NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
20779 | 2gi4 | 7189 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 1HT MET 1 16.792 -8.472 -6.460 2 2H MET 1 2HT MET 1 17.723 -7.179 -5.893 3 3H MET 1 3HT MET 1 18.029 -7.834 -7.422 4 HA MET 1 HA MET 1 16.575 -5.644 -7.010 5 1HB MET 1 2HB MET 1 16.724 -7.722 -9.140 6 2HB MET 1 1HB MET 1 15.492 -6.478 -9.305 7 1HG MET 1 2HG MET 1 16.975 -4.942 -9.915 8 2HG MET 1 1HG MET 1 18.090 -5.383 -8.623 9 1HE MET 1 1HE MET 1 20.697 -5.503 -10.512 10 2HE MET 1 2HE MET 1 20.743 -7.148 -9.879 11 3HE MET 1 3HE MET 1 20.043 -5.850 -8.912 12 H LYS 2 H LYS 2 15.268 -6.302 -5.061 13 HA LYS 2 HA LYS 2 12.797 -7.719 -5.701 14 1HB LYS 2 2HB LYS 2 14.004 -8.239 -3.598 15 2HB LYS 2 1HB LYS 2 13.744 -6.584 -3.062 16 1HG LYS 2 2HG LYS 2 11.627 -6.982 -2.454 17 2HG LYS 2 1HG LYS 2 11.305 -7.996 -3.862 18 1HD LYS 2 2HD LYS 2 11.858 -9.903 -2.777 19 2HD LYS 2 1HD LYS 2 13.149 -9.127 -1.857 20 1HE LYS 2 2HE LYS 2 11.819 -8.789 -0.099 21 2HE LYS 2 1HE LYS 2 10.529 -8.135 -1.108 22 1HZ LYS 2 1HZ LYS 2 9.522 -10.001 -0.331 23 2HZ LYS 2 2HZ LYS 2 10.962 -10.879 -0.190 24 3HZ LYS 2 3HZ LYS 2 10.250 -10.663 -1.708 25 H LYS 3 H LYS 3 11.034 -6.664 -6.320 26 HA LYS 3 HA LYS 3 10.743 -3.838 -5.534 27 1HB LYS 3 2HB LYS 3 10.562 -5.140 -8.158 28 2HB LYS 3 1HB LYS 3 9.217 -4.069 -7.796 29 1HG LYS 3 2HG LYS 3 11.408 -2.590 -7.041 30 2HG LYS 3 1HG LYS 3 11.969 -3.445 -8.480 31 1HD LYS 3 2HD LYS 3 9.912 -2.659 -9.656 32 2HD LYS 3 1HD LYS 3 9.532 -1.685 -8.235 33 1HE LYS 3 2HE LYS 3 10.687 -0.450 -10.084 34 2HE LYS 3 1HE LYS 3 11.492 -0.366 -8.516 35 1HZ LYS 3 1HZ LYS 3 12.893 -0.845 -10.590 36 2HZ LYS 3 2HZ LYS 3 12.262 -2.413 -10.497 37 3HZ LYS 3 3HZ LYS 3 13.166 -1.787 -9.211 38 H ILE 4 H ILE 4 8.914 -3.259 -4.555 39 HA ILE 4 HA ILE 4 6.732 -5.239 -4.410 40 HB ILE 4 HB ILE 4 6.858 -3.136 -2.341 41 1HG1 ILE 4 2HG1 ILE 4 9.255 -3.774 -2.618 42 2HG1 ILE 4 1HG1 ILE 4 8.599 -4.189 -1.039 43 1HG2 ILE 4 1HG2 ILE 4 5.969 -4.808 -0.952 44 2HG2 ILE 4 2HG2 ILE 4 6.537 -6.102 -2.007 45 3HG2 ILE 4 3HG2 ILE 4 5.212 -5.060 -2.524 46 1HD1 ILE 4 1HD1 ILE 4 8.993 -6.099 -3.330 47 2HD1 ILE 4 2HD1 ILE 4 8.370 -6.509 -1.732 48 3HD1 ILE 4 3HD1 ILE 4 10.033 -5.948 -1.914 49 H LEU 5 H LEU 5 5.029 -4.630 -5.586 50 HA LEU 5 HA LEU 5 4.536 -1.778 -6.022 51 1HB LEU 5 2HB LEU 5 4.295 -4.098 -7.643 52 2HB LEU 5 1HB LEU 5 2.695 -3.410 -7.450 53 HG LEU 5 HG LEU 5 5.102 -1.870 -8.424 54 1HD1 LEU 5 1HD1 LEU 5 3.283 -2.049 -10.487 55 2HD1 LEU 5 2HD1 LEU 5 3.286 -3.672 -9.794 56 3HD1 LEU 5 3HD1 LEU 5 4.795 -2.948 -10.348 57 1HD2 LEU 5 1HD2 LEU 5 2.265 -1.043 -8.810 58 2HD2 LEU 5 2HD2 LEU 5 3.726 -0.058 -8.726 59 3HD2 LEU 5 3HD2 LEU 5 3.042 -0.750 -7.255 60 H PHE 6 H PHE 6 3.230 -0.857 -4.571 61 HA PHE 6 HA PHE 6 1.055 -2.404 -3.372 62 1HB PHE 6 2HB PHE 6 1.889 0.427 -2.705 63 2HB PHE 6 1HB PHE 6 0.881 -0.645 -1.741 64 HD1 PHE 6 1HD PHE 6 4.273 0.269 -2.667 65 HD2 PHE 6 2HD PHE 6 1.890 -2.508 -0.490 66 HE1 PHE 6 1HE PHE 6 6.266 -0.470 -1.430 67 HE2 PHE 6 2HE PHE 6 3.880 -3.249 0.750 68 HZ PHE 6 HZ PHE 6 6.073 -2.232 0.277 69 H ILE 7 H ILE 7 -1.072 -2.029 -3.843 70 HA ILE 7 HA ILE 7 -1.627 0.110 -5.798 71 HB ILE 7 HB ILE 7 -3.205 -2.438 -5.453 72 1HG1 ILE 7 2HG1 ILE 7 -1.406 -1.899 -7.789 73 2HG1 ILE 7 1HG1 ILE 7 -0.727 -2.566 -6.307 74 1HG2 ILE 7 1HG2 ILE 7 -4.703 -1.255 -6.616 75 2HG2 ILE 7 2HG2 ILE 7 -3.622 -1.490 -7.989 76 3HG2 ILE 7 3HG2 ILE 7 -3.528 -0.009 -7.036 77 1HD1 ILE 7 1HD1 ILE 7 -2.448 -3.814 -8.333 78 2HD1 ILE 7 2HD1 ILE 7 -2.817 -4.221 -6.657 79 3HD1 ILE 7 3HD1 ILE 7 -1.203 -4.519 -7.302 80 H CYS 8 H CYS 8 -2.966 1.673 -5.217 81 HA CYS 8 HA CYS 8 -4.939 1.149 -3.108 82 1HB CYS 8 2HB CYS 8 -3.358 3.707 -3.385 83 2HB CYS 8 1HB CYS 8 -4.521 3.316 -2.121 84 HG CYS 8 HG CYS 8 -1.333 2.234 -2.496 85 H LEU 9 H LEU 9 -6.932 1.546 -3.727 86 HA LEU 9 HA LEU 9 -7.772 2.288 -6.201 87 1HB LEU 9 2HB LEU 9 -9.239 1.338 -4.492 88 2HB LEU 9 1HB LEU 9 -9.186 2.843 -3.593 89 HG LEU 9 HG LEU 9 -10.229 3.939 -5.646 90 1HD1 LEU 9 1HD1 LEU 9 -11.081 2.702 -7.362 91 2HD1 LEU 9 2HD1 LEU 9 -11.252 1.248 -6.379 92 3HD1 LEU 9 3HD1 LEU 9 -9.663 1.730 -6.972 93 1HD2 LEU 9 1HD2 LEU 9 -12.416 2.330 -4.962 94 2HD2 LEU 9 2HD2 LEU 9 -11.959 3.881 -4.256 95 3HD2 LEU 9 3HD2 LEU 9 -11.387 2.380 -3.529 96 H GLY 10 H GLY 10 -7.848 4.530 -3.416 97 1HA GLY 10 2HA GLY 10 -8.142 6.783 -5.208 98 2HA GLY 10 1HA GLY 10 -8.095 6.845 -3.451 99 H ASN 11 H ASN 11 -5.600 5.389 -3.222 100 HA ASN 11 HA ASN 11 -3.397 5.879 -2.973 101 1HB ASN 11 2HB ASN 11 -3.862 5.683 -5.644 102 2HB ASN 11 1HB ASN 11 -3.156 7.293 -5.547 103 1HD2 ASN 11 1HD2 ASN 11 -1.024 7.466 -5.448 104 2HD2 ASN 11 2HD2 ASN 11 0.076 6.162 -5.168 105 H ILE 12 H ILE 12 -5.540 7.995 -2.474 106 HA ILE 12 HA ILE 12 -3.693 10.279 -2.217 107 HB ILE 12 HB ILE 12 -5.623 11.788 -2.447 108 1HG1 ILE 12 2HG1 ILE 12 -7.538 10.189 -3.731 109 2HG1 ILE 12 1HG1 ILE 12 -7.079 9.288 -2.289 110 1HG2 ILE 12 1HG2 ILE 12 -4.525 11.667 -4.453 111 2HG2 ILE 12 2HG2 ILE 12 -6.127 11.110 -4.937 112 3HG2 ILE 12 3HG2 ILE 12 -4.838 9.942 -4.646 113 1HD1 ILE 12 1HD1 ILE 12 -7.591 11.250 -0.918 114 2HD1 ILE 12 2HD1 ILE 12 -8.987 10.701 -1.845 115 3HD1 ILE 12 3HD1 ILE 12 -8.083 12.123 -2.369 116 H CYS 13 H CYS 13 -4.410 8.032 -0.417 117 HA CYS 13 HA CYS 13 -5.001 9.648 1.917 118 1HB CYS 13 2HB CYS 13 -6.597 7.358 2.287 119 2HB CYS 13 1HB CYS 13 -7.136 9.022 2.092 120 HG CYS 13 HG CYS 13 -8.576 7.270 0.385 121 H ARG 14 H ARG 14 -5.318 6.150 1.618 122 HA ARG 14 HA ARG 14 -3.442 5.715 3.720 123 1HB ARG 14 2HB ARG 14 -4.875 3.998 3.875 124 2HB ARG 14 1HB ARG 14 -5.383 4.159 2.201 125 1HG ARG 14 2HG ARG 14 -2.714 2.997 2.542 126 2HG ARG 14 1HG ARG 14 -4.026 2.042 3.235 127 1HD ARG 14 2HD ARG 14 -3.977 3.098 0.412 128 2HD ARG 14 1HD ARG 14 -3.509 1.464 0.877 129 HE ARG 14 HE ARG 14 -6.204 2.424 1.517 130 1HH1 ARG 14 1HH1 ARG 14 -4.099 0.298 -0.268 131 2HH1 ARG 14 2HH1 ARG 14 -5.381 -0.749 -0.782 132 1HH2 ARG 14 1HH2 ARG 14 -7.898 1.055 0.845 133 2HH2 ARG 14 2HH2 ARG 14 -7.542 -0.318 -0.150 134 H SER 15 H SER 15 -3.212 5.780 0.259 135 HA SER 15 HA SER 15 -0.905 4.169 -0.028 136 1HB SER 15 2HB SER 15 -1.650 4.425 -2.125 137 2HB SER 15 1HB SER 15 -2.510 5.911 -1.722 138 HG SER 15 HG SER 15 0.288 5.744 -2.162 139 HA PRO 16 HA PRO 16 1.589 8.346 -0.056 140 1HB PRO 16 2HB PRO 16 -0.153 10.191 1.443 141 2HB PRO 16 1HB PRO 16 0.731 10.453 -0.064 142 1HG PRO 16 2HG PRO 16 -1.934 10.211 -0.041 143 2HG PRO 16 1HG PRO 16 -0.954 9.550 -1.365 144 1HD PRO 16 2HD PRO 16 -2.178 8.132 0.976 145 2HD PRO 16 1HD PRO 16 -2.123 7.644 -0.732 146 H MET 17 H MET 17 -0.563 8.234 2.802 147 HA MET 17 HA MET 17 1.361 8.919 4.697 148 1HB MET 17 2HB MET 17 -1.002 8.882 5.253 149 2HB MET 17 1HB MET 17 -1.067 7.144 4.998 150 1HG MET 17 2HG MET 17 -0.088 6.670 6.988 151 2HG MET 17 1HG MET 17 0.872 8.150 6.995 152 1HE MET 17 1HE MET 17 -0.676 7.709 10.074 153 2HE MET 17 2HE MET 17 -0.532 9.462 9.950 154 3HE MET 17 3HE MET 17 0.691 8.423 9.219 155 H ALA 18 H ALA 18 0.202 5.648 3.871 156 HA ALA 18 HA ALA 18 2.117 4.273 5.389 157 1HB ALA 18 1HB ALA 18 1.487 2.307 4.133 158 2HB ALA 18 2HB ALA 18 0.735 3.305 2.889 159 3HB ALA 18 3HB ALA 18 0.048 3.252 4.511 160 H GLU 19 H GLU 19 2.286 5.743 2.234 161 HA GLU 19 HA GLU 19 4.494 4.358 1.195 162 1HB GLU 19 2HB GLU 19 2.976 6.040 0.001 163 2HB GLU 19 1HB GLU 19 3.981 7.289 0.721 164 1HG GLU 19 2HG GLU 19 4.933 7.019 -1.356 165 2HG GLU 19 1HG GLU 19 5.943 5.991 -0.342 166 H PHE 20 H PHE 20 4.277 7.219 3.266 167 HA PHE 20 HA PHE 20 7.102 7.638 3.370 168 1HB PHE 20 2HB PHE 20 5.653 9.510 3.780 169 2HB PHE 20 1HB PHE 20 4.836 8.662 5.089 170 HD1 PHE 20 1HD PHE 20 8.285 9.727 4.131 171 HD2 PHE 20 2HD PHE 20 5.419 9.215 7.236 172 HE1 PHE 20 1HE PHE 20 9.864 10.705 5.745 173 HE2 PHE 20 2HE PHE 20 6.992 10.195 8.854 174 HZ PHE 20 HZ PHE 20 9.218 10.941 8.110 175 H ILE 21 H ILE 21 4.758 5.968 5.432 176 HA ILE 21 HA ILE 21 6.452 5.455 7.611 177 HB ILE 21 HB ILE 21 4.326 3.528 6.707 178 1HG1 ILE 21 2HG1 ILE 21 3.418 5.825 6.564 179 2HG1 ILE 21 1HG1 ILE 21 2.653 4.882 7.837 180 1HG2 ILE 21 1HG2 ILE 21 5.372 2.658 8.576 181 2HG2 ILE 21 2HG2 ILE 21 4.006 3.525 9.277 182 3HG2 ILE 21 3HG2 ILE 21 5.615 4.244 9.308 183 1HD1 ILE 21 1HD1 ILE 21 3.485 7.385 8.177 184 2HD1 ILE 21 2HD1 ILE 21 4.968 6.538 8.622 185 3HD1 ILE 21 3HD1 ILE 21 3.464 6.197 9.480 186 H MET 22 H MET 22 5.593 3.311 4.895 187 HA MET 22 HA MET 22 7.324 1.226 5.539 188 1HB MET 22 2HB MET 22 6.448 2.075 2.772 189 2HB MET 22 1HB MET 22 7.066 0.494 3.227 190 1HG MET 22 2HG MET 22 5.078 0.457 4.878 191 2HG MET 22 1HG MET 22 4.431 1.744 3.862 192 1HE MET 22 1HE MET 22 3.291 0.786 0.995 193 2HE MET 22 2HE MET 22 2.880 1.414 2.591 194 3HE MET 22 3HE MET 22 2.204 -0.121 2.048 195 H LYS 23 H LYS 23 7.826 3.929 3.279 196 HA LYS 23 HA LYS 23 10.374 3.325 2.415 197 1HB LYS 23 2HB LYS 23 8.866 5.188 1.612 198 2HB LYS 23 1HB LYS 23 9.415 6.126 2.993 199 1HG LYS 23 2HG LYS 23 11.446 6.527 2.092 200 2HG LYS 23 1HG LYS 23 11.516 4.963 1.275 201 1HD LYS 23 2HD LYS 23 11.345 6.600 -0.430 202 2HD LYS 23 1HD LYS 23 9.755 5.844 -0.304 203 1HE LYS 23 2HE LYS 23 8.836 7.701 0.795 204 2HE LYS 23 1HE LYS 23 10.423 8.362 1.190 205 1HZ LYS 23 1HZ LYS 23 9.123 9.441 -0.695 206 2HZ LYS 23 2HZ LYS 23 9.530 8.080 -1.612 207 3HZ LYS 23 3HZ LYS 23 10.749 9.072 -0.988 208 H ASP 24 H ASP 24 9.377 4.786 5.443 209 HA ASP 24 HA ASP 24 11.966 5.645 6.243 210 1HB ASP 24 2HB ASP 24 9.736 6.470 7.131 211 2HB ASP 24 1HB ASP 24 9.670 4.992 8.086 212 H LEU 25 H LEU 25 9.978 2.925 7.428 213 HA LEU 25 HA LEU 25 12.027 1.799 8.996 214 1HB LEU 25 2HB LEU 25 9.296 1.153 8.264 215 2HB LEU 25 1HB LEU 25 10.294 -0.280 8.423 216 HG LEU 25 HG LEU 25 10.703 1.554 10.636 217 1HD1 LEU 25 1HD1 LEU 25 7.911 0.668 9.991 218 2HD1 LEU 25 2HD1 LEU 25 8.485 2.268 10.459 219 3HD1 LEU 25 3HD1 LEU 25 8.434 0.968 11.648 220 1HD2 LEU 25 1HD2 LEU 25 9.489 -1.102 11.033 221 2HD2 LEU 25 2HD2 LEU 25 10.902 -0.369 11.795 222 3HD2 LEU 25 3HD2 LEU 25 11.036 -1.079 10.186 223 H VAL 26 H VAL 26 11.093 1.175 5.639 224 HA VAL 26 HA VAL 26 12.398 -1.250 5.253 225 HB VAL 26 HB VAL 26 12.602 -0.623 2.860 226 1HG1 VAL 26 1HG1 VAL 26 10.034 -0.056 2.661 227 2HG1 VAL 26 2HG1 VAL 26 10.061 -0.431 4.383 228 3HG1 VAL 26 3HG1 VAL 26 10.591 -1.636 3.210 229 1HG2 VAL 26 1HG2 VAL 26 11.363 1.572 2.285 230 2HG2 VAL 26 2HG2 VAL 26 13.055 1.642 2.779 231 3HG2 VAL 26 3HG2 VAL 26 11.781 2.043 3.933 232 H LYS 27 H LYS 27 13.723 1.982 5.416 233 HA LYS 27 HA LYS 27 16.177 1.660 4.203 234 1HB LYS 27 2HB LYS 27 15.370 3.797 5.077 235 2HB LYS 27 1HB LYS 27 15.537 3.205 6.723 236 1HG LYS 27 2HG LYS 27 18.025 2.857 6.068 237 2HG LYS 27 1HG LYS 27 17.651 4.000 4.775 238 1HD LYS 27 2HD LYS 27 17.945 5.662 6.223 239 2HD LYS 27 1HD LYS 27 16.545 5.076 7.123 240 1HE LYS 27 2HE LYS 27 17.981 3.623 8.442 241 2HE LYS 27 1HE LYS 27 19.388 4.148 7.517 242 1HZ LYS 27 1HZ LYS 27 18.690 6.479 8.309 243 2HZ LYS 27 2HZ LYS 27 19.482 5.456 9.398 244 3HZ LYS 27 3HZ LYS 27 17.805 5.655 9.492 245 H LYS 28 H LYS 28 15.044 0.344 7.203 246 HA LYS 28 HA LYS 28 17.536 -0.220 8.400 247 1HB LYS 28 2HB LYS 28 15.606 -0.202 9.777 248 2HB LYS 28 1HB LYS 28 14.784 -1.382 8.767 249 1HG LYS 28 2HG LYS 28 17.309 -2.348 9.866 250 2HG LYS 28 1HG LYS 28 16.113 -1.922 11.092 251 1HD LYS 28 2HD LYS 28 14.496 -3.289 9.542 252 2HD LYS 28 1HD LYS 28 15.998 -4.014 8.967 253 1HE LYS 28 2HE LYS 28 15.617 -5.442 10.677 254 2HE LYS 28 1HE LYS 28 16.414 -4.174 11.608 255 1HZ LYS 28 1HZ LYS 28 13.484 -4.186 11.237 256 2HZ LYS 28 2HZ LYS 28 14.395 -3.403 12.426 257 3HZ LYS 28 3HZ LYS 28 14.213 -5.083 12.474 258 H ALA 29 H ALA 29 15.328 -2.404 6.587 259 HA ALA 29 HA ALA 29 17.687 -4.076 6.019 260 1HB ALA 29 1HB ALA 29 16.409 -6.085 6.375 261 2HB ALA 29 2HB ALA 29 14.962 -5.140 6.721 262 3HB ALA 29 3HB ALA 29 16.340 -5.074 7.818 263 H ASN 30 H ASN 30 16.224 -2.087 4.332 264 HA ASN 30 HA ASN 30 15.675 -3.916 2.097 265 1HB ASN 30 2HB ASN 30 13.959 -1.673 3.090 266 2HB ASN 30 1HB ASN 30 13.986 -2.039 1.369 267 1HD2 ASN 30 1HD2 ASN 30 11.688 -2.461 1.815 268 2HD2 ASN 30 2HD2 ASN 30 11.236 -4.043 2.343 269 H LEU 31 H LEU 31 16.103 -0.449 2.849 270 HA LEU 31 HA LEU 31 17.136 0.250 0.324 271 1HB LEU 31 2HB LEU 31 16.337 1.970 1.798 272 2HB LEU 31 1HB LEU 31 17.487 1.516 3.042 273 HG LEU 31 HG LEU 31 19.269 2.151 1.225 274 1HD1 LEU 31 1HD1 LEU 31 18.588 3.861 -0.299 275 2HD1 LEU 31 2HD1 LEU 31 16.950 3.863 0.353 276 3HD1 LEU 31 3HD1 LEU 31 17.540 2.462 -0.541 277 1HD2 LEU 31 1HD2 LEU 31 17.682 4.290 2.638 278 2HD2 LEU 31 2HD2 LEU 31 19.365 4.383 2.121 279 3HD2 LEU 31 3HD2 LEU 31 18.897 3.266 3.403 280 H GLU 32 H GLU 32 18.513 -1.302 3.060 281 HA GLU 32 HA GLU 32 21.247 -0.785 2.587 282 1HB GLU 32 2HB GLU 32 20.024 -3.231 3.872 283 2HB GLU 32 1HB GLU 32 21.667 -2.642 4.086 284 1HG GLU 32 2HG GLU 32 19.883 -0.538 4.754 285 2HG GLU 32 1HG GLU 32 19.346 -2.001 5.577 286 H LYS 33 H LYS 33 19.134 -3.484 1.651 287 HA LYS 33 HA LYS 33 21.221 -4.605 -0.037 288 1HB LYS 33 2HB LYS 33 18.587 -5.521 0.986 289 2HB LYS 33 1HB LYS 33 19.110 -6.172 -0.562 290 1HG LYS 33 2HG LYS 33 20.679 -7.466 0.371 291 2HG LYS 33 1HG LYS 33 21.157 -6.226 1.533 292 1HD LYS 33 2HD LYS 33 19.283 -6.758 2.946 293 2HD LYS 33 1HD LYS 33 18.649 -7.885 1.747 294 1HE LYS 33 2HE LYS 33 20.554 -9.337 2.040 295 2HE LYS 33 1HE LYS 33 21.313 -8.175 3.128 296 1HZ LYS 33 1HZ LYS 33 19.594 -8.532 4.730 297 2HZ LYS 33 2HZ LYS 33 20.212 -10.042 4.280 298 3HZ LYS 33 3HZ LYS 33 18.723 -9.522 3.669 299 H GLU 34 H GLU 34 19.488 -2.036 -0.422 300 HA GLU 34 HA GLU 34 18.756 -0.804 -2.173 301 1HB GLU 34 2HB GLU 34 20.818 -2.301 -3.183 302 2HB GLU 34 1HB GLU 34 19.509 -2.680 -4.294 303 1HG GLU 34 2HG GLU 34 19.486 -0.618 -5.186 304 2HG GLU 34 1HG GLU 34 19.839 0.168 -3.650 305 H PHE 35 H PHE 35 16.634 -1.540 -1.285 306 HA PHE 35 HA PHE 35 15.189 -3.311 -3.129 307 1HB PHE 35 2HB PHE 35 14.777 -2.483 -0.293 308 2HB PHE 35 1HB PHE 35 13.352 -2.863 -1.253 309 HD1 PHE 35 1HD PHE 35 12.644 -4.830 -0.195 310 HD2 PHE 35 2HD PHE 35 16.671 -4.489 -1.531 311 HE1 PHE 35 1HE PHE 35 12.986 -7.228 0.236 312 HE2 PHE 35 2HE PHE 35 17.019 -6.887 -1.105 313 HZ PHE 35 HZ PHE 35 15.176 -8.260 -0.220 314 H PHE 36 H PHE 36 13.048 -2.634 -3.883 315 HA PHE 36 HA PHE 36 12.766 0.293 -4.030 316 1HB PHE 36 2HB PHE 36 12.399 -1.656 -6.312 317 2HB PHE 36 1HB PHE 36 12.075 0.072 -6.387 318 HD1 PHE 36 1HD PHE 36 14.423 -2.415 -7.076 319 HD2 PHE 36 2HD PHE 36 14.118 1.586 -5.662 320 HE1 PHE 36 1HE PHE 36 16.762 -2.011 -7.727 321 HE2 PHE 36 2HE PHE 36 16.453 1.998 -6.310 322 HZ PHE 36 HZ PHE 36 17.780 0.199 -7.345 323 H ILE 37 H ILE 37 10.728 1.123 -3.983 324 HA ILE 37 HA ILE 37 8.465 -0.750 -3.889 325 HB ILE 37 HB ILE 37 7.506 0.783 -2.060 326 1HG1 ILE 37 2HG1 ILE 37 10.151 1.269 -0.956 327 2HG1 ILE 37 1HG1 ILE 37 9.917 2.125 -2.477 328 1HG2 ILE 37 1HG2 ILE 37 8.223 -1.567 -1.753 329 2HG2 ILE 37 2HG2 ILE 37 8.453 -0.576 -0.314 330 3HG2 ILE 37 3HG2 ILE 37 9.834 -0.988 -1.330 331 1HD1 ILE 37 1HD1 ILE 37 8.361 2.374 0.069 332 2HD1 ILE 37 2HD1 ILE 37 7.731 2.957 -1.471 333 3HD1 ILE 37 3HD1 ILE 37 9.232 3.621 -0.825 334 H ASN 38 H ASN 38 6.562 0.017 -4.761 335 HA ASN 38 HA ASN 38 6.437 2.818 -5.596 336 1HB ASN 38 2HB ASN 38 5.414 1.300 -7.767 337 2HB ASN 38 1HB ASN 38 6.813 2.371 -7.754 338 1HD2 ASN 38 1HD2 ASN 38 5.897 -0.902 -6.739 339 2HD2 ASN 38 2HD2 ASN 38 7.366 -1.655 -7.248 340 H SER 39 H SER 39 4.454 3.678 -5.434 341 HA SER 39 HA SER 39 2.199 1.839 -4.957 342 1HB SER 39 2HB SER 39 2.959 3.252 -2.988 343 2HB SER 39 1HB SER 39 2.415 4.662 -3.898 344 HG SER 39 HG SER 39 0.957 3.195 -2.352 345 H ALA 40 H ALA 40 0.581 1.929 -6.382 346 HA ALA 40 HA ALA 40 0.074 4.424 -7.829 347 1HB ALA 40 1HB ALA 40 -0.200 2.173 -9.614 348 2HB ALA 40 2HB ALA 40 1.445 2.298 -8.989 349 3HB ALA 40 3HB ALA 40 0.711 3.669 -9.821 350 H GLY 41 H GLY 41 -2.010 4.419 -8.978 351 1HA GLY 41 2HA GLY 41 -4.031 3.129 -7.343 352 2HA GLY 41 1HA GLY 41 -4.311 4.341 -8.585 353 H THR 42 H THR 42 -6.121 2.655 -8.884 354 HA THR 42 HA THR 42 -5.390 0.227 -10.236 355 HB THR 42 HB THR 42 -7.389 0.024 -9.039 356 HG1 THR 42 1HG THR 42 -8.760 -0.623 -10.617 357 1HG2 THR 42 1HG2 THR 42 -7.651 2.670 -9.164 358 2HG2 THR 42 2HG2 THR 42 -9.005 1.613 -8.765 359 3HG2 THR 42 3HG2 THR 42 -8.826 2.236 -10.405 360 H SER 43 H SER 43 -6.875 3.306 -11.239 361 HA SER 43 HA SER 43 -6.146 2.622 -14.011 362 1HB SER 43 2HB SER 43 -8.453 4.441 -13.417 363 2HB SER 43 1HB SER 43 -8.155 3.445 -14.841 364 HG SER 43 HG SER 43 -9.757 2.815 -12.992 365 H GLY 44 H GLY 44 -5.214 4.466 -11.570 366 1HA GLY 44 2HA GLY 44 -4.120 6.468 -11.345 367 2HA GLY 44 1HA GLY 44 -3.649 6.213 -13.018 368 H GLU 45 H GLU 45 -7.018 6.576 -12.191 369 HA GLU 45 HA GLU 45 -7.454 8.661 -13.999 370 1HB GLU 45 2HB GLU 45 -9.082 7.963 -11.546 371 2HB GLU 45 1HB GLU 45 -9.634 8.941 -12.899 372 1HG GLU 45 2HG GLU 45 -9.697 7.110 -14.348 373 2HG GLU 45 1HG GLU 45 -8.694 6.123 -13.286 374 H HIS 46 H HIS 46 -6.969 8.721 -10.501 375 HA HIS 46 HA HIS 46 -6.000 11.461 -10.683 376 1HB HIS 46 2HB HIS 46 -7.375 12.174 -8.745 377 2HB HIS 46 1HB HIS 46 -8.353 11.785 -10.155 378 HD1 HIS 46 1HD HIS 46 -7.606 10.659 -6.679 379 HD2 HIS 46 2HD HIS 46 -10.003 9.528 -9.877 380 HE1 HIS 46 1HE HIS 46 -9.226 8.981 -5.743 381 HE2 HIS 46 2HE HIS 46 -10.594 8.230 -7.720 382 H ASP 47 H ASP 47 -6.138 8.374 -9.266 383 HA ASP 47 HA ASP 47 -5.030 8.526 -6.795 384 1HB ASP 47 2HB ASP 47 -3.745 6.528 -8.569 385 2HB ASP 47 1HB ASP 47 -4.557 6.304 -7.021 386 H GLY 48 H GLY 48 -3.523 10.020 -6.255 387 1HA GLY 48 2HA GLY 48 -0.847 9.644 -6.559 388 2HA GLY 48 1HA GLY 48 -1.281 10.600 -7.965 389 H GLU 49 H GLU 49 -3.429 11.973 -6.367 390 HA GLU 49 HA GLU 49 -2.073 14.282 -5.683 391 1HB GLU 49 2HB GLU 49 -4.623 13.383 -4.342 392 2HB GLU 49 1HB GLU 49 -4.082 15.032 -4.620 393 1HG GLU 49 2HG GLU 49 -4.426 14.817 -6.976 394 2HG GLU 49 1HG GLU 49 -4.765 13.094 -6.816 395 H GLY 50 H GLY 50 -3.629 12.232 -3.216 396 1HA GLY 50 2HA GLY 50 -2.541 11.292 -1.334 397 2HA GLY 50 1HA GLY 50 -1.184 12.370 -1.613 398 H MET 51 H MET 51 -4.660 12.551 -0.812 399 HA MET 51 HA MET 51 -4.144 13.983 1.581 400 1HB MET 51 2HB MET 51 -5.364 16.086 0.861 401 2HB MET 51 1HB MET 51 -3.729 15.887 0.244 402 1HG MET 51 2HG MET 51 -4.577 15.178 -1.896 403 2HG MET 51 1HG MET 51 -6.232 15.226 -1.292 404 1HE MET 51 1HE MET 51 -3.864 18.474 -3.202 405 2HE MET 51 2HE MET 51 -3.499 16.759 -3.012 406 3HE MET 51 3HE MET 51 -3.050 17.901 -1.746 407 H HIS 52 H HIS 52 -5.693 13.426 2.936 408 HA HIS 52 HA HIS 52 -8.467 13.371 2.093 409 1HB HIS 52 2HB HIS 52 -7.127 11.001 1.941 410 2HB HIS 52 1HB HIS 52 -7.740 10.937 3.590 411 HD1 HIS 52 1HD HIS 52 -10.216 12.803 1.984 412 HD2 HIS 52 2HD HIS 52 -9.155 8.789 1.852 413 HE1 HIS 52 1HE HIS 52 -12.249 11.599 1.125 414 HE2 HIS 52 2HE HIS 52 -11.544 9.187 0.946 415 H TYR 53 H TYR 53 -9.938 13.465 3.831 416 HA TYR 53 HA TYR 53 -9.250 15.041 5.963 417 1HB TYR 53 2HB TYR 53 -11.486 13.021 6.076 418 2HB TYR 53 1HB TYR 53 -11.400 14.587 6.879 419 HD1 TYR 53 1HD TYR 53 -13.334 13.147 4.669 420 HD2 TYR 53 2HD TYR 53 -10.536 16.352 4.694 421 HE1 TYR 53 1HE TYR 53 -14.505 14.177 2.768 422 HE2 TYR 53 2HE TYR 53 -11.701 17.393 2.795 423 HH TYR 53 HH TYR 53 -13.330 16.267 0.797 424 H GLY 54 H GLY 54 -9.862 11.535 6.169 425 1HA GLY 54 2HA GLY 54 -9.124 11.271 8.857 426 2HA GLY 54 1HA GLY 54 -9.188 9.966 7.689 427 H THR 55 H THR 55 -7.173 10.435 5.974 428 HA THR 55 HA THR 55 -4.922 9.642 7.461 429 HB THR 55 HB THR 55 -4.292 10.723 4.817 430 HG1 THR 55 1HG THR 55 -5.752 9.624 3.681 431 1HG2 THR 55 1HG2 THR 55 -3.655 8.481 6.528 432 2HG2 THR 55 2HG2 THR 55 -2.743 9.159 5.179 433 3HG2 THR 55 3HG2 THR 55 -3.995 7.952 4.880 434 H LYS 56 H LYS 56 -5.521 12.720 5.732 435 HA LYS 56 HA LYS 56 -3.097 13.942 6.376 436 1HB LYS 56 2HB LYS 56 -5.605 14.750 5.222 437 2HB LYS 56 1HB LYS 56 -5.044 15.982 6.343 438 1HG LYS 56 2HG LYS 56 -2.774 15.333 4.923 439 2HG LYS 56 1HG LYS 56 -4.055 15.269 3.711 440 1HD LYS 56 2HD LYS 56 -3.979 17.578 5.591 441 2HD LYS 56 1HD LYS 56 -2.810 17.524 4.269 442 1HE LYS 56 2HE LYS 56 -4.445 17.672 2.643 443 2HE LYS 56 1HE LYS 56 -5.703 17.042 3.705 444 1HZ LYS 56 1HZ LYS 56 -4.478 19.743 3.805 445 2HZ LYS 56 2HZ LYS 56 -5.551 19.146 4.969 446 3HZ LYS 56 3HZ LYS 56 -6.069 19.361 3.373 447 H ASN 57 H ASN 57 -6.210 14.124 8.100 448 HA ASN 57 HA ASN 57 -5.402 15.834 10.150 449 1HB ASN 57 2HB ASN 57 -7.737 15.302 9.871 450 2HB ASN 57 1HB ASN 57 -7.433 13.590 10.157 451 1HD2 ASN 57 1HD2 ASN 57 -7.731 12.858 12.135 452 2HD2 ASN 57 2HD2 ASN 57 -7.846 13.822 13.566 453 H LYS 58 H LYS 58 -5.277 12.314 9.915 454 HA LYS 58 HA LYS 58 -4.269 11.723 12.441 455 1HB LYS 58 2HB LYS 58 -4.968 10.270 10.259 456 2HB LYS 58 1HB LYS 58 -3.218 10.127 10.186 457 1HG LYS 58 2HG LYS 58 -4.068 9.681 12.868 458 2HG LYS 58 1HG LYS 58 -5.024 8.672 11.778 459 1HD LYS 58 2HD LYS 58 -3.288 7.334 11.357 460 2HD LYS 58 1HD LYS 58 -2.213 8.703 11.060 461 1HE LYS 58 2HE LYS 58 -1.733 8.928 13.377 462 2HE LYS 58 1HE LYS 58 -3.016 7.798 13.814 463 1HZ LYS 58 1HZ LYS 58 -0.567 7.006 13.763 464 2HZ LYS 58 2HZ LYS 58 -0.803 6.901 12.091 465 3HZ LYS 58 3HZ LYS 58 -1.777 5.999 13.140 466 H LEU 59 H LEU 59 -2.574 12.474 9.426 467 HA LEU 59 HA LEU 59 0.040 12.226 10.486 468 1HB LEU 59 2HB LEU 59 -1.002 13.700 8.068 469 2HB LEU 59 1HB LEU 59 0.701 13.514 8.439 470 HG LEU 59 HG LEU 59 -0.897 11.021 8.296 471 1HD1 LEU 59 1HD1 LEU 59 -1.841 11.763 6.356 472 2HD1 LEU 59 2HD1 LEU 59 -0.311 11.148 5.728 473 3HD1 LEU 59 3HD1 LEU 59 -0.518 12.877 6.008 474 1HD2 LEU 59 1HD2 LEU 59 1.458 10.906 8.782 475 2HD2 LEU 59 2HD2 LEU 59 1.839 11.859 7.349 476 3HD2 LEU 59 3HD2 LEU 59 1.164 10.238 7.176 477 H ALA 60 H ALA 60 -2.232 14.898 10.243 478 HA ALA 60 HA ALA 60 -0.476 17.003 10.840 479 1HB ALA 60 1HB ALA 60 -3.303 17.064 11.791 480 2HB ALA 60 2HB ALA 60 -2.970 17.012 10.059 481 3HB ALA 60 3HB ALA 60 -2.340 18.337 11.039 482 H GLN 61 H GLN 61 -2.121 14.682 12.866 483 HA GLN 61 HA GLN 61 -1.951 15.897 15.346 484 1HB GLN 61 2HB GLN 61 -2.111 13.117 14.369 485 2HB GLN 61 1HB GLN 61 -1.493 13.309 16.004 486 1HG GLN 61 2HG GLN 61 -3.705 14.960 15.943 487 2HG GLN 61 1HG GLN 61 -4.196 13.555 14.996 488 1HE2 GLN 61 1HE2 GLN 61 -3.584 11.419 16.042 489 2HE2 GLN 61 2HE2 GLN 61 -3.888 11.284 17.738 490 H LEU 62 H LEU 62 0.534 14.052 13.612 491 HA LEU 62 HA LEU 62 2.586 15.357 15.177 492 1HB LEU 62 2HB LEU 62 3.576 12.888 15.489 493 2HB LEU 62 1HB LEU 62 2.608 13.699 16.705 494 HG LEU 62 HG LEU 62 0.811 12.351 14.971 495 1HD1 LEU 62 1HD1 LEU 62 1.525 10.106 14.990 496 2HD1 LEU 62 2HD1 LEU 62 2.883 10.465 16.057 497 3HD1 LEU 62 3HD1 LEU 62 2.898 11.036 14.389 498 1HD2 LEU 62 1HD2 LEU 62 1.367 11.085 17.538 499 2HD2 LEU 62 2HD2 LEU 62 -0.116 11.822 16.934 500 3HD2 LEU 62 3HD2 LEU 62 1.140 12.829 17.654 501 H ASN 63 H ASN 63 1.825 12.883 12.760 502 HA ASN 63 HA ASN 63 4.379 12.800 11.559 503 1HB ASN 63 2HB ASN 63 1.787 12.247 10.115 504 2HB ASN 63 1HB ASN 63 3.370 11.518 9.843 505 1HD2 ASN 63 1HD2 ASN 63 0.484 11.468 11.719 506 2HD2 ASN 63 2HD2 ASN 63 0.833 10.033 12.614 507 H ILE 64 H ILE 64 3.906 13.146 8.845 508 HA ILE 64 HA ILE 64 3.857 16.073 8.664 509 HB ILE 64 HB ILE 64 4.807 14.087 6.593 510 1HG1 ILE 64 2HG1 ILE 64 6.601 15.780 8.314 511 2HG1 ILE 64 1HG1 ILE 64 6.056 14.198 8.866 512 1HG2 ILE 64 1HG2 ILE 64 5.797 15.954 5.484 513 2HG2 ILE 64 2HG2 ILE 64 5.379 17.036 6.812 514 3HG2 ILE 64 3HG2 ILE 64 4.109 16.351 5.799 515 1HD1 ILE 64 1HD1 ILE 64 7.210 13.084 7.178 516 2HD1 ILE 64 2HD1 ILE 64 8.319 14.354 7.701 517 3HD1 ILE 64 3HD1 ILE 64 7.393 14.547 6.211 518 H GLU 65 H GLU 65 2.413 17.157 7.390 519 HA GLU 65 HA GLU 65 -0.087 16.237 6.920 520 1HB GLU 65 2HB GLU 65 1.416 18.533 6.142 521 2HB GLU 65 1HB GLU 65 0.433 18.009 4.781 522 1HG GLU 65 2HG GLU 65 -1.313 19.011 5.685 523 2HG GLU 65 1HG GLU 65 -1.219 17.907 7.055 524 H HIS 66 H HIS 66 2.596 16.037 4.750 525 HA HIS 66 HA HIS 66 1.943 13.660 3.534 526 1HB HIS 66 2HB HIS 66 0.576 14.034 1.761 527 2HB HIS 66 1HB HIS 66 0.048 15.414 2.714 528 HD1 HIS 66 1HD HIS 66 0.912 17.767 1.960 529 HD2 HIS 66 2HD HIS 66 1.924 14.638 -0.580 530 HE1 HIS 66 1HE HIS 66 1.661 18.854 -0.181 531 HE2 HIS 66 2HE HIS 66 2.196 16.940 -1.729 532 H LYS 67 H LYS 67 3.295 13.146 1.682 533 HA LYS 67 HA LYS 67 5.168 14.995 0.631 534 1HB LYS 67 2HB LYS 67 7.212 14.032 1.665 535 2HB LYS 67 1HB LYS 67 6.190 14.881 2.817 536 1HG LYS 67 2HG LYS 67 5.804 11.954 2.515 537 2HG LYS 67 1HG LYS 67 7.250 12.522 3.352 538 1HD LYS 67 2HD LYS 67 6.036 12.813 5.192 539 2HD LYS 67 1HD LYS 67 5.086 14.033 4.343 540 1HE LYS 67 2HE LYS 67 3.322 12.674 4.156 541 2HE LYS 67 1HE LYS 67 4.321 11.319 3.633 542 1HZ LYS 67 1HZ LYS 67 4.753 11.824 6.376 543 2HZ LYS 67 2HZ LYS 67 4.154 10.425 5.637 544 3HZ LYS 67 3HZ LYS 67 3.093 11.661 6.094 545 H ASN 68 H ASN 68 3.389 13.058 -0.387 546 HA ASN 68 HA ASN 68 5.284 11.432 -1.901 547 1HB ASN 68 2HB ASN 68 3.057 10.388 -0.204 548 2HB ASN 68 1HB ASN 68 3.417 9.564 -1.718 549 1HD2 ASN 68 1HD2 ASN 68 5.917 9.317 -2.013 550 2HD2 ASN 68 2HD2 ASN 68 6.725 8.622 -0.653 551 H PHE 69 H PHE 69 3.872 13.809 -2.570 552 HA PHE 69 HA PHE 69 1.537 13.265 -4.088 553 1HB PHE 69 2HB PHE 69 2.474 15.526 -3.190 554 2HB PHE 69 1HB PHE 69 3.400 15.547 -4.685 555 HD1 PHE 69 1HD PHE 69 0.334 16.380 -3.148 556 HD2 PHE 69 2HD PHE 69 2.051 15.251 -6.874 557 HE1 PHE 69 1HE PHE 69 -1.604 17.336 -4.326 558 HE2 PHE 69 2HE PHE 69 0.115 16.202 -8.059 559 HZ PHE 69 HZ PHE 69 -1.716 17.246 -6.785 560 H THR 70 H THR 70 1.798 11.625 -5.561 561 HA THR 70 HA THR 70 3.353 12.271 -7.926 562 HB THR 70 HB THR 70 4.184 9.779 -7.884 563 HG1 THR 70 1HG THR 70 4.828 9.587 -5.444 564 1HG2 THR 70 1HG2 THR 70 5.973 11.056 -6.080 565 2HG2 THR 70 2HG2 THR 70 5.324 12.280 -7.171 566 3HG2 THR 70 3HG2 THR 70 6.131 10.854 -7.824 567 H SER 71 H SER 71 1.697 12.229 -9.336 568 HA SER 71 HA SER 71 -0.540 10.529 -9.181 569 1HB SER 71 2HB SER 71 -0.791 11.172 -11.664 570 2HB SER 71 1HB SER 71 -0.831 12.476 -10.477 571 HG SER 71 HG SER 71 1.633 11.754 -11.588 572 H LYS 72 H LYS 72 -0.278 8.371 -9.153 573 HA LYS 72 HA LYS 72 1.412 7.176 -11.245 574 1HB LYS 72 2HB LYS 72 1.058 6.565 -8.386 575 2HB LYS 72 1HB LYS 72 1.090 5.165 -9.447 576 1HG LYS 72 2HG LYS 72 3.201 7.142 -9.944 577 2HG LYS 72 1HG LYS 72 3.279 6.334 -8.377 578 1HD LYS 72 2HD LYS 72 3.963 4.417 -9.300 579 2HD LYS 72 1HD LYS 72 2.706 4.482 -10.539 580 1HE LYS 72 2HE LYS 72 4.818 4.529 -11.647 581 2HE LYS 72 1HE LYS 72 4.116 6.141 -11.766 582 1HZ LYS 72 1HZ LYS 72 5.909 6.967 -10.796 583 2HZ LYS 72 2HZ LYS 72 6.599 5.425 -10.722 584 3HZ LYS 72 3HZ LYS 72 5.669 5.996 -9.431 585 H LYS 73 H LYS 73 0.738 5.042 -12.015 586 HA LYS 73 HA LYS 73 -2.076 4.371 -11.743 587 1HB LYS 73 2HB LYS 73 -2.295 4.330 -14.285 588 2HB LYS 73 1HB LYS 73 -2.318 5.908 -13.516 589 1HG LYS 73 2HG LYS 73 -0.642 6.573 -14.792 590 2HG LYS 73 1HG LYS 73 0.377 5.281 -14.152 591 1HD LYS 73 2HD LYS 73 -1.002 3.817 -15.860 592 2HD LYS 73 1HD LYS 73 -1.236 5.375 -16.656 593 1HE LYS 73 2HE LYS 73 1.332 5.614 -16.389 594 2HE LYS 73 1HE LYS 73 1.301 3.866 -16.154 595 1HZ LYS 73 1HZ LYS 73 -0.254 4.368 -18.379 596 2HZ LYS 73 2HZ LYS 73 1.289 3.675 -18.349 597 3HZ LYS 73 3HZ LYS 73 1.115 5.344 -18.563 598 H LEU 74 H LEU 74 -1.488 2.375 -10.938 599 HA LEU 74 HA LEU 74 0.533 0.712 -11.877 600 1HB LEU 74 2HB LEU 74 -0.442 0.187 -9.794 601 2HB LEU 74 1HB LEU 74 -2.060 0.142 -10.468 602 HG LEU 74 HG LEU 74 -0.677 -1.855 -11.843 603 1HD1 LEU 74 1HD1 LEU 74 0.684 -1.363 -9.425 604 2HD1 LEU 74 2HD1 LEU 74 0.905 -2.704 -10.548 605 3HD1 LEU 74 3HD1 LEU 74 -0.233 -2.854 -9.209 606 1HD2 LEU 74 1HD2 LEU 74 -2.090 -3.054 -9.741 607 2HD2 LEU 74 2HD2 LEU 74 -2.665 -2.725 -11.376 608 3HD2 LEU 74 3HD2 LEU 74 -2.931 -1.544 -10.092 609 H THR 75 H THR 75 0.801 -0.320 -13.738 610 HA THR 75 HA THR 75 -1.578 -1.157 -15.257 611 HB THR 75 HB THR 75 0.242 -0.710 -17.243 612 HG1 THR 75 1HG THR 75 1.708 0.412 -16.003 613 1HG2 THR 75 1HG2 THR 75 -1.880 1.119 -16.124 614 2HG2 THR 75 2HG2 THR 75 -2.047 -0.057 -17.428 615 3HG2 THR 75 3HG2 THR 75 -1.074 1.394 -17.668 616 H GLN 76 H GLN 76 -0.390 -2.433 -17.343 617 HA GLN 76 HA GLN 76 0.424 -4.885 -16.166 618 1HB GLN 76 2HB GLN 76 -0.040 -3.871 -18.910 619 2HB GLN 76 1HB GLN 76 1.039 -5.251 -18.765 620 1HG GLN 76 2HG GLN 76 -1.662 -5.237 -17.471 621 2HG GLN 76 1HG GLN 76 -1.445 -5.693 -19.160 622 1HE2 GLN 76 1HE2 GLN 76 -2.209 -7.780 -18.649 623 2HE2 GLN 76 2HE2 GLN 76 -1.193 -8.936 -17.864 624 H LYS 77 H LYS 77 2.146 -2.478 -18.141 625 HA LYS 77 HA LYS 77 4.636 -3.748 -18.171 626 1HB LYS 77 2HB LYS 77 5.503 -1.330 -18.467 627 2HB LYS 77 1HB LYS 77 4.428 -1.995 -19.689 628 1HG LYS 77 2HG LYS 77 2.536 -0.859 -18.455 629 2HG LYS 77 1HG LYS 77 3.777 -0.013 -17.529 630 1HD LYS 77 2HD LYS 77 3.727 1.513 -19.164 631 2HD LYS 77 1HD LYS 77 4.611 0.327 -20.127 632 1HE LYS 77 2HE LYS 77 2.739 -0.317 -21.300 633 2HE LYS 77 1HE LYS 77 1.636 0.176 -20.015 634 1HZ LYS 77 1HZ LYS 77 3.190 2.101 -21.651 635 2HZ LYS 77 2HZ LYS 77 1.913 2.441 -20.594 636 3HZ LYS 77 3HZ LYS 77 1.616 1.611 -22.037 637 H LEU 78 H LEU 78 3.175 -1.595 -15.796 638 HA LEU 78 HA LEU 78 5.528 -1.241 -14.236 639 1HB LEU 78 2HB LEU 78 2.618 -0.718 -13.845 640 2HB LEU 78 1HB LEU 78 3.669 -0.699 -12.441 641 HG LEU 78 HG LEU 78 4.294 0.964 -14.863 642 1HD1 LEU 78 1HD1 LEU 78 2.344 2.021 -14.500 643 2HD1 LEU 78 2HD1 LEU 78 3.215 2.748 -13.149 644 3HD1 LEU 78 3HD1 LEU 78 2.164 1.358 -12.875 645 1HD2 LEU 78 1HD2 LEU 78 5.203 0.789 -12.036 646 2HD2 LEU 78 2HD2 LEU 78 5.203 2.367 -12.823 647 3HD2 LEU 78 3HD2 LEU 78 6.135 1.039 -13.512 648 H CYS 79 H CYS 79 2.712 -3.383 -13.946 649 HA CYS 79 HA CYS 79 3.459 -4.639 -11.551 650 1HB CYS 79 2HB CYS 79 1.255 -5.046 -12.145 651 2HB CYS 79 1HB CYS 79 1.655 -5.351 -13.831 652 HG CYS 79 HG CYS 79 2.926 -7.608 -11.713 653 H ASP 80 H ASP 80 4.341 -5.236 -14.887 654 HA ASP 80 HA ASP 80 5.535 -7.758 -14.572 655 1HB ASP 80 2HB ASP 80 4.995 -6.855 -16.770 656 2HB ASP 80 1HB ASP 80 6.156 -5.551 -16.546 657 H GLU 81 H GLU 81 6.542 -4.638 -13.588 658 HA GLU 81 HA GLU 81 9.356 -5.279 -13.463 659 1HB GLU 81 2HB GLU 81 7.912 -2.930 -12.235 660 2HB GLU 81 1HB GLU 81 9.639 -3.073 -12.527 661 1HG GLU 81 2HG GLU 81 9.250 -3.081 -14.926 662 2HG GLU 81 1HG GLU 81 7.511 -2.984 -14.654 663 H SER 82 H SER 82 6.898 -4.432 -10.996 664 HA SER 82 HA SER 82 8.484 -5.176 -8.804 665 1HB SER 82 2HB SER 82 5.632 -4.535 -9.255 666 2HB SER 82 1HB SER 82 5.988 -5.498 -7.820 667 HG SER 82 HG SER 82 7.780 -3.645 -7.782 668 H ASP 83 H ASP 83 8.638 -7.025 -7.604 669 HA ASP 83 HA ASP 83 7.981 -9.483 -8.990 670 1HB ASP 83 2HB ASP 83 10.041 -8.661 -7.268 671 2HB ASP 83 1HB ASP 83 9.128 -9.864 -6.362 672 H PHE 84 H PHE 84 6.860 -7.617 -6.296 673 HA PHE 84 HA PHE 84 4.849 -9.699 -5.738 674 1HB PHE 84 2HB PHE 84 6.602 -8.193 -3.891 675 2HB PHE 84 1HB PHE 84 4.919 -8.344 -3.394 676 HD1 PHE 84 1HD PHE 84 8.086 -9.873 -3.372 677 HD2 PHE 84 2HD PHE 84 3.925 -10.756 -3.512 678 HE1 PHE 84 1HE PHE 84 8.544 -12.143 -2.542 679 HE2 PHE 84 2HE PHE 84 4.375 -13.026 -2.680 680 HZ PHE 84 HZ PHE 84 6.687 -13.723 -2.193 681 H LEU 85 H LEU 85 2.745 -9.036 -5.479 682 HA LEU 85 HA LEU 85 2.220 -6.166 -5.897 683 1HB LEU 85 2HB LEU 85 1.664 -8.166 -7.688 684 2HB LEU 85 1HB LEU 85 0.144 -8.018 -6.826 685 HG LEU 85 HG LEU 85 0.407 -5.468 -7.324 686 1HD1 LEU 85 1HD1 LEU 85 1.990 -6.570 -9.629 687 2HD1 LEU 85 2HD1 LEU 85 2.748 -5.831 -8.218 688 3HD1 LEU 85 3HD1 LEU 85 1.660 -4.884 -9.232 689 1HD2 LEU 85 1HD2 LEU 85 -0.545 -5.967 -9.690 690 2HD2 LEU 85 2HD2 LEU 85 -1.433 -6.499 -8.262 691 3HD2 LEU 85 3HD2 LEU 85 -0.456 -7.650 -9.173 692 H ILE 86 H ILE 86 0.633 -5.224 -4.688 693 HA ILE 86 HA ILE 86 -0.916 -6.938 -2.869 694 HB ILE 86 HB ILE 86 0.399 -4.366 -1.991 695 1HG1 ILE 86 2HG1 ILE 86 1.570 -6.327 -0.501 696 2HG1 ILE 86 1HG1 ILE 86 1.392 -7.143 -2.051 697 1HG2 ILE 86 1HG2 ILE 86 -1.309 -6.423 -0.649 698 2HG2 ILE 86 2HG2 ILE 86 -1.463 -4.666 -0.643 699 3HG2 ILE 86 3HG2 ILE 86 -0.181 -5.442 0.287 700 1HD1 ILE 86 1HD1 ILE 86 2.481 -5.031 -3.036 701 2HD1 ILE 86 2HD1 ILE 86 3.494 -6.193 -2.179 702 3HD1 ILE 86 3HD1 ILE 86 2.983 -4.708 -1.377 703 H THR 87 H THR 87 -2.974 -6.247 -2.418 704 HA THR 87 HA THR 87 -3.897 -3.921 -3.960 705 HB THR 87 HB THR 87 -6.206 -5.131 -3.370 706 HG1 THR 87 1HG THR 87 -5.003 -6.828 -2.229 707 1HG2 THR 87 1HG2 THR 87 -4.260 -5.532 -5.592 708 2HG2 THR 87 2HG2 THR 87 -5.849 -4.768 -5.611 709 3HG2 THR 87 3HG2 THR 87 -5.715 -6.526 -5.552 710 H MET 88 H MET 88 -4.902 -5.659 -1.005 711 HA MET 88 HA MET 88 -5.383 -4.927 1.091 712 1HB MET 88 2HB MET 88 -4.521 -2.217 0.061 713 2HB MET 88 1HB MET 88 -4.981 -2.549 1.726 714 1HG MET 88 2HG MET 88 -3.096 -3.847 2.120 715 2HG MET 88 1HG MET 88 -2.794 -4.099 0.403 716 1HE MET 88 1HE MET 88 -0.952 -1.888 3.287 717 2HE MET 88 2HE MET 88 -2.694 -2.129 3.406 718 3HE MET 88 3HE MET 88 -2.049 -0.534 3.023 719 H ASP 89 H ASP 89 -6.611 -3.181 -1.685 720 HA ASP 89 HA ASP 89 -8.989 -2.278 -0.309 721 1HB ASP 89 2HB ASP 89 -9.078 -2.292 -3.239 722 2HB ASP 89 1HB ASP 89 -9.324 -0.963 -2.112 723 H ASN 90 H ASN 90 -10.935 -3.261 -0.280 724 HA ASN 90 HA ASN 90 -11.107 -6.016 -0.774 725 1HB ASN 90 2HB ASN 90 -12.545 -4.268 0.697 726 2HB ASN 90 1HB ASN 90 -13.643 -4.493 -0.661 727 1HD2 ASN 90 1HD2 ASN 90 -13.999 -5.286 2.084 728 2HD2 ASN 90 2HD2 ASN 90 -14.210 -7.001 2.081 729 H SER 91 H SER 91 -12.385 -3.263 -2.628 730 HA SER 91 HA SER 91 -13.590 -4.993 -4.593 731 1HB SER 91 2HB SER 91 -13.917 -2.315 -3.815 732 2HB SER 91 1HB SER 91 -13.337 -2.260 -5.479 733 HG SER 91 HG SER 91 -15.093 -4.120 -5.544 734 H ASN 92 H ASN 92 -10.733 -2.901 -4.457 735 HA ASN 92 HA ASN 92 -9.970 -2.989 -7.115 736 1HB ASN 92 2HB ASN 92 -8.929 -1.812 -4.965 737 2HB ASN 92 1HB ASN 92 -7.823 -3.178 -5.066 738 1HD2 ASN 92 1HD2 ASN 92 -8.611 -0.123 -6.248 739 2HD2 ASN 92 2HD2 ASN 92 -7.468 -0.054 -7.541 740 H PHE 93 H PHE 93 -9.824 -5.510 -4.745 741 HA PHE 93 HA PHE 93 -7.810 -7.093 -5.930 742 1HB PHE 93 2HB PHE 93 -8.330 -7.679 -3.726 743 2HB PHE 93 1HB PHE 93 -10.063 -7.658 -4.027 744 HD1 PHE 93 1HD PHE 93 -6.978 -9.521 -4.973 745 HD2 PHE 93 2HD PHE 93 -11.184 -9.645 -4.344 746 HE1 PHE 93 1HE PHE 93 -6.952 -11.960 -5.301 747 HE2 PHE 93 2HE PHE 93 -11.167 -12.084 -4.671 748 HZ PHE 93 HZ PHE 93 -9.049 -13.244 -5.150 749 H LYS 94 H LYS 94 -11.353 -7.530 -6.027 750 HA LYS 94 HA LYS 94 -11.388 -9.542 -7.955 751 1HB LYS 94 2HB LYS 94 -13.405 -7.484 -7.106 752 2HB LYS 94 1HB LYS 94 -13.760 -8.605 -8.415 753 1HG LYS 94 2HG LYS 94 -12.989 -10.390 -6.635 754 2HG LYS 94 1HG LYS 94 -13.453 -9.115 -5.507 755 1HD LYS 94 2HD LYS 94 -15.246 -10.123 -7.708 756 2HD LYS 94 1HD LYS 94 -15.266 -10.767 -6.066 757 1HE LYS 94 2HE LYS 94 -15.643 -8.371 -5.300 758 2HE LYS 94 1HE LYS 94 -15.963 -7.992 -6.992 759 1HZ LYS 94 1HZ LYS 94 -17.420 -10.277 -6.033 760 2HZ LYS 94 2HZ LYS 94 -17.971 -8.925 -6.887 761 3HZ LYS 94 3HZ LYS 94 -17.802 -8.851 -5.205 762 H ASN 95 H ASN 95 -11.559 -6.027 -8.334 763 HA ASN 95 HA ASN 95 -12.006 -5.965 -11.100 764 1HB ASN 95 2HB ASN 95 -11.831 -4.085 -9.133 765 2HB ASN 95 1HB ASN 95 -10.333 -3.797 -10.011 766 1HD2 ASN 95 1HD2 ASN 95 -12.944 -2.312 -9.738 767 2HD2 ASN 95 2HD2 ASN 95 -13.405 -1.964 -11.366 768 H VAL 96 H VAL 96 -8.936 -5.504 -9.341 769 HA VAL 96 HA VAL 96 -7.269 -5.392 -11.567 770 HB VAL 96 HB VAL 96 -6.790 -4.988 -9.012 771 1HG1 VAL 96 1HG1 VAL 96 -5.371 -7.597 -9.204 772 2HG1 VAL 96 2HG1 VAL 96 -7.067 -7.588 -8.717 773 3HG1 VAL 96 3HG1 VAL 96 -5.875 -6.686 -7.780 774 1HG2 VAL 96 1HG2 VAL 96 -4.278 -5.544 -9.618 775 2HG2 VAL 96 2HG2 VAL 96 -5.144 -4.211 -10.382 776 3HG2 VAL 96 3HG2 VAL 96 -4.967 -5.747 -11.229 777 H LEU 97 H LEU 97 -8.797 -8.117 -10.083 778 HA LEU 97 HA LEU 97 -7.052 -10.150 -10.976 779 1HB LEU 97 2HB LEU 97 -9.094 -10.162 -9.297 780 2HB LEU 97 1HB LEU 97 -9.981 -10.648 -10.728 781 HG LEU 97 HG LEU 97 -7.555 -12.212 -10.377 782 1HD1 LEU 97 1HD1 LEU 97 -9.417 -13.159 -8.389 783 2HD1 LEU 97 2HD1 LEU 97 -8.818 -11.550 -7.986 784 3HD1 LEU 97 3HD1 LEU 97 -7.682 -12.871 -8.260 785 1HD2 LEU 97 1HD2 LEU 97 -8.834 -13.756 -11.361 786 2HD2 LEU 97 2HD2 LEU 97 -10.022 -12.470 -11.569 787 3HD2 LEU 97 3HD2 LEU 97 -10.130 -13.553 -10.183 788 H LYS 98 H LYS 98 -10.214 -9.148 -12.296 789 HA LYS 98 HA LYS 98 -9.778 -10.626 -14.723 790 1HB LYS 98 2HB LYS 98 -12.006 -9.692 -13.384 791 2HB LYS 98 1HB LYS 98 -11.916 -8.636 -14.786 792 1HG LYS 98 2HG LYS 98 -12.056 -10.465 -16.286 793 2HG LYS 98 1HG LYS 98 -11.824 -11.632 -14.982 794 1HD LYS 98 2HD LYS 98 -14.078 -11.773 -15.094 795 2HD LYS 98 1HD LYS 98 -13.996 -10.345 -14.061 796 1HE LYS 98 2HE LYS 98 -14.043 -8.968 -16.181 797 2HE LYS 98 1HE LYS 98 -14.439 -10.458 -17.037 798 1HZ LYS 98 1HZ LYS 98 -16.382 -9.064 -16.377 799 2HZ LYS 98 2HZ LYS 98 -16.031 -9.417 -14.761 800 3HZ LYS 98 3HZ LYS 98 -16.448 -10.662 -15.826 801 H ASN 99 H ASN 99 -8.756 -7.631 -13.624 802 HA ASN 99 HA ASN 99 -8.858 -6.277 -16.182 803 1HB ASN 99 2HB ASN 99 -8.753 -5.390 -13.581 804 2HB ASN 99 1HB ASN 99 -7.101 -5.131 -14.131 805 1HD2 ASN 99 1HD2 ASN 99 -9.927 -3.639 -13.767 806 2HD2 ASN 99 2HD2 ASN 99 -9.853 -2.488 -15.053 807 H PHE 100 H PHE 100 -6.681 -8.307 -14.452 808 HA PHE 100 HA PHE 100 -4.598 -7.754 -16.458 809 1HB PHE 100 2HB PHE 100 -4.342 -8.414 -13.532 810 2HB PHE 100 1HB PHE 100 -3.008 -8.661 -14.655 811 HD1 PHE 100 1HD PHE 100 -1.669 -6.865 -15.369 812 HD2 PHE 100 2HD PHE 100 -5.261 -6.109 -13.218 813 HE1 PHE 100 1HE PHE 100 -1.018 -4.506 -15.121 814 HE2 PHE 100 2HE PHE 100 -4.618 -3.748 -12.966 815 HZ PHE 100 HZ PHE 100 -2.494 -2.943 -13.919 816 H THR 101 H THR 101 -3.004 -9.699 -16.543 817 HA THR 101 HA THR 101 -4.498 -11.932 -17.484 818 HB THR 101 HB THR 101 -2.086 -12.953 -17.611 819 HG1 THR 101 1HG THR 101 -0.641 -10.975 -17.860 820 1HG2 THR 101 1HG2 THR 101 -3.579 -11.132 -19.270 821 2HG2 THR 101 2HG2 THR 101 -2.554 -12.487 -19.740 822 3HG2 THR 101 3HG2 THR 101 -1.846 -10.891 -19.494 823 H ASN 102 H ASN 102 -3.089 -14.150 -16.825 824 HA ASN 102 HA ASN 102 -4.167 -14.829 -14.286 825 1HB ASN 102 2HB ASN 102 -2.434 -16.276 -16.271 826 2HB ASN 102 1HB ASN 102 -2.817 -16.989 -14.708 827 1HD2 ASN 102 1HD2 ASN 102 -5.311 -16.605 -14.216 828 2HD2 ASN 102 2HD2 ASN 102 -6.352 -17.172 -15.473 829 H THR 103 H THR 103 -1.728 -12.863 -14.709 830 HA THR 103 HA THR 103 0.198 -14.083 -12.905 831 HB THR 103 HB THR 103 1.051 -12.817 -14.828 832 HG1 THR 103 1HG THR 103 2.555 -12.648 -13.310 833 1HG2 THR 103 1HG2 THR 103 -0.905 -11.161 -14.762 834 2HG2 THR 103 2HG2 THR 103 0.690 -10.521 -15.156 835 3HG2 THR 103 3HG2 THR 103 0.028 -10.303 -13.536 836 H GLN 104 H GLN 104 -2.665 -12.751 -12.419 837 HA GLN 104 HA GLN 104 -2.119 -10.746 -10.462 838 1HB GLN 104 2HB GLN 104 -4.419 -10.569 -10.192 839 2HB GLN 104 1HB GLN 104 -4.278 -11.133 -11.850 840 1HG GLN 104 2HG GLN 104 -4.738 -12.990 -9.537 841 2HG GLN 104 1HG GLN 104 -6.051 -12.227 -10.431 842 1HE2 GLN 104 1HE2 GLN 104 -5.991 -12.559 -12.813 843 2HE2 GLN 104 2HE2 GLN 104 -5.516 -14.116 -13.390 844 H ASN 105 H ASN 105 -1.756 -14.052 -10.434 845 HA ASN 105 HA ASN 105 -2.647 -14.745 -7.849 846 1HB ASN 105 2HB ASN 105 -1.558 -16.785 -8.170 847 2HB ASN 105 1HB ASN 105 -1.904 -16.266 -9.816 848 1HD2 ASN 105 1HD2 ASN 105 -0.200 -15.407 -11.079 849 2HD2 ASN 105 2HD2 ASN 105 1.445 -15.796 -10.726 850 H LYS 106 H LYS 106 -0.146 -12.731 -8.840 851 HA LYS 106 HA LYS 106 1.543 -13.229 -6.521 852 1HB LYS 106 2HB LYS 106 1.767 -11.368 -8.882 853 2HB LYS 106 1HB LYS 106 2.876 -11.297 -7.519 854 1HG LYS 106 2HG LYS 106 3.397 -13.717 -7.947 855 2HG LYS 106 1HG LYS 106 2.474 -13.568 -9.445 856 1HD LYS 106 2HD LYS 106 3.992 -11.607 -10.006 857 2HD LYS 106 1HD LYS 106 5.006 -12.142 -8.665 858 1HE LYS 106 2HE LYS 106 4.204 -13.908 -10.970 859 2HE LYS 106 1HE LYS 106 5.703 -12.981 -10.922 860 1HZ LYS 106 1HZ LYS 106 6.452 -14.910 -10.047 861 2HZ LYS 106 2HZ LYS 106 4.946 -15.368 -9.429 862 3HZ LYS 106 3HZ LYS 106 5.886 -14.225 -8.607 863 H VAL 107 H VAL 107 -1.295 -11.819 -6.794 864 HA VAL 107 HA VAL 107 -0.687 -9.331 -5.403 865 HB VAL 107 HB VAL 107 -2.466 -9.595 -7.261 866 1HG1 VAL 107 1HG1 VAL 107 -4.033 -10.605 -4.888 867 2HG1 VAL 107 2HG1 VAL 107 -3.633 -11.517 -6.344 868 3HG1 VAL 107 3HG1 VAL 107 -4.719 -10.132 -6.442 869 1HG2 VAL 107 1HG2 VAL 107 -2.190 -7.864 -5.064 870 2HG2 VAL 107 2HG2 VAL 107 -3.917 -8.184 -5.236 871 3HG2 VAL 107 3HG2 VAL 107 -2.999 -7.546 -6.600 872 H LEU 108 H LEU 108 -1.373 -8.827 -3.333 873 HA LEU 108 HA LEU 108 -2.289 -11.107 -1.706 874 1HB LEU 108 2HB LEU 108 -0.265 -8.969 -1.095 875 2HB LEU 108 1HB LEU 108 -1.050 -9.881 0.180 876 HG LEU 108 HG LEU 108 -0.180 -11.926 -1.322 877 1HD1 LEU 108 1HD1 LEU 108 2.094 -11.420 -2.109 878 2HD1 LEU 108 2HD1 LEU 108 1.812 -9.711 -1.775 879 3HD1 LEU 108 3HD1 LEU 108 0.860 -10.538 -3.007 880 1HD2 LEU 108 1HD2 LEU 108 0.691 -12.280 0.689 881 2HD2 LEU 108 2HD2 LEU 108 0.682 -10.556 1.057 882 3HD2 LEU 108 3HD2 LEU 108 2.056 -11.270 0.214 883 H LYS 109 H LYS 109 -3.699 -10.644 0.040 884 HA LYS 109 HA LYS 109 -5.040 -8.029 -0.169 885 1HB LYS 109 2HB LYS 109 -6.266 -10.185 -0.948 886 2HB LYS 109 1HB LYS 109 -6.440 -10.513 0.770 887 1HG LYS 109 2HG LYS 109 -8.091 -9.040 0.985 888 2HG LYS 109 1HG LYS 109 -7.216 -7.802 0.082 889 1HD LYS 109 2HD LYS 109 -9.107 -8.215 -1.224 890 2HD LYS 109 1HD LYS 109 -7.842 -9.169 -2.001 891 1HE LYS 109 2HE LYS 109 -9.244 -10.898 -1.849 892 2HE LYS 109 1HE LYS 109 -8.883 -10.897 -0.123 893 1HZ LYS 109 1HZ LYS 109 -11.203 -10.838 -0.281 894 2HZ LYS 109 2HZ LYS 109 -11.194 -9.671 -1.505 895 3HZ LYS 109 3HZ LYS 109 -10.766 -9.243 0.074 896 H ILE 110 H ILE 110 -5.690 -7.010 1.706 897 HA ILE 110 HA ILE 110 -4.177 -7.673 4.059 898 HB ILE 110 HB ILE 110 -4.818 -5.318 3.143 899 1HG1 ILE 110 2HG1 ILE 110 -4.967 -4.539 5.656 900 2HG1 ILE 110 1HG1 ILE 110 -4.642 -6.240 5.983 901 1HG2 ILE 110 1HG2 ILE 110 -6.865 -4.487 3.497 902 2HG2 ILE 110 2HG2 ILE 110 -7.012 -5.253 5.080 903 3HG2 ILE 110 3HG2 ILE 110 -7.352 -6.177 3.617 904 1HD1 ILE 110 1HD1 ILE 110 -2.488 -5.911 5.633 905 2HD1 ILE 110 2HD1 ILE 110 -2.809 -4.197 5.366 906 3HD1 ILE 110 3HD1 ILE 110 -2.815 -5.319 4.005 907 H THR 111 H THR 111 -7.276 -8.443 2.871 908 HA THR 111 HA THR 111 -8.753 -8.680 5.247 909 HB THR 111 HB THR 111 -10.180 -10.270 4.018 910 HG1 THR 111 1HG THR 111 -7.913 -10.584 2.557 911 1HG2 THR 111 1HG2 THR 111 -10.459 -7.852 3.651 912 2HG2 THR 111 2HG2 THR 111 -10.854 -8.783 2.207 913 3HG2 THR 111 3HG2 THR 111 -9.312 -7.932 2.312 914 H ASP 112 H ASP 112 -6.270 -10.651 3.844 915 HA ASP 112 HA ASP 112 -6.822 -12.965 5.473 916 1HB ASP 112 2HB ASP 112 -4.696 -12.219 3.494 917 2HB ASP 112 1HB ASP 112 -4.457 -13.601 4.557 918 H PHE 113 H PHE 113 -4.892 -10.092 5.683 919 HA PHE 113 HA PHE 113 -3.313 -11.125 7.903 920 1HB PHE 113 2HB PHE 113 -3.310 -8.490 6.428 921 2HB PHE 113 1HB PHE 113 -2.341 -8.771 7.867 922 HD1 PHE 113 1HD PHE 113 -1.946 -11.820 6.885 923 HD2 PHE 113 2HD PHE 113 -1.225 -7.962 5.237 924 HE1 PHE 113 1HE PHE 113 -0.154 -12.757 5.485 925 HE2 PHE 113 2HE PHE 113 0.568 -8.893 3.835 926 HZ PHE 113 HZ PHE 113 1.106 -11.292 3.957 927 H SER 114 H SER 114 -5.198 -8.147 7.407 928 HA SER 114 HA SER 114 -5.496 -7.385 10.020 929 1HB SER 114 2HB SER 114 -7.041 -5.858 9.262 930 2HB SER 114 1HB SER 114 -6.313 -6.324 7.726 931 HG SER 114 HG SER 114 -8.843 -6.809 8.707 932 HA PRO 115 HA PRO 115 -8.242 -10.543 11.564 933 1HB PRO 115 2HB PRO 115 -8.104 -9.863 14.165 934 2HB PRO 115 1HB PRO 115 -6.756 -10.624 13.318 935 1HG PRO 115 2HG PRO 115 -7.079 -7.830 14.213 936 2HG PRO 115 1HG PRO 115 -5.599 -8.757 13.927 937 1HD PRO 115 2HD PRO 115 -6.838 -6.854 12.193 938 2HD PRO 115 1HD PRO 115 -5.396 -7.836 11.875 939 H SER 116 H SER 116 -8.873 -8.018 13.910 940 HA SER 116 HA SER 116 -11.702 -8.128 13.241 941 1HB SER 116 2HB SER 116 -10.107 -7.387 15.613 942 2HB SER 116 1HB SER 116 -11.561 -6.423 15.357 943 HG SER 116 HG SER 116 -11.412 -9.252 15.540 944 H LEU 117 H LEU 117 -9.541 -6.627 11.678 945 HA LEU 117 HA LEU 117 -10.142 -3.855 11.977 946 1HB LEU 117 2HB LEU 117 -8.281 -5.415 10.559 947 2HB LEU 117 1HB LEU 117 -9.181 -4.526 9.346 948 HG LEU 117 HG LEU 117 -8.613 -2.411 10.476 949 1HD1 LEU 117 1HD1 LEU 117 -7.234 -2.268 12.348 950 2HD1 LEU 117 2HD1 LEU 117 -6.699 -3.942 12.201 951 3HD1 LEU 117 3HD1 LEU 117 -8.338 -3.585 12.742 952 1HD2 LEU 117 1HD2 LEU 117 -6.929 -4.072 8.976 953 2HD2 LEU 117 2HD2 LEU 117 -5.920 -3.380 10.247 954 3HD2 LEU 117 3HD2 LEU 117 -6.824 -2.322 9.165 955 H ASN 118 H ASN 118 -11.094 -6.324 9.598 956 HA ASN 118 HA ASN 118 -12.631 -6.229 7.878 957 1HB ASN 118 2HB ASN 118 -13.992 -5.770 10.479 958 2HB ASN 118 1HB ASN 118 -14.958 -5.556 9.023 959 1HD2 ASN 118 1HD2 ASN 118 -14.477 -7.411 7.364 960 2HD2 ASN 118 2HD2 ASN 118 -14.583 -9.003 8.030 961 H TYR 119 H TYR 119 -11.199 -4.020 7.492 962 HA TYR 119 HA TYR 119 -12.961 -1.710 7.457 963 1HB TYR 119 2HB TYR 119 -11.096 -0.429 7.313 964 2HB TYR 119 1HB TYR 119 -10.318 -1.883 7.918 965 HD1 TYR 119 1HD TYR 119 -9.824 -3.596 5.740 966 HD2 TYR 119 2HD TYR 119 -9.857 0.661 5.737 967 HE1 TYR 119 1HE TYR 119 -8.321 -3.589 3.787 968 HE2 TYR 119 2HE TYR 119 -8.361 0.677 3.787 969 HH TYR 119 HH TYR 119 -6.503 -1.400 2.875 970 H ASP 120 H ASP 120 -13.131 -0.398 5.468 971 HA ASP 120 HA ASP 120 -13.789 -2.127 3.211 972 1HB ASP 120 2HB ASP 120 -15.238 -0.179 4.291 973 2HB ASP 120 1HB ASP 120 -14.296 0.816 3.187 974 H GLU 121 H GLU 121 -13.541 0.413 1.505 975 HA GLU 121 HA GLU 121 -10.787 -0.100 0.717 976 1HB GLU 121 2HB GLU 121 -13.212 0.795 -0.614 977 2HB GLU 121 1HB GLU 121 -11.833 1.805 -1.020 978 1HG GLU 121 2HG GLU 121 -10.677 0.063 -2.004 979 2HG GLU 121 1HG GLU 121 -11.609 -1.169 -1.153 980 H VAL 122 H VAL 122 -9.449 0.968 2.072 981 HA VAL 122 HA VAL 122 -8.210 2.706 2.861 982 HB VAL 122 HB VAL 122 -9.988 4.447 1.143 983 1HG1 VAL 122 1HG1 VAL 122 -8.647 6.243 1.591 984 2HG1 VAL 122 2HG1 VAL 122 -7.251 5.242 1.991 985 3HG1 VAL 122 3HG1 VAL 122 -8.574 5.411 3.144 986 1HG2 VAL 122 1HG2 VAL 122 -8.010 2.579 0.412 987 2HG2 VAL 122 2HG2 VAL 122 -7.308 4.180 0.186 988 3HG2 VAL 122 3HG2 VAL 122 -8.822 3.760 -0.615 989 HA PRO 123 HA PRO 123 -10.623 3.771 6.428 990 1HB PRO 123 2HB PRO 123 -8.395 5.549 7.162 991 2HB PRO 123 1HB PRO 123 -9.012 4.121 7.996 992 1HG PRO 123 2HG PRO 123 -6.649 4.095 6.732 993 2HG PRO 123 1HG PRO 123 -7.707 2.671 6.762 994 1HD PRO 123 2HD PRO 123 -7.296 4.681 4.576 995 2HD PRO 123 1HD PRO 123 -7.424 2.912 4.469 996 H ASP 124 H ASP 124 -9.665 6.485 7.555 997 HA ASP 124 HA ASP 124 -10.325 8.653 7.568 998 1HB ASP 124 2HB ASP 124 -9.736 9.644 5.655 999 2HB ASP 124 1HB ASP 124 -9.799 8.093 4.823 1000 HA PRO 125 HA PRO 125 -14.644 8.586 8.318 1001 1HB PRO 125 2HB PRO 125 -15.372 11.181 7.885 1002 2HB PRO 125 1HB PRO 125 -14.503 10.631 9.321 1003 1HG PRO 125 2HG PRO 125 -13.430 11.917 6.837 1004 2HG PRO 125 1HG PRO 125 -13.022 12.245 8.533 1005 1HD PRO 125 2HD PRO 125 -11.438 10.740 6.972 1006 2HD PRO 125 1HD PRO 125 -11.660 10.376 8.697 1007 H TRP 126 H TRP 126 -13.584 9.838 5.231 1008 HA TRP 126 HA TRP 126 -16.155 10.037 4.050 1009 1HB TRP 126 2HB TRP 126 -14.217 11.227 3.142 1010 2HB TRP 126 1HB TRP 126 -13.454 9.692 2.733 1011 HD1 TRP 126 HD TRP 126 -13.608 9.305 0.214 1012 HE1 TRP 126 1HE TRP 126 -15.374 9.696 -1.619 1013 HE3 TRP 126 3HE TRP 126 -17.248 11.511 3.048 1014 HZ2 TRP 126 2HZ TRP 126 -17.965 10.795 -1.833 1015 HZ3 TRP 126 3HZ TRP 126 -19.339 12.203 1.952 1016 HH2 TRP 126 HH TRP 126 -19.688 11.852 -0.438 1017 H TYR 127 H TYR 127 -14.054 7.366 4.669 1018 HA TYR 127 HA TYR 127 -15.729 5.659 2.948 1019 1HB TYR 127 2HB TYR 127 -12.908 5.189 3.927 1020 2HB TYR 127 1HB TYR 127 -13.851 4.042 2.983 1021 HD1 TYR 127 1HD TYR 127 -15.038 5.574 0.875 1022 HD2 TYR 127 2HD TYR 127 -11.187 6.021 2.636 1023 HE1 TYR 127 1HE TYR 127 -14.211 6.596 -1.202 1024 HE2 TYR 127 2HE TYR 127 -10.352 7.048 0.563 1025 HH TYR 127 HH TYR 127 -12.488 7.522 -2.239 1026 H SER 128 H SER 128 -14.594 6.225 6.179 1027 HA SER 128 HA SER 128 -16.086 3.852 7.091 1028 1HB SER 128 2HB SER 128 -14.031 5.067 8.865 1029 2HB SER 128 1HB SER 128 -14.493 3.376 8.668 1030 HG SER 128 HG SER 128 -12.982 4.912 6.819 1031 H GLY 129 H GLY 129 -14.970 7.034 8.276 1032 1HA GLY 129 2HA GLY 129 -16.960 8.552 8.780 1033 2HA GLY 129 1HA GLY 129 -17.488 7.224 9.801 1034 H ASN 130 H ASN 130 -14.140 7.435 9.849 1035 HA ASN 130 HA ASN 130 -14.035 9.408 11.991 1036 1HB ASN 130 2HB ASN 130 -14.549 6.994 12.863 1037 2HB ASN 130 1HB ASN 130 -12.839 6.717 12.547 1038 1HD2 ASN 130 1HD2 ASN 130 -11.346 8.323 13.515 1039 2HD2 ASN 130 2HD2 ASN 130 -11.714 8.901 15.102 1040 H PHE 131 H PHE 131 -11.996 10.266 12.360 1041 HA PHE 131 HA PHE 131 -10.138 10.021 10.179 1042 1HB PHE 131 2HB PHE 131 -9.884 11.587 12.758 1043 2HB PHE 131 1HB PHE 131 -8.889 11.787 11.320 1044 HD1 PHE 131 1HD PHE 131 -9.635 13.070 9.472 1045 HD2 PHE 131 2HD PHE 131 -12.267 12.244 12.713 1046 HE1 PHE 131 1HE PHE 131 -11.224 14.736 8.603 1047 HE2 PHE 131 2HE PHE 131 -13.861 13.907 11.850 1048 HZ PHE 131 HZ PHE 131 -13.340 15.156 9.792 1049 H ASP 132 H ASP 132 -10.146 9.244 13.619 1050 HA ASP 132 HA ASP 132 -7.517 8.312 13.868 1051 1HB ASP 132 2HB ASP 132 -8.147 7.946 15.995 1052 2HB ASP 132 1HB ASP 132 -9.745 8.527 15.537 1053 H GLU 133 H GLU 133 -10.250 6.961 12.293 1054 HA GLU 133 HA GLU 133 -9.735 4.231 12.426 1055 1HB GLU 133 2HB GLU 133 -11.761 4.782 11.410 1056 2HB GLU 133 1HB GLU 133 -11.027 6.005 10.382 1057 1HG GLU 133 2HG GLU 133 -11.116 4.521 8.744 1058 2HG GLU 133 1HG GLU 133 -9.825 3.651 9.572 1059 H THR 134 H THR 134 -8.376 6.730 10.340 1060 HA THR 134 HA THR 134 -6.870 5.094 8.638 1061 HB THR 134 HB THR 134 -5.583 7.633 9.378 1062 HG1 THR 134 1HG THR 134 -8.229 7.613 8.305 1063 1HG2 THR 134 1HG2 THR 134 -6.324 7.764 6.748 1064 2HG2 THR 134 2HG2 THR 134 -6.188 6.025 7.005 1065 3HG2 THR 134 3HG2 THR 134 -4.812 7.075 7.340 1066 H TYR 135 H TYR 135 -6.313 6.249 11.884 1067 HA TYR 135 HA TYR 135 -3.564 5.657 12.093 1068 1HB TYR 135 2HB TYR 135 -4.318 7.024 13.808 1069 2HB TYR 135 1HB TYR 135 -5.796 6.102 14.035 1070 HD1 TYR 135 1HD TYR 135 -5.913 4.360 15.643 1071 HD2 TYR 135 2HD TYR 135 -2.156 6.120 14.706 1072 HE1 TYR 135 1HE TYR 135 -4.902 3.213 17.569 1073 HE2 TYR 135 2HE TYR 135 -1.133 4.979 16.628 1074 HH TYR 135 HH TYR 135 -2.874 2.581 18.480 1075 H LYS 136 H LYS 136 -6.363 3.837 13.346 1076 HA LYS 136 HA LYS 136 -4.944 1.574 14.147 1077 1HB LYS 136 2HB LYS 136 -7.525 2.374 14.343 1078 2HB LYS 136 1HB LYS 136 -7.677 1.101 13.140 1079 1HG LYS 136 2HG LYS 136 -8.035 0.036 15.186 1080 2HG LYS 136 1HG LYS 136 -6.370 -0.364 14.761 1081 1HD LYS 136 2HD LYS 136 -6.240 0.224 17.017 1082 2HD LYS 136 1HD LYS 136 -5.734 1.689 16.173 1083 1HE LYS 136 2HE LYS 136 -7.536 2.856 16.854 1084 2HE LYS 136 1HE LYS 136 -8.622 1.479 16.672 1085 1HZ LYS 136 1HZ LYS 136 -7.089 0.758 18.775 1086 2HZ LYS 136 2HZ LYS 136 -8.622 1.464 18.889 1087 3HZ LYS 136 3HZ LYS 136 -7.237 2.428 19.009 1088 H ILE 137 H ILE 137 -6.655 2.155 11.084 1089 HA ILE 137 HA ILE 137 -6.158 -0.352 9.942 1090 HB ILE 137 HB ILE 137 -6.513 2.257 8.475 1091 1HG1 ILE 137 2HG1 ILE 137 -8.317 1.819 10.116 1092 2HG1 ILE 137 1HG1 ILE 137 -8.892 1.753 8.453 1093 1HG2 ILE 137 1HG2 ILE 137 -7.639 -0.074 7.216 1094 2HG2 ILE 137 2HG2 ILE 137 -5.914 -0.293 7.512 1095 3HG2 ILE 137 3HG2 ILE 137 -6.481 1.096 6.583 1096 1HD1 ILE 137 1HD1 ILE 137 -8.615 -0.758 8.618 1097 2HD1 ILE 137 2HD1 ILE 137 -9.920 -0.034 9.556 1098 3HD1 ILE 137 3HD1 ILE 137 -8.422 -0.514 10.355 1099 H LEU 138 H LEU 138 -4.529 2.715 9.083 1100 HA LEU 138 HA LEU 138 -2.580 1.579 7.472 1101 1HB LEU 138 2HB LEU 138 -2.983 4.158 8.810 1102 2HB LEU 138 1HB LEU 138 -1.313 3.782 8.438 1103 HG LEU 138 HG LEU 138 -1.708 3.734 6.124 1104 1HD1 LEU 138 1HD1 LEU 138 -4.369 4.184 5.604 1105 2HD1 LEU 138 2HD1 LEU 138 -4.414 3.014 6.922 1106 3HD1 LEU 138 3HD1 LEU 138 -3.531 2.641 5.442 1107 1HD2 LEU 138 1HD2 LEU 138 -3.487 5.899 7.233 1108 2HD2 LEU 138 2HD2 LEU 138 -2.735 5.878 5.638 1109 3HD2 LEU 138 3HD2 LEU 138 -1.732 5.987 7.085 1110 H SER 139 H SER 139 -2.282 2.454 10.925 1111 HA SER 139 HA SER 139 0.382 1.732 11.244 1112 1HB SER 139 2HB SER 139 -1.023 2.945 12.924 1113 2HB SER 139 1HB SER 139 -1.772 1.403 13.340 1114 HG SER 139 HG SER 139 0.624 2.415 14.102 1115 H LEU 140 H LEU 140 -2.499 -0.278 11.849 1116 HA LEU 140 HA LEU 140 -1.073 -2.610 12.537 1117 1HB LEU 140 2HB LEU 140 -3.671 -1.861 12.643 1118 2HB LEU 140 1HB LEU 140 -3.715 -2.943 11.265 1119 HG LEU 140 HG LEU 140 -2.263 -4.303 13.252 1120 1HD1 LEU 140 1HD1 LEU 140 -2.955 -3.314 15.148 1121 2HD1 LEU 140 2HD1 LEU 140 -4.426 -4.247 14.867 1122 3HD1 LEU 140 3HD1 LEU 140 -4.345 -2.556 14.370 1123 1HD2 LEU 140 1HD2 LEU 140 -4.182 -4.863 11.443 1124 2HD2 LEU 140 2HD2 LEU 140 -5.126 -4.918 12.933 1125 3HD2 LEU 140 3HD2 LEU 140 -3.712 -5.955 12.746 1126 H ALA 141 H ALA 141 -2.740 -1.769 9.505 1127 HA ALA 141 HA ALA 141 -2.075 -4.021 8.042 1128 1HB ALA 141 1HB ALA 141 -2.866 -2.914 6.184 1129 2HB ALA 141 2HB ALA 141 -2.210 -1.361 6.697 1130 3HB ALA 141 3HB ALA 141 -3.640 -2.019 7.492 1131 H CYS 142 H CYS 142 -0.308 -0.924 8.175 1132 HA CYS 142 HA CYS 142 1.733 -1.655 6.391 1133 1HB CYS 142 2HB CYS 142 1.129 0.573 8.073 1134 2HB CYS 142 1HB CYS 142 2.811 0.126 8.330 1135 HG CYS 142 HG CYS 142 3.477 1.701 6.401 1136 H LYS 143 H LYS 143 1.422 -2.087 9.884 1137 HA LYS 143 HA LYS 143 4.060 -2.907 10.401 1138 1HB LYS 143 2HB LYS 143 1.681 -2.628 11.875 1139 2HB LYS 143 1HB LYS 143 2.174 -4.304 12.080 1140 1HG LYS 143 2HG LYS 143 4.072 -2.016 12.497 1141 2HG LYS 143 1HG LYS 143 3.026 -2.625 13.781 1142 1HD LYS 143 2HD LYS 143 4.693 -4.056 14.223 1143 2HD LYS 143 1HD LYS 143 4.150 -4.923 12.785 1144 1HE LYS 143 2HE LYS 143 6.084 -4.506 11.780 1145 2HE LYS 143 1HE LYS 143 5.824 -2.772 11.964 1146 1HZ LYS 143 1HZ LYS 143 7.815 -3.164 13.057 1147 2HZ LYS 143 2HZ LYS 143 7.286 -4.616 13.746 1148 3HZ LYS 143 3HZ LYS 143 6.695 -3.140 14.324 1149 H ASN 144 H ASN 144 1.165 -4.981 10.141 1150 HA ASN 144 HA ASN 144 2.503 -7.417 10.037 1151 1HB ASN 144 2HB ASN 144 -0.125 -6.679 8.729 1152 2HB ASN 144 1HB ASN 144 0.437 -8.319 9.036 1153 1HD2 ASN 144 1HD2 ASN 144 -1.689 -8.345 10.150 1154 2HD2 ASN 144 2HD2 ASN 144 -1.728 -7.871 11.811 1155 H LEU 145 H LEU 145 1.551 -5.236 7.427 1156 HA LEU 145 HA LEU 145 2.313 -6.852 5.268 1157 1HB LEU 145 2HB LEU 145 0.950 -4.871 4.955 1158 2HB LEU 145 1HB LEU 145 2.250 -3.844 5.528 1159 HG LEU 145 HG LEU 145 3.591 -4.748 3.523 1160 1HD1 LEU 145 1HD1 LEU 145 0.814 -5.663 2.866 1161 2HD1 LEU 145 2HD1 LEU 145 2.331 -6.559 2.769 1162 3HD1 LEU 145 3HD1 LEU 145 1.985 -5.282 1.603 1163 1HD2 LEU 145 1HD2 LEU 145 2.565 -2.455 3.817 1164 2HD2 LEU 145 2HD2 LEU 145 1.206 -3.039 2.858 1165 3HD2 LEU 145 3HD2 LEU 145 2.822 -2.981 2.154 1166 H LEU 146 H LEU 146 4.130 -4.619 7.291 1167 HA LEU 146 HA LEU 146 6.511 -4.608 5.772 1168 1HB LEU 146 2HB LEU 146 5.588 -3.376 8.092 1169 2HB LEU 146 1HB LEU 146 6.939 -4.352 8.634 1170 HG LEU 146 HG LEU 146 7.699 -2.945 6.255 1171 1HD1 LEU 146 1HD1 LEU 146 6.351 -1.138 6.519 1172 2HD1 LEU 146 2HD1 LEU 146 7.626 -0.676 7.647 1173 3HD1 LEU 146 3HD1 LEU 146 6.138 -1.409 8.249 1174 1HD2 LEU 146 1HD2 LEU 146 8.807 -3.783 8.642 1175 2HD2 LEU 146 2HD2 LEU 146 8.845 -2.023 8.757 1176 3HD2 LEU 146 3HD2 LEU 146 9.612 -2.834 7.392 1177 H VAL 147 H VAL 147 5.253 -6.729 8.266 1178 HA VAL 147 HA VAL 147 7.604 -8.170 8.817 1179 HB VAL 147 HB VAL 147 4.770 -9.213 8.920 1180 1HG1 VAL 147 1HG1 VAL 147 5.594 -10.780 10.553 1181 2HG1 VAL 147 2HG1 VAL 147 7.201 -10.058 10.491 1182 3HG1 VAL 147 3HG1 VAL 147 6.565 -10.914 9.087 1183 1HG2 VAL 147 1HG2 VAL 147 5.969 -8.336 11.425 1184 2HG2 VAL 147 2HG2 VAL 147 4.369 -8.008 10.759 1185 3HG2 VAL 147 3HG2 VAL 147 5.748 -7.024 10.268 1186 H PHE 148 H PHE 148 4.863 -9.039 6.699 1187 HA PHE 148 HA PHE 148 6.109 -11.316 5.587 1188 1HB PHE 148 2HB PHE 148 3.591 -10.337 5.526 1189 2HB PHE 148 1HB PHE 148 4.135 -9.872 3.919 1190 HD1 PHE 148 1HD PHE 148 4.592 -11.523 2.234 1191 HD2 PHE 148 2HD PHE 148 3.402 -12.678 6.153 1192 HE1 PHE 148 1HE PHE 148 4.149 -13.805 1.424 1193 HE2 PHE 148 2HE PHE 148 2.959 -14.961 5.351 1194 HZ PHE 148 HZ PHE 148 3.332 -15.527 2.983 1195 H LEU 149 H LEU 149 5.981 -7.943 4.566 1196 HA LEU 149 HA LEU 149 7.190 -8.316 2.037 1197 1HB LEU 149 2HB LEU 149 6.277 -6.261 1.986 1198 2HB LEU 149 1HB LEU 149 6.381 -6.076 3.726 1199 HG LEU 149 HG LEU 149 8.929 -5.651 3.233 1200 1HD1 LEU 149 1HD1 LEU 149 8.404 -4.197 0.883 1201 2HD1 LEU 149 2HD1 LEU 149 7.826 -5.840 0.606 1202 3HD1 LEU 149 3HD1 LEU 149 9.498 -5.563 1.095 1203 1HD2 LEU 149 1HD2 LEU 149 7.334 -3.338 2.372 1204 2HD2 LEU 149 2HD2 LEU 149 8.475 -3.502 3.707 1205 3HD2 LEU 149 3HD2 LEU 149 6.821 -4.087 3.884 1206 H SER 150 H SER 150 8.472 -8.041 5.254 1207 HA SER 150 HA SER 150 11.165 -7.487 4.360 1208 1HB SER 150 2HB SER 150 11.771 -7.532 6.701 1209 2HB SER 150 1HB SER 150 10.274 -6.617 6.524 1210 HG SER 150 HG SER 150 9.354 -8.001 7.790 1211 H LYS 151 H LYS 151 10.289 -9.741 3.099 1212 HA LYS 151 HA LYS 151 10.797 -11.910 2.644 1213 1HB LYS 151 2HB LYS 151 13.099 -10.693 2.930 1214 2HB LYS 151 1HB LYS 151 13.227 -11.683 4.378 1215 1HG LYS 151 2HG LYS 151 13.535 -13.592 3.211 1216 2HG LYS 151 1HG LYS 151 12.474 -13.089 1.894 1217 1HD LYS 151 2HD LYS 151 14.153 -12.100 0.740 1218 2HD LYS 151 1HD LYS 151 14.978 -11.557 2.203 1219 1HE LYS 151 2HE LYS 151 15.640 -13.956 2.585 1220 2HE LYS 151 1HE LYS 151 15.024 -14.303 0.970 1221 1HZ LYS 151 1HZ LYS 151 17.476 -13.018 1.764 1222 2HZ LYS 151 2HZ LYS 151 16.649 -12.194 0.540 1223 3HZ LYS 151 3HZ LYS 151 17.088 -13.812 0.321 1224 H HIS 152 H HIS 152 8.944 -12.519 4.011 1225 HA HIS 152 HA HIS 152 9.788 -13.913 6.465 1226 1HB HIS 152 2HB HIS 152 7.711 -12.090 6.103 1227 2HB HIS 152 1HB HIS 152 6.912 -13.659 6.137 1228 HD1 HIS 152 1HD HIS 152 9.767 -12.210 8.209 1229 HD2 HIS 152 2HD HIS 152 6.076 -14.063 8.668 1230 HE1 HIS 152 1HE HIS 152 9.450 -12.473 10.690 1231 HE2 HIS 152 2HE HIS 152 7.225 -13.628 10.943 1232 H HIS 153 H HIS 153 9.853 -14.773 3.581 1233 HA HIS 153 HA HIS 153 8.304 -17.257 3.915 1234 1HB HIS 153 2HB HIS 153 8.074 -17.299 1.425 1235 2HB HIS 153 1HB HIS 153 7.223 -15.962 2.191 1236 HD1 HIS 153 1HD HIS 153 10.677 -16.481 0.661 1237 HD2 HIS 153 2HD HIS 153 7.642 -13.651 0.870 1238 HE1 HIS 153 1HE HIS 153 11.459 -14.553 -0.749 1239 HE2 HIS 153 2HE HIS 153 9.647 -12.816 -0.535 1240 H HIS 154 H HIS 154 9.281 -18.589 1.674 1241 HA HIS 154 HA HIS 154 12.111 -18.943 2.407 1242 1HB HIS 154 2HB HIS 154 11.722 -21.264 1.329 1243 2HB HIS 154 1HB HIS 154 11.061 -20.966 2.931 1244 HD1 HIS 154 1HD HIS 154 8.511 -20.943 3.173 1245 HD2 HIS 154 2HD HIS 154 9.808 -21.491 -0.736 1246 HE1 HIS 154 1HE HIS 154 6.471 -21.638 1.879 1247 HE2 HIS 154 2HE HIS 154 7.294 -22.033 -0.470 1248 H HIS 155 H HIS 155 13.623 -18.595 0.913 1249 HA HIS 155 HA HIS 155 12.790 -17.851 -1.770 1250 1HB HIS 155 2HB HIS 155 15.084 -17.056 -2.051 1251 2HB HIS 155 1HB HIS 155 14.389 -16.424 -0.562 1252 HD1 HIS 155 1HD HIS 155 14.938 -18.618 1.418 1253 HD2 HIS 155 2HD HIS 155 17.693 -17.460 -1.469 1254 HE1 HIS 155 1HE HIS 155 17.179 -19.343 2.299 1255 HE2 HIS 155 2HE HIS 155 18.839 -18.552 0.576 1256 H HIS 156 H HIS 156 14.432 -18.542 -3.557 1257 HA HIS 156 HA HIS 156 15.523 -21.187 -3.289 1258 1HB HIS 156 2HB HIS 156 14.069 -22.056 -5.221 1259 2HB HIS 156 1HB HIS 156 13.334 -21.979 -3.622 1260 HD1 HIS 156 1HD HIS 156 13.692 -19.183 -6.171 1261 HD2 HIS 156 2HD HIS 156 10.752 -21.363 -4.203 1262 HE1 HIS 156 1HE HIS 156 11.511 -18.117 -6.829 1263 HE2 HIS 156 2HE HIS 156 9.748 -19.423 -5.590 Start of MODEL 2 1 1H MET 1 1HT MET 1 16.500 -8.942 -7.167 2 2H MET 1 2HT MET 1 16.552 -7.407 -6.459 3 3H MET 1 3HT MET 1 17.605 -7.788 -7.726 4 HA MET 1 HA MET 1 15.756 -6.375 -8.446 5 1HB MET 1 2HB MET 1 15.729 -9.180 -9.577 6 2HB MET 1 1HB MET 1 15.221 -7.720 -10.414 7 1HG MET 1 2HG MET 1 17.282 -7.343 -11.106 8 2HG MET 1 1HG MET 1 17.887 -7.379 -9.451 9 1HE MET 1 1HE MET 1 16.103 -10.309 -11.392 10 2HE MET 1 2HE MET 1 17.487 -11.127 -12.115 11 3HE MET 1 3HE MET 1 17.052 -9.500 -12.640 12 H LYS 2 H LYS 2 14.591 -6.903 -6.093 13 HA LYS 2 HA LYS 2 12.098 -8.340 -6.659 14 1HB LYS 2 2HB LYS 2 13.432 -7.459 -4.109 15 2HB LYS 2 1HB LYS 2 11.745 -7.952 -4.139 16 1HG LYS 2 2HG LYS 2 13.531 -9.848 -5.453 17 2HG LYS 2 1HG LYS 2 13.884 -9.605 -3.740 18 1HD LYS 2 2HD LYS 2 11.539 -10.083 -3.199 19 2HD LYS 2 1HD LYS 2 11.202 -10.344 -4.911 20 1HE LYS 2 2HE LYS 2 13.166 -11.931 -3.259 21 2HE LYS 2 1HE LYS 2 11.532 -12.451 -3.670 22 1HZ LYS 2 1HZ LYS 2 13.755 -12.970 -5.122 23 2HZ LYS 2 2HZ LYS 2 13.087 -11.658 -5.954 24 3HZ LYS 2 3HZ LYS 2 12.169 -13.057 -5.705 25 H LYS 3 H LYS 3 10.414 -7.191 -7.315 26 HA LYS 3 HA LYS 3 10.170 -4.404 -6.392 27 1HB LYS 3 2HB LYS 3 9.943 -5.588 -9.088 28 2HB LYS 3 1HB LYS 3 8.705 -4.410 -8.673 29 1HG LYS 3 2HG LYS 3 10.752 -2.970 -7.917 30 2HG LYS 3 1HG LYS 3 11.640 -4.042 -9.002 31 1HD LYS 3 2HD LYS 3 9.119 -2.769 -9.963 32 2HD LYS 3 1HD LYS 3 10.592 -1.800 -9.882 33 1HE LYS 3 2HE LYS 3 10.107 -4.312 -11.465 34 2HE LYS 3 1HE LYS 3 10.480 -2.701 -12.075 35 1HZ LYS 3 1HZ LYS 3 12.434 -4.043 -12.196 36 2HZ LYS 3 2HZ LYS 3 12.300 -4.501 -10.573 37 3HZ LYS 3 3HZ LYS 3 12.669 -2.899 -10.971 38 H ILE 4 H ILE 4 8.427 -3.973 -5.229 39 HA ILE 4 HA ILE 4 6.147 -5.838 -5.380 40 HB ILE 4 HB ILE 4 6.870 -4.016 -3.082 41 1HG1 ILE 4 2HG1 ILE 4 7.232 -6.442 -2.053 42 2HG1 ILE 4 1HG1 ILE 4 7.603 -6.833 -3.729 43 1HG2 ILE 4 1HG2 ILE 4 4.759 -6.125 -3.457 44 2HG2 ILE 4 2HG2 ILE 4 4.540 -4.422 -3.057 45 3HG2 ILE 4 3HG2 ILE 4 5.242 -5.523 -1.872 46 1HD1 ILE 4 1HD1 ILE 4 9.413 -5.972 -1.938 47 2HD1 ILE 4 2HD1 ILE 4 8.933 -4.439 -2.667 48 3HD1 ILE 4 3HD1 ILE 4 9.561 -5.738 -3.679 49 H LEU 5 H LEU 5 4.661 -4.984 -6.706 50 HA LEU 5 HA LEU 5 4.271 -2.125 -6.871 51 1HB LEU 5 2HB LEU 5 3.751 -4.374 -8.534 52 2HB LEU 5 1HB LEU 5 2.234 -3.541 -8.259 53 HG LEU 5 HG LEU 5 4.749 -2.351 -9.430 54 1HD1 LEU 5 1HD1 LEU 5 2.677 -1.961 -11.179 55 2HD1 LEU 5 2HD1 LEU 5 2.345 -3.570 -10.538 56 3HD1 LEU 5 3HD1 LEU 5 3.899 -3.227 -11.299 57 1HD2 LEU 5 1HD2 LEU 5 4.007 -0.370 -8.752 58 2HD2 LEU 5 2HD2 LEU 5 2.546 -1.091 -8.075 59 3HD2 LEU 5 3HD2 LEU 5 2.588 -0.608 -9.772 60 H PHE 6 H PHE 6 3.038 -1.081 -5.452 61 HA PHE 6 HA PHE 6 0.914 -2.492 -4.031 62 1HB PHE 6 2HB PHE 6 2.180 0.229 -3.695 63 2HB PHE 6 1HB PHE 6 0.722 -0.230 -2.828 64 HD1 PHE 6 1HD PHE 6 3.216 0.629 -1.499 65 HD2 PHE 6 2HD PHE 6 1.918 -3.249 -2.680 66 HE1 PHE 6 1HE PHE 6 4.594 -0.369 0.273 67 HE2 PHE 6 2HE PHE 6 3.295 -4.250 -0.909 68 HZ PHE 6 HZ PHE 6 4.635 -2.811 0.570 69 H ILE 7 H ILE 7 -1.282 -1.885 -4.152 70 HA ILE 7 HA ILE 7 -1.941 0.059 -6.261 71 HB ILE 7 HB ILE 7 -3.561 -2.441 -5.946 72 1HG1 ILE 7 2HG1 ILE 7 -1.277 -2.127 -7.899 73 2HG1 ILE 7 1HG1 ILE 7 -1.132 -3.008 -6.383 74 1HG2 ILE 7 1HG2 ILE 7 -4.753 -1.009 -7.267 75 2HG2 ILE 7 2HG2 ILE 7 -3.784 -1.814 -8.501 76 3HG2 ILE 7 3HG2 ILE 7 -3.311 -0.222 -7.907 77 1HD1 ILE 7 1HD1 ILE 7 -2.243 -4.790 -7.168 78 2HD1 ILE 7 2HD1 ILE 7 -1.774 -4.136 -8.737 79 3HD1 ILE 7 3HD1 ILE 7 -3.382 -3.809 -8.091 80 H CYS 8 H CYS 8 -2.870 1.671 -5.157 81 HA CYS 8 HA CYS 8 -4.971 0.992 -3.214 82 1HB CYS 8 2HB CYS 8 -3.887 3.746 -3.281 83 2HB CYS 8 1HB CYS 8 -4.328 2.741 -1.904 84 HG CYS 8 HG CYS 8 -1.352 3.235 -3.299 85 H LEU 9 H LEU 9 -6.994 1.380 -3.819 86 HA LEU 9 HA LEU 9 -7.733 2.430 -6.288 87 1HB LEU 9 2HB LEU 9 -9.038 1.295 -4.081 88 2HB LEU 9 1HB LEU 9 -9.799 2.857 -4.314 89 HG LEU 9 HG LEU 9 -9.470 0.894 -6.571 90 1HD1 LEU 9 1HD1 LEU 9 -11.147 0.634 -4.272 91 2HD1 LEU 9 2HD1 LEU 9 -11.009 -0.424 -5.676 92 3HD1 LEU 9 3HD1 LEU 9 -12.143 0.926 -5.698 93 1HD2 LEU 9 1HD2 LEU 9 -10.634 2.354 -7.806 94 2HD2 LEU 9 2HD2 LEU 9 -10.184 3.530 -6.572 95 3HD2 LEU 9 3HD2 LEU 9 -11.750 2.724 -6.490 96 H GLY 10 H GLY 10 -6.916 4.015 -3.353 97 1HA GLY 10 2HA GLY 10 -7.433 6.603 -4.639 98 2HA GLY 10 1HA GLY 10 -8.048 6.322 -3.016 99 H ASN 11 H ASN 11 -5.190 6.790 -4.972 100 HA ASN 11 HA ASN 11 -3.378 6.616 -2.747 101 1HB ASN 11 2HB ASN 11 -2.800 6.086 -5.166 102 2HB ASN 11 1HB ASN 11 -2.797 7.821 -5.452 103 1HD2 ASN 11 1HD2 ASN 11 -0.655 5.815 -5.627 104 2HD2 ASN 11 2HD2 ASN 11 0.609 6.393 -4.600 105 H ILE 12 H ILE 12 -5.271 8.322 -1.967 106 HA ILE 12 HA ILE 12 -3.830 10.861 -1.821 107 HB ILE 12 HB ILE 12 -6.056 12.060 -1.976 108 1HG1 ILE 12 2HG1 ILE 12 -7.102 9.855 -3.648 109 2HG1 ILE 12 1HG1 ILE 12 -7.140 9.581 -1.909 110 1HG2 ILE 12 1HG2 ILE 12 -5.741 12.477 -4.204 111 2HG2 ILE 12 2HG2 ILE 12 -5.493 10.778 -4.600 112 3HG2 ILE 12 3HG2 ILE 12 -4.210 11.695 -3.812 113 1HD1 ILE 12 1HD1 ILE 12 -8.638 11.276 -1.542 114 2HD1 ILE 12 2HD1 ILE 12 -9.167 10.662 -3.108 115 3HD1 ILE 12 3HD1 ILE 12 -8.197 12.133 -3.019 116 H CYS 13 H CYS 13 -4.723 8.401 -0.108 117 HA CYS 13 HA CYS 13 -5.231 9.973 2.272 118 1HB CYS 13 2HB CYS 13 -7.474 9.337 1.230 119 2HB CYS 13 1HB CYS 13 -7.081 7.678 1.666 120 HG CYS 13 HG CYS 13 -7.185 10.192 3.977 121 H ARG 14 H ARG 14 -5.606 6.512 1.489 122 HA ARG 14 HA ARG 14 -4.004 5.786 3.764 123 1HB ARG 14 2HB ARG 14 -4.500 3.493 3.167 124 2HB ARG 14 1HB ARG 14 -5.967 4.455 3.079 125 1HG ARG 14 2HG ARG 14 -5.972 4.426 0.729 126 2HG ARG 14 1HG ARG 14 -4.303 3.857 0.654 127 1HD ARG 14 2HD ARG 14 -5.632 1.939 2.166 128 2HD ARG 14 1HD ARG 14 -6.767 2.351 0.882 129 HE ARG 14 HE ARG 14 -5.422 1.237 -0.579 130 1HH1 ARG 14 1HH1 ARG 14 -3.527 2.108 2.213 131 2HH1 ARG 14 2HH1 ARG 14 -2.117 1.256 1.681 132 1HH2 ARG 14 1HH2 ARG 14 -3.568 0.111 -1.286 133 2HH2 ARG 14 2HH2 ARG 14 -2.140 0.121 -0.306 134 H SER 15 H SER 15 -3.605 5.724 0.252 135 HA SER 15 HA SER 15 -1.197 4.316 0.137 136 1HB SER 15 2HB SER 15 -2.667 4.940 -1.807 137 2HB SER 15 1HB SER 15 -1.969 6.558 -1.725 138 HG SER 15 HG SER 15 -0.997 4.685 -3.104 139 HA PRO 16 HA PRO 16 1.035 8.685 0.309 140 1HB PRO 16 2HB PRO 16 -0.306 10.519 1.863 141 2HB PRO 16 1HB PRO 16 -0.348 10.485 0.098 142 1HG PRO 16 2HG PRO 16 -2.325 9.400 2.062 143 2HG PRO 16 1HG PRO 16 -2.615 10.276 0.547 144 1HD PRO 16 2HD PRO 16 -2.886 7.614 0.694 145 2HD PRO 16 1HD PRO 16 -2.228 8.396 -0.759 146 H MET 17 H MET 17 -1.051 7.744 3.031 147 HA MET 17 HA MET 17 0.652 8.464 5.118 148 1HB MET 17 2HB MET 17 -1.806 7.444 5.066 149 2HB MET 17 1HB MET 17 -0.931 5.948 5.364 150 1HG MET 17 2HG MET 17 -0.030 6.779 7.395 151 2HG MET 17 1HG MET 17 -0.601 8.411 7.051 152 1HE MET 17 1HE MET 17 -1.063 7.407 9.771 153 2HE MET 17 2HE MET 17 -1.234 5.683 9.444 154 3HE MET 17 3HE MET 17 -2.576 6.583 10.149 155 H ALA 18 H ALA 18 0.249 5.234 3.663 156 HA ALA 18 HA ALA 18 2.555 4.166 4.948 157 1HB ALA 18 1HB ALA 18 1.506 2.299 4.362 158 2HB ALA 18 2HB ALA 18 1.993 2.593 2.693 159 3HB ALA 18 3HB ALA 18 0.438 3.188 3.276 160 H GLU 19 H GLU 19 2.102 6.141 2.225 161 HA GLU 19 HA GLU 19 4.195 5.337 0.542 162 1HB GLU 19 2HB GLU 19 2.306 7.161 0.277 163 2HB GLU 19 1HB GLU 19 3.542 8.235 0.914 164 1HG GLU 19 2HG GLU 19 3.499 8.296 -1.503 165 2HG GLU 19 1HG GLU 19 5.026 7.629 -0.921 166 H PHE 20 H PHE 20 4.141 7.935 2.968 167 HA PHE 20 HA PHE 20 6.971 8.311 2.896 168 1HB PHE 20 2HB PHE 20 5.649 10.195 3.488 169 2HB PHE 20 1HB PHE 20 4.801 9.296 4.743 170 HD1 PHE 20 1HD PHE 20 8.190 10.521 3.819 171 HD2 PHE 20 2HD PHE 20 5.503 9.450 6.941 172 HE1 PHE 20 1HE PHE 20 9.806 11.335 5.485 173 HE2 PHE 20 2HE PHE 20 7.115 10.263 8.613 174 HZ PHE 20 HZ PHE 20 9.270 11.208 7.885 175 H ILE 21 H ILE 21 4.750 6.704 5.168 176 HA ILE 21 HA ILE 21 6.593 6.057 7.150 177 HB ILE 21 HB ILE 21 4.218 4.415 6.265 178 1HG1 ILE 21 2HG1 ILE 21 4.420 6.485 8.461 179 2HG1 ILE 21 1HG1 ILE 21 3.726 6.789 6.871 180 1HG2 ILE 21 1HG2 ILE 21 5.533 4.437 8.972 181 2HG2 ILE 21 2HG2 ILE 21 5.927 3.261 7.717 182 3HG2 ILE 21 3HG2 ILE 21 4.292 3.337 8.373 183 1HD1 ILE 21 1HD1 ILE 21 2.477 5.731 9.182 184 2HD1 ILE 21 2HD1 ILE 21 2.465 4.491 7.927 185 3HD1 ILE 21 3HD1 ILE 21 1.771 6.079 7.604 186 H MET 22 H MET 22 5.534 3.992 4.437 187 HA MET 22 HA MET 22 7.276 1.874 4.928 188 1HB MET 22 2HB MET 22 5.890 2.855 2.458 189 2HB MET 22 1HB MET 22 7.025 1.515 2.364 190 1HG MET 22 2HG MET 22 5.345 0.941 4.523 191 2HG MET 22 1HG MET 22 4.296 1.536 3.237 192 1HE MET 22 1HE MET 22 6.868 -1.733 4.008 193 2HE MET 22 2HE MET 22 7.572 -0.214 3.453 194 3HE MET 22 3HE MET 22 7.459 -1.586 2.352 195 H LYS 23 H LYS 23 7.707 4.699 2.806 196 HA LYS 23 HA LYS 23 10.157 4.089 1.705 197 1HB LYS 23 2HB LYS 23 9.009 6.023 0.944 198 2HB LYS 23 1HB LYS 23 8.979 6.728 2.553 199 1HG LYS 23 2HG LYS 23 11.689 6.260 1.742 200 2HG LYS 23 1HG LYS 23 10.834 7.192 0.511 201 1HD LYS 23 2HD LYS 23 10.045 8.299 2.950 202 2HD LYS 23 1HD LYS 23 11.778 8.012 3.113 203 1HE LYS 23 2HE LYS 23 12.263 9.326 1.197 204 2HE LYS 23 1HE LYS 23 10.562 9.398 0.735 205 1HZ LYS 23 1HZ LYS 23 10.171 10.647 2.834 206 2HZ LYS 23 2HZ LYS 23 11.145 11.463 1.718 207 3HZ LYS 23 3HZ LYS 23 11.847 10.715 3.063 208 H ASP 24 H ASP 24 9.457 5.383 4.905 209 HA ASP 24 HA ASP 24 12.168 5.911 5.597 210 1HB ASP 24 2HB ASP 24 9.663 6.442 6.709 211 2HB ASP 24 1HB ASP 24 10.468 5.408 7.884 212 H LEU 25 H LEU 25 9.941 3.302 6.569 213 HA LEU 25 HA LEU 25 11.807 1.887 8.120 214 1HB LEU 25 2HB LEU 25 9.103 1.484 7.128 215 2HB LEU 25 1HB LEU 25 10.008 -0.014 7.225 216 HG LEU 25 HG LEU 25 8.666 0.482 9.257 217 1HD1 LEU 25 1HD1 LEU 25 10.148 -0.843 10.228 218 2HD1 LEU 25 2HD1 LEU 25 11.149 0.562 10.593 219 3HD1 LEU 25 3HD1 LEU 25 11.391 -0.326 9.089 220 1HD2 LEU 25 1HD2 LEU 25 9.872 2.219 10.791 221 2HD2 LEU 25 2HD2 LEU 25 8.676 2.753 9.611 222 3HD2 LEU 25 3HD2 LEU 25 10.396 2.911 9.255 223 H VAL 26 H VAL 26 10.883 1.468 4.712 224 HA VAL 26 HA VAL 26 12.193 -0.905 4.185 225 HB VAL 26 HB VAL 26 12.376 -0.154 1.830 226 1HG1 VAL 26 1HG1 VAL 26 9.829 0.449 1.667 227 2HG1 VAL 26 2HG1 VAL 26 9.844 0.057 3.387 228 3HG1 VAL 26 3HG1 VAL 26 10.345 -1.150 2.202 229 1HG2 VAL 26 1HG2 VAL 26 10.919 2.351 2.392 230 2HG2 VAL 26 2HG2 VAL 26 12.101 1.979 1.137 231 3HG2 VAL 26 3HG2 VAL 26 12.640 2.343 2.776 232 H LYS 27 H LYS 27 13.541 2.370 4.215 233 HA LYS 27 HA LYS 27 16.037 1.842 3.135 234 1HB LYS 27 2HB LYS 27 15.174 4.095 3.662 235 2HB LYS 27 1HB LYS 27 15.381 3.762 5.375 236 1HG LYS 27 2HG LYS 27 17.593 4.137 5.314 237 2HG LYS 27 1HG LYS 27 17.785 3.377 3.732 238 1HD LYS 27 2HD LYS 27 18.240 5.592 3.253 239 2HD LYS 27 1HD LYS 27 16.520 5.484 2.870 240 1HE LYS 27 2HE LYS 27 16.988 7.494 4.158 241 2HE LYS 27 1HE LYS 27 15.974 6.385 5.080 242 1HZ LYS 27 1HZ LYS 27 18.919 6.560 5.393 243 2HZ LYS 27 2HZ LYS 27 17.832 5.718 6.377 244 3HZ LYS 27 3HZ LYS 27 17.821 7.408 6.363 245 H LYS 28 H LYS 28 14.782 1.095 6.296 246 HA LYS 28 HA LYS 28 17.236 0.673 7.621 247 1HB LYS 28 2HB LYS 28 15.181 1.027 8.848 248 2HB LYS 28 1HB LYS 28 14.494 -0.448 8.183 249 1HG LYS 28 2HG LYS 28 17.021 -0.936 9.514 250 2HG LYS 28 1HG LYS 28 15.833 -0.189 10.584 251 1HD LYS 28 2HD LYS 28 15.206 -2.581 8.867 252 2HD LYS 28 1HD LYS 28 15.846 -2.724 10.504 253 1HE LYS 28 2HE LYS 28 13.901 -1.264 11.233 254 2HE LYS 28 1HE LYS 28 13.228 -1.534 9.626 255 1HZ LYS 28 1HZ LYS 28 13.266 -3.918 10.060 256 2HZ LYS 28 2HZ LYS 28 12.333 -3.106 11.214 257 3HZ LYS 28 3HZ LYS 28 13.887 -3.644 11.610 258 H ALA 29 H ALA 29 14.977 -1.743 6.203 259 HA ALA 29 HA ALA 29 17.284 -3.568 6.027 260 1HB ALA 29 1HB ALA 29 14.508 -4.381 6.857 261 2HB ALA 29 2HB ALA 29 15.877 -4.160 7.947 262 3HB ALA 29 3HB ALA 29 15.920 -5.430 6.724 263 H ASN 30 H ASN 30 15.951 -1.910 3.930 264 HA ASN 30 HA ASN 30 15.392 -4.133 2.091 265 1HB ASN 30 2HB ASN 30 13.694 -1.731 2.609 266 2HB ASN 30 1HB ASN 30 13.785 -2.352 0.965 267 1HD2 ASN 30 1HD2 ASN 30 12.448 -2.741 4.061 268 2HD2 ASN 30 2HD2 ASN 30 11.563 -4.192 3.757 269 H LEU 31 H LEU 31 15.892 -0.600 2.147 270 HA LEU 31 HA LEU 31 17.013 -0.454 -0.434 271 1HB LEU 31 2HB LEU 31 16.656 1.329 1.851 272 2HB LEU 31 1HB LEU 31 18.128 1.657 0.959 273 HG LEU 31 HG LEU 31 16.338 3.063 0.138 274 1HD1 LEU 31 1HD1 LEU 31 17.884 1.326 -1.451 275 2HD1 LEU 31 2HD1 LEU 31 17.208 2.894 -1.891 276 3HD1 LEU 31 3HD1 LEU 31 16.288 1.421 -2.196 277 1HD2 LEU 31 1HD2 LEU 31 14.249 2.366 -0.442 278 2HD2 LEU 31 2HD2 LEU 31 14.616 1.160 0.791 279 3HD2 LEU 31 3HD2 LEU 31 14.794 0.758 -0.917 280 H GLU 32 H GLU 32 18.286 -1.443 2.594 281 HA GLU 32 HA GLU 32 21.040 -0.970 2.101 282 1HB GLU 32 2HB GLU 32 19.764 -3.049 3.889 283 2HB GLU 32 1HB GLU 32 21.432 -2.501 3.967 284 1HG GLU 32 2HG GLU 32 19.268 -0.483 4.235 285 2HG GLU 32 1HG GLU 32 19.594 -1.562 5.592 286 H LYS 33 H LYS 33 18.979 -3.842 1.751 287 HA LYS 33 HA LYS 33 21.111 -5.321 0.459 288 1HB LYS 33 2HB LYS 33 18.279 -5.969 1.240 289 2HB LYS 33 1HB LYS 33 19.197 -7.039 0.189 290 1HG LYS 33 2HG LYS 33 20.831 -7.425 1.879 291 2HG LYS 33 1HG LYS 33 20.135 -6.174 2.910 292 1HD LYS 33 2HD LYS 33 18.031 -7.529 2.988 293 2HD LYS 33 1HD LYS 33 18.898 -8.814 2.144 294 1HE LYS 33 2HE LYS 33 19.031 -9.369 4.425 295 2HE LYS 33 1HE LYS 33 20.606 -8.688 4.018 296 1HZ LYS 33 1HZ LYS 33 19.932 -6.596 4.987 297 2HZ LYS 33 2HZ LYS 33 19.749 -7.837 6.123 298 3HZ LYS 33 3HZ LYS 33 18.392 -7.207 5.334 299 H GLU 34 H GLU 34 19.455 -2.869 -0.587 300 HA GLU 34 HA GLU 34 18.906 -2.026 -2.614 301 1HB GLU 34 2HB GLU 34 20.820 -4.078 -3.170 302 2HB GLU 34 1HB GLU 34 19.604 -4.076 -4.439 303 1HG GLU 34 2HG GLU 34 19.989 -1.533 -4.500 304 2HG GLU 34 1HG GLU 34 21.473 -1.893 -3.619 305 H PHE 35 H PHE 35 16.703 -2.497 -1.738 306 HA PHE 35 HA PHE 35 15.313 -4.543 -3.335 307 1HB PHE 35 2HB PHE 35 14.822 -3.365 -0.642 308 2HB PHE 35 1HB PHE 35 13.420 -3.849 -1.592 309 HD1 PHE 35 1HD PHE 35 12.600 -5.919 -1.085 310 HD2 PHE 35 2HD PHE 35 16.798 -5.260 -0.827 311 HE1 PHE 35 1HE PHE 35 12.918 -8.252 -0.372 312 HE2 PHE 35 2HE PHE 35 17.122 -7.594 -0.114 313 HZ PHE 35 HZ PHE 35 15.181 -9.093 0.114 314 H PHE 36 H PHE 36 13.099 -3.934 -4.097 315 HA PHE 36 HA PHE 36 12.921 -1.065 -4.732 316 1HB PHE 36 2HB PHE 36 12.273 -3.274 -6.686 317 2HB PHE 36 1HB PHE 36 12.308 -1.543 -7.005 318 HD1 PHE 36 1HD PHE 36 14.531 -0.342 -6.851 319 HD2 PHE 36 2HD PHE 36 14.185 -4.582 -6.940 320 HE1 PHE 36 1HE PHE 36 16.888 -0.516 -7.533 321 HE2 PHE 36 2HE PHE 36 16.542 -4.765 -7.620 322 HZ PHE 36 HZ PHE 36 17.897 -2.730 -7.918 323 H ILE 37 H ILE 37 11.057 -0.181 -4.220 324 HA ILE 37 HA ILE 37 8.667 -1.895 -4.005 325 HB ILE 37 HB ILE 37 7.865 -0.329 -2.234 326 1HG1 ILE 37 2HG1 ILE 37 10.286 0.698 -1.261 327 2HG1 ILE 37 1HG1 ILE 37 10.299 1.049 -2.986 328 1HG2 ILE 37 1HG2 ILE 37 9.566 -1.169 -0.490 329 2HG2 ILE 37 2HG2 ILE 37 