NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
494686 | 2kyc | 16945 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 H SER 1 3.270 0.842 -0.575 2 HA SER 1 HA SER 1 0.812 -0.373 -0.880 3 HB2 SER 1 1HB SER 1 2.364 1.637 -2.393 4 HB3 SER 1 2HB SER 1 1.084 0.830 -3.300 5 HG SER 1 HG SER 1 -0.323 1.408 -1.512 6 H LEU 2 H LEU 2 3.312 -2.107 -1.296 7 HA LEU 2 HA LEU 2 3.264 -3.092 -3.939 8 HB2 LEU 2 1HB LEU 2 5.154 -3.512 -2.530 9 HB3 LEU 2 2HB LEU 2 4.149 -4.349 -1.349 10 HG LEU 2 HG LEU 2 3.713 -6.056 -3.211 11 HD11 LEU 2 1HD1 LEU 2 5.873 -4.390 -4.415 12 HD12 LEU 2 2HD1 LEU 2 4.461 -5.125 -5.174 13 HD13 LEU 2 3HD1 LEU 2 5.840 -6.127 -4.720 14 HD21 LEU 2 3HD2 LEU 2 6.115 -5.664 -1.546 15 HD22 LEU 2 1HD2 LEU 2 6.246 -6.873 -2.824 16 HD23 LEU 2 2HD2 LEU 2 4.978 -7.012 -1.605 17 H THR 3 H THR 3 1.695 -4.235 -0.963 18 HA THR 3 HA THR 3 -0.013 -5.973 -2.619 19 HB THR 3 HB THR 3 -0.347 -7.402 -0.743 20 HG1 THR 3 HG1 THR 3 0.749 -5.241 0.694 21 HG21 THR 3 3HG2 THR 3 2.456 -7.086 -0.103 22 HG22 THR 3 1HG2 THR 3 2.178 -6.953 -1.839 23 HG23 THR 3 2HG2 THR 3 1.643 -8.390 -0.967 24 H ASP 4 H ASP 4 -0.737 -3.370 -2.621 25 HA ASP 4 HA ASP 4 -2.590 -2.761 -0.512 26 HB2 ASP 4 1HB ASP 4 -1.463 -0.944 -1.658 27 HB3 ASP 4 2HB ASP 4 -2.124 -1.466 -3.205 28 H ILE 5 H ILE 5 -3.236 -2.916 -4.008 29 HA ILE 5 HA ILE 5 -5.968 -3.361 -3.790 30 HB ILE 5 HB ILE 5 -4.431 -2.859 -5.878 31 HG12 ILE 5 1HG1 ILE 5 -6.553 -4.350 -7.022 32 HG13 ILE 5 2HG1 ILE 5 -7.143 -3.713 -5.490 33 HG21 ILE 5 1HG2 ILE 5 -3.364 -5.112 -5.751 34 HG22 ILE 5 2HG2 ILE 5 -4.916 -5.813 -6.205 35 HG23 ILE 5 3HG2 ILE 5 -4.077 -4.734 -7.319 36 HD11 ILE 5 3HD1 ILE 5 -7.670 -2.163 -7.225 37 HD12 ILE 5 1HD1 ILE 5 -6.408 -1.459 -6.214 38 HD13 ILE 5 2HD1 ILE 5 -5.998 -2.147 -7.785 39 H LEU 6 H LEU 6 -3.329 -5.561 -3.408 40 HA LEU 6 HA LEU 6 -5.239 -7.797 -3.197 41 HB2 LEU 6 1HB LEU 6 -2.956 -7.581 -4.797 42 HB3 LEU 6 2HB LEU 6 -2.496 -8.642 -3.467 43 HG LEU 6 HG LEU 6 -4.538 -10.023 -4.030 44 HD11 LEU 6 1HD1 LEU 6 -4.626 -9.208 -6.784 45 HD12 LEU 6 2HD1 LEU 6 -5.068 -7.866 -5.729 46 HD13 LEU 6 3HD1 LEU 6 -5.943 -9.393 -5.626 47 HD21 LEU 6 3HD2 LEU 6 -3.138 -11.361 -5.129 48 HD22 LEU 6 1HD2 LEU 6 -1.961 -10.050 -5.037 49 HD23 LEU 6 2HD2 LEU 6 -2.979 -10.223 -6.468 50 H SER 7 H SER 7 -3.544 -9.631 -1.986 51 HA SER 7 HA SER 7 -2.989 -8.352 0.612 52 HB2 SER 7 1HB SER 7 -4.964 -10.183 0.159 53 HB3 SER 7 2HB SER 7 -3.631 -11.230 0.648 54 HG SER 7 HG SER 7 -5.083 -9.405 2.120 55 HA PRO 8 HA PRO 8 1.114 -9.903 0.213 56 HB2 PRO 8 1HB PRO 8 1.839 -9.819 2.828 57 HB3 PRO 8 2HB PRO 8 1.683 -8.370 1.828 58 HG2 PRO 8 1HG PRO 8 -0.251 -9.531 3.796 59 HG3 PRO 8 2HG PRO 8 0.210 -7.837 3.547 60 HD2 PRO 8 1HD PRO 8 -2.085 -8.882 2.562 61 HD3 PRO 8 2HD PRO 8 -1.191 -7.591 1.734 62 H SER 9 H SER 9 -1.339 -11.471 2.039 63 HA SER 9 HA SER 9 0.335 -13.796 2.603 64 HB2 SER 9 1HB SER 9 -1.310 -14.500 4.098 65 HB3 SER 9 2HB SER 9 -1.430 -12.745 4.218 66 HG SER 9 HG SER 9 -3.312 -12.784 3.206 67 H ASP 10 H ASP 10 -0.528 -12.959 -0.133 68 HA ASP 10 HA ASP 10 -1.786 -15.507 -0.903 69 HB2 ASP 10 1HB ASP 10 -2.261 -12.878 -2.316 70 HB3 ASP 10 2HB ASP 10 -3.069 -14.415 -2.615 71 H ILE 11 H ILE 11 0.420 -12.902 -1.723 72 HA ILE 11 HA ILE 11 1.296 -14.020 -4.194 73 HB ILE 11 HB ILE 11 2.652 -12.006 -2.397 74 HG12 ILE 11 1HG1 ILE 11 1.723 -10.795 -4.747 75 HG13 ILE 11 2HG1 ILE 11 0.411 -11.847 -4.226 76 HG21 ILE 11 1HG2 ILE 11 4.262 -13.066 -3.863 77 HG22 ILE 11 2HG2 ILE 11 3.223 -12.772 -5.257 78 HG23 ILE 11 3HG2 ILE 11 3.955 -11.415 -4.401 79 HD11 ILE 11 3HD1 ILE 11 1.091 -10.653 -1.890 80 HD12 ILE 11 1HD1 ILE 11 1.423 -9.368 -3.051 81 HD13 ILE 11 2HD1 ILE 11 -0.182 -10.095 -2.975 82 H ALA 12 H ALA 12 2.078 -14.583 -0.883 83 HA ALA 12 HA ALA 12 4.667 -15.720 -1.319 84 HB1 ALA 12 1HB ALA 12 4.642 -16.298 0.976 85 HB2 ALA 12 2HB ALA 12 3.829 -14.737 0.848 86 HB3 ALA 12 3HB ALA 12 2.882 -16.211 1.052 87 H ALA 13 H ALA 13 1.411 -16.876 -1.499 88 HA ALA 13 HA ALA 13 1.817 -19.619 -1.093 89 HB1 ALA 13 1HB ALA 13 -0.219 -18.117 -2.720 90 HB2 ALA 13 2HB ALA 13 -0.253 -19.870 -2.520 91 HB3 ALA 13 3HB ALA 13 -0.407 -18.819 -1.112 92 H ALA 14 H ALA 14 2.788 -17.580 -3.658 93 HA ALA 14 HA ALA 14 3.290 -19.899 -5.401 94 HB1 ALA 14 1HB ALA 14 1.966 -17.695 -6.100 95 HB2 ALA 14 2HB ALA 14 3.606 -17.152 -6.459 96 HB3 ALA 14 3HB ALA 14 2.968 -18.602 -7.234 97 H LEU 15 H LEU 15 4.757 -17.251 -3.681 98 HA LEU 15 HA LEU 15 7.310 -17.387 -4.926 99 HB2 LEU 15 1HB LEU 15 6.354 -16.247 -2.315 100 HB3 LEU 15 2HB LEU 15 8.041 -16.171 -2.818 101 HG LEU 15 HG LEU 15 5.706 -14.914 -4.259 102 HD11 LEU 15 1HD1 LEU 15 7.941 -13.365 -3.065 103 HD12 LEU 15 2HD1 LEU 15 6.690 -13.990 -1.990 104 HD13 LEU 15 3HD1 LEU 15 6.254 -12.913 -3.317 105 HD21 LEU 15 3HD2 LEU 15 7.422 -15.608 -5.822 106 HD22 LEU 15 1HD2 LEU 15 8.666 -14.841 -4.834 107 HD23 LEU 15 2HD2 LEU 15 7.447 -13.853 -5.640 108 H ARG 16 H ARG 16 5.717 -19.366 -2.667 109 HA ARG 16 HA ARG 16 8.269 -20.594 -1.854 110 HB2 ARG 16 1HB ARG 16 6.763 -19.659 -0.043 111 HB3 ARG 16 2HB ARG 16 5.611 -20.919 -0.465 112 HG2 ARG 16 1HG ARG 16 8.376 -21.791 0.101 113 HG3 ARG 16 2HG ARG 16 7.431 -21.189 1.465 114 HD2 ARG 16 1HD ARG 16 6.173 -23.151 -0.386 115 HD3 ARG 16 2HD ARG 16 7.376 -23.732 0.764 116 HE ARG 16 HE ARG 16 5.640 -22.218 2.249 117 HH11 ARG 16 1HH1 ARG 16 5.377 -24.997 0.169 118 HH12 ARG 16 2HH1 ARG 16 4.024 -25.668 1.018 119 HH21 ARG 16 1HH2 ARG 16 3.858 -23.090 3.375 120 HH22 ARG 16 2HH2 ARG 16 3.160 -24.582 2.841 121 H ASP 17 H ASP 17 5.285 -21.056 -3.500 122 HA ASP 17 HA ASP 17 5.567 -23.959 -3.541 123 HB2 ASP 17 1HB ASP 17 3.326 -22.812 -3.260 124 HB3 ASP 17 2HB ASP 17 3.468 -22.297 -4.939 125 H CYS 18 H CYS 18 6.374 -21.221 -5.421 126 HA CYS 18 HA CYS 18 6.916 -22.934 -7.755 127 HB2 CYS 18 1HB CYS 18 6.668 -19.924 -7.770 128 HB3 CYS 18 2HB CYS 18 6.719 -21.002 -9.160 129 HG CYS 18 HG CYS 18 4.176 -21.122 -9.398 130 H GLN 19 H GLN 19 8.557 -22.422 -5.297 131 HA GLN 19 HA GLN 19 10.720 -20.740 -5.861 132 HB2 GLN 19 1HB GLN 19 10.221 -23.014 -4.023 133 HB3 GLN 19 2HB GLN 19 11.904 -22.609 -4.334 134 HG2 GLN 19 1HG GLN 19 11.355 -20.250 -3.694 135 HG3 GLN 19 2HG GLN 19 9.774 -20.833 -3.179 136 HE21 GLN 19 2HE2 GLN 19 10.138 -20.253 -1.045 137 HE22 GLN 19 1HE2 GLN 19 11.221 -21.127 -0.022 138 H ALA 20 H ALA 20 9.897 -23.858 -7.085 139 HA ALA 20 HA ALA 20 12.410 -24.823 -7.843 140 HB1 ALA 20 1HB ALA 20 11.129 -26.524 -8.458 141 HB2 ALA 20 2HB ALA 20 9.686 -25.523 -8.289 142 HB3 ALA 20 3HB ALA 20 10.545 -25.579 -9.829 143 HA PRO 21 HA PRO 21 13.723 -22.398 -11.257 144 HB2 PRO 21 1HB PRO 21 14.737 -24.264 -12.948 145 HB3 PRO 21 2HB PRO 21 15.533 -23.803 -11.438 146 HG2 PRO 21 1HG PRO 21 13.800 -26.174 -12.019 147 HG3 PRO 21 2HG PRO 21 15.313 -26.092 -11.097 148 HD2 PRO 21 1HD PRO 21 12.884 -26.175 -9.904 149 HD3 PRO 21 2HD PRO 21 14.263 -25.306 -9.202 150 H ASP 22 H ASP 22 12.730 -21.447 -12.923 151 HA ASP 22 HA ASP 22 11.258 -21.039 -14.610 152 HB2 ASP 22 1HB ASP 22 12.775 -22.740 -15.705 153 HB3 ASP 22 2HB ASP 22 11.571 -23.962 -15.305 154 H SER 23 H SER 23 10.317 -22.141 -11.982 155 HA SER 23 HA SER 23 7.789 -23.380 -12.814 156 HB2 SER 23 1HB SER 23 9.299 -23.306 -10.218 157 HB3 SER 23 2HB SER 23 7.572 -23.661 -10.230 158 HG SER 23 HG SER 23 8.070 -25.602 -10.824 159 H PHE 24 H PHE 24 9.156 -20.505 -11.453 160 HA PHE 24 HA PHE 24 6.528 -19.465 -10.712 161 HB2 PHE 24 1HB PHE 24 8.215 -19.042 -9.072 162 HB3 PHE 24 2HB PHE 24 9.331 -18.427 -10.288 163 HD1 PHE 24 HD1 PHE 24 6.381 -17.688 -8.261 164 HD2 PHE 24 HD2 PHE 24 9.107 -16.191 -11.166 165 HE1 PHE 24 HE1 PHE 24 5.568 -15.404 -7.841 166 HE2 PHE 24 HE2 PHE 24 8.299 -13.905 -10.751 167 HZ PHE 24 HZ PHE 24 6.528 -13.508 -9.086 168 H SER 25 H SER 25 5.403 -18.140 -11.977 169 HA SER 25 HA SER 25 6.770 -16.491 -13.957 170 HB2 SER 25 1HB SER 25 4.369 -17.851 -15.014 171 HB3 SER 25 2HB SER 25 5.888 -17.454 -15.818 172 HG SER 25 HG SER 25 6.802 -19.276 -15.007 173 HA PRO 26 HA PRO 26 3.728 -13.487 -12.978 174 HB2 PRO 26 1HB PRO 26 3.314 -12.272 -15.370 175 HB3 PRO 26 2HB PRO 26 4.799 -12.067 -14.433 176 HG2 PRO 26 1HG PRO 26 4.268 -13.855 -16.775 177 HG3 PRO 26 2HG PRO 26 5.688 -12.848 -16.435 178 HD2 PRO 26 1HD PRO 26 5.651 -15.516 -15.976 179 HD3 PRO 26 2HD PRO 26 6.587 -14.387 -14.975 180 H LYS 27 H LYS 27 3.005 -15.456 -15.831 181 HA LYS 27 HA LYS 27 0.147 -14.967 -15.513 182 HB2 LYS 27 1HB LYS 27 1.396 -15.031 -17.766 183 HB3 LYS 27 2HB LYS 27 1.408 -16.777 -17.560 184 HG2 LYS 27 1HG LYS 27 -1.170 -16.418 -17.182 185 HG3 LYS 27 2HG LYS 27 -0.866 -14.943 -18.104 186 HD2 LYS 27 1HD LYS 27 -0.169 -17.744 -18.987 187 HD3 LYS 27 2HD LYS 27 -1.550 -16.802 -19.553 188 HE2 LYS 27 1HE LYS 27 0.208 -15.040 -20.220 189 HE3 LYS 27 2HE LYS 27 1.374 -16.350 -20.046 190 HZ1 LYS 27 3HZ LYS 27 0.309 -17.582 -21.737 191 HZ2 LYS 27 1HZ LYS 27 0.467 -16.008 -22.337 192 HZ3 LYS 27 2HZ LYS 27 -1.030 -16.549 -21.767 193 H LYS 28 H LYS 28 1.619 -16.460 -13.489 194 HA LYS 28 HA LYS 28 0.047 -18.939 -13.596 195 HB2 LYS 28 1HB LYS 28 2.388 -19.473 -14.167 196 HB3 LYS 28 2HB LYS 28 2.916 -18.743 -12.656 197 HG2 LYS 28 1HG LYS 28 2.899 -20.982 -12.133 198 HG3 LYS 28 2HG LYS 28 1.312 -20.462 -11.560 199 HD2 LYS 28 1HD LYS 28 0.390 -21.198 -13.784 200 HD3 LYS 28 2HD LYS 28 1.966 -21.920 -14.116 201 HE2 LYS 28 1HE LYS 28 1.724 -23.265 -12.044 202 HE3 LYS 28 2HE LYS 28 0.100 -22.607 -11.848 203 HZ1 LYS 28 3HZ LYS 28 0.532 -24.880 -13.070 204 HZ2 LYS 28 1HZ LYS 28 0.758 -23.864 -14.404 205 HZ3 LYS 28 2HZ LYS 28 -0.707 -23.837 -13.560 206 H PHE 29 H PHE 29 1.810 -16.602 -11.619 207 HA PHE 29 HA PHE 29 0.651 -17.564 -9.161 208 HB2 PHE 29 1HB PHE 29 2.043 -16.068 -8.072 209 HB3 PHE 29 2HB PHE 29 2.950 -16.362 -9.552 210 HD1 PHE 29 HD2 PHE 29 2.485 -14.702 -11.508 211 HD2 PHE 29 HD1 PHE 29 1.616 -13.903 -7.418 212 HE1 PHE 29 HE2 PHE 29 2.495 -12.287 -11.980 213 HE2 PHE 29 HE1 PHE 29 1.624 -11.487 -7.884 214 HZ PHE 29 HZ PHE 29 2.066 -10.676 -10.168 215 H PHE 30 H PHE 30 -0.227 -15.367 -11.627 216 HA PHE 30 HA PHE 30 -1.718 -13.456 -10.278 217 HB2 PHE 30 1HB PHE 30 -2.786 -12.996 -12.338 218 HB3 PHE 30 2HB PHE 30 -1.185 -13.585 -12.771 219 HD1 PHE 30 HD1 PHE 30 -1.073 -16.211 -13.139 220 HD2 PHE 30 HD2 PHE 30 -4.586 -13.832 -13.482 221 HE1 PHE 30 HE1 PHE 30 -2.093 -17.930 -14.573 222 HE2 PHE 30 HE2 PHE 30 -5.612 -15.549 -14.916 223 HZ PHE 30 HZ PHE 30 -4.366 -17.601 -15.462 224 H GLN 31 H GLN 31 -2.508 -16.773 -11.078 225 HA GLN 31 HA GLN 31 -5.267 -16.504 -10.261 226 HB2 GLN 31 1HB GLN 31 -5.574 -18.672 -11.014 227 HB3 GLN 31 2HB GLN 31 -4.263 -18.115 -12.045 228 HG2 GLN 31 1HG GLN 31 -2.756 -19.152 -10.178 229 HG3 GLN 31 2HG GLN 31 -4.213 -20.070 -9.803 230 HE21 GLN 31 2HE2 GLN 31 -1.419 -20.308 -11.349 231 HE22 GLN 31 1HE2 GLN 31 -1.848 -21.369 -12.643 232 H ILE 32 H ILE 32 -2.275 -17.116 -8.755 233 HA ILE 32 HA ILE 32 -3.426 -18.560 -6.510 234 HB ILE 32 HB ILE 32 -0.612 -17.598 -7.030 235 HG12 ILE 32 1HG1 ILE 32 -1.322 -20.468 -6.741 236 HG13 ILE 32 2HG1 ILE 32 -1.854 -19.665 -8.214 237 HG21 ILE 32 1HG2 ILE 32 -0.471 -17.659 -4.779 238 HG22 ILE 32 2HG2 ILE 32 -1.894 -18.686 -4.611 239 HG23 ILE 32 3HG2 ILE 32 -0.341 -19.397 -5.047 240 HD11 ILE 32 3HD1 ILE 32 0.957 -19.237 -7.441 241 HD12 ILE 32 1HD1 ILE 32 0.518 -20.866 -7.958 242 HD13 ILE 32 2HD1 ILE 32 0.237 -19.494 -9.030 243 H SER 33 H SER 33 -1.504 -15.572 -6.863 244 HA SER 33 HA SER 33 -1.993 -14.592 -4.291 245 HB2 SER 33 1HB SER 33 -1.335 -12.371 -5.251 246 HB3 SER 33 2HB SER 33 -0.202 -13.670 -5.622 247 HG SER 33 HG SER 33 -0.880 -12.230 -7.410 248 H GLY 34 H GLY 34 -3.405 -13.288 -7.301 249 HA2 GLY 34 1HA GLY 34 -6.047 -13.438 -6.879 250 HA3 GLY 34 2HA GLY 34 -5.597 -12.143 -5.780 251 H MET 35 H MET 35 -4.066 -12.737 -8.886 252 HA MET 35 HA MET 35 -4.993 -10.095 -9.762 253 HB2 MET 35 1HB MET 35 -2.708 -11.818 -10.732 254 HB3 MET 35 2HB MET 35 -3.152 -10.269 -11.437 255 HG2 MET 35 1HG MET 35 -2.863 -9.409 -8.987 256 HG3 MET 35 2HG MET 35 -1.887 -10.866 -8.810 257 HE1 MET 35 3HE MET 35 -0.904 -10.153 -12.496 258 HE2 MET 35 1HE MET 35 0.637 -10.469 -11.698 259 HE3 MET 35 2HE MET 35 -0.779 -11.441 -11.297 260 H SER 36 H SER 36 -5.997 -13.154 -10.042 261 HA SER 36 HA SER 36 -6.419 -13.320 -12.883 262 HB2 SER 36 1HB SER 36 -8.043 -15.220 -12.019 263 HB3 SER 36 2HB SER 36 -6.294 -15.444 -11.984 264 HG SER 36 HG SER 36 -7.987 -15.515 -9.951 265 H LYS 37 H LYS 37 -7.848 -11.563 -10.448 266 HA LYS 37 HA LYS 37 -10.445 -11.482 -11.833 267 HB2 LYS 37 1HB LYS 37 -9.878 -10.447 -9.058 268 HB3 LYS 37 2HB LYS 37 -11.445 -10.739 -9.800 269 HG2 LYS 37 1HG LYS 37 -11.090 -13.116 -9.736 270 HG3 LYS 37 2HG LYS 37 -9.442 -12.889 -9.145 271 HD2 LYS 37 1HD LYS 37 -10.776 -11.512 -7.271 272 HD3 LYS 37 2HD LYS 37 -12.025 -12.678 -7.716 273 HE2 LYS 37 1HE LYS 37 -10.826 -13.667 -5.942 274 HE3 LYS 37 2HE LYS 37 -10.266 -14.473 -7.407 275 HZ1 LYS 37 3HZ LYS 37 -8.784 -12.128 -6.470 276 HZ2 LYS 37 1HZ LYS 37 -8.224 -13.510 -7.271 277 HZ3 LYS 37 2HZ LYS 37 -8.591 -13.578 -5.621 278 H LYS 38 H LYS 38 -7.657 -9.955 -11.983 279 HA LYS 38 HA LYS 38 -8.193 -7.240 -11.522 280 HB2 LYS 38 1HB LYS 38 -6.337 -8.444 -13.584 281 HB3 LYS 38 2HB LYS 38 -6.279 -6.793 -12.979 282 HG2 LYS 38 1HG LYS 38 -6.000 -9.133 -11.131 283 HG3 LYS 38 2HG LYS 38 -4.621 -8.496 -12.030 284 HD2 LYS 38 1HD LYS 38 -4.489 -7.336 -10.029 285 HD3 LYS 38 2HD LYS 38 -5.370 -6.207 -11.061 286 HE2 LYS 38 1HE LYS 38 -7.082 -6.216 -9.648 287 HE3 LYS 38 2HE LYS 38 -7.237 -7.964 -9.812 288 HZ1 LYS 38 3HZ LYS 38 -5.046 -7.293 -8.137 289 HZ2 LYS 38 1HZ LYS 38 -6.399 -8.250 -7.795 290 HZ3 LYS 38 2HZ LYS 38 -6.467 -6.576 -7.564 291 H SER 39 H SER 39 -7.760 -5.799 -13.750 292 HA SER 39 HA SER 39 -9.313 -6.543 -15.997 293 HB2 SER 39 1HB SER 39 -10.680 -5.110 -13.780 294 HB3 SER 39 2HB SER 39 -11.014 -4.549 -15.418 295 HG SER 39 HG SER 39 -11.368 -6.918 -15.832 296 H SER 40 H SER 40 -6.766 -5.369 -15.422 297 HA SER 40 HA SER 40 -5.376 -3.740 -16.189 298 HB2 SER 40 1HB SER 40 -7.709 -3.551 -18.047 299 HB3 SER 40 2HB SER 40 -6.476 -2.293 -18.115 300 HG SER 40 HG SER 40 -6.108 -4.129 -19.523 301 H SER 41 H SER 41 -7.509 -3.211 -14.071 302 HA SER 41 HA SER 41 -7.283 -0.273 -14.115 303 HB2 SER 41 1HB SER 41 -9.635 -1.190 -14.434 304 HB3 SER 41 2HB SER 41 -9.528 -1.791 -12.779 305 HG SER 41 HG SER 41 -10.408 0.181 -12.555 306 H GLN 42 H GLN 42 -6.319 -3.064 -12.626 307 HA GLN 42 HA GLN 42 -5.790 -1.645 -10.099 308 HB2 GLN 42 1HB GLN 42 -6.242 -4.615 -10.437 309 HB3 GLN 42 2HB GLN 42 -5.915 -3.780 -8.924 310 HG2 GLN 42 1HG GLN 42 -8.093 -3.568 -8.636 311 HG3 GLN 42 2HG GLN 42 -8.129 -2.485 -10.026 312 HE21 GLN 42 2HE2 GLN 42 -7.515 -4.335 -12.026 313 HE22 GLN 42 1HE2 GLN 42 -8.846 -5.424 -12.194 314 H LEU 43 H LEU 43 -4.558 -3.468 -12.736 315 HA LEU 43 HA LEU 43 -2.192 -4.501 -11.712 316 HB2 LEU 43 1HB LEU 43 -2.491 -3.276 -14.444 317 HB3 LEU 43 2HB LEU 43 -1.377 -4.551 -13.954 318 HG LEU 43 HG LEU 43 -4.360 -4.752 -14.319 319 HD11 LEU 43 1HD1 LEU 43 -2.317 -5.033 -16.123 320 HD12 LEU 43 2HD1 LEU 43 -3.921 -5.751 -16.266 321 HD13 LEU 43 3HD1 LEU 43 -2.592 -6.692 -15.589 322 HD21 LEU 43 3HD2 LEU 43 -4.393 -6.367 -12.795 323 HD22 LEU 43 1HD2 LEU 43 -2.653 -6.225 -12.540 324 HD23 LEU 43 2HD2 LEU 43 -3.275 -7.285 -13.805 325 H LYS 44 H LYS 44 -2.325 -1.540 -13.689 326 HA LYS 44 HA LYS 44 0.184 -0.587 -12.890 327 HB2 LYS 44 1HB LYS 44 -0.282 1.302 -14.143 328 HB3 LYS 44 2HB LYS 44 -1.377 0.127 -14.860 329 HG2 LYS 44 1HG LYS 44 -2.209 2.039 -12.696 330 HG3 LYS 44 2HG LYS 44 -2.346 2.399 -14.418 331 HD2 LYS 44 1HD LYS 44 -3.547 -0.070 -13.190 332 HD3 LYS 44 2HD LYS 44 -4.417 1.465 -13.266 333 HE2 LYS 44 1HE LYS 44 -5.129 0.694 -15.254 334 HE3 LYS 44 2HE LYS 44 -3.551 1.235 -15.824 335 HZ1 LYS 44 3HZ LYS 44 -3.909 -1.491 -14.755 336 HZ2 LYS 44 1HZ LYS 44 -2.718 -0.910 -15.807 337 HZ3 LYS 44 2HZ LYS 44 -4.299 -1.139 -16.363 338 H GLU 45 H GLU 45 -2.843 -0.544 -11.282 339 HA GLU 45 HA GLU 45 -2.778 1.715 -9.723 340 HB2 GLU 45 1HB GLU 45 -4.488 -0.239 -9.800 341 HB3 GLU 45 2HB GLU 45 -3.508 -0.937 -8.518 342 HG2 GLU 45 1HG GLU 45 -4.985 0.178 -7.230 343 HG3 GLU 45 2HG GLU 45 -3.836 1.490 -7.485 344 H ILE 46 H ILE 46 -1.168 -1.385 -9.070 345 HA ILE 46 HA ILE 46 0.147 -0.313 -6.724 346 HB ILE 46 HB ILE 46 0.660 -2.966 -8.066 347 HG12 ILE 46 1HG1 ILE 46 -0.879 -3.506 -5.863 348 HG13 ILE 46 2HG1 ILE 46 -1.609 -2.018 -6.455 349 HG21 ILE 46 1HG2 ILE 46 0.934 -2.975 -5.227 350 HG22 ILE 46 2HG2 ILE 46 2.153 -3.291 -6.460 351 HG23 ILE 46 3HG2 ILE 46 1.880 -1.644 -5.893 352 HD11 ILE 46 3HD1 ILE 46 -1.770 -4.709 -7.499 353 HD12 ILE 46 1HD1 ILE 46 -2.785 -3.304 -7.824 354 HD13 ILE 46 2HD1 ILE 46 -1.290 -3.542 -8.731 355 H PHE 47 H PHE 47 0.806 -0.676 -10.084 356 HA PHE 47 HA PHE 47 2.738 -0.498 -11.327 357 HB2 PHE 47 1HB PHE 47 3.912 1.685 -10.836 358 HB3 PHE 47 2HB PHE 47 2.173 1.808 -11.078 359 HD1 PHE 47 HD1 PHE 47 0.692 2.338 -9.239 360 HD2 PHE 47 HD2 PHE 47 4.901 2.070 -8.670 361 HE1 PHE 47 HE1 PHE 47 0.468 3.476 -7.069 362 HE2 PHE 47 HE2 PHE 47 4.684 3.207 -6.499 363 HZ PHE 47 HZ PHE 47 2.465 3.911 -5.696 364 H ARG 48 H ARG 48 3.131 -2.405 -9.351 365 HA ARG 48 HA ARG 48 6.005 -2.122 -8.919 366 HB2 ARG 48 1HB ARG 48 3.947 -2.389 -6.789 367 HB3 ARG 48 2HB ARG 48 5.430 -3.314 -6.598 368 HG2 ARG 48 1HG ARG 48 6.479 -0.926 -7.204 369 HG3 ARG 48 2HG ARG 48 4.974 -0.406 -6.444 370 HD2 ARG 48 1HD ARG 48 6.350 -2.534 -4.991 371 HD3 ARG 48 2HD ARG 48 7.293 -1.051 -5.129 372 HE ARG 48 HE ARG 48 4.901 -1.451 -3.581 373 HH11 ARG 48 1HH1 ARG 48 6.945 0.883 -5.160 374 HH12 ARG 48 2HH1 ARG 48 6.423 2.205 -4.169 375 HH21 ARG 48 1HH2 ARG 48 4.205 0.281 -2.270 376 HH22 ARG 48 2HH2 ARG 48 4.864 1.861 -2.525 377 H ILE 49 H ILE 49 3.862 -3.753 -10.466 378 HA ILE 49 HA ILE 49 4.973 -6.404 -9.809 379 HB ILE 49 HB ILE 49 2.933 -7.394 -10.765 380 HG12 ILE 49 1HG1 ILE 49 2.509 -5.193 -12.130 381 HG13 ILE 49 2HG1 ILE 49 1.148 -6.168 -11.587 382 HG21 ILE 49 1HG2 ILE 49 2.600 -5.455 -8.491 383 HG22 ILE 49 2HG2 ILE 49 1.364 -6.629 -8.940 384 HG23 ILE 49 3HG2 ILE 49 2.953 -7.181 -8.410 385 HD11 ILE 49 3HD1 ILE 49 0.440 -4.606 -10.118 386 HD12 ILE 49 1HD1 ILE 49 2.070 -4.031 -9.768 387 HD13 ILE 49 2HD1 ILE 49 1.261 -3.537 -11.256 388 H LEU 50 H LEU 50 4.570 -3.981 -12.191 389 HA LEU 50 HA LEU 50 5.187 -5.772 -14.404 390 HB2 LEU 50 1HB LEU 50 5.020 -2.791 -14.611 391 HB3 LEU 50 2HB LEU 50 4.681 -4.010 -15.838 392 HG LEU 50 HG LEU 50 2.934 -3.727 -13.417 393 HD11 LEU 50 1HD1 LEU 50 3.091 -1.512 -14.453 394 HD12 LEU 50 2HD1 LEU 50 1.495 -2.228 -14.671 395 HD13 LEU 50 3HD1 LEU 50 2.644 -2.213 -16.008 396 HD21 LEU 50 3HD2 LEU 50 1.296 -4.787 -14.797 397 HD22 LEU 50 1HD2 LEU 50 2.785 -5.727 -14.904 398 HD23 LEU 50 2HD2 LEU 50 2.328 -4.647 -16.222 399 H ASP 51 H ASP 51 6.529 -2.664 -13.273 400 HA ASP 51 HA ASP 51 9.214 -3.719 -13.340 401 HB2 ASP 51 1HB ASP 51 9.918 -1.780 -14.909 402 HB3 ASP 51 2HB ASP 51 9.214 -3.228 -15.624 403 H ASN 52 H ASN 52 10.729 -2.380 -12.299 404 HA ASN 52 HA ASN 52 9.498 -0.375 -10.565 405 HB2 ASN 52 1HB ASN 52 10.880 -2.267 -9.621 406 HB3 ASN 52 2HB ASN 52 12.287 -1.523 -10.375 407 HD21 ASN 52 2HD2 ASN 52 13.422 -0.248 -9.118 408 HD22 ASN 52 1HD2 ASN 52 12.837 0.612 -7.738 409 H ASP 53 H ASP 53 9.894 0.367 -13.255 410 HA ASP 53 HA ASP 53 11.826 2.546 -12.887 411 HB2 ASP 53 1HB ASP 53 11.679 0.596 -15.158 412 HB3 ASP 53 2HB ASP 53 12.220 2.245 -15.463 413 H GLN 54 H GLN 54 9.159 1.297 -14.876 414 HA GLN 54 HA GLN 54 7.464 2.343 -15.984 415 HB2 GLN 54 1HB GLN 54 7.447 3.182 -13.336 416 HB3 GLN 54 2HB GLN 54 7.295 4.676 -14.251 417 HG2 GLN 54 1HG GLN 54 5.116 3.801 -13.699 418 HG3 GLN 54 2HG GLN 54 5.372 3.749 -15.442 419 HE21 GLN 54 2HE2 GLN 54 4.960 1.905 -12.547 420 HE22 GLN 54 1HE2 GLN 54 4.782 0.362 -13.303 421 H SER 55 H SER 55 10.113 3.011 -16.846 422 HA SER 55 HA SER 55 9.963 5.853 -17.513 423 HB2 SER 55 1HB SER 55 12.233 5.755 -18.040 424 HB3 SER 55 2HB SER 55 12.103 4.578 -16.733 425 HG SER 55 HG SER 55 12.955 3.256 -18.121 426 H GLY 56 H GLY 56 9.377 2.751 -18.881 427 HA2 GLY 56 1HA GLY 56 8.016 3.641 -21.106 428 HA3 GLY 56 2HA GLY 56 9.685 3.469 -21.627 429 H PHE 57 H PHE 57 10.697 1.300 -21.002 430 HA PHE 57 HA PHE 57 8.704 -0.839 -21.370 431 HB2 PHE 57 1HB PHE 57 11.495 -0.805 -22.532 432 HB3 PHE 57 2HB PHE 57 10.245 -2.011 -22.818 433 HD1 PHE 57 HD2 PHE 57 8.380 -1.547 -24.289 434 HD2 PHE 57 HD1 PHE 57 11.421 1.352 -23.608 435 HE1 PHE 57 HE2 PHE 57 7.595 -0.269 -26.239 436 HE2 PHE 57 HE1 PHE 57 10.640 2.635 -25.556 437 HZ PHE 57 HZ PHE 57 8.725 1.824 -26.876 438 H ILE 58 H ILE 58 10.284 -3.033 -21.141 439 HA ILE 58 HA ILE 58 11.580 -2.765 -18.511 440 HB ILE 58 HB ILE 58 9.883 -5.135 -19.276 441 HG12 ILE 58 1HG1 ILE 58 9.111 -2.767 -17.558 442 HG13 ILE 58 2HG1 ILE 58 8.477 -3.111 -19.163 443 HG21 ILE 58 1HG2 ILE 58 11.114 -4.197 -16.693 444 HG22 ILE 58 2HG2 ILE 58 9.939 -5.506 -16.804 445 HG23 ILE 58 3HG2 ILE 58 11.503 -5.656 -17.603 446 HD11 ILE 58 3HD1 ILE 58 7.849 -5.408 -18.007 447 HD12 ILE 58 1HD1 ILE 58 7.872 -4.391 -16.567 448 HD13 ILE 58 2HD1 ILE 58 6.807 -3.988 -17.914 449 H GLU 59 H GLU 59 13.199 -4.328 -18.036 450 HA GLU 59 HA GLU 59 14.133 -5.929 -20.312 451 HB2 GLU 59 1HB GLU 59 15.334 -3.669 -20.080 452 HB3 GLU 59 2HB GLU 59 16.051 -4.341 -18.622 453 HG2 GLU 59 1HG GLU 59 17.480 -4.527 -20.637 454 HG3 GLU 59 2HG GLU 59 17.131 -6.068 -19.857 455 H GLU 60 H GLU 60 15.843 -7.512 -19.644 456 HA GLU 60 HA GLU 60 14.931 -9.120 -17.551 457 HB2 GLU 60 1HB GLU 60 16.953 -10.441 -17.891 458 HB3 GLU 60 2HB GLU 60 16.252 -9.976 -19.435 459 HG2 GLU 60 1HG GLU 60 17.903 -8.090 -19.504 460 HG3 GLU 60 2HG GLU 60 18.677 -8.814 -18.096 461 H ASP 61 H ASP 61 17.022 -6.398 -17.524 462 HA ASP 61 HA ASP 61 18.411 -7.008 -15.104 463 HB2 ASP 61 1HB ASP 61 19.181 -5.388 -16.892 464 HB3 ASP 61 2HB ASP 61 17.965 -4.266 -16.287 465 H GLU 62 H GLU 62 15.237 -6.214 -15.714 466 HA GLU 62 HA GLU 62 14.897 -5.063 -13.022 467 HB2 GLU 62 1HB GLU 62 13.630 -4.440 -15.623 468 HB3 GLU 62 2HB GLU 62 12.555 -4.467 -14.232 469 HG2 GLU 62 1HG GLU 62 13.489 -2.628 -13.292 470 HG3 GLU 62 2HG GLU 62 15.088 -2.963 -13.955 471 H LEU 63 H LEU 63 14.953 -7.920 -14.103 472 HA LEU 63 HA LEU 63 12.351 -8.750 -12.995 473 HB2 LEU 63 1HB LEU 63 13.965 -10.442 -14.866 474 HB3 LEU 63 2HB LEU 63 12.253 -10.561 -14.465 475 HG LEU 63 HG LEU 63 13.520 -8.404 -16.153 476 HD11 LEU 63 1HD1 LEU 63 11.515 -10.180 -17.326 477 HD12 LEU 63 2HD1 LEU 63 13.024 -10.981 -16.888 478 HD13 LEU 63 3HD1 LEU 63 13.045 -9.599 -17.983 479 HD21 LEU 63 3HD2 LEU 63 11.591 -7.281 -16.096 480 HD22 LEU 63 1HD2 LEU 63 11.214 -8.244 -14.667 481 HD23 LEU 63 2HD2 LEU 63 10.629 -8.752 -16.251 482 H LYS 64 H LYS 64 15.751 -9.700 -13.393 483 HA LYS 64 HA LYS 64 15.910 -11.904 -11.799 484 HB2 LYS 64 1HB LYS 64 17.893 -9.623 -11.890 485 HB3 LYS 64 2HB LYS 64 18.235 -11.242 -11.295 486 HG2 LYS 64 1HG LYS 64 17.997 -12.184 -13.455 487 HG3 LYS 64 2HG LYS 64 17.311 -10.691 -14.102 488 HD2 LYS 64 1HD LYS 64 19.431 -9.550 -13.783 489 HD3 LYS 64 2HD LYS 64 20.123 -10.999 -13.050 490 HE2 LYS 64 1HE LYS 64 20.756 -10.664 -15.435 491 HE3 LYS 64 2HE LYS 64 19.955 -12.202 -15.112 492 HZ1 LYS 64 3HZ LYS 64 18.482 -9.826 -16.087 493 HZ2 LYS 64 1HZ LYS 64 17.974 -11.440 -16.079 494 HZ3 LYS 64 2HZ LYS 64 19.193 -10.943 -17.140 495 H TYR 65 H TYR 65 15.670 -8.550 -10.764 496 HA TYR 65 HA TYR 65 15.669 -9.425 -7.959 497 HB2 TYR 65 1HB TYR 65 15.958 -6.650 -9.128 498 HB3 TYR 65 2HB TYR 65 15.995 -7.038 -7.412 499 HD1 TYR 65 HD2 TYR 65 17.757 -7.684 -10.621 500 HD2 TYR 65 HD1 TYR 65 18.006 -7.639 -6.373 501 HE1 TYR 65 HE2 TYR 65 20.183 -8.061 -10.764 502 HE2 TYR 65 HE1 TYR 65 20.433 -8.015 -6.505 503 HH TYR 65 HH TYR 65 22.058 -8.995 -8.141 504 H PHE 66 H PHE 66 13.413 -10.126 -9.273 505 HA PHE 66 HA PHE 66 11.403 -8.065 -8.816 506 HB2 PHE 66 1HB PHE 66 11.384 -9.513 -10.877 507 HB3 PHE 66 2HB PHE 66 10.988 -10.878 -9.839 508 HD1 PHE 66 HD2 PHE 66 8.810 -11.040 -8.771 509 HD2 PHE 66 HD1 PHE 66 9.764 -7.808 -11.371 510 HE1 PHE 66 HE2 PHE 66 6.422 -10.476 -8.941 511 HE2 PHE 66 HE1 PHE 66 7.377 -7.239 -11.545 512 HZ PHE 66 HZ PHE 66 5.702 -8.574 -10.330 513 H LEU 67 H LEU 67 11.738 -11.515 -7.961 514 HA LEU 67 HA LEU 67 9.762 -11.642 -6.042 515 HB2 LEU 67 1HB LEU 67 12.400 -13.090 -5.904 516 HB3 LEU 67 2HB LEU 67 10.874 -13.589 -5.176 517 HG LEU 67 HG LEU 67 11.595 -13.568 -8.101 518 HD11 LEU 67 1HD1 LEU 67 12.437 -15.470 -6.844 519 HD12 LEU 67 2HD1 LEU 67 11.136 -15.966 -7.926 520 HD13 LEU 67 3HD1 LEU 67 10.824 -15.778 -6.200 521 HD21 LEU 67 3HD2 LEU 67 9.438 -13.187 -8.514 522 HD22 LEU 67 1HD2 LEU 67 9.002 -13.354 -6.813 523 HD23 LEU 67 2HD2 LEU 67 9.130 -14.786 -7.835 524 H GLN 68 H GLN 68 12.974 -10.307 -5.803 525 HA GLN 68 HA GLN 68 13.376 -10.245 -3.072 526 HB2 GLN 68 1HB GLN 68 14.551 -9.059 -5.331 527 HB3 GLN 68 2HB GLN 68 14.166 -7.729 -4.247 528 HG2 GLN 68 1HG GLN 68 15.742 -8.307 -2.768 529 HG3 GLN 68 2HG GLN 68 15.426 -10.031 -2.949 530 HE21 GLN 68 2HE2 GLN 68 16.090 -10.865 -5.203 531 HE22 GLN 68 1HE2 GLN 68 17.660 -10.379 -5.736 532 H ARG 69 H ARG 69 11.186 -8.366 -5.018 533 HA ARG 69 HA ARG 69 10.674 -6.274 -3.204 534 HB2 ARG 69 1HB ARG 69 9.062 -7.489 -5.438 535 HB3 ARG 69 2HB ARG 69 8.446 -6.155 -4.471 536 HG2 ARG 69 1HG ARG 69 11.127 -5.903 -5.742 537 HG3 ARG 69 2HG ARG 69 9.677 -5.712 -6.730 538 HD2 ARG 69 1HD ARG 69 10.032 -3.545 -6.061 539 HD3 ARG 69 2HD ARG 69 8.942 -4.109 -4.795 540 HE ARG 69 HE ARG 69 11.637 -4.540 -4.048 541 HH11 ARG 69 1HH1 ARG 69 9.257 -2.025 -4.405 542 HH12 ARG 69 2HH1 ARG 69 9.968 -1.001 -3.202 543 HH21 ARG 69 1HH2 ARG 69 12.583 -3.201 -2.462 544 HH22 ARG 69 2HH2 ARG 69 11.860 -1.671 -2.098 545 H PHE 70 H PHE 70 8.360 -8.857 -3.999 546 HA PHE 70 HA PHE 70 6.872 -8.550 -1.636 547 HB2 PHE 70 1HB PHE 70 7.061 -10.947 -3.473 548 HB3 PHE 70 2HB PHE 70 5.812 -10.694 -2.258 549 HD1 PHE 70 HD2 PHE 70 7.129 -9.581 -5.494 550 HD2 PHE 70 HD1 PHE 70 4.016 -9.155 -2.623 551 HE1 PHE 70 HE2 PHE 70 5.781 -8.350 -7.143 552 HE2 PHE 70 HE1 PHE 70 2.663 -7.923 -4.268 553 HZ PHE 70 HZ PHE 70 3.545 -7.518 -6.531 554 H GLU 71 H GLU 71 9.143 -11.143 -2.554 555 HA GLU 71 HA GLU 71 9.127 -12.606 -0.230 556 HB2 GLU 71 1HB GLU 71 10.428 -12.960 -2.456 557 HB3 GLU 71 2HB GLU 71 11.716 -12.077 -1.650 558 HG2 GLU 71 1HG GLU 71 12.014 -14.482 -1.447 559 HG3 GLU 71 2HG GLU 71 11.771 -13.726 0.126 560 H SER 72 H SER 72 10.779 -12.740 1.491 561 HA SER 72 HA SER 72 10.945 -10.326 2.925 562 HB2 SER 72 1HB SER 72 11.065 -12.834 3.720 563 HB3 SER 72 2HB SER 72 12.802 -12.599 3.524 564 HG SER 72 HG SER 72 12.794 -11.102 5.097 565 H GLY 73 H GLY 73 13.395 -12.149 1.110 566 HA2 GLY 73 1HA GLY 73 14.812 -9.769 0.422 567 HA3 GLY 73 2HA GLY 73 15.645 -10.663 1.685 568 H ALA 74 H ALA 74 14.054 -11.303 -1.442 569 HA ALA 74 HA ALA 74 15.377 -13.658 -2.066 570 HB1 ALA 74 1HB ALA 74 14.632 -13.374 -4.275 571 HB2 ALA 74 2HB ALA 74 13.427 -12.558 -3.277 572 HB3 ALA 74 3HB ALA 74 14.641 -11.615 -4.141 573 H ARG 75 H ARG 75 16.901 -13.809 -4.066 574 HA ARG 75 HA ARG 75 19.114 -11.904 -3.669 575 HB2 ARG 75 1HB ARG 75 20.395 -14.087 -4.602 576 HB3 ARG 75 2HB ARG 75 20.167 -13.751 -2.891 577 HG2 ARG 75 1HG ARG 75 18.061 -15.285 -4.320 578 HG3 ARG 75 2HG ARG 75 19.579 -16.095 -3.924 579 HD2 ARG 75 1HD ARG 75 19.232 -15.212 -1.556 580 HD3 ARG 75 2HD ARG 75 17.584 -14.839 -2.060 581 HE ARG 75 HE ARG 75 17.090 -17.051 -1.845 582 HH11 ARG 75 1HH1 ARG 75 20.532 -16.725 -2.254 583 HH12 ARG 75 2HH1 ARG 75 20.851 -18.412 -2.022 584 HH21 ARG 75 1HH2 ARG 75 17.497 -19.274 -1.537 585 HH22 ARG 75 2HH2 ARG 75 19.123 -19.861 -1.615 586 H VAL 76 H VAL 76 18.105 -14.397 -6.018 587 HA VAL 76 HA VAL 76 17.918 -12.505 -8.156 588 HB VAL 76 HB VAL 76 19.739 -13.990 -9.447 589 HG11 VAL 76 1HG1 VAL 76 20.759 -12.017 -9.677 590 HG12 VAL 76 2HG1 VAL 76 19.516 -11.382 -8.598 591 HG13 VAL 76 3HG1 VAL 76 21.077 -11.884 -7.947 592 HG21 VAL 76 3HG2 VAL 76 20.292 -15.291 -7.428 593 HG22 VAL 76 1HG2 VAL 76 21.678 -14.395 -8.050 594 HG23 VAL 76 2HG2 VAL 76 20.811 -13.805 -6.632 595 H LEU 77 H LEU 77 17.307 -13.521 -10.197 596 HA LEU 77 HA LEU 77 15.957 -16.090 -9.731 597 HB2 LEU 77 1HB LEU 77 15.376 -13.768 -11.535 598 HB3 LEU 77 2HB LEU 77 14.678 -15.356 -11.845 599 HG LEU 77 HG LEU 77 14.281 -14.351 -9.112 600 HD11 LEU 77 1HD1 LEU 77 12.268 -13.101 -10.651 601 HD12 LEU 77 2HD1 LEU 77 13.825 -12.582 -11.294 602 HD13 LEU 77 3HD1 LEU 77 13.456 -12.352 -9.585 603 HD21 LEU 77 3HD2 LEU 77 13.251 -16.399 -9.932 604 HD22 LEU 77 1HD2 LEU 77 12.450 -15.497 -11.218 605 HD23 LEU 77 2HD2 LEU 77 12.022 -15.197 -9.534 606 H THR 78 H THR 78 15.657 -17.410 -11.793 607 HA THR 78 HA THR 78 18.263 -17.986 -12.849 608 HB THR 78 HB THR 78 17.283 -19.885 -13.903 609 HG1 THR 78 HG1 THR 78 14.689 -18.911 -13.276 610 HG21 THR 78 3HG2 THR 78 16.069 -20.958 -12.062 611 HG22 THR 78 1HG2 THR 78 15.838 -19.387 -11.297 612 HG23 THR 78 2HG2 THR 78 17.462 -20.054 -11.470 613 H ALA 79 H ALA 79 17.921 -18.755 -15.407 614 HA ALA 79 HA ALA 79 17.636 -16.197 -16.776 615 HB1 ALA 79 1HB ALA 79 19.659 -17.586 -17.116 616 HB2 ALA 79 2HB ALA 79 18.646 -18.819 -17.869 617 HB3 ALA 79 3HB ALA 79 18.799 -17.227 -18.613 618 H SER 80 H SER 80 15.498 -18.394 -15.917 619 HA SER 80 HA SER 80 14.044 -18.321 -18.480 620 HB2 SER 80 1HB SER 80 14.773 -20.592 -17.304 621 HB3 SER 80 2HB SER 80 13.306 -20.299 -16.369 622 HG SER 80 HG SER 80 13.428 -21.402 -18.704 623 H GLU 81 H GLU 81 13.520 -18.453 -14.956 624 HA GLU 81 HA GLU 81 10.859 -17.723 -14.891 625 HB2 GLU 81 1HB GLU 81 13.133 -17.334 -12.981 626 HB3 GLU 81 2HB GLU 81 11.572 -16.605 -12.629 627 HG2 GLU 81 1HG GLU 81 10.504 -18.706 -12.527 628 HG3 GLU 81 2HG GLU 81 11.893 -19.527 -13.238 629 H THR 82 H THR 82 13.688 -15.726 -15.375 630 HA THR 82 HA THR 82 12.182 -13.256 -15.157 631 HB THR 82 HB THR 82 14.331 -12.164 -15.787 632 HG1 THR 82 HG1 THR 82 16.095 -13.374 -16.224 633 HG21 THR 82 3HG2 THR 82 15.127 -14.028 -13.635 634 HG22 THR 82 1HG2 THR 82 13.609 -13.164 -13.396 635 HG23 THR 82 2HG2 THR 82 15.104 -12.265 -13.657 636 H LYS 83 H LYS 83 13.937 -15.024 -17.699 637 HA LYS 83 HA LYS 83 13.402 -13.304 -19.820 638 HB2 LYS 83 1HB LYS 83 15.012 -15.082 -20.053 639 HB3 LYS 83 2HB LYS 83 13.773 -16.302 -19.788 640 HG2 LYS 83 1HG LYS 83 12.788 -15.907 -21.887 641 HG3 LYS 83 2HG LYS 83 13.681 -14.401 -22.110 642 HD2 LYS 83 1HD LYS 83 15.195 -16.950 -21.769 643 HD3 LYS 83 2HD LYS 83 14.435 -16.605 -23.324 644 HE2 LYS 83 1HE LYS 83 16.292 -14.704 -21.903 645 HE3 LYS 83 2HE LYS 83 16.821 -15.863 -23.121 646 HZ1 LYS 83 3HZ LYS 83 14.753 -14.595 -24.326 647 HZ2 LYS 83 1HZ LYS 83 16.390 -14.242 -24.566 648 HZ3 LYS 83 2HZ LYS 83 15.485 -13.344 -23.454 649 H THR 84 H THR 84 11.307 -15.428 -18.125 650 HA THR 84 HA THR 84 9.293 -15.336 -20.253 651 HB THR 84 HB THR 84 9.777 -17.524 -19.147 652 HG1 THR 84 HG1 THR 84 7.762 -17.287 -20.095 653 HG21 THR 84 3HG2 THR 84 9.888 -17.673 -16.928 654 HG22 THR 84 1HG2 THR 84 8.200 -17.180 -16.804 655 HG23 THR 84 2HG2 THR 84 9.477 -15.964 -16.790 656 H PHE 85 H PHE 85 10.133 -13.089 -18.387 657 HA PHE 85 HA PHE 85 7.560 -12.590 -17.063 658 HB2 PHE 85 1HB PHE 85 10.122 -12.279 -16.117 659 HB3 PHE 85 2HB PHE 85 9.707 -10.642 -16.615 660 HD1 PHE 85 HD2 PHE 85 8.655 -13.463 -14.472 661 HD2 PHE 85 HD1 PHE 85 8.245 -9.316 -15.341 662 HE1 PHE 85 HE2 PHE 85 7.390 -13.154 -12.385 663 HE2 PHE 85 HE1 PHE 85 6.980 -9.000 -13.254 664 HZ PHE 85 HZ PHE 85 6.550 -10.921 -11.774 665 H LEU 86 H LEU 86 9.881 -11.173 -19.319 666 HA LEU 86 HA LEU 86 7.787 -9.278 -20.162 667 HB2 LEU 86 1HB LEU 86 9.586 -7.756 -20.845 668 HB3 LEU 86 2HB LEU 86 9.601 -8.088 -19.114 669 HG LEU 86 HG LEU 86 11.427 -9.806 -19.652 670 HD11 LEU 86 1HD1 LEU 86 10.867 -8.799 -22.280 671 HD12 LEU 86 2HD1 LEU 86 11.926 -10.120 -21.789 672 HD13 LEU 86 3HD1 LEU 86 12.544 -8.470 -21.844 673 HD21 LEU 86 3HD2 LEU 86 11.940 -6.854 -20.004 674 HD22 LEU 86 1HD2 LEU 86 13.164 -8.066 -19.624 675 HD23 LEU 86 2HD2 LEU 86 11.867 -7.733 -18.475 676 H ALA 87 H ALA 87 10.036 -11.717 -21.078 677 HA ALA 87 HA ALA 87 9.661 -11.172 -23.929 678 HB1 ALA 87 1HB ALA 87 11.713 -11.979 -24.172 679 HB2 ALA 87 2HB ALA 87 11.810 -12.178 -22.422 680 HB3 ALA 87 3HB ALA 87 11.240 -13.508 -23.431 681 H ALA 88 H ALA 88 7.723 -12.434 -21.849 682 HA ALA 88 HA ALA 88 7.103 -14.862 -23.399 683 HB1 ALA 88 1HB ALA 88 5.721 -14.585 -20.848 684 HB2 ALA 88 2HB ALA 88 6.625 -15.949 -21.507 685 HB3 ALA 88 3HB ALA 88 7.477 -14.638 -20.691 686 H ALA 89 H ALA 89 5.777 -11.923 -21.986 687 HA ALA 89 HA ALA 89 3.085 -12.233 -22.437 688 HB1 ALA 89 1HB ALA 89 2.878 -9.955 -22.188 689 HB2 ALA 89 2HB ALA 89 4.455 -10.241 -21.450 690 HB3 ALA 89 3HB ALA 89 4.352 -9.613 -23.095 691 H ASP 90 H ASP 90 5.201 -10.451 -24.690 692 HA ASP 90 HA ASP 90 4.311 -11.859 -26.987 693 HB2 ASP 90 1HB ASP 90 2.796 -9.468 -26.151 694 HB3 ASP 90 2HB ASP 90 3.292 -9.485 -27.841 695 H HIS 91 H HIS 91 4.822 -10.352 -29.035 696 HA HIS 91 HA HIS 91 7.372 -8.986 -28.475 697 HB2 HIS 91 1HB HIS 91 7.545 -11.303 -29.549 698 HB3 HIS 91 2HB HIS 91 6.840 -10.569 -30.985 699 HD1 HIS 91 HD1 HIS 91 9.977 -10.691 -28.970 700 HD2 HIS 91 HD2 HIS 91 8.537 -8.829 -32.393 701 HE1 HIS 91 HE1 HIS 91 11.997 -9.712 -30.103 702 H ASP 92 H ASP 92 5.151 -7.481 -28.522 703 HA ASP 92 HA ASP 92 4.147 -6.550 -30.917 704 HB2 ASP 92 1HB ASP 92 3.202 -5.809 -28.831 705 HB3 ASP 92 2HB ASP 92 4.717 -5.042 -28.361 706 H GLY 93 H GLY 93 7.215 -5.818 -29.373 707 HA2 GLY 93 1HA GLY 93 7.987 -4.343 -31.809 708 HA3 GLY 93 2HA GLY 93 8.398 -3.732 -30.214 709 H ASP 94 H ASP 94 9.665 -5.296 -28.822 710 HA ASP 94 HA ASP 94 11.435 -7.006 -30.418 711 HB2 ASP 94 1HB ASP 94 12.159 -4.482 -29.284 712 HB3 ASP 94 2HB ASP 94 13.028 -5.753 -28.428 713 H GLY 95 H GLY 95 9.236 -7.263 -28.307 714 HA2 GLY 95 1HA GLY 95 8.883 -9.097 -26.881 715 HA3 GLY 95 2HA GLY 95 10.624 -9.310 -26.762 716 H LYS 96 H LYS 96 9.478 -6.114 -26.330 717 HA LYS 96 HA LYS 96 9.985 -6.347 -23.443 718 HB2 LYS 96 1HB LYS 96 10.425 -3.918 -23.511 719 HB3 LYS 96 2HB LYS 96 11.492 -4.820 -24.579 720 HG2 LYS 96 1HG LYS 96 9.941 -4.229 -26.462 721 HG3 LYS 96 2HG LYS 96 9.116 -3.144 -25.341 722 HD2 LYS 96 1HD LYS 96 10.602 -1.683 -26.290 723 HD3 LYS 96 2HD LYS 96 11.566 -2.260 -24.928 724 HE2 LYS 96 1HE LYS 96 12.548 -3.975 -26.466 725 HE3 LYS 96 2HE LYS 96 11.709 -3.178 -27.796 726 HZ1 LYS 96 3HZ LYS 96 13.107 -1.416 -27.746 727 HZ2 LYS 96 1HZ LYS 96 14.175 -2.571 -27.124 728 HZ3 LYS 96 2HZ LYS 96 13.376 -1.509 -26.078 729 H ILE 97 H ILE 97 8.569 -5.463 -21.948 730 HA ILE 97 HA ILE 97 5.823 -5.286 -22.822 731 HB ILE 97 HB ILE 97 6.844 -4.823 -20.026 732 HG12 ILE 97 1HG1 ILE 97 7.724 -6.963 -20.881 733 HG13 ILE 97 2HG1 ILE 97 6.527 -7.211 -19.614 734 HG21 ILE 97 1HG2 ILE 97 4.689 -4.499 -19.602 735 HG22 ILE 97 2HG2 ILE 97 4.254 -4.906 -21.261 736 HG23 ILE 97 3HG2 ILE 97 4.393 -6.179 -20.048 737 HD11 ILE 97 3HD1 ILE 97 6.358 -8.761 -21.560 738 HD12 ILE 97 1HD1 ILE 97 4.882 -7.869 -21.192 739 HD13 ILE 97 2HD1 ILE 97 5.897 -7.374 -22.547 740 H GLY 98 H GLY 98 4.453 -3.511 -22.601 741 HA2 GLY 98 1HA GLY 98 5.609 -0.962 -21.762 742 HA3 GLY 98 2HA GLY 98 5.080 -1.082 -23.433 743 H ALA 99 H ALA 99 3.782 -1.998 -20.237 744 HA ALA 99 HA ALA 99 1.685 -1.814 -19.357 745 HB1 ALA 99 1HB ALA 99 1.714 0.805 -20.852 746 HB2 ALA 99 2HB ALA 99 0.686 0.391 -19.479 747 HB3 ALA 99 3HB ALA 99 2.431 0.527 -19.264 748 H GLU 100 H GLU 100 1.860 -3.230 -21.855 749 HA GLU 100 HA GLU 100 -0.931 -2.990 -22.669 750 HB2 GLU 100 1HB GLU 100 1.415 -2.832 -24.557 751 HB3 GLU 100 2HB GLU 100 -0.204 -3.266 -25.089 752 HG2 GLU 100 1HG GLU 100 -1.057 -1.152 -24.631 753 HG3 GLU 100 2HG GLU 100 0.292 -0.734 -23.576 754 H GLU 101 H GLU 101 2.096 -4.785 -22.754 755 HA GLU 101 HA GLU 101 0.832 -7.217 -23.652 756 HB2 GLU 101 1HB GLU 101 3.581 -7.021 -22.446 757 HB3 GLU 101 2HB GLU 101 2.982 -8.188 -23.616 758 HG2 GLU 101 1HG GLU 101 3.701 -5.311 -24.055 759 HG3 GLU 101 2HG GLU 101 4.391 -6.746 -24.811 760 H PHE 102 H PHE 102 2.393 -6.140 -20.638 761 HA PHE 102 HA PHE 102 1.970 -8.388 -19.095 762 HB2 PHE 102 1HB PHE 102 2.990 -5.891 -18.637 763 HB3 PHE 102 2HB PHE 102 1.525 -5.858 -17.661 764 HD1 PHE 102 HD1 PHE 102 1.165 -8.021 -16.180 765 HD2 PHE 102 HD2 PHE 102 4.916 -6.678 -17.676 766 HE1 PHE 102 HE1 PHE 102 2.318 -9.277 -14.406 767 HE2 PHE 102 HE2 PHE 102 6.075 -7.931 -15.905 768 HZ PHE 102 HZ PHE 102 4.777 -9.234 -14.268 769 H GLN 103 H GLN 103 -0.263 -5.780 -19.864 770 HA GLN 103 HA GLN 103 -2.299 -6.520 -18.047 771 HB2 GLN 103 1HB GLN 103 -2.224 -4.853 -20.541 772 HB3 GLN 103 2HB GLN 103 -3.760 -5.226 -19.769 773 HG2 GLN 103 1HG GLN 103 -2.848 -3.048 -19.093 774 HG3 GLN 103 2HG GLN 103 -3.058 -4.154 -17.737 775 HE21 GLN 103 2HE2 GLN 103 -0.523 -3.677 -20.176 776 HE22 GLN 103 1HE2 GLN 103 0.773 -3.519 -19.044 777 H GLU 104 H GLU 104 -2.241 -6.915 -21.596 778 HA GLU 104 HA GLU 104 -4.434 -8.591 -21.806 779 HB2 GLU 104 1HB GLU 104 -3.505 -9.300 -23.966 780 HB3 GLU 104 2HB GLU 104 -3.377 -7.560 -23.746 781 HG2 GLU 104 1HG GLU 104 -1.030 -7.784 -23.165 782 HG3 GLU 104 2HG GLU 104 -1.146 -9.535 -23.326 783 H MET 105 H MET 105 -1.209 -9.299 -20.747 784 HA MET 105 HA MET 105 -1.225 -12.094 -21.130 785 HB2 MET 105 1HB MET 105 0.843 -10.896 -20.707 786 HB3 MET 105 2HB MET 105 0.267 -10.398 -19.122 787 HG2 MET 105 1HG MET 105 0.084 -12.950 -18.680 788 HG3 MET 105 2HG MET 105 1.195 -13.077 -20.041 789 HE1 MET 105 3HE MET 105 3.926 -10.505 -18.733 790 HE2 MET 105 1HE MET 105 4.005 -11.958 -19.730 791 HE3 MET 105 2HE MET 105 2.771 -10.738 -20.046 792 H VAL 106 H VAL 106 -1.996 -10.112 -18.276 793 HA VAL 106 HA VAL 106 -2.865 -12.401 -16.760 794 HB VAL 106 HB VAL 106 -3.259 -9.473 -16.130 795 HG11 VAL 106 1HG1 VAL 106 -2.970 -11.365 -13.930 796 HG12 VAL 106 2HG1 VAL 106 -4.165 -10.090 -14.181 797 HG13 VAL 106 3HG1 VAL 106 -4.389 -11.671 -14.931 798 HG21 VAL 106 3HG2 VAL 106 -0.948 -9.677 -16.274 799 HG22 VAL 106 1HG2 VAL 106 -1.266 -9.983 -14.567 800 HG23 VAL 106 2HG2 VAL 106 -0.956 -11.331 -15.662 801 H GLN 107 H GLN 107 -4.460 -9.574 -18.219 802 HA GLN 107 HA GLN 107 -7.079 -10.208 -17.495 803 HB2 GLN 107 1HB GLN 107 -6.167 -8.795 -20.007 804 HB3 GLN 107 2HB GLN 107 -7.773 -8.714 -19.296 805 HG2 GLN 107 1HG GLN 107 -5.307 -7.310 -18.561 806 HG3 GLN 107 2HG GLN 107 -6.992 -6.819 -18.395 807 HE21 GLN 107 2HE2 GLN 107 -8.210 -8.166 -16.710 808 HE22 GLN 107 1HE2 GLN 107 -7.389 -8.406 -15.209 809 H SER 108 H SER 108 -5.143 -11.243 -20.252 810 HA SER 108 HA SER 108 -5.494 -12.791 -21.887 811 HB2 SER 108 1HB SER 108 -6.850 -13.969 -19.485 812 HB3 SER 108 2HB SER 108 -6.947 -14.801 -21.036 813 HG SER 108 HG SER 108 -4.734 -14.981 -21.064 Start of MODEL 2 1 H1 SER 1 H SER 1 1.855 0.058 0.876 2 HA SER 1 HA SER 1 1.711 0.758 -1.895 3 HB2 SER 1 1HB SER 1 3.916 0.049 0.007 4 HB3 SER 1 2HB SER 1 4.241 0.066 -1.726 5 HG SER 1 HG SER 1 3.676 2.216 -1.796 6 H LEU 2 H LEU 2 3.316 -2.071 -0.445 7 HA LEU 2 HA LEU 2 2.841 -3.595 -2.860 8 HB2 LEU 2 1HB LEU 2 4.987 -3.647 -1.556 9 HB3 LEU 2 2HB LEU 2 4.119 -4.518 -0.294 10 HG LEU 2 HG LEU 2 3.599 -6.046 -2.502 11 HD11 LEU 2 1HD1 LEU 2 6.141 -4.590 -2.914 12 HD12 LEU 2 2HD1 LEU 2 5.014 -5.266 -4.089 13 HD13 LEU 2 3HD1 LEU 2 6.144 -6.323 -3.243 14 HD21 LEU 2 3HD2 LEU 2 6.060 -6.524 -0.872 15 HD22 LEU 2 1HD2 LEU 2 4.840 -7.672 -1.425 16 HD23 LEU 2 2HD2 LEU 2 4.469 -6.556 -0.110 17 H THR 3 H THR 3 1.725 -5.579 -2.954 18 HA THR 3 HA THR 3 -0.134 -6.863 -2.628 19 HB THR 3 HB THR 3 -0.255 -8.043 -0.587 20 HG1 THR 3 HG1 THR 3 1.366 -6.179 0.777 21 HG21 THR 3 3HG2 THR 3 2.595 -7.403 -0.259 22 HG22 THR 3 1HG2 THR 3 2.112 -7.798 -1.909 23 HG23 THR 3 2HG2 THR 3 1.811 -8.945 -0.603 24 H ASP 4 H ASP 4 -0.530 -3.979 -2.566 25 HA ASP 4 HA ASP 4 -2.454 -3.393 -0.520 26 HB2 ASP 4 1HB ASP 4 -1.268 -1.518 -1.320 27 HB3 ASP 4 2HB ASP 4 -1.539 -1.958 -3.004 28 H ILE 5 H ILE 5 -2.928 -3.177 -4.038 29 HA ILE 5 HA ILE 5 -5.721 -3.614 -3.849 30 HB ILE 5 HB ILE 5 -4.087 -2.635 -5.797 31 HG12 ILE 5 1HG1 ILE 5 -6.548 -3.464 -7.018 32 HG13 ILE 5 2HG1 ILE 5 -6.858 -3.016 -5.345 33 HG21 ILE 5 1HG2 ILE 5 -3.445 -4.979 -6.383 34 HG22 ILE 5 2HG2 ILE 5 -5.116 -5.253 -6.869 35 HG23 ILE 5 3HG2 ILE 5 -4.138 -4.055 -7.715 36 HD11 ILE 5 3HD1 ILE 5 -7.143 -1.150 -6.916 37 HD12 ILE 5 1HD1 ILE 5 -5.896 -0.841 -5.708 38 HD13 ILE 5 2HD1 ILE 5 -5.440 -1.284 -7.353 39 H LEU 6 H LEU 6 -3.005 -5.733 -4.119 40 HA LEU 6 HA LEU 6 -4.645 -7.997 -4.937 41 HB2 LEU 6 1HB LEU 6 -1.902 -7.304 -5.136 42 HB3 LEU 6 2HB LEU 6 -2.015 -8.781 -4.182 43 HG LEU 6 HG LEU 6 -3.586 -8.777 -6.671 44 HD11 LEU 6 1HD1 LEU 6 -1.107 -9.495 -7.616 45 HD12 LEU 6 2HD1 LEU 6 -0.771 -8.043 -6.674 46 HD13 LEU 6 3HD1 LEU 6 -1.959 -7.994 -7.977 47 HD21 LEU 6 3HD2 LEU 6 -3.497 -10.781 -5.426 48 HD22 LEU 6 1HD2 LEU 6 -1.747 -10.673 -5.232 49 HD23 LEU 6 2HD2 LEU 6 -2.438 -11.029 -6.816 50 H SER 7 H SER 7 -3.548 -10.089 -3.600 51 HA SER 7 HA SER 7 -4.429 -9.587 -0.839 52 HB2 SER 7 1HB SER 7 -5.412 -11.416 -2.580 53 HB3 SER 7 2HB SER 7 -4.167 -12.380 -1.784 54 HG SER 7 HG SER 7 -6.482 -12.100 -0.863 55 HA PRO 8 HA PRO 8 -0.124 -10.163 0.211 56 HB2 PRO 8 1HB PRO 8 -0.450 -9.713 2.868 57 HB3 PRO 8 2HB PRO 8 -0.399 -8.412 1.673 58 HG2 PRO 8 1HG PRO 8 -2.769 -9.699 2.973 59 HG3 PRO 8 2HG PRO 8 -2.463 -7.981 2.654 60 HD2 PRO 8 1HD PRO 8 -4.072 -9.491 1.084 61 HD3 PRO 8 2HD PRO 8 -3.101 -8.149 0.445 62 H SER 9 H SER 9 -2.883 -11.844 1.521 63 HA SER 9 HA SER 9 -1.210 -13.851 2.813 64 HB2 SER 9 1HB SER 9 -4.225 -13.830 2.618 65 HB3 SER 9 2HB SER 9 -3.225 -14.720 3.766 66 HG SER 9 HG SER 9 -2.494 -12.510 4.416 67 H ASP 10 H ASP 10 -1.632 -13.362 -0.210 68 HA ASP 10 HA ASP 10 -2.086 -16.195 -0.865 69 HB2 ASP 10 1HB ASP 10 -3.015 -13.828 -2.506 70 HB3 ASP 10 2HB ASP 10 -3.188 -15.523 -2.954 71 H ILE 11 H ILE 11 -0.493 -13.164 -1.644 72 HA ILE 11 HA ILE 11 0.996 -14.026 -3.861 73 HB ILE 11 HB ILE 11 1.727 -11.937 -1.805 74 HG12 ILE 11 1HG1 ILE 11 0.703 -11.281 -4.526 75 HG13 ILE 11 2HG1 ILE 11 -0.457 -11.854 -3.333 76 HG21 ILE 11 1HG2 ILE 11 3.148 -12.977 -4.098 77 HG22 ILE 11 2HG2 ILE 11 2.833 -11.250 -4.257 78 HG23 ILE 11 3HG2 ILE 11 3.693 -11.862 -2.845 79 HD11 ILE 11 3HD1 ILE 11 -0.001 -10.038 -1.891 80 HD12 ILE 11 1HD1 ILE 11 1.408 -9.554 -2.835 81 HD13 ILE 11 2HD1 ILE 11 -0.212 -9.369 -3.509 82 H ALA 12 H ALA 12 1.436 -14.512 -0.446 83 HA ALA 12 HA ALA 12 4.184 -15.300 -0.593 84 HB1 ALA 12 1HB ALA 12 4.084 -15.232 1.630 85 HB2 ALA 12 2HB ALA 12 2.428 -14.654 1.446 86 HB3 ALA 12 3HB ALA 12 2.741 -16.374 1.680 87 H ALA 13 H ALA 13 1.096 -16.934 -0.819 88 HA ALA 13 HA ALA 13 1.963 -19.577 -0.446 89 HB1 ALA 13 1HB ALA 13 -0.339 -18.485 -2.055 90 HB2 ALA 13 2HB ALA 13 -0.092 -20.196 -1.707 91 HB3 ALA 13 3HB ALA 13 -0.376 -19.061 -0.388 92 H ALA 14 H ALA 14 2.266 -17.414 -3.134 93 HA ALA 14 HA ALA 14 2.875 -19.505 -5.040 94 HB1 ALA 14 1HB ALA 14 1.777 -17.162 -5.457 95 HB2 ALA 14 2HB ALA 14 3.455 -16.630 -5.573 96 HB3 ALA 14 3HB ALA 14 2.849 -17.880 -6.660 97 H LEU 15 H LEU 15 4.645 -16.922 -3.359 98 HA LEU 15 HA LEU 15 7.156 -17.336 -4.471 99 HB2 LEU 15 1HB LEU 15 6.384 -16.437 -1.702 100 HB3 LEU 15 2HB LEU 15 8.030 -16.376 -2.330 101 HG LEU 15 HG LEU 15 5.726 -14.917 -3.609 102 HD11 LEU 15 1HD1 LEU 15 6.930 -12.913 -2.490 103 HD12 LEU 15 2HD1 LEU 15 7.527 -14.126 -1.358 104 HD13 LEU 15 3HD1 LEU 15 5.791 -13.876 -1.548 105 HD21 LEU 15 3HD2 LEU 15 7.738 -15.382 -4.986 106 HD22 LEU 15 1HD2 LEU 15 8.705 -14.494 -3.808 107 HD23 LEU 15 2HD2 LEU 15 7.447 -13.662 -4.723 108 H ARG 16 H ARG 16 5.415 -19.216 -2.144 109 HA ARG 16 HA ARG 16 7.791 -20.750 -1.417 110 HB2 ARG 16 1HB ARG 16 6.102 -20.055 0.308 111 HB3 ARG 16 2HB ARG 16 4.950 -21.134 -0.468 112 HG2 ARG 16 1HG ARG 16 7.530 -22.347 0.253 113 HG3 ARG 16 2HG ARG 16 6.519 -21.831 1.605 114 HD2 ARG 16 1HD ARG 16 5.257 -23.369 -0.608 115 HD3 ARG 16 2HD ARG 16 6.282 -24.234 0.536 116 HE ARG 16 HE ARG 16 4.534 -22.709 2.042 117 HH11 ARG 16 1HH1 ARG 16 4.337 -25.296 -0.280 118 HH12 ARG 16 2HH1 ARG 16 2.884 -25.961 0.389 119 HH21 ARG 16 1HH2 ARG 16 2.621 -23.575 2.932 120 HH22 ARG 16 2HH2 ARG 16 1.908 -24.980 2.215 121 H ASP 17 H ASP 17 5.220 -20.828 -3.636 122 HA ASP 17 HA ASP 17 5.575 -23.715 -4.086 123 HB2 ASP 17 1HB ASP 17 3.241 -22.602 -3.686 124 HB3 ASP 17 2HB ASP 17 3.396 -22.102 -5.369 125 H CYS 18 H CYS 18 7.237 -21.322 -4.996 126 HA CYS 18 HA CYS 18 7.488 -22.215 -7.763 127 HB2 CYS 18 1HB CYS 18 7.396 -20.065 -8.723 128 HB3 CYS 18 2HB CYS 18 6.027 -20.117 -7.620 129 HG CYS 18 HG CYS 18 8.236 -18.948 -5.717 130 H GLN 19 H GLN 19 8.956 -22.205 -5.056 131 HA GLN 19 HA GLN 19 11.297 -20.671 -5.317 132 HB2 GLN 19 1HB GLN 19 12.259 -22.229 -3.652 133 HB3 GLN 19 2HB GLN 19 10.671 -21.634 -3.187 134 HG2 GLN 19 1HG GLN 19 9.764 -23.793 -4.206 135 HG3 GLN 19 2HG GLN 19 11.434 -24.356 -4.175 136 HE21 GLN 19 2HE2 GLN 19 9.242 -22.617 -1.985 137 HE22 GLN 19 1HE2 GLN 19 9.588 -23.585 -0.597 138 H ALA 20 H ALA 20 10.246 -23.436 -6.990 139 HA ALA 20 HA ALA 20 12.857 -24.467 -7.634 140 HB1 ALA 20 1HB ALA 20 11.779 -26.214 -8.585 141 HB2 ALA 20 2HB ALA 20 10.436 -25.610 -7.614 142 HB3 ALA 20 3HB ALA 20 10.545 -25.193 -9.324 143 HA PRO 21 HA PRO 21 13.836 -22.032 -11.152 144 HB2 PRO 21 1HB PRO 21 15.030 -23.856 -12.771 145 HB3 PRO 21 2HB PRO 21 15.790 -23.232 -11.302 146 HG2 PRO 21 1HG PRO 21 14.329 -25.809 -11.730 147 HG3 PRO 21 2HG PRO 21 15.836 -25.512 -10.845 148 HD2 PRO 21 1HD PRO 21 13.450 -25.806 -9.600 149 HD3 PRO 21 2HD PRO 21 14.733 -24.753 -8.969 150 H ASP 22 H ASP 22 13.000 -21.389 -13.088 151 HA ASP 22 HA ASP 22 11.437 -21.215 -14.740 152 HB2 ASP 22 1HB ASP 22 13.074 -23.056 -15.544 153 HB3 ASP 22 2HB ASP 22 11.758 -24.171 -15.186 154 H SER 23 H SER 23 10.465 -21.851 -12.067 155 HA SER 23 HA SER 23 7.998 -23.307 -12.757 156 HB2 SER 23 1HB SER 23 9.510 -23.075 -10.161 157 HB3 SER 23 2HB SER 23 7.815 -23.559 -10.199 158 HG SER 23 HG SER 23 9.859 -24.844 -11.687 159 H PHE 24 H PHE 24 9.348 -20.333 -11.718 160 HA PHE 24 HA PHE 24 6.766 -19.300 -10.818 161 HB2 PHE 24 1HB PHE 24 8.742 -18.783 -9.450 162 HB3 PHE 24 2HB PHE 24 9.498 -17.998 -10.833 163 HD1 PHE 24 HD1 PHE 24 6.011 -17.798 -9.549 164 HD2 PHE 24 HD2 PHE 24 9.671 -15.759 -10.297 165 HE1 PHE 24 HE1 PHE 24 4.952 -15.671 -8.912 166 HE2 PHE 24 HE2 PHE 24 8.618 -13.629 -9.661 167 HZ PHE 24 HZ PHE 24 6.256 -13.582 -8.966 168 H SER 25 H SER 25 5.684 -17.632 -11.825 169 HA SER 25 HA SER 25 6.731 -16.228 -14.075 170 HB2 SER 25 1HB SER 25 4.460 -17.537 -15.209 171 HB3 SER 25 2HB SER 25 6.134 -17.568 -15.765 172 HG SER 25 HG SER 25 6.298 -19.521 -15.027 173 HA PRO 26 HA PRO 26 3.512 -13.435 -13.034 174 HB2 PRO 26 1HB PRO 26 2.959 -12.290 -15.432 175 HB3 PRO 26 2HB PRO 26 4.445 -11.964 -14.532 176 HG2 PRO 26 1HG PRO 26 3.994 -13.822 -16.836 177 HG3 PRO 26 2HG PRO 26 5.344 -12.710 -16.543 178 HD2 PRO 26 1HD PRO 26 5.511 -15.366 -16.046 179 HD3 PRO 26 2HD PRO 26 6.385 -14.157 -15.083 180 H LYS 27 H LYS 27 2.857 -15.432 -15.892 181 HA LYS 27 HA LYS 27 -0.014 -15.154 -15.523 182 HB2 LYS 27 1HB LYS 27 -0.263 -16.039 -17.640 183 HB3 LYS 27 2HB LYS 27 1.316 -15.276 -17.779 184 HG2 LYS 27 1HG LYS 27 0.749 -18.199 -17.339 185 HG3 LYS 27 2HG LYS 27 1.399 -17.443 -18.795 186 HD2 LYS 27 1HD LYS 27 3.324 -16.648 -17.331 187 HD3 LYS 27 2HD LYS 27 2.720 -17.774 -16.113 188 HE2 LYS 27 1HE LYS 27 4.323 -19.025 -17.235 189 HE3 LYS 27 2HE LYS 27 2.820 -19.521 -18.010 190 HZ1 LYS 27 3HZ LYS 27 3.661 -18.887 -19.940 191 HZ2 LYS 27 1HZ LYS 27 5.090 -18.380 -19.191 192 HZ3 LYS 27 2HZ LYS 27 3.805 -17.297 -19.381 193 H LYS 28 H LYS 28 2.024 -16.722 -13.763 194 HA LYS 28 HA LYS 28 0.434 -19.201 -13.640 195 HB2 LYS 28 1HB LYS 28 2.901 -19.389 -14.321 196 HB3 LYS 28 2HB LYS 28 3.271 -18.955 -12.658 197 HG2 LYS 28 1HG LYS 28 1.357 -21.170 -13.048 198 HG3 LYS 28 2HG LYS 28 3.037 -21.478 -13.496 199 HD2 LYS 28 1HD LYS 28 3.699 -20.629 -11.231 200 HD3 LYS 28 2HD LYS 28 1.984 -20.587 -10.814 201 HE2 LYS 28 1HE LYS 28 1.819 -22.850 -10.695 202 HE3 LYS 28 2HE LYS 28 3.026 -23.113 -11.954 203 HZ1 LYS 28 3HZ LYS 28 4.259 -21.940 -9.713 204 HZ2 LYS 28 1HZ LYS 28 4.547 -23.457 -10.404 205 HZ3 LYS 28 2HZ LYS 28 3.371 -23.286 -9.200 206 H PHE 29 H PHE 29 1.974 -16.604 -11.867 207 HA PHE 29 HA PHE 29 1.038 -17.639 -9.314 208 HB2 PHE 29 1HB PHE 29 2.506 -16.196 -8.315 209 HB3 PHE 29 2HB PHE 29 3.283 -16.316 -9.890 210 HD1 PHE 29 HD2 PHE 29 2.508 -14.549 -11.656 211 HD2 PHE 29 HD1 PHE 29 2.046 -14.117 -7.447 212 HE1 PHE 29 HE2 PHE 29 2.331 -12.110 -11.928 213 HE2 PHE 29 HE1 PHE 29 1.867 -11.678 -7.713 214 HZ PHE 29 HZ PHE 29 2.011 -10.671 -9.956 215 H PHE 30 H PHE 30 0.038 -15.468 -11.765 216 HA PHE 30 HA PHE 30 -1.435 -13.568 -10.403 217 HB2 PHE 30 1HB PHE 30 -2.539 -13.133 -12.417 218 HB3 PHE 30 2HB PHE 30 -1.020 -13.852 -12.942 219 HD1 PHE 30 HD1 PHE 30 -1.121 -16.500 -13.174 220 HD2 PHE 30 HD2 PHE 30 -4.468 -13.881 -13.398 221 HE1 PHE 30 HE1 PHE 30 -2.364 -18.203 -14.442 222 HE2 PHE 30 HE2 PHE 30 -5.717 -15.580 -14.666 223 HZ PHE 30 HZ PHE 30 -4.665 -17.745 -15.189 224 H GLN 31 H GLN 31 -2.154 -16.932 -10.979 225 HA GLN 31 HA GLN 31 -4.891 -16.685 -10.059 226 HB2 GLN 31 1HB GLN 31 -5.172 -18.920 -10.668 227 HB3 GLN 31 2HB GLN 31 -4.012 -18.323 -11.847 228 HG2 GLN 31 1HG GLN 31 -2.254 -19.219 -10.139 229 HG3 GLN 31 2HG GLN 31 -3.606 -20.196 -9.568 230 HE21 GLN 31 2HE2 GLN 31 -0.997 -20.373 -11.399 231 HE22 GLN 31 1HE2 GLN 31 -1.512 -21.493 -12.609 232 H ILE 32 H ILE 32 -1.776 -17.470 -8.769 233 HA ILE 32 HA ILE 32 -2.766 -18.787 -6.413 234 HB ILE 32 HB ILE 32 -0.027 -17.673 -7.027 235 HG12 ILE 32 1HG1 ILE 32 -0.670 -20.586 -6.862 236 HG13 ILE 32 2HG1 ILE 32 -1.127 -19.707 -8.317 237 HG21 ILE 32 1HG2 ILE 32 -0.105 -17.753 -4.701 238 HG22 ILE 32 2HG2 ILE 32 -1.095 -19.211 -4.689 239 HG23 ILE 32 3HG2 ILE 32 0.606 -19.304 -5.144 240 HD11 ILE 32 3HD1 ILE 32 1.622 -19.238 -7.437 241 HD12 ILE 32 1HD1 ILE 32 1.270 -20.901 -7.906 242 HD13 ILE 32 2HD1 ILE 32 0.981 -19.584 -9.043 243 H SER 33 H SER 33 -1.354 -15.601 -7.120 244 HA SER 33 HA SER 33 -1.745 -14.648 -4.444 245 HB2 SER 33 1HB SER 33 -0.980 -12.493 -5.320 246 HB3 SER 33 2HB SER 33 0.073 -13.791 -5.881 247 HG SER 33 HG SER 33 -1.200 -13.767 -7.846 248 H GLY 34 H GLY 34 -3.199 -13.747 -7.580 249 HA2 GLY 34 1HA GLY 34 -5.749 -13.790 -7.426 250 HA3 GLY 34 2HA GLY 34 -5.508 -12.679 -6.087 251 H MET 35 H MET 35 -3.825 -12.809 -9.205 252 HA MET 35 HA MET 35 -4.388 -9.983 -9.588 253 HB2 MET 35 1HB MET 35 -2.487 -11.955 -10.747 254 HB3 MET 35 2HB MET 35 -2.953 -10.594 -11.758 255 HG2 MET 35 1HG MET 35 -2.368 -9.264 -9.526 256 HG3 MET 35 2HG MET 35 -1.321 -10.663 -9.297 257 HE1 MET 35 3HE MET 35 -0.947 -10.959 -12.876 258 HE2 MET 35 1HE MET 35 0.761 -10.599 -12.618 259 HE3 MET 35 2HE MET 35 -0.101 -11.639 -11.485 260 H SER 36 H SER 36 -5.294 -13.083 -10.912 261 HA SER 36 HA SER 36 -6.335 -12.371 -13.371 262 HB2 SER 36 1HB SER 36 -6.171 -14.696 -12.163 263 HB3 SER 36 2HB SER 36 -7.818 -14.328 -11.652 264 HG SER 36 HG SER 36 -7.116 -14.047 -14.354 265 H LYS 37 H LYS 37 -7.680 -11.914 -10.172 266 HA LYS 37 HA LYS 37 -10.326 -11.316 -10.873 267 HB2 LYS 37 1HB LYS 37 -8.703 -10.197 -8.579 268 HB3 LYS 37 2HB LYS 37 -10.457 -10.178 -8.703 269 HG2 LYS 37 1HG LYS 37 -10.659 -12.332 -8.087 270 HG3 LYS 37 2HG LYS 37 -9.198 -12.826 -8.945 271 HD2 LYS 37 1HD LYS 37 -8.477 -13.085 -6.793 272 HD3 LYS 37 2HD LYS 37 -8.037 -11.393 -7.044 273 HE2 LYS 37 1HE LYS 37 -9.734 -10.615 -5.712 274 HE3 LYS 37 2HE LYS 37 -10.757 -12.020 -6.009 275 HZ1 LYS 37 3HZ LYS 37 -8.343 -11.939 -4.281 276 HZ2 LYS 37 1HZ LYS 37 -9.248 -13.330 -4.614 277 HZ3 LYS 37 2HZ LYS 37 -9.949 -12.050 -3.758 278 H LYS 38 H LYS 38 -7.417 -9.358 -10.883 279 HA LYS 38 HA LYS 38 -8.449 -6.807 -11.041 280 HB2 LYS 38 1HB LYS 38 -6.101 -7.892 -12.609 281 HB3 LYS 38 2HB LYS 38 -6.413 -6.197 -12.257 282 HG2 LYS 38 1HG LYS 38 -5.711 -8.370 -10.299 283 HG3 LYS 38 2HG LYS 38 -4.731 -6.976 -10.760 284 HD2 LYS 38 1HD LYS 38 -5.592 -6.016 -8.924 285 HD3 LYS 38 2HD LYS 38 -7.038 -5.787 -9.911 286 HE2 LYS 38 1HE LYS 38 -8.213 -7.266 -8.714 287 HE3 LYS 38 2HE LYS 38 -6.891 -8.433 -8.703 288 HZ1 LYS 38 3HZ LYS 38 -6.963 -6.045 -6.948 289 HZ2 LYS 38 1HZ LYS 38 -5.913 -7.368 -6.847 290 HZ3 LYS 38 2HZ LYS 38 -7.553 -7.559 -6.478 291 H SER 39 H SER 39 -8.407 -5.402 -13.075 292 HA SER 39 HA SER 39 -9.388 -6.785 -15.451 293 HB2 SER 39 1HB SER 39 -11.293 -5.035 -15.532 294 HB3 SER 39 2HB SER 39 -11.479 -6.414 -14.448 295 HG SER 39 HG SER 39 -11.897 -4.805 -13.108 296 H SER 40 H SER 40 -6.952 -5.592 -15.219 297 HA SER 40 HA SER 40 -5.561 -4.083 -16.200 298 HB2 SER 40 1HB SER 40 -6.036 -3.543 -18.382 299 HB3 SER 40 2HB SER 40 -7.253 -4.795 -18.133 300 HG SER 40 HG SER 40 -7.788 -2.489 -18.987 301 H SER 41 H SER 41 -7.556 -3.269 -14.056 302 HA SER 41 HA SER 41 -7.379 -0.358 -14.488 303 HB2 SER 41 1HB SER 41 -9.708 -1.579 -14.266 304 HB3 SER 41 2HB SER 41 -9.332 -1.528 -12.544 305 HG SER 41 HG SER 41 -10.517 0.319 -13.336 306 H GLN 42 H GLN 42 -6.320 -2.976 -12.656 307 HA GLN 42 HA GLN 42 -5.294 -1.155 -10.584 308 HB2 GLN 42 1HB GLN 42 -6.127 -4.022 -10.121 309 HB3 GLN 42 2HB GLN 42 -5.545 -2.887 -8.911 310 HG2 GLN 42 1HG GLN 42 -7.639 -2.318 -8.505 311 HG3 GLN 42 2HG GLN 42 -7.734 -1.643 -10.131 312 HE21 GLN 42 2HE2 GLN 42 -7.652 -3.881 -11.681 313 HE22 GLN 42 1HE2 GLN 42 -9.052 -4.852 -11.390 314 H LEU 43 H LEU 43 -4.489 -3.000 -13.132 315 HA LEU 43 HA LEU 43 -2.335 -4.571 -12.250 316 HB2 LEU 43 1HB LEU 43 -3.133 -3.371 -14.861 317 HB3 LEU 43 2HB LEU 43 -1.534 -4.095 -14.702 318 HG LEU 43 HG LEU 43 -3.650 -5.450 -15.581 319 HD11 LEU 43 1HD1 LEU 43 -1.486 -6.393 -15.623 320 HD12 LEU 43 2HD1 LEU 43 -2.489 -7.516 -14.705 321 HD13 LEU 43 3HD1 LEU 43 -1.385 -6.430 -13.863 322 HD21 LEU 43 3HD2 LEU 43 -4.894 -5.071 -13.466 323 HD22 LEU 43 1HD2 LEU 43 -3.664 -6.007 -12.618 324 HD23 LEU 43 2HD2 LEU 43 -4.662 -6.777 -13.852 325 H LYS 44 H LYS 44 -2.243 -1.375 -13.838 326 HA LYS 44 HA LYS 44 0.514 -0.990 -13.095 327 HB2 LYS 44 1HB LYS 44 0.495 0.839 -14.490 328 HB3 LYS 44 2HB LYS 44 -0.814 -0.104 -15.190 329 HG2 LYS 44 1HG LYS 44 -1.135 2.182 -13.256 330 HG3 LYS 44 2HG LYS 44 -1.403 2.252 -15.000 331 HD2 LYS 44 1HD LYS 44 -2.894 0.399 -13.147 332 HD3 LYS 44 2HD LYS 44 -3.482 1.994 -13.621 333 HE2 LYS 44 1HE LYS 44 -3.176 1.185 -16.029 334 HE3 LYS 44 2HE LYS 44 -3.041 -0.431 -15.337 335 HZ1 LYS 44 3HZ LYS 44 -5.338 0.500 -16.099 336 HZ2 LYS 44 1HZ LYS 44 -5.327 1.244 -14.579 337 HZ3 LYS 44 2HZ LYS 44 -5.220 -0.440 -14.697 338 H GLU 45 H GLU 45 -2.279 -0.789 -11.390 339 HA GLU 45 HA GLU 45 -2.093 1.657 -10.024 340 HB2 GLU 45 1HB GLU 45 -4.090 0.242 -9.940 341 HB3 GLU 45 2HB GLU 45 -3.194 -0.989 -9.061 342 HG2 GLU 45 1HG GLU 45 -4.724 0.547 -7.727 343 HG3 GLU 45 2HG GLU 45 -3.088 0.293 -7.123 344 H ILE 46 H ILE 46 -0.752 -1.539 -9.268 345 HA ILE 46 HA ILE 46 0.605 -0.531 -6.919 346 HB ILE 46 HB ILE 46 0.956 -3.231 -8.216 347 HG12 ILE 46 1HG1 ILE 46 -0.669 -3.731 -6.125 348 HG13 ILE 46 2HG1 ILE 46 -1.240 -2.123 -6.558 349 HG21 ILE 46 1HG2 ILE 46 1.155 -3.179 -5.359 350 HG22 ILE 46 2HG2 ILE 46 2.358 -3.665 -6.552 351 HG23 ILE 46 3HG2 ILE 46 2.239 -1.977 -6.058 352 HD11 ILE 46 3HD1 ILE 46 -1.827 -4.625 -7.775 353 HD12 ILE 46 1HD1 ILE 46 -2.485 -3.030 -8.137 354 HD13 ILE 46 2HD1 ILE 46 -1.023 -3.587 -8.952 355 H PHE 47 H PHE 47 1.291 -1.012 -10.264 356 HA PHE 47 HA PHE 47 3.249 -0.990 -11.476 357 HB2 PHE 47 1HB PHE 47 4.551 1.119 -11.035 358 HB3 PHE 47 2HB PHE 47 2.822 1.358 -11.265 359 HD1 PHE 47 HD2 PHE 47 1.394 1.996 -9.408 360 HD2 PHE 47 HD1 PHE 47 5.591 1.501 -8.901 361 HE1 PHE 47 HE2 PHE 47 1.271 3.187 -7.258 362 HE2 PHE 47 HE1 PHE 47 5.475 2.690 -6.750 363 HZ PHE 47 HZ PHE 47 3.313 3.536 -5.927 364 H ARG 48 H ARG 48 3.464 -2.854 -9.406 365 HA ARG 48 HA ARG 48 6.348 -2.744 -8.922 366 HB2 ARG 48 1HB ARG 48 4.207 -2.943 -6.853 367 HB3 ARG 48 2HB ARG 48 5.683 -3.870 -6.616 368 HG2 ARG 48 1HG ARG 48 6.985 -1.782 -6.840 369 HG3 ARG 48 2HG ARG 48 5.469 -0.887 -6.959 370 HD2 ARG 48 1HD ARG 48 5.778 -2.716 -4.651 371 HD3 ARG 48 2HD ARG 48 6.765 -1.256 -4.651 372 HE ARG 48 HE ARG 48 3.908 -1.425 -4.309 373 HH11 ARG 48 1HH1 ARG 48 6.596 0.611 -5.174 374 HH12 ARG 48 2HH1 ARG 48 5.769 2.086 -4.796 375 HH21 ARG 48 1HH2 ARG 48 2.808 0.509 -3.809 376 HH22 ARG 48 2HH2 ARG 48 3.614 2.027 -4.019 377 H ILE 49 H ILE 49 4.096 -4.275 -10.477 378 HA ILE 49 HA ILE 49 5.160 -6.957 -9.875 379 HB ILE 49 HB ILE 49 3.028 -7.908 -10.647 380 HG12 ILE 49 1HG1 ILE 49 2.528 -5.705 -11.980 381 HG13 ILE 49 2HG1 ILE 49 1.200 -6.651 -11.317 382 HG21 ILE 49 1HG2 ILE 49 2.926 -5.958 -8.360 383 HG22 ILE 49 2HG2 ILE 49 1.633 -7.108 -8.698 384 HG23 ILE 49 3HG2 ILE 49 3.250 -7.691 -8.303 385 HD11 ILE 49 3HD1 ILE 49 0.654 -5.070 -9.798 386 HD12 ILE 49 1HD1 ILE 49 2.319 -4.524 -9.599 387 HD13 ILE 49 2HD1 ILE 49 1.389 -4.022 -11.011 388 H LEU 50 H LEU 50 5.062 -4.498 -12.092 389 HA LEU 50 HA LEU 50 5.406 -6.333 -14.369 390 HB2 LEU 50 1HB LEU 50 5.063 -3.410 -14.771 391 HB3 LEU 50 2HB LEU 50 4.550 -4.756 -15.786 392 HG LEU 50 HG LEU 50 3.209 -4.115 -13.171 393 HD11 LEU 50 1HD1 LEU 50 2.974 -2.119 -14.433 394 HD12 LEU 50 2HD1 LEU 50 1.463 -3.013 -14.600 395 HD13 LEU 50 3HD1 LEU 50 2.639 -3.016 -15.914 396 HD21 LEU 50 3HD2 LEU 50 1.466 -5.487 -13.955 397 HD22 LEU 50 1HD2 LEU 50 2.951 -6.365 -14.322 398 HD23 LEU 50 2HD2 LEU 50 2.101 -5.496 -15.601 399 H ASP 51 H ASP 51 6.548 -3.084 -13.433 400 HA ASP 51 HA ASP 51 9.306 -3.934 -13.686 401 HB2 ASP 51 1HB ASP 51 9.712 -1.907 -15.259 402 HB3 ASP 51 2HB ASP 51 9.099 -3.408 -15.948 403 H ASN 52 H ASN 52 10.827 -2.172 -13.091 404 HA ASN 52 HA ASN 52 9.558 -0.321 -11.180 405 HB2 ASN 52 1HB ASN 52 11.021 -2.217 -10.268 406 HB3 ASN 52 2HB ASN 52 12.385 -1.346 -10.964 407 HD21 ASN 52 2HD2 ASN 52 9.855 -1.270 -8.568 408 HD22 ASN 52 1HD2 ASN 52 10.540 -0.014 -7.599 409 H ASP 53 H ASP 53 11.265 -0.524 -14.042 410 HA ASP 53 HA ASP 53 12.891 1.824 -13.764 411 HB2 ASP 53 1HB ASP 53 13.083 -0.233 -15.424 412 HB3 ASP 53 2HB ASP 53 12.074 0.790 -16.444 413 H GLN 54 H GLN 54 9.955 1.098 -15.656 414 HA GLN 54 HA GLN 54 8.278 2.424 -16.431 415 HB2 GLN 54 1HB GLN 54 9.006 3.515 -13.828 416 HB3 GLN 54 2HB GLN 54 8.316 4.732 -14.894 417 HG2 GLN 54 1HG GLN 54 6.542 3.798 -13.634 418 HG3 GLN 54 2HG GLN 54 6.394 3.192 -15.283 419 HE21 GLN 54 2HE2 GLN 54 5.042 1.833 -13.496 420 HE22 GLN 54 1HE2 GLN 54 5.805 0.336 -13.098 421 H SER 55 H SER 55 11.174 2.842 -17.242 422 HA SER 55 HA SER 55 11.364 5.622 -17.938 423 HB2 SER 55 1HB SER 55 12.986 3.194 -18.713 424 HB3 SER 55 2HB SER 55 13.341 4.814 -19.312 425 HG SER 55 HG SER 55 14.447 4.979 -17.533 426 H GLY 56 H GLY 56 9.959 2.815 -19.342 427 HA2 GLY 56 1HA GLY 56 8.376 3.906 -21.195 428 HA3 GLY 56 2HA GLY 56 9.921 3.920 -22.033 429 H PHE 57 H PHE 57 10.537 1.367 -20.410 430 HA PHE 57 HA PHE 57 8.734 -0.597 -21.450 431 HB2 PHE 57 1HB PHE 57 10.129 -1.624 -23.082 432 HB3 PHE 57 2HB PHE 57 10.104 0.094 -23.468 433 HD1 PHE 57 HD1 PHE 57 12.047 1.449 -22.172 434 HD2 PHE 57 HD2 PHE 57 12.154 -2.669 -23.244 435 HE1 PHE 57 HE1 PHE 57 14.506 1.500 -22.109 436 HE2 PHE 57 HE2 PHE 57 14.613 -2.625 -23.182 437 HZ PHE 57 HZ PHE 57 15.792 -0.539 -22.613 438 H ILE 58 H ILE 58 10.243 -2.837 -21.433 439 HA ILE 58 HA ILE 58 11.612 -2.821 -18.826 440 HB ILE 58 HB ILE 58 9.878 -5.107 -19.733 441 HG12 ILE 58 1HG1 ILE 58 9.099 -2.846 -17.879 442 HG13 ILE 58 2HG1 ILE 58 8.490 -3.070 -19.514 443 HG21 ILE 58 1HG2 ILE 58 11.169 -4.321 -17.134 444 HG22 ILE 58 2HG2 ILE 58 9.904 -5.544 -17.239 445 HG23 ILE 58 3HG2 ILE 58 11.431 -5.781 -18.088 446 HD11 ILE 58 3HD1 ILE 58 7.915 -5.474 -18.405 447 HD12 ILE 58 1HD1 ILE 58 7.736 -4.398 -17.020 448 HD13 ILE 58 2HD1 ILE 58 6.801 -4.110 -18.488 449 H GLU 59 H GLU 59 13.110 -4.596 -18.500 450 HA GLU 59 HA GLU 59 13.939 -6.064 -20.874 451 HB2 GLU 59 1HB GLU 59 15.140 -3.772 -20.709 452 HB3 GLU 59 2HB GLU 59 16.021 -4.502 -19.375 453 HG2 GLU 59 1HG GLU 59 17.022 -6.102 -20.763 454 HG3 GLU 59 2HG GLU 59 15.885 -5.797 -22.075 455 H GLU 60 H GLU 60 15.745 -7.611 -20.340 456 HA GLU 60 HA GLU 60 15.020 -9.232 -18.183 457 HB2 GLU 60 1HB GLU 60 17.500 -9.131 -19.890 458 HB3 GLU 60 2HB GLU 60 17.295 -10.327 -18.618 459 HG2 GLU 60 1HG GLU 60 15.246 -11.118 -19.718 460 HG3 GLU 60 2HG GLU 60 15.509 -9.951 -21.012 461 H ASP 61 H ASP 61 17.025 -6.457 -18.304 462 HA ASP 61 HA ASP 61 18.525 -7.072 -15.916 463 HB2 ASP 61 1HB ASP 61 19.452 -5.658 -17.742 464 HB3 ASP 61 2HB ASP 61 18.244 -4.433 -17.368 465 H GLU 62 H GLU 62 15.392 -6.212 -16.449 466 HA GLU 62 HA GLU 62 15.199 -4.881 -13.827 467 HB2 GLU 62 1HB GLU 62 13.817 -4.283 -16.412 468 HB3 GLU 62 2HB GLU 62 12.978 -3.967 -14.900 469 HG2 GLU 62 1HG GLU 62 15.604 -2.799 -15.785 470 HG3 GLU 62 2HG GLU 62 14.059 -1.962 -15.652 471 H LEU 63 H LEU 63 15.039 -7.745 -14.639 472 HA LEU 63 HA LEU 63 12.265 -8.311 -13.831 473 HB2 LEU 63 1HB LEU 63 14.248 -10.125 -15.196 474 HB3 LEU 63 2HB LEU 63 12.582 -10.530 -14.790 475 HG LEU 63 HG LEU 63 13.513 -8.521 -16.838 476 HD11 LEU 63 1HD1 LEU 63 11.698 -10.597 -17.702 477 HD12 LEU 63 2HD1 LEU 63 13.174 -11.271 -17.012 478 HD13 LEU 63 3HD1 LEU 63 13.269 -10.128 -18.352 479 HD21 LEU 63 3HD2 LEU 63 11.562 -7.493 -16.579 480 HD22 LEU 63 1HD2 LEU 63 11.053 -8.666 -15.364 481 HD23 LEU 63 2HD2 LEU 63 10.758 -8.984 -17.073 482 H LYS 64 H LYS 64 15.612 -9.423 -13.367 483 HA LYS 64 HA LYS 64 15.126 -11.184 -11.254 484 HB2 LYS 64 1HB LYS 64 17.555 -10.744 -10.669 485 HB3 LYS 64 2HB LYS 64 17.243 -11.291 -12.311 486 HG2 LYS 64 1HG LYS 64 17.507 -9.063 -13.164 487 HG3 LYS 64 2HG LYS 64 17.645 -8.412 -11.529 488 HD2 LYS 64 1HD LYS 64 19.788 -9.131 -11.278 489 HD3 LYS 64 2HD LYS 64 19.542 -10.558 -12.287 490 HE2 LYS 64 1HE LYS 64 19.424 -7.896 -13.598 491 HE3 LYS 64 2HE LYS 64 21.004 -8.487 -13.086 492 HZ1 LYS 64 3HZ LYS 64 20.516 -10.551 -14.345 493 HZ2 LYS 64 1HZ LYS 64 20.634 -9.173 -15.320 494 HZ3 LYS 64 2HZ LYS 64 19.116 -9.818 -14.948 495 H TYR 65 H TYR 65 15.982 -10.838 -8.979 496 HA TYR 65 HA TYR 65 15.736 -9.847 -6.947 497 HB2 TYR 65 1HB TYR 65 16.309 -7.398 -8.620 498 HB3 TYR 65 2HB TYR 65 16.180 -7.361 -6.865 499 HD1 TYR 65 HD2 TYR 65 18.021 -9.144 -9.581 500 HD2 TYR 65 HD1 TYR 65 18.098 -7.647 -5.599 501 HE1 TYR 65 HE2 TYR 65 20.395 -9.761 -9.401 502 HE2 TYR 65 HE1 TYR 65 20.473 -8.259 -5.409 503 HH TYR 65 HH TYR 65 22.120 -9.567 -6.372 504 H PHE 66 H PHE 66 13.399 -10.239 -8.718 505 HA PHE 66 HA PHE 66 11.617 -8.042 -8.141 506 HB2 PHE 66 1HB PHE 66 11.323 -9.230 -10.230 507 HB3 PHE 66 2HB PHE 66 11.135 -10.759 -9.377 508 HD1 PHE 66 HD1 PHE 66 9.573 -7.452 -9.934 509 HD2 PHE 66 HD2 PHE 66 9.039 -11.456 -8.592 510 HE1 PHE 66 HE1 PHE 66 7.141 -7.092 -9.839 511 HE2 PHE 66 HE2 PHE 66 6.606 -11.103 -8.496 512 HZ PHE 66 HZ PHE 66 5.654 -8.920 -9.121 513 H LEU 67 H LEU 67 11.886 -11.449 -7.153 514 HA LEU 67 HA LEU 67 9.733 -11.538 -5.401 515 HB2 LEU 67 1HB LEU 67 12.335 -12.964 -4.922 516 HB3 LEU 67 2HB LEU 67 10.712 -13.479 -4.466 517 HG LEU 67 HG LEU 67 11.812 -13.359 -7.274 518 HD11 LEU 67 1HD1 LEU 67 11.744 -15.434 -5.209 519 HD12 LEU 67 2HD1 LEU 67 12.751 -15.294 -6.649 520 HD13 LEU 67 3HD1 LEU 67 11.115 -15.941 -6.776 521 HD21 LEU 67 3HD2 LEU 67 9.653 -13.197 -7.837 522 HD22 LEU 67 1HD2 LEU 67 9.102 -13.585 -6.207 523 HD23 LEU 67 2HD2 LEU 67 9.537 -14.881 -7.322 524 H GLN 68 H GLN 68 12.790 -9.983 -5.063 525 HA GLN 68 HA GLN 68 13.044 -9.882 -2.282 526 HB2 GLN 68 1HB GLN 68 14.480 -8.918 -4.401 527 HB3 GLN 68 2HB GLN 68 13.843 -7.436 -3.702 528 HG2 GLN 68 1HG GLN 68 15.059 -7.643 -1.795 529 HG3 GLN 68 2HG GLN 68 15.068 -9.405 -1.859 530 HE21 GLN 68 2HE2 GLN 68 16.106 -9.957 -4.268 531 HE22 GLN 68 1HE2 GLN 68 17.718 -9.351 -4.398 532 H ARG 69 H ARG 69 10.742 -8.433 -4.327 533 HA ARG 69 HA ARG 69 10.123 -6.228 -2.561 534 HB2 ARG 69 1HB ARG 69 9.273 -7.144 -5.226 535 HB3 ARG 69 2HB ARG 69 8.000 -6.397 -4.270 536 HG2 ARG 69 1HG ARG 69 10.666 -5.078 -4.645 537 HG3 ARG 69 2HG ARG 69 9.360 -4.899 -5.819 538 HD2 ARG 69 1HD ARG 69 8.968 -3.081 -4.481 539 HD3 ARG 69 2HD ARG 69 7.957 -4.288 -3.686 540 HE ARG 69 HE ARG 69 10.619 -4.163 -2.626 541 HH11 ARG 69 1HH1 ARG 69 7.432 -2.769 -2.492 542 HH12 ARG 69 2HH1 ARG 69 7.616 -2.179 -0.874 543 HH21 ARG 69 1HH2 ARG 69 10.874 -3.391 -0.494 544 HH22 ARG 69 2HH2 ARG 69 9.574 -2.533 0.261 545 H PHE 70 H PHE 70 8.446 -9.184 -3.634 546 HA PHE 70 HA PHE 70 6.414 -8.879 -1.609 547 HB2 PHE 70 1HB PHE 70 6.979 -11.013 -3.665 548 HB3 PHE 70 2HB PHE 70 5.680 -11.155 -2.486 549 HD1 PHE 70 HD1 PHE 70 3.924 -9.301 -2.437 550 HD2 PHE 70 HD2 PHE 70 6.644 -9.873 -5.660 551 HE1 PHE 70 HE1 PHE 70 2.439 -8.011 -3.915 552 HE2 PHE 70 HE2 PHE 70 5.164 -8.583 -7.143 553 HZ PHE 70 HZ PHE 70 3.059 -7.650 -6.271 554 H GLU 71 H GLU 71 8.684 -11.534 -2.343 555 HA GLU 71 HA GLU 71 8.389 -12.886 0.070 556 HB2 GLU 71 1HB GLU 71 9.462 -13.939 -1.818 557 HB3 GLU 71 2HB GLU 71 10.758 -12.751 -1.798 558 HG2 GLU 71 1HG GLU 71 11.590 -14.766 -0.852 559 HG3 GLU 71 2HG GLU 71 11.410 -13.590 0.448 560 H SER 72 H SER 72 10.578 -10.266 -0.815 561 HA SER 72 HA SER 72 11.847 -8.849 0.434 562 HB2 SER 72 1HB SER 72 9.668 -8.717 1.746 563 HB3 SER 72 2HB SER 72 10.381 -9.878 2.866 564 HG SER 72 HG SER 72 11.566 -8.343 3.677 565 H GLY 73 H GLY 73 12.356 -11.893 0.214 566 HA2 GLY 73 1HA GLY 73 14.569 -11.903 2.166 567 HA3 GLY 73 2HA GLY 73 13.558 -13.324 1.948 568 H ALA 74 H ALA 74 13.324 -12.978 -0.935 569 HA ALA 74 HA ALA 74 15.413 -14.577 -1.804 570 HB1 ALA 74 1HB ALA 74 14.270 -14.617 -3.716 571 HB2 ALA 74 2HB ALA 74 13.108 -13.552 -2.922 572 HB3 ALA 74 3HB ALA 74 14.393 -12.869 -3.919 573 H ARG 75 H ARG 75 16.838 -13.843 -3.779 574 HA ARG 75 HA ARG 75 18.105 -11.263 -3.171 575 HB2 ARG 75 1HB ARG 75 20.277 -12.707 -3.837 576 HB3 ARG 75 2HB ARG 75 19.739 -12.482 -2.178 577 HG2 ARG 75 1HG ARG 75 18.978 -14.626 -1.984 578 HG3 ARG 75 2HG ARG 75 18.654 -14.784 -3.711 579 HD2 ARG 75 1HD ARG 75 20.734 -15.510 -4.160 580 HD3 ARG 75 2HD ARG 75 21.477 -14.382 -3.027 581 HE ARG 75 HE ARG 75 21.476 -16.034 -1.445 582 HH11 ARG 75 1HH1 ARG 75 19.294 -16.918 -4.009 583 HH12 ARG 75 2HH1 ARG 75 19.015 -18.515 -3.398 584 HH21 ARG 75 1HH2 ARG 75 21.117 -18.134 -0.630 585 HH22 ARG 75 2HH2 ARG 75 20.051 -19.205 -1.475 586 H VAL 76 H VAL 76 18.278 -14.016 -5.437 587 HA VAL 76 HA VAL 76 17.993 -12.143 -7.664 588 HB VAL 76 HB VAL 76 20.129 -14.259 -7.771 589 HG11 VAL 76 1HG1 VAL 76 19.947 -13.655 -9.926 590 HG12 VAL 76 2HG1 VAL 76 19.105 -12.153 -9.538 591 HG13 VAL 76 3HG1 VAL 76 20.864 -12.234 -9.428 592 HG21 VAL 76 3HG2 VAL 76 21.030 -12.981 -6.076 593 HG22 VAL 76 1HG2 VAL 76 21.663 -12.161 -7.504 594 HG23 VAL 76 2HG2 VAL 76 20.272 -11.495 -6.648 595 H LEU 77 H LEU 77 17.425 -13.187 -9.684 596 HA LEU 77 HA LEU 77 15.966 -15.695 -9.219 597 HB2 LEU 77 1HB LEU 77 15.549 -13.358 -11.022 598 HB3 LEU 77 2HB LEU 77 14.922 -14.932 -11.505 599 HG LEU 77 HG LEU 77 14.201 -14.121 -8.778 600 HD11 LEU 77 1HD1 LEU 77 12.316 -12.684 -9.921 601 HD12 LEU 77 2HD1 LEU 77 13.569 -12.416 -11.131 602 HD13 LEU 77 3HD1 LEU 77 13.856 -11.965 -9.451 603 HD21 LEU 77 3HD2 LEU 77 13.188 -15.704 -10.981 604 HD22 LEU 77 1HD2 LEU 77 11.941 -14.666 -10.288 605 HD23 LEU 77 2HD2 LEU 77 12.819 -15.798 -9.258 606 H THR 78 H THR 78 15.606 -16.758 -11.600 607 HA THR 78 HA THR 78 18.333 -17.333 -12.545 608 HB THR 78 HB THR 78 17.613 -19.507 -13.184 609 HG1 THR 78 HG1 THR 78 14.948 -18.834 -12.450 610 HG21 THR 78 3HG2 THR 78 16.895 -20.471 -11.104 611 HG22 THR 78 1HG2 THR 78 16.223 -18.932 -10.567 612 HG23 THR 78 2HG2 THR 78 17.968 -19.120 -10.741 613 H ALA 79 H ALA 79 18.374 -18.135 -14.885 614 HA ALA 79 HA ALA 79 17.412 -16.037 -16.552 615 HB1 ALA 79 1HB ALA 79 19.474 -17.794 -16.721 616 HB2 ALA 79 2HB ALA 79 18.343 -18.476 -17.890 617 HB3 ALA 79 3HB ALA 79 18.886 -16.807 -18.059 618 H SER 80 H SER 80 16.011 -18.903 -15.436 619 HA SER 80 HA SER 80 14.326 -19.362 -17.741 620 HB2 SER 80 1HB SER 80 14.867 -20.717 -15.180 621 HB3 SER 80 2HB SER 80 13.199 -20.840 -15.740 622 HG SER 80 HG SER 80 14.864 -22.456 -16.492 623 H GLU 81 H GLU 81 13.760 -18.419 -14.348 624 HA GLU 81 HA GLU 81 11.044 -17.826 -14.612 625 HB2 GLU 81 1HB GLU 81 13.129 -16.735 -12.722 626 HB3 GLU 81 2HB GLU 81 11.416 -16.365 -12.582 627 HG2 GLU 81 1HG GLU 81 10.874 -18.627 -12.133 628 HG3 GLU 81 2HG GLU 81 12.495 -19.168 -12.566 629 H THR 82 H THR 82 13.765 -15.517 -14.529 630 HA THR 82 HA THR 82 12.379 -13.211 -15.118 631 HB THR 82 HB THR 82 14.510 -12.354 -16.118 632 HG1 THR 82 HG1 THR 82 15.134 -15.088 -15.921 633 HG21 THR 82 3HG2 THR 82 15.501 -13.692 -13.713 634 HG22 THR 82 1HG2 THR 82 13.922 -12.937 -13.503 635 HG23 THR 82 2HG2 THR 82 15.295 -11.973 -14.049 636 H LYS 83 H LYS 83 13.829 -15.510 -17.408 637 HA LYS 83 HA LYS 83 13.314 -14.219 -19.785 638 HB2 LYS 83 1HB LYS 83 14.591 -16.234 -19.805 639 HB3 LYS 83 2HB LYS 83 13.266 -17.159 -19.112 640 HG2 LYS 83 1HG LYS 83 12.095 -17.224 -21.106 641 HG3 LYS 83 2HG LYS 83 12.943 -15.824 -21.766 642 HD2 LYS 83 1HD LYS 83 14.877 -17.071 -22.218 643 HD3 LYS 83 2HD LYS 83 14.379 -18.391 -21.158 644 HE2 LYS 83 1HE LYS 83 12.552 -18.927 -22.704 645 HE3 LYS 83 2HE LYS 83 13.070 -17.618 -23.765 646 HZ1 LYS 83 3HZ LYS 83 15.077 -18.739 -24.241 647 HZ2 LYS 83 1HZ LYS 83 13.850 -19.893 -24.399 648 HZ3 LYS 83 2HZ LYS 83 14.830 -19.883 -23.020 649 H THR 84 H THR 84 11.136 -16.315 -17.930 650 HA THR 84 HA THR 84 8.961 -15.831 -19.795 651 HB THR 84 HB THR 84 9.203 -18.073 -18.826 652 HG1 THR 84 HG1 THR 84 6.863 -16.749 -17.874 653 HG21 THR 84 3HG2 THR 84 10.133 -17.538 -16.665 654 HG22 THR 84 1HG2 THR 84 8.623 -18.417 -16.433 655 HG23 THR 84 2HG2 THR 84 8.668 -16.669 -16.207 656 H PHE 85 H PHE 85 9.874 -13.486 -18.596 657 HA PHE 85 HA PHE 85 7.627 -12.812 -16.812 658 HB2 PHE 85 1HB PHE 85 10.212 -12.703 -16.064 659 HB3 PHE 85 2HB PHE 85 10.046 -11.098 -16.768 660 HD1 PHE 85 HD2 PHE 85 8.640 -13.385 -14.222 661 HD2 PHE 85 HD1 PHE 85 8.972 -9.373 -15.605 662 HE1 PHE 85 HE2 PHE 85 7.599 -12.585 -12.142 663 HE2 PHE 85 HE1 PHE 85 7.931 -8.567 -13.526 664 HZ PHE 85 HZ PHE 85 7.242 -10.174 -11.792 665 H LEU 86 H LEU 86 9.861 -11.517 -19.252 666 HA LEU 86 HA LEU 86 7.763 -9.599 -20.028 667 HB2 LEU 86 1HB LEU 86 9.532 -8.143 -20.850 668 HB3 LEU 86 2HB LEU 86 9.726 -8.486 -19.133 669 HG LEU 86 HG LEU 86 11.423 -10.261 -19.875 670 HD11 LEU 86 1HD1 LEU 86 10.615 -9.211 -22.420 671 HD12 LEU 86 2HD1 LEU 86 11.673 -10.573 -22.055 672 HD13 LEU 86 3HD1 LEU 86 12.341 -8.944 -22.168 673 HD21 LEU 86 3HD2 LEU 86 13.182 -8.711 -19.736 674 HD22 LEU 86 1HD2 LEU 86 11.856 -7.978 -18.833 675 HD23 LEU 86 2HD2 LEU 86 12.221 -7.425 -20.467 676 H ALA 87 H ALA 87 9.859 -12.140 -21.032 677 HA ALA 87 HA ALA 87 9.514 -11.639 -23.863 678 HB1 ALA 87 1HB ALA 87 11.236 -13.032 -24.144 679 HB2 ALA 87 2HB ALA 87 11.423 -12.954 -22.392 680 HB3 ALA 87 3HB ALA 87 10.512 -14.275 -23.123 681 H ALA 88 H ALA 88 7.475 -12.717 -21.584 682 HA ALA 88 HA ALA 88 6.343 -14.943 -23.083 683 HB1 ALA 88 1HB ALA 88 5.626 -13.705 -20.433 684 HB2 ALA 88 2HB ALA 88 4.712 -15.017 -21.178 685 HB3 ALA 88 3HB ALA 88 6.399 -15.263 -20.727 686 H ALA 89 H ALA 89 5.588 -11.609 -22.229 687 HA ALA 89 HA ALA 89 3.096 -11.750 -23.763 688 HB1 ALA 89 1HB ALA 89 2.294 -10.114 -22.455 689 HB2 ALA 89 2HB ALA 89 3.630 -10.542 -21.386 690 HB3 ALA 89 3HB ALA 89 3.797 -9.194 -22.511 691 H ASP 90 H ASP 90 6.322 -10.910 -24.168 692 HA ASP 90 HA ASP 90 6.195 -8.631 -25.788 693 HB2 ASP 90 1HB ASP 90 8.409 -9.214 -26.538 694 HB3 ASP 90 2HB ASP 90 8.281 -9.618 -24.828 695 H HIS 91 H HIS 91 7.289 -9.109 -28.199 696 HA HIS 91 HA HIS 91 6.796 -9.634 -30.357 697 HB2 HIS 91 1HB HIS 91 5.489 -12.102 -29.196 698 HB3 HIS 91 2HB HIS 91 6.037 -11.883 -30.855 699 HD1 HIS 91 HD1 HIS 91 8.824 -10.569 -29.974 700 HD2 HIS 91 HD2 HIS 91 7.248 -14.185 -28.667 701 HE1 HIS 91 HE1 HIS 91 10.798 -11.925 -29.205 702 H ASP 92 H ASP 92 4.789 -8.324 -28.458 703 HA ASP 92 HA ASP 92 2.434 -8.653 -30.201 704 HB2 ASP 92 1HB ASP 92 2.433 -9.304 -27.592 705 HB3 ASP 92 2HB ASP 92 2.046 -7.591 -27.456 706 H GLY 93 H GLY 93 4.908 -6.648 -29.478 707 HA2 GLY 93 1HA GLY 93 3.371 -4.304 -30.359 708 HA3 GLY 93 2HA GLY 93 4.381 -4.165 -28.929 709 H ASP 94 H ASP 94 6.633 -4.172 -29.142 710 HA ASP 94 HA ASP 94 7.665 -4.043 -31.891 711 HB2 ASP 94 1HB ASP 94 7.263 -1.747 -30.891 712 HB3 ASP 94 2HB ASP 94 8.520 -2.129 -29.719 713 H GLY 95 H GLY 95 7.736 -5.992 -29.557 714 HA2 GLY 95 1HA GLY 95 9.358 -7.651 -29.178 715 HA3 GLY 95 2HA GLY 95 10.590 -6.554 -29.781 716 H LYS 96 H LYS 96 8.424 -5.208 -27.509 717 HA LYS 96 HA LYS 96 9.898 -5.948 -25.157 718 HB2 LYS 96 1HB LYS 96 10.703 -3.683 -24.627 719 HB3 LYS 96 2HB LYS 96 11.452 -4.318 -26.086 720 HG2 LYS 96 1HG LYS 96 9.016 -2.744 -26.535 721 HG3 LYS 96 2HG LYS 96 10.376 -1.846 -25.856 722 HD2 LYS 96 1HD LYS 96 10.554 -3.593 -28.308 723 HD3 LYS 96 2HD LYS 96 10.288 -1.849 -28.352 724 HE2 LYS 96 1HE LYS 96 12.580 -2.800 -26.745 725 HE3 LYS 96 2HE LYS 96 12.718 -2.978 -28.493 726 HZ1 LYS 96 3HZ LYS 96 12.422 -0.661 -28.789 727 HZ2 LYS 96 1HZ LYS 96 13.583 -0.843 -27.573 728 HZ3 LYS 96 2HZ LYS 96 11.995 -0.425 -27.170 729 H ILE 97 H ILE 97 8.839 -5.396 -23.262 730 HA ILE 97 HA ILE 97 6.053 -4.779 -23.542 731 HB ILE 97 HB ILE 97 7.518 -4.912 -20.921 732 HG12 ILE 97 1HG1 ILE 97 8.250 -6.861 -22.162 733 HG13 ILE 97 2HG1 ILE 97 7.080 -7.362 -20.945 734 HG21 ILE 97 1HG2 ILE 97 5.140 -6.206 -20.639 735 HG22 ILE 97 2HG2 ILE 97 5.413 -4.505 -20.268 736 HG23 ILE 97 3HG2 ILE 97 4.734 -4.968 -21.828 737 HD11 ILE 97 3HD1 ILE 97 5.819 -8.292 -22.497 738 HD12 ILE 97 1HD1 ILE 97 5.715 -6.769 -23.379 739 HD13 ILE 97 2HD1 ILE 97 7.044 -7.884 -23.698 740 H GLY 98 H GLY 98 4.942 -3.078 -22.369 741 HA2 GLY 98 1HA GLY 98 6.382 -0.855 -21.295 742 HA3 GLY 98 2HA GLY 98 5.820 -0.530 -22.928 743 H ALA 99 H ALA 99 4.610 -1.783 -19.821 744 HA ALA 99 HA ALA 99 2.574 -1.591 -18.804 745 HB1 ALA 99 1HB ALA 99 2.469 1.155 -20.020 746 HB2 ALA 99 2HB ALA 99 1.819 0.613 -18.472 747 HB3 ALA 99 3HB ALA 99 3.563 0.745 -18.698 748 H GLU 100 H GLU 100 2.288 -3.005 -21.087 749 HA GLU 100 HA GLU 100 -0.443 -2.451 -21.795 750 HB2 GLU 100 1HB GLU 100 -0.010 -2.430 -24.251 751 HB3 GLU 100 2HB GLU 100 0.587 -1.005 -23.413 752 HG2 GLU 100 1HG GLU 100 2.843 -2.141 -23.362 753 HG3 GLU 100 2HG GLU 100 2.168 -3.318 -24.486 754 H GLU 101 H GLU 101 2.465 -4.318 -22.612 755 HA GLU 101 HA GLU 101 0.981 -6.603 -23.489 756 HB2 GLU 101 1HB GLU 101 3.877 -6.584 -22.654 757 HB3 GLU 101 2HB GLU 101 3.085 -7.668 -23.788 758 HG2 GLU 101 1HG GLU 101 2.627 -5.445 -25.103 759 HG3 GLU 101 2HG GLU 101 4.006 -4.868 -24.168 760 H PHE 102 H PHE 102 2.821 -5.795 -20.564 761 HA PHE 102 HA PHE 102 2.538 -8.221 -19.225 762 HB2 PHE 102 1HB PHE 102 3.757 -5.861 -18.657 763 HB3 PHE 102 2HB PHE 102 2.395 -5.797 -17.543 764 HD1 PHE 102 HD2 PHE 102 2.000 -8.057 -16.206 765 HD2 PHE 102 HD1 PHE 102 5.696 -6.837 -17.928 766 HE1 PHE 102 HE2 PHE 102 3.208 -9.525 -14.645 767 HE2 PHE 102 HE1 PHE 102 6.911 -8.304 -16.370 768 HZ PHE 102 HZ PHE 102 5.667 -9.650 -14.725 769 H GLN 103 H GLN 103 0.238 -5.726 -19.834 770 HA GLN 103 HA GLN 103 -1.571 -6.412 -17.724 771 HB2 GLN 103 1HB GLN 103 -1.761 -4.696 -20.182 772 HB3 GLN 103 2HB GLN 103 -3.191 -5.050 -19.221 773 HG2 GLN 103 1HG GLN 103 -2.615 -3.180 -18.136 774 HG3 GLN 103 2HG GLN 103 -1.501 -4.248 -17.285 775 HE21 GLN 103 2HE2 GLN 103 0.652 -4.523 -18.438 776 HE22 GLN 103 1HE2 GLN 103 1.373 -3.082 -19.061 777 H GLU 104 H GLU 104 -1.524 -6.994 -21.235 778 HA GLU 104 HA GLU 104 -3.877 -8.575 -21.256 779 HB2 GLU 104 1HB GLU 104 -3.151 -9.240 -23.522 780 HB3 GLU 104 2HB GLU 104 -3.095 -7.500 -23.281 781 HG2 GLU 104 1HG GLU 104 -0.713 -7.550 -23.029 782 HG3 GLU 104 2HG GLU 104 -0.705 -9.313 -23.065 783 H MET 105 H MET 105 -0.567 -9.246 -20.520 784 HA MET 105 HA MET 105 -0.557 -12.029 -20.998 785 HB2 MET 105 1HB MET 105 1.564 -11.097 -20.752 786 HB3 MET 105 2HB MET 105 1.106 -10.181 -19.323 787 HG2 MET 105 1HG MET 105 1.424 -11.941 -17.916 788 HG3 MET 105 2HG MET 105 1.050 -13.140 -19.152 789 HE1 MET 105 3HE MET 105 4.266 -10.898 -17.709 790 HE2 MET 105 1HE MET 105 4.865 -10.658 -19.351 791 HE3 MET 105 2HE MET 105 3.242 -10.120 -18.918 792 H VAL 106 H VAL 106 -1.817 -10.084 -18.423 793 HA VAL 106 HA VAL 106 -2.339 -12.491 -16.813 794 HB VAL 106 HB VAL 106 -2.510 -9.598 -15.960 795 HG11 VAL 106 1HG1 VAL 106 -2.538 -12.079 -14.251 796 HG12 VAL 106 2HG1 VAL 106 -2.816 -10.413 -13.739 797 HG13 VAL 106 3HG1 VAL 106 -3.993 -11.229 -14.769 798 HG21 VAL 106 3HG2 VAL 106 -0.214 -10.135 -16.381 799 HG22 VAL 106 1HG2 VAL 106 -0.466 -10.147 -14.636 800 HG23 VAL 106 2HG2 VAL 106 -0.363 -11.668 -15.522 801 H GLN 107 H GLN 107 -3.907 -9.445 -17.804 802 HA GLN 107 HA GLN 107 -6.497 -10.137 -17.001 803 HB2 GLN 107 1HB GLN 107 -5.655 -8.302 -19.251 804 HB3 GLN 107 2HB GLN 107 -7.250 -8.347 -18.511 805 HG2 GLN 107 1HG GLN 107 -4.671 -7.356 -17.375 806 HG3 GLN 107 2HG GLN 107 -6.227 -6.536 -17.495 807 HE21 GLN 107 2HE2 GLN 107 -4.370 -8.924 -15.759 808 HE22 GLN 107 1HE2 GLN 107 -5.372 -8.969 -14.353 809 H SER 108 H SER 108 -4.685 -10.915 -19.879 810 HA SER 108 HA SER 108 -6.974 -12.508 -20.826 811 HB2 SER 108 1HB SER 108 -4.988 -10.953 -22.499 812 HB3 SER 108 2HB SER 108 -6.168 -12.089 -23.152 813 HG SER 108 HG SER 108 -7.598 -10.568 -23.034 Start of MODEL 3 1 H1 SER 1 H SER 1 2.769 -1.629 0.959 2 HA SER 1 HA SER 1 0.732 -0.481 -0.759 3 HB2 SER 1 1HB SER 1 3.753 -0.335 -0.817 4 HB3 SER 1 2HB SER 1 2.707 0.476 -1.982 5 HG SER 1 HG SER 1 1.850 1.703 -0.320 6 H LEU 2 H LEU 2 3.537 -2.640 -1.195 7 HA LEU 2 HA LEU 2 3.185 -3.326 -3.831 8 HB2 LEU 2 1HB LEU 2 5.122 -4.118 -2.817 9 HB3 LEU 2 2HB LEU 2 4.238 -4.841 -1.475 10 HG LEU 2 HG LEU 2 3.477 -6.643 -2.901 11 HD11 LEU 2 1HD1 LEU 2 4.337 -4.839 -5.004 12 HD12 LEU 2 2HD1 LEU 2 3.227 -6.208 -5.069 13 HD13 LEU 2 3HD1 LEU 2 4.964 -6.474 -5.220 14 HD21 LEU 2 3HD2 LEU 2 6.408 -6.046 -2.823 15 HD22 LEU 2 1HD2 LEU 2 5.811 -7.513 -3.599 16 HD23 LEU 2 2HD2 LEU 2 5.480 -7.223 -1.891 17 H THR 3 H THR 3 1.780 -4.980 -1.008 18 HA THR 3 HA THR 3 -0.077 -6.366 -2.816 19 HB THR 3 HB THR 3 -0.442 -7.986 -1.107 20 HG1 THR 3 HG1 THR 3 1.046 -6.247 0.595 21 HG21 THR 3 3HG2 THR 3 2.489 -7.481 -0.776 22 HG22 THR 3 1HG2 THR 3 1.840 -7.888 -2.364 23 HG23 THR 3 2HG2 THR 3 1.637 -9.006 -1.016 24 H ASP 4 H ASP 4 -0.574 -3.668 -2.342 25 HA ASP 4 HA ASP 4 -2.472 -3.345 -0.217 26 HB2 ASP 4 1HB ASP 4 -1.094 -1.473 -1.101 27 HB3 ASP 4 2HB ASP 4 -1.986 -1.569 -2.616 28 H ILE 5 H ILE 5 -2.834 -3.159 -3.764 29 HA ILE 5 HA ILE 5 -5.650 -3.292 -3.723 30 HB ILE 5 HB ILE 5 -3.920 -2.651 -5.642 31 HG12 ILE 5 1HG1 ILE 5 -6.044 -3.509 -7.181 32 HG13 ILE 5 2HG1 ILE 5 -6.753 -3.391 -5.574 33 HG21 ILE 5 1HG2 ILE 5 -3.136 -5.004 -5.836 34 HG22 ILE 5 2HG2 ILE 5 -4.741 -5.444 -6.417 35 HG23 ILE 5 3HG2 ILE 5 -3.742 -4.327 -7.347 36 HD11 ILE 5 3HD1 ILE 5 -7.066 -1.329 -6.770 37 HD12 ILE 5 1HD1 ILE 5 -5.956 -1.071 -5.424 38 HD13 ILE 5 2HD1 ILE 5 -5.332 -1.202 -7.069 39 H LEU 6 H LEU 6 -3.213 -5.719 -3.495 40 HA LEU 6 HA LEU 6 -5.259 -7.816 -3.804 41 HB2 LEU 6 1HB LEU 6 -2.810 -7.555 -5.088 42 HB3 LEU 6 2HB LEU 6 -2.522 -8.765 -3.839 43 HG LEU 6 HG LEU 6 -4.781 -9.755 -4.886 44 HD11 LEU 6 1HD1 LEU 6 -3.762 -9.294 -7.488 45 HD12 LEU 6 2HD1 LEU 6 -4.019 -7.727 -6.721 46 HD13 LEU 6 3HD1 LEU 6 -5.349 -8.880 -6.839 47 HD21 LEU 6 3HD2 LEU 6 -3.446 -11.457 -5.460 48 HD22 LEU 6 1HD2 LEU 6 -2.147 -10.473 -4.786 49 HD23 LEU 6 2HD2 LEU 6 -2.459 -10.451 -6.522 50 H SER 7 H SER 7 -3.954 -9.921 -2.644 51 HA SER 7 HA SER 7 -3.659 -9.040 0.154 52 HB2 SER 7 1HB SER 7 -5.726 -10.456 -0.574 53 HB3 SER 7 2HB SER 7 -4.584 -11.799 -0.589 54 HG SER 7 HG SER 7 -5.367 -10.172 1.583 55 HA PRO 8 HA PRO 8 0.428 -10.750 -0.302 56 HB2 PRO 8 1HB PRO 8 1.216 -10.266 2.250 57 HB3 PRO 8 2HB PRO 8 1.135 -9.005 1.014 58 HG2 PRO 8 1HG PRO 8 -0.828 -9.667 3.175 59 HG3 PRO 8 2HG PRO 8 -0.259 -8.079 2.629 60 HD2 PRO 8 1HD PRO 8 -2.642 -9.114 1.865 61 HD3 PRO 8 2HD PRO 8 -1.681 -8.053 0.815 62 H SER 9 H SER 9 -2.144 -11.891 1.584 63 HA SER 9 HA SER 9 -0.676 -14.039 2.854 64 HB2 SER 9 1HB SER 9 -3.653 -13.504 2.706 65 HB3 SER 9 2HB SER 9 -2.887 -14.740 3.703 66 HG SER 9 HG SER 9 -2.789 -11.938 3.958 67 H ASP 10 H ASP 10 -1.442 -13.547 -0.219 68 HA ASP 10 HA ASP 10 -1.992 -16.398 -0.726 69 HB2 ASP 10 1HB ASP 10 -3.155 -13.949 -1.997 70 HB3 ASP 10 2HB ASP 10 -2.975 -15.414 -2.959 71 H ILE 11 H ILE 11 -0.309 -13.483 -1.720 72 HA ILE 11 HA ILE 11 0.963 -14.495 -4.011 73 HB ILE 11 HB ILE 11 1.956 -12.378 -2.099 74 HG12 ILE 11 1HG1 ILE 11 0.787 -11.673 -4.726 75 HG13 ILE 11 2HG1 ILE 11 -0.342 -12.282 -3.521 76 HG21 ILE 11 1HG2 ILE 11 3.143 -13.572 -4.433 77 HG22 ILE 11 2HG2 ILE 11 2.853 -11.853 -4.690 78 HG23 ILE 11 3HG2 ILE 11 3.817 -12.387 -3.313 79 HD11 ILE 11 3HD1 ILE 11 -0.159 -10.445 -2.226 80 HD12 ILE 11 1HD1 ILE 11 1.538 -10.188 -2.633 81 HD13 ILE 11 2HD1 ILE 11 0.275 -9.706 -3.767 82 H ALA 12 H ALA 12 1.690 -14.799 -0.608 83 HA ALA 12 HA ALA 12 4.358 -15.750 -0.927 84 HB1 ALA 12 1HB ALA 12 4.414 -15.525 1.281 85 HB2 ALA 12 2HB ALA 12 2.731 -14.998 1.213 86 HB3 ALA 12 3HB ALA 12 3.113 -16.698 1.488 87 H ALA 13 H ALA 13 1.197 -17.247 -0.883 88 HA ALA 13 HA ALA 13 1.960 -19.911 -0.452 89 HB1 ALA 13 1HB ALA 13 -0.347 -18.997 -2.159 90 HB2 ALA 13 2HB ALA 13 -0.188 -20.522 -1.286 91 HB3 ALA 13 3HB ALA 13 -0.374 -19.012 -0.395 92 H ALA 14 H ALA 14 2.393 -17.861 -3.164 93 HA ALA 14 HA ALA 14 2.821 -20.103 -4.991 94 HB1 ALA 14 1HB ALA 14 1.571 -17.909 -5.570 95 HB2 ALA 14 2HB ALA 14 3.191 -17.233 -5.749 96 HB3 ALA 14 3HB ALA 14 2.689 -18.599 -6.746 97 H LEU 15 H LEU 15 4.573 -17.328 -3.634 98 HA LEU 15 HA LEU 15 7.023 -17.696 -4.874 99 HB2 LEU 15 1HB LEU 15 6.352 -16.665 -2.129 100 HB3 LEU 15 2HB LEU 15 7.979 -16.615 -2.804 101 HG LEU 15 HG LEU 15 5.557 -15.198 -3.917 102 HD11 LEU 15 1HD1 LEU 15 7.193 -13.225 -3.297 103 HD12 LEU 15 2HD1 LEU 15 7.771 -14.390 -2.106 104 HD13 LEU 15 3HD1 LEU 15 6.076 -13.903 -2.112 105 HD21 LEU 15 3HD2 LEU 15 7.096 -15.868 -5.677 106 HD22 LEU 15 1HD2 LEU 15 8.445 -15.157 -4.789 107 HD23 LEU 15 2HD2 LEU 15 7.165 -14.123 -5.424 108 H ARG 16 H ARG 16 5.548 -19.495 -2.297 109 HA ARG 16 HA ARG 16 8.019 -20.859 -1.607 110 HB2 ARG 16 1HB ARG 16 6.441 -20.315 0.178 111 HB3 ARG 16 2HB ARG 16 5.189 -21.256 -0.621 112 HG2 ARG 16 1HG ARG 16 7.733 -22.622 0.066 113 HG3 ARG 16 2HG ARG 16 6.610 -22.234 1.372 114 HD2 ARG 16 1HD ARG 16 4.836 -23.313 -0.190 115 HD3 ARG 16 2HD ARG 16 6.232 -24.043 -0.980 116 HE ARG 16 HE ARG 16 6.384 -24.452 1.806 117 HH11 ARG 16 1HH1 ARG 16 4.612 -25.499 -1.002 118 HH12 ARG 16 2HH1 ARG 16 4.248 -27.062 -0.350 119 HH21 ARG 16 1HH2 ARG 16 5.911 -26.507 2.675 120 HH22 ARG 16 2HH2 ARG 16 4.987 -27.634 1.741 121 H ASP 17 H ASP 17 4.788 -21.857 -2.749 122 HA ASP 17 HA ASP 17 5.356 -24.501 -3.314 123 HB2 ASP 17 1HB ASP 17 3.131 -23.081 -3.487 124 HB3 ASP 17 2HB ASP 17 3.584 -22.993 -5.187 125 H CYS 18 H CYS 18 5.841 -21.651 -5.351 126 HA CYS 18 HA CYS 18 7.210 -23.341 -7.327 127 HB2 CYS 18 1HB CYS 18 6.173 -20.511 -7.599 128 HB3 CYS 18 2HB CYS 18 6.945 -21.443 -8.876 129 HG CYS 18 HG CYS 18 4.512 -21.839 -9.745 130 H GLN 19 H GLN 19 8.287 -22.336 -4.724 131 HA GLN 19 HA GLN 19 10.100 -20.243 -5.107 132 HB2 GLN 19 1HB GLN 19 11.143 -20.944 -3.100 133 HB3 GLN 19 2HB GLN 19 9.440 -21.342 -2.919 134 HG2 GLN 19 1HG GLN 19 9.913 -23.665 -3.478 135 HG3 GLN 19 2HG GLN 19 11.620 -23.272 -3.683 136 HE21 GLN 19 2HE2 GLN 19 9.211 -22.397 -1.231 137 HE22 GLN 19 1HE2 GLN 19 10.121 -22.979 0.118 138 H ALA 20 H ALA 20 10.152 -23.488 -6.236 139 HA ALA 20 HA ALA 20 12.963 -23.759 -6.586 140 HB1 ALA 20 1HB ALA 20 12.492 -25.825 -7.332 141 HB2 ALA 20 2HB ALA 20 10.877 -25.481 -6.711 142 HB3 ALA 20 3HB ALA 20 11.229 -25.256 -8.425 143 HA PRO 21 HA PRO 21 13.752 -21.543 -10.290 144 HB2 PRO 21 1HB PRO 21 15.484 -23.183 -11.587 145 HB3 PRO 21 2HB PRO 21 15.928 -22.265 -10.143 146 HG2 PRO 21 1HG PRO 21 15.129 -25.139 -10.389 147 HG3 PRO 21 2HG PRO 21 16.431 -24.419 -9.425 148 HD2 PRO 21 1HD PRO 21 14.053 -25.141 -8.351 149 HD3 PRO 21 2HD PRO 21 14.996 -23.765 -7.744 150 H ASP 22 H ASP 22 12.829 -21.256 -12.241 151 HA ASP 22 HA ASP 22 11.579 -21.627 -14.105 152 HB2 ASP 22 1HB ASP 22 13.557 -23.297 -14.425 153 HB3 ASP 22 2HB ASP 22 12.350 -24.527 -14.059 154 H SER 23 H SER 23 10.550 -22.202 -11.346 155 HA SER 23 HA SER 23 8.310 -23.966 -12.097 156 HB2 SER 23 1HB SER 23 9.915 -24.568 -10.117 157 HB3 SER 23 2HB SER 23 8.990 -23.349 -9.240 158 HG SER 23 HG SER 23 8.226 -25.620 -9.157 159 H PHE 24 H PHE 24 9.257 -20.826 -11.112 160 HA PHE 24 HA PHE 24 6.485 -20.085 -10.485 161 HB2 PHE 24 1HB PHE 24 8.010 -19.396 -8.767 162 HB3 PHE 24 2HB PHE 24 9.108 -18.688 -9.947 163 HD1 PHE 24 HD1 PHE 24 5.587 -18.385 -8.765 164 HD2 PHE 24 HD2 PHE 24 9.035 -16.418 -10.301 165 HE1 PHE 24 HE1 PHE 24 4.461 -16.213 -8.502 166 HE2 PHE 24 HE2 PHE 24 7.915 -14.243 -10.039 167 HZ PHE 24 HZ PHE 24 5.625 -14.138 -9.138 168 H SER 25 H SER 25 5.491 -18.323 -11.514 169 HA SER 25 HA SER 25 6.791 -16.933 -13.666 170 HB2 SER 25 1HB SER 25 4.768 -19.093 -14.241 171 HB3 SER 25 2HB SER 25 5.037 -17.754 -15.357 172 HG SER 25 HG SER 25 6.367 -19.938 -15.333 173 HA PRO 26 HA PRO 26 3.732 -13.920 -12.763 174 HB2 PRO 26 1HB PRO 26 3.436 -12.697 -15.169 175 HB3 PRO 26 2HB PRO 26 4.876 -12.501 -14.162 176 HG2 PRO 26 1HG PRO 26 4.450 -14.281 -16.531 177 HG3 PRO 26 2HG PRO 26 5.855 -13.279 -16.122 178 HD2 PRO 26 1HD PRO 26 5.788 -15.949 -15.672 179 HD3 PRO 26 2HD PRO 26 6.679 -14.826 -14.625 180 H LYS 27 H LYS 27 3.136 -15.863 -15.665 181 HA LYS 27 HA LYS 27 0.272 -15.362 -15.492 182 HB2 LYS 27 1HB LYS 27 0.127 -16.617 -17.586 183 HB3 LYS 27 2HB LYS 27 1.333 -15.342 -17.702 184 HG2 LYS 27 1HG LYS 27 2.846 -16.825 -18.328 185 HG3 LYS 27 2HG LYS 27 2.640 -17.691 -16.803 186 HD2 LYS 27 1HD LYS 27 2.238 -19.230 -18.593 187 HD3 LYS 27 2HD LYS 27 0.690 -18.872 -17.823 188 HE2 LYS 27 1HE LYS 27 0.091 -17.368 -19.590 189 HE3 LYS 27 2HE LYS 27 1.699 -17.488 -20.303 190 HZ1 LYS 27 3HZ LYS 27 0.138 -19.945 -19.972 191 HZ2 LYS 27 1HZ LYS 27 1.269 -19.539 -21.162 192 HZ3 LYS 27 2HZ LYS 27 -0.291 -18.889 -21.222 193 H LYS 28 H LYS 28 1.732 -16.902 -13.425 194 HA LYS 28 HA LYS 28 0.108 -19.351 -13.573 195 HB2 LYS 28 1HB LYS 28 3.018 -19.059 -13.007 196 HB3 LYS 28 2HB LYS 28 2.124 -20.267 -12.092 197 HG2 LYS 28 1HG LYS 28 1.724 -20.259 -15.019 198 HG3 LYS 28 2HG LYS 28 3.304 -20.780 -14.429 199 HD2 LYS 28 1HD LYS 28 2.203 -22.782 -14.389 200 HD3 LYS 28 2HD LYS 28 1.810 -22.202 -12.769 201 HE2 LYS 28 1HE LYS 28 -0.184 -23.053 -13.833 202 HE3 LYS 28 2HE LYS 28 -0.316 -21.305 -13.641 203 HZ1 LYS 28 3HZ LYS 28 0.077 -20.965 -15.913 204 HZ2 LYS 28 1HZ LYS 28 -1.017 -22.254 -15.854 205 HZ3 LYS 28 2HZ LYS 28 0.620 -22.548 -16.158 206 H PHE 29 H PHE 29 1.722 -16.956 -11.554 207 HA PHE 29 HA PHE 29 0.399 -17.903 -9.156 208 HB2 PHE 29 1HB PHE 29 1.800 -16.502 -7.972 209 HB3 PHE 29 2HB PHE 29 2.780 -16.806 -9.402 210 HD1 PHE 29 HD2 PHE 29 2.349 -15.089 -11.381 211 HD2 PHE 29 HD1 PHE 29 1.576 -14.335 -7.263 212 HE1 PHE 29 HE2 PHE 29 2.487 -12.669 -11.801 213 HE2 PHE 29 HE1 PHE 29 1.712 -11.914 -7.677 214 HZ PHE 29 HZ PHE 29 2.169 -11.078 -9.948 215 H PHE 30 H PHE 30 -0.360 -15.877 -11.724 216 HA PHE 30 HA PHE 30 -1.708 -13.739 -10.621 217 HB2 PHE 30 1HB PHE 30 -2.933 -13.585 -12.674 218 HB3 PHE 30 2HB PHE 30 -1.323 -14.178 -13.070 219 HD1 PHE 30 HD1 PHE 30 -1.037 -16.699 -13.367 220 HD2 PHE 30 HD2 PHE 30 -4.820 -14.751 -13.357 221 HE1 PHE 30 HE1 PHE 30 -2.030 -18.629 -14.526 222 HE2 PHE 30 HE2 PHE 30 -5.820 -16.678 -14.514 223 HZ PHE 30 HZ PHE 30 -4.425 -18.621 -15.100 224 H GLN 31 H GLN 31 -2.699 -17.088 -10.859 225 HA GLN 31 HA GLN 31 -5.380 -16.503 -9.905 226 HB2 GLN 31 1HB GLN 31 -5.879 -18.779 -10.298 227 HB3 GLN 31 2HB GLN 31 -4.831 -18.294 -11.624 228 HG2 GLN 31 1HG GLN 31 -2.969 -19.214 -9.968 229 HG3 GLN 31 2HG GLN 31 -4.332 -20.174 -9.396 230 HE21 GLN 31 2HE2 GLN 31 -1.771 -20.443 -11.225 231 HE22 GLN 31 1HE2 GLN 31 -2.347 -21.473 -12.487 232 H ILE 32 H ILE 32 -2.343 -17.745 -8.702 233 HA ILE 32 HA ILE 32 -3.349 -18.780 -6.251 234 HB ILE 32 HB ILE 32 -0.554 -17.883 -6.961 235 HG12 ILE 32 1HG1 ILE 32 -1.379 -20.740 -6.701 236 HG13 ILE 32 2HG1 ILE 32 -1.833 -19.873 -8.165 237 HG21 ILE 32 1HG2 ILE 32 -0.459 -17.925 -4.671 238 HG22 ILE 32 2HG2 ILE 32 -1.714 -19.155 -4.532 239 HG23 ILE 32 3HG2 ILE 32 -0.087 -19.609 -5.040 240 HD11 ILE 32 3HD1 ILE 32 0.973 -19.572 -7.375 241 HD12 ILE 32 1HD1 ILE 32 0.489 -21.207 -7.826 242 HD13 ILE 32 2HD1 ILE 32 0.259 -19.874 -8.959 243 H SER 33 H SER 33 -1.358 -15.880 -6.864 244 HA SER 33 HA SER 33 -1.667 -14.764 -4.320 245 HB2 SER 33 1HB SER 33 -1.047 -12.591 -5.487 246 HB3 SER 33 2HB SER 33 0.081 -13.928 -5.708 247 HG SER 33 HG SER 33 -0.752 -14.265 -7.750 248 H GLY 34 H GLY 34 -3.418 -14.015 -7.335 249 HA2 GLY 34 1HA GLY 34 -5.910 -13.866 -6.975 250 HA3 GLY 34 2HA GLY 34 -5.510 -12.751 -5.677 251 H MET 35 H MET 35 -3.807 -12.831 -8.737 252 HA MET 35 HA MET 35 -4.474 -10.052 -9.180 253 HB2 MET 35 1HB MET 35 -2.679 -11.999 -10.621 254 HB3 MET 35 2HB MET 35 -2.963 -10.364 -11.202 255 HG2 MET 35 1HG MET 35 -2.255 -9.761 -8.724 256 HG3 MET 35 2HG MET 35 -1.422 -11.308 -8.856 257 HE1 MET 35 3HE MET 35 -0.762 -10.638 -12.480 258 HE2 MET 35 1HE MET 35 0.868 -10.888 -11.853 259 HE3 MET 35 2HE MET 35 -0.468 -11.868 -11.249 260 H SER 36 H SER 36 -5.615 -13.107 -10.200 261 HA SER 36 HA SER 36 -6.521 -12.657 -12.772 262 HB2 SER 36 1HB SER 36 -7.953 -14.497 -12.475 263 HB3 SER 36 2HB SER 36 -6.652 -14.794 -11.322 264 HG SER 36 HG SER 36 -8.466 -15.078 -10.157 265 H LYS 37 H LYS 37 -7.841 -11.551 -9.725 266 HA LYS 37 HA LYS 37 -10.366 -10.713 -10.670 267 HB2 LYS 37 1HB LYS 37 -8.789 -9.530 -8.380 268 HB3 LYS 37 2HB LYS 37 -10.530 -9.443 -8.618 269 HG2 LYS 37 1HG LYS 37 -10.514 -11.984 -8.479 270 HG3 LYS 37 2HG LYS 37 -8.866 -11.823 -7.868 271 HD2 LYS 37 1HD LYS 37 -11.045 -10.209 -6.622 272 HD3 LYS 37 2HD LYS 37 -10.905 -11.921 -6.218 273 HE2 LYS 37 1HE LYS 37 -9.582 -10.980 -4.594 274 HE3 LYS 37 2HE LYS 37 -8.386 -11.314 -5.845 275 HZ1 LYS 37 3HZ LYS 37 -7.947 -9.162 -6.051 276 HZ2 LYS 37 1HZ LYS 37 -8.872 -8.894 -4.660 277 HZ3 LYS 37 2HZ LYS 37 -9.582 -8.751 -6.189 278 H LYS 38 H LYS 38 -7.203 -9.223 -10.684 279 HA LYS 38 HA LYS 38 -7.801 -6.568 -11.096 280 HB2 LYS 38 1HB LYS 38 -5.626 -8.160 -12.467 281 HB3 LYS 38 2HB LYS 38 -5.668 -6.409 -12.303 282 HG2 LYS 38 1HG LYS 38 -5.329 -8.456 -10.130 283 HG3 LYS 38 2HG LYS 38 -4.177 -7.228 -10.659 284 HD2 LYS 38 1HD LYS 38 -4.988 -6.118 -8.860 285 HD3 LYS 38 2HD LYS 38 -6.249 -5.650 -10.003 286 HE2 LYS 38 1HE LYS 38 -7.807 -7.008 -9.049 287 HE3 LYS 38 2HE LYS 38 -6.615 -8.204 -8.543 288 HZ1 LYS 38 3HZ LYS 38 -6.804 -5.539 -7.270 289 HZ2 LYS 38 1HZ LYS 38 -6.027 -6.925 -6.689 290 HZ3 LYS 38 2HZ LYS 38 -7.716 -6.858 -6.731 291 H SER 39 H SER 39 -7.517 -5.358 -13.220 292 HA SER 39 HA SER 39 -8.542 -6.749 -15.556 293 HB2 SER 39 1HB SER 39 -10.300 -4.819 -15.764 294 HB3 SER 39 2HB SER 39 -10.659 -6.215 -14.748 295 HG SER 39 HG SER 39 -10.916 -4.806 -13.220 296 H SER 40 H SER 40 -6.045 -5.629 -15.139 297 HA SER 40 HA SER 40 -4.516 -4.241 -16.094 298 HB2 SER 40 1HB SER 40 -5.473 -5.026 -18.195 299 HB3 SER 40 2HB SER 40 -6.750 -3.815 -18.094 300 HG SER 40 HG SER 40 -5.360 -2.720 -19.260 301 H SER 41 H SER 41 -6.608 -3.220 -14.168 302 HA SER 41 HA SER 41 -6.292 -0.352 -14.772 303 HB2 SER 41 1HB SER 41 -8.650 -1.015 -14.870 304 HB3 SER 41 2HB SER 41 -8.538 -1.697 -13.248 305 HG SER 41 HG SER 41 -9.397 0.369 -13.113 306 H GLN 42 H GLN 42 -5.511 -2.882 -12.694 307 HA GLN 42 HA GLN 42 -4.685 -0.977 -10.604 308 HB2 GLN 42 1HB GLN 42 -5.472 -3.868 -10.204 309 HB3 GLN 42 2HB GLN 42 -4.980 -2.742 -8.946 310 HG2 GLN 42 1HG GLN 42 -7.100 -2.197 -8.669 311 HG3 GLN 42 2HG GLN 42 -7.101 -1.507 -10.291 312 HE21 GLN 42 2HE2 GLN 42 -6.827 -3.818 -11.792 313 HE22 GLN 42 1HE2 GLN 42 -8.259 -4.771 -11.623 314 H LEU 43 H LEU 43 -3.764 -3.386 -12.829 315 HA LEU 43 HA LEU 43 -1.533 -4.553 -11.695 316 HB2 LEU 43 1HB LEU 43 -1.834 -3.655 -14.557 317 HB3 LEU 43 2HB LEU 43 -0.704 -4.870 -13.962 318 HG LEU 43 HG LEU 43 -3.598 -5.083 -14.542 319 HD11 LEU 43 1HD1 LEU 43 -1.295 -6.167 -15.552 320 HD12 LEU 43 2HD1 LEU 43 -2.922 -6.800 -15.799 321 HD13 LEU 43 3HD1 LEU 43 -1.905 -7.459 -14.518 322 HD21 LEU 43 3HD2 LEU 43 -3.871 -5.565 -12.288 323 HD22 LEU 43 1HD2 LEU 43 -2.281 -6.316 -12.152 324 HD23 LEU 43 2HD2 LEU 43 -3.582 -7.154 -12.998 325 H LYS 44 H LYS 44 -1.941 -1.323 -12.947 326 HA LYS 44 HA LYS 44 0.916 -0.766 -12.603 327 HB2 LYS 44 1HB LYS 44 0.389 1.395 -13.713 328 HB3 LYS 44 2HB LYS 44 0.005 -0.007 -14.703 329 HG2 LYS 44 1HG LYS 44 -1.834 1.344 -15.016 330 HG3 LYS 44 2HG LYS 44 -2.378 0.262 -13.732 331 HD2 LYS 44 1HD LYS 44 -2.807 2.034 -12.460 332 HD3 LYS 44 2HD LYS 44 -1.090 2.443 -12.484 333 HE2 LYS 44 1HE LYS 44 -2.224 4.359 -13.266 334 HE3 LYS 44 2HE LYS 44 -1.531 3.592 -14.694 335 HZ1 LYS 44 3HZ LYS 44 -3.756 4.225 -15.191 336 HZ2 LYS 44 1HZ LYS 44 -4.357 3.479 -13.796 337 HZ3 LYS 44 2HZ LYS 44 -3.734 2.539 -15.056 338 H GLU 45 H GLU 45 -2.139 -0.286 -11.112 339 HA GLU 45 HA GLU 45 -1.834 2.072 -9.715 340 HB2 GLU 45 1HB GLU 45 -3.314 -0.453 -9.257 341 HB3 GLU 45 2HB GLU 45 -3.096 0.586 -7.856 342 HG2 GLU 45 1HG GLU 45 -4.258 1.520 -10.467 343 HG3 GLU 45 2HG GLU 45 -5.221 0.938 -9.109 344 H ILE 46 H ILE 46 -0.629 -1.150 -8.867 345 HA ILE 46 HA ILE 46 0.635 -0.180 -6.456 346 HB ILE 46 HB ILE 46 1.099 -2.866 -7.732 347 HG12 ILE 46 1HG1 ILE 46 -0.797 -3.270 -5.772 348 HG13 ILE 46 2HG1 ILE 46 -1.341 -1.777 -6.530 349 HG21 ILE 46 1HG2 ILE 46 0.917 -2.771 -4.856 350 HG22 ILE 46 2HG2 ILE 46 2.233 -3.342 -5.880 351 HG23 ILE 46 3HG2 ILE 46 2.125 -1.634 -5.454 352 HD11 ILE 46 3HD1 ILE 46 -1.471 -4.499 -7.489 353 HD12 ILE 46 1HD1 ILE 46 -2.334 -3.062 -8.037 354 HD13 ILE 46 2HD1 ILE 46 -0.723 -3.418 -8.663 355 H PHE 47 H PHE 47 1.448 -0.465 -9.759 356 HA PHE 47 HA PHE 47 3.444 -0.421 -10.906 357 HB2 PHE 47 1HB PHE 47 4.844 1.564 -10.185 358 HB3 PHE 47 2HB PHE 47 3.151 1.909 -10.520 359 HD1 PHE 47 HD2 PHE 47 5.710 1.633 -7.922 360 HD2 PHE 47 HD1 PHE 47 1.635 2.536 -8.756 361 HE1 PHE 47 HE2 PHE 47 5.480 2.640 -5.689 362 HE2 PHE 47 HE1 PHE 47 1.399 3.545 -6.524 363 HZ PHE 47 HZ PHE 47 3.322 3.597 -4.987 364 H ARG 48 H ARG 48 3.501 -2.482 -9.022 365 HA ARG 48 HA ARG 48 6.367 -2.547 -8.422 366 HB2 ARG 48 1HB ARG 48 4.126 -2.878 -6.485 367 HB3 ARG 48 2HB ARG 48 5.541 -3.905 -6.293 368 HG2 ARG 48 1HG ARG 48 6.892 -1.729 -6.391 369 HG3 ARG 48 2HG ARG 48 5.348 -0.924 -6.108 370 HD2 ARG 48 1HD ARG 48 5.076 -2.456 -4.108 371 HD3 ARG 48 2HD ARG 48 6.767 -2.900 -4.339 372 HE ARG 48 HE ARG 48 6.311 -0.064 -4.157 373 HH11 ARG 48 1HH1 ARG 48 6.917 -2.999 -2.385 374 HH12 ARG 48 2HH1 ARG 48 7.586 -2.185 -1.010 375 HH21 ARG 48 1HH2 ARG 48 7.191 1.019 -2.352 376 HH22 ARG 48 2HH2 ARG 48 7.741 0.100 -0.992 377 H ILE 49 H ILE 49 4.070 -3.820 -10.186 378 HA ILE 49 HA ILE 49 5.040 -6.587 -9.871 379 HB ILE 49 HB ILE 49 2.925 -7.399 -10.737 380 HG12 ILE 49 1HG1 ILE 49 2.089 -4.491 -10.784 381 HG13 ILE 49 2HG1 ILE 49 2.379 -5.501 -12.196 382 HG21 ILE 49 1HG2 ILE 49 2.460 -5.444 -8.489 383 HG22 ILE 49 2HG2 ILE 49 1.506 -6.883 -8.847 384 HG23 ILE 49 3HG2 ILE 49 3.178 -7.045 -8.312 385 HD11 ILE 49 3HD1 ILE 49 0.214 -5.957 -12.166 386 HD12 ILE 49 1HD1 ILE 49 0.517 -6.917 -10.719 387 HD13 ILE 49 2HD1 ILE 49 0.013 -5.234 -10.570 388 H LEU 50 H LEU 50 4.488 -3.914 -11.990 389 HA LEU 50 HA LEU 50 5.040 -5.487 -14.380 390 HB2 LEU 50 1HB LEU 50 4.723 -2.506 -14.268 391 HB3 LEU 50 2HB LEU 50 4.448 -3.591 -15.629 392 HG LEU 50 HG LEU 50 2.719 -3.746 -13.187 393 HD11 LEU 50 1HD1 LEU 50 2.735 -1.395 -13.889 394 HD12 LEU 50 2HD1 LEU 50 1.178 -2.165 -14.191 395 HD13 LEU 50 3HD1 LEU 50 2.298 -1.888 -15.525 396 HD21 LEU 50 3HD2 LEU 50 1.094 -4.592 -14.797 397 HD22 LEU 50 1HD2 LEU 50 2.584 -5.534 -14.849 398 HD23 LEU 50 2HD2 LEU 50 2.249 -4.344 -16.107 399 H ASP 51 H ASP 51 6.322 -2.401 -13.129 400 HA ASP 51 HA ASP 51 9.041 -3.359 -13.436 401 HB2 ASP 51 1HB ASP 51 9.523 -1.165 -14.790 402 HB3 ASP 51 2HB ASP 51 8.945 -2.606 -15.624 403 H ASN 52 H ASN 52 10.537 -2.195 -12.242 404 HA ASN 52 HA ASN 52 9.365 -0.352 -10.298 405 HB2 ASN 52 1HB ASN 52 11.076 -0.936 -8.835 406 HB3 ASN 52 2HB ASN 52 10.830 -2.435 -9.728 407 HD21 ASN 52 2HD2 ASN 52 12.316 -2.970 -11.401 408 HD22 ASN 52 1HD2 ASN 52 13.930 -2.354 -11.366 409 H ASP 53 H ASP 53 10.206 0.279 -13.148 410 HA ASP 53 HA ASP 53 12.021 2.509 -12.495 411 HB2 ASP 53 1HB ASP 53 11.835 0.798 -14.965 412 HB3 ASP 53 2HB ASP 53 12.567 2.399 -15.014 413 H GLN 54 H GLN 54 9.326 1.470 -14.552 414 HA GLN 54 HA GLN 54 7.688 2.635 -15.628 415 HB2 GLN 54 1HB GLN 54 8.004 4.541 -13.305 416 HB3 GLN 54 2HB GLN 54 6.580 4.348 -14.319 417 HG2 GLN 54 1HG GLN 54 7.717 2.207 -12.536 418 HG3 GLN 54 2HG GLN 54 6.376 3.270 -12.110 419 HE21 GLN 54 2HE2 GLN 54 5.581 0.906 -11.864 420 HE22 GLN 54 1HE2 GLN 54 4.718 0.282 -13.225 421 H SER 55 H SER 55 10.319 3.204 -16.516 422 HA SER 55 HA SER 55 10.366 6.083 -16.995 423 HB2 SER 55 1HB SER 55 12.531 5.392 -16.525 424 HB3 SER 55 2HB SER 55 12.331 3.850 -17.358 425 HG SER 55 HG SER 55 13.370 6.102 -18.301 426 H GLY 56 H GLY 56 9.231 3.253 -18.463 427 HA2 GLY 56 1HA GLY 56 7.912 4.344 -20.555 428 HA3 GLY 56 2HA GLY 56 9.537 4.146 -21.197 429 H PHE 57 H PHE 57 10.475 1.890 -20.851 430 HA PHE 57 HA PHE 57 8.358 -0.119 -21.256 431 HB2 PHE 57 1HB PHE 57 11.043 0.004 -22.645 432 HB3 PHE 57 2HB PHE 57 9.824 -1.246 -22.871 433 HD1 PHE 57 HD1 PHE 57 10.693 2.259 -23.512 434 HD2 PHE 57 HD2 PHE 57 7.883 -0.859 -24.217 435 HE1 PHE 57 HE1 PHE 57 9.670 3.592 -25.309 436 HE2 PHE 57 HE2 PHE 57 6.856 0.468 -26.016 437 HZ PHE 57 HZ PHE 57 7.749 2.697 -26.565 438 H ILE 58 H ILE 58 9.737 -2.407 -21.288 439 HA ILE 58 HA ILE 58 11.304 -2.432 -18.796 440 HB ILE 58 HB ILE 58 9.337 -4.592 -19.539 441 HG12 ILE 58 1HG1 ILE 58 8.962 -2.320 -17.575 442 HG13 ILE 58 2HG1 ILE 58 8.146 -2.468 -19.128 443 HG21 ILE 58 1HG2 ILE 58 10.931 -3.976 -17.061 444 HG22 ILE 58 2HG2 ILE 58 9.608 -5.141 -17.102 445 HG23 ILE 58 3HG2 ILE 58 11.043 -5.401 -18.094 446 HD11 ILE 58 3HD1 ILE 58 7.535 -4.845 -17.963 447 HD12 ILE 58 1HD1 ILE 58 7.582 -3.762 -16.572 448 HD13 ILE 58 2HD1 ILE 58 6.515 -3.406 -17.930 449 H GLU 59 H GLU 59 12.795 -4.187 -18.579 450 HA GLU 59 HA GLU 59 13.354 -5.715 -21.012 451 HB2 GLU 59 1HB GLU 59 14.753 -3.455 -20.577 452 HB3 GLU 59 2HB GLU 59 15.721 -4.581 -19.636 453 HG2 GLU 59 1HG GLU 59 16.394 -5.762 -21.471 454 HG3 GLU 59 2HG GLU 59 14.960 -5.340 -22.405 455 H GLU 60 H GLU 60 15.227 -7.308 -20.546 456 HA GLU 60 HA GLU 60 14.420 -9.048 -18.519 457 HB2 GLU 60 1HB GLU 60 16.545 -10.250 -18.966 458 HB3 GLU 60 2HB GLU 60 15.651 -9.860 -20.429 459 HG2 GLU 60 1HG GLU 60 17.183 -7.752 -20.466 460 HG3 GLU 60 2HG GLU 60 18.212 -8.724 -19.415 461 H ASP 61 H ASP 61 16.438 -6.281 -18.394 462 HA ASP 61 HA ASP 61 17.918 -7.013 -16.054 463 HB2 ASP 61 1HB ASP 61 18.519 -5.248 -17.849 464 HB3 ASP 61 2HB ASP 61 17.444 -4.181 -16.950 465 H GLU 62 H GLU 62 14.723 -6.288 -16.512 466 HA GLU 62 HA GLU 62 14.449 -5.284 -13.754 467 HB2 GLU 62 1HB GLU 62 12.991 -4.549 -16.261 468 HB3 GLU 62 2HB GLU 62 12.147 -4.458 -14.721 469 HG2 GLU 62 1HG GLU 62 13.020 -2.458 -14.401 470 HG3 GLU 62 2HG GLU 62 14.620 -3.194 -14.331 471 H LEU 63 H LEU 63 14.474 -8.052 -14.981 472 HA LEU 63 HA LEU 63 11.852 -8.927 -13.957 473 HB2 LEU 63 1HB LEU 63 13.492 -10.521 -15.893 474 HB3 LEU 63 2HB LEU 63 11.775 -10.662 -15.521 475 HG LEU 63 HG LEU 63 13.056 -8.407 -17.066 476 HD11 LEU 63 1HD1 LEU 63 11.116 -10.315 -18.255 477 HD12 LEU 63 2HD1 LEU 63 12.782 -10.848 -18.039 478 HD13 LEU 63 3HD1 LEU 63 12.434 -9.418 -19.010 479 HD21 LEU 63 3HD2 LEU 63 11.122 -7.304 -16.955 480 HD22 LEU 63 1HD2 LEU 63 10.701 -8.385 -15.626 481 HD23 LEU 63 2HD2 LEU 63 10.179 -8.762 -17.268 482 H LYS 64 H LYS 64 15.253 -9.140 -13.700 483 HA LYS 64 HA LYS 64 15.281 -11.659 -12.284 484 HB2 LYS 64 1HB LYS 64 17.535 -9.668 -12.344 485 HB3 LYS 64 2HB LYS 64 17.622 -11.417 -12.175 486 HG2 LYS 64 1HG LYS 64 16.982 -11.714 -14.481 487 HG3 LYS 64 2HG LYS 64 16.748 -9.975 -14.670 488 HD2 LYS 64 1HD LYS 64 19.258 -9.917 -13.825 489 HD3 LYS 64 2HD LYS 64 19.264 -11.552 -14.490 490 HE2 LYS 64 1HE LYS 64 18.329 -9.135 -16.024 491 HE3 LYS 64 2HE LYS 64 19.986 -9.734 -16.073 492 HZ1 LYS 64 3HZ LYS 64 19.320 -11.073 -17.693 493 HZ2 LYS 64 1HZ LYS 64 17.690 -10.688 -17.452 494 HZ3 LYS 64 2HZ LYS 64 18.407 -11.929 -16.555 495 H TYR 65 H TYR 65 14.341 -8.600 -11.482 496 HA TYR 65 HA TYR 65 14.981 -9.039 -8.639 497 HB2 TYR 65 1HB TYR 65 14.533 -6.312 -9.833 498 HB3 TYR 65 2HB TYR 65 15.273 -6.724 -8.290 499 HD1 TYR 65 HD2 TYR 65 17.181 -8.833 -9.163 500 HD2 TYR 65 HD1 TYR 65 16.204 -5.082 -10.916 501 HE1 TYR 65 HE2 TYR 65 19.408 -8.746 -10.203 502 HE2 TYR 65 HE1 TYR 65 18.428 -4.984 -11.962 503 HH TYR 65 HH TYR 65 20.315 -7.387 -12.495 504 H PHE 66 H PHE 66 12.779 -10.241 -9.466 505 HA PHE 66 HA PHE 66 10.509 -8.444 -9.058 506 HB2 PHE 66 1HB PHE 66 10.486 -10.096 -10.937 507 HB3 PHE 66 2HB PHE 66 10.484 -11.389 -9.742 508 HD1 PHE 66 HD1 PHE 66 8.551 -8.526 -11.047 509 HD2 PHE 66 HD2 PHE 66 8.496 -12.056 -8.670 510 HE1 PHE 66 HE1 PHE 66 6.096 -8.408 -10.935 511 HE2 PHE 66 HE2 PHE 66 6.041 -11.945 -8.555 512 HZ PHE 66 HZ PHE 66 4.838 -10.119 -9.689 513 H LEU 67 H LEU 67 11.418 -11.696 -7.901 514 HA LEU 67 HA LEU 67 9.705 -11.792 -5.726 515 HB2 LEU 67 1HB LEU 67 12.458 -12.998 -5.720 516 HB3 LEU 67 2HB LEU 67 11.009 -13.588 -4.907 517 HG LEU 67 HG LEU 67 11.559 -13.632 -7.873 518 HD11 LEU 67 1HD1 LEU 67 12.749 -15.302 -6.440 519 HD12 LEU 67 2HD1 LEU 67 11.667 -15.999 -7.645 520 HD13 LEU 67 3HD1 LEU 67 11.169 -15.920 -5.955 521 HD21 LEU 67 3HD2 LEU 67 9.371 -13.775 -8.203 522 HD22 LEU 67 1HD2 LEU 67 9.078 -13.593 -6.474 523 HD23 LEU 67 2HD2 LEU 67 9.314 -15.199 -7.163 524 H GLN 68 H GLN 68 12.653 -10.039 -6.125 525 HA GLN 68 HA GLN 68 13.491 -9.706 -3.497 526 HB2 GLN 68 1HB GLN 68 14.224 -8.689 -5.967 527 HB3 GLN 68 2HB GLN 68 13.714 -7.263 -5.073 528 HG2 GLN 68 1HG GLN 68 15.356 -7.534 -3.454 529 HG3 GLN 68 2HG GLN 68 15.615 -9.229 -3.864 530 HE21 GLN 68 2HE2 GLN 68 15.995 -9.217 -6.509 531 HE22 GLN 68 1HE2 GLN 68 17.383 -8.280 -6.933 532 H ARG 69 H ARG 69 10.691 -8.502 -5.076 533 HA ARG 69 HA ARG 69 10.251 -6.345 -3.194 534 HB2 ARG 69 1HB ARG 69 8.880 -7.380 -5.625 535 HB3 ARG 69 2HB ARG 69 7.906 -6.495 -4.459 536 HG2 ARG 69 1HG ARG 69 10.458 -5.415 -5.621 537 HG3 ARG 69 2HG ARG 69 8.869 -5.136 -6.336 538 HD2 ARG 69 1HD ARG 69 8.964 -3.285 -5.030 539 HD3 ARG 69 2HD ARG 69 8.328 -4.408 -3.828 540 HE ARG 69 HE ARG 69 10.260 -4.133 -2.657 541 HH11 ARG 69 1HH1 ARG 69 10.866 -3.311 -5.985 542 HH12 ARG 69 2HH1 ARG 69 12.497 -2.802 -5.699 543 HH21 ARG 69 1HH2 ARG 69 12.406 -3.466 -2.267 544 HH22 ARG 69 2HH2 ARG 69 13.372 -2.892 -3.583 545 H PHE 70 H PHE 70 8.099 -9.013 -4.163 546 HA PHE 70 HA PHE 70 6.496 -8.996 -1.917 547 HB2 PHE 70 1HB PHE 70 7.257 -11.268 -3.753 548 HB3 PHE 70 2HB PHE 70 6.036 -11.425 -2.494 549 HD1 PHE 70 HD1 PHE 70 4.070 -9.778 -2.563 550 HD2 PHE 70 HD2 PHE 70 6.680 -10.475 -5.851 551 HE1 PHE 70 HE1 PHE 70 2.370 -8.879 -4.098 552 HE2 PHE 70 HE2 PHE 70 4.986 -9.577 -7.392 553 HZ PHE 70 HZ PHE 70 2.827 -8.776 -6.516 554 H GLU 71 H GLU 71 8.919 -11.543 -2.497 555 HA GLU 71 HA GLU 71 8.995 -12.559 0.064 556 HB2 GLU 71 1HB GLU 71 10.071 -13.737 -1.725 557 HB3 GLU 71 2HB GLU 71 11.175 -12.400 -2.017 558 HG2 GLU 71 1HG GLU 71 12.336 -14.169 -0.888 559 HG3 GLU 71 2HG GLU 71 12.187 -12.784 0.192 560 H SER 72 H SER 72 10.665 -9.766 -1.250 561 HA SER 72 HA SER 72 11.798 -8.058 -0.262 562 HB2 SER 72 1HB SER 72 9.752 -8.358 1.355 563 HB3 SER 72 2HB SER 72 10.968 -8.995 2.463 564 HG SER 72 HG SER 72 11.431 -6.998 2.875 565 H GLY 73 H GLY 73 12.779 -11.000 -0.319 566 HA2 GLY 73 1HA GLY 73 15.281 -10.411 1.073 567 HA3 GLY 73 2HA GLY 73 14.420 -11.862 1.563 568 H ALA 74 H ALA 74 14.015 -11.099 -1.717 569 HA ALA 74 HA ALA 74 15.507 -13.432 -2.508 570 HB1 ALA 74 1HB ALA 74 14.448 -13.267 -4.552 571 HB2 ALA 74 2HB ALA 74 13.267 -12.529 -3.470 572 HB3 ALA 74 3HB ALA 74 14.313 -11.511 -4.460 573 H ARG 75 H ARG 75 16.844 -13.179 -4.629 574 HA ARG 75 HA ARG 75 18.607 -10.833 -4.387 575 HB2 ARG 75 1HB ARG 75 20.342 -12.726 -5.237 576 HB3 ARG 75 2HB ARG 75 20.115 -12.295 -3.547 577 HG2 ARG 75 1HG ARG 75 18.950 -14.210 -3.070 578 HG3 ARG 75 2HG ARG 75 18.400 -14.419 -4.734 579 HD2 ARG 75 1HD ARG 75 20.317 -15.466 -5.381 580 HD3 ARG 75 2HD ARG 75 21.317 -14.581 -4.230 581 HE ARG 75 HE ARG 75 21.000 -16.270 -2.724 582 HH11 ARG 75 1HH1 ARG 75 18.574 -16.506 -5.210 583 HH12 ARG 75 2HH1 ARG 75 17.954 -18.021 -4.642 584 HH21 ARG 75 1HH2 ARG 75 20.193 -18.264 -1.968 585 HH22 ARG 75 2HH2 ARG 75 18.875 -19.020 -2.798 586 H VAL 76 H VAL 76 18.386 -13.687 -6.514 587 HA VAL 76 HA VAL 76 17.770 -11.959 -8.781 588 HB VAL 76 HB VAL 76 20.058 -13.900 -9.011 589 HG11 VAL 76 1HG1 VAL 76 19.223 -13.395 -11.130 590 HG12 VAL 76 2HG1 VAL 76 18.920 -11.707 -10.712 591 HG13 VAL 76 3HG1 VAL 76 20.574 -12.279 -10.936 592 HG21 VAL 76 3HG2 VAL 76 20.844 -12.360 -7.394 593 HG22 VAL 76 1HG2 VAL 76 21.520 -11.839 -8.937 594 HG23 VAL 76 2HG2 VAL 76 20.137 -10.989 -8.249 595 H LEU 77 H LEU 77 17.057 -13.135 -10.667 596 HA LEU 77 HA LEU 77 15.917 -15.749 -9.953 597 HB2 LEU 77 1HB LEU 77 15.044 -13.566 -11.807 598 HB3 LEU 77 2HB LEU 77 14.452 -15.212 -12.018 599 HG LEU 77 HG LEU 77 14.131 -14.287 -9.287 600 HD11 LEU 77 1HD1 LEU 77 12.177 -12.892 -10.932 601 HD12 LEU 77 2HD1 LEU 77 13.811 -12.252 -11.102 602 HD13 LEU 77 3HD1 LEU 77 13.061 -12.343 -9.508 603 HD21 LEU 77 3HD2 LEU 77 13.054 -16.257 -10.370 604 HD22 LEU 77 1HD2 LEU 77 12.097 -15.138 -11.341 605 HD23 LEU 77 2HD2 LEU 77 11.921 -15.155 -9.586 606 H THR 78 H THR 78 15.536 -17.190 -11.931 607 HA THR 78 HA THR 78 18.090 -17.693 -13.136 608 HB THR 78 HB THR 78 17.160 -19.692 -14.006 609 HG1 THR 78 HG1 THR 78 14.869 -20.011 -14.045 610 HG21 THR 78 3HG2 THR 78 16.525 -20.767 -12.073 611 HG22 THR 78 1HG2 THR 78 15.478 -19.447 -11.553 612 HG23 THR 78 2HG2 THR 78 17.229 -19.295 -11.406 613 H ALA 79 H ALA 79 17.799 -18.507 -15.612 614 HA ALA 79 HA ALA 79 17.314 -16.067 -17.079 615 HB1 ALA 79 1HB ALA 79 18.981 -18.312 -17.398 616 HB2 ALA 79 2HB ALA 79 17.903 -18.279 -18.794 617 HB3 ALA 79 3HB ALA 79 18.894 -16.871 -18.412 618 H SER 80 H SER 80 15.599 -18.946 -16.370 619 HA SER 80 HA SER 80 13.863 -18.787 -18.684 620 HB2 SER 80 1HB SER 80 14.108 -20.622 -16.330 621 HB3 SER 80 2HB SER 80 12.600 -20.595 -17.244 622 HG SER 80 HG SER 80 15.182 -21.333 -18.090 623 H GLU 81 H GLU 81 13.487 -18.437 -15.158 624 HA GLU 81 HA GLU 81 10.835 -17.712 -15.048 625 HB2 GLU 81 1HB GLU 81 13.084 -16.588 -13.368 626 HB3 GLU 81 2HB GLU 81 11.375 -16.537 -12.958 627 HG2 GLU 81 1HG GLU 81 13.008 -19.042 -13.298 628 HG3 GLU 81 2HG GLU 81 12.578 -18.300 -11.758 629 H THR 82 H THR 82 13.635 -15.591 -15.562 630 HA THR 82 HA THR 82 12.084 -13.211 -15.790 631 HB THR 82 HB THR 82 14.156 -12.184 -16.675 632 HG1 THR 82 HG1 THR 82 15.807 -13.395 -17.296 633 HG21 THR 82 3HG2 THR 82 15.243 -13.748 -14.441 634 HG22 THR 82 1HG2 THR 82 13.662 -13.032 -14.131 635 HG23 THR 82 2HG2 THR 82 15.018 -12.006 -14.601 636 H LYS 83 H LYS 83 13.081 -15.696 -18.004 637 HA LYS 83 HA LYS 83 12.691 -14.222 -20.407 638 HB2 LYS 83 1HB LYS 83 14.071 -16.202 -20.430 639 HB3 LYS 83 2HB LYS 83 12.736 -17.193 -19.857 640 HG2 LYS 83 1HG LYS 83 13.025 -17.586 -22.192 641 HG3 LYS 83 2HG LYS 83 11.526 -16.684 -21.964 642 HD2 LYS 83 1HD LYS 83 12.759 -14.599 -22.509 643 HD3 LYS 83 2HD LYS 83 14.187 -15.577 -22.857 644 HE2 LYS 83 1HE LYS 83 11.537 -15.961 -24.234 645 HE3 LYS 83 2HE LYS 83 12.807 -14.910 -24.856 646 HZ1 LYS 83 3HZ LYS 83 13.010 -17.009 -25.916 647 HZ2 LYS 83 1HZ LYS 83 12.948 -17.844 -24.446 648 HZ3 LYS 83 2HZ LYS 83 14.292 -16.888 -24.820 649 H THR 84 H THR 84 10.575 -15.796 -18.195 650 HA THR 84 HA THR 84 8.366 -15.749 -20.126 651 HB THR 84 HB THR 84 8.666 -17.847 -18.880 652 HG1 THR 84 HG1 THR 84 6.530 -18.076 -18.556 653 HG21 THR 84 3HG2 THR 84 9.613 -17.141 -16.821 654 HG22 THR 84 1HG2 THR 84 8.032 -17.814 -16.428 655 HG23 THR 84 2HG2 THR 84 8.257 -16.066 -16.484 656 H PHE 85 H PHE 85 9.522 -13.340 -18.880 657 HA PHE 85 HA PHE 85 7.264 -12.441 -17.228 658 HB2 PHE 85 1HB PHE 85 10.137 -11.772 -17.323 659 HB3 PHE 85 2HB PHE 85 9.057 -10.402 -17.088 660 HD1 PHE 85 HD2 PHE 85 8.658 -13.882 -15.864 661 HD2 PHE 85 HD1 PHE 85 9.417 -9.814 -14.866 662 HE1 PHE 85 HE2 PHE 85 8.480 -14.439 -13.474 663 HE2 PHE 85 HE1 PHE 85 9.242 -10.365 -12.474 664 HZ PHE 85 HZ PHE 85 8.772 -12.680 -11.776 665 H LEU 86 H LEU 86 9.425 -11.129 -19.747 666 HA LEU 86 HA LEU 86 7.123 -9.609 -20.784 667 HB2 LEU 86 1HB LEU 86 8.735 -7.963 -21.619 668 HB3 LEU 86 2HB LEU 86 8.792 -8.129 -19.865 669 HG LEU 86 HG LEU 86 10.800 -9.677 -20.275 670 HD11 LEU 86 1HD1 LEU 86 10.130 -8.945 -22.972 671 HD12 LEU 86 2HD1 LEU 86 11.314 -10.113 -22.388 672 HD13 LEU 86 3HD1 LEU 86 11.766 -8.419 -22.576 673 HD21 LEU 86 3HD2 LEU 86 11.306 -7.676 -19.241 674 HD22 LEU 86 1HD2 LEU 86 10.733 -6.707 -20.599 675 HD23 LEU 86 2HD2 LEU 86 12.264 -7.574 -20.719 676 H ALA 87 H ALA 87 9.650 -11.846 -21.472 677 HA ALA 87 HA ALA 87 9.521 -11.565 -24.336 678 HB1 ALA 87 1HB ALA 87 11.475 -12.602 -24.202 679 HB2 ALA 87 2HB ALA 87 11.239 -12.842 -22.471 680 HB3 ALA 87 3HB ALA 87 10.667 -14.056 -23.615 681 H ALA 88 H ALA 88 7.411 -12.800 -22.146 682 HA ALA 88 HA ALA 88 6.548 -15.034 -23.838 683 HB1 ALA 88 1HB ALA 88 5.412 -14.295 -21.155 684 HB2 ALA 88 2HB ALA 88 5.309 -15.839 -22.001 685 HB3 ALA 88 3HB ALA 88 6.850 -15.300 -21.335 686 H ALA 89 H ALA 89 5.416 -11.984 -22.464 687 HA ALA 89 HA ALA 89 2.762 -12.023 -23.209 688 HB1 ALA 89 1HB ALA 89 3.113 -10.138 -22.035 689 HB2 ALA 89 2HB ALA 89 4.749 -9.929 -22.659 690 HB3 ALA 89 3HB ALA 89 3.366 -9.419 -23.625 691 H ASP 90 H ASP 90 5.109 -10.108 -25.066 692 HA ASP 90 HA ASP 90 4.132 -11.281 -27.552 693 HB2 ASP 90 1HB ASP 90 3.706 -8.452 -26.696 694 HB3 ASP 90 2HB ASP 90 4.049 -8.770 -28.394 695 H HIS 91 H HIS 91 5.383 -10.309 -29.463 696 HA HIS 91 HA HIS 91 8.138 -9.659 -28.663 697 HB2 HIS 91 1HB HIS 91 7.364 -11.613 -30.840 698 HB3 HIS 91 2HB HIS 91 9.004 -11.156 -30.391 699 HD1 HIS 91 HD1 HIS 91 10.110 -12.760 -28.880 700 HD2 HIS 91 HD2 HIS 91 5.977 -12.859 -28.469 701 HE1 HIS 91 HE1 HIS 91 9.644 -14.581 -27.209 702 H ASP 92 H ASP 92 6.129 -7.843 -29.488 703 HA ASP 92 HA ASP 92 6.050 -7.189 -32.170 704 HB2 ASP 92 1HB ASP 92 4.841 -6.108 -30.151 705 HB3 ASP 92 2HB ASP 92 6.254 -5.061 -30.056 706 H GLY 93 H GLY 93 8.586 -6.606 -29.819 707 HA2 GLY 93 1HA GLY 93 10.345 -5.788 -32.022 708 HA3 GLY 93 2HA GLY 93 10.217 -4.735 -30.620 709 H ASP 94 H ASP 94 10.822 -5.653 -28.520 710 HA ASP 94 HA ASP 94 12.619 -7.960 -28.679 711 HB2 ASP 94 1HB ASP 94 13.502 -5.257 -28.512 712 HB3 ASP 94 2HB ASP 94 13.834 -6.030 -26.964 713 H GLY 95 H GLY 95 9.945 -7.169 -27.445 714 HA2 GLY 95 1HA GLY 95 8.914 -8.184 -25.593 715 HA3 GLY 95 2HA GLY 95 10.495 -8.395 -24.856 716 H LYS 96 H LYS 96 9.746 -5.295 -26.151 717 HA LYS 96 HA LYS 96 9.990 -4.079 -23.568 718 HB2 LYS 96 1HB LYS 96 9.178 -2.785 -26.176 719 HB3 LYS 96 2HB LYS 96 9.791 -1.972 -24.743 720 HG2 LYS 96 1HG LYS 96 11.933 -3.184 -25.030 721 HG3 LYS 96 2HG LYS 96 11.306 -3.854 -26.538 722 HD2 LYS 96 1HD LYS 96 10.853 -1.320 -27.089 723 HD3 LYS 96 2HD LYS 96 12.119 -1.060 -25.887 724 HE2 LYS 96 1HE LYS 96 13.421 -1.227 -27.746 725 HE3 LYS 96 2HE LYS 96 13.333 -2.935 -27.319 726 HZ1 LYS 96 3HZ LYS 96 11.396 -3.079 -28.868 727 HZ2 LYS 96 1HZ LYS 96 12.879 -2.760 -29.618 728 HZ3 LYS 96 2HZ LYS 96 11.761 -1.512 -29.390 729 H ILE 97 H ILE 97 8.383 -4.043 -22.148 730 HA ILE 97 HA ILE 97 5.637 -4.341 -22.941 731 HB ILE 97 HB ILE 97 6.609 -3.608 -20.187 732 HG12 ILE 97 1HG1 ILE 97 7.905 -5.536 -20.933 733 HG13 ILE 97 2HG1 ILE 97 6.726 -6.034 -19.725 734 HG21 ILE 97 1HG2 ILE 97 4.458 -3.762 -19.672 735 HG22 ILE 97 2HG2 ILE 97 4.067 -4.187 -21.338 736 HG23 ILE 97 3HG2 ILE 97 4.471 -5.451 -20.177 737 HD11 ILE 97 3HD1 ILE 97 6.053 -7.601 -21.127 738 HD12 ILE 97 1HD1 ILE 97 5.454 -6.333 -22.195 739 HD13 ILE 97 2HD1 ILE 97 7.088 -6.965 -22.405 740 H GLY 98 H GLY 98 3.972 -2.845 -22.749 741 HA2 GLY 98 1HA GLY 98 4.729 -0.077 -22.111 742 HA3 GLY 98 2HA GLY 98 3.978 -0.420 -23.662 743 H ALA 99 H ALA 99 3.358 -1.420 -20.294 744 HA ALA 99 HA ALA 99 1.421 -1.547 -19.097 745 HB1 ALA 99 1HB ALA 99 0.950 1.037 -20.574 746 HB2 ALA 99 2HB ALA 99 -0.019 0.476 -19.211 747 HB3 ALA 99 3HB ALA 99 1.694 0.833 -18.987 748 H GLU 100 H GLU 100 1.477 -2.866 -21.724 749 HA GLU 100 HA GLU 100 -1.421 -3.134 -22.064 750 HB2 GLU 100 1HB GLU 100 0.588 -2.587 -24.235 751 HB3 GLU 100 2HB GLU 100 -0.925 -3.413 -24.581 752 HG2 GLU 100 1HG GLU 100 -2.207 -1.532 -23.933 753 HG3 GLU 100 2HG GLU 100 -0.800 -0.730 -23.238 754 H GLU 101 H GLU 101 1.806 -4.450 -22.562 755 HA GLU 101 HA GLU 101 0.932 -7.034 -23.387 756 HB2 GLU 101 1HB GLU 101 3.538 -5.857 -22.504 757 HB3 GLU 101 2HB GLU 101 3.376 -7.605 -22.609 758 HG2 GLU 101 1HG GLU 101 2.749 -7.411 -24.958 759 HG3 GLU 101 2HG GLU 101 2.901 -5.658 -24.856 760 H PHE 102 H PHE 102 2.530 -6.005 -20.366 761 HA PHE 102 HA PHE 102 2.167 -8.324 -18.920 762 HB2 PHE 102 1HB PHE 102 3.351 -6.014 -18.354 763 HB3 PHE 102 2HB PHE 102 1.847 -5.729 -17.485 764 HD1 PHE 102 HD2 PHE 102 1.089 -7.846 -16.015 765 HD2 PHE 102 HD1 PHE 102 5.081 -6.909 -17.158 766 HE1 PHE 102 HE2 PHE 102 1.938 -9.158 -14.115 767 HE2 PHE 102 HE1 PHE 102 5.936 -8.221 -15.260 768 HZ PHE 102 HZ PHE 102 4.364 -9.346 -13.735 769 H GLN 103 H GLN 103 -0.092 -5.683 -19.459 770 HA GLN 103 HA GLN 103 -2.046 -6.593 -17.597 771 HB2 GLN 103 1HB GLN 103 -2.043 -4.607 -19.846 772 HB3 GLN 103 2HB GLN 103 -3.553 -5.058 -19.065 773 HG2 GLN 103 1HG GLN 103 -2.649 -3.026 -18.104 774 HG3 GLN 103 2HG GLN 103 -2.673 -4.327 -16.916 775 HE21 GLN 103 2HE2 GLN 103 -0.396 -3.608 -19.527 776 HE22 GLN 103 1HE2 GLN 103 0.993 -3.460 -18.512 777 H GLU 104 H GLU 104 -2.009 -6.612 -21.167 778 HA GLU 104 HA GLU 104 -4.296 -8.124 -21.561 779 HB2 GLU 104 1HB GLU 104 -1.800 -7.716 -23.165 780 HB3 GLU 104 2HB GLU 104 -2.994 -8.888 -23.705 781 HG2 GLU 104 1HG GLU 104 -3.536 -5.974 -23.180 782 HG3 GLU 104 2HG GLU 104 -3.272 -6.696 -24.766 783 H MET 105 H MET 105 -1.127 -9.122 -20.554 784 HA MET 105 HA MET 105 -1.312 -11.864 -21.191 785 HB2 MET 105 1HB MET 105 0.822 -10.842 -20.653 786 HB3 MET 105 2HB MET 105 0.263 -10.454 -19.032 787 HG2 MET 105 1HG MET 105 -0.072 -13.004 -18.794 788 HG3 MET 105 2HG MET 105 1.001 -13.105 -20.188 789 HE1 MET 105 3HE MET 105 3.888 -10.796 -18.772 790 HE2 MET 105 1HE MET 105 3.954 -12.234 -19.791 791 HE3 MET 105 2HE MET 105 2.756 -10.981 -20.112 792 H VAL 106 H VAL 106 -1.519 -10.403 -17.942 793 HA VAL 106 HA VAL 106 -2.616 -12.633 -16.679 794 HB VAL 106 HB VAL 106 -3.131 -9.769 -15.879 795 HG11 VAL 106 1HG1 VAL 106 -2.808 -12.186 -14.119 796 HG12 VAL 106 2HG1 VAL 106 -3.435 -10.595 -13.686 797 HG13 VAL 106 3HG1 VAL 106 -4.372 -11.658 -14.737 798 HG21 VAL 106 3HG2 VAL 106 -0.820 -9.785 -16.097 799 HG22 VAL 106 1HG2 VAL 106 -1.052 -10.239 -14.408 800 HG23 VAL 106 2HG2 VAL 106 -0.684 -11.475 -15.612 801 H GLN 107 H GLN 107 -4.294 -9.708 -17.839 802 HA GLN 107 HA GLN 107 -6.888 -10.516 -17.232 803 HB2 GLN 107 1HB GLN 107 -5.988 -8.775 -19.533 804 HB3 GLN 107 2HB GLN 107 -7.621 -8.857 -18.885 805 HG2 GLN 107 1HG GLN 107 -5.184 -7.599 -17.735 806 HG3 GLN 107 2HG GLN 107 -6.823 -6.965 -17.875 807 HE21 GLN 107 2HE2 GLN 107 -4.735 -7.557 -15.643 808 HE22 GLN 107 1HE2 GLN 107 -5.709 -8.242 -14.391 809 H SER 108 H SER 108 -4.884 -11.201 -20.039 810 HA SER 108 HA SER 108 -6.804 -13.265 -20.836 811 HB2 SER 108 1HB SER 108 -7.461 -11.724 -22.428 812 HB3 SER 108 2HB SER 108 -5.873 -10.959 -22.497 813 HG SER 108 HG SER 108 -6.752 -13.342 -23.717 Start of MODEL 4 1 H1 SER 1 H SER 1 1.714 -0.195 0.145 2 HA SER 1 HA SER 1 0.543 -0.299 -2.258 3 HB2 SER 1 1HB SER 1 3.537 -0.313 -1.802 4 HB3 SER 1 2HB SER 1 2.746 0.166 -3.304 5 HG SER 1 HG SER 1 3.049 1.552 -0.961 6 H LEU 2 H LEU 2 2.754 -2.745 -1.006 7 HA LEU 2 HA LEU 2 2.910 -4.281 -3.381 8 HB2 LEU 2 1HB LEU 2 4.537 -4.442 -1.551 9 HB3 LEU 2 2HB LEU 2 3.292 -5.137 -0.515 10 HG LEU 2 HG LEU 2 3.198 -6.940 -2.453 11 HD11 LEU 2 1HD1 LEU 2 5.740 -5.489 -2.876 12 HD12 LEU 2 2HD1 LEU 2 4.725 -6.362 -4.022 13 HD13 LEU 2 3HD1 LEU 2 5.800 -7.250 -2.943 14 HD21 LEU 2 3HD2 LEU 2 4.012 -6.949 0.088 15 HD22 LEU 2 1HD2 LEU 2 5.562 -7.249 -0.698 16 HD23 LEU 2 2HD2 LEU 2 4.205 -8.340 -0.980 17 H THR 3 H THR 3 1.371 -5.295 -0.335 18 HA THR 3 HA THR 3 -0.557 -6.851 -1.891 19 HB THR 3 HB THR 3 -1.008 -8.108 0.062 20 HG1 THR 3 HG1 THR 3 -1.197 -6.545 1.632 21 HG21 THR 3 3HG2 THR 3 1.931 -7.410 0.051 22 HG22 THR 3 1HG2 THR 3 1.146 -8.654 -0.922 23 HG23 THR 3 2HG2 THR 3 1.227 -8.826 0.832 24 H ASP 4 H ASP 4 -0.813 -3.986 -1.787 25 HA ASP 4 HA ASP 4 -2.890 -3.322 0.081 26 HB2 ASP 4 1HB ASP 4 -1.251 -1.661 -0.818 27 HB3 ASP 4 2HB ASP 4 -2.032 -1.806 -2.391 28 H ILE 5 H ILE 5 -2.878 -3.342 -3.489 29 HA ILE 5 HA ILE 5 -5.717 -3.402 -3.657 30 HB ILE 5 HB ILE 5 -3.821 -2.715 -5.420 31 HG12 ILE 5 1HG1 ILE 5 -6.013 -3.623 -7.000 32 HG13 ILE 5 2HG1 ILE 5 -6.647 -3.110 -5.440 33 HG21 ILE 5 1HG2 ILE 5 -3.128 -5.106 -5.653 34 HG22 ILE 5 2HG2 ILE 5 -4.695 -5.426 -6.395 35 HG23 ILE 5 3HG2 ILE 5 -3.563 -4.318 -7.169 36 HD11 ILE 5 3HD1 ILE 5 -6.722 -1.241 -6.884 37 HD12 ILE 5 1HD1 ILE 5 -5.400 -0.962 -5.751 38 HD13 ILE 5 2HD1 ILE 5 -5.054 -1.487 -7.399 39 H LEU 6 H LEU 6 -3.405 -5.797 -3.049 40 HA LEU 6 HA LEU 6 -5.359 -7.902 -3.706 41 HB2 LEU 6 1HB LEU 6 -2.701 -7.607 -4.613 42 HB3 LEU 6 2HB LEU 6 -2.713 -8.957 -3.480 43 HG LEU 6 HG LEU 6 -4.773 -9.720 -4.945 44 HD11 LEU 6 1HD1 LEU 6 -3.240 -8.614 -7.199 45 HD12 LEU 6 2HD1 LEU 6 -4.212 -7.454 -6.294 46 HD13 LEU 6 3HD1 LEU 6 -4.976 -8.869 -7.017 47 HD21 LEU 6 3HD2 LEU 6 -3.337 -11.365 -5.327 48 HD22 LEU 6 1HD2 LEU 6 -2.004 -10.314 -4.847 49 HD23 LEU 6 2HD2 LEU 6 -2.512 -10.379 -6.535 50 H SER 7 H SER 7 -4.276 -10.032 -2.450 51 HA SER 7 HA SER 7 -4.432 -9.234 0.374 52 HB2 SER 7 1HB SER 7 -6.027 -10.976 -0.830 53 HB3 SER 7 2HB SER 7 -4.698 -12.084 -0.486 54 HG SER 7 HG SER 7 -6.464 -11.747 1.161 55 HA PRO 8 HA PRO 8 -0.153 -10.268 0.824 56 HB2 PRO 8 1HB PRO 8 -0.083 -10.237 3.538 57 HB3 PRO 8 2HB PRO 8 -0.142 -8.765 2.562 58 HG2 PRO 8 1HG PRO 8 -2.361 -10.189 3.979 59 HG3 PRO 8 2HG PRO 8 -2.027 -8.450 3.887 60 HD2 PRO 8 1HD PRO 8 -3.905 -9.657 2.354 61 HD3 PRO 8 2HD PRO 8 -2.975 -8.252 1.795 62 H SER 9 H SER 9 -2.770 -12.071 2.264 63 HA SER 9 HA SER 9 -1.013 -14.302 2.938 64 HB2 SER 9 1HB SER 9 -3.051 -13.394 4.342 65 HB3 SER 9 2HB SER 9 -3.989 -14.416 3.253 66 HG SER 9 HG SER 9 -1.817 -15.253 4.880 67 H ASP 10 H ASP 10 -1.431 -13.543 0.160 68 HA ASP 10 HA ASP 10 -2.421 -16.125 -0.810 69 HB2 ASP 10 1HB ASP 10 -3.242 -13.418 -1.875 70 HB3 ASP 10 2HB ASP 10 -3.490 -14.924 -2.753 71 H ILE 11 H ILE 11 -0.744 -13.110 -1.653 72 HA ILE 11 HA ILE 11 0.524 -14.025 -3.973 73 HB ILE 11 HB ILE 11 1.512 -11.963 -1.999 74 HG12 ILE 11 1HG1 ILE 11 0.359 -11.110 -4.567 75 HG13 ILE 11 2HG1 ILE 11 -0.789 -11.890 -3.484 76 HG21 ILE 11 1HG2 ILE 11 2.629 -13.013 -4.473 77 HG22 ILE 11 2HG2 ILE 11 2.427 -11.262 -4.495 78 HG23 ILE 11 3HG2 ILE 11 3.379 -12.024 -3.221 79 HD11 ILE 11 3HD1 ILE 11 -0.248 -10.288 -1.739 80 HD12 ILE 11 1HD1 ILE 11 0.930 -9.518 -2.801 81 HD13 ILE 11 2HD1 ILE 11 -0.786 -9.474 -3.208 82 H ALA 12 H ALA 12 1.169 -14.662 -0.645 83 HA ALA 12 HA ALA 12 3.903 -15.447 -0.966 84 HB1 ALA 12 1HB ALA 12 3.904 -15.482 1.258 85 HB2 ALA 12 2HB ALA 12 2.230 -14.931 1.188 86 HB3 ALA 12 3HB ALA 12 2.586 -16.654 1.308 87 H ALA 13 H ALA 13 0.802 -17.039 -1.190 88 HA ALA 13 HA ALA 13 1.615 -19.707 -0.967 89 HB1 ALA 13 1HB ALA 13 -0.655 -18.476 -2.519 90 HB2 ALA 13 2HB ALA 13 -0.441 -20.212 -2.293 91 HB3 ALA 13 3HB ALA 13 -0.711 -19.168 -0.897 92 H ALA 14 H ALA 14 2.133 -17.410 -3.466 93 HA ALA 14 HA ALA 14 2.763 -19.473 -5.440 94 HB1 ALA 14 1HB ALA 14 1.578 -17.037 -5.720 95 HB2 ALA 14 2HB ALA 14 3.243 -16.681 -6.181 96 HB3 ALA 14 3HB ALA 14 2.346 -17.943 -7.024 97 H LEU 15 H LEU 15 4.296 -16.954 -3.517 98 HA LEU 15 HA LEU 15 6.835 -17.004 -4.694 99 HB2 LEU 15 1HB LEU 15 5.908 -16.352 -1.911 100 HB3 LEU 15 2HB LEU 15 7.598 -16.220 -2.395 101 HG LEU 15 HG LEU 15 5.316 -14.689 -3.641 102 HD11 LEU 15 1HD1 LEU 15 7.152 -12.992 -2.351 103 HD12 LEU 15 2HD1 LEU 15 6.740 -14.264 -1.202 104 HD13 LEU 15 3HD1 LEU 15 5.465 -13.289 -1.932 105 HD21 LEU 15 3HD2 LEU 15 7.019 -14.924 -5.256 106 HD22 LEU 15 1HD2 LEU 15 8.293 -14.671 -4.063 107 HD23 LEU 15 2HD2 LEU 15 7.255 -13.328 -4.541 108 H ARG 16 H ARG 16 5.247 -19.284 -2.679 109 HA ARG 16 HA ARG 16 7.760 -20.638 -2.023 110 HB2 ARG 16 1HB ARG 16 5.809 -20.196 -0.351 111 HB3 ARG 16 2HB ARG 16 5.052 -21.575 -1.137 112 HG2 ARG 16 1HG ARG 16 7.847 -21.867 -0.175 113 HG3 ARG 16 2HG ARG 16 6.542 -21.853 1.013 114 HD2 ARG 16 1HD ARG 16 6.477 -23.626 -1.411 115 HD3 ARG 16 2HD ARG 16 7.268 -24.119 0.085 116 HE ARG 16 HE ARG 16 4.797 -23.367 0.899 117 HH11 ARG 16 1HH1 ARG 16 5.962 -25.553 -1.546 118 HH12 ARG 16 2HH1 ARG 16 4.595 -26.612 -1.437 119 HH21 ARG 16 1HH2 ARG 16 2.992 -24.753 1.053 120 HH22 ARG 16 2HH2 ARG 16 2.906 -26.155 0.041 121 H ASP 17 H ASP 17 4.681 -21.166 -3.680 122 HA ASP 17 HA ASP 17 5.338 -23.834 -4.496 123 HB2 ASP 17 1HB ASP 17 2.994 -22.706 -4.214 124 HB3 ASP 17 2HB ASP 17 3.261 -22.163 -5.869 125 H CYS 18 H CYS 18 6.453 -20.869 -5.466 126 HA CYS 18 HA CYS 18 7.276 -21.955 -8.070 127 HB2 CYS 18 1HB CYS 18 6.505 -19.069 -7.600 128 HB3 CYS 18 2HB CYS 18 6.974 -19.801 -9.130 129 HG CYS 18 HG CYS 18 4.573 -20.294 -9.857 130 H GLN 19 H GLN 19 8.558 -21.716 -5.388 131 HA GLN 19 HA GLN 19 10.562 -19.682 -5.607 132 HB2 GLN 19 1HB GLN 19 9.602 -21.056 -3.516 133 HB3 GLN 19 2HB GLN 19 11.016 -22.043 -3.863 134 HG2 GLN 19 1HG GLN 19 12.360 -20.573 -2.904 135 HG3 GLN 19 2HG GLN 19 11.716 -19.259 -3.888 136 HE21 GLN 19 2HE2 GLN 19 10.449 -21.318 -1.286 137 HE22 GLN 19 1HE2 GLN 19 9.871 -20.017 -0.308 138 H ALA 20 H ALA 20 10.145 -22.739 -6.993 139 HA ALA 20 HA ALA 20 12.945 -23.388 -7.246 140 HB1 ALA 20 1HB ALA 20 12.253 -25.412 -7.925 141 HB2 ALA 20 2HB ALA 20 10.682 -24.886 -7.321 142 HB3 ALA 20 3HB ALA 20 11.059 -24.743 -9.038 143 HA PRO 21 HA PRO 21 13.895 -21.338 -11.007 144 HB2 PRO 21 1HB PRO 21 15.415 -23.176 -12.304 145 HB3 PRO 21 2HB PRO 21 15.984 -22.288 -10.886 146 HG2 PRO 21 1HG PRO 21 14.876 -25.063 -11.065 147 HG3 PRO 21 2HG PRO 21 16.267 -24.472 -10.138 148 HD2 PRO 21 1HD PRO 21 13.846 -24.916 -9.009 149 HD3 PRO 21 2HD PRO 21 14.944 -23.640 -8.443 150 H ASP 22 H ASP 22 13.017 -21.000 -12.978 151 HA ASP 22 HA ASP 22 11.657 -21.252 -14.785 152 HB2 ASP 22 1HB ASP 22 12.096 -24.204 -14.822 153 HB3 ASP 22 2HB ASP 22 12.086 -23.054 -16.156 154 H SER 23 H SER 23 10.626 -21.702 -12.022 155 HA SER 23 HA SER 23 8.255 -23.317 -12.698 156 HB2 SER 23 1HB SER 23 9.517 -24.276 -10.837 157 HB3 SER 23 2HB SER 23 9.451 -22.738 -9.976 158 HG SER 23 HG SER 23 7.598 -24.712 -10.123 159 H PHE 24 H PHE 24 9.437 -20.230 -11.770 160 HA PHE 24 HA PHE 24 6.761 -19.268 -11.080 161 HB2 PHE 24 1HB PHE 24 8.498 -18.580 -9.551 162 HB3 PHE 24 2HB PHE 24 9.479 -17.963 -10.877 163 HD1 PHE 24 HD1 PHE 24 6.004 -17.524 -9.581 164 HD2 PHE 24 HD2 PHE 24 9.531 -15.689 -11.100 165 HE1 PHE 24 HE1 PHE 24 4.964 -15.310 -9.312 166 HE2 PHE 24 HE2 PHE 24 8.497 -13.472 -10.833 167 HZ PHE 24 HZ PHE 24 6.211 -13.281 -9.937 168 H SER 25 H SER 25 5.792 -17.516 -12.154 169 HA SER 25 HA SER 25 6.963 -16.280 -14.439 170 HB2 SER 25 1HB SER 25 5.195 -18.650 -14.816 171 HB3 SER 25 2HB SER 25 4.981 -17.287 -15.915 172 HG SER 25 HG SER 25 6.563 -18.280 -16.921 173 HA PRO 26 HA PRO 26 3.834 -13.303 -13.674 174 HB2 PRO 26 1HB PRO 26 3.352 -12.315 -16.156 175 HB3 PRO 26 2HB PRO 26 4.839 -11.981 -15.261 176 HG2 PRO 26 1HG PRO 26 4.343 -13.982 -17.432 177 HG3 PRO 26 2HG PRO 26 5.731 -12.903 -17.201 178 HD2 PRO 26 1HD PRO 26 5.791 -15.521 -16.511 179 HD3 PRO 26 2HD PRO 26 6.699 -14.279 -15.626 180 H LYS 27 H LYS 27 3.140 -15.505 -16.363 181 HA LYS 27 HA LYS 27 0.270 -15.109 -16.004 182 HB2 LYS 27 1HB LYS 27 0.047 -16.514 -18.019 183 HB3 LYS 27 2HB LYS 27 1.096 -15.128 -18.291 184 HG2 LYS 27 1HG LYS 27 2.684 -16.485 -19.011 185 HG3 LYS 27 2HG LYS 27 2.731 -17.267 -17.429 186 HD2 LYS 27 1HD LYS 27 2.328 -18.966 -19.052 187 HD3 LYS 27 2HD LYS 27 0.814 -18.699 -18.185 188 HE2 LYS 27 1HE LYS 27 -0.106 -17.471 -19.989 189 HE3 LYS 27 2HE LYS 27 1.458 -17.346 -20.794 190 HZ1 LYS 27 3HZ LYS 27 0.425 -20.030 -20.292 191 HZ2 LYS 27 1HZ LYS 27 1.312 -19.439 -21.607 192 HZ3 LYS 27 2HZ LYS 27 -0.346 -19.123 -21.495 193 H LYS 28 H LYS 28 1.782 -16.396 -13.912 194 HA LYS 28 HA LYS 28 0.331 -18.944 -13.850 195 HB2 LYS 28 1HB LYS 28 2.709 -19.370 -14.477 196 HB3 LYS 28 2HB LYS 28 3.203 -18.638 -12.956 197 HG2 LYS 28 1HG LYS 28 3.256 -20.895 -12.481 198 HG3 LYS 28 2HG LYS 28 1.672 -20.411 -11.871 199 HD2 LYS 28 1HD LYS 28 0.617 -21.232 -13.901 200 HD3 LYS 28 2HD LYS 28 2.194 -21.653 -14.573 201 HE2 LYS 28 1HE LYS 28 1.296 -22.787 -11.950 202 HE3 LYS 28 2HE LYS 28 0.753 -23.501 -13.468 203 HZ1 LYS 28 3HZ LYS 28 3.018 -24.172 -12.209 204 HZ2 LYS 28 1HZ LYS 28 3.599 -23.017 -13.300 205 HZ3 LYS 28 2HZ LYS 28 2.762 -24.372 -13.869 206 H PHE 29 H PHE 29 2.079 -16.448 -12.064 207 HA PHE 29 HA PHE 29 1.003 -17.311 -9.525 208 HB2 PHE 29 1HB PHE 29 2.420 -15.767 -8.543 209 HB3 PHE 29 2HB PHE 29 3.291 -16.129 -10.030 210 HD1 PHE 29 HD2 PHE 29 2.550 -14.568 -12.076 211 HD2 PHE 29 HD1 PHE 29 2.232 -13.566 -7.952 212 HE1 PHE 29 HE2 PHE 29 2.545 -12.178 -12.660 213 HE2 PHE 29 HE1 PHE 29 2.225 -11.175 -8.530 214 HZ PHE 29 HZ PHE 29 2.383 -10.478 -10.886 215 H PHE 30 H PHE 30 -0.006 -15.327 -12.087 216 HA PHE 30 HA PHE 30 -1.445 -13.319 -10.793 217 HB2 PHE 30 1HB PHE 30 -2.565 -12.967 -12.844 218 HB3 PHE 30 2HB PHE 30 -0.978 -13.584 -13.292 219 HD1 PHE 30 HD1 PHE 30 -0.834 -16.166 -13.641 220 HD2 PHE 30 HD2 PHE 30 -4.445 -13.917 -13.770 221 HE1 PHE 30 HE1 PHE 30 -1.899 -17.956 -14.951 222 HE2 PHE 30 HE2 PHE 30 -5.516 -15.703 -15.079 223 HZ PHE 30 HZ PHE 30 -4.243 -17.727 -15.671 224 H GLN 31 H GLN 31 -2.133 -16.695 -11.200 225 HA GLN 31 HA GLN 31 -4.903 -16.384 -10.360 226 HB2 GLN 31 1HB GLN 31 -5.218 -18.633 -10.939 227 HB3 GLN 31 2HB GLN 31 -4.085 -18.036 -12.145 228 HG2 GLN 31 1HG GLN 31 -2.294 -18.940 -10.466 229 HG3 GLN 31 2HG GLN 31 -3.637 -19.926 -9.892 230 HE21 GLN 31 2HE2 GLN 31 -1.047 -20.115 -11.720 231 HE22 GLN 31 1HE2 GLN 31 -1.575 -21.204 -12.953 232 H ILE 32 H ILE 32 -1.816 -17.439 -9.107 233 HA ILE 32 HA ILE 32 -2.872 -18.628 -6.726 234 HB ILE 32 HB ILE 32 -0.067 -17.703 -7.359 235 HG12 ILE 32 1HG1 ILE 32 -0.821 -20.573 -7.181 236 HG13 ILE 32 2HG1 ILE 32 -1.370 -19.690 -8.601 237 HG21 ILE 32 1HG2 ILE 32 -0.194 -17.783 -5.017 238 HG22 ILE 32 2HG2 ILE 32 -1.205 -19.227 -5.037 239 HG23 ILE 32 3HG2 ILE 32 0.497 -19.337 -5.486 240 HD11 ILE 32 3HD1 ILE 32 1.493 -19.591 -7.750 241 HD12 ILE 32 1HD1 ILE 32 0.870 -20.938 -8.702 242 HD13 ILE 32 2HD1 ILE 32 0.790 -19.295 -9.340 243 H SER 33 H SER 33 -0.970 -15.657 -7.280 244 HA SER 33 HA SER 33 -1.228 -14.626 -4.698 245 HB2 SER 33 1HB SER 33 -0.855 -13.179 -7.330 246 HB3 SER 33 2HB SER 33 -0.674 -12.425 -5.746 247 HG SER 33 HG SER 33 0.766 -14.759 -6.360 248 H GLY 34 H GLY 34 -3.132 -13.868 -7.615 249 HA2 GLY 34 1HA GLY 34 -5.611 -13.840 -7.160 250 HA3 GLY 34 2HA GLY 34 -5.212 -12.758 -5.834 251 H MET 35 H MET 35 -3.651 -12.663 -8.975 252 HA MET 35 HA MET 35 -4.503 -9.904 -9.286 253 HB2 MET 35 1HB MET 35 -2.536 -11.648 -10.756 254 HB3 MET 35 2HB MET 35 -2.978 -10.048 -11.336 255 HG2 MET 35 1HG MET 35 -2.352 -9.520 -8.749 256 HG3 MET 35 2HG MET 35 -1.244 -10.840 -9.116 257 HE1 MET 35 3HE MET 35 0.428 -9.332 -12.418 258 HE2 MET 35 1HE MET 35 0.047 -10.820 -11.550 259 HE3 MET 35 2HE MET 35 -1.209 -9.988 -12.469 260 H SER 36 H SER 36 -5.347 -13.013 -10.457 261 HA SER 36 HA SER 36 -6.313 -12.501 -13.000 262 HB2 SER 36 1HB SER 36 -7.927 -14.387 -12.538 263 HB3 SER 36 2HB SER 36 -6.237 -14.761 -12.200 264 HG SER 36 HG SER 36 -6.730 -15.036 -10.180 265 H LYS 37 H LYS 37 -7.728 -11.767 -9.882 266 HA LYS 37 HA LYS 37 -10.332 -11.142 -10.786 267 HB2 LYS 37 1HB LYS 37 -8.872 -10.054 -8.372 268 HB3 LYS 37 2HB LYS 37 -10.611 -10.023 -8.633 269 HG2 LYS 37 1HG LYS 37 -10.806 -12.343 -8.358 270 HG3 LYS 37 2HG LYS 37 -9.068 -12.594 -8.538 271 HD2 LYS 37 1HD LYS 37 -8.718 -11.341 -6.425 272 HD3 LYS 37 2HD LYS 37 -10.470 -11.237 -6.235 273 HE2 LYS 37 1HE LYS 37 -10.030 -13.092 -4.967 274 HE3 LYS 37 2HE LYS 37 -10.326 -13.846 -6.533 275 HZ1 LYS 37 3HZ LYS 37 -7.906 -13.839 -6.902 276 HZ2 LYS 37 1HZ LYS 37 -8.356 -14.769 -5.562 277 HZ3 LYS 37 2HZ LYS 37 -7.678 -13.236 -5.338 278 H LYS 38 H LYS 38 -7.340 -9.370 -10.736 279 HA LYS 38 HA LYS 38 -8.240 -6.749 -10.903 280 HB2 LYS 38 1HB LYS 38 -5.875 -7.940 -12.363 281 HB3 LYS 38 2HB LYS 38 -6.117 -6.239 -11.989 282 HG2 LYS 38 1HG LYS 38 -5.654 -8.475 -10.029 283 HG3 LYS 38 2HG LYS 38 -4.541 -7.168 -10.442 284 HD2 LYS 38 1HD LYS 38 -5.401 -6.174 -8.615 285 HD3 LYS 38 2HD LYS 38 -6.739 -5.763 -9.690 286 HE2 LYS 38 1HE LYS 38 -8.151 -7.214 -8.694 287 HE3 LYS 38 2HE LYS 38 -6.894 -8.424 -8.442 288 HZ1 LYS 38 3HZ LYS 38 -7.495 -7.692 -6.318 289 HZ2 LYS 38 1HZ LYS 38 -7.517 -6.062 -6.773 290 HZ3 LYS 38 2HZ LYS 38 -6.045 -6.884 -6.643 291 H SER 39 H SER 39 -7.763 -5.436 -13.064 292 HA SER 39 HA SER 39 -8.781 -6.762 -15.432 293 HB2 SER 39 1HB SER 39 -10.535 -4.824 -15.620 294 HB3 SER 39 2HB SER 39 -10.910 -6.248 -14.650 295 HG SER 39 HG SER 39 -9.761 -3.890 -13.577 296 H SER 40 H SER 40 -6.291 -5.640 -14.936 297 HA SER 40 HA SER 40 -4.748 -4.251 -15.865 298 HB2 SER 40 1HB SER 40 -5.006 -3.779 -18.091 299 HB3 SER 40 2HB SER 40 -6.344 -4.914 -17.913 300 HG SER 40 HG SER 40 -7.589 -3.341 -18.498 301 H SER 41 H SER 41 -6.946 -3.281 -13.956 302 HA SER 41 HA SER 41 -6.560 -0.395 -14.419 303 HB2 SER 41 1HB SER 41 -8.942 -1.888 -13.902 304 HB3 SER 41 2HB SER 41 -8.642 -0.827 -12.526 305 HG SER 41 HG SER 41 -8.641 0.020 -15.234 306 H GLN 42 H GLN 42 -5.757 -3.002 -12.460 307 HA GLN 42 HA GLN 42 -4.906 -1.184 -10.304 308 HB2 GLN 42 1HB GLN 42 -5.736 -4.072 -9.984 309 HB3 GLN 42 2HB GLN 42 -5.232 -2.984 -8.697 310 HG2 GLN 42 1HG GLN 42 -7.351 -2.440 -8.404 311 HG3 GLN 42 2HG GLN 42 -7.333 -1.680 -9.994 312 HE21 GLN 42 2HE2 GLN 42 -7.077 -3.936 -11.588 313 HE22 GLN 42 1HE2 GLN 42 -8.524 -4.871 -11.471 314 H LEU 43 H LEU 43 -3.998 -3.399 -12.676 315 HA LEU 43 HA LEU 43 -1.757 -4.634 -11.525 316 HB2 LEU 43 1HB LEU 43 -2.070 -3.836 -14.411 317 HB3 LEU 43 2HB LEU 43 -1.052 -5.121 -13.765 318 HG LEU 43 HG LEU 43 -3.995 -5.081 -14.237 319 HD11 LEU 43 1HD1 LEU 43 -3.098 -6.307 -15.903 320 HD12 LEU 43 2HD1 LEU 43 -3.133 -7.586 -14.690 321 HD13 LEU 43 3HD1 LEU 43 -1.642 -6.692 -14.985 322 HD21 LEU 43 3HD2 LEU 43 -4.229 -5.728 -12.058 323 HD22 LEU 43 1HD2 LEU 43 -2.601 -6.399 -11.964 324 HD23 LEU 43 2HD2 LEU 43 -3.875 -7.289 -12.799 325 H LYS 44 H LYS 44 -1.985 -1.680 -13.499 326 HA LYS 44 HA LYS 44 0.795 -1.042 -13.027 327 HB2 LYS 44 1HB LYS 44 0.483 0.777 -14.511 328 HB3 LYS 44 2HB LYS 44 -0.464 -0.549 -15.174 329 HG2 LYS 44 1HG LYS 44 -2.333 0.654 -13.654 330 HG3 LYS 44 2HG LYS 44 -1.331 2.042 -14.085 331 HD2 LYS 44 1HD LYS 44 -1.942 0.215 -16.305 332 HD3 LYS 44 2HD LYS 44 -3.339 1.051 -15.623 333 HE2 LYS 44 1HE LYS 44 -2.100 3.195 -15.886 334 HE3 LYS 44 2HE LYS 44 -0.822 2.305 -16.713 335 HZ1 LYS 44 3HZ LYS 44 -2.074 2.040 -18.561 336 HZ2 LYS 44 1HZ LYS 44 -2.806 3.459 -18.001 337 HZ3 LYS 44 2HZ LYS 44 -3.538 1.960 -17.718 338 H GLU 45 H GLU 45 -1.763 -0.910 -11.076 339 HA GLU 45 HA GLU 45 -1.656 1.756 -10.073 340 HB2 GLU 45 1HB GLU 45 -3.611 0.227 -9.807 341 HB3 GLU 45 2HB GLU 45 -2.661 -0.729 -8.678 342 HG2 GLU 45 1HG GLU 45 -3.006 2.186 -8.178 343 HG3 GLU 45 2HG GLU 45 -4.335 1.083 -7.824 344 H ILE 46 H ILE 46 -0.269 -1.331 -9.008 345 HA ILE 46 HA ILE 46 1.031 -0.237 -6.723 346 HB ILE 46 HB ILE 46 1.695 -2.785 -8.202 347 HG12 ILE 46 1HG1 ILE 46 0.326 -3.534 -5.965 348 HG13 ILE 46 2HG1 ILE 46 -0.506 -2.041 -6.385 349 HG21 ILE 46 1HG2 ILE 46 2.522 -3.462 -5.912 350 HG22 ILE 46 2HG2 ILE 46 3.488 -2.253 -6.757 351 HG23 ILE 46 3HG2 ILE 46 2.396 -1.762 -5.463 352 HD11 ILE 46 3HD1 ILE 46 -0.789 -4.624 -7.524 353 HD12 ILE 46 1HD1 ILE 46 -1.676 -3.145 -7.894 354 HD13 ILE 46 2HD1 ILE 46 -0.189 -3.524 -8.764 355 H PHE 47 H PHE 47 2.039 -0.926 -10.037 356 HA PHE 47 HA PHE 47 3.863 -0.307 -11.244 357 HB2 PHE 47 1HB PHE 47 3.692 1.877 -9.196 358 HB3 PHE 47 2HB PHE 47 5.045 1.834 -10.321 359 HD1 PHE 47 HD2 PHE 47 3.824 0.957 -12.800 360 HD2 PHE 47 HD1 PHE 47 2.343 3.631 -9.838 361 HE1 PHE 47 HE2 PHE 47 2.445 2.075 -14.504 362 HE2 PHE 47 HE1 PHE 47 0.960 4.752 -11.537 363 HZ PHE 47 HZ PHE 47 1.011 3.975 -13.873 364 H ARG 48 H ARG 48 4.184 -2.289 -9.181 365 HA ARG 48 HA ARG 48 7.082 -2.065 -8.823 366 HB2 ARG 48 1HB ARG 48 7.071 -2.282 -6.570 367 HB3 ARG 48 2HB ARG 48 5.462 -1.587 -6.713 368 HG2 ARG 48 1HG ARG 48 4.572 -3.935 -6.817 369 HG3 ARG 48 2HG ARG 48 6.194 -4.483 -6.389 370 HD2 ARG 48 1HD ARG 48 4.627 -2.500 -4.752 371 HD3 ARG 48 2HD ARG 48 4.577 -4.240 -4.471 372 HE ARG 48 HE ARG 48 7.214 -3.718 -4.402 373 HH11 ARG 48 1HH1 ARG 48 4.484 -2.242 -2.824 374 HH12 ARG 48 2HH1 ARG 48 5.385 -1.769 -1.422 375 HH21 ARG 48 1HH2 ARG 48 8.411 -3.100 -2.562 376 HH22 ARG 48 2HH2 ARG 48 7.619 -2.256 -1.274 377 H ILE 49 H ILE 49 4.703 -3.691 -10.206 378 HA ILE 49 HA ILE 49 5.975 -6.320 -9.799 379 HB ILE 49 HB ILE 49 3.871 -7.380 -10.384 380 HG12 ILE 49 1HG1 ILE 49 3.180 -5.327 -11.825 381 HG13 ILE 49 2HG1 ILE 49 1.927 -6.253 -11.005 382 HG21 ILE 49 1HG2 ILE 49 3.809 -5.358 -8.172 383 HG22 ILE 49 2HG2 ILE 49 2.472 -6.477 -8.436 384 HG23 ILE 49 3HG2 ILE 49 4.083 -7.097 -8.076 385 HD11 ILE 49 3HD1 ILE 49 1.325 -4.522 -9.737 386 HD12 ILE 49 1HD1 ILE 49 2.994 -4.050 -9.417 387 HD13 ILE 49 2HD1 ILE 49 2.206 -3.549 -10.915 388 H LEU 50 H LEU 50 5.523 -3.809 -11.949 389 HA LEU 50 HA LEU 50 5.798 -5.555 -14.298 390 HB2 LEU 50 1HB LEU 50 5.302 -2.602 -14.401 391 HB3 LEU 50 2HB LEU 50 4.970 -3.821 -15.629 392 HG LEU 50 HG LEU 50 3.476 -3.779 -13.025 393 HD11 LEU 50 1HD1 LEU 50 3.276 -1.554 -14.063 394 HD12 LEU 50 2HD1 LEU 50 1.753 -2.443 -14.065 395 HD13 LEU 50 3HD1 LEU 50 2.702 -2.318 -15.546 396 HD21 LEU 50 3HD2 LEU 50 1.775 -4.920 -14.375 397 HD22 LEU 50 1HD2 LEU 50 3.307 -5.794 -14.372 398 HD23 LEU 50 2HD2 LEU 50 2.841 -4.837 -15.779 399 H ASP 51 H ASP 51 6.967 -2.329 -13.317 400 HA ASP 51 HA ASP 51 9.704 -3.143 -13.868 401 HB2 ASP 51 1HB ASP 51 9.840 -0.841 -15.205 402 HB3 ASP 51 2HB ASP 51 9.451 -2.361 -16.004 403 H ASN 52 H ASN 52 11.222 -1.211 -13.426 404 HA ASN 52 HA ASN 52 10.171 0.300 -11.123 405 HB2 ASN 52 1HB ASN 52 12.487 0.176 -10.184 406 HB3 ASN 52 2HB ASN 52 11.686 -1.388 -10.306 407 HD21 ASN 52 2HD2 ASN 52 12.707 -2.971 -11.320 408 HD22 ASN 52 1HD2 ASN 52 14.120 -2.790 -12.299 409 H ASP 53 H ASP 53 10.950 0.709 -14.188 410 HA ASP 53 HA ASP 53 12.481 3.187 -13.784 411 HB2 ASP 53 1HB ASP 53 12.961 3.076 -16.202 412 HB3 ASP 53 2HB ASP 53 13.500 1.626 -15.358 413 H GLN 54 H GLN 54 9.527 1.866 -15.151 414 HA GLN 54 HA GLN 54 7.635 2.836 -15.971 415 HB2 GLN 54 1HB GLN 54 8.225 5.249 -14.294 416 HB3 GLN 54 2HB GLN 54 6.680 4.473 -14.616 417 HG2 GLN 54 1HG GLN 54 8.854 3.597 -12.748 418 HG3 GLN 54 2HG GLN 54 7.177 3.995 -12.378 419 HE21 GLN 54 2HE2 GLN 54 5.528 2.536 -13.124 420 HE22 GLN 54 1HE2 GLN 54 5.889 0.858 -13.315 421 H SER 55 H SER 55 10.152 3.386 -17.366 422 HA SER 55 HA SER 55 9.926 6.111 -18.319 423 HB2 SER 55 1HB SER 55 12.154 5.518 -18.315 424 HB3 SER 55 2HB SER 55 11.820 3.845 -18.759 425 HG SER 55 HG SER 55 12.703 5.587 -20.367 426 H GLY 56 H GLY 56 9.412 2.840 -19.594 427 HA2 GLY 56 1HA GLY 56 7.222 3.500 -21.180 428 HA3 GLY 56 2HA GLY 56 8.647 3.653 -22.197 429 H PHE 57 H PHE 57 10.226 1.605 -21.470 430 HA PHE 57 HA PHE 57 8.546 -0.779 -21.893 431 HB2 PHE 57 1HB PHE 57 10.153 -1.672 -23.408 432 HB3 PHE 57 2HB PHE 57 9.872 -0.008 -23.909 433 HD1 PHE 57 HD1 PHE 57 11.533 1.757 -22.975 434 HD2 PHE 57 HD2 PHE 57 12.312 -2.425 -23.113 435 HE1 PHE 57 HE1 PHE 57 13.948 2.206 -22.842 436 HE2 PHE 57 HE2 PHE 57 14.728 -1.983 -22.979 437 HZ PHE 57 HZ PHE 57 15.550 0.335 -22.843 438 H ILE 58 H ILE 58 10.133 -2.816 -21.567 439 HA ILE 58 HA ILE 58 11.584 -2.404 -19.039 440 HB ILE 58 HB ILE 58 9.912 -4.849 -19.580 441 HG12 ILE 58 1HG1 ILE 58 9.143 -2.402 -17.973 442 HG13 ILE 58 2HG1 ILE 58 8.450 -2.861 -19.525 443 HG21 ILE 58 1HG2 ILE 58 11.271 -3.720 -17.145 444 HG22 ILE 58 2HG2 ILE 58 10.083 -5.020 -17.073 445 HG23 ILE 58 3HG2 ILE 58 11.591 -5.253 -17.956 446 HD11 ILE 58 3HD1 ILE 58 8.159 -5.105 -17.901 447 HD12 ILE 58 1HD1 ILE 58 7.751 -3.727 -16.880 448 HD13 ILE 58 2HD1 ILE 58 6.903 -3.975 -18.407 449 H GLU 59 H GLU 59 13.206 -4.007 -18.566 450 HA GLU 59 HA GLU 59 14.077 -5.598 -20.876 451 HB2 GLU 59 1HB GLU 59 15.306 -3.354 -20.615 452 HB3 GLU 59 2HB GLU 59 16.039 -4.067 -19.185 453 HG2 GLU 59 1HG GLU 59 17.121 -5.738 -20.454 454 HG3 GLU 59 2HG GLU 59 16.176 -5.357 -21.892 455 H GLU 60 H GLU 60 15.750 -7.229 -20.272 456 HA GLU 60 HA GLU 60 14.855 -8.848 -18.180 457 HB2 GLU 60 1HB GLU 60 16.897 -10.175 -18.569 458 HB3 GLU 60 2HB GLU 60 16.080 -9.758 -20.069 459 HG2 GLU 60 1HG GLU 60 17.713 -7.804 -20.213 460 HG3 GLU 60 2HG GLU 60 18.624 -8.637 -18.954 461 H ASP 61 H ASP 61 16.989 -6.164 -18.160 462 HA ASP 61 HA ASP 61 18.364 -6.868 -15.733 463 HB2 ASP 61 1HB ASP 61 19.380 -5.413 -17.475 464 HB3 ASP 61 2HB ASP 61 18.176 -4.180 -17.108 465 H GLU 62 H GLU 62 15.269 -5.912 -16.357 466 HA GLU 62 HA GLU 62 15.006 -4.668 -13.698 467 HB2 GLU 62 1HB GLU 62 13.790 -3.940 -16.318 468 HB3 GLU 62 2HB GLU 62 12.806 -3.740 -14.876 469 HG2 GLU 62 1HG GLU 62 13.989 -1.978 -14.151 470 HG3 GLU 62 2HG GLU 62 15.526 -2.657 -14.682 471 H LEU 63 H LEU 63 14.829 -7.506 -14.612 472 HA LEU 63 HA LEU 63 12.037 -8.046 -13.843 473 HB2 LEU 63 1HB LEU 63 13.918 -9.899 -15.292 474 HB3 LEU 63 2HB LEU 63 12.198 -10.146 -14.996 475 HG LEU 63 HG LEU 63 13.437 -8.112 -16.848 476 HD11 LEU 63 1HD1 LEU 63 11.496 -10.061 -17.852 477 HD12 LEU 63 2HD1 LEU 63 13.013 -10.764 -17.290 478 HD13 LEU 63 3HD1 LEU 63 13.027 -9.520 -18.540 479 HD21 LEU 63 3HD2 LEU 63 11.551 -6.951 -16.751 480 HD22 LEU 63 1HD2 LEU 63 10.950 -8.032 -15.492 481 HD23 LEU 63 2HD2 LEU 63 10.628 -8.390 -17.189 482 H LYS 64 H LYS 64 15.342 -9.335 -13.534 483 HA LYS 64 HA LYS 64 14.907 -11.239 -11.588 484 HB2 LYS 64 1HB LYS 64 17.297 -10.746 -10.882 485 HB3 LYS 64 2HB LYS 64 17.053 -11.143 -12.577 486 HG2 LYS 64 1HG LYS 64 17.179 -8.797 -13.174 487 HG3 LYS 64 2HG LYS 64 17.347 -8.357 -11.473 488 HD2 LYS 64 1HD LYS 64 19.440 -9.648 -11.367 489 HD3 LYS 64 2HD LYS 64 19.277 -10.030 -13.082 490 HE2 LYS 64 1HE LYS 64 20.701 -8.222 -13.149 491 HE3 LYS 64 2HE LYS 64 19.135 -7.440 -13.355 492 HZ1 LYS 64 3HZ LYS 64 21.044 -7.029 -11.333 493 HZ2 LYS 64 1HZ LYS 64 19.627 -7.619 -10.621 494 HZ3 LYS 64 2HZ LYS 64 19.576 -6.225 -11.576 495 H TYR 65 H TYR 65 15.755 -11.073 -9.265 496 HA TYR 65 HA TYR 65 15.433 -10.310 -7.147 497 HB2 TYR 65 1HB TYR 65 15.803 -7.674 -8.572 498 HB3 TYR 65 2HB TYR 65 15.648 -7.807 -6.823 499 HD1 TYR 65 HD2 TYR 65 17.659 -9.240 -9.629 500 HD2 TYR 65 HD1 TYR 65 17.579 -7.977 -5.567 501 HE1 TYR 65 HE2 TYR 65 20.075 -9.667 -9.455 502 HE2 TYR 65 HE1 TYR 65 19.995 -8.399 -5.382 503 HH TYR 65 HH TYR 65 21.700 -9.885 -6.568 504 H PHE 66 H PHE 66 13.143 -10.656 -9.043 505 HA PHE 66 HA PHE 66 11.177 -8.710 -8.271 506 HB2 PHE 66 1HB PHE 66 11.008 -9.792 -10.444 507 HB3 PHE 66 2HB PHE 66 10.900 -11.374 -9.678 508 HD1 PHE 66 HD2 PHE 66 8.873 -12.027 -8.462 509 HD2 PHE 66 HD1 PHE 66 9.119 -8.346 -10.584 510 HE1 PHE 66 HE2 PHE 66 6.422 -11.823 -8.385 511 HE2 PHE 66 HE1 PHE 66 6.669 -8.135 -10.510 512 HZ PHE 66 HZ PHE 66 5.317 -9.876 -9.411 513 H LEU 67 H LEU 67 11.754 -12.135 -7.510 514 HA LEU 67 HA LEU 67 9.613 -12.533 -5.782 515 HB2 LEU 67 1HB LEU 67 12.335 -13.758 -5.421 516 HB3 LEU 67 2HB LEU 67 10.774 -14.435 -4.960 517 HG LEU 67 HG LEU 67 11.749 -14.040 -7.789 518 HD11 LEU 67 1HD1 LEU 67 11.594 -16.464 -6.016 519 HD12 LEU 67 2HD1 LEU 67 13.010 -15.797 -6.827 520 HD13 LEU 67 3HD1 LEU 67 11.730 -16.558 -7.772 521 HD21 LEU 67 3HD2 LEU 67 9.476 -13.948 -8.039 522 HD22 LEU 67 1HD2 LEU 67 9.166 -14.917 -6.599 523 HD23 LEU 67 2HD2 LEU 67 9.723 -15.694 -8.081 524 H GLN 68 H GLN 68 12.486 -10.704 -5.340 525 HA GLN 68 HA GLN 68 12.553 -10.771 -2.489 526 HB2 GLN 68 1HB GLN 68 14.317 -9.972 -4.373 527 HB3 GLN 68 2HB GLN 68 13.667 -8.412 -3.887 528 HG2 GLN 68 1HG GLN 68 14.298 -8.806 -1.600 529 HG3 GLN 68 2HG GLN 68 14.825 -10.442 -1.992 530 HE21 GLN 68 2HE2 GLN 68 16.238 -10.098 -4.268 531 HE22 GLN 68 1HE2 GLN 68 17.617 -9.100 -3.977 532 H ARG 69 H ARG 69 10.856 -8.882 -4.864 533 HA ARG 69 HA ARG 69 10.195 -6.614 -3.411 534 HB2 ARG 69 1HB ARG 69 8.687 -8.144 -5.523 535 HB3 ARG 69 2HB ARG 69 8.063 -6.653 -4.830 536 HG2 ARG 69 1HG ARG 69 10.817 -6.712 -5.975 537 HG3 ARG 69 2HG ARG 69 9.417 -6.593 -7.042 538 HD2 ARG 69 1HD ARG 69 9.795 -4.375 -6.690 539 HD3 ARG 69 2HD ARG 69 8.734 -4.700 -5.320 540 HE ARG 69 HE ARG 69 11.462 -5.102 -4.633 541 HH11 ARG 69 1HH1 ARG 69 9.069 -2.631 -5.171 542 HH12 ARG 69 2HH1 ARG 69 9.837 -1.478 -4.131 543 HH21 ARG 69 1HH2 ARG 69 12.482 -3.592 -3.261 544 HH22 ARG 69 2HH2 ARG 69 11.779 -2.025 -3.046 545 H PHE 70 H PHE 70 8.236 -9.580 -3.731 546 HA PHE 70 HA PHE 70 6.563 -8.768 -1.512 547 HB2 PHE 70 1HB PHE 70 6.549 -11.285 -3.191 548 HB3 PHE 70 2HB PHE 70 5.340 -10.873 -1.979 549 HD1 PHE 70 HD2 PHE 70 6.828 -9.740 -5.178 550 HD2 PHE 70 HD1 PHE 70 3.508 -9.536 -2.523 551 HE1 PHE 70 HE2 PHE 70 5.547 -8.510 -6.880 552 HE2 PHE 70 HE1 PHE 70 2.220 -8.307 -4.221 553 HZ PHE 70 HZ PHE 70 3.240 -7.791 -6.403 554 H GLU 71 H GLU 71 8.774 -11.459 -2.238 555 HA GLU 71 HA GLU 71 8.662 -12.408 0.490 556 HB2 GLU 71 1HB GLU 71 8.996 -13.765 -1.743 557 HB3 GLU 71 2HB GLU 71 10.690 -13.373 -1.483 558 HG2 GLU 71 1HG GLU 71 10.462 -15.441 -0.479 559 HG3 GLU 71 2HG GLU 71 10.334 -14.321 0.877 560 H SER 72 H SER 72 10.078 -11.998 2.079 561 HA SER 72 HA SER 72 12.198 -10.068 1.537 562 HB2 SER 72 1HB SER 72 10.681 -10.927 3.954 563 HB3 SER 72 2HB SER 72 12.318 -10.316 4.193 564 HG SER 72 HG SER 72 11.026 -8.549 4.263 565 H GLY 73 H GLY 73 12.201 -13.114 1.018 566 HA2 GLY 73 1HA GLY 73 14.786 -13.616 2.361 567 HA3 GLY 73 2HA GLY 73 13.590 -14.881 2.121 568 H ALA 74 H ALA 74 13.374 -13.020 -0.551 569 HA ALA 74 HA ALA 74 14.794 -14.937 -2.160 570 HB1 ALA 74 1HB ALA 74 13.325 -14.317 -3.701 571 HB2 ALA 74 2HB ALA 74 12.658 -13.153 -2.556 572 HB3 ALA 74 3HB ALA 74 13.934 -12.662 -3.670 573 H ARG 75 H ARG 75 16.120 -13.982 -4.070 574 HA ARG 75 HA ARG 75 17.827 -11.770 -3.210 575 HB2 ARG 75 1HB ARG 75 19.740 -13.410 -4.161 576 HB3 ARG 75 2HB ARG 75 19.322 -13.297 -2.456 577 HG2 ARG 75 1HG ARG 75 18.311 -15.334 -2.423 578 HG3 ARG 75 2HG ARG 75 17.824 -15.244 -4.116 579 HD2 ARG 75 1HD ARG 75 19.765 -16.133 -4.859 580 HD3 ARG 75 2HD ARG 75 20.727 -15.332 -3.617 581 HE ARG 75 HE ARG 75 20.488 -17.182 -2.275 582 HH11 ARG 75 1HH1 ARG 75 18.276 -17.388 -4.956 583 HH12 ARG 75 2HH1 ARG 75 17.827 -19.029 -4.628 584 HH21 ARG 75 1HH2 ARG 75 19.905 -19.342 -1.833 585 HH22 ARG 75 2HH2 ARG 75 18.753 -20.139 -2.850 586 H VAL 76 H VAL 76 18.071 -14.252 -5.749 587 HA VAL 76 HA VAL 76 17.516 -12.218 -7.778 588 HB VAL 76 HB VAL 76 19.883 -14.031 -8.141 589 HG11 VAL 76 1HG1 VAL 76 20.475 -11.898 -9.565 590 HG12 VAL 76 2HG1 VAL 76 19.382 -13.135 -10.188 591 HG13 VAL 76 3HG1 VAL 76 18.731 -11.646 -9.500 592 HG21 VAL 76 3HG2 VAL 76 20.684 -12.927 -6.291 593 HG22 VAL 76 1HG2 VAL 76 21.166 -11.815 -7.572 594 HG23 VAL 76 2HG2 VAL 76 19.729 -11.478 -6.606 595 H LEU 77 H LEU 77 17.162 -13.157 -9.933 596 HA LEU 77 HA LEU 77 15.948 -15.821 -9.703 597 HB2 LEU 77 1HB LEU 77 15.421 -13.486 -11.515 598 HB3 LEU 77 2HB LEU 77 14.804 -15.098 -11.872 599 HG LEU 77 HG LEU 77 14.187 -13.934 -9.207 600 HD11 LEU 77 1HD1 LEU 77 12.092 -12.967 -10.425 601 HD12 LEU 77 2HD1 LEU 77 13.178 -12.890 -11.812 602 HD13 LEU 77 3HD1 LEU 77 13.579 -12.023 -10.330 603 HD21 LEU 77 3HD2 LEU 77 13.534 -16.242 -10.012 604 HD22 LEU 77 1HD2 LEU 77 12.439 -15.438 -11.138 605 HD23 LEU 77 2HD2 LEU 77 12.223 -15.232 -9.400 606 H THR 78 H THR 78 15.770 -16.697 -12.202 607 HA THR 78 HA THR 78 18.578 -17.025 -13.005 608 HB THR 78 HB THR 78 17.887 -19.100 -14.096 609 HG1 THR 78 HG1 THR 78 15.350 -18.108 -13.477 610 HG21 THR 78 3HG2 THR 78 17.268 -20.385 -12.091 611 HG22 THR 78 1HG2 THR 78 16.885 -18.881 -11.255 612 HG23 THR 78 2HG2 THR 78 18.544 -19.217 -11.752 613 H ALA 79 H ALA 79 18.530 -17.849 -15.496 614 HA ALA 79 HA ALA 79 17.770 -15.498 -16.978 615 HB1 ALA 79 1HB ALA 79 19.858 -17.131 -17.221 616 HB2 ALA 79 2HB ALA 79 18.782 -17.897 -18.391 617 HB3 ALA 79 3HB ALA 79 19.222 -16.199 -18.577 618 H SER 80 H SER 80 16.054 -18.101 -16.003 619 HA SER 80 HA SER 80 14.492 -18.320 -18.480 620 HB2 SER 80 1HB SER 80 15.064 -20.138 -16.233 621 HB3 SER 80 2HB SER 80 13.388 -20.155 -16.781 622 HG SER 80 HG SER 80 14.423 -20.345 -18.972 623 H GLU 81 H GLU 81 13.952 -18.054 -14.963 624 HA GLU 81 HA GLU 81 11.253 -17.501 -14.981 625 HB2 GLU 81 1HB GLU 81 13.302 -16.267 -13.132 626 HB3 GLU 81 2HB GLU 81 11.580 -16.424 -12.817 627 HG2 GLU 81 1HG GLU 81 13.393 -18.776 -13.269 628 HG3 GLU 81 2HG GLU 81 13.057 -18.099 -11.677 629 H THR 82 H THR 82 13.939 -15.192 -15.240 630 HA THR 82 HA THR 82 12.254 -12.907 -15.486 631 HB THR 82 HB THR 82 14.298 -11.709 -16.173 632 HG1 THR 82 HG1 THR 82 15.816 -14.042 -15.779 633 HG21 THR 82 3HG2 THR 82 15.319 -13.372 -13.960 634 HG22 THR 82 1HG2 THR 82 13.719 -12.672 -13.716 635 HG23 THR 82 2HG2 THR 82 15.097 -11.625 -14.057 636 H LYS 83 H LYS 83 14.054 -14.891 -17.813 637 HA LYS 83 HA LYS 83 13.542 -13.448 -20.124 638 HB2 LYS 83 1HB LYS 83 15.094 -15.272 -20.177 639 HB3 LYS 83 2HB LYS 83 13.851 -16.421 -19.698 640 HG2 LYS 83 1HG LYS 83 12.881 -16.449 -21.792 641 HG3 LYS 83 2HG LYS 83 13.554 -14.879 -22.238 642 HD2 LYS 83 1HD LYS 83 15.757 -15.829 -22.450 643 HD3 LYS 83 2HD LYS 83 15.190 -17.382 -21.833 644 HE2 LYS 83 1HE LYS 83 13.732 -17.624 -23.780 645 HE3 LYS 83 2HE LYS 83 14.281 -16.064 -24.391 646 HZ1 LYS 83 3HZ LYS 83 15.800 -18.587 -24.168 647 HZ2 LYS 83 1HZ LYS 83 16.592 -17.098 -24.298 648 HZ3 LYS 83 2HZ LYS 83 15.557 -17.616 -25.532 649 H THR 84 H THR 84 11.403 -15.355 -18.210 650 HA THR 84 HA THR 84 9.358 -15.305 -20.320 651 HB THR 84 HB THR 84 9.846 -17.500 -19.230 652 HG1 THR 84 HG1 THR 84 7.813 -17.239 -20.134 653 HG21 THR 84 3HG2 THR 84 10.327 -16.843 -16.981 654 HG22 THR 84 1HG2 THR 84 8.865 -17.829 -16.941 655 HG23 THR 84 2HG2 THR 84 8.749 -16.074 -16.809 656 H PHE 85 H PHE 85 10.172 -12.979 -18.701 657 HA PHE 85 HA PHE 85 7.693 -12.497 -17.193 658 HB2 PHE 85 1HB PHE 85 10.324 -12.084 -16.442 659 HB3 PHE 85 2HB PHE 85 9.786 -10.477 -16.919 660 HD1 PHE 85 HD2 PHE 85 8.435 -13.378 -14.993 661 HD2 PHE 85 HD1 PHE 85 8.971 -9.163 -15.237 662 HE1 PHE 85 HE2 PHE 85 7.316 -13.113 -12.818 663 HE2 PHE 85 HE1 PHE 85 7.853 -8.891 -13.062 664 HZ PHE 85 HZ PHE 85 7.023 -10.867 -11.850 665 H LEU 86 H LEU 86 9.932 -10.960 -19.485 666 HA LEU 86 HA LEU 86 7.723 -9.205 -20.335 667 HB2 LEU 86 1HB LEU 86 9.422 -7.625 -21.091 668 HB3 LEU 86 2HB LEU 86 9.555 -7.955 -19.365 669 HG LEU 86 HG LEU 86 11.406 -9.608 -20.022 670 HD11 LEU 86 1HD1 LEU 86 10.654 -8.606 -22.603 671 HD12 LEU 86 2HD1 LEU 86 11.790 -9.889 -22.187 672 HD13 LEU 86 3HD1 LEU 86 12.341 -8.216 -22.265 673 HD21 LEU 86 3HD2 LEU 86 13.037 -7.950 -19.767 674 HD22 LEU 86 1HD2 LEU 86 11.611 -7.289 -18.967 675 HD23 LEU 86 2HD2 LEU 86 12.055 -6.731 -20.580 676 H ALA 87 H ALA 87 10.039 -11.572 -21.288 677 HA ALA 87 HA ALA 87 9.736 -11.067 -24.125 678 HB1 ALA 87 1HB ALA 87 11.641 -12.194 -24.304 679 HB2 ALA 87 2HB ALA 87 11.665 -12.324 -22.545 680 HB3 ALA 87 3HB ALA 87 10.942 -13.608 -23.514 681 H ALA 88 H ALA 88 7.726 -12.325 -21.927 682 HA ALA 88 HA ALA 88 6.695 -14.402 -23.746 683 HB1 ALA 88 1HB ALA 88 5.988 -14.194 -20.836 684 HB2 ALA 88 2HB ALA 88 5.827 -15.579 -21.917 685 HB3 ALA 88 3HB ALA 88 7.425 -15.055 -21.388 686 H ALA 89 H ALA 89 6.156 -11.307 -22.581 687 HA ALA 89 HA ALA 89 3.422 -11.125 -22.192 688 HB1 ALA 89 1HB ALA 89 3.845 -8.945 -22.036 689 HB2 ALA 89 2HB ALA 89 5.527 -9.338 -22.395 690 HB3 ALA 89 3HB ALA 89 4.434 -8.865 -23.696 691 H ASP 90 H ASP 90 5.042 -10.221 -25.240 692 HA ASP 90 HA ASP 90 2.931 -11.559 -26.748 693 HB2 ASP 90 1HB ASP 90 2.495 -8.991 -26.261 694 HB3 ASP 90 2HB ASP 90 3.620 -8.782 -27.600 695 H HIS 91 H HIS 91 3.446 -11.137 -29.229 696 HA HIS 91 HA HIS 91 6.312 -11.720 -29.555 697 HB2 HIS 91 1HB HIS 91 4.111 -12.455 -31.484 698 HB3 HIS 91 2HB HIS 91 5.760 -13.070 -31.445 699 HD1 HIS 91 HD1 HIS 91 6.337 -14.694 -29.407 700 HD2 HIS 91 HD2 HIS 91 2.306 -13.863 -29.976 701 HE1 HIS 91 HE1 HIS 91 5.097 -16.448 -28.100 702 H ASP 92 H ASP 92 4.939 -9.064 -29.524 703 HA ASP 92 HA ASP 92 4.665 -7.943 -32.041 704 HB2 ASP 92 1HB ASP 92 4.016 -6.648 -30.156 705 HB3 ASP 92 2HB ASP 92 5.621 -6.757 -29.438 706 H GLY 93 H GLY 93 7.597 -8.429 -30.119 707 HA2 GLY 93 1HA GLY 93 9.234 -8.531 -32.453 708 HA3 GLY 93 2HA GLY 93 9.433 -7.004 -31.607 709 H ASP 94 H ASP 94 10.139 -7.075 -29.369 710 HA ASP 94 HA ASP 94 11.722 -9.493 -28.789 711 HB2 ASP 94 1HB ASP 94 12.500 -6.700 -28.957 712 HB3 ASP 94 2HB ASP 94 12.900 -7.389 -27.386 713 H GLY 95 H GLY 95 9.233 -7.470 -27.754 714 HA2 GLY 95 1HA GLY 95 7.929 -8.400 -25.867 715 HA3 GLY 95 2HA GLY 95 9.456 -8.545 -25.009 716 H LYS 96 H LYS 96 8.839 -5.757 -26.978 717 HA LYS 96 HA LYS 96 9.346 -3.936 -24.913 718 HB2 LYS 96 1HB LYS 96 8.245 -3.742 -27.677 719 HB3 LYS 96 2HB LYS 96 8.056 -2.353 -26.615 720 HG2 LYS 96 1HG LYS 96 10.033 -1.856 -27.658 721 HG3 LYS 96 2HG LYS 96 10.612 -2.676 -26.206 722 HD2 LYS 96 1HD LYS 96 11.843 -3.610 -27.984 723 HD3 LYS 96 2HD LYS 96 10.606 -4.808 -27.594 724 HE2 LYS 96 1HE LYS 96 10.534 -4.712 -29.914 725 HE3 LYS 96 2HE LYS 96 9.219 -3.641 -29.430 726 HZ1 LYS 96 3HZ LYS 96 10.205 -1.936 -30.421 727 HZ2 LYS 96 1HZ LYS 96 11.315 -3.023 -31.092 728 HZ3 LYS 96 2HZ LYS 96 11.679 -2.229 -29.644 729 H ILE 97 H ILE 97 8.130 -3.830 -23.130 730 HA ILE 97 HA ILE 97 5.255 -4.180 -23.256 731 HB ILE 97 HB ILE 97 6.905 -3.457 -20.838 732 HG12 ILE 97 1HG1 ILE 97 7.796 -5.506 -21.829 733 HG13 ILE 97 2HG1 ILE 97 6.942 -5.871 -20.334 734 HG21 ILE 97 1HG2 ILE 97 5.021 -4.560 -19.640 735 HG22 ILE 97 2HG2 ILE 97 4.562 -3.092 -20.501 736 HG23 ILE 97 3HG2 ILE 97 4.169 -4.671 -21.180 737 HD11 ILE 97 3HD1 ILE 97 5.627 -7.294 -21.390 738 HD12 ILE 97 1HD1 ILE 97 5.134 -6.052 -22.540 739 HD13 ILE 97 2HD1 ILE 97 6.571 -7.025 -22.855 740 H GLY 98 H GLY 98 3.725 -2.634 -22.563 741 HA2 GLY 98 1HA GLY 98 4.611 0.094 -22.086 742 HA3 GLY 98 2HA GLY 98 3.733 -0.165 -23.587 743 H ALA 99 H ALA 99 3.363 -1.238 -20.203 744 HA ALA 99 HA ALA 99 1.525 -1.361 -18.858 745 HB1 ALA 99 1HB ALA 99 0.304 1.058 -20.026 746 HB2 ALA 99 2HB ALA 99 0.677 0.669 -18.347 747 HB3 ALA 99 3HB ALA 99 1.953 1.229 -19.426 748 H GLU 100 H GLU 100 1.337 -2.706 -21.422 749 HA GLU 100 HA GLU 100 -1.576 -2.908 -21.554 750 HB2 GLU 100 1HB GLU 100 0.228 -2.450 -23.930 751 HB3 GLU 100 2HB GLU 100 -1.409 -3.074 -24.073 752 HG2 GLU 100 1HG GLU 100 -2.358 -1.071 -23.308 753 HG3 GLU 100 2HG GLU 100 -0.815 -0.479 -22.695 754 H GLU 101 H GLU 101 1.386 -4.226 -23.048 755 HA GLU 101 HA GLU 101 0.419 -6.784 -23.551 756 HB2 GLU 101 1HB GLU 101 3.200 -5.761 -23.012 757 HB3 GLU 101 2HB GLU 101 2.888 -7.450 -23.389 758 HG2 GLU 101 1HG GLU 101 1.908 -6.803 -25.523 759 HG3 GLU 101 2HG GLU 101 2.198 -5.106 -25.146 760 H PHE 102 H PHE 102 2.407 -5.730 -20.783 761 HA PHE 102 HA PHE 102 2.381 -8.109 -19.363 762 HB2 PHE 102 1HB PHE 102 3.598 -5.812 -18.928 763 HB3 PHE 102 2HB PHE 102 2.214 -5.515 -17.882 764 HD1 PHE 102 HD1 PHE 102 1.644 -7.793 -16.436 765 HD2 PHE 102 HD2 PHE 102 5.463 -6.520 -17.818 766 HE1 PHE 102 HE1 PHE 102 2.721 -9.087 -14.642 767 HE2 PHE 102 HE2 PHE 102 6.546 -7.812 -16.027 768 HZ PHE 102 HZ PHE 102 5.175 -9.099 -14.436 769 H GLN 103 H GLN 103 0.137 -5.362 -19.080 770 HA GLN 103 HA GLN 103 -1.500 -6.371 -17.082 771 HB2 GLN 103 1HB GLN 103 -1.907 -4.440 -19.322 772 HB3 GLN 103 2HB GLN 103 -3.311 -4.980 -18.412 773 HG2 GLN 103 1HG GLN 103 -2.422 -2.883 -17.547 774 HG3 GLN 103 2HG GLN 103 -2.322 -4.176 -16.353 775 HE21 GLN 103 2HE2 GLN 103 -0.250 -3.381 -19.110 776 HE22 GLN 103 1HE2 GLN 103 1.198 -3.182 -18.189 777 H GLU 104 H GLU 104 -2.005 -6.603 -20.606 778 HA GLU 104 HA GLU 104 -4.288 -8.168 -20.578 779 HB2 GLU 104 1HB GLU 104 -2.071 -7.756 -22.526 780 HB3 GLU 104 2HB GLU 104 -3.183 -9.086 -22.815 781 HG2 GLU 104 1HG GLU 104 -5.029 -7.316 -22.501 782 HG3 GLU 104 2HG GLU 104 -3.734 -6.149 -22.762 783 H MET 105 H MET 105 -0.894 -9.218 -20.603 784 HA MET 105 HA MET 105 -1.205 -11.938 -20.794 785 HB2 MET 105 1HB MET 105 1.002 -11.161 -20.795 786 HB3 MET 105 2HB MET 105 0.781 -10.244 -19.311 787 HG2 MET 105 1HG MET 105 1.176 -12.028 -17.983 788 HG3 MET 105 2HG MET 105 0.461 -13.171 -19.116 789 HE1 MET 105 3HE MET 105 3.799 -11.087 -18.283 790 HE2 MET 105 1HE MET 105 4.621 -11.324 -19.826 791 HE3 MET 105 2HE MET 105 3.094 -10.444 -19.767 792 H VAL 106 H VAL 106 -1.958 -9.868 -18.108 793 HA VAL 106 HA VAL 106 -2.236 -12.059 -16.233 794 HB VAL 106 HB VAL 106 -3.079 -9.180 -15.885 795 HG11 VAL 106 1HG1 VAL 106 -2.331 -11.089 -13.703 796 HG12 VAL 106 2HG1 VAL 106 -3.298 -9.615 -13.614 797 HG13 VAL 106 3HG1 VAL 106 -3.967 -11.068 -14.360 798 HG21 VAL 106 3HG2 VAL 106 -0.819 -8.923 -16.205 799 HG22 VAL 106 1HG2 VAL 106 -0.868 -9.240 -14.471 800 HG23 VAL 106 2HG2 VAL 106 -0.438 -10.532 -15.591 801 H GLN 107 H GLN 107 -4.406 -9.689 -17.770 802 HA GLN 107 HA GLN 107 -6.800 -10.725 -16.744 803 HB2 GLN 107 1HB GLN 107 -6.404 -9.300 -19.380 804 HB3 GLN 107 2HB GLN 107 -7.914 -9.450 -18.491 805 HG2 GLN 107 1HG GLN 107 -5.506 -7.799 -17.846 806 HG3 GLN 107 2HG GLN 107 -7.188 -7.298 -18.015 807 HE21 GLN 107 2HE2 GLN 107 -5.010 -7.246 -15.828 808 HE22 GLN 107 1HE2 GLN 107 -5.865 -7.753 -14.416 809 H SER 108 H SER 108 -4.733 -11.845 -19.257 810 HA SER 108 HA SER 108 -6.775 -13.808 -20.072 811 HB2 SER 108 1HB SER 108 -5.846 -12.130 -21.812 812 HB3 SER 108 2HB SER 108 -4.378 -13.106 -21.750 813 HG SER 108 HG SER 108 -6.970 -14.118 -22.308 Start of MODEL 5 1 H1 SER 1 H SER 1 3.035 0.894 -3.608 2 HA SER 1 HA SER 1 5.200 -0.245 -1.964 3 HB2 SER 1 1HB SER 1 2.312 -0.582 -1.221 4 HB3 SER 1 2HB SER 1 3.743 -0.673 -0.195 5 HG SER 1 HG SER 1 3.648 1.408 0.107 6 H LEU 2 H LEU 2 4.046 -2.576 -1.184 7 HA LEU 2 HA LEU 2 3.521 -3.959 -3.733 8 HB2 LEU 2 1HB LEU 2 5.751 -4.368 -2.574 9 HB3 LEU 2 2HB LEU 2 4.826 -5.203 -1.328 10 HG LEU 2 HG LEU 2 3.959 -6.695 -3.208 11 HD11 LEU 2 1HD1 LEU 2 5.990 -5.072 -4.639 12 HD12 LEU 2 2HD1 LEU 2 4.470 -5.752 -5.216 13 HD13 LEU 2 3HD1 LEU 2 5.882 -6.790 -5.020 14 HD21 LEU 2 3HD2 LEU 2 6.476 -6.697 -1.776 15 HD22 LEU 2 1HD2 LEU 2 6.575 -7.602 -3.287 16 HD23 LEU 2 2HD2 LEU 2 5.352 -8.021 -2.087 17 H THR 3 H THR 3 2.121 -5.779 -3.676 18 HA THR 3 HA THR 3 0.122 -6.751 -3.157 19 HB THR 3 HB THR 3 -0.004 -7.858 -1.079 20 HG1 THR 3 HG1 THR 3 1.961 -6.201 0.095 21 HG21 THR 3 3HG2 THR 3 2.907 -7.684 -0.918 22 HG22 THR 3 1HG2 THR 3 2.312 -7.933 -2.559 23 HG23 THR 3 2HG2 THR 3 1.875 -9.067 -1.280 24 H ASP 4 H ASP 4 -0.032 -3.963 -3.362 25 HA ASP 4 HA ASP 4 -1.483 -2.878 -1.139 26 HB2 ASP 4 1HB ASP 4 -0.091 -1.555 -2.806 27 HB3 ASP 4 2HB ASP 4 -1.414 -1.777 -3.948 28 H ILE 5 H ILE 5 -2.526 -3.253 -4.527 29 HA ILE 5 HA ILE 5 -5.272 -3.145 -3.934 30 HB ILE 5 HB ILE 5 -3.968 -2.928 -6.220 31 HG12 ILE 5 1HG1 ILE 5 -6.270 -3.770 -7.296 32 HG13 ILE 5 2HG1 ILE 5 -6.764 -3.742 -5.607 33 HG21 ILE 5 1HG2 ILE 5 -3.334 -5.393 -6.056 34 HG22 ILE 5 2HG2 ILE 5 -5.008 -5.730 -6.497 35 HG23 ILE 5 3HG2 ILE 5 -3.971 -4.825 -7.599 36 HD11 ILE 5 3HD1 ILE 5 -7.332 -1.665 -6.698 37 HD12 ILE 5 1HD1 ILE 5 -6.098 -1.390 -5.468 38 HD13 ILE 5 2HD1 ILE 5 -5.650 -1.428 -7.174 39 H LEU 6 H LEU 6 -2.988 -5.740 -3.826 40 HA LEU 6 HA LEU 6 -5.172 -7.672 -3.419 41 HB2 LEU 6 1HB LEU 6 -2.800 -7.797 -4.961 42 HB3 LEU 6 2HB LEU 6 -2.632 -8.948 -3.638 43 HG LEU 6 HG LEU 6 -4.915 -9.846 -4.371 44 HD11 LEU 6 1HD1 LEU 6 -4.488 -9.089 -7.117 45 HD12 LEU 6 2HD1 LEU 6 -4.770 -7.672 -6.106 46 HD13 LEU 6 3HD1 LEU 6 -5.949 -8.983 -6.134 47 HD21 LEU 6 3HD2 LEU 6 -3.878 -11.448 -5.641 48 HD22 LEU 6 1HD2 LEU 6 -2.483 -10.720 -4.844 49 HD23 LEU 6 2HD2 LEU 6 -2.880 -10.277 -6.504 50 H SER 7 H SER 7 -3.976 -9.650 -2.065 51 HA SER 7 HA SER 7 -3.291 -8.369 0.491 52 HB2 SER 7 1HB SER 7 -5.283 -10.149 -0.015 53 HB3 SER 7 2HB SER 7 -3.990 -11.241 0.479 54 HG SER 7 HG SER 7 -4.960 -9.011 1.946 55 HA PRO 8 HA PRO 8 0.808 -9.969 0.192 56 HB2 PRO 8 1HB PRO 8 1.496 -9.753 2.810 57 HB3 PRO 8 2HB PRO 8 1.376 -8.359 1.730 58 HG2 PRO 8 1HG PRO 8 -0.604 -9.384 3.728 59 HG3 PRO 8 2HG PRO 8 -0.114 -7.712 3.395 60 HD2 PRO 8 1HD PRO 8 -2.410 -8.777 2.433 61 HD3 PRO 8 2HD PRO 8 -1.485 -7.546 1.550 62 H SER 9 H SER 9 -1.714 -11.422 1.990 63 HA SER 9 HA SER 9 -0.087 -13.715 2.776 64 HB2 SER 9 1HB SER 9 -2.007 -12.544 4.168 65 HB3 SER 9 2HB SER 9 -3.043 -13.610 3.219 66 HG SER 9 HG SER 9 -2.531 -14.879 4.869 67 H ASP 10 H ASP 10 -0.849 -12.989 -0.053 68 HA ASP 10 HA ASP 10 -2.032 -15.592 -0.761 69 HB2 ASP 10 1HB ASP 10 -2.422 -13.055 -2.353 70 HB3 ASP 10 2HB ASP 10 -3.233 -14.602 -2.579 71 H ILE 11 H ILE 11 -0.082 -12.882 -1.997 72 HA ILE 11 HA ILE 11 1.031 -14.254 -4.179 73 HB ILE 11 HB ILE 11 2.250 -11.981 -2.608 74 HG12 ILE 11 1HG1 ILE 11 1.011 -11.403 -5.198 75 HG13 ILE 11 2HG1 ILE 11 -0.134 -11.984 -3.993 76 HG21 ILE 11 1HG2 ILE 11 3.103 -13.466 -4.971 77 HG22 ILE 11 2HG2 ILE 11 3.052 -11.720 -5.212 78 HG23 ILE 11 3HG2 ILE 11 4.022 -12.402 -3.907 79 HD11 ILE 11 3HD1 ILE 11 0.598 -10.221 -2.464 80 HD12 ILE 11 1HD1 ILE 11 1.715 -9.630 -3.694 81 HD13 ILE 11 2HD1 ILE 11 -0.024 -9.570 -3.981 82 H ALA 12 H ALA 12 1.651 -14.490 -0.824 83 HA ALA 12 HA ALA 12 4.353 -15.427 -1.011 84 HB1 ALA 12 1HB ALA 12 4.336 -15.519 1.264 85 HB2 ALA 12 2HB ALA 12 2.993 -14.402 1.017 86 HB3 ALA 12 3HB ALA 12 2.675 -16.106 1.341 87 H ALA 13 H ALA 13 1.203 -16.862 -1.225 88 HA ALA 13 HA ALA 13 1.978 -19.545 -0.672 89 HB1 ALA 13 1HB ALA 13 -0.401 -18.555 -2.239 90 HB2 ALA 13 2HB ALA 13 -0.199 -20.162 -1.538 91 HB3 ALA 13 3HB ALA 13 -0.345 -18.753 -0.487 92 H ALA 14 H ALA 14 2.428 -17.499 -3.350 93 HA ALA 14 HA ALA 14 2.702 -19.713 -5.239 94 HB1 ALA 14 1HB ALA 14 1.562 -17.478 -5.779 95 HB2 ALA 14 2HB ALA 14 3.198 -16.827 -5.883 96 HB3 ALA 14 3HB ALA 14 2.699 -18.135 -6.956 97 H LEU 15 H LEU 15 4.623 -17.282 -3.570 98 HA LEU 15 HA LEU 15 7.042 -17.589 -4.917 99 HB2 LEU 15 1HB LEU 15 6.455 -16.916 -2.044 100 HB3 LEU 15 2HB LEU 15 8.074 -16.859 -2.737 101 HG LEU 15 HG LEU 15 5.714 -15.153 -3.527 102 HD11 LEU 15 1HD1 LEU 15 6.441 -14.071 -1.682 103 HD12 LEU 15 2HD1 LEU 15 7.641 -13.441 -2.810 104 HD13 LEU 15 3HD1 LEU 15 8.049 -14.792 -1.754 105 HD21 LEU 15 3HD2 LEU 15 7.042 -15.679 -5.484 106 HD22 LEU 15 1HD2 LEU 15 8.520 -15.236 -4.630 107 HD23 LEU 15 2HD2 LEU 15 7.315 -14.004 -5.002 108 H ARG 16 H ARG 16 5.484 -19.629 -2.574 109 HA ARG 16 HA ARG 16 7.878 -21.238 -2.173 110 HB2 ARG 16 1HB ARG 16 6.199 -20.673 -0.334 111 HB3 ARG 16 2HB ARG 16 5.117 -21.818 -1.114 112 HG2 ARG 16 1HG ARG 16 7.848 -22.766 -0.493 113 HG3 ARG 16 2HG ARG 16 6.757 -22.496 0.867 114 HD2 ARG 16 1HD ARG 16 5.713 -23.996 -1.473 115 HD3 ARG 16 2HD ARG 16 6.869 -24.815 -0.423 116 HE ARG 16 HE ARG 16 5.008 -23.750 1.276 117 HH11 ARG 16 1HH1 ARG 16 4.931 -25.915 -1.449 118 HH12 ARG 16 2HH1 ARG 16 3.549 -26.791 -0.879 119 HH21 ARG 16 1HH2 ARG 16 3.188 -24.896 2.037 120 HH22 ARG 16 2HH2 ARG 16 2.558 -26.210 1.103 121 H ASP 17 H ASP 17 5.066 -21.175 -4.137 122 HA ASP 17 HA ASP 17 5.329 -24.002 -4.846 123 HB2 ASP 17 1HB ASP 17 3.084 -22.701 -4.416 124 HB3 ASP 17 2HB ASP 17 3.301 -22.181 -6.085 125 H CYS 18 H CYS 18 7.186 -21.703 -5.598 126 HA CYS 18 HA CYS 18 7.445 -22.478 -8.393 127 HB2 CYS 18 1HB CYS 18 7.518 -20.264 -9.258 128 HB3 CYS 18 2HB CYS 18 6.062 -20.357 -8.274 129 HG CYS 18 HG CYS 18 8.748 -18.412 -7.922 130 H GLN 19 H GLN 19 8.867 -22.734 -5.725 131 HA GLN 19 HA GLN 19 11.257 -21.246 -5.811 132 HB2 GLN 19 1HB GLN 19 12.137 -22.974 -4.264 133 HB3 GLN 19 2HB GLN 19 10.568 -22.349 -3.774 134 HG2 GLN 19 1HG GLN 19 9.610 -24.390 -5.012 135 HG3 GLN 19 2HG GLN 19 11.253 -25.022 -4.923 136 HE21 GLN 19 2HE2 GLN 19 9.173 -23.217 -2.683 137 HE22 GLN 19 1HE2 GLN 19 9.334 -24.327 -1.370 138 H ALA 20 H ALA 20 10.182 -23.991 -7.585 139 HA ALA 20 HA ALA 20 12.727 -25.052 -8.285 140 HB1 ALA 20 1HB ALA 20 11.565 -26.630 -9.381 141 HB2 ALA 20 2HB ALA 20 10.176 -25.933 -8.547 142 HB3 ALA 20 3HB ALA 20 10.542 -25.452 -10.204 143 HA PRO 21 HA PRO 21 14.095 -22.411 -11.511 144 HB2 PRO 21 1HB PRO 21 15.133 -24.171 -13.299 145 HB3 PRO 21 2HB PRO 21 15.906 -23.805 -11.752 146 HG2 PRO 21 1HG PRO 21 14.179 -26.132 -12.503 147 HG3 PRO 21 2HG PRO 21 15.678 -26.111 -11.556 148 HD2 PRO 21 1HD PRO 21 13.231 -26.262 -10.407 149 HD3 PRO 21 2HD PRO 21 14.601 -25.441 -9.632 150 H ASP 22 H ASP 22 13.124 -21.356 -13.127 151 HA ASP 22 HA ASP 22 11.672 -20.839 -14.801 152 HB2 ASP 22 1HB ASP 22 13.220 -22.466 -15.976 153 HB3 ASP 22 2HB ASP 22 12.000 -23.705 -15.694 154 H SER 23 H SER 23 10.698 -22.128 -12.269 155 HA SER 23 HA SER 23 8.224 -23.387 -13.198 156 HB2 SER 23 1HB SER 23 9.205 -24.648 -11.454 157 HB3 SER 23 2HB SER 23 9.565 -23.207 -10.503 158 HG SER 23 HG SER 23 7.315 -24.717 -10.557 159 H PHE 24 H PHE 24 9.423 -20.396 -12.122 160 HA PHE 24 HA PHE 24 6.806 -19.460 -11.218 161 HB2 PHE 24 1HB PHE 24 8.795 -18.864 -9.881 162 HB3 PHE 24 2HB PHE 24 9.468 -18.022 -11.273 163 HD1 PHE 24 HD1 PHE 24 6.002 -18.044 -9.921 164 HD2 PHE 24 HD2 PHE 24 9.525 -15.785 -10.699 165 HE1 PHE 24 HE1 PHE 24 4.833 -15.990 -9.236 166 HE2 PHE 24 HE2 PHE 24 8.361 -13.728 -10.014 167 HZ PHE 24 HZ PHE 24 6.013 -13.829 -9.280 168 H SER 25 H SER 25 5.660 -17.831 -12.226 169 HA SER 25 HA SER 25 6.662 -16.486 -14.556 170 HB2 SER 25 1HB SER 25 4.720 -18.765 -14.822 171 HB3 SER 25 2HB SER 25 4.690 -17.425 -15.968 172 HG SER 25 HG SER 25 6.137 -19.440 -16.277 173 HA PRO 26 HA PRO 26 3.626 -13.529 -13.423 174 HB2 PRO 26 1HB PRO 26 2.992 -12.429 -15.823 175 HB3 PRO 26 2HB PRO 26 4.537 -12.143 -15.013 176 HG2 PRO 26 1HG PRO 26 3.886 -14.043 -17.232 177 HG3 PRO 26 2HG PRO 26 5.295 -12.982 -17.045 178 HD2 PRO 26 1HD PRO 26 5.378 -15.628 -16.477 179 HD3 PRO 26 2HD PRO 26 6.352 -14.432 -15.598 180 H LYS 27 H LYS 27 2.744 -15.611 -16.152 181 HA LYS 27 HA LYS 27 -0.094 -15.205 -15.613 182 HB2 LYS 27 1HB LYS 27 -0.471 -16.493 -17.652 183 HB3 LYS 27 2HB LYS 27 0.673 -15.189 -17.947 184 HG2 LYS 27 1HG LYS 27 2.464 -16.633 -18.169 185 HG3 LYS 27 2HG LYS 27 1.661 -17.929 -17.279 186 HD2 LYS 27 1HD LYS 27 0.631 -16.944 -19.925 187 HD3 LYS 27 2HD LYS 27 1.877 -18.189 -19.816 188 HE2 LYS 27 1HE LYS 27 0.342 -19.518 -18.385 189 HE3 LYS 27 2HE LYS 27 -0.905 -18.303 -18.656 190 HZ1 LYS 27 3HZ LYS 27 0.409 -19.905 -20.784 191 HZ2 LYS 27 1HZ LYS 27 -0.831 -18.776 -21.010 192 HZ3 LYS 27 2HZ LYS 27 -1.131 -20.202 -20.151 193 H LYS 28 H LYS 28 1.421 -16.519 -13.595 194 HA LYS 28 HA LYS 28 0.047 -19.114 -13.592 195 HB2 LYS 28 1HB LYS 28 2.946 -18.583 -13.275 196 HB3 LYS 28 2HB LYS 28 2.240 -19.744 -12.159 197 HG2 LYS 28 1HG LYS 28 1.786 -19.977 -15.108 198 HG3 LYS 28 2HG LYS 28 3.256 -20.601 -14.356 199 HD2 LYS 28 1HD LYS 28 2.128 -22.233 -13.190 200 HD3 LYS 28 2HD LYS 28 0.613 -21.328 -13.182 201 HE2 LYS 28 1HE LYS 28 0.310 -23.165 -14.653 202 HE3 LYS 28 2HE LYS 28 0.482 -21.728 -15.660 203 HZ1 LYS 28 3HZ LYS 28 2.690 -22.321 -16.202 204 HZ2 LYS 28 1HZ LYS 28 1.762 -23.721 -16.409 205 HZ3 LYS 28 2HZ LYS 28 2.737 -23.548 -15.038 206 H PHE 29 H PHE 29 1.607 -16.553 -11.731 207 HA PHE 29 HA PHE 29 0.447 -17.492 -9.246 208 HB2 PHE 29 1HB PHE 29 1.795 -15.940 -8.168 209 HB3 PHE 29 2HB PHE 29 2.752 -16.310 -9.599 210 HD1 PHE 29 HD2 PHE 29 2.599 -14.730 -11.577 211 HD2 PHE 29 HD1 PHE 29 1.131 -13.756 -7.703 212 HE1 PHE 29 HE2 PHE 29 2.645 -12.341 -12.164 213 HE2 PHE 29 HE1 PHE 29 1.172 -11.366 -8.284 214 HZ PHE 29 HZ PHE 29 1.931 -10.655 -10.517 215 H PHE 30 H PHE 30 -0.391 -15.389 -11.801 216 HA PHE 30 HA PHE 30 -1.882 -13.404 -10.608 217 HB2 PHE 30 1HB PHE 30 -3.026 -13.154 -12.675 218 HB3 PHE 30 2HB PHE 30 -1.413 -13.731 -13.082 219 HD1 PHE 30 HD1 PHE 30 -1.176 -16.313 -13.351 220 HD2 PHE 30 HD2 PHE 30 -4.863 -14.201 -13.586 221 HE1 PHE 30 HE1 PHE 30 -2.161 -18.181 -14.614 222 HE2 PHE 30 HE2 PHE 30 -5.855 -16.065 -14.848 223 HZ PHE 30 HZ PHE 30 -4.504 -18.059 -15.363 224 H GLN 31 H GLN 31 -2.651 -16.786 -11.002 225 HA GLN 31 HA GLN 31 -5.394 -16.408 -10.115 226 HB2 GLN 31 1HB GLN 31 -5.751 -18.673 -10.643 227 HB3 GLN 31 2HB GLN 31 -4.659 -18.090 -11.891 228 HG2 GLN 31 1HG GLN 31 -2.820 -18.990 -10.249 229 HG3 GLN 31 2HG GLN 31 -4.152 -19.982 -9.658 230 HE21 GLN 31 2HE2 GLN 31 -1.599 -20.127 -11.560 231 HE22 GLN 31 1HE2 GLN 31 -2.149 -21.217 -12.782 232 H ILE 32 H ILE 32 -2.317 -17.506 -8.877 233 HA ILE 32 HA ILE 32 -3.310 -18.723 -6.509 234 HB ILE 32 HB ILE 32 -0.576 -17.596 -7.121 235 HG12 ILE 32 1HG1 ILE 32 -1.217 -20.509 -6.913 236 HG13 ILE 32 2HG1 ILE 32 -1.660 -19.649 -8.384 237 HG21 ILE 32 1HG2 ILE 32 -0.447 -17.674 -4.851 238 HG22 ILE 32 2HG2 ILE 32 -1.699 -18.907 -4.710 239 HG23 ILE 32 3HG2 ILE 32 -0.068 -19.360 -5.203 240 HD11 ILE 32 3HD1 ILE 32 1.091 -19.217 -7.451 241 HD12 ILE 32 1HD1 ILE 32 0.710 -20.853 -7.989 242 HD13 ILE 32 2HD1 ILE 32 0.466 -19.486 -9.078 243 H SER 33 H SER 33 -1.522 -15.658 -6.910 244 HA SER 33 HA SER 33 -2.004 -14.694 -4.332 245 HB2 SER 33 1HB SER 33 -1.507 -12.426 -5.374 246 HB3 SER 33 2HB SER 33 -0.273 -13.665 -5.603 247 HG SER 33 HG SER 33 -0.913 -13.920 -7.692 248 H GLY 34 H GLY 34 -3.757 -14.084 -7.364 249 HA2 GLY 34 1HA GLY 34 -6.239 -14.082 -7.098 250 HA3 GLY 34 2HA GLY 34 -5.975 -13.004 -5.735 251 H MET 35 H MET 35 -4.067 -12.719 -8.632 252 HA MET 35 HA MET 35 -4.947 -10.009 -8.996 253 HB2 MET 35 1HB MET 35 -3.004 -11.769 -10.483 254 HB3 MET 35 2HB MET 35 -3.382 -10.133 -11.005 255 HG2 MET 35 1HG MET 35 -2.779 -9.657 -8.437 256 HG3 MET 35 2HG MET 35 -1.773 -11.075 -8.725 257 HE1 MET 35 3HE MET 35 -1.301 -9.941 -12.270 258 HE2 MET 35 1HE MET 35 0.370 -10.067 -11.718 259 HE3 MET 35 2HE MET 35 -0.821 -11.260 -11.201 260 H SER 36 H SER 36 -5.901 -13.061 -10.185 261 HA SER 36 HA SER 36 -6.778 -12.521 -12.757 262 HB2 SER 36 1HB SER 36 -8.264 -14.406 -12.516 263 HB3 SER 36 2HB SER 36 -6.780 -14.765 -11.633 264 HG SER 36 HG SER 36 -8.004 -15.043 -9.962 265 H LYS 37 H LYS 37 -8.203 -11.662 -9.681 266 HA LYS 37 HA LYS 37 -10.771 -10.954 -10.599 267 HB2 LYS 37 1HB LYS 37 -9.210 -9.873 -8.246 268 HB3 LYS 37 2HB LYS 37 -10.936 -9.652 -8.506 269 HG2 LYS 37 1HG LYS 37 -10.960 -12.264 -8.581 270 HG3 LYS 37 2HG LYS 37 -9.436 -12.097 -7.705 271 HD2 LYS 37 1HD LYS 37 -11.936 -10.672 -6.838 272 HD3 LYS 37 2HD LYS 37 -11.572 -12.320 -6.320 273 HE2 LYS 37 1HE LYS 37 -9.651 -11.648 -5.157 274 HE3 LYS 37 2HE LYS 37 -9.590 -10.092 -5.984 275 HZ1 LYS 37 3HZ LYS 37 -10.407 -10.041 -3.631 276 HZ2 LYS 37 1HZ LYS 37 -11.794 -10.856 -4.157 277 HZ3 LYS 37 2HZ LYS 37 -11.436 -9.318 -4.762 278 H LYS 38 H LYS 38 -7.709 -9.321 -10.700 279 HA LYS 38 HA LYS 38 -8.509 -6.672 -10.989 280 HB2 LYS 38 1HB LYS 38 -6.196 -8.056 -12.362 281 HB3 LYS 38 2HB LYS 38 -6.375 -6.319 -12.146 282 HG2 LYS 38 1HG LYS 38 -5.948 -8.394 -10.011 283 HG3 LYS 38 2HG LYS 38 -4.841 -7.113 -10.510 284 HD2 LYS 38 1HD LYS 38 -5.715 -6.028 -8.735 285 HD3 LYS 38 2HD LYS 38 -7.016 -5.649 -9.866 286 HE2 LYS 38 1HE LYS 38 -8.478 -7.064 -8.865 287 HE3 LYS 38 2HE LYS 38 -7.225 -8.225 -8.433 288 HZ1 LYS 38 3HZ LYS 38 -6.988 -5.728 -7.036 289 HZ2 LYS 38 1HZ LYS 38 -6.979 -7.308 -6.432 290 HZ3 LYS 38 2HZ LYS 38 -8.448 -6.522 -6.720 291 H SER 39 H SER 39 -7.869 -5.563 -13.283 292 HA SER 39 HA SER 39 -8.829 -6.908 -15.603 293 HB2 SER 39 1HB SER 39 -10.911 -6.241 -14.103 294 HB3 SER 39 2HB SER 39 -10.644 -4.661 -14.838 295 HG SER 39 HG SER 39 -11.480 -5.398 -16.609 296 H SER 40 H SER 40 -6.493 -5.652 -15.259 297 HA SER 40 HA SER 40 -5.098 -4.061 -16.096 298 HB2 SER 40 1HB SER 40 -7.397 -3.870 -18.042 299 HB3 SER 40 2HB SER 40 -5.914 -2.937 -18.238 300 HG SER 40 HG SER 40 -4.988 -5.255 -17.882 301 H SER 41 H SER 41 -7.187 -3.339 -14.063 302 HA SER 41 HA SER 41 -7.139 -0.423 -14.492 303 HB2 SER 41 1HB SER 41 -9.430 -1.658 -14.484 304 HB3 SER 41 2HB SER 41 -9.183 -1.763 -12.741 305 HG SER 41 HG SER 41 -9.325 0.581 -14.330 306 H GLN 42 H GLN 42 -5.929 -2.934 -12.699 307 HA GLN 42 HA GLN 42 -5.194 -1.109 -10.518 308 HB2 GLN 42 1HB GLN 42 -5.925 -4.017 -10.139 309 HB3 GLN 42 2HB GLN 42 -5.438 -2.889 -8.881 310 HG2 GLN 42 1HG GLN 42 -7.598 -2.522 -8.552 311 HG3 GLN 42 2HG GLN 42 -7.577 -1.629 -10.072 312 HE21 GLN 42 2HE2 GLN 42 -7.210 -3.802 -11.808 313 HE22 GLN 42 1HE2 GLN 42 -8.656 -4.748 -11.805 314 H LEU 43 H LEU 43 -4.248 -3.227 -12.927 315 HA LEU 43 HA LEU 43 -1.972 -4.451 -11.827 316 HB2 LEU 43 1HB LEU 43 -2.194 -3.571 -14.688 317 HB3 LEU 43 2HB LEU 43 -1.334 -4.963 -14.034 318 HG LEU 43 HG LEU 43 -4.313 -4.631 -14.348 319 HD11 LEU 43 1HD1 LEU 43 -3.596 -5.337 -16.397 320 HD12 LEU 43 2HD1 LEU 43 -3.774 -6.894 -15.588 321 HD13 LEU 43 3HD1 LEU 43 -2.179 -6.159 -15.744 322 HD21 LEU 43 3HD2 LEU 43 -4.633 -6.097 -12.716 323 HD22 LEU 43 1HD2 LEU 43 -2.900 -6.123 -12.388 324 HD23 LEU 43 2HD2 LEU 43 -3.594 -7.256 -13.547 325 H LYS 44 H LYS 44 -2.497 -1.267 -13.194 326 HA LYS 44 HA LYS 44 0.347 -0.626 -12.904 327 HB2 LYS 44 1HB LYS 44 -0.150 1.395 -14.168 328 HB3 LYS 44 2HB LYS 44 -0.743 -0.021 -15.026 329 HG2 LYS 44 1HG LYS 44 -2.678 1.289 -13.236 330 HG3 LYS 44 2HG LYS 44 -2.177 2.221 -14.649 331 HD2 LYS 44 1HD LYS 44 -2.614 -0.165 -15.807 332 HD3 LYS 44 2HD LYS 44 -3.767 -0.265 -14.474 333 HE2 LYS 44 1HE LYS 44 -5.061 0.730 -16.087 334 HE3 LYS 44 2HE LYS 44 -4.416 2.148 -15.262 335 HZ1 LYS 44 3HZ LYS 44 -3.520 0.988 -17.837 336 HZ2 LYS 44 1HZ LYS 44 -2.620 2.145 -16.992 337 HZ3 LYS 44 2HZ LYS 44 -4.167 2.527 -17.560 338 H GLU 45 H GLU 45 -2.314 -0.621 -11.014 339 HA GLU 45 HA GLU 45 -2.168 1.967 -9.820 340 HB2 GLU 45 1HB GLU 45 -3.613 -0.565 -9.297 341 HB3 GLU 45 2HB GLU 45 -3.365 0.485 -7.909 342 HG2 GLU 45 1HG GLU 45 -4.595 1.409 -10.490 343 HG3 GLU 45 2HG GLU 45 -5.526 0.803 -9.122 344 H ILE 46 H ILE 46 -0.931 -1.236 -8.935 345 HA ILE 46 HA ILE 46 0.410 -0.194 -6.594 346 HB ILE 46 HB ILE 46 0.799 -2.933 -7.781 347 HG12 ILE 46 1HG1 ILE 46 -1.029 -3.264 -5.761 348 HG13 ILE 46 2HG1 ILE 46 -1.576 -1.766 -6.505 349 HG21 ILE 46 1HG2 ILE 46 0.718 -2.703 -4.901 350 HG22 ILE 46 2HG2 ILE 46 1.974 -3.369 -5.944 351 HG23 ILE 46 3HG2 ILE 46 1.937 -1.639 -5.604 352 HD11 ILE 46 3HD1 ILE 46 -1.727 -4.506 -7.473 353 HD12 ILE 46 1HD1 ILE 46 -2.689 -3.091 -7.902 354 HD13 ILE 46 2HD1 ILE 46 -1.127 -3.363 -8.674 355 H PHE 47 H PHE 47 1.117 -0.632 -9.909 356 HA PHE 47 HA PHE 47 3.082 -0.672 -11.112 357 HB2 PHE 47 1HB PHE 47 4.505 1.346 -10.548 358 HB3 PHE 47 2HB PHE 47 2.803 1.678 -10.849 359 HD1 PHE 47 HD2 PHE 47 5.450 1.572 -8.337 360 HD2 PHE 47 HD1 PHE 47 1.334 2.376 -9.060 361 HE1 PHE 47 HE2 PHE 47 5.292 2.704 -6.158 362 HE2 PHE 47 HE1 PHE 47 1.169 3.510 -6.883 363 HZ PHE 47 HZ PHE 47 3.149 3.674 -5.428 364 H ARG 48 H ARG 48 3.204 -2.645 -9.171 365 HA ARG 48 HA ARG 48 6.080 -2.685 -8.638 366 HB2 ARG 48 1HB ARG 48 3.926 -2.754 -6.614 367 HB3 ARG 48 2HB ARG 48 5.199 -3.950 -6.414 368 HG2 ARG 48 1HG ARG 48 6.647 -1.696 -6.874 369 HG3 ARG 48 2HG ARG 48 5.252 -1.055 -6.004 370 HD2 ARG 48 1HD ARG 48 5.654 -2.926 -4.320 371 HD3 ARG 48 2HD ARG 48 7.215 -3.147 -5.109 372 HE ARG 48 HE ARG 48 6.441 -0.997 -3.357 373 HH11 ARG 48 1HH1 ARG 48 8.623 -2.017 -5.871 374 HH12 ARG 48 2HH1 ARG 48 9.852 -0.871 -5.449 375 HH21 ARG 48 1HH2 ARG 48 8.051 0.517 -2.792 376 HH22 ARG 48 2HH2 ARG 48 9.526 0.569 -3.697 377 H ILE 49 H ILE 49 3.789 -4.029 -10.302 378 HA ILE 49 HA ILE 49 4.723 -6.785 -9.828 379 HB ILE 49 HB ILE 49 2.590 -7.641 -10.559 380 HG12 ILE 49 1HG1 ILE 49 1.731 -4.754 -10.846 381 HG13 ILE 49 2HG1 ILE 49 2.065 -5.851 -12.181 382 HG21 ILE 49 1HG2 ILE 49 2.060 -5.476 -8.534 383 HG22 ILE 49 2HG2 ILE 49 1.238 -7.027 -8.693 384 HG23 ILE 49 3HG2 ILE 49 2.922 -6.971 -8.171 385 HD11 ILE 49 3HD1 ILE 49 0.209 -7.248 -11.547 386 HD12 ILE 49 1HD1 ILE 49 -0.090 -6.254 -10.121 387 HD13 ILE 49 2HD1 ILE 49 -0.333 -5.580 -11.733 388 H LEU 50 H LEU 50 4.047 -4.258 -12.112 389 HA LEU 50 HA LEU 50 4.605 -5.977 -14.396 390 HB2 LEU 50 1HB LEU 50 4.199 -3.011 -14.513 391 HB3 LEU 50 2HB LEU 50 3.891 -4.218 -15.759 392 HG LEU 50 HG LEU 50 2.275 -4.173 -13.235 393 HD11 LEU 50 1HD1 LEU 50 2.140 -1.919 -14.110 394 HD12 LEU 50 2HD1 LEU 50 0.627 -2.776 -14.403 395 HD13 LEU 50 3HD1 LEU 50 1.776 -2.541 -15.720 396 HD21 LEU 50 3HD2 LEU 50 0.627 -5.266 -14.617 397 HD22 LEU 50 1HD2 LEU 50 2.163 -6.121 -14.752 398 HD23 LEU 50 2HD2 LEU 50 1.634 -5.049 -16.049 399 H ASP 51 H ASP 51 5.792 -2.754 -13.433 400 HA ASP 51 HA ASP 51 8.537 -3.654 -13.850 401 HB2 ASP 51 1HB ASP 51 9.056 -1.724 -15.294 402 HB3 ASP 51 2HB ASP 51 7.869 -2.794 -16.036 403 H ASN 52 H ASN 52 10.065 -1.691 -13.364 404 HA ASN 52 HA ASN 52 8.965 -0.112 -11.144 405 HB2 ASN 52 1HB ASN 52 10.716 -2.291 -10.845 406 HB3 ASN 52 2HB ASN 52 11.707 -0.852 -10.626 407 HD21 ASN 52 2HD2 ASN 52 10.737 -2.938 -8.744 408 HD22 ASN 52 1HD2 ASN 52 9.965 -2.064 -7.469 409 H ASP 53 H ASP 53 9.634 0.531 -13.934 410 HA ASP 53 HA ASP 53 11.598 2.654 -13.389 411 HB2 ASP 53 1HB ASP 53 12.389 2.422 -15.742 412 HB3 ASP 53 2HB ASP 53 12.735 1.011 -14.746 413 H GLN 54 H GLN 54 8.978 1.571 -15.529 414 HA GLN 54 HA GLN 54 7.405 2.716 -16.716 415 HB2 GLN 54 1HB GLN 54 7.630 4.734 -14.481 416 HB3 GLN 54 2HB GLN 54 6.240 4.453 -15.522 417 HG2 GLN 54 1HG GLN 54 7.357 2.453 -13.570 418 HG3 GLN 54 2HG GLN 54 5.981 3.511 -13.260 419 HE21 GLN 54 2HE2 GLN 54 5.218 1.157 -12.886 420 HE22 GLN 54 1HE2 GLN 54 4.419 0.425 -14.231 421 H SER 55 H SER 55 10.209 3.299 -17.301 422 HA SER 55 HA SER 55 10.239 6.128 -17.974 423 HB2 SER 55 1HB SER 55 12.250 4.674 -17.139 424 HB3 SER 55 2HB SER 55 12.361 4.187 -18.831 425 HG SER 55 HG SER 55 13.448 6.269 -17.850 426 H GLY 56 H GLY 56 10.711 3.073 -19.765 427 HA2 GLY 56 1HA GLY 56 9.173 4.187 -21.987 428 HA3 GLY 56 2HA GLY 56 10.842 3.742 -22.315 429 H PHE 57 H PHE 57 10.998 1.428 -20.724 430 HA PHE 57 HA PHE 57 8.873 -0.372 -21.370 431 HB2 PHE 57 1HB PHE 57 10.344 -1.841 -22.835 432 HB3 PHE 57 2HB PHE 57 9.742 -0.362 -23.578 433 HD1 PHE 57 HD1 PHE 57 11.247 1.525 -23.984 434 HD2 PHE 57 HD2 PHE 57 12.672 -2.172 -22.429 435 HE1 PHE 57 HE1 PHE 57 13.550 2.176 -24.556 436 HE2 PHE 57 HE2 PHE 57 14.977 -1.527 -22.998 437 HZ PHE 57 HZ PHE 57 15.419 0.650 -24.062 438 H ILE 58 H ILE 58 9.526 -2.682 -20.846 439 HA ILE 58 HA ILE 58 11.063 -2.626 -18.376 440 HB ILE 58 HB ILE 58 9.697 -5.066 -19.459 441 HG12 ILE 58 1HG1 ILE 58 8.380 -2.786 -17.967 442 HG13 ILE 58 2HG1 ILE 58 8.060 -3.252 -19.634 443 HG21 ILE 58 1HG2 ILE 58 10.386 -4.031 -16.721 444 HG22 ILE 58 2HG2 ILE 58 9.314 -5.406 -16.986 445 HG23 ILE 58 3HG2 ILE 58 10.992 -5.479 -17.524 446 HD11 ILE 58 3HD1 ILE 58 7.607 -5.583 -18.293 447 HD12 ILE 58 1HD1 ILE 58 7.043 -4.370 -17.144 448 HD13 ILE 58 2HD1 ILE 58 6.371 -4.420 -18.774 449 H GLU 59 H GLU 59 12.565 -4.417 -17.891 450 HA GLU 59 HA GLU 59 13.794 -5.745 -20.155 451 HB2 GLU 59 1HB GLU 59 14.785 -3.332 -19.744 452 HB3 GLU 59 2HB GLU 59 15.657 -4.147 -18.453 453 HG2 GLU 59 1HG GLU 59 16.811 -5.524 -19.938 454 HG3 GLU 59 2HG GLU 59 15.683 -5.204 -21.253 455 H GLU 60 H GLU 60 15.719 -7.092 -19.377 456 HA GLU 60 HA GLU 60 14.859 -8.826 -17.357 457 HB2 GLU 60 1HB GLU 60 17.603 -8.452 -18.566 458 HB3 GLU 60 2HB GLU 60 17.171 -9.782 -17.501 459 HG2 GLU 60 1HG GLU 60 15.823 -10.785 -19.072 460 HG3 GLU 60 2HG GLU 60 15.559 -9.284 -19.958 461 H ASP 61 H ASP 61 16.657 -5.893 -17.202 462 HA ASP 61 HA ASP 61 17.951 -6.338 -14.709 463 HB2 ASP 61 1HB ASP 61 18.484 -4.561 -16.498 464 HB3 ASP 61 2HB ASP 61 17.181 -3.627 -15.768 465 H GLU 62 H GLU 62 14.725 -5.894 -15.506 466 HA GLU 62 HA GLU 62 14.100 -4.952 -12.784 467 HB2 GLU 62 1HB GLU 62 12.820 -4.387 -15.425 468 HB3 GLU 62 2HB GLU 62 11.813 -4.405 -13.983 469 HG2 GLU 62 1HG GLU 62 14.278 -2.712 -14.310 470 HG3 GLU 62 2HG GLU 62 12.635 -2.157 -14.622 471 H LEU 63 H LEU 63 14.590 -7.702 -13.734 472 HA LEU 63 HA LEU 63 11.981 -8.852 -12.998 473 HB2 LEU 63 1HB LEU 63 13.963 -10.213 -14.800 474 HB3 LEU 63 2HB LEU 63 12.287 -10.661 -14.489 475 HG LEU 63 HG LEU 63 13.229 -8.260 -16.056 476 HD11 LEU 63 1HD1 LEU 63 11.540 -10.283 -17.328 477 HD12 LEU 63 2HD1 LEU 63 13.147 -10.853 -16.879 478 HD13 LEU 63 3HD1 LEU 63 12.973 -9.450 -17.933 479 HD21 LEU 63 3HD2 LEU 63 11.169 -7.421 -15.954 480 HD22 LEU 63 1HD2 LEU 63 10.863 -8.557 -14.640 481 HD23 LEU 63 2HD2 LEU 63 10.436 -8.989 -16.296 482 H LYS 64 H LYS 64 15.491 -9.367 -13.061 483 HA LYS 64 HA LYS 64 15.571 -11.598 -11.371 484 HB2 LYS 64 1HB LYS 64 17.941 -10.815 -10.897 485 HB3 LYS 64 2HB LYS 64 17.534 -11.083 -12.587 486 HG2 LYS 64 1HG LYS 64 17.573 -8.840 -13.095 487 HG3 LYS 64 2HG LYS 64 17.258 -8.349 -11.428 488 HD2 LYS 64 1HD LYS 64 19.462 -8.671 -10.783 489 HD3 LYS 64 2HD LYS 64 19.799 -9.770 -12.122 490 HE2 LYS 64 1HE LYS 64 19.014 -7.182 -13.107 491 HE3 LYS 64 2HE LYS 64 20.358 -7.029 -11.977 492 HZ1 LYS 64 3HZ LYS 64 21.263 -9.030 -13.396 493 HZ2 LYS 64 1HZ LYS 64 21.492 -7.427 -13.888 494 HZ3 LYS 64 2HZ LYS 64 20.260 -8.357 -14.581 495 H TYR 65 H TYR 65 14.637 -8.450 -10.683 496 HA TYR 65 HA TYR 65 15.203 -8.806 -7.813 497 HB2 TYR 65 1HB TYR 65 14.936 -6.331 -9.503 498 HB3 TYR 65 2HB TYR 65 14.734 -6.268 -7.755 499 HD1 TYR 65 HD1 TYR 65 16.638 -6.766 -6.268 500 HD2 TYR 65 HD2 TYR 65 17.102 -6.604 -10.495 501 HE1 TYR 65 HE1 TYR 65 19.076 -6.593 -5.988 502 HE2 TYR 65 HE2 TYR 65 19.541 -6.432 -10.226 503 HH TYR 65 HH TYR 65 21.111 -5.533 -8.215 504 H PHE 66 H PHE 66 12.986 -10.000 -9.245 505 HA PHE 66 HA PHE 66 10.631 -8.467 -8.605 506 HB2 PHE 66 1HB PHE 66 10.850 -10.098 -10.546 507 HB3 PHE 66 2HB PHE 66 10.736 -11.388 -9.355 508 HD1 PHE 66 HD1 PHE 66 8.940 -8.644 -10.997 509 HD2 PHE 66 HD2 PHE 66 8.657 -11.922 -8.297 510 HE1 PHE 66 HE1 PHE 66 6.485 -8.516 -11.104 511 HE2 PHE 66 HE2 PHE 66 6.202 -11.801 -8.401 512 HZ PHE 66 HZ PHE 66 5.113 -10.097 -9.806 513 H LEU 67 H LEU 67 11.577 -11.763 -7.625 514 HA LEU 67 HA LEU 67 9.872 -11.947 -5.441 515 HB2 LEU 67 1HB LEU 67 12.580 -13.245 -5.552 516 HB3 LEU 67 2HB LEU 67 11.120 -13.837 -4.761 517 HG LEU 67 HG LEU 67 11.623 -13.695 -7.733 518 HD11 LEU 67 1HD1 LEU 67 12.817 -15.486 -6.503 519 HD12 LEU 67 2HD1 LEU 67 11.627 -16.095 -7.653 520 HD13 LEU 67 3HD1 LEU 67 11.259 -16.081 -5.928 521 HD21 LEU 67 3HD2 LEU 67 9.423 -13.744 -8.012 522 HD22 LEU 67 1HD2 LEU 67 9.171 -13.723 -6.266 523 HD23 LEU 67 2HD2 LEU 67 9.361 -15.260 -7.111 524 H GLN 68 H GLN 68 12.887 -10.288 -5.768 525 HA GLN 68 HA GLN 68 13.830 -10.152 -3.185 526 HB2 GLN 68 1HB GLN 68 14.775 -9.118 -5.351 527 HB3 GLN 68 2HB GLN 68 13.774 -7.726 -4.961 528 HG2 GLN 68 1HG GLN 68 15.198 -7.007 -3.415 529 HG3 GLN 68 2HG GLN 68 15.362 -8.610 -2.701 530 HE21 GLN 68 2HE2 GLN 68 16.410 -10.056 -4.746 531 HE22 GLN 68 1HE2 GLN 68 17.975 -9.453 -5.160 532 H ARG 69 H ARG 69 11.017 -8.646 -4.559 533 HA ARG 69 HA ARG 69 10.644 -6.858 -2.307 534 HB2 ARG 69 1HB ARG 69 9.074 -7.414 -4.815 535 HB3 ARG 69 2HB ARG 69 8.426 -6.410 -3.525 536 HG2 ARG 69 1HG ARG 69 11.096 -5.832 -4.753 537 HG3 ARG 69 2HG ARG 69 9.597 -5.260 -5.487 538 HD2 ARG 69 1HD ARG 69 10.171 -3.469 -4.157 539 HD3 ARG 69 2HD ARG 69 9.091 -4.368 -3.092 540 HE ARG 69 HE ARG 69 10.870 -4.820 -1.713 541 HH11 ARG 69 1HH1 ARG 69 12.034 -3.559 -4.742 542 HH12 ARG 69 2HH1 ARG 69 13.666 -3.376 -4.188 543 HH21 ARG 69 1HH2 ARG 69 13.015 -4.585 -0.972 544 HH22 ARG 69 2HH2 ARG 69 14.223 -3.961 -2.044 545 H PHE 70 H PHE 70 8.416 -9.194 -3.816 546 HA PHE 70 HA PHE 70 6.722 -9.516 -1.668 547 HB2 PHE 70 1HB PHE 70 7.494 -11.640 -3.679 548 HB3 PHE 70 2HB PHE 70 6.039 -11.637 -2.687 549 HD1 PHE 70 HD1 PHE 70 4.257 -9.995 -3.110 550 HD2 PHE 70 HD2 PHE 70 7.653 -10.327 -5.654 551 HE1 PHE 70 HE1 PHE 70 3.067 -8.736 -4.857 552 HE2 PHE 70 HE2 PHE 70 6.469 -9.069 -7.405 553 HZ PHE 70 HZ PHE 70 4.173 -8.271 -7.008 554 H GLU 71 H GLU 71 9.326 -11.789 -2.558 555 HA GLU 71 HA GLU 71 9.215 -13.413 -0.333 556 HB2 GLU 71 1HB GLU 71 10.702 -13.496 -2.505 557 HB3 GLU 71 2HB GLU 71 11.886 -12.705 -1.475 558 HG2 GLU 71 1HG GLU 71 12.336 -14.577 -0.351 559 HG3 GLU 71 2HG GLU 71 10.636 -15.032 -0.239 560 H SER 72 H SER 72 11.004 -13.577 1.368 561 HA SER 72 HA SER 72 10.820 -11.359 3.082 562 HB2 SER 72 1HB SER 72 11.195 -13.690 3.850 563 HB3 SER 72 2HB SER 72 12.831 -13.620 3.195 564 HG SER 72 HG SER 72 11.736 -12.274 5.405 565 H GLY 73 H GLY 73 13.280 -12.353 0.781 566 HA2 GLY 73 1HA GLY 73 14.322 -9.815 0.368 567 HA3 GLY 73 2HA GLY 73 15.294 -10.542 1.639 568 H ALA 74 H ALA 74 13.907 -11.555 -1.490 569 HA ALA 74 HA ALA 74 15.777 -13.500 -2.108 570 HB1 ALA 74 1HB ALA 74 14.833 -13.575 -4.186 571 HB2 ALA 74 2HB ALA 74 13.570 -12.704 -3.314 572 HB3 ALA 74 3HB ALA 74 14.717 -11.820 -4.321 573 H ARG 75 H ARG 75 17.267 -13.272 -4.138 574 HA ARG 75 HA ARG 75 18.911 -10.849 -3.808 575 HB2 ARG 75 1HB ARG 75 20.784 -12.576 -4.566 576 HB3 ARG 75 2HB ARG 75 20.343 -12.365 -2.876 577 HG2 ARG 75 1HG ARG 75 18.854 -14.307 -3.035 578 HG3 ARG 75 2HG ARG 75 19.340 -14.527 -4.717 579 HD2 ARG 75 1HD ARG 75 21.362 -15.379 -4.160 580 HD3 ARG 75 2HD ARG 75 21.525 -14.344 -2.742 581 HE ARG 75 HE ARG 75 20.687 -16.045 -1.479 582 HH11 ARG 75 1HH1 ARG 75 19.760 -16.564 -4.794 583 HH12 ARG 75 2HH1 ARG 75 19.041 -18.111 -4.488 584 HH21 ARG 75 1HH2 ARG 75 19.745 -18.080 -1.063 585 HH22 ARG 75 2HH2 ARG 75 19.032 -18.972 -2.365 586 H VAL 76 H VAL 76 18.279 -13.585 -6.002 587 HA VAL 76 HA VAL 76 17.873 -11.853 -8.236 588 HB VAL 76 HB VAL 76 19.828 -13.195 -9.482 589 HG11 VAL 76 1HG1 VAL 76 20.732 -11.155 -9.778 590 HG12 VAL 76 2HG1 VAL 76 19.320 -10.604 -8.874 591 HG13 VAL 76 3HG1 VAL 76 20.860 -10.846 -8.047 592 HG21 VAL 76 3HG2 VAL 76 20.526 -14.310 -7.380 593 HG22 VAL 76 1HG2 VAL 76 21.810 -13.353 -8.120 594 HG23 VAL 76 2HG2 VAL 76 20.942 -12.729 -6.717 595 H LEU 77 H LEU 77 17.258 -13.006 -10.165 596 HA LEU 77 HA LEU 77 16.282 -15.711 -9.557 597 HB2 LEU 77 1HB LEU 77 15.312 -13.553 -11.399 598 HB3 LEU 77 2HB LEU 77 14.798 -15.227 -11.599 599 HG LEU 77 HG LEU 77 14.447 -14.079 -8.900 600 HD11 LEU 77 1HD1 LEU 77 12.159 -13.336 -10.401 601 HD12 LEU 77 2HD1 LEU 77 13.574 -12.617 -11.169 602 HD13 LEU 77 3HD1 LEU 77 13.244 -12.309 -9.464 603 HD21 LEU 77 3HD2 LEU 77 13.412 -16.204 -10.539 604 HD22 LEU 77 1HD2 LEU 77 12.097 -15.212 -9.908 605 HD23 LEU 77 2HD2 LEU 77 13.255 -15.950 -8.801 606 H THR 78 H THR 78 16.034 -17.115 -11.579 607 HA THR 78 HA THR 78 18.635 -17.404 -12.757 608 HB THR 78 HB THR 78 17.835 -19.429 -13.730 609 HG1 THR 78 HG1 THR 78 15.178 -18.802 -12.960 610 HG21 THR 78 3HG2 THR 78 16.790 -20.575 -11.794 611 HG22 THR 78 1HG2 THR 78 16.540 -19.004 -11.034 612 HG23 THR 78 2HG2 THR 78 18.177 -19.585 -11.339 613 H ALA 79 H ALA 79 18.357 -18.217 -15.268 614 HA ALA 79 HA ALA 79 17.685 -15.763 -16.670 615 HB1 ALA 79 1HB ALA 79 19.825 -16.870 -17.120 616 HB2 ALA 79 2HB ALA 79 18.961 -18.291 -17.707 617 HB3 ALA 79 3HB ALA 79 18.827 -16.760 -18.571 618 H SER 80 H SER 80 15.855 -18.181 -15.676 619 HA SER 80 HA SER 80 14.300 -18.360 -18.172 620 HB2 SER 80 1HB SER 80 14.595 -20.284 -15.870 621 HB3 SER 80 2HB SER 80 13.251 -20.396 -17.007 622 HG SER 80 HG SER 80 14.636 -21.534 -18.116 623 H GLU 81 H GLU 81 13.888 -18.319 -14.630 624 HA GLU 81 HA GLU 81 11.169 -17.801 -14.546 625 HB2 GLU 81 1HB GLU 81 13.442 -17.208 -12.695 626 HB3 GLU 81 2HB GLU 81 11.859 -16.530 -12.344 627 HG2 GLU 81 1HG GLU 81 10.914 -18.818 -12.421 628 HG3 GLU 81 2HG GLU 81 12.549 -19.444 -12.629 629 H THR 82 H THR 82 13.838 -15.626 -15.151 630 HA THR 82 HA THR 82 12.132 -13.274 -15.031 631 HB THR 82 HB THR 82 14.198 -12.030 -15.656 632 HG1 THR 82 HG1 THR 82 16.138 -13.172 -15.793 633 HG21 THR 82 3HG2 THR 82 15.086 -13.737 -13.411 634 HG22 THR 82 1HG2 THR 82 13.498 -12.990 -13.244 635 HG23 THR 82 2HG2 THR 82 14.923 -11.984 -13.507 636 H LYS 83 H LYS 83 13.712 -15.308 -17.416 637 HA LYS 83 HA LYS 83 13.238 -13.622 -19.652 638 HB2 LYS 83 1HB LYS 83 14.946 -15.319 -19.779 639 HB3 LYS 83 2HB LYS 83 13.774 -16.589 -19.451 640 HG2 LYS 83 1HG LYS 83 14.426 -16.491 -21.813 641 HG3 LYS 83 2HG LYS 83 12.700 -16.202 -21.579 642 HD2 LYS 83 1HD LYS 83 13.096 -13.783 -21.755 643 HD3 LYS 83 2HD LYS 83 14.814 -14.092 -22.020 644 HE2 LYS 83 1HE LYS 83 12.619 -15.172 -23.780 645 HE3 LYS 83 2HE LYS 83 13.484 -13.669 -24.100 646 HZ1 LYS 83 3HZ LYS 83 14.813 -15.030 -25.271 647 HZ2 LYS 83 1HZ LYS 83 14.368 -16.415 -24.407 648 HZ3 LYS 83 2HZ LYS 83 15.516 -15.352 -23.766 649 H THR 84 H THR 84 11.179 -15.508 -17.760 650 HA THR 84 HA THR 84 9.216 -15.812 -19.923 651 HB THR 84 HB THR 84 9.678 -17.835 -18.605 652 HG1 THR 84 HG1 THR 84 7.464 -18.274 -18.115 653 HG21 THR 84 3HG2 THR 84 10.097 -17.580 -16.423 654 HG22 THR 84 1HG2 THR 84 8.355 -17.423 -16.202 655 HG23 THR 84 2HG2 THR 84 9.353 -15.982 -16.393 656 H PHE 85 H PHE 85 9.920 -13.281 -18.474 657 HA PHE 85 HA PHE 85 7.312 -12.697 -17.245 658 HB2 PHE 85 1HB PHE 85 10.004 -11.991 -16.534 659 HB3 PHE 85 2HB PHE 85 9.080 -10.526 -16.847 660 HD1 PHE 85 HD2 PHE 85 9.056 -13.675 -14.890 661 HD2 PHE 85 HD1 PHE 85 7.590 -9.696 -15.259 662 HE1 PHE 85 HE2 PHE 85 8.042 -13.844 -12.655 663 HE2 PHE 85 HE1 PHE 85 6.574 -9.859 -13.024 664 HZ PHE 85 HZ PHE 85 6.798 -11.936 -11.719 665 H LEU 86 H LEU 86 9.785 -11.019 -19.197 666 HA LEU 86 HA LEU 86 7.869 -9.160 -20.242 667 HB2 LEU 86 1HB LEU 86 10.614 -9.674 -21.347 668 HB3 LEU 86 2HB LEU 86 9.666 -8.190 -21.422 669 HG LEU 86 HG LEU 86 11.214 -9.321 -19.114 670 HD11 LEU 86 1HD1 LEU 86 11.131 -6.616 -20.443 671 HD12 LEU 86 2HD1 LEU 86 12.388 -7.837 -20.637 672 HD13 LEU 86 3HD1 LEU 86 12.150 -7.058 -19.073 673 HD21 LEU 86 3HD2 LEU 86 10.185 -7.378 -17.819 674 HD22 LEU 86 1HD2 LEU 86 9.187 -8.814 -18.050 675 HD23 LEU 86 2HD2 LEU 86 8.919 -7.384 -19.047 676 H ALA 87 H ALA 87 9.995 -11.477 -21.931 677 HA ALA 87 HA ALA 87 8.662 -11.426 -24.370 678 HB1 ALA 87 1HB ALA 87 9.881 -13.380 -24.951 679 HB2 ALA 87 2HB ALA 87 10.921 -12.418 -23.900 680 HB3 ALA 87 3HB ALA 87 10.087 -13.833 -23.259 681 H ALA 88 H ALA 88 7.780 -12.943 -21.410 682 HA ALA 88 HA ALA 88 6.244 -15.093 -22.196 683 HB1 ALA 88 1HB ALA 88 4.954 -13.544 -20.098 684 HB2 ALA 88 2HB ALA 88 5.651 -15.164 -20.046 685 HB3 ALA 88 3HB ALA 88 6.686 -13.751 -19.833 686 H ALA 89 H ALA 89 5.000 -11.797 -21.604 687 HA ALA 89 HA ALA 89 2.421 -12.169 -22.509 688 HB1 ALA 89 1HB ALA 89 2.366 -10.068 -21.796 689 HB2 ALA 89 2HB ALA 89 4.121 -9.929 -21.914 690 HB3 ALA 89 3HB ALA 89 3.112 -9.581 -23.319 691 H ASP 90 H ASP 90 4.767 -10.357 -24.471 692 HA ASP 90 HA ASP 90 4.264 -11.996 -26.794 693 HB2 ASP 90 1HB ASP 90 3.005 -9.320 -26.437 694 HB3 ASP 90 2HB ASP 90 3.639 -9.719 -28.031 695 H HIS 91 H HIS 91 5.312 -10.767 -28.794 696 HA HIS 91 HA HIS 91 7.721 -9.337 -27.945 697 HB2 HIS 91 1HB HIS 91 9.089 -10.795 -29.472 698 HB3 HIS 91 2HB HIS 91 8.491 -11.603 -28.026 699 HD1 HIS 91 HD1 HIS 91 6.433 -13.252 -28.391 700 HD2 HIS 91 HD2 HIS 91 8.316 -11.926 -31.849 701 HE1 HIS 91 HE1 HIS 91 5.672 -14.811 -30.212 702 H ASP 92 H ASP 92 5.881 -7.879 -29.002 703 HA ASP 92 HA ASP 92 5.426 -7.806 -31.723 704 HB2 ASP 92 1HB ASP 92 4.187 -6.305 -30.387 705 HB3 ASP 92 2HB ASP 92 5.640 -5.608 -29.676 706 H GLY 93 H GLY 93 8.276 -6.861 -29.939 707 HA2 GLY 93 1HA GLY 93 9.623 -6.352 -32.511 708 HA3 GLY 93 2HA GLY 93 9.822 -5.228 -31.174 709 H ASP 94 H ASP 94 10.710 -6.155 -29.140 710 HA ASP 94 HA ASP 94 12.548 -8.391 -29.685 711 HB2 ASP 94 1HB ASP 94 13.219 -5.667 -29.134 712 HB3 ASP 94 2HB ASP 94 13.737 -6.656 -27.772 713 H GLY 95 H GLY 95 9.995 -7.401 -27.913 714 HA2 GLY 95 1HA GLY 95 9.117 -8.952 -26.263 715 HA3 GLY 95 2HA GLY 95 10.757 -9.154 -25.665 716 H LYS 96 H LYS 96 9.740 -5.970 -26.496 717 HA LYS 96 HA LYS 96 10.023 -5.132 -23.746 718 HB2 LYS 96 1HB LYS 96 9.555 -3.666 -26.336 719 HB3 LYS 96 2HB LYS 96 9.512 -2.842 -24.783 720 HG2 LYS 96 1HG LYS 96 11.684 -2.485 -25.323 721 HG3 LYS 96 2HG LYS 96 11.857 -4.036 -24.499 722 HD2 LYS 96 1HD LYS 96 13.085 -4.280 -26.482 723 HD3 LYS 96 2HD LYS 96 11.553 -5.093 -26.808 724 HE2 LYS 96 1HE LYS 96 12.054 -3.783 -28.721 725 HE3 LYS 96 2HE LYS 96 10.762 -2.949 -27.858 726 HZ1 LYS 96 3HZ LYS 96 12.041 -1.159 -27.808 727 HZ2 LYS 96 1HZ LYS 96 13.315 -1.989 -28.551 728 HZ3 LYS 96 2HZ LYS 96 13.176 -1.986 -26.866 729 H ILE 97 H ILE 97 8.398 -3.514 -22.868 730 HA ILE 97 HA ILE 97 5.647 -4.231 -23.609 731 HB ILE 97 HB ILE 97 6.545 -3.985 -20.742 732 HG12 ILE 97 1HG1 ILE 97 7.613 -5.943 -21.799 733 HG13 ILE 97 2HG1 ILE 97 6.414 -6.421 -20.602 734 HG21 ILE 97 1HG2 ILE 97 3.984 -4.368 -22.121 735 HG22 ILE 97 2HG2 ILE 97 4.262 -5.453 -20.760 736 HG23 ILE 97 3HG2 ILE 97 4.327 -3.707 -20.523 737 HD11 ILE 97 3HD1 ILE 97 5.225 -7.534 -22.108 738 HD12 ILE 97 1HD1 ILE 97 5.284 -6.200 -23.260 739 HD13 ILE 97 2HD1 ILE 97 6.614 -7.356 -23.180 740 H GLY 98 H GLY 98 4.062 -2.657 -23.137 741 HA2 GLY 98 1HA GLY 98 5.062 -0.050 -22.214 742 HA3 GLY 98 2HA GLY 98 4.247 -0.152 -23.768 743 H ALA 99 H ALA 99 3.637 -1.461 -20.505 744 HA ALA 99 HA ALA 99 1.723 -1.576 -19.268 745 HB1 ALA 99 1HB ALA 99 1.038 1.121 -20.395 746 HB2 ALA 99 2HB ALA 99 0.703 0.479 -18.786 747 HB3 ALA 99 3HB ALA 99 2.354 0.896 -19.243 748 H GLU 100 H GLU 100 1.465 -2.926 -21.652 749 HA GLU 100 HA GLU 100 -1.403 -2.773 -22.048 750 HB2 GLU 100 1HB GLU 100 0.568 -2.338 -24.290 751 HB3 GLU 100 2HB GLU 100 -1.092 -2.844 -24.568 752 HG2 GLU 100 1HG GLU 100 -1.798 -0.784 -23.287 753 HG3 GLU 100 2HG GLU 100 -0.118 -0.262 -23.391 754 H GLU 101 H GLU 101 1.667 -4.336 -22.786 755 HA GLU 101 HA GLU 101 0.456 -6.780 -23.678 756 HB2 GLU 101 1HB GLU 101 3.310 -6.240 -22.841 757 HB3 GLU 101 2HB GLU 101 2.739 -7.659 -23.707 758 HG2 GLU 101 1HG GLU 101 1.932 -5.988 -25.485 759 HG3 GLU 101 2HG GLU 101 3.006 -4.845 -24.681 760 H PHE 102 H PHE 102 2.353 -5.887 -20.794 761 HA PHE 102 HA PHE 102 2.039 -8.310 -19.434 762 HB2 PHE 102 1HB PHE 102 3.464 -6.077 -18.958 763 HB3 PHE 102 2HB PHE 102 2.155 -5.833 -17.807 764 HD1 PHE 102 HD1 PHE 102 1.606 -7.901 -16.294 765 HD2 PHE 102 HD2 PHE 102 5.303 -7.294 -18.313 766 HE1 PHE 102 HE1 PHE 102 2.717 -9.418 -14.707 767 HE2 PHE 102 HE2 PHE 102 6.420 -8.811 -16.730 768 HZ PHE 102 HZ PHE 102 5.127 -9.875 -14.924 769 H GLN 103 H GLN 103 -0.151 -5.699 -19.928 770 HA GLN 103 HA GLN 103 -1.860 -6.272 -17.700 771 HB2 GLN 103 1HB GLN 103 -2.029 -4.508 -20.111 772 HB3 GLN 103 2HB GLN 103 -3.485 -4.836 -19.181 773 HG2 GLN 103 1HG GLN 103 -2.348 -2.745 -18.533 774 HG3 GLN 103 2HG GLN 103 -2.514 -3.895 -17.208 775 HE21 GLN 103 2HE2 GLN 103 -0.191 -3.492 -19.862 776 HE22 GLN 103 1HE2 GLN 103 1.214 -3.481 -18.858 777 H GLU 104 H GLU 104 -2.057 -6.859 -21.204 778 HA GLU 104 HA GLU 104 -4.502 -8.281 -21.094 779 HB2 GLU 104 1HB GLU 104 -4.248 -8.619 -23.362 780 HB3 GLU 104 2HB GLU 104 -3.240 -7.200 -23.117 781 HG2 GLU 104 1HG GLU 104 -1.386 -9.066 -22.750 782 HG3 GLU 104 2HG GLU 104 -2.480 -9.978 -23.788 783 H MET 105 H MET 105 -1.330 -9.130 -20.222 784 HA MET 105 HA MET 105 -1.486 -11.933 -20.752 785 HB2 MET 105 1HB MET 105 0.691 -10.992 -20.588 786 HB3 MET 105 2HB MET 105 0.334 -10.257 -19.030 787 HG2 MET 105 1HG MET 105 0.547 -12.246 -17.889 788 HG3 MET 105 2HG MET 105 0.233 -13.221 -19.323 789 HE1 MET 105 3HE MET 105 2.771 -10.503 -17.983 790 HE2 MET 105 1HE MET 105 4.139 -10.800 -19.056 791 HE3 MET 105 2HE MET 105 2.616 -10.204 -19.715 792 H VAL 106 H VAL 106 -1.945 -9.922 -17.865 793 HA VAL 106 HA VAL 106 -2.632 -12.173 -16.210 794 HB VAL 106 HB VAL 106 -3.022 -9.230 -15.648 795 HG11 VAL 106 1HG1 VAL 106 -2.537 -11.020 -13.405 796 HG12 VAL 106 2HG1 VAL 106 -3.781 -9.787 -13.622 797 HG13 VAL 106 3HG1 VAL 106 -4.017 -11.406 -14.283 798 HG21 VAL 106 3HG2 VAL 106 -0.736 -9.369 -15.925 799 HG22 VAL 106 1HG2 VAL 106 -0.904 -9.731 -14.207 800 HG23 VAL 106 2HG2 VAL 106 -0.662 -11.040 -15.365 801 H GLN 107 H GLN 107 -4.362 -9.669 -17.975 802 HA GLN 107 HA GLN 107 -6.928 -10.583 -16.958 803 HB2 GLN 107 1HB GLN 107 -6.396 -8.470 -19.047 804 HB3 GLN 107 2HB GLN 107 -7.885 -8.722 -18.145 805 HG2 GLN 107 1HG GLN 107 -5.314 -7.509 -17.262 806 HG3 GLN 107 2HG GLN 107 -6.965 -6.929 -17.050 807 HE21 GLN 107 2HE2 GLN 107 -8.266 -8.902 -15.869 808 HE22 GLN 107 1HE2 GLN 107 -7.556 -9.318 -14.350 809 H SER 108 H SER 108 -4.880 -11.746 -19.168 810 HA SER 108 HA SER 108 -6.211 -12.061 -21.556 811 HB2 SER 108 1HB SER 108 -4.547 -13.507 -22.051 