NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21855 | 2i9y | 7339 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H THR 17 H THR 17 -0.299 -30.570 -0.856 2 HA THR 17 HA THR 17 -1.684 -31.525 1.501 3 HB THR 17 HB THR 17 0.422 -29.392 1.181 4 HG1 THR 17 1HG THR 17 0.820 -31.973 2.251 5 1HG2 THR 17 1HG2 THR 17 -0.563 -30.872 3.631 6 2HG2 THR 17 2HG2 THR 17 -0.900 -29.184 3.241 7 3HG2 THR 17 3HG2 THR 17 0.753 -29.694 3.590 8 H GLU 18 H GLU 18 -1.405 -28.753 -0.651 9 HA GLU 18 HA GLU 18 -2.650 -26.885 -1.017 10 1HB GLU 18 2HB GLU 18 -4.721 -28.297 0.695 11 2HB GLU 18 1HB GLU 18 -5.004 -26.859 -0.270 12 1HG GLU 18 2HG GLU 18 -4.673 -28.078 -2.289 13 2HG GLU 18 1HG GLU 18 -4.183 -29.527 -1.397 14 H ALA 19 H ALA 19 -3.925 -25.140 0.308 15 HA ALA 19 HA ALA 19 -2.433 -24.505 2.647 16 1HB ALA 19 1HB ALA 19 -4.991 -23.271 1.597 17 2HB ALA 19 2HB ALA 19 -3.364 -22.762 1.182 18 3HB ALA 19 3HB ALA 19 -3.945 -22.570 2.838 19 H SER 20 H SER 20 -2.689 -26.028 4.156 20 HA SER 20 HA SER 20 -5.129 -27.345 4.702 21 1HB SER 20 2HB SER 20 -2.592 -27.185 6.322 22 2HB SER 20 1HB SER 20 -3.888 -28.347 6.582 23 HG SER 20 HG SER 20 -3.097 -28.352 3.976 24 H SER 21 H SER 21 -3.472 -24.602 6.130 25 HA SER 21 HA SER 21 -5.446 -24.335 8.232 26 1HB SER 21 2HB SER 21 -3.213 -22.443 7.468 27 2HB SER 21 1HB SER 21 -4.032 -22.588 9.021 28 HG SER 21 HG SER 21 -3.029 -24.475 9.417 29 H LEU 22 H LEU 22 -5.291 -23.704 5.003 30 HA LEU 22 HA LEU 22 -5.996 -22.344 3.498 31 1HB LEU 22 2HB LEU 22 -8.170 -21.988 5.492 32 2HB LEU 22 1HB LEU 22 -8.226 -21.202 3.921 33 HG LEU 22 HG LEU 22 -7.885 -24.179 4.237 34 1HD1 LEU 22 1HD1 LEU 22 -10.231 -24.350 3.699 35 2HD1 LEU 22 2HD1 LEU 22 -10.383 -22.579 3.756 36 3HD1 LEU 22 3HD1 LEU 22 -9.943 -23.497 5.214 37 1HD2 LEU 22 1HD2 LEU 22 -8.595 -24.189 1.878 38 2HD2 LEU 22 2HD2 LEU 22 -7.123 -23.265 2.078 39 3HD2 LEU 22 3HD2 LEU 22 -8.654 -22.435 1.874 40 H VAL 23 H VAL 23 -5.202 -20.750 6.352 41 HA VAL 23 HA VAL 23 -5.089 -18.227 5.051 42 HB VAL 23 HB VAL 23 -5.266 -18.283 7.515 43 1HG1 VAL 23 1HG1 VAL 23 -2.532 -19.459 7.411 44 2HG1 VAL 23 2HG1 VAL 23 -3.992 -20.285 7.969 45 3HG1 VAL 23 3HG1 VAL 23 -3.324 -18.926 8.896 46 1HG2 VAL 23 1HG2 VAL 23 -2.675 -17.065 6.559 47 2HG2 VAL 23 2HG2 VAL 23 -3.507 -16.647 8.056 48 3HG2 VAL 23 3HG2 VAL 23 -4.268 -16.311 6.503 49 H GLY 24 H GLY 24 -3.681 -17.567 3.786 50 1HA GLY 24 2HA GLY 24 -1.168 -19.034 3.494 51 2HA GLY 24 1HA GLY 24 -2.074 -18.370 2.128 52 H LYS 25 H LYS 25 0.565 -17.719 2.755 53 HA LYS 25 HA LYS 25 0.241 -14.890 3.060 54 1HB LYS 25 2HB LYS 25 2.190 -14.865 4.648 55 2HB LYS 25 1HB LYS 25 0.662 -15.399 5.327 56 1HG LYS 25 2HG LYS 25 1.239 -17.578 5.281 57 2HG LYS 25 1HG LYS 25 2.683 -17.342 4.284 58 1HD LYS 25 2HD LYS 25 2.287 -16.371 7.143 59 2HD LYS 25 1HD LYS 25 3.283 -17.749 6.672 60 1HE LYS 25 2HE LYS 25 4.704 -16.232 5.321 61 2HE LYS 25 1HE LYS 25 3.738 -14.869 5.863 62 1HZ LYS 25 1HZ LYS 25 5.356 -16.631 7.609 63 2HZ LYS 25 2HZ LYS 25 4.461 -15.301 8.131 64 3HZ LYS 25 3HZ LYS 25 5.779 -15.087 7.084 65 H LEU 26 H LEU 26 2.038 -13.781 2.256 66 HA LEU 26 HA LEU 26 4.167 -15.350 1.138 67 1HB LEU 26 2HB LEU 26 2.281 -15.172 -0.583 68 2HB LEU 26 1HB LEU 26 2.562 -13.448 -0.593 69 HG LEU 26 HG LEU 26 4.624 -15.513 -1.428 70 1HD1 LEU 26 1HD1 LEU 26 4.120 -14.838 -3.688 71 2HD1 LEU 26 2HD1 LEU 26 2.814 -13.806 -3.087 72 3HD1 LEU 26 3HD1 LEU 26 2.719 -15.565 -2.891 73 1HD2 LEU 26 1HD2 LEU 26 5.611 -13.385 -0.727 74 2HD2 LEU 26 2HD2 LEU 26 4.538 -12.520 -1.818 75 3HD2 LEU 26 3HD2 LEU 26 5.769 -13.612 -2.469 76 H GLU 27 H GLU 27 5.987 -14.160 1.142 77 HA GLU 27 HA GLU 27 5.724 -11.360 1.924 78 1HB GLU 27 2HB GLU 27 7.598 -13.371 3.196 79 2HB GLU 27 1HB GLU 27 7.576 -11.646 3.534 80 1HG GLU 27 2HG GLU 27 5.279 -11.854 4.392 81 2HG GLU 27 1HG GLU 27 5.332 -13.580 4.070 82 H THR 28 H THR 28 7.048 -10.046 0.888 83 HA THR 28 HA THR 28 9.287 -11.166 -0.547 84 HB THR 28 HB THR 28 7.393 -11.193 -2.205 85 HG1 THR 28 1HG THR 28 9.145 -10.830 -3.330 86 1HG2 THR 28 1HG2 THR 28 6.055 -9.344 -1.256 87 2HG2 THR 28 2HG2 THR 28 6.391 -9.084 -2.967 88 3HG2 THR 28 3HG2 THR 28 7.301 -8.196 -1.747 89 H ASP 29 H ASP 29 10.716 -9.390 -1.271 90 HA ASP 29 HA ASP 29 10.330 -6.967 0.322 91 1HB ASP 29 2HB ASP 29 12.957 -8.469 0.042 92 2HB ASP 29 1HB ASP 29 12.721 -6.953 0.899 93 H VAL 30 H VAL 30 10.440 -5.277 -0.916 94 HA VAL 30 HA VAL 30 11.730 -5.577 -3.536 95 HB VAL 30 HB VAL 30 9.495 -3.626 -2.735 96 1HG1 VAL 30 1HG1 VAL 30 10.970 -2.633 -4.397 97 2HG1 VAL 30 2HG1 VAL 30 9.391 -3.029 -5.070 98 3HG1 VAL 30 3HG1 VAL 30 10.776 -4.057 -5.426 99 1HG2 VAL 30 1HG2 VAL 30 9.442 -6.030 -4.551 100 2HG2 VAL 30 2HG2 VAL 30 8.105 -4.913 -4.255 101 3HG2 VAL 30 3HG2 VAL 30 8.714 -5.928 -2.944 102 H GLU 31 H GLU 31 13.221 -4.037 -4.170 103 HA GLU 31 HA GLU 31 14.249 -2.471 -1.932 104 1HB GLU 31 2HB GLU 31 15.631 -2.795 -4.599 105 2HB GLU 31 1HB GLU 31 16.176 -2.325 -2.971 106 1HG GLU 31 2HG GLU 31 16.095 -4.517 -2.149 107 2HG GLU 31 1HG GLU 31 15.203 -5.094 -3.554 108 H ILE 32 H ILE 32 14.394 -0.241 -2.053 109 HA ILE 32 HA ILE 32 13.417 0.975 -4.516 110 HB ILE 32 HB ILE 32 12.279 2.719 -3.161 111 1HG1 ILE 32 2HG1 ILE 32 12.827 0.871 -0.822 112 2HG1 ILE 32 1HG1 ILE 32 13.582 2.437 -1.083 113 1HG2 ILE 32 1HG2 ILE 32 10.950 0.904 -4.087 114 2HG2 ILE 32 2HG2 ILE 32 10.305 1.384 -2.523 115 3HG2 ILE 32 3HG2 ILE 32 11.270 -0.084 -2.663 116 1HD1 ILE 32 1HD1 ILE 32 11.848 2.566 0.574 117 2HD1 ILE 32 2HD1 ILE 32 10.661 1.931 -0.569 118 3HD1 ILE 32 3HD1 ILE 32 11.399 3.512 -0.844 119 H LYS 33 H LYS 33 14.032 3.259 -4.666 120 HA LYS 33 HA LYS 33 16.803 3.623 -3.759 121 1HB LYS 33 2HB LYS 33 15.173 5.162 -5.775 122 2HB LYS 33 1HB LYS 33 16.892 5.348 -5.478 123 1HG LYS 33 2HG LYS 33 17.303 3.126 -6.353 124 2HG LYS 33 1HG LYS 33 15.568 2.883 -6.597 125 1HD LYS 33 2HD LYS 33 15.557 4.834 -8.118 126 2HD LYS 33 1HD LYS 33 17.298 4.963 -7.916 127 1HE LYS 33 2HE LYS 33 17.616 2.777 -8.897 128 2HE LYS 33 1HE LYS 33 15.872 2.548 -9.018 129 1HZ LYS 33 1HZ LYS 33 16.853 3.239 -11.131 130 2HZ LYS 33 2HZ LYS 33 17.438 4.640 -10.438 131 3HZ LYS 33 3HZ LYS 33 15.776 4.405 -10.567 132 H ALA 34 H ALA 34 13.564 4.698 -3.508 133 HA ALA 34 HA ALA 34 13.909 7.251 -2.450 134 1HB ALA 34 1HB ALA 34 11.691 5.278 -1.907 135 2HB ALA 34 2HB ALA 34 11.756 6.414 -3.255 136 3HB ALA 34 3HB ALA 34 11.635 7.014 -1.602 137 H SER 35 H SER 35 14.247 7.991 -0.516 138 HA SER 35 HA SER 35 15.662 6.472 1.397 139 1HB SER 35 2HB SER 35 15.839 9.027 0.914 140 2HB SER 35 1HB SER 35 14.316 9.112 1.713 141 HG SER 35 HG SER 35 16.031 9.550 3.111 142 H ALA 36 H ALA 36 14.893 5.449 3.255 143 HA ALA 36 HA ALA 36 12.173 4.962 3.699 144 1HB ALA 36 1HB ALA 36 13.972 3.531 4.599 145 2HB ALA 36 2HB ALA 36 12.850 4.049 5.857 146 3HB ALA 36 3HB ALA 36 14.423 4.827 5.708 147 H ASP 37 H ASP 37 14.347 7.381 4.902 148 HA ASP 37 HA ASP 37 12.670 8.553 6.859 149 1HB ASP 37 2HB ASP 37 14.901 9.767 5.221 150 2HB ASP 37 1HB ASP 37 14.142 10.553 6.596 151 H LYS 38 H LYS 38 13.094 8.999 3.459 152 HA LYS 38 HA LYS 38 11.438 11.330 3.223 153 1HB LYS 38 2HB LYS 38 13.368 10.779 1.764 154 2HB LYS 38 1HB LYS 38 12.432 9.431 1.098 155 1HG LYS 38 2HG LYS 38 10.842 10.948 0.243 156 2HG LYS 38 1HG LYS 38 11.679 12.290 1.064 157 1HD LYS 38 2HD LYS 38 13.682 11.778 -0.304 158 2HD LYS 38 1HD LYS 38 12.717 10.598 -1.196 159 1HE LYS 38 2HE LYS 38 11.175 12.289 -1.874 160 2HE LYS 38 1HE LYS 38 12.015 13.466 -0.863 161 1HZ LYS 38 1HZ LYS 38 13.235 12.116 -3.231 162 2HZ LYS 38 2HZ LYS 38 13.931 13.329 -2.280 163 3HZ LYS 38 3HZ LYS 38 12.580 13.675 -3.225 164 H PHE 39 H PHE 39 11.018 7.854 2.980 165 HA PHE 39 HA PHE 39 8.331 7.964 1.996 166 1HB PHE 39 2HB PHE 39 9.711 5.907 1.790 167 2HB PHE 39 1HB PHE 39 9.747 5.761 3.541 168 HD1 PHE 39 1HD PHE 39 7.752 5.303 0.523 169 HD2 PHE 39 2HD PHE 39 7.751 5.038 4.770 170 HE1 PHE 39 1HE PHE 39 5.694 3.951 0.440 171 HE2 PHE 39 2HE PHE 39 5.695 3.688 4.690 172 HZ PHE 39 HZ PHE 39 4.666 3.146 2.524 173 H HIS 40 H HIS 40 9.799 7.457 5.176 174 HA HIS 40 HA HIS 40 7.583 7.285 6.841 175 1HB HIS 40 2HB HIS 40 9.930 6.909 7.527 176 2HB HIS 40 1HB HIS 40 10.250 8.626 7.376 177 HD1 HIS 40 1HD HIS 40 9.579 10.121 9.391 178 HD2 HIS 40 2HD HIS 40 8.430 6.144 9.786 179 HE1 HIS 40 1HE HIS 40 8.897 9.842 11.768 180 HE2 HIS 40 2HE HIS 40 8.279 7.417 12.006 181 H HIS 41 H HIS 41 9.003 9.949 5.297 182 HA HIS 41 HA HIS 41 8.146 12.192 6.696 183 1HB HIS 41 2HB HIS 41 9.846 12.026 4.872 184 2HB HIS 41 1HB HIS 41 8.523 11.883 3.729 185 HD1 HIS 41 1HD HIS 41 6.954 14.093 3.583 186 HD2 HIS 41 2HD HIS 41 10.633 14.477 5.433 187 HE1 HIS 41 1HE HIS 41 7.408 16.533 3.613 188 HE2 HIS 41 2HE HIS 41 9.562 16.799 4.858 189 H MET 42 H MET 42 6.404 10.112 4.402 190 HA MET 42 HA MET 42 4.334 11.936 3.743 191 1HB MET 42 2HB MET 42 3.098 10.070 2.824 192 2HB MET 42 1HB MET 42 4.788 9.887 2.392 193 1HG MET 42 2HG MET 42 5.056 8.233 4.176 194 2HG MET 42 1HG MET 42 3.359 8.416 4.601 195 1HE MET 42 1HE MET 42 1.342 7.686 2.992 196 2HE MET 42 2HE MET 42 1.576 6.973 1.399 197 3HE MET 42 3HE MET 42 1.997 8.661 1.673 198 H PHE 43 H PHE 43 4.903 10.080 6.549 199 HA PHE 43 HA PHE 43 2.159 10.050 7.413 200 1HB PHE 43 2HB PHE 43 4.704 9.365 8.891 201 2HB PHE 43 1HB PHE 43 3.088 9.155 9.547 202 HD1 PHE 43 1HD PHE 43 1.607 7.421 8.653 203 HD2 PHE 43 2HD PHE 43 5.593 7.862 7.245 204 HE1 PHE 43 1HE PHE 43 1.494 5.182 7.648 205 HE2 PHE 43 2HE PHE 43 5.489 5.623 6.232 206 HZ PHE 43 HZ PHE 43 3.440 4.278 6.433 207 H ALA 44 H ALA 44 4.287 12.547 7.125 208 HA ALA 44 HA ALA 44 3.458 13.857 9.541 209 1HB ALA 44 1HB ALA 44 5.871 13.858 9.094 210 2HB ALA 44 2HB ALA 44 5.207 15.485 8.936 211 3HB ALA 44 3HB ALA 44 5.578 14.538 7.495 212 H GLY 45 H GLY 45 3.069 16.112 9.059 213 1HA GLY 45 2HA GLY 45 0.843 16.177 7.170 214 2HA GLY 45 1HA GLY 45 1.149 17.370 8.417 215 H LYS 46 H LYS 46 3.176 16.250 5.621 216 HA LYS 46 HA LYS 46 2.588 18.456 4.053 217 1HB LYS 46 2HB LYS 46 3.951 19.606 5.850 218 2HB LYS 46 1HB LYS 46 5.302 18.570 5.454 219 1HG LYS 46 2HG LYS 46 4.053 20.542 3.529 220 2HG LYS 46 1HG LYS 46 5.420 20.917 4.559 221 1HD LYS 46 2HD LYS 46 5.341 18.645 2.687 222 2HD LYS 46 1HD LYS 46 5.971 20.229 2.143 223 1HE LYS 46 2HE LYS 46 7.018 18.386 4.321 224 2HE LYS 46 1HE LYS 46 7.801 18.719 2.781 225 1HZ LYS 46 1HZ LYS 46 8.833 19.906 4.579 226 2HZ LYS 46 2HZ LYS 46 7.399 20.645 5.009 227 3HZ LYS 46 3HZ LYS 46 8.124 21.025 3.537 228 HA PRO 47 HA PRO 47 4.737 15.196 1.693 229 1HB PRO 47 2HB PRO 47 2.616 14.343 0.257 230 2HB PRO 47 1HB PRO 47 2.921 13.775 1.901 231 1HG PRO 47 2HG PRO 47 0.786 15.534 0.930 232 2HG PRO 47 1HG PRO 47 0.921 14.702 2.486 233 1HD PRO 47 2HD PRO 47 1.582 17.477 1.804 234 2HD PRO 47 1HD PRO 47 1.414 16.727 3.412 235 H HIS 48 H HIS 48 3.522 18.126 1.093 236 HA HIS 48 HA HIS 48 3.638 19.694 -0.470 237 1HB HIS 48 2HB HIS 48 5.896 18.908 -1.069 238 2HB HIS 48 1HB HIS 48 5.203 17.738 -2.184 239 HD1 HIS 48 1HD HIS 48 6.208 21.294 -1.903 240 HD2 HIS 48 2HD HIS 48 4.078 18.932 -4.579 241 HE1 HIS 48 1HE HIS 48 6.042 22.637 -3.998 242 HE2 HIS 48 2HE HIS 48 4.515 21.324 -5.473 243 H HIS 49 H HIS 49 1.645 20.000 -0.821 244 HA HIS 49 HA HIS 49 0.605 19.729 -3.375 245 1HB HIS 49 2HB HIS 49 0.162 17.337 -2.674 246 2HB HIS 49 1HB HIS 49 -0.810 17.945 -1.339 247 HD1 HIS 49 1HD HIS 49 -1.199 16.637 -4.648 248 HD2 HIS 49 2HD HIS 49 -3.036 19.690 -2.502 249 HE1 HIS 49 1HE HIS 49 -3.422 17.000 -5.755 250 HE2 HIS 49 2HE HIS 49 -4.624 18.528 -4.138 251 H VAL 50 H VAL 50 -0.367 21.628 -3.449 252 HA VAL 50 HA VAL 50 -1.732 22.572 -1.037 253 HB VAL 50 HB VAL 50 0.454 23.648 -1.193 254 1HG1 VAL 50 1HG1 VAL 50 0.869 23.417 -3.546 255 2HG1 VAL 50 2HG1 VAL 50 1.047 25.112 -3.074 256 3HG1 VAL 50 3HG1 VAL 50 -0.410 24.569 -3.918 257 1HG2 VAL 50 1HG2 VAL 50 -0.261 26.015 -1.202 258 2HG2 VAL 50 2HG2 VAL 50 -1.370 24.975 -0.303 259 3HG2 VAL 50 3HG2 VAL 50 -1.797 25.522 -1.921 260 H SER 51 H SER 51 -3.663 23.596 -1.357 261 HA SER 51 HA SER 51 -4.708 23.542 -4.039 262 1HB SER 51 2HB SER 51 -5.995 24.364 -1.420 263 2HB SER 51 1HB SER 51 -6.843 24.165 -2.957 264 HG SER 51 HG SER 51 -6.528 22.058 -2.906 265 H LYS 52 H LYS 52 -3.315 25.081 -4.902 266 HA LYS 52 HA LYS 52 -3.550 27.779 -3.844 267 1HB LYS 52 2HB LYS 52 -1.318 26.807 -4.039 268 2HB LYS 52 1HB LYS 52 -1.542 26.625 -5.768 269 1HG LYS 52 2HG LYS 52 -1.604 28.998 -6.074 270 2HG LYS 52 1HG LYS 52 -1.572 29.274 -4.333 271 1HD LYS 52 2HD LYS 52 0.591 27.923 -5.927 272 2HD LYS 52 1HD LYS 52 0.626 29.615 -5.397 273 1HE LYS 52 2HE LYS 52 0.530 28.871 -3.058 274 2HE LYS 52 1HE LYS 52 0.496 27.194 -3.573 275 1HZ LYS 52 1HZ LYS 52 2.695 27.505 -4.557 276 2HZ LYS 52 2HZ LYS 52 2.693 27.798 -2.907 277 3HZ LYS 52 3HZ LYS 52 2.739 29.093 -3.985 278 H ALA 53 H ALA 53 -3.804 29.544 -5.337 279 HA ALA 53 HA ALA 53 -4.905 30.694 -6.908 280 1HB ALA 53 1HB ALA 53 -4.918 28.135 -8.548 281 2HB ALA 53 2HB ALA 53 -3.673 29.376 -8.626 282 3HB ALA 53 3HB ALA 53 -5.316 29.745 -9.151 283 H SER 54 H SER 54 -6.069 28.946 -4.825 284 HA SER 54 HA SER 54 -8.781 28.710 -5.889 285 1HB SER 54 2HB SER 54 -7.849 26.532 -5.276 286 2HB SER 54 1HB SER 54 -7.479 27.128 -3.662 287 HG SER 54 HG SER 54 -9.409 25.990 -3.629 288 HA PRO 55 HA PRO 55 -9.477 31.656 -2.528 289 1HB PRO 55 2HB PRO 55 -11.247 33.145 -4.121 290 2HB PRO 55 1HB PRO 55 -9.560 33.549 -3.812 291 1HG PRO 55 2HG PRO 55 -10.674 32.807 -6.302 292 2HG PRO 55 1HG PRO 55 -8.957 32.938 -5.910 293 1HD PRO 55 2HD PRO 55 -10.682 30.511 -6.045 294 2HD PRO 55 1HD PRO 55 -8.951 30.707 -6.398 295 H GLY 56 H GLY 56 -10.993 29.269 -3.951 296 1HA GLY 56 2HA GLY 56 -12.886 28.497 -2.289 297 2HA GLY 56 1HA GLY 56 -13.726 29.810 -3.108 298 H ASN 57 H ASN 57 -11.476 27.319 -4.302 299 HA ASN 57 HA ASN 57 -13.053 26.940 -6.663 300 1HB ASN 57 2HB ASN 57 -10.611 26.742 -6.750 301 2HB ASN 57 1HB ASN 57 -10.667 25.402 -5.617 302 1HD2 ASN 57 1HD2 ASN 57 -9.689 23.995 -7.025 303 2HD2 ASN 57 2HD2 ASN 57 -10.487 23.367 -8.423 304 H ILE 58 H ILE 58 -14.791 25.766 -6.770 305 HA ILE 58 HA ILE 58 -15.281 23.800 -4.721 306 HB ILE 58 HB ILE 58 -17.113 24.938 -6.841 307 1HG1 ILE 58 2HG1 ILE 58 -16.994 25.360 -3.839 308 2HG1 ILE 58 1HG1 ILE 58 -16.483 26.519 -5.056 309 1HG2 ILE 58 1HG2 ILE 58 -17.733 23.056 -4.569 310 2HG2 ILE 58 2HG2 ILE 58 -17.637 22.615 -6.262 311 3HG2 ILE 58 3HG2 ILE 58 -18.912 23.724 -5.716 312 1HD1 ILE 58 1HD1 ILE 58 -18.658 27.088 -4.135 313 2HD1 ILE 58 2HD1 ILE 58 -19.296 25.524 -4.639 314 3HD1 ILE 58 3HD1 ILE 58 -18.782 26.702 -5.850 315 H GLN 59 H GLN 59 -14.672 21.867 -5.066 316 HA GLN 59 HA GLN 59 -15.427 20.329 -7.387 317 1HB GLN 59 2HB GLN 59 -13.134 19.635 -7.979 318 2HB GLN 59 1HB GLN 59 -13.350 21.362 -8.218 319 1HG GLN 59 2HG GLN 59 -12.249 21.833 -6.160 320 2HG GLN 59 1HG GLN 59 -12.062 20.115 -5.814 321 1HE2 GLN 59 1HE2 GLN 59 -9.830 20.175 -5.777 322 2HE2 GLN 59 2HE2 GLN 59 -8.864 20.411 -7.176 323 H GLY 60 H GLY 60 -15.501 20.562 -4.333 324 1HA GLY 60 2HA GLY 60 -15.761 18.858 -2.766 325 2HA GLY 60 1HA GLY 60 -14.671 17.838 -3.715 326 H CYS 61 H CYS 61 -14.060 17.908 -1.149 327 HA CYS 61 HA CYS 61 -12.158 20.041 -0.692 328 1HB CYS 61 2HB CYS 61 -13.581 19.196 1.164 329 2HB CYS 61 1HB CYS 61 -12.851 17.609 0.985 330 HG CYS 61 HG CYS 61 -10.229 18.687 1.607 331 H ASP 62 H ASP 62 -10.156 19.876 -1.398 332 HA ASP 62 HA ASP 62 -9.121 17.703 -2.820 333 1HB ASP 62 2HB ASP 62 -8.296 20.024 -3.027 334 2HB ASP 62 1HB ASP 62 -7.635 19.937 -1.405 335 H LEU 63 H LEU 63 -7.871 15.961 -2.234 336 HA LEU 63 HA LEU 63 -7.956 15.207 0.506 337 1HB LEU 63 2HB LEU 63 -6.668 13.824 -1.852 338 2HB LEU 63 1HB LEU 63 -6.628 13.180 -0.231 339 HG LEU 63 HG LEU 63 -9.134 13.051 -0.295 340 1HD1 LEU 63 1HD1 LEU 63 -10.285 13.138 -2.437 341 2HD1 LEU 63 2HD1 LEU 63 -8.800 13.687 -3.217 342 3HD1 LEU 63 3HD1 LEU 63 -9.595 14.706 -2.017 343 1HD2 LEU 63 1HD2 LEU 63 -7.760 11.098 -0.706 344 2HD2 LEU 63 2HD2 LEU 63 -7.654 11.512 -2.418 345 3HD2 LEU 63 3HD2 LEU 63 -9.206 11.065 -1.715 346 H HIS 64 H HIS 64 -6.812 16.453 1.750 347 HA HIS 64 HA HIS 64 -3.994 16.862 1.161 348 1HB HIS 64 2HB HIS 64 -5.895 18.264 2.994 349 2HB HIS 64 1HB HIS 64 -4.164 18.436 3.203 350 HD1 HIS 64 1HD HIS 64 -2.914 19.856 1.559 351 HD2 HIS 64 2HD HIS 64 -6.947 19.479 0.667 352 HE1 HIS 64 1HE HIS 64 -3.379 21.579 -0.212 353 HE2 HIS 64 2HE HIS 64 -5.805 21.316 -0.771 354 H GLU 65 H GLU 65 -2.902 17.287 3.438 355 HA GLU 65 HA GLU 65 -1.808 15.096 4.415 356 1HB GLU 65 2HB GLU 65 -2.546 17.458 6.148 357 2HB GLU 65 1HB GLU 65 -1.257 16.305 6.437 358 1HG GLU 65 2HG GLU 65 -0.204 18.251 5.629 359 2HG GLU 65 1HG GLU 65 -0.222 17.100 4.303 360 H GLY 66 H GLY 66 -2.117 13.588 5.964 361 1HA GLY 66 2HA GLY 66 -4.725 12.665 6.347 362 2HA GLY 66 1HA GLY 66 -3.282 12.046 7.130 363 H ASP 67 H ASP 67 -6.201 13.309 7.662 364 HA ASP 67 HA ASP 67 -5.488 14.022 10.408 365 1HB ASP 67 2HB ASP 67 -7.219 15.782 10.421 366 2HB ASP 67 1HB ASP 67 -6.000 16.118 9.203 367 H TRP 68 H TRP 68 -6.452 11.658 8.910 368 HA TRP 68 HA TRP 68 -9.235 11.302 9.668 369 1HB TRP 68 2HB TRP 68 -7.993 10.540 7.490 370 2HB TRP 68 1HB TRP 68 -7.412 9.217 8.482 371 HD1 TRP 68 HD TRP 68 -9.622 7.714 9.641 372 HE1 TRP 68 1HE TRP 68 -11.740 6.943 8.387 373 HE3 TRP 68 3HE TRP 68 -9.509 11.008 5.737 374 HZ2 TRP 68 2HZ TRP 68 -13.167 7.642 6.072 375 HZ3 TRP 68 3HZ TRP 68 -11.286 10.892 4.046 376 HH2 TRP 68 HH TRP 68 -13.074 9.248 4.206 377 H GLY 69 H GLY 69 -6.308 11.077 11.188 378 1HA GLY 69 2HA GLY 69 -6.123 10.476 13.475 379 2HA GLY 69 1HA GLY 69 -7.444 9.346 13.264 380 H THR 70 H THR 70 -5.269 9.061 10.772 381 HA THR 70 HA THR 70 -3.662 7.627 10.174 382 HB THR 70 HB THR 70 -3.071 7.287 13.141 383 HG1 THR 70 1HG THR 70 -2.896 9.422 11.748 384 1HG2 THR 70 1HG2 THR 70 -0.833 6.586 12.379 385 2HG2 THR 70 2HG2 THR 70 -1.352 6.738 10.702 386 3HG2 THR 70 3HG2 THR 70 -2.076 5.511 11.740 387 H VAL 71 H VAL 71 -4.619 5.908 13.176 388 HA VAL 71 HA VAL 71 -4.922 3.502 11.666 389 HB VAL 71 HB VAL 71 -5.680 4.048 14.556 390 1HG1 VAL 71 1HG1 VAL 71 -5.354 1.439 13.069 391 2HG1 VAL 71 2HG1 VAL 71 -6.877 2.124 13.626 392 3HG1 VAL 71 3HG1 VAL 71 -5.667 1.595 14.800 393 1HG2 VAL 71 1HG2 VAL 71 -3.580 2.885 15.086 394 2HG2 VAL 71 2HG2 VAL 71 -3.297 4.352 14.146 395 3HG2 VAL 71 3HG2 VAL 71 -3.219 2.775 13.362 396 H GLY 72 H GLY 72 -6.717 2.646 10.775 397 1HA GLY 72 2HA GLY 72 -8.993 2.325 10.480 398 2HA GLY 72 1HA GLY 72 -9.307 3.676 11.569 399 H SER 73 H SER 73 -6.954 4.717 9.581 400 HA SER 73 HA SER 73 -8.629 6.515 8.225 401 1HB SER 73 2HB SER 73 -6.299 7.059 8.804 402 2HB SER 73 1HB SER 73 -5.748 5.796 7.703 403 HG SER 73 HG SER 73 -6.260 7.008 6.012 404 H ILE 74 H ILE 74 -9.589 6.386 6.369 405 HA ILE 74 HA ILE 74 -8.832 4.237 4.571 406 HB ILE 74 HB ILE 74 -11.564 5.415 5.109 407 1HG1 ILE 74 2HG1 ILE 74 -10.488 2.616 5.237 408 2HG1 ILE 74 1HG1 ILE 74 -10.670 3.651 6.634 409 1HG2 ILE 74 1HG2 ILE 74 -12.402 3.949 3.316 410 2HG2 ILE 74 2HG2 ILE 74 -10.750 3.474 2.916 411 3HG2 ILE 74 3HG2 ILE 74 -11.271 5.137 2.670 412 1HD1 ILE 74 1HD1 ILE 74 -12.827 2.615 4.828 413 2HD1 ILE 74 2HD1 ILE 74 -13.100 3.691 6.208 414 3HD1 ILE 74 3HD1 ILE 74 -12.476 2.044 6.463 415 H VAL 75 H VAL 75 -7.894 4.995 2.893 416 HA VAL 75 HA VAL 75 -8.650 7.593 1.856 417 HB VAL 75 HB VAL 75 -6.577 7.800 3.257 418 1HG1 VAL 75 1HG1 VAL 75 -5.639 5.613 3.012 419 2HG1 VAL 75 2HG1 VAL 75 -4.461 6.823 2.498 420 3HG1 VAL 75 3HG1 VAL 75 -5.347 5.890 1.296 421 1HG2 VAL 75 1HG2 VAL 75 -6.124 8.228 0.301 422 2HG2 VAL 75 2HG2 VAL 75 -5.181 8.976 1.591 423 3HG2 VAL 75 3HG2 VAL 75 -6.891 9.357 1.416 424 H PHE 76 H PHE 76 -7.952 7.715 -0.449 425 HA PHE 76 HA PHE 76 -7.688 5.053 -1.549 426 1HB PHE 76 2HB PHE 76 -9.545 7.219 -2.554 427 2HB PHE 76 1HB PHE 76 -9.193 5.710 -3.403 428 HD1 PHE 76 1HD PHE 76 -9.467 3.599 -1.965 429 HD2 PHE 76 2HD PHE 76 -11.447 7.256 -1.170 430 HE1 PHE 76 1HE PHE 76 -11.129 2.385 -0.694 431 HE2 PHE 76 2HE PHE 76 -13.163 6.058 0.112 432 HZ PHE 76 HZ PHE 76 -13.019 3.608 0.364 433 H TRP 77 H TRP 77 -6.268 4.816 -3.025 434 HA TRP 77 HA TRP 77 -4.743 7.178 -3.930 435 1HB TRP 77 2HB TRP 77 -3.641 5.394 -2.513 436 2HB TRP 77 1HB TRP 77 -3.993 4.256 -3.802 437 HD1 TRP 77 HD TRP 77 -2.649 4.485 -5.954 438 HE1 TRP 77 1HE TRP 77 -0.291 5.502 -6.507 439 HE3 TRP 77 3HE TRP 77 -2.145 7.379 -1.856 440 HZ2 TRP 77 2HZ TRP 77 1.485 7.337 -5.281 441 HZ3 TRP 77 3HZ TRP 77 -0.114 8.750 -1.585 442 HH2 TRP 77 HH TRP 77 1.661 8.724 -3.262 443 H ASN 78 H ASN 78 -5.074 7.766 -5.888 444 HA ASN 78 HA ASN 78 -6.153 5.843 -7.855 445 1HB ASN 78 2HB ASN 78 -7.866 7.463 -7.059 446 2HB ASN 78 1HB ASN 78 -6.828 8.787 -7.547 447 1HD2 ASN 78 1HD2 ASN 78 -9.524 8.204 -8.343 448 2HD2 ASN 78 2HD2 ASN 78 -9.534 8.040 -10.062 449 H TYR 79 H TYR 79 -5.078 5.788 -9.712 450 HA TYR 79 HA TYR 79 -3.369 7.936 -10.548 451 1HB TYR 79 2HB TYR 79 -1.365 6.473 -10.653 452 2HB TYR 79 1HB TYR 79 -1.879 6.808 -9.008 453 HD1 TYR 79 1HD TYR 79 -1.164 4.251 -11.424 454 HD2 TYR 79 2HD TYR 79 -3.154 5.013 -7.775 455 HE1 TYR 79 1HE TYR 79 -1.170 1.830 -10.929 456 HE2 TYR 79 2HE TYR 79 -3.169 2.599 -7.257 457 HH TYR 79 HH TYR 79 -1.291 0.374 -8.962 458 H VAL 80 H VAL 80 -2.513 7.471 -12.682 459 HA VAL 80 HA VAL 80 -4.184 5.534 -14.087 460 HB VAL 80 HB VAL 80 -2.644 7.917 -15.185 461 1HG1 VAL 80 1HG1 VAL 80 -3.839 7.477 -17.283 462 2HG1 VAL 80 2HG1 VAL 80 -4.564 6.038 -16.568 463 3HG1 VAL 80 3HG1 VAL 80 -2.823 6.108 -16.825 464 1HG2 VAL 80 1HG2 VAL 80 -4.856 8.927 -15.571 465 2HG2 VAL 80 2HG2 VAL 80 -4.569 8.609 -13.855 466 3HG2 VAL 80 3HG2 VAL 80 -5.607 7.534 -14.788 467 H HIS 81 H HIS 81 -3.243 3.831 -14.912 468 HA HIS 81 HA HIS 81 -0.321 3.813 -15.168 469 1HB HIS 81 2HB HIS 81 -1.119 2.867 -12.959 470 2HB HIS 81 1HB HIS 81 -1.983 1.648 -13.876 471 HD1 HIS 81 1HD HIS 81 1.449 2.698 -12.830 472 HD2 HIS 81 2HD HIS 81 -0.443 -0.446 -14.743 473 HE1 HIS 81 1HE HIS 81 3.170 0.895 -12.976 474 HE2 HIS 81 2HE HIS 81 1.891 -1.089 -13.784 475 H ASP 82 H ASP 82 0.008 3.406 -17.256 476 HA ASP 82 HA ASP 82 -0.088 2.580 -19.358 477 1HB ASP 82 2HB ASP 82 -1.520 0.290 -17.997 478 2HB ASP 82 1HB ASP 82 -1.159 0.305 -19.715 479 H GLY 83 H GLY 83 -2.176 4.343 -18.368 480 1HA GLY 83 2HA GLY 83 -3.832 5.412 -19.642 481 2HA GLY 83 1HA GLY 83 -3.991 3.960 -20.613 482 H GLU 84 H GLU 84 -4.109 2.613 -17.762 483 HA GLU 84 HA GLU 84 -7.002 2.869 -17.571 484 1HB GLU 84 2HB GLU 84 -5.064 0.846 -16.496 485 2HB GLU 84 1HB GLU 84 -6.682 0.977 -15.841 486 1HG GLU 84 2HG GLU 84 -6.548 -0.797 -17.416 487 2HG GLU 84 1HG GLU 84 -7.612 0.455 -18.024 488 H ALA 85 H ALA 85 -8.029 3.412 -15.760 489 HA ALA 85 HA ALA 85 -6.537 5.017 -13.864 490 1HB ALA 85 1HB ALA 85 -9.506 4.485 -14.113 491 2HB ALA 85 2HB ALA 85 -8.652 5.889 -14.742 492 3HB ALA 85 3HB ALA 85 -8.763 5.636 -13.001 493 H LYS 86 H LYS 86 -5.752 4.089 -12.125 494 HA LYS 86 HA LYS 86 -6.976 1.572 -11.246 495 1HB LYS 86 2HB LYS 86 -4.143 2.477 -10.768 496 2HB LYS 86 1HB LYS 86 -4.820 0.884 -10.499 497 1HG LYS 86 2HG LYS 86 -4.455 2.196 -13.167 498 2HG LYS 86 1HG LYS 86 -3.368 0.998 -12.459 499 1HD LYS 86 2HD LYS 86 -6.286 0.435 -13.051 500 2HD LYS 86 1HD LYS 86 -5.014 0.214 -14.243 501 1HE LYS 86 2HE LYS 86 -5.532 -1.892 -13.229 502 2HE LYS 86 1HE LYS 86 -3.912 -1.371 -12.790 503 1HZ LYS 86 1HZ LYS 86 -6.302 -1.144 -10.997 504 2HZ LYS 86 2HZ LYS 86 -4.688 -0.837 -10.558 505 3HZ LYS 86 3HZ LYS 86 -5.165 -2.374 -10.926 506 H VAL 87 H VAL 87 -7.513 1.457 -9.209 507 HA VAL 87 HA VAL 87 -6.908 3.686 -7.397 508 HB VAL 87 HB VAL 87 -9.682 2.478 -7.723 509 1HG1 VAL 87 1HG1 VAL 87 -8.755 4.767 -5.993 510 2HG1 VAL 87 2HG1 VAL 87 -9.254 3.171 -5.439 511 3HG1 VAL 87 3HG1 VAL 87 -10.428 4.249 -6.196 512 1HG2 VAL 87 1HG2 VAL 87 -8.712 5.222 -8.543 513 2HG2 VAL 87 2HG2 VAL 87 -10.385 4.669 -8.600 514 3HG2 VAL 87 3HG2 VAL 87 -9.172 3.912 -9.632 515 H ALA 88 H ALA 88 -6.456 3.015 -5.381 516 HA ALA 88 HA ALA 88 -6.869 0.173 -4.805 517 1HB ALA 88 1HB ALA 88 -4.512 0.871 -4.811 518 2HB ALA 88 2HB ALA 88 -5.047 0.351 -3.215 519 3HB ALA 88 3HB ALA 88 -4.870 2.077 -3.568 520 H LYS 89 H LYS 89 -8.270 -0.345 -3.266 521 HA LYS 89 HA LYS 89 -9.296 1.751 -1.551 522 1HB LYS 89 2HB LYS 89 -10.325 -0.956 -2.384 523 2HB LYS 89 1HB LYS 89 -11.197 0.105 -1.296 524 1HG LYS 89 2HG LYS 89 -11.400 1.776 -3.058 525 2HG LYS 89 1HG LYS 89 -10.456 0.764 -4.151 526 1HD LYS 89 2HD LYS 89 -12.208 -0.959 -4.014 527 2HD LYS 89 1HD LYS 89 -13.149 0.097 -2.960 528 1HE LYS 89 2HE LYS 89 -13.320 1.741 -4.724 529 2HE LYS 89 1HE LYS 89 -12.274 0.772 -5.762 530 1HZ LYS 89 1HZ LYS 89 -14.964 -0.032 -4.786 531 2HZ LYS 89 2HZ LYS 89 -13.930 -0.979 -5.709 532 3HZ LYS 89 3HZ LYS 89 -14.573 0.441 -6.356 533 H GLU 90 H GLU 90 -8.644 1.726 0.491 534 HA GLU 90 HA GLU 90 -7.524 -0.696 1.631 535 1HB GLU 90 2HB GLU 90 -5.481 0.575 2.189 536 2HB GLU 90 1HB GLU 90 -5.690 0.305 0.461 537 1HG GLU 90 2HG GLU 90 -6.629 2.559 0.234 538 2HG GLU 90 1HG GLU 90 -6.371 2.833 1.937 539 H ARG 91 H ARG 91 -7.185 -0.490 3.840 540 HA ARG 91 HA ARG 91 -8.143 1.909 5.195 541 1HB ARG 91 2HB ARG 91 -9.986 0.328 5.319 542 2HB ARG 91 1HB ARG 91 -8.912 -0.942 5.872 543 1HG ARG 91 2HG ARG 91 -8.522 0.283 7.950 544 2HG ARG 91 1HG ARG 91 -9.571 1.581 7.378 545 1HD ARG 91 2HD ARG 91 -11.450 0.033 7.293 546 2HD ARG 91 1HD ARG 91 -10.401 -1.278 7.832 547 HE ARG 91 HE ARG 91 -10.046 0.156 9.863 548 1HH1 ARG 91 1HH1 ARG 91 -13.095 0.066 8.059 549 2HH1 ARG 91 2HH1 ARG 91 -14.053 0.572 9.365 550 1HH2 ARG 91 1HH2 ARG 91 -11.421 0.858 11.699 551 2HH2 ARG 91 2HH2 ARG 91 -13.099 1.026 11.435 552 H ILE 92 H ILE 92 -6.703 2.529 6.737 553 HA ILE 92 HA ILE 92 -4.341 0.924 7.164 554 HB ILE 92 HB ILE 92 -5.232 3.462 8.566 555 1HG1 ILE 92 2HG1 ILE 92 -3.128 2.939 6.447 556 2HG1 ILE 92 1HG1 ILE 92 -4.620 3.849 6.249 557 1HG2 ILE 92 1HG2 ILE 92 -2.978 3.564 9.527 558 2HG2 ILE 92 2HG2 ILE 92 -2.623 1.975 8.846 559 3HG2 ILE 92 3HG2 ILE 92 -3.867 2.144 10.082 560 1HD1 ILE 92 1HD1 ILE 92 -2.292 4.636 8.000 561 2HD1 ILE 92 2HD1 ILE 92 -3.765 5.567 7.797 562 3HD1 ILE 92 3HD1 ILE 92 -2.678 5.328 6.428 563 H GLU 93 H GLU 93 -4.048 -0.596 8.455 564 HA GLU 93 HA GLU 93 -6.107 -1.183 10.440 565 1HB GLU 93 2HB GLU 93 -5.262 -2.794 8.617 566 2HB GLU 93 1HB GLU 93 -3.802 -2.923 9.567 567 1HG GLU 93 2HG GLU 93 -6.561 -3.684 10.517 568 2HG GLU 93 1HG GLU 93 -5.391 -4.800 9.844 569 H ALA 94 H ALA 94 -2.593 -0.686 10.115 570 HA ALA 94 HA ALA 94 -2.393 0.193 12.845 571 1HB ALA 94 1HB ALA 94 -0.714 -1.456 13.531 572 2HB ALA 94 2HB ALA 94 -0.902 -2.295 11.995 573 3HB ALA 94 3HB ALA 94 -2.243 -2.246 13.142 574 H VAL 95 H VAL 95 -0.495 1.387 13.220 575 HA VAL 95 HA VAL 95 1.496 1.515 11.107 576 HB VAL 95 HB VAL 95 -0.088 3.980 12.001 577 1HG1 VAL 95 1HG1 VAL 95 2.499 3.909 10.424 578 2HG1 VAL 95 2HG1 VAL 95 2.316 4.526 12.064 579 3HG1 VAL 95 3HG1 VAL 95 1.508 5.338 10.722 580 1HG2 VAL 95 1HG2 VAL 95 0.555 2.868 9.275 581 2HG2 VAL 95 2HG2 VAL 95 -0.395 4.314 9.609 582 3HG2 VAL 95 3HG2 VAL 95 -0.991 2.728 10.110 583 H GLU 96 H GLU 96 3.428 1.511 11.877 584 HA GLU 96 HA GLU 96 3.955 2.247 14.679 585 1HB GLU 96 2HB GLU 96 5.696 0.791 12.669 586 2HB GLU 96 1HB GLU 96 6.201 1.262 14.252 587 1HG GLU 96 2HG GLU 96 3.952 -0.633 13.706 588 2HG GLU 96 1HG GLU 96 5.615 -1.087 14.107 589 HA PRO 97 HA PRO 97 5.588 5.892 12.618 590 1HB PRO 97 2HB PRO 97 5.962 7.370 14.885 591 2HB PRO 97 1HB PRO 97 4.410 7.244 14.054 592 1HG PRO 97 2HG PRO 97 5.377 5.820 16.487 593 2HG PRO 97 1HG PRO 97 3.766 6.468 16.128 594 1HD PRO 97 2HD PRO 97 4.416 3.834 15.932 595 2HD PRO 97 1HD PRO 97 3.149 4.596 14.955 596 H ASP 98 H ASP 98 6.943 4.234 15.422 597 HA ASP 98 HA ASP 98 9.541 5.449 15.073 598 1HB ASP 98 2HB ASP 98 8.739 4.855 17.340 599 2HB ASP 98 1HB ASP 98 8.709 3.163 16.874 600 H LYS 99 H LYS 99 8.039 2.404 14.320 601 HA LYS 99 HA LYS 99 10.557 1.259 13.381 602 1HB LYS 99 2HB LYS 99 7.798 0.092 13.361 603 2HB LYS 99 1HB LYS 99 9.301 -0.754 13.026 604 1HG LYS 99 2HG LYS 99 10.044 -0.293 15.320 605 2HG LYS 99 1HG LYS 99 8.484 0.472 15.643 606 1HD LYS 99 2HD LYS 99 7.383 -1.624 14.969 607 2HD LYS 99 1HD LYS 99 9.009 -2.305 14.785 608 1HE LYS 99 2HE LYS 99 9.465 -1.968 17.141 609 2HE LYS 99 1HE LYS 99 7.899 -1.190 17.358 610 1HZ LYS 99 1HZ LYS 99 7.864 -3.476 18.120 611 2HZ LYS 99 2HZ LYS 99 8.333 -4.023 16.598 612 3HZ LYS 99 3HZ LYS 99 6.833 -3.284 16.799 613 H ASN 100 H ASN 100 8.233 3.216 12.179 614 HA ASN 100 HA ASN 100 7.247 3.751 10.224 615 1HB ASN 100 2HB ASN 100 9.680 4.246 9.647 616 2HB ASN 100 1HB ASN 100 9.737 2.663 8.876 617 1HD2 ASN 100 1HD2 ASN 100 10.098 3.450 6.836 618 2HD2 ASN 100 2HD2 ASN 100 8.888 4.318 5.947 619 H LEU 101 H LEU 101 5.700 2.097 10.619 620 HA LEU 101 HA LEU 101 5.790 -0.104 8.649 621 1HB LEU 101 2HB LEU 101 6.221 -0.926 10.958 622 2HB LEU 101 1HB LEU 101 4.708 -0.185 11.445 623 HG LEU 101 HG LEU 101 3.528 -1.679 9.866 624 1HD1 LEU 101 1HD1 LEU 101 6.202 -2.987 9.696 625 2HD1 LEU 101 2HD1 LEU 101 5.244 -2.237 8.393 626 3HD1 LEU 101 3HD1 LEU 101 4.670 -3.705 9.189 627 1HD2 LEU 101 1HD2 LEU 101 3.656 -3.648 11.327 628 2HD2 LEU 101 2HD2 LEU 101 3.519 -2.135 12.207 629 3HD2 LEU 101 3HD2 LEU 101 5.085 -2.953 12.111 630 H ILE 102 H ILE 102 3.900 -0.326 7.526 631 HA ILE 102 HA ILE 102 1.533 0.823 8.706 632 HB ILE 102 HB ILE 102 2.265 2.593 7.272 633 1HG1 ILE 102 2HG1 ILE 102 0.007 1.115 5.886 634 2HG1 ILE 102 1HG1 ILE 102 -0.173 2.121 7.316 635 1HG2 ILE 102 1HG2 ILE 102 2.620 2.293 4.832 636 2HG2 ILE 102 2HG2 ILE 102 2.432 0.546 5.074 637 3HG2 ILE 102 3HG2 ILE 102 3.766 1.384 5.818 638 1HD1 ILE 102 1HD1 ILE 102 0.724 3.053 4.593 639 2HD1 ILE 102 2HD1 ILE 102 0.534 4.073 6.019 640 3HD1 ILE 102 3HD1 ILE 102 -0.875 3.289 5.300 641 H THR 103 H THR 103 0.009 -0.503 8.736 642 HA THR 103 HA THR 103 0.044 -2.918 7.079 643 HB THR 103 HB THR 103 -1.693 -2.245 9.461 644 HG1 THR 103 1HG THR 103 0.834 -2.487 9.462 645 1HG2 THR 103 1HG2 THR 103 -1.980 -4.670 9.601 646 2HG2 THR 103 2HG2 THR 103 -0.922 -4.883 8.210 647 3HG2 THR 103 3HG2 THR 103 -2.483 -4.087 8.012 648 H PHE 104 H PHE 104 -1.287 -3.008 5.304 649 HA PHE 104 HA PHE 104 -3.558 -1.165 5.105 650 1HB PHE 104 2HB PHE 104 -2.160 -2.833 3.015 651 2HB PHE 104 1HB PHE 104 -3.503 -1.784 2.669 652 HD1 PHE 104 1HD PHE 104 -3.145 0.724 3.091 653 HD2 PHE 104 2HD PHE 104 0.002 -2.124 2.914 654 HE1 PHE 104 1HE PHE 104 -1.547 2.523 2.578 655 HE2 PHE 104 2HE PHE 104 1.596 -0.337 2.406 656 HZ PHE 104 HZ PHE 104 0.839 1.980 2.236 657 H ARG 105 H ARG 105 -5.535 -1.949 5.064 658 HA ARG 105 HA ARG 105 -5.968 -4.860 4.984 659 1HB ARG 105 2HB ARG 105 -6.851 -3.781 6.978 660 2HB ARG 105 1HB ARG 105 -7.678 -2.583 5.989 661 1HG ARG 105 2HG ARG 105 -8.975 -4.476 4.968 662 2HG ARG 105 1HG ARG 105 -8.274 -5.512 6.209 663 1HD ARG 105 2HD ARG 105 -9.272 -4.097 7.944 664 2HD ARG 105 1HD ARG 105 -9.892 -3.044 6.659 665 HE ARG 105 HE ARG 105 -10.874 -5.434 5.978 666 1HH1 ARG 105 1HH1 ARG 105 -10.980 -3.712 9.052 667 2HH1 ARG 105 2HH1 ARG 105 -12.573 -4.184 9.423 668 1HH2 ARG 105 1HH2 ARG 105 -13.052 -6.088 6.477 669 2HH2 ARG 105 2HH2 ARG 105 -13.784 -5.584 7.919 670 H VAL 106 H VAL 106 -7.149 -5.673 3.247 671 HA VAL 106 HA VAL 106 -7.883 -3.820 1.198 672 HB VAL 106 HB VAL 106 -7.043 -6.170 0.652 673 1HG1 VAL 106 1HG1 VAL 106 -8.633 -8.007 0.791 674 2HG1 VAL 106 2HG1 VAL 106 -9.675 -6.990 1.792 675 3HG1 VAL 106 3HG1 VAL 106 -8.065 -7.430 2.358 676 1HG2 VAL 106 1HG2 VAL 106 -8.280 -4.869 -1.002 677 2HG2 VAL 106 2HG2 VAL 106 -9.800 -5.514 -0.371 678 3HG2 VAL 106 3HG2 VAL 106 -8.627 -6.595 -1.127 679 H ILE 107 H ILE 107 -9.842 -3.055 0.806 680 HA ILE 107 HA ILE 107 -12.040 -3.989 2.519 681 HB ILE 107 HB ILE 107 -12.999 -1.700 2.286 682 1HG1 ILE 107 2HG1 ILE 107 -10.311 -1.146 1.062 683 2HG1 ILE 107 1HG1 ILE 107 -11.862 -1.132 0.216 684 1HG2 ILE 107 1HG2 ILE 107 -11.448 -0.642 3.866 685 2HG2 ILE 107 2HG2 ILE 107 -10.214 -1.825 3.454 686 3HG2 ILE 107 3HG2 ILE 107 -11.687 -2.343 4.282 687 1HD1 ILE 107 1HD1 ILE 107 -12.556 0.717 1.535 688 2HD1 ILE 107 2HD1 ILE 107 -10.975 0.989 0.706 689 3HD1 ILE 107 3HD1 ILE 107 -11.030 0.598 2.455 690 H GLU 108 H GLU 108 -11.044 -3.053 -0.654 691 HA GLU 108 HA GLU 108 -13.369 -3.094 -2.105 692 1HB GLU 108 2HB GLU 108 -11.316 -2.520 -3.168 693 2HB GLU 108 1HB GLU 108 -10.625 -4.093 -2.869 694 1HG GLU 108 2HG GLU 108 -11.245 -3.865 -5.211 695 2HG GLU 108 1HG GLU 108 -12.237 -5.088 -4.432 696 H GLY 109 H GLY 109 -14.719 -4.505 -2.849 697 1HA GLY 109 2HA GLY 109 -14.903 -7.054 -1.516 698 2HA GLY 109 1HA GLY 109 -16.105 -6.344 -2.589 699 H ASP 110 H ASP 110 -13.983 -5.889 -4.603 700 HA ASP 110 HA ASP 110 -14.301 -8.187 -6.169 701 1HB ASP 110 2HB ASP 110 -13.716 -6.083 -7.206 702 2HB ASP 110 1HB ASP 110 -12.195 -6.027 -6.325 703 H LEU 111 H LEU 111 -11.533 -7.188 -4.223 704 HA LEU 111 HA LEU 111 -10.054 -9.562 -4.776 705 1HB LEU 111 2HB LEU 111 -9.690 -7.497 -2.606 706 2HB LEU 111 1HB LEU 111 -8.526 -8.753 -2.986 707 HG LEU 111 HG LEU 111 -9.349 -6.490 -4.823 708 1HD1 LEU 111 1HD1 LEU 111 -7.054 -5.684 -4.524 709 2HD1 LEU 111 2HD1 LEU 111 -6.767 -6.955 -3.336 710 3HD1 LEU 111 3HD1 LEU 111 -7.955 -5.697 -3.013 711 1HD2 LEU 111 1HD2 LEU 111 -8.813 -8.487 -6.102 712 2HD2 LEU 111 2HD2 LEU 111 -7.301 -8.670 -5.210 713 3HD2 LEU 111 3HD2 LEU 111 -7.536 -7.284 -6.274 714 H MET 112 H MET 112 -12.469 -8.694 -2.514 715 HA MET 112 HA MET 112 -11.974 -10.712 -0.558 716 1HB MET 112 2HB MET 112 -14.576 -9.276 -1.203 717 2HB MET 112 1HB MET 112 -14.332 -10.296 0.185 718 1HG MET 112 2HG MET 112 -12.694 -7.807 -0.239 719 2HG MET 112 1HG MET 112 -14.294 -7.738 0.462 720 1HE MET 112 1HE MET 112 -11.366 -10.499 1.208 721 2HE MET 112 2HE MET 112 -10.595 -9.629 2.530 722 3HE MET 112 3HE MET 112 -10.589 -8.942 0.913 723 H LYS 113 H LYS 113 -13.098 -10.884 -3.735 724 HA LYS 113 HA LYS 113 -14.890 -13.143 -3.367 725 1HB LYS 113 2HB LYS 113 -13.805 -11.960 -5.929 726 2HB LYS 113 1HB LYS 113 -15.099 -13.141 -5.807 727 1HG LYS 113 2HG LYS 113 -15.174 -10.307 -4.776 728 2HG LYS 113 1HG LYS 113 -15.956 -10.915 -6.233 729 1HD LYS 113 2HD LYS 113 -17.385 -12.353 -4.912 730 2HD LYS 113 1HD LYS 113 -16.542 -11.878 -3.435 731 1HE LYS 113 2HE LYS 113 -18.646 -10.673 -3.645 732 2HE LYS 113 1HE LYS 113 -17.274 -9.578 -3.741 733 1HZ LYS 113 1HZ LYS 113 -18.910 -9.019 -5.370 734 2HZ LYS 113 2HZ LYS 113 -18.910 -10.559 -6.026 735 3HZ LYS 113 3HZ LYS 113 -17.552 -9.573 -6.193 736 H GLU 114 H GLU 114 -11.636 -12.762 -3.449 737 HA GLU 114 HA GLU 114 -11.303 -15.554 -4.231 738 1HB GLU 114 2HB GLU 114 -9.380 -13.271 -4.718 739 2HB GLU 114 1HB GLU 114 -8.957 -14.967 -4.947 740 1HG GLU 114 2HG GLU 114 -10.603 -15.236 -6.601 741 2HG GLU 114 1HG GLU 114 -11.247 -13.613 -6.353 742 H TYR 115 H TYR 115 -10.466 -12.984 -2.020 743 HA TYR 115 HA TYR 115 -9.395 -14.996 -0.172 744 1HB TYR 115 2HB TYR 115 -8.555 -12.082 -0.261 745 2HB TYR 115 1HB TYR 115 -7.770 -13.412 0.594 746 HD1 TYR 115 1HD TYR 115 -7.962 -11.539 -2.410 747 HD2 TYR 115 2HD TYR 115 -6.659 -15.254 -0.792 748 HE1 TYR 115 1HE TYR 115 -6.609 -11.959 -4.439 749 HE2 TYR 115 2HE TYR 115 -5.326 -15.667 -2.754 750 HH TYR 115 HH TYR 115 -4.680 -13.324 -5.159 751 H LYS 116 H LYS 116 -10.552 -15.010 1.640 752 HA LYS 116 HA LYS 116 -12.754 -13.151 1.829 753 1HB LYS 116 2HB LYS 116 -13.417 -14.528 3.820 754 2HB LYS 116 1HB LYS 116 -13.336 -15.393 2.296 755 1HG LYS 116 2HG LYS 116 -11.076 -16.202 2.953 756 2HG LYS 116 1HG LYS 116 -11.313 -15.439 4.522 757 1HD LYS 116 2HD LYS 116 -13.101 -17.526 3.322 758 2HD LYS 116 1HD LYS 116 -11.839 -17.866 4.512 759 1HE LYS 116 2HE LYS 116 -13.002 -16.370 6.104 760 2HE LYS 116 1HE LYS 116 -14.264 -16.107 4.900 761 1HZ LYS 116 1HZ LYS 116 -14.910 -17.747 6.501 762 2HZ LYS 116 2HZ LYS 116 -13.573 -18.700 6.157 763 3HZ LYS 116 3HZ LYS 116 -14.771 -18.463 4.980 764 H SER 117 H SER 117 -9.667 -13.099 2.810 765 HA SER 117 HA SER 117 -9.953 -10.623 4.013 766 1HB SER 117 2HB SER 117 -8.887 -11.217 6.209 767 2HB SER 117 1HB SER 117 -10.551 -11.773 6.004 768 HG SER 117 HG SER 117 -8.624 -13.251 6.755 769 H PHE 118 H PHE 118 -8.192 -9.505 3.620 770 HA PHE 118 HA PHE 118 -5.683 -10.872 3.111 771 1HB PHE 118 2HB PHE 118 -6.654 -10.679 0.862 772 2HB PHE 118 1HB PHE 118 -7.096 -9.032 1.184 773 HD1 PHE 118 1HD PHE 118 -3.773 -10.622 1.791 774 HD2 PHE 118 2HD PHE 118 -6.071 -7.879 -0.497 775 HE1 PHE 118 1HE PHE 118 -1.726 -9.833 0.699 776 HE2 PHE 118 2HE PHE 118 -4.012 -7.061 -1.583 777 HZ PHE 118 HZ PHE 118 -1.840 -8.043 -0.982 778 H LEU 119 H LEU 119 -4.132 -9.903 4.127 779 HA LEU 119 HA LEU 119 -4.418 -7.069 4.801 780 1HB LEU 119 2HB LEU 119 -4.938 -8.664 6.672 781 2HB LEU 119 1HB LEU 119 -3.311 -9.285 6.524 782 HG LEU 119 HG LEU 119 -2.469 -7.005 7.101 783 1HD1 LEU 119 1HD1 LEU 119 -4.052 -5.453 8.158 784 2HD1 LEU 119 2HD1 LEU 119 -5.385 -6.502 7.671 785 3HD1 LEU 119 3HD1 LEU 119 -4.401 -5.699 6.448 786 1HD2 LEU 119 1HD2 LEU 119 -2.985 -7.203 9.475 787 2HD2 LEU 119 2HD2 LEU 119 -2.610 -8.774 8.763 788 3HD2 LEU 119 3HD2 LEU 119 -4.284 -8.334 9.103 789 H LEU 120 H LEU 120 -2.610 -5.965 4.196 790 HA LEU 120 HA LEU 120 -0.167 -7.496 3.857 791 1HB LEU 120 2HB LEU 120 0.448 -6.311 1.813 792 2HB LEU 120 1HB LEU 120 -1.022 -7.218 1.589 793 HG LEU 120 HG LEU 120 -0.916 -4.219 1.996 794 1HD1 LEU 120 1HD1 LEU 120 -1.303 -4.065 -0.396 795 2HD1 LEU 120 2HD1 LEU 120 -1.228 -5.821 -0.534 796 3HD1 LEU 120 3HD1 LEU 120 0.208 -4.911 -0.058 797 1HD2 LEU 120 1HD2 LEU 120 -3.083 -5.224 2.597 798 2HD2 LEU 120 2HD2 LEU 120 -3.147 -6.022 1.026 799 3HD2 LEU 120 3HD2 LEU 120 -3.212 -4.263 1.122 800 H THR 121 H THR 121 1.468 -6.684 4.766 801 HA THR 121 HA THR 121 1.225 -3.949 5.850 802 HB THR 121 HB THR 121 2.807 -6.239 7.020 803 HG1 THR 121 1HG THR 121 0.199 -5.979 6.869 804 1HG2 THR 121 1HG2 THR 121 3.433 -3.968 7.665 805 2HG2 THR 121 2HG2 THR 121 2.734 -4.848 9.031 806 3HG2 THR 121 3HG2 THR 121 1.780 -3.641 8.160 807 H ILE 122 H ILE 122 2.918 -2.548 5.346 808 HA ILE 122 HA ILE 122 5.325 -3.809 4.262 809 HB ILE 122 HB ILE 122 5.740 -1.853 2.861 810 1HG1 ILE 122 2HG1 ILE 122 3.000 -0.915 3.680 811 2HG1 ILE 122 1HG1 ILE 122 4.516 -0.194 4.195 812 1HG2 ILE 122 1HG2 ILE 122 4.583 -3.736 1.876 813 2HG2 ILE 122 2HG2 ILE 122 3.978 -2.227 1.187 814 3HG2 ILE 122 3HG2 ILE 122 3.033 -3.084 2.404 815 1HD1 ILE 122 1HD1 ILE 122 3.526 -0.320 1.349 816 2HD1 ILE 122 2HD1 ILE 122 5.033 0.417 1.890 817 3HD1 ILE 122 3HD1 ILE 122 3.487 1.097 2.398 818 H GLN 123 H GLN 123 7.243 -3.027 4.863 819 HA GLN 123 HA GLN 123 7.274 -0.800 6.768 820 1HB GLN 123 2HB GLN 123 7.355 -3.031 7.962 821 2HB GLN 123 1HB GLN 123 8.860 -3.344 7.123 822 1HG GLN 123 2HG GLN 123 9.905 -1.443 8.192 823 2HG GLN 123 1HG GLN 123 8.392 -1.033 8.995 824 1HE2 GLN 123 1HE2 GLN 123 9.216 -1.238 11.029 825 2HE2 GLN 123 2HE2 GLN 123 9.629 -2.769 11.725 826 H VAL 124 H VAL 124 8.635 0.666 6.056 827 HA VAL 124 HA VAL 124 10.723 -0.153 4.148 828 HB VAL 124 HB VAL 124 9.566 2.613 4.598 829 1HG1 VAL 124 1HG1 VAL 124 10.723 3.195 2.519 830 2HG1 VAL 124 2HG1 VAL 124 11.419 1.573 2.469 831 3HG1 VAL 124 3HG1 VAL 124 11.843 2.672 3.777 832 1HG2 VAL 124 1HG2 VAL 124 7.898 1.129 3.644 833 2HG2 VAL 124 2HG2 VAL 124 9.027 0.655 2.370 834 3HG2 VAL 124 3HG2 VAL 124 8.428 2.313 2.451 835 H THR 125 H THR 125 12.618 -0.371 5.137 836 HA THR 125 HA THR 125 13.406 1.752 6.951 837 HB THR 125 HB THR 125 12.487 -0.318 8.236 838 HG1 THR 125 1HG THR 125 15.034 -0.189 9.177 839 1HG2 THR 125 1HG2 THR 125 13.527 -2.056 6.824 840 2HG2 THR 125 2HG2 THR 125 14.048 -2.193 8.508 841 3HG2 THR 125 3HG2 THR 125 15.119 -1.456 7.314 842 HA PRO 126 HA PRO 126 17.318 1.462 4.695 843 1HB PRO 126 2HB PRO 126 19.071 1.675 6.816 844 2HB PRO 126 1HB PRO 126 18.286 3.071 6.065 845 1HG PRO 126 2HG PRO 126 17.443 1.501 8.475 846 2HG PRO 126 1HG PRO 126 17.558 3.279 8.309 847 1HD PRO 126 2HD PRO 126 15.231 2.083 8.152 848 2HD PRO 126 1HD PRO 126 15.632 3.317 6.934 849 H LYS 127 H LYS 127 18.475 -0.296 4.108 850 HA LYS 127 HA LYS 127 18.885 -2.343 6.113 851 1HB LYS 127 2HB LYS 127 16.801 -2.967 5.033 852 2HB LYS 127 1HB LYS 127 17.561 -2.899 3.462 853 1HG LYS 127 2HG LYS 127 18.854 -4.847 3.933 854 2HG LYS 127 1HG LYS 127 18.330 -4.845 5.622 855 1HD LYS 127 2HD LYS 127 16.026 -5.187 4.927 856 2HD LYS 127 1HD LYS 127 16.477 -5.168 3.243 857 1HE LYS 127 2HE LYS 127 17.490 -7.145 5.279 858 2HE LYS 127 1HE LYS 127 16.155 -7.450 4.173 859 1HZ LYS 127 1HZ LYS 127 18.240 -8.391 3.403 860 2HZ LYS 127 2HZ LYS 127 18.964 -6.876 3.322 861 3HZ LYS 127 3HZ LYS 127 17.663 -7.253 2.330 862 HA PRO 128 HA PRO 128 22.261 -3.103 2.790 863 1HB PRO 128 2HB PRO 128 22.443 -1.224 0.778 864 2HB PRO 128 1HB PRO 128 21.671 -2.796 0.575 865 1HG PRO 128 2HG PRO 128 20.453 -0.131 1.115 866 2HG PRO 128 1HG PRO 128 19.894 -1.425 0.034 867 1HD PRO 128 2HD PRO 128 18.773 -0.993 2.437 868 2HD PRO 128 1HD PRO 128 18.959 -2.628 1.765 869 H GLY 129 H GLY 129 21.145 0.168 3.464 870 1HA GLY 129 2HA GLY 129 22.606 1.023 5.399 871 2HA GLY 129 1HA GLY 129 23.880 0.949 4.192 872 H GLY 130 H GLY 130 22.577 3.162 5.757 873 1HA GLY 130 2HA GLY 130 22.217 5.377 5.452 874 2HA GLY 130 1HA GLY 130 22.893 5.179 3.846 875 HA PRO 131 HA PRO 131 18.709 6.423 2.734 876 1HB PRO 131 2HB PRO 131 19.197 6.849 0.116 877 2HB PRO 131 1HB PRO 131 19.736 7.985 1.364 878 1HG PRO 131 2HG PRO 131 21.293 5.837 -0.029 879 2HG PRO 131 1HG PRO 131 21.766 7.515 0.292 880 1HD PRO 131 2HD PRO 131 22.587 5.442 1.817 881 2HD PRO 131 1HD PRO 131 22.303 7.060 2.497 882 H GLY 132 H GLY 132 20.598 3.793 1.582 883 1HA GLY 132 2HA GLY 132 18.808 2.629 -0.243 884 2HA GLY 132 1HA GLY 132 20.082 1.782 0.638 885 H SER 133 H SER 133 16.784 2.181 0.251 886 HA SER 133 HA SER 133 16.267 1.014 2.867 887 1HB SER 133 2HB SER 133 14.485 2.775 1.195 888 2HB SER 133 1HB SER 133 14.171 2.184 2.833 889 HG SER 133 HG SER 133 16.228 3.910 1.972 890 H ILE 134 H ILE 134 14.824 -0.638 2.959 891 HA ILE 134 HA ILE 134 14.121 -1.879 0.405 892 HB ILE 134 HB ILE 134 14.855 -3.144 3.046 893 1HG1 ILE 134 2HG1 ILE 134 16.706 -2.323 1.746 894 2HG1 ILE 134 1HG1 ILE 134 16.697 -4.102 1.749 895 1HG2 ILE 134 1HG2 ILE 134 14.551 -5.323 1.941 896 2HG2 ILE 134 2HG2 ILE 134 13.930 -4.504 0.507 897 3HG2 ILE 134 3HG2 ILE 134 13.038 -4.417 2.025 898 1HD1 ILE 134 1HD1 ILE 134 15.881 -2.247 -0.451 899 2HD1 ILE 134 2HD1 ILE 134 15.630 -3.983 -0.426 900 3HD1 ILE 134 3HD1 ILE 134 17.280 -3.336 -0.408 901 H VAL 135 H VAL 135 12.031 -2.438 0.259 902 HA VAL 135 HA VAL 135 10.336 -1.819 2.554 903 HB VAL 135 HB VAL 135 9.645 -0.502 0.598 904 1HG1 VAL 135 1HG1 VAL 135 9.176 -3.088 -0.808 905 2HG1 VAL 135 2HG1 VAL 135 10.430 -1.906 -1.187 906 3HG1 VAL 135 3HG1 VAL 135 8.727 -1.494 -1.414 907 1HG2 VAL 135 1HG2 VAL 135 7.638 -2.657 1.218 908 2HG2 VAL 135 2HG2 VAL 135 7.270 -1.095 0.490 909 3HG2 VAL 135 3HG2 VAL 135 7.889 -1.177 2.139 910 H HIS 136 H HIS 136 9.649 -3.330 3.685 911 HA HIS 136 HA HIS 136 9.823 -6.069 2.720 912 1HB HIS 136 2HB HIS 136 9.027 -5.045 5.447 913 2HB HIS 136 1HB HIS 136 9.344 -6.713 5.017 914 HD1 HIS 136 1HD HIS 136 11.919 -7.173 4.291 915 HD2 HIS 136 2HD HIS 136 11.122 -3.687 6.366 916 HE1 HIS 136 1HE HIS 136 14.116 -6.496 5.328 917 HE2 HIS 136 2HE HIS 136 13.362 -4.723 6.958 918 H TRP 137 H TRP 137 8.085 -6.894 1.737 919 HA TRP 137 HA TRP 137 5.473 -5.875 2.498 920 1HB TRP 137 2HB TRP 137 6.325 -7.627 0.180 921 2HB TRP 137 1HB TRP 137 4.685 -7.158 0.543 922 HD1 TRP 137 HD TRP 137 8.038 -5.371 -0.451 923 HE1 TRP 137 1HE TRP 137 7.394 -3.327 -1.821 924 HE3 TRP 137 3HE TRP 137 2.932 -5.653 -0.070 925 HZ2 TRP 137 2HZ TRP 137 5.132 -1.990 -2.626 926 HZ3 TRP 137 3HZ TRP 137 1.590 -3.932 -1.175 927 HH2 TRP 137 HH TRP 137 2.653 -2.117 -2.440 928 H HIS 138 H HIS 138 4.377 -6.960 3.868 929 HA HIS 138 HA HIS 138 4.830 -9.846 4.185 930 1HB HIS 138 2HB HIS 138 5.558 -8.605 6.160 931 2HB HIS 138 1HB HIS 138 4.073 -7.683 6.164 932 HD1 HIS 138 1HD HIS 138 5.494 -11.051 7.108 933 HD2 HIS 138 2HD HIS 138 1.981 -8.870 7.444 934 HE1 HIS 138 1HE HIS 138 4.130 -12.246 8.824 935 HE2 HIS 138 2HE HIS 138 1.881 -11.069 8.760 936 H LEU 139 H LEU 139 3.142 -10.862 3.172 937 HA LEU 139 HA LEU 139 0.530 -9.546 3.293 938 1HB LEU 139 2HB LEU 139 1.577 -11.456 1.206 939 2HB LEU 139 1HB LEU 139 -0.023 -10.772 1.226 940 HG LEU 139 HG LEU 139 1.152 -8.480 0.906 941 1HD1 LEU 139 1HD1 LEU 139 3.380 -9.088 1.526 942 2HD1 LEU 139 2HD1 LEU 139 3.319 -8.526 -0.153 943 3HD1 LEU 139 3HD1 LEU 139 3.457 -10.245 0.195 944 1HD2 LEU 139 1HD2 LEU 139 1.330 -10.566 -1.248 945 2HD2 LEU 139 2HD2 LEU 139 1.345 -8.818 -1.490 946 3HD2 LEU 139 3HD2 LEU 139 -0.091 -9.606 -0.842 947 H GLU 140 H GLU 140 -1.105 -10.661 4.048 948 HA GLU 140 HA GLU 140 -0.897 -13.545 4.436 949 1HB GLU 140 2HB GLU 140 -1.752 -11.580 6.584 950 2HB GLU 140 1HB GLU 140 -1.953 -13.323 6.692 951 1HG GLU 140 2HG GLU 140 0.492 -13.584 6.562 952 2HG GLU 140 1HG GLU 140 0.652 -11.832 6.520 953 H TYR 141 H TYR 141 -2.686 -14.560 3.848 954 HA TYR 141 HA TYR 141 -5.193 -13.111 3.718 955 1HB TYR 141 2HB TYR 141 -5.500 -13.660 1.267 956 2HB TYR 141 1HB TYR 141 -4.370 -12.375 1.630 957 HD1 TYR 141 1HD TYR 141 -1.904 -12.866 1.523 958 HD2 TYR 141 2HD TYR 141 -4.833 -15.579 0.096 959 HE1 TYR 141 1HE TYR 141 -0.189 -13.972 0.239 960 HE2 TYR 141 2HE TYR 141 -3.176 -16.726 -1.221 961 HH TYR 141 HH TYR 141 0.204 -16.250 -0.828 962 H GLU 142 H GLU 142 -6.946 -14.290 3.706 963 HA GLU 142 HA GLU 142 -6.613 -17.131 4.318 964 1HB GLU 142 2HB GLU 142 -7.799 -15.575 5.849 965 2HB GLU 142 1HB GLU 142 -8.967 -15.262 4.586 966 1HG GLU 142 2HG GLU 142 -9.948 -16.739 6.140 967 2HG GLU 142 1HG GLU 142 -9.596 -17.665 4.686 968 H LYS 143 H LYS 143 -6.849 -18.479 2.632 969 HA LYS 143 HA LYS 143 -8.033 -17.836 0.149 970 1HB LYS 143 2HB LYS 143 -7.274 -20.452 1.409 971 2HB LYS 143 1HB LYS 143 -8.147 -20.403 -0.099 972 1HG LYS 143 2HG LYS 143 -5.829 -20.769 -0.523 973 2HG LYS 143 1HG LYS 143 -6.271 -19.176 -1.100 974 1HD LYS 143 2HD LYS 143 -5.181 -18.145 0.753 975 2HD LYS 143 1HD LYS 143 -4.875 -19.727 1.507 976 1HE LYS 143 2HE LYS 143 -3.858 -18.850 -1.181 977 2HE LYS 143 1HE LYS 143 -2.892 -18.835 0.293 978 1HZ LYS 143 1HZ LYS 143 -2.516 -20.829 -1.090 979 2HZ LYS 143 2HZ LYS 143 -4.109 -21.347 -0.859 980 3HZ LYS 143 3HZ LYS 143 -3.061 -21.190 0.439 981 H ILE 144 H ILE 144 -10.126 -17.925 -0.461 982 HA ILE 144 HA ILE 144 -12.146 -18.886 1.315 983 HB ILE 144 HB ILE 144 -12.268 -18.314 -1.671 984 1HG1 ILE 144 2HG1 ILE 144 -13.074 -16.664 0.715 985 2HG1 ILE 144 1HG1 ILE 144 -11.680 -16.370 -0.323 986 1HG2 ILE 144 1HG2 ILE 144 -14.508 -18.709 0.312 987 2HG2 ILE 144 2HG2 ILE 144 -14.074 -19.818 -0.993 988 3HG2 ILE 144 3HG2 ILE 144 -14.703 -18.211 -1.368 989 1HD1 ILE 144 1HD1 ILE 144 -13.495 -14.870 -0.820 990 2HD1 ILE 144 2HD1 ILE 144 -14.565 -16.245 -1.113 991 3HD1 ILE 144 3HD1 ILE 144 -13.186 -15.949 -2.187 992 H SER 145 H SER 145 -10.423 -20.050 -1.463 993 HA SER 145 HA SER 145 -10.279 -22.663 -0.528 994 1HB SER 145 2HB SER 145 -12.588 -22.760 -1.571 995 2HB SER 145 1HB SER 145 -11.878 -22.240 -3.095 996 HG SER 145 HG SER 145 -11.685 -24.685 -1.755 997 H GLU 146 H GLU 146 -9.031 -23.910 -2.395 998 HA GLU 146 HA GLU 146 -6.755 -22.334 -2.687 999 1HB GLU 146 2HB GLU 146 -7.453 -25.017 -3.611 1000 2HB GLU 146 1HB GLU 146 -5.889 -24.305 -3.989 1001 1HG GLU 146 2HG GLU 146 -6.961 -24.560 -1.178 1002 2HG GLU 146 1HG GLU 146 -5.850 -25.722 -1.913 1003 H GLU 147 H GLU 147 -8.767 -23.837 -5.233 1004 HA GLU 147 HA GLU 147 -7.414 -22.699 -7.437 1005 1HB GLU 147 2HB GLU 147 -8.960 -24.645 -7.585 1006 2HB GLU 147 1HB GLU 147 -10.303 -23.573 -7.241 1007 1HG GLU 147 2HG GLU 147 -9.800 -22.342 -9.325 1008 2HG GLU 147 1HG GLU 147 -8.542 -23.525 -9.676 1009 H VAL 148 H VAL 148 -9.521 -21.505 -5.215 1010 HA VAL 148 HA VAL 148 -10.679 -19.357 -6.785 1011 HB VAL 148 HB VAL 148 -10.765 -19.801 -3.781 1012 1HG1 VAL 148 1HG1 VAL 148 -12.400 -17.951 -5.514 1013 2HG1 VAL 148 2HG1 VAL 148 -11.174 -17.486 -4.328 1014 3HG1 VAL 148 3HG1 VAL 148 -12.668 -18.256 -3.794 1015 1HG2 VAL 148 1HG2 VAL 148 -12.794 -20.438 -5.918 1016 2HG2 VAL 148 2HG2 VAL 148 -13.025 -20.662 -4.182 1017 3HG2 VAL 148 3HG2 VAL 148 -11.802 -21.603 -5.046 1018 H ALA 149 H ALA 149 -7.989 -19.749 -4.615 1019 HA ALA 149 HA ALA 149 -7.444 -16.883 -4.564 1020 1HB ALA 149 1HB ALA 149 -7.235 -18.092 -2.501 1021 2HB ALA 149 2HB ALA 149 -5.618 -17.565 -3.019 1022 3HB ALA 149 3HB ALA 149 -6.123 -19.234 -3.245 1023 H HIS 150 H HIS 150 -5.655 -15.948 -5.576 1024 HA HIS 150 HA HIS 150 -3.891 -17.727 -7.091 1025 1HB HIS 150 2HB HIS 150 -5.273 -15.296 -8.281 1026 2HB HIS 150 1HB HIS 150 -4.015 -16.233 -9.074 1027 HD1 HIS 150 1HD HIS 150 -4.753 -18.374 -10.284 1028 HD2 HIS 150 2HD HIS 150 -7.786 -16.655 -8.022 1029 HE1 HIS 150 1HE HIS 150 -6.835 -19.598 -10.909 1030 HE2 HIS 150 2HE HIS 150 -8.419 -18.880 -9.123 1031 HA PRO 151 HA PRO 151 -1.301 -15.074 -4.340 1032 1HB PRO 151 2HB PRO 151 0.610 -16.955 -5.675 1033 2HB PRO 151 1HB PRO 151 0.568 -16.415 -3.990 1034 1HG PRO 151 2HG PRO 151 -0.369 -18.804 -4.603 1035 2HG PRO 151 1HG PRO 151 -1.249 -17.778 -3.463 1036 1HD PRO 151 2HD PRO 151 -1.891 -18.428 -6.302 1037 2HD PRO 151 1HD PRO 151 -2.982 -18.139 -4.938 1038 H GLU 152 H GLU 152 -0.923 -15.791 -7.703 1039 HA GLU 152 HA GLU 152 1.122 -14.196 -8.635 1040 1HB GLU 152 2HB GLU 152 -0.083 -15.698 -10.051 1041 2HB GLU 152 1HB GLU 152 -1.579 -14.817 -9.800 1042 1HG GLU 152 2HG GLU 152 -0.606 -12.894 -10.956 1043 2HG GLU 152 1HG GLU 152 0.846 -13.831 -11.264 1044 H THR 153 H THR 153 -2.225 -13.304 -7.944 1045 HA THR 153 HA THR 153 -2.118 -10.813 -9.228 1046 HB THR 153 HB THR 153 -4.341 -10.436 -8.286 1047 HG1 THR 153 1HG THR 153 -5.146 -11.757 -6.742 1048 1HG2 THR 153 1HG2 THR 153 -4.088 -11.953 -10.204 1049 2HG2 THR 153 2HG2 THR 153 -5.415 -12.474 -9.153 1050 3HG2 THR 153 3HG2 THR 153 -3.863 -13.306 -9.099 1051 H LEU 154 H LEU 154 -1.438 -11.796 -5.950 1052 HA LEU 154 HA LEU 154 -1.559 -9.157 -4.894 1053 1HB LEU 154 2HB LEU 154 -0.121 -11.537 -3.724 1054 2HB LEU 154 1HB LEU 154 -0.506 -10.048 -2.901 1055 HG LEU 154 HG LEU 154 -2.020 -11.524 -2.062 1056 1HD1 LEU 154 1HD1 LEU 154 -3.492 -10.201 -4.291 1057 2HD1 LEU 154 2HD1 LEU 154 -3.168 -9.548 -2.679 1058 3HD1 LEU 154 3HD1 LEU 154 -4.229 -10.953 -2.877 1059 1HD2 LEU 154 1HD2 LEU 154 -2.515 -12.643 -4.810 1060 2HD2 LEU 154 2HD2 LEU 154 -3.353 -13.121 -3.327 1061 3HD2 LEU 154 3HD2 LEU 154 -1.616 -13.380 -3.480 1062 H LEU 155 H LEU 155 1.012 -11.207 -6.166 1063 HA LEU 155 HA LEU 155 3.101 -9.459 -5.424 1064 1HB LEU 155 2HB LEU 155 3.006 -11.539 -7.588 1065 2HB LEU 155 1HB LEU 155 4.447 -10.632 -7.185 1066 HG LEU 155 HG LEU 155 2.978 -12.536 -5.362 1067 1HD1 LEU 155 1HD1 LEU 155 5.671 -12.654 -6.659 1068 2HD1 LEU 155 2HD1 LEU 155 4.272 -13.648 -7.092 1069 3HD1 LEU 155 3HD1 LEU 155 5.044 -13.821 -5.503 1070 1HD2 LEU 155 1HD2 LEU 155 5.433 -10.851 -4.872 1071 2HD2 LEU 155 2HD2 LEU 155 4.869 -12.153 -3.841 1072 3HD2 LEU 155 3HD2 LEU 155 3.876 -10.712 -4.041 1073 H GLN 156 H GLN 156 1.203 -9.704 -8.349 1074 HA GLN 156 HA GLN 156 2.540 -7.696 -9.753 1075 1HB GLN 156 2HB GLN 156 -0.357 -8.550 -9.897 1076 2HB GLN 156 1HB GLN 156 0.362 -7.400 -11.005 1077 1HG GLN 156 2HG GLN 156 1.431 -10.191 -10.677 1078 2HG GLN 156 1HG GLN 156 0.117 -9.825 -11.776 1079 1HE2 GLN 156 1HE2 GLN 156 2.872 -7.600 -11.307 1080 2HE2 GLN 156 2HE2 GLN 156 3.526 -7.860 -12.863 1081 H PHE 157 H PHE 157 -0.143 -7.525 -7.468 1082 HA PHE 157 HA PHE 157 -0.627 -4.773 -7.694 1083 1HB PHE 157 2HB PHE 157 -2.191 -6.332 -6.573 1084 2HB PHE 157 1HB PHE 157 -1.014 -6.589 -5.298 1085 HD1 PHE 157 1HD PHE 157 -1.210 -5.356 -3.358 1086 HD2 PHE 157 2HD PHE 157 -2.931 -3.856 -6.944 1087 HE1 PHE 157 1HE PHE 157 -2.222 -3.455 -2.086 1088 HE2 PHE 157 2HE PHE 157 -3.929 -1.981 -5.695 1089 HZ PHE 157 HZ PHE 157 -3.567 -1.788 -3.266 1090 H CYS 158 H CYS 158 1.573 -6.605 -5.644 1091 HA CYS 158 HA CYS 158 2.497 -4.460 -4.083 1092 1HB CYS 158 2HB CYS 158 3.902 -7.036 -4.794 1093 2HB CYS 158 1HB CYS 158 4.375 -5.941 -3.503 1094 HG CYS 158 HG CYS 158 1.471 -7.704 -3.683 1095 H VAL 159 H VAL 159 3.831 -5.901 -7.053 1096 HA VAL 159 HA VAL 159 6.157 -4.313 -7.007 1097 HB VAL 159 HB VAL 159 5.901 -6.481 -8.231 1098 1HG1 VAL 159 1HG1 VAL 159 4.447 -4.915 -10.290 1099 2HG1 VAL 159 2HG1 VAL 159 3.813 -6.195 -9.264 1100 3HG1 VAL 159 3HG1 VAL 159 5.045 -6.569 -10.480 1101 1HG2 VAL 159 1HG2 VAL 159 6.978 -4.173 -9.836 1102 2HG2 VAL 159 2HG2 VAL 159 7.369 -5.871 -10.120 1103 3HG2 VAL 159 3HG2 VAL 159 7.849 -5.090 -8.612 1104 H GLU 160 H GLU 160 3.086 -3.900 -8.579 1105 HA GLU 160 HA GLU 160 3.885 -1.664 -10.145 1106 1HB GLU 160 2HB GLU 160 1.091 -2.471 -9.324 1107 2HB GLU 160 1HB GLU 160 1.483 -1.283 -10.562 1108 1HG GLU 160 2HG GLU 160 2.180 -4.220 -10.641 1109 2HG GLU 160 1HG GLU 160 0.892 -3.439 -11.547 1110 H VAL 161 H VAL 161 2.677 -1.948 -6.900 1111 HA VAL 161 HA VAL 161 2.349 0.884 -6.583 1112 HB VAL 161 HB VAL 161 2.539 -1.291 -4.463 1113 1HG1 VAL 161 1HG1 VAL 161 1.626 0.382 -2.907 1114 2HG1 VAL 161 2HG1 VAL 161 1.706 1.606 -4.174 1115 3HG1 VAL 161 3HG1 VAL 161 3.190 0.890 -3.545 1116 1HG2 VAL 161 1HG2 VAL 161 0.577 -1.502 -5.895 1117 2HG2 VAL 161 2HG2 VAL 161 0.158 0.184 -5.590 1118 3HG2 VAL 161 3HG2 VAL 161 0.109 -0.989 -4.274 1119 H SER 162 H SER 162 4.863 -1.481 -5.788 1120 HA SER 162 HA SER 162 6.615 0.078 -4.283 1121 1HB SER 162 2HB SER 162 7.276 -2.090 -6.264 1122 2HB SER 162 1HB SER 162 8.334 -1.443 -4.999 1123 HG SER 162 HG SER 162 5.901 -2.877 -4.675 1124 H LYS 163 H LYS 163 6.629 -0.386 -7.783 1125 HA LYS 163 HA LYS 163 8.831 1.305 -8.270 1126 1HB LYS 163 2HB LYS 163 8.156 1.193 -10.632 1127 2HB LYS 163 1HB LYS 163 8.182 -0.388 -9.863 1128 1HG LYS 163 2HG LYS 163 5.728 -0.260 -9.609 1129 2HG LYS 163 1HG LYS 163 5.747 1.277 -10.471 1130 1HD LYS 163 2HD LYS 163 5.138 -0.556 -11.960 1131 2HD LYS 163 1HD LYS 163 6.687 0.153 -12.428 1132 1HE LYS 163 2HE LYS 163 7.892 -1.669 -11.422 1133 2HE LYS 163 1HE LYS 163 6.403 -2.320 -10.728 1134 1HZ LYS 163 1HZ LYS 163 6.965 -2.112 -13.641 1135 2HZ LYS 163 2HZ LYS 163 5.607 -2.793 -12.891 1136 3HZ LYS 163 3HZ LYS 163 7.104 -3.515 -12.706 1137 H GLU 164 H GLU 164 5.389 1.936 -8.009 1138 HA GLU 164 HA GLU 164 5.546 4.501 -9.227 1139 1HB GLU 164 2HB GLU 164 3.421 3.190 -9.115 1140 2HB GLU 164 1HB GLU 164 3.459 3.488 -7.363 1141 1HG GLU 164 2HG GLU 164 3.197 5.806 -7.613 1142 2HG GLU 164 1HG GLU 164 3.492 5.731 -9.341 1143 H ILE 165 H ILE 165 5.281 3.352 -5.914 1144 HA ILE 165 HA ILE 165 5.195 5.936 -4.878 1145 HB ILE 165 HB ILE 165 4.317 4.052 -3.665 1146 1HG1 ILE 165 2HG1 ILE 165 5.124 4.600 -1.410 1147 2HG1 ILE 165 1HG1 ILE 165 6.554 5.365 -2.105 1148 1HG2 ILE 165 1HG2 ILE 165 5.797 2.466 -2.431 1149 2HG2 ILE 165 2HG2 ILE 165 7.184 3.175 -3.259 1150 3HG2 ILE 165 3HG2 ILE 165 5.947 2.327 -4.182 1151 1HD1 ILE 165 1HD1 ILE 165 3.708 6.243 -2.495 1152 2HD1 ILE 165 2HD1 ILE 165 5.163 6.974 -3.193 1153 3HD1 ILE 165 3HD1 ILE 165 4.916 7.011 -1.442 1154 H ASP 166 H ASP 166 7.763 3.730 -5.433 1155 HA ASP 166 HA ASP 166 9.896 5.167 -4.254 1156 1HB ASP 166 2HB ASP 166 10.245 2.895 -4.976 1157 2HB ASP 166 1HB ASP 166 9.905 3.329 -6.646 1158 H GLU 167 H GLU 167 8.784 5.173 -7.654 1159 HA GLU 167 HA GLU 167 10.610 7.213 -8.318 1160 1HB GLU 167 2HB GLU 167 8.246 6.201 -9.869 1161 2HB GLU 167 1HB GLU 167 9.407 7.378 -10.475 1162 1HG GLU 167 2HG GLU 167 11.192 5.693 -10.058 1163 2HG GLU 167 1HG GLU 167 9.920 4.530 -9.710 1164 H HIS 168 H HIS 168 7.321 7.281 -7.244 1165 HA HIS 168 HA HIS 168 6.824 9.969 -7.940 1166 1HB HIS 168 2HB HIS 168 4.984 8.433 -7.271 1167 2HB HIS 168 1HB HIS 168 5.628 8.383 -5.638 1168 HD1 HIS 168 1HD HIS 168 3.622 10.532 -7.958 1169 HD2 HIS 168 2HD HIS 168 5.125 10.684 -4.085 1170 HE1 HIS 168 1HE HIS 168 2.516 12.514 -6.872 1171 HE2 HIS 168 2HE HIS 168 3.880 12.774 -4.753 1172 H LEU 169 H LEU 169 8.364 8.477 -5.150 1173 HA LEU 169 HA LEU 169 8.612 10.976 -3.796 1174 1HB LEU 169 2HB LEU 169 9.980 8.336 -3.283 1175 2HB LEU 169 1HB LEU 169 10.140 9.741 -2.252 1176 HG LEU 169 HG LEU 169 7.589 8.200 -2.755 1177 1HD1 LEU 169 1HD1 LEU 169 9.361 8.360 -0.322 1178 2HD1 LEU 169 2HD1 LEU 169 9.169 6.970 -1.386 1179 3HD1 LEU 169 3HD1 LEU 169 7.808 7.533 -0.417 1180 1HD2 LEU 169 1HD2 LEU 169 6.642 9.604 -0.975 1181 2HD2 LEU 169 2HD2 LEU 169 7.123 10.566 -2.368 1182 3HD2 LEU 169 3HD2 LEU 169 8.134 10.543 -0.920 1183 H LEU 170 H LEU 170 10.600 9.121 -5.986 1184 HA LEU 170 HA LEU 170 12.937 10.725 -5.624 1185 1HB LEU 170 2HB LEU 170 12.102 9.079 -8.008 1186 2HB LEU 170 1HB LEU 170 13.699 9.733 -7.738 1187 HG LEU 170 HG LEU 170 12.343 7.590 -6.114 1188 1HD1 LEU 170 1HD1 LEU 170 13.068 6.885 -8.322 1189 2HD1 LEU 170 2HD1 LEU 170 14.032 6.142 -7.054 1190 3HD1 LEU 170 3HD1 LEU 170 14.694 7.487 -7.993 1191 1HD2 LEU 170 1HD2 LEU 170 14.485 7.372 -4.949 1192 2HD2 LEU 170 2HD2 LEU 170 13.799 8.975 -4.701 1193 3HD2 LEU 170 3HD2 LEU 170 15.118 8.746 -5.848 1194 H ALA 171 H ALA 171 10.112 10.889 -7.625 1195 HA ALA 171 HA ALA 171 10.965 12.935 -9.392 1196 1HB ALA 171 1HB ALA 171 8.608 13.072 -10.007 1197 2HB ALA 171 2HB ALA 171 8.205 12.081 -8.596 1198 3HB ALA 171 3HB ALA 171 9.154 11.392 -9.912 1199 H GLU 172 H GLU 172 10.049 13.004 -6.138 1200 HA GLU 172 HA GLU 172 9.417 15.836 -6.390 1201 1HB GLU 172 2HB GLU 172 8.541 13.918 -4.265 1202 2HB GLU 172 1HB GLU 172 8.268 15.646 -4.206 1203 1HG GLU 172 2HG GLU 172 7.056 15.397 -6.397 1204 2HG GLU 172 1HG GLU 172 7.128 13.651 -6.136 1205 H GLU 173 H GLU 173 10.019 17.171 -4.652 1206 HA GLU 173 HA GLU 173 12.729 16.833 -4.010 1207 1HB GLU 173 2HB GLU 173 12.476 19.012 -2.823 1208 2HB GLU 173 1HB GLU 173 11.939 19.045 -4.489 1209 1HG GLU 173 2HG GLU 173 9.605 18.826 -3.691 1210 2HG GLU 173 1HG GLU 173 10.202 18.924 -2.038 Start of MODEL 2 1 H THR 17 H THR 17 -6.567 -29.788 -0.896 2 HA THR 17 HA THR 17 -6.586 -27.146 -0.232 3 HB THR 17 HB THR 17 -5.374 -29.432 1.319 4 HG1 THR 17 1HG THR 17 -8.047 -28.466 1.106 5 1HG2 THR 17 1HG2 THR 17 -6.106 -28.157 3.290 6 2HG2 THR 17 2HG2 THR 17 -6.700 -26.873 2.239 7 3HG2 THR 17 3HG2 THR 17 -4.973 -27.208 2.322 8 H GLU 18 H GLU 18 -3.812 -29.284 -0.726 9 HA GLU 18 HA GLU 18 -1.577 -28.979 -0.943 10 1HB GLU 18 2HB GLU 18 -2.298 -26.126 -1.640 11 2HB GLU 18 1HB GLU 18 -0.758 -26.909 -1.968 12 1HG GLU 18 2HG GLU 18 -3.419 -27.690 -3.145 13 2HG GLU 18 1HG GLU 18 -2.158 -26.772 -3.962 14 H ALA 19 H ALA 19 -2.289 -25.933 0.186 15 HA ALA 19 HA ALA 19 -0.471 -26.231 2.457 16 1HB ALA 19 1HB ALA 19 -2.179 -23.877 1.606 17 2HB ALA 19 2HB ALA 19 -0.464 -24.079 1.257 18 3HB ALA 19 3HB ALA 19 -1.007 -23.851 2.922 19 H SER 20 H SER 20 -1.347 -27.454 4.023 20 HA SER 20 HA SER 20 -4.063 -28.006 4.285 21 1HB SER 20 2HB SER 20 -2.280 -29.517 5.073 22 2HB SER 20 1HB SER 20 -1.883 -28.370 6.350 23 HG SER 20 HG SER 20 -4.466 -29.475 6.058 24 H SER 21 H SER 21 -2.173 -25.447 5.689 25 HA SER 21 HA SER 21 -4.010 -24.865 7.769 26 1HB SER 21 2HB SER 21 -2.560 -22.814 7.964 27 2HB SER 21 1HB SER 21 -1.729 -24.364 8.131 28 HG SER 21 HG SER 21 -1.024 -22.497 6.554 29 H LEU 22 H LEU 22 -3.921 -24.135 4.402 30 HA LEU 22 HA LEU 22 -4.770 -22.684 3.031 31 1HB LEU 22 2HB LEU 22 -7.108 -23.016 4.848 32 2HB LEU 22 1HB LEU 22 -7.184 -22.135 3.342 33 HG LEU 22 HG LEU 22 -6.272 -24.998 3.485 34 1HD1 LEU 22 1HD1 LEU 22 -8.465 -25.551 2.631 35 2HD1 LEU 22 2HD1 LEU 22 -8.956 -23.854 2.817 36 3HD1 LEU 22 3HD1 LEU 22 -8.518 -24.825 4.237 37 1HD2 LEU 22 1HD2 LEU 22 -6.707 -24.937 1.052 38 2HD2 LEU 22 2HD2 LEU 22 -5.475 -23.772 1.503 39 3HD2 LEU 22 3HD2 LEU 22 -7.105 -23.232 1.156 40 H VAL 23 H VAL 23 -4.319 -21.310 6.033 41 HA VAL 23 HA VAL 23 -4.921 -18.709 5.073 42 HB VAL 23 HB VAL 23 -4.866 -19.127 7.513 43 1HG1 VAL 23 1HG1 VAL 23 -1.940 -19.464 7.124 44 2HG1 VAL 23 2HG1 VAL 23 -3.072 -20.730 7.621 45 3HG1 VAL 23 3HG1 VAL 23 -2.723 -19.365 8.706 46 1HG2 VAL 23 1HG2 VAL 23 -2.807 -17.117 6.614 47 2HG2 VAL 23 2HG2 VAL 23 -3.576 -17.143 8.201 48 3HG2 VAL 23 3HG2 VAL 23 -4.543 -16.848 6.757 49 H GLY 24 H GLY 24 -3.853 -17.674 3.768 50 1HA GLY 24 2HA GLY 24 -1.280 -18.704 2.872 51 2HA GLY 24 1HA GLY 24 -2.401 -17.732 1.915 52 H LYS 25 H LYS 25 0.410 -17.516 2.959 53 HA LYS 25 HA LYS 25 0.149 -14.698 3.476 54 1HB LYS 25 2HB LYS 25 2.018 -14.925 5.148 55 2HB LYS 25 1HB LYS 25 0.427 -15.444 5.689 56 1HG LYS 25 2HG LYS 25 0.905 -17.631 5.487 57 2HG LYS 25 1HG LYS 25 2.388 -17.392 4.548 58 1HD LYS 25 2HD LYS 25 1.969 -16.616 7.459 59 2HD LYS 25 1HD LYS 25 2.869 -18.034 6.916 60 1HE LYS 25 2HE LYS 25 4.457 -16.566 5.731 61 2HE LYS 25 1HE LYS 25 3.588 -15.159 6.277 62 1HZ LYS 25 1HZ LYS 25 4.977 -17.112 8.034 63 2HZ LYS 25 2HZ LYS 25 4.093 -15.779 8.585 64 3HZ LYS 25 3HZ LYS 25 5.494 -15.570 7.668 65 H LEU 26 H LEU 26 1.761 -13.575 2.639 66 HA LEU 26 HA LEU 26 3.947 -15.075 1.495 67 1HB LEU 26 2HB LEU 26 2.038 -14.865 -0.181 68 2HB LEU 26 1HB LEU 26 2.286 -13.139 -0.142 69 HG LEU 26 HG LEU 26 4.325 -15.149 -1.089 70 1HD1 LEU 26 1HD1 LEU 26 3.751 -14.385 -3.324 71 2HD1 LEU 26 2HD1 LEU 26 2.453 -13.402 -2.642 72 3HD1 LEU 26 3HD1 LEU 26 2.393 -15.170 -2.505 73 1HD2 LEU 26 1HD2 LEU 26 5.320 -13.017 -0.352 74 2HD2 LEU 26 2HD2 LEU 26 4.241 -12.148 -1.443 75 3HD2 LEU 26 3HD2 LEU 26 5.467 -13.235 -2.094 76 H GLU 27 H GLU 27 5.764 -13.880 1.465 77 HA GLU 27 HA GLU 27 5.524 -11.087 2.258 78 1HB GLU 27 2HB GLU 27 5.905 -12.523 4.279 79 2HB GLU 27 1HB GLU 27 7.412 -13.062 3.561 80 1HG GLU 27 2HG GLU 27 8.322 -10.853 3.694 81 2HG GLU 27 1HG GLU 27 6.778 -10.207 4.249 82 H THR 28 H THR 28 6.715 -9.855 0.993 83 HA THR 28 HA THR 28 8.940 -11.088 -0.438 84 HB THR 28 HB THR 28 6.994 -11.117 -1.993 85 HG1 THR 28 1HG THR 28 7.986 -9.502 -3.579 86 1HG2 THR 28 1HG2 THR 28 5.724 -9.244 -1.047 87 2HG2 THR 28 2HG2 THR 28 5.986 -9.018 -2.777 88 3HG2 THR 28 3HG2 THR 28 6.955 -8.114 -1.618 89 H ASP 29 H ASP 29 10.295 -9.342 -1.499 90 HA ASP 29 HA ASP 29 10.228 -6.887 0.063 91 1HB ASP 29 2HB ASP 29 12.685 -6.902 0.287 92 2HB ASP 29 1HB ASP 29 11.977 -8.217 1.187 93 H VAL 30 H VAL 30 10.338 -5.173 -1.087 94 HA VAL 30 HA VAL 30 11.475 -5.344 -3.790 95 HB VAL 30 HB VAL 30 9.168 -3.549 -2.872 96 1HG1 VAL 30 1HG1 VAL 30 10.585 -2.443 -4.519 97 2HG1 VAL 30 2HG1 VAL 30 9.019 -2.884 -5.211 98 3HG1 VAL 30 3HG1 VAL 30 10.451 -3.844 -5.580 99 1HG2 VAL 30 1HG2 VAL 30 9.210 -5.863 -4.783 100 2HG2 VAL 30 2HG2 VAL 30 7.819 -4.820 -4.451 101 3HG2 VAL 30 3HG2 VAL 30 8.470 -5.865 -3.172 102 H GLU 31 H GLU 31 13.064 -3.935 -4.182 103 HA GLU 31 HA GLU 31 13.630 -2.076 -2.067 104 1HB GLU 31 2HB GLU 31 15.880 -1.768 -3.151 105 2HB GLU 31 1HB GLU 31 15.537 -3.356 -2.506 106 1HG GLU 31 2HG GLU 31 16.729 -3.580 -4.551 107 2HG GLU 31 1HG GLU 31 15.073 -4.140 -4.791 108 H ILE 32 H ILE 32 13.835 -0.013 -2.183 109 HA ILE 32 HA ILE 32 12.894 1.279 -4.642 110 HB ILE 32 HB ILE 32 12.134 3.170 -3.208 111 1HG1 ILE 32 2HG1 ILE 32 12.814 1.319 -0.898 112 2HG1 ILE 32 1HG1 ILE 32 13.659 2.802 -1.304 113 1HG2 ILE 32 1HG2 ILE 32 10.515 1.498 -3.892 114 2HG2 ILE 32 2HG2 ILE 32 10.138 2.064 -2.267 115 3HG2 ILE 32 3HG2 ILE 32 10.919 0.501 -2.496 116 1HD1 ILE 32 1HD1 ILE 32 12.169 3.112 0.583 117 2HD1 ILE 32 2HD1 ILE 32 10.794 2.593 -0.389 118 3HD1 ILE 32 3HD1 ILE 32 11.649 4.089 -0.789 119 H LYS 33 H LYS 33 13.822 3.398 -5.028 120 HA LYS 33 HA LYS 33 16.698 3.284 -4.700 121 1HB LYS 33 2HB LYS 33 14.982 5.384 -6.003 122 2HB LYS 33 1HB LYS 33 16.714 5.167 -6.223 123 1HG LYS 33 2HG LYS 33 16.356 3.047 -7.290 124 2HG LYS 33 1HG LYS 33 14.624 3.147 -6.967 125 1HD LYS 33 2HD LYS 33 14.559 5.206 -8.356 126 2HD LYS 33 1HD LYS 33 16.254 4.924 -8.771 127 1HE LYS 33 2HE LYS 33 14.746 4.059 -10.496 128 2HE LYS 33 1HE LYS 33 15.674 2.772 -9.723 129 1HZ LYS 33 1HZ LYS 33 13.279 2.268 -10.053 130 2HZ LYS 33 2HZ LYS 33 12.893 3.492 -8.962 131 3HZ LYS 33 3HZ LYS 33 13.760 2.155 -8.432 132 H ALA 34 H ALA 34 14.127 4.718 -3.075 133 HA ALA 34 HA ALA 34 15.644 7.001 -2.119 134 1HB ALA 34 1HB ALA 34 12.826 6.163 -1.502 135 2HB ALA 34 2HB ALA 34 13.307 7.312 -2.749 136 3HB ALA 34 3HB ALA 34 13.584 7.689 -1.047 137 H SER 35 H SER 35 16.001 7.423 0.053 138 HA SER 35 HA SER 35 16.718 5.173 1.639 139 1HB SER 35 2HB SER 35 16.678 8.128 2.285 140 2HB SER 35 1HB SER 35 17.544 6.881 3.181 141 HG SER 35 HG SER 35 18.471 6.453 0.956 142 H ALA 36 H ALA 36 15.760 4.503 3.558 143 HA ALA 36 HA ALA 36 13.002 4.733 3.940 144 1HB ALA 36 1HB ALA 36 14.362 2.878 4.807 145 2HB ALA 36 2HB ALA 36 13.389 3.625 6.080 146 3HB ALA 36 3HB ALA 36 15.114 3.983 5.957 147 H ASP 37 H ASP 37 15.637 6.639 4.973 148 HA ASP 37 HA ASP 37 14.668 8.069 7.127 149 1HB ASP 37 2HB ASP 37 16.375 9.086 4.847 150 2HB ASP 37 1HB ASP 37 16.197 9.865 6.415 151 H LYS 38 H LYS 38 14.180 8.625 3.647 152 HA LYS 38 HA LYS 38 12.743 11.021 4.121 153 1HB LYS 38 2HB LYS 38 12.800 9.347 1.628 154 2HB LYS 38 1HB LYS 38 12.012 10.911 1.766 155 1HG LYS 38 2HG LYS 38 14.253 11.828 2.463 156 2HG LYS 38 1HG LYS 38 14.930 10.278 1.962 157 1HD LYS 38 2HD LYS 38 15.153 11.839 0.176 158 2HD LYS 38 1HD LYS 38 13.945 10.621 -0.269 159 1HE LYS 38 2HE LYS 38 12.137 12.166 0.256 160 2HE LYS 38 1HE LYS 38 13.287 13.366 0.844 161 1HZ LYS 38 1HZ LYS 38 13.017 12.377 -1.931 162 2HZ LYS 38 2HZ LYS 38 14.157 13.523 -1.435 163 3HZ LYS 38 3HZ LYS 38 12.506 13.866 -1.388 164 H PHE 39 H PHE 39 11.884 7.695 3.769 165 HA PHE 39 HA PHE 39 9.095 8.090 3.489 166 1HB PHE 39 2HB PHE 39 10.352 5.985 2.905 167 2HB PHE 39 1HB PHE 39 10.553 5.682 4.620 168 HD1 PHE 39 1HD PHE 39 7.922 6.238 2.051 169 HD2 PHE 39 2HD PHE 39 8.988 4.393 5.718 170 HE1 PHE 39 1HE PHE 39 5.789 5.022 2.042 171 HE2 PHE 39 2HE PHE 39 6.850 3.158 5.719 172 HZ PHE 39 HZ PHE 39 5.248 3.475 3.876 173 H HIS 40 H HIS 40 11.278 7.660 6.208 174 HA HIS 40 HA HIS 40 9.381 7.737 8.304 175 1HB HIS 40 2HB HIS 40 11.727 7.039 8.657 176 2HB HIS 40 1HB HIS 40 12.274 8.668 8.288 177 HD1 HIS 40 1HD HIS 40 12.756 10.028 10.319 178 HD2 HIS 40 2HD HIS 40 9.934 7.088 11.072 179 HE1 HIS 40 1HE HIS 40 12.262 10.189 12.758 180 HE2 HIS 40 2HE HIS 40 10.739 8.291 13.247 181 H HIS 41 H HIS 41 11.107 10.224 6.547 182 HA HIS 41 HA HIS 41 10.194 12.489 7.964 183 1HB HIS 41 2HB HIS 41 11.107 12.197 5.093 184 2HB HIS 41 1HB HIS 41 10.592 13.737 5.736 185 HD1 HIS 41 1HD HIS 41 13.052 14.642 5.239 186 HD2 HIS 41 2HD HIS 41 12.819 11.569 8.021 187 HE1 HIS 41 1HE HIS 41 15.256 14.634 6.415 188 HE2 HIS 41 2HE HIS 41 14.988 12.968 8.268 189 H MET 42 H MET 42 8.687 10.520 5.546 190 HA MET 42 HA MET 42 6.591 12.350 4.963 191 1HB MET 42 2HB MET 42 6.747 9.379 4.459 192 2HB MET 42 1HB MET 42 5.464 10.414 3.861 193 1HG MET 42 2HG MET 42 8.386 10.600 3.164 194 2HG MET 42 1HG MET 42 7.105 9.973 2.132 195 1HE MET 42 1HE MET 42 4.734 12.100 2.697 196 2HE MET 42 2HE MET 42 5.161 11.508 1.091 197 3HE MET 42 3HE MET 42 5.027 13.238 1.388 198 H PHE 43 H PHE 43 6.992 9.817 7.358 199 HA PHE 43 HA PHE 43 4.253 9.884 8.166 200 1HB PHE 43 2HB PHE 43 6.690 8.881 9.638 201 2HB PHE 43 1HB PHE 43 5.059 8.809 10.291 202 HD1 PHE 43 1HD PHE 43 3.320 7.513 9.029 203 HD2 PHE 43 2HD PHE 43 7.467 7.248 8.193 204 HE1 PHE 43 1HE PHE 43 2.944 5.370 7.882 205 HE2 PHE 43 2HE PHE 43 7.104 5.121 7.050 206 HZ PHE 43 HZ PHE 43 4.841 4.170 6.894 207 H ALA 44 H ALA 44 7.032 11.732 8.912 208 HA ALA 44 HA ALA 44 5.834 13.166 11.079 209 1HB ALA 44 1HB ALA 44 8.275 13.147 10.764 210 2HB ALA 44 2HB ALA 44 7.649 14.794 10.696 211 3HB ALA 44 3HB ALA 44 8.080 13.952 9.207 212 H GLY 45 H GLY 45 6.512 13.912 7.702 213 1HA GLY 45 2HA GLY 45 5.144 14.864 6.126 214 2HA GLY 45 1HA GLY 45 3.902 15.045 7.352 215 H LYS 46 H LYS 46 6.462 16.562 5.669 216 HA LYS 46 HA LYS 46 6.051 18.984 7.256 217 1HB LYS 