10.316 -2.004 -1.851 330 3HG2 ILE 37 3HG2 ILE 37 8.644 -2.357 -1.413 331 1HD1 ILE 37 1HD1 ILE 37 9.099 2.557 -1.040 332 2HD1 ILE 37 2HD1 ILE 37 7.750 1.655 -1.731 333 3HD1 ILE 37 3HD1 ILE 37 8.771 2.648 -2.771 334 H ASN 38 H ASN 38 6.704 -1.019 -4.697 335 HA ASN 38 HA ASN 38 6.801 1.626 -5.966 336 1HB ASN 38 2HB ASN 38 5.498 -0.709 -7.356 337 2HB ASN 38 1HB ASN 38 5.905 0.870 -8.020 338 1HD2 ASN 38 1HD2 ASN 38 6.925 -2.317 -7.514 339 2HD2 ASN 38 2HD2 ASN 38 8.532 -2.158 -8.130 340 H SER 39 H SER 39 4.603 2.398 -6.589 341 HA SER 39 HA SER 39 2.325 1.213 -5.308 342 1HB SER 39 2HB SER 39 2.765 2.187 -3.295 343 2HB SER 39 1HB SER 39 3.827 3.405 -4.002 344 HG SER 39 HG SER 39 2.099 4.652 -4.482 345 H ALA 40 H ALA 40 0.470 1.862 -6.276 346 HA ALA 40 HA ALA 40 0.188 4.399 -7.563 347 1HB ALA 40 1HB ALA 40 -0.053 2.224 -9.554 348 2HB ALA 40 2HB ALA 40 1.578 2.719 -9.102 349 3HB ALA 40 3HB ALA 40 0.448 3.902 -9.758 350 H GLY 41 H GLY 41 -1.904 4.417 -8.920 351 1HA GLY 41 2HA GLY 41 -3.939 3.050 -7.325 352 2HA GLY 41 1HA GLY 41 -4.209 4.413 -8.400 353 H THR 42 H THR 42 -6.023 2.583 -8.687 354 HA THR 42 HA THR 42 -5.389 0.396 -10.376 355 HB THR 42 HB THR 42 -8.123 1.362 -10.668 356 HG1 THR 42 1HG THR 42 -8.424 1.965 -8.669 357 1HG2 THR 42 1HG2 THR 42 -7.474 -0.928 -11.133 358 2HG2 THR 42 2HG2 THR 42 -8.617 -0.896 -9.791 359 3HG2 THR 42 3HG2 THR 42 -6.896 -1.128 -9.479 360 H SER 43 H SER 43 -6.798 3.600 -11.045 361 HA SER 43 HA SER 43 -6.183 3.156 -13.895 362 1HB SER 43 2HB SER 43 -8.128 5.251 -13.473 363 2HB SER 43 1HB SER 43 -8.264 3.783 -14.440 364 HG SER 43 HG SER 43 -9.761 3.497 -12.907 365 H GLY 44 H GLY 44 -5.042 4.701 -11.298 366 1HA GLY 44 2HA GLY 44 -3.746 6.557 -10.946 367 2HA GLY 44 1HA GLY 44 -3.335 6.403 -12.644 368 H GLU 45 H GLU 45 -6.647 6.973 -11.768 369 HA GLU 45 HA GLU 45 -6.916 9.245 -13.361 370 1HB GLU 45 2HB GLU 45 -8.603 8.654 -10.927 371 2HB GLU 45 1HB GLU 45 -9.078 9.536 -12.372 372 1HG GLU 45 2HG GLU 45 -8.970 7.514 -13.686 373 2HG GLU 45 1HG GLU 45 -8.381 6.610 -12.292 374 H HIS 46 H HIS 46 -7.109 9.227 -9.810 375 HA HIS 46 HA HIS 46 -5.791 11.863 -9.804 376 1HB HIS 46 2HB HIS 46 -8.065 10.779 -8.172 377 2HB HIS 46 1HB HIS 46 -7.028 12.034 -7.503 378 HD1 HIS 46 1HD HIS 46 -8.928 11.526 -10.770 379 HD2 HIS 46 2HD HIS 46 -8.031 14.484 -7.993 380 HE1 HIS 46 1HE HIS 46 -10.112 13.592 -11.582 381 HE2 HIS 46 2HE HIS 46 -9.615 15.349 -9.847 382 H ASP 47 H ASP 47 -5.899 8.648 -8.608 383 HA ASP 47 HA ASP 47 -4.553 8.619 -6.257 384 1HB ASP 47 2HB ASP 47 -3.566 6.692 -8.298 385 2HB ASP 47 1HB ASP 47 -4.126 6.398 -6.653 386 H GLY 48 H GLY 48 -2.783 9.648 -5.603 387 1HA GLY 48 2HA GLY 48 -0.248 9.351 -6.091 388 2HA GLY 48 1HA GLY 48 -0.669 10.228 -7.552 389 H GLU 49 H GLU 49 -2.681 11.844 -6.073 390 HA GLU 49 HA GLU 49 -1.051 14.046 -5.452 391 1HB GLU 49 2HB GLU 49 -3.935 13.477 -4.749 392 2HB GLU 49 1HB GLU 49 -3.150 15.032 -4.504 393 1HG GLU 49 2HG GLU 49 -3.167 13.759 -7.206 394 2HG GLU 49 1HG GLU 49 -4.578 14.639 -6.621 395 H GLY 50 H GLY 50 -3.305 12.606 -3.111 396 1HA GLY 50 2HA GLY 50 -2.650 11.647 -1.021 397 2HA GLY 50 1HA GLY 50 -1.131 12.527 -1.130 398 H MET 51 H MET 51 -4.624 12.937 -0.672 399 HA MET 51 HA MET 51 -4.251 14.776 1.466 400 1HB MET 51 2HB MET 51 -5.510 16.668 0.283 401 2HB MET 51 1HB MET 51 -3.810 16.458 -0.111 402 1HG MET 51 2HG MET 51 -4.285 15.553 -2.208 403 2HG MET 51 1HG MET 51 -5.961 15.214 -1.780 404 1HE MET 51 1HE MET 51 -7.512 16.075 -2.759 405 2HE MET 51 2HE MET 51 -7.187 17.118 -4.143 406 3HE MET 51 3HE MET 51 -7.984 17.774 -2.712 407 H HIS 52 H HIS 52 -5.723 13.811 2.736 408 HA HIS 52 HA HIS 52 -8.492 14.157 2.217 409 1HB HIS 52 2HB HIS 52 -7.533 11.937 0.962 410 2HB HIS 52 1HB HIS 52 -8.014 11.264 2.515 411 HD1 HIS 52 1HD HIS 52 -9.412 10.824 -0.353 412 HD2 HIS 52 2HD HIS 52 -10.769 13.219 2.760 413 HE1 HIS 52 1HE HIS 52 -11.891 11.047 -0.707 414 HE2 HIS 52 2HE HIS 52 -12.687 12.523 1.172 415 H TYR 53 H TYR 53 -9.819 13.602 4.000 416 HA TYR 53 HA TYR 53 -8.793 14.088 6.502 417 1HB TYR 53 2HB TYR 53 -11.302 12.607 5.714 418 2HB TYR 53 1HB TYR 53 -10.938 13.090 7.365 419 HD1 TYR 53 1HD TYR 53 -12.963 13.921 4.821 420 HD2 TYR 53 2HD TYR 53 -9.982 15.757 7.241 421 HE1 TYR 53 1HE TYR 53 -13.976 16.122 4.392 422 HE2 TYR 53 2HE TYR 53 -10.987 17.960 6.820 423 HH TYR 53 HH TYR 53 -13.959 18.293 4.915 424 H GLY 54 H GLY 54 -9.234 12.494 8.422 425 1HA GLY 54 2HA GLY 54 -8.694 10.556 9.533 426 2HA GLY 54 1HA GLY 54 -8.680 9.733 7.983 427 H THR 55 H THR 55 -6.728 9.966 6.656 428 HA THR 55 HA THR 55 -4.422 9.306 8.071 429 HB THR 55 HB THR 55 -4.861 10.181 5.226 430 HG1 THR 55 1HG THR 55 -5.431 8.020 6.074 431 1HG2 THR 55 1HG2 THR 55 -2.518 9.539 4.760 432 2HG2 THR 55 2HG2 THR 55 -2.231 9.409 6.495 433 3HG2 THR 55 3HG2 THR 55 -2.636 10.971 5.784 434 H LYS 56 H LYS 56 -5.246 12.371 6.451 435 HA LYS 56 HA LYS 56 -2.917 13.772 7.060 436 1HB LYS 56 2HB LYS 56 -4.834 14.448 5.514 437 2HB LYS 56 1HB LYS 56 -5.662 15.020 6.955 438 1HG LYS 56 2HG LYS 56 -3.860 16.592 7.391 439 2HG LYS 56 1HG LYS 56 -2.986 15.997 5.977 440 1HD LYS 56 2HD LYS 56 -4.833 16.721 4.537 441 2HD LYS 56 1HD LYS 56 -5.701 17.319 5.952 442 1HE LYS 56 2HE LYS 56 -3.111 18.443 6.024 443 2HE LYS 56 1HE LYS 56 -3.708 18.627 4.376 444 1HZ LYS 56 1HZ LYS 56 -4.269 20.483 5.922 445 2HZ LYS 56 2HZ LYS 56 -5.272 19.416 6.767 446 3HZ LYS 56 3HZ LYS 56 -5.604 19.786 5.151 447 H ASN 57 H ASN 57 -5.937 13.519 8.904 448 HA ASN 57 HA ASN 57 -5.248 15.271 10.979 449 1HB ASN 57 2HB ASN 57 -7.492 14.777 11.001 450 2HB ASN 57 1HB ASN 57 -7.233 13.078 10.615 451 1HD2 ASN 57 1HD2 ASN 57 -6.730 11.633 12.271 452 2HD2 ASN 57 2HD2 ASN 57 -7.017 12.012 13.931 453 H LYS 58 H LYS 58 -4.959 11.724 10.809 454 HA LYS 58 HA LYS 58 -3.849 11.358 13.352 455 1HB LYS 58 2HB LYS 58 -3.947 9.761 10.843 456 2HB LYS 58 1HB LYS 58 -2.784 9.276 12.070 457 1HG LYS 58 2HG LYS 58 -5.774 9.460 12.349 458 2HG LYS 58 1HG LYS 58 -4.773 8.009 12.394 459 1HD LYS 58 2HD LYS 58 -4.638 10.254 14.406 460 2HD LYS 58 1HD LYS 58 -5.536 8.753 14.635 461 1HE LYS 58 2HE LYS 58 -3.594 8.188 15.684 462 2HE LYS 58 1HE LYS 58 -3.191 7.684 14.044 463 1HZ LYS 58 1HZ LYS 58 -2.573 10.436 14.524 464 2HZ LYS 58 2HZ LYS 58 -1.588 9.200 13.920 465 3HZ LYS 58 3HZ LYS 58 -1.755 9.407 15.589 466 H LEU 59 H LEU 59 -2.287 11.817 10.203 467 HA LEU 59 HA LEU 59 0.360 11.630 11.167 468 1HB LEU 59 2HB LEU 59 -0.679 13.093 8.739 469 2HB LEU 59 1HB LEU 59 1.002 12.705 9.049 470 HG LEU 59 HG LEU 59 -1.210 10.707 8.566 471 1HD1 LEU 59 1HD1 LEU 59 -0.688 11.771 6.519 472 2HD1 LEU 59 2HD1 LEU 59 0.170 10.231 6.515 473 3HD1 LEU 59 3HD1 LEU 59 1.043 11.725 6.855 474 1HD2 LEU 59 1HD2 LEU 59 0.634 9.995 10.143 475 2HD2 LEU 59 2HD2 LEU 59 1.740 10.159 8.779 476 3HD2 LEU 59 3HD2 LEU 59 0.416 8.997 8.706 477 H ALA 60 H ALA 60 -1.934 14.266 10.906 478 HA ALA 60 HA ALA 60 -0.176 16.410 11.350 479 1HB ALA 60 1HB ALA 60 -3.080 16.190 12.144 480 2HB ALA 60 2HB ALA 60 -2.485 16.692 10.561 481 3HB ALA 60 3HB ALA 60 -2.151 17.682 11.982 482 H GLN 61 H GLN 61 -1.726 14.136 13.504 483 HA GLN 61 HA GLN 61 -1.419 15.419 15.947 484 1HB GLN 61 2HB GLN 61 -2.431 13.052 15.217 485 2HB GLN 61 1HB GLN 61 -0.891 12.497 15.860 486 1HG GLN 61 2HG GLN 61 -1.876 14.298 17.751 487 2HG GLN 61 1HG GLN 61 -3.263 13.333 17.247 488 1HE2 GLN 61 1HE2 GLN 61 -2.224 10.902 16.789 489 2HE2 GLN 61 2HE2 GLN 61 -1.538 10.244 18.231 490 H LEU 62 H LEU 62 0.918 13.342 14.232 491 HA LEU 62 HA LEU 62 3.059 14.609 15.764 492 1HB LEU 62 2HB LEU 62 3.807 11.906 15.606 493 2HB LEU 62 1HB LEU 62 3.454 12.843 17.045 494 HG LEU 62 HG LEU 62 0.941 12.154 16.251 495 1HD1 LEU 62 1HD1 LEU 62 2.368 9.580 15.905 496 2HD1 LEU 62 2HD1 LEU 62 2.301 10.673 14.524 497 3HD1 LEU 62 3HD1 LEU 62 0.809 10.106 15.273 498 1HD2 LEU 62 1HD2 LEU 62 1.006 10.532 18.055 499 2HD2 LEU 62 2HD2 LEU 62 1.897 11.986 18.504 500 3HD2 LEU 62 3HD2 LEU 62 2.769 10.533 18.017 501 H ASN 63 H ASN 63 2.215 12.346 13.163 502 HA ASN 63 HA ASN 63 4.743 12.406 11.887 503 1HB ASN 63 2HB ASN 63 2.067 11.846 10.586 504 2HB ASN 63 1HB ASN 63 3.654 11.313 10.034 505 1HD2 ASN 63 1HD2 ASN 63 0.960 10.579 11.929 506 2HD2 ASN 63 2HD2 ASN 63 1.571 9.150 12.682 507 H ILE 64 H ILE 64 4.106 12.940 9.209 508 HA ILE 64 HA ILE 64 4.148 15.858 9.250 509 HB ILE 64 HB ILE 64 4.478 14.160 6.792 510 1HG1 ILE 64 2HG1 ILE 64 6.016 13.263 8.490 511 2HG1 ILE 64 1HG1 ILE 64 6.891 14.083 7.202 512 1HG2 ILE 64 1HG2 ILE 64 4.347 16.847 7.104 513 2HG2 ILE 64 2HG2 ILE 64 5.191 16.035 5.785 514 3HG2 ILE 64 3HG2 ILE 64 6.087 16.580 7.204 515 1HD1 ILE 64 1HD1 ILE 64 6.403 16.009 9.189 516 2HD1 ILE 64 2HD1 ILE 64 7.941 15.274 8.736 517 3HD1 ILE 64 3HD1 ILE 64 6.960 14.552 10.012 518 H GLU 65 H GLU 65 2.620 17.144 8.270 519 HA GLU 65 HA GLU 65 0.010 16.368 8.157 520 1HB GLU 65 2HB GLU 65 0.951 18.727 8.050 521 2HB GLU 65 1HB GLU 65 1.101 18.472 6.317 522 1HG GLU 65 2HG GLU 65 -1.179 18.439 5.986 523 2HG GLU 65 1HG GLU 65 -1.523 18.007 7.661 524 H HIS 66 H HIS 66 2.325 16.321 5.592 525 HA HIS 66 HA HIS 66 1.296 14.129 4.246 526 1HB HIS 66 2HB HIS 66 -0.156 16.561 3.666 527 2HB HIS 66 1HB HIS 66 0.615 15.935 2.212 528 HD1 HIS 66 1HD HIS 66 -2.444 15.701 3.946 529 HD2 HIS 66 2HD HIS 66 0.015 12.931 2.064 530 HE1 HIS 66 1HE HIS 66 -3.907 13.710 3.481 531 HE2 HIS 66 2HE HIS 66 -2.423 12.088 2.250 532 H LYS 67 H LYS 67 2.313 13.737 2.161 533 HA LYS 67 HA LYS 67 4.247 15.475 1.057 534 1HB LYS 67 2HB LYS 67 6.278 14.180 1.701 535 2HB LYS 67 1HB LYS 67 5.534 15.033 3.046 536 1HG LYS 67 2HG LYS 67 4.668 12.243 2.624 537 2HG LYS 67 1HG LYS 67 6.328 12.485 3.174 538 1HD LYS 67 2HD LYS 67 5.669 13.076 5.228 539 2HD LYS 67 1HD LYS 67 4.411 14.145 4.604 540 1HE LYS 67 2HE LYS 67 4.251 11.175 5.064 541 2HE LYS 67 1HE LYS 67 3.338 12.444 5.877 542 1HZ LYS 67 1HZ LYS 67 1.811 12.402 4.288 543 2HZ LYS 67 2HZ LYS 67 2.560 11.020 3.663 544 3HZ LYS 67 3HZ LYS 67 2.965 12.546 3.060 545 H ASN 68 H ASN 68 5.939 13.921 -0.235 546 HA ASN 68 HA ASN 68 6.155 12.554 -2.034 547 1HB ASN 68 2HB ASN 68 4.353 10.885 -0.287 548 2HB ASN 68 1HB ASN 68 4.970 10.301 -1.829 549 1HD2 ASN 68 1HD2 ASN 68 5.493 10.317 1.403 550 2HD2 ASN 68 2HD2 ASN 68 7.187 9.978 1.429 551 H PHE 69 H PHE 69 4.842 14.440 -2.986 552 HA PHE 69 HA PHE 69 2.178 13.642 -3.874 553 1HB PHE 69 2HB PHE 69 3.718 16.190 -3.801 554 2HB PHE 69 1HB PHE 69 2.507 16.012 -5.067 555 HD1 PHE 69 1HD PHE 69 2.831 15.421 -1.394 556 HD2 PHE 69 2HD PHE 69 0.408 16.791 -4.612 557 HE1 PHE 69 1HE PHE 69 1.072 16.054 0.205 558 HE2 PHE 69 2HE PHE 69 -1.356 17.427 -3.020 559 HZ PHE 69 HZ PHE 69 -1.024 17.058 -0.607 560 H THR 70 H THR 70 2.507 12.045 -5.383 561 HA THR 70 HA THR 70 3.547 12.939 -7.952 562 HB THR 70 HB THR 70 5.538 11.935 -7.497 563 HG1 THR 70 1HG THR 70 5.039 9.435 -7.923 564 1HG2 THR 70 1HG2 THR 70 4.951 11.415 -5.160 565 2HG2 THR 70 2HG2 THR 70 5.892 10.127 -5.910 566 3HG2 THR 70 3HG2 THR 70 4.151 9.940 -5.703 567 H SER 71 H SER 71 1.837 12.622 -9.215 568 HA SER 71 HA SER 71 -0.244 10.815 -8.746 569 1HB SER 71 2HB SER 71 -0.445 11.212 -11.420 570 2HB SER 71 1HB SER 71 -0.996 12.375 -10.214 571 HG SER 71 HG SER 71 0.504 13.691 -10.853 572 H LYS 72 H LYS 72 -0.184 8.679 -8.790 573 HA LYS 72 HA LYS 72 1.683 7.344 -10.628 574 1HB LYS 72 2HB LYS 72 0.373 6.328 -8.101 575 2HB LYS 72 1HB LYS 72 1.433 5.378 -9.134 576 1HG LYS 72 2HG LYS 72 2.434 7.965 -8.059 577 2HG LYS 72 1HG LYS 72 2.337 6.571 -6.981 578 1HD LYS 72 2HD LYS 72 3.685 5.269 -8.578 579 2HD LYS 72 1HD LYS 72 3.812 6.692 -9.613 580 1HE LYS 72 2HE LYS 72 5.516 5.950 -7.525 581 2HE LYS 72 1HE LYS 72 5.523 7.464 -8.426 582 1HZ LYS 72 1HZ LYS 72 4.007 8.404 -6.808 583 2HZ LYS 72 2HZ LYS 72 5.398 7.831 -6.035 584 3HZ LYS 72 3HZ LYS 72 3.960 6.944 -5.953 585 H LYS 73 H LYS 73 0.938 5.286 -11.584 586 HA LYS 73 HA LYS 73 -1.909 4.815 -11.752 587 1HB LYS 73 2HB LYS 73 -1.668 6.636 -13.363 588 2HB LYS 73 1HB LYS 73 -0.376 5.770 -14.180 589 1HG LYS 73 2HG LYS 73 -1.938 4.015 -14.822 590 2HG LYS 73 1HG LYS 73 -3.239 4.857 -13.978 591 1HD LYS 73 2HD LYS 73 -3.654 5.808 -15.966 592 2HD LYS 73 1HD LYS 73 -2.249 6.816 -15.612 593 1HE LYS 73 2HE LYS 73 -0.924 4.832 -16.675 594 2HE LYS 73 1HE LYS 73 -2.480 4.435 -17.403 595 1HZ LYS 73 1HZ LYS 73 -1.514 5.805 -18.964 596 2HZ LYS 73 2HZ LYS 73 -0.799 6.818 -17.813 597 3HZ LYS 73 3HZ LYS 73 -2.465 6.902 -18.093 598 H LEU 74 H LEU 74 -1.400 2.730 -11.037 599 HA LEU 74 HA LEU 74 0.579 1.056 -12.069 600 1HB LEU 74 2HB LEU 74 -0.426 0.353 -10.077 601 2HB LEU 74 1HB LEU 74 -2.047 0.546 -10.715 602 HG LEU 74 HG LEU 74 -0.609 -1.443 -12.230 603 1HD1 LEU 74 1HD1 LEU 74 0.200 -2.871 -10.701 604 2HD1 LEU 74 2HD1 LEU 74 -1.077 -2.511 -9.538 605 3HD1 LEU 74 3HD1 LEU 74 0.313 -1.434 -9.684 606 1HD2 LEU 74 1HD2 LEU 74 -3.148 -0.936 -11.793 607 2HD2 LEU 74 2HD2 LEU 74 -2.910 -2.035 -10.434 608 3HD2 LEU 74 3HD2 LEU 74 -2.589 -2.585 -12.079 609 H THR 75 H THR 75 0.826 0.175 -14.020 610 HA THR 75 HA THR 75 -1.578 -0.336 -15.645 611 HB THR 75 HB THR 75 0.904 0.278 -17.124 612 HG1 THR 75 1HG THR 75 -0.481 2.557 -16.371 613 1HG2 THR 75 1HG2 THR 75 -1.733 1.583 -17.586 614 2HG2 THR 75 2HG2 THR 75 -1.588 -0.146 -17.904 615 3HG2 THR 75 3HG2 THR 75 -0.546 0.997 -18.751 616 H GLN 76 H GLN 76 -0.697 -1.664 -17.720 617 HA GLN 76 HA GLN 76 -0.048 -4.220 -16.725 618 1HB GLN 76 2HB GLN 76 0.316 -4.716 -19.233 619 2HB GLN 76 1HB GLN 76 -1.291 -4.240 -18.701 620 1HG GLN 76 2HG GLN 76 -0.753 -1.910 -19.399 621 2HG GLN 76 1HG GLN 76 0.753 -2.521 -20.083 622 1HE2 GLN 76 1HE2 GLN 76 0.448 -2.294 -22.204 623 2HE2 GLN 76 2HE2 GLN 76 -0.860 -2.979 -23.100 624 H LYS 77 H LYS 77 1.862 -1.749 -18.386 625 HA LYS 77 HA LYS 77 4.215 -3.226 -18.726 626 1HB LYS 77 2HB LYS 77 3.392 -0.655 -19.301 627 2HB LYS 77 1HB LYS 77 4.658 -0.402 -18.107 628 1HG LYS 77 2HG LYS 77 5.990 -2.080 -19.613 629 2HG LYS 77 1HG LYS 77 4.833 -1.564 -20.841 630 1HD LYS 77 2HD LYS 77 6.336 0.077 -21.203 631 2HD LYS 77 1HD LYS 77 5.558 0.828 -19.808 632 1HE LYS 77 2HE LYS 77 7.926 0.903 -19.472 633 2HE LYS 77 1HE LYS 77 7.249 -0.280 -18.354 634 1HZ LYS 77 1HZ LYS 77 9.315 -0.693 -20.092 635 2HZ LYS 77 2HZ LYS 77 8.007 -1.464 -20.838 636 3HZ LYS 77 3HZ LYS 77 8.454 -1.891 -19.263 637 H LEU 78 H LEU 78 3.191 -1.122 -16.051 638 HA LEU 78 HA LEU 78 5.531 -1.450 -14.500 639 1HB LEU 78 2HB LEU 78 2.732 -0.559 -13.905 640 2HB LEU 78 1HB LEU 78 3.872 -0.806 -12.597 641 HG LEU 78 HG LEU 78 4.494 1.009 -14.913 642 1HD1 LEU 78 1HD1 LEU 78 3.874 2.728 -12.948 643 2HD1 LEU 78 2HD1 LEU 78 2.703 1.453 -12.613 644 3HD1 LEU 78 3HD1 LEU 78 2.734 2.227 -14.197 645 1HD2 LEU 78 1HD2 LEU 78 5.514 1.494 -12.194 646 2HD2 LEU 78 2HD2 LEU 78 6.330 1.611 -13.753 647 3HD2 LEU 78 3HD2 LEU 78 6.112 0.037 -12.987 648 H CYS 79 H CYS 79 2.486 -3.208 -14.667 649 HA CYS 79 HA CYS 79 2.817 -4.838 -12.408 650 1HB CYS 79 2HB CYS 79 0.675 -4.677 -13.527 651 2HB CYS 79 1HB CYS 79 1.352 -5.355 -15.004 652 HG CYS 79 HG CYS 79 0.914 -7.030 -12.050 653 H ASP 80 H ASP 80 3.748 -5.326 -15.793 654 HA ASP 80 HA ASP 80 4.794 -7.918 -15.499 655 1HB ASP 80 2HB ASP 80 4.620 -5.949 -17.563 656 2HB ASP 80 1HB ASP 80 6.277 -6.543 -17.499 657 H GLU 81 H GLU 81 5.983 -4.863 -14.512 658 HA GLU 81 HA GLU 81 8.763 -5.625 -14.430 659 1HB GLU 81 2HB GLU 81 7.291 -3.252 -13.274 660 2HB GLU 81 1HB GLU 81 9.033 -3.467 -13.195 661 1HG GLU 81 2HG GLU 81 9.241 -3.312 -15.558 662 2HG GLU 81 1HG GLU 81 7.493 -3.374 -15.773 663 H SER 82 H SER 82 6.360 -4.801 -11.909 664 HA SER 82 HA SER 82 7.954 -5.762 -9.779 665 1HB SER 82 2HB SER 82 5.142 -4.858 -10.105 666 2HB SER 82 1HB SER 82 5.509 -5.846 -8.691 667 HG SER 82 HG SER 82 6.191 -4.038 -7.872 668 H ASP 83 H ASP 83 7.834 -7.661 -8.594 669 HA ASP 83 HA ASP 83 6.769 -9.942 -10.083 670 1HB ASP 83 2HB ASP 83 9.087 -9.487 -8.394 671 2HB ASP 83 1HB ASP 83 8.186 -10.911 -7.880 672 H PHE 84 H PHE 84 6.218 -8.090 -7.231 673 HA PHE 84 HA PHE 84 4.157 -10.030 -6.412 674 1HB PHE 84 2HB PHE 84 6.094 -8.503 -4.684 675 2HB PHE 84 1HB PHE 84 4.589 -9.152 -4.042 676 HD1 PHE 84 1HD PHE 84 7.913 -9.947 -5.303 677 HD2 PHE 84 2HD PHE 84 4.251 -11.549 -3.844 678 HE1 PHE 84 1HE PHE 84 9.006 -12.126 -4.963 679 HE2 PHE 84 2HE PHE 84 5.337 -13.730 -3.500 680 HZ PHE 84 HZ PHE 84 7.718 -14.020 -4.058 681 H LEU 85 H LEU 85 2.172 -9.223 -6.412 682 HA LEU 85 HA LEU 85 1.841 -6.298 -6.361 683 1HB LEU 85 2HB LEU 85 -0.237 -8.275 -7.266 684 2HB LEU 85 1HB LEU 85 -0.155 -6.556 -7.602 685 HG LEU 85 HG LEU 85 1.958 -8.417 -8.640 686 1HD1 LEU 85 1HD1 LEU 85 -0.675 -8.812 -9.241 687 2HD1 LEU 85 2HD1 LEU 85 0.683 -9.238 -10.283 688 3HD1 LEU 85 3HD1 LEU 85 -0.164 -7.709 -10.518 689 1HD2 LEU 85 1HD2 LEU 85 2.760 -6.502 -9.422 690 2HD2 LEU 85 2HD2 LEU 85 1.351 -5.618 -8.835 691 3HD2 LEU 85 3HD2 LEU 85 1.323 -6.360 -10.435 692 H ILE 86 H ILE 86 0.570 -5.340 -4.842 693 HA ILE 86 HA ILE 86 -0.925 -7.077 -3.007 694 HB ILE 86 HB ILE 86 1.023 -4.931 -2.168 695 1HG1 ILE 86 2HG1 ILE 86 0.979 -7.834 -1.357 696 2HG1 ILE 86 1HG1 ILE 86 1.843 -7.280 -2.786 697 1HG2 ILE 86 1HG2 ILE 86 -1.192 -5.048 -0.896 698 2HG2 ILE 86 2HG2 ILE 86 0.295 -5.146 0.046 699 3HG2 ILE 86 3HG2 ILE 86 -0.626 -6.609 -0.303 700 1HD1 ILE 86 1HD1 ILE 86 3.578 -6.741 -1.536 701 2HD1 ILE 86 2HD1 ILE 86 2.720 -7.319 -0.109 702 3HD1 ILE 86 3HD1 ILE 86 2.581 -5.630 -0.596 703 H THR 87 H THR 87 -2.933 -6.483 -2.961 704 HA THR 87 HA THR 87 -3.622 -3.656 -3.381 705 HB THR 87 HB THR 87 -5.965 -4.576 -3.760 706 HG1 THR 87 1HG THR 87 -6.241 -6.703 -3.849 707 1HG2 THR 87 1HG2 THR 87 -3.662 -5.163 -5.598 708 2HG2 THR 87 2HG2 THR 87 -4.835 -3.849 -5.681 709 3HG2 THR 87 3HG2 THR 87 -5.327 -5.497 -6.071 710 H MET 88 H MET 88 -5.231 -2.715 -2.013 711 HA MET 88 HA MET 88 -5.484 -4.080 0.583 712 1HB MET 88 2HB MET 88 -4.104 -1.753 0.113 713 2HB MET 88 1HB MET 88 -5.671 -1.147 0.633 714 1HG MET 88 2HG MET 88 -5.317 -1.724 2.752 715 2HG MET 88 1HG MET 88 -4.662 -3.300 2.309 716 1HE MET 88 1HE MET 88 -2.402 -3.663 1.342 717 2HE MET 88 2HE MET 88 -0.961 -2.744 1.777 718 3HE MET 88 3HE MET 88 -1.955 -2.231 0.414 719 H ASP 89 H ASP 89 -7.058 -2.245 -1.915 720 HA ASP 89 HA ASP 89 -9.486 -1.829 -0.410 721 1HB ASP 89 2HB ASP 89 -9.547 -1.621 -3.366 722 2HB ASP 89 1HB ASP 89 -10.159 -0.512 -2.142 723 H ASN 90 H ASN 90 -11.274 -3.079 -0.402 724 HA ASN 90 HA ASN 90 -11.119 -5.776 -1.087 725 1HB ASN 90 2HB ASN 90 -13.472 -3.994 -0.473 726 2HB ASN 90 1HB ASN 90 -13.654 -5.719 -0.778 727 1HD2 ASN 90 1HD2 ASN 90 -11.770 -3.463 1.202 728 2HD2 ASN 90 2HD2 ASN 90 -11.754 -4.451 2.619 729 H SER 91 H SER 91 -12.916 -3.168 -2.721 730 HA SER 91 HA SER 91 -13.871 -4.755 -4.840 731 1HB SER 91 2HB SER 91 -13.422 -1.776 -4.604 732 2HB SER 91 1HB SER 91 -14.173 -2.526 -6.012 733 HG SER 91 HG SER 91 -15.634 -3.505 -4.336 734 H ASN 92 H ASN 92 -10.896 -2.948 -4.390 735 HA ASN 92 HA ASN 92 -9.946 -2.981 -7.022 736 1HB ASN 92 2HB ASN 92 -9.039 -1.797 -4.869 737 2HB ASN 92 1HB ASN 92 -8.072 -3.261 -4.703 738 1HD2 ASN 92 1HD2 ASN 92 -8.658 -0.405 -6.575 739 2HD2 ASN 92 2HD2 ASN 92 -7.222 -0.489 -7.532 740 H PHE 93 H PHE 93 -9.938 -5.438 -4.535 741 HA PHE 93 HA PHE 93 -8.009 -7.154 -5.674 742 1HB PHE 93 2HB PHE 93 -8.691 -7.419 -3.363 743 2HB PHE 93 1HB PHE 93 -10.348 -7.760 -3.853 744 HD1 PHE 93 1HD PHE 93 -6.935 -9.036 -4.686 745 HD2 PHE 93 2HD PHE 93 -10.972 -9.954 -3.698 746 HE1 PHE 93 1HE PHE 93 -6.410 -11.437 -4.787 747 HE2 PHE 93 2HE PHE 93 -10.453 -12.357 -3.795 748 HZ PHE 93 HZ PHE 93 -8.170 -13.101 -4.340 749 H LYS 94 H LYS 94 -11.564 -7.204 -5.856 750 HA LYS 94 HA LYS 94 -11.741 -9.413 -7.593 751 1HB LYS 94 2HB LYS 94 -13.536 -7.983 -6.169 752 2HB LYS 94 1HB LYS 94 -13.844 -7.339 -7.775 753 1HG LYS 94 2HG LYS 94 -14.637 -9.334 -8.575 754 2HG LYS 94 1HG LYS 94 -13.713 -10.291 -7.415 755 1HD LYS 94 2HD LYS 94 -15.908 -10.487 -6.656 756 2HD LYS 94 1HD LYS 94 -15.233 -9.213 -5.637 757 1HE LYS 94 2HE LYS 94 -16.266 -7.970 -7.954 758 2HE LYS 94 1HE LYS 94 -17.487 -9.111 -7.390 759 1HZ LYS 94 1HZ LYS 94 -17.643 -6.839 -6.418 760 2HZ LYS 94 2HZ LYS 94 -16.175 -7.119 -5.627 761 3HZ LYS 94 3HZ LYS 94 -17.522 -8.078 -5.271 762 H ASN 95 H ASN 95 -11.464 -5.953 -8.188 763 HA ASN 95 HA ASN 95 -11.978 -6.045 -10.969 764 1HB ASN 95 2HB ASN 95 -11.174 -4.066 -9.012 765 2HB ASN 95 1HB ASN 95 -10.291 -3.860 -10.521 766 1HD2 ASN 95 1HD2 ASN 95 -13.565 -4.363 -9.274 767 2HD2 ASN 95 2HD2 ASN 95 -14.353 -3.374 -10.451 768 H VAL 96 H VAL 96 -8.895 -5.746 -9.198 769 HA VAL 96 HA VAL 96 -7.233 -5.919 -11.442 770 HB VAL 96 HB VAL 96 -6.578 -5.176 -9.109 771 1HG1 VAL 96 1HG1 VAL 96 -7.168 -6.800 -7.607 772 2HG1 VAL 96 2HG1 VAL 96 -5.475 -7.220 -7.867 773 3HG1 VAL 96 3HG1 VAL 96 -6.744 -8.120 -8.698 774 1HG2 VAL 96 1HG2 VAL 96 -4.527 -7.124 -9.968 775 2HG2 VAL 96 2HG2 VAL 96 -4.394 -5.391 -9.664 776 3HG2 VAL 96 3HG2 VAL 96 -5.081 -5.971 -11.182 777 H LEU 97 H LEU 97 -8.887 -8.387 -9.653 778 HA LEU 97 HA LEU 97 -7.301 -10.607 -10.307 779 1HB LEU 97 2HB LEU 97 -9.298 -10.403 -8.678 780 2HB LEU 97 1HB LEU 97 -10.289 -10.748 -10.082 781 HG LEU 97 HG LEU 97 -8.311 -12.731 -10.081 782 1HD1 LEU 97 1HD1 LEU 97 -9.527 -12.561 -7.339 783 2HD1 LEU 97 2HD1 LEU 97 -7.906 -11.971 -7.704 784 3HD1 LEU 97 3HD1 LEU 97 -8.294 -13.678 -7.923 785 1HD2 LEU 97 1HD2 LEU 97 -11.230 -12.580 -9.494 786 2HD2 LEU 97 2HD2 LEU 97 -10.373 -14.098 -9.232 787 3HD2 LEU 97 3HD2 LEU 97 -10.388 -13.359 -10.833 788 H LYS 98 H LYS 98 -9.944 -9.034 -12.035 789 HA LYS 98 HA LYS 98 -9.567 -10.880 -14.288 790 1HB LYS 98 2HB LYS 98 -11.869 -10.410 -13.263 791 2HB LYS 98 1HB LYS 98 -11.752 -8.824 -14.012 792 1HG LYS 98 2HG LYS 98 -11.162 -10.503 -16.094 793 2HG LYS 98 1HG LYS 98 -12.377 -11.413 -15.192 794 1HD LYS 98 2HD LYS 98 -12.731 -8.524 -15.963 795 2HD LYS 98 1HD LYS 98 -13.256 -9.861 -16.989 796 1HE LYS 98 2HE LYS 98 -14.120 -9.588 -14.121 797 2HE LYS 98 1HE LYS 98 -15.000 -8.829 -15.446 798 1HZ LYS 98 1HZ LYS 98 -14.400 -11.728 -15.413 799 2HZ LYS 98 2HZ LYS 98 -15.532 -10.905 -16.361 800 3HZ LYS 98 3HZ LYS 98 -15.797 -11.091 -14.700 801 H ASN 99 H ASN 99 -8.541 -7.903 -13.242 802 HA ASN 99 HA ASN 99 -8.672 -6.418 -15.673 803 1HB ASN 99 2HB ASN 99 -8.201 -5.743 -13.094 804 2HB ASN 99 1HB ASN 99 -6.557 -5.737 -13.724 805 1HD2 ASN 99 1HD2 ASN 99 -9.700 -4.274 -13.894 806 2HD2 ASN 99 2HD2 ASN 99 -9.223 -2.873 -14.786 807 H PHE 100 H PHE 100 -6.081 -8.256 -14.065 808 HA PHE 100 HA PHE 100 -4.426 -7.923 -16.464 809 1HB PHE 100 2HB PHE 100 -3.761 -8.813 -13.659 810 2HB PHE 100 1HB PHE 100 -2.616 -8.912 -14.991 811 HD1 PHE 100 1HD PHE 100 -3.269 -6.347 -16.392 812 HD2 PHE 100 2HD PHE 100 -2.760 -7.244 -12.261 813 HE1 PHE 100 1HE PHE 100 -2.590 -4.019 -15.973 814 HE2 PHE 100 2HE PHE 100 -2.081 -4.918 -11.837 815 HZ PHE 100 HZ PHE 100 -1.996 -3.302 -13.693 816 H THR 101 H THR 101 -2.860 -9.971 -16.639 817 HA THR 101 HA THR 101 -4.455 -12.053 -17.700 818 HB THR 101 HB THR 101 -2.279 -13.255 -18.012 819 HG1 THR 101 1HG THR 101 -1.480 -11.335 -16.236 820 1HG2 THR 101 1HG2 THR 101 -3.205 -10.871 -19.227 821 2HG2 THR 101 2HG2 THR 101 -2.197 -12.134 -19.933 822 3HG2 THR 101 3HG2 THR 101 -1.448 -10.759 -19.120 823 H ASN 102 H ASN 102 -3.216 -14.400 -17.073 824 HA ASN 102 HA ASN 102 -4.546 -15.209 -14.736 825 1HB ASN 102 2HB ASN 102 -3.779 -16.603 -16.771 826 2HB ASN 102 1HB ASN 102 -2.241 -16.731 -15.923 827 1HD2 ASN 102 1HD2 ASN 102 -5.670 -16.918 -15.021 828 2HD2 ASN 102 2HD2 ASN 102 -5.535 -18.405 -14.152 829 H THR 103 H THR 103 -2.075 -13.184 -14.696 830 HA THR 103 HA THR 103 -0.482 -14.458 -12.623 831 HB THR 103 HB THR 103 0.658 -13.110 -14.352 832 HG1 THR 103 1HG THR 103 0.944 -12.884 -11.690 833 1HG2 THR 103 1HG2 THR 103 0.460 -10.660 -14.309 834 2HG2 THR 103 2HG2 THR 103 -0.826 -10.791 -13.109 835 3HG2 THR 103 3HG2 THR 103 -1.069 -11.428 -14.736 836 H GLN 104 H GLN 104 -3.396 -13.243 -12.564 837 HA GLN 104 HA GLN 104 -3.368 -11.194 -10.622 838 1HB GLN 104 2HB GLN 104 -5.794 -12.163 -10.224 839 2HB GLN 104 1HB GLN 104 -5.398 -11.279 -11.691 840 1HG GLN 104 2HG GLN 104 -6.210 -13.010 -12.808 841 2HG GLN 104 1HG GLN 104 -4.763 -13.889 -12.318 842 1HE2 GLN 104 1HE2 GLN 104 -7.025 -15.267 -12.871 843 2HE2 GLN 104 2HE2 GLN 104 -7.705 -15.914 -11.420 844 H ASN 105 H ASN 105 -2.581 -14.440 -10.360 845 HA ASN 105 HA ASN 105 -3.547 -14.881 -7.686 846 1HB ASN 105 2HB ASN 105 -2.938 -16.606 -9.605 847 2HB ASN 105 1HB ASN 105 -1.345 -16.524 -8.858 848 1HD2 ASN 105 1HD2 ASN 105 -2.136 -18.886 -8.683 849 2HD2 ASN 105 2HD2 ASN 105 -2.878 -19.301 -7.179 850 H LYS 106 H LYS 106 -1.318 -12.826 -8.745 851 HA LYS 106 HA LYS 106 0.614 -13.353 -6.595 852 1HB LYS 106 2HB LYS 106 0.870 -12.410 -9.294 853 2HB LYS 106 1HB LYS 106 1.479 -11.185 -8.190 854 1HG LYS 106 2HG LYS 106 3.386 -12.319 -8.199 855 2HG LYS 106 1HG LYS 106 2.560 -13.519 -7.204 856 1HD LYS 106 2HD LYS 106 2.107 -14.898 -9.039 857 2HD LYS 106 1HD LYS 106 2.393 -13.599 -10.200 858 1HE LYS 106 2HE LYS 106 4.513 -14.841 -8.451 859 2HE LYS 106 1HE LYS 106 4.210 -15.287 -10.130 860 1HZ LYS 106 1HZ LYS 106 6.005 -13.498 -9.475 861 2HZ LYS 106 2HZ LYS 106 4.670 -12.462 -9.539 862 3HZ LYS 106 3HZ LYS 106 5.104 -13.364 -10.901 863 H VAL 107 H VAL 107 -2.169 -11.869 -6.760 864 HA VAL 107 HA VAL 107 -1.368 -9.293 -5.639 865 HB VAL 107 HB VAL 107 -4.203 -10.233 -5.998 866 1HG1 VAL 107 1HG1 VAL 107 -3.596 -7.455 -6.532 867 2HG1 VAL 107 2HG1 VAL 107 -3.089 -7.940 -4.915 868 3HG1 VAL 107 3HG1 VAL 107 -4.765 -8.160 -5.416 869 1HG2 VAL 107 1HG2 VAL 107 -3.907 -10.320 -8.202 870 2HG2 VAL 107 2HG2 VAL 107 -2.247 -9.744 -8.060 871 3HG2 VAL 107 3HG2 VAL 107 -3.574 -8.588 -8.161 872 H LEU 108 H LEU 108 -1.725 -8.674 -3.546 873 HA LEU 108 HA LEU 108 -2.810 -10.725 -1.728 874 1HB LEU 108 2HB LEU 108 -0.405 -8.948 -1.386 875 2HB LEU 108 1HB LEU 108 -1.181 -9.742 -0.029 876 HG LEU 108 HG LEU 108 -0.797 -11.920 -1.417 877 1HD1 LEU 108 1HD1 LEU 108 0.411 -11.795 -3.272 878 2HD1 LEU 108 2HD1 LEU 108 1.683 -10.900 -2.441 879 3HD1 LEU 108 3HD1 LEU 108 0.323 -10.037 -3.157 880 1HD2 LEU 108 1HD2 LEU 108 0.376 -10.934 0.731 881 2HD2 LEU 108 2HD2 LEU 108 1.745 -10.786 -0.371 882 3HD2 LEU 108 3HD2 LEU 108 1.006 -12.363 -0.088 883 H LYS 109 H LYS 109 -4.658 -10.033 -0.911 884 HA LYS 109 HA LYS 109 -5.227 -7.205 -0.638 885 1HB LYS 109 2HB LYS 109 -7.460 -8.279 0.282 886 2HB LYS 109 1HB LYS 109 -7.125 -8.219 -1.443 887 1HG LYS 109 2HG LYS 109 -7.082 -10.438 -1.617 888 2HG LYS 109 1HG LYS 109 -6.070 -10.616 -0.181 889 1HD LYS 109 2HD LYS 109 -8.297 -10.000 1.070 890 2HD LYS 109 1HD LYS 109 -9.044 -10.576 -0.423 891 1HE LYS 109 2HE LYS 109 -6.996 -12.402 0.414 892 2HE LYS 109 1HE LYS 109 -8.109 -12.104 1.748 893 1HZ LYS 109 1HZ LYS 109 -9.942 -12.749 0.377 894 2HZ LYS 109 2HZ LYS 109 -8.776 -13.972 0.306 895 3HZ LYS 109 3HZ LYS 109 -8.951 -12.894 -0.987 896 H ILE 110 H ILE 110 -5.690 -6.168 1.292 897 HA ILE 110 HA ILE 110 -4.220 -6.987 3.555 898 HB ILE 110 HB ILE 110 -4.829 -4.620 2.927 899 1HG1 ILE 110 2HG1 ILE 110 -4.868 -3.847 5.219 900 2HG1 ILE 110 1HG1 ILE 110 -5.492 -5.398 5.773 901 1HG2 ILE 110 1HG2 ILE 110 -7.444 -5.363 4.229 902 2HG2 ILE 110 2HG2 ILE 110 -7.202 -4.967 2.527 903 3HG2 ILE 110 3HG2 ILE 110 -6.948 -3.736 3.763 904 1HD1 ILE 110 1HD1 ILE 110 -2.869 -5.280 4.360 905 2HD1 ILE 110 2HD1 ILE 110 -3.457 -6.446 5.547 906 3HD1 ILE 110 3HD1 ILE 110 -2.980 -4.827 6.061 907 H THR 111 H THR 111 -7.361 -7.825 2.503 908 HA THR 111 HA THR 111 -8.686 -8.223 4.937 909 HB THR 111 HB THR 111 -9.030 -9.996 2.521 910 HG1 THR 111 1HG THR 111 -10.785 -8.063 2.407 911 1HG2 THR 111 1HG2 THR 111 -11.341 -9.032 4.064 912 2HG2 THR 111 2HG2 THR 111 -10.252 -10.103 4.945 913 3HG2 THR 111 3HG2 THR 111 -10.989 -10.641 3.435 914 H ASP 112 H ASP 112 -6.463 -10.281 3.135 915 HA ASP 112 HA ASP 112 -6.739 -12.490 4.968 916 1HB ASP 112 2HB ASP 112 -5.902 -12.260 2.355 917 2HB ASP 112 1HB ASP 112 -4.387 -12.499 3.218 918 H PHE 113 H PHE 113 -5.200 -9.572 5.164 919 HA PHE 113 HA PHE 113 -3.187 -10.652 7.023 920 1HB PHE 113 2HB PHE 113 -2.936 -8.421 5.021 921 2HB PHE 113 1HB PHE 113 -1.876 -8.517 6.424 922 HD1 PHE 113 1HD PHE 113 -2.907 -10.218 3.324 923 HD2 PHE 113 2HD PHE 113 -0.098 -10.078 6.518 924 HE1 PHE 113 1HE PHE 113 -1.452 -11.785 2.107 925 HE2 PHE 113 2HE PHE 113 1.363 -11.644 5.307 926 HZ PHE 113 HZ PHE 113 0.687 -12.499 3.098 927 H SER 114 H SER 114 -6.024 -9.342 7.130 928 HA SER 114 HA SER 114 -5.424 -7.789 9.518 929 1HB SER 114 2HB SER 114 -6.992 -6.705 7.173 930 2HB SER 114 1HB SER 114 -7.049 -5.998 8.789 931 HG SER 114 HG SER 114 -4.677 -6.367 7.281 932 HA PRO 115 HA PRO 115 -8.733 -10.777 10.451 933 1HB PRO 115 2HB PRO 115 -8.131 -9.743 13.171 934 2HB PRO 115 1HB PRO 115 -8.255 -11.411 12.599 935 1HG PRO 115 2HG PRO 115 -5.880 -10.331 13.122 936 2HG PRO 115 1HG PRO 115 -6.100 -11.413 11.734 937 1HD PRO 115 2HD PRO 115 -5.896 -8.429 11.801 938 2HD PRO 115 1HD PRO 115 -5.216 -9.579 10.631 939 H SER 116 H SER 116 -9.048 -8.631 13.155 940 HA SER 116 HA SER 116 -11.764 -8.059 12.462 941 1HB SER 116 2HB SER 116 -10.906 -6.412 14.627 942 2HB SER 116 1HB SER 116 -11.930 -7.847 14.679 943 HG SER 116 HG SER 116 -9.092 -7.811 14.748 944 H LEU 117 H LEU 117 -9.208 -6.816 11.065 945 HA LEU 117 HA LEU 117 -9.963 -4.002 11.258 946 1HB LEU 117 2HB LEU 117 -7.553 -5.448 10.586 947 2HB LEU 117 1HB LEU 117 -7.946 -4.284 9.334 948 HG LEU 117 HG LEU 117 -7.443 -3.724 12.254 949 1HD1 LEU 117 1HD1 LEU 117 -5.517 -2.608 11.558 950 2HD1 LEU 117 2HD1 LEU 117 -6.056 -2.533 9.880 951 3HD1 LEU 117 3HD1 LEU 117 -5.542 -4.072 10.574 952 1HD2 LEU 117 1HD2 LEU 117 -7.726 -1.303 11.465 953 2HD2 LEU 117 2HD2 LEU 117 -9.186 -2.251 11.752 954 3HD2 LEU 117 3HD2 LEU 117 -8.613 -1.990 10.104 955 H ASN 118 H ASN 118 -11.835 -5.785 10.099 956 HA ASN 118 HA ASN 118 -11.755 -5.805 7.282 957 1HB ASN 118 2HB ASN 118 -13.557 -6.634 9.346 958 2HB ASN 118 1HB ASN 118 -14.462 -5.745 8.125 959 1HD2 ASN 118 1HD2 ASN 118 -13.962 -6.399 5.838 960 2HD2 ASN 118 2HD2 ASN 118 -13.787 -8.089 5.530 961 H TYR 119 H TYR 119 -11.252 -3.787 6.458 962 HA TYR 119 HA TYR 119 -13.275 -1.684 6.874 963 1HB TYR 119 2HB TYR 119 -11.660 -0.053 6.776 964 2HB TYR 119 1HB TYR 119 -10.727 -1.357 7.494 965 HD1 TYR 119 1HD TYR 119 -9.905 -3.021 5.308 966 HD2 TYR 119 2HD TYR 119 -10.321 1.213 5.405 967 HE1 TYR 119 1HE TYR 119 -8.255 -2.821 3.492 968 HE2 TYR 119 2HE TYR 119 -8.673 1.423 3.594 969 HH TYR 119 HH TYR 119 -7.812 -0.925 1.608 970 H ASP 120 H ASP 120 -13.366 -0.148 4.902 971 HA ASP 120 HA ASP 120 -13.849 -1.827 2.567 972 1HB ASP 120 2HB ASP 120 -15.449 -0.008 3.633 973 2HB ASP 120 1HB ASP 120 -14.504 1.089 2.629 974 H GLU 121 H GLU 121 -13.678 0.663 0.865 975 HA GLU 121 HA GLU 121 -10.874 0.357 0.191 976 1HB GLU 121 2HB GLU 121 -13.049 1.966 -1.158 977 2HB GLU 121 1HB GLU 121 -11.432 1.708 -1.794 978 1HG GLU 121 2HG GLU 121 -12.276 -0.030 -2.877 979 2HG GLU 121 1HG GLU 121 -12.343 -0.846 -1.315 980 H VAL 122 H VAL 122 -9.602 1.455 1.575 981 HA VAL 122 HA VAL 122 -8.490 3.226 2.471 982 HB VAL 122 HB VAL 122 -10.344 4.960 0.828 983 1HG1 VAL 122 1HG1 VAL 122 -8.470 6.615 1.060 984 2HG1 VAL 122 2HG1 VAL 122 -7.780 5.553 2.289 985 3HG1 VAL 122 3HG1 VAL 122 -9.365 6.283 2.543 986 1HG2 VAL 122 1HG2 VAL 122 -9.230 4.227 -0.949 987 2HG2 VAL 122 2HG2 VAL 122 -8.163 3.254 0.064 988 3HG2 VAL 122 3HG2 VAL 122 -7.766 4.939 -0.270 989 HA PRO 123 HA PRO 123 -11.141 3.970 5.959 990 1HB PRO 123 2HB PRO 123 -8.949 5.502 7.128 991 2HB PRO 123 1HB PRO 123 -9.601 3.939 7.622 992 1HG PRO 123 2HG PRO 123 -7.146 4.212 6.515 993 2HG PRO 123 1HG PRO 123 -8.143 2.762 6.294 994 1HD PRO 123 2HD PRO 123 -7.721 5.074 4.434 995 2HD PRO 123 1HD PRO 123 -7.773 3.334 4.074 996 H ASP 124 H ASP 124 -10.043 6.522 7.414 997 HA ASP 124 HA ASP 124 -10.583 8.721 7.594 998 1HB ASP 124 2HB ASP 124 -9.862 9.844 5.806 999 2HB ASP 124 1HB ASP 124 -9.937 8.367 4.850 1000 HA PRO 125 HA PRO 125 -14.921 8.894 8.203 1001 1HB PRO 125 2HB PRO 125 -15.448 11.565 7.754 1002 2HB PRO 125 1HB PRO 125 -14.813 10.895 9.259 1003 1HG PRO 125 2HG PRO 125 -13.360 12.222 7.011 1004 2HG PRO 125 1HG PRO 125 -13.103 12.375 8.759 1005 1HD PRO 125 2HD PRO 125 -11.494 10.868 7.230 1006 2HD PRO 125 1HD PRO 125 -11.920 10.387 8.887 1007 H TRP 126 H TRP 126 -13.748 10.462 5.258 1008 HA TRP 126 HA TRP 126 -16.199 10.730 3.937 1009 1HB TRP 126 2HB TRP 126 -14.189 11.819 3.109 1010 2HB TRP 126 1HB TRP 126 -13.438 10.259 2.791 1011 HD1 TRP 126 HD TRP 126 -13.753 9.304 0.422 1012 HE1 TRP 126 1HE TRP 126 -15.210 9.907 -1.613 1013 HE3 TRP 126 3HE TRP 126 -16.702 12.889 2.564 1014 HZ2 TRP 126 2HZ TRP 126 -17.326 11.665 -2.229 1015 HZ3 TRP 126 3HZ TRP 126 -18.419 13.983 1.182 1016 HH2 TRP 126 HH TRP 126 -18.723 13.383 -1.164 1017 H TYR 127 H TYR 127 -14.269 7.933 4.563 1018 HA TYR 127 HA TYR 127 -15.968 6.349 2.752 1019 1HB TYR 127 2HB TYR 127 -13.198 5.780 3.810 1020 2HB TYR 127 1HB TYR 127 -14.159 4.622 2.897 1021 HD1 TYR 127 1HD TYR 127 -15.167 5.787 0.625 1022 HD2 TYR 127 2HD TYR 127 -11.552 6.840 2.607 1023 HE1 TYR 127 1HE TYR 127 -14.289 6.710 -1.477 1024 HE2 TYR 127 2HE TYR 127 -10.663 7.771 0.512 1025 HH TYR 127 HH TYR 127 -11.460 8.631 -1.603 1026 H SER 128 H SER 128 -14.182 5.907 5.822 1027 HA SER 128 HA SER 128 -16.063 3.874 6.655 1028 1HB SER 128 2HB SER 128 -13.915 5.010 8.423 1029 2HB SER 128 1HB SER 128 -14.566 3.371 8.378 1030 HG SER 128 HG SER 128 -13.251 4.379 6.116 1031 H GLY 129 H GLY 129 -14.932 6.950 8.101 1032 1HA GLY 129 2HA GLY 129 -17.089 8.341 8.620 1033 2HA GLY 129 1HA GLY 129 -17.383 6.998 9.712 1034 H ASN 130 H ASN 130 -14.306 6.904 10.062 1035 HA ASN 130 HA ASN 130 -14.106 9.227 11.860 1036 1HB ASN 130 2HB ASN 130 -14.533 6.792 12.847 1037 2HB ASN 130 1HB ASN 130 -12.787 6.675 12.650 1038 1HD2 ASN 130 1HD2 ASN 130 -11.535 8.518 13.571 1039 2HD2 ASN 130 2HD2 ASN 130 -12.062 9.153 15.090 1040 H PHE 131 H PHE 131 -11.854 9.719 12.518 1041 HA PHE 131 HA PHE 131 -10.118 9.605 10.192 1042 1HB PHE 131 2HB PHE 131 -9.274 10.967 12.706 1043 2HB PHE 131 1HB PHE 131 -9.055 11.464 11.032 1044 HD1 PHE 131 1HD PHE 131 -10.818 12.648 9.843 1045 HD2 PHE 131 2HD PHE 131 -11.267 11.533 13.926 1046 HE1 PHE 131 1HE PHE 131 -12.718 14.198 10.054 1047 HE2 PHE 131 2HE PHE 131 -13.167 13.080 14.144 1048 HZ PHE 131 HZ PHE 131 -13.895 14.415 12.206 1049 H ASP 132 H ASP 132 -10.150 8.541 13.553 1050 HA ASP 132 HA ASP 132 -7.533 7.640 13.800 1051 1HB ASP 132 2HB ASP 132 -9.902 7.498 15.321 1052 2HB ASP 132 1HB ASP 132 -9.331 5.840 15.151 1053 H GLU 133 H GLU 133 -10.133 6.339 11.960 1054 HA GLU 133 HA GLU 133 -9.480 3.639 11.838 1055 1HB GLU 133 2HB GLU 133 -10.435 5.106 9.404 1056 2HB GLU 133 1HB GLU 133 -10.862 3.496 9.963 1057 1HG GLU 133 2HG GLU 133 -11.618 5.541 11.866 1058 2HG GLU 133 1HG GLU 133 -12.338 5.808 10.277 1059 H THR 134 H THR 134 -8.400 6.269 9.690 1060 HA THR 134 HA THR 134 -6.850 4.886 7.914 1061 HB THR 134 HB THR 134 -5.437 6.910 7.703 1062 HG1 THR 134 1HG THR 134 -5.940 7.305 10.173 1063 1HG2 THR 134 1HG2 THR 134 -7.585 8.504 7.523 1064 2HG2 THR 134 2HG2 THR 134 -8.398 6.944 7.661 1065 3HG2 THR 134 3HG2 THR 134 -7.242 7.224 6.358 1066 H TYR 135 H TYR 135 -5.887 5.969 11.149 1067 HA TYR 135 HA TYR 135 -3.203 5.102 10.947 1068 1HB TYR 135 2HB TYR 135 -3.768 6.726 12.614 1069 2HB TYR 135 1HB TYR 135 -4.963 5.655 13.336 1070 HD1 TYR 135 1HD TYR 135 -4.363 4.609 15.297 1071 HD2 TYR 135 2HD TYR 135 -1.310 5.619 12.508 1072 HE1 TYR 135 1HE TYR 135 -2.664 3.757 16.856 1073 HE2 TYR 135 2HE TYR 135 0.397 4.768 14.060 1074 HH TYR 135 HH TYR 135 0.795 3.848 16.038 1075 H LYS 136 H LYS 136 -6.120 3.561 12.237 1076 HA LYS 136 HA LYS 136 -4.935 1.317 13.373 1077 1HB LYS 136 2HB LYS 136 -7.646 1.703 12.119 1078 2HB LYS 136 1HB LYS 136 -7.179 0.214 12.929 1079 1HG LYS 136 2HG LYS 136 -6.672 1.612 14.962 1080 2HG LYS 136 1HG LYS 136 -7.449 2.957 14.125 1081 1HD LYS 136 2HD LYS 136 -9.280 0.934 13.838 1082 2HD LYS 136 1HD LYS 136 -8.627 0.636 15.451 1083 1HE LYS 136 2HE LYS 136 -10.455 2.084 15.771 1084 2HE LYS 136 1HE LYS 136 -9.019 3.098 15.907 1085 1HZ LYS 136 1HZ LYS 136 -11.072 3.770 14.417 1086 2HZ LYS 136 2HZ LYS 136 -10.238 2.852 13.266 1087 3HZ LYS 136 3HZ LYS 136 -9.488 4.183 13.990 1088 H ILE 137 H ILE 137 -6.374 1.542 10.108 1089 HA ILE 137 HA ILE 137 -5.519 -1.043 9.328 1090 HB ILE 137 HB ILE 137 -5.780 0.639 7.023 1091 1HG1 ILE 137 2HG1 ILE 137 -6.995 2.085 8.748 1092 2HG1 ILE 137 1HG1 ILE 137 -7.892 1.652 7.299 1093 1HG2 ILE 137 1HG2 ILE 137 -6.386 -1.488 6.586 1094 2HG2 ILE 137 2HG2 ILE 137 -7.985 -0.869 6.994 1095 3HG2 ILE 137 3HG2 ILE 137 -7.047 -1.752 8.200 1096 1HD1 ILE 137 1HD1 ILE 137 -9.378 1.424 9.104 1097 2HD1 ILE 137 2HD1 ILE 137 -8.196 0.539 10.068 1098 3HD1 ILE 137 3HD1 ILE 137 -8.918 -0.215 8.646 1099 H LEU 138 H LEU 138 -4.245 2.177 8.463 1100 HA LEU 138 HA LEU 138 -2.160 1.337 6.843 1101 1HB LEU 138 2HB LEU 138 -2.715 3.768 8.446 1102 2HB LEU 138 1HB LEU 138 -1.069 3.545 7.887 1103 HG LEU 138 HG LEU 138 -2.365 4.952 6.356 1104 1HD1 LEU 138 1HD1 LEU 138 -0.626 3.855 5.270 1105 2HD1 LEU 138 2HD1 LEU 138 -2.034 3.489 4.273 1106 3HD1 LEU 138 3HD1 LEU 138 -1.411 2.281 5.396 1107 1HD2 LEU 138 1HD2 LEU 138 -4.565 3.868 6.833 1108 2HD2 LEU 138 2HD2 LEU 138 -4.057 2.517 5.820 1109 3HD2 LEU 138 3HD2 LEU 138 -4.235 4.127 5.120 1110 H SER 139 H SER 139 -2.097 1.874 10.365 1111 HA SER 139 HA SER 139 0.633 1.345 10.723 1112 1HB SER 139 2HB SER 139 -1.243 2.259 12.372 1113 2HB SER 139 1HB SER 139 -1.275 0.571 12.878 1114 HG SER 139 HG SER 139 0.744 0.729 13.611 1115 H LEU 140 H LEU 140 -2.138 -0.841 11.306 1116 HA LEU 140 HA LEU 140 -0.632 -3.119 11.894 1117 1HB LEU 140 2HB LEU 140 -3.361 -2.469 11.510 1118 2HB LEU 140 1HB LEU 140 -3.020 -3.863 10.505 1119 HG LEU 140 HG LEU 140 -1.848 -4.465 12.967 1120 1HD1 LEU 140 1HD1 LEU 140 -4.593 -3.933 13.773 1121 2HD1 LEU 140 2HD1 LEU 140 -3.660 -2.464 13.482 1122 3HD1 LEU 140 3HD1 LEU 140 -3.081 -3.661 14.641 1123 1HD2 LEU 140 1HD2 LEU 140 -3.827 -5.477 11.174 1124 2HD2 LEU 140 2HD2 LEU 140 -4.398 -5.663 12.833 1125 3HD2 LEU 140 3HD2 LEU 140 -2.846 -6.350 12.351 1126 H ALA 141 H ALA 141 -2.223 -2.311 8.814 1127 HA ALA 141 HA ALA 141 -1.327 -4.393 7.267 1128 1HB ALA 141 1HB ALA 141 -1.337 -1.821 5.866 1129 2HB ALA 141 2HB ALA 141 -2.789 -2.150 6.810 1130 3HB ALA 141 3HB ALA 141 -2.271 -3.285 5.564 1131 H CYS 142 H CYS 142 0.342 -1.314 7.870 1132 HA CYS 142 HA CYS 142 2.490 -1.713 6.126 1133 1HB CYS 142 2HB CYS 142 1.849 0.416 7.369 1134 2HB CYS 142 1HB CYS 142 2.698 -0.255 8.758 1135 HG CYS 142 HG CYS 142 5.116 0.274 7.989 1136 H LYS 143 H LYS 143 2.226 -2.484 9.590 1137 HA LYS 143 HA LYS 143 4.822 -3.521 9.870 1138 1HB LYS 143 2HB LYS 143 3.035 -2.871 11.661 1139 2HB LYS 143 1HB LYS 143 2.532 -4.548 11.505 1140 1HG LYS 143 2HG LYS 143 5.022 -5.093 11.911 1141 2HG LYS 143 1HG LYS 143 5.114 -3.442 12.525 1142 1HD LYS 143 2HD LYS 143 2.989 -4.198 13.894 1143 2HD LYS 143 1HD LYS 143 3.666 -5.805 13.618 1144 1HE LYS 143 2HE LYS 143 4.434 -4.871 15.742 1145 2HE LYS 143 1HE LYS 143 5.775 -5.100 14.620 1146 1HZ LYS 143 1HZ LYS 143 6.151 -3.002 15.468 1147 2HZ LYS 143 2HZ LYS 143 4.512 -2.589 15.502 1148 3HZ LYS 143 3HZ LYS 143 5.337 -2.651 14.027 1149 H ASN 144 H ASN 144 1.771 -5.366 9.756 1150 HA ASN 144 HA ASN 144 2.817 -7.894 9.562 1151 1HB ASN 144 2HB ASN 144 0.266 -6.635 9.014 1152 2HB ASN 144 1HB ASN 144 0.575 -7.957 7.893 1153 1HD2 ASN 144 1HD2 ASN 144 -0.496 -9.662 8.579 1154 2HD2 ASN 144 2HD2 ASN 144 -0.533 -10.253 10.203 1155 H LEU 145 H LEU 145 2.007 -5.735 6.850 1156 HA LEU 145 HA LEU 145 2.786 -7.487 4.802 1157 1HB LEU 145 2HB LEU 145 1.451 -5.287 4.676 1158 2HB LEU 145 1HB LEU 145 3.016 -4.500 4.593 1159 HG LEU 145 HG LEU 145 3.508 -5.965 2.580 1160 1HD1 LEU 145 1HD1 LEU 145 1.120 -6.499 1.493 1161 2HD1 LEU 145 2HD1 LEU 145 0.737 -6.776 3.192 1162 3HD1 LEU 145 3HD1 LEU 145 2.044 -7.678 2.424 1163 1HD2 LEU 145 1HD2 LEU 145 3.044 -3.660 2.244 1164 2HD2 LEU 145 2HD2 LEU 145 1.320 -3.898 2.532 1165 3HD2 LEU 145 3HD2 LEU 145 2.070 -4.553 1.077 1166 H LEU 146 H LEU 146 4.611 -5.029 6.580 1167 HA LEU 146 HA LEU 146 6.952 -5.089 5.050 1168 1HB LEU 146 2HB LEU 146 6.077 -3.820 7.370 1169 2HB LEU 146 1HB LEU 146 7.481 -4.739 7.877 1170 HG LEU 146 HG LEU 146 7.845 -3.184 5.402 1171 1HD1 LEU 146 1HD1 LEU 146 8.223 -1.091 6.735 1172 2HD1 LEU 146 2HD1 LEU 146 7.350 -1.862 8.060 1173 3HD1 LEU 146 3HD1 LEU 146 6.533 -1.554 6.528 1174 1HD2 LEU 146 1HD2 LEU 146 9.745 -4.259 6.247 1175 2HD2 LEU 146 2HD2 LEU 146 9.391 -3.772 7.905 1176 3HD2 LEU 146 3HD2 LEU 146 9.939 -2.575 6.732 1177 H VAL 147 H VAL 147 6.033 -6.996 7.896 1178 HA VAL 147 HA VAL 147 8.463 -8.410 8.120 1179 HB VAL 147 HB VAL 147 5.728 -9.325 9.017 1180 1HG1 VAL 147 1HG1 VAL 147 7.963 -10.034 10.703 1181 2HG1 VAL 147 2HG1 VAL 147 8.177 -10.648 9.063 1182 3HG1 VAL 147 3HG1 VAL 147 6.728 -11.063 9.979 1183 1HG2 VAL 147 1HG2 VAL 147 7.230 -8.270 11.162 1184 2HG2 VAL 147 2HG2 VAL 147 5.733 -7.645 10.470 1185 3HG2 VAL 147 3HG2 VAL 147 7.290 -7.086 9.858 1186 H PHE 148 H PHE 148 5.338 -9.396 6.720 1187 HA PHE 148 HA PHE 148 6.204 -11.909 5.810 1188 1HB PHE 148 2HB PHE 148 3.834 -11.294 6.082 1189 2HB PHE 148 1HB PHE 148 3.973 -10.177 4.729 1190 HD1 PHE 148 1HD PHE 148 4.585 -13.772 5.525 1191 HD2 PHE 148 2HD PHE 148 3.296 -10.898 2.663 1192 HE1 PHE 148 1HE PHE 148 3.997 -15.587 3.973 1193 HE2 PHE 148 2HE PHE 148 2.705 -12.708 1.105 1194 HZ PHE 148 HZ PHE 148 3.054 -15.056 1.760 1195 H LEU 149 H LEU 149 6.427 -8.721 4.384 1196 HA LEU 149 HA LEU 149 6.972 -9.560 1.733 1197 1HB LEU 149 2HB LEU 149 6.285 -7.229 2.596 1198 2HB LEU 149 1HB LEU 149 7.995 -7.000 2.922 1199 HG LEU 149 HG LEU 149 8.380 -7.563 0.461 1200 1HD1 LEU 149 1HD1 LEU 149 5.395 -7.266 0.507 1201 2HD1 LEU 149 2HD1 LEU 149 6.368 -8.549 -0.214 1202 3HD1 LEU 149 3HD1 LEU 149 6.344 -6.943 -0.944 1203 1HD2 LEU 149 1HD2 LEU 149 7.608 -5.150 1.771 1204 2HD2 LEU 149 2HD2 LEU 149 6.984 -5.135 0.122 1205 3HD2 LEU 149 3HD2 LEU 149 8.708 -5.371 0.409 1206 H SER 150 H SER 150 9.153 -8.459 4.340 1207 HA SER 150 HA SER 150 11.200 -10.272 3.413 1208 1HB SER 150 2HB SER 150 12.676 -7.915 3.565 1209 2HB SER 150 1HB SER 150 12.254 -8.792 2.093 1210 HG SER 150 HG SER 150 10.401 -7.002 3.199 1211 H LYS 151 H LYS 151 10.485 -10.923 5.631 1212 HA LYS 151 HA LYS 151 12.460 -10.321 7.521 1213 1HB LYS 151 2HB LYS 151 11.034 -8.184 7.566 1214 2HB LYS 151 1HB LYS 151 9.804 -9.168 8.347 1215 1HG LYS 151 2HG LYS 151 11.612 -9.767 10.046 1216 2HG LYS 151 1HG LYS 151 12.523 -8.419 9.362 1217 1HD LYS 151 2HD LYS 151 9.697 -8.128 10.351 1218 2HD LYS 151 1HD LYS 151 11.096 -7.917 11.406 1219 1HE LYS 151 2HE LYS 151 10.544 -6.363 8.879 1220 2HE LYS 151 1HE LYS 151 10.279 -5.779 10.521 1221 1HZ LYS 151 1HZ LYS 151 12.552 -5.461 9.080 1222 2HZ LYS 151 2HZ LYS 151 12.940 -6.766 10.084 1223 3HZ LYS 151 3HZ LYS 151 12.427 -5.303 10.761 1224 H HIS 152 H HIS 152 9.792 -11.969 6.410 1225 HA HIS 152 HA HIS 152 9.270 -13.411 8.884 1226 1HB HIS 152 2HB HIS 152 7.736 -12.780 6.619 1227 2HB HIS 152 1HB HIS 152 7.966 -14.525 6.559 1228 HD1 HIS 152 1HD HIS 152 7.995 -13.726 10.011 1229 HD2 HIS 152 2HD HIS 152 5.013 -14.061 7.137 1230 HE1 HIS 152 1HE HIS 152 5.858 -14.054 11.295 1231 HE2 HIS 152 2HE HIS 152 4.081 -14.341 9.533 1232 H HIS 153 H HIS 153 10.069 -14.337 5.528 1233 HA HIS 153 HA HIS 153 11.340 -16.763 6.588 1234 1HB HIS 153 2HB HIS 153 9.650 -16.271 4.346 1235 2HB HIS 153 1HB HIS 153 11.214 -16.802 3.740 1236 HD1 HIS 153 1HD HIS 153 9.017 -17.957 6.637 1237 HD2 HIS 153 2HD HIS 153 11.117 -19.470 3.387 1238 HE1 HIS 153 1HE HIS 153 8.691 -20.449 6.727 1239 HE2 HIS 153 2HE HIS 153 9.894 -21.335 4.699 1240 H HIS 154 H HIS 154 13.017 -17.444 4.563 1241 HA HIS 154 HA HIS 154 14.817 -15.197 4.087 1242 1HB HIS 154 2HB HIS 154 15.268 -17.267 6.074 1243 2HB HIS 154 1HB HIS 154 16.547 -17.246 4.865 1244 HD1 HIS 154 1HD HIS 154 15.642 -15.737 7.976 1245 HD2 HIS 154 2HD HIS 154 17.609 -14.450 4.550 1246 HE1 HIS 154 1HE HIS 154 16.933 -13.694 8.671 1247 HE2 HIS 154 2HE HIS 154 18.041 -12.879 6.559 1248 H HIS 155 H HIS 155 16.988 -16.553 3.115 1249 HA HIS 155 HA HIS 155 17.788 -17.459 1.189 1250 1HB HIS 155 2HB HIS 155 16.423 -19.438 2.501 1251 2HB HIS 155 1HB HIS 155 15.664 -19.475 0.913 1252 HD1 HIS 155 1HD HIS 155 19.281 -19.235 2.111 1253 HD2 HIS 155 2HD HIS 155 16.924 -21.280 -0.632 1254 HE1 HIS 155 1HE HIS 155 20.850 -20.784 0.899 1255 HE2 HIS 155 2HE HIS 155 19.382 -22.078 -0.688 1256 H HIS 156 H HIS 156 15.828 -15.334 0.968 1257 HA HIS 156 HA HIS 156 15.039 -15.804 -1.808 1258 1HB HIS 156 2HB HIS 156 13.198 -15.570 0.410 1259 2HB HIS 156 1HB HIS 156 12.954 -14.262 -0.742 1260 HD1 HIS 156 1HD HIS 156 12.162 -17.760 -0.160 1261 HD2 HIS 156 2HD HIS 156 12.449 -15.250 -3.460 1262 HE1 HIS 156 1HE HIS 156 10.934 -18.939 -2.010 1263 HE2 HIS 156 2HE HIS 156 11.206 -17.447 -4.022 Start of MODEL 3 1 1H MET 1 1HT MET 1 15.753 -10.358 -8.257 2 2H MET 1 2HT MET 1 16.581 -9.628 -6.975 3 3H MET 1 3HT MET 1 17.100 -9.381 -8.566 4 HA MET 1 HA MET 1 15.885 -7.468 -7.623 5 1HB MET 1 2HB MET 1 14.963 -8.969 -10.055 6 2HB MET 1 1HB MET 1 14.219 -7.434 -9.630 7 1HG MET 1 2HG MET 1 16.476 -6.401 -9.663 8 2HG MET 1 1HG MET 1 17.118 -7.933 -10.254 9 1HE MET 1 1HE MET 1 17.405 -6.333 -13.648 10 2HE MET 1 2HE MET 1 17.876 -7.751 -12.713 11 3HE MET 1 3HE MET 1 18.119 -6.136 -12.048 12 H LYS 2 H LYS 2 14.466 -7.044 -6.068 13 HA LYS 2 HA LYS 2 12.010 -8.668 -5.929 14 1HB LYS 2 2HB LYS 2 13.981 -8.054 -3.914 15 2HB LYS 2 1HB LYS 2 12.405 -7.440 -3.431 16 1HG LYS 2 2HG LYS 2 12.419 -9.574 -2.547 17 2HG LYS 2 1HG LYS 2 11.549 -9.791 -4.067 18 1HD LYS 2 2HD LYS 2 13.459 -10.722 -5.127 19 2HD LYS 2 1HD LYS 2 14.513 -10.245 -3.793 20 1HE LYS 2 2HE LYS 2 14.097 -12.142 -2.712 21 2HE LYS 2 1HE LYS 2 12.358 -11.875 -2.820 22 1HZ LYS 2 1HZ LYS 2 12.907 -12.664 -5.306 23 2HZ LYS 2 2HZ LYS 2 12.445 -13.723 -4.071 24 3HZ LYS 2 3HZ LYS 2 14.081 -13.538 -4.456 25 H LYS 3 H LYS 3 10.417 -7.496 -6.777 26 HA LYS 3 HA LYS 3 10.141 -4.694 -5.909 27 1HB LYS 3 2HB LYS 3 10.034 -5.894 -8.599 28 2HB LYS 3 1HB LYS 3 8.737 -4.766 -8.239 29 1HG LYS 3 2HG LYS 3 10.638 -3.198 -7.460 30 2HG LYS 3 1HG LYS 3 11.674 -4.269 -8.405 31 1HD LYS 3 2HD LYS 3 10.813 -3.577 -10.386 32 2HD LYS 3 1HD LYS 3 9.195 -3.341 -9.720 33 1HE LYS 3 2HE LYS 3 9.649 -1.157 -9.857 34 2HE LYS 3 1HE LYS 3 10.649 -1.415 -8.428 35 1HZ LYS 3 1HZ LYS 3 11.612 -1.560 -11.233 36 2HZ LYS 3 2HZ LYS 3 12.561 -1.734 -9.845 37 3HZ LYS 3 3HZ LYS 3 11.838 -0.245 -10.193 38 H ILE 4 H ILE 4 8.221 -4.100 -5.078 39 HA ILE 4 HA ILE 4 5.997 -6.029 -5.237 40 HB ILE 4 HB ILE 4 5.903 -4.339 -2.876 41 1HG1 ILE 4 2HG1 ILE 4 8.407 -4.653 -3.164 42 2HG1 ILE 4 1HG1 ILE 4 7.736 -5.214 -1.638 43 1HG2 ILE 4 1HG2 ILE 4 6.018 -7.335 -2.983 44 2HG2 ILE 4 2HG2 ILE 4 4.581 -6.435 -3.469 45 3HG2 ILE 4 3HG2 ILE 4 5.190 -6.303 -1.819 46 1HD1 ILE 4 1HD1 ILE 4 8.278 -7.022 -3.978 47 2HD1 ILE 4 2HD1 ILE 4 7.883 -7.485 -2.324 48 3HD1 ILE 4 3HD1 ILE 4 9.432 -6.720 -2.679 49 H LEU 5 H LEU 5 4.463 -5.151 -6.471 50 HA LEU 5 HA LEU 5 4.100 -2.253 -6.474 51 1HB LEU 5 2HB LEU 5 3.985 -4.215 -8.465 52 2HB LEU 5 1HB LEU 5 2.332 -3.679 -8.245 53 HG LEU 5 HG LEU 5 4.617 -1.775 -8.730 54 1HD1 LEU 5 1HD1 LEU 5 2.669 -2.846 -10.761 55 2HD1 LEU 5 2HD1 LEU 5 4.341 -3.384 -10.603 56 3HD1 LEU 5 3HD1 LEU 5 3.989 -1.712 -11.040 57 1HD2 LEU 5 1HD2 LEU 5 1.635 -1.445 -9.034 58 2HD2 LEU 5 2HD2 LEU 5 2.864 -0.206 -9.284 59 3HD2 LEU 5 3HD2 LEU 5 2.587 -0.858 -7.669 60 H PHE 6 H PHE 6 2.720 -1.479 -5.003 61 HA PHE 6 HA PHE 6 0.429 -3.080 -4.156 62 1HB PHE 6 2HB PHE 6 1.229 -0.351 -3.129 63 2HB PHE 6 1HB PHE 6 0.169 -1.520 -2.354 64 HD1 PHE 6 1HD PHE 6 2.741 -0.061 -1.343 65 HD2 PHE 6 2HD PHE 6 1.972 -3.963 -2.862 66 HE1 PHE 6 1HE PHE 6 4.650 -0.935 -0.059 67 HE2 PHE 6 2HE PHE 6 3.880 -4.839 -1.584 68 HZ PHE 6 HZ PHE 6 5.221 -3.326 -0.182 69 H ILE 7 H ILE 7 -1.657 -2.604 -4.704 70 HA ILE 7 HA ILE 7 -2.052 -0.241 -6.426 71 HB ILE 7 HB ILE 7 -3.811 -2.664 -6.557 72 1HG1 ILE 7 2HG1 ILE 7 -1.624 -2.378 -8.546 73 2HG1 ILE 7 1HG1 ILE 7 -1.171 -2.973 -6.952 74 1HG2 ILE 7 1HG2 ILE 7 -3.944 -1.796 -8.970 75 2HG2 ILE 7 2HG2 ILE 7 -3.207 -0.327 -8.331 76 3HG2 ILE 7 3HG2 ILE 7 -4.762 -0.877 -7.708 77 1HD1 ILE 7 1HD1 ILE 7 -2.441 -4.350 -9.119 78 2HD1 ILE 7 2HD1 ILE 7 -3.448 -4.419 -7.673 79 3HD1 ILE 7 3HD1 ILE 7 -1.780 -4.990 -7.615 80 H CYS 8 H CYS 8 -3.079 1.294 -5.332 81 HA CYS 8 HA CYS 8 -5.312 0.523 -3.575 82 1HB CYS 8 2HB CYS 8 -4.013 3.205 -3.391 83 2HB CYS 8 1HB CYS 8 -4.805 2.258 -2.137 84 HG CYS 8 HG CYS 8 -2.099 2.505 -1.492 85 H LEU 9 H LEU 9 -7.287 1.218 -4.043 86 HA LEU 9 HA LEU 9 -7.899 2.360 -6.520 87 1HB LEU 9 2HB LEU 9 -9.306 1.098 -4.558 88 2HB LEU 9 1HB LEU 9 -9.895 2.742 -4.397 89 HG LEU 9 HG LEU 9 -10.310 2.621 -6.945 90 1HD1 LEU 9 1HD1 LEU 9 -9.384 -0.067 -6.366 91 2HD1 LEU 9 2HD1 LEU 9 -9.612 0.744 -7.917 92 3HD1 LEU 9 3HD1 LEU 9 -10.974 -0.052 -7.130 93 1HD2 LEU 9 1HD2 LEU 9 -12.410 1.063 -6.312 94 2HD2 LEU 9 2HD2 LEU 9 -12.283 2.763 -5.863 95 3HD2 LEU 9 3HD2 LEU 9 -11.859 1.510 -4.698 96 H GLY 10 H GLY 10 -7.091 3.841 -3.494 97 1HA GLY 10 2HA GLY 10 -7.530 6.470 -4.748 98 2HA GLY 10 1HA GLY 10 -8.106 6.173 -3.115 99 H ASN 11 H ASN 11 -5.353 6.809 -5.121 100 HA ASN 11 HA ASN 11 -3.431 6.520 -2.994 101 1HB ASN 11 2HB ASN 11 -3.136 6.339 -5.637 102 2HB ASN 11 1HB ASN 11 -2.769 8.052 -5.459 103 1HD2 ASN 11 1HD2 ASN 11 -1.041 8.644 -4.015 104 2HD2 ASN 11 2HD2 ASN 11 0.274 7.553 -3.765 105 H ILE 12 H ILE 12 -5.413 8.169 -2.129 106 HA ILE 12 HA ILE 12 -4.008 10.736 -1.893 107 HB ILE 12 HB ILE 12 -6.090 11.975 -2.059 108 1HG1 ILE 12 2HG1 ILE 12 -7.554 9.558 -3.035 109 2HG1 ILE 12 1HG1 ILE 12 -7.395 9.803 -1.298 110 1HG2 ILE 12 1HG2 ILE 12 -4.694 11.257 -4.109 111 2HG2 ILE 12 2HG2 ILE 12 -6.296 11.948 -4.372 112 3HG2 ILE 12 3HG2 ILE 12 -6.062 10.203 -4.472 113 1HD1 ILE 12 1HD1 ILE 12 -9.221 11.043 -1.449 114 2HD1 ILE 12 2HD1 ILE 12 -9.120 11.116 -3.209 115 3HD1 ILE 12 3HD1 ILE 12 -8.209 12.262 -2.225 116 H CYS 13 H CYS 13 -4.822 8.156 -0.248 117 HA CYS 13 HA CYS 13 -5.204 9.640 2.217 118 1HB CYS 13 2HB CYS 13 -7.494 9.195 1.495 119 2HB CYS 13 1HB CYS 13 -7.130 7.478 1.358 120 HG CYS 13 HG CYS 13 -8.696 7.960 3.652 121 H ARG 14 H ARG 14 -5.727 6.208 1.490 122 HA ARG 14 HA ARG 14 -3.962 5.430 3.604 123 1HB ARG 14 2HB ARG 14 -5.434 3.748 3.535 124 2HB ARG 14 1HB ARG 14 -5.961 4.177 1.916 125 1HG ARG 14 2HG ARG 14 -3.357 2.890 1.919 126 2HG ARG 14 1HG ARG 14 -4.609 1.892 2.659 127 1HD ARG 14 2HD ARG 14 -5.486 3.202 0.209 128 2HD ARG 14 1HD ARG 14 -4.110 2.127 -0.036 129 HE ARG 14 HE ARG 14 -6.718 1.323 1.069 130 1HH1 ARG 14 1HH1 ARG 14 -3.691 0.567 -0.482 131 2HH1 ARG 14 2HH1 ARG 14 -4.114 -1.084 -0.790 132 1HH2 ARG 14 1HH2 ARG 14 -7.280 -0.847 0.674 133 2HH2 ARG 14 2HH2 ARG 14 -6.156 -1.887 -0.136 134 H SER 15 H SER 15 -3.796 5.386 0.073 135 HA SER 15 HA SER 15 -1.395 3.933 -0.134 136 1HB SER 15 2HB SER 15 -1.847 5.941 -2.228 137 2HB SER 15 1HB SER 15 -1.656 4.192 -2.354 138 HG SER 15 HG SER 15 -3.904 4.310 -1.272 139 HA PRO 16 HA PRO 16 0.837 8.259 -0.419 140 1HB PRO 16 2HB PRO 16 -0.390 10.299 0.919 141 2HB PRO 16 1HB PRO 16 -0.587 10.009 -0.813 142 1HG PRO 16 2HG PRO 16 -2.377 9.223 1.455 143 2HG PRO 16 1HG PRO 16 -2.805 9.918 -0.121 144 1HD PRO 16 2HD PRO 16 -3.063 7.291 0.374 145 2HD PRO 16 1HD PRO 16 -2.568 7.894 -1.222 146 H MET 17 H MET 17 -1.199 7.851 2.483 147 HA MET 17 HA MET 17 0.656 8.700 4.377 148 1HB MET 17 2HB MET 17 -1.900 7.777 4.486 149 2HB MET 17 1HB MET 17 -1.031 6.416 5.180 150 1HG MET 17 2HG MET 17 -0.891 9.265 6.140 151 2HG MET 17 1HG MET 17 -1.816 7.965 6.889 152 1HE MET 17 1HE MET 17 0.212 6.488 9.300 153 2HE MET 17 2HE MET 17 -1.304 7.184 8.726 154 3HE MET 17 3HE MET 17 -0.119 8.203 9.543 155 H ALA 18 H ALA 18 -0.061 5.351 3.375 156 HA ALA 18 HA ALA 18 2.095 4.204 4.797 157 1HB ALA 18 1HB ALA 18 1.012 2.349 4.256 158 2HB ALA 18 2HB ALA 18 1.440 2.579 2.561 159 3HB ALA 18 3HB ALA 18 -0.048 3.279 3.196 160 H GLU 19 H GLU 19 1.913 5.870 1.790 161 HA GLU 19 HA GLU 19 4.147 4.735 0.490 162 1HB GLU 19 2HB GLU 19 2.557 6.123 -0.725 163 2HB GLU 19 1HB GLU 19 2.968 7.512 0.271 164 1HG GLU 19 2HG GLU 19 4.812 7.976 -0.910 165 2HG GLU 19 1HG GLU 19 5.245 6.279 -1.098 166 H PHE 20 H PHE 20 3.793 7.509 2.665 167 HA PHE 20 HA PHE 20 6.555 8.209 2.624 168 1HB PHE 20 2HB PHE 20 5.336 10.025 3.314 169 2HB PHE 20 1HB PHE 20 4.145 9.038 4.148 170 HD1 PHE 20 1HD PHE 20 7.635 10.280 4.405 171 HD2 PHE 20 2HD PHE 20 4.204 8.830 6.467 172 HE1 PHE 20 1HE PHE 20 8.698 10.829 6.556 173 HE2 PHE 20 2HE PHE 20 5.262 9.379 8.619 174 HZ PHE 20 HZ PHE 20 7.510 10.379 8.666 175 H ILE 21 H ILE 21 4.515 6.332 4.838 176 HA ILE 21 HA ILE 21 6.427 5.843 6.821 177 HB ILE 21 HB ILE 21 4.265 3.910 5.998 178 1HG1 ILE 21 2HG1 ILE 21 4.042 6.235 7.922 179 2HG1 ILE 21 1HG1 ILE 21 3.389 6.227 6.287 180 1HG2 ILE 21 1HG2 ILE 21 5.552 4.433 8.674 181 2HG2 ILE 21 2HG2 ILE 21 5.926 3.078 7.608 182 3HG2 ILE 21 3HG2 ILE 21 4.319 3.222 8.322 183 1HD1 ILE 21 1HD1 ILE 21 2.361 3.930 7.421 184 2HD1 ILE 21 2HD1 ILE 21 1.514 5.458 7.180 185 3HD1 ILE 21 3HD1 ILE 21 2.301 5.119 8.722 186 H MET 22 H MET 22 5.475 3.768 4.091 187 HA MET 22 HA MET 22 7.299 1.721 4.506 188 1HB MET 22 2HB MET 22 5.988 2.757 2.001 189 2HB MET 22 1HB MET 22 7.043 1.351 1.987 190 1HG MET 22 2HG MET 22 5.557 0.047 3.134 191 2HG MET 22 1HG MET 22 4.795 1.423 3.929 192 1HE MET 22 1HE MET 22 2.754 -0.060 3.549 193 2HE MET 22 2HE MET 22 3.115 -1.168 2.224 194 3HE MET 22 3HE MET 22 1.778 -0.027 2.080 195 H LYS 23 H LYS 23 7.639 4.565 2.383 196 HA LYS 23 HA LYS 23 10.176 4.016 1.404 197 1HB LYS 23 2HB LYS 23 10.092 6.084 0.466 198 2HB LYS 23 1HB LYS 23 8.408 5.976 0.952 199 1HG LYS 23 2HG LYS 23 9.052 7.172 3.070 200 2HG LYS 23 1HG LYS 23 10.633 7.450 2.336 201 1HD LYS 23 2HD LYS 23 8.166 8.202 0.832 202 2HD LYS 23 1HD LYS 23 8.738 9.248 2.134 203 1HE LYS 23 2HE LYS 23 10.244 8.412 -0.340 204 2HE LYS 23 1HE LYS 23 9.664 10.027 0.062 205 1HZ LYS 23 1HZ LYS 23 11.893 10.096 0.619 206 2HZ LYS 23 2HZ LYS 23 11.908 8.526 1.249 207 3HZ LYS 23 3HZ LYS 23 11.160 9.775 2.111 208 H ASP 24 H ASP 24 9.222 5.419 4.473 209 HA ASP 24 HA ASP 24 11.795 6.352 5.227 210 1HB ASP 24 2HB ASP 24 9.411 6.884 6.197 211 2HB ASP 24 1HB ASP 24 9.757 5.520 7.255 212 H LEU 25 H LEU 25 9.948 3.540 6.423 213 HA LEU 25 HA LEU 25 12.115 2.410 7.829 214 1HB LEU 25 2HB LEU 25 9.385 1.603 7.084 215 2HB LEU 25 1HB LEU 25 10.500 0.277 7.350 216 HG LEU 25 HG LEU 25 10.122 2.470 9.376 217 1HD1 LEU 25 1HD1 LEU 25 8.100 1.699 9.857 218 2HD1 LEU 25 2HD1 LEU 25 8.821 0.135 10.241 219 3HD1 LEU 25 3HD1 LEU 25 8.235 0.459 8.610 220 1HD2 LEU 25 1HD2 LEU 25 12.141 1.040 9.513 221 2HD2 LEU 25 2HD2 LEU 25 11.092 -0.371 9.655 222 3HD2 LEU 25 3HD2 LEU 25 11.071 0.873 10.906 223 H VAL 26 H VAL 26 11.286 2.346 4.492 224 HA VAL 26 HA VAL 26 12.407 -0.103 3.723 225 HB VAL 26 HB VAL 26 11.659 2.398 2.335 226 1HG1 VAL 26 1HG1 VAL 26 13.891 0.690 1.401 227 2HG1 VAL 26 2HG1 VAL 26 13.570 2.400 1.110 228 3HG1 VAL 26 3HG1 VAL 26 12.691 1.171 0.201 229 1HG2 VAL 26 1HG2 VAL 26 9.990 1.065 1.741 230 2HG2 VAL 26 2HG2 VAL 26 10.773 -0.295 2.550 231 3HG2 VAL 26 3HG2 VAL 26 11.123 0.044 0.854 232 H LYS 27 H LYS 27 13.903 3.133 3.802 233 HA LYS 27 HA LYS 27 16.369 2.531 2.775 234 1HB LYS 27 2HB LYS 27 15.396 4.779 3.594 235 2HB LYS 27 1HB LYS 27 16.110 4.355 5.144 236 1HG LYS 27 2HG LYS 27 18.097 3.953 3.181 237 2HG LYS 27 1HG LYS 27 17.345 5.517 2.859 238 1HD LYS 27 2HD LYS 27 17.758 6.221 5.143 239 2HD LYS 27 1HD LYS 27 18.418 4.632 5.538 240 1HE LYS 27 2HE LYS 27 20.428 5.305 4.881 241 2HE LYS 27 1HE LYS 27 19.799 5.600 3.260 242 1HZ LYS 27 1HZ LYS 27 19.487 7.818 3.688 243 2HZ LYS 27 2HZ LYS 27 20.879 7.519 4.602 244 3HZ LYS 27 3HZ LYS 27 19.371 7.609 5.364 245 H LYS 28 H LYS 28 15.248 1.926 6.078 246 HA LYS 28 HA LYS 28 17.792 1.304 7.123 247 1HB LYS 28 2HB LYS 28 16.738 0.739 9.106 248 2HB LYS 28 1HB LYS 28 15.646 1.910 8.385 249 1HG LYS 28 2HG LYS 28 14.052 0.425 8.842 250 2HG LYS 28 1HG LYS 28 14.657 -0.456 7.438 251 1HD LYS 28 2HD LYS 28 15.032 -2.172 8.812 252 2HD LYS 28 1HD LYS 28 16.342 -1.219 9.512 253 1HE LYS 28 2HE LYS 28 15.144 -1.660 11.403 254 2HE LYS 28 1HE LYS 28 14.352 -0.168 10.899 255 1HZ LYS 28 1HZ LYS 28 12.798 -1.781 9.633 256 2HZ LYS 28 2HZ LYS 28 12.581 -1.558 11.295 257 3HZ LYS 28 3HZ LYS 28 13.375 -2.937 10.725 258 H ALA 29 H ALA 29 15.196 -0.970 6.067 259 HA ALA 29 HA ALA 29 17.339 -2.975 5.799 260 1HB ALA 29 1HB ALA 29 16.236 -3.512 7.828 261 2HB ALA 29 2HB ALA 29 15.731 -4.694 6.620 262 3HB ALA 29 3HB ALA 29 14.648 -3.377 7.071 263 H ASN 30 H ASN 30 15.935 -1.347 3.717 264 HA ASN 30 HA ASN 30 15.000 -3.632 2.115 265 1HB ASN 30 2HB ASN 30 13.653 -1.009 2.558 266 2HB ASN 30 1HB ASN 30 13.537 -1.741 0.962 267 1HD2 ASN 30 1HD2 ASN 30 12.121 -3.333 0.640 268 2HD2 ASN 30 2HD2 ASN 30 11.165 -4.073 1.874 269 H LEU 31 H LEU 31 15.931 -0.199 1.808 270 HA LEU 31 HA LEU 31 16.823 -0.407 -0.857 271 1HB LEU 31 2HB LEU 31 16.295 1.708 0.455 272 2HB LEU 31 1HB LEU 31 17.878 1.540 1.190 273 HG LEU 31 HG LEU 31 18.603 1.434 -1.390 274 1HD1 LEU 31 1HD1 LEU 31 17.299 3.152 -2.613 275 2HD1 LEU 31 2HD1 LEU 31 16.099 3.106 -1.322 276 3HD1 LEU 31 3HD1 LEU 31 16.396 1.670 -2.301 277 1HD2 LEU 31 1HD2 LEU 31 19.683 3.305 -0.843 278 2HD2 LEU 31 2HD2 LEU 31 18.850 3.203 0.708 279 3HD2 LEU 31 3HD2 LEU 31 18.181 4.195 -0.588 280 H GLU 32 H GLU 32 18.201 -1.367 2.118 281 HA GLU 32 HA GLU 32 20.945 -1.333 1.354 282 1HB GLU 32 2HB GLU 32 19.683 -3.100 3.447 283 2HB GLU 32 1HB GLU 32 21.347 -2.534 3.379 284 1HG GLU 32 2HG GLU 32 19.418 -0.358 3.438 285 2HG GLU 32 1HG GLU 32 19.304 -1.419 4.843 286 H LYS 33 H LYS 33 18.337 -3.677 1.167 287 HA LYS 33 HA LYS 33 20.149 -5.642 -0.040 288 1HB LYS 33 2HB LYS 33 17.732 -5.806 1.568 289 2HB LYS 33 1HB LYS 33 17.606 -6.777 0.106 290 1HG LYS 33 2HG LYS 33 19.186 -8.248 0.779 291 2HG LYS 33 1HG LYS 33 20.114 -7.026 1.650 292 1HD LYS 33 2HD LYS 33 17.425 -7.829 2.672 293 2HD LYS 33 1HD LYS 33 18.809 -8.887 2.955 294 1HE LYS 33 2HE LYS 33 19.628 -6.251 3.560 295 2HE LYS 33 1HE LYS 33 18.060 -6.496 4.327 296 1HZ LYS 33 1HZ LYS 33 19.009 -7.744 5.871 297 2HZ LYS 33 2HZ LYS 33 20.526 -7.389 5.213 298 3HZ LYS 33 3HZ LYS 33 19.691 -8.771 4.711 299 H GLU 34 H GLU 34 18.845 -3.100 -1.187 300 HA GLU 34 HA GLU 34 18.074 -2.375 -3.189 301 1HB GLU 34 2HB GLU 34 19.137 -5.084 -3.899 302 2HB GLU 34 1HB GLU 34 18.305 -4.119 -5.111 303 1HG GLU 34 2HG GLU 34 19.942 -2.483 -5.120 304 2HG GLU 34 1HG GLU 34 20.555 -2.947 -3.534 305 H PHE 35 H PHE 35 16.006 -2.675 -1.768 306 HA PHE 35 HA PHE 35 14.125 -4.433 -3.199 307 1HB PHE 35 2HB PHE 35 14.312 -3.543 -0.361 308 2HB PHE 35 1HB PHE 35 12.702 -3.772 -1.037 309 HD1 PHE 35 1HD PHE 35 15.984 -5.555 -0.957 310 HD2 PHE 35 2HD PHE 35 11.743 -5.832 -0.743 311 HE1 PHE 35 1HE PHE 35 16.167 -7.974 -0.552 312 HE2 PHE 35 2HE PHE 35 11.919 -8.252 -0.337 313 HZ PHE 35 HZ PHE 35 14.133 -9.327 -0.241 314 H PHE 36 H PHE 36 12.348 -3.574 -4.175 315 HA PHE 36 HA PHE 36 12.068 -0.642 -4.043 316 1HB PHE 36 2HB PHE 36 12.535 -2.327 -6.277 317 2HB PHE 36 1HB PHE 36 10.896 -1.701 -6.429 318 HD1 PHE 36 1HD PHE 36 14.220 -1.103 -7.221 319 HD2 PHE 36 2HD PHE 36 10.716 0.908 -5.883 320 HE1 PHE 36 1HE PHE 36 15.115 1.021 -8.081 321 HE2 PHE 36 2HE PHE 36 11.604 3.037 -6.742 322 HZ PHE 36 HZ PHE 36 13.807 3.094 -7.842 323 H ILE 37 H ILE 37 10.066 0.253 -3.856 324 HA ILE 37 HA ILE 37 7.739 -1.535 -3.756 325 HB ILE 37 HB ILE 37 6.997 0.051 -1.784 326 1HG1 ILE 37 2HG1 ILE 37 9.450 0.015 -0.464 327 2HG1 ILE 37 1HG1 ILE 37 9.840 0.606 -2.077 328 1HG2 ILE 37 1HG2 ILE 37 7.179 -2.389 -1.685 329 2HG2 ILE 37 2HG2 ILE 37 7.745 -1.631 -0.196 330 3HG2 ILE 37 3HG2 ILE 37 8.909 -2.244 -1.371 331 1HD1 ILE 37 1HD1 ILE 37 7.693 1.767 -0.322 332 2HD1 ILE 37 2HD1 ILE 37 8.285 2.410 -1.853 333 3HD1 ILE 37 3HD1 ILE 37 9.338 2.390 -0.440 334 H ASN 38 H ASN 38 6.388 -0.796 -5.266 335 HA ASN 38 HA ASN 38 6.064 2.125 -5.536 336 1HB ASN 38 2HB ASN 38 5.178 0.876 -7.919 337 2HB ASN 38 1HB ASN 38 6.576 1.926 -7.704 338 1HD2 ASN 38 1HD2 ASN 38 5.640 -1.437 -7.038 339 2HD2 ASN 38 2HD2 ASN 38 7.121 -2.135 -7.594 340 H SER 39 H SER 39 4.087 2.901 -5.184 341 HA SER 39 HA SER 39 1.810 1.034 -5.306 342 1HB SER 39 2HB SER 39 0.782 2.272 -3.447 343 2HB SER 39 1HB SER 39 2.348 1.615 -2.974 344 HG SER 39 HG SER 39 1.691 4.006 -2.596 345 H ALA 40 H ALA 40 0.303 1.577 -6.734 346 HA ALA 40 HA ALA 40 -0.141 4.411 -7.352 347 1HB ALA 40 1HB ALA 40 1.024 4.083 -9.252 348 2HB ALA 40 2HB ALA 40 -0.480 3.349 -9.808 349 3HB ALA 40 3HB ALA 40 0.825 2.331 -9.199 350 H GLY 41 H GLY 41 -2.092 4.375 -9.116 351 1HA GLY 41 2HA GLY 41 -4.246 2.953 -7.716 352 2HA GLY 41 1HA GLY 41 -4.448 4.362 -8.748 353 H THR 42 H THR 42 -6.223 2.799 -9.512 354 HA THR 42 HA THR 42 -5.330 0.637 -11.205 355 HB THR 42 HB THR 42 -7.607 0.135 -11.591 356 HG1 THR 42 1HG THR 42 -8.978 2.072 -10.431 357 1HG2 THR 42 1HG2 THR 42 -7.977 1.259 -8.876 358 2HG2 THR 42 2HG2 THR 42 -6.619 0.159 -9.106 359 3HG2 THR 42 3HG2 THR 42 -8.259 -0.375 -9.473 360 H SER 43 H SER 43 -6.912 3.788 -11.726 361 HA SER 43 HA SER 43 -5.962 3.681 -14.514 362 1HB SER 43 2HB SER 43 -8.591 4.767 -13.482 363 2HB SER 43 1HB SER 43 -7.993 5.027 -15.120 364 HG SER 43 HG SER 43 -8.718 2.585 -13.887 365 H GLY 44 H GLY 44 -5.427 5.102 -11.673 366 1HA GLY 44 2HA GLY 44 -4.446 7.066 -11.010 367 2HA GLY 44 1HA GLY 44 -3.942 7.241 -12.683 368 H GLU 45 H GLU 45 -7.316 7.035 -11.897 369 HA GLU 45 HA GLU 45 -8.019 9.369 -13.235 370 1HB GLU 45 2HB GLU 45 -9.354 7.458 -11.451 371 2HB GLU 45 1HB GLU 45 -10.045 9.074 -11.408 372 1HG GLU 45 2HG GLU 45 -9.714 8.582 -14.100 373 2HG GLU 45 1HG GLU 45 -10.225 7.026 -13.447 374 H HIS 46 H HIS 46 -7.848 8.846 -9.714 375 HA HIS 46 HA HIS 46 -7.235 11.706 -9.411 376 1HB HIS 46 2HB HIS 46 -8.524 11.650 -7.255 377 2HB HIS 46 1HB HIS 46 -9.518 11.473 -8.698 378 HD1 HIS 46 1HD HIS 46 -8.585 9.784 -5.561 379 HD2 HIS 46 2HD HIS 46 -10.515 8.809 -9.110 380 HE1 HIS 46 1HE HIS 46 -9.774 7.615 -5.106 381 HE2 HIS 46 2HE HIS 46 -10.934 7.041 -7.269 382 H ASP 47 H ASP 47 -6.794 8.423 -8.394 383 HA ASP 47 HA ASP 47 -5.402 8.529 -6.064 384 1HB ASP 47 2HB ASP 47 -4.007 6.810 -7.969 385 2HB ASP 47 1HB ASP 47 -4.907 6.375 -6.515 386 H GLY 48 H GLY 48 -4.106 10.320 -5.698 387 1HA GLY 48 2HA GLY 48 -1.433 10.247 -6.238 388 2HA GLY 48 1HA GLY 48 -2.104 11.122 -7.605 389 H GLU 49 H GLU 49 -4.230 12.295 -5.817 390 HA GLU 49 HA GLU 49 -3.048 14.744 -5.298 391 1HB GLU 49 2HB GLU 49 -5.439 13.541 -3.891 392 2HB GLU 49 1HB GLU 49 -5.018 15.246 -3.913 393 1HG GLU 49 2HG GLU 49 -5.111 14.815 -6.539 394 2HG GLU 49 1HG GLU 49 -6.233 13.561 -6.013 395 H GLY 50 H GLY 50 -3.559 12.024 -3.077 396 1HA GLY 50 2HA GLY 50 -2.586 11.510 -1.064 397 2HA GLY 50 1HA GLY 50 -1.243 12.519 -1.577 398 H MET 51 H MET 51 -4.583 12.872 -0.377 399 HA MET 51 HA MET 51 -3.839 14.353 1.897 400 1HB MET 51 2HB MET 51 -3.362 16.026 0.042 401 2HB MET 51 1HB MET 51 -5.097 16.070 -0.241 402 1HG MET 51 2HG MET 51 -4.794 16.466 2.502 403 2HG MET 51 1HG MET 51 -3.524 17.427 1.746 404 1HE MET 51 1HE MET 51 -6.922 16.908 2.729 405 2HE MET 51 2HE MET 51 -7.900 18.215 2.061 406 3HE MET 51 3HE MET 51 -6.695 18.561 3.302 407 H HIS 52 H HIS 52 -5.326 13.299 3.095 408 HA HIS 52 HA HIS 52 -8.137 13.825 2.471 409 1HB HIS 52 2HB HIS 52 -6.931 11.284 2.190 410 2HB HIS 52 1HB HIS 52 -7.928 11.211 3.640 411 HD1 HIS 52 1HD HIS 52 -9.579 13.569 1.608 412 HD2 HIS 52 2HD HIS 52 -9.245 9.428 1.514 413 HE1 HIS 52 1HE HIS 52 -11.523 12.769 0.229 414 HE2 HIS 52 2HE HIS 52 -11.281 10.262 0.155 415 H TYR 53 H TYR 53 -9.575 13.437 4.336 416 HA TYR 53 HA TYR 53 -8.828 14.854 6.564 417 1HB TYR 53 2HB TYR 53 -10.926 12.683 6.474 418 2HB TYR 53 1HB TYR 53 -10.842 14.008 7.630 419 HD1 TYR 53 1HD TYR 53 -12.226 12.919 4.569 420 HD2 TYR 53 2HD TYR 53 -10.901 16.412 6.602 421 HE1 TYR 53 1HE TYR 53 -13.590 14.304 3.064 422 HE2 TYR 53 2HE TYR 53 -12.263 17.809 5.103 423 HH TYR 53 HH TYR 53 -13.307 17.734 2.960 424 H GLY 54 H GLY 54 -9.652 11.434 6.913 425 1HA GLY 54 2HA GLY 54 -8.485 10.945 9.319 426 2HA GLY 54 1HA GLY 54 -8.641 9.726 8.069 427 H THR 55 H THR 55 -6.832 10.519 6.182 428 HA THR 55 HA THR 55 -4.438 9.566 7.231 429 HB THR 55 HB THR 55 -5.295 9.852 4.728 430 HG1 THR 55 1HG THR 55 -2.515 9.999 5.017 431 1HG2 THR 55 1HG2 THR 55 -5.098 12.070 4.187 432 2HG2 THR 55 2HG2 THR 55 -3.490 11.508 3.730 433 3HG2 THR 55 3HG2 THR 55 -3.730 12.328 5.271 434 H LYS 56 H LYS 56 -5.404 12.914 6.553 435 HA LYS 56 HA LYS 56 -2.997 14.160 7.204 436 1HB LYS 56 2HB LYS 56 -5.388 15.033 6.305 437 2HB LYS 56 1HB LYS 56 -5.484 15.568 7.978 438 1HG LYS 56 2HG LYS 56 -3.087 16.512 7.476 439 2HG LYS 56 1HG LYS 56 -3.652 16.441 5.806 440 1HD LYS 56 2HD LYS 56 -5.672 17.581 7.516 441 2HD LYS 56 1HD LYS 56 -4.149 18.455 7.683 442 1HE LYS 56 2HE LYS 56 -4.040 18.718 5.249 443 2HE LYS 56 1HE LYS 56 -5.568 17.854 5.090 444 1HZ LYS 56 1HZ LYS 56 -5.073 20.539 6.208 445 2HZ LYS 56 2HZ LYS 56 -6.462 19.673 6.636 446 3HZ LYS 56 3HZ LYS 56 -6.180 20.070 5.016 447 H ASN 57 H ASN 57 -5.723 13.260 9.281 448 HA ASN 57 HA ASN 57 -4.817 14.486 11.629 449 1HB ASN 57 2HB ASN 57 -6.734 13.659 12.449 450 2HB ASN 57 1HB ASN 57 -7.000 12.912 10.877 451 1HD2 ASN 57 1HD2 ASN 57 -5.882 12.411 14.138 452 2HD2 ASN 57 2HD2 ASN 57 -5.937 10.686 14.100 453 H LYS 58 H LYS 58 -4.344 11.163 10.464 454 HA LYS 58 HA LYS 58 -2.806 10.268 12.639 455 1HB LYS 58 2HB LYS 58 -3.644 9.275 10.067 456 2HB LYS 58 1HB LYS 58 -1.958 8.868 10.347 457 1HG LYS 58 2HG LYS 58 -3.712 7.185 11.087 458 2HG LYS 58 1HG LYS 58 -2.453 7.607 12.246 459 1HD LYS 58 2HD LYS 58 -4.801 9.334 12.415 460 2HD LYS 58 1HD LYS 58 -5.159 7.635 12.730 461 1HE LYS 58 2HE LYS 58 -2.892 7.938 14.164 462 2HE LYS 58 1HE LYS 58 -3.568 9.561 14.291 463 1HZ LYS 58 1HZ LYS 58 -4.876 8.780 15.883 464 2HZ LYS 58 2HZ LYS 58 -4.373 7.188 15.614 465 3HZ LYS 58 3HZ LYS 58 -5.669 7.826 14.733 466 H LEU 59 H LEU 59 -1.954 11.861 9.641 467 HA LEU 59 HA LEU 59 0.848 11.528 9.861 468 1HB LEU 59 2HB LEU 59 -0.791 13.575 8.369 469 2HB LEU 59 1HB LEU 59 0.948 13.414 8.217 470 HG LEU 59 HG LEU 59 -0.927 11.138 7.607 471 1HD1 LEU 59 1HD1 LEU 59 -0.395 11.842 5.183 472 2HD1 LEU 59 2HD1 LEU 59 -0.066 13.427 5.883 473 3HD1 LEU 59 3HD1 LEU 59 -1.664 12.699 6.060 474 1HD2 LEU 59 1HD2 LEU 59 1.168 10.710 6.062 475 2HD2 LEU 59 2HD2 LEU 59 1.149 10.199 7.748 476 3HD2 LEU 59 3HD2 LEU 59 1.976 11.686 7.288 477 H ALA 60 H ALA 60 -1.175 14.409 10.464 478 HA ALA 60 HA ALA 60 0.785 16.059 11.497 479 1HB ALA 60 1HB ALA 60 -2.117 15.935 12.310 480 2HB ALA 60 2HB ALA 60 -1.453 16.846 10.953 481 3HB ALA 60 3HB ALA 60 -1.020 17.285 12.605 482 H GLN 61 H GLN 61 -0.923 13.420 13.030 483 HA GLN 61 HA GLN 61 -0.442 13.960 15.710 484 1HB GLN 61 2HB GLN 61 -0.811 11.449 14.134 485 2HB GLN 61 1HB GLN 61 -0.309 11.327 15.815 486 1HG GLN 61 2HG GLN 61 -2.407 13.117 15.891 487 2HG GLN 61 1HG GLN 61 -2.909 11.929 14.688 488 1HE2 GLN 61 1HE2 GLN 61 -1.608 9.690 15.773 489 2HE2 GLN 61 2HE2 GLN 61 -2.401 9.268 17.249 490 H LEU 62 H LEU 62 1.649 12.323 13.354 491 HA LEU 62 HA LEU 62 3.976 13.054 14.911 492 1HB LEU 62 2HB LEU 62 4.676 10.480 14.499 493 2HB LEU 62 1HB LEU 62 4.011 11.089 16.002 494 HG LEU 62 HG LEU 62 1.835 10.370 14.309 495 1HD1 LEU 62 1HD1 LEU 62 2.554 8.611 13.166 496 2HD1 LEU 62 2HD1 LEU 62 2.877 7.798 14.697 497 3HD1 LEU 62 3HD1 LEU 62 4.151 8.727 13.906 498 1HD2 LEU 62 1HD2 LEU 62 1.723 10.427 16.715 499 2HD2 LEU 62 2HD2 LEU 62 2.961 9.177 16.838 500 3HD2 LEU 62 3HD2 LEU 62 1.382 8.789 16.157 501 H ASN 63 H ASN 63 2.681 11.321 12.116 502 HA ASN 63 HA ASN 63 5.087 11.360 10.605 503 1HB ASN 63 2HB ASN 63 2.286 11.207 9.481 504 2HB ASN 63 1HB ASN 63 3.771 10.562 8.782 505 1HD2 ASN 63 1HD2 ASN 63 1.195 10.040 10.976 506 2HD2 ASN 63 2HD2 ASN 63 1.636 8.443 11.463 507 H ILE 64 H ILE 64 4.245 12.320 8.111 508 HA ILE 64 HA ILE 64 4.406 15.208 8.587 509 HB ILE 64 HB ILE 64 4.923 13.646 6.054 510 1HG1 ILE 64 2HG1 ILE 64 6.917 14.996 7.881 511 2HG1 ILE 64 1HG1 ILE 64 6.539 13.279 7.956 512 1HG2 ILE 64 1HG2 ILE 64 6.161 16.002 5.686 513 2HG2 ILE 64 2HG2 ILE 64 4.798 16.526 6.674 514 3HG2 ILE 64 3HG2 ILE 64 4.511 15.675 5.156 515 1HD1 ILE 64 1HD1 ILE 64 8.532 13.519 6.703 516 2HD1 ILE 64 2HD1 ILE 64 7.823 14.779 5.695 517 3HD1 ILE 64 3HD1 ILE 64 7.249 13.117 5.562 518 H GLU 65 H GLU 65 2.765 16.535 8.103 519 HA GLU 65 HA GLU 65 0.211 15.692 7.631 520 1HB GLU 65 2HB GLU 65 1.503 18.170 7.911 521 2HB GLU 65 1HB GLU 65 0.536 18.284 6.447 522 1HG GLU 65 2HG GLU 65 -1.348 17.287 7.935 523 2HG GLU 65 1HG GLU 65 -0.338 17.852 9.265 524 H HIS 66 H HIS 66 2.698 15.999 5.350 525 HA HIS 66 HA HIS 66 1.345 14.649 3.324 526 1HB HIS 66 2HB HIS 66 1.269 16.669 1.674 527 2HB HIS 66 1HB HIS 66 -0.063 16.418 2.794 528 HD1 HIS 66 1HD HIS 66 -0.843 18.624 3.567 529 HD2 HIS 66 2HD HIS 66 3.298 18.483 3.267 530 HE1 HIS 66 1HE HIS 66 -0.035 20.867 4.364 531 HE2 HIS 66 2HE HIS 66 2.478 20.717 4.281 532 H LYS 67 H LYS 67 2.725 13.919 1.838 533 HA LYS 67 HA LYS 67 4.933 15.230 0.769 534 1HB LYS 67 2HB LYS 67 5.444 14.446 3.403 535 2HB LYS 67 1HB LYS 67 6.224 13.216 2.418 536 1HG LYS 67 2HG LYS 67 7.939 14.590 2.171 537 2HG LYS 67 1HG LYS 67 6.893 15.662 1.237 538 1HD LYS 67 2HD LYS 67 6.393 16.986 3.100 539 2HD LYS 67 1HD LYS 67 6.938 15.750 4.235 540 1HE LYS 67 2HE LYS 67 8.821 17.067 2.301 541 2HE LYS 67 1HE LYS 67 8.453 17.778 3.872 542 1HZ LYS 67 1HZ LYS 67 10.096 16.503 4.628 543 2HZ LYS 67 2HZ LYS 67 10.144 15.555 3.230 544 3HZ LYS 67 3HZ LYS 67 9.041 15.191 4.460 545 H ASN 68 H ASN 68 2.818 13.492 -0.006 546 HA ASN 68 HA ASN 68 4.390 11.472 -1.401 547 1HB ASN 68 2HB ASN 68 1.860 10.746 0.084 548 2HB ASN 68 1HB ASN 68 2.879 9.660 -0.856 549 1HD2 ASN 68 1HD2 ASN 68 5.155 9.492 -0.116 550 2HD2 ASN 68 2HD2 ASN 68 5.446 9.490 1.586 551 H PHE 69 H PHE 69 2.709 14.004 -1.899 552 HA PHE 69 HA PHE 69 0.487 13.163 -3.474 553 1HB PHE 69 2HB PHE 69 1.016 15.647 -4.443 554 2HB PHE 69 1HB PHE 69 0.084 15.334 -2.984 555 HD1 PHE 69 1HD PHE 69 3.547 16.005 -4.159 556 HD2 PHE 69 2HD PHE 69 0.748 16.244 -0.963 557 HE1 PHE 69 1HE PHE 69 5.159 17.323 -2.850 558 HE2 PHE 69 2HE PHE 69 2.355 17.562 0.353 559 HZ PHE 69 HZ PHE 69 4.565 18.104 -0.591 560 H THR 70 H THR 70 0.916 11.810 -5.113 561 HA THR 70 HA THR 70 2.392 12.863 -7.374 562 HB THR 70 HB THR 70 4.265 11.779 -6.555 563 HG1 THR 70 1HG THR 70 4.268 10.768 -8.436 564 1HG2 THR 70 1HG2 THR 70 2.333 9.814 -5.382 565 2HG2 THR 70 2HG2 THR 70 3.600 10.746 -4.586 566 3HG2 THR 70 3HG2 THR 70 4.025 9.369 -5.603 567 H SER 71 H SER 71 0.820 12.729 -8.850 568 HA SER 71 HA SER 71 -1.274 10.868 -8.860 569 1HB SER 71 2HB SER 71 -1.607 11.610 -11.242 570 2HB SER 71 1HB SER 71 -1.517 12.929 -10.075 571 HG SER 71 HG SER 71 0.098 12.377 -12.185 572 H LYS 72 H LYS 72 -0.864 8.737 -8.887 573 HA LYS 72 HA LYS 72 0.965 7.718 -10.955 574 1HB LYS 72 2HB LYS 72 0.262 6.637 -8.233 575 2HB LYS 72 1HB LYS 72 1.047 5.651 -9.460 576 1HG LYS 72 2HG LYS 72 2.797 7.539 -9.548 577 2HG LYS 72 1HG LYS 72 2.107 8.039 -8.002 578 1HD LYS 72 2HD LYS 72 2.759 6.072 -6.937 579 2HD LYS 72 1HD LYS 72 2.950 5.198 -8.459 580 1HE LYS 72 2HE LYS 72 5.134 5.612 -8.229 581 2HE LYS 72 1HE LYS 72 4.740 7.259 -8.723 582 1HZ LYS 72 1HZ LYS 72 5.179 8.032 -6.695 583 2HZ LYS 72 2HZ LYS 72 5.928 6.547 -6.388 584 3HZ LYS 72 3HZ LYS 72 4.321 6.794 -5.923 585 H LYS 73 H LYS 73 0.423 5.661 -11.932 586 HA LYS 73 HA LYS 73 -2.322 4.748 -11.748 587 1HB LYS 73 2HB LYS 73 -2.367 4.959 -14.387 588 2HB LYS 73 1HB LYS 73 -2.907 6.273 -13.354 589 1HG LYS 73 2HG LYS 73 -1.044 7.560 -13.783 590 2HG LYS 73 1HG LYS 73 -0.062 6.167 -14.244 591 1HD LYS 73 2HD LYS 73 -0.555 6.524 -16.380 592 2HD LYS 73 1HD LYS 73 -2.270 6.308 -16.023 593 1HE LYS 73 2HE LYS 73 -1.569 8.880 -15.113 594 2HE LYS 73 1HE LYS 73 -0.850 8.699 -16.712 595 1HZ LYS 73 1HZ LYS 73 -3.260 9.558 -16.492 596 2HZ LYS 73 2HZ LYS 73 -3.658 7.928 -16.271 597 3HZ LYS 73 3HZ LYS 73 -2.898 8.426 -17.698 598 H LEU 74 H LEU 74 -1.533 2.735 -11.188 599 HA LEU 74 HA LEU 74 0.576 1.359 -12.372 600 1HB LEU 74 2HB LEU 74 -0.133 0.345 -10.440 601 2HB LEU 74 1HB LEU 74 -1.831 0.585 -10.805 602 HG LEU 74 HG LEU 74 -0.882 -1.237 -12.730 603 1HD1 LEU 74 1HD1 LEU 74 -0.186 -3.055 -11.027 604 2HD1 LEU 74 2HD1 LEU 74 0.271 -1.689 -10.011 605 3HD1 LEU 74 3HD1 LEU 74 1.019 -1.898 -11.594 606 1HD2 LEU 74 1HD2 LEU 74 -2.842 -2.121 -12.186 607 2HD2 LEU 74 2HD2 LEU 74 -2.972 -0.954 -10.870 608 3HD2 LEU 74 3HD2 LEU 74 -2.248 -2.536 -10.578 609 H THR 75 H THR 75 0.839 0.368 -14.286 610 HA THR 75 HA THR 75 -1.556 -0.259 -15.880 611 HB THR 75 HB THR 75 0.702 0.426 -17.558 612 HG1 THR 75 1HG THR 75 -0.165 2.301 -15.623 613 1HG2 THR 75 1HG2 THR 75 -2.194 0.950 -17.350 614 2HG2 THR 75 2HG2 THR 75 -1.218 0.515 -18.753 615 3HG2 THR 75 3HG2 THR 75 -1.249 2.185 -18.184 616 H GLN 76 H GLN 76 -0.358 -1.347 -18.083 617 HA GLN 76 HA GLN 76 0.277 -3.950 -17.201 618 1HB GLN 76 2HB GLN 76 0.974 -4.228 -19.678 619 2HB GLN 76 1HB GLN 76 -0.710 -3.881 -19.309 620 1HG GLN 76 2HG GLN 76 -0.665 -1.989 -20.464 621 2HG GLN 76 1HG GLN 76 0.822 -1.457 -19.679 622 1HE2 GLN 76 1HE2 GLN 76 0.529 -0.784 -22.225 623 2HE2 GLN 76 2HE2 GLN 76 1.546 -1.730 -23.253 624 H LYS 77 H LYS 77 2.292 -1.419 -18.681 625 HA LYS 77 HA LYS 77 4.708 -2.826 -18.655 626 1HB LYS 77 2HB LYS 77 5.679 -0.395 -18.492 627 2HB LYS 77 1HB LYS 77 4.825 -0.916 -19.938 628 1HG LYS 77 2HG LYS 77 2.777 0.079 -18.483 629 2HG LYS 77 1HG LYS 77 4.104 1.110 -17.941 630 1HD LYS 77 2HD LYS 77 4.600 1.240 -20.530 631 2HD LYS 77 1HD LYS 77 2.886 0.836 -20.643 632 1HE LYS 77 2HE LYS 77 2.228 2.790 -19.566 633 2HE LYS 77 1HE LYS 77 3.819 3.042 -18.848 634 1HZ LYS 77 1HZ LYS 77 3.889 4.566 -20.512 635 2HZ LYS 77 2HZ LYS 77 2.869 3.690 -21.537 636 3HZ LYS 77 3HZ LYS 77 4.490 3.236 -21.368 637 H LEU 78 H LEU 78 3.265 -0.694 -16.217 638 HA LEU 78 HA LEU 78 5.403 -0.706 -14.404 639 1HB LEU 78 2HB LEU 78 2.508 -0.096 -14.276 640 2HB LEU 78 1HB LEU 78 3.296 -0.445 -12.749 641 HG LEU 78 HG LEU 78 5.037 1.349 -13.821 642 1HD1 LEU 78 1HD1 LEU 78 4.113 2.822 -15.229 643 2HD1 LEU 78 2HD1 LEU 78 2.556 2.789 -14.401 644 3HD1 LEU 78 3HD1 LEU 78 2.962 1.530 -15.569 645 1HD2 LEU 78 1HD2 LEU 78 3.797 3.028 -12.378 646 2HD2 LEU 78 2HD2 LEU 78 4.317 1.539 -11.588 647 3HD2 LEU 78 3HD2 LEU 78 2.631 1.742 -12.063 648 H CYS 79 H CYS 79 2.549 -2.810 -14.627 649 HA CYS 79 HA CYS 79 3.114 -4.397 -12.378 650 1HB CYS 79 2HB CYS 79 0.965 -4.755 -13.090 651 2HB CYS 79 1HB CYS 79 1.398 -4.658 -14.793 652 HG CYS 79 HG CYS 79 