812 HB3 SER 108 2HB SER 108 -3.901 -13.074 -20.468 813 HG SER 108 HG SER 108 -5.075 -14.863 -19.613 Start of MODEL 6 1 H1 SER 1 H SER 1 5.101 -3.458 0.956 2 HA SER 1 HA SER 1 2.490 -2.631 1.058 3 HB2 SER 1 1HB SER 1 5.008 -1.335 0.099 4 HB3 SER 1 2HB SER 1 3.475 -0.508 -0.180 5 HG SER 1 HG SER 1 4.842 -0.369 1.973 6 H LEU 2 H LEU 2 4.228 -3.829 -1.668 7 HA LEU 2 HA LEU 2 2.628 -2.704 -3.721 8 HB2 LEU 2 1HB LEU 2 3.790 -4.063 -5.192 9 HB3 LEU 2 2HB LEU 2 4.939 -3.811 -3.879 10 HG LEU 2 HG LEU 2 3.252 -6.285 -4.255 11 HD11 LEU 2 1HD1 LEU 2 5.999 -5.546 -5.138 12 HD12 LEU 2 2HD1 LEU 2 4.759 -6.484 -5.970 13 HD13 LEU 2 3HD1 LEU 2 5.671 -7.208 -4.645 14 HD21 LEU 2 3HD2 LEU 2 5.245 -5.411 -2.207 15 HD22 LEU 2 1HD2 LEU 2 5.083 -7.121 -2.607 16 HD23 LEU 2 2HD2 LEU 2 3.695 -6.225 -1.991 17 H THR 3 H THR 3 1.985 -5.069 -1.407 18 HA THR 3 HA THR 3 -0.034 -6.408 -3.051 19 HB THR 3 HB THR 3 -0.316 -7.828 -0.927 20 HG1 THR 3 HG1 THR 3 0.970 -6.196 0.318 21 HG21 THR 3 3HG2 THR 3 2.430 -8.009 -2.133 22 HG22 THR 3 1HG2 THR 3 0.985 -8.390 -3.069 23 HG23 THR 3 2HG2 THR 3 1.363 -9.315 -1.615 24 H ASP 4 H ASP 4 -0.507 -3.704 -2.394 25 HA ASP 4 HA ASP 4 -2.274 -3.545 -0.139 26 HB2 ASP 4 1HB ASP 4 -1.013 -1.582 -0.895 27 HB3 ASP 4 2HB ASP 4 -1.856 -1.625 -2.441 28 H ILE 5 H ILE 5 -2.884 -3.051 -3.622 29 HA ILE 5 HA ILE 5 -5.659 -3.171 -3.486 30 HB ILE 5 HB ILE 5 -4.053 -2.566 -5.472 31 HG12 ILE 5 1HG1 ILE 5 -6.232 -3.672 -6.870 32 HG13 ILE 5 2HG1 ILE 5 -6.841 -3.282 -5.265 33 HG21 ILE 5 1HG2 ILE 5 -3.166 -4.882 -5.636 34 HG22 ILE 5 2HG2 ILE 5 -4.761 -5.410 -6.169 35 HG23 ILE 5 3HG2 ILE 5 -3.837 -4.270 -7.147 36 HD11 ILE 5 3HD1 ILE 5 -7.212 -1.415 -6.697 37 HD12 ILE 5 1HD1 ILE 5 -5.940 -0.986 -5.554 38 HD13 ILE 5 2HD1 ILE 5 -5.526 -1.411 -7.215 39 H LEU 6 H LEU 6 -3.313 -5.707 -3.376 40 HA LEU 6 HA LEU 6 -5.472 -7.707 -3.525 41 HB2 LEU 6 1HB LEU 6 -3.091 -7.562 -4.973 42 HB3 LEU 6 2HB LEU 6 -2.816 -8.814 -3.763 43 HG LEU 6 HG LEU 6 -5.147 -9.691 -4.652 44 HD11 LEU 6 1HD1 LEU 6 -4.280 -8.941 -7.312 45 HD12 LEU 6 2HD1 LEU 6 -4.759 -7.542 -6.351 46 HD13 LEU 6 3HD1 LEU 6 -5.886 -8.878 -6.585 47 HD21 LEU 6 3HD2 LEU 6 -3.916 -11.378 -5.446 48 HD22 LEU 6 1HD2 LEU 6 -2.520 -10.432 -4.931 49 HD23 LEU 6 2HD2 LEU 6 -3.077 -10.342 -6.602 50 H SER 7 H SER 7 -4.191 -9.870 -2.455 51 HA SER 7 HA SER 7 -3.909 -9.048 0.347 52 HB2 SER 7 1HB SER 7 -5.560 -10.911 -0.673 53 HB3 SER 7 2HB SER 7 -4.152 -11.924 -0.357 54 HG SER 7 HG SER 7 -5.922 -10.813 1.391 55 HA PRO 8 HA PRO 8 0.433 -9.904 0.090 56 HB2 PRO 8 1HB PRO 8 0.953 -9.705 2.747 57 HB3 PRO 8 2HB PRO 8 0.679 -8.298 1.713 58 HG2 PRO 8 1HG PRO 8 -1.221 -9.688 3.562 59 HG3 PRO 8 2HG PRO 8 -0.970 -7.950 3.317 60 HD2 PRO 8 1HD PRO 8 -3.032 -9.297 2.192 61 HD3 PRO 8 2HD PRO 8 -2.258 -7.906 1.406 62 H SER 9 H SER 9 -1.883 -11.722 1.919 63 HA SER 9 HA SER 9 0.045 -13.838 2.504 64 HB2 SER 9 1HB SER 9 -2.852 -13.469 3.293 65 HB3 SER 9 2HB SER 9 -1.890 -14.884 3.720 66 HG SER 9 HG SER 9 -1.044 -12.262 4.345 67 H ASP 10 H ASP 10 -0.763 -13.234 -0.238 68 HA ASP 10 HA ASP 10 -1.903 -15.859 -0.929 69 HB2 ASP 10 1HB ASP 10 -3.151 -13.433 -1.390 70 HB3 ASP 10 2HB ASP 10 -2.374 -13.784 -2.931 71 H ILE 11 H ILE 11 0.275 -13.240 -1.772 72 HA ILE 11 HA ILE 11 1.294 -14.423 -4.148 73 HB ILE 11 HB ILE 11 2.446 -12.306 -2.334 74 HG12 ILE 11 1HG1 ILE 11 1.893 -10.958 -4.513 75 HG13 ILE 11 2HG1 ILE 11 0.810 -12.305 -4.848 76 HG21 ILE 11 1HG2 ILE 11 3.593 -13.693 -4.668 77 HG22 ILE 11 2HG2 ILE 11 3.738 -11.936 -4.665 78 HG23 ILE 11 3HG2 ILE 11 4.392 -12.876 -3.324 79 HD11 ILE 11 3HD1 ILE 11 0.610 -11.124 -2.158 80 HD12 ILE 11 1HD1 ILE 11 0.082 -10.111 -3.501 81 HD13 ILE 11 2HD1 ILE 11 -0.651 -11.696 -3.250 82 H ALA 12 H ALA 12 1.990 -14.802 -0.771 83 HA ALA 12 HA ALA 12 4.578 -15.959 -1.061 84 HB1 ALA 12 1HB ALA 12 4.507 -16.373 1.236 85 HB2 ALA 12 2HB ALA 12 3.533 -14.916 1.034 86 HB3 ALA 12 3HB ALA 12 2.746 -16.478 1.257 87 H ALA 13 H ALA 13 1.330 -17.168 -1.275 88 HA ALA 13 HA ALA 13 1.787 -19.894 -0.800 89 HB1 ALA 13 1HB ALA 13 -0.248 -18.651 -2.647 90 HB2 ALA 13 2HB ALA 13 -0.301 -20.284 -1.981 91 HB3 ALA 13 3HB ALA 13 -0.449 -18.890 -0.911 92 H ALA 14 H ALA 14 2.754 -17.898 -3.392 93 HA ALA 14 HA ALA 14 3.255 -20.230 -5.114 94 HB1 ALA 14 1HB ALA 14 1.980 -18.041 -5.859 95 HB2 ALA 14 2HB ALA 14 3.624 -17.458 -6.121 96 HB3 ALA 14 3HB ALA 14 3.057 -18.902 -6.960 97 H LEU 15 H LEU 15 4.765 -17.454 -3.565 98 HA LEU 15 HA LEU 15 7.299 -17.575 -4.690 99 HB2 LEU 15 1HB LEU 15 6.406 -16.802 -1.924 100 HB3 LEU 15 2HB LEU 15 8.068 -16.618 -2.480 101 HG LEU 15 HG LEU 15 5.692 -15.280 -3.770 102 HD11 LEU 15 1HD1 LEU 15 7.360 -13.397 -2.529 103 HD12 LEU 15 2HD1 LEU 15 7.060 -14.655 -1.331 104 HD13 LEU 15 3HD1 LEU 15 5.705 -13.827 -2.097 105 HD21 LEU 15 3HD2 LEU 15 7.736 -15.691 -5.164 106 HD22 LEU 15 1HD2 LEU 15 8.630 -14.672 -4.035 107 HD23 LEU 15 2HD2 LEU 15 7.296 -13.993 -4.969 108 H ARG 16 H ARG 16 5.786 -19.677 -2.389 109 HA ARG 16 HA ARG 16 8.324 -20.989 -1.761 110 HB2 ARG 16 1HB ARG 16 6.584 -20.431 0.014 111 HB3 ARG 16 2HB ARG 16 5.600 -21.708 -0.688 112 HG2 ARG 16 1HG ARG 16 8.401 -22.323 0.108 113 HG3 ARG 16 2HG ARG 16 7.161 -22.179 1.355 114 HD2 ARG 16 1HD ARG 16 6.045 -23.749 -0.689 115 HD3 ARG 16 2HD ARG 16 7.687 -24.347 -0.451 116 HE ARG 16 HE ARG 16 7.084 -25.111 1.635 117 HH11 ARG 16 1HH1 ARG 16 4.575 -23.066 0.353 118 HH12 ARG 16 2HH1 ARG 16 3.427 -23.483 1.582 119 HH21 ARG 16 1HH2 ARG 16 5.581 -25.668 3.258 120 HH22 ARG 16 2HH2 ARG 16 4.001 -24.963 3.234 121 H ASP 17 H ASP 17 5.518 -21.350 -3.720 122 HA ASP 17 HA ASP 17 6.175 -24.159 -4.278 123 HB2 ASP 17 1HB ASP 17 3.775 -23.282 -3.688 124 HB3 ASP 17 2HB ASP 17 3.750 -22.781 -5.377 125 H CYS 18 H CYS 18 7.535 -21.632 -5.275 126 HA CYS 18 HA CYS 18 7.490 -22.382 -8.113 127 HB2 CYS 18 1HB CYS 18 7.359 -20.176 -8.874 128 HB3 CYS 18 2HB CYS 18 6.202 -20.212 -7.550 129 HG CYS 18 HG CYS 18 8.547 -19.282 -5.850 130 H GLN 19 H GLN 19 9.250 -22.416 -5.463 131 HA GLN 19 HA GLN 19 11.638 -21.079 -6.019 132 HB2 GLN 19 1HB GLN 19 12.685 -22.748 -4.486 133 HB3 GLN 19 2HB GLN 19 11.248 -21.978 -3.827 134 HG2 GLN 19 1HG GLN 19 9.985 -24.031 -4.690 135 HG3 GLN 19 2HG GLN 19 11.576 -24.774 -4.846 136 HE21 GLN 19 2HE2 GLN 19 9.958 -22.728 -2.434 137 HE22 GLN 19 1HE2 GLN 19 10.328 -23.737 -1.082 138 H ALA 20 H ALA 20 10.273 -23.889 -7.440 139 HA ALA 20 HA ALA 20 12.651 -25.134 -8.353 140 HB1 ALA 20 1HB ALA 20 11.269 -26.692 -9.161 141 HB2 ALA 20 2HB ALA 20 9.987 -25.787 -8.355 142 HB3 ALA 20 3HB ALA 20 10.321 -25.510 -10.064 143 HA PRO 21 HA PRO 21 13.852 -22.755 -11.838 144 HB2 PRO 21 1HB PRO 21 14.571 -24.666 -13.627 145 HB3 PRO 21 2HB PRO 21 15.526 -24.289 -12.188 146 HG2 PRO 21 1HG PRO 21 13.572 -26.513 -12.637 147 HG3 PRO 21 2HG PRO 21 15.160 -26.561 -11.849 148 HD2 PRO 21 1HD PRO 21 12.843 -26.477 -10.451 149 HD3 PRO 21 2HD PRO 21 14.340 -25.727 -9.863 150 H ASP 22 H ASP 22 12.810 -21.711 -13.419 151 HA ASP 22 HA ASP 22 11.189 -21.153 -14.919 152 HB2 ASP 22 1HB ASP 22 12.578 -22.919 -16.160 153 HB3 ASP 22 2HB ASP 22 11.253 -24.028 -15.817 154 H SER 23 H SER 23 10.379 -22.251 -12.292 155 HA SER 23 HA SER 23 7.802 -23.486 -12.950 156 HB2 SER 23 1HB SER 23 9.637 -23.650 -10.692 157 HB3 SER 23 2HB SER 23 7.978 -23.343 -10.180 158 HG SER 23 HG SER 23 7.337 -25.218 -11.075 159 H PHE 24 H PHE 24 9.192 -20.507 -12.084 160 HA PHE 24 HA PHE 24 6.638 -19.454 -11.096 161 HB2 PHE 24 1HB PHE 24 8.722 -19.040 -9.766 162 HB3 PHE 24 2HB PHE 24 9.336 -18.091 -11.116 163 HD1 PHE 24 HD1 PHE 24 5.969 -18.249 -9.528 164 HD2 PHE 24 HD2 PHE 24 9.377 -15.882 -10.477 165 HE1 PHE 24 HE1 PHE 24 4.829 -16.258 -8.640 166 HE2 PHE 24 HE2 PHE 24 8.243 -13.887 -9.590 167 HZ PHE 24 HZ PHE 24 5.966 -14.073 -8.669 168 H SER 25 H SER 25 5.607 -17.731 -12.077 169 HA SER 25 HA SER 25 6.682 -16.297 -14.279 170 HB2 SER 25 1HB SER 25 5.104 -17.191 -16.010 171 HB3 SER 25 2HB SER 25 6.344 -18.343 -15.515 172 HG SER 25 HG SER 25 3.991 -19.015 -15.629 173 HA PRO 26 HA PRO 26 3.433 -13.558 -13.185 174 HB2 PRO 26 1HB PRO 26 3.041 -12.238 -15.524 175 HB3 PRO 26 2HB PRO 26 4.467 -11.991 -14.509 176 HG2 PRO 26 1HG PRO 26 4.158 -13.673 -16.966 177 HG3 PRO 26 2HG PRO 26 5.491 -12.597 -16.507 178 HD2 PRO 26 1HD PRO 26 5.614 -15.284 -16.195 179 HD3 PRO 26 2HD PRO 26 6.429 -14.156 -15.092 180 H LYS 27 H LYS 27 2.999 -15.781 -15.816 181 HA LYS 27 HA LYS 27 0.109 -15.306 -15.868 182 HB2 LYS 27 1HB LYS 27 0.116 -16.808 -17.832 183 HB3 LYS 27 2HB LYS 27 1.181 -15.424 -18.039 184 HG2 LYS 27 1HG LYS 27 3.103 -16.712 -17.838 185 HG3 LYS 27 2HG LYS 27 2.246 -18.040 -17.053 186 HD2 LYS 27 1HD LYS 27 1.657 -17.219 -19.883 187 HD3 LYS 27 2HD LYS 27 2.942 -18.365 -19.491 188 HE2 LYS 27 1HE LYS 27 1.011 -19.517 -18.108 189 HE3 LYS 27 2HE LYS 27 -0.012 -18.657 -19.258 190 HZ1 LYS 27 3HZ LYS 27 1.692 -19.719 -20.943 191 HZ2 LYS 27 1HZ LYS 27 0.329 -20.566 -20.406 192 HZ3 LYS 27 2HZ LYS 27 1.841 -20.869 -19.711 193 H LYS 28 H LYS 28 1.869 -16.799 -13.796 194 HA LYS 28 HA LYS 28 0.181 -19.213 -13.691 195 HB2 LYS 28 1HB LYS 28 2.457 -19.880 -14.165 196 HB3 LYS 28 2HB LYS 28 3.064 -18.894 -12.841 197 HG2 LYS 28 1HG LYS 28 3.070 -21.182 -12.156 198 HG3 LYS 28 2HG LYS 28 1.806 -20.334 -11.261 199 HD2 LYS 28 1HD LYS 28 0.815 -22.355 -11.927 200 HD3 LYS 28 2HD LYS 28 0.209 -21.160 -13.076 201 HE2 LYS 28 1HE LYS 28 0.809 -22.882 -14.481 202 HE3 LYS 28 2HE LYS 28 2.271 -21.898 -14.494 203 HZ1 LYS 28 3HZ LYS 28 3.212 -23.366 -12.805 204 HZ2 LYS 28 1HZ LYS 28 2.809 -24.222 -14.208 205 HZ3 LYS 28 2HZ LYS 28 1.818 -24.324 -12.841 206 H PHE 29 H PHE 29 1.887 -16.729 -11.850 207 HA PHE 29 HA PHE 29 0.676 -17.529 -9.355 208 HB2 PHE 29 1HB PHE 29 2.118 -16.066 -8.345 209 HB3 PHE 29 2HB PHE 29 2.987 -16.295 -9.859 210 HD1 PHE 29 HD2 PHE 29 2.332 -14.615 -11.771 211 HD2 PHE 29 HD1 PHE 29 1.701 -13.929 -7.618 212 HE1 PHE 29 HE2 PHE 29 2.240 -12.192 -12.189 213 HE2 PHE 29 HE1 PHE 29 1.606 -11.505 -8.030 214 HZ PHE 29 HZ PHE 29 1.877 -10.634 -10.318 215 H PHE 30 H PHE 30 -0.200 -15.591 -11.999 216 HA PHE 30 HA PHE 30 -1.654 -13.519 -10.882 217 HB2 PHE 30 1HB PHE 30 -2.748 -13.309 -12.956 218 HB3 PHE 30 2HB PHE 30 -1.190 -14.026 -13.356 219 HD1 PHE 30 HD1 PHE 30 -1.159 -16.642 -13.453 220 HD2 PHE 30 HD2 PHE 30 -4.664 -14.252 -13.807 221 HE1 PHE 30 HE1 PHE 30 -2.304 -18.497 -14.594 222 HE2 PHE 30 HE2 PHE 30 -5.815 -16.104 -14.948 223 HZ PHE 30 HZ PHE 30 -4.635 -18.230 -15.342 224 H GLN 31 H GLN 31 -2.396 -16.910 -11.032 225 HA GLN 31 HA GLN 31 -5.140 -16.462 -10.140 226 HB2 GLN 31 1HB GLN 31 -5.551 -18.739 -10.608 227 HB3 GLN 31 2HB GLN 31 -4.522 -18.173 -11.918 228 HG2 GLN 31 1HG GLN 31 -2.615 -19.074 -10.330 229 HG3 GLN 31 2HG GLN 31 -3.931 -20.077 -9.723 230 HE21 GLN 31 2HE2 GLN 31 -1.422 -20.231 -11.655 231 HE22 GLN 31 1HE2 GLN 31 -2.005 -21.283 -12.895 232 H ILE 32 H ILE 32 -2.051 -17.610 -8.982 233 HA ILE 32 HA ILE 32 -2.994 -18.782 -6.572 234 HB ILE 32 HB ILE 32 -0.260 -17.703 -7.264 235 HG12 ILE 32 1HG1 ILE 32 -0.887 -20.607 -7.028 236 HG13 ILE 32 2HG1 ILE 32 -1.447 -19.763 -8.468 237 HG21 ILE 32 1HG2 ILE 32 -0.206 -17.757 -4.956 238 HG22 ILE 32 2HG2 ILE 32 -1.305 -19.132 -4.858 239 HG23 ILE 32 3HG2 ILE 32 0.365 -19.372 -5.373 240 HD11 ILE 32 3HD1 ILE 32 1.307 -19.135 -7.887 241 HD12 ILE 32 1HD1 ILE 32 1.054 -20.873 -8.050 242 HD13 ILE 32 2HD1 ILE 32 0.581 -19.787 -9.356 243 H SER 33 H SER 33 -1.571 -15.610 -7.319 244 HA SER 33 HA SER 33 -1.872 -14.648 -4.637 245 HB2 SER 33 1HB SER 33 -1.103 -12.515 -5.518 246 HB3 SER 33 2HB SER 33 -0.112 -13.813 -6.184 247 HG SER 33 HG SER 33 -0.631 -12.936 -8.024 248 H GLY 34 H GLY 34 -3.507 -13.921 -7.720 249 HA2 GLY 34 1HA GLY 34 -6.014 -13.899 -7.498 250 HA3 GLY 34 2HA GLY 34 -5.747 -12.813 -6.142 251 H MET 35 H MET 35 -3.902 -12.714 -9.126 252 HA MET 35 HA MET 35 -4.654 -9.948 -9.499 253 HB2 MET 35 1HB MET 35 -2.722 -11.791 -10.890 254 HB3 MET 35 2HB MET 35 -3.077 -10.185 -11.512 255 HG2 MET 35 1HG MET 35 -2.514 -9.618 -8.927 256 HG3 MET 35 2HG MET 35 -1.466 -11.007 -9.205 257 HE1 MET 35 3HE MET 35 -0.762 -9.865 -12.796 258 HE2 MET 35 1HE MET 35 0.764 -10.178 -11.967 259 HE3 MET 35 2HE MET 35 -0.630 -11.218 -11.670 260 H SER 36 H SER 36 -5.545 -13.028 -10.761 261 HA SER 36 HA SER 36 -6.438 -12.419 -13.309 262 HB2 SER 36 1HB SER 36 -6.433 -14.670 -11.895 263 HB3 SER 36 2HB SER 36 -8.118 -14.224 -11.627 264 HG SER 36 HG SER 36 -8.549 -14.523 -13.702 265 H LYS 37 H LYS 37 -7.912 -11.749 -10.206 266 HA LYS 37 HA LYS 37 -10.487 -11.060 -11.145 267 HB2 LYS 37 1HB LYS 37 -9.156 -9.900 -8.701 268 HB3 LYS 37 2HB LYS 37 -10.874 -10.148 -8.980 269 HG2 LYS 37 1HG LYS 37 -10.061 -12.676 -9.187 270 HG3 LYS 37 2HG LYS 37 -8.791 -12.064 -8.125 271 HD2 LYS 37 1HD LYS 37 -11.661 -11.470 -7.527 272 HD3 LYS 37 2HD LYS 37 -10.976 -13.039 -7.099 273 HE2 LYS 37 1HE LYS 37 -9.184 -11.855 -5.855 274 HE3 LYS 37 2HE LYS 37 -9.998 -10.330 -6.202 275 HZ1 LYS 37 3HZ LYS 37 -11.327 -10.661 -4.481 276 HZ2 LYS 37 1HZ LYS 37 -10.483 -12.075 -4.096 277 HZ3 LYS 37 2HZ LYS 37 -11.843 -12.149 -5.098 278 H LYS 38 H LYS 38 -7.472 -9.326 -10.971 279 HA LYS 38 HA LYS 38 -8.304 -6.693 -11.086 280 HB2 LYS 38 1HB LYS 38 -5.974 -7.930 -12.565 281 HB3 LYS 38 2HB LYS 38 -6.176 -6.218 -12.216 282 HG2 LYS 38 1HG LYS 38 -5.705 -8.448 -10.256 283 HG3 LYS 38 2HG LYS 38 -4.636 -7.097 -10.640 284 HD2 LYS 38 1HD LYS 38 -5.546 -6.212 -8.769 285 HD3 LYS 38 2HD LYS 38 -6.838 -5.748 -9.879 286 HE2 LYS 38 1HE LYS 38 -8.282 -7.312 -9.067 287 HE3 LYS 38 2HE LYS 38 -6.995 -8.444 -8.656 288 HZ1 LYS 38 3HZ LYS 38 -6.446 -6.587 -6.905 289 HZ2 LYS 38 1HZ LYS 38 -7.615 -7.769 -6.590 290 HZ3 LYS 38 2HZ LYS 38 -8.088 -6.224 -7.093 291 H SER 39 H SER 39 -7.942 -5.279 -13.140 292 HA SER 39 HA SER 39 -8.879 -6.494 -15.596 293 HB2 SER 39 1HB SER 39 -10.600 -4.722 -13.900 294 HB3 SER 39 2HB SER 39 -10.742 -4.641 -15.656 295 HG SER 39 HG SER 39 -11.828 -6.426 -15.585 296 H SER 40 H SER 40 -6.469 -5.234 -14.959 297 HA SER 40 HA SER 40 -5.008 -3.706 -15.801 298 HB2 SER 40 1HB SER 40 -5.286 -3.144 -17.990 299 HB3 SER 40 2HB SER 40 -6.633 -4.278 -17.888 300 HG SER 40 HG SER 40 -7.179 -2.201 -18.799 301 H SER 41 H SER 41 -7.307 -3.012 -13.857 302 HA SER 41 HA SER 41 -7.082 -0.083 -14.090 303 HB2 SER 41 1HB SER 41 -9.403 -1.228 -14.162 304 HB3 SER 41 2HB SER 41 -9.169 -1.483 -12.433 305 HG SER 41 HG SER 41 -10.285 0.497 -13.017 306 H GLN 42 H GLN 42 -6.071 -2.762 -12.345 307 HA GLN 42 HA GLN 42 -5.288 -1.051 -10.081 308 HB2 GLN 42 1HB GLN 42 -5.990 -3.984 -9.896 309 HB3 GLN 42 2HB GLN 42 -5.557 -2.920 -8.564 310 HG2 GLN 42 1HG GLN 42 -7.712 -2.533 -8.269 311 HG3 GLN 42 2HG GLN 42 -7.710 -1.671 -9.807 312 HE21 GLN 42 2HE2 GLN 42 -7.319 -3.796 -11.541 313 HE22 GLN 42 1HE2 GLN 42 -8.715 -4.813 -11.508 314 H LEU 43 H LEU 43 -4.310 -3.008 -12.614 315 HA LEU 43 HA LEU 43 -2.019 -4.256 -11.542 316 HB2 LEU 43 1HB LEU 43 -2.365 -3.322 -14.382 317 HB3 LEU 43 2HB LEU 43 -1.348 -4.638 -13.797 318 HG LEU 43 HG LEU 43 -4.334 -4.573 -14.110 319 HD11 LEU 43 1HD1 LEU 43 -2.135 -5.655 -15.573 320 HD12 LEU 43 2HD1 LEU 43 -3.855 -5.697 -15.958 321 HD13 LEU 43 3HD1 LEU 43 -3.140 -6.973 -14.973 322 HD21 LEU 43 3HD2 LEU 43 -4.350 -5.614 -12.088 323 HD22 LEU 43 1HD2 LEU 43 -2.684 -6.173 -12.236 324 HD23 LEU 43 2HD2 LEU 43 -3.973 -7.004 -13.107 325 H LYS 44 H LYS 44 -2.310 -1.284 -13.495 326 HA LYS 44 HA LYS 44 0.419 -0.541 -12.880 327 HB2 LYS 44 1HB LYS 44 0.221 1.067 -14.523 328 HB3 LYS 44 2HB LYS 44 -0.938 -0.130 -15.086 329 HG2 LYS 44 1HG LYS 44 -1.566 2.397 -13.573 330 HG3 LYS 44 2HG LYS 44 -1.867 2.086 -15.285 331 HD2 LYS 44 1HD LYS 44 -3.433 0.318 -14.709 332 HD3 LYS 44 2HD LYS 44 -3.095 0.552 -12.993 333 HE2 LYS 44 1HE LYS 44 -5.053 1.748 -13.272 334 HE3 LYS 44 2HE LYS 44 -3.825 3.001 -13.448 335 HZ1 LYS 44 3HZ LYS 44 -5.780 2.175 -15.304 336 HZ2 LYS 44 1HZ LYS 44 -4.245 1.928 -15.970 337 HZ3 LYS 44 2HZ LYS 44 -4.689 3.463 -15.417 338 H GLU 45 H GLU 45 -2.236 -0.481 -11.075 339 HA GLU 45 HA GLU 45 -2.311 2.208 -10.132 340 HB2 GLU 45 1HB GLU 45 -3.571 -0.361 -9.415 341 HB3 GLU 45 2HB GLU 45 -3.373 0.770 -8.083 342 HG2 GLU 45 1HG GLU 45 -4.720 1.433 -10.689 343 HG3 GLU 45 2HG GLU 45 -5.562 0.928 -9.226 344 H ILE 46 H ILE 46 -0.828 -0.782 -8.927 345 HA ILE 46 HA ILE 46 0.323 0.474 -6.629 346 HB ILE 46 HB ILE 46 1.092 -2.156 -7.898 347 HG12 ILE 46 1HG1 ILE 46 -0.398 -2.768 -5.691 348 HG13 ILE 46 2HG1 ILE 46 -1.227 -1.331 -6.279 349 HG21 ILE 46 1HG2 ILE 46 1.437 -1.242 -5.049 350 HG22 ILE 46 2HG2 ILE 46 2.057 -2.718 -5.788 351 HG23 ILE 46 3HG2 ILE 46 2.703 -1.150 -6.274 352 HD11 ILE 46 3HD1 ILE 46 -1.211 -4.033 -7.325 353 HD12 ILE 46 1HD1 ILE 46 -2.338 -2.708 -7.618 354 HD13 ILE 46 2HD1 ILE 46 -0.850 -2.825 -8.558 355 H PHE 47 H PHE 47 1.386 -0.227 -9.894 356 HA PHE 47 HA PHE 47 3.259 0.323 -11.061 357 HB2 PHE 47 1HB PHE 47 3.081 2.535 -9.039 358 HB3 PHE 47 2HB PHE 47 4.434 2.468 -10.163 359 HD1 PHE 47 HD2 PHE 47 3.313 1.663 -12.657 360 HD2 PHE 47 HD1 PHE 47 1.637 4.197 -9.676 361 HE1 PHE 47 HE2 PHE 47 1.940 2.769 -14.374 362 HE2 PHE 47 HE1 PHE 47 0.261 5.306 -11.388 363 HZ PHE 47 HZ PHE 47 0.413 4.594 -13.740 364 H ARG 48 H ARG 48 3.569 -1.690 -9.109 365 HA ARG 48 HA ARG 48 6.445 -1.505 -8.696 366 HB2 ARG 48 1HB ARG 48 4.482 -2.030 -6.460 367 HB3 ARG 48 2HB ARG 48 6.206 -2.361 -6.349 368 HG2 ARG 48 1HG ARG 48 6.610 0.063 -6.836 369 HG3 ARG 48 2HG ARG 48 4.870 0.312 -6.677 370 HD2 ARG 48 1HD ARG 48 6.268 -1.129 -4.490 371 HD3 ARG 48 2HD ARG 48 6.543 0.607 -4.633 372 HE ARG 48 HE ARG 48 3.767 -0.120 -4.700 373 HH11 ARG 48 1HH1 ARG 48 6.480 0.602 -2.641 374 HH12 ARG 48 2HH1 ARG 48 5.498 1.100 -1.302 375 HH21 ARG 48 1HH2 ARG 48 2.464 0.533 -2.945 376 HH22 ARG 48 2HH2 ARG 48 3.214 1.059 -1.476 377 H ILE 49 H ILE 49 4.247 -3.072 -10.191 378 HA ILE 49 HA ILE 49 5.420 -5.711 -9.660 379 HB ILE 49 HB ILE 49 3.288 -6.818 -9.927 380 HG12 ILE 49 1HG1 ILE 49 2.362 -4.979 -11.441 381 HG13 ILE 49 2HG1 ILE 49 1.233 -5.709 -10.304 382 HG21 ILE 49 1HG2 ILE 49 3.439 -4.664 -7.849 383 HG22 ILE 49 2HG2 ILE 49 2.081 -5.787 -7.903 384 HG23 ILE 49 3HG2 ILE 49 3.720 -6.396 -7.677 385 HD11 ILE 49 3HD1 ILE 49 0.791 -3.737 -9.416 386 HD12 ILE 49 1HD1 ILE 49 2.501 -3.447 -9.095 387 HD13 ILE 49 2HD1 ILE 49 1.807 -2.996 -10.652 388 H LEU 50 H LEU 50 5.120 -3.323 -11.798 389 HA LEU 50 HA LEU 50 5.128 -5.164 -14.097 390 HB2 LEU 50 1HB LEU 50 4.257 -2.316 -14.357 391 HB3 LEU 50 2HB LEU 50 3.922 -3.684 -15.417 392 HG LEU 50 HG LEU 50 2.744 -3.451 -12.658 393 HD11 LEU 50 1HD1 LEU 50 2.101 -1.479 -13.964 394 HD12 LEU 50 2HD1 LEU 50 0.734 -2.557 -13.685 395 HD13 LEU 50 3HD1 LEU 50 1.529 -2.530 -15.259 396 HD21 LEU 50 3HD2 LEU 50 1.081 -5.002 -13.602 397 HD22 LEU 50 1HD2 LEU 50 2.712 -5.672 -13.625 398 HD23 LEU 50 2HD2 LEU 50 1.997 -5.043 -15.110 399 H ASP 51 H ASP 51 5.885 -1.727 -13.519 400 HA ASP 51 HA ASP 51 8.608 -2.243 -14.507 401 HB2 ASP 51 1HB ASP 51 7.402 0.389 -15.152 402 HB3 ASP 51 2HB ASP 51 8.527 -0.595 -16.084 403 H ASN 52 H ASN 52 10.056 -1.697 -13.030 404 HA ASN 52 HA ASN 52 9.364 -0.152 -10.729 405 HB2 ASN 52 1HB ASN 52 10.953 -1.958 -10.498 406 HB3 ASN 52 2HB ASN 52 12.016 -1.232 -11.700 407 HD21 ASN 52 2HD2 ASN 52 13.731 -0.348 -10.831 408 HD22 ASN 52 1HD2 ASN 52 13.803 0.472 -9.312 409 H ASP 53 H ASP 53 11.751 0.367 -13.329 410 HA ASP 53 HA ASP 53 12.252 3.069 -12.571 411 HB2 ASP 53 1HB ASP 53 13.367 3.139 -14.883 412 HB3 ASP 53 2HB ASP 53 14.026 2.012 -13.700 413 H GLN 54 H GLN 54 9.878 1.520 -14.516 414 HA GLN 54 HA GLN 54 8.205 2.283 -15.864 415 HB2 GLN 54 1HB GLN 54 7.973 3.516 -13.497 416 HB3 GLN 54 2HB GLN 54 8.205 4.930 -14.517 417 HG2 GLN 54 1HG GLN 54 5.836 4.376 -14.138 418 HG3 GLN 54 2HG GLN 54 6.290 4.362 -15.842 419 HE21 GLN 54 2HE2 GLN 54 5.389 2.429 -13.095 420 HE22 GLN 54 1HE2 GLN 54 5.034 0.984 -13.973 421 H SER 55 H SER 55 10.921 2.797 -16.755 422 HA SER 55 HA SER 55 11.133 5.400 -17.857 423 HB2 SER 55 1HB SER 55 12.872 4.269 -19.358 424 HB3 SER 55 2HB SER 55 13.158 4.191 -17.619 425 HG SER 55 HG SER 55 12.555 2.085 -17.605 426 H GLY 56 H GLY 56 9.223 2.734 -18.693 427 HA2 GLY 56 1HA GLY 56 7.474 3.355 -20.373 428 HA3 GLY 56 2HA GLY 56 8.813 3.824 -21.410 429 H PHE 57 H PHE 57 9.632 1.122 -19.611 430 HA PHE 57 HA PHE 57 8.378 -0.954 -21.032 431 HB2 PHE 57 1HB PHE 57 10.120 -1.648 -22.559 432 HB3 PHE 57 2HB PHE 57 9.681 0.018 -22.919 433 HD1 PHE 57 HD1 PHE 57 11.149 1.840 -21.756 434 HD2 PHE 57 HD2 PHE 57 12.342 -2.204 -22.342 435 HE1 PHE 57 HE1 PHE 57 13.507 2.508 -21.543 436 HE2 PHE 57 HE2 PHE 57 14.702 -1.542 -22.129 437 HZ PHE 57 HZ PHE 57 15.287 0.816 -21.728 438 H ILE 58 H ILE 58 9.889 -3.031 -20.917 439 HA ILE 58 HA ILE 58 11.331 -2.968 -18.352 440 HB ILE 58 HB ILE 58 9.588 -5.271 -19.209 441 HG12 ILE 58 1HG1 ILE 58 8.900 -3.117 -17.200 442 HG13 ILE 58 2HG1 ILE 58 8.255 -3.184 -18.837 443 HG21 ILE 58 1HG2 ILE 58 11.407 -4.726 -16.993 444 HG22 ILE 58 2HG2 ILE 58 9.825 -5.313 -16.483 445 HG23 ILE 58 3HG2 ILE 58 10.796 -6.261 -17.608 446 HD11 ILE 58 3HD1 ILE 58 7.935 -5.514 -17.000 447 HD12 ILE 58 1HD1 ILE 58 6.862 -4.120 -16.878 448 HD13 ILE 58 2HD1 ILE 58 6.953 -5.033 -18.384 449 H GLU 59 H GLU 59 12.982 -4.540 -18.094 450 HA GLU 59 HA GLU 59 13.758 -6.024 -20.497 451 HB2 GLU 59 1HB GLU 59 14.921 -3.673 -20.135 452 HB3 GLU 59 2HB GLU 59 15.902 -4.588 -18.999 453 HG2 GLU 59 1HG GLU 59 16.801 -5.935 -20.661 454 HG3 GLU 59 2HG GLU 59 15.509 -5.557 -21.799 455 H GLU 60 H GLU 60 15.702 -7.478 -19.978 456 HA GLU 60 HA GLU 60 14.993 -9.255 -17.951 457 HB2 GLU 60 1HB GLU 60 17.575 -8.881 -19.462 458 HB3 GLU 60 2HB GLU 60 17.336 -10.185 -18.308 459 HG2 GLU 60 1HG GLU 60 16.886 -11.132 -20.392 460 HG3 GLU 60 2HG GLU 60 15.301 -10.826 -19.682 461 H ASP 61 H ASP 61 16.843 -6.360 -17.826 462 HA ASP 61 HA ASP 61 18.280 -6.970 -15.423 463 HB2 ASP 61 1HB ASP 61 19.021 -5.283 -17.126 464 HB3 ASP 61 2HB ASP 61 17.697 -4.247 -16.600 465 H GLU 62 H GLU 62 15.074 -6.422 -15.996 466 HA GLU 62 HA GLU 62 14.660 -5.410 -13.260 467 HB2 GLU 62 1HB GLU 62 13.369 -4.624 -15.827 468 HB3 GLU 62 2HB GLU 62 12.371 -4.650 -14.380 469 HG2 GLU 62 1HG GLU 62 13.941 -3.121 -13.283 470 HG3 GLU 62 2HG GLU 62 14.906 -3.073 -14.757 471 H LEU 63 H LEU 63 14.817 -8.166 -14.410 472 HA LEU 63 HA LEU 63 12.115 -9.088 -13.680 473 HB2 LEU 63 1HB LEU 63 14.139 -10.594 -15.322 474 HB3 LEU 63 2HB LEU 63 12.448 -11.012 -15.057 475 HG LEU 63 HG LEU 63 13.519 -8.729 -16.711 476 HD11 LEU 63 1HD1 LEU 63 11.672 -10.575 -17.954 477 HD12 LEU 63 2HD1 LEU 63 13.109 -11.396 -17.346 478 HD13 LEU 63 3HD1 LEU 63 13.273 -10.054 -18.478 479 HD21 LEU 63 3HD2 LEU 63 11.581 -7.686 -16.443 480 HD22 LEU 63 1HD2 LEU 63 11.040 -8.943 -15.331 481 HD23 LEU 63 2HD2 LEU 63 10.734 -9.105 -17.061 482 H LYS 64 H LYS 64 15.569 -9.885 -13.473 483 HA LYS 64 HA LYS 64 15.316 -12.029 -11.674 484 HB2 LYS 64 1HB LYS 64 17.674 -11.836 -11.331 485 HB3 LYS 64 2HB LYS 64 17.356 -11.457 -13.019 486 HG2 LYS 64 1HG LYS 64 17.588 -9.101 -12.583 487 HG3 LYS 64 2HG LYS 64 17.762 -9.405 -10.853 488 HD2 LYS 64 1HD LYS 64 19.965 -9.249 -11.392 489 HD3 LYS 64 2HD LYS 64 19.734 -10.964 -11.737 490 HE2 LYS 64 1HE LYS 64 19.271 -8.925 -13.875 491 HE3 LYS 64 2HE LYS 64 20.912 -9.438 -13.485 492 HZ1 LYS 64 3HZ LYS 64 18.918 -10.796 -14.986 493 HZ2 LYS 64 1HZ LYS 64 19.453 -11.757 -13.701 494 HZ3 LYS 64 2HZ LYS 64 20.564 -11.153 -14.825 495 H TYR 65 H TYR 65 14.703 -8.766 -11.216 496 HA TYR 65 HA TYR 65 15.101 -8.999 -8.305 497 HB2 TYR 65 1HB TYR 65 14.936 -6.490 -9.987 498 HB3 TYR 65 2HB TYR 65 15.172 -6.544 -8.244 499 HD1 TYR 65 HD2 TYR 65 17.165 -8.636 -7.904 500 HD2 TYR 65 HD1 TYR 65 16.885 -5.634 -10.906 501 HE1 TYR 65 HE2 TYR 65 19.600 -8.747 -8.234 502 HE2 TYR 65 HE1 TYR 65 19.318 -5.737 -11.245 503 HH TYR 65 HH TYR 65 21.398 -7.505 -9.111 504 H PHE 66 H PHE 66 12.892 -10.218 -9.238 505 HA PHE 66 HA PHE 66 10.663 -8.343 -8.993 506 HB2 PHE 66 1HB PHE 66 10.714 -10.088 -10.813 507 HB3 PHE 66 2HB PHE 66 10.535 -11.308 -9.556 508 HD1 PHE 66 HD1 PHE 66 8.902 -8.403 -11.149 509 HD2 PHE 66 HD2 PHE 66 8.432 -11.797 -8.624 510 HE1 PHE 66 HE1 PHE 66 6.458 -8.128 -11.240 511 HE2 PHE 66 HE2 PHE 66 5.988 -11.528 -8.711 512 HZ PHE 66 HZ PHE 66 4.998 -9.692 -10.021 513 H LEU 67 H LEU 67 11.418 -11.581 -7.694 514 HA LEU 67 HA LEU 67 9.601 -11.573 -5.609 515 HB2 LEU 67 1HB LEU 67 12.337 -12.821 -5.475 516 HB3 LEU 67 2HB LEU 67 10.879 -13.333 -4.627 517 HG LEU 67 HG LEU 67 11.457 -13.585 -7.576 518 HD11 LEU 67 1HD1 LEU 67 11.637 -15.363 -5.254 519 HD12 LEU 67 2HD1 LEU 67 12.433 -15.456 -6.824 520 HD13 LEU 67 3HD1 LEU 67 10.781 -16.043 -6.638 521 HD21 LEU 67 3HD2 LEU 67 9.261 -13.528 -7.911 522 HD22 LEU 67 1HD2 LEU 67 8.940 -13.416 -6.180 523 HD23 LEU 67 2HD2 LEU 67 9.136 -14.996 -6.940 524 H GLN 68 H GLN 68 12.580 -9.860 -5.914 525 HA GLN 68 HA GLN 68 13.336 -9.455 -3.285 526 HB2 GLN 68 1HB GLN 68 14.255 -8.561 -5.646 527 HB3 GLN 68 2HB GLN 68 13.456 -7.099 -5.084 528 HG2 GLN 68 1HG GLN 68 14.972 -6.727 -3.463 529 HG3 GLN 68 2HG GLN 68 15.192 -8.444 -3.124 530 HE21 GLN 68 2HE2 GLN 68 15.976 -9.458 -5.487 531 HE22 GLN 68 1HE2 GLN 68 17.476 -8.760 -5.985 532 H ARG 69 H ARG 69 10.574 -8.257 -4.969 533 HA ARG 69 HA ARG 69 10.041 -6.149 -3.055 534 HB2 ARG 69 1HB ARG 69 8.588 -7.194 -5.475 535 HB3 ARG 69 2HB ARG 69 7.843 -6.031 -4.386 536 HG2 ARG 69 1HG ARG 69 10.544 -5.430 -5.473 537 HG3 ARG 69 2HG ARG 69 9.142 -5.259 -6.531 538 HD2 ARG 69 1HD ARG 69 9.320 -3.146 -5.610 539 HD3 ARG 69 2HD ARG 69 8.135 -3.915 -4.555 540 HE ARG 69 HE ARG 69 9.638 -3.795 -2.827 541 HH11 ARG 69 1HH1 ARG 69 11.280 -3.175 -5.834 542 HH12 ARG 69 2HH1 ARG 69 12.758 -2.681 -5.076 543 HH21 ARG 69 1HH2 ARG 69 11.578 -3.146 -1.817 544 HH22 ARG 69 2HH2 ARG 69 12.926 -2.666 -2.791 545 H PHE 70 H PHE 70 7.918 -8.761 -4.212 546 HA PHE 70 HA PHE 70 6.219 -8.812 -2.040 547 HB2 PHE 70 1HB PHE 70 7.046 -11.052 -3.891 548 HB3 PHE 70 2HB PHE 70 5.733 -11.191 -2.727 549 HD1 PHE 70 HD1 PHE 70 3.890 -9.351 -2.886 550 HD2 PHE 70 HD2 PHE 70 6.586 -10.335 -6.029 551 HE1 PHE 70 HE1 PHE 70 2.334 -8.373 -4.523 552 HE2 PHE 70 HE2 PHE 70 5.036 -9.357 -7.670 553 HZ PHE 70 HZ PHE 70 2.907 -8.374 -6.918 554 H GLU 71 H GLU 71 8.888 -11.114 -2.609 555 HA GLU 71 HA GLU 71 8.801 -12.427 -0.184 556 HB2 GLU 71 1HB GLU 71 10.294 -12.783 -2.316 557 HB3 GLU 71 2HB GLU 71 11.454 -11.810 -1.423 558 HG2 GLU 71 1HG GLU 71 11.813 -13.419 0.148 559 HG3 GLU 71 2HG GLU 71 10.202 -14.111 -0.032 560 H SER 72 H SER 72 10.572 -12.314 1.533 561 HA SER 72 HA SER 72 10.382 -9.789 2.826 562 HB2 SER 72 1HB SER 72 10.444 -11.762 4.191 563 HB3 SER 72 2HB SER 72 11.969 -12.280 3.473 564 HG SER 72 HG SER 72 11.598 -9.929 5.023 565 H GLY 73 H GLY 73 12.847 -11.382 0.915 566 HA2 GLY 73 1HA GLY 73 14.184 -8.975 0.311 567 HA3 GLY 73 2HA GLY 73 15.059 -9.805 1.589 568 H ALA 74 H ALA 74 13.459 -10.717 -1.468 569 HA ALA 74 HA ALA 74 15.024 -12.925 -2.051 570 HB1 ALA 74 1HB ALA 74 13.978 -12.966 -4.067 571 HB2 ALA 74 2HB ALA 74 12.916 -11.825 -3.240 572 HB3 ALA 74 3HB ALA 74 14.170 -11.232 -4.329 573 H ARG 75 H ARG 75 16.481 -12.999 -4.102 574 HA ARG 75 HA ARG 75 18.413 -10.779 -3.985 575 HB2 ARG 75 1HB ARG 75 20.015 -12.873 -4.593 576 HB3 ARG 75 2HB ARG 75 19.757 -12.280 -2.958 577 HG2 ARG 75 1HG ARG 75 18.412 -14.044 -2.379 578 HG3 ARG 75 2HG ARG 75 17.920 -14.354 -4.045 579 HD2 ARG 75 1HD ARG 75 19.997 -15.369 -4.564 580 HD3 ARG 75 2HD ARG 75 20.728 -14.797 -3.065 581 HE ARG 75 HE ARG 75 19.857 -16.619 -2.001 582 HH11 ARG 75 1HH1 ARG 75 18.154 -16.151 -5.001 583 HH12 ARG 75 2HH1 ARG 75 17.248 -17.622 -4.867 584 HH21 ARG 75 1HH2 ARG 75 18.670 -18.557 -1.812 585 HH22 ARG 75 2HH2 ARG 75 17.541 -18.989 -3.052 586 H VAL 76 H VAL 76 18.101 -13.780 -5.880 587 HA VAL 76 HA VAL 76 17.678 -12.220 -8.308 588 HB VAL 76 HB VAL 76 19.832 -14.306 -8.354 589 HG11 VAL 76 1HG1 VAL 76 18.964 -13.618 -10.487 590 HG12 VAL 76 2HG1 VAL 76 19.174 -11.916 -10.070 591 HG13 VAL 76 3HG1 VAL 76 20.585 -12.952 -10.293 592 HG21 VAL 76 3HG2 VAL 76 20.630 -12.816 -6.674 593 HG22 VAL 76 1HG2 VAL 76 21.476 -12.418 -8.169 594 HG23 VAL 76 2HG2 VAL 76 20.146 -11.403 -7.612 595 H LEU 77 H LEU 77 16.963 -13.501 -10.113 596 HA LEU 77 HA LEU 77 15.682 -16.002 -9.251 597 HB2 LEU 77 1HB LEU 77 14.967 -13.936 -11.299 598 HB3 LEU 77 2HB LEU 77 14.292 -15.562 -11.380 599 HG LEU 77 HG LEU 77 13.982 -14.306 -8.760 600 HD11 LEU 77 1HD1 LEU 77 11.961 -13.125 -10.367 601 HD12 LEU 77 2HD1 LEU 77 13.532 -12.663 -11.022 602 HD13 LEU 77 3HD1 LEU 77 13.150 -12.336 -9.331 603 HD21 LEU 77 3HD2 LEU 77 12.912 -16.418 -9.642 604 HD22 LEU 77 1HD2 LEU 77 11.903 -15.380 -10.650 605 HD23 LEU 77 2HD2 LEU 77 11.820 -15.252 -8.893 606 H THR 78 H THR 78 15.221 -17.476 -11.261 607 HA THR 78 HA THR 78 17.784 -18.290 -12.248 608 HB THR 78 HB THR 78 16.527 -20.088 -13.409 609 HG1 THR 78 HG1 THR 78 14.304 -20.170 -13.223 610 HG21 THR 78 3HG2 THR 78 15.915 -21.284 -11.450 611 HG22 THR 78 1HG2 THR 78 15.568 -19.798 -10.567 612 HG23 THR 78 2HG2 THR 78 17.232 -20.209 -10.981 613 H ALA 79 H ALA 79 17.735 -19.066 -14.699 614 HA ALA 79 HA ALA 79 17.526 -16.631 -16.243 615 HB1 ALA 79 1HB ALA 79 19.342 -18.581 -16.290 616 HB2 ALA 79 2HB ALA 79 18.270 -19.177 -17.558 617 HB3 ALA 79 3HB ALA 79 18.992 -17.573 -17.695 618 H SER 80 H SER 80 15.397 -19.028 -15.459 619 HA SER 80 HA SER 80 14.008 -18.946 -18.045 620 HB2 SER 80 1HB SER 80 14.041 -20.868 -15.766 621 HB3 SER 80 2HB SER 80 12.550 -20.725 -16.698 622 HG SER 80 HG SER 80 13.561 -21.464 -18.465 623 H GLU 81 H GLU 81 13.322 -18.668 -14.559 624 HA GLU 81 HA GLU 81 10.704 -17.871 -14.633 625 HB2 GLU 81 1HB GLU 81 12.910 -16.907 -12.810 626 HB3 GLU 81 2HB GLU 81 11.205 -16.580 -12.537 627 HG2 GLU 81 1HG GLU 81 10.736 -18.915 -12.277 628 HG3 GLU 81 2HG GLU 81 12.384 -19.339 -12.736 629 H THR 82 H THR 82 13.568 -15.801 -14.970 630 HA THR 82 HA THR 82 12.107 -13.385 -15.278 631 HB THR 82 HB THR 82 14.223 -12.415 -16.077 632 HG1 THR 82 HG1 THR 82 16.066 -13.996 -15.980 633 HG21 THR 82 3HG2 THR 82 15.174 -14.126 -13.865 634 HG22 THR 82 1HG2 THR 82 13.673 -13.248 -13.572 635 HG23 THR 82 2HG2 THR 82 15.140 -12.368 -14.005 636 H LYS 83 H LYS 83 13.660 -15.580 -17.602 637 HA LYS 83 HA LYS 83 13.219 -14.216 -19.948 638 HB2 LYS 83 1HB LYS 83 14.494 -16.249 -19.953 639 HB3 LYS 83 2HB LYS 83 13.110 -17.184 -19.401 640 HG2 LYS 83 1HG LYS 83 13.499 -17.574 -21.750 641 HG3 LYS 83 2HG LYS 83 11.968 -16.726 -21.524 642 HD2 LYS 83 1HD LYS 83 13.091 -15.707 -23.367 643 HD3 LYS 83 2HD LYS 83 13.182 -14.588 -22.005 644 HE2 LYS 83 1HE LYS 83 15.316 -14.763 -23.217 645 HE3 LYS 83 2HE LYS 83 15.453 -15.290 -21.540 646 HZ1 LYS 83 3HZ LYS 83 14.793 -17.439 -23.309 647 HZ2 LYS 83 1HZ LYS 83 16.044 -17.322 -22.176 648 HZ3 LYS 83 2HZ LYS 83 16.252 -16.695 -23.733 649 H THR 84 H THR 84 10.969 -16.333 -18.213 650 HA THR 84 HA THR 84 8.864 -15.816 -20.146 651 HB THR 84 HB THR 84 9.077 -18.069 -19.175 652 HG1 THR 84 HG1 THR 84 6.993 -17.227 -19.823 653 HG21 THR 84 3HG2 THR 84 9.807 -17.903 -17.000 654 HG22 THR 84 1HG2 THR 84 8.085 -18.178 -16.738 655 HG23 THR 84 2HG2 THR 84 8.743 -16.546 -16.632 656 H PHE 85 H PHE 85 9.753 -13.490 -18.885 657 HA PHE 85 HA PHE 85 7.447 -12.819 -17.177 658 HB2 PHE 85 1HB PHE 85 9.703 -12.777 -16.036 659 HB3 PHE 85 2HB PHE 85 10.139 -11.450 -17.108 660 HD1 PHE 85 HD1 PHE 85 8.637 -9.372 -17.067 661 HD2 PHE 85 HD2 PHE 85 8.613 -12.359 -14.035 662 HE1 PHE 85 HE1 PHE 85 7.612 -7.772 -15.504 663 HE2 PHE 85 HE2 PHE 85 7.588 -10.764 -12.467 664 HZ PHE 85 HZ PHE 85 7.085 -8.467 -13.201 665 H LEU 86 H LEU 86 9.801 -11.462 -19.473 666 HA LEU 86 HA LEU 86 7.715 -9.575 -20.352 667 HB2 LEU 86 1HB LEU 86 9.509 -8.061 -21.022 668 HB3 LEU 86 2HB LEU 86 9.561 -8.419 -19.297 669 HG LEU 86 HG LEU 86 11.363 -10.141 -19.905 670 HD11 LEU 86 1HD1 LEU 86 10.752 -9.083 -22.501 671 HD12 LEU 86 2HD1 LEU 86 11.812 -10.420 -22.057 672 HD13 LEU 86 3HD1 LEU 86 12.440 -8.773 -22.097 673 HD21 LEU 86 3HD2 LEU 86 12.037 -7.236 -20.337 674 HD22 LEU 86 1HD2 LEU 86 13.090 -8.504 -19.709 675 HD23 LEU 86 2HD2 LEU 86 11.713 -7.949 -18.757 676 H ALA 87 H ALA 87 9.945 -12.037 -21.253 677 HA ALA 87 HA ALA 87 9.651 -11.492 -24.104 678 HB1 ALA 87 1HB ALA 87 11.480 -12.792 -24.453 679 HB2 ALA 87 2HB ALA 87 11.787 -12.354 -22.772 680 HB3 ALA 87 3HB ALA 87 11.067 -13.916 -23.158 681 H ALA 88 H ALA 88 7.640 -12.720 -21.990 682 HA ALA 88 HA ALA 88 6.904 -15.113 -23.518 683 HB1 ALA 88 1HB ALA 88 5.785 -14.168 -20.884 684 HB2 ALA 88 2HB ALA 88 5.532 -15.737 -21.649 685 HB3 ALA 88 3HB ALA 88 7.132 -15.295 -21.052 686 H ALA 89 H ALA 89 5.671 -11.983 -22.464 687 HA ALA 89 HA ALA 89 3.029 -12.152 -23.225 688 HB1 ALA 89 1HB ALA 89 3.089 -10.049 -22.531 689 HB2 ALA 89 2HB ALA 89 4.852 -10.082 -22.558 690 HB3 ALA 89 3HB ALA 89 3.957 -9.584 -23.994 691 H ASP 90 H ASP 90 5.449 -10.518 -25.265 692 HA ASP 90 HA ASP 90 4.943 -12.017 -27.592 693 HB2 ASP 90 1HB ASP 90 2.762 -10.570 -27.137 694 HB3 ASP 90 2HB ASP 90 3.722 -9.314 -27.913 695 H HIS 91 H HIS 91 5.595 -10.558 -29.623 696 HA HIS 91 HA HIS 91 7.892 -8.904 -28.810 697 HB2 HIS 91 1HB HIS 91 8.253 -11.343 -29.821 698 HB3 HIS 91 2HB HIS 91 8.050 -10.473 -31.338 699 HD1 HIS 91 HD1 HIS 91 10.419 -10.974 -28.524 700 HD2 HIS 91 HD2 HIS 91 10.104 -8.615 -31.930 701 HE1 HIS 91 HE1 HIS 91 12.703 -9.977 -28.865 702 H ASP 92 H ASP 92 5.395 -7.834 -29.386 703 HA ASP 92 HA ASP 92 4.850 -7.111 -31.993 704 HB2 ASP 92 1HB ASP 92 3.244 -6.504 -30.387 705 HB3 ASP 92 2HB ASP 92 4.432 -5.680 -29.381 706 H GLY 93 H GLY 93 7.333 -5.918 -29.849 707 HA2 GLY 93 1HA GLY 93 8.223 -4.091 -31.996 708 HA3 GLY 93 2HA GLY 93 8.414 -3.725 -30.288 709 H ASP 94 H ASP 94 9.902 -5.009 -29.041 710 HA ASP 94 HA ASP 94 11.827 -6.571 -30.600 711 HB2 ASP 94 1HB ASP 94 12.534 -4.107 -30.319 712 HB3 ASP 94 2HB ASP 94 12.792 -4.515 -28.625 713 H GLY 95 H GLY 95 9.712 -6.896 -28.387 714 HA2 GLY 95 1HA GLY 95 9.572 -8.676 -26.859 715 HA3 GLY 95 2HA GLY 95 11.328 -8.734 -26.799 716 H LYS 96 H LYS 96 9.877 -5.640 -26.478 717 HA LYS 96 HA LYS 96 10.550 -5.654 -23.616 718 HB2 LYS 96 1HB LYS 96 10.689 -3.193 -23.837 719 HB3 LYS 96 2HB LYS 96 11.814 -4.032 -24.897 720 HG2 LYS 96 1HG LYS 96 10.162 -3.737 -26.748 721 HG3 LYS 96 2HG LYS 96 9.217 -2.719 -25.659 722 HD2 LYS 96 1HD LYS 96 10.774 -1.027 -25.674 723 HD3 LYS 96 2HD LYS 96 12.112 -2.116 -26.046 724 HE2 LYS 96 1HE LYS 96 11.137 -2.412 -28.324 725 HE3 LYS 96 2HE LYS 96 9.953 -1.169 -27.925 726 HZ1 LYS 96 3HZ LYS 96 12.857 -0.660 -27.714 727 HZ2 LYS 96 1HZ LYS 96 11.595 0.462 -27.820 728 HZ3 LYS 96 2HZ LYS 96 12.028 -0.454 -29.174 729 H ILE 97 H ILE 97 8.926 -5.688 -22.222 730 HA ILE 97 HA ILE 97 6.224 -5.121 -23.116 731 HB ILE 97 HB ILE 97 7.160 -6.000 -20.383 732 HG12 ILE 97 1HG1 ILE 97 7.800 -7.663 -22.028 733 HG13 ILE 97 2HG1 ILE 97 6.422 -8.260 -21.110 734 HG21 ILE 97 1HG2 ILE 97 4.803 -6.764 -20.158 735 HG22 ILE 97 2HG2 ILE 97 4.978 -5.015 -20.283 736 HG23 ILE 97 3HG2 ILE 97 4.440 -5.948 -21.679 737 HD11 ILE 97 3HD1 ILE 97 6.189 -8.774 -23.464 738 HD12 ILE 97 1HD1 ILE 97 4.938 -7.643 -22.949 739 HD13 ILE 97 2HD1 ILE 97 6.327 -7.064 -23.868 740 H GLY 98 H GLY 98 4.852 -3.569 -22.214 741 HA2 GLY 98 1HA GLY 98 6.223 -1.458 -20.663 742 HA3 GLY 98 2HA GLY 98 5.103 -1.096 -21.968 743 H ALA 99 H ALA 99 2.892 -1.284 -21.630 744 HA ALA 99 HA ALA 99 1.902 -2.228 -19.076 745 HB1 ALA 99 1HB ALA 99 2.288 0.610 -19.644 746 HB2 ALA 99 2HB ALA 99 0.647 0.205 -19.136 747 HB3 ALA 99 3HB ALA 99 2.018 -0.215 -18.108 748 H GLU 100 H GLU 100 1.614 -2.648 -22.063 749 HA GLU 100 HA GLU 100 -1.320 -2.392 -22.173 750 HB2 GLU 100 1HB GLU 100 -0.990 -2.417 -24.699 751 HB3 GLU 100 2HB GLU 100 -0.518 -0.949 -23.855 752 HG2 GLU 100 1HG GLU 100 1.720 -1.301 -24.199 753 HG3 GLU 100 2HG GLU 100 1.532 -3.046 -24.357 754 H GLU 101 H GLU 101 1.481 -4.400 -22.670 755 HA GLU 101 HA GLU 101 -0.149 -6.617 -23.648 756 HB2 GLU 101 1HB GLU 101 2.837 -6.450 -23.203 757 HB3 GLU 101 2HB GLU 101 1.985 -7.781 -23.973 758 HG2 GLU 101 1HG GLU 101 1.837 -4.988 -25.047 759 HG3 GLU 101 2HG GLU 101 3.154 -6.081 -25.471 760 H PHE 102 H PHE 102 2.002 -5.830 -20.937 761 HA PHE 102 HA PHE 102 1.942 -8.199 -19.543 762 HB2 PHE 102 1HB PHE 102 3.232 -6.102 -18.960 763 HB3 PHE 102 2HB PHE 102 1.754 -5.487 -18.228 764 HD1 PHE 102 HD2 PHE 102 0.654 -7.036 -16.440 765 HD2 PHE 102 HD1 PHE 102 4.722 -7.289 -17.669 766 HE1 PHE 102 HE2 PHE 102 1.213 -8.190 -14.340 767 HE2 PHE 102 HE1 PHE 102 5.287 -8.445 -15.571 768 HZ PHE 102 HZ PHE 102 3.532 -8.896 -13.903 769 H GLN 103 H GLN 103 -0.399 -5.532 -19.345 770 HA GLN 103 HA GLN 103 -2.064 -6.475 -17.377 771 HB2 GLN 103 1HB GLN 103 -2.557 -4.851 -19.844 772 HB3 GLN 103 2HB GLN 103 -3.918 -5.350 -18.848 773 HG2 GLN 103 1HG GLN 103 -2.912 -3.058 -18.407 774 HG3 GLN 103 2HG GLN 103 -3.193 -4.105 -17.018 775 HE21 GLN 103 2HE2 GLN 103 -0.645 -3.486 -19.414 776 HE22 GLN 103 1HE2 GLN 103 0.658 -3.489 -18.279 777 H GLU 104 H GLU 104 -2.386 -7.121 -20.869 778 HA GLU 104 HA GLU 104 -4.563 -8.835 -20.748 779 HB2 GLU 104 1HB GLU 104 -2.260 -8.595 -22.658 780 HB3 GLU 104 2HB GLU 104 -3.456 -9.867 -22.864 781 HG2 GLU 104 1HG GLU 104 -5.157 -7.896 -22.695 782 HG3 GLU 104 2HG GLU 104 -3.760 -6.918 -23.141 783 H MET 105 H MET 105 -1.103 -9.637 -20.600 784 HA MET 105 HA MET 105 -1.240 -12.380 -20.487 785 HB2 MET 105 1HB MET 105 0.911 -11.454 -20.584 786 HB3 MET 105 2HB MET 105 0.626 -10.412 -19.197 787 HG2 MET 105 1HG MET 105 1.151 -12.018 -17.704 788 HG3 MET 105 2HG MET 105 0.484 -13.312 -18.697 789 HE1 MET 105 3HE MET 105 3.704 -11.012 -18.087 790 HE2 MET 105 1HE MET 105 4.558 -11.350 -19.593 791 HE3 MET 105 2HE MET 105 2.996 -10.532 -19.630 792 H VAL 106 H VAL 106 -2.132 -10.066 -18.054 793 HA VAL 106 HA VAL 106 -2.289 -12.045 -15.943 794 HB VAL 106 HB VAL 106 -3.295 -9.198 -15.916 795 HG11 VAL 106 1HG1 VAL 106 -2.433 -10.781 -13.529 796 HG12 VAL 106 2HG1 VAL 106 -3.517 -9.391 -13.619 797 HG13 VAL 106 3HG1 VAL 106 -4.059 -10.972 -14.183 798 HG21 VAL 106 3HG2 VAL 106 -1.043 -8.878 -16.293 799 HG22 VAL 106 1HG2 VAL 106 -1.096 -8.941 -14.531 800 HG23 VAL 106 2HG2 VAL 106 -0.582 -10.356 -15.449 801 H GLN 107 H GLN 107 -4.572 -10.017 -17.772 802 HA GLN 107 HA GLN 107 -6.943 -10.851 -16.648 803 HB2 GLN 107 1HB GLN 107 -6.434 -10.238 -19.564 804 HB3 GLN 107 2HB GLN 107 -8.010 -10.256 -18.783 805 HG2 GLN 107 1HG GLN 107 -5.738 -8.384 -18.154 806 HG3 GLN 107 2HG GLN 107 -7.198 -7.990 -19.061 807 HE21 GLN 107 2HE2 GLN 107 -5.768 -7.697 -16.152 808 HE22 GLN 107 1HE2 GLN 107 -7.161 -7.539 -15.142 809 H SER 108 H SER 108 -4.992 -12.453 -19.104 810 HA SER 108 HA SER 108 -6.900 -14.512 -19.639 811 HB2 SER 108 1HB SER 108 -4.792 -15.639 -20.657 812 HB3 SER 108 2HB SER 108 -5.398 -14.159 -21.400 813 HG SER 108 HG SER 108 -2.990 -14.549 -20.587 Start of MODEL 7 1 H1 SER 1 H SER 1 0.735 0.955 -3.153 2 HA SER 1 HA SER 1 3.582 0.647 -2.563 3 HB2 SER 1 1HB SER 1 1.409 0.861 -0.560 4 HB3 SER 1 2HB SER 1 2.574 -0.437 -0.300 5 HG SER 1 HG SER 1 3.522 2.125 -0.916 6 H LEU 2 H LEU 2 3.781 -1.693 -1.440 7 HA LEU 2 HA LEU 2 2.848 -3.520 -3.455 8 HB2 LEU 2 1HB LEU 2 5.117 -3.577 -2.371 9 HB3 LEU 2 2HB LEU 2 4.324 -4.173 -0.914 10 HG LEU 2 HG LEU 2 3.438 -5.982 -2.705 11 HD11 LEU 2 1HD1 LEU 2 5.808 -4.712 -3.881 12 HD12 LEU 2 2HD1 LEU 2 4.531 -5.662 -4.639 13 HD13 LEU 2 3HD1 LEU 2 5.860 -6.473 -3.811 14 HD21 LEU 2 3HD2 LEU 2 4.926 -6.032 -0.475 15 HD22 LEU 2 1HD2 LEU 2 6.145 -6.518 -1.653 16 HD23 LEU 2 2HD2 LEU 2 4.656 -7.450 -1.490 17 H THR 3 H THR 3 1.544 -5.347 -3.138 18 HA THR 3 HA THR 3 -0.346 -6.399 -2.416 19 HB THR 3 HB THR 3 -0.293 -7.285 -0.262 20 HG1 THR 3 HG1 THR 3 1.356 -5.203 0.721 21 HG21 THR 3 3HG2 THR 3 2.573 -6.608 -0.167 22 HG22 THR 3 1HG2 THR 3 2.005 -7.285 -1.693 23 HG23 THR 3 2HG2 THR 3 1.780 -8.183 -0.192 24 H ASP 4 H ASP 4 -0.514 -3.524 -2.820 25 HA ASP 4 HA ASP 4 -2.170 -2.441 -0.737 26 HB2 ASP 4 1HB ASP 4 -0.659 -1.131 -2.343 27 HB3 ASP 4 2HB ASP 4 -1.934 -1.355 -3.538 28 H ILE 5 H ILE 5 -2.870 -2.994 -4.192 29 HA ILE 5 HA ILE 5 -5.675 -2.929 -3.834 30 HB ILE 5 HB ILE 5 -4.226 -2.639 -6.002 31 HG12 ILE 5 1HG1 ILE 5 -6.422 -3.820 -7.169 32 HG13 ILE 5 2HG1 ILE 5 -6.996 -3.486 -5.538 33 HG21 ILE 5 1HG2 ILE 5 -3.428 -5.056 -5.763 34 HG22 ILE 5 2HG2 ILE 5 -5.021 -5.509 -6.366 35 HG23 ILE 5 3HG2 ILE 5 -3.949 -4.525 -7.362 36 HD11 ILE 5 3HD1 ILE 5 -7.572 -1.614 -6.826 37 HD12 ILE 5 1HD1 ILE 5 -6.167 -1.124 -5.881 38 HD13 ILE 5 2HD1 ILE 5 -5.982 -1.544 -7.584 39 H LEU 6 H LEU 6 -3.313 -5.448 -3.558 40 HA LEU 6 HA LEU 6 -5.471 -7.426 -3.219 41 HB2 LEU 6 1HB LEU 6 -3.147 -7.509 -4.814 42 HB3 LEU 6 2HB LEU 6 -2.896 -8.646 -3.492 43 HG LEU 6 HG LEU 6 -5.229 -9.560 -4.163 44 HD11 LEU 6 1HD1 LEU 6 -4.658 -8.857 -6.931 45 HD12 LEU 6 2HD1 LEU 6 -5.126 -7.474 -5.943 46 HD13 LEU 6 3HD1 LEU 6 -6.190 -8.876 -6.056 47 HD21 LEU 6 3HD2 LEU 6 -4.031 -11.265 -4.937 48 HD22 LEU 6 1HD2 LEU 6 -2.607 -10.231 -4.817 49 HD23 LEU 6 2HD2 LEU 6 -3.495 -10.336 -6.337 50 H SER 7 H SER 7 -4.132 -9.417 -1.940 51 HA SER 7 HA SER 7 -3.454 -8.160 0.634 52 HB2 SER 7 1HB SER 7 -5.502 -9.769 0.322 53 HB3 SER 7 2HB SER 7 -4.275 -11.034 0.389 54 HG SER 7 HG SER 7 -4.421 -10.807 2.466 55 HA PRO 8 HA PRO 8 0.642 -9.748 0.257 56 HB2 PRO 8 1HB PRO 8 1.360 -9.603 2.871 57 HB3 PRO 8 2HB PRO 8 1.223 -8.180 1.832 58 HG2 PRO 8 1HG PRO 8 -0.729 -9.265 3.824 59 HG3 PRO 8 2HG PRO 8 -0.248 -7.584 3.532 60 HD2 PRO 8 1HD PRO 8 -2.552 -8.628 2.568 61 HD3 PRO 8 2HD PRO 8 -1.641 -7.370 1.708 62 H SER 9 H SER 9 -1.858 -11.262 2.030 63 HA SER 9 HA SER 9 -0.232 -13.548 2.804 64 HB2 SER 9 1HB SER 9 -2.481 -14.404 3.670 65 HB3 SER 9 2HB SER 9 -1.838 -12.957 4.446 66 HG SER 9 HG SER 9 -4.109 -12.867 3.832 67 H ASP 10 H ASP 10 -1.100 -12.672 -0.046 68 HA ASP 10 HA ASP 10 -1.980 -15.355 -0.886 69 HB2 ASP 10 1HB ASP 10 -2.687 -12.811 -2.348 70 HB3 ASP 10 2HB ASP 10 -3.342 -14.425 -2.607 71 H ILE 11 H ILE 11 -0.046 -12.511 -1.577 72 HA ILE 11 HA ILE 11 1.031 -13.406 -4.039 73 HB ILE 11 HB ILE 11 2.230 -11.474 -2.050 74 HG12 ILE 11 1HG1 ILE 11 0.879 -10.588 -4.550 75 HG13 ILE 11 2HG1 ILE 11 -0.145 -11.132 -3.226 76 HG21 ILE 11 1HG2 ILE 11 3.160 -12.518 -4.588 77 HG22 ILE 11 2HG2 ILE 11 3.019 -10.761 -4.604 78 HG23 ILE 11 3HG2 ILE 11 4.013 -11.554 -3.383 79 HD11 ILE 11 3HD1 ILE 11 1.045 -9.494 -1.758 80 HD12 ILE 11 1HD1 ILE 11 1.828 -8.868 -3.209 81 HD13 ILE 11 2HD1 ILE 11 0.074 -8.782 -3.046 82 H ALA 12 H ALA 12 1.676 -14.230 -0.768 83 HA ALA 12 HA ALA 12 4.355 -15.194 -1.225 84 HB1 ALA 12 1HB ALA 12 4.501 -15.335 1.005 85 HB2 ALA 12 2HB ALA 12 2.984 -14.434 1.009 86 HB3 ALA 12 3HB ALA 12 2.966 -16.192 1.149 87 H ALA 13 H ALA 13 1.126 -16.479 -1.329 88 HA ALA 13 HA ALA 13 1.646 -19.208 -1.045 89 HB1 ALA 13 1HB ALA 13 -0.493 -17.669 -2.468 90 HB2 ALA 13 2HB ALA 13 -0.436 -19.430 -2.549 91 HB3 ALA 13 3HB ALA 13 -0.603 -18.624 -0.990 92 H ALA 14 H ALA 14 2.388 -17.048 -3.616 93 HA ALA 14 HA ALA 14 2.889 -19.265 -5.471 94 HB1 ALA 14 1HB ALA 14 1.716 -16.866 -5.935 95 HB2 ALA 14 2HB ALA 14 3.381 -16.527 -6.408 96 HB3 ALA 14 3HB ALA 14 2.500 -17.850 -7.172 97 H LEU 15 H LEU 15 4.481 -16.749 -3.638 98 HA LEU 15 HA LEU 15 7.021 -16.961 -4.893 99 HB2 LEU 15 1HB LEU 15 6.136 -15.892 -2.226 100 HB3 LEU 15 2HB LEU 15 7.818 -15.860 -2.752 101 HG LEU 15 HG LEU 15 5.520 -14.462 -4.120 102 HD11 LEU 15 1HD1 LEU 15 7.690 -12.851 -3.046 103 HD12 LEU 15 2HD1 LEU 15 6.804 -13.731 -1.801 104 HD13 LEU 15 3HD1 LEU 15 5.944 -12.649 -2.896 105 HD21 LEU 15 3HD2 LEU 15 7.223 -15.135 -5.707 106 HD22 LEU 15 1HD2 LEU 15 8.483 -14.445 -4.683 107 HD23 LEU 15 2HD2 LEU 15 7.293 -13.391 -5.448 108 H ARG 16 H ARG 16 5.341 -19.010 -2.801 109 HA ARG 16 HA ARG 16 7.822 -20.296 -1.882 110 HB2 ARG 16 1HB ARG 16 6.255 -19.646 -0.102 111 HB3 ARG 16 2HB ARG 16 4.996 -20.614 -0.856 112 HG2 ARG 16 1HG ARG 16 6.620 -22.583 -0.564 113 HG3 ARG 16 2HG ARG 16 7.467 -21.522 0.564 114 HD2 ARG 16 1HD ARG 16 5.579 -21.367 1.981 115 HD3 ARG 16 2HD ARG 16 4.521 -22.087 0.768 116 HE ARG 16 HE ARG 16 6.178 -23.469 2.645 117 HH11 ARG 16 1HH1 ARG 16 4.730 -23.655 -0.516 118 HH12 ARG 16 2HH1 ARG 16 4.713 -25.387 -0.549 119 HH21 ARG 16 1HH2 ARG 16 6.160 -25.750 2.614 120 HH22 ARG 16 2HH2 ARG 16 5.526 -26.578 1.232 121 H ASP 17 H ASP 17 4.700 -20.921 -3.420 122 HA ASP 17 HA ASP 17 5.231 -23.702 -3.858 123 HB2 ASP 17 1HB ASP 17 2.943 -22.438 -3.729 124 HB3 ASP 17 2HB ASP 17 3.217 -22.149 -5.445 125 H CYS 18 H CYS 18 6.429 -20.936 -5.261 126 HA CYS 18 HA CYS 18 7.114 -22.396 -7.724 127 HB2 CYS 18 1HB CYS 18 6.716 -19.406 -7.536 128 HB3 CYS 18 2HB CYS 18 7.009 -20.350 -8.992 129 HG CYS 18 HG CYS 18 4.531 -21.708 -8.817 130 H GLN 19 H GLN 19 8.668 -22.525 -5.434 131 HA GLN 19 HA GLN 19 10.797 -20.579 -5.624 132 HB2 GLN 19 1HB GLN 19 10.137 -22.863 -3.836 133 HB3 GLN 19 2HB GLN 19 11.827 -22.395 -3.962 134 HG2 GLN 19 1HG GLN 19 11.093 -20.047 -3.414 135 HG3 GLN 19 2HG GLN 19 9.514 -20.728 -3.023 136 HE21 GLN 19 2HE2 GLN 19 9.722 -20.057 -0.874 137 HE22 GLN 19 1HE2 GLN 19 10.751 -20.883 0.240 138 H ALA 20 H ALA 20 10.072 -23.707 -6.886 139 HA ALA 20 HA ALA 20 12.694 -24.608 -7.423 140 HB1 ALA 20 1HB ALA 20 11.682 -26.407 -8.292 141 HB2 ALA 20 2HB ALA 20 10.201 -25.686 -7.662 142 HB3 ALA 20 3HB ALA 20 10.653 -25.439 -9.348 143 HA PRO 21 HA PRO 21 13.990 -22.318 -10.934 144 HB2 PRO 21 1HB PRO 21 15.209 -24.214 -12.447 145 HB3 PRO 21 2HB PRO 21 15.899 -23.595 -10.942 146 HG2 PRO 21 1HG PRO 21 14.365 -26.120 -11.426 147 HG3 PRO 21 2HG PRO 21 15.825 -25.867 -10.451 148 HD2 PRO 21 1HD PRO 21 13.355 -26.046 -9.356 149 HD3 PRO 21 2HD PRO 21 14.637 -25.034 -8.660 150 H ASP 22 H ASP 22 13.155 -21.605 -12.815 151 HA ASP 22 HA ASP 22 11.713 -21.408 -14.568 152 HB2 ASP 22 1HB ASP 22 13.386 -23.194 -15.355 153 HB3 ASP 22 2HB ASP 22 12.105 -24.358 -15.031 154 H SER 23 H SER 23 10.643 -22.208 -11.929 155 HA SER 23 HA SER 23 8.203 -23.613 -12.794 156 HB2 SER 23 1HB SER 23 9.632 -23.479 -10.155 157 HB3 SER 23 2HB SER 23 7.912 -23.862 -10.215 158 HG SER 23 HG SER 23 8.391 -25.638 -11.509 159 H PHE 24 H PHE 24 9.472 -20.639 -11.727 160 HA PHE 24 HA PHE 24 6.853 -19.642 -10.882 161 HB2 PHE 24 1HB PHE 24 8.717 -19.090 -9.418 162 HB3 PHE 24 2HB PHE 24 9.596 -18.371 -10.763 163 HD1 PHE 24 HD1 PHE 24 6.185 -18.060 -9.271 164 HD2 PHE 24 HD2 PHE 24 9.655 -16.088 -10.748 165 HE1 PHE 24 HE1 PHE 24 5.156 -15.881 -8.770 166 HE2 PHE 24 HE2 PHE 24 8.633 -13.906 -10.249 167 HZ PHE 24 HZ PHE 24 6.380 -13.801 -9.259 168 H SER 25 H SER 25 5.914 -17.785 -11.820 169 HA SER 25 HA SER 25 6.996 -16.440 -14.061 170 HB2 SER 25 1HB SER 25 5.252 -18.810 -14.572 171 HB3 SER 25 2HB SER 25 5.057 -17.392 -15.603 172 HG SER 25 HG SER 25 6.600 -18.841 -16.452 173 HA PRO 26 HA PRO 26 3.800 -13.597 -13.091 174 HB2 PRO 26 1HB PRO 26 3.278 -12.466 -15.504 175 HB3 PRO 26 2HB PRO 26 4.762 -12.152 -14.597 176 HG2 PRO 26 1HG PRO 26 4.302 -14.024 -16.887 177 HG3 PRO 26 2HG PRO 26 5.665 -12.927 -16.595 178 HD2 PRO 26 1HD PRO 26 5.793 -15.581 -16.073 179 HD3 PRO 26 2HD PRO 26 6.676 -14.375 -15.114 180 H LYS 27 H LYS 27 3.196 -15.952 -15.595 181 HA LYS 27 HA LYS 27 0.313 -15.479 -15.479 182 HB2 LYS 27 1HB LYS 27 1.810 -15.990 -17.614 183 HB3 LYS 27 2HB LYS 27 1.503 -17.655 -17.136 184 HG2 LYS 27 1HG LYS 27 -0.866 -17.334 -17.324 185 HG3 LYS 27 2HG LYS 27 -0.650 -15.607 -17.620 186 HD2 LYS 27 1HD LYS 27 -1.072 -16.733 -19.714 187 HD3 LYS 27 2HD LYS 27 0.596 -16.157 -19.686 188 HE2 LYS 27 1HE LYS 27 1.464 -18.288 -19.454 189 HE3 LYS 27 2HE LYS 27 -0.032 -18.935 -18.783 190 HZ1 LYS 27 3HZ LYS 27 0.831 -18.950 -21.453 191 HZ2 LYS 27 1HZ LYS 27 -0.580 -18.022 -21.361 192 HZ3 LYS 27 2HZ LYS 27 -0.579 -19.618 -20.801 193 H LYS 28 H LYS 28 1.735 -16.560 -13.186 194 HA LYS 28 HA LYS 28 0.244 -19.077 -12.930 195 HB2 LYS 28 1HB LYS 28 3.139 -18.589 -12.303 196 HB3 LYS 28 2HB LYS 28 2.231 -19.810 -11.422 197 HG2 LYS 28 1HG LYS 28 2.427 -19.750 -14.421 198 HG3 LYS 28 2HG LYS 28 3.549 -20.639 -13.388 199 HD2 LYS 28 1HD LYS 28 0.585 -21.040 -13.164 200 HD3 LYS 28 2HD LYS 28 1.531 -21.897 -14.383 201 HE2 LYS 28 1HE LYS 28 1.654 -23.418 -12.693 202 HE3 LYS 28 2HE LYS 28 3.055 -22.431 -12.281 203 HZ1 LYS 28 3HZ LYS 28 0.534 -21.554 -11.149 204 HZ2 LYS 28 1HZ LYS 28 2.068 -21.645 -10.441 205 HZ3 LYS 28 2HZ LYS 28 1.110 -23.033 -10.565 206 H PHE 29 H PHE 29 1.858 -16.384 -11.311 207 HA PHE 29 HA PHE 29 0.630 -16.961 -8.769 208 HB2 PHE 29 1HB PHE 29 1.915 -15.232 -7.904 209 HB3 PHE 29 2HB PHE 29 2.904 -15.768 -9.258 210 HD1 PHE 29 HD2 PHE 29 2.515 -14.515 -11.508 211 HD2 PHE 29 HD1 PHE 29 1.401 -12.997 -7.691 212 HE1 PHE 29 HE2 PHE 29 2.499 -12.232 -12.425 213 HE2 PHE 29 HE1 PHE 29 1.382 -10.712 -8.601 214 HZ PHE 29 HZ PHE 29 1.933 -10.326 -10.971 215 H PHE 30 H PHE 30 -0.232 -15.265 -11.603 216 HA PHE 30 HA PHE 30 -1.847 -13.219 -10.617 217 HB2 PHE 30 1HB PHE 30 -2.776 -13.074 -12.776 218 HB3 PHE 30 2HB PHE 30 -1.153 -13.706 -13.041 219 HD1 PHE 30 HD1 PHE 30 -0.999 -16.340 -13.058 220 HD2 PHE 30 HD2 PHE 30 -4.533 -14.100 -13.835 221 HE1 PHE 30 HE1 PHE 30 -1.942 -18.258 -14.276 222 HE2 PHE 30 HE2 PHE 30 -5.483 -16.014 -15.053 223 HZ PHE 30 HZ PHE 30 -4.188 -18.097 -15.275 224 H GLN 31 H GLN 31 -2.429 -16.648 -10.895 225 HA GLN 31 HA GLN 31 -5.243 -16.341 -10.202 226 HB2 GLN 31 1HB GLN 31 -5.490 -18.647 -10.684 227 HB3 GLN 31 2HB GLN 31 -4.416 -18.009 -11.922 228 HG2 GLN 31 1HG GLN 31 -2.585 -18.802 -10.154 229 HG3 GLN 31 2HG GLN 31 -3.877 -19.929 -9.744 230 HE21 GLN 31 2HE2 GLN 31 -1.165 -19.874 -11.328 231 HE22 GLN 31 1HE2 GLN 31 -1.525 -20.870 -12.693 232 H ILE 32 H ILE 32 -2.208 -17.336 -8.788 233 HA ILE 32 HA ILE 32 -3.326 -18.528 -6.450 234 HB ILE 32 HB ILE 32 -0.550 -17.447 -6.948 235 HG12 ILE 32 1HG1 ILE 32 -1.255 -20.350 -6.766 236 HG13 ILE 32 2HG1 ILE 32 -1.588 -19.485 -8.262 237 HG21 ILE 32 1HG2 ILE 32 -0.474 -17.535 -4.689 238 HG22 ILE 32 2HG2 ILE 32 -1.818 -18.670 -4.579 239 HG23 ILE 32 3HG2 ILE 32 -0.207 -19.250 -4.997 240 HD11 ILE 32 3HD1 ILE 32 1.109 -19.607 -6.939 241 HD12 ILE 32 1HD1 ILE 32 0.581 -20.674 -8.240 242 HD13 ILE 32 2HD1 ILE 32 0.727 -18.939 -8.525 243 H SER 33 H SER 33 -1.530 -15.472 -6.885 244 HA SER 33 HA SER 33 -2.053 -14.446 -4.339 245 HB2 SER 33 1HB SER 33 -0.337 -13.587 -5.972 246 HB3 SER 33 2HB SER 33 -1.652 -12.806 -6.849 247 HG SER 33 HG SER 33 -0.901 -11.287 -5.461 248 H GLY 34 H GLY 34 -3.670 -13.665 -7.424 249 HA2 GLY 34 1HA GLY 34 -6.196 -13.756 -7.197 250 HA3 GLY 34 2HA GLY 34 -5.954 -12.658 -5.847 251 H MET 35 H MET 35 -4.365 -12.684 -9.017 252 HA MET 35 HA MET 35 -5.198 -9.899 -9.368 253 HB2 MET 35 1HB MET 35 -3.062 -11.557 -10.710 254 HB3 MET 35 2HB MET 35 -3.479 -9.925 -11.216 255 HG2 MET 35 1HG MET 35 -3.056 -9.450 -8.633 256 HG3 MET 35 2HG MET 35 -2.017 -10.860 -8.824 257 HE1 MET 35 3HE MET 35 0.090 -9.521 -11.989 258 HE2 MET 35 1HE MET 35 -0.551 -10.972 -11.219 259 HE3 MET 35 2HE MET 35 -1.604 -9.961 -12.209 260 H SER 36 H SER 36 -5.838 -13.051 -10.520 261 HA SER 36 HA SER 36 -6.563 -12.658 -13.160 262 HB2 SER 36 1HB SER 36 -6.513 -14.878 -12.178 263 HB3 SER 36 2HB SER 36 -7.841 -14.465 -11.094 264 HG SER 36 HG SER 36 -8.915 -15.387 -12.694 265 H LYS 37 H LYS 37 -8.355 -11.934 -10.221 266 HA LYS 37 HA LYS 37 -10.835 -11.348 -11.433 267 HB2 LYS 37 1HB LYS 37 -11.215 -10.001 -9.305 268 HB3 LYS 37 2HB LYS 37 -10.860 -11.711 -9.101 269 HG2 LYS 37 1HG LYS 37 -8.851 -11.324 -8.125 270 HG3 LYS 37 2HG LYS 37 -8.568 -9.839 -9.037 271 HD2 LYS 37 1HD LYS 37 -9.694 -8.542 -7.538 272 HD3 LYS 37 2HD LYS 37 -10.800 -9.839 -7.081 273 HE2 LYS 37 1HE LYS 37 -8.434 -10.822 -6.184 274 HE3 LYS 37 2HE LYS 37 -8.188 -9.091 -5.959 275 HZ1 LYS 37 3HZ LYS 37 -10.525 -9.216 -4.881 276 HZ2 LYS 37 1HZ LYS 37 -9.169 -9.697 -3.991 277 HZ3 LYS 37 2HZ LYS 37 -10.170 -10.860 -4.702 278 H LYS 38 H LYS 38 -7.896 -9.533 -11.081 279 HA LYS 38 HA LYS 38 -8.808 -6.925 -11.360 280 HB2 LYS 38 1HB LYS 38 -6.288 -8.078 -12.568 281 HB3 LYS 38 2HB LYS 38 -6.591 -6.385 -12.199 282 HG2 LYS 38 1HG LYS 38 -6.476 -8.587 -10.149 283 HG3 LYS 38 2HG LYS 38 -5.136 -7.512 -10.553 284 HD2 LYS 38 1HD LYS 38 -5.919 -6.146 -8.971 285 HD3 LYS 38 2HD LYS 38 -7.250 -5.789 -10.074 286 HE2 LYS 38 1HE LYS 38 -8.730 -6.997 -8.879 287 HE3 LYS 38 2HE LYS 38 -7.555 -8.256 -8.505 288 HZ1 LYS 38 3HZ LYS 38 -8.066 -7.225 -6.477 289 HZ2 LYS 38 1HZ LYS 38 -7.950 -5.667 -7.126 290 HZ3 LYS 38 2HZ LYS 38 -6.555 -6.600 -6.911 291 H SER 39 H SER 39 -8.058 -5.644 -13.492 292 HA SER 39 HA SER 39 -8.705 -6.953 -15.961 293 HB2 SER 39 1HB SER 39 -10.932 -6.358 -14.660 294 HB3 SER 39 2HB SER 39 -10.611 -4.746 -15.300 295 HG SER 39 HG SER 39 -11.816 -6.621 -16.560 296 H SER 40 H SER 40 -6.420 -5.748 -15.462 297 HA SER 40 HA SER 40 -4.968 -4.102 -16.073 298 HB2 SER 40 1HB SER 40 -5.818 -4.820 -18.303 299 HB3 SER 40 2HB SER 40 -7.036 -3.547 -18.214 300 HG SER 40 HG SER 40 -4.682 -3.284 -19.199 301 H SER 41 H SER 41 -7.147 -3.440 -14.176 302 HA SER 41 HA SER 41 -7.145 -0.517 -14.556 303 HB2 SER 41 1HB SER 41 -9.414 -1.520 -14.803 304 HB3 SER 41 2HB SER 41 -9.285 -2.140 -13.157 305 HG SER 41 HG SER 41 -9.082 0.036 -12.452 306 H GLN 42 H GLN 42 -5.999 -3.039 -12.738 307 HA GLN 42 HA GLN 42 -5.433 -1.243 -10.485 308 HB2 GLN 42 1HB GLN 42 -6.181 -4.159 -10.215 309 HB3 GLN 42 2HB GLN 42 -5.736 -3.079 -8.901 310 HG2 GLN 42 1HG GLN 42 -7.906 -2.704 -8.652 311 HG3 GLN 42 2HG GLN 42 -7.806 -1.750 -10.131 312 HE21 GLN 42 2HE2 GLN 42 -7.375 -3.873 -11.928 313 HE22 GLN 42 1HE2 GLN 42 -8.835 -4.791 -12.033 314 H LEU 43 H LEU 43 -4.373 -3.514 -12.776 315 HA LEU 43 HA LEU 43 -2.153 -4.677 -11.591 316 HB2 LEU 43 1HB LEU 43 -2.138 -3.705 -14.429 317 HB3 LEU 43 2HB LEU 43 -1.365 -5.138 -13.753 318 HG LEU 43 HG LEU 43 -4.298 -4.725 -14.309 319 HD11 LEU 43 1HD1 LEU 43 -2.275 -5.589 -15.950 320 HD12 LEU 43 2HD1 LEU 43 -3.991 -5.943 -16.152 321 HD13 LEU 43 3HD1 LEU 43 -2.944 -7.096 -15.325 322 HD21 LEU 43 3HD2 LEU 43 -4.798 -6.237 -12.767 323 HD22 LEU 43 1HD2 LEU 43 -3.107 -6.292 -12.269 324 HD23 LEU 43 2HD2 LEU 43 -3.693 -7.388 -13.520 325 H LYS 44 H LYS 44 -2.418 -1.545 -13.235 326 HA LYS 44 HA LYS 44 0.344 -0.896 -12.632 327 HB2 LYS 44 1HB LYS 44 0.120 0.882 -14.081 328 HB3 LYS 44 2HB LYS 44 -1.073 -0.229 -14.740 329 HG2 LYS 44 1HG LYS 44 -1.620 2.113 -12.929 330 HG3 LYS 44 2HG LYS 44 -1.972 2.009 -14.656 331 HD2 LYS 44 1HD LYS 44 -3.381 -0.053 -14.026 332 HD3 LYS 44 2HD LYS 44 -3.276 0.560 -12.374 333 HE2 LYS 44 1HE LYS 44 -4.192 2.289 -14.653 334 HE3 LYS 44 2HE LYS 44 -5.307 1.242 -13.776 335 HZ1 LYS 44 3HZ LYS 44 -5.078 2.461 -11.854 336 HZ2 LYS 44 1HZ LYS 44 -4.991 3.678 -13.026 337 HZ3 LYS 44 2HZ LYS 44 -3.578 3.107 -12.294 338 H GLU 45 H GLU 45 -2.281 -1.025 -10.777 339 HA GLU 45 HA GLU 45 -2.191 1.551 -9.504 340 HB2 GLU 45 1HB GLU 45 -4.217 0.032 -9.618 341 HB3 GLU 45 2HB GLU 45 -3.427 -0.976 -8.413 342 HG2 GLU 45 1HG GLU 45 -5.108 0.621 -7.506 343 HG3 GLU 45 2HG GLU 45 -3.502 0.752 -6.791 344 H ILE 46 H ILE 46 -1.066 -1.716 -8.703 345 HA ILE 46 HA ILE 46 0.061 -0.983 -6.195 346 HB ILE 46 HB ILE 46 0.875 -3.351 -7.873 347 HG12 ILE 46 1HG1 ILE 46 -1.004 -4.188 -5.978 348 HG13 ILE 46 2HG1 ILE 46 -1.694 -2.729 -6.679 349 HG21 ILE 46 1HG2 ILE 46 0.651 -3.572 -4.957 350 HG22 ILE 46 2HG2 ILE 46 1.913 -4.143 -6.047 351 HG23 ILE 46 3HG2 ILE 46 1.897 -2.459 -5.523 352 HD11 ILE 46 3HD1 ILE 46 -1.606 -5.356 -7.748 353 HD12 ILE 46 1HD1 ILE 46 -2.366 -3.912 -8.415 354 HD13 ILE 46 2HD1 ILE 46 -0.687 -4.285 -8.805 355 H PHE 47 H PHE 47 1.214 -0.972 -9.482 356 HA PHE 47 HA PHE 47 3.177 -0.327 -10.438 357 HB2 PHE 47 1HB PHE 47 3.053 1.378 -7.968 358 HB3 PHE 47 2HB PHE 47 4.430 1.485 -9.060 359 HD1 PHE 47 HD2 PHE 47 3.406 1.398 -11.684 360 HD2 PHE 47 HD1 PHE 47 1.651 3.165 -8.232 361 HE1 PHE 47 HE2 PHE 47 2.146 2.947 -13.122 362 HE2 PHE 47 HE1 PHE 47 0.388 4.716 -9.665 363 HZ PHE 47 HZ PHE 47 0.635 4.609 -12.112 364 H ARG 48 H ARG 48 3.199 -2.689 -8.718 365 HA ARG 48 HA ARG 48 6.087 -2.873 -8.372 366 HB2 ARG 48 1HB ARG 48 4.113 -3.542 -6.182 367 HB3 ARG 48 2HB ARG 48 5.819 -3.968 -6.154 368 HG2 ARG 48 1HG ARG 48 6.066 -1.349 -6.560 369 HG3 ARG 48 2HG ARG 48 4.506 -1.354 -5.734 370 HD2 ARG 48 1HD ARG 48 5.401 -2.027 -3.763 371 HD3 ARG 48 2HD ARG 48 6.635 -3.017 -4.540 372 HE ARG 48 HE ARG 48 8.067 -1.262 -4.328 373 HH11 ARG 48 1HH1 ARG 48 4.810 -0.034 -4.267 374 HH12 ARG 48 2HH1 ARG 48 5.294 1.602 -3.965 375 HH21 ARG 48 1HH2 ARG 48 8.716 0.888 -3.931 376 HH22 ARG 48 2HH2 ARG 48 7.516 2.125 -3.775 377 H ILE 49 H ILE 49 3.699 -3.984 -9.995 378 HA ILE 49 HA ILE 49 4.419 -6.825 -9.680 379 HB ILE 49 HB ILE 49 2.209 -7.394 -10.620 380 HG12 ILE 49 1HG1 ILE 49 1.388 -4.539 -10.144 381 HG13 ILE 49 2HG1 ILE 49 2.001 -5.056 -11.711 382 HG21 ILE 49 1HG2 ILE 49 2.568 -5.980 -8.046 383 HG22 ILE 49 2HG2 ILE 49 0.913 -6.319 -8.551 384 HG23 ILE 49 3HG2 ILE 49 2.068 -7.639 -8.370 385 HD11 ILE 49 3HD1 ILE 49 0.151 -6.930 -11.370 386 HD12 ILE 49 1HD1 ILE 49 -0.567 -5.659 -10.382 387 HD13 ILE 49 2HD1 ILE 49 -0.207 -5.357 -12.082 388 H LEU 50 H LEU 50 4.166 -4.115 -11.783 389 HA LEU 50 HA LEU 50 4.544 -5.755 -14.173 390 HB2 LEU 50 1HB LEU 50 4.535 -2.787 -14.281 391 HB3 LEU 50 2HB LEU 50 3.878 -3.960 -15.421 392 HG LEU 50 HG LEU 50 2.599 -3.461 -12.748 393 HD11 LEU 50 1HD1 LEU 50 2.529 -1.314 -13.647 394 HD12 LEU 50 2HD1 LEU 50 0.996 -2.027 -14.147 395 HD13 LEU 50 3HD1 LEU 50 2.328 -1.906 -15.296 396 HD21 LEU 50 3HD2 LEU 50 0.600 -4.269 -14.000 397 HD22 LEU 50 1HD2 LEU 50 1.880 -5.470 -13.831 398 HD23 LEU 50 2HD2 LEU 50 1.660 -4.627 -15.364 399 H ASP 51 H ASP 51 6.024 -2.738 -12.973 400 HA ASP 51 HA ASP 51 8.675 -3.845 -13.168 401 HB2 ASP 51 1HB ASP 51 9.338 -1.889 -14.762 402 HB3 ASP 51 2HB ASP 51 8.644 -3.359 -15.440 403 H ASN 52 H ASN 52 10.291 -2.470 -12.276 404 HA ASN 52 HA ASN 52 9.163 -0.407 -10.519 405 HB2 ASN 52 1HB ASN 52 11.213 -0.710 -9.172 406 HB3 ASN 52 2HB ASN 52 10.321 -2.217 -9.365 407 HD21 ASN 52 2HD2 ASN 52 11.122 -3.790 -10.824 408 HD22 ASN 52 1HD2 ASN 52 12.797 -3.829 -11.246 409 H ASP 53 H ASP 53 9.338 0.604 -12.936 410 HA ASP 53 HA ASP 53 11.459 2.560 -12.692 411 HB2 ASP 53 1HB ASP 53 12.225 0.508 -14.137 412 HB3 ASP 53 2HB ASP 53 11.214 1.249 -15.374 413 H GLN 54 H GLN 54 8.973 1.363 -14.951 414 HA GLN 54 HA GLN 54 7.389 2.453 -16.177 415 HB2 GLN 54 1HB GLN 54 7.285 4.376 -13.856 416 HB3 GLN 54 2HB GLN 54 5.986 3.961 -14.966 417 HG2 GLN 54 1HG GLN 54 7.245 2.085 -12.977 418 HG3 GLN 54 2HG GLN 54 5.709 2.923 -12.768 419 HE21 GLN 54 2HE2 GLN 54 5.395 0.411 -12.476 420 HE22 GLN 54 1HE2 GLN 54 4.770 -0.384 -13.877 421 H SER 55 H SER 55 10.143 3.273 -16.588 422 HA SER 55 HA SER 55 9.985 6.140 -17.076 423 HB2 SER 55 1HB SER 55 12.116 5.705 -16.325 424 HB3 SER 55 2HB SER 55 12.164 4.103 -17.061 425 HG SER 55 HG SER 55 13.527 5.583 -18.148 426 H GLY 56 H GLY 56 10.481 3.143 -18.928 427 HA2 GLY 56 1HA GLY 56 9.203 4.402 -21.229 428 HA3 GLY 56 2HA GLY 56 10.864 3.871 -21.449 429 H PHE 57 H PHE 57 11.098 1.502 -20.371 430 HA PHE 57 HA PHE 57 8.839 -0.205 -20.883 431 HB2 PHE 57 1HB PHE 57 11.190 -0.141 -22.769 432 HB3 PHE 57 2HB PHE 57 10.159 -1.559 -22.607 433 HD1 PHE 57 HD2 PHE 57 7.690 -1.308 -23.092 434 HD2 PHE 57 HD1 PHE 57 10.569 1.651 -24.128 435 HE1 PHE 57 HE2 PHE 57 6.110 -0.344 -24.713 436 HE2 PHE 57 HE1 PHE 57 8.993 2.621 -25.750 437 HZ PHE 57 HZ PHE 57 6.761 1.623 -26.045 438 H ILE 58 H ILE 58 9.424 -2.535 -20.558 439 HA ILE 58 HA ILE 58 11.277 -2.722 -18.321 440 HB ILE 58 HB ILE 58 9.553 -4.951 -19.377 441 HG12 ILE 58 1HG1 ILE 58 8.785 -2.834 -17.356 442 HG13 ILE 58 2HG1 ILE 58 8.136 -2.970 -18.986 443 HG21 ILE 58 1HG2 ILE 58 11.235 -4.487 -17.019 444 HG22 ILE 58 2HG2 ILE 58 9.653 -5.185 -16.674 445 HG23 ILE 58 3HG2 ILE 58 10.750 -5.997 -17.791 446 HD11 ILE 58 3HD1 ILE 58 7.772 -5.472 -17.753 447 HD12 ILE 58 1HD1 ILE 58 7.268 -4.243 -16.594 448 HD13 ILE 58 2HD1 ILE 58 6.547 -4.287 -18.203 449 H GLU 59 H GLU 59 12.806 -4.489 -18.156 450 HA GLU 59 HA GLU 59 13.611 -5.767 -20.645 451 HB2 GLU 59 1HB GLU 59 14.784 -3.476 -20.328 452 HB3 GLU 59 2HB GLU 59 15.701 -4.293 -19.070 453 HG2 GLU 59 1HG GLU 59 16.812 -4.207 -21.299 454 HG3 GLU 59 2HG GLU 59 16.632 -5.824 -20.622 455 H GLU 60 H GLU 60 15.471 -7.306 -20.248 456 HA GLU 60 HA GLU 60 14.799 -9.117 -18.236 457 HB2 GLU 60 1HB GLU 60 17.341 -8.804 -19.834 458 HB3 GLU 60 2HB GLU 60 17.042 -10.157 -18.753 459 HG2 GLU 60 1HG GLU 60 15.189 -10.889 -20.068 460 HG3 GLU 60 2HG GLU 60 15.262 -9.439 -21.067 461 H ASP 61 H ASP 61 16.738 -6.288 -18.120 462 HA ASP 61 HA ASP 61 18.279 -7.029 -15.814 463 HB2 ASP 61 1HB ASP 61 19.036 -5.343 -17.495 464 HB3 ASP 61 2HB ASP 61 17.765 -4.264 -16.927 465 H GLU 62 H GLU 62 15.078 -6.339 -16.210 466 HA GLU 62 HA GLU 62 14.844 -5.381 -13.434 467 HB2 GLU 62 1HB GLU 62 13.523 -4.421 -15.914 468 HB3 GLU 62 2HB GLU 62 12.531 -4.501 -14.465 469 HG2 GLU 62 1HG GLU 62 13.631 -2.809 -13.446 470 HG3 GLU 62 2HG GLU 62 15.175 -3.213 -14.194 471 H LEU 63 H LEU 63 14.784 -8.099 -14.729 472 HA LEU 63 HA LEU 63 12.062 -8.910 -13.959 473 HB2 LEU 63 1HB LEU 63 14.086 -10.422 -15.604 474 HB3 LEU 63 2HB LEU 63 12.429 -10.921 -15.269 475 HG LEU 63 HG LEU 63 13.314 -8.598 -16.977 476 HD11 LEU 63 1HD1 LEU 63 11.540 -10.538 -18.166 477 HD12 LEU 63 2HD1 LEU 63 13.016 -11.299 -17.573 478 HD13 LEU 63 3HD1 LEU 63 13.112 -9.961 -18.718 479 HD21 LEU 63 3HD2 LEU 63 11.338 -7.664 -16.598 480 HD22 LEU 63 1HD2 LEU 63 10.876 -8.991 -15.532 481 HD23 LEU 63 2HD2 LEU 63 10.560 -9.100 -17.264 482 H LYS 64 H LYS 64 15.478 -9.830 -13.663 483 HA LYS 64 HA LYS 64 15.168 -11.978 -11.913 484 HB2 LYS 64 1HB LYS 64 17.532 -11.328 -11.158 485 HB3 LYS 64 2HB LYS 64 17.300 -11.717 -12.857 486 HG2 LYS 64 1HG LYS 64 16.871 -8.930 -12.519 487 HG3 LYS 64 2HG LYS 64 18.382 -9.367 -11.717 488 HD2 LYS 64 1HD LYS 64 17.867 -10.475 -14.427 489 HD3 LYS 64 2HD LYS 64 18.286 -8.765 -14.298 490 HE2 LYS 64 1HE LYS 64 19.932 -10.760 -12.821 491 HE3 LYS 64 2HE LYS 64 20.142 -10.618 -14.566 492 HZ1 LYS 64 3HZ LYS 64 20.972 -8.512 -14.389 493 HZ2 LYS 64 1HZ LYS 64 21.536 -9.162 -12.932 494 HZ3 LYS 64 2HZ LYS 64 20.162 -8.176 -12.942 495 H TYR 65 H TYR 65 15.494 -8.518 -11.242 496 HA TYR 65 HA TYR 65 15.390 -8.904 -8.388 497 HB2 TYR 65 1HB TYR 65 15.326 -6.438 -10.128 498 HB3 TYR 65 2HB TYR 65 15.229 -6.376 -8.372 499 HD1 TYR 65 HD2 TYR 65 17.389 -7.450 -11.191 500 HD2 TYR 65 HD1 TYR 65 17.177 -6.482 -7.054 501 HE1 TYR 65 HE2 TYR 65 19.845 -7.488 -11.062 502 HE2 TYR 65 HE1 TYR 65 19.632 -6.516 -6.913 503 HH TYR 65 HH TYR 65 21.587 -6.131 -8.773 504 H PHE 66 H PHE 66 13.196 -10.100 -9.600 505 HA PHE 66 HA PHE 66 10.931 -8.307 -9.238 506 HB2 PHE 66 1HB PHE 66 10.901 -9.833 -11.151 507 HB3 PHE 66 2HB PHE 66 11.039 -11.214 -10.068 508 HD1 PHE 66 HD2 PHE 66 9.157 -11.830 -8.603 509 HD2 PHE 66 HD1 PHE 66 8.820 -8.750 -11.521 510 HE1 PHE 66 HE2 PHE 66 6.705 -11.948 -8.439 511 HE2 PHE 66 HE1 PHE 66 6.367 -8.862 -11.361 512 HZ PHE 66 HZ PHE 66 5.307 -10.463 -9.819 513 H LEU 67 H LEU 67 11.755 -11.578 -8.071 514 HA LEU 67 HA LEU 67 9.892 -11.766 -6.052 515 HB2 LEU 67 1HB LEU 67 12.698 -12.820 -5.813 516 HB3 LEU 67 2HB LEU 67 11.229 -13.482 -5.100 517 HG LEU 67 HG LEU 67 12.017 -13.527 -8.010 518 HD11 LEU 67 1HD1 LEU 67 12.005 -15.507 -5.790 519 HD12 LEU 67 2HD1 LEU 67 13.172 -15.272 -7.091 520 HD13 LEU 67 3HD1 LEU 67 11.630 -16.062 -7.422 521 HD21 LEU 67 3HD2 LEU 67 9.860 -13.682 -8.510 522 HD22 LEU 67 1HD2 LEU 67 9.416 -13.596 -6.806 523 HD23 LEU 67 2HD2 LEU 67 9.777 -15.156 -7.545 524 H GLN 68 H GLN 68 12.874 -9.971 -6.111 525 HA GLN 68 HA GLN 68 13.392 -9.578 -3.432 526 HB2 GLN 68 1HB GLN 68 14.242 -8.444 -5.855 527 HB3 GLN 68 2HB GLN 68 13.700 -7.093 -4.869 528 HG2 GLN 68 1HG GLN 68 15.425 -7.265 -3.455 529 HG3 GLN 68 2HG GLN 68 15.378 -9.028 -3.453 530 HE21 GLN 68 2HE2 GLN 68 15.918 -9.851 -5.841 531 HE22 GLN 68 1HE2 GLN 68 17.414 -9.236 -6.448 532 H ARG 69 H ARG 69 11.146 -7.772 -5.506 533 HA ARG 69 HA ARG 69 10.317 -5.820 -3.751 534 HB2 ARG 69 1HB ARG 69 8.908 -7.300 -5.947 535 HB3 ARG 69 2HB ARG 69 8.034 -6.124 -4.974 536 HG2 ARG 69 1HG ARG 69 10.624 -5.297 -6.164 537 HG3 ARG 69 2HG ARG 69 9.226 -5.460 -7.230 538 HD2 ARG 69 1HD ARG 69 9.319 -3.194 -6.483 539 HD3 ARG 69 2HD ARG 69 7.961 -3.976 -5.675 540 HE ARG 69 HE ARG 69 9.035 -3.709 -3.662 541 HH11 ARG 69 1HH1 ARG 69 11.245 -3.040 -6.267 542 HH12 ARG 69 2HH1 ARG 69 12.476 -2.397 -5.231 543 HH21 ARG 69 1HH2 ARG 69 10.648 -2.864 -2.287 544 HH22 ARG 69 2HH2 ARG 69 12.136 -2.298 -2.968 545 H PHE 70 H PHE 70 8.233 -8.627 -4.383 546 HA PHE 70 HA PHE 70 6.807 -8.383 -1.978 547 HB2 PHE 70 1HB PHE 70 7.145 -10.883 -3.646 548 HB3 PHE 70 2HB PHE 70 5.838 -10.541 -2.518 549 HD1 PHE 70 HD1 PHE 70 4.255 -8.655 -3.038 550 HD2 PHE 70 HD2 PHE 70 7.036 -10.182 -5.876 551 HE1 PHE 70 HE1 PHE 70 2.947 -7.642 -4.859 552 HE2 PHE 70 HE2 PHE 70 5.732 -9.171 -7.702 553 HZ PHE 70 HZ PHE 70 3.686 -7.898 -7.194 554 H GLU 71 H GLU 71 8.910 -11.129 -2.839 555 HA GLU 71 HA GLU 71 9.231 -11.952 -0.148 556 HB2 GLU 71 1HB GLU 71 9.558 -13.248 -2.417 557 HB3 GLU 71 2HB GLU 71 11.218 -12.690 -2.258 558 HG2 GLU 71 1HG GLU 71 11.524 -13.863 -0.236 559 HG3 GLU 71 2HG GLU 71 9.796 -14.173 -0.070 560 H SER 72 H SER 72 10.557 -11.237 1.381 561 HA SER 72 HA SER 72 12.579 -9.252 0.670 562 HB2 SER 72 1HB SER 72 11.102 -9.959 3.169 563 HB3 SER 72 2HB SER 72 12.679 -9.184 3.319 564 HG SER 72 HG SER 72 11.153 -7.576 3.222 565 H GLY 73 H GLY 73 12.856 -12.222 0.279 566 HA2 GLY 73 1HA GLY 73 15.442 -12.466 1.665 567 HA3 GLY 73 2HA GLY 73 14.298 -13.798 1.718 568 H ALA 74 H ALA 74 14.059 -12.200 -1.211 569 HA ALA 74 HA ALA 74 15.260 -14.409 -2.612 570 HB1 ALA 74 1HB ALA 74 13.968 -13.783 -4.324 571 HB2 ALA 74 2HB ALA 74 13.212 -12.677 -3.176 572 HB3 ALA 74 3HB ALA 74 14.503 -12.104 -4.233 573 H ARG 75 H ARG 75 16.634 -13.812 -4.623 574 HA ARG 75 HA ARG 75 18.571 -11.703 -4.003 575 HB2 ARG 75 1HB ARG 75 20.261 -13.607 -4.897 576 HB3 ARG 75 2HB ARG 75 19.936 -13.319 -3.193 577 HG2 ARG 75 1HG ARG 75 18.690 -15.216 -2.963 578 HG3 ARG 75 2HG ARG 75 18.185 -15.220 -4.654 579 HD2 ARG 75 1HD ARG 75 20.150 -16.200 -5.375 580 HD3 ARG 75 2HD ARG 75 21.057 -15.657 -3.964 581 HE ARG 75 HE ARG 75 20.378 -17.537 -2.836 582 HH11 ARG 75 1HH1 ARG 75 18.497 -17.181 -5.744 583 HH12 ARG 75 2HH1 ARG 75 17.761 -18.744 -5.615 584 HH21 ARG 75 1HH2 ARG 75 19.415 -19.598 -2.655 585 HH22 ARG 75 2HH2 ARG 75 18.284 -20.117 -3.858 586 H VAL 76 H VAL 76 18.532 -14.363 -6.361 587 HA VAL 76 HA VAL 76 18.003 -12.470 -8.519 588 HB VAL 76 HB VAL 76 20.380 -14.317 -8.690 589 HG11 VAL 76 1HG1 VAL 76 19.851 -13.822 -10.856 590 HG12 VAL 76 2HG1 VAL 76 19.130 -12.265 -10.442 591 HG13 VAL 76 3HG1 VAL 76 20.885 -12.443 -10.482 592 HG21 VAL 76 3HG2 VAL 76 21.070 -12.837 -7.024 593 HG22 VAL 76 1HG2 VAL 76 21.675 -12.101 -8.508 594 HG23 VAL 76 2HG2 VAL 76 20.214 -11.475 -7.746 595 H LEU 77 H LEU 77 16.323 -13.357 -9.522 596 HA LEU 77 HA LEU 77 15.486 -15.991 -9.385 597 HB2 LEU 77 1HB LEU 77 14.994 -13.792 -11.351 598 HB3 LEU 77 2HB LEU 77 14.329 -15.399 -11.633 599 HG LEU 77 HG LEU 77 13.760 -14.302 -8.972 600 HD11 LEU 77 1HD1 LEU 77 11.835 -13.085 -10.612 601 HD12 LEU 77 2HD1 LEU 77 13.407 -12.621 -11.262 602 HD13 LEU 77 3HD1 LEU 77 13.023 -12.301 -9.571 603 HD21 LEU 77 3HD2 LEU 77 12.519 -15.975 -11.043 604 HD22 LEU 77 1HD2 LEU 77 11.401 -14.961 -10.132 605 HD23 LEU 77 2HD2 LEU 77 12.448 -16.100 -9.285 606 H THR 78 H THR 78 15.183 -17.373 -11.477 607 HA THR 78 HA THR 78 17.811 -18.183 -12.289 608 HB THR 78 HB THR 78 16.709 -19.976 -13.505 609 HG1 THR 78 HG1 THR 78 14.565 -19.964 -13.907 610 HG21 THR 78 3HG2 THR 78 15.568 -21.065 -11.668 611 HG22 THR 78 1HG2 THR 78 15.322 -19.516 -10.862 612 HG23 THR 78 2HG2 THR 78 16.952 -20.166 -11.046 613 H ALA 79 H ALA 79 17.854 -18.912 -14.792 614 HA ALA 79 HA ALA 79 17.733 -16.398 -16.257 615 HB1 ALA 79 1HB ALA 79 19.802 -17.702 -16.316 616 HB2 ALA 79 2HB ALA 79 18.932 -19.048 -17.054 617 HB3 ALA 79 3HB ALA 79 19.103 -17.525 -17.926 618 H SER 80 H SER 80 15.722 -18.984 -15.767 619 HA SER 80 HA SER 80 14.592 -18.905 -18.474 620 HB2 SER 80 1HB SER 80 14.679 -20.913 -16.324 621 HB3 SER 80 2HB SER 80 13.114 -20.775 -17.125 622 HG SER 80 HG SER 80 15.627 -21.274 -18.345 623 H GLU 81 H GLU 81 13.654 -18.567 -15.067 624 HA GLU 81 HA GLU 81 10.967 -17.993 -15.386 625 HB2 GLU 81 1HB GLU 81 13.000 -17.130 -13.353 626 HB3 GLU 81 2HB GLU 81 11.350 -16.529 -13.272 627 HG2 GLU 81 1HG GLU 81 10.479 -18.574 -12.728 628 HG3 GLU 81 2HG GLU 81 11.792 -19.460 -13.502 629 H THR 82 H THR 82 13.638 -15.639 -15.170 630 HA THR 82 HA THR 82 12.166 -13.333 -15.620 631 HB THR 82 HB THR 82 14.265 -12.302 -16.415 632 HG1 THR 82 HG1 THR 82 15.322 -14.944 -16.215 633 HG21 THR 82 3HG2 THR 82 15.242 -13.990 -14.200 634 HG22 THR 82 1HG2 THR 82 13.709 -13.166 -13.917 635 HG23 THR 82 2HG2 THR 82 15.148 -12.234 -14.332 636 H LYS 83 H LYS 83 13.800 -15.411 -18.000 637 HA LYS 83 HA LYS 83 13.298 -14.000 -20.306 638 HB2 LYS 83 1HB LYS 83 14.638 -16.091 -20.149 639 HB3 LYS 83 2HB LYS 83 13.142 -17.006 -20.016 640 HG2 LYS 83 1HG LYS 83 13.922 -17.142 -22.268 641 HG3 LYS 83 2HG LYS 83 12.474 -16.133 -22.241 642 HD2 LYS 83 1HD LYS 83 13.802 -14.132 -22.382 643 HD3 LYS 83 2HD LYS 83 15.294 -15.061 -22.217 644 HE2 LYS 83 1HE LYS 83 13.378 -15.591 -24.461 645 HE3 LYS 83 2HE LYS 83 14.563 -14.290 -24.568 646 HZ1 LYS 83 3HZ LYS 83 16.323 -15.787 -24.493 647 HZ2 LYS 83 1HZ LYS 83 15.199 -16.562 -25.492 648 HZ3 LYS 83 2HZ LYS 83 15.374 -17.046 -23.881 649 H THR 84 H THR 84 11.152 -16.281 -18.647 650 HA THR 84 HA THR 84 9.020 -15.783 -20.560 651 HB THR 84 HB THR 84 9.323 -18.065 -19.715 652 HG1 THR 84 HG1 THR 84 7.243 -17.948 -20.173 653 HG21 THR 84 3HG2 THR 84 10.149 -17.840 -17.535 654 HG22 THR 84 1HG2 THR 84 8.513 -18.456 -17.306 655 HG23 THR 84 2HG2 THR 84 8.853 -16.743 -17.059 656 H PHE 85 H PHE 85 9.785 -13.473 -19.210 657 HA PHE 85 HA PHE 85 7.458 -12.997 -17.466 658 HB2 PHE 85 1HB PHE 85 9.713 -12.896 -16.327 659 HB3 PHE 85 2HB PHE 85 10.076 -11.498 -17.334 660 HD1 PHE 85 HD1 PHE 85 8.504 -9.493 -17.180 661 HD2 PHE 85 HD2 PHE 85 8.575 -12.643 -14.319 662 HE1 PHE 85 HE1 PHE 85 7.403 -8.025 -15.541 663 HE2 PHE 85 HE2 PHE 85 7.473 -11.181 -12.676 664 HZ PHE 85 HZ PHE 85 6.885 -8.868 -13.286 665 H LEU 86 H LEU 86 9.721 -11.457 -19.733 666 HA LEU 86 HA LEU 86 7.565 -9.592 -20.481 667 HB2 LEU 86 1HB LEU 86 9.321 -8.032 -21.178 668 HB3 LEU 86 2HB LEU 86 9.413 -8.424 -19.462 669 HG LEU 86 HG LEU 86 11.233 -10.092 -20.115 670 HD11 LEU 86 1HD1 LEU 86 10.545 -9.039 -22.702 671 HD12 LEU 86 2HD1 LEU 86 11.606 -10.382 -22.282 672 HD13 LEU 86 3HD1 LEU 86 12.244 -8.739 -22.338 673 HD21 LEU 86 3HD2 LEU 86 11.805 -8.114 -18.924 674 HD22 LEU 86 1HD2 LEU 86 11.607 -7.114 -20.363 675 HD23 LEU 86 2HD2 LEU 86 12.943 -8.261 -20.263 676 H ALA 87 H ALA 87 9.749 -12.016 -21.539 677 HA ALA 87 HA ALA 87 9.451 -11.354 -24.356 678 HB1 ALA 87 1HB ALA 87 11.277 -12.600 -24.701 679 HB2 ALA 87 2HB ALA 87 11.467 -12.544 -22.948 680 HB3 ALA 87 3HB ALA 87 10.676 -13.927 -23.705 681 H ALA 88 H ALA 88 8.131 -13.531 -21.986 682 HA ALA 88 HA ALA 88 7.029 -15.470 -23.698 683 HB1 ALA 88 1HB ALA 88 6.167 -14.529 -20.969 684 HB2 ALA 88 2HB ALA 88 5.471 -15.922 -21.797 685 HB3 ALA 88 3HB ALA 88 7.180 -15.920 -21.358 686 H ALA 89 H ALA 89 5.733 -12.409 -22.475 687 HA ALA 89 HA ALA 89 3.123 -12.572 -23.342 688 HB1 ALA 89 1HB ALA 89 3.264 -10.613 -22.282 689 HB2 ALA 89 2HB ALA 89 4.976 -10.429 -22.665 690 HB3 ALA 89 3HB ALA 89 3.753 -9.944 -23.839 691 H ASP 90 H ASP 90 5.467 -10.606 -25.148 692 HA ASP 90 HA ASP 90 5.210 -11.942 -27.605 693 HB2 ASP 90 1HB ASP 90 2.864 -10.748 -27.092 694 HB3 ASP 90 2HB ASP 90 3.708 -9.389 -27.827 695 H HIS 91 H HIS 91 5.704 -10.202 -29.483 696 HA HIS 91 HA HIS 91 7.684 -8.288 -28.464 697 HB2 HIS 91 1HB HIS 91 9.196 -8.992 -30.364 698 HB3 HIS 91 2HB HIS 91 9.023 -10.168 -29.065 699 HD1 HIS 91 HD1 HIS 91 8.533 -9.717 -32.680 700 HD2 HIS 91 HD2 HIS 91 7.378 -12.429 -29.752 701 HE1 HIS 91 HE1 HIS 91 7.720 -11.746 -33.925 702 H ASP 92 H ASP 92 5.682 -6.977 -28.998 703 HA ASP 92 HA ASP 92 4.857 -6.579 -31.659 704 HB2 ASP 92 1HB ASP 92 3.429 -5.814 -29.909 705 HB3 ASP 92 2HB ASP 92 4.704 -4.818 -29.213 706 H GLY 93 H GLY 93 7.339 -5.006 -29.692 707 HA2 GLY 93 1HA GLY 93 8.248 -3.600 -32.129 708 HA3 GLY 93 2HA GLY 93 8.414 -2.939 -30.509 709 H ASP 94 H ASP 94 9.587 -4.629 -28.985 710 HA ASP 94 HA ASP 94 11.746 -6.008 -30.366 711 HB2 ASP 94 1HB ASP 94 12.333 -3.511 -29.866 712 HB3 ASP 94 2HB ASP 94 12.517 -4.074 -28.207 713 H GLY 95 H GLY 95 9.445 -6.669 -28.601 714 HA2 GLY 95 1HA GLY 95 9.077 -8.321 -27.032 715 HA3 GLY 95 2HA GLY 95 10.817 -8.547 -26.930 716 H LYS 96 H LYS 96 9.553 -5.372 -26.455 717 HA LYS 96 HA LYS 96 10.200 -5.587 -23.595 718 HB2 LYS 96 1HB LYS 96 10.618 -3.206 -23.628 719 HB3 LYS 96 2HB LYS 96 11.528 -3.968 -24.926 720 HG2 LYS 96 1HG LYS 96 9.634 -3.311 -26.465 721 HG3 LYS 96 2HG LYS 96 9.027 -2.319 -25.137 722 HD2 LYS 96 1HD LYS 96 10.964 -0.959 -25.145 723 HD3 LYS 96 2HD LYS 96 11.837 -2.084 -26.188 724 HE2 LYS 96 1HE LYS 96 9.302 -0.906 -27.200 725 HE3 LYS 96 2HE LYS 96 10.728 0.128 -27.131 726 HZ1 LYS 96 3HZ LYS 96 11.591 -2.229 -28.248 727 HZ2 LYS 96 1HZ LYS 96 11.317 -0.768 -29.056 728 HZ3 LYS 96 2HZ LYS 96 10.095 -1.935 -28.981 729 H ILE 97 H ILE 97 8.685 -5.239 -22.086 730 HA ILE 97 HA ILE 97 5.957 -4.777 -22.966 731 HB ILE 97 HB ILE 97 6.915 -5.249 -20.146 732 HG12 ILE 97 1HG1 ILE 97 7.658 -7.071 -21.650 733 HG13 ILE 97 2HG1 ILE 97 6.447 -7.614 -20.493 734 HG21 ILE 97 1HG2 ILE 97 4.462 -6.327 -20.278 735 HG22 ILE 97 2HG2 ILE 97 4.760 -4.650 -19.824 736 HG23 ILE 97 3HG2 ILE 97 4.289 -5.046 -21.476 737 HD11 ILE 97 3HD1 ILE 97 4.784 -7.739 -22.133 738 HD12 ILE 97 1HD1 ILE 97 5.721 -6.781 -23.278 739 HD13 ILE 97 2HD1 ILE 97 6.224 -8.425 -22.884 740 H GLY 98 H GLY 98 4.635 -3.093 -22.288 741 HA2 GLY 98 1HA GLY 98 5.872 -0.940 -20.725 742 HA3 GLY 98 2HA GLY 98 5.278 -0.562 -22.336 743 H ALA 99 H ALA 99 4.127 -2.235 -19.402 744 HA ALA 99 HA ALA 99 2.084 -2.266 -18.387 745 HB1 ALA 99 1HB ALA 99 2.163 0.620 -19.259 746 HB2 ALA 99 2HB ALA 99 1.028 -0.049 -18.086 747 HB3 ALA 99 3HB ALA 99 2.756 -0.044 -17.736 748 H GLU 100 H GLU 100 1.976 -3.328 -20.928 749 HA GLU 100 HA GLU 100 -0.796 -2.788 -21.616 750 HB2 GLU 100 1HB GLU 100 1.494 -2.444 -23.544 751 HB3 GLU 100 2HB GLU 100 -0.146 -2.767 -24.089 752 HG2 GLU 100 1HG GLU 100 0.611 -0.439 -22.343 753 HG3 GLU 100 2HG GLU 100 0.511 -0.365 -24.101 754 H GLU 101 H GLU 101 2.003 -4.542 -22.972 755 HA GLU 101 HA GLU 101 0.579 -6.773 -23.844 756 HB2 GLU 101 1HB GLU 101 3.464 -6.490 -23.001 757 HB3 GLU 101 2HB GLU 101 2.812 -7.948 -23.735 758 HG2 GLU 101 1HG GLU 101 2.892 -5.213 -24.989 759 HG3 GLU 101 2HG GLU 101 3.943 -6.573 -25.380 760 H PHE 102 H PHE 102 2.473 -6.395 -20.847 761 HA PHE 102 HA PHE 102 1.956 -8.868 -19.720 762 HB2 PHE 102 1HB PHE 102 3.578 -7.295 -18.781 763 HB3 PHE 102 2HB PHE 102 2.273 -6.211 -18.308 764 HD1 PHE 102 HD2 PHE 102 2.108 -9.871 -17.996 765 HD2 PHE 102 HD1 PHE 102 2.762 -6.179 -15.982 766 HE1 PHE 102 HE2 PHE 102 1.940 -11.027 -15.831 767 HE2 PHE 102 HE1 PHE 102 2.596 -7.329 -13.813 768 HZ PHE 102 HZ PHE 102 2.183 -9.756 -13.735 769 H GLN 103 H GLN 103 0.084 -5.867 -19.386 770 HA GLN 103 HA GLN 103 -1.832 -6.598 -17.595 771 HB2 GLN 103 1HB GLN 103 -1.883 -4.852 -20.013 772 HB3 GLN 103 2HB GLN 103 -3.407 -5.211 -19.212 773 HG2 GLN 103 1HG GLN 103 -2.204 -3.089 -18.524 774 HG3 GLN 103 2HG GLN 103 -2.751 -4.159 -17.234 775 HE21 GLN 103 2HE2 GLN 103 0.099 -3.846 -19.333 776 HE22 GLN 103 1HE2 GLN 103 1.261 -4.012 -18.066 777 H GLU 104 H GLU 104 -1.676 -7.486 -21.007 778 HA GLU 104 HA GLU 104 -4.208 -8.793 -21.056 779 HB2 GLU 104 1HB GLU 104 -1.838 -9.146 -22.900 780 HB3 GLU 104 2HB GLU 104 -3.483 -9.678 -23.221 781 HG2 GLU 104 1HG GLU 104 -2.472 -6.857 -23.012 782 HG3 GLU 104 2HG GLU 104 -3.125 -7.672 -24.432 783 H MET 105 H MET 105 -0.859 -9.952 -20.794 784 HA MET 105 HA MET 105 -1.291 -12.672 -20.778 785 HB2 MET 105 1HB MET 105 0.949 -11.994 -20.782 786 HB3 MET 105 2HB MET 105 0.732 -10.941 -19.390 787 HG2 MET 105 1HG MET 105 0.924 -12.647 -17.890 788 HG3 MET 105 2HG MET 105 0.321 -13.856 -19.021 789 HE1 MET 105 3HE MET 105 3.579 -11.612 -18.146 790 HE2 MET 105 1HE MET 105 4.488 -12.000 -19.607 791 HE3 MET 105 2HE MET 105 2.939 -11.166 -19.729 792 H VAL 106 H VAL 106 -2.030 -10.337 -18.318 793 HA VAL 106 HA VAL 106 -2.393 -12.277 -16.219 794 HB VAL 106 HB VAL 106 -3.354 -9.416 -16.288 795 HG11 VAL 106 1HG1 VAL 106 -2.567 -10.777 -13.782 796 HG12 VAL 106 2HG1 VAL 106 -3.852 -9.604 -14.084 797 HG13 VAL 106 3HG1 VAL 106 -4.077 -11.296 -14.531 798 HG21 VAL 106 3HG2 VAL 106 -1.085 -9.127 -16.575 799 HG22 VAL 106 1HG2 VAL 106 -1.210 -9.164 -14.816 800 HG23 VAL 106 2HG2 VAL 106 -0.677 -10.599 -15.693 801 H GLN 107 H GLN 107 -4.552 -10.234 -18.178 802 HA GLN 107 HA GLN 107 -6.977 -11.097 -17.138 803 HB2 GLN 107 1HB GLN 107 -6.336 -10.257 -19.970 804 HB3 GLN 107 2HB GLN 107 -7.958 -10.387 -19.302 805 HG2 GLN 107 1HG GLN 107 -5.817 -8.399 -18.682 806 HG3 GLN 107 2HG GLN 107 -7.491 -8.126 -19.160 807 HE21 GLN 107 2HE2 GLN 107 -5.547 -7.620 -16.721 808 HE22 GLN 107 1HE2 GLN 107 -6.602 -7.867 -15.375 809 H SER 108 H SER 108 -4.785 -12.692 -19.296 810 HA SER 108 HA SER 108 -6.613 -14.992 -19.389 811 HB2 SER 108 1HB SER 108 -4.836 -14.377 -21.730 812 HB3 SER 108 2HB SER 108 -6.305 -15.352 -21.674 813 HG SER 108 HG SER 108 -7.244 -13.131 -21.042 Start of MODEL 8 1 H1 SER 1 H SER 1 4.177 1.756 -1.093 2 HA SER 1 HA SER 1 3.590 -0.212 0.969 3 HB2 SER 1 1HB SER 1 2.034 1.568 -0.751 4 HB3 SER 1 2HB SER 1 1.354 -0.056 -0.652 5 HG SER 1 HG SER 1 0.888 1.723 1.048 6 H LEU 2 H LEU 2 1.972 -2.007 -0.029 7 HA LEU 2 HA LEU 2 2.739 -3.087 -2.552 8 HB2 LEU 2 1HB LEU 2 4.707 -3.571 -0.998 9 HB3 LEU 2 2HB LEU 2 3.627 -4.695 -0.175 10 HG LEU 2 HG LEU 2 3.359 -5.884 -2.378 11 HD11 LEU 2 1HD1 LEU 2 4.975 -3.654 -3.238 12 HD12 LEU 2 2HD1 LEU 2 4.106 -4.851 -4.196 13 HD13 LEU 2 3HD1 LEU 2 5.742 -5.192 -3.632 14 HD21 LEU 2 3HD2 LEU 2 5.839 -5.747 -0.756 15 HD22 LEU 2 1HD2 LEU 2 5.890 -6.674 -2.256 16 HD23 LEU 2 2HD2 LEU 2 4.717 -7.085 -1.004 17 H THR 3 H THR 3 1.558 -4.987 -3.105 18 HA THR 3 HA THR 3 -0.405 -6.148 -3.217 19 HB THR 3 HB THR 3 -0.862 -7.617 -1.419 20 HG1 THR 3 HG1 THR 3 0.650 -5.945 0.320 21 HG21 THR 3 3HG2 THR 3 2.032 -7.123 -0.871 22 HG22 THR 3 1HG2 THR 3 1.533 -7.590 -2.497 23 HG23 THR 3 2HG2 THR 3 1.181 -8.646 -1.129 24 H ASP 4 H ASP 4 -0.898 -3.467 -3.120 25 HA ASP 4 HA ASP 4 -2.781 -2.803 -1.060 26 HB2 ASP 4 1HB ASP 4 -1.406 -1.083 -2.175 27 HB3 ASP 4 2HB ASP 4 -2.229 -1.420 -3.695 28 H ILE 5 H ILE 5 -3.152 -3.150 -4.594 29 HA ILE 5 HA ILE 5 -5.980 -3.268 -4.491 30 HB ILE 5 HB ILE 5 -4.231 -2.872 -6.500 31 HG12 ILE 5 1HG1 ILE 5 -6.413 -3.665 -7.927 32 HG13 ILE 5 2HG1 ILE 5 -7.108 -3.497 -6.318 33 HG21 ILE 5 1HG2 ILE 5 -3.660 -5.329 -6.428 34 HG22 ILE 5 2HG2 ILE 5 -5.281 -5.637 -7.048 35 HG23 ILE 5 3HG2 ILE 5 -4.134 -4.698 -8.004 36 HD11 ILE 5 3HD1 ILE 5 -7.367 -1.452 -7.568 37 HD12 ILE 5 1HD1 ILE 5 -6.264 -1.197 -6.216 38 HD13 ILE 5 2HD1 ILE 5 -5.628 -1.375 -7.852 39 H LEU 6 H LEU 6 -3.492 -5.640 -4.111 40 HA LEU 6 HA LEU 6 -5.508 -7.786 -4.167 41 HB2 LEU 6 1HB LEU 6 -2.901 -7.593 -5.287 42 HB3 LEU 6 2HB LEU 6 -2.876 -8.842 -4.043 43 HG LEU 6 HG LEU 6 -4.909 -9.827 -5.238 44 HD11 LEU 6 1HD1 LEU 6 -4.026 -8.689 -7.771 45 HD12 LEU 6 2HD1 LEU 6 -4.780 -7.511 -6.698 46 HD13 LEU 6 3HD1 LEU 6 -5.656 -8.971 -7.158 47 HD21 LEU 6 3HD2 LEU 6 -3.546 -11.186 -6.535 48 HD22 LEU 6 1HD2 LEU 6 -2.435 -10.564 -5.315 49 HD23 LEU 6 2HD2 LEU 6 -2.443 -9.869 -6.937 50 H SER 7 H SER 7 -4.386 -9.732 -2.735 51 HA SER 7 HA SER 7 -4.293 -8.584 -0.039 52 HB2 SER 7 1HB SER 7 -5.633 -10.822 -1.153 53 HB3 SER 7 2HB SER 7 -4.441 -11.448 -0.015 54 HG SER 7 HG SER 7 -5.391 -10.341 1.610 55 HA PRO 8 HA PRO 8 0.022 -9.478 0.264 56 HB2 PRO 8 1HB PRO 8 0.250 -9.251 2.959 57 HB3 PRO 8 2HB PRO 8 0.077 -7.855 1.889 58 HG2 PRO 8 1HG PRO 8 -1.999 -9.248 3.535 59 HG3 PRO 8 2HG PRO 8 -1.738 -7.510 3.301 60 HD2 PRO 8 1HD PRO 8 -3.655 -8.886 1.974 61 HD3 PRO 8 2HD PRO 8 -2.813 -7.494 1.263 62 H SER 9 H SER 9 -2.460 -11.299 1.861 63 HA SER 9 HA SER 9 -0.592 -13.388 2.679 64 HB2 SER 9 1HB SER 9 -3.591 -13.434 3.017 65 HB3 SER 9 2HB SER 9 -2.377 -14.330 3.930 66 HG SER 9 HG SER 9 -3.383 -11.892 4.411 67 H ASP 10 H ASP 10 -1.072 -12.820 -0.146 68 HA ASP 10 HA ASP 10 -2.051 -15.478 -0.941 69 HB2 ASP 10 1HB ASP 10 -2.655 -12.820 -2.237 70 HB3 ASP 10 2HB ASP 10 -2.873 -14.356 -3.071 71 H ILE 11 H ILE 11 0.067 -12.754 -1.592 72 HA ILE 11 HA ILE 11 1.362 -13.860 -3.857 73 HB ILE 11 HB ILE 11 2.264 -11.754 -1.894 74 HG12 ILE 11 1HG1 ILE 11 1.916 -10.509 -4.276 75 HG13 ILE 11 2HG1 ILE 11 0.709 -11.783 -4.411 76 HG21 ILE 11 1HG2 ILE 11 4.234 -12.757 -2.843 77 HG22 ILE 11 2HG2 ILE 11 3.553 -12.652 -4.466 78 HG23 ILE 11 3HG2 ILE 11 3.979 -11.181 -3.592 79 HD11 ILE 11 3HD1 ILE 11 0.615 -10.472 -1.834 80 HD12 ILE 11 1HD1 ILE 11 0.397 -9.342 -3.170 81 HD13 ILE 11 2HD1 ILE 11 -0.665 -10.742 -3.017 82 H ALA 12 H ALA 12 1.963 -14.040 -0.395 83 HA ALA 12 HA ALA 12 4.523 -15.153 -0.432 84 HB1 ALA 12 1HB ALA 12 4.275 -15.374 1.797 85 HB2 ALA 12 2HB ALA 12 2.830 -14.400 1.523 86 HB3 ALA 12 3HB ALA 12 2.699 -16.154 1.654 87 H ALA 13 H ALA 13 1.380 -16.613 -0.937 88 HA ALA 13 HA ALA 13 2.268 -19.319 -0.734 89 HB1 ALA 13 1HB ALA 13 -0.195 -18.253 -2.108 90 HB2 ALA 13 2HB ALA 13 0.091 -19.914 -1.587 91 HB3 ALA 13 3HB ALA 13 -0.080 -18.631 -0.389 92 H ALA 14 H ALA 14 2.446 -16.922 -3.172 93 HA ALA 14 HA ALA 14 2.756 -18.846 -5.335 94 HB1 ALA 14 1HB ALA 14 1.624 -16.469 -5.408 95 HB2 ALA 14 2HB ALA 14 3.279 -15.943 -5.717 96 HB3 ALA 14 3HB ALA 14 2.507 -17.105 -6.796 97 H LEU 15 H LEU 15 4.691 -16.635 -3.401 98 HA LEU 15 HA LEU 15 7.087 -16.988 -4.919 99 HB2 LEU 15 1HB LEU 15 6.703 -15.985 -2.102 100 HB3 LEU 15 2HB LEU 15 8.184 -15.849 -3.048 101 HG LEU 15 HG LEU 15 5.582 -14.562 -3.854 102 HD11 LEU 15 1HD1 LEU 15 7.881 -13.135 -2.562 103 HD12 LEU 15 2HD1 LEU 15 6.554 -13.804 -1.612 104 HD13 LEU 15 3HD1 LEU 15 6.232 -12.569 -2.829 105 HD21 LEU 15 3HD2 LEU 15 6.876 -14.616 -5.753 106 HD22 LEU 15 1HD2 LEU 15 8.391 -14.524 -4.855 107 HD23 LEU 15 2HD2 LEU 15 7.387 -13.086 -5.040 108 H ARG 16 H ARG 16 5.490 -18.782 -2.471 109 HA ARG 16 HA ARG 16 7.908 -20.272 -1.778 110 HB2 ARG 16 1HB ARG 16 6.550 -19.669 0.105 111 HB3 ARG 16 2HB ARG 16 5.104 -20.313 -0.662 112 HG2 ARG 16 1HG ARG 16 7.326 -22.212 -0.257 113 HG3 ARG 16 2HG ARG 16 6.505 -21.634 1.194 114 HD2 ARG 16 1HD ARG 16 4.365 -22.188 -0.300 115 HD3 ARG 16 2HD ARG 16 5.500 -23.331 -1.018 116 HE ARG 16 HE ARG 16 5.625 -23.557 1.776 117 HH11 ARG 16 1HH1 ARG 16 3.459 -24.214 -0.869 118 HH12 ARG 16 2HH1 ARG 16 2.674 -25.535 -0.070 119 HH21 ARG 16 1HH2 ARG 16 4.599 -25.295 2.839 120 HH22 ARG 16 2HH2 ARG 16 3.323 -26.149 2.040 121 H ASP 17 H ASP 17 5.084 -20.492 -3.731 122 HA ASP 17 HA ASP 17 5.357 -23.380 -4.069 123 HB2 ASP 17 1HB ASP 17 3.102 -22.235 -3.829 124 HB3 ASP 17 2HB ASP 17 3.370 -21.563 -5.435 125 H CYS 18 H CYS 18 7.204 -21.133 -5.103 126 HA CYS 18 HA CYS 18 7.447 -22.246 -7.807 127 HB2 CYS 18 1HB CYS 18 7.791 -20.112 -8.807 128 HB3 CYS 18 2HB CYS 18 6.328 -19.976 -7.839 129 HG CYS 18 HG CYS 18 7.226 -17.682 -7.029 130 H GLN 19 H GLN 19 8.834 -22.559 -5.152 131 HA GLN 19 HA GLN 19 11.380 -21.354 -5.281 132 HB2 GLN 19 1HB GLN 19 10.345 -23.810 -3.879 133 HB3 GLN 19 2HB GLN 19 12.025 -23.305 -3.750 134 HG2 GLN 19 1HG GLN 19 11.290 -21.145 -2.847 135 HG3 GLN 19 2HG GLN 19 9.617 -21.694 -2.936 136 HE21 GLN 19 2HE2 GLN 19 9.434 -21.369 -0.686 137 HE22 GLN 19 1HE2 GLN 19 10.092 -22.505 0.437 138 H ALA 20 H ALA 20 9.985 -23.885 -7.077 139 HA ALA 20 HA ALA 20 12.395 -25.309 -7.686 140 HB1 ALA 20 1HB ALA 20 11.053 -26.784 -8.709 141 HB2 ALA 20 2HB ALA 20 9.747 -25.883 -7.938 142 HB3 ALA 20 3HB ALA 20 10.195 -25.532 -9.607 143 HA PRO 21 HA PRO 21 14.050 -22.942 -10.990 144 HB2 PRO 21 1HB PRO 21 14.880 -24.864 -12.718 145 HB3 PRO 21 2HB PRO 21 15.691 -24.539 -11.181 146 HG2 PRO 21 1HG PRO 21 13.712 -26.679 -11.863 147 HG3 PRO 21 2HG PRO 21 15.205 -26.797 -10.913 148 HD2 PRO 21 1HD PRO 21 12.758 -26.634 -9.766 149 HD3 PRO 21 2HD PRO 21 14.212 -25.949 -9.014 150 H ASP 22 H ASP 22 13.208 -21.839 -12.646 151 HA ASP 22 HA ASP 22 11.788 -21.207 -14.310 152 HB2 ASP 22 1HB ASP 22 13.217 -23.034 -15.413 153 HB3 ASP 22 2HB ASP 22 11.811 -24.078 -15.222 154 H SER 23 H SER 23 10.674 -22.322 -11.785 155 HA SER 23 HA SER 23 8.123 -23.420 -12.718 156 HB2 SER 23 1HB SER 23 9.720 -23.728 -10.319 157 HB3 SER 23 2HB SER 23 8.065 -23.266 -9.921 158 HG SER 23 HG SER 23 7.635 -25.034 -11.640 159 H PHE 24 H PHE 24 9.527 -20.493 -11.817 160 HA PHE 24 HA PHE 24 7.019 -19.331 -10.869 161 HB2 PHE 24 1HB PHE 24 8.989 -18.733 -9.597 162 HB3 PHE 24 2HB PHE 24 9.815 -18.196 -11.056 163 HD1 PHE 24 HD1 PHE 24 6.454 -17.543 -9.565 164 HD2 PHE 24 HD2 PHE 24 10.082 -15.924 -11.092 165 HE1 PHE 24 HE1 PHE 24 5.583 -15.269 -9.214 166 HE2 PHE 24 HE2 PHE 24 9.217 -13.648 -10.743 167 HZ PHE 24 HZ PHE 24 6.965 -13.317 -9.802 168 H SER 25 H SER 25 5.964 -17.648 -11.910 169 HA SER 25 HA SER 25 6.900 -16.392 -14.264 170 HB2 SER 25 1HB SER 25 5.302 -17.424 -15.874 171 HB3 SER 25 2HB SER 25 6.534 -18.552 -15.311 172 HG SER 25 HG SER 25 4.767 -19.710 -14.996 173 HA PRO 26 HA PRO 26 3.654 -13.626 -13.229 174 HB2 PRO 26 1HB PRO 26 3.134 -12.488 -15.638 175 HB3 PRO 26 2HB PRO 26 4.600 -12.147 -14.711 176 HG2 PRO 26 1HG PRO 26 4.210 -14.011 -17.021 177 HG3 PRO 26 2HG PRO 26 5.543 -12.885 -16.705 178 HD2 PRO 26 1HD PRO 26 5.727 -15.540 -16.202 179 HD3 PRO 26 2HD PRO 26 6.571 -14.322 -15.224 180 H LYS 27 H LYS 27 3.142 -16.056 -15.650 181 HA LYS 27 HA LYS 27 0.244 -15.625 -15.605 182 HB2 LYS 27 1HB LYS 27 0.115 -17.027 -17.527 183 HB3 LYS 27 2HB LYS 27 1.464 -15.931 -17.787 184 HG2 LYS 27 1HG LYS 27 2.971 -17.771 -16.960 185 HG3 LYS 27 2HG LYS 27 1.568 -18.838 -17.036 186 HD2 LYS 27 1HD LYS 27 2.591 -19.180 -19.093 187 HD3 LYS 27 2HD LYS 27 1.348 -17.985 -19.469 188 HE2 LYS 27 1HE LYS 27 3.300 -17.221 -20.540 189 HE3 LYS 27 2HE LYS 27 3.136 -16.224 -19.096 190 HZ1 LYS 27 3HZ LYS 27 4.660 -18.536 -18.520 191 HZ2 LYS 27 1HZ LYS 27 5.104 -16.908 -18.389 192 HZ3 LYS 27 2HZ LYS 27 5.327 -17.730 -19.851 193 H LYS 28 H LYS 28 2.119 -16.931 -13.514 194 HA LYS 28 HA LYS 28 0.498 -19.368 -13.167 195 HB2 LYS 28 1HB LYS 28 2.801 -19.970 -13.684 196 HB3 LYS 28 2HB LYS 28 3.389 -18.922 -12.399 197 HG2 LYS 28 1HG LYS 28 3.478 -21.152 -11.598 198 HG3 LYS 28 2HG LYS 28 2.137 -20.352 -10.774 199 HD2 LYS 28 1HD LYS 28 0.648 -21.343 -12.591 200 HD3 LYS 28 2HD LYS 28 2.029 -22.358 -13.012 201 HE2 LYS 28 1HE LYS 28 0.766 -22.207 -10.277 202 HE3 LYS 28 2HE LYS 28 0.429 -23.458 -11.472 203 HZ1 LYS 28 3HZ LYS 28 3.024 -22.915 -10.139 204 HZ2 LYS 28 1HZ LYS 28 2.834 -23.998 -11.425 205 HZ3 LYS 28 2HZ LYS 28 2.048 -24.285 -9.956 206 H PHE 29 H PHE 29 2.062 -16.618 -11.647 207 HA PHE 29 HA PHE 29 1.013 -17.289 -9.029 208 HB2 PHE 29 1HB PHE 29 2.411 -15.675 -8.190 209 HB3 PHE 29 2HB PHE 29 3.257 -16.027 -9.693 210 HD1 PHE 29 HD2 PHE 29 2.557 -14.563 -11.742 211 HD2 PHE 29 HD1 PHE 29 1.892 -13.495 -7.675 212 HE1 PHE 29 HE2 PHE 29 2.377 -12.198 -12.396 213 HE2 PHE 29 HE1 PHE 29 1.710 -11.128 -8.323 214 HZ PHE 29 HZ PHE 29 1.954 -10.477 -10.686 215 H PHE 30 H PHE 30 0.077 -15.458 -11.775 216 HA PHE 30 HA PHE 30 -1.470 -13.429 -10.733 217 HB2 PHE 30 1HB PHE 30 -2.547 -13.316 -12.813 218 HB3 PHE 30 2HB PHE 30 -0.986 -14.038 -13.193 219 HD1 PHE 30 HD1 PHE 30 -0.970 -16.684 -13.095 220 HD2 PHE 30 HD2 PHE 30 -4.428 -14.278 -13.701 221 HE1 PHE 30 HE1 PHE 30 -2.108 -18.593 -14.151 222 HE2 PHE 30 HE2 PHE 30 -5.572 -16.182 -14.757 223 HZ PHE 30 HZ PHE 30 -4.413 -18.344 -14.982 224 H GLN 31 H GLN 31 -2.134 -16.854 -10.858 225 HA GLN 31 HA GLN 31 -4.889 -16.510 -10.016 226 HB2 GLN 31 1HB GLN 31 -5.146 -18.821 -10.326 227 HB3 GLN 31 2HB GLN 31 -4.031 -18.337 -11.596 228 HG2 GLN 31 1HG GLN 31 -2.209 -18.996 -9.850 229 HG3 GLN 31 2HG GLN 31 -3.522 -19.930 -9.133 230 HE21 GLN 31 2HE2 GLN 31 -0.955 -20.278 -10.985 231 HE22 GLN 31 1HE2 GLN 31 -1.475 -21.532 -12.053 232 H ILE 32 H ILE 32 -1.786 -17.343 -8.640 233 HA ILE 32 HA ILE 32 -2.790 -18.315 -6.156 234 HB ILE 32 HB ILE 32 -0.054 -17.231 -6.837 235 HG12 ILE 32 1HG1 ILE 32 -0.687 -20.128 -6.446 236 HG13 ILE 32 2HG1 ILE 32 -1.091 -19.370 -7.983 237 HG21 ILE 32 1HG2 ILE 32 -0.054 -17.133 -4.542 238 HG22 ILE 32 2HG2 ILE 32 -1.190 -18.471 -4.377 239 HG23 ILE 32 3HG2 ILE 32 0.491 -18.790 -4.803 240 HD11 ILE 32 3HD1 ILE 32 1.634 -18.876 -6.997 241 HD12 ILE 32 1HD1 ILE 32 1.266 -20.538 -7.457 242 HD13 ILE 32 2HD1 ILE 32 1.056 -19.232 -8.624 243 H SER 33 H SER 33 -1.066 -15.290 -6.948 244 HA SER 33 HA SER 33 -1.521 -14.037 -4.487 245 HB2 SER 33 1HB SER 33 -0.973 -11.930 -5.683 246 HB3 SER 33 2HB SER 33 0.171 -13.224 -6.041 247 HG SER 33 HG SER 33 -0.630 -13.407 -8.041 248 H GLY 34 H GLY 34 -3.412 -14.042 -7.472 249 HA2 GLY 34 1HA GLY 34 -5.853 -13.982 -7.194 250 HA3 GLY 34 2HA GLY 34 -5.602 -12.749 -5.967 251 H MET 35 H MET 35 -3.581 -12.536 -8.721 252 HA MET 35 HA MET 35 -4.617 -9.987 -9.428 253 HB2 MET 35 1HB MET 35 -2.602 -11.819 -10.717 254 HB3 MET 35 2HB MET 35 -3.046 -10.272 -11.425 255 HG2 MET 35 1HG MET 35 -2.477 -9.514 -8.898 256 HG3 MET 35 2HG MET 35 -1.377 -10.877 -9.088 257 HE1 MET 35 3HE MET 35 -1.061 -9.916 -12.761 258 HE2 MET 35 1HE MET 35 0.612 -10.008 -12.208 259 HE3 MET 35 2HE MET 35 -0.572 -11.183 -11.634 260 H SER 36 H SER 36 -5.459 -13.176 -10.305 261 HA SER 36 HA SER 36 -6.341 -12.945 -12.915 262 HB2 SER 36 1HB SER 36 -7.661 -14.870 -12.527 263 HB3 SER 36 2HB SER 36 -6.309 -15.018 -11.404 264 HG SER 36 HG SER 36 -8.763 -15.195 -10.748 265 H LYS 37 H LYS 37 -7.859 -11.851 -9.946 266 HA LYS 37 HA LYS 37 -10.408 -11.270 -11.001 267 HB2 LYS 37 1HB LYS 37 -8.945 -10.009 -8.674 268 HB3 LYS 37 2HB LYS 37 -10.658 -9.805 -9.016 269 HG2 LYS 37 1HG LYS 37 -11.046 -12.165 -8.660 270 HG3 LYS 37 2HG LYS 37 -9.319 -12.436 -8.416 271 HD2 LYS 37 1HD LYS 37 -10.918 -10.543 -6.709 272 HD3 LYS 37 2HD LYS 37 -10.751 -12.258 -6.325 273 HE2 LYS 37 1HE LYS 37 -8.248 -11.902 -6.451 274 HE3 LYS 37 2HE LYS 37 -8.587 -10.173 -6.497 275 HZ1 LYS 37 3HZ LYS 37 -8.456 -11.863 -4.263 276 HZ2 LYS 37 1HZ LYS 37 -10.037 -11.273 -4.382 277 HZ3 LYS 37 2HZ LYS 37 -8.736 -10.195 -4.303 278 H LYS 38 H LYS 38 -7.386 -9.522 -11.010 279 HA LYS 38 HA LYS 38 -8.207 -6.941 -11.541 280 HB2 LYS 38 1HB LYS 38 -5.849 -8.373 -12.780 281 HB3 LYS 38 2HB LYS 38 -6.053 -6.630 -12.667 282 HG2 LYS 38 1HG LYS 38 -5.623 -8.580 -10.421 283 HG3 LYS 38 2HG LYS 38 -4.551 -7.283 -10.954 284 HD2 LYS 38 1HD LYS 38 -5.508 -6.193 -9.213 285 HD3 LYS 38 2HD LYS 38 -6.747 -5.842 -10.421 286 HE2 LYS 38 1HE LYS 38 -8.241 -7.320 -9.516 287 HE3 LYS 38 2HE LYS 38 -6.979 -8.364 -8.864 288 HZ1 LYS 38 3HZ LYS 38 -8.369 -6.947 -7.257 289 HZ2 LYS 38 1HZ LYS 38 -7.394 -5.661 -7.764 290 HZ3 LYS 38 2HZ LYS 38 -6.694 -7.013 -7.028 291 H SER 39 H SER 39 -7.883 -5.818 -13.735 292 HA SER 39 HA SER 39 -8.724 -7.387 -16.025 293 HB2 SER 39 1HB SER 39 -10.504 -5.414 -14.636 294 HB3 SER 39 2HB SER 39 -10.613 -5.602 -16.386 295 HG SER 39 HG SER 39 -10.842 -7.710 -14.498 296 H SER 40 H SER 40 -6.334 -6.115 -15.656 297 HA SER 40 HA SER 40 -4.880 -4.656 -16.622 298 HB2 SER 40 1HB SER 40 -5.747 -5.569 -18.709 299 HB3 SER 40 2HB SER 40 -7.104 -4.443 -18.667 300 HG SER 40 HG SER 40 -5.751 -3.331 -19.876 301 H SER 41 H SER 41 -7.080 -3.706 -14.771 302 HA SER 41 HA SER 41 -6.947 -0.846 -15.476 303 HB2 SER 41 1HB SER 41 -9.254 -1.766 -15.525 304 HB3 SER 41 2HB SER 41 -9.083 -2.226 -13.831 305 HG SER 41 HG SER 41 -8.958 0.407 -14.888 306 H GLN 42 H GLN 42 -5.985 -3.231 -13.307 307 HA GLN 42 HA GLN 42 -5.270 -1.189 -11.308 308 HB2 GLN 42 1HB GLN 42 -5.933 -4.084 -10.748 309 HB3 GLN 42 2HB GLN 42 -5.500 -2.866 -9.556 310 HG2 GLN 42 1HG GLN 42 -7.649 -2.421 -9.313 311 HG3 GLN 42 2HG GLN 42 -7.663 -1.798 -10.962 312 HE21 GLN 42 2HE2 GLN 42 -7.275 -4.153 -12.366 313 HE22 GLN 42 1HE2 GLN 42 -8.665 -5.160 -12.170 314 H LEU 43 H LEU 43 -4.234 -3.632 -13.425 315 HA LEU 43 HA LEU 43 -1.949 -4.635 -12.204 316 HB2 LEU 43 1HB LEU 43 -2.312 -3.984 -15.125 317 HB3 LEU 43 2HB LEU 43 -1.126 -5.096 -14.446 318 HG LEU 43 HG LEU 43 -4.005 -5.484 -14.993 319 HD11 LEU 43 1HD1 LEU 43 -1.507 -6.675 -15.649 320 HD12 LEU 43 2HD1 LEU 43 -3.112 -7.058 -16.268 321 HD13 LEU 43 3HD1 LEU 43 -2.505 -7.875 -14.828 322 HD21 LEU 43 3HD2 LEU 43 -4.260 -5.767 -12.699 323 HD22 LEU 43 1HD2 LEU 43 -2.647 -6.454 -12.505 324 HD23 LEU 43 2HD2 LEU 43 -3.922 -7.402 -13.271 325 H LYS 44 H LYS 44 -2.501 -1.559 -13.782 326 HA LYS 44 HA LYS 44 0.313 -0.825 -13.367 327 HB2 LYS 44 1HB LYS 44 -0.063 0.993 -14.918 328 HB3 LYS 44 2HB LYS 44 -0.617 -0.510 -15.643 329 HG2 LYS 44 1HG LYS 44 -2.715 0.889 -14.189 330 HG3 LYS 44 2HG LYS 44 -2.030 1.837 -15.512 331 HD2 LYS 44 1HD LYS 44 -2.302 -0.550 -16.732 332 HD3 LYS 44 2HD LYS 44 -3.634 -0.642 -15.578 333 HE2 LYS 44 1HE LYS 44 -4.668 0.361 -17.371 334 HE3 LYS 44 2HE LYS 44 -4.156 1.770 -16.443 335 HZ1 LYS 44 3HZ LYS 44 -2.094 0.979 -18.199 336 HZ2 LYS 44 1HZ LYS 44 -2.936 2.446 -18.144 337 HZ3 LYS 44 2HZ LYS 44 -3.530 1.164 -19.073 338 H GLU 45 H GLU 45 -2.283 -0.828 -11.556 339 HA GLU 45 HA GLU 45 -2.296 1.945 -10.694 340 HB2 GLU 45 1HB GLU 45 -3.892 -0.494 -10.041 341 HB3 GLU 45 2HB GLU 45 -3.859 0.825 -8.880 342 HG2 GLU 45 1HG GLU 45 -4.498 1.372 -11.743 343 HG3 GLU 45 2HG GLU 45 -5.731 0.721 -10.665 344 H ILE 46 H ILE 46 -0.957 -1.119 -9.720 345 HA ILE 46 HA ILE 46 -0.091 -0.067 -7.144 346 HB ILE 46 HB ILE 46 0.529 -2.778 -8.309 347 HG12 ILE 46 1HG1 ILE 46 -1.445 -3.102 -6.381 348 HG13 ILE 46 2HG1 ILE 46 -1.978 -1.694 -7.293 349 HG21 ILE 46 1HG2 ILE 46 0.240 -2.642 -5.453 350 HG22 ILE 46 2HG2 ILE 46 1.621 -3.164 -6.415 351 HG23 ILE 46 3HG2 ILE 46 1.424 -1.459 -6.010 352 HD11 ILE 46 3HD1 ILE 46 -1.904 -4.508 -8.050 353 HD12 ILE 46 1HD1 ILE 46 -2.899 -3.188 -8.664 354 HD13 ILE 46 2HD1 ILE 46 -1.262 -3.418 -9.278 355 H PHE 47 H PHE 47 1.103 -0.518 -10.332 356 HA PHE 47 HA PHE 47 3.215 -0.447 -11.244 357 HB2 PHE 47 1HB PHE 47 4.432 1.655 -10.521 358 HB3 PHE 47 2HB PHE 47 2.776 1.887 -11.072 359 HD1 PHE 47 HD2 PHE 47 5.021 1.929 -8.186 360 HD2 PHE 47 HD1 PHE 47 1.037 2.556 -9.546 361 HE1 PHE 47 HE2 PHE 47 4.485 3.077 -6.077 362 HE2 PHE 47 HE1 PHE 47 0.495 3.706 -7.440 363 HZ PHE 47 HZ PHE 47 2.220 3.967 -5.701 364 H ARG 48 H ARG 48 3.128 -2.352 -9.190 365 HA ARG 48 HA ARG 48 5.926 -2.312 -8.367 366 HB2 ARG 48 1HB ARG 48 3.605 -2.633 -6.464 367 HB3 ARG 48 2HB ARG 48 5.244 -3.133 -6.072 368 HG2 ARG 48 1HG ARG 48 6.032 -0.953 -6.006 369 HG3 ARG 48 2HG ARG 48 4.681 -0.334 -6.957 370 HD2 ARG 48 1HD ARG 48 3.220 -1.067 -4.974 371 HD3 ARG 48 2HD ARG 48 4.733 -1.162 -4.074 372 HE ARG 48 HE ARG 48 4.852 1.308 -5.114 373 HH11 ARG 48 1HH1 ARG 48 2.339 -0.379 -3.394 374 HH12 ARG 48 2HH1 ARG 48 1.679 1.057 -2.685 375 HH21 ARG 48 1HH2 ARG 48 3.992 3.207 -4.188 376 HH22 ARG 48 2HH2 ARG 48 2.620 3.097 -3.139 377 H ILE 49 H ILE 49 3.850 -3.808 -10.127 378 HA ILE 49 HA ILE 49 4.722 -6.502 -9.315 379 HB ILE 49 HB ILE 49 2.634 -7.439 -10.122 380 HG12 ILE 49 1HG1 ILE 49 2.287 -5.521 -11.796 381 HG13 ILE 49 2HG1 ILE 49 0.855 -6.178 -11.011 382 HG21 ILE 49 1HG2 ILE 49 2.499 -5.291 -8.044 383 HG22 ILE 49 2HG2 ILE 49 1.065 -6.231 -8.454 384 HG23 ILE 49 3HG2 ILE 49 2.506 -7.043 -7.842 385 HD11 ILE 49 3HD1 ILE 49 1.921 -4.019 -9.459 386 HD12 ILE 49 1HD1 ILE 49 1.670 -3.511 -11.129 387 HD13 ILE 49 2HD1 ILE 49 0.332 -4.190 -10.202 388 H LEU 50 H LEU 50 4.966 -4.141 -11.586 389 HA LEU 50 HA LEU 50 5.405 -6.076 -13.765 390 HB2 LEU 50 1HB LEU 50 5.069 -3.154 -14.264 391 HB3 LEU 50 2HB LEU 50 4.738 -4.517 -15.331 392 HG LEU 50 HG LEU 50 3.058 -3.941 -12.905 393 HD11 LEU 50 1HD1 LEU 50 3.012 -1.942 -14.269 394 HD12 LEU 50 2HD1 LEU 50 1.485 -2.811 -14.419 395 HD13 LEU 50 3HD1 LEU 50 2.681 -2.903 -15.711 396 HD21 LEU 50 3HD2 LEU 50 1.481 -5.370 -13.901 397 HD22 LEU 50 1HD2 LEU 50 3.031 -6.186 -14.106 398 HD23 LEU 50 2HD2 LEU 50 2.302 -5.326 -15.463 399 H ASP 51 H ASP 51 6.494 -2.785 -12.917 400 HA ASP 51 HA ASP 51 9.268 -3.699 -13.147 401 HB2 ASP 51 1HB ASP 51 8.176 -2.456 -15.256 402 HB3 ASP 51 2HB ASP 51 8.652 -1.041 -14.323 403 H ASN 52 H ASN 52 10.661 -1.487 -12.692 404 HA ASN 52 HA ASN 52 9.502 -0.244 -10.292 405 HB2 ASN 52 1HB ASN 52 11.052 -2.082 -9.650 406 HB3 ASN 52 2HB ASN 52 12.345 -1.255 -10.514 407 HD21 ASN 52 2HD2 ASN 52 13.660 -0.755 -8.862 408 HD22 ASN 52 1HD2 ASN 52 13.222 0.263 -7.536 409 H ASP 53 H ASP 53 10.505 0.329 -13.275 410 HA ASP 53 HA ASP 53 11.723 2.921 -12.578 411 HB2 ASP 53 1HB ASP 53 13.190 1.197 -13.805 412 HB3 ASP 53 2HB ASP 53 12.174 1.524 -15.206 413 H GLN 54 H GLN 54 9.560 1.177 -14.747 414 HA GLN 54 HA GLN 54 7.893 1.865 -16.139 415 HB2 GLN 54 1HB GLN 54 7.516 3.058 -13.647 416 HB3 GLN 54 2HB GLN 54 7.274 4.364 -14.799 417 HG2 GLN 54 1HG GLN 54 5.172 3.305 -14.304 418 HG3 GLN 54 2HG GLN 54 5.617 2.996 -15.982 419 HE21 GLN 54 2HE2 GLN 54 5.004 1.630 -12.890 420 HE22 GLN 54 1HE2 GLN 54 5.136 -0.030 -13.352 421 H SER 55 H SER 55 10.612 2.829 -16.680 422 HA SER 55 HA SER 55 10.530 5.519 -17.566 423 HB2 SER 55 1HB SER 55 12.600 4.088 -17.106 424 HB3 SER 55 2HB SER 55 12.332 3.380 -18.699 425 HG SER 55 HG SER 55 13.742 5.110 -18.899 426 H GLY 56 H GLY 56 9.391 2.557 -18.909 427 HA2 GLY 56 1HA GLY 56 7.759 3.554 -20.824 428 HA3 GLY 56 2HA GLY 56 9.316 3.505 -21.637 429 H PHE 57 H PHE 57 10.001 1.083 -19.935 430 HA PHE 57 HA PHE 57 8.178 -0.969 -20.732 431 HB2 PHE 57 1HB PHE 57 9.404 -2.036 -22.434 432 HB3 PHE 57 2HB PHE 57 9.458 -0.330 -22.866 433 HD1 PHE 57 HD1 PHE 57 11.546 0.887 -21.527 434 HD2 PHE 57 HD2 PHE 57 11.350 -3.152 -22.856 435 HE1 PHE 57 HE1 PHE 57 14.004 0.793 -21.593 436 HE2 PHE 57 HE2 PHE 57 13.807 -3.253 -22.923 437 HZ PHE 57 HZ PHE 57 15.137 -1.279 -22.290 438 H ILE 58 H ILE 58 9.785 -3.168 -20.719 439 HA ILE 58 HA ILE 58 11.281 -2.975 -18.190 440 HB ILE 58 HB ILE 58 9.560 -5.334 -18.941 441 HG12 ILE 58 1HG1 ILE 58 8.928 -3.095 -17.005 442 HG13 ILE 58 2HG1 ILE 58 8.165 -3.325 -18.575 443 HG21 ILE 58 1HG2 ILE 58 11.014 -4.540 -16.426 444 HG22 ILE 58 2HG2 ILE 58 9.841 -5.853 -16.511 445 HG23 ILE 58 3HG2 ILE 58 11.327 -5.937 -17.456 446 HD11 ILE 58 3HD1 ILE 58 7.673 -5.720 -17.509 447 HD12 ILE 58 1HD1 ILE 58 7.750 -4.758 -16.033 448 HD13 ILE 58 2HD1 ILE 58 6.603 -4.333 -17.304 449 H GLU 59 H GLU 59 12.970 -4.505 -17.904 450 HA GLU 59 HA GLU 59 13.763 -5.998 -20.303 451 HB2 GLU 59 1HB GLU 59 14.916 -3.672 -19.966 452 HB3 GLU 59 2HB GLU 59 15.838 -4.516 -18.730 453 HG2 GLU 59 1HG GLU 59 16.777 -6.000 -20.300 454 HG3 GLU 59 2HG GLU 59 15.634 -5.516 -21.552 455 H GLU 60 H GLU 60 15.635 -7.503 -19.799 456 HA GLU 60 HA GLU 60 14.911 -9.263 -17.760 457 HB2 GLU 60 1HB GLU 60 17.611 -9.014 -19.097 458 HB3 GLU 60 2HB GLU 60 17.015 -10.419 -18.224 459 HG2 GLU 60 1HG GLU 60 15.530 -10.995 -19.891 460 HG3 GLU 60 2HG GLU 60 15.490 -9.365 -20.561 461 H ASP 61 H ASP 61 16.809 -6.408 -17.656 462 HA ASP 61 HA ASP 61 18.305 -7.055 -15.301 463 HB2 ASP 61 1HB ASP 61 19.043 -5.363 -16.975 464 HB3 ASP 61 2HB ASP 61 17.708 -4.330 -16.471 465 H GLU 62 H GLU 62 15.087 -6.464 -15.782 466 HA GLU 62 HA GLU 62 14.759 -5.447 -13.035 467 HB2 GLU 62 1HB GLU 62 13.322 -4.760 -15.562 468 HB3 GLU 62 2HB GLU 62 12.424 -4.731 -14.051 469 HG2 GLU 62 1HG GLU 62 15.006 -3.247 -14.412 470 HG3 GLU 62 2HG GLU 62 13.442 -2.549 -14.829 471 H LEU 63 H LEU 63 14.922 -8.221 -14.157 472 HA LEU 63 HA LEU 63 12.307 -9.180 -13.193 473 HB2 LEU 63 1HB LEU 63 14.072 -10.707 -15.081 474 HB3 LEU 63 2HB LEU 63 12.373 -10.983 -14.703 475 HG LEU 63 HG LEU 63 13.484 -8.684 -16.312 476 HD11 LEU 63 1HD1 LEU 63 11.576 -10.516 -17.544 477 HD12 LEU 63 2HD1 LEU 63 13.110 -11.272 -17.114 478 HD13 LEU 63 3HD1 LEU 63 13.088 -9.859 -18.169 479 HD21 LEU 63 3HD2 LEU 63 11.505 -7.668 -16.176 480 HD22 LEU 63 1HD2 LEU 63 11.166 -8.735 -14.813 481 HD23 LEU 63 2HD2 LEU 63 10.624 -9.175 -16.433 482 H LYS 64 H LYS 64 15.718 -10.136 -13.577 483 HA LYS 64 HA LYS 64 15.812 -12.320 -11.929 484 HB2 LYS 64 1HB LYS 64 18.194 -11.609 -11.433 485 HB3 LYS 64 2HB LYS 64 17.769 -11.744 -13.134 486 HG2 LYS 64 1HG LYS 64 17.225 -9.157 -12.773 487 HG3 LYS 64 2HG LYS 64 18.461 -9.361 -11.530 488 HD2 LYS 64 1HD LYS 64 18.752 -10.073 -14.449 489 HD3 LYS 64 2HD LYS 64 19.443 -8.655 -13.657 490 HE2 LYS 64 1HE LYS 64 21.245 -10.047 -13.564 491 HE3 LYS 64 2HE LYS 64 20.457 -10.500 -12.054 492 HZ1 LYS 64 3HZ LYS 64 19.753 -12.487 -12.911 493 HZ2 LYS 64 1HZ LYS 64 21.221 -12.312 -13.733 494 HZ3 LYS 64 2HZ LYS 64 19.766 -11.947 -14.514 495 H TYR 65 H TYR 65 15.799 -8.923 -11.005 496 HA TYR 65 HA TYR 65 15.803 -9.713 -8.173 497 HB2 TYR 65 1HB TYR 65 16.392 -7.065 -9.504 498 HB3 TYR 65 2HB TYR 65 16.251 -7.268 -7.761 499 HD1 TYR 65 HD1 TYR 65 17.767 -9.254 -6.801 500 HD2 TYR 65 HD2 TYR 65 18.509 -7.128 -10.411 501 HE1 TYR 65 HE1 TYR 65 20.141 -9.886 -6.678 502 HE2 TYR 65 HE2 TYR 65 20.885 -7.755 -10.298 503 HH TYR 65 HH TYR 65 22.115 -10.055 -8.854 504 H PHE 66 H PHE 66 13.470 -10.286 -9.350 505 HA PHE 66 HA PHE 66 11.649 -8.040 -8.940 506 HB2 PHE 66 1HB PHE 66 11.375 -9.422 -10.965 507 HB3 PHE 66 2HB PHE 66 11.093 -10.836 -9.955 508 HD1 PHE 66 HD2 PHE 66 9.032 -11.022 -8.632 509 HD2 PHE 66 HD1 PHE 66 9.672 -7.801 -11.340 510 HE1 PHE 66 HE2 PHE 66 6.627 -10.506 -8.581 511 HE2 PHE 66 HE1 PHE 66 7.269 -7.279 -11.292 512 HZ PHE 66 HZ PHE 66 5.742 -8.632 -9.912 513 H LEU 67 H LEU 67 11.777 -11.473 -7.971 514 HA LEU 67 HA LEU 67 9.821 -11.423 -6.030 515 HB2 LEU 67 1HB LEU 67 12.377 -12.999 -5.822 516 HB3 LEU 67 2HB LEU 67 10.812 -13.400 -5.118 517 HG LEU 67 HG LEU 67 11.560 -13.463 -8.039 518 HD11 LEU 67 1HD1 LEU 67 12.310 -15.322 -6.476 519 HD12 LEU 67 2HD1 LEU 67 11.371 -15.797 -7.891 520 HD13 LEU 67 3HD1 LEU 67 10.599 -15.720 -6.307 521 HD21 LEU 67 3HD2 LEU 67 9.400 -13.043 -8.420 522 HD22 LEU 67 1HD2 LEU 67 8.969 -13.251 -6.723 523 HD23 LEU 67 2HD2 LEU 67 9.100 -14.659 -7.778 524 H GLN 68 H GLN 68 13.087 -10.225 -5.880 525 HA GLN 68 HA GLN 68 13.603 -10.096 -3.193 526 HB2 GLN 68 1HB GLN 68 15.024 -9.276 -5.168 527 HB3 GLN 68 2HB GLN 68 14.150 -7.758 -5.009 528 HG2 GLN 68 1HG GLN 68 15.198 -7.190 -3.086 529 HG3 GLN 68 2HG GLN 68 15.368 -8.861 -2.553 530 HE21 GLN 68 2HE2 GLN 68 16.717 -10.065 -4.504 531 HE22 GLN 68 1HE2 GLN 68 18.269 -9.341 -4.736 532 H ARG 69 H ARG 69 11.678 -7.809 -5.108 533 HA ARG 69 HA ARG 69 11.130 -5.906 -3.196 534 HB2 ARG 69 1HB ARG 69 9.694 -6.922 -5.591 535 HB3 ARG 69 2HB ARG 69 8.775 -5.926 -4.470 536 HG2 ARG 69 1HG ARG 69 11.367 -5.128 -5.779 537 HG3 ARG 69 2HG ARG 69 9.758 -4.623 -6.297 538 HD2 ARG 69 1HD ARG 69 11.199 -3.945 -3.748 539 HD3 ARG 69 2HD ARG 69 10.609 -2.847 -4.995 540 HE ARG 69 HE ARG 69 8.344 -4.010 -4.131 541 HH11 ARG 69 1HH1 ARG 69 10.997 -2.503 -2.454 542 HH12 ARG 69 2HH1 ARG 69 10.022 -1.959 -1.130 543 HH21 ARG 69 1HH2 ARG 69 7.050 -3.300 -2.393 544 HH22 ARG 69 2HH2 ARG 69 7.777 -2.413 -1.095 545 H PHE 70 H PHE 70 8.756 -8.424 -4.043 546 HA PHE 70 HA PHE 70 7.274 -8.132 -1.672 547 HB2 PHE 70 1HB PHE 70 7.423 -10.433 -3.628 548 HB3 PHE 70 2HB PHE 70 6.240 -10.319 -2.329 549 HD1 PHE 70 HD2 PHE 70 7.420 -8.704 -5.436 550 HD2 PHE 70 HD1 PHE 70 4.292 -9.027 -2.568 551 HE1 PHE 70 HE2 PHE 70 5.943 -7.395 -6.905 552 HE2 PHE 70 HE1 PHE 70 2.809 -7.719 -4.033 553 HZ PHE 70 HZ PHE 70 3.635 -6.901 -6.204 554 H GLU 71 H GLU 71 9.029 -11.089 -2.595 555 HA GLU 71 HA GLU 71 9.130 -12.237 -0.092 556 HB2 GLU 71 1HB GLU 71 9.874 -13.127 -2.438 557 HB3 GLU 71 2HB GLU 71 11.457 -12.535 -1.955 558 HG2 GLU 71 1HG GLU 71 11.134 -14.926 -1.484 559 HG3 GLU 71 2HG GLU 71 11.474 -13.978 -0.037 560 H SER 72 H SER 72 11.076 -12.600 1.287 561 HA SER 72 HA SER 72 12.633 -10.111 1.561 562 HB2 SER 72 1HB SER 72 11.236 -11.790 3.609 563 HB3 SER 72 2HB SER 72 12.697 -10.917 4.070 564 HG SER 72 HG SER 72 11.258 -9.386 4.393 565 H GLY 73 H GLY 73 13.069 -12.935 0.342 566 HA2 GLY 73 1HA GLY 73 15.783 -13.207 1.422 567 HA3 GLY 73 2HA GLY 73 14.750 -14.628 1.400 568 H ALA 74 H ALA 74 14.135 -12.547 -1.189 569 HA ALA 74 HA ALA 74 15.187 -14.454 -3.068 570 HB1 ALA 74 1HB ALA 74 13.638 -13.611 -4.418 571 HB2 ALA 74 2HB ALA 74 13.145 -12.554 -3.095 572 HB3 ALA 74 3HB ALA 74 14.320 -11.990 -4.283 573 H ARG 75 H ARG 75 17.151 -14.438 -3.931 574 HA ARG 75 HA ARG 75 18.793 -12.024 -3.652 575 HB2 ARG 75 1HB ARG 75 20.522 -13.927 -4.525 576 HB3 ARG 75 2HB ARG 75 20.188 -13.597 -2.831 577 HG2 ARG 75 1HG ARG 75 18.751 -15.438 -2.639 578 HG3 ARG 75 2HG ARG 75 18.610 -15.615 -4.389 579 HD2 ARG 75 1HD ARG 75 20.707 -16.572 -4.591 580 HD3 ARG 75 2HD ARG 75 21.280 -15.880 -3.074 581 HE ARG 75 HE ARG 75 20.474 -17.718 -1.982 582 HH11 ARG 75 1HH1 ARG 75 19.008 -17.546 -5.135 583 HH12 ARG 75 2HH1 ARG 75 18.231 -19.089 -5.001 584 HH21 ARG 75 1HH2 ARG 75 19.456 -19.751 -1.794 585 HH22 ARG 75 2HH2 ARG 75 18.486 -20.342 -3.100 586 H VAL 76 H VAL 76 18.817 -14.671 -6.031 587 HA VAL 76 HA VAL 76 18.446 -12.720 -8.183 588 HB VAL 76 HB VAL 76 20.623 -14.783 -8.395 589 HG11 VAL 76 1HG1 VAL 76 20.223 -14.055 -10.521 590 HG12 VAL 76 2HG1 VAL 76 19.664 -12.467 -9.992 591 HG13 VAL 76 3HG1 VAL 76 21.389 -12.835 -10.010 592 HG21 VAL 76 3HG2 VAL 76 21.594 -13.605 -6.701 593 HG22 VAL 76 1HG2 VAL 76 22.068 -12.584 -8.058 594 HG23 VAL 76 2HG2 VAL 76 20.689 -12.134 -7.056 595 H LEU 77 H LEU 77 16.700 -13.446 -9.207 596 HA LEU 77 HA LEU 77 15.651 -16.008 -9.128 597 HB2 LEU 77 1HB LEU 77 15.272 -13.619 -10.808 598 HB3 LEU 77 2HB LEU 77 14.745 -15.141 -11.523 599 HG LEU 77 HG LEU 77 13.821 -14.476 -8.771 600 HD11 LEU 77 1HD1 LEU 77 11.810 -13.448 -10.237 601 HD12 LEU 77 2HD1 LEU 77 13.195 -12.929 -11.198 602 HD13 LEU 77 3HD1 LEU 77 13.082 -12.476 -9.497 603 HD21 LEU 77 3HD2 LEU 77 12.819 -16.017 -11.137 604 HD22 LEU 77 1HD2 LEU 77 11.726 -15.525 -9.842 605 HD23 LEU 77 2HD2 LEU 77 13.103 -16.569 -9.485 606 H THR 78 H THR 78 15.282 -17.375 -11.180 607 HA THR 78 HA THR 78 17.853 -18.306 -12.044 608 HB THR 78 HB THR 78 16.666 -20.076 -13.184 609 HG1 THR 78 HG1 THR 78 14.335 -20.016 -13.209 610 HG21 THR 78 3HG2 THR 78 15.198 -20.893 -11.282 611 HG22 THR 78 1HG2 THR 78 15.552 -19.365 -10.477 612 HG23 THR 78 2HG2 THR 78 16.860 -20.485 -10.858 613 H ALA 79 H ALA 79 18.278 -18.788 -14.376 614 HA ALA 79 HA ALA 79 17.997 -16.369 -15.906 615 HB1 ALA 79 1HB ALA 79 20.073 -17.761 -15.848 616 HB2 ALA 79 2HB ALA 79 19.215 -18.973 -16.801 617 HB3 ALA 79 3HB ALA 79 19.498 -17.365 -17.468 618 H SER 80 H SER 80 15.964 -18.898 -15.419 619 HA SER 80 HA SER 80 14.912 -18.870 -18.164 620 HB2 SER 80 1HB SER 80 14.982 -20.887 -16.016 621 HB3 SER 80 2HB SER 80 13.447 -20.781 -16.877 622 HG SER 80 HG SER 80 14.391 -21.437 -18.685 623 H GLU 81 H GLU 81 13.908 -18.571 -14.773 624 HA GLU 81 HA GLU 81 11.214 -18.035 -15.160 625 HB2 GLU 81 1HB GLU 81 13.144 -17.094 -13.045 626 HB3 GLU 81 2HB GLU 81 11.430 -16.707 -12.989 627 HG2 GLU 81 1HG GLU 81 10.810 -18.914 -12.637 628 HG3 GLU 81 2HG GLU 81 12.340 -19.542 -13.245 629 H THR 82 H THR 82 13.890 -15.699 -14.896 630 HA THR 82 HA THR 82 12.462 -13.359 -15.237 631 HB THR 82 HB THR 82 14.531 -12.342 -16.080 632 HG1 THR 82 HG1 THR 82 15.823 -13.582 -17.194 633 HG21 THR 82 3HG2 THR 82 15.483 -14.256 -14.003 634 HG22 THR 82 1HG2 THR 82 14.136 -13.187 -13.612 635 HG23 THR 82 2HG2 THR 82 15.688 -12.507 -14.102 636 H LYS 83 H LYS 83 13.985 -15.350 -17.768 637 HA LYS 83 HA LYS 83 13.336 -13.869 -19.991 638 HB2 LYS 83 1HB LYS 83 14.733 -15.878 -20.074 639 HB3 LYS 83 2HB LYS 83 13.331 -16.882 -19.728 640 HG2 LYS 83 1HG LYS 83 12.328 -16.289 -21.836 641 HG3 LYS 83 2HG LYS 83 13.635 -15.152 -22.174 642 HD2 LYS 83 1HD LYS 83 14.359 -16.964 -23.373 643 HD3 LYS 83 2HD LYS 83 15.131 -17.295 -21.820 644 HE2 LYS 83 1HE LYS 83 13.693 -19.010 -21.317 645 HE3 LYS 83 2HE LYS 83 12.388 -18.349 -22.302 646 HZ1 LYS 83 3HZ LYS 83 13.840 -20.432 -23.042 647 HZ2 LYS 83 1HZ LYS 83 14.779 -19.201 -23.724 648 HZ3 LYS 83 2HZ LYS 83 13.151 -19.358 -24.152 649 H THR 84 H THR 84 11.321 -16.249 -18.308 650 HA THR 84 HA THR 84 9.084 -15.726 -20.089 651 HB THR 84 HB THR 84 9.463 -18.030 -19.352 652 HG1 THR 84 HG1 THR 84 7.364 -18.276 -19.374 653 HG21 THR 84 3HG2 THR 84 10.424 -17.834 -17.211 654 HG22 THR 84 1HG2 THR 84 8.838 -18.550 -16.929 655 HG23 THR 84 2HG2 THR 84 9.099 -16.834 -16.616 656 H PHE 85 H PHE 85 9.863 -13.445 -18.714 657 HA PHE 85 HA PHE 85 7.624 -13.078 -16.834 658 HB2 PHE 85 1HB PHE 85 10.191 -12.904 -16.084 659 HB3 PHE 85 2HB PHE 85 9.969 -11.259 -16.671 660 HD1 PHE 85 HD2 PHE 85 8.398 -13.771 -14.418 661 HD2 PHE 85 HD1 PHE 85 9.093 -9.657 -15.261 662 HE1 PHE 85 HE2 PHE 85 7.338 -13.158 -12.284 663 HE2 PHE 85 HE1 PHE 85 8.035 -9.038 -13.128 664 HZ PHE 85 HZ PHE 85 7.154 -10.789 -11.637 665 H LEU 86 H LEU 86 9.745 -11.419 -19.153 666 HA LEU 86 HA LEU 86 7.515 -9.584 -19.742 667 HB2 LEU 86 1HB LEU 86 9.193 -7.936 -20.420 668 HB3 LEU 86 2HB LEU 86 9.360 -8.401 -18.728 669 HG LEU 86 HG LEU 86 11.206 -9.981 -19.535 670 HD11 LEU 86 1HD1 LEU 86 10.399 -8.798 -22.029 671 HD12 LEU 86 2HD1 LEU 86 11.516 -10.128 -21.726 672 HD13 LEU 86 3HD1 LEU 86 12.100 -8.464 -21.701 673 HD21 LEU 86 3HD2 LEU 86 12.859 -8.272 -19.341 674 HD22 LEU 86 1HD2 LEU 86 11.512 -7.834 -18.290 675 HD23 LEU 86 2HD2 LEU 86 11.715 -7.028 -19.846 676 H ALA 87 H ALA 87 9.778 -11.862 -20.972 677 HA ALA 87 HA ALA 87 9.604 -11.100 -23.724 678 HB1 ALA 87 1HB ALA 87 11.136 -12.707 -24.097 679 HB2 ALA 87 2HB ALA 87 11.314 -12.662 -22.343 680 HB3 ALA 87 3HB ALA 87 10.297 -13.891 -23.095 681 H ALA 88 H ALA 88 7.600 -12.866 -21.581 682 HA ALA 88 HA ALA 88 6.344 -14.658 -23.329 683 HB1 ALA 88 1HB ALA 88 5.379 -13.290 -20.831 684 HB2 ALA 88 2HB ALA 88 4.417 -14.487 -21.699 685 HB3 ALA 88 3HB ALA 88 5.978 -14.940 -21.014 686 H ALA 89 H ALA 89 5.644 -11.271 -22.581 687 HA ALA 89 HA ALA 89 3.226 -10.946 -23.864 688 HB1 ALA 89 1HB ALA 89 3.692 -8.975 -22.914 689 HB2 ALA 89 2HB ALA 89 5.434 -9.200 -23.080 690 HB3 ALA 89 3HB ALA 89 4.490 -8.594 -24.441 691 H ASP 90 H ASP 90 6.216 -9.777 -25.386 692 HA ASP 90 HA ASP 90 6.804 -9.585 -27.582 693 HB2 ASP 90 1HB ASP 90 5.784 -12.387 -27.316 694 HB3 ASP 90 2HB ASP 90 6.239 -11.787 -28.908 695 H HIS 91 H HIS 91 4.365 -8.352 -26.977 696 HA HIS 91 HA HIS 91 2.836 -8.800 -29.457 697 HB2 HIS 91 1HB HIS 91 1.973 -8.400 -26.672 698 HB3 HIS 91 2HB HIS 91 1.108 -7.418 -27.851 699 HD1 HIS 91 HD1 HIS 91 -0.116 -8.788 -29.801 700 HD2 HIS 91 HD2 HIS 91 1.194 -11.018 -26.550 701 HE1 HIS 91 HE1 HIS 91 -1.344 -10.978 -29.949 702 H ASP 92 H ASP 92 4.725 -6.635 -27.649 703 HA ASP 92 HA ASP 92 3.631 -4.219 -28.793 704 HB2 ASP 92 1HB ASP 92 4.832 -4.520 -26.498 705 HB3 ASP 92 2HB ASP 92 6.309 -4.377 -27.447 706 H GLY 93 H GLY 93 6.299 -6.408 -29.410 707 HA2 GLY 93 1HA GLY 93 6.617 -6.010 -32.060 708 HA3 GLY 93 2HA GLY 93 7.511 -4.661 -31.375 709 H ASP 94 H ASP 94 8.806 -5.655 -29.269 710 HA ASP 94 HA ASP 94 10.279 -8.001 -30.257 711 HB2 ASP 94 1HB ASP 94 11.257 -5.307 -29.991 712 HB3 ASP 94 2HB ASP 94 12.128 -6.368 -28.887 713 H GLY 95 H GLY 95 8.228 -7.383 -28.083 714 HA2 GLY 95 1HA GLY 95 7.916 -8.727 -26.150 715 HA3 GLY 95 2HA GLY 95 9.662 -8.831 -25.974 716 H LYS 96 H LYS 96 9.467 -5.748 -26.582 717 HA LYS 96 HA LYS 96 9.851 -4.895 -23.939 718 HB2 LYS 96 1HB LYS 96 10.009 -2.698 -24.809 719 HB3 LYS 96 2HB LYS 96 10.634 -3.756 -26.068 720 HG2 LYS 96 1HG LYS 96 8.045 -3.625 -26.798 721 HG3 LYS 96 2HG LYS 96 8.245 -2.041 -26.045 722 HD2 LYS 96 1HD LYS 96 9.777 -1.342 -27.605 723 HD3 LYS 96 2HD LYS 96 10.324 -2.983 -27.960 724 HE2 LYS 96 1HE LYS 96 8.386 -3.434 -29.260 725 HE3 LYS 96 2HE LYS 96 7.592 -1.960 -28.707 726 HZ1 LYS 96 3HZ LYS 96 10.022 -2.078 -30.411 727 HZ2 LYS 96 1HZ LYS 96 9.260 -0.664 -29.880 728 HZ3 LYS 96 2HZ LYS 96 8.460 -1.707 -30.944 729 H ILE 97 H ILE 97 8.534 -4.032 -22.418 730 HA ILE 97 HA ILE 97 5.676 -4.334 -22.823 731 HB ILE 97 HB ILE 97 6.941 -3.321 -20.297 732 HG12 ILE 97 1HG1 ILE 97 8.223 -5.298 -20.907 733 HG13 ILE 97 2HG1 ILE 97 7.156 -5.675 -19.559 734 HG21 ILE 97 1HG2 ILE 97 4.775 -3.325 -19.749 735 HG22 ILE 97 2HG2 ILE 97 4.335 -4.308 -21.145 736 HG23 ILE 97 3HG2 ILE 97 4.929 -5.080 -19.675 737 HD11 ILE 97 3HD1 ILE 97 7.088 -7.506 -21.053 738 HD12 ILE 97 1HD1 ILE 97 5.559 -6.645 -21.224 739 HD13 ILE 97 2HD1 ILE 97 6.822 -6.451 -22.440 740 H GLY 98 H GLY 98 4.163 -2.646 -22.137 741 HA2 GLY 98 1HA GLY 98 5.083 0.069 -21.930 742 HA3 GLY 98 2HA GLY 98 4.380 -0.291 -23.500 743 H ALA 99 H ALA 99 3.515 -1.231 -20.173 744 HA ALA 99 HA ALA 99 1.503 -1.231 -19.095 745 HB1 ALA 99 1HB ALA 99 0.923 1.376 -20.454 746 HB2 ALA 99 2HB ALA 99 0.537 0.868 -18.809 747 HB3 ALA 99 3HB ALA 99 2.204 1.240 -19.249 748 H GLU 100 H GLU 100 1.472 -2.649 -21.532 749 HA GLU 100 HA GLU 100 -1.375 -2.568 -22.087 750 HB2 GLU 100 1HB GLU 100 0.721 -2.123 -24.209 751 HB3 GLU 100 2HB GLU 100 -0.903 -2.682 -24.585 752 HG2 GLU 100 1HG GLU 100 -0.264 -0.111 -23.159 753 HG3 GLU 100 2HG GLU 100 -0.603 -0.253 -24.882 754 H GLU 101 H GLU 101 1.742 -4.060 -22.902 755 HA GLU 101 HA GLU 101 0.599 -6.551 -23.687 756 HB2 GLU 101 1HB GLU 101 3.437 -6.182 -22.757 757 HB3 GLU 101 2HB GLU 101 2.813 -7.329 -23.934 758 HG2 GLU 101 1HG GLU 101 3.326 -4.402 -24.248 759 HG3 GLU 101 2HG GLU 101 3.913 -5.747 -25.224 760 H PHE 102 H PHE 102 2.350 -5.493 -20.774 761 HA PHE 102 HA PHE 102 2.294 -7.860 -19.349 762 HB2 PHE 102 1HB PHE 102 3.155 -5.323 -18.833 763 HB3 PHE 102 2HB PHE 102 1.789 -5.451 -17.730 764 HD1 PHE 102 HD1 PHE 102 1.784 -8.019 -16.642 765 HD2 PHE 102 HD2 PHE 102 5.156 -5.690 -17.793 766 HE1 PHE 102 HE1 PHE 102 3.185 -9.266 -15.049 767 HE2 PHE 102 HE2 PHE 102 6.562 -6.933 -16.203 768 HZ PHE 102 HZ PHE 102 5.578 -8.725 -14.829 769 H GLN 103 H GLN 103 -0.236 -5.470 -19.793 770 HA GLN 103 HA GLN 103 -2.001 -6.429 -17.806 771 HB2 GLN 103 1HB GLN 103 -2.327 -4.735 -20.259 772 HB3 GLN 103 2HB GLN 103 -3.743 -5.277 -19.369 773 HG2 GLN 103 1HG GLN 103 -2.991 -3.022 -18.730 774 HG3 GLN 103 2HG GLN 103 -2.997 -4.161 -17.385 775 HE21 GLN 103 2HE2 GLN 103 -0.710 -3.387 -19.988 776 HE22 GLN 103 1HE2 GLN 103 0.648 -3.134 -18.951 777 H GLU 104 H GLU 104 -2.260 -6.785 -21.350 778 HA GLU 104 HA GLU 104 -4.278 -8.690 -21.351 779 HB2 GLU 104 1HB GLU 104 -3.894 -8.918 -23.612 780 HB3 GLU 104 2HB GLU 104 -3.135 -7.363 -23.302 781 HG2 GLU 104 1HG GLU 104 -1.004 -8.856 -22.919 782 HG3 GLU 104 2HG GLU 104 -1.898 -9.988 -23.932 783 H MET 105 H MET 105 -0.905 -9.032 -20.661 784 HA MET 105 HA MET 105 -0.618 -11.794 -21.154 785 HB2 MET 105 1HB MET 105 1.345 -10.447 -20.892 786 HB3 MET 105 2HB MET 105 0.842 -9.922 -19.290 787 HG2 MET 105 1HG MET 105 0.944 -12.476 -18.749 788 HG3 MET 105 2HG MET 105 2.002 -12.521 -20.158 789 HE1 MET 105 3HE MET 105 4.219 -9.417 -19.040 790 HE2 MET 105 1HE MET 105 4.754 -10.873 -19.880 791 HE3 MET 105 2HE MET 105 3.250 -10.084 -20.355 792 H VAL 106 H VAL 106 -1.942 -9.990 -18.479 793 HA VAL 106 HA VAL 106 -2.140 -12.392 -16.827 794 HB VAL 106 HB VAL 106 -3.007 -9.572 -16.175 795 HG11 VAL 106 1HG1 VAL 106 -2.448 -11.809 -14.249 796 HG12 VAL 106 2HG1 VAL 106 -3.282 -10.283 -13.952 797 HG13 VAL 106 3HG1 VAL 106 -4.051 -11.534 -14.930 798 HG21 VAL 106 3HG2 VAL 106 -0.664 -9.484 -16.470 799 HG22 VAL 106 1HG2 VAL 106 -0.924 -9.623 -14.731 800 HG23 VAL 106 2HG2 VAL 106 -0.427 -11.035 -15.664 801 H GLN 107 H GLN 107 -4.264 -9.895 -18.212 802 HA GLN 107 HA GLN 107 -6.691 -11.055 -17.395 803 HB2 GLN 107 1HB GLN 107 -6.201 -9.326 -19.826 804 HB3 GLN 107 2HB GLN 107 -7.747 -9.595 -19.031 805 HG2 GLN 107 1HG GLN 107 -5.413 -7.970 -18.133 806 HG3 GLN 107 2HG GLN 107 -7.117 -7.529 -18.232 807 HE21 GLN 107 2HE2 GLN 107 -4.961 -7.607 -16.054 808 HE22 GLN 107 1HE2 GLN 107 -5.768 -8.352 -14.720 809 H SER 108 H SER 108 -4.529 -11.801 -19.986 810 HA SER 108 HA SER 108 -6.368 -13.916 -20.867 811 HB2 SER 108 1HB SER 108 -4.898 -11.928 -22.585 812 HB3 SER 108 2HB SER 108 -5.379 -13.502 -23.219 813 HG SER 108 HG SER 108 -7.060 -12.174 -23.660 Start of MODEL 9 1 H1 SER 1 H SER 1 2.104 1.516 -3.436 2 HA SER 1 HA SER 1 3.016 -0.003 -1.151 3 HB2 SER 1 1HB SER 1 0.622 0.965 -1.633 4 HB3 SER 1 2HB SER 1 0.413 -0.534 -2.539 5 HG SER 1 HG SER 1 0.883 -0.173 0.215 6 H LEU 2 H LEU 2 1.841 -2.431 -1.411 7 HA LEU 2 HA LEU 2 2.934 -3.636 -3.848 8 HB2 LEU 2 1HB LEU 2 4.660 -3.804 -2.126 9 HB3 LEU 2 2HB LEU 2 3.510 -4.590 -1.046 10 HG LEU 2 HG LEU 2 3.414 -6.278 -3.147 11 HD11 LEU 2 1HD1 LEU 2 6.042 -4.873 -3.258 12 HD12 LEU 2 2HD1 LEU 2 5.017 -5.455 -4.570 13 HD13 LEU 2 3HD1 LEU 2 5.964 -6.598 -3.618 14 HD21 LEU 2 3HD2 LEU 2 5.423 -6.311 -0.896 15 HD22 LEU 2 1HD2 LEU 2 4.944 -7.705 -1.864 16 HD23 LEU 2 2HD2 LEU 2 3.763 -6.905 -0.826 17 H THR 3 H THR 3 1.354 -4.548 -0.780 18 HA THR 3 HA THR 3 -0.480 -6.248 -2.332 19 HB THR 3 HB THR 3 -0.894 -7.499 -0.284 20 HG1 THR 3 HG1 THR 3 0.881 -5.596 0.873 21 HG21 THR 3 3HG2 THR 3 1.816 -7.176 -1.392 22 HG22 THR 3 1HG2 THR 3 0.832 -8.627 -1.209 23 HG23 THR 3 2HG2 THR 3 1.731 -7.992 0.169 24 H ASP 4 H ASP 4 -1.024 -3.547 -2.329 25 HA ASP 4 HA ASP 4 -2.879 -2.875 -0.241 26 HB2 ASP 4 1HB ASP 4 -1.750 -1.033 -1.203 27 HB3 ASP 4 2HB ASP 4 -2.106 -1.568 -2.843 28 H ILE 5 H ILE 5 -3.462 -2.917 -3.751 29 HA ILE 5 HA ILE 5 -6.226 -3.239 -3.562 30 HB ILE 5 HB ILE 5 -4.618 -2.703 -5.615 31 HG12 ILE 5 1HG1 ILE 5 -6.822 -3.852 -6.902 32 HG13 ILE 5 2HG1 ILE 5 -7.406 -3.434 -5.294 33 HG21 ILE 5 1HG2 ILE 5 -3.834 -5.125 -5.564 34 HG22 ILE 5 2HG2 ILE 5 -5.411 -5.531 -6.240 35 HG23 ILE 5 3HG2 ILE 5 -4.317 -4.472 -7.130 36 HD11 ILE 5 3HD1 ILE 5 -7.790 -1.640 -6.891 37 HD12 ILE 5 1HD1 ILE 5 -6.679 -1.138 -5.617 38 HD13 ILE 5 2HD1 ILE 5 -6.060 -1.552 -7.216 39 H LEU 6 H LEU 6 -3.668 -5.557 -3.325 40 HA LEU 6 HA LEU 6 -5.640 -7.745 -3.330 41 HB2 LEU 6 1HB LEU 6 -3.087 -7.472 -4.583 42 HB3 LEU 6 2HB LEU 6 -3.013 -8.783 -3.407 43 HG LEU 6 HG LEU 6 -5.209 -9.570 -4.610 44 HD11 LEU 6 1HD1 LEU 6 -3.846 -8.062 -6.832 45 HD12 LEU 6 2HD1 LEU 6 -5.312 -7.516 -6.019 46 HD13 LEU 6 3HD1 LEU 6 -5.321 -9.024 -6.932 47 HD21 LEU 6 3HD2 LEU 6 -3.870 -11.223 -5.249 48 HD22 LEU 6 1HD2 LEU 6 -2.497 -10.228 -4.764 49 HD23 LEU 6 2HD2 LEU 6 -3.068 -10.188 -6.432 50 H SER 7 H SER 7 -4.367 -9.703 -2.031 51 HA SER 7 HA SER 7 -4.053 -8.600 0.675 52 HB2 SER 7 1HB SER 7 -5.752 -10.560 -0.202 53 HB3 SER 7 2HB SER 7 -4.398 -11.511 0.410 54 HG SER 7 HG SER 7 -5.769 -9.481 1.848 55 HA PRO 8 HA PRO 8 0.216 -9.716 0.626 56 HB2 PRO 8 1HB PRO 8 0.659 -9.622 3.302 57 HB3 PRO 8 2HB PRO 8 0.472 -8.172 2.308 58 HG2 PRO 8 1HG PRO 8 -1.536 -9.546 4.052 59 HG3 PRO 8 2HG PRO 8 -1.211 -7.812 3.872 60 HD2 PRO 8 1HD PRO 8 -3.288 -9.041 2.642 61 HD3 PRO 8 2HD PRO 8 -2.437 -7.656 1.926 62 H SER 9 H SER 9 -2.263 -11.552 2.118 63 HA SER 9 HA SER 9 -0.454 -13.716 2.872 64 HB2 SER 9 1HB SER 9 -2.259 -14.666 4.058 65 HB3 SER 9 2HB SER 9 -2.444 -12.930 4.301 66 HG SER 9 HG SER 9 -3.997 -12.946 2.615 67 H ASP 10 H ASP 10 -1.026 -12.900 0.053 68 HA ASP 10 HA ASP 10 -1.982 -15.517 -0.907 69 HB2 ASP 10 1HB ASP 10 -2.293 -12.920 -2.416 70 HB3 ASP 10 2HB ASP 10 -3.016 -14.480 -2.796 71 H ILE 11 H ILE 11 0.010 -12.689 -1.733 72 HA ILE 11 HA ILE 11 1.403 -13.871 -3.863 73 HB ILE 11 HB ILE 11 2.260 -11.662 -1.992 74 HG12 ILE 11 1HG1 ILE 11 1.774 -10.460 -4.347 75 HG13 ILE 11 2HG1 ILE 11 0.654 -11.810 -4.487 76 HG21 ILE 11 1HG2 ILE 11 4.227 -12.620 -2.989 77 HG22 ILE 11 2HG2 ILE 11 3.481 -12.591 -4.586 78 HG23 ILE 11 3HG2 ILE 11 3.886 -11.079 -3.774 79 HD11 ILE 11 3HD1 ILE 11 0.291 -10.770 -1.913 80 HD12 ILE 11 1HD1 ILE 11 0.396 -9.384 -2.998 81 HD13 ILE 11 2HD1 ILE 11 -0.797 -10.649 -3.295 82 H ALA 12 H ALA 12 1.742 -14.196 -0.438 83 HA ALA 12 HA ALA 12 4.431 -15.109 -0.383 84 HB1 ALA 12 1HB ALA 12 4.138 -15.040 1.819 85 HB2 ALA 12 2HB ALA 12 2.495 -14.479 1.508 86 HB3 ALA 12 3HB ALA 12 2.810 -16.198 1.745 87 H ALA 13 H ALA 13 1.348 -16.656 -0.941 88 HA ALA 13 HA ALA 13 2.361 -19.334 -0.674 89 HB1 ALA 13 1HB ALA 13 -0.218 -18.399 -1.927 90 HB2 ALA 13 2HB ALA 13 0.174 -20.042 -1.418 91 HB3 ALA 13 3HB ALA 13 0.005 -18.763 -0.215 92 H ALA 14 H ALA 14 2.425 -16.962 -3.104 93 HA ALA 14 HA ALA 14 2.660 -18.890 -5.282 94 HB1 ALA 14 1HB ALA 14 1.560 -16.417 -5.215 95 HB2 ALA 14 2HB ALA 14 3.163 -16.053 -5.855 96 HB3 ALA 14 3HB ALA 14 2.126 -17.215 -6.682 97 H LEU 15 H LEU 15 4.615 -16.612 -3.446 98 HA LEU 15 HA LEU 15 6.953 -16.923 -5.064 99 HB2 LEU 15 1HB LEU 15 6.454 -15.754 -2.342 100 HB3 LEU 15 2HB LEU 15 8.070 -15.853 -3.038 101 HG LEU 15 HG LEU 15 5.737 -14.300 -4.158 102 HD11 LEU 15 1HD1 LEU 15 6.428 -12.603 -2.914 103 HD12 LEU 15 2HD1 LEU 15 8.057 -12.748 -3.574 104 HD13 LEU 15 3HD1 LEU 15 7.602 -13.667 -2.139 105 HD21 LEU 15 3HD2 LEU 15 7.099 -15.148 -5.959 106 HD22 LEU 15 1HD2 LEU 15 8.569 -14.610 -5.146 107 HD23 LEU 15 2HD2 LEU 15 7.413 -13.424 -5.752 108 H ARG 16 H ARG 16 5.445 -18.883 -2.788 109 HA ARG 16 HA ARG 16 7.955 -20.260 -2.117 110 HB2 ARG 16 1HB ARG 16 6.669 -19.596 -0.169 111 HB3 ARG 16 2HB ARG 16 5.234 -20.387 -0.809 112 HG2 ARG 16 1HG ARG 16 7.619 -22.090 -0.481 113 HG3 ARG 16 2HG ARG 16 6.862 -21.502 1.000 114 HD2 ARG 16 1HD ARG 16 4.933 -22.673 0.643 115 HD3 ARG 16 2HD ARG 16 5.101 -22.623 -1.112 116 HE ARG 16 HE ARG 16 7.116 -24.230 0.109 117 HH11 ARG 16 1HH1 ARG 16 3.785 -24.203 -0.906 118 HH12 ARG 16 2HH1 ARG 16 3.703 -25.920 -1.127 119 HH21 ARG 16 1HH2 ARG 16 7.020 -26.491 -0.179 120 HH22 ARG 16 2HH2 ARG 16 5.543 -27.220 -0.713 121 H ASP 17 H ASP 17 4.622 -20.851 -3.190 122 HA ASP 17 HA ASP 17 4.858 -23.607 -3.624 123 HB2 ASP 17 1HB ASP 17 2.713 -22.336 -3.586 124 HB3 ASP 17 2HB ASP 17 3.121 -21.668 -5.165 125 H CYS 18 H CYS 18 6.162 -20.960 -5.353 126 HA CYS 18 HA CYS 18 7.007 -22.787 -7.501 127 HB2 CYS 18 1HB CYS 18 6.468 -19.840 -7.884 128 HB3 CYS 18 2HB CYS 18 6.817 -21.035 -9.127 129 HG CYS 18 HG CYS 18 3.912 -20.195 -7.754 130 H GLN 19 H GLN 19 8.249 -21.850 -4.934 131 HA GLN 19 HA GLN 19 10.297 -20.006 -5.423 132 HB2 GLN 19 1HB GLN 19 11.284 -20.756 -3.403 133 HB3 GLN 19 2HB GLN 19 9.547 -20.920 -3.183 134 HG2 GLN 19 1HG GLN 19 9.698 -23.304 -3.638 135 HG3 GLN 19 2HG GLN 19 11.435 -23.151 -3.901 136 HE21 GLN 19 2HE2 GLN 19 9.301 -21.774 -1.433 137 HE22 GLN 19 1HE2 GLN 19 10.141 -22.448 -0.082 138 H ALA 20 H ALA 20 9.925 -23.270 -6.425 139 HA ALA 20 HA ALA 20 12.684 -23.885 -6.805 140 HB1 ALA 20 1HB ALA 20 11.959 -25.924 -7.393 141 HB2 ALA 20 2HB ALA 20 10.397 -25.355 -6.803 142 HB3 ALA 20 3HB ALA 20 10.767 -25.284 -8.525 143 HA PRO 21 HA PRO 21 13.606 -21.983 -10.650 144 HB2 PRO 21 1HB PRO 21 15.088 -23.884 -11.900 145 HB3 PRO 21 2HB PRO 21 15.685 -22.952 -10.522 146 HG2 PRO 21 1HG PRO 21 14.544 -25.719 -10.586 147 HG3 PRO 21 2HG PRO 21 15.954 -25.110 -9.699 148 HD2 PRO 21 1HD PRO 21 13.544 -25.486 -8.523 149 HD3 PRO 21 2HD PRO 21 14.663 -24.203 -8.019 150 H ASP 22 H ASP 22 12.747 -21.722 -12.649 151 HA ASP 22 HA ASP 22 11.371 -22.026 -14.435 152 HB2 ASP 22 1HB ASP 22 12.269 -24.888 -14.055 153 HB3 ASP 22 2HB ASP 22 11.342 -24.324 -15.442 154 H SER 23 H SER 23 10.375 -22.363 -11.612 155 HA SER 23 HA SER 23 7.912 -23.859 -12.230 156 HB2 SER 23 1HB SER 23 9.425 -24.682 -10.318 157 HB3 SER 23 2HB SER 23 8.878 -23.254 -9.439 158 HG SER 23 HG SER 23 6.825 -24.026 -9.448 159 H PHE 24 H PHE 24 9.270 -20.831 -11.410 160 HA PHE 24 HA PHE 24 6.665 -19.729 -10.641 161 HB2 PHE 24 1HB PHE 24 8.458 -19.128 -9.143 162 HB3 PHE 24 2HB PHE 24 9.455 -18.577 -10.486 163 HD1 PHE 24 HD1 PHE 24 6.060 -17.924 -9.075 164 HD2 PHE 24 HD2 PHE 24 9.604 -16.315 -10.798 165 HE1 PHE 24 HE1 PHE 24 5.155 -15.652 -8.807 166 HE2 PHE 24 HE2 PHE 24 8.705 -14.041 -10.532 167 HZ PHE 24 HZ PHE 24 6.478 -13.707 -9.535 168 H SER 25 H SER 25 5.675 -18.084 -11.776 169 HA SER 25 HA SER 25 6.897 -16.851 -14.057 170 HB2 SER 25 1HB SER 25 4.479 -18.232 -14.973 171 HB3 SER 25 2HB SER 25 6.043 -18.053 -15.766 172 HG SER 25 HG SER 25 6.798 -19.813 -14.681 173 HA PRO 26 HA PRO 26 3.876 -13.764 -13.294 174 HB2 PRO 26 1HB PRO 26 3.382 -12.797 -15.782 175 HB3 PRO 26 2HB PRO 26 4.895 -12.498 -14.918 176 HG2 PRO 26 1HG PRO 26 4.296 -14.514 -17.049 177 HG3 PRO 26 2HG PRO 26 5.722 -13.477 -16.859 178 HD2 PRO 26 1HD PRO 26 5.710 -16.085 -16.131 179 HD3 PRO 26 2HD PRO 26 6.674 -14.861 -15.280 180 H LYS 27 H LYS 27 3.065 -15.988 -15.930 181 HA LYS 27 HA LYS 27 0.218 -15.481 -15.556 182 HB2 LYS 27 1HB LYS 27 1.418 -17.469 -17.471 183 HB3 LYS 27 2HB LYS 27 -0.139 -16.657 -17.571 184 HG2 LYS 27 1HG LYS 27 0.993 -14.535 -18.001 185 HG3 LYS 27 2HG LYS 27 2.555 -15.350 -17.901 186 HD2 LYS 27 1HD LYS 27 1.997 -15.120 -20.214 187 HD3 LYS 27 2HD LYS 27 1.814 -16.822 -19.784 188 HE2 LYS 27 1HE LYS 27 -0.538 -16.664 -19.753 189 HE3 LYS 27 2HE LYS 27 -0.498 -14.901 -19.746 190 HZ1 LYS 27 3HZ LYS 27 -1.095 -15.856 -21.920 191 HZ2 LYS 27 1HZ LYS 27 0.426 -16.590 -22.006 192 HZ3 LYS 27 2HZ LYS 27 0.301 -14.904 -21.991 193 H LYS 28 H LYS 28 1.824 -16.810 -13.483 194 HA LYS 28 HA LYS 28 0.243 -19.281 -13.297 195 HB2 LYS 28 1HB LYS 28 2.538 -19.894 -13.900 196 HB3 LYS 28 2HB LYS 28 3.152 -18.978 -12.530 197 HG2 LYS 28 1HG LYS 28 3.190 -21.153 -11.756 198 HG3 LYS 28 2HG LYS 28 1.666 -20.539 -11.110 199 HD2 LYS 28 1HD LYS 28 0.417 -21.632 -12.834 200 HD3 LYS 28 2HD LYS 28 1.894 -22.078 -13.693 201 HE2 LYS 28 1HE LYS 28 1.403 -24.047 -12.616 202 HE3 LYS 28 2HE LYS 28 2.477 -23.284 -11.445 203 HZ1 LYS 28 3HZ LYS 28 0.737 -22.785 -10.042 204 HZ2 LYS 28 1HZ LYS 28 0.256 -24.289 -10.652 205 HZ3 LYS 28 2HZ LYS 28 -0.432 -22.869 -11.262 206 H PHE 29 H PHE 29 2.050 -16.761 -11.610 207 HA PHE 29 HA PHE 29 1.007 -17.506 -9.030 208 HB2 PHE 29 1HB PHE 29 2.410 -15.891 -8.143 209 HB3 PHE 29 2HB PHE 29 3.264 -16.310 -9.624 210 HD1 PHE 29 HD2 PHE 29 2.666 -14.851 -11.711 211 HD2 PHE 29 HD1 PHE 29 1.993 -13.679 -7.674 212 HE1 PHE 29 HE2 PHE 29 2.612 -12.493 -12.408 213 HE2 PHE 29 HE1 PHE 29 1.938 -11.318 -8.366 214 HZ PHE 29 HZ PHE 29 2.249 -10.722 -10.735 215 H PHE 30 H PHE 30 0.051 -15.471 -11.633 216 HA PHE 30 HA PHE 30 -1.434 -13.494 -10.419 217 HB2 PHE 30 1HB PHE 30 -2.609 -13.257 -12.460 218 HB3 PHE 30 2HB PHE 30 -1.020 -13.865 -12.909 219 HD1 PHE 30 HD1 PHE 30 -0.899 -16.535 -12.966 220 HD2 PHE 30 HD2 PHE 30 -4.424 -14.206 -13.480 221 HE1 PHE 30 HE1 PHE 30 -1.953 -18.403 -14.170 222 HE2 PHE 30 HE2 PHE 30 -5.484 -16.070 -14.685 223 HZ PHE 30 HZ PHE 30 -4.249 -18.173 -15.030 224 H GLN 31 H GLN 31 -2.180 -16.887 -10.783 225 HA GLN 31 HA GLN 31 -4.909 -16.552 -9.862 226 HB2 GLN 31 1HB GLN 31 -5.221 -18.821 -10.338 227 HB3 GLN 31 2HB GLN 31 -4.085 -18.291 -11.571 228 HG2 GLN 31 1HG GLN 31 -2.286 -19.115 -9.889 229 HG3 GLN 31 2HG GLN 31 -3.623 -20.031 -9.195 230 HE21 GLN 31 2HE2 GLN 31 -1.100 -20.357 -11.132 231 HE22 GLN 31 1HE2 GLN 31 -1.680 -21.554 -12.234 232 H ILE 32 H ILE 32 -1.796 -17.476 -8.588 233 HA ILE 32 HA ILE 32 -2.760 -18.626 -6.165 234 HB ILE 32 HB ILE 32 -0.043 -17.498 -6.848 235 HG12 ILE 32 1HG1 ILE 32 -0.639 -20.406 -6.506 236 HG13 ILE 32 2HG1 ILE 32 -1.120 -19.621 -8.006 237 HG21 ILE 32 1HG2 ILE 32 -0.067 -17.446 -4.528 238 HG22 ILE 32 2HG2 ILE 32 -1.080 -18.884 -4.407 239 HG23 ILE 32 3HG2 ILE 32 0.614 -19.035 -4.876 240 HD11 ILE 32 3HD1 ILE 32 1.634 -19.087 -7.154 241 HD12 ILE 32 1HD1 ILE 32 1.285 -20.762 -7.579 242 HD13 ILE 32 2HD1 ILE 32 0.987 -19.475 -8.748 243 H SER 33 H SER 33 -1.420 -15.441 -6.998 244 HA SER 33 HA SER 33 -1.803 -14.397 -4.356 245 HB2 SER 33 1HB SER 33 -1.273 -12.916 -6.943 246 HB3 SER 33 2HB SER 33 -1.101 -12.260 -5.316 247 HG SER 33 HG SER 33 0.903 -12.954 -6.154 248 H GLY 34 H GLY 34 -3.371 -13.779 -7.500 249 HA2 GLY 34 1HA GLY 34 -5.887 -13.832 -7.343 250 HA3 GLY 34 2HA GLY 34 -5.686 -12.708 -6.007 251 H MET 35 H MET 35 -3.764 -12.625 -8.943 252 HA MET 35 HA MET 35 -4.605 -9.894 -9.407 253 HB2 MET 35 1HB MET 35 -2.550 -11.680 -10.701 254 HB3 MET 35 2HB MET 35 -2.928 -10.079 -11.322 255 HG2 MET 35 1HG MET 35 -2.480 -9.463 -8.755 256 HG3 MET 35 2HG MET 35 -1.440 -10.878 -8.908 257 HE1 MET 35 3HE MET 35 -0.836 -9.779 -12.520 258 HE2 MET 35 1HE MET 35 0.792 -10.004 -11.879 259 HE3 MET 35 2HE MET 35 -0.492 -11.127 -11.434 260 H SER 36 H SER 36 -5.286 -13.043 -10.644 261 HA SER 36 HA SER 36 -6.103 -12.520 -13.236 262 HB2 SER 36 1HB SER 36 -7.065 -14.610 -13.209 263 HB3 SER 36 2HB SER 36 -6.039 -14.746 -11.781 264 HG SER 36 HG SER 36 -7.989 -15.372 -11.067 265 H LYS 37 H LYS 37 -7.736 -11.879 -10.208 266 HA LYS 37 HA LYS 37 -10.302 -11.338 -11.270 267 HB2 LYS 37 1HB LYS 37 -8.972 -10.376 -8.732 268 HB3 LYS 37 2HB LYS 37 -10.674 -10.139 -9.110 269 HG2 LYS 37 1HG LYS 37 -11.177 -12.151 -8.342 270 HG3 LYS 37 2HG LYS 37 -9.992 -12.905 -9.410 271 HD2 LYS 37 1HD LYS 37 -9.294 -13.510 -7.261 272 HD3 LYS 37 2HD LYS 37 -8.247 -12.154 -7.688 273 HE2 LYS 37 1HE LYS 37 -8.861 -11.359 -5.676 274 HE3 LYS 37 2HE LYS 37 -10.319 -10.852 -6.529 275 HZ1 LYS 37 3HZ LYS 37 -11.504 -12.165 -5.222 276 HZ2 LYS 37 1HZ LYS 37 -10.107 -12.634 -4.390 277 HZ3 LYS 37 2HZ LYS 37 -10.630 -13.521 -5.731 278 H LYS 38 H LYS 38 -7.382 -9.473 -11.031 279 HA LYS 38 HA LYS 38 -8.388 -6.881 -11.225 280 HB2 LYS 38 1HB LYS 38 -5.850 -7.960 -12.465 281 HB3 LYS 38 2HB LYS 38 -6.202 -6.268 -12.134 282 HG2 LYS 38 1HG LYS 38 -5.714 -8.479 -10.161 283 HG3 LYS 38 2HG LYS 38 -4.772 -7.007 -10.412 284 HD2 LYS 38 1HD LYS 38 -5.948 -6.232 -8.657 285 HD3 LYS 38 2HD LYS 38 -7.221 -5.975 -9.853 286 HE2 LYS 38 1HE LYS 38 -8.506 -7.608 -9.006 287 HE3 LYS 38 2HE LYS 38 -7.135 -8.691 -8.768 288 HZ1 LYS 38 3HZ LYS 38 -6.852 -6.648 -6.923 289 HZ2 LYS 38 1HZ LYS 38 -7.281 -8.256 -6.616 290 HZ3 LYS 38 2HZ LYS 38 -8.483 -7.093 -6.867 291 H SER 39 H SER 39 -7.642 -5.575 -13.382 292 HA SER 39 HA SER 39 -8.245 -6.827 -15.861 293 HB2 SER 39 1HB SER 39 -10.360 -5.262 -16.144 294 HB3 SER 39 2HB SER 39 -10.513 -6.863 -15.421 295 HG SER 39 HG SER 39 -11.359 -4.754 -14.333 296 H SER 40 H SER 40 -6.092 -5.446 -15.393 297 HA SER 40 HA SER 40 -4.817 -3.632 -15.927 298 HB2 SER 40 1HB SER 40 -5.176 -2.729 -18.098 299 HB3 SER 40 2HB SER 40 -5.760 -4.392 -18.171 300 HG SER 40 HG SER 40 -7.105 -2.405 -18.942 301 H SER 41 H SER 41 -7.072 -3.263 -14.014 302 HA SER 41 HA SER 41 -7.287 -0.333 -14.244 303 HB2 SER 41 1HB SER 41 -9.462 -1.534 -14.660 304 HB3 SER 41 2HB SER 41 -9.379 -2.131 -13.002 305 HG SER 41 HG SER 41 -10.628 -0.206 -13.204 306 H GLN 42 H GLN 42 -6.200 -2.957 -12.459 307 HA GLN 42 HA GLN 42 -5.791 -1.238 -10.110 308 HB2 GLN 42 1HB GLN 42 -6.381 -4.196 -9.963 309 HB3 GLN 42 2HB GLN 42 -6.186 -3.086 -8.613 310 HG2 GLN 42 1HG GLN 42 -8.386 -2.859 -8.614 311 HG3 GLN 42 2HG GLN 42 -8.216 -1.963 -10.122 312 HE21 GLN 42 2HE2 GLN 42 -7.431 -4.080 -11.776 313 HE22 GLN 42 1HE2 GLN 42 -8.776 -5.146 -11.973 314 H LEU 43 H LEU 43 -4.450 -3.099 -12.522 315 HA LEU 43 HA LEU 43 -2.291 -4.366 -11.267 316 HB2 LEU 43 1HB LEU 43 -2.101 -3.146 -13.997 317 HB3 LEU 43 2HB LEU 43 -1.358 -4.626 -13.395 318 HG LEU 43 HG LEU 43 -4.242 -4.191 -14.149 319 HD11 LEU 43 1HD1 LEU 43 -2.325 -4.702 -15.840 320 HD12 LEU 43 2HD1 LEU 43 -3.852 -5.577 -15.941 321 HD13 LEU 43 3HD1 LEU 43 -2.449 -6.336 -15.189 322 HD21 LEU 43 3HD2 LEU 43 -4.663 -6.470 -13.458 323 HD22 LEU 43 1HD2 LEU 43 -4.074 -5.531 -12.086 324 HD23 LEU 43 2HD2 LEU 43 -2.992 -6.646 -12.921 325 H LYS 44 H LYS 44 -2.052 -1.401 -13.232 326 HA LYS 44 HA LYS 44 0.452 -0.638 -12.223 327 HB2 LYS 44 1HB LYS 44 0.202 1.337 -13.453 328 HB3 LYS 44 2HB LYS 44 -0.773 0.171 -14.338 329 HG2 LYS 44 1HG LYS 44 -1.846 2.168 -12.356 330 HG3 LYS 44 2HG LYS 44 -1.865 2.361 -14.110 331 HD2 LYS 44 1HD LYS 44 -3.075 0.040 -14.052 332 HD3 LYS 44 2HD LYS 44 -3.435 0.495 -12.385 333 HE2 LYS 44 1HE LYS 44 -5.270 1.221 -13.695 334 HE3 LYS 44 2HE LYS 44 -4.340 2.664 -13.293 335 HZ1 LYS 44 3HZ LYS 44 -5.019 1.672 -15.833 336 HZ2 LYS 44 1HZ LYS 44 -3.334 1.660 -15.687 337 HZ3 LYS 44 2HZ LYS 44 -4.194 3.096 -15.444 338 H GLU 45 H GLU 45 -2.663 -0.425 -10.850 339 HA GLU 45 HA GLU 45 -2.628 1.849 -9.314 340 HB2 GLU 45 1HB GLU 45 -4.427 0.032 -9.474 341 HB3 GLU 45 2HB GLU 45 -3.536 -0.802 -8.209 342 HG2 GLU 45 1HG GLU 45 -5.217 0.377 -7.097 343 HG3 GLU 45 2HG GLU 45 -3.754 1.329 -6.853 344 H ILE 46 H ILE 46 -1.166 -1.291 -8.519 345 HA ILE 46 HA ILE 46 0.014 -0.239 -6.096 346 HB ILE 46 HB ILE 46 0.566 -2.909 -7.384 347 HG12 ILE 46 1HG1 ILE 46 -1.158 -3.474 -5.372 348 HG13 ILE 46 2HG1 ILE 46 -1.787 -1.914 -5.890 349 HG21 ILE 46 1HG2 ILE 46 0.602 -2.935 -4.540 350 HG22 ILE 46 2HG2 ILE 46 1.926 -3.238 -5.664 351 HG23 ILE 46 3HG2 ILE 46 1.605 -1.598 -5.102 352 HD11 ILE 46 3HD1 ILE 46 -1.980 -4.513 -7.154 353 HD12 ILE 46 1HD1 ILE 46 -2.939 -3.055 -7.403 354 HD13 ILE 46 2HD1 ILE 46 -1.410 -3.261 -8.257 355 H PHE 47 H PHE 47 0.843 -0.408 -9.385 356 HA PHE 47 HA PHE 47 2.831 -0.243 -10.535 357 HB2 PHE 47 1HB PHE 47 4.133 1.780 -9.795 358 HB3 PHE 47 2HB PHE 47 2.412 2.062 -10.033 359 HD1 PHE 47 HD2 PHE 47 0.947 2.489 -8.150 360 HD2 PHE 47 HD1 PHE 47 5.120 1.853 -7.599 361 HE1 PHE 47 HE2 PHE 47 0.780 3.395 -5.869 362 HE2 PHE 47 HE1 PHE 47 4.959 2.757 -5.316 363 HZ PHE 47 HZ PHE 47 2.788 3.530 -4.449 364 H ARG 48 H ARG 48 2.972 -2.350 -8.689 365 HA ARG 48 HA ARG 48 5.849 -2.380 -8.197 366 HB2 ARG 48 1HB ARG 48 3.742 -2.538 -6.116 367 HB3 ARG 48 2HB ARG 48 5.073 -3.678 -5.973 368 HG2 ARG 48 1HG ARG 48 6.399 -1.347 -6.440 369 HG3 ARG 48 2HG ARG 48 5.005 -0.792 -5.510 370 HD2 ARG 48 1HD ARG 48 6.333 -1.319 -3.759 371 HD3 ARG 48 2HD ARG 48 5.691 -2.935 -4.052 372 HE ARG 48 HE ARG 48 7.765 -3.599 -4.782 373 HH11 ARG 48 1HH1 ARG 48 7.667 -0.127 -4.548 374 HH12 ARG 48 2HH1 ARG 48 9.371 0.068 -4.797 375 HH21 ARG 48 1HH2 ARG 48 10.009 -3.356 -5.110 376 HH22 ARG 48 2HH2 ARG 48 10.702 -1.769 -5.117 377 H ILE 49 H ILE 49 3.547 -3.692 -9.848 378 HA ILE 49 HA ILE 49 4.406 -6.473 -9.378 379 HB ILE 49 HB ILE 49 2.292 -7.220 -10.343 380 HG12 ILE 49 1HG1 ILE 49 1.428 -4.325 -10.340 381 HG13 ILE 49 2HG1 ILE 49 2.004 -5.156 -11.782 382 HG21 ILE 49 1HG2 ILE 49 2.358 -5.472 -7.949 383 HG22 ILE 49 2HG2 ILE 49 0.782 -6.012 -8.524 384 HG23 ILE 49 3HG2 ILE 49 2.013 -7.196 -8.085 385 HD11 ILE 49 3HD1 ILE 49 0.174 -6.756 -11.589 386 HD12 ILE 49 1HD1 ILE 49 -0.402 -5.922 -10.146 387 HD13 ILE 49 2HD1 ILE 49 -0.418 -5.099 -11.706 388 H LEU 50 H LEU 50 4.209 -3.870 -11.603 389 HA LEU 50 HA LEU 50 4.685 -5.564 -13.924 390 HB2 LEU 50 1HB LEU 50 4.732 -2.567 -13.912 391 HB3 LEU 50 2HB LEU 50 4.362 -3.659 -15.245 392 HG LEU 50 HG LEU 50 2.557 -3.480 -12.857 393 HD11 LEU 50 1HD1 LEU 50 2.876 -1.194 -13.676 394 HD12 LEU 50 2HD1 LEU 50 1.250 -1.788 -14.009 395 HD13 LEU 50 3HD1 LEU 50 2.446 -1.720 -15.303 396 HD21 LEU 50 3HD2 LEU 50 1.052 -3.862 -15.100 397 HD22 LEU 50 1HD2 LEU 50 1.645 -5.146 -14.046 398 HD23 LEU 50 2HD2 LEU 50 2.537 -4.723 -15.508 399 H ASP 51 H ASP 51 6.263 -2.611 -12.693 400 HA ASP 51 HA ASP 51 8.857 -3.871 -12.750 401 HB2 ASP 51 1HB ASP 51 9.812 -2.178 -14.336 402 HB3 ASP 51 2HB ASP 51 8.714 -3.332 -15.087 403 H ASN 52 H ASN 52 10.585 -1.987 -12.421 404 HA ASN 52 HA ASN 52 9.476 -0.206 -10.351 405 HB2 ASN 52 1HB ASN 52 10.929 -2.029 -9.469 406 HB3 ASN 52 2HB ASN 52 12.257 -1.396 -10.437 407 HD21 ASN 52 2HD2 ASN 52 13.520 -0.978 -8.641 408 HD22 ASN 52 1HD2 ASN 52 13.181 0.319 -7.552 409 H ASP 53 H ASP 53 11.107 -0.393 -13.306 410 HA ASP 53 HA ASP 53 12.751 1.902 -13.157 411 HB2 ASP 53 1HB ASP 53 11.562 0.325 -15.420 412 HB3 ASP 53 2HB ASP 53 12.426 1.827 -15.737 413 H GLN 54 H GLN 54 9.392 1.417 -14.132 414 HA GLN 54 HA GLN 54 7.680 2.866 -14.512 415 HB2 GLN 54 1HB GLN 54 9.286 4.055 -12.382 416 HB3 GLN 54 2HB GLN 54 8.365 5.248 -13.289 417 HG2 GLN 54 1HG GLN 54 7.273 4.244 -11.230 418 HG3 GLN 54 2HG GLN 54 6.321 4.284 -12.713 419 HE21 GLN 54 2HE2 GLN 54 4.995 2.609 -12.056 420 HE22 GLN 54 1HE2 GLN 54 5.536 0.970 -11.984 421 H SER 55 H SER 55 10.168 2.896 -16.227 422 HA SER 55 HA SER 55 10.247 5.614 -17.233 423 HB2 SER 55 1HB SER 55 11.731 3.081 -17.845 424 HB3 SER 55 2HB SER 55 11.766 4.412 -19.002 425 HG SER 55 HG SER 55 12.473 5.742 -17.201 426 H GLY 56 H GLY 56 8.897 2.501 -18.129 427 HA2 GLY 56 1HA GLY 56 6.745 3.292 -19.534 428 HA3 GLY 56 2HA GLY 56 8.025 3.448 -20.727 429 H PHE 57 H PHE 57 9.595 1.292 -20.279 430 HA PHE 57 HA PHE 57 7.764 -0.990 -20.625 431 HB2 PHE 57 1HB PHE 57 10.332 -0.399 -22.111 432 HB3 PHE 57 2HB PHE 57 9.443 -1.914 -22.229 433 HD1 PHE 57 HD1 PHE 57 9.097 1.745 -22.757 434 HD2 PHE 57 HD2 PHE 57 7.735 -2.155 -23.783 435 HE1 PHE 57 HE1 PHE 57 7.714 2.704 -24.552 436 HE2 PHE 57 HE2 PHE 57 6.351 -1.203 -25.580 437 HZ PHE 57 HZ PHE 57 6.339 1.229 -25.967 438 H ILE 58 H ILE 58 9.412 -3.077 -20.675 439 HA ILE 58 HA ILE 58 11.041 -2.881 -18.230 440 HB ILE 58 HB ILE 58 9.416 -5.324 -18.892 441 HG12 ILE 58 1HG1 ILE 58 8.620 -3.048 -17.063 442 HG13 ILE 58 2HG1 ILE 58 7.880 -3.410 -18.618 443 HG21 ILE 58 1HG2 ILE 58 10.854 -4.325 -16.447 444 HG22 ILE 58 2HG2 ILE 58 9.706 -5.662 -16.405 445 HG23 ILE 58 3HG2 ILE 58 11.171 -5.789 -17.377 446 HD11 ILE 58 3HD1 ILE 58 7.792 -5.778 -17.101 447 HD12 ILE 58 1HD1 ILE 58 7.268 -4.464 -16.048 448 HD13 ILE 58 2HD1 ILE 58 6.452 -4.739 -17.587 449 H GLU 59 H GLU 59 12.686 -4.547 -18.020 450 HA GLU 59 HA GLU 59 13.432 -5.855 -20.537 451 HB2 GLU 59 1HB GLU 59 14.646 -3.549 -19.807 452 HB3 GLU 59 2HB GLU 59 15.666 -4.713 -18.972 453 HG2 GLU 59 1HG GLU 59 16.501 -5.578 -20.895 454 HG3 GLU 59 2HG GLU 59 15.030 -5.255 -21.812 455 H GLU 60 H GLU 60 15.486 -7.281 -20.066 456 HA GLU 60 HA GLU 60 14.687 -9.232 -18.182 457 HB2 GLU 60 1HB GLU 60 16.767 -10.379 -18.768 458 HB3 GLU 60 2HB GLU 60 15.936 -9.805 -20.207 459 HG2 GLU 60 1HG GLU 60 17.491 -7.745 -19.976 460 HG3 GLU 60 2HG GLU 60 18.459 -8.812 -18.961 461 H ASP 61 H ASP 61 16.663 -6.428 -17.944 462 HA ASP 61 HA ASP 61 18.169 -7.255 -15.652 463 HB2 ASP 61 1HB ASP 61 19.009 -5.521 -17.174 464 HB3 ASP 61 2HB ASP 61 17.649 -4.484 -16.751 465 H GLU 62 H GLU 62 14.965 -6.508 -16.060 466 HA GLU 62 HA GLU 62 14.705 -5.569 -13.279 467 HB2 GLU 62 1HB GLU 62 13.178 -4.917 -15.761 468 HB3 GLU 62 2HB GLU 62 12.323 -4.909 -14.225 469 HG2 GLU 62 1HG GLU 62 14.877 -3.392 -14.562 470 HG3 GLU 62 2HG GLU 62 13.340 -2.716 -15.098 471 H LEU 63 H LEU 63 14.843 -8.342 -14.517 472 HA LEU 63 HA LEU 63 12.278 -9.355 -13.482 473 HB2 LEU 63 1HB LEU 63 14.121 -10.854 -15.319 474 HB3 LEU 63 2HB LEU 63 12.434 -11.199 -14.944 475 HG LEU 63 HG LEU 63 13.462 -8.901 -16.608 476 HD11 LEU 63 1HD1 LEU 63 11.624 -10.989 -17.638 477 HD12 LEU 63 2HD1 LEU 63 13.323 -11.415 -17.434 478 HD13 LEU 63 3HD1 LEU 63 12.873 -10.062 -18.471 479 HD21 LEU 63 3HD2 LEU 63 11.471 -7.921 -16.447 480 HD22 LEU 63 1HD2 LEU 63 11.138 -9.004 -15.095 481 HD23 LEU 63 2HD2 LEU 63 10.621 -9.442 -16.724 482 H LYS 64 H LYS 64 15.724 -10.205 -13.784 483 HA LYS 64 HA LYS 64 15.868 -12.357 -12.104 484 HB2 LYS 64 1HB LYS 64 18.205 -11.541 -11.555 485 HB3 LYS 64 2HB LYS 64 17.830 -11.713 -13.265 486 HG2 LYS 64 1HG LYS 64 17.381 -9.273 -13.355 487 HG3 LYS 64 2HG LYS 64 17.925 -9.156 -11.680 488 HD2 LYS 64 1HD LYS 64 20.124 -9.884 -12.270 489 HD3 LYS 64 2HD LYS 64 19.609 -10.286 -13.910 490 HE2 LYS 64 1HE LYS 64 19.658 -8.127 -14.599 491 HE3 LYS 64 2HE LYS 64 19.153 -7.502 -13.029 492 HZ1 LYS 64 3HZ LYS 64 21.647 -8.570 -12.612 493 HZ2 LYS 64 1HZ LYS 64 21.259 -6.927 -12.726 494 HZ3 LYS 64 2HZ LYS 64 21.775 -7.771 -14.098 495 H TYR 65 H TYR 65 15.702 -8.951 -11.219 496 HA TYR 65 HA TYR 65 15.648 -9.715 -8.381 497 HB2 TYR 65 1HB TYR 65 15.924 -6.909 -9.448 498 HB3 TYR 65 2HB TYR 65 16.318 -7.505 -7.839 499 HD1 TYR 65 HD2 TYR 65 17.875 -9.939 -8.530 500 HD2 TYR 65 HD1 TYR 65 17.951 -6.033 -10.217 501 HE1 TYR 65 HE2 TYR 65 20.207 -10.292 -9.229 502 HE2 TYR 65 HE1 TYR 65 20.282 -6.376 -10.921 503 HH TYR 65 HH TYR 65 21.821 -9.475 -10.733 504 H PHE 66 H PHE 66 13.370 -10.326 -9.724 505 HA PHE 66 HA PHE 66 11.477 -8.142 -9.346 506 HB2 PHE 66 1HB PHE 66 11.288 -9.493 -11.383 507 HB3 PHE 66 2HB PHE 66 11.067 -10.944 -10.411 508 HD1 PHE 66 HD2 PHE 66 9.004 -11.220 -9.064 509 HD2 PHE 66 HD1 PHE 66 9.494 -8.020 -11.828 510 HE1 PHE 66 HE2 PHE 66 6.573 -10.841 -9.051 511 HE2 PHE 66 HE1 PHE 66 7.064 -7.635 -11.818 512 HZ PHE 66 HZ PHE 66 5.600 -9.048 -10.430 513 H LEU 67 H LEU 67 11.967 -11.476 -8.210 514 HA LEU 67 HA LEU 67 9.845 -11.685 -6.460 515 HB2 LEU 67 1HB LEU 67 12.611 -12.755 -5.938 516 HB3 LEU 67 2HB LEU 67 11.088 -13.388 -5.318 517 HG LEU 67 HG LEU 67 12.081 -13.497 -8.163 518 HD11 LEU 67 1HD1 LEU 67 11.939 -15.403 -5.900 519 HD12 LEU 67 2HD1 LEU 67 13.125 -15.265 -7.197 520 HD13 LEU 67 3HD1 LEU 67 11.563 -16.021 -7.509 521 HD21 LEU 67 3HD2 LEU 67 9.882 -13.369 -8.650 522 HD22 LEU 67 1HD2 LEU 67 9.382 -13.795 -7.014 523 HD23 LEU 67 2HD2 LEU 67 9.886 -15.057 -8.139 524 H GLN 68 H GLN 68 12.838 -9.931 -6.091 525 HA GLN 68 HA GLN 68 12.855 -9.556 -3.325 526 HB2 GLN 68 1HB GLN 68 14.343 -8.638 -5.509 527 HB3 GLN 68 2HB GLN 68 13.729 -7.183 -4.735 528 HG2 GLN 68 1HG GLN 68 14.982 -7.470 -2.879 529 HG3 GLN 68 2HG GLN 68 14.894 -9.229 -2.956 530 HE21 GLN 68 2HE2 GLN 68 15.983 -10.019 -5.142 531 HE22 GLN 68 1HE2 GLN 68 17.589 -9.423 -5.366 532 H ARG 69 H ARG 69 10.868 -8.150 -5.787 533 HA ARG 69 HA ARG 69 10.048 -5.794 -4.541 534 HB2 ARG 69 1HB ARG 69 8.868 -7.615 -6.584 535 HB3 ARG 69 2HB ARG 69 7.816 -6.410 -5.852 536 HG2 ARG 69 1HG ARG 69 8.868 -5.696 -7.986 537 HG3 ARG 69 2HG ARG 69 9.202 -4.628 -6.621 538 HD2 ARG 69 1HD ARG 69 11.131 -6.817 -7.118 539 HD3 ARG 69 2HD ARG 69 11.101 -5.500 -8.290 540 HE ARG 69 HE ARG 69 11.271 -4.720 -5.501 541 HH11 ARG 69 1HH1 ARG 69 12.957 -5.380 -8.475 542 HH12 ARG 69 2HH1 ARG 69 14.371 -4.486 -8.024 543 HH21 ARG 69 1HH2 ARG 69 13.127 -3.540 -4.896 544 HH22 ARG 69 2HH2 ARG 69 14.467 -3.441 -5.988 545 H PHE 70 H PHE 70 8.521 -9.013 -4.435 546 HA PHE 70 HA PHE 70 6.860 -8.128 -2.197 547 HB2 PHE 70 1HB PHE 70 6.768 -10.786 -3.630 548 HB3 PHE 70 2HB PHE 70 5.541 -10.100 -2.571 549 HD1 PHE 70 HD2 PHE 70 7.144 -9.824 -5.873 550 HD2 PHE 70 HD1 PHE 70 3.938 -8.552 -3.379 551 HE1 PHE 70 HE2 PHE 70 6.032 -8.817 -7.823 552 HE2 PHE 70 HE1 PHE 70 2.820 -7.544 -5.326 553 HZ PHE 70 HZ PHE 70 3.867 -7.675 -7.551 554 H GLU 71 H GLU 71 8.773 -11.036 -2.990 555 HA GLU 71 HA GLU 71 8.903 -12.154 -0.484 556 HB2 GLU 71 1HB GLU 71 9.750 -13.259 -2.500 557 HB3 GLU 71 2HB GLU 71 11.082 -12.115 -2.579 558 HG2 GLU 71 1HG GLU 71 11.952 -14.099 -1.655 559 HG3 GLU 71 2HG GLU 71 11.802 -12.951 -0.325 560 H SER 72 H SER 72 11.091 -9.728 -1.875 561 HA SER 72 HA SER 72 12.522 -8.241 -0.918 562 HB2 SER 72 1HB SER 72 10.365 -7.943 0.543 563 HB3 SER 72 2HB SER 72 11.326 -8.745 1.786 564 HG SER 72 HG SER 72 12.417 -6.973 2.041 565 H GLY 73 H GLY 73 12.828 -11.316 -0.708 566 HA2 GLY 73 1HA GLY 73 15.139 -11.202 1.125 567 HA3 GLY 73 2HA GLY 73 14.049 -12.580 1.122 568 H ALA 74 H ALA 74 13.715 -12.540 -1.785 569 HA ALA 74 HA ALA 74 15.647 -14.372 -2.535 570 HB1 ALA 74 1HB ALA 74 14.662 -14.384 -4.593 571 HB2 ALA 74 2HB ALA 74 13.388 -13.596 -3.661 572 HB3 ALA 74 3HB ALA 74 14.488 -12.630 -4.645 573 H ARG 75 H ARG 75 17.096 -13.996 -4.565 574 HA ARG 75 HA ARG 75 18.589 -11.481 -4.243 575 HB2 ARG 75 1HB ARG 75 20.597 -13.138 -4.871 576 HB3 ARG 75 2HB ARG 75 20.130 -12.797 -3.211 577 HG2 ARG 75 1HG ARG 75 19.333 -14.876 -2.864 578 HG3 ARG 75 2HG ARG 75 18.724 -15.035 -4.513 579 HD2 ARG 75 1HD ARG 75 20.721 -15.807 -5.323 580 HD3 ARG 75 2HD ARG 75 21.667 -14.963 -4.097 581 HE ARG 75 HE ARG 75 20.727 -17.629 -3.963 582 HH11 ARG 75 1HH1 ARG 75 21.238 -14.798 -2.002 583 HH12 ARG 75 2HH1 ARG 75 21.461 -15.694 -0.536 584 HH21 ARG 75 1HH2 ARG 75 21.019 -18.820 -2.040 585 HH22 ARG 75 2HH2 ARG 75 21.338 -17.982 -0.559 586 H VAL 76 H VAL 76 18.659 -14.398 -6.299 587 HA VAL 76 HA VAL 76 18.241 -12.712 -8.652 588 HB VAL 76 HB VAL 76 20.445 -14.762 -8.650 589 HG11 VAL 76 1HG1 VAL 76 19.770 -14.294 -10.841 590 HG12 VAL 76 2HG1 VAL 76 19.554 -12.575 -10.504 591 HG13 VAL 76 3HG1 VAL 76 21.177 -13.261 -10.590 592 HG21 VAL 76 3HG2 VAL 76 21.164 -13.185 -7.027 593 HG22 VAL 76 1HG2 VAL 76 21.998 -12.781 -8.527 594 HG23 VAL 76 2HG2 VAL 76 20.611 -11.825 -8.004 595 H LEU 77 H LEU 77 17.498 -13.852 -10.504 596 HA LEU 77 HA LEU 77 16.270 -16.437 -9.835 597 HB2 LEU 77 1HB LEU 77 15.530 -14.297 -11.813 598 HB3 LEU 77 2HB LEU 77 14.806 -15.904 -11.837 599 HG LEU 77 HG LEU 77 14.684 -14.380 -9.291 600 HD11 LEU 77 1HD1 LEU 77 12.428 -13.489 -10.355 601 HD12 LEU 77 2HD1 LEU 77 13.395 -13.543 -11.829 602 HD13 LEU 77 3HD1 LEU 77 13.934 -12.576 -10.456 603 HD21 LEU 77 3HD2 LEU 77 13.327 -16.594 -10.625 604 HD22 LEU 77 1HD2 LEU 77 12.227 -15.447 -9.861 605 HD23 LEU 77 2HD2 LEU 77 13.487 -16.229 -8.906 606 H THR 78 H THR 78 15.700 -17.501 -12.219 607 HA THR 78 HA THR 78 18.359 -18.040 -13.344 608 HB THR 78 HB THR 78 17.377 -20.128 -14.223 609 HG1 THR 78 HG1 THR 78 15.275 -20.643 -13.812 610 HG21 THR 78 3HG2 THR 78 17.177 -21.291 -12.108 611 HG22 THR 78 1HG2 THR 78 16.859 -19.774 -11.269 612 HG23 THR 78 2HG2 THR 78 18.442 -20.068 -11.988 613 H ALA 79 H ALA 79 18.506 -18.459 -15.667 614 HA ALA 79 HA ALA 79 17.409 -16.365 -17.194 615 HB1 ALA 79 1HB ALA 79 19.563 -17.695 -17.591 616 HB2 ALA 79 2HB ALA 79 18.528 -18.871 -18.403 617 HB3 ALA 79 3HB ALA 79 18.619 -17.214 -19.001 618 H SER 80 H SER 80 16.113 -19.367 -16.279 619 HA SER 80 HA SER 80 14.385 -19.702 -18.562 620 HB2 SER 80 1HB SER 80 15.046 -21.209 -16.146 621 HB3 SER 80 2HB SER 80 13.328 -21.266 -16.539 622 HG SER 80 HG SER 80 15.454 -22.423 -17.811 623 H GLU 81 H GLU 81 13.903 -18.849 -15.136 624 HA GLU 81 HA GLU 81 11.154 -18.310 -15.336 625 HB2 GLU 81 1HB GLU 81 13.260 -17.343 -13.407 626 HB3 GLU 81 2HB GLU 81 11.560 -16.929 -13.239 627 HG2 GLU 81 1HG GLU 81 10.944 -19.159 -12.841 628 HG3 GLU 81 2HG GLU 81 12.496 -19.773 -13.406 629 H THR 82 H THR 82 13.839 -15.970 -15.110 630 HA THR 82 HA THR 82 12.442 -13.652 -15.569 631 HB THR 82 HB THR 82 14.544 -12.714 -16.530 632 HG1 THR 82 HG1 THR 82 15.464 -15.399 -16.231 633 HG21 THR 82 3HG2 THR 82 15.579 -14.255 -14.258 634 HG22 THR 82 1HG2 THR 82 14.027 -13.474 -13.960 635 HG23 THR 82 2HG2 THR 82 15.416 -12.512 -14.464 636 H LYS 83 H LYS 83 13.872 -15.805 -18.010 637 HA LYS 83 HA LYS 83 13.338 -14.404 -20.306 638 HB2 LYS 83 1HB LYS 83 14.560 -16.441 -20.457 639 HB3 LYS 83 2HB LYS 83 13.234 -17.369 -19.770 640 HG2 LYS 83 1HG LYS 83 11.935 -17.126 -21.748 641 HG3 LYS 83 2HG LYS 83 13.070 -15.953 -22.418 642 HD2 LYS 83 1HD LYS 83 14.027 -18.690 -21.698 643 HD3 LYS 83 2HD LYS 83 13.136 -18.446 -23.202 644 HE2 LYS 83 1HE LYS 83 15.468 -16.704 -22.491 645 HE3 LYS 83 2HE LYS 83 15.715 -18.284 -23.234 646 HZ1 LYS 83 3HZ LYS 83 14.692 -15.836 -24.394 647 HZ2 LYS 83 1HZ LYS 83 13.851 -17.237 -24.834 648 HZ3 LYS 83 2HZ LYS 83 15.513 -17.122 -25.125 649 H THR 84 H THR 84 11.130 -16.550 -18.543 650 HA THR 84 HA THR 84 8.943 -15.864 -20.339 651 HB THR 84 HB THR 84 9.140 -18.193 -19.602 652 HG1 THR 84 HG1 THR 84 7.052 -17.808 -19.984 653 HG21 THR 84 3HG2 THR 84 10.084 -18.156 -17.473 654 HG22 THR 84 1HG2 THR 84 8.409 -18.605 -17.151 655 HG23 THR 84 2HG2 THR 84 8.945 -16.946 -16.881 656 H PHE 85 H PHE 85 9.886 -13.647 -18.984 657 HA PHE 85 HA PHE 85 7.581 -13.022 -17.277 658 HB2 PHE 85 1HB PHE 85 10.011 -13.426 -16.167 659 HB3 PHE 85 2HB PHE 85 10.135 -11.712 -16.550 660 HD1 PHE 85 HD1 PHE 85 8.521 -10.112 -15.570 661 HD2 PHE 85 HD2 PHE 85 8.646 -14.201 -14.397 662 HE1 PHE 85 HE1 PHE 85 7.244 -9.565 -13.539 663 HE2 PHE 85 HE2 PHE 85 7.368 -13.661 -12.365 664 HZ PHE 85 HZ PHE 85 6.664 -11.341 -11.934 665 H LEU 86 H LEU 86 10.234 -11.825 -19.275 666 HA LEU 86 HA LEU 86 8.689 -9.364 -19.755 667 HB2 LEU 86 1HB LEU 86 10.874 -8.975 -18.744 668 HB3 LEU 86 2HB LEU 86 11.648 -9.862 -20.057 669 HG LEU 86 HG LEU 86 11.682 -7.267 -20.054 670 HD11 LEU 86 1HD1 LEU 86 11.400 -7.322 -22.592 671 HD12 LEU 86 2HD1 LEU 86 11.058 -9.040 -22.391 672 HD13 LEU 86 3HD1 LEU 86 12.614 -8.386 -21.881 673 HD21 LEU 86 3HD2 LEU 86 9.036 -7.439 -19.837 674 HD22 LEU 86 1HD2 LEU 86 9.159 -7.466 -21.596 675 HD23 LEU 86 2HD2 LEU 86 9.830 -6.112 -20.686 676 H ALA 87 H ALA 87 10.409 -12.033 -21.239 677 HA ALA 87 HA ALA 87 9.597 -11.086 -23.901 678 HB1 ALA 87 1HB ALA 87 11.255 -12.554 -24.819 679 HB2 ALA 87 2HB ALA 87 12.000 -11.609 -23.529 680 HB3 ALA 87 3HB ALA 87 11.545 -13.289 -23.242 681 H ALA 88 H ALA 88 7.881 -12.436 -21.845 682 HA ALA 88 HA ALA 88 7.277 -14.982 -23.146 683 HB1 ALA 88 1HB ALA 88 5.587 -14.095 -20.908 684 HB2 ALA 88 2HB ALA 88 6.364 -15.651 -21.201 685 HB3 ALA 88 3HB ALA 88 7.296 -14.314 -20.527 686 H ALA 89 H ALA 89 5.645 -11.941 -22.282 687 HA ALA 89 HA ALA 89 3.147 -12.433 -23.348 688 HB1 ALA 89 1HB ALA 89 2.816 -10.077 -23.410 689 HB2 ALA 89 2HB ALA 89 3.851 -10.424 -22.024 690 HB3 ALA 89 3HB ALA 89 4.551 -9.774 -23.506 691 H ASP 90 H ASP 90 5.559 -10.425 -25.036 692 HA ASP 90 HA ASP 90 5.573 -11.860 -27.438 693 HB2 ASP 90 1HB ASP 90 3.131 -10.730 -27.168 694 HB3 ASP 90 2HB ASP 90 3.989 -9.417 -27.970 695 H HIS 91 H HIS 91 5.950 -9.968 -29.339 696 HA HIS 91 HA HIS 91 7.841 -8.024 -28.229 697 HB2 HIS 91 1HB HIS 91 9.420 -8.644 -30.137 698 HB3 HIS 91 2HB HIS 91 9.317 -9.783 -28.797 699 HD1 HIS 91 HD1 HIS 91 8.918 -9.529 -32.423 700 HD2 HIS 91 HD2 HIS 91 7.730 -12.136 -29.413 701 HE1 HIS 91 HE1 HIS 91 8.224 -11.641 -33.598 702 H ASP 92 H ASP 92 5.640 -6.958 -28.882 703 HA ASP 92 HA ASP 92 4.903 -6.517 -31.511 704 HB2 ASP 92 1HB ASP 92 3.435 -5.726 -29.841 705 HB3 ASP 92 2HB ASP 92 4.701 -4.786 -29.055 706 H GLY 93 H GLY 93 7.282 -4.755 -29.552 707 HA2 GLY 93 1HA GLY 93 8.097 -3.276 -31.963 708 HA3 GLY 93 2HA GLY 93 8.456 -2.802 -30.310 709 H ASP 94 H ASP 94 9.927 -4.271 -29.091 710 HA ASP 94 HA ASP 94 11.793 -5.725 -30.824 711 HB2 ASP 94 1HB ASP 94 12.396 -3.206 -30.040 712 HB3 ASP 94 2HB ASP 94 13.040 -4.117 -28.677 713 H GLY 95 H GLY 95 9.712 -6.346 -28.711 714 HA2 GLY 95 1HA GLY 95 9.630 -8.287 -27.379 715 HA3 GLY 95 2HA GLY 95 11.382 -8.242 -27.245 716 H LYS 96 H LYS 96 9.873 -5.243 -26.708 717 HA LYS 96 HA LYS 96 10.301 -5.553 -23.815 718 HB2 LYS 96 1HB LYS 96 10.397 -3.036 -23.824 719 HB3 LYS 96 2HB LYS 96 11.699 -3.836 -24.694 720 HG2 LYS 96 1HG LYS 96 9.432 -3.237 -26.405 721 HG3 LYS 96 2HG LYS 96 10.109 -1.796 -25.641 722 HD2 LYS 96 1HD LYS 96 11.932 -3.799 -26.905 723 HD3 LYS 96 2HD LYS 96 11.064 -2.644 -27.919 724 HE2 LYS 96 1HE LYS 96 12.553 -1.662 -25.527 725 HE3 LYS 96 2HE LYS 96 13.450 -2.084 -26.985 726 HZ1 LYS 96 3HZ LYS 96 12.972 -0.041 -27.675 727 HZ2 LYS 96 1HZ LYS 96 11.827 0.208 -26.454 728 HZ3 LYS 96 2HZ LYS 96 11.377 -0.562 -27.891 729 H ILE 97 H ILE 97 8.579 -5.624 -22.542 730 HA ILE 97 HA ILE 97 5.959 -4.988 -23.612 731 HB ILE 97 HB ILE 97 6.713 -6.043 -20.884 732 HG12 ILE 97 1HG1 ILE 97 5.633 -7.537 -23.282 733 HG13 ILE 97 2HG1 ILE 97 7.325 -7.533 -22.795 734 HG21 ILE 97 1HG2 ILE 97 4.105 -5.511 -22.238 735 HG22 ILE 97 2HG2 ILE 97 4.236 -6.826 -21.071 736 HG23 ILE 97 3HG2 ILE 97 4.599 -5.172 -20.579 737 HD11 ILE 97 3HD1 ILE 97 6.601 -8.486 -20.602 738 HD12 ILE 97 1HD1 ILE 97 4.986 -8.663 -21.287 739 HD13 ILE 97 2HD1 ILE 97 6.345 -9.537 -21.995 740 H GLY 98 H GLY 98 4.525 -3.472 -22.750 741 HA2 GLY 98 1HA GLY 98 5.729 -1.497 -20.914 742 HA3 GLY 98 2HA GLY 98 4.852 -0.999 -22.352 743 H ALA 99 H ALA 99 2.586 -1.270 -22.431 744 HA ALA 99 HA ALA 99 1.254 -2.096 -19.966 745 HB1 ALA 99 1HB ALA 99 0.904 0.630 -21.206 746 HB2 ALA 99 2HB ALA 99 -0.115 -0.038 -19.931 747 HB3 ALA 99 3HB ALA 99 1.594 0.267 -19.624 748 H GLU 100 H GLU 100 1.482 -3.034 -22.796 749 HA GLU 100 HA GLU 100 -1.400 -3.067 -23.409 750 HB2 GLU 100 1HB GLU 100 0.864 -3.147 -25.412 751 HB3 GLU 100 2HB GLU 100 -0.853 -3.207 -25.787 752 HG2 GLU 100 1HG GLU 100 -1.108 -0.953 -24.817 753 HG3 GLU 100 2HG GLU 100 0.635 -0.897 -24.560 754 H GLU 101 H GLU 101 1.648 -4.813 -23.386 755 HA GLU 101 HA GLU 101 0.330 -7.304 -24.125 756 HB2 GLU 101 1HB GLU 101 3.232 -6.849 -23.418 757 HB3 GLU 101 2HB GLU 101 2.544 -8.265 -24.201 758 HG2 GLU 101 1HG GLU 101 1.793 -6.550 -26.013 759 HG3 GLU 101 2HG GLU 101 3.068 -5.552 -25.315 760 H PHE 102 H PHE 102 2.112 -5.916 -21.391 761 HA PHE 102 HA PHE 102 2.168 -8.058 -19.672 762 HB2 PHE 102 1HB PHE 102 3.092 -5.680 -19.347 763 HB3 PHE 102 2HB PHE 102 1.501 -5.286 -18.704 764 HD1 PHE 102 HD1 PHE 102 0.639 -6.898 -16.821 765 HD2 PHE 102 HD2 PHE 102 4.726 -6.402 -17.903 766 HE1 PHE 102 HE1 PHE 102 1.323 -7.740 -14.612 767 HE2 PHE 102 HE2 PHE 102 5.416 -7.244 -15.696 768 HZ PHE 102 HZ PHE 102 3.714 -7.915 -14.048 769 H GLN 103 H GLN 103 -0.540 -6.002 -20.500 770 HA GLN 103 HA GLN 103 -2.280 -6.783 -18.422 771 HB2 GLN 103 1HB GLN 103 -2.572 -5.453 -21.063 772 HB3 GLN 103 2HB GLN 103 -4.021 -6.153 -20.355 773 HG2 GLN 103 1HG GLN 103 -3.770 -3.785 -19.808 774 HG3 GLN 103 2HG GLN 103 -3.749 -4.806 -18.371 775 HE21 GLN 103 2HE2 GLN 103 -1.180 -4.135 -20.699 776 HE22 GLN 103 1HE2 GLN 103 -0.089 -3.428 -19.561 777 H GLU 104 H GLU 104 -2.345 -7.779 -21.851 778 HA GLU 104 HA GLU 104 -4.195 -9.825 -21.591 779 HB2 GLU 104 1HB GLU 104 -1.903 -9.457 -23.513 780 HB3 GLU 104 2HB GLU 104 -3.031 -10.798 -23.646 781 HG2 GLU 104 1HG GLU 104 -4.880 -9.135 -23.789 782 HG3 GLU 104 2HG GLU 104 -3.660 -7.865 -23.850 783 H MET 105 H MET 105 -0.858 -9.741 -20.685 784 HA MET 105 HA MET 105 -0.368 -12.529 -20.619 785 HB2 MET 105 1HB MET 105 1.572 -11.251 -20.578 786 HB3 MET 105 2HB MET 105 0.929 -10.128 -19.387 787 HG2 MET 105 1HG MET 105 1.007 -12.103 -17.763 788 HG3 MET 105 2HG MET 105 2.037 -12.876 -18.965 789 HE1 MET 105 3HE MET 105 4.691 -9.770 -19.194 790 HE2 MET 105 1HE MET 105 4.154 -11.209 -20.062 791 HE3 MET 105 2HE MET 105 3.099 -9.799 -19.955 792 H VAL 106 H VAL 106 -1.972 -10.337 -18.461 793 HA VAL 106 HA VAL 106 -2.226 -12.491 -16.464 794 HB VAL 106 HB VAL 106 -2.639 -9.538 -15.991 795 HG11 VAL 106 1HG1 VAL 106 -2.059 -11.470 -13.818 796 HG12 VAL 106 2HG1 VAL 106 -3.073 -10.026 -13.812 797 HG13 VAL 106 3HG1 VAL 106 -3.666 -11.519 -14.541 798 HG21 VAL 106 3HG2 VAL 106 -0.296 -10.057 -16.578 799 HG22 VAL 106 1HG2 VAL 106 -0.476 -9.515 -14.910 800 HG23 VAL 106 2HG2 VAL 106 -0.248 -11.228 -15.261 801 H GLN 107 H GLN 107 -4.084 -9.568 -17.311 802 HA GLN 107 HA GLN 107 -6.572 -10.696 -16.614 803 HB2 GLN 107 1HB GLN 107 -7.538 -8.739 -17.815 804 HB3 GLN 107 2HB GLN 107 -6.306 -8.305 -16.638 805 HG2 GLN 107 1HG GLN 107 -4.842 -7.593 -18.218 806 HG3 GLN 107 2HG GLN 107 -5.429 -8.727 -19.433 807 HE21 GLN 107 2HE2 GLN 107 -7.305 -6.447 -17.515 808 HE22 GLN 107 1HE2 GLN 107 -7.859 -5.499 -18.848 809 H SER 108 H SER 108 -4.721 -10.700 -19.563 810 HA SER 108 HA SER 108 -5.081 -11.598 -21.627 811 HB2 SER 108 1HB SER 108 -5.068 -13.642 -20.188 812 HB3 SER 108 2HB SER 108 -6.826 -13.542 -20.098 813 HG SER 108 HG SER 108 -5.219 -14.434 -22.131 Start of MODEL 10 1 H1 SER 1 H SER 1 5.643 0.020 1.579 2 HA SER 1 HA SER 1 3.147 -1.301 2.371 3 HB2 SER 1 1HB SER 1 2.916 1.237 1.791 4 HB3 SER 1 2HB SER 1 3.107 0.691 0.125 5 HG SER 1 HG SER 1 1.011 0.282 1.909 6 H LEU 2 H LEU 2 2.326 -2.776 0.872 7 HA LEU 2 HA LEU 2 3.413 -3.135 -1.726 8 HB2 LEU 2 1HB LEU 2 5.326 -3.933 -0.428 9 HB3 LEU 2 2HB LEU 2 4.285 -5.090 0.398 10 HG LEU 2 HG LEU 2 3.898 -6.220 -1.778 11 HD11 LEU 2 1HD1 LEU 2 5.543 -3.956 -2.712 12 HD12 LEU 2 2HD1 LEU 2 4.280 -4.865 -3.541 13 HD13 LEU 2 3HD1 LEU 2 5.908 -5.531 -3.416 14 HD21 LEU 2 3HD2 LEU 2 6.338 -6.136 -0.234 15 HD22 LEU 2 1HD2 LEU 2 6.648 -6.610 -1.904 16 HD23 LEU 2 2HD2 LEU 2 5.492 -7.518 -0.931 17 H THR 3 H THR 3 2.444 -4.913 -2.863 18 HA THR 3 HA THR 3 0.456 -5.905 -3.484 19 HB THR 3 HB THR 3 1.734 -7.757 -2.536 20 HG1 THR 3 HG1 THR 3 -0.883 -8.138 -1.556 21 HG21 THR 3 3HG2 THR 3 2.185 -7.081 -0.316 22 HG22 THR 3 1HG2 THR 3 1.127 -8.484 -0.175 23 HG23 THR 3 2HG2 THR 3 0.473 -6.861 0.047 24 H ASP 4 H ASP 4 -0.152 -3.519 -2.233 25 HA ASP 4 HA ASP 4 -1.970 -3.780 -0.080 26 HB2 ASP 4 1HB ASP 4 -0.946 -1.641 -0.548 27 HB3 ASP 4 2HB ASP 4 -1.656 -1.608 -2.159 28 H ILE 5 H ILE 5 -2.556 -3.237 -3.556 29 HA ILE 5 HA ILE 5 -5.370 -3.632 -3.329 30 HB ILE 5 HB ILE 5 -3.848 -2.479 -5.220 31 HG12 ILE 5 1HG1 ILE 5 -6.206 -3.464 -6.534 32 HG13 ILE 5 2HG1 ILE 5 -6.578 -3.122 -4.848 33 HG21 ILE 5 1HG2 ILE 5 -2.986 -4.722 -5.917 34 HG22 ILE 5 2HG2 ILE 5 -4.617 -5.113 -6.461 35 HG23 ILE 5 3HG2 ILE 5 -3.732 -3.786 -7.213 36 HD11 ILE 5 3HD1 ILE 5 -7.046 -1.167 -6.097 37 HD12 ILE 5 1HD1 ILE 5 -5.570 -0.859 -5.182 38 HD13 ILE 5 2HD1 ILE 5 -5.479 -1.230 -6.904 39 H LEU 6 H LEU 6 -2.672 -5.736 -3.691 40 HA LEU 6 HA LEU 6 -4.328 -7.951 -4.626 41 HB2 LEU 6 1HB LEU 6 -1.591 -7.243 -4.868 42 HB3 LEU 6 2HB LEU 6 -1.677 -8.770 -3.993 43 HG LEU 6 HG LEU 6 -3.332 -8.655 -6.416 44 HD11 LEU 6 1HD1 LEU 6 -0.957 -9.245 -7.581 45 HD12 LEU 6 2HD1 LEU 6 -0.485 -7.944 -6.488 46 HD13 LEU 6 3HD1 LEU 6 -1.757 -7.676 -7.680 47 HD21 LEU 6 3HD2 LEU 6 -3.134 -10.720 -5.276 48 HD22 LEU 6 1HD2 LEU 6 -1.377 -10.584 -5.186 49 HD23 LEU 6 2HD2 LEU 6 -2.160 -10.867 -6.741 50 H SER 7 H SER 7 -3.175 -10.107 -3.434 51 HA SER 7 HA SER 7 -3.975 -9.756 -0.624 52 HB2 SER 7 1HB SER 7 -5.346 -11.333 -1.964 53 HB3 SER 7 2HB SER 7 -3.903 -12.302 -2.263 54 HG SER 7 HG SER 7 -5.369 -12.880 -0.419 55 HA PRO 8 HA PRO 8 0.393 -10.386 0.168 56 HB2 PRO 8 1HB PRO 8 0.223 -9.889 2.832 57 HB3 PRO 8 2HB PRO 8 0.249 -8.607 1.615 58 HG2 PRO 8 1HG PRO 8 -2.086 -9.803 3.059 59 HG3 PRO 8 2HG PRO 8 -1.746 -8.100 2.697 60 HD2 PRO 8 1HD PRO 8 -3.481 -9.582 1.238 61 HD3 PRO 8 2HD PRO 8 -2.505 -8.280 0.528 62 H SER 9 H SER 9 -2.334 -12.112 1.294 63 HA SER 9 HA SER 9 -0.640 -14.128 2.604 64 HB2 SER 9 1HB SER 9 -2.681 -13.092 3.790 65 HB3 SER 9 2HB SER 9 -3.652 -14.073 2.693 66 HG SER 9 HG SER 9 -3.329 -15.286 4.510 67 H ASP 10 H ASP 10 -1.130 -13.668 -0.343 68 HA ASP 10 HA ASP 10 -1.927 -16.431 -0.964 69 HB2 ASP 10 1HB ASP 10 -2.756 -13.910 -2.403 70 HB3 ASP 10 2HB ASP 10 -2.885 -15.510 -3.127 71 H ILE 11 H ILE 11 -0.048 -13.591 -1.830 72 HA ILE 11 HA ILE 11 1.261 -14.630 -4.086 73 HB ILE 11 HB ILE 11 2.277 -12.602 -2.090 74 HG12 ILE 11 1HG1 ILE 11 1.230 -11.879 -4.785 75 HG13 ILE 11 2HG1 ILE 11 0.061 -12.311 -3.542 76 HG21 ILE 11 1HG2 ILE 11 4.088 -13.548 -3.415 77 HG22 ILE 11 2HG2 ILE 11 3.201 -13.198 -4.897 78 HG23 ILE 11 3HG2 ILE 11 3.777 -11.876 -3.882 79 HD11 ILE 11 3HD1 ILE 11 0.495 -10.457 -2.297 80 HD12 ILE 11 1HD1 ILE 11 2.160 -10.327 -2.864 81 HD13 ILE 11 2HD1 ILE 11 0.830 -9.828 -3.910 82 H ALA 12 H ALA 12 1.831 -15.041 -0.664 83 HA ALA 12 HA ALA 12 4.457 -16.106 -0.867 84 HB1 ALA 12 1HB ALA 12 4.129 -16.840 1.437 85 HB2 ALA 12 2HB ALA 12 3.592 -15.174 1.217 86 HB3 ALA 12 3HB ALA 12 2.407 -16.476 1.314 87 H ALA 13 H ALA 13 1.237 -17.505 -0.982 88 HA ALA 13 HA ALA 13 1.940 -20.209 -0.702 89 HB1 ALA 13 1HB ALA 13 -0.359 -19.057 -2.278 90 HB2 ALA 13 2HB ALA 13 -0.223 -20.708 -1.671 91 HB3 ALA 13 3HB ALA 13 -0.365 -19.362 -0.541 92 H ALA 14 H ALA 14 2.496 -18.016 -3.252 93 HA ALA 14 HA ALA 14 2.940 -20.197 -5.172 94 HB1 ALA 14 1HB ALA 14 1.520 -18.054 -5.661 95 HB2 ALA 14 2HB ALA 14 3.099 -17.321 -5.946 96 HB3 ALA 14 3HB ALA 14 2.592 -18.718 -6.895 97 H LEU 15 H LEU 15 4.503 -17.483 -3.562 98 HA LEU 15 HA LEU 15 6.943 -17.513 -4.927 99 HB2 LEU 15 1HB LEU 15 6.176 -16.702 -2.142 100 HB3 LEU 15 2HB LEU 15 7.838 -16.578 -2.715 101 HG LEU 15 HG LEU 15 5.462 -15.160 -3.920 102 HD11 LEU 15 1HD1 LEU 15 7.661 -13.666 -2.649 103 HD12 LEU 15 2HD1 LEU 15 6.590 -14.545 -1.559 104 HD13 LEU 15 3HD1 LEU 15 5.927 -13.345 -2.668 105 HD21 LEU 15 3HD2 LEU 15 7.188 -15.659 -5.564 106 HD22 LEU 15 1HD2 LEU 15 8.413 -14.950 -4.511 107 HD23 LEU 15 2HD2 LEU 15 7.149 -13.932 -5.201 108 H ARG 16 H ARG 16 5.665 -19.622 -2.488 109 HA ARG 16 HA ARG 16 8.273 -20.889 -2.087 110 HB2 ARG 16 1HB ARG 16 6.311 -20.324 -0.299 111 HB3 ARG 16 2HB ARG 16 5.903 -21.984 -0.710 112 HG2 ARG 16 1HG ARG 16 8.577 -21.035 0.299 113 HG3 ARG 16 2HG ARG 16 7.344 -21.862 1.254 114 HD2 ARG 16 1HD ARG 16 7.698 -23.496 -0.955 115 HD3 ARG 16 2HD ARG 16 9.327 -22.946 -0.566 116 HE ARG 16 HE ARG 16 9.276 -24.292 1.271 117 HH11 ARG 16 1HH1 ARG 16 6.003 -23.670 0.263 118 HH12 ARG 16 2HH1 ARG 16 5.301 -24.746 1.426 119 HH21 ARG 16 1HH2 ARG 16 8.365 -25.712 2.807 120 HH22 ARG 16 2HH2 ARG 16 6.646 -25.906 2.873 121 H ASP 17 H ASP 17 4.932 -21.807 -2.918 122 HA ASP 17 HA ASP 17 5.393 -24.470 -3.548 123 HB2 ASP 17 1HB ASP 17 3.163 -23.221 -3.388 124 HB3 ASP 17 2HB ASP 17 3.441 -22.739 -5.059 125 H CYS 18 H CYS 18 5.720 -21.591 -5.574 126 HA CYS 18 HA CYS 18 6.713 -23.243 -7.777 127 HB2 CYS 18 1HB CYS 18 6.043 -20.294 -7.687 128 HB3 CYS 18 2HB CYS 18 6.556 -21.177 -9.120 129 HG CYS 18 HG CYS 18 3.778 -20.651 -9.209 130 H GLN 19 H GLN 19 8.182 -22.586 -5.232 131 HA GLN 19 HA GLN 19 10.217 -20.736 -5.663 132 HB2 GLN 19 1HB GLN 19 9.767 -21.802 -3.489 133 HB3 GLN 19 2HB GLN 19 10.366 -23.331 -4.119 134 HG2 GLN 19 1HG GLN 19 12.572 -22.542 -4.239 135 HG3 GLN 19 2HG GLN 19 12.068 -20.863 -4.052 136 HE21 GLN 19 2HE2 GLN 19 10.630 -20.660 -1.936 137 HE22 GLN 19 1HE2 GLN 19 11.397 -21.285 -0.520 138 H ALA 20 H ALA 20 9.826 -23.994 -6.846 139 HA ALA 20 HA ALA 20 12.421 -24.629 -7.587 140 HB1 ALA 20 1HB ALA 20 11.435 -26.441 -8.406 141 HB2 ALA 20 2HB ALA 20 9.882 -25.714 -7.994 142 HB3 ALA 20 3HB ALA 20 10.559 -25.490 -9.607 143 HA PRO 21 HA PRO 21 13.559 -22.046 -10.946 144 HB2 PRO 21 1HB PRO 21 14.810 -23.774 -12.624 145 HB3 PRO 21 2HB PRO 21 15.512 -23.248 -11.089 146 HG2 PRO 21 1HG PRO 21 14.057 -25.783 -11.737 147 HG3 PRO 21 2HG PRO 21 15.528 -25.552 -10.774 148 HD2 PRO 21 1HD PRO 21 13.090 -25.905 -9.649 149 HD3 PRO 21 2HD PRO 21 14.351 -24.903 -8.901 150 H ASP 22 H ASP 22 12.664 -21.224 -12.754 151 HA ASP 22 HA ASP 22 11.171 -20.945 -14.452 152 HB2 ASP 22 1HB ASP 22 12.886 -22.543 -15.450 153 HB3 ASP 22 2HB ASP 22 11.725 -23.831 -15.136 154 H SER 23 H SER 23 10.182 -21.979 -11.873 155 HA SER 23 HA SER 23 7.803 -23.450 -12.791 156 HB2 SER 23 1HB SER 23 9.199 -23.330 -10.125 157 HB3 SER 23 2HB SER 23 7.534 -23.893 -10.263 158 HG SER 23 HG SER 23 9.751 -24.969 -11.675 159 H PHE 24 H PHE 24 8.943 -20.525 -11.353 160 HA PHE 24 HA PHE 24 6.244 -19.694 -10.600 161 HB2 PHE 24 1HB PHE 24 7.876 -19.177 -8.939 162 HB3 PHE 24 2HB PHE 24 8.967 -18.481 -10.132 163 HD1 PHE 24 HD1 PHE 24 5.345 -17.956 -9.415 164 HD2 PHE 24 HD2 PHE 24 9.230 -16.242 -9.707 165 HE1 PHE 24 HE1 PHE 24 4.392 -15.730 -8.981 166 HE2 PHE 24 HE2 PHE 24 8.283 -14.013 -9.272 167 HZ PHE 24 HZ PHE 24 5.861 -13.755 -8.907 168 H SER 25 H SER 25 5.327 -19.447 -12.658 169 HA SER 25 HA SER 25 6.536 -17.483 -14.454 170 HB2 SER 25 1HB SER 25 4.483 -19.626 -14.744 171 HB3 SER 25 2HB SER 25 4.370 -18.232 -15.817 172 HG SER 25 HG SER 25 6.843 -19.513 -15.476 173 HA PRO 26 HA PRO 26 3.824 -14.181 -13.462 174 HB2 PRO 26 1HB PRO 26 3.327 -13.092 -15.898 175 HB3 PRO 26 2HB PRO 26 4.889 -12.951 -15.084 176 HG2 PRO 26 1HG PRO 26 4.046 -14.835 -17.252 177 HG3 PRO 26 2HG PRO 26 5.561 -13.929 -17.084 178 HD2 PRO 26 1HD PRO 26 5.352 -16.550 -16.438 179 HD3 PRO 26 2HD PRO 26 6.446 -15.441 -15.587 180 H LYS 27 H LYS 27 2.725 -16.161 -16.199 181 HA LYS 27 HA LYS 27 -0.051 -15.467 -15.650 182 HB2 LYS 27 1HB LYS 27 -0.562 -16.724 -17.684 183 HB3 LYS 27 2HB LYS 27 0.702 -15.538 -17.983 184 HG2 LYS 27 1HG LYS 27 2.308 -17.530 -17.515 185 HG3 LYS 27 2HG LYS 27 0.885 -18.513 -17.868 186 HD2 LYS 27 1HD LYS 27 0.715 -17.662 -20.060 187 HD3 LYS 27 2HD LYS 27 1.824 -16.333 -19.714 188 HE2 LYS 27 1HE LYS 27 2.689 -19.205 -19.558 189 HE3 LYS 27 2HE LYS 27 2.715 -18.309 -21.076 190 HZ1 LYS 27 3HZ LYS 27 4.837 -18.025 -20.223 191 HZ2 LYS 27 1HZ LYS 27 4.297 -17.836 -18.631 192 HZ3 LYS 27 2HZ LYS 27 4.057 -16.598 -19.758 193 H LYS 28 H LYS 28 1.325 -16.934 -13.633 194 HA LYS 28 HA LYS 28 -0.333 -19.356 -13.609 195 HB2 LYS 28 1HB LYS 28 2.619 -19.156 -13.191 196 HB3 LYS 28 2HB LYS 28 1.712 -20.344 -12.265 197 HG2 LYS 28 1HG LYS 28 1.565 -20.158 -15.260 198 HG3 LYS 28 2HG LYS 28 2.750 -21.155 -14.413 199 HD2 LYS 28 1HD LYS 28 -0.238 -21.375 -14.058 200 HD3 LYS 28 2HD LYS 28 0.721 -22.403 -15.125 201 HE2 LYS 28 1HE LYS 28 2.125 -22.826 -12.957 202 HE3 LYS 28 2HE LYS 28 0.655 -22.294 -12.142 203 HZ1 LYS 28 3HZ LYS 28 1.201 -24.816 -13.128 204 HZ2 LYS 28 1HZ LYS 28 0.032 -24.170 -14.166 205 HZ3 LYS 28 2HZ LYS 28 -0.269 -24.259 -12.504 206 H PHE 29 H PHE 29 1.562 -17.014 -11.764 207 HA PHE 29 HA PHE 29 0.360 -17.812 -9.259 208 HB2 PHE 29 1HB PHE 29 1.868 -16.383 -8.224 209 HB3 PHE 29 2HB PHE 29 2.752 -16.843 -9.675 210 HD1 PHE 29 HD2 PHE 29 2.624 -15.263 -11.681 211 HD2 PHE 29 HD1 PHE 29 1.483 -14.147 -7.736 212 HE1 PHE 29 HE2 PHE 29 2.870 -12.891 -12.285 213 HE2 PHE 29 HE1 PHE 29 1.725 -11.773 -8.334 214 HZ PHE 29 HZ PHE 29 2.421 -11.142 -10.610 215 H PHE 30 H PHE 30 -0.307 -15.603 -11.792 216 HA PHE 30 HA PHE 30 -1.612 -13.520 -10.543 217 HB2 PHE 30 1HB PHE 30 -2.716 -13.106 -12.603 218 HB3 PHE 30 2HB PHE 30 -1.169 -13.830 -13.029 219 HD1 PHE 30 HD1 PHE 30 -1.228 -16.458 -13.275 220 HD2 PHE 30 HD2 PHE 30 -4.611 -13.898 -13.624 221 HE1 PHE 30 HE1 PHE 30 -2.395 -18.185 -14.582 222 HE2 PHE 30 HE2 PHE 30 -5.784 -15.621 -14.931 223 HZ PHE 30 HZ PHE 30 -4.677 -17.768 -15.411 224 H GLN 31 H GLN 31 -2.702 -16.801 -11.071 225 HA GLN 31 HA GLN 31 -5.410 -16.233 -10.230 226 HB2 GLN 31 1HB GLN 31 -5.910 -18.443 -10.770 227 HB3 GLN 31 2HB GLN 31 -4.639 -18.037 -11.915 228 HG2 GLN 31 1HG GLN 31 -3.060 -19.047 -10.119 229 HG3 GLN 31 2HG GLN 31 -4.532 -19.812 -9.522 230 HE21 GLN 31 2HE2 GLN 31 -1.932 -20.421 -11.275 231 HE22 GLN 31 1HE2 GLN 31 -2.560 -21.548 -12.424 232 H ILE 32 H ILE 32 -2.443 -17.368 -8.818 233 HA ILE 32 HA ILE 32 -3.668 -18.400 -6.428 234 HB ILE 32 HB ILE 32 -0.777 -17.743 -7.009 235 HG12 ILE 32 1HG1 ILE 32 -1.758 -20.533 -6.743 236 HG13 ILE 32 2HG1 ILE 32 -2.220 -19.671 -8.206 237 HG21 ILE 32 1HG2 ILE 32 -0.708 -17.804 -4.741 238 HG22 ILE 32 2HG2 ILE 32 -2.165 -18.788 -4.612 239 HG23 ILE 32 3HG2 ILE 32 -0.630 -19.539 -5.046 240 HD11 ILE 32 3HD1 ILE 32 0.619 -19.485 -7.472 241 HD12 ILE 32 1HD1 ILE 32 0.047 -21.087 -7.938 242 HD13 ILE 32 2HD1 ILE 32 -0.140 -19.726 -9.046 243 H SER 33 H SER 33 -1.338 -15.737 -6.897 244 HA SER 33 HA SER 33 -1.634 -14.540 -4.430 245 HB2 SER 33 1HB SER 33 -0.777 -12.482 -5.482 246 HB3 SER 33 2HB SER 33 0.117 -13.902 -6.025 247 HG SER 33 HG SER 33 -0.805 -12.199 -7.604 248 H GLY 34 H GLY 34 -3.274 -13.533 -7.440 249 HA2 GLY 34 1HA GLY 34 -5.796 -13.317 -7.035 250 HA3 GLY 34 2HA GLY 34 -5.304 -12.198 -5.772 251 H MET 35 H MET 35 -3.976 -12.605 -9.035 252 HA MET 35 HA MET 35 -4.399 -9.748 -9.487 253 HB2 MET 35 1HB MET 35 -2.597 -11.821 -10.665 254 HB3 MET 35 2HB MET 35 -2.994 -10.401 -11.623 255 HG2 MET 35 1HG MET 35 -2.311 -9.327 -9.192 256 HG3 MET 35 2HG MET 35 -1.203 -10.687 -9.352 257 HE1 MET 35 3HE MET 35 -0.218 -10.207 -12.994 258 HE2 MET 35 1HE MET 35 1.067 -10.272 -11.788 259 HE3 MET 35 2HE MET 35 -0.363 -11.288 -11.608 260 H SER 36 H SER 36 -5.398 -12.880 -10.653 261 HA SER 36 HA SER 36 -6.461 -12.252 -13.128 262 HB2 SER 36 1HB SER 36 -6.322 -14.528 -11.835 263 HB3 SER 36 2HB SER 36 -7.947 -14.104 -11.295 264 HG SER 36 HG SER 36 -8.077 -15.304 -13.191 265 H LYS 37 H LYS 37 -7.736 -11.622 -9.931 266 HA LYS 37 HA LYS 37 -10.376 -10.960 -10.683 267 HB2 LYS 37 1HB LYS 37 -8.707 -10.098 -8.316 268 HB3 LYS 37 2HB LYS 37 -10.419 -9.733 -8.490 269 HG2 LYS 37 1HG LYS 37 -10.518 -12.377 -8.839 270 HG3 LYS 37 2HG LYS 37 -9.076 -12.279 -7.826 271 HD2 LYS 37 1HD LYS 37 -11.714 -10.986 -7.142 272 HD3 LYS 37 2HD LYS 37 -11.213 -12.576 -6.562 273 HE2 LYS 37 1HE LYS 37 -9.289 -11.590 -5.455 274 HE3 LYS 37 2HE LYS 37 -9.714 -10.001 -6.090 275 HZ1 LYS 37 3HZ LYS 37 -11.905 -10.350 -4.867 276 HZ2 LYS 37 1HZ LYS 37 -10.538 -10.006 -3.931 277 HZ3 LYS 37 2HZ LYS 37 -11.115 -11.592 -4.034 278 H LYS 38 H LYS 38 -7.379 -9.207 -10.784 279 HA LYS 38 HA LYS 38 -8.319 -6.579 -10.866 280 HB2 LYS 38 1HB LYS 38 -5.954 -7.720 -12.364 281 HB3 LYS 38 2HB LYS 38 -6.215 -6.026 -11.969 282 HG2 LYS 38 1HG LYS 38 -5.653 -8.284 -10.065 283 HG3 LYS 38 2HG LYS 38 -4.624 -6.899 -10.434 284 HD2 LYS 38 1HD LYS 38 -5.535 -5.941 -8.631 285 HD3 LYS 38 2HD LYS 38 -6.977 -5.724 -9.625 286 HE2 LYS 38 1HE LYS 38 -8.132 -7.150 -8.369 287 HE3 LYS 38 2HE LYS 38 -6.888 -8.388 -8.538 288 HZ1 LYS 38 3HZ LYS 38 -6.713 -8.068 -6.330 289 HZ2 LYS 38 1HZ LYS 38 -7.343 -6.499 -6.378 290 HZ3 LYS 38 2HZ LYS 38 -5.725 -6.772 -6.785 291 H SER 39 H SER 39 -7.646 -5.346 -13.143 292 HA SER 39 HA SER 39 -8.521 -6.537 -15.539 293 HB2 SER 39 1HB SER 39 -10.682 -6.293 -14.058 294 HB3 SER 39 2HB SER 39 -10.593 -4.605 -14.560 295 HG SER 39 HG SER 39 -11.510 -6.692 -15.934 296 H SER 40 H SER 40 -6.349 -5.111 -15.174 297 HA SER 40 HA SER 40 -5.143 -3.287 -15.816 298 HB2 SER 40 1HB SER 40 -5.605 -2.482 -17.953 299 HB3 SER 40 2HB SER 40 -6.439 -4.035 -17.960 300 HG SER 40 HG SER 40 -8.097 -2.861 -18.508 301 H SER 41 H SER 41 -7.200 -2.974 -13.694 302 HA SER 41 HA SER 41 -7.472 -0.045 -13.853 303 HB2 SER 41 1HB SER 41 -9.685 -1.006 -14.090 304 HB3 SER 41 2HB SER 41 -9.434 -2.026 -12.674 305 HG SER 41 HG SER 41 -10.138 -0.426 -11.531 306 H GLN 42 H GLN 42 -6.117 -2.640 -12.265 307 HA GLN 42 HA GLN 42 -5.510 -0.964 -9.935 308 HB2 GLN 42 1HB GLN 42 -6.086 -3.920 -9.726 309 HB3 GLN 42 2HB GLN 42 -5.792 -2.794 -8.407 310 HG2 GLN 42 1HG GLN 42 -7.996 -2.633 -8.232 311 HG3 GLN 42 2HG GLN 42 -7.940 -1.680 -9.714 312 HE21 GLN 42 2HE2 GLN 42 -7.224 -3.788 -11.460 313 HE22 GLN 42 1HE2 GLN 42 -8.591 -4.833 -11.614 314 H LEU 43 H LEU 43 -4.413 -2.755 -12.493 315 HA LEU 43 HA LEU 43 -2.146 -4.053 -11.440 316 HB2 LEU 43 1HB LEU 43 -2.209 -2.890 -14.196 317 HB3 LEU 43 2HB LEU 43 -1.471 -4.391 -13.640 318 HG LEU 43 HG LEU 43 -4.397 -3.851 -14.115 319 HD11 LEU 43 1HD1 LEU 43 -3.161 -4.318 -16.128 320 HD12 LEU 43 2HD1 LEU 43 -4.142 -5.722 -15.710 321 HD13 LEU 43 3HD1 LEU 43 -2.409 -5.728 -15.383 322 HD21 LEU 43 3HD2 LEU 43 -4.810 -6.130 -13.382 323 HD22 LEU 43 1HD2 LEU 43 -4.100 -5.181 -12.075 324 HD23 LEU 43 2HD2 LEU 43 -3.105 -6.327 -12.974 325 H LYS 44 H LYS 44 -2.178 -1.085 -13.419 326 HA LYS 44 HA LYS 44 0.440 -0.326 -12.616 327 HB2 LYS 44 1HB LYS 44 0.187 1.515 -14.017 328 HB3 LYS 44 2HB LYS 44 -0.883 0.325 -14.747 329 HG2 LYS 44 1HG LYS 44 -1.749 2.539 -12.898 330 HG3 LYS 44 2HG LYS 44 -1.886 2.558 -14.658 331 HD2 LYS 44 1HD LYS 44 -3.330 0.563 -14.542 332 HD3 LYS 44 2HD LYS 44 -3.227 0.612 -12.780 333 HE2 LYS 44 1HE LYS 44 -5.191 1.738 -13.096 334 HE3 LYS 44 2HE LYS 44 -4.056 3.086 -13.139 335 HZ1 LYS 44 3HZ LYS 44 -4.115 2.318 -15.712 336 HZ2 LYS 44 1HZ LYS 44 -5.067 3.556 -15.062 337 HZ3 LYS 44 2HZ LYS 44 -5.709 2.002 -15.242 338 H GLU 45 H GLU 45 -2.523 -0.146 -11.048 339 HA GLU 45 HA GLU 45 -2.543 2.282 -9.744 340 HB2 GLU 45 1HB GLU 45 -4.322 0.571 -9.568 341 HB3 GLU 45 2HB GLU 45 -3.267 -0.399 -8.550 342 HG2 GLU 45 1HG GLU 45 -4.959 0.891 -7.293 343 HG3 GLU 45 2HG GLU 45 -3.298 1.253 -6.824 344 H ILE 46 H ILE 46 -0.817 -0.677 -8.814 345 HA ILE 46 HA ILE 46 0.446 0.653 -6.572 346 HB ILE 46 HB ILE 46 1.085 -2.087 -7.655 347 HG12 ILE 46 1HG1 ILE 46 -0.478 -2.602 -5.523 348 HG13 ILE 46 2HG1 ILE 46 -1.224 -1.105 -6.071 349 HG21 ILE 46 1HG2 ILE 46 1.275 -1.815 -4.819 350 HG22 ILE 46 2HG2 ILE 46 2.539 -2.206 -5.984 351 HG23 ILE 46 3HG2 ILE 46 2.192 -0.522 -5.591 352 HD11 ILE 46 3HD1 ILE 46 -1.451 -3.761 -7.134 353 HD12 ILE 46 1HD1 ILE 46 -2.391 -2.316 -7.505 354 HD13 ILE 46 2HD1 ILE 46 -0.889 -2.637 -8.371 355 H PHE 47 H PHE 47 1.119 0.027 -9.885 356 HA PHE 47 HA PHE 47 3.042 0.163 -11.146 357 HB2 PHE 47 1HB PHE 47 4.155 2.416 -10.825 358 HB3 PHE 47 2HB PHE 47 2.416 2.459 -11.100 359 HD1 PHE 47 HD1 PHE 47 0.891 3.101 -9.336 360 HD2 PHE 47 HD2 PHE 47 5.095 3.003 -8.680 361 HE1 PHE 47 HE1 PHE 47 0.596 4.408 -7.273 362 HE2 PHE 47 HE2 PHE 47 4.807 4.309 -6.615 363 HZ PHE 47 HZ PHE 47 2.555 5.012 -5.908 364 H ARG 48 H ARG 48 3.499 -1.564 -9.025 365 HA ARG 48 HA ARG 48 6.364 -1.163 -8.635 366 HB2 ARG 48 1HB ARG 48 4.332 -1.398 -6.451 367 HB3 ARG 48 2HB ARG 48 5.928 -2.096 -6.216 368 HG2 ARG 48 1HG ARG 48 6.635 0.339 -7.080 369 HG3 ARG 48 2HG ARG 48 5.089 0.726 -6.323 370 HD2 ARG 48 1HD ARG 48 6.553 -1.037 -4.618 371 HD3 ARG 48 2HD ARG 48 7.593 0.309 -5.082 372 HE ARG 48 HE ARG 48 6.268 1.725 -3.849 373 HH11 ARG 48 1HH1 ARG 48 4.671 -1.346 -4.218 374 HH12 ARG 48 2HH1 ARG 48 3.421 -0.981 -3.075 375 HH21 ARG 48 1HH2 ARG 48 4.628 2.218 -2.342 376 HH22 ARG 48 2HH2 ARG 48 3.397 1.047 -2.009 377 H ILE 49 H ILE 49 4.280 -2.979 -10.030 378 HA ILE 49 HA ILE 49 5.698 -5.467 -9.416 379 HB ILE 49 HB ILE 49 3.739 -6.794 -9.302 380 HG12 ILE 49 1HG1 ILE 49 2.467 -5.591 -11.058 381 HG13 ILE 49 2HG1 ILE 49 1.487 -5.939 -9.637 382 HG21 ILE 49 1HG2 ILE 49 3.459 -4.294 -7.652 383 HG22 ILE 49 2HG2 ILE 49 2.477 -5.736 -7.401 384 HG23 ILE 49 3HG2 ILE 49 4.227 -5.814 -7.196 385 HD11 ILE 49 3HD1 ILE 49 2.181 -3.536 -8.920 386 HD12 ILE 49 1HD1 ILE 49 2.514 -3.331 -10.639 387 HD13 ILE 49 2HD1 ILE 49 0.894 -3.776 -10.101 388 H LEU 50 H LEU 50 5.120 -3.275 -11.643 389 HA LEU 50 HA LEU 50 5.089 -5.243 -13.828 390 HB2 LEU 50 1HB LEU 50 3.800 -2.530 -13.999 391 HB3 LEU 50 2HB LEU 50 3.720 -3.838 -15.177 392 HG LEU 50 HG LEU 50 2.564 -4.165 -12.429 393 HD11 LEU 50 1HD1 LEU 50 1.703 -2.076 -13.634 394 HD12 LEU 50 2HD1 LEU 50 0.515 -3.248 -13.065 395 HD13 LEU 50 3HD1 LEU 50 0.959 -3.201 -14.771 396 HD21 LEU 50 3HD2 LEU 50 0.987 -5.518 -14.138 397 HD22 LEU 50 1HD2 LEU 50 2.407 -6.215 -13.357 398 HD23 LEU 50 2HD2 LEU 50 2.521 -5.598 -15.006 399 H ASP 51 H ASP 51 5.495 -1.715 -13.499 400 HA ASP 51 HA ASP 51 8.096 -1.991 -14.858 401 HB2 ASP 51 1HB ASP 51 6.482 0.530 -15.022 402 HB3 ASP 51 2HB ASP 51 7.704 -0.084 -16.132 403 H ASN 52 H ASN 52 9.608 -1.755 -13.337 404 HA ASN 52 HA ASN 52 9.228 -0.176 -10.987 405 HB2 ASN 52 1HB ASN 52 10.665 -2.213 -11.075 406 HB3 ASN 52 2HB ASN 52 11.803 -1.326 -12.085 407 HD21 ASN 52 2HD2 ASN 52 13.526 -0.968 -10.880 408 HD22 ASN 52 1HD2 ASN 52 13.523 -0.296 -9.288 409 H ASP 53 H ASP 53 10.024 0.604 -14.146 410 HA ASP 53 HA ASP 53 11.489 3.022 -13.333 411 HB2 ASP 53 1HB ASP 53 12.349 1.326 -15.142 412 HB3 ASP 53 2HB ASP 53 11.208 2.165 -16.189 413 H GLN 54 H GLN 54 8.808 1.891 -15.358 414 HA GLN 54 HA GLN 54 7.015 2.967 -16.263 415 HB2 GLN 54 1HB GLN 54 6.985 3.396 -13.584 416 HB3 GLN 54 2HB GLN 54 6.974 5.053 -14.174 417 HG2 GLN 54 1HG GLN 54 4.724 4.456 -13.900 418 HG3 GLN 54 2HG GLN 54 5.028 4.386 -15.635 419 HE21 GLN 54 2HE2 GLN 54 5.229 2.270 -12.791 420 HE22 GLN 54 1HE2 GLN 54 4.541 0.885 -13.561 421 H SER 55 H SER 55 9.673 3.899 -17.046 422 HA SER 55 HA SER 55 8.980 6.657 -17.821 423 HB2 SER 55 1HB SER 55 11.016 6.236 -16.240 424 HB3 SER 55 2HB SER 55 11.822 5.694 -17.712 425 HG SER 55 HG SER 55 11.160 8.226 -16.905 426 H GLY 56 H GLY 56 10.297 3.562 -18.800 427 HA2 GLY 56 1HA GLY 56 10.000 4.417 -21.609 428 HA3 GLY 56 2HA GLY 56 11.412 3.509 -21.087 429 H PHE 57 H PHE 57 10.980 1.354 -20.113 430 HA PHE 57 HA PHE 57 8.497 0.051 -20.503 431 HB2 PHE 57 1HB PHE 57 9.370 -1.521 -22.327 432 HB3 PHE 57 2HB PHE 57 8.877 0.092 -22.831 433 HD1 PHE 57 HD2 PHE 57 11.779 -2.066 -22.121 434 HD2 PHE 57 HD1 PHE 57 10.419 1.605 -23.792 435 HE1 PHE 57 HE2 PHE 57 13.989 -1.717 -23.145 436 HE2 PHE 57 HE1 PHE 57 12.626 1.959 -24.820 437 HZ PHE 57 HZ PHE 57 14.415 0.297 -24.496 438 H ILE 58 H ILE 58 8.704 -2.350 -20.201 439 HA ILE 58 HA ILE 58 10.510 -2.858 -18.031 440 HB ILE 58 HB ILE 58 8.750 -4.877 -19.415 441 HG12 ILE 58 1HG1 ILE 58 8.025 -3.073 -17.097 442 HG13 ILE 58 2HG1 ILE 58 7.467 -2.846 -18.751 443 HG21 ILE 58 1HG2 ILE 58 10.401 -4.837 -16.994 444 HG22 ILE 58 2HG2 ILE 58 8.774 -5.475 -16.762 445 HG23 ILE 58 3HG2 ILE 58 9.842 -6.198 -17.965 446 HD11 ILE 58 3HD1 ILE 58 6.954 -5.514 -17.681 447 HD12 ILE 58 1HD1 ILE 58 6.138 -4.213 -16.814 448 HD13 ILE 58 2HD1 ILE 58 5.889 -4.409 -18.550 449 H GLU 59 H GLU 59 12.077 -4.530 -17.921 450 HA GLU 59 HA GLU 59 12.939 -5.784 -20.394 451 HB2 GLU 59 1HB GLU 59 14.036 -3.414 -20.001 452 HB3 GLU 59 2HB GLU 59 15.054 -4.312 -18.883 453 HG2 GLU 59 1HG GLU 59 15.946 -5.646 -20.584 454 HG3 GLU 59 2HG GLU 59 14.674 -5.198 -21.720 455 H GLU 60 H GLU 60 14.824 -7.273 -19.989 456 HA GLU 60 HA GLU 60 14.226 -9.053 -17.925 457 HB2 GLU 60 1HB GLU 60 16.222 -10.242 -18.550 458 HB3 GLU 60 2HB GLU 60 15.460 -9.626 -20.009 459 HG2 GLU 60 1HG GLU 60 17.108 -7.612 -19.612 460 HG3 GLU 60 2HG GLU 60 18.014 -8.833 -18.720 461 H ASP 61 H ASP 61 16.164 -6.206 -17.935 462 HA ASP 61 HA ASP 61 17.751 -6.853 -15.644 463 HB2 ASP 61 1HB ASP 61 18.282 -5.127 -17.463 464 HB3 ASP 61 2HB ASP 61 17.150 -4.068 -16.626 465 H GLU 62 H GLU 62 14.520 -6.183 -15.996 466 HA GLU 62 HA GLU 62 14.332 -5.197 -13.225 467 HB2 GLU 62 1HB GLU 62 12.810 -4.418 -15.678 468 HB3 GLU 62 2HB GLU 62 12.004 -4.352 -14.117 469 HG2 GLU 62 1HG GLU 62 14.493 -2.873 -14.931 470 HG3 GLU 62 2HG GLU 62 12.893 -2.190 -14.648 471 H LEU 63 H LEU 63 14.364 -7.953 -14.348 472 HA LEU 63 HA LEU 63 11.689 -8.827 -13.476 473 HB2 LEU 63 1HB LEU 63 13.652 -10.313 -15.214 474 HB3 LEU 63 2HB LEU 63 12.026 -10.838 -14.785 475 HG LEU 63 HG LEU 63 12.769 -8.516 -16.562 476 HD11 LEU 63 1HD1 LEU 63 10.993 -10.562 -17.601 477 HD12 LEU 63 2HD1 LEU 63 12.569 -11.206 -17.142 478 HD13 LEU 63 3HD1 LEU 63 12.462 -9.877 -18.296 479 HD21 LEU 63 3HD2 LEU 63 10.786 -7.632 -16.113 480 HD22 LEU 63 1HD2 LEU 63 10.425 -8.941 -14.987 481 HD23 LEU 63 2HD2 LEU 63 10.014 -9.109 -16.694 482 H LYS 64 H LYS 64 15.140 -9.659 -13.380 483 HA LYS 64 HA LYS 64 14.923 -11.754 -11.515 484 HB2 LYS 64 1HB LYS 64 17.344 -11.416 -11.158 485 HB3 LYS 64 2HB LYS 64 16.919 -11.470 -12.864 486 HG2 LYS 64 1HG LYS 64 16.828 -8.873 -12.630 487 HG3 LYS 64 2HG LYS 64 17.836 -9.167 -11.211 488 HD2 LYS 64 1HD LYS 64 19.540 -9.084 -12.674 489 HD3 LYS 64 2HD LYS 64 19.055 -10.733 -13.075 490 HE2 LYS 64 1HE LYS 64 17.634 -8.543 -14.468 491 HE3 LYS 64 2HE LYS 64 19.323 -8.797 -14.906 492 HZ1 LYS 64 3HZ LYS 64 18.411 -10.277 -16.315 493 HZ2 LYS 64 1HZ LYS 64 17.006 -10.482 -15.394 494 HZ3 LYS 64 2HZ LYS 64 18.426 -11.295 -14.964 495 H TYR 65 H TYR 65 14.368 -8.480 -11.124 496 HA TYR 65 HA TYR 65 15.010 -8.567 -8.254 497 HB2 TYR 65 1HB TYR 65 14.640 -6.268 -10.169 498 HB3 TYR 65 2HB TYR 65 14.636 -6.041 -8.423 499 HD1 TYR 65 HD2 TYR 65 16.697 -7.083 -11.304 500 HD2 TYR 65 HD1 TYR 65 16.664 -6.065 -7.173 501 HE1 TYR 65 HE2 TYR 65 19.153 -6.956 -11.321 502 HE2 TYR 65 HE1 TYR 65 19.120 -5.935 -7.179 503 HH TYR 65 HH TYR 65 21.013 -7.067 -9.810 504 H PHE 66 H PHE 66 12.706 -9.879 -9.380 505 HA PHE 66 HA PHE 66 10.428 -8.209 -8.729 506 HB2 PHE 66 1HB PHE 66 10.473 -9.922 -10.611 507 HB3 PHE 66 2HB PHE 66 10.391 -11.159 -9.362 508 HD1 PHE 66 HD1 PHE 66 8.600 -8.302 -10.861 509 HD2 PHE 66 HD2 PHE 66 8.354 -11.694 -8.301 510 HE1 PHE 66 HE1 PHE 66 6.149 -8.092 -10.823 511 HE2 PHE 66 HE2 PHE 66 5.903 -11.490 -8.261 512 HZ PHE 66 HZ PHE 66 4.797 -9.688 -9.523 513 H LEU 67 H LEU 67 11.393 -11.473 -7.660 514 HA LEU 67 HA LEU 67 9.803 -11.615 -5.411 515 HB2 LEU 67 1HB LEU 67 12.576 -12.764 -5.508 516 HB3 LEU 67 2HB LEU 67 11.159 -13.399 -4.675 517 HG LEU 67 HG LEU 67 11.667 -13.392 -7.647 518 HD11 LEU 67 1HD1 LEU 67 12.834 -15.206 -6.926 519 HD12 LEU 67 2HD1 LEU 67 11.233 -15.935 -7.045 520 HD13 LEU 67 3HD1 LEU 67 11.847 -15.408 -5.478 521 HD21 LEU 67 3HD2 LEU 67 9.438 -13.298 -7.827 522 HD22 LEU 67 1HD2 LEU 67 9.191 -13.608 -6.108 523 HD23 LEU 67 2HD2 LEU 67 9.464 -14.953 -7.216 524 H GLN 68 H GLN 68 12.729 -9.831 -5.899 525 HA GLN 68 HA GLN 68 13.709 -9.498 -3.349 526 HB2 GLN 68 1HB GLN 68 14.234 -8.383 -5.797 527 HB3 GLN 68 2HB GLN 68 13.615 -7.004 -4.897 528 HG2 GLN 68 1HG GLN 68 15.395 -6.933 -3.502 529 HG3 GLN 68 2HG GLN 68 15.641 -8.678 -3.547 530 HE21 GLN 68 2HE2 GLN 68 15.997 -9.260 -6.112 531 HE22 GLN 68 1HE2 GLN 68 17.365 -8.432 -6.765 532 H ARG 69 H ARG 69 10.768 -8.285 -4.708 533 HA ARG 69 HA ARG 69 10.355 -6.345 -2.591 534 HB2 ARG 69 1HB ARG 69 8.732 -7.207 -4.976 535 HB3 ARG 69 2HB ARG 69 8.070 -6.142 -3.743 536 HG2 ARG 69 1HG ARG 69 10.538 -5.585 -5.376 537 HG3 ARG 69 2HG ARG 69 8.934 -4.916 -5.680 538 HD2 ARG 69 1HD ARG 69 10.759 -4.417 -3.346 539 HD3 ARG 69 2HD ARG 69 10.108 -3.250 -4.496 540 HE ARG 69 HE ARG 69 7.886 -4.220 -3.329 541 HH11 ARG 69 1HH1 ARG 69 10.866 -2.963 -2.042 542 HH12 ARG 69 2HH1 ARG 69 10.134 -2.346 -0.597 543 HH21 ARG 69 1HH2 ARG 69 6.911 -3.413 -1.432 544 HH22 ARG 69 2HH2 ARG 69 7.885 -2.603 -0.251 545 H PHE 70 H PHE 70 8.185 -8.885 -3.818 546 HA PHE 70 HA PHE 70 6.710 -9.153 -1.473 547 HB2 PHE 70 1HB PHE 70 7.218 -11.275 -3.569 548 HB3 PHE 70 2HB PHE 70 5.893 -11.261 -2.410 549 HD1 PHE 70 HD1 PHE 70 4.116 -9.543 -2.593 550 HD2 PHE 70 HD2 PHE 70 7.120 -10.021 -5.570 551 HE1 PHE 70 HE1 PHE 70 2.736 -8.271 -4.185 552 HE2 PHE 70 HE2 PHE 70 5.746 -8.749 -7.166 553 HZ PHE 70 HZ PHE 70 3.551 -7.872 -6.474 554 H GLU 71 H GLU 71 9.142 -11.464 -2.693 555 HA GLU 71 HA GLU 71 9.310 -13.078 -0.468 556 HB2 GLU 71 1HB GLU 71 10.483 -13.215 -2.806 557 HB3 GLU 71 2HB GLU 71 11.800 -12.392 -1.984 558 HG2 GLU 71 1HG GLU 71 12.409 -14.222 -0.853 559 HG3 GLU 71 2HG GLU 71 10.743 -14.710 -0.545 560 H SER 72 H SER 72 11.298 -13.264 0.987 561 HA SER 72 HA SER 72 11.358 -11.108 2.750 562 HB2 SER 72 1HB SER 72 12.039 -13.572 3.135 563 HB3 SER 72 2HB SER 72 13.627 -13.077 2.547 564 HG SER 72 HG SER 72 12.223 -12.010 4.772 565 H GLY 73 H GLY 73 13.820 -12.124 0.382 566 HA2 GLY 73 1HA GLY 73 14.527 -9.504 -0.350 567 HA3 GLY 73 2HA GLY 73 15.644 -10.053 0.891 568 H ALA 74 H ALA 74 14.137 -11.442 -2.031 569 HA ALA 74 HA ALA 74 16.138 -13.244 -2.658 570 HB1 ALA 74 1HB ALA 74 14.987 -13.625 -4.563 571 HB2 ALA 74 2HB ALA 74 13.769 -12.631 -3.762 572 HB3 ALA 74 3HB ALA 74 14.850 -11.910 -4.954 573 H ARG 75 H ARG 75 17.460 -13.053 -4.795 574 HA ARG 75 HA ARG 75 18.905 -10.484 -4.746 575 HB2 ARG 75 1HB ARG 75 20.783 -12.207 -5.662 576 HB3 ARG 75 2HB ARG 75 20.600 -11.762 -3.971 577 HG2 ARG 75 1HG ARG 75 19.625 -13.771 -3.406 578 HG3 ARG 75 2HG ARG 75 19.079 -14.087 -5.054 579 HD2 ARG 75 1HD ARG 75 21.470 -14.371 -5.711 580 HD3 ARG 75 2HD ARG 75 21.901 -14.236 -4.006 581 HE ARG 75 HE ARG 75 21.214 -16.393 -3.707 582 HH11 ARG 75 1HH1 ARG 75 19.884 -15.191 -6.691 583 HH12 ARG 75 2HH1 ARG 75 19.239 -16.724 -7.174 584 HH21 ARG 75 1HH2 ARG 75 20.369 -18.418 -4.331 585 HH22 ARG 75 2HH2 ARG 75 19.515 -18.559 -5.830 586 H VAL 76 H VAL 76 19.020 -13.356 -6.844 587 HA VAL 76 HA VAL 76 18.052 -11.760 -9.092 588 HB VAL 76 HB VAL 76 20.528 -13.406 -9.488 589 HG11 VAL 76 1HG1 VAL 76 19.367 -12.772 -11.484 590 HG12 VAL 76 2HG1 VAL 76 19.264 -11.093 -10.950 591 HG13 VAL 76 3HG1 VAL 76 20.829 -11.794 -11.365 592 HG21 VAL 76 3HG2 VAL 76 21.387 -11.973 -7.884 593 HG22 VAL 76 1HG2 VAL 76 21.701 -11.091 -9.379 594 HG23 VAL 76 2HG2 VAL 76 20.333 -10.641 -8.360 595 H LEU 77 H LEU 77 16.410 -12.906 -9.862 596 HA LEU 77 HA LEU 77 15.881 -15.585 -9.383 597 HB2 LEU 77 1HB LEU 77 14.966 -13.675 -11.500 598 HB3 LEU 77 2HB LEU 77 14.440 -15.357 -11.517 599 HG LEU 77 HG LEU 77 14.046 -13.991 -8.950 600 HD11 LEU 77 1HD1 LEU 77 11.837 -13.120 -10.361 601 HD12 LEU 77 2HD1 LEU 77 13.194 -12.720 -11.413 602 HD13 LEU 77 3HD1 LEU 77 13.156 -12.118 -9.756 603 HD21 LEU 77 3HD2 LEU 77 12.869 -16.084 -10.581 604 HD22 LEU 77 1HD2 LEU 77 11.655 -15.006 -9.891 605 HD23 LEU 77 2HD2 LEU 77 12.800 -15.835 -8.835 606 H THR 78 H THR 78 15.472 -17.122 -11.408 607 HA THR 78 HA THR 78 18.086 -17.837 -12.336 608 HB THR 78 HB THR 78 17.050 -19.762 -13.347 609 HG1 THR 78 HG1 THR 78 14.802 -19.926 -13.524 610 HG21 THR 78 3HG2 THR 78 16.278 -20.817 -11.434 611 HG22 THR 78 1HG2 THR 78 15.415 -19.388 -10.868 612 HG23 THR 78 2HG2 THR 78 17.175 -19.456 -10.760 613 H ALA 79 H ALA 79 17.868 -18.765 -14.832 614 HA ALA 79 HA ALA 79 17.641 -16.314 -16.398 615 HB1 ALA 79 1HB ALA 79 19.659 -17.246 -16.924 616 HB2 ALA 79 2HB ALA 79 19.073 -18.898 -16.732 617 HB3 ALA 79 3HB ALA 79 18.655 -17.977 -18.176 618 H SER 80 H SER 80 15.630 -18.764 -15.576 619 HA SER 80 HA SER 80 14.286 -18.815 -18.194 620 HB2 SER 80 1HB SER 80 14.518 -20.780 -15.975 621 HB3 SER 80 2HB SER 80 12.983 -20.732 -16.842 622 HG SER 80 HG SER 80 15.320 -21.799 -17.613 623 H GLU 81 H GLU 81 13.684 -18.474 -14.713 624 HA GLU 81 HA GLU 81 10.967 -17.976 -14.753 625 HB2 GLU 81 1HB GLU 81 13.085 -16.774 -12.965 626 HB3 GLU 81 2HB GLU 81 11.357 -16.660 -12.666 627 HG2 GLU 81 1HG GLU 81 12.732 -19.304 -12.971 628 HG3 GLU 81 2HG GLU 81 12.663 -18.460 -11.426 629 H THR 82 H THR 82 13.615 -15.622 -15.051 630 HA THR 82 HA THR 82 11.881 -13.394 -15.444 631 HB THR 82 HB THR 82 13.894 -12.148 -16.057 632 HG1 THR 82 HG1 THR 82 15.860 -13.210 -16.293 633 HG21 THR 82 3HG2 THR 82 14.905 -13.841 -13.842 634 HG22 THR 82 1HG2 THR 82 13.328 -13.086 -13.618 635 HG23 THR 82 2HG2 THR 82 14.745 -12.088 -13.945 636 H LYS 83 H LYS 83 13.592 -15.605 -17.584 637 HA LYS 83 HA LYS 83 13.222 -14.222 -19.995 638 HB2 LYS 83 1HB LYS 83 14.768 -16.052 -19.906 639 HB3 LYS 83 2HB LYS 83 13.504 -17.170 -19.410 640 HG2 LYS 83 1HG LYS 83 14.108 -17.490 -21.744 641 HG3 LYS 83 2HG LYS 83 12.435 -16.949 -21.586 642 HD2 LYS 83 1HD LYS 83 13.157 -14.648 -22.095 643 HD3 LYS 83 2HD LYS 83 14.809 -15.231 -22.311 644 HE2 LYS 83 1HE LYS 83 14.065 -16.665 -24.143 645 HE3 LYS 83 2HE LYS 83 12.409 -16.106 -23.917 646 HZ1 LYS 83 3HZ LYS 83 13.403 -13.795 -24.306 647 HZ2 LYS 83 1HZ LYS 83 13.198 -14.808 -25.646 648 HZ3 LYS 83 2HZ LYS 83 14.731 -14.615 -24.958 649 H THR 84 H THR 84 10.995 -15.878 -18.002 650 HA THR 84 HA THR 84 9.011 -15.957 -20.178 651 HB THR 84 HB THR 84 9.438 -18.125 -19.043 652 HG1 THR 84 HG1 THR 84 7.421 -18.423 -19.578 653 HG21 THR 84 3HG2 THR 84 9.960 -17.456 -16.815 654 HG22 THR 84 1HG2 THR 84 8.461 -18.380 -16.734 655 HG23 THR 84 2HG2 THR 84 8.418 -16.619 -16.638 656 H PHE 85 H PHE 85 9.819 -13.597 -18.585 657 HA PHE 85 HA PHE 85 7.322 -13.056 -17.132 658 HB2 PHE 85 1HB PHE 85 10.090 -12.360 -16.665 659 HB3 PHE 85 2HB PHE 85 9.086 -10.915 -16.726 660 HD1 PHE 85 HD2 PHE 85 8.642 -14.361 -15.357 661 HD2 PHE 85 HD1 PHE 85 8.529 -10.167 -14.639 662 HE1 PHE 85 HE2 PHE 85 7.907 -14.780 -13.047 663 HE2 PHE 85 HE1 PHE 85 7.795 -10.579 -12.327 664 HZ PHE 85 HZ PHE 85 7.481 -12.888 -11.529 665 H LEU 86 H LEU 86 9.561 -11.604 -19.477 666 HA LEU 86 HA LEU 86 7.345 -9.898 -20.407 667 HB2 LEU 86 1HB LEU 86 9.032 -8.326 -21.201 668 HB3 LEU 86 2HB LEU 86 9.162 -8.599 -19.465 669 HG LEU 86 HG LEU 86 11.033 -10.249 -20.056 670 HD11 LEU 86 1HD1 LEU 86 10.277 -9.357 -22.675 671 HD12 LEU 86 2HD1 LEU 86 11.425 -10.610 -22.207 672 HD13 LEU 86 3HD1 LEU 86 11.958 -8.935 -22.349 673 HD21 LEU 86 3HD2 LEU 86 11.358 -7.284 -20.499 674 HD22 LEU 86 1HD2 LEU 86 12.682 -8.413 -20.215 675 HD23 LEU 86 2HD2 LEU 86 11.469 -8.145 -18.963 676 H ALA 87 H ALA 87 9.675 -12.288 -21.245 677 HA ALA 87 HA ALA 87 9.478 -11.883 -24.096 678 HB1 ALA 87 1HB ALA 87 11.291 -13.168 -24.193 679 HB2 ALA 87 2HB ALA 87 11.290 -13.153 -22.429 680 HB3 ALA 87 3HB ALA 87 10.505 -14.470 -23.299 681 H ALA 88 H ALA 88 7.937 -13.850 -21.662 682 HA ALA 88 HA ALA 88 6.796 -15.807 -23.330 683 HB1 ALA 88 1HB ALA 88 5.583 -14.753 -20.785 684 HB2 ALA 88 2HB ALA 88 5.386 -16.354 -21.498 685 HB3 ALA 88 3HB ALA 88 6.943 -15.876 -20.824 686 H ALA 89 H ALA 89 5.606 -12.647 -22.255 687 HA ALA 89 HA ALA 89 3.025 -12.717 -23.212 688 HB1 ALA 89 1HB ALA 89 3.132 -10.686 -22.325 689 HB2 ALA 89 2HB ALA 89 4.894 -10.690 -22.409 690 HB3 ALA 89 3HB ALA 89 3.947 -10.136 -23.789 691 H ASP 90 H ASP 90 5.548 -10.957 -24.995 692 HA ASP 90 HA ASP 90 5.282 -12.356 -27.416 693 HB2 ASP 90 1HB ASP 90 3.000 -11.036 -27.052 694 HB3 ASP 90 2HB ASP 90 3.945 -9.709 -27.722 695 H HIS 91 H HIS 91 6.122 -10.940 -29.314 696 HA HIS 91 HA HIS 91 8.056 -8.959 -28.335 697 HB2 HIS 91 1HB HIS 91 9.715 -9.978 -29.985 698 HB3 HIS 91 2HB HIS 91 9.408 -10.892 -28.511 699 HD1 HIS 91 HD1 HIS 91 9.171 -11.091 -32.184 700 HD2 HIS 91 HD2 HIS 91 7.813 -13.242 -28.899 701 HE1 HIS 91 HE1 HIS 91 8.420 -13.311 -33.098 702 H ASP 92 H ASP 92 6.637 -7.383 -29.218 703 HA ASP 92 HA ASP 92 6.134 -7.422 -32.077 704 HB2 ASP 92 1HB ASP 92 4.294 -6.596 -30.878 705 HB3 ASP 92 2HB ASP 92 5.307 -5.616 -29.821 706 H GLY 93 H GLY 93 8.132 -5.696 -29.750 707 HA2 GLY 93 1HA GLY 93 9.318 -4.148 -31.959 708 HA3 GLY 93 2HA GLY 93 9.401 -3.710 -30.259 709 H ASP 94 H ASP 94 10.857 -4.813 -28.889 710 HA ASP 94 HA ASP 94 12.831 -6.519 -30.238 711 HB2 ASP 94 1HB ASP 94 13.264 -3.843 -29.275 712 HB3 ASP 94 2HB ASP 94 14.248 -4.973 -28.348 713 H GLY 95 H GLY 95 10.580 -6.893 -28.267 714 HA2 GLY 95 1HA GLY 95 10.430 -8.684 -26.724 715 HA3 GLY 95 2HA GLY 95 12.139 -8.486 -26.366 716 H LYS 96 H LYS 96 10.420 -5.561 -26.470 717 HA LYS 96 HA LYS 96 10.503 -5.413 -23.540 718 HB2 LYS 96 1HB LYS 96 10.470 -2.986 -23.829 719 HB3 LYS 96 2HB LYS 96 11.783 -3.707 -24.751 720 HG2 LYS 96 1HG LYS 96 9.966 -3.672 -26.673 721 HG3 LYS 96 2HG LYS 96 9.318 -2.356 -25.692 722 HD2 LYS 96 1HD LYS 96 11.171 -1.023 -26.015 723 HD3 LYS 96 2HD LYS 96 12.232 -2.397 -26.338 724 HE2 LYS 96 1HE LYS 96 11.470 -2.624 -28.527 725 HE3 LYS 96 2HE LYS 96 9.994 -1.713 -28.209 726 HZ1 LYS 96 3HZ LYS 96 11.809 -0.558 -29.523 727 HZ2 LYS 96 1HZ LYS 96 12.663 -0.448 -28.066 728 HZ3 LYS 96 2HZ LYS 96 11.153 0.298 -28.220 729 H ILE 97 H ILE 97 8.738 -4.756 -22.334 730 HA ILE 97 HA ILE 97 6.164 -5.280 -23.538 731 HB ILE 97 HB ILE 97 6.793 -4.458 -20.701 732 HG12 ILE 97 1HG1 ILE 97 7.927 -6.547 -21.288 733 HG13 ILE 97 2HG1 ILE 97 6.601 -6.855 -20.172 734 HG21 ILE 97 1HG2 ILE 97 4.502 -5.961 -20.667 735 HG22 ILE 97 2HG2 ILE 97 4.575 -4.201 -20.606 736 HG23 ILE 97 3HG2 ILE 97 4.323 -5.020 -22.148 737 HD11 ILE 97 3HD1 ILE 97 5.213 -7.623 -22.007 738 HD12 ILE 97 1HD1 ILE 97 6.509 -7.271 -23.151 739 HD13 ILE 97 2HD1 ILE 97 6.722 -8.533 -21.936 740 H GLY 98 H GLY 98 4.440 -3.847 -23.699 741 HA2 GLY 98 1HA GLY 98 5.199 -0.998 -23.515 742 HA3 GLY 98 2HA GLY 98 4.086 -1.647 -24.710 743 H ALA 99 H ALA 99 4.156 -2.414 -21.266 744 HA ALA 99 HA ALA 99 2.548 -2.270 -19.658 745 HB1 ALA 99 1HB ALA 99 1.987 0.364 -21.015 746 HB2 ALA 99 2HB ALA 99 1.481 -0.093 -19.388 747 HB3 ALA 99 3HB ALA 99 3.196 0.083 -19.762 748 H GLU 100 H GLU 100 1.847 -3.503 -22.259 749 HA GLU 100 HA GLU 100 -1.059 -3.437 -21.901 750 HB2 GLU 100 1HB GLU 100 -1.405 -3.449 -24.347 751 HB3 GLU 100 2HB GLU 100 -0.654 -1.963 -23.783 752 HG2 GLU 100 1HG GLU 100 1.567 -3.133 -24.400 753 HG3 GLU 100 2HG GLU 100 0.542 -4.201 -25.357 754 H GLU 101 H GLU 101 1.784 -5.055 -23.200 755 HA GLU 101 HA GLU 101 0.461 -7.481 -23.877 756 HB2 GLU 101 1HB GLU 101 3.327 -6.670 -23.529 757 HB3 GLU 101 2HB GLU 101 2.910 -8.367 -23.722 758 HG2 GLU 101 1HG GLU 101 2.252 -6.161 -25.661 759 HG3 GLU 101 2HG GLU 101 3.542 -7.349 -25.840 760 H PHE 102 H PHE 102 2.789 -6.802 -21.258 761 HA PHE 102 HA PHE 102 2.491 -9.146 -19.843 762 HB2 PHE 102 1HB PHE 102 4.198 -7.429 -19.351 763 HB3 PHE 102 2HB PHE 102 2.946 -6.391 -18.678 764 HD1 PHE 102 HD1 PHE 102 1.741 -7.110 -16.614 765 HD2 PHE 102 HD2 PHE 102 5.182 -9.145 -18.076 766 HE1 PHE 102 HE1 PHE 102 2.053 -8.159 -14.410 767 HE2 PHE 102 HE2 PHE 102 5.498 -10.198 -15.875 768 HZ PHE 102 HZ PHE 102 3.933 -9.706 -14.039 769 H GLN 103 H GLN 103 0.766 -6.087 -19.215 770 HA GLN 103 HA GLN 103 -0.895 -6.952 -17.188 771 HB2 GLN 103 1HB GLN 103 -1.276 -4.894 -19.348 772 HB3 GLN 103 2HB GLN 103 -2.521 -5.191 -18.141 773 HG2 GLN 103 1HG GLN 103 -1.151 -3.311 -17.497 774 HG3 GLN 103 2HG GLN 103 -0.930 -4.647 -16.368 775 HE21 GLN 103 2HE2 GLN 103 0.460 -4.037 -19.566 776 HE22 GLN 103 1HE2 GLN 103 2.108 -4.069 -19.049 777 H GLU 104 H GLU 104 -1.545 -7.007 -20.688 778 HA GLU 104 HA GLU 104 -4.091 -8.092 -20.630 779 HB2 GLU 104 1HB GLU 104 -1.869 -8.079 -22.607 780 HB3 GLU 104 2HB GLU 104 -3.187 -9.209 -22.882 781 HG2 GLU 104 1HG GLU 104 -4.787 -7.378 -22.849 782 HG3 GLU 104 2HG GLU 104 -3.484 -6.235 -22.532 783 H MET 105 H MET 105 -0.976 -9.803 -20.766 784 HA MET 105 HA MET 105 -1.889 -12.404 -20.898 785 HB2 MET 105 1HB MET 105 0.391 -12.317 -21.091 786 HB3 MET 105 2HB MET 105 0.561 -11.105 -19.828 787 HG2 MET 105 1HG MET 105 0.318 -12.738 -18.117 788 HG3 MET 105 2HG MET 105 -0.146 -13.974 -19.284 789 HE1 MET 105 3HE MET 105 2.783 -11.398 -18.560 790 HE2 MET 105 1HE MET 105 4.052 -12.109 -19.559 791 HE3 MET 105 2HE MET 105 2.592 -11.467 -20.313 792 H VAL 106 H VAL 106 -1.961 -10.196 -18.226 793 HA VAL 106 HA VAL 106 -2.429 -12.213 -16.224 794 HB VAL 106 HB VAL 106 -2.918 -9.243 -15.999 795 HG11 VAL 106 1HG1 VAL 106 -2.039 -10.777 -13.664 796 HG12 VAL 106 2HG1 VAL 106 -3.312 -9.563 -13.814 797 HG13 VAL 106 3HG1 VAL 106 -3.627 -11.236 -14.279 798 HG21 VAL 106 3HG2 VAL 106 -0.680 -9.267 -16.548 799 HG22 VAL 106 1HG2 VAL 106 -0.607 -9.434 -14.794 800 HG23 VAL 106 2HG2 VAL 106 -0.409 -10.852 -15.823 801 H GLN 107 H GLN 107 -4.445 -9.471 -17.299 802 HA GLN 107 HA GLN 107 -6.832 -10.341 -16.206 803 HB2 GLN 107 1HB GLN 107 -7.895 -8.952 -18.081 804 HB3 GLN 107 2HB GLN 107 -6.791 -8.128 -16.987 805 HG2 GLN 107 1HG GLN 107 -5.044 -8.159 -18.604 806 HG3 GLN 107 2HG GLN 107 -5.973 -9.216 -19.667 807 HE21 GLN 107 2HE2 GLN 107 -7.000 -6.350 -17.877 808 HE22 GLN 107 1HE2 GLN 107 -7.465 -5.432 -19.264 809 H SER 108 H SER 108 -5.221 -11.373 -19.109 810 HA SER 108 HA SER 108 -7.494 -13.152 -19.709 811 HB2 SER 108 1HB SER 108 -7.077 -11.532 -21.509 812 HB3 SER 108 2HB SER 108 -5.402 -12.072 -21.615 813 HG SER 108 HG SER 108 -6.168 -13.447 -23.006 Start of MODEL 11 1 H1 SER 1 H SER 1 1.036 -0.522 0.558 2 HA SER 1 HA SER 1 0.046 -0.359 -2.027 3 HB2 SER 1 1HB SER 1 1.761 1.160 -0.997 4 HB3 SER 1 2HB SER 1 2.962 -0.104 -1.260 5 HG SER 1 HG SER 1 2.684 0.102 -3.452 6 H LEU 2 H LEU 2 2.595 -2.481 -0.756 7 HA LEU 2 HA LEU 2 3.175 -3.760 -3.203 8 HB2 LEU 2 1HB LEU 2 4.726 -3.853 -1.372 9 HB3 LEU 2 2HB LEU 2 3.538 -4.660 -0.351 10 HG LEU 2 HG LEU 2 3.661 -6.524 -2.182 11 HD11 LEU 2 1HD1 LEU 2 6.261 -5.053 -2.567 12 HD12 LEU 2 2HD1 LEU 2 5.023 -5.372 -3.781 13 HD13 LEU 2 3HD1 LEU 2 5.960 -6.705 -3.106 14 HD21 LEU 2 3HD2 LEU 2 4.951 -6.050 0.291 15 HD22 LEU 2 1HD2 LEU 2 6.120 -6.827 -0.777 16 HD23 LEU 2 2HD2 LEU 2 4.564 -7.597 -0.464 17 H THR 3 H THR 3 1.702 -5.384 -0.405 18 HA THR 3 HA THR 3 0.110 -6.996 -2.268 19 HB THR 3 HB THR 3 -0.259 -8.510 -0.337 20 HG1 THR 3 HG1 THR 3 1.720 -7.024 1.044 21 HG21 THR 3 3HG2 THR 3 2.676 -8.227 -0.340 22 HG22 THR 3 1HG2 THR 3 1.922 -8.346 -1.928 23 HG23 THR 3 2HG2 THR 3 1.671 -9.620 -0.735 24 H ASP 4 H ASP 4 -0.476 -4.197 -1.253 25 HA ASP 4 HA ASP 4 -2.789 -4.471 0.426 26 HB2 ASP 4 1HB ASP 4 -1.334 -2.447 0.426 27 HB3 ASP 4 2HB ASP 4 -1.903 -2.079 -1.200 28 H ILE 5 H ILE 5 -2.323 -3.450 -2.959 29 HA ILE 5 HA ILE 5 -5.018 -3.281 -3.650 30 HB ILE 5 HB ILE 5 -2.596 -2.977 -4.992 31 HG12 ILE 5 1HG1 ILE 5 -4.206 -2.283 -6.903 32 HG13 ILE 5 2HG1 ILE 5 -5.487 -2.681 -5.763 33 HG21 ILE 5 1HG2 ILE 5 -2.754 -5.353 -5.654 34 HG22 ILE 5 2HG2 ILE 5 -4.288 -5.002 -6.447 35 HG23 ILE 5 3HG2 ILE 5 -2.802 -4.252 -7.030 36 HD11 ILE 5 3HD1 ILE 5 -5.313 -0.606 -5.016 37 HD12 ILE 5 1HD1 ILE 5 -3.760 -1.067 -4.320 38 HD13 ILE 5 2HD1 ILE 5 -3.825 -0.334 -5.923 39 H LEU 6 H LEU 6 -3.004 -6.042 -3.175 40 HA LEU 6 HA LEU 6 -5.173 -7.777 -4.159 41 HB2 LEU 6 1HB LEU 6 -2.502 -7.703 -4.983 42 HB3 LEU 6 2HB LEU 6 -2.636 -9.128 -3.954 43 HG LEU 6 HG LEU 6 -4.787 -9.487 -5.539 44 HD11 LEU 6 1HD1 LEU 6 -2.723 -8.133 -7.270 45 HD12 LEU 6 2HD1 LEU 6 -4.317 -7.494 -6.870 46 HD13 LEU 6 3HD1 LEU 6 -4.173 -8.962 -7.837 47 HD21 LEU 6 3HD2 LEU 6 -3.656 -11.366 -5.861 48 HD22 LEU 6 1HD2 LEU 6 -2.206 -10.599 -5.213 49 HD23 LEU 6 2HD2 LEU 6 -2.541 -10.529 -6.943 50 H SER 7 H SER 7 -4.356 -10.176 -3.152 51 HA SER 7 HA SER 7 -4.769 -9.762 -0.287 52 HB2 SER 7 1HB SER 7 -6.137 -11.367 -1.880 53 HB3 SER 7 2HB SER 7 -4.804 -12.474 -1.550 54 HG SER 7 HG SER 7 -6.255 -11.147 0.489 55 HA PRO 8 HA PRO 8 -0.440 -10.651 0.335 56 HB2 PRO 8 1HB PRO 8 -0.508 -10.402 3.037 57 HB3 PRO 8 2HB PRO 8 -0.491 -9.013 1.945 58 HG2 PRO 8 1HG PRO 8 -2.805 -10.286 3.354 59 HG3 PRO 8 2HG PRO 8 -2.435 -8.565 3.140 60 HD2 PRO 8 1HD PRO 8 -4.254 -9.865 1.613 61 HD3 PRO 8 2HD PRO 8 -3.271 -8.524 0.992 62 H SER 9 H SER 9 -3.176 -12.378 1.508 63 HA SER 9 HA SER 9 -1.546 -14.509 2.658 64 HB2 SER 9 1HB SER 9 -3.554 -15.395 3.563 65 HB3 SER 9 2HB SER 9 -3.691 -13.646 3.742 66 HG SER 9 HG SER 9 -4.804 -13.850 1.570 67 H ASP 10 H ASP 10 -1.804 -13.802 -0.291 68 HA ASP 10 HA ASP 10 -2.410 -16.534 -1.199 69 HB2 ASP 10 1HB ASP 10 -3.348 -13.926 -2.341 70 HB3 ASP 10 2HB ASP 10 -3.099 -15.306 -3.407 71 H ILE 11 H ILE 11 -0.578 -13.573 -1.641 72 HA ILE 11 HA ILE 11 0.999 -14.493 -3.819 73 HB ILE 11 HB ILE 11 1.596 -12.324 -1.803 74 HG12 ILE 11 1HG1 ILE 11 0.773 -11.745 -4.601 75 HG13 ILE 11 2HG1 ILE 11 -0.476 -12.318 -3.502 76 HG21 ILE 11 1HG2 ILE 11 3.140 -13.436 -3.997 77 HG22 ILE 11 2HG2 ILE 11 2.876 -11.701 -4.166 78 HG23 ILE 11 3HG2 ILE 11 3.635 -12.339 -2.708 79 HD11 ILE 11 3HD1 ILE 11 -0.014 -10.483 -1.989 80 HD12 ILE 11 1HD1 ILE 11 1.288 -9.925 -3.039 81 HD13 ILE 11 2HD1 ILE 11 -0.382 -9.882 -3.606 82 H ALA 12 H ALA 12 1.148 -14.938 -0.393 83 HA ALA 12 HA ALA 12 3.908 -15.631 -0.227 84 HB1 ALA 12 1HB ALA 12 3.463 -15.453 1.937 85 HB2 ALA 12 2HB ALA 12 1.743 -15.301 1.577 86 HB3 ALA 12 3HB ALA 12 2.449 -16.894 1.853 87 H ALA 13 H ALA 13 0.947 -17.406 -0.847 88 HA ALA 13 HA ALA 13 2.072 -20.006 -0.552 89 HB1 ALA 13 1HB ALA 13 -0.369 -19.232 -2.141 90 HB2 ALA 13 2HB ALA 13 0.024 -20.824 -1.491 91 HB3 ALA 13 3HB ALA 13 -0.358 -19.494 -0.397 92 H ALA 14 H ALA 14 2.301 -17.632 -2.974 93 HA ALA 14 HA ALA 14 2.929 -19.566 -5.075 94 HB1 ALA 14 1HB ALA 14 1.567 -17.270 -5.245 95 HB2 ALA 14 2HB ALA 14 3.188 -16.668 -5.597 96 HB3 ALA 14 3HB ALA 14 2.486 -17.945 -6.591 97 H LEU 15 H LEU 15 4.431 -16.870 -3.320 98 HA LEU 15 HA LEU 15 6.910 -16.857 -4.557 99 HB2 LEU 15 1HB LEU 15 6.049 -16.217 -1.757 100 HB3 LEU 15 2HB LEU 15 7.734 -16.073 -2.253 101 HG LEU 15 HG LEU 15 5.402 -14.548 -3.412 102 HD11 LEU 15 1HD1 LEU 15 5.735 -13.414 -1.480 103 HD12 LEU 15 2HD1 LEU 15 7.026 -12.677 -2.427 104 HD13 LEU 15 3HD1 LEU 15 7.395 -13.982 -1.300 105 HD21 LEU 15 3HD2 LEU 15 7.004 -14.917 -5.143 106 HD22 LEU 15 1HD2 LEU 15 8.343 -14.522 -4.065 107 HD23 LEU 15 2HD2 LEU 15 7.213 -13.263 -4.564 108 H ARG 16 H ARG 16 5.556 -19.158 -2.365 109 HA ARG 16 HA ARG 16 8.143 -20.389 -1.823 110 HB2 ARG 16 1HB ARG 16 6.539 -20.195 0.021 111 HB3 ARG 16 2HB ARG 16 5.367 -21.140 -0.889 112 HG2 ARG 16 1HG ARG 16 7.270 -22.931 -0.911 113 HG3 ARG 16 2HG ARG 16 7.859 -22.020 0.481 114 HD2 ARG 16 1HD ARG 16 5.073 -23.141 0.204 115 HD3 ARG 16 2HD ARG 16 6.384 -23.914 1.095 116 HE ARG 16 HE ARG 16 6.229 -22.243 2.734 117 HH11 ARG 16 1HH1 ARG 16 3.930 -21.786 0.160 118 HH12 ARG 16 2HH1 ARG 16 2.954 -20.668 1.054 119 HH21 ARG 16 1HH2 ARG 16 4.953 -20.772 3.921 120 HH22 ARG 16 2HH2 ARG 16 3.538 -20.091 3.193 121 H ASP 17 H ASP 17 5.106 -21.085 -3.490 122 HA ASP 17 HA ASP 17 5.908 -23.702 -4.330 123 HB2 ASP 17 1HB ASP 17 3.506 -22.613 -4.089 124 HB3 ASP 17 2HB ASP 17 3.784 -22.177 -5.773 125 H CYS 18 H CYS 18 6.892 -20.678 -5.255 126 HA CYS 18 HA CYS 18 7.598 -21.617 -7.957 127 HB2 CYS 18 1HB CYS 18 7.341 -19.468 -8.826 128 HB3 CYS 18 2HB CYS 18 6.004 -19.587 -7.689 129 HG CYS 18 HG CYS 18 8.317 -18.404 -5.868 130 H GLN 19 H GLN 19 8.914 -21.570 -5.130 131 HA GLN 19 HA GLN 19 11.206 -19.927 -5.336 132 HB2 GLN 19 1HB GLN 19 10.262 -22.087 -3.573 133 HB3 GLN 19 2HB GLN 19 12.011 -21.957 -3.701 134 HG2 GLN 19 1HG GLN 19 11.562 -19.424 -3.258 135 HG3 GLN 19 2HG GLN 19 10.043 -20.019 -2.591 136 HE21 GLN 19 2HE2 GLN 19 10.055 -20.516 -0.524 137 HE22 GLN 19 1HE2 GLN 19 11.445 -20.913 0.421 138 H ALA 20 H ALA 20 10.330 -22.760 -6.951 139 HA ALA 20 HA ALA 20 13.006 -23.771 -7.353 140 HB1 ALA 20 1HB ALA 20 12.024 -25.613 -8.186 141 HB2 ALA 20 2HB ALA 20 10.567 -24.943 -7.450 142 HB3 ALA 20 3HB ALA 20 10.885 -24.689 -9.167 143 HA PRO 21 HA PRO 21 14.136 -21.549 -10.964 144 HB2 PRO 21 1HB PRO 21 15.383 -23.454 -12.443 145 HB3 PRO 21 2HB PRO 21 16.088 -22.761 -10.978 146 HG2 PRO 21 1HG PRO 21 14.631 -25.351 -11.337 147 HG3 PRO 21 2HG PRO 21 16.104 -25.016 -10.409 148 HD2 PRO 21 1HD PRO 21 13.669 -25.241 -9.246 149 HD3 PRO 21 2HD PRO 21 14.931 -24.163 -8.617 150 H ASP 22 H ASP 22 13.475 -21.055 -13.034 151 HA ASP 22 HA ASP 22 11.889 -20.925 -14.685 152 HB2 ASP 22 1HB ASP 22 11.996 -22.743 -16.260 153 HB3 ASP 22 2HB ASP 22 13.602 -22.516 -15.573 154 H SER 23 H SER 23 10.788 -21.506 -12.098 155 HA SER 23 HA SER 23 8.466 -23.155 -12.858 156 HB2 SER 23 1HB SER 23 9.934 -22.849 -10.269 157 HB3 SER 23 2HB SER 23 8.206 -23.201 -10.229 158 HG SER 23 HG SER 23 8.903 -24.927 -11.851 159 H PHE 24 H PHE 24 9.571 -20.066 -11.902 160 HA PHE 24 HA PHE 24 6.901 -19.168 -11.123 161 HB2 PHE 24 1HB PHE 24 8.775 -18.439 -9.728 162 HB3 PHE 24 2HB PHE 24 9.550 -17.707 -11.129 163 HD1 PHE 24 HD1 PHE 24 6.117 -17.615 -9.663 164 HD2 PHE 24 HD2 PHE 24 9.480 -15.423 -11.076 165 HE1 PHE 24 HE1 PHE 24 4.928 -15.509 -9.212 166 HE2 PHE 24 HE2 PHE 24 8.297 -13.313 -10.628 167 HZ PHE 24 HZ PHE 24 6.018 -13.354 -9.694 168 H SER 25 H SER 25 5.737 -17.628 -12.239 169 HA SER 25 HA SER 25 6.771 -16.328 -14.575 170 HB2 SER 25 1HB SER 25 4.455 -17.864 -15.445 171 HB3 SER 25 2HB SER 25 6.026 -17.667 -16.221 172 HG SER 25 HG SER 25 6.054 -19.751 -15.707 173 HA PRO 26 HA PRO 26 3.533 -13.495 -13.728 174 HB2 PRO 26 1HB PRO 26 2.888 -12.589 -16.204 175 HB3 PRO 26 2HB PRO 26 4.396 -12.161 -15.387 176 HG2 PRO 26 1HG PRO 26 3.903 -14.233 -17.490 177 HG3 PRO 26 2HG PRO 26 5.244 -13.081 -17.347 178 HD2 PRO 26 1HD PRO 26 5.468 -15.676 -16.608 179 HD3 PRO 26 2HD PRO 26 6.352 -14.371 -15.791 180 H LYS 27 H LYS 27 2.833 -15.800 -16.325 181 HA LYS 27 HA LYS 27 -0.036 -15.536 -15.845 182 HB2 LYS 27 1HB LYS 27 1.627 -16.829 -17.981 183 HB3 LYS 27 2HB LYS 27 -0.055 -17.298 -17.772 184 HG2 LYS 27 1HG LYS 27 -0.739 -14.970 -18.102 185 HG3 LYS 27 2HG LYS 27 0.950 -14.515 -18.337 186 HD2 LYS 27 1HD LYS 27 -0.582 -16.481 -20.040 187 HD3 LYS 27 2HD LYS 27 -0.250 -14.801 -20.469 188 HE2 LYS 27 1HE LYS 27 2.239 -15.554 -19.974 189 HE3 LYS 27 2HE LYS 27 1.581 -17.142 -20.363 190 HZ1 LYS 27 3HZ LYS 27 0.961 -16.412 -22.504 191 HZ2 LYS 27 1HZ LYS 27 2.546 -15.867 -22.273 192 HZ3 LYS 27 2HZ LYS 27 1.251 -14.787 -22.132 193 H LYS 28 H LYS 28 1.766 -16.750 -13.865 194 HA LYS 28 HA LYS 28 0.465 -19.386 -13.705 195 HB2 LYS 28 1HB LYS 28 2.968 -19.418 -14.274 196 HB3 LYS 28 2HB LYS 28 3.227 -18.858 -12.627 197 HG2 LYS 28 1HG LYS 28 1.543 -21.270 -13.048 198 HG3 LYS 28 2HG LYS 28 3.292 -21.413 -13.239 199 HD2 LYS 28 1HD LYS 28 3.552 -20.392 -10.980 200 HD3 LYS 28 2HD LYS 28 1.797 -20.454 -10.800 201 HE2 LYS 28 1HE LYS 28 2.324 -22.428 -9.800 202 HE3 LYS 28 2HE LYS 28 2.207 -22.992 -11.467 203 HZ1 LYS 28 3HZ LYS 28 4.451 -23.231 -11.643 204 HZ2 LYS 28 1HZ LYS 28 4.278 -23.550 -9.991 205 HZ3 LYS 28 2HZ LYS 28 4.801 -22.027 -10.507 206 H PHE 29 H PHE 29 1.921 -16.683 -11.960 207 HA PHE 29 HA PHE 29 0.811 -17.591 -9.435 208 HB2 PHE 29 1HB PHE 29 2.162 -16.024 -8.406 209 HB3 PHE 29 2HB PHE 29 3.094 -16.357 -9.862 210 HD1 PHE 29 HD2 PHE 29 2.452 -14.803 -11.919 211 HD2 PHE 29 HD1 PHE 29 1.831 -13.835 -7.821 212 HE1 PHE 29 HE2 PHE 29 2.407 -12.411 -12.495 213 HE2 PHE 29 HE1 PHE 29 1.784 -11.442 -8.390 214 HZ PHE 29 HZ PHE 29 2.073 -10.727 -10.729 215 H PHE 30 H PHE 30 -0.041 -15.524 -12.029 216 HA PHE 30 HA PHE 30 -1.580 -13.562 -10.855 217 HB2 PHE 30 1HB PHE 30 -2.665 -13.302 -12.939 218 HB3 PHE 30 2HB PHE 30 -1.062 -13.914 -13.332 219 HD1 PHE 30 HD1 PHE 30 -0.993 -16.619 -13.321 220 HD2 PHE 30 HD2 PHE 30 -4.400 -14.198 -14.124 221 HE1 PHE 30 HE1 PHE 30 -2.007 -18.472 -14.582 222 HE2 PHE 30 HE2 PHE 30 -5.421 -16.047 -15.386 223 HZ PHE 30 HZ PHE 30 -4.225 -18.188 -15.616 224 H GLN 31 H GLN 31 -2.274 -16.957 -11.240 225 HA GLN 31 HA GLN 31 -5.046 -16.640 -10.435 226 HB2 GLN 31 1HB GLN 31 -5.330 -18.911 -10.942 227 HB3 GLN 31 2HB GLN 31 -4.173 -18.348 -12.141 228 HG2 GLN 31 1HG GLN 31 -2.414 -19.178 -10.394 229 HG3 GLN 31 2HG GLN 31 -3.763 -20.150 -9.808 230 HE21 GLN 31 2HE2 GLN 31 -1.136 -20.386 -11.582 231 HE22 GLN 31 1HE2 GLN 31 -1.634 -21.529 -12.779 232 H ILE 32 H ILE 32 -1.976 -17.544 -9.060 233 HA ILE 32 HA ILE 32 -3.053 -18.712 -6.677 234 HB ILE 32 HB ILE 32 -0.274 -17.662 -7.224 235 HG12 ILE 32 1HG1 ILE 32 -1.001 -20.561 -7.100 236 HG13 ILE 32 2HG1 ILE 32 -1.344 -19.660 -8.573 237 HG21 ILE 32 1HG2 ILE 32 -0.360 -17.755 -4.920 238 HG22 ILE 32 2HG2 ILE 32 -1.484 -19.112 -4.912 239 HG23 ILE 32 3HG2 ILE 32 0.211 -19.374 -5.324 240 HD11 ILE 32 3HD1 ILE 32 1.368 -19.326 -7.499 241 HD12 ILE 32 1HD1 ILE 32 0.969 -20.943 -8.079 242 HD13 ILE 32 2HD1 ILE 32 0.818 -19.556 -9.158 243 H SER 33 H SER 33 -1.126 -15.741 -7.132 244 HA SER 33 HA SER 33 -1.658 -14.653 -4.618 245 HB2 SER 33 1HB SER 33 -0.992 -13.247 -7.215 246 HB3 SER 33 2HB SER 33 -0.949 -12.486 -5.625 247 HG SER 33 HG SER 33 0.584 -14.743 -6.412 248 H GLY 34 H GLY 34 -3.327 -14.184 -7.713 249 HA2 GLY 34 1HA GLY 34 -5.769 -14.014 -7.633 250 HA3 GLY 34 2HA GLY 34 -5.579 -13.021 -6.195 251 H MET 35 H MET 35 -3.908 -12.893 -9.329 252 HA MET 35 HA MET 35 -4.532 -10.042 -9.471 253 HB2 MET 35 1HB MET 35 -2.541 -11.812 -10.862 254 HB3 MET 35 2HB MET 35 -2.914 -10.210 -11.484 255 HG2 MET 35 1HG MET 35 -2.433 -9.624 -8.899 256 HG3 MET 35 2HG MET 35 -1.371 -11.013 -9.117 257 HE1 MET 35 3HE MET 35 -0.847 -9.799 -12.726 258 HE2 MET 35 1HE MET 35 0.776 -10.066 -12.087 259 HE3 MET 35 2HE MET 35 -0.526 -11.183 -11.679 260 H SER 36 H SER 36 -5.339 -13.057 -10.957 261 HA SER 36 HA SER 36 -6.191 -12.286 -13.474 262 HB2 SER 36 1HB SER 36 -6.142 -14.635 -12.305 263 HB3 SER 36 2HB SER 36 -7.814 -14.253 -11.896 264 HG SER 36 HG SER 36 -8.370 -14.523 -13.914 265 H LYS 37 H LYS 37 -7.753 -11.875 -10.367 266 HA LYS 37 HA LYS 37 -10.315 -11.158 -11.328 267 HB2 LYS 37 1HB LYS 37 -10.522 -10.059 -9.035 268 HB3 LYS 37 2HB LYS 37 -10.196 -11.787 -9.060 269 HG2 LYS 37 1HG LYS 37 -8.148 -11.554 -8.142 270 HG3 LYS 37 2HG LYS 37 -7.837 -10.019 -8.957 271 HD2 LYS 37 1HD LYS 37 -8.042 -9.344 -6.761 272 HD3 LYS 37 2HD LYS 37 -9.690 -9.120 -7.352 273 HE2 LYS 37 1HE LYS 37 -10.359 -11.236 -6.393 274 HE3 LYS 37 2HE LYS 37 -8.700 -11.571 -5.899 275 HZ1 LYS 37 3HZ LYS 37 -8.934 -9.379 -4.601 276 HZ2 LYS 37 1HZ LYS 37 -9.669 -10.771 -3.980 277 HZ3 LYS 37 2HZ LYS 37 -10.599 -9.612 -4.787 278 H LYS 38 H LYS 38 -7.334 -9.413 -10.964 279 HA LYS 38 HA LYS 38 -8.182 -6.788 -10.851 280 HB2 LYS 38 1HB LYS 38 -5.840 -7.896 -12.409 281 HB3 LYS 38 2HB LYS 38 -6.058 -6.209 -11.964 282 HG2 LYS 38 1HG LYS 38 -5.632 -8.533 -10.101 283 HG3 LYS 38 2HG LYS 38 -4.503 -7.223 -10.452 284 HD2 LYS 38 1HD LYS 38 -5.356 -6.197 -8.661 285 HD3 LYS 38 2HD LYS 38 -6.791 -5.903 -9.646 286 HE2 LYS 38 1HE LYS 38 -8.016 -7.431 -8.537 287 HE3 LYS 38 2HE LYS 38 -6.670 -8.560 -8.402 288 HZ1 LYS 38 3HZ LYS 38 -7.671 -6.752 -6.471 289 HZ2 LYS 38 1HZ LYS 38 -6.044 -6.409 -6.783 290 HZ3 LYS 38 2HZ LYS 38 -6.502 -7.961 -6.291 291 H SER 39 H SER 39 -7.867 -5.186 -12.751 292 HA SER 39 HA SER 39 -8.844 -6.208 -15.294 293 HB2 SER 39 1HB SER 39 -10.622 -4.292 -15.215 294 HB3 SER 39 2HB SER 39 -10.969 -5.827 -14.418 295 HG SER 39 HG SER 39 -10.361 -3.333 -13.308 296 H SER 40 H SER 40 -6.363 -5.208 -14.819 297 HA SER 40 HA SER 40 -4.840 -3.668 -15.516 298 HB2 SER 40 1HB SER 40 -5.129 -2.907 -17.662 299 HB3 SER 40 2HB SER 40 -6.433 -4.093 -17.620 300 HG SER 40 HG SER 40 -6.570 -1.411 -17.903 301 H SER 41 H SER 41 -6.913 -2.975 -13.423 302 HA SER 41 HA SER 41 -6.571 -0.049 -13.535 303 HB2 SER 41 1HB SER 41 -8.932 -0.619 -13.748 304 HB3 SER 41 2HB SER 41 -8.845 -1.622 -12.300 305 HG SER 41 HG SER 41 -9.692 0.470 -11.874 306 H GLN 42 H GLN 42 -5.667 -2.849 -11.997 307 HA GLN 42 HA GLN 42 -4.821 -1.345 -9.618 308 HB2 GLN 42 1HB GLN 42 -5.829 -4.195 -9.624 309 HB3 GLN 42 2HB GLN 42 -5.208 -3.327 -8.227 310 HG2 GLN 42 1HG GLN 42 -7.298 -2.741 -7.795 311 HG3 GLN 42 2HG GLN 42 -7.206 -1.682 -9.201 312 HE21 GLN 42 2HE2 GLN 42 -7.116 -3.648 -11.193 313 HE22 GLN 42 1HE2 GLN 42 -8.654 -4.431 -11.254 314 H LEU 43 H LEU 43 -3.890 -2.998 -12.291 315 HA LEU 43 HA LEU 43 -1.749 -4.581 -11.284 316 HB2 LEU 43 1HB LEU 43 -2.084 -3.405 -14.039 317 HB3 LEU 43 2HB LEU 43 -1.025 -4.740 -13.589 318 HG LEU 43 HG LEU 43 -3.952 -4.709 -14.071 319 HD11 LEU 43 1HD1 LEU 43 -1.594 -6.036 -15.046 320 HD12 LEU 43 2HD1 LEU 43 -3.217 -5.979 -15.734 321 HD13 LEU 43 3HD1 LEU 43 -2.808 -7.212 -14.542 322 HD21 LEU 43 3HD2 LEU 43 -4.189 -5.475 -11.908 323 HD22 LEU 43 1HD2 LEU 43 -2.605 -6.252 -11.896 324 HD23 LEU 43 2HD2 LEU 43 -3.938 -6.980 -12.794 325 H LYS 44 H LYS 44 -1.695 -1.524 -13.128 326 HA LYS 44 HA LYS 44 1.042 -1.017 -12.510 327 HB2 LYS 44 1HB LYS 44 0.876 0.722 -13.965 328 HB3 LYS 44 2HB LYS 44 -0.584 -0.131 -14.449 329 HG2 LYS 44 1HG LYS 44 -0.479 2.143 -12.478 330 HG3 LYS 44 2HG LYS 44 -0.944 2.280 -14.175 331 HD2 LYS 44 1HD LYS 44 -2.360 0.292 -12.469 332 HD3 LYS 44 2HD LYS 44 -2.751 2.002 -12.270 333 HE2 LYS 44 1HE LYS 44 -4.269 1.370 -13.881 334 HE3 LYS 44 2HE LYS 44 -2.939 1.967 -14.872 335 HZ1 LYS 44 3HZ LYS 44 -3.980 -0.260 -15.488 336 HZ2 LYS 44 1HZ LYS 44 -3.149 -0.890 -14.156 337 HZ3 LYS 44 2HZ LYS 44 -2.291 -0.180 -15.429 338 H GLU 45 H GLU 45 -1.766 -0.714 -10.713 339 HA GLU 45 HA GLU 45 -1.538 1.656 -9.324 340 HB2 GLU 45 1HB GLU 45 -2.867 -0.869 -8.950 341 HB3 GLU 45 2HB GLU 45 -2.242 -0.293 -7.411 342 HG2 GLU 45 1HG GLU 45 -4.118 1.148 -9.267 343 HG3 GLU 45 2HG GLU 45 -4.482 0.488 -7.674 344 H ILE 46 H ILE 46 0.121 -1.413 -8.703 345 HA ILE 46 HA ILE 46 1.590 -0.305 -6.472 346 HB ILE 46 HB ILE 46 2.108 -2.941 -7.838 347 HG12 ILE 46 1HG1 ILE 46 0.657 -3.613 -5.655 348 HG13 ILE 46 2HG1 ILE 46 -0.109 -2.084 -6.072 349 HG21 ILE 46 1HG2 ILE 46 2.454 -2.903 -4.993 350 HG22 ILE 46 2HG2 ILE 46 3.633 -3.251 -6.256 351 HG23 ILE 46 3HG2 ILE 46 3.372 -1.589 -5.728 352 HD11 ILE 46 3HD1 ILE 46 -0.520 -4.633 -7.214 353 HD12 ILE 46 1HD1 ILE 46 -1.289 -3.103 -7.632 354 HD13 ILE 46 2HD1 ILE 46 0.193 -3.597 -8.450 355 H PHE 47 H PHE 47 1.996 -0.622 -9.869 356 HA PHE 47 HA PHE 47 3.819 -0.396 -11.258 357 HB2 PHE 47 1HB PHE 47 4.994 1.792 -10.842 358 HB3 PHE 47 2HB PHE 47 3.238 1.899 -10.905 359 HD1 PHE 47 HD2 PHE 47 1.947 2.368 -8.908 360 HD2 PHE 47 HD1 PHE 47 6.196 2.156 -8.787 361 HE1 PHE 47 HE2 PHE 47 1.935 3.462 -6.704 362 HE2 PHE 47 HE1 PHE 47 6.192 3.250 -6.583 363 HZ PHE 47 HZ PHE 47 4.059 3.905 -5.539 364 H ARG 48 H ARG 48 4.375 -2.311 -9.297 365 HA ARG 48 HA ARG 48 7.277 -1.987 -9.084 366 HB2 ARG 48 1HB ARG 48 5.366 -2.377 -6.842 367 HB3 ARG 48 2HB ARG 48 6.868 -3.290 -6.782 368 HG2 ARG 48 1HG ARG 48 8.004 -1.016 -7.219 369 HG3 ARG 48 2HG ARG 48 6.457 -0.330 -6.715 370 HD2 ARG 48 1HD ARG 48 7.875 -2.382 -5.049 371 HD3 ARG 48 2HD ARG 48 8.283 -0.670 -4.936 372 HE ARG 48 HE ARG 48 5.481 -1.108 -4.673 373 HH11 ARG 48 1HH1 ARG 48 8.508 -1.272 -2.960 374 HH12 ARG 48 2HH1 ARG 48 7.787 -1.044 -1.401 375 HH21 ARG 48 1HH2 ARG 48 4.521 -0.807 -2.626 376 HH22 ARG 48 2HH2 ARG 48 5.519 -0.781 -1.212 377 H ILE 49 H ILE 49 4.990 -3.641 -10.474 378 HA ILE 49 HA ILE 49 6.364 -6.229 -10.163 379 HB ILE 49 HB ILE 49 4.254 -7.381 -10.608 380 HG12 ILE 49 1HG1 ILE 49 3.322 -5.265 -11.820 381 HG13 ILE 49 2HG1 ILE 49 2.214 -6.321 -10.951 382 HG21 ILE 49 1HG2 ILE 49 4.242 -5.458 -8.292 383 HG22 ILE 49 2HG2 ILE 49 3.093 -6.785 -8.461 384 HG23 ILE 49 3HG2 ILE 49 4.817 -7.125 -8.313 385 HD11 ILE 49 3HD1 ILE 49 1.746 -4.765 -9.392 386 HD12 ILE 49 1HD1 ILE 49 3.376 -4.094 -9.410 387 HD13 ILE 49 2HD1 ILE 49 2.233 -3.667 -10.683 388 H LEU 50 H LEU 50 5.751 -3.709 -12.189 389 HA LEU 50 HA LEU 50 5.915 -5.413 -14.588 390 HB2 LEU 50 1HB LEU 50 5.079 -2.554 -14.723 391 HB3 LEU 50 2HB LEU 50 4.682 -3.890 -15.801 392 HG LEU 50 HG LEU 50 3.579 -3.697 -13.010 393 HD11 LEU 50 1HD1 LEU 50 2.909 -1.674 -14.125 394 HD12 LEU 50 2HD1 LEU 50 1.534 -2.776 -14.054 395 HD13 LEU 50 3HD1 LEU 50 2.429 -2.579 -15.561 396 HD21 LEU 50 3HD2 LEU 50 1.842 -5.162 -13.961 397 HD22 LEU 50 1HD2 LEU 50 3.450 -5.883 -14.039 398 HD23 LEU 50 2HD2 LEU 50 2.724 -5.188 -15.489 399 H ASP 51 H ASP 51 6.699 -2.039 -13.731 400 HA ASP 51 HA ASP 51 9.461 -2.496 -14.570 401 HB2 ASP 51 1HB ASP 51 9.207 -0.148 -15.755 402 HB3 ASP 51 2HB ASP 51 8.800 -1.638 -16.602 403 H ASN 52 H ASN 52 10.767 -1.732 -13.055 404 HA ASN 52 HA ASN 52 9.765 0.084 -11.041 405 HB2 ASN 52 1HB ASN 52 11.620 -0.507 -9.764 406 HB3 ASN 52 2HB ASN 52 11.335 -1.967 -10.705 407 HD21 ASN 52 2HD2 ASN 52 13.637 0.127 -9.674 408 HD22 ASN 52 1HD2 ASN 52 14.860 -0.178 -10.856 409 H ASP 53 H ASP 53 10.879 0.584 -14.038 410 HA ASP 53 HA ASP 53 12.417 2.991 -13.339 411 HB2 ASP 53 1HB ASP 53 13.077 2.949 -15.779 412 HB3 ASP 53 2HB ASP 53 13.669 1.598 -14.816 413 H GLN 54 H GLN 54 9.537 1.831 -14.909 414 HA GLN 54 HA GLN 54 7.767 2.878 -15.890 415 HB2 GLN 54 1HB GLN 54 8.640 4.955 -13.884 416 HB3 GLN 54 2HB GLN 54 7.170 5.108 -14.837 417 HG2 GLN 54 1HG GLN 54 7.818 2.961 -12.833 418 HG3 GLN 54 2HG GLN 54 6.617 4.242 -12.678 419 HE21 GLN 54 2HE2 GLN 54 6.113 1.473 -12.415 420 HE22 GLN 54 1HE2 GLN 54 5.027 1.011 -13.677 421 H SER 55 H SER 55 10.079 3.024 -17.412 422 HA SER 55 HA SER 55 10.270 5.765 -18.392 423 HB2 SER 55 1HB SER 55 12.296 4.249 -18.046 424 HB3 SER 55 2HB SER 55 11.748 3.363 -19.468 425 HG SER 55 HG SER 55 13.014 5.772 -19.297 426 H GLY 56 H GLY 56 9.834 2.547 -19.885 427 HA2 GLY 56 1HA GLY 56 7.522 3.244 -21.330 428 HA3 GLY 56 2HA GLY 56 8.923 3.500 -22.360 429 H PHE 57 H PHE 57 10.545 1.398 -21.574 430 HA PHE 57 HA PHE 57 8.931 -0.948 -22.330 431 HB2 PHE 57 1HB PHE 57 10.721 -1.749 -23.697 432 HB3 PHE 57 2HB PHE 57 10.454 -0.065 -24.137 433 HD1 PHE 57 HD1 PHE 57 11.959 1.676 -22.932 434 HD2 PHE 57 HD2 PHE 57 12.855 -2.475 -23.215 435 HE1 PHE 57 HE1 PHE 57 14.334 2.164 -22.514 436 HE2 PHE 57 HE2 PHE 57 15.231 -1.994 -22.797 437 HZ PHE 57 HZ PHE 57 15.974 0.327 -22.446 438 H ILE 58 H ILE 58 10.570 -2.987 -22.001 439 HA ILE 58 HA ILE 58 11.841 -2.764 -19.375 440 HB ILE 58 HB ILE 58 9.887 -4.980 -19.973 441 HG12 ILE 58 1HG1 ILE 58 9.443 -2.537 -18.244 442 HG13 ILE 58 2HG1 ILE 58 8.739 -2.776 -19.840 443 HG21 ILE 58 1HG2 ILE 58 11.726 -4.321 -17.776 444 HG22 ILE 58 2HG2 ILE 58 10.110 -4.826 -17.283 445 HG23 ILE 58 3HG2 ILE 58 11.092 -5.881 -18.300 446 HD11 ILE 58 3HD1 ILE 58 8.069 -5.064 -18.410 447 HD12 ILE 58 1HD1 ILE 58 7.850 -3.729 -17.279 448 HD13 ILE 58 2HD1 ILE 58 7.012 -3.717 -18.831 449 H GLU 59 H GLU 59 13.311 -4.477 -18.889 450 HA GLU 59 HA GLU 59 13.982 -6.263 -21.113 451 HB2 GLU 59 1HB GLU 59 15.377 -4.079 -21.061 452 HB3 GLU 59 2HB GLU 59 16.159 -4.791 -19.657 453 HG2 GLU 59 1HG GLU 59 17.106 -6.508 -20.892 454 HG3 GLU 59 2HG GLU 59 15.966 -6.312 -22.222 455 H GLU 60 H GLU 60 15.596 -7.942 -20.440 456 HA GLU 60 HA GLU 60 14.692 -9.328 -18.190 457 HB2 GLU 60 1HB GLU 60 16.790 -10.714 -18.515 458 HB3 GLU 60 2HB GLU 60 15.727 -10.583 -19.909 459 HG2 GLU 60 1HG GLU 60 17.188 -9.232 -21.069 460 HG3 GLU 60 2HG GLU 60 18.006 -8.684 -19.607 461 H ASP 61 H ASP 61 16.994 -6.799 -18.476 462 HA ASP 61 HA ASP 61 18.426 -7.386 -16.054 463 HB2 ASP 61 1HB ASP 61 19.432 -6.125 -17.952 464 HB3 ASP 61 2HB ASP 61 18.321 -4.799 -17.619 465 H GLU 62 H GLU 62 15.359 -6.322 -16.615 466 HA GLU 62 HA GLU 62 15.281 -4.874 -14.050 467 HB2 GLU 62 1HB GLU 62 14.055 -4.221 -16.675 468 HB3 GLU 62 2HB GLU 62 13.084 -3.910 -15.244 469 HG2 GLU 62 1HG GLU 62 14.412 -2.221 -14.533 470 HG3 GLU 62 2HG GLU 62 15.875 -2.939 -15.205 471 H LEU 63 H LEU 63 14.853 -7.754 -14.861 472 HA LEU 63 HA LEU 63 12.070 -8.060 -13.956 473 HB2 LEU 63 1HB LEU 63 13.825 -10.104 -15.304 474 HB3 LEU 63 2HB LEU 63 12.112 -10.270 -14.924 475 HG LEU 63 HG LEU 63 13.336 -8.423 -16.972 476 HD11 LEU 63 1HD1 LEU 63 11.300 -10.370 -17.759 477 HD12 LEU 63 2HD1 LEU 63 12.806 -11.088 -17.190 478 HD13 LEU 63 3HD1 LEU 63 12.827 -9.944 -18.532 479 HD21 LEU 63 3HD2 LEU 63 11.498 -7.188 -16.855 480 HD22 LEU 63 1HD2 LEU 63 10.888 -8.192 -15.540 481 HD23 LEU 63 2HD2 LEU 63 10.521 -8.613 -17.213 482 H LYS 64 H LYS 64 15.395 -9.022 -13.368 483 HA LYS 64 HA LYS 64 14.945 -10.954 -11.389 484 HB2 LYS 64 1HB LYS 64 17.283 -9.049 -11.610 485 HB3 LYS 64 2HB LYS 64 17.260 -10.564 -10.717 486 HG2 LYS 64 1HG LYS 64 17.138 -11.840 -12.709 487 HG3 LYS 64 2HG LYS 64 16.815 -10.405 -13.686 488 HD2 LYS 64 1HD LYS 64 19.065 -9.548 -13.071 489 HD3 LYS 64 2HD LYS 64 19.376 -11.072 -12.236 490 HE2 LYS 64 1HE LYS 64 19.188 -12.301 -14.287 491 HE3 LYS 64 2HE LYS 64 18.653 -10.862 -15.155 492 HZ1 LYS 64 3HZ LYS 64 20.743 -10.062 -15.302 493 HZ2 LYS 64 1HZ LYS 64 21.160 -11.696 -15.162 494 HZ3 LYS 64 2HZ LYS 64 21.227 -10.686 -13.806 495 H TYR 65 H TYR 65 15.569 -10.677 -9.050 496 HA TYR 65 HA TYR 65 15.199 -9.779 -6.993 497 HB2 TYR 65 1HB TYR 65 15.126 -7.071 -8.324 498 HB3 TYR 65 2HB TYR 65 15.541 -7.442 -6.654 499 HD1 TYR 65 HD1 TYR 65 17.720 -8.441 -6.109 500 HD2 TYR 65 HD2 TYR 65 16.739 -7.307 -10.090 501 HE1 TYR 65 HE1 TYR 65 20.098 -8.565 -6.723 502 HE2 TYR 65 HE2 TYR 65 19.115 -7.429 -10.717 503 HH TYR 65 HH TYR 65 21.293 -8.967 -9.382 504 H PHE 66 H PHE 66 13.017 -10.175 -9.163 505 HA PHE 66 HA PHE 66 10.897 -8.416 -8.438 506 HB2 PHE 66 1HB PHE 66 10.912 -9.527 -10.608 507 HB3 PHE 66 2HB PHE 66 10.837 -11.103 -9.826 508 HD1 PHE 66 HD2 PHE 66 8.778 -11.770 -8.606 509 HD2 PHE 66 HD1 PHE 66 8.969 -8.240 -10.976 510 HE1 PHE 66 HE2 PHE 66 6.320 -11.681 -8.665 511 HE2 PHE 66 HE1 PHE 66 6.511 -8.144 -11.038 512 HZ PHE 66 HZ PHE 66 5.184 -9.867 -9.882 513 H LEU 67 H LEU 67 11.533 -11.844 -7.702 514 HA LEU 67 HA LEU 67 9.366 -12.292 -6.024 515 HB2 LEU 67 1HB LEU 67 12.107 -13.484 -5.663 516 HB3 LEU 67 2HB LEU 67 10.563 -14.180 -5.174 517 HG LEU 67 HG LEU 67 11.529 -13.803 -8.009 518 HD11 LEU 67 1HD1 LEU 67 11.793 -15.948 -6.066 519 HD12 LEU 67 2HD1 LEU 67 12.611 -15.709 -7.609 520 HD13 LEU 67 3HD1 LEU 67 11.022 -16.472 -7.563 521 HD21 LEU 67 3HD2 LEU 67 9.290 -13.680 -8.351 522 HD22 LEU 67 1HD2 LEU 67 8.900 -14.501 -6.840 523 HD23 LEU 67 2HD2 LEU 67 9.433 -15.435 -8.238 524 H GLN 68 H GLN 68 12.279 -10.520 -5.458 525 HA GLN 68 HA GLN 68 12.205 -10.598 -2.609 526 HB2 GLN 68 1HB GLN 68 14.099 -9.878 -4.370 527 HB3 GLN 68 2HB GLN 68 13.462 -8.286 -3.980 528 HG2 GLN 68 1HG GLN 68 13.868 -8.722 -1.601 529 HG3 GLN 68 2HG GLN 68 14.546 -10.294 -2.018 530 HE21 GLN 68 2HE2 GLN 68 16.001 -9.633 -4.265 531 HE22 GLN 68 1HE2 GLN 68 17.302 -8.590 -3.814 532 H ARG 69 H ARG 69 10.570 -8.758 -5.025 533 HA ARG 69 HA ARG 69 9.948 -6.435 -3.596 534 HB2 ARG 69 1HB ARG 69 8.412 -7.896 -5.747 535 HB3 ARG 69 2HB ARG 69 7.955 -6.314 -5.130 536 HG2 ARG 69 1HG ARG 69 10.731 -6.674 -6.117 537 HG3 ARG 69 2HG ARG 69 9.424 -6.594 -7.301 538 HD2 ARG 69 1HD ARG 69 10.130 -4.376 -7.061 539 HD3 ARG 69 2HD ARG 69 8.678 -4.485 -6.068 540 HE ARG 69 HE ARG 69 9.957 -4.081 -4.213 541 HH11 ARG 69 1HH1 ARG 69 12.034 -4.953 -6.867 542 HH12 ARG 69 2HH1 ARG 69 13.496 -4.573 -6.018 543 HH21 ARG 69 1HH2 ARG 69 11.874 -3.578 -3.085 544 HH22 ARG 69 2HH2 ARG 69 13.404 -3.792 -3.866 545 H PHE 70 H PHE 70 8.212 -9.524 -3.825 546 HA PHE 70 HA PHE 70 6.345 -8.634 -1.759 547 HB2 PHE 70 1HB PHE 70 6.380 -11.111 -3.494 548 HB3 PHE 70 2HB PHE 70 5.155 -10.769 -2.277 549 HD1 PHE 70 HD1 PHE 70 3.842 -8.573 -2.533 550 HD2 PHE 70 HD2 PHE 70 6.113 -10.351 -5.664 551 HE1 PHE 70 HE1 PHE 70 2.549 -7.296 -4.192 552 HE2 PHE 70 HE2 PHE 70 4.825 -9.076 -7.327 553 HZ PHE 70 HZ PHE 70 3.041 -7.545 -6.593 554 H GLU 71 H GLU 71 8.856 -11.028 -2.345 555 HA GLU 71 HA GLU 71 8.503 -12.206 0.287 556 HB2 GLU 71 1HB GLU 71 9.239 -13.342 -2.007 557 HB3 GLU 71 2HB GLU 71 10.837 -12.885 -1.433 558 HG2 GLU 71 1HG GLU 71 10.482 -14.139 0.616 559 HG3 GLU 71 2HG GLU 71 8.856 -14.566 0.087 560 H SER 72 H SER 72 9.739 -11.820 2.035 561 HA SER 72 HA SER 72 11.680 -9.649 1.845 562 HB2 SER 72 1HB SER 72 10.058 -10.853 4.039 563 HB3 SER 72 2HB SER 72 11.586 -10.085 4.472 564 HG SER 72 HG SER 72 9.255 -8.960 3.420 565 H GLY 73 H GLY 73 12.071 -12.607 1.089 566 HA2 GLY 73 1HA GLY 73 14.638 -12.880 2.509 567 HA3 GLY 73 2HA GLY 73 13.558 -14.260 2.374 568 H ALA 74 H ALA 74 13.250 -12.425 -0.375 569 HA ALA 74 HA ALA 74 14.669 -14.371 -1.952 570 HB1 ALA 74 1HB ALA 74 13.152 -13.797 -3.462 571 HB2 ALA 74 2HB ALA 74 12.550 -12.543 -2.378 572 HB3 ALA 74 3HB ALA 74 13.823 -12.168 -3.539 573 H ARG 75 H ARG 75 15.992 -13.450 -3.879 574 HA ARG 75 HA ARG 75 17.690 -11.213 -3.068 575 HB2 ARG 75 1HB ARG 75 19.614 -12.866 -3.972 576 HB3 ARG 75 2HB ARG 75 19.189 -12.716 -2.273 577 HG2 ARG 75 1HG ARG 75 18.196 -14.759 -2.194 578 HG3 ARG 75 2HG ARG 75 17.700 -14.706 -3.887 579 HD2 ARG 75 1HD ARG 75 19.649 -15.588 -4.624 580 HD3 ARG 75 2HD ARG 75 20.606 -14.776 -3.386 581 HE ARG 75 HE ARG 75 20.351 -16.608 -2.018 582 HH11 ARG 75 1HH1 ARG 75 18.199 -16.862 -4.743 583 HH12 ARG 75 2HH1 ARG 75 17.762 -18.506 -4.410 584 HH21 ARG 75 1HH2 ARG 75 19.785 -18.771 -1.570 585 HH22 ARG 75 2HH2 ARG 75 18.664 -19.590 -2.605 586 H VAL 76 H VAL 76 17.967 -13.754 -5.544 587 HA VAL 76 HA VAL 76 17.376 -11.790 -7.627 588 HB VAL 76 HB VAL 76 19.811 -13.529 -7.910 589 HG11 VAL 76 1HG1 VAL 76 19.212 -12.731 -9.994 590 HG12 VAL 76 2HG1 VAL 76 18.630 -11.192 -9.354 591 HG13 VAL 76 3HG1 VAL 76 20.363 -11.510 -9.451 592 HG21 VAL 76 3HG2 VAL 76 20.285 -12.221 -5.966 593 HG22 VAL 76 1HG2 VAL 76 21.148 -11.500 -7.324 594 HG23 VAL 76 2HG2 VAL 76 19.661 -10.759 -6.730 595 H LEU 77 H LEU 77 17.053 -12.789 -9.754 596 HA LEU 77 HA LEU 77 15.947 -15.496 -9.466 597 HB2 LEU 77 1HB LEU 77 15.288 -13.179 -11.243 598 HB3 LEU 77 2HB LEU 77 14.818 -14.815 -11.697 599 HG LEU 77 HG LEU 77 14.028 -14.015 -8.981 600 HD11 LEU 77 1HD1 LEU 77 12.004 -12.909 -10.516 601 HD12 LEU 77 2HD1 LEU 77 13.487 -12.274 -11.228 602 HD13 LEU 77 3HD1 LEU 77 13.162 -12.038 -9.511 603 HD21 LEU 77 3HD2 LEU 77 13.365 -16.126 -10.064 604 HD22 LEU 77 1HD2 LEU 77 12.511 -15.204 -11.301 605 HD23 LEU 77 2HD2 LEU 77 11.977 -15.131 -9.621 606 H THR 78 H THR 78 15.805 -16.458 -11.918 607 HA THR 78 HA THR 78 18.616 -16.642 -12.759 608 HB THR 78 HB THR 78 18.142 -18.816 -13.640 609 HG1 THR 78 HG1 THR 78 16.153 -19.493 -14.073 610 HG21 THR 78 3HG2 THR 78 17.461 -20.026 -11.657 611 HG22 THR 78 1HG2 THR 78 16.713 -18.575 -10.990 612 HG23 THR 78 2HG2 THR 78 18.464 -18.654 -11.189 613 H ALA 79 H ALA 79 18.469 -17.663 -15.227 614 HA ALA 79 HA ALA 79 17.486 -15.408 -16.776 615 HB1 ALA 79 1HB ALA 79 19.768 -16.286 -17.130 616 HB2 ALA 79 2HB ALA 79 19.069 -17.802 -17.700 617 HB3 ALA 79 3HB ALA 79 18.787 -16.309 -18.596 618 H SER 80 H SER 80 15.936 -17.910 -15.615 619 HA SER 80 HA SER 80 14.488 -18.523 -18.107 620 HB2 SER 80 1HB SER 80 13.813 -20.618 -17.117 621 HB3 SER 80 2HB SER 80 15.561 -20.467 -16.940 622 HG SER 80 HG SER 80 13.603 -19.939 -14.953 623 H GLU 81 H GLU 81 14.000 -18.057 -14.610 624 HA GLU 81 HA GLU 81 11.201 -17.814 -14.722 625 HB2 GLU 81 1HB GLU 81 13.282 -16.960 -12.736 626 HB3 GLU 81 2HB GLU 81 11.600 -16.502 -12.512 627 HG2 GLU 81 1HG GLU 81 10.936 -18.827 -12.478 628 HG3 GLU 81 2HG GLU 81 12.596 -19.327 -12.799 629 H THR 82 H THR 82 13.784 -15.500 -15.187 630 HA THR 82 HA THR 82 12.004 -13.223 -15.197 631 HB THR 82 HB THR 82 14.047 -11.964 -15.945 632 HG1 THR 82 HG1 THR 82 15.902 -13.023 -16.271 633 HG21 THR 82 3HG2 THR 82 14.907 -13.492 -13.555 634 HG22 THR 82 1HG2 THR 82 13.332 -12.703 -13.476 635 HG23 THR 82 2HG2 THR 82 14.780 -11.750 -13.801 636 H LYS 83 H LYS 83 13.973 -14.953 -17.604 637 HA LYS 83 HA LYS 83 13.353 -13.478 -19.851 638 HB2 LYS 83 1HB LYS 83 15.015 -15.197 -19.976 639 HB3 LYS 83 2HB LYS 83 13.847 -16.440 -19.545 640 HG2 LYS 83 1HG LYS 83 12.854 -16.415 -21.640 641 HG3 LYS 83 2HG LYS 83 13.492 -14.816 -22.031 642 HD2 LYS 83 1HD LYS 83 14.872 -16.156 -23.291 643 HD3 LYS 83 2HD LYS 83 15.808 -16.026 -21.800 644 HE2 LYS 83 1HE LYS 83 15.865 -18.302 -22.266 645 HE3 LYS 83 2HE LYS 83 14.557 -18.167 -21.093 646 HZ1 LYS 83 3HZ LYS 83 14.297 -18.445 -24.036 647 HZ2 LYS 83 1HZ LYS 83 12.999 -18.105 -23.005 648 HZ3 LYS 83 2HZ LYS 83 13.836 -19.567 -22.857 649 H THR 84 H THR 84 11.333 -15.598 -18.031 650 HA THR 84 HA THR 84 9.318 -15.679 -20.157 651 HB THR 84 HB THR 84 9.861 -17.795 -18.973 652 HG1 THR 84 HG1 THR 84 7.682 -18.372 -18.709 653 HG21 THR 84 3HG2 THR 84 10.276 -16.767 -16.748 654 HG22 THR 84 1HG2 THR 84 9.168 -18.137 -16.686 655 HG23 THR 84 2HG2 THR 84 8.542 -16.491 -16.591 656 H PHE 85 H PHE 85 9.913 -13.203 -18.784 657 HA PHE 85 HA PHE 85 7.359 -12.767 -17.382 658 HB2 PHE 85 1HB PHE 85 9.831 -12.363 -16.326 659 HB3 PHE 85 2HB PHE 85 9.501 -10.772 -17.004 660 HD1 PHE 85 HD2 PHE 85 7.930 -13.386 -14.867 661 HD2 PHE 85 HD1 PHE 85 8.310 -9.242 -15.760 662 HE1 PHE 85 HE2 PHE 85 6.553 -12.840 -12.903 663 HE2 PHE 85 HE1 PHE 85 6.934 -8.689 -13.797 664 HZ PHE 85 HZ PHE 85 6.053 -10.489 -12.366 665 H LEU 86 H LEU 86 9.691 -11.424 -19.665 666 HA LEU 86 HA LEU 86 7.602 -9.570 -20.606 667 HB2 LEU 86 1HB LEU 86 9.403 -8.139 -21.431 668 HB3 LEU 86 2HB LEU 86 9.501 -8.385 -19.689 669 HG LEU 86 HG LEU 86 11.248 -10.187 -20.246 670 HD11 LEU 86 1HD1 LEU 86 10.579 -9.277 -22.875 671 HD12 LEU 86 2HD1 LEU 86 11.657 -10.583 -22.386 672 HD13 LEU 86 3HD1 LEU 86 12.278 -8.940 -22.541 673 HD21 LEU 86 3HD2 LEU 86 13.024 -8.545 -20.263 674 HD22 LEU 86 1HD2 LEU 86 11.727 -8.011 -19.194 675 HD23 LEU 86 2HD2 LEU 86 11.901 -7.294 -20.796 676 H ALA 87 H ALA 87 9.780 -12.113 -21.429 677 HA ALA 87 HA ALA 87 9.515 -11.733 -24.289 678 HB1 ALA 87 1HB ALA 87 11.187 -13.242 -24.523 679 HB2 ALA 87 2HB ALA 87 11.491 -12.800 -22.843 680 HB3 ALA 87 3HB ALA 87 10.593 -14.270 -23.219 681 H ALA 88 H ALA 88 7.424 -12.757 -22.045 682 HA ALA 88 HA ALA 88 6.289 -14.876 -23.748 683 HB1 ALA 88 1HB ALA 88 5.468 -14.432 -20.904 684 HB2 ALA 88 2HB ALA 88 5.372 -15.899 -21.879 685 HB3 ALA 88 3HB ALA 88 6.935 -15.334 -21.288 686 H ALA 89 H ALA 89 5.921 -11.677 -22.809 687 HA ALA 89 HA ALA 89 3.161 -11.356 -22.563 688 HB1 ALA 89 1HB ALA 89 3.950 -9.323 -22.129 689 HB2 ALA 89 2HB ALA 89 5.456 -9.651 -22.989 690 HB3 ALA 89 3HB ALA 89 4.043 -9.072 -23.873 691 H ASP 90 H ASP 90 4.940 -10.333 -25.466 692 HA ASP 90 HA ASP 90 3.098 -11.781 -27.181 693 HB2 ASP 90 1HB ASP 90 2.223 -9.370 -26.535 694 HB3 ASP 90 2HB ASP 90 3.372 -8.864 -27.770 695 H HIS 91 H HIS 91 3.653 -11.118 -29.587 696 HA HIS 91 HA HIS 91 6.585 -11.234 -29.787 697 HB2 HIS 91 1HB HIS 91 4.505 -12.136 -31.791 698 HB3 HIS 91 2HB HIS 91 6.248 -12.341 -31.943 699 HD1 HIS 91 HD1 HIS 91 7.190 -14.458 -31.038 700 HD2 HIS 91 HD2 HIS 91 3.395 -13.666 -29.544 701 HE1 HIS 91 HE1 HIS 91 6.554 -16.493 -29.704 702 H ASP 92 H ASP 92 4.914 -8.791 -29.571 703 HA ASP 92 HA ASP 92 4.571 -7.461 -31.977 704 HB2 ASP 92 1HB ASP 92 3.908 -6.694 -29.638 705 HB3 ASP 92 2HB ASP 92 5.563 -6.116 -29.466 706 H GLY 93 H GLY 93 7.493 -7.924 -30.065 707 HA2 GLY 93 1HA GLY 93 9.141 -7.390 -32.357 708 HA3 GLY 93 2HA GLY 93 9.235 -6.119 -31.147 709 H ASP 94 H ASP 94 9.941 -6.710 -28.989 710 HA ASP 94 HA ASP 94 11.387 -9.249 -28.808 711 HB2 ASP 94 1HB ASP 94 12.847 -7.235 -29.605 712 HB3 ASP 94 2HB ASP 94 12.760 -6.735 -27.918 713 H GLY 95 H GLY 95 8.970 -7.933 -27.573 714 HA2 GLY 95 1HA GLY 95 8.028 -8.420 -25.476 715 HA3 GLY 95 2HA GLY 95 9.646 -8.637 -24.824 716 H LYS 96 H LYS 96 9.072 -5.819 -26.710 717 HA LYS 96 HA LYS 96 9.717 -4.100 -24.537 718 HB2 LYS 96 1HB LYS 96 9.019 -3.759 -27.408 719 HB3 LYS 96 2HB LYS 96 8.820 -2.361 -26.360 720 HG2 LYS 96 1HG LYS 96 10.978 -2.216 -27.319 721 HG3 LYS 96 2HG LYS 96 11.195 -2.684 -25.631 722 HD2 LYS 96 1HD LYS 96 11.541 -4.986 -26.270 723 HD3 LYS 96 2HD LYS 96 11.180 -4.608 -27.956 724 HE2 LYS 96 1HE LYS 96 13.513 -4.686 -27.875 725 HE3 LYS 96 2HE LYS 96 13.139 -2.965 -27.809 726 HZ1 LYS 96 3HZ LYS 96 13.175 -3.778 -25.194 727 HZ2 LYS 96 1HZ LYS 96 14.387 -2.908 -25.991 728 HZ3 LYS 96 2HZ LYS 96 14.481 -4.594 -25.894 729 H ILE 97 H ILE 97 8.109 -4.559 -22.968 730 HA ILE 97 HA ILE 97 5.343 -4.344 -23.397 731 HB ILE 97 HB ILE 97 6.790 -3.752 -20.815 732 HG12 ILE 97 1HG1 ILE 97 7.541 -5.900 -21.672 733 HG13 ILE 97 2HG1 ILE 97 6.456 -6.157 -20.309 734 HG21 ILE 97 1HG2 ILE 97 4.684 -4.596 -19.805 735 HG22 ILE 97 2HG2 ILE 97 4.478 -3.111 -20.732 736 HG23 ILE 97 3HG2 ILE 97 3.980 -4.656 -21.421 737 HD11 ILE 97 3HD1 ILE 97 6.056 -7.732 -22.135 738 HD12 ILE 97 1HD1 ILE 97 4.651 -6.714 -21.819 739 HD13 ILE 97 2HD1 ILE 97 5.686 -6.383 -23.209 740 H GLY 98 H GLY 98 3.872 -2.677 -22.958 741 HA2 GLY 98 1HA GLY 98 4.992 0.002 -22.522 742 HA3 GLY 98 2HA GLY 98 4.017 -0.277 -23.957 743 H ALA 99 H ALA 99 3.714 -1.208 -20.528 744 HA ALA 99 HA ALA 99 1.931 -1.131 -19.106 745 HB1 ALA 99 1HB ALA 99 0.878 1.384 -20.190 746 HB2 ALA 99 2HB ALA 99 1.410 0.982 -18.556 747 HB3 ALA 99 3HB ALA 99 2.596 1.412 -19.789 748 H GLU 100 H GLU 100 1.449 -2.566 -21.505 749 HA GLU 100 HA GLU 100 -1.451 -2.460 -21.522 750 HB2 GLU 100 1HB GLU 100 0.208 -2.065 -24.012 751 HB3 GLU 100 2HB GLU 100 -1.479 -2.556 -24.050 752 HG2 GLU 100 1HG GLU 100 -2.097 -0.493 -22.882 753 HG3 GLU 100 2HG GLU 100 -0.405 0.003 -22.886 754 H GLU 101 H GLU 101 1.369 -3.964 -23.100 755 HA GLU 101 HA GLU 101 0.208 -6.400 -23.747 756 HB2 GLU 101 1HB GLU 101 3.062 -5.796 -22.958 757 HB3 GLU 101 2HB GLU 101 2.533 -7.310 -23.677 758 HG2 GLU 101 1HG GLU 101 3.108 -6.338 -25.602 759 HG3 GLU 101 2HG GLU 101 1.549 -5.528 -25.460 760 H PHE 102 H PHE 102 2.127 -5.625 -20.843 761 HA PHE 102 HA PHE 102 1.816 -8.072 -19.550 762 HB2 PHE 102 1HB PHE 102 3.306 -6.017 -18.962 763 HB3 PHE 102 2HB PHE 102 1.919 -5.498 -18.009 764 HD1 PHE 102 HD1 PHE 102 0.997 -7.176 -16.292 765 HD2 PHE 102 HD2 PHE 102 4.855 -7.480 -18.062 766 HE1 PHE 102 HE1 PHE 102 1.731 -8.618 -14.437 767 HE2 PHE 102 HE2 PHE 102 5.595 -8.922 -16.211 768 HZ PHE 102 HZ PHE 102 4.032 -9.494 -14.396 769 H GLN 103 H GLN 103 -0.046 -5.074 -19.034 770 HA GLN 103 HA GLN 103 -1.873 -6.029 -17.198 771 HB2 GLN 103 1HB GLN 103 -2.083 -3.923 -19.332 772 HB3 GLN 103 2HB GLN 103 -3.444 -4.286 -18.280 773 HG2 GLN 103 1HG GLN 103 -2.202 -2.391 -17.442 774 HG3 GLN 103 2HG GLN 103 -2.080 -3.751 -16.327 775 HE21 GLN 103 2HE2 GLN 103 -0.356 -2.910 -19.309 776 HE22 GLN 103 1HE2 GLN 103 1.225 -2.967 -18.615 777 H GLU 104 H GLU 104 -1.813 -6.433 -20.680 778 HA GLU 104 HA GLU 104 -4.450 -7.579 -20.807 779 HB2 GLU 104 1HB GLU 104 -2.202 -7.331 -22.800 780 HB3 GLU 104 2HB GLU 104 -3.694 -8.186 -23.168 781 HG2 GLU 104 1HG GLU 104 -3.794 -5.380 -22.159 782 HG3 GLU 104 2HG GLU 104 -3.422 -5.703 -23.852 783 H MET 105 H MET 105 -1.180 -8.735 -20.456 784 HA MET 105 HA MET 105 -1.636 -11.439 -21.139 785 HB2 MET 105 1HB MET 105 0.615 -10.718 -21.097 786 HB3 MET 105 2HB MET 105 0.459 -10.061 -19.473 787 HG2 MET 105 1HG MET 105 0.803 -12.054 -18.483 788 HG3 MET 105 2HG MET 105 -0.031 -12.952 -19.750 789 HE1 MET 105 3HE MET 105 3.387 -11.350 -18.598 790 HE2 MET 105 1HE MET 105 4.307 -11.418 -20.101 791 HE3 MET 105 2HE MET 105 2.895 -10.369 -19.980 792 H VAL 106 H VAL 106 -1.546 -9.783 -17.990 793 HA VAL 106 HA VAL 106 -2.076 -11.994 -16.377 794 HB VAL 106 HB VAL 106 -3.083 -9.209 -15.809 795 HG11 VAL 106 1HG1 VAL 106 -1.951 -11.141 -13.824 796 HG12 VAL 106 2HG1 VAL 106 -3.070 -9.800 -13.568 797 HG13 VAL 106 3HG1 VAL 106 -3.628 -11.280 -14.349 798 HG21 VAL 106 3HG2 VAL 106 -0.889 -8.723 -16.321 799 HG22 VAL 106 1HG2 VAL 106 -0.769 -9.095 -14.602 800 HG23 VAL 106 2HG2 VAL 106 -0.304 -10.303 -15.800 801 H GLN 107 H GLN 107 -4.373 -9.601 -17.684 802 HA GLN 107 HA GLN 107 -6.718 -10.632 -16.678 803 HB2 GLN 107 1HB GLN 107 -6.153 -9.264 -19.304 804 HB3 GLN 107 2HB GLN 107 -7.782 -9.677 -18.787 805 HG2 GLN 107 1HG GLN 107 -5.863 -7.759 -17.503 806 HG3 GLN 107 2HG GLN 107 -7.436 -7.414 -18.220 807 HE21 GLN 107 2HE2 GLN 107 -5.740 -8.475 -15.430 808 HE22 GLN 107 1HE2 GLN 107 -7.104 -8.602 -14.377 809 H SER 108 H SER 108 -4.777 -11.797 -19.339 810 HA SER 108 HA SER 108 -6.801 -13.788 -20.041 811 HB2 SER 108 1HB SER 108 -4.172 -13.048 -21.344 812 HB3 SER 108 2HB SER 108 -5.231 -14.336 -21.917 813 HG SER 108 HG SER 108 -6.273 -12.841 -22.939 Start of MODEL 12 1 H1 SER 1 H SER 1 1.946 1.563 -1.100 2 HA SER 1 HA SER 1 4.081 0.115 -0.657 3 HB2 SER 1 1HB SER 1 2.234 -1.055 1.167 4 HB3 SER 1 2HB SER 1 3.357 0.274 1.456 5 HG SER 1 HG SER 1 0.767 0.419 1.464 6 H LEU 2 H LEU 2 3.945 -2.277 0.482 7 HA LEU 2 HA LEU 2 3.773 -4.058 -1.720 8 HB2 LEU 2 1HB LEU 2 5.172 -4.099 0.537 9 HB3 LEU 2 2HB LEU 2 3.822 -5.104 1.058 10 HG LEU 2 HG LEU 2 5.770 -6.401 0.259 11 HD11 LEU 2 1HD1 LEU 2 3.526 -6.826 -1.673 12 HD12 LEU 2 2HD1 LEU 2 3.287 -7.086 0.054 13 HD13 LEU 2 3HD1 LEU 2 4.506 -8.016 -0.817 14 HD21 LEU 2 3HD2 LEU 2 5.110 -5.562 -2.532 15 HD22 LEU 2 1HD2 LEU 2 6.580 -6.303 -1.899 16 HD23 LEU 2 2HD2 LEU 2 6.235 -4.605 -1.567 17 H THR 3 H THR 3 2.225 -5.474 -2.320 18 HA THR 3 HA THR 3 0.092 -6.257 -2.577 19 HB THR 3 HB THR 3 -0.841 -7.407 -0.579 20 HG1 THR 3 HG1 THR 3 1.494 -6.684 0.831 21 HG21 THR 3 3HG2 THR 3 1.767 -7.858 -1.780 22 HG22 THR 3 1HG2 THR 3 0.482 -9.008 -1.413 23 HG23 THR 3 2HG2 THR 3 1.644 -8.556 -0.165 24 H ASP 4 H ASP 4 -0.174 -3.675 -2.741 25 HA ASP 4 HA ASP 4 -1.856 -2.533 -0.711 26 HB2 ASP 4 1HB ASP 4 -0.412 -1.057 -1.957 27 HB3 ASP 4 2HB ASP 4 -1.106 -1.593 -3.485 28 H ILE 5 H ILE 5 -2.382 -3.474 -4.110 29 HA ILE 5 HA ILE 5 -5.240 -3.214 -3.841 30 HB ILE 5 HB ILE 5 -3.712 -2.909 -5.975 31 HG12 ILE 5 1HG1 ILE 5 -5.865 -3.799 -7.295 32 HG13 ILE 5 2HG1 ILE 5 -6.530 -3.813 -5.666 33 HG21 ILE 5 1HG2 ILE 5 -2.947 -5.287 -5.865 34 HG22 ILE 5 2HG2 ILE 5 -4.587 -5.773 -6.289 35 HG23 ILE 5 3HG2 ILE 5 -3.634 -4.809 -7.417 36 HD11 ILE 5 3HD1 ILE 5 -7.108 -1.727 -6.493 37 HD12 ILE 5 1HD1 ILE 5 -5.676 -1.402 -5.517 38 HD13 ILE 5 2HD1 ILE 5 -5.544 -1.495 -7.274 39 H LEU 6 H LEU 6 -2.885 -5.735 -3.559 40 HA LEU 6 HA LEU 6 -5.048 -7.721 -3.310 41 HB2 LEU 6 1HB LEU 6 -2.576 -7.772 -4.760 42 HB3 LEU 6 2HB LEU 6 -2.573 -9.043 -3.540 43 HG LEU 6 HG LEU 6 -4.884 -9.666 -4.539 44 HD11 LEU 6 1HD1 LEU 6 -3.677 -8.137 -6.840 45 HD12 LEU 6 2HD1 LEU 6 -5.113 -7.667 -5.930 46 HD13 LEU 6 3HD1 LEU 6 -5.127 -9.140 -6.900 47 HD21 LEU 6 3HD2 LEU 6 -3.830 -11.368 -5.571 48 HD22 LEU 6 1HD2 LEU 6 -2.392 -10.661 -4.834 49 HD23 LEU 6 2HD2 LEU 6 -2.792 -10.296 -6.513 50 H SER 7 H SER 7 -3.908 -9.724 -1.993 51 HA SER 7 HA SER 7 -3.175 -8.518 0.588 52 HB2 SER 7 1HB SER 7 -5.307 -9.915 0.374 53 HB3 SER 7 2HB SER 7 -4.245 -11.311 0.187 54 HG SER 7 HG SER 7 -4.681 -9.684 2.425 55 HA PRO 8 HA PRO 8 0.830 -10.330 0.309 56 HB2 PRO 8 1HB PRO 8 1.468 -10.323 2.948 57 HB3 PRO 8 2HB PRO 8 1.441 -8.856 1.962 58 HG2 PRO 8 1HG PRO 8 -0.631 -9.910 3.848 59 HG3 PRO 8 2HG PRO 8 -0.052 -8.247 3.637 60 HD2 PRO 8 1HD PRO 8 -2.376 -9.128 2.561 61 HD3 PRO 8 2HD PRO 8 -1.371 -7.889 1.781 62 H SER 9 H SER 9 -1.795 -11.764 1.979 63 HA SER 9 HA SER 9 -0.329 -14.157 2.724 64 HB2 SER 9 1HB SER 9 -2.279 -13.087 4.046 65 HB3 SER 9 2HB SER 9 -3.322 -13.853 2.847 66 HG SER 9 HG SER 9 -2.528 -14.987 4.964 67 H ASP 10 H ASP 10 -1.099 -13.107 -0.135 68 HA ASP 10 HA ASP 10 -2.100 -15.701 -1.114 69 HB2 ASP 10 1HB ASP 10 -2.355 -13.068 -2.568 70 HB3 ASP 10 2HB ASP 10 -3.163 -14.589 -2.938 71 H ILE 11 H ILE 11 -0.021 -12.939 -1.943 72 HA ILE 11 HA ILE 11 1.248 -14.121 -4.149 73 HB ILE 11 HB ILE 11 2.213 -11.982 -2.253 74 HG12 ILE 11 1HG1 ILE 11 1.807 -10.686 -4.526 75 HG13 ILE 11 2HG1 ILE 11 0.722 -12.035 -4.842 76 HG21 ILE 11 1HG2 ILE 11 3.584 -13.353 -4.463 77 HG22 ILE 11 2HG2 ILE 11 3.659 -11.593 -4.504 78 HG23 ILE 11 3HG2 ILE 11 4.245 -12.467 -3.089 79 HD11 ILE 11 3HD1 ILE 11 0.270 -11.028 -2.203 80 HD12 ILE 11 1HD1 ILE 11 0.198 -9.712 -3.375 81 HD13 ILE 11 2HD1 ILE 11 -0.839 -11.126 -3.571 82 H ALA 12 H ALA 12 1.730 -14.501 -0.733 83 HA ALA 12 HA ALA 12 4.359 -15.575 -0.834 84 HB1 ALA 12 1HB ALA 12 4.179 -15.383 1.368 85 HB2 ALA 12 2HB ALA 12 2.494 -14.904 1.167 86 HB3 ALA 12 3HB ALA 12 2.905 -16.602 1.400 87 H ALA 13 H ALA 13 1.141 -16.959 -1.084 88 HA ALA 13 HA ALA 13 1.812 -19.665 -0.774 89 HB1 ALA 13 1HB ALA 13 -0.418 -18.382 -2.345 90 HB2 ALA 13 2HB ALA 13 -0.297 -20.109 -2.008 91 HB3 ALA 13 3HB ALA 13 -0.482 -18.963 -0.680 92 H ALA 14 H ALA 14 2.334 -17.474 -3.382 93 HA ALA 14 HA ALA 14 2.858 -19.639 -5.277 94 HB1 ALA 14 1HB ALA 14 1.601 -17.406 -5.782 95 HB2 ALA 14 2HB ALA 14 3.232 -16.757 -5.953 96 HB3 ALA 14 3HB ALA 14 2.704 -18.094 -6.974 97 H LEU 15 H LEU 15 4.516 -16.873 -3.784 98 HA LEU 15 HA LEU 15 7.009 -17.161 -4.954 99 HB2 LEU 15 1HB LEU 15 6.214 -16.218 -2.212 100 HB3 LEU 15 2HB LEU 15 7.875 -16.148 -2.797 101 HG LEU 15 HG LEU 15 5.497 -14.669 -3.916 102 HD11 LEU 15 1HD1 LEU 15 6.082 -13.029 -2.548 103 HD12 LEU 15 2HD1 LEU 15 7.716 -13.033 -3.208 104 HD13 LEU 15 3HD1 LEU 15 7.317 -14.070 -1.839 105 HD21 LEU 15 3HD2 LEU 15 6.887 -15.301 -5.758 106 HD22 LEU 15 1HD2 LEU 15 8.346 -14.834 -4.884 107 HD23 LEU 15 2HD2 LEU 15 7.195 -13.601 -5.400 108 H ARG 16 H ARG 16 5.488 -19.073 -2.489 109 HA ARG 16 HA ARG 16 7.978 -20.445 -1.834 110 HB2 ARG 16 1HB ARG 16 6.316 -19.824 -0.060 111 HB3 ARG 16 2HB ARG 16 5.200 -20.979 -0.776 112 HG2 ARG 16 1HG ARG 16 7.877 -22.016 -0.114 113 HG3 ARG 16 2HG ARG 16 6.856 -21.561 1.252 114 HD2 ARG 16 1HD ARG 16 5.291 -23.173 0.795 115 HD3 ARG 16 2HD ARG 16 5.667 -23.201 -0.927 116 HE ARG 16 HE ARG 16 7.843 -24.174 0.617 117 HH11 ARG 16 1HH1 ARG 16 4.705 -25.049 -0.610 118 HH12 ARG 16 2HH1 ARG 16 5.046 -26.748 -0.639 119 HH21 ARG 16 1HH2 ARG 16 8.304 -26.408 0.584 120 HH22 ARG 16 2HH2 ARG 16 7.093 -27.520 0.041 121 H ASP 17 H ASP 17 5.206 -20.801 -3.834 122 HA ASP 17 HA ASP 17 5.723 -23.656 -4.242 123 HB2 ASP 17 1HB ASP 17 3.370 -22.727 -3.871 124 HB3 ASP 17 2HB ASP 17 3.500 -22.046 -5.490 125 H CYS 18 H CYS 18 7.367 -21.306 -5.238 126 HA CYS 18 HA CYS 18 7.650 -22.304 -7.962 127 HB2 CYS 18 1HB CYS 18 7.549 -20.182 -9.013 128 HB3 CYS 18 2HB CYS 18 6.135 -20.261 -7.969 129 HG CYS 18 HG CYS 18 6.710 -17.792 -7.351 130 H GLN 19 H GLN 19 9.115 -22.227 -5.296 131 HA GLN 19 HA GLN 19 11.415 -20.615 -5.591 132 HB2 GLN 19 1HB GLN 19 12.401 -22.081 -3.857 133 HB3 GLN 19 2HB GLN 19 10.798 -21.501 -3.425 134 HG2 GLN 19 1HG GLN 19 9.954 -23.726 -4.377 135 HG3 GLN 19 2HG GLN 19 11.635 -24.246 -4.273 136 HE21 GLN 19 2HE2 GLN 19 9.413 -22.395 -2.210 137 HE22 GLN 19 1HE2 GLN 19 9.715 -23.308 -0.775 138 H ALA 20 H ALA 20 10.426 -23.422 -7.200 139 HA ALA 20 HA ALA 20 13.082 -24.406 -7.788 140 HB1 ALA 20 1HB ALA 20 12.075 -26.255 -8.610 141 HB2 ALA 20 2HB ALA 20 10.712 -25.654 -7.665 142 HB3 ALA 20 3HB ALA 20 10.790 -25.339 -9.398 143 HA PRO 21 HA PRO 21 13.892 -22.140 -11.458 144 HB2 PRO 21 1HB PRO 21 15.133 -24.000 -12.997 145 HB3 PRO 21 2HB PRO 21 15.892 -23.264 -11.582 146 HG2 PRO 21 1HG PRO 21 14.534 -25.920 -11.836 147 HG3 PRO 21 2HG PRO 21 16.044 -25.510 -11.000 148 HD2 PRO 21 1HD PRO 21 13.695 -25.833 -9.692 149 HD3 PRO 21 2HD PRO 21 14.943 -24.694 -9.147 150 H ASP 22 H ASP 22 12.956 -21.624 -13.378 151 HA ASP 22 HA ASP 22 11.412 -21.627 -15.051 152 HB2 ASP 22 1HB ASP 22 13.017 -23.476 -15.782 153 HB3 ASP 22 2HB ASP 22 11.811 -24.613 -15.187 154 H SER 23 H SER 23 10.566 -22.179 -12.245 155 HA SER 23 HA SER 23 8.050 -23.611 -12.787 156 HB2 SER 23 1HB SER 23 9.618 -24.456 -10.948 157 HB3 SER 23 2HB SER 23 9.166 -23.008 -10.048 158 HG SER 23 HG SER 23 7.819 -24.738 -9.489 159 H PHE 24 H PHE 24 9.451 -20.591 -11.938 160 HA PHE 24 HA PHE 24 6.893 -19.486 -11.056 161 HB2 PHE 24 1HB PHE 24 8.880 -18.904 -9.746 162 HB3 PHE 24 2HB PHE 24 9.641 -18.228 -11.183 163 HD1 PHE 24 HD1 PHE 24 6.167 -17.871 -9.899 164 HD2 PHE 24 HD2 PHE 24 9.865 -15.963 -10.793 165 HE1 PHE 24 HE1 PHE 24 5.155 -15.685 -9.399 166 HE2 PHE 24 HE2 PHE 24 8.859 -13.774 -10.294 167 HZ PHE 24 HZ PHE 24 6.502 -13.632 -9.595 168 H SER 25 H SER 25 5.801 -17.874 -12.137 169 HA SER 25 HA SER 25 6.817 -16.598 -14.476 170 HB2 SER 25 1HB SER 25 5.152 -19.047 -14.764 171 HB3 SER 25 2HB SER 25 4.787 -17.696 -15.837 172 HG SER 25 HG SER 25 6.516 -19.391 -16.390 173 HA PRO 26 HA PRO 26 3.611 -13.742 -13.583 174 HB2 PRO 26 1HB PRO 26 2.952 -12.807 -16.046 175 HB3 PRO 26 2HB PRO 26 4.472 -12.401 -15.239 176 HG2 PRO 26 1HG PRO 26 3.939 -14.450 -17.356 177 HG3 PRO 26 2HG PRO 26 5.292 -13.313 -17.215 178 HD2 PRO 26 1HD PRO 26 5.497 -15.916 -16.500 179 HD3 PRO 26 2HD PRO 26 6.402 -14.627 -15.681 180 H LYS 27 H LYS 27 2.864 -16.016 -16.195 181 HA LYS 27 HA LYS 27 0.003 -15.719 -15.708 182 HB2 LYS 27 1HB LYS 27 1.360 -17.532 -17.704 183 HB3 LYS 27 2HB LYS 27 -0.324 -17.024 -17.694 184 HG2 LYS 27 1HG LYS 27 0.511 -14.667 -18.021 185 HG3 LYS 27 2HG LYS 27 2.103 -15.368 -18.319 186 HD2 LYS 27 1HD LYS 27 0.453 -16.863 -19.937 187 HD3 LYS 27 2HD LYS 27 -0.244 -15.245 -20.046 188 HE2 LYS 27 1HE LYS 27 2.591 -15.026 -20.201 189 HE3 LYS 27 2HE LYS 27 2.063 -16.266 -21.338 190 HZ1 LYS 27 3HZ LYS 27 0.603 -13.725 -21.260 191 HZ2 LYS 27 1HZ LYS 27 0.875 -14.772 -22.561 192 HZ3 LYS 27 2HZ LYS 27 2.115 -13.759 -22.017 193 H LYS 28 H LYS 28 1.580 -16.848 -13.613 194 HA LYS 28 HA LYS 28 0.309 -19.490 -13.458 195 HB2 LYS 28 1HB LYS 28 2.742 -19.722 -14.008 196 HB3 LYS 28 2HB LYS 28 3.114 -18.917 -12.489 197 HG2 LYS 28 1HG LYS 28 3.344 -21.184 -12.016 198 HG3 LYS 28 2HG LYS 28 1.751 -20.769 -11.378 199 HD2 LYS 28 1HD LYS 28 0.758 -21.608 -13.506 200 HD3 LYS 28 2HD LYS 28 2.365 -22.157 -13.985 201 HE2 LYS 28 1HE LYS 28 1.341 -24.054 -13.070 202 HE3 LYS 28 2HE LYS 28 2.387 -23.451 -11.784 203 HZ1 LYS 28 3HZ LYS 28 0.647 -23.097 -10.469 204 HZ2 LYS 28 1HZ LYS 28 -0.272 -24.004 -11.563 205 HZ3 LYS 28 2HZ LYS 28 -0.237 -22.317 -11.682 206 H PHE 29 H PHE 29 1.813 -16.795 -11.736 207 HA PHE 29 HA PHE 29 0.636 -17.629 -9.216 208 HB2 PHE 29 1HB PHE 29 2.016 -16.085 -8.190 209 HB3 PHE 29 2HB PHE 29 2.962 -16.473 -9.623 210 HD1 PHE 29 HD2 PHE 29 2.668 -14.927 -11.660 211 HD2 PHE 29 HD1 PHE 29 1.481 -13.887 -7.707 212 HE1 PHE 29 HE2 PHE 29 2.708 -12.546 -12.278 213 HE2 PHE 29 HE1 PHE 29 1.518 -11.504 -8.319 214 HZ PHE 29 HZ PHE 29 2.134 -10.831 -10.607 215 H PHE 30 H PHE 30 -0.128 -15.602 -11.861 216 HA PHE 30 HA PHE 30 -1.614 -13.562 -10.755 217 HB2 PHE 30 1HB PHE 30 -2.690 -13.338 -12.853 218 HB3 PHE 30 2HB PHE 30 -1.095 -13.990 -13.215 219 HD1 PHE 30 HD1 PHE 30 -1.029 -16.660 -13.223 220 HD2 PHE 30 HD2 PHE 30 -4.479 -14.269 -13.932 221 HE1 PHE 30 HE1 PHE 30 -2.069 -18.527 -14.442 222 HE2 PHE 30 HE2 PHE 30 -5.525 -16.133 -15.151 223 HZ PHE 30 HZ PHE 30 -4.320 -18.266 -15.406 224 H GLN 31 H GLN 31 -2.438 -16.940 -11.101 225 HA GLN 31 HA GLN 31 -5.191 -16.510 -10.295 226 HB2 GLN 31 1HB GLN 31 -5.547 -18.793 -10.736 227 HB3 GLN 31 2HB GLN 31 -4.405 -18.275 -11.968 228 HG2 GLN 31 1HG GLN 31 -2.631 -19.114 -10.232 229 HG3 GLN 31 2HG GLN 31 -3.991 -20.058 -9.625 230 HE21 GLN 31 2HE2 GLN 31 -1.387 -20.364 -11.416 231 HE22 GLN 31 1HE2 GLN 31 -1.918 -21.500 -12.604 232 H ILE 32 H ILE 32 -2.167 -17.585 -8.909 233 HA ILE 32 HA ILE 32 -3.258 -18.670 -6.518 234 HB ILE 32 HB ILE 32 -0.482 -17.643 -7.114 235 HG12 ILE 32 1HG1 ILE 32 -1.191 -20.521 -6.737 236 HG13 ILE 32 2HG1 ILE 32 -1.595 -19.750 -8.267 237 HG21 ILE 32 1HG2 ILE 32 -0.372 -17.593 -4.851 238 HG22 ILE 32 2HG2 ILE 32 -1.703 -18.731 -4.650 239 HG23 ILE 32 3HG2 ILE 32 -0.096 -19.321 -5.073 240 HD11 ILE 32 3HD1 ILE 32 1.159 -19.378 -7.262 241 HD12 ILE 32 1HD1 ILE 32 0.715 -20.984 -7.840 242 HD13 ILE 32 2HD1 ILE 32 0.566 -19.589 -8.909 243 H SER 33 H SER 33 -1.392 -15.666 -7.016 244 HA SER 33 HA SER 33 -1.924 -14.569 -4.501 245 HB2 SER 33 1HB SER 33 -1.162 -12.449 -5.442 246 HB3 SER 33 2HB SER 33 -0.139 -13.764 -6.018 247 HG SER 33 HG SER 33 -0.722 -13.297 -7.974 248 H GLY 34 H GLY 34 -3.539 -13.984 -7.621 249 HA2 GLY 34 1HA GLY 34 -6.040 -13.941 -7.431 250 HA3 GLY 34 2HA GLY 34 -5.791 -12.811 -6.108 251 H MET 35 H MET 35 -3.719 -12.632 -8.873 252 HA MET 35 HA MET 35 -4.506 -9.941 -9.396 253 HB2 MET 35 1HB MET 35 -2.619 -11.855 -10.751 254 HB3 MET 35 2HB MET 35 -2.942 -10.257 -11.410 255 HG2 MET 35 1HG MET 35 -2.358 -9.628 -8.851 256 HG3 MET 35 2HG MET 35 -1.353 -11.058 -9.076 257 HE1 MET 35 3HE MET 35 -0.884 -10.110 -12.672 258 HE2 MET 35 1HE MET 35 0.786 -10.203 -12.110 259 HE3 MET 35 2HE MET 35 -0.405 -11.368 -11.532 260 H SER 36 H SER 36 -5.515 -13.011 -10.558 261 HA SER 36 HA SER 36 -6.383 -12.455 -13.129 262 HB2 SER 36 1HB SER 36 -6.437 -14.670 -11.726 263 HB3 SER 36 2HB SER 36 -8.071 -14.147 -11.318 264 HG SER 36 HG SER 36 -7.933 -15.501 -13.210 265 H LYS 37 H LYS 37 -7.816 -11.613 -10.051 266 HA LYS 37 HA LYS 37 -10.372 -10.872 -10.989 267 HB2 LYS 37 1HB LYS 37 -8.793 -9.977 -8.575 268 HB3 LYS 37 2HB LYS 37 -10.463 -9.511 -8.869 269 HG2 LYS 37 1HG LYS 37 -11.037 -11.950 -8.918 270 HG3 LYS 37 2HG LYS 37 -9.389 -12.276 -8.375 271 HD2 LYS 37 1HD LYS 37 -11.275 -10.449 -6.901 272 HD3 LYS 37 2HD LYS 37 -11.149 -12.177 -6.564 273 HE2 LYS 37 1HE LYS 37 -8.889 -11.968 -5.883 274 HE3 LYS 37 2HE LYS 37 -8.775 -10.328 -6.519 275 HZ1 LYS 37 3HZ LYS 37 -9.020 -10.493 -4.057 276 HZ2 LYS 37 1HZ LYS 37 -10.586 -11.088 -4.298 277 HZ3 LYS 37 2HZ LYS 37 -10.186 -9.527 -4.813 278 H LYS 38 H LYS 38 -7.294 -9.278 -11.045 279 HA LYS 38 HA LYS 38 -8.024 -6.612 -11.259 280 HB2 LYS 38 1HB LYS 38 -5.785 -8.057 -12.687 281 HB3 LYS 38 2HB LYS 38 -5.917 -6.311 -12.525 282 HG2 LYS 38 1HG LYS 38 -5.425 -8.343 -10.370 283 HG3 LYS 38 2HG LYS 38 -4.383 -7.014 -10.884 284 HD2 LYS 38 1HD LYS 38 -5.272 -5.995 -9.072 285 HD3 LYS 38 2HD LYS 38 -6.585 -5.632 -10.194 286 HE2 LYS 38 1HE LYS 38 -8.006 -7.109 -9.219 287 HE3 LYS 38 2HE LYS 38 -6.716 -8.230 -8.786 288 HZ1 LYS 38 3HZ LYS 38 -7.944 -6.225 -7.202 289 HZ2 LYS 38 1HZ LYS 38 -6.275 -5.958 -7.289 290 HZ3 LYS 38 2HZ LYS 38 -6.866 -7.442 -6.735 291 H SER 39 H SER 39 -7.514 -5.400 -13.484 292 HA SER 39 HA SER 39 -8.505 -6.647 -15.849 293 HB2 SER 39 1HB SER 39 -10.567 -6.132 -14.302 294 HB3 SER 39 2HB SER 39 -10.329 -4.479 -14.870 295 HG SER 39 HG SER 39 -11.739 -6.107 -16.105 296 H SER 40 H SER 40 -6.182 -5.287 -15.342 297 HA SER 40 HA SER 40 -4.832 -3.648 -16.159 298 HB2 SER 40 1HB SER 40 -5.799 -4.327 -18.318 299 HB3 SER 40 2HB SER 40 -7.130 -3.195 -18.080 300 HG SER 40 HG SER 40 -5.882 -1.751 -18.932 301 H SER 41 H SER 41 -6.835 -3.066 -14.050 302 HA SER 41 HA SER 41 -6.863 -0.136 -14.343 303 HB2 SER 41 1HB SER 41 -9.105 -1.852 -14.052 304 HB3 SER 41 2HB SER 41 -8.921 -0.974 -12.534 305 HG SER 41 HG SER 41 -10.204 0.147 -14.099 306 H GLN 42 H GLN 42 -5.537 -2.650 -12.745 307 HA GLN 42 HA GLN 42 -5.003 -0.998 -10.377 308 HB2 GLN 42 1HB GLN 42 -5.569 -3.968 -10.332 309 HB3 GLN 42 2HB GLN 42 -5.084 -2.998 -8.948 310 HG2 GLN 42 1HG GLN 42 -7.246 -2.752 -8.528 311 HG3 GLN 42 2HG GLN 42 -7.289 -1.663 -9.914 312 HE21 GLN 42 2HE2 GLN 42 -6.891 -3.586 -11.928 313 HE22 GLN 42 1HE2 GLN 42 -8.311 -4.564 -12.025 314 H LEU 43 H LEU 43 -3.938 -3.272 -12.750 315 HA LEU 43 HA LEU 43 -1.541 -4.173 -11.702 316 HB2 LEU 43 1HB LEU 43 -1.841 -3.351 -14.573 317 HB3 LEU 43 2HB LEU 43 -0.873 -4.663 -13.904 318 HG LEU 43 HG LEU 43 -3.856 -4.563 -14.283 319 HD11 LEU 43 1HD1 LEU 43 -2.963 -5.326 -16.255 320 HD12 LEU 43 2HD1 LEU 43 -3.168 -6.838 -15.371 321 HD13 LEU 43 3HD1 LEU 43 -1.579 -6.080 -15.464 322 HD21 LEU 43 3HD2 LEU 43 -4.088 -5.828 -12.470 323 HD22 LEU 43 1HD2 LEU 43 -2.342 -5.940 -12.247 324 HD23 LEU 43 2HD2 LEU 43 -3.169 -7.078 -13.311 325 H LYS 44 H LYS 44 -2.394 -1.018 -12.846 326 HA LYS 44 HA LYS 44 0.396 -0.142 -12.848 327 HB2 LYS 44 1HB LYS 44 -0.430 1.931 -13.810 328 HB3 LYS 44 2HB LYS 44 -1.056 0.559 -14.715 329 HG2 LYS 44 1HG LYS 44 -2.796 1.459 -12.541 330 HG3 LYS 44 2HG LYS 44 -2.540 2.651 -13.817 331 HD2 LYS 44 1HD LYS 44 -2.972 0.418 -15.288 332 HD3 LYS 44 2HD LYS 44 -3.982 0.084 -13.880 333 HE2 LYS 44 1HE LYS 44 -5.514 1.279 -15.019 334 HE3 LYS 44 2HE LYS 44 -4.640 2.658 -14.354 335 HZ1 LYS 44 3HZ LYS 44 -3.621 3.089 -16.347 336 HZ2 LYS 44 1HZ LYS 44 -5.122 2.523 -16.884 337 HZ3 LYS 44 2HZ LYS 44 -3.774 1.502 -16.913 338 H GLU 45 H GLU 45 -2.401 -0.132 -10.870 339 HA GLU 45 HA GLU 45 -2.011 2.194 -9.362 340 HB2 GLU 45 1HB GLU 45 -3.294 -0.455 -8.735 341 HB3 GLU 45 2HB GLU 45 -3.209 0.828 -7.536 342 HG2 GLU 45 1HG GLU 45 -4.318 1.453 -10.223 343 HG3 GLU 45 2HG GLU 45 -5.306 0.545 -9.080 344 H ILE 46 H ILE 46 -0.774 -1.096 -8.881 345 HA ILE 46 HA ILE 46 0.771 -0.278 -6.570 346 HB ILE 46 HB ILE 46 0.960 -2.931 -7.982 347 HG12 ILE 46 1HG1 ILE 46 -0.704 -3.433 -5.906 348 HG13 ILE 46 2HG1 ILE 46 -1.222 -1.805 -6.328 349 HG21 ILE 46 1HG2 ILE 46 1.211 -2.502 -5.043 350 HG22 ILE 46 2HG2 ILE 46 1.955 -3.727 -6.070 351 HG23 ILE 46 3HG2 ILE 46 2.557 -2.070 -6.097 352 HD11 ILE 46 3HD1 ILE 46 -1.713 -4.319 -7.672 353 HD12 ILE 46 1HD1 ILE 46 -2.538 -2.769 -7.830 354 HD13 ILE 46 2HD1 ILE 46 -1.075 -3.089 -8.762 355 H PHE 47 H PHE 47 1.235 -0.749 -9.974 356 HA PHE 47 HA PHE 47 3.127 -0.799 -11.288 357 HB2 PHE 47 1HB PHE 47 4.517 1.274 -10.925 358 HB3 PHE 47 2HB PHE 47 2.787 1.559 -11.089 359 HD1 PHE 47 HD1 PHE 47 1.453 2.259 -9.187 360 HD2 PHE 47 HD2 PHE 47 5.651 1.647 -8.837 361 HE1 PHE 47 HE1 PHE 47 1.449 3.476 -7.048 362 HE2 PHE 47 HE2 PHE 47 5.653 2.862 -6.698 363 HZ PHE 47 HZ PHE 47 3.551 3.778 -5.800 364 H ARG 48 H ARG 48 3.416 -2.681 -9.280 365 HA ARG 48 HA ARG 48 6.317 -2.638 -8.927 366 HB2 ARG 48 1HB ARG 48 4.284 -2.858 -6.738 367 HB3 ARG 48 2HB ARG 48 5.819 -3.702 -6.586 368 HG2 ARG 48 1HG ARG 48 7.043 -1.716 -6.548 369 HG3 ARG 48 2HG ARG 48 5.706 -0.775 -7.212 370 HD2 ARG 48 1HD ARG 48 5.138 -2.135 -4.669 371 HD3 ARG 48 2HD ARG 48 6.366 -0.873 -4.582 372 HE ARG 48 HE ARG 48 3.927 -0.127 -5.945 373 HH11 ARG 48 1HH1 ARG 48 5.671 -0.214 -2.933 374 HH12 ARG 48 2HH1 ARG 48 4.750 1.064 -2.212 375 HH21 ARG 48 1HH2 ARG 48 2.706 1.556 -5.006 376 HH22 ARG 48 2HH2 ARG 48 3.063 2.070 -3.392 377 H ILE 49 H ILE 49 3.986 -4.104 -10.391 378 HA ILE 49 HA ILE 49 5.022 -6.809 -9.854 379 HB ILE 49 HB ILE 49 2.866 -7.774 -10.286 380 HG12 ILE 49 1HG1 ILE 49 2.214 -5.958 -11.953 381 HG13 ILE 49 2HG1 ILE 49 0.929 -6.555 -10.908 382 HG21 ILE 49 1HG2 ILE 49 2.911 -5.553 -8.273 383 HG22 ILE 49 2HG2 ILE 49 1.511 -6.611 -8.440 384 HG23 ILE 49 3HG2 ILE 49 3.082 -7.290 -8.016 385 HD11 ILE 49 3HD1 ILE 49 2.186 -4.344 -9.635 386 HD12 ILE 49 1HD1 ILE 49 1.783 -3.900 -11.293 387 HD13 ILE 49 2HD1 ILE 49 0.527 -4.500 -10.211 388 H LEU 50 H LEU 50 4.778 -4.344 -12.045 389 HA LEU 50 HA LEU 50 4.999 -6.194 -14.328 390 HB2 LEU 50 1HB LEU 50 4.289 -3.312 -14.659 391 HB3 LEU 50 2HB LEU 50 3.948 -4.676 -15.723 392 HG LEU 50 HG LEU 50 2.611 -4.379 -13.048 393 HD11 LEU 50 1HD1 LEU 50 2.148 -2.340 -14.265 394 HD12 LEU 50 2HD1 LEU 50 0.714 -3.366 -14.239 395 HD13 LEU 50 3HD1 LEU 50 1.700 -3.267 -15.698 396 HD21 LEU 50 3HD2 LEU 50 0.972 -5.856 -13.995 397 HD22 LEU 50 1HD2 LEU 50 2.570 -6.570 -14.219 398 HD23 LEU 50 2HD2 LEU 50 1.756 -5.786 -15.574 399 H ASP 51 H ASP 51 5.903 -2.834 -13.529 400 HA ASP 51 HA ASP 51 8.633 -3.447 -14.437 401 HB2 ASP 51 1HB ASP 51 7.142 -2.079 -16.068 402 HB3 ASP 51 2HB ASP 51 7.390 -0.757 -14.930 403 H ASN 52 H ASN 52 10.173 -1.615 -13.748 404 HA ASN 52 HA ASN 52 9.465 -0.749 -11.022 405 HB2 ASN 52 1HB ASN 52 11.078 -2.566 -10.906 406 HB3 ASN 52 2HB ASN 52 12.140 -1.733 -12.037 407 HD21 ASN 52 2HD2 ASN 52 10.342 -0.652 -9.179 408 HD22 ASN 52 1HD2 ASN 52 11.716 -0.022 -8.342 409 H ASP 53 H ASP 53 11.737 -0.114 -13.694 410 HA ASP 53 HA ASP 53 12.409 2.497 -12.853 411 HB2 ASP 53 1HB ASP 53 13.647 0.979 -14.516 412 HB3 ASP 53 2HB ASP 53 12.498 1.564 -15.716 413 H GLN 54 H GLN 54 9.838 1.221 -14.855 414 HA GLN 54 HA GLN 54 8.073 2.199 -15.920 415 HB2 GLN 54 1HB GLN 54 7.977 2.865 -13.299 416 HB3 GLN 54 2HB GLN 54 7.999 4.467 -14.024 417 HG2 GLN 54 1HG GLN 54 5.729 3.779 -13.668 418 HG3 GLN 54 2HG GLN 54 6.057 3.846 -15.399 419 HE21 GLN 54 2HE2 GLN 54 5.031 1.928 -12.793 420 HE22 GLN 54 1HE2 GLN 54 4.855 0.437 -13.648 421 H SER 55 H SER 55 10.607 2.973 -16.928 422 HA SER 55 HA SER 55 10.333 5.824 -17.521 423 HB2 SER 55 1HB SER 55 12.560 5.020 -16.868 424 HB3 SER 55 2HB SER 55 12.551 3.882 -18.216 425 HG SER 55 HG SER 55 13.358 5.457 -19.333 426 H GLY 56 H GLY 56 9.351 2.898 -18.780 427 HA2 GLY 56 1HA GLY 56 8.053 3.814 -20.986 428 HA3 GLY 56 2HA GLY 56 9.679 3.506 -21.578 429 H PHE 57 H PHE 57 10.550 1.295 -21.142 430 HA PHE 57 HA PHE 57 8.391 -0.708 -21.222 431 HB2 PHE 57 1HB PHE 57 10.987 -0.855 -22.764 432 HB3 PHE 57 2HB PHE 57 9.626 -1.967 -22.872 433 HD1 PHE 57 HD2 PHE 57 7.617 -1.363 -24.075 434 HD2 PHE 57 HD1 PHE 57 10.914 1.316 -23.816 435 HE1 PHE 57 HE2 PHE 57 6.661 -0.016 -25.899 436 HE2 PHE 57 HE1 PHE 57 9.963 2.668 -25.639 437 HZ PHE 57 HZ PHE 57 7.835 2.002 -26.684 438 H ILE 58 H ILE 58 9.168 -2.939 -20.690 439 HA ILE 58 HA ILE 58 10.837 -2.799 -18.307 440 HB ILE 58 HB ILE 58 9.427 -5.257 -19.315 441 HG12 ILE 58 1HG1 ILE 58 8.265 -3.107 -17.531 442 HG13 ILE 58 2HG1 ILE 58 7.813 -3.375 -19.211 443 HG21 ILE 58 1HG2 ILE 58 10.834 -4.445 -16.876 444 HG22 ILE 58 2HG2 ILE 58 9.295 -5.259 -16.599 445 HG23 ILE 58 3HG2 ILE 58 10.554 -6.053 -17.545 446 HD11 ILE 58 3HD1 ILE 58 7.561 -5.833 -17.814 447 HD12 ILE 58 1HD1 ILE 58 6.747 -4.571 -16.889 448 HD13 ILE 58 2HD1 ILE 58 6.306 -4.855 -18.574 449 H GLU 59 H GLU 59 12.477 -4.439 -17.898 450 HA GLU 59 HA GLU 59 13.624 -5.710 -20.263 451 HB2 GLU 59 1HB GLU 59 14.604 -3.340 -19.790 452 HB3 GLU 59 2HB GLU 59 15.441 -4.139 -18.467 453 HG2 GLU 59 1HG GLU 59 16.878 -4.031 -20.389 454 HG3 GLU 59 2HG GLU 59 16.441 -5.709 -20.070 455 H GLU 60 H GLU 60 15.319 -7.276 -19.723 456 HA GLU 60 HA GLU 60 14.564 -8.997 -17.664 457 HB2 GLU 60 1HB GLU 60 17.137 -8.786 -19.226 458 HB3 GLU 60 2HB GLU 60 16.819 -10.080 -18.080 459 HG2 GLU 60 1HG GLU 60 14.816 -10.693 -19.399 460 HG3 GLU 60 2HG GLU 60 15.267 -9.468 -20.584 461 H ASP 61 H ASP 61 16.603 -6.223 -17.622 462 HA ASP 61 HA ASP 61 18.078 -6.889 -15.266 463 HB2 ASP 61 1HB ASP 61 18.553 -5.105 -17.152 464 HB3 ASP 61 2HB ASP 61 17.615 -4.053 -16.095 465 H GLU 62 H GLU 62 14.877 -6.127 -15.748 466 HA GLU 62 HA GLU 62 14.610 -5.112 -12.994 467 HB2 GLU 62 1HB GLU 62 13.097 -4.416 -15.491 468 HB3 GLU 62 2HB GLU 62 12.351 -4.215 -13.912 469 HG2 GLU 62 1HG GLU 62 13.238 -2.170 -13.993 470 HG3 GLU 62 2HG GLU 62 14.730 -2.981 -13.521 471 H LEU 63 H LEU 63 14.653 -7.890 -14.068 472 HA LEU 63 HA LEU 63 11.971 -8.724 -13.176 473 HB2 LEU 63 1HB LEU 63 13.813 -10.271 -14.987 474 HB3 LEU 63 2HB LEU 63 12.147 -10.666 -14.570 475 HG LEU 63 HG LEU 63 13.069 -8.353 -16.274 476 HD11 LEU 63 1HD1 LEU 63 11.208 -10.228 -17.443 477 HD12 LEU 63 2HD1 LEU 63 12.696 -11.023 -16.933 478 HD13 LEU 63 3HD1 LEU 63 12.764 -9.657 -18.046 479 HD21 LEU 63 3HD2 LEU 63 11.105 -7.387 -15.916 480 HD22 LEU 63 1HD2 LEU 63 10.718 -8.631 -14.727 481 HD23 LEU 63 2HD2 LEU 63 10.268 -8.857 -16.417 482 H LYS 64 H LYS 64 15.428 -9.308 -13.012 483 HA LYS 64 HA LYS 64 15.427 -11.621 -11.442 484 HB2 LYS 64 1HB LYS 64 17.440 -9.368 -11.355 485 HB3 LYS 64 2HB LYS 64 17.707 -11.028 -10.840 486 HG2 LYS 64 1HG LYS 64 17.715 -11.833 -13.028 487 HG3 LYS 64 2HG LYS 64 16.929 -10.384 -13.660 488 HD2 LYS 64 1HD LYS 64 18.956 -9.085 -13.120 489 HD3 LYS 64 2HD LYS 64 19.737 -10.568 -12.569 490 HE2 LYS 64 1HE LYS 64 20.519 -10.491 -14.713 491 HE3 LYS 64 2HE LYS 64 19.040 -11.414 -14.969 492 HZ1 LYS 64 3HZ LYS 64 17.979 -9.154 -15.410 493 HZ2 LYS 64 1HZ LYS 64 18.997 -9.785 -16.606 494 HZ3 LYS 64 2HZ LYS 64 19.559 -8.570 -15.572 495 H TYR 65 H TYR 65 15.897 -8.259 -10.336 496 HA TYR 65 HA TYR 65 15.503 -8.985 -7.591 497 HB2 TYR 65 1HB TYR 65 15.682 -6.284 -8.939 498 HB3 TYR 65 2HB TYR 65 15.612 -6.522 -7.197 499 HD1 TYR 65 HD2 TYR 65 17.631 -7.385 -10.202 500 HD2 TYR 65 HD1 TYR 65 17.575 -6.868 -5.979 501 HE1 TYR 65 HE2 TYR 65 20.078 -7.632 -10.145 502 HE2 TYR 65 HE1 TYR 65 20.021 -7.113 -5.910 503 HH TYR 65 HH TYR 65 21.973 -6.656 -7.950 504 H PHE 66 H PHE 66 13.316 -9.886 -8.929 505 HA PHE 66 HA PHE 66 11.172 -7.943 -8.575 506 HB2 PHE 66 1HB PHE 66 11.188 -9.367 -10.593 507 HB3 PHE 66 2HB PHE 66 11.063 -10.797 -9.574 508 HD1 PHE 66 HD2 PHE 66 8.999 -11.143 -8.208 509 HD2 PHE 66 HD1 PHE 66 9.288 -8.117 -11.187 510 HE1 PHE 66 HE2 PHE 66 6.546 -10.967 -8.263 511 HE2 PHE 66 HE1 PHE 66 6.835 -7.935 -11.246 512 HZ PHE 66 HZ PHE 66 5.461 -9.362 -9.783 513 H LEU 67 H LEU 67 11.619 -11.358 -7.639 514 HA LEU 67 HA LEU 67 9.653 -11.416 -5.674 515 HB2 LEU 67 1HB LEU 67 12.204 -12.997 -5.529 516 HB3 LEU 67 2HB LEU 67 10.608 -13.447 -4.931 517 HG LEU 67 HG LEU 67 11.451 -13.271 -7.823 518 HD11 LEU 67 1HD1 LEU 67 11.375 -15.427 -5.839 519 HD12 LEU 67 2HD1 LEU 67 12.285 -15.296 -7.344 520 HD13 LEU 67 3HD1 LEU 67 10.598 -15.809 -7.375 521 HD21 LEU 67 3HD2 LEU 67 9.299 -13.109 -8.333 522 HD22 LEU 67 1HD2 LEU 67 8.866 -13.111 -6.623 523 HD23 LEU 67 2HD2 LEU 67 9.004 -14.636 -7.499 524 H GLN 68 H GLN 68 12.792 -10.012 -5.614 525 HA GLN 68 HA GLN 68 13.400 -10.065 -2.897 526 HB2 GLN 68 1HB GLN 68 14.626 -9.055 -5.072 527 HB3 GLN 68 2HB GLN 68 14.012 -7.565 -4.366 528 HG2 GLN 68 1HG GLN 68 15.572 -7.563 -2.791 529 HG3 GLN 68 2HG GLN 68 15.257 -9.247 -2.375 530 HE21 GLN 68 2HE2 GLN 68 15.938 -10.628 -4.542 531 HE22 GLN 68 1HE2 GLN 68 17.604 -10.399 -4.937 532 H ARG 69 H ARG 69 10.906 -8.413 -4.550 533 HA ARG 69 HA ARG 69 10.551 -6.374 -2.524 534 HB2 ARG 69 1HB ARG 69 9.262 -7.055 -5.122 535 HB3 ARG 69 2HB ARG 69 8.321 -6.136 -3.956 536 HG2 ARG 69 1HG ARG 69 11.079 -5.285 -4.758 537 HG3 ARG 69 2HG ARG 69 9.657 -4.846 -5.707 538 HD2 ARG 69 1HD ARG 69 9.776 -3.034 -4.320 539 HD3 ARG 69 2HD ARG 69 8.746 -4.088 -3.353 540 HE ARG 69 HE ARG 69 11.532 -4.420 -2.781 541 HH11 ARG 69 1HH1 ARG 69 8.708 -2.499 -2.109 542 HH12 ARG 69 2HH1 ARG 69 9.274 -1.973 -0.558 543 HH21 ARG 69 1HH2 ARG 69 12.289 -3.735 -0.742 544 HH22 ARG 69 2HH2 ARG 69 11.312 -2.676 0.218 545 H PHE 70 H PHE 70 8.181 -8.656 -3.880 546 HA PHE 70 HA PHE 70 6.442 -8.644 -1.733 547 HB2 PHE 70 1HB PHE 70 7.021 -10.712 -3.840 548 HB3 PHE 70 2HB PHE 70 5.803 -10.993 -2.599 549 HD1 PHE 70 HD1 PHE 70 3.980 -9.176 -2.347 550 HD2 PHE 70 HD2 PHE 70 6.446 -9.615 -5.788 551 HE1 PHE 70 HE1 PHE 70 2.329 -7.935 -3.685 552 HE2 PHE 70 HE2 PHE 70 4.800 -8.375 -7.131 553 HZ PHE 70 HZ PHE 70 2.738 -7.532 -6.079 554 H GLU 71 H GLU 71 8.538 -11.432 -2.460 555 HA GLU 71 HA GLU 71 8.319 -12.713 -0.039 556 HB2 GLU 71 1HB GLU 71 9.387 -13.786 -1.911 557 HB3 GLU 71 2HB GLU 71 10.679 -12.594 -1.918 558 HG2 GLU 71 1HG GLU 71 11.432 -13.401 0.264 559 HG3 GLU 71 2HG GLU 71 10.146 -14.607 0.255 560 H SER 72 H SER 72 10.449 -10.056 -0.918 561 HA SER 72 HA SER 72 11.727 -8.641 0.323 562 HB2 SER 72 1HB SER 72 9.483 -8.766 1.706 563 HB3 SER 72 2HB SER 72 10.496 -9.619 2.870 564 HG SER 72 HG SER 72 10.498 -7.386 3.278 565 H GLY 73 H GLY 73 12.286 -11.665 0.065 566 HA2 GLY 73 1HA GLY 73 14.662 -11.595 1.761 567 HA3 GLY 73 2HA GLY 73 13.548 -12.929 2.019 568 H ALA 74 H ALA 74 13.669 -11.823 -1.194 569 HA ALA 74 HA ALA 74 14.842 -14.300 -2.070 570 HB1 ALA 74 1HB ALA 74 14.221 -13.668 -4.251 571 HB2 ALA 74 2HB ALA 74 12.932 -13.073 -3.204 572 HB3 ALA 74 3HB ALA 74 14.151 -11.958 -3.821 573 H ARG 75 H ARG 75 16.421 -13.996 -4.077 574 HA ARG 75 HA ARG 75 18.533 -12.094 -3.320 575 HB2 ARG 75 1HB ARG 75 20.012 -14.159 -4.235 576 HB3 ARG 75 2HB ARG 75 19.644 -13.903 -2.535 577 HG2 ARG 75 1HG ARG 75 18.132 -15.620 -2.458 578 HG3 ARG 75 2HG ARG 75 17.757 -15.510 -4.179 579 HD2 ARG 75 1HD ARG 75 19.523 -16.809 -4.788 580 HD3 ARG 75 2HD ARG 75 20.523 -16.269 -3.441 581 HE ARG 75 HE ARG 75 19.803 -18.081 -2.266 582 HH11 ARG 75 1HH1 ARG 75 17.500 -17.417 -4.791 583 HH12 ARG 75 2HH1 ARG 75 16.533 -18.815 -4.455 584 HH21 ARG 75 1HH2 ARG 75 18.539 -19.925 -1.815 585 HH22 ARG 75 2HH2 ARG 75 17.124 -20.240 -2.762 586 H VAL 76 H VAL 76 17.823 -14.531 -5.832 587 HA VAL 76 HA VAL 76 17.711 -12.559 -7.903 588 HB VAL 76 HB VAL 76 19.675 -13.904 -9.121 589 HG11 VAL 76 1HG1 VAL 76 20.531 -11.854 -9.210 590 HG12 VAL 76 2HG1 VAL 76 19.322 -11.357 -8.024 591 HG13 VAL 76 3HG1 VAL 76 20.918 -11.885 -7.490 592 HG21 VAL 76 3HG2 VAL 76 20.124 -15.301 -7.140 593 HG22 VAL 76 1HG2 VAL 76 21.521 -14.334 -7.613 594 HG23 VAL 76 2HG2 VAL 76 20.539 -13.848 -6.231 595 H LEU 77 H LEU 77 17.176 -13.465 -9.975 596 HA LEU 77 HA LEU 77 15.981 -16.138 -9.733 597 HB2 LEU 77 1HB LEU 77 15.344 -13.793 -11.505 598 HB3 LEU 77 2HB LEU 77 14.661 -15.397 -11.760 599 HG LEU 77 HG LEU 77 14.318 -14.054 -9.113 600 HD11 LEU 77 1HD1 LEU 77 12.093 -13.234 -10.123 601 HD12 LEU 77 2HD1 LEU 77 12.926 -13.364 -11.672 602 HD13 LEU 77 3HD1 LEU 77 13.555 -12.294 -10.419 603 HD21 LEU 77 3HD2 LEU 77 13.184 -16.314 -10.602 604 HD22 LEU 77 1HD2 LEU 77 12.001 -15.310 -9.762 605 HD23 LEU 77 2HD2 LEU 77 13.326 -16.052 -8.863 606 H THR 78 H THR 78 15.649 -16.955 -12.234 607 HA THR 78 HA THR 78 18.400 -17.239 -13.228 608 HB THR 78 HB THR 78 17.687 -19.308 -14.286 609 HG1 THR 78 HG1 THR 78 15.500 -20.039 -13.873 610 HG21 THR 78 3HG2 THR 78 17.377 -20.641 -12.346 611 HG22 THR 78 1HG2 THR 78 16.602 -19.319 -11.474 612 HG23 THR 78 2HG2 THR 78 18.327 -19.245 -11.836 613 H ALA 79 H ALA 79 18.671 -17.475 -15.584 614 HA ALA 79 HA ALA 79 17.517 -15.298 -16.969 615 HB1 ALA 79 1HB ALA 79 19.737 -16.029 -17.519 616 HB2 ALA 79 2HB ALA 79 19.145 -17.627 -17.974 617 HB3 ALA 79 3HB ALA 79 18.712 -16.218 -18.942 618 H SER 80 H SER 80 16.367 -18.415 -16.371 619 HA SER 80 HA SER 80 14.792 -18.624 -18.798 620 HB2 SER 80 1HB SER 80 15.537 -20.394 -16.596 621 HB3 SER 80 2HB SER 80 13.839 -20.548 -17.047 622 HG SER 80 HG SER 80 14.737 -21.849 -18.481 623 H GLU 81 H GLU 81 14.144 -18.305 -15.309 624 HA GLU 81 HA GLU 81 11.366 -18.026 -15.506 625 HB2 GLU 81 1HB GLU 81 13.186 -16.802 -13.425 626 HB3 GLU 81 2HB GLU 81 11.460 -17.090 -13.258 627 HG2 GLU 81 1HG GLU 81 13.380 -19.328 -13.784 628 HG3 GLU 81 2HG GLU 81 13.066 -18.736 -12.154 629 H THR 82 H THR 82 13.768 -15.439 -14.980 630 HA THR 82 HA THR 82 12.094 -13.266 -15.247 631 HB THR 82 HB THR 82 14.093 -11.972 -15.966 632 HG1 THR 82 HG1 THR 82 16.041 -13.071 -16.256 633 HG21 THR 82 3HG2 THR 82 15.240 -13.649 -13.848 634 HG22 THR 82 1HG2 THR 82 13.590 -13.110 -13.536 635 HG23 THR 82 2HG2 THR 82 14.860 -11.927 -13.849 636 H LYS 83 H LYS 83 13.907 -14.930 -17.814 637 HA LYS 83 HA LYS 83 13.315 -13.374 -19.981 638 HB2 LYS 83 1HB LYS 83 14.752 -15.239 -20.285 639 HB3 LYS 83 2HB LYS 83 13.521 -16.371 -19.741 640 HG2 LYS 83 1HG LYS 83 12.589 -14.889 -22.023 641 HG3 LYS 83 2HG LYS 83 14.137 -15.665 -22.367 642 HD2 LYS 83 1HD LYS 83 12.928 -17.708 -21.162 643 HD3 LYS 83 2HD LYS 83 11.493 -16.870 -21.758 644 HE2 LYS 83 1HE LYS 83 12.440 -16.896 -24.024 645 HE3 LYS 83 2HE LYS 83 13.851 -17.760 -23.417 646 HZ1 LYS 83 3HZ LYS 83 11.050 -18.745 -23.421 647 HZ2 LYS 83 1HZ LYS 83 12.358 -19.564 -22.726 648 HZ3 LYS 83 2HZ LYS 83 12.315 -19.302 -24.397 649 H THR 84 H THR 84 11.267 -15.901 -18.565 650 HA THR 84 HA THR 84 9.107 -15.262 -20.408 651 HB THR 84 HB THR 84 9.518 -17.622 -19.885 652 HG1 THR 84 HG1 THR 84 7.061 -16.896 -18.666 653 HG21 THR 84 3HG2 THR 84 10.344 -17.699 -17.707 654 HG22 THR 84 1HG2 THR 84 8.715 -18.352 -17.535 655 HG23 THR 84 2HG2 THR 84 9.049 -16.682 -17.076 656 H PHE 85 H PHE 85 9.733 -13.105 -18.810 657 HA PHE 85 HA PHE 85 7.419 -12.989 -16.990 658 HB2 PHE 85 1HB PHE 85 9.949 -12.806 -16.124 659 HB3 PHE 85 2HB PHE 85 9.690 -11.120 -16.562 660 HD1 PHE 85 HD2 PHE 85 8.450 -13.881 -14.448 661 HD2 PHE 85 HD1 PHE 85 8.386 -9.695 -15.216 662 HE1 PHE 85 HE2 PHE 85 7.291 -13.509 -12.310 663 HE2 PHE 85 HE1 PHE 85 7.228 -9.317 -13.079 664 HZ PHE 85 HZ PHE 85 6.677 -11.225 -11.623 665 H LEU 86 H LEU 86 9.469 -11.215 -19.251 666 HA LEU 86 HA LEU 86 7.264 -9.296 -19.627 667 HB2 LEU 86 1HB LEU 86 8.939 -7.629 -20.253 668 HB3 LEU 86 2HB LEU 86 9.164 -8.206 -18.603 669 HG LEU 86 HG LEU 86 10.957 -9.749 -19.576 670 HD11 LEU 86 1HD1 LEU 86 10.071 -8.405 -21.962 671 HD12 LEU 86 2HD1 LEU 86 11.175 -9.769 -21.784 672 HD13 LEU 86 3HD1 LEU 86 11.789 -8.119 -21.682 673 HD21 LEU 86 3HD2 LEU 86 12.643 -8.031 -19.411 674 HD22 LEU 86 1HD2 LEU 86 11.390 -7.738 -18.205 675 HD23 LEU 86 2HD2 LEU 86 11.436 -6.773 -19.681 676 H ALA 87 H ALA 87 9.435 -11.535 -21.065 677 HA ALA 87 HA ALA 87 9.105 -10.593 -23.766 678 HB1 ALA 87 1HB ALA 87 10.640 -12.164 -24.365 679 HB2 ALA 87 2HB ALA 87 11.035 -12.028 -22.651 680 HB3 ALA 87 3HB ALA 87 10.029 -13.360 -23.221 681 H ALA 88 H ALA 88 7.520 -12.853 -21.646 682 HA ALA 88 HA ALA 88 6.172 -14.397 -23.582 683 HB1 ALA 88 1HB ALA 88 5.183 -13.770 -20.807 684 HB2 ALA 88 2HB ALA 88 4.799 -15.179 -21.797 685 HB3 ALA 88 3HB ALA 88 6.429 -14.969 -21.158 686 H ALA 89 H ALA 89 5.826 -11.155 -22.732 687 HA ALA 89 HA ALA 89 3.061 -10.745 -22.954 688 HB1 ALA 89 1HB ALA 89 3.844 -8.769 -22.289 689 HB2 ALA 89 2HB ALA 89 5.454 -9.104 -22.926 690 HB3 ALA 89 3HB ALA 89 4.205 -8.452 -23.986 691 H ASP 90 H ASP 90 5.367 -9.680 -25.439 692 HA ASP 90 HA ASP 90 3.861 -11.035 -27.517 693 HB2 ASP 90 1HB ASP 90 2.860 -8.671 -26.975 694 HB3 ASP 90 2HB ASP 90 4.251 -8.087 -27.884 695 H HIS 91 H HIS 91 4.948 -11.077 -29.551 696 HA HIS 91 HA HIS 91 7.838 -10.731 -29.268 697 HB2 HIS 91 1HB HIS 91 7.935 -12.132 -31.349 698 HB3 HIS 91 2HB HIS 91 7.190 -12.933 -29.969 699 HD1 HIS 91 HD1 HIS 91 4.738 -13.594 -30.170 700 HD2 HIS 91 HD2 HIS 91 6.147 -11.466 -33.448 701 HE1 HIS 91 HE1 HIS 91 2.949 -13.800 -31.925 702 H ASP 92 H ASP 92 5.931 -8.511 -29.796 703 HA ASP 92 HA ASP 92 5.921 -7.629 -32.412 704 HB2 ASP 92 1HB ASP 92 4.689 -6.470 -30.671 705 HB3 ASP 92 2HB ASP 92 6.189 -6.005 -29.875 706 H GLY 93 H GLY 93 8.545 -7.687 -30.117 707 HA2 GLY 93 1HA GLY 93 10.441 -7.130 -32.214 708 HA3 GLY 93 2HA GLY 93 10.324 -5.843 -31.023 709 H ASP 94 H ASP 94 10.383 -6.741 -28.670 710 HA ASP 94 HA ASP 94 12.079 -9.064 -28.342 711 HB2 ASP 94 1HB ASP 94 13.609 -7.106 -28.871 712 HB3 ASP 94 2HB ASP 94 13.087 -6.400 -27.343 713 H GLY 95 H GLY 95 9.420 -7.882 -27.487 714 HA2 GLY 95 1HA GLY 95 8.174 -8.479 -25.586 715 HA3 GLY 95 2HA GLY 95 9.673 -8.666 -24.688 716 H LYS 96 H LYS 96 9.202 -5.804 -26.569 717 HA LYS 96 HA LYS 96 9.518 -4.118 -24.311 718 HB2 LYS 96 1HB LYS 96 8.961 -3.700 -27.217 719 HB3 LYS 96 2HB LYS 96 8.712 -2.356 -26.110 720 HG2 LYS 96 1HG LYS 96 10.996 -2.381 -25.442 721 HG3 LYS 96 2HG LYS 96 11.289 -3.897 -26.297 722 HD2 LYS 96 1HD LYS 96 10.306 -1.499 -27.791 723 HD3 LYS 96 2HD LYS 96 12.016 -1.641 -27.376 724 HE2 LYS 96 1HE LYS 96 12.175 -3.733 -28.561 725 HE3 LYS 96 2HE LYS 96 10.438 -3.739 -28.862 726 HZ1 LYS 96 3HZ LYS 96 10.615 -2.098 -30.437 727 HZ2 LYS 96 1HZ LYS 96 12.065 -2.931 -30.690 728 HZ3 LYS 96 2HZ LYS 96 12.063 -1.482 -29.817 729 H ILE 97 H ILE 97 7.899 -4.438 -22.820 730 HA ILE 97 HA ILE 97 5.119 -4.228 -23.627 731 HB ILE 97 HB ILE 97 6.312 -4.552 -20.871 732 HG12 ILE 97 1HG1 ILE 97 4.964 -6.631 -22.601 733 HG13 ILE 97 2HG1 ILE 97 6.711 -6.430 -22.511 734 HG21 ILE 97 1HG2 ILE 97 4.257 -3.876 -20.257 735 HG22 ILE 97 2HG2 ILE 97 3.568 -4.182 -21.850 736 HG23 ILE 97 3HG2 ILE 97 3.785 -5.512 -20.713 737 HD11 ILE 97 3HD1 ILE 97 6.720 -7.017 -20.197 738 HD12 ILE 97 1HD1 ILE 97 4.957 -7.022 -20.142 739 HD13 ILE 97 2HD1 ILE 97 5.814 -8.244 -21.082 740 H GLY 98 H GLY 98 3.697 -2.604 -23.006 741 HA2 GLY 98 1HA GLY 98 4.761 -0.299 -21.559 742 HA3 GLY 98 2HA GLY 98 4.236 -0.026 -23.213 743 H ALA 99 H ALA 99 3.038 -1.554 -20.223 744 HA ALA 99 HA ALA 99 0.950 -1.645 -19.306 745 HB1 ALA 99 1HB ALA 99 0.319 1.057 -20.373 746 HB2 ALA 99 2HB ALA 99 0.091 0.397 -18.753 747 HB3 ALA 99 3HB ALA 99 1.699 0.887 -19.287 748 H GLU 100 H GLU 100 0.935 -3.002 -21.623 749 HA GLU 100 HA GLU 100 -1.796 -2.704 -22.488 750 HB2 GLU 100 1HB GLU 100 -1.318 -2.499 -24.865 751 HB3 GLU 100 2HB GLU 100 -0.641 -1.134 -23.990 752 HG2 GLU 100 1HG GLU 100 1.519 -2.619 -23.976 753 HG3 GLU 100 2HG GLU 100 0.739 -3.382 -25.360 754 H GLU 101 H GLU 101 1.309 -4.331 -22.817 755 HA GLU 101 HA GLU 101 0.076 -6.739 -23.863 756 HB2 GLU 101 1HB GLU 101 2.937 -6.166 -23.069 757 HB3 GLU 101 2HB GLU 101 2.379 -7.640 -23.848 758 HG2 GLU 101 1HG GLU 101 2.543 -4.873 -24.979 759 HG3 GLU 101 2HG GLU 101 3.293 -6.355 -25.567 760 H PHE 102 H PHE 102 1.873 -5.792 -20.941 761 HA PHE 102 HA PHE 102 1.752 -8.199 -19.574 762 HB2 PHE 102 1HB PHE 102 2.766 -5.749 -19.013 763 HB3 PHE 102 2HB PHE 102 1.381 -5.773 -17.926 764 HD1 PHE 102 HD1 PHE 102 1.157 -8.268 -16.772 765 HD2 PHE 102 HD2 PHE 102 4.736 -6.328 -18.016 766 HE1 PHE 102 HE1 PHE 102 2.443 -9.614 -15.163 767 HE2 PHE 102 HE2 PHE 102 6.027 -7.672 -16.410 768 HZ PHE 102 HZ PHE 102 4.881 -9.318 -14.982 769 H GLN 103 H GLN 103 -0.658 -5.650 -19.848 770 HA GLN 103 HA GLN 103 -2.437 -6.478 -17.872 771 HB2 GLN 103 1HB GLN 103 -2.760 -4.980 -20.446 772 HB3 GLN 103 2HB GLN 103 -4.182 -5.436 -19.516 773 HG2 GLN 103 1HG GLN 103 -3.242 -3.120 -19.122 774 HG3 GLN 103 2HG GLN 103 -3.561 -4.107 -17.696 775 HE21 GLN 103 2HE2 GLN 103 -0.936 -3.476 -20.001 776 HE22 GLN 103 1HE2 GLN 103 0.320 -3.420 -18.817 777 H GLU 104 H GLU 104 -2.758 -7.121 -21.370 778 HA GLU 104 HA GLU 104 -4.805 -8.987 -21.181 779 HB2 GLU 104 1HB GLU 104 -2.648 -8.519 -23.216 780 HB3 GLU 104 2HB GLU 104 -3.763 -9.866 -23.397 781 HG2 GLU 104 1HG GLU 104 -5.644 -8.355 -23.435 782 HG3 GLU 104 2HG GLU 104 -4.581 -6.982 -23.133 783 H MET 105 H MET 105 -1.371 -9.360 -20.690 784 HA MET 105 HA MET 105 -1.226 -12.170 -20.874 785 HB2 MET 105 1HB MET 105 0.838 -11.081 -20.946 786 HB3 MET 105 2HB MET 105 0.465 -10.073 -19.554 787 HG2 MET 105 1HG MET 105 1.106 -11.646 -18.064 788 HG3 MET 105 2HG MET 105 0.590 -12.985 -19.087 789 HE1 MET 105 3HE MET 105 3.451 -10.193 -18.681 790 HE2 MET 105 1HE MET 105 4.393 -10.600 -20.115 791 HE3 MET 105 2HE MET 105 2.733 -10.029 -20.284 792 H VAL 106 H VAL 106 -2.342 -10.035 -18.380 793 HA VAL 106 HA VAL 106 -2.397 -12.187 -16.402 794 HB VAL 106 HB VAL 106 -3.137 -9.271 -16.126 795 HG11 VAL 106 1HG1 VAL 106 -2.828 -11.362 -13.975 796 HG12 VAL 106 2HG1 VAL 106 -3.284 -9.671 -13.755 797 HG13 VAL 106 3HG1 VAL 106 -4.372 -10.777 -14.594 798 HG21 VAL 106 3HG2 VAL 106 -0.855 -9.185 -16.290 799 HG22 VAL 106 1HG2 VAL 106 -1.025 -9.494 -14.561 800 HG23 VAL 106 2HG2 VAL 106 -0.637 -10.818 -15.660 801 H GLN 107 H GLN 107 -4.638 -9.851 -17.889 802 HA GLN 107 HA GLN 107 -6.990 -10.860 -16.767 803 HB2 GLN 107 1HB GLN 107 -6.744 -9.591 -19.496 804 HB3 GLN 107 2HB GLN 107 -8.167 -9.625 -18.463 805 HG2 GLN 107 1HG GLN 107 -5.672 -8.008 -18.186 806 HG3 GLN 107 2HG GLN 107 -7.354 -7.479 -18.188 807 HE21 GLN 107 2HE2 GLN 107 -5.021 -7.191 -16.277 808 HE22 GLN 107 1HE2 GLN 107 -5.677 -7.648 -14.746 809 H SER 108 H SER 108 -5.014 -12.060 -19.326 810 HA SER 108 HA SER 108 -7.095 -14.003 -20.073 811 HB2 SER 108 1HB SER 108 -6.218 -14.105 -22.206 812 HB3 SER 108 2HB SER 108 -5.829 -12.436 -21.791 813 HG SER 108 HG SER 108 -4.164 -14.606 -22.161 Start of MODEL 13 1 H1 SER 1 H SER 1 5.134 -0.320 0.307 2 HA SER 1 HA SER 1 2.213 -0.276 0.299 3 HB2 SER 1 1HB SER 1 4.348 0.904 -1.391 4 HB3 SER 1 2HB SER 1 2.855 0.452 -2.215 5 HG SER 1 HG SER 1 2.022 2.195 -1.419 6 H LEU 2 H LEU 2 3.920 -2.753 0.377 7 HA LEU 2 HA LEU 2 3.622 -4.029 -2.166 8 HB2 LEU 2 1HB LEU 2 5.338 -4.601 -0.424 9 HB3 LEU 2 2HB LEU 2 4.041 -5.339 0.513 10 HG LEU 2 HG LEU 2 3.731 -6.666 -1.801 11 HD11 LEU 2 1HD1 LEU 2 6.129 -5.293 -2.208 12 HD12 LEU 2 2HD1 LEU 2 5.479 -6.625 -3.165 13 HD13 LEU 2 3HD1 LEU 2 6.592 -6.954 -1.837 14 HD21 LEU 2 3HD2 LEU 2 5.767 -7.401 0.298 15 HD22 LEU 2 1HD2 LEU 2 4.882 -8.502 -0.757 16 HD23 LEU 2 2HD2 LEU 2 4.023 -7.588 0.481 17 H THR 3 H THR 3 2.082 -5.452 -2.859 18 HA THR 3 HA THR 3 -0.049 -6.241 -3.101 19 HB THR 3 HB THR 3 -0.817 -7.736 -1.396 20 HG1 THR 3 HG1 THR 3 1.103 -6.617 0.382 21 HG21 THR 3 3HG2 THR 3 2.116 -7.969 -0.955 22 HG22 THR 3 1HG2 THR 3 1.517 -8.064 -2.610 23 HG23 THR 3 2HG2 THR 3 0.939 -9.206 -1.397 24 H ASP 4 H ASP 4 -0.327 -3.656 -2.986 25 HA ASP 4 HA ASP 4 -1.901 -2.712 -0.787 26 HB2 ASP 4 1HB ASP 4 -0.519 -1.168 -2.081 27 HB3 ASP 4 2HB ASP 4 -1.444 -1.532 -3.535 28 H ILE 5 H ILE 5 -2.658 -3.367 -4.211 29 HA ILE 5 HA ILE 5 -5.494 -3.211 -3.700 30 HB ILE 5 HB ILE 5 -4.063 -2.710 -5.918 31 HG12 ILE 5 1HG1 ILE 5 -6.407 -3.300 -7.095 32 HG13 ILE 5 2HG1 ILE 5 -6.908 -3.400 -5.411 33 HG21 ILE 5 1HG2 ILE 5 -3.503 -5.137 -6.131 34 HG22 ILE 5 2HG2 ILE 5 -5.211 -5.446 -6.436 35 HG23 ILE 5 3HG2 ILE 5 -4.285 -4.439 -7.549 36 HD11 ILE 5 3HD1 ILE 5 -7.346 -1.198 -6.218 37 HD12 ILE 5 1HD1 ILE 5 -6.009 -1.114 -5.071 38 HD13 ILE 5 2HD1 ILE 5 -5.691 -1.031 -6.804 39 H LEU 6 H LEU 6 -3.154 -5.583 -3.348 40 HA LEU 6 HA LEU 6 -5.195 -7.704 -3.470 41 HB2 LEU 6 1HB LEU 6 -2.650 -7.535 -4.762 42 HB3 LEU 6 2HB LEU 6 -2.626 -8.866 -3.607 43 HG LEU 6 HG LEU 6 -4.878 -9.519 -4.791 44 HD11 LEU 6 1HD1 LEU 6 -3.485 -8.191 -7.091 45 HD12 LEU 6 2HD1 LEU 6 -4.745 -7.371 -6.169 46 HD13 LEU 6 3HD1 LEU 6 -5.112 -8.870 -7.023 47 HD21 LEU 6 3HD2 LEU 6 -3.693 -11.204 -5.684 48 HD22 LEU 6 1HD2 LEU 6 -2.329 -10.451 -4.857 49 HD23 LEU 6 2HD2 LEU 6 -2.617 -10.118 -6.565 50 H SER 7 H SER 7 -4.067 -9.728 -2.197 51 HA SER 7 HA SER 7 -3.653 -8.676 0.511 52 HB2 SER 7 1HB SER 7 -5.292 -10.731 -0.500 53 HB3 SER 7 2HB SER 7 -4.020 -11.537 0.419 54 HG SER 7 HG SER 7 -5.823 -9.543 1.314 55 HA PRO 8 HA PRO 8 0.587 -9.898 0.412 56 HB2 PRO 8 1HB PRO 8 1.051 -9.859 3.087 57 HB3 PRO 8 2HB PRO 8 0.893 -8.389 2.118 58 HG2 PRO 8 1HG PRO 8 -1.137 -9.741 3.854 59 HG3 PRO 8 2HG PRO 8 -0.770 -8.013 3.700 60 HD2 PRO 8 1HD PRO 8 -2.885 -9.169 2.465 61 HD3 PRO 8 2HD PRO 8 -2.005 -7.795 1.766 62 H SER 9 H SER 9 -1.910 -11.674 1.989 63 HA SER 9 HA SER 9 -0.135 -13.919 2.586 64 HB2 SER 9 1HB SER 9 -3.049 -13.421 3.222 65 HB3 SER 9 2HB SER 9 -2.202 -14.916 3.617 66 HG SER 9 HG SER 9 -0.924 -13.825 5.031 67 H ASP 10 H ASP 10 -0.807 -13.088 -0.165 68 HA ASP 10 HA ASP 10 -1.947 -15.645 -1.072 69 HB2 ASP 10 1HB ASP 10 -2.428 -12.955 -2.371 70 HB3 ASP 10 2HB ASP 10 -3.068 -14.504 -2.912 71 H ILE 11 H ILE 11 0.227 -12.956 -1.690 72 HA ILE 11 HA ILE 11 1.310 -14.004 -4.109 73 HB ILE 11 HB ILE 11 2.310 -11.907 -2.190 74 HG12 ILE 11 1HG1 ILE 11 1.867 -10.512 -4.338 75 HG13 ILE 11 2HG1 ILE 11 0.913 -11.899 -4.852 76 HG21 ILE 11 1HG2 ILE 11 4.321 -12.620 -3.064 77 HG22 ILE 11 2HG2 ILE 11 3.608 -13.079 -4.609 78 HG23 ILE 11 3HG2 ILE 11 3.851 -11.376 -4.222 79 HD11 ILE 11 3HD1 ILE 11 0.264 -11.061 -2.156 80 HD12 ILE 11 1HD1 ILE 11 0.036 -9.774 -3.340 81 HD13 ILE 11 2HD1 ILE 11 -0.786 -11.321 -3.549 82 H ALA 12 H ALA 12 1.943 -14.511 -0.738 83 HA ALA 12 HA ALA 12 4.574 -15.546 -0.974 84 HB1 ALA 12 1HB ALA 12 4.486 -15.651 1.251 85 HB2 ALA 12 2HB ALA 12 2.897 -14.899 1.113 86 HB3 ALA 12 3HB ALA 12 3.034 -16.653 1.229 87 H ALA 13 H ALA 13 1.375 -16.956 -1.249 88 HA ALA 13 HA ALA 13 2.083 -19.669 -1.082 89 HB1 ALA 13 1HB ALA 13 -0.200 -18.259 -2.437 90 HB2 ALA 13 2HB ALA 13 -0.039 -20.015 -2.428 91 HB3 ALA 13 3HB ALA 13 -0.206 -19.137 -0.908 92 H ALA 14 H ALA 14 2.337 -17.354 -3.673 93 HA ALA 14 HA ALA 14 2.845 -19.366 -5.691 94 HB1 ALA 14 1HB ALA 14 1.782 -16.948 -5.912 95 HB2 ALA 14 2HB ALA 14 3.469 -16.507 -6.185 96 HB3 ALA 14 3HB ALA 14 2.688 -17.695 -7.229 97 H LEU 15 H LEU 15 4.707 -16.870 -3.980 98 HA LEU 15 HA LEU 15 7.166 -17.273 -5.220 99 HB2 LEU 15 1HB LEU 15 6.524 -16.430 -2.401 100 HB3 LEU 15 2HB LEU 15 8.140 -16.368 -3.100 101 HG LEU 15 HG LEU 15 5.738 -14.792 -4.025 102 HD11 LEU 15 1HD1 LEU 15 7.445 -14.334 -1.882 103 HD12 LEU 15 2HD1 LEU 15 6.380 -13.163 -2.658 104 HD13 LEU 15 3HD1 LEU 15 8.061 -13.301 -3.173 105 HD21 LEU 15 3HD2 LEU 15 7.104 -15.291 -5.922 106 HD22 LEU 15 1HD2 LEU 15 8.576 -14.897 -5.034 107 HD23 LEU 15 2HD2 LEU 15 7.427 -13.623 -5.446 108 H ARG 16 H ARG 16 5.486 -19.220 -2.922 109 HA ARG 16 HA ARG 16 7.873 -20.769 -2.272 110 HB2 ARG 16 1HB ARG 16 5.951 -20.078 -0.630 111 HB3 ARG 16 2HB ARG 16 5.121 -21.467 -1.318 112 HG2 ARG 16 1HG ARG 16 7.900 -21.765 -0.269 113 HG3 ARG 16 2HG ARG 16 6.529 -21.737 0.842 114 HD2 ARG 16 1HD ARG 16 6.745 -23.587 -1.526 115 HD3 ARG 16 2HD ARG 16 7.237 -24.021 0.110 116 HE ARG 16 HE ARG 16 4.667 -23.176 0.397 117 HH11 ARG 16 1HH1 ARG 16 6.244 -25.553 -1.599 118 HH12 ARG 16 2HH1 ARG 16 4.863 -26.597 -1.673 119 HH21 ARG 16 1HH2 ARG 16 2.843 -24.542 0.307 120 HH22 ARG 16 2HH2 ARG 16 2.929 -26.020 -0.590 121 H ASP 17 H ASP 17 4.609 -21.346 -3.581 122 HA ASP 17 HA ASP 17 5.012 -24.020 -4.309 123 HB2 ASP 17 1HB ASP 17 2.832 -22.596 -4.228 124 HB3 ASP 17 2HB ASP 17 3.230 -22.201 -5.898 125 H CYS 18 H CYS 18 6.196 -21.130 -5.700 126 HA CYS 18 HA CYS 18 7.156 -22.648 -8.035 127 HB2 CYS 18 1HB CYS 18 6.553 -19.688 -8.039 128 HB3 CYS 18 2HB CYS 18 6.950 -20.702 -9.421 129 HG CYS 18 HG CYS 18 4.544 -22.191 -9.227 130 H GLN 19 H GLN 19 8.346 -22.083 -5.360 131 HA GLN 19 HA GLN 19 10.364 -20.132 -5.585 132 HB2 GLN 19 1HB GLN 19 9.468 -21.563 -3.535 133 HB3 GLN 19 2HB GLN 19 10.838 -22.583 -3.955 134 HG2 GLN 19 1HG GLN 19 12.363 -20.755 -3.644 135 HG3 GLN 19 2HG GLN 19 11.026 -19.635 -3.386 136 HE21 GLN 19 2HE2 GLN 19 9.654 -20.036 -1.509 137 HE22 GLN 19 1HE2 GLN 19 10.366 -20.702 -0.083 138 H ALA 20 H ALA 20 10.077 -23.323 -6.858 139 HA ALA 20 HA ALA 20 12.827 -23.905 -7.208 140 HB1 ALA 20 1HB ALA 20 12.109 -25.838 -8.089 141 HB2 ALA 20 2HB ALA 20 10.522 -25.312 -7.525 142 HB3 ALA 20 3HB ALA 20 10.998 -25.035 -9.200 143 HA PRO 21 HA PRO 21 14.007 -21.557 -10.722 144 HB2 PRO 21 1HB PRO 21 15.532 -23.318 -12.115 145 HB3 PRO 21 2HB PRO 21 16.060 -22.580 -10.597 146 HG2 PRO 21 1HG PRO 21 14.883 -25.291 -11.078 147 HG3 PRO 21 2HG PRO 21 16.247 -24.830 -10.041 148 HD2 PRO 21 1HD PRO 21 13.765 -25.297 -9.063 149 HD3 PRO 21 2HD PRO 21 14.871 -24.113 -8.336 150 H ASP 22 H ASP 22 13.107 -20.982 -12.609 151 HA ASP 22 HA ASP 22 11.854 -21.034 -14.507 152 HB2 ASP 22 1HB ASP 22 13.630 -22.736 -15.123 153 HB3 ASP 22 2HB ASP 22 12.480 -23.984 -14.652 154 H SER 23 H SER 23 10.790 -21.912 -11.784 155 HA SER 23 HA SER 23 8.413 -23.382 -12.695 156 HB2 SER 23 1HB SER 23 9.793 -24.266 -10.747 157 HB3 SER 23 2HB SER 23 9.216 -22.877 -9.827 158 HG SER 23 HG SER 23 7.418 -24.602 -11.150 159 H PHE 24 H PHE 24 9.523 -20.327 -11.642 160 HA PHE 24 HA PHE 24 6.837 -19.414 -10.936 161 HB2 PHE 24 1HB PHE 24 8.524 -18.685 -9.403 162 HB3 PHE 24 2HB PHE 24 9.555 -18.119 -10.714 163 HD1 PHE 24 HD1 PHE 24 5.988 -17.582 -9.746 164 HD2 PHE 24 HD2 PHE 24 9.738 -15.840 -10.755 165 HE1 PHE 24 HE1 PHE 24 4.995 -15.339 -9.550 166 HE2 PHE 24 HE2 PHE 24 8.752 -13.595 -10.559 167 HZ PHE 24 HZ PHE 24 6.378 -13.342 -9.955 168 H SER 25 H SER 25 5.743 -17.823 -12.052 169 HA SER 25 HA SER 25 6.908 -16.528 -14.345 170 HB2 SER 25 1HB SER 25 4.483 -18.013 -15.137 171 HB3 SER 25 2HB SER 25 5.959 -17.693 -16.047 172 HG SER 25 HG SER 25 6.906 -19.436 -15.156 173 HA PRO 26 HA PRO 26 3.871 -13.487 -13.466 174 HB2 PRO 26 1HB PRO 26 3.359 -12.466 -15.929 175 HB3 PRO 26 2HB PRO 26 4.872 -12.173 -15.063 176 HG2 PRO 26 1HG PRO 26 4.285 -14.144 -17.239 177 HG3 PRO 26 2HG PRO 26 5.701 -13.098 -17.029 178 HD2 PRO 26 1HD PRO 26 5.717 -15.722 -16.363 179 HD3 PRO 26 2HD PRO 26 6.672 -14.509 -15.487 180 H LYS 27 H LYS 27 3.073 -15.658 -16.150 181 HA LYS 27 HA LYS 27 0.221 -15.190 -15.748 182 HB2 LYS 27 1HB LYS 27 -0.107 -16.483 -17.766 183 HB3 LYS 27 2HB LYS 27 1.143 -15.279 -18.047 184 HG2 LYS 27 1HG LYS 27 2.861 -16.910 -17.935 185 HG3 LYS 27 2HG LYS 27 1.744 -18.137 -17.335 186 HD2 LYS 27 1HD LYS 27 2.149 -18.567 -19.656 187 HD3 LYS 27 2HD LYS 27 0.501 -17.956 -19.491 188 HE2 LYS 27 1HE LYS 27 1.026 -15.914 -20.441 189 HE3 LYS 27 2HE LYS 27 2.740 -16.060 -20.057 190 HZ1 LYS 27 3HZ LYS 27 2.170 -16.340 -22.452 191 HZ2 LYS 27 1HZ LYS 27 1.364 -17.772 -22.049 192 HZ3 LYS 27 2HZ LYS 27 3.029 -17.636 -21.785 193 H LYS 28 H LYS 28 1.764 -16.516 -13.681 194 HA LYS 28 HA LYS 28 0.263 -19.040 -13.595 195 HB2 LYS 28 1HB LYS 28 3.189 -18.631 -13.298 196 HB3 LYS 28 2HB LYS 28 2.430 -19.761 -12.185 197 HG2 LYS 28 1HG LYS 28 2.106 -19.931 -15.168 198 HG3 LYS 28 2HG LYS 28 3.389 -20.759 -14.282 199 HD2 LYS 28 1HD LYS 28 0.490 -21.087 -13.560 200 HD3 LYS 28 2HD LYS 28 1.261 -22.083 -14.796 201 HE2 LYS 28 1HE LYS 28 2.601 -21.824 -12.153 202 HE3 LYS 28 2HE LYS 28 1.160 -22.834 -12.261 203 HZ1 LYS 28 3HZ LYS 28 2.446 -24.435 -13.053 204 HZ2 LYS 28 1HZ LYS 28 3.795 -23.415 -13.093 205 HZ3 LYS 28 2HZ LYS 28 2.757 -23.496 -14.425 206 H PHE 29 H PHE 29 1.976 -16.521 -11.808 207 HA PHE 29 HA PHE 29 0.863 -17.351 -9.277 208 HB2 PHE 29 1HB PHE 29 2.230 -15.750 -8.297 209 HB3 PHE 29 2HB PHE 29 3.145 -16.165 -9.742 210 HD1 PHE 29 HD2 PHE 29 2.568 -14.682 -11.853 211 HD2 PHE 29 HD1 PHE 29 1.912 -13.533 -7.808 212 HE1 PHE 29 HE2 PHE 29 2.576 -12.316 -12.527 213 HE2 PHE 29 HE1 PHE 29 1.917 -11.165 -8.476 214 HZ PHE 29 HZ PHE 29 2.251 -10.554 -10.838 215 H PHE 30 H PHE 30 -0.019 -15.263 -11.855 216 HA PHE 30 HA PHE 30 -1.529 -13.306 -10.629 217 HB2 PHE 30 1HB PHE 30 -2.632 -13.000 -12.699 218 HB3 PHE 30 2HB PHE 30 -1.033 -13.608 -13.115 219 HD1 PHE 30 HD1 PHE 30 -0.907 -16.254 -13.294 220 HD2 PHE 30 HD2 PHE 30 -4.440 -13.926 -13.757 221 HE1 PHE 30 HE1 PHE 30 -1.936 -18.078 -14.586 222 HE2 PHE 30 HE2 PHE 30 -5.474 -15.746 -15.049 223 HZ PHE 30 HZ PHE 30 -4.223 -17.825 -15.465 224 H GLN 31 H GLN 31 -2.290 -16.680 -11.156 225 HA GLN 31 HA GLN 31 -5.044 -16.373 -10.324 226 HB2 GLN 31 1HB GLN 31 -5.325 -18.632 -10.853 227 HB3 GLN 31 2HB GLN 31 -4.129 -18.083 -12.019 228 HG2 GLN 31 1HG GLN 31 -2.414 -18.931 -10.266 229 HG3 GLN 31 2HG GLN 31 -3.782 -19.853 -9.644 230 HE21 GLN 31 2HE2 GLN 31 -1.173 -20.151 -11.477 231 HE22 GLN 31 1HE2 GLN 31 -1.702 -21.339 -12.613 232 H ILE 32 H ILE 32 -1.991 -17.361 -8.935 233 HA ILE 32 HA ILE 32 -3.091 -18.501 -6.561 234 HB ILE 32 HB ILE 32 -0.306 -17.471 -7.115 235 HG12 ILE 32 1HG1 ILE 32 -0.974 -20.363 -6.863 236 HG13 ILE 32 2HG1 ILE 32 -1.452 -19.544 -8.346 237 HG21 ILE 32 1HG2 ILE 32 -0.186 -17.540 -4.860 238 HG22 ILE 32 2HG2 ILE 32 -1.563 -18.631 -4.712 239 HG23 ILE 32 3HG2 ILE 32 0.023 -19.267 -5.146 240 HD11 ILE 32 3HD1 ILE 32 1.323 -19.117 -7.444 241 HD12 ILE 32 1HD1 ILE 32 0.913 -20.733 -8.020 242 HD13 ILE 32 2HD1 ILE 32 0.673 -19.335 -9.069 243 H SER 33 H SER 33 -1.242 -15.488 -7.066 244 HA SER 33 HA SER 33 -1.720 -14.410 -4.533 245 HB2 SER 33 1HB SER 33 -1.277 -12.865 -7.098 246 HB3 SER 33 2HB SER 33 -0.975 -12.292 -5.457 247 HG SER 33 HG SER 33 0.358 -14.419 -6.785 248 H GLY 34 H GLY 34 -3.449 -13.890 -7.597 249 HA2 GLY 34 1HA GLY 34 -5.927 -13.843 -7.371 250 HA3 GLY 34 2HA GLY 34 -5.673 -12.751 -6.018 251 H MET 35 H MET 35 -3.629 -12.431 -8.782 252 HA MET 35 HA MET 35 -4.471 -9.745 -9.215 253 HB2 MET 35 1HB MET 35 -2.558 -11.595 -10.608 254 HB3 MET 35 2HB MET 35 -2.954 -10.028 -11.301 255 HG2 MET 35 1HG MET 35 -2.356 -9.350 -8.738 256 HG3 MET 35 2HG MET 35 -1.267 -10.708 -9.012 257 HE1 MET 35 3HE MET 35 -0.921 -9.544 -12.676 258 HE2 MET 35 1HE MET 35 0.703 -9.812 -12.043 259 HE3 MET 35 2HE MET 35 -0.607 -10.907 -11.601 260 H SER 36 H SER 36 -5.361 -12.809 -10.554 261 HA SER 36 HA SER 36 -6.331 -12.120 -13.052 262 HB2 SER 36 1HB SER 36 -6.430 -14.394 -12.706 263 HB3 SER 36 2HB SER 36 -7.028 -14.225 -11.056 264 HG SER 36 HG SER 36 -8.475 -14.888 -13.018 265 H LYS 37 H LYS 37 -7.735 -11.584 -9.891 266 HA LYS 37 HA LYS 37 -10.355 -10.955 -10.654 267 HB2 LYS 37 1HB LYS 37 -8.861 -9.660 -8.375 268 HB3 LYS 37 2HB LYS 37 -10.593 -9.934 -8.507 269 HG2 LYS 37 1HG LYS 37 -8.450 -12.014 -8.138 270 HG3 LYS 37 2HG LYS 37 -9.671 -11.515 -6.966 271 HD2 LYS 37 1HD LYS 37 -11.429 -12.347 -8.479 272 HD3 LYS 37 2HD LYS 37 -10.182 -12.890 -9.604 273 HE2 LYS 37 1HE LYS 37 -9.259 -14.213 -7.593 274 HE3 LYS 37 2HE LYS 37 -10.842 -13.930 -6.870 275 HZ1 LYS 37 3HZ LYS 37 -10.088 -15.717 -9.004 276 HZ2 LYS 37 1HZ LYS 37 -11.483 -14.817 -9.328 277 HZ3 LYS 37 2HZ LYS 37 -11.406 -15.789 -7.946 278 H LYS 38 H LYS 38 -7.417 -9.033 -10.623 279 HA LYS 38 HA LYS 38 -8.406 -6.475 -10.865 280 HB2 LYS 38 1HB LYS 38 -6.042 -7.625 -12.359 281 HB3 LYS 38 2HB LYS 38 -6.335 -5.920 -12.046 282 HG2 LYS 38 1HG LYS 38 -5.672 -8.069 -10.053 283 HG3 LYS 38 2HG LYS 38 -4.711 -6.653 -10.487 284 HD2 LYS 38 1HD LYS 38 -5.636 -5.810 -8.602 285 HD3 LYS 38 2HD LYS 38 -6.973 -5.439 -9.694 286 HE2 LYS 38 1HE LYS 38 -8.293 -7.115 -8.865 287 HE3 LYS 38 2HE LYS 38 -6.918 -8.114 -8.397 288 HZ1 LYS 38 3HZ LYS 38 -6.612 -6.928 -6.452 289 HZ2 LYS 38 1HZ LYS 38 -8.299 -6.986 -6.574 290 HZ3 LYS 38 2HZ LYS 38 -7.468 -5.576 -7.002 291 H SER 39 H SER 39 -8.444 -5.094 -12.853 292 HA SER 39 HA SER 39 -9.293 -6.497 -15.271 293 HB2 SER 39 1HB SER 39 -11.309 -5.987 -13.782 294 HB3 SER 39 2HB SER 39 -11.000 -4.286 -14.128 295 HG SER 39 HG SER 39 -11.564 -6.333 -16.011 296 H SER 40 H SER 40 -6.913 -5.187 -14.930 297 HA SER 40 HA SER 40 -5.559 -3.654 -15.926 298 HB2 SER 40 1HB SER 40 -7.618 -2.514 -17.701 299 HB3 SER 40 2HB SER 40 -6.038 -3.192 -18.094 300 HG SER 40 HG SER 40 -8.520 -4.414 -17.979 301 H SER 41 H SER 41 -7.737 -2.948 -13.819 302 HA SER 41 HA SER 41 -7.594 -0.024 -14.129 303 HB2 SER 41 1HB SER 41 -9.880 -0.795 -13.967 304 HB3 SER 41 2HB SER 41 -9.504 -1.738 -12.525 305 HG SER 41 HG SER 41 -10.380 0.128 -11.784 306 H GLN 42 H GLN 42 -6.373 -2.648 -12.383 307 HA GLN 42 HA GLN 42 -5.296 -0.821 -10.341 308 HB2 GLN 42 1HB GLN 42 -5.989 -3.721 -9.864 309 HB3 GLN 42 2HB GLN 42 -5.440 -2.551 -8.671 310 HG2 GLN 42 1HG GLN 42 -7.552 -2.100 -8.212 311 HG3 GLN 42 2HG GLN 42 -7.728 -1.437 -9.836 312 HE21 GLN 42 2HE2 GLN 42 -7.770 -3.456 -11.487 313 HE22 GLN 42 1HE2 GLN 42 -9.023 -4.586 -11.118 314 H LEU 43 H LEU 43 -4.589 -2.701 -12.927 315 HA LEU 43 HA LEU 43 -2.370 -4.215 -12.209 316 HB2 LEU 43 1HB LEU 43 -3.228 -2.868 -14.732 317 HB3 LEU 43 2HB LEU 43 -1.639 -3.625 -14.645 318 HG LEU 43 HG LEU 43 -3.671 -4.938 -15.612 319 HD11 LEU 43 1HD1 LEU 43 -1.369 -5.789 -15.174 320 HD12 LEU 43 2HD1 LEU 43 -2.639 -6.997 -14.982 321 HD13 LEU 43 3HD1 LEU 43 -1.905 -6.257 -13.560 322 HD21 LEU 43 3HD2 LEU 43 -5.147 -4.524 -13.694 323 HD22 LEU 43 1HD2 LEU 43 -4.030 -5.407 -12.653 324 HD23 LEU 43 2HD2 LEU 43 -4.872 -6.247 -13.956 325 H LYS 44 H LYS 44 -2.608 -0.793 -13.045 326 HA LYS 44 HA LYS 44 0.258 -0.447 -12.582 327 HB2 LYS 44 1HB LYS 44 -0.141 1.872 -13.393 328 HB3 LYS 44 2HB LYS 44 -0.585 0.635 -14.562 329 HG2 LYS 44 1HG LYS 44 -2.330 2.157 -14.682 330 HG3 LYS 44 2HG LYS 44 -2.962 0.889 -13.628 331 HD2 LYS 44 1HD LYS 44 -3.263 2.353 -11.981 332 HD3 LYS 44 2HD LYS 44 -1.570 2.845 -12.061 333 HE2 LYS 44 1HE LYS 44 -2.270 4.267 -14.069 334 HE3 LYS 44 2HE LYS 44 -3.927 3.981 -13.537 335 HZ1 LYS 44 3HZ LYS 44 -2.973 6.067 -12.681 336 HZ2 LYS 44 1HZ LYS 44 -1.803 5.178 -11.842 337 HZ3 LYS 44 2HZ LYS 44 -3.438 5.011 -11.444 338 H GLU 45 H GLU 45 -2.650 -0.257 -10.902 339 HA GLU 45 HA GLU 45 -2.363 1.960 -9.257 340 HB2 GLU 45 1HB GLU 45 -3.779 -0.626 -9.093 341 HB3 GLU 45 2HB GLU 45 -3.477 0.165 -7.553 342 HG2 GLU 45 1HG GLU 45 -4.895 1.391 -9.908 343 HG3 GLU 45 2HG GLU 45 -5.664 0.744 -8.459 344 H ILE 46 H ILE 46 -1.078 -1.320 -8.828 345 HA ILE 46 HA ILE 46 0.325 -0.559 -6.412 346 HB ILE 46 HB ILE 46 0.721 -3.143 -7.895 347 HG12 ILE 46 1HG1 ILE 46 -1.156 -3.712 -5.973 348 HG13 ILE 46 2HG1 ILE 46 -1.703 -2.148 -6.568 349 HG21 ILE 46 1HG2 ILE 46 0.744 -2.542 -4.943 350 HG22 ILE 46 2HG2 ILE 46 1.269 -4.024 -5.741 351 HG23 ILE 46 3HG2 ILE 46 2.181 -2.531 -5.965 352 HD11 ILE 46 3HD1 ILE 46 -1.793 -4.769 -7.827 353 HD12 ILE 46 1HD1 ILE 46 -2.757 -3.325 -8.133 354 HD13 ILE 46 2HD1 ILE 46 -1.170 -3.500 -8.881 355 H PHE 47 H PHE 47 0.974 -0.835 -9.799 356 HA PHE 47 HA PHE 47 2.926 -0.768 -11.020 357 HB2 PHE 47 1HB PHE 47 4.270 1.291 -10.445 358 HB3 PHE 47 2HB PHE 47 2.548 1.566 -10.689 359 HD1 PHE 47 HD2 PHE 47 5.269 1.494 -8.254 360 HD2 PHE 47 HD1 PHE 47 1.108 2.170 -8.845 361 HE1 PHE 47 HE2 PHE 47 5.132 2.566 -6.044 362 HE2 PHE 47 HE1 PHE 47 0.965 3.244 -6.636 363 HZ PHE 47 HZ PHE 47 2.979 3.442 -5.232 364 H ARG 48 H ARG 48 3.123 -2.752 -9.062 365 HA ARG 48 HA ARG 48 6.009 -2.683 -8.551 366 HB2 ARG 48 1HB ARG 48 5.862 -3.125 -6.319 367 HB3 ARG 48 2HB ARG 48 4.370 -2.212 -6.501 368 HG2 ARG 48 1HG ARG 48 3.123 -4.313 -6.713 369 HG3 ARG 48 2HG ARG 48 4.625 -5.212 -6.486 370 HD2 ARG 48 1HD ARG 48 2.976 -4.672 -4.474 371 HD3 ARG 48 2HD ARG 48 4.724 -4.754 -4.263 372 HE ARG 48 HE ARG 48 3.071 -2.355 -4.250 373 HH11 ARG 48 1HH1 ARG 48 6.250 -3.774 -4.179 374 HH12 ARG 48 2HH1 ARG 48 7.014 -2.349 -3.557 375 HH21 ARG 48 1HH2 ARG 48 4.066 -0.473 -3.431 376 HH22 ARG 48 2HH2 ARG 48 5.771 -0.472 -3.131 377 H ILE 49 H ILE 49 3.563 -4.151 -10.073 378 HA ILE 49 HA ILE 49 4.737 -6.840 -9.792 379 HB ILE 49 HB ILE 49 2.595 -7.733 -10.627 380 HG12 ILE 49 1HG1 ILE 49 2.069 -5.370 -11.686 381 HG13 ILE 49 2HG1 ILE 49 0.767 -6.435 -11.166 382 HG21 ILE 49 1HG2 ILE 49 2.483 -6.012 -8.159 383 HG22 ILE 49 2HG2 ILE 49 1.254 -7.204 -8.579 384 HG23 ILE 49 3HG2 ILE 49 2.911 -7.719 -8.265 385 HD11 ILE 49 3HD1 ILE 49 0.225 -5.123 -9.380 386 HD12 ILE 49 1HD1 ILE 49 1.852 -4.461 -9.228 387 HD13 ILE 49 2HD1 ILE 49 0.788 -3.901 -10.519 388 H LEU 50 H LEU 50 4.430 -4.195 -11.829 389 HA LEU 50 HA LEU 50 4.662 -5.787 -14.275 390 HB2 LEU 50 1HB LEU 50 4.611 -2.795 -14.164 391 HB3 LEU 50 2HB LEU 50 4.136 -3.862 -15.484 392 HG LEU 50 HG LEU 50 2.586 -3.770 -12.914 393 HD11 LEU 50 1HD1 LEU 50 2.730 -1.478 -13.756 394 HD12 LEU 50 2HD1 LEU 50 1.102 -2.133 -13.928 395 HD13 LEU 50 3HD1 LEU 50 2.161 -2.023 -15.334 396 HD21 LEU 50 3HD2 LEU 50 0.801 -4.279 -14.807 397 HD22 LEU 50 1HD2 LEU 50 1.780 -5.553 -14.079 398 HD23 LEU 50 2HD2 LEU 50 2.233 -4.880 -15.645 399 H ASP 51 H ASP 51 6.226 -2.810 -13.086 400 HA ASP 51 HA ASP 51 8.844 -3.986 -13.615 401 HB2 ASP 51 1HB ASP 51 7.787 -2.560 -15.611 402 HB3 ASP 51 2HB ASP 51 8.438 -1.228 -14.659 403 H ASN 52 H ASN 52 10.521 -2.004 -13.156 404 HA ASN 52 HA ASN 52 9.671 -0.787 -10.613 405 HB2 ASN 52 1HB ASN 52 11.152 -2.759 -10.251 406 HB3 ASN 52 2HB ASN 52 12.405 -1.949 -11.186 407 HD21 ASN 52 2HD2 ASN 52 10.148 -0.859 -8.675 408 HD22 ASN 52 1HD2 ASN 52 11.361 -0.216 -7.627 409 H ASP 53 H ASP 53 10.480 -0.125 -13.662 410 HA ASP 53 HA ASP 53 12.097 2.241 -13.002 411 HB2 ASP 53 1HB ASP 53 12.769 0.479 -14.819 412 HB3 ASP 53 2HB ASP 53 11.585 1.328 -15.811 413 H GLN 54 H GLN 54 9.372 1.259 -15.078 414 HA GLN 54 HA GLN 54 7.510 2.367 -15.767 415 HB2 GLN 54 1HB GLN 54 7.785 3.005 -13.111 416 HB3 GLN 54 2HB GLN 54 7.698 4.592 -13.865 417 HG2 GLN 54 1HG GLN 54 5.500 3.897 -13.205 418 HG3 GLN 54 2HG GLN 54 5.600 3.926 -14.965 419 HE21 GLN 54 2HE2 GLN 54 5.243 1.963 -12.145 420 HE22 GLN 54 1HE2 GLN 54 4.854 0.490 -12.960 421 H SER 55 H SER 55 9.879 2.954 -17.091 422 HA SER 55 HA SER 55 9.686 5.846 -17.606 423 HB2 SER 55 1HB SER 55 11.926 4.927 -16.928 424 HB3 SER 55 2HB SER 55 11.929 3.983 -18.417 425 HG SER 55 HG SER 55 12.815 5.727 -19.203 426 H GLY 56 H GLY 56 8.989 2.774 -18.882 427 HA2 GLY 56 1HA GLY 56 7.577 3.652 -21.078 428 HA3 GLY 56 2HA GLY 56 9.214 3.393 -21.661 429 H PHE 57 H PHE 57 10.150 1.236 -21.327 430 HA PHE 57 HA PHE 57 8.079 -0.858 -21.262 431 HB2 PHE 57 1HB PHE 57 10.547 -0.840 -23.012 432 HB3 PHE 57 2HB PHE 57 9.293 -2.075 -22.986 433 HD1 PHE 57 HD1 PHE 57 9.992 1.450 -23.836 434 HD2 PHE 57 HD2 PHE 57 7.319 -1.837 -24.246 435 HE1 PHE 57 HE1 PHE 57 8.758 2.674 -25.578 436 HE2 PHE 57 HE2 PHE 57 6.082 -0.619 -25.989 437 HZ PHE 57 HZ PHE 57 6.801 1.640 -26.657 438 H ILE 58 H ILE 58 8.960 -3.042 -20.763 439 HA ILE 58 HA ILE 58 10.853 -2.822 -18.553 440 HB ILE 58 HB ILE 58 9.309 -5.281 -19.361 441 HG12 ILE 58 1HG1 ILE 58 8.469 -3.135 -17.399 442 HG13 ILE 58 2HG1 ILE 58 7.769 -3.368 -18.998 443 HG21 ILE 58 1HG2 ILE 58 11.073 -4.522 -17.143 444 HG22 ILE 58 2HG2 ILE 58 9.580 -5.325 -16.659 445 HG23 ILE 58 3HG2 ILE 58 10.679 -6.115 -17.789 446 HD11 ILE 58 3HD1 ILE 58 7.688 -5.835 -17.572 447 HD12 ILE 58 1HD1 ILE 58 7.001 -4.556 -16.573 448 HD13 ILE 58 2HD1 ILE 58 6.356 -4.857 -18.187 449 H GLU 59 H GLU 59 12.605 -4.317 -18.299 450 HA GLU 59 HA GLU 59 13.487 -5.684 -20.734 451 HB2 GLU 59 1HB GLU 59 14.484 -3.295 -20.405 452 HB3 GLU 59 2HB GLU 59 15.465 -4.065 -19.166 453 HG2 GLU 59 1HG GLU 59 16.517 -5.475 -20.725 454 HG3 GLU 59 2HG GLU 59 15.332 -5.104 -21.977 455 H GLU 60 H GLU 60 15.262 -7.212 -20.337 456 HA GLU 60 HA GLU 60 14.736 -8.906 -18.183 457 HB2 GLU 60 1HB GLU 60 16.942 -9.978 -18.803 458 HB3 GLU 60 2HB GLU 60 15.769 -9.836 -20.105 459 HG2 GLU 60 1HG GLU 60 16.940 -8.037 -21.092 460 HG3 GLU 60 2HG GLU 60 17.969 -7.840 -19.675 461 H ASP 61 H ASP 61 16.728 -6.106 -18.393 462 HA ASP 61 HA ASP 61 18.386 -6.729 -16.129 463 HB2 ASP 61 1HB ASP 61 19.116 -5.215 -17.966 464 HB3 ASP 61 2HB ASP 61 17.899 -4.051 -17.448 465 H GLU 62 H GLU 62 15.192 -5.952 -16.398 466 HA GLU 62 HA GLU 62 15.155 -4.757 -13.705 467 HB2 GLU 62 1HB GLU 62 13.516 -4.088 -16.131 468 HB3 GLU 62 2HB GLU 62 12.890 -3.779 -14.517 469 HG2 GLU 62 1HG GLU 62 15.377 -2.627 -15.753 470 HG3 GLU 62 2HG GLU 62 13.883 -1.777 -15.360 471 H LEU 63 H LEU 63 14.993 -7.575 -14.650 472 HA LEU 63 HA LEU 63 12.286 -8.243 -13.708 473 HB2 LEU 63 1HB LEU 63 14.222 -9.960 -15.254 474 HB3 LEU 63 2HB LEU 63 12.578 -10.398 -14.794 475 HG LEU 63 HG LEU 63 13.415 -8.307 -16.798 476 HD11 LEU 63 1HD1 LEU 63 11.530 -10.376 -17.589 477 HD12 LEU 63 2HD1 LEU 63 13.095 -11.021 -17.092 478 HD13 LEU 63 3HD1 LEU 63 13.005 -9.821 -18.381 479 HD21 LEU 63 3HD2 LEU 63 11.501 -7.263 -16.370 480 HD22 LEU 63 1HD2 LEU 63 11.019 -8.503 -15.212 481 HD23 LEU 63 2HD2 LEU 63 10.654 -8.707 -16.926 482 H LYS 64 H LYS 64 15.694 -9.202 -13.444 483 HA LYS 64 HA LYS 64 15.391 -11.116 -11.426 484 HB2 LYS 64 1HB LYS 64 17.762 -9.291 -11.858 485 HB3 LYS 64 2HB LYS 64 17.771 -10.835 -11.016 486 HG2 LYS 64 1HG LYS 64 17.556 -12.052 -12.976 487 HG3 LYS 64 2HG LYS 64 16.918 -10.675 -13.877 488 HD2 LYS 64 1HD LYS 64 19.719 -10.714 -12.787 489 HD3 LYS 64 2HD LYS 64 19.319 -11.381 -14.371 490 HE2 LYS 64 1HE LYS 64 18.657 -9.288 -15.204 491 HE3 LYS 64 2HE LYS 64 18.546 -8.587 -13.591 492 HZ1 LYS 64 3HZ LYS 64 20.516 -7.749 -14.483 493 HZ2 LYS 64 1HZ LYS 64 20.977 -9.238 -15.141 494 HZ3 LYS 64 2HZ LYS 64 21.032 -9.000 -13.468 495 H TYR 65 H TYR 65 16.224 -10.891 -9.163 496 HA TYR 65 HA TYR 65 15.942 -10.054 -7.066 497 HB2 TYR 65 1HB TYR 65 16.346 -7.319 -8.267 498 HB3 TYR 65 2HB TYR 65 16.772 -7.872 -6.652 499 HD1 TYR 65 HD2 TYR 65 17.695 -8.035 -10.217 500 HD2 TYR 65 HD1 TYR 65 18.839 -8.997 -6.234 501 HE1 TYR 65 HE2 TYR 65 19.966 -8.559 -11.002 502 HE2 TYR 65 HE1 TYR 65 21.113 -9.523 -7.007 503 HH TYR 65 HH TYR 65 21.899 -9.843 -10.320 504 H PHE 66 H PHE 66 13.630 -10.181 -8.957 505 HA PHE 66 HA PHE 66 11.913 -7.997 -8.162 506 HB2 PHE 66 1HB PHE 66 11.559 -8.817 -10.370 507 HB3 PHE 66 2HB PHE 66 11.467 -10.484 -9.811 508 HD1 PHE 66 HD2 PHE 66 9.462 -11.324 -8.722 509 HD2 PHE 66 HD1 PHE 66 9.678 -7.334 -10.190 510 HE1 PHE 66 HE2 PHE 66 7.015 -11.134 -8.558 511 HE2 PHE 66 HE1 PHE 66 7.231 -7.138 -10.027 512 HZ PHE 66 HZ PHE 66 5.896 -9.040 -9.211 513 H LEU 67 H LEU 67 12.018 -11.511 -7.612 514 HA LEU 67 HA LEU 67 9.812 -11.785 -5.980 515 HB2 LEU 67 1HB LEU 67 12.388 -13.239 -5.464 516 HB3 LEU 67 2HB LEU 67 10.740 -13.813 -5.219 517 HG LEU 67 HG LEU 67 12.160 -13.427 -7.851 518 HD11 LEU 67 1HD1 LEU 67 12.127 -15.567 -6.070 519 HD12 LEU 67 2HD1 LEU 67 12.643 -15.591 -7.756 520 HD13 LEU 67 3HD1 LEU 67 10.981 -16.006 -7.337 521 HD21 LEU 67 3HD2 LEU 67 10.168 -13.174 -8.798 522 HD22 LEU 67 1HD2 LEU 67 9.357 -13.355 -7.242 523 HD23 LEU 67 2HD2 LEU 67 9.728 -14.780 -8.214 524 H GLN 68 H GLN 68 12.948 -10.454 -5.234 525 HA GLN 68 HA GLN 68 12.928 -10.574 -2.457 526 HB2 GLN 68 1HB GLN 68 14.609 -9.525 -4.329 527 HB3 GLN 68 2HB GLN 68 13.963 -8.063 -3.596 528 HG2 GLN 68 1HG GLN 68 14.796 -8.626 -1.477 529 HG3 GLN 68 2HG GLN 68 15.097 -10.297 -1.950 530 HE21 GLN 68 2HE2 GLN 68 16.441 -10.082 -4.260 531 HE22 GLN 68 1HE2 GLN 68 17.938 -9.254 -4.026 532 H ARG 69 H ARG 69 11.087 -8.593 -4.620 533 HA ARG 69 HA ARG 69 10.410 -6.467 -2.939 534 HB2 ARG 69 1HB ARG 69 9.025 -7.782 -5.256 535 HB3 ARG 69 2HB ARG 69 8.241 -6.484 -4.367 536 HG2 ARG 69 1HG ARG 69 11.010 -6.047 -5.352 537 HG3 ARG 69 2HG ARG 69 9.681 -6.008 -6.512 538 HD2 ARG 69 1HD ARG 69 9.913 -3.785 -5.829 539 HD3 ARG 69 2HD ARG 69 8.553 -4.390 -4.883 540 HE ARG 69 HE ARG 69 9.804 -4.141 -2.974 541 HH11 ARG 69 1HH1 ARG 69 11.866 -3.856 -5.764 542 HH12 ARG 69 2HH1 ARG 69 13.238 -3.312 -4.856 543 HH21 ARG 69 1HH2 ARG 69 11.603 -3.426 -1.768 544 HH22 ARG 69 2HH2 ARG 69 13.088 -3.069 -2.583 545 H PHE 70 H PHE 70 8.452 -9.372 -3.629 546 HA PHE 70 HA PHE 70 6.812 -8.865 -1.297 547 HB2 PHE 70 1HB PHE 70 6.734 -11.207 -3.210 548 HB3 PHE 70 2HB PHE 70 5.490 -10.761 -2.046 549 HD1 PHE 70 HD2 PHE 70 7.175 -9.732 -5.162 550 HD2 PHE 70 HD1 PHE 70 3.869 -9.123 -2.551 551 HE1 PHE 70 HE2 PHE 70 6.093 -8.325 -6.865 552 HE2 PHE 70 HE1 PHE 70 2.781 -7.716 -4.251 553 HZ PHE 70 HZ PHE 70 3.894 -7.315 -6.411 554 H GLU 71 H GLU 71 8.773 -11.619 -2.441 555 HA GLU 71 HA GLU 71 8.674 -13.204 -0.205 556 HB2 GLU 71 1HB GLU 71 9.752 -13.883 -2.300 557 HB3 GLU 71 2HB GLU 71 11.062 -12.750 -2.002 558 HG2 GLU 71 1HG GLU 71 11.858 -14.001 -0.166 559 HG3 GLU 71 2HG GLU 71 10.402 -14.993 -0.120 560 H SER 72 H SER 72 10.867 -10.493 -0.828 561 HA SER 72 HA SER 72 12.161 -9.228 0.550 562 HB2 SER 72 1HB SER 72 9.921 -9.160 1.805 563 HB3 SER 72 2HB SER 72 10.629 -10.357 2.890 564 HG SER 72 HG SER 72 10.868 -8.056 3.478 565 H GLY 73 H GLY 73 12.610 -12.238 0.103 566 HA2 GLY 73 1HA GLY 73 14.755 -12.464 2.112 567 HA3 GLY 73 2HA GLY 73 13.694 -13.830 1.797 568 H ALA 74 H ALA 74 13.506 -13.443 -1.036 569 HA ALA 74 HA ALA 74 15.625 -14.999 -1.927 570 HB1 ALA 74 1HB ALA 74 14.489 -15.042 -3.847 571 HB2 ALA 74 2HB ALA 74 13.287 -14.051 -3.020 572 HB3 ALA 74 3HB ALA 74 14.530 -13.286 -4.010 573 H ARG 75 H ARG 75 17.002 -14.203 -3.924 574 HA ARG 75 HA ARG 75 18.267 -11.640 -3.222 575 HB2 ARG 75 1HB ARG 75 20.379 -13.046 -4.163 576 HB3 ARG 75 2HB ARG 75 19.977 -12.905 -2.457 577 HG2 ARG 75 1HG ARG 75 19.165 -15.046 -2.327 578 HG3 ARG 75 2HG ARG 75 18.777 -15.117 -4.048 579 HD2 ARG 75 1HD ARG 75 20.899 -15.696 -4.642 580 HD3 ARG 75 2HD ARG 75 21.630 -14.816 -3.301 581 HE ARG 75 HE ARG 75 21.585 -16.746 -2.090 582 HH11 ARG 75 1HH1 ARG 75 19.267 -17.005 -4.675 583 HH12 ARG 75 2HH1 ARG 75 18.876 -18.657 -4.333 584 HH21 ARG 75 1HH2 ARG 75 21.079 -18.922 -1.630 585 HH22 ARG 75 2HH2 ARG 75 19.906 -19.747 -2.601 586 H VAL 76 H VAL 76 18.652 -14.161 -5.717 587 HA VAL 76 HA VAL 76 18.048 -12.148 -7.766 588 HB VAL 76 HB VAL 76 20.313 -14.082 -8.163 589 HG11 VAL 76 1HG1 VAL 76 19.914 -13.247 -10.226 590 HG12 VAL 76 2HG1 VAL 76 19.138 -11.788 -9.605 591 HG13 VAL 76 3HG1 VAL 76 20.897 -11.911 -9.629 592 HG21 VAL 76 3HG2 VAL 76 21.323 -12.981 -6.452 593 HG22 VAL 76 1HG2 VAL 76 21.646 -11.809 -7.729 594 HG23 VAL 76 2HG2 VAL 76 20.299 -11.555 -6.619 595 H LEU 77 H LEU 77 17.564 -13.102 -9.886 596 HA LEU 77 HA LEU 77 16.221 -15.693 -9.560 597 HB2 LEU 77 1HB LEU 77 15.745 -13.321 -11.318 598 HB3 LEU 77 2HB LEU 77 15.127 -14.904 -11.784 599 HG LEU 77 HG LEU 77 14.447 -14.069 -9.049 600 HD11 LEU 77 1HD1 LEU 77 12.491 -12.736 -10.313 601 HD12 LEU 77 2HD1 LEU 77 13.845 -12.370 -11.382 602 HD13 LEU 77 3HD1 LEU 77 13.939 -11.962 -9.669 603 HD21 LEU 77 3HD2 LEU 77 12.913 -15.200 -11.386 604 HD22 LEU 77 1HD2 LEU 77 12.240 -14.920 -9.779 605 HD23 LEU 77 2HD2 LEU 77 13.542 -16.090 -9.998 606 H THR 78 H THR 78 15.931 -16.655 -11.996 607 HA THR 78 HA THR 78 18.690 -17.113 -12.901 608 HB THR 78 HB THR 78 17.831 -19.200 -13.914 609 HG1 THR 78 HG1 THR 78 15.681 -19.836 -13.347 610 HG21 THR 78 3HG2 THR 78 17.579 -20.435 -11.870 611 HG22 THR 78 1HG2 THR 78 17.068 -18.988 -11.001 612 HG23 THR 78 2HG2 THR 78 18.727 -19.128 -11.582 613 H ALA 79 H ALA 79 18.495 -18.053 -15.347 614 HA ALA 79 HA ALA 79 17.665 -15.749 -16.892 615 HB1 ALA 79 1HB ALA 79 19.845 -16.908 -17.255 616 HB2 ALA 79 2HB ALA 79 18.946 -18.288 -17.888 617 HB3 ALA 79 3HB ALA 79 18.866 -16.731 -18.712 618 H SER 80 H SER 80 15.993 -18.249 -15.734 619 HA SER 80 HA SER 80 14.429 -18.698 -18.183 620 HB2 SER 80 1HB SER 80 14.918 -20.307 -15.720 621 HB3 SER 80 2HB SER 80 13.356 -20.483 -16.518 622 HG SER 80 HG SER 80 15.615 -21.627 -17.188 623 H GLU 81 H GLU 81 13.884 -18.255 -14.683 624 HA GLU 81 HA GLU 81 11.174 -17.700 -14.780 625 HB2 GLU 81 1HB GLU 81 13.341 -16.809 -12.893 626 HB3 GLU 81 2HB GLU 81 11.669 -16.315 -12.663 627 HG2 GLU 81 1HG GLU 81 10.954 -18.492 -12.245 628 HG3 GLU 81 2HG GLU 81 12.405 -19.202 -12.952 629 H THR 82 H THR 82 13.901 -15.438 -15.006 630 HA THR 82 HA THR 82 12.272 -13.122 -15.291 631 HB THR 82 HB THR 82 14.405 -12.047 -16.119 632 HG1 THR 82 HG1 THR 82 15.841 -13.441 -16.808 633 HG21 THR 82 3HG2 THR 82 15.341 -13.273 -13.666 634 HG22 THR 82 1HG2 THR 82 13.639 -12.823 -13.560 635 HG23 THR 82 2HG2 THR 82 14.848 -11.608 -13.973 636 H LYS 83 H LYS 83 14.057 -15.147 -17.599 637 HA LYS 83 HA LYS 83 13.549 -13.713 -19.920 638 HB2 LYS 83 1HB LYS 83 15.107 -15.553 -19.919 639 HB3 LYS 83 2HB LYS 83 13.833 -16.693 -19.507 640 HG2 LYS 83 1HG LYS 83 14.387 -16.905 -21.836 641 HG3 LYS 83 2HG LYS 83 12.761 -16.238 -21.678 642 HD2 LYS 83 1HD LYS 83 13.719 -13.970 -22.010 643 HD3 LYS 83 2HD LYS 83 15.292 -14.717 -22.301 644 HE2 LYS 83 1HE LYS 83 12.917 -15.591 -23.888 645 HE3 LYS 83 2HE LYS 83 13.740 -14.089 -24.306 646 HZ1 LYS 83 3HZ LYS 83 15.700 -15.216 -24.800 647 HZ2 LYS 83 1HZ LYS 83 14.498 -16.211 -25.455 648 HZ3 LYS 83 2HZ LYS 83 15.228 -16.621 -23.985 649 H THR 84 H THR 84 11.412 -15.612 -17.997 650 HA THR 84 HA THR 84 9.369 -15.571 -20.111 651 HB THR 84 HB THR 84 9.882 -17.767 -19.013 652 HG1 THR 84 HG1 THR 84 7.886 -17.657 -19.931 653 HG21 THR 84 3HG2 THR 84 10.303 -17.076 -16.753 654 HG22 THR 84 1HG2 THR 84 8.879 -18.116 -16.747 655 HG23 THR 84 2HG2 THR 84 8.694 -16.367 -16.617 656 H PHE 85 H PHE 85 10.212 -13.283 -18.389 657 HA PHE 85 HA PHE 85 7.738 -12.816 -16.879 658 HB2 PHE 85 1HB PHE 85 10.368 -12.359 -16.187 659 HB3 PHE 85 2HB PHE 85 9.817 -10.764 -16.688 660 HD1 PHE 85 HD2 PHE 85 8.398 -13.613 -14.733 661 HD2 PHE 85 HD1 PHE 85 9.139 -9.428 -14.964 662 HE1 PHE 85 HE2 PHE 85 7.317 -13.305 -12.544 663 HE2 PHE 85 HE1 PHE 85 8.060 -9.113 -12.775 664 HZ PHE 85 HZ PHE 85 7.146 -11.052 -11.563 665 H LEU 86 H LEU 86 9.782 -11.454 -19.411 666 HA LEU 86 HA LEU 86 7.600 -9.590 -20.082 667 HB2 LEU 86 1HB LEU 86 9.421 -8.286 -21.256 668 HB3 LEU 86 2HB LEU 86 9.451 -8.279 -19.494 669 HG LEU 86 HG LEU 86 11.213 -10.095 -19.654 670 HD11 LEU 86 1HD1 LEU 86 10.611 -9.741 -22.449 671 HD12 LEU 86 2HD1 LEU 86 11.580 -10.981 -21.655 672 HD13 LEU 86 3HD1 LEU 86 12.320 -9.452 -22.127 673 HD21 LEU 86 3HD2 LEU 86 12.147 -8.124 -19.003 674 HD22 LEU 86 1HD2 LEU 86 11.518 -7.238 -20.392 675 HD23 LEU 86 2HD2 LEU 86 12.924 -8.287 -20.578 676 H ALA 87 H ALA 87 9.541 -12.204 -21.140 677 HA ALA 87 HA ALA 87 9.029 -11.789 -23.961 678 HB1 ALA 87 1HB ALA 87 11.099 -12.912 -22.835 679 HB2 ALA 87 2HB ALA 87 10.083 -14.354 -22.859 680 HB3 ALA 87 3HB ALA 87 10.479 -13.529 -24.367 681 H ALA 88 H ALA 88 7.432 -13.216 -21.321 682 HA ALA 88 HA ALA 88 6.103 -15.368 -22.528 683 HB1 ALA 88 1HB ALA 88 5.289 -13.579 -20.246 684 HB2 ALA 88 2HB ALA 88 4.403 -15.029 -20.722 685 HB3 ALA 88 3HB ALA 88 6.068 -15.159 -20.154 686 H ALA 89 H ALA 89 5.177 -11.953 -22.233 687 HA ALA 89 HA ALA 89 2.643 -12.029 -23.307 688 HB1 ALA 89 1HB ALA 89 3.401 -9.987 -22.408 689 HB2 ALA 89 2HB ALA 89 4.784 -9.928 -23.502 690 HB3 ALA 89 3HB ALA 89 3.153 -9.687 -24.128 691 H ASP 90 H ASP 90 5.336 -10.821 -25.279 692 HA ASP 90 HA ASP 90 5.177 -12.685 -27.350 693 HB2 ASP 90 1HB ASP 90 3.027 -10.755 -27.349 694 HB3 ASP 90 2HB ASP 90 4.018 -10.573 -28.795 695 H HIS 91 H HIS 91 5.858 -11.421 -29.564 696 HA HIS 91 HA HIS 91 8.000 -9.550 -28.796 697 HB2 HIS 91 1HB HIS 91 8.677 -11.975 -29.419 698 HB3 HIS 91 2HB HIS 91 8.300 -11.493 -31.071 699 HD1 HIS 91 HD1 HIS 91 9.995 -10.060 -32.284 700 HD2 HIS 91 HD2 HIS 91 10.901 -10.596 -28.265 701 HE1 HIS 91 HE1 HIS 91 12.323 -9.155 -31.994 702 H ASP 92 H ASP 92 5.618 -8.527 -29.544 703 HA ASP 92 HA ASP 92 5.081 -8.153 -32.233 704 HB2 ASP 92 1HB ASP 92 3.522 -7.377 -30.579 705 HB3 ASP 92 2HB ASP 92 4.711 -6.268 -29.901 706 H GLY 93 H GLY 93 7.520 -6.654 -30.216 707 HA2 GLY 93 1HA GLY 93 8.568 -5.310 -32.626 708 HA3 GLY 93 2HA GLY 93 8.498 -4.475 -31.081 709 H ASP 94 H ASP 94 9.649 -5.646 -29.253 710 HA ASP 94 HA ASP 94 11.918 -7.250 -30.122 711 HB2 ASP 94 1HB ASP 94 12.503 -4.753 -30.256 712 HB3 ASP 94 2HB ASP 94 12.430 -4.766 -28.496 713 H GLY 95 H GLY 95 9.544 -7.656 -28.449 714 HA2 GLY 95 1HA GLY 95 9.043 -8.795 -26.518 715 HA3 GLY 95 2HA GLY 95 10.768 -9.060 -26.319 716 H LYS 96 H LYS 96 9.296 -5.885 -26.525 717 HA LYS 96 HA LYS 96 10.121 -5.406 -23.742 718 HB2 LYS 96 1HB LYS 96 9.705 -2.920 -24.745 719 HB3 LYS 96 2HB LYS 96 11.258 -3.745 -24.767 720 HG2 LYS 96 1HG LYS 96 10.897 -2.860 -26.934 721 HG3 LYS 96 2HG LYS 96 10.669 -4.607 -27.042 722 HD2 LYS 96 1HD LYS 96 8.267 -4.335 -26.997 723 HD3 LYS 96 2HD LYS 96 8.438 -2.596 -26.749 724 HE2 LYS 96 1HE LYS 96 9.834 -3.679 -29.102 725 HE3 LYS 96 2HE LYS 96 8.075 -3.772 -29.163 726 HZ1 LYS 96 3HZ LYS 96 9.760 -1.356 -28.869 727 HZ2 LYS 96 1HZ LYS 96 8.101 -1.346 -28.539 728 HZ3 LYS 96 2HZ LYS 96 8.651 -1.712 -30.095 729 H ILE 97 H ILE 97 8.369 -5.829 -22.511 730 HA ILE 97 HA ILE 97 5.709 -5.097 -23.336 731 HB ILE 97 HB ILE 97 6.718 -6.146 -20.689 732 HG12 ILE 97 1HG1 ILE 97 5.393 -7.497 -23.048 733 HG13 ILE 97 2HG1 ILE 97 7.028 -7.768 -22.456 734 HG21 ILE 97 1HG2 ILE 97 4.370 -6.625 -20.193 735 HG22 ILE 97 2HG2 ILE 97 4.645 -4.898 -20.417 736 HG23 ILE 97 3HG2 ILE 97 3.893 -5.845 -21.701 737 HD11 ILE 97 3HD1 ILE 97 5.932 -8.534 -20.290 738 HD12 ILE 97 1HD1 ILE 97 4.430 -8.587 -21.213 739 HD13 ILE 97 2HD1 ILE 97 5.797 -9.594 -21.692 740 H GLY 98 H GLY 98 4.391 -3.510 -22.458 741 HA2 GLY 98 1HA GLY 98 5.741 -1.533 -20.728 742 HA3 GLY 98 2HA GLY 98 4.810 -1.039 -22.134 743 H ALA 99 H ALA 99 2.559 -1.115 -22.071 744 HA ALA 99 HA ALA 99 1.295 -1.929 -19.564 745 HB1 ALA 99 1HB ALA 99 1.586 0.844 -20.505 746 HB2 ALA 99 2HB ALA 99 -0.031 0.388 -19.967 747 HB3 ALA 99 3HB ALA 99 1.344 0.214 -18.876 748 H GLU 100 H GLU 100 1.379 -2.456 -22.650 749 HA GLU 100 HA GLU 100 -1.548 -2.616 -22.946 750 HB2 GLU 100 1HB GLU 100 -1.197 -2.381 -25.403 751 HB3 GLU 100 2HB GLU 100 -0.769 -0.943 -24.485 752 HG2 GLU 100 1HG GLU 100 1.342 -2.937 -25.156 753 HG3 GLU 100 2HG GLU 100 0.782 -1.807 -26.387 754 H GLU 101 H GLU 101 1.383 -4.261 -22.799 755 HA GLU 101 HA GLU 101 0.262 -6.614 -24.165 756 HB2 GLU 101 1HB GLU 101 3.128 -5.919 -23.504 757 HB3 GLU 101 2HB GLU 101 2.616 -7.448 -24.202 758 HG2 GLU 101 1HG GLU 101 1.819 -6.324 -26.183 759 HG3 GLU 101 2HG GLU 101 2.201 -4.755 -25.478 760 H PHE 102 H PHE 102 1.447 -5.369 -21.150 761 HA PHE 102 HA PHE 102 1.737 -7.883 -19.832 762 HB2 PHE 102 1HB PHE 102 2.823 -5.697 -19.145 763 HB3 PHE 102 2HB PHE 102 1.253 -5.210 -18.515 764 HD1 PHE 102 HD1 PHE 102 0.148 -6.928 -16.861 765 HD2 PHE 102 HD2 PHE 102 4.310 -6.727 -17.729 766 HE1 PHE 102 HE1 PHE 102 0.642 -8.071 -14.739 767 HE2 PHE 102 HE2 PHE 102 4.811 -7.870 -15.609 768 HZ PHE 102 HZ PHE 102 2.976 -8.545 -14.111 769 H GLN 103 H GLN 103 -0.863 -5.536 -20.162 770 HA GLN 103 HA GLN 103 -2.600 -6.633 -18.231 771 HB2 GLN 103 1HB GLN 103 -2.982 -4.861 -20.619 772 HB3 GLN 103 2HB GLN 103 -4.379 -5.477 -19.747 773 HG2 GLN 103 1HG GLN 103 -3.581 -3.192 -19.079 774 HG3 GLN 103 2HG GLN 103 -3.767 -4.358 -17.769 775 HE21 GLN 103 2HE2 GLN 103 -1.257 -3.442 -20.112 776 HE22 GLN 103 1HE2 GLN 103 0.028 -3.363 -18.960 777 H GLU 104 H GLU 104 -2.044 -7.363 -21.621 778 HA GLU 104 HA GLU 104 -4.295 -9.122 -21.860 779 HB2 GLU 104 1HB GLU 104 -1.931 -8.463 -23.582 780 HB3 GLU 104 2HB GLU 104 -2.937 -9.852 -23.968 781 HG2 GLU 104 1HG GLU 104 -4.211 -7.197 -23.513 782 HG3 GLU 104 2HG GLU 104 -3.414 -7.535 -25.049 783 H MET 105 H MET 105 -1.254 -9.390 -20.434 784 HA MET 105 HA MET 105 -0.971 -12.244 -20.877 785 HB2 MET 105 1HB MET 105 1.119 -11.245 -20.801 786 HB3 MET 105 2HB MET 105 0.656 -10.134 -19.518 787 HG2 MET 105 1HG MET 105 1.023 -11.672 -17.861 788 HG3 MET 105 2HG MET 105 0.751 -13.047 -18.929 789 HE1 MET 105 3HE MET 105 3.180 -9.939 -18.513 790 HE2 MET 105 1HE MET 105 4.525 -10.481 -19.517 791 HE3 MET 105 2HE MET 105 2.950 -10.171 -20.247 792 H VAL 106 H VAL 106 -2.238 -10.074 -18.490 793 HA VAL 106 HA VAL 106 -2.651 -12.326 -16.638 794 HB VAL 106 HB VAL 106 -2.715 -9.362 -16.053 795 HG11 VAL 106 1HG1 VAL 106 -2.942 -11.702 -14.163 796 HG12 VAL 106 2HG1 VAL 106 -2.952 -9.992 -13.725 797 HG13 VAL 106 3HG1 VAL 106 -4.278 -10.669 -14.670 798 HG21 VAL 106 3HG2 VAL 106 -0.469 -9.761 -16.218 799 HG22 VAL 106 1HG2 VAL 106 -0.731 -10.226 -14.537 800 HG23 VAL 106 2HG2 VAL 106 -0.627 -11.464 -15.789 801 H GLN 107 H GLN 107 -4.276 -9.287 -17.573 802 HA GLN 107 HA GLN 107 -6.817 -9.962 -16.678 803 HB2 GLN 107 1HB GLN 107 -6.268 -8.273 -19.117 804 HB3 GLN 107 2HB GLN 107 -7.641 -8.166 -18.023 805 HG2 GLN 107 1HG GLN 107 -4.866 -7.174 -17.693 806 HG3 GLN 107 2HG GLN 107 -6.400 -6.401 -17.300 807 HE21 GLN 107 2HE2 GLN 107 -7.618 -7.444 -15.484 808 HE22 GLN 107 1HE2 GLN 107 -6.697 -7.980 -14.124 809 H SER 108 H SER 108 -5.302 -10.549 -19.821 810 HA SER 108 HA SER 108 -7.457 -12.466 -20.406 811 HB2 SER 108 1HB SER 108 -7.787 -10.448 -21.775 812 HB3 SER 108 2HB SER 108 -6.144 -10.601 -22.399 813 HG SER 108 HG SER 108 -8.179 -11.588 -23.527 Start of MODEL 14 1 H1 SER 1 H SER 1 4.747 0.235 -0.025 2 HA SER 1 HA SER 1 2.359 -0.477 1.296 3 HB2 SER 1 1HB SER 1 1.804 0.944 -1.299 4 HB3 SER 1 2HB SER 1 0.668 0.474 -0.035 5 HG SER 1 HG SER 1 1.884 2.792 -0.323 6 H LEU 2 H LEU 2 2.586 -2.589 0.937 7 HA LEU 2 HA LEU 2 2.888 -3.491 -1.851 8 HB2 LEU 2 1HB LEU 2 4.941 -3.812 -0.473 9 HB3 LEU 2 2HB LEU 2 4.007 -4.870 0.583 10 HG LEU 2 HG LEU 2 3.631 -6.374 -1.371 11 HD11 LEU 2 1HD1 LEU 2 4.601 -4.195 -2.819 12 HD12 LEU 2 2HD1 LEU 2 4.218 -5.803 -3.433 13 HD13 LEU 2 3HD1 LEU 2 5.862 -5.424 -2.921 14 HD21 LEU 2 3HD2 LEU 2 6.121 -5.883 0.050 15 HD22 LEU 2 1HD2 LEU 2 6.361 -6.713 -1.488 16 HD23 LEU 2 2HD2 LEU 2 5.281 -7.400 -0.275 17 H THR 3 H THR 3 1.901 -5.521 -2.364 18 HA THR 3 HA THR 3 0.057 -6.865 -2.445 19 HB THR 3 HB THR 3 -0.257 -8.332 -0.616 20 HG1 THR 3 HG1 THR 3 -0.597 -6.954 1.091 21 HG21 THR 3 3HG2 THR 3 2.565 -7.591 -0.031 22 HG22 THR 3 1HG2 THR 3 2.152 -8.040 -1.685 23 HG23 THR 3 2HG2 THR 3 1.859 -9.172 -0.364 24 H ASP 4 H ASP 4 -0.462 -4.047 -2.054 25 HA ASP 4 HA ASP 4 -2.577 -3.751 -0.148 26 HB2 ASP 4 1HB ASP 4 -1.264 -1.814 -0.773 27 HB3 ASP 4 2HB ASP 4 -1.709 -2.012 -2.466 28 H ILE 5 H ILE 5 -2.795 -3.160 -3.645 29 HA ILE 5 HA ILE 5 -5.558 -3.642 -3.777 30 HB ILE 5 HB ILE 5 -3.832 -2.529 -5.487 31 HG12 ILE 5 1HG1 ILE 5 -6.000 -3.626 -7.052 32 HG13 ILE 5 2HG1 ILE 5 -6.569 -3.164 -5.451 33 HG21 ILE 5 1HG2 ILE 5 -2.837 -4.755 -6.016 34 HG22 ILE 5 2HG2 ILE 5 -4.377 -5.212 -6.743 35 HG23 ILE 5 3HG2 ILE 5 -3.442 -3.880 -7.422 36 HD11 ILE 5 3HD1 ILE 5 -6.871 -1.315 -6.911 37 HD12 ILE 5 1HD1 ILE 5 -5.544 -0.925 -5.818 38 HD13 ILE 5 2HD1 ILE 5 -5.204 -1.416 -7.478 39 H LEU 6 H LEU 6 -2.846 -5.784 -3.856 40 HA LEU 6 HA LEU 6 -4.438 -7.996 -4.895 41 HB2 LEU 6 1HB LEU 6 -1.678 -7.325 -4.873 42 HB3 LEU 6 2HB LEU 6 -1.876 -8.843 -4.000 43 HG LEU 6 HG LEU 6 -3.259 -8.689 -6.597 44 HD11 LEU 6 1HD1 LEU 6 -0.807 -9.417 -7.474 45 HD12 LEU 6 2HD1 LEU 6 -0.384 -8.146 -6.327 46 HD13 LEU 6 3HD1 LEU 6 -1.489 -7.801 -7.657 47 HD21 LEU 6 3HD2 LEU 6 -3.305 -10.743 -5.408 48 HD22 LEU 6 1HD2 LEU 6 -1.562 -10.704 -5.139 49 HD23 LEU 6 2HD2 LEU 6 -2.197 -10.965 -6.764 50 H SER 7 H SER 7 -3.455 -10.149 -3.569 51 HA SER 7 HA SER 7 -4.520 -9.744 -0.858 52 HB2 SER 7 1HB SER 7 -5.568 -11.409 -2.573 53 HB3 SER 7 2HB SER 7 -4.206 -12.442 -2.140 54 HG SER 7 HG SER 7 -4.907 -12.114 0.092 55 HA PRO 8 HA PRO 8 -0.318 -10.389 0.500 56 HB2 PRO 8 1HB PRO 8 -0.855 -10.117 3.148 57 HB3 PRO 8 2HB PRO 8 -0.726 -8.740 2.048 58 HG2 PRO 8 1HG PRO 8 -3.175 -10.123 3.070 59 HG3 PRO 8 2HG PRO 8 -2.864 -8.387 2.889 60 HD2 PRO 8 1HD PRO 8 -4.329 -9.799 1.102 61 HD3 PRO 8 2HD PRO 8 -3.326 -8.412 0.631 62 H SER 9 H SER 9 -3.151 -12.176 1.453 63 HA SER 9 HA SER 9 -1.540 -14.267 2.709 64 HB2 SER 9 1HB SER 9 -3.757 -13.378 3.674 65 HB3 SER 9 2HB SER 9 -4.537 -14.311 2.397 66 HG SER 9 HG SER 9 -3.949 -15.249 4.667 67 H ASP 10 H ASP 10 -1.430 -13.733 -0.174 68 HA ASP 10 HA ASP 10 -2.057 -16.447 -1.075 69 HB2 ASP 10 1HB ASP 10 -2.893 -13.908 -2.481 70 HB3 ASP 10 2HB ASP 10 -2.839 -15.478 -3.278 71 H ILE 11 H ILE 11 -0.492 -13.363 -1.887 72 HA ILE 11 HA ILE 11 1.211 -14.264 -3.887 73 HB ILE 11 HB ILE 11 1.773 -12.123 -1.831 74 HG12 ILE 11 1HG1 ILE 11 0.908 -11.526 -4.619 75 HG13 ILE 11 2HG1 ILE 11 -0.315 -12.104 -3.493 76 HG21 ILE 11 1HG2 ILE 11 3.332 -13.173 -4.036 77 HG22 ILE 11 2HG2 ILE 11 3.020 -11.447 -4.208 78 HG23 ILE 11 3HG2 ILE 11 3.801 -12.061 -2.751 79 HD11 ILE 11 3HD1 ILE 11 -0.085 -10.247 -2.109 80 HD12 ILE 11 1HD1 ILE 11 1.476 -9.808 -2.802 81 HD13 ILE 11 2HD1 ILE 11 -0.001 -9.585 -3.741 82 H ALA 12 H ALA 12 1.351 -14.756 -0.465 83 HA ALA 12 HA ALA 12 4.132 -15.531 -0.433 84 HB1 ALA 12 1HB ALA 12 3.931 -15.724 1.856 85 HB2 ALA 12 2HB ALA 12 2.709 -14.505 1.491 86 HB3 ALA 12 3HB ALA 12 2.228 -16.178 1.775 87 H ALA 13 H ALA 13 1.060 -17.063 -0.889 88 HA ALA 13 HA ALA 13 1.866 -19.719 -0.250 89 HB1 ALA 13 1HB ALA 13 -0.403 -18.825 -2.024 90 HB2 ALA 13 2HB ALA 13 -0.214 -20.407 -1.267 91 HB3 ALA 13 3HB ALA 13 -0.489 -18.980 -0.269 92 H ALA 14 H ALA 14 2.473 -17.674 -2.898 93 HA ALA 14 HA ALA 14 3.020 -19.913 -4.707 94 HB1 ALA 14 1HB ALA 14 1.753 -17.720 -5.339 95 HB2 ALA 14 2HB ALA 14 3.381 -17.058 -5.495 96 HB3 ALA 14 3HB ALA 14 2.895 -18.443 -6.473 97 H LEU 15 H LEU 15 4.601 -17.256 -3.022 98 HA LEU 15 HA LEU 15 7.132 -17.442 -4.197 99 HB2 LEU 15 1HB LEU 15 6.221 -16.545 -1.480 100 HB3 LEU 15 2HB LEU 15 7.915 -16.491 -1.963 101 HG LEU 15 HG LEU 15 5.643 -14.984 -3.256 102 HD11 LEU 15 1HD1 LEU 15 6.955 -13.014 -2.411 103 HD12 LEU 15 2HD1 LEU 15 7.890 -14.149 -1.439 104 HD13 LEU 15 3HD1 LEU 15 6.156 -13.980 -1.170 105 HD21 LEU 15 3HD2 LEU 15 7.285 -15.603 -4.916 106 HD22 LEU 15 1HD2 LEU 15 8.593 -15.031 -3.881 107 HD23 LEU 15 2HD2 LEU 15 7.433 -13.884 -4.551 108 H ARG 16 H ARG 16 5.582 -19.381 -1.754 109 HA ARG 16 HA ARG 16 8.068 -20.774 -1.126 110 HB2 ARG 16 1HB ARG 16 6.706 -20.289 0.779 111 HB3 ARG 16 2HB ARG 16 5.277 -20.956 0.003 112 HG2 ARG 16 1HG ARG 16 7.552 -22.801 0.335 113 HG3 ARG 16 2HG ARG 16 6.738 -22.282 1.812 114 HD2 ARG 16 1HD ARG 16 5.052 -23.154 -0.471 115 HD3 ARG 16 2HD ARG 16 5.935 -24.394 0.419 116 HE ARG 16 HE ARG 16 4.628 -22.760 2.269 117 HH11 ARG 16 1HH1 ARG 16 3.859 -25.043 -0.245 118 HH12 ARG 16 2HH1 ARG 16 2.376 -25.552 0.492 119 HH21 ARG 16 1HH2 ARG 16 2.677 -23.422 3.248 120 HH22 ARG 16 2HH2 ARG 16 1.704 -24.629 2.478 121 H ASP 17 H ASP 17 5.248 -21.109 -3.069 122 HA ASP 17 HA ASP 17 5.688 -23.971 -3.468 123 HB2 ASP 17 1HB ASP 17 3.371 -23.014 -3.159 124 HB3 ASP 17 2HB ASP 17 3.560 -22.235 -4.727 125 H CYS 18 H CYS 18 7.447 -21.692 -4.453 126 HA CYS 18 HA CYS 18 7.623 -22.649 -7.223 127 HB2 CYS 18 1HB CYS 18 7.957 -20.460 -8.099 128 HB3 CYS 18 2HB CYS 18 6.516 -20.378 -7.092 129 HG CYS 18 HG CYS 18 9.072 -18.443 -6.997 130 H GLN 19 H GLN 19 9.069 -23.000 -4.547 131 HA GLN 19 HA GLN 19 11.617 -21.841 -4.709 132 HB2 GLN 19 1HB GLN 19 10.566 -24.318 -3.370 133 HB3 GLN 19 2HB GLN 19 12.275 -23.909 -3.304 134 HG2 GLN 19 1HG GLN 19 11.802 -21.846 -2.187 135 HG3 GLN 19 2HG GLN 19 10.067 -22.080 -2.396 136 HE21 GLN 19 2HE2 GLN 19 9.601 -22.028 -0.228 137 HE22 GLN 19 1HE2 GLN 19 10.064 -23.282 0.866 138 H ALA 20 H ALA 20 10.174 -24.336 -6.542 139 HA ALA 20 HA ALA 20 12.576 -25.706 -7.284 140 HB1 ALA 20 1HB ALA 20 11.227 -27.144 -8.375 141 HB2 ALA 20 2HB ALA 20 9.963 -26.350 -7.435 142 HB3 ALA 20 3HB ALA 20 10.263 -25.857 -9.101 143 HA PRO 21 HA PRO 21 14.096 -23.195 -10.546 144 HB2 PRO 21 1HB PRO 21 14.940 -25.049 -12.340 145 HB3 PRO 21 2HB PRO 21 15.775 -24.740 -10.813 146 HG2 PRO 21 1HG PRO 21 13.842 -26.917 -11.507 147 HG3 PRO 21 2HG PRO 21 15.357 -27.017 -10.593 148 HD2 PRO 21 1HD PRO 21 12.932 -26.951 -9.390 149 HD3 PRO 21 2HD PRO 21 14.384 -26.244 -8.651 150 H ASP 22 H ASP 22 13.416 -22.187 -12.377 151 HA ASP 22 HA ASP 22 11.849 -21.514 -13.909 152 HB2 ASP 22 1HB ASP 22 11.708 -22.951 -15.832 153 HB3 ASP 22 2HB ASP 22 13.332 -23.095 -15.165 154 H SER 23 H SER 23 10.714 -22.509 -11.455 155 HA SER 23 HA SER 23 8.269 -23.845 -12.378 156 HB2 SER 23 1HB SER 23 9.128 -25.029 -10.536 157 HB3 SER 23 2HB SER 23 9.558 -23.552 -9.673 158 HG SER 23 HG SER 23 7.726 -24.093 -8.699 159 H PHE 24 H PHE 24 9.498 -20.831 -11.322 160 HA PHE 24 HA PHE 24 6.847 -19.800 -10.654 161 HB2 PHE 24 1HB PHE 24 9.014 -19.299 -9.325 162 HB3 PHE 24 2HB PHE 24 9.381 -18.183 -10.636 163 HD1 PHE 24 HD1 PHE 24 6.235 -19.010 -8.811 164 HD2 PHE 24 HD2 PHE 24 9.053 -16.025 -9.934 165 HE1 PHE 24 HE1 PHE 24 4.840 -17.293 -7.733 166 HE2 PHE 24 HE2 PHE 24 7.664 -14.303 -8.857 167 HZ PHE 24 HZ PHE 24 5.555 -14.936 -7.754 168 H SER 25 H SER 25 5.649 -18.682 -12.045 169 HA SER 25 HA SER 25 6.930 -17.278 -14.267 170 HB2 SER 25 1HB SER 25 5.033 -19.573 -14.506 171 HB3 SER 25 2HB SER 25 4.905 -18.257 -15.674 172 HG SER 25 HG SER 25 7.371 -19.509 -15.094 173 HA PRO 26 HA PRO 26 3.933 -14.157 -13.552 174 HB2 PRO 26 1HB PRO 26 3.413 -13.260 -16.061 175 HB3 PRO 26 2HB PRO 26 4.937 -12.943 -15.224 176 HG2 PRO 26 1HG PRO 26 4.305 -15.017 -17.288 177 HG3 PRO 26 2HG PRO 26 5.737 -13.982 -17.145 178 HD2 PRO 26 1HD PRO 26 5.723 -16.567 -16.342 179 HD3 PRO 26 2HD PRO 26 6.702 -15.323 -15.538 180 H LYS 27 H LYS 27 3.077 -16.430 -16.136 181 HA LYS 27 HA LYS 27 0.237 -15.919 -15.704 182 HB2 LYS 27 1HB LYS 27 -0.119 -17.336 -17.664 183 HB3 LYS 27 2HB LYS 27 1.047 -16.067 -18.013 184 HG2 LYS 27 1HG LYS 27 2.870 -17.609 -17.858 185 HG3 LYS 27 2HG LYS 27 1.798 -18.890 -17.286 186 HD2 LYS 27 1HD LYS 27 2.278 -19.242 -19.623 187 HD3 LYS 27 2HD LYS 27 0.585 -18.775 -19.445 188 HE2 LYS 27 1HE LYS 27 0.918 -16.704 -20.388 189 HE3 LYS 27 2HE LYS 27 2.623 -16.659 -19.945 190 HZ1 LYS 27 3HZ LYS 27 1.338 -17.884 -22.265 191 HZ2 LYS 27 1HZ LYS 27 2.693 -18.669 -21.625 192 HZ3 LYS 27 2HZ LYS 27 2.815 -17.067 -22.153 193 H LYS 28 H LYS 28 1.752 -17.173 -13.602 194 HA LYS 28 HA LYS 28 0.289 -19.719 -13.458 195 HB2 LYS 28 1HB LYS 28 3.194 -19.214 -13.023 196 HB3 LYS 28 2HB LYS 28 2.397 -20.376 -11.970 197 HG2 LYS 28 1HG LYS 28 2.149 -20.561 -14.949 198 HG3 LYS 28 2HG LYS 28 3.539 -21.236 -14.096 199 HD2 LYS 28 1HD LYS 28 0.763 -21.898 -13.197 200 HD3 LYS 28 2HD LYS 28 1.467 -22.736 -14.582 201 HE2 LYS 28 1HE LYS 28 2.733 -22.558 -11.851 202 HE3 LYS 28 2HE LYS 28 1.790 -23.929 -12.432 203 HZ1 LYS 28 3HZ LYS 28 4.466 -23.040 -13.240 204 HZ2 LYS 28 1HZ LYS 28 3.500 -23.832 -14.380 205 HZ3 LYS 28 2HZ LYS 28 3.900 -24.603 -12.929 206 H PHE 29 H PHE 29 1.880 -17.093 -11.713 207 HA PHE 29 HA PHE 29 0.589 -17.846 -9.222 208 HB2 PHE 29 1HB PHE 29 2.020 -16.370 -8.161 209 HB3 PHE 29 2HB PHE 29 2.988 -16.832 -9.557 210 HD1 PHE 29 HD2 PHE 29 2.818 -15.297 -11.632 211 HD2 PHE 29 HD1 PHE 29 1.642 -14.138 -7.709 212 HE1 PHE 29 HE2 PHE 29 3.023 -12.931 -12.273 213 HE2 PHE 29 HE1 PHE 29 1.844 -11.770 -8.344 214 HZ PHE 29 HZ PHE 29 2.537 -11.164 -10.628 215 H PHE 30 H PHE 30 -0.027 -15.856 -11.912 216 HA PHE 30 HA PHE 30 -1.394 -13.692 -10.891 217 HB2 PHE 30 1HB PHE 30 -2.463 -13.494 -13.003 218 HB3 PHE 30 2HB PHE 30 -0.890 -14.215 -13.325 219 HD1 PHE 30 HD1 PHE 30 -0.871 -16.845 -13.357 220 HD2 PHE 30 HD2 PHE 30 -4.325 -14.433 -13.962 221 HE1 PHE 30 HE1 PHE 30 -1.965 -18.713 -14.527 222 HE2 PHE 30 HE2 PHE 30 -5.426 -16.297 -15.132 223 HZ PHE 30 HZ PHE 30 -4.246 -18.441 -15.415 224 H GLN 31 H GLN 31 -2.421 -17.026 -11.134 225 HA GLN 31 HA GLN 31 -5.146 -16.404 -10.359 226 HB2 GLN 31 1HB GLN 31 -5.636 -18.676 -10.725 227 HB3 GLN 31 2HB GLN 31 -4.461 -18.267 -11.968 228 HG2 GLN 31 1HG GLN 31 -2.753 -19.149 -10.174 229 HG3 GLN 31 2HG GLN 31 -4.173 -20.008 -9.579 230 HE21 GLN 31 2HE2 GLN 31 -1.553 -20.483 -11.311 231 HE22 GLN 31 1HE2 GLN 31 -2.120 -21.614 -12.487 232 H ILE 32 H ILE 32 -2.194 -17.586 -8.914 233 HA ILE 32 HA ILE 32 -3.373 -18.518 -6.492 234 HB ILE 32 HB ILE 32 -0.521 -17.697 -7.052 235 HG12 ILE 32 1HG1 ILE 32 -1.447 -20.527 -6.776 236 HG13 ILE 32 2HG1 ILE 32 -1.731 -19.688 -8.298 237 HG21 ILE 32 1HG2 ILE 32 -0.548 -17.681 -4.767 238 HG22 ILE 32 2HG2 ILE 32 -1.870 -18.844 -4.664 239 HG23 ILE 32 3HG2 ILE 32 -0.240 -19.394 -5.053 240 HD11 ILE 32 3HD1 ILE 32 0.997 -19.441 -7.268 241 HD12 ILE 32 1HD1 ILE 32 0.508 -21.083 -7.686 242 HD13 ILE 32 2HD1 ILE 32 0.419 -19.802 -8.895 243 H SER 33 H SER 33 -1.163 -15.758 -6.965 244 HA SER 33 HA SER 33 -1.640 -14.512 -4.542 245 HB2 SER 33 1HB SER 33 -0.753 -12.472 -5.578 246 HB3 SER 33 2HB SER 33 0.189 -13.879 -6.070 247 HG SER 33 HG SER 33 -0.348 -12.477 -7.826 248 H GLY 34 H GLY 34 -3.168 -13.759 -7.679 249 HA2 GLY 34 1HA GLY 34 -5.676 -13.557 -7.500 250 HA3 GLY 34 2HA GLY 34 -5.349 -12.453 -6.173 251 H MET 35 H MET 35 -3.758 -12.741 -9.334 252 HA MET 35 HA MET 35 -4.247 -9.885 -9.753 253 HB2 MET 35 1HB MET 35 -2.344 -11.841 -11.039 254 HB3 MET 35 2HB MET 35 -2.581 -10.207 -11.643 255 HG2 MET 35 1HG MET 35 -2.085 -9.679 -9.056 256 HG3 MET 35 2HG MET 35 -1.152 -11.160 -9.255 257 HE1 MET 35 3HE MET 35 1.194 -10.237 -12.232 258 HE2 MET 35 1HE MET 35 0.226 -11.512 -11.491 259 HE3 MET 35 2HE MET 35 -0.500 -10.433 -12.682 260 H SER 36 H SER 36 -5.079 -13.017 -10.997 261 HA SER 36 HA SER 36 -5.899 -12.423 -13.574 262 HB2 SER 36 1HB SER 36 -6.880 -14.493 -13.578 263 HB3 SER 36 2HB SER 36 -5.911 -14.669 -12.115 264 HG SER 36 HG SER 36 -7.833 -15.178 -11.349 265 H LYS 37 H LYS 37 -7.483 -11.782 -10.521 266 HA LYS 37 HA LYS 37 -10.041 -11.145 -11.548 267 HB2 LYS 37 1HB LYS 37 -10.291 -9.899 -9.356 268 HB3 LYS 37 2HB LYS 37 -9.888 -11.606 -9.226 269 HG2 LYS 37 1HG LYS 37 -7.851 -11.201 -8.339 270 HG3 LYS 37 2HG LYS 37 -7.617 -9.720 -9.270 271 HD2 LYS 37 1HD LYS 37 -8.696 -8.416 -7.727 272 HD3 LYS 37 2HD LYS 37 -9.720 -9.740 -7.165 273 HE2 LYS 37 1HE LYS 37 -7.375 -10.697 -6.364 274 HE3 LYS 37 2HE LYS 37 -6.963 -8.983 -6.357 275 HZ1 LYS 37 3HZ LYS 37 -9.483 -9.687 -5.096 276 HZ2 LYS 37 1HZ LYS 37 -8.300 -8.578 -4.612 277 HZ3 LYS 37 2HZ LYS 37 -8.091 -10.227 -4.300 278 H LYS 38 H LYS 38 -7.065 -9.364 -11.289 279 HA LYS 38 HA LYS 38 -7.892 -6.743 -11.381 280 HB2 LYS 38 1HB LYS 38 -5.588 -7.992 -12.889 281 HB3 LYS 38 2HB LYS 38 -5.789 -6.269 -12.595 282 HG2 LYS 38 1HG LYS 38 -5.326 -8.421 -10.544 283 HG3 LYS 38 2HG LYS 38 -4.214 -7.136 -11.022 284 HD2 LYS 38 1HD LYS 38 -5.050 -5.946 -9.331 285 HD3 LYS 38 2HD LYS 38 -6.525 -5.793 -10.287 286 HE2 LYS 38 1HE LYS 38 -7.665 -7.199 -8.963 287 HE3 LYS 38 2HE LYS 38 -6.311 -8.321 -8.833 288 HZ1 LYS 38 3HZ LYS 38 -6.117 -5.774 -7.409 289 HZ2 LYS 38 1HZ LYS 38 -5.517 -7.298 -6.983 290 HZ3 LYS 38 2HZ LYS 38 -7.159 -6.948 -6.779 291 H SER 39 H SER 39 -7.733 -5.258 -13.334 292 HA SER 39 HA SER 39 -8.596 -6.413 -15.847 293 HB2 SER 39 1HB SER 39 -10.663 -6.103 -14.357 294 HB3 SER 39 2HB SER 39 -10.401 -4.370 -14.555 295 HG SER 39 HG SER 39 -10.604 -6.147 -16.749 296 H SER 40 H SER 40 -6.266 -5.145 -15.435 297 HA SER 40 HA SER 40 -4.936 -3.426 -16.114 298 HB2 SER 40 1HB SER 40 -7.069 -3.673 -18.091 299 HB3 SER 40 2HB SER 40 -6.377 -2.051 -18.044 300 HG SER 40 HG SER 40 -4.788 -2.863 -19.135 301 H SER 41 H SER 41 -6.981 -2.964 -13.986 302 HA SER 41 HA SER 41 -7.046 -0.021 -14.149 303 HB2 SER 41 1HB SER 41 -9.233 -1.788 -13.873 304 HB3 SER 41 2HB SER 41 -9.009 -1.026 -12.299 305 HG SER 41 HG SER 41 -9.161 0.389 -14.754 306 H GLN 42 H GLN 42 -5.818 -2.691 -12.566 307 HA GLN 42 HA GLN 42 -5.085 -1.042 -10.246 308 HB2 GLN 42 1HB GLN 42 -5.756 -3.987 -10.134 309 HB3 GLN 42 2HB GLN 42 -5.276 -2.974 -8.778 310 HG2 GLN 42 1HG GLN 42 -7.424 -2.615 -8.396 311 HG3 GLN 42 2HG GLN 42 -7.465 -1.673 -9.885 312 HE21 GLN 42 2HE2 GLN 42 -7.124 -3.716 -11.735 313 HE22 GLN 42 1HE2 GLN 42 -8.526 -4.725 -11.717 314 H LEU 43 H LEU 43 -4.098 -2.877 -12.850 315 HA LEU 43 HA LEU 43 -1.800 -4.171 -11.886 316 HB2 LEU 43 1HB LEU 43 -2.322 -3.014 -14.620 317 HB3 LEU 43 2HB LEU 43 -1.044 -4.160 -14.222 318 HG LEU 43 HG LEU 43 -3.920 -4.609 -14.699 319 HD11 LEU 43 1HD1 LEU 43 -1.704 -5.343 -15.978 320 HD12 LEU 43 2HD1 LEU 43 -3.170 -6.323 -15.981 321 HD13 LEU 43 3HD1 LEU 43 -1.849 -6.717 -14.881 322 HD21 LEU 43 3HD2 LEU 43 -4.053 -5.259 -12.464 323 HD22 LEU 43 1HD2 LEU 43 -2.415 -5.915 -12.458 324 HD23 LEU 43 2HD2 LEU 43 -3.702 -6.764 -13.316 325 H LYS 44 H LYS 44 -1.831 -1.216 -13.882 326 HA LYS 44 HA LYS 44 0.799 -0.477 -13.064 327 HB2 LYS 44 1HB LYS 44 0.651 1.199 -14.621 328 HB3 LYS 44 2HB LYS 44 -0.597 0.120 -15.231 329 HG2 LYS 44 1HG LYS 44 -1.087 2.506 -13.459 330 HG3 LYS 44 2HG LYS 44 -1.297 2.474 -15.212 331 HD2 LYS 44 1HD LYS 44 -2.724 0.558 -13.385 332 HD3 LYS 44 2HD LYS 44 -3.385 2.143 -13.791 333 HE2 LYS 44 1HE LYS 44 -2.574 0.953 -16.213 334 HE3 LYS 44 2HE LYS 44 -3.442 -0.286 -15.307 335 HZ1 LYS 44 3HZ LYS 44 -5.334 0.689 -15.857 336 HZ2 LYS 44 1HZ LYS 44 -4.501 1.877 -16.727 337 HZ3 LYS 44 2HZ LYS 44 -4.857 2.120 -15.092 338 H GLU 45 H GLU 45 -2.173 -0.233 -11.550 339 HA GLU 45 HA GLU 45 -2.209 2.259 -10.356 340 HB2 GLU 45 1HB GLU 45 -4.024 0.624 -10.135 341 HB3 GLU 45 2HB GLU 45 -3.000 -0.385 -9.123 342 HG2 GLU 45 1HG GLU 45 -3.163 1.016 -7.316 343 HG3 GLU 45 2HG GLU 45 -3.510 2.431 -8.308 344 H ILE 46 H ILE 46 -0.533 -0.675 -9.267 345 HA ILE 46 HA ILE 46 0.700 0.743 -7.061 346 HB ILE 46 HB ILE 46 1.320 -2.057 -7.988 347 HG12 ILE 46 1HG1 ILE 46 -0.320 -2.365 -5.830 348 HG13 ILE 46 2HG1 ILE 46 -1.048 -0.966 -6.612 349 HG21 ILE 46 1HG2 ILE 46 1.570 -0.768 -5.275 350 HG22 ILE 46 2HG2 ILE 46 2.077 -2.396 -5.722 351 HG23 ILE 46 3HG2 ILE 46 2.899 -0.997 -6.412 352 HD11 ILE 46 3HD1 ILE 46 -1.081 -3.765 -7.381 353 HD12 ILE 46 1HD1 ILE 46 -2.153 -2.445 -7.847 354 HD13 ILE 46 2HD1 ILE 46 -0.631 -2.690 -8.704 355 H PHE 47 H PHE 47 1.427 -0.051 -10.324 356 HA PHE 47 HA PHE 47 3.365 0.009 -11.562 357 HB2 PHE 47 1HB PHE 47 4.551 2.233 -11.272 358 HB3 PHE 47 2HB PHE 47 2.821 2.324 -11.587 359 HD1 PHE 47 HD2 PHE 47 5.452 2.780 -9.081 360 HD2 PHE 47 HD1 PHE 47 1.293 3.124 -9.917 361 HE1 PHE 47 HE2 PHE 47 5.162 4.147 -7.056 362 HE2 PHE 47 HE1 PHE 47 0.996 4.493 -7.894 363 HZ PHE 47 HZ PHE 47 2.931 5.005 -6.460 364 H ARG 48 H ARG 48 3.698 -1.626 -9.296 365 HA ARG 48 HA ARG 48 6.576 -1.276 -8.852 366 HB2 ARG 48 1HB ARG 48 6.463 -1.312 -6.587 367 HB3 ARG 48 2HB ARG 48 4.861 -0.646 -6.877 368 HG2 ARG 48 1HG ARG 48 3.924 -2.924 -6.740 369 HG3 ARG 48 2HG ARG 48 5.535 -3.533 -6.354 370 HD2 ARG 48 1HD ARG 48 4.223 -1.365 -4.741 371 HD3 ARG 48 2HD ARG 48 3.941 -3.074 -4.408 372 HE ARG 48 HE ARG 48 6.128 -3.271 -3.642 373 HH11 ARG 48 1HH1 ARG 48 5.523 -0.088 -4.917 374 HH12 ARG 48 2HH1 ARG 48 6.958 0.601 -4.233 375 HH21 ARG 48 1HH2 ARG 48 8.019 -2.375 -2.736 376 HH22 ARG 48 2HH2 ARG 48 8.377 -0.701 -2.993 377 H ILE 49 H ILE 49 4.220 -3.140 -10.071 378 HA ILE 49 HA ILE 49 5.588 -5.661 -9.391 379 HB ILE 49 HB ILE 49 3.491 -6.793 -10.142 380 HG12 ILE 49 1HG1 ILE 49 2.452 -3.953 -10.162 381 HG13 ILE 49 2HG1 ILE 49 2.543 -5.052 -11.533 382 HG21 ILE 49 1HG2 ILE 49 2.937 -4.876 -7.895 383 HG22 ILE 49 2HG2 ILE 49 2.387 -6.541 -8.078 384 HG23 ILE 49 3HG2 ILE 49 4.086 -6.206 -7.745 385 HD11 ILE 49 3HD1 ILE 49 0.901 -6.512 -10.450 386 HD12 ILE 49 1HD1 ILE 49 0.791 -5.372 -9.109 387 HD13 ILE 49 2HD1 ILE 49 0.275 -4.886 -10.724 388 H LEU 50 H LEU 50 4.166 -3.761 -12.007 389 HA LEU 50 HA LEU 50 4.843 -5.586 -14.080 390 HB2 LEU 50 1HB LEU 50 4.475 -2.632 -14.453 391 HB3 LEU 50 2HB LEU 50 4.120 -3.935 -15.585 392 HG LEU 50 HG LEU 50 2.584 -3.728 -13.027 393 HD11 LEU 50 1HD1 LEU 50 2.558 -1.485 -14.076 394 HD12 LEU 50 2HD1 LEU 50 0.976 -2.265 -14.053 395 HD13 LEU 50 3HD1 LEU 50 1.913 -2.216 -15.547 396 HD21 LEU 50 3HD2 LEU 50 0.843 -4.503 -14.886 397 HD22 LEU 50 1HD2 LEU 50 1.909 -5.636 -14.056 398 HD23 LEU 50 2HD2 LEU 50 2.327 -5.051 -15.666 399 H ASP 51 H ASP 51 6.203 -2.375 -13.317 400 HA ASP 51 HA ASP 51 8.881 -3.366 -13.829 401 HB2 ASP 51 1HB ASP 51 9.418 -1.918 -15.613 402 HB3 ASP 51 2HB ASP 51 7.859 -2.610 -16.051 403 H ASN 52 H ASN 52 10.337 -2.388 -12.555 404 HA ASN 52 HA ASN 52 9.406 -0.201 -10.865 405 HB2 ASN 52 1HB ASN 52 10.812 -2.455 -10.266 406 HB3 ASN 52 2HB ASN 52 12.116 -1.283 -10.430 407 HD21 ASN 52 2HD2 ASN 52 11.235 0.966 -9.412 408 HD22 ASN 52 1HD2 ASN 52 10.747 0.788 -7.765 409 H ASP 53 H ASP 53 10.367 -0.013 -13.762 410 HA ASP 53 HA ASP 53 12.539 1.931 -13.354 411 HB2 ASP 53 1HB ASP 53 12.857 -0.037 -14.950 412 HB3 ASP 53 2HB ASP 53 11.686 0.757 -15.999 413 H GLN 54 H GLN 54 9.364 1.462 -14.799 414 HA GLN 54 HA GLN 54 7.805 2.915 -15.597 415 HB2 GLN 54 1HB GLN 54 9.145 4.332 -13.379 416 HB3 GLN 54 2HB GLN 54 8.224 5.350 -14.478 417 HG2 GLN 54 1HG GLN 54 6.931 4.594 -12.521 418 HG3 GLN 54 2HG GLN 54 6.225 4.101 -14.059 419 HE21 GLN 54 2HE2 GLN 54 5.251 2.233 -13.698 420 HE22 GLN 54 1HE2 GLN 54 5.956 0.860 -12.923 421 H SER 55 H SER 55 10.510 2.735 -16.894 422 HA SER 55 HA SER 55 10.937 5.362 -18.022 423 HB2 SER 55 1HB SER 55 12.796 3.720 -17.566 424 HB3 SER 55 2HB SER 55 12.175 2.744 -18.896 425 HG SER 55 HG SER 55 12.536 4.530 -20.274 426 H GLY 56 H GLY 56 9.237 2.447 -18.839 427 HA2 GLY 56 1HA GLY 56 7.412 3.248 -20.550 428 HA3 GLY 56 2HA GLY 56 8.821 3.342 -21.597 429 H PHE 57 H PHE 57 10.241 1.127 -20.975 430 HA PHE 57 HA PHE 57 8.364 -1.083 -21.503 431 HB2 PHE 57 1HB PHE 57 9.680 -1.911 -23.213 432 HB3 PHE 57 2HB PHE 57 9.915 -0.179 -23.425 433 HD1 PHE 57 HD1 PHE 57 11.914 0.723 -21.790 434 HD2 PHE 57 HD2 PHE 57 11.564 -3.174 -23.463 435 HE1 PHE 57 HE1 PHE 57 14.346 0.419 -21.580 436 HE2 PHE 57 HE2 PHE 57 13.996 -3.485 -23.256 437 HZ PHE 57 HZ PHE 57 15.390 -1.687 -22.313 438 H ILE 58 H ILE 58 9.852 -3.247 -21.350 439 HA ILE 58 HA ILE 58 11.289 -3.094 -18.784 440 HB ILE 58 HB ILE 58 9.504 -5.392 -19.572 441 HG12 ILE 58 1HG1 ILE 58 8.905 -3.122 -17.663 442 HG13 ILE 58 2HG1 ILE 58 8.174 -3.332 -19.250 443 HG21 ILE 58 1HG2 ILE 58 10.939 -4.643 -17.034 444 HG22 ILE 58 2HG2 ILE 58 9.698 -5.892 -17.120 445 HG23 ILE 58 3HG2 ILE 58 11.192 -6.070 -18.039 446 HD11 ILE 58 3HD1 ILE 58 7.813 -5.738 -17.802 447 HD12 ILE 58 1HD1 ILE 58 7.345 -4.393 -16.762 448 HD13 ILE 58 2HD1 ILE 58 6.597 -4.583 -18.348 449 H GLU 59 H GLU 59 12.892 -4.717 -18.437 450 HA GLU 59 HA GLU 59 13.712 -6.216 -20.824 451 HB2 GLU 59 1HB GLU 59 14.962 -3.969 -20.447 452 HB3 GLU 59 2HB GLU 59 15.759 -4.818 -19.131 453 HG2 GLU 59 1HG GLU 59 17.009 -4.800 -21.287 454 HG3 GLU 59 2HG GLU 59 16.715 -6.402 -20.612 455 H GLU 60 H GLU 60 15.478 -7.823 -20.271 456 HA GLU 60 HA GLU 60 14.585 -9.562 -18.276 457 HB2 GLU 60 1HB GLU 60 17.171 -9.394 -19.808 458 HB3 GLU 60 2HB GLU 60 16.882 -10.656 -18.619 459 HG2 GLU 60 1HG GLU 60 14.958 -11.434 -19.872 460 HG3 GLU 60 2HG GLU 60 15.176 -10.135 -21.043 461 H ASP 61 H ASP 61 16.628 -6.819 -18.083 462 HA ASP 61 HA ASP 61 18.017 -7.582 -15.692 463 HB2 ASP 61 1HB ASP 61 18.946 -5.946 -17.302 464 HB3 ASP 61 2HB ASP 61 17.640 -4.833 -16.900 465 H GLU 62 H GLU 62 14.862 -6.767 -16.273 466 HA GLU 62 HA GLU 62 14.517 -5.693 -13.550 467 HB2 GLU 62 1HB GLU 62 13.160 -5.043 -16.126 468 HB3 GLU 62 2HB GLU 62 12.219 -4.953 -14.644 469 HG2 GLU 62 1HG GLU 62 13.665 -3.305 -13.728 470 HG3 GLU 62 2HG GLU 62 14.834 -3.524 -15.029 471 H LEU 63 H LEU 63 14.508 -8.504 -14.839 472 HA LEU 63 HA LEU 63 11.867 -9.351 -13.851 473 HB2 LEU 63 1HB LEU 63 13.709 -10.995 -15.560 474 HB3 LEU 63 2HB LEU 63 11.989 -11.236 -15.262 475 HG LEU 63 HG LEU 63 13.223 -9.037 -16.920 476 HD11 LEU 63 1HD1 LEU 63 11.328 -11.006 -18.043 477 HD12 LEU 63 2HD1 LEU 63 12.950 -11.589 -17.671 478 HD13 LEU 63 3HD1 LEU 63 12.734 -10.231 -18.775 479 HD21 LEU 63 3HD2 LEU 63 11.272 -7.962 -16.906 480 HD22 LEU 63 1HD2 LEU 63 10.831 -8.972 -15.529 481 HD23 LEU 63 2HD2 LEU 63 10.363 -9.452 -17.161 482 H LYS 64 H LYS 64 15.263 -9.564 -13.360 483 HA LYS 64 HA LYS 64 15.143 -11.936 -11.712 484 HB2 LYS 64 1HB LYS 64 17.441 -9.995 -11.917 485 HB3 LYS 64 2HB LYS 64 17.496 -11.688 -11.444 486 HG2 LYS 64 1HG LYS 64 17.024 -12.395 -13.679 487 HG3 LYS 64 2HG LYS 64 16.726 -10.733 -14.192 488 HD2 LYS 64 1HD LYS 64 19.205 -10.443 -13.231 489 HD3 LYS 64 2HD LYS 64 19.283 -12.145 -13.692 490 HE2 LYS 64 1HE LYS 64 18.460 -9.872 -15.497 491 HE3 LYS 64 2HE LYS 64 20.037 -10.659 -15.497 492 HZ1 LYS 64 3HZ LYS 64 17.722 -11.427 -16.864 493 HZ2 LYS 64 1HZ LYS 64 18.066 -12.633 -15.728 494 HZ3 LYS 64 2HZ LYS 64 19.235 -12.183 -16.865 495 H TYR 65 H TYR 65 14.139 -8.870 -11.240 496 HA TYR 65 HA TYR 65 14.761 -8.953 -8.360 497 HB2 TYR 65 1HB TYR 65 14.130 -6.437 -9.897 498 HB3 TYR 65 2HB TYR 65 14.819 -6.580 -8.284 499 HD1 TYR 65 HD2 TYR 65 16.881 -8.710 -8.909 500 HD2 TYR 65 HD1 TYR 65 15.800 -5.132 -10.943 501 HE1 TYR 65 HE2 TYR 65 19.145 -8.574 -9.861 502 HE2 TYR 65 HE1 TYR 65 18.061 -4.987 -11.901 503 HH TYR 65 HH TYR 65 20.393 -7.571 -11.507 504 H PHE 66 H PHE 66 12.623 -10.378 -9.272 505 HA PHE 66 HA PHE 66 10.236 -8.740 -8.978 506 HB2 PHE 66 1HB PHE 66 10.300 -10.524 -10.690 507 HB3 PHE 66 2HB PHE 66 10.499 -11.722 -9.416 508 HD1 PHE 66 HD2 PHE 66 8.652 -12.086 -7.780 509 HD2 PHE 66 HD1 PHE 66 8.178 -9.679 -11.259 510 HE1 PHE 66 HE2 PHE 66 6.207 -12.266 -7.568 511 HE2 PHE 66 HE1 PHE 66 5.733 -9.855 -11.052 512 HZ PHE 66 HZ PHE 66 4.744 -11.151 -9.205 513 H LEU 67 H LEU 67 11.252 -11.837 -7.528 514 HA LEU 67 HA LEU 67 9.550 -11.762 -5.343 515 HB2 LEU 67 1HB LEU 67 12.314 -12.932 -5.237 516 HB3 LEU 67 2HB LEU 67 10.870 -13.470 -4.384 517 HG LEU 67 HG LEU 67 11.424 -13.748 -7.336 518 HD11 LEU 67 1HD1 LEU 67 12.611 -15.263 -5.668 519 HD12 LEU 67 2HD1 LEU 67 11.681 -16.045 -6.946 520 HD13 LEU 67 3HD1 LEU 67 11.018 -15.932 -5.316 521 HD21 LEU 67 3HD2 LEU 67 9.243 -13.989 -7.656 522 HD22 LEU 67 1HD2 LEU 67 8.946 -13.621 -5.957 523 HD23 LEU 67 2HD2 LEU 67 9.207 -15.290 -6.464 524 H GLN 68 H GLN 68 12.500 -10.044 -5.901 525 HA GLN 68 HA GLN 68 13.301 -9.462 -3.298 526 HB2 GLN 68 1HB GLN 68 14.051 -8.678 -5.876 527 HB3 GLN 68 2HB GLN 68 13.636 -7.182 -5.050 528 HG2 GLN 68 1HG GLN 68 15.441 -7.260 -3.736 529 HG3 GLN 68 2HG GLN 68 15.298 -8.998 -3.473 530 HE21 GLN 68 2HE2 GLN 68 15.532 -10.070 -5.899 531 HE22 GLN 68 1HE2 GLN 68 17.060 -9.689 -6.609 532 H ARG 69 H ARG 69 10.533 -8.435 -5.021 533 HA ARG 69 HA ARG 69 10.099 -6.056 -3.428 534 HB2 ARG 69 1HB ARG 69 8.812 -7.338 -5.761 535 HB3 ARG 69 2HB ARG 69 7.737 -6.449 -4.690 536 HG2 ARG 69 1HG ARG 69 10.253 -5.254 -5.812 537 HG3 ARG 69 2HG ARG 69 8.699 -5.172 -6.643 538 HD2 ARG 69 1HD ARG 69 8.585 -3.215 -5.490 539 HD3 ARG 69 2HD ARG 69 7.909 -4.291 -4.268 540 HE ARG 69 HE ARG 69 9.698 -3.799 -2.952 541 HH11 ARG 69 1HH1 ARG 69 10.574 -3.194 -6.267 542 HH12 ARG 69 2HH1 ARG 69 12.139 -2.562 -5.874 543 HH21 ARG 69 1HH2 ARG 69 11.756 -2.970 -2.423 544 HH22 ARG 69 2HH2 ARG 69 12.810 -2.436 -3.688 545 H PHE 70 H PHE 70 8.300 -9.097 -3.937 546 HA PHE 70 HA PHE 70 6.626 -8.687 -1.668 547 HB2 PHE 70 1HB PHE 70 7.171 -11.179 -3.294 548 HB3 PHE 70 2HB PHE 70 5.908 -11.033 -2.077 549 HD1 PHE 70 HD1 PHE 70 4.114 -9.267 -2.430 550 HD2 PHE 70 HD2 PHE 70 6.788 -10.525 -5.494 551 HE1 PHE 70 HE1 PHE 70 2.574 -8.383 -4.133 552 HE2 PHE 70 HE2 PHE 70 5.252 -9.642 -7.201 553 HZ PHE 70 HZ PHE 70 3.143 -8.568 -6.522 554 H GLU 71 H GLU 71 9.041 -11.245 -2.274 555 HA GLU 71 HA GLU 71 9.184 -12.189 0.334 556 HB2 GLU 71 1HB GLU 71 10.135 -13.421 -1.530 557 HB3 GLU 71 2HB GLU 71 11.322 -12.152 -1.801 558 HG2 GLU 71 1HG GLU 71 12.413 -13.941 -0.689 559 HG3 GLU 71 2HG GLU 71 12.240 -12.620 0.465 560 H SER 72 H SER 72 11.005 -9.600 -1.234 561 HA SER 72 HA SER 72 12.271 -7.903 -0.402 562 HB2 SER 72 1HB SER 72 10.165 -7.890 1.192 563 HB3 SER 72 2HB SER 72 11.337 -8.443 2.390 564 HG SER 72 HG SER 72 12.324 -6.550 2.325 565 H GLY 73 H GLY 73 13.017 -10.890 -0.140 566 HA2 GLY 73 1HA GLY 73 15.390 -10.398 1.543 567 HA3 GLY 73 2HA GLY 73 14.492 -11.903 1.673 568 H ALA 74 H ALA 74 13.972 -12.087 -1.187 569 HA ALA 74 HA ALA 74 16.087 -13.676 -1.990 570 HB1 ALA 74 1HB ALA 74 15.025 -13.880 -4.027 571 HB2 ALA 74 2HB ALA 74 13.699 -13.374 -2.979 572 HB3 ALA 74 3HB ALA 74 14.486 -12.201 -4.035 573 H ARG 75 H ARG 75 17.351 -13.236 -4.115 574 HA ARG 75 HA ARG 75 18.492 -10.524 -4.032 575 HB2 ARG 75 1HB ARG 75 20.706 -11.733 -4.615 576 HB3 ARG 75 2HB ARG 75 20.158 -11.734 -2.944 577 HG2 ARG 75 1HG ARG 75 19.792 -13.960 -2.921 578 HG3 ARG 75 2HG ARG 75 19.267 -14.002 -4.605 579 HD2 ARG 75 1HD ARG 75 21.355 -14.368 -5.384 580 HD3 ARG 75 2HD ARG 75 22.102 -13.336 -4.165 581 HE ARG 75 HE ARG 75 22.466 -15.193 -2.891 582 HH11 ARG 75 1HH1 ARG 75 20.002 -15.916 -5.241 583 HH12 ARG 75 2HH1 ARG 75 19.923 -17.598 -4.834 584 HH21 ARG 75 1HH2 ARG 75 22.371 -17.406 -2.345 585 HH22 ARG 75 2HH2 ARG 75 21.270 -18.444 -3.185 586 H VAL 76 H VAL 76 17.888 -13.449 -5.895 587 HA VAL 76 HA VAL 76 17.456 -11.947 -8.287 588 HB VAL 76 HB VAL 76 19.277 -13.538 -9.454 589 HG11 VAL 76 1HG1 VAL 76 20.401 -11.614 -9.956 590 HG12 VAL 76 2HG1 VAL 76 18.907 -10.926 -9.319 591 HG13 VAL 76 3HG1 VAL 76 20.343 -11.015 -8.299 592 HG21 VAL 76 3HG2 VAL 76 20.012 -14.396 -7.227 593 HG22 VAL 76 1HG2 VAL 76 21.303 -13.668 -8.184 594 HG23 VAL 76 2HG2 VAL 76 20.583 -12.772 -6.846 595 H LEU 77 H LEU 77 16.830 -13.340 -10.112 596 HA LEU 77 HA LEU 77 15.634 -15.840 -9.131 597 HB2 LEU 77 1HB LEU 77 14.835 -13.851 -11.212 598 HB3 LEU 77 2HB LEU 77 14.265 -15.515 -11.329 599 HG LEU 77 HG LEU 77 13.803 -14.419 -8.689 600 HD11 LEU 77 1HD1 LEU 77 11.953 -13.108 -10.518 601 HD12 LEU 77 2HD1 LEU 77 13.598 -12.483 -10.620 602 HD13 LEU 77 3HD1 LEU 77 12.752 -12.489 -9.073 603 HD21 LEU 77 3HD2 LEU 77 12.771 -16.442 -9.743 604 HD22 LEU 77 1HD2 LEU 77 11.854 -15.355 -10.787 605 HD23 LEU 77 2HD2 LEU 77 11.618 -15.307 -9.040 606 H THR 78 H THR 78 15.223 -17.425 -11.060 607 HA THR 78 HA THR 78 17.810 -18.190 -12.026 608 HB THR 78 HB THR 78 16.670 -20.117 -13.023 609 HG1 THR 78 HG1 THR 78 14.511 -20.208 -13.187 610 HG21 THR 78 3HG2 THR 78 15.915 -21.152 -11.003 611 HG22 THR 78 1HG2 THR 78 15.546 -19.590 -10.274 612 HG23 THR 78 2HG2 THR 78 17.222 -20.049 -10.575 613 H ALA 79 H ALA 79 18.008 -18.933 -14.379 614 HA ALA 79 HA ALA 79 17.607 -16.641 -16.051 615 HB1 ALA 79 1HB ALA 79 19.561 -18.369 -16.028 616 HB2 ALA 79 2HB ALA 79 18.517 -19.273 -17.125 617 HB3 ALA 79 3HB ALA 79 19.040 -17.643 -17.549 618 H SER 80 H SER 80 15.676 -19.257 -15.244 619 HA SER 80 HA SER 80 14.296 -19.343 -17.819 620 HB2 SER 80 1HB SER 80 14.156 -21.017 -15.321 621 HB3 SER 80 2HB SER 80 12.892 -21.109 -16.547 622 HG SER 80 HG SER 80 15.502 -22.018 -16.616 623 H GLU 81 H GLU 81 13.449 -18.884 -14.384 624 HA GLU 81 HA GLU 81 10.825 -18.145 -14.633 625 HB2 GLU 81 1HB GLU 81 12.940 -17.132 -12.739 626 HB3 GLU 81 2HB GLU 81 11.247 -16.685 -12.592 627 HG2 GLU 81 1HG GLU 81 10.594 -18.863 -12.069 628 HG3 GLU 81 2HG GLU 81 12.101 -19.554 -12.667 629 H THR 82 H THR 82 13.662 -16.027 -14.906 630 HA THR 82 HA THR 82 12.169 -13.664 -15.415 631 HB THR 82 HB THR 82 14.349 -12.731 -16.218 632 HG1 THR 82 HG1 THR 82 15.448 -15.233 -15.430 633 HG21 THR 82 3HG2 THR 82 15.227 -13.973 -13.743 634 HG22 THR 82 1HG2 THR 82 13.561 -13.405 -13.647 635 HG23 THR 82 2HG2 THR 82 14.850 -12.284 -14.084 636 H LYS 83 H LYS 83 13.916 -15.922 -17.533 637 HA LYS 83 HA LYS 83 13.612 -14.692 -19.964 638 HB2 LYS 83 1HB LYS 83 14.879 -16.729 -19.764 639 HB3 LYS 83 2HB LYS 83 13.446 -17.632 -19.291 640 HG2 LYS 83 1HG LYS 83 12.577 -17.627 -21.445 641 HG3 LYS 83 2HG LYS 83 13.586 -16.270 -21.952 642 HD2 LYS 83 1HD LYS 83 14.427 -18.298 -22.949 643 HD3 LYS 83 2HD LYS 83 15.578 -17.731 -21.736 644 HE2 LYS 83 1HE LYS 83 14.702 -19.347 -20.136 645 HE3 LYS 83 2HE LYS 83 13.513 -19.891 -21.318 646 HZ1 LYS 83 3HZ LYS 83 15.356 -21.400 -21.291 647 HZ2 LYS 83 1HZ LYS 83 16.463 -20.143 -21.532 648 HZ3 LYS 83 2HZ LYS 83 15.377 -20.560 -22.759 649 H THR 84 H THR 84 11.260 -16.765 -18.304 650 HA THR 84 HA THR 84 9.272 -16.223 -20.370 651 HB THR 84 HB THR 84 9.455 -18.525 -19.537 652 HG1 THR 84 HG1 THR 84 7.244 -18.807 -19.253 653 HG21 THR 84 3HG2 THR 84 10.097 -18.513 -17.332 654 HG22 THR 84 1HG2 THR 84 8.366 -18.791 -17.147 655 HG23 THR 84 2HG2 THR 84 9.029 -17.173 -16.915 656 H PHE 85 H PHE 85 10.072 -13.978 -18.877 657 HA PHE 85 HA PHE 85 7.601 -13.406 -17.380 658 HB2 PHE 85 1HB PHE 85 9.741 -13.579 -15.991 659 HB3 PHE 85 2HB PHE 85 10.254 -12.100 -16.796 660 HD1 PHE 85 HD1 PHE 85 8.544 -10.123 -16.695 661 HD2 PHE 85 HD2 PHE 85 8.572 -13.431 -14.017 662 HE1 PHE 85 HE1 PHE 85 7.301 -8.790 -15.041 663 HE2 PHE 85 HE2 PHE 85 7.329 -12.104 -12.359 664 HZ PHE 85 HZ PHE 85 6.691 -9.781 -12.870 665 H LEU 86 H LEU 86 10.176 -12.121 -19.424 666 HA LEU 86 HA LEU 86 8.432 -9.847 -20.100 667 HB2 LEU 86 1HB LEU 86 10.535 -9.161 -19.114 668 HB3 LEU 86 2HB LEU 86 11.427 -10.120 -20.293 669 HG LEU 86 HG LEU 86 11.279 -7.554 -20.590 670 HD11 LEU 86 1HD1 LEU 86 10.872 -8.035 -23.161 671 HD12 LEU 86 2HD1 LEU 86 11.013 -9.706 -22.616 672 HD13 LEU 86 3HD1 LEU 86 12.333 -8.571 -22.331 673 HD21 LEU 86 3HD2 LEU 86 9.362 -6.600 -21.308 674 HD22 LEU 86 1HD2 LEU 86 8.625 -7.941 -20.431 675 HD23 LEU 86 2HD2 LEU 86 8.840 -8.043 -22.178 676 H ALA 87 H ALA 87 10.273 -12.531 -21.341 677 HA ALA 87 HA ALA 87 10.023 -11.786 -24.102 678 HB1 ALA 87 1HB ALA 87 11.292 -13.621 -24.575 679 HB2 ALA 87 2HB ALA 87 11.741 -13.384 -22.885 680 HB3 ALA 87 3HB ALA 87 10.542 -14.604 -23.316 681 H ALA 88 H ALA 88 7.802 -12.813 -21.901 682 HA ALA 88 HA ALA 88 6.311 -14.570 -23.673 683 HB1 ALA 88 1HB ALA 88 5.862 -13.616 -20.859 684 HB2 ALA 88 2HB ALA 88 4.655 -14.544 -21.749 685 HB3 ALA 88 3HB ALA 88 6.239 -15.245 -21.419 686 H ALA 89 H ALA 89 6.032 -11.332 -22.274 687 HA ALA 89 HA ALA 89 3.594 -10.834 -23.802 688 HB1 ALA 89 1HB ALA 89 3.064 -9.509 -22.107 689 HB2 ALA 89 2HB ALA 89 4.597 -9.909 -21.330 690 HB3 ALA 89 3HB ALA 89 4.491 -8.516 -22.407 691 H ASP 90 H ASP 90 6.417 -11.088 -24.922 692 HA ASP 90 HA ASP 90 7.073 -8.476 -25.910 693 HB2 ASP 90 1HB ASP 90 8.709 -9.710 -27.334 694 HB3 ASP 90 2HB ASP 90 8.853 -10.079 -25.618 695 H HIS 91 H HIS 91 4.812 -8.117 -26.704 696 HA HIS 91 HA HIS 91 4.619 -9.004 -29.502 697 HB2 HIS 91 1HB HIS 91 2.587 -9.191 -27.344 698 HB3 HIS 91 2HB HIS 91 2.013 -8.694 -28.933 699 HD1 HIS 91 HD1 HIS 91 3.809 -10.529 -30.669 700 HD2 HIS 91 HD2 HIS 91 1.708 -11.775 -27.308 701 HE1 HIS 91 HE1 HIS 91 3.499 -13.008 -30.951 702 H ASP 92 H ASP 92 5.268 -6.486 -27.680 703 HA ASP 92 HA ASP 92 3.444 -4.510 -28.681 704 HB2 ASP 92 1HB ASP 92 5.651 -4.614 -26.790 705 HB3 ASP 92 2HB ASP 92 5.717 -3.168 -27.795 706 H GLY 93 H GLY 93 6.345 -5.976 -29.806 707 HA2 GLY 93 1HA GLY 93 6.418 -5.416 -32.354 708 HA3 GLY 93 2HA GLY 93 6.817 -3.819 -31.739 709 H ASP 94 H ASP 94 8.439 -4.593 -29.569 710 HA ASP 94 HA ASP 94 10.616 -6.127 -30.782 711 HB2 ASP 94 1HB ASP 94 10.904 -3.636 -31.230 712 HB3 ASP 94 2HB ASP 94 11.132 -3.448 -29.494 713 H GLY 95 H GLY 95 8.687 -6.551 -28.580 714 HA2 GLY 95 1HA GLY 95 8.789 -7.655 -26.558 715 HA3 GLY 95 2HA GLY 95 10.542 -7.590 -26.666 716 H LYS 96 H LYS 96 8.764 -4.641 -26.932 717 HA LYS 96 HA LYS 96 9.745 -3.860 -24.273 718 HB2 LYS 96 1HB LYS 96 9.342 -1.501 -25.197 719 HB3 LYS 96 2HB LYS 96 10.698 -2.410 -25.852 720 HG2 LYS 96 1HG LYS 96 9.792 -2.542 -27.908 721 HG3 LYS 96 2HG LYS 96 8.146 -2.704 -27.292 722 HD2 LYS 96 1HD LYS 96 8.390 -0.226 -26.621 723 HD3 LYS 96 2HD LYS 96 9.761 -0.215 -27.733 724 HE2 LYS 96 1HE LYS 96 8.401 -0.722 -29.582 725 HE3 LYS 96 2HE LYS 96 7.055 -1.222 -28.559 726 HZ1 LYS 96 3HZ LYS 96 7.093 1.117 -29.711 727 HZ2 LYS 96 1HZ LYS 96 7.996 1.541 -28.345 728 HZ3 LYS 96 2HZ LYS 96 6.434 0.917 -28.166 729 H ILE 97 H ILE 97 8.189 -4.128 -22.798 730 HA ILE 97 HA ILE 97 5.448 -4.198 -23.236 731 HB ILE 97 HB ILE 97 6.796 -3.304 -20.687 732 HG12 ILE 97 1HG1 ILE 97 7.758 -5.412 -21.406 733 HG13 ILE 97 2HG1 ILE 97 6.677 -5.704 -20.048 734 HG21 ILE 97 1HG2 ILE 97 4.763 -4.346 -19.652 735 HG22 ILE 97 2HG2 ILE 97 4.458 -2.878 -20.579 736 HG23 ILE 97 3HG2 ILE 97 4.077 -4.454 -21.273 737 HD11 ILE 97 3HD1 ILE 97 5.637 -7.231 -21.252 738 HD12 ILE 97 1HD1 ILE 97 5.135 -5.975 -22.383 739 HD13 ILE 97 2HD1 ILE 97 6.642 -6.852 -22.651 740 H GLY 98 H GLY 98 3.773 -2.707 -22.904 741 HA2 GLY 98 1HA GLY 98 4.507 0.103 -22.539 742 HA3 GLY 98 2HA GLY 98 3.707 -0.337 -24.041 743 H ALA 99 H ALA 99 3.180 -1.360 -20.673 744 HA ALA 99 HA ALA 99 1.283 -1.468 -19.414 745 HB1 ALA 99 1HB ALA 99 1.082 1.196 -20.754 746 HB2 ALA 99 2HB ALA 99 -0.222 0.629 -19.710 747 HB3 ALA 99 3HB ALA 99 1.408 0.812 -19.063 748 H GLU 100 H GLU 100 1.247 -2.704 -22.096 749 HA GLU 100 HA GLU 100 -1.658 -2.976 -22.320 750 HB2 GLU 100 1HB GLU 100 -1.534 -2.942 -24.779 751 HB3 GLU 100 2HB GLU 100 -1.054 -1.404 -24.075 752 HG2 GLU 100 1HG GLU 100 1.346 -2.295 -24.279 753 HG3 GLU 100 2HG GLU 100 0.652 -3.487 -25.377 754 H GLU 101 H GLU 101 1.552 -4.217 -23.059 755 HA GLU 101 HA GLU 101 0.676 -6.759 -23.990 756 HB2 GLU 101 1HB GLU 101 3.309 -5.627 -23.111 757 HB3 GLU 101 2HB GLU 101 3.144 -7.357 -23.376 758 HG2 GLU 101 1HG GLU 101 2.722 -5.158 -25.381 759 HG3 GLU 101 2HG GLU 101 4.010 -6.362 -25.362 760 H PHE 102 H PHE 102 2.419 -5.922 -20.989 761 HA PHE 102 HA PHE 102 2.122 -8.317 -19.671 762 HB2 PHE 102 1HB PHE 102 3.360 -6.103 -18.998 763 HB3 PHE 102 2HB PHE 102 1.868 -5.763 -18.126 764 HD1 PHE 102 HD2 PHE 102 1.212 -7.100 -16.213 765 HD2 PHE 102 HD1 PHE 102 4.838 -7.873 -18.304 766 HE1 PHE 102 HE2 PHE 102 1.994 -8.486 -14.337 767 HE2 PHE 102 HE1 PHE 102 5.626 -9.262 -16.431 768 HZ PHE 102 HZ PHE 102 4.203 -9.569 -14.444 769 H GLN 103 H GLN 103 -0.073 -5.521 -19.557 770 HA GLN 103 HA GLN 103 -1.946 -6.476 -17.774 771 HB2 GLN 103 1HB GLN 103 -2.130 -4.644 -20.137 772 HB3 GLN 103 2HB GLN 103 -3.593 -5.107 -19.279 773 HG2 GLN 103 1HG GLN 103 -2.685 -2.970 -18.503 774 HG3 GLN 103 2HG GLN 103 -2.734 -4.185 -17.226 775 HE21 GLN 103 2HE2 GLN 103 -0.438 -3.539 -19.850 776 HE22 GLN 103 1HE2 GLN 103 0.947 -3.378 -18.830 777 H GLU 104 H GLU 104 -1.640 -7.154 -21.225 778 HA GLU 104 HA GLU 104 -4.050 -8.715 -21.331 779 HB2 GLU 104 1HB GLU 104 -1.845 -8.059 -23.235 780 HB3 GLU 104 2HB GLU 104 -2.877 -9.439 -23.586 781 HG2 GLU 104 1HG GLU 104 -4.028 -6.744 -22.972 782 HG3 GLU 104 2HG GLU 104 -3.495 -7.175 -24.596 783 H MET 105 H MET 105 -0.707 -9.302 -20.641 784 HA MET 105 HA MET 105 -0.679 -12.092 -21.155 785 HB2 MET 105 1HB MET 105 1.421 -10.995 -21.044 786 HB3 MET 105 2HB MET 105 1.056 -10.292 -19.474 787 HG2 MET 105 1HG MET 105 1.564 -12.196 -18.342 788 HG3 MET 105 2HG MET 105 1.105 -13.246 -19.681 789 HE1 MET 105 3HE MET 105 4.170 -11.446 -17.905 790 HE2 MET 105 1HE MET 105 5.063 -10.929 -19.336 791 HE3 MET 105 2HE MET 105 3.455 -10.279 -19.018 792 H VAL 106 H VAL 106 -1.180 -10.182 -18.204 793 HA VAL 106 HA VAL 106 -1.647 -12.519 -16.589 794 HB VAL 106 HB VAL 106 -2.192 -9.621 -15.929 795 HG11 VAL 106 1HG1 VAL 106 -1.761 -11.934 -14.049 796 HG12 VAL 106 2HG1 VAL 106 -2.277 -10.295 -13.648 797 HG13 VAL 106 3HG1 VAL 106 -3.355 -11.365 -14.546 798 HG21 VAL 106 3HG2 VAL 106 0.087 -9.622 -16.286 799 HG22 VAL 106 1HG2 VAL 106 0.000 -10.035 -14.573 800 HG23 VAL 106 2HG2 VAL 106 0.275 -11.299 -15.772 801 H GLN 107 H GLN 107 -3.689 -9.771 -17.598 802 HA GLN 107 HA GLN 107 -6.104 -10.865 -16.659 803 HB2 GLN 107 1HB GLN 107 -5.780 -8.917 -18.944 804 HB3 GLN 107 2HB GLN 107 -7.205 -9.143 -17.939 805 HG2 GLN 107 1HG GLN 107 -6.210 -8.125 -16.091 806 HG3 GLN 107 2HG GLN 107 -4.588 -8.288 -16.762 807 HE21 GLN 107 2HE2 GLN 107 -7.517 -7.112 -18.333 808 HE22 GLN 107 1HE2 GLN 107 -6.929 -5.517 -18.641 809 H SER 108 H SER 108 -4.240 -11.499 -19.479 810 HA SER 108 HA SER 108 -6.231 -13.451 -20.347 811 HB2 SER 108 1HB SER 108 -6.896 -11.963 -21.946 812 HB3 SER 108 2HB SER 108 -5.382 -11.061 -21.886 813 HG SER 108 HG SER 108 -6.136 -12.962 -23.615 Start of MODEL 15 1 H1 SER 1 H SER 1 2.789 0.485 0.444 2 HA SER 1 HA SER 1 0.986 0.498 -1.607 3 HB2 SER 1 1HB SER 1 3.681 1.700 -1.234 4 HB3 SER 1 2HB SER 1 3.013 1.721 -2.865 5 HG SER 1 HG SER 1 1.088 2.660 -1.855 6 H LEU 2 H LEU 2 2.342 -2.153 -1.195 7 HA LEU 2 HA LEU 2 3.061 -2.645 -4.010 8 HB2 LEU 2 1HB LEU 2 5.046 -3.020 -2.863 9 HB3 LEU 2 2HB LEU 2 4.222 -3.726 -1.475 10 HG LEU 2 HG LEU 2 3.787 -5.758 -2.743 11 HD11 LEU 2 1HD1 LEU 2 4.358 -4.082 -4.970 12 HD12 LEU 2 2HD1 LEU 2 3.757 -5.739 -4.957 13 HD13 LEU 2 3HD1 LEU 2 5.494 -5.431 -4.973 14 HD21 LEU 2 3HD2 LEU 2 6.676 -4.899 -2.896 15 HD22 LEU 2 1HD2 LEU 2 6.082 -6.560 -2.929 16 HD23 LEU 2 2HD2 LEU 2 5.872 -5.577 -1.479 17 H THR 3 H THR 3 1.719 -4.132 -1.074 18 HA THR 3 HA THR 3 0.160 -5.945 -2.795 19 HB THR 3 HB THR 3 -0.016 -7.467 -0.928 20 HG1 THR 3 HG1 THR 3 1.547 -5.607 0.564 21 HG21 THR 3 3HG2 THR 3 2.866 -6.610 -0.972 22 HG22 THR 3 1HG2 THR 3 2.100 -7.376 -2.362 23 HG23 THR 3 2HG2 THR 3 2.205 -8.238 -0.827 24 H ASP 4 H ASP 4 -0.711 -3.311 -2.435 25 HA ASP 4 HA ASP 4 -2.653 -3.176 -0.329 26 HB2 ASP 4 1HB ASP 4 -1.657 -1.125 -1.141 27 HB3 ASP 4 2HB ASP 4 -2.221 -1.454 -2.777 28 H ILE 5 H ILE 5 -3.253 -2.794 -3.812 29 HA ILE 5 HA ILE 5 -5.939 -3.575 -3.677 30 HB ILE 5 HB ILE 5 -4.415 -2.464 -5.612 31 HG12 ILE 5 1HG1 ILE 5 -6.712 -3.735 -6.835 32 HG13 ILE 5 2HG1 ILE 5 -7.105 -3.150 -5.222 33 HG21 ILE 5 1HG2 ILE 5 -3.421 -4.711 -6.099 34 HG22 ILE 5 2HG2 ILE 5 -5.014 -5.225 -6.652 35 HG23 ILE 5 3HG2 ILE 5 -4.172 -3.918 -7.484 36 HD11 ILE 5 3HD1 ILE 5 -7.598 -1.495 -6.941 37 HD12 ILE 5 1HD1 ILE 5 -6.353 -0.925 -5.829 38 HD13 ILE 5 2HD1 ILE 5 -5.905 -1.502 -7.435 39 H LEU 6 H LEU 6 -3.028 -5.436 -3.875 40 HA LEU 6 HA LEU 6 -4.521 -7.873 -4.516 41 HB2 LEU 6 1HB LEU 6 -2.219 -7.084 -5.539 42 HB3 LEU 6 2HB LEU 6 -1.576 -7.856 -4.091 43 HG LEU 6 HG LEU 6 -1.833 -9.147 -6.393 44 HD11 LEU 6 1HD1 LEU 6 -2.581 -11.078 -4.492 45 HD12 LEU 6 2HD1 LEU 6 -1.631 -9.866 -3.634 46 HD13 LEU 6 3HD1 LEU 6 -0.957 -10.674 -5.049 47 HD21 LEU 6 3HD2 LEU 6 -4.310 -8.694 -6.402 48 HD22 LEU 6 1HD2 LEU 6 -4.437 -9.797 -5.032 49 HD23 LEU 6 2HD2 LEU 6 -3.845 -10.386 -6.586 50 H SER 7 H SER 7 -3.805 -9.868 -3.279 51 HA SER 7 HA SER 7 -4.077 -9.294 -0.447 52 HB2 SER 7 1HB SER 7 -5.474 -11.043 -1.491 53 HB3 SER 7 2HB SER 7 -4.019 -11.953 -1.898 54 HG SER 7 HG SER 7 -5.153 -11.451 0.631 55 HA PRO 8 HA PRO 8 0.320 -9.653 0.169 56 HB2 PRO 8 1HB PRO 8 0.246 -9.339 2.864 57 HB3 PRO 8 2HB PRO 8 0.077 -7.990 1.736 58 HG2 PRO 8 1HG PRO 8 -2.044 -9.505 3.207 59 HG3 PRO 8 2HG PRO 8 -1.897 -7.758 2.943 60 HD2 PRO 8 1HD PRO 8 -3.551 -9.319 1.474 61 HD3 PRO 8 2HD PRO 8 -2.751 -7.882 0.806 62 H SER 9 H SER 9 -2.149 -11.560 1.754 63 HA SER 9 HA SER 9 -0.180 -13.525 2.652 64 HB2 SER 9 1HB SER 9 -3.129 -13.876 3.038 65 HB3 SER 9 2HB SER 9 -1.797 -14.361 4.088 66 HG SER 9 HG SER 9 -2.229 -12.593 5.128 67 H ASP 10 H ASP 10 -0.976 -13.008 -0.209 68 HA ASP 10 HA ASP 10 -1.695 -15.787 -0.867 69 HB2 ASP 10 1HB ASP 10 -2.582 -13.273 -2.297 70 HB3 ASP 10 2HB ASP 10 -2.844 -14.908 -2.897 71 H ILE 11 H ILE 11 0.165 -12.929 -1.635 72 HA ILE 11 HA ILE 11 1.367 -13.886 -4.012 73 HB ILE 11 HB ILE 11 2.447 -11.864 -2.046 74 HG12 ILE 11 1HG1 ILE 11 1.294 -10.925 -4.575 75 HG13 ILE 11 2HG1 ILE 11 0.123 -11.698 -3.511 76 HG21 ILE 11 1HG2 ILE 11 3.562 -13.015 -4.417 77 HG22 ILE 11 2HG2 ILE 11 3.261 -11.298 -4.676 78 HG23 ILE 11 3HG2 ILE 11 4.262 -11.823 -3.322 79 HD11 ILE 11 3HD1 ILE 11 0.672 -10.159 -1.736 80 HD12 ILE 11 1HD1 ILE 11 1.930 -9.423 -2.729 81 HD13 ILE 11 2HD1 ILE 11 0.235 -9.272 -3.196 82 H ALA 12 H ALA 12 2.071 -14.333 -0.625 83 HA ALA 12 HA ALA 12 4.725 -15.302 -0.934 84 HB1 ALA 12 1HB ALA 12 4.697 -15.153 1.278 85 HB2 ALA 12 2HB ALA 12 2.984 -14.737 1.208 86 HB3 ALA 12 3HB ALA 12 3.476 -16.422 1.379 87 H ALA 13 H ALA 13 1.551 -16.804 -0.992 88 HA ALA 13 HA ALA 13 2.344 -19.488 -0.775 89 HB1 ALA 13 1HB ALA 13 -0.057 -18.103 -1.878 90 HB2 ALA 13 2HB ALA 13 0.151 -19.833 -2.151 91 HB3 ALA 13 3HB ALA 13 0.077 -19.203 -0.505 92 H ALA 14 H ALA 14 2.489 -17.246 -3.416 93 HA ALA 14 HA ALA 14 2.911 -19.315 -5.406 94 HB1 ALA 14 1HB ALA 14 1.751 -16.977 -5.689 95 HB2 ALA 14 2HB ALA 14 3.405 -16.433 -5.970 96 HB3 ALA 14 3HB ALA 14 2.700 -17.680 -6.998 97 H LEU 15 H LEU 15 4.791 -16.731 -3.856 98 HA LEU 15 HA LEU 15 7.194 -17.082 -5.202 99 HB2 LEU 15 1HB LEU 15 6.618 -16.217 -2.380 100 HB3 LEU 15 2HB LEU 15 8.237 -16.192 -3.075 101 HG LEU 15 HG LEU 15 5.897 -14.647 -4.185 102 HD11 LEU 15 1HD1 LEU 15 7.854 -12.942 -3.082 103 HD12 LEU 15 2HD1 LEU 15 7.460 -14.144 -1.854 104 HD13 LEU 15 3HD1 LEU 15 6.181 -13.162 -2.568 105 HD21 LEU 15 3HD2 LEU 15 7.744 -15.226 -5.751 106 HD22 LEU 15 1HD2 LEU 15 8.854 -14.356 -4.693 107 HD23 LEU 15 2HD2 LEU 15 7.540 -13.492 -5.493 108 H ARG 16 H ARG 16 5.695 -19.052 -2.790 109 HA ARG 16 HA ARG 16 8.144 -20.532 -2.245 110 HB2 ARG 16 1HB ARG 16 6.557 -20.019 -0.409 111 HB3 ARG 16 2HB ARG 16 5.339 -20.997 -1.218 112 HG2 ARG 16 1HG ARG 16 7.524 -22.682 -1.030 113 HG3 ARG 16 2HG ARG 16 7.524 -21.801 0.499 114 HD2 ARG 16 1HD ARG 16 5.237 -23.365 -0.692 115 HD3 ARG 16 2HD ARG 16 6.200 -23.810 0.716 116 HE ARG 16 HE ARG 16 5.163 -21.384 1.371 117 HH11 ARG 16 1HH1 ARG 16 3.802 -24.401 0.291 118 HH12 ARG 16 2HH1 ARG 16 2.305 -24.177 1.133 119 HH21 ARG 16 1HH2 ARG 16 3.195 -21.077 2.484 120 HH22 ARG 16 2HH2 ARG 16 1.960 -22.285 2.379 121 H ASP 17 H ASP 17 4.863 -21.267 -3.432 122 HA ASP 17 HA ASP 17 5.396 -23.902 -4.222 123 HB2 ASP 17 1HB ASP 17 3.145 -22.512 -4.038 124 HB3 ASP 17 2HB ASP 17 3.426 -22.269 -5.760 125 H CYS 18 H CYS 18 6.355 -20.935 -5.602 126 HA CYS 18 HA CYS 18 7.202 -22.332 -8.054 127 HB2 CYS 18 1HB CYS 18 6.600 -19.379 -7.851 128 HB3 CYS 18 2HB CYS 18 6.915 -20.309 -9.311 129 HG CYS 18 HG CYS 18 4.316 -20.019 -9.652 130 H GLN 19 H GLN 19 8.778 -22.394 -5.796 131 HA GLN 19 HA GLN 19 10.764 -20.286 -6.019 132 HB2 GLN 19 1HB GLN 19 9.962 -21.404 -3.833 133 HB3 GLN 19 2HB GLN 19 11.012 -22.737 -4.296 134 HG2 GLN 19 1HG GLN 19 12.937 -21.484 -4.043 135 HG3 GLN 19 2HG GLN 19 12.080 -19.951 -4.198 136 HE21 GLN 19 2HE2 GLN 19 10.264 -19.799 -2.420 137 HE22 GLN 19 1HE2 GLN 19 10.827 -20.099 -0.814 138 H ALA 20 H ALA 20 10.165 -22.580 -8.033 139 HA ALA 20 HA ALA 20 12.933 -23.556 -8.279 140 HB1 ALA 20 1HB ALA 20 12.156 -25.559 -8.885 141 HB2 ALA 20 2HB ALA 20 10.601 -25.007 -8.261 142 HB3 ALA 20 3HB ALA 20 10.962 -24.862 -9.981 143 HA PRO 21 HA PRO 21 13.570 -21.393 -12.043 144 HB2 PRO 21 1HB PRO 21 14.911 -23.209 -13.552 145 HB3 PRO 21 2HB PRO 21 15.636 -22.392 -12.162 146 HG2 PRO 21 1HG PRO 21 14.446 -25.133 -12.339 147 HG3 PRO 21 2HG PRO 21 15.934 -24.610 -11.530 148 HD2 PRO 21 1HD PRO 21 13.623 -25.048 -10.189 149 HD3 PRO 21 2HD PRO 21 14.802 -23.820 -9.684 150 H ASP 22 H ASP 22 12.384 -20.916 -13.791 151 HA ASP 22 HA ASP 22 10.885 -21.075 -15.495 152 HB2 ASP 22 1HB ASP 22 12.570 -22.780 -16.293 153 HB3 ASP 22 2HB ASP 22 11.548 -24.021 -15.572 154 H SER 23 H SER 23 10.179 -21.711 -12.638 155 HA SER 23 HA SER 23 7.674 -23.175 -13.161 156 HB2 SER 23 1HB SER 23 9.181 -24.330 -11.572 157 HB3 SER 23 2HB SER 23 9.152 -22.908 -10.530 158 HG SER 23 HG SER 23 6.975 -24.591 -11.216 159 H PHE 24 H PHE 24 9.090 -20.227 -12.189 160 HA PHE 24 HA PHE 24 6.535 -19.249 -11.113 161 HB2 PHE 24 1HB PHE 24 8.281 -18.826 -9.559 162 HB3 PHE 24 2HB PHE 24 9.365 -18.252 -10.822 163 HD1 PHE 24 HD1 PHE 24 6.192 -17.443 -9.076 164 HD2 PHE 24 HD2 PHE 24 9.506 -15.985 -11.313 165 HE1 PHE 24 HE1 PHE 24 5.466 -15.132 -8.639 166 HE2 PHE 24 HE2 PHE 24 8.787 -13.673 -10.879 167 HZ PHE 24 HZ PHE 24 6.765 -13.244 -9.540 168 H SER 25 H SER 25 5.330 -17.903 -12.277 169 HA SER 25 HA SER 25 6.538 -16.138 -14.240 170 HB2 SER 25 1HB SER 25 4.246 -17.615 -15.363 171 HB3 SER 25 2HB SER 25 5.748 -17.104 -16.133 172 HG SER 25 HG SER 25 5.925 -19.266 -16.035 173 HA PRO 26 HA PRO 26 3.276 -13.427 -13.123 174 HB2 PRO 26 1HB PRO 26 2.765 -12.138 -15.457 175 HB3 PRO 26 2HB PRO 26 4.231 -11.862 -14.509 176 HG2 PRO 26 1HG PRO 26 3.836 -13.576 -16.931 177 HG3 PRO 26 2HG PRO 26 5.174 -12.479 -16.543 178 HD2 PRO 26 1HD PRO 26 5.345 -15.160 -16.207 179 HD3 PRO 26 2HD PRO 26 6.193 -14.010 -15.154 180 H LYS 27 H LYS 27 2.750 -15.617 -15.786 181 HA LYS 27 HA LYS 27 -0.148 -15.218 -15.647 182 HB2 LYS 27 1HB LYS 27 -0.300 -16.404 -17.703 183 HB3 LYS 27 2HB LYS 27 1.061 -15.301 -17.863 184 HG2 LYS 27 1HG LYS 27 2.514 -17.287 -17.165 185 HG3 LYS 27 2HG LYS 27 1.091 -18.276 -17.504 186 HD2 LYS 27 1HD LYS 27 1.051 -17.548 -19.786 187 HD3 LYS 27 2HD LYS 27 2.312 -16.352 -19.479 188 HE2 LYS 27 1HE LYS 27 3.300 -18.237 -20.584 189 HE3 LYS 27 2HE LYS 27 3.857 -18.213 -18.912 190 HZ1 LYS 27 3HZ LYS 27 2.794 -20.121 -18.438 191 HZ2 LYS 27 1HZ LYS 27 2.888 -20.379 -20.107 192 HZ3 LYS 27 2HZ LYS 27 1.464 -19.774 -19.424 193 H LYS 28 H LYS 28 1.558 -16.601 -13.591 194 HA LYS 28 HA LYS 28 0.026 -19.114 -13.525 195 HB2 LYS 28 1HB LYS 28 2.588 -19.256 -14.032 196 HB3 LYS 28 2HB LYS 28 2.761 -18.942 -12.311 197 HG2 LYS 28 1HG LYS 28 0.888 -21.091 -13.100 198 HG3 LYS 28 2HG LYS 28 2.613 -21.397 -13.324 199 HD2 LYS 28 1HD LYS 28 3.046 -20.963 -10.999 200 HD3 LYS 28 2HD LYS 28 1.377 -20.450 -10.740 201 HE2 LYS 28 1HE LYS 28 0.588 -22.693 -11.226 202 HE3 LYS 28 2HE LYS 28 2.232 -23.218 -11.585 203 HZ1 LYS 28 3HZ LYS 28 2.153 -22.039 -9.026 204 HZ2 LYS 28 1HZ LYS 28 2.561 -23.626 -9.449 205 HZ3 LYS 28 2HZ LYS 28 0.951 -23.225 -9.123 206 H PHE 29 H PHE 29 1.681 -16.591 -11.694 207 HA PHE 29 HA PHE 29 0.528 -17.474 -9.190 208 HB2 PHE 29 1HB PHE 29 1.968 -16.013 -8.156 209 HB3 PHE 29 2HB PHE 29 2.842 -16.264 -9.664 210 HD1 PHE 29 HD2 PHE 29 2.251 -14.579 -11.583 211 HD2 PHE 29 HD1 PHE 29 1.566 -13.867 -7.443 212 HE1 PHE 29 HE2 PHE 29 2.206 -12.157 -12.011 213 HE2 PHE 29 HE1 PHE 29 1.519 -11.443 -7.865 214 HZ PHE 29 HZ PHE 29 1.841 -10.585 -10.151 215 H PHE 30 H PHE 30 -0.483 -15.619 -11.790 216 HA PHE 30 HA PHE 30 -1.852 -13.485 -10.678 217 HB2 PHE 30 1HB PHE 30 -3.157 -13.424 -12.674 218 HB3 PHE 30 2HB PHE 30 -1.561 -14.006 -13.135 219 HD1 PHE 30 HD1 PHE 30 -1.258 -16.552 -13.317 220 HD2 PHE 30 HD2 PHE 30 -5.050 -14.620 -13.260 221 HE1 PHE 30 HE1 PHE 30 -2.280 -18.535 -14.356 222 HE2 PHE 30 HE2 PHE 30 -6.079 -16.600 -14.297 223 HZ PHE 30 HZ PHE 30 -4.694 -18.561 -14.846 224 H GLN 31 H GLN 31 -2.613 -16.874 -10.624 225 HA GLN 31 HA GLN 31 -5.288 -16.362 -9.567 226 HB2 GLN 31 1HB GLN 31 -5.744 -18.661 -9.907 227 HB3 GLN 31 2HB GLN 31 -4.839 -18.136 -11.320 228 HG2 GLN 31 1HG GLN 31 -2.807 -18.989 -9.820 229 HG3 GLN 31 2HG GLN 31 -4.085 -20.015 -9.171 230 HE21 GLN 31 2HE2 GLN 31 -1.654 -20.169 -11.167 231 HE22 GLN 31 1HE2 GLN 31 -2.279 -21.191 -12.411 232 H ILE 32 H ILE 32 -2.123 -17.405 -8.574 233 HA ILE 32 HA ILE 32 -2.901 -18.520 -6.068 234 HB ILE 32 HB ILE 32 -0.219 -17.472 -6.979 235 HG12 ILE 32 1HG1 ILE 32 -0.894 -20.365 -6.636 236 HG13 ILE 32 2HG1 ILE 32 -1.446 -19.533 -8.085 237 HG21 ILE 32 1HG2 ILE 32 -0.089 -17.455 -4.650 238 HG22 ILE 32 2HG2 ILE 32 -1.076 -18.907 -4.492 239 HG23 ILE 32 3HG2 ILE 32 0.576 -19.026 -5.097 240 HD11 ILE 32 3HD1 ILE 32 1.380 -19.123 -7.420 241 HD12 ILE 32 1HD1 ILE 32 0.935 -20.775 -7.846 242 HD13 ILE 32 2HD1 ILE 32 0.609 -19.456 -8.970 243 H SER 33 H SER 33 -1.528 -15.384 -7.028 244 HA SER 33 HA SER 33 -1.651 -14.324 -4.367 245 HB2 SER 33 1HB SER 33 -0.439 -12.602 -5.201 246 HB3 SER 33 2HB SER 33 -0.255 -13.639 -6.615 247 HG SER 33 HG SER 33 -2.210 -12.600 -7.416 248 H GLY 34 H GLY 34 -3.601 -14.018 -7.305 249 HA2 GLY 34 1HA GLY 34 -6.038 -13.870 -6.923 250 HA3 GLY 34 2HA GLY 34 -5.676 -12.697 -5.665 251 H MET 35 H MET 35 -3.839 -12.604 -8.592 252 HA MET 35 HA MET 35 -4.769 -9.946 -9.151 253 HB2 MET 35 1HB MET 35 -2.846 -11.768 -10.602 254 HB3 MET 35 2HB MET 35 -3.196 -10.120 -11.105 255 HG2 MET 35 1HG MET 35 -2.538 -9.618 -8.586 256 HG3 MET 35 2HG MET 35 -1.628 -11.112 -8.800 257 HE1 MET 35 3HE MET 35 -1.292 -10.107 -12.359 258 HE2 MET 35 1HE MET 35 0.438 -10.198 -12.028 259 HE3 MET 35 2HE MET 35 -0.653 -11.410 -11.356 260 H SER 36 H SER 36 -5.751 -13.067 -10.047 261 HA SER 36 HA SER 36 -6.614 -12.798 -12.661 262 HB2 SER 36 1HB SER 36 -6.690 -14.915 -11.385 263 HB3 SER 36 2HB SER 36 -8.031 -14.281 -10.432 264 HG SER 36 HG SER 36 -8.914 -15.480 -12.066 265 H LYS 37 H LYS 37 -8.039 -11.574 -9.708 266 HA LYS 37 HA LYS 37 -10.567 -10.878 -10.771 267 HB2 LYS 37 1HB LYS 37 -9.099 -9.597 -8.459 268 HB3 LYS 37 2HB LYS 37 -10.826 -9.505 -8.777 269 HG2 LYS 37 1HG LYS 37 -11.038 -11.901 -8.405 270 HG3 LYS 37 2HG LYS 37 -9.299 -12.017 -8.121 271 HD2 LYS 37 1HD LYS 37 -9.784 -10.188 -6.308 272 HD3 LYS 37 2HD LYS 37 -11.431 -10.812 -6.412 273 HE2 LYS 37 1HE LYS 37 -8.946 -12.405 -5.787 274 HE3 LYS 37 2HE LYS 37 -10.199 -11.932 -4.640 275 HZ1 LYS 37 3HZ LYS 37 -11.620 -13.200 -6.535 276 HZ2 LYS 37 1HZ LYS 37 -11.050 -13.928 -5.118 277 HZ3 LYS 37 2HZ LYS 37 -10.180 -14.087 -6.559 278 H LYS 38 H LYS 38 -7.451 -9.315 -10.785 279 HA LYS 38 HA LYS 38 -8.110 -6.684 -11.290 280 HB2 LYS 38 1HB LYS 38 -5.861 -8.263 -12.553 281 HB3 LYS 38 2HB LYS 38 -5.953 -6.509 -12.451 282 HG2 LYS 38 1HG LYS 38 -5.605 -8.475 -10.205 283 HG3 LYS 38 2HG LYS 38 -4.483 -7.223 -10.745 284 HD2 LYS 38 1HD LYS 38 -5.365 -6.021 -9.062 285 HD3 LYS 38 2HD LYS 38 -6.700 -5.750 -10.185 286 HE2 LYS 38 1HE LYS 38 -8.112 -6.957 -8.945 287 HE3 LYS 38 2HE LYS 38 -6.945 -8.264 -8.749 288 HZ1 LYS 38 3HZ LYS 38 -6.882 -5.742 -7.187 289 HZ2 LYS 38 1HZ LYS 38 -5.940 -7.124 -6.932 290 HZ3 LYS 38 2HZ LYS 38 -7.606 -7.171 -6.644 291 H SER 39 H SER 39 -7.735 -5.567 -13.481 292 HA SER 39 HA SER 39 -8.675 -7.055 -15.781 293 HB2 SER 39 1HB SER 39 -10.508 -5.230 -16.111 294 HB3 SER 39 2HB SER 39 -10.832 -6.580 -15.025 295 HG SER 39 HG SER 39 -10.761 -5.271 -13.351 296 H SER 40 H SER 40 -6.238 -5.812 -15.315 297 HA SER 40 HA SER 40 -4.737 -4.397 -16.275 298 HB2 SER 40 1HB SER 40 -4.956 -4.041 -18.540 299 HB3 SER 40 2HB SER 40 -6.169 -5.303 -18.322 300 HG SER 40 HG SER 40 -7.558 -3.918 -19.041 301 H SER 41 H SER 41 -6.973 -3.408 -14.466 302 HA SER 41 HA SER 41 -6.719 -0.547 -15.127 303 HB2 SER 41 1HB SER 41 -9.070 -1.715 -15.148 304 HB3 SER 41 2HB SER 41 -8.940 -1.574 -13.395 305 HG SER 41 HG SER 41 -9.635 0.380 -13.713 306 H GLN 42 H GLN 42 -5.942 -2.993 -12.955 307 HA GLN 42 HA GLN 42 -5.303 -1.013 -10.869 308 HB2 GLN 42 1HB GLN 42 -5.973 -3.932 -10.459 309 HB3 GLN 42 2HB GLN 42 -5.579 -2.773 -9.196 310 HG2 GLN 42 1HG GLN 42 -7.729 -2.314 -9.009 311 HG3 GLN 42 2HG GLN 42 -7.695 -1.644 -10.639 312 HE21 GLN 42 2HE2 GLN 42 -7.272 -3.953 -12.102 313 HE22 GLN 42 1HE2 GLN 42 -8.665 -4.966 -11.974 314 H LEU 43 H LEU 43 -4.176 -3.465 -12.969 315 HA LEU 43 HA LEU 43 -1.947 -4.489 -11.730 316 HB2 LEU 43 1HB LEU 43 -2.164 -3.629 -14.612 317 HB3 LEU 43 2HB LEU 43 -0.978 -4.758 -13.958 318 HG LEU 43 HG LEU 43 -3.804 -5.181 -14.693 319 HD11 LEU 43 1HD1 LEU 43 -1.412 -6.133 -15.545 320 HD12 LEU 43 2HD1 LEU 43 -2.958 -6.944 -15.790 321 HD13 LEU 43 3HD1 LEU 43 -1.920 -7.415 -14.445 322 HD21 LEU 43 3HD2 LEU 43 -4.189 -5.582 -12.428 323 HD22 LEU 43 1HD2 LEU 43 -2.588 -6.281 -12.183 324 HD23 LEU 43 2HD2 LEU 43 -3.814 -7.178 -13.079 325 H LYS 44 H LYS 44 -2.321 -1.355 -13.307 326 HA LYS 44 HA LYS 44 0.446 -0.648 -12.746 327 HB2 LYS 44 1HB LYS 44 -0.150 1.493 -13.883 328 HB3 LYS 44 2HB LYS 44 -0.403 0.065 -14.879 329 HG2 LYS 44 1HG LYS 44 -2.292 1.343 -15.277 330 HG3 LYS 44 2HG LYS 44 -2.837 0.183 -14.063 331 HD2 LYS 44 1HD LYS 44 -3.387 1.839 -12.687 332 HD3 LYS 44 2HD LYS 44 -1.739 2.468 -12.745 333 HE2 LYS 44 1HE LYS 44 -2.389 3.557 -14.942 334 HE3 LYS 44 2HE LYS 44 -4.056 3.146 -14.541 335 HZ1 LYS 44 3HZ LYS 44 -2.650 5.375 -13.728 336 HZ2 LYS 44 1HZ LYS 44 -2.786 4.410 -12.346 337 HZ3 LYS 44 2HZ LYS 44 -4.174 4.880 -13.189 338 H GLU 45 H GLU 45 -2.644 -0.335 -11.318 339 HA GLU 45 HA GLU 45 -2.539 2.056 -9.957 340 HB2 GLU 45 1HB GLU 45 -4.467 0.511 -9.933 341 HB3 GLU 45 2HB GLU 45 -3.568 -0.576 -8.883 342 HG2 GLU 45 1HG GLU 45 -5.230 0.856 -7.715 343 HG3 GLU 45 2HG GLU 45 -3.583 0.998 -7.103 344 H ILE 46 H ILE 46 -1.110 -1.050 -9.014 345 HA ILE 46 HA ILE 46 0.072 0.082 -6.632 346 HB ILE 46 HB ILE 46 0.739 -2.606 -7.805 347 HG12 ILE 46 1HG1 ILE 46 -1.170 -3.098 -5.889 348 HG13 ILE 46 2HG1 ILE 46 -1.800 -1.657 -6.679 349 HG21 ILE 46 1HG2 ILE 46 0.466 -2.338 -4.922 350 HG22 ILE 46 2HG2 ILE 46 1.793 -2.996 -5.878 351 HG23 ILE 46 3HG2 ILE 46 1.685 -1.258 -5.599 352 HD11 ILE 46 3HD1 ILE 46 -1.843 -4.370 -7.562 353 HD12 ILE 46 1HD1 ILE 46 -2.618 -2.952 -8.268 354 HD13 ILE 46 2HD1 ILE 46 -0.970 -3.379 -8.730 355 H PHE 47 H PHE 47 0.914 -0.235 -9.920 356 HA PHE 47 HA PHE 47 2.909 -0.101 -11.064 357 HB2 PHE 47 1HB PHE 47 4.181 1.989 -10.386 358 HB3 PHE 47 2HB PHE 47 2.473 2.215 -10.749 359 HD1 PHE 47 HD2 PHE 47 5.012 2.181 -8.118 360 HD2 PHE 47 HD1 PHE 47 0.897 2.790 -9.020 361 HE1 PHE 47 HE2 PHE 47 4.689 3.234 -5.918 362 HE2 PHE 47 HE1 PHE 47 0.567 3.845 -6.821 363 HZ PHE 47 HZ PHE 47 2.464 4.067 -5.267 364 H ARG 48 H ARG 48 3.104 -2.115 -9.163 365 HA ARG 48 HA ARG 48 5.968 -2.054 -8.642 366 HB2 ARG 48 1HB ARG 48 3.863 -2.354 -6.518 367 HB3 ARG 48 2HB ARG 48 5.451 -3.085 -6.324 368 HG2 ARG 48 1HG ARG 48 6.280 -0.661 -6.906 369 HG3 ARG 48 2HG ARG 48 4.669 -0.218 -6.337 370 HD2 ARG 48 1HD ARG 48 5.098 -0.874 -4.187 371 HD3 ARG 48 2HD ARG 48 6.280 -2.087 -4.680 372 HE ARG 48 HE ARG 48 7.493 0.244 -5.311 373 HH11 ARG 48 1HH1 ARG 48 5.980 -0.952 -2.413 374 HH12 ARG 48 2HH1 ARG 48 7.001 -0.042 -1.348 375 HH21 ARG 48 1HH2 ARG 48 8.843 1.447 -3.920 376 HH22 ARG 48 2HH2 ARG 48 8.628 1.323 -2.207 377 H ILE 49 H ILE 49 3.788 -3.496 -10.268 378 HA ILE 49 HA ILE 49 4.614 -6.234 -9.554 379 HB ILE 49 HB ILE 49 2.549 -7.076 -10.476 380 HG12 ILE 49 1HG1 ILE 49 1.833 -4.187 -11.025 381 HG13 ILE 49 2HG1 ILE 49 2.263 -5.379 -12.246 382 HG21 ILE 49 1HG2 ILE 49 1.876 -4.781 -8.647 383 HG22 ILE 49 2HG2 ILE 49 1.017 -6.311 -8.814 384 HG23 ILE 49 3HG2 ILE 49 2.633 -6.280 -8.108 385 HD11 ILE 49 3HD1 ILE 49 0.022 -5.540 -12.406 386 HD12 ILE 49 1HD1 ILE 49 0.251 -6.681 -11.081 387 HD13 ILE 49 2HD1 ILE 49 -0.246 -5.023 -10.741 388 H LEU 50 H LEU 50 4.374 -3.821 -12.017 389 HA LEU 50 HA LEU 50 5.062 -5.693 -14.141 390 HB2 LEU 50 1HB LEU 50 4.852 -2.711 -14.402 391 HB3 LEU 50 2HB LEU 50 4.680 -3.936 -15.657 392 HG LEU 50 HG LEU 50 2.708 -3.782 -13.407 393 HD11 LEU 50 1HD1 LEU 50 2.882 -1.519 -14.347 394 HD12 LEU 50 2HD1 LEU 50 1.334 -2.278 -14.716 395 HD13 LEU 50 3HD1 LEU 50 2.583 -2.177 -15.956 396 HD21 LEU 50 3HD2 LEU 50 1.222 -4.667 -15.206 397 HD22 LEU 50 1HD2 LEU 50 2.563 -5.732 -14.784 398 HD23 LEU 50 2HD2 LEU 50 2.637 -4.764 -16.256 399 H ASP 51 H ASP 51 6.361 -2.518 -13.161 400 HA ASP 51 HA ASP 51 9.070 -3.627 -13.393 401 HB2 ASP 51 1HB ASP 51 8.069 -2.112 -15.390 402 HB3 ASP 51 2HB ASP 51 8.707 -0.845 -14.345 403 H ASN 52 H ASN 52 10.557 -1.442 -12.816 404 HA ASN 52 HA ASN 52 9.482 -0.393 -10.289 405 HB2 ASN 52 1HB ASN 52 10.997 -2.346 -9.872 406 HB3 ASN 52 2HB ASN 52 12.302 -1.434 -10.625 407 HD21 ASN 52 2HD2 ASN 52 13.592 -0.484 -9.242 408 HD22 ASN 52 1HD2 ASN 52 13.157 0.121 -7.683 409 H ASP 53 H ASP 53 10.363 0.453 -13.208 410 HA ASP 53 HA ASP 53 11.770 2.889 -12.326 411 HB2 ASP 53 1HB ASP 53 12.603 2.952 -14.757 412 HB3 ASP 53 2HB ASP 53 13.335 1.769 -13.676 413 H GLN 54 H GLN 54 9.261 1.500 -14.332 414 HA GLN 54 HA GLN 54 7.516 2.406 -15.480 415 HB2 GLN 54 1HB GLN 54 7.519 3.471 -12.937 416 HB3 GLN 54 2HB GLN 54 7.404 4.900 -13.955 417 HG2 GLN 54 1HG GLN 54 5.208 4.078 -13.301 418 HG3 GLN 54 2HG GLN 54 5.438 3.999 -15.047 419 HE21 GLN 54 2HE2 GLN 54 5.023 2.202 -12.124 420 HE22 GLN 54 1HE2 GLN 54 4.806 0.653 -12.858 421 H SER 55 H SER 55 10.141 3.019 -16.467 422 HA SER 55 HA SER 55 10.089 5.782 -17.323 423 HB2 SER 55 1HB SER 55 11.978 3.483 -17.680 424 HB3 SER 55 2HB SER 55 12.102 4.880 -18.749 425 HG SER 55 HG SER 55 12.010 6.049 -16.559 426 H GLY 56 H GLY 56 8.993 2.734 -18.477 427 HA2 GLY 56 1HA GLY 56 7.349 3.595 -20.451 428 HA3 GLY 56 2HA GLY 56 8.905 3.494 -21.261 429 H PHE 57 H PHE 57 10.082 1.309 -20.652 430 HA PHE 57 HA PHE 57 8.102 -0.855 -20.936 431 HB2 PHE 57 1HB PHE 57 9.496 -1.959 -22.526 432 HB3 PHE 57 2HB PHE 57 9.363 -0.284 -23.050 433 HD1 PHE 57 HD1 PHE 57 11.268 1.301 -22.190 434 HD2 PHE 57 HD2 PHE 57 11.574 -2.937 -22.445 435 HE1 PHE 57 HE1 PHE 57 13.722 1.484 -22.232 436 HE2 PHE 57 HE2 PHE 57 14.028 -2.761 -22.487 437 HZ PHE 57 HZ PHE 57 15.105 -0.548 -22.380 438 H ILE 58 H ILE 58 9.754 -3.021 -20.839 439 HA ILE 58 HA ILE 58 11.147 -2.770 -18.257 440 HB ILE 58 HB ILE 58 9.495 -5.166 -19.049 441 HG12 ILE 58 1HG1 ILE 58 8.769 -2.930 -17.143 442 HG13 ILE 58 2HG1 ILE 58 8.059 -3.176 -18.735 443 HG21 ILE 58 1HG2 ILE 58 10.855 -4.340 -16.492 444 HG22 ILE 58 2HG2 ILE 58 9.709 -5.674 -16.611 445 HG23 ILE 58 3HG2 ILE 58 11.226 -5.734 -17.507 446 HD11 ILE 58 3HD1 ILE 58 7.751 -5.608 -17.415 447 HD12 ILE 58 1HD1 ILE 58 7.372 -4.371 -16.217 448 HD13 ILE 58 2HD1 ILE 58 6.507 -4.406 -17.754 449 H GLU 59 H GLU 59 12.862 -4.248 -17.894 450 HA GLU 59 HA GLU 59 13.789 -5.717 -20.264 451 HB2 GLU 59 1HB GLU 59 14.924 -3.447 -19.944 452 HB3 GLU 59 2HB GLU 59 15.664 -4.142 -18.509 453 HG2 GLU 59 1HG GLU 59 17.086 -4.196 -20.550 454 HG3 GLU 59 2HG GLU 59 16.827 -5.765 -19.791 455 H GLU 60 H GLU 60 15.545 -7.288 -19.724 456 HA GLU 60 HA GLU 60 14.725 -9.034 -17.703 457 HB2 GLU 60 1HB GLU 60 16.863 -10.223 -18.130 458 HB3 GLU 60 2HB GLU 60 15.976 -9.844 -19.600 459 HG2 GLU 60 1HG GLU 60 18.128 -9.298 -20.183 460 HG3 GLU 60 2HG GLU 60 17.483 -7.739 -19.671 461 H ASP 61 H ASP 61 16.759 -6.270 -17.580 462 HA ASP 61 HA ASP 61 18.231 -6.975 -15.239 463 HB2 ASP 61 1HB ASP 61 18.763 -5.168 -17.028 464 HB3 ASP 61 2HB ASP 61 17.689 -4.142 -16.081 465 H GLU 62 H GLU 62 15.017 -6.223 -15.715 466 HA GLU 62 HA GLU 62 14.727 -5.254 -12.947 467 HB2 GLU 62 1HB GLU 62 13.307 -4.562 -15.465 468 HB3 GLU 62 2HB GLU 62 12.347 -4.620 -13.994 469 HG2 GLU 62 1HG GLU 62 14.884 -3.033 -14.181 470 HG3 GLU 62 2HG GLU 62 13.321 -2.376 -14.661 471 H LEU 63 H LEU 63 14.831 -8.038 -14.199 472 HA LEU 63 HA LEU 63 12.268 -9.011 -13.119 473 HB2 LEU 63 1HB LEU 63 14.003 -10.515 -15.054 474 HB3 LEU 63 2HB LEU 63 12.322 -10.825 -14.625 475 HG LEU 63 HG LEU 63 13.348 -8.514 -16.273 476 HD11 LEU 63 1HD1 LEU 63 11.399 -10.334 -17.440 477 HD12 LEU 63 2HD1 LEU 63 12.927 -11.118 -17.039 478 HD13 LEU 63 3HD1 LEU 63 12.910 -9.711 -18.102 479 HD21 LEU 63 3HD2 LEU 63 11.307 -7.562 -16.208 480 HD22 LEU 63 1HD2 LEU 63 11.176 -8.423 -14.675 481 HD23 LEU 63 2HD2 LEU 63 10.467 -9.112 -16.136 482 H LYS 64 H LYS 64 15.683 -9.919 -13.558 483 HA LYS 64 HA LYS 64 15.831 -12.115 -11.928 484 HB2 LYS 64 1HB LYS 64 18.212 -11.309 -11.430 485 HB3 LYS 64 2HB LYS 64 17.778 -11.557 -13.116 486 HG2 LYS 64 1HG LYS 64 17.610 -9.243 -13.519 487 HG3 LYS 64 2HG LYS 64 17.627 -8.865 -11.795 488 HD2 LYS 64 1HD LYS 64 19.782 -8.340 -12.725 489 HD3 LYS 64 2HD LYS 64 19.945 -9.754 -11.681 490 HE2 LYS 64 1HE LYS 64 20.021 -11.222 -13.561 491 HE3 LYS 64 2HE LYS 64 19.582 -9.921 -14.666 492 HZ1 LYS 64 3HZ LYS 64 21.677 -9.165 -14.739 493 HZ2 LYS 64 1HZ LYS 64 22.091 -10.717 -14.208 494 HZ3 LYS 64 2HZ LYS 64 21.968 -9.448 -13.097 495 H TYR 65 H TYR 65 15.842 -8.718 -10.974 496 HA TYR 65 HA TYR 65 15.825 -9.545 -8.152 497 HB2 TYR 65 1HB TYR 65 16.686 -7.031 -9.542 498 HB3 TYR 65 2HB TYR 65 16.221 -6.981 -7.845 499 HD1 TYR 65 HD2 TYR 65 18.251 -9.318 -9.950 500 HD2 TYR 65 HD1 TYR 65 18.047 -6.912 -6.448 501 HE1 TYR 65 HE2 TYR 65 20.509 -10.059 -9.316 502 HE2 TYR 65 HE1 TYR 65 20.305 -7.645 -5.805 503 HH TYR 65 HH TYR 65 22.197 -8.664 -6.570 504 H PHE 66 H PHE 66 13.480 -9.992 -9.421 505 HA PHE 66 HA PHE 66 11.738 -7.701 -8.939 506 HB2 PHE 66 1HB PHE 66 11.466 -9.033 -11.016 507 HB3 PHE 66 2HB PHE 66 11.057 -10.437 -10.035 508 HD1 PHE 66 HD2 PHE 66 8.976 -10.402 -8.660 509 HD2 PHE 66 HD1 PHE 66 9.865 -7.388 -11.531 510 HE1 PHE 66 HE2 PHE 66 6.612 -9.720 -8.671 511 HE2 PHE 66 HE1 PHE 66 7.502 -6.701 -11.546 512 HZ PHE 66 HZ PHE 66 5.872 -7.868 -10.116 513 H LEU 67 H LEU 67 11.844 -11.149 -8.033 514 HA LEU 67 HA LEU 67 9.828 -11.086 -6.119 515 HB2 LEU 67 1HB LEU 67 12.291 -12.798 -5.920 516 HB3 LEU 67 2HB LEU 67 10.671 -13.156 -5.325 517 HG LEU 67 HG LEU 67 11.508 -13.039 -8.222 518 HD11 LEU 67 1HD1 LEU 67 12.396 -14.986 -7.053 519 HD12 LEU 67 2HD1 LEU 67 11.132 -15.449 -8.192 520 HD13 LEU 67 3HD1 LEU 67 10.780 -15.379 -6.465 521 HD21 LEU 67 3HD2 LEU 67 9.338 -12.662 -8.586 522 HD22 LEU 67 1HD2 LEU 67 8.909 -12.997 -6.908 523 HD23 LEU 67 2HD2 LEU 67 9.083 -14.325 -8.056 524 H GLN 68 H GLN 68 13.017 -9.822 -5.996 525 HA GLN 68 HA GLN 68 13.630 -9.901 -3.299 526 HB2 GLN 68 1HB GLN 68 14.866 -8.867 -5.423 527 HB3 GLN 68 2HB GLN 68 14.191 -7.378 -4.774 528 HG2 GLN 68 1HG GLN 68 15.613 -7.333 -3.046 529 HG3 GLN 68 2HG GLN 68 15.524 -9.075 -2.794 530 HE21 GLN 68 2HE2 GLN 68 16.371 -10.077 -5.155 531 HE22 GLN 68 1HE2 GLN 68 18.009 -9.617 -5.453 532 H ARG 69 H ARG 69 11.173 -8.118 -4.924 533 HA ARG 69 HA ARG 69 10.803 -6.210 -2.778 534 HB2 ARG 69 1HB ARG 69 9.351 -6.758 -5.358 535 HB3 ARG 69 2HB ARG 69 8.720 -5.633 -4.163 536 HG2 ARG 69 1HG ARG 69 11.510 -5.350 -5.204 537 HG3 ARG 69 2HG ARG 69 10.132 -4.724 -6.111 538 HD2 ARG 69 1HD ARG 69 10.766 -2.894 -4.846 539 HD3 ARG 69 2HD ARG 69 9.483 -3.603 -3.867 540 HE ARG 69 HE ARG 69 11.030 -4.092 -2.248 541 HH11 ARG 69 1HH1 ARG 69 12.675 -3.281 -5.207 542 HH12 ARG 69 2HH1 ARG 69 14.245 -3.239 -4.476 543 HH21 ARG 69 1HH2 ARG 69 13.092 -4.040 -1.274 544 HH22 ARG 69 2HH2 ARG 69 14.481 -3.672 -2.239 545 H PHE 70 H PHE 70 8.640 -8.610 -4.298 546 HA PHE 70 HA PHE 70 6.712 -8.622 -2.293 547 HB2 PHE 70 1HB PHE 70 7.529 -10.653 -4.352 548 HB3 PHE 70 2HB PHE 70 6.257 -11.013 -3.189 549 HD1 PHE 70 HD1 PHE 70 4.331 -9.282 -3.033 550 HD2 PHE 70 HD2 PHE 70 7.000 -9.597 -6.333 551 HE1 PHE 70 HE1 PHE 70 2.694 -8.128 -4.462 552 HE2 PHE 70 HE2 PHE 70 5.369 -8.443 -7.768 553 HZ PHE 70 HZ PHE 70 3.213 -7.706 -6.833 554 H GLU 71 H GLU 71 9.402 -10.912 -2.765 555 HA GLU 71 HA GLU 71 8.943 -12.061 -0.141 556 HB2 GLU 71 1HB GLU 71 9.663 -13.313 -2.301 557 HB3 GLU 71 2HB GLU 71 11.273 -12.725 -1.913 558 HG2 GLU 71 1HG GLU 71 10.831 -15.014 -1.103 559 HG3 GLU 71 2HG GLU 71 11.265 -13.884 0.179 560 H SER 72 H SER 72 10.828 -12.372 1.336 561 HA SER 72 HA SER 72 12.434 -9.905 1.434 562 HB2 SER 72 1HB SER 72 10.677 -10.528 3.286 563 HB3 SER 72 2HB SER 72 11.950 -11.608 3.853 564 HG SER 72 HG SER 72 11.759 -8.897 4.040 565 H GLY 73 H GLY 73 12.861 -12.784 0.303 566 HA2 GLY 73 1HA GLY 73 15.600 -13.007 1.358 567 HA3 GLY 73 2HA GLY 73 14.584 -14.438 1.273 568 H ALA 74 H ALA 74 13.855 -12.399 -1.268 569 HA ALA 74 HA ALA 74 15.006 -14.188 -3.183 570 HB1 ALA 74 1HB ALA 74 13.266 -13.412 -4.323 571 HB2 ALA 74 2HB ALA 74 13.037 -12.092 -3.175 572 HB3 ALA 74 3HB ALA 74 14.144 -11.896 -4.533 573 H ARG 75 H ARG 75 16.975 -14.103 -4.029 574 HA ARG 75 HA ARG 75 18.501 -11.599 -3.784 575 HB2 ARG 75 1HB ARG 75 20.376 -13.467 -4.395 576 HB3 ARG 75 2HB ARG 75 19.933 -13.008 -2.757 577 HG2 ARG 75 1HG ARG 75 18.598 -14.907 -2.463 578 HG3 ARG 75 2HG ARG 75 18.544 -15.241 -4.195 579 HD2 ARG 75 1HD ARG 75 20.946 -15.748 -4.158 580 HD3 ARG 75 2HD ARG 75 20.976 -15.440 -2.422 581 HE ARG 75 HE ARG 75 20.090 -17.519 -2.080 582 HH11 ARG 75 1HH1 ARG 75 19.614 -16.620 -5.409 583 HH12 ARG 75 2HH1 ARG 75 19.012 -18.175 -5.879 584 HH21 ARG 75 1HH2 ARG 75 19.299 -19.571 -2.686 585 HH22 ARG 75 2HH2 ARG 75 18.833 -19.852 -4.329 586 H VAL 76 H VAL 76 18.448 -14.443 -5.943 587 HA VAL 76 HA VAL 76 18.282 -12.670 -8.254 588 HB VAL 76 HB VAL 76 20.435 -14.777 -8.129 589 HG11 VAL 76 1HG1 VAL 76 20.038 -14.413 -10.361 590 HG12 VAL 76 2HG1 VAL 76 19.559 -12.732 -10.114 591 HG13 VAL 76 3HG1 VAL 76 21.263 -13.185 -10.041 592 HG21 VAL 76 3HG2 VAL 76 21.156 -13.213 -6.535 593 HG22 VAL 76 1HG2 VAL 76 21.978 -12.744 -8.023 594 HG23 VAL 76 2HG2 VAL 76 20.561 -11.847 -7.478 595 H LEU 77 H LEU 77 17.538 -13.685 -10.149 596 HA LEU 77 HA LEU 77 16.254 -16.283 -9.664 597 HB2 LEU 77 1HB LEU 77 15.603 -14.035 -11.553 598 HB3 LEU 77 2HB LEU 77 14.839 -15.621 -11.649 599 HG LEU 77 HG LEU 77 14.715 -14.170 -9.056 600 HD11 LEU 77 1HD1 LEU 77 12.435 -13.332 -10.305 601 HD12 LEU 77 2HD1 LEU 77 13.646 -13.140 -11.572 602 HD13 LEU 77 3HD1 LEU 77 13.864 -12.340 -10.016 603 HD21 LEU 77 3HD2 LEU 77 13.503 -16.432 -10.304 604 HD22 LEU 77 1HD2 LEU 77 12.252 -15.254 -9.909 605 HD23 LEU 77 2HD2 LEU 77 13.329 -15.852 -8.647 606 H THR 78 H THR 78 15.729 -17.192 -12.124 607 HA THR 78 HA THR 78 18.408 -17.721 -13.204 608 HB THR 78 HB THR 78 17.561 -19.773 -14.099 609 HG1 THR 78 HG1 THR 78 15.022 -18.723 -13.370 610 HG21 THR 78 3HG2 THR 78 17.038 -20.961 -12.125 611 HG22 THR 78 1HG2 THR 78 16.273 -19.555 -11.387 612 HG23 THR 78 2HG2 THR 78 18.023 -19.596 -11.601 613 H ALA 79 H ALA 79 18.109 -18.512 -15.665 614 HA ALA 79 HA ALA 79 17.332 -16.127 -17.084 615 HB1 ALA 79 1HB ALA 79 19.347 -17.761 -17.506 616 HB2 ALA 79 2HB ALA 79 18.165 -18.606 -18.506 617 HB3 ALA 79 3HB ALA 79 18.563 -16.921 -18.844 618 H SER 80 H SER 80 15.602 -18.670 -15.973 619 HA SER 80 HA SER 80 13.848 -18.848 -18.317 620 HB2 SER 80 1HB SER 80 14.005 -20.519 -15.800 621 HB3 SER 80 2HB SER 80 12.775 -20.731 -17.046 622 HG SER 80 HG SER 80 15.497 -21.327 -17.102 623 H GLU 81 H GLU 81 13.517 -18.548 -14.775 624 HA GLU 81 HA GLU 81 10.866 -17.823 -14.654 625 HB2 GLU 81 1HB GLU 81 13.172 -16.916 -12.928 626 HB3 GLU 81 2HB GLU 81 11.486 -16.603 -12.540 627 HG2 GLU 81 1HG GLU 81 11.078 -19.040 -12.524 628 HG3 GLU 81 2HG GLU 81 12.800 -19.298 -12.795 629 H THR 82 H THR 82 13.676 -15.710 -15.119 630 HA THR 82 HA THR 82 12.149 -13.305 -15.230 631 HB THR 82 HB THR 82 14.198 -12.239 -16.032 632 HG1 THR 82 HG1 THR 82 14.979 -13.892 -17.389 633 HG21 THR 82 3HG2 THR 82 15.246 -14.138 -14.002 634 HG22 THR 82 1HG2 THR 82 13.819 -13.194 -13.577 635 HG23 THR 82 2HG2 THR 82 15.311 -12.376 -14.042 636 H LYS 83 H LYS 83 13.632 -15.386 -17.699 637 HA LYS 83 HA LYS 83 12.976 -13.887 -19.950 638 HB2 LYS 83 1HB LYS 83 14.490 -15.758 -20.108 639 HB3 LYS 83 2HB LYS 83 13.230 -16.879 -19.609 640 HG2 LYS 83 1HG LYS 83 12.133 -16.753 -21.652 641 HG3 LYS 83 2HG LYS 83 12.919 -15.235 -22.090 642 HD2 LYS 83 1HD LYS 83 14.086 -16.717 -23.402 643 HD3 LYS 83 2HD LYS 83 15.100 -16.690 -21.957 644 HE2 LYS 83 1HE LYS 83 14.824 -18.968 -22.581 645 HE3 LYS 83 2HE LYS 83 13.835 -18.697 -21.147 646 HZ1 LYS 83 3HZ LYS 83 12.190 -18.155 -23.280 647 HZ2 LYS 83 1HZ LYS 83 12.154 -19.534 -22.300 648 HZ3 LYS 83 2HZ LYS 83 13.040 -19.543 -23.741 649 H THR 84 H THR 84 10.976 -15.798 -17.889 650 HA THR 84 HA THR 84 8.771 -15.744 -19.823 651 HB THR 84 HB THR 84 9.309 -17.896 -18.658 652 HG1 THR 84 HG1 THR 84 7.253 -18.314 -18.923 653 HG21 THR 84 3HG2 THR 84 9.930 -17.169 -16.478 654 HG22 THR 84 1HG2 THR 84 8.431 -18.080 -16.298 655 HG23 THR 84 2HG2 THR 84 8.403 -16.317 -16.255 656 H PHE 85 H PHE 85 9.783 -13.389 -18.310 657 HA PHE 85 HA PHE 85 7.402 -12.771 -16.698 658 HB2 PHE 85 1HB PHE 85 9.996 -12.510 -15.968 659 HB3 PHE 85 2HB PHE 85 9.703 -10.913 -16.648 660 HD1 PHE 85 HD2 PHE 85 6.803 -10.650 -15.878 661 HD2 PHE 85 HD1 PHE 85 10.208 -11.975 -13.694 662 HE1 PHE 85 HE2 PHE 85 5.723 -9.956 -13.779 663 HE2 PHE 85 HE1 PHE 85 9.133 -11.283 -11.592 664 HZ PHE 85 HZ PHE 85 6.888 -10.271 -11.633 665 H LEU 86 H LEU 86 9.668 -11.143 -18.921 666 HA LEU 86 HA LEU 86 7.419 -9.482 -19.846 667 HB2 LEU 86 1HB LEU 86 9.101 -7.847 -20.547 668 HB3 LEU 86 2HB LEU 86 9.170 -8.176 -18.817 669 HG LEU 86 HG LEU 86 11.090 -9.788 -19.420 670 HD11 LEU 86 1HD1 LEU 86 10.423 -8.777 -22.004 671 HD12 LEU 86 2HD1 LEU 86 11.632 -9.980 -21.559 672 HD13 LEU 86 3HD1 LEU 86 12.059 -8.270 -21.586 673 HD21 LEU 86 3HD2 LEU 86 12.705 -8.003 -19.239 674 HD22 LEU 86 1HD2 LEU 86 11.322 -7.652 -18.204 675 HD23 LEU 86 2HD2 LEU 86 11.501 -6.818 -19.748 676 H ALA 87 H ALA 87 9.883 -11.725 -20.769 677 HA ALA 87 HA ALA 87 9.567 -11.216 -23.610 678 HB1 ALA 87 1HB ALA 87 11.044 -13.452 -23.547 679 HB2 ALA 87 2HB ALA 87 11.725 -11.837 -23.345 680 HB3 ALA 87 3HB ALA 87 11.380 -12.832 -21.930 681 H ALA 88 H ALA 88 7.674 -12.666 -21.420 682 HA ALA 88 HA ALA 88 6.978 -14.996 -23.043 683 HB1 ALA 88 1HB ALA 88 5.417 -14.427 -20.612 684 HB2 ALA 88 2HB ALA 88 6.136 -15.936 -21.177 685 HB3 ALA 88 3HB ALA 88 7.136 -14.733 -20.362 686 H ALA 89 H ALA 89 5.603 -11.963 -21.868 687 HA ALA 89 HA ALA 89 2.978 -12.225 -22.669 688 HB1 ALA 89 1HB ALA 89 2.783 -10.009 -22.264 689 HB2 ALA 89 2HB ALA 89 4.383 -10.236 -21.557 690 HB3 ALA 89 3HB ALA 89 4.225 -9.599 -23.194 691 H ASP 90 H ASP 90 5.486 -10.560 -24.590 692 HA ASP 90 HA ASP 90 4.837 -11.895 -27.001 693 HB2 ASP 90 1HB ASP 90 2.864 -10.215 -26.508 694 HB3 ASP 90 2HB ASP 90 4.002 -9.026 -27.137 695 H HIS 91 H HIS 91 5.814 -10.633 -28.939 696 HA HIS 91 HA HIS 91 8.119 -9.029 -28.101 697 HB2 HIS 91 1HB HIS 91 8.188 -11.640 -29.573 698 HB3 HIS 91 2HB HIS 91 9.425 -10.427 -29.888 699 HD1 HIS 91 HD1 HIS 91 11.272 -10.181 -28.185 700 HD2 HIS 91 HD2 HIS 91 8.202 -12.665 -26.894 701 HE1 HIS 91 HE1 HIS 91 12.118 -11.253 -26.074 702 H ASP 92 H ASP 92 6.382 -7.531 -29.051 703 HA ASP 92 HA ASP 92 5.812 -7.486 -31.791 704 HB2 ASP 92 1HB ASP 92 4.528 -6.125 -30.282 705 HB3 ASP 92 2HB ASP 92 5.966 -5.245 -29.771 706 H GLY 93 H GLY 93 8.532 -6.192 -29.964 707 HA2 GLY 93 1HA GLY 93 9.915 -5.729 -32.522 708 HA3 GLY 93 2HA GLY 93 9.911 -4.472 -31.294 709 H ASP 94 H ASP 94 10.485 -5.568 -29.003 710 HA ASP 94 HA ASP 94 12.742 -7.398 -29.344 711 HB2 ASP 94 1HB ASP 94 13.113 -4.646 -29.049 712 HB3 ASP 94 2HB ASP 94 13.401 -5.307 -27.442 713 H GLY 95 H GLY 95 10.020 -7.537 -28.174 714 HA2 GLY 95 1HA GLY 95 9.082 -8.651 -26.390 715 HA3 GLY 95 2HA GLY 95 10.709 -8.956 -25.801 716 H LYS 96 H LYS 96 9.680 -5.703 -26.428 717 HA LYS 96 HA LYS 96 9.937 -5.103 -23.586 718 HB2 LYS 96 1HB LYS 96 10.029 -2.772 -24.272 719 HB3 LYS 96 2HB LYS 96 11.160 -3.724 -25.224 720 HG2 LYS 96 1HG LYS 96 9.389 -3.817 -27.016 721 HG3 LYS 96 2HG LYS 96 8.503 -2.611 -26.080 722 HD2 LYS 96 1HD LYS 96 10.356 -1.062 -26.259 723 HD3 LYS 96 2HD LYS 96 11.326 -2.277 -27.095 724 HE2 LYS 96 1HE LYS 96 9.738 -2.284 -28.944 725 HE3 LYS 96 2HE LYS 96 8.734 -1.105 -28.102 726 HZ1 LYS 96 3HZ LYS 96 10.916 0.277 -28.115 727 HZ2 LYS 96 1HZ LYS 96 9.945 0.224 -29.500 728 HZ3 LYS 96 2HZ LYS 96 11.339 -0.729 -29.408 729 H ILE 97 H ILE 97 8.261 -4.739 -22.289 730 HA ILE 97 HA ILE 97 5.579 -4.847 -23.364 731 HB ILE 97 HB ILE 97 6.324 -4.402 -20.480 732 HG12 ILE 97 1HG1 ILE 97 7.547 -6.363 -21.258 733 HG13 ILE 97 2HG1 ILE 97 6.219 -6.859 -20.215 734 HG21 ILE 97 1HG2 ILE 97 3.868 -4.970 -21.970 735 HG22 ILE 97 2HG2 ILE 97 4.110 -5.985 -20.549 736 HG23 ILE 97 3HG2 ILE 97 4.090 -4.229 -20.385 737 HD11 ILE 97 3HD1 ILE 97 5.590 -8.258 -21.804 738 HD12 ILE 97 1HD1 ILE 97 5.181 -6.867 -22.807 739 HD13 ILE 97 2HD1 ILE 97 6.782 -7.598 -22.923 740 H GLY 98 H GLY 98 3.938 -3.275 -22.922 741 HA2 GLY 98 1HA GLY 98 4.893 -0.605 -22.165 742 HA3 GLY 98 2HA GLY 98 4.123 -0.804 -23.732 743 H ALA 99 H ALA 99 3.417 -1.983 -20.440 744 HA ALA 99 HA ALA 99 1.465 -2.059 -19.262 745 HB1 ALA 99 1HB ALA 99 0.744 0.584 -20.467 746 HB2 ALA 99 2HB ALA 99 0.499 0.003 -18.819 747 HB3 ALA 99 3HB ALA 99 2.117 0.440 -19.369 748 H GLU 100 H GLU 100 1.330 -3.392 -21.729 749 HA GLU 100 HA GLU 100 -1.543 -3.277 -22.183 750 HB2 GLU 100 1HB GLU 100 -1.220 -3.344 -24.661 751 HB3 GLU 100 2HB GLU 100 -0.778 -1.813 -23.920 752 HG2 GLU 100 1HG GLU 100 1.569 -2.401 -24.034 753 HG3 GLU 100 2HG GLU 100 1.159 -3.980 -24.703 754 H GLU 101 H GLU 101 1.546 -4.867 -22.767 755 HA GLU 101 HA GLU 101 0.327 -7.337 -23.608 756 HB2 GLU 101 1HB GLU 101 3.182 -6.673 -22.870 757 HB3 GLU 101 2HB GLU 101 2.653 -8.215 -23.528 758 HG2 GLU 101 1HG GLU 101 2.389 -7.394 -25.624 759 HG3 GLU 101 2HG GLU 101 1.954 -5.782 -25.059 760 H PHE 102 H PHE 102 2.169 -6.282 -20.748 761 HA PHE 102 HA PHE 102 2.003 -8.646 -19.291 762 HB2 PHE 102 1HB PHE 102 3.354 -6.519 -18.786 763 HB3 PHE 102 2HB PHE 102 1.892 -5.924 -18.005 764 HD1 PHE 102 HD2 PHE 102 0.832 -7.595 -16.259 765 HD2 PHE 102 HD1 PHE 102 4.900 -7.633 -17.510 766 HE1 PHE 102 HE2 PHE 102 1.452 -8.780 -14.195 767 HE2 PHE 102 HE1 PHE 102 5.527 -8.819 -15.448 768 HZ PHE 102 HZ PHE 102 3.802 -9.394 -13.787 769 H GLN 103 H GLN 103 -0.311 -6.029 -19.646 770 HA GLN 103 HA GLN 103 -2.061 -6.774 -17.568 771 HB2 GLN 103 1HB GLN 103 -2.352 -5.143 -20.066 772 HB3 GLN 103 2HB GLN 103 -3.772 -5.537 -19.106 773 HG2 GLN 103 1HG GLN 103 -2.741 -3.321 -18.612 774 HG3 GLN 103 2HG GLN 103 -2.925 -4.384 -17.218 775 HE21 GLN 103 2HE2 GLN 103 -0.522 -3.872 -19.786 776 HE22 GLN 103 1HE2 GLN 103 0.844 -3.819 -18.729 777 H GLU 104 H GLU 104 -2.481 -7.258 -21.082 778 HA GLU 104 HA GLU 104 -4.670 -8.953 -20.945 779 HB2 GLU 104 1HB GLU 104 -4.008 -9.724 -23.199 780 HB3 GLU 104 2HB GLU 104 -3.952 -7.975 -23.041 781 HG2 GLU 104 1HG GLU 104 -1.544 -8.045 -22.798 782 HG3 GLU 104 2HG GLU 104 -1.570 -9.805 -22.871 783 H MET 105 H MET 105 -1.306 -9.613 -20.379 784 HA MET 105 HA MET 105 -1.371 -12.421 -20.675 785 HB2 MET 105 1HB MET 105 0.770 -11.467 -20.663 786 HB3 MET 105 2HB MET 105 0.442 -10.521 -19.217 787 HG2 MET 105 1HG MET 105 0.960 -12.213 -17.822 788 HG3 MET 105 2HG MET 105 0.324 -13.448 -18.907 789 HE1 MET 105 3HE MET 105 3.386 -10.965 -18.320 790 HE2 MET 105 1HE MET 105 4.371 -11.392 -19.720 791 HE3 MET 105 2HE MET 105 2.789 -10.647 -19.949 792 H VAL 106 H VAL 106 -2.370 -10.289 -18.127 793 HA VAL 106 HA VAL 106 -2.621 -12.478 -16.213 794 HB VAL 106 HB VAL 106 -3.250 -9.540 -15.891 795 HG11 VAL 106 1HG1 VAL 106 -2.788 -10.901 -13.430 796 HG12 VAL 106 2HG1 VAL 106 -4.237 -10.050 -13.970 797 HG13 VAL 106 3HG1 VAL 106 -4.033 -11.764 -14.333 798 HG21 VAL 106 3HG2 VAL 106 -0.952 -9.573 -16.053 799 HG22 VAL 106 1HG2 VAL 106 -1.179 -9.812 -14.321 800 HG23 VAL 106 2HG2 VAL 106 -0.819 -11.190 -15.361 801 H GLN 107 H GLN 107 -4.692 -10.033 -17.764 802 HA GLN 107 HA GLN 107 -7.129 -10.920 -16.724 803 HB2 GLN 107 1HB GLN 107 -6.801 -9.715 -19.466 804 HB3 GLN 107 2HB GLN 107 -8.181 -9.585 -18.384 805 HG2 GLN 107 1HG GLN 107 -5.556 -8.178 -18.280 806 HG3 GLN 107 2HG GLN 107 -7.189 -7.521 -18.173 807 HE21 GLN 107 2HE2 GLN 107 -4.752 -7.309 -16.437 808 HE22 GLN 107 1HE2 GLN 107 -5.310 -7.720 -14.854 809 H SER 108 H SER 108 -5.357 -11.902 -19.615 810 HA SER 108 HA SER 108 -5.614 -13.642 -21.059 811 HB2 SER 108 1HB SER 108 -7.114 -15.017 -18.826 812 HB3 SER 108 2HB SER 108 -6.173 -15.764 -20.116 813 HG SER 108 HG SER 108 -5.089 -15.633 -18.046 