46 2HB LYS 46 8.046 18.505 5.008 218 2HB LYS 46 1HB LYS 46 7.875 20.001 5.890 219 1HG LYS 46 2HG LYS 46 9.788 18.953 6.758 220 2HG LYS 46 1HG LYS 46 8.531 18.704 7.964 221 1HD LYS 46 2HD LYS 46 9.775 16.658 7.701 222 2HD LYS 46 1HD LYS 46 8.166 16.433 7.018 223 1HE LYS 46 2HE LYS 46 9.884 15.467 5.566 224 2HE LYS 46 1HE LYS 46 9.048 16.780 4.765 225 1HZ LYS 46 1HZ LYS 46 11.522 16.739 4.520 226 2HZ LYS 46 2HZ LYS 46 11.680 17.129 6.125 227 3HZ LYS 46 3HZ LYS 46 10.951 18.211 5.056 228 HA PRO 47 HA PRO 47 2.876 19.600 4.186 229 1HB PRO 47 2HB PRO 47 2.746 22.245 5.541 230 2HB PRO 47 1HB PRO 47 1.445 21.104 5.177 231 1HG PRO 47 2HG PRO 47 2.340 21.342 7.660 232 2HG PRO 47 1HG PRO 47 1.948 19.749 6.990 233 1HD PRO 47 2HD PRO 47 4.632 21.012 7.388 234 2HD PRO 47 1HD PRO 47 4.113 19.335 7.658 235 H HIS 48 H HIS 48 3.857 19.839 2.299 236 HA HIS 48 HA HIS 48 5.310 22.261 1.801 237 1HB HIS 48 2HB HIS 48 5.633 21.350 -0.594 238 2HB HIS 48 1HB HIS 48 6.420 20.479 0.703 239 HD1 HIS 48 1HD HIS 48 6.184 18.004 0.560 240 HD2 HIS 48 2HD HIS 48 3.115 19.964 -1.478 241 HE1 HIS 48 1HE HIS 48 4.872 16.211 -0.560 242 HE2 HIS 48 2HE HIS 48 3.289 17.441 -2.053 243 H HIS 49 H HIS 49 3.969 23.810 2.051 244 HA HIS 49 HA HIS 49 1.656 23.919 0.259 245 1HB HIS 49 2HB HIS 49 1.014 23.468 2.599 246 2HB HIS 49 1HB HIS 49 1.867 24.912 3.110 247 HD1 HIS 49 1HD HIS 49 -1.401 23.716 2.156 248 HD2 HIS 49 2HD HIS 49 0.598 27.345 1.956 249 HE1 HIS 49 1HE HIS 49 -3.190 25.444 1.907 250 HE2 HIS 49 2HE HIS 49 -1.966 27.592 1.583 251 H VAL 50 H VAL 50 2.498 25.253 -1.279 252 HA VAL 50 HA VAL 50 2.369 27.962 -0.749 253 HB VAL 50 HB VAL 50 4.600 27.783 0.184 254 1HG1 VAL 50 1HG1 VAL 50 5.402 25.808 -0.904 255 2HG1 VAL 50 2HG1 VAL 50 6.554 27.126 -1.138 256 3HG1 VAL 50 3HG1 VAL 50 5.476 26.650 -2.454 257 1HG2 VAL 50 1HG2 VAL 50 5.785 29.450 -1.195 258 2HG2 VAL 50 2HG2 VAL 50 4.076 29.825 -0.976 259 3HG2 VAL 50 3HG2 VAL 50 4.636 29.146 -2.504 260 H SER 51 H SER 51 1.060 28.258 -2.309 261 HA SER 51 HA SER 51 2.088 28.066 -5.041 262 1HB SER 51 2HB SER 51 -0.685 27.224 -4.136 263 2HB SER 51 1HB SER 51 -0.099 27.229 -5.805 264 HG SER 51 HG SER 51 1.667 25.903 -4.427 265 H LYS 52 H LYS 52 1.520 30.016 -2.787 266 HA LYS 52 HA LYS 52 -0.028 31.987 -4.303 267 1HB LYS 52 2HB LYS 52 0.004 31.544 -1.310 268 2HB LYS 52 1HB LYS 52 -0.801 32.868 -2.138 269 1HG LYS 52 2HG LYS 52 -2.308 31.323 -3.228 270 2HG LYS 52 1HG LYS 52 -1.465 29.956 -2.504 271 1HD LYS 52 2HD LYS 52 -3.497 30.444 -1.280 272 2HD LYS 52 1HD LYS 52 -2.070 30.762 -0.292 273 1HE LYS 52 2HE LYS 52 -3.756 32.524 -0.015 274 2HE LYS 52 1HE LYS 52 -2.282 33.165 -0.726 275 1HZ LYS 52 1HZ LYS 52 -4.782 32.478 -2.184 276 2HZ LYS 52 2HZ LYS 52 -3.394 33.052 -2.924 277 3HZ LYS 52 3HZ LYS 52 -4.236 34.024 -1.830 278 H ALA 53 H ALA 53 0.585 34.242 -3.258 279 HA ALA 53 HA ALA 53 3.441 34.463 -3.305 280 1HB ALA 53 1HB ALA 53 1.997 36.240 -4.224 281 2HB ALA 53 2HB ALA 53 3.024 36.867 -2.930 282 3HB ALA 53 3HB ALA 53 1.324 36.522 -2.624 283 H SER 54 H SER 54 0.918 35.056 -0.942 284 HA SER 54 HA SER 54 2.786 34.371 1.172 285 1HB SER 54 2HB SER 54 2.383 36.809 1.203 286 2HB SER 54 1HB SER 54 0.645 36.529 1.192 287 HG SER 54 HG SER 54 2.525 36.021 3.234 288 HA PRO 55 HA PRO 55 -0.798 31.624 1.393 289 1HB PRO 55 2HB PRO 55 0.492 29.421 2.181 290 2HB PRO 55 1HB PRO 55 0.521 29.963 0.499 291 1HG PRO 55 2HG PRO 55 2.635 30.145 2.579 292 2HG PRO 55 1HG PRO 55 2.794 29.959 0.828 293 1HD PRO 55 2HD PRO 55 3.048 32.357 2.296 294 2HD PRO 55 1HD PRO 55 2.920 32.216 0.530 295 H GLY 56 H GLY 56 -2.072 31.217 3.084 296 1HA GLY 56 2HA GLY 56 -1.087 31.803 5.748 297 2HA GLY 56 1HA GLY 56 -2.765 31.500 5.298 298 H ASN 57 H ASN 57 -0.942 30.322 7.364 299 HA ASN 57 HA ASN 57 -0.441 28.392 8.336 300 1HB ASN 57 2HB ASN 57 -2.648 27.268 6.579 301 2HB ASN 57 1HB ASN 57 -1.835 26.343 7.829 302 1HD2 ASN 57 1HD2 ASN 57 -3.712 26.022 8.959 303 2HD2 ASN 57 2HD2 ASN 57 -4.518 27.255 9.845 304 H ILE 58 H ILE 58 1.648 28.350 7.604 305 HA ILE 58 HA ILE 58 2.311 27.000 5.177 306 HB ILE 58 HB ILE 58 4.093 27.701 7.546 307 1HG1 ILE 58 2HG1 ILE 58 3.629 29.169 4.935 308 2HG1 ILE 58 1HG1 ILE 58 3.040 29.675 6.514 309 1HG2 ILE 58 1HG2 ILE 58 5.063 25.939 6.171 310 2HG2 ILE 58 2HG2 ILE 58 5.956 27.444 5.935 311 3HG2 ILE 58 3HG2 ILE 58 4.797 26.897 4.718 312 1HD1 ILE 58 1HD1 ILE 58 5.351 29.963 7.267 313 2HD1 ILE 58 2HD1 ILE 58 4.990 30.959 5.857 314 3HD1 ILE 58 3HD1 ILE 58 5.923 29.472 5.674 315 H GLN 59 H GLN 59 2.604 26.249 8.623 316 HA GLN 59 HA GLN 59 2.837 23.443 7.997 317 1HB GLN 59 2HB GLN 59 2.509 24.787 10.707 318 2HB GLN 59 1HB GLN 59 2.657 23.059 10.485 319 1HG GLN 59 2HG GLN 59 4.745 23.916 11.253 320 2HG GLN 59 1HG GLN 59 4.946 23.445 9.573 321 1HE2 GLN 59 1HE2 GLN 59 4.765 26.063 11.806 322 2HE2 GLN 59 2HE2 GLN 59 5.394 27.287 10.771 323 H GLY 60 H GLY 60 0.910 23.554 6.743 324 1HA GLY 60 2HA GLY 60 -1.598 23.821 8.183 325 2HA GLY 60 1HA GLY 60 -1.416 23.570 6.449 326 H CYS 61 H CYS 61 -0.715 21.886 9.489 327 HA CYS 61 HA CYS 61 -1.289 19.444 8.092 328 1HB CYS 61 2HB CYS 61 -0.409 18.316 10.172 329 2HB CYS 61 1HB CYS 61 0.743 19.306 9.284 330 HG CYS 61 HG CYS 61 -0.909 20.685 11.897 331 H ASP 62 H ASP 62 -3.455 19.879 7.864 332 HA ASP 62 HA ASP 62 -5.019 19.257 10.253 333 1HB ASP 62 2HB ASP 62 -6.990 20.117 9.019 334 2HB ASP 62 1HB ASP 62 -5.723 21.329 9.087 335 H LEU 63 H LEU 63 -4.498 18.392 6.894 336 HA LEU 63 HA LEU 63 -5.438 15.698 7.531 337 1HB LEU 63 2HB LEU 63 -4.830 17.031 4.894 338 2HB LEU 63 1HB LEU 63 -4.887 15.290 5.017 339 HG LEU 63 HG LEU 63 -7.279 15.478 5.700 340 1HD1 LEU 63 1HD1 LEU 63 -8.478 17.537 5.334 341 2HD1 LEU 63 2HD1 LEU 63 -6.968 18.372 4.980 342 3HD1 LEU 63 3HD1 LEU 63 -7.260 17.728 6.595 343 1HD2 LEU 63 1HD2 LEU 63 -6.675 14.994 3.415 344 2HD2 LEU 63 2HD2 LEU 63 -6.550 16.716 3.059 345 3HD2 LEU 63 3HD2 LEU 63 -8.112 16.009 3.468 346 H HIS 64 H HIS 64 -3.941 13.980 6.487 347 HA HIS 64 HA HIS 64 -1.147 14.707 6.752 348 1HB HIS 64 2HB HIS 64 -2.444 14.030 9.033 349 2HB HIS 64 1HB HIS 64 -2.100 12.416 8.432 350 HD1 HIS 64 1HD HIS 64 -0.090 11.526 9.534 351 HD2 HIS 64 2HD HIS 64 0.221 15.603 8.846 352 HE1 HIS 64 1HE HIS 64 2.120 12.219 10.534 353 HE2 HIS 64 2HE HIS 64 2.392 14.616 9.862 354 H GLU 65 H GLU 65 -0.632 11.650 7.049 355 HA GLU 65 HA GLU 65 -0.695 11.133 4.283 356 1HB GLU 65 2HB GLU 65 0.107 8.842 4.784 357 2HB GLU 65 1HB GLU 65 1.064 10.065 5.584 358 1HG GLU 65 2HG GLU 65 -1.072 8.391 6.914 359 2HG GLU 65 1HG GLU 65 0.651 8.043 6.953 360 H GLY 66 H GLY 66 -1.779 9.585 3.086 361 1HA GLY 66 2HA GLY 66 -3.593 8.274 2.497 362 2HA GLY 66 1HA GLY 66 -4.171 8.375 4.161 363 H ASP 67 H ASP 67 -5.401 10.051 4.792 364 HA ASP 67 HA ASP 67 -6.010 12.354 3.221 365 1HB ASP 67 2HB ASP 67 -7.280 10.765 1.862 366 2HB ASP 67 1HB ASP 67 -8.129 10.204 3.297 367 H TRP 68 H TRP 68 -7.562 10.102 5.486 368 HA TRP 68 HA TRP 68 -8.875 12.245 6.808 369 1HB TRP 68 2HB TRP 68 -8.581 9.349 7.621 370 2HB TRP 68 1HB TRP 68 -9.681 10.507 8.363 371 HD1 TRP 68 HD TRP 68 -9.229 8.413 5.181 372 HE1 TRP 68 1HE TRP 68 -11.452 8.378 3.883 373 HE3 TRP 68 3HE TRP 68 -11.829 11.855 7.919 374 HZ2 TRP 68 2HZ TRP 68 -13.959 9.642 3.991 375 HZ3 TRP 68 3HZ TRP 68 -14.139 12.386 7.250 376 HH2 TRP 68 HH TRP 68 -15.179 11.301 5.330 377 H GLY 69 H GLY 69 -5.770 10.846 7.149 378 1HA GLY 69 2HA GLY 69 -4.005 11.674 8.382 379 2HA GLY 69 1HA GLY 69 -5.090 12.872 9.060 380 H THR 70 H THR 70 -6.154 9.654 9.395 381 HA THR 70 HA THR 70 -4.994 9.341 12.014 382 HB THR 70 HB THR 70 -6.953 10.810 12.385 383 HG1 THR 70 1HG THR 70 -6.812 9.620 14.121 384 1HG2 THR 70 1HG2 THR 70 -8.573 8.561 11.171 385 2HG2 THR 70 2HG2 THR 70 -8.300 10.147 10.452 386 3HG2 THR 70 3HG2 THR 70 -9.232 10.007 11.943 387 H VAL 71 H VAL 71 -5.755 7.204 12.922 388 HA VAL 71 HA VAL 71 -5.498 5.169 10.970 389 HB VAL 71 HB VAL 71 -6.361 4.923 13.878 390 1HG1 VAL 71 1HG1 VAL 71 -5.340 2.814 11.973 391 2HG1 VAL 71 2HG1 VAL 71 -6.986 2.940 12.599 392 3HG1 VAL 71 3HG1 VAL 71 -5.649 2.578 13.694 393 1HG2 VAL 71 1HG2 VAL 71 -4.029 4.308 14.305 394 2HG2 VAL 71 2HG2 VAL 71 -4.152 5.936 13.628 395 3HG2 VAL 71 3HG2 VAL 71 -3.647 4.590 12.609 396 H GLY 72 H GLY 72 -7.028 3.830 10.047 397 1HA GLY 72 2HA GLY 72 -9.221 3.034 9.762 398 2HA GLY 72 1HA GLY 72 -9.819 4.414 10.678 399 H SER 73 H SER 73 -7.515 5.646 8.767 400 HA SER 73 HA SER 73 -9.238 6.983 7.024 401 1HB SER 73 2HB SER 73 -6.966 7.810 7.653 402 2HB SER 73 1HB SER 73 -6.263 6.475 6.750 403 HG SER 73 HG SER 73 -6.816 7.348 4.909 404 H ILE 74 H ILE 74 -9.977 6.490 5.059 405 HA ILE 74 HA ILE 74 -8.963 4.105 3.710 406 HB ILE 74 HB ILE 74 -11.847 4.977 3.999 407 1HG1 ILE 74 2HG1 ILE 74 -10.424 2.445 4.757 408 2HG1 ILE 74 1HG1 ILE 74 -10.790 3.752 5.871 409 1HG2 ILE 74 1HG2 ILE 74 -12.421 3.050 2.571 410 2HG2 ILE 74 2HG2 ILE 74 -10.707 2.729 2.306 411 3HG2 ILE 74 3HG2 ILE 74 -11.424 4.204 1.685 412 1HD1 ILE 74 1HD1 ILE 74 -12.748 2.077 4.340 413 2HD1 ILE 74 2HD1 ILE 74 -13.176 3.378 5.464 414 3HD1 ILE 74 3HD1 ILE 74 -12.377 1.910 6.059 415 H VAL 75 H VAL 75 -8.150 4.675 1.861 416 HA VAL 75 HA VAL 75 -9.480 6.775 0.278 417 HB VAL 75 HB VAL 75 -7.395 7.639 -0.555 418 1HG1 VAL 75 1HG1 VAL 75 -7.359 7.545 2.430 419 2HG1 VAL 75 2HG1 VAL 75 -8.206 8.702 1.407 420 3HG1 VAL 75 3HG1 VAL 75 -6.440 8.672 1.429 421 1HG2 VAL 75 1HG2 VAL 75 -6.024 5.637 -0.520 422 2HG2 VAL 75 2HG2 VAL 75 -5.989 5.662 1.238 423 3HG2 VAL 75 3HG2 VAL 75 -5.196 6.947 0.324 424 H PHE 76 H PHE 76 -9.204 6.605 -1.947 425 HA PHE 76 HA PHE 76 -8.463 3.911 -2.643 426 1HB PHE 76 2HB PHE 76 -10.622 5.594 -3.901 427 2HB PHE 76 1HB PHE 76 -10.059 4.055 -4.557 428 HD1 PHE 76 1HD PHE 76 -9.656 2.457 -2.179 429 HD2 PHE 76 2HD PHE 76 -12.785 5.174 -3.097 430 HE1 PHE 76 1HE PHE 76 -11.071 1.226 -0.729 431 HE2 PHE 76 2HE PHE 76 -14.293 3.925 -1.603 432 HZ PHE 76 HZ PHE 76 -13.452 1.929 -0.400 433 H TRP 77 H TRP 77 -7.059 3.520 -4.019 434 HA TRP 77 HA TRP 77 -5.702 5.772 -5.216 435 1HB TRP 77 2HB TRP 77 -4.474 4.452 -3.563 436 2HB TRP 77 1HB TRP 77 -4.831 2.984 -4.453 437 HD1 TRP 77 HD TRP 77 -3.394 6.302 -5.476 438 HE1 TRP 77 1HE TRP 77 -1.095 5.847 -6.786 439 HE3 TRP 77 3HE TRP 77 -3.275 1.276 -5.135 440 HZ2 TRP 77 2HZ TRP 77 0.417 3.631 -7.503 441 HZ3 TRP 77 3HZ TRP 77 -1.409 0.033 -6.131 442 HH2 TRP 77 HH TRP 77 0.398 1.184 -7.291 443 H ASN 78 H ASN 78 -5.962 5.957 -7.318 444 HA ASN 78 HA ASN 78 -6.863 3.646 -8.860 445 1HB ASN 78 2HB ASN 78 -7.091 6.619 -9.437 446 2HB ASN 78 1HB ASN 78 -7.460 5.374 -10.611 447 1HD2 ASN 78 1HD2 ASN 78 -8.287 5.081 -7.216 448 2HD2 ASN 78 2HD2 ASN 78 -9.999 5.223 -7.418 449 H TYR 79 H TYR 79 -5.604 2.873 -10.373 450 HA TYR 79 HA TYR 79 -3.396 4.445 -11.343 451 1HB TYR 79 2HB TYR 79 -1.741 2.646 -10.889 452 2HB TYR 79 1HB TYR 79 -2.404 3.320 -9.415 453 HD1 TYR 79 1HD TYR 79 -1.701 0.355 -11.243 454 HD2 TYR 79 2HD TYR 79 -4.289 1.948 -8.266 455 HE1 TYR 79 1HE TYR 79 -2.193 -1.920 -10.458 456 HE2 TYR 79 2HE TYR 79 -4.781 -0.330 -7.468 457 HH TYR 79 HH TYR 79 -2.941 -2.990 -8.391 458 H VAL 80 H VAL 80 -2.445 3.435 -13.266 459 HA VAL 80 HA VAL 80 -4.556 1.928 -14.618 460 HB VAL 80 HB VAL 80 -2.382 3.661 -15.843 461 1HG1 VAL 80 1HG1 VAL 80 -3.575 3.326 -17.967 462 2HG1 VAL 80 2HG1 VAL 80 -4.701 2.231 -17.163 463 3HG1 VAL 80 3HG1 VAL 80 -3.002 1.793 -17.313 464 1HG2 VAL 80 1HG2 VAL 80 -4.216 5.171 -16.440 465 2HG2 VAL 80 2HG2 VAL 80 -4.105 4.958 -14.690 466 3HG2 VAL 80 3HG2 VAL 80 -5.354 4.117 -15.602 467 H HIS 81 H HIS 81 -4.209 -0.037 -15.129 468 HA HIS 81 HA HIS 81 -1.502 -0.963 -15.574 469 1HB HIS 81 2HB HIS 81 -1.934 -1.529 -13.245 470 2HB HIS 81 1HB HIS 81 -3.505 -2.187 -13.684 471 HD1 HIS 81 1HD HIS 81 0.124 -2.972 -13.784 472 HD2 HIS 81 2HD HIS 81 -3.531 -4.687 -14.595 473 HE1 HIS 81 1HE HIS 81 0.634 -5.410 -14.278 474 HE2 HIS 81 2HE HIS 81 -1.551 -6.145 -15.273 475 H ASP 82 H ASP 82 -1.423 -1.914 -17.416 476 HA ASP 82 HA ASP 82 -1.877 -2.886 -19.375 477 1HB ASP 82 2HB ASP 82 -3.974 -4.351 -17.756 478 2HB ASP 82 1HB ASP 82 -3.728 -4.661 -19.468 479 H GLY 83 H GLY 83 -3.083 -0.419 -18.685 480 1HA GLY 83 2HA GLY 83 -4.285 1.073 -20.020 481 2HA GLY 83 1HA GLY 83 -4.955 -0.287 -20.897 482 H GLU 84 H GLU 84 -5.597 -1.296 -17.971 483 HA GLU 84 HA GLU 84 -8.200 0.034 -17.907 484 1HB GLU 84 2HB GLU 84 -7.214 -2.395 -16.424 485 2HB GLU 84 1HB GLU 84 -8.767 -1.665 -16.127 486 1HG GLU 84 2HG GLU 84 -9.117 -3.566 -17.474 487 2HG GLU 84 1HG GLU 84 -9.364 -2.162 -18.491 488 H ALA 85 H ALA 85 -9.011 0.943 -16.048 489 HA ALA 85 HA ALA 85 -6.979 2.064 -14.322 490 1HB ALA 85 1HB ALA 85 -9.968 2.509 -14.413 491 2HB ALA 85 2HB ALA 85 -8.744 3.537 -15.159 492 3HB ALA 85 3HB ALA 85 -8.833 3.402 -13.402 493 H LYS 86 H LYS 86 -6.403 1.016 -12.604 494 HA LYS 86 HA LYS 86 -8.141 -1.044 -11.446 495 1HB LYS 86 2HB LYS 86 -5.293 -0.318 -10.799 496 2HB LYS 86 1HB LYS 86 -6.157 -1.738 -10.283 497 1HG LYS 86 2HG LYS 86 -5.335 -1.175 -13.130 498 2HG LYS 86 1HG LYS 86 -4.378 -2.069 -11.956 499 1HD LYS 86 2HD LYS 86 -5.432 -3.682 -13.352 500 2HD LYS 86 1HD LYS 86 -6.308 -3.704 -11.823 501 1HE LYS 86 2HE LYS 86 -8.072 -2.311 -12.911 502 2HE LYS 86 1HE LYS 86 -7.052 -2.368 -14.366 503 1HZ LYS 86 1HZ LYS 86 -8.882 -4.017 -14.386 504 2HZ LYS 86 2HZ LYS 86 -8.157 -4.789 -13.074 505 3HZ LYS 86 3HZ LYS 86 -7.349 -4.696 -14.535 506 H VAL 87 H VAL 87 -8.555 -0.916 -9.224 507 HA VAL 87 HA VAL 87 -7.891 1.638 -7.949 508 HB VAL 87 HB VAL 87 -10.577 0.228 -7.728 509 1HG1 VAL 87 1HG1 VAL 87 -9.645 2.844 -6.547 510 2HG1 VAL 87 2HG1 VAL 87 -9.928 1.346 -5.665 511 3HG1 VAL 87 3HG1 VAL 87 -11.275 2.180 -6.429 512 1HG2 VAL 87 1HG2 VAL 87 -9.883 2.829 -9.098 513 2HG2 VAL 87 2HG2 VAL 87 -11.512 2.193 -8.876 514 3HG2 VAL 87 3HG2 VAL 87 -10.361 1.330 -9.895 515 H ALA 88 H ALA 88 -7.173 1.424 -5.932 516 HA ALA 88 HA ALA 88 -7.014 -1.311 -4.875 517 1HB ALA 88 1HB ALA 88 -4.869 -0.191 -5.310 518 2HB ALA 88 2HB ALA 88 -5.098 -0.483 -3.582 519 3HB ALA 88 3HB ALA 88 -5.355 1.127 -4.251 520 H LYS 89 H LYS 89 -7.715 -1.729 -2.835 521 HA LYS 89 HA LYS 89 -9.429 0.330 -1.645 522 1HB LYS 89 2HB LYS 89 -9.635 -2.658 -1.262 523 2HB LYS 89 1HB LYS 89 -10.863 -1.435 -0.977 524 1HG LYS 89 2HG LYS 89 -9.873 -2.390 -3.661 525 2HG LYS 89 1HG LYS 89 -11.426 -2.773 -2.939 526 1HD LYS 89 2HD LYS 89 -11.961 -0.325 -3.014 527 2HD LYS 89 1HD LYS 89 -10.442 -0.078 -3.878 528 1HE LYS 89 2HE LYS 89 -12.790 -1.745 -4.789 529 2HE LYS 89 1HE LYS 89 -12.267 -0.200 -5.457 530 1HZ LYS 89 1HZ LYS 89 -11.584 -2.029 -6.840 531 2HZ LYS 89 2HZ LYS 89 -10.779 -2.787 -5.607 532 3HZ LYS 89 3HZ LYS 89 -10.179 -1.356 -6.217 533 H GLU 90 H GLU 90 -8.762 0.934 0.486 534 HA GLU 90 HA GLU 90 -7.170 -0.921 1.949 535 1HB GLU 90 2HB GLU 90 -5.271 0.617 2.142 536 2HB GLU 90 1HB GLU 90 -5.509 0.058 0.496 537 1HG GLU 90 2HG GLU 90 -5.114 2.278 0.079 538 2HG GLU 90 1HG GLU 90 -6.865 2.287 0.301 539 H ARG 91 H ARG 91 -6.916 -0.339 4.048 540 HA ARG 91 HA ARG 91 -8.133 2.121 5.038 541 1HB ARG 91 2HB ARG 91 -9.767 0.256 5.411 542 2HB ARG 91 1HB ARG 91 -8.518 -0.622 6.285 543 1HG ARG 91 2HG ARG 91 -8.390 1.299 7.881 544 2HG ARG 91 1HG ARG 91 -9.793 1.989 7.077 545 1HD ARG 91 2HD ARG 91 -11.079 -0.034 7.637 546 2HD ARG 91 1HD ARG 91 -9.665 -0.680 8.476 547 HE ARG 91 HE ARG 91 -11.374 1.517 9.304 548 1HH1 ARG 91 1HH1 ARG 91 -8.510 -0.463 10.025 549 2HH1 ARG 91 2HH1 ARG 91 -8.421 0.040 11.657 550 1HH2 ARG 91 1HH2 ARG 91 -11.249 2.132 11.573 551 2HH2 ARG 91 2HH2 ARG 91 -10.020 1.498 12.556 552 H ILE 92 H ILE 92 -6.841 2.982 6.632 553 HA ILE 92 HA ILE 92 -4.334 1.658 7.171 554 HB ILE 92 HB ILE 92 -5.562 4.086 8.526 555 1HG1 ILE 92 2HG1 ILE 92 -3.444 3.862 6.372 556 2HG1 ILE 92 1HG1 ILE 92 -5.075 4.491 6.182 557 1HG2 ILE 92 1HG2 ILE 92 -3.318 4.545 9.429 558 2HG2 ILE 92 2HG2 ILE 92 -2.750 3.009 8.774 559 3HG2 ILE 92 3HG2 ILE 92 -3.982 3.026 10.033 560 1HD1 ILE 92 1HD1 ILE 92 -2.870 5.719 7.831 561 2HD1 ILE 92 2HD1 ILE 92 -4.503 6.344 7.711 562 3HD1 ILE 92 3HD1 ILE 92 -3.467 6.309 6.280 563 H GLU 93 H GLU 93 -4.101 0.074 8.545 564 HA GLU 93 HA GLU 93 -6.068 -0.378 10.685 565 1HB GLU 93 2HB GLU 93 -3.859 -2.097 9.583 566 2HB GLU 93 1HB GLU 93 -4.911 -2.570 10.903 567 1HG GLU 93 2HG GLU 93 -5.782 -1.945 8.098 568 2HG GLU 93 1HG GLU 93 -5.529 -3.554 8.766 569 H ALA 94 H ALA 94 -2.626 0.006 10.101 570 HA ALA 94 HA ALA 94 -2.194 0.888 12.813 571 1HB ALA 94 1HB ALA 94 -0.334 -0.682 13.148 572 2HB ALA 94 2HB ALA 94 -0.727 -1.476 11.623 573 3HB ALA 94 3HB ALA 94 -1.868 -1.534 12.966 574 H VAL 95 H VAL 95 -0.423 2.221 12.913 575 HA VAL 95 HA VAL 95 1.263 2.446 10.604 576 HB VAL 95 HB VAL 95 -0.575 3.954 10.017 577 1HG1 VAL 95 1HG1 VAL 95 -0.031 5.380 12.608 578 2HG1 VAL 95 2HG1 VAL 95 -1.466 4.440 12.203 579 3HG1 VAL 95 3HG1 VAL 95 -1.117 5.935 11.333 580 1HG2 VAL 95 1HG2 VAL 95 1.653 4.604 9.334 581 2HG2 VAL 95 2HG2 VAL 95 1.893 5.473 10.848 582 3HG2 VAL 95 3HG2 VAL 95 0.685 6.037 9.693 583 H GLU 96 H GLU 96 3.220 2.660 11.232 584 HA GLU 96 HA GLU 96 3.815 3.733 13.919 585 1HB GLU 96 2HB GLU 96 5.359 1.762 12.269 586 2HB GLU 96 1HB GLU 96 5.833 2.382 13.817 587 1HG GLU 96 2HG GLU 96 3.361 0.751 13.357 588 2HG GLU 96 1HG GLU 96 4.916 0.112 13.893 589 HA PRO 97 HA PRO 97 5.650 6.804 11.119 590 1HB PRO 97 2HB PRO 97 6.454 7.953 13.739 591 2HB PRO 97 1HB PRO 97 5.641 8.735 12.380 592 1HG PRO 97 2HG PRO 97 4.281 8.129 14.577 593 2HG PRO 97 1HG PRO 97 3.558 7.888 12.974 594 1HD PRO 97 2HD PRO 97 4.766 5.869 14.826 595 2HD PRO 97 1HD PRO 97 3.293 5.756 13.834 596 H ASP 98 H ASP 98 7.281 5.718 14.112 597 HA ASP 98 HA ASP 98 9.843 6.228 12.931 598 1HB ASP 98 2HB ASP 98 9.125 5.122 15.613 599 2HB ASP 98 1HB ASP 98 10.776 5.359 15.057 600 H LYS 99 H LYS 99 7.814 3.574 12.953 601 HA LYS 99 HA LYS 99 10.094 1.796 12.611 602 1HB LYS 99 2HB LYS 99 7.182 1.150 12.821 603 2HB LYS 99 1HB LYS 99 8.481 -0.015 12.661 604 1HG LYS 99 2HG LYS 99 9.435 0.784 14.787 605 2HG LYS 99 1HG LYS 99 8.053 1.882 14.945 606 1HD LYS 99 2HD LYS 99 6.552 -0.000 14.827 607 2HD LYS 99 1HD LYS 99 7.961 -1.066 14.685 608 1HE LYS 99 2HE LYS 99 8.688 -0.480 16.894 609 2HE LYS 99 1HE LYS 99 7.437 0.756 17.029 610 1HZ LYS 99 1HZ LYS 99 6.841 -1.247 18.229 611 2HZ LYS 99 2HZ LYS 99 6.940 -2.177 16.829 612 3HZ LYS 99 3HZ LYS 99 5.768 -0.964 16.965 613 H ASN 100 H ASN 100 8.049 3.705 10.772 614 HA ASN 100 HA ASN 100 7.509 3.862 8.585 615 1HB ASN 100 2HB ASN 100 9.847 1.961 8.257 616 2HB ASN 100 1HB ASN 100 9.041 2.752 6.915 617 1HD2 ASN 100 1HD2 ASN 100 11.794 2.900 7.743 618 2HD2 ASN 100 2HD2 ASN 100 12.106 4.568 8.082 619 H LEU 101 H LEU 101 5.928 2.279 9.982 620 HA LEU 101 HA LEU 101 5.524 -0.166 8.380 621 1HB LEU 101 2HB LEU 101 6.175 -0.559 10.758 622 2HB LEU 101 1HB LEU 101 4.772 0.377 11.234 623 HG LEU 101 HG LEU 101 3.344 -1.286 10.077 624 1HD1 LEU 101 1HD1 LEU 101 5.900 -2.820 9.951 625 2HD1 LEU 101 2HD1 LEU 101 4.881 -2.245 8.607 626 3HD1 LEU 101 3HD1 LEU 101 4.284 -3.483 9.704 627 1HD2 LEU 101 1HD2 LEU 101 3.455 -2.921 11.872 628 2HD2 LEU 101 2HD2 LEU 101 3.575 -1.275 12.478 629 3HD2 LEU 101 3HD2 LEU 101 5.027 -2.281 12.377 630 H ILE 102 H ILE 102 3.577 -0.339 7.448 631 HA ILE 102 HA ILE 102 1.330 1.060 8.562 632 HB ILE 102 HB ILE 102 2.112 2.714 7.063 633 1HG1 ILE 102 2HG1 ILE 102 0.287 2.881 5.343 634 2HG1 ILE 102 1HG1 ILE 102 -0.184 1.241 5.763 635 1HG2 ILE 102 1HG2 ILE 102 2.520 2.356 4.659 636 2HG2 ILE 102 2HG2 ILE 102 2.318 0.622 4.930 637 3HG2 ILE 102 3HG2 ILE 102 3.632 1.474 5.708 638 1HD1 ILE 102 1HD1 ILE 102 -1.595 2.887 6.847 639 2HD1 ILE 102 2HD1 ILE 102 -0.183 3.607 7.617 640 3HD1 ILE 102 3HD1 ILE 102 -0.674 1.965 8.038 641 H THR 103 H THR 103 -0.210 -0.257 8.694 642 HA THR 103 HA THR 103 -0.343 -2.686 7.059 643 HB THR 103 HB THR 103 -1.909 -1.923 9.540 644 HG1 THR 103 1HG THR 103 0.170 -3.812 9.351 645 1HG2 THR 103 1HG2 THR 103 -2.454 -4.315 9.660 646 2HG2 THR 103 2HG2 THR 103 -1.569 -4.595 8.160 647 3HG2 THR 103 3HG2 THR 103 -3.035 -3.619 8.145 648 H PHE 104 H PHE 104 -1.836 -2.970 5.503 649 HA PHE 104 HA PHE 104 -4.045 -1.043 5.182 650 1HB PHE 104 2HB PHE 104 -2.612 -2.771 3.171 651 2HB PHE 104 1HB PHE 104 -3.929 -1.729 2.721 652 HD1 PHE 104 1HD PHE 104 -3.507 0.833 3.303 653 HD2 PHE 104 2HD PHE 104 -0.481 -2.130 2.929 654 HE1 PHE 104 1HE PHE 104 -1.848 2.587 2.822 655 HE2 PHE 104 2HE PHE 104 1.170 -0.393 2.456 656 HZ PHE 104 HZ PHE 104 0.511 1.954 2.399 657 H ARG 105 H ARG 105 -6.067 -1.906 4.634 658 HA ARG 105 HA ARG 105 -6.452 -4.826 4.902 659 1HB ARG 105 2HB ARG 105 -7.012 -3.759 7.016 660 2HB ARG 105 1HB ARG 105 -8.049 -2.617 6.186 661 1HG ARG 105 2HG ARG 105 -9.491 -4.530 5.496 662 2HG ARG 105 1HG ARG 105 -8.499 -5.576 6.521 663 1HD ARG 105 2HD ARG 105 -9.033 -4.154 8.451 664 2HD ARG 105 1HD ARG 105 -10.005 -3.135 7.389 665 HE ARG 105 HE ARG 105 -10.863 -5.853 7.337 666 1HH1 ARG 105 1HH1 ARG 105 -11.026 -2.892 9.250 667 2HH1 ARG 105 2HH1 ARG 105 -12.536 -3.231 9.946 668 1HH2 ARG 105 1HH2 ARG 105 -12.926 -6.363 8.312 669 2HH2 ARG 105 2HH2 ARG 105 -13.650 -5.261 9.395 670 H VAL 106 H VAL 106 -8.074 -5.666 3.532 671 HA VAL 106 HA VAL 106 -9.082 -3.928 1.497 672 HB VAL 106 HB VAL 106 -8.459 -6.276 0.933 673 1HG1 VAL 106 1HG1 VAL 106 -9.723 -8.144 1.749 674 2HG1 VAL 106 2HG1 VAL 106 -10.644 -7.077 2.809 675 3HG1 VAL 106 3HG1 VAL 106 -8.908 -7.290 3.053 676 1HG2 VAL 106 1HG2 VAL 106 -10.197 -5.234 -0.429 677 2HG2 VAL 106 2HG2 VAL 106 -11.430 -5.774 0.708 678 3HG2 VAL 106 3HG2 VAL 106 -10.521 -6.955 -0.231 679 H ILE 107 H ILE 107 -10.974 -2.870 1.575 680 HA ILE 107 HA ILE 107 -12.900 -3.693 3.649 681 HB ILE 107 HB ILE 107 -13.686 -1.417 3.934 682 1HG1 ILE 107 2HG1 ILE 107 -13.279 -0.592 1.594 683 2HG1 ILE 107 1HG1 ILE 107 -12.747 0.529 2.832 684 1HG2 ILE 107 1HG2 ILE 107 -11.741 -0.395 4.955 685 2HG2 ILE 107 2HG2 ILE 107 -10.699 -1.464 4.043 686 3HG2 ILE 107 3HG2 ILE 107 -11.771 -2.138 5.292 687 1HD1 ILE 107 1HD1 ILE 107 -11.143 0.495 1.081 688 2HD1 ILE 107 2HD1 ILE 107 -11.014 -1.257 1.121 689 3HD1 ILE 107 3HD1 ILE 107 -10.436 -0.293 2.481 690 H GLU 108 H GLU 108 -12.519 -2.996 0.341 691 HA GLU 108 HA GLU 108 -15.277 -2.442 -0.150 692 1HB GLU 108 2HB GLU 108 -13.496 -1.529 -1.587 693 2HB GLU 108 1HB GLU 108 -13.155 -3.164 -2.142 694 1HG GLU 108 2HG GLU 108 -14.497 -1.920 -3.762 695 2HG GLU 108 1HG GLU 108 -15.349 -3.328 -3.126 696 H GLY 109 H GLY 109 -13.517 -5.077 -1.824 697 1HA GLY 109 2HA GLY 109 -14.857 -7.243 -0.842 698 2HA GLY 109 1HA GLY 109 -16.003 -6.512 -1.949 699 H ASP 110 H ASP 110 -13.811 -5.654 -3.783 700 HA ASP 110 HA ASP 110 -13.803 -7.629 -5.668 701 1HB ASP 110 2HB ASP 110 -13.044 -5.429 -6.225 702 2HB ASP 110 1HB ASP 110 -11.690 -5.549 -5.111 703 H LEU 111 H LEU 111 -11.212 -7.217 -3.273 704 HA LEU 111 HA LEU 111 -9.827 -9.555 -4.146 705 1HB LEU 111 2HB LEU 111 -9.506 -7.986 -1.587 706 2HB LEU 111 1HB LEU 111 -8.413 -9.232 -2.152 707 HG LEU 111 HG LEU 111 -8.935 -6.603 -3.543 708 1HD1 LEU 111 1HD1 LEU 111 -6.653 -6.049 -2.891 709 2HD1 LEU 111 2HD1 LEU 111 -6.543 -7.564 -1.990 710 3HD1 LEU 111 3HD1 LEU 111 -7.684 -6.316 -1.485 711 1HD2 LEU 111 1HD2 LEU 111 -8.397 -8.370 -5.140 712 2HD2 LEU 111 2HD2 LEU 111 -6.980 -8.815 -4.190 713 3HD2 LEU 111 3HD2 LEU 111 -7.050 -7.244 -4.985 714 H MET 112 H MET 112 -12.435 -9.002 -2.019 715 HA MET 112 HA MET 112 -12.093 -11.329 -0.369 716 1HB MET 112 2HB MET 112 -14.527 -9.597 -0.791 717 2HB MET 112 1HB MET 112 -14.377 -10.843 0.425 718 1HG MET 112 2HG MET 112 -12.642 -8.376 0.327 719 2HG MET 112 1HG MET 112 -14.149 -8.471 1.212 720 1HE MET 112 1HE MET 112 -11.057 -11.338 1.185 721 2HE MET 112 2HE MET 112 -10.202 -10.481 2.441 722 3HE MET 112 3HE MET 112 -10.445 -9.674 0.912 723 H LYS 113 H LYS 113 -13.023 -10.927 -3.521 724 HA LYS 113 HA LYS 113 -14.924 -13.138 -3.632 725 1HB LYS 113 2HB LYS 113 -13.527 -11.648 -5.846 726 2HB LYS 113 1HB LYS 113 -14.890 -12.734 -6.022 727 1HG LYS 113 2HG LYS 113 -14.992 -10.103 -4.541 728 2HG LYS 113 1HG LYS 113 -15.419 -10.295 -6.230 729 1HD LYS 113 2HD LYS 113 -17.472 -10.288 -5.038 730 2HD LYS 113 1HD LYS 113 -17.133 -11.968 -5.466 731 1HE LYS 113 2HE LYS 113 -16.487 -12.445 -3.163 732 2HE LYS 113 1HE LYS 113 -16.634 -10.740 -2.734 733 1HZ LYS 113 1HZ LYS 113 -18.524 -12.055 -2.029 734 2HZ LYS 113 2HZ LYS 113 -18.811 -12.562 -3.599 735 3HZ LYS 113 3HZ LYS 113 -19.009 -10.934 -3.201 736 H GLU 114 H GLU 114 -11.689 -12.799 -3.412 737 HA GLU 114 HA GLU 114 -11.295 -15.489 -4.524 738 1HB GLU 114 2HB GLU 114 -9.318 -13.195 -4.619 739 2HB GLU 114 1HB GLU 114 -8.968 -14.842 -5.144 740 1HG GLU 114 2HG GLU 114 -10.729 -14.718 -6.778 741 2HG GLU 114 1HG GLU 114 -11.102 -13.063 -6.296 742 H TYR 115 H TYR 115 -10.556 -13.259 -1.960 743 HA TYR 115 HA TYR 115 -9.495 -15.487 -0.361 744 1HB TYR 115 2HB TYR 115 -8.815 -12.544 -0.085 745 2HB TYR 115 1HB TYR 115 -8.096 -13.885 0.804 746 HD1 TYR 115 1HD TYR 115 -8.103 -11.968 -2.246 747 HD2 TYR 115 2HD TYR 115 -6.566 -15.476 -0.382 748 HE1 TYR 115 1HE TYR 115 -6.427 -12.189 -4.022 749 HE2 TYR 115 2HE TYR 115 -4.909 -15.681 -2.138 750 HH TYR 115 HH TYR 115 -4.276 -13.236 -4.381 751 H LYS 116 H LYS 116 -10.391 -15.562 1.716 752 HA LYS 116 HA LYS 116 -12.764 -13.924 1.862 753 1HB LYS 116 2HB LYS 116 -13.489 -15.452 3.722 754 2HB LYS 116 1HB LYS 116 -13.372 -16.165 2.128 755 1HG LYS 116 2HG LYS 116 -11.143 -17.051 2.806 756 2HG LYS 116 1HG LYS 116 -11.490 -16.497 4.450 757 1HD LYS 116 2HD LYS 116 -13.162 -18.412 2.833 758 2HD LYS 116 1HD LYS 116 -12.054 -18.881 4.127 759 1HE LYS 116 2HE LYS 116 -13.418 -17.587 5.727 760 2HE LYS 116 1HE LYS 116 -14.506 -17.129 4.418 761 1HZ LYS 116 1HZ LYS 116 -15.375 -18.967 5.714 762 2HZ LYS 116 2HZ LYS 116 -14.038 -19.921 5.350 763 3HZ LYS 116 3HZ LYS 116 -15.100 -19.453 4.136 764 H SER 117 H SER 117 -9.787 -13.635 2.872 765 HA SER 117 HA SER 117 -10.445 -11.278 4.229 766 1HB SER 117 2HB SER 117 -9.232 -11.735 6.316 767 2HB SER 117 1HB SER 117 -10.660 -12.763 6.135 768 HG SER 117 HG SER 117 -7.972 -13.407 6.148 769 H PHE 118 H PHE 118 -8.629 -9.852 4.223 770 HA PHE 118 HA PHE 118 -6.111 -10.881 3.284 771 1HB PHE 118 2HB PHE 118 -7.312 -10.639 1.168 772 2HB PHE 118 1HB PHE 118 -7.767 -8.991 1.572 773 HD1 PHE 118 1HD PHE 118 -4.926 -11.209 0.755 774 HD2 PHE 118 2HD PHE 118 -6.319 -7.204 1.035 775 HE1 PHE 118 1HE PHE 118 -2.907 -10.434 -0.389 776 HE2 PHE 118 2HE PHE 118 -4.302 -6.422 -0.128 777 HZ PHE 118 HZ PHE 118 -2.589 -8.040 -0.838 778 H LEU 119 H LEU 119 -4.691 -9.915 4.502 779 HA LEU 119 HA LEU 119 -5.012 -7.072 5.141 780 1HB LEU 119 2HB LEU 119 -5.684 -8.511 7.047 781 2HB LEU 119 1HB LEU 119 -4.130 -9.305 6.981 782 HG LEU 119 HG LEU 119 -3.059 -7.128 7.558 783 1HD1 LEU 119 1HD1 LEU 119 -4.464 -5.369 8.487 784 2HD1 LEU 119 2HD1 LEU 119 -5.904 -6.241 7.967 785 3HD1 LEU 119 3HD1 LEU 119 -4.768 -5.615 6.769 786 1HD2 LEU 119 1HD2 LEU 119 -3.691 -7.194 9.910 787 2HD2 LEU 119 2HD2 LEU 119 -3.511 -8.820 9.257 788 3HD2 LEU 119 3HD2 LEU 119 -5.121 -8.141 9.511 789 H LEU 120 H LEU 120 -3.111 -5.970 4.686 790 HA LEU 120 HA LEU 120 -0.680 -7.561 4.507 791 1HB LEU 120 2HB LEU 120 0.054 -6.560 2.448 792 2HB LEU 120 1HB LEU 120 -1.486 -7.332 2.190 793 HG LEU 120 HG LEU 120 -1.080 -4.344 2.485 794 1HD1 LEU 120 1HD1 LEU 120 -1.457 -4.243 0.099 795 2HD1 LEU 120 2HD1 LEU 120 -1.539 -6.003 0.013 796 3HD1 LEU 120 3HD1 LEU 120 -0.029 -5.206 0.469 797 1HD2 LEU 120 1HD2 LEU 120 -3.336 -5.017 3.125 798 2HD2 LEU 120 2HD2 LEU 120 -3.492 -5.956 1.642 799 3HD2 LEU 120 3HD2 LEU 120 -3.366 -4.200 1.565 800 H THR 121 H THR 121 1.112 -6.593 5.122 801 HA THR 121 HA THR 121 0.878 -3.808 6.028 802 HB THR 121 HB THR 121 2.353 -6.055 7.415 803 HG1 THR 121 1HG THR 121 -0.006 -6.124 7.462 804 1HG2 THR 121 1HG2 THR 121 3.302 -3.852 7.763 805 2HG2 THR 121 2HG2 THR 121 2.511 -4.433 9.237 806 3HG2 THR 121 3HG2 THR 121 1.722 -3.229 8.217 807 H ILE 122 H ILE 122 2.596 -2.513 5.429 808 HA ILE 122 HA ILE 122 4.925 -3.910 4.336 809 HB ILE 122 HB ILE 122 5.322 -2.065 2.786 810 1HG1 ILE 122 2HG1 ILE 122 2.675 -0.960 3.692 811 2HG1 ILE 122 1HG1 ILE 122 4.247 -0.280 4.094 812 1HG2 ILE 122 1HG2 ILE 122 4.005 -3.938 1.962 813 2HG2 ILE 122 2HG2 ILE 122 3.426 -2.429 1.252 814 3HG2 ILE 122 3HG2 ILE 122 2.531 -3.174 2.569 815 1HD1 ILE 122 1HD1 ILE 122 3.091 -0.505 1.313 816 2HD1 ILE 122 2HD1 ILE 122 4.664 0.178 1.727 817 3HD1 ILE 122 3HD1 ILE 122 3.190 0.965 2.287 818 H GLN 123 H GLN 123 6.909 -3.101 4.833 819 HA GLN 123 HA GLN 123 7.039 -0.755 6.546 820 1HB GLN 123 2HB GLN 123 6.784 -2.777 8.006 821 2HB GLN 123 1HB GLN 123 8.274 -3.394 7.318 822 1HG GLN 123 2HG GLN 123 9.542 -1.606 8.259 823 2HG GLN 123 1HG GLN 123 8.077 -0.783 8.784 824 1HE2 GLN 123 1HE2 GLN 123 8.660 -0.766 10.880 825 2HE2 GLN 123 2HE2 GLN 123 8.674 -2.162 11.899 826 H VAL 124 H VAL 124 8.776 0.430 6.112 827 HA VAL 124 HA VAL 124 10.574 -0.642 4.081 828 HB VAL 124 HB VAL 124 10.157 2.245 4.937 829 1HG1 VAL 124 1HG1 VAL 124 11.506 2.828 2.974 830 2HG1 VAL 124 2HG1 VAL 124 11.799 1.118 2.665 831 3HG1 VAL 124 3HG1 VAL 124 12.440 1.874 4.125 832 1HG2 VAL 124 1HG2 VAL 124 8.249 1.303 3.756 833 2HG2 VAL 124 2HG2 VAL 124 9.305 0.759 2.455 834 3HG2 VAL 124 3HG2 VAL 124 9.084 2.486 2.749 835 H THR 125 H THR 125 12.467 -1.308 4.540 836 HA THR 125 HA THR 125 13.780 -0.439 7.002 837 HB THR 125 HB THR 125 13.791 -3.142 5.633 838 HG1 THR 125 1HG THR 125 12.297 -1.953 7.621 839 1HG2 THR 125 1HG2 THR 125 14.927 -3.942 7.622 840 2HG2 THR 125 2HG2 THR 125 14.963 -2.307 8.299 841 3HG2 THR 125 3HG2 THR 125 15.900 -2.691 6.843 842 HA PRO 126 HA PRO 126 16.799 1.189 4.099 843 1HB PRO 126 2HB PRO 126 18.944 1.264 5.823 844 2HB PRO 126 1HB PRO 126 17.665 2.481 5.752 845 1HG PRO 126 2HG PRO 126 17.954 0.155 7.613 846 2HG PRO 126 1HG PRO 126 17.485 1.825 7.978 847 1HD PRO 126 2HD PRO 126 15.653 -0.085 7.804 848 2HD PRO 126 1HD PRO 126 15.331 1.533 7.143 849 H LYS 127 H LYS 127 18.634 0.588 2.897 850 HA LYS 127 HA LYS 127 19.201 -2.233 2.940 851 1HB LYS 127 2HB LYS 127 20.106 -0.044 1.071 852 2HB LYS 127 1HB LYS 127 20.625 -1.714 0.932 853 1HG LYS 127 2HG LYS 127 18.317 -2.410 0.631 854 2HG LYS 127 1HG LYS 127 17.792 -0.737 0.763 855 1HD LYS 127 2HD LYS 127 17.890 -1.451 -1.549 856 2HD LYS 127 1HD LYS 127 19.063 -0.170 -1.228 857 1HE LYS 127 2HE LYS 127 20.856 -1.807 -1.112 858 2HE LYS 127 1HE LYS 127 19.705 -3.127 -1.313 859 1HZ LYS 127 1HZ LYS 127 20.846 -2.596 -3.370 860 2HZ LYS 127 2HZ LYS 127 20.283 -1.015 -3.335 861 3HZ LYS 127 3HZ LYS 127 19.207 -2.289 -3.529 862 HA PRO 128 HA PRO 128 22.924 -2.080 5.277 863 1HB PRO 128 2HB PRO 128 24.098 -3.985 3.339 864 2HB PRO 128 1HB PRO 128 23.848 -4.175 5.075 865 1HG PRO 128 2HG PRO 128 22.334 -5.481 3.276 866 2HG PRO 128 1HG PRO 128 21.675 -4.912 4.819 867 1HD PRO 128 2HD PRO 128 21.333 -3.789 2.080 868 2HD PRO 128 1HD PRO 128 20.192 -3.850 3.423 869 H GLY 129 H GLY 129 23.706 -2.514 1.818 870 1HA GLY 129 2HA GLY 129 25.586 -0.267 2.096 871 2HA GLY 129 1HA GLY 129 25.910 -1.687 1.109 872 H GLY 130 H GLY 130 23.087 0.446 1.471 873 1HA GLY 130 2HA GLY 130 23.437 1.301 -1.251 874 2HA GLY 130 1HA GLY 130 22.026 0.299 -0.956 875 HA PRO 131 HA PRO 131 21.504 4.887 0.564 876 1HB PRO 131 2HB PRO 131 20.533 5.527 -2.150 877 2HB PRO 131 1HB PRO 131 21.605 6.461 -1.105 878 1HG PRO 131 2HG PRO 131 22.526 5.206 -3.286 879 2HG PRO 131 1HG PRO 131 23.493 5.325 -1.805 880 1HD PRO 131 2HD PRO 131 21.938 3.009 -2.876 881 2HD PRO 131 1HD PRO 131 23.530 3.053 -2.085 882 H GLY 132 H GLY 132 19.826 2.704 -1.546 883 1HA GLY 132 2HA GLY 132 17.211 3.789 -1.033 884 2HA GLY 132 1HA GLY 132 17.577 2.315 -1.918 885 H SER 133 H SER 133 15.673 1.577 -0.704 886 HA SER 133 HA SER 133 16.514 0.215 1.707 887 1HB SER 133 2HB SER 133 14.140 2.082 1.653 888 2HB SER 133 1HB SER 133 14.532 0.971 2.966 889 HG SER 133 HG SER 133 16.617 2.541 2.166 890 H ILE 134 H ILE 134 15.036 -1.507 2.295 891 HA ILE 134 HA ILE 134 13.517 -2.451 0.008 892 HB ILE 134 HB ILE 134 14.958 -3.889 2.195 893 1HG1 ILE 134 2HG1 ILE 134 15.360 -5.571 0.407 894 2HG1 ILE 134 1HG1 ILE 134 14.450 -4.549 -0.690 895 1HG2 ILE 134 1HG2 ILE 134 13.735 -5.937 1.889 896 2HG2 ILE 134 2HG2 ILE 134 12.504 -5.038 0.970 897 3HG2 ILE 134 3HG2 ILE 134 12.777 -4.676 2.679 898 1HD1 ILE 134 1HD1 ILE 134 16.061 -2.802 -0.334 899 2HD1 ILE 134 2HD1 ILE 134 16.723 -4.297 -1.012 900 3HD1 ILE 134 3HD1 ILE 134 16.977 -3.911 0.718 901 H VAL 135 H VAL 135 11.420 -2.505 0.060 902 HA VAL 135 HA VAL 135 10.123 -2.014 2.589 903 HB VAL 135 HB VAL 135 9.314 -0.604 0.731 904 1HG1 VAL 135 1HG1 VAL 135 8.576 -3.136 -0.672 905 2HG1 VAL 135 2HG1 VAL 135 9.822 -1.987 -1.149 906 3HG1 VAL 135 3HG1 VAL 135 8.123 -1.507 -1.183 907 1HG2 VAL 135 1HG2 VAL 135 7.264 -2.654 1.545 908 2HG2 VAL 135 2HG2 VAL 135 6.905 -1.072 0.857 909 3HG2 VAL 135 3HG2 VAL 135 7.690 -1.190 2.434 910 H HIS 136 H HIS 136 9.419 -3.567 3.721 911 HA HIS 136 HA HIS 136 9.385 -6.248 2.621 912 1HB HIS 136 2HB HIS 136 9.206 -5.206 5.455 913 2HB HIS 136 1HB HIS 136 8.977 -6.902 5.052 914 HD1 HIS 136 1HD HIS 136 11.057 -8.274 4.647 915 HD2 HIS 136 2HD HIS 136 11.909 -4.233 5.164 916 HE1 HIS 136 1HE HIS 136 13.534 -8.120 4.862 917 HE2 HIS 136 2HE HIS 136 14.042 -5.703 5.177 918 H TRP 137 H TRP 137 7.610 -6.869 1.699 919 HA TRP 137 HA TRP 137 5.049 -5.822 2.584 920 1HB TRP 137 2HB TRP 137 5.801 -7.641 0.290 921 2HB TRP 137 1HB TRP 137 4.185 -7.106 0.670 922 HD1 TRP 137 HD TRP 137 7.586 -5.410 -0.324 923 HE1 TRP 137 1HE TRP 137 6.991 -3.398 -1.785 924 HE3 TRP 137 3HE TRP 137 2.485 -5.692 -0.086 925 HZ2 TRP 137 2HZ TRP 137 4.738 -2.103 -2.703 926 HZ3 TRP 137 3HZ TRP 137 1.167 -4.024 -1.285 927 HH2 TRP 137 HH TRP 137 2.243 -2.256 -2.572 928 H HIS 138 H HIS 138 3.973 -6.921 4.051 929 HA HIS 138 HA HIS 138 4.393 -9.819 4.270 930 1HB HIS 138 2HB HIS 138 5.235 -8.556 6.222 931 2HB HIS 138 1HB HIS 138 3.706 -7.719 6.351 932 HD1 HIS 