0.359 -7.225 -14.059 653 H ASP 80 H ASP 80 4.147 -4.604 -15.732 654 HA ASP 80 HA ASP 80 5.308 -7.162 -15.644 655 1HB ASP 80 2HB ASP 80 5.008 -5.137 -17.551 656 2HB ASP 80 1HB ASP 80 6.750 -5.344 -17.386 657 H GLU 81 H GLU 81 6.298 -4.174 -14.293 658 HA GLU 81 HA GLU 81 9.102 -4.817 -14.154 659 1HB GLU 81 2HB GLU 81 7.500 -2.654 -12.778 660 2HB GLU 81 1HB GLU 81 9.253 -2.787 -12.742 661 1HG GLU 81 2HG GLU 81 8.369 -2.849 -15.453 662 2HG GLU 81 1HG GLU 81 7.637 -1.470 -14.634 663 H SER 82 H SER 82 6.558 -4.372 -11.668 664 HA SER 82 HA SER 82 8.089 -5.419 -9.559 665 1HB SER 82 2HB SER 82 6.330 -4.729 -8.360 666 2HB SER 82 1HB SER 82 5.522 -4.310 -9.871 667 HG SER 82 HG SER 82 4.849 -6.188 -8.140 668 H ASP 83 H ASP 83 7.922 -7.427 -8.467 669 HA ASP 83 HA ASP 83 7.341 -9.654 -10.284 670 1HB ASP 83 2HB ASP 83 8.876 -9.762 -7.684 671 2HB ASP 83 1HB ASP 83 8.835 -10.979 -8.957 672 H PHE 84 H PHE 84 6.270 -8.130 -7.401 673 HA PHE 84 HA PHE 84 4.320 -10.294 -7.006 674 1HB PHE 84 2HB PHE 84 6.236 -9.165 -5.075 675 2HB PHE 84 1HB PHE 84 4.582 -9.289 -4.482 676 HD1 PHE 84 1HD PHE 84 4.107 -11.186 -3.306 677 HD2 PHE 84 2HD PHE 84 6.946 -11.395 -6.471 678 HE1 PHE 84 1HE PHE 84 4.454 -13.576 -2.834 679 HE2 PHE 84 2HE PHE 84 7.295 -13.786 -6.006 680 HZ PHE 84 HZ PHE 84 6.047 -14.879 -4.186 681 H LEU 85 H LEU 85 2.266 -9.646 -6.917 682 HA LEU 85 HA LEU 85 1.734 -6.757 -6.791 683 1HB LEU 85 2HB LEU 85 0.310 -9.060 -8.081 684 2HB LEU 85 1HB LEU 85 -0.565 -7.588 -7.704 685 HG LEU 85 HG LEU 85 0.124 -7.537 -10.013 686 1HD1 LEU 85 1HD1 LEU 85 1.685 -5.503 -9.912 687 2HD1 LEU 85 2HD1 LEU 85 1.549 -5.663 -8.161 688 3HD1 LEU 85 3HD1 LEU 85 0.107 -5.381 -9.136 689 1HD2 LEU 85 1HD2 LEU 85 2.489 -8.758 -9.000 690 2HD2 LEU 85 2HD2 LEU 85 2.934 -7.277 -9.848 691 3HD2 LEU 85 3HD2 LEU 85 1.996 -8.520 -10.675 692 H ILE 86 H ILE 86 0.395 -5.909 -5.245 693 HA ILE 86 HA ILE 86 -0.950 -7.807 -3.448 694 HB ILE 86 HB ILE 86 0.716 -5.456 -2.548 695 1HG1 ILE 86 2HG1 ILE 86 1.080 -8.418 -2.041 696 2HG1 ILE 86 1HG1 ILE 86 1.983 -7.496 -3.238 697 1HG2 ILE 86 1HG2 ILE 86 -0.221 -7.283 -0.495 698 2HG2 ILE 86 2HG2 ILE 86 -1.546 -6.482 -1.338 699 3HG2 ILE 86 3HG2 ILE 86 -0.289 -5.522 -0.558 700 1HD1 ILE 86 1HD1 ILE 86 2.323 -7.668 -0.342 701 2HD1 ILE 86 2HD1 ILE 86 2.407 -6.029 -0.990 702 3HD1 ILE 86 3HD1 ILE 86 3.489 -7.279 -1.607 703 H THR 87 H THR 87 -2.982 -7.357 -3.085 704 HA THR 87 HA THR 87 -3.934 -4.590 -3.424 705 HB THR 87 HB THR 87 -6.095 -5.507 -4.213 706 HG1 THR 87 1HG THR 87 -5.828 -7.623 -3.278 707 1HG2 THR 87 1HG2 THR 87 -3.583 -6.104 -5.742 708 2HG2 THR 87 2HG2 THR 87 -4.743 -4.796 -5.978 709 3HG2 THR 87 3HG2 THR 87 -5.170 -6.446 -6.434 710 H MET 88 H MET 88 -5.136 -3.792 -1.779 711 HA MET 88 HA MET 88 -5.845 -5.667 0.378 712 1HB MET 88 2HB MET 88 -5.679 -2.842 1.135 713 2HB MET 88 1HB MET 88 -4.991 -4.259 1.916 714 1HG MET 88 2HG MET 88 -3.235 -4.228 0.082 715 2HG MET 88 1HG MET 88 -3.837 -2.619 -0.314 716 1HE MET 88 1HE MET 88 -1.484 -1.522 0.051 717 2HE MET 88 2HE MET 88 -0.806 -3.115 0.392 718 3HE MET 88 3HE MET 88 -0.493 -1.769 1.488 719 H ASP 89 H ASP 89 -6.985 -3.391 -1.887 720 HA ASP 89 HA ASP 89 -9.407 -2.724 -0.470 721 1HB ASP 89 2HB ASP 89 -8.830 -2.320 -3.408 722 2HB ASP 89 1HB ASP 89 -10.028 -1.481 -2.430 723 H ASN 90 H ASN 90 -11.262 -3.831 -0.505 724 HA ASN 90 HA ASN 90 -11.410 -6.426 -1.497 725 1HB ASN 90 2HB ASN 90 -13.009 -4.770 0.091 726 2HB ASN 90 1HB ASN 90 -14.038 -5.226 -1.265 727 1HD2 ASN 90 1HD2 ASN 90 -13.003 -6.101 1.741 728 2HD2 ASN 90 2HD2 ASN 90 -13.399 -7.782 1.699 729 H SER 91 H SER 91 -12.163 -3.392 -3.016 730 HA SER 91 HA SER 91 -13.578 -4.645 -5.217 731 1HB SER 91 2HB SER 91 -14.196 -2.517 -5.874 732 2HB SER 91 1HB SER 91 -13.959 -2.263 -4.145 733 HG SER 91 HG SER 91 -11.921 -1.418 -4.587 734 H ASN 92 H ASN 92 -10.419 -3.285 -4.534 735 HA ASN 92 HA ASN 92 -9.435 -3.082 -7.145 736 1HB ASN 92 2HB ASN 92 -8.419 -2.299 -4.874 737 2HB ASN 92 1HB ASN 92 -7.659 -3.888 -4.871 738 1HD2 ASN 92 1HD2 ASN 92 -8.293 -1.384 -7.308 739 2HD2 ASN 92 2HD2 ASN 92 -6.674 -1.321 -7.907 740 H PHE 93 H PHE 93 -9.753 -5.837 -5.019 741 HA PHE 93 HA PHE 93 -8.021 -7.597 -6.377 742 1HB PHE 93 2HB PHE 93 -8.800 -8.073 -4.121 743 2HB PHE 93 1HB PHE 93 -10.463 -8.177 -4.687 744 HD1 PHE 93 1HD PHE 93 -11.347 -10.239 -5.196 745 HD2 PHE 93 2HD PHE 93 -7.122 -9.733 -5.237 746 HE1 PHE 93 1HE PHE 93 -11.067 -12.652 -5.584 747 HE2 PHE 93 2HE PHE 93 -6.834 -12.145 -5.626 748 HZ PHE 93 HZ PHE 93 -8.808 -13.608 -5.800 749 H LYS 94 H LYS 94 -11.559 -7.207 -6.574 750 HA LYS 94 HA LYS 94 -11.924 -9.093 -8.643 751 1HB LYS 94 2HB LYS 94 -13.580 -6.849 -7.539 752 2HB LYS 94 1HB LYS 94 -14.105 -7.707 -8.981 753 1HG LYS 94 2HG LYS 94 -13.323 -9.460 -6.777 754 2HG LYS 94 1HG LYS 94 -14.701 -8.416 -6.420 755 1HD LYS 94 2HD LYS 94 -15.158 -9.374 -9.001 756 2HD LYS 94 1HD LYS 94 -14.554 -10.763 -8.095 757 1HE LYS 94 2HE LYS 94 -17.048 -10.450 -8.052 758 2HE LYS 94 1HE LYS 94 -16.273 -10.560 -6.473 759 1HZ LYS 94 1HZ LYS 94 -16.937 -8.518 -5.945 760 2HZ LYS 94 2HZ LYS 94 -17.973 -8.598 -7.280 761 3HZ LYS 94 3HZ LYS 94 -16.455 -7.867 -7.431 762 H ASN 95 H ASN 95 -11.178 -5.671 -8.641 763 HA ASN 95 HA ASN 95 -11.720 -5.152 -11.362 764 1HB ASN 95 2HB ASN 95 -11.133 -3.569 -9.298 765 2HB ASN 95 1HB ASN 95 -9.517 -3.689 -9.987 766 1HD2 ASN 95 1HD2 ASN 95 -9.440 -1.561 -10.605 767 2HD2 ASN 95 2HD2 ASN 95 -10.390 -0.923 -11.900 768 H VAL 96 H VAL 96 -8.615 -5.737 -9.714 769 HA VAL 96 HA VAL 96 -7.023 -5.845 -12.007 770 HB VAL 96 HB VAL 96 -6.638 -7.184 -9.326 771 1HG1 VAL 96 1HG1 VAL 96 -5.043 -8.358 -10.385 772 2HG1 VAL 96 2HG1 VAL 96 -4.136 -6.847 -10.330 773 3HG1 VAL 96 3HG1 VAL 96 -5.037 -7.283 -11.783 774 1HG2 VAL 96 1HG2 VAL 96 -5.718 -5.266 -8.581 775 2HG2 VAL 96 2HG2 VAL 96 -6.690 -4.537 -9.860 776 3HG2 VAL 96 3HG2 VAL 96 -4.985 -4.889 -10.140 777 H LEU 97 H LEU 97 -9.059 -8.253 -10.511 778 HA LEU 97 HA LEU 97 -8.078 -10.625 -11.464 779 1HB LEU 97 2HB LEU 97 -10.559 -9.675 -10.451 780 2HB LEU 97 1HB LEU 97 -10.901 -10.662 -11.858 781 HG LEU 97 HG LEU 97 -11.006 -12.008 -9.847 782 1HD1 LEU 97 1HD1 LEU 97 -10.304 -13.246 -11.717 783 2HD1 LEU 97 2HD1 LEU 97 -9.194 -13.690 -10.421 784 3HD1 LEU 97 3HD1 LEU 97 -8.682 -12.554 -11.670 785 1HD2 LEU 97 1HD2 LEU 97 -9.693 -11.083 -8.220 786 2HD2 LEU 97 2HD2 LEU 97 -8.355 -10.762 -9.323 787 3HD2 LEU 97 3HD2 LEU 97 -8.647 -12.402 -8.745 788 H LYS 98 H LYS 98 -10.208 -8.375 -13.212 789 HA LYS 98 HA LYS 98 -9.763 -9.924 -15.665 790 1HB LYS 98 2HB LYS 98 -11.646 -8.530 -16.568 791 2HB LYS 98 1HB LYS 98 -12.082 -9.578 -15.225 792 1HG LYS 98 2HG LYS 98 -12.882 -7.834 -14.128 793 2HG LYS 98 1HG LYS 98 -11.281 -7.092 -14.139 794 1HD LYS 98 2HD LYS 98 -12.317 -6.713 -16.715 795 2HD LYS 98 1HD LYS 98 -13.643 -6.359 -15.607 796 1HE LYS 98 2HE LYS 98 -11.933 -4.943 -14.324 797 2HE LYS 98 1HE LYS 98 -10.938 -5.069 -15.775 798 1HZ LYS 98 1HZ LYS 98 -13.704 -3.989 -15.695 799 2HZ LYS 98 2HZ LYS 98 -12.695 -4.049 -17.050 800 3HZ LYS 98 3HZ LYS 98 -12.296 -3.051 -15.744 801 H ASN 99 H ASN 99 -8.879 -7.007 -14.117 802 HA ASN 99 HA ASN 99 -8.442 -5.334 -16.328 803 1HB ASN 99 2HB ASN 99 -7.603 -5.401 -13.503 804 2HB ASN 99 1HB ASN 99 -6.519 -4.525 -14.580 805 1HD2 ASN 99 1HD2 ASN 99 -8.397 -3.548 -16.396 806 2HD2 ASN 99 2HD2 ASN 99 -9.379 -2.376 -15.593 807 H PHE 100 H PHE 100 -6.175 -7.469 -14.597 808 HA PHE 100 HA PHE 100 -4.241 -7.128 -16.765 809 1HB PHE 100 2HB PHE 100 -4.057 -8.207 -13.965 810 2HB PHE 100 1HB PHE 100 -2.796 -8.544 -15.146 811 HD1 PHE 100 1HD PHE 100 -2.323 -6.162 -16.565 812 HD2 PHE 100 2HD PHE 100 -3.399 -6.602 -12.471 813 HE1 PHE 100 1HE PHE 100 -1.267 -3.998 -16.059 814 HE2 PHE 100 2HE PHE 100 -2.346 -4.438 -11.958 815 HZ PHE 100 HZ PHE 100 -1.278 -3.134 -13.754 816 H THR 101 H THR 101 -2.948 -9.206 -17.253 817 HA THR 101 HA THR 101 -4.724 -11.054 -18.463 818 HB THR 101 HB THR 101 -2.325 -12.349 -18.544 819 HG1 THR 101 1HG THR 101 -1.110 -10.092 -19.055 820 1HG2 THR 101 1HG2 THR 101 -1.990 -11.089 -20.718 821 2HG2 THR 101 2HG2 THR 101 -3.413 -10.143 -20.283 822 3HG2 THR 101 3HG2 THR 101 -3.551 -11.886 -20.520 823 H ASN 102 H ASN 102 -3.644 -13.533 -18.145 824 HA ASN 102 HA ASN 102 -4.870 -14.413 -15.744 825 1HB ASN 102 2HB ASN 102 -3.018 -16.286 -17.070 826 2HB ASN 102 1HB ASN 102 -4.712 -16.490 -16.635 827 1HD2 ASN 102 1HD2 ASN 102 -2.735 -16.519 -19.153 828 2HD2 ASN 102 2HD2 ASN 102 -3.786 -15.948 -20.400 829 H THR 103 H THR 103 -2.168 -12.750 -15.872 830 HA THR 103 HA THR 103 -0.559 -14.423 -14.103 831 HB THR 103 HB THR 103 0.641 -13.273 -15.892 832 HG1 THR 103 1HG THR 103 1.309 -11.928 -13.487 833 1HG2 THR 103 1HG2 THR 103 0.865 -10.706 -15.568 834 2HG2 THR 103 2HG2 THR 103 -0.673 -10.850 -14.718 835 3HG2 THR 103 3HG2 THR 103 -0.549 -11.343 -16.407 836 H GLN 104 H GLN 104 -3.154 -12.613 -13.686 837 HA GLN 104 HA GLN 104 -2.443 -10.761 -11.669 838 1HB GLN 104 2HB GLN 104 -4.734 -10.401 -11.378 839 2HB GLN 104 1HB GLN 104 -4.606 -10.884 -13.063 840 1HG GLN 104 2HG GLN 104 -5.280 -12.816 -10.865 841 2HG GLN 104 1HG GLN 104 -6.500 -11.893 -11.739 842 1HE2 GLN 104 1HE2 GLN 104 -7.158 -12.580 -13.688 843 2HE2 GLN 104 2HE2 GLN 104 -6.519 -13.958 -14.512 844 H ASN 105 H ASN 105 -2.402 -14.085 -11.658 845 HA ASN 105 HA ASN 105 -3.383 -14.742 -9.109 846 1HB ASN 105 2HB ASN 105 -1.426 -16.024 -10.988 847 2HB ASN 105 1HB ASN 105 -1.654 -16.682 -9.369 848 1HD2 ASN 105 1HD2 ASN 105 -4.080 -16.868 -8.787 849 2HD2 ASN 105 2HD2 ASN 105 -5.063 -17.623 -9.991 850 H LYS 106 H LYS 106 -0.776 -12.832 -9.963 851 HA LYS 106 HA LYS 106 0.879 -13.502 -7.672 852 1HB LYS 106 2HB LYS 106 1.151 -11.803 -10.082 853 2HB LYS 106 1HB LYS 106 1.996 -11.243 -8.646 854 1HG LYS 106 2HG LYS 106 3.628 -12.528 -9.550 855 2HG LYS 106 1HG LYS 106 2.809 -13.760 -8.590 856 1HD LYS 106 2HD LYS 106 1.948 -14.808 -10.419 857 2HD LYS 106 1HD LYS 106 1.814 -13.312 -11.345 858 1HE LYS 106 2HE LYS 106 4.200 -13.308 -11.748 859 2HE LYS 106 1HE LYS 106 4.401 -14.732 -10.729 860 1HZ LYS 106 1HZ LYS 106 2.484 -15.139 -12.814 861 2HZ LYS 106 2HZ LYS 106 3.835 -16.067 -12.398 862 3HZ LYS 106 3HZ LYS 106 4.008 -14.732 -13.424 863 H VAL 107 H VAL 107 -1.939 -12.112 -7.801 864 HA VAL 107 HA VAL 107 -1.379 -9.676 -6.311 865 HB VAL 107 HB VAL 107 -3.743 -10.822 -7.673 866 1HG1 VAL 107 1HG1 VAL 107 -5.143 -9.048 -6.355 867 2HG1 VAL 107 2HG1 VAL 107 -3.949 -9.341 -5.091 868 3HG1 VAL 107 3HG1 VAL 107 -4.926 -10.674 -5.704 869 1HG2 VAL 107 1HG2 VAL 107 -3.888 -8.735 -8.643 870 2HG2 VAL 107 2HG2 VAL 107 -2.155 -8.877 -8.352 871 3HG2 VAL 107 3HG2 VAL 107 -3.159 -7.924 -7.258 872 H LEU 108 H LEU 108 -1.755 -9.356 -4.172 873 HA LEU 108 HA LEU 108 -2.408 -11.744 -2.587 874 1HB LEU 108 2HB LEU 108 -0.659 -9.382 -2.141 875 2HB LEU 108 1HB LEU 108 -1.430 -10.097 -0.738 876 HG LEU 108 HG LEU 108 -0.376 -12.293 -2.021 877 1HD1 LEU 108 1HD1 LEU 108 0.809 -10.456 -3.448 878 2HD1 LEU 108 2HD1 LEU 108 1.713 -11.858 -2.875 879 3HD1 LEU 108 3HD1 LEU 108 1.854 -10.314 -2.035 880 1HD2 LEU 108 1HD2 LEU 108 1.400 -10.976 -0.084 881 2HD2 LEU 108 2HD2 LEU 108 0.671 -12.581 -0.050 882 3HD2 LEU 108 3HD2 LEU 108 -0.273 -11.173 0.438 883 H LYS 109 H LYS 109 -3.508 -11.262 -0.458 884 HA LYS 109 HA LYS 109 -5.556 -9.179 -0.805 885 1HB LYS 109 2HB LYS 109 -5.840 -12.047 -0.436 886 2HB LYS 109 1HB LYS 109 -6.692 -11.143 0.809 887 1HG LYS 109 2HG LYS 109 -7.695 -9.792 -1.117 888 2HG LYS 109 1HG LYS 109 -7.102 -11.086 -2.158 889 1HD LYS 109 2HD LYS 109 -8.748 -11.722 0.260 890 2HD LYS 109 1HD LYS 109 -9.525 -11.203 -1.238 891 1HE LYS 109 2HE LYS 109 -9.236 -13.204 -2.173 892 2HE LYS 109 1HE LYS 109 -7.528 -13.228 -1.739 893 1HZ LYS 109 1HZ LYS 109 -8.932 -13.660 0.604 894 2HZ LYS 109 2HZ LYS 109 -8.022 -14.788 -0.267 895 3HZ LYS 109 3HZ LYS 109 -9.680 -14.633 -0.562 896 H ILE 110 H ILE 110 -6.232 -8.071 1.018 897 HA ILE 110 HA ILE 110 -4.327 -7.946 3.174 898 HB ILE 110 HB ILE 110 -5.550 -5.960 2.145 899 1HG1 ILE 110 2HG1 ILE 110 -5.972 -5.003 4.584 900 2HG1 ILE 110 1HG1 ILE 110 -5.183 -6.504 5.058 901 1HG2 ILE 110 1HG2 ILE 110 -7.801 -7.193 2.415 902 2HG2 ILE 110 2HG2 ILE 110 -7.740 -5.459 2.733 903 3HG2 ILE 110 3HG2 ILE 110 -7.746 -6.602 4.075 904 1HD1 ILE 110 1HD1 ILE 110 -4.035 -4.072 4.077 905 2HD1 ILE 110 2HD1 ILE 110 -3.590 -5.424 3.035 906 3HD1 ILE 110 3HD1 ILE 110 -3.243 -5.492 4.763 907 H THR 111 H THR 111 -7.154 -9.713 2.581 908 HA THR 111 HA THR 111 -8.278 -9.865 5.155 909 HB THR 111 HB THR 111 -8.338 -12.235 3.329 910 HG1 THR 111 1HG THR 111 -8.610 -10.042 2.208 911 1HG2 THR 111 1HG2 THR 111 -10.883 -11.725 4.041 912 2HG2 THR 111 2HG2 THR 111 -10.038 -11.001 5.409 913 3HG2 THR 111 3HG2 THR 111 -9.783 -12.700 5.015 914 H ASP 112 H ASP 112 -5.689 -11.690 3.606 915 HA ASP 112 HA ASP 112 -5.427 -13.523 5.814 916 1HB ASP 112 2HB ASP 112 -4.818 -13.783 3.225 917 2HB ASP 112 1HB ASP 112 -3.250 -13.236 3.808 918 H PHE 113 H PHE 113 -4.677 -10.365 5.558 919 HA PHE 113 HA PHE 113 -2.504 -10.626 7.509 920 1HB PHE 113 2HB PHE 113 -2.414 -9.187 4.903 921 2HB PHE 113 1HB PHE 113 -1.631 -8.424 6.283 922 HD1 PHE 113 1HD PHE 113 -1.588 -11.287 4.004 923 HD2 PHE 113 2HD PHE 113 0.352 -9.367 7.268 924 HE1 PHE 113 1HE PHE 113 0.394 -12.705 3.655 925 HE2 PHE 113 2HE PHE 113 2.337 -10.782 6.926 926 HZ PHE 113 HZ PHE 113 2.358 -12.453 5.118 927 H SER 114 H SER 114 -5.501 -9.730 7.186 928 HA SER 114 HA SER 114 -5.337 -7.723 9.240 929 1HB SER 114 2HB SER 114 -6.430 -7.026 6.510 930 2HB SER 114 1HB SER 114 -6.777 -6.088 7.962 931 HG SER 114 HG SER 114 -4.918 -5.168 7.724 932 HA PRO 115 HA PRO 115 -8.995 -10.621 9.365 933 1HB PRO 115 2HB PRO 115 -8.208 -10.879 12.185 934 2HB PRO 115 1HB PRO 115 -8.489 -12.138 10.980 935 1HG PRO 115 2HG PRO 115 -6.021 -11.566 11.875 936 2HG PRO 115 1HG PRO 115 -6.319 -12.057 10.195 937 1HD PRO 115 2HD PRO 115 -5.866 -9.312 11.316 938 2HD PRO 115 1HD PRO 115 -5.213 -10.045 9.834 939 H SER 116 H SER 116 -8.152 -8.921 12.386 940 HA SER 116 HA SER 116 -10.878 -8.075 12.735 941 1HB SER 116 2HB SER 116 -9.242 -8.748 14.588 942 2HB SER 116 1HB SER 116 -8.530 -7.146 14.383 943 HG SER 116 HG SER 116 -11.247 -7.695 15.003 944 H LEU 117 H LEU 117 -9.231 -7.010 10.446 945 HA LEU 117 HA LEU 117 -9.513 -4.141 11.054 946 1HB LEU 117 2HB LEU 117 -7.210 -5.161 10.427 947 2HB LEU 117 1HB LEU 117 -7.853 -5.207 8.797 948 HG LEU 117 HG LEU 117 -8.364 -2.670 9.240 949 1HD1 LEU 117 1HD1 LEU 117 -7.611 -2.940 11.654 950 2HD1 LEU 117 2HD1 LEU 117 -6.951 -1.572 10.758 951 3HD1 LEU 117 3HD1 LEU 117 -5.969 -3.013 11.017 952 1HD2 LEU 117 1HD2 LEU 117 -6.621 -3.921 7.710 953 2HD2 LEU 117 2HD2 LEU 117 -5.469 -3.244 8.860 954 3HD2 LEU 117 3HD2 LEU 117 -6.540 -2.177 7.952 955 H ASN 118 H ASN 118 -11.693 -5.790 10.267 956 HA ASN 118 HA ASN 118 -12.284 -5.795 7.550 957 1HB ASN 118 2HB ASN 118 -13.592 -6.934 9.368 958 2HB ASN 118 1HB ASN 118 -14.281 -5.367 9.781 959 1HD2 ASN 118 1HD2 ASN 118 -13.568 -6.787 6.620 960 2HD2 ASN 118 2HD2 ASN 118 -15.194 -6.739 6.039 961 H TYR 119 H TYR 119 -11.881 -4.000 6.370 962 HA TYR 119 HA TYR 119 -13.387 -1.572 7.085 963 1HB TYR 119 2HB TYR 119 -11.610 -0.175 6.432 964 2HB TYR 119 1HB TYR 119 -10.852 -1.440 7.390 965 HD1 TYR 119 1HD TYR 119 -10.121 0.543 4.843 966 HD2 TYR 119 2HD TYR 119 -10.488 -3.639 5.541 967 HE1 TYR 119 1HE TYR 119 -8.570 0.107 2.994 968 HE2 TYR 119 2HE TYR 119 -8.929 -4.087 3.686 969 HH TYR 119 HH TYR 119 -8.214 -2.084 1.361 970 H ASP 120 H ASP 120 -13.412 -0.060 4.997 971 HA ASP 120 HA ASP 120 -14.234 -1.777 2.747 972 1HB ASP 120 2HB ASP 120 -15.503 0.678 3.919 973 2HB ASP 120 1HB ASP 120 -15.781 0.255 2.230 974 H GLU 121 H GLU 121 -11.783 -1.328 2.384 975 HA GLU 121 HA GLU 121 -10.170 -0.443 1.059 976 1HB GLU 121 2HB GLU 121 -12.449 0.950 -0.355 977 2HB GLU 121 1HB GLU 121 -10.848 0.627 -1.005 978 1HG GLU 121 2HG GLU 121 -11.568 -1.302 -1.801 979 2HG GLU 121 1HG GLU 121 -11.926 -1.842 -0.162 980 H VAL 122 H VAL 122 -8.831 0.968 1.968 981 HA VAL 122 HA VAL 122 -7.927 2.892 2.769 982 HB VAL 122 HB VAL 122 -10.097 4.386 1.309 983 1HG1 VAL 122 1HG1 VAL 122 -7.243 5.061 2.008 984 2HG1 VAL 122 2HG1 VAL 122 -8.697 5.750 2.730 985 3HG1 VAL 122 3HG1 VAL 122 -8.316 6.070 1.038 986 1HG2 VAL 122 1HG2 VAL 122 -8.989 2.589 -0.093 987 2HG2 VAL 122 2HG2 VAL 122 -7.492 3.500 0.093 988 3HG2 VAL 122 3HG2 VAL 122 -8.878 4.238 -0.710 989 HA PRO 123 HA PRO 123 -10.459 3.713 6.355 990 1HB PRO 123 2HB PRO 123 -8.649 5.047 7.815 991 2HB PRO 123 1HB PRO 123 -8.484 3.316 7.498 992 1HG PRO 123 2HG PRO 123 -7.117 5.624 6.175 993 2HG PRO 123 1HG PRO 123 -6.441 4.068 6.687 994 1HD PRO 123 2HD PRO 123 -7.177 4.656 4.107 995 2HD PRO 123 1HD PRO 123 -7.115 3.014 4.775 996 H ASP 124 H ASP 124 -9.525 6.238 7.777 997 HA ASP 124 HA ASP 124 -10.040 8.449 7.915 998 1HB ASP 124 2HB ASP 124 -9.292 9.560 6.130 999 2HB ASP 124 1HB ASP 124 -9.372 8.084 5.173 1000 HA PRO 125 HA PRO 125 -14.377 8.644 8.506 1001 1HB PRO 125 2HB PRO 125 -14.897 11.300 7.916 1002 2HB PRO 125 1HB PRO 125 -14.305 10.696 9.467 1003 1HG PRO 125 2HG PRO 125 -12.789 11.923 7.207 1004 2HG PRO 125 1HG PRO 125 -12.571 12.137 8.953 1005 1HD PRO 125 2HD PRO 125 -10.934 10.573 7.523 1006 2HD PRO 125 1HD PRO 125 -11.411 10.142 9.178 1007 H TRP 126 H TRP 126 -13.216 10.140 5.509 1008 HA TRP 126 HA TRP 126 -15.660 10.297 4.164 1009 1HB TRP 126 2HB TRP 126 -13.840 11.439 3.192 1010 2HB TRP 126 1HB TRP 126 -12.813 10.012 3.224 1011 HD1 TRP 126 HD TRP 126 -12.623 8.714 1.021 1012 HE1 TRP 126 1HE TRP 126 -13.876 8.719 -1.224 1013 HE3 TRP 126 3HE TRP 126 -16.441 11.896 2.227 1014 HZ2 TRP 126 2HZ TRP 126 -16.173 9.909 -2.339 1015 HZ3 TRP 126 3HZ TRP 126 -18.126 12.415 0.510 1016 HH2 TRP 126 HH TRP 126 -17.993 11.443 -1.726 1017 H TYR 127 H TYR 127 -13.795 7.580 5.059 1018 HA TYR 127 HA TYR 127 -15.290 5.856 3.203 1019 1HB TYR 127 2HB TYR 127 -12.608 5.584 4.511 1020 2HB TYR 127 1HB TYR 127 -13.483 4.148 3.997 1021 HD1 TYR 127 1HD TYR 127 -11.520 7.002 2.928 1022 HD2 TYR 127 2HD TYR 127 -13.994 3.811 1.597 1023 HE1 TYR 127 1HE TYR 127 -10.656 7.298 0.648 1024 HE2 TYR 127 2HE TYR 127 -13.137 4.087 -0.687 1025 HH TYR 127 HH TYR 127 -10.650 6.512 -1.436 1026 H SER 128 H SER 128 -13.839 5.504 6.455 1027 HA SER 128 HA SER 128 -15.960 3.677 7.201 1028 1HB SER 128 2HB SER 128 -13.262 4.167 8.037 1029 2HB SER 128 1HB SER 128 -14.328 4.237 9.439 1030 HG SER 128 HG SER 128 -13.648 2.099 7.834 1031 H GLY 129 H GLY 129 -14.621 6.659 8.686 1032 1HA GLY 129 2HA GLY 129 -16.873 8.109 9.029 1033 2HA GLY 129 1HA GLY 129 -17.003 6.921 10.312 1034 H ASN 130 H ASN 130 -14.283 6.753 11.075 1035 HA ASN 130 HA ASN 130 -13.923 9.456 12.183 1036 1HB ASN 130 2HB ASN 130 -12.913 8.463 14.129 1037 2HB ASN 130 1HB ASN 130 -14.450 7.659 13.827 1038 1HD2 ASN 130 1HD2 ASN 130 -10.991 7.361 13.749 1039 2HD2 ASN 130 2HD2 ASN 130 -10.943 5.640 13.614 1040 H PHE 131 H PHE 131 -11.552 9.791 12.948 1041 HA PHE 131 HA PHE 131 -9.910 9.518 10.571 1042 1HB PHE 131 2HB PHE 131 -9.313 10.967 13.157 1043 2HB PHE 131 1HB PHE 131 -8.430 11.124 11.643 1044 HD1 PHE 131 1HD PHE 131 -11.565 11.908 13.389 1045 HD2 PHE 131 2HD PHE 131 -9.249 12.489 9.867 1046 HE1 PHE 131 1HE PHE 131 -13.046 13.757 12.725 1047 HE2 PHE 131 2HE PHE 131 -10.726 14.339 9.197 1048 HZ PHE 131 HZ PHE 131 -12.628 14.976 10.627 1049 H ASP 132 H ASP 132 -9.896 8.465 13.928 1050 HA ASP 132 HA ASP 132 -7.351 7.485 14.228 1051 1HB ASP 132 2HB ASP 132 -9.753 5.964 15.224 1052 2HB ASP 132 1HB ASP 132 -8.171 6.125 15.980 1053 H GLU 133 H GLU 133 -9.807 6.291 12.132 1054 HA GLU 133 HA GLU 133 -9.161 3.606 11.899 1055 1HB GLU 133 2HB GLU 133 -9.921 5.394 9.590 1056 2HB GLU 133 1HB GLU 133 -10.173 3.659 9.718 1057 1HG GLU 133 2HG GLU 133 -11.424 5.526 11.684 1058 2HG GLU 133 1HG GLU 133 -12.147 5.262 10.097 1059 H THR 134 H THR 134 -7.818 6.358 10.074 1060 HA THR 134 HA THR 134 -6.121 5.059 8.375 1061 HB THR 134 HB THR 134 -4.530 7.074 8.772 1062 HG1 THR 134 1HG THR 134 -6.430 8.656 9.732 1063 1HG2 THR 134 1HG2 THR 134 -6.680 6.667 7.154 1064 2HG2 THR 134 2HG2 THR 134 -5.629 8.081 7.085 1065 3HG2 THR 134 3HG2 THR 134 -7.145 8.152 7.983 1066 H TYR 135 H TYR 135 -5.545 5.774 11.802 1067 HA TYR 135 HA TYR 135 -2.871 4.869 11.846 1068 1HB TYR 135 2HB TYR 135 -4.351 6.165 13.648 1069 2HB TYR 135 1HB TYR 135 -4.550 4.535 14.282 1070 HD1 TYR 135 1HD TYR 135 -3.230 4.330 16.171 1071 HD2 TYR 135 2HD TYR 135 -1.608 6.261 12.743 1072 HE1 TYR 135 1HE TYR 135 -1.052 4.498 17.300 1073 HE2 TYR 135 2HE TYR 135 0.572 6.433 13.864 1074 HH TYR 135 HH TYR 135 1.215 6.455 16.645 1075 H LYS 136 H LYS 136 -5.860 3.238 12.920 1076 HA LYS 136 HA LYS 136 -4.723 0.787 13.551 1077 1HB LYS 136 2HB LYS 136 -7.472 1.456 12.503 1078 2HB LYS 136 1HB LYS 136 -7.021 -0.153 13.055 1079 1HG LYS 136 2HG LYS 136 -6.798 2.304 14.774 1080 2HG LYS 136 1HG LYS 136 -8.226 1.268 14.730 1081 1HD LYS 136 2HD LYS 136 -6.666 -0.657 15.284 1082 2HD LYS 136 1HD LYS 136 -5.443 0.566 15.634 1083 1HE LYS 136 2HE LYS 136 -8.134 0.788 16.903 1084 2HE LYS 136 1HE LYS 136 -6.977 -0.382 17.539 1085 1HZ LYS 136 1HZ LYS 136 -6.257 1.348 18.734 1086 2HZ LYS 136 2HZ LYS 136 -6.972 2.499 17.721 1087 3HZ LYS 136 3HZ LYS 136 -5.471 1.830 17.316 1088 H ILE 137 H ILE 137 -6.323 1.638 10.482 1089 HA ILE 137 HA ILE 137 -5.741 -0.744 9.142 1090 HB ILE 137 HB ILE 137 -5.954 1.855 7.672 1091 1HG1 ILE 137 2HG1 ILE 137 -7.638 1.952 9.461 1092 2HG1 ILE 137 1HG1 ILE 137 -8.391 1.778 7.882 1093 1HG2 ILE 137 1HG2 ILE 137 -7.631 -0.145 6.629 1094 2HG2 ILE 137 2HG2 ILE 137 -6.096 -0.921 7.017 1095 3HG2 ILE 137 3HG2 ILE 137 -6.130 0.480 5.948 1096 1HD1 ILE 137 1HD1 ILE 137 -7.938 -0.485 9.811 1097 2HD1 ILE 137 2HD1 ILE 137 -8.846 -0.537 8.300 1098 3HD1 ILE 137 3HD1 ILE 137 -9.443 0.422 9.655 1099 H LEU 138 H LEU 138 -4.186 2.418 8.513 1100 HA LEU 138 HA LEU 138 -2.185 1.469 6.858 1101 1HB LEU 138 2HB LEU 138 -2.159 3.856 8.692 1102 2HB LEU 138 1HB LEU 138 -0.948 3.552 7.460 1103 HG LEU 138 HG LEU 138 -3.827 3.668 6.669 1104 1HD1 LEU 138 1HD1 LEU 138 -2.061 6.020 7.295 1105 2HD1 LEU 138 2HD1 LEU 138 -3.665 5.661 7.936 1106 3HD1 LEU 138 3HD1 LEU 138 -3.473 6.121 6.244 1107 1HD2 LEU 138 1HD2 LEU 138 -3.008 3.756 4.592 1108 2HD2 LEU 138 2HD2 LEU 138 -1.492 3.216 5.313 1109 3HD2 LEU 138 3HD2 LEU 138 -1.772 4.934 5.031 1110 H SER 139 H SER 139 -1.779 2.248 10.331 1111 HA SER 139 HA SER 139 0.853 1.468 10.572 1112 1HB SER 139 2HB SER 139 -0.741 2.569 12.303 1113 2HB SER 139 1HB SER 139 -1.078 0.908 12.799 1114 HG SER 139 HG SER 139 1.524 1.081 12.609 1115 H LEU 140 H LEU 140 -2.003 -0.604 11.188 1116 HA LEU 140 HA LEU 140 -0.502 -2.913 11.787 1117 1HB LEU 140 2HB LEU 140 -3.209 -2.202 11.708 1118 2HB LEU 140 1HB LEU 140 -3.053 -3.551 10.600 1119 HG LEU 140 HG LEU 140 -3.661 -4.353 12.801 1120 1HD1 LEU 140 1HD1 LEU 140 -0.765 -5.006 12.296 1121 2HD1 LEU 140 2HD1 LEU 140 -2.110 -5.687 11.380 1122 3HD1 LEU 140 3HD1 LEU 140 -1.966 -6.011 13.108 1123 1HD2 LEU 140 1HD2 LEU 140 -2.768 -2.500 14.118 1124 2HD2 LEU 140 2HD2 LEU 140 -1.125 -3.034 13.763 1125 3HD2 LEU 140 3HD2 LEU 140 -2.193 -4.052 14.727 1126 H ALA 141 H ALA 141 -2.294 -2.135 8.799 1127 HA ALA 141 HA ALA 141 -1.517 -4.329 7.305 1128 1HB ALA 141 1HB ALA 141 -2.796 -1.811 6.810 1129 2HB ALA 141 2HB ALA 141 -2.964 -3.342 5.951 1130 3HB ALA 141 3HB ALA 141 -1.696 -2.207 5.489 1131 H CYS 142 H CYS 142 0.089 -1.158 7.497 1132 HA CYS 142 HA CYS 142 2.118 -1.704 5.636 1133 1HB CYS 142 2HB CYS 142 1.497 0.558 6.535 1134 2HB CYS 142 1HB CYS 142 2.344 0.138 8.020 1135 HG CYS 142 HG CYS 142 4.839 -0.145 6.758 1136 H LYS 143 H LYS 143 1.954 -2.268 9.123 1137 HA LYS 143 HA LYS 143 4.666 -2.986 9.463 1138 1HB LYS 143 2HB LYS 143 3.174 -2.365 11.327 1139 2HB LYS 143 1HB LYS 143 2.265 -3.850 11.084 1140 1HG LYS 143 2HG LYS 143 5.077 -4.403 11.398 1141 2HG LYS 143 1HG LYS 143 4.449 -3.470 12.758 1142 1HD LYS 143 2HD LYS 143 3.423 -5.267 13.573 1143 2HD LYS 143 1HD LYS 143 2.582 -5.525 12.044 1144 1HE LYS 143 2HE LYS 143 4.205 -6.971 11.247 1145 2HE LYS 143 1HE LYS 143 5.445 -6.334 12.327 1146 1HZ LYS 143 1HZ LYS 143 4.511 -8.604 12.870 1147 2HZ LYS 143 2HZ LYS 143 3.092 -7.814 13.341 1148 3HZ LYS 143 3HZ LYS 143 4.548 -7.485 14.139 1149 H ASN 144 H ASN 144 1.813 -5.135 9.458 1150 HA ASN 144 HA ASN 144 3.165 -7.542 9.344 1151 1HB ASN 144 2HB ASN 144 0.439 -6.652 8.529 1152 2HB ASN 144 1HB ASN 144 0.975 -8.248 8.017 1153 1HD2 ASN 144 1HD2 ASN 144 -1.175 -7.811 9.734 1154 2HD2 ASN 144 2HD2 ASN 144 -0.781 -8.461 11.286 1155 H LEU 145 H LEU 145 1.969 -5.586 6.621 1156 HA LEU 145 HA LEU 145 2.837 -7.307 4.585 1157 1HB LEU 145 2HB LEU 145 1.856 -4.569 4.777 1158 2HB LEU 145 1HB LEU 145 3.026 -4.777 3.489 1159 HG LEU 145 HG LEU 145 0.480 -6.367 3.822 1160 1HD1 LEU 145 1HD1 LEU 145 1.222 -3.971 2.222 1161 2HD1 LEU 145 2HD1 LEU 145 -0.289 -4.360 3.046 1162 3HD1 LEU 145 3HD1 LEU 145 0.114 -5.152 1.523 1163 1HD2 LEU 145 1HD2 LEU 145 2.312 -7.664 2.810 1164 2HD2 LEU 145 2HD2 LEU 145 2.508 -6.406 1.590 1165 3HD2 LEU 145 3HD2 LEU 145 1.012 -7.335 1.665 1166 H LEU 146 H LEU 146 4.486 -4.666 6.267 1167 HA LEU 146 HA LEU 146 6.752 -4.459 4.669 1168 1HB LEU 146 2HB LEU 146 6.075 -3.037 6.681 1169 2HB LEU 146 1HB LEU 146 6.822 -4.275 7.673 1170 HG LEU 146 HG LEU 146 8.891 -3.818 6.083 1171 1HD1 LEU 146 1HD1 LEU 146 7.135 -1.427 5.775 1172 2HD1 LEU 146 2HD1 LEU 146 8.144 -2.243 4.582 1173 3HD1 LEU 146 3HD1 LEU 146 8.886 -1.225 5.816 1174 1HD2 LEU 146 1HD2 LEU 146 7.947 -2.517 8.568 1175 2HD2 LEU 146 2HD2 LEU 146 9.348 -1.805 7.768 1176 3HD2 LEU 146 3HD2 LEU 146 9.384 -3.494 8.273 1177 H VAL 147 H VAL 147 6.063 -6.669 7.346 1178 HA VAL 147 HA VAL 147 8.589 -7.938 7.382 1179 HB VAL 147 HB VAL 147 5.932 -9.120 8.207 1180 1HG1 VAL 147 1HG1 VAL 147 7.968 -10.636 7.933 1181 2HG1 VAL 147 2HG1 VAL 147 7.132 -10.678 9.485 1182 3HG1 VAL 147 3HG1 VAL 147 8.641 -9.782 9.322 1183 1HG2 VAL 147 1HG2 VAL 147 7.911 -7.578 9.882 1184 2HG2 VAL 147 2HG2 VAL 147 6.386 -8.279 10.426 1185 3HG2 VAL 147 3HG2 VAL 147 6.381 -6.940 9.278 1186 H PHE 148 H PHE 148 5.603 -8.575 5.616 1187 HA PHE 148 HA PHE 148 6.336 -11.074 4.536 1188 1HB PHE 148 2HB PHE 148 4.030 -10.380 4.508 1189 2HB PHE 148 1HB PHE 148 4.417 -8.963 3.537 1190 HD1 PHE 148 1HD PHE 148 4.609 -9.103 1.177 1191 HD2 PHE 148 2HD PHE 148 4.140 -12.637 3.501 1192 HE1 PHE 148 1HE PHE 148 4.169 -10.388 -0.874 1193 HE2 PHE 148 2HE PHE 148 3.700 -13.929 1.454 1194 HZ PHE 148 HZ PHE 148 3.716 -12.805 -0.738 1195 H LEU 149 H LEU 149 6.414 -7.838 3.023 1196 HA LEU 149 HA LEU 149 7.701 -8.693 0.667 1197 1HB LEU 149 2HB LEU 149 8.190 -6.272 0.324 1198 2HB LEU 149 1HB LEU 149 6.501 -6.638 0.624 1199 HG LEU 149 HG LEU 149 7.414 -6.082 3.148 1200 1HD1 LEU 149 1HD1 LEU 149 9.533 -5.301 1.751 1201 2HD1 LEU 149 2HD1 LEU 149 8.981 -4.438 3.187 1202 3HD1 LEU 149 3HD1 LEU 149 8.557 -3.841 1.583 1203 1HD2 LEU 149 1HD2 LEU 149 6.426 -3.726 2.531 1204 2HD2 LEU 149 2HD2 LEU 149 5.396 -5.157 2.586 1205 3HD2 LEU 149 3HD2 LEU 149 5.980 -4.551 1.036 1206 H SER 150 H SER 150 8.938 -7.675 3.781 1207 HA SER 150 HA SER 150 11.635 -7.327 2.886 1208 1HB SER 150 2HB SER 150 12.202 -7.070 5.218 1209 2HB SER 150 1HB SER 150 10.689 -6.214 4.918 1210 HG SER 150 HG SER 150 10.025 -7.367 6.553 1211 H LYS 151 H LYS 151 9.822 -10.025 3.049 1212 HA LYS 151 HA LYS 151 10.234 -12.259 3.143 1213 1HB LYS 151 2HB LYS 151 12.833 -11.091 2.260 1214 2HB LYS 151 1HB LYS 151 12.790 -12.796 2.685 1215 1HG LYS 151 2HG LYS 151 10.762 -12.890 1.074 1216 2HG LYS 151 1HG LYS 151 11.411 -11.370 0.455 1217 1HD LYS 151 2HD LYS 151 13.104 -12.397 -0.591 1218 2HD LYS 151 1HD LYS 151 13.441 -13.437 0.793 1219 1HE LYS 151 2HE LYS 151 11.539 -14.868 0.140 1220 2HE LYS 151 1HE LYS 151 11.290 -13.852 -1.280 1221 1HZ LYS 151 1HZ LYS 151 13.988 -14.706 -1.122 1222 2HZ LYS 151 2HZ LYS 151 12.864 -14.951 -2.361 1223 3HZ LYS 151 3HZ LYS 151 12.952 -16.042 -1.072 1224 H HIS 152 H HIS 152 9.917 -11.355 5.594 1225 HA HIS 152 HA HIS 152 12.084 -12.597 7.161 1226 1HB HIS 152 2HB HIS 152 10.588 -10.072 7.549 1227 2HB HIS 152 1HB HIS 152 10.852 -11.038 8.998 1228 HD1 HIS 152 1HD HIS 152 13.136 -10.947 10.036 1229 HD2 HIS 152 2HD HIS 152 13.031 -9.234 6.253 1230 HE1 HIS 152 1HE HIS 152 15.374 -9.843 9.736 1231 HE2 HIS 152 2HE HIS 152 15.322 -8.891 7.404 1232 H HIS 153 H HIS 153 11.543 -14.297 8.367 1233 HA HIS 153 HA HIS 153 8.746 -15.105 8.461 1234 1HB HIS 153 2HB HIS 153 11.288 -16.552 9.231 1235 2HB HIS 153 1HB HIS 153 9.676 -17.247 9.362 1236 HD1 HIS 153 1HD HIS 153 12.458 -17.251 7.183 1237 HD2 HIS 153 2HD HIS 153 8.343 -17.087 6.619 1238 HE1 HIS 153 1HE HIS 153 12.075 -17.980 4.807 1239 HE2 HIS 153 2HE HIS 153 9.583 -17.822 4.471 1240 H HIS 154 H HIS 154 8.856 -16.701 10.787 1241 HA HIS 154 HA HIS 154 8.414 -14.649 12.779 1242 1HB HIS 154 2HB HIS 154 7.384 -16.370 14.098 1243 2HB HIS 154 1HB HIS 154 6.840 -16.571 12.437 1244 HD1 HIS 154 1HD HIS 154 8.024 -18.480 15.189 1245 HD2 HIS 154 2HD HIS 154 8.572 -18.654 11.074 1246 HE1 HIS 154 1HE HIS 154 8.815 -20.818 14.716 1247 HE2 HIS 154 2HE HIS 154 9.247 -20.865 12.235 1248 H HIS 155 H HIS 155 10.826 -17.005 11.998 1249 HA HIS 155 HA HIS 155 12.284 -16.270 14.449 1250 1HB HIS 155 2HB HIS 155 11.390 -18.804 13.873 1251 2HB HIS 155 1HB HIS 155 13.040 -18.846 13.262 1252 HD1 HIS 155 1HD HIS 155 14.389 -19.986 14.995 1253 HD2 HIS 155 2HD HIS 155 11.710 -17.277 16.653 1254 HE1 HIS 155 1HE HIS 155 14.879 -19.980 17.462 1255 HE2 HIS 155 2HE HIS 155 13.250 -18.327 18.445 1256 H HIS 156 H HIS 156 13.492 -18.311 11.862 1257 HA HIS 156 HA HIS 156 14.979 -16.137 10.650 1258 1HB HIS 156 2HB HIS 156 17.163 -17.355 10.964 1259 2HB HIS 156 1HB HIS 156 16.493 -16.644 12.430 1260 HD1 HIS 156 1HD HIS 156 15.828 -20.027 10.807 1261 HD2 HIS 156 2HD HIS 156 17.117 -18.384 14.399 1262 HE1 HIS 156 1HE HIS 156 16.132 -21.976 12.367 1263 HE2 HIS 156 2HE HIS 156 16.991 -20.965 14.509 Start of MODEL 4 1 1H MET 1 1HT MET 1 17.782 -8.112 -7.496 2 2H MET 1 2HT MET 1 18.552 -7.902 -8.987 3 3H MET 1 3HT MET 1 17.283 -9.010 -8.840 4 HA MET 1 HA MET 1 16.969 -6.102 -8.391 5 1HB MET 1 2HB MET 1 17.089 -7.707 -10.857 6 2HB MET 1 1HB MET 1 15.684 -6.656 -10.743 7 1HG MET 1 2HG MET 1 17.950 -5.154 -9.956 8 2HG MET 1 1HG MET 1 18.351 -6.000 -11.450 9 1HE MET 1 1HE MET 1 15.985 -2.820 -10.122 10 2HE MET 1 2HE MET 1 15.468 -4.448 -9.684 11 3HE MET 1 3HE MET 1 14.573 -3.536 -10.900 12 H LYS 2 H LYS 2 15.451 -6.209 -6.810 13 HA LYS 2 HA LYS 2 13.069 -7.865 -7.318 14 1HB LYS 2 2HB LYS 2 14.228 -6.831 -4.726 15 2HB LYS 2 1HB LYS 2 12.655 -7.609 -4.848 16 1HG LYS 2 2HG LYS 2 14.586 -9.271 -6.115 17 2HG LYS 2 1HG LYS 2 15.189 -8.809 -4.522 18 1HD LYS 2 2HD LYS 2 12.547 -9.394 -4.034 19 2HD LYS 2 1HD LYS 2 12.996 -10.589 -5.253 20 1HE LYS 2 2HE LYS 2 14.332 -11.705 -3.839 21 2HE LYS 2 1HE LYS 2 14.991 -10.225 -3.145 22 1HZ LYS 2 1HZ LYS 2 12.277 -11.212 -2.493 23 2HZ LYS 2 2HZ LYS 2 13.186 -10.046 -1.673 24 3HZ LYS 2 3HZ LYS 2 13.646 -11.673 -1.611 25 H LYS 3 H LYS 3 11.179 -6.884 -7.675 26 HA LYS 3 HA LYS 3 10.914 -4.043 -6.945 27 1HB LYS 3 2HB LYS 3 10.349 -5.396 -9.557 28 2HB LYS 3 1HB LYS 3 9.417 -3.980 -9.089 29 1HG LYS 3 2HG LYS 3 12.103 -3.314 -8.646 30 2HG LYS 3 1HG LYS 3 12.048 -4.137 -10.207 31 1HD LYS 3 2HD LYS 3 9.895 -2.527 -10.437 32 2HD LYS 3 1HD LYS 3 10.914 -1.540 -9.386 33 1HE LYS 3 2HE LYS 3 12.047 -0.885 -11.179 34 2HE LYS 3 1HE LYS 3 12.609 -2.544 -11.381 35 1HZ LYS 3 1HZ LYS 3 10.277 -1.238 -12.653 36 2HZ LYS 3 2HZ LYS 3 10.458 -2.920 -12.623 37 3HZ LYS 3 3HZ LYS 3 11.612 -1.960 -13.402 38 H ILE 4 H ILE 4 9.030 -3.447 -6.013 39 HA ILE 4 HA ILE 4 6.863 -5.442 -5.916 40 HB ILE 4 HB ILE 4 7.787 -3.687 -3.638 41 1HG1 ILE 4 2HG1 ILE 4 7.885 -6.248 -2.735 42 2HG1 ILE 4 1HG1 ILE 4 8.300 -6.482 -4.430 43 1HG2 ILE 4 1HG2 ILE 4 5.241 -4.825 -4.169 44 2HG2 ILE 4 2HG2 ILE 4 5.776 -3.946 -2.736 45 3HG2 ILE 4 3HG2 ILE 4 5.961 -5.698 -2.815 46 1HD1 ILE 4 1HD1 ILE 4 9.909 -4.412 -3.824 47 2HD1 ILE 4 2HD1 ILE 4 10.380 -6.107 -3.689 48 3HD1 ILE 4 3HD1 ILE 4 9.829 -5.229 -2.263 49 H LEU 5 H LEU 5 5.284 -4.603 -7.125 50 HA LEU 5 HA LEU 5 4.843 -1.751 -7.251 51 1HB LEU 5 2HB LEU 5 4.374 -3.890 -8.965 52 2HB LEU 5 1HB LEU 5 2.774 -3.380 -8.462 53 HG LEU 5 HG LEU 5 4.865 -1.683 -9.826 54 1HD1 LEU 5 1HD1 LEU 5 3.660 -3.257 -11.276 55 2HD1 LEU 5 2HD1 LEU 5 3.256 -1.579 -11.637 56 3HD1 LEU 5 3HD1 LEU 5 2.129 -2.580 -10.722 57 1HD2 LEU 5 1HD2 LEU 5 2.581 -0.939 -8.183 58 2HD2 LEU 5 2HD2 LEU 5 2.504 -0.265 -9.811 59 3HD2 LEU 5 3HD2 LEU 5 3.909 0.049 -8.792 60 H PHE 6 H PHE 6 3.698 -0.727 -5.761 61 HA PHE 6 HA PHE 6 1.719 -2.148 -4.154 62 1HB PHE 6 2HB PHE 6 3.295 0.338 -3.900 63 2HB PHE 6 1HB PHE 6 1.654 0.441 -3.279 64 HD1 PHE 6 1HD PHE 6 2.149 0.667 -0.996 65 HD2 PHE 6 2HD PHE 6 3.773 -2.604 -3.190 66 HE1 PHE 6 1HE PHE 6 2.882 -0.377 1.106 67 HE2 PHE 6 2HE PHE 6 4.502 -3.651 -1.090 68 HZ PHE 6 HZ PHE 6 4.057 -2.539 1.060 69 H ILE 7 H ILE 7 -0.498 -1.770 -4.285 70 HA ILE 7 HA ILE 7 -1.349 0.284 -6.217 71 HB ILE 7 HB ILE 7 -2.797 -2.330 -6.068 72 1HG1 ILE 7 2HG1 ILE 7 -0.761 -1.906 -8.208 73 2HG1 ILE 7 1HG1 ILE 7 -0.205 -2.457 -6.631 74 1HG2 ILE 7 1HG2 ILE 7 -2.485 -0.259 -8.236 75 2HG2 ILE 7 2HG2 ILE 7 -3.882 -0.460 -7.179 76 3HG2 ILE 7 3HG2 ILE 7 -3.467 -1.720 -8.341 77 1HD1 ILE 7 1HD1 ILE 7 -1.461 -4.441 -6.775 78 2HD1 ILE 7 2HD1 ILE 7 -0.683 -4.240 -8.344 79 3HD1 ILE 7 3HD1 ILE 7 -2.390 -3.843 -8.149 80 H CYS 8 H CYS 8 -2.351 1.734 -4.936 81 HA CYS 8 HA CYS 8 -4.449 0.729 -3.139 82 1HB CYS 8 2HB CYS 8 -2.596 3.076 -2.915 83 2HB CYS 8 1HB CYS 8 -4.158 3.105 -2.102 84 HG CYS 8 HG CYS 8 -1.956 2.384 -0.376 85 H LEU 9 H LEU 9 -6.454 1.124 -3.770 86 HA LEU 9 HA LEU 9 -7.166 2.361 -6.127 87 1HB LEU 9 2HB LEU 9 -8.575 0.818 -4.751 88 2HB LEU 9 1HB LEU 9 -8.920 2.165 -3.682 89 HG LEU 9 HG LEU 9 -9.615 3.195 -6.123 90 1HD1 LEU 9 1HD1 LEU 9 -9.478 1.295 -7.436 91 2HD1 LEU 9 2HD1 LEU 9 -11.177 1.311 -6.963 92 3HD1 LEU 9 3HD1 LEU 9 -10.043 0.236 -6.146 93 1HD2 LEU 9 1HD2 LEU 9 -10.848 3.302 -3.975 94 2HD2 LEU 9 2HD2 LEU 9 -11.428 1.663 -4.267 95 3HD2 LEU 9 3HD2 LEU 9 -11.885 2.967 -5.362 96 H GLY 10 H GLY 10 -6.538 3.809 -3.040 97 1HA GLY 10 2HA GLY 10 -7.099 6.440 -4.242 98 2HA GLY 10 1HA GLY 10 -7.694 6.064 -2.631 99 H ASN 11 H ASN 11 -4.869 6.759 -4.569 100 HA ASN 11 HA ASN 11 -3.046 6.569 -2.355 101 1HB ASN 11 2HB ASN 11 -2.647 6.362 -4.990 102 2HB ASN 11 1HB ASN 11 -2.274 8.071 -4.796 103 1HD2 ASN 11 1HD2 ASN 11 -0.557 8.673 -3.411 104 2HD2 ASN 11 2HD2 ASN 11 0.714 7.563 -3.044 105 H ILE 12 H ILE 12 -5.122 8.210 -1.659 106 HA ILE 12 HA ILE 12 -3.732 10.764 -1.307 107 HB ILE 12 HB ILE 12 -5.836 11.999 -1.631 108 1HG1 ILE 12 2HG1 ILE 12 -6.969 9.468 -2.814 109 2HG1 ILE 12 1HG1 ILE 12 -7.248 9.920 -1.134 110 1HG2 ILE 12 1HG2 ILE 12 -5.235 10.343 -4.070 111 2HG2 ILE 12 2HG2 ILE 12 -4.163 11.611 -3.476 112 3HG2 ILE 12 3HG2 ILE 12 -5.797 12.012 -4.001 113 1HD1 ILE 12 1HD1 ILE 12 -8.669 11.583 -1.678 114 2HD1 ILE 12 2HD1 ILE 12 -8.908 10.563 -3.097 115 3HD1 ILE 12 3HD1 ILE 12 -7.833 11.959 -3.184 116 H CYS 13 H CYS 13 -4.812 8.185 0.224 117 HA CYS 13 HA CYS 13 -5.533 9.710 2.612 118 1HB CYS 13 2HB CYS 13 -7.645 8.979 1.587 119 2HB CYS 13 1HB CYS 13 -7.088 7.310 1.638 120 HG CYS 13 HG CYS 13 -7.510 9.223 4.441 121 H ARG 14 H ARG 14 -5.618 6.215 2.000 122 HA ARG 14 HA ARG 14 -3.958 5.731 4.295 123 1HB ARG 14 2HB ARG 14 -5.276 3.920 4.244 124 2HB ARG 14 1HB ARG 14 -5.711 4.190 2.563 125 1HG ARG 14 2HG ARG 14 -4.004 2.848 1.771 126 2HG ARG 14 1HG ARG 14 -3.050 3.012 3.246 127 1HD ARG 14 2HD ARG 14 -3.864 1.032 3.858 128 2HD ARG 14 1HD ARG 14 -5.413 1.840 4.094 129 HE ARG 14 HE ARG 14 -6.200 0.808 2.206 130 1HH1 ARG 14 1HH1 ARG 14 -2.728 0.529 2.300 131 2HH1 ARG 14 2HH1 ARG 14 -2.650 -0.555 0.951 132 1HH2 ARG 14 1HH2 ARG 14 -6.105 -0.616 0.427 133 2HH2 ARG 14 2HH2 ARG 14 -4.569 -1.204 -0.113 134 H SER 15 H SER 15 -3.613 5.351 0.793 135 HA SER 15 HA SER 15 -1.133 4.126 0.690 136 1HB SER 15 2HB SER 15 -1.563 6.188 -1.358 137 2HB SER 15 1HB SER 15 -1.283 4.455 -1.530 138 HG SER 15 HG SER 15 -3.381 4.959 -2.178 139 HA PRO 16 HA PRO 16 0.831 8.671 0.571 140 1HB PRO 16 2HB PRO 16 -1.109 9.974 2.405 141 2HB PRO 16 1HB PRO 16 -0.262 10.637 1.002 142 1HG PRO 16 2HG PRO 16 -2.842 10.027 0.856 143 2HG PRO 16 1HG PRO 16 -1.754 9.698 -0.505 144 1HD PRO 16 2HD PRO 16 -2.879 7.811 1.524 145 2HD PRO 16 1HD PRO 16 -2.629 7.577 -0.219 146 H MET 17 H MET 17 -0.989 7.743 3.506 147 HA MET 17 HA MET 17 0.882 8.602 5.382 148 1HB MET 17 2HB MET 17 -1.528 7.596 5.662 149 2HB MET 17 1HB MET 17 -0.659 6.078 5.848 150 1HG MET 17 2HG MET 17 -0.048 8.516 7.490 151 2HG MET 17 1HG MET 17 -1.238 7.305 7.969 152 1HE MET 17 1HE MET 17 0.660 6.379 10.481 153 2HE MET 17 2HE MET 17 0.446 8.013 9.852 154 3HE MET 17 3HE MET 17 2.068 7.351 10.051 155 H ALA 18 H ALA 18 0.455 5.285 4.134 156 HA ALA 18 HA ALA 18 2.859 4.317 5.278 157 1HB ALA 18 1HB ALA 18 2.118 2.826 2.948 158 2HB ALA 18 2HB ALA 18 0.690 3.208 3.909 159 3HB ALA 18 3HB ALA 18 2.051 2.361 4.647 160 H GLU 19 H GLU 19 2.113 6.074 2.417 161 HA GLU 19 HA GLU 19 4.213 5.388 0.735 162 1HB GLU 19 2HB GLU 19 2.334 6.836 0.076 163 2HB GLU 19 1HB GLU 19 2.947 8.108 1.121 164 1HG GLU 19 2HG GLU 19 3.509 8.569 -1.172 165 2HG GLU 19 1HG GLU 19 4.973 8.244 -0.243 166 H PHE 20 H PHE 20 4.088 8.090 3.055 167 HA PHE 20 HA PHE 20 6.837 8.722 2.759 168 1HB PHE 20 2HB PHE 20 4.838 10.179 3.615 169 2HB PHE 20 1HB PHE 20 5.275 9.526 5.191 170 HD1 PHE 20 1HD PHE 20 6.591 11.418 2.290 171 HD2 PHE 20 2HD PHE 20 7.080 10.401 6.394 172 HE1 PHE 20 1HE PHE 20 8.355 13.121 2.498 173 HE2 PHE 20 2HE PHE 20 8.845 12.103 6.609 174 HZ PHE 20 HZ PHE 20 9.484 13.466 4.660 175 H ILE 21 H ILE 21 5.048 7.011 5.357 176 HA ILE 21 HA ILE 21 7.334 6.621 6.946 177 HB ILE 21 HB ILE 21 6.077 4.996 8.221 178 1HG1 ILE 21 2HG1 ILE 21 3.630 5.288 6.584 179 2HG1 ILE 21 1HG1 ILE 21 4.886 4.253 5.912 180 1HG2 ILE 21 1HG2 ILE 21 3.859 6.774 7.928 181 2HG2 ILE 21 2HG2 ILE 21 5.366 7.674 7.754 182 3HG2 ILE 21 3HG2 ILE 21 5.078 6.709 9.202 183 1HD1 ILE 21 1HD1 ILE 21 4.845 3.242 8.351 184 2HD1 ILE 21 2HD1 ILE 21 3.722 2.714 7.099 185 3HD1 ILE 21 3HD1 ILE 21 3.202 3.881 8.316 186 H MET 22 H MET 22 5.714 4.263 4.789 187 HA MET 22 HA MET 22 7.567 2.213 5.167 188 1HB MET 22 2HB MET 22 5.434 2.781 3.256 189 2HB MET 22 1HB MET 22 6.749 1.845 2.564 190 1HG MET 22 2HG MET 22 6.005 0.868 5.172 191 2HG MET 22 1HG MET 22 4.630 0.889 4.068 192 1HE MET 22 1HE MET 22 6.091 -2.825 4.267 193 2HE MET 22 2HE MET 22 5.109 -1.648 5.140 194 3HE MET 22 3HE MET 22 6.852 -1.716 5.407 195 H LYS 23 H LYS 23 7.484 4.690 2.589 196 HA LYS 23 HA LYS 23 9.724 3.881 1.184 197 1HB LYS 23 2HB LYS 23 8.057 5.839 0.751 198 2HB LYS 23 1HB LYS 23 9.216 6.798 1.661 199 1HG LYS 23 2HG LYS 23 10.964 6.230 0.071 200 2HG LYS 23 1HG LYS 23 9.830 5.221 -0.831 201 1HD LYS 23 2HD LYS 23 9.274 7.016 -2.023 202 2HD LYS 23 1HD LYS 23 8.588 7.721 -0.559 203 1HE LYS 23 2HE LYS 23 10.111 9.322 -1.352 204 2HE LYS 23 1HE LYS 23 10.944 8.514 -0.025 205 1HZ LYS 23 1HZ LYS 23 12.454 8.724 -1.830 206 2HZ LYS 23 2HZ LYS 23 11.350 8.068 -2.930 207 3HZ LYS 23 3HZ LYS 23 12.027 7.089 -1.729 208 H ASP 24 H ASP 24 9.522 5.770 4.151 209 HA ASP 24 HA ASP 24 12.297 6.422 4.245 210 1HB ASP 24 2HB ASP 24 10.339 7.567 5.465 211 2HB ASP 24 1HB ASP 24 10.500 6.277 6.654 212 H LEU 25 H LEU 25 10.323 3.912 5.769 213 HA LEU 25 HA LEU 25 12.378 2.782 7.333 214 1HB LEU 25 2HB LEU 25 10.270 2.220 8.060 215 2HB LEU 25 1HB LEU 25 9.669 1.932 6.440 216 HG LEU 25 HG LEU 25 11.684 -0.012 7.016 217 1HD1 LEU 25 1HD1 LEU 25 10.222 -1.142 8.844 218 2HD1 LEU 25 2HD1 LEU 25 9.711 0.509 9.195 219 3HD1 LEU 25 3HD1 LEU 25 11.416 0.072 9.304 220 1HD2 LEU 25 1HD2 LEU 25 9.129 0.198 5.835 221 2HD2 LEU 25 2HD2 LEU 25 9.038 -1.077 7.050 222 3HD2 LEU 25 3HD2 LEU 25 10.252 -1.161 5.773 223 H VAL 26 H VAL 26 11.234 2.034 4.067 224 HA VAL 26 HA VAL 26 12.724 -0.344 3.767 225 HB VAL 26 HB VAL 26 12.378 -0.010 1.311 226 1HG1 VAL 26 1HG1 VAL 26 9.684 0.416 2.315 227 2HG1 VAL 26 2HG1 VAL 26 10.601 -0.735 3.287 228 3HG1 VAL 26 3HG1 VAL 26 10.398 -1.007 1.556 229 1HG2 VAL 26 1HG2 VAL 26 10.527 2.235 1.873 230 2HG2 VAL 26 2HG2 VAL 26 11.441 1.856 0.412 231 3HG2 VAL 26 3HG2 VAL 26 12.249 2.604 1.790 232 H LYS 27 H LYS 27 13.567 3.026 3.252 233 HA LYS 27 HA LYS 27 15.749 2.778 1.584 234 1HB LYS 27 2HB LYS 27 14.650 4.874 2.681 235 2HB LYS 27 1HB LYS 27 15.859 4.635 3.935 236 1HG LYS 27 2HG LYS 27 17.521 5.408 2.654 237 2HG LYS 27 1HG LYS 27 16.925 4.586 1.210 238 1HD LYS 27 2HD LYS 27 15.114 6.683 1.959 239 2HD LYS 27 1HD LYS 27 16.753 7.324 1.831 240 1HE LYS 27 2HE LYS 27 16.812 5.978 -0.395 241 2HE LYS 27 1HE LYS 27 15.055 6.021 -0.258 242 1HZ LYS 27 1HZ LYS 27 16.222 7.876 -1.551 243 2HZ LYS 27 2HZ LYS 27 16.649 8.496 -0.036 244 3HZ LYS 27 3HZ LYS 27 15.018 8.317 -0.446 245 H LYS 28 H LYS 28 15.772 2.641 5.143 246 HA LYS 28 HA LYS 28 18.529 2.032 5.340 247 1HB LYS 28 2HB LYS 28 18.050 1.540 7.698 248 2HB LYS 28 1HB LYS 28 17.350 3.066 7.179 249 1HG LYS 28 2HG LYS 28 15.490 2.331 8.161 250 2HG LYS 28 1HG LYS 28 15.300 1.321 6.726 251 1HD LYS 28 2HD LYS 28 16.168 -0.568 7.802 252 2HD LYS 28 1HD LYS 28 16.897 0.391 9.092 253 1HE LYS 28 2HE LYS 28 14.706 0.920 9.978 254 2HE LYS 28 1HE LYS 28 13.932 0.071 8.641 255 1HZ LYS 28 1HZ LYS 28 15.195 -1.950 9.465 256 2HZ LYS 28 2HZ LYS 28 13.900 -1.424 10.417 257 3HZ LYS 28 3HZ LYS 28 15.488 -1.071 10.881 258 H ALA 29 H ALA 29 15.705 -0.030 4.962 259 HA ALA 29 HA ALA 29 17.497 -2.359 5.232 260 1HB ALA 29 1HB ALA 29 16.123 -3.294 6.685 261 2HB ALA 29 2HB ALA 29 14.737 -3.058 5.619 262 3HB ALA 29 3HB ALA 29 15.226 -1.775 6.726 263 H ASN 30 H ASN 30 16.780 -0.881 2.726 264 HA ASN 30 HA ASN 30 16.214 -3.224 1.161 265 1HB ASN 30 2HB ASN 30 14.058 -1.411 1.807 266 2HB ASN 30 1HB ASN 30 14.344 -1.440 0.069 267 1HD2 ASN 30 1HD2 ASN 30 12.194 -2.389 0.036 268 2HD2 ASN 30 2HD2 ASN 30 12.027 -4.092 0.268 269 H LEU 31 H LEU 31 16.205 0.341 0.957 270 HA LEU 31 HA LEU 31 17.167 0.467 -1.685 271 1HB LEU 31 2HB LEU 31 16.129 2.321 -0.211 272 2HB LEU 31 1HB LEU 31 17.760 2.563 0.385 273 HG LEU 31 HG LEU 31 17.950 2.557 -2.427 274 1HD1 LEU 31 1HD1 LEU 31 15.759 3.029 -2.913 275 2HD1 LEU 31 2HD1 LEU 31 16.412 4.655 -2.710 276 3HD1 LEU 31 3HD1 LEU 31 15.496 3.902 -1.404 277 1HD2 LEU 31 1HD2 LEU 31 18.959 4.611 -2.106 278 2HD2 LEU 31 2HD2 LEU 31 19.151 3.858 -0.524 279 3HD2 LEU 31 3HD2 LEU 31 17.879 5.053 -0.784 280 H GLU 32 H GLU 32 18.708 -0.238 1.285 281 HA GLU 32 HA GLU 32 21.361 0.511 0.578 282 1HB GLU 32 2HB GLU 32 20.452 -1.566 2.580 283 2HB GLU 32 1HB GLU 32 22.038 -0.810 2.512 284 1HG GLU 32 2HG GLU 32 19.594 0.873 2.840 285 2HG GLU 32 1HG GLU 32 20.278 0.020 4.224 286 H LYS 33 H LYS 33 19.425 -2.399 0.240 287 HA LYS 33 HA LYS 33 21.660 -3.821 -1.006 288 1HB LYS 33 2HB LYS 33 19.160 -4.600 0.336 289 2HB LYS 33 1HB LYS 33 19.525 -5.537 -1.106 290 1HG LYS 33 2HG LYS 33 21.137 -6.673 -0.083 291 2HG LYS 33 1HG LYS 33 21.840 -5.212 0.612 292 1HD LYS 33 2HD LYS 33 20.528 -5.331 2.517 293 2HD LYS 33 1HD LYS 33 19.297 -6.318 1.728 294 1HE LYS 33 2HE LYS 33 20.902 -7.409 3.453 295 2HE LYS 33 1HE LYS 33 20.518 -8.264 1.961 296 1HZ LYS 33 1HZ LYS 33 22.966 -8.056 2.741 297 2HZ LYS 33 2HZ LYS 33 22.876 -6.513 2.052 298 3HZ LYS 33 3HZ LYS 33 22.594 -7.882 1.099 299 H GLU 34 H GLU 34 19.900 -1.542 -2.104 300 HA GLU 34 HA GLU 34 19.119 -0.873 -4.123 301 1HB GLU 34 2HB GLU 34 20.901 -3.122 -4.755 302 2HB GLU 34 1HB GLU 34 19.704 -2.778 -5.995 303 1HG GLU 34 2HG GLU 34 20.498 -0.583 -6.297 304 2HG GLU 34 1HG GLU 34 21.460 -0.649 -4.821 305 H PHE 35 H PHE 35 17.081 -1.523 -2.853 306 HA PHE 35 HA PHE 35 15.596 -3.586 -4.342 307 1HB PHE 35 2HB PHE 35 15.460 -2.606 -1.523 308 2HB PHE 35 1HB PHE 35 13.978 -3.186 -2.276 309 HD1 PHE 35 1HD PHE 35 17.516 -4.372 -2.452 310 HD2 PHE 35 2HD PHE 35 13.480 -5.260 -1.432 311 HE1 PHE 35 1HE PHE 35 18.162 -6.687 -1.927 312 HE2 PHE 35 2HE PHE 35 14.120 -7.577 -0.904 313 HZ PHE 35 HZ PHE 35 16.462 -8.292 -1.152 314 H PHE 36 H PHE 36 13.898 -2.990 -5.566 315 HA PHE 36 HA PHE 36 13.157 -0.150 -5.537 316 1HB PHE 36 2HB PHE 36 13.629 -2.063 -7.639 317 2HB PHE 36 1HB PHE 36 12.009 -1.387 -7.786 318 HD1 PHE 36 1HD PHE 36 11.682 0.745 -8.670 319 HD2 PHE 36 2HD PHE 36 15.584 -0.457 -7.470 320 HE1 PHE 36 1HE PHE 36 12.622 2.772 -9.703 321 HE2 PHE 36 2HE PHE 36 16.530 1.567 -8.499 322 HZ PHE 36 HZ PHE 36 15.048 3.185 -9.617 323 H ILE 37 H ILE 37 11.194 0.504 -4.985 324 HA ILE 37 HA ILE 37 8.997 -1.443 -4.883 325 HB ILE 37 HB ILE 37 8.341 0.084 -2.768 326 1HG1 ILE 37 2HG1 ILE 37 10.784 -0.161 -1.532 327 2HG1 ILE 37 1HG1 ILE 37 11.237 0.396 -3.140 328 1HG2 ILE 37 1HG2 ILE 37 8.254 -2.286 -2.697 329 2HG2 ILE 37 2HG2 ILE 37 9.273 -1.772 -1.353 330 3HG2 ILE 37 3HG2 ILE 37 10.008 -2.420 -2.820 331 1HD1 ILE 37 1HD1 ILE 37 10.680 2.062 -1.169 332 2HD1 ILE 37 2HD1 ILE 37 9.038 1.821 -1.763 333 3HD1 ILE 37 3HD1 ILE 37 10.286 2.433 -2.848 334 H ASN 38 H ASN 38 7.379 -0.721 -6.092 335 HA ASN 38 HA ASN 38 7.148 2.164 -6.577 336 1HB ASN 38 2HB ASN 38 5.720 -0.018 -8.092 337 2HB ASN 38 1HB ASN 38 6.013 1.644 -8.597 338 1HD2 ASN 38 1HD2 ASN 38 7.222 -1.544 -8.482 339 2HD2 ASN 38 2HD2 ASN 38 8.721 -1.251 -9.289 340 H SER 39 H SER 39 4.795 2.837 -7.081 341 HA SER 39 HA SER 39 2.698 1.566 -5.617 342 1HB SER 39 2HB SER 39 2.345 3.306 -3.936 343 2HB SER 39 1HB SER 39 3.950 2.603 -3.744 344 HG SER 39 HG SER 39 3.216 5.159 -4.428 345 H ALA 40 H ALA 40 0.819 2.092 -6.570 346 HA ALA 40 HA ALA 40 0.362 4.726 -7.663 347 1HB ALA 40 1HB ALA 40 1.591 3.006 -9.353 348 2HB ALA 40 2HB ALA 40 0.521 4.311 -9.868 349 3HB ALA 40 3HB ALA 40 -0.103 2.668 -9.709 350 H GLY 41 H GLY 41 -1.835 4.684 -8.915 351 1HA GLY 41 2HA GLY 41 -3.718 3.245 -7.180 352 2HA GLY 41 1HA GLY 41 -4.087 4.677 -8.130 353 H THR 42 H THR 42 -5.838 2.650 -8.259 354 HA THR 42 HA THR 42 -5.403 0.635 -10.133 355 HB THR 42 HB THR 42 -8.083 1.959 -9.876 356 HG1 THR 42 1HG THR 42 -8.114 0.298 -7.982 357 1HG2 THR 42 1HG2 THR 42 -8.084 0.110 -11.355 358 2HG2 THR 42 2HG2 THR 42 -8.766 -0.485 -9.841 359 3HG2 THR 42 3HG2 THR 42 -7.095 -0.859 -10.262 360 H SER 43 H SER 43 -6.752 3.897 -10.639 361 HA SER 43 HA SER 43 -6.251 3.529 -13.522 362 1HB SER 43 2HB SER 43 -8.720 3.858 -12.409 363 2HB SER 43 1HB SER 43 -8.285 5.528 -12.774 364 HG SER 43 HG SER 43 -7.659 3.885 -14.828 365 H GLY 44 H GLY 44 -5.089 5.030 -10.907 366 1HA GLY 44 2HA GLY 44 -3.771 6.872 -10.559 367 2HA GLY 44 1HA GLY 44 -3.487 6.838 -12.291 368 H GLU 45 H GLU 45 -6.712 7.277 -11.030 369 HA GLU 45 HA GLU 45 -7.177 9.623 -12.483 370 1HB GLU 45 2HB GLU 45 -8.639 8.905 -9.945 371 2HB GLU 45 1HB GLU 45 -9.257 9.777 -11.342 372 1HG GLU 45 2HG GLU 45 -8.341 7.191 -12.153 373 2HG GLU 45 1HG GLU 45 -9.448 7.035 -10.789 374 H HIS 46 H HIS 46 -7.295 9.529 -8.938 375 HA HIS 46 HA HIS 46 -5.853 12.099 -8.908 376 1HB HIS 46 2HB HIS 46 -7.046 12.207 -6.541 377 2HB HIS 46 1HB HIS 46 -7.874 12.724 -8.006 378 HD1 HIS 46 1HD HIS 46 -10.069 11.656 -8.454 379 HD2 HIS 46 2HD HIS 46 -7.780 9.458 -5.772 380 HE1 HIS 46 1HE HIS 46 -11.563 9.793 -7.666 381 HE2 HIS 46 2HE HIS 46 -10.125 8.422 -6.118 382 H ASP 47 H ASP 47 -5.867 8.847 -7.955 383 HA ASP 47 HA ASP 47 -4.580 8.655 -5.573 384 1HB ASP 47 2HB ASP 47 -3.422 6.977 -7.738 385 2HB ASP 47 1HB ASP 47 -4.048 6.504 -6.158 386 H GLY 48 H GLY 48 -3.103 10.134 -4.953 387 1HA GLY 48 2HA GLY 48 -0.487 9.994 -5.163 388 2HA GLY 48 1HA GLY 48 -0.844 10.741 -6.714 389 H GLU 49 H GLU 49 -3.175 12.145 -5.385 390 HA GLU 49 HA GLU 49 -1.918 14.600 -4.888 391 1HB GLU 49 2HB GLU 49 -4.180 14.632 -5.592 392 2HB GLU 49 1HB GLU 49 -4.682 13.555 -4.299 393 1HG GLU 49 2HG GLU 49 -5.475 15.649 -3.673 394 2HG GLU 49 1HG GLU 49 -4.019 15.421 -2.704 395 H GLY 50 H GLY 50 -2.943 12.015 -2.734 396 1HA GLY 50 2HA GLY 50 -2.506 11.611 -0.521 397 2HA GLY 50 1HA GLY 50 -1.121 12.677 -0.709 398 H MET 51 H MET 51 -4.632 12.685 -0.160 399 HA MET 51 HA MET 51 -4.449 14.484 2.015 400 1HB MET 51 2HB MET 51 -4.014 16.125 0.256 401 2HB MET 51 1HB MET 51 -5.490 15.650 -0.572 402 1HG MET 51 2HG MET 51 -6.639 16.301 1.665 403 2HG MET 51 1HG MET 51 -5.151 17.202 1.951 404 1HE MET 51 1HE MET 51 -4.453 19.200 -0.647 405 2HE MET 51 2HE MET 51 -4.431 19.042 1.108 406 3HE MET 51 3HE MET 51 -5.420 20.288 0.348 407 H HIS 52 H HIS 52 -5.893 13.368 3.195 408 HA HIS 52 HA HIS 52 -8.671 13.532 2.521 409 1HB HIS 52 2HB HIS 52 -7.267 11.181 1.728 410 2HB HIS 52 1HB HIS 52 -8.343 10.756 3.054 411 HD1 HIS 52 1HD HIS 52 -9.849 13.470 1.265 412 HD2 HIS 52 2HD HIS 52 -9.572 9.362 0.708 413 HE1 HIS 52 1HE HIS 52 -11.689 12.885 -0.345 414 HE2 HIS 52 2HE HIS 52 -11.547 10.384 -0.613 415 H TYR 53 H TYR 53 -10.052 12.944 4.255 416 HA TYR 53 HA TYR 53 -9.217 13.652 6.774 417 1HB TYR 53 2HB TYR 53 -11.478 11.714 6.376 418 2HB TYR 53 1HB TYR 53 -11.335 13.014 7.554 419 HD1 TYR 53 1HD TYR 53 -13.088 12.074 4.778 420 HD2 TYR 53 2HD TYR 53 -10.890 15.408 6.244 421 HE1 TYR 53 1HE TYR 53 -14.355 13.557 3.279 422 HE2 TYR 53 2HE TYR 53 -12.151 16.903 4.751 423 HH TYR 53 HH TYR 53 -14.906 15.780 2.924 424 H GLY 54 H GLY 54 -9.440 12.239 8.774 425 1HA GLY 54 2HA GLY 54 -8.776 10.440 10.040 426 2HA GLY 54 1HA GLY 54 -8.785 9.474 8.576 427 H THR 55 H THR 55 -6.888 9.656 7.150 428 HA THR 55 HA THR 55 -4.519 9.241 8.565 429 HB THR 55 HB THR 55 -3.711 9.959 5.992 430 HG1 THR 55 1HG THR 55 -5.601 10.002 4.981 431 1HG2 THR 55 1HG2 THR 55 -3.092 7.764 5.854 432 2HG2 THR 55 2HG2 THR 55 -4.619 7.176 6.513 433 3HG2 THR 55 3HG2 THR 55 -3.397 7.855 7.589 434 H LYS 56 H LYS 56 -5.494 12.047 6.584 435 HA LYS 56 HA LYS 56 -3.200 13.589 7.018 436 1HB LYS 56 2HB LYS 56 -5.714 13.936 5.762 437 2HB LYS 56 1HB LYS 56 -5.513 15.287 6.869 438 1HG LYS 56 2HG LYS 56 -3.105 15.340 5.742 439 2HG LYS 56 1HG LYS 56 -4.003 14.593 4.420 440 1HD LYS 56 2HD LYS 56 -4.302 16.798 3.893 441 2HD LYS 56 1HD LYS 56 -5.702 16.549 4.939 442 1HE LYS 56 2HE LYS 56 -3.306 17.278 6.419 443 2HE LYS 56 1HE LYS 56 -3.767 18.497 5.231 444 1HZ LYS 56 1HZ LYS 56 -5.943 18.624 6.197 445 2HZ LYS 56 2HZ LYS 56 -4.798 18.835 7.424 446 3HZ LYS 56 3HZ LYS 56 -5.604 17.356 7.266 447 H ASN 57 H ASN 57 -6.277 13.543 8.774 448 HA ASN 57 HA ASN 57 -5.766 15.518 10.644 449 1HB ASN 57 2HB ASN 57 -7.960 14.721 10.635 450 2HB ASN 57 1HB ASN 57 -7.452 13.035 10.672 451 1HD2 ASN 57 1HD2 ASN 57 -7.445 12.018 12.560 452 2HD2 ASN 57 2HD2 ASN 57 -7.618 12.772 14.105 453 H LYS 58 H LYS 58 -4.917 12.090 10.708 454 HA LYS 58 HA LYS 58 -3.828 12.081 13.319 455 1HB LYS 58 2HB LYS 58 -4.307 9.950 12.621 456 2HB LYS 58 1HB LYS 58 -3.785 10.255 10.971 457 1HG LYS 58 2HG LYS 58 -1.504 9.991 11.544 458 2HG LYS 58 1HG LYS 58 -1.866 10.028 13.271 459 1HD LYS 58 2HD LYS 58 -1.394 7.749 12.378 460 2HD LYS 58 1HD LYS 58 -2.973 7.907 13.151 461 1HE LYS 58 2HE LYS 58 -2.901 6.633 10.955 462 2HE LYS 58 1HE LYS 58 -4.098 7.922 11.083 463 1HZ LYS 58 1HZ LYS 58 -2.882 9.295 9.687 464 2HZ LYS 58 2HZ LYS 58 -2.691 7.775 8.969 465 3HZ LYS 58 3HZ LYS 58 -1.441 8.433 9.900 466 H LEU 59 H LEU 59 -2.379 12.506 10.107 467 HA LEU 59 HA LEU 59 0.298 12.540 10.867 468 1HB LEU 59 2HB LEU 59 -1.005 14.164 8.677 469 2HB LEU 59 1HB LEU 59 0.711 13.828 8.819 470 HG LEU 59 HG LEU 59 -1.360 11.663 8.488 471 1HD1 LEU 59 1HD1 LEU 59 0.385 12.733 6.297 472 2HD1 LEU 59 2HD1 LEU 59 -1.242 13.348 6.583 473 3HD1 LEU 59 3HD1 LEU 59 -0.999 11.649 6.176 474 1HD2 LEU 59 1HD2 LEU 59 1.613 11.774 8.572 475 2HD2 LEU 59 2HD2 LEU 59 0.835 10.582 7.530 476 3HD2 LEU 59 3HD2 LEU 59 0.506 10.589 9.263 477 H ALA 60 H ALA 60 -1.935 15.297 10.511 478 HA ALA 60 HA ALA 60 -0.153 17.259 11.447 479 1HB ALA 60 1HB ALA 60 -2.471 17.482 10.278 480 2HB ALA 60 2HB ALA 60 -1.950 18.714 11.427 481 3HB ALA 60 3HB ALA 60 -3.097 17.471 11.927 482 H GLN 61 H GLN 61 -2.219 14.970 13.062 483 HA GLN 61 HA GLN 61 -2.233 16.133 15.626 484 1HB GLN 61 2HB GLN 61 -3.749 14.303 14.745 485 2HB GLN 61 1HB GLN 61 -2.421 13.187 15.031 486 1HG GLN 61 2HG GLN 61 -2.440 13.775 17.404 487 2HG GLN 61 1HG GLN 61 -3.784 14.879 17.113 488 1HE2 GLN 61 1HE2 GLN 61 -3.127 11.615 15.910 489 2HE2 GLN 61 2HE2 GLN 61 -4.579 10.907 16.521 490 H LEU 62 H LEU 62 0.064 13.976 14.040 491 HA LEU 62 HA LEU 62 1.991 14.544 16.128 492 1HB LEU 62 2HB LEU 62 2.445 11.956 16.203 493 2HB LEU 62 1HB LEU 62 1.258 12.703 17.256 494 HG LEU 62 HG LEU 62 0.002 11.928 14.789 495 1HD1 LEU 62 1HD1 LEU 62 1.954 10.302 14.840 496 2HD1 LEU 62 2HD1 LEU 62 0.336 9.607 14.740 497 3HD1 LEU 62 3HD1 LEU 62 1.200 9.614 16.278 498 1HD2 LEU 62 1HD2 LEU 62 -1.588 10.982 16.211 499 2HD2 LEU 62 2HD2 LEU 62 -0.934 12.329 17.143 500 3HD2 LEU 62 3HD2 LEU 62 -0.407 10.681 17.485 501 H ASN 63 H ASN 63 1.329 12.563 13.245 502 HA ASN 63 HA ASN 63 4.069 12.318 12.514 503 1HB ASN 63 2HB ASN 63 1.621 11.984 10.762 504 2HB ASN 63 1HB ASN 63 3.244 11.383 10.414 505 1HD2 ASN 63 1HD2 ASN 63 0.270 10.622 11.677 506 2HD2 ASN 63 2HD2 ASN 63 0.698 9.188 12.540 507 H ILE 64 H ILE 64 3.686 12.925 9.660 508 HA ILE 64 HA ILE 64 4.014 15.847 9.825 509 HB ILE 64 HB ILE 64 5.171 13.931 7.800 510 1HG1 ILE 64 2HG1 ILE 64 6.181 13.766 10.067 511 2HG1 ILE 64 1HG1 ILE 64 7.315 14.353 8.856 512 1HG2 ILE 64 1HG2 ILE 64 4.826 16.794 7.774 513 2HG2 ILE 64 2HG2 ILE 64 5.404 15.719 6.500 514 3HG2 ILE 64 3HG2 ILE 64 6.534 16.359 7.694 515 1HD1 ILE 64 1HD1 ILE 64 6.101 16.627 9.966 516 2HD1 ILE 64 2HD1 ILE 64 7.759 16.064 10.180 517 3HD1 ILE 64 3HD1 ILE 64 6.504 15.561 11.311 518 H GLU 65 H GLU 65 2.643 17.102 8.746 519 HA GLU 65 HA GLU 65 0.409 16.057 7.374 520 1HB GLU 65 2HB GLU 65 1.416 18.685 8.145 521 2HB GLU 65 1HB GLU 65 0.568 18.709 6.605 522 1HG GLU 65 2HG GLU 65 -1.429 17.947 7.567 523 2HG GLU 65 1HG GLU 65 -0.618 17.439 9.048 524 H HIS 66 H HIS 66 3.377 15.819 6.284 525 HA HIS 66 HA HIS 66 2.669 16.492 3.510 526 1HB HIS 66 2HB HIS 66 5.334 16.522 4.910 527 2HB HIS 66 1HB HIS 66 5.202 16.497 3.154 528 HD1 HIS 66 1HD HIS 66 6.564 18.882 4.311 529 HD2 HIS 66 2HD HIS 66 2.442 18.721 3.803 530 HE1 HIS 66 1HE HIS 66 5.802 21.277 4.225 531 HE2 HIS 66 2HE HIS 66 3.298 21.155 3.984 532 H LYS 67 H LYS 67 3.411 15.108 1.842 533 HA LYS 67 HA LYS 67 4.473 12.510 2.469 534 1HB LYS 67 2HB LYS 67 2.406 11.457 1.233 535 2HB LYS 67 1HB LYS 67 2.347 11.763 2.963 536 1HG LYS 67 2HG LYS 67 1.441 13.998 1.298 537 2HG LYS 67 1HG LYS 67 0.456 12.539 1.181 538 1HD LYS 67 2HD LYS 67 0.902 12.773 3.887 539 2HD LYS 67 1HD LYS 67 0.724 14.451 3.369 540 1HE LYS 67 2HE LYS 67 -1.474 14.062 3.582 541 2HE LYS 67 1HE LYS 67 -1.314 13.247 2.026 542 1HZ LYS 67 1HZ LYS 67 -0.603 11.397 3.955 543 2HZ LYS 67 2HZ LYS 67 -2.011 11.412 3.020 544 3HZ LYS 67 3HZ LYS 67 -1.998 12.153 4.541 545 H ASN 68 H ASN 68 4.639 11.160 0.426 546 HA ASN 68 HA ASN 68 5.866 12.680 -1.595 547 1HB ASN 68 2HB ASN 68 6.063 10.122 -0.934 548 2HB ASN 68 1HB ASN 68 4.854 9.937 -2.202 549 1HD2 ASN 68 1HD2 ASN 68 7.488 12.269 -2.035 550 2HD2 ASN 68 2HD2 ASN 68 8.321 11.703 -3.438 551 H PHE 69 H PHE 69 4.599 14.178 -2.587 552 HA PHE 69 HA PHE 69 1.971 13.499 -3.578 553 1HB PHE 69 2HB PHE 69 3.558 16.013 -4.122 554 2HB PHE 69 1HB PHE 69 1.820 15.794 -4.279 555 HD1 PHE 69 1HD PHE 69 4.284 17.176 -2.297 556 HD2 PHE 69 2HD PHE 69 0.694 14.912 -1.992 557 HE1 PHE 69 1HE PHE 69 3.985 17.968 0.013 558 HE2 PHE 69 2HE PHE 69 0.388 15.700 0.318 559 HZ PHE 69 HZ PHE 69 2.035 17.232 1.323 560 H THR 70 H THR 70 2.224 11.936 -5.143 561 HA THR 70 HA THR 70 3.236 12.892 -7.699 562 HB THR 70 HB THR 70 5.227 11.842 -7.095 563 HG1 THR 70 1HG THR 70 3.739 9.721 -8.282 564 1HG2 THR 70 1HG2 THR 70 3.739 10.567 -5.164 565 2HG2 THR 70 2HG2 THR 70 5.451 10.297 -5.485 566 3HG2 THR 70 3HG2 THR 70 4.241 9.240 -6.212 567 H SER 71 H SER 71 1.333 12.754 -8.744 568 HA SER 71 HA SER 71 -0.626 10.777 -8.339 569 1HB SER 71 2HB SER 71 -1.595 12.534 -9.423 570 2HB SER 71 1HB SER 71 -0.130 12.921 -10.323 571 HG SER 71 HG SER 71 -1.583 10.586 -10.911 572 H LYS 72 H LYS 72 -0.081 8.686 -8.535 573 HA LYS 72 HA LYS 72 1.404 7.839 -10.922 574 1HB LYS 72 2HB LYS 72 1.140 6.773 -8.157 575 2HB LYS 72 1HB LYS 72 1.390 5.616 -9.456 576 1HG LYS 72 2HG LYS 72 3.198 7.919 -9.517 577 2HG LYS 72 1HG LYS 72 3.369 6.877 -8.103 578 1HD LYS 72 2HD LYS 72 4.400 5.311 -9.305 579 2HD LYS 72 1HD LYS 72 3.101 5.301 -10.500 580 1HE LYS 72 2HE LYS 72 4.338 6.443 -11.955 581 2HE LYS 72 1HE LYS 72 4.704 7.680 -10.755 582 1HZ LYS 72 1HZ LYS 72 6.316 5.792 -9.907 583 2HZ LYS 72 2HZ LYS 72 6.779 6.882 -11.115 584 3HZ LYS 72 3HZ LYS 72 6.252 5.331 -11.533 585 H LYS 73 H LYS 73 0.710 6.038 -12.145 586 HA LYS 73 HA LYS 73 -2.077 5.201 -11.740 587 1HB LYS 73 2HB LYS 73 -2.223 6.926 -13.403 588 2HB LYS 73 1HB LYS 73 -0.871 6.254 -14.303 589 1HG LYS 73 2HG LYS 73 -2.418 4.153 -14.475 590 2HG LYS 73 1HG LYS 73 -3.696 5.325 -14.148 591 1HD LYS 73 2HD LYS 73 -1.680 5.993 -16.228 592 2HD LYS 73 1HD LYS 73 -2.896 4.774 -16.615 593 1HE LYS 73 2HE LYS 73 -4.074 7.080 -15.326 594 2HE LYS 73 1HE LYS 73 -3.181 7.539 -16.775 595 1HZ LYS 73 1HZ LYS 73 -4.777 5.209 -17.193 596 2HZ LYS 73 2HZ LYS 73 -4.743 6.659 -18.064 597 3HZ LYS 73 3HZ LYS 73 -5.716 6.523 -16.688 598 H LEU 74 H LEU 74 -1.670 3.119 -11.187 599 HA LEU 74 HA LEU 74 0.363 1.482 -12.160 600 1HB LEU 74 2HB LEU 74 -0.626 0.621 -10.276 601 2HB LEU 74 1HB LEU 74 -2.246 1.025 -10.808 602 HG LEU 74 HG LEU 74 -1.215 -0.967 -12.567 603 1HD1 LEU 74 1HD1 LEU 74 -0.659 -1.408 -9.669 604 2HD1 LEU 74 2HD1 LEU 74 0.307 -1.842 -11.079 605 3HD1 LEU 74 3HD1 LEU 74 -1.143 -2.765 -10.685 606 1HD2 LEU 74 1HD2 LEU 74 -3.485 -0.974 -12.388 607 2HD2 LEU 74 2HD2 LEU 74 -3.463 -0.616 -10.661 608 3HD2 LEU 74 3HD2 LEU 74 -3.108 -2.247 -11.228 609 H THR 75 H THR 75 0.666 0.394 -14.002 610 HA THR 75 HA THR 75 -1.628 -0.068 -15.777 611 HB THR 75 HB THR 75 0.644 0.452 -17.412 612 HG1 THR 75 1HG THR 75 1.500 1.788 -15.841 613 1HG2 THR 75 1HG2 THR 75 -1.168 1.036 -18.587 614 2HG2 THR 75 2HG2 THR 75 -1.109 2.572 -17.721 615 3HG2 THR 75 3HG2 THR 75 -2.133 1.264 -17.129 616 H GLN 76 H GLN 76 -0.671 -1.407 -17.789 617 HA GLN 76 HA GLN 76 0.157 -3.896 -16.679 618 1HB GLN 76 2HB GLN 76 -1.093 -3.088 -19.017 619 2HB GLN 76 1HB GLN 76 0.474 -3.662 -19.571 620 1HG GLN 76 2HG GLN 76 -0.011 -5.739 -18.145 621 2HG GLN 76 1HG GLN 76 -1.679 -5.166 -18.139 622 1HE2 GLN 76 1HE2 GLN 76 0.939 -5.472 -20.525 623 2HE2 GLN 76 2HE2 GLN 76 -0.024 -6.242 -21.735 624 H LYS 77 H LYS 77 1.766 -1.327 -18.456 625 HA LYS 77 HA LYS 77 4.168 -2.631 -19.048 626 1HB LYS 77 2HB LYS 77 3.215 -0.233 -19.676 627 2HB LYS 77 1HB LYS 77 4.217 0.260 -18.318 628 1HG LYS 77 2HG LYS 77 5.676 -1.501 -20.063 629 2HG LYS 77 1HG LYS 77 5.014 -0.133 -20.960 630 1HD LYS 77 2HD LYS 77 5.991 1.016 -18.643 631 2HD LYS 77 1HD LYS 77 7.187 -0.221 -19.030 632 1HE LYS 77 2HE LYS 77 7.766 0.766 -21.024 633 2HE LYS 77 1HE LYS 77 6.200 1.556 -21.208 634 1HZ LYS 77 1HZ LYS 77 7.752 3.234 -20.697 635 2HZ LYS 77 2HZ LYS 77 8.432 2.349 -19.426 636 3HZ LYS 77 3HZ LYS 77 6.871 2.984 -19.274 637 H LEU 78 H LEU 78 3.185 -0.802 -16.176 638 HA LEU 78 HA LEU 78 5.699 -1.011 -14.863 639 1HB LEU 78 2HB LEU 78 3.357 0.396 -14.449 640 2HB LEU 78 1HB LEU 78 3.384 -0.732 -13.109 641 HG LEU 78 HG LEU 78 4.394 1.373 -12.456 642 1HD1 LEU 78 1HD1 LEU 78 5.873 -1.145 -12.487 643 2HD1 LEU 78 2HD1 LEU 78 5.531 -0.043 -11.153 644 3HD1 LEU 78 3HD1 LEU 78 6.885 0.277 -12.238 645 1HD2 LEU 78 1HD2 LEU 78 6.457 0.895 -14.598 646 2HD2 LEU 78 2HD2 LEU 78 6.341 2.279 -13.511 647 3HD2 LEU 78 3HD2 LEU 78 5.112 2.026 -14.751 648 H CYS 79 H CYS 79 2.681 -2.858 -14.681 649 HA CYS 79 HA CYS 79 3.381 -4.529 -12.543 650 1HB CYS 79 2HB CYS 79 1.095 -4.412 -13.318 651 2HB CYS 79 1HB CYS 79 1.556 -5.035 -14.899 652 HG CYS 79 HG CYS 79 0.177 -7.045 -13.562 653 H ASP 80 H ASP 80 3.999 -4.798 -16.002 654 HA ASP 80 HA ASP 80 4.997 -7.423 -16.027 655 1HB ASP 80 2HB ASP 80 5.453 -5.038 -17.809 656 2HB ASP 80 1HB ASP 80 6.265 -6.574 -18.104 657 H GLU 81 H GLU 81 6.351 -4.474 -14.891 658 HA GLU 81 HA GLU 81 9.089 -5.419 -14.962 659 1HB GLU 81 2HB GLU 81 7.766 -2.904 -13.978 660 2HB GLU 81 1HB GLU 81 9.457 -3.245 -13.634 661 1HG GLU 81 2HG GLU 81 8.240 -3.055 -16.381 662 2HG GLU 81 1HG GLU 81 9.172 -1.791 -15.581 663 H SER 82 H SER 82 6.869 -4.372 -12.354 664 HA SER 82 HA SER 82 8.435 -5.218 -10.223 665 1HB SER 82 2HB SER 82 6.146 -5.412 -9.029 666 2HB SER 82 1HB SER 82 6.634 -3.837 -9.653 667 HG SER 82 HG SER 82 5.422 -4.674 -11.638 668 H ASP 83 H ASP 83 8.609 -7.084 -9.050 669 HA ASP 83 HA ASP 83 7.754 -9.515 -10.420 670 1HB ASP 83 2HB ASP 83 10.150 -8.964 -9.455 671 2HB ASP 83 1HB ASP 83 9.444 -9.556 -7.955 672 H PHE 84 H PHE 84 6.908 -7.585 -7.739 673 HA PHE 84 HA PHE 84 5.035 -9.662 -6.842 674 1HB PHE 84 2HB PHE 84 6.931 -8.058 -5.145 675 2HB PHE 84 1HB PHE 84 5.432 -8.693 -4.474 676 HD1 PHE 84 1HD PHE 84 5.032 -11.195 -4.609 677 HD2 PHE 84 2HD PHE 84 8.824 -9.406 -5.329 678 HE1 PHE 84 1HE PHE 84 6.126 -13.363 -4.213 679 HE2 PHE 84 2HE PHE 84 9.926 -11.570 -4.935 680 HZ PHE 84 HZ PHE 84 8.576 -13.553 -4.377 681 H LEU 85 H LEU 85 3.018 -8.943 -6.959 682 HA LEU 85 HA LEU 85 2.540 -6.044 -6.921 683 1HB LEU 85 2HB LEU 85 1.517 -8.207 -8.505 684 2HB LEU 85 1HB LEU 85 0.191 -7.433 -7.657 685 HG LEU 85 HG LEU 85 1.120 -5.225 -8.578 686 1HD1 LEU 85 1HD1 LEU 85 2.269 -5.677 -10.840 687 2HD1 LEU 85 2HD1 LEU 85 2.704 -7.233 -10.133 688 3HD1 LEU 85 3HD1 LEU 85 3.240 -5.736 -9.369 689 1HD2 LEU 85 1HD2 LEU 85 -0.313 -7.360 -10.073 690 2HD2 LEU 85 2HD2 LEU 85 0.149 -5.892 -10.934 691 3HD2 LEU 85 3HD2 LEU 85 -0.889 -5.790 -9.511 692 H ILE 86 H ILE 86 1.058 -5.119 -5.541 693 HA ILE 86 HA ILE 86 -0.212 -6.879 -3.550 694 HB ILE 86 HB ILE 86 0.770 -4.211 -2.662 695 1HG1 ILE 86 2HG1 ILE 86 2.692 -5.340 -3.850 696 2HG1 ILE 86 1HG1 ILE 86 2.973 -4.983 -2.150 697 1HG2 ILE 86 1HG2 ILE 86 -0.162 -5.047 -0.821 698 2HG2 ILE 86 2HG2 ILE 86 1.249 -6.097 -0.709 699 3HG2 ILE 86 3HG2 ILE 86 -0.221 -6.676 -1.492 700 1HD1 ILE 86 1HD1 ILE 86 3.503 -7.098 -1.808 701 2HD1 ILE 86 2HD1 ILE 86 3.186 -7.460 -3.505 702 3HD1 ILE 86 3HD1 ILE 86 1.888 -7.593 -2.316 703 H THR 87 H THR 87 -2.328 -6.479 -3.258 704 HA THR 87 HA THR 87 -3.449 -4.055 -4.475 705 HB THR 87 HB THR 87 -5.593 -5.626 -3.677 706 HG1 THR 87 1HG THR 87 -4.825 -7.588 -3.521 707 1HG2 THR 87 1HG2 THR 87 -5.497 -4.449 -5.771 708 2HG2 THR 87 2HG2 THR 87 -5.764 -6.159 -6.109 709 3HG2 THR 87 3HG2 THR 87 -4.162 -5.457 -6.329 710 H MET 88 H MET 88 -4.278 -6.082 -1.657 711 HA MET 88 HA MET 88 -4.688 -5.562 0.520 712 1HB MET 88 2HB MET 88 -3.220 -3.267 -0.355 713 2HB MET 88 1HB MET 88 -4.555 -2.732 0.656 714 1HG MET 88 2HG MET 88 -3.053 -3.079 2.292 715 2HG MET 88 1HG MET 88 -3.659 -4.730 2.177 716 1HE MET 88 1HE MET 88 -1.296 -6.825 0.666 717 2HE MET 88 2HE MET 88 -2.694 -6.523 1.695 718 3HE MET 88 3HE MET 88 -1.078 -6.588 2.400 719 H ASP 89 H ASP 89 -6.031 -3.381 -1.917 720 HA ASP 89 HA ASP 89 -8.395 -2.854 -0.347 721 1HB ASP 89 2HB ASP 89 -7.891 -2.252 -3.267 722 2HB ASP 89 1HB ASP 89 -9.147 -1.553 -2.251 723 H ASN 90 H ASN 90 -10.374 -3.788 -0.553 724 HA ASN 90 HA ASN 90 -10.563 -6.408 -1.505 725 1HB ASN 90 2HB ASN 90 -12.083 -4.897 0.127 726 2HB ASN 90 1HB ASN 90 -13.077 -4.848 -1.325 727 1HD2 ASN 90 1HD2 ASN 90 -12.493 -6.494 1.461 728 2HD2 ASN 90 2HD2 ASN 90 -13.189 -8.019 1.044 729 H SER 91 H SER 91 -12.116 -3.488 -2.853 730 HA SER 91 HA SER 91 -13.131 -4.707 -5.151 731 1HB SER 91 2HB SER 91 -12.255 -1.823 -4.900 732 2HB SER 91 1HB SER 91 -13.448 -2.476 -6.024 733 HG SER 91 HG SER 91 -14.155 -1.437 -3.923 734 H ASN 92 H ASN 92 -9.990 -3.227 -4.539 735 HA ASN 92 HA ASN 92 -9.037 -3.168 -7.171 736 1HB ASN 92 2HB ASN 92 -8.012 -2.619 -4.603 737 2HB ASN 92 1HB ASN 92 -6.907 -3.778 -5.336 738 1HD2 ASN 92 1HD2 ASN 92 -7.067 -0.714 -4.777 739 2HD2 ASN 92 2HD2 ASN 92 -6.420 -0.039 -6.229 740 H PHE 93 H PHE 93 -9.371 -5.795 -4.921 741 HA PHE 93 HA PHE 93 -7.543 -7.594 -6.103 742 1HB PHE 93 2HB PHE 93 -8.307 -8.079 -3.897 743 2HB PHE 93 1HB PHE 93 -9.995 -8.020 -4.393 744 HD1 PHE 93 1HD PHE 93 -6.946 -9.842 -5.560 745 HD2 PHE 93 2HD PHE 93 -11.015 -10.065 -4.330 746 HE1 PHE 93 1HE PHE 93 -6.920 -12.275 -5.928 747 HE2 PHE 93 2HE PHE 93 -10.996 -12.498 -4.695 748 HZ PHE 93 HZ PHE 93 -8.946 -13.605 -5.495 749 H LYS 94 H LYS 94 -11.104 -7.557 -6.310 750 HA LYS 94 HA LYS 94 -11.268 -9.430 -8.401 751 1HB LYS 94 2HB LYS 94 -13.591 -8.275 -8.725 752 2HB LYS 94 1HB LYS 94 -13.263 -9.194 -7.263 753 1HG LYS 94 2HG LYS 94 -12.871 -7.191 -6.012 754 2HG LYS 94 1HG LYS 94 -12.964 -6.206 -7.474 755 1HD LYS 94 2HD LYS 94 -15.343 -7.332 -7.664 756 2HD LYS 94 1HD LYS 94 -15.138 -7.523 -5.921 757 1HE LYS 94 2HE LYS 94 -14.974 -5.201 -5.581 758 2HE LYS 94 1HE LYS 94 -14.709 -4.887 -7.296 759 1HZ LYS 94 1HZ LYS 94 -17.178 -5.217 -5.846 760 2HZ LYS 94 2HZ LYS 94 -17.117 -6.099 -7.289 761 3HZ LYS 94 3HZ LYS 94 -16.881 -4.425 -7.311 762 H ASN 95 H ASN 95 -10.916 -5.938 -8.402 763 HA ASN 95 HA ASN 95 -11.520 -5.515 -11.133 764 1HB ASN 95 2HB ASN 95 -10.320 -3.954 -8.934 765 2HB ASN 95 1HB ASN 95 -9.806 -3.480 -10.549 766 1HD2 ASN 95 1HD2 ASN 95 -12.793 -4.394 -8.863 767 2HD2 ASN 95 2HD2 ASN 95 -13.766 -3.146 -9.556 768 H VAL 96 H VAL 96 -8.396 -5.741 -9.441 769 HA VAL 96 HA VAL 96 -6.739 -5.592 -11.673 770 HB VAL 96 HB VAL 96 -6.395 -6.814 -8.952 771 1HG1 VAL 96 1HG1 VAL 96 -4.329 -6.851 -11.149 772 2HG1 VAL 96 2HG1 VAL 96 -5.114 -8.259 -10.434 773 3HG1 VAL 96 3HG1 VAL 96 -4.038 -7.259 -9.458 774 1HG2 VAL 96 1HG2 VAL 96 -5.726 -4.307 -10.306 775 2HG2 VAL 96 2HG2 VAL 96 -4.418 -4.981 -9.335 776 3HG2 VAL 96 3HG2 VAL 96 -5.981 -4.641 -8.593 777 H LEU 97 H LEU 97 -8.580 -8.256 -10.383 778 HA LEU 97 HA LEU 97 -7.348 -10.461 -11.454 779 1HB LEU 97 2HB LEU 97 -9.960 -9.805 -10.477 780 2HB LEU 97 1HB LEU 97 -10.114 -10.828 -11.892 781 HG LEU 97 HG LEU 97 -8.666 -12.511 -10.835 782 1HD1 LEU 97 1HD1 LEU 97 -7.380 -12.045 -9.091 783 2HD1 LEU 97 2HD1 LEU 97 -8.785 -11.568 -8.137 784 3HD1 LEU 97 3HD1 LEU 97 -7.960 -10.380 -9.146 785 1HD2 LEU 97 1HD2 LEU 97 -11.217 -12.327 -10.503 786 2HD2 LEU 97 2HD2 LEU 97 -10.810 -11.828 -8.860 787 3HD2 LEU 97 3HD2 LEU 97 -10.301 -13.410 -9.455 788 H LYS 98 H LYS 98 -9.672 -8.326 -13.103 789 HA LYS 98 HA LYS 98 -9.021 -9.673 -15.630 790 1HB LYS 98 2HB LYS 98 -11.200 -7.639 -15.361 791 2HB LYS 98 1HB LYS 98 -11.070 -8.986 -16.481 792 1HG LYS 98 2HG LYS 98 -12.128 -10.375 -15.100 793 2HG LYS 98 1HG LYS 98 -11.195 -9.836 -13.702 794 1HD LYS 98 2HD LYS 98 -12.880 -8.562 -12.995 795 2HD LYS 98 1HD LYS 98 -13.005 -7.771 -14.567 796 1HE LYS 98 2HE LYS 98 -15.027 -8.744 -14.639 797 2HE LYS 98 1HE LYS 98 -14.119 -10.179 -15.113 798 1HZ LYS 98 1HZ LYS 98 -14.938 -11.176 -13.330 799 2HZ LYS 98 2HZ LYS 98 -15.671 -9.750 -12.792 800 3HZ LYS 98 3HZ LYS 98 -14.077 -10.101 -12.347 801 H ASN 99 H ASN 99 -8.327 -6.872 -13.881 802 HA ASN 99 HA ASN 99 -7.995 -5.096 -16.114 803 1HB ASN 99 2HB ASN 99 -7.878 -4.906 -13.234 804 2HB ASN 99 1HB ASN 99 -6.490 -4.105 -13.964 805 1HD2 ASN 99 1HD2 ASN 99 -6.891 -2.450 -15.536 806 2HD2 ASN 99 2HD2 ASN 99 -8.356 -1.537 -15.473 807 H PHE 100 H PHE 100 -6.230 -7.703 -15.021 808 HA PHE 100 HA PHE 100 -3.835 -6.705 -16.404 809 1HB PHE 100 2HB PHE 100 -4.027 -7.908 -13.681 810 2HB PHE 100 1HB PHE 100 -2.625 -8.309 -14.666 811 HD1 PHE 100 1HD PHE 100 -2.154 -5.753 -16.067 812 HD2 PHE 100 2HD PHE 100 -3.198 -6.536 -12.017 813 HE1 PHE 100 1HE PHE 100 -1.083 -3.644 -15.385 814 HE2 PHE 100 2HE PHE 100 -2.130 -4.431 -11.329 815 HZ PHE 100 HZ PHE 100 -1.071 -2.981 -13.014 816 H THR 101 H THR 101 -2.270 -8.709 -16.710 817 HA THR 101 HA THR 101 -3.712 -10.543 -18.379 818 HB THR 101 HB THR 101 -1.263 -11.589 -18.449 819 HG1 THR 101 1HG THR 101 0.191 -10.372 -17.513 820 1HG2 THR 101 1HG2 THR 101 -0.761 -9.515 -20.063 821 2HG2 THR 101 2HG2 THR 101 -2.488 -9.257 -19.809 822 3HG2 THR 101 3HG2 THR 101 -1.913 -10.784 -20.477 823 H ASN 102 H ASN 102 -2.417 -12.917 -18.167 824 HA ASN 102 HA ASN 102 -3.763 -14.156 -16.003 825 1HB ASN 102 2HB ASN 102 -1.555 -15.510 -17.512 826 2HB ASN 102 1HB ASN 102 -3.070 -16.182 -16.917 827 1HD2 ASN 102 1HD2 ASN 102 -5.033 -14.907 -17.904 828 2HD2 ASN 102 2HD2 ASN 102 -4.986 -14.761 -19.624 829 H THR 103 H THR 103 -1.107 -12.300 -15.832 830 HA THR 103 HA THR 103 0.413 -13.968 -13.993 831 HB THR 103 HB THR 103 1.643 -12.568 -15.607 832 HG1 THR 103 1HG THR 103 2.742 -13.014 -13.716 833 1HG2 THR 103 1HG2 THR 103 1.405 -10.032 -14.311 834 2HG2 THR 103 2HG2 THR 103 -0.200 -10.583 -14.792 835 3HG2 THR 103 3HG2 THR 103 1.083 -10.447 -15.994 836 H GLN 104 H GLN 104 -2.347 -12.465 -13.644 837 HA GLN 104 HA GLN 104 -2.030 -10.647 -11.523 838 1HB GLN 104 2HB GLN 104 -4.386 -10.804 -11.216 839 2HB GLN 104 1HB GLN 104 -4.088 -10.957 -12.942 840 1HG GLN 104 2HG GLN 104 -4.199 -13.482 -11.433 841 2HG GLN 104 1HG GLN 104 -5.708 -12.579 -11.543 842 1HE2 GLN 104 1HE2 GLN 104 -6.006 -11.656 -13.884 843 2HE2 GLN 104 2HE2 GLN 104 -5.820 -12.827 -15.140 844 H ASN 105 H ASN 105 -1.512 -13.961 -11.593 845 HA ASN 105 HA ASN 105 -2.381 -14.639 -8.961 846 1HB ASN 105 2HB ASN 105 -1.842 -16.179 -11.010 847 2HB ASN 105 1HB ASN 105 -0.197 -16.124 -10.382 848 1HD2 ASN 105 1HD2 ASN 105 0.156 -18.001 -9.438 849 2HD2 ASN 105 2HD2 ASN 105 -0.878 -18.763 -8.282 850 H LYS 106 H LYS 106 -0.031 -12.580 -9.922 851 HA LYS 106 HA LYS 106 1.860 -13.310 -7.807 852 1HB LYS 106 2HB LYS 106 2.025 -11.750 -10.317 853 2HB LYS 106 1HB LYS 106 3.001 -11.162 -8.978 854 1HG LYS 106 2HG LYS 106 4.234 -13.161 -8.861 855 2HG LYS 106 1HG LYS 106 3.081 -14.024 -9.880 856 1HD LYS 106 2HD LYS 106 3.750 -12.130 -11.606 857 2HD LYS 106 1HD LYS 106 5.220 -12.099 -10.630 858 1HE LYS 106 2HE LYS 106 4.085 -14.656 -11.724 859 2HE LYS 106 1HE LYS 106 5.183 -13.647 -12.664 860 1HZ LYS 106 1HZ LYS 106 5.892 -15.572 -10.853 861 2HZ LYS 106 2HZ LYS 106 6.173 -14.119 -10.032 862 3HZ LYS 106 3HZ LYS 106 6.915 -14.403 -11.526 863 H VAL 107 H VAL 107 -0.903 -11.842 -7.707 864 HA VAL 107 HA VAL 107 -0.025 -9.431 -6.281 865 HB VAL 107 HB VAL 107 -2.877 -10.143 -6.938 866 1HG1 VAL 107 1HG1 VAL 107 -2.778 -8.413 -5.342 867 2HG1 VAL 107 2HG1 VAL 107 -3.049 -7.609 -6.888 868 3HG1 VAL 107 3HG1 VAL 107 -1.439 -7.619 -6.169 869 1HG2 VAL 107 1HG2 VAL 107 -2.741 -9.240 -9.037 870 2HG2 VAL 107 2HG2 VAL 107 -1.146 -9.983 -8.918 871 3HG2 VAL 107 3HG2 VAL 107 -1.335 -8.251 -8.643 872 H LEU 108 H LEU 108 -0.604 -9.030 -4.153 873 HA LEU 108 HA LEU 108 -1.499 -11.398 -2.653 874 1HB LEU 108 2HB LEU 108 0.287 -9.092 -1.932 875 2HB LEU 108 1HB LEU 108 -0.446 -10.097 -0.697 876 HG LEU 108 HG LEU 108 0.648 -12.075 -1.953 877 1HD1 LEU 108 1HD1 LEU 108 2.864 -10.423 -2.780 878 2HD1 LEU 108 2HD1 LEU 108 1.398 -10.018 -3.672 879 3HD1 LEU 108 3HD1 LEU 108 1.999 -11.676 -3.671 880 1HD2 LEU 108 1HD2 LEU 108 2.338 -10.064 -0.469 881 2HD2 LEU 108 2HD2 LEU 108 2.723 -11.770 -0.700 882 3HD2 LEU 108 3HD2 LEU 108 1.321 -11.304 0.263 883 H LYS 109 H LYS 109 -2.957 -11.153 -0.917 884 HA LYS 109 HA LYS 109 -4.562 -8.684 -1.005 885 1HB LYS 109 2HB LYS 109 -5.347 -11.411 -1.450 886 2HB LYS 109 1HB LYS 109 -6.158 -10.801 -0.014 887 1HG LYS 109 2HG LYS 109 -6.472 -8.735 -1.777 888 2HG LYS 109 1HG LYS 109 -6.575 -10.151 -2.825 889 1HD LYS 109 2HD LYS 109 -8.152 -9.878 -0.274 890 2HD LYS 109 1HD LYS 109 -8.758 -9.339 -1.841 891 1HE LYS 109 2HE LYS 109 -9.467 -11.406 -2.236 892 2HE LYS 109 1HE LYS 109 -7.791 -11.954 -2.216 893 1HZ LYS 109 1HZ LYS 109 -9.678 -11.858 0.071 894 2HZ LYS 109 2HZ LYS 109 -8.023 -12.165 0.240 895 3HZ LYS 109 3HZ LYS 109 -8.994 -13.233 -0.642 896 H ILE 110 H ILE 110 -5.320 -7.861 0.943 897 HA ILE 110 HA ILE 110 -3.783 -8.639 3.266 898 HB ILE 110 HB ILE 110 -4.273 -6.236 2.563 899 1HG1 ILE 110 2HG1 ILE 110 -5.066 -6.045 5.278 900 2HG1 ILE 110 1HG1 ILE 110 -4.041 -7.469 5.140 901 1HG2 ILE 110 1HG2 ILE 110 -6.853 -6.647 4.043 902 2HG2 ILE 110 2HG2 ILE 110 -6.751 -6.732 2.284 903 3HG2 ILE 110 3HG2 ILE 110 -6.324 -5.239 3.122 904 1HD1 ILE 110 1HD1 ILE 110 -2.679 -5.568 3.694 905 2HD1 ILE 110 2HD1 ILE 110 -2.333 -6.068 5.349 906 3HD1 ILE 110 3HD1 ILE 110 -3.348 -4.658 5.048 907 H THR 111 H THR 111 -6.678 -9.657 1.982 908 HA THR 111 HA THR 111 -8.396 -9.785 4.183 909 HB THR 111 HB THR 111 -8.188 -11.889 2.025 910 HG1 THR 111 1HG THR 111 -9.931 -9.682 1.877 911 1HG2 THR 111 1HG2 THR 111 -9.664 -12.518 3.839 912 2HG2 THR 111 2HG2 THR 111 -10.626 -12.092 2.423 913 3HG2 THR 111 3HG2 THR 111 -10.474 -10.954 3.763 914 H ASP 112 H ASP 112 -5.697 -11.824 3.254 915 HA ASP 112 HA ASP 112 -6.251 -13.815 5.267 916 1HB ASP 112 2HB ASP 112 -5.151 -14.328 3.072 917 2HB ASP 112 1HB ASP 112 -3.733 -13.451 3.634 918 H PHE 113 H PHE 113 -4.689 -10.792 5.189 919 HA PHE 113 HA PHE 113 -3.275 -11.416 7.700 920 1HB PHE 113 2HB PHE 113 -2.543 -9.067 5.986 921 2HB PHE 113 1HB PHE 113 -1.554 -9.951 7.142 922 HD1 PHE 113 1HD PHE 113 -1.837 -9.271 3.823 923 HD2 PHE 113 2HD PHE 113 -1.461 -12.619 6.423 924 HE1 PHE 113 1HE PHE 113 -0.870 -10.587 1.982 925 HE2 PHE 113 2HE PHE 113 -0.494 -13.941 4.587 926 HZ PHE 113 HZ PHE 113 -0.196 -12.925 2.364 927 H SER 114 H SER 114 -6.045 -10.163 6.778 928 HA SER 114 HA SER 114 -6.039 -8.158 8.919 929 1HB SER 114 2HB SER 114 -5.956 -6.771 7.006 930 2HB SER 114 1HB SER 114 -7.074 -7.795 6.109 931 HG SER 114 HG SER 114 -8.079 -5.895 6.904 932 HA PRO 115 HA PRO 115 -9.563 -11.121 9.273 933 1HB PRO 115 2HB PRO 115 -9.066 -12.025 11.757 934 2HB PRO 115 1HB PRO 115 -8.252 -12.680 10.333 935 1HG PRO 115 2HG PRO 115 -7.244 -10.765 12.381 936 2HG PRO 115 1HG PRO 115 -6.382 -12.055 11.527 937 1HD PRO 115 2HD PRO 115 -6.280 -9.353 10.888 938 2HD PRO 115 1HD PRO 115 -5.836 -10.681 9.800 939 H SER 116 H SER 116 -8.686 -9.904 12.484 940 HA SER 116 HA SER 116 -11.343 -9.146 13.074 941 1HB SER 116 2HB SER 116 -9.110 -7.984 14.660 942 2HB SER 116 1HB SER 116 -10.595 -8.764 15.204 943 HG SER 116 HG SER 116 -9.170 -10.303 15.607 944 H LEU 117 H LEU 117 -9.271 -7.629 11.036 945 HA LEU 117 HA LEU 117 -9.804 -4.908 11.861 946 1HB LEU 117 2HB LEU 117 -8.077 -6.239 9.940 947 2HB LEU 117 1HB LEU 117 -8.862 -4.835 9.245 948 HG LEU 117 HG LEU 117 -6.997 -4.934 11.605 949 1HD1 LEU 117 1HD1 LEU 117 -6.244 -4.778 9.141 950 2HD1 LEU 117 2HD1 LEU 117 -5.560 -3.656 10.316 951 3HD1 LEU 117 3HD1 LEU 117 -6.843 -3.121 9.231 952 1HD2 LEU 117 1HD2 LEU 117 -8.532 -3.425 12.437 953 2HD2 LEU 117 2HD2 LEU 117 -8.987 -2.842 10.836 954 3HD2 LEU 117 3HD2 LEU 117 -7.441 -2.368 11.540 955 H ASN 118 H ASN 118 -10.733 -7.010 9.146 956 HA ASN 118 HA ASN 118 -12.377 -6.824 7.572 957 1HB ASN 118 2HB ASN 118 -13.532 -7.235 9.895 958 2HB ASN 118 1HB ASN 118 -14.135 -5.598 9.664 959 1HD2 ASN 118 1HD2 