Start of MODEL 16 1 H1 SER 1 H SER 1 4.562 0.526 -0.697 2 HA SER 1 HA SER 1 2.039 0.697 -2.159 3 HB2 SER 1 1HB SER 1 4.907 0.523 -3.110 4 HB3 SER 1 2HB SER 1 3.510 0.600 -4.183 5 HG SER 1 HG SER 1 4.569 2.655 -3.691 6 H LEU 2 H LEU 2 4.365 -1.618 -1.069 7 HA LEU 2 HA LEU 2 3.791 -3.714 -2.872 8 HB2 LEU 2 1HB LEU 2 5.745 -3.493 -1.249 9 HB3 LEU 2 2HB LEU 2 4.637 -4.083 -0.013 10 HG LEU 2 HG LEU 2 4.329 -6.052 -1.771 11 HD11 LEU 2 1HD1 LEU 2 5.919 -4.865 -3.348 12 HD12 LEU 2 2HD1 LEU 2 6.263 -6.561 -3.011 13 HD13 LEU 2 3HD1 LEU 2 7.203 -5.296 -2.218 14 HD21 LEU 2 3HD2 LEU 2 6.590 -5.726 0.195 15 HD22 LEU 2 1HD2 LEU 2 6.133 -7.260 -0.546 16 HD23 LEU 2 2HD2 LEU 2 4.994 -6.412 0.499 17 H THR 3 H THR 3 2.417 -5.474 -2.714 18 HA THR 3 HA THR 3 0.396 -6.466 -2.333 19 HB THR 3 HB THR 3 -0.013 -7.204 -0.121 20 HG1 THR 3 HG1 THR 3 0.072 -5.731 1.391 21 HG21 THR 3 3HG2 THR 3 2.875 -6.870 0.303 22 HG22 THR 3 1HG2 THR 3 2.431 -7.513 -1.277 23 HG23 THR 3 2HG2 THR 3 1.909 -8.341 0.190 24 H ASP 4 H ASP 4 0.084 -3.841 -3.097 25 HA ASP 4 HA ASP 4 -1.577 -2.353 -1.331 26 HB2 ASP 4 1HB ASP 4 -0.513 -1.055 -2.963 27 HB3 ASP 4 2HB ASP 4 -0.931 -2.173 -4.259 28 H ILE 5 H ILE 5 -2.550 -3.568 -4.525 29 HA ILE 5 HA ILE 5 -5.289 -3.769 -3.693 30 HB ILE 5 HB ILE 5 -4.163 -3.351 -6.101 31 HG12 ILE 5 1HG1 ILE 5 -6.537 -4.346 -6.917 32 HG13 ILE 5 2HG1 ILE 5 -6.832 -4.259 -5.184 33 HG21 ILE 5 1HG2 ILE 5 -3.404 -5.791 -6.040 34 HG22 ILE 5 2HG2 ILE 5 -5.095 -6.194 -6.331 35 HG23 ILE 5 3HG2 ILE 5 -4.205 -5.224 -7.505 36 HD11 ILE 5 3HD1 ILE 5 -7.596 -2.254 -6.312 37 HD12 ILE 5 1HD1 ILE 5 -6.272 -1.887 -5.207 38 HD13 ILE 5 2HD1 ILE 5 -5.974 -1.975 -6.943 39 H LEU 6 H LEU 6 -2.585 -5.899 -3.812 40 HA LEU 6 HA LEU 6 -4.245 -8.289 -3.658 41 HB2 LEU 6 1HB LEU 6 -1.648 -7.727 -4.583 42 HB3 LEU 6 2HB LEU 6 -1.460 -8.784 -3.185 43 HG LEU 6 HG LEU 6 -1.549 -9.927 -5.424 44 HD11 LEU 6 1HD1 LEU 6 -2.913 -11.755 -4.626 45 HD12 LEU 6 2HD1 LEU 6 -3.695 -10.696 -3.452 46 HD13 LEU 6 3HD1 LEU 6 -1.981 -11.077 -3.291 47 HD21 LEU 6 3HD2 LEU 6 -3.391 -8.406 -6.272 48 HD22 LEU 6 1HD2 LEU 6 -4.500 -9.366 -5.293 49 HD23 LEU 6 2HD2 LEU 6 -3.586 -10.130 -6.594 50 H SER 7 H SER 7 -2.782 -9.901 -1.995 51 HA SER 7 HA SER 7 -2.902 -8.533 0.611 52 HB2 SER 7 1HB SER 7 -4.895 -9.823 0.545 53 HB3 SER 7 2HB SER 7 -4.067 -11.206 -0.170 54 HG SER 7 HG SER 7 -4.563 -11.159 2.225 55 HA PRO 8 HA PRO 8 1.110 -10.183 1.329 56 HB2 PRO 8 1HB PRO 8 1.108 -10.220 4.044 57 HB3 PRO 8 2HB PRO 8 1.232 -8.728 3.104 58 HG2 PRO 8 1HG PRO 8 -1.164 -9.939 4.430 59 HG3 PRO 8 2HG PRO 8 -0.645 -8.244 4.389 60 HD2 PRO 8 1HD PRO 8 -2.598 -9.209 2.780 61 HD3 PRO 8 2HD PRO 8 -1.508 -7.900 2.280 62 H SER 9 H SER 9 -1.738 -11.836 2.110 63 HA SER 9 HA SER 9 -0.242 -14.232 2.941 64 HB2 SER 9 1HB SER 9 -3.186 -13.623 3.298 65 HB3 SER 9 2HB SER 9 -2.346 -15.056 3.888 66 HG SER 9 HG SER 9 -1.737 -13.944 5.552 67 H ASP 10 H ASP 10 -0.944 -13.037 0.188 68 HA ASP 10 HA ASP 10 -1.968 -15.554 -0.944 69 HB2 ASP 10 1HB ASP 10 -2.632 -12.754 -1.882 70 HB3 ASP 10 2HB ASP 10 -3.113 -14.238 -2.700 71 H ILE 11 H ILE 11 0.068 -12.719 -1.328 72 HA ILE 11 HA ILE 11 1.145 -13.438 -3.857 73 HB ILE 11 HB ILE 11 2.312 -11.647 -1.722 74 HG12 ILE 11 1HG1 ILE 11 1.058 -10.612 -4.218 75 HG13 ILE 11 2HG1 ILE 11 -0.014 -11.209 -2.956 76 HG21 ILE 11 1HG2 ILE 11 3.291 -12.516 -4.328 77 HG22 ILE 11 2HG2 ILE 11 3.236 -10.763 -4.148 78 HG23 ILE 11 3HG2 ILE 11 4.147 -11.740 -2.996 79 HD11 ILE 11 3HD1 ILE 11 0.645 -9.572 -1.452 80 HD12 ILE 11 1HD1 ILE 11 2.132 -9.224 -2.333 81 HD13 ILE 11 2HD1 ILE 11 0.577 -8.717 -2.993 82 H ALA 12 H ALA 12 1.730 -14.514 -0.656 83 HA ALA 12 HA ALA 12 4.417 -15.443 -1.118 84 HB1 ALA 12 1HB ALA 12 4.391 -16.220 1.088 85 HB2 ALA 12 2HB ALA 12 3.396 -14.764 1.125 86 HB3 ALA 12 3HB ALA 12 2.633 -16.354 1.116 87 H ALA 13 H ALA 13 1.196 -16.714 -1.443 88 HA ALA 13 HA ALA 13 1.757 -19.462 -1.417 89 HB1 ALA 13 1HB ALA 13 -0.406 -17.876 -2.781 90 HB2 ALA 13 2HB ALA 13 -0.342 -19.639 -2.805 91 HB3 ALA 13 3HB ALA 13 -0.506 -18.784 -1.272 92 H ALA 14 H ALA 14 2.504 -17.039 -3.720 93 HA ALA 14 HA ALA 14 2.981 -19.027 -5.825 94 HB1 ALA 14 1HB ALA 14 1.727 -16.746 -6.139 95 HB2 ALA 14 2HB ALA 14 3.366 -16.106 -6.267 96 HB3 ALA 14 3HB ALA 14 2.817 -17.354 -7.386 97 H LEU 15 H LEU 15 4.593 -16.700 -3.756 98 HA LEU 15 HA LEU 15 7.131 -16.830 -5.025 99 HB2 LEU 15 1HB LEU 15 6.279 -15.994 -2.264 100 HB3 LEU 15 2HB LEU 15 7.946 -15.898 -2.827 101 HG LEU 15 HG LEU 15 5.610 -14.421 -4.040 102 HD11 LEU 15 1HD1 LEU 15 7.102 -12.473 -3.089 103 HD12 LEU 15 2HD1 LEU 15 7.599 -13.717 -1.944 104 HD13 LEU 15 3HD1 LEU 15 5.897 -13.278 -2.084 105 HD21 LEU 15 3HD2 LEU 15 7.385 -14.946 -5.645 106 HD22 LEU 15 1HD2 LEU 15 8.573 -14.212 -4.568 107 HD23 LEU 15 2HD2 LEU 15 7.312 -13.218 -5.298 108 H ARG 16 H ARG 16 5.441 -18.960 -2.967 109 HA ARG 16 HA ARG 16 7.913 -20.380 -2.251 110 HB2 ARG 16 1HB ARG 16 6.450 -19.798 -0.369 111 HB3 ARG 16 2HB ARG 16 5.121 -20.667 -1.127 112 HG2 ARG 16 1HG ARG 16 7.069 -22.577 -1.035 113 HG3 ARG 16 2HG ARG 16 7.366 -21.666 0.447 114 HD2 ARG 16 1HD ARG 16 5.433 -22.338 1.402 115 HD3 ARG 16 2HD ARG 16 4.545 -22.291 -0.120 116 HE ARG 16 HE ARG 16 6.437 -24.446 0.039 117 HH11 ARG 16 1HH1 ARG 16 3.202 -23.419 0.815 118 HH12 ARG 16 2HH1 ARG 16 2.564 -25.029 0.868 119 HH21 ARG 16 1HH2 ARG 16 5.608 -26.571 0.105 120 HH22 ARG 16 2HH2 ARG 16 3.933 -26.821 0.465 121 H ASP 17 H ASP 17 4.611 -20.992 -3.433 122 HA ASP 17 HA ASP 17 4.977 -23.691 -4.084 123 HB2 ASP 17 1HB ASP 17 2.785 -22.425 -3.949 124 HB3 ASP 17 2HB ASP 17 3.149 -21.787 -5.550 125 H CYS 18 H CYS 18 6.138 -20.852 -5.598 126 HA CYS 18 HA CYS 18 6.917 -22.412 -7.974 127 HB2 CYS 18 1HB CYS 18 6.657 -19.406 -7.848 128 HB3 CYS 18 2HB CYS 18 6.874 -20.405 -9.280 129 HG CYS 18 HG CYS 18 4.118 -19.280 -8.096 130 H GLN 19 H GLN 19 8.215 -21.911 -5.260 131 HA GLN 19 HA GLN 19 10.436 -20.248 -5.518 132 HB2 GLN 19 1HB GLN 19 9.502 -21.589 -3.472 133 HB3 GLN 19 2HB GLN 19 10.625 -22.829 -4.012 134 HG2 GLN 19 1HG GLN 19 12.002 -21.752 -2.592 135 HG3 GLN 19 2HG GLN 19 12.286 -20.750 -4.014 136 HE21 GLN 19 2HE2 GLN 19 10.222 -21.002 -1.153 137 HE22 GLN 19 1HE2 GLN 19 10.070 -19.301 -0.896 138 H ALA 20 H ALA 20 9.788 -23.350 -6.889 139 HA ALA 20 HA ALA 20 12.439 -24.194 -7.380 140 HB1 ALA 20 1HB ALA 20 11.484 -25.985 -8.330 141 HB2 ALA 20 2HB ALA 20 9.979 -25.316 -7.698 142 HB3 ALA 20 3HB ALA 20 10.449 -25.006 -9.370 143 HA PRO 21 HA PRO 21 13.779 -21.803 -10.806 144 HB2 PRO 21 1HB PRO 21 15.049 -23.645 -12.345 145 HB3 PRO 21 2HB PRO 21 15.702 -23.060 -10.810 146 HG2 PRO 21 1HG PRO 21 14.207 -25.587 -11.392 147 HG3 PRO 21 2HG PRO 21 15.644 -25.345 -10.381 148 HD2 PRO 21 1HD PRO 21 13.154 -25.580 -9.341 149 HD3 PRO 21 2HD PRO 21 14.411 -24.573 -8.593 150 H ASP 22 H ASP 22 13.212 -21.163 -12.861 151 HA ASP 22 HA ASP 22 11.703 -20.894 -14.566 152 HB2 ASP 22 1HB ASP 22 11.847 -22.609 -16.251 153 HB3 ASP 22 2HB ASP 22 13.425 -22.458 -15.483 154 H SER 23 H SER 23 10.479 -21.619 -12.072 155 HA SER 23 HA SER 23 8.168 -23.175 -13.034 156 HB2 SER 23 1HB SER 23 9.429 -22.971 -10.309 157 HB3 SER 23 2HB SER 23 7.750 -23.477 -10.495 158 HG SER 23 HG SER 23 9.951 -24.700 -11.805 159 H PHE 24 H PHE 24 9.275 -20.179 -11.788 160 HA PHE 24 HA PHE 24 6.574 -19.280 -11.129 161 HB2 PHE 24 1HB PHE 24 8.293 -18.680 -9.531 162 HB3 PHE 24 2HB PHE 24 9.267 -17.946 -10.801 163 HD1 PHE 24 HD1 PHE 24 5.825 -17.683 -9.382 164 HD2 PHE 24 HD2 PHE 24 9.212 -15.663 -10.983 165 HE1 PHE 24 HE1 PHE 24 4.729 -15.520 -8.963 166 HE2 PHE 24 HE2 PHE 24 8.122 -13.497 -10.567 167 HZ PHE 24 HZ PHE 24 5.878 -13.424 -9.555 168 H SER 25 H SER 25 5.528 -17.620 -12.194 169 HA SER 25 HA SER 25 6.766 -16.210 -14.373 170 HB2 SER 25 1HB SER 25 4.385 -17.632 -15.361 171 HB3 SER 25 2HB SER 25 5.920 -17.306 -16.165 172 HG SER 25 HG SER 25 5.515 -19.560 -15.721 173 HA PRO 26 HA PRO 26 3.668 -13.234 -13.489 174 HB2 PRO 26 1HB PRO 26 3.181 -12.149 -15.930 175 HB3 PRO 26 2HB PRO 26 4.677 -11.863 -15.033 176 HG2 PRO 26 1HG PRO 26 4.148 -13.777 -17.273 177 HG3 PRO 26 2HG PRO 26 5.548 -12.721 -17.011 178 HD2 PRO 26 1HD PRO 26 5.586 -15.363 -16.420 179 HD3 PRO 26 2HD PRO 26 6.512 -14.164 -15.494 180 H LYS 27 H LYS 27 2.940 -15.345 -16.239 181 HA LYS 27 HA LYS 27 0.077 -14.914 -15.885 182 HB2 LYS 27 1HB LYS 27 -0.155 -16.307 -17.908 183 HB3 LYS 27 2HB LYS 27 0.914 -14.935 -18.166 184 HG2 LYS 27 1HG LYS 27 2.507 -16.297 -18.861 185 HG3 LYS 27 2HG LYS 27 2.497 -17.123 -17.301 186 HD2 LYS 27 1HD LYS 27 2.104 -18.748 -19.022 187 HD3 LYS 27 2HD LYS 27 0.602 -18.515 -18.124 188 HE2 LYS 27 1HE LYS 27 -0.338 -17.210 -19.860 189 HE3 LYS 27 2HE LYS 27 1.216 -17.044 -20.676 190 HZ1 LYS 27 3HZ LYS 27 0.887 -19.714 -20.599 191 HZ2 LYS 27 1HZ LYS 27 0.480 -18.733 -21.915 192 HZ3 LYS 27 2HZ LYS 27 -0.708 -19.188 -20.801 193 H LYS 28 H LYS 28 1.633 -16.278 -13.826 194 HA LYS 28 HA LYS 28 0.121 -18.797 -13.788 195 HB2 LYS 28 1HB LYS 28 3.048 -18.404 -13.217 196 HB3 LYS 28 2HB LYS 28 2.157 -19.750 -12.521 197 HG2 LYS 28 1HG LYS 28 2.056 -19.276 -15.465 198 HG3 LYS 28 2HG LYS 28 3.464 -20.060 -14.744 199 HD2 LYS 28 1HD LYS 28 2.214 -21.917 -15.138 200 HD3 LYS 28 2HD LYS 28 1.547 -21.490 -13.560 201 HE2 LYS 28 1HE LYS 28 -0.419 -20.708 -14.453 202 HE3 LYS 28 2HE LYS 28 0.317 -20.313 -16.005 203 HZ1 LYS 28 3HZ LYS 28 -1.104 -22.194 -16.281 204 HZ2 LYS 28 1HZ LYS 28 -0.369 -23.020 -15.001 205 HZ3 LYS 28 2HZ LYS 28 0.495 -22.728 -16.425 206 H PHE 29 H PHE 29 1.848 -16.323 -11.951 207 HA PHE 29 HA PHE 29 0.777 -17.197 -9.427 208 HB2 PHE 29 1HB PHE 29 2.101 -15.562 -8.450 209 HB3 PHE 29 2HB PHE 29 3.005 -15.920 -9.918 210 HD1 PHE 29 HD2 PHE 29 2.411 -14.423 -11.984 211 HD2 PHE 29 HD1 PHE 29 1.630 -13.372 -7.934 212 HE1 PHE 29 HE2 PHE 29 2.316 -12.049 -12.622 213 HE2 PHE 29 HE1 PHE 29 1.532 -10.996 -8.565 214 HZ PHE 29 HZ PHE 29 1.876 -10.332 -10.912 215 H PHE 30 H PHE 30 -0.259 -15.173 -11.981 216 HA PHE 30 HA PHE 30 -1.808 -13.262 -10.715 217 HB2 PHE 30 1HB PHE 30 -2.961 -12.992 -12.761 218 HB3 PHE 30 2HB PHE 30 -1.351 -13.545 -13.213 219 HD1 PHE 30 HD1 PHE 30 -1.092 -16.118 -13.535 220 HD2 PHE 30 HD2 PHE 30 -4.808 -14.045 -13.644 221 HE1 PHE 30 HE1 PHE 30 -2.086 -17.974 -14.808 222 HE2 PHE 30 HE2 PHE 30 -5.808 -15.898 -14.916 223 HZ PHE 30 HZ PHE 30 -4.447 -17.866 -15.499 224 H GLN 31 H GLN 31 -2.327 -16.669 -11.007 225 HA GLN 31 HA GLN 31 -5.100 -16.441 -10.109 226 HB2 GLN 31 1HB GLN 31 -5.388 -18.687 -10.726 227 HB3 GLN 31 2HB GLN 31 -4.338 -18.025 -11.972 228 HG2 GLN 31 1HG GLN 31 -2.437 -18.922 -10.412 229 HG3 GLN 31 2HG GLN 31 -3.721 -19.966 -9.805 230 HE21 GLN 31 2HE2 GLN 31 -1.224 -19.989 -11.788 231 HE22 GLN 31 1HE2 GLN 31 -1.781 -21.066 -13.019 232 H ILE 32 H ILE 32 -1.935 -17.334 -8.986 233 HA ILE 32 HA ILE 32 -2.776 -18.734 -6.651 234 HB ILE 32 HB ILE 32 -0.144 -17.408 -7.304 235 HG12 ILE 32 1HG1 ILE 32 -0.592 -20.361 -7.151 236 HG13 ILE 32 2HG1 ILE 32 -1.123 -19.494 -8.589 237 HG21 ILE 32 1HG2 ILE 32 -0.036 -17.513 -5.008 238 HG22 ILE 32 2HG2 ILE 32 -1.063 -18.943 -4.918 239 HG23 ILE 32 3HG2 ILE 32 0.610 -19.092 -5.455 240 HD11 ILE 32 3HD1 ILE 32 1.619 -18.919 -7.705 241 HD12 ILE 32 1HD1 ILE 32 1.325 -20.559 -8.283 242 HD13 ILE 32 2HD1 ILE 32 0.973 -19.180 -9.325 243 H SER 33 H SER 33 -1.635 -15.419 -7.234 244 HA SER 33 HA SER 33 -2.023 -14.628 -4.504 245 HB2 SER 33 1HB SER 33 -1.832 -12.616 -6.705 246 HB3 SER 33 2HB SER 33 -1.089 -12.604 -5.106 247 HG SER 33 HG SER 33 0.617 -13.378 -6.033 248 H GLY 34 H GLY 34 -3.753 -14.100 -7.557 249 HA2 GLY 34 1HA GLY 34 -6.232 -14.222 -7.331 250 HA3 GLY 34 2HA GLY 34 -6.048 -13.129 -5.967 251 H MET 35 H MET 35 -4.087 -12.721 -8.804 252 HA MET 35 HA MET 35 -5.131 -10.075 -9.200 253 HB2 MET 35 1HB MET 35 -3.035 -11.705 -10.628 254 HB3 MET 35 2HB MET 35 -3.501 -10.095 -11.160 255 HG2 MET 35 1HG MET 35 -3.004 -9.565 -8.591 256 HG3 MET 35 2HG MET 35 -1.924 -10.939 -8.813 257 HE1 MET 35 3HE MET 35 0.000 -9.566 -12.076 258 HE2 MET 35 1HE MET 35 -0.572 -11.029 -11.273 259 HE3 MET 35 2HE MET 35 -1.689 -10.053 -12.227 260 H SER 36 H SER 36 -5.843 -13.183 -10.420 261 HA SER 36 HA SER 36 -6.672 -12.707 -13.015 262 HB2 SER 36 1HB SER 36 -7.878 -14.720 -12.884 263 HB3 SER 36 2HB SER 36 -6.607 -14.920 -11.678 264 HG SER 36 HG SER 36 -8.219 -15.320 -10.389 265 H LYS 37 H LYS 37 -8.256 -11.928 -9.994 266 HA LYS 37 HA LYS 37 -10.814 -11.341 -11.051 267 HB2 LYS 37 1HB LYS 37 -9.395 -10.484 -8.533 268 HB3 LYS 37 2HB LYS 37 -11.034 -9.968 -8.909 269 HG2 LYS 37 1HG LYS 37 -11.684 -12.368 -9.049 270 HG3 LYS 37 2HG LYS 37 -10.066 -12.785 -8.480 271 HD2 LYS 37 1HD LYS 37 -11.782 -10.870 -6.941 272 HD3 LYS 37 2HD LYS 37 -11.998 -12.613 -6.764 273 HE2 LYS 37 1HE LYS 37 -9.837 -12.905 -5.908 274 HE3 LYS 37 2HE LYS 37 -9.299 -11.330 -6.488 275 HZ1 LYS 37 3HZ LYS 37 -11.037 -10.413 -4.877 276 HZ2 LYS 37 1HZ LYS 37 -9.602 -11.025 -4.222 277 HZ3 LYS 37 2HZ LYS 37 -11.017 -11.950 -4.169 278 H LYS 38 H LYS 38 -7.860 -9.495 -10.741 279 HA LYS 38 HA LYS 38 -8.813 -6.909 -11.067 280 HB2 LYS 38 1HB LYS 38 -6.271 -7.979 -12.295 281 HB3 LYS 38 2HB LYS 38 -6.607 -6.320 -11.819 282 HG2 LYS 38 1HG LYS 38 -6.249 -8.691 -10.001 283 HG3 LYS 38 2HG LYS 38 -5.159 -7.316 -10.197 284 HD2 LYS 38 1HD LYS 38 -6.229 -6.436 -8.438 285 HD3 LYS 38 2HD LYS 38 -7.543 -6.108 -9.570 286 HE2 LYS 38 1HE LYS 38 -8.879 -7.546 -8.524 287 HE3 LYS 38 2HE LYS 38 -7.674 -8.827 -8.646 288 HZ1 LYS 38 3HZ LYS 38 -8.392 -7.226 -6.393 289 HZ2 LYS 38 1HZ LYS 38 -6.725 -7.190 -6.679 290 HZ3 LYS 38 2HZ LYS 38 -7.512 -8.669 -6.450 291 H SER 39 H SER 39 -8.174 -5.606 -13.173 292 HA SER 39 HA SER 39 -8.587 -6.889 -15.676 293 HB2 SER 39 1HB SER 39 -10.922 -6.791 -14.468 294 HB3 SER 39 2HB SER 39 -10.886 -5.101 -14.971 295 HG SER 39 HG SER 39 -10.295 -6.142 -17.128 296 H SER 40 H SER 40 -6.559 -5.452 -15.403 297 HA SER 40 HA SER 40 -5.385 -3.576 -15.950 298 HB2 SER 40 1HB SER 40 -6.710 -4.225 -18.108 299 HB3 SER 40 2HB SER 40 -7.636 -2.765 -17.762 300 HG SER 40 HG SER 40 -5.846 -1.547 -18.043 301 H SER 41 H SER 41 -7.400 -3.398 -13.778 302 HA SER 41 HA SER 41 -7.741 -0.471 -13.794 303 HB2 SER 41 1HB SER 41 -9.869 -1.979 -13.932 304 HB3 SER 41 2HB SER 41 -9.565 -2.264 -12.219 305 HG SER 41 HG SER 41 -10.555 -0.440 -11.932 306 H GLN 42 H GLN 42 -6.293 -3.117 -12.347 307 HA GLN 42 HA GLN 42 -5.548 -1.492 -10.026 308 HB2 GLN 42 1HB GLN 42 -6.287 -4.413 -9.813 309 HB3 GLN 42 2HB GLN 42 -5.815 -3.345 -8.498 310 HG2 GLN 42 1HG GLN 42 -7.990 -3.052 -8.162 311 HG3 GLN 42 2HG GLN 42 -7.954 -2.033 -9.600 312 HE21 GLN 42 2HE2 GLN 42 -7.518 -4.106 -11.479 313 HE22 GLN 42 1HE2 GLN 42 -8.972 -5.033 -11.587 314 H LEU 43 H LEU 43 -4.603 -3.205 -12.653 315 HA LEU 43 HA LEU 43 -2.389 -4.686 -11.734 316 HB2 LEU 43 1HB LEU 43 -2.555 -3.343 -14.415 317 HB3 LEU 43 2HB LEU 43 -1.717 -4.834 -13.991 318 HG LEU 43 HG LEU 43 -4.685 -4.412 -14.290 319 HD11 LEU 43 1HD1 LEU 43 -3.949 -4.830 -16.406 320 HD12 LEU 43 2HD1 LEU 43 -4.142 -6.486 -15.834 321 HD13 LEU 43 3HD1 LEU 43 -2.543 -5.744 -15.860 322 HD21 LEU 43 3HD2 LEU 43 -5.083 -6.126 -12.940 323 HD22 LEU 43 1HD2 LEU 43 -3.372 -6.170 -12.514 324 HD23 LEU 43 2HD2 LEU 43 -3.971 -7.142 -13.859 325 H LYS 44 H LYS 44 -2.562 -1.420 -13.149 326 HA LYS 44 HA LYS 44 0.204 -0.902 -12.472 327 HB2 LYS 44 1HB LYS 44 0.047 0.984 -13.793 328 HB3 LYS 44 2HB LYS 44 -1.165 -0.050 -14.538 329 HG2 LYS 44 1HG LYS 44 -1.720 2.127 -12.532 330 HG3 LYS 44 2HG LYS 44 -1.950 2.249 -14.278 331 HD2 LYS 44 1HD LYS 44 -3.335 0.247 -12.495 332 HD3 LYS 44 2HD LYS 44 -4.045 1.768 -13.041 333 HE2 LYS 44 1HE LYS 44 -3.042 0.455 -15.329 334 HE3 LYS 44 2HE LYS 44 -3.918 -0.752 -14.388 335 HZ1 LYS 44 3HZ LYS 44 -5.816 0.788 -14.325 336 HZ2 LYS 44 1HZ LYS 44 -5.411 0.327 -15.902 337 HZ3 LYS 44 2HZ LYS 44 -4.974 1.857 -15.330 338 H GLU 45 H GLU 45 -2.645 -0.851 -10.792 339 HA GLU 45 HA GLU 45 -2.525 1.547 -9.338 340 HB2 GLU 45 1HB GLU 45 -3.873 -1.059 -9.056 341 HB3 GLU 45 2HB GLU 45 -3.619 -0.190 -7.549 342 HG2 GLU 45 1HG GLU 45 -4.898 1.074 -9.952 343 HG3 GLU 45 2HG GLU 45 -5.815 0.203 -8.725 344 H ILE 46 H ILE 46 -1.207 -1.671 -8.598 345 HA ILE 46 HA ILE 46 0.039 -0.819 -6.171 346 HB ILE 46 HB ILE 46 0.713 -3.276 -7.785 347 HG12 ILE 46 1HG1 ILE 46 -0.961 -4.026 -5.691 348 HG13 ILE 46 2HG1 ILE 46 -1.712 -2.571 -6.338 349 HG21 ILE 46 1HG2 ILE 46 0.783 -3.354 -4.857 350 HG22 ILE 46 2HG2 ILE 46 1.938 -3.968 -6.038 351 HG23 ILE 46 3HG2 ILE 46 1.958 -2.263 -5.589 352 HD11 ILE 46 3HD1 ILE 46 -1.532 -5.251 -7.462 353 HD12 ILE 46 1HD1 ILE 46 -2.683 -3.954 -7.785 354 HD13 ILE 46 2HD1 ILE 46 -1.120 -3.972 -8.604 355 H PHE 47 H PHE 47 1.037 -1.110 -9.517 356 HA PHE 47 HA PHE 47 2.917 -0.472 -10.626 357 HB2 PHE 47 1HB PHE 47 2.958 1.351 -8.240 358 HB3 PHE 47 2HB PHE 47 4.272 1.387 -9.411 359 HD1 PHE 47 HD2 PHE 47 3.035 1.134 -11.962 360 HD2 PHE 47 HD1 PHE 47 1.624 3.193 -8.515 361 HE1 PHE 47 HE2 PHE 47 1.711 2.627 -13.401 362 HE2 PHE 47 HE1 PHE 47 0.296 4.689 -9.948 363 HZ PHE 47 HZ PHE 47 0.339 4.408 -12.394 364 H ARG 48 H ARG 48 3.039 -2.765 -8.846 365 HA ARG 48 HA ARG 48 5.949 -2.887 -8.554 366 HB2 ARG 48 1HB ARG 48 4.058 -3.900 -6.426 367 HB3 ARG 48 2HB ARG 48 5.816 -3.925 -6.378 368 HG2 ARG 48 1HG ARG 48 5.310 -1.273 -6.746 369 HG3 ARG 48 2HG ARG 48 3.946 -1.773 -5.744 370 HD2 ARG 48 1HD ARG 48 5.336 -1.506 -4.013 371 HD3 ARG 48 2HD ARG 48 6.067 -3.023 -4.537 372 HE ARG 48 HE ARG 48 7.400 -1.212 -6.004 373 HH11 ARG 48 1HH1 ARG 48 6.667 -1.387 -2.605 374 HH12 ARG 48 2HH1 ARG 48 8.099 -0.542 -2.119 375 HH21 ARG 48 1HH2 ARG 48 9.290 -0.098 -5.377 376 HH22 ARG 48 2HH2 ARG 48 9.590 0.192 -3.697 377 H ILE 49 H ILE 49 3.593 -4.011 -10.234 378 HA ILE 49 HA ILE 49 4.394 -6.840 -10.022 379 HB ILE 49 HB ILE 49 2.257 -7.507 -10.873 380 HG12 ILE 49 1HG1 ILE 49 1.653 -4.552 -11.119 381 HG13 ILE 49 2HG1 ILE 49 1.877 -5.682 -12.449 382 HG21 ILE 49 1HG2 ILE 49 1.878 -5.425 -8.724 383 HG22 ILE 49 2HG2 ILE 49 0.778 -6.755 -9.085 384 HG23 ILE 49 3HG2 ILE 49 2.396 -7.092 -8.468 385 HD11 ILE 49 3HD1 ILE 49 -0.110 -6.942 -11.539 386 HD12 ILE 49 1HD1 ILE 49 -0.386 -5.556 -10.485 387 HD13 ILE 49 2HD1 ILE 49 -0.440 -5.356 -12.237 388 H LEU 50 H LEU 50 4.344 -4.052 -11.967 389 HA LEU 50 HA LEU 50 4.850 -5.615 -14.404 390 HB2 LEU 50 1HB LEU 50 4.420 -2.647 -14.275 391 HB3 LEU 50 2HB LEU 50 4.276 -3.714 -15.670 392 HG LEU 50 HG LEU 50 2.407 -3.987 -13.343 393 HD11 LEU 50 1HD1 LEU 50 2.367 -1.625 -14.008 394 HD12 LEU 50 2HD1 LEU 50 0.865 -2.455 -14.415 395 HD13 LEU 50 3HD1 LEU 50 2.051 -2.108 -15.674 396 HD21 LEU 50 3HD2 LEU 50 0.909 -4.792 -15.152 397 HD22 LEU 50 1HD2 LEU 50 2.366 -5.766 -14.958 398 HD23 LEU 50 2HD2 LEU 50 2.246 -4.615 -16.288 399 H ASP 51 H ASP 51 5.972 -2.478 -13.133 400 HA ASP 51 HA ASP 51 8.728 -3.343 -13.227 401 HB2 ASP 51 1HB ASP 51 9.231 -1.224 -14.694 402 HB3 ASP 51 2HB ASP 51 8.772 -2.742 -15.460 403 H ASN 52 H ASN 52 10.150 -1.939 -12.136 404 HA ASN 52 HA ASN 52 8.774 0.007 -10.417 405 HB2 ASN 52 1HB ASN 52 10.259 -2.079 -9.622 406 HB3 ASN 52 2HB ASN 52 11.540 -0.882 -9.787 407 HD21 ASN 52 2HD2 ASN 52 8.177 -0.745 -8.661 408 HD22 ASN 52 1HD2 ASN 52 8.541 -0.026 -7.133 409 H ASP 53 H ASP 53 9.736 0.518 -13.160 410 HA ASP 53 HA ASP 53 11.647 2.674 -12.542 411 HB2 ASP 53 1HB ASP 53 12.383 0.653 -14.048 412 HB3 ASP 53 2HB ASP 53 11.456 1.493 -15.288 413 H GLN 54 H GLN 54 8.877 1.657 -14.467 414 HA GLN 54 HA GLN 54 7.299 2.820 -15.630 415 HB2 GLN 54 1HB GLN 54 7.919 4.790 -13.427 416 HB3 GLN 54 2HB GLN 54 6.568 4.965 -14.540 417 HG2 GLN 54 1HG GLN 54 7.005 2.780 -12.523 418 HG3 GLN 54 2HG GLN 54 5.751 4.019 -12.516 419 HE21 GLN 54 2HE2 GLN 54 5.388 1.182 -12.399 420 HE22 GLN 54 1HE2 GLN 54 4.470 0.729 -13.790 421 H SER 55 H SER 55 10.039 3.087 -16.537 422 HA SER 55 HA SER 55 10.267 5.842 -17.440 423 HB2 SER 55 1HB SER 55 12.036 3.416 -17.763 424 HB3 SER 55 2HB SER 55 12.374 4.955 -18.554 425 HG SER 55 HG SER 55 13.269 5.510 -16.746 426 H GLY 56 H GLY 56 9.059 2.832 -18.560 427 HA2 GLY 56 1HA GLY 56 7.603 3.610 -20.658 428 HA3 GLY 56 2HA GLY 56 9.208 3.568 -21.371 429 H PHE 57 H PHE 57 10.420 1.422 -20.726 430 HA PHE 57 HA PHE 57 8.536 -0.809 -21.118 431 HB2 PHE 57 1HB PHE 57 10.058 -1.854 -22.642 432 HB3 PHE 57 2HB PHE 57 9.851 -0.189 -23.175 433 HD1 PHE 57 HD1 PHE 57 11.629 1.502 -22.257 434 HD2 PHE 57 HD2 PHE 57 12.183 -2.713 -22.466 435 HE1 PHE 57 HE1 PHE 57 14.068 1.824 -22.205 436 HE2 PHE 57 HE2 PHE 57 14.622 -2.398 -22.412 437 HZ PHE 57 HZ PHE 57 15.568 -0.128 -22.281 438 H ILE 58 H ILE 58 10.195 -2.931 -20.935 439 HA ILE 58 HA ILE 58 11.523 -2.644 -18.323 440 HB ILE 58 HB ILE 58 9.976 -5.109 -19.085 441 HG12 ILE 58 1HG1 ILE 58 8.996 -2.757 -17.451 442 HG13 ILE 58 2HG1 ILE 58 8.416 -3.206 -19.051 443 HG21 ILE 58 1HG2 ILE 58 11.074 -4.031 -16.496 444 HG22 ILE 58 2HG2 ILE 58 9.999 -5.424 -16.604 445 HG23 ILE 58 3HG2 ILE 58 11.590 -5.476 -17.365 446 HD11 ILE 58 3HD1 ILE 58 8.156 -5.499 -17.468 447 HD12 ILE 58 1HD1 ILE 58 7.583 -4.152 -16.484 448 HD13 ILE 58 2HD1 ILE 58 6.875 -4.449 -18.073 449 H GLU 59 H GLU 59 13.168 -4.230 -17.874 450 HA GLU 59 HA GLU 59 14.172 -5.688 -20.212 451 HB2 GLU 59 1HB GLU 59 15.279 -3.351 -19.739 452 HB3 GLU 59 2HB GLU 59 16.118 -4.230 -18.468 453 HG2 GLU 59 1HG GLU 59 17.383 -4.068 -20.589 454 HG3 GLU 59 2HG GLU 59 17.102 -5.722 -20.047 455 H GLU 60 H GLU 60 15.984 -7.203 -19.576 456 HA GLU 60 HA GLU 60 15.106 -8.970 -17.606 457 HB2 GLU 60 1HB GLU 60 17.905 -8.725 -18.720 458 HB3 GLU 60 2HB GLU 60 17.226 -10.137 -17.922 459 HG2 GLU 60 1HG GLU 60 15.685 -10.491 -19.715 460 HG3 GLU 60 2HG GLU 60 16.148 -8.970 -20.476 461 H ASP 61 H ASP 61 17.010 -6.125 -17.348 462 HA ASP 61 HA ASP 61 18.329 -6.781 -14.897 463 HB2 ASP 61 1HB ASP 61 19.118 -5.047 -16.540 464 HB3 ASP 61 2HB ASP 61 17.782 -4.026 -16.014 465 H GLU 62 H GLU 62 15.146 -6.150 -15.615 466 HA GLU 62 HA GLU 62 14.619 -5.170 -12.886 467 HB2 GLU 62 1HB GLU 62 13.416 -4.464 -15.508 468 HB3 GLU 62 2HB GLU 62 12.324 -4.562 -14.133 469 HG2 GLU 62 1HG GLU 62 13.564 -2.897 -12.946 470 HG3 GLU 62 2HG GLU 62 14.823 -2.891 -14.179 471 H LEU 63 H LEU 63 14.869 -7.945 -14.107 472 HA LEU 63 HA LEU 63 12.237 -8.952 -13.247 473 HB2 LEU 63 1HB LEU 63 14.108 -10.442 -15.057 474 HB3 LEU 63 2HB LEU 63 12.391 -10.727 -14.776 475 HG LEU 63 HG LEU 63 13.565 -8.388 -16.280 476 HD11 LEU 63 1HD1 LEU 63 11.821 -10.412 -17.558 477 HD12 LEU 63 2HD1 LEU 63 13.489 -10.873 -17.219 478 HD13 LEU 63 3HD1 LEU 63 13.151 -9.469 -18.231 479 HD21 LEU 63 3HD2 LEU 63 11.538 -7.446 -16.325 480 HD22 LEU 63 1HD2 LEU 63 11.178 -8.478 -14.941 481 HD23 LEU 63 2HD2 LEU 63 10.723 -8.992 -16.566 482 H LYS 64 H LYS 64 15.645 -9.963 -13.541 483 HA LYS 64 HA LYS 64 15.669 -12.123 -11.871 484 HB2 LYS 64 1HB LYS 64 17.801 -9.983 -12.028 485 HB3 LYS 64 2HB LYS 64 18.033 -11.618 -11.422 486 HG2 LYS 64 1HG LYS 64 17.727 -12.559 -13.567 487 HG3 LYS 64 2HG LYS 64 17.114 -11.040 -14.224 488 HD2 LYS 64 1HD LYS 64 19.839 -11.029 -13.044 489 HD3 LYS 64 2HD LYS 64 19.624 -11.841 -14.597 490 HE2 LYS 64 1HE LYS 64 18.990 -9.888 -15.673 491 HE3 LYS 64 2HE LYS 64 18.519 -9.095 -14.171 492 HZ1 LYS 64 3HZ LYS 64 21.162 -9.555 -13.819 493 HZ2 LYS 64 1HZ LYS 64 20.486 -8.088 -14.322 494 HZ3 LYS 64 2HZ LYS 64 21.081 -9.182 -15.467 495 H TYR 65 H TYR 65 15.661 -8.723 -10.964 496 HA TYR 65 HA TYR 65 15.605 -9.493 -8.128 497 HB2 TYR 65 1HB TYR 65 16.248 -6.882 -9.497 498 HB3 TYR 65 2HB TYR 65 15.990 -7.005 -7.760 499 HD1 TYR 65 HD2 TYR 65 17.972 -8.758 -10.408 500 HD2 TYR 65 HD1 TYR 65 17.880 -7.175 -6.460 501 HE1 TYR 65 HE2 TYR 65 20.331 -9.386 -10.107 502 HE2 TYR 65 HE1 TYR 65 20.239 -7.797 -6.148 503 HH TYR 65 HH TYR 65 22.093 -9.336 -8.760 504 H PHE 66 H PHE 66 13.299 -10.044 -9.465 505 HA PHE 66 HA PHE 66 11.459 -7.822 -9.056 506 HB2 PHE 66 1HB PHE 66 11.244 -9.196 -11.092 507 HB3 PHE 66 2HB PHE 66 10.944 -10.616 -10.096 508 HD1 PHE 66 HD2 PHE 66 8.867 -10.746 -8.737 509 HD2 PHE 66 HD1 PHE 66 9.526 -7.659 -11.592 510 HE1 PHE 66 HE2 PHE 66 6.458 -10.244 -8.745 511 HE2 PHE 66 HE1 PHE 66 7.118 -7.151 -11.604 512 HZ PHE 66 HZ PHE 66 5.581 -8.445 -10.180 513 H LEU 67 H LEU 67 11.636 -11.245 -8.063 514 HA LEU 67 HA LEU 67 9.610 -11.175 -6.163 515 HB2 LEU 67 1HB LEU 67 12.107 -12.833 -5.922 516 HB3 LEU 67 2HB LEU 67 10.500 -13.205 -5.302 517 HG LEU 67 HG LEU 67 11.390 -13.224 -8.183 518 HD11 LEU 67 1HD1 LEU 67 12.084 -15.170 -6.901 519 HD12 LEU 67 2HD1 LEU 67 10.817 -15.600 -8.050 520 HD13 LEU 67 3HD1 LEU 67 10.429 -15.409 -6.340 521 HD21 LEU 67 3HD2 LEU 67 9.276 -12.765 -8.707 522 HD22 LEU 67 1HD2 LEU 67 8.759 -12.874 -7.025 523 HD23 LEU 67 2HD2 LEU 67 8.853 -14.331 -8.014 524 H GLN 68 H GLN 68 12.794 -9.878 -6.039 525 HA GLN 68 HA GLN 68 13.280 -9.859 -3.289 526 HB2 GLN 68 1HB GLN 68 14.561 -8.892 -5.539 527 HB3 GLN 68 2HB GLN 68 14.157 -7.429 -4.651 528 HG2 GLN 68 1HG GLN 68 15.574 -7.898 -2.949 529 HG3 GLN 68 2HG GLN 68 15.368 -9.641 -3.110 530 HE21 GLN 68 2HE2 GLN 68 16.049 -10.151 -5.646 531 HE22 GLN 68 1HE2 GLN 68 17.693 -9.714 -5.945 532 H ARG 69 H ARG 69 10.908 -8.227 -5.088 533 HA ARG 69 HA ARG 69 10.605 -6.015 -3.248 534 HB2 ARG 69 1HB ARG 69 9.264 -6.900 -5.765 535 HB3 ARG 69 2HB ARG 69 8.397 -5.808 -4.692 536 HG2 ARG 69 1HG ARG 69 11.161 -5.017 -5.260 537 HG3 ARG 69 2HG ARG 69 10.088 -5.030 -6.662 538 HD2 ARG 69 1HD ARG 69 8.919 -3.256 -5.933 539 HD3 ARG 69 2HD ARG 69 8.925 -3.819 -4.262 540 HE ARG 69 HE ARG 69 10.811 -2.017 -5.503 541 HH11 ARG 69 1HH1 ARG 69 10.167 -4.164 -2.839 542 HH12 ARG 69 2HH1 ARG 69 11.328 -3.422 -1.790 543 HH21 ARG 69 1HH2 ARG 69 12.343 -1.031 -4.130 544 HH22 ARG 69 2HH2 ARG 69 12.564 -1.639 -2.525 545 H PHE 70 H PHE 70 8.570 -8.771 -4.242 546 HA PHE 70 HA PHE 70 6.756 -8.386 -2.055 547 HB2 PHE 70 1HB PHE 70 7.061 -10.593 -4.094 548 HB3 PHE 70 2HB PHE 70 5.814 -10.597 -2.851 549 HD1 PHE 70 HD1 PHE 70 4.229 -8.582 -2.777 550 HD2 PHE 70 HD2 PHE 70 6.701 -9.516 -6.114 551 HE1 PHE 70 HE1 PHE 70 2.779 -7.224 -4.227 552 HE2 PHE 70 HE2 PHE 70 5.255 -8.159 -7.570 553 HZ PHE 70 HZ PHE 70 3.291 -7.009 -6.627 554 H GLU 71 H GLU 71 8.955 -11.065 -2.910 555 HA GLU 71 HA GLU 71 8.720 -12.438 -0.484 556 HB2 GLU 71 1HB GLU 71 9.652 -13.510 -2.443 557 HB3 GLU 71 2HB GLU 71 10.994 -12.374 -2.472 558 HG2 GLU 71 1HG GLU 71 11.801 -14.416 -1.582 559 HG3 GLU 71 2HG GLU 71 11.700 -13.262 -0.253 560 H SER 72 H SER 72 10.969 -9.913 -1.507 561 HA SER 72 HA SER 72 12.359 -8.543 -0.338 562 HB2 SER 72 1HB SER 72 10.162 -8.500 1.121 563 HB3 SER 72 2HB SER 72 11.158 -9.395 2.269 564 HG SER 72 HG SER 72 11.546 -6.792 1.245 565 H GLY 73 H GLY 73 12.734 -11.596 -0.552 566 HA2 GLY 73 1HA GLY 73 15.022 -11.688 1.307 567 HA3 GLY 73 2HA GLY 73 13.938 -13.063 1.158 568 H ALA 74 H ALA 74 13.569 -12.841 -1.688 569 HA ALA 74 HA ALA 74 15.571 -14.505 -2.619 570 HB1 ALA 74 1HB ALA 74 14.520 -14.431 -4.641 571 HB2 ALA 74 2HB ALA 74 13.241 -13.765 -3.626 572 HB3 ALA 74 3HB ALA 74 14.267 -12.687 -4.573 573 H ARG 75 H ARG 75 16.951 -13.919 -4.638 574 HA ARG 75 HA ARG 75 18.241 -11.307 -4.296 575 HB2 ARG 75 1HB ARG 75 20.434 -12.743 -4.749 576 HB3 ARG 75 2HB ARG 75 19.830 -12.454 -3.124 577 HG2 ARG 75 1HG ARG 75 19.230 -14.609 -2.813 578 HG3 ARG 75 2HG ARG 75 18.787 -14.844 -4.505 579 HD2 ARG 75 1HD ARG 75 20.814 -15.627 -5.037 580 HD3 ARG 75 2HD ARG 75 21.635 -14.363 -4.122 581 HE ARG 75 HE ARG 75 21.887 -15.841 -2.404 582 HH11 ARG 75 1HH1 ARG 75 19.363 -16.992 -4.507 583 HH12 ARG 75 2HH1 ARG 75 19.177 -18.500 -3.674 584 HH21 ARG 75 1HH2 ARG 75 21.652 -17.823 -1.299 585 HH22 ARG 75 2HH2 ARG 75 20.479 -18.971 -1.849 586 H VAL 76 H VAL 76 18.176 -14.289 -6.239 587 HA VAL 76 HA VAL 76 18.038 -12.666 -8.660 588 HB VAL 76 HB VAL 76 20.057 -14.896 -8.452 589 HG11 VAL 76 1HG1 VAL 76 19.619 -14.679 -10.691 590 HG12 VAL 76 2HG1 VAL 76 19.221 -12.964 -10.559 591 HG13 VAL 76 3HG1 VAL 76 20.905 -13.487 -10.504 592 HG21 VAL 76 3HG2 VAL 76 20.931 -13.267 -7.005 593 HG22 VAL 76 1HG2 VAL 76 21.727 -12.966 -8.550 594 HG23 VAL 76 2HG2 VAL 76 20.389 -11.940 -8.032 595 H LEU 77 H LEU 77 17.151 -13.746 -10.451 596 HA LEU 77 HA LEU 77 15.740 -16.228 -9.753 597 HB2 LEU 77 1HB LEU 77 15.120 -14.001 -11.667 598 HB3 LEU 77 2HB LEU 77 14.316 -15.566 -11.776 599 HG LEU 77 HG LEU 77 14.236 -14.264 -9.129 600 HD11 LEU 77 1HD1 LEU 77 12.084 -13.146 -10.542 601 HD12 LEU 77 2HD1 LEU 77 13.533 -12.793 -11.483 602 HD13 LEU 77 3HD1 LEU 77 13.439 -12.305 -9.791 603 HD21 LEU 77 3HD2 LEU 77 12.803 -16.229 -10.655 604 HD22 LEU 77 1HD2 LEU 77 11.698 -14.984 -10.072 605 HD23 LEU 77 2HD2 LEU 77 12.713 -15.867 -8.931 606 H THR 78 H THR 78 15.184 -17.556 -11.811 607 HA THR 78 HA THR 78 17.680 -18.394 -12.943 608 HB THR 78 HB THR 78 16.429 -20.154 -14.031 609 HG1 THR 78 HG1 THR 78 14.234 -18.487 -13.421 610 HG21 THR 78 3HG2 THR 78 15.252 -21.134 -12.065 611 HG22 THR 78 1HG2 THR 78 15.445 -19.592 -11.232 612 HG23 THR 78 2HG2 THR 78 16.866 -20.530 -11.692 613 H ALA 79 H ALA 79 17.497 -19.031 -15.433 614 HA ALA 79 HA ALA 79 17.306 -16.502 -16.826 615 HB1 ALA 79 1HB ALA 79 19.179 -18.199 -17.104 616 HB2 ALA 79 2HB ALA 79 18.034 -19.144 -18.056 617 HB3 ALA 79 3HB ALA 79 18.490 -17.524 -18.581 618 H SER 80 H SER 80 15.142 -18.879 -16.092 619 HA SER 80 HA SER 80 13.676 -18.657 -18.624 620 HB2 SER 80 1HB SER 80 13.588 -20.600 -16.338 621 HB3 SER 80 2HB SER 80 12.190 -20.431 -17.401 622 HG SER 80 HG SER 80 13.346 -21.923 -18.428 623 H GLU 81 H GLU 81 13.118 -18.416 -15.114 624 HA GLU 81 HA GLU 81 10.518 -17.483 -15.149 625 HB2 GLU 81 1HB GLU 81 12.805 -16.985 -13.261 626 HB3 GLU 81 2HB GLU 81 11.227 -16.259 -12.987 627 HG2 GLU 81 1HG GLU 81 10.225 -18.269 -12.525 628 HG3 GLU 81 2HG GLU 81 11.407 -19.194 -13.450 629 H THR 82 H THR 82 13.521 -15.586 -15.280 630 HA THR 82 HA THR 82 12.195 -13.074 -15.486 631 HB THR 82 HB THR 82 14.388 -12.149 -16.042 632 HG1 THR 82 HG1 THR 82 15.611 -13.463 -17.175 633 HG21 THR 82 3HG2 THR 82 15.079 -14.166 -13.973 634 HG22 THR 82 1HG2 THR 82 13.687 -13.128 -13.668 635 HG23 THR 82 2HG2 THR 82 15.274 -12.414 -13.954 636 H LYS 83 H LYS 83 13.782 -15.199 -17.850 637 HA LYS 83 HA LYS 83 13.485 -13.617 -20.113 638 HB2 LYS 83 1HB LYS 83 14.842 -15.598 -20.190 639 HB3 LYS 83 2HB LYS 83 13.463 -16.622 -19.813 640 HG2 LYS 83 1HG LYS 83 12.450 -16.055 -21.962 641 HG3 LYS 83 2HG LYS 83 13.833 -15.026 -22.340 642 HD2 LYS 83 1HD LYS 83 14.326 -17.869 -21.598 643 HD3 LYS 83 2HD LYS 83 13.700 -17.511 -23.209 644 HE2 LYS 83 1HE LYS 83 15.977 -17.457 -23.568 645 HE3 LYS 83 2HE LYS 83 15.624 -15.757 -23.267 646 HZ1 LYS 83 3HZ LYS 83 17.488 -17.255 -21.968 647 HZ2 LYS 83 1HZ LYS 83 16.206 -17.203 -20.866 648 HZ3 LYS 83 2HZ LYS 83 16.879 -15.765 -21.447 649 H THR 84 H THR 84 11.220 -15.911 -18.655 650 HA THR 84 HA THR 84 9.214 -15.348 -20.682 651 HB THR 84 HB THR 84 9.530 -17.655 -19.748 652 HG1 THR 84 HG1 THR 84 7.429 -18.024 -20.050 653 HG21 THR 84 3HG2 THR 84 9.514 -18.018 -17.551 654 HG22 THR 84 1HG2 THR 84 7.897 -17.330 -17.421 655 HG23 THR 84 2HG2 THR 84 9.313 -16.287 -17.286 656 H PHE 85 H PHE 85 10.227 -13.393 -18.540 657 HA PHE 85 HA PHE 85 7.791 -12.851 -17.049 658 HB2 PHE 85 1HB PHE 85 10.374 -12.542 -16.359 659 HB3 PHE 85 2HB PHE 85 10.049 -10.928 -16.982 660 HD1 PHE 85 HD2 PHE 85 8.820 -13.456 -14.560 661 HD2 PHE 85 HD1 PHE 85 8.962 -9.348 -15.667 662 HE1 PHE 85 HE2 PHE 85 7.772 -12.846 -12.420 663 HE2 PHE 85 HE1 PHE 85 7.914 -8.732 -13.527 664 HZ PHE 85 HZ PHE 85 7.317 -10.482 -11.901 665 H LEU 86 H LEU 86 9.825 -11.232 -19.470 666 HA LEU 86 HA LEU 86 7.549 -9.461 -20.076 667 HB2 LEU 86 1HB LEU 86 9.741 -8.290 -21.243 668 HB3 LEU 86 2HB LEU 86 9.005 -7.820 -19.712 669 HG LEU 86 HG LEU 86 10.622 -9.370 -18.573 670 HD11 LEU 86 1HD1 LEU 86 11.213 -10.043 -21.284 671 HD12 LEU 86 2HD1 LEU 86 11.831 -10.764 -19.798 672 HD13 LEU 86 3HD1 LEU 86 12.658 -9.382 -20.518 673 HD21 LEU 86 3HD2 LEU 86 11.362 -6.886 -20.034 674 HD22 LEU 86 1HD2 LEU 86 12.632 -7.787 -19.205 675 HD23 LEU 86 2HD2 LEU 86 11.243 -7.187 -18.299 676 H ALA 87 H ALA 87 9.914 -11.675 -21.342 677 HA ALA 87 HA ALA 87 9.274 -11.127 -24.106 678 HB1 ALA 87 1HB ALA 87 11.209 -12.139 -24.503 679 HB2 ALA 87 2HB ALA 87 11.404 -12.348 -22.762 680 HB3 ALA 87 3HB ALA 87 10.651 -13.620 -23.725 681 H ALA 88 H ALA 88 7.586 -12.582 -21.744 682 HA ALA 88 HA ALA 88 6.645 -14.864 -23.291 683 HB1 ALA 88 1HB ALA 88 5.790 -13.910 -20.561 684 HB2 ALA 88 2HB ALA 88 5.354 -15.442 -21.320 685 HB3 ALA 88 3HB ALA 88 7.032 -15.122 -20.879 686 H ALA 89 H ALA 89 5.495 -11.744 -22.109 687 HA ALA 89 HA ALA 89 2.805 -11.933 -22.751 688 HB1 ALA 89 1HB ALA 89 2.706 -9.732 -22.275 689 HB2 ALA 89 2HB ALA 89 4.359 -9.991 -21.715 690 HB3 ALA 89 3HB ALA 89 4.066 -9.333 -23.325 691 H ASP 90 H ASP 90 5.307 -10.391 -24.780 692 HA ASP 90 HA ASP 90 4.248 -11.600 -27.165 693 HB2 ASP 90 1HB ASP 90 3.352 -9.737 -28.234 694 HB3 ASP 90 2HB ASP 90 2.792 -9.520 -26.578 695 H HIS 91 H HIS 91 5.337 -10.154 -29.123 696 HA HIS 91 HA HIS 91 8.067 -9.439 -28.413 697 HB2 HIS 91 1HB HIS 91 8.056 -11.914 -28.819 698 HB3 HIS 91 2HB HIS 91 7.524 -11.591 -30.466 699 HD1 HIS 91 HD1 HIS 91 9.315 -11.200 -32.149 700 HD2 HIS 91 HD2 HIS 91 10.701 -10.777 -28.256 701 HE1 HIS 91 HE1 HIS 91 11.803 -10.894 -32.351 702 H ASP 92 H ASP 92 6.487 -7.546 -29.153 703 HA ASP 92 HA ASP 92 5.971 -7.168 -31.885 704 HB2 ASP 92 1HB ASP 92 4.941 -5.825 -30.077 705 HB3 ASP 92 2HB ASP 92 6.498 -5.054 -29.785 706 H GLY 93 H GLY 93 8.832 -6.586 -29.943 707 HA2 GLY 93 1HA GLY 93 10.338 -6.117 -32.412 708 HA3 GLY 93 2HA GLY 93 10.438 -4.900 -31.148 709 H ASP 94 H ASP 94 10.773 -6.125 -28.870 710 HA ASP 94 HA ASP 94 12.809 -8.203 -29.184 711 HB2 ASP 94 1HB ASP 94 13.870 -5.881 -29.123 712 HB3 ASP 94 2HB ASP 94 13.322 -5.788 -27.451 713 H GLY 95 H GLY 95 10.030 -8.005 -28.117 714 HA2 GLY 95 1HA GLY 95 8.876 -9.028 -26.409 715 HA3 GLY 95 2HA GLY 95 10.418 -9.613 -25.802 716 H LYS 96 H LYS 96 9.825 -6.213 -26.284 717 HA LYS 96 HA LYS 96 10.149 -5.788 -23.415 718 HB2 LYS 96 1HB LYS 96 10.522 -3.443 -24.002 719 HB3 LYS 96 2HB LYS 96 11.568 -4.499 -24.942 720 HG2 LYS 96 1HG LYS 96 9.954 -4.317 -26.826 721 HG3 LYS 96 2HG LYS 96 9.062 -3.123 -25.880 722 HD2 LYS 96 1HD LYS 96 10.895 -1.611 -25.902 723 HD3 LYS 96 2HD LYS 96 11.985 -2.841 -26.548 724 HE2 LYS 96 1HE LYS 96 10.421 -2.907 -28.568 725 HE3 LYS 96 2HE LYS 96 9.738 -1.410 -27.937 726 HZ1 LYS 96 3HZ LYS 96 12.453 -1.027 -27.897 727 HZ2 LYS 96 1HZ LYS 96 11.360 -0.373 -29.011 728 HZ3 LYS 96 2HZ LYS 96 12.166 -1.818 -29.365 729 H ILE 97 H ILE 97 8.502 -5.332 -22.116 730 HA ILE 97 HA ILE 97 5.838 -5.117 -23.134 731 HB ILE 97 HB ILE 97 6.670 -4.546 -20.298 732 HG12 ILE 97 1HG1 ILE 97 7.718 -6.648 -20.924 733 HG13 ILE 97 2HG1 ILE 97 6.349 -6.967 -19.864 734 HG21 ILE 97 1HG2 ILE 97 4.488 -4.440 -19.915 735 HG22 ILE 97 2HG2 ILE 97 4.194 -4.636 -21.642 736 HG23 ILE 97 3HG2 ILE 97 4.265 -6.053 -20.594 737 HD11 ILE 97 3HD1 ILE 97 6.122 -8.580 -21.489 738 HD12 ILE 97 1HD1 ILE 97 5.041 -7.312 -22.066 739 HD13 ILE 97 2HD1 ILE 97 6.642 -7.501 -22.782 740 H GLY 98 H GLY 98 4.439 -3.365 -23.079 741 HA2 GLY 98 1HA GLY 98 5.631 -0.754 -22.406 742 HA3 GLY 98 2HA GLY 98 4.840 -0.993 -23.957 743 H ALA 99 H ALA 99 4.005 -1.901 -20.613 744 HA ALA 99 HA ALA 99 2.048 -1.708 -19.455 745 HB1 ALA 99 1HB ALA 99 1.457 0.923 -20.669 746 HB2 ALA 99 2HB ALA 99 1.516 0.441 -18.974 747 HB3 ALA 99 3HB ALA 99 3.012 0.750 -19.856 748 H GLU 100 H GLU 100 1.716 -3.166 -21.779 749 HA GLU 100 HA GLU 100 -1.103 -2.733 -22.274 750 HB2 GLU 100 1HB GLU 100 0.948 -2.609 -24.484 751 HB3 GLU 100 2HB GLU 100 -0.757 -2.924 -24.775 752 HG2 GLU 100 1HG GLU 100 -1.308 -0.762 -23.738 753 HG3 GLU 100 2HG GLU 100 0.414 -0.446 -23.532 754 H GLU 101 H GLU 101 1.809 -4.626 -22.855 755 HA GLU 101 HA GLU 101 0.367 -6.972 -23.679 756 HB2 GLU 101 1HB GLU 101 3.240 -6.818 -22.766 757 HB3 GLU 101 2HB GLU 101 2.504 -8.054 -23.776 758 HG2 GLU 101 1HG GLU 101 2.772 -5.170 -24.583 759 HG3 GLU 101 2HG GLU 101 3.940 -6.424 -24.993 760 H PHE 102 H PHE 102 2.338 -6.173 -20.816 761 HA PHE 102 HA PHE 102 1.882 -8.456 -19.338 762 HB2 PHE 102 1HB PHE 102 3.321 -6.288 -18.864 763 HB3 PHE 102 2HB PHE 102 1.910 -5.826 -17.919 764 HD1 PHE 102 HD2 PHE 102 1.016 -7.801 -16.348 765 HD2 PHE 102 HD1 PHE 102 5.007 -7.372 -17.764 766 HE1 PHE 102 HE2 PHE 102 1.826 -9.168 -14.470 767 HE2 PHE 102 HE1 PHE 102 5.823 -8.740 -15.889 768 HZ PHE 102 HZ PHE 102 4.232 -9.639 -14.238 769 H GLN 103 H GLN 103 -0.164 -5.618 -19.708 770 HA GLN 103 HA GLN 103 -2.030 -6.247 -17.689 771 HB2 GLN 103 1HB GLN 103 -2.129 -4.527 -20.148 772 HB3 GLN 103 2HB GLN 103 -3.568 -4.773 -19.168 773 HG2 GLN 103 1HG GLN 103 -2.408 -2.711 -18.581 774 HG3 GLN 103 2HG GLN 103 -2.446 -3.848 -17.234 775 HE21 GLN 103 2HE2 GLN 103 -0.354 -3.542 -20.081 776 HE22 GLN 103 1HE2 GLN 103 1.128 -3.463 -19.197 777 H GLU 104 H GLU 104 -1.821 -7.115 -21.099 778 HA GLU 104 HA GLU 104 -4.376 -8.441 -21.109 779 HB2 GLU 104 1HB GLU 104 -2.137 -8.152 -23.085 780 HB3 GLU 104 2HB GLU 104 -3.418 -9.324 -23.363 781 HG2 GLU 104 1HG GLU 104 -5.049 -7.421 -23.086 782 HG3 GLU 104 2HG GLU 104 -3.658 -6.340 -23.144 783 H MET 105 H MET 105 -1.171 -9.262 -20.243 784 HA MET 105 HA MET 105 -1.334 -12.071 -20.732 785 HB2 MET 105 1HB MET 105 0.842 -11.106 -20.607 786 HB3 MET 105 2HB MET 105 0.506 -10.385 -19.039 787 HG2 MET 105 1HG MET 105 0.906 -12.302 -17.913 788 HG3 MET 105 2HG MET 105 0.301 -13.323 -19.215 789 HE1 MET 105 3HE MET 105 3.413 -11.304 -17.837 790 HE2 MET 105 1HE MET 105 4.471 -11.349 -19.248 791 HE3 MET 105 2HE MET 105 2.949 -10.461 -19.316 792 H VAL 106 H VAL 106 -2.351 -9.965 -18.180 793 HA VAL 106 HA VAL 106 -2.686 -12.115 -16.261 794 HB VAL 106 HB VAL 106 -3.579 -9.235 -16.069 795 HG11 VAL 106 1HG1 VAL 106 -3.016 -10.648 -13.597 796 HG12 VAL 106 2HG1 VAL 106 -4.432 -9.704 -14.062 797 HG13 VAL 106 3HG1 VAL 106 -4.315 -11.403 -14.519 798 HG21 VAL 106 3HG2 VAL 106 -1.289 -9.018 -16.168 799 HG22 VAL 106 1HG2 VAL 106 -1.533 -9.249 -14.436 800 HG23 VAL 106 2HG2 VAL 106 -0.999 -10.598 -15.440 801 H GLN 107 H GLN 107 -4.664 -10.139 -18.397 802 HA GLN 107 HA GLN 107 -7.190 -10.844 -17.420 803 HB2 GLN 107 1HB GLN 107 -6.291 -10.078 -20.198 804 HB3 GLN 107 2HB GLN 107 -7.978 -10.276 -19.746 805 HG2 GLN 107 1HG GLN 107 -6.023 -8.221 -18.774 806 HG3 GLN 107 2HG GLN 107 -7.539 -7.972 -19.639 807 HE21 GLN 107 2HE2 GLN 107 -6.082 -8.792 -16.580 808 HE22 GLN 107 1HE2 GLN 107 -7.480 -8.496 -15.609 809 H SER 108 H SER 108 -4.967 -12.536 -19.513 810 HA SER 108 HA SER 108 -6.921 -14.729 -19.762 811 HB2 SER 108 1HB SER 108 -6.351 -13.815 -21.943 812 HB3 SER 108 2HB SER 108 -4.630 -13.988 -21.598 813 HG SER 108 HG SER 108 -4.784 -15.949 -22.303 Start of MODEL 17 1 H1 SER 1 H SER 1 4.642 -1.241 3.141 2 HA SER 1 HA SER 1 2.034 -0.670 2.268 3 HB2 SER 1 1HB SER 1 4.513 -0.306 0.585 4 HB3 SER 1 2HB SER 1 3.037 0.659 0.572 5 HG SER 1 HG SER 1 4.159 1.881 1.877 6 H LEU 2 H LEU 2 4.506 -2.855 0.991 7 HA LEU 2 HA LEU 2 3.380 -3.610 -1.395 8 HB2 LEU 2 1HB LEU 2 5.574 -4.355 -0.422 9 HB3 LEU 2 2HB LEU 2 4.670 -5.526 0.537 10 HG LEU 2 HG LEU 2 3.954 -6.671 -1.474 11 HD11 LEU 2 1HD1 LEU 2 5.143 -4.291 -2.793 12 HD12 LEU 2 2HD1 LEU 2 3.680 -5.194 -3.186 13 HD13 LEU 2 3HD1 LEU 2 5.261 -5.846 -3.617 14 HD21 LEU 2 3HD2 LEU 2 6.900 -6.126 -1.232 15 HD22 LEU 2 1HD2 LEU 2 6.246 -7.319 -2.353 16 HD23 LEU 2 2HD2 LEU 2 5.984 -7.503 -0.619 17 H THR 3 H THR 3 2.241 -5.642 -1.952 18 HA THR 3 HA THR 3 0.273 -6.802 -1.922 19 HB THR 3 HB THR 3 -0.051 -8.292 -0.050 20 HG1 THR 3 HG1 THR 3 1.988 -6.978 1.402 21 HG21 THR 3 3HG2 THR 3 2.912 -8.111 -0.050 22 HG22 THR 3 1HG2 THR 3 2.113 -8.327 -1.606 23 HG23 THR 3 2HG2 THR 3 1.864 -9.503 -0.316 24 H ASP 4 H ASP 4 -0.578 -4.415 -1.955 25 HA ASP 4 HA ASP 4 -2.395 -4.060 0.338 26 HB2 ASP 4 1HB ASP 4 -1.022 -2.146 0.278 27 HB3 ASP 4 2HB ASP 4 -1.077 -2.057 -1.481 28 H ILE 5 H ILE 5 -2.173 -3.429 -3.164 29 HA ILE 5 HA ILE 5 -4.966 -3.131 -3.528 30 HB ILE 5 HB ILE 5 -2.738 -2.728 -5.108 31 HG12 ILE 5 1HG1 ILE 5 -4.693 -2.326 -6.891 32 HG13 ILE 5 2HG1 ILE 5 -5.688 -2.522 -5.451 33 HG21 ILE 5 1HG2 ILE 5 -2.809 -5.130 -5.726 34 HG22 ILE 5 2HG2 ILE 5 -4.410 -4.867 -6.417 35 HG23 ILE 5 3HG2 ILE 5 -3.008 -4.044 -7.102 36 HD11 ILE 5 3HD1 ILE 5 -5.352 -0.368 -5.070 37 HD12 ILE 5 1HD1 ILE 5 -3.686 -0.779 -4.666 38 HD13 ILE 5 2HD1 ILE 5 -4.098 -0.275 -6.306 39 H LEU 6 H LEU 6 -3.023 -5.868 -3.044 40 HA LEU 6 HA LEU 6 -5.217 -7.610 -3.951 41 HB2 LEU 6 1HB LEU 6 -2.671 -7.548 -5.013 42 HB3 LEU 6 2HB LEU 6 -2.604 -8.889 -3.870 43 HG LEU 6 HG LEU 6 -4.791 -9.650 -5.094 44 HD11 LEU 6 1HD1 LEU 6 -3.921 -8.862 -7.634 45 HD12 LEU 6 2HD1 LEU 6 -3.963 -7.392 -6.662 46 HD13 LEU 6 3HD1 LEU 6 -5.408 -8.392 -6.812 47 HD21 LEU 6 3HD2 LEU 6 -3.466 -11.267 -5.863 48 HD22 LEU 6 1HD2 LEU 6 -2.109 -10.328 -5.241 49 HD23 LEU 6 2HD2 LEU 6 -2.602 -10.155 -6.926 50 H SER 7 H SER 7 -4.388 -9.998 -2.966 51 HA SER 7 HA SER 7 -4.700 -9.580 -0.104 52 HB2 SER 7 1HB SER 7 -6.022 -11.270 -1.589 53 HB3 SER 7 2HB SER 7 -4.588 -12.282 -1.412 54 HG SER 7 HG SER 7 -4.973 -11.643 0.974 55 HA PRO 8 HA PRO 8 -0.332 -10.173 0.524 56 HB2 PRO 8 1HB PRO 8 -0.421 -10.034 3.234 57 HB3 PRO 8 2HB PRO 8 -0.520 -8.607 2.195 58 HG2 PRO 8 1HG PRO 8 -2.719 -10.122 3.547 59 HG3 PRO 8 2HG PRO 8 -2.494 -8.369 3.400 60 HD2 PRO 8 1HD PRO 8 -4.199 -9.757 1.819 61 HD3 PRO 8 2HD PRO 8 -3.331 -8.316 1.253 62 H SER 9 H SER 9 -2.910 -12.103 1.852 63 HA SER 9 HA SER 9 -1.049 -14.183 2.718 64 HB2 SER 9 1HB SER 9 -3.042 -15.276 3.673 65 HB3 SER 9 2HB SER 9 -2.885 -13.614 4.241 66 HG SER 9 HG SER 9 -4.931 -13.634 3.620 67 H ASP 10 H ASP 10 -1.570 -13.470 -0.130 68 HA ASP 10 HA ASP 10 -2.325 -16.166 -1.034 69 HB2 ASP 10 1HB ASP 10 -3.210 -13.516 -2.170 70 HB3 ASP 10 2HB ASP 10 -3.263 -15.004 -3.111 71 H ILE 11 H ILE 11 -0.465 -13.239 -1.572 72 HA ILE 11 HA ILE 11 0.900 -14.178 -3.891 73 HB ILE 11 HB ILE 11 1.678 -11.995 -1.953 74 HG12 ILE 11 1HG1 ILE 11 0.647 -11.398 -4.669 75 HG13 ILE 11 2HG1 ILE 11 -0.525 -12.013 -3.509 76 HG21 ILE 11 1HG2 ILE 11 3.014 -13.129 -4.275 77 HG22 ILE 11 2HG2 ILE 11 2.763 -11.389 -4.409 78 HG23 ILE 11 3HG2 ILE 11 3.635 -12.050 -3.026 79 HD11 ILE 11 3HD1 ILE 11 -0.092 -10.201 -2.017 80 HD12 ILE 11 1HD1 ILE 11 1.253 -9.641 -3.010 81 HD13 ILE 11 2HD1 ILE 11 -0.398 -9.541 -3.624 82 H ALA 12 H ALA 12 1.379 -14.519 -0.468 83 HA ALA 12 HA ALA 12 4.123 -15.258 -0.545 84 HB1 ALA 12 1HB ALA 12 3.940 -15.214 1.672 85 HB2 ALA 12 2HB ALA 12 2.260 -14.728 1.440 86 HB3 ALA 12 3HB ALA 12 2.662 -16.431 1.661 87 H ALA 13 H ALA 13 1.143 -16.959 -1.082 88 HA ALA 13 HA ALA 13 2.231 -19.591 -0.750 89 HB1 ALA 13 1HB ALA 13 -0.299 -18.756 -2.162 90 HB2 ALA 13 2HB ALA 13 0.114 -20.378 -1.607 91 HB3 ALA 13 3HB ALA 13 -0.164 -19.090 -0.435 92 H ALA 14 H ALA 14 2.337 -17.251 -3.217 93 HA ALA 14 HA ALA 14 2.684 -19.153 -5.381 94 HB1 ALA 14 1HB ALA 14 1.715 -16.635 -5.343 95 HB2 ALA 14 2HB ALA 14 3.379 -16.331 -5.842 96 HB3 ALA 14 3HB ALA 14 2.361 -17.421 -6.783 97 H LEU 15 H LEU 15 4.646 -17.070 -3.344 98 HA LEU 15 HA LEU 15 7.060 -17.364 -4.814 99 HB2 LEU 15 1HB LEU 15 6.589 -16.641 -1.926 100 HB3 LEU 15 2HB LEU 15 8.140 -16.518 -2.753 101 HG LEU 15 HG LEU 15 5.686 -14.987 -3.597 102 HD11 LEU 15 1HD1 LEU 15 7.766 -13.420 -2.353 103 HD12 LEU 15 2HD1 LEU 15 7.112 -14.620 -1.239 104 HD13 LEU 15 3HD1 LEU 15 6.034 -13.463 -2.020 105 HD21 LEU 15 3HD2 LEU 15 7.340 -15.247 -5.340 106 HD22 LEU 15 1HD2 LEU 15 8.618 -14.710 -4.249 107 HD23 LEU 15 2HD2 LEU 15 7.355 -13.585 -4.750 108 H ARG 16 H ARG 16 5.373 -19.377 -2.604 109 HA ARG 16 HA ARG 16 7.736 -20.993 -2.025 110 HB2 ARG 16 1HB ARG 16 6.238 -20.536 -0.163 111 HB3 ARG 16 2HB ARG 16 4.881 -21.211 -1.056 112 HG2 ARG 16 1HG ARG 16 6.812 -23.224 -1.029 113 HG3 ARG 16 2HG ARG 16 6.827 -22.533 0.595 114 HD2 ARG 16 1HD ARG 16 4.453 -23.638 -0.897 115 HD3 ARG 16 2HD ARG 16 5.232 -24.330 0.525 116 HE ARG 16 HE ARG 16 4.444 -21.824 1.298 117 HH11 ARG 16 1HH1 ARG 16 2.862 -24.637 -0.008 118 HH12 ARG 16 2HH1 ARG 16 1.354 -24.317 0.782 119 HH21 ARG 16 1HH2 ARG 16 2.463 -21.392 2.343 120 HH22 ARG 16 2HH2 ARG 16 1.128 -22.470 2.118 121 H ASP 17 H ASP 17 4.497 -21.388 -3.445 122 HA ASP 17 HA ASP 17 4.778 -24.049 -4.251 123 HB2 ASP 17 1HB ASP 17 2.683 -22.517 -4.231 124 HB3 ASP 17 2HB ASP 17 3.198 -22.055 -5.851 125 H CYS 18 H CYS 18 5.608 -21.038 -5.908 126 HA CYS 18 HA CYS 18 6.806 -22.601 -8.088 127 HB2 CYS 18 1HB CYS 18 5.833 -19.763 -7.892 128 HB3 CYS 18 2HB CYS 18 6.951 -20.245 -9.162 129 HG CYS 18 HG CYS 18 4.852 -22.495 -9.543 130 H GLN 19 H GLN 19 8.014 -22.274 -5.442 131 HA GLN 19 HA GLN 19 10.116 -20.361 -5.605 132 HB2 GLN 19 1HB GLN 19 10.931 -21.299 -3.589 133 HB3 GLN 19 2HB GLN 19 9.178 -21.402 -3.492 134 HG2 GLN 19 1HG GLN 19 9.268 -23.751 -4.120 135 HG3 GLN 19 2HG GLN 19 11.023 -23.654 -4.255 136 HE21 GLN 19 2HE2 GLN 19 8.509 -22.783 -1.901 137 HE22 GLN 19 1HE2 GLN 19 9.331 -23.432 -0.528 138 H ALA 20 H ALA 20 9.670 -23.557 -6.818 139 HA ALA 20 HA ALA 20 12.348 -24.384 -7.048 140 HB1 ALA 20 1HB ALA 20 11.500 -26.200 -8.058 141 HB2 ALA 20 2HB ALA 20 9.943 -25.530 -7.570 142 HB3 ALA 20 3HB ALA 20 10.552 -25.249 -9.201 143 HA PRO 21 HA PRO 21 14.029 -22.076 -10.379 144 HB2 PRO 21 1HB PRO 21 15.473 -23.950 -11.712 145 HB3 PRO 21 2HB PRO 21 15.952 -23.310 -10.135 146 HG2 PRO 21 1HG PRO 21 14.548 -25.871 -10.793 147 HG3 PRO 21 2HG PRO 21 15.866 -25.581 -9.642 148 HD2 PRO 21 1HD PRO 21 13.281 -25.812 -8.869 149 HD3 PRO 21 2HD PRO 21 14.441 -24.768 -8.022 150 H ASP 22 H ASP 22 13.404 -21.383 -12.344 151 HA ASP 22 HA ASP 22 12.213 -21.231 -14.278 152 HB2 ASP 22 1HB ASP 22 13.989 -23.004 -14.827 153 HB3 ASP 22 2HB ASP 22 12.692 -24.182 -14.644 154 H SER 23 H SER 23 10.842 -22.055 -11.770 155 HA SER 23 HA SER 23 8.517 -23.428 -12.949 156 HB2 SER 23 1HB SER 23 9.760 -23.530 -10.244 157 HB3 SER 23 2HB SER 23 8.004 -23.664 -10.337 158 HG SER 23 HG SER 23 9.651 -25.228 -12.001 159 H PHE 24 H PHE 24 9.664 -20.480 -11.814 160 HA PHE 24 HA PHE 24 7.026 -19.505 -11.017 161 HB2 PHE 24 1HB PHE 24 8.977 -18.915 -9.619 162 HB3 PHE 24 2HB PHE 24 9.701 -18.091 -10.996 163 HD1 PHE 24 HD1 PHE 24 6.376 -18.113 -9.292 164 HD2 PHE 24 HD2 PHE 24 9.572 -15.812 -10.907 165 HE1 PHE 24 HE1 PHE 24 5.200 -16.045 -8.664 166 HE2 PHE 24 HE2 PHE 24 8.401 -13.740 -10.281 167 HZ PHE 24 HZ PHE 24 6.213 -13.855 -9.157 168 H SER 25 H SER 25 5.750 -18.402 -12.348 169 HA SER 25 HA SER 25 6.919 -16.965 -14.615 170 HB2 SER 25 1HB SER 25 5.072 -19.289 -14.763 171 HB3 SER 25 2HB SER 25 4.752 -17.947 -15.861 172 HG SER 25 HG SER 25 6.227 -18.910 -17.023 173 HA PRO 26 HA PRO 26 3.975 -13.835 -13.736 174 HB2 PRO 26 1HB PRO 26 3.286 -12.954 -16.210 175 HB3 PRO 26 2HB PRO 26 4.865 -12.635 -15.482 176 HG2 PRO 26 1HG PRO 26 4.090 -14.721 -17.484 177 HG3 PRO 26 2HG PRO 26 5.530 -13.687 -17.446 178 HD2 PRO 26 1HD PRO 26 5.567 -16.268 -16.625 179 HD3 PRO 26 2HD PRO 26 6.600 -15.020 -15.899 180 H LYS 27 H LYS 27 2.943 -16.127 -16.237 181 HA LYS 27 HA LYS 27 0.138 -15.612 -15.605 182 HB2 LYS 27 1HB LYS 27 -0.367 -16.993 -17.545 183 HB3 LYS 27 2HB LYS 27 0.807 -15.756 -17.971 184 HG2 LYS 27 1HG LYS 27 2.539 -17.645 -17.441 185 HG3 LYS 27 2HG LYS 27 1.156 -18.702 -17.735 186 HD2 LYS 27 1HD LYS 27 1.954 -16.545 -19.670 187 HD3 LYS 27 2HD LYS 27 2.663 -18.160 -19.725 188 HE2 LYS 27 1HE LYS 27 0.375 -19.099 -19.915 189 HE3 LYS 27 2HE LYS 27 -0.258 -17.456 -19.991 190 HZ1 LYS 27 3HZ LYS 27 -0.047 -17.829 -22.191 191 HZ2 LYS 27 1HZ LYS 27 1.170 -18.990 -22.010 192 HZ3 LYS 27 2HZ LYS 27 1.551 -17.345 -21.918 193 H LYS 28 H LYS 28 1.772 -16.857 -13.609 194 HA LYS 28 HA LYS 28 0.324 -19.402 -13.365 195 HB2 LYS 28 1HB LYS 28 2.649 -19.883 -14.038 196 HB3 LYS 28 2HB LYS 28 3.232 -18.981 -12.646 197 HG2 LYS 28 1HG LYS 28 3.368 -21.198 -11.973 198 HG3 LYS 28 2HG LYS 28 1.863 -20.632 -11.244 199 HD2 LYS 28 1HD LYS 28 0.576 -21.664 -13.013 200 HD3 LYS 28 2HD LYS 28 2.054 -22.137 -13.853 201 HE2 LYS 28 1HE LYS 28 1.175 -24.042 -12.676 202 HE3 LYS 28 2HE LYS 28 2.668 -23.524 -11.894 203 HZ1 LYS 28 3HZ LYS 28 -0.039 -23.541 -10.876 204 HZ2 LYS 28 1HZ LYS 28 0.836 -22.136 -10.525 205 HZ3 LYS 28 2HZ LYS 28 1.431 -23.646 -10.047 206 H PHE 29 H PHE 29 2.102 -16.815 -11.740 207 HA PHE 29 HA PHE 29 1.085 -17.571 -9.141 208 HB2 PHE 29 1HB PHE 29 2.520 -15.975 -8.254 209 HB3 PHE 29 2HB PHE 29 3.371 -16.445 -9.721 210 HD1 PHE 29 HD2 PHE 29 2.875 -14.999 -11.828 211 HD2 PHE 29 HD1 PHE 29 2.135 -13.745 -7.829 212 HE1 PHE 29 HE2 PHE 29 2.905 -12.651 -12.562 213 HE2 PHE 29 HE1 PHE 29 2.163 -11.395 -8.557 214 HZ PHE 29 HZ PHE 29 2.549 -10.845 -10.926 215 H PHE 30 H PHE 30 0.231 -15.420 -11.711 216 HA PHE 30 HA PHE 30 -1.240 -13.469 -10.430 217 HB2 PHE 30 1HB PHE 30 -2.316 -13.066 -12.492 218 HB3 PHE 30 2HB PHE 30 -0.741 -13.721 -12.927 219 HD1 PHE 30 HD1 PHE 30 -0.825 -16.458 -12.967 220 HD2 PHE 30 HD2 PHE 30 -4.048 -13.801 -13.784 221 HE1 PHE 30 HE1 PHE 30 -1.921 -18.206 -14.308 222 HE2 PHE 30 HE2 PHE 30 -5.150 -15.544 -15.125 223 HZ PHE 30 HZ PHE 30 -4.088 -17.750 -15.388 224 H GLN 31 H GLN 31 -2.029 -16.819 -10.974 225 HA GLN 31 HA GLN 31 -4.793 -16.474 -10.165 226 HB2 GLN 31 1HB GLN 31 -5.130 -18.697 -10.778 227 HB3 GLN 31 2HB GLN 31 -3.898 -18.155 -11.910 228 HG2 GLN 31 1HG GLN 31 -2.234 -19.108 -10.170 229 HG3 GLN 31 2HG GLN 31 -3.638 -19.991 -9.572 230 HE21 GLN 31 2HE2 GLN 31 -1.033 -20.332 -11.415 231 HE22 GLN 31 1HE2 GLN 31 -1.599 -21.485 -12.570 232 H ILE 32 H ILE 32 -1.752 -17.436 -8.784 233 HA ILE 32 HA ILE 32 -2.852 -18.689 -6.458 234 HB ILE 32 HB ILE 32 -0.076 -17.615 -6.968 235 HG12 ILE 32 1HG1 ILE 32 -0.780 -20.518 -6.827 236 HG13 ILE 32 2HG1 ILE 32 -1.147 -19.630 -8.302 237 HG21 ILE 32 1HG2 ILE 32 -0.358 -17.689 -4.620 238 HG22 ILE 32 2HG2 ILE 32 -1.199 -19.236 -4.698 239 HG23 ILE 32 3HG2 ILE 32 0.526 -19.151 -5.057 240 HD11 ILE 32 3HD1 ILE 32 1.567 -19.227 -7.284 241 HD12 ILE 32 1HD1 ILE 32 1.198 -20.877 -7.784 242 HD13 ILE 32 2HD1 ILE 32 0.998 -19.545 -8.922 243 H SER 33 H SER 33 -1.384 -15.519 -7.113 244 HA SER 33 HA SER 33 -1.845 -14.563 -4.450 245 HB2 SER 33 1HB SER 33 -1.199 -12.332 -5.484 246 HB3 SER 33 2HB SER 33 0.009 -13.611 -5.609 247 HG SER 33 HG SER 33 -1.600 -12.472 -7.597 248 H GLY 34 H GLY 34 -3.239 -13.727 -7.628 249 HA2 GLY 34 1HA GLY 34 -5.762 -13.715 -7.594 250 HA3 GLY 34 2HA GLY 34 -5.593 -12.671 -6.190 251 H MET 35 H MET 35 -3.855 -12.681 -9.291 252 HA MET 35 HA MET 35 -4.506 -9.839 -9.571 253 HB2 MET 35 1HB MET 35 -2.395 -11.588 -10.824 254 HB3 MET 35 2HB MET 35 -2.729 -9.960 -11.397 255 HG2 MET 35 1HG MET 35 -2.416 -9.457 -8.785 256 HG3 MET 35 2HG MET 35 -1.374 -10.869 -8.945 257 HE1 MET 35 3HE MET 35 1.053 -9.727 -11.791 258 HE2 MET 35 1HE MET 35 0.124 -11.079 -11.143 259 HE3 MET 35 2HE MET 35 -0.604 -9.999 -12.332 260 H SER 36 H SER 36 -5.082 -12.940 -11.000 261 HA SER 36 HA SER 36 -5.790 -12.269 -13.594 262 HB2 SER 36 1HB SER 36 -5.682 -14.589 -12.385 263 HB3 SER 36 2HB SER 36 -7.393 -14.299 -12.073 264 HG SER 36 HG SER 36 -7.141 -15.420 -14.015 265 H LYS 37 H LYS 37 -7.626 -11.967 -10.614 266 HA LYS 37 HA LYS 37 -10.134 -11.389 -11.770 267 HB2 LYS 37 1HB LYS 37 -10.629 -10.344 -9.532 268 HB3 LYS 37 2HB LYS 37 -10.069 -12.011 -9.471 269 HG2 LYS 37 1HG LYS 37 -7.747 -10.517 -9.281 270 HG3 LYS 37 2HG LYS 37 -8.919 -9.625 -8.309 271 HD2 LYS 37 1HD LYS 37 -8.174 -12.535 -8.032 272 HD3 LYS 37 2HD LYS 37 -7.778 -11.229 -6.913 273 HE2 LYS 37 1HE LYS 37 -9.637 -11.802 -5.818 274 HE3 LYS 37 2HE LYS 37 -10.516 -11.049 -7.147 275 HZ1 LYS 37 3HZ LYS 37 -10.429 -13.773 -6.395 276 HZ2 LYS 37 1HZ LYS 37 -9.877 -13.605 -7.985 277 HZ3 LYS 37 2HZ LYS 37 -11.404 -13.021 -7.554 278 H LYS 38 H LYS 38 -7.292 -9.472 -11.233 279 HA LYS 38 HA LYS 38 -8.327 -6.898 -11.228 280 HB2 LYS 38 1HB LYS 38 -5.773 -7.833 -12.550 281 HB3 LYS 38 2HB LYS 38 -6.147 -6.179 -12.085 282 HG2 LYS 38 1HG LYS 38 -5.768 -8.524 -10.236 283 HG3 LYS 38 2HG LYS 38 -4.666 -7.164 -10.467 284 HD2 LYS 38 1HD LYS 38 -5.718 -6.277 -8.693 285 HD3 LYS 38 2HD LYS 38 -6.997 -5.890 -9.846 286 HE2 LYS 38 1HE LYS 38 -8.370 -7.534 -9.081 287 HE3 LYS 38 2HE LYS 38 -7.034 -8.597 -8.643 288 HZ1 LYS 38 3HZ LYS 38 -8.501 -6.841 -6.997 289 HZ2 LYS 38 1HZ LYS 38 -6.874 -6.375 -6.989 290 HZ3 LYS 38 2HZ LYS 38 -7.304 -7.953 -6.557 291 H SER 39 H SER 39 -7.751 -5.342 -13.190 292 HA SER 39 HA SER 39 -8.311 -6.395 -15.797 293 HB2 SER 39 1HB SER 39 -10.489 -5.225 -14.151 294 HB3 SER 39 2HB SER 39 -10.410 -4.711 -15.836 295 HG SER 39 HG SER 39 -11.615 -6.518 -15.897 296 H SER 40 H SER 40 -6.141 -5.089 -15.280 297 HA SER 40 HA SER 40 -4.851 -3.255 -15.693 298 HB2 SER 40 1HB SER 40 -6.452 -3.704 -17.897 299 HB3 SER 40 2HB SER 40 -6.702 -1.988 -17.575 300 HG SER 40 HG SER 40 -4.917 -1.974 -18.781 301 H SER 41 H SER 41 -7.020 -3.054 -13.653 302 HA SER 41 HA SER 41 -7.224 -0.114 -13.588 303 HB2 SER 41 1HB SER 41 -9.435 -1.114 -13.917 304 HB3 SER 41 2HB SER 41 -9.201 -2.133 -12.497 305 HG SER 41 HG SER 41 -9.289 -0.347 -11.203 306 H GLN 42 H GLN 42 -5.834 -2.780 -12.203 307 HA GLN 42 HA GLN 42 -5.273 -1.290 -9.740 308 HB2 GLN 42 1HB GLN 42 -5.917 -4.243 -9.826 309 HB3 GLN 42 2HB GLN 42 -5.463 -3.323 -8.398 310 HG2 GLN 42 1HG GLN 42 -7.642 -3.096 -8.043 311 HG3 GLN 42 2HG GLN 42 -7.609 -1.916 -9.353 312 HE21 GLN 42 2HE2 GLN 42 -7.147 -3.746 -11.461 313 HE22 GLN 42 1HE2 GLN 42 -8.590 -4.669 -11.684 314 H LEU 43 H LEU 43 -4.140 -2.860 -12.423 315 HA LEU 43 HA LEU 43 -1.805 -4.109 -11.358 316 HB2 LEU 43 1HB LEU 43 -1.923 -3.134 -14.168 317 HB3 LEU 43 2HB LEU 43 -1.256 -4.634 -13.526 318 HG LEU 43 HG LEU 43 -4.167 -3.990 -13.979 319 HD11 LEU 43 1HD1 LEU 43 -2.973 -4.534 -16.012 320 HD12 LEU 43 2HD1 LEU 43 -4.030 -5.870 -15.560 321 HD13 LEU 43 3HD1 LEU 43 -2.296 -5.978 -15.259 322 HD21 LEU 43 3HD2 LEU 43 -4.506 -6.377 -13.288 323 HD22 LEU 43 1HD2 LEU 43 -4.055 -5.281 -11.982 324 HD23 LEU 43 2HD2 LEU 43 -2.851 -6.366 -12.676 325 H LYS 44 H LYS 44 -2.030 -1.294 -13.536 326 HA LYS 44 HA LYS 44 0.567 -0.360 -12.814 327 HB2 LYS 44 1HB LYS 44 0.257 1.306 -14.404 328 HB3 LYS 44 2HB LYS 44 -0.770 0.014 -15.009 329 HG2 LYS 44 1HG LYS 44 -1.708 2.386 -13.409 330 HG3 LYS 44 2HG LYS 44 -1.854 2.199 -15.158 331 HD2 LYS 44 1HD LYS 44 -3.234 0.192 -14.808 332 HD3 LYS 44 2HD LYS 44 -3.117 0.430 -13.063 333 HE2 LYS 44 1HE LYS 44 -4.223 2.513 -14.933 334 HE3 LYS 44 2HE LYS 44 -5.227 1.281 -14.170 335 HZ1 LYS 44 3HZ LYS 44 -3.486 2.809 -12.408 336 HZ2 LYS 44 1HZ LYS 44 -5.069 2.264 -12.162 337 HZ3 LYS 44 2HZ LYS 44 -4.786 3.651 -13.088 338 H GLU 45 H GLU 45 -2.364 -0.217 -11.234 339 HA GLU 45 HA GLU 45 -2.579 2.331 -10.205 340 HB2 GLU 45 1HB GLU 45 -4.076 0.272 -9.824 341 HB3 GLU 45 2HB GLU 45 -2.993 -0.107 -8.492 342 HG2 GLU 45 1HG GLU 45 -4.522 2.468 -8.781 343 HG3 GLU 45 2HG GLU 45 -5.025 1.098 -7.793 344 H ILE 46 H ILE 46 -0.567 -0.339 -9.019 345 HA ILE 46 HA ILE 46 0.597 1.328 -6.955 346 HB ILE 46 HB ILE 46 1.599 -1.395 -7.736 347 HG12 ILE 46 1HG1 ILE 46 -0.115 -1.875 -5.657 348 HG13 ILE 46 2HG1 ILE 46 -1.004 -0.662 -6.572 349 HG21 ILE 46 1HG2 ILE 46 1.578 0.209 -5.189 350 HG22 ILE 46 2HG2 ILE 46 2.041 -1.490 -5.266 351 HG23 ILE 46 3HG2 ILE 46 2.974 -0.281 -6.148 352 HD11 ILE 46 3HD1 ILE 46 -0.313 -3.447 -7.273 353 HD12 ILE 46 1HD1 ILE 46 -1.775 -2.518 -7.604 354 HD13 ILE 46 2HD1 ILE 46 -0.328 -2.263 -8.581 355 H PHE 47 H PHE 47 1.404 0.159 -10.143 356 HA PHE 47 HA PHE 47 3.116 0.623 -11.566 357 HB2 PHE 47 1HB PHE 47 3.102 2.993 -9.750 358 HB3 PHE 47 2HB PHE 47 4.453 2.800 -10.862 359 HD1 PHE 47 HD2 PHE 47 3.396 1.880 -13.301 360 HD2 PHE 47 HD1 PHE 47 1.612 4.552 -10.509 361 HE1 PHE 47 HE2 PHE 47 2.048 2.864 -15.109 362 HE2 PHE 47 HE1 PHE 47 0.260 5.540 -12.312 363 HZ PHE 47 HZ PHE 47 0.478 4.697 -14.616 364 H ARG 48 H ARG 48 3.521 -0.882 -8.932 365 HA ARG 48 HA ARG 48 6.452 -0.950 -9.105 366 HB2 ARG 48 1HB ARG 48 6.787 -0.678 -6.878 367 HB3 ARG 48 2HB ARG 48 5.256 0.182 -6.978 368 HG2 ARG 48 1HG ARG 48 4.098 -1.923 -6.350 369 HG3 ARG 48 2HG ARG 48 5.680 -2.667 -6.111 370 HD2 ARG 48 1HD ARG 48 6.087 -1.512 -4.198 371 HD3 ARG 48 2HD ARG 48 5.191 -0.093 -4.738 372 HE ARG 48 HE ARG 48 3.558 -2.399 -4.151 373 HH11 ARG 48 1HH1 ARG 48 5.028 0.502 -2.908 374 HH12 ARG 48 2HH1 ARG 48 3.915 0.656 -1.590 375 HH21 ARG 48 1HH2 ARG 48 2.087 -2.207 -2.419 376 HH22 ARG 48 2HH2 ARG 48 2.243 -0.885 -1.312 377 H ILE 49 H ILE 49 3.700 -2.576 -9.603 378 HA ILE 49 HA ILE 49 4.709 -5.155 -8.629 379 HB ILE 49 HB ILE 49 2.486 -6.045 -9.082 380 HG12 ILE 49 1HG1 ILE 49 1.685 -3.237 -9.859 381 HG13 ILE 49 2HG1 ILE 49 2.034 -4.507 -11.027 382 HG21 ILE 49 1HG2 ILE 49 2.339 -3.467 -7.526 383 HG22 ILE 49 2HG2 ILE 49 1.261 -4.852 -7.364 384 HG23 ILE 49 3HG2 ILE 49 2.958 -4.998 -6.907 385 HD11 ILE 49 3HD1 ILE 49 0.161 -5.518 -9.154 386 HD12 ILE 49 1HD1 ILE 49 -0.398 -3.940 -9.709 387 HD13 ILE 49 2HD1 ILE 49 -0.050 -5.214 -10.878 388 H LEU 50 H LEU 50 4.277 -3.285 -11.470 389 HA LEU 50 HA LEU 50 4.472 -5.599 -13.235 390 HB2 LEU 50 1HB LEU 50 4.460 -2.729 -14.102 391 HB3 LEU 50 2HB LEU 50 3.967 -4.156 -15.011 392 HG LEU 50 HG LEU 50 2.431 -3.325 -12.581 393 HD11 LEU 50 1HD1 LEU 50 2.645 -1.311 -13.962 394 HD12 LEU 50 2HD1 LEU 50 0.996 -1.935 -13.958 395 HD13 LEU 50 3HD1 LEU 50 2.038 -2.209 -15.354 396 HD21 LEU 50 3HD2 LEU 50 0.703 -4.210 -14.504 397 HD22 LEU 50 1HD2 LEU 50 1.398 -5.203 -13.223 398 HD23 LEU 50 2HD2 LEU 50 2.142 -5.180 -14.822 399 H ASP 51 H ASP 51 6.161 -2.464 -12.992 400 HA ASP 51 HA ASP 51 8.720 -3.828 -13.252 401 HB2 ASP 51 1HB ASP 51 9.458 -2.449 -15.124 402 HB3 ASP 51 2HB ASP 51 8.027 -3.371 -15.576 403 H ASN 52 H ASN 52 10.506 -1.969 -13.342 404 HA ASN 52 HA ASN 52 9.779 -0.025 -11.249 405 HB2 ASN 52 1HB ASN 52 11.303 -1.774 -10.422 406 HB3 ASN 52 2HB ASN 52 12.453 -1.373 -11.694 407 HD21 ASN 52 2HD2 ASN 52 14.087 -0.792 -10.324 408 HD22 ASN 52 1HD2 ASN 52 14.035 0.625 -9.337 409 H ASP 53 H ASP 53 10.952 -0.472 -14.398 410 HA ASP 53 HA ASP 53 12.605 1.811 -14.657 411 HB2 ASP 53 1HB ASP 53 11.080 0.149 -16.659 412 HB3 ASP 53 2HB ASP 53 12.064 1.529 -17.138 413 H GLN 54 H GLN 54 9.146 1.287 -14.979 414 HA GLN 54 HA GLN 54 7.396 2.703 -15.337 415 HB2 GLN 54 1HB GLN 54 8.909 3.678 -13.243 416 HB3 GLN 54 2HB GLN 54 8.711 5.088 -14.275 417 HG2 GLN 54 1HG GLN 54 6.895 5.240 -12.872 418 HG3 GLN 54 2HG GLN 54 6.212 4.436 -14.285 419 HE21 GLN 54 2HE2 GLN 54 5.679 2.252 -14.164 420 HE22 GLN 54 1HE2 GLN 54 5.504 1.435 -12.652 421 H SER 55 H SER 55 9.423 2.533 -17.435 422 HA SER 55 HA SER 55 9.342 5.228 -18.587 423 HB2 SER 55 1HB SER 55 10.993 2.781 -19.174 424 HB3 SER 55 2HB SER 55 10.881 4.103 -20.336 425 HG SER 55 HG SER 55 12.200 5.210 -19.142 426 H GLY 56 H GLY 56 7.863 2.155 -18.806 427 HA2 GLY 56 1HA GLY 56 5.696 2.356 -20.103 428 HA3 GLY 56 2HA GLY 56 6.724 2.845 -21.441 429 H PHE 57 H PHE 57 8.824 0.913 -20.681 430 HA PHE 57 HA PHE 57 7.460 -1.568 -21.496 431 HB2 PHE 57 1HB PHE 57 9.289 -2.118 -22.939 432 HB3 PHE 57 2HB PHE 57 8.807 -0.467 -23.317 433 HD1 PHE 57 HD1 PHE 57 10.136 1.413 -22.128 434 HD2 PHE 57 HD2 PHE 57 11.507 -2.597 -22.523 435 HE1 PHE 57 HE1 PHE 57 12.448 2.172 -21.769 436 HE2 PHE 57 HE2 PHE 57 13.822 -1.844 -22.164 437 HZ PHE 57 HZ PHE 57 14.295 0.543 -21.785 438 H ILE 58 H ILE 58 9.359 -3.406 -21.304 439 HA ILE 58 HA ILE 58 10.635 -3.134 -18.681 440 HB ILE 58 HB ILE 58 9.009 -5.570 -19.398 441 HG12 ILE 58 1HG1 ILE 58 8.263 -3.284 -17.560 442 HG13 ILE 58 2HG1 ILE 58 7.534 -3.612 -19.128 443 HG21 ILE 58 1HG2 ILE 58 10.373 -4.654 -16.874 444 HG22 ILE 58 2HG2 ILE 58 9.250 -6.012 -16.951 445 HG23 ILE 58 3HG2 ILE 58 10.763 -6.066 -17.855 446 HD11 ILE 58 3HD1 ILE 58 7.242 -5.996 -17.797 447 HD12 ILE 58 1HD1 ILE 58 6.992 -4.791 -16.534 448 HD13 ILE 58 2HD1 ILE 58 6.004 -4.755 -17.995 449 H GLU 59 H GLU 59 12.370 -4.588 -18.312 450 HA GLU 59 HA GLU 59 13.270 -6.126 -20.644 451 HB2 GLU 59 1HB GLU 59 14.339 -3.723 -20.229 452 HB3 GLU 59 2HB GLU 59 15.320 -4.630 -19.086 453 HG2 GLU 59 1HG GLU 59 16.214 -5.998 -20.780 454 HG3 GLU 59 2HG GLU 59 15.008 -5.465 -21.951 455 H GLU 60 H GLU 60 15.095 -7.616 -20.081 456 HA GLU 60 HA GLU 60 14.385 -9.283 -17.956 457 HB2 GLU 60 1HB GLU 60 16.504 -10.457 -18.397 458 HB3 GLU 60 2HB GLU 60 15.625 -10.106 -19.879 459 HG2 GLU 60 1HG GLU 60 17.140 -7.975 -19.915 460 HG3 GLU 60 2HG GLU 60 18.169 -8.945 -18.863 461 H ASP 61 H ASP 61 16.293 -6.439 -18.007 462 HA ASP 61 HA ASP 61 17.806 -7.011 -15.631 463 HB2 ASP 61 1HB ASP 61 18.608 -5.461 -17.408 464 HB3 ASP 61 2HB ASP 61 17.316 -4.345 -16.974 465 H GLU 62 H GLU 62 14.614 -6.380 -16.121 466 HA GLU 62 HA GLU 62 14.334 -5.160 -13.453 467 HB2 GLU 62 1HB GLU 62 12.920 -4.570 -16.016 468 HB3 GLU 62 2HB GLU 62 12.026 -4.416 -14.510 469 HG2 GLU 62 1HG GLU 62 14.547 -2.960 -15.265 470 HG3 GLU 62 2HG GLU 62 12.926 -2.281 -15.139 471 H LEU 63 H LEU 63 14.385 -8.001 -14.401 472 HA LEU 63 HA LEU 63 11.709 -8.801 -13.461 473 HB2 LEU 63 1HB LEU 63 13.581 -10.476 -15.116 474 HB3 LEU 63 2HB LEU 63 11.892 -10.806 -14.735 475 HG LEU 63 HG LEU 63 12.917 -8.620 -16.546 476 HD11 LEU 63 1HD1 LEU 63 11.103 -10.648 -17.605 477 HD12 LEU 63 2HD1 LEU 63 12.666 -11.285 -17.097 478 HD13 LEU 63 3HD1 LEU 63 12.589 -9.984 -18.284 479 HD21 LEU 63 3HD2 LEU 63 10.921 -7.652 -16.432 480 HD22 LEU 63 1HD2 LEU 63 10.539 -8.715 -15.078 481 HD23 LEU 63 2HD2 LEU 63 10.101 -9.187 -16.720 482 H LYS 64 H LYS 64 15.169 -9.337 -13.214 483 HA LYS 64 HA LYS 64 15.165 -11.540 -11.491 484 HB2 LYS 64 1HB LYS 64 17.429 -10.714 -10.797 485 HB3 LYS 64 2HB LYS 64 17.211 -10.870 -12.535 486 HG2 LYS 64 1HG LYS 64 16.722 -8.415 -12.602 487 HG3 LYS 64 2HG LYS 64 17.207 -8.343 -10.906 488 HD2 LYS 64 1HD LYS 64 19.105 -7.733 -12.208 489 HD3 LYS 64 2HD LYS 64 19.398 -9.362 -11.593 490 HE2 LYS 64 1HE LYS 64 19.094 -10.339 -13.667 491 HE3 LYS 64 2HE LYS 64 18.138 -8.989 -14.277 492 HZ1 LYS 64 3HZ LYS 64 20.866 -9.439 -14.608 493 HZ2 LYS 64 1HZ LYS 64 20.712 -8.070 -13.625 494 HZ3 LYS 64 2HZ LYS 64 19.961 -8.112 -15.139 495 H TYR 65 H TYR 65 15.191 -8.064 -10.752 496 HA TYR 65 HA TYR 65 15.056 -8.514 -7.916 497 HB2 TYR 65 1HB TYR 65 14.462 -5.916 -9.326 498 HB3 TYR 65 2HB TYR 65 15.067 -6.153 -7.690 499 HD1 TYR 65 HD2 TYR 65 17.338 -7.799 -7.845 500 HD2 TYR 65 HD1 TYR 65 16.024 -4.919 -10.688 501 HE1 TYR 65 HE2 TYR 65 19.646 -7.559 -8.661 502 HE2 TYR 65 HE1 TYR 65 18.328 -4.672 -11.512 503 HH TYR 65 HH TYR 65 20.864 -5.280 -10.093 504 H PHE 66 H PHE 66 13.007 -9.909 -9.074 505 HA PHE 66 HA PHE 66 10.583 -8.317 -8.706 506 HB2 PHE 66 1HB PHE 66 10.758 -9.771 -10.702 507 HB3 PHE 66 2HB PHE 66 10.887 -11.175 -9.648 508 HD1 PHE 66 HD2 PHE 66 8.945 -11.743 -8.150 509 HD2 PHE 66 HD1 PHE 66 8.674 -8.889 -11.296 510 HE1 PHE 66 HE2 PHE 66 6.493 -11.941 -8.114 511 HE2 PHE 66 HE1 PHE 66 6.221 -9.082 -11.264 512 HZ PHE 66 HZ PHE 66 5.128 -10.610 -9.673 513 H LEU 67 H LEU 67 11.529 -11.630 -7.784 514 HA LEU 67 HA LEU 67 9.720 -11.971 -5.730 515 HB2 LEU 67 1HB LEU 67 12.529 -13.057 -5.778 516 HB3 LEU 67 2HB LEU 67 11.152 -13.727 -4.906 517 HG LEU 67 HG LEU 67 11.598 -13.700 -7.886 518 HD11 LEU 67 1HD1 LEU 67 12.810 -15.420 -6.636 519 HD12 LEU 67 2HD1 LEU 67 11.544 -16.118 -7.647 520 HD13 LEU 67 3HD1 LEU 67 11.295 -15.956 -5.909 521 HD21 LEU 67 3HD2 LEU 67 9.387 -13.684 -8.125 522 HD22 LEU 67 1HD2 LEU 67 9.133 -13.762 -6.382 523 HD23 LEU 67 2HD2 LEU 67 9.359 -15.247 -7.307 524 H GLN 68 H GLN 68 12.657 -10.130 -5.766 525 HA GLN 68 HA GLN 68 13.349 -9.972 -3.111 526 HB2 GLN 68 1HB GLN 68 14.429 -8.847 -5.155 527 HB3 GLN 68 2HB GLN 68 13.293 -7.534 -4.873 528 HG2 GLN 68 1HG GLN 68 14.311 -6.879 -2.932 529 HG3 GLN 68 2HG GLN 68 14.975 -8.481 -2.611 530 HE21 GLN 68 2HE2 GLN 68 16.326 -9.097 -4.829 531 HE22 GLN 68 1HE2 GLN 68 17.599 -7.966 -5.118 532 H ARG 69 H ARG 69 10.897 -8.047 -4.814 533 HA ARG 69 HA ARG 69 10.126 -6.354 -2.780 534 HB2 ARG 69 1HB ARG 69 8.686 -7.564 -5.103 535 HB3 ARG 69 2HB ARG 69 7.765 -6.652 -3.915 536 HG2 ARG 69 1HG ARG 69 10.219 -5.457 -5.119 537 HG3 ARG 69 2HG ARG 69 8.705 -5.468 -6.025 538 HD2 ARG 69 1HD ARG 69 8.658 -3.423 -4.914 539 HD3 ARG 69 2HD ARG 69 7.668 -4.468 -3.896 540 HE ARG 69 HE ARG 69 9.216 -4.248 -2.226 541 HH11 ARG 69 1HH1 ARG 69 10.628 -3.209 -5.234 542 HH12 ARG 69 2HH1 ARG 69 12.070 -2.594 -4.495 543 HH21 ARG 69 1HH2 ARG 69 11.109 -3.441 -1.241 544 HH22 ARG 69 2HH2 ARG 69 12.342 -2.727 -2.224 545 H PHE 70 H PHE 70 8.120 -9.158 -3.650 546 HA PHE 70 HA PHE 70 6.754 -9.274 -1.224 547 HB2 PHE 70 1HB PHE 70 7.302 -11.601 -3.075 548 HB3 PHE 70 2HB PHE 70 5.976 -11.457 -1.927 549 HD1 PHE 70 HD1 PHE 70 4.329 -9.514 -2.290 550 HD2 PHE 70 HD2 PHE 70 7.023 -10.923 -5.270 551 HE1 PHE 70 HE1 PHE 70 2.929 -8.491 -4.035 552 HE2 PHE 70 HE2 PHE 70 5.627 -9.902 -7.020 553 HZ PHE 70 HZ PHE 70 3.577 -8.683 -6.404 554 H GLU 71 H GLU 71 9.079 -11.750 -2.301 555 HA GLU 71 HA GLU 71 9.481 -12.953 0.146 556 HB2 GLU 71 1HB GLU 71 10.415 -13.416 -2.329 557 HB3 GLU 71 2HB GLU 71 11.859 -12.716 -1.612 558 HG2 GLU 71 1HG GLU 71 12.094 -14.433 -0.082 559 HG3 GLU 71 2HG GLU 71 10.404 -14.918 -0.215 560 H SER 72 H SER 72 11.446 -12.925 1.516 561 HA SER 72 HA SER 72 12.362 -10.156 1.935 562 HB2 SER 72 1HB SER 72 11.586 -12.333 3.824 563 HB3 SER 72 2HB SER 72 12.851 -11.210 4.326 564 HG SER 72 HG SER 72 11.231 -9.544 3.603 565 H GLY 73 H GLY 73 13.419 -12.785 0.504 566 HA2 GLY 73 1HA GLY 73 16.201 -12.271 1.283 567 HA3 GLY 73 2HA GLY 73 15.614 -13.927 1.336 568 H ALA 74 H ALA 74 14.137 -12.159 -1.122 569 HA ALA 74 HA ALA 74 15.493 -13.688 -3.145 570 HB1 ALA 74 1HB ALA 74 13.361 -13.488 -3.845 571 HB2 ALA 74 2HB ALA 74 13.117 -11.955 -3.007 572 HB3 ALA 74 3HB ALA 74 13.951 -11.988 -4.560 573 H ARG 75 H ARG 75 17.278 -13.107 -4.180 574 HA ARG 75 HA ARG 75 18.012 -10.255 -4.224 575 HB2 ARG 75 1HB ARG 75 20.368 -11.250 -4.648 576 HB3 ARG 75 2HB ARG 75 19.710 -11.288 -3.018 577 HG2 ARG 75 1HG ARG 75 18.989 -13.627 -3.417 578 HG3 ARG 75 2HG ARG 75 19.803 -13.566 -4.982 579 HD2 ARG 75 1HD ARG 75 21.822 -13.845 -4.060 580 HD3 ARG 75 2HD ARG 75 21.492 -12.678 -2.781 581 HE ARG 75 HE ARG 75 21.067 -14.431 -1.394 582 HH11 ARG 75 1HH1 ARG 75 20.612 -15.494 -4.678 583 HH12 ARG 75 2HH1 ARG 75 20.300 -17.141 -4.240 584 HH21 ARG 75 1HH2 ARG 75 20.658 -16.596 -0.804 585 HH22 ARG 75 2HH2 ARG 75 20.326 -17.766 -2.036 586 H VAL 76 H VAL 76 18.280 -13.268 -6.100 587 HA VAL 76 HA VAL 76 17.831 -11.742 -8.546 588 HB VAL 76 HB VAL 76 20.141 -13.674 -8.367 589 HG11 VAL 76 1HG1 VAL 76 19.637 -13.600 -10.591 590 HG12 VAL 76 2HG1 VAL 76 18.939 -11.982 -10.494 591 HG13 VAL 76 3HG1 VAL 76 20.691 -12.191 -10.490 592 HG21 VAL 76 3HG2 VAL 76 20.861 -11.907 -7.015 593 HG22 VAL 76 1HG2 VAL 76 21.511 -11.519 -8.608 594 HG23 VAL 76 2HG2 VAL 76 20.068 -10.693 -8.020 595 H LEU 77 H LEU 77 17.084 -13.003 -10.303 596 HA LEU 77 HA LEU 77 15.990 -15.603 -9.478 597 HB2 LEU 77 1HB LEU 77 15.085 -13.498 -11.396 598 HB3 LEU 77 2HB LEU 77 14.552 -15.164 -11.608 599 HG LEU 77 HG LEU 77 14.164 -14.078 -8.904 600 HD11 LEU 77 1HD1 LEU 77 11.965 -13.144 -10.436 601 HD12 LEU 77 2HD1 LEU 77 13.442 -12.462 -11.117 602 HD13 LEU 77 3HD1 LEU 77 13.066 -12.223 -9.410 603 HD21 LEU 77 3HD2 LEU 77 12.955 -15.978 -10.763 604 HD22 LEU 77 1HD2 LEU 77 11.779 -15.024 -9.859 605 HD23 LEU 77 2HD2 LEU 77 12.988 -15.978 -8.999 606 H THR 78 H THR 78 15.576 -17.068 -11.490 607 HA THR 78 HA THR 78 18.155 -17.678 -12.583 608 HB THR 78 HB THR 78 17.120 -19.612 -13.581 609 HG1 THR 78 HG1 THR 78 14.975 -19.778 -13.883 610 HG21 THR 78 3HG2 THR 78 16.300 -20.718 -11.642 611 HG22 THR 78 1HG2 THR 78 15.760 -19.202 -10.922 612 HG23 THR 78 2HG2 THR 78 17.484 -19.538 -11.082 613 H ALA 79 H ALA 79 18.294 -18.265 -14.986 614 HA ALA 79 HA ALA 79 17.683 -15.887 -16.491 615 HB1 ALA 79 1HB ALA 79 19.827 -17.279 -16.619 616 HB2 ALA 79 2HB ALA 79 18.895 -18.384 -17.630 617 HB3 ALA 79 3HB ALA 79 19.127 -16.710 -18.135 618 H SER 80 H SER 80 15.898 -18.532 -15.734 619 HA SER 80 HA SER 80 14.532 -18.641 -18.333 620 HB2 SER 80 1HB SER 80 14.792 -20.554 -16.052 621 HB3 SER 80 2HB SER 80 13.339 -20.628 -17.049 622 HG SER 80 HG SER 80 15.064 -20.570 -18.839 623 H GLU 81 H GLU 81 13.763 -18.562 -14.851 624 HA GLU 81 HA GLU 81 11.061 -18.087 -14.989 625 HB2 GLU 81 1HB GLU 81 13.160 -17.222 -13.028 626 HB3 GLU 81 2HB GLU 81 11.494 -16.698 -12.827 627 HG2 GLU 81 1HG GLU 81 10.724 -18.887 -12.512 628 HG3 GLU 81 2HG GLU 81 12.212 -19.590 -13.142 629 H THR 82 H THR 82 13.668 -15.675 -15.053 630 HA THR 82 HA THR 82 11.924 -13.443 -15.319 631 HB THR 82 HB THR 82 14.002 -12.208 -16.005 632 HG1 THR 82 HG1 THR 82 15.890 -13.290 -16.177 633 HG21 THR 82 3HG2 THR 82 14.995 -13.528 -13.630 634 HG22 THR 82 1HG2 THR 82 13.263 -13.221 -13.515 635 HG23 THR 82 2HG2 THR 82 14.375 -11.889 -13.827 636 H LYS 83 H LYS 83 13.927 -15.248 -17.636 637 HA LYS 83 HA LYS 83 13.473 -13.802 -19.926 638 HB2 LYS 83 1HB LYS 83 15.002 -15.647 -19.955 639 HB3 LYS 83 2HB LYS 83 13.724 -16.788 -19.556 640 HG2 LYS 83 1HG LYS 83 12.733 -16.554 -21.704 641 HG3 LYS 83 2HG LYS 83 13.780 -15.190 -22.104 642 HD2 LYS 83 1HD LYS 83 15.064 -17.771 -21.376 643 HD3 LYS 83 2HD LYS 83 14.291 -17.648 -22.958 644 HE2 LYS 83 1HE LYS 83 16.441 -16.963 -23.431 645 HE3 LYS 83 2HE LYS 83 15.635 -15.424 -23.134 646 HZ1 LYS 83 3HZ LYS 83 16.773 -16.658 -20.784 647 HZ2 LYS 83 1HZ LYS 83 16.849 -15.052 -21.309 648 HZ3 LYS 83 2HZ LYS 83 17.911 -16.202 -21.949 649 H THR 84 H THR 84 11.400 -16.290 -18.492 650 HA THR 84 HA THR 84 9.372 -15.844 -20.541 651 HB THR 84 HB THR 84 9.865 -18.163 -19.847 652 HG1 THR 84 HG1 THR 84 7.254 -17.571 -18.941 653 HG21 THR 84 3HG2 THR 84 10.321 -18.419 -17.657 654 HG22 THR 84 1HG2 THR 84 8.573 -18.565 -17.482 655 HG23 THR 84 2HG2 THR 84 9.362 -17.015 -17.192 656 H PHE 85 H PHE 85 9.964 -13.695 -18.721 657 HA PHE 85 HA PHE 85 7.492 -13.582 -17.128 658 HB2 PHE 85 1HB PHE 85 10.026 -13.134 -16.265 659 HB3 PHE 85 2HB PHE 85 9.548 -11.500 -16.716 660 HD1 PHE 85 HD2 PHE 85 8.524 -14.417 -14.665 661 HD2 PHE 85 HD1 PHE 85 8.219 -10.219 -15.298 662 HE1 PHE 85 HE2 PHE 85 7.323 -14.186 -12.531 663 HE2 PHE 85 HE1 PHE 85 7.018 -9.981 -13.163 664 HZ PHE 85 HZ PHE 85 6.567 -11.967 -11.777 665 H LEU 86 H LEU 86 9.488 -11.808 -19.437 666 HA LEU 86 HA LEU 86 7.173 -10.069 -19.987 667 HB2 LEU 86 1HB LEU 86 8.740 -8.322 -20.649 668 HB3 LEU 86 2HB LEU 86 8.972 -8.804 -18.970 669 HG LEU 86 HG LEU 86 10.891 -10.255 -19.833 670 HD11 LEU 86 1HD1 LEU 86 9.959 -9.096 -22.301 671 HD12 LEU 86 2HD1 LEU 86 11.141 -10.377 -22.034 672 HD13 LEU 86 3HD1 LEU 86 11.650 -8.689 -22.008 673 HD21 LEU 86 3HD2 LEU 86 12.434 -8.489 -19.589 674 HD22 LEU 86 1HD2 LEU 86 11.037 -8.038 -18.611 675 HD23 LEU 86 2HD2 LEU 86 11.283 -7.295 -20.191 676 H ALA 87 H ALA 87 9.540 -12.228 -21.227 677 HA ALA 87 HA ALA 87 9.299 -11.467 -23.980 678 HB1 ALA 87 1HB ALA 87 10.760 -13.218 -24.459 679 HB2 ALA 87 2HB ALA 87 11.251 -12.693 -22.848 680 HB3 ALA 87 3HB ALA 87 10.267 -14.144 -23.041 681 H ALA 88 H ALA 88 7.228 -13.004 -21.880 682 HA ALA 88 HA ALA 88 6.081 -14.822 -23.846 683 HB1 ALA 88 1HB ALA 88 5.091 -14.248 -21.060 684 HB2 ALA 88 2HB ALA 88 4.687 -15.626 -22.085 685 HB3 ALA 88 3HB ALA 88 6.319 -15.455 -21.439 686 H ALA 89 H ALA 89 5.787 -11.593 -22.992 687 HA ALA 89 HA ALA 89 2.990 -11.211 -23.274 688 HB1 ALA 89 1HB ALA 89 3.634 -9.259 -22.434 689 HB2 ALA 89 2HB ALA 89 5.319 -9.567 -22.859 690 HB3 ALA 89 3HB ALA 89 4.232 -8.832 -24.038 691 H ASP 90 H ASP 90 5.447 -9.902 -25.483 692 HA ASP 90 HA ASP 90 4.314 -11.165 -27.789 693 HB2 ASP 90 1HB ASP 90 3.226 -9.390 -28.819 694 HB3 ASP 90 2HB ASP 90 2.762 -9.170 -27.133 695 H HIS 91 H HIS 91 5.172 -9.550 -29.793 696 HA HIS 91 HA HIS 91 7.986 -8.952 -29.207 697 HB2 HIS 91 1HB HIS 91 7.790 -11.254 -30.166 698 HB3 HIS 91 2HB HIS 91 7.078 -10.545 -31.612 699 HD1 HIS 91 HD1 HIS 91 8.848 -10.846 -33.332 700 HD2 HIS 91 HD2 HIS 91 10.365 -9.329 -29.775 701 HE1 HIS 91 HE1 HIS 91 11.260 -10.313 -33.803 702 H ASP 92 H ASP 92 6.480 -6.874 -29.292 703 HA ASP 92 HA ASP 92 5.833 -5.875 -31.881 704 HB2 ASP 92 1HB ASP 92 4.666 -5.060 -29.902 705 HB3 ASP 92 2HB ASP 92 6.176 -4.434 -29.243 706 H GLY 93 H GLY 93 8.678 -5.832 -29.880 707 HA2 GLY 93 1HA GLY 93 10.086 -4.388 -32.027 708 HA3 GLY 93 2HA GLY 93 10.297 -3.889 -30.355 709 H ASP 94 H ASP 94 11.537 -5.137 -28.964 710 HA ASP 94 HA ASP 94 12.860 -7.491 -30.113 711 HB2 ASP 94 1HB ASP 94 14.234 -5.315 -30.314 712 HB3 ASP 94 2HB ASP 94 14.431 -5.442 -28.569 713 H GLY 95 H GLY 95 10.759 -7.015 -28.051 714 HA2 GLY 95 1HA GLY 95 10.540 -8.755 -26.311 715 HA3 GLY 95 2HA GLY 95 12.154 -8.302 -25.786 716 H LYS 96 H LYS 96 11.211 -5.412 -26.425 717 HA LYS 96 HA LYS 96 10.575 -4.732 -23.743 718 HB2 LYS 96 1HB LYS 96 10.224 -2.432 -24.697 719 HB3 LYS 96 2HB LYS 96 11.794 -3.145 -25.044 720 HG2 LYS 96 1HG LYS 96 11.390 -3.300 -27.267 721 HG3 LYS 96 2HG LYS 96 9.658 -3.561 -27.048 722 HD2 LYS 96 1HD LYS 96 9.385 -1.188 -26.477 723 HD3 LYS 96 2HD LYS 96 11.114 -0.936 -26.725 724 HE2 LYS 96 1HE LYS 96 10.907 -1.521 -29.056 725 HE3 LYS 96 2HE LYS 96 9.210 -1.943 -28.836 726 HZ1 LYS 96 3HZ LYS 96 9.516 0.262 -29.826 727 HZ2 LYS 96 1HZ LYS 96 10.347 0.773 -28.444 728 HZ3 LYS 96 2HZ LYS 96 8.714 0.346 -28.339 729 H ILE 97 H ILE 97 8.668 -4.431 -22.757 730 HA ILE 97 HA ILE 97 6.262 -5.224 -24.118 731 HB ILE 97 HB ILE 97 6.408 -4.057 -21.347 732 HG12 ILE 97 1HG1 ILE 97 8.087 -5.814 -21.460 733 HG13 ILE 97 2HG1 ILE 97 6.703 -6.378 -20.530 734 HG21 ILE 97 1HG2 ILE 97 4.477 -5.594 -20.993 735 HG22 ILE 97 2HG2 ILE 97 4.178 -4.315 -22.170 736 HG23 ILE 97 3HG2 ILE 97 4.516 -5.957 -22.719 737 HD11 ILE 97 3HD1 ILE 97 6.565 -8.144 -21.843 738 HD12 ILE 97 1HD1 ILE 97 6.258 -7.093 -23.224 739 HD13 ILE 97 2HD1 ILE 97 7.912 -7.547 -22.812 740 H GLY 98 H GLY 98 4.342 -3.962 -24.300 741 HA2 GLY 98 1HA GLY 98 4.919 -1.089 -24.614 742 HA3 GLY 98 2HA GLY 98 3.694 -1.976 -25.509 743 H ALA 99 H ALA 99 4.140 -2.382 -22.070 744 HA ALA 99 HA ALA 99 2.687 -2.103 -20.331 745 HB1 ALA 99 1HB ALA 99 1.816 0.513 -21.448 746 HB2 ALA 99 2HB ALA 99 2.282 0.084 -19.801 747 HB3 ALA 99 3HB ALA 99 3.518 0.295 -21.041 748 H GLU 100 H GLU 100 1.590 -3.591 -22.423 749 HA GLU 100 HA GLU 100 -1.229 -3.145 -21.926 750 HB2 GLU 100 1HB GLU 100 -1.818 -3.274 -24.338 751 HB3 GLU 100 2HB GLU 100 -0.952 -1.805 -23.909 752 HG2 GLU 100 1HG GLU 100 0.335 -2.260 -25.663 753 HG3 GLU 100 2HG GLU 100 1.081 -3.478 -24.630 754 H GLU 101 H GLU 101 1.293 -5.064 -23.471 755 HA GLU 101 HA GLU 101 -0.312 -7.397 -23.806 756 HB2 GLU 101 1HB GLU 101 2.701 -7.203 -23.684 757 HB3 GLU 101 2HB GLU 101 1.761 -8.523 -24.366 758 HG2 GLU 101 1HG GLU 101 2.252 -7.437 -26.282 759 HG3 GLU 101 2HG GLU 101 0.791 -6.550 -25.852 760 H PHE 102 H PHE 102 2.441 -6.775 -21.621 761 HA PHE 102 HA PHE 102 2.204 -9.022 -20.041 762 HB2 PHE 102 1HB PHE 102 4.090 -7.424 -19.930 763 HB3 PHE 102 2HB PHE 102 3.041 -6.264 -19.122 764 HD1 PHE 102 HD2 PHE 102 4.453 -9.681 -18.787 765 HD2 PHE 102 HD1 PHE 102 2.837 -6.276 -16.810 766 HE1 PHE 102 HE2 PHE 102 5.051 -10.664 -16.612 767 HE2 PHE 102 HE1 PHE 102 3.433 -7.254 -14.632 768 HZ PHE 102 HZ PHE 102 4.540 -9.451 -14.531 769 H GLN 103 H GLN 103 0.300 -6.108 -20.010 770 HA GLN 103 HA GLN 103 -0.914 -6.569 -17.461 771 HB2 GLN 103 1HB GLN 103 -1.432 -4.701 -19.747 772 HB3 GLN 103 2HB GLN 103 -2.626 -4.869 -18.467 773 HG2 GLN 103 1HG GLN 103 -1.184 -2.982 -18.035 774 HG3 GLN 103 2HG GLN 103 -0.941 -4.231 -16.815 775 HE21 GLN 103 2HE2 GLN 103 0.311 -3.818 -20.105 776 HE22 GLN 103 1HE2 GLN 103 1.980 -3.888 -19.664 777 H GLU 104 H GLU 104 -2.003 -6.966 -20.826 778 HA GLU 104 HA GLU 104 -4.519 -8.080 -20.148 779 HB2 GLU 104 1HB GLU 104 -2.883 -8.124 -22.680 780 HB3 GLU 104 2HB GLU 104 -4.463 -8.887 -22.564 781 HG2 GLU 104 1HG GLU 104 -3.888 -5.969 -22.101 782 HG3 GLU 104 2HG GLU 104 -4.589 -6.664 -23.561 783 H MET 105 H MET 105 -1.333 -9.386 -20.364 784 HA MET 105 HA MET 105 -1.980 -12.096 -20.824 785 HB2 MET 105 1HB MET 105 0.279 -11.369 -21.149 786 HB3 MET 105 2HB MET 105 0.393 -10.791 -19.493 787 HG2 MET 105 1HG MET 105 -0.096 -13.295 -18.911 788 HG3 MET 105 2HG MET 105 0.505 -13.570 -20.544 789 HE1 MET 105 3HE MET 105 3.707 -11.240 -20.124 790 HE2 MET 105 1HE MET 105 3.580 -12.739 -21.046 791 HE3 MET 105 2HE MET 105 2.284 -11.545 -21.121 792 H VAL 106 H VAL 106 -1.996 -10.101 -17.968 793 HA VAL 106 HA VAL 106 -2.384 -12.409 -16.223 794 HB VAL 106 HB VAL 106 -2.270 -9.478 -15.500 795 HG11 VAL 106 1HG1 VAL 106 -1.560 -11.390 -13.443 796 HG12 VAL 106 2HG1 VAL 106 -2.715 -10.056 -13.394 797 HG13 VAL 106 3HG1 VAL 106 -3.208 -11.629 -14.023 798 HG21 VAL 106 3HG2 VAL 106 -0.145 -10.014 -16.364 799 HG22 VAL 106 1HG2 VAL 106 0.016 -10.150 -14.613 800 HG23 VAL 106 2HG2 VAL 106 -0.145 -11.603 -15.600 801 H GLN 107 H GLN 107 -4.073 -9.420 -17.147 802 HA GLN 107 HA GLN 107 -6.369 -9.670 -15.659 803 HB2 GLN 107 1HB GLN 107 -6.076 -8.656 -18.491 804 HB3 GLN 107 2HB GLN 107 -7.506 -8.417 -17.495 805 HG2 GLN 107 1HG GLN 107 -6.398 -6.980 -16.034 806 HG3 GLN 107 2HG GLN 107 -4.807 -7.514 -16.572 807 HE21 GLN 107 2HE2 GLN 107 -7.569 -6.623 -18.562 808 HE22 GLN 107 1HE2 GLN 107 -6.821 -5.260 -19.314 809 H SER 108 H SER 108 -5.561 -11.259 -18.705 810 HA SER 108 HA SER 108 -7.931 -12.975 -18.346 811 HB2 SER 108 1HB SER 108 -8.523 -11.890 -20.293 812 HB3 SER 108 2HB SER 108 -6.850 -11.646 -20.792 813 HG SER 108 HG SER 108 -7.734 -13.213 -22.102 Start of MODEL 18 1 H1 SER 1 H SER 1 3.739 2.180 0.135 2 HA SER 1 HA SER 1 2.802 0.073 1.937 3 HB2 SER 1 1HB SER 1 1.300 1.957 0.991 4 HB3 SER 1 2HB SER 1 1.334 1.032 -0.510 5 HG SER 1 HG SER 1 0.244 0.334 1.989 6 H LEU 2 H LEU 2 1.820 -1.881 0.828 7 HA LEU 2 HA LEU 2 2.846 -2.669 -1.717 8 HB2 LEU 2 1HB LEU 2 4.831 -2.863 -0.159 9 HB3 LEU 2 2HB LEU 2 3.950 -4.155 0.654 10 HG LEU 2 HG LEU 2 3.869 -5.166 -1.783 11 HD11 LEU 2 1HD1 LEU 2 5.890 -3.024 -1.933 12 HD12 LEU 2 2HD1 LEU 2 4.925 -3.771 -3.206 13 HD13 LEU 2 3HD1 LEU 2 6.364 -4.589 -2.596 14 HD21 LEU 2 3HD2 LEU 2 6.301 -5.230 0.001 15 HD22 LEU 2 1HD2 LEU 2 5.923 -6.404 -1.260 16 HD23 LEU 2 2HD2 LEU 2 4.869 -6.250 0.146 17 H THR 3 H THR 3 2.035 -4.701 -2.413 18 HA THR 3 HA THR 3 0.327 -6.197 -2.655 19 HB THR 3 HB THR 3 0.102 -7.825 -0.956 20 HG1 THR 3 HG1 THR 3 1.248 -6.051 0.946 21 HG21 THR 3 3HG2 THR 3 2.850 -6.600 -0.687 22 HG22 THR 3 1HG2 THR 3 2.343 -7.758 -1.916 23 HG23 THR 3 2HG2 THR 3 2.413 -8.244 -0.222 24 H ASP 4 H ASP 4 -0.540 -3.545 -2.239 25 HA ASP 4 HA ASP 4 -2.646 -3.474 -0.302 26 HB2 ASP 4 1HB ASP 4 -1.688 -1.380 -0.887 27 HB3 ASP 4 2HB ASP 4 -1.897 -1.682 -2.609 28 H ILE 5 H ILE 5 -3.007 -2.942 -3.795 29 HA ILE 5 HA ILE 5 -5.688 -3.721 -3.893 30 HB ILE 5 HB ILE 5 -4.043 -2.551 -5.669 31 HG12 ILE 5 1HG1 ILE 5 -6.192 -3.842 -7.122 32 HG13 ILE 5 2HG1 ILE 5 -6.738 -3.306 -5.536 33 HG21 ILE 5 1HG2 ILE 5 -2.973 -4.789 -6.109 34 HG22 ILE 5 2HG2 ILE 5 -4.491 -5.278 -6.859 35 HG23 ILE 5 3HG2 ILE 5 -3.566 -3.936 -7.534 36 HD11 ILE 5 3HD1 ILE 5 -7.132 -1.606 -7.213 37 HD12 ILE 5 1HD1 ILE 5 -5.944 -1.050 -6.035 38 HD13 ILE 5 2HD1 ILE 5 -5.419 -1.593 -7.629 39 H LEU 6 H LEU 6 -2.799 -5.606 -3.865 40 HA LEU 6 HA LEU 6 -4.251 -8.010 -4.708 41 HB2 LEU 6 1HB LEU 6 -1.883 -7.232 -5.544 42 HB3 LEU 6 2HB LEU 6 -1.343 -8.008 -4.057 43 HG LEU 6 HG LEU 6 -1.410 -9.297 -6.362 44 HD11 LEU 6 1HD1 LEU 6 -2.365 -11.215 -4.525 45 HD12 LEU 6 2HD1 LEU 6 -1.448 -10.022 -3.606 46 HD13 LEU 6 3HD1 LEU 6 -0.694 -10.858 -4.963 47 HD21 LEU 6 3HD2 LEU 6 -3.867 -8.826 -6.612 48 HD22 LEU 6 1HD2 LEU 6 -4.140 -9.919 -5.255 49 HD23 LEU 6 2HD2 LEU 6 -3.407 -10.524 -6.742 50 H SER 7 H SER 7 -3.690 -10.038 -3.472 51 HA SER 7 HA SER 7 -4.203 -9.552 -0.667 52 HB2 SER 7 1HB SER 7 -4.298 -11.921 -2.478 53 HB3 SER 7 2HB SER 7 -4.109 -12.209 -0.749 54 HG SER 7 HG SER 7 -6.176 -10.700 -1.980 55 HA PRO 8 HA PRO 8 0.110 -9.828 0.395 56 HB2 PRO 8 1HB PRO 8 -0.249 -9.648 3.080 57 HB3 PRO 8 2HB PRO 8 -0.348 -8.251 2.001 58 HG2 PRO 8 1HG PRO 8 -2.555 -9.898 3.176 59 HG3 PRO 8 2HG PRO 8 -2.441 -8.136 3.008 60 HD2 PRO 8 1HD PRO 8 -3.883 -9.673 1.307 61 HD3 PRO 8 2HD PRO 8 -3.069 -8.182 0.790 62 H SER 9 H SER 9 -2.408 -11.783 1.932 63 HA SER 9 HA SER 9 -0.450 -13.782 2.748 64 HB2 SER 9 1HB SER 9 -2.126 -14.718 4.091 65 HB3 SER 9 2HB SER 9 -2.487 -12.993 4.149 66 HG SER 9 HG SER 9 -4.237 -13.297 2.953 67 H ASP 10 H ASP 10 -1.177 -13.206 -0.104 68 HA ASP 10 HA ASP 10 -1.954 -15.951 -0.841 69 HB2 ASP 10 1HB ASP 10 -2.732 -13.344 -2.148 70 HB3 ASP 10 2HB ASP 10 -2.883 -14.898 -2.964 71 H ILE 11 H ILE 11 0.084 -13.183 -1.440 72 HA ILE 11 HA ILE 11 1.344 -14.137 -3.790 73 HB ILE 11 HB ILE 11 2.416 -12.220 -1.717 74 HG12 ILE 11 1HG1 ILE 11 1.464 -11.181 -4.293 75 HG13 ILE 11 2HG1 ILE 11 0.197 -11.899 -3.304 76 HG21 ILE 11 1HG2 ILE 11 4.175 -13.146 -3.132 77 HG22 ILE 11 2HG2 ILE 11 3.267 -12.687 -4.571 78 HG23 ILE 11 3HG2 ILE 11 3.901 -11.442 -3.495 79 HD11 ILE 11 3HD1 ILE 11 0.790 -10.420 -1.463 80 HD12 ILE 11 1HD1 ILE 11 2.073 -9.709 -2.442 81 HD13 ILE 11 2HD1 ILE 11 0.386 -9.508 -2.918 82 H ALA 12 H ALA 12 1.896 -14.667 -0.379 83 HA ALA 12 HA ALA 12 4.490 -15.815 -0.641 84 HB1 ALA 12 1HB ALA 12 4.294 -16.418 1.651 85 HB2 ALA 12 2HB ALA 12 3.531 -14.838 1.461 86 HB3 ALA 12 3HB ALA 12 2.535 -16.287 1.600 87 H ALA 13 H ALA 13 1.245 -17.024 -0.946 88 HA ALA 13 HA ALA 13 1.710 -19.763 -0.558 89 HB1 ALA 13 1HB ALA 13 -0.324 -18.399 -2.318 90 HB2 ALA 13 2HB ALA 13 -0.354 -20.102 -1.860 91 HB3 ALA 13 3HB ALA 13 -0.532 -18.854 -0.627 92 H ALA 14 H ALA 14 2.672 -17.672 -3.082 93 HA ALA 14 HA ALA 14 3.235 -19.952 -4.856 94 HB1 ALA 14 1HB ALA 14 1.872 -17.834 -5.586 95 HB2 ALA 14 2HB ALA 14 3.478 -17.131 -5.784 96 HB3 ALA 14 3HB ALA 14 3.033 -18.581 -6.684 97 H LEU 15 H LEU 15 4.649 -17.167 -3.242 98 HA LEU 15 HA LEU 15 7.196 -17.221 -4.380 99 HB2 LEU 15 1HB LEU 15 6.204 -16.367 -1.679 100 HB3 LEU 15 2HB LEU 15 7.901 -16.228 -2.134 101 HG LEU 15 HG LEU 15 5.602 -14.871 -3.541 102 HD11 LEU 15 1HD1 LEU 15 7.258 -12.946 -2.479 103 HD12 LEU 15 2HD1 LEU 15 7.171 -14.157 -1.201 104 HD13 LEU 15 3HD1 LEU 15 5.691 -13.439 -1.837 105 HD21 LEU 15 3HD2 LEU 15 7.461 -15.360 -5.034 106 HD22 LEU 15 1HD2 LEU 15 8.587 -14.618 -3.896 107 HD23 LEU 15 2HD2 LEU 15 7.367 -13.630 -4.700 108 H ARG 16 H ARG 16 5.744 -19.236 -1.936 109 HA ARG 16 HA ARG 16 8.313 -20.519 -1.365 110 HB2 ARG 16 1HB ARG 16 6.838 -19.878 0.529 111 HB3 ARG 16 2HB ARG 16 5.614 -20.982 -0.084 112 HG2 ARG 16 1HG ARG 16 8.339 -22.038 0.472 113 HG3 ARG 16 2HG ARG 16 7.259 -21.698 1.826 114 HD2 ARG 16 1HD ARG 16 5.533 -23.050 0.397 115 HD3 ARG 16 2HD ARG 16 6.981 -23.696 -0.374 116 HE ARG 16 HE ARG 16 7.340 -23.909 2.374 117 HH11 ARG 16 1HH1 ARG 16 5.226 -25.179 -0.083 118 HH12 ARG 16 2HH1 ARG 16 4.943 -26.673 0.748 119 HH21 ARG 16 1HH2 ARG 16 6.976 -25.872 3.478 120 HH22 ARG 16 2HH2 ARG 16 5.939 -27.065 2.774 121 H ASP 17 H ASP 17 4.989 -21.444 -2.261 122 HA ASP 17 HA ASP 17 5.447 -24.133 -2.765 123 HB2 ASP 17 1HB ASP 17 3.227 -22.830 -2.734 124 HB3 ASP 17 2HB ASP 17 3.557 -22.482 -4.429 125 H CYS 18 H CYS 18 5.858 -21.346 -4.900 126 HA CYS 18 HA CYS 18 6.957 -23.112 -6.970 127 HB2 CYS 18 1HB CYS 18 6.281 -20.174 -7.198 128 HB3 CYS 18 2HB CYS 18 6.657 -21.281 -8.513 129 HG CYS 18 HG CYS 18 3.887 -21.564 -6.524 130 H GLN 19 H GLN 19 8.339 -22.288 -4.465 131 HA GLN 19 HA GLN 19 10.309 -20.355 -5.025 132 HB2 GLN 19 1HB GLN 19 9.716 -21.222 -2.752 133 HB3 GLN 19 2HB GLN 19 10.556 -22.714 -3.153 134 HG2 GLN 19 1HG GLN 19 12.646 -21.591 -3.302 135 HG3 GLN 19 2HG GLN 19 11.870 -20.012 -3.188 136 HE21 GLN 19 2HE2 GLN 19 10.269 -20.086 -1.134 137 HE22 GLN 19 1HE2 GLN 19 11.085 -20.508 0.329 138 H ALA 20 H ALA 20 9.999 -23.691 -5.899 139 HA ALA 20 HA ALA 20 12.683 -24.334 -6.393 140 HB1 ALA 20 1HB ALA 20 11.868 -26.287 -7.127 141 HB2 ALA 20 2HB ALA 20 10.313 -25.671 -6.567 142 HB3 ALA 20 3HB ALA 20 10.765 -25.512 -8.264 143 HA PRO 21 HA PRO 21 13.805 -22.213 -10.067 144 HB2 PRO 21 1HB PRO 21 15.214 -24.096 -11.422 145 HB3 PRO 21 2HB PRO 21 15.825 -23.303 -9.966 146 HG2 PRO 21 1HG PRO 21 14.539 -25.990 -10.261 147 HG3 PRO 21 2HG PRO 21 15.956 -25.527 -9.301 148 HD2 PRO 21 1HD PRO 21 13.500 -25.854 -8.209 149 HD3 PRO 21 2HD PRO 21 14.673 -24.676 -7.586 150 H ASP 22 H ASP 22 12.815 -21.692 -11.919 151 HA ASP 22 HA ASP 22 11.495 -21.796 -13.770 152 HB2 ASP 22 1HB ASP 22 11.829 -24.769 -13.915 153 HB3 ASP 22 2HB ASP 22 11.769 -23.589 -15.221 154 H SER 23 H SER 23 10.489 -22.435 -10.990 155 HA SER 23 HA SER 23 8.055 -23.920 -11.712 156 HB2 SER 23 1HB SER 23 9.171 -24.904 -9.821 157 HB3 SER 23 2HB SER 23 9.309 -23.339 -9.021 158 HG SER 23 HG SER 23 7.351 -25.078 -8.803 159 H PHE 24 H PHE 24 9.276 -20.837 -10.765 160 HA PHE 24 HA PHE 24 6.589 -19.817 -10.210 161 HB2 PHE 24 1HB PHE 24 8.425 -19.238 -8.644 162 HB3 PHE 24 2HB PHE 24 9.260 -18.419 -9.960 163 HD1 PHE 24 HD1 PHE 24 5.852 -18.437 -8.431 164 HD2 PHE 24 HD2 PHE 24 9.074 -16.141 -10.000 165 HE1 PHE 24 HE1 PHE 24 4.626 -16.368 -7.913 166 HE2 PHE 24 HE2 PHE 24 7.853 -14.068 -9.484 167 HZ PHE 24 HZ PHE 24 5.626 -14.180 -8.438 168 H SER 25 H SER 25 5.775 -17.958 -11.291 169 HA SER 25 HA SER 25 7.066 -16.777 -13.521 170 HB2 SER 25 1HB SER 25 5.222 -19.080 -14.018 171 HB3 SER 25 2HB SER 25 5.208 -17.723 -15.144 172 HG SER 25 HG SER 25 7.296 -19.508 -14.531 173 HA PRO 26 HA PRO 26 3.953 -13.747 -12.913 174 HB2 PRO 26 1HB PRO 26 3.637 -12.732 -15.411 175 HB3 PRO 26 2HB PRO 26 5.074 -12.432 -14.427 176 HG2 PRO 26 1HG PRO 26 4.672 -14.408 -16.639 177 HG3 PRO 26 2HG PRO 26 6.063 -13.357 -16.318 178 HD2 PRO 26 1HD PRO 26 6.034 -15.980 -15.648 179 HD3 PRO 26 2HD PRO 26 6.911 -14.762 -14.699 180 H LYS 27 H LYS 27 3.380 -15.922 -15.651 181 HA LYS 27 HA LYS 27 0.504 -15.467 -15.475 182 HB2 LYS 27 1HB LYS 27 0.402 -16.932 -17.484 183 HB3 LYS 27 2HB LYS 27 1.417 -15.513 -17.706 184 HG2 LYS 27 1HG LYS 27 3.178 -16.765 -18.192 185 HG3 LYS 27 2HG LYS 27 2.971 -17.730 -16.729 186 HD2 LYS 27 1HD LYS 27 0.984 -18.330 -18.772 187 HD3 LYS 27 2HD LYS 27 2.637 -18.614 -19.320 188 HE2 LYS 27 1HE LYS 27 2.037 -19.590 -16.614 189 HE3 LYS 27 2HE LYS 27 1.148 -20.393 -17.908 190 HZ1 LYS 27 3HZ LYS 27 3.204 -20.943 -18.984 191 HZ2 LYS 27 1HZ LYS 27 3.279 -21.471 -17.379 192 HZ3 LYS 27 2HZ LYS 27 4.099 -20.068 -17.846 193 H LYS 28 H LYS 28 1.933 -16.815 -13.315 194 HA LYS 28 HA LYS 28 0.416 -19.332 -13.341 195 HB2 LYS 28 1HB LYS 28 3.271 -18.949 -12.432 196 HB3 LYS 28 2HB LYS 28 2.307 -20.365 -12.033 197 HG2 LYS 28 1HG LYS 28 2.994 -19.463 -14.823 198 HG3 LYS 28 2HG LYS 28 3.808 -20.751 -13.932 199 HD2 LYS 28 1HD LYS 28 0.888 -20.706 -14.697 200 HD3 LYS 28 2HD LYS 28 2.150 -21.647 -15.497 201 HE2 LYS 28 1HE LYS 28 2.581 -22.646 -13.164 202 HE3 LYS 28 2HE LYS 28 1.002 -21.982 -12.745 203 HZ1 LYS 28 3HZ LYS 28 0.030 -23.691 -13.733 204 HZ2 LYS 28 1HZ LYS 28 1.545 -24.378 -14.038 205 HZ3 LYS 28 2HZ LYS 28 0.825 -23.372 -15.191 206 H PHE 29 H PHE 29 1.986 -16.806 -11.443 207 HA PHE 29 HA PHE 29 0.685 -17.655 -9.000 208 HB2 PHE 29 1HB PHE 29 2.038 -16.140 -7.896 209 HB3 PHE 29 2HB PHE 29 3.032 -16.513 -9.301 210 HD1 PHE 29 HD2 PHE 29 2.613 -14.935 -11.377 211 HD2 PHE 29 HD1 PHE 29 1.719 -13.939 -7.337 212 HE1 PHE 29 HE2 PHE 29 2.698 -12.544 -11.951 213 HE2 PHE 29 HE1 PHE 29 1.801 -11.547 -7.905 214 HZ PHE 29 HZ PHE 29 2.292 -10.847 -10.214 215 H PHE 30 H PHE 30 -0.072 -15.702 -11.657 216 HA PHE 30 HA PHE 30 -1.527 -13.603 -10.603 217 HB2 PHE 30 1HB PHE 30 -2.637 -13.454 -12.705 218 HB3 PHE 30 2HB PHE 30 -1.017 -14.056 -13.042 219 HD1 PHE 30 HD1 PHE 30 -0.762 -16.622 -13.232 220 HD2 PHE 30 HD2 PHE 30 -4.477 -14.567 -13.545 221 HE1 PHE 30 HE1 PHE 30 -1.724 -18.549 -14.422 222 HE2 PHE 30 HE2 PHE 30 -5.445 -16.491 -14.734 223 HZ PHE 30 HZ PHE 30 -4.069 -18.486 -15.174 224 H GLN 31 H GLN 31 -2.321 -16.984 -10.744 225 HA GLN 31 HA GLN 31 -5.091 -16.510 -9.982 226 HB2 GLN 31 1HB GLN 31 -5.478 -18.787 -10.386 227 HB3 GLN 31 2HB GLN 31 -4.307 -18.327 -11.615 228 HG2 GLN 31 1HG GLN 31 -2.578 -19.153 -9.825 229 HG3 GLN 31 2HG GLN 31 -3.966 -20.056 -9.221 230 HE21 GLN 31 2HE2 GLN 31 -1.338 -20.428 -10.981 231 HE22 GLN 31 1HE2 GLN 31 -1.869 -21.594 -12.140 232 H ILE 32 H ILE 32 -2.060 -17.534 -8.587 233 HA ILE 32 HA ILE 32 -3.179 -18.525 -6.148 234 HB ILE 32 HB ILE 32 -0.353 -17.661 -6.772 235 HG12 ILE 32 1HG1 ILE 32 -1.101 -20.511 -6.420 236 HG13 ILE 32 2HG1 ILE 32 -1.655 -19.732 -7.898 237 HG21 ILE 32 1HG2 ILE 32 -0.259 -17.656 -4.506 238 HG22 ILE 32 2HG2 ILE 32 -1.639 -18.740 -4.335 239 HG23 ILE 32 3HG2 ILE 32 -0.056 -19.388 -4.763 240 HD11 ILE 32 3HD1 ILE 32 1.174 -19.314 -7.199 241 HD12 ILE 32 1HD1 ILE 32 0.713 -20.953 -7.660 242 HD13 ILE 32 2HD1 ILE 32 0.418 -19.609 -8.764 243 H SER 33 H SER 33 -1.214 -15.628 -6.850 244 HA SER 33 HA SER 33 -1.559 -14.407 -4.361 245 HB2 SER 33 1HB SER 33 -0.268 -12.774 -5.235 246 HB3 SER 33 2HB SER 33 -0.148 -13.822 -6.648 247 HG SER 33 HG SER 33 -1.941 -12.707 -7.527 248 H GLY 34 H GLY 34 -3.454 -14.142 -7.340 249 HA2 GLY 34 1HA GLY 34 -5.886 -13.929 -7.048 250 HA3 GLY 34 2HA GLY 34 -5.547 -12.780 -5.761 251 H MET 35 H MET 35 -3.754 -12.804 -8.760 252 HA MET 35 HA MET 35 -4.562 -10.075 -9.270 253 HB2 MET 35 1HB MET 35 -2.632 -11.936 -10.655 254 HB3 MET 35 2HB MET 35 -2.964 -10.304 -11.219 255 HG2 MET 35 1HG MET 35 -2.354 -9.697 -8.726 256 HG3 MET 35 2HG MET 35 -1.477 -11.222 -8.824 257 HE1 MET 35 3HE MET 35 0.654 -10.396 -12.140 258 HE2 MET 35 1HE MET 35 -0.057 -11.701 -11.190 259 HE3 MET 35 2HE MET 35 -1.074 -10.730 -12.255 260 H SER 36 H SER 36 -5.536 -13.190 -10.251 261 HA SER 36 HA SER 36 -6.371 -12.831 -12.868 262 HB2 SER 36 1HB SER 36 -7.863 -14.683 -12.522 263 HB3 SER 36 2HB SER 36 -6.421 -14.981 -11.552 264 HG SER 36 HG SER 36 -8.941 -14.845 -10.740 265 H LYS 37 H LYS 37 -7.843 -11.751 -9.881 266 HA LYS 37 HA LYS 37 -10.372 -11.052 -10.930 267 HB2 LYS 37 1HB LYS 37 -8.982 -9.733 -8.598 268 HB3 LYS 37 2HB LYS 37 -10.713 -9.838 -8.890 269 HG2 LYS 37 1HG LYS 37 -10.448 -12.351 -8.701 270 HG3 LYS 37 2HG LYS 37 -8.829 -12.029 -8.076 271 HD2 LYS 37 1HD LYS 37 -11.234 -10.690 -6.886 272 HD3 LYS 37 2HD LYS 37 -10.776 -12.325 -6.402 273 HE2 LYS 37 1HE LYS 37 -8.419 -11.262 -6.069 274 HE3 LYS 37 2HE LYS 37 -9.315 -9.746 -6.009 275 HZ1 LYS 37 3HZ LYS 37 -10.573 -10.538 -4.162 276 HZ2 LYS 37 1HZ LYS 37 -8.936 -10.785 -3.810 277 HZ3 LYS 37 2HZ LYS 37 -9.905 -12.088 -4.284 278 H LYS 38 H LYS 38 -7.274 -9.495 -10.987 279 HA LYS 38 HA LYS 38 -7.979 -6.838 -11.383 280 HB2 LYS 38 1HB LYS 38 -5.695 -8.354 -12.661 281 HB3 LYS 38 2HB LYS 38 -5.820 -6.604 -12.538 282 HG2 LYS 38 1HG LYS 38 -5.490 -8.577 -10.294 283 HG3 LYS 38 2HG LYS 38 -4.338 -7.355 -10.838 284 HD2 LYS 38 1HD LYS 38 -5.200 -6.034 -9.256 285 HD3 LYS 38 2HD LYS 38 -6.625 -5.900 -10.290 286 HE2 LYS 38 1HE LYS 38 -7.856 -6.959 -8.776 287 HE3 LYS 38 2HE LYS 38 -6.767 -8.344 -8.823 288 HZ1 LYS 38 3HZ LYS 38 -5.398 -7.323 -7.153 289 HZ2 LYS 38 1HZ LYS 38 -6.993 -7.374 -6.593 290 HZ3 LYS 38 2HZ LYS 38 -6.343 -5.920 -7.162 291 H SER 39 H SER 39 -7.316 -5.797 -13.679 292 HA SER 39 HA SER 39 -8.252 -7.180 -15.987 293 HB2 SER 39 1HB SER 39 -10.369 -6.549 -14.598 294 HB3 SER 39 2HB SER 39 -10.058 -4.917 -15.189 295 HG SER 39 HG SER 39 -10.525 -5.529 -17.192 296 H SER 40 H SER 40 -5.934 -5.755 -15.357 297 HA SER 40 HA SER 40 -4.510 -4.218 -16.244 298 HB2 SER 40 1HB SER 40 -6.663 -3.868 -18.345 299 HB3 SER 40 2HB SER 40 -4.982 -3.354 -18.485 300 HG SER 40 HG SER 40 -4.527 -5.695 -18.076 301 H SER 41 H SER 41 -6.883 -3.480 -14.458 302 HA SER 41 HA SER 41 -6.786 -0.574 -14.948 303 HB2 SER 41 1HB SER 41 -9.050 -1.211 -15.237 304 HB3 SER 41 2HB SER 41 -9.004 -2.297 -13.848 305 HG SER 41 HG SER 41 -9.574 -0.677 -12.657 306 H GLN 42 H GLN 42 -5.733 -3.017 -12.969 307 HA GLN 42 HA GLN 42 -5.314 -1.135 -10.745 308 HB2 GLN 42 1HB GLN 42 -5.812 -4.103 -10.470 309 HB3 GLN 42 2HB GLN 42 -5.531 -2.969 -9.156 310 HG2 GLN 42 1HG GLN 42 -7.725 -2.738 -9.010 311 HG3 GLN 42 2HG GLN 42 -7.669 -1.889 -10.553 312 HE21 GLN 42 2HE2 GLN 42 -6.976 -4.072 -12.179 313 HE22 GLN 42 1HE2 GLN 42 -8.330 -5.142 -12.251 314 H LEU 43 H LEU 43 -4.007 -3.352 -12.973 315 HA LEU 43 HA LEU 43 -1.732 -4.299 -11.703 316 HB2 LEU 43 1HB LEU 43 -1.796 -3.403 -14.571 317 HB3 LEU 43 2HB LEU 43 -0.817 -4.682 -13.856 318 HG LEU 43 HG LEU 43 -3.773 -4.725 -14.429 319 HD11 LEU 43 1HD1 LEU 43 -1.742 -5.293 -16.089 320 HD12 LEU 43 2HD1 LEU 43 -3.300 -6.118 -16.139 321 HD13 LEU 43 3HD1 LEU 43 -1.936 -6.860 -15.303 322 HD21 LEU 43 3HD2 LEU 43 -4.041 -6.132 -12.733 323 HD22 LEU 43 1HD2 LEU 43 -2.318 -6.080 -12.357 324 HD23 LEU 43 2HD2 LEU 43 -2.929 -7.243 -13.534 325 H LYS 44 H LYS 44 -2.280 -1.202 -13.314 326 HA LYS 44 HA LYS 44 0.428 -0.317 -12.780 327 HB2 LYS 44 1HB LYS 44 -0.006 1.465 -14.174 328 HB3 LYS 44 2HB LYS 44 -1.123 0.270 -14.818 329 HG2 LYS 44 1HG LYS 44 -1.813 2.490 -12.903 330 HG3 LYS 44 2HG LYS 44 -2.185 2.443 -14.628 331 HD2 LYS 44 1HD LYS 44 -3.169 0.420 -12.619 332 HD3 LYS 44 2HD LYS 44 -4.099 1.820 -13.159 333 HE2 LYS 44 1HE LYS 44 -3.044 -0.372 -14.944 334 HE3 LYS 44 2HE LYS 44 -4.704 -0.243 -14.365 335 HZ1 LYS 44 3HZ LYS 44 -3.300 1.704 -16.115 336 HZ2 LYS 44 1HZ LYS 44 -4.867 1.903 -15.507 337 HZ3 LYS 44 2HZ LYS 44 -4.531 0.641 -16.582 338 H GLU 45 H GLU 45 -2.081 -0.745 -10.829 339 HA GLU 45 HA GLU 45 -2.101 1.811 -9.474 340 HB2 GLU 45 1HB GLU 45 -4.097 0.246 -9.672 341 HB3 GLU 45 2HB GLU 45 -3.295 -0.775 -8.486 342 HG2 GLU 45 1HG GLU 45 -3.806 2.116 -7.920 343 HG3 GLU 45 2HG GLU 45 -5.069 0.908 -7.691 344 H ILE 46 H ILE 46 -0.568 -1.304 -9.143 345 HA ILE 46 HA ILE 46 0.475 -0.672 -6.502 346 HB ILE 46 HB ILE 46 1.207 -3.057 -8.191 347 HG12 ILE 46 1HG1 ILE 46 -0.686 -3.824 -6.256 348 HG13 ILE 46 2HG1 ILE 46 -1.350 -2.388 -7.028 349 HG21 ILE 46 1HG2 ILE 46 0.997 -3.272 -5.273 350 HG22 ILE 46 2HG2 ILE 46 2.244 -3.864 -6.370 351 HG23 ILE 46 3HG2 ILE 46 2.258 -2.180 -5.846 352 HD11 ILE 46 3HD1 ILE 46 -1.288 -5.059 -7.979 353 HD12 ILE 46 1HD1 ILE 46 -2.014 -3.635 -8.723 354 HD13 ILE 46 2HD1 ILE 46 -0.336 -4.053 -9.070 355 H PHE 47 H PHE 47 1.534 -0.778 -9.833 356 HA PHE 47 HA PHE 47 3.514 -0.269 -10.848 357 HB2 PHE 47 1HB PHE 47 2.747 1.937 -9.854 358 HB3 PHE 47 2HB PHE 47 3.891 1.648 -8.547 359 HD1 PHE 47 HD2 PHE 47 3.793 1.703 -12.276 360 HD2 PHE 47 HD1 PHE 47 5.986 2.560 -8.730 361 HE1 PHE 47 HE2 PHE 47 5.587 2.704 -13.631 362 HE2 PHE 47 HE1 PHE 47 7.783 3.563 -10.080 363 HZ PHE 47 HZ PHE 47 7.585 3.634 -12.533 364 H ARG 48 H ARG 48 3.623 -2.461 -9.000 365 HA ARG 48 HA ARG 48 6.496 -2.510 -8.572 366 HB2 ARG 48 1HB ARG 48 4.511 -2.952 -6.338 367 HB3 ARG 48 2HB ARG 48 6.207 -3.407 -6.250 368 HG2 ARG 48 1HG ARG 48 6.898 -1.125 -6.406 369 HG3 ARG 48 2HG ARG 48 5.247 -0.599 -6.739 370 HD2 ARG 48 1HD ARG 48 5.490 -2.143 -4.278 371 HD3 ARG 48 2HD ARG 48 6.458 -0.669 -4.269 372 HE ARG 48 HE ARG 48 3.594 -0.861 -4.180 373 HH11 ARG 48 1HH1 ARG 48 6.295 1.151 -5.060 374 HH12 ARG 48 2HH1 ARG 48 5.406 2.632 -4.916 375 HH21 ARG 48 1HH2 ARG 48 2.414 1.081 -3.987 376 HH22 ARG 48 2HH2 ARG 48 3.199 2.590 -4.305 377 H ILE 49 H ILE 49 4.238 -3.844 -10.146 378 HA ILE 49 HA ILE 49 4.993 -6.618 -9.498 379 HB ILE 49 HB ILE 49 2.846 -7.396 -10.247 380 HG12 ILE 49 1HG1 ILE 49 2.197 -4.492 -10.801 381 HG13 ILE 49 2HG1 ILE 49 2.465 -5.736 -12.018 382 HG21 ILE 49 1HG2 ILE 49 2.151 -5.088 -8.475 383 HG22 ILE 49 2HG2 ILE 49 1.565 -6.750 -8.426 384 HG23 ILE 49 3HG2 ILE 49 3.206 -6.378 -7.897 385 HD11 ILE 49 3HD1 ILE 49 0.493 -6.923 -11.269 386 HD12 ILE 49 1HD1 ILE 49 0.240 -5.733 -9.993 387 HD13 ILE 49 2HD1 ILE 49 0.094 -5.257 -11.685 388 H LEU 50 H LEU 50 4.549 -4.181 -11.931 389 HA LEU 50 HA LEU 50 5.125 -6.056 -14.092 390 HB2 LEU 50 1HB LEU 50 4.803 -3.098 -14.422 391 HB3 LEU 50 2HB LEU 50 4.485 -4.385 -15.584 392 HG LEU 50 HG LEU 50 2.812 -4.109 -13.113 393 HD11 LEU 50 1HD1 LEU 50 2.735 -1.920 -14.097 394 HD12 LEU 50 2HD1 LEU 50 1.231 -2.763 -14.467 395 HD13 LEU 50 3HD1 LEU 50 2.479 -2.604 -15.702 396 HD21 LEU 50 3HD2 LEU 50 1.120 -5.054 -14.768 397 HD22 LEU 50 1HD2 LEU 50 2.417 -6.127 -14.242 398 HD23 LEU 50 2HD2 LEU 50 2.498 -5.357 -15.827 399 H ASP 51 H ASP 51 6.346 -2.804 -13.281 400 HA ASP 51 HA ASP 51 9.046 -3.585 -13.057 401 HB2 ASP 51 1HB ASP 51 8.679 -3.950 -15.526 402 HB3 ASP 51 2HB ASP 51 8.405 -2.216 -15.673 403 H ASN 52 H ASN 52 10.529 -1.665 -13.039 404 HA ASN 52 HA ASN 52 9.088 0.623 -11.909 405 HB2 ASN 52 1HB ASN 52 10.789 -0.463 -10.488 406 HB3 ASN 52 2HB ASN 52 12.017 -0.110 -11.701 407 HD21 ASN 52 2HD2 ASN 52 13.291 1.344 -10.779 408 HD22 ASN 52 1HD2 ASN 52 12.768 2.830 -10.071 409 H ASP 53 H ASP 53 10.376 -0.276 -14.791 410 HA ASP 53 HA ASP 53 11.295 2.436 -15.464 411 HB2 ASP 53 1HB ASP 53 11.926 -0.276 -16.554 412 HB3 ASP 53 2HB ASP 53 12.053 1.119 -17.621 413 H