138 1HD HIS 138 5.444 -10.897 7.213 933 HD2 HIS 138 2HD HIS 138 1.713 -9.141 7.567 934 HE1 HIS 138 1HE HIS 138 4.218 -12.289 8.921 935 HE2 HIS 138 2HE HIS 138 1.872 -11.284 9.001 936 H LEU 139 H LEU 139 2.645 -10.771 3.325 937 HA LEU 139 HA LEU 139 0.043 -9.422 3.579 938 1HB LEU 139 2HB LEU 139 0.942 -11.340 1.410 939 2HB LEU 139 1HB LEU 139 -0.623 -10.580 1.521 940 HG LEU 139 HG LEU 139 0.634 -8.347 1.173 941 1HD1 LEU 139 1HD1 LEU 139 2.866 -9.046 1.668 942 2HD1 LEU 139 2HD1 LEU 139 2.740 -8.455 0.011 943 3HD1 LEU 139 3HD1 LEU 139 2.834 -10.185 0.320 944 1HD2 LEU 139 1HD2 LEU 139 0.622 -10.386 -1.043 945 2HD2 LEU 139 2HD2 LEU 139 0.690 -8.637 -1.246 946 3HD2 LEU 139 3HD2 LEU 139 -0.745 -9.385 -0.545 947 H GLU 140 H GLU 140 -1.512 -10.528 4.594 948 HA GLU 140 HA GLU 140 -1.241 -13.430 4.807 949 1HB GLU 140 2HB GLU 140 -2.048 -11.569 7.052 950 2HB GLU 140 1HB GLU 140 -2.163 -13.321 7.113 951 1HG GLU 140 2HG GLU 140 0.267 -13.473 6.816 952 2HG GLU 140 1HG GLU 140 0.356 -11.714 6.819 953 H TYR 141 H TYR 141 -2.966 -14.485 4.280 954 HA TYR 141 HA TYR 141 -5.572 -13.197 4.257 955 1HB TYR 141 2HB TYR 141 -5.838 -13.671 1.769 956 2HB TYR 141 1HB TYR 141 -4.781 -12.340 2.245 957 HD1 TYR 141 1HD TYR 141 -2.460 -12.366 1.751 958 HD2 TYR 141 2HD TYR 141 -4.834 -15.766 0.921 959 HE1 TYR 141 1HE TYR 141 -0.569 -13.351 0.479 960 HE2 TYR 141 2HE TYR 141 -3.009 -16.758 -0.362 961 HH TYR 141 HH TYR 141 0.190 -15.521 -0.239 962 H GLU 142 H GLU 142 -7.294 -14.652 3.670 963 HA GLU 142 HA GLU 142 -6.595 -17.449 4.321 964 1HB GLU 142 2HB GLU 142 -8.023 -16.187 5.930 965 2HB GLU 142 1HB GLU 142 -9.198 -15.953 4.658 966 1HG GLU 142 2HG GLU 142 -9.949 -17.676 6.117 967 2HG GLU 142 1HG GLU 142 -9.524 -18.400 4.567 968 H LYS 143 H LYS 143 -6.782 -18.829 2.630 969 HA LYS 143 HA LYS 143 -7.873 -18.087 0.112 970 1HB LYS 143 2HB LYS 143 -7.009 -20.727 1.245 971 2HB LYS 143 1HB LYS 143 -7.883 -20.669 -0.262 972 1HG LYS 143 2HG LYS 143 -5.535 -20.892 -0.669 973 2HG LYS 143 1HG LYS 143 -6.072 -19.318 -1.224 974 1HD LYS 143 2HD LYS 143 -5.095 -18.275 0.714 975 2HD LYS 143 1HD LYS 143 -4.667 -19.857 1.382 976 1HE LYS 143 2HE LYS 143 -3.652 -18.753 -1.242 977 2HE LYS 143 1HE LYS 143 -2.760 -18.742 0.275 978 1HZ LYS 143 1HZ LYS 143 -2.141 -20.545 -1.194 979 2HZ LYS 143 2HZ LYS 143 -3.675 -21.235 -1.118 980 3HZ LYS 143 3HZ LYS 143 -2.696 -21.127 0.267 981 H ILE 144 H ILE 144 -9.902 -18.230 -0.669 982 HA ILE 144 HA ILE 144 -11.979 -19.430 0.911 983 HB ILE 144 HB ILE 144 -11.982 -18.613 -2.027 984 1HG1 ILE 144 2HG1 ILE 144 -13.040 -17.202 0.416 985 2HG1 ILE 144 1HG1 ILE 144 -11.608 -16.741 -0.494 986 1HG2 ILE 144 1HG2 ILE 144 -14.317 -19.315 -0.230 987 2HG2 ILE 144 2HG2 ILE 144 -13.712 -20.281 -1.579 988 3HG2 ILE 144 3HG2 ILE 144 -14.438 -18.702 -1.880 989 1HD1 ILE 144 1HD1 ILE 144 -13.469 -15.317 -1.019 990 2HD1 ILE 144 2HD1 ILE 144 -14.441 -16.723 -1.470 991 3HD1 ILE 144 3HD1 ILE 144 -13.020 -16.288 -2.432 992 H SER 145 H SER 145 -10.002 -20.214 -1.833 993 HA SER 145 HA SER 145 -9.795 -22.909 -1.198 994 1HB SER 145 2HB SER 145 -12.074 -22.922 -2.282 995 2HB SER 145 1HB SER 145 -11.350 -22.222 -3.725 996 HG SER 145 HG SER 145 -11.712 -24.631 -3.334 997 H GLU 146 H GLU 146 -8.448 -23.871 -3.125 998 HA GLU 146 HA GLU 146 -6.264 -22.123 -3.350 999 1HB GLU 146 2HB GLU 146 -6.825 -24.827 -4.304 1000 2HB GLU 146 1HB GLU 146 -5.369 -23.999 -4.847 1001 1HG GLU 146 2HG GLU 146 -6.108 -24.422 -1.943 1002 2HG GLU 146 1HG GLU 146 -4.975 -25.443 -2.832 1003 H GLU 147 H GLU 147 -8.220 -23.682 -5.900 1004 HA GLU 147 HA GLU 147 -7.113 -22.264 -8.061 1005 1HB GLU 147 2HB GLU 147 -9.887 -23.452 -7.803 1006 2HB GLU 147 1HB GLU 147 -9.195 -22.863 -9.305 1007 1HG GLU 147 2HG GLU 147 -7.421 -24.570 -9.107 1008 2HG GLU 147 1HG GLU 147 -8.206 -25.191 -7.658 1009 H VAL 148 H VAL 148 -9.135 -21.333 -5.655 1010 HA VAL 148 HA VAL 148 -10.449 -19.167 -7.104 1011 HB VAL 148 HB VAL 148 -10.628 -19.879 -4.157 1012 1HG1 VAL 148 1HG1 VAL 148 -12.353 -18.033 -5.814 1013 2HG1 VAL 148 2HG1 VAL 148 -11.240 -17.556 -4.533 1014 3HG1 VAL 148 3HG1 VAL 148 -12.676 -18.510 -4.144 1015 1HG2 VAL 148 1HG2 VAL 148 -12.498 -20.506 -6.430 1016 2HG2 VAL 148 2HG2 VAL 148 -12.764 -20.909 -4.729 1017 3HG2 VAL 148 3HG2 VAL 148 -11.429 -21.644 -5.621 1018 H ALA 149 H ALA 149 -7.583 -19.603 -5.301 1019 HA ALA 149 HA ALA 149 -7.378 -16.735 -4.741 1020 1HB ALA 149 1HB ALA 149 -7.045 -18.204 -2.826 1021 2HB ALA 149 2HB ALA 149 -5.544 -17.370 -3.238 1022 3HB ALA 149 3HB ALA 149 -5.771 -19.059 -3.691 1023 H HIS 150 H HIS 150 -5.723 -15.542 -5.625 1024 HA HIS 150 HA HIS 150 -3.766 -16.980 -7.279 1025 1HB HIS 150 2HB HIS 150 -5.303 -14.537 -8.165 1026 2HB HIS 150 1HB HIS 150 -3.842 -15.103 -8.958 1027 HD1 HIS 150 1HD HIS 150 -4.108 -16.900 -10.692 1028 HD2 HIS 150 2HD HIS 150 -7.549 -16.314 -8.429 1029 HE1 HIS 150 1HE HIS 150 -5.909 -18.197 -11.848 1030 HE2 HIS 150 2HE HIS 150 -8.010 -17.564 -10.634 1031 HA PRO 151 HA PRO 151 -1.443 -14.195 -4.446 1032 1HB PRO 151 2HB PRO 151 0.626 -16.246 -5.020 1033 2HB PRO 151 1HB PRO 151 0.105 -15.599 -3.461 1034 1HG PRO 151 2HG PRO 151 -0.584 -18.068 -4.189 1035 2HG PRO 151 1HG PRO 151 -1.730 -17.023 -3.330 1036 1HD PRO 151 2HD PRO 151 -1.601 -17.691 -6.250 1037 2HD PRO 151 1HD PRO 151 -3.013 -17.571 -5.172 1038 H GLU 152 H GLU 152 -1.115 -15.395 -7.522 1039 HA GLU 152 HA GLU 152 1.233 -14.422 -8.681 1040 1HB GLU 152 2HB GLU 152 -1.483 -14.382 -9.980 1041 2HB GLU 152 1HB GLU 152 0.081 -14.592 -10.751 1042 1HG GLU 152 2HG GLU 152 0.328 -16.677 -9.605 1043 2HG GLU 152 1HG GLU 152 -1.280 -16.538 -8.912 1044 H THR 153 H THR 153 -1.933 -12.982 -8.255 1045 HA THR 153 HA THR 153 -1.270 -10.630 -9.693 1046 HB THR 153 HB THR 153 -3.641 -10.088 -9.346 1047 HG1 THR 153 1HG THR 153 -4.846 -11.270 -7.905 1048 1HG2 THR 153 1HG2 THR 153 -3.008 -11.713 -11.102 1049 2HG2 THR 153 2HG2 THR 153 -4.584 -12.128 -10.410 1050 3HG2 THR 153 3HG2 THR 153 -3.132 -13.016 -9.936 1051 H LEU 154 H LEU 154 -1.533 -11.662 -6.411 1052 HA LEU 154 HA LEU 154 -1.598 -9.165 -5.087 1053 1HB LEU 154 2HB LEU 154 -0.263 -11.710 -4.174 1054 2HB LEU 154 1HB LEU 154 -0.686 -10.353 -3.155 1055 HG LEU 154 HG LEU 154 -2.617 -12.194 -4.559 1056 1HD1 LEU 154 1HD1 LEU 154 -3.178 -12.915 -2.305 1057 2HD1 LEU 154 2HD1 LEU 154 -1.936 -11.852 -1.655 1058 3HD1 LEU 154 3HD1 LEU 154 -1.477 -13.219 -2.661 1059 1HD2 LEU 154 1HD2 LEU 154 -3.525 -9.915 -4.401 1060 2HD2 LEU 154 2HD2 LEU 154 -3.146 -9.904 -2.672 1061 3HD2 LEU 154 3HD2 LEU 154 -4.349 -11.020 -3.298 1062 H LEU 155 H LEU 155 1.079 -11.154 -6.264 1063 HA LEU 155 HA LEU 155 3.112 -9.444 -5.323 1064 1HB LEU 155 2HB LEU 155 3.137 -11.434 -7.573 1065 2HB LEU 155 1HB LEU 155 4.558 -10.568 -7.022 1066 HG LEU 155 HG LEU 155 2.925 -12.510 -5.389 1067 1HD1 LEU 155 1HD1 LEU 155 5.702 -12.656 -6.496 1068 2HD1 LEU 155 2HD1 LEU 155 4.309 -13.565 -7.105 1069 3HD1 LEU 155 3HD1 LEU 155 4.934 -13.871 -5.474 1070 1HD2 LEU 155 1HD2 LEU 155 5.405 -10.944 -4.686 1071 2HD2 LEU 155 2HD2 LEU 155 4.696 -12.236 -3.727 1072 3HD2 LEU 155 3HD2 LEU 155 3.802 -10.742 -3.967 1073 H GLN 156 H GLN 156 1.273 -9.517 -8.288 1074 HA GLN 156 HA GLN 156 2.791 -7.493 -9.541 1075 1HB GLN 156 2HB GLN 156 -0.076 -8.285 -10.040 1076 2HB GLN 156 1HB GLN 156 0.882 -7.256 -11.087 1077 1HG GLN 156 2HG GLN 156 2.482 -9.225 -11.276 1078 2HG GLN 156 1HG GLN 156 1.190 -10.177 -10.550 1079 1HE2 GLN 156 1HE2 GLN 156 2.212 -8.337 -13.236 1080 2HE2 GLN 156 2HE2 GLN 156 1.019 -8.873 -14.367 1081 H PHE 157 H PHE 157 0.012 -7.455 -7.431 1082 HA PHE 157 HA PHE 157 -0.595 -4.720 -7.536 1083 1HB PHE 157 2HB PHE 157 -2.064 -6.356 -6.426 1084 2HB PHE 157 1HB PHE 157 -0.837 -6.650 -5.206 1085 HD1 PHE 157 1HD PHE 157 -1.037 -5.552 -3.170 1086 HD2 PHE 157 2HD PHE 157 -2.851 -3.855 -6.628 1087 HE1 PHE 157 1HE PHE 157 -2.078 -3.758 -1.763 1088 HE2 PHE 157 2HE PHE 157 -3.869 -2.102 -5.245 1089 HZ PHE 157 HZ PHE 157 -3.474 -2.061 -2.813 1090 H CYS 158 H CYS 158 1.767 -6.517 -5.663 1091 HA CYS 158 HA CYS 158 2.735 -4.444 -4.047 1092 1HB CYS 158 2HB CYS 158 4.273 -6.799 -5.177 1093 2HB CYS 158 1HB CYS 158 4.751 -5.823 -3.794 1094 HG CYS 158 HG CYS 158 1.895 -7.718 -3.851 1095 H VAL 159 H VAL 159 3.735 -5.577 -7.250 1096 HA VAL 159 HA VAL 159 5.908 -3.866 -7.656 1097 HB VAL 159 HB VAL 159 4.034 -5.026 -9.737 1098 1HG1 VAL 159 1HG1 VAL 159 5.392 -3.220 -10.646 1099 2HG1 VAL 159 2HG1 VAL 159 5.903 -4.778 -11.298 1100 3HG1 VAL 159 3HG1 VAL 159 6.852 -3.992 -10.030 1101 1HG2 VAL 159 1HG2 VAL 159 6.623 -6.113 -8.632 1102 2HG2 VAL 159 2HG2 VAL 159 5.688 -6.809 -9.955 1103 3HG2 VAL 159 3HG2 VAL 159 5.006 -6.755 -8.330 1104 H GLU 160 H GLU 160 2.480 -3.463 -8.453 1105 HA GLU 160 HA GLU 160 2.781 -1.048 -9.866 1106 1HB GLU 160 2HB GLU 160 0.332 -2.095 -8.463 1107 2HB GLU 160 1HB GLU 160 0.353 -0.796 -9.652 1108 1HG GLU 160 2HG GLU 160 1.111 -3.666 -10.126 1109 2HG GLU 160 1HG GLU 160 -0.360 -2.871 -10.666 1110 H VAL 161 H VAL 161 2.353 -1.660 -6.468 1111 HA VAL 161 HA VAL 161 1.997 1.123 -5.851 1112 HB VAL 161 HB VAL 161 2.914 -1.125 -4.038 1113 1HG1 VAL 161 1HG1 VAL 161 2.202 0.330 -2.182 1114 2HG1 VAL 161 2HG1 VAL 161 1.826 1.609 -3.341 1115 3HG1 VAL 161 3HG1 VAL 161 3.490 1.068 -3.136 1116 1HG2 VAL 161 1HG2 VAL 161 0.707 -1.592 -4.947 1117 2HG2 VAL 161 2HG2 VAL 161 0.152 0.009 -4.466 1118 3HG2 VAL 161 3HG2 VAL 161 0.573 -1.181 -3.237 1119 H SER 162 H SER 162 4.690 -1.161 -5.986 1120 HA SER 162 HA SER 162 6.638 0.308 -4.769 1121 1HB SER 162 2HB SER 162 6.889 -1.707 -6.982 1122 2HB SER 162 1HB SER 162 8.219 -1.123 -5.975 1123 HG SER 162 HG SER 162 5.894 -2.528 -5.114 1124 H LYS 163 H LYS 163 5.679 0.564 -8.218 1125 HA LYS 163 HA LYS 163 7.973 2.186 -8.697 1126 1HB LYS 163 2HB LYS 163 7.118 2.853 -10.894 1127 2HB LYS 163 1HB LYS 163 7.020 1.123 -10.691 1128 1HG LYS 163 2HG LYS 163 4.648 2.924 -10.266 1129 2HG LYS 163 1HG LYS 163 5.102 2.355 -11.866 1130 1HD LYS 163 2HD LYS 163 4.476 0.572 -9.513 1131 2HD LYS 163 1HD LYS 163 3.328 1.015 -10.770 1132 1HE LYS 163 2HE LYS 163 5.932 -0.450 -11.243 1133 2HE LYS 163 1HE LYS 163 4.353 -1.204 -11.142 1134 1HZ LYS 163 1HZ LYS 163 5.095 0.843 -13.171 1135 2HZ LYS 163 2HZ LYS 163 3.650 -0.028 -13.089 1136 3HZ LYS 163 3HZ LYS 163 5.085 -0.819 -13.421 1137 H GLU 164 H GLU 164 4.686 3.016 -7.809 1138 HA GLU 164 HA GLU 164 5.015 5.797 -8.315 1139 1HB GLU 164 2HB GLU 164 2.777 4.651 -8.100 1140 2HB GLU 164 1HB GLU 164 3.113 4.529 -6.367 1141 1HG GLU 164 2HG GLU 164 3.265 6.963 -6.211 1142 2HG GLU 164 1HG GLU 164 2.897 7.100 -7.925 1143 H ILE 165 H ILE 165 5.190 3.805 -5.416 1144 HA ILE 165 HA ILE 165 5.623 5.948 -3.649 1145 HB ILE 165 HB ILE 165 4.755 3.690 -3.060 1146 1HG1 ILE 165 2HG1 ILE 165 5.640 5.209 -1.237 1147 2HG1 ILE 165 1HG1 ILE 165 5.637 3.507 -0.818 1148 1HG2 ILE 165 1HG2 ILE 165 6.293 1.823 -2.575 1149 2HG2 ILE 165 2HG2 ILE 165 7.599 2.763 -3.301 1150 3HG2 ILE 165 3HG2 ILE 165 6.216 2.273 -4.282 1151 1HD1 ILE 165 1HD1 ILE 165 8.027 5.129 -1.660 1152 2HD1 ILE 165 2HD1 ILE 165 8.045 3.420 -1.231 1153 3HD1 ILE 165 3HD1 ILE 165 7.628 4.627 -0.016 1154 H ASP 166 H ASP 166 7.787 3.907 -5.477 1155 HA ASP 166 HA ASP 166 10.267 4.674 -4.407 1156 1HB ASP 166 2HB ASP 166 10.089 2.765 -5.851 1157 2HB ASP 166 1HB ASP 166 9.480 3.751 -7.166 1158 H GLU 167 H GLU 167 8.537 6.010 -7.228 1159 HA GLU 167 HA GLU 167 10.531 8.037 -7.652 1160 1HB GLU 167 2HB GLU 167 8.975 8.922 -9.356 1161 2HB GLU 167 1HB GLU 167 9.304 7.210 -9.569 1162 1HG GLU 167 2HG GLU 167 7.173 6.643 -8.607 1163 2HG GLU 167 1HG GLU 167 6.852 8.332 -8.235 1164 H HIS 168 H HIS 168 7.528 7.875 -5.932 1165 HA HIS 168 HA HIS 168 7.098 10.663 -5.737 1166 1HB HIS 168 2HB HIS 168 5.380 8.822 -5.322 1167 2HB HIS 168 1HB HIS 168 6.141 8.580 -3.759 1168 HD1 HIS 168 1HD HIS 168 3.574 10.515 -5.450 1169 HD2 HIS 168 2HD HIS 168 5.892 10.972 -2.032 1170 HE1 HIS 168 1HE HIS 168 2.434 12.285 -4.101 1171 HE2 HIS 168 2HE HIS 168 4.107 12.810 -2.329 1172 H LEU 169 H LEU 169 8.944 8.371 -3.778 1173 HA LEU 169 HA LEU 169 9.499 10.325 -1.753 1174 1HB LEU 169 2HB LEU 169 10.847 7.701 -2.333 1175 2HB LEU 169 1HB LEU 169 11.238 8.729 -0.977 1176 HG LEU 169 HG LEU 169 8.643 7.277 -1.448 1177 1HD1 LEU 169 1HD1 LEU 169 10.822 6.944 0.608 1178 2HD1 LEU 169 2HD1 LEU 169 10.499 5.873 -0.752 1179 3HD1 LEU 169 3HD1 LEU 169 9.314 6.030 0.543 1180 1HD2 LEU 169 1HD2 LEU 169 8.001 8.106 0.771 1181 2HD2 LEU 169 2HD2 LEU 169 8.208 9.428 -0.372 1182 3HD2 LEU 169 3HD2 LEU 169 9.461 9.094 0.828 1183 H LEU 170 H LEU 170 10.898 9.495 -4.769 1184 HA LEU 170 HA LEU 170 13.423 10.730 -4.230 1185 1HB LEU 170 2HB LEU 170 12.134 10.001 -6.842 1186 2HB LEU 170 1HB LEU 170 13.788 10.549 -6.658 1187 HG LEU 170 HG LEU 170 12.632 8.015 -5.523 1188 1HD1 LEU 170 1HD1 LEU 170 12.909 8.001 -7.910 1189 2HD1 LEU 170 2HD1 LEU 170 14.072 6.916 -7.134 1190 3HD1 LEU 170 3HD1 LEU 170 14.590 8.498 -7.746 1191 1HD2 LEU 170 1HD2 LEU 170 14.946 7.512 -4.857 1192 2HD2 LEU 170 2HD2 LEU 170 14.342 8.950 -4.041 1193 3HD2 LEU 170 3HD2 LEU 170 15.448 9.113 -5.407 1194 H ALA 171 H ALA 171 10.386 11.841 -5.053 1195 HA ALA 171 HA ALA 171 11.226 14.341 -6.163 1196 1HB ALA 171 1HB ALA 171 8.833 14.886 -6.062 1197 2HB ALA 171 2HB ALA 171 8.545 13.417 -5.124 1198 3HB ALA 171 3HB ALA 171 9.098 13.297 -6.791 1199 H GLU 172 H GLU 172 9.668 16.093 -4.842 1200 HA GLU 172 HA GLU 172 11.306 16.862 -2.650 1201 1HB GLU 172 2HB GLU 172 8.635 17.941 -3.497 1202 2HB GLU 172 1HB GLU 172 9.658 18.673 -2.280 1203 1HG GLU 172 2HG GLU 172 11.382 19.048 -3.933 1204 2HG GLU 172 1HG GLU 172 10.378 18.282 -5.169 1205 H GLU 173 H GLU 173 10.780 17.169 -0.492 1206 HA GLU 173 HA GLU 173 8.667 15.418 0.495 1207 1HB GLU 173 2HB GLU 173 10.113 15.171 2.576 1208 2HB GLU 173 1HB GLU 173 10.765 14.422 1.131 1209 1HG GLU 173 2HG GLU 173 12.314 16.270 0.833 1210 2HG GLU 173 1HG GLU 173 11.600 17.110 2.202 Start of MODEL 3 1 H THR 17 H THR 17 -5.897 -26.246 -5.999 2 HA THR 17 HA THR 17 -6.431 -26.326 -3.825 3 HB THR 17 HB THR 17 -8.878 -27.908 -4.651 4 HG1 THR 17 1HG THR 17 -9.640 -26.049 -5.309 5 1HG2 THR 17 1HG2 THR 17 -8.379 -28.006 -2.240 6 2HG2 THR 17 2HG2 THR 17 -9.830 -27.048 -2.545 7 3HG2 THR 17 3HG2 THR 17 -8.300 -26.246 -2.185 8 H GLU 18 H GLU 18 -4.906 -27.190 -2.922 9 HA GLU 18 HA GLU 18 -4.800 -30.082 -2.523 10 1HB GLU 18 2HB GLU 18 -2.358 -29.868 -3.110 11 2HB GLU 18 1HB GLU 18 -3.488 -29.762 -4.463 12 1HG GLU 18 2HG GLU 18 -3.313 -27.298 -4.354 13 2HG GLU 18 1HG GLU 18 -2.119 -27.466 -3.070 14 H ALA 19 H ALA 19 -5.308 -27.532 -0.936 15 HA ALA 19 HA ALA 19 -3.391 -28.075 1.153 16 1HB ALA 19 1HB ALA 19 -3.952 -25.298 0.116 17 2HB ALA 19 2HB ALA 19 -2.451 -26.197 -0.092 18 3HB ALA 19 3HB ALA 19 -2.958 -25.690 1.522 19 H SER 20 H SER 20 -4.603 -28.615 2.775 20 HA SER 20 HA SER 20 -7.359 -27.990 2.988 21 1HB SER 20 2HB SER 20 -5.514 -29.194 5.049 22 2HB SER 20 1HB SER 20 -7.272 -29.308 5.011 23 HG SER 20 HG SER 20 -6.351 -30.071 2.665 24 H SER 21 H SER 21 -4.455 -26.550 4.215 25 HA SER 21 HA SER 21 -5.274 -25.390 6.586 26 1HB SER 21 2HB SER 21 -3.278 -24.285 4.626 27 2HB SER 21 1HB SER 21 -3.356 -23.967 6.361 28 HG SER 21 HG SER 21 -3.175 -26.377 6.534 29 H LEU 22 H LEU 22 -5.556 -24.056 3.298 30 HA LEU 22 HA LEU 22 -6.459 -22.268 2.402 31 1HB LEU 22 2HB LEU 22 -8.208 -22.400 4.831 32 2HB LEU 22 1HB LEU 22 -8.507 -21.321 3.480 33 HG LEU 22 HG LEU 22 -8.314 -24.311 3.170 34 1HD1 LEU 22 1HD1 LEU 22 -10.726 -24.282 3.064 35 2HD1 LEU 22 2HD1 LEU 22 -10.711 -22.555 3.523 36 3HD1 LEU 22 3HD1 LEU 22 -10.074 -23.790 4.627 37 1HD2 LEU 22 1HD2 LEU 22 -9.469 -23.846 1.051 38 2HD2 LEU 22 2HD2 LEU 22 -7.897 -23.048 1.131 39 3HD2 LEU 22 3HD2 LEU 22 -9.379 -22.123 1.387 40 H VAL 23 H VAL 23 -5.674 -21.625 5.755 41 HA VAL 23 HA VAL 23 -5.268 -18.833 5.297 42 HB VAL 23 HB VAL 23 -4.178 -20.591 7.518 43 1HG1 VAL 23 1HG1 VAL 23 -2.857 -18.526 7.233 44 2HG1 VAL 23 2HG1 VAL 23 -3.778 -18.483 8.737 45 3HG1 VAL 23 3HG1 VAL 23 -4.328 -17.569 7.331 46 1HG2 VAL 23 1HG2 VAL 23 -6.531 -18.753 7.389 47 2HG2 VAL 23 2HG2 VAL 23 -5.994 -19.618 8.843 48 3HG2 VAL 23 3HG2 VAL 23 -6.601 -20.514 7.436 49 H GLY 24 H GLY 24 -3.529 -17.836 4.555 50 1HA GLY 24 2HA GLY 24 -1.024 -19.299 4.353 51 2HA GLY 24 1HA GLY 24 -1.783 -18.822 2.842 52 H LYS 25 H LYS 25 0.593 -17.930 3.162 53 HA LYS 25 HA LYS 25 0.249 -15.096 3.688 54 1HB LYS 25 2HB LYS 25 2.504 -16.808 4.654 55 2HB LYS 25 1HB LYS 25 2.634 -15.085 4.278 56 1HG LYS 25 2HG LYS 25 0.964 -14.649 5.989 57 2HG LYS 25 1HG LYS 25 0.967 -16.371 6.403 58 1HD LYS 25 2HD LYS 25 2.504 -15.038 7.857 59 2HD LYS 25 1HD LYS 25 3.328 -16.306 6.945 60 1HE LYS 25 2HE LYS 25 4.066 -14.601 5.257 61 2HE LYS 25 1HE LYS 25 3.236 -13.363 6.164 62 1HZ LYS 25 1HZ LYS 25 5.516 -14.974 7.214 63 2HZ LYS 25 2HZ LYS 25 4.736 -13.729 8.032 64 3HZ LYS 25 3HZ LYS 25 5.646 -13.404 6.654 65 H LEU 26 H LEU 26 1.610 -13.795 2.497 66 HA LEU 26 HA LEU 26 3.483 -15.145 0.864 67 1HB LEU 26 2HB LEU 26 1.546 -14.805 -0.618 68 2HB LEU 26 1HB LEU 26 1.535 -13.103 -0.212 69 HG LEU 26 HG LEU 26 3.705 -12.831 -1.330 70 1HD1 LEU 26 1HD1 LEU 26 4.592 -15.082 -1.038 71 2HD1 LEU 26 2HD1 LEU 26 4.576 -14.627 -2.738 72 3HD1 LEU 26 3HD1 LEU 26 3.347 -15.724 -2.111 73 1HD2 LEU 26 1HD2 LEU 26 1.640 -12.430 -2.511 74 2HD2 LEU 26 2HD2 LEU 26 1.579 -14.135 -2.994 75 3HD2 LEU 26 3HD2 LEU 26 2.883 -13.091 -3.574 76 H GLU 27 H GLU 27 5.334 -14.131 0.824 77 HA GLU 27 HA GLU 27 5.367 -11.450 1.955 78 1HB GLU 27 2HB GLU 27 5.672 -13.177 3.716 79 2HB GLU 27 1HB GLU 27 7.090 -13.743 2.857 80 1HG GLU 27 2HG GLU 27 8.248 -11.722 3.306 81 2HG GLU 27 1HG GLU 27 6.785 -10.970 3.956 82 H THR 28 H THR 28 6.723 -10.143 0.922 83 HA THR 28 HA THR 28 8.902 -11.251 -0.615 84 HB THR 28 HB THR 28 6.936 -11.221 -2.217 85 HG1 THR 28 1HG THR 28 8.898 -10.945 -3.114 86 1HG2 THR 28 1HG2 THR 28 5.701 -9.313 -1.251 87 2HG2 THR 28 2HG2 THR 28 6.034 -9.056 -2.962 88 3HG2 THR 28 3HG2 THR 28 6.995 -8.220 -1.744 89 H ASP 29 H ASP 29 10.312 -9.435 -1.351 90 HA ASP 29 HA ASP 29 9.795 -6.991 0.114 91 1HB ASP 29 2HB ASP 29 12.146 -6.791 0.770 92 2HB ASP 29 1HB ASP 29 11.452 -8.259 1.434 93 H VAL 30 H VAL 30 10.202 -5.223 -0.952 94 HA VAL 30 HA VAL 30 11.287 -5.529 -3.663 95 HB VAL 30 HB VAL 30 9.150 -3.553 -2.743 96 1HG1 VAL 30 1HG1 VAL 30 10.541 -2.622 -4.509 97 2HG1 VAL 30 2HG1 VAL 30 8.929 -2.987 -5.125 98 3HG1 VAL 30 3HG1 VAL 30 10.281 -4.060 -5.496 99 1HG2 VAL 30 1HG2 VAL 30 8.899 -5.975 -4.519 100 2HG2 VAL 30 2HG2 VAL 30 7.620 -4.801 -4.199 101 3HG2 VAL 30 3HG2 VAL 30 8.242 -5.809 -2.887 102 H GLU 31 H GLU 31 12.706 -3.959 -4.326 103 HA GLU 31 HA GLU 31 13.858 -2.435 -2.128 104 1HB GLU 31 2HB GLU 31 15.103 -2.346 -4.839 105 2HB GLU 31 1HB GLU 31 15.776 -2.316 -3.214 106 1HG GLU 31 2HG GLU 31 16.527 -4.330 -4.240 107 2HG GLU 31 1HG GLU 31 15.313 -4.759 -3.036 108 H ILE 32 H ILE 32 13.669 -0.312 -2.024 109 HA ILE 32 HA ILE 32 12.694 1.095 -4.408 110 HB ILE 32 HB ILE 32 11.800 2.854 -2.914 111 1HG1 ILE 32 2HG1 ILE 32 12.520 0.973 -0.641 112 2HG1 ILE 32 1HG1 ILE 32 13.311 2.500 -0.997 113 1HG2 ILE 32 1HG2 ILE 32 10.277 1.134 -3.674 114 2HG2 ILE 32 2HG2 ILE 32 9.853 1.623 -2.034 115 3HG2 ILE 32 3HG2 ILE 32 10.711 0.108 -2.307 116 1HD1 ILE 32 1HD1 ILE 32 11.779 2.721 0.860 117 2HD1 ILE 32 2HD1 ILE 32 10.444 2.148 -0.137 118 3HD1 ILE 32 3HD1 ILE 32 11.222 3.687 -0.503 119 H LYS 33 H LYS 33 13.648 3.063 -4.870 120 HA LYS 33 HA LYS 33 16.480 3.081 -4.166 121 1HB LYS 33 2HB LYS 33 14.964 4.914 -6.006 122 2HB LYS 33 1HB LYS 33 16.708 4.703 -5.944 123 1HG LYS 33 2HG LYS 33 14.694 2.640 -6.775 124 2HG LYS 33 1HG LYS 33 15.728 3.549 -7.866 125 1HD LYS 33 2HD LYS 33 17.690 2.527 -6.806 126 2HD LYS 33 1HD LYS 33 16.621 1.604 -5.746 127 1HE LYS 33 2HE LYS 33 15.594 0.554 -7.692 128 2HE LYS 33 1HE LYS 33 16.662 1.469 -8.750 129 1HZ LYS 33 1HZ LYS 33 17.535 -0.525 -6.732 130 2HZ LYS 33 2HZ LYS 33 18.547 0.341 -7.746 131 3HZ LYS 33 3HZ LYS 33 17.460 -0.782 -8.398 132 H ALA 34 H ALA 34 13.731 4.383 -3.024 133 HA ALA 34 HA ALA 34 14.752 6.939 -2.193 134 1HB ALA 34 1HB ALA 34 12.211 5.500 -1.452 135 2HB ALA 34 2HB ALA 34 12.392 6.679 -2.752 136 3HB ALA 34 3HB ALA 34 12.599 7.177 -1.073 137 H SER 35 H SER 35 14.991 7.510 0.018 138 HA SER 35 HA SER 35 16.153 5.397 1.572 139 1HB SER 35 2HB SER 35 17.280 7.563 1.430 140 2HB SER 35 1HB SER 35 15.861 8.356 2.118 141 HG SER 35 HG SER 35 17.614 7.842 3.609 142 H ALA 36 H ALA 36 15.428 4.717 3.540 143 HA ALA 36 HA ALA 36 12.701 4.570 4.058 144 1HB ALA 36 1HB ALA 36 14.347 2.983 4.945 145 2HB ALA 36 2HB ALA 36 13.347 3.654 6.233 146 3HB ALA 36 3HB ALA 36 14.994 4.241 5.994 147 H ASP 37 H ASP 37 15.087 6.916 4.931 148 HA ASP 37 HA ASP 37 13.740 8.156 7.039 149 1HB ASP 37 2HB ASP 37 15.750 9.305 5.103 150 2HB ASP 37 1HB ASP 37 15.087 10.219 6.449 151 H LYS 38 H LYS 38 13.332 8.530 3.564 152 HA LYS 38 HA LYS 38 11.802 10.878 3.989 153 1HB LYS 38 2HB LYS 38 11.980 9.225 1.487 154 2HB LYS 38 1HB LYS 38 11.136 10.767 1.620 155 1HG LYS 38 2HG LYS 38 13.347 11.720 2.437 156 2HG LYS 38 1HG LYS 38 14.077 10.229 1.855 157 1HD LYS 38 2HD LYS 38 14.292 11.872 0.152 158 2HD LYS 38 1HD LYS 38 13.061 10.698 -0.359 159 1HE LYS 38 2HE LYS 38 11.281 12.233 0.286 160 2HE LYS 38 1HE LYS 38 12.456 13.375 0.929 161 1HZ LYS 38 1HZ LYS 38 12.124 12.580 -1.909 162 2HZ LYS 38 2HZ LYS 38 13.310 13.641 -1.337 163 3HZ LYS 38 3HZ LYS 38 11.686 14.064 -1.215 164 H PHE 39 H PHE 39 11.059 7.515 3.783 165 HA PHE 39 HA PHE 39 8.224 7.807 3.593 166 1HB PHE 39 2HB PHE 39 9.474 5.687 3.065 167 2HB PHE 39 1HB PHE 39 9.846 5.523 4.773 168 HD1 PHE 39 1HD PHE 39 7.230 5.319 2.224 169 HD2 PHE 39 2HD PHE 39 8.163 4.768 6.340 170 HE1 PHE 39 1HE PHE 39 5.138 4.058 2.525 171 HE2 PHE 39 2HE PHE 39 6.066 3.509 6.651 172 HZ PHE 39 HZ PHE 39 4.556 3.153 4.739 173 H HIS 40 H HIS 40 10.571 7.476 6.135 174 HA HIS 40 HA HIS 40 9.009 7.464 8.445 175 1HB HIS 40 2HB HIS 40 11.457 7.010 8.257 176 2HB HIS 40 1HB HIS 40 11.726 8.707 7.946 177 HD1 HIS 40 1HD HIS 40 11.966 6.325 10.523 178 HD2 HIS 40 2HD HIS 40 10.774 10.293 10.365 179 HE1 HIS 40 1HE HIS 40 12.243 7.205 12.851 180 HE2 HIS 40 2HE HIS 40 11.161 9.464 12.770 181 H HIS 41 H HIS 41 10.294 10.108 6.503 182 HA HIS 41 HA HIS 41 9.274 12.172 8.218 183 1HB HIS 41 2HB HIS 41 10.618 12.317 5.528 184 2HB HIS 41 1HB HIS 41 9.918 13.728 6.293 185 HD1 HIS 41 1HD HIS 41 11.831 15.069 7.089 186 HD2 HIS 41 2HD HIS 41 12.366 11.033 7.845 187 HE1 HIS 41 1HE HIS 41 13.993 14.906 8.355 188 HE2 HIS 41 2HE HIS 41 14.288 12.449 8.834 189 H MET 42 H MET 42 8.133 10.773 5.170 190 HA MET 42 HA MET 42 6.470 12.849 4.396 191 1HB MET 42 2HB MET 42 5.233 11.303 2.998 192 2HB MET 42 1HB MET 42 6.956 10.996 2.890 193 1HG MET 42 2HG MET 42 6.719 9.076 4.367 194 2HG MET 42 1HG MET 42 5.002 9.405 4.541 195 1HE MET 42 1HE MET 42 3.218 9.121 2.591 196 2HE MET 42 2HE MET 42 3.638 8.654 0.945 197 3HE MET 42 3HE MET 42 4.145 10.220 1.568 198 H PHE 43 H PHE 43 5.710 10.420 6.811 199 HA PHE 43 HA PHE 43 2.912 11.163 6.737 200 1HB PHE 43 2HB PHE 43 3.558 8.806 7.121 201 2HB PHE 43 1HB PHE 43 4.328 9.274 8.632 202 HD1 PHE 43 1HD PHE 43 1.100 8.912 6.888 203 HD2 PHE 43 2HD PHE 43 3.031 9.628 10.608 204 HE1 PHE 43 1HE PHE 43 -1.036 8.584 8.052 205 HE2 PHE 43 2HE PHE 43 0.889 9.296 11.788 206 HZ PHE 43 HZ PHE 43 -1.148 8.775 10.506 207 H ALA 44 H ALA 44 5.684 12.222 8.466 208 HA ALA 44 HA ALA 44 3.929 13.683 10.329 209 1HB ALA 44 1HB ALA 44 4.824 11.737 11.496 210 2HB ALA 44 2HB ALA 44 5.474 13.234 12.169 211 3HB ALA 44 3HB ALA 44 6.462 12.244 11.096 212 H GLY 45 H GLY 45 5.534 14.320 7.872 213 1HA GLY 45 2HA GLY 45 7.065 16.550 9.026 214 2HA GLY 45 1HA GLY 45 7.704 15.591 7.694 215 H LYS 46 H LYS 46 4.476 16.784 8.345 216 HA LYS 46 HA LYS 46 3.027 18.048 7.270 217 1HB LYS 46 2HB LYS 46 5.441 19.428 6.064 218 2HB LYS 46 1HB LYS 46 3.799 19.953 5.806 219 1HG LYS 46 2HG LYS 46 4.729 21.375 7.478 220 2HG LYS 46 1HG LYS 46 3.607 20.300 8.293 221 1HD LYS 46 2HD LYS 46 5.651 20.604 9.590 222 2HD LYS 46 1HD LYS 46 5.496 18.929 9.060 223 1HE LYS 46 2HE LYS 46 7.795 19.770 8.821 224 2HE LYS 46 1HE LYS 46 7.109 19.316 7.269 225 1HZ LYS 46 1HZ LYS 46 8.341 21.396 7.199 226 2HZ LYS 46 2HZ LYS 46 7.309 22.100 8.313 227 3HZ LYS 46 3HZ LYS 46 6.738 21.661 6.784 228 HA PRO 47 HA PRO 47 2.583 15.764 3.442 229 1HB PRO 47 2HB PRO 47 -0.106 15.699 3.464 230 2HB PRO 47 1HB PRO 47 0.844 14.675 4.547 231 1HG PRO 47 2HG PRO 47 -0.583 17.236 5.136 232 2HG PRO 47 1HG PRO 47 -0.458 15.769 6.119 233 1HD PRO 47 2HD PRO 47 1.059 18.040 6.481 234 2HD PRO 47 1HD PRO 47 1.527 16.417 7.025 235 H HIS 48 H HIS 48 2.751 18.744 3.856 236 HA HIS 48 HA HIS 48 0.921 20.147 2.201 237 1HB HIS 48 2HB HIS 48 2.247 21.295 3.902 238 2HB HIS 48 1HB HIS 48 3.732 20.803 3.117 239 HD1 HIS 48 1HD HIS 48 4.725 22.448 1.446 240 HD2 HIS 48 2HD HIS 48 0.741 23.301 2.307 241 HE1 HIS 48 1HE HIS 48 4.247 24.591 0.337 242 HE2 HIS 48 2HE HIS 48 1.863 25.093 0.801 243 H HIS 49 H HIS 49 1.044 20.684 0.037 244 HA HIS 49 HA HIS 49 3.470 19.942 -1.386 245 1HB HIS 49 2HB HIS 49 2.274 19.012 -3.275 246 2HB HIS 49 1HB HIS 49 1.717 18.184 -1.842 247 HD1 HIS 49 1HD HIS 49 -0.778 17.754 -1.956 248 HD2 HIS 49 2HD HIS 49 0.355 21.223 -3.936 249 HE1 HIS 49 1HE HIS 49 -2.864 18.641 -2.953 250 HE2 HIS 49 2HE HIS 49 -2.077 20.477 -4.468 251 H VAL 50 H VAL 50 4.082 21.351 -2.961 252 HA VAL 50 HA VAL 50 2.506 23.804 -2.954 253 HB VAL 50 HB VAL 50 4.908 24.045 -2.367 254 1HG1 VAL 50 1HG1 VAL 50 5.868 22.253 -3.638 255 2HG1 VAL 50 2HG1 VAL 50 6.661 23.775 -4.055 256 3HG1 VAL 50 3HG1 VAL 50 5.468 23.073 -5.150 257 1HG2 VAL 50 1HG2 VAL 50 5.469 25.885 -3.916 258 2HG2 VAL 50 2HG2 VAL 50 3.796 25.942 -3.366 259 3HG2 VAL 50 3HG2 VAL 50 4.172 25.342 -4.980 260 H SER 51 H SER 51 1.553 24.550 -4.792 261 HA SER 51 HA SER 51 1.624 22.691 -7.047 262 1HB SER 51 2HB SER 51 -0.523 24.642 -6.243 263 2HB SER 51 1HB SER 51 -0.603 23.489 -7.571 264 HG SER 51 HG SER 51 -1.631 22.782 -5.704 265 H LYS 52 H LYS 52 3.225 23.513 -8.326 266 HA LYS 52 HA LYS 52 2.654 26.035 -9.633 267 1HB LYS 52 2HB LYS 52 5.350 25.260 -8.489 268 2HB LYS 52 1HB LYS 52 5.071 26.602 -9.589 269 1HG LYS 52 2HG LYS 52 3.697 27.720 -7.946 270 2HG LYS 52 1HG LYS 52 3.828 26.338 -6.860 271 1HD LYS 52 2HD LYS 52 5.321 28.095 -6.163 272 2HD LYS 52 1HD LYS 52 6.236 26.695 -6.729 273 1HE LYS 52 2HE LYS 52 6.553 27.820 -8.905 274 2HE LYS 52 1HE LYS 52 5.684 29.221 -8.284 275 1HZ LYS 52 1HZ LYS 52 8.212 28.135 -7.200 276 2HZ LYS 52 2HZ LYS 52 7.403 29.504 -6.626 277 3HZ LYS 52 3HZ LYS 52 8.067 29.505 -8.183 278 H ALA 53 H ALA 53 4.313 26.117 -11.602 279 HA ALA 53 HA ALA 53 5.046 25.243 -13.561 280 1HB ALA 53 1HB ALA 53 5.549 22.743 -11.934 281 2HB ALA 53 2HB ALA 53 6.676 24.084 -12.117 282 3HB ALA 53 3HB ALA 53 6.243 23.096 -13.517 283 H SER 54 H SER 54 2.269 25.019 -12.789 284 HA SER 54 HA SER 54 0.312 24.225 -13.451 285 1HB SER 54 2HB SER 54 1.930 22.943 -15.668 286 2HB SER 54 1HB SER 54 0.166 22.940 -15.639 287 HG SER 54 HG SER 54 0.215 25.181 -15.619 288 HA PRO 55 HA PRO 55 0.747 20.513 -10.974 289 1HB PRO 55 2HB PRO 55 -1.377 20.990 -9.394 290 2HB PRO 55 1HB PRO 55 0.165 21.829 -9.185 291 1HG PRO 55 2HG PRO 55 -2.360 22.791 -10.452 292 2HG PRO 55 1HG PRO 55 -1.213 23.676 -9.442 293 1HD PRO 55 2HD PRO 55 -1.326 23.816 -12.188 294 2HD PRO 55 1HD PRO 55 0.102 24.215 -11.214 295 H GLY 56 H GLY 56 -2.508 21.553 -12.076 296 1HA GLY 56 2HA GLY 56 -3.817 20.183 -13.507 297 2HA GLY 56 1HA GLY 56 -2.992 18.774 -12.838 298 H ASN 57 H ASN 57 -5.152 17.977 -12.479 299 HA ASN 57 HA ASN 57 -6.907 17.398 -11.205 300 1HB ASN 57 2HB ASN 57 -5.179 17.161 -9.409 301 2HB ASN 57 1HB ASN 57 -5.473 18.828 -8.941 302 1HD2 ASN 57 1HD2 ASN 57 -7.344 19.328 -7.788 303 2HD2 ASN 57 2HD2 ASN 57 -8.350 18.124 -7.087 304 H ILE 58 H ILE 58 -8.604 18.403 -12.049 305 HA ILE 58 HA ILE 58 -8.915 21.220 -11.516 306 HB ILE 58 HB ILE 58 -10.765 21.163 -13.209 307 1HG1 ILE 58 2HG1 ILE 58 -9.719 18.362 -13.755 308 2HG1 ILE 58 1HG1 ILE 58 -11.277 18.722 -13.025 309 1HG2 ILE 58 1HG2 ILE 58 -8.027 20.266 -14.092 310 2HG2 ILE 58 2HG2 ILE 58 -8.543 21.923 -13.780 311 3HG2 ILE 58 3HG2 ILE 58 -9.233 21.023 -15.132 312 1HD1 ILE 58 1HD1 ILE 58 -11.981 19.815 -15.094 313 2HD1 ILE 58 2HD1 ILE 58 -11.475 18.149 -15.388 314 3HD1 ILE 58 3HD1 ILE 58 -10.399 19.484 -15.802 315 H GLN 59 H GLN 59 -9.543 21.318 -9.458 316 HA GLN 59 HA GLN 59 -11.001 21.598 -7.741 317 1HB GLN 59 2HB GLN 59 -13.053 21.216 -9.925 318 2HB GLN 59 1HB GLN 59 -13.448 21.714 -8.294 319 1HG GLN 59 2HG GLN 59 -12.166 23.752 -8.569 320 2HG GLN 59 1HG GLN 59 -11.661 23.237 -10.180 321 1HE2 GLN 59 1HE2 GLN 59 -13.195 25.593 -9.309 322 2HE2 GLN 59 2HE2 GLN 59 -14.666 25.540 -10.213 323 H GLY 60 H GLY 60 -13.368 20.441 -6.984 324 1HA GLY 60 2HA GLY 60 -14.170 18.004 -7.175 325 2HA GLY 60 1HA GLY 60 -12.550 17.654 -6.589 326 H CYS 61 H CYS 61 -12.870 20.321 -5.063 327 HA CYS 61 HA CYS 61 -13.357 21.057 -3.018 328 1HB CYS 61 2HB CYS 61 -15.679 19.122 -3.110 329 2HB CYS 61 1HB CYS 61 -15.442 20.334 -1.857 330 HG CYS 61 HG CYS 61 -15.413 21.526 -4.974 331 H ASP 62 H ASP 62 -13.429 17.561 -3.196 332 HA ASP 62 HA ASP 62 -12.746 17.108 -0.474 333 1HB ASP 62 2HB ASP 62 -13.823 15.369 -1.824 334 2HB ASP 62 1HB ASP 62 -12.412 15.302 -2.875 335 H LEU 63 H LEU 63 -10.797 16.806 0.481 336 HA LEU 63 HA LEU 63 -8.444 17.083 -1.213 337 1HB LEU 63 2HB LEU 63 -8.884 19.241 -0.130 338 2HB LEU 63 1HB LEU 63 -8.901 18.460 1.434 339 HG LEU 63 HG LEU 63 -6.514 17.930 1.207 340 1HD1 LEU 63 1HD1 LEU 63 -6.382 17.757 -1.217 341 2HD1 LEU 63 2HD1 LEU 63 -5.212 18.929 -0.616 342 3HD1 LEU 63 3HD1 LEU 63 -6.704 19.483 -1.370 343 1HD2 LEU 63 1HD2 LEU 63 -7.181 20.834 0.744 344 2HD2 LEU 63 2HD2 LEU 63 -5.675 20.220 1.426 345 3HD2 LEU 63 3HD2 LEU 63 -7.194 20.004 2.298 346 H HIS 64 H HIS 64 -8.122 14.916 -1.139 347 HA HIS 64 HA HIS 64 -6.788 13.937 1.232 348 1HB HIS 64 2HB HIS 64 -9.112 12.454 -0.043 349 2HB HIS 64 1HB HIS 64 -7.970 11.715 1.062 350 HD1 HIS 64 1HD HIS 64 -11.135 13.607 0.958 351 HD2 HIS 64 2HD HIS 64 -8.169 12.770 3.757 352 HE1 HIS 64 1HE HIS 64 -12.129 14.129 3.166 353 HE2 HIS 64 2HE HIS 64 -10.167 14.043 4.717 354 H GLU 65 H GLU 65 -4.850 13.767 0.185 355 HA GLU 65 HA GLU 65 -4.762 12.592 -2.426 356 1HB GLU 65 2HB GLU 65 -2.536 13.366 -0.526 357 2HB GLU 65 1HB GLU 65 -2.252 12.642 -2.097 358 1HG GLU 65 2HG GLU 65 -3.393 14.586 -3.140 359 2HG GLU 65 1HG GLU 65 -3.521 15.316 -1.540 360 H GLY 66 H GLY 66 -3.200 11.651 0.641 361 1HA GLY 66 2HA GLY 66 -4.023 8.915 0.032 362 2HA GLY 66 1HA GLY 66 -2.331 9.267 0.298 363 H ASP 67 H ASP 67 -4.497 11.163 2.255 364 HA ASP 67 HA ASP 67 -4.499 9.207 4.410 365 1HB ASP 67 2HB ASP 67 -3.135 10.421 5.959 366 2HB ASP 67 1HB ASP 67 -2.196 10.221 4.483 367 H TRP 68 H TRP 68 -5.670 9.866 6.215 368 HA TRP 68 HA TRP 68 -7.261 12.332 6.010 369 1HB TRP 68 2HB TRP 68 -7.581 9.840 7.691 370 2HB TRP 68 1HB TRP 68 -8.493 11.306 7.999 371 HD1 TRP 68 HD TRP 68 -7.956 8.858 5.026 372 HE1 TRP 68 1HE TRP 68 -10.193 8.612 3.807 373 HE3 TRP 68 3HE TRP 68 -10.709 12.147 7.785 374 HZ2 TRP 68 2HZ TRP 68 -12.808 9.678 4.000 375 HZ3 TRP 68 3HZ TRP 68 -13.073 12.472 7.210 376 HH2 TRP 68 HH TRP 68 -14.097 11.268 5.355 377 H GLY 69 H GLY 69 -4.503 11.079 7.363 378 1HA GLY 69 2HA GLY 69 -2.977 12.184 8.736 379 2HA GLY 69 1HA GLY 69 -4.257 13.268 9.255 380 H THR 70 H THR 70 -5.757 10.540 9.579 381 HA THR 70 HA THR 70 -4.859 10.079 12.343 382 HB THR 70 HB THR 70 -7.638 9.869 11.171 383 HG1 THR 70 1HG THR 70 -6.257 11.926 12.506 384 1HG2 THR 70 1HG2 THR 70 -6.691 9.864 14.047 385 2HG2 THR 70 2HG2 THR 70 -7.285 8.461 13.157 386 3HG2 THR 70 3HG2 THR 70 -8.372 9.802 13.515 387 H VAL 71 H VAL 71 -4.906 7.846 13.047 388 HA VAL 71 HA VAL 71 -4.551 5.864 11.038 389 HB VAL 71 HB VAL 71 -5.162 5.404 13.971 390 1HG1 VAL 71 1HG1 VAL 71 -3.719 3.681 11.968 391 2HG1 VAL 71 2HG1 VAL 71 -5.334 3.406 12.620 392 3HG1 VAL 71 3HG1 VAL 71 -3.924 3.317 13.681 393 1HG2 VAL 71 1HG2 VAL 71 -2.735 5.345 14.351 394 2HG2 VAL 71 2HG2 VAL 71 -3.284 6.930 13.808 395 3HG2 VAL 71 3HG2 VAL 71 -2.474 5.850 12.679 396 H GLY 72 H GLY 72 -6.023 4.245 10.377 397 1HA GLY 72 2HA GLY 72 -8.187 3.260 10.408 398 2HA GLY 72 1HA GLY 72 -8.785 4.687 11.264 399 H SER 73 H SER 73 -6.691 5.755 9.106 400 HA SER 73 HA SER 73 -8.434 7.146 7.470 401 1HB SER 73 2HB SER 73 -6.096 7.773 7.960 402 2HB SER 73 1HB SER 73 -5.546 6.367 7.058 403 HG SER 73 HG SER 73 -6.118 7.290 5.217 404 H ILE 74 H ILE 74 -9.298 6.726 5.520 405 HA ILE 74 HA ILE 74 -8.539 4.316 4.061 406 HB ILE 74 HB ILE 74 -11.324 5.371 4.569 407 1HG1 ILE 74 2HG1 ILE 74 -10.037 2.725 5.152 408 2HG1 ILE 74 1HG1 ILE 74 -10.290 4.018 6.315 409 1HG2 ILE 74 1HG2 ILE 74 -12.124 3.549 3.114 410 2HG2 ILE 74 2HG2 ILE 74 -10.456 3.141 2.720 411 3HG2 ILE 74 3HG2 ILE 74 -11.125 4.693 2.219 412 1HD1 ILE 74 1HD1 ILE 74 -12.379 2.476 4.825 413 2HD1 ILE 74 2HD1 ILE 74 -12.698 3.802 5.954 414 3HD1 ILE 74 3HD1 ILE 74 -11.978 2.295 6.541 415 H VAL 75 H VAL 75 -7.749 5.012 2.238 416 HA VAL 75 HA VAL 75 -9.031 7.325 0.948 417 HB VAL 75 HB VAL 75 -6.884 7.975 2.118 418 1HG1 VAL 75 1HG1 VAL 75 -5.627 5.948 1.689 419 2HG1 VAL 75 2HG1 VAL 75 -4.744 7.374 1.135 420 3HG1 VAL 75 3HG1 VAL 75 -5.574 6.323 -0.020 421 1HG2 VAL 75 1HG2 VAL 75 -6.972 8.356 -0.877 422 2HG2 VAL 75 2HG2 VAL 75 -6.053 9.358 0.255 423 3HG2 VAL 75 3HG2 VAL 75 -7.813 9.335 0.322 424 H PHE 76 H PHE 76 -8.788 7.351 -1.367 425 HA PHE 76 HA PHE 76 -8.129 4.687 -2.357 426 1HB PHE 76 2HB PHE 76 -10.163 6.622 -3.490 427 2HB PHE 76 1HB PHE 76 -9.818 4.988 -4.073 428 HD1 PHE 76 1HD PHE 76 -9.582 3.489 -1.686 429 HD2 PHE 76 2HD PHE 76 -12.336 6.547 -2.604 430 HE1 PHE 76 1HE PHE 76 -11.075 2.535 -0.079 431 HE2 PHE 76 2HE PHE 76 -13.926 5.615 -0.960 432 HZ PHE 76 HZ PHE 76 -13.320 3.593 0.318 433 