ASN 118 -13.539 -7.589 6.902 960 2HD2 ASN 118 2HD2 ASN 118 -15.191 -7.909 6.516 961 H TYR 119 H TYR 119 -10.699 -4.767 7.236 962 HA TYR 119 HA TYR 119 -12.128 -2.257 7.257 963 1HB TYR 119 2HB TYR 119 -10.093 -1.316 7.105 964 2HB TYR 119 1HB TYR 119 -9.472 -2.932 7.408 965 HD1 TYR 119 1HD TYR 119 -8.940 -4.390 5.341 966 HD2 TYR 119 2HD TYR 119 -9.548 -0.185 5.158 967 HE1 TYR 119 1HE TYR 119 -7.750 -4.316 3.184 968 HE2 TYR 119 2HE TYR 119 -8.369 -0.101 3.011 969 HH TYR 119 HH TYR 119 -6.378 -2.173 1.917 970 H ASP 120 H ASP 120 -12.247 -0.916 5.247 971 HA ASP 120 HA ASP 120 -12.704 -2.565 2.854 972 1HB ASP 120 2HB ASP 120 -14.610 -0.819 4.298 973 2HB ASP 120 1HB ASP 120 -14.629 -0.705 2.541 974 H GLU 121 H GLU 121 -11.104 -1.915 1.574 975 HA GLU 121 HA GLU 121 -9.518 -0.526 0.615 976 1HB GLU 121 2HB GLU 121 -11.771 1.035 -0.509 977 2HB GLU 121 1HB GLU 121 -10.439 0.229 -1.324 978 1HG GLU 121 2HG GLU 121 -11.874 -1.344 -1.920 979 2HG GLU 121 1HG GLU 121 -11.934 -1.837 -0.229 980 H VAL 122 H VAL 122 -8.402 0.737 2.030 981 HA VAL 122 HA VAL 122 -7.655 2.635 3.029 982 HB VAL 122 HB VAL 122 -9.712 4.119 1.397 983 1HG1 VAL 122 1HG1 VAL 122 -8.241 5.981 1.570 984 2HG1 VAL 122 2HG1 VAL 122 -6.982 4.993 2.310 985 3HG1 VAL 122 3HG1 VAL 122 -8.468 5.336 3.196 986 1HG2 VAL 122 1HG2 VAL 122 -6.922 3.359 0.546 987 2HG2 VAL 122 2HG2 VAL 122 -8.121 4.241 -0.399 988 3HG2 VAL 122 3HG2 VAL 122 -8.387 2.544 0.002 989 HA PRO 123 HA PRO 123 -10.545 3.192 6.371 990 1HB PRO 123 2HB PRO 123 -8.639 4.855 7.734 991 2HB PRO 123 1HB PRO 123 -9.025 3.163 8.038 992 1HG PRO 123 2HG PRO 123 -6.618 4.057 7.053 993 2HG PRO 123 1HG PRO 123 -7.250 2.417 6.823 994 1HD PRO 123 2HD PRO 123 -7.274 4.743 4.942 995 2HD PRO 123 1HD PRO 123 -7.001 3.019 4.605 996 H ASP 124 H ASP 124 -9.674 5.831 7.850 997 HA ASP 124 HA ASP 124 -10.325 8.007 7.960 998 1HB ASP 124 2HB ASP 124 -9.754 9.126 6.123 999 2HB ASP 124 1HB ASP 124 -9.740 7.619 5.213 1000 HA PRO 125 HA PRO 125 -14.642 7.858 8.727 1001 1HB PRO 125 2HB PRO 125 -15.384 10.474 8.296 1002 2HB PRO 125 1HB PRO 125 -14.616 9.878 9.771 1003 1HG PRO 125 2HG PRO 125 -13.392 11.268 7.424 1004 2HG PRO 125 1HG PRO 125 -13.063 11.485 9.153 1005 1HD PRO 125 2HD PRO 125 -11.413 10.070 7.582 1006 2HD PRO 125 1HD PRO 125 -11.726 9.593 9.264 1007 H TRP 126 H TRP 126 -13.587 9.193 5.671 1008 HA TRP 126 HA TRP 126 -16.148 9.381 4.466 1009 1HB TRP 126 2HB TRP 126 -14.510 10.624 3.363 1010 2HB TRP 126 1HB TRP 126 -13.331 9.320 3.429 1011 HD1 TRP 126 HD TRP 126 -12.905 8.256 1.152 1012 HE1 TRP 126 1HE TRP 126 -14.247 7.920 -1.019 1013 HE3 TRP 126 3HE TRP 126 -17.338 10.344 2.607 1014 HZ2 TRP 126 2HZ TRP 126 -16.840 8.469 -1.986 1015 HZ3 TRP 126 3HZ TRP 126 -19.201 10.397 0.999 1016 HH2 TRP 126 HH TRP 126 -18.955 9.479 -1.250 1017 H TYR 127 H TYR 127 -13.914 6.768 4.968 1018 HA TYR 127 HA TYR 127 -15.419 5.014 3.179 1019 1HB TYR 127 2HB TYR 127 -12.772 4.798 4.575 1020 2HB TYR 127 1HB TYR 127 -13.573 3.356 3.962 1021 HD1 TYR 127 1HD TYR 127 -14.085 3.212 1.500 1022 HD2 TYR 127 2HD TYR 127 -11.573 6.234 3.127 1023 HE1 TYR 127 1HE TYR 127 -13.154 3.631 -0.735 1024 HE2 TYR 127 2HE TYR 127 -10.635 6.673 0.898 1025 HH TYR 127 HH TYR 127 -11.948 5.931 -1.824 1026 H SER 128 H SER 128 -14.213 4.929 6.544 1027 HA SER 128 HA SER 128 -16.285 2.966 7.185 1028 1HB SER 128 2HB SER 128 -15.032 2.439 9.138 1029 2HB SER 128 1HB SER 128 -13.853 2.626 7.841 1030 HG SER 128 HG SER 128 -13.965 3.923 10.146 1031 H GLY 129 H GLY 129 -14.961 5.949 8.659 1032 1HA GLY 129 2HA GLY 129 -16.941 7.602 8.975 1033 2HA GLY 129 1HA GLY 129 -17.544 6.320 10.012 1034 H ASN 130 H ASN 130 -14.211 6.355 10.191 1035 HA ASN 130 HA ASN 130 -14.201 8.279 12.415 1036 1HB ASN 130 2HB ASN 130 -14.343 5.683 12.977 1037 2HB ASN 130 1HB ASN 130 -12.604 5.779 12.713 1038 1HD2 ASN 130 1HD2 ASN 130 -11.659 7.858 13.819 1039 2HD2 ASN 130 2HD2 ASN 130 -12.116 8.046 15.476 1040 H PHE 131 H PHE 131 -12.258 9.321 12.819 1041 HA PHE 131 HA PHE 131 -10.482 9.509 10.561 1042 1HB PHE 131 2HB PHE 131 -10.344 10.878 13.257 1043 2HB PHE 131 1HB PHE 131 -9.398 11.306 11.836 1044 HD1 PHE 131 1HD PHE 131 -10.250 12.767 10.216 1045 HD2 PHE 131 2HD PHE 131 -12.848 11.146 13.172 1046 HE1 PHE 131 1HE PHE 131 -12.023 14.317 9.503 1047 HE2 PHE 131 2HE PHE 131 -14.625 12.694 12.465 1048 HZ PHE 131 HZ PHE 131 -14.214 14.281 10.628 1049 H ASP 132 H ASP 132 -10.185 8.555 13.962 1050 HA ASP 132 HA ASP 132 -7.464 7.896 13.961 1051 1HB ASP 132 2HB ASP 132 -9.602 6.536 15.610 1052 2HB ASP 132 1HB ASP 132 -7.896 6.715 16.010 1053 H GLU 133 H GLU 133 -10.165 6.309 12.590 1054 HA GLU 133 HA GLU 133 -9.423 3.641 12.623 1055 1HB GLU 133 2HB GLU 133 -11.553 4.026 11.792 1056 2HB GLU 133 1HB GLU 133 -11.024 5.338 10.750 1057 1HG GLU 133 2HG GLU 133 -11.190 3.885 9.085 1058 2HG GLU 133 1HG GLU 133 -9.709 3.161 9.712 1059 H THR 134 H THR 134 -8.254 6.275 10.599 1060 HA THR 134 HA THR 134 -6.913 4.759 8.658 1061 HB THR 134 HB THR 134 -5.351 6.795 8.530 1062 HG1 THR 134 1HG THR 134 -6.075 7.414 10.780 1063 1HG2 THR 134 1HG2 THR 134 -8.159 7.705 8.213 1064 2HG2 THR 134 2HG2 THR 134 -7.668 6.260 7.328 1065 3HG2 THR 134 3HG2 THR 134 -6.810 7.780 7.079 1066 H TYR 135 H TYR 135 -5.953 5.793 11.881 1067 HA TYR 135 HA TYR 135 -3.247 4.972 11.684 1068 1HB TYR 135 2HB TYR 135 -4.192 6.562 13.400 1069 2HB TYR 135 1HB TYR 135 -4.897 5.165 14.206 1070 HD1 TYR 135 1HD TYR 135 -1.564 5.150 12.603 1071 HD2 TYR 135 2HD TYR 135 -3.716 5.388 16.267 1072 HE1 TYR 135 1HE TYR 135 0.530 4.815 13.848 1073 HE2 TYR 135 2HE TYR 135 -1.627 5.054 17.521 1074 HH TYR 135 HH TYR 135 1.105 3.859 16.263 1075 H LYS 136 H LYS 136 -6.164 3.415 12.961 1076 HA LYS 136 HA LYS 136 -4.964 1.090 13.942 1077 1HB LYS 136 2HB LYS 136 -7.725 1.602 12.846 1078 2HB LYS 136 1HB LYS 136 -7.253 0.052 13.530 1079 1HG LYS 136 2HG LYS 136 -6.831 2.534 15.124 1080 2HG LYS 136 1HG LYS 136 -8.451 1.843 14.998 1081 1HD LYS 136 2HD LYS 136 -6.474 -0.192 15.559 1082 2HD LYS 136 1HD LYS 136 -6.441 1.089 16.772 1083 1HE LYS 136 2HE LYS 136 -8.784 -0.610 15.942 1084 2HE LYS 136 1HE LYS 136 -7.989 -0.563 17.515 1085 1HZ LYS 136 1HZ LYS 136 -8.720 1.813 17.646 1086 2HZ LYS 136 2HZ LYS 136 -9.971 0.677 17.705 1087 3HZ LYS 136 3HZ LYS 136 -9.676 1.536 16.278 1088 H ILE 137 H ILE 137 -6.373 1.702 10.731 1089 HA ILE 137 HA ILE 137 -5.758 -0.869 9.698 1090 HB ILE 137 HB ILE 137 -6.131 1.607 8.032 1091 1HG1 ILE 137 2HG1 ILE 137 -7.894 1.441 9.799 1092 2HG1 ILE 137 1HG1 ILE 137 -8.517 1.313 8.158 1093 1HG2 ILE 137 1HG2 ILE 137 -7.465 -0.593 6.940 1094 2HG2 ILE 137 2HG2 ILE 137 -5.911 -1.211 7.503 1095 3HG2 ILE 137 3HG2 ILE 137 -5.965 0.142 6.373 1096 1HD1 ILE 137 1HD1 ILE 137 -8.241 -0.820 10.235 1097 2HD1 ILE 137 2HD1 ILE 137 -8.389 -1.221 8.524 1098 3HD1 ILE 137 3HD1 ILE 137 -9.672 -0.320 9.333 1099 H LEU 138 H LEU 138 -4.247 2.313 9.106 1100 HA LEU 138 HA LEU 138 -2.218 1.511 7.424 1101 1HB LEU 138 2HB LEU 138 -2.891 3.842 8.818 1102 2HB LEU 138 1HB LEU 138 -1.243 3.486 9.293 1103 HG LEU 138 HG LEU 138 -1.211 4.989 7.418 1104 1HD1 LEU 138 1HD1 LEU 138 -0.465 2.203 6.543 1105 2HD1 LEU 138 2HD1 LEU 138 0.541 3.297 7.495 1106 3HD1 LEU 138 3HD1 LEU 138 0.123 3.705 5.830 1107 1HD2 LEU 138 1HD2 LEU 138 -2.125 3.661 5.212 1108 2HD2 LEU 138 2HD2 LEU 138 -3.003 4.920 6.080 1109 3HD2 LEU 138 3HD2 LEU 138 -3.320 3.221 6.433 1110 H SER 139 H SER 139 -2.183 1.572 10.973 1111 HA SER 139 HA SER 139 0.480 0.759 11.302 1112 1HB SER 139 2HB SER 139 -1.003 1.713 13.093 1113 2HB SER 139 1HB SER 139 -1.811 0.148 13.180 1114 HG SER 139 HG SER 139 0.478 0.914 14.330 1115 H LEU 140 H LEU 140 -2.496 -1.212 11.497 1116 HA LEU 140 HA LEU 140 -1.240 -3.683 11.811 1117 1HB LEU 140 2HB LEU 140 -3.906 -2.714 11.164 1118 2HB LEU 140 1HB LEU 140 -3.543 -4.233 10.370 1119 HG LEU 140 HG LEU 140 -4.679 -4.614 12.487 1120 1HD1 LEU 140 1HD1 LEU 140 -1.936 -5.483 13.161 1121 2HD1 LEU 140 2HD1 LEU 140 -2.568 -5.980 11.591 1122 3HD1 LEU 140 3HD1 LEU 140 -3.434 -6.409 13.066 1123 1HD2 LEU 140 1HD2 LEU 140 -3.515 -2.445 13.450 1124 2HD2 LEU 140 2HD2 LEU 140 -2.355 -3.628 14.052 1125 3HD2 LEU 140 3HD2 LEU 140 -4.055 -3.753 14.503 1126 H ALA 141 H ALA 141 -2.589 -2.316 8.807 1127 HA ALA 141 HA ALA 141 -1.761 -4.289 7.059 1128 1HB ALA 141 1HB ALA 141 -3.308 -2.576 6.375 1129 2HB ALA 141 2HB ALA 141 -1.916 -2.562 5.293 1130 3HB ALA 141 3HB ALA 141 -2.068 -1.333 6.549 1131 H CYS 142 H CYS 142 0.007 -1.390 8.108 1132 HA CYS 142 HA CYS 142 2.238 -1.678 6.442 1133 1HB CYS 142 2HB CYS 142 1.765 0.357 7.756 1134 2HB CYS 142 1HB CYS 142 2.145 -0.518 9.235 1135 HG CYS 142 HG CYS 142 4.617 -0.674 7.013 1136 H LYS 143 H LYS 143 1.423 -3.145 9.528 1137 HA LYS 143 HA LYS 143 3.975 -4.277 10.044 1138 1HB LYS 143 2HB LYS 143 1.788 -3.949 11.551 1139 2HB LYS 143 1HB LYS 143 1.535 -5.622 11.077 1140 1HG LYS 143 2HG LYS 143 2.800 -6.125 12.839 1141 2HG LYS 143 1HG LYS 143 4.163 -5.628 11.833 1142 1HD LYS 143 2HD LYS 143 4.009 -3.364 12.733 1143 2HD LYS 143 1HD LYS 143 2.626 -3.839 13.717 1144 1HE LYS 143 2HE LYS 143 4.015 -5.421 14.937 1145 2HE LYS 143 1HE LYS 143 5.398 -5.013 13.921 1146 1HZ LYS 143 1HZ LYS 143 4.606 -3.780 16.277 1147 2HZ LYS 143 2HZ LYS 143 4.313 -2.663 15.042 1148 3HZ LYS 143 3HZ LYS 143 5.860 -3.314 15.241 1149 H ASN 144 H ASN 144 0.942 -5.877 9.038 1150 HA ASN 144 HA ASN 144 1.942 -8.374 8.479 1151 1HB ASN 144 2HB ASN 144 -0.237 -6.892 6.991 1152 2HB ASN 144 1HB ASN 144 0.040 -8.629 6.906 1153 1HD2 ASN 144 1HD2 ASN 144 -1.769 -6.299 8.323 1154 2HD2 ASN 144 2HD2 ASN 144 -2.272 -7.140 9.745 1155 H LEU 145 H LEU 145 1.694 -5.624 6.242 1156 HA LEU 145 HA LEU 145 2.807 -6.892 4.005 1157 1HB LEU 145 2HB LEU 145 1.666 -4.510 4.388 1158 2HB LEU 145 1HB LEU 145 3.342 -4.000 4.449 1159 HG LEU 145 HG LEU 145 2.340 -3.745 2.207 1160 1HD1 LEU 145 1HD1 LEU 145 4.650 -5.600 2.619 1161 2HD1 LEU 145 2HD1 LEU 145 4.653 -3.906 2.134 1162 3HD1 LEU 145 3HD1 LEU 145 4.126 -5.147 0.998 1163 1HD2 LEU 145 1HD2 LEU 145 2.329 -6.738 1.993 1164 2HD2 LEU 145 2HD2 LEU 145 1.618 -5.546 0.904 1165 3HD2 LEU 145 3HD2 LEU 145 0.896 -5.836 2.487 1166 H LEU 146 H LEU 146 4.303 -5.071 6.642 1167 HA LEU 146 HA LEU 146 6.914 -4.978 5.667 1168 1HB LEU 146 2HB LEU 146 6.504 -3.654 7.538 1169 2HB LEU 146 1HB LEU 146 5.723 -4.956 8.412 1170 HG LEU 146 HG LEU 146 8.199 -5.980 8.266 1171 1HD1 LEU 146 1HD1 LEU 146 9.685 -3.951 8.877 1172 2HD1 LEU 146 2HD1 LEU 146 8.487 -3.019 7.981 1173 3HD1 LEU 146 3HD1 LEU 146 9.377 -4.314 7.179 1174 1HD2 LEU 146 1HD2 LEU 146 8.498 -5.290 10.534 1175 2HD2 LEU 146 2HD2 LEU 146 6.776 -5.564 10.274 1176 3HD2 LEU 146 3HD2 LEU 146 7.410 -3.920 10.317 1177 H VAL 147 H VAL 147 5.183 -7.521 7.365 1178 HA VAL 147 HA VAL 147 7.408 -9.182 7.892 1179 HB VAL 147 HB VAL 147 4.577 -10.130 7.472 1180 1HG1 VAL 147 1HG1 VAL 147 5.227 -11.807 9.176 1181 2HG1 VAL 147 2HG1 VAL 147 6.871 -11.170 9.131 1182 3HG1 VAL 147 3HG1 VAL 147 6.175 -11.918 7.693 1183 1HG2 VAL 147 1HG2 VAL 147 5.670 -8.360 9.515 1184 2HG2 VAL 147 2HG2 VAL 147 4.880 -9.792 10.178 1185 3HG2 VAL 147 3HG2 VAL 147 3.992 -8.714 9.100 1186 H PHE 148 H PHE 148 4.877 -9.502 5.387 1187 HA PHE 148 HA PHE 148 6.146 -11.618 4.027 1188 1HB PHE 148 2HB PHE 148 3.738 -10.155 3.791 1189 2HB PHE 148 1HB PHE 148 4.533 -10.085 2.222 1190 HD1 PHE 148 1HD PHE 148 3.055 -12.292 4.747 1191 HD2 PHE 148 2HD PHE 148 4.795 -12.046 0.872 1192 HE1 PHE 148 1HE PHE 148 2.252 -14.565 4.248 1193 HE2 PHE 148 2HE PHE 148 3.994 -14.317 0.364 1194 HZ PHE 148 HZ PHE 148 2.722 -15.579 2.054 1195 H LEU 149 H LEU 149 5.914 -8.180 3.117 1196 HA LEU 149 HA LEU 149 7.459 -8.259 0.832 1197 1HB LEU 149 2HB LEU 149 6.238 -6.298 1.250 1198 2HB LEU 149 1HB LEU 149 6.950 -6.091 2.840 1199 HG LEU 149 HG LEU 149 8.906 -5.983 0.666 1200 1HD1 LEU 149 1HD1 LEU 149 7.330 -3.506 0.817 1201 2HD1 LEU 149 2HD1 LEU 149 6.565 -4.844 -0.040 1202 3HD1 LEU 149 3HD1 LEU 149 8.146 -4.256 -0.556 1203 1HD2 LEU 149 1HD2 LEU 149 8.458 -3.722 2.503 1204 2HD2 LEU 149 2HD2 LEU 149 9.949 -4.560 2.074 1205 3HD2 LEU 149 3HD2 LEU 149 8.853 -5.265 3.261 1206 H SER 150 H SER 150 8.599 -7.506 4.141 1207 HA SER 150 HA SER 150 11.331 -7.341 3.310 1208 1HB SER 150 2HB SER 150 9.901 -6.579 5.572 1209 2HB SER 150 1HB SER 150 10.986 -7.842 6.151 1210 HG SER 150 HG SER 150 11.627 -5.390 5.814 1211 H LYS 151 H LYS 151 9.571 -9.941 3.149 1212 HA LYS 151 HA LYS 151 9.941 -12.183 3.185 1213 1HB LYS 151 2HB LYS 151 12.207 -11.109 2.227 1214 2HB LYS 151 1HB LYS 151 12.852 -11.871 3.673 1215 1HG LYS 151 2HG LYS 151 11.666 -13.987 2.864 1216 2HG LYS 151 1HG LYS 151 11.522 -13.151 1.315 1217 1HD LYS 151 2HD LYS 151 14.159 -13.414 2.729 1218 2HD LYS 151 1HD LYS 151 13.550 -14.680 1.663 1219 1HE LYS 151 2HE LYS 151 14.725 -13.482 0.131 1220 2HE LYS 151 1HE LYS 151 13.201 -12.603 0.043 1221 1HZ LYS 151 1HZ LYS 151 15.130 -11.129 0.234 1222 2HZ LYS 151 2HZ LYS 151 15.516 -11.819 1.729 1223 3HZ LYS 151 3HZ LYS 151 14.074 -10.954 1.546 1224 H HIS 152 H HIS 152 9.004 -12.934 5.009 1225 HA HIS 152 HA HIS 152 10.747 -13.570 7.235 1226 1HB HIS 152 2HB HIS 152 9.142 -11.281 7.382 1227 2HB HIS 152 1HB HIS 152 8.281 -12.501 8.314 1228 HD1 HIS 152 1HD HIS 152 12.013 -11.778 8.090 1229 HD2 HIS 152 2HD HIS 152 8.945 -11.999 10.883 1230 HE1 HIS 152 1HE HIS 152 13.110 -11.413 10.324 1231 HE2 HIS 152 2HE HIS 152 11.245 -11.621 12.005 1232 H HIS 153 H HIS 153 9.244 -14.695 9.012 1233 HA HIS 153 HA HIS 153 7.009 -16.147 7.950 1234 1HB HIS 153 2HB HIS 153 9.476 -17.217 7.342 1235 2HB HIS 153 1HB HIS 153 9.025 -18.088 8.804 1236 HD1 HIS 153 1HD HIS 153 5.898 -18.074 8.071 1237 HD2 HIS 153 2HD HIS 153 9.025 -19.395 5.675 1238 HE1 HIS 153 1HE HIS 153 4.865 -19.698 6.454 1239 HE2 HIS 153 2HE HIS 153 6.792 -20.554 5.074 1240 H HIS 154 H HIS 154 5.672 -16.643 9.564 1241 HA HIS 154 HA HIS 154 6.533 -16.192 12.292 1242 1HB HIS 154 2HB HIS 154 4.072 -16.025 10.865 1243 2HB HIS 154 1HB HIS 154 3.857 -17.179 12.178 1244 HD1 HIS 154 1HD HIS 154 6.289 -14.768 13.241 1245 HD2 HIS 154 2HD HIS 154 2.142 -14.870 13.013 1246 HE1 HIS 154 1HE HIS 154 5.487 -12.951 14.783 1247 HE2 HIS 154 2HE HIS 154 2.977 -12.969 14.555 1248 H HIS 155 H HIS 155 5.127 -17.866 13.830 1249 HA HIS 155 HA HIS 155 6.445 -20.425 13.339 1250 1HB HIS 155 2HB HIS 155 4.980 -20.311 15.828 1251 2HB HIS 155 1HB HIS 155 6.705 -20.534 15.560 1252 HD1 HIS 155 1HD HIS 155 4.157 -17.764 15.955 1253 HD2 HIS 155 2HD HIS 155 8.258 -18.379 16.217 1254 HE1 HIS 155 1HE HIS 155 5.097 -15.631 16.898 1255 HE2 HIS 155 2HE HIS 155 7.578 -16.038 17.082 1256 H HIS 156 H HIS 156 4.900 -22.189 14.706 1257 HA HIS 156 HA HIS 156 2.631 -22.488 12.904 1258 1HB HIS 156 2HB HIS 156 4.458 -24.270 14.172 1259 2HB HIS 156 1HB HIS 156 2.838 -24.671 14.731 1260 HD1 HIS 156 1HD HIS 156 2.200 -26.667 13.403 1261 HD2 HIS 156 2HD HIS 156 3.927 -23.714 11.043 1262 HE1 HIS 156 1HE HIS 156 2.009 -27.499 11.038 1263 HE2 HIS 156 2HE HIS 156 2.963 -25.646 9.621 Start of MODEL 5 1 1H MET 1 1HT MET 1 14.794 -11.217 -7.832 2 2H MET 1 2HT MET 1 16.449 -10.875 -7.775 3 3H MET 1 3HT MET 1 15.546 -10.453 -9.141 4 HA MET 1 HA MET 1 16.063 -8.922 -6.871 5 1HB MET 1 2HB MET 1 14.936 -7.200 -8.183 6 2HB MET 1 1HB MET 1 15.980 -8.168 -9.214 7 1HG MET 1 2HG MET 1 13.545 -9.457 -9.357 8 2HG MET 1 1HG MET 1 13.118 -7.747 -9.332 9 1HE MET 1 1HE MET 1 13.057 -10.282 -11.698 10 2HE MET 1 2HE MET 1 14.717 -10.671 -11.248 11 3HE MET 1 3HE MET 1 14.356 -10.097 -12.876 12 H LYS 2 H LYS 2 14.220 -7.344 -6.117 13 HA LYS 2 HA LYS 2 11.829 -8.890 -5.397 14 1HB LYS 2 2HB LYS 2 13.922 -7.990 -3.620 15 2HB LYS 2 1HB LYS 2 12.387 -7.249 -3.191 16 1HG LYS 2 2HG LYS 2 12.363 -9.172 -1.932 17 2HG LYS 2 1HG LYS 2 11.462 -9.667 -3.366 18 1HD LYS 2 2HD LYS 2 13.342 -10.819 -4.253 19 2HD LYS 2 1HD LYS 2 14.425 -10.109 -3.054 20 1HE LYS 2 2HE LYS 2 13.149 -11.302 -1.285 21 2HE LYS 2 1HE LYS 2 12.214 -12.097 -2.552 22 1HZ LYS 2 1HZ LYS 2 15.114 -12.368 -2.001 23 2HZ LYS 2 2HZ LYS 2 14.396 -12.927 -3.426 24 3HZ LYS 2 3HZ LYS 2 13.927 -13.573 -1.934 25 H LYS 3 H LYS 3 10.267 -7.811 -6.427 26 HA LYS 3 HA LYS 3 10.091 -4.907 -5.976 27 1HB LYS 3 2HB LYS 3 9.936 -6.440 -8.511 28 2HB LYS 3 1HB LYS 3 8.788 -5.125 -8.312 29 1HG LYS 3 2HG LYS 3 11.039 -3.867 -7.577 30 2HG LYS 3 1HG LYS 3 11.707 -5.051 -8.702 31 1HD LYS 3 2HD LYS 3 10.739 -4.082 -10.500 32 2HD LYS 3 1HD LYS 3 9.275 -3.658 -9.612 33 1HE LYS 3 2HE LYS 3 10.093 -1.642 -8.954 34 2HE LYS 3 1HE LYS 3 11.758 -2.221 -8.879 35 1HZ LYS 3 1HZ LYS 3 11.172 -2.356 -11.519 36 2HZ LYS 3 2HZ LYS 3 12.020 -1.098 -10.771 37 3HZ LYS 3 3HZ LYS 3 10.357 -0.952 -11.042 38 H ILE 4 H ILE 4 8.298 -4.328 -4.963 39 HA ILE 4 HA ILE 4 5.932 -6.077 -5.194 40 HB ILE 4 HB ILE 4 5.824 -4.543 -2.783 41 1HG1 ILE 4 2HG1 ILE 4 8.370 -4.691 -3.107 42 2HG1 ILE 4 1HG1 ILE 4 7.720 -5.242 -1.567 43 1HG2 ILE 4 1HG2 ILE 4 5.717 -7.398 -3.605 44 2HG2 ILE 4 2HG2 ILE 4 4.505 -6.407 -2.792 45 3HG2 ILE 4 3HG2 ILE 4 5.893 -7.018 -1.892 46 1HD1 ILE 4 1HD1 ILE 4 8.412 -7.345 -1.896 47 2HD1 ILE 4 2HD1 ILE 4 9.495 -6.615 -3.080 48 3HD1 ILE 4 3HD1 ILE 4 7.973 -7.333 -3.604 49 H LEU 5 H LEU 5 4.440 -5.072 -6.362 50 HA LEU 5 HA LEU 5 4.289 -2.170 -6.379 51 1HB LEU 5 2HB LEU 5 3.872 -4.118 -8.300 52 2HB LEU 5 1HB LEU 5 2.252 -3.575 -7.908 53 HG LEU 5 HG LEU 5 4.511 -1.767 -8.775 54 1HD1 LEU 5 1HD1 LEU 5 2.929 -1.552 -10.808 55 2HD1 LEU 5 2HD1 LEU 5 2.295 -3.108 -10.271 56 3HD1 LEU 5 3HD1 LEU 5 3.999 -2.949 -10.698 57 1HD2 LEU 5 1HD2 LEU 5 2.478 -0.226 -9.154 58 2HD2 LEU 5 2HD2 LEU 5 3.089 -0.431 -7.513 59 3HD2 LEU 5 3HD2 LEU 5 1.647 -1.303 -8.032 60 H PHE 6 H PHE 6 3.009 -1.113 -5.007 61 HA PHE 6 HA PHE 6 0.741 -2.523 -3.791 62 1HB PHE 6 2HB PHE 6 1.852 0.178 -3.009 63 2HB PHE 6 1HB PHE 6 0.742 -0.824 -2.087 64 HD1 PHE 6 1HD PHE 6 2.472 -3.427 -2.782 65 HD2 PHE 6 2HD PHE 6 3.307 0.394 -1.095 66 HE1 PHE 6 1HE PHE 6 4.371 -4.383 -1.557 67 HE2 PHE 6 2HE PHE 6 5.208 -0.562 0.134 68 HZ PHE 6 HZ PHE 6 5.744 -2.954 -0.098 69 H ILE 7 H ILE 7 -1.244 -2.173 -4.598 70 HA ILE 7 HA ILE 7 -1.688 0.294 -6.145 71 HB ILE 7 HB ILE 7 -3.635 -1.931 -6.349 72 1HG1 ILE 7 2HG1 ILE 7 -1.261 -2.192 -8.106 73 2HG1 ILE 7 1HG1 ILE 7 -1.051 -2.707 -6.435 74 1HG2 ILE 7 1HG2 ILE 7 -2.330 -0.251 -8.479 75 2HG2 ILE 7 2HG2 ILE 7 -3.771 0.240 -7.588 76 3HG2 ILE 7 3HG2 ILE 7 -3.812 -1.199 -8.607 77 1HD1 ILE 7 1HD1 ILE 7 -1.741 -4.661 -7.350 78 2HD1 ILE 7 2HD1 ILE 7 -2.716 -3.869 -8.589 79 3HD1 ILE 7 3HD1 ILE 7 -3.313 -3.980 -6.932 80 H CYS 8 H CYS 8 -3.012 1.783 -5.340 81 HA CYS 8 HA CYS 8 -5.103 0.943 -3.455 82 1HB CYS 8 2HB CYS 8 -3.509 3.488 -3.170 83 2HB CYS 8 1HB CYS 8 -4.682 2.826 -2.035 84 HG CYS 8 HG CYS 8 -2.119 2.545 -0.952 85 H LEU 9 H LEU 9 -7.072 1.698 -3.874 86 HA LEU 9 HA LEU 9 -7.603 3.092 -6.275 87 1HB LEU 9 2HB LEU 9 -9.125 1.852 -4.131 88 2HB LEU 9 1HB LEU 9 -9.895 3.309 -4.728 89 HG LEU 9 HG LEU 9 -8.983 1.170 -6.625 90 1HD1 LEU 9 1HD1 LEU 9 -11.742 1.290 -5.441 91 2HD1 LEU 9 2HD1 LEU 9 -10.479 0.235 -4.807 92 3HD1 LEU 9 3HD1 LEU 9 -11.040 0.038 -6.467 93 1HD2 LEU 9 1HD2 LEU 9 -10.559 2.141 -8.109 94 2HD2 LEU 9 2HD2 LEU 9 -9.642 3.473 -7.402 95 3HD2 LEU 9 3HD2 LEU 9 -11.270 3.117 -6.823 96 H GLY 10 H GLY 10 -6.387 4.290 -3.468 97 1HA GLY 10 2HA GLY 10 -7.203 6.996 -4.189 98 2HA GLY 10 1HA GLY 10 -7.611 6.465 -2.565 99 H ASN 11 H ASN 11 -4.992 7.212 -4.769 100 HA ASN 11 HA ASN 11 -2.925 6.824 -2.826 101 1HB ASN 11 2HB ASN 11 -3.094 7.521 -5.643 102 2HB ASN 11 1HB ASN 11 -1.891 8.492 -4.800 103 1HD2 ASN 11 1HD2 ASN 11 -0.045 7.546 -4.058 104 2HD2 ASN 11 2HD2 ASN 11 0.396 5.913 -4.409 105 H ILE 12 H ILE 12 -5.009 8.529 -1.888 106 HA ILE 12 HA ILE 12 -3.447 10.966 -1.411 107 HB ILE 12 HB ILE 12 -5.479 12.313 -1.424 108 1HG1 ILE 12 2HG1 ILE 12 -7.106 10.257 -2.775 109 2HG1 ILE 12 1HG1 ILE 12 -6.820 9.968 -1.061 110 1HG2 ILE 12 1HG2 ILE 12 -5.699 10.977 -4.040 111 2HG2 ILE 12 2HG2 ILE 12 -4.082 11.505 -3.569 112 3HG2 ILE 12 3HG2 ILE 12 -5.404 12.671 -3.648 113 1HD1 ILE 12 1HD1 ILE 12 -8.656 11.750 -2.301 114 2HD1 ILE 12 2HD1 ILE 12 -7.516 12.679 -1.326 115 3HD1 ILE 12 3HD1 ILE 12 -8.450 11.376 -0.591 116 H CYS 13 H CYS 13 -4.476 8.296 0.001 117 HA CYS 13 HA CYS 13 -4.901 9.659 2.555 118 1HB CYS 13 2HB CYS 13 -7.101 8.943 1.662 119 2HB CYS 13 1HB CYS 13 -6.534 7.279 1.672 120 HG CYS 13 HG CYS 13 -8.295 7.856 3.852 121 H ARG 14 H ARG 14 -5.102 6.190 1.879 122 HA ARG 14 HA ARG 14 -3.107 5.692 3.884 123 1HB ARG 14 2HB ARG 14 -4.126 3.715 4.073 124 2HB ARG 14 1HB ARG 14 -5.293 4.297 2.896 125 1HG ARG 14 2HG ARG 14 -4.709 2.358 1.888 126 2HG ARG 14 1HG ARG 14 -3.459 3.396 1.201 127 1HD ARG 14 2HD ARG 14 -2.463 2.494 3.668 128 2HD ARG 14 1HD ARG 14 -3.187 1.088 2.889 129 HE ARG 14 HE ARG 14 -1.496 2.611 1.141 130 1HH1 ARG 14 1HH1 ARG 14 -1.566 0.121 3.578 131 2HH1 ARG 14 2HH1 ARG 14 -0.097 -0.623 3.043 132 1HH2 ARG 14 1HH2 ARG 14 0.438 1.637 0.428 133 2HH2 ARG 14 2HH2 ARG 14 1.043 0.239 1.252 134 H SER 15 H SER 15 -3.293 5.382 0.365 135 HA SER 15 HA SER 15 -0.920 4.003 -0.083 136 1HB SER 15 2HB SER 15 -1.420 6.053 -2.094 137 2HB SER 15 1HB SER 15 -1.434 4.296 -2.245 138 HG SER 15 HG SER 15 -3.498 5.139 -2.622 139 HA PRO 16 HA PRO 16 1.340 8.320 -0.420 140 1HB PRO 16 2HB PRO 16 0.240 10.314 1.091 141 2HB PRO 16 1HB PRO 16 -0.102 10.091 -0.628 142 1HG PRO 16 2HG PRO 16 -1.703 9.209 1.749 143 2HG PRO 16 1HG PRO 16 -2.258 9.981 0.249 144 1HD PRO 16 2HD PRO 16 -2.496 7.341 0.628 145 2HD PRO 16 1HD PRO 16 -2.101 8.013 -0.968 146 H MET 17 H MET 17 -0.448 7.729 2.591 147 HA MET 17 HA MET 17 1.522 8.541 4.389 148 1HB MET 17 2HB MET 17 -0.674 6.493 4.627 149 2HB MET 17 1HB MET 17 0.364 6.929 5.976 150 1HG MET 17 2HG MET 17 -1.988 8.200 5.081 151 2HG MET 17 1HG MET 17 -0.952 8.635 6.438 152 1HE MET 17 1HE MET 17 -2.730 10.122 3.701 153 2HE MET 17 2HE MET 17 -1.947 11.701 3.749 154 3HE MET 17 3HE MET 17 -2.539 10.965 5.239 155 H ALA 18 H ALA 18 0.761 5.203 3.374 156 HA ALA 18 HA ALA 18 3.025 4.063 4.603 157 1HB ALA 18 1HB ALA 18 2.548 2.094 3.168 158 2HB ALA 18 2HB ALA 18 1.311 3.045 2.344 159 3HB ALA 18 3HB ALA 18 1.144 2.680 4.061 160 H GLU 19 H GLU 19 2.618 5.779 1.639 161 HA GLU 19 HA GLU 19 4.764 4.735 0.156 162 1HB GLU 19 2HB GLU 19 3.029 6.282 -0.744 163 2HB GLU 19 1HB GLU 19 3.761 7.590 0.174 164 1HG GLU 19 2HG GLU 19 5.758 7.482 -1.117 165 2HG GLU 19 1HG GLU 19 5.232 5.996 -1.907 166 H PHE 20 H PHE 20 4.612 7.537 2.339 167 HA PHE 20 HA PHE 20 7.431 8.011 2.241 168 1HB PHE 20 2HB PHE 20 5.359 9.564 2.912 169 2HB PHE 20 1HB PHE 20 5.822 9.031 4.526 170 HD1 PHE 20 1HD PHE 20 8.139 9.485 5.341 171 HD2 PHE 20 2HD PHE 20 6.608 11.181 1.751 172 HE1 PHE 20 1HE PHE 20 9.915 11.187 5.394 173 HE2 PHE 20 2HE PHE 20 8.383 12.886 1.795 174 HZ PHE 20 HZ PHE 20 10.039 12.890 3.618 175 H ILE 21 H ILE 21 5.258 6.539 4.650 176 HA ILE 21 HA ILE 21 7.130 6.058 6.650 177 HB ILE 21 HB ILE 21 4.784 4.293 5.944 178 1HG1 ILE 21 2HG1 ILE 21 4.851 6.547 7.952 179 2HG1 ILE 21 1HG1 ILE 21 4.302 6.767 6.293 180 1HG2 ILE 21 1HG2 ILE 21 5.047 3.219 7.918 181 2HG2 ILE 21 2HG2 ILE 21 5.692 4.644 8.735 182 3HG2 ILE 21 3HG2 ILE 21 6.731 3.685 7.679 183 1HD1 ILE 21 1HD1 ILE 21 2.850 4.598 7.127 184 2HD1 ILE 21 2HD1 ILE 21 2.285 6.267 7.075 185 3HD1 ILE 21 3HD1 ILE 21 2.933 5.602 8.574 186 H MET 22 H MET 22 6.040 3.800 4.118 187 HA MET 22 HA MET 22 7.804 1.729 4.716 188 1HB MET 22 2HB MET 22 6.467 2.542 2.143 189 2HB MET 22 1HB MET 22 7.491 1.117 2.251 190 1HG MET 22 2HG MET 22 5.435 1.281 4.325 191 2HG MET 22 1HG MET 22 4.807 1.159 2.682 192 1HE MET 22 1HE MET 22 6.561 -1.245 5.594 193 2HE MET 22 2HE MET 22 7.571 0.023 4.898 194 3HE MET 22 3HE MET 22 7.874 -1.667 4.493 195 H LYS 23 H LYS 23 8.170 4.458 2.473 196 HA LYS 23 HA LYS 23 10.589 3.822 1.320 197 1HB LYS 23 2HB LYS 23 9.235 5.759 0.665 198 2HB LYS 23 1HB LYS 23 9.630 6.557 2.180 199 1HG LYS 23 2HG LYS 23 11.134 7.561 0.799 200 2HG LYS 23 1HG LYS 23 12.099 6.190 1.347 201 1HD LYS 23 2HD LYS 23 12.232 5.355 -0.718 202 2HD LYS 23 1HD LYS 23 10.492 5.511 -0.964 203 1HE LYS 23 2HE LYS 23 12.081 8.005 -1.032 204 2HE LYS 23 1HE LYS 23 12.304 6.887 -2.377 205 1HZ LYS 23 1HZ LYS 23 9.603 7.695 -1.499 206 2HZ LYS 23 2HZ LYS 23 10.086 7.070 -2.994 207 3HZ LYS 23 3HZ LYS 23 10.494 8.656 -2.570 208 H ASP 24 H ASP 24 9.979 5.258 4.485 209 HA ASP 24 HA ASP 24 12.713 5.793 5.079 210 1HB ASP 24 2HB ASP 24 10.151 6.084 6.399 211 2HB ASP 24 1HB ASP 24 11.379 5.494 7.517 212 H LEU 25 H LEU 25 10.498 3.237 6.207 213 HA LEU 25 HA LEU 25 12.350 1.828 7.748 214 1HB LEU 25 2HB LEU 25 9.721 1.621 7.375 215 2HB LEU 25 1HB LEU 25 10.230 0.314 6.323 216 HG LEU 25 HG LEU 25 11.601 0.072 8.825 217 1HD1 LEU 25 1HD1 LEU 25 9.183 -0.547 9.890 218 2HD1 LEU 25 2HD1 LEU 25 8.799 0.924 8.996 219 3HD1 LEU 25 3HD1 LEU 25 10.072 0.941 10.217 220 1HD2 LEU 25 1HD2 LEU 25 10.366 -1.527 6.885 221 2HD2 LEU 25 2HD2 LEU 25 9.526 -1.868 8.398 222 3HD2 LEU 25 3HD2 LEU 25 11.277 -2.059 8.298 223 H VAL 26 H VAL 26 11.367 1.245 4.371 224 HA VAL 26 HA VAL 26 12.845 -1.026 3.872 225 HB VAL 26 HB VAL 26 12.824 -0.406 1.496 226 1HG1 VAL 26 1HG1 VAL 26 10.851 -1.436 2.310 227 2HG1 VAL 26 2HG1 VAL 26 10.337 -0.088 1.294 228 3HG1 VAL 26 3HG1 VAL 26 10.292 0.064 3.051 229 1HG2 VAL 26 1HG2 VAL 26 13.299 1.926 1.559 230 2HG2 VAL 26 2HG2 VAL 26 11.869 2.252 2.540 231 3HG2 VAL 26 3HG2 VAL 26 11.689 1.740 0.862 232 H LYS 27 H LYS 27 13.938 2.342 3.723 233 HA LYS 27 HA LYS 27 16.376 2.031 2.490 234 1HB LYS 27 2HB LYS 27 15.440 3.874 4.667 235 2HB LYS 27 1HB LYS 27 17.104 3.937 4.100 236 1HG LYS 27 2HG LYS 27 15.935 4.088 1.743 237 2HG LYS 27 1HG LYS 27 14.591 4.699 2.710 238 1HD LYS 27 2HD LYS 27 15.992 6.444 3.625 239 2HD LYS 27 1HD LYS 27 17.403 5.792 2.791 240 1HE LYS 27 2HE LYS 27 16.022 6.146 0.644 241 2HE LYS 27 1HE LYS 27 15.010 7.186 1.643 242 1HZ LYS 27 1HZ LYS 27 16.487 8.720 0.930 243 2HZ LYS 27 2HZ LYS 27 17.734 7.601 0.697 244 3HZ LYS 27 3HZ LYS 27 17.381 8.161 2.254 245 H LYS 28 H LYS 28 15.461 1.119 5.736 246 HA LYS 28 HA LYS 28 18.060 0.811 6.794 247 1HB LYS 28 2HB LYS 28 16.066 1.041 8.192 248 2HB LYS 28 1HB LYS 28 15.486 -0.522 7.630 249 1HG LYS 28 2HG LYS 28 18.170 -0.678 8.715 250 2HG LYS 28 1HG LYS 28 17.006 -0.046 9.881 251 1HD LYS 28 2HD LYS 28 16.011 -2.337 8.371 252 2HD LYS 28 1HD LYS 28 17.447 -2.700 9.329 253 1HE LYS 28 2HE LYS 28 15.744 -1.133 10.946 254 2HE LYS 28 1HE LYS 28 14.741 -2.369 10.189 255 1HZ LYS 28 1HZ LYS 28 17.194 -2.820 11.799 256 2HZ LYS 28 2HZ LYS 28 16.359 -4.038 10.974 257 3HZ LYS 28 3HZ LYS 28 15.607 -3.205 12.241 258 H ALA 29 H ALA 29 15.785 -1.707 5.593 259 HA ALA 29 HA ALA 29 18.153 -3.400 5.123 260 1HB ALA 29 1HB ALA 29 15.876 -5.007 5.803 261 2HB ALA 29 2HB ALA 29 16.209 -3.833 7.077 262 3HB ALA 29 3HB ALA 29 17.473 -4.945 6.549 263 H ASN 30 H ASN 30 16.478 -1.814 3.220 264 HA ASN 30 HA ASN 30 15.733 -4.072 1.484 265 1HB ASN 30 2HB ASN 30 14.074 -1.844 2.363 266 2HB ASN 30 1HB ASN 30 14.157 -1.960 0.609 267 1HD2 ASN 30 1HD2 ASN 30 14.323 -4.581 2.957 268 2HD2 ASN 30 2HD2 ASN 30 12.877 -5.374 2.444 269 H LEU 31 H LEU 31 16.321 -0.554 1.394 270 HA LEU 31 HA LEU 31 17.146 -0.488 -1.299 271 1HB LEU 31 2HB LEU 31 16.829 1.358 0.812 272 2HB LEU 31 1HB LEU 31 18.484 1.527 0.259 273 HG LEU 31 HG LEU 31 17.388 1.654 -2.115 274 1HD1 LEU 31 1HD1 LEU 31 15.111 2.650 -0.417 275 2HD1 LEU 31 2HD1 LEU 31 15.126 1.079 -1.218 276 3HD1 LEU 31 3HD1 LEU 31 15.187 2.558 -2.177 277 1HD2 LEU 31 1HD2 LEU 31 18.112 3.746 -1.951 278 2HD2 LEU 31 2HD2 LEU 31 18.231 3.535 -0.204 279 3HD2 LEU 31 3HD2 LEU 31 16.750 4.175 -0.915 280 H GLU 32 H GLU 32 18.732 -1.438 1.595 281 HA GLU 32 HA GLU 32 21.421 -1.152 0.667 282 1HB GLU 32 2HB GLU 32 20.515 -3.048 2.822 283 2HB GLU 32 1HB GLU 32 22.060 -2.220 2.674 284 1HG GLU 32 2HG GLU 32 19.466 -0.776 3.144 285 2HG GLU 32 1HG GLU 32 20.503 -1.353 4.449 286 H LYS 33 H LYS 33 18.967 -3.625 0.527 287 HA LYS 33 HA LYS 33 20.854 -5.501 -0.713 288 1HB LYS 33 2HB LYS 33 18.284 -5.792 0.753 289 2HB LYS 33 1HB LYS 33 18.607 -6.949 -0.530 290 1HG LYS 33 2HG LYS 33 20.068 -8.065 0.717 291 2HG LYS 33 1HG LYS 33 20.896 -6.586 1.211 292 1HD LYS 33 2HD LYS 33 18.236 -7.282 2.389 293 2HD LYS 33 1HD LYS 33 19.700 -8.058 2.996 294 1HE LYS 33 2HE LYS 33 19.564 -5.082 2.720 295 2HE LYS 33 1HE LYS 33 18.848 -5.879 4.120 296 1HZ LYS 33 1HZ LYS 33 21.688 -6.016 3.266 297 2HZ LYS 33 2HZ LYS 33 21.029 -6.919 4.535 298 3HZ LYS 33 3HZ LYS 33 21.078 -5.232 4.636 299 H GLU 34 H GLU 34 19.403 -3.031 -1.824 300 HA GLU 34 HA GLU 34 18.571 -2.345 -3.817 301 1HB GLU 34 2HB GLU 34 19.861 -4.924 -4.435 302 2HB GLU 34 1HB GLU 34 18.700 -4.356 -5.627 303 1HG GLU 34 2HG GLU 34 19.933 -2.431 -6.083 304 2HG GLU 34 1HG GLU 34 20.869 -2.569 -4.596 305 H PHE 35 H PHE 35 16.583 -2.698 -2.269 306 HA PHE 35 HA PHE 35 14.661 -4.495 -3.594 307 1HB PHE 35 2HB PHE 35 14.894 -3.443 -0.801 308 2HB PHE 35 1HB PHE 35 13.300 -3.850 -1.427 309 HD1 PHE 35 1HD PHE 35 12.630 -5.800 -0.408 310 HD2 PHE 35 2HD PHE 35 16.615 -5.504 -1.873 311 HE1 PHE 35 1HE PHE 35 13.010 -8.163 0.157 312 HE2 PHE 35 2HE PHE 35 17.001 -7.869 -1.312 313 HZ PHE 35 HZ PHE 35 15.197 -9.202 -0.296 314 H PHE 36 H PHE 36 12.696 -3.681 -4.357 315 HA PHE 36 HA PHE 36 12.368 -0.763 -4.217 316 1HB PHE 36 2HB PHE 36 13.192 -2.141 -6.495 317 2HB PHE 36 1HB PHE 36 11.479 -1.833 -6.762 318 HD1 PHE 36 1HD PHE 36 10.849 0.175 -7.690 319 HD2 PHE 36 2HD PHE 36 14.570 -0.077 -5.642 320 HE1 PHE 36 1HE PHE 36 11.367 2.486 -8.357 321 HE2 PHE 36 2HE PHE 36 15.096 2.233 -6.304 322 HZ PHE 36 HZ PHE 36 13.494 3.519 -7.663 323 H ILE 37 H ILE 37 10.342 0.000 -4.052 324 HA ILE 37 HA ILE 37 8.099 -1.871 -4.314 325 HB ILE 37 HB ILE 37 7.054 -1.089 -2.284 326 1HG1 ILE 37 2HG1 ILE 37 8.065 1.220 -2.359 327 2HG1 ILE 37 1HG1 ILE 37 8.031 0.478 -0.765 328 1HG2 ILE 37 1HG2 ILE 37 8.218 -2.952 -1.704 329 2HG2 ILE 37 2HG2 ILE 37 9.003 -1.787 -0.638 330 3HG2 ILE 37 3HG2 ILE 37 9.776 -2.257 -2.152 331 1HD1 ILE 37 1HD1 ILE 37 10.122 1.614 -1.093 332 2HD1 ILE 37 2HD1 ILE 37 10.415 0.719 -2.585 333 3HD1 ILE 37 3HD1 ILE 37 10.406 -0.126 -1.036 334 H ASN 38 H ASN 38 6.436 -1.043 -5.425 335 HA ASN 38 HA ASN 38 6.531 1.826 -6.055 336 1HB ASN 38 2HB ASN 38 4.804 -0.004 -7.634 337 2HB ASN 38 1HB ASN 38 5.779 1.364 -8.164 338 1HD2 ASN 38 1HD2 ASN 38 5.678 -2.026 -7.602 339 2HD2 ASN 38 2HD2 ASN 38 7.238 -2.401 -8.243 340 H SER 39 H SER 39 4.284 2.717 -6.664 341 HA SER 39 HA SER 39 2.023 1.653 -5.275 342 1HB SER 39 2HB SER 39 3.762 3.170 -3.708 343 2HB SER 39 1HB SER 39 2.471 4.292 -4.139 344 HG SER 39 HG SER 39 1.341 3.322 -2.670 345 H ALA 40 H ALA 40 0.318 2.201 -6.456 346 HA ALA 40 HA ALA 40 -0.077 4.877 -7.424 347 1HB ALA 40 1HB ALA 40 1.443 4.019 -9.140 348 2HB ALA 40 2HB ALA 40 -0.163 4.329 -9.798 349 3HB ALA 40 3HB ALA 40 0.342 2.676 -9.445 350 H GLY 41 H GLY 41 -2.156 5.073 -8.635 351 1HA GLY 41 2HA GLY 41 -4.184 3.551 -7.283 352 2HA GLY 41 1HA GLY 41 -4.448 4.834 -8.453 353 H THR 42 H THR 42 -6.149 2.840 -8.673 354 HA THR 42 HA THR 42 -5.261 0.671 -10.298 355 HB THR 42 HB THR 42 -8.119 1.541 -10.315 356 HG1 THR 42 1HG THR 42 -6.654 0.620 -8.072 357 1HG2 THR 42 1HG2 THR 42 -8.561 -0.655 -10.708 358 2HG2 THR 42 2HG2 THR 42 -7.232 -1.216 -9.693 359 3HG2 THR 42 3HG2 THR 42 -6.907 -0.623 -11.322 360 H SER 43 H SER 43 -7.011 3.689 -10.978 361 HA SER 43 HA SER 43 -6.332 3.328 -13.823 362 1HB SER 43 2HB SER 43 -8.787 3.092 -13.281 363 2HB SER 43 1HB SER 43 -8.770 4.785 -12.791 364 HG SER 43 HG SER 43 -7.656 4.798 -15.118 365 H GLY 44 H GLY 44 -5.625 5.058 -11.145 366 1HA GLY 44 2HA GLY 44 -4.585 7.068 -10.769 367 2HA GLY 44 1HA GLY 44 -4.136 7.016 -12.465 368 H GLU 45 H GLU 45 -7.483 7.031 -11.498 369 HA GLU 45 HA GLU 45 -8.140 9.227 -13.105 370 1HB GLU 45 2HB GLU 45 -9.749 8.423 -10.693 371 2HB GLU 45 1HB GLU 45 -10.322 9.064 -12.225 372 1HG GLU 45 2HG GLU 45 -9.949 7.025 -13.336 373 2HG GLU 45 1HG GLU 45 -8.985 6.389 -12.004 374 H HIS 46 H HIS 46 -7.868 9.033 -9.559 375 HA HIS 46 HA HIS 46 -7.130 11.873 -9.535 376 1HB HIS 46 2HB HIS 46 -8.619 11.208 -7.153 377 2HB HIS 46 1HB HIS 46 -8.893 12.506 -8.309 378 HD1 HIS 46 1HD HIS 46 -10.432 11.871 -10.404 379 HD2 HIS 46 2HD HIS 46 -10.432 9.159 -7.254 380 HE1 HIS 46 1HE HIS 46 -12.464 10.429 -10.757 381 HE2 HIS 46 2HE HIS 46 -12.459 8.813 -8.824 382 H ASP 47 H ASP 47 -6.798 8.682 -8.331 383 HA ASP 47 HA ASP 47 -5.590 8.856 -5.907 384 1HB ASP 47 2HB ASP 47 -4.150 7.138 -7.853 385 2HB ASP 47 1HB ASP 47 -4.818 6.736 -6.271 386 H GLY 48 H GLY 48 -4.325 10.573 -5.407 387 1HA GLY 48 2HA GLY 48 -1.791 10.856 -5.336 388 2HA GLY 48 1HA GLY 48 -1.941 11.051 -7.076 389 H GLU 49 H GLU 49 -4.652 12.337 -5.711 390 HA GLU 49 HA GLU 49 -4.115 14.967 -6.438 391 1HB GLU 49 2HB GLU 49 -6.213 13.569 -4.912 392 2HB GLU 49 1HB GLU 49 -6.051 15.282 -4.554 393 1HG GLU 49 2HG GLU 49 -5.980 15.187 -7.309 394 2HG GLU 49 1HG GLU 49 -7.174 13.964 -6.876 395 H GLY 50 H GLY 50 -4.813 14.155 -3.047 396 1HA GLY 50 2HA GLY 50 -2.345 15.446 -2.191 397 2HA GLY 50 1HA GLY 50 -3.835 16.264 -1.749 398 H MET 51 H MET 51 -4.584 15.810 0.206 399 HA MET 51 HA MET 51 -3.860 13.218 1.406 400 1HB MET 51 2HB MET 51 -3.642 14.241 3.518 401 2HB MET 51 1HB MET 51 -2.829 15.326 2.400 402 1HG MET 51 2HG MET 51 -5.654 15.709 3.353 403 2HG MET 51 1HG MET 51 -4.246 16.447 4.112 404 1HE MET 51 1HE MET 51 -6.319 19.215 2.016 405 2HE MET 51 2HE MET 51 -5.900 18.702 3.650 406 3HE MET 51 3HE MET 51 -6.999 17.727 2.675 407 H HIS 52 H HIS 52 -5.390 12.801 3.401 408 HA HIS 52 HA HIS 52 -8.168 13.426 2.688 409 1HB HIS 52 2HB HIS 52 -7.015 10.961 2.164 410 2HB HIS 52 1HB HIS 52 -7.852 10.706 3.691 411 HD1 HIS 52 1HD HIS 52 -8.555 9.765 0.595 412 HD2 HIS 52 2HD HIS 52 -10.554 12.473 3.032 413 HE1 HIS 52 1HE HIS 52 -10.905 9.859 -0.292 414 HE2 HIS 52 2HE HIS 52 -12.123 11.423 1.263 415 H TYR 53 H TYR 53 -9.663 13.280 4.429 416 HA TYR 53 HA TYR 53 -8.836 14.304 6.849 417 1HB TYR 53 2HB TYR 53 -11.271 12.546 6.601 418 2HB TYR 53 1HB TYR 53 -11.032 13.936 7.653 419 HD1 TYR 53 1HD TYR 53 -10.091 16.018 5.876 420 HD2 TYR 53 2HD TYR 53 -13.028 13.019 5.181 421 HE1 TYR 53 1HE TYR 53 -11.168 17.467 4.206 422 HE2 TYR 53 2HE TYR 53 -14.111 14.459 3.506 423 HH TYR 53 HH TYR 53 -13.642 16.320 2.099 424 H GLY 54 H GLY 54 -8.685 13.400 8.971 425 1HA GLY 54 2HA GLY 54 -8.187 11.784 10.533 426 2HA GLY 54 1HA GLY 54 -8.686 10.572 9.369 427 H THR 55 H THR 55 -6.895 10.864 7.322 428 HA THR 55 HA THR 55 -4.646 9.517 8.312 429 HB THR 55 HB THR 55 -3.943 10.734 5.839 430 HG1 THR 55 1HG THR 55 -6.553 9.606 5.763 431 1HG2 THR 55 1HG2 THR 55 -4.331 8.114 6.993 432 2HG2 THR 55 2HG2 THR 55 -3.246 8.619 5.697 433 3HG2 THR 55 3HG2 THR 55 -4.910 8.166 5.328 434 H LYS 56 H LYS 56 -4.928 12.847 7.069 435 HA LYS 56 HA LYS 56 -2.290 13.623 7.667 436 1HB LYS 56 2HB LYS 56 -3.706 15.958 7.947 437 2HB LYS 56 1HB LYS 56 -3.112 15.316 6.423 438 1HG LYS 56 2HG LYS 56 -5.328 15.809 5.974 439 2HG LYS 56 1HG LYS 56 -5.360 14.077 6.309 440 1HD LYS 56 2HD LYS 56 -7.063 14.650 7.676 441 2HD LYS 56 1HD LYS 56 -5.753 15.046 8.792 442 1HE LYS 56 2HE LYS 56 -5.875 17.366 7.514 443 2HE LYS 56 1HE LYS 56 -7.531 16.837 7.225 444 1HZ LYS 56 1HZ LYS 56 -7.894 16.649 9.566 445 2HZ LYS 56 2HZ LYS 56 -7.257 18.186 9.257 446 3HZ LYS 56 3HZ LYS 56 -6.270 16.978 9.907 447 H ASN 57 H ASN 57 -5.215 13.492 9.548 448 HA ASN 57 HA ASN 57 -4.422 14.981 11.787 449 1HB ASN 57 2HB ASN 57 -6.747 14.305 11.357 450 2HB ASN 57 1HB ASN 57 -6.312 12.616 11.604 451 1HD2 ASN 57 1HD2 ASN 57 -6.335 11.810 13.615 452 2HD2 ASN 57 2HD2 ASN 57 -6.620 12.735 15.047 453 H LYS 58 H LYS 58 -4.275 11.502 11.155 454 HA LYS 58 HA LYS 58 -3.079 10.740 13.574 455 1HB LYS 58 2HB LYS 58 -4.189 9.362 11.614 456 2HB LYS 58 1HB LYS 58 -2.530 9.243 11.048 457 1HG LYS 58 2HG LYS 58 -3.260 7.317 12.410 458 2HG LYS 58 1HG LYS 58 -1.851 8.154 13.068 459 1HD LYS 58 2HD LYS 58 -4.120 9.395 14.185 460 2HD LYS 58 1HD LYS 58 -4.395 7.654 14.290 461 1HE LYS 58 2HE LYS 58 -3.242 8.029 16.238 462 2HE LYS 58 1HE LYS 58 -1.925 7.617 15.138 463 1HZ LYS 58 1HZ LYS 58 -1.163 9.514 16.175 464 2HZ LYS 58 2HZ LYS 58 -2.683 10.255 16.207 465 3HZ LYS 58 3HZ LYS 58 -1.828 10.145 14.752 466 H LEU 59 H LEU 59 -1.643 11.330 10.382 467 HA LEU 59 HA LEU 59 1.008 10.845 11.141 468 1HB LEU 59 2HB LEU 59 0.001 12.648 8.944 469 2HB LEU 59 1HB LEU 59 1.630 12.021 9.088 470 HG LEU 59 HG LEU 59 -0.803 10.731 8.042 471 1HD1 LEU 59 1HD1 LEU 59 0.908 9.516 6.724 472 2HD1 LEU 59 2HD1 LEU 59 2.157 10.391 7.613 473 3HD1 LEU 59 3HD1 LEU 59 1.022 11.271 6.589 474 1HD2 LEU 59 1HD2 LEU 59 -0.810 9.118 9.636 475 2HD2 LEU 59 2HD2 LEU 59 0.868 9.407 10.095 476 3HD2 LEU 59 3HD2 LEU 59 0.499 8.471 8.648 477 H ALA 60 H ALA 60 -0.731 13.943 10.825 478 HA ALA 60 HA ALA 60 1.321 15.652 11.538 479 1HB ALA 60 1HB ALA 60 -0.423 17.221 12.275 480 2HB ALA 60 2HB ALA 60 -1.610 15.919 12.209 481 3HB ALA 60 3HB ALA 60 -0.821 16.469 10.731 482 H GLN 61 H GLN 61 -0.713 13.627 13.546 483 HA GLN 61 HA GLN 61 -0.119 14.731 16.045 484 1HB GLN 61 2HB GLN 61 -1.780 12.820 15.274 485 2HB GLN 61 1HB GLN 61 -0.454 11.783 15.781 486 1HG GLN 61 2HG GLN 61 -1.096 13.852 17.725 487 2HG GLN 61 1HG GLN 61 -2.442 12.764 17.390 488 1HE2 GLN 61 1HE2 GLN 61 -1.922 10.426 17.478 489 2HE2 GLN 61 2HE2 GLN 61 -0.827 9.890 18.703 490 H LEU 62 H LEU 62 1.555 12.165 14.229 491 HA LEU 62 HA LEU 62 3.947 12.710 15.822 492 1HB LEU 62 2HB LEU 62 3.783 9.881 15.369 493 2HB LEU 62 1HB LEU 62 4.011 10.753 16.872 494 HG LEU 62 HG LEU 62 1.335 11.070 16.502 495 1HD1 LEU 62 1HD1 LEU 62 1.970 8.287 15.540 496 2HD1 LEU 62 2HD1 LEU 62 1.422 9.604 14.503 497 3HD1 LEU 62 3HD1 LEU 62 0.373 8.994 15.782 498 1HD2 LEU 62 1HD2 LEU 62 1.634 10.324 18.580 499 2HD2 LEU 62 2HD2 LEU 62 3.100 9.449 18.136 500 3HD2 LEU 62 3HD2 LEU 62 1.521 8.696 17.909 501 H ASN 63 H ASN 63 2.596 10.862 13.101 502 HA ASN 63 HA ASN 63 5.091 10.434 11.815 503 1HB ASN 63 2HB ASN 63 2.402 10.495 10.440 504 2HB ASN 63 1HB ASN 63 3.837 9.586 9.972 505 1HD2 ASN 63 1HD2 ASN 63 1.345 9.878 12.441 506 2HD2 ASN 63 2HD2 ASN 63 1.396 8.227 12.945 507 H ILE 64 H ILE 64 4.584 11.175 9.165 508 HA ILE 64 HA ILE 64 5.133 14.049 9.315 509 HB ILE 64 HB ILE 64 5.381 12.631 6.726 510 1HG1 ILE 64 2HG1 ILE 64 6.230 10.963 8.377 511 2HG1 ILE 64 1HG1 ILE 64 7.476 11.554 7.282 512 1HG2 ILE 64 1HG2 ILE 64 7.719 13.988 7.312 513 2HG2 ILE 64 2HG2 ILE 64 6.457 14.956 8.076 514 3HG2 ILE 64 3HG2 ILE 64 6.366 14.589 6.353 515 1HD1 ILE 64 1HD1 ILE 64 8.383 11.403 9.487 516 2HD1 ILE 64 2HD1 ILE 64 7.055 12.353 10.151 517 3HD1 ILE 64 3HD1 ILE 64 8.222 13.108 9.065 518 H GLU 65 H GLU 65 3.758 15.540 8.518 519 HA GLU 65 HA GLU 65 1.107 14.995 7.997 520 1HB GLU 65 2HB GLU 65 2.867 17.325 7.714 521 2HB GLU 65 1HB GLU 65 1.463 17.350 6.656 522 1HG GLU 65 2HG GLU 65 -0.037 17.255 8.473 523 2HG GLU 65 1HG GLU 65 1.249 16.838 9.605 524 H HIS 66 H HIS 66 0.977 13.283 6.542 525 HA HIS 66 HA HIS 66 0.928 12.180 4.558 526 1HB HIS 66 2HB HIS 66 -0.251 13.592 2.740 527 2HB HIS 66 1HB HIS 66 -1.111 13.234 4.229 528 HD1 HIS 66 1HD HIS 66 0.238 16.026 2.205 529 HD2 HIS 66 2HD HIS 66 -1.483 15.476 5.945 530 HE1 HIS 66 1HE HIS 66 -0.408 18.326 2.992 531 HE2 HIS 66 2HE HIS 66 -1.399 17.974 5.281 532 H LYS 67 H LYS 67 1.207 14.894 2.487 533 HA LYS 67 HA LYS 67 2.809 15.625 1.052 534 1HB LYS 67 2HB LYS 67 4.720 14.130 2.857 535 2HB LYS 67 1HB LYS 67 5.201 15.194 1.544 536 1HG LYS 67 2HG LYS 67 4.982 16.998 2.815 537 2HG LYS 67 1HG LYS 67 3.374 16.508 3.357 538 1HD LYS 67 2HD LYS 67 4.252 16.106 5.361 539 2HD LYS 67 1HD LYS 67 5.146 14.769 4.639 540 1HE LYS 67 2HE LYS 67 6.052 17.529 5.302 541 2HE LYS 67 1HE LYS 67 6.861 15.986 5.568 542 1HZ LYS 67 1HZ LYS 67 6.991 15.932 3.011 543 2HZ LYS 67 2HZ LYS 67 8.071 16.921 3.858 544 3HZ LYS 67 3HZ LYS 67 6.715 17.598 3.107 545 H ASN 68 H ASN 68 4.790 14.560 -0.304 546 HA ASN 68 HA ASN 68 5.299 13.102 -1.970 547 1HB ASN 68 2HB ASN 68 4.803 11.495 0.373 548 2HB ASN 68 1HB ASN 68 4.306 10.621 -1.074 549 1HD2 ASN 68 1HD2 ASN 68 5.830 9.355 -1.809 550 2HD2 ASN 68 2HD2 ASN 68 7.529 9.674 -1.791 551 H PHE 69 H PHE 69 2.785 14.458 -2.070 552 HA PHE 69 HA PHE 69 0.848 12.561 -3.082 553 1HB PHE 69 2HB PHE 69 -0.242 14.931 -3.736 554 2HB PHE 69 1HB PHE 69 -0.382 14.218 -2.135 555 HD1 PHE 69 1HD PHE 69 0.076 15.557 -0.336 556 HD2 PHE 69 2HD PHE 69 1.957 16.407 -4.057 557 HE1 PHE 69 1HE PHE 69 1.105 17.564 0.647 558 HE2 PHE 69 2HE PHE 69 2.993 18.414 -3.080 559 HZ PHE 69 HZ PHE 69 2.565 18.995 -0.726 560 H THR 70 H THR 70 0.850 11.831 -5.091 561 HA THR 70 HA THR 70 1.402 13.591 -7.317 562 HB THR 70 HB THR 70 2.975 11.276 -7.860 563 HG1 THR 70 1HG THR 70 3.823 10.928 -5.950 564 1HG2 THR 70 1HG2 THR 70 3.017 13.987 -8.367 565 2HG2 THR 70 2HG2 THR 70 4.263 12.831 -8.837 566 3HG2 THR 70 3HG2 THR 70 4.431 13.749 -7.340 567 H SER 71 H SER 71 -0.014 13.132 -8.863 568 HA SER 71 HA SER 71 -1.798 10.971 -8.735 569 1HB SER 71 2HB SER 71 -1.201 12.408 -11.309 570 2HB SER 71 1HB SER 71 -2.746 11.807 -10.709 571 HG SER 71 HG SER 71 -1.827 13.568 -8.955 572 H LYS 72 H LYS 72 -1.278 8.904 -8.979 573 HA LYS 72 HA LYS 72 0.523 8.175 -11.192 574 1HB LYS 72 2HB LYS 72 0.814 7.639 -8.395 575 2HB LYS 72 1HB LYS 72 0.566 6.117 -9.241 576 1HG LYS 72 2HG LYS 72 2.583 8.121 -10.189 577 2HG LYS 72 1HG LYS 72 2.963 6.946 -8.929 578 1HD LYS 72 2HD LYS 72 3.129 5.266 -10.403 579 2HD LYS 72 1HD LYS 72 1.664 5.758 -11.254 580 1HE LYS 72 2HE LYS 72 2.797 6.983 -12.780 581 2HE LYS 72 1HE LYS 72 4.017 7.498 -11.615 582 1HZ LYS 72 1HZ LYS 72 5.286 5.655 -11.989 583 2HZ LYS 72 2HZ LYS 72 4.606 5.841 -13.526 584 3HZ LYS 72 3HZ LYS 72 3.978 4.690 -12.459 585 H LYS 73 H LYS 73 -0.001 6.360 -12.395 586 HA LYS 73 HA LYS 73 -2.571 5.069 -11.773 587 1HB LYS 73 2HB LYS 73 -2.249 5.210 -14.606 588 2HB LYS 73 1HB LYS 73 -3.537 5.876 -13.613 589 1HG LYS 73 2HG LYS 73 -2.865 7.879 -14.280 590 2HG LYS 73 1HG LYS 73 -1.435 7.651 -13.273 591 1HD LYS 73 2HD LYS 73 -0.499 8.147 -15.328 592 2HD LYS 73 1HD LYS 73 -0.508 6.382 -15.348 593 1HE LYS 73 2HE LYS 73 -2.311 6.286 -16.820 594 2HE LYS 73 1HE LYS 73 -2.814 7.937 -16.460 595 1HZ LYS 73 1HZ LYS 73 -0.176 7.573 -17.661 596 2HZ LYS 73 2HZ LYS 73 -1.310 8.805 -17.895 597 3HZ LYS 73 3HZ LYS 73 -1.517 7.310 -18.657 598 H LEU 74 H LEU 74 -1.823 3.092 -11.196 599 HA LEU 74 HA LEU 74 0.366 1.738 -12.265 600 1HB LEU 74 2HB LEU 74 -0.462 0.910 -10.241 601 2HB LEU 74 1HB LEU 74 -2.110 0.842 -10.833 602 HG LEU 74 HG LEU 74 -0.285 -0.929 -12.284 603 1HD1 LEU 74 1HD1 LEU 74 -0.369 -2.594 -10.341 604 2HD1 LEU 74 2HD1 LEU 74 -0.631 -1.181 -9.317 605 3HD1 LEU 74 3HD1 LEU 74 0.842 -1.314 -10.278 606 1HD2 LEU 74 1HD2 LEU 74 -2.102 -2.476 -12.043 607 2HD2 LEU 74 2HD2 LEU 74 -2.767 -0.895 -12.460 608 3HD2 LEU 74 3HD2 LEU 74 -2.849 -1.476 -10.796 609 H THR 75 H THR 75 0.679 0.479 -14.026 610 HA THR 75 HA THR 75 -1.655 -0.083 -15.732 611 HB THR 75 HB THR 75 0.832 0.257 -17.219 612 HG1 THR 75 1HG THR 75 1.158 2.372 -16.831 613 1HG2 THR 75 1HG2 THR 75 -1.804 0.221 -17.803 614 2HG2 THR 75 2HG2 THR 75 -0.583 0.960 -18.839 615 3HG2 THR 75 3HG2 THR 75 -1.521 1.961 -17.731 616 H GLN 76 H GLN 76 -0.689 -1.585 -17.658 617 HA GLN 76 HA GLN 76 -0.131 -4.060 -16.383 618 1HB GLN 76 2HB GLN 76 0.112 -4.881 -18.776 619 2HB GLN 76 1HB GLN 76 -1.435 -4.165 -18.350 620 1HG GLN 76 2HG GLN 76 -1.048 -2.259 -19.599 621 2HG GLN 76 1HG GLN 76 0.700 -2.494 -19.600 622 1HE2 GLN 76 1HE2 GLN 76 1.166 -4.873 -20.539 623 2HE2 GLN 76 2HE2 GLN 76 0.482 -5.117 -22.107 624 H LYS 77 H LYS 77 1.807 -1.873 -18.399 625 HA LYS 77 HA LYS 77 4.112 -3.441 -18.565 626 1HB LYS 77 2HB LYS 77 3.328 -0.877 -19.377 627 2HB LYS 77 1HB LYS 77 4.751 -0.627 -18.376 628 1HG LYS 77 2HG LYS 77 5.344 -2.796 -20.056 629 2HG LYS 77 1HG LYS 77 4.574 -1.573 -21.067 630 1HD LYS 77 2HD LYS 77 6.381 -0.240 -19.343 631 2HD LYS 77 1HD LYS 77 7.230 -1.625 -20.035 632 1HE LYS 77 2HE LYS 77 5.882 -0.596 -22.194 633 2HE LYS 77 1HE LYS 77 6.336 0.851 -21.295 634 1HZ LYS 77 1HZ LYS 77 8.628 0.111 -21.314 635 2HZ LYS 77 2HZ LYS 77 8.037 0.211 -22.895 636 3HZ LYS 77 3HZ LYS 77 8.201 -1.297 -22.147 637 H LEU 78 H LEU 78 3.063 -1.150 -16.094 638 HA LEU 78 HA LEU 78 5.481 -1.204 -14.600 639 1HB LEU 78 2HB LEU 78 3.009 0.157 -14.490 640 2HB LEU 78 1HB LEU 78 3.205 -0.646 -12.944 641 HG LEU 78 HG LEU 78 5.456 0.983 -14.054 642 1HD1 LEU 78 1HD1 LEU 78 2.975 2.097 -13.803 643 2HD1 LEU 78 2HD1 LEU 78 4.502 2.969 -13.666 644 3HD1 LEU 78 3HD1 LEU 78 3.679 2.397 -12.214 645 1HD2 LEU 78 1HD2 LEU 78 6.325 0.282 -12.129 646 2HD2 LEU 78 2HD2 LEU 78 4.774 -0.349 -11.577 647 3HD2 LEU 78 3HD2 LEU 78 5.176 1.348 -11.321 648 H CYS 79 H CYS 79 2.406 -2.947 -14.322 649 HA CYS 79 HA CYS 79 3.030 -4.340 -11.952 650 1HB CYS 79 2HB CYS 79 0.783 -4.470 -12.367 651 2HB CYS 79 1HB CYS 79 1.002 -4.593 -14.109 652 HG CYS 79 HG CYS 79 -0.211 -6.936 -13.362 653 H ASP 80 H ASP 80 3.733 -4.958 -15.320 654 HA ASP 80 HA ASP 80 4.464 -7.662 -15.122 655 1HB ASP 80 2HB ASP 80 4.700 -5.525 -17.085 656 2HB ASP 80 1HB ASP 80 6.099 -6.594 -17.102 657 H GLU 81 H GLU 81 6.014 -4.818 -14.018 658 HA GLU 81 HA GLU 81 8.680 -5.913 -13.987 659 1HB GLU 81 2HB GLU 81 7.424 -3.346 -13.443 660 2HB GLU 81 1HB GLU 81 8.646 -3.748 -12.245 661 1HG GLU 81 2HG GLU 81 9.007 -3.546 -15.223 662 2HG GLU 81 1HG GLU 81 9.671 -2.479 -13.985 663 H SER 82 H SER 82 6.416 -4.900 -11.404 664 HA SER 82 HA SER 82 7.892 -6.039 -9.305 665 1HB SER 82 2HB SER 82 4.918 -5.831 -9.110 666 2HB SER 82 1HB SER 82 6.154 -5.387 -7.932 667 HG SER 82 HG SER 82 5.582 -3.463 -8.675 668 H ASP 83 H ASP 83 7.898 -8.003 -8.353 669 HA ASP 83 HA ASP 83 6.723 -10.193 -9.845 670 1HB ASP 83 2HB ASP 83 9.073 -9.896 -8.417 671 2HB ASP 83 1HB ASP 83 8.085 -10.889 -7.352 672 H PHE 84 H PHE 84 5.955 -8.294 -7.127 673 HA PHE 84 HA PHE 84 3.772 -10.142 -6.455 674 1HB PHE 84 2HB PHE 84 5.949 -9.294 -4.714 675 2HB PHE 84 1HB PHE 84 4.371 -8.898 -4.043 676 HD1 PHE 84 1HD PHE 84 2.630 -10.796 -3.985 677 HD2 PHE 84 2HD PHE 84 6.811 -11.426 -4.460 678 HE1 PHE 84 1HE PHE 84 2.362 -13.119 -3.223 679 HE2 PHE 84 2HE PHE 84 6.551 -13.751 -3.700 680 HZ PHE 84 HZ PHE 84 4.323 -14.602 -3.080 681 H LEU 85 H LEU 85 1.835 -9.182 -6.382 682 HA LEU 85 HA LEU 85 1.760 -6.240 -6.222 683 1HB LEU 85 2HB LEU 85 0.166 -8.159 -7.889 684 2HB LEU 85 1HB LEU 85 -0.444 -6.555 -7.525 685 HG LEU 85 HG LEU 85 1.997 -5.903 -8.459 686 1HD1 LEU 85 1HD1 LEU 85 1.210 -8.440 -9.879 687 2HD1 LEU 85 2HD1 LEU 85 2.689 -8.142 -8.965 688 3HD1 LEU 85 3HD1 LEU 85 2.401 -7.287 -10.481 689 1HD2 LEU 85 1HD2 LEU 85 -0.694 -5.845 -9.386 690 2HD2 LEU 85 2HD2 LEU 85 0.366 -6.203 -10.749 691 3HD2 LEU 85 3HD2 LEU 85 0.635 -4.754 -9.780 692 H ILE 86 H ILE 86 0.018 -5.270 -5.124 693 HA ILE 86 HA ILE 86 -1.650 -7.046 -3.484 694 HB ILE 86 HB ILE 86 -0.197 -4.638 -2.381 695 1HG1 ILE 86 2HG1 ILE 86 0.783 -6.658 -0.934 696 2HG1 ILE 86 1HG1 ILE 86 0.457 -7.545 -2.420 697 1HG2 ILE 86 1HG2 ILE 86 -1.222 -5.034 -0.353 698 2HG2 ILE 86 2HG2 ILE 86 -1.588 -6.714 -0.747 699 3HG2 ILE 86 3HG2 ILE 86 -2.516 -5.412 -1.490 700 1HD1 ILE 86 1HD1 ILE 86 1.767 -5.162 -3.153 701 2HD1 ILE 86 2HD1 ILE 86 2.375 -6.816 -3.232 702 3HD1 ILE 86 3HD1 ILE 86 2.646 -5.846 -1.785 703 H THR 87 H THR 87 -3.648 -6.577 -4.162 704 HA THR 87 HA THR 87 -4.434 -4.106 -5.279 705 HB THR 87 HB THR 87 -6.806 -5.226 -4.501 706 HG1 THR 87 1HG THR 87 -5.498 -7.531 -5.256 707 1HG2 THR 87 1HG2 THR 87 -5.301 -4.918 -6.865 708 2HG2 THR 87 2HG2 THR 87 -7.029 -5.237 -6.716 709 3HG2 THR 87 3HG2 THR 87 -5.894 -6.579 -6.855 710 H MET 88 H MET 88 -5.036 -5.538 -2.069 711 HA MET 88 HA MET 88 -5.393 -4.569 -0.045 712 1HB MET 88 2HB MET 88 -3.886 -2.705 -1.119 713 2HB MET 88 1HB MET 88 -5.395 -1.809 -1.203 714 1HG MET 88 2HG MET 88 -5.665 -2.214 1.252 715 2HG MET 88 1HG MET 88 -4.030 -2.871 1.252 716 1HE MET 88 1HE MET 88 -5.775 -0.180 -0.650 717 2HE MET 88 2HE MET 88 -4.815 1.281 -0.420 718 3HE MET 88 3HE MET 88 -6.007 0.809 0.792 719 H ASP 89 H ASP 89 -7.055 -2.771 -2.638 720 HA ASP 89 HA ASP 89 -9.430 -2.463 -1.029 721 1HB ASP 89 2HB ASP 89 -9.093 -1.893 -3.979 722 2HB ASP 89 1HB ASP 89 -10.339 -1.260 -2.907 723 H ASN 90 H ASN 90 -11.306 -3.609 -1.188 724 HA ASN 90 HA ASN 90 -11.217 -6.263 -2.039 725 1HB ASN 90 2HB ASN 90 -13.344 -4.415 -1.108 726 2HB ASN 90 1HB ASN 90 -13.872 -5.866 -1.953 727 1HD2 ASN 90 1HD2 ASN 90 -14.705 -6.999 -0.297 728 2HD2 ASN 90 2HD2 ASN 90 -13.800 -7.531 1.075 729 H SER 91 H SER 91 -13.318 -3.752 -3.466 730 HA SER 91 HA SER 91 -14.039 -5.181 -5.731 731 1HB SER 91 2HB SER 91 -13.928 -2.441 -6.461 732 2HB SER 91 1HB SER 91 -15.334 -3.375 -5.954 733 HG SER 91 HG SER 91 -14.437 -1.377 -4.693 734 H ASN 92 H ASN 92 -11.074 -3.535 -5.051 735 HA ASN 92 HA ASN 92 -10.162 -3.014 -7.646 736 1HB ASN 92 2HB ASN 92 -9.121 -2.843 -5.036 737 2HB ASN 92 1HB ASN 92 -7.987 -3.836 -5.945 738 1HD2 ASN 92 1HD2 ASN 92 -6.798 -1.742 -5.255 739 2HD2 ASN 92 2HD2 ASN 92 -6.746 -0.505 -6.460 740 H PHE 93 H PHE 93 -10.161 -5.968 -5.762 741 HA PHE 93 HA PHE 93 -8.344 -7.440 -7.326 742 1HB PHE 93 2HB PHE 93 -9.330 -7.977 -4.999 743 2HB PHE 93 1HB PHE 93 -10.671 -8.690 -5.891 744 HD1 PHE 93 1HD PHE 93 -6.937 -8.750 -6.000 745 HD2 PHE 93 2HD PHE 93 -10.572 -10.953 -6.202 746 HE1 PHE 93 1HE PHE 93 -5.655 -10.834 -6.250 747 HE2 PHE 93 2HE PHE 93 -9.296 -13.043 -6.452 748 HZ PHE 93 HZ PHE 93 -6.834 -12.985 -6.475 749 H LYS 94 H LYS 94 -11.908 -7.417 -7.383 750 HA LYS 94 HA LYS 94 -12.219 -9.196 -9.512 751 1HB LYS 94 2HB LYS 94 -13.968 -6.995 -8.440 752 2HB LYS 94 1HB LYS 94 -14.471 -8.009 -9.787 753 1HG LYS 94 2HG LYS 94 -13.519 -9.358 -7.324 754 2HG LYS 94 1HG LYS 94 -15.101 -8.579 -7.286 755 1HD LYS 94 2HD LYS 94 -15.716 -9.860 -9.326 756 2HD LYS 94 1HD LYS 94 -14.172 -10.708 -9.211 757 1HE LYS 94 2HE LYS 94 -15.636 -10.736 -6.704 758 2HE LYS 94 1HE LYS 94 -16.562 -11.452 -8.023 759 1HZ LYS 94 1HZ LYS 94 -13.790 -12.274 -7.891 760 2HZ LYS 94 2HZ LYS 94 -15.184 -13.198 -8.150 761 3HZ LYS 94 3HZ LYS 94 -14.736 -12.768 -6.577 762 H ASN 95 H ASN 95 -11.837 -5.681 -9.507 763 HA ASN 95 HA ASN 95 -12.359 -5.311 -12.262 764 1HB ASN 95 2HB ASN 95 -12.247 -3.581 -10.312 765 2HB ASN 95 1HB ASN 95 -10.535 -3.498 -10.719 766 1HD2 ASN 95 1HD2 ASN 95 -10.853 -1.311 -11.293 767 2HD2 ASN 95 2HD2 ASN 95 -11.560 -0.886 -12.811 768 H VAL 96 H VAL 96 -9.251 -5.366 -10.504 769 HA VAL 96 HA VAL 96 -7.626 -5.202 -12.787 770 HB VAL 96 HB VAL 96 -6.877 -4.773 -10.438 771 1HG1 VAL 96 1HG1 VAL 96 -6.348 -7.699 -10.164 772 2HG1 VAL 96 2HG1 VAL 96 -7.917 -7.045 -9.695 773 3HG1 VAL 96 3HG1 VAL 96 -6.449 -6.454 -8.919 774 1HG2 VAL 96 1HG2 VAL 96 -5.392 -5.266 -12.502 775 2HG2 VAL 96 2HG2 VAL 96 -5.053 -6.792 -11.685 776 3HG2 VAL 96 3HG2 VAL 96 -4.658 -5.263 -10.899 777 H LEU 97 H LEU 97 -9.294 -7.891 -11.378 778 HA LEU 97 HA LEU 97 -7.718 -10.008 -12.301 779 1HB LEU 97 2HB LEU 97 -10.029 -9.791 -10.870 780 2HB LEU 97 1HB LEU 97 -10.619 -10.461 -12.378 781 HG LEU 97 HG LEU 97 -8.597 -12.147 -11.992 782 1HD1 LEU 97 1HD1 LEU 97 -9.412 -11.434 -9.181 783 2HD1 LEU 97 2HD1 LEU 97 -7.886 -10.961 -9.926 784 3HD1 LEU 97 3HD1 LEU 97 -8.254 -12.667 -9.680 785 1HD2 LEU 97 1HD2 LEU 97 -10.177 -13.715 -11.423 786 2HD2 LEU 97 2HD2 LEU 97 -11.196 -12.433 -12.079 787 3HD2 LEU 97 3HD2 LEU 97 -11.029 -12.621 -10.333 788 H LYS 98 H LYS 98 -10.403 -8.307 -13.885 789 HA LYS 98 HA LYS 98 -10.081 -9.904 -16.288 790 1HB LYS 98 2HB LYS 98 -11.912 -7.553 -15.789 791 2HB LYS 98 1HB LYS 98 -12.000 -8.678 -17.136 792 1HG LYS 98 2HG LYS 98 -12.541 -10.491 -15.603 793 2HG LYS 98 1HG LYS 98 -12.426 -9.377 -14.239 794 1HD LYS 98 2HD LYS 98 -14.343 -8.205 -14.885 795 2HD LYS 98 1HD LYS 98 -14.290 -8.847 -16.527 796 1HE LYS 98 2HE LYS 98 -14.846 -11.074 -15.664 797 2HE LYS 98 1HE LYS 98 -14.915 -10.419 -14.029 798 1HZ LYS 98 1HZ LYS 98 -17.008 -10.612 -15.739 799 2HZ LYS 98 2HZ LYS 98 -16.564 -8.988 -15.894 800 3HZ LYS 98 3HZ LYS 98 -16.952 -9.617 -14.372 801 H ASN 99 H ASN 99 -9.619 -6.539 -15.276 802 HA ASN 99 HA ASN 99 -8.907 -5.486 -17.765 803 1HB ASN 99 2HB ASN 99 -9.422 -4.263 -15.556 804 2HB ASN 99 1HB ASN 99 -7.719 -4.506 -15.180 805 1HD2 ASN 99 1HD2 ASN 99 -9.736 -3.405 -17.886 806 2HD2 ASN 99 2HD2 ASN 99 -8.733 -2.064 -18.309 807 H PHE 100 H PHE 100 -7.151 -7.580 -15.685 808 HA PHE 100 HA PHE 100 -4.662 -6.985 -17.139 809 1HB PHE 100 2HB PHE 100 -5.212 -7.949 -14.372 810 2HB PHE 100 1HB PHE 100 -3.736 -8.490 -15.159 811 HD1 PHE 100 1HD PHE 100 -5.130 -5.182 -15.886 812 HD2 PHE 100 2HD PHE 100 -2.344 -7.377 -13.531 813 HE1 PHE 100 1HE PHE 100 -4.018 -3.082 -15.249 814 HE2 PHE 100 2HE PHE 100 -1.229 -5.281 -12.892 815 HZ PHE 100 HZ PHE 100 -2.065 -3.129 -13.750 816 H THR 101 H THR 101 -3.184 -9.060 -17.118 817 HA THR 101 HA THR 101 -4.537 -10.982 -18.772 818 HB THR 101 HB THR 101 -2.130 -12.078 -18.590 819 HG1 THR 101 1HG THR 101 -1.801 -10.120 -16.960 820 1HG2 THR 101 1HG2 THR 101 -3.382 -10.187 -20.305 821 2HG2 THR 101 2HG2 THR 101 -2.125 -11.360 -20.696 822 3HG2 THR 101 3HG2 THR 101 -1.683 -9.744 -20.147 823 H ASN 102 H ASN 102 -3.303 -13.342 -18.279 824 HA ASN 102 HA ASN 102 -4.832 -14.415 -16.147 825 1HB ASN 102 2HB ASN 102 -3.886 -16.539 -16.757 826 2HB ASN 102 1HB ASN 102 -4.210 -15.642 -18.237 827 1HD2 ASN 102 1HD2 ASN 102 -2.029 -17.550 -16.738 828 2HD2 ASN 102 2HD2 ASN 102 -0.590 -17.065 -17.562 829 H THR 103 H THR 103 -2.385 -12.472 -15.707 830 HA THR 103 HA THR 103 -0.805 -14.055 -13.854 831 HB THR 103 HB THR 103 0.361 -12.444 -15.276 832 HG1 THR 103 1HG THR 103 0.716 -12.761 -12.743 833 1HG2 THR 103 1HG2 THR 103 -0.578 -10.072 -13.819 834 2HG2 THR 103 2HG2 THR 103 -1.777 -10.801 -14.889 835 3HG2 THR 103 3HG2 THR 103 -0.219 -10.284 -15.533 836 H GLN 104 H GLN 104 -3.750 -12.945 -13.550 837 HA GLN 104 HA GLN 104 -3.844 -11.193 -11.390 838 1HB GLN 104 2HB GLN 104 -5.884 -13.329 -11.364 839 2HB GLN 104 1HB GLN 104 -6.081 -11.584 -11.348 840 1HG GLN 104 2HG GLN 104 -6.482 -11.526 -13.525 841 2HG GLN 104 1HG GLN 104 -5.061 -12.504 -13.888 842 1HE2 GLN 104 1HE2 GLN 104 -5.864 -13.921 -15.316 843 2HE2 GLN 104 2HE2 GLN 104 -7.166 -15.011 -15.000 844 H ASN 105 H ASN 105 -2.784 -14.432 -11.487 845 HA ASN 105 HA ASN 105 -3.360 -15.117 -8.770 846 1HB ASN 105 2HB ASN 105 -1.726 -16.331 -10.965 847 2HB ASN 105 1HB ASN 105 -1.519 -16.907 -9.314 848 1HD2 ASN 105 1HD2 ASN 105 -4.410 -16.244 -8.794 849 2HD2 ASN 105 2HD2 ASN 105 -5.282 -17.565 -9.485 850 H LYS 106 H LYS 106 -1.517 -12.727 -9.763 851 HA LYS 106 HA LYS 106 0.646 -13.247 -7.833 852 1HB LYS 106 2HB LYS 106 0.922 -12.563 -10.452 853 2HB LYS 106 1HB LYS 106 0.949 -10.978 -9.692 854 1HG LYS 106 2HG LYS 106 3.185 -11.596 -9.783 855 2HG LYS 106 1HG LYS 106 2.714 -11.974 -8.124 856 1HD LYS 106 2HD LYS 106 3.639 -13.978 -8.552 857 2HD LYS 106 1HD LYS 106 2.124 -14.306 -9.396 858 1HE LYS 106 2HE LYS 106 4.040 -14.886 -10.786 859 2HE LYS 106 1HE LYS 106 3.129 -13.552 -11.493 860 1HZ LYS 106 1HZ LYS 106 5.369 -12.952 -11.676 861 2HZ LYS 106 2HZ LYS 106 5.737 -13.447 -10.101 862 3HZ LYS 106 3HZ LYS 106 4.801 -12.060 -10.355 863 H VAL 107 H VAL 107 -2.230 -11.722 -8.078 864 HA VAL 107 HA VAL 107 -1.417 -9.359 -6.539 865 HB VAL 107 HB VAL 107 -4.243 -9.815 -7.394 866 1HG1 VAL 107 1HG1 VAL 107 -3.578 -7.903 -5.961 867 2HG1 VAL 107 2HG1 VAL 107 -4.304 -7.416 -7.492 868 3HG1 VAL 107 3HG1 VAL 107 -2.556 -7.321 -7.275 869 1HG2 VAL 107 1HG2 VAL 107 -2.334 -10.125 -9.273 870 2HG2 VAL 107 2HG2 VAL 107 -2.537 -8.374 -9.317 871 3HG2 VAL 107 3HG2 VAL 107 -3.922 -9.430 -9.595 872 H LEU 108 H LEU 108 -2.035 -9.036 -4.458 873 HA LEU 108 HA LEU 108 -3.692 -11.124 -3.202 874 1HB LEU 108 2HB LEU 108 -1.698 -9.719 -1.529 875 2HB LEU 108 1HB LEU 108 -2.245 -11.384 -1.467 876 HG LEU 108 HG LEU 108 -0.652 -10.730 -3.846 877 1HD1 LEU 108 1HD1 LEU 108 0.693 -10.792 -1.152 878 2HD1 LEU 108 2HD1 LEU 108 0.437 -9.330 -2.105 879 3HD1 LEU 108 3HD1 LEU 108 1.465 -10.619 -2.729 880 1HD2 LEU 108 1HD2 LEU 108 0.199 -12.850 -2.023 881 2HD2 LEU 108 2HD2 LEU 108 -0.179 -12.915 -3.745 882 3HD2 LEU 108 3HD2 LEU 108 -1.477 -12.989 -2.553 883 H LYS 109 H LYS 109 -4.916 -10.466 -1.349 884 HA LYS 109 HA LYS 109 -5.535 -7.588 -1.355 885 1HB LYS 109 2HB LYS 109 -7.408 -9.765 -0.446 886 2HB LYS 109 1HB LYS 109 -7.795 -8.100 -0.857 887 1HG LYS 109 2HG LYS 109 -7.440 -8.512 -3.179 888 2HG LYS 109 1HG LYS 109 -6.785 -10.117 -2.846 889 1HD LYS 109 2HD LYS 109 -9.546 -9.437 -1.934 890 2HD LYS 109 1HD LYS 109 -9.266 -9.837 -3.630 891 1HE LYS 109 2HE LYS 109 -9.137 -11.549 -1.222 892 2HE LYS 109 1HE LYS 109 -9.675 -11.932 -2.857 893 1HZ LYS 109 1HZ LYS 109 -7.693 -13.126 -2.503 894 2HZ LYS 109 2HZ LYS 109 -6.892 -11.787 -1.850 895 3HZ LYS 109 3HZ LYS 109 -7.263 -11.828 -3.499 896 H ILE 110 H ILE 110 -5.815 -6.525 0.595 897 HA ILE 110 HA ILE 110 -4.229 -7.369 2.752 898 HB ILE 110 HB ILE 110 -5.265 -4.994 2.042 899 1HG1 ILE 110 2HG1 ILE 110 -4.774 -4.723 4.805 900 2HG1 ILE 110 1HG1 ILE 110 -3.775 -6.067 4.259 901 1HG2 ILE 110 1HG2 ILE 110 -7.517 -5.445 2.728 902 2HG2 ILE 110 2HG2 ILE 110 -6.821 -4.256 3.830 903 3HG2 ILE 110 3HG2 ILE 110 -6.978 -5.940 4.332 904 1HD1 ILE 110 1HD1 ILE 110 -2.314 -4.456 3.747 905 2HD1 ILE 110 2HD1 ILE 110 -3.553 -3.202 3.707 906 3HD1 ILE 110 3HD1 ILE 110 -3.312 -4.248 2.308 907 H THR 111 H THR 111 -7.333 -8.367 1.875 908 HA THR 111 HA THR 111 -8.555 -8.738 4.378 909 HB THR 111 HB THR 111 -9.840 -8.967 2.326 910 HG1 THR 111 1HG THR 111 -10.634 -10.120 4.105 911 1HG2 THR 111 1HG2 THR 111 -7.744 -10.895 1.667 912 2HG2 THR 111 2HG2 THR 111 -8.823 -9.989 0.606 913 3HG2 THR 111 3HG2 THR 111 -9.372 -11.493 1.346 914 H ASP 112 H ASP 112 -6.258 -10.696 2.567 915 HA ASP 112 HA ASP 112 -6.363 -12.884 4.447 916 1HB ASP 112 2HB ASP 112 -4.770 -12.285 1.975 917 2HB ASP 112 1HB ASP 112 -4.265 -13.582 3.054 918 H PHE 113 H PHE 113 -4.779 -9.895 4.245 919 HA PHE 113 HA PHE 113 -2.674 -10.760 6.111 920 1HB PHE 113 2HB PHE 113 -2.879 -8.324 4.332 921 2HB PHE 113 1HB PHE 113 -1.622 -8.537 5.546 922 HD1 PHE 113 1HD PHE 113 -0.273 -10.782 5.360 923 HD2 PHE 113 2HD PHE 113 -2.470 -9.003 2.179 924 HE1 PHE 113 1HE PHE 113 1.093 -12.018 3.729 925 HE2 PHE 113 2HE PHE 113 -1.108 -10.238 0.542 926 HZ PHE 113 HZ PHE 113 0.677 -11.747 1.318 927 H SER 114 H SER 114 -5.673 -9.414 6.061 928 HA SER 114 HA SER 114 -5.435 -8.445 8.756 929 1HB SER 114 2HB SER 114 -6.273 -6.544 6.555 930 2HB SER 114 1HB SER 114 -6.357 -6.205 8.284 931 HG SER 114 HG SER 114 -4.364 -5.595 8.136 932 HA PRO 115 HA PRO 115 -9.491 -10.421 7.440 933 1HB PRO 115 2HB PRO 115 -9.523 -12.305 9.404 934 2HB PRO 115 1HB PRO 115 -8.756 -12.557 7.832 935 1HG PRO 115 2HG PRO 115 -7.511 -11.788 10.443 936 2HG PRO 115 1HG PRO 115 -6.950 -12.964 9.240 937 1HD PRO 115 2HD PRO 115 -5.901 -10.486 9.417 938 2HD PRO 115 1HD PRO 115 -6.071 -11.330 7.865 939 H SER 116 H SER 116 -8.356 -10.098 10.809 940 HA SER 116 HA SER 116 -10.936 -9.548 11.853 941 1HB SER 116 2HB SER 116 -9.698 -8.901 13.917 942 2HB SER 116 1HB SER 116 -9.211 -10.474 13.283 943 HG SER 116 HG SER 116 -7.351 -9.374 13.735 944 H LEU 117 H LEU 117 -9.010 -7.673 9.923 945 HA LEU 117 HA LEU 117 -9.553 -5.132 11.203 946 1HB LEU 117 2HB LEU 117 -7.461 -5.684 9.884 947 2HB LEU 117 1HB LEU 117 -8.449 -5.600 8.439 948 HG LEU 117 HG LEU 117 -8.995 -3.235 9.004 949 1HD1 LEU 117 1HD1 LEU 117 -6.942 -3.669 11.168 950 2HD1 LEU 117 2HD1 LEU 117 -8.649 -3.284 11.391 951 3HD1 LEU 117 3HD1 LEU 117 -7.565 -2.098 10.664 952 1HD2 LEU 117 1HD2 LEU 117 -7.374 -2.971 7.501 953 2HD2 LEU 117 2HD2 LEU 117 -6.443 -4.316 8.156 954 3HD2 LEU 117 3HD2 LEU 117 -6.283 -2.708 8.860 955 H ASN 118 H ASN 118 -10.506 -6.769 8.193 956 HA ASN 118 HA ASN 118 -12.125 -6.250 6.644 957 1HB ASN 118 2HB ASN 118 -13.195 -7.477 8.659 958 2HB ASN 118 1HB ASN 118 -13.920 -5.917 9.031 959 1HD2 ASN 118 1HD2 ASN 118 -13.273 -7.352 5.873 960 2HD2 ASN 118 2HD2 ASN 118 -14.925 -7.418 5.368 961 H TYR 119 H TYR 119 -11.245 -4.178 6.001 962 HA TYR 119 HA TYR 119 -12.750 -1.881 7.056 963 1HB TYR 119 2HB TYR 119 -10.960 -0.478 6.514 964 2HB TYR 119 1HB TYR 119 -10.183 -1.927 7.132 965 HD1 TYR 119 1HD TYR 119 -9.416 0.449 5.078 966 HD2 TYR 119 2HD TYR 119 -10.284 -3.704 4.740 967 HE1 TYR 119 1HE TYR 119 -8.066 0.341 3.033 968 HE2 TYR 119 2HE TYR 119 -8.924 -3.823 2.685 969 HH TYR 119 HH TYR 119 -7.088 -2.585 1.627 970 H ASP 120 H ASP 120 -12.556 -0.057 5.072 971 HA ASP 120 HA ASP 120 -13.734 -1.364 2.713 972 1HB ASP 120 2HB ASP 120 -14.881 0.802 4.421 973 2HB ASP 120 1HB ASP 120 -15.221 0.817 2.693 974 H GLU 121 H GLU 121 -11.845 -1.070 1.540 975 HA GLU 121 HA GLU 121 -10.164 0.021 0.418 976 1HB GLU 121 2HB GLU 121 -12.524 1.715 -0.397 977 2HB GLU 121 1HB GLU 121 -11.046 1.466 -1.315 978 1HG GLU 121 2HG GLU 121 -11.784 -0.445 -2.182 979 2HG GLU 121 1HG GLU 121 -12.369 -1.026 -0.624 980 H VAL 122 H VAL 122 -8.807 0.970 1.879 981 HA VAL 122 HA VAL 122 -7.646 2.655 2.871 982 HB VAL 122 HB VAL 122 -9.421 4.314 1.088 983 1HG1 VAL 122 1HG1 VAL 122 -8.928 5.763 2.899 984 2HG1 VAL 122 2HG1 VAL 122 -7.820 6.183 1.593 985 3HG1 VAL 122 3HG1 VAL 122 -7.250 5.224 2.959 986 1HG2 VAL 122 1HG2 VAL 122 -6.461 3.766 0.955 987 2HG2 VAL 122 2HG2 VAL 122 -7.456 4.573 -0.258 988 3HG2 VAL 122 3HG2 VAL 122 -7.682 2.855 0.067 989 HA PRO 123 HA PRO 123 -10.153 3.554 6.442 990 1HB PRO 123 2HB PRO 123 -8.351 4.947 7.893 991 2HB PRO 123 1HB PRO 123 -8.220 3.204 7.642 992 1HG PRO 123 2HG PRO 123 -6.793 5.431 6.243 993 2HG PRO 123 1HG PRO 123 -6.150 3.889 6.837 994 1HD PRO 123 2HD PRO 123 -6.786 4.331 4.229 995 2HD PRO 123 1HD PRO 123 -6.879 2.733 4.993 996 H ASP 124 H ASP 124 -9.318 6.053 7.912 997 HA ASP 124 HA ASP 124 -9.882 8.249 8.089 998 1HB ASP 124 2HB ASP 124 -9.068 9.418 6.391 999 2HB ASP 124 1HB ASP 124 -9.055 7.964 5.395 1000 HA PRO 125 HA PRO 125 -14.213 8.480 8.613 1001 1HB PRO 125 2HB PRO 125 -14.018 11.246 7.512 1002 2HB PRO 125 1HB PRO 125 -14.785 10.680 9.000 1003 1HG PRO 125 2HG PRO 125 -12.437 11.898 9.105 1004 2HG PRO 125 1HG PRO 125 -12.755 10.480 10.122 1005 1HD PRO 125 2HD PRO 125 -11.135 10.695 7.623 1006 2HD PRO 125 1HD PRO 125 -10.849 9.710 9.072 1007 H TRP 126 H TRP 126 -13.103 9.929 5.547 1008 HA TRP 126 HA TRP 126 -15.500 9.964 4.177 1009 1HB TRP 126 2HB TRP 126 -13.529 10.985 3.236 1010 2HB TRP 126 1HB TRP 126 -12.718 9.426 3.127 1011 HD1 TRP 126 HD TRP 126 -12.730 8.449 0.770 1012 HE1 TRP 126 1HE TRP 126 -14.235 8.640 -1.308 1013 HE3 TRP 126 3HE TRP 126 -16.355 11.516 2.667 1014 HZ2 TRP 126 2HZ TRP 126 -16.639 9.918 -2.046 1015 HZ3 TRP 126 3HZ TRP 126 -18.223 12.176 1.208 1016 HH2 TRP 126 HH TRP 126 -18.360 11.393 -1.100 1017 H TYR 127 H TYR 127 -13.568 7.231 5.057 1018 HA TYR 127 HA TYR 127 -15.227 5.499 3.353 1019 1HB TYR 127 2HB TYR 127 -12.489 5.095 4.546 1020 2HB TYR 127 1HB TYR 127 -13.421 3.777 3.844 1021 HD1 TYR 127 1HD TYR 127 -11.077 6.346 3.188 1022 HD2 TYR 127 2HD TYR 127 -14.237 4.134 1.397 1023 HE1 TYR 127 1HE TYR 127 -10.212 6.937 0.967 1024 HE2 TYR 127 2HE TYR 127 -13.380 4.707 -0.834 1025 HH TYR 127 HH TYR 127 -11.650 7.018 -1.604 1026 H SER 128 H SER 128 -13.584 5.290 6.525 1027 HA SER 128 HA SER 128 -15.595 3.418 7.451 1028 1HB SER 128 2HB SER 128 -13.936 4.128 9.606 1029 2HB SER 128 1HB SER 128 -13.835 2.673 8.615 1030 HG SER 128 HG SER 128 -11.875 3.927 8.686 1031 H GLY 129 H GLY 129 -14.313 6.527 8.660 1032 1HA GLY 129 2HA GLY 129 -16.237 8.177 9.035 1033 2HA GLY 129 1HA GLY 129 -16.872 6.907 10.070 1034 H ASN 130 H ASN 130 -13.649 6.640 10.440 1035 HA ASN 130 HA ASN 130 -13.543 8.662 12.579 1036 1HB ASN 130 2HB ASN 130 -13.863 6.072 13.150 1037 2HB ASN 130 1HB ASN 130 -12.110 6.086 12.976 1038 1HD2 ASN 130 1HD2 ASN 130 -11.177 8.207 14.073 1039 2HD2 ASN 130 2HD2 ASN 130 -11.686 8.413 15.713 1040 H PHE 131 H PHE 131 -11.454 9.402 13.172 1041 HA PHE 131 HA PHE 131 -9.624 9.531 10.930 1042 1HB PHE 131 2HB PHE 131 -9.207 10.810 13.627 1043 2HB PHE 131 1HB PHE 131 -8.580 11.327 12.067 1044 HD1 PHE 131 1HD PHE 131 -9.807 12.788 10.678 1045 HD2 PHE 131 2HD PHE 131 -11.629 11.111 14.141 1046 HE1 PHE 131 1HE PHE 131 -11.695 14.349 10.437 1047 HE2 PHE 131 2HE PHE 131 -13.521 12.667 13.903 1048 HZ PHE 131 HZ PHE 131 -13.554 14.288 12.050 1049 H ASP 132 H ASP 132 -9.921 7.868 13.926 1050 HA ASP 132 HA ASP 132 -7.169 7.271 14.350 1051 1HB ASP 132 2HB ASP 132 -9.715 6.634 15.611 1052 2HB ASP 132 1HB ASP 132 -8.622 5.253 15.595 1053 H GLU 133 H GLU 133 -9.599 5.982 12.284 1054 HA GLU 133 HA GLU 133 -8.797 3.339 12.000 1055 1HB GLU 133 2HB GLU 133 -9.679 5.030 9.672 1056 2HB GLU 133 1HB GLU 133 -9.945 3.313 9.930 1057 1HG GLU 133 2HG GLU 133 -11.104 5.270 11.849 1058 2HG GLU 133 1HG GLU 133 -11.864 5.031 10.277 1059 H THR 134 H THR 134 -7.674 6.217 10.250 1060 HA THR 134 HA THR 134 -5.924 5.113 8.464 1061 HB THR 134 HB THR 134 -4.673 7.182 8.501 1062 HG1 THR 134 1HG THR 134 -5.747 8.636 10.364 1063 1HG2 THR 134 1HG2 THR 134 -6.567 7.705 7.356 1064 2HG2 THR 134 2HG2 THR 134 -6.813 8.779 8.733 1065 3HG2 THR 134 3HG2 THR 134 -7.629 7.217 8.677 1066 H TYR 135 H TYR 135 -5.460 5.563 11.921 1067 HA TYR 135 HA TYR 135 -2.690 4.887 11.931 1068 1HB TYR 135 2HB TYR 135 -4.111 6.112 13.744 1069 2HB TYR 135 1HB TYR 135 -4.489 4.488 14.301 1070 HD1 TYR 135 1HD TYR 135 -1.227 5.532 12.885 1071 HD2 TYR 135 2HD TYR 135 -3.410 4.583 16.412 1072 HE1 TYR 135 1HE TYR 135 0.871 5.494 14.166 1073 HE2 TYR 135 2HE TYR 135 -1.318 4.544 17.703 1074 HH TYR 135 HH TYR 135 1.040 5.665 17.422 1075 H LYS 136 H LYS 136 -5.590 3.089 12.961 1076 HA LYS 136 HA LYS 136 -4.354 0.667 13.519 1077 1HB LYS 136 2HB LYS 136 -7.127 1.429 12.695 1078 2HB LYS 136 1HB LYS 136 -6.697 -0.273 12.801 1079 1HG LYS 136 2HG LYS 136 -5.891 1.280 15.134 1080 2HG LYS 136 1HG LYS 136 -7.634 1.262 14.854 1081 1HD LYS 136 2HD LYS 136 -6.434 -1.359 14.501 1082 2HD LYS 136 1HD LYS 136 -6.148 -0.707 16.115 1083 1HE LYS 136 2HE LYS 136 -8.865 -0.763 14.821 1084 2HE LYS 136 1HE LYS 136 -8.253 -2.074 15.829 1085 1HZ LYS 136 1HZ LYS 136 -8.492 0.743 16.730 1086 2HZ LYS 136 2HZ LYS 136 -8.093 -0.597 17.681 1087 3HZ LYS 136 3HZ LYS 136 -9.650 -0.452 17.036 1088 H ILE 137 H ILE 137 -5.940 1.621 10.472 1089 HA ILE 137 HA ILE 137 -5.322 -0.726 9.070 1090 HB ILE 137 HB ILE 137 -5.604 1.909 7.678 1091 1HG1 ILE 137 2HG1 ILE 137 -7.286 1.755 9.544 1092 2HG1 ILE 137 1HG1 ILE 137 -7.981 1.876 7.934 1093 1HG2 ILE 137 1HG2 ILE 137 -5.558 0.491 5.958 1094 2HG2 ILE 137 2HG2 ILE 137 -7.193 0.042 6.444 1095 3HG2 ILE 137 3HG2 ILE 137 -5.817 -0.912 6.995 1096 1HD1 ILE 137 1HD1 ILE 137 -7.596 -0.803 9.184 1097 2HD1 ILE 137 2HD1 ILE 137 -8.766 -0.283 7.971 1098 3HD1 ILE 137 3HD1 ILE 137 -8.961 0.212 9.653 1099 H LEU 138 H LEU 138 -3.810 2.497 8.538 1100 HA LEU 138 HA LEU 138 -1.790 1.621 6.877 1101 1HB LEU 138 2HB LEU 138 -1.972 3.944 8.757 1102 2HB LEU 138 1HB LEU 138 -0.520 3.663 7.814 1103 HG LEU 138 HG LEU 138 -3.166 3.783 6.426 1104 1HD1 LEU 138 1HD1 LEU 138 -2.756 6.232 6.109 1105 2HD1 LEU 138 2HD1 LEU 138 -1.557 6.134 7.399 1106 3HD1 LEU 138 3HD1 LEU 138 -3.249 5.767 7.736 1107 1HD2 LEU 138 1HD2 LEU 138 -1.363 5.032 4.863 1108 2HD2 LEU 138 2HD2 LEU 138 -1.664 3.296 4.818 1109 3HD2 LEU 138 3HD2 LEU 138 -0.304 3.930 5.744 1110 H SER 139 H SER 139 -1.421 2.226 10.387 1111 HA SER 139 HA SER 139 1.206 1.387 10.606 1112 1HB SER 139 2HB SER 139 -0.278 2.517 12.364 1113 2HB SER 139 1HB SER 139 -0.807 0.888 12.788 1114 HG SER 139 HG SER 139 0.917 1.338 14.083 1115 H LEU 140 H LEU 140 -1.672 -0.614 11.342 1116 HA LEU 140 HA LEU 140 -0.224 -2.974 11.807 1117 1HB LEU 140 2HB LEU 140 -2.499 -2.697 12.583 1118 2HB LEU 140 1HB LEU 140 -3.085 -2.593 10.934 1119 HG LEU 140 HG LEU 140 -1.948 -5.011 10.801 1120 1HD1 LEU 140 1HD1 LEU 140 -1.144 -5.050 13.070 1121 2HD1 LEU 140 2HD1 LEU 140 -2.440 -6.232 12.894 1122 3HD1 LEU 140 3HD1 LEU 140 -2.756 -4.689 13.687 1123 1HD2 LEU 140 1HD2 LEU 140 -4.058 -5.507 10.334 1124 2HD2 LEU 140 2HD2 LEU 140 -4.556 -3.959 11.018 1125 3HD2 LEU 140 3HD2 LEU 140 -4.490 -5.394 12.041 1126 H ALA 141 H ALA 141 -2.113 -2.089 8.908 1127 HA ALA 141 HA ALA 141 -1.482 -4.292 7.363 1128 1HB ALA 141 1HB ALA 141 -3.197 -2.556 6.840 1129 2HB ALA 141 2HB ALA 141 -2.210 -3.054 5.466 1130 3HB ALA 141 3HB ALA 141 -1.889 -1.519 6.272 1131 H CYS 142 H CYS 142 0.273 -1.190 7.539 1132 HA CYS 142 HA CYS 142 2.167 -1.751 5.560 1133 1HB CYS 142 2HB CYS 142 1.909 0.491 6.418 1134 2HB CYS 142 1HB CYS 142 2.392 -0.023 8.030 1135 HG CYS 142 HG CYS 142 4.795 -0.828 5.971 1136 H LYS 143 H LYS 143 2.372 -2.272 9.081 1137 HA LYS 143 HA LYS 143 4.963 -3.339 9.105 1138 1HB LYS 143 2HB LYS 143 2.639 -3.763 10.985 1139 2HB LYS 143 1HB LYS 143 4.266 -4.352 11.299 1140 1HG LYS 143 2HG LYS 143 4.303 -1.553 10.620 1141 2HG LYS 143 1HG LYS 143 3.212 -1.867 11.971 1142 1HD LYS 143 2HD LYS 143 5.030 -3.099 13.105 1143 2HD LYS 143 1HD LYS 143 6.112 -2.679 11.775 1144 1HE LYS 143 2HE LYS 143 6.597 -1.049 13.346 1145 2HE LYS 143 1HE LYS 143 5.422 -0.241 12.308 1146 1HZ LYS 143 1HZ LYS 143 4.771 -1.586 14.874 1147 2HZ LYS 143 2HZ LYS 143 3.700 -0.709 13.902 1148 3HZ LYS 143 3HZ LYS 143 4.974 0.083 14.682 1149 H ASN 144 H ASN 144 1.876 -5.136 9.348 1150 HA ASN 144 HA ASN 144 2.934 -7.690 9.163 1151 1HB ASN 144 2HB ASN 144 0.396 -6.611 9.330 1152 2HB ASN 144 1HB ASN 144 0.379 -7.421 7.766 1153 1HD2 ASN 144 1HD2 ASN 144 -1.074 -8.971 8.493 1154 2HD2 ASN 144 2HD2 ASN 144 -0.602 -10.241 9.565 1155 H LEU 145 H LEU 145 1.721 -5.637 6.523 1156 HA LEU 145 HA LEU 145 2.272 -7.430 4.430 1157 1HB LEU 145 2HB LEU 145 0.847 -5.719 3.818 1158 2HB LEU 145 1HB LEU 145 1.789 -4.495 4.644 1159 HG LEU 145 HG LEU 145 3.172 -5.709 2.361 1160 1HD1 LEU 145 1HD1 LEU 145 1.347 -5.728 1.038 1161 2HD1 LEU 145 2HD1 LEU 145 1.650 -3.993 0.955 1162 3HD1 LEU 145 3HD1 LEU 145 0.448 -4.625 2.080 1163 1HD2 LEU 145 1HD2 LEU 145 2.748 -2.868 2.265 1164 2HD2 LEU 145 2HD2 LEU 145 4.249 -3.769 2.483 1165 3HD2 LEU 145 3HD2 LEU 145 3.254 -3.359 3.881 1166 H LEU 146 H LEU 146 4.258 -5.157 6.163 1167 HA LEU 146 HA LEU 146 6.425 -5.048 4.349 1168 1HB LEU 146 2HB LEU 146 6.186 -3.361 6.032 1169 2HB LEU 146 1HB LEU 146 6.213 -4.550 7.314 1170 HG LEU 146 HG LEU 146 8.297 -3.053 6.857 1171 1HD1 LEU 146 1HD1 LEU 146 8.082 -4.917 8.485 1172 2HD1 LEU 146 2HD1 LEU 146 9.706 -4.714 7.825 1173 3HD1 LEU 146 3HD1 LEU 146 8.670 -6.014 7.234 1174 1HD2 LEU 146 1HD2 LEU 146 8.971 -5.307 4.990 1175 2HD2 LEU 146 2HD2 LEU 146 9.863 -3.813 5.287 1176 3HD2 LEU 146 3HD2 LEU 146 8.331 -3.768 4.413 1177 H VAL 147 H VAL 147 6.010 -6.897 7.369 1178 HA VAL 147 HA VAL 147 8.367 -8.348 7.288 1179 HB VAL 147 HB VAL 147 5.738 -9.429 8.304 1180 1HG1 VAL 147 1HG1 VAL 147 7.343 -11.134 8.406 1181 2HG1 VAL 147 2HG1 VAL 147 7.332 -10.439 10.026 1182 3HG1 VAL 147 3HG1 VAL 147 8.621 -10.023 8.896 1183 1HG2 VAL 147 1HG2 VAL 147 5.694 -7.914 9.930 1184 2HG2 VAL 147 2HG2 VAL 147 6.947 -7.033 9.057 1185 3HG2 VAL 147 3HG2 VAL 147 7.393 -8.189 10.312 1186 H PHE 148 H PHE 148 5.201 -9.244 5.933 1187 HA PHE 148 HA PHE 148 5.985 -11.761 4.948 1188 1HB PHE 148 2HB PHE 148 3.619 -10.799 5.289 1189 2HB PHE 148 1HB PHE 148 3.826 -10.091 3.690 1190 HD1 PHE 148 1HD PHE 148 4.078 -11.545 1.716 1191 HD2 PHE 148 2HD PHE 148 3.205 -13.122 5.571 1192 HE1 PHE 148 1HE PHE 148 3.356 -13.660 0.683 1193 HE2 PHE 148 2HE PHE 148 2.482 -15.240 4.546 1194 HZ PHE 148 HZ PHE 148 2.558 -15.510 2.099 1195 H LEU 149 H LEU 149 5.525 -8.701 3.162 1196 HA LEU 149 HA LEU 149 6.485 -9.725 0.715 1197 1HB LEU 149 2HB LEU 149 6.328 -6.860 1.644 1198 2HB LEU 149 1HB LEU 149 6.549 -7.376 -0.017 1199 HG LEU 149 HG LEU 149 4.099 -7.803 1.692 1200 1HD1 LEU 149 1HD1 LEU 149 4.059 -5.607 0.922 1201 2HD1 LEU 149 2HD1 LEU 149 3.106 -6.490 -0.271 1202 3HD1 LEU 149 3HD1 LEU 149 4.772 -6.039 -0.631 1203 1HD2 LEU 149 1HD2 LEU 149 3.096 -8.924 -0.171 1204 2HD2 LEU 149 2HD2 LEU 149 4.607 -9.747 0.213 1205 3HD2 LEU 149 3HD2 LEU 149 4.525 -8.655 -1.169 1206 H SER 150 H SER 150 8.178 -8.859 3.517 1207 HA SER 150 HA SER 150 10.645 -8.395 1.985 1208 1HB SER 150 2HB SER 150 10.240 -6.629 3.577 1209 2HB SER 150 1HB SER 150 9.985 -7.795 4.875 1210 HG SER 150 HG SER 150 12.093 -6.884 4.908 1211 H LYS 151 H LYS 151 10.417 -9.600 5.286 1212 HA LYS 151 HA LYS 151 11.252 -12.265 4.461 1213 1HB LYS 151 2HB LYS 151 12.957 -10.373 6.064 1214 2HB LYS 151 1HB LYS 151 13.135 -12.115 6.219 1215 1HG LYS 151 2HG LYS 151 14.554 -12.022 4.521 1216 2HG LYS 151 1HG LYS 151 13.174 -11.658 3.481 1217 1HD LYS 151 2HD LYS 151 13.870 -9.563 3.161 1218 2HD LYS 151 1HD LYS 151 14.089 -9.303 4.892 1219 1HE LYS 151 2HE LYS 151 16.294 -10.044 4.851 1220 2HE LYS 151 1HE LYS 151 16.077 -10.901 3.326 1221 1HZ LYS 151 1HZ LYS 151 15.855 -8.737 2.221 1222 2HZ LYS 151 2HZ LYS 151 17.359 -8.915 2.974 1223 3HZ LYS 151 3HZ LYS 151 16.165 -7.955 3.690 1224 H HIS 152 H HIS 152 9.224 -12.875 5.330 1225 HA HIS 152 HA HIS 152 8.392 -12.282 7.959 1226 1HB HIS 152 2HB HIS 152 6.989 -14.456 7.581 1227 2HB HIS 152 1HB HIS 152 6.653 -13.022 6.617 1228 HD1 HIS 152 1HD HIS 152 7.582 -13.056 4.128 1229 HD2 HIS 152 2HD HIS 152 7.735 -16.680 6.154 1230 HE1 HIS 152 1HE HIS 152 7.936 -14.803 2.353 1231 HE2 HIS 152 2HE HIS 152 7.926 -16.996 3.595 1232 H HIS 153 H HIS 153 8.673 -13.293 9.878 1233 HA HIS 153 HA HIS 153 9.599 -14.596 11.487 1234 1HB HIS 153 2HB HIS 153 8.870 -16.383 9.413 1235 2HB HIS 153 1HB HIS 153 10.450 -16.894 9.997 1236 HD1 HIS 153 1HD HIS 153 10.593 -17.498 12.581 1237 HD2 HIS 153 2HD HIS 153 6.759 -16.969 11.072 1238 HE1 HIS 153 1HE HIS 153 9.053 -18.509 14.291 1239 HE2 HIS 153 2HE HIS 153 6.734 -18.080 13.407 1240 H HIS 154 H HIS 154 11.465 -13.894 12.263 1241 HA HIS 154 HA HIS 154 13.943 -14.716 10.978 1242 1HB HIS 154 2HB HIS 154 14.759 -12.247 11.475 1243 2HB HIS 154 1HB HIS 154 13.986 -12.660 9.948 1244 HD1 HIS 154 1HD HIS 154 12.893 -11.344 13.356 1245 HD2 HIS 154 2HD HIS 154 11.987 -10.961 9.319 1246 HE1 HIS 154 1HE HIS 154 11.105 -9.581 13.233 1247 HE2 HIS 154 2HE HIS 154 10.523 -9.415 10.788 1248 H HIS 155 H HIS 155 12.499 -12.869 13.647 1249 HA HIS 155 HA HIS 155 14.315 -14.257 15.492 1250 1HB HIS 155 2HB HIS 155 14.829 -11.720 14.861 1251 2HB HIS 155 1HB HIS 155 13.601 -11.424 16.086 1252 HD1 HIS 155 1HD HIS 155 16.809 -10.885 16.194 1253 HD2 HIS 155 2HD HIS 155 14.647 -13.830 18.172 1254 HE1 HIS 155 1HE HIS 155 18.205 -11.520 18.185 1255 HE2 HIS 155 2HE HIS 155 16.907 -13.348 19.333 1256 H HIS 156 H HIS 156 13.376 -14.996 17.319 1257 HA HIS 156 HA HIS 156 10.682 -14.037 17.991 1258 1HB HIS 156 2HB HIS 156 11.128 -16.472 16.779 1259 2HB HIS 156 1HB HIS 156 11.080 -16.898 18.487 1260 HD1 HIS 156 1HD HIS 156 8.928 -14.075 18.059 1261 HD2 HIS 156 2HD HIS 156 8.595 -18.156 17.352 1262 HE1 HIS 156 1HE HIS 156 6.460 -14.533 17.916 1263 HE2 