GLN 54 H GLN 54 8.484 1.529 -15.221 414 HA GLN 54 HA GLN 54 7.233 1.072 -17.644 415 HB2 GLN 54 1HB GLN 54 6.360 1.422 -15.119 416 HB3 GLN 54 2HB GLN 54 5.883 2.967 -15.811 417 HG2 GLN 54 1HG GLN 54 4.017 1.885 -16.382 418 HG3 GLN 54 2HG GLN 54 4.991 1.257 -17.710 419 HE21 GLN 54 2HE2 GLN 54 4.853 0.494 -14.250 420 HE22 GLN 54 1HE2 GLN 54 4.550 -1.194 -14.459 421 H SER 55 H SER 55 8.779 3.930 -16.497 422 HA SER 55 HA SER 55 7.468 5.887 -18.011 423 HB2 SER 55 1HB SER 55 8.934 6.660 -16.325 424 HB3 SER 55 2HB SER 55 10.276 5.689 -16.931 425 HG SER 55 HG SER 55 10.750 7.217 -18.296 426 H GLY 56 H GLY 56 9.557 3.351 -18.971 427 HA2 GLY 56 1HA GLY 56 9.549 4.421 -21.712 428 HA3 GLY 56 2HA GLY 56 11.058 3.851 -21.014 429 H PHE 57 H PHE 57 10.705 1.555 -19.926 430 HA PHE 57 HA PHE 57 8.851 -0.231 -21.032 431 HB2 PHE 57 1HB PHE 57 10.244 -1.428 -22.655 432 HB3 PHE 57 2HB PHE 57 10.005 0.245 -23.147 433 HD1 PHE 57 HD1 PHE 57 11.869 1.911 -22.553 434 HD2 PHE 57 HD2 PHE 57 12.379 -2.314 -22.528 435 HE1 PHE 57 HE1 PHE 57 14.305 2.208 -22.733 436 HE2 PHE 57 HE2 PHE 57 14.815 -2.024 -22.707 437 HZ PHE 57 HZ PHE 57 15.782 0.239 -22.809 438 H ILE 58 H ILE 58 10.232 -2.580 -21.148 439 HA ILE 58 HA ILE 58 11.650 -2.719 -18.570 440 HB ILE 58 HB ILE 58 9.851 -4.927 -19.526 441 HG12 ILE 58 1HG1 ILE 58 9.087 -2.655 -17.678 442 HG13 ILE 58 2HG1 ILE 58 8.499 -2.867 -19.324 443 HG21 ILE 58 1HG2 ILE 58 11.536 -4.404 -17.216 444 HG22 ILE 58 2HG2 ILE 58 9.895 -4.871 -16.772 445 HG23 ILE 58 3HG2 ILE 58 10.862 -5.924 -17.804 446 HD11 ILE 58 3HD1 ILE 58 8.062 -5.241 -17.753 447 HD12 ILE 58 1HD1 ILE 58 7.342 -3.822 -16.992 448 HD13 ILE 58 2HD1 ILE 58 6.910 -4.250 -18.647 449 H GLU 59 H GLU 59 13.111 -4.520 -18.338 450 HA GLU 59 HA GLU 59 13.879 -5.867 -20.819 451 HB2 GLU 59 1HB GLU 59 15.224 -3.654 -20.177 452 HB3 GLU 59 2HB GLU 59 16.090 -4.785 -19.146 453 HG2 GLU 59 1HG GLU 59 17.146 -4.442 -21.350 454 HG3 GLU 59 2HG GLU 59 16.719 -6.121 -21.026 455 H GLU 60 H GLU 60 15.633 -7.542 -20.354 456 HA GLU 60 HA GLU 60 14.685 -9.367 -18.464 457 HB2 GLU 60 1HB GLU 60 16.777 -10.623 -18.910 458 HB3 GLU 60 2HB GLU 60 15.957 -10.110 -20.378 459 HG2 GLU 60 1HG GLU 60 17.529 -8.157 -20.455 460 HG3 GLU 60 2HG GLU 60 18.423 -8.920 -19.142 461 H ASP 61 H ASP 61 16.871 -6.725 -18.139 462 HA ASP 61 HA ASP 61 18.209 -7.635 -15.787 463 HB2 ASP 61 1HB ASP 61 18.770 -5.693 -17.535 464 HB3 ASP 61 2HB ASP 61 17.936 -4.721 -16.325 465 H GLU 62 H GLU 62 15.072 -6.634 -16.338 466 HA GLU 62 HA GLU 62 14.747 -5.738 -13.551 467 HB2 GLU 62 1HB GLU 62 13.227 -5.071 -16.057 468 HB3 GLU 62 2HB GLU 62 12.500 -4.852 -14.472 469 HG2 GLU 62 1HG GLU 62 13.371 -2.798 -14.629 470 HG3 GLU 62 2HG GLU 62 14.853 -3.592 -14.102 471 H LEU 63 H LEU 63 14.731 -8.496 -14.937 472 HA LEU 63 HA LEU 63 12.110 -9.382 -13.925 473 HB2 LEU 63 1HB LEU 63 13.846 -10.959 -15.794 474 HB3 LEU 63 2HB LEU 63 12.125 -11.150 -15.466 475 HG LEU 63 HG LEU 63 13.409 -8.908 -17.025 476 HD11 LEU 63 1HD1 LEU 63 11.405 -10.720 -18.215 477 HD12 LEU 63 2HD1 LEU 63 13.003 -11.401 -17.913 478 HD13 LEU 63 3HD1 LEU 63 12.832 -9.972 -18.932 479 HD21 LEU 63 3HD2 LEU 63 11.524 -7.745 -16.843 480 HD22 LEU 63 1HD2 LEU 63 11.025 -8.872 -15.581 481 HD23 LEU 63 2HD2 LEU 63 10.544 -9.154 -17.254 482 H LYS 64 H LYS 64 15.515 -9.622 -13.576 483 HA LYS 64 HA LYS 64 15.455 -12.102 -12.088 484 HB2 LYS 64 1HB LYS 64 17.742 -10.144 -12.282 485 HB3 LYS 64 2HB LYS 64 17.823 -11.854 -11.879 486 HG2 LYS 64 1HG LYS 64 17.141 -12.428 -14.150 487 HG3 LYS 64 2HG LYS 64 17.046 -10.713 -14.556 488 HD2 LYS 64 1HD LYS 64 19.478 -10.546 -13.902 489 HD3 LYS 64 2HD LYS 64 19.494 -12.310 -13.827 490 HE2 LYS 64 1HE LYS 64 19.239 -12.542 -16.102 491 HE3 LYS 64 2HE LYS 64 18.453 -10.974 -16.281 492 HZ1 LYS 64 3HZ LYS 64 20.995 -11.457 -16.941 493 HZ2 LYS 64 1HZ LYS 64 21.198 -10.880 -15.363 494 HZ3 LYS 64 2HZ LYS 64 20.408 -9.928 -16.517 495 H TYR 65 H TYR 65 14.356 -9.171 -11.350 496 HA TYR 65 HA TYR 65 15.013 -9.486 -8.503 497 HB2 TYR 65 1HB TYR 65 14.910 -6.870 -10.019 498 HB3 TYR 65 2HB TYR 65 15.085 -7.021 -8.274 499 HD1 TYR 65 HD2 TYR 65 16.729 -7.918 -11.488 500 HD2 TYR 65 HD1 TYR 65 17.206 -7.246 -7.314 501 HE1 TYR 65 HE2 TYR 65 19.171 -8.054 -11.751 502 HE2 TYR 65 HE1 TYR 65 19.649 -7.378 -7.566 503 HH TYR 65 HH TYR 65 21.201 -8.716 -9.770 504 H PHE 66 H PHE 66 12.796 -10.630 -9.338 505 HA PHE 66 HA PHE 66 10.584 -8.739 -9.033 506 HB2 PHE 66 1HB PHE 66 10.424 -10.312 -10.897 507 HB3 PHE 66 2HB PHE 66 10.584 -11.669 -9.786 508 HD1 PHE 66 HD2 PHE 66 8.763 -12.187 -8.200 509 HD2 PHE 66 HD1 PHE 66 8.350 -9.211 -11.215 510 HE1 PHE 66 HE2 PHE 66 6.319 -12.246 -7.918 511 HE2 PHE 66 HE1 PHE 66 5.905 -9.265 -10.937 512 HZ PHE 66 HZ PHE 66 4.887 -10.784 -9.288 513 H LEU 67 H LEU 67 11.482 -11.950 -7.761 514 HA LEU 67 HA LEU 67 9.665 -12.078 -5.684 515 HB2 LEU 67 1HB LEU 67 12.490 -13.108 -5.545 516 HB3 LEU 67 2HB LEU 67 11.081 -13.725 -4.685 517 HG LEU 67 HG LEU 67 11.680 -13.965 -7.629 518 HD11 LEU 67 1HD1 LEU 67 12.871 -15.541 -6.217 519 HD12 LEU 67 2HD1 LEU 67 11.618 -16.366 -7.144 520 HD13 LEU 67 3HD1 LEU 67 11.360 -16.010 -5.437 521 HD21 LEU 67 3HD2 LEU 67 9.487 -14.036 -7.981 522 HD22 LEU 67 1HD2 LEU 67 9.144 -13.940 -6.253 523 HD23 LEU 67 2HD2 LEU 67 9.445 -15.506 -7.007 524 H GLN 68 H GLN 68 12.601 -10.236 -5.928 525 HA GLN 68 HA GLN 68 13.143 -9.741 -3.241 526 HB2 GLN 68 1HB GLN 68 14.221 -8.933 -5.621 527 HB3 GLN 68 2HB GLN 68 13.518 -7.435 -5.026 528 HG2 GLN 68 1HG GLN 68 14.958 -7.286 -3.276 529 HG3 GLN 68 2HG GLN 68 15.142 -9.034 -3.134 530 HE21 GLN 68 2HE2 GLN 68 16.102 -9.952 -5.327 531 HE22 GLN 68 1HE2 GLN 68 17.558 -9.167 -5.825 532 H ARG 69 H ARG 69 10.997 -8.011 -5.474 533 HA ARG 69 HA ARG 69 10.229 -5.891 -3.904 534 HB2 ARG 69 1HB ARG 69 8.627 -7.534 -5.861 535 HB3 ARG 69 2HB ARG 69 8.002 -6.070 -5.115 536 HG2 ARG 69 1HG ARG 69 10.438 -6.272 -6.872 537 HG3 ARG 69 2HG ARG 69 8.871 -5.597 -7.321 538 HD2 ARG 69 1HD ARG 69 10.907 -4.517 -5.401 539 HD3 ARG 69 2HD ARG 69 10.194 -3.733 -6.810 540 HE ARG 69 HE ARG 69 8.061 -4.110 -5.216 541 HH11 ARG 69 1HH1 ARG 69 11.212 -2.744 -4.644 542 HH12 ARG 69 2HH1 ARG 69 10.659 -1.649 -3.420 543 HH21 ARG 69 1HH2 ARG 69 7.320 -2.673 -3.607 544 HH22 ARG 69 2HH2 ARG 69 8.445 -1.610 -2.831 545 H PHE 70 H PHE 70 8.042 -8.663 -4.284 546 HA PHE 70 HA PHE 70 6.655 -8.151 -1.889 547 HB2 PHE 70 1HB PHE 70 6.830 -10.667 -3.557 548 HB3 PHE 70 2HB PHE 70 5.697 -10.438 -2.229 549 HD1 PHE 70 HD1 PHE 70 4.342 -8.119 -2.434 550 HD2 PHE 70 HD2 PHE 70 6.013 -10.329 -5.665 551 HE1 PHE 70 HE1 PHE 70 2.741 -7.066 -3.978 552 HE2 PHE 70 HE2 PHE 70 4.416 -9.279 -7.214 553 HZ PHE 70 HZ PHE 70 2.778 -7.645 -6.371 554 H GLU 71 H GLU 71 8.719 -10.971 -2.616 555 HA GLU 71 HA GLU 71 8.994 -11.667 0.131 556 HB2 GLU 71 1HB GLU 71 9.210 -13.156 -1.992 557 HB3 GLU 71 2HB GLU 71 10.878 -12.602 -2.009 558 HG2 GLU 71 1HG GLU 71 10.939 -14.631 -0.867 559 HG3 GLU 71 2HG GLU 71 11.002 -13.407 0.400 560 H SER 72 H SER 72 10.320 -10.841 1.596 561 HA SER 72 HA SER 72 12.421 -9.009 0.743 562 HB2 SER 72 1HB SER 72 10.979 -9.524 3.314 563 HB3 SER 72 2HB SER 72 12.566 -8.756 3.366 564 HG SER 72 HG SER 72 11.489 -7.002 2.954 565 H GLY 73 H GLY 73 12.506 -12.069 0.654 566 HA2 GLY 73 1HA GLY 73 15.121 -12.303 2.001 567 HA3 GLY 73 2HA GLY 73 13.930 -13.591 2.110 568 H ALA 74 H ALA 74 13.719 -12.164 -0.893 569 HA ALA 74 HA ALA 74 14.889 -14.462 -2.171 570 HB1 ALA 74 1HB ALA 74 13.564 -13.932 -3.884 571 HB2 ALA 74 2HB ALA 74 12.869 -12.705 -2.824 572 HB3 ALA 74 3HB ALA 74 14.163 -12.275 -3.942 573 H ARG 75 H ARG 75 16.243 -13.974 -4.237 574 HA ARG 75 HA ARG 75 18.234 -11.887 -3.701 575 HB2 ARG 75 1HB ARG 75 19.854 -13.841 -4.615 576 HB3 ARG 75 2HB ARG 75 19.574 -13.531 -2.906 577 HG2 ARG 75 1HG ARG 75 18.295 -15.398 -2.631 578 HG3 ARG 75 2HG ARG 75 17.737 -15.396 -4.305 579 HD2 ARG 75 1HD ARG 75 19.541 -16.557 -5.051 580 HD3 ARG 75 2HD ARG 75 20.627 -15.841 -3.862 581 HE ARG 75 HE ARG 75 20.158 -17.572 -2.430 582 HH11 ARG 75 1HH1 ARG 75 17.855 -17.568 -5.041 583 HH12 ARG 75 2HH1 ARG 75 17.171 -19.101 -4.612 584 HH21 ARG 75 1HH2 ARG 75 19.265 -19.590 -1.856 585 HH22 ARG 75 2HH2 ARG 75 17.973 -20.250 -2.800 586 H VAL 76 H VAL 76 17.981 -14.569 -6.029 587 HA VAL 76 HA VAL 76 17.530 -12.658 -8.191 588 HB VAL 76 HB VAL 76 19.707 -14.710 -8.493 589 HG11 VAL 76 1HG1 VAL 76 19.300 -14.029 -10.608 590 HG12 VAL 76 2HG1 VAL 76 18.575 -12.505 -10.093 591 HG13 VAL 76 3HG1 VAL 76 20.330 -12.677 -10.138 592 HG21 VAL 76 3HG2 VAL 76 20.491 -13.365 -6.694 593 HG22 VAL 76 1HG2 VAL 76 21.304 -12.797 -8.152 594 HG23 VAL 76 2HG2 VAL 76 19.953 -11.883 -7.483 595 H LEU 77 H LEU 77 16.940 -13.714 -10.229 596 HA LEU 77 HA LEU 77 15.534 -16.243 -9.717 597 HB2 LEU 77 1HB LEU 77 15.032 -13.952 -11.578 598 HB3 LEU 77 2HB LEU 77 14.327 -15.536 -11.893 599 HG LEU 77 HG LEU 77 13.772 -14.779 -9.190 600 HD11 LEU 77 1HD1 LEU 77 12.270 -12.875 -10.758 601 HD12 LEU 77 2HD1 LEU 77 13.998 -12.529 -10.802 602 HD13 LEU 77 3HD1 LEU 77 13.161 -12.645 -9.254 603 HD21 LEU 77 3HD2 LEU 77 12.203 -15.374 -11.673 604 HD22 LEU 77 1HD2 LEU 77 11.400 -14.862 -10.188 605 HD23 LEU 77 2HD2 LEU 77 12.370 -16.335 -10.202 606 H THR 78 H THR 78 15.102 -17.306 -12.085 607 HA THR 78 HA THR 78 17.799 -17.866 -13.108 608 HB THR 78 HB THR 78 17.012 -20.007 -13.826 609 HG1 THR 78 HG1 THR 78 14.784 -20.568 -13.574 610 HG21 THR 78 3HG2 THR 78 16.500 -21.042 -11.761 611 HG22 THR 78 1HG2 THR 78 15.714 -19.591 -11.141 612 HG23 THR 78 2HG2 THR 78 17.465 -19.622 -11.356 613 H ALA 79 H ALA 79 17.951 -18.421 -15.437 614 HA ALA 79 HA ALA 79 16.957 -16.329 -17.039 615 HB1 ALA 79 1HB ALA 79 18.941 -17.170 -17.834 616 HB2 ALA 79 2HB ALA 79 18.460 -18.848 -17.574 617 HB3 ALA 79 3HB ALA 79 17.789 -17.938 -18.927 618 H SER 80 H SER 80 15.540 -19.258 -16.055 619 HA SER 80 HA SER 80 13.823 -19.602 -18.340 620 HB2 SER 80 1HB SER 80 14.341 -21.012 -15.815 621 HB3 SER 80 2HB SER 80 12.654 -21.055 -16.326 622 HG SER 80 HG SER 80 13.415 -21.827 -18.372 623 H GLU 81 H GLU 81 13.340 -18.571 -14.965 624 HA GLU 81 HA GLU 81 10.618 -17.935 -15.215 625 HB2 GLU 81 1HB GLU 81 12.726 -16.872 -13.331 626 HB3 GLU 81 2HB GLU 81 11.011 -16.515 -13.179 627 HG2 GLU 81 1HG GLU 81 10.494 -18.597 -12.440 628 HG3 GLU 81 2HG GLU 81 11.800 -19.364 -13.342 629 H THR 82 H THR 82 13.443 -15.758 -15.229 630 HA THR 82 HA THR 82 12.125 -13.388 -15.780 631 HB THR 82 HB THR 82 14.272 -12.608 -16.799 632 HG1 THR 82 HG1 THR 82 14.799 -15.364 -16.623 633 HG21 THR 82 3HG2 THR 82 15.216 -14.013 -14.402 634 HG22 THR 82 1HG2 THR 82 13.698 -13.143 -14.186 635 HG23 THR 82 2HG2 THR 82 15.134 -12.285 -14.744 636 H LYS 83 H LYS 83 13.473 -15.740 -18.080 637 HA LYS 83 HA LYS 83 13.014 -14.466 -20.460 638 HB2 LYS 83 1HB LYS 83 14.128 -16.585 -20.436 639 HB3 LYS 83 2HB LYS 83 12.716 -17.387 -19.761 640 HG2 LYS 83 1HG LYS 83 11.625 -17.465 -21.764 641 HG3 LYS 83 2HG LYS 83 12.438 -16.028 -22.388 642 HD2 LYS 83 1HD LYS 83 13.361 -17.788 -23.622 643 HD3 LYS 83 2HD LYS 83 14.565 -17.463 -22.373 644 HE2 LYS 83 1HE LYS 83 14.395 -19.778 -22.345 645 HE3 LYS 83 2HE LYS 83 13.328 -19.288 -21.030 646 HZ1 LYS 83 3HZ LYS 83 12.705 -20.671 -23.452 647 HZ2 LYS 83 1HZ LYS 83 11.718 -19.315 -23.233 648 HZ3 LYS 83 2HZ LYS 83 11.789 -20.510 -22.039 649 H THR 84 H THR 84 10.687 -16.363 -18.571 650 HA THR 84 HA THR 84 8.547 -15.693 -20.426 651 HB THR 84 HB THR 84 8.606 -17.966 -19.524 652 HG1 THR 84 HG1 THR 84 6.552 -17.274 -19.990 653 HG21 THR 84 3HG2 THR 84 9.569 -17.815 -17.403 654 HG22 THR 84 1HG2 THR 84 7.879 -18.178 -17.056 655 HG23 THR 84 2HG2 THR 84 8.478 -16.527 -16.894 656 H PHE 85 H PHE 85 9.588 -13.429 -19.255 657 HA PHE 85 HA PHE 85 7.318 -12.554 -17.615 658 HB2 PHE 85 1HB PHE 85 9.505 -13.049 -16.292 659 HB3 PHE 85 2HB PHE 85 10.082 -11.549 -17.009 660 HD1 PHE 85 HD1 PHE 85 8.675 -9.450 -16.645 661 HD2 PHE 85 HD2 PHE 85 8.196 -13.018 -14.374 662 HE1 PHE 85 HE1 PHE 85 7.542 -8.168 -14.877 663 HE2 PHE 85 HE2 PHE 85 7.062 -11.742 -12.602 664 HZ PHE 85 HZ PHE 85 6.733 -9.314 -12.852 665 H LEU 86 H LEU 86 10.068 -11.649 -19.639 666 HA LEU 86 HA LEU 86 8.658 -9.159 -20.338 667 HB2 LEU 86 1HB LEU 86 10.822 -8.779 -19.291 668 HB3 LEU 86 2HB LEU 86 11.598 -9.812 -20.490 669 HG LEU 86 HG LEU 86 11.762 -7.231 -20.708 670 HD11 LEU 86 1HD1 LEU 86 11.480 -7.535 -23.269 671 HD12 LEU 86 2HD1 LEU 86 11.202 -9.227 -22.860 672 HD13 LEU 86 3HD1 LEU 86 12.723 -8.451 -22.416 673 HD21 LEU 86 3HD2 LEU 86 9.992 -6.049 -21.491 674 HD22 LEU 86 1HD2 LEU 86 9.097 -7.276 -20.593 675 HD23 LEU 86 2HD2 LEU 86 9.298 -7.433 -22.338 676 H ALA 87 H ALA 87 10.301 -11.999 -21.571 677 HA ALA 87 HA ALA 87 9.794 -11.192 -24.332 678 HB1 ALA 87 1HB ALA 87 11.279 -12.851 -25.000 679 HB2 ALA 87 2HB ALA 87 11.972 -12.275 -23.484 680 HB3 ALA 87 3HB ALA 87 11.059 -13.783 -23.519 681 H ALA 88 H ALA 88 7.738 -12.101 -22.251 682 HA ALA 88 HA ALA 88 6.546 -14.269 -23.855 683 HB1 ALA 88 1HB ALA 88 6.104 -13.665 -20.933 684 HB2 ALA 88 2HB ALA 88 5.350 -14.970 -21.848 685 HB3 ALA 88 3HB ALA 88 7.092 -14.975 -21.579 686 H ALA 89 H ALA 89 5.963 -11.232 -22.172 687 HA ALA 89 HA ALA 89 3.244 -10.947 -22.409 688 HB1 ALA 89 1HB ALA 89 3.541 -8.656 -22.125 689 HB2 ALA 89 2HB ALA 89 4.988 -9.353 -21.396 690 HB3 ALA 89 3HB ALA 89 5.067 -8.646 -23.010 691 H ASP 90 H ASP 90 5.488 -9.445 -24.737 692 HA ASP 90 HA ASP 90 4.161 -10.502 -27.019 693 HB2 ASP 90 1HB ASP 90 2.695 -8.521 -25.949 694 HB3 ASP 90 2HB ASP 90 3.786 -7.558 -26.942 695 H HIS 91 H HIS 91 4.855 -9.120 -29.045 696 HA HIS 91 HA HIS 91 7.548 -8.030 -28.647 697 HB2 HIS 91 1HB HIS 91 8.251 -9.321 -30.731 698 HB3 HIS 91 2HB HIS 91 8.061 -10.259 -29.252 699 HD1 HIS 91 HD1 HIS 91 6.566 -9.746 -32.635 700 HD2 HIS 91 HD2 HIS 91 5.946 -12.101 -29.269 701 HE1 HIS 91 HE1 HIS 91 4.946 -11.531 -33.352 702 H ASP 92 H ASP 92 5.391 -6.446 -29.036 703 HA ASP 92 HA ASP 92 4.546 -5.878 -31.601 704 HB2 ASP 92 1HB ASP 92 3.509 -4.738 -29.788 705 HB3 ASP 92 2HB ASP 92 5.041 -4.059 -29.246 706 H GLY 93 H GLY 93 7.521 -4.872 -29.980 707 HA2 GLY 93 1HA GLY 93 8.564 -4.057 -32.613 708 HA3 GLY 93 2HA GLY 93 8.769 -3.006 -31.220 709 H ASP 94 H ASP 94 9.687 -4.330 -29.237 710 HA ASP 94 HA ASP 94 11.699 -6.261 -30.081 711 HB2 ASP 94 1HB ASP 94 12.316 -3.513 -29.690 712 HB3 ASP 94 2HB ASP 94 13.013 -4.409 -28.343 713 H GLY 95 H GLY 95 9.264 -6.119 -28.332 714 HA2 GLY 95 1HA GLY 95 8.770 -7.501 -26.495 715 HA3 GLY 95 2HA GLY 95 10.470 -7.479 -26.049 716 H LYS 96 H LYS 96 10.077 -4.387 -26.559 717 HA LYS 96 HA LYS 96 10.042 -3.621 -23.879 718 HB2 LYS 96 1HB LYS 96 9.333 -1.973 -26.313 719 HB3 LYS 96 2HB LYS 96 9.715 -1.323 -24.724 720 HG2 LYS 96 1HG LYS 96 11.926 -1.593 -25.000 721 HG3 LYS 96 2HG LYS 96 11.740 -3.128 -25.852 722 HD2 LYS 96 1HD LYS 96 12.674 -1.427 -27.326 723 HD3 LYS 96 2HD LYS 96 11.070 -1.917 -27.876 724 HE2 LYS 96 1HE LYS 96 11.420 0.526 -27.977 725 HE3 LYS 96 2HE LYS 96 10.089 0.066 -26.918 726 HZ1 LYS 96 3HZ LYS 96 12.729 0.380 -25.708 727 HZ2 LYS 96 1HZ LYS 96 11.200 0.732 -25.074 728 HZ3 LYS 96 2HZ LYS 96 11.921 1.789 -26.181 729 H ILE 97 H ILE 97 8.460 -3.484 -22.438 730 HA ILE 97 HA ILE 97 5.702 -3.769 -23.297 731 HB ILE 97 HB ILE 97 6.685 -3.492 -20.462 732 HG12 ILE 97 1HG1 ILE 97 7.905 -5.318 -21.587 733 HG13 ILE 97 2HG1 ILE 97 6.797 -5.931 -20.364 734 HG21 ILE 97 1HG2 ILE 97 4.527 -3.647 -19.972 735 HG22 ILE 97 2HG2 ILE 97 4.123 -3.824 -21.679 736 HG23 ILE 97 3HG2 ILE 97 4.496 -5.249 -20.710 737 HD11 ILE 97 3HD1 ILE 97 6.738 -7.310 -22.347 738 HD12 ILE 97 1HD1 ILE 97 5.190 -6.496 -22.119 739 HD13 ILE 97 2HD1 ILE 97 6.325 -5.908 -23.334 740 H GLY 98 H GLY 98 4.049 -2.305 -22.883 741 HA2 GLY 98 1HA GLY 98 4.847 0.336 -21.857 742 HA3 GLY 98 2HA GLY 98 4.038 0.216 -23.412 743 H ALA 99 H ALA 99 3.523 -1.263 -20.208 744 HA ALA 99 HA ALA 99 1.620 -1.564 -18.984 745 HB1 ALA 99 1HB ALA 99 0.869 1.173 -19.990 746 HB2 ALA 99 2HB ALA 99 0.401 0.412 -18.469 747 HB3 ALA 99 3HB ALA 99 2.077 0.892 -18.735 748 H GLU 100 H GLU 100 1.518 -2.591 -21.655 749 HA GLU 100 HA GLU 100 -1.382 -2.673 -21.976 750 HB2 GLU 100 1HB GLU 100 0.557 -1.986 -24.185 751 HB3 GLU 100 2HB GLU 100 -1.090 -2.525 -24.481 752 HG2 GLU 100 1HG GLU 100 -0.586 -0.186 -22.698 753 HG3 GLU 100 2HG GLU 100 -0.539 0.007 -24.449 754 H GLU 101 H GLU 101 1.784 -3.983 -22.794 755 HA GLU 101 HA GLU 101 0.765 -6.413 -23.908 756 HB2 GLU 101 1HB GLU 101 3.520 -5.639 -22.942 757 HB3 GLU 101 2HB GLU 101 3.150 -7.173 -23.716 758 HG2 GLU 101 1HG GLU 101 2.433 -5.985 -25.727 759 HG3 GLU 101 2HG GLU 101 2.814 -4.449 -24.951 760 H PHE 102 H PHE 102 2.636 -5.804 -20.929 761 HA PHE 102 HA PHE 102 2.270 -8.315 -19.790 762 HB2 PHE 102 1HB PHE 102 3.759 -6.256 -19.082 763 HB3 PHE 102 2HB PHE 102 2.391 -5.899 -18.033 764 HD1 PHE 102 HD2 PHE 102 1.763 -7.450 -16.242 765 HD2 PHE 102 HD1 PHE 102 5.211 -8.098 -18.652 766 HE1 PHE 102 HE2 PHE 102 2.611 -9.062 -14.589 767 HE2 PHE 102 HE1 PHE 102 6.065 -9.712 -17.003 768 HZ PHE 102 HZ PHE 102 4.765 -10.195 -14.967 769 H GLN 103 H GLN 103 0.097 -5.645 -20.042 770 HA GLN 103 HA GLN 103 -1.637 -6.320 -17.900 771 HB2 GLN 103 1HB GLN 103 -1.708 -4.497 -20.229 772 HB3 GLN 103 2HB GLN 103 -3.270 -4.997 -19.597 773 HG2 GLN 103 1HG GLN 103 -2.499 -2.887 -18.627 774 HG3 GLN 103 2HG GLN 103 -2.704 -4.148 -17.412 775 HE21 GLN 103 2HE2 GLN 103 -0.047 -3.651 -19.679 776 HE22 GLN 103 1HE2 GLN 103 1.173 -3.418 -18.478 777 H GLU 104 H GLU 104 -1.795 -6.948 -21.400 778 HA GLU 104 HA GLU 104 -4.188 -8.459 -21.277 779 HB2 GLU 104 1HB GLU 104 -3.929 -8.794 -23.545 780 HB3 GLU 104 2HB GLU 104 -2.974 -7.337 -23.308 781 HG2 GLU 104 1HG GLU 104 -1.058 -9.150 -22.934 782 HG3 GLU 104 2HG GLU 104 -2.118 -10.079 -23.992 783 H MET 105 H MET 105 -0.906 -9.201 -20.586 784 HA MET 105 HA MET 105 -0.944 -11.986 -21.066 785 HB2 MET 105 1HB MET 105 1.174 -10.934 -20.828 786 HB3 MET 105 2HB MET 105 0.739 -10.247 -19.270 787 HG2 MET 105 1HG MET 105 1.237 -12.128 -18.146 788 HG3 MET 105 2HG MET 105 0.652 -13.180 -19.433 789 HE1 MET 105 3HE MET 105 3.677 -11.154 -17.999 790 HE2 MET 105 1HE MET 105 4.812 -11.189 -19.349 791 HE3 MET 105 2HE MET 105 3.309 -10.277 -19.485 792 H VAL 106 H VAL 106 -1.398 -10.113 -18.069 793 HA VAL 106 HA VAL 106 -1.897 -12.267 -16.365 794 HB VAL 106 HB VAL 106 -3.182 -9.551 -16.106 795 HG11 VAL 106 1HG1 VAL 106 -2.150 -11.220 -13.856 796 HG12 VAL 106 2HG1 VAL 106 -3.434 -10.010 -13.861 797 HG13 VAL 106 3HG1 VAL 106 -3.713 -11.598 -14.578 798 HG21 VAL 106 3HG2 VAL 106 -0.992 -8.906 -16.383 799 HG22 VAL 106 1HG2 VAL 106 -1.037 -9.193 -14.644 800 HG23 VAL 106 2HG2 VAL 106 -0.351 -10.409 -15.721 801 H GLN 107 H GLN 107 -4.243 -10.170 -18.043 802 HA GLN 107 HA GLN 107 -6.556 -11.483 -17.214 803 HB2 GLN 107 1HB GLN 107 -6.178 -10.154 -19.898 804 HB3 GLN 107 2HB GLN 107 -7.684 -10.363 -19.014 805 HG2 GLN 107 1HG GLN 107 -5.424 -8.484 -18.467 806 HG3 GLN 107 2HG GLN 107 -7.140 -8.135 -18.674 807 HE21 GLN 107 2HE2 GLN 107 -4.947 -7.828 -16.486 808 HE22 GLN 107 1HE2 GLN 107 -5.788 -8.283 -15.046 809 H SER 108 H SER 108 -4.323 -12.214 -19.814 810 HA SER 108 HA SER 108 -6.019 -14.267 -20.936 811 HB2 SER 108 1HB SER 108 -4.110 -14.687 -22.451 812 HB3 SER 108 2HB SER 108 -4.555 -12.981 -22.415 813 HG SER 108 HG SER 108 -2.340 -13.118 -22.228 Start of MODEL 19 1 H1 SER 1 H SER 1 2.378 -2.085 1.801 2 HA SER 1 HA SER 1 1.168 -0.418 -0.282 3 HB2 SER 1 1HB SER 1 4.118 -0.763 0.262 4 HB3 SER 1 2HB SER 1 3.324 0.537 -0.627 5 HG SER 1 HG SER 1 3.259 1.536 1.210 6 H LEU 2 H LEU 2 3.272 -3.224 0.152 7 HA LEU 2 HA LEU 2 3.647 -3.675 -2.644 8 HB2 LEU 2 1HB LEU 2 5.316 -4.501 -1.192 9 HB3 LEU 2 2HB LEU 2 4.133 -5.340 -0.190 10 HG LEU 2 HG LEU 2 3.725 -6.907 -2.072 11 HD11 LEU 2 1HD1 LEU 2 5.731 -5.136 -3.368 12 HD12 LEU 2 2HD1 LEU 2 4.299 -5.911 -4.045 13 HD13 LEU 2 3HD1 LEU 2 5.756 -6.859 -3.746 14 HD21 LEU 2 3HD2 LEU 2 6.352 -6.615 -0.709 15 HD22 LEU 2 1HD2 LEU 2 6.190 -7.845 -1.963 16 HD23 LEU 2 2HD2 LEU 2 5.129 -7.877 -0.555 17 H THR 3 H THR 3 1.633 -5.209 -0.148 18 HA THR 3 HA THR 3 0.052 -6.451 -2.304 19 HB THR 3 HB THR 3 -0.610 -8.182 -0.769 20 HG1 THR 3 HG1 THR 3 0.634 -6.506 1.129 21 HG21 THR 3 3HG2 THR 3 2.252 -8.120 -0.063 22 HG22 THR 3 1HG2 THR 3 1.888 -7.953 -1.780 23 HG23 THR 3 2HG2 THR 3 1.315 -9.364 -0.889 24 H ASP 4 H ASP 4 -0.505 -3.841 -1.775 25 HA ASP 4 HA ASP 4 -2.577 -3.575 0.196 26 HB2 ASP 4 1HB ASP 4 -1.294 -1.618 -0.271 27 HB3 ASP 4 2HB ASP 4 -1.582 -1.763 -2.002 28 H ILE 5 H ILE 5 -2.548 -3.439 -3.368 29 HA ILE 5 HA ILE 5 -5.399 -3.521 -3.554 30 HB ILE 5 HB ILE 5 -3.631 -2.616 -5.267 31 HG12 ILE 5 1HG1 ILE 5 -5.499 -3.687 -7.045 32 HG13 ILE 5 2HG1 ILE 5 -6.349 -3.614 -5.505 33 HG21 ILE 5 1HG2 ILE 5 -2.525 -4.819 -5.526 34 HG22 ILE 5 2HG2 ILE 5 -4.000 -5.434 -6.270 35 HG23 ILE 5 3HG2 ILE 5 -3.093 -4.140 -7.051 36 HD11 ILE 5 3HD1 ILE 5 -6.831 -1.554 -6.337 37 HD12 ILE 5 1HD1 ILE 5 -5.350 -1.183 -5.455 38 HD13 ILE 5 2HD1 ILE 5 -5.300 -1.420 -7.202 39 H LEU 6 H LEU 6 -2.987 -5.881 -3.121 40 HA LEU 6 HA LEU 6 -4.907 -8.004 -3.825 41 HB2 LEU 6 1HB LEU 6 -2.263 -7.588 -4.764 42 HB3 LEU 6 2HB LEU 6 -2.250 -9.023 -3.740 43 HG LEU 6 HG LEU 6 -4.348 -9.649 -5.246 44 HD11 LEU 6 1HD1 LEU 6 -2.719 -7.771 -6.941 45 HD12 LEU 6 2HD1 LEU 6 -4.441 -7.679 -6.573 46 HD13 LEU 6 3HD1 LEU 6 -3.827 -8.974 -7.601 47 HD21 LEU 6 3HD2 LEU 6 -2.910 -11.302 -5.604 48 HD22 LEU 6 1HD2 LEU 6 -1.541 -10.250 -5.243 49 HD23 LEU 6 2HD2 LEU 6 -2.179 -10.333 -6.885 50 H SER 7 H SER 7 -3.692 -10.162 -2.718 51 HA SER 7 HA SER 7 -3.631 -9.483 0.149 52 HB2 SER 7 1HB SER 7 -5.498 -11.020 -1.018 53 HB3 SER 7 2HB SER 7 -4.284 -12.258 -0.694 54 HG SER 7 HG SER 7 -6.019 -11.361 0.992 55 HA PRO 8 HA PRO 8 0.552 -10.987 -0.043 56 HB2 PRO 8 1HB PRO 8 1.068 -10.727 2.610 57 HB3 PRO 8 2HB PRO 8 1.041 -9.354 1.498 58 HG2 PRO 8 1HG PRO 8 -1.083 -10.309 3.379 59 HG3 PRO 8 2HG PRO 8 -0.546 -8.652 3.047 60 HD2 PRO 8 1HD PRO 8 -2.789 -9.704 1.955 61 HD3 PRO 8 2HD PRO 8 -1.788 -8.504 1.111 62 H SER 9 H SER 9 -2.113 -12.380 1.572 63 HA SER 9 HA SER 9 -0.602 -14.646 2.599 64 HB2 SER 9 1HB SER 9 -2.700 -13.474 3.680 65 HB3 SER 9 2HB SER 9 -3.595 -14.545 2.603 66 HG SER 9 HG SER 9 -1.603 -15.411 4.429 67 H ASP 10 H ASP 10 -1.157 -13.912 -0.354 68 HA ASP 10 HA ASP 10 -1.934 -16.636 -1.146 69 HB2 ASP 10 1HB ASP 10 -2.876 -14.033 -2.347 70 HB3 ASP 10 2HB ASP 10 -2.992 -15.570 -3.199 71 H ILE 11 H ILE 11 -0.118 -13.716 -1.838 72 HA ILE 11 HA ILE 11 1.123 -14.621 -4.216 73 HB ILE 11 HB ILE 11 2.101 -12.572 -2.223 74 HG12 ILE 11 1HG1 ILE 11 0.964 -11.759 -4.829 75 HG13 ILE 11 2HG1 ILE 11 -0.184 -12.440 -3.681 76 HG21 ILE 11 1HG2 ILE 11 3.245 -13.635 -4.679 77 HG22 ILE 11 2HG2 ILE 11 3.067 -11.882 -4.704 78 HG23 ILE 11 3HG2 ILE 11 3.987 -12.656 -3.415 79 HD11 ILE 11 3HD1 ILE 11 -0.014 -10.682 -2.262 80 HD12 ILE 11 1HD1 ILE 11 1.666 -10.355 -2.687 81 HD13 ILE 11 2HD1 ILE 11 0.368 -9.857 -3.773 82 H ALA 12 H ALA 12 1.777 -15.131 -0.839 83 HA ALA 12 HA ALA 12 4.474 -15.998 -1.123 84 HB1 ALA 12 1HB ALA 12 4.423 -15.928 1.094 85 HB2 ALA 12 2HB ALA 12 2.716 -15.492 1.002 86 HB3 ALA 12 3HB ALA 12 3.187 -17.185 1.151 87 H ALA 13 H ALA 13 1.354 -17.574 -1.320 88 HA ALA 13 HA ALA 13 2.187 -20.244 -1.097 89 HB1 ALA 13 1HB ALA 13 -0.124 -19.148 -2.695 90 HB2 ALA 13 2HB ALA 13 0.083 -20.819 -2.168 91 HB3 ALA 13 3HB ALA 13 -0.159 -19.543 -0.976 92 H ALA 14 H ALA 14 2.436 -17.965 -3.695 93 HA ALA 14 HA ALA 14 2.986 -19.995 -5.693 94 HB1 ALA 14 1HB ALA 14 1.794 -17.736 -6.067 95 HB2 ALA 14 2HB ALA 14 3.425 -17.062 -6.100 96 HB3 ALA 14 3HB ALA 14 2.956 -18.294 -7.271 97 H LEU 15 H LEU 15 4.764 -17.425 -4.004 98 HA LEU 15 HA LEU 15 7.239 -17.753 -5.222 99 HB2 LEU 15 1HB LEU 15 6.509 -16.912 -2.428 100 HB3 LEU 15 2HB LEU 15 8.161 -16.868 -3.041 101 HG LEU 15 HG LEU 15 5.866 -15.334 -4.255 102 HD11 LEU 15 1HD1 LEU 15 7.742 -13.615 -3.048 103 HD12 LEU 15 2HD1 LEU 15 7.317 -14.835 -1.848 104 HD13 LEU 15 3HD1 LEU 15 6.053 -13.867 -2.606 105 HD21 LEU 15 3HD2 LEU 15 7.825 -15.905 -5.709 106 HD22 LEU 15 1HD2 LEU 15 8.835 -14.971 -4.606 107 HD23 LEU 15 2HD2 LEU 15 7.537 -14.178 -5.498 108 H ARG 16 H ARG 16 5.620 -19.743 -2.905 109 HA ARG 16 HA ARG 16 8.044 -21.220 -2.246 110 HB2 ARG 16 1HB ARG 16 6.103 -20.625 -0.619 111 HB3 ARG 16 2HB ARG 16 5.283 -21.992 -1.362 112 HG2 ARG 16 1HG ARG 16 8.047 -22.344 -0.303 113 HG3 ARG 16 2HG ARG 16 6.679 -22.312 0.812 114 HD2 ARG 16 1HD ARG 16 6.889 -24.130 -1.584 115 HD3 ARG 16 2HD ARG 16 7.323 -24.596 0.060 116 HE ARG 16 HE ARG 16 4.787 -23.727 0.339 117 HH11 ARG 16 1HH1 ARG 16 6.290 -25.984 -1.844 118 HH12 ARG 16 2HH1 ARG 16 4.870 -26.961 -2.020 119 HH21 ARG 16 1HH2 ARG 16 2.911 -25.005 0.116 120 HH22 ARG 16 2HH2 ARG 16 2.948 -26.403 -0.905 121 H ASP 17 H ASP 17 4.809 -21.983 -3.543 122 HA ASP 17 HA ASP 17 5.304 -24.605 -4.295 123 HB2 ASP 17 1HB ASP 17 3.113 -23.150 -4.351 124 HB3 ASP 17 2HB ASP 17 3.583 -22.871 -6.025 125 H CYS 18 H CYS 18 5.895 -21.612 -6.081 126 HA CYS 18 HA CYS 18 7.124 -23.146 -8.252 127 HB2 CYS 18 1HB CYS 18 6.614 -20.169 -8.148 128 HB3 CYS 18 2HB CYS 18 7.012 -21.134 -9.565 129 HG CYS 18 HG CYS 18 4.154 -20.169 -8.939 130 H GLN 19 H GLN 19 8.271 -22.586 -5.502 131 HA GLN 19 HA GLN 19 10.347 -20.744 -5.604 132 HB2 GLN 19 1HB GLN 19 9.634 -21.937 -3.561 133 HB3 GLN 19 2HB GLN 19 10.344 -23.417 -4.192 134 HG2 GLN 19 1HG GLN 19 12.519 -22.618 -3.955 135 HG3 GLN 19 2HG GLN 19 11.987 -20.943 -3.824 136 HE21 GLN 19 2HE2 GLN 19 10.573 -20.491 -1.900 137 HE22 GLN 19 1HE2 GLN 19 11.025 -21.233 -0.407 138 H ALA 20 H ALA 20 10.048 -23.846 -7.113 139 HA ALA 20 HA ALA 20 12.780 -24.392 -7.564 140 HB1 ALA 20 1HB ALA 20 12.031 -26.234 -8.593 141 HB2 ALA 20 2HB ALA 20 10.444 -25.732 -8.009 142 HB3 ALA 20 3HB ALA 20 10.950 -25.323 -9.648 143 HA PRO 21 HA PRO 21 13.958 -21.747 -10.860 144 HB2 PRO 21 1HB PRO 21 15.427 -23.393 -12.443 145 HB3 PRO 21 2HB PRO 21 15.992 -22.817 -10.870 146 HG2 PRO 21 1HG PRO 21 14.753 -25.445 -11.592 147 HG3 PRO 21 2HG PRO 21 16.140 -25.114 -10.538 148 HD2 PRO 21 1HD PRO 21 13.664 -25.626 -9.569 149 HD3 PRO 21 2HD PRO 21 14.804 -24.540 -8.749 150 H ASP 22 H ASP 22 13.405 -21.086 -12.920 151 HA ASP 22 HA ASP 22 11.929 -20.883 -14.660 152 HB2 ASP 22 1HB ASP 22 12.236 -22.533 -16.383 153 HB3 ASP 22 2HB ASP 22 13.780 -22.308 -15.564 154 H SER 23 H SER 23 10.722 -21.792 -12.200 155 HA SER 23 HA SER 23 8.515 -23.420 -13.281 156 HB2 SER 23 1HB SER 23 9.874 -23.434 -10.622 157 HB3 SER 23 2HB SER 23 8.150 -23.800 -10.678 158 HG SER 23 HG SER 23 9.827 -25.087 -12.503 159 H PHE 24 H PHE 24 9.452 -20.476 -11.779 160 HA PHE 24 HA PHE 24 6.699 -19.776 -11.096 161 HB2 PHE 24 1HB PHE 24 8.221 -19.156 -9.389 162 HB3 PHE 24 2HB PHE 24 9.359 -18.472 -10.545 163 HD1 PHE 24 HD1 PHE 24 5.764 -18.011 -9.643 164 HD2 PHE 24 HD2 PHE 24 9.508 -16.192 -10.531 165 HE1 PHE 24 HE1 PHE 24 4.760 -15.790 -9.306 166 HE2 PHE 24 HE2 PHE 24 8.511 -13.968 -10.194 167 HZ PHE 24 HZ PHE 24 6.135 -13.765 -9.581 168 H SER 25 H SER 25 5.595 -18.055 -12.015 169 HA SER 25 HA SER 25 6.780 -16.424 -14.062 170 HB2 SER 25 1HB SER 25 4.719 -18.499 -14.844 171 HB3 SER 25 2HB SER 25 5.278 -17.188 -15.882 172 HG SER 25 HG SER 25 6.342 -19.305 -16.129 173 HA PRO 26 HA PRO 26 3.564 -13.696 -12.847 174 HB2 PRO 26 1HB PRO 26 3.248 -12.221 -15.104 175 HB3 PRO 26 2HB PRO 26 4.656 -12.069 -14.046 176 HG2 PRO 26 1HG PRO 26 4.369 -13.583 -16.613 177 HG3 PRO 26 2HG PRO 26 5.712 -12.566 -16.058 178 HD2 PRO 26 1HD PRO 26 5.777 -15.270 -15.917 179 HD3 PRO 26 2HD PRO 26 6.588 -14.232 -14.727 180 H LYS 27 H LYS 27 3.146 -15.650 -15.710 181 HA LYS 27 HA LYS 27 0.264 -15.153 -15.738 182 HB2 LYS 27 1HB LYS 27 0.217 -16.192 -17.871 183 HB3 LYS 27 2HB LYS 27 1.644 -15.164 -17.861 184 HG2 LYS 27 1HG LYS 27 2.760 -17.443 -17.028 185 HG3 LYS 27 2HG LYS 27 1.421 -18.107 -17.966 186 HD2 LYS 27 1HD LYS 27 3.326 -16.029 -19.032 187 HD3 LYS 27 2HD LYS 27 3.567 -17.765 -19.238 188 HE2 LYS 27 1HE LYS 27 0.930 -16.641 -20.004 189 HE3 LYS 27 2HE LYS 27 2.305 -16.272 -21.044 190 HZ1 LYS 27 3HZ LYS 27 2.479 -18.403 -21.724 191 HZ2 LYS 27 1HZ LYS 27 0.835 -18.447 -21.326 192 HZ3 LYS 27 2HZ LYS 27 1.984 -19.053 -20.243 193 H LYS 28 H LYS 28 1.620 -16.657 -13.591 194 HA LYS 28 HA LYS 28 0.028 -19.115 -13.804 195 HB2 LYS 28 1HB LYS 28 2.604 -19.376 -14.158 196 HB3 LYS 28 2HB LYS 28 2.686 -19.158 -12.415 197 HG2 LYS 28 1HG LYS 28 0.814 -21.186 -13.536 198 HG3 LYS 28 2HG LYS 28 2.540 -21.547 -13.459 199 HD2 LYS 28 1HD LYS 28 2.390 -20.814 -11.008 200 HD3 LYS 28 2HD LYS 28 0.642 -20.951 -11.207 201 HE2 LYS 28 1HE LYS 28 1.464 -23.009 -10.296 202 HE3 LYS 28 2HE LYS 28 0.975 -23.297 -11.965 203 HZ1 LYS 28 3HZ LYS 28 3.007 -24.002 -12.427 204 HZ2 LYS 28 1HZ LYS 28 3.447 -23.810 -10.804 205 HZ3 LYS 28 2HZ LYS 28 3.688 -22.545 -11.901 206 H PHE 29 H PHE 29 1.704 -16.813 -11.714 207 HA PHE 29 HA PHE 29 0.306 -17.761 -9.359 208 HB2 PHE 29 1HB PHE 29 1.777 -16.498 -8.128 209 HB3 PHE 29 2HB PHE 29 2.738 -16.721 -9.586 210 HD1 PHE 29 HD2 PHE 29 2.395 -14.869 -11.423 211 HD2 PHE 29 HD1 PHE 29 1.524 -14.378 -7.286 212 HE1 PHE 29 HE2 PHE 29 2.573 -12.429 -11.679 213 HE2 PHE 29 HE1 PHE 29 1.700 -11.937 -7.535 214 HZ PHE 29 HZ PHE 29 2.226 -10.959 -9.733 215 H PHE 30 H PHE 30 -0.357 -15.672 -11.891 216 HA PHE 30 HA PHE 30 -1.640 -13.510 -10.714 217 HB2 PHE 30 1HB PHE 30 -2.732 -13.169 -12.801 218 HB3 PHE 30 2HB PHE 30 -1.163 -13.873 -13.177 219 HD1 PHE 30 HD1 PHE 30 -1.097 -16.429 -13.522 220 HD2 PHE 30 HD2 PHE 30 -4.660 -14.104 -13.667 221 HE1 PHE 30 HE1 PHE 30 -2.205 -18.213 -14.804 222 HE2 PHE 30 HE2 PHE 30 -5.773 -15.885 -14.948 223 HZ PHE 30 HZ PHE 30 -4.546 -17.943 -15.518 224 H GLN 31 H GLN 31 -2.725 -16.804 -11.158 225 HA GLN 31 HA GLN 31 -5.425 -16.174 -10.289 226 HB2 GLN 31 1HB GLN 31 -5.992 -18.393 -10.842 227 HB3 GLN 31 2HB GLN 31 -4.847 -17.894 -12.080 228 HG2 GLN 31 1HG GLN 31 -3.133 -18.981 -10.358 229 HG3 GLN 31 2HG GLN 31 -4.571 -19.909 -9.936 230 HE21 GLN 31 2HE2 GLN 31 -1.904 -20.207 -11.590 231 HE22 GLN 31 1HE2 GLN 31 -2.432 -21.130 -12.951 232 H ILE 32 H ILE 32 -2.453 -17.359 -8.982 233 HA ILE 32 HA ILE 32 -3.623 -18.538 -6.633 234 HB ILE 32 HB ILE 32 -0.756 -17.799 -7.230 235 HG12 ILE 32 1HG1 ILE 32 -1.741 -20.607 -7.067 236 HG13 ILE 32 2HG1 ILE 32 -2.142 -19.681 -8.509 237 HG21 ILE 32 1HG2 ILE 32 -0.660 -17.936 -4.961 238 HG22 ILE 32 2HG2 ILE 32 -2.074 -18.983 -4.853 239 HG23 ILE 32 3HG2 ILE 32 -0.517 -19.652 -5.343 240 HD11 ILE 32 3HD1 ILE 32 0.674 -19.578 -7.667 241 HD12 ILE 32 1HD1 ILE 32 0.090 -21.141 -8.238 242 HD13 ILE 32 2HD1 ILE 32 -0.032 -19.721 -9.277 243 H SER 33 H SER 33 -1.385 -15.783 -7.028 244 HA SER 33 HA SER 33 -1.700 -14.730 -4.477 245 HB2 SER 33 1HB SER 33 -0.984 -12.535 -5.583 246 HB3 SER 33 2HB SER 33 0.104 -13.909 -5.777 247 HG SER 33 HG SER 33 -0.702 -12.497 -7.696 248 H GLY 34 H GLY 34 -3.263 -13.559 -7.470 249 HA2 GLY 34 1HA GLY 34 -5.806 -13.375 -7.077 250 HA3 GLY 34 2HA GLY 34 -5.316 -12.281 -5.791 251 H MET 35 H MET 35 -3.924 -12.616 -9.030 252 HA MET 35 HA MET 35 -4.355 -9.757 -9.442 253 HB2 MET 35 1HB MET 35 -2.675 -11.788 -10.916 254 HB3 MET 35 2HB MET 35 -2.847 -10.114 -11.427 255 HG2 MET 35 1HG MET 35 -2.096 -9.673 -8.924 256 HG3 MET 35 2HG MET 35 -1.363 -11.260 -9.138 257 HE1 MET 35 3HE MET 35 -0.620 -10.800 -12.575 258 HE2 MET 35 1HE MET 35 1.064 -10.791 -12.052 259 HE3 MET 35 2HE MET 35 -0.095 -11.868 -11.272 260 H SER 36 H SER 36 -5.461 -12.840 -10.561 261 HA SER 36 HA SER 36 -6.442 -12.239 -13.081 262 HB2 SER 36 1HB SER 36 -7.814 -14.159 -12.883 263 HB3 SER 36 2HB SER 36 -6.413 -14.497 -11.868 264 HG SER 36 HG SER 36 -8.027 -14.959 -10.533 265 H LYS 37 H LYS 37 -7.739 -11.454 -9.927 266 HA LYS 37 HA LYS 37 -10.326 -10.676 -10.768 267 HB2 LYS 37 1HB LYS 37 -10.332 -9.390 -8.585 268 HB3 LYS 37 2HB LYS 37 -10.028 -11.118 -8.459 269 HG2 LYS 37 1HG LYS 37 -7.871 -10.834 -7.795 270 HG3 LYS 37 2HG LYS 37 -7.681 -9.317 -8.679 271 HD2 LYS 37 1HD LYS 37 -7.827 -8.387 -6.633 272 HD3 LYS 37 2HD LYS 37 -9.562 -8.618 -6.855 273 HE2 LYS 37 1HE LYS 37 -8.855 -9.446 -4.680 274 HE3 LYS 37 2HE LYS 37 -9.418 -10.771 -5.697 275 HZ1 LYS 37 3HZ LYS 37 -7.301 -11.158 -4.409 276 HZ2 LYS 37 1HZ LYS 37 -6.552 -10.067 -5.464 277 HZ3 LYS 37 2HZ LYS 37 -7.232 -11.494 -6.065 278 H LYS 38 H LYS 38 -7.237 -9.098 -10.807 279 HA LYS 38 HA LYS 38 -7.895 -6.425 -10.860 280 HB2 LYS 38 1HB LYS 38 -5.814 -7.860 -12.519 281 HB3 LYS 38 2HB LYS 38 -5.884 -6.118 -12.290 282 HG2 LYS 38 1HG LYS 38 -5.350 -8.219 -10.207 283 HG3 LYS 38 2HG LYS 38 -4.240 -6.985 -10.809 284 HD2 LYS 38 1HD LYS 38 -4.887 -5.817 -9.004 285 HD3 LYS 38 2HD LYS 38 -6.339 -5.472 -9.946 286 HE2 LYS 38 1HE LYS 38 -7.622 -6.954 -8.765 287 HE3 LYS 38 2HE LYS 38 -6.252 -7.993 -8.372 288 HZ1 LYS 38 3HZ LYS 38 -6.270 -7.038 -6.385 289 HZ2 LYS 38 1HZ LYS 38 -7.382 -5.858 -6.867 290 HZ3 LYS 38 2HZ LYS 38 -5.728 -5.612 -7.116 291 H SER 39 H SER 39 -7.730 -4.999 -12.896 292 HA SER 39 HA SER 39 -9.025 -6.148 -15.234 293 HB2 SER 39 1HB SER 39 -10.692 -4.138 -15.121 294 HB3 SER 39 2HB SER 39 -11.021 -5.586 -14.170 295 HG SER 39 HG SER 39 -10.830 -3.151 -13.276 296 H SER 40 H SER 40 -6.429 -5.027 -14.739 297 HA SER 40 HA SER 40 -4.926 -3.671 -15.781 298 HB2 SER 40 1HB SER 40 -6.341 -4.302 -17.802 299 HB3 SER 40 2HB SER 40 -7.166 -2.758 -17.589 300 HG SER 40 HG SER 40 -5.266 -2.857 -19.066 301 H SER 41 H SER 41 -7.125 -2.708 -13.779 302 HA SER 41 HA SER 41 -6.660 0.177 -14.148 303 HB2 SER 41 1HB SER 41 -8.973 -0.029 -14.086 304 HB3 SER 41 2HB SER 41 -8.926 -1.375 -12.947 305 HG SER 41 HG SER 41 -9.572 0.365 -11.777 306 H GLN 42 H GLN 42 -5.762 -2.492 -12.328 307 HA GLN 42 HA GLN 42 -4.873 -0.777 -10.103 308 HB2 GLN 42 1HB GLN 42 -5.483 -3.738 -10.061 309 HB3 GLN 42 2HB GLN 42 -4.875 -2.806 -8.700 310 HG2 GLN 42 1HG GLN 42 -7.231 -3.132 -8.441 311 HG3 GLN 42 2HG GLN 42 -6.919 -1.429 -8.771 312 HE21 GLN 42 2HE2 GLN 42 -6.884 -4.015 -11.138 313 HE22 GLN 42 1HE2 GLN 42 -8.258 -3.470 -12.033 314 H LEU 43 H LEU 43 -3.980 -3.100 -12.518 315 HA LEU 43 HA LEU 43 -1.547 -4.033 -11.652 316 HB2 LEU 43 1HB LEU 43 -2.022 -3.101 -14.470 317 HB3 LEU 43 2HB LEU 43 -0.974 -4.407 -13.921 318 HG LEU 43 HG LEU 43 -3.964 -4.375 -14.175 319 HD11 LEU 43 1HD1 LEU 43 -3.408 -5.413 -16.061 320 HD12 LEU 43 2HD1 LEU 43 -2.903 -6.773 -15.059 321 HD13 LEU 43 3HD1 LEU 43 -1.721 -5.567 -15.568 322 HD21 LEU 43 3HD2 LEU 43 -4.078 -5.498 -12.241 323 HD22 LEU 43 1HD2 LEU 43 -2.338 -5.786 -12.194 324 HD23 LEU 43 2HD2 LEU 43 -3.381 -6.838 -13.152 325 H LYS 44 H LYS 44 -2.284 -0.900 -13.103 326 HA LYS 44 HA LYS 44 0.505 -0.074 -12.861 327 HB2 LYS 44 1HB LYS 44 0.025 1.656 -14.314 328 HB3 LYS 44 2HB LYS 44 -1.112 0.429 -14.856 329 HG2 LYS 44 1HG LYS 44 -1.783 2.675 -12.966 330 HG3 LYS 44 2HG LYS 44 -2.103 2.681 -14.702 331 HD2 LYS 44 1HD LYS 44 -3.298 0.394 -14.130 332 HD3 LYS 44 2HD LYS 44 -3.412 1.126 -12.527 333 HE2 LYS 44 1HE LYS 44 -5.392 1.773 -13.569 334 HE3 LYS 44 2HE LYS 44 -4.346 3.178 -13.761 335 HZ1 LYS 44 3HZ LYS 44 -5.685 1.932 -15.757 336 HZ2 LYS 44 1HZ LYS 44 -4.126 1.293 -15.917 337 HZ3 LYS 44 2HZ LYS 44 -4.363 2.967 -15.966 338 H GLU 45 H GLU 45 -2.341 -0.001 -11.056 339 HA GLU 45 HA GLU 45 -2.260 2.483 -9.796 340 HB2 GLU 45 1HB GLU 45 -4.134 0.941 -9.539 341 HB3 GLU 45 2HB GLU 45 -3.108 -0.190 -8.668 342 HG2 GLU 45 1HG GLU 45 -4.645 1.211 -7.262 343 HG3 GLU 45 2HG GLU 45 -2.943 1.236 -6.803 344 H ILE 46 H ILE 46 -0.644 -0.553 -8.920 345 HA ILE 46 HA ILE 46 0.747 0.726 -6.720 346 HB ILE 46 HB ILE 46 1.443 -2.013 -7.691 347 HG12 ILE 46 1HG1 ILE 46 -0.538 -2.530 -5.891 348 HG13 ILE 46 2HG1 ILE 46 -1.197 -1.124 -6.720 349 HG21 ILE 46 1HG2 ILE 46 1.001 -1.165 -4.860 350 HG22 ILE 46 2HG2 ILE 46 2.079 -2.401 -5.504 351 HG23 ILE 46 3HG2 ILE 46 2.476 -0.695 -5.704 352 HD11 ILE 46 3HD1 ILE 46 -0.715 -3.863 -7.710 353 HD12 ILE 46 1HD1 ILE 46 -2.027 -2.739 -8.062 354 HD13 ILE 46 2HD1 ILE 46 -0.460 -2.539 -8.846 355 H PHE 47 H PHE 47 1.305 -0.052 -10.038 356 HA PHE 47 HA PHE 47 3.212 -0.064 -11.335 357 HB2 PHE 47 1HB PHE 47 4.388 2.166 -11.185 358 HB3 PHE 47 2HB PHE 47 2.643 2.254 -11.398 359 HD1 PHE 47 HD1 PHE 47 1.201 2.978 -9.571 360 HD2 PHE 47 HD2 PHE 47 5.437 2.911 -9.164 361 HE1 PHE 47 HE1 PHE 47 1.029 4.410 -7.578 362 HE2 PHE 47 HE2 PHE 47 5.272 4.343 -7.170 363 HZ PHE 47 HZ PHE 47 3.065 5.094 -6.374 364 H ARG 48 H ARG 48 3.699 -1.735 -9.240 365 HA ARG 48 HA ARG 48 6.563 -1.359 -8.866 366 HB2 ARG 48 1HB ARG 48 6.588 -1.455 -6.556 367 HB3 ARG 48 2HB ARG 48 5.159 -0.473 -6.850 368 HG2 ARG 48 1HG ARG 48 3.745 -2.449 -6.559 369 HG3 ARG 48 2HG ARG 48 5.184 -3.423 -6.248 370 HD2 ARG 48 1HD ARG 48 3.832 -2.523 -4.242 371 HD3 ARG 48 2HD ARG 48 5.590 -2.401 -4.206 372 HE ARG 48 HE ARG 48 4.236 -0.079 -5.258 373 HH11 ARG 48 1HH1 ARG 48 5.517 -1.656 -2.432 374 HH12 ARG 48 2HH1 ARG 48 5.688 -0.187 -1.530 375 HH21 ARG 48 1HH2 ARG 48 4.456 1.862 -4.080 376 HH22 ARG 48 2HH2 ARG 48 5.084 1.813 -2.468 377 H ILE 49 H ILE 49 4.305 -3.201 -10.062 378 HA ILE 49 HA ILE 49 5.621 -5.715 -9.266 379 HB ILE 49 HB ILE 49 3.501 -6.895 -9.668 380 HG12 ILE 49 1HG1 ILE 49 2.693 -4.874 -11.159 381 HG13 ILE 49 2HG1 ILE 49 1.530 -5.869 -10.290 382 HG21 ILE 49 1HG2 ILE 49 3.422 -4.678 -7.631 383 HG22 ILE 49 2HG2 ILE 49 2.290 -6.030 -7.662 384 HG23 ILE 49 3HG2 ILE 49 4.009 -6.326 -7.405 385 HD11 ILE 49 3HD1 ILE 49 1.039 -4.220 -8.788 386 HD12 ILE 49 1HD1 ILE 49 2.610 -3.440 -8.961 387 HD13 ILE 49 2HD1 ILE 49 1.392 -3.261 -10.225 388 H LEU 50 H LEU 50 5.147 -3.557 -11.711 389 HA LEU 50 HA LEU 50 5.407 -5.633 -13.786 390 HB2 LEU 50 1HB LEU 50 4.652 -2.826 -14.441 391 HB3 LEU 50 2HB LEU 50 4.265 -4.320 -15.292 392 HG LEU 50 HG LEU 50 3.043 -3.612 -12.635 393 HD11 LEU 50 1HD1 LEU 50 2.448 -1.817 -14.097 394 HD12 LEU 50 2HD1 LEU 50 1.060 -2.896 -13.962 395 HD13 LEU 50 3HD1 LEU 50 2.072 -2.938 -15.406 396 HD21 LEU 50 3HD2 LEU 50 1.517 -5.319 -13.077 397 HD22 LEU 50 1HD2 LEU 50 3.060 -5.989 -13.610 398 HD23 LEU 50 2HD2 LEU 50 1.915 -5.360 -14.796 399 H ASP 51 H ASP 51 6.222 -2.176 -13.452 400 HA ASP 51 HA ASP 51 9.022 -2.784 -13.977 401 HB2 ASP 51 1HB ASP 51 8.888 -0.754 -15.675 402 HB3 ASP 51 2HB ASP 51 8.573 -2.406 -16.199 403 H ASN 52 H ASN 52 10.423 -1.347 -13.065 404 HA ASN 52 HA ASN 52 9.202 0.796 -11.469 405 HB2 ASN 52 1HB ASN 52 10.579 -1.070 -10.378 406 HB3 ASN 52 2HB ASN 52 11.986 -0.306 -11.111 407 HD21 ASN 52 2HD2 ASN 52 13.028 1.003 -9.815 408 HD22 ASN 52 1HD2 ASN 52 12.341 1.938 -8.534 409 H ASP 53 H ASP 53 10.094 0.810 -14.378 410 HA ASP 53 HA ASP 53 12.070 2.983 -14.223 411 HB2 ASP 53 1HB ASP 53 12.310 0.810 -15.717 412 HB3 ASP 53 2HB ASP 53 11.291 1.731 -16.820 413 H GLN 54 H GLN 54 9.015 2.068 -15.782 414 HA GLN 54 HA GLN 54 7.332 3.302 -16.690 415 HB2 GLN 54 1HB GLN 54 8.260 4.803 -14.336 416 HB3 GLN 54 2HB GLN 54 7.355 5.760 -15.501 417 HG2 GLN 54 1HG GLN 54 5.824 4.934 -13.886 418 HG3 GLN 54 2HG GLN 54 5.544 4.059 -15.391 419 HE21 GLN 54 2HE2 GLN 54 4.455 2.700 -13.645 420 HE22 GLN 54 1HE2 GLN 54 5.409 1.427 -12.972 421 H SER 55 H SER 55 10.090 3.509 -17.809 422 HA SER 55 HA SER 55 10.195 6.206 -18.881 423 HB2 SER 55 1HB SER 55 12.212 4.684 -18.215 424 HB3 SER 55 2HB SER 55 11.964 3.962 -19.805 425 HG SER 55 HG SER 55 12.964 5.615 -20.600 426 H GLY 56 H GLY 56 9.092 3.055 -19.810 427 HA2 GLY 56 1HA GLY 56 7.435 3.789 -21.836 428 HA3 GLY 56 2HA GLY 56 8.992 3.622 -22.634 429 H PHE 57 H PHE 57 10.157 1.481 -21.860 430 HA PHE 57 HA PHE 57 8.167 -0.688 -21.994 431 HB2 PHE 57 1HB PHE 57 9.519 -1.896 -23.521 432 HB3 PHE 57 2HB PHE 57 9.479 -0.246 -24.132 433 HD1 PHE 57 HD1 PHE 57 11.448 1.285 -23.291 434 HD2 PHE 57 HD2 PHE 57 11.542 -2.970 -23.375 435 HE1 PHE 57 HE1 PHE 57 13.908 1.343 -23.295 436 HE2 PHE 57 HE2 PHE 57 14.002 -2.918 -23.377 437 HZ PHE 57 HZ PHE 57 15.188 -0.760 -23.336 438 H ILE 58 H ILE 58 9.789 -2.853 -21.724 439 HA ILE 58 HA ILE 58 11.193 -2.421 -19.173 440 HB ILE 58 HB ILE 58 9.543 -4.875 -19.744 441 HG12 ILE 58 1HG1 ILE 58 8.744 -2.413 -18.176 442 HG13 ILE 58 2HG1 ILE 58 8.056 -2.922 -19.713 443 HG21 ILE 58 1HG2 ILE 58 10.790 -3.738 -17.248 444 HG22 ILE 58 2HG2 ILE 58 9.689 -5.115 -17.270 445 HG23 ILE 58 3HG2 ILE 58 11.246 -5.218 -18.093 446 HD11 ILE 58 3HD1 ILE 58 7.802 -5.119 -18.006 447 HD12 ILE 58 1HD1 ILE 58 7.349 -3.706 -17.052 448 HD13 ILE 58 2HD1 ILE 58 6.528 -4.041 -18.577 449 H GLU 59 H GLU 59 12.864 -3.928 -18.685 450 HA GLU 59 HA GLU 59 13.771 -5.569 -20.948 451 HB2 GLU 59 1HB GLU 59 14.937 -3.202 -20.459 452 HB3 GLU 59 2HB GLU 59 15.851 -4.197 -19.334 453 HG2 GLU 59 1HG GLU 59 16.627 -5.605 -21.087 454 HG3 GLU 59 2HG GLU 59 15.536 -4.854 -22.250 455 H GLU 60 H GLU 60 15.471 -7.154 -20.297 456 HA GLU 60 HA GLU 60 14.595 -8.738 -18.169 457 HB2 GLU 60 1HB GLU 60 16.665 -10.036 -18.520 458 HB3 GLU 60 2HB GLU 60 15.835 -9.680 -20.028 459 HG2 GLU 60 1HG GLU 60 17.465 -8.258 -20.757 460 HG3 GLU 60 2HG GLU 60 17.978 -7.833 -19.125 461 H ASP 61 H ASP 61 16.718 -6.037 -18.223 462 HA ASP 61 HA ASP 61 18.086 -6.655 -15.772 463 HB2 ASP 61 1HB ASP 61 19.113 -5.241 -17.520 464 HB3 ASP 61 2HB ASP 61 17.867 -4.025 -17.252 465 H GLU 62 H GLU 62 14.983 -5.719 -16.443 466 HA GLU 62 HA GLU 62 14.705 -4.357 -13.844 467 HB2 GLU 62 1HB GLU 62 13.456 -3.865 -16.487 468 HB3 GLU 62 2HB GLU 62 12.410 -3.695 -15.084 469 HG2 GLU 62 1HG GLU 62 14.986 -2.225 -15.587 470 HG3 GLU 62 2HG GLU 62 13.356 -1.561 -15.680 471 H LEU 63 H LEU 63 14.560 -7.285 -14.809 472 HA LEU 63 HA LEU 63 11.873 -7.897 -13.780 473 HB2 LEU 63 1HB LEU 63 13.713 -9.772 -15.244 474 HB3 LEU 63 2HB LEU 63 11.998 -9.992 -14.901 475 HG LEU 63 HG LEU 63 13.201 -8.018 -16.841 476 HD11 LEU 63 1HD1 LEU 63 11.276 -10.047 -17.734 477 HD12 LEU 63 2HD1 LEU 63 12.839 -10.675 -17.213 478 HD13 LEU 63 3HD1 LEU 63 12.757 -9.468 -18.496 479 HD21 LEU 63 3HD2 LEU 63 11.287 -6.896 -16.814 480 HD22 LEU 63 1HD2 LEU 63 10.763 -7.876 -15.445 481 HD23 LEU 63 2HD2 LEU 63 10.372 -8.379 -17.090 482 H LYS 64 H LYS 64 15.267 -8.924 -13.582 483 HA LYS 64 HA LYS 64 14.997 -10.808 -11.546 484 HB2 LYS 64 1HB LYS 64 17.363 -8.975 -11.967 485 HB3 LYS 64 2HB LYS 64 17.373 -10.547 -11.178 486 HG2 LYS 64 1HG LYS 64 17.415 -11.675 -13.125 487 HG3 LYS 64 2HG LYS 64 16.364 -10.516 -13.944 488 HD2 LYS 64 1HD LYS 64 18.526 -10.403 -14.964 489 HD3 LYS 64 2HD LYS 64 18.296 -8.932 -14.016 490 HE2 LYS 64 1HE LYS 64 19.479 -10.354 -12.144 491 HE3 LYS 64 2HE LYS 64 20.099 -11.255 -13.526 492 HZ1 LYS 64 3HZ LYS 64 20.334 -8.310 -13.282 493 HZ2 LYS 64 1HZ LYS 64 21.127 -9.324 -14.381 494 HZ3 LYS 64 2HZ LYS 64 21.528 -9.379 -12.739 495 H TYR 65 H TYR 65 15.909 -10.554 -9.296 496 HA TYR 65 HA TYR 65 15.725 -9.689 -7.201 497 HB2 TYR 65 1HB TYR 65 15.819 -6.960 -8.485 498 HB3 TYR 65 2HB TYR 65 16.335 -7.410 -6.863 499 HD1 TYR 65 HD2 TYR 65 17.197 -7.529 -10.433 500 HD2 TYR 65 HD1 TYR 65 18.488 -8.420 -6.478 501 HE1 TYR 65 HE2 TYR 65 19.486 -7.875 -11.264 502 HE2 TYR 65 HE1 TYR 65 20.780 -8.766 -7.297 503 HH TYR 65 HH TYR 65 22.134 -7.872 -9.409 504 H PHE 66 H PHE 66 13.334 -10.001 -9.021 505 HA PHE 66 HA PHE 66 11.472 -7.999 -8.090 506 HB2 PHE 66 1HB PHE 66 11.106 -8.814 -10.306 507 HB3 PHE 66 2HB PHE 66 11.151 -10.489 -9.766 508 HD1 PHE 66 HD2 PHE 66 9.254 -11.471 -8.598 509 HD2 PHE 66 HD1 PHE 66 9.136 -7.470 -10.046 510 HE1 PHE 66 HE2 PHE 66 6.808 -11.451 -8.335 511 HE2 PHE 66 HE1 PHE 66 6.690 -7.444 -9.784 512 HZ PHE 66 HZ PHE 66 5.522 -9.436 -8.929 513 H LEU 67 H LEU 67 11.868 -11.511 -7.660 514 HA LEU 67 HA LEU 67 9.787 -12.001 -5.925 515 HB2 LEU 67 1HB LEU 67 12.500 -13.251 -5.604 516 HB3 LEU 67 2HB LEU 67 10.926 -13.960 -5.249 517 HG LEU 67 HG LEU 67 12.117 -13.429 -7.967 518 HD11 LEU 67 1HD1 LEU 67 12.537 -15.534 -6.312 519 HD12 LEU 67 2HD1 LEU 67 12.602 -15.616 -8.072 520 HD13 LEU 67 3HD1 LEU 67 11.131 -16.089 -7.221 521 HD21 LEU 67 3HD2 LEU 67 10.050 -13.295 -8.765 522 HD22 LEU 67 1HD2 LEU 67 9.365 -13.571 -7.163 523 HD23 LEU 67 2HD2 LEU 67 9.769 -14.942 -8.196 524 H GLN 68 H GLN 68 12.832 -10.427 -5.297 525 HA GLN 68 HA GLN 68 13.040 -10.624 -2.552 526 HB2 GLN 68 1HB GLN 68 14.386 -9.262 -4.489 527 HB3 GLN 68 2HB GLN 68 13.602 -7.941 -3.634 528 HG2 GLN 68 1HG GLN 68 14.723 -8.386 -1.654 529 HG3 GLN 68 2HG GLN 68 15.117 -10.036 -2.134 530 HE21 GLN 68 2HE2 GLN 68 16.247 -9.776 -4.539 531 HE22 GLN 68 1HE2 GLN 68 17.681 -8.817 -4.454 532 H ARG 69 H ARG 69 10.805 -8.759 -4.458 533 HA ARG 69 HA ARG 69 9.970 -6.922 -2.498 534 HB2 ARG 69 1HB ARG 69 8.583 -8.075 -4.915 535 HB3 ARG 69 2HB ARG 69 7.839 -6.854 -3.891 536 HG2 ARG 69 1HG ARG 69 10.427 -6.548 -5.400 537 HG3 ARG 69 2HG ARG 69 8.867 -5.863 -5.861 538 HD2 ARG 69 1HD ARG 69 10.491 -5.214 -3.407 539 HD3 ARG 69 2HD ARG 69 10.180 -4.160 -4.786 540 HE ARG 69 HE ARG 69 7.699 -4.747 -3.861 541 HH11 ARG 69 1HH1 ARG 69 10.591 -3.491 -2.384 542 HH12 ARG 69 2HH1 ARG 69 9.737 -2.559 -1.199 543 HH21 ARG 69 1HH2 ARG 69 6.564 -3.524 -2.306 544 HH22 ARG 69 2HH2 ARG 69 7.447 -2.579 -1.155 545 H PHE 70 H PHE 70 8.048 -9.685 -3.669 546 HA PHE 70 HA PHE 70 6.402 -9.740 -1.369 547 HB2 PHE 70 1HB PHE 70 6.870 -11.854 -3.481 548 HB3 PHE 70 2HB PHE 70 5.581 -11.897 -2.283 549 HD1 PHE 70 HD1 PHE 70 4.162 -9.615 -2.219 550 HD2 PHE 70 HD2 PHE 70 6.309 -11.121 -5.572 551 HE1 PHE 70 HE1 PHE 70 2.718 -8.311 -3.725 552 HE2 PHE 70 HE2 PHE 70 4.869 -9.818 -7.083 553 HZ PHE 70 HZ PHE 70 3.071 -8.411 -6.160 554 H GLU 71 H GLU 71 8.945 -11.987 -2.464 555 HA GLU 71 HA GLU 71 8.973 -13.746 -0.367 556 HB2 GLU 71 1HB GLU 71 10.421 -13.716 -2.487 557 HB3 GLU 71 2HB GLU 71 11.529 -12.705 -1.570 558 HG2 GLU 71 1HG GLU 71 12.155 -15.085 -1.570 559 HG3 GLU 71 2HG GLU 71 11.872 -14.442 0.046 560 H SER 72 H SER 72 10.524 -13.950 1.441 561 HA SER 72 HA SER 72 10.333 -11.728 3.177 562 HB2 SER 72 1HB SER 72 10.405 -14.094 3.942 563 HB3 SER 72 2HB SER 72 12.102 -14.169 3.466 564 HG SER 72 HG SER 72 11.931 -13.693 5.667 565 H GLY 73 H GLY 73 13.064 -13.137 1.396 566 HA2 GLY 73 1HA GLY 73 14.352 -10.577 1.216 567 HA3 GLY 73 2HA GLY 73 15.165 -11.660 2.336 568 H ALA 74 H ALA 74 13.716 -11.889 -0.918 569 HA ALA 74 HA ALA 74 15.385 -13.941 -1.832 570 HB1 ALA 74 1HB ALA 74 14.266 -13.752 -3.778 571 HB2 ALA 74 2HB ALA 74 13.210 -12.704 -2.830 572 HB3 ALA 74 3HB ALA 74 14.467 -12.001 -3.849 573 H ARG 75 H ARG 75 16.684 -13.385 -4.038 574 HA ARG 75 HA ARG 75 18.535 -11.180 -3.446 575 HB2 ARG 75 1HB ARG 75 20.252 -12.966 -4.489 576 HB3 ARG 75 2HB ARG 75 19.965 -12.804 -2.762 577 HG2 ARG 75 1HG ARG 75 18.870 -14.780 -2.616 578 HG3 ARG 75 2HG ARG 75 18.192 -14.650 -4.240 579 HD2 ARG 75 1HD ARG 75 20.027 -15.580 -5.230 580 HD3 ARG 75 2HD ARG 75 21.130 -14.991 -3.987 581 HE ARG 75 HE ARG 75 19.877 -17.527 -4.065 582 HH11 ARG 75 1HH1 ARG 75 20.821 -15.003 -1.861 583 HH12 ARG 75 2HH1 ARG 75 21.000 -16.071 -0.509 584 HH21 ARG 75 1HH2 ARG 75 20.110 -18.944 -2.293 585 HH22 ARG 75 2HH2 ARG 75 20.597 -18.313 -0.756 586 H VAL 76 H VAL 76 18.326 -13.732 -5.923 587 HA VAL 76 HA VAL 76 17.736 -11.730 -7.959 588 HB VAL 76 HB VAL 76 19.991 -13.618 -8.520 589 HG11 VAL 76 1HG1 VAL 76 20.592 -11.491 -9.924 590 HG12 VAL 76 2HG1 VAL 76 19.340 -12.604 -10.480 591 HG13 VAL 76 3HG1 VAL 76 18.891 -11.099 -9.677 592 HG21 VAL 76 3HG2 VAL 76 20.731 -12.515 -6.520 593 HG22 VAL 76 1HG2 VAL 76 21.572 -11.800 -7.896 594 HG23 VAL 76 2HG2 VAL 76 20.225 -10.945 -7.144 595 H LEU 77 H LEU 77 17.271 -12.746 -10.087 596 HA LEU 77 HA LEU 77 15.937 -15.329 -9.676 597 HB2 LEU 77 1HB LEU 77 15.400 -12.962 -11.393 598 HB3 LEU 77 2HB LEU 77 14.893 -14.545 -11.977 599 HG LEU 77 HG LEU 77 14.055 -13.981 -9.232 600 HD11 LEU 77 1HD1 LEU 77 12.127 -12.545 -10.376 601 HD12 LEU 77 2HD1 LEU 77 13.471 -12.067 -11.413 602 HD13 LEU 77 3HD1 LEU 77 13.568 -11.811 -9.671 603 HD21 LEU 77 3HD2 LEU 77 13.344 -15.881 -10.735 604 HD22 LEU 77 1HD2 LEU 77 12.421 -14.693 -11.656 605 HD23 LEU 77 2HD2 LEU 77 12.038 -14.983 -9.959 606 H THR 78 H THR 78 15.622 -16.338 -12.101 607 HA THR 78 HA THR 78 18.377 -16.824 -13.008 608 HB THR 78 HB THR 78 17.578 -18.947 -13.906 609 HG1 THR 78 HG1 THR 78 15.101 -17.823 -13.288 610 HG21 THR 78 3HG2 THR 78 17.122 -20.089 -11.829 611 HG22 THR 78 1HG2 THR 78 16.600 -18.585 -11.072 612 HG23 THR 78 2HG2 THR 78 18.290 -18.803 -11.529 613 H ALA 79 H ALA 79 18.251 -17.754 -15.422 614 HA ALA 79 HA ALA 79 17.359 -15.509 -17.011 615 HB1 ALA 79 1HB ALA 79 19.562 -16.559 -17.378 616 HB2 ALA 79 2HB ALA 79 18.747 -18.034 -17.899 617 HB3 ALA 79 3HB ALA 79 18.560 -16.548 -18.830 618 H SER 80 H SER 80 15.761 -18.063 -15.834 619 HA SER 80 HA SER 80 14.191 -18.528 -18.278 620 HB2 SER 80 1HB SER 80 14.781 -20.187 -15.869 621 HB3 SER 80 2HB SER 80 13.223 -20.411 -16.664 622 HG SER 80 HG SER 80 15.783 -20.613 -17.877 623 H GLU 81 H GLU 81 13.854 -17.891 -14.799 624 HA GLU 81 HA GLU 81 11.061 -17.559 -14.796 625 HB2 GLU 81 1HB GLU 81 13.052 -16.233 -12.949 626 HB3 GLU 81 2HB GLU 81 11.346 -16.515 -12.629 627 HG2 GLU 81 1HG GLU 81 13.331 -18.723 -13.093 628 HG3 GLU 81 2HG GLU 81 12.928 -18.088 -11.499 629 H THR 82 H THR 82 13.688 -15.179 -15.045 630 HA THR 82 HA THR 82 11.938 -12.945 -15.310 631 HB THR 82 HB THR 82 14.007 -11.736 -16.080 632 HG1 THR 82 HG1 THR 82 15.004 -13.724 -16.922 633 HG21 THR 82 3HG2 THR 82 14.926 -13.083 -13.643 634 HG22 THR 82 1HG2 THR 82 13.260 -12.512 -13.569 635 HG23 THR 82 2HG2 THR 82 14.565 -11.381 -13.929 636 H LYS 83 H LYS 83 13.594 -15.073 -17.569 637 HA LYS 83 HA LYS 83 13.211 -13.613 -19.921 638 HB2 LYS 83 1HB LYS 83 14.685 -15.480 -19.975 639 HB3 LYS 83 2HB LYS 83 13.433 -16.575 -19.404 640 HG2 LYS 83 1HG LYS 83 12.337 -16.585 -21.471 641 HG3 LYS 83 2HG LYS 83 13.193 -15.145 -22.028 642 HD2 LYS 83 1HD LYS 83 14.274 -16.853 -23.167 643 HD3 LYS 83 2HD LYS 83 15.318 -16.604 -21.766 644 HE2 LYS 83 1HE LYS 83 14.991 -18.966 -22.102 645 HE3 LYS 83 2HE LYS 83 14.162 -18.472 -20.627 646 HZ1 LYS 83 3HZ LYS 83 12.292 -19.287 -21.446 647 HZ2 LYS 83 1HZ LYS 83 13.088 -19.764 -22.860 648 HZ3 LYS 83 2HZ LYS 83 12.374 -18.234 -22.768 649 H THR 84 H THR 84 10.983 -15.394 -17.986 650 HA THR 84 HA THR 84 8.955 -15.301 -20.112 651 HB THR 84 HB THR 84 9.300 -17.495 -19.022 652 HG1 THR 84 HG1 THR 84 7.258 -17.648 -19.535 653 HG21 THR 84 3HG2 THR 84 9.937 -16.909 -16.809 654 HG22 THR 84 1HG2 THR 84 8.385 -17.735 -16.678 655 HG23 THR 84 2HG2 THR 84 8.461 -15.977 -16.558 656 H PHE 85 H PHE 85 9.818 -12.949 -18.623 657 HA PHE 85 HA PHE 85 7.377 -12.344 -17.094 658 HB2 PHE 85 1HB PHE 85 10.048 -11.959 -16.416 659 HB3 PHE 85 2HB PHE 85 9.494 -10.358 -16.894 660 HD1 PHE 85 HD2 PHE 85 8.615 -13.228 -14.705 661 HD2 PHE 85 HD1 PHE 85 8.312 -9.040 -15.400 662 HE1 PHE 85 HE2 PHE 85 7.558 -12.943 -12.502 663 HE2 PHE 85 HE1 PHE 85 7.255 -8.748 -13.197 664 HZ PHE 85 HZ PHE 85 6.875 -10.700 -11.746 665 H LEU 86 H LEU 86 9.637 -10.956 -19.459 666 HA LEU 86 HA LEU 86 7.457 -9.200 -20.379 667 HB2 LEU 86 1HB LEU 86 9.175 -7.647 -21.153 668 HB3 LEU 86 2HB LEU 86 9.273 -7.924 -19.415 669 HG LEU 86 HG LEU 86 11.131 -9.602 -19.986 670 HD11 LEU 86 1HD1 LEU 86 10.432 -8.683 -22.608 671 HD12 LEU 86 2HD1 LEU 86 11.569 -9.943 -22.131 672 HD13 LEU 86 3HD1 LEU 86 12.108 -8.268 -22.251 673 HD21 LEU 86 3HD2 LEU 86 11.774 -6.731 -20.598 674 HD22 LEU 86 1HD2 LEU 86 12.770 -7.932 -19.774 675 HD23 LEU 86 2HD2 LEU 86 11.341 -7.276 -18.977 676 H ALA 87 H ALA 87 9.775 -11.604 -21.220 677 HA ALA 87 HA ALA 87 9.583 -11.175 -24.070 678 HB1 ALA 87 1HB ALA 87 11.379 -12.493 -24.202 679 HB2 ALA 87 2HB ALA 87 11.428 -12.403 -22.441 680 HB3 ALA 87 3HB ALA 87 10.627 -13.760 -23.232 681 H ALA 88 H ALA 88 7.822 -12.865 -21.673 682 HA ALA 88 HA ALA 88 6.659 -14.763 -23.546 683 HB1 ALA 88 1HB ALA 88 5.796 -14.343 -20.700 684 HB2 ALA 88 2HB ALA 88 5.640 -15.790 -21.698 685 HB3 ALA 88 3HB ALA 88 7.227 -15.285 -21.118 686 H ALA 89 H ALA 89 5.736 -11.876 -21.736 687 HA ALA 89 HA ALA 89 3.014 -11.823 -22.173 688 HB1 ALA 89 1HB ALA 89 3.066 -9.642 -21.498 689 HB2 ALA 89 2HB ALA 89 4.653 -10.167 -20.934 690 HB3 ALA 89 3HB ALA 89 4.507 -9.266 -22.443 691 H ASP 90 H ASP 90 5.606 -10.740 -24.331 692 HA ASP 90 HA ASP 90 3.845 -11.065 -26.609 693 HB2 ASP 90 1HB ASP 90 3.940 -8.864 -27.427 694 HB3 ASP 90 2HB ASP 90 3.602 -8.667 -25.710 695 H HIS 91 H HIS 91 5.067 -10.665 -28.689 696 HA HIS 91 HA HIS 91 7.948 -11.142 -28.386 697 HB2 HIS 91 1HB HIS 91 7.738 -12.833 -30.277 698 HB3 HIS 91 2HB HIS 91 7.125 -13.343 -28.707 699 HD1 HIS 91 HD1 HIS 91 5.666 -11.682 -31.815 700 HD2 HIS 91 HD2 HIS 91 4.706 -14.509 -28.925 701 HE1 HIS 91 HE1 HIS 91 3.398 -12.556 -32.457 702 H ASP 92 H ASP 92 6.331 -8.811 -29.181 703 HA ASP 92 HA ASP 92 6.267 -8.372 -31.920 704 HB2 ASP 92 1HB ASP 92 5.299 -6.868 -30.172 705 HB3 ASP 92 2HB ASP 92 6.930 -6.305 -29.815 706 H GLY 93 H GLY 93 8.963 -8.315 -29.700 707 HA2 GLY 93 1HA GLY 93 10.820 -8.325 -31.907 708 HA3 GLY 93 2HA GLY 93 10.882 -6.854 -30.947 709 H ASP 94 H ASP 94 11.145 -7.199 -28.552 710 HA ASP 94 HA ASP 94 12.842 -9.548 -28.024 711 HB2 ASP 94 1HB ASP 94 14.109 -7.368 -28.338 712 HB3 ASP 94 2HB ASP 94 13.333 -6.808 -26.859 713 H GLY 95 H GLY 95 10.037 -8.043 -27.265 714 HA2 GLY 95 1HA GLY 95 8.606 -9.019 -25.592 715 HA3 GLY 95 2HA GLY 95 10.023 -9.255 -24.580 716 H LYS 96 H LYS 96 9.885 -6.248 -26.186 717 HA LYS 96 HA LYS 96 9.839 -4.780 -23.777 718 HB2 LYS 96 1HB LYS 96 9.544 -2.795 -25.305 719 HB3 LYS 96 2HB LYS 96 10.935 -3.813 -25.655 720 HG2 LYS 96 1HG LYS 96 8.642 -4.709 -27.138 721 HG3 LYS 96 2HG LYS 96 8.937 -2.992 -27.422 722 HD2 LYS 96 1HD LYS 96 11.455 -3.944 -27.585 723 HD3 LYS 96 2HD LYS 96 10.553 -5.347 -28.163 724 HE2 LYS 96 1HE LYS 96 10.499 -2.545 -29.269 725 HE3 LYS 96 2HE LYS 96 11.124 -3.995 -30.053 726 HZ1 LYS 96 3HZ LYS 96 8.560 -4.654 -29.476 727 HZ2 LYS 96 1HZ LYS 96 9.118 -4.118 -30.981 728 HZ3 LYS 96 2HZ LYS 96 8.429 -3.020 -29.895 729 H ILE 97 H ILE 97 8.135 -4.599 -22.484 730 HA ILE 97 HA ILE 97 5.444 -4.895 -23.436 731 HB ILE 97 HB ILE 97 6.255 -3.908 -20.708 732 HG12 ILE 97 1HG1 ILE 97 7.521 -5.946 -21.184 733 HG13 ILE 97 2HG1 ILE 97 6.266 -6.266 -19.992 734 HG21 ILE 97 1HG2 ILE 97 3.783 -4.902 -21.970 735 HG22 ILE 97 2HG2 ILE 97 4.110 -5.485 -20.339 736 HG23 ILE 97 3HG2 ILE 97 4.004 -3.753 -20.651 737 HD11 ILE 97 3HD1 ILE 97 5.370 -7.834 -21.268 738 HD12 ILE 97 1HD1 ILE 97 5.290 -6.748 -22.654 739 HD13 ILE 97 2HD1 ILE 97 6.762 -7.668 -22.338 740 H GLY 98 H GLY 98 3.752 -3.323 -23.207 741 HA2 GLY 98 1HA GLY 98 4.598 -0.532 -22.944 742 HA3 GLY 98 2HA GLY 98 3.867 -1.019 -24.466 743 H ALA 99 H ALA 99 3.155 -1.619 -21.022 744 HA ALA 99 HA ALA 99 1.194 -1.555 -19.859 745 HB1 ALA 99 1HB ALA 99 1.079 0.894 -21.571 746 HB2 ALA 99 2HB ALA 99 -0.269 0.486 -20.508 747 HB3 ALA 99 3HB ALA 99 1.338 0.754 -19.832 748 H GLU 100 H GLU 100 1.272 -3.157 -22.337 749 HA GLU 100 HA GLU 100 -1.629 -3.387 -22.712 750 HB2 GLU 100 1HB GLU 100 0.458 -3.275 -24.884 751 HB3 GLU 100 2HB GLU 100 -1.132 -3.977 -25.144 752 HG2 GLU 100 1HG GLU 100 -2.197 -1.961 -25.048 753 HG3 GLU 100 2HG GLU 100 -0.967 -1.235 -24.015 754 H GLU 101 H GLU 101 1.557 -4.869 -22.914 755 HA GLU 101 HA GLU 101 0.557 -7.515 -23.371 756 HB2 GLU 101 1HB GLU 101 3.284 -6.836 -22.290 757 HB3 GLU 101 2HB GLU 101 2.809 -8.232 -23.245 758 HG2 GLU 101 1HG GLU 101 3.152 -5.394 -24.151 759 HG3 GLU 101 2HG GLU 101 4.026 -6.828 -24.685 760 H PHE 102 H PHE 102 2.193 -6.005 -20.582 761 HA PHE 102 HA PHE 102 1.895 -8.075 -18.776 762 HB2 PHE 102 1HB PHE 102 2.878 -5.503 -18.672 763 HB3 PHE 102 2HB PHE 102 1.511 -5.436 -17.565 764 HD1 PHE 102 HD1 PHE 102 1.417 -7.759 -16.078 765 HD2 PHE 102 HD2 PHE 102 4.885 -5.847 -17.640 766 HE1 PHE 102 HE1 PHE 102 2.785 -8.814 -14.325 767 HE2 PHE 102 HE2 PHE 102 6.257 -6.899 -15.891 768 HZ PHE 102 HZ PHE 102 5.208 -8.385 -14.231 769 H GLN 103 H GLN 103 -0.406 -5.576 -19.693 770 HA GLN 103 HA GLN 103 -2.327 -6.244 -17.686 771 HB2 GLN 103 1HB GLN 103 -2.365 -4.545 -20.159 772 HB3 GLN 103 2HB GLN 103 -3.860 -4.900 -19.302 773 HG2 GLN 103 1HG GLN 103 -2.944 -2.764 -18.614 774 HG3 GLN 103 2HG GLN 103 -2.950 -3.910 -17.275 775 HE21 GLN 103 2HE2 GLN 103 -0.713 -3.507 -19.988 776 HE22 GLN 103 1HE2 GLN 103 0.692 -3.241 -19.018 777 H GLU 104 H GLU 104 -2.391 -6.649 -21.233 778 HA GLU 104 HA GLU 104 -4.655 -8.219 -21.408 779 HB2 GLU 104 1HB GLU 104 -2.164 -8.116 -23.094 780 HB3 GLU 104 2HB GLU 104 -3.501 -9.184 -23.496 781 HG2 GLU 104 1HG GLU 104 -4.996 -7.291 -23.693 782 HG3 GLU 104 2HG GLU 104 -3.704 -6.196 -23.206 783 H MET 105 H MET 105 -1.440 -9.098 -20.401 784 HA MET 105 HA MET 105 -1.666 -11.898 -20.683 785 HB2 MET 105 1HB MET 105 0.495 -10.825 -20.385 786 HB3 MET 105 2HB MET 105 0.022 -10.252 -18.791 787 HG2 MET 105 1HG MET 105 -0.307 -12.766 -18.263 788 HG3 MET 105 2HG MET 105 0.714 -13.015 -19.677 789 HE1 MET 105 3HE MET 105 3.724 -10.690 -18.664 790 HE2 MET 105 1HE MET 105 3.654 -12.242 -19.498 791 HE3 MET 105 2HE MET 105 2.514 -10.963 -19.919 792 H VAL 106 H VAL 106 -1.640 -10.084 -17.613 793 HA VAL 106 HA VAL 106 -2.729 -12.131 -16.061 794 HB VAL 106 HB VAL 106 -3.081 -9.183 -15.523 795 HG11 VAL 106 1HG1 VAL 106 -2.500 -10.830 -13.244 796 HG12 VAL 106 2HG1 VAL 106 -3.899 -9.799 -13.551 797 HG13 VAL 106 3HG1 VAL 106 -3.892 -11.469 -14.117 798 HG21 VAL 106 3HG2 VAL 106 -0.797 -9.297 -15.871 799 HG22 VAL 106 1HG2 VAL 106 -0.921 -9.620 -14.142 800 HG23 VAL 106 2HG2 VAL 106 -0.683 -10.952 -15.274 801 H GLN 107 H GLN 107 -4.291 -9.574 -17.909 802 HA GLN 107 HA GLN 107 -6.880 -9.783 -16.916 803 HB2 GLN 107 1HB GLN 107 -5.762 -8.979 -19.581 804 HB3 GLN 107 2HB GLN 107 -7.502 -9.073 -19.343 805 HG2 GLN 107 1HG GLN 107 -5.552 -7.316 -17.877 806 HG3 GLN 107 2HG GLN 107 -6.811 -6.817 -19.007 807 HE21 GLN 107 2HE2 GLN 107 -6.081 -7.804 -15.785 808 HE22 GLN 107 1HE2 GLN 107 -7.641 -7.501 -15.109 809 H SER 108 H SER 108 -5.148 -11.814 -19.171 810 HA SER 108 HA SER 108 -5.658 -13.784 -20.188 811 HB2 SER 108 1HB SER 108 -6.042 -14.409 -17.784 812 HB3 SER 108 2HB SER 108 -7.754 -14.064 -18.025 813 HG SER 108 HG SER 108 -7.768 -16.106 -18.580 Start of MODEL 20 1 H1 SER 1 H SER 1 3.654 0.396 -3.322 2 HA SER 1 HA SER 1 2.366 -0.849 -0.985 3 HB2 SER 1 1HB SER 1 0.414 -1.228 -2.698 4 HB3 SER 1 2HB SER 1 0.564 0.322 -1.869 5 HG SER 1 HG SER 1 1.726 1.058 -3.750 6 H LEU 2 H LEU 2 1.371 -3.023 -1.601 7 HA LEU 2 HA LEU 2 2.526 -4.443 -3.801 8 HB2 LEU 2 1HB LEU 2 4.435 -4.337 -2.242 9 HB3 LEU 2 2HB LEU 2 3.455 -5.145 -1.020 10 HG LEU 2 HG LEU 2 3.545 -6.690 -3.458 11 HD11 LEU 2 1HD1 LEU 2 6.219 -6.500 -2.155 12 HD12 LEU 2 2HD1 LEU 2 5.790 -5.354 -3.425 13 HD13 LEU 2 3HD1 LEU 2 5.786 -7.086 -3.761 14 HD21 LEU 2 3HD2 LEU 2 3.998 -7.029 -0.548 15 HD22 LEU 2 1HD2 LEU 2 4.704 -8.231 -1.628 16 HD23 LEU 2 2HD2 LEU 2 2.965 -7.940 -1.651 17 H THR 3 H THR 3 1.214 -4.924 -0.523 18 HA THR 3 HA THR 3 -0.514 -7.048 -1.588 19 HB THR 3 HB THR 3 -0.724 -7.920 0.587 20 HG1 THR 3 HG1 THR 3 0.516 -5.578 1.633 21 HG21 THR 3 3HG2 THR 3 1.484 -8.342 -0.352 22 HG22 THR 3 1HG2 THR 3 1.590 -8.161 1.399 23 HG23 THR 3 2HG2 THR 3 2.086 -6.838 0.344 24 H ASP 4 H ASP 4 -0.697 -3.863 -1.263 25 HA ASP 4 HA ASP 4 -3.012 -3.372 0.253 26 HB2 ASP 4 1HB ASP 4 -1.585 -1.539 -0.378 27 HB3 ASP 4 2HB ASP 4 -1.823 -1.878 -2.090 28 H ILE 5 H ILE 5 -2.896 -3.076 -3.287 29 HA ILE 5 HA ILE 5 -5.678 -3.507 -3.579 30 HB ILE 5 HB ILE 5 -3.853 -2.420 -5.195 31 HG12 ILE 5 1HG1 ILE 5 -5.894 -3.579 -6.880 32 HG13 ILE 5 2HG1 ILE 5 -6.579 -3.087 -5.335 33 HG21 ILE 5 1HG2 ILE 5 -2.801 -4.646 -5.599 34 HG22 ILE 5 2HG2 ILE 5 -4.281 -5.137 -6.422 35 HG23 ILE 5 3HG2 ILE 5 -3.314 -3.810 -7.065 36 HD11 ILE 5 3HD1 ILE 5 -6.820 -1.242 -6.753 37 HD12 ILE 5 1HD1 ILE 5 -5.448 -0.853 -5.715 38 HD13 ILE 5 2HD1 ILE 5 -5.176 -1.396 -7.371 39 H LEU 6 H LEU 6 -2.959 -5.638 -3.438 40 HA LEU 6 HA LEU 6 -4.534 -7.884 -4.460 41 HB2 LEU 6 1HB LEU 6 -1.783 -7.189 -4.521 42 HB3 LEU 6 2HB LEU 6 -1.942 -8.685 -3.604 43 HG LEU 6 HG LEU 6 -3.392 -8.617 -6.168 44 HD11 LEU 6 1HD1 LEU 6 -0.983 -9.326 -7.122 45 HD12 LEU 6 2HD1 LEU 6 -0.502 -8.067 -5.985 46 HD13 LEU 6 3HD1 LEU 6 -1.653 -7.702 -7.271 47 HD21 LEU 6 3HD2 LEU 6 -3.396 -10.649 -4.974 48 HD22 LEU 6 1HD2 LEU 6 -1.663 -10.562 -4.662 49 HD23 LEU 6 2HD2 LEU 6 -2.250 -10.879 -6.295 50 H SER 7 H SER 7 -3.501 -9.997 -3.109 51 HA SER 7 HA SER 7 -4.405 -9.505 -0.349 52 HB2 SER 7 1HB SER 7 -5.678 -11.107 -2.014 53 HB3 SER 7 2HB SER 7 -4.412 -12.245 -1.554 54 HG SER 7 HG SER 7 -6.473 -11.148 -0.024 55 HA PRO 8 HA PRO 8 -0.197 -10.509 0.722 56 HB2 PRO 8 1HB PRO 8 -0.536 -10.267 3.405 57 HB3 PRO 8 2HB PRO 8 -0.379 -8.875 2.327 58 HG2 PRO 8 1HG PRO 8 -2.850 -10.105 3.486 59 HG3 PRO 8 2HG PRO 8 -2.426 -8.391 3.320 60 HD2 PRO 8 1HD PRO 8 -4.105 -9.649 1.608 61 HD3 PRO 8 2HD PRO 8 -3.037 -8.326 1.098 62 H SER 9 H SER 9 -3.079 -12.161 1.673 63 HA SER 9 HA SER 9 -1.586 -14.352 2.902 64 HB2 SER 9 1HB SER 9 -3.584 -15.065 3.844 65 HB3 SER 9 2HB SER 9 -3.850 -13.325 3.754 66 HG SER 9 HG SER 9 -4.909 -13.759 1.703 67 H ASP 10 H ASP 10 -1.476 -13.716 0.007 68 HA ASP 10 HA ASP 10 -2.211 -16.387 -0.963 69 HB2 ASP 10 1HB ASP 10 -3.209 -13.802 -1.944 70 HB3 ASP 10 2HB ASP 10 -2.571 -14.853 -3.205 71 H ILE 11 H ILE 11 -0.252 -13.491 -1.310 72 HA ILE 11 HA ILE 11 1.382 -14.282 -3.426 73 HB ILE 11 HB ILE 11 2.123 -12.582 -1.042 74 HG12 ILE 11 1HG1 ILE 11 1.481 -11.485 -3.743 75 HG13 ILE 11 2HG1 ILE 11 0.149 -12.003 -2.716 76 HG21 ILE 11 1HG2 ILE 11 4.076 -13.454 -2.265 77 HG22 ILE 11 2HG2 ILE 11 3.436 -12.751 -3.750 78 HG23 ILE 11 3HG2 ILE 11 3.913 -11.704 -2.414 79 HD11 ILE 11 3HD1 ILE 11 0.642 -10.406 -1.084 80 HD12 ILE 11 1HD1 ILE 11 2.252 -10.107 -1.739 81 HD13 ILE 11 2HD1 ILE 11 0.825 -9.559 -2.619 82 H ALA 12 H ALA 12 1.541 -15.047 0.002 83 HA ALA 12 HA ALA 12 4.112 -16.258 -0.061 84 HB1 ALA 12 1HB ALA 12 3.812 -16.150 2.132 85 HB2 ALA 12 2HB ALA 12 2.125 -15.694 1.892 86 HB3 ALA 12 3HB ALA 12 2.568 -17.396 2.023 87 H ALA 13 H ALA 13 0.862 -17.402 -0.671 88 HA ALA 13 HA ALA 13 1.457 -20.182 -0.569 89 HB1 ALA 13 1HB ALA 13 -0.791 -18.818 -2.044 90 HB2 ALA 13 2HB ALA 13 -0.715 -20.511 -1.556 91 HB3 ALA 13 3HB ALA 13 -0.823 -19.245 -0.333 92 H ALA 14 H ALA 14 2.145 -17.749 -2.840 93 HA ALA 14 HA ALA 14 2.407 -19.654 -5.049 94 HB1 ALA 14 1HB ALA 14 1.530 -17.051 -4.996 95 HB2 ALA 14 2HB ALA 14 3.179 -16.902 -5.606 96 HB3 ALA 14 3HB ALA 14 2.024 -17.946 -6.434 97 H LEU 15 H LEU 15 4.329 -17.276 -3.239 98 HA LEU 15 HA LEU 15 6.770 -17.686 -4.523 99 HB2 LEU 15 1HB LEU 15 6.155 -16.894 -1.684 100 HB3 LEU 15 2HB LEU 15 7.776 -16.869 -2.373 101 HG LEU 15 HG LEU 15 5.460 -15.239 -3.411 102 HD11 LEU 15 1HD1 LEU 15 6.605 -13.333 -2.352 103 HD12 LEU 15 2HD1 LEU 15 7.729 -14.455 -1.587 104 HD13 LEU 15 3HD1 LEU 15 6.014 -14.507 -1.176 105 HD21 LEU 15 3HD2 LEU 15 7.340 -15.850 -4.983 106 HD22 LEU 15 1HD2 LEU 15 8.403 -14.905 -3.940 107 HD23 LEU 15 2HD2 LEU 15 7.051 -14.124 -4.760 108 H ARG 16 H ARG 16 5.035 -19.718 -2.385 109 HA ARG 16 HA ARG 16 7.410 -21.325 -1.782 110 HB2 ARG 16 1HB ARG 16 5.597 -20.622 -0.046 111 HB3 ARG 16 2HB ARG 16 4.655 -21.926 -0.758 112 HG2 ARG 16 1HG ARG 16 7.441 -22.490 0.119 113 HG3 ARG 16 2HG ARG 16 6.172 -22.336 1.337 114 HD2 ARG 16 1HD ARG 16 6.021 -24.169 -1.051 115 HD3 ARG 16 2HD ARG 16 6.570 -24.670 0.548 116 HE ARG 16 HE ARG 16 4.146 -23.587 1.046 117 HH11 ARG 16 1HH1 ARG 16 5.266 -25.994 -1.205 118 HH12 ARG 16 2HH1 ARG 16 3.765 -26.860 -1.227 119 HH21 ARG 16 1HH2 ARG 16 2.165 -24.718 1.026 120 HH22 ARG 16 2HH2 ARG 16 2.002 -26.133 0.042 121 H ASP 17 H ASP 17 4.219 -21.549 -3.292 122 HA ASP 17 HA ASP 17 4.186 -24.249 -3.924 123 HB2 ASP 17 1HB ASP 17 2.266 -22.731 -4.240 124 HB3 ASP 17 2HB ASP 17 3.100 -21.969 -5.591 125 H CYS 18 H CYS 18 5.565 -21.548 -5.766 126 HA CYS 18 HA CYS 18 6.993 -23.522 -7.424 127 HB2 CYS 18 1HB CYS 18 7.113 -21.635 -9.127 128 HB3 CYS 18 2HB CYS 18 5.527 -22.353 -8.873 129 HG CYS 18 HG CYS 18 6.501 -19.451 -7.351 130 H GLN 19 H GLN 19 7.953 -22.656 -4.917 131 HA GLN 19 HA GLN 19 9.758 -20.506 -5.069 132 HB2 GLN 19 1HB GLN 19 10.668 -21.299 -3.026 133 HB3 GLN 19 2HB GLN 19 8.951 -21.676 -2.977 134 HG2 GLN 19 1HG GLN 19 9.564 -23.989 -3.779 135 HG3 GLN 19 2HG GLN 19 11.243 -23.552 -3.462 136 HE21 GLN 19 2HE2 GLN 19 8.070 -23.884 -1.977 137 HE22 GLN 19 1HE2 GLN 19 8.647 -24.210 -0.382 138 H ALA 20 H ALA 20 9.855 -23.604 -6.467 139 HA ALA 20 HA ALA 20 12.690 -23.938 -6.565 140 HB1 ALA 20 1HB ALA 20 12.245 -25.929 -7.504 141 HB2 ALA 20 2HB ALA 20 10.585 -25.588 -7.014 142 HB3 ALA 20 3HB ALA 20 11.106 -25.244 -8.663 143 HA PRO 21 HA PRO 21 13.841 -21.460 -9.999 144 HB2 PRO 21 1HB PRO 21 15.649 -23.038 -11.270 145 HB3 PRO 21 2HB PRO 21 15.982 -22.248 -9.724 146 HG2 PRO 21 1HG PRO 21 15.153 -25.072 -10.268 147 HG3 PRO 21 2HG PRO 21 16.380 -24.464 -9.142 148 HD2 PRO 21 1HD PRO 21 13.903 -25.206 -8.337 149 HD3 PRO 21 2HD PRO 21 14.816 -23.907 -7.542 150 H ASP 22 H ASP 22 13.059 -20.992 -11.971 151 HA ASP 22 HA ASP 22 11.996 -21.186 -13.973 152 HB2 ASP 22 1HB ASP 22 12.648 -24.111 -14.087 153 HB3 ASP 22 2HB ASP 22 12.596 -22.931 -15.394 154 H SER 23 H SER 23 10.766 -22.035 -11.316 155 HA SER 23 HA SER 23 8.548 -23.651 -12.379 156 HB2 SER 23 1HB SER 23 9.622 -24.679 -10.455 157 HB3 SER 23 2HB SER 23 9.433 -23.196 -9.520 158 HG SER 23 HG SER 23 7.227 -24.582 -10.620 159 H PHE 24 H PHE 24 9.433 -20.572 -11.140 160 HA PHE 24 HA PHE 24 6.656 -19.798 -10.666 161 HB2 PHE 24 1HB PHE 24 8.056 -18.984 -8.957 162 HB3 PHE 24 2HB PHE 24 9.305 -18.492 -10.096 163 HD1 PHE 24 HD1 PHE 24 5.671 -17.794 -9.583 164 HD2 PHE 24 HD2 PHE 24 9.564 -16.232 -10.307 165 HE1 PHE 24 HE1 PHE 24 4.749 -15.513 -9.600 166 HE2 PHE 24 HE2 PHE 24 8.648 -13.949 -10.324 167 HZ PHE 24 HZ PHE 24 6.238 -13.586 -9.970 168 H SER 25 H SER 25 5.592 -18.219 -11.830 169 HA SER 25 HA SER 25 6.911 -16.852 -14.009 170 HB2 SER 25 1HB SER 25 5.050 -19.150 -14.450 171 HB3 SER 25 2HB SER 25 4.983 -17.785 -15.565 172 HG SER 25 HG SER 25 6.941 -19.703 -15.223 173 HA PRO 26 HA PRO 26 3.833 -13.812 -13.288 174 HB2 PRO 26 1HB PRO 26 3.417 -12.800 -15.773 175 HB3 PRO 26 2HB PRO 26 4.895 -12.504 -14.850 176 HG2 PRO 26 1HG PRO 26 4.395 -14.483 -17.040 177 HG3 PRO 26 2HG PRO 26 5.801 -13.435 -16.779 178 HD2 PRO 26 1HD PRO 26 5.792 -16.057 -16.103 179 HD3 PRO 26 2HD PRO 26 6.711 -14.840 -15.194 180 H LYS 27 H LYS 27 3.134 -15.949 -16.034 181 HA LYS 27 HA LYS 27 0.270 -15.502 -15.716 182 HB2 LYS 27 1HB LYS 27 0.002 -16.710 -17.770 183 HB3 LYS 27 2HB LYS 27 1.328 -15.575 -17.981 184 HG2 LYS 27 1HG LYS 27 2.746 -17.689 -17.224 185 HG3 LYS 27 2HG LYS 27 1.353 -18.534 -17.902 186 HD2 LYS 27 1HD LYS 27 1.636 -17.247 -19.993 187 HD3 LYS 27 2HD LYS 27 3.077 -16.493 -19.308 188 HE2 LYS 27 1HE LYS 27 3.940 -18.231 -20.589 189 HE3 LYS 27 2HE LYS 27 3.907 -18.907 -18.961 190 HZ1 LYS 27 3HZ LYS 27 2.953 -20.218 -21.008 191 HZ2 LYS 27 1HZ LYS 27 1.563 -19.318 -20.663 192 HZ3 LYS 27 2HZ LYS 27 2.230 -20.329 -19.483 193 H LYS 28 H LYS 28 1.672 -16.818 -13.585 194 HA LYS 28 HA LYS 28 0.177 -19.339 -13.575 195 HB2 LYS 28 1HB LYS 28 2.596 -19.764 -14.132 196 HB3 LYS 28 2HB LYS 28 3.010 -19.118 -12.549 197 HG2 LYS 28 1HG LYS 28 2.995 -21.406 -12.205 198 HG3 LYS 28 2HG LYS 28 1.402 -20.906 -11.635 199 HD2 LYS 28 1HD LYS 28 0.401 -21.598 -13.731 200 HD3 LYS 28 2HD LYS 28 1.989 -22.009 -14.382 201 HE2 LYS 28 1HE LYS 28 2.214 -23.650 -12.484 202 HE3 LYS 28 2HE LYS 28 0.517 -23.345 -12.119 203 HZ1 LYS 28 3HZ LYS 28 1.258 -25.292 -13.699 204 HZ2 LYS 28 1HZ LYS 28 1.212 -24.067 -14.866 205 HZ3 LYS 28 2HZ LYS 28 -0.175 -24.435 -13.971 206 H PHE 29 H PHE 29 1.925 -16.884 -11.733 207 HA PHE 29 HA PHE 29 0.742 -17.728 -9.232 208 HB2 PHE 29 1HB PHE 29 2.184 -16.247 -8.194 209 HB3 PHE 29 2HB PHE 29 3.088 -16.626 -9.656 210 HD1 PHE 29 HD2 PHE 29 2.510 -15.021 -11.703 211 HD2 PHE 29 HD1 PHE 29 2.012 -14.046 -7.590 212 HE1 PHE 29 HE2 PHE 29 2.608 -12.628 -12.262 213 HE2 PHE 29 HE1 PHE 29 2.108 -11.651 -8.143 214 HZ PHE 29 HZ PHE 29 2.408 -10.939 -10.481 215 H PHE 30 H PHE 30 -0.133 -15.731 -11.820 216 HA PHE 30 HA PHE 30 -1.495 -13.628 -10.639 217 HB2 PHE 30 1HB PHE 30 -2.679 -13.389 -12.685 218 HB3 PHE 30 2HB PHE 30 -1.097 -14.032 -13.114 219 HD1 PHE 30 HD1 PHE 30 -0.943 -16.611 -13.359 220 HD2 PHE 30 HD2 PHE 30 -4.585 -14.410 -13.489 221 HE1 PHE 30 HE1 PHE 30 -2.022 -18.473 -14.551 222 HE2 PHE 30 HE2 PHE 30 -5.670 -16.270 -14.680 223 HZ PHE 30 HZ PHE 30 -4.389 -18.305 -15.211 224 H GLN 31 H GLN 31 -2.332 -16.991 -10.815 225 HA GLN 31 HA GLN 31 -5.072 -16.518 -9.961 226 HB2 GLN 31 1HB GLN 31 -5.479 -18.776 -10.382 227 HB3 GLN 31 2HB GLN 31 -4.291 -18.348 -11.606 228 HG2 GLN 31 1HG GLN 31 -2.581 -19.192 -9.823 229 HG3 GLN 31 2HG GLN 31 -3.984 -20.042 -9.178 230 HE21 GLN 31 2HE2 GLN 31 -1.390 -20.518 -10.972 231 HE22 GLN 31 1HE2 GLN 31 -1.966 -21.702 -12.090 232 H ILE 32 H ILE 32 -2.001 -17.499 -8.640 233 HA ILE 32 HA ILE 32 -3.091 -18.449 -6.152 234 HB ILE 32 HB ILE 32 -0.240 -17.746 -6.863 235 HG12 ILE 32 1HG1 ILE 32 -1.064 -20.561 -6.524 236 HG13 ILE 32 2HG1 ILE 32 -1.724 -19.754 -7.942 237 HG21 ILE 32 1HG2 ILE 32 -0.311 -17.710 -4.537 238 HG22 ILE 32 2HG2 ILE 32 -1.490 -19.018 -4.457 239 HG23 ILE 32 3HG2 ILE 32 0.180 -19.364 -4.904 240 HD11 ILE 32 3HD1 ILE 32 1.167 -19.418 -7.462 241 HD12 ILE 32 1HD1 ILE 32 0.617 -21.025 -7.937 242 HD13 ILE 32 2HD1 ILE 32 0.278 -19.636 -8.970 243 H SER 33 H SER 33 -0.841 -15.766 -6.847 244 HA SER 33 HA SER 33 -1.045 -14.464 -4.425 245 HB2 SER 33 1HB SER 33 0.596 -13.883 -6.183 246 HB3 SER 33 2HB SER 33 -0.700 -13.162 -7.138 247 HG SER 33 HG SER 33 -0.565 -12.238 -4.556 248 H GLY 34 H GLY 34 -3.157 -14.232 -7.240 249 HA2 GLY 34 1HA GLY 34 -5.519 -13.836 -6.883 250 HA3 GLY 34 2HA GLY 34 -5.086 -12.774 -5.551 251 H MET 35 H MET 35 -3.808 -12.919 -8.861 252 HA MET 35 HA MET 35 -4.400 -10.062 -9.126 253 HB2 MET 35 1HB MET 35 -2.538 -11.906 -10.620 254 HB3 MET 35 2HB MET 35 -2.881 -10.266 -11.155 255 HG2 MET 35 1HG MET 35 -2.198 -9.751 -8.627 256 HG3 MET 35 2HG MET 35 -1.264 -11.224 -8.880 257 HE1 MET 35 3HE MET 35 0.625 -10.088 -12.250 258 HE2 MET 35 1HE MET 35 0.063 -11.485 -11.331 259 HE3 MET 35 2HE MET 35 -1.083 -10.530 -12.272 260 H SER 36 H SER 36 -5.444 -13.127 -10.205 261 HA SER 36 HA SER 36 -6.371 -12.638 -12.770 262 HB2 SER 36 1HB SER 36 -8.239 -14.327 -12.042 263 HB3 SER 36 2HB SER 36 -6.560 -14.862 -12.117 264 HG SER 36 HG SER 36 -7.993 -14.052 -9.805 265 H LYS 37 H LYS 37 -7.718 -11.688 -9.683 266 HA LYS 37 HA LYS 37 -10.281 -10.926 -10.603 267 HB2 LYS 37 1HB LYS 37 -8.697 -9.922 -8.230 268 HB3 LYS 37 2HB LYS 37 -10.410 -9.627 -8.498 269 HG2 LYS 37 1HG LYS 37 -10.887 -11.986 -8.313 270 HG3 LYS 37 2HG LYS 37 -9.166 -12.349 -8.163 271 HD2 LYS 37 1HD LYS 37 -9.049 -11.173 -6.065 272 HD3 LYS 37 2HD LYS 37 -10.715 -10.616 -6.239 273 HE2 LYS 37 1HE LYS 37 -10.069 -13.541 -6.222 274 HE3 LYS 37 2HE LYS 37 -10.217 -12.644 -4.712 275 HZ1 LYS 37 3HZ LYS 37 -12.363 -13.243 -4.942 276 HZ2 LYS 37 1HZ LYS 37 -12.270 -13.412 -6.623 277 HZ3 LYS 37 2HZ LYS 37 -12.437 -11.876 -5.936 278 H LYS 38 H LYS 38 -7.175 -9.389 -10.705 279 HA LYS 38 HA LYS 38 -7.885 -6.712 -10.955 280 HB2 LYS 38 1HB LYS 38 -5.639 -8.167 -12.364 281 HB3 LYS 38 2HB LYS 38 -5.756 -6.425 -12.149 282 HG2 LYS 38 1HG LYS 38 -5.349 -8.518 -10.030 283 HG3 LYS 38 2HG LYS 38 -4.237 -7.239 -10.523 284 HD2 LYS 38 1HD LYS 38 -5.081 -6.084 -8.800 285 HD3 LYS 38 2HD LYS 38 -6.490 -5.835 -9.835 286 HE2 LYS 38 1HE LYS 38 -7.771 -7.054 -8.486 287 HE3 LYS 38 2HE LYS 38 -6.632 -8.399 -8.537 288 HZ1 LYS 38 3HZ LYS 38 -6.753 -6.156 -6.626 289 HZ2 LYS 38 1HZ LYS 38 -5.311 -7.008 -6.859 290 HZ3 LYS 38 2HZ LYS 38 -6.692 -7.817 -6.312 291 H SER 39 H SER 39 -7.239 -5.596 -13.243 292 HA SER 39 HA SER 39 -8.289 -6.884 -15.561 293 HB2 SER 39 1HB SER 39 -10.330 -6.187 -14.073 294 HB3 SER 39 2HB SER 39 -9.977 -4.567 -14.673 295 HG SER 39 HG SER 39 -11.006 -5.137 -16.401 296 H SER 40 H SER 40 -5.895 -5.580 -14.981 297 HA SER 40 HA SER 40 -4.438 -4.071 -15.861 298 HB2 SER 40 1HB SER 40 -4.678 -3.578 -18.092 299 HB3 SER 40 2HB SER 40 -5.892 -4.851 -17.959 300 HG SER 40 HG SER 40 -6.203 -2.142 -18.380 301 H SER 41 H SER 41 -6.725 -3.283 -13.992 302 HA SER 41 HA SER 41 -6.517 -0.373 -14.415 303 HB2 SER 41 1HB SER 41 -8.838 -1.392 -14.652 304 HB3 SER 41 2HB SER 41 -8.759 -1.744 -12.926 305 HG SER 41 HG SER 41 -9.622 0.210 -12.890 306 H GLN 42 H GLN 42 -5.555 -2.914 -12.516 307 HA GLN 42 HA GLN 42 -5.027 -1.116 -10.246 308 HB2 GLN 42 1HB GLN 42 -5.647 -4.067 -10.043 309 HB3 GLN 42 2HB GLN 42 -5.313 -2.977 -8.704 310 HG2 GLN 42 1HG GLN 42 -7.491 -2.642 -8.537 311 HG3 GLN 42 2HG GLN 42 -7.420 -1.792 -10.080 312 HE21 GLN 42 2HE2 GLN 42 -6.845 -3.969 -11.736 313 HE22 GLN 42 1HE2 GLN 42 -8.232 -4.998 -11.789 314 H LEU 43 H LEU 43 -3.833 -3.282 -12.569 315 HA LEU 43 HA LEU 43 -1.568 -4.331 -11.309 316 HB2 LEU 43 1HB LEU 43 -1.674 -3.521 -14.200 317 HB3 LEU 43 2HB LEU 43 -0.744 -4.827 -13.468 318 HG LEU 43 HG LEU 43 -3.658 -4.732 -14.151 319 HD11 LEU 43 1HD1 LEU 43 -1.376 -5.898 -15.278 320 HD12 LEU 43 2HD1 LEU 43 -3.059 -6.167 -15.730 321 HD13 LEU 43 3HD1 LEU 43 -2.286 -7.220 -14.547 322 HD21 LEU 43 3HD2 LEU 43 -4.000 -5.562 -12.057 323 HD22 LEU 43 1HD2 LEU 43 -2.360 -6.197 -11.918 324 HD23 LEU 43 2HD2 LEU 43 -3.559 -7.057 -12.884 325 H LYS 44 H LYS 44 -1.745 -1.504 -13.482 326 HA LYS 44 HA LYS 44 0.893 -0.635 -12.855 327 HB2 LYS 44 1HB LYS 44 0.373 1.322 -14.177 328 HB3 LYS 44 2HB LYS 44 -0.257 -0.107 -14.988 329 HG2 LYS 44 1HG LYS 44 -2.218 1.081 -13.219 330 HG3 LYS 44 2HG LYS 44 -1.635 2.224 -14.432 331 HD2 LYS 44 1HD LYS 44 -1.995 0.044 -15.973 332 HD3 LYS 44 2HD LYS 44 -3.237 -0.236 -14.751 333 HE2 LYS 44 1HE LYS 44 -4.328 0.992 -16.415 334 HE3 LYS 44 2HE LYS 44 -3.941 2.186 -15.176 335 HZ1 LYS 44 3HZ LYS 44 -1.930 1.826 -17.234 336 HZ2 LYS 44 1HZ LYS 44 -2.513 3.247 -16.523 337 HZ3 LYS 44 2HZ LYS 44 -3.389 2.501 -17.763 338 H GLU 45 H GLU 45 -2.096 -0.341 -11.264 339 HA GLU 45 HA GLU 45 -2.034 2.127 -10.053 340 HB2 GLU 45 1HB GLU 45 -3.807 0.335 -9.827 341 HB3 GLU 45 2HB GLU 45 -2.782 -0.417 -8.613 342 HG2 GLU 45 1HG GLU 45 -4.604 1.009 -7.701 343 HG3 GLU 45 2HG GLU 45 -2.985 1.449 -7.161 344 H ILE 46 H ILE 46 -0.397 -0.840 -8.990 345 HA ILE 46 HA ILE 46 0.913 0.540 -6.812 346 HB ILE 46 HB ILE 46 1.502 -2.244 -7.806 347 HG12 ILE 46 1HG1 ILE 46 -0.078 -2.648 -5.652 348 HG13 ILE 46 2HG1 ILE 46 -0.803 -1.173 -6.282 349 HG21 ILE 46 1HG2 ILE 46 1.675 -1.805 -4.965 350 HG22 ILE 46 2HG2 ILE 46 2.902 -2.390 -6.088 351 HG23 ILE 46 3HG2 ILE 46 2.687 -0.657 -5.842 352 HD11 ILE 46 3HD1 ILE 46 -1.032 -3.881 -7.221 353 HD12 ILE 46 1HD1 ILE 46 -1.974 -2.454 -7.653 354 HD13 ILE 46 2HD1 ILE 46 -0.470 -2.809 -8.504 355 H PHE 47 H PHE 47 1.562 -0.209 -10.105 356 HA PHE 47 HA PHE 47 3.475 -0.138 -11.382 357 HB2 PHE 47 1HB PHE 47 4.631 2.084 -11.159 358 HB3 PHE 47 2HB PHE 47 2.883 2.184 -11.339 359 HD1 PHE 47 HD2 PHE 47 1.481 2.903 -9.502 360 HD2 PHE 47 HD1 PHE 47 5.710 2.674 -9.083 361 HE1 PHE 47 HE2 PHE 47 1.347 4.252 -7.449 362 HE2 PHE 47 HE1 PHE 47 5.583 4.023 -7.029 363 HZ PHE 47 HZ PHE 47 3.400 4.815 -6.210 364 H ARG 48 H ARG 48 3.863 -1.779 -9.125 365 HA ARG 48 HA ARG 48 6.753 -1.461 -8.788 366 HB2 ARG 48 1HB ARG 48 4.772 -1.877 -6.547 367 HB3 ARG 48 2HB ARG 48 6.498 -2.169 -6.378 368 HG2 ARG 48 1HG ARG 48 5.892 0.459 -7.473 369 HG3 ARG 48 2HG ARG 48 5.204 0.193 -5.870 370 HD2 ARG 48 1HD ARG 48 8.073 -0.424 -6.519 371 HD3 ARG 48 2HD ARG 48 7.551 1.170 -5.974 372 HE ARG 48 HE ARG 48 6.557 -0.660 -4.150 373 HH11 ARG 48 1HH1 ARG 48 9.668 0.398 -5.300 374 HH12 ARG 48 2HH1 ARG 48 10.479 0.068 -3.805 375 HH21 ARG 48 1HH2 ARG 48 7.613 -1.100 -2.176 376 HH22 ARG 48 2HH2 ARG 48 9.309 -0.785 -2.029 377 H ILE 49 H ILE 49 4.588 -3.261 -10.120 378 HA ILE 49 HA ILE 49 5.907 -5.785 -9.388 379 HB ILE 49 HB ILE 49 3.857 -7.016 -9.530 380 HG12 ILE 49 1HG1 ILE 49 2.849 -5.538 -11.310 381 HG13 ILE 49 2HG1 ILE 49 1.729 -6.057 -10.055 382 HG21 ILE 49 1HG2 ILE 49 3.786 -4.603 -7.756 383 HG22 ILE 49 2HG2 ILE 49 2.505 -5.813 -7.703 384 HG23 ILE 49 3HG2 ILE 49 4.169 -6.274 -7.344 385 HD11 ILE 49 3HD1 ILE 49 2.791 -3.642 -9.150 386 HD12 ILE 49 1HD1 ILE 49 2.464 -3.407 -10.866 387 HD13 ILE 49 2HD1 ILE 49 1.173 -3.936 -9.787 388 H LEU 50 H LEU 50 5.540 -3.596 -11.716 389 HA LEU 50 HA LEU 50 5.670 -5.615 -13.856 390 HB2 LEU 50 1HB LEU 50 4.624 -2.842 -14.305 391 HB3 LEU 50 2HB LEU 50 4.445 -4.268 -15.325 392 HG LEU 50 HG LEU 50 3.140 -4.066 -12.624 393 HD11 LEU 50 1HD1 LEU 50 2.458 -2.154 -14.061 394 HD12 LEU 50 2HD1 LEU 50 1.143 -3.260 -13.667 395 HD13 LEU 50 3HD1 LEU 50 1.893 -3.316 -15.262 396 HD21 LEU 50 3HD2 LEU 50 1.558 -5.670 -13.810 397 HD22 LEU 50 1HD2 LEU 50 3.159 -6.284 -13.396 398 HD23 LEU 50 2HD2 LEU 50 2.802 -5.801 -15.054 399 H ASP 51 H ASP 51 6.241 -2.109 -13.539 400 HA ASP 51 HA ASP 51 9.033 -2.537 -14.316 401 HB2 ASP 51 1HB ASP 51 7.573 -1.961 -16.330 402 HB3 ASP 51 2HB ASP 51 7.371 -0.372 -15.598 403 H ASN 52 H ASN 52 10.003 -1.844 -12.503 404 HA ASN 52 HA ASN 52 9.012 0.323 -10.927 405 HB2 ASN 52 1HB ASN 52 10.423 -1.696 -10.158 406 HB3 ASN 52 2HB ASN 52 11.807 -0.782 -10.751 407 HD21 ASN 52 2HD2 ASN 52 12.536 -0.849 -8.546 408 HD22 ASN 52 1HD2 ASN 52 11.929 0.300 -7.407 409 H ASP 53 H ASP 53 10.916 0.130 -13.727 410 HA ASP 53 HA ASP 53 12.420 2.552 -13.273 411 HB2 ASP 53 1HB ASP 53 12.110 0.671 -15.599 412 HB3 ASP 53 2HB ASP 53 12.924 2.221 -15.791 413 H GLN 54 H GLN 54 9.572 1.573 -15.119 414 HA GLN 54 HA GLN 54 7.968 2.761 -16.214 415 HB2 GLN 54 1HB GLN 54 8.738 4.752 -14.079 416 HB3 GLN 54 2HB GLN 54 7.355 4.957 -15.145 417 HG2 GLN 54 1HG GLN 54 7.770 2.695 -13.203 418 HG3 GLN 54 2HG GLN 54 6.686 4.068 -12.986 419 HE21 GLN 54 2HE2 GLN 54 5.691 1.563 -12.798 420 HE22 GLN 54 1HE2 GLN 54 4.695 1.206 -14.164 421 H SER 55 H SER 55 10.768 2.988 -17.128 422 HA SER 55 HA SER 55 11.128 5.676 -18.066 423 HB2 SER 55 1HB SER 55 12.901 3.770 -17.623 424 HB3 SER 55 2HB SER 55 12.558 3.357 -19.303 425 HG SER 55 HG SER 55 13.316 5.940 -18.402 426 H GLY 56 H GLY 56 9.559 2.817 -19.226 427 HA2 GLY 56 1HA GLY 56 7.896 3.789 -21.047 428 HA3 GLY 56 2HA GLY 56 9.398 3.827 -21.958 429 H PHE 57 H PHE 57 10.126 1.330 -20.257 430 HA PHE 57 HA PHE 57 8.350 -0.704 -21.201 431 HB2 PHE 57 1HB PHE 57 9.778 -1.765 -22.809 432 HB3 PHE 57 2HB PHE 57 9.620 -0.076 -23.279 433 HD1 PHE 57 HD1 PHE 57 11.499 1.495 -22.231 434 HD2 PHE 57 HD2 PHE 57 11.868 -2.696 -22.876 435 HE1 PHE 57 HE1 PHE 57 13.949 1.717 -22.254 436 HE2 PHE 57 HE2 PHE 57 14.318 -2.481 -22.899 437 HZ PHE 57 HZ PHE 57 15.362 -0.272 -22.588 438 H ILE 58 H ILE 58 9.992 -2.890 -21.191 439 HA ILE 58 HA ILE 58 11.342 -2.774 -18.576 440 HB ILE 58 HB ILE 58 9.712 -5.134 -19.503 441 HG12 ILE 58 1HG1 ILE 58 8.911 -2.944 -17.574 442 HG13 ILE 58 2HG1 ILE 58 8.241 -3.184 -19.184 443 HG21 ILE 58 1HG2 ILE 58 10.991 -4.380 -16.883 444 HG22 ILE 58 2HG2 ILE 58 9.841 -5.704 -17.066 445 HG23 ILE 58 3HG2 ILE 58 11.383 -5.751 -17.921 446 HD11 ILE 58 3HD1 ILE 58 7.977 -5.627 -17.808 447 HD12 ILE 58 1HD1 ILE 58 7.442 -4.349 -16.717 448 HD13 ILE 58 2HD1 ILE 58 6.708 -4.511 -18.313 449 H GLU 59 H GLU 59 13.009 -4.341 -18.246 450 HA GLU 59 HA GLU 59 13.965 -5.707 -20.659 451 HB2 GLU 59 1HB GLU 59 15.089 -3.427 -20.253 452 HB3 GLU 59 2HB GLU 59 15.862 -4.199 -18.875 453 HG2 GLU 59 1HG GLU 59 17.245 -4.154 -20.934 454 HG3 GLU 59 2HG GLU 59 16.973 -5.768 -20.279 455 H GLU 60 H GLU 60 15.738 -7.277 -20.146 456 HA GLU 60 HA GLU 60 14.921 -9.087 -18.190 457 HB2 GLU 60 1HB GLU 60 17.661 -8.851 -19.447 458 HB3 GLU 60 2HB GLU 60 17.017 -10.271 -18.635 459 HG2 GLU 60 1HG GLU 60 15.108 -9.982 -20.446 460 HG3 GLU 60 2HG GLU 60 16.411 -9.180 -21.321 461 H ASP 61 H ASP 61 16.875 -6.281 -17.932 462 HA ASP 61 HA ASP 61 18.280 -7.047 -15.554 463 HB2 ASP 61 1HB ASP 61 19.129 -5.334 -17.149 464 HB3 ASP 61 2HB ASP 61 17.808 -4.274 -16.665 465 H GLU 62 H GLU 62 15.100 -6.360 -16.114 466 HA GLU 62 HA GLU 62 14.709 -5.457 -13.338 467 HB2 GLU 62 1HB GLU 62 13.464 -4.495 -15.870 468 HB3 GLU 62 2HB GLU 62 12.467 -4.537 -14.423 469 HG2 GLU 62 1HG GLU 62 15.053 -3.042 -14.781 470 HG3 GLU 62 2HG GLU 62 13.433 -2.351 -14.689 471 H LEU 63 H LEU 63 14.766 -8.159 -14.582 472 HA LEU 63 HA LEU 63 12.021 -8.997 -13.915 473 HB2 LEU 63 1HB LEU 63 13.971 -10.495 -15.651 474 HB3 LEU 63 2HB LEU 63 12.266 -10.859 -15.394 475 HG LEU 63 HG LEU 63 13.383 -8.489 -16.891 476 HD11 LEU 63 1HD1 LEU 63 11.595 -10.351 -18.252 477 HD12 LEU 63 2HD1 LEU 63 13.124 -11.072 -17.751 478 HD13 LEU 63 3HD1 LEU 63 13.121 -9.643 -18.785 479 HD21 LEU 63 3HD2 LEU 63 11.402 -7.505 -16.716 480 HD22 LEU 63 1HD2 LEU 63 10.926 -8.744 -15.555 481 HD23 LEU 63 2HD2 LEU 63 10.581 -8.965 -17.271 482 H LYS 64 H LYS 64 15.409 -9.421 -13.329 483 HA LYS 64 HA LYS 64 15.067 -11.823 -11.754 484 HB2 LYS 64 1HB LYS 64 17.436 -11.751 -11.418 485 HB3 LYS 64 2HB LYS 64 17.126 -11.348 -13.102 486 HG2 LYS 64 1HG LYS 64 17.323 -8.935 -12.472 487 HG3 LYS 64 2HG LYS 64 17.856 -9.465 -10.874 488 HD2 LYS 64 1HD LYS 64 19.910 -9.964 -11.611 489 HD3 LYS 64 2HD LYS 64 19.289 -10.773 -13.051 490 HE2 LYS 64 1HE LYS 64 18.767 -8.109 -13.535 491 HE3 LYS 64 2HE LYS 64 20.330 -8.073 -12.721 492 HZ1 LYS 64 3HZ LYS 64 19.721 -9.792 -15.063 493 HZ2 LYS 64 1HZ LYS 64 21.234 -9.543 -14.346 494 HZ3 LYS 64 2HZ LYS 64 20.470 -8.278 -15.170 495 H TYR 65 H TYR 65 14.197 -8.773 -11.192 496 HA TYR 65 HA TYR 65 14.845 -8.930 -8.321 497 HB2 TYR 65 1HB TYR 65 14.591 -6.503 -10.098 498 HB3 TYR 65 2HB TYR 65 14.590 -6.409 -8.340 499 HD1 TYR 65 HD2 TYR 65 16.620 -7.145 -11.311 500 HD2 TYR 65 HD1 TYR 65 16.618 -6.736 -7.076 501 HE1 TYR 65 HE2 TYR 65 19.079 -7.093 -11.321 502 HE2 TYR 65 HE1 TYR 65 19.077 -6.682 -7.074 503 HH TYR 65 HH TYR 65 20.902 -5.947 -9.103 504 H PHE 66 H PHE 66 12.643 -10.249 -9.301 505 HA PHE 66 HA PHE 66 10.328 -8.529 -8.887 506 HB2 PHE 66 1HB PHE 66 10.423 -10.276 -10.715 507 HB3 PHE 66 2HB PHE 66 10.343 -11.497 -9.448 508 HD1 PHE 66 HD1 PHE 66 8.513 -8.807 -11.151 509 HD2 PHE 66 HD2 PHE 66 8.302 -11.959 -8.298 510 HE1 PHE 66 HE1 PHE 66 6.058 -8.653 -11.167 511 HE2 PHE 66 HE2 PHE 66 5.846 -11.811 -8.311 512 HZ PHE 66 HZ PHE 66 4.721 -10.157 -9.747 513 H LEU 67 H LEU 67 11.103 -11.801 -7.708 514 HA LEU 67 HA LEU 67 9.458 -11.748 -5.482 515 HB2 LEU 67 1HB LEU 67 12.100 -13.176 -5.542 516 HB3 LEU 67 2HB LEU 67 10.627 -13.645 -4.696 517 HG LEU 67 HG LEU 67 11.015 -13.677 -7.689 518 HD11 LEU 67 1HD1 LEU 67 12.230 -15.388 -6.132 519 HD12 LEU 67 2HD1 LEU 67 11.392 -15.940 -7.581 520 HD13 LEU 67 3HD1 LEU 67 10.624 -16.105 -6.003 521 HD21 LEU 67 3HD2 LEU 67 8.805 -13.799 -7.827 522 HD22 LEU 67 1HD2 LEU 67 8.664 -13.682 -6.073 523 HD23 LEU 67 2HD2 LEU 67 8.838 -15.261 -6.840 524 H GLN 68 H GLN 68 12.531 -10.251 -5.976 525 HA GLN 68 HA GLN 68 13.548 -9.985 -3.436 526 HB2 GLN 68 1HB GLN 68 14.344 -9.056 -5.776 527 HB3 GLN 68 2HB GLN 68 13.552 -7.589 -5.219 528 HG2 GLN 68 1HG GLN 68 15.096 -7.195 -3.606 529 HG3 GLN 68 2HG GLN 68 15.434 -8.907 -3.355 530 HE21 GLN 68 2HE2 GLN 68 16.139 -9.792 -5.783 531 HE22 GLN 68 1HE2 GLN 68 17.557 -8.983 -6.346 532 H ARG 69 H ARG 69 10.723 -8.508 -4.795 533 HA ARG 69 HA ARG 69 10.483 -6.533 -2.692 534 HB2 ARG 69 1HB ARG 69 8.792 -7.296 -5.059 535 HB3 ARG 69 2HB ARG 69 8.183 -6.206 -3.820 536 HG2 ARG 69 1HG ARG 69 10.792 -5.684 -5.194 537 HG3 ARG 69 2HG ARG 69 9.257 -5.198 -5.917 538 HD2 ARG 69 1HD ARG 69 9.777 -3.296 -4.757 539 HD3 ARG 69 2HD ARG 69 8.845 -4.160 -3.535 540 HE ARG 69 HE ARG 69 10.731 -4.279 -2.261 541 HH11 ARG 69 1HH1 ARG 69 11.656 -3.672 -5.562 542 HH12 ARG 69 2HH1 ARG 69 13.336 -3.468 -5.191 543 HH21 ARG 69 1HH2 ARG 69 12.940 -4.013 -1.760 544 HH22 ARG 69 2HH2 ARG 69 14.065 -3.663 -3.028 545 H PHE 70 H PHE 70 8.161 -8.979 -3.844 546 HA PHE 70 HA PHE 70 6.583 -9.085 -1.595 547 HB2 PHE 70 1HB PHE 70 7.268 -11.402 -3.416 548 HB3 PHE 70 2HB PHE 70 5.868 -11.306 -2.352 549 HD1 PHE 70 HD1 PHE 70 4.036 -9.754 -2.849 550 HD2 PHE 70 HD2 PHE 70 7.321 -10.261 -5.508 551 HE1 PHE 70 HE1 PHE 70 2.743 -8.682 -4.647 552 HE2 PHE 70 HE2 PHE 70 6.034 -9.189 -7.309 553 HZ PHE 70 HZ PHE 70 3.741 -8.397 -6.880 554 H GLU 71 H GLU 71 9.067 -11.529 -2.369 555 HA GLU 71 HA GLU 71 9.073 -12.757 0.134 556 HB2 GLU 71 1HB GLU 71 10.083 -13.902 -1.687 557 HB3 GLU 71 2HB GLU 71 11.181 -12.567 -2.010 558 HG2 GLU 71 1HG GLU 71 12.362 -14.398 -0.973 559 HG3 GLU 71 2HG GLU 71 12.330 -13.003 0.104 560 H SER 72 H SER 72 10.704 -9.890 -1.005 561 HA SER 72 HA SER 72 11.868 -8.262 0.079 562 HB2 SER 72 1HB SER 72 9.958 -8.764 1.801 563 HB3 SER 72 2HB SER 72 11.253 -9.505 2.739 564 HG SER 72 HG SER 72 10.671 -7.045 2.827 565 H GLY 73 H GLY 73 12.868 -11.182 -0.338 566 HA2 GLY 73 1HA GLY 73 15.503 -10.658 0.760 567 HA3 GLY 73 2HA GLY 73 14.700 -12.082 1.406 568 H ALA 74 H ALA 74 13.998 -11.244 -1.852 569 HA ALA 74 HA ALA 74 15.178 -13.699 -2.787 570 HB1 ALA 74 1HB ALA 74 13.852 -13.479 -4.605 571 HB2 ALA 74 2HB ALA 74 12.993 -12.352 -3.554 572 HB3 ALA 74 3HB ALA 74 14.143 -11.745 -4.745 573 H ARG 75 H ARG 75 17.137 -13.951 -3.634 574 HA ARG 75 HA ARG 75 18.926 -11.730 -3.867 575 HB2 ARG 75 1HB ARG 75 20.326 -13.726 -4.988 576 HB3 ARG 75 2HB ARG 75 20.158 -13.535 -3.248 577 HG2 ARG 75 1HG ARG 75 18.712 -15.302 -3.053 578 HG3 ARG 75 2HG ARG 75 18.143 -15.160 -4.718 579 HD2 ARG 75 1HD ARG 75 20.123 -16.143 -5.572 580 HD3 ARG 75 2HD ARG 75 20.943 -16.007 -4.018 581 HE ARG 75 HE ARG 75 19.974 -17.975 -3.386 582 HH11 ARG 75 1HH1 ARG 75 18.220 -16.680 -6.100 583 HH12 ARG 75 2HH1 ARG 75 17.215 -18.079 -6.285 584 HH21 ARG 75 1HH2 ARG 75 18.658 -19.823 -3.620 585 HH22 ARG 75 2HH2 ARG 75 17.465 -19.866 -4.874 586 H VAL 76 H VAL 76 18.585 -14.249 -6.326 587 HA VAL 76 HA VAL 76 17.812 -12.297 -8.339 588 HB VAL 76 HB VAL 76 20.244 -13.961 -8.909 589 HG11 VAL 76 1HG1 VAL 76 19.369 -13.097 -10.880 590 HG12 VAL 76 2HG1 VAL 76 18.907 -11.571 -10.123 591 HG13 VAL 76 3HG1 VAL 76 20.607 -11.917 -10.446 592 HG21 VAL 76 3HG2 VAL 76 20.885 -12.701 -6.971 593 HG22 VAL 76 1HG2 VAL 76 21.611 -11.943 -8.389 594 HG23 VAL 76 2HG2 VAL 76 20.185 -11.226 -7.639 595 H LEU 77 H LEU 77 16.226 -13.223 -9.439 596 HA LEU 77 HA LEU 77 15.483 -15.888 -9.313 597 HB2 LEU 77 1HB LEU 77 14.891 -13.666 -11.213 598 HB3 LEU 77 2HB LEU 77 14.339 -15.295 -11.596 599 HG LEU 77 HG LEU 77 13.635 -14.443 -8.893 600 HD11 LEU 77 1HD1 LEU 77 11.776 -13.134 -10.627 601 HD12 LEU 77 2HD1 LEU 77 13.394 -12.486 -10.898 602 HD13 LEU 77 3HD1 LEU 77 12.698 -12.472 -9.277 603 HD21 LEU 77 3HD2 LEU 77 12.793 -16.455 -10.093 604 HD22 LEU 77 1HD2 LEU 77 11.942 -15.381 -11.204 605 HD23 LEU 77 2HD2 LEU 77 11.518 -15.394 -9.492 606 H THR 78 H THR 78 15.218 -17.246 -11.439 607 HA THR 78 HA THR 78 17.875 -17.964 -12.249 608 HB THR 78 HB THR 78 16.875 -19.811 -13.417 609 HG1 THR 78 HG1 THR 78 14.694 -19.906 -13.847 610 HG21 THR 78 3HG2 THR 78 15.405 -20.769 -11.617 611 HG22 THR 78 1HG2 THR 78 15.493 -19.208 -10.804 612 HG23 THR 78 2HG2 THR 78 16.959 -20.156 -11.054 613 H ALA 79 H ALA 79 17.869 -18.701 -14.781 614 HA ALA 79 HA ALA 79 17.729 -16.168 -16.212 615 HB1 ALA 79 1HB ALA 79 19.545 -18.264 -16.216 616 HB2 ALA 79 2HB ALA 79 18.712 -18.403 -17.764 617 HB3 ALA 79 3HB ALA 79 19.512 -16.894 -17.326 618 H SER 80 H SER 80 15.847 -18.936 -15.818 619 HA SER 80 HA SER 80 14.645 -18.790 -18.472 620 HB2 SER 80 1HB SER 80 14.728 -20.772 -16.301 621 HB3 SER 80 2HB SER 80 13.157 -20.629 -17.088 622 HG SER 80 HG SER 80 14.579 -20.726 -19.104 623 H GLU 81 H GLU 81 13.713 -18.407 -15.068 624 HA GLU 81 HA GLU 81 11.033 -17.824 -15.372 625 HB2 GLU 81 1HB GLU 81 13.085 -16.886 -13.389 626 HB3 GLU 81 2HB GLU 81 11.425 -16.316 -13.301 627 HG2 GLU 81 1HG GLU 81 10.608 -18.344 -12.661 628 HG3 GLU 81 2HG GLU 81 11.888 -19.241 -13.477 629 H THR 82 H THR 82 13.702 -15.462 -15.243 630 HA THR 82 HA THR 82 12.220 -13.173 -15.748 631 HB THR 82 HB THR 82 14.325 -12.175 -16.615 632 HG1 THR 82 HG1 THR 82 15.394 -14.789 -16.214 633 HG21 THR 82 3HG2 THR 82 15.387 -13.629 -14.323 634 HG22 THR 82 1HG2 THR 82 13.753 -13.025 -14.056 635 HG23 THR 82 2HG2 THR 82 15.042 -11.910 -14.508 636 H LYS 83 H LYS 83 13.523 -15.549 -17.991 637 HA LYS 83 HA LYS 83 13.169 -14.163 -20.387 638 HB2 LYS 83 1HB LYS 83 14.353 -16.371 -20.055 639 HB3 LYS 83 2HB LYS 83 12.768 -17.133 -20.017 640 HG2 LYS 83 1HG LYS 83 12.405 -16.814 -22.251 641 HG3 LYS 83 2HG LYS 83 13.453 -15.396 -22.331 642 HD2 LYS 83 1HD LYS 83 15.415 -16.746 -22.258 643 HD3 LYS 83 2HD LYS 83 14.480 -18.191 -21.869 644 HE2 LYS 83 1HE LYS 83 13.439 -18.142 -24.055 645 HE3 LYS 83 2HE LYS 83 14.267 -16.635 -24.444 646 HZ1 LYS 83 3HZ LYS 83 15.171 -19.109 -25.041 647 HZ2 LYS 83 1HZ LYS 83 16.040 -18.750 -23.634 648 HZ3 LYS 83 2HZ LYS 83 16.129 -17.717 -24.971 649 H THR 84 H THR 84 10.908 -16.180 -18.555 650 HA THR 84 HA THR 84 8.781 -15.649 -20.471 651 HB THR 84 HB THR 84 8.935 -17.908 -19.557 652 HG1 THR 84 HG1 THR 84 6.854 -17.562 -19.985 653 HG21 THR 84 3HG2 THR 84 9.887 -17.582 -17.410 654 HG22 THR 84 1HG2 THR 84 8.271 -18.230 -17.133 655 HG23 THR 84 2HG2 THR 84 8.580 -16.508 -16.914 656 H PHE 85 H PHE 85 9.694 -13.333 -19.256 657 HA PHE 85 HA PHE 85 7.447 -12.647 -17.476 658 HB2 PHE 85 1HB PHE 85 10.199 -12.439 -16.947 659 HB3 PHE 85 2HB PHE 85 9.652 -10.795 -17.258 660 HD1 PHE 85 HD2 PHE 85 8.600 -13.823 -15.349 661 HD2 PHE 85 HD1 PHE 85 8.856 -9.576 -15.486 662 HE1 PHE 85 HE2 PHE 85 7.697 -13.698 -13.064 663 HE2 PHE 85 HE1 PHE 85 7.953 -9.445 -13.201 664 HZ PHE 85 HZ PHE 85 7.372 -11.508 -11.987 665 H LEU 86 H LEU 86 9.785 -11.216 -19.754 666 HA LEU 86 HA LEU 86 7.642 -9.406 -20.659 667 HB2 LEU 86 1HB LEU 86 9.359 -7.783 -21.225 668 HB3 LEU 86 2HB LEU 86 9.419 -8.202 -19.514 669 HG LEU 86 HG LEU 86 11.316 -9.794 -20.154 670 HD11 LEU 86 1HD1 LEU 86 10.679 -8.658 -22.731 671 HD12 LEU 86 2HD1 LEU 86 11.729 -10.015 -22.325 672 HD13 LEU 86 3HD1 LEU 86 12.364 -8.370 -22.298 673 HD21 LEU 86 3HD2 LEU 86 12.959 -8.043 -19.967 674 HD22 LEU 86 1HD2 LEU 86 11.579 -7.651 -18.941 675 HD23 LEU 86 2HD2 LEU 86 11.786 -6.833 -20.490 676 H ALA 87 H ALA 87 9.944 -11.793 -21.519 677 HA ALA 87 HA ALA 87 9.896 -11.173 -24.352 678 HB1 ALA 87 1HB ALA 87 11.708 -12.476 -24.512 679 HB2 ALA 87 2HB ALA 87 11.731 -12.411 -22.749 680 HB3 ALA 87 3HB ALA 87 10.975 -13.775 -23.572 681 H ALA 88 H ALA 88 7.692 -12.460 -22.356 682 HA ALA 88 HA ALA 88 6.765 -14.461 -24.309 683 HB1 ALA 88 1HB ALA 88 5.712 -14.270 -21.513 684 HB2 ALA 88 2HB ALA 88 5.743 -15.657 -22.603 685 HB3 ALA 88 3HB ALA 88 7.235 -15.095 -21.849 686 H ALA 89 H ALA 89 6.207 -11.361 -23.155 687 HA ALA 89 HA ALA 89 3.409 -11.176 -23.146 688 HB1 ALA 89 1HB ALA 89 3.916 -9.115 -22.512 689 HB2 ALA 89 2HB ALA 89 5.606 -9.397 -22.933 690 HB3 ALA 89 3HB ALA 89 4.494 -8.746 -24.137 691 H ASP 90 H ASP 90 5.567 -9.984 -25.726 692 HA ASP 90 HA ASP 90 4.018 -11.232 -27.789 693 HB2 ASP 90 1HB ASP 90 3.637 -8.337 -27.151 694 HB3 ASP 90 2HB ASP 90 3.607 -8.843 -28.838 695 H HIS 91 H HIS 91 4.751 -10.242 -30.015 696 HA HIS 91 HA HIS 91 7.648 -9.724 -29.848 697 HB2 HIS 91 1HB HIS 91 7.760 -10.949 -32.080 698 HB3 HIS 91 2HB HIS 91 7.452 -11.941 -30.658 699 HD1 HIS 91 HD1 HIS 91 5.571 -10.368 -33.549 700 HD2 HIS 91 HD2 HIS 91 5.198 -13.467 -30.807 701 HE1 HIS 91 HE1 HIS 91 3.527 -11.651 -34.258 702 H ASP 92 H ASP 92 5.622 -7.725 -29.962 703 HA ASP 92 HA ASP 92 5.018 -6.740 -32.480 704 HB2 ASP 92 1HB ASP 92 4.053 -5.793 -30.456 705 HB3 ASP 92 2HB ASP 92 5.633 -5.200 -29.950 706 H GLY 93 H GLY 93 7.989 -6.465 -30.618 707 HA2 GLY 93 1HA GLY 93 9.479 -5.829 -32.991 708 HA3 GLY 93 2HA GLY 93 9.348 -4.466 -31.890 709 H ASP 94 H ASP 94 9.752 -5.284 -29.475 710 HA ASP 94 HA ASP 94 11.965 -7.180 -29.379 711 HB2 ASP 94 1HB ASP 94 12.420 -4.401 -29.501 712 HB3 ASP 94 2HB ASP 94 12.692 -4.866 -27.824 713 H GLY 95 H GLY 95 9.181 -6.964 -28.348 714 HA2 GLY 95 1HA GLY 95 8.081 -7.643 -26.447 715 HA3 GLY 95 2HA GLY 95 9.653 -8.026 -25.761 716 H LYS 96 H LYS 96 9.282 -4.815 -26.867 717 HA LYS 96 HA LYS 96 9.720 -3.720 -24.298 718 HB2 LYS 96 1HB LYS 96 8.627 -2.201 -26.660 719 HB3 LYS 96 2HB LYS 96 9.623 -1.591 -25.345 720 HG2 LYS 96 1HG LYS 96 11.325 -3.382 -26.300 721 HG3 LYS 96 2HG LYS 96 10.397 -3.100 -27.775 722 HD2 LYS 96 1HD LYS 96 12.102 -1.525 -27.917 723 HD3 LYS 96 2HD LYS 96 10.759 -0.596 -27.248 724 HE2 LYS 96 1HE LYS 96 11.737 -0.403 -25.196 725 HE3 LYS 96 2HE LYS 96 12.594 -1.936 -25.339 726 HZ1 LYS 96 3HZ LYS 96 13.974 -0.748 -27.095 727 HZ2 LYS 96 1HZ LYS 96 14.244 -0.320 -25.480 728 HZ3 LYS 96 2HZ LYS 96 13.326 0.689 -26.480 729 H ILE 97 H ILE 97 8.197 -4.065 -22.775 730 HA ILE 97 HA ILE 97 5.426 -4.170 -23.204 731 HB ILE 97 HB ILE 97 6.797 -3.397 -20.628 732 HG12 ILE 97 1HG1 ILE 97 7.777 -5.458 -21.480 733 HG13 ILE 97 2HG1 ILE 97 6.743 -5.815 -20.101 734 HG21 ILE 97 1HG2 ILE 97 4.803 -4.442 -19.600 735 HG22 ILE 97 2HG2 ILE 97 4.421 -3.017 -20.565 736 HG23 ILE 97 3HG2 ILE 97 4.109 -4.628 -21.210 737 HD11 ILE 97 3HD1 ILE 97 5.826 -7.380 -21.373 738 HD12 ILE 97 1HD1 ILE 97 5.053 -6.069 -22.264 739 HD13 ILE 97 2HD1 ILE 97 6.580 -6.744 -22.835 740 H GLY 98 H GLY 98 3.772 -2.680 -22.786 741 HA2 GLY 98 1HA GLY 98 4.539 0.102 -22.293 742 HA3 GLY 98 2HA GLY 98 3.717 -0.257 -23.805 743 H ALA 99 H ALA 99 3.240 -1.373 -20.455 744 HA ALA 99 HA ALA 99 1.355 -1.533 -19.181 745 HB1 ALA 99 1HB ALA 99 0.992 1.159 -20.469 746 HB2 ALA 99 2HB ALA 99 -0.097 0.542 -19.225 747 HB3 ALA 99 3HB ALA 99 1.610 0.789 -18.859 748 H GLU 100 H GLU 100 1.091 -3.139 -21.303 749 HA GLU 100 HA GLU 100 -1.723 -3.326 -21.629 750 HB2 GLU 100 1HB GLU 100 -1.954 -2.940 -23.972 751 HB3 GLU 100 2HB GLU 100 -1.161 -1.527 -23.289 752 HG2 GLU 100 1HG GLU 100 1.024 -2.537 -24.014 753 HG3 GLU 100 2HG GLU 100 0.083 -3.737 -24.897 754 H GLU 101 H GLU 101 1.484 -4.283 -22.710 755 HA GLU 101 HA GLU 101 0.638 -6.822 -23.737 756 HB2 GLU 101 1HB GLU 101 3.311 -5.571 -23.169 757 HB3 GLU 101 2HB GLU 101 3.185 -7.268 -23.612 758 HG2 GLU 101 1HG GLU 101 2.428 -6.789 -25.748 759 HG3 GLU 101 2HG GLU 101 1.913 -5.162 -25.308 760 H PHE 102 H PHE 102 1.781 -5.602 -20.673 761 HA PHE 102 HA PHE 102 2.135 -8.256 -19.560 762 HB2 PHE 102 1HB PHE 102 3.453 -6.048 -18.999 763 HB3 PHE 102 2HB PHE 102 2.114 -5.774 -17.889 764 HD1 PHE 102 HD1 PHE 102 1.530 -7.824 -16.346 765 HD2 PHE 102 HD2 PHE 102 5.287 -7.207 -18.249 766 HE1 PHE 102 HE1 PHE 102 2.608 -9.285 -14.684 767 HE2 PHE 102 HE2 PHE 102 6.370 -8.667 -16.591 768 HZ PHE 102 HZ PHE 102 5.031 -9.709 -14.807 769 H GLN 103 H GLN 103 -0.187 -5.626 -19.443 770 HA GLN 103 HA GLN 103 -1.745 -6.589 -17.299 771 HB2 GLN 103 1HB GLN 103 -2.270 -4.710 -19.579 772 HB3 GLN 103 2HB GLN 103 -3.576 -5.188 -18.502 773 HG2 GLN 103 1HG GLN 103 -2.519 -3.048 -17.883 774 HG3 GLN 103 2HG GLN 103 -2.439 -4.265 -16.610 775 HE21 GLN 103 2HE2 GLN 103 -0.506 -3.461 -19.481 776 HE22 GLN 103 1HE2 GLN 103 1.012 -3.429 -18.658 777 H GLU 104 H GLU 104 -1.826 -7.201 -20.767 778 HA GLU 104 HA GLU 104 -4.246 -8.737 -20.664 779 HB2 GLU 104 1HB GLU 104 -3.921 -9.133 -22.979 780 HB3 GLU 104 2HB GLU 104 -3.375 -7.487 -22.686 781 HG2 GLU 104 1HG GLU 104 -1.043 -8.366 -22.563 782 HG3 GLU 104 2HG GLU 104 -1.670 -9.932 -23.075 783 H MET 105 H MET 105 -0.872 -9.378 -20.243 784 HA MET 105 HA MET 105 -0.897 -12.155 -20.786 785 HB2 MET 105 1HB MET 105 1.224 -11.145 -20.766 786 HB3 MET 105 2HB MET 105 0.934 -10.358 -19.220 787 HG2 MET 105 1HG MET 105 1.618 -12.132 -18.043 788 HG3 MET 105 2HG MET 105 0.835 -13.280 -19.126 789 HE1 MET 105 3HE MET 105 4.136 -10.988 -18.704 790 HE2 MET 105 1HE MET 105 4.786 -11.247 -20.323 791 HE3 MET 105 2HE MET 105 3.223 -10.456 -20.117 792 H VAL 106 H VAL 106 -1.794 -10.253 -18.016 793 HA VAL 106 HA VAL 106 -1.906 -12.555 -16.250 794 HB VAL 106 HB VAL 106 -2.858 -9.737 -15.725 795 HG11 VAL 106 1HG1 VAL 106 -2.020 -11.772 -13.686 796 HG12 VAL 106 2HG1 VAL 106 -2.980 -10.308 -13.463 797 HG13 VAL 106 3HG1 VAL 106 -3.675 -11.703 -14.291 798 HG21 VAL 106 3HG2 VAL 106 -0.564 -9.514 -16.175 799 HG22 VAL 106 1HG2 VAL 106 -0.669 -9.624 -14.418 800 HG23 VAL 106 2HG2 VAL 106 -0.169 -11.028 -15.361 801 H GLN 107 H GLN 107 -4.227 -10.163 -17.518 802 HA GLN 107 HA GLN 107 -6.555 -11.272 -16.528 803 HB2 GLN 107 1HB GLN 107 -6.103 -9.834 -19.146 804 HB3 GLN 107 2HB GLN 107 -7.689 -10.177 -18.469 805 HG2 GLN 107 1HG GLN 107 -5.596 -8.279 -17.506 806 HG3 GLN 107 2HG GLN 107 -7.302 -7.989 -17.838 807 HE21 GLN 107 2HE2 GLN 107 -5.061 -8.374 -15.455 808 HE22 GLN 107 1HE2 GLN 107 -6.106 -8.794 -14.145 809 H SER 108 H SER 108 -4.878 -12.018 -19.563 810 HA SER 108 HA SER 108 -5.037 -13.768 -21.008 811 HB2 SER 108 1HB SER 108 -5.848 -15.029 -18.404 812 HB3 SER 108 2HB SER 108 -5.876 -15.968 -19.896 813 HG SER 108 HG SER 108 -3.639 -14.607 -18.799
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