H TRP 77 H TRP 77 -6.497 4.565 -3.641 434 HA TRP 77 HA TRP 77 -5.470 7.044 -4.794 435 1HB TRP 77 2HB TRP 77 -4.173 5.843 -2.958 436 2HB TRP 77 1HB TRP 77 -3.987 4.509 -4.085 437 HD1 TRP 77 HD TRP 77 -2.548 5.061 -6.291 438 HE1 TRP 77 1HE TRP 77 -0.504 6.707 -6.598 439 HE3 TRP 77 3HE TRP 77 -3.217 7.959 -2.187 440 HZ2 TRP 77 2HZ TRP 77 0.599 8.881 -5.244 441 HZ3 TRP 77 3HZ TRP 77 -1.641 9.792 -1.742 442 HH2 TRP 77 HH TRP 77 0.225 10.242 -3.237 443 H ASN 78 H ASN 78 -4.822 6.911 -6.950 444 HA ASN 78 HA ASN 78 -5.917 4.603 -8.389 445 1HB ASN 78 2HB ASN 78 -5.334 7.411 -9.354 446 2HB ASN 78 1HB ASN 78 -5.822 6.098 -10.414 447 1HD2 ASN 78 1HD2 ASN 78 -7.965 5.392 -10.363 448 2HD2 ASN 78 2HD2 ASN 78 -9.199 6.290 -9.582 449 H TYR 79 H TYR 79 -4.667 3.317 -9.519 450 HA TYR 79 HA TYR 79 -1.893 4.124 -9.994 451 1HB TYR 79 2HB TYR 79 -1.120 1.844 -9.494 452 2HB TYR 79 1HB TYR 79 -1.965 2.493 -8.101 453 HD1 TYR 79 1HD TYR 79 -1.849 -0.127 -10.590 454 HD2 TYR 79 2HD TYR 79 -4.290 1.631 -7.578 455 HE1 TYR 79 1HE TYR 79 -3.253 -2.140 -10.562 456 HE2 TYR 79 2HE TYR 79 -5.700 -0.388 -7.543 457 HH TYR 79 HH TYR 79 -4.796 -3.303 -9.008 458 H VAL 80 H VAL 80 -0.981 3.086 -11.895 459 HA VAL 80 HA VAL 80 -3.151 2.526 -13.769 460 HB VAL 80 HB VAL 80 -0.379 3.597 -14.380 461 1HG1 VAL 80 1HG1 VAL 80 -1.240 3.972 -16.648 462 2HG1 VAL 80 2HG1 VAL 80 -2.768 3.224 -16.187 463 3HG1 VAL 80 3HG1 VAL 80 -1.294 2.262 -16.215 464 1HG2 VAL 80 1HG2 VAL 80 -1.532 5.706 -14.896 465 2HG2 VAL 80 2HG2 VAL 80 -1.760 5.230 -13.207 466 3HG2 VAL 80 3HG2 VAL 80 -3.054 4.980 -14.373 467 H HIS 81 H HIS 81 -3.340 0.584 -14.389 468 HA HIS 81 HA HIS 81 -0.976 -1.131 -14.504 469 1HB HIS 81 2HB HIS 81 -2.234 -1.691 -12.497 470 2HB HIS 81 1HB HIS 81 -3.709 -1.852 -13.436 471 HD1 HIS 81 1HD HIS 81 -0.347 -3.495 -13.028 472 HD2 HIS 81 2HD HIS 81 -4.169 -4.344 -14.341 473 HE1 HIS 81 1HE HIS 81 -0.371 -6.003 -13.420 474 HE2 HIS 81 2HE HIS 81 -2.763 -6.512 -13.933 475 H ASP 82 H ASP 82 -0.639 -1.493 -16.514 476 HA ASP 82 HA ASP 82 -0.837 -2.086 -18.666 477 1HB ASP 82 2HB ASP 82 -3.441 -3.283 -17.749 478 2HB ASP 82 1HB ASP 82 -2.810 -3.485 -19.377 479 H GLY 83 H GLY 83 -1.670 0.433 -17.808 480 1HA GLY 83 2HA GLY 83 -2.199 2.267 -19.126 481 2HA GLY 83 1HA GLY 83 -3.072 1.218 -20.226 482 H GLU 84 H GLU 84 -4.432 0.199 -17.527 483 HA GLU 84 HA GLU 84 -6.443 2.327 -17.579 484 1HB GLU 84 2HB GLU 84 -6.530 -0.382 -16.252 485 2HB GLU 84 1HB GLU 84 -7.743 0.848 -16.004 486 1HG GLU 84 2HG GLU 84 -8.617 -0.658 -17.486 487 2HG GLU 84 1HG GLU 84 -8.189 0.738 -18.458 488 H ALA 85 H ALA 85 -6.977 3.523 -15.871 489 HA ALA 85 HA ALA 85 -5.105 3.426 -13.637 490 1HB ALA 85 1HB ALA 85 -7.268 5.455 -14.290 491 2HB ALA 85 2HB ALA 85 -5.541 5.653 -14.600 492 3HB ALA 85 3HB ALA 85 -6.139 5.565 -12.945 493 H LYS 86 H LYS 86 -5.649 2.232 -12.037 494 HA LYS 86 HA LYS 86 -8.473 1.505 -11.717 495 1HB LYS 86 2HB LYS 86 -6.085 -0.103 -10.763 496 2HB LYS 86 1HB LYS 86 -7.744 -0.657 -10.984 497 1HG LYS 86 2HG LYS 86 -7.489 -0.326 -13.435 498 2HG LYS 86 1HG LYS 86 -5.810 0.113 -13.173 499 1HD LYS 86 2HD LYS 86 -5.750 -2.137 -13.845 500 2HD LYS 86 1HD LYS 86 -5.567 -2.206 -12.091 501 1HE LYS 86 2HE LYS 86 -7.973 -2.710 -11.883 502 2HE LYS 86 1HE LYS 86 -8.074 -2.584 -13.655 503 1HZ LYS 86 1HZ LYS 86 -7.962 -4.912 -12.939 504 2HZ LYS 86 2HZ LYS 86 -6.485 -4.668 -12.203 505 3HZ LYS 86 3HZ LYS 86 -6.649 -4.481 -13.880 506 H VAL 87 H VAL 87 -8.857 0.881 -9.309 507 HA VAL 87 HA VAL 87 -7.646 3.058 -7.747 508 HB VAL 87 HB VAL 87 -10.400 1.839 -7.395 509 1HG1 VAL 87 1HG1 VAL 87 -9.168 4.278 -6.137 510 2HG1 VAL 87 2HG1 VAL 87 -9.510 2.746 -5.333 511 3HG1 VAL 87 3HG1 VAL 87 -10.837 3.744 -5.929 512 1HG2 VAL 87 1HG2 VAL 87 -9.638 4.467 -8.660 513 2HG2 VAL 87 2HG2 VAL 87 -11.282 3.926 -8.320 514 3HG2 VAL 87 3HG2 VAL 87 -10.295 3.059 -9.496 515 H ALA 88 H ALA 88 -6.834 2.573 -5.801 516 HA ALA 88 HA ALA 88 -7.019 -0.206 -4.909 517 1HB ALA 88 1HB ALA 88 -4.734 0.578 -5.339 518 2HB ALA 88 2HB ALA 88 -4.987 0.284 -3.617 519 3HB ALA 88 3HB ALA 88 -4.991 1.937 -4.238 520 H LYS 89 H LYS 89 -8.248 -0.541 -3.217 521 HA LYS 89 HA LYS 89 -9.024 1.737 -1.610 522 1HB LYS 89 2HB LYS 89 -10.459 -0.805 -2.308 523 2HB LYS 89 1HB LYS 89 -11.146 0.385 -1.212 524 1HG LYS 89 2HG LYS 89 -11.009 2.062 -3.072 525 2HG LYS 89 1HG LYS 89 -10.483 0.768 -4.138 526 1HD LYS 89 2HD LYS 89 -12.610 -0.371 -3.812 527 2HD LYS 89 1HD LYS 89 -13.131 0.893 -2.683 528 1HE LYS 89 2HE LYS 89 -12.906 2.545 -4.506 529 2HE LYS 89 1HE LYS 89 -12.446 1.247 -5.600 530 1HZ LYS 89 1HZ LYS 89 -15.047 1.486 -4.197 531 2HZ LYS 89 2HZ LYS 89 -14.622 0.243 -5.249 532 3HZ LYS 89 3HZ LYS 89 -14.765 1.828 -5.830 533 H GLU 90 H GLU 90 -8.525 1.719 0.517 534 HA GLU 90 HA GLU 90 -7.346 -0.682 1.565 535 1HB GLU 90 2HB GLU 90 -5.287 0.607 2.076 536 2HB GLU 90 1HB GLU 90 -5.546 0.283 0.372 537 1HG GLU 90 2HG GLU 90 -4.889 2.509 0.263 538 2HG GLU 90 1HG GLU 90 -6.645 2.634 0.390 539 H ARG 91 H ARG 91 -6.731 -0.393 3.737 540 HA ARG 91 HA ARG 91 -8.020 1.768 5.209 541 1HB ARG 91 2HB ARG 91 -9.616 0.073 5.423 542 2HB ARG 91 1HB ARG 91 -8.406 -1.187 5.523 543 1HG ARG 91 2HG ARG 91 -9.461 -0.899 7.682 544 2HG ARG 91 1HG ARG 91 -7.790 -0.355 7.775 545 1HD ARG 91 2HD ARG 91 -8.577 1.965 7.514 546 2HD ARG 91 1HD ARG 91 -10.245 1.385 7.544 547 HE ARG 91 HE ARG 91 -8.324 1.037 9.738 548 1HH1 ARG 91 1HH1 ARG 91 -11.645 1.635 8.629 549 2HH1 ARG 91 2HH1 ARG 91 -12.281 1.856 10.189 550 1HH2 ARG 91 1HH2 ARG 91 -9.244 1.301 11.931 551 2HH2 ARG 91 2HH2 ARG 91 -10.898 1.658 12.082 552 H ILE 92 H ILE 92 -6.441 2.688 6.409 553 HA ILE 92 HA ILE 92 -4.084 1.172 7.058 554 HB ILE 92 HB ILE 92 -4.990 3.910 8.028 555 1HG1 ILE 92 2HG1 ILE 92 -2.905 3.091 5.995 556 2HG1 ILE 92 1HG1 ILE 92 -4.441 3.878 5.656 557 1HG2 ILE 92 1HG2 ILE 92 -2.706 4.212 8.896 558 2HG2 ILE 92 2HG2 ILE 92 -2.338 2.536 8.492 559 3HG2 ILE 92 3HG2 ILE 92 -3.563 2.902 9.709 560 1HD1 ILE 92 1HD1 ILE 92 -2.131 5.066 7.187 561 2HD1 ILE 92 2HD1 ILE 92 -3.658 5.881 6.871 562 3HD1 ILE 92 3HD1 ILE 92 -2.587 5.464 5.534 563 H GLU 93 H GLU 93 -3.935 -0.155 8.655 564 HA GLU 93 HA GLU 93 -5.953 -0.054 10.785 565 1HB GLU 93 2HB GLU 93 -5.656 -2.144 9.431 566 2HB GLU 93 1HB GLU 93 -4.031 -2.282 10.083 567 1HG GLU 93 2HG GLU 93 -5.578 -3.743 11.244 568 2HG GLU 93 1HG GLU 93 -4.942 -2.497 12.323 569 H ALA 94 H ALA 94 -2.601 0.345 10.097 570 HA ALA 94 HA ALA 94 -2.059 1.443 12.663 571 1HB ALA 94 1HB ALA 94 -0.211 -0.081 13.199 572 2HB ALA 94 2HB ALA 94 -0.659 -1.100 11.831 573 3HB ALA 94 3HB ALA 94 -1.763 -0.923 13.195 574 H VAL 95 H VAL 95 -0.295 2.796 12.506 575 HA VAL 95 HA VAL 95 1.455 2.543 10.259 576 HB VAL 95 HB VAL 95 -0.316 3.927 9.284 577 1HG1 VAL 95 1HG1 VAL 95 0.117 5.830 11.573 578 2HG1 VAL 95 2HG1 VAL 95 -1.310 4.840 11.263 579 3HG1 VAL 95 3HG1 VAL 95 -0.882 6.143 10.151 580 1HG2 VAL 95 1HG2 VAL 95 1.957 4.418 8.585 581 2HG2 VAL 95 2HG2 VAL 95 2.146 5.558 9.917 582 3HG2 VAL 95 3HG2 VAL 95 1.003 5.903 8.621 583 H GLU 96 H GLU 96 3.405 2.887 10.877 584 HA GLU 96 HA GLU 96 3.905 4.314 13.407 585 1HB GLU 96 2HB GLU 96 5.537 2.210 12.017 586 2HB GLU 96 1HB GLU 96 5.908 2.948 13.554 587 1HG GLU 96 2HG GLU 96 3.516 1.209 13.004 588 2HG GLU 96 1HG GLU 96 5.037 0.693 13.740 589 HA PRO 97 HA PRO 97 5.842 7.110 10.339 590 1HB PRO 97 2HB PRO 97 6.420 8.656 12.793 591 2HB PRO 97 1HB PRO 97 5.596 9.168 11.321 592 1HG PRO 97 2HG PRO 97 4.257 8.741 13.605 593 2HG PRO 97 1HG PRO 97 3.547 8.360 12.028 594 1HD PRO 97 2HD PRO 97 4.712 6.520 14.071 595 2HD PRO 97 1HD PRO 97 3.321 6.298 12.998 596 H ASP 98 H ASP 98 7.205 6.362 13.528 597 HA ASP 98 HA ASP 98 9.864 6.819 12.572 598 1HB ASP 98 2HB ASP 98 8.833 5.988 15.258 599 2HB ASP 98 1HB ASP 98 10.540 5.883 14.859 600 H LYS 99 H LYS 99 7.913 4.033 13.126 601 HA LYS 99 HA LYS 99 10.188 2.267 12.842 602 1HB LYS 99 2HB LYS 99 7.281 1.580 12.952 603 2HB LYS 99 1HB LYS 99 8.629 0.467 13.053 604 1HG LYS 99 2HG LYS 99 9.380 1.512 15.107 605 2HG LYS 99 1HG LYS 99 8.049 2.674 14.981 606 1HD LYS 99 2HD LYS 99 6.483 0.836 14.994 607 2HD LYS 99 1HD LYS 99 7.865 -0.255 15.212 608 1HE LYS 99 2HE LYS 99 8.353 0.662 17.357 609 2HE LYS 99 1HE LYS 99 7.224 1.991 17.109 610 1HZ LYS 99 1HZ LYS 99 6.278 0.324 18.559 611 2HZ LYS 99 2HZ LYS 99 6.459 -0.875 17.378 612 3HZ LYS 99 3HZ LYS 99 5.425 0.435 17.110 613 H ASN 100 H ASN 100 8.179 3.920 10.716 614 HA ASN 100 HA ASN 100 7.872 3.892 8.445 615 1HB ASN 100 2HB ASN 100 10.073 1.797 8.430 616 2HB ASN 100 1HB ASN 100 9.509 2.725 7.048 617 1HD2 ASN 100 1HD2 ASN 100 12.134 2.458 8.216 618 2HD2 ASN 100 2HD2 ASN 100 12.649 4.067 8.628 619 H LEU 101 H LEU 101 6.215 2.326 9.993 620 HA LEU 101 HA LEU 101 5.858 -0.197 8.476 621 1HB LEU 101 2HB LEU 101 6.512 -0.557 10.808 622 2HB LEU 101 1HB LEU 101 5.186 0.448 11.344 623 HG LEU 101 HG LEU 101 3.634 -1.206 10.291 624 1HD1 LEU 101 1HD1 LEU 101 6.121 -2.851 10.125 625 2HD1 LEU 101 2HD1 LEU 101 5.086 -2.276 8.796 626 3HD1 LEU 101 3HD1 LEU 101 4.467 -3.447 9.957 627 1HD2 LEU 101 1HD2 LEU 101 3.784 -2.789 12.137 628 2HD2 LEU 101 2HD2 LEU 101 3.927 -1.116 12.655 629 3HD2 LEU 101 3HD2 LEU 101 5.375 -2.138 12.568 630 H ILE 102 H ILE 102 3.830 -0.552 7.631 631 HA ILE 102 HA ILE 102 1.615 0.873 8.735 632 HB ILE 102 HB ILE 102 2.380 2.489 7.119 633 1HG1 ILE 102 2HG1 ILE 102 -0.064 1.070 6.025 634 2HG1 ILE 102 1HG1 ILE 102 -0.069 2.194 7.377 635 1HG2 ILE 102 1HG2 ILE 102 2.505 1.969 4.687 636 2HG2 ILE 102 2HG2 ILE 102 2.243 0.277 5.096 637 3HG2 ILE 102 3HG2 ILE 102 3.687 1.088 5.661 638 1HD1 ILE 102 1HD1 ILE 102 0.683 2.844 4.536 639 2HD1 ILE 102 2HD1 ILE 102 0.672 3.983 5.884 640 3HD1 ILE 102 3HD1 ILE 102 -0.837 3.259 5.329 641 H THR 103 H THR 103 -0.002 -0.335 8.886 642 HA THR 103 HA THR 103 -0.142 -2.937 7.535 643 HB THR 103 HB THR 103 -1.711 -1.826 9.874 644 HG1 THR 103 1HG THR 103 0.482 -3.626 9.818 645 1HG2 THR 103 1HG2 THR 103 -2.272 -4.181 10.309 646 2HG2 THR 103 2HG2 THR 103 -1.368 -4.647 8.867 647 3HG2 THR 103 3HG2 THR 103 -2.837 -3.681 8.712 648 H PHE 104 H PHE 104 -1.542 -3.212 5.825 649 HA PHE 104 HA PHE 104 -3.796 -1.348 5.464 650 1HB PHE 104 2HB PHE 104 -2.390 -3.140 3.492 651 2HB PHE 104 1HB PHE 104 -3.740 -2.119 3.077 652 HD1 PHE 104 1HD PHE 104 -3.385 0.418 3.355 653 HD2 PHE 104 2HD PHE 104 -0.237 -2.439 3.329 654 HE1 PHE 104 1HE PHE 104 -1.782 2.185 2.753 655 HE2 PHE 104 2HE PHE 104 1.357 -0.686 2.727 656 HZ PHE 104 HZ PHE 104 0.609 1.613 2.436 657 H ARG 105 H ARG 105 -5.786 -2.157 5.500 658 HA ARG 105 HA ARG 105 -6.229 -5.089 5.599 659 1HB ARG 105 2HB ARG 105 -7.084 -3.770 7.521 660 2HB ARG 105 1HB ARG 105 -8.051 -2.799 6.429 661 1HG ARG 105 2HG ARG 105 -9.020 -5.124 5.710 662 2HG ARG 105 1HG ARG 105 -8.424 -5.616 7.294 663 1HD ARG 105 2HD ARG 105 -10.329 -3.356 6.719 664 2HD ARG 105 1HD ARG 105 -10.770 -4.930 7.369 665 HE ARG 105 HE ARG 105 -8.855 -3.675 9.038 666 1HH1 ARG 105 1HH1 ARG 105 -12.292 -3.614 8.185 667 2HH1 ARG 105 2HH1 ARG 105 -12.763 -2.839 9.626 668 1HH2 ARG 105 1HH2 ARG 105 -9.500 -2.657 10.978 669 2HH2 ARG 105 2HH2 ARG 105 -11.156 -2.281 11.267 670 H VAL 106 H VAL 106 -7.799 -6.017 4.108 671 HA VAL 106 HA VAL 106 -8.349 -4.595 1.724 672 HB VAL 106 HB VAL 106 -8.023 -7.059 1.862 673 1HG1 VAL 106 1HG1 VAL 106 -9.794 -8.500 2.743 674 2HG1 VAL 106 2HG1 VAL 106 -10.670 -7.070 3.289 675 3HG1 VAL 106 3HG1 VAL 106 -9.102 -7.468 3.988 676 1HG2 VAL 106 1HG2 VAL 106 -9.229 -6.132 -0.048 677 2HG2 VAL 106 2HG2 VAL 106 -10.745 -6.247 0.838 678 3HG2 VAL 106 3HG2 VAL 106 -9.876 -7.714 0.385 679 H ILE 107 H ILE 107 -10.324 -3.748 1.070 680 HA ILE 107 HA ILE 107 -12.562 -3.783 2.980 681 HB ILE 107 HB ILE 107 -13.036 -1.387 2.549 682 1HG1 ILE 107 2HG1 ILE 107 -10.299 -1.383 1.299 683 2HG1 ILE 107 1HG1 ILE 107 -11.825 -1.177 0.445 684 1HG2 ILE 107 1HG2 ILE 107 -11.250 -0.452 3.945 685 2HG2 ILE 107 2HG2 ILE 107 -10.350 -1.946 3.776 686 3HG2 ILE 107 3HG2 ILE 107 -11.907 -1.954 4.628 687 1HD1 ILE 107 1HD1 ILE 107 -12.242 0.844 1.598 688 2HD1 ILE 107 2HD1 ILE 107 -10.606 0.854 0.859 689 3HD1 ILE 107 3HD1 ILE 107 -10.784 0.558 2.592 690 H GLU 108 H GLU 108 -11.469 -3.135 -0.253 691 HA GLU 108 HA GLU 108 -13.728 -2.411 -1.385 692 1HB GLU 108 2HB GLU 108 -12.628 -3.146 -3.605 693 2HB GLU 108 1HB GLU 108 -12.061 -1.829 -2.615 694 1HG GLU 108 2HG GLU 108 -10.217 -2.914 -3.253 695 2HG GLU 108 1HG GLU 108 -10.479 -3.378 -1.578 696 H GLY 109 H GLY 109 -12.633 -5.765 -1.889 697 1HA GLY 109 2HA GLY 109 -14.597 -7.335 -1.411 698 2HA GLY 109 1HA GLY 109 -15.434 -6.342 -2.597 699 H ASP 110 H ASP 110 -12.948 -6.012 -4.172 700 HA ASP 110 HA ASP 110 -13.329 -8.223 -5.914 701 1HB ASP 110 2HB ASP 110 -11.202 -6.090 -5.890 702 2HB ASP 110 1HB ASP 110 -11.364 -7.293 -7.165 703 H LEU 111 H LEU 111 -10.729 -7.323 -3.694 704 HA LEU 111 HA LEU 111 -9.142 -9.628 -4.229 705 1HB LEU 111 2HB LEU 111 -9.250 -7.888 -1.759 706 2HB LEU 111 1HB LEU 111 -8.009 -9.078 -2.084 707 HG LEU 111 HG LEU 111 -8.515 -6.594 -3.731 708 1HD1 LEU 111 1HD1 LEU 111 -6.409 -5.788 -2.798 709 2HD1 LEU 111 2HD1 LEU 111 -6.314 -7.216 -1.768 710 3HD1 LEU 111 3HD1 LEU 111 -7.615 -6.047 -1.541 711 1HD2 LEU 111 1HD2 LEU 111 -7.604 -8.405 -5.079 712 2HD2 LEU 111 2HD2 LEU 111 -6.319 -8.663 -3.893 713 3HD2 LEU 111 3HD2 LEU 111 -6.388 -7.162 -4.815 714 H MET 112 H MET 112 -11.905 -9.027 -2.376 715 HA MET 112 HA MET 112 -11.725 -11.342 -0.662 716 1HB MET 112 2HB MET 112 -14.037 -9.502 -1.224 717 2HB MET 112 1HB MET 112 -14.043 -10.770 -0.022 718 1HG MET 112 2HG MET 112 -12.124 -8.445 0.056 719 2HG MET 112 1HG MET 112 -13.703 -8.380 0.799 720 1HE MET 112 1HE MET 112 -10.708 -11.257 0.819 721 2HE MET 112 2HE MET 112 -10.131 -10.869 2.420 722 3HE MET 112 3HE MET 112 -9.962 -9.678 1.140 723 H LYS 113 H LYS 113 -12.451 -10.983 -3.873 724 HA LYS 113 HA LYS 113 -14.463 -13.058 -4.022 725 1HB LYS 113 2HB LYS 113 -12.744 -11.887 -6.222 726 2HB LYS 113 1HB LYS 113 -14.163 -12.899 -6.440 727 1HG LYS 113 2HG LYS 113 -14.118 -10.141 -5.250 728 2HG LYS 113 1HG LYS 113 -14.665 -10.567 -6.874 729 1HD LYS 113 2HD LYS 113 -16.419 -11.966 -5.888 730 2HD LYS 113 1HD LYS 113 -15.869 -11.510 -4.278 731 1HE LYS 113 2HE LYS 113 -16.347 -9.171 -4.761 732 2HE LYS 113 1HE LYS 113 -16.895 -9.614 -6.378 733 1HZ LYS 113 1HZ LYS 113 -18.121 -10.499 -3.828 734 2HZ LYS 113 2HZ LYS 113 -18.640 -10.934 -5.380 735 3HZ LYS 113 3HZ LYS 113 -18.730 -9.317 -4.859 736 H GLU 114 H GLU 114 -11.117 -12.827 -3.784 737 HA GLU 114 HA GLU 114 -10.782 -15.586 -4.735 738 1HB GLU 114 2HB GLU 114 -8.719 -13.368 -4.603 739 2HB GLU 114 1HB GLU 114 -8.431 -14.999 -5.198 740 1HG GLU 114 2HG GLU 114 -10.024 -14.663 -6.985 741 2HG GLU 114 1HG GLU 114 -10.391 -13.045 -6.397 742 H TYR 115 H TYR 115 -10.422 -13.399 -2.061 743 HA TYR 115 HA TYR 115 -9.408 -15.592 -0.406 744 1HB TYR 115 2HB TYR 115 -8.552 -12.687 -0.211 745 2HB TYR 115 1HB TYR 115 -7.979 -14.018 0.796 746 HD1 TYR 115 1HD TYR 115 -7.689 -12.326 -2.374 747 HD2 TYR 115 2HD TYR 115 -6.532 -15.789 -0.197 748 HE1 TYR 115 1HE TYR 115 -5.931 -12.791 -4.036 749 HE2 TYR 115 2HE TYR 115 -4.807 -16.252 -1.838 750 HH TYR 115 HH TYR 115 -3.861 -14.036 -4.234 751 H LYS 116 H LYS 116 -10.225 -15.566 1.693 752 HA LYS 116 HA LYS 116 -12.787 -14.217 1.934 753 1HB LYS 116 2HB LYS 116 -11.449 -16.110 3.923 754 2HB LYS 116 1HB LYS 116 -13.127 -15.532 3.870 755 1HG LYS 116 2HG LYS 116 -13.551 -16.750 1.893 756 2HG LYS 116 1HG LYS 116 -11.827 -17.157 1.803 757 1HD LYS 116 2HD LYS 116 -13.245 -19.006 2.564 758 2HD LYS 116 1HD LYS 116 -11.963 -18.571 3.698 759 1HE LYS 116 2HE LYS 116 -14.842 -17.669 3.956 760 2HE LYS 116 1HE LYS 116 -14.244 -19.148 4.694 761 1HZ LYS 116 1HZ LYS 116 -13.374 -16.357 5.338 762 2HZ LYS 116 2HZ LYS 116 -12.616 -17.712 5.921 763 3HZ LYS 116 3HZ LYS 116 -14.237 -17.414 6.316 764 H SER 117 H SER 117 -9.591 -13.771 2.870 765 HA SER 117 HA SER 117 -10.160 -11.374 4.319 766 1HB SER 117 2HB SER 117 -10.402 -13.039 5.997 767 2HB SER 117 1HB SER 117 -8.828 -13.752 5.582 768 HG SER 117 HG SER 117 -8.585 -12.485 7.347 769 H PHE 118 H PHE 118 -8.331 -10.013 4.199 770 HA PHE 118 HA PHE 118 -5.801 -11.023 3.328 771 1HB PHE 118 2HB PHE 118 -6.934 -10.965 1.178 772 2HB PHE 118 1HB PHE 118 -7.494 -9.321 1.463 773 HD1 PHE 118 1HD PHE 118 -4.521 -11.416 0.790 774 HD2 PHE 118 2HD PHE 118 -6.104 -7.469 0.921 775 HE1 PHE 118 1HE PHE 118 -2.518 -10.585 -0.334 776 HE2 PHE 118 2HE PHE 118 -4.096 -6.630 -0.219 777 HZ PHE 118 HZ PHE 118 -2.296 -8.185 -0.844 778 H LEU 119 H LEU 119 -4.466 -9.909 4.605 779 HA LEU 119 HA LEU 119 -4.745 -7.057 4.658 780 1HB LEU 119 2HB LEU 119 -5.957 -7.851 6.648 781 2HB LEU 119 1HB LEU 119 -4.573 -8.796 7.139 782 HG LEU 119 HG LEU 119 -4.368 -5.824 6.909 783 1HD1 LEU 119 1HD1 LEU 119 -4.979 -5.674 9.293 784 2HD1 LEU 119 2HD1 LEU 119 -5.379 -7.397 9.303 785 3HD1 LEU 119 3HD1 LEU 119 -6.317 -6.254 8.321 786 1HD2 LEU 119 1HD2 LEU 119 -2.713 -6.139 8.691 787 2HD2 LEU 119 2HD2 LEU 119 -2.310 -7.053 7.235 788 3HD2 LEU 119 3HD2 LEU 119 -2.998 -7.876 8.644 789 H LEU 120 H LEU 120 -2.812 -6.061 4.569 790 HA LEU 120 HA LEU 120 -0.471 -7.778 4.756 791 1HB LEU 120 2HB LEU 120 0.494 -6.899 2.723 792 2HB LEU 120 1HB LEU 120 -1.040 -7.651 2.378 793 HG LEU 120 HG LEU 120 -0.562 -4.657 2.513 794 1HD1 LEU 120 1HD1 LEU 120 -0.753 -4.719 0.089 795 2HD1 LEU 120 2HD1 LEU 120 -0.884 -6.479 0.140 796 3HD1 LEU 120 3HD1 LEU 120 0.605 -5.683 0.657 797 1HD2 LEU 120 1HD2 LEU 120 -2.896 -5.235 3.010 798 2HD2 LEU 120 2HD2 LEU 120 -2.958 -6.232 1.555 799 3HD2 LEU 120 3HD2 LEU 120 -2.759 -4.485 1.420 800 H THR 121 H THR 121 1.242 -6.914 5.632 801 HA THR 121 HA THR 121 1.082 -4.076 6.368 802 HB THR 121 HB THR 121 2.482 -6.308 7.865 803 HG1 THR 121 1HG THR 121 0.249 -6.501 8.021 804 1HG2 THR 121 1HG2 THR 121 3.481 -4.102 8.130 805 2HG2 THR 121 2HG2 THR 121 2.702 -4.625 9.630 806 3HG2 THR 121 3HG2 THR 121 1.923 -3.434 8.583 807 H ILE 122 H ILE 122 2.742 -2.825 5.654 808 HA ILE 122 HA ILE 122 5.094 -4.249 4.631 809 HB ILE 122 HB ILE 122 5.424 -2.504 2.977 810 1HG1 ILE 122 2HG1 ILE 122 2.854 -1.297 3.949 811 2HG1 ILE 122 1HG1 ILE 122 4.453 -0.640 4.271 812 1HG2 ILE 122 1HG2 ILE 122 3.999 -4.367 2.307 813 2HG2 ILE 122 2HG2 ILE 122 3.428 -2.868 1.572 814 3HG2 ILE 122 3HG2 ILE 122 2.588 -3.528 2.965 815 1HD1 ILE 122 1HD1 ILE 122 3.198 -0.951 1.542 816 2HD1 ILE 122 2HD1 ILE 122 4.797 -0.287 1.871 817 3HD1 ILE 122 3HD1 ILE 122 3.359 0.558 2.441 818 H GLN 123 H GLN 123 7.101 -3.292 4.991 819 HA GLN 123 HA GLN 123 7.147 -0.891 6.607 820 1HB GLN 123 2HB GLN 123 7.049 -2.838 8.174 821 2HB GLN 123 1HB GLN 123 8.550 -3.419 7.479 822 1HG GLN 123 2HG GLN 123 9.758 -1.546 8.311 823 2HG GLN 123 1HG GLN 123 8.267 -0.732 8.788 824 1HE2 GLN 123 1HE2 GLN 123 8.818 -0.557 10.906 825 2HE2 GLN 123 2HE2 GLN 123 8.866 -1.900 11.986 826 H VAL 124 H VAL 124 8.812 0.365 6.147 827 HA VAL 124 HA VAL 124 10.618 -0.568 4.045 828 HB VAL 124 HB VAL 124 10.137 2.249 5.078 829 1HG1 VAL 124 1HG1 VAL 124 11.356 2.973 3.079 830 2HG1 VAL 124 2HG1 VAL 124 11.684 1.286 2.672 831 3HG1 VAL 124 3HG1 VAL 124 12.370 1.989 4.139 832 1HG2 VAL 124 1HG2 VAL 124 8.173 1.344 3.947 833 2HG2 VAL 124 2HG2 VAL 124 9.168 0.899 2.558 834 3HG2 VAL 124 3HG2 VAL 124 8.931 2.598 2.968 835 H THR 125 H THR 125 12.566 -1.212 4.574 836 HA THR 125 HA THR 125 13.639 -0.338 7.146 837 HB THR 125 HB THR 125 14.043 -2.960 5.699 838 HG1 THR 125 1HG THR 125 12.097 -1.954 7.282 839 1HG2 THR 125 1HG2 THR 125 14.899 -3.715 7.846 840 2HG2 THR 125 2HG2 THR 125 14.686 -2.103 8.525 841 3HG2 THR 125 3HG2 THR 125 15.875 -2.365 7.240 842 HA PRO 126 HA PRO 126 17.016 1.176 4.534 843 1HB PRO 126 2HB PRO 126 18.701 1.820 6.613 844 2HB PRO 126 1HB PRO 126 17.410 2.886 6.052 845 1HG PRO 126 2HG PRO 126 17.468 1.063 8.412 846 2HG PRO 126 1HG PRO 126 16.736 2.669 8.240 847 1HD PRO 126 2HD PRO 126 15.309 0.354 8.160 848 2HD PRO 126 1HD PRO 126 14.813 1.828 7.306 849 H LYS 127 H LYS 127 18.129 -0.388 3.591 850 HA LYS 127 HA LYS 127 19.560 -2.246 5.290 851 1HB LYS 127 2HB LYS 127 17.555 -3.377 4.726 852 2HB LYS 127 1HB LYS 127 17.695 -3.016 3.030 853 1HG LYS 127 2HG LYS 127 19.669 -4.492 2.930 854 2HG LYS 127 1HG LYS 127 19.430 -4.865 4.642 855 1HD LYS 127 2HD LYS 127 17.235 -5.756 4.177 856 2HD LYS 127 1HD LYS 127 17.375 -5.294 2.494 857 1HE LYS 127 2HE LYS 127 19.117 -7.316 3.927 858 2HE LYS 127 1HE LYS 127 17.826 -7.703 2.795 859 1HZ LYS 127 1HZ LYS 127 19.950 -7.812 1.706 860 2HZ LYS 127 2HZ LYS 127 20.339 -6.247 2.159 861 3HZ LYS 127 3HZ LYS 127 19.099 -6.530 1.052 862 HA PRO 128 HA PRO 128 22.036 -2.022 1.100 863 1HB PRO 128 2HB PRO 128 20.801 0.358 -0.169 864 2HB PRO 128 1HB PRO 128 21.367 -1.142 -0.911 865 1HG PRO 128 2HG PRO 128 18.762 -0.643 -0.662 866 2HG PRO 128 1HG PRO 128 19.395 -2.279 -0.425 867 1HD PRO 128 2HD PRO 128 18.568 -0.250 1.607 868 2HD PRO 128 1HD PRO 128 18.290 -2.002 1.565 869 H GLY 129 H GLY 129 20.644 1.146 2.041 870 1HA GLY 129 2HA GLY 129 22.600 1.994 3.729 871 2HA GLY 129 1HA GLY 129 23.195 2.416 2.126 872 H GLY 130 H GLY 130 22.770 4.427 1.601 873 1HA GLY 130 2HA GLY 130 20.641 5.894 2.913 874 2HA GLY 130 1HA GLY 130 21.800 6.536 1.745 875 HA PRO 131 HA PRO 131 18.669 6.151 -1.352 876 1HB PRO 131 2HB PRO 131 20.175 5.748 -3.594 877 2HB PRO 131 1HB PRO 131 20.019 7.327 -2.814 878 1HG PRO 131 2HG PRO 131 22.229 5.336 -2.631 879 2HG PRO 131 1HG PRO 131 22.324 7.104 -2.727 880 1HD PRO 131 2HD PRO 131 22.611 5.707 -0.397 881 2HD PRO 131 1HD PRO 131 21.972 7.360 -0.472 882 H GLY 132 H GLY 132 17.708 4.298 -0.724 883 1HA GLY 132 2HA GLY 132 17.148 2.231 -2.106 884 2HA GLY 132 1HA GLY 132 18.810 1.786 -1.731 885 H SER 133 H SER 133 15.715 1.420 -0.824 886 HA SER 133 HA SER 133 16.518 0.444 1.816 887 1HB SER 133 2HB SER 133 13.986 1.990 1.231 888 2HB SER 133 1HB SER 133 14.485 1.340 2.795 889 HG SER 133 HG SER 133 15.562 3.424 1.284 890 H ILE 134 H ILE 134 15.220 -1.367 2.495 891 HA ILE 134 HA ILE 134 13.938 -2.588 0.210 892 HB ILE 134 HB ILE 134 15.063 -3.866 2.694 893 1HG1 ILE 134 2HG1 ILE 134 16.774 -3.280 1.113 894 2HG1 ILE 134 1HG1 ILE 134 16.437 -5.032 1.019 895 1HG2 ILE 134 1HG2 ILE 134 14.458 -6.028 1.707 896 2HG2 ILE 134 2HG2 ILE 134 13.618 -5.190 0.404 897 3HG2 ILE 134 3HG2 ILE 134 13.032 -5.052 2.061 898 1HD1 ILE 134 1HD1 ILE 134 15.527 -2.959 -0.917 899 2HD1 ILE 134 2HD1 ILE 134 15.162 -4.689 -0.964 900 3HD1 ILE 134 3HD1 ILE 134 16.824 -4.123 -1.129 901 H VAL 135 H VAL 135 11.861 -2.796 0.278 902 HA VAL 135 HA VAL 135 10.469 -2.342 2.815 903 HB VAL 135 HB VAL 135 9.717 -0.772 1.073 904 1HG1 VAL 135 1HG1 VAL 135 8.844 -3.155 -0.512 905 2HG1 VAL 135 2HG1 VAL 135 10.148 -2.040 -0.916 906 3HG1 VAL 135 3HG1 VAL 135 8.476 -1.474 -0.894 907 1HG2 VAL 135 1HG2 VAL 135 7.587 -2.788 1.756 908 2HG2 VAL 135 2HG2 VAL 135 7.291 -1.140 1.196 909 3HG2 VAL 135 3HG2 VAL 135 8.088 -1.419 2.746 910 H HIS 136 H HIS 136 9.691 -3.902 3.850 911 HA HIS 136 HA HIS 136 9.526 -6.503 2.542 912 1HB HIS 136 2HB HIS 136 9.570 -5.759 5.478 913 2HB HIS 136 1HB HIS 136 9.364 -7.410 4.897 914 HD1 HIS 136 1HD HIS 136 11.473 -8.536 3.848 915 HD2 HIS 136 2HD HIS 136 12.165 -4.745 5.407 916 HE1 HIS 136 1HE HIS 136 13.955 -8.301 3.967 917 HE2 HIS 136 2HE HIS 136 14.280 -6.189 5.275 918 H TRP 137 H TRP 137 7.678 -7.166 1.814 919 HA TRP 137 HA TRP 137 5.190 -6.015 2.803 920 1HB TRP 137 2HB TRP 137 5.814 -7.722 0.374 921 2HB TRP 137 1HB TRP 137 4.233 -7.154 0.828 922 HD1 TRP 137 HD TRP 137 7.670 -5.438 -0.058 923 HE1 TRP 137 1HE TRP 137 7.115 -3.364 -1.425 924 HE3 TRP 137 3HE TRP 137 2.575 -5.735 0.052 925 HZ2 TRP 137 2HZ TRP 137 4.827 -1.995 -2.342 926 HZ3 TRP 137 3HZ TRP 137 1.270 -4.019 -1.084 927 HH2 TRP 137 HH TRP 137 2.356 -2.177 -2.256 928 H HIS 138 H HIS 138 4.049 -7.190 4.235 929 HA HIS 138 HA HIS 138 4.405 -10.124 4.184 930 1HB HIS 138 2HB HIS 138 3.382 -8.450 6.499 931 2HB HIS 138 1HB HIS 138 3.751 -10.161 6.533 932 HD1 HIS 138 1HD HIS 138 6.368 -10.803 6.641 933 HD2 HIS 138 2HD HIS 138 5.432 -6.764 6.891 934 HE1 HIS 138 1HE HIS 138 8.417 -9.710 7.490 935 HE2 HIS 138 2HE HIS 138 7.712 -7.336 7.944 936 H LEU 139 H LEU 139 2.693 -10.938 3.088 937 HA LEU 139 HA LEU 139 0.130 -9.573 3.399 938 1HB LEU 139 2HB LEU 139 1.038 -11.527 1.267 939 2HB LEU 139 1HB LEU 139 -0.544 -10.801 1.345 940 HG LEU 139 HG LEU 139 0.622 -8.549 0.957 941 1HD1 LEU 139 1HD1 LEU 139 2.866 -9.121 1.576 942 2HD1 LEU 139 2HD1 LEU 139 2.798 -8.558 -0.094 943 3HD1 LEU 139 3HD1 LEU 139 2.958 -10.281 0.248 944 1HD2 LEU 139 1HD2 LEU 139 0.828 -10.647 -1.187 945 2HD2 LEU 139 2HD2 LEU 139 0.823 -8.903 -1.449 946 3HD2 LEU 139 3HD2 LEU 139 -0.607 -9.699 -0.796 947 H GLU 140 H GLU 140 -1.341 -10.578 4.585 948 HA GLU 140 HA GLU 140 -1.048 -13.465 5.008 949 1HB GLU 140 2HB GLU 140 -1.948 -11.365 6.985 950 2HB GLU 140 1HB GLU 140 -1.888 -13.099 7.286 951 1HG GLU 140 2HG GLU 140 0.503 -13.101 6.991 952 2HG GLU 140 1HG GLU 140 0.484 -11.388 6.611 953 H TYR 141 H TYR 141 -2.812 -14.576 4.545 954 HA TYR 141 HA TYR 141 -5.359 -13.274 4.316 955 1HB TYR 141 2HB TYR 141 -5.553 -13.763 1.864 956 2HB TYR 141 1HB TYR 141 -4.423 -12.490 2.329 957 HD1 TYR 141 1HD TYR 141 -2.060 -12.742 2.019 958 HD2 TYR 141 2HD TYR 141 -4.716 -15.861 0.988 959 HE1 TYR 141 1HE TYR 141 -0.250 -13.846 0.829 960 HE2 TYR 141 2HE TYR 141 -2.954 -16.997 -0.230 961 HH TYR 141 HH TYR 141 0.327 -16.167 0.081 962 H GLU 142 H GLU 142 -7.001 -14.719 3.432 963 HA GLU 142 HA GLU 142 -6.399 -17.536 4.037 964 1HB GLU 142 2HB GLU 142 -7.692 -16.392 5.854 965 2HB GLU 142 1HB GLU 142 -8.947 -16.028 4.687 966 1HG GLU 142 2HG GLU 142 -9.383 -18.404 4.391 967 2HG GLU 142 1HG GLU 142 -8.092 -18.794 5.524 968 H LYS 143 H LYS 143 -6.687 -18.731 2.251 969 HA LYS 143 HA LYS 143 -7.809 -17.819 -0.155 970 1HB LYS 143 2HB LYS 143 -7.206 -20.602 0.848 971 2HB LYS 143 1HB LYS 143 -7.908 -20.322 -0.723 972 1HG LYS 143 2HG LYS 143 -5.524 -20.758 -0.859 973 2HG LYS 143 1HG LYS 143 -5.896 -19.138 -1.417 974 1HD LYS 143 2HD LYS 143 -5.033 -18.192 0.600 975 2HD LYS 143 1HD LYS 143 -4.867 -19.789 1.339 976 1HE LYS 143 2HE LYS 143 -3.475 -18.940 -1.165 977 2HE LYS 143 1HE LYS 143 -2.723 -18.804 0.424 978 1HZ LYS 143 1HZ LYS 143 -2.046 -20.842 -0.694 979 2HZ LYS 143 2HZ LYS 143 -3.632 -21.378 -0.830 980 3HZ LYS 143 3HZ LYS 143 -2.929 -21.193 0.684 981 H ILE 144 H ILE 144 -9.981 -18.048 -0.954 982 HA ILE 144 HA ILE 144 -11.952 -19.061 0.910 983 HB ILE 144 HB ILE 144 -12.466 -18.600 -2.057 984 1HG1 ILE 144 2HG1 ILE 144 -12.445 -16.551 0.184 985 2HG1 ILE 144 1HG1 ILE 144 -11.499 -16.540 -1.294 986 1HG2 ILE 144 1HG2 ILE 144 -14.204 -18.432 0.401 987 2HG2 ILE 144 2HG2 ILE 144 -14.193 -19.770 -0.755 988 3HG2 ILE 144 3HG2 ILE 144 -14.762 -18.169 -1.256 989 1HD1 ILE 144 1HD1 ILE 144 -13.253 -14.946 -1.340 990 2HD1 ILE 144 2HD1 ILE 144 -14.413 -16.213 -0.964 991 3HD1 ILE 144 3HD1 ILE 144 -13.585 -16.218 -2.549 992 H SER 145 H SER 145 -10.294 -19.980 -1.899 993 HA SER 145 HA SER 145 -10.285 -22.697 -1.234 994 1HB SER 145 2HB SER 145 -12.408 -22.627 -2.482 995 2HB SER 145 1HB SER 145 -11.639 -21.737 -3.787 996 HG SER 145 HG SER 145 -11.842 -24.359 -3.542 997 H GLU 146 H GLU 146 -8.685 -23.663 -2.687 998 HA GLU 146 HA GLU 146 -6.435 -21.874 -2.844 999 1HB GLU 146 2HB GLU 146 -6.892 -24.599 -3.699 1000 2HB GLU 146 1HB GLU 146 -5.286 -23.875 -3.804 1001 1HG GLU 146 2HG GLU 146 -6.883 -24.445 -1.278 1002 2HG GLU 146 1HG GLU 146 -5.419 -25.288 -1.784 1003 H GLU 147 H GLU 147 -8.264 -23.752 -5.182 1004 HA GLU 147 HA GLU 147 -6.868 -23.005 -7.503 1005 1HB GLU 147 2HB GLU 147 -8.868 -23.861 -8.674 1006 2HB GLU 147 1HB GLU 147 -8.305 -24.949 -7.416 1007 1HG GLU 147 2HG GLU 147 -10.043 -23.988 -5.909 1008 2HG GLU 147 1HG GLU 147 -10.651 -23.085 -7.293 1009 H VAL 148 H VAL 148 -9.040 -21.381 -5.580 1010 HA VAL 148 HA VAL 148 -10.005 -19.555 -7.659 1011 HB VAL 148 HB VAL 148 -10.665 -19.604 -4.696 1012 1HG1 VAL 148 1HG1 VAL 148 -12.080 -18.226 -6.970 1013 2HG1 VAL 148 2HG1 VAL 148 -11.123 -17.439 -5.717 1014 3HG1 VAL 148 3HG1 VAL 148 -12.624 -18.268 -5.294 1015 1HG2 VAL 148 1HG2 VAL 148 -12.140 -20.800 -7.031 1016 2HG2 VAL 148 2HG2 VAL 148 -12.749 -20.720 -5.374 1017 3HG2 VAL 148 3HG2 VAL 148 -11.305 -21.669 -5.742 1018 H ALA 149 H ALA 149 -7.497 -19.765 -5.406 1019 HA ALA 149 HA ALA 149 -7.205 -16.882 -5.095 1020 1HB ALA 149 1HB ALA 149 -6.994 -18.282 -3.117 1021 2HB ALA 149 2HB ALA 149 -5.470 -17.465 -3.489 1022 3HB ALA 149 3HB ALA 149 -5.681 -19.172 -3.883 1023 H HIS 150 H HIS 150 -5.212 -15.843 -5.597 1024 HA HIS 150 HA HIS 150 -3.355 -17.274 -7.322 1025 1HB HIS 150 2HB HIS 150 -4.840 -14.801 -8.215 1026 2HB HIS 150 1HB HIS 150 -3.328 -15.321 -8.936 1027 HD1 HIS 150 1HD HIS 150 -3.399 -17.356 -10.506 1028 HD2 HIS 150 2HD HIS 150 -7.071 -16.358 -8.852 1029 HE1 HIS 150 1HE HIS 150 -5.109 -18.631 -11.848 1030 HE2 HIS 150 2HE HIS 150 -7.315 -17.766 -11.012 1031 HA PRO 151 HA PRO 151 -0.836 -14.843 -4.369 1032 1HB PRO 151 2HB PRO 151 1.027 -16.875 -5.538 1033 2HB PRO 151 1HB PRO 151 0.891 -16.313 -3.866 1034 1HG PRO 151 2HG PRO 151 -0.140 -18.659 -4.466 1035 2HG PRO 151 1HG PRO 151 -1.063 -17.523 -3.480 1036 1HD PRO 151 2HD PRO 151 -1.420 -18.164 -6.386 1037 2HD PRO 151 1HD PRO 151 -2.627 -17.920 -5.101 1038 H GLU 152 H GLU 152 -0.446 -15.666 -7.795 1039 HA GLU 152 HA GLU 152 1.795 -14.042 -8.301 1040 1HB GLU 152 2HB GLU 152 1.016 -13.969 -10.653 1041 2HB GLU 152 1HB GLU 152 1.306 -15.607 -10.026 1042 1HG GLU 152 2HG GLU 152 -1.427 -14.373 -10.109 1043 2HG GLU 152 1HG GLU 152 -0.735 -15.062 -11.570 1044 H THR 153 H THR 153 -1.643 -13.305 -8.314 1045 HA THR 153 HA THR 153 -1.300 -10.769 -9.503 1046 HB THR 153 HB THR 153 -3.706 -10.437 -8.913 1047 HG1 THR 153 1HG THR 153 -4.500 -11.598 -7.290 1048 1HG2 THR 153 1HG2 THR 153 -3.096 -11.727 -10.935 1049 2HG2 THR 153 2HG2 THR 153 -4.591 -12.333 -10.202 1050 3HG2 THR 153 3HG2 THR 153 -3.074 -13.194 -9.957 1051 H LEU 154 H LEU 154 -1.214 -12.055 -6.378 1052 HA LEU 154 HA LEU 154 -1.458 -9.619 -4.870 1053 1HB LEU 154 2HB LEU 154 -0.053 -12.173 -4.105 1054 2HB LEU 154 1HB LEU 154 -0.478 -10.876 -3.011 1055 HG LEU 154 HG LEU 154 -2.394 -12.691 -4.465 1056 1HD1 LEU 154 1HD1 LEU 154 -2.926 -13.496 -2.228 1057 2HD1 LEU 154 2HD1 LEU 154 -1.682 -12.448 -1.552 1058 3HD1 LEU 154 3HD1 LEU 154 -1.231 -13.767 -2.629 1059 1HD2 LEU 154 1HD2 LEU 154 -3.349 -10.455 -4.242 1060 2HD2 LEU 154 2HD2 LEU 154 -2.947 -10.448 -2.520 1061 3HD2 LEU 154 3HD2 LEU 154 -4.139 -11.585 -3.146 1062 H LEU 155 H LEU 155 1.275 -11.452 -6.158 1063 HA LEU 155 HA LEU 155 3.265 -9.721 -5.191 1064 1HB LEU 155 2HB LEU 155 3.267 -11.518 -7.596 1065 2HB LEU 155 1HB LEU 155 4.673 -10.625 -7.052 1066 HG LEU 155 HG LEU 155 3.241 -12.767 -5.483 1067 1HD1 LEU 155 1HD1 LEU 155 5.902 -12.715 -6.838 1068 2HD1 LEU 155 2HD1 LEU 155 4.482 -13.637 -7.372 1069 3HD1 LEU 155 3HD1 LEU 155 5.287 -14.030 -5.838 1070 1HD2 LEU 155 1HD2 LEU 155 5.744 -11.196 -4.853 1071 2HD2 LEU 155 2HD2 LEU 155 5.132 -12.567 -3.930 1072 3HD2 LEU 155 3HD2 LEU 155 4.199 -11.079 -4.005 1073 H GLN 156 H GLN 156 1.395 -9.717 -8.169 1074 HA GLN 156 HA GLN 156 2.745 -7.515 -9.303 1075 1HB GLN 156 2HB GLN 156 -0.078 -8.424 -9.815 1076 2HB GLN 156 1HB GLN 156 0.772 -7.214 -10.761 1077 1HG GLN 156 2HG GLN 156 2.495 -8.986 -11.241 1078 2HG GLN 156 1HG GLN 156 1.365 -10.139 -10.530 1079 1HE2 GLN 156 1HE2 GLN 156 1.950 -7.961 -13.082 1080 2HE2 GLN 156 2HE2 GLN 156 0.748 -8.513 -14.192 1081 H PHE 157 H PHE 157 -0.053 -7.714 -7.196 1082 HA PHE 157 HA PHE 157 -0.789 -5.032 -7.181 1083 1HB PHE 157 2HB PHE 157 -2.128 -6.807 -6.111 1084 2HB PHE 157 1HB PHE 157 -0.869 -7.042 -4.909 1085 HD1 PHE 157 1HD PHE 157 -1.101 -6.002 -2.872 1086 HD2 PHE 157 2HD PHE 157 -3.114 -4.382 -6.246 1087 HE1 PHE 157 1HE PHE 157 -2.236 -4.326 -1.399 1088 HE2 PHE 157 2HE PHE 157 -4.239 -2.736 -4.804 1089 HZ PHE 157 HZ PHE 157 -3.794 -2.711 -2.383 1090 H CYS 158 H CYS 158 1.665 -6.739 -5.323 1091 HA CYS 158 HA CYS 158 2.553 -4.570 -3.764 1092 1HB CYS 158 2HB CYS 158 4.125 -6.969 -4.747 1093 2HB CYS 158 1HB CYS 158 4.559 -5.926 -3.396 1094 HG CYS 158 HG CYS 158 1.824 -7.984 -3.525 1095 H VAL 159 H VAL 159 3.617 -5.875 -6.876 1096 HA VAL 159 HA VAL 159 5.787 -4.172 -7.346 1097 HB VAL 159 HB VAL 159 3.990 -5.514 -9.388 1098 1HG1 VAL 159 1HG1 VAL 159 6.780 -4.400 -9.738 1099 2HG1 VAL 159 2HG1 VAL 159 5.302 -3.707 -10.399 1100 3HG1 VAL 159 3HG1 VAL 159 5.850 -5.288 -10.953 1101 1HG2 VAL 159 1HG2 VAL 159 6.599 -6.393 -8.170 1102 2HG2 VAL 159 2HG2 VAL 159 5.724 -7.227 -9.460 1103 3HG2 VAL 159 3HG2 VAL 159 5.004 -7.081 -7.856 1104 H GLU 160 H GLU 160 2.387 -3.804 -8.246 1105 HA GLU 160 HA GLU 160 2.764 -1.486 -9.787 1106 1HB GLU 160 2HB GLU 160 0.262 -2.334 -8.316 1107 2HB GLU 160 1HB GLU 160 0.333 -1.120 -9.587 1108 1HG GLU 160 2HG GLU 160 0.943 -4.056 -9.875 1109 2HG GLU 160 1HG GLU 160 -0.473 -3.207 -10.487 1110 H VAL 161 H VAL 161 1.931 -1.847 -6.385 1111 HA VAL 161 HA VAL 161 1.750 0.911 -5.831 1112 HB VAL 161 HB VAL 161 2.483 -1.360 -3.976 1113 1HG1 VAL 161 1HG1 VAL 161 1.720 0.127 -2.143 1114 2HG1 VAL 161 2HG1 VAL 161 1.480 1.424 -3.318 1115 3HG1 VAL 161 3HG1 VAL 161 3.101 0.806 -3.008 1116 1HG2 VAL 161 1HG2 VAL 161 0.317 -1.714 -5.006 1117 2HG2 VAL 161 2HG2 VAL 161 -0.199 -0.093 -4.538 1118 3HG2 VAL 161 3HG2 VAL 161 0.110 -1.311 -3.302 1119 H SER 162 H SER 162 4.453 -1.334 -5.964 1120 HA SER 162 HA SER 162 6.390 0.081 -4.640 1121 1HB SER 162 2HB SER 162 6.693 -1.720 -7.034 1122 2HB SER 162 1HB SER 162 8.025 -1.172 -6.011 1123 HG SER 162 HG SER 162 5.760 -2.670 -5.100 1124 H LYS 163 H LYS 163 5.483 0.505 -8.098 1125 HA LYS 163 HA LYS 163 7.549 2.412 -8.501 1126 1HB LYS 163 2HB LYS 163 5.024 2.039 -10.118 1127 2HB LYS 163 1HB LYS 163 6.187 3.302 -10.460 1128 1HG LYS 163 2HG LYS 163 6.685 1.589 -11.969 1129 2HG LYS 163 1HG LYS 163 7.909 1.464 -10.717 1130 1HD LYS 163 