HIS 156 2HE HIS 156 6.284 -16.998 17.427 Start of MODEL 6 1 1H MET 1 1HT MET 1 17.435 -10.086 -8.130 2 2H MET 1 2HT MET 1 16.788 -9.627 -6.636 3 3H MET 1 3HT MET 1 17.980 -8.676 -7.370 4 HA MET 1 HA MET 1 16.343 -7.443 -8.174 5 1HB MET 1 2HB MET 1 16.235 -9.970 -9.782 6 2HB MET 1 1HB MET 1 15.099 -8.673 -10.128 7 1HG MET 1 2HG MET 1 16.782 -7.208 -10.788 8 2HG MET 1 1HG MET 1 18.043 -8.154 -9.999 9 1HE MET 1 1HE MET 1 16.960 -7.539 -13.877 10 2HE MET 1 2HE MET 1 15.684 -7.562 -12.659 11 3HE MET 1 3HE MET 1 15.808 -8.874 -13.831 12 H LYS 2 H LYS 2 14.907 -7.039 -6.545 13 HA LYS 2 HA LYS 2 12.553 -8.807 -6.392 14 1HB LYS 2 2HB LYS 2 14.194 -8.452 -4.346 15 2HB LYS 2 1HB LYS 2 13.260 -6.975 -4.144 16 1HG LYS 2 2HG LYS 2 12.074 -8.390 -2.811 17 2HG LYS 2 1HG LYS 2 11.225 -8.627 -4.340 18 1HD LYS 2 2HD LYS 2 13.323 -10.441 -4.430 19 2HD LYS 2 1HD LYS 2 12.760 -10.511 -2.760 20 1HE LYS 2 2HE LYS 2 10.866 -10.648 -5.088 21 2HE LYS 2 1HE LYS 2 11.664 -12.085 -4.450 22 1HZ LYS 2 1HZ LYS 2 9.819 -12.133 -3.176 23 2HZ LYS 2 2HZ LYS 2 9.543 -10.469 -3.285 24 3HZ LYS 2 3HZ LYS 2 10.705 -11.064 -2.210 25 H LYS 3 H LYS 3 10.750 -7.930 -7.151 26 HA LYS 3 HA LYS 3 10.391 -5.016 -6.923 27 1HB LYS 3 2HB LYS 3 9.055 -6.243 -9.223 28 2HB LYS 3 1HB LYS 3 9.958 -4.742 -9.124 29 1HG LYS 3 2HG LYS 3 11.682 -5.681 -10.141 30 2HG LYS 3 1HG LYS 3 11.767 -6.942 -8.908 31 1HD LYS 3 2HD LYS 3 9.608 -7.744 -10.354 32 2HD LYS 3 1HD LYS 3 10.616 -7.010 -11.607 33 1HE LYS 3 2HE LYS 3 12.402 -8.496 -10.111 34 2HE LYS 3 1HE LYS 3 10.960 -9.510 -10.164 35 1HZ LYS 3 1HZ LYS 3 12.864 -9.118 -12.166 36 2HZ LYS 3 2HZ LYS 3 11.412 -8.451 -12.721 37 3HZ LYS 3 3HZ LYS 3 11.465 -10.069 -12.230 38 H ILE 4 H ILE 4 8.624 -4.499 -5.834 39 HA ILE 4 HA ILE 4 6.338 -6.355 -5.907 40 HB ILE 4 HB ILE 4 7.312 -4.815 -3.497 41 1HG1 ILE 4 2HG1 ILE 4 7.124 -7.489 -2.840 42 2HG1 ILE 4 1HG1 ILE 4 7.727 -7.528 -4.494 43 1HG2 ILE 4 1HG2 ILE 4 4.941 -4.818 -3.418 44 2HG2 ILE 4 2HG2 ILE 4 5.481 -6.101 -2.334 45 3HG2 ILE 4 3HG2 ILE 4 4.859 -6.502 -3.935 46 1HD1 ILE 4 1HD1 ILE 4 9.388 -7.465 -2.509 47 2HD1 ILE 4 2HD1 ILE 4 9.020 -5.740 -2.493 48 3HD1 ILE 4 3HD1 ILE 4 9.697 -6.484 -3.942 49 H LEU 5 H LEU 5 4.940 -5.317 -7.192 50 HA LEU 5 HA LEU 5 4.673 -2.441 -7.091 51 1HB LEU 5 2HB LEU 5 4.310 -4.285 -9.066 52 2HB LEU 5 1HB LEU 5 2.656 -3.960 -8.586 53 HG LEU 5 HG LEU 5 4.609 -1.791 -9.344 54 1HD1 LEU 5 1HD1 LEU 5 3.715 -3.678 -11.082 55 2HD1 LEU 5 2HD1 LEU 5 4.135 -2.022 -11.521 56 3HD1 LEU 5 3HD1 LEU 5 2.453 -2.454 -11.212 57 1HD2 LEU 5 1HD2 LEU 5 2.342 -0.637 -9.780 58 2HD2 LEU 5 2HD2 LEU 5 2.903 -0.803 -8.116 59 3HD2 LEU 5 3HD2 LEU 5 1.677 -1.903 -8.747 60 H PHE 6 H PHE 6 3.419 -1.409 -5.729 61 HA PHE 6 HA PHE 6 1.311 -2.809 -4.282 62 1HB PHE 6 2HB PHE 6 2.750 -0.197 -3.962 63 2HB PHE 6 1HB PHE 6 1.181 -0.407 -3.200 64 HD1 PHE 6 1HD PHE 6 3.428 -3.301 -3.482 65 HD2 PHE 6 2HD PHE 6 2.177 -0.047 -1.025 66 HE1 PHE 6 1HE PHE 6 4.507 -4.346 -1.544 67 HE2 PHE 6 2HE PHE 6 3.261 -1.097 0.916 68 HZ PHE 6 HZ PHE 6 4.427 -3.250 0.658 69 H ILE 7 H ILE 7 -0.873 -2.341 -4.500 70 HA ILE 7 HA ILE 7 -1.584 -0.284 -6.487 71 HB ILE 7 HB ILE 7 -2.968 -2.955 -6.268 72 1HG1 ILE 7 2HG1 ILE 7 -1.225 -2.149 -8.576 73 2HG1 ILE 7 1HG1 ILE 7 -0.502 -2.877 -7.144 74 1HG2 ILE 7 1HG2 ILE 7 -3.127 -1.075 -8.586 75 2HG2 ILE 7 2HG2 ILE 7 -4.121 -0.804 -7.155 76 3HG2 ILE 7 3HG2 ILE 7 -4.274 -2.310 -8.060 77 1HD1 ILE 7 1HD1 ILE 7 -2.470 -4.078 -9.057 78 2HD1 ILE 7 2HD1 ILE 7 -2.171 -4.764 -7.460 79 3HD1 ILE 7 3HD1 ILE 7 -0.856 -4.645 -8.627 80 H CYS 8 H CYS 8 -2.621 1.249 -5.382 81 HA CYS 8 HA CYS 8 -4.624 0.425 -3.389 82 1HB CYS 8 2HB CYS 8 -2.933 2.910 -3.591 83 2HB CYS 8 1HB CYS 8 -4.348 2.816 -2.548 84 HG CYS 8 HG CYS 8 -2.410 2.409 -0.755 85 H LEU 9 H LEU 9 -6.685 0.770 -3.864 86 HA LEU 9 HA LEU 9 -7.568 1.808 -6.296 87 1HB LEU 9 2HB LEU 9 -8.816 0.297 -4.674 88 2HB LEU 9 1HB LEU 9 -9.201 1.743 -3.762 89 HG LEU 9 HG LEU 9 -10.931 0.777 -5.448 90 1HD1 LEU 9 1HD1 LEU 9 -10.620 3.181 -4.257 91 2HD1 LEU 9 2HD1 LEU 9 -11.994 2.745 -5.274 92 3HD1 LEU 9 3HD1 LEU 9 -10.646 3.655 -5.956 93 1HD2 LEU 9 1HD2 LEU 9 -9.074 2.280 -7.284 94 2HD2 LEU 9 2HD2 LEU 9 -10.736 1.852 -7.688 95 3HD2 LEU 9 3HD2 LEU 9 -9.547 0.585 -7.390 96 H GLY 10 H GLY 10 -6.920 3.350 -3.245 97 1HA GLY 10 2HA GLY 10 -7.505 5.959 -4.490 98 2HA GLY 10 1HA GLY 10 -8.067 5.598 -2.864 99 H ASN 11 H ASN 11 -5.328 6.425 -4.845 100 HA ASN 11 HA ASN 11 -3.427 6.198 -2.699 101 1HB ASN 11 2HB ASN 11 -3.208 7.435 -5.444 102 2HB ASN 11 1HB ASN 11 -1.878 7.373 -4.292 103 1HD2 ASN 11 1HD2 ASN 11 -0.645 6.128 -5.698 104 2HD2 ASN 11 2HD2 ASN 11 -0.972 4.452 -5.962 105 H ILE 12 H ILE 12 -5.842 7.937 -2.473 106 HA ILE 12 HA ILE 12 -4.494 10.488 -1.907 107 HB ILE 12 HB ILE 12 -6.552 11.635 -2.204 108 1HG1 ILE 12 2HG1 ILE 12 -7.936 9.786 -1.127 109 2HG1 ILE 12 1HG1 ILE 12 -8.688 10.631 -2.473 110 1HG2 ILE 12 1HG2 ILE 12 -5.842 9.675 -4.330 111 2HG2 ILE 12 2HG2 ILE 12 -5.664 11.428 -4.307 112 3HG2 ILE 12 3HG2 ILE 12 -7.255 10.706 -4.551 113 1HD1 ILE 12 1HD1 ILE 12 -7.248 8.331 -3.407 114 2HD1 ILE 12 2HD1 ILE 12 -8.957 8.732 -3.570 115 3HD1 ILE 12 3HD1 ILE 12 -8.382 7.886 -2.133 116 H CYS 13 H CYS 13 -4.899 7.919 -0.267 117 HA CYS 13 HA CYS 13 -5.600 9.307 2.178 118 1HB CYS 13 2HB CYS 13 -7.774 8.529 1.535 119 2HB CYS 13 1HB CYS 13 -7.155 6.919 1.183 120 HG CYS 13 HG CYS 13 -6.662 6.244 3.824 121 H ARG 14 H ARG 14 -5.615 5.819 1.614 122 HA ARG 14 HA ARG 14 -3.703 5.443 3.708 123 1HB ARG 14 2HB ARG 14 -4.389 3.285 3.741 124 2HB ARG 14 1HB ARG 14 -5.752 3.960 2.855 125 1HG ARG 14 2HG ARG 14 -5.038 3.069 0.834 126 2HG ARG 14 1HG ARG 14 -3.375 2.872 1.393 127 1HD ARG 14 2HD ARG 14 -5.791 1.247 2.158 128 2HD ARG 14 1HD ARG 14 -4.348 0.704 1.303 129 HE ARG 14 HE ARG 14 -3.533 1.677 3.778 130 1HH1 ARG 14 1HH1 ARG 14 -5.493 -0.915 2.517 131 2HH1 ARG 14 2HH1 ARG 14 -5.160 -1.981 3.840 132 1HH2 ARG 14 1HH2 ARG 14 -3.090 0.280 5.521 133 2HH2 ARG 14 2HH2 ARG 14 -3.795 -1.302 5.549 134 H SER 15 H SER 15 -3.604 5.027 0.175 135 HA SER 15 HA SER 15 -1.136 3.788 -0.041 136 1HB SER 15 2HB SER 15 -2.830 4.339 -1.885 137 2HB SER 15 1HB SER 15 -2.019 5.901 -1.990 138 HG SER 15 HG SER 15 -0.908 3.332 -2.422 139 HA PRO 16 HA PRO 16 0.963 8.201 -0.262 140 1HB PRO 16 2HB PRO 16 -0.370 10.167 1.100 141 2HB PRO 16 1HB PRO 16 -0.514 9.906 -0.643 142 1HG PRO 16 2HG PRO 16 -2.322 8.992 1.564 143 2HG PRO 16 1HG PRO 16 -2.745 9.706 -0.003 144 1HD PRO 16 2HD PRO 16 -2.910 7.067 0.410 145 2HD PRO 16 1HD PRO 16 -2.366 7.722 -1.149 146 H MET 17 H MET 17 -1.064 7.626 2.615 147 HA MET 17 HA MET 17 0.732 8.565 4.531 148 1HB MET 17 2HB MET 17 -1.762 7.619 4.672 149 2HB MET 17 1HB MET 17 -0.908 6.172 5.193 150 1HG MET 17 2HG MET 17 -0.630 8.890 6.454 151 2HG MET 17 1HG MET 17 -1.649 7.586 7.061 152 1HE MET 17 1HE MET 17 0.322 5.646 9.251 153 2HE MET 17 2HE MET 17 -1.194 6.359 8.702 154 3HE MET 17 3HE MET 17 -0.084 7.304 9.694 155 H ALA 18 H ALA 18 0.190 5.194 3.504 156 HA ALA 18 HA ALA 18 2.454 4.180 4.879 157 1HB ALA 18 1HB ALA 18 2.019 2.328 2.963 158 2HB ALA 18 2HB ALA 18 0.449 3.128 3.017 159 3HB ALA 18 3HB ALA 18 1.131 2.421 4.483 160 H GLU 19 H GLU 19 2.035 5.815 1.893 161 HA GLU 19 HA GLU 19 4.210 4.830 0.425 162 1HB GLU 19 2HB GLU 19 2.685 6.171 -0.762 163 2HB GLU 19 1HB GLU 19 2.741 7.454 0.435 164 1HG GLU 19 2HG GLU 19 3.923 8.354 -1.318 165 2HG GLU 19 1HG GLU 19 5.206 7.706 -0.294 166 H PHE 20 H PHE 20 4.000 7.634 2.613 167 HA PHE 20 HA PHE 20 6.801 8.172 2.436 168 1HB PHE 20 2HB PHE 20 5.595 10.088 2.928 169 2HB PHE 20 1HB PHE 20 4.541 9.266 4.073 170 HD1 PHE 20 1HD PHE 20 8.136 10.163 3.636 171 HD2 PHE 20 2HD PHE 20 4.870 9.649 6.316 172 HE1 PHE 20 1HE PHE 20 9.535 10.975 5.490 173 HE2 PHE 20 2HE PHE 20 6.262 10.462 8.175 174 HZ PHE 20 HZ PHE 20 8.599 11.126 7.762 175 H ILE 21 H ILE 21 4.738 6.709 4.976 176 HA ILE 21 HA ILE 21 6.802 6.324 6.815 177 HB ILE 21 HB ILE 21 5.416 4.832 8.021 178 1HG1 ILE 21 2HG1 ILE 21 3.442 4.627 5.770 179 2HG1 ILE 21 1HG1 ILE 21 4.794 3.506 5.875 180 1HG2 ILE 21 1HG2 ILE 21 3.891 6.368 8.566 181 2HG2 ILE 21 2HG2 ILE 21 3.190 6.387 6.949 182 3HG2 ILE 21 3HG2 ILE 21 4.632 7.341 7.296 183 1HD1 ILE 21 1HD1 ILE 21 3.578 2.261 7.232 184 2HD1 ILE 21 2HD1 ILE 21 2.305 3.481 7.277 185 3HD1 ILE 21 3HD1 ILE 21 3.642 3.559 8.424 186 H MET 22 H MET 22 5.502 3.975 4.460 187 HA MET 22 HA MET 22 7.300 1.921 5.042 188 1HB MET 22 2HB MET 22 5.822 2.597 2.502 189 2HB MET 22 1HB MET 22 6.824 1.160 2.664 190 1HG MET 22 2HG MET 22 5.428 0.241 4.312 191 2HG MET 22 1HG MET 22 4.593 1.772 4.567 192 1HE MET 22 1HE MET 22 2.934 -1.387 3.507 193 2HE MET 22 2HE MET 22 1.686 -0.146 3.379 194 3HE MET 22 3HE MET 22 2.865 -0.080 4.689 195 H LYS 23 H LYS 23 7.527 4.532 2.632 196 HA LYS 23 HA LYS 23 9.905 3.820 1.418 197 1HB LYS 23 2HB LYS 23 8.219 5.971 1.270 198 2HB LYS 23 1HB LYS 23 9.663 6.699 1.960 199 1HG LYS 23 2HG LYS 23 10.307 4.960 -0.256 200 2HG LYS 23 1HG LYS 23 9.156 6.214 -0.719 201 1HD LYS 23 2HD LYS 23 10.622 7.941 -0.123 202 2HD LYS 23 1HD LYS 23 11.634 6.866 0.844 203 1HE LYS 23 2HE LYS 23 11.349 6.775 -2.157 204 2HE LYS 23 1HE LYS 23 12.701 7.489 -1.281 205 1HZ LYS 23 1HZ LYS 23 13.518 5.419 -1.717 206 2HZ LYS 23 2HZ LYS 23 12.005 4.665 -1.644 207 3HZ LYS 23 3HZ LYS 23 12.793 5.118 -0.217 208 H ASP 24 H ASP 24 9.397 5.426 4.508 209 HA ASP 24 HA ASP 24 12.102 6.153 4.951 210 1HB ASP 24 2HB ASP 24 9.697 6.614 6.238 211 2HB ASP 24 1HB ASP 24 10.573 5.596 7.377 212 H LEU 25 H LEU 25 10.178 3.526 6.407 213 HA LEU 25 HA LEU 25 12.401 2.271 7.626 214 1HB LEU 25 2HB LEU 25 10.064 0.596 6.948 215 2HB LEU 25 1HB LEU 25 10.914 0.776 8.469 216 HG LEU 25 HG LEU 25 9.011 2.843 7.369 217 1HD1 LEU 25 1HD1 LEU 25 7.739 0.857 7.762 218 2HD1 LEU 25 2HD1 LEU 25 7.444 1.971 9.097 219 3HD1 LEU 25 3HD1 LEU 25 8.529 0.597 9.317 220 1HD2 LEU 25 1HD2 LEU 25 9.225 3.954 9.380 221 2HD2 LEU 25 2HD2 LEU 25 10.870 3.374 9.114 222 3HD2 LEU 25 3HD2 LEU 25 9.804 2.521 10.231 223 H VAL 26 H VAL 26 11.204 2.187 4.413 224 HA VAL 26 HA VAL 26 12.053 -0.387 3.647 225 HB VAL 26 HB VAL 26 11.250 2.076 2.195 226 1HG1 VAL 26 1HG1 VAL 26 11.736 0.629 0.046 227 2HG1 VAL 26 2HG1 VAL 26 13.033 -0.015 1.053 228 3HG1 VAL 26 3HG1 VAL 26 12.957 1.713 0.713 229 1HG2 VAL 26 1HG2 VAL 26 9.494 0.791 1.467 230 2HG2 VAL 26 2HG2 VAL 26 9.840 0.028 3.018 231 3HG2 VAL 26 3HG2 VAL 26 10.424 -0.707 1.526 232 H LYS 27 H LYS 27 13.668 2.766 3.043 233 HA LYS 27 HA LYS 27 15.905 1.822 1.772 234 1HB LYS 27 2HB LYS 27 17.097 3.805 2.971 235 2HB LYS 27 1HB LYS 27 15.799 4.127 1.830 236 1HG LYS 27 2HG LYS 27 14.848 5.348 3.411 237 2HG LYS 27 1HG LYS 27 14.514 3.844 4.270 238 1HD LYS 27 2HD LYS 27 15.833 4.534 5.919 239 2HD LYS 27 1HD LYS 27 17.201 4.501 4.805 240 1HE LYS 27 2HE LYS 27 16.196 6.833 4.069 241 2HE LYS 27 1HE LYS 27 15.526 6.790 5.699 242 1HZ LYS 27 1HZ LYS 27 18.351 6.856 4.864 243 2HZ LYS 27 2HZ LYS 27 17.927 6.232 6.377 244 3HZ LYS 27 3HZ LYS 27 17.547 7.833 5.989 245 H LYS 28 H LYS 28 15.541 2.237 5.287 246 HA LYS 28 HA LYS 28 18.081 1.179 5.926 247 1HB LYS 28 2HB LYS 28 17.265 1.125 8.233 248 2HB LYS 28 1HB LYS 28 16.880 2.648 7.445 249 1HG LYS 28 2HG LYS 28 14.861 2.288 8.361 250 2HG LYS 28 1HG LYS 28 14.626 1.286 6.927 251 1HD LYS 28 2HD LYS 28 14.314 -0.487 8.226 252 2HD LYS 28 1HD LYS 28 15.948 -0.297 8.867 253 1HE LYS 28 2HE LYS 28 14.837 -0.075 10.824 254 2HE LYS 28 1HE LYS 28 14.694 1.598 10.287 255 1HZ LYS 28 1HZ LYS 28 12.659 -0.489 10.430 256 2HZ LYS 28 2HZ LYS 28 12.549 0.601 9.142 257 3HZ LYS 28 3HZ LYS 28 12.531 1.171 10.735 258 H ALA 29 H ALA 29 15.017 -0.397 5.294 259 HA ALA 29 HA ALA 29 16.292 -2.954 6.023 260 1HB ALA 29 1HB ALA 29 13.453 -2.109 6.531 261 2HB ALA 29 2HB ALA 29 14.696 -2.499 7.720 262 3HB ALA 29 3HB ALA 29 14.031 -3.768 6.691 263 H ASN 30 H ASN 30 16.032 -1.652 3.342 264 HA ASN 30 HA ASN 30 15.121 -4.000 1.951 265 1HB ASN 30 2HB ASN 30 13.291 -1.842 2.310 266 2HB ASN 30 1HB ASN 30 13.753 -1.890 0.612 267 1HD2 ASN 30 1HD2 ASN 30 12.132 -2.829 -0.411 268 2HD2 ASN 30 2HD2 ASN 30 11.402 -4.333 0.023 269 H LEU 31 H LEU 31 15.807 -0.539 1.408 270 HA LEU 31 HA LEU 31 16.967 -0.878 -1.133 271 1HB LEU 31 2HB LEU 31 16.438 1.264 0.600 272 2HB LEU 31 1HB LEU 31 18.167 1.313 0.316 273 HG LEU 31 HG LEU 31 16.087 1.271 -1.871 274 1HD1 LEU 31 1HD1 LEU 31 17.578 3.699 -1.729 275 2HD1 LEU 31 2HD1 LEU 31 16.821 3.391 -0.166 276 3HD1 LEU 31 3HD1 LEU 31 15.834 3.458 -1.627 277 1HD2 LEU 31 1HD2 LEU 31 19.059 1.784 -1.945 278 2HD2 LEU 31 2HD2 LEU 31 17.956 1.900 -3.316 279 3HD2 LEU 31 3HD2 LEU 31 18.238 0.341 -2.542 280 H GLU 32 H GLU 32 18.109 -1.598 1.989 281 HA GLU 32 HA GLU 32 20.879 -1.315 1.694 282 1HB GLU 32 2HB GLU 32 20.325 -3.685 3.200 283 2HB GLU 32 1HB GLU 32 20.873 -2.120 3.780 284 1HG GLU 32 2HG GLU 32 18.815 -1.505 4.475 285 2HG GLU 32 1HG GLU 32 17.997 -2.352 3.163 286 H LYS 33 H LYS 33 18.792 -4.123 1.092 287 HA LYS 33 HA LYS 33 20.959 -5.557 -0.203 288 1HB LYS 33 2HB LYS 33 18.150 -6.207 0.600 289 2HB LYS 33 1HB LYS 33 18.929 -7.187 -0.635 290 1HG LYS 33 2HG LYS 33 20.364 -6.691 1.926 291 2HG LYS 33 1HG LYS 33 19.040 -7.859 1.889 292 1HD LYS 33 2HD LYS 33 20.344 -9.381 0.923 293 2HD LYS 33 1HD LYS 33 20.767 -8.257 -0.370 294 1HE LYS 33 2HE LYS 33 22.817 -8.081 0.459 295 2HE LYS 33 1HE LYS 33 22.152 -7.443 1.962 296 1HZ LYS 33 1HZ LYS 33 23.553 -9.439 2.260 297 2HZ LYS 33 2HZ LYS 33 22.435 -10.336 1.362 298 3HZ LYS 33 3HZ LYS 33 21.975 -9.646 2.836 299 H GLU 34 H GLU 34 19.395 -3.038 -1.161 300 HA GLU 34 HA GLU 34 18.843 -2.093 -3.141 301 1HB GLU 34 2HB GLU 34 20.998 -3.354 -3.775 302 2HB GLU 34 1HB GLU 34 19.930 -4.511 -4.558 303 1HG GLU 34 2HG GLU 34 19.366 -3.080 -6.223 304 2HG GLU 34 1HG GLU 34 19.541 -1.651 -5.207 305 H PHE 35 H PHE 35 16.673 -2.877 -2.132 306 HA PHE 35 HA PHE 35 15.319 -4.755 -3.937 307 1HB PHE 35 2HB PHE 35 14.604 -3.658 -1.220 308 2HB PHE 35 1HB PHE 35 13.440 -4.524 -2.215 309 HD1 PHE 35 1HD PHE 35 16.076 -6.245 -3.217 310 HD2 PHE 35 2HD PHE 35 14.045 -5.480 0.447 311 HE1 PHE 35 1HE PHE 35 16.901 -8.379 -2.317 312 HE2 PHE 35 2HE PHE 35 14.868 -7.615 1.350 313 HZ PHE 35 HZ PHE 35 16.298 -9.067 -0.031 314 H PHE 36 H PHE 36 13.283 -4.189 -4.898 315 HA PHE 36 HA PHE 36 12.874 -1.282 -5.163 316 1HB PHE 36 2HB PHE 36 13.843 -2.772 -7.159 317 2HB PHE 36 1HB PHE 36 12.127 -3.058 -7.426 318 HD1 PHE 36 1HD PHE 36 14.792 -0.543 -7.410 319 HD2 PHE 36 2HD PHE 36 10.677 -1.302 -8.193 320 HE1 PHE 36 1HE PHE 36 14.623 1.609 -8.595 321 HE2 PHE 36 2HE PHE 36 10.503 0.846 -9.379 322 HZ PHE 36 HZ PHE 36 12.477 2.304 -9.582 323 H ILE 37 H ILE 37 10.900 -0.543 -4.780 324 HA ILE 37 HA ILE 37 8.622 -2.399 -4.881 325 HB ILE 37 HB ILE 37 7.895 -0.705 -2.860 326 1HG1 ILE 37 2HG1 ILE 37 10.033 -1.192 -1.308 327 2HG1 ILE 37 1HG1 ILE 37 10.854 -0.996 -2.853 328 1HG2 ILE 37 1HG2 ILE 37 8.780 -2.795 -1.437 329 2HG2 ILE 37 2HG2 ILE 37 8.858 -3.487 -3.058 330 3HG2 ILE 37 3HG2 ILE 37 7.332 -2.852 -2.443 331 1HD1 ILE 37 1HD1 ILE 37 10.635 1.207 -2.774 332 2HD1 ILE 37 2HD1 ILE 37 10.096 1.008 -1.106 333 3HD1 ILE 37 3HD1 ILE 37 8.913 1.096 -2.412 334 H ASN 38 H ASN 38 6.880 -1.610 -5.906 335 HA ASN 38 HA ASN 38 6.919 1.242 -6.641 336 1HB ASN 38 2HB ASN 38 5.447 -0.993 -8.047 337 2HB ASN 38 1HB ASN 38 5.654 0.661 -8.614 338 1HD2 ASN 38 1HD2 ASN 38 7.330 -2.337 -7.901 339 2HD2 ASN 38 2HD2 ASN 38 8.669 -2.059 -8.958 340 H SER 39 H SER 39 4.620 2.058 -7.190 341 HA SER 39 HA SER 39 2.419 1.002 -5.727 342 1HB SER 39 2HB SER 39 3.279 1.824 -3.728 343 2HB SER 39 1HB SER 39 4.045 3.206 -4.509 344 HG SER 39 HG SER 39 1.296 2.822 -3.947 345 H ALA 40 H ALA 40 0.619 1.656 -6.741 346 HA ALA 40 HA ALA 40 0.284 4.326 -7.727 347 1HB ALA 40 1HB ALA 40 0.413 4.030 -10.003 348 2HB ALA 40 2HB ALA 40 0.162 2.287 -9.900 349 3HB ALA 40 3HB ALA 40 1.720 2.982 -9.452 350 H GLY 41 H GLY 41 -1.811 4.444 -9.092 351 1HA GLY 41 2HA GLY 41 -3.832 2.933 -7.621 352 2HA GLY 41 1HA GLY 41 -4.118 4.349 -8.623 353 H THR 42 H THR 42 -5.852 2.346 -8.942 354 HA THR 42 HA THR 42 -5.121 0.345 -10.792 355 HB THR 42 HB THR 42 -7.912 1.438 -10.617 356 HG1 THR 42 1HG THR 42 -7.103 -0.541 -8.815 357 1HG2 THR 42 1HG2 THR 42 -7.388 -1.450 -10.536 358 2HG2 THR 42 2HG2 THR 42 -6.848 -0.650 -12.013 359 3HG2 THR 42 3HG2 THR 42 -8.535 -0.532 -11.513 360 H SER 43 H SER 43 -6.713 3.501 -11.275 361 HA SER 43 HA SER 43 -6.000 3.286 -14.127 362 1HB SER 43 2HB SER 43 -8.555 3.246 -13.238 363 2HB SER 43 1HB SER 43 -8.321 4.983 -13.438 364 HG SER 43 HG SER 43 -7.304 3.905 -15.578 365 H GLY 44 H GLY 44 -5.246 4.837 -11.381 366 1HA GLY 44 2HA GLY 44 -4.147 6.796 -10.913 367 2HA GLY 44 1HA GLY 44 -3.803 6.891 -12.632 368 H GLU 45 H GLU 45 -7.104 6.798 -11.576 369 HA GLU 45 HA GLU 45 -7.825 9.151 -12.897 370 1HB GLU 45 2HB GLU 45 -9.394 8.272 -10.512 371 2HB GLU 45 1HB GLU 45 -9.962 8.810 -12.086 372 1HG GLU 45 2HG GLU 45 -10.303 6.692 -12.614 373 2HG GLU 45 1HG GLU 45 -8.558 6.451 -12.580 374 H HIS 46 H HIS 46 -7.886 8.703 -9.369 375 HA HIS 46 HA HIS 46 -7.071 11.520 -9.084 376 1HB HIS 46 2HB HIS 46 -8.198 11.262 -6.771 377 2HB HIS 46 1HB HIS 46 -9.234 11.428 -8.185 378 HD1 HIS 46 1HD HIS 46 -8.473 9.195 -5.376 379 HD2 HIS 46 2HD HIS 46 -10.456 8.943 -9.018 380 HE1 HIS 46 1HE HIS 46 -9.857 7.101 -5.243 381 HE2 HIS 46 2HE HIS 46 -11.023 6.949 -7.472 382 H ASP 47 H ASP 47 -6.546 8.227 -8.165 383 HA ASP 47 HA ASP 47 -5.036 8.291 -5.912 384 1HB ASP 47 2HB ASP 47 -3.773 6.639 -7.982 385 2HB ASP 47 1HB ASP 47 -4.486 6.164 -6.440 386 H GLY 48 H GLY 48 -3.319 9.429 -5.276 387 1HA GLY 48 2HA GLY 48 -0.874 9.694 -5.804 388 2HA GLY 48 1HA GLY 48 -1.418 10.335 -7.345 389 H GLU 49 H GLU 49 -3.616 11.383 -5.147 390 HA GLU 49 HA GLU 49 -2.689 14.065 -5.243 391 1HB GLU 49 2HB GLU 49 -4.991 12.649 -3.992 392 2HB GLU 49 1HB GLU 49 -4.584 14.247 -3.379 393 1HG GLU 49 2HG GLU 49 -4.934 13.774 -6.313 394 2HG GLU 49 1HG GLU 49 -6.325 14.033 -5.260 395 H GLY 50 H GLY 50 -3.346 12.062 -2.355 396 1HA GLY 50 2HA GLY 50 -1.054 11.986 -1.022 397 2HA GLY 50 1HA GLY 50 -1.445 13.691 -0.851 398 H MET 51 H MET 51 -1.779 13.722 1.328 399 HA MET 51 HA MET 51 -3.056 11.847 2.899 400 1HB MET 51 2HB MET 51 -3.680 13.989 4.307 401 2HB MET 51 1HB MET 51 -2.015 13.442 4.170 402 1HG MET 51 2HG MET 51 -2.041 15.798 3.877 403 2HG MET 51 1HG MET 51 -1.704 15.062 2.311 404 1HE MET 51 1HE MET 51 -3.552 15.903 0.002 405 2HE MET 51 2HE MET 51 -2.085 16.473 0.797 406 3HE MET 51 3HE MET 51 -3.431 17.579 0.534 407 H HIS 52 H HIS 52 -5.151 12.051 4.036 408 HA HIS 52 HA HIS 52 -7.266 13.084 2.267 409 1HB HIS 52 2HB HIS 52 -6.804 10.451 2.539 410 2HB HIS 52 1HB HIS 52 -7.858 10.692 3.926 411 HD1 HIS 52 1HD HIS 52 -8.156 12.291 0.498 412 HD2 HIS 52 2HD HIS 52 -10.212 9.694 3.005 413 HE1 HIS 52 1HE HIS 52 -10.354 11.855 -0.643 414 HE2 HIS 52 2HE HIS 52 -11.621 10.366 0.944 415 H TYR 53 H TYR 53 -9.441 12.479 3.859 416 HA TYR 53 HA TYR 53 -9.675 14.643 5.533 417 1HB TYR 53 2HB TYR 53 -11.377 12.736 4.681 418 2HB TYR 53 1HB TYR 53 -11.172 12.221 6.349 419 HD1 TYR 53 1HD TYR 53 -10.785 15.146 7.395 420 HD2 TYR 53 2HD TYR 53 -13.709 13.273 4.936 421 HE1 TYR 53 1HE TYR 53 -12.445 16.814 8.109 422 HE2 TYR 53 2HE TYR 53 -15.375 14.938 5.641 423 HH TYR 53 HH TYR 53 -14.575 17.450 8.017 424 H GLY 54 H GLY 54 -9.552 11.324 6.811 425 1HA GLY 54 2HA GLY 54 -8.572 12.333 9.344 426 2HA GLY 54 1HA GLY 54 -9.024 10.675 8.984 427 H THR 55 H THR 55 -7.210 10.797 6.537 428 HA THR 55 HA THR 55 -4.987 9.560 7.684 429 HB THR 55 HB THR 55 -5.000 10.978 5.014 430 HG1 THR 55 1HG THR 55 -6.674 9.603 4.828 431 1HG2 THR 55 1HG2 THR 55 -3.268 9.494 4.387 432 2HG2 THR 55 2HG2 THR 55 -3.511 8.489 5.816 433 3HG2 THR 55 3HG2 THR 55 -2.821 10.103 5.981 434 H LYS 56 H LYS 56 -5.293 12.871 6.394 435 HA LYS 56 HA LYS 56 -2.704 13.743 7.005 436 1HB LYS 56 2HB LYS 56 -4.139 15.030 5.538 437 2HB LYS 56 1HB LYS 56 -5.302 15.286 6.831 438 1HG LYS 56 2HG LYS 56 -3.391 16.474 8.054 439 2HG LYS 56 1HG LYS 56 -2.586 16.499 6.484 440 1HD LYS 56 2HD LYS 56 -5.369 17.380 6.381 441 2HD LYS 56 1HD LYS 56 -4.351 18.389 7.410 442 1HE LYS 56 2HE LYS 56 -2.754 18.046 5.234 443 2HE LYS 56 1HE LYS 56 -4.355 18.058 4.495 444 1HZ LYS 56 1HZ LYS 56 -3.212 20.275 4.740 445 2HZ LYS 56 2HZ LYS 56 -3.481 20.144 6.405 446 3HZ LYS 56 3HZ LYS 56 -4.793 20.189 5.339 447 H ASN 57 H ASN 57 -5.601 13.518 8.961 448 HA ASN 57 HA ASN 57 -4.795 15.076 11.147 449 1HB ASN 57 2HB ASN 57 -6.851 14.512 11.853 450 2HB ASN 57 1HB ASN 57 -6.987 13.421 10.476 451 1HD2 ASN 57 1HD2 ASN 57 -6.031 13.653 13.846 452 2HD2 ASN 57 2HD2 ASN 57 -6.211 11.971 14.201 453 H LYS 58 H LYS 58 -4.483 11.602 10.543 454 HA LYS 58 HA LYS 58 -3.213 10.891 12.925 455 1HB LYS 58 2HB LYS 58 -4.083 9.577 10.681 456 2HB LYS 58 1HB LYS 58 -2.337 9.418 10.541 457 1HG LYS 58 2HG LYS 58 -3.549 8.811 13.172 458 2HG LYS 58 1HG LYS 58 -3.830 7.670 11.855 459 1HD LYS 58 2HD LYS 58 -1.797 6.831 12.132 460 2HD LYS 58 1HD LYS 58 -1.088 8.418 11.821 461 1HE LYS 58 2HE LYS 58 -1.934 7.247 14.460 462 2HE LYS 58 1HE LYS 58 -0.312 7.709 13.945 463 1HZ LYS 58 1HZ LYS 58 -1.774 9.994 13.686 464 2HZ LYS 58 2HZ LYS 58 -0.718 9.633 14.954 465 3HZ LYS 58 3HZ LYS 58 -2.371 9.310 15.113 466 H LEU 59 H LEU 59 -1.903 11.945 9.837 467 HA LEU 59 HA LEU 59 0.826 11.624 10.504 468 1HB LEU 59 2HB LEU 59 -0.564 13.312 8.431 469 2HB LEU 59 1HB LEU 59 1.182 13.235 8.579 470 HG LEU 59 HG LEU 59 -0.161 10.621 8.363 471 1HD1 LEU 59 1HD1 LEU 59 -1.227 10.891 6.434 472 2HD1 LEU 59 2HD1 LEU 59 0.149 11.732 5.720 473 3HD1 LEU 59 3HD1 LEU 59 -1.047 12.632 6.654 474 1HD2 LEU 59 1HD2 LEU 59 1.827 11.010 6.417 475 2HD2 LEU 59 2HD2 LEU 59 1.954 10.112 7.928 476 3HD2 LEU 59 3HD2 LEU 59 2.395 11.817 7.878 477 H ALA 60 H ALA 60 -1.275 14.497 10.478 478 HA ALA 60 HA ALA 60 0.558 16.397 11.290 479 1HB ALA 60 1HB ALA 60 -1.209 17.770 11.403 480 2HB ALA 60 2HB ALA 60 -2.077 16.719 12.522 481 3HB ALA 60 3HB ALA 60 -2.125 16.393 10.789 482 H GLN 61 H GLN 61 -1.115 13.969 13.182 483 HA GLN 61 HA GLN 61 -0.755 14.940 15.750 484 1HB GLN 61 2HB GLN 61 -0.847 12.159 14.626 485 2HB GLN 61 1HB GLN 61 -0.563 12.419 16.342 486 1HG GLN 61 2HG GLN 61 -2.744 14.010 15.825 487 2HG GLN 61 1HG GLN 61 -3.021 12.598 14.806 488 1HE2 GLN 61 1HE2 GLN 61 -1.824 10.648 16.389 489 2HE2 GLN 61 2HE2 GLN 61 -2.760 10.447 17.827 490 H LEU 62 H LEU 62 1.463 12.820 13.920 491 HA LEU 62 HA LEU 62 3.691 13.951 15.448 492 1HB LEU 62 2HB LEU 62 4.154 11.144 15.026 493 2HB LEU 62 1HB LEU 62 4.222 12.070 16.514 494 HG LEU 62 HG LEU 62 1.531 11.788 16.207 495 1HD1 LEU 62 1HD1 LEU 62 1.763 10.351 14.261 496 2HD1 LEU 62 2HD1 LEU 62 1.111 9.445 15.627 497 3HD1 LEU 62 3HD1 LEU 62 2.805 9.260 15.172 498 1HD2 LEU 62 1HD2 LEU 62 2.079 11.207 18.295 499 2HD2 LEU 62 2HD2 LEU 62 3.649 10.573 17.801 500 3HD2 LEU 62 3HD2 LEU 62 2.209 9.564 17.665 501 H ASN 63 H ASN 63 2.657 11.921 12.747 502 HA ASN 63 HA ASN 63 5.140 11.897 11.393 503 1HB ASN 63 2HB ASN 63 2.421 11.626 10.100 504 2HB ASN 63 1HB ASN 63 3.953 10.943 9.556 505 1HD2 ASN 63 1HD2 ASN 63 1.133 10.341 11.204 506 2HD2 ASN 63 2HD2 ASN 63 1.594 8.883 12.008 507 H ILE 64 H ILE 64 4.634 12.657 8.812 508 HA ILE 64 HA ILE 64 4.759 15.562 9.044 509 HB ILE 64 HB ILE 64 5.154 14.042 6.488 510 1HG1 ILE 64 2HG1 ILE 64 6.533 12.895 8.157 511 2HG1 ILE 64 1HG1 ILE 64 7.542 13.803 7.037 512 1HG2 ILE 64 1HG2 ILE 64 6.094 15.934 5.703 513 2HG2 ILE 64 2HG2 ILE 64 6.854 16.326 7.246 514 3HG2 ILE 64 3HG2 ILE 64 5.146 16.684 6.987 515 1HD1 ILE 64 1HD1 ILE 64 8.304 15.183 8.641 516 2HD1 ILE 64 2HD1 ILE 64 7.857 13.842 9.694 517 3HD1 ILE 64 3HD1 ILE 64 6.764 15.213 9.501 518 H GLU 65 H GLU 65 3.324 16.957 8.116 519 HA GLU 65 HA GLU 65 0.708 16.063 7.634 520 1HB GLU 65 2HB GLU 65 1.758 18.449 8.260 521 2HB GLU 65 1HB GLU 65 1.504 18.697 6.538 522 1HG GLU 65 2HG GLU 65 -0.797 18.490 6.717 523 2HG GLU 65 1HG GLU 65 -0.700 17.644 8.261 524 H HIS 66 H HIS 66 3.292 15.712 5.677 525 HA HIS 66 HA HIS 66 1.902 14.719 3.494 526 1HB HIS 66 2HB HIS 66 2.371 16.500 1.786 527 2HB HIS 66 1HB HIS 66 1.143 16.937 2.969 528 HD1 HIS 66 1HD HIS 66 1.726 18.817 4.645 529 HD2 HIS 66 2HD HIS 66 4.722 18.011 1.882 530 HE1 HIS 66 1HE HIS 66 3.339 20.739 4.822 531 HE2 HIS 66 2HE HIS 66 5.100 20.270 3.084 532 H LYS 67 H LYS 67 3.239 13.813 1.943 533 HA LYS 67 HA LYS 67 5.938 14.459 1.533 534 1HB LYS 67 2HB LYS 67 5.612 13.188 3.955 535 2HB LYS 67 1HB LYS 67 6.027 11.861 2.878 536 1HG LYS 67 2HG LYS 67 8.130 12.444 3.398 537 2HG LYS 67 1HG LYS 67 7.889 13.665 2.147 538 1HD LYS 67 2HD LYS 67 7.058 15.194 3.984 539 2HD LYS 67 1HD LYS 67 7.658 13.996 5.131 540 1HE LYS 67 2HE LYS 67 9.289 15.783 4.761 541 2HE LYS 67 1HE LYS 67 9.905 14.223 4.217 542 1HZ LYS 67 1HZ LYS 67 10.364 15.274 2.324 543 2HZ LYS 67 2HZ LYS 67 9.403 16.611 2.712 544 3HZ LYS 67 3HZ LYS 67 8.702 15.244 2.006 545 H ASN 68 H ASN 68 6.533 13.613 -0.356 546 HA ASN 68 HA ASN 68 6.475 12.427 -2.291 547 1HB ASN 68 2HB ASN 68 5.905 10.286 -0.255 548 2HB ASN 68 1HB ASN 68 6.010 9.911 -1.973 549 1HD2 ASN 68 1HD2 ASN 68 7.787 8.546 -1.271 550 2HD2 ASN 68 2HD2 ASN 68 9.359 9.241 -1.092 551 H PHE 69 H PHE 69 4.591 13.770 -2.864 552 HA PHE 69 HA PHE 69 2.150 12.132 -3.143 553 1HB PHE 69 2HB PHE 69 2.446 15.114 -2.754 554 2HB PHE 69 1HB PHE 69 0.956 14.374 -3.322 555 HD1 PHE 69 1HD PHE 69 2.090 11.965 -1.215 556 HD2 PHE 69 2HD PHE 69 0.650 15.967 -1.065 557 HE1 PHE 69 1HE PHE 69 1.384 11.619 1.115 558 HE2 PHE 69 2HE PHE 69 -0.056 15.627 1.265 559 HZ PHE 69 HZ PHE 69 0.310 13.452 2.359 560 H THR 70 H THR 70 2.407 11.309 -5.167 561 HA THR 70 HA THR 70 2.444 13.242 -7.364 562 HB THR 70 HB THR 70 4.253 10.819 -7.273 563 HG1 THR 70 1HG THR 70 5.384 13.280 -7.683 564 1HG2 THR 70 1HG2 THR 70 3.405 12.657 -9.443 565 2HG2 THR 70 2HG2 THR 70 3.868 10.956 -9.515 566 3HG2 THR 70 3HG2 THR 70 5.109 12.203 -9.393 567 H SER 71 H SER 71 0.934 12.813 -8.832 568 HA SER 71 HA SER 71 -0.922 10.753 -8.577 569 1HB SER 71 2HB SER 71 -1.144 11.433 -11.219 570 2HB SER 71 1HB SER 71 -1.878 12.328 -9.891 571 HG SER 71 HG SER 71 0.767 12.914 -10.577 572 H LYS 72 H LYS 72 -0.772 8.649 -8.976 573 HA LYS 72 HA LYS 72 1.115 7.753 -11.049 574 1HB LYS 72 2HB LYS 72 0.867 5.572 -9.415 575 2HB LYS 72 1HB LYS 72 2.199 6.717 -9.380 576 1HG LYS 72 2HG LYS 72 0.269 7.894 -7.784 577 2HG LYS 72 1HG LYS 72 0.165 6.176 -7.396 578 1HD LYS 72 2HD LYS 72 2.674 6.206 -7.127 579 2HD LYS 72 1HD LYS 72 2.583 7.965 -7.238 580 1HE LYS 72 2HE LYS 72 0.707 7.520 -5.363 581 2HE LYS 72 1HE LYS 72 1.775 6.152 -5.051 582 1HZ LYS 72 1HZ LYS 72 3.599 7.622 -4.710 583 2HZ LYS 72 2HZ LYS 72 2.315 8.185 -3.764 584 3HZ LYS 72 3HZ LYS 72 2.702 8.967 -5.213 585 H LYS 73 H LYS 73 0.521 6.000 -12.336 586 HA LYS 73 HA LYS 73 -2.220 5.003 -12.059 587 1HB LYS 73 2HB LYS 73 -1.799 5.332 -14.826 588 2HB LYS 73 1HB LYS 73 -2.955 6.179 -13.808 589 1HG LYS 73 2HG LYS 73 -0.747 7.614 -13.279 590 2HG LYS 73 1HG LYS 73 -0.387 7.090 -14.926 591 1HD LYS 73 2HD LYS 73 -2.770 7.883 -15.479 592 2HD LYS 73 1HD LYS 73 -2.695 8.733 -13.934 593 1HE LYS 73 2HE LYS 73 -0.638 9.868 -14.701 594 2HE LYS 73 1HE LYS 73 -0.808 9.068 -16.264 595 1HZ LYS 73 1HZ LYS 73 -1.760 11.155 -16.566 596 2HZ LYS 73 2HZ LYS 73 -2.537 11.141 -15.065 597 3HZ LYS 73 3HZ LYS 73 -3.098 10.149 -16.314 598 H LEU 74 H LEU 74 -1.498 2.966 -11.513 599 HA LEU 74 HA LEU 74 0.576 1.535 -12.698 600 1HB LEU 74 2HB LEU 74 -0.168 0.541 -10.771 601 2HB LEU 74 1HB LEU 74 -1.855 0.836 -11.137 602 HG LEU 74 HG LEU 74 -1.513 -0.979 -12.977 603 1HD1 LEU 74 1HD1 LEU 74 1.055 -0.933 -11.818 604 2HD1 LEU 74 2HD1 LEU 74 0.436 -2.029 -13.054 605 3HD1 LEU 74 3HD1 LEU 74 0.304 -2.457 -11.348 606 1HD2 LEU 74 1HD2 LEU 74 -1.928 -2.757 -11.214 607 2HD2 LEU 74 2HD2 LEU 74 -3.026 -1.377 -11.217 608 3HD2 LEU 74 3HD2 LEU 74 -1.734 -1.473 -10.021 609 H THR 75 H THR 75 0.830 0.718 -14.678 610 HA THR 75 HA THR 75 -1.574 0.066 -16.255 611 HB THR 75 HB THR 75 0.395 0.694 -18.126 612 HG1 THR 75 1HG THR 75 1.136 2.727 -17.498 613 1HG2 THR 75 1HG2 THR 75 -1.327 1.830 -18.986 614 2HG2 THR 75 2HG2 THR 75 -1.397 2.910 -17.593 615 3HG2 THR 75 3HG2 THR 75 -2.242 1.363 -17.551 616 H GLN 76 H GLN 76 -0.550 -1.080 -18.430 617 HA GLN 76 HA GLN 76 0.173 -3.652 -17.591 618 1HB GLN 76 2HB GLN 76 -0.792 -2.685 -19.878 619 2HB GLN 76 1HB GLN 76 0.903 -2.762 -20.339 620 1HG GLN 76 2HG GLN 76 0.399 -5.214 -19.145 621 2HG GLN 76 1HG GLN 76 -1.044 -4.878 -20.099 622 1HE2 GLN 76 1HE2 GLN 76 -0.092 -3.571 -22.248 623 2HE2 GLN 76 2HE2 GLN 76 0.988 -4.577 -23.147 624 H LYS 77 H LYS 77 2.128 -1.006 -18.897 625 HA LYS 77 HA LYS 77 4.572 -2.354 -19.070 626 1HB LYS 77 2HB LYS 77 3.861 0.013 -19.897 627 2HB LYS 77 1HB LYS 77 4.414 0.544 -18.315 628 1HG LYS 77 2HG LYS 77 6.600 0.169 -18.798 629 2HG LYS 77 1HG LYS 77 6.245 -1.168 -19.893 630 1HD LYS 77 2HD LYS 77 6.511 0.221 -21.607 631 2HD LYS 77 1HD LYS 77 5.106 1.130 -21.048 632 1HE LYS 77 2HE LYS 77 6.416 2.666 -19.878 633 2HE LYS 77 1HE LYS 77 7.821 1.601 -19.869 634 1HZ LYS 77 1HZ LYS 77 6.719 2.751 -22.365 635 2HZ LYS 77 2HZ LYS 77 8.229 2.026 -22.129 636 3HZ LYS 77 3HZ LYS 77 7.902 3.540 -21.449 637 H LEU 78 H LEU 78 3.027 -0.701 -16.368 638 HA LEU 78 HA LEU 78 5.260 -0.806 -14.620 639 1HB LEU 78 2HB LEU 78 2.779 0.380 -14.575 640 2HB LEU 78 1HB LEU 78 2.631 -0.854 -13.338 641 HG LEU 78 HG LEU 78 4.964 0.188 -12.568 642 1HD1 LEU 78 1HD1 LEU 78 4.506 2.756 -12.790 643 2HD1 LEU 78 2HD1 LEU 78 3.658 2.266 -14.257 644 3HD1 LEU 78 3HD1 LEU 78 5.368 1.884 -14.057 645 1HD2 LEU 78 1HD2 LEU 78 3.815 1.011 -10.792 646 2HD2 LEU 78 2HD2 LEU 78 2.518 0.069 -11.526 647 3HD2 LEU 78 3HD2 LEU 78 2.606 1.808 -11.798 648 H CYS 79 H CYS 79 2.309 -2.792 -14.812 649 HA CYS 79 HA CYS 79 2.941 -4.579 -12.767 650 1HB CYS 79 2HB CYS 79 0.725 -4.649 -13.518 651 2HB CYS 79 1HB CYS 79 1.201 -4.776 -15.207 652 HG CYS 79 HG CYS 79 2.367 -7.399 -13.657 653 H ASP 80 H ASP 80 3.679 -4.726 -16.226 654 HA ASP 80 HA ASP 80 4.846 -7.283 -16.236 655 1HB ASP 80 2HB ASP 80 4.126 -5.992 -18.261 656 2HB ASP 80 1HB ASP 80 5.550 -4.975 -18.056 657 H GLU 81 H GLU 81 5.997 -4.286 -15.035 658 HA GLU 81 HA GLU 81 8.799 -4.932 -15.228 659 1HB GLU 81 2HB GLU 81 7.176 -2.665 -14.271 660 2HB GLU 81 1HB GLU 81 8.680 -2.921 -13.397 661 1HG GLU 81 2HG GLU 81 9.986 -2.473 -15.237 662 2HG GLU 81 1HG GLU 81 8.701 -2.869 -16.376 663 H SER 82 H SER 82 6.575 -4.471 -12.468 664 HA SER 82 HA SER 82 8.343 -5.508 -10.537 665 1HB SER 82 2HB SER 82 5.323 -5.310 -10.517 666 2HB SER 82 1HB SER 82 6.310 -5.694 -9.107 667 HG SER 82 HG SER 82 6.276 -3.293 -10.610 668 H ASP 83 H ASP 83 7.629 -7.475 -9.147 669 HA ASP 83 HA ASP 83 7.156 -9.730 -10.984 670 1HB ASP 83 2HB ASP 83 9.399 -9.355 -9.578 671 2HB ASP 83 1HB ASP 83 8.455 -10.189 -8.348 672 H PHE 84 H PHE 84 6.340 -8.313 -7.882 673 HA PHE 84 HA PHE 84 4.211 -10.329 -7.591 674 1HB PHE 84 2HB PHE 84 6.068 -9.127 -5.605 675 2HB PHE 84 1HB PHE 84 4.410 -9.402 -5.081 676 HD1 PHE 84 1HD PHE 84 3.450 -11.753 -5.411 677 HD2 PHE 84 2HD PHE 84 7.608 -10.863 -5.592 678 HE1 PHE 84 1HE PHE 84 3.971 -14.121 -4.995 679 HE2 PHE 84 2HE PHE 84 8.136 -13.231 -5.178 680 HZ PHE 84 HZ PHE 84 6.316 -14.863 -4.880 681 H LEU 85 H LEU 85 2.170 -9.628 -7.518 682 HA LEU 85 HA LEU 85 1.726 -6.722 -7.480 683 1HB LEU 85 2HB LEU 85 0.649 -8.894 -9.041 684 2HB LEU 85 1HB LEU 85 -0.644 -8.039 -8.221 685 HG LEU 85 HG LEU 85 0.564 -5.911 -9.199 686 1HD1 LEU 85 1HD1 LEU 85 2.068 -6.196 -10.820 687 2HD1 LEU 85 2HD1 LEU 85 1.143 -7.497 -11.570 688 3HD1 LEU 85 3HD1 LEU 85 2.220 -7.847 -10.219 689 1HD2 LEU 85 1HD2 LEU 85 -1.165 -7.794 -10.800 690 2HD2 LEU 85 2HD2 LEU 85 -0.868 -6.105 -11.209 691 3HD2 LEU 85 3HD2 LEU 85 -1.711 -6.515 -9.715 692 H ILE 86 H ILE 86 0.572 -5.787 -5.894 693 HA ILE 86 HA ILE 86 -0.904 -7.542 -4.044 694 HB ILE 86 HB ILE 86 0.673 -5.107 -3.211 695 1HG1 ILE 86 2HG1 ILE 86 2.192 -6.892 -3.917 696 2HG1 ILE 86 1HG1 ILE 86 2.248 -6.690 -2.170 697 1HG2 ILE 86 1HG2 ILE 86 0.151 -6.818 -1.045 698 2HG2 ILE 86 2HG2 ILE 86 -1.364 -6.662 -1.932 699 3HG2 ILE 86 3HG2 ILE 86 -0.530 -5.220 -1.350 700 1HD1 ILE 86 1HD1 ILE 86 0.330 -8.694 -3.127 701 2HD1 ILE 86 2HD1 ILE 86 1.473 -8.758 -1.786 702 3HD1 ILE 86 3HD1 ILE 86 2.026 -9.063 -3.432 703 H THR 87 H THR 87 -2.947 -6.974 -3.681 704 HA THR 87 HA THR 87 -3.900 -4.434 -4.776 705 HB THR 87 HB THR 87 -6.171 -5.685 -4.011 706 HG1 THR 87 1HG THR 87 -5.272 -7.952 -5.018 707 1HG2 THR 87 1HG2 THR 87 -6.563 -5.686 -6.218 708 2HG2 THR 87 2HG2 THR 87 -5.206 -6.764 -6.544 709 3HG2 THR 87 3HG2 THR 87 -4.935 -5.029 -6.384 710 H MET 88 H MET 88 -4.628 -6.417 -1.895 711 HA MET 88 HA MET 88 -4.872 -5.880 0.290 712 1HB MET 88 2HB MET 88 -3.588 -4.233 1.084 713 2HB MET 88 1HB MET 88 -3.175 -3.872 -0.584 714 1HG MET 88 2HG MET 88 -5.415 -2.451 -0.413 715 2HG MET 88 1HG MET 88 -4.958 -2.439 1.289 716 1HE MET 88 1HE MET 88 -2.599 -0.671 2.116 717 2HE MET 88 2HE MET 88 -1.298 -1.217 1.058 718 3HE MET 88 3HE MET 88 -2.404 -2.390 1.773 719 H ASP 89 H ASP 89 -6.269 -3.620 -2.044 720 HA ASP 89 HA ASP 89 -8.513 -3.027 -0.325 721 1HB ASP 89 2HB ASP 89 -8.165 -2.387 -3.260 722 2HB ASP 89 1HB ASP 89 -9.327 -1.663 -2.154 723 H ASN 90 H ASN 90 -10.551 -3.854 -0.468 724 HA ASN 90 HA ASN 90 -10.886 -6.466 -1.388 725 1HB ASN 90 2HB ASN 90 -13.262 -4.684 -1.053 726 2HB ASN 90 1HB ASN 90 -13.032 -6.350 -0.536 727 1HD2 ASN 90 1HD2 ASN 90 -10.685 -6.186 0.852 728 2HD2 ASN 90 2HD2 ASN 90 -10.899 -5.189 2.246 729 H SER 91 H SER 91 -12.367 -3.501 -2.716 730 HA SER 91 HA SER 91 -13.475 -4.781 -4.969 731 1HB SER 91 2HB SER 91 -12.763 -1.866 -4.975 732 2HB SER 91 1HB SER 91 -14.180 -2.668 -5.656 733 HG SER 91 HG SER 91 -15.155 -2.410 -3.820 734 H ASN 92 H ASN 92 -10.314 -3.429 -4.388 735 HA ASN 92 HA ASN 92 -9.481 -3.008 -7.025 736 1HB ASN 92 2HB ASN 92 -8.259 -3.117 -4.419 737 2HB ASN 92 1HB ASN 92 -7.231 -3.914 -5.605 738 1HD2 ASN 92 1HD2 ASN 92 -6.070 -1.860 -4.636 739 2HD2 ASN 92 2HD2 ASN 92 -6.154 -0.466 -5.652 740 H PHE 93 H PHE 93 -9.452 -5.939 -5.053 741 HA PHE 93 HA PHE 93 -7.906 -7.540 -6.751 742 1HB PHE 93 2HB PHE 93 -8.444 -8.175 -4.445 743 2HB PHE 93 1HB PHE 93 -10.137 -8.368 -4.884 744 HD1 PHE 93 1HD PHE 93 -6.874 -9.531 -6.290 745 HD2 PHE 93 2HD PHE 93 -10.794 -10.553 -4.985 746 HE1 PHE 93 1HE PHE 93 -6.450 -11.884 -6.872 747 HE2 PHE 93 2HE PHE 93 -10.377 -12.907 -5.565 748 HZ PHE 93 HZ PHE 93 -8.203 -13.576 -6.508 749 H LYS 94 H LYS 94 -11.451 -7.253 -6.537 750 HA LYS 94 HA LYS 94 -12.020 -9.032 -8.631 751 1HB LYS 94 2HB LYS 94 -13.695 -8.321 -6.991 752 2HB LYS 94 1HB LYS 94 -13.647 -6.686 -7.637 753 1HG LYS 94 2HG LYS 94 -14.550 -7.447 -9.742 754 2HG LYS 94 1HG LYS 94 -14.499 -9.122 -9.188 755 1HD LYS 94 2HD LYS 94 -16.413 -8.911 -8.042 756 2HD LYS 94 1HD LYS 94 -15.943 -7.346 -7.377 757 1HE LYS 94 2HE LYS 94 -16.834 -7.664 -10.228 758 2HE LYS 94 1HE LYS 94 -17.985 -7.416 -8.915 759 1HZ LYS 94 1HZ LYS 94 -15.905 -5.575 -9.916 760 2HZ LYS 94 2HZ LYS 94 -16.535 -5.401 -8.356 761 3HZ LYS 94 3HZ LYS 94 -17.559 -5.290 -9.698 762 H ASN 95 H ASN 95 -11.309 -5.586 -8.624 763 HA ASN 95 HA ASN 95 -12.094 -5.079 -11.297 764 1HB ASN 95 2HB ASN 95 -11.147 -3.564 -9.152 765 2HB ASN 95 1HB ASN 95 -9.914 -3.384 -10.398 766 1HD2 ASN 95 1HD2 ASN 95 -13.440 -3.715 -10.538 767 2HD2 ASN 95 2HD2 ASN 95 -13.714 -2.260 -11.428 768 H VAL 96 H VAL 96 -8.819 -5.430 -9.916 769 HA VAL 96 HA VAL 96 -7.464 -5.470 -12.370 770 HB VAL 96 HB VAL 96 -5.568 -6.418 -11.147 771 1HG1 VAL 96 1HG1 VAL 96 -5.605 -4.691 -9.206 772 2HG1 VAL 96 2HG1 VAL 96 -7.127 -4.176 -9.931 773 3HG1 VAL 96 3HG1 VAL 96 -5.639 -4.123 -10.874 774 1HG2 VAL 96 1HG2 VAL 96 -6.742 -6.445 -8.509 775 2HG2 VAL 96 2HG2 VAL 96 -5.784 -7.680 -9.325 776 3HG2 VAL 96 3HG2 VAL 96 -7.529 -7.615 -9.569 777 H LEU 97 H LEU 97 -9.268 -7.899 -10.732 778 HA LEU 97 HA LEU 97 -8.151 -10.259 -11.605 779 1HB LEU 97 2HB LEU 97 -10.227 -9.760 -10.106 780 2HB LEU 97 1HB LEU 97 -11.123 -9.907 -11.605 781 HG LEU 97 HG LEU 97 -10.093 -12.202 -11.872 782 1HD1 LEU 97 1HD1 LEU 97 -8.410 -11.441 -9.894 783 2HD1 LEU 97 2HD1 LEU 97 -8.749 -13.117 -10.322 784 3HD1 LEU 97 3HD1 LEU 97 -9.605 -12.360 -8.980 785 1HD2 LEU 97 1HD2 LEU 97 -11.933 -11.547 -9.585 786 2HD2 LEU 97 2HD2 LEU 97 -11.591 -13.200 -10.095 787 3HD2 LEU 97 3HD2 LEU 97 -12.358 -12.073 -11.215 788 H LYS 98 H LYS 98 -10.784 -8.490 -13.266 789 HA LYS 98 HA LYS 98 -10.137 -9.998 -15.698 790 1HB LYS 98 2HB LYS 98 -12.582 -9.258 -14.470 791 2HB LYS 98 1HB LYS 98 -12.491 -8.407 -16.007 792 1HG LYS 98 2HG LYS 98 -11.712 -10.871 -16.775 793 2HG LYS 98 1HG LYS 98 -12.799 -11.276 -15.444 794 1HD LYS 98 2HD LYS 98 -14.340 -9.490 -16.664 795 2HD LYS 98 1HD LYS 98 -13.384 -9.994 -18.060 796 1HE LYS 98 2HE LYS 98 -14.902 -11.634 -18.243 797 2HE LYS 98 1HE LYS 98 -13.998 -12.391 -16.933 798 1HZ LYS 98 1HZ LYS 98 -16.648 -11.717 -16.898 799 2HZ LYS 98 2HZ LYS 98 -15.915 -10.519 -15.957 800 3HZ LYS 98 3HZ LYS 98 -15.707 -12.150 -15.559 801 H ASN 99 H ASN 99 -9.485 -7.009 -14.365 802 HA ASN 99 HA ASN 99 -9.695 -5.487 -16.821 803 1HB ASN 99 2HB ASN 99 -9.982 -4.598 -14.398 804 2HB ASN 99 1HB ASN 99 -8.223 -4.547 -14.379 805 1HD2 ASN 99 1HD2 ASN 99 -10.863 -3.656 -16.580 806 2HD2 ASN 99 2HD2 ASN 99 -10.224 -2.103 -16.988 807 H PHE 100 H PHE 100 -7.489 -7.682 -15.619 808 HA PHE 100 HA PHE 100 -5.370 -6.530 -17.308 809 1HB PHE 100 2HB PHE 100 -5.151 -7.720 -14.561 810 2HB PHE 100 1HB PHE 100 -3.779 -7.752 -15.664 811 HD1 PHE 100 1HD PHE 100 -5.932 -5.652 -13.598 812 HD2 PHE 100 2HD PHE 100 -2.651 -5.706 -16.309 813 HE1 PHE 100 1HE PHE 100 -5.346 -3.358 -12.928 814 HE2 PHE 100 2HE PHE 100 -2.058 -3.413 -15.641 815 HZ PHE 100 HZ PHE 100 -3.406 -2.236 -13.949 816 H THR 101 H THR 101 -3.602 -8.343 -17.638 817 HA THR 101 HA THR 101 -4.815 -10.344 -19.226 818 HB THR 101 HB THR 101 -2.094 -11.022 -18.550 819 HG1 THR 101 1HG THR 101 -1.308 -8.928 -19.508 820 1HG2 THR 101 1HG2 THR 101 -3.145 -9.785 -21.089 821 2HG2 THR 101 2HG2 THR 101 -3.404 -11.479 -20.668 822 3HG2 THR 101 3HG2 THR 101 -1.766 -10.867 -20.896 823 H ASN 102 H ASN 102 -3.426 -12.651 -18.832 824 HA ASN 102 HA ASN 102 -4.887 -13.872 -16.720 825 1HB ASN 102 2HB ASN 102 -2.600 -15.037 -18.318 826 2HB ASN 102 1HB ASN 102 -3.811 -15.934 -17.407 827 1HD2 ASN 102 1HD2 ASN 102 -3.007 -15.751 -20.325 828 2HD2 ASN 102 2HD2 ASN 102 -4.508 -15.536 -21.154 829 H THR 103 H THR 103 -2.490 -11.849 -16.303 830 HA THR 103 HA THR 103 -0.852 -13.423 -14.484 831 HB THR 103 HB THR 103 0.251 -11.765 -15.938 832 HG1 THR 103 1HG THR 103 1.630 -11.230 -14.371 833 1HG2 THR 103 1HG2 THR 103 -1.887 -10.115 -15.185 834 2HG2 THR 103 2HG2 THR 103 -0.509 -9.686 -16.199 835 3HG2 THR 103 3HG2 THR 103 -0.449 -9.394 -14.461 836 H GLN 104 H GLN 104 -3.802 -12.323 -14.190 837 HA GLN 104 HA GLN 104 -3.763 -10.663 -11.898 838 1HB GLN 104 2HB GLN 104 -6.087 -10.858 -11.881 839 2HB GLN 104 1HB GLN 104 -5.679 -11.085 -13.576 840 1HG GLN 104 2HG GLN 104 -5.738 -13.581 -12.086 841 2HG GLN 104 1HG GLN 104 -7.276 -12.720 -12.055 842 1HE2 GLN 104 1HE2 GLN 104 -4.863 -14.208 -14.096 843 2HE2 GLN 104 2HE2 GLN 104 -5.869 -14.383 -15.490 844 H ASN 105 H ASN 105 -3.093 -13.949 -12.298 845 HA ASN 105 HA ASN 105 -3.983 -14.809 -9.693 846 1HB ASN 105 2HB ASN 105 -2.009 -16.337 -11.359 847 2HB ASN 105 1HB ASN 105 -3.273 -16.947 -10.294 848 1HD2 ASN 105 1HD2 ASN 105 -2.412 -16.805 -13.381 849 2HD2 ASN 105 2HD2 ASN 105 -3.958 -16.785 -14.150 850 H LYS 106 H LYS 106 -1.463 -12.946 -10.737 851 HA LYS 106 HA LYS 106 0.443 -13.926 -8.746 852 1HB LYS 106 2HB LYS 106 0.893 -13.062 -11.258 853 2HB LYS 106 1HB LYS 106 1.076 -11.542 -10.393 854 1HG LYS 106 2HG LYS 106 3.149 -12.113 -9.886 855 2HG LYS 106 1HG LYS 106 2.527 -13.471 -8.945 856 1HD LYS 106 2HD LYS 106 3.159 -14.963 -10.492 857 2HD LYS 106 1HD LYS 106 2.530 -13.978 -11.815 858 1HE LYS 106 2HE LYS 106 5.177 -13.614 -10.415 859 2HE LYS 106 1HE LYS 106 4.936 -14.276 -12.031 860 1HZ LYS 106 1HZ LYS 106 5.599 -11.956 -12.113 861 2HZ LYS 106 2HZ LYS 106 4.262 -11.512 -11.177 862 3HZ LYS 106 3HZ LYS 106 4.034 -12.146 -12.728 863 H VAL 107 H VAL 107 -2.171 -12.303 -8.402 864 HA VAL 107 HA VAL 107 -1.034 -10.073 -6.856 865 HB VAL 107 HB VAL 107 -3.956 -10.314 -7.483 866 1HG1 VAL 107 1HG1 VAL 107 -3.845 -7.868 -7.359 867 2HG1 VAL 107 2HG1 VAL 107 -2.111 -7.966 -7.055 868 3HG1 VAL 107 3HG1 VAL 107 -3.251 -8.624 -5.881 869 1HG2 VAL 107 1HG2 VAL 107 -3.628 -10.099 -9.670 870 2HG2 VAL 107 2HG2 VAL 107 -1.880 -10.082 -9.439 871 3HG2 VAL 107 3HG2 VAL 107 -2.793 -8.574 -9.370 872 H LEU 108 H LEU 108 -1.554 -9.789 -4.713 873 HA LEU 108 HA LEU 108 -3.024 -12.003 -3.437 874 1HB LEU 108 2HB LEU 108 -0.447 -10.690 -2.746 875 2HB LEU 108 1HB LEU 108 -1.481 -11.188 -1.421 876 HG LEU 108 HG LEU 108 -1.506 -13.500 -2.489 877 1HD1 LEU 108 1HD1 LEU 108 1.066 -12.905 -3.786 878 2HD1 LEU 108 2HD1 LEU 108 -0.364 -12.284 -4.612 879 3HD1 LEU 108 3HD1 LEU 108 -0.225 -14.008 -4.266 880 1HD2 LEU 108 1HD2 LEU 108 0.504 -12.171 -0.899 881 2HD2 LEU 108 2HD2 LEU 108 1.192 -13.509 -1.818 882 3HD2 LEU 108 3HD2 LEU 108 -0.171 -13.792 -0.737 883 H LYS 109 H LYS 109 -4.281 -11.501 -1.591 884 HA LYS 109 HA LYS 109 -5.099 -8.678 -1.487 885 1HB LYS 109 2HB LYS 109 -6.648 -10.842 -1.977 886 2HB LYS 109 1HB LYS 109 -6.810 -10.734 -0.230 887 1HG LYS 109 2HG LYS 109 -7.886 -8.704 -0.318 888 2HG LYS 109 1HG LYS 109 -7.199 -8.289 -1.889 889 1HD LYS 109 2HD LYS 109 -9.249 -8.848 -2.644 890 2HD LYS 109 1HD LYS 109 -8.619 -10.494 -2.541 891 1HE LYS 109 2HE LYS 109 -9.723 -10.916 -0.528 892 2HE LYS 109 1HE LYS 109 -9.964 -9.201 -0.195 893 1HZ LYS 109 1HZ LYS 109 -11.982 -10.451 -0.937 894 2HZ LYS 109 2HZ LYS 109 -11.263 -10.605 -2.460 895 3HZ LYS 109 3HZ LYS 109 -11.627 -9.071 -1.849 896 H ILE 110 H ILE 110 -5.298 -7.606 0.454 897 HA ILE 110 HA ILE 110 -3.685 -8.638 2.619 898 HB ILE 110 HB ILE 110 -4.004 -6.138 1.681 899 1HG1 ILE 110 2HG1 ILE 110 -3.497 -6.456 4.617 900 2HG1 ILE 110 1HG1 ILE 110 -2.415 -7.223 3.457 901 1HG2 ILE 110 1HG2 ILE 110 -5.444 -4.799 2.881 902 2HG2 ILE 110 2HG2 ILE 110 -5.574 -5.948 4.213 903 3HG2 ILE 110 3HG2 ILE 110 -6.399 -6.270 2.687 904 1HD1 ILE 110 1HD1 ILE 110 -1.319 -5.270 3.635 905 2HD1 ILE 110 2HD1 ILE 110 -2.759 -4.383 4.137 906 3HD1 ILE 110 3HD1 ILE 110 -2.499 -4.748 2.432 907 H THR 111 H THR 111 -6.972 -8.647 1.782 908 HA THR 111 HA THR 111 -8.229 -8.477 4.280 909 HB THR 111 HB THR 111 -9.237 -10.337 2.152 910 HG1 THR 111 1HG THR 111 -8.643 -7.681 1.855 911 1HG2 THR 111 1HG2 THR 111 -11.393 -9.575 2.875 912 2HG2 THR 111 2HG2 THR 111 -10.669 -8.310 3.867 913 3HG2 THR 111 3HG2 THR 111 -10.461 -10.004 4.309 914 H ASP 112 H ASP 112 -6.506 -11.082 2.721 915 HA ASP 112 HA ASP 112 -7.406 -13.090 4.586 916 1HB ASP 112 2HB ASP 112 -5.564 -13.011 2.245 917 2HB ASP 112 1HB ASP 112 -5.338 -14.301 3.423 918 H PHE 113 H PHE 113 -4.854 -10.781 4.381 919 HA PHE 113 HA PHE 113 -3.300 -12.100 6.475 920 1HB PHE 113 2HB PHE 113 -2.705 -9.511 5.029 921 2HB PHE 113 1HB PHE 113 -1.602 -10.423 6.052 922 HD1 PHE 113 1HD PHE 113 -2.083 -9.584 2.835 923 HD2 PHE 113 2HD PHE 113 -1.680 -13.100 5.198 924 HE1 PHE 113 1HE PHE 113 -1.284 -10.815 0.859 925 HE2 PHE 113 2HE PHE 113 -0.879 -14.337 3.227 926 HZ PHE 113 HZ PHE 113 -0.681 -13.195 1.054 927 H SER 114 H SER 114 -5.770 -9.832 6.154 928 HA SER 114 HA SER 114 -5.054 -8.340 8.547 929 1HB SER 114 2HB SER 114 -6.106 -6.736 7.372 930 2HB SER 114 1HB SER 114 -6.821 -7.914 6.271 931 HG SER 114 HG SER 114 -8.509 -7.006 7.339 932 HA PRO 115 HA PRO 115 -7.462 -10.943 11.200 933 1HB PRO 115 2HB PRO 115 -7.739 -9.304 13.325 934 2HB PRO 115 1HB PRO 115 -6.191 -10.043 12.899 935 1HG PRO 115 2HG PRO 115 -7.188 -7.276 12.339 936 2HG PRO 115 1HG PRO 115 -5.588 -7.796 12.899 937 1HD PRO 115 2HD PRO 115 -6.130 -7.174 10.305 938 2HD PRO 115 1HD PRO 115 -4.890 -8.349 10.783 939 H SER 116 H SER 116 -9.172 -9.317 13.147 940 HA SER 116 HA SER 116 -11.610 -9.520 11.651 941 1HB SER 116 2HB SER 116 -11.397 -8.321 14.401 942 2HB SER 116 1HB SER 116 -12.721 -9.250 13.700 943 HG SER 116 HG SER 116 -10.167 -10.382 14.118 944 H LEU 117 H LEU 117 -9.603 -7.411 10.915 945 HA LEU 117 HA LEU 117 -10.689 -4.885 11.638 946 1HB LEU 117 2HB LEU 117 -8.679 -5.870 9.678 947 2HB LEU 117 1HB LEU 117 -9.349 -4.270 9.418 948 HG LEU 117 HG LEU 117 -8.027 -5.131 11.991 949 1HD1 LEU 117 1HD1 LEU 117 -6.017 -4.223 11.279 950 2HD1 LEU 117 2HD1 LEU 117 -6.771 -3.337 9.953 951 3HD1 LEU 117 3HD1 LEU 117 -6.586 -5.088 9.850 952 1HD2 LEU 117 1HD2 LEU 117 -8.498 -3.098 12.794 953 2HD2 LEU 117 2HD2 LEU 117 -9.704 -3.019 11.510 954 3HD2 LEU 117 3HD2 LEU 117 -8.111 -2.304 11.268 955 H ASN 118 H ASN 118 -10.938 -6.881 8.704 956 HA ASN 118 HA ASN 118 -12.372 -6.821 6.933 957 1HB ASN 118 2HB ASN 118 -13.872 -7.399 8.917 958 2HB ASN 118 1HB ASN 118 -14.391 -5.717 8.885 959 1HD2 ASN 118 1HD2 ASN 118 -13.649 -7.884 6.196 960 2HD2 ASN 118 2HD2 ASN 118 -15.225 -7.833 5.491 961 H TYR 119 H TYR 119 -10.766 -4.466 7.352 962 HA TYR 119 HA TYR 119 -12.175 -2.073 7.077 963 1HB TYR 119 2HB TYR 119 -10.133 -1.116 6.827 964 2HB TYR 119 1HB TYR 119 -9.567 -2.703 7.329 965 HD1 TYR 119 1HD TYR 119 -9.095 -4.405 5.381 966 HD2 TYR 119 2HD TYR 119 -9.337 -0.187 4.882 967 HE1 TYR 119 1HE TYR 119 -7.801 -4.582 3.290 968 HE2 TYR 119 2HE TYR 119 -8.054 -0.356 2.799 969 HH TYR 119 HH TYR 119 -6.518 -1.827 1.700 970 H ASP 120 H ASP 120 -12.236 -0.682 5.089 971 HA ASP 120 HA ASP 120 -12.768 -2.289 2.679 972 1HB ASP 120 2HB ASP 120 -14.419 0.136 3.246 973 2HB ASP 120 1HB ASP 120 -14.820 -1.295 2.301 974 H GLU 121 H GLU 121 -10.802 -1.707 1.754 975 HA GLU 121 HA GLU 121 -9.259 -0.433 0.659 976 1HB GLU 121 2HB GLU 121 -11.645 1.151 -0.269 977 2HB GLU 121 1HB GLU 121 -10.151 0.832 -1.140 978 1HG GLU 121 2HG GLU 121 -11.052 -0.958 -2.063 979 2HG GLU 121 1HG GLU 121 -11.338 -1.658 -0.471 980 H VAL 122 H VAL 122 -8.003 0.683 2.047 981 HA VAL 122 HA VAL 122 -7.118 2.388 3.234 982 HB VAL 122 HB VAL 122 -7.023 4.406 2.205 983 1HG1 VAL 122 1HG1 VAL 122 -7.302 4.195 -0.169 984 2HG1 VAL 122 2HG1 VAL 122 -8.463 2.885 0.040 985 3HG1 VAL 122 3HG1 VAL 122 -6.771 2.643 0.479 986 1HG2 VAL 122 1HG2 VAL 122 -8.868 5.634 2.477 987 2HG2 VAL 122 2HG2 VAL 122 -9.939 4.250 2.259 988 3HG2 VAL 122 3HG2 VAL 122 -9.289 5.092 0.853 989 HA PRO 123 HA PRO 123 -9.943 3.336 6.500 990 1HB PRO 123 2HB PRO 123 -8.002 4.945 7.844 991 2HB PRO 123 1HB PRO 123 -8.378 3.245 8.122 992 1HG PRO 123 2HG PRO 123 -5.988 4.186 7.101 993 2HG PRO 123 1HG PRO 123 -6.598 2.535 6.893 994 1HD PRO 123 2HD PRO 123 -6.712 4.852 5.001 995 2HD PRO 123 1HD PRO 123 -6.398 3.134 4.667 996 H ASP 124 H ASP 124 -9.121 5.894 7.997 997 HA ASP 124 HA ASP 124 -9.666 8.102 8.105 998 1HB ASP 124 2HB ASP 124 -9.065 9.224 6.263 999 2HB ASP 124 1HB ASP 124 -9.132 7.735 5.325 1000 HA PRO 125 HA PRO 125 -13.954 8.058 9.002 1001 1HB PRO 125 2HB PRO 125 -14.583 10.705 8.381 1002 2HB PRO 125 1HB PRO 125 -13.971 10.121 9.931 1003 1HG PRO 125 2HG PRO 125 -12.496 11.374 7.655 1004 2HG PRO 125 1HG PRO 125 -12.264 11.589 9.400 1005 1HD PRO 125 2HD PRO 125 -10.596 10.069 7.984 1006 2HD PRO 125 1HD PRO 125 -11.103 9.581 9.617 1007 H TRP 126 H TRP 126 -13.143 9.771 5.988 1008 HA TRP 126 HA TRP 126 -15.652 9.721 4.804 1009 1HB TRP 126 2HB TRP 126 -13.969 11.053 3.798 1010 2HB TRP 126 1HB TRP 126 -12.878 9.683 3.624 1011 HD1 TRP 126 HD TRP 126 -12.671 8.968 1.195 1012 HE1 TRP 126 1HE TRP 126 -14.213 8.898 -0.863 1013 HE3 TRP 126 3HE TRP 126 -16.930 10.857 3.303 1014 HZ2 TRP 126 2HZ TRP 126 -16.874 9.554 -1.509 1015 HZ3 TRP 126 3HZ TRP 126 -18.932 11.103 1.893 1016 HH2 TRP 126 HH TRP 126 -18.904 10.465 -0.464 1017 H TYR 127 H TYR 127 -13.391 7.125 5.248 1018 HA TYR 127 HA TYR 127 -14.918 5.428 3.406 1019 1HB TYR 127 2HB TYR 127 -12.167 5.246 4.571 1020 2HB TYR 127 1HB TYR 127 -12.968 3.788 3.999 1021 HD1 TYR 127 1HD TYR 127 -11.788 7.141 2.949 1022 HD2 TYR 127 2HD TYR 127 -13.074 3.291 1.693 1023 HE1 TYR 127 1HE TYR 127 -11.102 7.674 0.652 1024 HE2 TYR 127 2HE TYR 127 -12.385 3.805 -0.610 1025 HH TYR 127 HH TYR 127 -10.681 5.410 -1.708 1026 H SER 128 H SER 128 -13.777 5.503 6.781 1027 HA SER 128 HA SER 128 -15.765 3.410 7.367 1028 1HB SER 128 2HB SER 128 -13.099 3.185 7.786 1029 2HB SER 128 1HB SER 128 -13.613 3.848 9.338 1030 HG SER 128 HG SER 128 -15.357 2.007 8.800 1031 H GLY 129 H GLY 129 -14.056 6.102 9.035 1032 1HA GLY 129 2HA GLY 129 -15.936 7.802 9.697 1033 2HA GLY 129 1HA GLY 129 -16.460 6.450 10.681 1034 H ASN 130 H ASN 130 -13.196 6.147 10.747 1035 HA ASN 130 HA ASN 130 -13.003 7.917 13.096 1036 1HB ASN 130 2HB ASN 130 -12.937 5.255 13.243 1037 2HB ASN 130 1HB ASN 130 -11.235 5.533 12.886 1038 1HD2 ASN 130 1HD2 ASN 130 -10.506 7.649 14.213 1039 2HD2 ASN 130 2HD2 ASN 130 -10.786 7.494 15.913 1040 H PHE 131 H PHE 131 -10.994 8.874 13.577 1041 HA PHE 131 HA PHE 131 -9.388 9.464 11.210 1042 1HB PHE 131 2HB PHE 131 -9.283 10.738 13.952 1043 2HB PHE 131 1HB PHE 131 -8.523 11.339 12.484 1044 HD1 PHE 131 1HD PHE 131 -9.825 12.424 10.760 1045 HD2 PHE 131 2HD PHE 131 -11.653 10.991 14.326 1046 HE1 PHE 131 1HE PHE 131 -11.832 13.761 10.265 1047 HE2 PHE 131 2HE PHE 131 -13.665 12.321 13.836 1048 HZ PHE 131 HZ PHE 131 -13.755 13.709 11.803 1049 H ASP 132 H ASP 132 -9.282 7.647 14.096 1050 HA ASP 132 HA ASP 132 -6.374 7.453 14.148 1051 1HB ASP 132 2HB ASP 132 -8.393 6.055 15.918 1052 2HB ASP 132 1HB ASP 132 -6.660 6.203 16.199 1053 H GLU 133 H GLU 133 -9.138 5.770 12.967 1054 HA GLU 133 HA GLU 133 -8.208 3.150 12.905 1055 1HB GLU 133 2HB GLU 133 -9.803 2.728 11.162 1056 2HB GLU 133 1HB GLU 133 -10.519 3.844 12.315 1057 1HG GLU 133 2HG GLU 133 -9.707 5.676 10.697 1058 2HG GLU 133 1HG GLU 133 -9.570 4.359 9.533 1059 H THR 134 H THR 134 -7.460 5.907 10.891 1060 HA THR 134 HA THR 134 -6.241 4.714 8.710 1061 HB THR 134 HB THR 134 -4.601 6.907 9.481 1062 HG1 THR 134 1HG THR 134 -6.070 7.696 10.898 1063 1HG2 THR 134 1HG2 THR 134 -5.229 7.754 7.442 1064 2HG2 THR 134 2HG2 THR 134 -6.906 7.238 7.623 1065 3HG2 THR 134 3HG2 THR 134 -5.660 6.059 7.213 1066 H TYR 135 H TYR 135 -4.938 5.431 11.910 1067 HA TYR 135 HA TYR 135 -2.311 4.515 11.419 1068 1HB TYR 135 2HB TYR 135 -2.945 5.972 13.328 1069 2HB TYR 135 1HB TYR 135 -3.814 4.620 14.045 1070 HD1 TYR 135 1HD TYR 135 -2.706 3.824 15.893 1071 HD2 TYR 135 2HD TYR 135 -0.421 4.980 12.495 1072 HE1 TYR 135 1HE TYR 135 -0.652 3.097 17.033 1073 HE2 TYR 135 2HE TYR 135 1.638 4.254 13.624 1074 HH TYR 135 HH TYR 135 1.625 2.367 16.435 1075 H LYS 136 H LYS 136 -5.161 2.969 12.871 1076 HA LYS 136 HA LYS 136 -4.017 0.532 13.555 1077 1HB LYS 136 2HB LYS 136 -6.795 1.366 12.817 1078 2HB LYS 136 1HB LYS 136 -6.437 -0.340 13.050 1079 1HG LYS 136 2HG LYS 136 -5.817 0.005 15.309 1080 2HG LYS 136 1HG LYS 136 -5.811 1.758 15.108 1081 1HD LYS 136 2HD LYS 136 -7.957 1.840 15.680 1082 2HD LYS 136 1HD LYS 136 -8.367 0.776 14.334 1083 1HE LYS 136 2HE LYS 136 -7.553 -0.054 17.117 1084 2HE LYS 136 1HE LYS 136 -9.159 -0.188 16.403 1085 1HZ LYS 136 1HZ LYS 136 -7.571 -1.513 14.645 1086 2HZ LYS 136 2HZ LYS 136 -8.526 -2.234 15.840 1087 3HZ LYS 136 3HZ LYS 136 -6.891 -1.925 16.138 1088 H ILE 137 H ILE 137 -5.800 1.258 10.547 1089 HA ILE 137 HA ILE 137 -5.271 -1.225 9.325 1090 HB ILE 137 HB ILE 137 -5.741 1.259 7.720 1091 1HG1 ILE 137 2HG1 ILE 137 -7.248 1.367 9.685 1092 2HG1 ILE 137 1HG1 ILE 137 -8.124 1.141 8.177 1093 1HG2 ILE 137 1HG2 ILE 137 -6.842 -0.168 6.216 1094 2HG2 ILE 137 2HG2 ILE 137 -6.978 -1.460 7.410 1095 3HG2 ILE 137 3HG2 ILE 137 -5.404 -1.053 6.724 1096 1HD1 ILE 137 1HD1 ILE 137 -9.198 -0.330 9.559 1097 2HD1 ILE 137 2HD1 ILE 137 -7.730 -0.744 10.444 1098 3HD1 ILE 137 3HD1 ILE 137 -7.991 -1.384 8.822 1099 H LEU 138 H LEU 138 -3.852 1.973 8.605 1100 HA LEU 138 HA LEU 138 -2.010 1.142 6.720 1101 1HB LEU 138 2HB LEU 138 -2.020 3.440 8.644 1102 2HB LEU 138 1HB LEU 138 -0.683 3.195 7.535 1103 HG LEU 138 HG LEU 138 -3.438 3.245 6.404 1104 1HD1 LEU 138 1HD1 LEU 138 -3.514 5.628 6.319 1105 2HD1 LEU 138 2HD1 LEU 138 -1.930 5.761 7.082 1106 3HD1 LEU 138 3HD1 LEU 138 -3.304 5.155 8.005 1107 1HD2 LEU 138 1HD2 LEU 138 -2.381 3.810 4.458 1108 2HD2 LEU 138 2HD2 LEU 138 -1.105 2.880 5.242 1109 3HD2 LEU 138 3HD2 LEU 138 -1.064 4.643 5.285 1110 H SER 139 H SER 139 -1.333 1.685 10.193 1111 HA SER 139 HA SER 139 1.316 0.842 10.150 1112 1HB SER 139 2HB SER 139 -0.058 1.960 12.054 1113 2HB SER 139 1HB SER 139 -0.431 0.304 12.533 1114 HG SER 139 HG SER 139 1.977 1.691 12.627 1115 H LEU 140 H LEU 140 -1.554 -1.096 11.042 1116 HA LEU 140 HA LEU 140 -0.236 -3.506 11.483 1117 1HB LEU 140 2HB LEU 140 -2.525 -3.237 12.137 1118 2HB LEU 140 1HB LEU 140 -3.023 -2.952 10.480 1119 HG LEU 140 HG LEU 140 -1.725 -5.537 10.808 1120 1HD1 LEU 140 1HD1 LEU 140 -4.377 -5.254 12.180 1121 2HD1 LEU 140 2HD1 LEU 140 -2.855 -5.143 13.065 1122 3HD1 LEU 140 3HD1 LEU 140 -3.262 -6.621 12.193 1123 1HD2 LEU 140 1HD2 LEU 140 -3.150 -6.090 9.171 1124 2HD2 LEU 140 2HD2 LEU 140 -3.467 -4.358 9.071 1125 3HD2 LEU 140 3HD2 LEU 140 -4.537 -5.396 10.013 1126 H ALA 141 H ALA 141 -1.933 -2.511 8.509 1127 HA ALA 141 HA ALA 141 -1.217 -4.678 6.930 1128 1HB ALA 141 1HB ALA 141 -2.416 -2.099 6.534 1129 2HB ALA 141 2HB ALA 141 -2.623 -3.585 5.606 1130 3HB ALA 141 3HB ALA 141 -1.312 -2.471 5.210 1131 H CYS 142 H CYS 142 0.571 -1.757 7.688 1132 HA CYS 142 HA CYS 142 2.565 -1.922 5.728 1133 1HB CYS 142 2HB CYS 142 2.425 0.095 6.949 1134 2HB CYS 142 1HB CYS 142 2.514 -0.738 8.497 1135 HG CYS 142 HG CYS 142 4.973 -0.027 8.746 1136 H LYS 143 H LYS 143 2.493 -3.197 9.046 1137 HA LYS 143 HA LYS 143 5.047 -4.435 8.887 1138 1HB LYS 143 2HB LYS 143 4.024 -3.765 11.019 1139 2HB LYS 143 1HB LYS 143 2.761 -4.967 10.791 1140 1HG LYS 143 2HG LYS 143 4.198 -6.741 11.184 1141 2HG LYS 143 1HG LYS 143 5.637 -5.783 10.830 1142 1HD LYS 143 2HD LYS 143 5.815 -5.740 13.084 1143 2HD LYS 143 1HD LYS 143 4.672 -4.405 12.929 1144 1HE LYS 143 2HE LYS 143 3.311 -5.542 14.275 1145 2HE LYS 143 1HE LYS 143 3.084 -6.685 12.952 1146 1HZ LYS 143 1HZ LYS 143 5.433 -7.021 14.664 1147 2HZ LYS 143 2HZ LYS 143 4.488 -8.190 13.886 1148 3HZ LYS 143 3HZ LYS 143 3.927 -7.454 15.302 1149 H ASN 144 H ASN 144 1.785 -5.885 9.034 1150 HA ASN 144 HA ASN 144 2.443 -8.514 8.636 1151 1HB ASN 144 2HB ASN 144 0.045 -6.867 8.132 1152 2HB ASN 144 1HB ASN 144 0.118 -8.381 7.233 1153 1HD2 ASN 144 1HD2 ASN 144 -1.885 -8.316 8.838 1154 2HD2 ASN 144 2HD2 ASN 144 -1.623 -9.202 10.298 1155 H LEU 145 H LEU 145 1.691 -6.151 6.070 1156 HA LEU 145 HA LEU 145 2.135 -7.904 3.921 1157 1HB LEU 145 2HB LEU 145 1.115 -5.464 4.059 1158 2HB LEU 145 1HB LEU 145 2.752 -5.003 3.628 1159 HG LEU 145 HG LEU 145 2.575 -6.490 1.623 1160 1HD1 LEU 145 1HD1 LEU 145 -0.382 -6.512 2.096 1161 2HD1 LEU 145 2HD1 LEU 145 0.648 -7.810 2.700 1162 3HD1 LEU 145 3HD1 LEU 145 0.575 -7.475 0.970 1163 1HD2 LEU 145 1HD2 LEU 145 0.322 -4.658 1.256 1164 2HD2 LEU 145 2HD2 LEU 145 1.873 -4.735 0.421 1165 3HD2 LEU 145 3HD2 LEU 145 1.751 -3.917 1.978 1166 H LEU 146 H LEU 146 4.310 -5.666 5.605 1167 HA LEU 146 HA LEU 146 6.537 -5.891 3.965 1168 1HB LEU 146 2HB LEU 146 5.948 -4.836 6.521 1169 2HB LEU 146 1HB LEU 146 7.367 -5.849 6.708 1170 HG LEU 146 HG LEU 146 8.481 -4.576 4.895 1171 1HD1 LEU 146 1HD1 LEU 146 6.419 -3.846 3.748 1172 2HD1 LEU 146 2HD1 LEU 146 7.528 -2.516 4.084 1173 3HD1 LEU 146 3HD1 LEU 146 6.095 -2.746 5.087 1174 1HD2 LEU 146 1HD2 LEU 146 8.556 -2.368 6.242 1175 2HD2 LEU 146 2HD2 LEU 146 9.116 -3.857 7.004 1176 3HD2 LEU 146 3HD2 LEU 146 7.514 -3.221 7.380 1177 H VAL 147 H VAL 147 5.516 -7.969 6.645 1178 HA VAL 147 HA VAL 147 7.761 -9.648 6.689 1179 HB VAL 147 HB VAL 147 4.905 -10.238 7.473 1180 1HG1 VAL 147 1HG1 VAL 147 7.117 -11.758 8.695 1181 2HG1 VAL 147 2HG1 VAL 147 6.749 -12.149 7.016 1182 3HG1 VAL 147 3HG1 VAL 147 5.492 -12.277 8.247 1183 1HG2 VAL 147 1HG2 VAL 147 5.777 -9.867 9.767 1184 2HG2 VAL 147 2HG2 VAL 147 5.836 -8.426 8.753 1185 3HG2 VAL 147 3HG2 VAL 147 7.307 -9.348 9.063 1186 H PHE 148 H PHE 148 4.596 -10.148 5.113 1187 HA PHE 148 HA PHE 148 5.248 -12.601 3.922 1188 1HB PHE 148 2HB PHE 148 2.972 -11.171 4.135 1189 2HB PHE 148 1HB PHE 148 3.372 -10.848 2.450 1190 HD1 PHE 148 1HD PHE 148 3.024 -12.470 0.787 1191 HD2 PHE 148 2HD PHE 148 2.724 -13.547 4.893 1192 HE1 PHE 148 1HE PHE 148 2.081 -14.650 0.143 1193 HE2 PHE 148 2HE PHE 148 1.782 -15.729 4.256 1194 HZ PHE 148 HZ PHE 148 1.460 -16.283 1.878 1195 H LEU 149 H LEU 149 5.309 -9.328 2.508 1196 HA LEU 149 HA LEU 149 6.269 -10.133 -0.010 1197 1HB LEU 149 2HB LEU 149 6.704 -7.446 1.287 1198 2HB LEU 149 1HB LEU 149 6.696 -7.800 -0.433 1199 HG LEU 149 HG LEU 149 4.308 -7.965 1.406 1200 1HD1 LEU 149 1HD1 LEU 149 5.514 -5.780 0.035 1201 2HD1 LEU 149 2HD1 LEU 149 4.049 -5.802 1.016 1202 3HD1 LEU 149 3HD1 LEU 149 3.958 -6.139 -0.713 1203 1HD2 LEU 149 1HD2 LEU 149 3.411 -7.958 -1.188 1204 2HD2 LEU 149 2HD2 LEU 149 3.518 -9.371 -0.140 1205 3HD2 LEU 149 3HD2 LEU 149 4.825 -9.008 -1.266 1206 H SER 150 H SER 150 8.101 -8.434 2.567 1207 HA SER 150 HA SER 150 10.329 -10.183 2.339 1208 1HB SER 150 2HB SER 150 11.908 -8.352 1.472 1209 2HB SER 150 1HB SER 150 10.872 -9.152 0.291 1210 HG SER 150 HG SER 150 10.590 -7.041 -0.127 1211 H LYS 151 H LYS 151 10.351 -10.241 4.554 1212 HA LYS 151 HA LYS 151 11.877 -8.338 5.923 1213 1HB LYS 151 2HB LYS 151 9.850 -6.943 5.754 1214 2HB LYS 151 1HB LYS 151 8.926 -8.196 6.572 1215 1HG LYS 151 2HG LYS 151 9.434 -6.526 8.176 1216 2HG LYS 151 1HG LYS 151 10.451 -7.922 8.535 1217 1HD LYS 151 2HD LYS 151 12.335 -6.855 7.411 1218 2HD LYS 151 1HD LYS 151 11.319 -5.469 7.003 1219 1HE LYS 151 2HE LYS 151 10.953 -5.129 9.457 1220 2HE LYS 151 1HE LYS 151 12.158 -6.382 9.751 1221 1HZ LYS 151 1HZ LYS 151 13.562 -4.651 9.759 1222 2HZ LYS 151 2HZ LYS 151 12.513 -3.639 8.902 1223 3HZ LYS 151 3HZ LYS 151 13.468 -4.762 8.073 1224 H HIS 152 H HIS 152 8.988 -9.883 7.250 1225 HA HIS 152 HA HIS 152 8.709 -11.487 8.835 1226 1HB HIS 152 2HB HIS 152 9.610 -12.870 6.948 1227 2HB HIS 152 1HB HIS 152 11.211 -12.714 7.663 1228 HD1 HIS 152 1HD HIS 152 8.658 -13.072 10.227 1229 HD2 HIS 152 2HD HIS 152 10.913 -15.627 7.848 1230 HE1 HIS 152 1HE HIS 152 8.499 -15.330 11.325 1231 HE2 HIS 152 2HE HIS 152 9.822 -16.872 9.836 1232 H HIS 153 H HIS 153 9.152 -10.000 10.523 1233 HA HIS 153 HA HIS 153 11.742 -9.548 11.568 1234 1HB HIS 153 2HB HIS 153 10.586 -8.582 13.495 1235 2HB HIS 153 1HB HIS 153 9.844 -8.040 11.993 1236 HD1 HIS 153 1HD HIS 153 7.735 -9.862 11.308 1237 HD2 HIS 153 2HD HIS 153 8.684 -9.199 15.299 1238 HE1 HIS 153 1HE HIS 153 5.692 -10.542 12.608 1239 HE2 HIS 153 2HE HIS 153 6.322 -10.215 15.025 1240 H HIS 154 H HIS 154 12.062 -10.044 14.050 1241 HA HIS 154 HA HIS 154 11.255 -12.757 14.734 1242 1HB HIS 154 2HB HIS 154 13.570 -13.481 15.148 1243 2HB HIS 154 1HB HIS 154 13.313 -13.085 13.452 1244 HD1 HIS 154 1HD HIS 154 13.554 -9.876 14.486 1245 HD2 HIS 154 2HD HIS 154 16.347 -12.952 14.544 1246 HE1 HIS 154 1HE HIS 154 15.799 -8.745 14.563 1247 HE2 HIS 154 2HE HIS 154 17.475 -10.625 14.563 1248 H HIS 155 H HIS 155 11.324 -9.738 15.651 1249 HA HIS 155 HA HIS 155 12.657 -9.634 18.115 1250 1HB HIS 155 2HB HIS 155 10.276 -8.140 17.028 1251 2HB HIS 155 1HB HIS 155 10.924 -7.817 18.633 1252 HD1 HIS 155 1HD HIS 155 12.476 -5.903 18.641 1253 HD2 HIS 155 2HD HIS 155 12.587 -7.954 15.029 1254 HE1 HIS 155 1HE HIS 155 14.135 -4.662 17.213 1255 HE2 HIS 155 2HE HIS 155 14.104 -5.860 14.997 1256 H HIS 156 H HIS 156 9.191 -10.198 17.485 1257 HA HIS 156 HA HIS 156 9.053 -11.589 20.081 1258 1HB HIS 156 2HB HIS 156 6.466 -10.777 19.057 1259 2HB HIS 156 1HB HIS 156 7.211 -10.425 20.612 1260 HD1 HIS 156 1HD HIS 156 6.657 -8.995 17.214 1261 HD2 HIS 156 2HD HIS 156 8.524 -7.944 20.773 1262 HE1 HIS 156 1HE HIS 156 7.183 -6.546 16.999 1263 HE2 HIS 156 2HE HIS 156 8.234 -5.913 19.198 Start of MODEL 7 1 1H MET 1 1HT MET 1 16.500 -8.496 -7.536 2 2H MET 1 2HT MET 1 17.659 -7.740 -8.507 3 3H MET 1 3HT MET 1 16.795 -9.067 -9.101 4 HA MET 1 HA MET 1 16.011 -6.280 -8.879 5 1HB MET 1 2HB MET 1 15.880 -8.551 -10.763 6 2HB MET 1 1HB MET 1 14.499 -7.466 -10.808 7 1HG MET 1 2HG MET 1 16.176 -6.830 -12.442 8 2HG MET 1 1HG MET 1 15.972 -5.578 -11.218 9 1HE MET 1 1HE MET 1 17.889 -8.438 -12.589 10 2HE MET 1 2HE MET 1 18.434 -8.984 -11.002 11 3HE MET 1 3HE MET 1 19.565 -8.191 -12.099 12 H LYS 2 H LYS 2 15.166 -6.990 -6.581 13 HA LYS 2 HA LYS 2 12.525 -8.209 -6.718 14 1HB LYS 2 2HB LYS 2 14.558 -7.897 -4.697 15 2HB LYS 2 1HB LYS 2 13.017 -7.292 -4.103 16 1HG LYS 2 2HG LYS 2 12.913 -9.491 -3.475 17 2HG LYS 2 1HG LYS 2 12.092 -9.544 -5.035 18 1HD LYS 2 2HD LYS 2 13.605 -10.969 -5.830 19 2HD LYS 2 1HD LYS 2 14.915 -9.860 -5.417 20 1HE LYS 2 2HE LYS 2 14.023 -11.013 -3.003 21 2HE LYS 2 1HE LYS 2 14.173 -12.326 -4.169 22 1HZ LYS 2 1HZ LYS 2 16.305 -10.342 -3.592 23 2HZ LYS 2 2HZ LYS 2 16.436 -11.702 -4.588 24 3HZ LYS 2 3HZ LYS 2 16.232 -11.894 -2.920 25 H LYS 3 H LYS 3 10.857 -6.970 -7.217 26 HA LYS 3 HA LYS 3 10.775 -4.226 -6.150 27 1HB LYS 3 2HB LYS 3 10.545 -5.173 -8.887 28 2HB LYS 3 1HB LYS 3 9.136 -4.240 -8.400 29 1HG LYS 3 2HG LYS 3 10.947 -2.561 -7.516 30 2HG LYS 3 1HG LYS 3 11.969 -3.386 -8.696 31 1HD LYS 3 2HD LYS 3 9.375 -2.747 -9.806 32 2HD LYS 3 1HD LYS 3 10.186 -1.305 -9.190 33 1HE LYS 3 2HE LYS 3 10.673 -1.827 -11.585 34 2HE LYS 3 1HE LYS 3 12.100 -1.708 -10.555 35 1HZ LYS 3 1HZ LYS 3 12.594 -3.859 -10.856 36 2HZ LYS 3 2HZ LYS 3 11.614 -3.738 -12.228 37 3HZ LYS 3 3HZ LYS 3 10.980 -4.367 -10.791 38 H ILE 4 H ILE 4 8.916 -3.564 -5.212 39 HA ILE 4 HA ILE 4 6.684 -5.489 -5.150 40 HB ILE 4 HB ILE 4 6.616 -3.744 -2.878 41 1HG1 ILE 4 2HG1 ILE 4 9.126 -3.727 -3.338 42 2HG1 ILE 4 1HG1 ILE 4 8.628 -4.247 -1.732 43 1HG2 ILE 4 1HG2 ILE 4 6.369 -6.557 -3.549 44 2HG2 ILE 4 2HG2 ILE 4 5.532 -5.606 -2.323 45 3HG2 ILE 4 3HG2 ILE 4 7.115 -6.297 -1.972 46 1HD1 ILE 4 1HD1 ILE 4 10.338 -5.714 -2.409 47 2HD1 ILE 4 2HD1 ILE 4 9.623 -5.937 -4.004 48 3HD1 ILE 4 3HD1 ILE 4 8.833 -6.617 -2.581 49 H LEU 5 H LEU 5 5.055 -4.692 -6.310 50 HA LEU 5 HA LEU 5 4.693 -1.807 -6.515 51 1HB LEU 5 2HB LEU 5 4.426 -3.899 -8.314 52 2HB LEU 5 1HB LEU 5 2.772 -3.448 -7.949 53 HG LEU 5 HG LEU 5 4.862 -1.471 -8.853 54 1HD1 LEU 5 1HD1 LEU 5 4.717 -2.470 -10.845 55 2HD1 LEU 5 2HD1 LEU 5 3.103 -1.765 -10.928 56 3HD1 LEU 5 3HD1 LEU 5 3.313 -3.425 -10.368 57 1HD2 LEU 5 1HD2 LEU 5 2.691 -0.251 -9.501 58 2HD2 LEU 5 2HD2 LEU 5 3.158 -0.284 -7.800 59 3HD2 LEU 5 3HD2 LEU 5 1.903 -1.373 -8.390 60 H PHE 6 H PHE 6 3.469 -0.880 -4.977 61 HA PHE 6 HA PHE 6 1.238 -2.353 -3.791 62 1HB PHE 6 2HB PHE 6 2.209 0.443 -3.144 63 2HB PHE 6 1HB PHE 6 1.066 -0.509 -2.211 64 HD1 PHE 6 1HD PHE 6 2.231 -3.035 -1.705 65 HD2 PHE 6 2HD PHE 6 4.190 0.731 -2.091 66 HE1 PHE 6 1HE PHE 6 4.072 -3.845 -0.299 67 HE2 PHE 6 2HE PHE 6 6.036 -0.086 -0.690 68 HZ PHE 6 HZ PHE 6 5.981 -2.377 0.203 69 H ILE 7 H ILE 7 -0.834 -2.059 -4.478 70 HA ILE 7 HA ILE 7 -1.369 0.301 -6.172 71 HB ILE 7 HB ILE 7 -2.909 -2.240 -6.511 72 1HG1 ILE 7 2HG1 ILE 7 -1.053 -2.328 -8.533 73 2HG1 ILE 7 1HG1 ILE 7 -0.078 -1.806 -7.162 74 1HG2 ILE 7 1HG2 ILE 7 -2.145 -0.529 -8.784 75 2HG2 ILE 7 2HG2 ILE 7 -3.215 0.207 -7.590 76 3HG2 ILE 7 3HG2 ILE 7 -3.690 -1.286 -8.399 77 1HD1 ILE 7 1HD1 ILE 7 -0.202 -4.285 -7.571 78 2HD1 ILE 7 2HD1 ILE 7 -1.883 -4.200 -7.048 79 3HD1 ILE 7 3HD1 ILE 7 -0.591 -3.750 -5.937 80 H CYS 8 H CYS 8 -2.649 1.678 -5.134 81 HA CYS 8 HA CYS 8 -4.822 0.603 -3.463 82 1HB CYS 8 2HB CYS 8 -2.942 2.317 -2.631 83 2HB CYS 8 1HB CYS 8 -4.079 3.479 -3.307 84 HG CYS 8 HG CYS 8 -6.075 3.087 -1.577 85 H LEU 9 H LEU 9 -6.815 0.773 -4.234 86 HA LEU 9 HA LEU 9 -7.474 1.810 -6.713 87 1HB LEU 9 2HB LEU 9 -8.816 0.500 -4.622 88 2HB LEU 9 1HB LEU 9 -9.741 1.954 -4.943 89 HG LEU 9 HG LEU 9 -8.935 0.139 -7.192 90 1HD1 LEU 9 1HD1 LEU 9 -11.610 -0.166 -5.943 91 2HD1 LEU 9 2HD1 LEU 9 -10.239 -0.962 -5.171 92 3HD1 LEU 9 3HD1 LEU 9 -10.642 -1.329 -6.848 93 1HD2 LEU 9 1HD2 LEU 9 -11.535 1.426 -7.252 94 2HD2 LEU 9 2HD2 LEU 9 -10.227 1.464 -8.434 95 3HD2 LEU 9 3HD2 LEU 9 -10.217 2.583 -7.072 96 H GLY 10 H GLY 10 -7.414 3.400 -3.589 97 1HA GLY 10 2HA GLY 10 -8.511 5.841 -4.812 98 2HA GLY 10 1HA GLY 10 -8.379 5.536 -3.081 99 H ASN 11 H ASN 11 -5.673 4.620 -3.114 100 HA ASN 11 HA ASN 11 -3.619 5.521 -2.715 101 1HB ASN 11 2HB ASN 11 -3.993 5.400 -5.378 102 2HB ASN 11 1HB ASN 11 -3.701 7.127 -5.201 103 1HD2 ASN 11 1HD2 ASN 11 -2.350 3.966 -5.051 104 2HD2 ASN 11 2HD2 ASN 11 -0.705 4.444 -4.829 105 H ILE 12 H ILE 12 -5.942 7.064 -1.797 106 HA ILE 12 HA ILE 12 -4.585 9.648 -1.460 107 HB ILE 12 HB ILE 12 -6.807 10.778 -1.541 108 1HG1 ILE 12 2HG1 ILE 12 -7.726 8.149 -2.729 109 2HG1 ILE 12 1HG1 ILE 12 -8.162 8.739 -1.128 110 1HG2 ILE 12 1HG2 ILE 12 -5.955 11.305 -3.530 111 2HG2 ILE 12 2HG2 ILE 12 -6.968 10.026 -4.197 112 3HG2 ILE 12 3HG2 ILE 12 -5.293 9.687 -3.761 113 1HD1 ILE 12 1HD1 ILE 12 -9.963 9.144 -2.652 114 2HD1 ILE 12 2HD1 ILE 12 -8.883 9.985 -3.765 115 3HD1 ILE 12 3HD1 ILE 12 -9.243 10.686 -2.188 116 H CYS 13 H CYS 13 -5.263 7.044 0.088 117 HA CYS 13 HA CYS 13 -6.054 8.428 2.545 118 1HB CYS 13 2HB CYS 13 -7.537 6.328 1.155 119 2HB CYS 13 1HB CYS 13 -7.200 5.930 2.834 120 HG CYS 13 HG CYS 13 -9.562 6.992 3.264 121 H ARG 14 H ARG 14 -5.622 4.981 1.926 122 HA ARG 14 HA ARG 14 -3.716 4.794 4.066 123 1HB ARG 14 2HB ARG 14 -4.094 2.537 4.014 124 2HB ARG 14 1HB ARG 14 -5.579 3.105 3.262 125 1HG ARG 14 2HG ARG 14 -5.099 2.136 1.304 126 2HG ARG 14 1HG ARG 14 -3.397 2.596 1.374 127 1HD ARG 14 2HD ARG 14 -4.754 0.213 2.594 128 2HD ARG 14 1HD ARG 14 -3.387 0.253 1.482 129 HE ARG 14 HE ARG 14 -3.310 0.572 4.350 130 1HH1 ARG 14 1HH1 ARG 14 -1.644 1.079 1.330 131 2HH1 ARG 14 2HH1 ARG 14 -0.077 1.163 2.062 132 1HH2 ARG 14 1HH2 ARG 14 -1.250 0.680 5.319 133 2HH2 ARG 14 2HH2 ARG 14 0.147 0.936 4.328 134 H SER 15 H SER 15 -3.581 4.912 0.585 135 HA SER 15 HA SER 15 -0.975 3.831 0.292 136 1HB SER 15 2HB SER 15 -2.949 4.449 -1.451 137 2HB SER 15 1HB SER 15 -1.855 5.806 -1.715 138 HG SER 15 HG SER 15 -0.237 4.381 -2.252 139 HA PRO 16 HA PRO 16 0.398 8.542 0.059 140 1HB PRO 16 2HB PRO 16 -1.130 10.187 1.647 141 2HB PRO 16 1HB PRO 16 -1.323 10.026 -0.101 142 1HG PRO 16 2HG PRO 16 -2.859 8.705 2.103 143 2HG PRO 16 1HG PRO 16 -3.459 9.428 0.597 144 1HD PRO 16 2HD PRO 16 -3.201 6.781 0.853 145 2HD PRO 16 1HD PRO 16 -2.821 7.596 -0.681 146 H MET 17 H MET 17 -1.296 7.677 3.083 147 HA MET 17 HA MET 17 0.545 8.772 4.857 148 1HB MET 17 2HB MET 17 -1.800 7.328 5.068 149 2HB MET 17 1HB MET 17 -0.610 6.252 5.787 150 1HG MET 17 2HG MET 17 -0.359 9.006 6.697 151 2HG MET 17 1HG MET 17 -1.928 8.289 7.059 152 1HE MET 17 1HE MET 17 -1.002 7.821 10.370 153 2HE MET 17 2HE MET 17 -1.152 9.133 9.201 154 3HE MET 17 3HE MET 17 0.417 8.767 9.918 155 H ALA 18 H ALA 18 0.306 5.355 3.842 156 HA ALA 18 HA ALA 18 2.775 4.611 5.018 157 1HB ALA 18 1HB ALA 18 0.809 3.338 3.221 158 2HB ALA 18 2HB ALA 18 1.565 2.733 4.696 159 3HB ALA 18 3HB ALA 18 2.453 2.699 3.171 160 H GLU 19 H GLU 19 2.008 6.334 2.192 161 HA GLU 19 HA GLU 19 4.136 5.586 0.500 162 1HB GLU 19 2HB GLU 19 2.117 6.944 -0.156 163 2HB GLU 19 1HB GLU 19 2.837 8.313 0.677 164 1HG GLU 19 2HG GLU 19 3.254 8.513 -1.665 165 2HG GLU 19 1HG GLU 19 4.776 8.169 -0.842 166 H PHE 20 H PHE 20 3.805 8.348 2.736 167 HA PHE 20 HA PHE 20 6.529 9.143 2.444 168 1HB PHE 20 2HB PHE 20 4.568 10.601 3.186 169 2HB PHE 20 1HB PHE 20 4.740 9.861 4.771 170 HD1 PHE 20 1HD PHE 20 6.761 10.263 6.114 171 HD2 PHE 20 2HD PHE 20 6.115 12.223 2.392 172 HE1 PHE 20 1HE PHE 20 8.491 11.916 6.688 173 HE2 PHE 20 2HE PHE 20 7.846 13.877 2.957 174 HZ PHE 20 HZ PHE 20 9.036 13.725 5.109 175 H ILE 21 H ILE 21 4.771 7.334 4.966 176 HA ILE 21 HA ILE 21 6.873 7.039 6.766 177 HB ILE 21 HB ILE 21 4.759 4.954 6.236 178 1HG1 ILE 21 2HG1 ILE 21 4.634 7.305 8.138 179 2HG1 ILE 21 1HG1 ILE 21 3.823 7.254 6.576 180 1HG2 ILE 21 1HG2 ILE 21 6.938 5.017 8.007 181 2HG2 ILE 21 2HG2 ILE 21 5.602 3.865 7.979 182 3HG2 ILE 21 3HG2 ILE 21 5.498 5.312 8.983 183 1HD1 ILE 21 1HD1 ILE 21 2.090 6.248 7.502 184 2HD1 ILE 21 2HD1 ILE 21 2.897 6.318 9.070 185 3HD1 ILE 21 3HD1 ILE 21 3.120 4.915 8.024 186 H MET 22 H MET 22 5.854 4.723 4.244 187 HA MET 22 HA MET 22 7.910 2.884 4.627 188 1HB MET 22 2HB MET 22 6.079 3.528 2.371 189 2HB MET 22 1HB MET 22 7.477 2.520 2.023 190 1HG MET 22 2HG MET 22 6.124 1.649 4.414 191 2HG MET 22 1HG MET 22 5.028 1.700 3.034 192 1HE MET 22 1HE MET 22 5.302 -0.575 4.500 193 2HE MET 22 2HE MET 22 6.816 -1.480 4.526 194 3HE MET 22 3HE MET 22 5.568 -1.885 3.348 195 H LYS 23 H LYS 23 7.771 5.687 2.447 196 HA LYS 23 HA LYS 23 10.154 5.378 1.100 197 1HB LYS 23 2HB LYS 23 8.576 7.151 0.566 198 2HB LYS 23 1HB LYS 23 8.891 7.934 2.107 199 1HG LYS 23 2HG LYS 23 11.385 7.872 1.127 200 2HG LYS 23 1HG LYS 23 10.472 7.937 -0.381 201 1HD LYS 23 2HD LYS 23 9.489 9.988 0.168 202 2HD LYS 23 1HD LYS 23 9.879 9.818 1.880 203 1HE LYS 23 2HE LYS 23 12.352 9.746 0.719 204 2HE LYS 23 1HE LYS 23 11.489 10.874 -0.326 205 1HZ LYS 23 1HZ LYS 23 12.658 11.878 1.632 206 2HZ LYS 23 2HZ LYS 23 11.520 11.120 2.627 207 3HZ LYS 23 3HZ LYS 23 11.017 12.272 1.497 208 H ASP 24 H ASP 24 9.612 6.625 4.348 209 HA ASP 24 HA ASP 24 12.318 7.449 4.750 210 1HB ASP 24 2HB ASP 24 9.841 7.388 6.306 211 2HB ASP 24 1HB ASP 24 11.282 7.087 7.274 212 H LEU 25 H LEU 25 10.450 4.752 6.118 213 HA LEU 25 HA LEU 25 12.619 3.532 7.418 214 1HB LEU 25 2HB LEU 25 10.152 3.270 7.885 215 2HB LEU 25 1HB LEU 25 10.103 2.150 6.537 216 HG LEU 25 HG LEU 25 12.209 1.419 8.367 217 1HD1 LEU 25 1HD1 LEU 25 10.541 2.645 9.894 218 2HD1 LEU 25 2HD1 LEU 25 11.062 1.023 10.350 219 3HD1 LEU 25 3HD1 LEU 25 9.484 1.264 9.600 220 1HD2 LEU 25 1HD2 LEU 25 11.573 -0.600 7.677 221 2HD2 LEU 25 2HD2 LEU 25 10.412 0.217 6.631 222 3HD2 LEU 25 3HD2 LEU 25 9.917 -0.344 8.228 223 H VAL 26 H VAL 26 11.629 3.256 4.082 224 HA VAL 26 HA VAL 26 12.520 0.677 3.530 225 HB VAL 26 HB VAL 26 12.991 1.524 1.185 226 1HG1 VAL 26 1HG1 VAL 26 10.898 0.901 0.812 227 2HG1 VAL 26 2HG1 VAL 26 10.280 2.398 1.512 228 3HG1 VAL 26 3HG1 VAL 26 10.598 1.006 2.547 229 1HG2 VAL 26 1HG2 VAL 26 13.501 3.787 1.464 230 2HG2 VAL 26 2HG2 VAL 26 12.093 4.070 2.488 231 3HG2 VAL 26 3HG2 VAL 26 11.885 3.786 0.760 232 H LYS 27 H LYS 27 14.392 3.710 3.300 233 HA LYS 27 HA LYS 27 16.773 2.690 2.378 234 1HB LYS 27 2HB LYS 27 16.297 5.092 2.716 235 2HB LYS 27 1HB LYS 27 16.448 4.864 4.451 236 1HG LYS 27 2HG LYS 27 18.761 3.915 2.944 237 2HG LYS 27 1HG LYS 27 18.451 5.643 2.770 238 1HD LYS 27 2HD LYS 27 18.297 5.750 5.285 239 2HD LYS 27 1HD LYS 27 18.903 4.092 5.312 240 1HE LYS 27 2HE LYS 27 21.004 4.718 4.798 241 2HE LYS 27 1HE LYS 27 20.467 5.957 3.666 242 1HZ LYS 27 1HZ LYS 27 20.268 7.517 5.331 243 2HZ LYS 27 2HZ LYS 27 21.631 6.656 5.839 244 3HZ LYS 27 3HZ LYS 27 20.131 6.364 6.563 245 H LYS 28 H LYS 28 15.406 2.394 5.574 246 HA LYS 28 HA LYS 28 17.772 1.703 6.949 247 1HB LYS 28 2HB LYS 28 15.569 2.449 7.944 248 2HB LYS 28 1HB LYS 28 14.991 0.810 7.680 249 1HG LYS 28 2HG LYS 28 17.545 1.080 9.134 250 2HG LYS 28 1HG LYS 28 16.093 1.632 9.971 251 1HD LYS 28 2HD LYS 28 15.659 -0.911 8.664 252 2HD LYS 28 1HD LYS 28 17.026 -0.985 9.778 253 1HE LYS 28 2HE LYS 28 14.529 0.342 10.697 254 2HE LYS 28 1HE LYS 28 14.544 -1.418 10.586 255 1HZ LYS 28 1HZ LYS 28 16.719 -0.002 11.984 256 2HZ LYS 28 2HZ LYS 28 16.172 -1.589 12.192 257 3HZ LYS 28 3HZ LYS 28 15.252 -0.295 12.775 258 H ALA 29 H ALA 29 15.154 -0.449 5.732 259 HA ALA 29 HA ALA 29 17.169 -2.596 5.656 260 1HB ALA 29 1HB ALA 29 15.989 -3.115 7.597 261 2HB ALA 29 2HB ALA 29 15.278 -4.153 6.362 262 3HB ALA 29 3HB ALA 29 14.436 -2.690 6.876 263 H ASN 30 H ASN 30 16.001 -0.924 3.476 264 HA ASN 30 HA ASN 30 14.990 -3.164 1.858 265 1HB ASN 30 2HB ASN 30 13.961 -0.321 1.761 266 2HB ASN 30 1HB ASN 30 13.481 -1.617 0.670 267 1HD2 ASN 30 1HD2 ASN 30 13.705 -0.928 4.145 268 2HD2 ASN 30 2HD2 ASN 30 12.220 -1.703 4.566 269 H LEU 31 H LEU 31 16.193 0.186 1.569 270 HA LEU 31 HA LEU 31 17.206 -0.184 -1.054 271 1HB LEU 31 2HB LEU 31 16.663 1.996 0.319 272 2HB LEU 31 1HB LEU 31 18.345 1.867 0.795 273 HG LEU 31 HG LEU 31 18.948 1.846 -1.646 274 1HD1 LEU 31 1HD1 LEU 31 17.331 1.572 -3.137 275 2HD1 LEU 31 2HD1 LEU 31 16.714 3.165 -2.702 276 3HD1 LEU 31 3HD1 LEU 31 16.093 1.728 -1.890 277 1HD2 LEU 31 1HD2 LEU 31 17.717 4.151 -0.218 278 2HD2 LEU 31 2HD2 LEU 31 18.206 4.354 -1.901 279 3HD2 LEU 31 3HD2 LEU 31 19.396 3.878 -0.688 280 H GLU 32 H GLU 32 18.251 -1.415 1.842 281 HA GLU 32 HA GLU 32 21.085 -1.232 1.443 282 1HB GLU 32 2HB GLU 32 19.705 -3.266 3.183 283 2HB GLU 32 1HB GLU 32 21.298 -2.550 3.389 284 1HG GLU 32 2HG GLU 32 18.924 -0.762 3.466 285 2HG GLU 32 1HG GLU 32 19.250 -1.798 4.856 286 H LYS 33 H LYS 33 18.560 -3.545 0.680 287 HA LYS 33 HA LYS 33 20.545 -5.363 -0.490 288 1HB LYS 33 2HB LYS 33 17.639 -6.031 -0.417 289 2HB LYS 33 1HB LYS 33 19.035 -7.089 -0.261 290 1HG LYS 33 2HG LYS 33 18.366 -7.148 1.889 291 2HG LYS 33 1HG LYS 33 19.321 -5.666 1.984 292 1HD LYS 33 2HD LYS 33 17.274 -5.141 3.016 293 2HD LYS 33 1HD LYS 33 17.167 -4.435 1.403 294 1HE LYS 33 2HE LYS 33 15.161 -5.474 1.396 295 2HE LYS 33 1HE LYS 33 16.133 -6.861 0.903 296 1HZ LYS 33 1HZ LYS 33 14.590 -7.376 2.719 297 2HZ LYS 33 2HZ LYS 33 15.366 -6.242 3.704 298 3HZ LYS 33 3HZ LYS 33 16.203 -7.612 3.173 299 H GLU 34 H GLU 34 19.366 -2.724 -1.524 300 HA GLU 34 HA GLU 34 18.837 -1.802 -3.526 301 1HB GLU 34 2HB GLU 34 20.361 -4.180 -4.139 302 2HB GLU 34 1HB GLU 34 19.190 -3.846 -5.407 303 1HG GLU 34 2HG GLU 34 20.087 -1.465 -5.384 304 2HG GLU 34 1HG GLU 34 21.419 -2.103 -4.421 305 H PHE 35 H PHE 35 16.657 -2.486 -2.211 306 HA PHE 35 HA PHE 35 14.941 -3.986 -4.065 307 1HB PHE 35 2HB PHE 35 14.797 -3.368 -1.140 308 2HB PHE 35 1HB PHE 35 13.298 -3.640 -2.020 309 HD1 PHE 35 1HD PHE 35 12.538 -5.684 -1.234 310 HD2 PHE 35 2HD PHE 35 16.595 -5.302 -2.464 311 HE1 PHE 35 1HE PHE 35 12.836 -8.114 -0.993 312 HE2 PHE 35 2HE PHE 35 16.899 -7.733 -2.227 313 HZ PHE 35 HZ PHE 35 15.018 -9.141 -1.490 314 H PHE 36 H PHE 36 13.230 -3.038 -5.085 315 HA PHE 36 HA PHE 36 12.895 -0.139 -4.655 316 1HB PHE 36 2HB PHE 36 13.805 -1.264 -6.931 317 2HB PHE 36 1HB PHE 36 12.074 -1.302 -7.252 318 HD1 PHE 36 1HD PHE 36 14.943 0.894 -6.532 319 HD2 PHE 36 2HD PHE 36 10.870 0.678 -7.750 320 HE1 PHE 36 1HE PHE 36 15.024 3.258 -7.210 321 HE2 PHE 36 2HE PHE 36 10.944 3.041 -8.430 322 HZ PHE 36 HZ PHE 36 13.023 4.334 -8.160 323 H ILE 37 H ILE 37 10.858 0.696 -4.480 324 HA ILE 37 HA ILE 37 8.613 -1.204 -4.640 325 HB ILE 37 HB ILE 37 7.579 -0.152 -2.696 326 1HG1 ILE 37 2HG1 ILE 37 9.670 1.208 -1.439 327 2HG1 ILE 37 1HG1 ILE 37 9.708 1.783 -3.102 328 1HG2 ILE 37 1HG2 ILE 37 9.619 -0.759 -1.058 329 2HG2 ILE 37 2HG2 ILE 37 10.193 -1.510 -2.547 330 3HG2 ILE 37 3HG2 ILE 37 8.630 -1.972 -1.873 331 1HD1 ILE 37 1HD1 ILE 37 7.035 1.686 -1.918 332 2HD1 ILE 37 2HD1 ILE 37 7.819 2.951 -2.864 333 3HD1 ILE 37 3HD1 ILE 37 8.151 2.807 -1.138 334 H ASN 38 H ASN 38 6.602 -0.347 -5.247 335 HA ASN 38 HA ASN 38 6.633 2.417 -6.247 336 1HB ASN 38 2HB ASN 38 5.102 0.352 -7.762 337 2HB ASN 38 1HB ASN 38 5.853 1.838 -8.336 338 1HD2 ASN 38 1HD2 ASN 38 6.136 -1.506 -8.040 339 2HD2 ASN 38 2HD2 ASN 38 7.765 -1.668 -8.593 340 H SER 39 H SER 39 4.308 3.094 -6.857 341 HA SER 39 HA SER 39 2.161 1.853 -5.431 342 1HB SER 39 2HB SER 39 3.365 3.006 -3.575 343 2HB SER 39 1HB SER 39 3.116 4.538 -4.410 344 HG SER 39 HG SER 39 0.924 2.872 -3.838 345 H ALA 40 H ALA 40 0.342 2.271 -6.512 346 HA ALA 40 HA ALA 40 -0.263 4.845 -7.602 347 1HB ALA 40 1HB ALA 40 -0.200 4.354 -9.924 348 2HB ALA 40 2HB ALA 40 0.171 2.657 -9.622 349 3HB ALA 40 3HB ALA 40 1.370 3.899 -9.262 350 H GLY 41 H GLY 41 -2.295 4.676 -9.050 351 1HA GLY 41 2HA GLY 41 -4.166 2.908 -7.654 352 2HA GLY 41 1HA GLY 41 -4.596 4.313 -8.619 353 H THR 42 H THR 42 -6.151 2.387 -9.239 354 HA THR 42 HA THR 42 -5.069 0.500 -11.109 355 HB THR 42 HB THR 42 -7.000 -0.141 -9.801 356 HG1 THR 42 1HG THR 42 -7.998 0.152 -12.431 357 1HG2 THR 42 1HG2 THR 42 -7.974 2.453 -10.599 358 2HG2 THR 42 2HG2 THR 42 -8.570 1.373 -9.337 359 3HG2 THR 42 3HG2 THR 42 -9.148 1.197 -10.994 360 H SER 43 H SER 43 -6.859 3.545 -11.365 361 HA SER 43 HA SER 43 -6.429 3.439 -14.280 362 1HB SER 43 2HB SER 43 -8.569 5.177 -13.139 363 2HB SER 43 1HB SER 43 -8.506 4.341 -14.691 364 HG SER 43 HG SER 43 -9.959 3.518 -12.909 365 H GLY 44 H GLY 44 -5.439 4.920 -11.499 366 1HA GLY 44 2HA GLY 44 -4.246 6.822 -11.050 367 2HA GLY 44 1HA GLY 44 -3.847 6.817 -12.760 368 H GLU 45 H GLU 45 -7.190 7.009 -11.986 369 HA GLU 45 HA GLU 45 -7.566 9.441 -13.318 370 1HB GLU 45 2HB GLU 45 -9.221 7.707 -11.560 371 2HB GLU 45 1HB GLU 45 -9.767 9.363 -11.786 372 1HG GLU 45 2HG GLU 45 -9.652 8.984 -14.249 373 2HG GLU 45 1HG GLU 45 -9.316 7.287 -13.912 374 H HIS 46 H HIS 46 -7.944 8.847 -9.827 375 HA HIS 46 HA HIS 46 -7.032 11.607 -9.347 376 1HB HIS 46 2HB HIS 46 -9.470 10.374 -8.590 377 2HB HIS 46 1HB HIS 46 -8.522 10.572 -7.121 378 HD1 HIS 46 1HD HIS 46 -9.750 12.503 -6.087 379 HD2 HIS 46 2HD HIS 46 -8.638 13.237 -10.022 380 HE1 HIS 46 1HE HIS 46 -10.257 14.934 -6.487 381 HE2 HIS 46 2HE HIS 46 -9.508 15.372 -8.852 382 H ASP 47 H ASP 47 -6.789 8.259 -8.565 383 HA ASP 47 HA ASP 47 -5.561 8.083 -6.160 384 1HB ASP 47 2HB ASP 47 -4.220 6.579 -8.344 385 2HB ASP 47 1HB ASP 47 -4.855 6.003 -6.804 386 H GLY 48 H GLY 48 -4.069 9.452 -5.347 387 1HA GLY 48 2HA GLY 48 -1.527 9.565 -5.442 388 2HA GLY 48 1HA GLY 48 -1.786 10.174 -7.067 389 H GLU 49 H GLU 49 -4.270 11.298 -5.176 390 HA GLU 49 HA GLU 49 -3.506 13.974 -5.338 391 1HB GLU 49 2HB GLU 49 -5.746 12.529 -4.399 392 2HB GLU 49 1HB GLU 49 -5.253 13.593 -3.091 393 1HG GLU 49 2HG GLU 49 -5.224 15.009 -5.586 394 2HG GLU 49 1HG GLU 49 -6.787 14.234 -5.333 395 H GLY 50 H GLY 50 -4.001 12.392 -2.182 396 1HA GLY 50 2HA GLY 50 -1.705 12.270 -0.937 397 2HA GLY 50 1HA GLY 50 -1.788 14.013 -1.137 398 H MET 51 H MET 51 -2.663 11.371 0.770 399 HA MET 51 HA MET 51 -3.798 11.105 2.706 400 1HB MET 51 2HB MET 51 -3.278 12.629 4.287 401 2HB MET 51 1HB MET 51 -2.294 13.317 3.006 402 1HG MET 51 2HG MET 51 -4.507 14.644 2.482 403 2HG MET 51 1HG MET 51 -4.842 14.291 4.176 404 1HE MET 51 1HE MET 51 -3.893 17.961 3.618 405 2HE MET 51 2HE MET 51 -4.629 16.789 2.525 406 3HE MET 51 3HE MET 51 -3.009 17.404 2.196 407 H HIS 52 H HIS 52 -5.740 11.864 4.035 408 HA HIS 52 HA HIS 52 -7.832 13.094 2.411 409 1HB HIS 52 2HB HIS 52 -7.637 10.359 2.491 410 2HB HIS 52 1HB HIS 52 -8.746 10.680 3.820 411 HD1 HIS 52 1HD HIS 52 -9.252 9.439 0.803 412 HD2 HIS 52 2HD HIS 52 -10.476 13.090 2.361 413 HE1 HIS 52 1HE HIS 52 -11.240 10.125 -0.574 414 HE2 HIS 52 2HE HIS 52 -12.044 12.268 0.478 415 H TYR 53 H TYR 53 -9.976 12.501 4.105 416 HA TYR 53 HA TYR 53 -9.865 14.487 6.002 417 1HB TYR 53 2HB TYR 53 -11.550 11.984 5.927 418 2HB TYR 53 1HB TYR 53 -11.799 13.275 7.097 419 HD1 TYR 53 1HD TYR 53 -11.663 15.720 5.707 420 HD2 TYR 53 2HD TYR 53 -13.157 12.000 4.285 421 HE1 TYR 53 1HE TYR 53 -13.084 16.915 4.093 422 HE2 TYR 53 2HE TYR 53 -14.581 13.183 2.667 423 HH TYR 53 HH TYR 53 -15.609 15.440 2.425 424 H GLY 54 H GLY 54 -10.077 11.086 7.004 425 1HA GLY 54 2HA GLY 54 -9.101 11.537 9.591 426 2HA GLY 54 1HA GLY 54 -9.197 9.974 8.801 427 H THR 55 H THR 55 -7.380 10.506 6.660 428 HA THR 55 HA THR 55 -4.970 9.794 7.873 429 HB THR 55 HB THR 55 -5.284 11.088 5.156 430 HG1 THR 55 1HG THR 55 -6.456 9.316 4.883 431 1HG2 THR 55 1HG2 THR 55 -3.041 10.960 5.188 432 2HG2 THR 55 2HG2 THR 55 -3.280 9.223 4.990 433 3HG2 THR 55 3HG2 THR 55 -3.032 9.901 6.600 434 H LYS 56 H LYS 56 -5.919 12.929 6.472 435 HA LYS 56 HA LYS 56 -3.585 14.319 7.144 436 1HB LYS 56 2HB LYS 56 -4.638 16.165 6.329 437 2HB LYS 56 1HB LYS 56 -5.754 14.961 5.706 438 1HG LYS 56 2HG LYS 56 -7.368 16.105 6.707 439 2HG LYS 56 1HG LYS 56 -6.722 15.520 8.241 440 1HD LYS 56 2HD LYS 56 -6.300 17.631 8.799 441 2HD LYS 56 1HD LYS 56 -5.104 17.689 7.502 442 1HE LYS 56 2HE LYS 56 -7.927 18.048 6.707 443 2HE LYS 56 1HE LYS 56 -7.211 19.351 7.655 444 1HZ LYS 56 1HZ LYS 56 -5.693 19.827 6.019 445 2HZ LYS 56 2HZ LYS 56 -7.026 19.369 5.085 446 3HZ LYS 56 3HZ LYS 56 -5.756 18.281 5.334 447 H ASN 57 H ASN 57 -6.383 13.451 9.019 448 HA ASN 57 HA ASN 57 -6.091 15.244 11.154 449 1HB ASN 57 2HB ASN 57 -8.121 14.157 11.228 450 2HB ASN 57 1HB ASN 57 -7.432 12.606 10.763 451 1HD2 ASN 57 1HD2 ASN 57 -6.731 11.216 12.314 452 2HD2 ASN 57 2HD2 ASN 57 -6.936 11.487 14.008 453 H LYS 58 H LYS 58 -4.844 11.935 10.733 454 HA LYS 58 HA LYS 58 -3.480 11.864 13.214 455 1HB LYS 58 2HB LYS 58 -3.347 10.233 10.703 456 2HB LYS 58 1HB LYS 58 -2.133 10.007 11.954 457 1HG LYS 58 2HG LYS 58 -5.102 9.594 12.178 458 2HG LYS 58 1HG LYS 58 -3.829 8.380 12.291 459 1HD LYS 58 2HD LYS 58 -3.947 10.678 14.217 460 2HD LYS 58 1HD LYS 58 -4.927 9.232 14.467 461 1HE LYS 58 2HE LYS 58 -3.170 8.276 15.431 462 2HE LYS 58 1HE LYS 58 -2.344 8.313 13.872 463 1HZ LYS 58 1HZ LYS 58 -1.620 9.650 16.174 464 2HZ LYS 58 2HZ LYS 58 -2.219 10.849 15.144 465 3HZ LYS 58 3HZ LYS 58 -0.955 9.850 14.630 466 H LEU 59 H LEU 59 -2.539 12.881 9.978 467 HA LEU 59 HA LEU 59 0.226 13.124 10.490 468 1HB LEU 59 2HB LEU 59 -1.356 14.778 8.528 469 2HB LEU 59 1HB LEU 59 0.353 14.388 8.459 470 HG LEU 59 HG LEU 59 -1.939 12.462 8.064 471 1HD1 LEU 59 1HD1 LEU 59 -1.847 13.228 5.976 472 2HD1 LEU 59 2HD1 LEU 59 -0.298 12.391 5.858 473 3HD1 LEU 59 3HD1 LEU 59 -0.345 14.105 6.273 474 1HD2 LEU 59 1HD2 LEU 59 -0.052 11.410 9.232 475 2HD2 LEU 59 2HD2 LEU 59 1.028 11.941 7.943 476 3HD2 LEU 59 3HD2 LEU 59 -0.256 10.782 7.597 477 H ALA 60 H ALA 60 -2.393 15.529 10.537 478 HA ALA 60 HA ALA 60 -0.840 17.720 11.329 479 1HB ALA 60 1HB ALA 60 -3.534 17.248 10.785 480 2HB ALA 60 2HB ALA 60 -2.778 18.797 11.154 481 3HB ALA 60 3HB ALA 60 -3.497 17.837 12.447 482 H GLN 61 H GLN 61 -2.238 15.081 13.139 483 HA GLN 61 HA GLN 61 -2.114 16.156 15.719 484 1HB GLN 61 2HB GLN 61 -2.700 13.652 14.552 485 2HB GLN 61 1HB GLN 61 -1.464 13.359 15.768 486 1HG GLN 61 2HG GLN 61 -2.904 13.631 17.432 487 2HG GLN 61 1HG GLN 61 -3.531 15.130 16.746 488 1HE2 GLN 61 1HE2 GLN 61 -3.592 11.666 15.955 489 2HE2 GLN 61 2HE2 GLN 61 -5.288 11.598 15.631 490 H LEU 62 H LEU 62 0.289 14.092 14.048 491 HA LEU 62 HA LEU 62 2.394 15.436 15.557 492 1HB LEU 62 2HB LEU 62 3.253 12.819 15.639 493 2HB LEU 62 1HB LEU 62 2.623 13.747 16.985 494 HG LEU 62 HG LEU 62 0.307 12.871 16.216 495 1HD1 LEU 62 1HD1 LEU 62 2.193 11.061 14.744 496 2HD1 LEU 62 2HD1 LEU 62 0.769 11.904 14.133 497 3HD1 LEU 62 3HD1 LEU 62 0.582 10.537 15.232 498 1HD2 LEU 62 1HD2 LEU 62 1.448 10.501 17.251 499 2HD2 LEU 62 2HD2 LEU 62 0.565 11.758 18.117 500 3HD2 LEU 62 3HD2 LEU 62 2.318 11.860 17.961 501 H ASN 63 H ASN 63 1.547 13.143 12.996 502 HA ASN 63 HA ASN 63 4.121 13.054 11.813 503 1HB ASN 63 2HB ASN 63 1.521 12.614 10.344 504 2HB ASN 63 1HB ASN 63 3.097 11.904 10.000 505 1HD2 ASN 63 1HD2 ASN 63 0.154 11.275 11.240 506 2HD2 ASN 63 2HD2 ASN 63 0.543 9.960 12.290 507 H ILE 64 H ILE 64 3.475 13.553 9.082 508 HA ILE 64 HA ILE 64 3.433 16.500 9.101 509 HB ILE 64 HB ILE 64 4.679 14.686 7.034 510 1HG1 ILE 64 2HG1 ILE 64 6.206 16.435 8.944 511 2HG1 ILE 64 1HG1 ILE 64 5.725 14.806 9.411 512 1HG2 ILE 64 1HG2 ILE 64 4.147 16.676 5.943 513 2HG2 ILE 64 2HG2 ILE 64 5.826 16.905 6.432 514 3HG2 ILE 64 3HG2 ILE 64 4.529 17.662 7.356 515 1HD1 ILE 64 1HD1 ILE 64 7.764 14.326 8.576 516 2HD1 ILE 64 2HD1 ILE 64 7.762 15.706 7.476 517 3HD1 ILE 64 3HD1 ILE 64 6.857 14.249 7.065 518 H GLU 65 H GLU 65 1.942 17.553 7.898 519 HA GLU 65 HA GLU 65 -0.273 16.158 6.850 520 1HB GLU 65 2HB GLU 65 0.228 18.763 7.573 521 2HB GLU 65 1HB GLU 65 0.074 18.878 5.825 522 1HG GLU 65 2HG GLU 65 -2.113 17.818 5.934 523 2HG GLU 65 1HG GLU 65 -1.959 17.660 7.682 524 H HIS 66 H HIS 66 2.683 16.197 5.616 525 HA HIS 66 HA HIS 66 1.760 16.201 2.822 526 1HB HIS 66 2HB HIS 66 3.510 17.922 3.493 527 2HB HIS 66 1HB HIS 66 4.617 16.571 3.717 528 HD1 HIS 66 1HD HIS 66 3.705 18.978 1.278 529 HD2 HIS 66 2HD HIS 66 4.687 14.940 1.149 530 HE1 HIS 66 1HE HIS 66 4.371 18.524 -1.105 531 HE2 HIS 66 2HE HIS 66 4.923 16.066 -1.168 532 H LYS 67 H LYS 67 1.498 14.236 2.057 533 HA LYS 67 HA LYS 67 3.488 12.184 2.741 534 1HB LYS 67 2HB LYS 67 0.618 12.160 3.235 535 2HB LYS 67 1HB LYS 67 1.143 10.772 2.293 536 1HG LYS 67 2HG LYS 67 1.213 10.146 4.576 537 2HG LYS 67 1HG LYS 67 2.882 10.353 4.041 538 1HD LYS 67 2HD LYS 67 2.664 12.743 4.959 539 2HD LYS 67 1HD LYS 67 1.234 12.140 5.797 540 1HE LYS 67 2HE LYS 67 2.441 10.862 7.229 541 2HE LYS 67 1HE LYS 67 3.693 10.519 6.035 542 1HZ LYS 67 1HZ LYS 67 3.691 12.456 8.082 543 2HZ LYS 67 2HZ LYS 67 3.820 13.237 6.586 544 3HZ LYS 67 3HZ LYS 67 4.939 12.044 7.017 545 H ASN 68 H ASN 68 3.963 13.517 0.547 546 HA ASN 68 HA ASN 68 4.376 13.323 -1.674 547 1HB ASN 68 2HB ASN 68 3.729 10.559 -0.853 548 2HB ASN 68 1HB ASN 68 3.608 10.888 -2.580 549 1HD2 ASN 68 1HD2 ASN 68 5.500 11.941 -3.575 550 2HD2 ASN 68 2HD2 ASN 68 7.071 11.496 -3.010 551 H PHE 69 H PHE 69 3.260 14.404 -3.129 552 HA PHE 69 HA PHE 69 0.422 13.711 -3.555 553 1HB PHE 69 2HB PHE 69 1.724 16.445 -3.699 554 2HB PHE 69 1HB PHE 69 0.053 16.101 -4.132 555 HD1 PHE 69 1HD PHE 69 -1.581 16.428 -2.553 556 HD2 PHE 69 2HD PHE 69 2.410 15.710 -1.263 557 HE1 PHE 69 1HE PHE 69 -2.269 16.815 -0.224 558 HE2 PHE 69 2HE PHE 69 1.728 16.093 1.070 559 HZ PHE 69 HZ PHE 69 -0.614 16.646 1.591 560 H THR 70 H THR 70 1.032 12.282 -5.253 561 HA THR 70 HA THR 70 1.455 13.661 -7.784 562 HB THR 70 HB THR 70 3.146 11.242 -7.214 563 HG1 THR 70 1HG THR 70 4.695 13.362 -7.150 564 1HG2 THR 70 1HG2 THR 70 2.652 12.154 -9.561 565 2HG2 THR 70 2HG2 THR 70 4.339 11.867 -9.134 566 3HG2 THR 70 3HG2 THR 70 3.690 13.508 -9.111 567 H SER 71 H SER 71 -0.311 13.038 -8.864 568 HA SER 71 HA SER 71 -1.739 10.662 -8.415 569 1HB SER 71 2HB SER 71 -3.056 11.254 -10.335 570 2HB SER 71 1HB SER 71 -2.640 12.750 -9.498 571 HG SER 71 HG SER 71 -1.849 11.821 -11.983 572 H LYS 72 H LYS 72 -1.071 8.666 -8.808 573 HA LYS 72 HA LYS 72 0.622 8.188 -11.168 574 1HB LYS 72 2HB LYS 72 0.467 6.728 -8.533 575 2HB LYS 72 1HB LYS 72 1.307 6.082 -9.936 576 1HG LYS 72 2HG LYS 72 2.429 8.524 -9.802 577 2HG LYS 72 1HG LYS 72 2.076 8.245 -8.096 578 1HD LYS 72 2HD LYS 72 3.284 6.123 -8.186 579 2HD LYS 72 1HD LYS 72 3.615 6.376 -9.900 580 1HE LYS 72 2HE LYS 72 4.641 8.636 -9.031 581 2HE LYS 72 1HE LYS 72 4.770 7.742 -7.516 582 1HZ LYS 72 1HZ LYS 72 6.638 6.890 -8.315 583 2HZ LYS 72 2HZ LYS 72 6.377 7.555 -9.849 584 3HZ LYS 72 3HZ LYS 72 5.723 6.044 -9.461 585 H LYS 73 H LYS 73 0.168 6.454 -12.527 586 HA LYS 73 HA LYS 73 -2.428 5.132 -12.094 587 1HB LYS 73 2HB LYS 73 -2.662 5.246 -14.638 588 2HB LYS 73 1HB LYS 73 -2.915 6.732 -13.742 589 1HG LYS 73 2HG LYS 73 -0.605 7.406 -14.258 590 2HG LYS 73 1HG LYS 73 -0.431 5.955 -15.248 591 1HD LYS 73 2HD LYS 73 -1.647 6.816 -16.941 592 2HD LYS 73 1HD LYS 73 -2.795 7.597 -15.851 593 1HE LYS 73 2HE LYS 73 -0.059 8.716 -15.913 594 2HE LYS 73 1HE LYS 73 -1.034 8.948 -17.363 595 1HZ LYS 73 1HZ LYS 73 -2.729 9.571 -15.325 596 2HZ LYS 73 2HZ LYS 73 -1.898 10.680 -16.293 597 3HZ LYS 73 3HZ LYS 73 -1.251 10.210 -14.803 598 H LEU 74 H LEU 74 -1.541 3.196 -11.423 599 HA LEU 74 HA LEU 74 0.623 1.866 -12.571 600 1HB LEU 74 2HB LEU 74 0.049 0.908 -10.583 601 2HB LEU 74 1HB LEU 74 -1.671 1.102 -10.861 602 HG LEU 74 HG LEU 74 -0.522 -0.838 -12.685 603 1HD1 LEU 74 1HD1 LEU 74 -0.537 -2.329 -10.329 604 2HD1 LEU 74 2HD1 LEU 74 0.435 -0.901 -9.972 605 3HD1 LEU 74 3HD1 LEU 74 0.856 -1.935 -11.337 606 1HD2 LEU 74 1HD2 LEU 74 -2.329 -2.163 -11.188 607 2HD2 LEU 74 2HD2 LEU 74 -2.755 -1.123 -12.547 608 3HD2 LEU 74 3HD2 LEU 74 -2.840 -0.500 -10.899 609 H THR 75 H THR 75 0.899 0.764 -14.411 610 HA THR 75 HA THR 75 -1.495 -0.028 -15.938 611 HB THR 75 HB THR 75 -0.021 0.398 -18.009 612 HG1 THR 75 1HG THR 75 1.240 2.432 -16.620 613 1HG2 THR 75 1HG2 THR 75 -1.432 2.389 -16.316 614 2HG2 THR 75 2HG2 THR 75 -1.788 1.841 -17.954 615 3HG2 THR 75 3HG2 THR 75 -0.487 2.999 -17.675 616 H GLN 76 H GLN 76 -0.466 -1.403 -17.966 617 HA GLN 76 HA GLN 76 0.304 -3.856 -16.808 618 1HB GLN 76 2HB GLN 76 -0.407 -2.873 -19.417 619 2HB GLN 76 1HB GLN 76 1.008 -3.910 -19.542 620 1HG GLN 76 2HG GLN 76 -0.132 -5.774 -18.966 621 2HG GLN 76 1HG GLN 76 -1.219 -4.908 -17.881 622 1HE2 GLN 76 1HE2 GLN 76 -3.059 -3.928 -18.712 623 2HE2 GLN 76 2HE2 GLN 76 -3.686 -4.320 -20.273 624 H LYS 77 H LYS 77 2.115 -1.344 -18.517 625 HA LYS 77 HA LYS 77 4.580 -2.658 -18.693 626 1HB LYS 77 2HB LYS 77 3.610 0.103 -18.908 627 2HB LYS 77 1HB LYS 77 5.276 -0.024 -18.362 628 1HG LYS 77 2HG LYS 77 5.871 -1.284 -20.326 629 2HG LYS 77 1HG LYS 77 4.187 -1.320 -20.851 630 1HD LYS 77 2HD LYS 77 4.722 0.501 -22.046 631 2HD LYS 77 1HD LYS 77 4.624 1.357 -20.507 632 1HE LYS 77 2HE LYS 77 7.193 0.152 -20.702 633 2HE LYS 77 1HE LYS 77 6.872 1.015 -22.206 634 1HZ LYS 77 1HZ LYS 77 7.107 2.066 -19.475 635 2HZ LYS 77 2HZ LYS 77 6.116 2.882 -20.576 636 3HZ LYS 77 3HZ LYS 77 7.759 2.664 -20.917 637 H LEU 78 H LEU 78 3.202 -0.643 -16.132 638 HA LEU 78 HA LEU 78 5.473 -0.591 -14.464 639 1HB LEU 78 2HB LEU 78 2.774 0.323 -14.372 640 2HB LEU 78 1HB LEU 78 3.114 -0.526 -12.878 641 HG LEU 78 HG LEU 78 4.823 1.715 -13.952 642 1HD1 LEU 78 1HD1 LEU 78 2.248 1.868 -12.815 643 2HD1 LEU 78 2HD1 LEU 78 3.369 3.186 -13.160 644 3HD1 LEU 78 3HD1 LEU 78 3.393 2.398 -11.582 645 1HD2 LEU 78 1HD2 LEU 78 6.196 1.328 -12.242 646 2HD2 LEU 78 2HD2 LEU 78 5.361 -0.212 -12.037 647 3HD2 LEU 78 3HD2 LEU 78 4.856 1.196 -11.102 648 H CYS 79 H CYS 79 2.641 -2.732 -14.530 649 HA CYS 79 HA CYS 79 3.320 -4.292 -12.299 650 1HB CYS 79 2HB CYS 79 1.127 -4.587 -13.028 651 2HB CYS 79 1HB CYS 79 1.602 -4.739 -14.716 652 HG CYS 79 HG CYS 79 1.142 -7.268 -14.615 653 H ASP 80 H ASP 80 4.195 -4.542 -15.699 654 HA ASP 80 HA ASP 80 5.453 -7.055 -15.598 655 1HB ASP 80 2HB ASP 80 5.067 -4.992 -17.518 656 2HB ASP 80 1HB ASP 80 6.786 -5.376 -17.488 657 H GLU 81 H GLU 81 6.408 -3.979 -14.417 658 HA GLU 81 HA GLU 81 9.235 -4.542 -14.402 659 1HB GLU 81 2HB GLU 81 7.525 -2.312 -13.356 660 2HB GLU 81 1HB GLU 81 9.205 -2.452 -12.854 661 1HG GLU 81 2HG GLU 81 9.945 -2.287 -15.145 662 2HG GLU 81 1HG GLU 81 8.275 -2.271 -15.712 663 H SER 82 H SER 82 6.816 -4.050 -11.800 664 HA SER 82 HA SER 82 8.514 -4.979 -9.751 665 1HB SER 82 2HB SER 82 6.786 -4.503 -8.354 666 2HB SER 82 1HB SER 82 6.122 -3.708 -9.780 667 HG SER 82 HG SER 82 5.474 -6.217 -8.679 668 H ASP 83 H ASP 83 8.216 -6.926 -8.452 669 HA ASP 83 HA ASP 83 7.582 -9.237 -10.155 670 1HB ASP 83 2HB ASP 83 9.805 -8.629 -8.455 671 2HB ASP 83 1HB ASP 83 8.988 -10.057 -7.830 672 H PHE 84 H PHE 84 6.672 -7.556 -7.303 673 HA PHE 84 HA PHE 84 4.791 -9.728 -6.653 674 1HB PHE 84 2HB PHE 84 6.791 -8.476 -4.937 675 2HB PHE 84 1HB PHE 84 5.171 -8.382 -4.258 676 HD1 PHE 84 1HD PHE 84 7.760 -10.707 -5.497 677 HD2 PHE 84 2HD PHE 84 4.106 -10.281 -3.357 678 HE1 PHE 84 1HE PHE 84 7.951 -13.032 -4.715 679 HE2 PHE 84 2HE PHE 84 4.290 -12.605 -2.571 680 HZ PHE 84 HZ PHE 84 6.215 -13.983 -3.250 681 H LEU 85 H LEU 85 2.765 -9.094 -6.909 682 HA LEU 85 HA LEU 85 2.115 -6.245 -6.873 683 1HB LEU 85 2HB LEU 85 0.765 -8.708 -7.906 684 2HB LEU 85 1HB LEU 85 -0.199 -7.285 -7.569 685 HG LEU 85 HG LEU 85 0.354 -7.331 -9.910 686 1HD1 LEU 85 1HD1 LEU 85 0.230 -5.128 -9.182 687 2HD1 LEU 85 2HD1 LEU 85 1.774 -5.191 -10.030 688 3HD1 LEU 85 3HD1 LEU 85 1.734 -5.241 -8.268 689 1HD2 LEU 85 1HD2 LEU 85 3.020 -6.897 -10.220 690 2HD2 LEU 85 2HD2 LEU 85 2.225 -8.458 -10.422 691 3HD2 LEU 85 3HD2 LEU 85 3.005 -8.058 -8.892 692 H ILE 86 H ILE 86 1.095 -5.299 -5.197 693 HA ILE 86 HA ILE 86 -0.296 -7.032 -3.269 694 HB ILE 86 HB ILE 86 1.582 -4.779 -2.566 695 1HG1 ILE 86 2HG1 ILE 86 1.799 -7.694 -1.819 696 2HG1 ILE 86 1HG1 ILE 86 2.533 -7.044 -3.282 697 1HG2 ILE 86 1HG2 ILE 86 0.658 -6.451 -0.384 698 2HG2 ILE 86 2HG2 ILE 86 -0.667 -5.602 -1.180 699 3HG2 ILE 86 3HG2 ILE 86 0.694 -4.693 -0.523 700 1HD1 ILE 86 1HD1 ILE 86 3.557 -5.326 -1.552 701 2HD1 ILE 86 2HD1 ILE 86 4.300 -6.892 -1.879 702 3HD1 ILE 86 3HD1 ILE 86 3.291 -6.675 -0.447 703 H THR 87 H THR 87 -2.322 -6.505 -3.169 704 HA THR 87 HA THR 87 -3.089 -3.669 -3.385 705 HB THR 87 HB THR 87 -5.407 -4.730 -3.961 706 HG1 THR 87 1HG THR 87 -5.028 -6.882 -3.745 707 1HG2 THR 87 1HG2 THR 87 -4.771 -4.813 -6.379 708 2HG2 THR 87 2HG2 THR 87 -3.084 -4.657 -5.886 709 3HG2 THR 87 3HG2 THR 87 -4.228 -3.360 -5.540 710 H MET 88 H MET 88 -4.710 -2.924 -1.951 711 HA MET 88 HA MET 88 -5.098 -4.657 0.397 712 1HB MET 88 2HB MET 88 -5.380 -1.708 0.666 713 2HB MET 88 1HB MET 88 -4.748 -2.886 1.809 714 1HG MET 88 2HG MET 88 -2.807 -1.864 1.288 715 2HG MET 88 1HG MET 88 -2.829 -3.042 -0.024 716 1HE MET 88 1HE MET 88 -0.973 -0.343 -1.120 717 2HE MET 88 2HE MET 88 -1.706 -0.990 -2.588 718 3HE MET 88 3HE MET 88 -1.292 -2.072 -1.258 719 H ASP 89 H ASP 89 -6.618 -2.890 -2.095 720 HA ASP 89 HA ASP 89 -9.139 -2.563 -0.729 721 1HB ASP 89 2HB ASP 89 -8.777 -2.386 -3.710 722 2HB ASP 89 1HB ASP 89 -9.918 -1.521 -2.685 723 H ASN 90 H ASN 90 -10.797 -3.954 -0.696 724 HA ASN 90 HA ASN 90 -10.453 -6.631 -1.372 725 1HB ASN 90 2HB ASN 90 -12.172 -5.465 0.220 726 2HB ASN 90 1HB ASN 90 -13.199 -5.439 -1.210 727 1HD2 ASN 90 1HD2 ASN 90 -13.208 -6.949 1.421 728 2HD2 ASN 90 2HD2 ASN 90 -13.446 -8.595 0.950 729 H SER 91 H SER 91 -11.677 -3.962 -3.247 730 HA SER 91 HA SER 91 -12.722 -5.697 -5.328 731 1HB SER 91 2HB SER 91 -12.495 -2.833 -5.940 732 2HB SER 91 1HB SER 91 -13.896 -3.900 -6.028 733 HG SER 91 HG SER 91 -12.852 -2.583 -3.749 734 H ASN 92 H ASN 92 -9.826 -3.944 -4.608 735 HA ASN 92 HA ASN 92 -8.801 -3.569 -7.185 736 1HB ASN 92 2HB ASN 92 -7.911 -3.104 -4.596 737 2HB ASN 92 1HB ASN 92 -6.745 -4.254 -5.242 738 1HD2 ASN 92 1HD2 ASN 92 -7.622 -1.041 -5.053 739 2HD2 ASN 92 2HD2 ASN 92 -6.601 -0.416 -6.299 740 H PHE 93 H PHE 93 -8.949 -6.408 -5.166 741 HA PHE 93 HA PHE 93 -7.013 -7.962 -6.502 742 1HB PHE 93 2HB PHE 93 -8.206 -8.375 -4.230 743 2HB PHE 93 1HB PHE 93 -9.446 -9.156 -5.206 744 HD1 PHE 93 1HD PHE 93 -5.737 -9.171 -4.791 745 HD2 PHE 93 2HD PHE 93 -9.272 -11.417 -5.552 746 HE1 PHE 93 1HE PHE 93 -4.412 -11.245 -4.807 747 HE2 PHE 93 2HE PHE 93 -7.954 -13.494 -5.567 748 HZ PHE 93 HZ PHE 93 -5.520 -13.409 -5.194 749 H LYS 94 H LYS 94 -10.547 -7.762 -6.876 750 HA LYS 94 HA LYS 94 -10.694 -9.629 -8.997 751 1HB LYS 94 2HB LYS 94 -12.952 -9.119 -9.111 752 2HB LYS 94 1HB LYS 94 -12.570 -8.683 -7.453 753 1HG LYS 94 2HG LYS 94 -12.116 -6.330 -8.712 754 2HG LYS 94 1HG LYS 94 -13.409 -7.003 -9.706 755 1HD LYS 94 2HD LYS 94 -13.769 -7.199 -6.780 756 2HD LYS 94 1HD LYS 94 -13.847 -5.576 -7.469 757 1HE LYS 94 2HE LYS 94 -15.343 -7.527 -9.022 758 2HE LYS 94 1HE LYS 94 -15.912 -7.408 -7.357 759 1HZ LYS 94 1HZ LYS 94 -15.464 -4.987 -8.985 760 2HZ LYS 94 2HZ LYS 94 -16.435 -5.177 -7.614 761 3HZ LYS 94 3HZ LYS 94 -16.917 -5.848 -9.091 762 H ASN 95 H ASN 95 -10.012 -6.226 -8.842 763 HA ASN 95 HA ASN 95 -10.464 -5.594 -11.565 764 1HB ASN 95 2HB ASN 95 -9.263 -4.296 -9.223 765 2HB ASN 95 1HB ASN 95 -8.530 -3.821 -10.752 766 1HD2 ASN 95 1HD2 ASN 95 -10.799 -4.039 -12.384 767 2HD2 ASN 95 2HD2 ASN 95 -11.905 -2.787 -11.943 768 H VAL 96 H VAL 96 -7.409 -6.148 -9.802 769 HA VAL 96 HA VAL 96 -5.767 -6.150 -12.081 770 HB VAL 96 HB VAL 96 -4.074 -7.245 -10.672 771 1HG1 VAL 96 1HG1 VAL 96 -5.441 -5.194 -8.967 772 2HG1 VAL 96 2HG1 VAL 96 -4.724 -4.761 -10.519 773 3HG1 VAL 96 3HG1 VAL 96 -3.717 -5.441 -9.242 774 1HG2 VAL 96 1HG2 VAL 96 -4.640 -8.584 -8.995 775 2HG2 VAL 96 2HG2 VAL 96 -6.341 -8.226 -9.289 776 3HG2 VAL 96 3HG2 VAL 96 -5.414 -7.237 -8.160 777 H LEU 97 H LEU 97 -7.832 -8.560 -10.728 778 HA LEU 97 HA LEU 97 -6.678 -10.916 -11.648 779 1HB LEU 97 2HB LEU 97 -9.105 -10.150 -10.478 780 2HB LEU 97 1HB LEU 97 -9.548 -10.965 -11.965 781 HG LEU 97 HG LEU 97 -7.797 -12.759 -11.039 782 1HD1 LEU 97 1HD1 LEU 97 -8.596 -11.109 -8.709 783 2HD1 LEU 97 2HD1 LEU 97 -7.098 -11.985 -9.018 784 3HD1 LEU 97 3HD1 LEU 97 -8.539 -12.859 -8.498 785 1HD2 LEU 97 1HD2 LEU 97 -9.608 -14.091 -10.661 786 2HD2 LEU 97 2HD2 LEU 97 -10.397 -12.773 -11.527 787 3HD2 LEU 97 3HD2 LEU 97 -10.479 -12.845 -9.767 788 H LYS 98 H LYS 98 -8.900 -8.710 -13.324 789 HA LYS 98 HA LYS 98 -8.455 -10.208 -15.811 790 1HB LYS 98 2HB LYS 98 -10.806 -9.631 -14.899 791 2HB LYS 98 1HB LYS 98 -10.467 -8.002 -15.467 792 1HG LYS 98 2HG LYS 98 -10.915 -8.547 -17.572 793 2HG LYS 98 1HG LYS 98 -9.894 -9.984 -17.497 794 1HD LYS 98 2HD LYS 98 -11.938 -10.961 -17.839 795 2HD LYS 98 1HD LYS 98 -11.907 -10.923 -16.075 796 1HE LYS 98 2HE LYS 98 -13.765 -9.710 -16.071 797 2HE LYS 98 1HE LYS 98 -12.935 -8.440 -16.968 798 1HZ LYS 98 1HZ LYS 98 -14.046 -8.956 -18.805 799 2HZ LYS 98 2HZ LYS 98 -15.041 -9.940 -17.855 800 3HZ LYS 98 3HZ LYS 98 -13.709 -10.609 -18.655 801 H ASN 99 H ASN 99 -7.285 -7.559 -14.199 802 HA ASN 99 HA ASN 99 -7.032 -5.708 -16.357 803 1HB ASN 99 2HB ASN 99 -6.696 -5.576 -13.625 804 2HB ASN 99 1HB ASN 99 -5.043 -5.469 -14.222 805 1HD2 ASN 99 1HD2 ASN 99 -4.340 -3.543 -14.780 806 2HD2 ASN 99 2HD2 ASN 99 -5.322 -2.168 -15.139 807 H PHE 100 H PHE 100 -4.642 -7.788 -14.701 808 HA PHE 100 HA PHE 100 -2.843 -7.432 -16.984 809 1HB PHE 100 2HB PHE 100 -2.229 -8.742 -14.334 810 2HB PHE 100 1HB PHE 100 -1.075 -8.232 -15.562 811 HD1 PHE 100 1HD PHE 100 -2.036 -7.471 -12.448 812 HD2 PHE 100 2HD PHE 100 -1.735 -5.569 -16.245 813 HE1 PHE 100 1HE PHE 100 -1.828 -5.287 -11.334 814 HE2 PHE 100 2HE PHE 100 -1.526 -3.383 -15.136 815 HZ PHE 100 HZ PHE 100 -1.570 -3.240 -12.679 816 H THR 101 H THR 101 -1.334 -9.551 -17.110 817 HA THR 101 HA THR 101 -2.911 -11.497 -18.410 818 HB THR 101 HB THR 101 -0.597 -12.815 -18.163 819 HG1 THR 101 1HG THR 101 0.812 -10.612 -18.326 820 1HG2 THR 101 1HG2 THR 101 -0.475 -12.318 -20.335 821 2HG2 THR 101 2HG2 THR 101 -0.149 -10.620 -19.987 822 3HG2 THR 101 3HG2 THR 101 -1.814 -11.195 -20.087 823 H ASN 102 H ASN 102 -1.870 -13.923 -17.792 824 HA ASN 102 HA ASN 102 -3.461 -14.772 -15.629 825 1HB ASN 102 2HB ASN 102 -2.357 -16.006 -17.763 826 2HB ASN 102 1HB ASN 102 -1.257 -16.544 -16.497 827 1HD2 ASN 102 1HD2 ASN 102 -4.747 -16.088 -16.951 828 2HD2 ASN 102 2HD2 ASN 102 -5.207 -17.598 -16.250 829 H THR 103 H THR 103 -0.935 -12.918 -15.207 830 HA THR 103 HA THR 103 0.499 -14.462 -13.210 831 HB THR 103 HB THR 103 1.679 -12.868 -14.752 832 HG1 THR 103 1HG THR 103 2.633 -11.745 -12.645 833 1HG2 THR 103 1HG2 THR 103 0.548 -10.713 -12.974 834 2HG2 THR 103 2HG2 THR 103 -0.110 -11.090 -14.566 835 3HG2 THR 103 3HG2 THR 103 1.551 -10.517 -14.411 836 H GLN 104 H GLN 104 -2.404 -13.227 -13.094 837 HA GLN 104 HA GLN 104 -2.510 -11.369 -11.020 838 1HB GLN 104 2HB GLN 104 -4.632 -13.456 -11.175 839 2HB GLN 104 1HB GLN 104 -4.784 -11.716 -10.985 840 1HG GLN 104 2HG GLN 104 -5.429 -11.727 -13.113 841 2HG GLN 104 1HG GLN 104 -3.715 -11.915 -13.484 842 1HE2 GLN 104 1HE2 GLN 104 -5.398 -12.783 -15.331 843 2HE2 GLN 104 2HE2 GLN 104 -5.486 -14.509 -15.356 844 H ASN 105 H ASN 105 -1.652 -14.675 -10.926 845 HA ASN 105 HA ASN 105 -2.434 -15.239 -8.246 846 1HB ASN 105 2HB ASN 105 -0.954 -16.593 -10.376 847 2HB ASN 105 1HB ASN 105 -0.319 -16.935 -8.769 848 1HD2 ASN 105 1HD2 ASN 105 -2.678 -16.806 -7.303 849 2HD2 ASN 105 2HD2 ASN 105 -3.691 -18.129 -7.761 850 H LYS 106 H LYS 106 -0.314 -13.020 -9.307 851 HA LYS 106 HA LYS 106 1.620 -13.445 -7.139 852 1HB LYS 106 2HB LYS 106 1.713 -11.826 -9.673 853 2HB LYS 106 1HB LYS 106 2.853 -11.546 -8.364 854 1HG LYS 106 2HG LYS 106 2.885 -14.306 -8.796 855 2HG LYS 106 1HG LYS 106 2.869 -13.571 -10.401 856 1HD LYS 106 2HD LYS 106 5.036 -13.122 -10.190 857 2HD LYS 106 1HD LYS 106 4.666 -12.072 -8.821 858 1HE LYS 106 2HE LYS 106 5.194 -15.039 -8.694 859 2HE LYS 106 1HE LYS 106 6.319 -13.768 -8.220 860 1HZ LYS 106 1HZ LYS 106 4.838 -13.105 -6.471 861 2HZ LYS 106 2HZ LYS 106 5.129 -14.765 -6.331 862 3HZ LYS 106 3HZ LYS 106 3.663 -14.217 -6.971 863 H VAL 107 H VAL 107 -1.232 -12.207 -7.189 864 HA VAL 107 HA VAL 107 -0.538 -9.633 -5.939 865 HB VAL 107 HB VAL 107 -3.304 -10.469 -6.794 866 1HG1 VAL 107 1HG1 VAL 107 -3.612 -7.982 -6.873 867 2HG1 VAL 107 2HG1 VAL 107 -2.019 -7.826 -6.133 868 3HG1 VAL 107 3HG1 VAL 107 -3.319 -8.642 -5.265 869 1HG2 VAL 107 1HG2 VAL 107 -2.806 -10.161 -8.937 870 2HG2 VAL 107 2HG2 VAL 107 -1.108 -9.968 -8.501 871 3HG2 VAL 107 3HG2 VAL 107 -2.164 -8.559 -8.581 872 H LEU 108 H LEU 108 -1.099 -9.196 -3.860 873 HA LEU 108 HA LEU 108 -2.610 -11.251 -2.391 874 1HB LEU 108 2HB LEU 108 -0.981 -10.377 -0.449 875 2HB LEU 108 1HB LEU 108 -0.627 -11.773 -1.449 876 HG LEU 108 HG LEU 108 0.346 -9.105 -2.361 877 1HD1 LEU 108 1HD1 LEU 108 2.459 -9.615 -1.023 878 2HD1 LEU 108 2HD1 LEU 108 1.437 -10.668 -0.044 879 3HD1 LEU 108 3HD1 LEU 108 1.085 -8.943 -0.146 880 1HD2 LEU 108 1HD2 LEU 108 0.619 -11.741 -3.212 881 2HD2 LEU 108 2HD2 LEU 108 2.166 -11.344 -2.465 882 3HD2 LEU 108 3HD2 LEU 108 1.537 -10.344 -3.773 883 H LYS 109 H LYS 109 -4.128 -10.517 -1.011 884 HA LYS 109 HA LYS 109 -4.659 -7.666 -1.006 885 1HB LYS 109 2HB LYS 109 -6.769 -8.468 0.240 886 2HB LYS 109 1HB LYS 109 -6.599 -8.881 -1.461 887 1HG LYS 109 2HG LYS 109 -5.533 -11.073 -0.521 888 2HG LYS 109 1HG LYS 109 -6.414 -10.630 0.942 889 1HD LYS 109 2HD LYS 109 -8.018 -10.397 -1.483 890 2HD LYS 109 1HD LYS 109 -7.435 -12.037 -1.188 891 1HE LYS 109 2HE LYS 109 -8.373 -11.981 1.059 892 2HE LYS 109 1HE LYS 109 -8.918 -10.324 0.803 893 1HZ LYS 109 1HZ LYS 109 -9.804 -12.318 -1.131 894 2HZ LYS 109 2HZ LYS 109 -10.631 -10.989 -0.492 895 3HZ LYS 109 3HZ LYS 109 -10.480 -12.407 0.417 896 H ILE 110 H ILE 110 -4.834 -6.384 0.813 897 HA ILE 110 HA ILE 110 -3.255 -7.252 3.093 898 HB ILE 110 HB ILE 110 -4.153 -4.657 1.999 899 1HG1 ILE 110 2HG1 ILE 110 -1.860 -5.469 1.736 900 2HG1 ILE 110 1HG1 ILE 110 -1.889 -3.988 2.688 901 1HG2 ILE 110 1HG2 ILE 110 -3.913 -5.117 4.956 902 2HG2 ILE 110 2HG2 ILE 110 -5.213 -4.325 4.067 903 3HG2 ILE 110 3HG2 ILE 110 -3.643 -3.536 4.223 904 1HD1 ILE 110 1HD1 ILE 110 -1.721 -5.381 4.737 905 2HD1 ILE 110 2HD1 ILE 110 -0.326 -5.504 3.666 906 3HD1 ILE 110 3HD1 ILE 110 -1.527 -6.795 3.704 907 H THR 111 H THR 111 -6.589 -6.672 2.273 908 HA THR 111 HA THR 111 -7.673 -6.364 4.836 909 HB THR 111 HB THR 111 -9.159 -7.950 2.778 910 HG1 THR 111 1HG THR 111 -9.649 -5.587 2.039 911 1HG2 THR 111 1HG2 THR 111 -9.867 -6.822 5.163 912 2HG2 THR 111 2HG2 THR 111 -10.990 -7.203 3.858 913 3HG2 THR 111 3HG2 THR 111 -10.345 -5.570 4.019 914 H ASP 112 H ASP 112 -6.628 -9.194 3.069 915 HA ASP 112 HA ASP 112 -7.710 -11.056 4.993 916 1HB ASP 112 2HB ASP 112 -7.016 -11.289 2.365 917 2HB ASP 112 1HB ASP 112 -5.610 -12.003 3.151 918 H PHE 113 H PHE 113 -4.781 -9.307 4.471 919 HA PHE 113 HA PHE 113 -3.213 -10.956 6.275 920 1HB PHE 113 2HB PHE 113 -2.628 -8.448 4.701 921 2HB PHE 113 1HB PHE 113 -1.495 -9.092 5.881 922 HD1 PHE 113 1HD PHE 113 -0.694 -8.694 3.122 923 HD2 PHE 113 2HD PHE 113 -2.619 -12.034 4.929 924 HE1 PHE 113 1HE PHE 113 0.251 -10.171 1.396 925 HE2 PHE 113 2HE PHE 113 -1.677 -13.515 3.205 926 HZ PHE 113 HZ PHE 113 -0.240 -12.583 1.435 927 H SER 114 H SER 114 -5.354 -8.345 6.461 928 HA SER 114 HA SER 114 -4.423 -7.731 9.179 929 1HB SER 114 2HB SER 114 -5.174 -5.419 8.881 930 2HB SER 114 1HB SER 114 -3.977 -5.841 7.657 931 HG SER 114 HG SER 114 -5.417 -5.462 6.188 932 HA PRO 115 HA PRO 115 -8.905 -9.079 9.189 933 1HB PRO 115 2HB PRO 115 -8.694 -11.341 10.605 934 2HB PRO 115 1HB PRO 115 -8.358 -11.308 8.869 935 1HG PRO 115 2HG PRO 115 -6.445 -11.283 11.170 936 2HG PRO 115 1HG PRO 115 -6.353 -12.189 9.648 937 1HD PRO 115 2HD PRO 115 -5.003 -9.844 10.133 938 2HD PRO 115 1HD PRO 115 -5.449 -10.419 8.515 939 H SER 116 H SER 116 -6.519 -8.239 11.417 940 HA SER 116 HA SER 116 -7.946 -8.564 13.851 941 1HB SER 116 2HB SER 116 -5.642 -8.348 14.152 942 2HB SER 116 1HB SER 116 -5.520 -7.006 13.016 943 HG SER 116 HG SER 116 -5.390 -6.509 15.352 944 H LEU 117 H LEU 117 -8.141 -6.289 11.301 945 HA LEU 117 HA LEU 117 -9.811 -4.540 12.985 946 1HB LEU 117 2HB LEU 117 -7.728 -3.925 10.988 947 2HB LEU 117 1HB LEU 117 -9.179 -2.946 10.890 948 HG LEU 117 HG LEU 117 -8.075 -3.212 13.602 949 1HD1 LEU 117 1HD1 LEU 117 -5.956 -2.783 13.082 950 2HD1 LEU 117 2HD1 LEU 117 -6.504 -1.187 12.570 951 3HD1 LEU 117 3HD1 LEU 117 -6.351 -2.488 11.389 952 1HD2 LEU 117 1HD2 LEU 117 -9.457 -1.240 11.909 953 2HD2 LEU 117 2HD2 LEU 117 -8.322 -0.578 13.087 954 3HD2 LEU 117 3HD2 LEU 117 -9.653 -1.603 13.623 955 H ASN 118 H ASN 118 -9.350 -5.824 9.707 956 HA ASN 118 HA ASN 118 -10.805 -6.257 8.014 957 1HB ASN 118 2HB ASN 118 -11.874 -7.438 10.168 958 2HB ASN 118 1HB ASN 118 -13.160 -6.282 9.833 959 1HD2 ASN 118 1HD2 ASN 118 -11.017 -8.259 7.809 960 2HD2 ASN 118 2HD2 ASN 118 -12.281 -8.988 6.887 961 H TYR 119 H TYR 119 -10.633 -4.247 7.010 962 HA TYR 119 HA TYR 119 -12.720 -2.283 7.661 963 1HB TYR 119 2HB TYR 119 -11.326 -0.634 6.521 964 2HB TYR 119 1HB TYR 119 -10.399 -1.460 7.769 965 HD1 TYR 119 1HD TYR 119 -10.947 -1.207 4.119 966 HD2 TYR 119 2HD TYR 119 -8.466 -2.732 7.221 967 HE1 TYR 119 1HE TYR 119 -9.232 -1.777 2.450 968 HE2 TYR 119 2HE TYR 119 -6.742 -3.304 5.564 969 HH TYR 119 HH TYR 119 -6.507 -3.729 3.225 970 H ASP 120 H ASP 120 -12.852 -0.838 5.391 971 HA ASP 120 HA ASP 120 -13.593 -2.713 3.257 972 1HB ASP 120 2HB ASP 120 -15.290 -0.395 4.219 973 2HB ASP 120 1HB ASP 120 -15.653 -1.429 2.840 974 H GLU 121 H GLU 121 -11.676 -2.092 2.195 975 HA GLU 121 HA GLU 121 -10.419 -0.919 0.712 976 1HB GLU 121 2HB GLU 121 -13.149 -0.104 0.228 977 2HB GLU 121 1HB GLU 121 -12.045 1.225 -0.096 978 1HG GLU 121 2HG GLU 121 -11.265 0.275 -1.954 979 2HG GLU 121 1HG GLU 121 -11.148 -1.315 -1.203 980 H VAL 122 H VAL 122 -8.888 -0.096 2.103 981 HA VAL 122 HA VAL 122 -7.718 1.405 3.337 982 HB VAL 122 HB VAL 122 -7.391 3.455 2.379 983 1HG1 VAL 122 1HG1 VAL 122 -8.451 3.179 -0.104 984 2HG1 VAL 122 2HG1 VAL 122 -8.512 1.518 0.487 985 3HG1 VAL 122 3HG1 VAL 122 -6.977 2.386 0.455 986 1HG2 VAL 122 1HG2 VAL 122 -9.579 4.382 3.029 987 2HG2 VAL 122 2HG2 VAL 122 -10.301 3.626 1.610 988 3HG2 VAL 122 3HG2 VAL 122 -9.085 4.887 1.413 989 HA PRO 123 HA PRO 123 -10.161 2.944 6.688 990 1HB PRO 123 2HB PRO 123 -8.419 4.512 7.975 991 2HB PRO 123 1HB PRO 123 -8.153 2.774 7.810 992 1HG PRO 123 2HG PRO 123 -6.860 5.033 6.378 993 2HG PRO 123 1HG PRO 123 -6.188 3.463 6.844 994 1HD PRO 123 2HD PRO 123 -7.166 4.196 4.302 995 2HD PRO 123 1HD PRO 123 -6.741 2.561 4.845 996 H ASP 124 H ASP 124 -9.433 5.594 7.894 997 HA ASP 124 HA ASP 124 -10.071 7.773 7.879 998 1HB ASP 124 2HB ASP 124 -9.454 8.829 6.016 999 2HB ASP 124 1HB ASP 124 -9.378 7.282 5.181 1000 HA PRO 125 HA PRO 125 -14.410 7.712 8.490 1001 1HB PRO 125 2HB PRO 125 -15.106 10.309 7.961 1002 2HB PRO 125 1HB PRO 125 -14.335 9.775 9.458 1003 1HG PRO 125 2HG PRO 125 -13.099 11.016 7.029 1004 2HG PRO 125 1HG PRO 125 -12.787 11.358 8.742 1005 1HD PRO 125 2HD PRO 125 -11.125 9.830 7.307 1006 2HD PRO 125 1HD PRO 125 -11.474 9.463 9.009 1007 H TRP 126 H TRP 126 -13.228 8.897 5.435 1008 HA TRP 126 HA TRP 126 -15.671 9.196 4.087 1009 1HB TRP 126 2HB TRP 126 -13.261 9.862 3.386 1010 2HB TRP 126 1HB TRP 126 -13.169 8.233 2.729 1011 HD1 TRP 126 HD TRP 126 -14.573 11.655 1.997 1012 HE1 TRP 126 1HE TRP 126 -15.718 11.630 -0.309 1013 HE3 TRP 126 3HE TRP 126 -14.559 6.616 1.137 1014 HZ2 TRP 126 2HZ TRP 126 -16.505 9.723 -2.235 1015 HZ3 TRP 126 3HZ TRP 126 -15.529 5.774 -0.961 1016 HH2 TRP 126 HH TRP 126 -16.482 7.298 -2.611 1017 H TYR 127 H TYR 127 -13.682 6.369 4.725 1018 HA TYR 127 HA TYR 127 -15.523 4.710 3.158 1019 1HB TYR 127 2HB TYR 127 -12.754 4.196 4.235 1020 2HB TYR 127 1HB TYR 127 -13.754 2.930 3.533 1021 HD1 TYR 127 1HD TYR 127 -12.218 6.232 2.766 1022 HD2 TYR 127 2HD TYR 127 -13.761 2.580 1.225 1023 HE1 TYR 127 1HE TYR 127 -11.421 6.851 0.523 1024 HE2 TYR 127 2HE TYR 127 -12.968 3.183 -1.020 1025 HH TYR 127 HH TYR 127 -11.095 4.722 -1.959 1026 H SER 128 H SER 128 -14.027 4.861 6.390 1027 HA SER 128 HA SER 128 -15.927 2.830 7.312 1028 1HB SER 128 2HB SER 128 -13.366 2.783 7.770 1029 2HB SER 128 1HB SER 128 -13.735 3.977 9.014 1030 HG SER 128 HG SER 128 -13.794 1.850 9.839 1031 H GLY 129 H GLY 129 -14.629 5.942 8.518 1032 1HA GLY 129 2HA GLY 129 -16.494 7.614 8.949 1033 2HA GLY 129 1HA GLY 129 -17.210 6.323 9.903 1034 H ASN 130 H ASN 130 -13.771 6.589 9.990 1035 HA ASN 130 HA ASN 130 -13.848 8.200 12.432 1036 1HB ASN 130 2HB ASN 130 -13.945 5.586 12.793 1037 2HB ASN 130 1HB ASN 130 -12.217 5.693 12.472 1038 1HD2 ASN 130 1HD2 ASN 130 -11.003 7.246 13.791 1039 2HD2 ASN 130 2HD2 ASN 130 -11.469 7.461 15.441 1040 H PHE 131 H PHE 131 -11.964 9.318 12.879 1041 HA PHE 131 HA PHE 131 -10.157 9.651 10.653 1042 1HB PHE 131 2HB PHE 131 -9.557 10.979 13.237 1043 2HB PHE 131 1HB PHE 131 -9.568 11.641 11.605 1044 HD1 PHE 131 1HD PHE 131 -11.811 12.125 10.528 1045 HD2 PHE 131 2HD PHE 131 -11.349 11.330 14.682 1046 HE1 PHE 131 1HE PHE 131 -13.993 13.174 10.967 1047 HE2 PHE 131 2HE PHE 131 -13.531 12.375 15.130 1048 HZ PHE 131 HZ PHE 131 -14.856 13.299 13.271 1049 H ASP 132 H ASP 132 -10.047 8.360 13.914 1050 HA ASP 132 HA ASP 132 -7.258 7.888 14.021 1051 1HB ASP 132 2HB ASP 132 -9.595 6.735 15.542 1052 2HB ASP 132 1HB ASP 132 -7.937 6.223 15.845 1053 H GLU 133 H GLU 133 -9.867 6.299 12.481 1054 HA GLU 133 HA GLU 133 -9.012 3.663 12.357 1055 1HB GLU 133 2HB GLU 133 -11.204 4.296 11.584 1056 2HB GLU 133 1HB GLU 133 -10.515 5.315 10.327 1057 1HG GLU 133 2HG GLU 133 -10.636 3.610 8.934 1058 2HG GLU 133 1HG GLU 133 -9.446 2.759 9.917 1059 H THR 134 H THR 134 -7.999 6.452 10.454 1060 HA THR 134 HA THR 134 -6.624 5.137 8.422 1061 HB THR 134 HB THR 134 -5.158 7.222 8.360 1062 HG1 THR 134 1HG THR 134 -5.249 8.253 10.224 1063 1HG2 THR 134 1HG2 THR 134 -6.895 7.247 6.834 1064 2HG2 THR 134 2HG2 THR 134 -7.243 8.682 7.799 1065 3HG2 THR 134 3HG2 THR 134 -8.135 7.189 8.086 1066 H TYR 135 H TYR 135 -5.399 6.266 11.569 1067 HA TYR 135 HA TYR 135 -2.756 5.391 11.190 1068 1HB TYR 135 2HB TYR 135 -3.617 6.969 12.977 1069 2HB TYR 135 1HB TYR 135 -4.156 5.539 13.853 1070 HD1 TYR 135 1HD TYR 135 -1.089 6.949 12.251 1071 HD2 TYR 135 2HD TYR 135 -2.706 4.549 15.370 1072 HE1 TYR 135 1HE TYR 135 1.159 6.702 13.220 1073 HE2 TYR 135 2HE TYR 135 -0.463 4.298 16.347 1074 HH TYR 135 HH TYR 135 1.956 6.127 15.900 1075 H LYS 136 H LYS 136 -5.497 3.806 12.813 1076 HA LYS 136 HA LYS 136 -4.191 1.540 13.719 1077 1HB LYS 136 2HB LYS 136 -6.895 2.398 13.402 1078 2HB LYS 136 1HB LYS 136 -6.770 0.744 12.820 1079 1HG LYS 136 2HG LYS 136 -7.316 0.544 15.080 1080 2HG LYS 136 1HG LYS 136 -5.580 0.236 15.014 1081 1HD LYS 136 2HD LYS 136 -5.093 2.450 15.794 1082 2HD LYS 136 1HD LYS 136 -6.789 2.921 15.661 1083 1HE LYS 136 2HE LYS 136 -7.394 1.790 17.556 1084 2HE LYS 136 1HE LYS 136 -6.110 0.594 17.383 1085 1HZ LYS 136 1HZ LYS 136 -4.543 2.038 18.281 1086 2HZ LYS 136 2HZ LYS 136 -5.907 2.296 19.248 1087 3HZ LYS 136 3HZ LYS 136 -5.504 3.410 18.041 1088 H ILE 137 H ILE 137 -5.925 1.911 10.627 1089 HA ILE 137 HA ILE 137 -5.197 -0.641 9.640 1090 HB ILE 137 HB ILE 137 -5.936 1.704 7.913 1091 1HG1 ILE 137 2HG1 ILE 137 -7.487 1.545 9.853 1092 2HG1 ILE 137 1HG1 ILE 137 -8.273 1.215 8.311 1093 1HG2 ILE 137 1HG2 ILE 137 -6.052 -1.272 7.658 1094 2HG2 ILE 137 2HG2 ILE 137 -5.409 -0.075 6.534 1095 3HG2 ILE 137 3HG2 ILE 137 -7.154 -0.255 6.730 1096 1HD1 ILE 137 1HD1 ILE 137 -7.502 -0.734 10.456 1097 2HD1 ILE 137 2HD1 ILE 137 -7.949 -1.236 8.826 1098 3HD1 ILE 137 3HD1 ILE 137 -9.109 -0.367 9.830 1099 H LEU 138 H LEU 138 -3.762 2.578 9.196 1100 HA LEU 138 HA LEU 138 -1.938 1.819 7.176 1101 1HB LEU 138 2HB LEU 138 -2.371 4.146 8.904 1102 2HB LEU 138 1HB LEU 138 -0.696 3.897 8.453 1103 HG LEU 138 HG LEU 138 -1.666 5.408 6.880 1104 1HD1 LEU 138 1HD1 LEU 138 -0.659 4.465 5.137 1105 2HD1 LEU 138 2HD1 LEU 138 -1.826 3.143 5.077 1106 3HD1 LEU 138 3HD1 LEU 138 -0.437 3.044 6.159 1107 1HD2 LEU 138 1HD2 LEU 138 -3.998 3.841 7.271 1108 2HD2 LEU 138 2HD2 LEU 138 -3.610 3.826 5.551 1109 3HD2 LEU 138 3HD2 LEU 138 -3.826 5.361 6.394 1110 H SER 139 H SER 139 -1.362 2.413 10.636 1111 HA SER 139 HA SER 139 1.293 1.616 10.706 1112 1HB SER 139 2HB SER 139 1.107 1.623 13.054 1113 2HB SER 139 1HB SER 139 -0.116 2.780 12.521 1114 HG SER 139 HG SER 139 -0.619 0.944 14.131 1115 H LEU 140 H LEU 140 -1.642 -0.330 11.174 1116 HA LEU 140 HA LEU 140 -0.276 -2.728 11.818 1117 1HB LEU 140 2HB LEU 140 -2.904 -1.882 11.788 1118 2HB LEU 140 1HB LEU 140 -2.859 -3.091 10.519 1119 HG LEU 140 HG LEU 140 -1.496 -4.227 12.699 1120 1HD1 LEU 140 1HD1 LEU 140 -2.677 -2.343 13.969 1121 2HD1 LEU 140 2HD1 LEU 140 -2.870 -3.989 14.571 1122 3HD1 LEU 140 3HD1 LEU 140 -4.163 -3.233 13.640 1123 1HD2 LEU 140 1HD2 LEU 140 -2.690 -5.896 11.857 1124 2HD2 LEU 140 2HD2 LEU 140 -3.696 -4.761 10.957 1125 3HD2 LEU 140 3HD2 LEU 140 -4.133 -5.213 12.605 1126 H ALA 141 H ALA 141 -1.697 -1.550 8.777 1127 HA ALA 141 HA ALA 141 -1.094 -3.806 7.231 1128 1HB ALA 141 1HB ALA 141 -2.603 -2.446 6.185 1129 2HB ALA 141 2HB ALA 141 -1.130 -2.005 5.322 1130 3HB ALA 141 3HB ALA 141 -1.739 -0.968 6.612 1131 H CYS 142 H CYS 142 0.745 -0.785 7.647 1132 HA CYS 142 HA CYS 142 2.833 -1.386 5.888 1133 1HB CYS 142 2HB CYS 142 2.529 0.851 6.767 1134 2HB CYS 142 1HB CYS 142 2.838 0.292 8.407 1135 HG CYS 142 HG CYS 142 5.431 -0.574 6.673 1136 H LYS 143 H LYS 143 2.574 -1.986 9.392 1137 HA LYS 143 HA LYS 143 5.117 -3.150 9.699 1138 1HB LYS 143 2HB LYS 143 3.766 -2.328 11.585 1139 2HB LYS 143 1HB LYS 143 2.614 -3.630 11.322 1140 1HG LYS 143 2HG LYS 143 4.258 -5.279 11.908 1141 2HG LYS 143 1HG LYS 143 5.513 -4.044 12.017 1142 1HD LYS 143 2HD LYS 143 4.193 -2.970 13.843 1143 2HD LYS 143 1HD LYS 143 3.096 -4.350 13.792 1144 1HE LYS 143 2HE LYS 143 6.056 -4.663 14.203 1145 2HE LYS 143 1HE LYS 143 4.943 -4.399 15.545 1146 1HZ LYS 143 1HZ LYS 143 4.216 -6.491 15.440 1147 2HZ LYS 143 2HZ LYS 143 5.596 -6.808 14.517 1148 3HZ LYS 143 3HZ LYS 143 4.123 -6.494 13.750 1149 H ASN 144 H ASN 144 1.959 -4.820 9.674 1150 HA ASN 144 HA ASN 144 2.887 -7.414 9.563 1151 1HB ASN 144 2HB ASN 144 0.422 -6.261 9.545 1152 2HB ASN 144 1HB ASN 144 0.502 -6.889 7.902 1153 1HD2 ASN 144 1HD2 ASN 144 -0.953 -7.630 10.484 1154 2HD2 ASN 144 2HD2 ASN 144 -0.724 -9.338 10.599 1155 H LEU 145 H LEU 145 2.044 -5.325 6.811 1156 HA LEU 145 HA LEU 145 2.735 -7.148 4.795 1157 1HB LEU 145 2HB LEU 145 1.374 -5.212 4.323 1158 2HB LEU 145 1HB LEU 145 2.679 -4.134 4.778 1159 HG LEU 145 HG LEU 145 3.972 -5.281 2.829 1160 1HD1 LEU 145 1HD1 LEU 145 2.058 -5.692 1.023 1161 2HD1 LEU 145 2HD1 LEU 145 1.193 -6.232 2.462 1162 3HD1 LEU 145 3HD1 LEU 145 2.721 -6.990 2.016 1163 1HD2 LEU 145 1HD2 LEU 145 2.484 -2.957 3.095 1164 2HD2 LEU 145 2HD2 LEU 145 1.936 -3.652 1.570 1165 3HD2 LEU 145 3HD2 LEU 145 3.650 -3.321 1.823 1166 H LEU 146 H LEU 146 4.668 -5.014 6.752 1167 HA LEU 146 HA LEU 146 6.980 -4.983 5.110 1168 1HB LEU 146 2HB LEU 146 6.202 -3.974 7.674 1169 2HB LEU 146 1HB LEU 146 7.753 -4.778 7.828 1170 HG LEU 146 HG LEU 146 7.354 -2.803 5.619 1171 1HD1 LEU 146 1HD1 LEU 146 7.965 -0.972 7.036 1172 2HD1 LEU 146 2HD1 LEU 146 8.108 -2.038 8.433 1173 3HD1 LEU 146 3HD1 LEU 146 6.529 -1.742 7.709 1174 1HD2 LEU 146 1HD2 LEU 146 9.388 -4.114 5.648 1175 2HD2 LEU 146 2HD2 LEU 146 9.703 -3.636 7.315 1176 3HD2 LEU 146 3HD2 LEU 146 9.752 -2.431 6.028 1177 H VAL 147 H VAL 147 5.860 -7.083 7.704 1178 HA VAL 147 HA VAL 147 8.232 -8.639 7.890 1179 HB VAL 147 HB VAL 147 5.432 -9.492 8.639 1180 1HG1 VAL 147 1HG1 VAL 147 6.754 -11.387 8.800 1181 2HG1 VAL 147 2HG1 VAL 147 6.845 -10.723 10.432 1182 3HG1 VAL 147 3HG1 VAL 147 8.178 -10.475 9.303 1183 1HG2 VAL 147 1HG2 VAL 147 5.660 -7.503 9.815 1184 2HG2 VAL 147 2HG2 VAL 147 7.396 -7.718 10.039 1185 3HG2 VAL 147 3HG2 VAL 147 6.260 -8.702 10.961 1186 H PHE 148 H PHE 148 5.114 -9.147 6.254 1187 HA PHE 148 HA PHE 148 5.759 -11.654 5.133 1188 1HB PHE 148 2HB PHE 148 3.453 -10.552 5.366 1189 2HB PHE 148 1HB PHE 148 3.850 -9.680 3.889 1190 HD1 PHE 148 1HD PHE 148 3.972 -10.820 1.767 1191 HD2 PHE 148 2HD PHE 148 3.045 -12.937 5.340 1192 HE1 PHE 148 1HE PHE 148 3.194 -12.732 0.427 1193 HE2 PHE 148 2HE PHE 148 2.265 -14.853 4.007 1194 HZ PHE 148 HZ PHE 148 2.340 -14.752 1.547 1195 H LEU 149 H LEU 149 6.127 -8.348 3.949 1196 HA LEU 149 HA LEU 149 6.962 -9.018 1.332 1197 1HB LEU 149 2HB LEU 149 6.235 -6.801 1.614 1198 2HB LEU 149 1HB LEU 149 7.222 -6.570 3.049 1199 HG LEU 149 HG LEU 149 8.682 -7.058 0.514 1200 1HD1 LEU 149 1HD1 LEU 149 6.738 -5.504 -0.009 1201 2HD1 LEU 149 2HD1 LEU 149 8.358 -4.911 -0.376 1202 3HD1 LEU 149 3HD1 LEU 149 7.519 -4.347 1.068 1203 1HD2 LEU 149 1HD2 LEU 149 10.287 -6.463 1.944 1204 2HD2 LEU 149 2HD2 LEU 149 9.120 -5.870 3.125 1205 3HD2 LEU 149 3HD2 LEU 149 9.662 -4.820 1.816 1206 H SER 150 H SER 150 8.640 -8.662 4.387 1207 HA SER 150 HA SER 150 11.258 -8.940 3.178 1208 1HB SER 150 2HB SER 150 12.123 -8.341 5.219 1209 2HB SER 150 1HB SER 150 10.509 -7.654 5.397 1210 HG SER 150 HG SER 150 10.048 -9.105 6.863 1211 H LYS 151 H LYS 151 8.784 -10.994 4.111 1212 HA LYS 151 HA LYS 151 8.587 -13.243 4.349 1213 1HB LYS 151 2HB LYS 151 11.235 -13.075 2.927 1214 2HB LYS 151 1HB LYS 151 10.511 -14.617 3.359 1215 1HG LYS 151 2HG LYS 151 8.697 -12.806 1.953 1216 2HG LYS 151 1HG LYS 151 10.111 -13.294 1.016 1217 1HD LYS 151 2HD LYS 151 9.512 -15.510 1.008 1218 2HD LYS 151 1HD LYS 151 8.597 -15.380 2.510 1219 1HE LYS 151 2HE LYS 151 6.859 -14.111 1.321 1220 2HE LYS 151 1HE LYS 151 7.769 -14.288 -0.178 1221 1HZ LYS 151 1HZ LYS 151 6.621 -16.507 1.430 1222 2HZ LYS 151 2HZ LYS 151 7.520 -16.692 0.008 1223 3HZ LYS 151 3HZ LYS 151 6.013 -15.926 -0.038 1224 H HIS 152 H HIS 152 8.592 -13.159 6.629 1225 HA HIS 152 HA HIS 152 11.113 -13.559 8.027 1226 1HB HIS 152 2HB HIS 152 9.221 -12.072 8.877 1227 2HB HIS 152 1HB HIS 152 8.355 -13.558 9.250 1228 HD1 HIS 152 1HD HIS 152 11.818 -14.179 9.886 1229 HD2 HIS 152 2HD HIS 152 8.751 -12.261 11.931 1230 HE1 HIS 152 1HE HIS 152 12.571 -14.075 12.282 1231 HE2 HIS 152 2HE HIS 152 10.660 -12.991 13.517 1232 H HIS 153 H HIS 153 7.966 -15.185 8.385 1233 HA HIS 153 HA HIS 153 9.032 -17.770 7.788 1234 1HB HIS 153 2HB HIS 153 8.926 -18.778 9.949 1235 2HB HIS 153 1HB HIS 153 9.900 -17.323 10.118 1236 HD1 HIS 153 1HD HIS 153 7.781 -15.199 10.539 1237 HD2 HIS 153 2HD HIS 153 7.623 -18.953 12.312 1238 HE1 HIS 153 1HE HIS 153 6.318 -14.924 12.567 1239 HE2 HIS 153 2HE HIS 153 6.318 -17.185 13.676 1240 H HIS 154 H HIS 154 7.414 -19.393 7.690 1241 HA HIS 154 HA HIS 154 4.660 -18.478 8.135 1242 1HB HIS 154 2HB HIS 154 5.791 -18.580 5.622 1243 2HB HIS 154 1HB HIS 154 4.967 -20.131 5.739 1244 HD1 HIS 154 1HD HIS 154 2.476 -20.128 5.436 1245 HD2 HIS 154 2HD HIS 154 4.027 -16.306 5.933 1246 HE1 HIS 154 1HE HIS 154 0.568 -18.562 4.960 1247 HE2 HIS 154 2HE HIS 154 1.550 -16.253 5.192 1248 H HIS 155 H HIS 155 6.986 -20.806 8.593 1249 HA HIS 155 HA HIS 155 6.991 -22.928 9.410 1250 1HB HIS 155 2HB HIS 155 4.508 -21.715 10.426 1251 2HB HIS 155 1HB HIS 155 4.517 -23.475 10.431 1252 HD1 HIS 155 1HD HIS 155 7.407 -24.024 11.251 1253 HD2 HIS 155 2HD HIS 155 5.020 -21.125 13.028 1254 HE1 HIS 155 1HE HIS 155 8.397 -23.644 13.530 1255 HE2 HIS 155 2HE HIS 155 6.890 -21.943 14.617 1256 H HIS 156 H HIS 156 7.231 -24.128 7.568 1257 HA HIS 156 HA HIS 156 4.964 -24.781 5.905 1258 1HB HIS 156 2HB HIS 156 6.585 -26.097 4.599 1259 2HB HIS 156 1HB HIS 156 7.160 -24.456 4.881 1260 HD1 HIS 156 1HD HIS 156 8.989 -24.230 6.861 1261 HD2 HIS 156 2HD HIS 156 8.308 -28.054 5.384 1262 HE1 HIS 156 1HE HIS 156 10.962 -25.598 7.606 1263 HE2 HIS 156 2HE HIS 156 10.577 -27.883 6.615 Start of MODEL 8 1 1H MET 1 1HT MET 1 16.731 -8.898 -8.493 2 2H MET 1 2HT MET 1 17.790 -8.190 -7.380 3 3H MET 1 3HT MET 1 17.978 -7.890 -9.034 4 HA MET 1 HA MET 1 16.746 -6.227 -7.378 5 1HB MET 1 2HB MET 1 16.259 -6.804 -10.300 6 2HB MET 1 1HB MET 1 15.611 -5.380 -9.495 7 1HG MET 1 2HG MET 1 17.584 -4.328 -9.490 8 2HG MET 1 1HG MET 1 18.482 -5.795 -9.101 9 1HE MET 1 1HE MET 1 17.374 -3.282 -11.388 10 2HE MET 1 2HE MET 1 16.522 -4.301 -12.550 11 3HE MET 1 3HE MET 1 18.108 -3.644 -12.950 12 H LYS 2 H LYS 2 14.718 -5.703 -6.655 13 HA LYS 2 HA LYS 2 12.444 -7.345 -7.426 14 1HB LYS 2 2HB LYS 2 13.729 -7.394 -4.737 15 2HB LYS 2 1HB LYS 2 11.973 -7.452 -4.811 16 1HG LYS 2 2HG LYS 2 12.181 -9.403 -6.356 17 2HG LYS 2 1HG LYS 2 13.917 -9.392 -6.037 18 1HD LYS 2 2HD LYS 2 13.114 -9.417 -3.527 19 2HD LYS 2 1HD LYS 2 11.653 -10.108 -4.235 20 1HE LYS 2 2HE LYS 2 13.061 -11.824 -5.338 21 2HE LYS 2 1HE LYS 2 14.465 -11.167 -4.499 22 1HZ LYS 2 1HZ LYS 2 13.819 -12.051 -2.537 23 2HZ LYS 2 2HZ LYS 2 13.037 -13.164 -3.539 24 3HZ LYS 2 3HZ LYS 2 12.166 -11.886 -2.857 25 H LYS 3 H LYS 3 10.632 -6.178 -7.537 26 HA LYS 3 HA LYS 3 10.599 -3.557 -6.191 27 1HB LYS 3 2HB LYS 3 9.844 -4.354 -8.966 28 2HB LYS 3 1HB LYS 3 8.939 -3.060 -8.192 29 1HG LYS 3 2HG LYS 3 11.580 -2.402 -7.706 30 2HG LYS 3 1HG LYS 3 11.588 -3.032 -9.356 31 1HD LYS 3 2HD LYS 3 9.334 -1.437 -9.276 32 2HD LYS 3 1HD LYS 3 10.513 -0.539 -8.315 33 1HE LYS 3 2HE LYS 3 11.903 -1.479 -10.562 34 2HE LYS 3 1HE LYS 3 10.359 -0.878 -11.166 35 1HZ LYS 3 1HZ LYS 3 11.080 1.060 -9.456 36 2HZ LYS 3 2HZ LYS 3 11.389 1.092 -11.117 37 3HZ LYS 3 3HZ LYS 3 12.589 0.572 -10.045 38 H ILE 4 H ILE 4 8.499 -2.749 -5.564 39 HA ILE 4 HA ILE 4 6.472 -4.867 -5.230 40 HB ILE 4 HB ILE 4 7.335 -2.859 -3.148 41 1HG1 ILE 4 2HG1 ILE 4 7.659 -5.169 -1.921 42 2HG1 ILE 4 1HG1 ILE 4 7.822 -5.778 -3.564 43 1HG2 ILE 4 1HG2 ILE 4 5.229 -3.035 -2.428 44 2HG2 ILE 4 2HG2 ILE 4 5.686 -4.656 -1.906 45 3HG2 ILE 4 3HG2 ILE 4 4.894 -4.422 -3.465 46 1HD1 ILE 4 1HD1 ILE 4 9.808 -4.676 -1.979 47 2HD1 ILE 4 2HD1 ILE 4 9.426 -3.417 -3.153 48 3HD1 ILE 4 3HD1 ILE 4 9.899 -5.022 -3.706 49 H LEU 5 H LEU 5 4.765 -4.257 -6.407 50 HA LEU 5 HA LEU 5 4.115 -1.437 -6.714 51 1HB LEU 5 2HB LEU 5 3.899 -3.641 -8.374 52 2HB LEU 5 1HB LEU 5 2.244 -3.332 -7.888 53 HG LEU 5 HG LEU 5 3.998 -1.156 -8.999 54 1HD1 LEU 5 1HD1 LEU 5 3.895 -2.028 -11.032 55 2HD1 LEU 5 2HD1 LEU 5 2.135 -2.061 -10.935 56 3HD1 LEU 5 3HD1 LEU 5 3.074 -3.450 -10.388 57 1HD2 LEU 5 1HD2 LEU 5 1.236 -1.408 -8.104 58 2HD2 LEU 5 2HD2 LEU 5 1.388 -0.705 -9.714 59 3HD2 LEU 5 3HD2 LEU 5 2.224 0.033 -8.348 60 H PHE 6 H PHE 6 2.932 -0.511 -5.159 61 HA PHE 6 HA PHE 6 0.888 -2.083 -3.755 62 1HB PHE 6 2HB PHE 6 2.132 0.613 -3.178 63 2HB PHE 6 1HB PHE 6 0.750 -0.010 -2.288 64 HD1 PHE 6 1HD PHE 6 3.947 0.623 -1.793 65 HD2 PHE 6 2HD PHE 6 1.403 -2.790 -1.791 66 HE1 PHE 6 1HE PHE 6 5.470 -0.509 -0.231 67 HE2 PHE 6 2HE PHE 6 2.921 -3.923 -0.228 68 HZ PHE 6 HZ PHE 6 4.959 -2.785 0.554 69 H ILE 7 H ILE 7 -1.136 -1.987 -4.542 70 HA ILE 7 HA ILE 7 -1.885 0.326 -6.183 71 HB ILE 7 HB ILE 7 -3.275 -2.342 -5.944 72 1HG1 ILE 7 2HG1 ILE 7 -1.811 -1.442 -8.389 73 2HG1 ILE 7 1HG1 ILE 7 -0.881 -2.094 -7.043 74 1HG2 ILE 7 1HG2 ILE 7 -4.853 -0.694 -6.600 75 2HG2 ILE 7 2HG2 ILE 7 -4.389 -1.568 -8.059 76 3HG2 ILE 7 3HG2 ILE 7 -3.719 0.032 -7.740 77 1HD1 ILE 7 1HD1 ILE 7 -3.152 -3.763 -7.689 78 2HD1 ILE 7 2HD1 ILE 7 -1.443 -4.175 -7.560 79 3HD1 ILE 7 3HD1 ILE 7 -2.082 -3.527 -9.071 80 H CYS 8 H CYS 8 -3.364 1.759 -5.568 81 HA CYS 8 HA CYS 8 -5.274 1.061 -3.470 82 1HB CYS 8 2HB CYS 8 -3.086 2.932 -3.213 83 2HB CYS 8 1HB CYS 8 -4.635 3.737 -2.988 84 HG CYS 8 HG CYS 8 -5.352 1.543 -1.102 85 H LEU 9 H LEU 9 -7.274 1.547 -4.053 86 HA LEU 9 HA LEU 9 -7.995 2.676 -6.472 87 1HB LEU 9 2HB LEU 9 -9.319 1.641 -4.206 88 2HB LEU 9 1HB LEU 9 -10.022 3.219 -4.508 89 HG LEU 9 HG LEU 9 -9.781 1.099 -6.637 90 1HD1 LEU 9 1HD1 LEU 9 -11.768 1.454 -4.479 91 2HD1 LEU 9 2HD1 LEU 9 -11.270 -0.002 -5.338 92 3HD1 LEU 9 3HD1 LEU 9 -12.396 1.124 -6.094 93 1HD2 LEU 9 1HD2 LEU 9 -10.162 3.017 -7.802 94 2HD2 LEU 9 2HD2 LEU 9 -10.961 3.816 -6.449 95 3HD2 LEU 9 3HD2 LEU 9 -11.828 2.605 -7.395 96 H GLY 10 H GLY 10 -7.187 4.200 -3.469 97 1HA GLY 10 2HA GLY 10 -7.457 6.822 -4.771 98 2HA GLY 10 1HA GLY 10 -8.164 6.577 -3.178 99 H ASN 11 H ASN 11 -5.281 7.170 -4.960 100 HA ASN 11 HA ASN 11 -3.487 6.639 -2.781 101 1HB ASN 11 2HB ASN 11 -3.047 6.654 -5.380 102 2HB ASN 11 1HB ASN 11 -2.693 8.353 -5.088 103 1HD2 ASN 11 1HD2 ASN 11 -1.233 5.575 -5.546 104 2HD2 ASN 11 2HD2 ASN 11 0.151 5.741 -4.526 105 H ILE 12 H ILE 12 -5.474 8.322 -1.899 106 HA ILE 12 HA ILE 12 -3.920 10.711 -1.232 107 HB ILE 12 HB ILE 12 -6.061 12.056 -1.329 108 1HG1 ILE 12 2HG1 ILE 12 -7.274 10.527 -3.435 109 2HG1 ILE 12 1HG1 ILE 12 -7.130 9.521 -1.996 110 1HG2 ILE 12 1HG2 ILE 12 -4.602 11.039 -3.727 111 2HG2 ILE 12 2HG2 ILE 12 -4.542 12.628 -2.966 112 3HG2 ILE 12 3HG2 ILE 12 -5.946 12.164 -3.928 113 1HD1 ILE 12 1HD1 ILE 12 -9.256 10.602 -1.971 114 2HD1 ILE 12 2HD1 ILE 12 -8.511 12.181 -2.221 115 3HD1 ILE 12 3HD1 ILE 12 -8.255 11.316 -0.706 116 H CYS 13 H CYS 13 -4.679 8.145 0.071 117 HA CYS 13 HA CYS 13 -5.607 9.302 2.568 118 1HB CYS 13 2HB CYS 13 -7.129 7.290 0.977 119 2HB CYS 13 1HB CYS 13 -7.125 7.128 2.729 120 HG CYS 13 HG CYS 13 -8.599 9.236 3.306 121 H ARG 14 H ARG 14 -5.667 5.877 1.830 122 HA ARG 14 HA ARG 14 -3.735 5.370 3.897 123 1HB ARG 14 2HB ARG 14 -4.824 3.432 4.036 124 2HB ARG 14 1HB ARG 14 -5.847 3.946 2.702 125 1HG ARG 14 2HG ARG 14 -5.092 1.951 1.900 126 2HG ARG 14 1HG ARG 14 -3.850 3.025 1.254 127 1HD ARG 14 2HD ARG 14 -2.246 2.090 2.501 128 2HD ARG 14 1HD ARG 14 -3.255 2.093 3.946 129 HE ARG 14 HE ARG 14 -4.128 0.076 2.183 130 1HH1 ARG 14 1HH1 ARG 14 -1.488 0.849 4.323 131 2HH1 ARG 14 2HH1 ARG 14 -1.109 -0.807 4.662 132 1HH2 ARG 14 1HH2 ARG 14 -3.636 -2.106 2.624 133 2HH2 ARG 14 2HH2 ARG 14 -2.330 -2.486 3.697 134 H SER 15 H SER 15 -3.801 5.192 0.372 135 HA SER 15 HA SER 15 -1.443 3.811 -0.096 136 1HB SER 15 2HB SER 15 -3.212 4.701 -1.763 137 2HB SER 15 1HB SER 15 -2.218 6.157 -1.800 138 HG SER 15 HG SER 15 -1.740 3.665 -2.863 139 HA PRO 16 HA PRO 16 0.963 8.031 -0.004 140 1HB PRO 16 2HB PRO 16 -0.740 9.780 1.634 141 2HB PRO 16 1HB PRO 16 0.059 10.114 0.095 142 1HG PRO 16 2HG PRO 16 -2.602 9.826 0.262 143 2HG PRO 16 1HG PRO 16 -1.688 9.259 -1.149 144 1HD PRO 16 2HD PRO 16 -2.749 7.689 1.175 145 2HD PRO 16 1HD PRO 16 -2.778 7.292 -0.557 146 H MET 17 H MET 17 -1.085 7.321 2.810 147 HA MET 17 HA MET 17 0.656 8.147 4.818 148 1HB MET 17 2HB MET 17 -1.717 7.424 5.149 149 2HB MET 17 1HB MET 17 -1.188 5.757 4.955 150 1HG MET 17 2HG MET 17 -0.137 5.704 6.982 151 2HG MET 17 1HG MET 17 0.166 7.439 6.994 152 1HE MET 17 1HE MET 17 -1.970 7.568 10.105 153 2HE MET 17 2HE MET 17 -0.814 8.491 9.146 154 3HE MET 17 3HE MET 17 -0.445 6.831 9.612 155 H ALA 18 H ALA 18 0.239 4.836 3.554 156 HA ALA 18 HA ALA 18 2.484 3.783 4.917 157 1HB ALA 18 1HB ALA 18 0.424 2.649 3.657 158 2HB ALA 18 2HB ALA 18 1.934 1.805 4.004 159 3HB ALA 18 3HB ALA 18 1.654 2.490 2.403 160 H GLU 19 H GLU 19 2.087 5.411 1.858 161 HA GLU 19 HA GLU 19 4.398 4.623 0.536 162 1HB GLU 19 2HB GLU 19 2.581 6.028 -0.428 163 2HB GLU 19 1HB GLU 19 3.175 7.388 0.515 164 1HG GLU 19 2HG GLU 19 5.074 7.621 -0.766 165 2HG GLU 19 1HG GLU 19 5.023 5.953 -1.336 166 H PHE 20 H PHE 20 3.959 7.413 2.707 167 HA PHE 20 HA PHE 20 6.723 8.106 2.678 168 1HB PHE 20 2HB PHE 20 4.578 9.538 3.233 169 2HB PHE 20 1HB PHE 20 4.904 9.002 4.876 170 HD1 PHE 20 1HD PHE 20 7.664 9.134 5.304 171 HD2 PHE 20 2HD PHE 20 5.284 11.670 2.853 172 HE1 PHE 20 1HE PHE 20 9.323 10.934 5.561 173 HE2 PHE 20 2HE PHE 20 6.939 13.472 3.104 174 HZ PHE 20 HZ PHE 20 8.962 13.106 4.459 175 H ILE 21 H ILE 21 4.646 6.520 5.135 176 HA ILE 21 HA ILE 21 6.677 6.235 7.036 177 HB ILE 21 HB ILE 21 5.314 4.687 8.216 178 1HG1 ILE 21 2HG1 ILE 21 3.338 4.499 5.968 179 2HG1 ILE 21 1HG1 ILE 21 4.721 3.410 6.013 180 1HG2 ILE 21 1HG2 ILE 21 4.480 7.197 7.429 181 2HG2 ILE 21 2HG2 ILE 21 3.848 6.256 8.779 182 3HG2 ILE 21 3HG2 ILE 21 3.052 6.187 7.208 183 1HD1 ILE 21 1HD1 ILE 21 2.289 3.427 7.624 184 2HD1 ILE 21 2HD1 ILE 21 3.772 3.188 8.547 185 3HD1 ILE 21 3HD1 ILE 21 3.377 2.102 7.216 186 H MET 22 H MET 22 5.510 3.832 4.674 187 HA MET 22 HA MET 22 7.347 1.831 5.314 188 1HB MET 22 2HB MET 22 5.948 2.473 2.720 189 2HB MET 22 1HB MET 22 6.964 1.053 2.930 190 1HG MET 22 2HG MET 22 4.900 1.426 4.981 191 2HG MET 22 1HG MET 22 4.298 1.109 3.355 192 1HE MET 22 1HE MET 22 3.174 -1.298 4.043 193 2HE MET 22 2HE MET 22 4.198 -2.551 3.342 194 3HE MET 22 3HE MET 22 3.920 -1.046 2.465 195 H LYS 23 H LYS 23 7.571 4.526 3.017 196 HA LYS 23 HA LYS 23 9.958 3.921 1.769 197 1HB LYS 23 2HB LYS 23 8.313 6.235 2.088 198 2HB LYS 23 1HB LYS 23 9.987 6.711 2.334 199 1HG LYS 23 2HG LYS 23 9.143 5.086 -0.040 200 2HG LYS 23 1HG LYS 23 9.054 6.849 -0.030 201 1HD LYS 23 2HD LYS 23 11.608 6.146 0.948 202 2HD LYS 23 1HD LYS 23 11.317 5.161 -0.487 203 1HE LYS 23 2HE LYS 23 12.411 7.382 -0.915 204 2HE LYS 23 1HE LYS 23 10.935 7.080 -1.832 205 1HZ LYS 23 1HZ LYS 23 11.103 9.338 -0.835 206 2HZ LYS 23 2HZ LYS 23 11.004 8.629 0.697 207 3HZ LYS 23 3HZ LYS 23 9.711 8.486 -0.385 208 H ASP 24 H ASP 24 9.429 5.472 4.904 209 HA ASP 24 HA ASP 24 12.192 5.939 5.433 210 1HB ASP 24 2HB ASP 24 10.121 7.025 6.545 211 2HB ASP 24 1HB ASP 24 10.101 5.594 7.570 212 H LEU 25 H LEU 25 9.914 3.380 6.252 213 HA LEU 25 HA LEU 25 11.646 1.875 7.905 214 1HB LEU 25 2HB LEU 25 8.996 1.766 7.240 215 2HB LEU 25 1HB LEU 25 9.630 0.382 6.371 216 HG LEU 25 HG LEU 25 8.721 -0.141 8.638 217 1HD1 LEU 25 1HD1 LEU 25 11.633 -0.706 8.120 218 2HD1 LEU 25 2HD1 LEU 25 10.250 -1.672 7.608 219 3HD1 LEU 25 3HD1 LEU 25 10.648 -1.543 9.321 220 1HD2 LEU 25 1HD2 LEU 25 9.730 2.041 9.592 221 2HD2 LEU 25 2HD2 LEU 25 11.200 1.086 9.781 222 3HD2 LEU 25 3HD2 LEU 25 9.717 0.592 10.598 223 H VAL 26 H VAL 26 11.428 2.262 4.504 224 HA VAL 26 HA VAL 26 12.432 -0.213 3.637 225 HB VAL 26 HB VAL 26 12.457 2.522 2.383 226 1HG1 VAL 26 1HG1 VAL 26 14.163 1.827 1.104 227 2HG1 VAL 26 2HG1 VAL 26 12.959 0.807 0.317 228 3HG1 VAL 26 3HG1 VAL 26 13.974 0.144 1.600 229 1HG2 VAL 26 1HG2 VAL 26 10.775 1.593 0.930 230 2HG2 VAL 26 2HG2 VAL 26 10.310 1.310 2.606 231 3HG2 VAL 26 3HG2 VAL 26 10.987 -0.005 1.644 232 H LYS 27 H LYS 27 14.115 2.813 4.426 233 HA LYS 27 HA LYS 27 16.670 2.007 3.634 234 1HB LYS 27 2HB LYS 27 15.964 4.337 4.175 235 2HB LYS 27 1HB LYS 27 16.004 3.909 5.879 236 1HG LYS 27 2HG LYS 27 18.475 3.135 5.127 237 2HG LYS 27 1HG LYS 27 18.204 4.482 4.020 238 1HD LYS 27 2HD LYS 27 17.307 5.524 6.368 239 2HD LYS 27 1HD LYS 27 18.612 4.475 6.927 240 1HE LYS 27 2HE LYS 27 19.769 5.690 4.786 241 2HE LYS 27 1HE LYS 27 18.718 6.970 5.387 242 1HZ LYS 27 1HZ LYS 27 21.130 6.647 6.316 243 2HZ LYS 27 2HZ LYS 27 20.370 5.515 7.317 244 3HZ LYS 27 3HZ LYS 27 19.865 7.129 7.333 245 H LYS 28 H LYS 28 14.952 1.450 6.660 246 HA LYS 28 HA LYS 28 17.206 0.634 8.141 247 1HB LYS 28 2HB LYS 28 15.748 0.046 9.861 248 2HB LYS 28 1HB LYS 28 14.934 1.359 9.028 249 1HG LYS 28 2HG LYS 28 13.150 0.037 9.044 250 2HG LYS 28 1HG LYS 28 13.952 -0.858 7.751 251 1HD LYS 28 2HD LYS 28 13.763 -2.629 9.107 252 2HD LYS 28 1HD LYS 28 15.109 -1.913 9.997 253 1HE LYS 28 2HE LYS 28 13.766 -1.892 11.775 254 2HE LYS 28 1HE LYS 28 12.891 -0.585 10.978 255 1HZ LYS 28 1HZ LYS 28 11.128 -1.896 10.877 256 2HZ LYS 28 2HZ LYS 28 11.982 -3.167 11.597 257 3HZ LYS 28 3HZ LYS 28 11.976 -2.998 9.914 258 H ALA 29 H ALA 29 14.734 -1.430 6.501 259 HA ALA 29 HA ALA 29 16.760 -3.569 6.604 260 1HB ALA 29 1HB ALA 29 15.482 -4.782 7.927 261 2HB ALA 29 2HB ALA 29 14.227 -4.799 6.688 262 3HB ALA 29 3HB ALA 29 14.241 -3.530 7.911 263 H ASN 30 H ASN 30 14.577 -1.860 4.600 264 HA ASN 30 HA ASN 30 14.289 -4.026 2.694 265 1HB ASN 30 2HB ASN 30 13.330 -1.190 2.797 266 2HB ASN 30 1HB ASN 30 13.305 -2.066 1.271 267 1HD2 ASN 30 1HD2 ASN 30 11.693 -3.443 0.880 268 2HD2 ASN 30 2HD2 ASN 30 10.461 -3.873 2.012 269 H LEU 31 H LEU 31 16.410 -1.385 3.283 270 HA LEU 31 HA LEU 31 18.334 -0.707 2.281 271 1HB LEU 31 2HB LEU 31 17.945 -3.406 1.072 272 2HB LEU 31 1HB LEU 31 19.153 -2.345 0.374 273 HG LEU 31 HG LEU 31 19.606 -2.299 3.150 274 1HD1 LEU 31 1HD1 LEU 31 19.492 -4.410 3.961 275 2HD1 LEU 31 2HD1 LEU 31 19.745 -5.151 2.380 276 3HD1 LEU 31 3HD1 LEU 31 18.158 -4.513 2.811 277 1HD2 LEU 31 1HD2 LEU 31 21.521 -2.128 1.963 278 2HD2 LEU 31 2HD2 LEU 31 20.961 -3.220 0.695 279 3HD2 LEU 31 3HD2 LEU 31 21.568 -3.874 2.217 280 H GLU 32 H GLU 32 16.897 0.994 1.508 281 HA GLU 32 HA GLU 32 15.573 1.106 -0.900 282 1HB GLU 32 2HB GLU 32 16.210 2.913 1.066 283 2HB GLU 32 1HB GLU 32 17.090 3.549 -0.317 284 1HG GLU 32 2HG GLU 32 14.137 3.026 -0.119 285 2HG GLU 32 1HG GLU 32 14.946 4.588 -0.231 286 H LYS 33 H LYS 33 18.993 1.071 -0.350 287 HA LYS 33 HA LYS 33 19.618 1.928 -3.059 288 1HB LYS 33 2HB LYS 33 22.011 1.302 -2.197 289 2HB LYS 33 1HB LYS 33 21.226 2.770 -1.631 290 1HG LYS 33 2HG LYS 33 20.912 1.961 0.477 291 2HG LYS 33 1HG LYS 33 20.830 0.282 -0.060 292 1HD LYS 33 2HD LYS 33 22.879 0.337 1.003 293 2HD LYS 33 1HD LYS 33 23.337 0.645 -0.673 294 1HE LYS 33 2HE LYS 33 22.688 3.110 0.654 295 2HE LYS 33 1HE LYS 33 23.898 2.221 1.579 296 1HZ LYS 33 1HZ LYS 33 24.657 3.809 -0.280 297 2HZ LYS 33 2HZ LYS 33 24.213 2.560 -1.330 298 3HZ LYS 33 3HZ LYS 33 25.398 2.293 -0.153 299 H GLU 34 H GLU 34 18.132 -0.578 -2.467 300 HA GLU 34 HA GLU 34 19.754 -2.342 -4.133 301 1HB GLU 34 2HB GLU 34 18.819 -2.950 -1.357 302 2HB GLU 34 1HB GLU 34 18.870 -4.249 -2.540 303 1HG GLU 34 2HG GLU 34 21.235 -2.501 -1.937 304 2HG GLU 34 1HG GLU 34 20.893 -3.994 -1.065 305 H PHE 35 H PHE 35 16.696 -2.269 -2.306 306 HA PHE 35 HA PHE 35 15.322 -3.415 -4.630 307 1HB PHE 35 2HB PHE 35 14.374 -3.088 -1.773 308 2HB PHE 35 1HB PHE 35 13.482 -3.887 -3.063 309 HD1 PHE 35 1HD PHE 35 16.781 -4.056 -1.324 310 HD2 PHE 35 2HD PHE 35 13.634 -6.170 -3.255 311 HE1 PHE 35 1HE PHE 35 17.864 -6.188 -0.745 312 HE2 PHE 35 2HE PHE 35 14.711 -8.306 -2.680 313 HZ PHE 35 HZ PHE 35 16.829 -8.317 -1.424 314 H PHE 36 H PHE 36 12.953 -2.585 -4.821 315 HA PHE 36 HA PHE 36 12.775 0.287 -4.298 316 1HB PHE 36 2HB PHE 36 12.604 -0.984 -7.030 317 2HB PHE 36 1HB PHE 36 11.944 0.610 -6.683 318 HD1 PHE 36 1HD PHE 36 13.611 2.303 -5.594 319 HD2 PHE 36 2HD PHE 36 14.780 -1.172 -7.756 320 HE1 PHE 36 1HE PHE 36 15.824 3.302 -5.998 321 HE2 PHE 36 2HE PHE 36 16.994 -0.180 -8.164 322 HZ PHE 36 HZ PHE 36 17.518 2.060 -7.284 323 H ILE 37 H ILE 37 10.729 1.045 -3.982 324 HA ILE 37 HA ILE 37 8.545 -0.909 -4.267 325 HB ILE 37 HB ILE 37 7.493 0.157 -2.260 326 1HG1 ILE 37 2HG1 ILE 37 8.998 2.218 -2.396 327 2HG1 ILE 37 1HG1 ILE 37 8.721 1.548 -0.795 328 1HG2 ILE 37 1HG2 ILE 37 8.806 -1.115 -0.652 329 2HG2 ILE 37 2HG2 ILE 37 10.136 -1.216 -1.806 330 3HG2 ILE 37 3HG2 ILE 37 8.601 -2.011 -2.156 331 1HD1 ILE 37 1HD1 ILE 37 11.197 1.640 -2.418 332 2HD1 ILE 37 2HD1 ILE 37 10.964 0.263 -1.342 333 3HD1 ILE 37 3HD1 ILE 37 10.960 1.901 -0.690 334 H ASN 38 H ASN 38 6.962 -0.275 -5.522 335 HA ASN 38 HA ASN 38 6.632 2.600 -6.065 336 1HB ASN 38 2HB ASN 38 5.197 1.327 -8.029 337 2HB ASN 38 1HB ASN 38 6.857 1.889 -8.199 338 1HD2 ASN 38 1HD2 ASN 38 8.495 0.246 -7.279 339 2HD2 ASN 38 2HD2 ASN 38 8.246 -1.395 -7.760 340 H SER 39 H SER 39 4.333 3.233 -6.622 341 HA SER 39 HA SER 39 2.208 1.640 -5.558 342 1HB SER 39 2HB SER 39 1.633 2.906 -3.639 343 2HB SER 39 1HB SER 39 3.369 2.624 -3.507 344 HG SER 39 HG SER 39 2.628 4.835 -3.113 345 H ALA 40 H ALA 40 0.379 2.145 -6.558 346 HA ALA 40 HA ALA 40 -0.297 4.833 -7.311 347 1HB ALA 40 1HB ALA 40 0.698 4.780 -9.316 348 2HB ALA 40 2HB ALA 40 -0.600 3.680 -9.783 349 3HB ALA 40 3HB ALA 40 0.950 3.036 -9.243 350 H GLY 41 H GLY 41 -2.385 4.717 -8.765 351 1HA GLY 41 2HA GLY 41 -4.220 2.986 -7.328 352 2HA GLY 41 1HA GLY 41 -4.657 4.278 -8.437 353 H THR 42 H THR 42 -6.135 2.148 -8.765 354 HA THR 42 HA THR 42 -5.055 0.100 -10.402 355 HB THR 42 HB THR 42 -7.873 0.475 -10.880 356 HG1 THR 42 1HG THR 42 -8.623 0.724 -8.871 357 1HG2 THR 42 1HG2 THR 42 -6.752 -1.668 -11.035 358 2HG2 THR 42 2HG2 THR 42 -7.985 -1.739 -9.776 359 3HG2 THR 42 3HG2 THR 42 -6.284 -1.579 -9.337 360 H SER 43 H SER 43 -6.977 3.000 -11.160 361 HA SER 43 HA SER 43 -6.065 2.746 -13.950 362 1HB SER 43 2HB SER 43 -8.215 3.714 -14.674 363 2HB SER 43 1HB SER 43 -8.450 2.198 -13.805 364 HG SER 43 HG SER 43 -9.896 3.600 -12.940 365 H GLY 44 H GLY 44 -5.350 4.381 -11.383 366 1HA GLY 44 2HA GLY 44 -4.532 6.478 -10.938 367 2HA GLY 44 1HA GLY 44 -4.314 6.627 -12.675 368 H GLU 45 H GLU 45 -7.474 6.079 -11.347 369 HA GLU 45 HA GLU 45 -8.577 8.344 -12.602 370 1HB GLU 45 2HB GLU 45 -10.598 7.814 -11.177 371 2HB GLU 45 1HB GLU 45 -10.017 6.504 -12.193 372 1HG GLU 45 2HG GLU 45 -8.668 5.891 -10.002 373 2HG GLU 45 1HG GLU 45 -9.989 6.778 -9.243 374 H HIS 46 H HIS 46 -7.488 7.765 -9.298 375 HA HIS 46 HA HIS 46 -7.757 10.649 -8.799 376 1HB HIS 46 2HB HIS 46 -8.602 8.379 -7.012 377 2HB HIS 46 1HB HIS 46 -8.251 9.982 -6.370 378 HD1 HIS 46 1HD HIS 46 -9.579 11.653 -8.635 379 HD2 HIS 46 2HD HIS 46 -11.331 8.391 -6.749 380 HE1 HIS 46 1HE HIS 46 -12.058 11.946 -8.948 381 HE2 HIS 46 2HE HIS 46 -13.100 9.997 -7.739 382 H ASP 47 H ASP 47 -5.992 7.684 -8.322 383 HA ASP 47 HA ASP 47 -4.191 8.229 -6.368 384 1HB ASP 47 2HB ASP 47 -3.866 6.144 -7.318 385 2HB ASP 47 1HB ASP 47 -3.936 6.770 -8.966 386 H GLY 48 H GLY 48 -3.052 9.985 -5.935 387 1HA GLY 48 2HA GLY 48 -1.192 11.399 -6.369 388 2HA GLY 48 1HA GLY 48 -1.489 11.217 -8.090 389 H GLU 49 H GLU 49 -2.792 12.672 -5.134 390 HA GLU 49 HA GLU 49 -3.435 15.084 -6.583 391 1HB GLU 49 2HB GLU 49 -5.500 13.132 -5.818 392 2HB GLU 49 1HB GLU 49 -5.830 14.780 -5.299 393 1HG GLU 49 2HG GLU 49 -5.050 15.157 -7.882 394 2HG GLU 49 1HG GLU 49 -5.875 13.601 -7.971 395 H GLY 50 H GLY 50 -2.344 13.533 -3.921 396 1HA GLY 50 2HA GLY 50 -1.369 15.110 -2.249 397 2HA GLY 50 1HA GLY 50 -2.973 15.822 -2.158 398 H MET 51 H MET 51 -4.277 15.125 -0.586 399 HA MET 51 HA MET 51 -4.299 12.404 0.300 400 1HB MET 51 2HB MET 51 -2.333 13.849 1.471 401 2HB MET 51 1HB MET 51 -3.662 14.184 2.570 402 1HG MET 51 2HG MET 51 -4.012 11.741 2.807 403 2HG MET 51 1HG MET 51 -2.571 11.484 1.824 404 1HE MET 51 1HE MET 51 -0.801 10.277 3.688 405 2HE MET 51 2HE MET 51 0.259 11.633 4.074 406 3HE MET 51 3HE MET 51 -0.410 11.473 2.451 407 H HIS 52 H HIS 52 -5.530 12.534 2.675 408 HA HIS 52 HA HIS 52 -7.631 14.526 2.632 409 1HB HIS 52 2HB HIS 52 -8.044 12.121 1.267 410 2HB HIS 52 1HB HIS 52 -8.878 11.912 2.804 411 HD1 HIS 52 1HD HIS 52 -8.665 14.674 0.178 412 HD2 HIS 52 2HD HIS 52 -11.425 12.781 2.642 413 HE1 HIS 52 1HE HIS 52 -10.878 15.747 -0.343 414 HE2 HIS 52 2HE HIS 52 -12.533 14.595 1.169 415 H TYR 53 H TYR 53 -9.390 13.628 4.379 416 HA TYR 53 HA TYR 53 -8.247 13.921 6.860 417 1HB TYR 53 2HB TYR 53 -10.770 12.341 6.390 418 2HB TYR 53 1HB TYR 53 -10.351 13.321 7.790 419 HD1 TYR 53 1HD TYR 53 -12.634 13.273 5.393 420 HD2 TYR 53 2HD TYR 53 -9.487 15.841 6.663 421 HE1 TYR 53 1HE TYR 53 -13.797 15.191 4.384 422 HE2 TYR 53 2HE TYR 53 -10.642 17.764 5.659 423 HH TYR 53 HH TYR 53 -13.882 17.577 4.529 424 H GLY 54 H GLY 54 -8.710 12.188 8.678 425 1HA GLY 54 2HA GLY 54 -8.209 10.148 9.609 426 2HA GLY 54 1HA GLY 54 -8.201 9.465 7.994 427 H THR 55 H THR 55 -6.246 9.649 6.730 428 HA THR 55 HA THR 55 -3.964 8.940 8.170 429 HB THR 55 HB THR 55 -4.064 8.208 5.929 430 HG1 THR 55 1HG THR 55 -2.087 8.956 5.133 431 1HG2 THR 55 1HG2 THR 55 -4.763 11.031 5.363 432 2HG2 THR 55 2HG2 THR 55 -5.389 9.544 4.651 433 3HG2 THR 55 3HG2 THR 55 -3.828 10.180 4.132 434 H LYS 56 H LYS 56 -4.700 12.006 6.500 435 HA LYS 56 HA LYS 56 -2.343 13.354 7.124 436 1HB LYS 56 2HB LYS 56 -3.874 14.226 5.474 437 2HB LYS 56 1HB LYS 56 -5.136 14.421 6.682 438 1HG LYS 56 2HG LYS 56 -3.939 16.188 7.752 439 2HG LYS 56 1HG LYS 56 -2.518 15.900 6.746 440 1HD LYS 56 2HD LYS 56 -3.447 16.895 4.907 441 2HD LYS 56 1HD LYS 56 -5.096 16.493 5.389 442 1HE LYS 56 2HE LYS 56 -5.361 18.431 6.466 443 2HE LYS 56 1HE LYS 56 -3.793 18.296 7.260 444 1HZ LYS 56 1HZ LYS 56 -3.158 18.855 4.678 445 2HZ LYS 56 2HZ LYS 56 -3.192 19.973 5.947 446 3HZ LYS 56 3HZ LYS 56 -4.537 19.801 4.936 447 H ASN 57 H ASN 57 -5.337 13.056 8.974 448 HA ASN 57 HA ASN 57 -4.732 14.923 10.975 449 1HB ASN 57 2HB ASN 57 -6.925 14.317 11.134 450 2HB ASN 57 1HB ASN 57 -6.609 12.648 10.673 451 1HD2 ASN 57 1HD2 ASN 57 -6.123 11.146 12.237 452 2HD2 ASN 57 2HD2 ASN 57 -6.319 11.456 13.926 453 H LYS 58 H LYS 58 -4.181 11.411 10.880 454 HA LYS 58 HA LYS 58 -2.973 11.224 13.416 455 1HB LYS 58 2HB LYS 58 -3.005 9.493 10.973 456 2HB LYS 58 1HB LYS 58 -1.913 9.104 12.294 457 1HG LYS 58 2HG LYS 58 -4.913 9.302 12.434 458 2HG LYS 58 1HG LYS 58 -3.939 7.834 12.524 459 1HD LYS 58 2HD LYS 58 -3.718 10.098 14.501 460 2HD LYS 58 1HD LYS 58 -4.788 8.715 14.728 461 1HE LYS 58 2HE LYS 58 -3.028 7.803 15.778 462 2HE LYS 58 1HE LYS 58 -2.439 7.477 14.147 463 1HZ LYS 58 1HZ LYS 58 -1.342 9.176 16.134 464 2HZ LYS 58 2HZ LYS 58 -1.675 10.066 14.734 465 3HZ LYS 58 3HZ LYS 58 -0.677 8.703 14.651 466 H LEU 59 H LEU 59 -1.630 11.763 10.192 467 HA LEU 59 HA LEU 59 1.085 11.605 10.947 468 1HB LEU 59 2HB LEU 59 -0.124 13.169 8.667 469 2HB LEU 59 1HB LEU 59 1.558 12.697 8.822 470 HG LEU 59 HG LEU 59 -0.642 10.652 8.692 471 1HD1 LEU 59 1HD1 LEU 59 0.906 11.757 6.357 472 2HD1 LEU 59 2HD1 LEU 59 -0.778 12.136 6.719 473 3HD1 LEU 59 3HD1 LEU 59 -0.313 10.482 6.318 474 1HD2 LEU 59 1HD2 LEU 59 2.333 10.628 8.258 475 2HD2 LEU 59 2HD2 LEU 59 1.278 9.311 7.744 476 3HD2 LEU 59 3HD2 LEU 59 1.397 9.731 9.453 477 H ALA 60 H ALA 60 -1.059 14.399 10.466 478 HA ALA 60 HA ALA 60 0.748 16.412 11.110 479 1HB ALA 60 1HB ALA 60 -1.095 17.850 11.317 480 2HB ALA 60 2HB ALA 60 -2.163 16.547 11.837 481 3HB ALA 60 3HB ALA 60 -1.615 16.623 10.162 482 H GLN 61 H GLN 61 -1.066 14.236 13.144 483 HA GLN 61 HA GLN 61 -0.859 15.578 15.591 484 1HB GLN 61 2HB GLN 61 -1.492 12.873 14.686 485 2HB GLN 61 1HB GLN 61 -0.704 12.901 16.258 486 1HG GLN 61 2HG GLN 61 -2.527 14.849 16.609 487 2HG GLN 61 1HG GLN 61 -3.381 13.819 15.461 488 1HE2 GLN 61 1HE2 GLN 61 -2.565 11.333 16.191 489 2HE2 GLN 61 2HE2 GLN 61 -3.110 10.973 17.790 490 H LEU 62 H LEU 62 1.313 13.155 14.129 491 HA LEU 62 HA LEU 62 3.529 14.299 15.627 492 1HB LEU 62 2HB LEU 62 4.132 11.720 16.071 493 2HB LEU 62 1HB LEU 62 3.305 12.740 17.233 494 HG LEU 62 HG LEU 62 1.230 11.708 15.726 495 1HD1 LEU 62 1HD1 LEU 62 3.470 9.741 15.900 496 2HD1 LEU 62 2HD1 LEU 62 2.355 10.058 14.571 497 3HD1 LEU 62 3HD1 LEU 62 1.798 9.192 16.003 498 1HD2 LEU 62 1HD2 LEU 62 0.505 11.095 17.751 499 2HD2 LEU 62 2HD2 LEU 62 1.982 11.848 18.354 500 3HD2 LEU 62 3HD2 LEU 62 1.934 10.109 18.066 501 H ASN 63 H ASN 63 2.464 11.843 13.304 502 HA ASN 63 HA ASN 63 5.010 11.337 12.192 503 1HB ASN 63 2HB ASN 63 2.390 11.068 10.719 504 2HB ASN 63 1HB ASN 63 3.871 10.146 10.475 505 1HD2 ASN 63 1HD2 ASN 63 0.880 9.860 11.581 506 2HD2 ASN 63 2HD2 ASN 63 1.099 8.671 12.816 507 H ILE 64 H ILE 64 4.578 11.612 9.428 508 HA ILE 64 HA ILE 64 4.957 14.511 9.139 509 HB ILE 64 HB ILE 64 5.776 12.361 7.187 510 1HG1 ILE 64 2HG1 ILE 64 8.082 13.384 8.341 511 2HG1 ILE 64 1HG1 ILE 64 6.987 13.202 9.708 512 1HG2 ILE 64 1HG2 ILE 64 5.665 15.177 7.015 513 2HG2 ILE 64 2HG2 ILE 64 6.340 14.038 5.850 514 3HG2 ILE 64 3HG2 ILE 64 7.367 14.726 7.108 515 1HD1 ILE 64 1HD1 ILE 64 6.955 10.933 9.555 516 2HD1 ILE 64 2HD1 ILE 64 8.572 11.255 8.928 517 3HD1 ILE 64 3HD1 ILE 64 7.243 10.933 7.815 518 H GLU 65 H GLU 65 3.650 15.702 7.877 519 HA GLU 65 HA GLU 65 1.148 14.756 7.065 520 1HB GLU 65 2HB GLU 65 2.609 17.255 6.971 521 2HB GLU 65 1HB GLU 65 1.647 17.027 5.517 522 1HG GLU 65 2HG GLU 65 -0.233 17.495 6.589 523 2HG GLU 65 1HG GLU 65 0.136 16.352 7.879 524 H HIS 66 H HIS 66 0.444 15.421 4.640 525 HA HIS 66 HA HIS 66 1.445 13.367 3.002 526 1HB HIS 66 2HB HIS 66 0.001 14.270 1.263 527 2HB HIS 66 1HB HIS 66 -0.846 14.253 2.805 528 HD1 HIS 66 1HD HIS 66 -1.106 16.185 0.114 529 HD2 HIS 66 2HD HIS 66 0.156 17.162 3.951 530 HE1 HIS 66 1HE HIS 66 -1.474 18.662 0.332 531 HE2 HIS 66 2HE HIS 66 -0.608 19.247 2.624 532 H LYS 67 H LYS 67 2.969 13.296 1.495 533 HA LYS 67 HA LYS 67 4.058 15.634 0.244 534 1HB LYS 67 2HB LYS 67 5.530 14.234 2.438 535 2HB LYS 67 1HB LYS 67 6.446 14.839 1.065 536 1HG LYS 67 2HG LYS 67 6.530 16.794 2.099 537 2HG LYS 67 1HG LYS 67 4.798 16.953 1.800 538 1HD LYS 67 2HD LYS 67 4.428 16.879 3.990 539 2HD LYS 67 1HD LYS 67 5.121 15.254 4.043 540 1HE LYS 67 2HE LYS 67 6.681 17.831 4.236 541 2HE LYS 67 1HE LYS 67 6.233 16.807 5.600 542 1HZ LYS 67 1HZ LYS 67 7.443 15.044 4.005 543 2HZ LYS 67 2HZ LYS 67 8.239 15.908 5.221 544 3HZ LYS 67 3HZ LYS 67 8.314 16.442 3.618 545 H ASN 68 H ASN 68 2.801 13.109 -0.418 546 HA ASN 68 HA ASN 68 4.869 12.055 -2.223 547 1HB ASN 68 2HB ASN 68 2.730 10.240 -1.173 548 2HB ASN 68 1HB ASN 68 4.333 9.839 -1.781 549 1HD2 ASN 68 1HD2 ASN 68 2.445 10.285 0.939 550 2HD2 ASN 68 2HD2 ASN 68 3.700 10.323 2.126 551 H PHE 69 H PHE 69 3.085 14.083 -2.859 552 HA PHE 69 HA PHE 69 0.797 12.995 -4.211 553 1HB PHE 69 2HB PHE 69 1.097 15.538 -5.218 554 2HB PHE 69 1HB PHE 69 0.164 15.110 -3.790 555 HD1 PHE 69 1HD PHE 69 0.734 15.965 -1.701 556 HD2 PHE 69 2HD PHE 69 3.533 16.201 -4.897 557 HE1 PHE 69 1HE PHE 69 2.179 17.403 -0.322 558 HE2 PHE 69 2HE PHE 69 4.984 17.640 -3.525 559 HZ PHE 69 HZ PHE 69 4.307 18.241 -1.234 560 H THR 70 H THR 70 1.093 11.798 -5.979 561 HA THR 70 HA THR 70 2.496 12.949 -8.241 562 HB THR 70 HB THR 70 3.268 10.136 -7.574 563 HG1 THR 70 1HG THR 70 5.220 11.750 -6.777 564 1HG2 THR 70 1HG2 THR 70 4.489 12.407 -9.133 565 2HG2 THR 70 2HG2 THR 70 3.900 10.861 -9.743 566 3HG2 THR 70 3HG2 THR 70 5.363 10.921 -8.762 567 H SER 71 H SER 71 0.873 12.873 -9.673 568 HA SER 71 HA SER 71 -1.206 10.982 -9.693 569 1HB SER 71 2HB SER 71 -0.679 12.129 -12.317 570 2HB SER 71 1HB SER 71 -2.075 12.337 -11.261 571 HG SER 71 HG SER 71 -0.779 14.270 -11.709 572 H LYS 72 H LYS 72 -0.745 8.868 -9.864 573 HA LYS 72 HA LYS 72 0.806 8.010 -12.214 574 1HB LYS 72 2HB LYS 72 0.782 6.784 -9.455 575 2HB LYS 72 1HB LYS 72 1.515 6.029 -10.863 576 1HG LYS 72 2HG LYS 72 2.312 8.740 -9.837 577 2HG LYS 72 1HG LYS 72 3.096 7.238 -9.346 578 1HD LYS 72 2HD LYS 72 2.802 7.778 -12.254 579 2HD LYS 72 1HD LYS 72 4.012 8.697 -11.358 580 1HE LYS 72 2HE LYS 72 3.925 5.765 -10.930 581 2HE LYS 72 1HE LYS 72 4.542 6.340 -12.477 582 1HZ LYS 72 1HZ LYS 72 5.771 7.919 -10.615 583 2HZ LYS 72 2HZ LYS 72 6.468 6.615 -11.437 584 3HZ LYS 72 3HZ LYS 72 5.782 6.380 -9.909 585 H LYS 73 H LYS 73 0.370 5.535 -12.582 586 HA LYS 73 HA LYS 73 -2.300 4.659 -11.975 587 1HB LYS 73 2HB LYS 73 -2.938 4.484 -14.420 588 2HB LYS 73 1HB LYS 73 -2.951 6.105 -13.739 589 1HG LYS 73 2HG LYS 73 -0.398 5.359 -14.940 590 2HG LYS 73 1HG LYS 73 -1.748 5.374 -16.076 591 1HD LYS 73 2HD LYS 73 -2.320 7.659 -15.250 592 2HD LYS 73 1HD LYS 73 -0.839 7.628 -14.291 593 1HE LYS 73 2HE LYS 73 0.524 7.567 -16.214 594 2HE LYS 73 1HE LYS 73 -0.839 7.172 -17.261 595 1HZ LYS 73 1HZ LYS 73 0.093 9.592 -17.134 596 2HZ LYS 73 2HZ LYS 73 -0.900 9.696 -15.771 597 3HZ LYS 73 3HZ LYS 73 -1.570 9.320 -17.277 598 H LEU 74 H LEU 74 -1.714 2.663 -11.361 599 HA LEU 74 HA LEU 74 0.431 1.174 -12.328 600 1HB LEU 74 2HB LEU 74 -0.271 0.189 -10.428 601 2HB LEU 74 1HB LEU 74 -1.937 0.671 -10.673 602 HG LEU 74 HG LEU 74 -1.472 -1.336 -12.576 603 1HD1 LEU 74 1HD1 LEU 74 -0.486 -3.141 -11.483 604 2HD1 LEU 74 2HD1 LEU 74 -0.571 -2.354 -9.908 605 3HD1 LEU 74 3HD1 LEU 74 0.581 -1.786 -11.116 606 1HD2 LEU 74 1HD2 LEU 74 -2.997 -2.638 -11.066 607 2HD2 LEU 74 2HD2 LEU 74 -3.577 -1.035 -11.516 608 3HD2 LEU 74 3HD2 LEU 74 -2.882 -1.304 -9.918 609 H THR 75 H THR 75 0.778 0.145 -14.185 610 HA THR 75 HA THR 75 -1.517 -0.812 -15.743 611 HB THR 75 HB THR 75 -0.181 -0.057 -17.826 612 HG1 THR 75 1HG THR 75 0.742 2.033 -16.198 613 1HG2 THR 75 1HG2 THR 75 -2.314 0.907 -17.329 614 2HG2 THR 75 2HG2 THR 75 -1.206 2.229 -17.697 615 3HG2 THR 75 3HG2 THR 75 -1.633 1.877 -16.023 616 H GLN 76 H GLN 76 -0.222 -1.801 -17.923 617 HA GLN 76 HA GLN 76 0.834 -4.230 -16.971 618 1HB GLN 76 2HB GLN 76 1.216 -3.127 -19.755 619 2HB GLN 76 1HB GLN 76 1.169 -4.815 -19.264 620 1HG GLN 76 2HG GLN 76 -1.247 -3.332 -18.579 621 2HG GLN 76 1HG GLN 76 -0.916 -3.398 -20.310 622 1HE2 GLN 76 1HE2 GLN 76 -0.434 -5.577 -21.185 623 2HE2 GLN 76 2HE2 GLN 76 -1.323 -6.915 -20.547 624 H LYS 77 H LYS 77 2.404 -1.429 -18.503 625 HA LYS 77 HA LYS 77 5.019 -2.425 -18.490 626 1HB LYS 77 2HB LYS 77 4.086 -0.320 -19.636 627 2HB LYS 77 1HB LYS 77 4.352 0.485 -18.097 628 1HG LYS 77 2HG LYS 77 6.569 0.596 -18.394 629 2HG LYS 77 1HG LYS 77 6.659 -1.023 -19.090 630 1HD LYS 77 2HD LYS 77 6.866 -0.117 -21.109 631 2HD LYS 77 1HD LYS 77 5.264 0.603 -20.933 632 1HE LYS 77 2HE LYS 77 6.202 2.613 -20.912 633 2HE LYS 77 1HE LYS 77 7.028 2.184 -19.414 634 1HZ LYS 77 1HZ LYS 77 8.884 2.470 -20.587 635 2HZ LYS 77 2HZ LYS 77 8.077 2.433 -22.073 636 3HZ LYS 77 3HZ LYS 77 8.534 0.987 -21.324 637 H LEU 78 H LEU 78 3.157 -0.744 -16.025 638 HA LEU 78 HA LEU 78 5.278 -0.302 -14.210 639 1HB LEU 78 2HB LEU 78 2.454 0.109 -14.294 640 2HB LEU 78 1HB LEU 78 2.853 -0.680 -12.781 641 HG LEU 78 HG LEU 78 4.739 1.396 -13.136 642 1HD1 LEU 78 1HD1 LEU 78 3.516 2.674 -14.601 643 2HD1 LEU 78 2HD1 LEU 78 2.924 3.274 -13.052 644 3HD1 LEU 78 3HD1 LEU 78 1.968 2.111 -13.970 645 1HD2 LEU 78 1HD2 LEU 78 2.751 2.155 -11.277 646 2HD2 LEU 78 2HD2 LEU 78 4.321 1.417 -10.958 647 3HD2 LEU 78 3HD2 LEU 78 2.900 0.400 -11.200 648 H CYS 79 H CYS 79 2.906 -2.914 -14.534 649 HA CYS 79 HA CYS 79 3.808 -4.378 -12.274 650 1HB CYS 79 2HB CYS 79 2.062 -5.729 -12.727 651 2HB CYS 79 1HB CYS 79 1.634 -4.534 -13.946 652 HG CYS 79 HG CYS 79 2.438 -5.904 -16.094 653 H ASP 80 H ASP 80 4.866 -4.120 -15.555 654 HA ASP 80 HA ASP 80 