2HD LYS 163 7.182 -0.736 -11.270 1131 2HD LYS 163 1HD LYS 163 6.533 -0.339 -9.680 1132 1HE LYS 163 2HE LYS 163 4.363 0.119 -10.609 1133 2HE LYS 163 1HE LYS 163 4.981 -0.068 -12.262 1134 1HZ LYS 163 1HZ LYS 163 5.422 -2.356 -11.743 1135 2HZ LYS 163 2HZ LYS 163 3.787 -2.029 -11.486 1136 3HZ LYS 163 3HZ LYS 163 4.842 -2.101 -10.169 1137 H GLU 164 H GLU 164 4.270 2.770 -7.391 1138 HA GLU 164 HA GLU 164 4.211 5.585 -7.552 1139 1HB GLU 164 2HB GLU 164 2.160 4.227 -7.218 1140 2HB GLU 164 1HB GLU 164 2.801 3.780 -5.633 1141 1HG GLU 164 2HG GLU 164 1.053 5.515 -5.476 1142 2HG GLU 164 1HG GLU 164 2.605 6.026 -4.823 1143 H ILE 165 H ILE 165 4.975 3.399 -4.876 1144 HA ILE 165 HA ILE 165 5.462 5.543 -3.098 1145 HB ILE 165 HB ILE 165 4.715 3.302 -2.412 1146 1HG1 ILE 165 2HG1 ILE 165 5.780 4.789 -0.683 1147 2HG1 ILE 165 1HG1 ILE 165 5.885 3.088 -0.293 1148 1HG2 ILE 165 1HG2 ILE 165 6.278 1.417 -2.134 1149 2HG2 ILE 165 2HG2 ILE 165 7.487 2.345 -3.021 1150 3HG2 ILE 165 3HG2 ILE 165 5.974 1.887 -3.809 1151 1HD1 ILE 165 1HD1 ILE 165 8.111 4.797 -1.402 1152 2HD1 ILE 165 2HD1 ILE 165 8.238 3.089 -0.989 1153 3HD1 ILE 165 3HD1 ILE 165 7.935 4.281 0.275 1154 H ASP 166 H ASP 166 7.588 3.528 -5.042 1155 HA ASP 166 HA ASP 166 10.085 4.436 -4.084 1156 1HB ASP 166 2HB ASP 166 9.878 2.464 -5.516 1157 2HB ASP 166 1HB ASP 166 9.306 3.464 -6.838 1158 H GLU 167 H GLU 167 8.223 5.514 -6.908 1159 HA GLU 167 HA GLU 167 10.063 7.611 -7.441 1160 1HB GLU 167 2HB GLU 167 7.325 7.177 -8.593 1161 2HB GLU 167 1HB GLU 167 8.504 8.341 -9.176 1162 1HG GLU 167 2HG GLU 167 10.029 6.451 -9.647 1163 2HG GLU 167 1HG GLU 167 8.719 5.351 -9.209 1164 H HIS 168 H HIS 168 7.155 7.408 -5.566 1165 HA HIS 168 HA HIS 168 6.511 10.183 -5.722 1166 1HB HIS 168 2HB HIS 168 5.023 8.178 -4.904 1167 2HB HIS 168 1HB HIS 168 5.751 8.521 -3.343 1168 HD1 HIS 168 1HD HIS 168 3.017 9.440 -5.482 1169 HD2 HIS 168 2HD HIS 168 5.210 11.317 -2.486 1170 HE1 HIS 168 1HE HIS 168 1.645 11.447 -4.777 1171 HE2 HIS 168 2HE HIS 168 2.936 12.472 -2.872 1172 H LEU 169 H LEU 169 8.498 8.247 -3.545 1173 HA LEU 169 HA LEU 169 9.037 10.491 -1.861 1174 1HB LEU 169 2HB LEU 169 10.436 7.832 -2.073 1175 2HB LEU 169 1HB LEU 169 10.808 9.053 -0.873 1176 HG LEU 169 HG LEU 169 8.206 7.546 -1.132 1177 1HD1 LEU 169 1HD1 LEU 169 10.388 7.419 0.941 1178 2HD1 LEU 169 2HD1 LEU 169 10.023 6.187 -0.268 1179 3HD1 LEU 169 3HD1 LEU 169 8.853 6.552 0.999 1180 1HD2 LEU 169 1HD2 LEU 169 7.604 8.648 0.975 1181 2HD2 LEU 169 2HD2 LEU 169 7.807 9.818 -0.326 1182 3HD2 LEU 169 3HD2 LEU 169 9.073 9.615 0.889 1183 H LEU 170 H LEU 170 10.510 9.110 -4.702 1184 HA LEU 170 HA LEU 170 12.889 10.670 -4.482 1185 1HB LEU 170 2HB LEU 170 11.691 9.303 -6.879 1186 2HB LEU 170 1HB LEU 170 13.281 10.033 -6.833 1187 HG LEU 170 HG LEU 170 12.373 7.645 -5.241 1188 1HD1 LEU 170 1HD1 LEU 170 12.713 7.193 -7.591 1189 2HD1 LEU 170 2HD1 LEU 170 13.972 6.446 -6.613 1190 3HD1 LEU 170 3HD1 LEU 170 14.317 7.923 -7.518 1191 1HD2 LEU 170 1HD2 LEU 170 14.727 7.497 -4.531 1192 2HD2 LEU 170 2HD2 LEU 170 13.955 8.965 -3.936 1193 3HD2 LEU 170 3HD2 LEU 170 15.053 9.041 -5.319 1194 H ALA 171 H ALA 171 9.761 11.165 -5.753 1195 HA ALA 171 HA ALA 171 10.395 13.607 -7.104 1196 1HB ALA 171 1HB ALA 171 7.942 13.910 -7.191 1197 2HB ALA 171 2HB ALA 171 7.745 12.515 -6.127 1198 3HB ALA 171 3HB ALA 171 8.411 12.302 -7.747 1199 H GLU 172 H GLU 172 11.201 15.135 -5.912 1200 HA GLU 172 HA GLU 172 10.656 15.346 -3.145 1201 1HB GLU 172 2HB GLU 172 12.207 17.153 -4.971 1202 2HB GLU 172 1HB GLU 172 12.071 17.383 -3.228 1203 1HG GLU 172 2HG GLU 172 13.061 15.218 -2.829 1204 2HG GLU 172 1HG GLU 172 13.148 14.929 -4.560 1205 H GLU 173 H GLU 173 9.843 17.078 -2.036 1206 HA GLU 173 HA GLU 173 7.871 18.666 -3.463 1207 1HB GLU 173 2HB GLU 173 6.781 16.630 -2.588 1208 2HB GLU 173 1HB GLU 173 7.386 16.997 -0.983 1209 1HG GLU 173 2HG GLU 173 5.022 17.545 -1.269 1210 2HG GLU 173 1HG GLU 173 6.002 18.950 -0.861 Start of MODEL 4 1 H THR 17 H THR 17 1.978 -22.966 -4.387 2 HA THR 17 HA THR 17 2.505 -24.396 -1.914 3 HB THR 17 HB THR 17 2.143 -21.432 -2.403 4 HG1 THR 17 1HG THR 17 4.077 -21.820 -3.206 5 1HG2 THR 17 1HG2 THR 17 3.102 -22.911 0.062 6 2HG2 THR 17 2HG2 THR 17 1.574 -22.043 -0.089 7 3HG2 THR 17 3HG2 THR 17 3.100 -21.157 -0.135 8 H GLU 18 H GLU 18 0.662 -25.534 -1.572 9 HA GLU 18 HA GLU 18 -1.785 -23.984 -1.281 10 1HB GLU 18 2HB GLU 18 -3.002 -26.044 -1.747 11 2HB GLU 18 1HB GLU 18 -2.000 -25.558 -3.109 12 1HG GLU 18 2HG GLU 18 -0.340 -27.252 -2.449 13 2HG GLU 18 1HG GLU 18 -1.391 -27.744 -1.119 14 H ALA 19 H ALA 19 -3.324 -25.317 0.243 15 HA ALA 19 HA ALA 19 -1.991 -26.606 2.425 16 1HB ALA 19 1HB ALA 19 -3.071 -23.827 2.829 17 2HB ALA 19 2HB ALA 19 -1.370 -24.283 2.852 18 3HB ALA 19 3HB ALA 19 -2.464 -24.892 4.104 19 H SER 20 H SER 20 -3.425 -27.904 3.370 20 HA SER 20 HA SER 20 -6.090 -28.094 2.573 21 1HB SER 20 2HB SER 20 -6.239 -29.660 4.526 22 2HB SER 20 1HB SER 20 -4.882 -29.994 3.444 23 HG SER 20 HG SER 20 -4.918 -29.245 6.056 24 H SER 21 H SER 21 -4.485 -26.339 5.060 25 HA SER 21 HA SER 21 -6.738 -25.718 6.658 26 1HB SER 21 2HB SER 21 -4.033 -24.407 6.512 27 2HB SER 21 1HB SER 21 -5.186 -24.319 7.849 28 HG SER 21 HG SER 21 -4.852 -26.401 8.312 29 H LEU 22 H LEU 22 -5.911 -24.645 3.578 30 HA LEU 22 HA LEU 22 -6.426 -22.925 2.238 31 1HB LEU 22 2HB LEU 22 -8.441 -22.406 4.390 32 2HB LEU 22 1HB LEU 22 -8.455 -21.618 2.821 33 HG LEU 22 HG LEU 22 -8.641 -24.605 3.179 34 1HD1 LEU 22 1HD1 LEU 22 -10.999 -24.327 2.780 35 2HD1 LEU 22 2HD1 LEU 22 -10.798 -22.553 2.828 36 3HD1 LEU 22 3HD1 LEU 22 -10.450 -23.548 4.261 37 1HD2 LEU 22 1HD2 LEU 22 -9.483 -24.525 0.893 38 2HD2 LEU 22 2HD2 LEU 22 -7.856 -23.861 0.990 39 3HD2 LEU 22 3HD2 LEU 22 -9.244 -22.780 0.857 40 H VAL 23 H VAL 23 -4.638 -22.448 4.727 41 HA VAL 23 HA VAL 23 -4.820 -19.638 5.144 42 HB VAL 23 HB VAL 23 -3.844 -21.228 6.814 43 1HG1 VAL 23 1HG1 VAL 23 -1.523 -21.400 4.927 44 2HG1 VAL 23 2HG1 VAL 23 -2.627 -22.699 5.380 45 3HG1 VAL 23 3HG1 VAL 23 -1.542 -22.002 6.584 46 1HG2 VAL 23 1HG2 VAL 23 -1.990 -19.007 5.959 47 2HG2 VAL 23 2HG2 VAL 23 -1.990 -19.796 7.538 48 3HG2 VAL 23 3HG2 VAL 23 -3.388 -18.856 7.025 49 H GLY 24 H GLY 24 -3.346 -17.994 4.368 50 1HA GLY 24 2HA GLY 24 -1.676 -18.798 2.120 51 2HA GLY 24 1HA GLY 24 -2.965 -17.613 1.918 52 H LYS 25 H LYS 25 0.202 -17.917 2.349 53 HA LYS 25 HA LYS 25 0.361 -15.152 3.298 54 1HB LYS 25 2HB LYS 25 2.285 -17.386 3.856 55 2HB LYS 25 1HB LYS 25 2.616 -15.665 3.974 56 1HG LYS 25 2HG LYS 25 0.978 -15.460 5.744 57 2HG LYS 25 1HG LYS 25 0.633 -17.193 5.623 58 1HD LYS 25 2HD LYS 25 2.283 -16.614 7.430 59 2HD LYS 25 1HD LYS 25 2.887 -17.764 6.230 60 1HE LYS 25 2HE LYS 25 4.069 -15.936 5.060 61 2HE LYS 25 1HE LYS 25 3.450 -14.780 6.222 62 1HZ LYS 25 1HZ LYS 25 5.209 -17.069 6.915 63 2HZ LYS 25 2HZ LYS 25 4.786 -15.780 7.947 64 3HZ LYS 25 3HZ LYS 25 5.743 -15.515 6.591 65 H LEU 26 H LEU 26 1.947 -13.923 2.339 66 HA LEU 26 HA LEU 26 3.813 -15.247 0.707 67 1HB LEU 26 2HB LEU 26 2.036 -14.781 -0.935 68 2HB LEU 26 1HB LEU 26 2.021 -13.097 -0.468 69 HG LEU 26 HG LEU 26 4.336 -12.870 -1.340 70 1HD1 LEU 26 1HD1 LEU 26 5.070 -15.171 -1.133 71 2HD1 LEU 26 2HD1 LEU 26 5.236 -14.609 -2.797 72 3HD1 LEU 26 3HD1 LEU 26 3.899 -15.670 -2.355 73 1HD2 LEU 26 1HD2 LEU 26 2.438 -12.232 -2.704 74 2HD2 LEU 26 2HD2 LEU 26 2.291 -13.887 -3.308 75 3HD2 LEU 26 3HD2 LEU 26 3.719 -12.927 -3.698 76 H GLU 27 H GLU 27 5.730 -14.204 0.814 77 HA GLU 27 HA GLU 27 5.685 -11.524 1.943 78 1HB GLU 27 2HB GLU 27 7.476 -13.781 2.862 79 2HB GLU 27 1HB GLU 27 7.634 -12.108 3.369 80 1HG GLU 27 2HG GLU 27 5.393 -12.212 4.374 81 2HG GLU 27 1HG GLU 27 5.268 -13.902 3.899 82 H THR 28 H THR 28 7.029 -10.169 1.022 83 HA THR 28 HA THR 28 9.135 -11.188 -0.648 84 HB THR 28 HB THR 28 7.149 -11.084 -2.178 85 HG1 THR 28 1HG THR 28 8.586 -10.581 -3.541 86 1HG2 THR 28 1HG2 THR 28 5.883 -9.308 -1.033 87 2HG2 THR 28 2HG2 THR 28 6.129 -8.926 -2.735 88 3HG2 THR 28 3HG2 THR 28 7.108 -8.127 -1.511 89 H ASP 29 H ASP 29 10.437 -9.283 -1.424 90 HA ASP 29 HA ASP 29 10.067 -6.933 0.203 91 1HB ASP 29 2HB ASP 29 12.483 -6.809 0.783 92 2HB ASP 29 1HB ASP 29 11.680 -8.181 1.520 93 H VAL 30 H VAL 30 10.157 -5.235 -0.914 94 HA VAL 30 HA VAL 30 11.362 -5.372 -3.592 95 HB VAL 30 HB VAL 30 9.209 -3.476 -2.579 96 1HG1 VAL 30 1HG1 VAL 30 10.582 -2.481 -4.337 97 2HG1 VAL 30 2HG1 VAL 30 8.952 -2.807 -4.916 98 3HG1 VAL 30 3HG1 VAL 30 10.282 -3.876 -5.377 99 1HG2 VAL 30 1HG2 VAL 30 8.989 -5.845 -4.420 100 2HG2 VAL 30 2HG2 VAL 30 7.681 -4.710 -4.045 101 3HG2 VAL 30 3HG2 VAL 30 8.354 -5.741 -2.773 102 H GLU 31 H GLU 31 12.807 -3.805 -4.146 103 HA GLU 31 HA GLU 31 13.829 -2.265 -1.897 104 1HB GLU 31 2HB GLU 31 15.115 -2.199 -4.625 105 2HB GLU 31 1HB GLU 31 15.724 -1.903 -2.998 106 1HG GLU 31 2HG GLU 31 16.748 -3.900 -3.826 107 2HG GLU 31 1HG GLU 31 15.633 -4.304 -2.528 108 H ILE 32 H ILE 32 13.652 -0.082 -1.818 109 HA ILE 32 HA ILE 32 12.587 1.211 -4.215 110 HB ILE 32 HB ILE 32 11.929 3.119 -2.761 111 1HG1 ILE 32 2HG1 ILE 32 12.648 1.284 -0.452 112 2HG1 ILE 32 1HG1 ILE 32 13.536 2.727 -0.923 113 1HG2 ILE 32 1HG2 ILE 32 10.239 1.500 -3.364 114 2HG2 ILE 32 2HG2 ILE 32 9.958 2.057 -1.719 115 3HG2 ILE 32 3HG2 ILE 32 10.691 0.483 -1.999 116 1HD1 ILE 32 1HD1 ILE 32 12.137 3.132 1.003 117 2HD1 ILE 32 2HD1 ILE 32 10.705 2.643 0.098 118 3HD1 ILE 32 3HD1 ILE 32 11.595 4.097 -0.368 119 H LYS 33 H LYS 33 13.556 3.183 -4.838 120 HA LYS 33 HA LYS 33 16.435 3.082 -4.428 121 1HB LYS 33 2HB LYS 33 14.839 5.069 -6.004 122 2HB LYS 33 1HB LYS 33 16.539 4.721 -6.158 123 1HG LYS 33 2HG LYS 33 16.096 2.537 -7.050 124 2HG LYS 33 1HG LYS 33 14.361 2.751 -6.784 125 1HD LYS 33 2HD LYS 33 14.388 4.674 -8.299 126 2HD LYS 33 1HD LYS 33 16.102 4.392 -8.592 127 1HE LYS 33 2HE LYS 33 15.566 2.186 -9.512 128 2HE LYS 33 1HE LYS 33 13.856 2.479 -9.211 129 1HZ LYS 33 1HZ LYS 33 14.398 2.950 -11.504 130 2HZ LYS 33 2HZ LYS 33 15.592 4.025 -11.067 131 3HZ LYS 33 3HZ LYS 33 13.982 4.387 -10.737 132 H ALA 34 H ALA 34 13.895 4.478 -2.929 133 HA ALA 34 HA ALA 34 15.216 6.957 -2.200 134 1HB ALA 34 1HB ALA 34 12.507 5.890 -1.429 135 2HB ALA 34 2HB ALA 34 12.835 7.026 -2.736 136 3HB ALA 34 3HB ALA 34 13.130 7.497 -1.061 137 H SER 35 H SER 35 15.063 7.521 0.197 138 HA SER 35 HA SER 35 16.220 5.348 1.660 139 1HB SER 35 2HB SER 35 16.736 7.238 3.246 140 2HB SER 35 1HB SER 35 17.453 7.390 1.643 141 HG SER 35 HG SER 35 16.521 9.293 2.328 142 H ALA 36 H ALA 36 15.501 4.940 3.813 143 HA ALA 36 HA ALA 36 12.706 4.638 4.011 144 1HB ALA 36 1HB ALA 36 14.297 3.070 5.014 145 2HB ALA 36 2HB ALA 36 13.176 3.708 6.220 146 3HB ALA 36 3HB ALA 36 14.825 4.325 6.134 147 H ASP 37 H ASP 37 14.934 7.030 5.070 148 HA ASP 37 HA ASP 37 13.243 8.206 6.991 149 1HB ASP 37 2HB ASP 37 15.641 8.677 7.059 150 2HB ASP 37 1HB ASP 37 15.536 9.513 5.511 151 H LYS 38 H LYS 38 13.407 8.554 3.509 152 HA LYS 38 HA LYS 38 11.790 10.871 3.561 153 1HB LYS 38 2HB LYS 38 12.217 8.971 1.274 154 2HB LYS 38 1HB LYS 38 11.325 10.481 1.164 155 1HG LYS 38 2HG LYS 38 13.482 11.536 2.121 156 2HG LYS 38 1HG LYS 38 14.247 10.040 1.584 157 1HD LYS 38 2HD LYS 38 14.482 11.667 -0.131 158 2HD LYS 38 1HD LYS 38 13.283 10.465 -0.663 159 1HE LYS 38 2HE LYS 38 11.458 11.975 -0.078 160 2HE LYS 38 1HE LYS 38 12.595 13.132 0.598 161 1HZ LYS 38 1HZ LYS 38 12.313 12.360 -2.247 162 2HZ LYS 38 2HZ LYS 38 13.500 13.414 -1.643 163 3HZ LYS 38 3HZ LYS 38 11.873 13.812 -1.536 164 H PHE 39 H PHE 39 11.094 7.494 3.646 165 HA PHE 39 HA PHE 39 8.284 7.622 3.205 166 1HB PHE 39 2HB PHE 39 9.631 5.493 3.262 167 2HB PHE 39 1HB PHE 39 9.874 5.721 4.982 168 HD1 PHE 39 1HD PHE 39 7.633 4.578 2.390 169 HD2 PHE 39 2HD PHE 39 7.944 5.446 6.540 170 HE1 PHE 39 1HE PHE 39 5.590 3.267 2.816 171 HE2 PHE 39 2HE PHE 39 5.905 4.143 6.973 172 HZ PHE 39 HZ PHE 39 4.725 3.049 5.110 173 H HIS 40 H HIS 40 10.330 7.750 6.007 174 HA HIS 40 HA HIS 40 8.531 8.295 8.049 175 1HB HIS 40 2HB HIS 40 10.800 7.690 8.533 176 2HB HIS 40 1HB HIS 40 11.420 9.022 7.585 177 HD1 HIS 40 1HD HIS 40 12.635 10.488 9.148 178 HD2 HIS 40 2HD HIS 40 9.070 9.081 10.794 179 HE1 HIS 40 1HE HIS 40 12.434 11.592 11.379 180 HE2 HIS 40 2HE HIS 40 10.275 10.742 12.358 181 H HIS 41 H HIS 41 10.053 10.505 5.755 182 HA HIS 41 HA HIS 41 8.961 12.877 6.979 183 1HB HIS 41 2HB HIS 41 10.495 12.499 4.426 184 2HB HIS 41 1HB HIS 41 9.755 14.040 4.819 185 HD1 HIS 41 1HD HIS 41 11.803 15.446 5.325 186 HD2 HIS 41 2HD HIS 41 11.827 11.806 7.310 187 HE1 HIS 41 1HE HIS 41 13.818 15.491 6.769 188 HE2 HIS 41 2HE HIS 41 13.993 13.085 7.492 189 H MET 42 H MET 42 7.884 10.805 4.352 190 HA MET 42 HA MET 42 6.216 12.723 3.121 191 1HB MET 42 2HB MET 42 5.102 10.944 1.938 192 2HB MET 42 1HB MET 42 6.805 10.532 2.045 193 1HG MET 42 2HG MET 42 6.362 8.945 3.760 194 2HG MET 42 1HG MET 42 4.683 9.459 3.877 195 1HE MET 42 1HE MET 42 5.388 6.450 3.605 196 2HE MET 42 2HE MET 42 4.242 5.930 2.373 197 3HE MET 42 3HE MET 42 3.738 7.070 3.620 198 H PHE 43 H PHE 43 5.768 10.818 5.939 199 HA PHE 43 HA PHE 43 2.951 10.940 6.118 200 1HB PHE 43 2HB PHE 43 4.277 9.300 7.354 201 2HB PHE 43 1HB PHE 43 5.082 10.581 8.244 202 HD1 PHE 43 1HD PHE 43 1.822 8.914 7.708 203 HD2 PHE 43 2HD PHE 43 4.150 11.424 10.236 204 HE1 PHE 43 1HE PHE 43 0.114 8.731 9.462 205 HE2 PHE 43 2HE PHE 43 2.445 11.246 11.993 206 HZ PHE 43 HZ PHE 43 0.424 9.900 11.609 207 H ALA 44 H ALA 44 5.399 13.254 6.630 208 HA ALA 44 HA ALA 44 3.708 14.881 8.363 209 1HB ALA 44 1HB ALA 44 5.983 14.441 9.125 210 2HB ALA 44 2HB ALA 44 5.718 16.160 8.829 211 3HB ALA 44 3HB ALA 44 6.617 15.188 7.660 212 H GLY 45 H GLY 45 3.646 14.554 5.188 213 1HA GLY 45 2HA GLY 45 2.793 17.208 4.734 214 2HA GLY 45 1HA GLY 45 4.441 17.067 4.169 215 H LYS 46 H LYS 46 4.439 14.601 3.002 216 HA LYS 46 HA LYS 46 3.148 15.206 0.539 217 1HB LYS 46 2HB LYS 46 4.717 12.822 1.466 218 2HB LYS 46 1HB LYS 46 3.916 12.814 -0.092 219 1HG LYS 46 2HG LYS 46 6.288 13.317 -0.307 220 2HG LYS 46 1HG LYS 46 5.323 14.697 -0.803 221 1HD LYS 46 2HD LYS 46 5.805 15.820 1.280 222 2HD LYS 46 1HD LYS 46 6.636 14.394 1.897 223 1HE LYS 46 2HE LYS 46 8.205 16.110 1.092 224 2HE LYS 46 1HE LYS 46 8.346 14.604 0.196 225 1HZ LYS 46 1HZ LYS 46 8.424 16.546 -1.229 226 2HZ LYS 46 2HZ LYS 46 6.900 17.038 -0.724 227 3HZ LYS 46 3HZ LYS 46 7.065 15.625 -1.616 228 HA PRO 47 HA PRO 47 -0.727 13.146 1.168 229 1HB PRO 47 2HB PRO 47 -1.328 12.660 -1.463 230 2HB PRO 47 1HB PRO 47 -1.547 14.239 -0.696 231 1HG PRO 47 2HG PRO 47 0.692 13.259 -2.423 232 2HG PRO 47 1HG PRO 47 -0.125 14.831 -2.437 233 1HD PRO 47 2HD PRO 47 2.272 14.482 -1.276 234 2HD PRO 47 1HD PRO 47 1.067 15.607 -0.617 235 H HIS 48 H HIS 48 -1.705 11.040 0.641 236 HA HIS 48 HA HIS 48 0.322 8.957 0.675 237 1HB HIS 48 2HB HIS 48 -1.461 8.972 2.367 238 2HB HIS 48 1HB HIS 48 -2.675 8.887 1.113 239 HD1 HIS 48 1HD HIS 48 -0.209 6.810 2.991 240 HD2 HIS 48 2HD HIS 48 -3.136 6.306 0.100 241 HE1 HIS 48 1HE HIS 48 -0.660 4.321 2.885 242 HE2 HIS 48 2HE HIS 48 -2.715 4.183 1.397 243 H HIS 49 H HIS 49 -1.502 10.481 -1.616 244 HA HIS 49 HA HIS 49 -1.270 8.317 -3.574 245 1HB HIS 49 2HB HIS 49 -3.556 8.161 -3.002 246 2HB HIS 49 1HB HIS 49 -3.712 9.878 -2.733 247 HD1 HIS 49 1HD HIS 49 -5.441 10.620 -4.266 248 HD2 HIS 49 2HD HIS 49 -2.861 7.992 -6.144 249 HE1 HIS 49 1HE HIS 49 -6.193 10.544 -6.662 250 HE2 HIS 49 2HE HIS 49 -4.357 9.350 -7.783 251 H VAL 50 H VAL 50 -0.818 9.122 -5.730 252 HA VAL 50 HA VAL 50 0.398 11.555 -6.001 253 HB VAL 50 HB VAL 50 -0.072 11.374 -8.507 254 1HG1 VAL 50 1HG1 VAL 50 1.054 8.951 -7.125 255 2HG1 VAL 50 2HG1 VAL 50 1.922 10.433 -7.541 256 3HG1 VAL 50 3HG1 VAL 50 1.314 9.381 -8.817 257 1HG2 VAL 50 1HG2 VAL 50 -2.222 10.195 -8.373 258 2HG2 VAL 50 2HG2 VAL 50 -1.404 8.791 -7.686 259 3HG2 VAL 50 3HG2 VAL 50 -1.054 9.292 -9.339 260 H SER 51 H SER 51 -0.236 13.573 -6.099 261 HA SER 51 HA SER 51 -3.115 14.059 -6.014 262 1HB SER 51 2HB SER 51 -1.731 14.592 -3.997 263 2HB SER 51 1HB SER 51 -0.846 15.767 -4.961 264 HG SER 51 HG SER 51 -2.831 16.869 -5.265 265 H LYS 52 H LYS 52 -3.812 14.619 -8.011 266 HA LYS 52 HA LYS 52 -3.047 17.088 -9.156 267 1HB LYS 52 2HB LYS 52 -1.204 15.626 -10.033 268 2HB LYS 52 1HB LYS 52 -2.442 14.589 -10.728 269 1HG LYS 52 2HG LYS 52 -3.175 16.403 -12.181 270 2HG LYS 52 1HG LYS 52 -1.964 17.473 -11.469 271 1HD LYS 52 2HD LYS 52 -1.183 16.575 -13.599 272 2HD LYS 52 1HD LYS 52 -0.200 15.985 -12.253 273 1HE LYS 52 2HE LYS 52 -1.435 13.899 -12.244 274 2HE LYS 52 1HE LYS 52 -2.461 14.477 -13.550 275 1HZ LYS 52 1HZ LYS 52 -0.739 13.022 -14.354 276 2HZ LYS 52 2HZ LYS 52 0.469 14.013 -13.723 277 3HZ LYS 52 3HZ LYS 52 -0.510 14.568 -14.974 278 H ALA 53 H ALA 53 -4.652 17.740 -10.673 279 HA ALA 53 HA ALA 53 -7.078 16.243 -10.359 280 1HB ALA 53 1HB ALA 53 -8.219 18.120 -11.393 281 2HB ALA 53 2HB ALA 53 -6.678 18.828 -11.863 282 3HB ALA 53 3HB ALA 53 -7.101 18.702 -10.157 283 H SER 54 H SER 54 -6.551 14.395 -11.474 284 HA SER 54 HA SER 54 -7.077 14.613 -14.324 285 1HB SER 54 2HB SER 54 -4.916 12.890 -13.072 286 2HB SER 54 1HB SER 54 -5.399 12.833 -14.767 287 HG SER 54 HG SER 54 -4.835 15.058 -14.882 288 HA PRO 55 HA PRO 55 -10.251 11.713 -13.273 289 1HB PRO 55 2HB PRO 55 -10.404 10.468 -15.759 290 2HB PRO 55 1HB PRO 55 -11.271 11.932 -15.294 291 1HG PRO 55 2HG PRO 55 -8.768 11.634 -16.873 292 2HG PRO 55 1HG PRO 55 -10.072 12.815 -17.036 293 1HD PRO 55 2HD PRO 55 -7.702 13.420 -15.924 294 2HD PRO 55 1HD PRO 55 -9.222 14.174 -15.388 295 H GLY 56 H GLY 56 -10.559 9.591 -12.837 296 1HA GLY 56 2HA GLY 56 -9.083 7.369 -13.528 297 2HA GLY 56 1HA GLY 56 -8.263 8.088 -12.137 298 H ASN 57 H ASN 57 -10.523 9.232 -10.989 299 HA ASN 57 HA ASN 57 -12.378 7.091 -10.431 300 1HB ASN 57 2HB ASN 57 -12.172 7.322 -7.997 301 2HB ASN 57 1HB ASN 57 -10.590 6.927 -8.652 302 1HD2 ASN 57 1HD2 ASN 57 -8.955 8.502 -8.598 303 2HD2 ASN 57 2HD2 ASN 57 -9.087 9.900 -7.602 304 H ILE 58 H ILE 58 -13.974 8.264 -8.651 305 HA ILE 58 HA ILE 58 -15.400 10.148 -10.089 306 HB ILE 58 HB ILE 58 -16.702 10.611 -8.028 307 1HG1 ILE 58 2HG1 ILE 58 -14.694 8.787 -6.675 308 2HG1 ILE 58 1HG1 ILE 58 -14.817 10.524 -6.430 309 1HG2 ILE 58 1HG2 ILE 58 -17.508 8.334 -7.683 310 2HG2 ILE 58 2HG2 ILE 58 -16.069 7.709 -8.489 311 3HG2 ILE 58 3HG2 ILE 58 -17.236 8.673 -9.399 312 1HD1 ILE 58 1HD1 ILE 58 -15.850 9.292 -4.610 313 2HD1 ILE 58 2HD1 ILE 58 -16.929 8.486 -5.747 314 3HD1 ILE 58 3HD1 ILE 58 -17.056 10.227 -5.494 315 H GLN 59 H GLN 59 -12.887 10.773 -7.701 316 HA GLN 59 HA GLN 59 -13.353 13.662 -7.964 317 1HB GLN 59 2HB GLN 59 -11.588 12.126 -6.067 318 2HB GLN 59 1HB GLN 59 -11.751 13.870 -6.104 319 1HG GLN 59 2HG GLN 59 -14.114 13.634 -5.509 320 2HG GLN 59 1HG GLN 59 -13.907 11.888 -5.438 321 1HE2 GLN 59 1HE2 GLN 59 -14.640 13.809 -3.360 322 2HE2 GLN 59 2HE2 GLN 59 -13.482 13.559 -2.094 323 H GLY 60 H GLY 60 -11.017 11.156 -8.534 324 1HA GLY 60 2HA GLY 60 -9.216 11.193 -10.054 325 2HA GLY 60 1HA GLY 60 -9.470 12.928 -10.267 326 H CYS 61 H CYS 61 -9.110 14.195 -8.256 327 HA CYS 61 HA CYS 61 -6.680 13.310 -6.865 328 1HB CYS 61 2HB CYS 61 -6.502 15.431 -8.179 329 2HB CYS 61 1HB CYS 61 -7.837 16.097 -7.253 330 HG CYS 61 HG CYS 61 -5.506 17.306 -6.364 331 H ASP 62 H ASP 62 -6.741 13.509 -4.531 332 HA ASP 62 HA ASP 62 -9.359 13.077 -3.481 333 1HB ASP 62 2HB ASP 62 -6.751 13.435 -1.977 334 2HB ASP 62 1HB ASP 62 -8.258 12.843 -1.287 335 H LEU 63 H LEU 63 -10.622 14.741 -3.541 336 HA LEU 63 HA LEU 63 -9.654 17.338 -2.606 337 1HB LEU 63 2HB LEU 63 -10.641 17.260 -4.853 338 2HB LEU 63 1HB LEU 63 -12.115 16.598 -4.184 339 HG LEU 63 HG LEU 63 -12.470 18.717 -2.944 340 1HD1 LEU 63 1HD1 LEU 63 -11.163 20.696 -3.555 341 2HD1 LEU 63 2HD1 LEU 63 -10.081 19.680 -4.503 342 3HD1 LEU 63 3HD1 LEU 63 -10.176 19.477 -2.754 343 1HD2 LEU 63 1HD2 LEU 63 -13.547 18.354 -5.099 344 2HD2 LEU 63 2HD2 LEU 63 -12.132 19.006 -5.927 345 3HD2 LEU 63 3HD2 LEU 63 -13.108 20.050 -4.893 346 H HIS 64 H HIS 64 -10.399 18.172 -0.774 347 HA HIS 64 HA HIS 64 -11.534 18.510 1.130 348 1HB HIS 64 2HB HIS 64 -13.508 18.843 -0.273 349 2HB HIS 64 1HB HIS 64 -13.753 17.110 -0.360 350 HD1 HIS 64 1HD HIS 64 -15.422 16.206 1.215 351 HD2 HIS 64 2HD HIS 64 -13.953 19.877 2.457 352 HE1 HIS 64 1HE HIS 64 -16.814 16.838 3.175 353 HE2 HIS 64 2HE HIS 64 -16.129 19.191 3.680 354 H GLU 65 H GLU 65 -10.223 17.387 2.386 355 HA GLU 65 HA GLU 65 -10.812 14.579 2.878 356 1HB GLU 65 2HB GLU 65 -8.538 14.470 3.858 357 2HB GLU 65 1HB GLU 65 -8.527 14.937 2.170 358 1HG GLU 65 2HG GLU 65 -8.203 16.846 4.499 359 2HG GLU 65 1HG GLU 65 -6.876 16.174 3.560 360 H GLY 66 H GLY 66 -11.119 13.838 4.953 361 1HA GLY 66 2HA GLY 66 -11.524 15.944 6.980 362 2HA GLY 66 1HA GLY 66 -12.591 14.555 6.807 363 H ASP 67 H ASP 67 -10.283 12.798 6.235 364 HA ASP 67 HA ASP 67 -8.887 11.404 7.239 365 1HB ASP 67 2HB ASP 67 -7.398 13.199 7.823 366 2HB ASP 67 1HB ASP 67 -8.430 13.705 9.155 367 H TRP 68 H TRP 68 -8.747 9.843 8.855 368 HA TRP 68 HA TRP 68 -11.295 9.545 10.317 369 1HB TRP 68 2HB TRP 68 -9.324 7.472 9.403 370 2HB TRP 68 1HB TRP 68 -10.833 7.142 10.224 371 HD1 TRP 68 HD TRP 68 -9.720 8.796 6.866 372 HE1 TRP 68 1HE TRP 68 -11.462 8.194 5.073 373 HE3 TRP 68 3HE TRP 68 -12.998 6.207 9.782 374 HZ2 TRP 68 2HZ TRP 68 -13.903 6.799 4.921 375 HZ3 TRP 68 3HZ TRP 68 -15.018 5.260 8.738 376 HH2 TRP 68 HH TRP 68 -15.459 5.548 6.364 377 H GLY 69 H GLY 69 -8.506 10.789 11.160 378 1HA GLY 69 2HA GLY 69 -7.714 10.928 13.348 379 2HA GLY 69 1HA GLY 69 -8.334 9.308 13.672 380 H THR 70 H THR 70 -6.775 9.742 10.693 381 HA THR 70 HA THR 70 -4.955 8.967 9.741 382 HB THR 70 HB THR 70 -3.684 8.985 12.501 383 HG1 THR 70 1HG THR 70 -4.556 10.912 11.005 384 1HG2 THR 70 1HG2 THR 70 -1.551 9.068 11.264 385 2HG2 THR 70 2HG2 THR 70 -2.433 8.963 9.739 386 3HG2 THR 70 3HG2 THR 70 -2.452 7.603 10.859 387 H VAL 71 H VAL 71 -4.886 7.185 12.844 388 HA VAL 71 HA VAL 71 -4.576 4.717 11.444 389 HB VAL 71 HB VAL 71 -5.317 5.203 14.353 390 1HG1 VAL 71 1HG1 VAL 71 -4.346 2.702 12.969 391 2HG1 VAL 71 2HG1 VAL 71 -5.979 2.995 13.538 392 3HG1 VAL 71 3HG1 VAL 71 -4.651 2.866 14.702 393 1HG2 VAL 71 1HG2 VAL 71 -2.961 4.702 14.812 394 2HG2 VAL 71 2HG2 VAL 71 -3.124 6.118 13.769 395 3HG2 VAL 71 3HG2 VAL 71 -2.658 4.564 13.081 396 H GLY 72 H GLY 72 -6.162 3.604 10.479 397 1HA GLY 72 2HA GLY 72 -8.321 2.651 10.470 398 2HA GLY 72 1HA GLY 72 -8.884 3.995 11.459 399 H SER 73 H SER 73 -6.872 5.304 9.252 400 HA SER 73 HA SER 73 -9.032 6.483 7.815 401 1HB SER 73 2HB SER 73 -6.975 7.743 8.467 402 2HB SER 73 1HB SER 73 -6.058 6.758 7.334 403 HG SER 73 HG SER 73 -6.655 8.716 6.410 404 H ILE 74 H ILE 74 -9.295 6.553 5.627 405 HA ILE 74 HA ILE 74 -8.395 4.200 4.175 406 HB ILE 74 HB ILE 74 -11.191 5.339 4.320 407 1HG1 ILE 74 2HG1 ILE 74 -10.073 2.605 4.911 408 2HG1 ILE 74 1HG1 ILE 74 -10.447 3.830 6.113 409 1HG2 ILE 74 1HG2 ILE 74 -11.814 3.662 2.631 410 2HG2 ILE 74 2HG2 ILE 74 -10.121 3.193 2.475 411 3HG2 ILE 74 3HG2 ILE 74 -10.632 4.804 1.986 412 1HD1 ILE 74 1HD1 ILE 74 -12.370 2.468 4.257 413 2HD1 ILE 74 2HD1 ILE 74 -12.799 3.701 5.457 414 3HD1 ILE 74 3HD1 ILE 74 -12.163 2.128 5.979 415 H VAL 75 H VAL 75 -7.292 4.883 2.534 416 HA VAL 75 HA VAL 75 -8.032 7.378 1.148 417 HB VAL 75 HB VAL 75 -5.206 6.258 1.372 418 1HG1 VAL 75 1HG1 VAL 75 -4.486 8.468 0.581 419 2HG1 VAL 75 2HG1 VAL 75 -6.173 8.954 0.426 420 3HG1 VAL 75 3HG1 VAL 75 -5.529 7.651 -0.575 421 1HG2 VAL 75 1HG2 VAL 75 -4.701 8.065 2.976 422 2HG2 VAL 75 2HG2 VAL 75 -5.900 6.932 3.608 423 3HG2 VAL 75 3HG2 VAL 75 -6.412 8.502 2.995 424 H PHE 76 H PHE 76 -7.272 7.236 -1.237 425 HA PHE 76 HA PHE 76 -7.307 4.439 -2.081 426 1HB PHE 76 2HB PHE 76 -8.853 6.696 -3.347 427 2HB PHE 76 1HB PHE 76 -8.743 5.060 -3.997 428 HD1 PHE 76 1HD PHE 76 -9.148 3.313 -2.013 429 HD2 PHE 76 2HD PHE 76 -10.875 7.146 -2.319 430 HE1 PHE 76 1HE PHE 76 -10.948 2.561 -0.570 431 HE2 PHE 76 2HE PHE 76 -12.737 6.443 -0.867 432 HZ PHE 76 HZ PHE 76 -12.798 4.137 0.017 433 H TRP 77 H TRP 77 -6.135 3.871 -3.799 434 HA TRP 77 HA TRP 77 -4.270 5.885 -4.869 435 1HB TRP 77 2HB TRP 77 -4.065 2.882 -4.733 436 2HB TRP 77 1HB TRP 77 -3.000 3.852 -5.716 437 HD1 TRP 77 HD TRP 77 -2.195 6.098 -3.770 438 HE1 TRP 77 1HE TRP 77 -0.760 5.602 -1.724 439 HE3 TRP 77 3HE TRP 77 -3.222 1.125 -3.308 440 HZ2 TRP 77 2HZ TRP 77 -0.125 3.341 -0.101 441 HZ3 TRP 77 3HZ TRP 77 -2.157 -0.137 -1.496 442 HH2 TRP 77 HH TRP 77 -0.639 0.950 0.075 443 H ASN 78 H ASN 78 -3.854 5.932 -7.078 444 HA ASN 78 HA ASN 78 -5.730 4.515 -8.824 445 1HB ASN 78 2HB ASN 78 -5.034 7.461 -8.908 446 2HB ASN 78 1HB ASN 78 -5.609 6.612 -10.325 447 1HD2 ASN 78 1HD2 ASN 78 -6.882 5.880 -7.148 448 2HD2 ASN 78 2HD2 ASN 78 -8.421 6.612 -7.388 449 H TYR 79 H TYR 79 -4.774 3.573 -10.449 450 HA TYR 79 HA TYR 79 -2.244 4.446 -11.483 451 1HB TYR 79 2HB TYR 79 -1.164 2.205 -11.135 452 2HB TYR 79 1HB TYR 79 -1.426 3.083 -9.640 453 HD1 TYR 79 1HD TYR 79 -2.036 0.021 -11.446 454 HD2 TYR 79 2HD TYR 79 -3.387 2.387 -8.175 455 HE1 TYR 79 1HE TYR 79 -3.187 -1.939 -10.498 456 HE2 TYR 79 2HE TYR 79 -4.531 0.445 -7.229 457 HH TYR 79 HH TYR 79 -4.012 -2.727 -8.312 458 H VAL 80 H VAL 80 -1.672 3.056 -13.406 459 HA VAL 80 HA VAL 80 -4.195 2.285 -14.659 460 HB VAL 80 HB VAL 80 -1.601 3.141 -15.987 461 1HG1 VAL 80 1HG1 VAL 80 -2.914 3.211 -18.057 462 2HG1 VAL 80 2HG1 VAL 80 -4.324 2.618 -17.184 463 3HG1 VAL 80 3HG1 VAL 80 -2.907 1.588 -17.365 464 1HG2 VAL 80 1HG2 VAL 80 -2.817 5.192 -16.583 465 2HG2 VAL 80 2HG2 VAL 80 -2.681 4.993 -14.832 466 3HG2 VAL 80 3HG2 VAL 80 -4.199 4.615 -15.643 467 H HIS 81 H HIS 81 -4.494 0.258 -14.937 468 HA HIS 81 HA HIS 81 -2.236 -1.503 -15.507 469 1HB HIS 81 2HB HIS 81 -2.795 -1.563 -12.994 470 2HB HIS 81 1HB HIS 81 -4.358 -2.205 -13.479 471 HD1 HIS 81 1HD HIS 81 -0.830 -3.149 -12.928 472 HD2 HIS 81 2HD HIS 81 -4.299 -4.876 -14.416 473 HE1 HIS 81 1HE HIS 81 -0.361 -5.621 -13.036 474 HE2 HIS 81 2HE HIS 81 -2.513 -6.653 -13.863 475 H ASP 82 H ASP 82 -2.726 -2.780 -17.147 476 HA ASP 82 HA ASP 82 -3.783 -3.636 -18.974 477 1HB ASP 82 2HB ASP 82 -6.172 -3.841 -17.112 478 2HB ASP 82 1HB ASP 82 -6.113 -4.521 -18.728 479 H GLY 83 H GLY 83 -3.780 -0.812 -18.443 480 1HA GLY 83 2HA GLY 83 -4.437 0.989 -19.690 481 2HA GLY 83 1HA GLY 83 -5.585 -0.041 -20.535 482 H GLU 84 H GLU 84 -6.264 -0.530 -17.357 483 HA GLU 84 HA GLU 84 -8.410 1.454 -17.463 484 1HB GLU 84 2HB GLU 84 -8.947 -0.991 -17.142 485 2HB GLU 84 1HB GLU 84 -8.094 -0.926 -15.610 486 1HG GLU 84 2HG GLU 84 -9.642 0.660 -14.750 487 2HG GLU 84 1HG GLU 84 -10.521 0.715 -16.290 488 H ALA 85 H ALA 85 -8.746 2.827 -15.702 489 HA ALA 85 HA ALA 85 -6.419 3.283 -14.048 490 1HB ALA 85 1HB ALA 85 -9.118 4.673 -14.087 491 2HB ALA 85 2HB ALA 85 -7.663 5.232 -14.911 492 3HB ALA 85 3HB ALA 85 -7.718 5.183 -13.150 493 H LYS 86 H LYS 86 -6.179 2.171 -12.300 494 HA LYS 86 HA LYS 86 -8.488 0.714 -11.247 495 1HB LYS 86 2HB LYS 86 -5.595 0.234 -10.618 496 2HB LYS 86 1HB LYS 86 -6.955 -0.846 -10.376 497 1HG LYS 86 2HG LYS 86 -5.768 -0.037 -13.022 498 2HG LYS 86 1HG LYS 86 -5.553 -1.564 -12.157 499 1HD LYS 86 2HD LYS 86 -8.201 -0.552 -13.227 500 2HD LYS 86 1HD LYS 86 -7.140 -1.690 -14.062 501 1HE LYS 86 2HE LYS 86 -7.320 -3.220 -12.238 502 2HE LYS 86 1HE LYS 86 -8.424 -2.093 -11.388 503 1HZ LYS 86 1HZ LYS 86 -9.966 -2.385 -13.280 504 2HZ LYS 86 2HZ LYS 86 -9.637 -3.857 -12.515 505 3HZ LYS 86 3HZ LYS 86 -8.890 -3.479 -13.971 506 H VAL 87 H VAL 87 -8.981 0.884 -9.159 507 HA VAL 87 HA VAL 87 -7.562 2.946 -7.639 508 HB VAL 87 HB VAL 87 -10.490 2.159 -7.414 509 1HG1 VAL 87 1HG1 VAL 87 -8.978 4.402 -6.093 510 2HG1 VAL 87 2HG1 VAL 87 -9.583 2.941 -5.310 511 3HG1 VAL 87 3HG1 VAL 87 -10.715 4.119 -5.975 512 1HG2 VAL 87 1HG2 VAL 87 -9.278 4.638 -8.648 513 2HG2 VAL 87 2HG2 VAL 87 -10.999 4.356 -8.402 514 3HG2 VAL 87 3HG2 VAL 87 -10.090 3.338 -9.518 515 H ALA 88 H ALA 88 -6.810 2.320 -5.726 516 HA ALA 88 HA ALA 88 -7.407 -0.435 -4.890 517 1HB ALA 88 1HB ALA 88 -5.026 -0.019 -5.361 518 2HB ALA 88 2HB ALA 88 -5.293 -0.342 -3.647 519 3HB ALA 88 3HB ALA 88 -5.047 1.313 -4.197 520 H LYS 89 H LYS 89 -8.135 -0.803 -2.857 521 HA LYS 89 HA LYS 89 -9.004 1.582 -1.422 522 1HB LYS 89 2HB LYS 89 -10.397 -1.035 -1.880 523 2HB LYS 89 1HB LYS 89 -11.118 0.359 -1.102 524 1HG LYS 89 2HG LYS 89 -10.929 1.648 -3.187 525 2HG LYS 89 1HG LYS 89 -10.176 0.272 -3.974 526 1HD LYS 89 2HD LYS 89 -12.296 -1.001 -3.609 527 2HD LYS 89 1HD LYS 89 -13.008 0.478 -2.960 528 1HE LYS 89 2HE LYS 89 -13.592 0.161 -5.295 529 2HE LYS 89 1HE LYS 89 -12.612 1.610 -5.092 530 1HZ LYS 89 1HZ LYS 89 -11.603 -1.042 -6.067 531 2HZ LYS 89 2HZ LYS 89 -10.659 0.306 -5.935 532 3HZ LYS 89 3HZ LYS 89 -11.916 0.278 -7.050 533 H GLU 90 H GLU 90 -8.301 1.645 0.611 534 HA GLU 90 HA GLU 90 -7.149 -0.794 1.736 535 1HB GLU 90 2HB GLU 90 -5.322 0.593 2.553 536 2HB GLU 90 1HB GLU 90 -5.397 0.586 0.791 537 1HG GLU 90 2HG GLU 90 -6.537 2.745 0.827 538 2HG GLU 90 1HG GLU 90 -6.493 2.751 2.566 539 H ARG 91 H ARG 91 -6.724 -0.555 3.958 540 HA ARG 91 HA ARG 91 -8.255 1.390 5.507 541 1HB ARG 91 2HB ARG 91 -9.680 -0.432 5.727 542 2HB ARG 91 1HB ARG 91 -8.399 -1.601 5.519 543 1HG ARG 91 2HG ARG 91 -9.277 -1.789 7.743 544 2HG ARG 91 1HG ARG 91 -7.663 -1.120 7.844 545 1HD ARG 91 2HD ARG 91 -8.661 1.116 8.165 546 2HD ARG 91 1HD ARG 91 -10.270 0.375 8.126 547 HE ARG 91 HE ARG 91 -8.493 -0.862 10.003 548 1HH1 ARG 91 1HH1 ARG 91 -10.855 1.747 9.657 549 2HH1 ARG 91 2HH1 ARG 91 -11.138 1.891 11.322 550 1HH2 ARG 91 1HH2 ARG 91 -8.848 -0.660 12.241 551 2HH2 ARG 91 2HH2 ARG 91 -9.964 0.472 12.851 552 H ILE 92 H ILE 92 -6.753 2.411 6.708 553 HA ILE 92 HA ILE 92 -4.212 1.182 7.277 554 HB ILE 92 HB ILE 92 -5.474 3.764 8.222 555 1HG1 ILE 92 2HG1 ILE 92 -3.224 3.207 6.274 556 2HG1 ILE 92 1HG1 ILE 92 -4.816 3.851 5.888 557 1HG2 ILE 92 1HG2 ILE 92 -3.316 4.346 9.205 558 2HG2 ILE 92 2HG2 ILE 92 -2.722 2.724 8.822 559 3HG2 ILE 92 3HG2 ILE 92 -4.042 2.931 9.975 560 1HD1 ILE 92 1HD1 ILE 92 -2.704 5.227 7.545 561 2HD1 ILE 92 2HD1 ILE 92 -4.285 5.889 7.144 562 3HD1 ILE 92 3HD1 ILE 92 -3.103 5.599 5.865 563 H GLU 93 H GLU 93 -3.894 -0.157 8.841 564 HA GLU 93 HA GLU 93 -5.892 -0.170 10.977 565 1HB GLU 93 2HB GLU 93 -5.317 -2.247 9.573 566 2HB GLU 93 1HB GLU 93 -3.834 -2.313 10.516 567 1HG GLU 93 2HG GLU 93 -5.520 -3.783 11.429 568 2HG GLU 93 1HG GLU 93 -5.139 -2.481 12.564 569 H ALA 94 H ALA 94 -2.524 0.354 10.297 570 HA ALA 94 HA ALA 94 -2.087 1.568 12.847 571 1HB ALA 94 1HB ALA 94 -0.225 0.126 13.542 572 2HB ALA 94 2HB ALA 94 -0.537 -0.943 12.174 573 3HB ALA 94 3HB ALA 94 -1.731 -0.791 13.461 574 H VAL 95 H VAL 95 -0.387 3.021 12.751 575 HA VAL 95 HA VAL 95 1.385 2.938 10.416 576 HB VAL 95 HB VAL 95 -0.101 5.446 11.358 577 1HG1 VAL 95 1HG1 VAL 95 2.082 5.193 9.285 578 2HG1 VAL 95 2HG1 VAL 95 2.241 5.972 10.859 579 3HG1 VAL 95 3HG1 VAL 95 1.161 6.653 9.643 580 1HG2 VAL 95 1HG2 VAL 95 -0.018 4.159 8.651 581 2HG2 VAL 95 2HG2 VAL 95 -0.969 5.551 9.144 582 3HG2 VAL 95 3HG2 VAL 95 -1.335 3.973 9.833 583 H GLU 96 H GLU 96 3.381 2.946 11.069 584 HA GLU 96 HA GLU 96 4.157 4.329 13.550 585 1HB GLU 96 2HB GLU 96 5.527 2.177 11.959 586 2HB GLU 96 1HB GLU 96 6.235 3.000 13.316 587 1HG GLU 96 2HG GLU 96 3.770 1.283 13.458 588 2HG GLU 96 1HG GLU 96 5.409 0.778 13.882 589 HA PRO 97 HA PRO 97 5.899 7.024 10.303 590 1HB PRO 97 2HB PRO 97 6.505 8.780 12.587 591 2HB PRO 97 1HB PRO 97 5.532 9.119 11.152 592 1HG PRO 97 2HG PRO 97 4.413 8.814 13.569 593 2HG PRO 97 1HG PRO 97 3.605 8.270 12.089 594 1HD PRO 97 2HD PRO 97 5.114 6.669 14.124 595 2HD PRO 97 1HD PRO 97 3.588 6.294 13.286 596 H ASP 98 H ASP 98 7.285 6.332 13.481 597 HA ASP 98 HA ASP 98 9.935 6.975 12.590 598 1HB ASP 98 2HB ASP 98 9.388 7.506 14.876 599 2HB ASP 98 1HB ASP 98 8.971 5.835 15.217 600 H LYS 99 H LYS 99 8.102 4.062 13.156 601 HA LYS 99 HA LYS 99 10.431 2.401 12.691 602 1HB LYS 99 2HB LYS 99 7.567 1.574 13.028 603 2HB LYS 99 1HB LYS 99 8.955 0.506 12.942 604 1HG LYS 99 2HG LYS 99 9.895 1.569 14.927 605 2HG LYS 99 1HG LYS 99 8.442 2.570 15.048 606 1HD LYS 99 2HD LYS 99 7.104 0.513 15.138 607 2HD LYS 99 1HD LYS 99 8.639 -0.379 15.123 608 1HE LYS 99 2HE LYS 99 7.756 -0.136 17.425 609 2HE LYS 99 1HE LYS 99 9.319 0.657 17.175 610 1HZ LYS 99 1HZ LYS 99 7.667 2.032 18.434 611 2HZ LYS 99 2HZ LYS 99 6.748 2.137 17.001 612 3HZ LYS 99 3HZ LYS 99 8.296 2.752 17.060 613 H ASN 100 H ASN 100 8.300 4.043 10.737 614 HA ASN 100 HA ASN 100 7.740 4.036 8.533 615 1HB ASN 100 2HB ASN 100 10.080 2.121 8.291 616 2HB ASN 100 1HB ASN 100 9.303 2.951 6.954 617 1HD2 ASN 100 1HD2 ASN 100 12.034 2.980 7.841 618 2HD2 ASN 100 2HD2 ASN 100 12.443 4.633 8.171 619 H LEU 101 H LEU 101 6.231 2.380 10.077 620 HA LEU 101 HA LEU 101 5.859 -0.097 8.492 621 1HB LEU 101 2HB LEU 101 6.591 -0.609 10.749 622 2HB LEU 101 1HB LEU 101 5.354 0.419 11.430 623 HG LEU 101 HG LEU 101 3.666 -1.113 10.366 624 1HD1 LEU 101 1HD1 LEU 101 6.049 -2.885 10.060 625 2HD1 LEU 101 2HD1 LEU 101 5.019 -2.205 8.783 626 3HD1 LEU 101 3HD1 LEU 101 4.358 -3.377 9.920 627 1HD2 LEU 101 1HD2 LEU 101 3.782 -2.724 12.165 628 2HD2 LEU 101 2HD2 LEU 101 4.076 -1.082 12.719 629 3HD2 LEU 101 3HD2 LEU 101 5.438 -2.200 12.544 630 H ILE 102 H ILE 102 3.838 -0.407 7.663 631 HA ILE 102 HA ILE 102 1.628 0.940 8.900 632 HB ILE 102 HB ILE 102 2.505 2.533 7.257 633 1HG1 ILE 102 2HG1 ILE 102 0.049 2.502 7.737 634 2HG1 ILE 102 1HG1 ILE 102 0.428 3.209 6.172 635 1HG2 ILE 102 1HG2 ILE 102 2.327 2.117 4.811 636 2HG2 ILE 102 2HG2 ILE 102 1.931 0.445 5.194 637 3HG2 ILE 102 3HG2 ILE 102 3.496 1.089 5.633 638 1HD1 ILE 102 1HD1 ILE 102 -0.320 1.096 5.144 639 2HD1 ILE 102 2HD1 ILE 102 -1.576 1.867 6.114 640 3HD1 ILE 102 3HD1 ILE 102 -0.698 0.478 6.752 641 H THR 103 H THR 103 0.008 -0.287 8.975 642 HA THR 103 HA THR 103 -0.008 -2.885 7.581 643 HB THR 103 HB THR 103 -1.708 -1.933 9.897 644 HG1 THR 103 1HG THR 103 0.871 -2.563 9.719 645 1HG2 