6.232 -6.558 -15.832 655 1HB ASP 80 2HB ASP 80 5.786 -4.411 -17.456 656 2HB ASP 80 1HB ASP 80 7.498 -4.214 -17.097 657 H GLU 81 H GLU 81 6.943 -3.727 -14.013 658 HA GLU 81 HA GLU 81 9.744 -4.464 -13.651 659 1HB GLU 81 2HB GLU 81 8.127 -2.102 -12.684 660 2HB GLU 81 1HB GLU 81 9.816 -2.363 -12.271 661 1HG GLU 81 2HG GLU 81 9.675 -2.573 -15.057 662 2HG GLU 81 1HG GLU 81 8.674 -1.189 -14.623 663 H SER 82 H SER 82 6.959 -3.687 -11.563 664 HA SER 82 HA SER 82 8.058 -4.595 -9.173 665 1HB SER 82 2HB SER 82 6.019 -4.140 -8.258 666 2HB SER 82 1HB SER 82 5.777 -3.331 -9.806 667 HG SER 82 HG SER 82 4.622 -5.623 -8.809 668 H ASP 83 H ASP 83 8.272 -6.524 -8.214 669 HA ASP 83 HA ASP 83 7.601 -8.893 -9.785 670 1HB ASP 83 2HB ASP 83 9.817 -8.193 -8.242 671 2HB ASP 83 1HB ASP 83 8.976 -9.399 -7.274 672 H PHE 84 H PHE 84 6.748 -7.244 -6.847 673 HA PHE 84 HA PHE 84 4.828 -9.396 -6.226 674 1HB PHE 84 2HB PHE 84 6.227 -7.504 -4.323 675 2HB PHE 84 1HB PHE 84 4.953 -8.629 -3.861 676 HD1 PHE 84 1HD PHE 84 5.359 -11.058 -3.949 677 HD2 PHE 84 2HD PHE 84 8.459 -8.233 -4.669 678 HE1 PHE 84 1HE PHE 84 7.041 -12.819 -3.595 679 HE2 PHE 84 2HE PHE 84 10.147 -9.988 -4.316 680 HZ PHE 84 HZ PHE 84 9.438 -12.285 -3.778 681 H LEU 85 H LEU 85 2.791 -8.833 -6.590 682 HA LEU 85 HA LEU 85 2.099 -5.982 -6.652 683 1HB LEU 85 2HB LEU 85 1.524 -8.068 -8.386 684 2HB LEU 85 1HB LEU 85 0.026 -7.838 -7.505 685 HG LEU 85 HG LEU 85 0.283 -5.345 -8.110 686 1HD1 LEU 85 1HD1 LEU 85 1.559 -4.850 -10.082 687 2HD1 LEU 85 2HD1 LEU 85 2.057 -6.535 -10.234 688 3HD1 LEU 85 3HD1 LEU 85 2.629 -5.565 -8.877 689 1HD2 LEU 85 1HD2 LEU 85 -0.311 -7.416 -10.220 690 2HD2 LEU 85 2HD2 LEU 85 -0.789 -5.719 -10.292 691 3HD2 LEU 85 3HD2 LEU 85 -1.445 -6.768 -9.036 692 H ILE 86 H ILE 86 0.447 -5.125 -5.437 693 HA ILE 86 HA ILE 86 -0.934 -6.901 -3.552 694 HB ILE 86 HB ILE 86 0.302 -4.276 -2.711 695 1HG1 ILE 86 2HG1 ILE 86 1.640 -6.048 -1.236 696 2HG1 ILE 86 1HG1 ILE 86 1.326 -7.075 -2.631 697 1HG2 ILE 86 1HG2 ILE 86 -1.183 -4.453 -1.060 698 2HG2 ILE 86 2HG2 ILE 86 -0.226 -5.814 -0.478 699 3HG2 ILE 86 3HG2 ILE 86 -1.618 -6.098 -1.523 700 1HD1 ILE 86 1HD1 ILE 86 2.679 -4.392 -2.734 701 2HD1 ILE 86 2HD1 ILE 86 2.447 -5.509 -4.079 702 3HD1 ILE 86 3HD1 ILE 86 3.503 -5.952 -2.739 703 H THR 87 H THR 87 -3.022 -6.343 -3.109 704 HA THR 87 HA THR 87 -4.121 -4.132 -4.680 705 HB THR 87 HB THR 87 -6.239 -5.536 -3.488 706 HG1 THR 87 1HG THR 87 -5.720 -7.615 -3.579 707 1HG2 THR 87 1HG2 THR 87 -5.038 -5.355 -6.220 708 2HG2 THR 87 2HG2 THR 87 -6.591 -4.758 -5.636 709 3HG2 THR 87 3HG2 THR 87 -6.363 -6.482 -5.925 710 H MET 88 H MET 88 -4.458 -5.540 -1.423 711 HA MET 88 HA MET 88 -4.719 -4.577 0.616 712 1HB MET 88 2HB MET 88 -4.684 -1.880 -0.746 713 2HB MET 88 1HB MET 88 -4.431 -2.213 0.963 714 1HG MET 88 2HG MET 88 -2.405 -3.567 0.229 715 2HG MET 88 1HG MET 88 -2.608 -2.795 -1.343 716 1HE MET 88 1HE MET 88 -1.236 0.642 -0.983 717 2HE MET 88 2HE MET 88 -2.721 -0.091 -1.587 718 3HE MET 88 3HE MET 88 -1.164 -0.847 -1.924 719 H ASP 89 H ASP 89 -6.590 -3.068 -1.989 720 HA ASP 89 HA ASP 89 -8.850 -2.590 -0.263 721 1HB ASP 89 2HB ASP 89 -8.829 -2.472 -3.279 722 2HB ASP 89 1HB ASP 89 -9.916 -1.639 -2.173 723 H ASN 90 H ASN 90 -10.838 -3.687 -0.354 724 HA ASN 90 HA ASN 90 -10.624 -6.475 -0.767 725 1HB ASN 90 2HB ASN 90 -12.978 -4.686 -0.170 726 2HB ASN 90 1HB ASN 90 -13.125 -6.435 -0.312 727 1HD2 ASN 90 1HD2 ASN 90 -13.125 -7.427 1.557 728 2HD2 ASN 90 2HD2 ASN 90 -12.265 -6.942 2.974 729 H SER 91 H SER 91 -12.870 -4.186 -2.341 730 HA SER 91 HA SER 91 -13.717 -5.941 -4.338 731 1HB SER 91 2HB SER 91 -13.873 -3.348 -5.427 732 2HB SER 91 1HB SER 91 -15.144 -4.239 -4.592 733 HG SER 91 HG SER 91 -14.518 -2.102 -3.720 734 H ASN 92 H ASN 92 -10.904 -3.854 -4.209 735 HA ASN 92 HA ASN 92 -10.264 -3.801 -6.930 736 1HB ASN 92 2HB ASN 92 -8.763 -3.394 -4.402 737 2HB ASN 92 1HB ASN 92 -7.816 -3.679 -5.860 738 1HD2 ASN 92 1HD2 ASN 92 -7.142 -1.432 -5.214 739 2HD2 ASN 92 2HD2 ASN 92 -8.043 -0.123 -5.893 740 H PHE 93 H PHE 93 -9.986 -6.357 -4.620 741 HA PHE 93 HA PHE 93 -7.958 -7.875 -5.859 742 1HB PHE 93 2HB PHE 93 -8.776 -8.260 -3.545 743 2HB PHE 93 1HB PHE 93 -10.285 -8.877 -4.207 744 HD1 PHE 93 1HD PHE 93 -6.694 -9.461 -5.056 745 HD2 PHE 93 2HD PHE 93 -10.425 -11.140 -3.884 746 HE1 PHE 93 1HE PHE 93 -5.715 -11.714 -5.183 747 HE2 PHE 93 2HE PHE 93 -9.453 -13.397 -4.008 748 HZ PHE 93 HZ PHE 93 -7.095 -13.686 -4.658 749 H LYS 94 H LYS 94 -11.507 -8.229 -6.016 750 HA LYS 94 HA LYS 94 -11.446 -10.213 -8.035 751 1HB LYS 94 2HB LYS 94 -13.380 -9.141 -6.385 752 2HB LYS 94 1HB LYS 94 -13.864 -8.564 -7.974 753 1HG LYS 94 2HG LYS 94 -13.152 -11.426 -7.749 754 2HG LYS 94 1HG LYS 94 -14.653 -10.903 -6.983 755 1HD LYS 94 2HD LYS 94 -14.471 -9.718 -9.574 756 2HD LYS 94 1HD LYS 94 -14.180 -11.453 -9.716 757 1HE LYS 94 2HE LYS 94 -16.271 -11.647 -8.171 758 2HE LYS 94 1HE LYS 94 -16.605 -10.008 -8.731 759 1HZ LYS 94 1HZ LYS 94 -16.863 -12.509 -10.125 760 2HZ LYS 94 2HZ LYS 94 -16.037 -11.336 -11.020 761 3HZ LYS 94 3HZ LYS 94 -17.593 -11.015 -10.440 762 H ASN 95 H ASN 95 -11.388 -6.737 -8.088 763 HA ASN 95 HA ASN 95 -12.190 -6.357 -10.775 764 1HB ASN 95 2HB ASN 95 -11.857 -4.657 -8.766 765 2HB ASN 95 1HB ASN 95 -10.262 -4.473 -9.491 766 1HD2 ASN 95 1HD2 ASN 95 -10.247 -4.015 -11.845 767 2HD2 ASN 95 2HD2 ASN 95 -11.469 -2.961 -12.464 768 H VAL 96 H VAL 96 -8.936 -6.317 -9.306 769 HA VAL 96 HA VAL 96 -7.542 -6.150 -11.750 770 HB VAL 96 HB VAL 96 -5.549 -6.809 -10.482 771 1HG1 VAL 96 1HG1 VAL 96 -7.360 -4.849 -9.083 772 2HG1 VAL 96 2HG1 VAL 96 -6.202 -4.504 -10.368 773 3HG1 VAL 96 3HG1 VAL 96 -5.630 -5.005 -8.778 774 1HG2 VAL 96 1HG2 VAL 96 -7.141 -8.378 -9.003 775 2HG2 VAL 96 2HG2 VAL 96 -7.025 -6.986 -7.927 776 3HG2 VAL 96 3HG2 VAL 96 -5.562 -7.817 -8.454 777 H LEU 97 H LEU 97 -8.970 -8.808 -10.065 778 HA LEU 97 HA LEU 97 -7.473 -10.957 -10.979 779 1HB LEU 97 2HB LEU 97 -9.946 -10.568 -9.670 780 2HB LEU 97 1HB LEU 97 -10.257 -11.640 -11.023 781 HG LEU 97 HG LEU 97 -7.888 -12.508 -9.658 782 1HD1 LEU 97 1HD1 LEU 97 -8.630 -11.494 -7.662 783 2HD1 LEU 97 2HD1 LEU 97 -9.084 -13.195 -7.541 784 3HD1 LEU 97 3HD1 LEU 97 -10.300 -11.984 -7.946 785 1HD2 LEU 97 1HD2 LEU 97 -9.727 -13.685 -11.118 786 2HD2 LEU 97 2HD2 LEU 97 -10.491 -13.951 -9.550 787 3HD2 LEU 97 3HD2 LEU 97 -8.868 -14.569 -9.857 788 H LYS 98 H LYS 98 -10.115 -9.234 -12.586 789 HA LYS 98 HA LYS 98 -9.694 -10.875 -14.985 790 1HB LYS 98 2HB LYS 98 -12.007 -9.549 -13.794 791 2HB LYS 98 1HB LYS 98 -11.840 -9.209 -15.511 792 1HG LYS 98 2HG LYS 98 -11.872 -11.558 -16.031 793 2HG LYS 98 1HG LYS 98 -11.875 -11.971 -14.316 794 1HD LYS 98 2HD LYS 98 -14.105 -12.057 -14.533 795 2HD LYS 98 1HD LYS 98 -14.028 -10.295 -14.509 796 1HE LYS 98 2HE LYS 98 -13.525 -10.772 -17.119 797 2HE LYS 98 1HE LYS 98 -14.568 -12.143 -16.740 798 1HZ LYS 98 1HZ LYS 98 -15.239 -9.380 -17.043 799 2HZ LYS 98 2HZ LYS 98 -15.822 -10.015 -15.589 800 3HZ LYS 98 3HZ LYS 98 -16.246 -10.741 -17.057 801 H ASN 99 H ASN 99 -9.334 -7.678 -13.714 802 HA ASN 99 HA ASN 99 -9.224 -6.183 -16.074 803 1HB ASN 99 2HB ASN 99 -8.655 -5.773 -13.301 804 2HB ASN 99 1HB ASN 99 -7.329 -5.110 -14.252 805 1HD2 ASN 99 1HD2 ASN 99 -10.820 -5.327 -14.821 806 2HD2 ASN 99 2HD2 ASN 99 -11.060 -3.632 -15.059 807 H PHE 100 H PHE 100 -6.635 -7.858 -14.309 808 HA PHE 100 HA PHE 100 -4.807 -7.305 -16.532 809 1HB PHE 100 2HB PHE 100 -4.368 -8.190 -13.688 810 2HB PHE 100 1HB PHE 100 -3.093 -8.300 -14.897 811 HD1 PHE 100 1HD PHE 100 -1.979 -6.348 -15.709 812 HD2 PHE 100 2HD PHE 100 -5.211 -6.014 -12.962 813 HE1 PHE 100 1HE PHE 100 -1.386 -3.994 -15.305 814 HE2 PHE 100 2HE PHE 100 -4.626 -3.660 -12.554 815 HZ PHE 100 HZ PHE 100 -2.711 -2.646 -13.725 816 H THR 101 H THR 101 -3.084 -9.276 -16.606 817 HA THR 101 HA THR 101 -4.529 -11.413 -17.826 818 HB THR 101 HB THR 101 -1.739 -12.037 -17.331 819 HG1 THR 101 1HG THR 101 -0.952 -10.233 -18.592 820 1HG2 THR 101 1HG2 THR 101 -1.923 -11.637 -19.979 821 2HG2 THR 101 2HG2 THR 101 -3.635 -11.819 -19.594 822 3HG2 THR 101 3HG2 THR 101 -2.497 -13.105 -19.186 823 H ASN 102 H ASN 102 -3.159 -13.681 -17.267 824 HA ASN 102 HA ASN 102 -4.385 -14.561 -14.860 825 1HB ASN 102 2HB ASN 102 -3.034 -16.692 -15.384 826 2HB ASN 102 1HB ASN 102 -4.262 -16.186 -16.541 827 1HD2 ASN 102 1HD2 ASN 102 -3.169 -17.403 -18.135 828 2HD2 ASN 102 2HD2 ASN 102 -1.744 -16.792 -18.897 829 H THR 103 H THR 103 -1.935 -12.572 -14.936 830 HA THR 103 HA THR 103 -0.092 -13.983 -13.188 831 HB THR 103 HB THR 103 0.752 -12.419 -14.939 832 HG1 THR 103 1HG THR 103 1.590 -12.745 -12.498 833 1HG2 THR 103 1HG2 THR 103 -0.084 -10.366 -15.147 834 2HG2 THR 103 2HG2 THR 103 0.435 -9.973 -13.508 835 3HG2 THR 103 3HG2 THR 103 -1.160 -10.673 -13.783 836 H GLN 104 H GLN 104 -2.990 -12.845 -12.616 837 HA GLN 104 HA GLN 104 -2.654 -11.007 -10.479 838 1HB GLN 104 2HB GLN 104 -5.044 -11.928 -9.890 839 2HB GLN 104 1HB GLN 104 -4.800 -10.923 -11.312 840 1HG GLN 104 2HG GLN 104 -6.216 -12.756 -11.895 841 2HG GLN 104 1HG GLN 104 -4.654 -12.976 -12.683 842 1HE2 GLN 104 1HE2 GLN 104 -3.447 -14.735 -12.218 843 2HE2 GLN 104 2HE2 GLN 104 -3.943 -15.998 -11.148 844 H ASN 105 H ASN 105 -1.907 -14.248 -10.706 845 HA ASN 105 HA ASN 105 -2.633 -15.120 -8.089 846 1HB ASN 105 2HB ASN 105 -2.179 -16.616 -10.075 847 2HB ASN 105 1HB ASN 105 -0.467 -16.273 -9.852 848 1HD2 ASN 105 1HD2 ASN 105 -3.316 -17.476 -8.139 849 2HD2 ASN 105 2HD2 ASN 105 -2.462 -18.608 -7.152 850 H LYS 106 H LYS 106 -0.357 -12.932 -9.128 851 HA LYS 106 HA LYS 106 1.462 -13.503 -6.889 852 1HB LYS 106 2HB LYS 106 1.811 -12.216 -9.547 853 2HB LYS 106 1HB LYS 106 2.782 -11.594 -8.219 854 1HG LYS 106 2HG LYS 106 3.435 -14.038 -7.810 855 2HG LYS 106 1HG LYS 106 2.787 -14.335 -9.424 856 1HD LYS 106 2HD LYS 106 4.309 -12.382 -10.152 857 2HD LYS 106 1HD LYS 106 5.130 -12.649 -8.612 858 1HE LYS 106 2HE LYS 106 5.476 -15.012 -9.249 859 2HE LYS 106 1HE LYS 106 4.738 -14.672 -10.814 860 1HZ LYS 106 1HZ LYS 106 7.281 -14.616 -10.609 861 2HZ LYS 106 2HZ LYS 106 7.056 -13.104 -9.884 862 3HZ LYS 106 3HZ LYS 106 6.518 -13.372 -11.465 863 H VAL 107 H VAL 107 -1.227 -12.114 -6.904 864 HA VAL 107 HA VAL 107 -0.381 -9.507 -5.827 865 HB VAL 107 HB VAL 107 -3.200 -10.279 -6.562 866 1HG1 VAL 107 1HG1 VAL 107 -2.138 -8.102 -5.185 867 2HG1 VAL 107 2HG1 VAL 107 -3.761 -8.244 -5.862 868 3HG1 VAL 107 3HG1 VAL 107 -2.474 -7.496 -6.808 869 1HG2 VAL 107 1HG2 VAL 107 -1.800 -8.483 -8.394 870 2HG2 VAL 107 2HG2 VAL 107 -2.867 -9.846 -8.734 871 3HG2 VAL 107 3HG2 VAL 107 -1.161 -10.127 -8.382 872 H LEU 108 H LEU 108 -0.831 -8.953 -3.752 873 HA LEU 108 HA LEU 108 -1.980 -11.055 -2.054 874 1HB LEU 108 2HB LEU 108 -0.607 -8.695 -0.881 875 2HB LEU 108 1HB LEU 108 -0.625 -10.363 -0.342 876 HG LEU 108 HG LEU 108 0.881 -9.497 -2.800 877 1HD1 LEU 108 1HD1 LEU 108 2.165 -9.881 -0.124 878 2HD1 LEU 108 2HD1 LEU 108 1.544 -8.305 -0.613 879 3HD1 LEU 108 3HD1 LEU 108 2.804 -9.090 -1.565 880 1HD2 LEU 108 1HD2 LEU 108 0.950 -11.739 -2.964 881 2HD2 LEU 108 2HD2 LEU 108 0.530 -11.979 -1.268 882 3HD2 LEU 108 3HD2 LEU 108 2.193 -11.604 -1.719 883 H LYS 109 H LYS 109 -3.431 -10.460 -0.337 884 HA LYS 109 HA LYS 109 -4.897 -7.961 -0.858 885 1HB LYS 109 2HB LYS 109 -6.485 -10.096 0.350 886 2HB LYS 109 1HB LYS 109 -6.862 -9.045 -1.006 887 1HG LYS 109 2HG LYS 109 -6.128 -10.532 -2.546 888 2HG LYS 109 1HG LYS 109 -4.874 -11.180 -1.488 889 1HD LYS 109 2HD LYS 109 -7.634 -11.685 -0.608 890 2HD LYS 109 1HD LYS 109 -7.172 -12.476 -2.117 891 1HE LYS 109 2HE LYS 109 -5.571 -12.634 0.431 892 2HE LYS 109 1HE LYS 109 -6.765 -13.836 -0.059 893 1HZ LYS 109 1HZ LYS 109 -5.482 -14.414 -1.936 894 2HZ LYS 109 2HZ LYS 109 -4.401 -14.359 -0.636 895 3HZ LYS 109 3HZ LYS 109 -4.449 -13.086 -1.749 896 H ILE 110 H ILE 110 -4.813 -6.610 0.801 897 HA ILE 110 HA ILE 110 -3.779 -7.298 3.334 898 HB ILE 110 HB ILE 110 -5.269 -4.869 2.355 899 1HG1 ILE 110 2HG1 ILE 110 -2.964 -5.257 1.527 900 2HG1 ILE 110 1HG1 ILE 110 -3.095 -3.796 2.498 901 1HG2 ILE 110 1HG2 ILE 110 -5.740 -5.198 4.755 902 2HG2 ILE 110 2HG2 ILE 110 -4.782 -3.752 4.438 903 3HG2 ILE 110 3HG2 ILE 110 -4.005 -5.202 5.071 904 1HD1 ILE 110 1HD1 ILE 110 -2.115 -4.949 4.395 905 2HD1 ILE 110 2HD1 ILE 110 -1.058 -5.046 2.987 906 3HD1 ILE 110 3HD1 ILE 110 -2.029 -6.441 3.460 907 H THR 111 H THR 111 -7.028 -7.147 2.048 908 HA THR 111 HA THR 111 -8.486 -7.132 4.435 909 HB THR 111 HB THR 111 -9.792 -6.785 2.533 910 HG1 THR 111 1HG THR 111 -10.925 -9.090 2.418 911 1HG2 THR 111 1HG2 THR 111 -8.802 -7.479 0.625 912 2HG2 THR 111 2HG2 THR 111 -9.816 -8.906 0.844 913 3HG2 THR 111 3HG2 THR 111 -8.135 -8.928 1.376 914 H ASP 112 H ASP 112 -6.785 -9.688 2.784 915 HA ASP 112 HA ASP 112 -7.955 -11.799 4.368 916 1HB ASP 112 2HB ASP 112 -6.959 -11.933 1.954 917 2HB ASP 112 1HB ASP 112 -5.420 -12.103 2.791 918 H PHE 113 H PHE 113 -5.203 -9.696 4.514 919 HA PHE 113 HA PHE 113 -3.939 -11.260 6.623 920 1HB PHE 113 2HB PHE 113 -3.108 -8.670 5.297 921 2HB PHE 113 1HB PHE 113 -2.170 -9.516 6.523 922 HD1 PHE 113 1HD PHE 113 -2.142 -12.243 5.807 923 HD2 PHE 113 2HD PHE 113 -2.139 -8.854 3.234 924 HE1 PHE 113 1HE PHE 113 -1.056 -13.582 4.050 925 HE2 PHE 113 2HE PHE 113 -1.056 -10.186 1.473 926 HZ PHE 113 HZ PHE 113 -0.513 -12.553 1.880 927 H SER 114 H SER 114 -6.462 -9.248 6.503 928 HA SER 114 HA SER 114 -5.814 -7.821 8.982 929 1HB SER 114 2HB SER 114 -7.299 -6.186 8.375 930 2HB SER 114 1HB SER 114 -6.908 -6.791 6.766 931 HG SER 114 HG SER 114 -9.272 -6.683 7.897 932 HA PRO 115 HA PRO 115 -8.201 -11.037 11.000 933 1HB PRO 115 2HB PRO 115 -7.700 -9.496 13.443 934 2HB PRO 115 1HB PRO 115 -7.184 -11.131 13.026 935 1HG PRO 115 2HG PRO 115 -5.451 -9.069 13.168 936 2HG PRO 115 1HG PRO 115 -5.245 -10.404 12.019 937 1HD PRO 115 2HD PRO 115 -6.327 -7.649 11.551 938 2HD PRO 115 1HD PRO 115 -5.225 -8.612 10.542 939 H SER 116 H SER 116 -8.863 -8.797 13.470 940 HA SER 116 HA SER 116 -11.659 -8.704 12.674 941 1HB SER 116 2HB SER 116 -10.729 -9.282 15.045 942 2HB SER 116 1HB SER 116 -10.597 -7.533 15.228 943 HG SER 116 HG SER 116 -12.853 -9.147 15.071 944 H LEU 117 H LEU 117 -9.525 -7.053 11.381 945 HA LEU 117 HA LEU 117 -9.883 -4.352 12.197 946 1HB LEU 117 2HB LEU 117 -8.596 -5.759 9.930 947 2HB LEU 117 1HB LEU 117 -9.051 -4.090 9.650 948 HG LEU 117 HG LEU 117 -7.160 -5.124 11.764 949 1HD1 LEU 117 1HD1 LEU 117 -5.556 -4.699 10.296 950 2HD1 LEU 117 2HD1 LEU 117 -6.140 -3.047 10.089 951 3HD1 LEU 117 3HD1 LEU 117 -6.787 -4.345 9.084 952 1HD2 LEU 117 1HD2 LEU 117 -8.764 -2.737 11.740 953 2HD2 LEU 117 2HD2 LEU 117 -7.051 -2.328 11.643 954 3HD2 LEU 117 3HD2 LEU 117 -7.647 -3.323 12.972 955 H ASN 118 H ASN 118 -11.304 -6.326 9.610 956 HA ASN 118 HA ASN 118 -13.074 -5.964 8.210 957 1HB ASN 118 2HB ASN 118 -14.129 -6.091 10.542 958 2HB ASN 118 1HB ASN 118 -14.247 -4.337 10.464 959 1HD2 ASN 118 1HD2 ASN 118 -14.812 -6.969 8.151 960 2HD2 ASN 118 2HD2 ASN 118 -16.410 -6.475 7.720 961 H TYR 119 H TYR 119 -11.608 -4.569 6.933 962 HA TYR 119 HA TYR 119 -12.643 -1.821 6.859 963 1HB TYR 119 2HB TYR 119 -10.625 -1.001 7.327 964 2HB TYR 119 1HB TYR 119 -9.999 -2.634 7.491 965 HD1 TYR 119 1HD TYR 119 -8.961 -3.751 5.488 966 HD2 TYR 119 2HD TYR 119 -10.041 0.364 5.499 967 HE1 TYR 119 1HE TYR 119 -7.480 -3.366 3.559 968 HE2 TYR 119 2HE TYR 119 -8.573 0.764 3.573 969 HH TYR 119 HH TYR 119 -7.338 -0.222 1.957 970 H ASP 120 H ASP 120 -12.806 -0.847 4.838 971 HA ASP 120 HA ASP 120 -13.017 -2.722 2.616 972 1HB ASP 120 2HB ASP 120 -13.797 0.084 2.187 973 2HB ASP 120 1HB ASP 120 -14.666 -1.400 1.809 974 H GLU 121 H GLU 121 -12.770 0.189 1.232 975 HA GLU 121 HA GLU 121 -9.976 -0.276 0.475 976 1HB GLU 121 2HB GLU 121 -11.851 1.609 -0.929 977 2HB GLU 121 1HB GLU 121 -10.422 0.809 -1.565 978 1HG GLU 121 2HG GLU 121 -12.028 -0.448 -2.556 979 2HG GLU 121 1HG GLU 121 -11.837 -1.358 -1.058 980 H VAL 122 H VAL 122 -8.643 0.804 1.752 981 HA VAL 122 HA VAL 122 -7.629 2.407 2.957 982 HB VAL 122 HB VAL 122 -7.284 4.510 1.977 983 1HG1 VAL 122 1HG1 VAL 122 -6.700 3.984 -0.254 984 2HG1 VAL 122 2HG1 VAL 122 -7.960 2.755 -0.369 985 3HG1 VAL 122 3HG1 VAL 122 -6.560 2.488 0.670 986 1HG2 VAL 122 1HG2 VAL 122 -9.377 4.452 -0.063 987 2HG2 VAL 122 2HG2 VAL 122 -8.797 5.785 0.936 988 3HG2 VAL 122 3HG2 VAL 122 -9.974 4.643 1.585 989 HA PRO 123 HA PRO 123 -10.505 3.692 6.033 990 1HB PRO 123 2HB PRO 123 -8.269 5.123 7.270 991 2HB PRO 123 1HB PRO 123 -9.166 3.722 7.856 992 1HG PRO 123 2HG PRO 123 -6.622 3.528 7.014 993 2HG PRO 123 1HG PRO 123 -7.797 2.223 6.765 994 1HD PRO 123 2HD PRO 123 -6.845 4.307 4.831 995 2HD PRO 123 1HD PRO 123 -7.092 2.565 4.575 996 H ASP 124 H ASP 124 -9.555 6.138 7.539 997 HA ASP 124 HA ASP 124 -9.832 8.395 7.600 998 1HB ASP 124 2HB ASP 124 -8.912 9.366 5.808 999 2HB ASP 124 1HB ASP 124 -9.198 7.930 4.833 1000 HA PRO 125 HA PRO 125 -14.150 8.780 8.241 1001 1HB PRO 125 2HB PRO 125 -13.817 11.606 7.356 1002 2HB PRO 125 1HB PRO 125 -14.554 10.966 8.829 1003 1HG PRO 125 2HG PRO 125 -12.131 12.058 8.894 1004 2HG PRO 125 1HG PRO 125 -12.505 10.619 9.861 1005 1HD PRO 125 2HD PRO 125 -10.934 10.854 7.337 1006 2HD PRO 125 1HD PRO 125 -10.697 9.767 8.721 1007 H TRP 126 H TRP 126 -12.856 10.070 5.217 1008 HA TRP 126 HA TRP 126 -15.345 10.424 3.926 1009 1HB TRP 126 2HB TRP 126 -13.439 11.568 3.061 1010 2HB TRP 126 1HB TRP 126 -12.541 10.068 2.872 1011 HD1 TRP 126 HD TRP 126 -13.133 8.541 0.748 1012 HE1 TRP 126 1HE TRP 126 -14.278 9.090 -1.487 1013 HE3 TRP 126 3HE TRP 126 -15.267 13.015 2.007 1014 HZ2 TRP 126 2HZ TRP 126 -15.869 11.140 -2.574 1015 HZ3 TRP 126 3HZ TRP 126 -16.586 14.208 0.306 1016 HH2 TRP 126 HH TRP 126 -16.881 13.290 -1.939 1017 H TYR 127 H TYR 127 -13.488 7.590 4.588 1018 HA TYR 127 HA TYR 127 -15.079 6.081 2.632 1019 1HB TYR 127 2HB TYR 127 -12.393 5.550 3.869 1020 2HB TYR 127 1HB TYR 127 -13.318 4.261 3.101 1021 HD1 TYR 127 1HD TYR 127 -13.841 4.393 0.680 1022 HD2 TYR 127 2HD TYR 127 -11.271 7.206 2.566 1023 HE1 TYR 127 1HE TYR 127 -13.026 5.116 -1.525 1024 HE2 TYR 127 2HE TYR 127 -10.449 7.939 0.364 1025 HH TYR 127 HH TYR 127 -11.228 7.932 -1.989 1026 H SER 128 H SER 128 -14.056 6.008 6.052 1027 HA SER 128 HA SER 128 -16.139 3.971 6.484 1028 1HB SER 128 2HB SER 128 -13.869 4.577 8.375 1029 2HB SER 128 1HB SER 128 -14.938 3.175 8.379 1030 HG SER 128 HG SER 128 -13.203 3.793 6.226 1031 H GLY 129 H GLY 129 -14.617 6.702 8.264 1032 1HA GLY 129 2HA GLY 129 -16.852 8.205 8.691 1033 2HA GLY 129 1HA GLY 129 -16.956 6.964 9.925 1034 H ASN 130 H ASN 130 -14.292 6.720 10.720 1035 HA ASN 130 HA ASN 130 -13.890 9.376 11.909 1036 1HB ASN 130 2HB ASN 130 -14.170 8.017 13.727 1037 2HB ASN 130 1HB ASN 130 -13.550 6.594 12.897 1038 1HD2 ASN 130 1HD2 ASN 130 -11.269 6.465 12.569 1039 2HD2 ASN 130 2HD2 ASN 130 -10.194 7.186 13.706 1040 H PHE 131 H PHE 131 -11.532 9.830 12.531 1041 HA PHE 131 HA PHE 131 -9.940 9.528 10.116 1042 1HB PHE 131 2HB PHE 131 -8.413 11.102 11.691 1043 2HB PHE 131 1HB PHE 131 -9.706 11.712 10.664 1044 HD1 PHE 131 1HD PHE 131 -8.752 10.856 14.108 1045 HD2 PHE 131 2HD PHE 131 -11.718 12.587 11.596 1046 HE1 PHE 131 1HE PHE 131 -9.875 11.795 16.086 1047 HE2 PHE 131 2HE PHE 131 -12.845 13.531 13.569 1048 HZ PHE 131 HZ PHE 131 -11.923 13.135 15.818 1049 H ASP 132 H ASP 132 -9.456 9.027 13.606 1050 HA ASP 132 HA ASP 132 -6.883 8.050 13.607 1051 1HB ASP 132 2HB ASP 132 -9.161 7.090 15.349 1052 2HB ASP 132 1HB ASP 132 -7.445 6.919 15.704 1053 H GLU 133 H GLU 133 -9.699 6.528 12.366 1054 HA GLU 133 HA GLU 133 -9.068 3.842 12.601 1055 1HB GLU 133 2HB GLU 133 -10.806 3.444 11.173 1056 2HB GLU 133 1HB GLU 133 -11.182 5.092 11.649 1057 1HG GLU 133 2HG GLU 133 -9.805 5.738 9.555 1058 2HG GLU 133 1HG GLU 133 -10.095 4.070 9.070 1059 H THR 134 H THR 134 -7.913 6.267 10.352 1060 HA THR 134 HA THR 134 -6.735 4.616 8.435 1061 HB THR 134 HB THR 134 -5.471 7.204 9.283 1062 HG1 THR 134 1HG THR 134 -7.513 7.900 9.083 1063 1HG2 THR 134 1HG2 THR 134 -5.975 6.511 6.459 1064 2HG2 THR 134 2HG2 THR 134 -4.821 5.482 7.307 1065 3HG2 THR 134 3HG2 THR 134 -4.549 7.221 7.216 1066 H TYR 135 H TYR 135 -5.502 5.791 11.531 1067 HA TYR 135 HA TYR 135 -2.882 4.748 11.209 1068 1HB TYR 135 2HB TYR 135 -3.312 6.489 12.847 1069 2HB TYR 135 1HB TYR 135 -4.432 5.440 13.711 1070 HD1 TYR 135 1HD TYR 135 -0.862 5.857 12.786 1071 HD2 TYR 135 2HD TYR 135 -3.658 3.945 15.362 1072 HE1 TYR 135 1HE TYR 135 0.990 5.030 14.174 1073 HE2 TYR 135 2HE TYR 135 -1.811 3.114 16.758 1074 HH TYR 135 HH TYR 135 0.673 2.604 16.411 1075 H LYS 136 H LYS 136 -5.849 3.503 12.671 1076 HA LYS 136 HA LYS 136 -4.813 1.188 13.834 1077 1HB LYS 136 2HB LYS 136 -7.085 1.954 14.261 1078 2HB LYS 136 1HB LYS 136 -7.528 1.652 12.587 1079 1HG LYS 136 2HG LYS 136 -6.896 -0.782 13.050 1080 2HG LYS 136 1HG LYS 136 -6.942 -0.330 14.755 1081 1HD LYS 136 2HD LYS 136 -9.283 0.689 14.040 1082 2HD LYS 136 1HD LYS 136 -9.155 -0.541 12.780 1083 1HE LYS 136 2HE LYS 136 -10.282 -1.631 14.502 1084 2HE LYS 136 1HE LYS 136 -8.610 -2.160 14.695 1085 1HZ LYS 136 1HZ LYS 136 -8.658 -1.387 16.754 1086 2HZ LYS 136 2HZ LYS 136 -10.244 -0.835 16.552 1087 3HZ LYS 136 3HZ LYS 136 -8.942 0.179 16.180 1088 H ILE 137 H ILE 137 -6.363 1.511 10.641 1089 HA ILE 137 HA ILE 137 -5.789 -1.115 9.794 1090 HB ILE 137 HB ILE 137 -6.046 1.090 7.800 1091 1HG1 ILE 137 2HG1 ILE 137 -7.645 1.504 9.748 1092 2HG1 ILE 137 1HG1 ILE 137 -8.366 1.379 8.149 1093 1HG2 ILE 137 1HG2 ILE 137 -6.538 -1.794 7.959 1094 2HG2 ILE 137 2HG2 ILE 137 -6.102 -0.787 6.579 1095 3HG2 ILE 137 3HG2 ILE 137 -7.782 -0.877 7.108 1096 1HD1 ILE 137 1HD1 ILE 137 -8.521 -0.496 10.454 1097 2HD1 ILE 137 2HD1 ILE 137 -8.700 -1.118 8.814 1098 3HD1 ILE 137 3HD1 ILE 137 -9.802 0.123 9.411 1099 H LEU 138 H LEU 138 -4.169 1.973 9.041 1100 HA LEU 138 HA LEU 138 -2.228 0.970 7.327 1101 1HB LEU 138 2HB LEU 138 -2.711 3.423 8.741 1102 2HB LEU 138 1HB LEU 138 -1.003 3.035 8.788 1103 HG LEU 138 HG LEU 138 -1.440 4.462 6.902 1104 1HD1 LEU 138 1HD1 LEU 138 0.183 3.291 5.947 1105 2HD1 LEU 138 2HD1 LEU 138 -1.068 2.371 5.112 1106 3HD1 LEU 138 3HD1 LEU 138 -0.412 1.781 6.638 1107 1HD2 LEU 138 1HD2 LEU 138 -3.024 2.647 5.302 1108 2HD2 LEU 138 2HD2 LEU 138 -3.270 4.360 5.643 1109 3HD2 LEU 138 3HD2 LEU 138 -3.875 3.142 6.766 1110 H SER 139 H SER 139 -1.937 1.541 10.832 1111 HA SER 139 HA SER 139 0.663 0.678 11.167 1112 1HB SER 139 2HB SER 139 -1.070 1.699 12.862 1113 2HB SER 139 1HB SER 139 -1.376 0.005 13.253 1114 HG SER 139 HG SER 139 0.245 0.608 14.589 1115 H LEU 140 H LEU 140 -2.287 -1.298 11.597 1116 HA LEU 140 HA LEU 140 -0.902 -3.719 12.021 1117 1HB LEU 140 2HB LEU 140 -3.504 -2.905 12.192 1118 2HB LEU 140 1HB LEU 140 -3.552 -3.950 10.786 1119 HG LEU 140 HG LEU 140 -2.534 -5.765 12.155 1120 1HD1 LEU 140 1HD1 LEU 140 -2.723 -5.442 14.657 1121 2HD1 LEU 140 2HD1 LEU 140 -2.840 -3.713 14.329 1122 3HD1 LEU 140 3HD1 LEU 140 -1.392 -4.604 13.859 1123 1HD2 LEU 140 1HD2 LEU 140 -4.552 -6.414 13.161 1124 2HD2 LEU 140 2HD2 LEU 140 -5.029 -5.385 11.811 1125 3HD2 LEU 140 3HD2 LEU 140 -5.041 -4.746 13.455 1126 H ALA 141 H ALA 141 -2.649 -2.618 9.114 1127 HA ALA 141 HA ALA 141 -2.042 -4.724 7.442 1128 1HB ALA 141 1HB ALA 141 -3.668 -3.054 6.837 1129 2HB ALA 141 2HB ALA 141 -2.443 -3.167 5.574 1130 3HB ALA 141 3HB ALA 141 -2.411 -1.824 6.716 1131 H CYS 142 H CYS 142 -0.173 -1.704 7.827 1132 HA CYS 142 HA CYS 142 1.799 -2.283 5.932 1133 1HB CYS 142 2HB CYS 142 1.485 -0.387 8.148 1134 2HB CYS 142 1HB CYS 142 3.159 -0.809 7.800 1135 HG CYS 142 HG CYS 142 1.637 1.537 6.442 1136 H LYS 143 H LYS 143 1.673 -3.014 9.410 1137 HA LYS 143 HA LYS 143 4.247 -4.104 9.645 1138 1HB LYS 143 2HB LYS 143 1.700 -4.465 11.190 1139 2HB LYS 143 1HB LYS 143 3.114 -5.435 11.575 1140 1HG LYS 143 2HG LYS 143 4.401 -3.426 12.015 1141 2HG LYS 143 1HG LYS 143 3.017 -2.425 11.571 1142 1HD LYS 143 2HD LYS 143 1.739 -3.305 13.427 1143 2HD LYS 143 1HD LYS 143 3.044 -4.422 13.833 1144 1HE LYS 143 2HE LYS 143 3.228 -1.412 13.891 1145 2HE LYS 143 1HE LYS 143 3.014 -2.449 15.300 1146 1HZ LYS 143 1HZ LYS 143 5.147 -3.498 14.777 1147 2HZ LYS 143 2HZ LYS 143 5.319 -1.838 15.053 1148 3HZ LYS 143 3HZ LYS 143 5.356 -2.440 13.473 1149 H ASN 144 H ASN 144 1.152 -5.853 9.372 1150 HA ASN 144 HA ASN 144 2.211 -8.398 9.015 1151 1HB ASN 144 2HB ASN 144 -0.380 -7.105 8.643 1152 2HB ASN 144 1HB ASN 144 -0.108 -8.413 7.495 1153 1HD2 ASN 144 1HD2 ASN 144 -0.777 -7.566 10.736 1154 2HD2 ASN 144 2HD2 ASN 144 -0.895 -9.169 11.371 1155 H LEU 145 H LEU 145 1.641 -5.820 6.701 1156 HA LEU 145 HA LEU 145 2.041 -7.297 4.341 1157 1HB LEU 145 2HB LEU 145 1.366 -4.719 4.905 1158 2HB LEU 145 1HB LEU 145 3.012 -4.516 4.339 1159 HG LEU 145 HG LEU 145 0.705 -5.720 2.811 1160 1HD1 LEU 145 1HD1 LEU 145 0.867 -3.835 1.403 1161 2HD1 LEU 145 2HD1 LEU 145 2.396 -3.333 2.125 1162 3HD1 LEU 145 3HD1 LEU 145 0.901 -3.211 3.053 1163 1HD2 LEU 145 1HD2 LEU 145 2.136 -6.283 1.064 1164 2HD2 LEU 145 2HD2 LEU 145 3.018 -6.813 2.497 1165 3HD2 LEU 145 3HD2 LEU 145 3.456 -5.303 1.699 1166 H LEU 146 H LEU 146 4.284 -5.445 6.373 1167 HA LEU 146 HA LEU 146 6.587 -5.746 4.848 1168 1HB LEU 146 2HB LEU 146 6.100 -5.425 7.788 1169 2HB LEU 146 1HB LEU 146 7.729 -5.669 7.187 1170 HG LEU 146 HG LEU 146 5.973 -3.454 6.157 1171 1HD1 LEU 146 1HD1 LEU 146 6.412 -2.121 7.903 1172 2HD1 LEU 146 2HD1 LEU 146 8.048 -2.751 8.102 1173 3HD1 LEU 146 3HD1 LEU 146 6.676 -3.630 8.776 1174 1HD2 LEU 146 1HD2 LEU 146 7.691 -3.302 4.740 1175 2HD2 LEU 146 2HD2 LEU 146 8.694 -4.387 5.702 1176 3HD2 LEU 146 3HD2 LEU 146 8.609 -2.672 6.107 1177 H VAL 147 H VAL 147 5.199 -7.876 7.308 1178 HA VAL 147 HA VAL 147 7.262 -9.767 7.410 1179 HB VAL 147 HB VAL 147 4.332 -10.382 7.775 1180 1HG1 VAL 147 1HG1 VAL 147 5.698 -11.764 9.672 1181 2HG1 VAL 147 2HG1 VAL 147 6.856 -11.770 8.341 1182 3HG1 VAL 147 3HG1 VAL 147 5.233 -12.416 8.100 1183 1HG2 VAL 147 1HG2 VAL 147 4.434 -8.664 9.251 1184 2HG2 VAL 147 2HG2 VAL 147 6.187 -8.760 9.413 1185 3HG2 VAL 147 3HG2 VAL 147 5.159 -9.905 10.274 1186 H PHE 148 H PHE 148 4.183 -9.973 5.615 1187 HA PHE 148 HA PHE 148 4.836 -12.336 4.233 1188 1HB PHE 148 2HB PHE 148 2.559 -10.991 4.569 1189 2HB PHE 148 1HB PHE 148 2.984 -10.371 2.977 1190 HD1 PHE 148 1HD PHE 148 2.770 -11.712 1.040 1191 HD2 PHE 148 2HD PHE 148 2.217 -13.422 4.897 1192 HE1 PHE 148 1HE PHE 148 1.841 -13.740 0.002 1193 HE2 PHE 148 2HE PHE 148 1.288 -15.454 3.867 1194 HZ PHE 148 HZ PHE 148 1.099 -15.615 1.417 1195 H LEU 149 H LEU 149 4.793 -8.974 3.058 1196 HA LEU 149 HA LEU 149 5.737 -9.398 0.509 1197 1HB LEU 149 2HB LEU 149 5.392 -7.196 0.472 1198 2HB LEU 149 1HB LEU 149 5.292 -7.178 2.220 1199 HG LEU 149 HG LEU 149 7.893 -7.058 2.121 1200 1HD1 LEU 149 1HD1 LEU 149 7.375 -7.197 -0.589 1201 2HD1 LEU 149 2HD1 LEU 149 8.889 -6.694 0.164 1202 3HD1 LEU 149 3HD1 LEU 149 7.694 -5.485 -0.307 1203 1HD2 LEU 149 1HD2 LEU 149 7.776 -4.705 2.272 1204 2HD2 LEU 149 2HD2 LEU 149 6.230 -5.307 2.871 1205 3HD2 LEU 149 3HD2 LEU 149 6.345 -4.635 1.244 1206 H SER 150 H SER 150 7.680 -8.799 3.448 1207 HA SER 150 HA SER 150 9.758 -10.516 2.720 1208 1HB SER 150 2HB SER 150 10.084 -8.750 0.935 1209 2HB SER 150 1HB SER 150 10.523 -7.633 2.228 1210 HG SER 150 HG SER 150 12.443 -8.447 2.018 1211 H LYS 151 H LYS 151 9.617 -11.027 4.906 1212 HA LYS 151 HA LYS 151 11.415 -9.793 6.633 1213 1HB LYS 151 2HB LYS 151 9.540 -8.036 6.570 1214 2HB LYS 151 1HB LYS 151 8.600 -9.186 7.509 1215 1HG LYS 151 2HG LYS 151 10.259 -9.140 9.275 1216 2HG LYS 151 1HG LYS 151 11.266 -8.046 8.324 1217 1HD LYS 151 2HD LYS 151 9.910 -6.248 8.704 1218 2HD LYS 151 1HD LYS 151 8.456 -7.238 8.845 1219 1HE LYS 151 2HE LYS 151 8.904 -7.802 11.057 1220 2HE LYS 151 1HE LYS 151 10.612 -7.390 10.916 1221 1HZ LYS 151 1HZ LYS 151 8.399 -5.731 11.638 1222 2HZ LYS 151 2HZ LYS 151 9.314 -5.050 10.390 1223 3HZ LYS 151 3HZ LYS 151 10.056 -5.467 11.850 1224 H HIS 152 H HIS 152 8.869 -11.958 5.971 1225 HA HIS 152 HA HIS 152 8.503 -13.210 8.435 1226 1HB HIS 152 2HB HIS 152 7.977 -15.277 6.951 1227 2HB HIS 152 1HB HIS 152 6.949 -13.856 6.842 1228 HD1 HIS 152 1HD HIS 152 6.444 -15.224 4.487 1229 HD2 HIS 152 2HD HIS 152 10.035 -13.153 4.781 1230 HE1 HIS 152 1HE HIS 152 7.247 -14.932 2.124 1231 HE2 HIS 152 2HE HIS 152 9.386 -13.615 2.321 1232 H HIS 153 H HIS 153 10.028 -15.202 5.976 1233 HA HIS 153 HA HIS 153 11.807 -16.606 6.041 1234 1HB HIS 153 2HB HIS 153 12.771 -14.155 7.408 1235 2HB HIS 153 1HB HIS 153 13.749 -15.605 7.608 1236 HD1 HIS 153 1HD HIS 153 13.686 -12.767 5.594 1237 HD2 HIS 153 2HD HIS 153 14.045 -16.821 4.755 1238 HE1 HIS 153 1HE HIS 153 14.747 -12.890 3.317 1239 HE2 HIS 153 2HE HIS 153 15.042 -15.353 2.873 1240 H HIS 154 H HIS 154 9.701 -17.118 7.866 1241 HA HIS 154 HA HIS 154 11.144 -18.779 9.760 1242 1HB HIS 154 2HB HIS 154 10.624 -16.533 10.870 1243 2HB HIS 154 1HB HIS 154 8.931 -17.008 10.790 1244 HD1 HIS 154 1HD HIS 154 8.838 -17.020 13.397 1245 HD2 HIS 154 2HD HIS 154 11.477 -19.776 11.750 1246 HE1 HIS 154 1HE HIS 154 9.414 -18.601 15.267 1247 HE2 HIS 154 2HE HIS 154 11.035 -20.243 14.256 1248 H HIS 155 H HIS 155 8.551 -18.159 7.708 1249 HA HIS 155 HA HIS 155 6.532 -19.803 8.749 1250 1HB HIS 155 2HB HIS 155 6.930 -18.278 6.421 1251 2HB HIS 155 1HB HIS 155 6.599 -19.915 5.865 1252 HD1 HIS 155 1HD HIS 155 4.989 -16.934 7.301 1253 HD2 HIS 155 2HD HIS 155 4.032 -20.929 6.676 1254 HE1 HIS 155 1HE HIS 155 2.494 -17.079 7.581 1255 HE2 HIS 155 2HE HIS 155 1.933 -19.501 7.174 1256 H HIS 156 H HIS 156 6.572 -21.901 9.149 1257 HA HIS 156 HA HIS 156 7.031 -24.122 9.044 1258 1HB HIS 156 2HB HIS 156 6.608 -23.293 6.377 1259 2HB HIS 156 1HB HIS 156 8.001 -24.370 6.346 1260 HD1 HIS 156 1HD HIS 156 5.242 -25.115 5.098 1261 HD2 HIS 156 2HD HIS 156 6.531 -26.248 8.883 1262 HE1 HIS 156 1HE HIS 156 3.922 -27.177 5.669 1263 HE2 HIS 156 2HE HIS 156 4.655 -27.793 7.999 Start of MODEL 9 1 1H MET 1 1HT MET 1 16.216 -8.876 -7.373 2 2H MET 1 2HT MET 1 17.498 -8.049 -8.104 3 3H MET 1 3HT MET 1 16.522 -9.080 -9.024 4 HA MET 1 HA MET 1 15.989 -6.379 -8.049 5 1HB MET 1 2HB MET 1 14.954 -7.729 -10.527 6 2HB MET 1 1HB MET 1 15.277 -6.022 -10.259 7 1HG MET 1 2HG MET 1 17.362 -6.209 -10.988 8 2HG MET 1 1HG MET 1 17.670 -7.614 -9.968 9 1HE MET 1 1HE MET 1 15.108 -6.845 -12.641 10 2HE MET 1 2HE MET 1 15.425 -7.986 -13.946 11 3HE MET 1 3HE MET 1 16.448 -6.562 -13.753 12 H LYS 2 H LYS 2 14.569 -6.632 -6.330 13 HA LYS 2 HA LYS 2 12.065 -8.073 -6.857 14 1HB LYS 2 2HB LYS 2 13.512 -7.270 -4.362 15 2HB LYS 2 1HB LYS 2 11.773 -7.516 -4.303 16 1HG LYS 2 2HG LYS 2 12.585 -9.583 -3.698 17 2HG LYS 2 1HG LYS 2 12.301 -9.788 -5.427 18 1HD LYS 2 2HD LYS 2 14.636 -9.460 -5.904 19 2HD LYS 2 1HD LYS 2 14.964 -9.051 -4.219 20 1HE LYS 2 2HE LYS 2 13.746 -11.692 -4.906 21 2HE LYS 2 1HE LYS 2 15.481 -11.447 -5.099 22 1HZ LYS 2 1HZ LYS 2 13.881 -11.303 -2.615 23 2HZ LYS 2 2HZ LYS 2 15.433 -10.640 -2.715 24 3HZ LYS 2 3HZ LYS 2 15.208 -12.299 -2.954 25 H LYS 3 H LYS 3 10.306 -6.954 -7.384 26 HA LYS 3 HA LYS 3 10.157 -4.124 -6.576 27 1HB LYS 3 2HB LYS 3 9.813 -5.382 -9.219 28 2HB LYS 3 1HB LYS 3 8.576 -4.212 -8.787 29 1HG LYS 3 2HG LYS 3 11.207 -3.200 -8.183 30 2HG LYS 3 1HG LYS 3 11.076 -3.684 -9.875 31 1HD LYS 3 2HD LYS 3 8.699 -2.292 -9.111 32 2HD LYS 3 1HD LYS 3 10.104 -1.329 -8.650 33 1HE LYS 3 2HE LYS 3 10.967 -1.452 -10.910 34 2HE LYS 3 1HE LYS 3 9.636 -2.504 -11.387 35 1HZ LYS 3 1HZ LYS 3 9.676 0.206 -11.593 36 2HZ LYS 3 2HZ LYS 3 8.743 -0.052 -10.205 37 3HZ LYS 3 3HZ LYS 3 8.295 -0.768 -11.671 38 H ILE 4 H ILE 4 8.435 -3.557 -5.450 39 HA ILE 4 HA ILE 4 6.142 -5.406 -5.355 40 HB ILE 4 HB ILE 4 7.363 -3.637 -3.253 41 1HG1 ILE 4 2HG1 ILE 4 6.977 -5.792 -1.922 42 2HG1 ILE 4 1HG1 ILE 4 6.625 -6.552 -3.471 43 1HG2 ILE 4 1HG2 ILE 4 5.322 -4.324 -1.856 44 2HG2 ILE 4 2HG2 ILE 4 4.533 -4.610 -3.407 45 3HG2 ILE 4 3HG2 ILE 4 5.135 -3.001 -3.008 46 1HD1 ILE 4 1HD1 ILE 4 8.779 -6.777 -3.921 47 2HD1 ILE 4 2HD1 ILE 4 9.109 -6.250 -2.270 48 3HD1 ILE 4 3HD1 ILE 4 9.093 -5.076 -3.586 49 H LEU 5 H LEU 5 4.197 -4.648 -5.989 50 HA LEU 5 HA LEU 5 4.003 -1.764 -6.528 51 1HB LEU 5 2HB LEU 5 3.505 -3.978 -8.184 52 2HB LEU 5 1HB LEU 5 1.937 -3.285 -7.814 53 HG LEU 5 HG LEU 5 4.251 -1.687 -8.906 54 1HD1 LEU 5 1HD1 LEU 5 3.590 -3.381 -10.521 55 2HD1 LEU 5 2HD1 LEU 5 3.091 -1.775 -11.054 56 3HD1 LEU 5 3HD1 LEU 5 1.905 -2.885 -10.368 57 1HD2 LEU 5 1HD2 LEU 5 1.649 -0.646 -9.460 58 2HD2 LEU 5 2HD2 LEU 5 2.970 0.091 -8.556 59 3HD2 LEU 5 3HD2 LEU 5 1.803 -0.939 -7.728 60 H PHE 6 H PHE 6 2.911 -0.739 -5.004 61 HA PHE 6 HA PHE 6 0.752 -2.083 -3.569 62 1HB PHE 6 2HB PHE 6 2.091 0.598 -3.141 63 2HB PHE 6 1HB PHE 6 0.777 -0.019 -2.149 64 HD1 PHE 6 1HD PHE 6 4.155 0.458 -2.193 65 HD2 PHE 6 2HD PHE 6 1.319 -2.602 -1.352 66 HE1 PHE 6 1HE PHE 6 5.789 -0.650 -0.731 67 HE2 PHE 6 2HE PHE 6 2.949 -3.713 0.112 68 HZ PHE 6 HZ PHE 6 5.187 -2.738 0.423 69 H ILE 7 H ILE 7 -1.183 -2.012 -4.566 70 HA ILE 7 HA ILE 7 -1.881 0.364 -6.137 71 HB ILE 7 HB ILE 7 -3.424 -2.223 -5.988 72 1HG1 ILE 7 2HG1 ILE 7 -2.011 -1.929 -8.455 73 2HG1 ILE 7 1HG1 ILE 7 -0.858 -1.775 -7.134 74 1HG2 ILE 7 1HG2 ILE 7 -4.321 -1.455 -8.159 75 2HG2 ILE 7 2HG2 ILE 7 -3.425 0.052 -7.967 76 3HG2 ILE 7 3HG2 ILE 7 -4.708 -0.361 -6.830 77 1HD1 ILE 7 1HD1 ILE 7 -1.041 -3.937 -6.551 78 2HD1 ILE 7 2HD1 ILE 7 -1.588 -4.114 -8.219 79 3HD1 ILE 7 3HD1 ILE 7 -2.766 -4.001 -6.911 80 H CYS 8 H CYS 8 -3.223 1.845 -5.368 81 HA CYS 8 HA CYS 8 -5.180 1.075 -3.320 82 1HB CYS 8 2HB CYS 8 -3.197 2.218 -2.297 83 2HB CYS 8 1HB CYS 8 -3.588 3.641 -3.258 84 HG CYS 8 HG CYS 8 -6.354 3.035 -1.833 85 H LEU 9 H LEU 9 -7.187 1.681 -3.780 86 HA LEU 9 HA LEU 9 -7.917 2.894 -6.175 87 1HB LEU 9 2HB LEU 9 -9.305 1.512 -4.460 88 2HB LEU 9 1HB LEU 9 -9.646 3.066 -3.728 89 HG LEU 9 HG LEU 9 -11.331 2.052 -5.418 90 1HD1 LEU 9 1HD1 LEU 9 -10.512 4.766 -4.848 91 2HD1 LEU 9 2HD1 LEU 9 -12.130 4.077 -4.992 92 3HD1 LEU 9 3HD1 LEU 9 -11.275 4.628 -6.433 93 1HD2 LEU 9 1HD2 LEU 9 -10.957 2.654 -7.736 94 2HD2 LEU 9 2HD2 LEU 9 -9.677 1.578 -7.175 95 3HD2 LEU 9 3HD2 LEU 9 -9.368 3.307 -7.333 96 H GLY 10 H GLY 10 -6.866 4.264 -3.217 97 1HA GLY 10 2HA GLY 10 -7.207 6.949 -4.352 98 2HA GLY 10 1HA GLY 10 -7.802 6.640 -2.726 99 H ASN 11 H ASN 11 -5.032 7.225 -4.696 100 HA ASN 11 HA ASN 11 -3.099 6.584 -2.674 101 1HB ASN 11 2HB ASN 11 -2.953 7.906 -5.365 102 2HB ASN 11 1HB ASN 11 -1.563 7.914 -4.285 103 1HD2 ASN 11 1HD2 ASN 11 -0.168 6.432 -4.877 104 2HD2 ASN 11 2HD2 ASN 11 -0.542 4.830 -5.403 105 H ILE 12 H ILE 12 -5.138 8.395 -1.808 106 HA ILE 12 HA ILE 12 -3.455 10.706 -1.116 107 HB ILE 12 HB ILE 12 -5.766 11.902 -0.877 108 1HG1 ILE 12 2HG1 ILE 12 -6.398 9.890 -3.045 109 2HG1 ILE 12 1HG1 ILE 12 -7.034 9.800 -1.405 110 1HG2 ILE 12 1HG2 ILE 12 -5.078 13.093 -2.638 111 2HG2 ILE 12 2HG2 ILE 12 -5.197 11.712 -3.729 112 3HG2 ILE 12 3HG2 ILE 12 -3.753 11.935 -2.742 113 1HD1 ILE 12 1HD1 ILE 12 -8.416 10.884 -3.339 114 2HD1 ILE 12 2HD1 ILE 12 -7.437 12.300 -2.954 115 3HD1 ILE 12 3HD1 ILE 12 -8.447 11.560 -1.712 116 H CYS 13 H CYS 13 -4.764 7.988 0.052 117 HA CYS 13 HA CYS 13 -5.137 9.166 2.714 118 1HB CYS 13 2HB CYS 13 -7.335 8.567 1.694 119 2HB CYS 13 1HB CYS 13 -6.803 6.892 1.623 120 HG CYS 13 HG CYS 13 -8.164 6.547 3.813 121 H ARG 14 H ARG 14 -5.315 5.792 1.601 122 HA ARG 14 HA ARG 14 -3.539 4.992 3.709 123 1HB ARG 14 2HB ARG 14 -4.768 3.145 3.512 124 2HB ARG 14 1HB ARG 14 -5.480 3.735 2.020 125 1HG ARG 14 2HG ARG 14 -4.569 1.781 1.290 126 2HG ARG 14 1HG ARG 14 -3.219 2.873 0.984 127 1HD ARG 14 2HD ARG 14 -2.232 2.226 3.142 128 2HD ARG 14 1HD ARG 14 -3.569 1.106 3.405 129 HE ARG 14 HE ARG 14 -2.047 0.717 0.967 130 1HH1 ARG 14 1HH1 ARG 14 -2.534 -0.191 4.295 131 2HH1 ARG 14 2HH1 ARG 14 -1.734 -1.718 4.130 132 1HH2 ARG 14 1HH2 ARG 14 -0.994 -1.292 0.740 133 2HH2 ARG 14 2HH2 ARG 14 -0.857 -2.343 2.110 134 H SER 15 H SER 15 -3.358 5.028 0.163 135 HA SER 15 HA SER 15 -0.888 3.802 -0.134 136 1HB SER 15 2HB SER 15 -1.743 4.044 -2.203 137 2HB SER 15 1HB SER 15 -2.599 5.528 -1.782 138 HG SER 15 HG SER 15 -0.048 5.174 -2.822 139 HA PRO 16 HA PRO 16 1.227 8.174 0.063 140 1HB PRO 16 2HB PRO 16 -0.090 10.117 1.420 141 2HB PRO 16 1HB PRO 16 -0.259 9.876 -0.323 142 1HG PRO 16 2HG PRO 16 -2.043 8.938 1.897 143 2HG PRO 16 1HG PRO 16 -2.483 9.713 0.362 144 1HD PRO 16 2HD PRO 16 -2.666 7.055 0.703 145 2HD PRO 16 1HD PRO 16 -2.184 7.764 -0.853 146 H MET 17 H MET 17 -0.913 7.576 2.858 147 HA MET 17 HA MET 17 0.831 8.414 4.858 148 1HB MET 17 2HB MET 17 -1.682 7.214 4.749 149 2HB MET 17 1HB MET 17 -0.696 6.069 5.646 150 1HG MET 17 2HG MET 17 -0.937 8.989 6.322 151 2HG MET 17 1HG MET 17 -1.902 7.711 7.057 152 1HE MET 17 1HE MET 17 -1.591 7.450 9.165 153 2HE MET 17 2HE MET 17 -0.113 7.314 10.118 154 3HE MET 17 3HE MET 17 -0.656 5.956 9.133 155 H ALA 18 H ALA 18 0.349 5.127 3.577 156 HA ALA 18 HA ALA 18 2.541 4.041 5.061 157 1HB ALA 18 1HB ALA 18 1.772 2.054 4.390 158 2HB ALA 18 2HB ALA 18 1.703 2.541 2.697 159 3HB ALA 18 3HB ALA 18 0.383 2.958 3.789 160 H GLU 19 H GLU 19 2.241 5.759 2.106 161 HA GLU 19 HA GLU 19 4.445 4.721 0.693 162 1HB GLU 19 2HB GLU 19 2.735 6.208 -0.311 163 2HB GLU 19 1HB GLU 19 3.366 7.546 0.637 164 1HG GLU 19 2HG GLU 19 5.381 7.588 -0.567 165 2HG GLU 19 1HG GLU 19 5.080 6.006 -1.281 166 H PHE 20 H PHE 20 4.187 7.524 2.871 167 HA PHE 20 HA PHE 20 6.998 8.040 2.809 168 1HB PHE 20 2HB PHE 20 5.644 9.930 3.219 169 2HB PHE 20 1HB PHE 20 4.723 9.114 4.482 170 HD1 PHE 20 1HD PHE 20 5.395 9.232 6.728 171 HD2 PHE 20 2HD PHE 20 8.040 10.537 3.660 172 HE1 PHE 20 1HE PHE 20 6.882 10.206 8.430 173 HE2 PHE 20 2HE PHE 20 9.533 11.511 5.356 174 HZ PHE 20 HZ PHE 20 8.954 11.345 7.744 175 H ILE 21 H ILE 21 4.799 6.476 5.131 176 HA ILE 21 HA ILE 21 6.661 6.039 7.173 177 HB ILE 21 HB ILE 21 4.279 4.357 6.396 178 1HG1 ILE 21 2HG1 ILE 21 4.655 6.547 8.450 179 2HG1 ILE 21 1HG1 ILE 21 3.678 6.637 6.988 180 1HG2 ILE 21 1HG2 ILE 21 4.983 4.189 9.170 181 2HG2 ILE 21 2HG2 ILE 21 6.360 3.722 8.173 182 3HG2 ILE 21 3HG2 ILE 21 4.814 2.896 7.982 183 1HD1 ILE 21 1HD1 ILE 21 2.083 6.258 8.582 184 2HD1 ILE 21 2HD1 ILE 21 3.135 5.224 9.549 185 3HD1 ILE 21 3HD1 ILE 21 2.427 4.611 8.054 186 H MET 22 H MET 22 5.631 3.776 4.613 187 HA MET 22 HA MET 22 7.454 1.749 5.208 188 1HB MET 22 2HB MET 22 5.855 2.498 2.816 189 2HB MET 22 1HB MET 22 7.181 1.368 2.577 190 1HG MET 22 2HG MET 22 5.969 0.327 4.772 191 2HG MET 22 1HG MET 22 4.596 0.990 3.889 192 1HE MET 22 1HE MET 22 7.169 -2.582 3.019 193 2HE MET 22 2HE MET 22 7.513 -1.224 4.090 194 3HE MET 22 3HE MET 22 7.963 -1.139 2.387 195 H LYS 23 H LYS 23 7.740 4.544 3.057 196 HA LYS 23 HA LYS 23 10.163 4.015 1.848 197 1HB LYS 23 2HB LYS 23 8.556 6.378 2.405 198 2HB LYS 23 1HB LYS 23 10.276 6.737 2.412 199 1HG LYS 23 2HG LYS 23 9.432 5.077 0.164 200 2HG LYS 23 1HG LYS 23 8.684 6.676 0.204 201 1HD LYS 23 2HD LYS 23 11.106 7.508 0.647 202 2HD LYS 23 1HD LYS 23 11.577 5.940 -0.011 203 1HE LYS 23 2HE LYS 23 10.022 6.533 -1.972 204 2HE LYS 23 1HE LYS 23 10.104 8.182 -1.353 205 1HZ LYS 23 1HZ LYS 23 12.692 7.017 -1.539 206 2HZ LYS 23 2HZ LYS 23 12.108 8.444 -2.234 207 3HZ LYS 23 3HZ LYS 23 11.902 6.968 -3.035 208 H ASP 24 H ASP 24 9.516 5.265 5.076 209 HA ASP 24 HA ASP 24 12.234 5.844 5.708 210 1HB ASP 24 2HB ASP 24 9.857 5.350 7.513 211 2HB ASP 24 1HB ASP 24 11.418 5.960 8.054 212 H LEU 25 H LEU 25 10.089 3.123 6.504 213 HA LEU 25 HA LEU 25 12.022 1.640 7.937 214 1HB LEU 25 2HB LEU 25 9.371 1.046 6.710 215 2HB LEU 25 1HB LEU 25 10.380 -0.297 7.216 216 HG LEU 25 HG LEU 25 9.870 1.903 9.163 217 1HD1 LEU 25 1HD1 LEU 25 7.891 -0.258 8.457 218 2HD1 LEU 25 2HD1 LEU 25 7.659 1.485 8.303 219 3HD1 LEU 25 3HD1 LEU 25 7.813 0.751 9.900 220 1HD2 LEU 25 1HD2 LEU 25 11.161 -0.563 9.207 221 2HD2 LEU 25 2HD2 LEU 25 9.650 -0.826 10.078 222 3HD2 LEU 25 3HD2 LEU 25 10.754 0.450 10.593 223 H VAL 26 H VAL 26 11.478 2.073 4.568 224 HA VAL 26 HA VAL 26 12.414 -0.309 3.496 225 HB VAL 26 HB VAL 26 12.416 2.515 2.499 226 1HG1 VAL 26 1HG1 VAL 26 14.408 1.816 1.487 227 2HG1 VAL 26 2HG1 VAL 26 13.170 1.518 0.268 228 3HG1 VAL 26 3HG1 VAL 26 13.805 0.181 1.224 229 1HG2 VAL 26 1HG2 VAL 26 11.014 1.326 0.706 230 2HG2 VAL 26 2HG2 VAL 26 10.316 1.517 2.316 231 3HG2 VAL 26 3HG2 VAL 26 10.993 -0.037 1.826 232 H LYS 27 H LYS 27 14.312 2.647 4.130 233 HA LYS 27 HA LYS 27 16.793 1.707 3.378 234 1HB LYS 27 2HB LYS 27 15.758 3.914 4.929 235 2HB LYS 27 1HB LYS 27 17.270 3.331 5.610 236 1HG LYS 27 2HG LYS 27 18.477 4.177 3.938 237 2HG LYS 27 1HG LYS 27 17.348 3.599 2.711 238 1HD LYS 27 2HD LYS 27 16.627 5.932 4.441 239 2HD LYS 27 1HD LYS 27 17.682 6.156 3.045 240 1HE LYS 27 2HE LYS 27 15.860 4.899 1.735 241 2HE LYS 27 1HE LYS 27 14.828 5.239 3.123 242 1HZ LYS 27 1HZ LYS 27 15.895 7.058 1.111 243 2HZ LYS 27 2HZ LYS 27 15.792 7.653 2.689 244 3HZ LYS 27 3HZ LYS 27 14.404 7.082 1.910 245 H LYS 28 H LYS 28 14.998 0.988 6.280 246 HA LYS 28 HA LYS 28 17.157 0.094 7.863 247 1HB LYS 28 2HB LYS 28 15.035 0.667 8.862 248 2HB LYS 28 1HB LYS 28 14.225 -0.610 7.966 249 1HG LYS 28 2HG LYS 28 16.337 -1.817 9.393 250 2HG LYS 28 1HG LYS 28 15.500 -0.736 10.508 251 1HD LYS 28 2HD LYS 28 13.596 -1.963 10.478 252 2HD LYS 28 1HD LYS 28 13.783 -2.404 8.779 253 1HE LYS 28 2HE LYS 28 14.009 -4.248 10.566 254 2HE LYS 28 1HE LYS 28 15.200 -4.181 9.266 255 1HZ LYS 28 1HZ LYS 28 15.590 -3.012 11.968 256 2HZ LYS 28 2HZ LYS 28 16.741 -3.098 10.732 257 3HZ LYS 28 3HZ LYS 28 16.193 -4.516 11.475 258 H ALA 29 H ALA 29 14.769 -1.838 5.997 259 HA ALA 29 HA ALA 29 16.801 -3.967 5.876 260 1HB ALA 29 1HB ALA 29 15.549 -5.376 7.029 261 2HB ALA 29 2HB ALA 29 14.187 -5.119 5.940 262 3HB ALA 29 3HB ALA 29 14.410 -4.065 7.336 263 H ASN 30 H ASN 30 15.914 -1.974 3.825 264 HA ASN 30 HA ASN 30 15.230 -3.949 1.765 265 1HB ASN 30 2HB ASN 30 13.829 -1.354 2.316 266 2HB ASN 30 1HB ASN 30 13.873 -2.007 0.681 267 1HD2 ASN 30 1HD2 ASN 30 13.164 -3.011 4.007 268 2HD2 ASN 30 2HD2 ASN 30 11.817 -4.013 3.599 269 H LEU 31 H LEU 31 16.158 -0.520 2.163 270 HA LEU 31 HA LEU 31 17.389 -0.259 -0.339 271 1HB LEU 31 2HB LEU 31 16.731 1.573 1.300 272 2HB LEU 31 1HB LEU 31 18.221 1.221 2.151 273 HG LEU 31 HG LEU 31 18.079 3.174 0.391 274 1HD1 LEU 31 1HD1 LEU 31 20.167 3.196 1.135 275 2HD1 LEU 31 2HD1 LEU 31 20.575 2.160 -0.233 276 3HD1 LEU 31 3HD1 LEU 31 20.194 1.444 1.333 277 1HD2 LEU 31 1HD2 LEU 31 17.298 1.684 -1.436 278 2HD2 LEU 31 2HD2 LEU 31 18.854 0.857 -1.376 279 3HD2 LEU 31 3HD2 LEU 31 18.778 2.561 -1.823 280 H GLU 32 H GLU 32 18.415 -1.864 2.500 281 HA GLU 32 HA GLU 32 21.229 -1.751 2.034 282 1HB GLU 32 2HB GLU 32 19.741 -3.861 3.596 283 2HB GLU 32 1HB GLU 32 21.419 -3.369 3.787 284 1HG GLU 32 2HG GLU 32 19.516 -1.185 4.138 285 2HG GLU 32 1HG GLU 32 19.313 -2.499 5.297 286 H LYS 33 H LYS 33 18.669 -4.078 1.295 287 HA LYS 33 HA LYS 33 20.571 -5.712 -0.216 288 1HB LYS 33 2HB LYS 33 18.229 -6.282 1.324 289 2HB LYS 33 1HB LYS 33 17.952 -6.805 -0.332 290 1HG LYS 33 2HG LYS 33 20.381 -7.570 1.268 291 2HG LYS 33 1HG LYS 33 18.910 -8.542 1.187 292 1HD LYS 33 2HD LYS 33 19.464 -9.368 -0.811 293 2HD LYS 33 1HD LYS 33 19.838 -7.765 -1.447 294 1HE LYS 33 2HE LYS 33 21.695 -9.328 0.336 295 2HE LYS 33 1HE LYS 33 21.757 -9.390 -1.425 296 1HZ LYS 33 1HZ LYS 33 21.729 -6.702 -0.600 297 2HZ LYS 33 2HZ LYS 33 22.945 -7.538 -1.427 298 3HZ LYS 33 3HZ LYS 33 22.935 -7.514 0.264 299 H GLU 34 H GLU 34 19.161 -3.031 -0.904 300 HA GLU 34 HA GLU 34 18.429 -1.972 -2.771 301 1HB GLU 34 2HB GLU 34 19.278 -4.464 -4.249 302 2HB GLU 34 1HB GLU 34 19.073 -2.853 -4.924 303 1HG GLU 34 2HG GLU 34 21.033 -2.078 -4.032 304 2HG GLU 34 1HG GLU 34 21.018 -3.242 -2.708 305 H PHE 35 H PHE 35 16.304 -2.558 -1.598 306 HA PHE 35 HA PHE 35 14.632 -4.293 -3.278 307 1HB PHE 35 2HB PHE 35 14.589 -3.504 -0.436 308 2HB PHE 35 1HB PHE 35 13.011 -3.555 -1.215 309 HD1 PHE 35 1HD PHE 35 16.082 -5.589 -0.705 310 HD2 PHE 35 2HD PHE 35 11.889 -5.566 -1.424 311 HE1 PHE 35 1HE PHE 35 16.025 -8.033 -0.423 312 HE2 PHE 35 2HE PHE 35 11.823 -8.009 -1.142 313 HZ PHE 35 HZ PHE 35 13.893 -9.246 -0.641 314 H PHE 36 H PHE 36 13.062 -3.478 -4.545 315 HA PHE 36 HA PHE 36 12.688 -0.563 -4.498 316 1HB PHE 36 2HB PHE 36 12.676 -2.608 -6.669 317 2HB PHE 36 1HB PHE 36 11.684 -1.170 -6.873 318 HD1 PHE 36 1HD PHE 36 12.722 0.188 -8.416 319 HD2 PHE 36 2HD PHE 36 15.064 -1.645 -5.370 320 HE1 PHE 36 1HE PHE 36 14.698 1.438 -9.185 321 HE2 PHE 36 2HE PHE 36 17.041 -0.398 -6.132 322 HZ PHE 36 HZ PHE 36 16.860 1.147 -8.041 323 H ILE 37 H ILE 37 10.745 0.337 -4.209 324 HA ILE 37 HA ILE 37 8.377 -1.412 -4.154 325 HB ILE 37 HB ILE 37 7.553 0.158 -2.280 326 1HG1 ILE 37 2HG1 ILE 37 10.149 0.467 -1.115 327 2HG1 ILE 37 1HG1 ILE 37 10.157 1.219 -2.708 328 1HG2 ILE 37 1HG2 ILE 37 9.559 -2.042 -2.009 329 2HG2 ILE 37 2HG2 ILE 37 7.826 -2.059 -1.681 330 3HG2 ILE 37 3HG2 ILE 37 8.925 -1.236 -0.574 331 1HD1 ILE 37 1HD1 ILE 37 7.909 2.274 -1.859 332 2HD1 ILE 37 2HD1 ILE 37 9.470 2.965 -1.417 333 3HD1 ILE 37 3HD1 ILE 37 8.608 1.931 -0.277 334 H ASN 38 H ASN 38 6.411 -0.439 -4.751 335 HA ASN 38 HA ASN 38 6.558 2.307 -5.777 336 1HB ASN 38 2HB ASN 38 5.036 0.414 -7.465 337 2HB ASN 38 1HB ASN 38 6.039 1.785 -7.929 338 1HD2 ASN 38 1HD2 ASN 38 5.797 -1.521 -7.906 339 2HD2 ASN 38 2HD2 ASN 38 7.451 -1.920 -8.206 340 H SER 39 H SER 39 4.379 3.176 -6.337 341 HA SER 39 HA SER 39 2.082 1.891 -5.164 342 1HB SER 39 2HB SER 39 2.995 4.516 -3.963 343 2HB SER 39 1HB SER 39 1.618 3.535 -3.465 344 HG SER 39 HG SER 39 4.331 3.190 -2.964 345 H ALA 40 H ALA 40 0.396 2.377 -6.413 346 HA ALA 40 HA ALA 40 0.068 5.059 -7.475 347 1HB ALA 40 1HB ALA 40 -0.442 3.737 -9.765 348 2HB ALA 40 2HB ALA 40 0.877 2.757 -9.124 349 3HB ALA 40 3HB ALA 40 1.110 4.485 -9.389 350 H GLY 41 H GLY 41 -2.000 4.925 -9.050 351 1HA GLY 41 2HA GLY 41 -4.065 3.619 -7.408 352 2HA GLY 41 1HA GLY 41 -4.319 5.014 -8.447 353 H THR 42 H THR 42 -6.173 3.332 -8.882 354 HA THR 42 HA THR 42 -5.551 1.150 -10.611 355 HB THR 42 HB THR 42 -8.058 1.263 -11.130 356 HG1 THR 42 1HG THR 42 -8.856 3.151 -10.536 357 1HG2 THR 42 1HG2 THR 42 -7.950 1.043 -8.221 358 2HG2 THR 42 2HG2 THR 42 -6.654 0.166 -9.033 359 3HG2 THR 42 3HG2 THR 42 -8.337 -0.177 -9.434 360 H SER 43 H SER 43 -6.869 4.407 -11.150 361 HA SER 43 HA SER 43 -6.087 4.156 -13.979 362 1HB SER 43 2HB SER 43 -8.615 5.251 -12.781 363 2HB SER 43 1HB SER 43 -8.047 5.826 -14.348 364 HG SER 43 HG SER 43 -9.455 4.071 -14.608 365 H GLY 44 H GLY 44 -5.453 5.681 -11.145 366 1HA GLY 44 2HA GLY 44 -4.209 7.537 -10.617 367 2HA GLY 44 1HA GLY 44 -3.803 7.648 -12.323 368 H GLU 45 H GLU 45 -7.141 7.677 -11.458 369 HA GLU 45 HA GLU 45 -7.708 10.089 -12.722 370 1HB GLU 45 2HB GLU 45 -9.299 8.902 -10.445 371 2HB GLU 45 1HB GLU 45 -9.895 9.956 -11.720 372 1HG GLU 45 2HG GLU 45 -9.817 8.280 -13.319 373 2HG GLU 45 1HG GLU 45 -8.691 7.300 -12.378 374 H HIS 46 H HIS 46 -7.577 9.469 -9.217 375 HA HIS 46 HA HIS 46 -6.776 12.276 -8.835 376 1HB HIS 46 2HB HIS 46 -8.089 11.332 -6.486 377 2HB HIS 46 1HB HIS 46 -8.560 12.659 -7.540 378 HD1 HIS 46 1HD HIS 46 -9.224 9.018 -6.913 379 HD2 HIS 46 2HD HIS 46 -10.692 12.134 -9.235 380 HE1 HIS 46 1HE HIS 46 -11.380 8.169 -7.888 381 HE2 HIS 46 2HE HIS 46 -12.299 10.107 -9.211 382 H ASP 47 H ASP 47 -6.436 8.942 -8.014 383 HA ASP 47 HA ASP 47 -5.051 8.862 -5.682 384 1HB ASP 47 2HB ASP 47 -3.779 7.265 -7.815 385 2HB ASP 47 1HB ASP 47 -4.463 6.750 -6.273 386 H GLY 48 H GLY 48 -3.578 10.313 -5.036 387 1HA GLY 48 2HA GLY 48 -1.210 10.790 -4.983 388 2HA GLY 48 1HA GLY 48 -1.195 10.656 -6.735 389 H GLU 49 H GLU 49 -3.676 12.389 -4.968 390 HA GLU 49 HA GLU 49 -3.188 14.767 -6.479 391 1HB GLU 49 2HB GLU 49 -5.287 13.723 -4.859 392 2HB GLU 49 1HB GLU 49 -4.867 15.317 -4.245 393 1HG GLU 49 2HG GLU 49 -5.557 14.689 -7.105 394 2HG GLU 49 1HG GLU 49 -6.661 15.382 -5.919 395 H GLY 50 H GLY 50 -3.475 14.543 -2.932 396 1HA GLY 50 2HA GLY 50 -0.901 15.420 -2.306 397 2HA GLY 50 1HA GLY 50 -1.904 16.850 -2.496 398 H MET 51 H MET 51 -4.243 15.126 -1.477 399 HA MET 51 HA MET 51 -3.668 14.372 1.180 400 1HB MET 51 2HB MET 51 -4.686 16.225 2.404 401 2HB MET 51 1HB MET 51 -3.289 16.774 1.489 402 1HG MET 51 2HG MET 51 -4.526 18.064 0.100 403 2HG MET 51 1HG MET 51 -5.928 16.998 0.175 404 1HE MET 51 1HE MET 51 -3.980 19.947 2.062 405 2HE MET 51 2HE MET 51 -5.457 20.898 2.217 406 3HE MET 51 3HE MET 51 -4.952 20.305 0.635 407 H HIS 52 H HIS 52 -5.675 14.051 2.488 408 HA HIS 52 HA HIS 52 -8.226 14.165 1.227 409 1HB HIS 52 2HB HIS 52 -7.129 12.220 0.041 410 2HB HIS 52 1HB HIS 52 -7.104 11.385 1.591 411 HD1 HIS 52 1HD HIS 52 -9.662 12.999 -0.715 412 HD2 HIS 52 2HD HIS 52 -9.339 9.932 2.070 413 HE1 HIS 52 1HE HIS 52 -11.885 11.823 -0.750 414 HE2 HIS 52 2HE HIS 52 -11.650 9.939 0.908 415 H TYR 53 H TYR 53 -9.918 13.625 2.620 416 HA TYR 53 HA TYR 53 -9.627 14.155 5.289 417 1HB TYR 53 2HB TYR 53 -11.749 13.863 3.737 418 2HB TYR 53 1HB TYR 53 -11.783 12.261 4.463 419 HD1 TYR 53 1HD TYR 53 -13.748 12.416 5.751 420 HD2 TYR 53 2HD TYR 53 -10.750 15.411 6.138 421 HE1 TYR 53 1HE TYR 53 -14.919 13.328 7.710 422 HE2 TYR 53 2HE TYR 53 -11.912 16.329 8.100 423 HH TYR 53 HH TYR 53 -14.866 15.950 8.831 424 H GLY 54 H GLY 54 -9.529 12.956 7.185 425 1HA GLY 54 2HA GLY 54 -9.334 11.012 8.481 426 2HA GLY 54 1HA GLY 54 -9.200 10.068 7.006 427 H THR 55 H THR 55 -7.157 10.153 5.841 428 HA THR 55 HA THR 55 -4.977 9.644 7.498 429 HB THR 55 HB THR 55 -5.258 10.103 4.551 430 HG1 THR 55 1HG THR 55 -5.094 7.971 4.542 431 1HG2 THR 55 1HG2 THR 55 -2.710 9.227 4.704 432 2HG2 THR 55 2HG2 THR 55 -2.758 10.282 6.116 433 3HG2 THR 55 3HG2 THR 55 -3.145 10.926 4.521 434 H LYS 56 H LYS 56 -5.621 12.526 5.491 435 HA LYS 56 HA LYS 56 -3.306 13.931 6.156 436 1HB LYS 56 2HB LYS 56 -4.334 15.848 5.250 437 2HB LYS 56 1HB LYS 56 -5.039 14.499 4.371 438 1HG LYS 56 2HG LYS 56 -7.103 14.893 5.161 439 2HG LYS 56 1HG LYS 56 -6.520 15.335 6.767 440 1HD LYS 56 2HD LYS 56 -5.937 17.188 4.520 441 2HD LYS 56 1HD LYS 56 -7.596 17.116 5.119 442 1HE LYS 56 2HE LYS 56 -7.052 18.019 7.137 443 2HE LYS 56 1HE LYS 56 -5.432 17.326 7.132 444 1HZ LYS 56 1HZ LYS 56 -6.373 19.853 6.039 445 2HZ LYS 56 2HZ LYS 56 -5.202 19.037 5.133 446 3HZ LYS 56 3HZ LYS 56 -4.882 19.463 6.737 447 H ASN 57 H ASN 57 -6.356 13.626 7.878 448 HA ASN 57 HA ASN 57 -5.970 15.677 9.758 449 1HB ASN 57 2HB ASN 57 -8.125 14.508 9.392 450 2HB ASN 57 1HB ASN 57 -7.446 13.059 10.127 451 1HD2 ASN 57 1HD2 ASN 57 -7.783 12.791 12.211 452 2HD2 ASN 57 2HD2 ASN 57 -8.226 14.026 13.335 453 H LYS 58 H LYS 58 -5.217 12.201 9.936 454 HA LYS 58 HA LYS 58 -4.051 12.259 12.497 455 1HB LYS 58 2HB LYS 58 -4.688 10.150 11.544 456 2HB LYS 58 1HB LYS 58 -3.640 10.399 10.154 457 1HG LYS 58 2HG LYS 58 -2.630 8.812 11.648 458 2HG LYS 58 1HG LYS 58 -1.681 10.300 11.650 459 1HD LYS 58 2HD LYS 58 -1.813 9.851 13.908 460 2HD LYS 58 1HD LYS 58 -3.209 10.912 13.687 461 1HE LYS 58 2HE LYS 58 -3.522 7.965 13.385 462 2HE LYS 58 1HE LYS 58 -3.462 8.677 15.001 463 1HZ LYS 58 1HZ LYS 58 -5.285 10.184 14.264 464 2HZ LYS 58 2HZ LYS 58 -5.726 8.554 14.346 465 3HZ LYS 58 3HZ LYS 58 -5.414 9.269 12.847 466 H LEU 59 H LEU 59 -2.619 12.425 9.268 467 HA LEU 59 HA LEU 59 0.056 12.603 9.949 468 1HB LEU 59 2HB LEU 59 -1.386 14.020 7.705 469 2HB LEU 59 1HB LEU 59 0.351 13.824 7.816 470 HG LEU 59 HG LEU 59 -1.635 11.566 7.544 471 1HD1 LEU 59 1HD1 LEU 59 0.342 12.183 5.438 472 2HD1 LEU 59 2HD1 LEU 59 -1.026 13.284 5.591 473 3HD1 LEU 59 3HD1 LEU 59 -1.305 11.567 5.306 474 1HD2 LEU 59 1HD2 LEU 59 1.378 11.540 7.424 475 2HD2 LEU 59 2HD2 LEU 59 0.306 10.156 7.213 476 3HD2 LEU 59 3HD2 LEU 59 0.409 10.962 8.778 477 H ALA 60 H ALA 60 -2.333 15.204 9.636 478 HA ALA 60 HA ALA 60 -0.623 17.352 10.179 479 1HB ALA 60 1HB ALA 60 -3.572 16.934 10.348 480 2HB ALA 60 2HB ALA 60 -2.646 18.030 9.323 481 3HB ALA 60 3HB ALA 60 -2.869 18.399 11.034 482 H GLN 61 H GLN 61 -2.287 15.102 12.287 483 HA GLN 61 HA GLN 61 -2.106 16.472 14.704 484 1HB GLN 61 2HB GLN 61 -2.564 13.726 13.851 485 2HB GLN 61 1HB GLN 61 -1.726 13.817 15.392 486 1HG GLN 61 2HG GLN 61 -3.496 14.766 16.464 487 2HG GLN 61 1HG GLN 61 -4.110 15.536 15.003 488 1HE2 GLN 61 1HE2 GLN 61 -3.240 12.152 15.418 489 2HE2 GLN 61 2HE2 GLN 61 -4.830 11.522 15.171 490 H LEU 62 H LEU 62 0.214 14.019 13.448 491 HA LEU 62 HA LEU 62 2.334 15.490 14.817 492 1HB LEU 62 2HB LEU 62 3.245 13.047 15.389 493 2HB LEU 62 1HB LEU 62 2.295 14.005 16.499 494 HG LEU 62 HG LEU 62 1.720 11.529 16.246 495 1HD1 LEU 62 1HD1 LEU 62 -0.860 12.462 15.917 496 2HD1 LEU 62 2HD1 LEU 62 0.031 13.851 16.539 497 3HD1 LEU 62 3HD1 LEU 62 0.034 12.330 17.432 498 1HD2 LEU 62 1HD2 LEU 62 0.154 12.424 13.852 499 2HD2 LEU 62 2HD2 LEU 62 0.440 10.787 14.442 500 3HD2 LEU 62 3HD2 LEU 62 1.753 11.697 13.697 501 H ASN 63 H ASN 63 1.411 13.133 12.387 502 HA ASN 63 HA ASN 63 4.056 12.733 11.379 503 1HB ASN 63 2HB ASN 63 1.479 12.298 9.859 504 2HB ASN 63 1HB ASN 63 3.033 11.505 9.598 505 1HD2 ASN 63 1HD2 ASN 63 0.053 11.012 10.748 506 2HD2 ASN 63 2HD2 ASN 63 0.368 9.785 11.922 507 H ILE 64 H ILE 64 3.579 13.028 8.591 508 HA ILE 64 HA ILE 64 3.848 15.942 8.372 509 HB ILE 64 HB ILE 64 4.471 14.110 6.097 510 1HG1 ILE 64 2HG1 ILE 64 5.540 13.029 8.030 511 2HG1 ILE 64 1HG1 ILE 64 6.741 13.734 6.955 512 1HG2 ILE 64 1HG2 ILE 64 6.451 15.957 6.254 513 2HG2 ILE 64 2HG2 ILE 64 5.098 16.840 6.963 514 3HG2 ILE 64 3HG2 ILE 64 4.956 16.164 5.340 515 1HD1 ILE 64 1HD1 ILE 64 5.833 15.455 9.163 516 2HD1 ILE 64 2HD1 ILE 64 7.449 15.203 8.503 517 3HD1 ILE 64 3HD1 ILE 64 6.759 14.025 9.620 518 H GLU 65 H GLU 65 2.365 17.132 7.323 519 HA GLU 65 HA GLU 65 -0.139 16.178 6.697 520 1HB GLU 65 2HB GLU 65 0.997 18.652 6.827 521 2HB GLU 65 1HB GLU 65 0.667 18.508 5.105 522 1HG GLU 65 2HG GLU 65 -1.677 17.646 6.175 523 2HG GLU 65 1HG GLU 65 -1.169 18.851 7.357 524 H HIS 66 H HIS 66 2.657 15.786 4.922 525 HA HIS 66 HA HIS 66 1.546 14.137 2.996 526 1HB HIS 66 2HB HIS 66 1.595 15.482 0.961 527 2HB HIS 66 1HB HIS 66 0.467 16.176 2.119 528 HD1 HIS 66 1HD HIS 66 1.498 17.947 -0.097 529 HD2 HIS 66 2HD HIS 66 3.402 17.608 3.583 530 HE1 HIS 66 1HE HIS 66 2.847 20.054 0.161 531 HE2 HIS 66 2HE HIS 66 4.013 19.814 2.381 532 H LYS 67 H LYS 67 3.041 13.384 1.421 533 HA LYS 67 HA LYS 67 5.643 14.336 1.071 534 1HB LYS 67 2HB LYS 67 5.365 13.187 3.581 535 2HB LYS 67 1HB LYS 67 6.053 11.893 2.610 536 1HG LYS 67 2HG LYS 67 8.020 12.825 3.085 537 2HG LYS 67 1HG LYS 67 7.583 14.037 1.879 538 1HD LYS 67 2HD LYS 67 6.587 15.414 3.659 539 2HD LYS 67 1HD LYS 67 7.092 14.215 4.850 540 1HE LYS 67 2HE LYS 67 9.416 14.716 3.486 541 2HE LYS 67 1HE LYS 67 8.638 16.299 3.503 542 1HZ LYS 67 1HZ LYS 67 8.531 14.952 6.037 543 2HZ LYS 67 2HZ LYS 67 9.018 16.530 5.673 544 3HZ LYS 67 3HZ LYS 67 10.113 15.249 5.518 545 H ASN 68 H ASN 68 6.545 13.328 -0.640 546 HA ASN 68 HA ASN 68 6.779 11.927 -2.410 547 1HB ASN 68 2HB ASN 68 5.505 9.728 -0.799 548 2HB ASN 68 1HB ASN 68 6.752 9.603 -2.037 549 1HD2 ASN 68 1HD2 ASN 68 8.450 11.638 -1.142 550 2HD2 ASN 68 2HD2 ASN 68 9.159 11.138 0.351 551 H PHE 69 H PHE 69 4.355 13.472 -2.054 552 HA PHE 69 HA PHE 69 2.180 11.831 -3.040 553 1HB PHE 69 2HB PHE 69 2.463 14.434 -1.825 554 2HB PHE 69 1HB PHE 69 1.490 14.545 -3.288 555 HD1 PHE 69 1HD PHE 69 -0.343 12.639 -3.502 556 HD2 PHE 69 2HD PHE 69 1.394 13.975 0.145 557 HE1 PHE 69 1HE PHE 69 -2.299 11.800 -2.268 558 HE2 PHE 69 2HE PHE 69 -0.558 13.138 1.386 559 HZ PHE 69 HZ PHE 69 -2.408 12.049 0.179 560 H THR 70 H THR 70 1.886 11.369 -5.105 561 HA THR 70 HA THR 70 2.291 13.356 -7.161 562 HB THR 70 HB THR 70 3.605 11.209 -8.331 563 HG1 THR 70 1HG THR 70 4.428 11.569 -5.635 564 1HG2 THR 70 1HG2 THR 70 4.627 13.089 -8.995 565 2HG2 THR 70 2HG2 THR 70 5.619 12.929 -7.546 566 3HG2 THR 70 3HG2 THR 70 4.179 13.946 -7.520 567 H SER 71 H SER 71 0.826 13.106 -8.747 568 HA SER 71 HA SER 71 -1.183 11.144 -8.576 569 1HB SER 71 2HB SER 71 -1.061 12.205 -11.238 570 2HB SER 71 1HB SER 71 -2.217 12.572 -9.957 571 HG SER 71 HG SER 71 -0.553 14.235 -10.941 572 H LYS 72 H LYS 72 -0.585 9.042 -8.745 573 HA LYS 72 HA LYS 72 0.890 8.258 -11.172 574 1HB LYS 72 2HB LYS 72 1.276 7.562 -8.399 575 2HB LYS 72 1HB LYS 72 0.969 6.118 -9.353 576 1HG LYS 72 2HG LYS 72 2.867 6.401 -10.639 577 2HG LYS 72 1HG LYS 72 2.969 8.128 -10.290 578 1HD LYS 72 2HD LYS 72 3.236 7.095 -7.803 579 2HD LYS 72 1HD LYS 72 3.985 5.821 -8.768 580 1HE LYS 72 2HE LYS 72 5.838 7.058 -8.742 581 2HE LYS 72 1HE LYS 72 5.006 8.153 -9.845 582 1HZ LYS 72 1HZ LYS 72 5.621 9.569 -8.175 583 2HZ LYS 72 2HZ LYS 72 5.445 8.411 -6.954 584 3HZ LYS 72 3HZ LYS 72 4.076 9.132 -7.637 585 H LYS 73 H LYS 73 0.244 6.404 -12.299 586 HA LYS 73 HA LYS 73 -2.386 5.293 -11.599 587 1HB LYS 73 2HB LYS 73 -2.307 5.369 -14.402 588 2HB LYS 73 1HB LYS 73 -3.343 6.311 -13.342 589 1HG LYS 73 2HG LYS 73 -1.700 8.099 -13.287 590 2HG LYS 73 1HG LYS 73 -0.614 7.146 -14.300 591 1HD LYS 73 2HD LYS 73 -1.571 8.330 -15.967 592 2HD LYS 73 1HD LYS 73 -2.836 7.107 -15.823 593 1HE LYS 73 2HE LYS 73 -3.806 8.747 -14.033 594 2HE LYS 73 1HE LYS 73 -2.806 9.937 -14.865 595 1HZ LYS 73 1HZ LYS 73 -4.120 9.904 -16.678 596 2HZ LYS 73 2HZ LYS 73 -5.292 9.372 -15.582 597 3HZ LYS 73 3HZ LYS 73 -4.473 8.254 -16.552 598 H LEU 74 H LEU 74 -1.651 3.296 -11.026 599 HA LEU 74 HA LEU 74 0.415 1.845 -12.187 600 1HB LEU 74 2HB LEU 74 -0.182 0.776 -10.298 601 2HB LEU 74 1HB LEU 74 -1.852 1.289 -10.416 602 HG LEU 74 HG LEU 74 -1.333 -0.705 -12.417 603 1HD1 LEU 74 1HD1 LEU 74 0.238 -1.093 -10.132 604 2HD1 LEU 74 2HD1 LEU 74 -0.116 -2.258 -11.408 605 3HD1 LEU 74 3HD1 LEU 74 -1.136 -2.187 -9.971 606 1HD2 LEU 74 1HD2 LEU 74 -3.035 -1.860 -10.708 607 2HD2 LEU 74 2HD2 LEU 74 -3.523 -0.609 -11.852 608 3HD2 LEU 74 3HD2 LEU 74 -3.185 -0.186 -10.173 609 H THR 75 H THR 75 0.650 0.999 -14.151 610 HA THR 75 HA THR 75 -1.772 0.418 -15.730 611 HB THR 75 HB THR 75 0.687 0.686 -17.278 612 HG1 THR 75 1HG THR 75 -0.072 3.203 -16.650 613 1HG2 THR 75 1HG2 THR 75 -2.156 1.441 -17.406 614 2HG2 THR 75 2HG2 THR 75 -1.081 0.851 -18.673 615 3HG2 THR 75 3HG2 THR 75 -1.048 2.552 -18.209 616 H GLN 76 H GLN 76 -0.927 -1.062 -17.733 617 HA GLN 76 HA GLN 76 -0.513 -3.615 -16.600 618 1HB GLN 76 2HB GLN 76 -1.692 -3.055 -18.788 619 2HB GLN 76 1HB GLN 76 -0.091 -2.907 -19.501 620 1HG GLN 76 2HG GLN 76 0.394 -5.211 -19.006 621 2HG GLN 76 1HG GLN 76 -1.131 -5.382 -18.140 622 1HE2 GLN 76 1HE2 GLN 76 -0.086 -4.133 -21.299 623 2HE2 GLN 76 2HE2 GLN 76 -1.269 -4.992 -22.219 624 H LYS 77 H LYS 77 1.615 -1.498 -18.508 625 HA LYS 77 HA LYS 77 3.845 -3.186 -18.564 626 1HB LYS 77 2HB LYS 77 3.335 -0.883 -19.753 627 2HB LYS 77 1HB LYS 77 4.211 -0.225 -18.378 628 1HG LYS 77 2HG LYS 77 6.201 -1.045 -19.073 629 2HG LYS 77 1HG LYS 77 5.479 -2.481 -19.803 630 1HD LYS 77 2HD LYS 77 4.747 0.047 -21.099 631 2HD LYS 77 1HD LYS 77 6.464 -0.353 -21.189 632 1HE LYS 77 2HE LYS 77 4.881 -2.686 -21.723 633 2HE LYS 77 1HE LYS 77 4.371 -1.363 -22.770 634 1HZ LYS 77 1HZ LYS 77 6.093 -1.938 -24.033 635 2HZ LYS 77 2HZ LYS 77 6.784 -2.906 -22.830 636 3HZ LYS 77 3HZ LYS 77 7.086 -1.242 -22.852 637 H LEU 78 H LEU 78 2.825 -0.770 -16.196 638 HA LEU 78 HA LEU 78 5.135 -0.899 -14.573 639 1HB LEU 78 2HB LEU 78 2.952 0.696 -14.639 640 2HB LEU 78 1HB LEU 78 2.548 -0.320 -13.269 641 HG LEU 78 HG LEU 78 4.909 0.294 -12.398 642 1HD1 LEU 78 1HD1 LEU 78 4.455 2.638 -14.230 643 2HD1 LEU 78 2HD1 LEU 78 5.587 1.330 -14.571 644 3HD1 LEU 78 3HD1 LEU 78 5.826 2.355 -13.156 645 1HD2 LEU 78 1HD2 LEU 78 3.758 2.715 -11.879 646 2HD2 LEU 78 2HD2 LEU 78 3.426 1.223 -11.001 647 3HD2 LEU 78 3HD2 LEU 78 2.363 1.729 -12.314 648 H CYS 79 H CYS 79 2.091 -2.674 -14.580 649 HA CYS 79 HA CYS 79 2.512 -4.069 -12.155 650 1HB CYS 79 2HB CYS 79 0.339 -4.396 -12.634 651 2HB CYS 79 1HB CYS 79 0.589 -4.113 -14.352 652 HG CYS 79 HG CYS 79 1.756 -7.073 -13.350 653 H ASP 80 H ASP 80 3.292 -4.769 -15.518 654 HA ASP 80 HA ASP 80 4.159 -7.420 -15.174 655 1HB ASP 80 2HB ASP 80 4.007 -5.562 -17.294 656 2HB ASP 80 1HB ASP 80 5.681 -6.099 -17.224 657 H GLU 81 H GLU 81 5.574 -4.438 -14.267 658 HA GLU 81 HA GLU 81 8.297 -5.378 -14.243 659 1HB GLU 81 2HB GLU 81 6.933 -2.888 -13.247 660 2HB GLU 81 1HB GLU 81 8.621 -3.217 -12.879 661 1HG GLU 81 2HG GLU 81 7.710 -3.339 -15.710 662 2HG GLU 81 1HG GLU 81 7.948 -1.768 -14.947 663 H SER 82 H SER 82 6.028 -4.387 -11.654 664 HA SER 82 HA SER 82 7.601 -5.345 -9.539 665 1HB SER 82 2HB SER 82 5.690 -5.010 -8.153 666 2HB SER 82 1HB SER 82 5.620 -3.761 -9.397 667 HG SER 82 HG SER 82 3.712 -5.359 -8.811 668 H ASP 83 H ASP 83 7.861 -7.299 -8.639 669 HA ASP 83 HA ASP 83 6.733 -9.588 -10.009 670 1HB ASP 83 2HB ASP 83 9.152 -9.440 -9.300 671 2HB ASP 83 1HB ASP 83 8.601 -9.584 -7.633 672 H PHE 84 H PHE 84 6.053 -7.718 -7.239 673 HA PHE 84 HA PHE 84 4.202 -9.806 -6.282 674 1HB PHE 84 2HB PHE 84 6.236 -8.306 -4.832 675 2HB PHE 84 1HB PHE 84 4.641 -8.131 -4.108 676 HD1 PHE 84 1HD PHE 84 6.990 -10.734 -5.369 677 HD2 PHE 84 2HD PHE 84 3.870 -9.743 -2.649 678 HE1 PHE 84 1HE PHE 84 7.248 -12.924 -4.279 679 HE2 PHE 84 2HE PHE 84 4.123 -11.932 -1.554 680 HZ PHE 84 HZ PHE 84 5.815 -13.526 -2.368 681 H LEU 85 H LEU 85 2.154 -9.244 -6.576 682 HA LEU 85 HA LEU 85 1.451 -6.423 -6.885 683 1HB LEU 85 2HB LEU 85 0.224 -9.013 -7.675 684 2HB LEU 85 1HB LEU 85 -0.869 -7.684 -7.342 685 HG LEU 85 HG LEU 85 -0.360 -7.868 -9.731 686 1HD1 LEU 85 1HD1 LEU 85 -0.130 -5.604 -10.125 687 2HD1 LEU 85 2HD1 LEU 85 1.016 -5.384 -8.802 688 3HD1 LEU 85 3HD1 LEU 85 -0.694 -5.638 -8.454 689 1HD2 LEU 85 1HD2 LEU 85 1.726 -8.676 -10.099 690 2HD2 LEU 85 2HD2 LEU 85 2.419 -7.828 -8.717 691 3HD2 LEU 85 3HD2 LEU 85 2.102 -6.958 -10.216 692 H ILE 86 H ILE 86 0.246 -5.304 -5.427 693 HA ILE 86 HA ILE 86 -0.845 -6.824 -3.152 694 HB ILE 86 HB ILE 86 0.736 -4.263 -3.084 695 1HG1 ILE 86 2HG1 ILE 86 1.861 -5.695 -1.210 696 2HG1 ILE 86 1HG1 ILE 86 1.069 -7.046 -2.012 697 1HG2 ILE 86 1HG2 ILE 86 -0.454 -3.549 -1.352 698 2HG2 ILE 86 2HG2 ILE 86 0.006 -5.004 -0.467 699 3HG2 ILE 86 3HG2 ILE 86 -1.476 -4.986 -1.423 700 1HD1 ILE 86 1HD1 ILE 86 2.307 -5.617 -4.054 701 2HD1 ILE 86 2HD1 ILE 86 2.819 -7.154 -3.356 702 3HD1 ILE 86 3HD1 ILE 86 3.467 -5.640 -2.726 703 H THR 87 H THR 87 -2.939 -6.614 -2.986 704 HA THR 87 HA THR 87 -4.218 -4.083 -3.798 705 HB THR 87 HB THR 87 -6.290 -5.423 -4.190 706 HG1 THR 87 1HG THR 87 -5.296 -7.825 -4.557 707 1HG2 THR 87 1HG2 THR 87 -5.685 -5.489 -6.334 708 2HG2 THR 87 2HG2 THR 87 -4.599 -6.846 -6.031 709 3HG2 THR 87 3HG2 THR 87 -4.022 -5.192 -5.829 710 H MET 88 H MET 88 -4.549 -2.997 -1.936 711 HA MET 88 HA MET 88 -5.179 -4.391 0.514 712 1HB MET 88 2HB MET 88 -3.607 -2.514 0.538 713 2HB MET 88 1HB MET 88 -4.839 -1.446 -0.113 714 1HG MET 88 2HG MET 88 -5.582 -2.813 2.366 715 2HG MET 88 1HG MET 88 -4.229 -1.694 2.507 716 1HE MET 88 1HE MET 88 -6.348 1.067 3.697 717 2HE MET 88 2HE MET 88 -4.927 0.034 3.849 718 3HE MET 88 3HE MET 88 -6.512 -0.570 4.334 719 H ASP 89 H ASP 89 -6.781 -2.387 -1.879 720 HA ASP 89 HA ASP 89 -9.192 -2.109 -0.318 721 1HB ASP 89 2HB ASP 89 -8.770 -1.520 -3.255 722 2HB ASP 89 1HB ASP 89 -10.096 -0.952 -2.248 723 H ASN 90 H ASN 90 -11.167 -3.114 -0.727 724 HA ASN 90 HA ASN 90 -11.023 -5.819 -1.486 725 1HB ASN 90 2HB ASN 90 -12.802 -4.317 -0.073 726 2HB ASN 90 1HB ASN 90 -13.693 -4.573 -1.570 727 1HD2 ASN 90 1HD2 ASN 90 -13.398 -5.707 1.404 728 2HD2 ASN 90 2HD2 ASN 90 -13.735 -7.383 1.156 729 H SER 91 H SER 91 -12.417 -2.999 -3.147 730 HA SER 91 HA SER 91 -13.219 -4.483 -5.446 731 1HB SER 91 2HB SER 91 -14.077 -2.179 -4.584 732 2HB SER 91 1HB SER 91 -12.718 -1.521 -5.492 733 HG SER 91 HG SER 91 -14.147 -3.346 -6.924 734 H ASN 92 H ASN 92 -10.247 -3.123 -4.405 735 HA ASN 92 HA ASN 92 -9.005 -2.570 -6.851 736 1HB ASN 92 2HB ASN 92 -8.206 -2.859 -4.085 737 2HB ASN 92 1HB ASN 92 -6.999 -3.556 -5.162 738 1HD2 ASN 92 1HD2 ASN 92 -6.240 -1.464 -3.723 739 2HD2 ASN 92 2HD2 ASN 92 -6.115 -0.041 -4.695 740 H PHE 93 H PHE 93 -9.443 -5.582 -5.106 741 HA PHE 93 HA PHE 93 -7.661 -7.162 -6.615 742 1HB PHE 93 2HB PHE 93 -8.365 -8.044 -4.536 743 2HB PHE 93 1HB PHE 93 -10.067 -7.818 -4.922 744 HD1 PHE 93 1HD PHE 93 -11.297 -9.638 -5.618 745 HD2 PHE 93 2HD PHE 93 -7.071 -9.684 -6.120 746 HE1 PHE 93 1HE PHE 93 -11.421 -11.961 -6.420 747 HE2 PHE 93 2HE PHE 93 -7.188 -12.006 -6.925 748 HZ PHE 93 HZ PHE 93 -9.365 -13.148 -7.076 749 H LYS 94 H LYS 94 -11.123 -6.491 -6.968 750 HA LYS 94 HA LYS 94 -11.557 -8.251 -9.137 751 1HB LYS 94 2HB LYS 94 -13.129 -6.594 -7.547 752 2HB LYS 94 1HB LYS 94 -13.290 -5.917 -9.162 753 1HG LYS 94 2HG LYS 94 -13.932 -8.150 -9.996 754 2HG LYS 94 1HG LYS 94 -13.860 -8.758 -8.342 755 1HD LYS 94 2HD LYS 94 -16.070 -8.258 -8.387 756 2HD LYS 94 1HD LYS 94 -15.473 -6.651 -7.965 757 1HE LYS 94 2HE LYS 94 -16.825 -6.115 -9.726 758 2HE LYS 94 1HE LYS 94 -15.311 -6.399 -10.582 759 1HZ LYS 94 1HZ LYS 94 -16.076 -8.680 -11.020 760 2HZ LYS 94 2HZ LYS 94 -17.097 -7.517 -11.703 761 3HZ LYS 94 3HZ LYS 94 -17.558 -8.318 -10.287 762 H ASN 95 H ASN 95 -10.681 -4.831 -8.971 763 HA ASN 95 HA ASN 95 -10.931 -4.261 -11.713 764 1HB ASN 95 2HB ASN 95 -10.191 -2.853 -9.411 765 2HB ASN 95 1HB ASN 95 -8.786 -2.762 -10.469 766 1HD2 ASN 95 1HD2 ASN 95 -11.729 -1.416 -9.713 767 2HD2 ASN 95 2HD2 ASN 95 -11.968 -0.469 -11.137 768 H VAL 96 H VAL 96 -7.994 -4.993 -9.822 769 HA VAL 96 HA VAL 96 -6.253 -5.108 -12.020 770 HB VAL 96 HB VAL 96 -4.696 -6.287 -10.541 771 1HG1 VAL 96 1HG1 VAL 96 -5.191 -4.562 -8.490 772 2HG1 VAL 96 2HG1 VAL 96 -6.085 -3.814 -9.813 773 3HG1 VAL 96 3HG1 VAL 96 -4.361 -4.139 -9.987 774 1HG2 VAL 96 1HG2 VAL 96 -6.172 -7.812 -9.419 775 2HG2 VAL 96 2HG2 VAL 96 -7.068 -6.479 -8.688 776 3HG2 VAL 96 3HG2 VAL 96 -5.400 -6.790 -8.207 777 H LEU 97 H LEU 97 -8.534 -7.394 -10.795 778 HA LEU 97 HA LEU 97 -7.406 -9.775 -11.791 779 1HB LEU 97 2HB LEU 97 -9.529 -9.223 -10.245 780 2HB LEU 97 1HB LEU 97 -10.358 -9.497 -11.765 781 HG LEU 97 HG LEU 97 -10.257 -11.509 -10.325 782 1HD1 LEU 97 1HD1 LEU 97 -9.052 -12.947 -12.181 783 2HD1 LEU 97 2HD1 LEU 97 -9.111 -11.421 -13.062 784 3HD1 LEU 97 3HD1 LEU 97 -10.602 -12.162 -12.480 785 1HD2 LEU 97 1HD2 LEU 97 -7.720 -10.759 -9.748 786 2HD2 LEU 97 2HD2 LEU 97 -7.432 -12.017 -10.950 787 3HD2 LEU 97 3HD2 LEU 97 -8.360 -12.383 -9.495 788 H LYS 98 H LYS 98 -9.643 -7.444 -13.253 789 HA LYS 98 HA LYS 98 -9.531 -8.940 -15.770 790 1HB LYS 98 2HB LYS 98 -11.328 -6.687 -14.866 791 2HB LYS 98 1HB LYS 98 -11.372 -7.397 -16.474 792 1HG LYS 98 2HG LYS 98 -11.664 -9.158 -14.087 793 2HG LYS 98 1HG LYS 98 -13.035 -8.192 -14.636 794 1HD LYS 98 2HD LYS 98 -12.837 -9.196 -16.866 795 2HD LYS 98 1HD LYS 98 -11.479 -10.171 -16.301 796 1HE LYS 98 2HE LYS 98 -13.798 -10.422 -14.578 797 2HE LYS 98 1HE LYS 98 -14.160 -10.873 -16.243 798 1HZ LYS 98 1HZ LYS 98 -13.315 -12.838 -15.637 799 2HZ LYS 98 2HZ LYS 98 -12.504 -12.208 -14.292 800 3HZ LYS 98 3HZ LYS 98 -11.805 -12.098 -15.829 801 H ASN 99 H ASN 99 -7.906 -6.451 -14.298 802 HA ASN 99 HA ASN 99 -7.500 -4.939 -16.771 803 1HB ASN 99 2HB ASN 99 -7.938 -3.807 -14.531 804 2HB ASN 99 1HB ASN 99 -6.314 -4.309 -14.071 805 1HD2 ASN 99 1HD2 ASN 99 -6.065 -1.956 -13.843 806 2HD2 ASN 99 2HD2 ASN 99 -5.599 -1.045 -15.236 807 H PHE 100 H PHE 100 -6.009 -7.380 -14.901 808 HA PHE 100 HA PHE 100 -3.483 -6.964 -16.361 809 1HB PHE 100 2HB PHE 100 -3.910 -8.216 -13.643 810 2HB PHE 100 1HB PHE 100 -2.374 -8.197 -14.500 811 HD1 PHE 100 1HD PHE 100 -3.097 -7.039 -11.733 812 HD2 PHE 100 2HD PHE 100 -2.807 -5.322 -15.616 813 HE1 PHE 100 1HE PHE 100 -2.581 -4.856 -10.726 814 HE2 PHE 100 2HE PHE 100 -2.291 -3.137 -14.615 815 HZ PHE 100 HZ PHE 100 -2.177 -2.902 -12.167 816 H THR 101 H THR 101 -2.193 -9.134 -16.379 817 HA THR 101 HA THR 101 -3.804 -11.000 -17.873 818 HB THR 101 HB THR 101 -1.296 -12.152 -17.607 819 HG1 THR 101 1HG THR 101 -0.049 -10.108 -18.225 820 1HG2 THR 101 1HG2 THR 101 -1.996 -12.177 -19.758 821 2HG2 THR 101 2HG2 THR 101 -1.023 -10.711 -19.878 822 3HG2 THR 101 3HG2 THR 101 -2.766 -10.595 -19.636 823 H ASN 102 H ASN 102 -2.634 -13.418 -17.380 824 HA ASN 102 HA ASN 102 -4.083 -14.374 -15.168 825 1HB ASN 102 2HB ASN 102 -2.951 -15.514 -17.364 826 2HB ASN 102 1HB ASN 102 -1.847 -16.052 -16.101 827 1HD2 ASN 102 1HD2 ASN 102 -2.538 -17.502 -14.581 828 2HD2 ASN 102 2HD2 ASN 102 -4.052 -18.328 -14.682 829 H THR 103 H THR 103 -1.614 -12.415 -14.831 830 HA THR 103 HA THR 103 -0.080 -13.906 -12.861 831 HB THR 103 HB THR 103 1.579 -12.512 -13.391 832 HG1 THR 103 1HG THR 103 0.923 -10.067 -13.168 833 1HG2 THR 103 1HG2 THR 103 -0.356 -10.920 -15.075 834 2HG2 THR 103 2HG2 THR 103 0.411 -12.421 -15.595 835 3HG2 THR 103 3HG2 THR 103 1.397 -11.000 -15.251 836 H GLN 104 H GLN 104 -2.977 -12.520 -12.820 837 HA GLN 104 HA GLN 104 -2.968 -10.759 -10.636 838 1HB GLN 104 2HB GLN 104 -5.444 -11.823 -10.464 839 2HB GLN 104 1HB GLN 104 -4.993 -10.584 -11.625 840 1HG GLN 104 2HG GLN 104 -6.167 -12.197 -12.848 841 2HG GLN 104 1HG GLN 104 -4.468 -12.469 -13.228 842 1HE2 GLN 104 1HE2 GLN 104 -5.294 -14.572 -13.914 843 2HE2 GLN 104 2HE2 GLN 104 -5.456 -15.826 -12.739 844 H ASN 105 H ASN 105 -2.264 -14.026 -10.696 845 HA ASN 105 HA ASN 105 -3.399 -14.769 -8.170 846 1HB ASN 105 2HB ASN 105 -2.382 -16.165 -10.305 847 2HB ASN 105 1HB ASN 105 -1.104 -16.341 -9.105 848 1HD2 ASN 105 1HD2 ASN 105 -1.728 -17.160 -6.993 849 2HD2 ASN 105 2HD2 ASN 105 -3.030 -18.291 -6.885 850 H LYS 106 H LYS 106 -1.102 -12.598 -8.807 851 HA LYS 106 HA LYS 106 0.582 -13.336 -6.507 852 1HB LYS 106 2HB LYS 106 1.156 -11.410 -8.766 853 2HB LYS 106 1HB LYS 106 2.244 -11.763 -7.431 854 1HG LYS 106 2HG LYS 106 1.261 -13.968 -9.191 855 2HG LYS 106 1HG LYS 106 2.593 -12.933 -9.710 856 1HD LYS 106 2HD LYS 106 3.673 -13.469 -7.467 857 2HD LYS 106 1HD LYS 106 2.457 -14.737 -7.307 858 1HE LYS 106 2HE LYS 106 4.462 -15.699 -8.214 859 2HE LYS 106 1HE LYS 106 3.227 -15.675 -9.471 860 1HZ LYS 106 1HZ LYS 106 4.375 -13.391 -10.010 861 2HZ LYS 106 2HZ LYS 106 4.984 -14.845 -10.622 862 3HZ LYS 106 3HZ LYS 106 5.703 -14.132 -9.267 863 H VAL 107 H VAL 107 -2.110 -11.954 -6.590 864 HA VAL 107 HA VAL 107 -1.466 -9.291 -5.603 865 HB VAL 107 HB VAL 107 -3.899 -8.962 -5.458 866 1HG1 VAL 107 1HG1 VAL 107 -3.603 -8.261 -7.547 867 2HG1 VAL 107 2HG1 VAL 107 -4.113 -9.859 -8.091 868 3HG1 VAL 107 3HG1 VAL 107 -2.400 -9.513 -7.856 869 1HG2 VAL 107 1HG2 VAL 107 -5.430 -10.603 -5.601 870 2HG2 VAL 107 2HG2 VAL 107 -4.077 -11.659 -5.195 871 3HG2 VAL 107 3HG2 VAL 107 -4.555 -11.445 -6.878 872 H LEU 108 H LEU 108 -1.745 -8.580 -3.530 873 HA LEU 108 HA LEU 108 -2.210 -10.656 -1.495 874 1HB LEU 108 2HB LEU 108 -0.373 -8.352 -1.677 875 2HB LEU 108 1HB LEU 108 -1.121 -8.592 -0.108 876 HG LEU 108 HG LEU 108 -0.268 -11.121 -0.679 877 1HD1 LEU 108 1HD1 LEU 108 0.911 -9.840 -2.685 878 2HD1 LEU 108 2HD1 LEU 108 1.678 -11.190 -1.850 879 3HD1 LEU 108 3HD1 LEU 108 2.116 -9.533 -1.435 880 1HD2 LEU 108 1HD2 LEU 108 1.203 -10.827 1.082 881 2HD2 LEU 108 2HD2 LEU 108 0.031 -9.538 1.352 882 3HD2 LEU 108 3HD2 LEU 108 1.591 -9.171 0.617 883 H LYS 109 H LYS 109 -3.866 -10.438 -0.091 884 HA LYS 109 HA LYS 109 -5.437 -7.956 -0.210 885 1HB LYS 109 2HB LYS 109 -6.195 -10.703 -0.580 886 2HB LYS 109 1HB LYS 109 -7.044 -10.043 0.810 887 1HG LYS 109 2HG LYS 109 -8.338 -8.718 -0.450 888 2HG LYS 109 1HG LYS 109 -7.019 -8.300 -1.546 889 1HD LYS 109 2HD LYS 109 -8.342 -9.528 -2.957 890 2HD LYS 109 1HD LYS 109 -7.314 -10.808 -2.308 891 1HE LYS 109 2HE LYS 109 -9.530 -11.626 -2.208 892 2HE LYS 109 1HE LYS 109 -9.095 -11.180 -0.558 893 1HZ LYS 109 1HZ LYS 109 -10.185 -8.911 -1.407 894 2HZ LYS 109 2HZ LYS 109 -11.069 -10.135 -0.648 895 3HZ LYS 109 3HZ LYS 109 -11.074 -10.012 -2.334 896 H ILE 110 H ILE 110 -6.254 -7.090 1.666 897 HA ILE 110 HA ILE 110 -4.723 -7.467 4.024 898 HB ILE 110 HB ILE 110 -5.731 -5.307 3.395 899 1HG1 ILE 110 2HG1 ILE 110 -6.783 -4.826 5.697 900 2HG1 ILE 110 1HG1 ILE 110 -6.450 -6.516 6.060 901 1HG2 ILE 110 1HG2 ILE 110 -8.290 -5.277 4.239 902 2HG2 ILE 110 2HG2 ILE 110 -8.199 -6.904 3.565 903 3HG2 ILE 110 3HG2 ILE 110 -7.811 -5.510 2.558 904 1HD1 ILE 110 1HD1 ILE 110 -4.034 -5.907 5.307 905 2HD1 ILE 110 2HD1 ILE 110 -4.599 -5.474 6.919 906 3HD1 ILE 110 3HD1 ILE 110 -4.556 -4.258 5.644 907 H THR 111 H THR 111 -7.814 -8.694 2.933 908 HA THR 111 HA THR 111 -8.916 -9.494 5.368 909 HB THR 111 HB THR 111 -10.102 -9.516 3.162 910 HG1 THR 111 1HG THR 111 -11.406 -10.656 4.368 911 1HG2 THR 111 1HG2 THR 111 -9.178 -10.666 1.486 912 2HG2 THR 111 2HG2 THR 111 -9.668 -12.140 2.321 913 3HG2 THR 111 3HG2 THR 111 -8.055 -11.474 2.581 914 H ASP 112 H ASP 112 -6.259 -10.787 3.599 915 HA ASP 112 HA ASP 112 -6.342 -13.387 4.846 916 1HB ASP 112 2HB ASP 112 -4.648 -12.021 2.840 917 2HB ASP 112 1HB ASP 112 -3.847 -13.251 3.814 918 H PHE 113 H PHE 113 -4.912 -10.292 5.487 919 HA PHE 113 HA PHE 113 -3.681 -11.413 7.909 920 1HB PHE 113 2HB PHE 113 -2.310 -9.101 6.648 921 2HB PHE 113 1HB PHE 113 -1.638 -10.456 7.549 922 HD1 PHE 113 1HD PHE 113 -1.316 -12.645 6.415 923 HD2 PHE 113 2HD PHE 113 -2.434 -9.130 4.293 924 HE1 PHE 113 1HE PHE 113 -0.621 -13.703 4.304 925 HE2 PHE 113 2HE PHE 113 -1.742 -10.180 2.178 926 HZ PHE 113 HZ PHE 113 -0.835 -12.470 2.183 927 H SER 114 H SER 114 -5.987 -10.540 8.442 928 HA SER 114 HA SER 114 -5.614 -8.175 9.979 929 1HB SER 114 2HB SER 114 -6.451 -6.589 8.642 930 2HB SER 114 1HB SER 114 -6.542 -7.771 7.338 931 HG SER 114 HG SER 114 -8.539 -6.980 9.160 932 HA PRO 115 HA PRO 115 -8.635 -10.806 12.026 933 1HB PRO 115 2HB PRO 115 -8.238 -9.045 14.323 934 2HB PRO 115 1HB PRO 115 -7.852 -10.758 14.153 935 1HG PRO 115 2HG PRO 115 -5.944 -8.844 14.305 936 2HG PRO 115 1HG PRO 115 -5.729 -10.340 13.378 937 1HD PRO 115 2HD PRO 115 -6.439 -7.593 12.409 938 2HD PRO 115 1HD PRO 115 -5.321 -8.783 11.705 939 H SER 116 H SER 116 -9.074 -7.932 13.913 940 HA SER 116 HA SER 116 -11.809 -7.713 12.936 941 1HB SER 116 2HB SER 116 -11.735 -5.878 14.883 942 2HB SER 116 1HB SER 116 -11.940 -7.596 15.225 943 HG SER 116 HG SER 116 -10.177 -6.214 16.317 944 H LEU 117 H LEU 117 -9.306 -6.771 11.506 945 HA LEU 117 HA LEU 117 -9.779 -3.897 11.332 946 1HB LEU 117 2HB LEU 117 -7.475 -5.222 11.343 947 2HB LEU 117 1HB LEU 117 -7.789 -5.299 9.620 948 HG LEU 117 HG LEU 117 -8.174 -2.677 9.985 949 1HD1 LEU 117 1HD1 LEU 117 -6.595 -3.619 12.310 950 2HD1 LEU 117 2HD1 LEU 117 -7.715 -2.264 12.173 951 3HD1 LEU 117 3HD1 LEU 117 -6.082 -2.128 11.518 952 1HD2 LEU 117 1HD2 LEU 117 -5.941 -2.343 9.149 953 2HD2 LEU 117 2HD2 LEU 117 -6.624 -3.791 8.411 954 3HD2 LEU 117 3HD2 LEU 117 -5.449 -3.938 9.718 955 H ASN 118 H ASN 118 -11.846 -5.631 10.403 956 HA ASN 118 HA ASN 118 -11.712 -5.867 7.559 957 1HB ASN 118 2HB ASN 118 -13.285 -6.986 9.497 958 2HB ASN 118 1HB ASN 118 -14.391 -5.824 8.772 959 1HD2 ASN 118 1HD2 ASN 118 -13.474 -5.890 6.148 960 2HD2 ASN 118 2HD2 ASN 118 -13.834 -7.440 5.475 961 H TYR 119 H TYR 119 -12.187 -4.438 6.043 962 HA TYR 119 HA TYR 119 -13.953 -2.186 6.604 963 1HB TYR 119 2HB TYR 119 -12.362 -0.552 5.670 964 2HB TYR 119 1HB TYR 119 -11.732 -1.301 7.134 965 HD1 TYR 119 1HD TYR 119 -11.170 -0.685 3.625 966 HD2 TYR 119 2HD TYR 119 -10.019 -3.129 6.913 967 HE1 TYR 119 1HE TYR 119 -9.119 -1.332 2.416 968 HE2 TYR 119 2HE TYR 119 -7.974 -3.781 5.718 969 HH TYR 119 HH TYR 119 -6.529 -2.850 3.912 970 H ASP 120 H ASP 120 -13.923 -0.798 4.375 971 HA ASP 120 HA ASP 120 -14.707 -2.727 2.350 972 1HB ASP 120 2HB ASP 120 -15.042 0.263 2.283 973 2HB ASP 120 1HB ASP 120 -15.859 -0.920 1.265 974 H GLU 121 H GLU 121 -13.295 0.411 2.048 975 HA GLU 121 HA GLU 121 -10.985 -0.633 0.616 976 1HB GLU 121 2HB GLU 121 -13.053 1.189 -0.598 977 2HB GLU 121 1HB GLU 121 -11.398 1.150 -1.191 978 1HG GLU 121 2HG GLU 121 -11.966 -0.534 -2.501 979 2HG GLU 121 1HG GLU 121 -12.215 -1.520 -1.060 980 H VAL 122 H VAL 122 -9.526 0.173 2.042 981 HA VAL 122 HA VAL 122 -8.128 1.696 2.999 982 HB VAL 122 HB VAL 122 -9.631 3.593 1.199 983 1HG1 VAL 122 1HG1 VAL 122 -8.055 5.335 1.765 984 2HG1 VAL 122 2HG1 VAL 122 -7.246 4.271 2.915 985 3HG1 VAL 122 3HG1 VAL 122 -8.899 4.806 3.219 986 1HG2 VAL 122 1HG2 VAL 122 -7.278 3.703 0.182 987 2HG2 VAL 122 2HG2 VAL 122 -8.230 2.241 -0.084 988 3HG2 VAL 122 3HG2 VAL 122 -6.953 2.252 1.131 989 HA PRO 123 HA PRO 123 -10.414 2.777 6.635 990 1HB PRO 123 2HB PRO 123 -8.574 4.425 7.827 991 2HB PRO 123 1HB PRO 123 -8.476 2.663 7.841 992 1HG PRO 123 2HG PRO 123 -7.086 4.620 6.052 993 2HG PRO 123 1HG PRO 123 -6.431 3.182 6.858 994 1HD PRO 123 2HD PRO 123 -7.100 3.144 4.264 995 2HD PRO 123 1HD PRO 123 -7.373 1.734 5.308 996 H ASP 124 H ASP 124 -9.375 5.535 7.704 997 HA ASP 124 HA ASP 124 -10.069 7.693 7.729 998 1HB ASP 124 2HB ASP 124 -9.558 8.631 5.766 999 2HB ASP 124 1HB ASP 124 -9.726 7.078 4.954 1000 HA PRO 125 HA PRO 125 -14.345 7.520 8.688 1001 1HB PRO 125 2HB PRO 125 -15.108 10.126 8.441 1002 2HB PRO 125 1HB PRO 125 -14.154 9.510 9.794 1003 1HG PRO 125 2HG PRO 125 -13.248 10.965 7.343 1004 2HG PRO 125 1HG PRO 125 -12.723 11.168 9.025 1005 1HD PRO 125 2HD PRO 125 -11.273 9.785 7.213 1006 2HD PRO 125 1HD PRO 125 -11.305 9.351 8.934 1007 H TRP 126 H TRP 126 -13.447 9.054 5.668 1008 HA TRP 126 HA TRP 126 -16.028 9.278 4.562 1009 1HB TRP 126 2HB TRP 126 -14.034 10.450 3.676 1010 2HB TRP 126 1HB TRP 126 -13.401 8.910 3.107 1011 HD1 TRP 126 HD TRP 126 -13.574 9.041 0.552 1012 HE1 TRP 126 1HE TRP 126 -15.438 9.578 -1.138 1013 HE3 TRP 126 3HE TRP 126 -17.229 10.523 3.809 1014 HZ2 TRP 126 2HZ TRP 126 -18.102 10.509 -1.100 1015 HZ3 TRP 126 3HZ TRP 126 -19.404 11.223 2.900 1016 HH2 TRP 126 HH TRP 126 -19.830 11.216 0.496 1017 H TYR 127 H TYR 127 -13.988 6.556 5.068 1018 HA TYR 127 HA TYR 127 -15.696 4.930 3.301 1019 1HB TYR 127 2HB TYR 127 -12.917 4.280 4.309 1020 2HB TYR 127 1HB TYR 127 -13.876 3.300 3.207 1021 HD1 TYR 127 1HD TYR 127 -11.034 4.744 2.972 1022 HD2 TYR 127 2HD TYR 127 -14.931 5.517 1.445 1023 HE1 TYR 127 1HE TYR 127 -10.045 5.948 1.068 1024 HE2 TYR 127 2HE TYR 127 -13.951 6.714 -0.467 1025 HH TYR 127 HH TYR 127 -11.805 6.777 -1.696 1026 H SER 128 H SER 128 -13.999 4.886 6.427 1027 HA SER 128 HA SER 128 -15.669 2.675 7.329 1028 1HB SER 128 2HB SER 128 -13.658 4.006 9.100 1029 2HB SER 128 1HB SER 128 -14.113 2.305 9.001 1030 HG SER 128 HG SER 128 -13.012 2.223 6.987 1031 H GLY 129 H GLY 129 -14.748 5.900 8.592 1032 1HA GLY 129 2HA GLY 129 -17.009 7.157 9.045 1033 2HA GLY 129 1HA GLY 129 -17.172 5.878 10.237 1034 H ASN 130 H ASN 130 -14.018 6.212 10.317 1035 HA ASN 130 HA ASN 130 -13.990 8.607 12.020 1036 1HB ASN 130 2HB ASN 130 -14.158 6.228 13.196 1037 2HB ASN 130 1HB ASN 130 -12.422 6.231 12.908 1038 1HD2 ASN 130 1HD2 ASN 130 -11.315 8.299 13.587 1039 2HD2 ASN 130 2HD2 ASN 130 -11.796 8.969 15.104 1040 H PHE 131 H PHE 131 -11.876 9.519 12.368 1041 HA PHE 131 HA PHE 131 -10.205 9.273 10.023 1042 1HB PHE 131 2HB PHE 131 -9.047 10.962 12.046 1043 2HB PHE 131 1HB PHE 131 -9.679 11.404 10.465 1044 HD1 PHE 131 1HD PHE 131 -12.036 12.071 10.218 1045 HD2 PHE 131 2HD PHE 131 -10.302 11.319 14.031 1046 HE1 PHE 131 1HE PHE 131 -13.905 13.255 11.297 1047 HE2 PHE 131 2HE PHE 131 -12.167 12.499 15.117 1048 HZ PHE 131 HZ PHE 131 -13.972 13.469 13.750 1049 H ASP 132 H ASP 132 -10.015 8.539 13.449 1050 HA ASP 132 HA ASP 132 -7.317 7.930 13.690 1051 1HB ASP 132 2HB ASP 132 -8.668 8.051 15.660 1052 2HB ASP 132 1HB ASP 132 -9.737 6.777 15.085 1053 H GLU 133 H GLU 133 -9.812 6.236 12.020 1054 HA GLU 133 HA GLU 133 -8.903 3.611 12.088 1055 1HB GLU 133 2HB GLU 133 -10.080 4.962 9.658 1056 2HB GLU 133 1HB GLU 133 -10.125 3.248 10.046 1057 1HG GLU 133 2HG GLU 133 -11.314 5.020 12.061 1058 2HG GLU 133 1HG GLU 133 -12.136 4.976 10.501 1059 H THR 134 H THR 134 -7.954 6.269 9.933 1060 HA THR 134 HA THR 134 -6.324 4.942 8.169 1061 HB THR 134 HB THR 134 -4.937 7.029 8.066 1062 HG1 THR 134 1HG THR 134 -5.140 7.680 10.249 1063 1HG2 THR 134 1HG2 THR 134 -6.749 7.020 6.595 1064 2HG2 THR 134 2HG2 THR 134 -6.958 8.525 7.490 1065 3HG2 THR 134 3HG2 THR 134 -7.931 7.113 7.902 1066 H TYR 135 H TYR 135 -5.672 5.810 11.507 1067 HA TYR 135 HA TYR 135 -2.905 5.090 11.425 1068 1HB TYR 135 2HB TYR 135 -4.208 6.632 13.105 1069 2HB TYR 135 1HB TYR 135 -4.473 5.122 13.971 1070 HD1 TYR 135 1HD TYR 135 -3.041 4.875 15.756 1071 HD2 TYR 135 2HD TYR 135 -1.562 6.670 12.192 1072 HE1 TYR 135 1HE TYR 135 -0.817 5.077 16.786 1073 HE2 TYR 135 2HE TYR 135 0.665 6.875 13.214 1074 HH TYR 135 HH TYR 135 1.211 6.416 16.540 1075 H LYS 136 H LYS 136 -5.709 3.575 13.040 1076 HA LYS 136 HA LYS 136 -4.432 1.262 13.875 1077 1HB LYS 136 2HB LYS 136 -6.834 2.154 14.335 1078 2HB LYS 136 1HB LYS 136 -7.279 1.180 12.941 1079 1HG LYS 136 2HG LYS 136 -7.666 -0.069 14.958 1080 2HG LYS 136 1HG LYS 136 -6.340 -0.804 14.056 1081 1HD LYS 136 2HD LYS 136 -5.137 -0.700 15.930 1082 2HD LYS 136 1HD LYS 136 -5.113 1.053 15.728 1083 1HE LYS 136 2HE LYS 136 -6.309 1.289 17.582 1084 2HE LYS 136 1HE LYS 136 -7.609 0.333 16.871 1085 1HZ LYS 136 1HZ LYS 136 -7.138 -1.329 18.235 1086 2HZ LYS 136 2HZ LYS 136 -5.998 -0.353 19.012 1087 3HZ LYS 136 3HZ LYS 136 -5.521 -1.361 17.742 1088 H ILE 137 H ILE 137 -6.296 1.716 10.878 1089 HA ILE 137 HA ILE 137 -5.846 -0.866 9.866 1090 HB ILE 137 HB ILE 137 -6.318 1.530 8.122 1091 1HG1 ILE 137 2HG1 ILE 137 -7.831 1.566 10.135 1092 2HG1 ILE 137 1HG1 ILE 137 -8.663 1.448 8.590 1093 1HG2 ILE 137 1HG2 ILE 137 -5.900 -0.718 7.117 1094 2HG2 ILE 137 2HG2 ILE 137 -7.456 -0.004 6.694 1095 3HG2 ILE 137 3HG2 ILE 137 -7.373 -1.281 7.907 1096 1HD1 ILE 137 1HD1 ILE 137 -8.831 -1.017 8.979 1097 2HD1 ILE 137 2HD1 ILE 137 -9.746 -0.008 10.102 1098 3HD1 ILE 137 3HD1 ILE 137 -8.217 -0.729 10.608 1099 H LEU 138 H LEU 138 -4.233 2.226 8.997 1100 HA LEU 138 HA LEU 138 -2.447 1.034 7.170 1101 1HB LEU 138 2HB LEU 138 -3.082 3.565 7.701 1102 2HB LEU 138 1HB LEU 138 -1.586 3.474 8.611 1103 HG LEU 138 HG LEU 138 -1.096 2.337 6.058 1104 1HD1 LEU 138 1HD1 LEU 138 -1.527 4.683 4.896 1105 2HD1 LEU 138 2HD1 LEU 138 -2.869 4.709 6.040 1106 3HD1 LEU 138 3HD1 LEU 138 -2.724 3.388 4.880 1107 1HD2 LEU 138 1HD2 LEU 138 0.307 3.732 7.795 1108 2HD2 LEU 138 2HD2 LEU 138 -0.213 5.085 6.788 1109 3HD2 LEU 138 3HD2 LEU 138 0.701 3.754 6.076 1110 H SER 139 H SER 139 -1.906 2.051 10.546 1111 HA SER 139 HA SER 139 0.756 1.334 10.753 1112 1HB SER 139 2HB SER 139 -0.876 2.474 12.476 1113 2HB SER 139 1HB SER 139 -1.081 0.822 13.067 1114 HG SER 139 HG SER 139 0.709 2.265 13.935 1115 H LEU 140 H LEU 140 -2.059 -0.678 11.629 1116 HA LEU 140 HA LEU 140 -0.614 -3.002 12.229 1117 1HB LEU 140 2HB LEU 140 -3.292 -2.217 12.204 1118 2HB LEU 140 1HB LEU 140 -3.214 -3.574 11.096 1119 HG LEU 140 HG LEU 140 -1.876 -4.683 13.100 1120 1HD1 LEU 140 1HD1 LEU 140 -2.012 -2.550 14.420 1121 2HD1 LEU 140 2HD1 LEU 140 -2.603 -3.990 15.249 1122 3HD1 LEU 140 3HD1 LEU 140 -3.747 -2.835 14.563 1123 1HD2 LEU 140 1HD2 LEU 140 -4.425 -4.881 12.039 1124 2HD2 LEU 140 2HD2 LEU 140 -4.693 -4.718 13.774 1125 3HD2 LEU 140 3HD2 LEU 140 -3.663 -6.010 13.161 1126 H ALA 141 H ALA 141 -2.408 -2.216 9.244 1127 HA ALA 141 HA ALA 141 -1.731 -4.474 7.786 1128 1HB ALA 141 1HB ALA 141 -3.404 -2.641 7.212 1129 2HB ALA 141 2HB ALA 141 -2.498 -3.355 5.878 1130 3HB ALA 141 3HB ALA 141 -2.037 -1.774 6.511 1131 H CYS 142 H CYS 142 0.003 -1.385 7.991 1132 HA CYS 142 HA CYS 142 1.988 -1.924 6.101 1133 1HB CYS 142 2HB CYS 142 1.549 0.312 7.107 1134 2HB CYS 142 1HB CYS 142 2.276 -0.254 8.608 1135 HG CYS 142 HG CYS 142 4.395 -0.830 6.189 1136 H LYS 143 H LYS 143 1.735 -2.784 9.507 1137 HA LYS 143 HA LYS 143 4.404 -3.670 9.837 1138 1HB LYS 143 2HB LYS 143 2.725 -3.153 11.666 1139 2HB LYS 143 1HB LYS 143 1.991 -4.713 11.321 1140 1HG LYS 143 2HG LYS 143 4.167 -5.790 11.827 1141 2HG LYS 143 1HG LYS 143 4.791 -4.209 12.304 1142 1HD LYS 143 2HD LYS 143 2.283 -4.709 13.610 1143 2HD LYS 143 1HD LYS 143 3.389 -6.056 13.891 1144 1HE LYS 143 2HE LYS 143 4.471 -4.849 15.406 1145 2HE LYS 143 1HE LYS 143 4.867 -3.657 14.168 1146 1HZ LYS 143 1HZ LYS 143 3.706 -2.342 15.575 1147 2HZ LYS 143 2HZ LYS 143 2.767 -3.606 16.191 1148 3HZ LYS 143 3HZ LYS 143 2.391 -2.931 14.687 1149 H ASN 144 H ASN 144 1.444 -5.656 9.585 1150 HA ASN 144 HA ASN 144 2.726 -8.093 9.204 1151 1HB ASN 144 2HB ASN 144 0.640 -8.978 8.808 1152 2HB ASN 144 1HB ASN 144 0.179 -7.457 9.565 1153 1HD2 ASN 144 1HD2 ASN 144 -1.047 -6.062 8.463 1154 2HD2 ASN 144 2HD2 ASN 144 -1.527 -6.256 6.815 1155 H LEU 145 H LEU 145 1.751 -5.650 6.862 1156 HA LEU 145 HA LEU 145 2.323 -7.110 4.528 1157 1HB LEU 145 2HB LEU 145 1.819 -4.302 5.227 1158 2HB LEU 145 1HB LEU 145 2.843 -4.516 3.821 1159 HG LEU 145 HG LEU 145 0.467 -4.251 3.230 1160 1HD1 LEU 145 1HD1 LEU 145 1.977 -6.725 2.566 1161 2HD1 LEU 145 2HD1 LEU 145 1.543 -5.356 1.543 1162 3HD1 LEU 145 3HD1 LEU 145 0.324 -6.554 1.979 1163 1HD2 LEU 145 1HD2 LEU 145 -1.071 -5.207 4.518 1164 2HD2 LEU 145 2HD2 LEU 145 0.135 -6.228 5.303 1165 3HD2 LEU 145 3HD2 LEU 145 -0.619 -6.753 3.798 1166 H LEU 146 H LEU 146 4.292 -4.794 6.379 1167 HA LEU 146 HA LEU 146 6.568 -4.752 4.830 1168 1HB LEU 146 2HB LEU 146 6.388 -3.292 6.702 1169 2HB LEU 146 1HB LEU 146 6.228 -4.632 7.820 1170 HG LEU 146 HG LEU 146 8.687 -5.126 6.727 1171 1HD1 LEU 146 1HD1 LEU 146 8.876 -3.131 5.485 1172 2HD1 LEU 146 2HD1 LEU 146 9.848 -2.888 6.936 1173 3HD1 LEU 146 3HD1 LEU 146 8.249 -2.154 6.812 1174 1HD2 LEU 146 1HD2 LEU 146 8.325 -3.330 9.106 1175 2HD2 LEU 146 2HD2 LEU 146 9.536 -4.585 8.842 1176 3HD2 LEU 146 3HD2 LEU 146 7.857 -5.030 9.144 1177 H VAL 147 H VAL 147 5.575 -7.150 7.218 1178 HA VAL 147 HA VAL 147 7.960 -8.663 7.206 1179 HB VAL 147 HB VAL 147 5.134 -9.530 7.830 1180 1HG1 VAL 147 1HG1 VAL 147 6.891 -11.330 7.256 1181 2HG1 VAL 147 2HG1 VAL 147 5.949 -11.507 8.737 1182 3HG1 VAL 147 3HG1 VAL 147 7.606 -10.906 8.811 1183 1HG2 VAL 147 1HG2 VAL 147 6.445 -9.409 10.198 1184 2HG2 VAL 147 2HG2 VAL 147 5.460 -8.103 9.539 1185 3HG2 VAL 147 3HG2 VAL 147 7.211 -8.083 9.322 1186 H PHE 148 H PHE 148 4.878 -9.177 5.481 1187 HA PHE 148 HA PHE 148 5.718 -11.459 4.059 1188 1HB PHE 148 2HB PHE 148 3.345 -10.086 4.381 1189 2HB PHE 148 1HB PHE 148 3.715 -9.848 2.676 1190 HD1 PHE 148 1HD PHE 148 3.742 -11.705 1.136 1191 HD2 PHE 148 2HD PHE 148 2.885 -12.292 5.264 1192 HE1 PHE 148 1HE PHE 148 2.882 -13.956 0.635 1193 HE2 PHE 148 2HE PHE 148 2.024 -14.542 4.770 1194 HZ PHE 148 HZ PHE 148 2.022 -15.378 2.452 1195 H LEU 149 H LEU 149 5.394 -8.091 2.936 1196 HA LEU 149 HA LEU 149 6.330 -8.453 0.352 1197 1HB LEU 149 2HB LEU 149 6.824 -5.983 2.006 1198 2HB LEU 149 1HB LEU 149 6.676 -6.084 0.261 1199 HG LEU 149 HG LEU 149 4.337 -6.951 1.876 1200 1HD1 LEU 149 1HD1 LEU 149 4.736 -4.039 1.318 1201 2HD1 LEU 149 2HD1 LEU 149 5.316 -4.755 2.821 1202 3HD1 LEU 149 3HD1 LEU 149 3.600 -4.820 2.416 1203 1HD2 LEU 149 1HD2 LEU 149 3.574 -7.023 -0.215 1204 2HD2 LEU 149 2HD2 LEU 149 4.970 -6.140 -0.831 1205 3HD2 LEU 149 3HD2 LEU 149 3.587 -5.260 -0.184 1206 H SER 150 H SER 150 8.134 -7.986 3.344 1207 HA SER 150 HA SER 150 10.660 -7.845 1.915 1208 1HB SER 150 2HB SER 150 9.858 -6.763 4.275 1209 2HB SER 150 1HB SER 150 10.705 -8.199 4.848 1210 HG SER 150 HG SER 150 12.290 -7.251 3.067 1211 H LYS 151 H LYS 151 8.615 -10.266 2.902 1212 HA LYS 151 HA LYS 151 8.792 -12.518 3.153 1213 1HB LYS 151 2HB LYS 151 9.855 -12.313 0.938 1214 2HB LYS 151 1HB LYS 151 11.419 -12.105 1.713 1215 1HG LYS 151 2HG LYS 151 10.877 -14.404 2.806 1216 2HG LYS 151 1HG LYS 151 9.737 -14.555 1.467 1217 1HD LYS 151 2HD LYS 151 11.373 -14.947 -0.007 1218 2HD LYS 151 1HD LYS 151 12.352 -13.613 0.608 1219 1HE LYS 151 2HE LYS 151 12.363 -15.669 2.559 1220 2HE LYS 151 1HE LYS 151 12.698 -16.413 0.996 1221 1HZ LYS 151 1HZ LYS 151 14.723 -15.675 2.103 1222 2HZ LYS 151 2HZ LYS 151 14.150 -14.084 2.132 1223 3HZ LYS 151 3HZ LYS 151 14.484 -14.835 0.654 1224 H HIS 152 H HIS 152 8.948 -12.320 5.441 1225 HA HIS 152 HA HIS 152 11.377 -12.039 6.838 1226 1HB HIS 152 2HB HIS 152 8.977 -11.811 7.724 1227 2HB HIS 152 1HB HIS 152 9.004 -13.562 7.894 1228 HD1 HIS 152 1HD HIS 152 12.003 -13.712 8.906 1229 HD2 HIS 152 2HD HIS 152 9.025 -11.245 10.425 1230 HE1 HIS 152 1HE HIS 152 12.717 -13.165 11.254 1231 HE2 HIS 152 2HE HIS 152 10.848 -11.757 12.189 1232 H HIS 153 H HIS 153 9.412 -15.003 6.520 1233 HA HIS 153 HA HIS 153 9.966 -17.204 6.455 1234 1HB HIS 153 2HB HIS 153 11.360 -16.192 4.480 1235 2HB HIS 153 1HB HIS 153 12.735 -16.522 5.529 1236 HD1 HIS 153 1HD HIS 153 10.947 -18.019 2.882 1237 HD2 HIS 153 2HD HIS 153 12.527 -19.436 6.454 1238 HE1 HIS 153 1HE HIS 153 11.170 -20.506 2.579 1239 HE2 HIS 153 2HE HIS 153 12.051 -21.351 4.783 1240 H HIS 154 H HIS 154 13.342 -16.437 6.942 1241 HA HIS 154 HA HIS 154 14.787 -16.801 8.653 1242 1HB HIS 154 2HB HIS 154 12.783 -15.384 9.789 1243 2HB HIS 154 1HB HIS 154 12.721 -16.847 10.767 1244 HD1 HIS 154 1HD HIS 154 15.165 -17.530 11.833 1245 HD2 HIS 154 2HD HIS 154 14.629 -13.588 10.630 1246 HE1 HIS 154 1HE HIS 154 16.964 -16.218 13.004 1247 HE2 HIS 154 2HE HIS 154 16.651 -13.844 12.222 1248 H HIS 155 H HIS 155 15.721 -18.550 9.551 1249 HA HIS 155 HA HIS 155 16.079 -20.702 10.173 1250 1HB HIS 155 2HB HIS 155 13.139 -20.690 10.885 1251 2HB HIS 155 1HB HIS 155 14.317 -21.893 11.399 1252 HD1 HIS 155 1HD HIS 155 12.679 -18.984 12.599 1253 HD2 HIS 155 2HD HIS 155 16.535 -20.492 12.933 1254 HE1 HIS 155 1HE HIS 155 13.679 -17.834 14.599 1255 HE2 HIS 155 2HE HIS 155 16.044 -18.692 14.724 1256 H HIS 156 H HIS 156 16.353 -22.476 8.984 1257 HA HIS 156 HA HIS 156 14.334 -23.089 6.926 1258 1HB HIS 156 2HB HIS 156 16.673 -24.170 5.954 1259 2HB HIS 156 1HB HIS 156 15.968 -22.641 5.444 1260 HD1 HIS 156 1HD HIS 156 17.493 -20.705 5.600 1261 HD2 HIS 156 2HD HIS 156 18.573 -23.735 8.230 1262 HE1 HIS 156 1HE HIS 156 19.615 -19.919 6.694 1263 HE2 HIS 156 2HE HIS 156 20.301 -21.811 8.211 Start of MODEL 10 1 1H MET 1 1HT MET 1 16.723 -10.350 -7.711 2 2H MET 1 2HT MET 1 17.057 -9.134 -6.585 3 3H MET 1 3HT MET 1 17.831 -9.127 -8.089 4 HA MET 1 HA MET 1 16.107 -7.473 -8.071 5 1HB MET 1 2HB MET 1 16.251 -9.753 -9.854 6 2HB MET 1 1HB MET 1 14.630 -9.072 -9.834 7 1HG MET 1 2HG MET 1 15.486 -6.902 -10.434 8 2HG MET 1 1HG MET 1 17.143 -7.497 -10.337 9 1HE MET 1 1HE MET 1 15.637 -6.763 -14.124 10 2HE MET 1 2HE MET 1 16.977 -6.213 -13.119 11 3HE MET 1 3HE MET 1 15.315 -6.000 -12.567 12 H LYS 2 H LYS 2 14.495 -6.856 -6.795 13 HA LYS 2 HA LYS 2 12.165 -8.568 -6.494 14 1HB LYS 2 2HB LYS 2 14.119 -8.165 -4.389 15 2HB LYS 2 1HB LYS 2 12.529 -7.592 -3.905 16 1HG LYS 2 2HG LYS 2 12.180 -9.713 -3.303 17 2HG LYS 2 1HG LYS 2 11.916 -9.990 -5.026 18 1HD LYS 2 2HD LYS 2 14.105 -10.802 -5.336 19 2HD LYS 2 1HD LYS 2 14.643 -10.174 -3.776 20 1HE LYS 2 2HE LYS 2 12.617 -12.375 -4.156 21 2HE LYS 2 1HE LYS 2 14.319 -12.624 -3.772 22 1HZ LYS 2 1HZ LYS 2 12.157 -11.629 -2.075 23 2HZ LYS 2 2HZ LYS 2 13.705 -10.999 -1.815 24 3HZ LYS 2 3HZ LYS 2 13.439 -12.665 -1.694 25 H LYS 3 H LYS 3 10.523 -7.329 -7.047 26 HA LYS 3 HA LYS 3 10.446 -4.557 -6.063 27 1HB LYS 3 2HB LYS 3 10.271 -5.557 -8.818 28 2HB LYS 3 1HB LYS 3 8.975 -4.455 -8.376 29 1HG LYS 3 2HG LYS 3 11.678 -3.588 -7.609 30 2HG LYS 3 1HG LYS 3 11.364 -3.675 -9.343 31 1HD LYS 3 2HD LYS 3 9.121 -2.439 -8.552 32 2HD LYS 3 1HD LYS 3 10.221 -1.879 -7.290 33 1HE LYS 3 2HE LYS 3 10.518 -0.251 -8.884 34 2HE LYS 3 1HE LYS 3 11.804 -1.378 -9.311 35 1HZ LYS 3 1HZ LYS 3 10.924 -1.390 -11.334 36 2HZ LYS 3 2HZ LYS 3 9.529 -0.575 -10.830 37 3HZ LYS 3 3HZ LYS 3 9.618 -2.259 -10.700 38 H ILE 4 H ILE 4 8.652 -4.045 -4.986 39 HA ILE 4 HA ILE 4 6.340 -5.863 -5.220 40 HB ILE 4 HB ILE 4 6.337 -4.285 -2.792 41 1HG1 ILE 4 2HG1 ILE 4 8.816 -4.502 -3.106 42 2HG1 ILE 4 1HG1 ILE 4 8.208 -5.274 -1.646 43 1HG2 ILE 4 1HG2 ILE 4 6.135 -6.627 -1.820 44 2HG2 ILE 4 2HG2 ILE 4 6.171 -7.199 -3.488 45 3HG2 ILE 4 3HG2 ILE 4 4.885 -6.118 -2.955 46 1HD1 ILE 4 1HD1 ILE 4 8.162 -7.263 -3.603 47 2HD1 ILE 4 2HD1 ILE 4 9.296 -7.099 -2.263 48 3HD1 ILE 4 3HD1 ILE 4 9.684 -6.401 -3.835 49 H LEU 5 H LEU 5 4.684 -4.951 -6.234 50 HA LEU 5 HA LEU 5 4.393 -2.040 -6.157 51 1HB LEU 5 2HB LEU 5 4.082 -3.950 -8.193 52 2HB LEU 5 1HB LEU 5 2.471 -3.357 -7.839 53 HG LEU 5 HG LEU 5 4.826 -1.598 -8.524 54 1HD1 LEU 5 1HD1 LEU 5 2.981 -3.103 -10.187 55 2HD1 LEU 5 2HD1 LEU 5 4.473 -2.267 -10.617 56 3HD1 LEU 5 3HD1 LEU 5 2.956 -1.373 -10.530 57 1HD2 LEU 5 1HD2 LEU 5 1.892 -0.923 -8.377 58 2HD2 LEU 5 2HD2 LEU 5 3.234 0.184 -8.663 59 3HD2 LEU 5 3HD2 LEU 5 3.051 -0.591 -7.090 60 H PHE 6 H PHE 6 3.138 -1.301 -4.564 61 HA PHE 6 HA PHE 6 0.894 -2.911 -3.619 62 1HB PHE 6 2HB PHE 6 1.701 -0.233 -2.501 63 2HB PHE 6 1HB PHE 6 0.829 -1.534 -1.703 64 HD1 PHE 6 1HD PHE 6 4.066 -0.164 -2.539 65 HD2 PHE 6 2HD PHE 6 2.057 -3.554 -0.926 66 HE1 PHE 6 1HE PHE 6 6.178 -0.944 -1.552 67 HE2 PHE 6 2HE PHE 6 4.166 -4.338 0.061 68 HZ PHE 6 HZ PHE 6 6.231 -3.035 -0.252 69 H ILE 7 H ILE 7 -1.029 -2.639 -4.516 70 HA ILE 7 HA ILE 7 -1.632 -0.101 -5.863 71 HB ILE 7 HB ILE 7 -3.201 -2.663 -6.094 72 1HG1 ILE 7 2HG1 ILE 7 -1.691 -2.273 -8.433 73 2HG1 ILE 7 1HG1 ILE 7 -0.562 -2.054 -7.099 74 1HG2 ILE 7 1HG2 ILE 7 -4.560 -1.444 -7.351 75 2HG2 ILE 7 2HG2 ILE 7 -3.222 -1.082 -8.442 76 3HG2 ILE 7 3HG2 ILE 7 -3.556 -0.019 -7.073 77 1HD1 ILE 7 1HD1 ILE 7 -2.339 -4.393 -6.910 78 2HD1 ILE 7 2HD1 ILE 7 -0.628 -4.225 -6.519 79 3HD1 ILE 7 3HD1 ILE 7 -1.133 -4.429 -8.196 80 H CYS 8 H CYS 8 -2.965 1.297 -4.938 81 HA CYS 8 HA CYS 8 -5.023 0.292 -3.098 82 1HB CYS 8 2HB CYS 8 -3.069 2.530 -2.650 83 2HB CYS 8 1HB CYS 8 -4.615 2.494 -1.812 84 HG CYS 8 HG CYS 8 -3.210 -0.439 -1.469 85 H LEU 9 H LEU 9 -7.005 1.110 -3.370 86 HA LEU 9 HA LEU 9 -7.503 2.785 -5.645 87 1HB LEU 9 2HB LEU 9 -8.944 0.891 -4.196 88 2HB LEU 9 1HB LEU 9 -9.777 2.402 -3.885 89 HG LEU 9 HG LEU 9 -9.433 2.502 -6.601 90 1HD1 LEU 9 1HD1 LEU 9 -10.279 -0.320 -6.045 91 2HD1 LEU 9 2HD1 LEU 9 -8.595 0.091 -6.368 92 3HD1 LEU 9 3HD1 LEU 9 -9.832 0.424 -7.580 93 1HD2 LEU 9 1HD2 LEU 9 -11.585 2.946 -6.302 94 2HD2 LEU 9 2HD2 LEU 9 -11.553 2.192 -4.708 95 3HD2 LEU 9 3HD2 LEU 9 -11.896 1.218 -6.137 96 H GLY 10 H GLY 10 -6.617 4.804 -5.209 97 1HA GLY 10 2HA GLY 10 -8.012 6.882 -4.409 98 2HA GLY 10 1HA GLY 10 -7.561 6.241 -2.836 99 H ASN 11 H ASN 11 -4.995 5.563 -3.026 100 HA ASN 11 HA ASN 11 -2.912 6.466 -2.828 101 1HB ASN 11 2HB ASN 11 -3.381 6.234 -5.419 102 2HB ASN 11 1HB ASN 11 -3.295 7.993 -5.363 103 1HD2 ASN 11 1HD2 ASN 11 -1.554 5.088 -5.414 104 2HD2 ASN 11 2HD2 ASN 11 0.030 5.753 -5.234 105 H ILE 12 H ILE 12 -5.320 8.073 -1.959 106 HA ILE 12 HA ILE 12 -3.876 10.601 -1.575 107 HB ILE 12 HB ILE 12 -5.907 11.892 -1.874 108 1HG1 ILE 12 2HG1 ILE 12 -7.350 9.500 -2.952 109 2HG1 ILE 12 1HG1 ILE 12 -7.336 9.785 -1.214 110 1HG2 ILE 12 1HG2 ILE 12 -5.789 11.994 -4.140 111 2HG2 ILE 12 2HG2 ILE 12 -5.938 10.248 -4.337 112 3HG2 ILE 12 3HG2 ILE 12 -4.396 10.952 -3.854 113 1HD1 ILE 12 1HD1 ILE 12 -7.992 12.194 -2.623 114 2HD1 ILE 12 2HD1 ILE 12 -8.909 11.321 -1.397 115 3HD1 ILE 12 3HD1 ILE 12 -9.065 10.877 -3.097 116 H CYS 13 H CYS 13 -4.785 8.024 -0.051 117 HA CYS 13 HA CYS 13 -5.462 9.460 2.395 118 1HB CYS 13 2HB CYS 13 -7.010 7.124 2.511 119 2HB CYS 13 1HB CYS 13 -7.586 8.783 2.383 120 HG CYS 13 HG CYS 13 -8.773 6.927 0.487 121 H ARG 14 H ARG 14 -5.657 5.982 1.805 122 HA ARG 14 HA ARG 14 -3.789 5.494 3.936 123 1HB ARG 14 2HB ARG 14 -4.430 3.257 3.827 124 2HB ARG 14 1HB ARG 14 -5.883 4.117 3.340 125 1HG ARG 14 2HG ARG 14 -5.641 3.502 1.104 126 2HG ARG 14 1HG ARG 14 -3.943 3.071 1.311 127 1HD ARG 14 2HD ARG 14 -6.395 1.539 1.997 128 2HD ARG 14 1HD ARG 14 -4.885 0.987 1.275 129 HE ARG 14 HE ARG 14 -5.463 1.286 4.111 130 1HH1 ARG 14 1HH1 ARG 14 -3.108 0.659 1.620 131 2HH1 ARG 14 2HH1 ARG 14 -1.972 -0.077 2.701 132 1HH2 ARG 14 1HH2 ARG 14 -3.971 0.319 5.541 133 2HH2 ARG 14 2HH2 ARG 14 -2.462 -0.271 4.927 134 H SER 15 H SER 15 -3.767 5.173 0.418 135 HA SER 15 HA SER 15 -1.369 3.769 0.168 136 1HB SER 15 2HB SER 15 -2.595 3.864 -1.798 137 2HB SER 15 1HB SER 15 -2.881 5.598 -1.655 138 HG SER 15 HG SER 15 -0.317 4.480 -2.107 139 HA PRO 16 HA PRO 16 0.872 8.092 -0.235 140 1HB PRO 16 2HB PRO 16 -0.300 10.076 1.267 141 2HB PRO 16 1HB PRO 16 -0.518 9.893 -0.477 142 1HG PRO 16 2HG PRO 16 -2.301 9.014 1.759 143 2HG PRO 16 1HG PRO 16 -2.731 9.762 0.209 144 1HD PRO 16 2HD PRO 16 -3.007 7.125 0.619 145 2HD PRO 16 1HD PRO 16 -2.505 7.772 -0.959 146 H MET 17 H MET 17 -1.009 7.373 2.672 147 HA MET 17 HA MET 17 0.870 8.181 4.587 148 1HB MET 17 2HB MET 17 -1.665 7.025 4.605 149 2HB MET 17 1HB MET 17 -0.642 5.827 5.387 150 1HG MET 17 2HG MET 17 -0.687 8.718 6.195 151 2HG MET 17 1HG MET 17 -1.749 7.500 6.900 152 1HE MET 17 1HE MET 17 -1.303 7.123 9.127 153 2HE MET 17 2HE MET 17 0.158 6.397 9.799 154 3HE MET 17 3HE MET 17 -0.807 5.509 8.618 155 H ALA 18 H ALA 18 0.174 4.890 3.404 156 HA ALA 18 HA ALA 18 2.455 3.732 4.632 157 1HB ALA 18 1HB ALA 18 0.467 2.424 4.046 158 2HB ALA 18 2HB ALA 18 1.927 1.752 3.322 159 3HB ALA 18 3HB ALA 18 0.804 2.685 2.335 160 H GLU 19 H GLU 19 2.055 5.633 1.850 161 HA GLU 19 HA GLU 19 4.120 4.566 0.223 162 1HB GLU 19 2HB GLU 19 2.344 6.111 -0.595 163 2HB GLU 19 1HB GLU 19 3.092 7.411 0.322 164 1HG GLU 19 2HG GLU 19 4.795 7.657 -1.146 165 2HG GLU 19 1HG GLU 19 4.825 5.945 -1.569 166 H PHE 20 H PHE 20 4.019 7.300 2.503 167 HA PHE 20 HA PHE 20 6.816 7.828 2.283 168 1HB PHE 20 2HB PHE 20 5.222 9.582 2.948 169 2HB PHE 20 1HB PHE 20 4.856 8.698 4.427 170 HD1 PHE 20 1HD PHE 20 7.574 10.419 2.591 171 HD2 PHE 20 2HD PHE 20 6.180 8.971 6.342 172 HE1 PHE 20 1HE PHE 20 9.428 11.576 3.722 173 HE2 PHE 20 2HE PHE 20 8.029 10.127 7.480 174 HZ PHE 20 HZ PHE 20 9.656 11.433 6.170 175 H ILE 21 H ILE 21 4.801 5.958 4.506 176 HA ILE 21 HA ILE 21 6.792 5.452 6.442 177 HB ILE 21 HB ILE 21 4.421 3.729 5.707 178 1HG1 ILE 21 2HG1 ILE 21 4.686 5.781 7.914 179 2HG1 ILE 21 1HG1 ILE 21 3.885 6.084 6.376 180 1HG2 ILE 21 1HG2 ILE 21 4.973 2.325 7.347 181 2HG2 ILE 21 2HG2 ILE 21 5.325 3.644 8.463 182 3HG2 ILE 21 3HG2 ILE 21 6.562 3.091 7.334 183 1HD1 ILE 21 1HD1 ILE 21 2.907 4.745 8.747 184 2HD1 ILE 21 2HD1 ILE 21 2.679 3.780 7.289 185 3HD1 ILE 21 3HD1 ILE 21 2.023 5.415 7.377 186 H MET 22 H MET 22 5.608 3.370 3.800 187 HA MET 22 HA MET 22 7.427 1.293 4.148 188 1HB MET 22 2HB MET 22 5.940 2.269 1.720 189 2HB MET 22 1HB MET 22 6.986 0.857 1.665 190 1HG MET 22 2HG MET 22 5.141 0.731 3.886 191 2HG MET 22 1HG MET 22 4.304 0.919 2.347 192 1HE MET 22 1HE MET 22 7.104 -2.399 3.667 193 2HE MET 22 2HE MET 22 5.665 -2.103 4.641 194 3HE MET 22 3HE MET 22 6.837 -0.810 4.384 195 H LYS 23 H LYS 23 7.634 4.069 1.924 196 HA LYS 23 HA LYS 23 10.109 3.453 0.800 197 1HB LYS 23 2HB LYS 23 8.401 5.262 0.134 198 2HB LYS 23 1HB LYS 23 9.217 6.279 1.315 199 1HG LYS 23 2HG LYS 23 11.235 6.243 0.103 200 2HG LYS 23 1HG LYS 23 10.686 4.913 -0.919 201 1HD LYS 23 2HD LYS 23 8.779 6.647 -1.522 202 2HD LYS 23 1HD LYS 23 10.014 7.809 -1.033 203 1HE LYS 23 2HE LYS 23 10.839 5.634 -2.870 204 2HE LYS 23 1HE LYS 23 9.798 6.896 -3.529 205 1HZ LYS 23 1HZ LYS 23 11.573 8.398 -2.293 206 2HZ LYS 23 2HZ LYS 23 11.796 7.864 -3.882 207 3HZ LYS 23 3HZ LYS 23 12.559 7.058 -2.606 208 H ASP 24 H ASP 24 9.324 5.056 3.823 209 HA ASP 24 HA ASP 24 11.877 6.105 4.386 210 1HB ASP 24 2HB ASP 24 9.707 6.669 5.564 211 2HB ASP 24 1HB ASP 24 9.878 5.151 6.440 212 H LEU 25 H LEU 25 10.331 3.187 5.728 213 HA LEU 25 HA LEU 25 12.696 2.199 6.915 214 1HB LEU 25 2HB LEU 25 11.418 0.476 7.674 215 2HB LEU 25 1HB LEU 25 10.144 1.614 7.277 216 HG LEU 25 HG LEU 25 10.492 0.198 4.921 217 1HD1 LEU 25 1HD1 LEU 25 11.923 -1.397 6.164 218 2HD1 LEU 25 2HD1 LEU 25 10.462 -2.133 5.507 219 3HD1 LEU 25 3HD1 LEU 25 10.557 -1.744 7.224 220 1HD2 LEU 25 1HD2 LEU 25 8.527 -0.113 7.181 221 2HD2 LEU 25 2HD2 LEU 25 8.340 -0.890 5.608 222 3HD2 LEU 25 3HD2 LEU 25 8.358 0.870 5.727 223 H VAL 26 H VAL 26 11.513 2.103 3.697 224 HA VAL 26 HA VAL 26 12.812 -0.267 2.841 225 HB VAL 26 HB VAL 26 11.426 1.987 1.515 226 1HG1 VAL 26 1HG1 VAL 26 13.575 0.393 0.165 227 2HG1 VAL 26 2HG1 VAL 26 13.265 2.126 0.092 228 3HG1 VAL 26 3HG1 VAL 26 12.190 1.003 -0.740 229 1HG2 VAL 26 1HG2 VAL 26 10.131 0.075 1.975 230 2HG2 VAL 26 2HG2 VAL 26 11.373 -1.013 1.355 231 3HG2 VAL 26 3HG2 VAL 26 10.464 0.011 0.244 232 H LYS 27 H LYS 27 13.695 3.166 2.545 233 HA LYS 27 HA LYS 27 16.040 2.887 1.121 234 1HB LYS 27 2HB LYS 27 14.910 4.911 2.945 235 2HB LYS 27 1HB LYS 27 16.653 4.984 2.724 236 1HG LYS 27 2HG LYS 27 15.644 4.689 0.156 237 2HG LYS 27 1HG LYS 27 14.530 5.804 0.950 238 1HD LYS 27 2HD LYS 27 16.565 7.094 1.715 239 2HD LYS 27 1HD LYS 27 17.509 6.084 0.618 240 1HE LYS 27 2HE LYS 27 15.132 7.718 -0.247 241 2HE LYS 27 1HE LYS 27 16.794 8.304 -0.315 242 1HZ LYS 27 1HZ LYS 27 15.936 7.335 -2.425 243 2HZ LYS 27 2HZ LYS 27 15.878 5.826 -1.662 244 3HZ LYS 27 3HZ LYS 27 17.361 6.617 -1.862 245 H LYS 28 H LYS 28 15.611 2.715 4.644 246 HA LYS 28 HA LYS 28 18.355 2.564 5.243 247 1HB LYS 28 2HB LYS 28 17.639 1.852 7.483 248 2HB LYS 28 1HB LYS 28 16.768 3.265 6.906 249 1HG LYS 28 2HG LYS 28 14.893 2.220 7.441 250 2HG LYS 28 1HG LYS 28 15.212 1.098 6.116 251 1HD LYS 28 2HD LYS 28 15.812 -0.567 7.508 252 2HD LYS 28 1HD LYS 28 16.683 0.522 8.591 253 1HE LYS 28 2HE LYS 28 14.297 1.325 9.253 254 2HE LYS 28 1HE LYS 28 13.786 -0.216 8.566 255 1HZ LYS 28 1HZ LYS 28 14.925 0.293 11.090 256 2HZ LYS 28 2HZ LYS 28 15.954 -0.735 10.227 257 3HZ LYS 28 3HZ LYS 28 14.338 -1.169 10.471 258 H ALA 29 H ALA 29 15.960 -0.147 5.199 259 HA ALA 29 HA ALA 29 18.284 -1.921 4.828 260 1HB ALA 29 1HB ALA 29 17.156 -1.775 7.191 261 2HB ALA 29 2HB ALA 29 17.730 -3.309 6.537 262 3HB ALA 29 3HB ALA 29 16.015 -2.906 6.462 263 H ASN 30 H ASN 30 16.231 -1.013 2.803 264 HA ASN 30 HA ASN 30 15.353 -3.731 2.080 265 1HB ASN 30 2HB ASN 30 13.704 -1.441 2.551 266 2HB ASN 30 1HB ASN 30 13.596 -1.879 0.850 267 1HD2 ASN 30 1HD2 ASN 30 12.021 -3.221 0.413 268 2HD2 ASN 30 2HD2 ASN 30 11.387 -4.437 1.464 269 H LEU 31 H LEU 31 15.549 -0.492 0.618 270 HA LEU 31 HA LEU 31 16.168 -1.571 -1.960 271 1HB LEU 31 2HB LEU 31 15.576 0.459 -2.656 272 2HB LEU 31 1HB LEU 31 15.254 0.871 -0.985 273 HG LEU 31 HG LEU 31 17.868 1.428 -1.028 274 1HD1 LEU 31 1HD1 LEU 31 18.512 0.984 -3.190 275 2HD1 LEU 31 2HD1 LEU 31 18.106 2.697 -3.302 276 3HD1 LEU 31 3HD1 LEU 31 16.962 1.480 -3.868 277 1HD2 LEU 31 1HD2 LEU 31 16.556 3.664 -2.222 278 2HD2 LEU 31 2HD2 LEU 31 17.016 3.416 -0.538 279 3HD2 LEU 31 3HD2 LEU 31 15.443 2.864 -1.113 280 H GLU 32 H GLU 32 18.015 -0.516 0.777 281 HA GLU 32 HA GLU 32 20.460 -0.016 -0.519 282 1HB GLU 32 2HB GLU 32 19.619 -0.632 2.264 283 2HB GLU 32 1HB GLU 32 21.314 -0.881 1.870 284 1HG GLU 32 2HG GLU 32 19.871 1.697 1.325 285 2HG GLU 32 1HG GLU 32 20.712 1.362 2.837 286 H LYS 33 H LYS 33 18.713 -2.853 -0.025 287 HA LYS 33 HA LYS 33 21.060 -4.565 -0.378 288 1HB LYS 33 2HB LYS 33 18.939 -4.908 1.255 289 2HB LYS 33 1HB LYS 33 18.351 -5.753 -0.171 290 1HG LYS 33 2HG LYS 33 20.344 -7.170 -0.153 291 2HG LYS 33 1HG LYS 33 20.923 -6.328 1.286 292 1HD LYS 33 2HD LYS 33 19.079 -7.125 2.582 293 2HD LYS 33 1HD LYS 33 18.284 -7.776 1.147 294 1HE LYS 33 2HE LYS 33 20.208 -9.326 0.860 295 2HE LYS 33 1HE LYS 33 20.859 -8.735 2.388 296 1HZ LYS 33 1HZ LYS 33 18.155 -9.507 2.705 297 2HZ LYS 33 2HZ LYS 33 19.529 -10.100 3.492 298 3HZ LYS 33 3HZ LYS 33 19.035 -10.780 2.024 299 H GLU 34 H GLU 34 18.245 -3.332 -1.952 300 HA GLU 34 HA GLU 34 18.508 -3.171 -4.439 301 1HB GLU 34 2HB GLU 34 18.732 -5.119 -5.747 302 2HB GLU 34 1HB GLU 34 19.919 -5.295 -4.462 303 1HG GLU 34 2HG GLU 34 17.990 -6.585 -3.263 304 2HG GLU 34 1HG GLU 34 17.366 -6.760 -4.902 305 H PHE 35 H PHE 35 16.466 -3.496 -2.175 306 HA PHE 35 HA PHE 35 14.266 -4.694 -3.697 307 1HB PHE 35 2HB PHE 35 14.619 -3.977 -0.802 308 2HB PHE 35 1HB PHE 35 13.015 -4.254 -1.470 309 HD1 PHE 35 1HD PHE 35 12.150 -6.368 -1.323 310 HD2 PHE 35 2HD PHE 35 16.377 -5.877 -1.411 311 HE1 PHE 35 1HE PHE 35 12.435 -8.791 -1.003 312 HE2 PHE 35 2HE PHE 35 16.669 -8.300 -1.093 313 HZ PHE 35 HZ PHE 35 14.695 -9.760 -0.889 314 H PHE 36 H PHE 36 13.081 -3.427 -4.929 315 HA PHE 36 HA PHE 36 12.776 -0.596 -4.183 316 1HB PHE 36 2HB PHE 36 12.217 -1.784 -6.901 317 2HB PHE 36 1HB PHE 36 12.431 -0.087 -6.484 318 HD1 PHE 36 1HD PHE 36 14.082 -3.209 -7.309 319 HD2 PHE 36 2HD PHE 36 14.671 0.791 -5.980 320 HE1 PHE 36 1HE PHE 36 16.471 -3.379 -7.870 321 HE2 PHE 36 2HE PHE 36 17.062 0.628 -6.539 322 HZ PHE 36 HZ PHE 36 17.965 -1.459 -7.485 323 H ILE 37 H ILE 37 10.787 0.267 -3.875 324 HA ILE 37 HA ILE 37 8.489 -1.559 -4.144 325 HB ILE 37 HB ILE 37 7.441 -0.360 -2.271 326 1HG1 ILE 37 2HG1 ILE 37 9.753 0.891 -1.142 327 2HG1 ILE 37 1HG1 ILE 37 9.519 1.515 -2.771 328 1HG2 ILE 37 1HG2 ILE 37 9.127 -1.121 -0.493 329 2HG2 ILE 37 2HG2 ILE 37 10.111 -1.657 -1.855 330 3HG2 ILE 37 3HG2 ILE 37 8.500 -2.331 -1.612 331 1HD1 ILE 37 1HD1 ILE 37 7.232 1.384 -0.855 332 2HD1 ILE 37 2HD1 ILE 37 7.456 2.427 -2.260 333 3HD1 ILE 37 3HD1 ILE 37 8.391 2.711 -0.792 334 H ASN 38 H ASN 38 6.507 -0.706 -4.812 335 HA ASN 38 HA ASN 38 6.523 2.037 -5.855 336 1HB ASN 38 2HB ASN 38 6.374 -0.439 -7.398 337 2HB ASN 38 1HB ASN 38 5.013 0.633 -7.709 338 1HD2 ASN 38 1HD2 ASN 38 6.139 0.525 -9.861 339 2HD2 ASN 38 2HD2 ASN 38 7.331 1.733 -10.177 340 H SER 39 H SER 39 4.350 2.900 -6.237 341 HA SER 39 HA SER 39 2.121 1.431 -5.102 342 1HB SER 39 2HB SER 39 2.956 4.073 -3.885 343 2HB SER 39 1HB SER 39 1.590 3.070 -3.397 344 HG SER 39 HG SER 39 4.342 2.639 -3.022 345 H ALA 40 H ALA 40 0.244 1.957 -6.070 346 HA ALA 40 HA ALA 40 -0.312 4.569 -7.086 347 1HB ALA 40 1HB ALA 40 0.705 4.397 -9.061 348 2HB ALA 40 2HB ALA 40 -0.563 3.249 -9.493 349 3HB ALA 40 3HB ALA 40 0.978 2.666 -8.863 350 H GLY 41 H GLY 41 -2.363 4.557 -8.457 351 1HA GLY 41 2HA GLY 41 -4.265 2.752 -7.161 352 2HA GLY 41 1HA GLY 41 -4.661 4.223 -8.037 353 H THR 42 H THR 42 -6.289 2.377 -8.730 354 HA THR 42 HA THR 42 -5.392 0.481 -10.638 355 HB THR 42 HB THR 42 -8.102 1.112 -11.186 356 HG1 THR 42 1HG THR 42 -8.601 0.618 -8.736 357 1HG2 THR 42 1HG2 THR 42 -7.375 -1.118 -11.332 358 2HG2 THR 42 2HG2 THR 42 -8.425 -1.089 -9.916 359 3HG2 THR 42 3HG2 THR 42 -6.673 -1.086 -9.714 360 H SER 43 H SER 43 -6.950 3.666 -10.995 361 HA SER 43 HA SER 43 -5.982 3.703 -13.778 362 1HB SER 43 2HB SER 43 -8.463 3.414 -13.626 363 2HB SER 43 1HB SER 43 -8.551 4.970 -12.803 364 HG SER 43 HG SER 43 -7.443 4.575 -15.385 365 H GLY 44 H GLY 44 -5.540 4.988 -10.835 366 1HA GLY 44 2HA GLY 44 -4.682 6.946 -10.012 367 2HA GLY 44 1HA GLY 44 -3.884 7.050 -11.572 368 H GLU 45 H GLU 45 -7.380 7.209 -11.055 369 HA GLU 45 HA GLU 45 -7.796 9.424 -12.673 370 1HB GLU 45 2HB GLU 45 -9.351 7.875 -10.783 371 2HB GLU 45 1HB GLU 45 -9.768 9.580 -10.682 372 1HG GLU 45 2HG GLU 45 -10.108 9.570 -13.149 373 2HG GLU 45 1HG GLU 45 -9.868 7.823 -13.120 374 H HIS 46 H HIS 46 -8.383 9.668 -9.187 375 HA HIS 46 HA HIS 46 -7.219 12.362 -9.230 376 1HB HIS 46 2HB HIS 46 -9.203 10.971 -7.468 377 2HB HIS 46 1HB HIS 46 -8.246 12.287 -6.789 378 HD1 HIS 46 1HD HIS 46 -11.447 12.026 -7.710 379 HD2 HIS 46 2HD HIS 46 -8.415 14.390 -9.283 380 HE1 HIS 46 1HE HIS 46 -12.611 13.941 -8.851 381 HE2 HIS 46 2HE HIS 46 -10.759 15.297 -9.890 382 H ASP 47 H ASP 47 -6.659 9.172 -8.323 383 HA ASP 47 HA ASP 47 -5.200 9.127 -6.045 384 1HB ASP 47 2HB ASP 47 -4.267 7.723 -8.549 385 2HB ASP 47 1HB ASP 47 -4.103 7.184 -6.881 386 H GLY 48 H GLY 48 -3.931 10.849 -5.512 387 1HA GLY 48 2HA GLY 48 -1.283 10.961 -6.282 388 2HA GLY 48 1HA GLY 48 -2.124 12.099 -7.324 389 H GLU 49 H GLU 49 -4.090 12.767 -5.237 390 HA GLU 49 HA GLU 49 -2.968 15.044 -4.181 391 1HB GLU 49 2HB GLU 49 -5.242 13.342 -3.162 392 2HB GLU 49 1HB GLU 49 -4.819 14.882 -2.433 393 1HG GLU 49 2HG GLU 49 -5.274 14.804 -5.362 394 2HG GLU 49 1HG GLU 49 -6.670 14.677 -4.294 395 H GLY 50 H GLY 50 -3.694 12.152 -2.208 396 1HA GLY 50 2HA GLY 50 -2.139 11.058 -0.801 397 2HA GLY 50 1HA GLY 50 -1.099 12.466 -0.895 398 H MET 51 H MET 51 -3.673 14.101 -0.313 399 HA MET 51 HA MET 51 -3.502 13.719 2.598 400 1HB MET 51 2HB MET 51 -4.429 16.144 2.586 401 2HB MET 51 1HB MET 51 -2.731 15.871 2.219 402 1HG MET 51 2HG MET 51 -3.160 16.096 -0.140 403 2HG MET 51 1HG MET 51 -4.891 16.235 0.156 404 1HE MET 51 1HE MET 51 -4.077 18.871 -1.540 405 2HE MET 51 2HE MET 51 -5.106 19.790 -0.442 406 3HE MET 51 3HE MET 51 -5.516 18.123 -0.848 407 H HIS 52 H HIS 52 -5.219 13.005 3.638 408 HA HIS 52 HA HIS 52 -7.883 13.491 2.494 409 1HB HIS 52 2HB HIS 52 -6.687 11.013 2.520 410 2HB HIS 52 1HB HIS 52 -7.643 10.985 3.998 411 HD1 HIS 52 1HD HIS 52 -7.926 10.050 0.629 412 HD2 HIS 52 2HD HIS 52 -10.460 12.013 3.270 413 HE1 HIS 52 1HE HIS 52 -10.234 9.787 -0.334 414 HE2 HIS 52 2HE HIS 52 -11.737 11.066 1.231 415 H TYR 53 H TYR 53 -9.625 12.999 4.190 416 HA TYR 53 HA TYR 53 -9.438 14.770 6.277 417 1HB TYR 53 2HB TYR 53 -11.214 12.412 5.775 418 2HB TYR 53 1HB TYR 53 -11.342 13.302 7.288 419 HD1 TYR 53 1HD TYR 53 -10.868 16.075 6.332 420 HD2 TYR 53 2HD TYR 53 -13.199 12.933 4.659 421 HE1 TYR 53 1HE TYR 53 -12.310 17.738 5.233 422 HE2 TYR 53 2HE TYR 53 -14.645 14.586 3.553 423 HH TYR 53 HH TYR 53 -15.130 17.379 4.269 424 H GLY 54 H GLY 54 -9.557 11.250 6.801 425 1HA GLY 54 2HA GLY 54 -8.581 11.449 9.454 426 2HA GLY 54 1HA GLY 54 -8.767 9.970 8.531 427 H THR 55 H THR 55 -6.969 10.715 6.389 428 HA THR 55 HA THR 55 -4.574 9.737 7.453 429 HB THR 55 HB THR 55 -4.816 11.357 4.916 430 HG1 THR 55 1HG THR 55 -5.170 8.548 5.256 431 1HG2 THR 55 1HG2 THR 55 -2.543 10.985 5.294 432 2HG2 THR 55 2HG2 THR 55 -3.004 9.641 4.249 433 3HG2 THR 55 3HG2 THR 55 -2.823 9.386 5.984 434 H LYS 56 H LYS 56 -5.372 13.065 6.434 435 HA LYS 56 HA LYS 56 -2.926 14.212 7.171 436 1HB LYS 56 2HB LYS 56 -3.931 16.297 6.835 437 2HB LYS 56 1HB LYS 56 -4.838 15.225 5.779 438 1HG LYS 56 2HG LYS 56 -6.623 15.093 7.448 439 2HG LYS 56 1HG LYS 56 -5.713 16.184 8.497 440 1HD LYS 56 2HD LYS 56 -6.064 17.206 5.785 441 2HD LYS 56 1HD LYS 56 -7.588 16.941 6.636 442 1HE LYS 56 2HE LYS 56 -7.274 18.780 7.839 443 2HE LYS 56 1HE LYS 56 -5.722 18.170 8.414 444 1HZ LYS 56 1HZ LYS 56 -6.177 19.672 5.893 445 2HZ LYS 56 2HZ LYS 56 -4.688 19.059 6.407 446 3HZ LYS 56 3HZ LYS 56 -5.450 20.278 7.296 447 H ASN 57 H ASN 57 -5.788 13.472 9.055 448 HA ASN 57 HA ASN 57 -5.203 15.001 11.332 449 1HB ASN 57 2HB ASN 57 -7.380 13.824 10.792 450 2HB ASN 57 1HB ASN 57 -6.618 12.332 11.336 451 1HD2 ASN 57 1HD2 ASN 57 -6.236 12.016 13.506 452 2HD2 ASN 57 2HD2 ASN 57 -6.901 13.036 14.732 453 H LYS 58 H LYS 58 -4.457 11.594 10.609 454 HA LYS 58 HA LYS 58 -3.086 11.107 13.028 455 1HB LYS 58 2HB LYS 58 -2.946 9.713 10.354 456 2HB LYS 58 1HB LYS 58 -2.137 9.130 11.802 457 1HG LYS 58 2HG LYS 58 -5.078 9.309 11.249 458 2HG LYS 58 1HG LYS 58 -4.116 7.891 11.662 459 1HD LYS 58 2HD LYS 58 -4.620 10.213 13.522 460 2HD LYS 58 1HD LYS 58 -5.549 8.713 13.524 461 1HE LYS 58 2HE LYS 58 -4.038 8.122 15.097 462 2HE LYS 58 1HE LYS 58 -3.067 7.702 13.685 463 1HZ LYS 58 1HZ LYS 58 -1.844 9.676 13.866 464 2HZ LYS 58 2HZ LYS 58 -1.964 9.106 15.454 465 3HZ LYS 58 3HZ LYS 58 -2.947 10.383 14.937 466 H LEU 59 H LEU 59 -1.970 12.114 9.820 467 HA LEU 59 HA LEU 59 0.788 12.009 10.456 468 1HB LEU 59 2HB LEU 59 -0.823 13.279 8.281 469 2HB LEU 59 1HB LEU 59 0.853 13.758 8.484 470 HG LEU 59 HG LEU 59 1.675 11.731 7.776 471 1HD1 LEU 59 1HD1 LEU 59 -0.950 10.373 8.354 472 2HD1 LEU 59 2HD1 LEU 59 0.427 10.392 9.454 473 3HD1 LEU 59 3HD1 LEU 59 0.568 9.610 7.879 474 1HD2 LEU 59 1HD2 LEU 59 0.796 11.419 5.705 475 2HD2 LEU 59 2HD2 LEU 59 -0.021 12.923 6.130 476 3HD2 LEU 59 3HD2 LEU 59 -0.867 11.384 6.292 477 H ALA 60 H ALA 60 -1.671 14.508 10.731 478 HA ALA 60 HA ALA 60 0.056 16.650 11.357 479 1HB ALA 60 1HB ALA 60 -2.643 16.602 12.575 480 2HB ALA 60 2HB ALA 60 -2.551 16.528 10.815 481 3HB ALA 60 3HB ALA 60 -1.823 17.882 11.680 482 H GLN 61 H GLN 61 -1.365 14.079 13.260 483 HA GLN 61 HA GLN 61 -1.004 15.081 15.826 484 1HB GLN 61 2HB GLN 61 -1.524 12.515 14.617 485 2HB GLN 61 1HB GLN 61 -0.422 12.339 15.974 486 1HG GLN 61 2HG GLN 61 -2.414 14.077 16.862 487 2HG GLN 61 1HG GLN 61 -3.252 12.812 15.966 488 1HE2 GLN 61 1HE2 GLN 61 -1.568 10.666 16.496 489 2HE2 GLN 61 2HE2 GLN 61 -1.669 10.278 18.176 490 H LEU 62 H LEU 62 1.269 12.971 14.017 491 HA LEU 62 HA LEU 62 3.464 14.332 15.372 492 1HB LEU 62 2HB LEU 62 4.476 11.837 15.477 493 2HB LEU 62 1HB LEU 62 3.707 12.647 16.821 494 HG LEU 62 HG LEU 62 3.075 10.220 16.366 495 1HD1 LEU 62 1HD1 LEU 62 1.330 12.491 17.001 496 2HD1 LEU 62 2HD1 LEU 62 1.678 11.024 17.916 497 3HD1 LEU 62 3HD1 LEU 62 0.508 10.985 16.597 498 1HD2 LEU 62 1HD2 LEU 62 1.855 9.596 14.578 499 2HD2 LEU 62 2HD2 LEU 62 2.656 10.976 13.828 500 3HD2 LEU 62 3HD2 LEU 62 1.020 11.144 14.465 501 H ASN 63 H ASN 63 2.317 12.382 12.712 502 HA ASN 63 HA ASN 63 4.874 12.181 11.427 503 1HB ASN 63 2HB ASN 63 2.163 11.856 10.128 504 2HB ASN 63 1HB ASN 63 3.703 11.197 9.579 505 1HD2 ASN 63 1HD2 ASN 63 0.913 10.309 10.859 506 2HD2 ASN 63 2HD2 ASN 63 1.405 8.964 11.826 507 H ILE 64 H ILE 64 4.048 12.836 8.759 508 HA ILE 64 HA ILE 64 4.135 15.778 8.927 509 HB ILE 64 HB ILE 64 5.231 13.935 6.809 510 1HG1 ILE 64 2HG1 ILE 64 7.076 15.802 8.062 511 2HG1 ILE 64 1HG1 ILE 64 6.324 14.734 9.243 512 1HG2 ILE 64 1HG2 ILE 64 4.530 16.738 6.703 513 2HG2 ILE 64 2HG2 ILE 64 5.021 15.648 5.407 514 3HG2 ILE 64 3HG2 ILE 64 6.242 16.479 6.371 515 1HD1 ILE 64 1HD1 ILE 64 7.788 13.848 6.768 516 2HD1 ILE 64 2HD1 ILE 64 7.077 12.797 7.994 517 3HD1 ILE 64 3HD1 ILE 64 8.434 13.843 8.409 518 H GLU 65 H GLU 65 2.659 16.967 7.821 519 HA GLU 65 HA GLU 65 0.289 15.751 6.888 520 1HB GLU 65 2HB GLU 65 1.392 18.535 6.816 521 2HB GLU 65 1HB GLU 65 -0.050 18.152 5.886 522 1HG GLU 65 2HG GLU 65 -0.984 17.213 8.075 523 2HG GLU 65 1HG GLU 65 0.339 18.079 8.854 524 H HIS 66 H HIS 66 0.997 14.222 5.331 525 HA HIS 66 HA HIS 66 1.242 13.448 3.219 526 1HB HIS 66 2HB HIS 66 -0.050 14.576 1.783 527 2HB HIS 66 1HB HIS 66 -0.084 15.925 2.910 528 HD1 HIS 66 1HD HIS 66 1.205 18.013 2.274 529 HD2 HIS 66 2HD HIS 66 1.866 14.837 -0.323 530 HE1 HIS 66 1HE HIS 66 2.461 18.989 0.326 531 HE2 HIS 66 2HE HIS 66 2.793 17.062 -1.264 532 H LYS 67 H LYS 67 2.981 12.868 2.081 533 HA LYS 67 HA LYS 67 5.181 14.726 1.676 534 1HB LYS 67 2HB LYS 67 6.011 12.094 2.763 535 2HB LYS 67 1HB LYS 67 6.763 13.671 2.944 536 1HG LYS 67 2HG LYS 67 6.054 13.198 5.085 537 2HG LYS 67 1HG LYS 67 4.743 14.202 4.464 538 1HD LYS 67 2HD LYS 67 3.260 12.477 4.419 539 2HD LYS 67 1HD LYS 67 4.501 11.277 4.061 540 1HE LYS 67 2HE LYS 67 5.297 11.463 6.396 541 2HE LYS 67 1HE LYS 67 3.971 12.577 6.729 542 1HZ LYS 67 1HZ LYS 67 2.399 10.841 6.217 543 2HZ LYS 67 2HZ LYS 67 3.469 10.297 7.409 544 3HZ LYS 67 3HZ LYS 67 3.646 9.772 5.811 545 H ASN 68 H ASN 68 3.318 13.457 -0.080 546 HA ASN 68 HA ASN 68 5.137 12.426 -2.017 547 1HB ASN 68 2HB ASN 68 3.545 10.248 -2.138 548 2HB ASN 68 1HB ASN 68 5.071 10.284 -1.260 549 1HD2 ASN 68 1HD2 ASN 68 4.953 9.449 0.681 550 2HD2 ASN 68 2HD2 ASN 68 3.577 9.472 1.726 551 H PHE 69 H PHE 69 3.692 14.560 -2.371 552 HA PHE 69 HA PHE 69 1.084 14.033 -3.473 553 1HB PHE 69 2HB PHE 69 2.225 16.252 -2.426 554 2HB PHE 69 1HB PHE 69 2.462 16.569 -4.141 555 HD1 PHE 69 1HD PHE 69 0.313 16.184 -5.626 556 HD2 PHE 69 2HD PHE 69 0.279 16.955 -1.441 557 HE1 PHE 69 1HE PHE 69 -2.001 17.005 -5.800 558 HE2 PHE 69 2HE PHE 69 -2.034 17.777 -1.607 559 HZ PHE 69 HZ PHE 69 -3.177 17.802 -3.789 560 H THR 70 H THR 70 1.487 12.506 -5.118 561 HA THR 70 HA THR 70 2.310 13.707 -7.626 562 HB THR 70 HB THR 70 4.446 12.902 -7.077 563 HG1 THR 70 1HG THR 70 4.656 11.026 -8.490 564 1HG2 THR 70 1HG2 THR 70 4.873 10.642 -6.198 565 2HG2 THR 70 2HG2 THR 70 3.135 10.350 -6.136 566 3HG2 THR 70 3HG2 THR 70 3.857 11.590 -5.112 567 H SER 71 H SER 71 0.658 13.264 -8.922 568 HA SER 71 HA SER 71 -1.240 11.249 -8.520 569 1HB SER 71 2HB SER 71 -1.510 11.734 -11.171 570 2HB SER 71 1HB SER 71 -2.141 12.802 -9.918 571 HG SER 71 HG SER 71 -0.824 13.822 -11.590 572 H LYS 72 H LYS 72 -0.852 9.136 -8.561 573 HA LYS 72 HA LYS 72 0.903 8.090 -10.684 574 1HB LYS 72 2HB LYS 72 0.542 7.176 -7.835 575 2HB LYS 72 1HB LYS 72 1.287 6.159 -9.062 576 1HG LYS 72 2HG LYS 72 3.074 7.715 -9.366 577 2HG LYS 72 1HG LYS 72 2.277 8.908 -8.338 578 1HD LYS 72 2HD LYS 72 2.645 7.621 -6.393 579 2HD LYS 72 1HD LYS 72 3.075 6.189 -7.330 580 1HE LYS 72 2HE LYS 72 4.663 8.751 -7.254 581 2HE LYS 72 1HE LYS 72 5.031 7.307 -6.312 582 1HZ LYS 72 1HZ LYS 72 5.437 6.087 -8.308 583 2HZ LYS 72 2HZ LYS 72 6.338 7.516 -8.383 584 3HZ LYS 72 3HZ LYS 72 4.909 7.370 -9.277 585 H LYS 73 H LYS 73 0.109 6.605 -12.013 586 HA LYS 73 HA LYS 73 -2.433 5.282 -11.317 587 1HB LYS 73 2HB LYS 73 -2.533 5.373 -14.037 588 2HB LYS 73 1HB LYS 73 -3.324 6.530 -12.977 589 1HG LYS 73 2HG LYS 73 -2.084 8.194 -13.753 590 2HG LYS 73 1HG LYS 73 -0.592 7.299 -13.454 591 1HD LYS 73 2HD LYS 73 -0.630 6.307 -15.577 592 2HD LYS 73 1HD LYS 73 -2.330 6.705 -15.829 593 1HE LYS 73 2HE LYS 73 -1.535 9.160 -15.680 594 2HE LYS 73 1HE LYS 73 0.070 8.492 -15.972 595 1HZ LYS 73 1HZ LYS 73 -1.832 9.121 -17.860 596 2HZ LYS 73 2HZ LYS 73 -1.818 7.431 -17.806 597 3HZ LYS 73 3HZ LYS 73 -0.388 8.278 -18.117 598 H LEU 74 H LEU 74 -1.726 3.262 -10.853 599 HA LEU 74 HA LEU 74 0.474 1.942 -11.868 600 1HB LEU 74 2HB LEU 74 -0.665 1.062 -9.964 601 2HB LEU 74 1HB LEU 74 -2.151 0.851 -10.872 602 HG LEU 74 HG LEU 74 -0.085 -0.655 -12.151 603 1HD1 LEU 74 1HD1 LEU 74 1.207 -0.989 -10.300 604 2HD1 LEU 74 2HD1 LEU 74 0.038 -2.294 -10.095 605 3HD1 LEU 74 3HD1 LEU 74 -0.143 -0.795 -9.183 606 1HD2 LEU 74 1HD2 LEU 74 -2.724 -1.135 -10.862 607 2HD2 LEU 74 2HD2 LEU 74 -1.697 -2.522 -11.227 608 3HD2 LEU 74 3HD2 LEU 74 -2.203 -1.435 -12.520 609 H THR 75 H THR 75 0.968 1.552 -13.911 610 HA THR 75 HA THR 75 -1.177 0.724 -15.753 611 HB THR 75 HB THR 75 1.287 1.544 -17.062 612 HG1 THR 75 1HG THR 75 1.209 2.944 -15.116 613 1HG2 THR 75 1HG2 THR 75 -0.447 3.139 -18.135 614 2HG2 THR 75 2HG2 THR 75 -1.633 2.205 -17.222 615 3HG2 THR 75 3HG2 THR 75 -0.605 1.405 -18.411 616 H GLN 76 H GLN 76 0.265 -0.297 -17.807 617 HA GLN 76 HA GLN 76 0.991 -2.867 -16.808 618 1HB GLN 76 2HB GLN 76 0.805 -1.579 -19.485 619 2HB GLN 76 1HB GLN 76 1.791 -3.028 -19.346 620 1HG GLN 76 2HG GLN 76 0.015 -4.363 -19.182 621 2HG GLN 76 1HG GLN 76 -0.818 -3.276 -18.072 622 1HE2 GLN 76 1HE2 GLN 76 -2.574 -2.328 -18.808 623 2HE2 GLN 76 2HE2 GLN 76 -2.992 -2.105 -20.469 624 H LYS 77 H LYS 77 2.759 -0.020 -17.810 625 HA LYS 77 HA LYS 77 5.291 -1.141 -18.195 626 1HB LYS 77 2HB LYS 77 4.240 1.563 -17.572 627 2HB LYS 77 1HB LYS 77 5.947 1.287 -17.250 628 1HG LYS 77 2HG LYS 77 6.476 1.329 -19.413 629 2HG LYS 77 1HG LYS 77 5.106 0.309 -19.860 630 1HD LYS 77 2HD LYS 77 3.625 2.202 -19.857 631 2HD LYS 77 1HD LYS 77 4.891 3.247 -19.210 632 1HE LYS 77 2HE LYS 77 6.015 3.353 -21.212 633 2HE LYS 77 1HE LYS 77 5.385 1.803 -21.768 634 1HZ LYS 77 1HZ LYS 77 4.365 4.418 -22.209 635 2HZ LYS 77 2HZ LYS 77 3.187 3.432 -21.502 636 3HZ LYS 77 3HZ LYS 77 3.927 2.960 -22.948 637 H LEU 78 H LEU 78 3.884 0.295 -15.258 638 HA LEU 78 HA LEU 78 6.133 -0.338 -13.626 639 1HB LEU 78 2HB LEU 78 3.313 0.358 -12.809 640 2HB LEU 78 1HB LEU 78 4.719 0.368 -11.761 641 HG LEU 78 HG LEU 78 5.208 2.043 -14.046 642 1HD1 LEU 78 1HD1 LEU 78 3.510 3.796 -13.399 643 2HD1 LEU 78 2HD1 LEU 78 2.645 2.516 -12.549 644 3HD1 LEU 78 3HD1 LEU 78 2.890 2.408 -14.292 645 1HD2 LEU 78 1HD2 LEU 78 5.009 3.640 -11.809 646 2HD2 LEU 78 2HD2 LEU 78 6.463 2.817 -12.373 647 3HD2 LEU 78 3HD2 LEU 78 5.441 2.063 -11.148 648 H CYS 79 H CYS 79 2.950 -1.819 -14.105 649 HA CYS 79 HA CYS 79 3.087 -3.758 -12.107 650 1HB CYS 79 2HB CYS 79 1.012 -3.338 -13.253 651 2HB CYS 79 1HB CYS 79 1.711 -3.820 -14.795 652 HG CYS 79 HG CYS 79 2.141 -6.381 -12.914 653 H ASP 80 H ASP 80 4.165 -3.912 -15.481 654 HA ASP 80 HA ASP 80 4.993 -6.594 -15.465 655 1HB ASP 80 2HB ASP 80 5.531 -4.218 -17.175 656 2HB ASP 80 1HB ASP 80 6.620 -5.593 -17.330 657 H GLU 81 H GLU 81 6.388 -3.807 -14.037 658 HA GLU 81 HA GLU 81 9.085 -4.818 -13.981 659 1HB GLU 81 2HB GLU 81 7.780 -2.497 -12.557 660 2HB GLU 81 1HB GLU 81 9.494 -2.874 -12.462 661 1HG GLU 81 2HG GLU 81 8.621 -2.729 -15.204 662 2HG GLU 81 1HG GLU 81 8.219 -1.254 -14.328 663 H SER 82 H SER 82 6.687 -4.125 -11.410 664 HA SER 82 HA SER 82 8.128 -5.427 -9.378 665 1HB SER 82 2HB SER 82 5.362 -4.398 -9.704 666 2HB SER 82 1HB SER 82 5.628 -5.576 -8.418 667 HG SER 82 HG SER 82 6.632 -2.986 -8.704 668 H ASP 83 H ASP 83 7.977 -7.449 -8.474 669 HA ASP 83 HA ASP 83 6.922 -9.519 -10.241 670 1HB ASP 83 2HB ASP 83 8.843 -9.571 -7.915 671 2HB ASP 83 1HB ASP 83 8.199 -11.044 -8.633 672 H PHE 84 H PHE 84 6.417 -8.118 -7.089 673 HA PHE 84 HA PHE 84 4.234 -10.046 -6.625 674 1HB PHE 84 2HB PHE 84 6.120 -8.713 -4.698 675 2HB PHE 84 1HB PHE 84 4.558 -9.324 -4.162 676 HD1 PHE 84 1HD PHE 84 7.607 -10.407 -6.005 677 HD2 PHE 84 2HD PHE 84 4.381 -11.513 -3.460 678 HE1 PHE 84 1HE PHE 84 8.574 -12.657 -5.763 679 HE2 PHE 84 2HE PHE 84 5.343 -13.763 -3.212 680 HZ PHE 84 HZ PHE 84 7.443 -14.338 -4.364 681 H LEU 85 H LEU 85 2.273 -9.204 -6.803 682 HA LEU 85 HA LEU 85 1.935 -6.309 -6.396 683 1HB LEU 85 2HB LEU 85 0.245 -8.281 -7.936 684 2HB LEU 85 1HB LEU 85 -0.154 -6.588 -7.715 685 HG LEU 85 HG LEU 85 2.399 -6.487 -8.764 686 1HD1 LEU 85 1HD1 LEU 85 0.867 -8.569 -10.307 687 2HD1 LEU 85 2HD1 LEU 85 2.205 -8.936 -9.218 688 3HD1 LEU 85 3HD1 LEU 85 2.480 -7.943 -10.648 689 1HD2 LEU 85 1HD2 LEU 85 1.397 -5.213 -10.325 690 2HD2 LEU 85 2HD2 LEU 85 -0.023 -5.415 -9.298 691 3HD2 LEU 85 3HD2 LEU 85 0.196 -6.445 -10.712 692 H ILE 86 H ILE 86 1.010 -5.714 -4.550 693 HA ILE 86 HA ILE 86 -0.810 -7.619 -3.227 694 HB ILE 86 HB ILE 86 0.683 -5.449 -1.783 695 1HG1 ILE 86 2HG1 ILE 86 1.630 -8.303 -1.902 696 2HG1 ILE 86 1HG1 ILE 86 2.179 -7.118 -3.084 697 1HG2 ILE 86 1HG2 ILE 86 -0.558 -6.180 -0.093 698 2HG2 ILE 86 2HG2 ILE 86 0.299 -7.719 -0.190 699 3HG2 ILE 86 3HG2 ILE 86 -1.210 -7.493 -1.075 700 1HD1 ILE 86 1HD1 ILE 86 2.838 -5.707 -1.038 701 2HD1 ILE 86 2HD1 ILE 86 3.839 -7.093 -1.473 702 3HD1 ILE 86 3HD1 ILE 86 2.688 -7.220 -0.142 703 H THR 87 H THR 87 -2.838 -7.057 -3.192 704 HA THR 87 HA THR 87 -3.550 -4.204 -3.300 705 HB THR 87 HB THR 87 -5.861 -5.730 -3.795 706 HG1 THR 87 1HG THR 87 -3.693 -6.631 -5.414 707 1HG2 THR 87 1HG2 THR 87 -5.899 -4.588 -5.854 708 2HG2 THR 87 2HG2 THR 87 -4.140 -4.478 -5.921 709 3HG2 THR 87 3HG2 THR 87 -5.040 -3.509 -4.755 710 H MET 88 H MET 88 -5.075 -3.402 -1.851 711 HA MET 88 HA MET 88 -5.633 -5.166 0.442 712 1HB MET 88 2HB MET 88 -5.809 -2.284 0.948 713 2HB MET 88 1HB MET 88 -5.013 -3.546 1.878 714 1HG MET 88 2HG MET 88 -3.526 -3.174 -0.498 715 2HG MET 88 1HG MET 88 -3.864 -1.582 0.182 716 1HE MET 88 1HE MET 88 -0.674 -2.637 0.092 717 2HE MET 88 2HE MET 88 -0.392 -1.744 1.586 718 3HE MET 88 3HE MET 88 -1.503 -1.107 0.373 719 H ASP 89 H ASP 89 -6.991 -3.011 -1.903 720 HA ASP 89 HA ASP 89 -9.516 -2.720 -0.535 721 1HB ASP 89 2HB ASP 89 -8.819 -2.084 -3.410 722 2HB ASP 89 1HB ASP 89 -10.245 -1.535 -2.534 723 H ASN 90 H ASN 90 -11.298 -3.942 -0.770 724 HA ASN 90 HA ASN 90 -11.126 -6.540 -1.751 725 1HB ASN 90 2HB ASN 90 -13.648 -4.922 -1.330 726 2HB ASN 90 1HB ASN 90 -13.536 -6.678 -1.393 727 1HD2 ASN 90 1HD2 ASN 90 -13.069 -7.772 0.412 728 2HD2 ASN 90 2HD2 ASN 90 -12.684 -7.047 1.933 729 H SER 91 H SER 91 -12.705 -3.702 -3.214 730 HA SER 91 HA SER 91 -13.565 -5.065 -5.543 731 1HB SER 91 2HB SER 91 -14.516 -3.088 -6.127 732 2HB SER 91 1HB SER 91 -14.128 -2.640 -4.465 733 HG SER 91 HG SER 91 -13.350 -1.384 -6.557 734 H ASN 92 H ASN 92 -10.563 -3.569 -4.644 735 HA ASN 92 HA ASN 92 -9.462 -3.103 -7.176 736 1HB ASN 92 2HB ASN 92 -8.622 -2.806 -4.559 737 2HB ASN 92 1HB ASN 92 -7.510 -4.009 -5.207 738 1HD2 ASN 92 1HD2 ASN 92 -6.980 -1.281 -4.399 739 2HD2 ASN 92 2HD2 ASN 92 -6.340 -0.475 -5.787 740 H PHE 93 H PHE 93 -9.495 -6.013 -5.178 741 HA PHE 93 HA PHE 93 -7.711 -7.548 -6.702 742 1HB PHE 93 2HB PHE 93 -8.112 -8.478 -4.629 743 2HB PHE 93 1HB PHE 93 -9.834 -8.130 -4.686 744 HD1 PHE 93 1HD PHE 93 -11.382 -9.735 -5.458 745 HD2 PHE 93 2HD PHE 93 -7.204 -10.410 -5.919 746 HE1 PHE 93 1HE PHE 93 -11.833 -12.070 -6.085 747 HE2 PHE 93 2HE PHE 93 -7.649 -12.748 -6.547 748 HZ PHE 93 HZ PHE 93 -9.966 -13.580 -6.631 749 H LYS 94 H LYS 94 -11.276 -7.525 -6.741 750 HA LYS 94 HA LYS 94 -11.540 -9.323 -8.891 751 1HB LYS 94 2HB LYS 94 -13.314 -8.605 -7.208 752 2HB LYS 94 1HB LYS 94 -13.522 -7.163 -8.192 753 1HG LYS 94 2HG LYS 94 -14.604 -8.270 -9.832 754 2HG LYS 94 1HG LYS 94 -13.646 -9.738 -9.623 755 1HD LYS 94 2HD LYS 94 -15.826 -10.310 -8.936 756 2HD LYS 94 1HD LYS 94 -14.912 -10.074 -7.445 757 1HE LYS 94 2HE LYS 94 -15.797 -7.650 -7.563 758 2HE LYS 94 1HE LYS 94 -16.980 -8.301 -8.696 759 1HZ LYS 94 1HZ LYS 94 -17.266 -10.051 -6.770 760 2HZ LYS 94 2HZ LYS 94 -18.102 -8.580 -6.758 761 3HZ LYS 94 3HZ LYS 94 -16.704 -8.766 -5.823 762 H ASN 95 H ASN 95 -11.190 -5.831 -8.768 763 HA ASN 95 HA ASN 95 -11.876 -5.312 -11.460 764 1HB ASN 95 2HB ASN 95 -10.899 -3.818 -9.193 765 2HB ASN 95 1HB ASN 95 -10.041 -3.342 -10.655 766 1HD2 ASN 95 1HD2 ASN 95 -11.355 -2.734 -12.510 767 2HD2 ASN 95 2HD2 ASN 95 -12.873 -1.957 -12.240 768 H VAL 96 H VAL 96 -8.667 -5.464 -9.901 769 HA VAL 96 HA VAL 96 -7.164 -5.224 -12.251 770 HB VAL 96 HB VAL 96 -6.418 -6.624 -9.677 771 1HG1 VAL 96 1HG1 VAL 96 -4.070 -5.878 -10.505 772 2HG1 VAL 96 2HG1 VAL 96 -4.832 -5.867 -12.095 773 3HG1 VAL 96 3HG1 VAL 96 -4.791 -7.353 -11.147 774 1HG2 VAL 96 1HG2 VAL 96 -5.677 -4.601 -8.848 775 2HG2 VAL 96 2HG2 VAL 96 -7.127 -4.118 -9.729 776 3HG2 VAL 96 3HG2 VAL 96 -5.536 -3.876 -10.450 777 H LEU 97 H LEU 97 -8.837 -7.930 -10.894 778 HA LEU 97 HA LEU 97 -7.446 -10.077 -11.965 779 1HB LEU 97 2HB LEU 97 -9.945 -9.643 -10.708 780 2HB LEU 97 1HB LEU 97 -10.249 -10.597 -12.148 781 HG LEU 97 HG LEU 97 -8.597 -12.262 -11.388 782 1HD1 LEU 97 1HD1 LEU 97 -7.378 -12.095 -9.458 783 2HD1 LEU 97 2HD1 LEU 97 -8.527 -10.996 -8.694 784 3HD1 LEU 97 3HD1 LEU 97 -7.433 -10.400 -9.942 785 1HD2 LEU 97 1HD2 LEU 97 -10.039 -12.525 -9.035 786 2HD2 LEU 97 2HD2 LEU 97 -10.464 -13.190 -10.611 787 3HD2 LEU 97 3HD2 LEU 97 -11.115 -11.631 -10.108 788 H LYS 98 H LYS 98 -10.048 -8.174 -13.487 789 HA LYS 98 HA LYS 98 -9.535 -9.600 -16.002 790 1HB LYS 98 2HB LYS 98 -11.886 -8.247 -14.825 791 2HB LYS 98 1HB LYS 98 -11.690 -8.078 -16.564 792 1HG LYS 98 2HG LYS 98 -11.479 -10.789 -15.350 793 2HG LYS 98 1HG LYS 98 -13.071 -10.053 -15.546 794 1HD LYS 98 2HD LYS 98 -11.321 -9.873 -17.902 795 2HD LYS 98 1HD LYS 98 -11.806 -11.511 -17.455 796 1HE LYS 98 2HE LYS 98 -13.350 -10.441 -19.068 797 2HE LYS 98 1HE LYS 98 -14.132 -10.904 -17.557 798 1HZ LYS 98 1HZ LYS 98 -14.285 -8.467 -18.715 799 2HZ LYS 98 2HZ LYS 98 -13.094 -8.223 -17.540 800 3HZ LYS 98 3HZ LYS 98 -14.620 -8.794 -17.089 801 H ASN 99 H ASN 99 -9.411 -6.437 -14.535 802 HA ASN 99 HA ASN 99 -9.254 -4.822 -16.788 803 1HB ASN 99 2HB ASN 99 -9.148 -4.372 -14.115 804 2HB ASN 99 1HB ASN 99 -7.471 -4.068 -14.560 805 1HD2 ASN 99 1HD2 ASN 99 -10.460 -3.486 -16.356 806 2HD2 ASN 99 2HD2 ASN 99 -10.239 -1.780 -16.515 807 H PHE 100 H PHE 100 -6.737 -6.744 -15.228 808 HA PHE 100 HA PHE 100 -4.848 -5.843 -17.295 809 1HB PHE 100 2HB PHE 100 -4.487 -6.807 -14.490 810 2HB PHE 100 1HB PHE 100 -3.188 -7.064 -15.650 811 HD1 PHE 100 1HD PHE 100 -1.501 -5.540 -15.390 812 HD2 PHE 100 2HD PHE 100 -5.528 -4.244 -14.930 813 HE1 PHE 100 1HE PHE 100 -0.715 -3.237 -15.025 814 HE2 PHE 100 2HE PHE 100 -4.749 -1.939 -14.565 815 HZ PHE 100 HZ PHE 100 -2.340 -1.434 -14.614 816 H THR 101 H THR 101 -3.133 -7.603 -17.766 817 HA THR 101 HA THR 101 -4.433 -9.709 -19.121 818 HB THR 101 HB THR 101 -1.577 -10.138 -18.639 819 HG1 THR 101 1HG THR 101 -1.402 -7.935 -18.525 820 1HG2 THR 101 1HG2 THR 101 -1.579 -10.723 -20.839 821 2HG2 THR 101 2HG2 THR 101 -2.681 -9.425 -21.297 822 3HG2 THR 101 3HG2 THR 101 -3.308 -10.888 -20.536 823 H ASN 102 H ASN 102 -2.908 -11.941 -18.816 824 HA ASN 102 HA ASN 102 -4.111 -13.216 -16.605 825 1HB ASN 102 2HB ASN 102 -3.283 -14.199 -18.861 826 2HB ASN 102 1HB ASN 102 -1.732 -14.350 -18.042 827 1HD2 ASN 102 1HD2 ASN 102 -5.018 -14.778 -16.809 828 2HD2 ASN 102 2HD2 ASN 102 -4.812 -16.426 -16.333 829 H THR 103 H THR 103 -1.873 -10.989 -16.286 830 HA THR 103 HA THR 103 -0.059 -12.402 -14.505 831 HB THR 103 HB THR 103 0.878 -10.679 -15.986 832 HG1 THR 103 1HG THR 103 1.615 -9.282 -13.991 833 1HG2 THR 103 1HG2 THR 103 -1.354 -9.139 -14.964 834 2HG2 THR 103 2HG2 THR 103 -0.338 -8.845 -16.375 835 3HG2 THR 103 3HG2 THR 103 0.171 -8.273 -14.787 836 H GLN 104 H GLN 104 -3.080 -11.550 -14.187 837 HA GLN 104 HA GLN 104 -3.081 -9.944 -11.818 838 1HB GLN 104 2HB GLN 104 -5.520 -10.668 -11.735 839 2HB GLN 104 1HB GLN 104 -5.016 -9.773 -13.162 840 1HG GLN 104 2HG GLN 104 -6.267 -11.454 -14.088 841 2HG GLN 104 1HG GLN 104 -4.642 -12.132 -14.185 842 1HE2 GLN 104 1HE2 GLN 104 -5.442 -14.233 -14.241 843 2HE2 GLN 104 2HE2 GLN 104 -6.087 -15.008 -12.839 844 H ASN 105 H ASN 105 -2.407 -13.185 -12.417 845 HA ASN 105 HA ASN 105 -3.506 -14.325 -10.037 846 1HB ASN 105 2HB ASN 105 -2.453 -15.351 -12.357 847 2HB ASN 105 1HB ASN 105 -1.176 -15.690 -11.192 848 1HD2 ASN 105 1HD2 ASN 105 -2.358 -17.788 -12.306 849 2HD2 ASN 105 2HD2 ASN 105 -3.420 -18.579 -11.195 850 H LYS 106 H LYS 106 -1.194 -12.071 -10.363 851 HA LYS 106 HA LYS 106 0.457 -13.112 -8.159 852 1HB LYS 106 2HB LYS 106 1.035 -11.470 -10.523 853 2HB LYS 106 1HB LYS 106 1.745 -10.854 -9.037 854 1HG LYS 106 2HG LYS 106 2.964 -12.854 -8.685 855 2HG LYS 106 1HG LYS 106 2.075 -13.697 -9.955 856 1HD LYS 106 2HD LYS 106 3.068 -12.272 -11.642 857 2HD LYS 106 1HD LYS 106 3.883 -11.322 -10.398 858 1HE LYS 106 2HE LYS 106 4.416 -14.148 -11.257 859 2HE LYS 106 1HE LYS 106 5.529 -12.781 -11.213 860 1HZ LYS 106 1HZ LYS 106 4.679 -14.557 -9.065 861 2HZ LYS 106 2HZ LYS 106 4.893 -12.930 -8.654 862 3HZ LYS 106 3HZ LYS 106 6.174 -13.808 -9.323 863 H VAL 107 H VAL 107 -2.245 -11.722 -8.109 864 HA VAL 107 HA VAL 107 -1.589 -9.282 -6.640 865 HB VAL 107 HB VAL 107 -3.963 -8.783 -6.672 866 1HG1 VAL 107 1HG1 VAL 107 -2.460 -9.372 -9.124 867 2HG1 VAL 107 2HG1 VAL 107 -3.270 -7.890 -8.612 868 3HG1 VAL 107 3HG1 VAL 107 -4.201 -9.197 -9.343 869 1HG2 VAL 107 1HG2 VAL 107 -5.135 -10.642 -8.354 870 2HG2 VAL 107 2HG2 VAL 107 -5.391 -10.497 -6.614 871 3HG2 VAL 107 3HG2 VAL 107 -4.185 -11.622 -7.238 872 H LEU 108 H LEU 108 -2.146 -8.932 -4.499 873 HA LEU 108 HA LEU 108 -2.915 -11.340 -2.983 874 1HB LEU 108 2HB LEU 108 -0.816 -9.288 -2.508 875 2HB LEU 108 1HB LEU 108 -1.645 -9.939 -1.106 876 HG LEU 108 HG LEU 108 -1.021 -12.250 -2.002 877 1HD1 LEU 108 1HD1 LEU 108 1.058 -12.221 -3.404 878 2HD1 LEU 108 2HD1 LEU 108 0.738 -10.516 -3.721 879 3HD1 LEU 108 3HD1 LEU 108 -0.417 -11.742 -4.242 880 1HD2 LEU 108 1HD2 LEU 108 1.569 -11.352 -1.389 881 2HD2 LEU 108 2HD2 LEU 108 0.385 -12.068 -0.295 882 3HD2 LEU 108 3HD2 LEU 108 0.457 -10.316 -0.495 883 H LYS 109 H LYS 109 -3.938 -10.853 -0.853 884 HA LYS 109 HA LYS 109 -5.595 -8.425 -1.001 885 1HB LYS 109 2HB LYS 109 -6.664 -10.852 0.348 886 2HB LYS 109 1HB LYS 109 -7.516 -9.586 -0.524 887 1HG LYS 109 2HG LYS 109 -7.589 -10.833 -2.347 888 2HG LYS 109 1HG LYS 109 -5.834 -11.019 -2.338 889 1HD LYS 109 2HD LYS 109 -6.277 -12.788 -0.497 890 2HD LYS 109 1HD LYS 109 -7.930 -12.776 -1.114 891 1HE LYS 109 2HE LYS 109 -5.988 -12.937 -3.255 892 2HE LYS 109 1HE LYS 109 -5.791 -14.254 -2.098 893 1HZ LYS 109 1HZ LYS 109 -8.336 -13.528 -3.449 894 2HZ LYS 109 2HZ LYS 109 -8.113 -14.817 -2.376 895 3HZ LYS 109 3HZ LYS 109 -7.336 -14.825 -3.877 896 H ILE 110 H ILE 110 -6.015 -7.341 0.904 897 HA ILE 110 HA ILE 110 -4.115 -7.707 3.012 898 HB ILE 110 HB ILE 110 -5.192 -5.501 2.177 899 1HG1 ILE 110 2HG1 ILE 110 -4.989 -4.532 4.514 900 2HG1 ILE 110 1HG1 ILE 110 -4.751 -6.180 5.085 901 1HG2 ILE 110 1HG2 ILE 110 -7.115 -4.792 3.609 902 2HG2 ILE 110 2HG2 ILE 110 -7.284 -6.474 4.110 903 3HG2 ILE 110 3HG2 ILE 110 -7.502 -6.032 2.417 904 1HD1 ILE 110 1HD1 ILE 110 -2.590 -5.894 4.716 905 2HD1 ILE 110 2HD1 ILE 110 -2.875 -4.364 3.885 906 3HD1 ILE 110 3HD1 ILE 110 -2.950 -5.881 2.990 907 H THR 111 H THR 111 -7.129 -9.062 2.337 908 HA THR 111 HA THR 111 -8.245 -9.341 4.898 909 HB THR 111 HB THR 111 -8.500 -11.436 2.751 910 HG1 THR 111 1HG THR 111 -9.456 -8.789 2.802 911 1HG2 THR 111 1HG2 THR 111 -10.046 -10.574 5.134 912 2HG2 THR 111 2HG2 THR 111 -9.784 -12.190 4.480 913 3HG2 THR 111 3HG2 THR 111 -10.960 -11.112 3.726 914 H ASP 112 H ASP 112 -5.804 -11.197 3.179 915 HA ASP 112 HA ASP 112 -5.675 -13.253 5.201 916 1HB ASP 112 2HB ASP 112 -5.103 -13.395 2.630 917 2HB ASP 112 1HB ASP 112 -3.517 -12.852 3.166 918 H PHE 113 H PHE 113 -4.372 -10.146 4.763 919 HA PHE 113 HA PHE 113 -2.121 -10.675 6.571 920 1HB PHE 113 2HB PHE 113 -2.783 -8.400 4.715 921 2HB PHE 113 1HB PHE 113 -1.582 -8.215 5.989 922 HD1 PHE 113 1HD PHE 113 0.171 -10.255 6.053 923 HD2 PHE 113 2HD PHE 113 -2.005 -8.944 2.638 924 HE1 PHE 113 1HE PHE 113 1.882 -11.245 4.588 925 HE2 PHE 113 2HE PHE 113 -0.299 -9.933 1.167 926 HZ PHE 113 HZ PHE 113 1.649 -11.084 2.141 927 H SER 114 H SER 114 -5.286 -9.518 6.564 928 HA SER 114 HA SER 114 -4.856 -8.137 9.123 929 1HB SER 114 2HB SER 114 -7.226 -7.678 7.314 930 2HB SER 114 1HB SER 114 -6.670 -6.680 8.659 931 HG SER 114 HG SER 114 -4.846 -6.136 7.430 932 HA PRO 115 HA PRO 115 -7.237 -11.536 10.735 933 1HB PRO 115 2HB PRO 115 -7.439 -10.684 13.293 934 2HB PRO 115 1HB PRO 115 -5.937 -11.329 12.620 935 1HG PRO 115 2HG PRO 115 -6.761 -8.480 13.030 936 2HG PRO 115 1HG PRO 115 -5.197 -9.251 13.353 937 1HD PRO 115 2HD PRO 115 -5.688 -7.765 11.128 938 2HD PRO 115 1HD PRO 115 -4.536 -9.115 11.156 939 H SER 116 H SER 116 -8.537 -9.417 13.074 940 HA SER 116 HA SER 116 -11.175 -9.672 11.853 941 1HB SER 116 2HB SER 116 -10.434 -8.761 14.642 942 2HB SER 116 1HB SER 116 -12.055 -9.136 14.059 943 HG SER 116 HG SER 116 -11.510 -11.017 14.905 944 H LEU 117 H LEU 117 -9.128 -7.655 10.995 945 HA LEU 117 HA LEU 117 -9.995 -5.101 11.902 946 1HB LEU 117 2HB LEU 117 -7.769 -5.632 10.855 947 2HB LEU 117 1HB LEU 117 -8.592 -5.744 9.310 948 HG LEU 117 HG LEU 117 -9.407 -3.301 9.998 949 1HD1 LEU 117 1HD1 LEU 117 -8.227 -3.403 12.173 950 2HD1 LEU 117 2HD1 LEU 117 -7.693 -2.068 11.149 951 3HD1 LEU 117 3HD1 LEU 117 -6.699 -3.518 11.300 952 1HD2 LEU 117 1HD2 LEU 117 -8.059 -4.130 8.002 953 2HD2 LEU 117 2HD2 LEU 117 -6.626 -3.693 8.933 954 3HD2 LEU 117 3HD2 LEU 117 -7.810 -2.457 8.501 955 H ASN 118 H ASN 118 -10.616 -6.946 8.925 956 HA ASN 118 HA ASN 118 -12.062 -6.512 7.176 957 1HB ASN 118 2HB ASN 118 -13.264 -7.729 9.164 958 2HB ASN 118 1HB ASN 118 -14.162 -6.218 9.290 959 1HD2 ASN 118 1HD2 ASN 118 -13.081 -8.493 6.791 960 2HD2 ASN 118 2HD2 ASN 118 -14.566 -8.492 5.907 961 H TYR 119 H TYR 119 -11.222 -4.400 6.606 962 HA TYR 119 HA TYR 119 -12.909 -2.156 7.477 963 1HB TYR 119 2HB TYR 119 -11.146 -0.703 7.005 964 2HB TYR 119 1HB TYR 119 -10.328 -2.121 7.647 965 HD1 TYR 119 1HD TYR 119 -9.766 0.300 5.471 966 HD2 TYR 119 2HD TYR 119 -10.156 -3.935 5.395 967 HE1 TYR 119 1HE TYR 119 -8.377 0.216 3.449 968 HE2 TYR 119 2HE TYR 119 -8.765 -4.033 3.369 969 HH TYR 119 HH TYR 119 -8.216 -1.658 1.401 970 H ASP 120 H ASP 120 -12.783 -0.381 5.501 971 HA ASP 120 HA ASP 120 -13.755 -1.795 3.107 972 1HB ASP 120 2HB ASP 120 -15.036 0.416 4.665 973 2HB ASP 120 1HB ASP 120 -15.309 0.315 2.928 974 H GLU 121 H GLU 121 -12.320 -1.434 1.582 975 HA GLU 121 HA GLU 121 -10.470 -0.377 0.586 976 1HB GLU 121 2HB GLU 121 -12.654 1.455 -0.331 977 2HB GLU 121 1HB GLU 121 -11.346 0.741 -1.262 978 1HG GLU 121 2HG GLU 121 -12.984 -0.606 -1.997 979 2HG GLU 121 1HG GLU 121 -12.624 -1.490 -0.514 980 H VAL 122 H VAL 122 -9.127 0.618 2.051 981 HA VAL 122 HA VAL 122 -7.968 2.346 2.964 982 HB VAL 122 HB VAL 122 -9.777 4.124 1.325 983 1HG1 VAL 122 1HG1 VAL 122 -7.384 4.605 3.000 984 2HG1 VAL 122 2HG1 VAL 122 -8.779 5.638 2.688 985 3HG1 VAL 122 3HG1 VAL 122 -7.504 5.487 1.479 986 1HG2 VAL 122 1HG2 VAL 122 -8.554 3.695 -0.506 987 2HG2 VAL 122 2HG2 VAL 122 -8.087 2.223 0.345 988 3HG2 VAL 122 3HG2 VAL 122 -7.041 3.641 0.400 989 HA PRO 123 HA PRO 123 -10.491 3.313 6.500 990 1HB PRO 123 2HB PRO 123 -8.676 4.744 7.909 991 2HB PRO 123 1HB PRO 123 -8.583 2.989 7.736 992 1HG PRO 123 2HG PRO 123 -7.110 5.118 6.230 993 2HG PRO 123 1HG PRO 123 -6.490 3.606 6.920 994 1HD PRO 123 2HD PRO 123 -7.075 3.869 4.294 995 2HD PRO 123 1HD PRO 123 -7.275 2.336 5.167 996 H ASP 124 H ASP 124 -9.411 5.920 7.794 997 HA ASP 124 HA ASP 124 -9.949 8.121 7.895 998 1HB ASP 124 2HB ASP 124 -9.295 9.186 6.045 999 2HB ASP 124 1HB ASP 124 -9.364 7.666 5.158 1000 HA PRO 125 HA PRO 125 -14.270 8.299 8.593 1001 1HB PRO 125 2HB PRO 125 -14.841 10.942 8.127 1002 2HB PRO 125 1HB PRO 125 -14.090 10.328 9.603 1003 1HG PRO 125 2HG PRO 125 -12.814 11.587 7.210 1004 2HG PRO 125 1HG PRO 125 -12.459 11.835 8.929 1005 1HD PRO 125 2HD PRO 125 -10.912 10.278 7.385 1006 2HD PRO 125 1HD PRO 125 -11.229 9.876 9.086 1007 H TRP 126 H TRP 126 -13.102 9.480 5.514 1008 HA TRP 126 HA TRP 126 -15.621 9.849 4.281 1009 1HB TRP 126 2HB TRP 126 -13.721 10.852 3.242 1010 2HB TRP 126 1HB TRP 126 -12.869 9.314 3.158 1011 HD1 TRP 126 HD TRP 126 -13.201 7.885 1.019 1012 HE1 TRP 126 1HE TRP 126 -14.592 8.153 -1.131 1013 HE3 TRP 126 3HE TRP 126 -16.091 11.867 2.411 1014 HZ2 TRP 126 2HZ TRP 126 -16.641 9.829 -2.107 1015 HZ3 TRP 126 3HZ TRP 126 -17.742 12.743 0.809 1016 HH2 TRP 126 HH TRP 126 -18.010 11.744 -1.403 1017 H TYR 127 H TYR 127 -13.743 7.057 5.029 1018 HA TYR 127 HA TYR 127 -15.491 5.379 3.363 1019 1HB TYR 127 2HB TYR 127 -12.735 4.934 4.487 1020 2HB TYR 127 1HB TYR 127 -13.717 3.600 3.895 1021 HD1 TYR 127 1HD TYR 127 -14.644 3.872 1.463 1022 HD2 TYR 127 2HD TYR 127 -11.332 6.047 3.012 1023 HE1 TYR 127 1HE TYR 127 -13.857 4.294 -0.826 1024 HE2 TYR 127 2HE TYR 127 -10.535 6.484 0.725 1025 HH TYR 127 HH TYR 127 -12.351 6.196 -1.937 1026 H SER 128 H SER 128 -13.841 5.220 6.535 1027 HA SER 128 HA SER 128 -15.841 3.360 7.505 1028 1HB SER 128 2HB SER 128 -13.776 4.529 9.316 1029 2HB SER 128 1HB SER 128 -14.388 2.878 9.224 1030 HG SER 128 HG SER 128 -13.037 2.447 7.596 1031 H GLY 129 H GLY 129 -14.580 6.514 8.640 1032 1HA GLY 129 2HA GLY 129 -16.629 8.092 8.929 1033 2HA GLY 129 1HA GLY 129 -17.092 6.886 10.117 1034 H ASN 130 H ASN 130 -13.839 6.884 10.317 1035 HA ASN 130 HA ASN 130 -13.696 9.222 12.085 1036 1HB ASN 130 2HB ASN 130 -14.141 6.826 13.189 1037 2HB ASN 130 1HB ASN 130 -12.388 6.730 13.047 1038 1HD2 ASN 130 1HD2 ASN 130 -11.273 8.828 13.786 1039 2HD2 ASN 130 2HD2 ASN 130 -11.822 9.464 15.296 1040 H PHE 131 H PHE 131 -11.524 9.892 12.613 1041 HA PHE 131 HA PHE 131 -9.733 9.552 10.368 1042 1HB PHE 131 2HB PHE 131 -8.856 11.112 12.733 1043 2HB PHE 131 1HB PHE 131 -8.748 11.506 11.022 1044 HD1 PHE 131 1HD PHE 131 -10.622 12.553 9.868 1045 HD2 PHE 131 2HD PHE 131 -10.764 11.738 14.043 1046 HE1 PHE 131 1HE PHE 131 -12.537 14.081 10.097 1047 HE2 PHE 131 2HE PHE 131 -12.682 13.262 14.279 1048 HZ PHE 131 HZ PHE 131 -13.570 14.436 12.304 1049 H ASP 132 H ASP 132 -10.172 8.113 13.399 1050 HA ASP 132 HA ASP 132 -7.433 7.502 13.967 1051 1HB ASP 132 2HB ASP 132 -9.197 7.619 15.719 1052 2HB ASP 132 1HB ASP 132 -9.933 6.172 15.034 1053 H GLU 133 H GLU 133 -9.911 6.094 12.008 1054 HA GLU 133 HA GLU 133 -9.081 3.432 11.925 1055 1HB GLU 133 2HB GLU 133 -10.052 4.812 9.447 1056 2HB GLU 133 1HB GLU 133 -10.391 3.182 10.013 1057 1HG GLU 133 2HG GLU 133 -11.444 5.717 11.226 1058 2HG GLU 133 1HG GLU 133 -12.343 4.626 10.177 1059 H THR 134 H THR 134 -7.962 6.260 10.156 1060 HA THR 134 HA THR 134 -6.358 5.183 8.234 1061 HB THR 134 HB THR 134 -5.208 7.432 9.819 1062 HG1 THR 134 1HG THR 134 -6.974 8.577 9.655 1063 1HG2 THR 134 1HG2 THR 134 -5.738 7.655 6.935 1064 2HG2 THR 134 2HG2 THR 134 -4.635 6.359 7.394 1065 3HG2 THR 134 3HG2 THR 134 -4.277 8.024 7.852 1066 H TYR 135 H TYR 135 -5.288 5.935 11.558 1067 HA TYR 135 HA TYR 135 -2.728 4.802 11.265 1068 1HB TYR 135 2HB TYR 135 -3.915 6.300 13.176 1069 2HB TYR 135 1HB TYR 135 -3.946 4.724 13.957 1070 HD1 TYR 135 1HD TYR 135 -2.250 4.525 15.501 1071 HD2 TYR 135 2HD TYR 135 -1.444 6.525 11.833 1072 HE1 TYR 135 1HE TYR 135 0.094 4.818 16.183 1073 HE2 TYR 135 2HE TYR 135 0.902 6.821 12.503 1074 HH TYR 135 HH TYR 135 2.009 6.025 15.722 1075 H LYS 136 H LYS 136 -5.758 3.458 12.527 1076 HA LYS 136 HA LYS 136 -4.814 1.040 13.484 1077 1HB LYS 136 2HB LYS 136 -7.247 2.177 13.308 1078 2HB LYS 136 1HB LYS 136 -7.400 0.959 12.049 1079 1HG LYS 136 2HG LYS 136 -6.780 -0.774 13.676 1080 2HG LYS 136 1HG LYS 136 -6.695 0.463 14.933 1081 1HD LYS 136 2HD LYS 136 -9.141 0.987 14.047 1082 2HD LYS 136 1HD LYS 136 -9.059 -0.710 13.568 1083 1HE LYS 136 2HE LYS 136 -8.579 -1.372 15.836 1084 2HE LYS 136 1HE LYS 136 -8.487 0.313 16.347 1085 1HZ LYS 136 1HZ LYS 136 -10.605 -0.525 16.966 1086 2HZ LYS 136 2HZ LYS 136 -10.895 -1.151 15.422 1087 3HZ LYS 136 3HZ LYS 136 -10.854 0.522 15.660 1088 H ILE 137 H ILE 137 -6.183 1.599 10.229 1089 HA ILE 137 HA ILE 137 -5.486 -0.991 9.293 1090 HB ILE 137 HB ILE 137 -5.832 1.137 7.276 1091 1HG1 ILE 137 2HG1 ILE 137 -7.347 1.973 8.983 1092 2HG1 ILE 137 1HG1 ILE 137 -8.266 1.287 7.652 1093 1HG2 ILE 137 1HG2 ILE 137 -6.663 -0.533 6.037 1094 2HG2 ILE 137 2HG2 ILE 137 -7.627 -1.179 7.365 1095 3HG2 ILE 137 3HG2 ILE 137 -5.909 -1.566 7.251 1096 1HD1 ILE 137 1HD1 ILE 137 -8.962 0.823 10.106 1097 2HD1 ILE 137 2HD1 ILE 137 -7.674 -0.383 10.049 1098 3HD1 ILE 137 3HD1 ILE 137 -9.022 -0.479 8.914 1099 H LEU 138 H LEU 138 -4.098 2.225 8.599 1100 HA LEU 138 HA LEU 138 -2.099 1.416 6.862 1101 1HB LEU 138 2HB LEU 138 -2.503 3.739 8.648 1102 2HB LEU 138 1HB LEU 138 -0.867 3.468 8.086 1103 HG LEU 138 HG LEU 138 -1.933 5.035 6.618 1104 1HD1 LEU 138 1HD1 LEU 138 -0.454 3.212 5.680 1105 2HD1 LEU 138 2HD1 LEU 138 -1.526 4.017 4.536 1106 3HD1 LEU 138 3HD1 LEU 138 -1.935 2.415 5.148 1107 1HD2 LEU 138 1HD2 LEU 138 -4.045 2.962 6.059 1108 2HD2 LEU 138 2HD2 LEU 138 -3.972 4.618 5.456 1109 3HD2 LEU 138 3HD2 LEU 138 -4.264 4.316 7.168 1110 H SER 139 H SER 139 -1.753 1.951 10.371 1111 HA SER 139 HA SER 139 0.893 1.104 10.564 1112 1HB SER 139 2HB SER 139 0.650 1.294 12.849 1113 2HB SER 139 1HB SER 139 -0.711 2.271 12.296 1114 HG SER 139 HG SER 139 -2.013 0.357 12.552 1115 H LEU 140 H LEU 140 -2.094 -0.798 11.078 1116 HA LEU 140 HA LEU 140 -0.733 -3.185 11.747 1117 1HB LEU 140 2HB LEU 140 -3.196 -2.544 12.123 1118 2HB LEU 140 1HB LEU 140 -3.454 -3.107 10.482 1119 HG LEU 140 HG LEU 140 -2.215 -5.267 11.420 1120 1HD1 LEU 140 1HD1 LEU 140 -2.876 -3.704 13.786 1121 2HD1 LEU 140 2HD1 LEU 140 -1.816 -5.101 13.608 1122 3HD1 LEU 140 3HD1 LEU 140 -3.551 -5.334 13.816 1123 1HD2 LEU 140 1HD2 LEU 140 -4.505 -6.143 12.015 1124 2HD2 LEU 140 2HD2 LEU 140 -4.353 -5.409 10.418 1125 3HD2 LEU 140 3HD2 LEU 140 -5.109 -4.510 11.733 1126 H ALA 141 H ALA 141 -2.424 -2.344 8.721 1127 HA ALA 141 HA ALA 141 -1.715 -4.571 7.251 1128 1HB ALA 141 1HB ALA 141 -1.957 -1.857 6.000 1129 2HB ALA 141 2HB ALA 141 -3.352 -2.707 6.667 1130 3HB ALA 141 3HB ALA 141 -2.430 -3.424 5.345 1131 H CYS 142 H CYS 142 0.025 -1.448 7.388 1132 HA CYS 142 HA CYS 142 2.062 -2.196 5.591 1133 1HB CYS 142 2HB CYS 142 1.542 0.146 6.251 1134 2HB CYS 142 1HB CYS 142 2.251 -0.173 7.829 1135 HG CYS 142 HG CYS 142 4.403 -1.015 5.493 1136 H LYS 143 H LYS 143 1.870 -2.407 9.128 1137 HA LYS 143 HA LYS 143 4.518 -3.210 9.589 1138 1HB LYS 143 2HB LYS 143 1.982 -3.271 11.099 1139 2HB LYS 143 1HB LYS 143 3.187 -4.447 11.604 1140 1HG LYS 143 2HG LYS 143 4.750 -2.296 11.496 1141 2HG LYS 143 1HG LYS 143 3.208 -1.496 11.807 1142 1HD LYS 143 2HD LYS 143 2.869 -2.923 13.769 1143 2HD LYS 143 1HD LYS 143 4.413 -3.718 13.457 1144 1HE LYS 143 2HE LYS 143 5.463 -1.414 13.626 1145 2HE LYS 143 1HE LYS 143 3.918 -0.866 14.271 1146 1HZ LYS 143 1HZ LYS 143 4.128 -2.367 16.097 1147 2HZ LYS 143 2HZ LYS 143 5.564 -1.478 15.991 1148 3HZ LYS 143 3HZ LYS 143 5.517 -3.076 15.439 1149 H ASN 144 H ASN 144 1.610 -5.281 9.567 1150 HA ASN 144 HA ASN 144 2.891 -7.731 9.668 1151 1HB ASN 144 2HB ASN 144 0.281 -6.902 9.492 1152 2HB ASN 144 1HB ASN 144 0.512 -7.710 7.946 1153 1HD2 ASN 144 1HD2 ASN 144 -1.250 -8.652 9.838 1154 2HD2 ASN 144 2HD2 ASN 144 -0.673 -10.158 10.457 1155 H LEU 145 H LEU 145 1.913 -5.885 6.789 1156 HA LEU 145 HA LEU 145 2.831 -7.742 4.893 1157 1HB LEU 145 2HB LEU 145 1.713 -6.298 3.623 1158 2HB LEU 145 1HB LEU 145 1.727 -5.099 4.898 1159 HG LEU 145 HG LEU 145 4.152 -4.610 4.022 1160 1HD1 LEU 145 1HD1 LEU 145 3.726 -6.647 2.379 1161 2HD1 LEU 145 2HD1 LEU 145 4.700 -5.253 1.911 1162 3HD1 LEU 145 3HD1 LEU 145 3.019 -5.370 1.389 1163 1HD2 LEU 145 1HD2 LEU 145 1.498 -3.695 3.136 1164 2HD2 LEU 145 2HD2 LEU 145 2.849 -3.253 2.092 1165 3HD2 LEU 145 3HD2 LEU 145 2.856 -2.782 3.792 1166 H LEU 146 H LEU 146 4.464 -5.229 6.697 1167 HA LEU 146 HA LEU 146 6.825 -5.120 5.154 1168 1HB LEU 146 2HB LEU 146 7.197 -3.427 6.543 1169 2HB LEU 146 1HB LEU 146 5.817 -3.912 7.507 1170 HG LEU 146 HG LEU 146 7.679 -5.607 8.488 1171 1HD1 LEU 146 1HD1 LEU 146 9.191 -3.082 7.841 1172 2HD1 LEU 146 2HD1 LEU 146 9.423 -4.630 7.028 1173 3HD1 LEU 146 3HD1 LEU 146 9.784 -4.473 8.747 1174 1HD2 LEU 146 1HD2 LEU 146 6.165 -3.978 9.669 1175 2HD2 LEU 146 2HD2 LEU 146 7.424 -2.765 9.439 1176 3HD2 LEU 146 3HD2 LEU 146 7.754 -4.206 10.399 1177 H VAL 147 H VAL 147 5.816 -7.150 7.846 1178 HA VAL 147 HA VAL 147 8.335 -8.376 8.287 1179 HB VAL 147 HB VAL 147 5.644 -9.597 8.896 1180 1HG1 VAL 147 1HG1 VAL 147 7.169 -11.227 9.409 1181 2HG1 VAL 147 2HG1 VAL 147 7.134 -10.340 10.933 1182 3HG1 VAL 147 3HG1 VAL 147 8.446 -10.070 9.785 1183 1HG2 VAL 147 1HG2 VAL 147 5.693 -7.302 9.729 1184 2HG2 VAL 147 2HG2 VAL 147 7.217 -7.627 10.555 1185 3HG2 VAL 147 3HG2 VAL 147 5.746 -8.461 11.055 1186 H PHE 148 H PHE 148 5.416 -9.540 6.587 1187 HA PHE 148 HA PHE 148 6.574 -11.944 5.677 1188 1HB PHE 148 2HB PHE 148 4.055 -10.905 5.666 1189 2HB PHE 148 1HB PHE 148 4.482 -10.772 3.963 1190 HD1 PHE 148 1HD PHE 148 3.932 -12.542 2.618 1191 HD2 PHE 148 2HD PHE 148 4.746 -13.266 6.731 1192 HE1 PHE 148 1HE PHE 148 3.397 -14.923 2.300 1193 HE2 PHE 148 2HE PHE 148 4.215 -15.648 6.420 1194 HZ PHE 148 HZ PHE 148 3.539 -16.480 4.203 1195 H LEU 149 H LEU 149 6.194 -8.786 4.093 1196 HA LEU 149 HA LEU 149 7.261 -9.515 1.605 1197 1HB LEU 149 2HB LEU 149 5.998 -7.415 2.074 1198 2HB LEU 149 1HB LEU 149 7.399 -6.805 2.934 1199 HG LEU 149 HG LEU 149 6.927 -6.111 0.448 1200 1HD1 LEU 149 1HD1 LEU 149 9.311 -6.393 2.045 1201 2HD1 LEU 149 2HD1 LEU 149 8.822 -5.086 0.967 1202 3HD1 LEU 149 3HD1 LEU 149 9.673 -6.490 0.322 1203 1HD2 LEU 149 1HD2 LEU 149 7.074 -8.732 -0.049 1204 2HD2 LEU 149 2HD2 LEU 149 8.775 -8.313 -0.247 1205 3HD2 LEU 149 3HD2 LEU 149 7.550 -7.505 -1.224 1206 H SER 150 H SER 150 8.813 -8.462 4.585 1207 HA SER 150 HA SER 150 11.435 -8.480 3.310 1208 1HB SER 150 2HB SER 150 12.215 -7.287 5.118 1209 2HB SER 150 1HB SER 150 10.514 -6.824 5.173 1210 HG SER 150 HG SER 150 11.438 -7.544 7.210 1211 H LYS 151 H LYS 151 9.513 -10.827 4.201 1212 HA LYS 151 HA LYS 151 9.743 -12.992 4.843 1213 1HB LYS 151 2HB LYS 151 11.789 -12.607 3.231 1214 2HB LYS 151 1HB LYS 151 12.724 -12.785 4.710 1215 1HG LYS 151 2HG LYS 151 11.273 -14.948 5.001 1216 2HG LYS 151 1HG LYS 151 11.075 -14.789 3.255 1217 1HD LYS 151 2HD LYS 151 13.245 -15.291 2.827 1218 2HD LYS 151 1HD LYS 151 13.827 -14.509 4.297 1219 1HE LYS 151 2HE LYS 151 13.349 -16.374 5.619 1220 2HE LYS 151 1HE LYS 151 12.254 -17.058 4.417 1221 1HZ LYS 151 1HZ LYS 151 14.223 -17.390 2.972 1222 2HZ LYS 151 2HZ LYS 151 14.268 -18.300 4.397 1223 3HZ LYS 151 3HZ LYS 151 15.213 -16.905 4.255 1224 H HIS 152 H HIS 152 9.085 -13.050 6.924 1225 HA HIS 152 HA HIS 152 10.382 -11.952 9.131 1226 1HB HIS 152 2HB HIS 152 9.023 -13.624 10.463 1227 2HB HIS 152 1HB HIS 152 8.102 -12.596 9.370 1228 HD1 HIS 152 1HD HIS 152 8.902 -16.117 10.101 1229 HD2 HIS 152 2HD HIS 152 7.120 -13.947 7.038 1230 HE1 HIS 152 1HE HIS 152 7.693 -17.813 8.692 1231 HE2 HIS 152 2HE HIS 152 6.666 -16.485 6.813 1232 H HIS 153 H HIS 153 11.646 -12.873 10.788 1233 HA HIS 153 HA HIS 153 12.747 -15.514 10.510 1234 1HB HIS 153 2HB HIS 153 14.070 -13.384 9.194 1235 2HB HIS 153 1HB HIS 153 15.037 -13.782 10.611 1236 HD1 HIS 153 1HD HIS 153 16.376 -15.923 10.542 1237 HD2 HIS 153 2HD HIS 153 13.767 -15.540 7.330 1238 HE1 HIS 153 1HE HIS 153 16.987 -17.775 8.954 1239 HE2 HIS 153 2HE HIS 153 15.442 -17.479 6.985 1240 H HIS 154 H HIS 154 11.383 -14.896 12.587 1241 HA HIS 154 HA HIS 154 13.258 -13.990 14.670 1242 1HB HIS 154 2HB HIS 154 11.134 -12.675 14.372 1243 2HB HIS 154 1HB HIS 154 10.243 -14.113 14.858 1244 HD1 HIS 154 1HD HIS 154 13.082 -14.238 16.918 1245 HD2 HIS 154 2HD HIS 154 9.677 -11.857 16.879 1246 HE1 HIS 154 1HE HIS 154 12.894 -13.297 19.242 1247 HE2 HIS 154 2HE HIS 154 10.863 -11.807 19.177 1248 H HIS 155 H HIS 155 10.273 -15.866 14.965 1249 HA HIS 155 HA HIS 155 11.850 -18.110 16.036 1250 1HB HIS 155 2HB HIS 155 10.838 -16.831 17.886 1251 2HB HIS 155 1HB HIS 155 9.249 -17.045 17.159 1252 HD1 HIS 155 1HD HIS 155 12.007 -19.566 17.907 1253 HD2 HIS 155 2HD HIS 155 7.985 -18.875 18.688 1254 HE1 HIS 155 1HE HIS 155 11.225 -21.562 19.220 1255 HE2 HIS 155 2HE HIS 155 8.797 -21.103 19.719 1256 H HIS 156 H HIS 156 11.623 -19.672 14.568 1257 HA HIS 156 HA HIS 156 8.913 -20.248 13.563 1258 1HB HIS 156 2HB HIS 156 11.091 -19.540 12.040 1259 2HB HIS 156 1HB HIS 156 11.133 -21.299 11.961 1260 HD1 HIS 156 1HD HIS 156 8.322 -22.128 11.621 1261 HD2 HIS 156 2HD HIS 156 9.805 -18.680 9.837 1262 HE1 HIS 156 1HE HIS 156 6.779 -21.652 9.694 1263 HE2 HIS 156 2HE HIS 156 7.740 -19.605 8.583
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