THR 103 1HG2 THR 103 -2.056 -4.341 10.290 646 2HG2 THR 103 2HG2 THR 103 -1.077 -4.714 8.871 647 3HG2 THR 103 3HG2 THR 103 -2.620 -3.882 8.681 648 H PHE 104 H PHE 104 -1.282 -3.081 5.750 649 HA PHE 104 HA PHE 104 -3.629 -1.347 5.425 650 1HB PHE 104 2HB PHE 104 -2.139 -3.038 3.382 651 2HB PHE 104 1HB PHE 104 -3.531 -2.084 2.999 652 HD1 PHE 104 1HD PHE 104 -3.328 0.441 3.210 653 HD2 PHE 104 2HD PHE 104 -0.010 -2.207 3.331 654 HE1 PHE 104 1HE PHE 104 -1.833 2.292 2.588 655 HE2 PHE 104 2HE PHE 104 1.485 -0.365 2.717 656 HZ PHE 104 HZ PHE 104 0.595 1.874 2.346 657 H ARG 105 H ARG 105 -5.576 -2.223 5.255 658 HA ARG 105 HA ARG 105 -5.910 -5.164 5.252 659 1HB ARG 105 2HB ARG 105 -6.349 -4.029 7.453 660 2HB ARG 105 1HB ARG 105 -7.539 -3.021 6.681 661 1HG ARG 105 2HG ARG 105 -7.768 -6.017 6.944 662 2HG ARG 105 1HG ARG 105 -8.398 -4.879 8.119 663 1HD ARG 105 2HD ARG 105 -9.851 -3.930 6.265 664 2HD ARG 105 1HD ARG 105 -9.299 -5.238 5.245 665 HE ARG 105 HE ARG 105 -10.166 -6.264 7.721 666 1HH1 ARG 105 1HH1 ARG 105 -11.520 -5.167 4.635 667 2HH1 ARG 105 2HH1 ARG 105 -13.014 -5.947 4.850 668 1HH2 ARG 105 1HH2 ARG 105 -12.181 -7.377 7.988 669 2HH2 ARG 105 2HH2 ARG 105 -13.377 -7.251 6.792 670 H VAL 106 H VAL 106 -7.243 -5.861 3.508 671 HA VAL 106 HA VAL 106 -7.960 -3.799 1.665 672 HB VAL 106 HB VAL 106 -7.178 -6.054 0.868 673 1HG1 VAL 106 1HG1 VAL 106 -8.737 -7.895 0.777 674 2HG1 VAL 106 2HG1 VAL 106 -9.852 -7.002 1.805 675 3HG1 VAL 106 3HG1 VAL 106 -8.276 -7.478 2.439 676 1HG2 VAL 106 1HG2 VAL 106 -8.335 -4.604 -0.687 677 2HG2 VAL 106 2HG2 VAL 106 -9.887 -5.153 -0.074 678 3HG2 VAL 106 3HG2 VAL 106 -8.860 -6.274 -0.962 679 H ILE 107 H ILE 107 -9.832 -2.908 1.291 680 HA ILE 107 HA ILE 107 -12.130 -3.816 2.873 681 HB ILE 107 HB ILE 107 -13.064 -1.545 2.485 682 1HG1 ILE 107 2HG1 ILE 107 -10.376 -1.111 1.214 683 2HG1 ILE 107 1HG1 ILE 107 -11.939 -1.085 0.407 684 1HG2 ILE 107 1HG2 ILE 107 -11.511 -0.371 3.984 685 2HG2 ILE 107 2HG2 ILE 107 -10.299 -1.610 3.686 686 3HG2 ILE 107 3HG2 ILE 107 -11.789 -2.029 4.544 687 1HD1 ILE 107 1HD1 ILE 107 -12.554 0.845 1.609 688 2HD1 ILE 107 2HD1 ILE 107 -10.939 1.032 0.818 689 3HD1 ILE 107 3HD1 ILE 107 -11.027 0.696 2.551 690 H GLU 108 H GLU 108 -10.971 -3.098 -0.279 691 HA GLU 108 HA GLU 108 -13.318 -3.216 -1.781 692 1HB GLU 108 2HB GLU 108 -11.326 -2.399 -2.775 693 2HB GLU 108 1HB GLU 108 -10.462 -3.889 -2.481 694 1HG GLU 108 2HG GLU 108 -11.782 -5.022 -4.104 695 2HG GLU 108 1HG GLU 108 -12.823 -3.618 -4.343 696 H GLY 109 H GLY 109 -14.544 -4.832 -2.608 697 1HA GLY 109 2HA GLY 109 -14.247 -7.403 -1.373 698 2HA GLY 109 1HA GLY 109 -15.584 -6.871 -2.372 699 H ASP 110 H ASP 110 -13.009 -6.103 -4.126 700 HA ASP 110 HA ASP 110 -13.329 -8.181 -6.007 701 1HB ASP 110 2HB ASP 110 -12.454 -6.020 -6.708 702 2HB ASP 110 1HB ASP 110 -11.017 -6.259 -5.719 703 H LEU 111 H LEU 111 -10.722 -7.591 -3.684 704 HA LEU 111 HA LEU 111 -9.399 -10.058 -4.257 705 1HB LEU 111 2HB LEU 111 -9.150 -8.283 -1.813 706 2HB LEU 111 1HB LEU 111 -8.071 -9.601 -2.210 707 HG LEU 111 HG LEU 111 -8.383 -7.006 -3.730 708 1HD1 LEU 111 1HD1 LEU 111 -6.059 -6.620 -3.090 709 2HD1 LEU 111 2HD1 LEU 111 -6.073 -8.107 -2.151 710 3HD1 LEU 111 3HD1 LEU 111 -7.101 -6.754 -1.681 711 1HD2 LEU 111 1HD2 LEU 111 -7.972 -8.783 -5.307 712 2HD2 LEU 111 2HD2 LEU 111 -6.627 -9.383 -4.339 713 3HD2 LEU 111 3HD2 LEU 111 -6.516 -7.808 -5.127 714 H MET 112 H MET 112 -12.012 -9.136 -2.337 715 HA MET 112 HA MET 112 -12.024 -11.358 -0.516 716 1HB MET 112 2HB MET 112 -14.227 -9.507 -1.309 717 2HB MET 112 1HB MET 112 -14.301 -10.668 -0.004 718 1HG MET 112 2HG MET 112 -12.378 -8.323 -0.048 719 2HG MET 112 1HG MET 112 -13.967 -8.244 0.687 720 1HE MET 112 1HE MET 112 -10.844 -10.913 0.825 721 2HE MET 112 2HE MET 112 -10.347 -10.562 2.459 722 3HE MET 112 3HE MET 112 -10.163 -9.325 1.224 723 H LYS 113 H LYS 113 -12.607 -11.252 -3.801 724 HA LYS 113 HA LYS 113 -14.842 -13.069 -3.848 725 1HB LYS 113 2HB LYS 113 -12.886 -12.426 -6.053 726 2HB LYS 113 1HB LYS 113 -14.427 -13.236 -6.252 727 1HG LYS 113 2HG LYS 113 -14.016 -10.372 -5.406 728 2HG LYS 113 1HG LYS 113 -14.569 -10.924 -6.984 729 1HD LYS 113 2HD LYS 113 -16.577 -11.872 -5.936 730 2HD LYS 113 1HD LYS 113 -16.003 -11.323 -4.363 731 1HE LYS 113 2HE LYS 113 -17.649 -9.770 -5.245 732 2HE LYS 113 1HE LYS 113 -16.071 -9.005 -5.133 733 1HZ LYS 113 1HZ LYS 113 -17.173 -8.461 -7.190 734 2HZ LYS 113 2HZ LYS 113 -17.300 -10.081 -7.619 735 3HZ LYS 113 3HZ LYS 113 -15.784 -9.330 -7.534 736 H GLU 114 H GLU 114 -11.479 -13.276 -3.601 737 HA GLU 114 HA GLU 114 -11.723 -16.190 -3.656 738 1HB GLU 114 2HB GLU 114 -9.250 -16.300 -4.240 739 2HB GLU 114 1HB GLU 114 -10.380 -15.940 -5.540 740 1HG GLU 114 2HG GLU 114 -8.747 -13.889 -4.067 741 2HG GLU 114 1HG GLU 114 -8.205 -14.688 -5.536 742 H TYR 115 H TYR 115 -10.415 -13.487 -1.977 743 HA TYR 115 HA TYR 115 -9.428 -15.375 0.023 744 1HB TYR 115 2HB TYR 115 -8.802 -12.421 -0.177 745 2HB TYR 115 1HB TYR 115 -7.994 -13.625 0.821 746 HD1 TYR 115 1HD TYR 115 -7.933 -11.852 -2.220 747 HD2 TYR 115 2HD TYR 115 -6.745 -15.561 -0.493 748 HE1 TYR 115 1HE TYR 115 -6.329 -12.194 -4.039 749 HE2 TYR 115 2HE TYR 115 -5.156 -15.886 -2.286 750 HH TYR 115 HH TYR 115 -4.265 -13.446 -4.423 751 H LYS 116 H LYS 116 -10.357 -15.283 1.959 752 HA LYS 116 HA LYS 116 -12.700 -13.564 2.156 753 1HB LYS 116 2HB LYS 116 -13.250 -15.015 4.162 754 2HB LYS 116 1HB LYS 116 -13.272 -15.813 2.597 755 1HG LYS 116 2HG LYS 116 -10.912 -16.555 3.116 756 2HG LYS 116 1HG LYS 116 -11.204 -15.998 4.766 757 1HD LYS 116 2HD LYS 116 -12.817 -18.055 3.272 758 2HD LYS 116 1HD LYS 116 -11.591 -18.430 4.483 759 1HE LYS 116 2HE LYS 116 -12.959 -17.196 6.148 760 2HE LYS 116 1HE LYS 116 -14.185 -16.947 4.904 761 1HZ LYS 116 1HZ LYS 116 -14.724 -18.844 6.295 762 2HZ LYS 116 2HZ LYS 116 -13.262 -19.580 5.913 763 3HZ LYS 116 3HZ LYS 116 -14.423 -19.363 4.725 764 H SER 117 H SER 117 -9.661 -13.252 2.807 765 HA SER 117 HA SER 117 -9.967 -10.930 4.339 766 1HB SER 117 2HB SER 117 -10.238 -12.507 6.105 767 2HB SER 117 1HB SER 117 -8.697 -13.298 5.708 768 HG SER 117 HG SER 117 -8.729 -11.700 7.484 769 H PHE 118 H PHE 118 -8.166 -9.652 3.991 770 HA PHE 118 HA PHE 118 -5.679 -10.878 3.184 771 1HB PHE 118 2HB PHE 118 -6.870 -10.546 1.010 772 2HB PHE 118 1HB PHE 118 -7.136 -8.875 1.431 773 HD1 PHE 118 1HD PHE 118 -4.431 -11.317 0.698 774 HD2 PHE 118 2HD PHE 118 -5.588 -7.232 0.835 775 HE1 PHE 118 1HE PHE 118 -2.348 -10.694 -0.412 776 HE2 PHE 118 2HE PHE 118 -3.497 -6.610 -0.293 777 HZ PHE 118 HZ PHE 118 -1.873 -8.342 -0.914 778 H LEU 119 H LEU 119 -4.296 -10.036 4.515 779 HA LEU 119 HA LEU 119 -4.490 -7.196 5.246 780 1HB LEU 119 2HB LEU 119 -5.009 -8.792 7.079 781 2HB LEU 119 1HB LEU 119 -3.459 -9.561 6.830 782 HG LEU 119 HG LEU 119 -2.372 -7.398 7.473 783 1HD1 LEU 119 1HD1 LEU 119 -3.722 -5.776 8.717 784 2HD1 LEU 119 2HD1 LEU 119 -5.179 -6.645 8.251 785 3HD1 LEU 119 3HD1 LEU 119 -4.179 -5.870 7.018 786 1HD2 LEU 119 1HD2 LEU 119 -2.761 -7.695 9.868 787 2HD2 LEU 119 2HD2 LEU 119 -2.579 -9.244 9.045 788 3HD2 LEU 119 3HD2 LEU 119 -4.183 -8.680 9.515 789 H LEU 120 H LEU 120 -2.653 -6.074 4.699 790 HA LEU 120 HA LEU 120 -0.229 -7.607 4.291 791 1HB LEU 120 2HB LEU 120 0.355 -6.478 2.225 792 2HB LEU 120 1HB LEU 120 -1.159 -7.325 2.041 793 HG LEU 120 HG LEU 120 -0.896 -4.334 2.418 794 1HD1 LEU 120 1HD1 LEU 120 -1.377 -4.162 0.058 795 2HD1 LEU 120 2HD1 LEU 120 -1.383 -5.924 -0.091 796 3HD1 LEU 120 3HD1 LEU 120 0.102 -5.079 0.341 797 1HD2 LEU 120 1HD2 LEU 120 -3.074 -5.170 3.141 798 2HD2 LEU 120 2HD2 LEU 120 -3.262 -6.044 1.620 799 3HD2 LEU 120 3HD2 LEU 120 -3.234 -4.282 1.628 800 H THR 121 H THR 121 1.365 -6.803 5.288 801 HA THR 121 HA THR 121 1.154 -4.016 6.184 802 HB THR 121 HB THR 121 2.610 -6.291 7.547 803 HG1 THR 121 1HG THR 121 0.336 -6.586 7.544 804 1HG2 THR 121 1HG2 THR 121 3.450 -4.040 8.032 805 2HG2 THR 121 2HG2 THR 121 2.637 -4.731 9.443 806 3HG2 THR 121 3HG2 THR 121 1.830 -3.516 8.452 807 H ILE 122 H ILE 122 2.802 -2.682 5.583 808 HA ILE 122 HA ILE 122 5.191 -3.988 4.510 809 HB ILE 122 HB ILE 122 5.543 -2.132 2.995 810 1HG1 ILE 122 2HG1 ILE 122 2.924 -1.015 3.956 811 2HG1 ILE 122 1HG1 ILE 122 4.511 -0.376 4.355 812 1HG2 ILE 122 1HG2 ILE 122 4.185 -3.982 2.172 813 2HG2 ILE 122 2HG2 ILE 122 3.626 -2.455 1.479 814 3HG2 ILE 122 3HG2 ILE 122 2.732 -3.198 2.799 815 1HD1 ILE 122 1HD1 ILE 122 3.340 -0.521 1.577 816 2HD1 ILE 122 2HD1 ILE 122 4.927 0.115 1.999 817 3HD1 ILE 122 3HD1 ILE 122 3.471 0.930 2.576 818 H GLN 123 H GLN 123 7.137 -3.103 5.007 819 HA GLN 123 HA GLN 123 7.164 -0.742 6.676 820 1HB GLN 123 2HB GLN 123 7.033 -2.704 8.199 821 2HB GLN 123 1HB GLN 123 8.517 -3.308 7.488 822 1HG GLN 123 2HG GLN 123 9.759 -1.451 8.315 823 2HG GLN 123 1HG GLN 123 8.291 -0.654 8.880 824 1HE2 GLN 123 1HE2 GLN 123 8.930 -0.554 10.975 825 2HE2 GLN 123 2HE2 GLN 123 9.060 -1.932 12.002 826 H VAL 124 H VAL 124 8.746 0.527 6.128 827 HA VAL 124 HA VAL 124 10.660 -0.481 4.167 828 HB VAL 124 HB VAL 124 10.054 2.382 4.972 829 1HG1 VAL 124 1HG1 VAL 124 11.346 3.003 2.998 830 2HG1 VAL 124 2HG1 VAL 124 11.719 1.305 2.701 831 3HG1 VAL 124 3HG1 VAL 124 12.340 2.106 4.148 832 1HG2 VAL 124 1HG2 VAL 124 8.175 1.341 3.842 833 2HG2 VAL 124 2HG2 VAL 124 9.235 0.807 2.536 834 3HG2 VAL 124 3HG2 VAL 124 8.943 2.527 2.791 835 H THR 125 H THR 125 12.458 -1.172 4.926 836 HA THR 125 HA THR 125 13.512 0.021 7.379 837 HB THR 125 HB THR 125 13.779 -2.801 6.326 838 HG1 THR 125 1HG THR 125 12.158 -1.571 8.289 839 1HG2 THR 125 1HG2 THR 125 14.707 -3.299 8.523 840 2HG2 THR 125 2HG2 THR 125 14.619 -1.590 8.968 841 3HG2 THR 125 3HG2 THR 125 15.714 -2.118 7.680 842 HA PRO 126 HA PRO 126 16.997 0.946 4.731 843 1HB PRO 126 2HB PRO 126 18.689 1.867 6.668 844 2HB PRO 126 1HB PRO 126 17.385 2.850 5.999 845 1HG PRO 126 2HG PRO 126 17.482 1.345 8.572 846 2HG PRO 126 1HG PRO 126 16.761 2.926 8.225 847 1HD PRO 126 2HD PRO 126 15.323 0.608 8.437 848 2HD PRO 126 1HD PRO 126 14.803 1.999 7.467 849 H LYS 127 H LYS 127 17.276 -1.176 4.282 850 HA LYS 127 HA LYS 127 18.693 -2.844 6.123 851 1HB LYS 127 2HB LYS 127 16.780 -3.798 5.067 852 2HB LYS 127 1HB LYS 127 17.352 -3.463 3.466 853 1HG LYS 127 2HG LYS 127 19.108 -5.125 3.760 854 2HG LYS 127 1HG LYS 127 18.542 -5.429 5.408 855 1HD LYS 127 2HD LYS 127 16.355 -6.081 4.545 856 2HD LYS 127 1HD LYS 127 16.859 -5.794 2.908 857 1HE LYS 127 2HE LYS 127 18.084 -7.816 4.793 858 2HE LYS 127 1HE LYS 127 16.954 -8.189 3.498 859 1HZ LYS 127 1HZ LYS 127 19.266 -8.627 2.872 860 2HZ LYS 127 2HZ LYS 127 19.668 -7.018 3.114 861 3HZ LYS 127 3HZ LYS 127 18.604 -7.444 1.889 862 HA PRO 128 HA PRO 128 22.129 -2.725 2.820 863 1HB PRO 128 2HB PRO 128 21.443 -0.592 0.918 864 2HB PRO 128 1HB PRO 128 21.936 -2.255 0.577 865 1HG PRO 128 2HG PRO 128 19.433 -1.397 0.134 866 2HG PRO 128 1HG PRO 128 19.761 -3.050 0.685 867 1HD PRO 128 2HD PRO 128 18.880 -0.662 2.271 868 2HD PRO 128 1HD PRO 128 18.278 -2.332 2.322 869 H GLY 129 H GLY 129 20.688 0.565 2.671 870 1HA GLY 129 2HA GLY 129 21.847 1.707 4.838 871 2HA GLY 129 1HA GLY 129 23.127 1.735 3.638 872 H GLY 130 H GLY 130 20.421 3.307 4.863 873 1HA GLY 130 2HA GLY 130 19.337 5.234 4.350 874 2HA GLY 130 1HA GLY 130 20.797 5.681 3.496 875 HA PRO 131 HA PRO 131 18.031 5.965 -0.039 876 1HB PRO 131 2HB PRO 131 20.051 6.192 -1.923 877 2HB PRO 131 1HB PRO 131 19.387 7.549 -1.011 878 1HG PRO 131 2HG PRO 131 21.870 5.966 -0.517 879 2HG PRO 131 1HG PRO 131 21.599 7.711 -0.349 880 1HD PRO 131 2HD PRO 131 21.677 6.083 1.771 881 2HD PRO 131 1HD PRO 131 20.575 7.477 1.718 882 H GLY 132 H GLY 132 17.108 4.147 -0.576 883 1HA GLY 132 2HA GLY 132 17.078 2.260 -2.002 884 2HA GLY 132 1HA GLY 132 18.789 2.014 -1.613 885 H SER 133 H SER 133 15.667 2.284 -0.038 886 HA SER 133 HA SER 133 16.653 0.478 2.016 887 1HB SER 133 2HB SER 133 14.231 2.278 1.968 888 2HB SER 133 1HB SER 133 14.672 1.215 3.307 889 HG SER 133 HG SER 133 16.646 2.972 2.363 890 H ILE 134 H ILE 134 15.102 -1.176 2.812 891 HA ILE 134 HA ILE 134 13.990 -2.473 0.472 892 HB ILE 134 HB ILE 134 15.027 -3.605 3.059 893 1HG1 ILE 134 2HG1 ILE 134 16.649 -2.809 1.449 894 2HG1 ILE 134 1HG1 ILE 134 16.715 -4.575 1.598 895 1HG2 ILE 134 1HG2 ILE 134 14.594 -5.829 2.106 896 2HG2 ILE 134 2HG2 ILE 134 13.810 -5.076 0.717 897 3HG2 ILE 134 3HG2 ILE 134 13.088 -4.925 2.317 898 1HD1 ILE 134 1HD1 ILE 134 15.572 -2.934 -0.632 899 2HD1 ILE 134 2HD1 ILE 134 15.415 -4.689 -0.476 900 3HD1 ILE 134 3HD1 ILE 134 17.006 -3.957 -0.643 901 H VAL 135 H VAL 135 11.918 -2.900 0.464 902 HA VAL 135 HA VAL 135 10.270 -2.146 2.791 903 HB VAL 135 HB VAL 135 9.185 -3.003 0.121 904 1HG1 VAL 135 1HG1 VAL 135 7.588 -2.961 1.897 905 2HG1 VAL 135 2HG1 VAL 135 7.242 -1.655 0.763 906 3HG1 VAL 135 3HG1 VAL 135 8.025 -1.300 2.304 907 1HG2 VAL 135 1HG2 VAL 135 9.000 -0.700 -0.546 908 2HG2 VAL 135 2HG2 VAL 135 10.678 -1.212 -0.372 909 3HG2 VAL 135 3HG2 VAL 135 9.943 -0.182 0.871 910 H HIS 136 H HIS 136 9.748 -3.736 4.077 911 HA HIS 136 HA HIS 136 9.809 -6.460 3.055 912 1HB HIS 136 2HB HIS 136 9.418 -5.397 5.872 913 2HB HIS 136 1HB HIS 136 9.449 -7.114 5.466 914 HD1 HIS 136 1HD HIS 136 11.846 -8.056 4.722 915 HD2 HIS 136 2HD HIS 136 11.819 -4.168 6.203 916 HE1 HIS 136 1HE HIS 136 14.224 -7.515 5.231 917 HE2 HIS 136 2HE HIS 136 14.071 -5.419 6.530 918 H TRP 137 H TRP 137 8.026 -7.125 2.062 919 HA TRP 137 HA TRP 137 5.453 -6.020 2.839 920 1HB TRP 137 2HB TRP 137 6.297 -7.705 0.466 921 2HB TRP 137 1HB TRP 137 4.659 -7.278 0.838 922 HD1 TRP 137 HD TRP 137 7.989 -5.284 -0.025 923 HE1 TRP 137 1HE TRP 137 7.269 -3.256 -1.335 924 HE3 TRP 137 3HE TRP 137 2.886 -5.905 0.175 925 HZ2 TRP 137 2HZ TRP 137 4.890 -2.010 -2.194 926 HZ3 TRP 137 3HZ TRP 137 1.478 -4.221 -0.931 927 HH2 TRP 137 HH TRP 137 2.446 -2.334 -2.074 928 H HIS 138 H HIS 138 4.215 -7.100 4.157 929 HA HIS 138 HA HIS 138 4.521 -10.028 4.370 930 1HB HIS 138 2HB HIS 138 3.239 -8.076 6.297 931 2HB HIS 138 1HB HIS 138 3.355 -9.799 6.543 932 HD1 HIS 138 1HD HIS 138 5.642 -10.713 7.339 933 HD2 HIS 138 2HD HIS 138 5.477 -6.621 6.760 934 HE1 HIS 138 1HE HIS 138 7.690 -9.794 8.460 935 HE2 HIS 138 2HE HIS 138 7.382 -7.319 8.363 936 H LEU 139 H LEU 139 2.987 -10.943 3.046 937 HA LEU 139 HA LEU 139 0.368 -9.650 3.070 938 1HB LEU 139 2HB LEU 139 1.486 -11.638 1.072 939 2HB LEU 139 1HB LEU 139 -0.108 -10.935 1.009 940 HG LEU 139 HG LEU 139 1.088 -8.677 0.709 941 1HD1 LEU 139 1HD1 LEU 139 3.293 -9.268 1.408 942 2HD1 LEU 139 2HD1 LEU 139 3.299 -8.710 -0.268 943 3HD1 LEU 139 3HD1 LEU 139 3.430 -10.431 0.090 944 1HD2 LEU 139 1HD2 LEU 139 1.316 -10.773 -1.439 945 2HD2 LEU 139 2HD2 LEU 139 1.366 -9.029 -1.698 946 3HD2 LEU 139 3HD2 LEU 139 -0.105 -9.791 -1.085 947 H GLU 140 H GLU 140 -1.126 -10.657 4.206 948 HA GLU 140 HA GLU 140 -0.883 -13.536 4.591 949 1HB GLU 140 2HB GLU 140 -1.502 -11.468 6.716 950 2HB GLU 140 1HB GLU 140 -1.585 -13.213 6.942 951 1HG GLU 140 2HG GLU 140 0.788 -13.418 6.519 952 2HG GLU 140 1HG GLU 140 0.899 -11.696 6.194 953 H TYR 141 H TYR 141 -2.703 -14.532 4.199 954 HA TYR 141 HA TYR 141 -5.193 -13.132 4.244 955 1HB TYR 141 2HB TYR 141 -5.622 -13.615 1.794 956 2HB TYR 141 1HB TYR 141 -4.493 -12.327 2.215 957 HD1 TYR 141 1HD TYR 141 -2.127 -12.505 1.663 958 HD2 TYR 141 2HD TYR 141 -4.809 -15.661 0.751 959 HE1 TYR 141 1HE TYR 141 -0.408 -13.534 0.236 960 HE2 TYR 141 2HE TYR 141 -3.137 -16.679 -0.688 961 HH TYR 141 HH TYR 141 0.147 -15.734 -0.650 962 H GLU 142 H GLU 142 -6.964 -14.504 3.422 963 HA GLU 142 HA GLU 142 -6.537 -17.287 4.335 964 1HB GLU 142 2HB GLU 142 -7.745 -15.654 5.871 965 2HB GLU 142 1HB GLU 142 -8.997 -15.565 4.649 966 1HG GLU 142 2HG GLU 142 -9.723 -17.060 6.335 967 2HG GLU 142 1HG GLU 142 -9.312 -18.022 4.917 968 H LYS 143 H LYS 143 -7.114 -18.762 2.720 969 HA LYS 143 HA LYS 143 -8.278 -17.814 0.254 970 1HB LYS 143 2HB LYS 143 -7.371 -20.553 1.151 971 2HB LYS 143 1HB LYS 143 -8.277 -20.332 -0.321 972 1HG LYS 143 2HG LYS 143 -5.901 -20.575 -0.742 973 2HG LYS 143 1HG LYS 143 -6.478 -18.998 -1.251 974 1HD LYS 143 2HD LYS 143 -5.490 -17.978 0.685 975 2HD LYS 143 1HD LYS 143 -5.053 -19.561 1.339 976 1HE LYS 143 2HE LYS 143 -4.054 -18.506 -1.306 977 2HE LYS 143 1HE LYS 143 -3.178 -18.323 0.208 978 1HZ LYS 143 1HZ LYS 143 -2.350 -20.198 -1.003 979 2HZ LYS 143 2HZ LYS 143 -3.889 -20.924 -1.052 980 3HZ LYS 143 3HZ LYS 143 -3.086 -20.709 0.408 981 H ILE 144 H ILE 144 -10.380 -17.932 -0.328 982 HA ILE 144 HA ILE 144 -12.342 -19.235 1.353 983 HB ILE 144 HB ILE 144 -12.568 -18.272 -1.527 984 1HG1 ILE 144 2HG1 ILE 144 -13.436 -16.914 1.002 985 2HG1 ILE 144 1HG1 ILE 144 -11.986 -16.483 0.094 986 1HG2 ILE 144 1HG2 ILE 144 -14.697 -18.949 0.494 987 2HG2 ILE 144 2HG2 ILE 144 -14.293 -19.892 -0.948 988 3HG2 ILE 144 3HG2 ILE 144 -14.980 -18.266 -1.109 989 1HD1 ILE 144 1HD1 ILE 144 -13.774 -14.965 -0.385 990 2HD1 ILE 144 2HD1 ILE 144 -14.828 -16.317 -0.853 991 3HD1 ILE 144 3HD1 ILE 144 -13.390 -15.951 -1.816 992 H SER 145 H SER 145 -10.752 -19.685 -1.682 993 HA SER 145 HA SER 145 -10.734 -22.519 -1.415 994 1HB SER 145 2HB SER 145 -12.789 -22.061 -2.751 995 2HB SER 145 1HB SER 145 -11.831 -21.091 -3.866 996 HG SER 145 HG SER 145 -12.343 -23.463 -4.281 997 H GLU 146 H GLU 146 -9.007 -23.312 -2.767 998 HA GLU 146 HA GLU 146 -6.799 -21.465 -2.673 999 1HB GLU 146 2HB GLU 146 -6.997 -24.235 -3.601 1000 2HB GLU 146 1HB GLU 146 -5.484 -23.395 -3.255 1001 1HG GLU 146 2HG GLU 146 -6.242 -23.136 -0.887 1002 2HG GLU 146 1HG GLU 146 -7.648 -24.113 -1.281 1003 H GLU 147 H GLU 147 -8.303 -23.490 -5.128 1004 HA GLU 147 HA GLU 147 -6.682 -22.675 -7.274 1005 1HB GLU 147 2HB GLU 147 -8.432 -23.673 -8.698 1006 2HB GLU 147 1HB GLU 147 -7.963 -24.722 -7.369 1007 1HG GLU 147 2HG GLU 147 -9.969 -24.075 -6.134 1008 2HG GLU 147 1HG GLU 147 -10.424 -22.991 -7.446 1009 H VAL 148 H VAL 148 -9.206 -21.186 -5.700 1010 HA VAL 148 HA VAL 148 -9.970 -19.511 -7.970 1011 HB VAL 148 HB VAL 148 -10.977 -19.159 -5.083 1012 1HG1 VAL 148 1HG1 VAL 148 -12.172 -18.262 -7.686 1013 2HG1 VAL 148 2HG1 VAL 148 -11.301 -17.228 -6.557 1014 3HG1 VAL 148 3HG1 VAL 148 -12.809 -17.989 -6.067 1015 1HG2 VAL 148 1HG2 VAL 148 -12.175 -20.738 -7.359 1016 2HG2 VAL 148 2HG2 VAL 148 -12.911 -20.457 -5.780 1017 3HG2 VAL 148 3HG2 VAL 148 -11.435 -21.417 -5.910 1018 H ALA 149 H ALA 149 -7.729 -19.455 -5.442 1019 HA ALA 149 HA ALA 149 -7.441 -16.619 -5.175 1020 1HB ALA 149 1HB ALA 149 -6.913 -18.130 -3.328 1021 2HB ALA 149 2HB ALA 149 -5.499 -17.175 -3.796 1022 3HB ALA 149 3HB ALA 149 -5.633 -18.859 -4.292 1023 H HIS 150 H HIS 150 -5.194 -15.626 -5.490 1024 HA HIS 150 HA HIS 150 -3.585 -16.662 -7.573 1025 1HB HIS 150 2HB HIS 150 -3.891 -14.770 -9.189 1026 2HB HIS 150 1HB HIS 150 -5.238 -15.884 -9.112 1027 HD1 HIS 150 1HD HIS 150 -5.920 -13.318 -10.400 1028 HD2 HIS 150 2HD HIS 150 -6.049 -13.682 -6.260 1029 HE1 HIS 150 1HE HIS 150 -7.448 -11.518 -9.621 1030 HE2 HIS 150 2HE HIS 150 -7.697 -11.880 -7.183 1031 HA PRO 151 HA PRO 151 -1.107 -14.166 -4.592 1032 1HB PRO 151 2HB PRO 151 0.750 -16.289 -5.563 1033 2HB PRO 151 1HB PRO 151 0.536 -15.653 -3.928 1034 1HG PRO 151 2HG PRO 151 -0.449 -18.020 -4.555 1035 2HG PRO 151 1HG PRO 151 -1.388 -16.899 -3.553 1036 1HD PRO 151 2HD PRO 151 -1.751 -17.608 -6.437 1037 2HD PRO 151 1HD PRO 151 -2.951 -17.272 -5.167 1038 H GLU 152 H GLU 152 -0.687 -15.358 -7.801 1039 HA GLU 152 HA GLU 152 1.506 -14.052 -8.808 1040 1HB GLU 152 2HB GLU 152 0.256 -15.645 -10.092 1041 2HB GLU 152 1HB GLU 152 -1.175 -14.631 -10.056 1042 1HG GLU 152 2HG GLU 152 -0.040 -12.995 -11.458 1043 2HG GLU 152 1HG GLU 152 1.402 -14.011 -11.473 1044 H THR 153 H THR 153 -1.822 -12.806 -8.518 1045 HA THR 153 HA THR 153 -1.105 -10.327 -9.723 1046 HB THR 153 HB THR 153 -3.444 -9.693 -9.338 1047 HG1 THR 153 1HG THR 153 -4.246 -10.504 -7.590 1048 1HG2 THR 153 1HG2 THR 153 -2.892 -11.191 -11.241 1049 2HG2 THR 153 2HG2 THR 153 -4.514 -11.496 -10.600 1050 3HG2 THR 153 3HG2 THR 153 -3.185 -12.575 -10.181 1051 H LEU 154 H LEU 154 -1.451 -11.589 -6.534 1052 HA LEU 154 HA LEU 154 -1.566 -9.175 -5.061 1053 1HB LEU 154 2HB LEU 154 -0.331 -11.804 -4.251 1054 2HB LEU 154 1HB LEU 154 -0.752 -10.493 -3.169 1055 HG LEU 154 HG LEU 154 -2.709 -12.156 -4.762 1056 1HD1 LEU 154 1HD1 LEU 154 -3.344 -13.041 -2.584 1057 2HD1 LEU 154 2HD1 LEU 154 -2.086 -12.081 -1.820 1058 3HD1 LEU 154 3HD1 LEU 154 -1.644 -13.372 -2.917 1059 1HD2 LEU 154 1HD2 LEU 154 -3.498 -9.850 -4.419 1060 2HD2 LEU 154 2HD2 LEU 154 -3.162 -10.021 -2.692 1061 3HD2 LEU 154 3HD2 LEU 154 -4.411 -11.009 -3.439 1062 H LEU 155 H LEU 155 1.211 -11.128 -6.250 1063 HA LEU 155 HA LEU 155 3.120 -9.543 -5.033 1064 1HB LEU 155 2HB LEU 155 3.481 -11.838 -5.641 1065 2HB LEU 155 1HB LEU 155 3.160 -11.473 -7.324 1066 HG LEU 155 HG LEU 155 5.020 -10.123 -7.448 1067 1HD1 LEU 155 1HD1 LEU 155 5.244 -9.311 -5.120 1068 2HD1 LEU 155 2HD1 LEU 155 6.756 -10.089 -5.577 1069 3HD1 LEU 155 3HD1 LEU 155 5.595 -10.944 -4.560 1070 1HD2 LEU 155 1HD2 LEU 155 6.791 -11.855 -7.233 1071 2HD2 LEU 155 2HD2 LEU 155 5.292 -12.429 -7.995 1072 3HD2 LEU 155 3HD2 LEU 155 5.625 -12.809 -6.304 1073 H GLN 156 H GLN 156 1.479 -9.514 -8.164 1074 HA GLN 156 HA GLN 156 3.113 -7.480 -9.281 1075 1HB GLN 156 2HB GLN 156 0.293 -8.246 -9.973 1076 2HB GLN 156 1HB GLN 156 1.308 -7.175 -10.927 1077 1HG GLN 156 2HG GLN 156 2.922 -9.062 -11.163 1078 2HG GLN 156 1HG GLN 156 1.724 -10.101 -10.393 1079 1HE2 GLN 156 1HE2 GLN 156 2.542 -8.254 -13.118 1080 2HE2 GLN 156 2HE2 GLN 156 1.350 -8.863 -14.214 1081 H PHE 157 H PHE 157 0.224 -7.463 -7.304 1082 HA PHE 157 HA PHE 157 -0.421 -4.733 -7.460 1083 1HB PHE 157 2HB PHE 157 -1.943 -6.371 -6.434 1084 2HB PHE 157 1HB PHE 157 -0.784 -6.684 -5.155 1085 HD1 PHE 157 1HD PHE 157 -1.045 -5.570 -3.120 1086 HD2 PHE 157 2HD PHE 157 -2.782 -3.897 -6.633 1087 HE1 PHE 157 1HE PHE 157 -2.151 -3.793 -1.740 1088 HE2 PHE 157 2HE PHE 157 -3.864 -2.154 -5.274 1089 HZ PHE 157 HZ PHE 157 -3.545 -2.109 -2.838 1090 H CYS 158 H CYS 158 1.864 -6.510 -5.496 1091 HA CYS 158 HA CYS 158 2.724 -4.412 -3.853 1092 1HB CYS 158 2HB CYS 158 4.325 -6.763 -4.892 1093 2HB CYS 158 1HB CYS 158 4.736 -5.773 -3.498 1094 HG CYS 158 HG CYS 158 1.899 -7.697 -3.673 1095 H VAL 159 H VAL 159 3.746 -5.489 -7.058 1096 HA VAL 159 HA VAL 159 5.919 -3.710 -7.395 1097 HB VAL 159 HB VAL 159 4.149 -4.917 -9.545 1098 1HG1 VAL 159 1HG1 VAL 159 6.957 -3.837 -9.717 1099 2HG1 VAL 159 2HG1 VAL 159 5.503 -3.108 -10.404 1100 3HG1 VAL 159 3HG1 VAL 159 6.086 -4.657 -11.017 1101 1HG2 VAL 159 1HG2 VAL 159 6.703 -5.997 -8.349 1102 2HG2 VAL 159 2HG2 VAL 159 5.818 -6.700 -9.705 1103 3HG2 VAL 159 3HG2 VAL 159 5.079 -6.655 -8.107 1104 H GLU 160 H GLU 160 2.517 -3.507 -8.319 1105 HA GLU 160 HA GLU 160 2.588 -1.030 -9.627 1106 1HB GLU 160 2HB GLU 160 0.298 -2.255 -8.069 1107 2HB GLU 160 1HB GLU 160 0.151 -0.943 -9.226 1108 1HG GLU 160 2HG GLU 160 1.065 -3.747 -9.858 1109 2HG GLU 160 1HG GLU 160 -0.540 -3.094 -10.166 1110 H VAL 161 H VAL 161 2.017 -1.814 -6.220 1111 HA VAL 161 HA VAL 161 1.683 0.890 -5.418 1112 HB VAL 161 HB VAL 161 2.465 -1.518 -3.770 1113 1HG1 VAL 161 1HG1 VAL 161 1.707 -0.193 -1.801 1114 2HG1 VAL 161 2HG1 VAL 161 1.452 1.194 -2.857 1115 3HG1 VAL 161 3HG1 VAL 161 3.081 0.563 -2.605 1116 1HG2 VAL 161 1HG2 VAL 161 0.284 -1.776 -4.801 1117 2HG2 VAL 161 2HG2 VAL 161 -0.220 -0.204 -4.181 1118 3HG2 VAL 161 3HG2 VAL 161 0.101 -1.530 -3.063 1119 H SER 162 H SER 162 4.498 -1.230 -5.698 1120 HA SER 162 HA SER 162 6.409 0.378 -4.444 1121 1HB SER 162 2HB SER 162 6.731 -1.418 -6.859 1122 2HB SER 162 1HB SER 162 8.052 -0.780 -5.875 1123 HG SER 162 HG SER 162 5.951 -2.476 -4.971 1124 H LYS 163 H LYS 163 5.154 0.471 -7.744 1125 HA LYS 163 HA LYS 163 6.797 2.520 -8.721 1126 1HB LYS 163 2HB LYS 163 3.985 1.761 -9.512 1127 2HB LYS 163 1HB LYS 163 4.981 2.905 -10.397 1128 1HG LYS 163 2HG LYS 163 6.602 1.171 -10.869 1129 2HG LYS 163 1HG LYS 163 5.667 0.016 -9.918 1130 1HD LYS 163 2HD LYS 163 3.797 0.235 -11.468 1131 2HD LYS 163 1HD LYS 163 4.685 1.453 -12.381 1132 1HE LYS 163 2HE LYS 163 5.569 -1.390 -11.971 1133 2HE LYS 163 1HE LYS 163 4.751 -0.798 -13.416 1134 1HZ LYS 163 1HZ LYS 163 6.631 0.728 -13.779 1135 2HZ LYS 163 2HZ LYS 163 7.118 -0.854 -13.793 1136 3HZ LYS 163 3HZ LYS 163 7.440 0.092 -12.446 1137 H GLU 164 H GLU 164 3.886 2.653 -6.792 1138 HA GLU 164 HA GLU 164 3.546 5.487 -7.043 1139 1HB GLU 164 2HB GLU 164 1.654 4.032 -6.382 1140 2HB GLU 164 1HB GLU 164 2.599 3.549 -4.970 1141 1HG GLU 164 2HG GLU 164 0.797 5.161 -4.418 1142 2HG GLU 164 1HG GLU 164 2.408 5.700 -3.971 1143 H ILE 165 H ILE 165 4.815 3.338 -4.521 1144 HA ILE 165 HA ILE 165 5.362 5.522 -2.829 1145 HB ILE 165 HB ILE 165 4.803 3.395 -1.888 1146 1HG1 ILE 165 2HG1 ILE 165 6.530 3.190 -0.136 1147 2HG1 ILE 165 1HG1 ILE 165 7.629 4.141 -1.130 1148 1HG2 ILE 165 1HG2 ILE 165 6.368 1.480 -1.850 1149 2HG2 ILE 165 2HG2 ILE 165 7.393 2.348 -3.001 1150 3HG2 ILE 165 3HG2 ILE 165 5.750 1.898 -3.455 1151 1HD1 ILE 165 1HD1 ILE 165 5.014 5.095 0.004 1152 2HD1 ILE 165 2HD1 ILE 165 6.140 6.011 -1.009 1153 3HD1 ILE 165 3HD1 ILE 165 6.634 5.501 0.608 1154 H ASP 166 H ASP 166 7.415 3.566 -4.794 1155 HA ASP 166 HA ASP 166 9.935 4.590 -3.986 1156 1HB ASP 166 2HB ASP 166 9.745 2.563 -5.345 1157 2HB ASP 166 1HB ASP 166 9.079 3.491 -6.675 1158 H GLU 167 H GLU 167 7.923 5.491 -6.725 1159 HA GLU 167 HA GLU 167 9.497 7.801 -7.369 1160 1HB GLU 167 2HB GLU 167 6.857 6.841 -8.445 1161 2HB GLU 167 1HB GLU 167 7.748 8.233 -9.064 1162 1HG GLU 167 2HG GLU 167 9.620 6.800 -9.648 1163 2HG GLU 167 1HG GLU 167 8.780 5.407 -8.984 1164 H HIS 168 H HIS 168 6.746 7.332 -5.376 1165 HA HIS 168 HA HIS 168 6.015 10.096 -5.209 1166 1HB HIS 168 2HB HIS 168 4.828 7.910 -4.318 1167 2HB HIS 168 1HB HIS 168 5.816 8.184 -2.898 1168 HD1 HIS 168 1HD HIS 168 2.728 9.041 -4.472 1169 HD2 HIS 168 2HD HIS 168 5.177 10.742 -1.588 1170 HE1 HIS 168 1HE HIS 168 1.296 10.749 -3.298 1171 HE2 HIS 168 2HE HIS 168 2.652 11.297 -1.308 1172 H LEU 169 H LEU 169 8.325 8.060 -3.473 1173 HA LEU 169 HA LEU 169 9.102 10.191 -1.733 1174 1HB LEU 169 2HB LEU 169 10.420 7.532 -2.248 1175 2HB LEU 169 1HB LEU 169 10.867 8.652 -0.981 1176 HG LEU 169 HG LEU 169 8.264 7.156 -1.212 1177 1HD1 LEU 169 1HD1 LEU 169 10.538 6.906 0.741 1178 2HD1 LEU 169 2HD1 LEU 169 10.100 5.755 -0.524 1179 3HD1 LEU 169 3HD1 LEU 169 9.003 6.040 0.825 1180 1HD2 LEU 169 1HD2 LEU 169 7.724 8.119 0.982 1181 2HD2 LEU 169 2HD2 LEU 169 7.867 9.357 -0.256 1182 3HD2 LEU 169 3HD2 LEU 169 9.180 9.110 0.900 1183 H LEU 170 H LEU 170 10.460 8.737 -4.657 1184 HA LEU 170 HA LEU 170 12.831 10.374 -4.610 1185 1HB LEU 170 2HB LEU 170 11.525 8.921 -6.888 1186 2HB LEU 170 1HB LEU 170 13.133 9.608 -6.912 1187 HG LEU 170 HG LEU 170 12.252 7.363 -5.119 1188 1HD1 LEU 170 1HD1 LEU 170 12.274 6.866 -7.552 1189 2HD1 LEU 170 2HD1 LEU 170 13.359 5.917 -6.603 1190 3HD1 LEU 170 3HD1 LEU 170 13.996 7.265 -7.581 1191 1HD2 LEU 170 1HD2 LEU 170 14.660 7.109 -4.716 1192 2HD2 LEU 170 2HD2 LEU 170 14.084 8.684 -4.180 1193 3HD2 LEU 170 3HD2 LEU 170 14.975 8.540 -5.697 1194 H ALA 171 H ALA 171 9.720 10.475 -6.194 1195 HA ALA 171 HA ALA 171 8.575 11.936 -7.337 1196 1HB ALA 171 1HB ALA 171 10.294 13.960 -5.929 1197 2HB ALA 171 2HB ALA 171 8.794 13.200 -5.345 1198 3HB ALA 171 3HB ALA 171 8.741 14.289 -6.739 1199 H GLU 172 H GLU 172 10.869 10.771 -8.488 1200 HA GLU 172 HA GLU 172 12.213 12.593 -10.177 1201 1HB GLU 172 2HB GLU 172 12.830 10.608 -11.493 1202 2HB GLU 172 1HB GLU 172 13.162 10.414 -9.782 1203 1HG GLU 172 2HG GLU 172 11.178 9.040 -9.526 1204 2HG GLU 172 1HG GLU 172 10.753 9.318 -11.214 1205 H GLU 173 H GLU 173 11.905 12.937 -12.342 1206 HA GLU 173 HA GLU 173 9.147 12.551 -13.261 1207 1HB GLU 173 2HB GLU 173 10.986 14.894 -13.802 1208 2HB GLU 173 1HB GLU 173 9.358 14.695 -14.422 1209 1HG GLU 173 2HG GLU 173 8.440 14.853 -12.206 1210 2HG GLU 173 1HG GLU 173 10.061 14.922 -11.510 Start of MODEL 5 1 H THR 17 H THR 17 0.025 -28.951 -2.178 2 HA THR 17 HA THR 17 -1.212 -30.013 -4.576 3 HB THR 17 HB THR 17 -2.032 -31.823 -3.003 4 HG1 THR 17 1HG THR 17 -0.249 -30.786 -1.080 5 1HG2 THR 17 1HG2 THR 17 0.185 -32.843 -2.642 6 2HG2 THR 17 2HG2 THR 17 0.949 -31.286 -2.958 7 3HG2 THR 17 3HG2 THR 17 0.068 -32.112 -4.241 8 H GLU 18 H GLU 18 -2.179 -28.875 -1.392 9 HA GLU 18 HA GLU 18 -4.409 -27.434 -2.370 10 1HB GLU 18 2HB GLU 18 -6.096 -28.647 -1.063 11 2HB GLU 18 1HB GLU 18 -5.415 -29.675 -2.319 12 1HG GLU 18 2HG GLU 18 -3.998 -30.756 -0.654 13 2HG GLU 18 1HG GLU 18 -4.677 -29.716 0.596 14 H ALA 19 H ALA 19 -5.517 -26.467 -0.402 15 HA ALA 19 HA ALA 19 -3.530 -26.114 1.717 16 1HB ALA 19 1HB ALA 19 -5.585 -24.177 0.674 17 2HB ALA 19 2HB ALA 19 -3.846 -24.085 0.408 18 3HB ALA 19 3HB ALA 19 -4.506 -23.863 2.027 19 H SER 20 H SER 20 -4.199 -27.449 3.300 20 HA SER 20 HA SER 20 -6.918 -28.022 3.773 21 1HB SER 20 2HB SER 20 -5.970 -29.123 5.783 22 2HB SER 20 1HB SER 20 -5.255 -29.646 4.252 23 HG SER 20 HG SER 20 -3.920 -28.952 6.229 24 H SER 21 H SER 21 -4.507 -25.973 5.286 25 HA SER 21 HA SER 21 -6.258 -25.127 7.391 26 1HB SER 21 2HB SER 21 -3.796 -25.375 7.711 27 2HB SER 21 1HB SER 21 -3.527 -24.085 6.552 28 HG SER 21 HG SER 21 -5.233 -23.445 8.635 29 H LEU 22 H LEU 22 -5.485 -24.168 4.188 30 HA LEU 22 HA LEU 22 -6.067 -22.578 2.799 31 1HB LEU 22 2HB LEU 22 -8.355 -22.381 4.687 32 2HB LEU 22 1HB LEU 22 -8.270 -21.420 3.218 33 HG LEU 22 HG LEU 22 -8.061 -24.426 3.164 34 1HD1 LEU 22 1HD1 LEU 22 -10.408 -24.448 2.579 35 2HD1 LEU 22 2HD1 LEU 22 -10.503 -22.698 2.893 36 3HD1 LEU 22 3HD1 LEU 22 -10.114 -23.832 4.206 37 1HD2 LEU 22 1HD2 LEU 22 -8.711 -24.116 0.828 38 2HD2 LEU 22 2HD2 LEU 22 -7.260 -23.177 1.177 39 3HD2 LEU 22 3HD2 LEU 22 -8.818 -22.380 1.072 40 H VAL 23 H VAL 23 -5.434 -21.441 5.947 41 HA VAL 23 HA VAL 23 -5.288 -18.733 5.044 42 HB VAL 23 HB VAL 23 -5.678 -19.163 7.441 43 1HG1 VAL 23 1HG1 VAL 23 -2.910 -20.279 7.425 44 2HG1 VAL 23 2HG1 VAL 23 -4.393 -21.177 7.735 45 3HG1 VAL 23 3HG1 VAL 23 -3.845 -19.946 8.890 46 1HG2 VAL 23 1HG2 VAL 23 -3.066 -17.741 6.932 47 2HG2 VAL 23 2HG2 VAL 23 -4.042 -17.586 8.392 48 3HG2 VAL 23 3HG2 VAL 23 -4.677 -17.032 6.844 49 H GLY 24 H GLY 24 -3.625 -17.682 4.231 50 1HA GLY 24 2HA GLY 24 -1.091 -19.102 3.960 51 2HA GLY 24 1HA GLY 24 -1.938 -18.573 2.511 52 H LYS 25 H LYS 25 0.564 -17.712 3.117 53 HA LYS 25 HA LYS 25 0.090 -14.907 3.284 54 1HB LYS 25 2HB LYS 25 2.028 -14.629 4.862 55 2HB LYS 25 1HB LYS 25 0.540 -15.217 5.579 56 1HG LYS 25 2HG LYS 25 1.305 -17.322 5.812 57 2HG LYS 25 1HG LYS 25 2.705 -17.116 4.732 58 1HD LYS 25 2HD LYS 25 2.294 -15.759 7.422 59 2HD LYS 25 1HD LYS 25 3.331 -17.165 7.164 60 1HE LYS 25 2HE LYS 25 4.725 -15.875 5.632 61 2HE LYS 25 1HE LYS 25 3.689 -14.475 5.818 62 1HZ LYS 25 1HZ LYS 25 5.273 -15.729 7.987 63 2HZ LYS 25 2HZ LYS 25 4.329 -14.331 8.132 64 3HZ LYS 25 3HZ LYS 25 5.682 -14.338 7.116 65 H LEU 26 H LEU 26 1.853 -13.704 2.475 66 HA LEU 26 HA LEU 26 3.976 -15.247 1.281 67 1HB LEU 26 2HB LEU 26 2.082 -15.109 -0.392 68 2HB LEU 26 1HB LEU 26 2.252 -13.373 -0.371 69 HG LEU 26 HG LEU 26 4.438 -15.260 -1.305 70 1HD1 LEU 26 1HD1 LEU 26 3.784 -14.614 -3.552 71 2HD1 LEU 26 2HD1 LEU 26 2.400 -13.737 -2.889 72 3HD1 LEU 26 3HD1 LEU 26 2.507 -15.498 -2.704 73 1HD2 LEU 26 1HD2 LEU 26 5.187 -13.007 -0.618 74 2HD2 LEU 26 2HD2 LEU 26 4.071 -12.298 -1.793 75 3HD2 LEU 26 3HD2 LEU 26 5.408 -13.325 -2.333 76 H GLU 27 H GLU 27 5.811 -14.091 1.197 77 HA GLU 27 HA GLU 27 5.663 -11.263 1.931 78 1HB GLU 27 2HB GLU 27 7.586 -13.304 3.051 79 2HB GLU 27 1HB GLU 27 7.708 -11.569 3.305 80 1HG GLU 27 2HG GLU 27 5.516 -11.608 4.425 81 2HG GLU 27 1HG GLU 27 5.464 -13.354 4.207 82 H THR 28 H THR 28 7.000 -9.955 0.839 83 HA THR 28 HA THR 28 9.107 -11.116 -0.756 84 HB THR 28 HB THR 28 7.174 -11.134 -2.326 85 HG1 THR 28 1HG THR 28 8.086 -9.344 -3.796 86 1HG2 THR 28 1HG2 THR 28 5.813 -9.371 -1.283 87 2HG2 THR 28 2HG2 THR 28 6.061 -9.045 -2.997 88 3HG2 THR 28 3HG2 THR 28 6.988 -8.156 -1.791 89 H ASP 29 H ASP 29 10.774 -9.684 -1.122 90 HA ASP 29 HA ASP 29 10.474 -7.116 0.243 91 1HB ASP 29 2HB ASP 29 12.910 -7.060 0.592 92 2HB ASP 29 1HB ASP 29 12.241 -8.490 1.333 93 H VAL 30 H VAL 30 10.385 -5.421 -0.941 94 HA VAL 30 HA VAL 30 11.506 -5.549 -3.651 95 HB VAL 30 HB VAL 30 9.238 -3.758 -2.649 96 1HG1 VAL 30 1HG1 VAL 30 10.603 -2.659 -4.342 97 2HG1 VAL 30 2HG1 VAL 30 8.995 -3.067 -4.937 98 3HG1 VAL 30 3HG1 VAL 30 10.384 -4.049 -5.410 99 1HG2 VAL 30 1HG2 VAL 30 9.239 -6.083 -4.544 100 2HG2 VAL 30 2HG2 VAL 30 7.848 -5.050 -4.176 101 3HG2 VAL 30 3HG2 VAL 30 8.544 -6.085 -2.917 102 H GLU 31 H GLU 31 13.130 -4.251 -4.061 103 HA GLU 31 HA GLU 31 13.681 -2.288 -2.047 104 1HB GLU 31 2HB GLU 31 15.997 -2.091 -2.962 105 2HB GLU 31 1HB GLU 31 15.565 -3.647 -2.296 106 1HG GLU 31 2HG GLU 31 16.884 -4.059 -4.182 107 2HG GLU 31 1HG GLU 31 15.222 -4.422 -4.639 108 H ILE 32 H ILE 32 13.817 -0.306 -2.181 109 HA ILE 32 HA ILE 32 12.968 0.932 -4.684 110 HB ILE 32 HB ILE 32 11.960 2.734 -3.314 111 1HG1 ILE 32 2HG1 ILE 32 12.690 0.966 -0.963 112 2HG1 ILE 32 1HG1 ILE 32 13.395 2.529 -1.333 113 1HG2 ILE 32 1HG2 ILE 32 10.549 0.897 -4.060 114 2HG2 ILE 32 2HG2 ILE 32 10.030 1.455 -2.469 115 3HG2 ILE 32 3HG2 ILE 32 10.967 -0.034 -2.621 116 1HD1 ILE 32 1HD1 ILE 32 11.820 2.685 0.468 117 2HD1 ILE 32 2HD1 ILE 32 10.539 2.001 -0.530 118 3HD1 ILE 32 3HD1 ILE 32 11.215 3.592 -0.916 119 H LYS 33 H LYS 33 13.584 3.394 -4.568 120 HA LYS 33 HA LYS 33 16.505 3.364 -4.363 121 1HB LYS 33 2HB LYS 33 14.747 5.501 -5.530 122 2HB LYS 33 1HB LYS 33 16.443 5.201 -5.860 123 1HG LYS 33 2HG LYS 33 15.892 3.128 -6.987 124 2HG LYS 33 1HG LYS 33 14.181 3.382 -6.635 125 1HD LYS 33 2HD LYS 33 14.354 5.532 -7.929 126 2HD LYS 33 1HD LYS 33 15.971 5.018 -8.413 127 1HE LYS 33 2HE LYS 33 14.413 4.416 -10.133 128 2HE LYS 33 1HE LYS 33 14.993 2.954 -9.336 129 1HZ LYS 33 1HZ LYS 33 12.602 2.834 -9.645 130 2HZ LYS 33 2HZ LYS 33 12.406 4.307 -8.859 131 3HZ LYS 33 3HZ LYS 33 12.913 3.001 -7.980 132 H ALA 34 H ALA 34 13.608 4.841 -3.185 133 HA ALA 34 HA ALA 34 14.723 7.022 -1.802 134 1HB ALA 34 1HB ALA 34 12.201 5.474 -1.234 135 2HB ALA 34 2HB ALA 34 12.345 6.847 -2.325 136 3HB ALA 34 3HB ALA 34 12.595 7.064 -0.594 137 H SER 35 H SER 35 15.172 7.245 0.415 138 HA SER 35 HA SER 35 16.047 4.773 1.651 139 1HB SER 35 2HB SER 35 17.689 6.582 1.523 140 2HB SER 35 1HB SER 35 16.611 7.650 2.413 141 HG SER 35 HG SER 35 18.355 5.892 3.332 142 H ALA 36 H ALA 36 15.377 4.105 3.613 143 HA ALA 36 HA ALA 36 12.740 4.610 4.443 144 1HB ALA 36 1HB ALA 36 13.962 2.503 4.845 145 2HB ALA 36 2HB ALA 36 13.285 3.175 6.338 146 3HB ALA 36 3HB ALA 36 15.001 3.363 5.978 147 H ASP 37 H ASP 37 15.819 5.955 5.320 148 HA ASP 37 HA ASP 37 14.994 7.215 7.714 149 1HB ASP 37 2HB ASP 37 17.360 6.840 7.328 150 2HB ASP 37 1HB ASP 37 17.300 7.836 5.875 151 H LYS 38 H LYS 38 15.183 8.262 4.338 152 HA LYS 38 HA LYS 38 14.545 10.899 5.105 153 1HB LYS 38 2HB LYS 38 14.552 11.545 2.743 154 2HB LYS 38 1HB LYS 38 15.969 10.634 3.160 155 1HG LYS 38 2HG LYS 38 15.386 9.907 1.021 156 2HG LYS 38 1HG LYS 38 14.821 8.629 2.083 157 1HD LYS 38 2HD LYS 38 13.196 9.140 0.322 158 2HD LYS 38 1HD LYS 38 12.541 9.477 1.935 159 1HE LYS 38 2HE LYS 38 11.922 11.237 0.357 160 2HE LYS 38 1HE LYS 38 13.000 11.900 1.568 161 1HZ LYS 38 1HZ LYS 38 13.675 11.187 -1.251 162 2HZ LYS 38 2HZ LYS 38 14.834 11.682 -0.114 163 3HZ LYS 38 3HZ LYS 38 13.596 12.702 -0.574 164 H PHE 39 H PHE 39 12.746 8.171 4.298 165 HA PHE 39 HA PHE 39 10.246 9.211 3.720 166 1HB PHE 39 2HB PHE 39 10.873 6.774 3.795 167 2HB PHE 39 1HB PHE 39 10.871 6.858 5.546 168 HD1 PHE 39 1HD PHE 39 8.954 6.235 2.621 169 HD2 PHE 39 2HD PHE 39 8.616 7.501 6.675 170 HE1 PHE 39 1HE PHE 39 6.567 5.651 2.605 171 HE2 PHE 39 2HE PHE 39 6.232 6.914 6.666 172 HZ PHE 39 HZ PHE 39 5.199 5.990 4.628 173 H HIS 40 H HIS 40 11.909 8.853 6.827 174 HA HIS 40 HA HIS 40 9.739 9.623 8.505 175 1HB HIS 40 2HB HIS 40 12.685 9.985 9.088 176 2HB HIS 40 1HB HIS 40 11.389 9.992 10.268 177 HD1 HIS 40 1HD HIS 40 13.990 7.996 9.243 178 HD2 HIS 40 2HD HIS 40 10.001 7.205 10.029 179 HE1 HIS 40 1HE HIS 40 13.883 5.532 9.671 180 HE2 HIS 40 2HE HIS 40 11.540 5.185 10.516 181 H HIS 41 H HIS 41 12.147 11.377 6.748 182 HA HIS 41 HA HIS 41 11.842 13.902 8.067 183 1HB HIS 41 2HB HIS 41 12.872 13.331 5.260 184 2HB HIS 41 1HB HIS 41 12.970 14.889 6.053 185 HD1 HIS 41 1HD HIS 41 15.380 15.273 6.671 186 HD2 HIS 41 2HD HIS 41 14.269 11.306 7.207 187 HE1 HIS 41 1HE HIS 41 17.441 14.084 7.474 188 HE2 HIS 41 2HE HIS 41 16.783 11.641 7.410 189 H MET 42 H MET 42 10.416 12.430 5.214 190 HA MET 42 HA MET 42 8.911 14.766 4.438 191 1HB MET 42 2HB MET 42 8.612 11.912 3.534 192 2HB MET 42 1HB MET 42 7.853 13.303 2.801 193 1HG MET 42 2HG MET 42 10.822 12.738 2.871 194 2HG MET 42 1HG MET 42 9.761 12.454 1.505 195 1HE MET 42 1HE MET 42 12.014 14.991 3.415 196 2HE MET 42 2HE MET 42 10.486 15.639 4.017 197 3HE MET 42 3HE MET 42 11.445 16.554 2.866 198 H PHE 43 H PHE 43 8.130 11.797 6.160 199 HA PHE 43 HA PHE 43 5.370 12.664 6.322 200 1HB PHE 43 2HB PHE 43 6.701 10.056 7.005 201 2HB PHE 43 1HB PHE 43 5.023 10.393 7.418 202 HD1 PHE 43 1HD PHE 43 3.328 10.115 5.841 203 HD2 PHE 43 2HD PHE 43 7.381 10.163 4.544 204 HE1 PHE 43 1HE PHE 43 2.615 9.400 3.602 205 HE2 PHE 43 2HE PHE 43 6.670 9.452 2.296 206 HZ PHE 43 HZ PHE 43 4.286 9.070 1.826 207 H ALA 44 H ALA 44 7.907 13.493 8.019 208 HA ALA 44 HA ALA 44 7.156 13.084 10.715 209 1HB ALA 44 1HB ALA 44 9.412 13.826 10.070 210 2HB ALA 44 2HB ALA 44 8.685 14.915 11.254 211 3HB ALA 44 3HB ALA 44 8.748 15.377 9.553 212 H GLY 45 H GLY 45 6.437 15.657 8.404 213 1HA GLY 45 2HA GLY 45 4.328 16.754 8.424 214 2HA GLY 45 1HA GLY 45 4.257 16.513 10.167 215 H LYS 46 H LYS 46 7.261 17.303 10.014 216 HA LYS 46 HA LYS 46 6.866 20.186 9.745 217 1HB LYS 46 2HB LYS 46 8.287 18.846 12.075 218 2HB LYS 46 1HB LYS 46 8.121 20.573 11.827 219 1HG LYS 46 2HG LYS 46 5.893 18.631 12.437 220 2HG LYS 46 1HG LYS 46 6.612 19.808 13.541 221 1HD LYS 46 2HD LYS 46 5.774 21.638 12.187 222 2HD LYS 46 1HD LYS 46 5.159 20.494 10.991 223 1HE LYS 46 2HE LYS 46 3.652 19.558 12.700 224 2HE LYS 46 1HE LYS 46 4.225 20.768 13.848 225 1HZ LYS 46 1HZ LYS 46 3.409 22.486 12.342 226 2HZ LYS 46 2HZ LYS 46 2.154 21.489 12.834 227 3HZ LYS 46 3HZ LYS 46 2.812 21.312 11.287 228 HA PRO 47 HA PRO 47 10.895 19.937 7.761 229 1HB PRO 47 2HB PRO 47 11.660 22.377 9.279 230 2HB PRO 47 1HB PRO 47 11.614 22.134 7.531 231 1HG PRO 47 2HG PRO 47 9.789 23.647 8.767 232 2HG PRO 47 1HG PRO 47 9.358 22.622 7.387 233 1HD PRO 47 2HD PRO 47 8.870 22.152 10.313 234 2HD PRO 47 1HD PRO 47 7.828 21.807 8.919 235 H HIS 48 H HIS 48 12.249 18.451 8.576 236 HA HIS 48 HA HIS 48 12.729 18.484 11.452 237 1HB HIS 48 2HB HIS 48 11.894 16.398 10.259 238 2HB HIS 48 1HB HIS 48 13.476 16.290 9.506 239 HD1 HIS 48 1HD HIS 48 15.263 14.991 10.836 240 HD2 HIS 48 2HD HIS 48 12.002 16.143 13.162 241 HE1 HIS 48 1HE HIS 48 15.567 13.875 13.018 242 HE2 HIS 48 2HE HIS 48 13.497 14.412 14.330 243 H HIS 49 H HIS 49 14.740 18.666 12.341 244 HA HIS 49 HA HIS 49 16.748 20.104 11.088 245 1HB HIS 49 2HB HIS 49 16.506 19.854 13.551 246 2HB HIS 49 1HB HIS 49 17.034 18.184 13.421 247 HD1 HIS 49 1HD HIS 49 19.483 17.840 13.890 248 HD2 HIS 49 2HD HIS 49 18.659 21.727 12.643 249 HE1 HIS 49 1HE HIS 49 21.616 19.090 14.111 250 HE2 HIS 49 2HE HIS 49 21.030 21.469 13.583 251 H VAL 50 H VAL 50 17.949 19.547 9.407 252 HA VAL 50 HA VAL 50 18.047 16.897 8.468 253 HB VAL 50 HB VAL 50 19.502 17.681 6.663 254 1HG1 VAL 50 1HG1 VAL 50 17.122 18.016 6.464 255 2HG1 VAL 50 2HG1 VAL 50 17.991 19.351 5.708 256 3HG1 VAL 50 3HG1 VAL 50 17.248 19.566 7.295 257 1HG2 VAL 50 1HG2 VAL 50 20.929 19.234 7.894 258 2HG2 VAL 50 2HG2 VAL 50 19.557 20.314 8.148 259 3HG2 VAL 50 3HG2 VAL 50 20.179 20.043 6.519 260 H SER 51 H SER 51 20.238 18.705 10.431 261 HA SER 51 HA SER 51 21.928 18.040 11.774 262 1HB SER 51 2HB SER 51 21.197 15.226 10.903 263 2HB SER 51 1HB SER 51 22.134 15.665 12.332 264 HG SER 51 HG SER 51 19.422 16.230 11.769 265 H LYS 52 H LYS 52 22.319 18.715 9.017 266 HA LYS 52 HA LYS 52 23.908 18.906 7.446 267 1HB LYS 52 2HB LYS 52 25.639 17.385 9.399 268 2HB LYS 52 1HB LYS 52 26.221 18.073 7.895 269 1HG LYS 52 2HG LYS 52 25.592 20.311 8.710 270 2HG LYS 52 1HG LYS 52 25.090 19.589 10.239 271 1HD LYS 52 2HD LYS 52 27.334 20.472 10.470 272 2HD LYS 52 1HD LYS 52 27.375 18.706 10.530 273 1HE LYS 52 2HE LYS 52 28.072 18.662 8.151 274 2HE LYS 52 1HE LYS 52 28.038 20.421 8.133 275 1HZ LYS 52 1HZ LYS 52 30.270 19.564 8.417 276 2HZ LYS 52 2HZ LYS 52 29.829 18.734 9.800 277 3HZ LYS 52 3HZ LYS 52 29.833 20.417 9.785 278 H ALA 53 H ALA 53 25.826 17.252 6.425 279 HA ALA 53 HA ALA 53 26.305 15.491 5.176 280 1HB ALA 53 1HB ALA 53 23.960 14.036 6.403 281 2HB ALA 53 2HB ALA 53 25.597 14.034 7.052 282 3HB ALA 53 3HB ALA 53 25.273 13.307 5.475 283 H SER 54 H SER 54 22.855 16.165 5.249 284 HA SER 54 HA SER 54 22.927 16.618 2.414 285 1HB SER 54 2HB SER 54 21.008 15.035 1.995 286 2HB SER 54 1HB SER 54 22.523 14.234 2.394 287 HG SER 54 HG SER 54 21.066 14.804 4.610 288 HA PRO 55 HA PRO 55 19.906 19.564 3.825 289 1HB PRO 55 2HB PRO 55 18.843 20.323 1.461 290 2HB PRO 55 1HB PRO 55 20.478 20.789 1.944 291 1HG PRO 55 2HG PRO 55 19.611 18.597 0.103 292 2HG PRO 55 1HG PRO 55 20.942 19.752 -0.083 293 1HD PRO 55 2HD PRO 55 21.304 17.195 0.787 294 2HD PRO 55 1HD PRO 55 22.349 18.543 1.278 295 H GLY 56 H GLY 56 17.488 20.021 3.491 296 1HA GLY 56 2HA GLY 56 16.068 17.494 3.058 297 2HA GLY 56 1HA GLY 56 15.672 18.607 4.366 298 H ASN 57 H ASN 57 16.154 18.676 0.866 299 HA ASN 57 HA ASN 57 14.220 20.792 0.580 300 1HB ASN 57 2HB ASN 57 15.587 19.125 -1.554 301 2HB ASN 57 1HB ASN 57 14.579 20.530 -1.850 302 1HD2 ASN 57 1HD2 ASN 57 17.372 20.034 -2.492 303 2HD2 ASN 57 2HD2 ASN 57 18.262 21.334 -1.786 304 H ILE 58 H ILE 58 12.336 20.580 -0.826 305 HA ILE 58 HA ILE 58 10.366 19.720 -1.340 306 HB ILE 58 HB ILE 58 11.593 16.969 -0.818 307 1HG1 ILE 58 2HG1 ILE 58 10.989 18.381 -3.433 308 2HG1 ILE 58 1HG1 ILE 58 12.588 18.170 -2.734 309 1HG2 ILE 58 1HG2 ILE 58 9.163 16.918 -0.516 310 2HG2 ILE 58 2HG2 ILE 58 9.642 16.029 -1.963 311 3HG2 ILE 58 3HG2 ILE 58 8.949 17.644 -2.111 312 1HD1 ILE 58 1HD1 ILE 58 10.761 15.974 -3.663 313 2HD1 ILE 58 2HD1 ILE 58 12.376 15.754 -2.989 314 3HD1 ILE 58 3HD1 ILE 58 12.171 16.586 -4.531 315 H GLN 59 H GLN 59 9.135 20.526 0.150 316 HA GLN 59 HA GLN 59 9.560 20.073 2.906 317 1HB GLN 59 2HB GLN 59 7.550 21.437 3.294 318 2HB GLN 59 1HB GLN 59 8.707 22.201 2.221 319 1HG GLN 59 2HG GLN 59 7.332 21.599 0.301 320 2HG GLN 59 1HG GLN 59 6.195 20.780 1.373 321 1HE2 GLN 59 1HE2 GLN 59 5.768 23.007 -0.443 322 2HE2 GLN 59 2HE2 GLN 59 5.174 24.311 0.518 323 H GLY 60 H GLY 60 8.815 18.672 4.267 324 1HA GLY 60 2HA GLY 60 6.538 16.995 3.467 325 2HA GLY 60 1HA GLY 60 7.817 16.503 4.583 326 H CYS 61 H CYS 61 5.631 19.242 4.221 327 HA CYS 61 HA CYS 61 5.436 19.440 7.088 328 1HB CYS 61 2HB CYS 61 4.254 21.171 4.909 329 2HB CYS 61 1HB CYS 61 4.206 21.514 6.635 330 HG CYS 61 HG CYS 61 7.302 20.992 5.985 331 H ASP 62 H ASP 62 3.351 19.718 8.095 332 HA ASP 62 HA ASP 62 1.793 17.446 7.750 333 1HB ASP 62 2HB ASP 62 0.396 18.343 9.572 334 2HB ASP 62 1HB ASP 62 2.117 18.415 9.926 335 H LEU 63 H LEU 63 -0.019 17.018 6.908 336 HA LEU 63 HA LEU 63 -1.542 19.019 5.366 337 1HB LEU 63 2HB LEU 63 -1.701 15.980 5.296 338 2HB LEU 63 1HB LEU 63 -2.564 17.069 4.254 339 HG LEU 63 HG LEU 63 -0.319 17.704 3.248 340 1HD1 LEU 63 1HD1 LEU 63 1.521 16.133 3.527 341 2HD1 LEU 63 2HD1 LEU 63 0.607 15.274 4.767 342 3HD1 LEU 63 3HD1 LEU 63 1.130 16.934 5.046 343 1HD2 LEU 63 1HD2 LEU 63 -1.221 14.840 3.029 344 2HD2 LEU 63 2HD2 LEU 63 -0.217 15.704 1.862 345 3HD2 LEU 63 3HD2 LEU 63 -1.886 16.206 2.139 346 H HIS 64 H HIS 64 -4.012 17.835 5.422 347 HA HIS 64 HA HIS 64 -4.548 17.710 8.276 348 1HB HIS 64 2HB HIS 64 -6.936 17.757 7.775 349 2HB HIS 64 1HB HIS 64 -6.152 19.019 6.857 350 HD1 HIS 64 1HD HIS 64 -6.577 19.020 4.365 351 HD2 HIS 64 2HD HIS 64 -7.785 15.484 6.171 352 HE1 HIS 64 1HE HIS 64 -7.861 17.764 2.614 353 HE2 HIS 64 2HE HIS 64 -8.492 15.590 3.693 354 H GLU 65 H GLU 65 -4.968 15.884 9.368 355 HA GLU 65 HA GLU 65 -4.294 13.445 8.027 356 1HB GLU 65 2HB GLU 65 -5.017 14.037 10.889 357 2HB GLU 65 1HB GLU 65 -4.635 12.425 10.307 358 1HG GLU 65 2HG GLU 65 -2.800 14.810 10.225 359 2HG GLU 65 1HG GLU 65 -2.715 13.471 11.372 360 H GLY 66 H GLY 66 -5.547 11.510 8.224 361 1HA GLY 66 2HA GLY 66 -8.088 11.765 7.080 362 2HA GLY 66 1HA GLY 66 -7.435 10.294 7.784 363 H ASP 67 H ASP 67 -9.907 12.373 7.922 364 HA ASP 67 HA ASP 67 -10.225 12.747 10.715 365 1HB ASP 67 2HB ASP 67 -12.246 13.047 8.495 366 2HB ASP 67 1HB ASP 67 -12.562 13.470 10.175 367 H TRP 68 H TRP 68 -10.332 10.016 9.164 368 HA TRP 68 HA TRP 68 -12.462 8.698 10.592 369 1HB TRP 68 2HB TRP 68 -10.099 7.578 9.074 370 2HB TRP 68 1HB TRP 68 -11.439 6.634 9.697 371 HD1 TRP 68 HD TRP 68 -13.664 6.601 8.281 372 HE1 TRP 68 1HE TRP 68 -14.241 7.372 5.910 373 HE3 TRP 68 3HE TRP 68 -9.566 9.502 7.350 374 HZ2 TRP 68 2HZ TRP 68 -13.130 9.000 3.908 375 HZ3 TRP 68 3HZ TRP 68 -9.402 10.638 5.177 376 HH2 TRP 68 HH TRP 68 -11.141 10.394 3.494 377 H GLY 69 H GLY 69 -9.552 10.007 11.524 378 1HA GLY 69 2HA GLY 69 -8.677 9.786 13.712 379 2HA GLY 69 1HA GLY 69 -9.341 8.159 13.790 380 H THR 70 H THR 70 -7.809 9.003 10.911 381 HA THR 70 HA THR 70 -5.984 8.303 9.823 382 HB THR 70 HB THR 70 -4.784 7.767 12.577 383 HG1 THR 70 1HG THR 70 -4.345 9.911 10.761 384 1HG2 THR 70 1HG2 THR 70 -2.602 7.776 11.417 385 2HG2 THR 70 2HG2 THR 70 -3.428 7.945 9.870 386 3HG2 THR 70 3HG2 THR 70 -3.633 6.476 10.819 387 H VAL 71 H VAL 71 -6.248 6.047 12.582 388 HA VAL 71 HA VAL 71 -6.122 3.796 10.831 389 HB VAL 71 HB VAL 71 -7.026 3.974 13.732 390 1HG1 VAL 71 1HG1 VAL 71 -6.352 1.551 12.057 391 2HG1 VAL 71 2HG1 VAL 71 -7.959 1.996 12.634 392 3HG1 VAL 71 3HG1 VAL 71 -6.705 1.534 13.783 393 1HG2 VAL 71 1HG2 VAL 71 -4.814 3.059 14.256 394 2HG2 VAL 71 2HG2 VAL 71 -4.681 4.594 13.395 395 3HG2 VAL 71 3HG2 VAL 71 -4.405 3.081 12.539 396 H GLY 72 H GLY 72 -7.754 2.819 9.810 397 1HA GLY 72 2HA GLY 72 -10.011 2.268 9.425 398 2HA GLY 72 1HA GLY 72 -10.493 3.580 10.491 399 H SER 73 H SER 73 -8.119 4.849 8.665 400 HA SER 73 HA SER 73 -9.874 6.407 7.083 401 1HB SER 73 2HB SER 73 -7.651 7.231 7.849 402 2HB SER 73 1HB SER 73 -6.868 6.041 6.818 403 HG SER 73 HG SER 73 -7.041 7.432 5.261 404 H ILE 74 H ILE 74 -10.598 6.097 5.102 405 HA ILE 74 HA ILE 74 -9.507 3.877 3.562 406 HB ILE 74 HB ILE 74 -12.424 4.447 4.078 407 1HG1 ILE 74 2HG1 ILE 74 -10.701 2.023 4.546 408 2HG1 ILE 74 1HG1 ILE 74 -11.186 3.179 5.771 409 1HG2 ILE 74 1HG2 ILE 74 -12.927 2.610 2.535 410 2HG2 ILE 74 2HG2 ILE 74 -11.214 2.482 2.118 411 3HG2 ILE 74 3HG2 ILE 74 -12.123 3.940 1.706 412 1HD1 ILE 74 1HD1 ILE 74 -12.981 1.388 4.168 413 2HD1 ILE 74 2HD1 ILE 74 -13.522 2.549 5.388 414 3HD1 ILE 74 3HD1 ILE 74 -12.532 1.156 5.862 415 H VAL 75 H VAL 75 -8.771 4.646 1.783 416 HA VAL 75 HA VAL 75 -10.318 6.637 0.318 417 HB VAL 75 HB VAL 75 -8.274 7.727 -0.513 418 1HG1 VAL 75 1HG1 VAL 75 -8.387 7.678 2.493 419 2HG1 VAL 75 2HG1 VAL 75 -9.325 8.723 1.423 420 3HG1 VAL 75 3HG1 VAL 75 -7.573 8.907 1.524 421 1HG2 VAL 75 1HG2 VAL 75 -6.706 5.873 -0.349 422 2HG2 VAL 75 2HG2 VAL 75 -6.788 5.938 1.412 423 3HG2 VAL 75 3HG2 VAL 75 -6.077 7.277 0.514 424 H PHE 76 H PHE 76 -10.098 6.476 -1.982 425 HA PHE 76 HA PHE 76 -8.976 3.912 -2.813 426 1HB PHE 76 2HB PHE 76 -11.542 5.174 -3.788 427 2HB PHE 76 1HB PHE 76 -10.779 3.767 -4.519 428 HD1 PHE 76 1HD PHE 76 -10.053 2.016 -2.595 429 HD2 PHE 76 2HD PHE 76 -13.354 4.667 -2.457 430 HE1 PHE 76 1HE PHE 76 -11.108 0.556 -0.998 431 HE2 PHE 76 2HE PHE 76 -14.468 3.200 -0.826 432 HZ PHE 76 HZ PHE 76 -13.357 1.123 -0.086 433 H TRP 77 H TRP 77 -7.575 3.974 -4.340 434 HA TRP 77 HA TRP 77 -7.302 6.483 -5.817 435 1HB TRP 77 2HB TRP 77 -5.244 4.323 -5.295 436 2HB TRP 77 1HB TRP 77 -4.971 5.743 -6.289 437 HD1 TRP 77 HD TRP 77 -6.817 7.293 -3.759 438 HE1 TRP 77 1HE TRP 77 -5.403 8.171 -1.823 439 HE3 TRP 77 3HE TRP 77 -2.560 4.625 -4.639 440 HZ2 TRP 77 2HZ TRP 77 -2.786 7.784 -0.787 441 HZ3 TRP 77 3HZ TRP 77 -0.639 4.938 -3.129 442 HH2 TRP 77 HH TRP 77 -0.752 6.484 -1.249 443 H ASN 78 H ASN 78 -7.836 6.511 -7.807 444 HA ASN 78 HA ASN 78 -8.018 4.003 -9.304 445 1HB ASN 78 2HB ASN 78 -9.308 6.705 -9.725 446 2HB ASN 78 1HB ASN 78 -9.290 5.467 -10.972 447 1HD2 ASN 78 1HD2 ASN 78 -10.487 6.316 -7.830 448 2HD2 ASN 78 2HD2 ASN 78 -11.751 5.149 -7.756 449 H TYR 79 H TYR 79 -6.706 3.640 -10.955 450 HA TYR 79 HA TYR 79 -5.127 5.779 -12.050 451 1HB TYR 79 2HB TYR 79 -3.007 4.516 -11.576 452 2HB TYR 79 1HB TYR 79 -3.778 5.159 -10.133 453 HD1 TYR 79 1HD TYR 79 -2.969 2.113 -11.999 454 HD2 TYR 79 2HD TYR 79 -4.730 3.662 -8.458 455 HE1 TYR 79 1HE TYR 79 -2.960 -0.144 -11.009 456 HE2 TYR 79 2HE TYR 79 -4.722 1.410 -7.458 457 HH TYR 79 HH TYR 79 -2.971 -1.156 -8.859 458 H VAL 80 H VAL 80 -3.808 4.869 -13.874 459 HA VAL 80 HA VAL 80 -5.284 2.654 -15.077 460 HB VAL 80 HB VAL 80 -3.623 4.803 -16.443 461 1HG1 VAL 80 1HG1 VAL 80 -4.526 3.888 -18.541 462 2HG1 VAL 80 2HG1 VAL 80 -5.341 2.614 -17.634 463 3HG1 VAL 80 3HG1 VAL 80 -3.586 2.675 -17.676 464 1HG2 VAL 80 1HG2 VAL 80 -5.778 5.644 -17.271 465 2HG2 VAL 80 2HG2 VAL 80 -5.705 5.651 -15.503 466 3HG2 VAL 80 3HG2 VAL 80 -6.601 4.387 -16.333 467 H HIS 81 H HIS 81 -4.290 0.822 -15.146 468 HA HIS 81 HA HIS 81 -1.393 0.756 -15.419 469 1HB HIS 81 2HB HIS 81 -1.925 0.652 -12.970 470 2HB HIS 81 1HB HIS 81 -2.882 -0.790 -13.261 471 HD1 HIS 81 1HD HIS 81 0.664 0.450 -13.241 472 HD2 HIS 81 2HD HIS 81 -1.408 -3.125 -13.400 473 HE1 HIS 81 1HE HIS 81 2.390 -1.360 -12.905 474 HE2 HIS 81 2HE HIS 81 1.043 -3.438 -12.707 475 H ASP 82 H ASP 82 -0.788 -0.733 -16.796 476 HA ASP 82 HA ASP 82 -0.841 -2.297 -18.463 477 1HB ASP 82 2HB ASP 82 -3.137 -3.555 -16.907 478 2HB ASP 82 1HB ASP 82 -2.285 -4.301 -18.247 479 H GLY 83 H GLY 83 -2.456 0.120 -18.491 480 1HA GLY 83 2HA GLY 83 -3.814 1.138 -20.060 481 2HA GLY 83 1HA GLY 83 -4.003 -0.418 -20.849 482 H GLU 84 H GLU 84 -4.795 -1.113 -17.816 483 HA GLU 84 HA GLU 84 -7.650 -0.748 -18.312 484 1HB GLU 84 2HB GLU 84 -6.763 -3.048 -17.944 485 2HB GLU 84 1HB GLU 84 -6.187 -2.522 -16.364 486 1HG GLU 84 2HG GLU 84 -8.469 -2.107 -15.653 487 2HG GLU 84 1HG GLU 84 -9.062 -2.599 -17.235 488 H ALA 85 H ALA 85 -8.951 0.118 -16.665 489 HA ALA 85 HA ALA 85 -7.600 1.916 -14.869 490 1HB ALA 85 1HB ALA 85 -10.544 1.314 -15.213 491 2HB ALA 85 2HB ALA 85 -9.669 2.634 -15.992 492 3HB ALA 85 3HB ALA 85 -9.876 2.621 -14.239 493 H LYS 86 H LYS 86 -6.903 1.250 -12.988 494 HA LYS 86 HA LYS 86 -8.281 -0.993 -11.777 495 1HB LYS 86 2HB LYS 86 -5.307 -0.501 -11.889 496 2HB LYS 86 1HB LYS 86 -6.052 -1.700 -10.831 497 1HG LYS 86 2HG LYS 86 -7.010 -2.836 -12.762 498 2HG LYS 86 1HG LYS 86 -6.293 -1.637 -13.833 499 1HD LYS 86 2HD LYS 86 -4.098 -2.374 -13.270 500 2HD LYS 86 1HD LYS 86 -4.722 -3.490 -12.030 501 1HE LYS 86 2HE LYS 86 -5.925 -4.675 -13.810 502 2HE LYS 86 1HE LYS 86 -5.234 -3.569 -14.988 503 1HZ LYS 86 1HZ LYS 86 -3.693 -5.437 -13.264 504 2HZ LYS 86 2HZ LYS 86 -3.007 -4.452 -14.448 505 3HZ LYS 86 3HZ LYS 86 -4.036 -5.684 -14.893 506 H VAL 87 H VAL 87 -8.517 -0.981 -9.566 507 HA VAL 87 HA VAL 87 -8.193 1.680 -8.345 508 HB VAL 87 HB VAL 87 -10.307 -0.378 -7.719 509 1HG1 VAL 87 1HG1 VAL 87 -10.140 2.541 -7.015 510 2HG1 VAL 87 2HG1 VAL 87 -9.918 1.178 -5.922 511 3HG1 VAL 87 3HG1 VAL 87 -11.499 1.477 -6.648 512 1HG2 VAL 87 1HG2 VAL 87 -10.594 2.010 -9.539 513 2HG2 VAL 87 2HG2 VAL 87 -11.907 0.959 -9.003 514 3HG2 VAL 87 3HG2 VAL 87 -10.621 0.311 -10.020 515 H ALA 88 H ALA 88 -7.437 1.690 -6.253 516 HA ALA 88 HA ALA 88 -6.579 -0.888 -5.136 517 1HB ALA 88 1HB ALA 88 -4.745 0.682 -5.523 518 2HB ALA 88 2HB ALA 88 -5.002 0.446 -3.796 519 3HB ALA 88 3HB ALA 88 -5.590 1.914 -4.574 520 H LYS 89 H LYS 89 -7.268 -1.467 -3.083 521 HA LYS 89 HA LYS 89 -9.157 0.364 -1.826 522 1HB LYS 89 2HB LYS 89 -9.335 -2.664 -1.879 523 2HB LYS 89 1HB LYS 89 -10.463 -1.576 -1.103 524 1HG LYS 89 2HG LYS 89 -11.569 -2.224 -3.069 525 2HG LYS 89 1HG LYS 89 -10.905 -0.647 -3.454 526 1HD LYS 89 2HD LYS 89 -9.028 -1.712 -4.609 527 2HD LYS 89 1HD LYS 89 -9.678 -3.303 -4.205 528 1HE LYS 89 2HE LYS 89 -11.714 -2.743 -5.466 529 2HE LYS 89 1HE LYS 89 -10.988 -1.203 -5.923 530 1HZ LYS 89 1HZ LYS 89 -10.052 -3.925 -6.653 531 2HZ LYS 89 2HZ LYS 89 -9.172 -2.512 -7.010 532 3HZ LYS 89 3HZ LYS 89 -10.708 -2.788 -7.680 533 H GLU 90 H GLU 90 -8.826 0.714 0.351 534 HA GLU 90 HA GLU 90 -6.995 -0.977 1.773 535 1HB GLU 90 2HB GLU 90 -5.461 0.889 2.223 536 2HB GLU 90 1HB GLU 90 -5.468 0.400 0.529 537 1HG GLU 90 2HG GLU 90 -6.919 2.241 -0.026 538 2HG GLU 90 1HG GLU 90 -7.019 2.711 1.650 539 H ARG 91 H ARG 91 -7.035 -0.580 3.934 540 HA ARG 91 HA ARG 91 -8.447 1.738 5.004 541 1HB ARG 91 2HB ARG 91 -9.909 -0.314 5.240 542 2HB ARG 91 1HB ARG 91 -8.605 -1.077 6.134 543 1HG ARG 91 2HG ARG 91 -8.753 0.786 7.795 544 2HG ARG 91 1HG ARG 91 -10.194 1.346 6.951 545 1HD ARG 91 2HD ARG 91 -11.237 -0.865 7.353 546 2HD ARG 91 1HD ARG 91 -9.815 -1.336 8.281 547 HE ARG 91 HE ARG 91 -11.815 0.661 9.017 548 1HH1 ARG 91 1HH1 ARG 91 -8.907 -1.149 9.971 549 2HH1 ARG 91 2HH1 ARG 91 -9.158 -0.891 11.642 550 1HH2 ARG 91 1HH2 ARG 91 -12.114 0.971 11.344 551 2HH2 ARG 91 2HH2 ARG 91 -10.965 0.324 12.417 552 H ILE 92 H ILE 92 -7.224 2.621 6.604 553 HA ILE 92 HA ILE 92 -4.562 1.531 6.981 554 HB ILE 92 HB ILE 92 -5.915 3.837 8.412 555 1HG1 ILE 92 2HG1 ILE 92 -5.820 4.260 6.008 556 2HG1 ILE 92 1HG1 ILE 92 -4.716 5.320 6.870 557 1HG2 ILE 92 1HG2 ILE 92 -3.644 4.591 8.977 558 2HG2 ILE 92 2HG2 ILE 92 -2.986 3.125 8.249 559 3HG2 ILE 92 3HG2 ILE 92 -4.023 3.018 9.672 560 1HD1 ILE 92 1HD1 ILE 92 -2.844 3.939 6.181 561 2HD1 ILE 92 2HD1 ILE 92 -3.764 4.490 4.779 562 3HD1 ILE 92 3HD1 ILE 92 -3.936 2.831 5.353 563 H GLU 93 H GLU 93 -4.135 -0.008 8.421 564 HA GLU 93 HA GLU 93 -6.005 -0.443 10.642 565 1HB GLU 93 2HB GLU 93 -3.732 -2.159 9.669 566 2HB GLU 93 1HB GLU 93 -4.832 -2.576 10.970 567 1HG GLU 93 2HG GLU 93 -5.555 -2.167 8.085 568 2HG GLU 93 1HG GLU 93 -5.380 -3.712 8.916 569 H ALA 94 H ALA 94 -2.603 0.121 9.969 570 HA ALA 94 HA ALA 94 -2.184 1.263 12.567 571 1HB ALA 94 1HB ALA 94 -0.344 -0.270 13.156 572 2HB ALA 94 2HB ALA 94 -0.734 -1.261 11.748 573 3HB ALA 94 3HB ALA 94 -1.890 -1.118 13.075 574 H VAL 95 H VAL 95 -0.399 2.618 12.525 575 HA VAL 95 HA VAL 95 1.364 2.513 10.265 576 HB VAL 95 HB VAL 95 -0.441 3.938 9.409 577 1HG1 VAL 95 1HG1 VAL 95 0.046 5.706 11.795 578 2HG1 VAL 95 2HG1 VAL 95 -1.396 4.740 11.483 579 3HG1 VAL 95 3HG1 VAL 95 -0.995 6.095 10.425 580 1HG2 VAL 95 1HG2 VAL 95 1.836 4.478 8.718 581 2HG2 VAL 95 2HG2 VAL 95 2.018 5.542 10.112 582 3HG2 VAL 95 3HG2 VAL 95 0.862 5.946 8.842 583 H GLU 96 H GLU 96 3.309 2.891 10.893 584 HA GLU 96 HA GLU 96 3.747 4.266 13.462 585 1HB GLU 96 2HB GLU 96 5.464 2.185 12.116 586 2HB GLU 96 1HB GLU 96 5.843 2.987 13.612 587 1HG GLU 96 2HG GLU 96 3.532 1.136 13.142 588 2HG GLU 96 1HG GLU 96 5.015 0.776 14.027 589 HA PRO 97 HA PRO 97 5.688 7.077 10.527 590 1HB PRO 97 2HB PRO 97 6.282 9.026 12.360 591 2HB PRO 97 1HB PRO 97 4.706 8.865 11.583 592 1HG PRO 97 2HG PRO 97 5.569 8.007 14.307 593 2HG PRO 97 1HG PRO 97 4.020 8.683 13.779 594 1HD PRO 97 2HD PRO 97 4.414 6.040 14.267 595 2HD PRO 97 1HD PRO 97 3.220 6.652 13.104 596 H ASP 98 H ASP 98 7.036 6.386 13.748 597 HA ASP 98 HA ASP 98 9.691 7.017 12.839 598 1HB ASP 98 2HB ASP 98 9.097 7.557 15.133 599 2HB ASP 98 1HB ASP 98 8.761 5.864 15.473 600 H LYS 99 H LYS 99 7.883 4.055 13.477 601 HA LYS 99 HA LYS 99 10.198 2.379 12.966 602 1HB LYS 99 2HB LYS 99 7.292 1.651 13.195 603 2HB LYS 99 1HB LYS 99 8.607 0.516 13.002 604 1HG LYS 99 2HG LYS 99 9.543 1.304 15.142 605 2HG LYS 99 1HG LYS 99 8.111 2.320 15.350 606 1HD LYS 99 2HD LYS 99 6.690 0.360 15.146 607 2HD LYS 99 1HD LYS 99 8.153 -0.609 14.917 608 1HE LYS 99 2HE LYS 99 8.891 -0.104 17.176 609 2HE LYS 99 1HE LYS 99 7.509 0.962 17.424 610 1HZ LYS 99 1HZ LYS 99 7.196 -1.232 18.438 611 2HZ LYS 99 2HZ LYS 99 7.328 -1.981 16.947 612 3HZ LYS 99 3HZ LYS 99 6.032 -0.947 17.281 613 H ASN 100 H ASN 100 7.943 4.050 11.149 614 HA ASN 100 HA ASN 100 7.155 4.033 9.115 615 1HB ASN 100 2HB ASN 100 9.466 4.601 8.559 616 2HB ASN 100 1HB ASN 100 9.882 2.897 8.451 617 1HD2 ASN 100 1HD2 ASN 100 10.613 3.276 6.359 618 2HD2 ASN 100 2HD2 ASN 100 9.495 3.444 5.039 619 H LEU 101 H LEU 101 5.694 2.553 9.938 620 HA LEU 101 HA LEU 101 5.676 -0.018 8.492 621 1HB LEU 101 2HB LEU 101 6.188 -0.407 10.848 622 2HB LEU 101 1HB LEU 101 4.795 0.548 11.312 623 HG LEU 101 HG LEU 101 3.355 -1.133 10.173 624 1HD1 LEU 101 1HD1 LEU 101 5.892 -2.703 10.067 625 2HD1 LEU 101 2HD1 LEU 101 4.943 -2.094 8.704 626 3HD1 LEU 101 3HD1 LEU 101 4.261 -3.326 9.773 627 1HD2 LEU 101 1HD2 LEU 101 3.500 -2.761 11.972 628 2HD2 LEU 101 2HD2 LEU 101 3.591 -1.099 12.551 629 3HD2 LEU 101 3HD2 LEU 101 5.059 -2.081 12.459 630 H ILE 102 H ILE 102 3.742 -0.393 7.477 631 HA ILE 102 HA ILE 102 1.395 0.956 8.443 632 HB ILE 102 HB ILE 102 2.127 2.631 6.946 633 1HG1 ILE 102 2HG1 ILE 102 0.389 2.663 5.150 634 2HG1 ILE 102 1HG1 ILE 102 0.011 0.991 5.543 635 1HG2 ILE 102 1HG2 ILE 102 2.686 2.255 4.585 636 2HG2 ILE 102 2HG2 ILE 102 2.554 0.517 4.882 637 3HG2 ILE 102 3HG2 ILE 102 3.785 1.448 5.708 638 1HD1 ILE 102 1HD1 ILE 102 -1.581 2.481 6.537 639 2HD1 ILE 102 2HD1 ILE 102 -0.293 3.374 7.348 640 3HD1 ILE 102 3HD1 ILE 102 -0.633 1.702 7.804 641 H THR 103 H THR 103 -0.149 -0.372 8.551 642 HA THR 103 HA THR 103 -0.213 -2.788 6.903 643 HB THR 103 HB THR 103 -1.821 -2.066 9.366 644 HG1 THR 103 1HG THR 103 0.300 -3.908 8.977 645 1HG2 THR 103 1HG2 THR 103 -2.514 -4.436 9.356 646 2HG2 THR 103 2HG2 THR 103 -1.654 -4.674 7.835 647 3HG2 THR 103 3HG2 THR 103 -3.053 -3.603 7.897 648 H PHE 104 H PHE 104 -1.565 -2.960 5.231 649 HA PHE 104 HA PHE 104 -3.832 -1.122 4.962 650 1HB PHE 104 2HB PHE 104 -2.456 -2.877 2.919 651 2HB PHE 104 1HB PHE 104 -3.737 -1.763 2.532 652 HD1 PHE 104 1HD PHE 104 -3.241 0.745 2.959 653 HD2 PHE 104 2HD PHE 104 -0.253 -2.279 2.812 654 HE1 PHE 104 1HE PHE 104 -1.531 2.451 2.478 655 HE2 PHE 104 2HE PHE 104 1.449 -0.589 2.338 656 HZ PHE 104 HZ PHE 104 0.830 1.770 2.171 657 H ARG 105 H ARG 105 -5.846 -2.048 4.442 658 HA ARG 105 HA ARG 105 -6.133 -4.963 4.817 659 1HB ARG 105 2HB ARG 105 -6.667 -3.831 6.896 660 2HB ARG 105 1HB ARG 105 -7.764 -2.762 6.050 661 1HG ARG 105 2HG ARG 105 -9.165 -4.748 5.490 662 2HG ARG 105 1HG ARG 105 -8.094 -5.719 6.510 663 1HD ARG 105 2HD ARG 105 -8.579 -4.204 8.387 664 2HD ARG 105 1HD ARG 105 -9.682 -3.324 7.332 665 HE ARG 105 HE ARG 105 -10.794 -5.658 7.180 666 1HH1 ARG 105 1HH1 ARG 105 -9.301 -4.187 10.052 667 2HH1 ARG 105 2HH1 ARG 105 -10.383 -4.911 11.155 668 1HH2 ARG 105 1HH2 ARG 105 -12.311 -6.665 8.745 669 2HH2 ARG 105 2HH2 ARG 105 -12.085 -6.341 10.399 670 H VAL 106 H VAL 106 -7.754 -5.909 3.603 671 HA VAL 106 HA VAL 106 -8.878 -4.426 1.450 672 HB VAL 106 HB VAL 106 -8.236 -6.765 1.141 673 1HG1 VAL 106 1HG1 VAL 106 -9.371 -8.587 2.300 674 2HG1 VAL 106 2HG1 VAL 106 -10.324 -7.418 3.219 675 3HG1 VAL 106 3HG1 VAL 106 -8.582 -7.509 3.440 676 1HG2 VAL 106 1HG2 VAL 106 -10.097 -5.973 -0.220 677 2HG2 VAL 106 2HG2 VAL 106 -11.227 -6.402 1.061 678 3HG2 VAL 106 3HG2 VAL 106 -10.343 -7.669 0.216 679 H ILE 107 H ILE 107 -10.896 -3.643 1.324 680 HA ILE 107 HA ILE 107 -12.787 -4.223 3.500 681 HB ILE 107 HB ILE 107 -13.653 -1.931 3.524 682 1HG1 ILE 107 2HG1 ILE 107 -13.062 -1.303 1.165 683 2HG1 ILE 107 1HG1 ILE 107 -12.652 -0.068 2.341 684 1HG2 ILE 107 1HG2 ILE 107 -11.830 -0.792 4.609 685 2HG2 ILE 107 2HG2 ILE 107 -10.687 -1.896 3.874 686 3HG2 ILE 107 3HG2 ILE 107 -11.836 -2.503 5.084 687 1HD1 ILE 107 1HD1 ILE 107 -10.891 -0.235 0.729 688 2HD1 ILE 107 2HD1 ILE 107 -10.745 -1.973 0.972 689 3HD1 ILE 107 3HD1 ILE 107 -10.311 -0.854 2.261 690 H GLU 108 H GLU 108 -12.212 -3.795 0.207 691 HA GLU 108 HA GLU 108 -15.007 -3.553 -0.539 692 1HB GLU 108 2HB GLU 108 -13.216 -2.176 -1.568 693 2HB GLU 108 1HB GLU 108 -12.499 -3.669 -2.162 694 1HG GLU 108 2HG GLU 108 -13.714 -2.532 -3.917 695 2HG GLU 108 1HG GLU 108 -14.465 -4.074 -3.533 696 H GLY 109 H GLY 109 -16.051 -5.102 -1.743 697 1HA GLY 109 2HA GLY 109 -15.505 -7.801 -1.233 698 2HA GLY 109 1HA GLY 109 -16.684 -7.179 -2.370 699 H ASP 110 H ASP 110 -14.312 -5.772 -3.678 700 HA ASP 110 HA ASP 110 -13.991 -7.368 -5.921 701 1HB ASP 110 2HB ASP 110 -13.514 -5.029 -5.992 702 2HB ASP 110 1HB ASP 110 -12.246 -5.189 -4.794 703 H LEU 111 H LEU 111 -11.602 -6.936 -3.311 704 HA LEU 111 HA LEU 111 -10.013 -9.145 -4.244 705 1HB LEU 111 2HB LEU 111 -9.804 -7.534 -1.707 706 2HB LEU 111 1HB LEU 111 -8.650 -8.764 -2.193 707 HG LEU 111 HG LEU 111 -9.212 -6.190 -3.680 708 1HD1 LEU 111 1HD1 LEU 111 -6.984 -5.519 -2.943 709 2HD1 LEU 111 2HD1 LEU 111 -6.835 -7.008 -2.010 710 3HD1 LEU 111 3HD1 LEU 111 -8.049 -5.806 -1.571 711 1HD2 LEU 111 1HD2 LEU 111 -8.529 -7.992 -5.200 712 2HD2 LEU 111 2HD2 LEU 111 -7.141 -8.337 -4.171 713 3HD2 LEU 111 3HD2 LEU 111 -7.244 -6.798 -5.019 714 H MET 112 H MET 112 -12.662 -8.799 -2.154 715 HA MET 112 HA MET 112 -12.117 -10.951 -0.377 716 1HB MET 112 2HB MET 112 -14.741 -9.587 -0.984 717 2HB MET 112 1HB MET 112 -14.511 -10.750 0.291 718 1HG MET 112 2HG MET 112 -12.889 -8.226 0.246 719 2HG MET 112 1HG MET 112 -14.537 -8.199 0.832 720 1HE MET 112 1HE MET 112 -11.667 -11.047 1.448 721 2HE MET 112 2HE MET 112 -11.042 -10.422 2.961 722 3HE MET 112 3HE MET 112 -10.854 -9.479 1.484 723 H LYS 113 H LYS 113 -13.065 -11.001 -3.572 724 HA LYS 113 HA LYS 113 -14.517 -13.512 -3.261 725 1HB LYS 113 2HB LYS 113 -14.025 -11.868 -5.745 726 2HB LYS 113 1HB LYS 113 -14.934 -13.373 -5.701 727 1HG LYS 113 2HG LYS 113 -15.649 -10.832 -4.252 728 2HG LYS 113 1HG LYS 113 -16.435 -11.475 -5.698 729 1HD LYS 113 2HD LYS 113 -17.144 -13.447 -4.465 730 2HD LYS 113 1HD LYS 113 -16.304 -12.880 -3.027 731 1HE LYS 113 2HE LYS 113 -17.752 -10.897 -3.009 732 2HE LYS 113 1HE LYS 113 -18.651 -11.566 -4.374 733 1HZ LYS 113 1HZ LYS 113 -19.756 -12.075 -2.290 734 2HZ LYS 113 2HZ LYS 113 -18.364 -12.827 -1.701 735 3HZ LYS 113 3HZ LYS 113 -19.200 -13.489 -3.001 736 H GLU 114 H GLU 114 -11.476 -12.677 -3.322 737 HA GLU 114 HA GLU 114 -10.709 -15.240 -4.551 738 1HB GLU 114 2HB GLU 114 -8.972 -12.795 -4.140 739 2HB GLU 114 1HB GLU 114 -8.478 -14.295 -4.914 740 1HG GLU 114 2HG GLU 114 -10.183 -13.894 -6.653 741 2HG GLU 114 1HG GLU 114 -10.528 -12.344 -5.905 742 H TYR 115 H TYR 115 -10.313 -12.977 -1.902 743 HA TYR 115 HA TYR 115 -9.295 -15.141 -0.190 744 1HB TYR 115 2HB TYR 115 -8.592 -12.206 0.058 745 2HB TYR 115 1HB TYR 115 -7.837 -13.569 0.881 746 HD1 TYR 115 1HD TYR 115 -7.988 -11.583 -2.093 747 HD2 TYR 115 2HD TYR 115 -6.338 -15.098 -0.385 748 HE1 TYR 115 1HE TYR 115 -6.371 -11.730 -3.967 749 HE2 TYR 115 2HE TYR 115 -4.743 -15.265 -2.225 750 HH TYR 115 HH TYR 115 -4.234 -12.756 -4.475 751 H LYS 116 H LYS 116 -10.384 -15.201 1.721 752 HA LYS 116 HA LYS 116 -12.682 -13.417 1.876 753 1HB LYS 116 2HB LYS 116 -13.480 -15.015 3.654 754 2HB LYS 116 1HB LYS 116 -13.313 -15.698 2.044 755 1HG LYS 116 2HG LYS 116 -11.085 -16.546 2.748 756 2HG LYS 116 1HG LYS 116 -11.479 -16.060 4.402 757 1HD LYS 116 2HD LYS 116 -13.005 -18.020 2.680 758 2HD LYS 116 1HD LYS 116 -11.948 -18.426 4.027 759 1HE LYS 116 2HE LYS 116 -13.450 -17.296 5.565 760 2HE LYS 116 1HE LYS 116 -14.491 -16.815 4.222 761 1HZ LYS 116 1HZ LYS 116 -15.361 -18.761 5.329 762 2HZ LYS 116 2HZ LYS 116 -13.924 -19.609 5.061 763 3HZ LYS 116 3HZ LYS 116 -14.891 -19.149 3.761 764 H SER 117 H SER 117 -9.695 -13.347 2.877 765 HA SER 117 HA SER 117 -10.075 -11.120 4.539 766 1HB SER 117 2HB SER 117 -10.458 -12.760 6.195 767 2HB SER 117 1HB SER 117 -8.991 -13.670 5.778 768 HG SER 117 HG SER 117 -9.320 -11.358 7.315 769 H PHE 118 H PHE 118 -8.222 -9.865 4.389 770 HA PHE 118 HA PHE 118 -5.796 -11.010 3.386 771 1HB PHE 118 2HB PHE 118 -7.008 -10.884 1.303 772 2HB PHE 118 1HB PHE 118 -7.514 -9.236 1.631 773 HD1 PHE 118 1HD PHE 118 -4.548 -11.347 0.899 774 HD2 PHE 118 2HD PHE 118 -6.213 -7.432 0.892 775 HE1 PHE 118 1HE PHE 118 -2.608 -10.534 -0.330 776 HE2 PHE 118 2HE PHE 118 -4.264 -6.611 -0.361 777 HZ PHE 118 HZ PHE 118 -2.460 -8.156 -0.971 778 H LEU 119 H LEU 119 -4.284 -10.018 4.465 779 HA LEU 119 HA LEU 119 -4.456 -7.127 4.851 780 1HB LEU 119 2HB LEU 119 -3.456 -9.230 6.731 781 2HB LEU 119 1HB LEU 119 -2.990 -7.548 6.872 782 HG LEU 119 HG LEU 119 -5.778 -8.427 6.793 783 1HD1 LEU 119 1HD1 LEU 119 -3.970 -7.909 9.225 784 2HD1 LEU 119 2HD1 LEU 119 -4.596 -9.491 8.756 785 3HD1 LEU 119 3HD1 LEU 119 -5.698 -8.243 9.343 786 1HD2 LEU 119 1HD2 LEU 119 -5.456 -6.113 6.356 787 2HD2 LEU 119 2HD2 LEU 119 -4.453 -5.925 7.794 788 3HD2 LEU 119 3HD2 LEU 119 -6.175 -6.270 7.954 789 H LEU 120 H LEU 120 -2.720 -6.102 4.649 790 HA LEU 120 HA LEU 120 -0.235 -7.473 4.023 791 1HB LEU 120 2HB LEU 120 0.274 -6.270 1.962 792 2HB LEU 120 1HB LEU 120 -1.182 -7.211 1.786 793 HG LEU 120 HG LEU 120 -1.100 -4.211 2.177 794 1HD1 LEU 120 1HD1 LEU 120 -1.648 -4.078 -0.174 795 2HD1 LEU 120 2HD1 LEU 120 -1.558 -5.836 -0.319 796 3HD1 LEU 120 3HD1 LEU 120 -0.107 -4.902 0.066 797 1HD2 LEU 120 1HD2 LEU 120 -3.197 -5.188 2.944 798 2HD2 LEU 120 2HD2 LEU 120 -3.370 -6.064 1.429 799 3HD2 LEU 120 3HD2 LEU 120 -3.453 -4.299 1.444 800 H THR 121 H THR 121 1.410 -6.611 4.912 801 HA THR 121 HA THR 121 1.181 -3.829 5.829 802 HB THR 121 HB THR 121 2.379 -6.169 7.308 803 HG1 THR 121 1HG THR 121 -0.030 -5.644 6.999 804 1HG2 THR 121 1HG2 THR 121 3.510 -4.050 7.775 805 2HG2 THR 121 2HG2 THR 121 2.556 -4.571 9.171 806 3HG2 THR 121 3HG2 THR 121 1.960 -3.288 8.116 807 H ILE 122 H ILE 122 2.881 -2.575 5.354 808 HA ILE 122 HA ILE 122 5.278 -3.951 4.429 809 HB ILE 122 HB ILE 122 5.744 -2.069 2.947 810 1HG1 ILE 122 2HG1 ILE 122 3.006 -1.066 3.676 811 2HG1 ILE 122 1HG1 ILE 122 4.521 -0.324 4.178 812 1HG2 ILE 122 1HG2 ILE 122 4.566 -3.972 2.034 813 2HG2 ILE 122 2HG2 ILE 122 3.971 -2.485 1.295 814 3HG2 ILE 122 3HG2 ILE 122 3.022 -3.278 2.545 815 1HD1 ILE 122 1HD1 ILE 122 3.531 -0.590 1.341 816 2HD1 ILE 122 2HD1 ILE 122 5.060 0.139 1.827 817 3HD1 ILE 122 3HD1 ILE 122 3.535 0.885 2.308 818 H GLN 123 H GLN 123 7.185 -3.233 5.108 819 HA GLN 123 HA GLN 123 7.329 -0.801 6.651 820 1HB GLN 123 2HB GLN 123 6.920 -2.635 8.294 821 2HB GLN 123 1HB GLN 123 8.362 -3.443 7.705 822 1HG GLN 123 2HG GLN 123 9.783 -1.785 8.568 823 2HG GLN 123 1HG GLN 123 8.452 -0.662 8.817 824 1HE2 GLN 123 1HE2 GLN 123 8.900 -0.363 10.925 825 2HE2 GLN 123 2HE2 GLN 123 8.613 -1.566 12.141 826 H VAL 124 H VAL 124 9.210 0.215 6.368 827 HA VAL 124 HA VAL 124 10.884 -1.008 4.286 828 HB VAL 124 HB VAL 124 10.451 1.927 4.837 829 1HG1 VAL 124 1HG1 VAL 124 11.431 2.278 2.648 830 2HG1 VAL 124 2HG1 VAL 124 11.718 0.543 2.501 831 3HG1 VAL 124 3HG1 VAL 124 12.542 1.475 3.754 832 1HG2 VAL 124 1HG2 VAL 124 8.360 0.923 4.102 833 2HG2 VAL 124 2HG2 VAL 124 9.182 0.208 2.715 834 3HG2 VAL 124 3HG2 VAL 124 9.027 1.960 2.840 835 H THR 125 H THR 125 12.986 -1.257 4.628 836 HA THR 125 HA THR 125 14.319 0.225 6.768 837 HB THR 125 HB THR 125 13.634 -2.123 7.576 838 HG1 THR 125 1HG THR 125 15.409 -1.166 8.517 839 1HG2 THR 125 1HG2 THR 125 13.918 -3.282 5.418 840 2HG2 THR 125 2HG2 THR 125 14.885 -4.045 6.694 841 3HG2 THR 125 3HG2 THR 125 15.657 -2.962 5.535 842 HA PRO 126 HA PRO 126 17.446 1.154 3.680 843 1HB PRO 126 2HB PRO 126 19.742 0.366 5.027 844 2HB PRO 126 1HB PRO 126 18.932 1.928 5.213 845 1HG PRO 126 2HG PRO 126 18.551 -0.584 6.820 846 2HG PRO 126 1HG PRO 126 18.838 1.075 7.434 847 1HD PRO 126 2HD PRO 126 16.437 0.135 7.456 848 2HD PRO 126 1HD PRO 126 16.672 1.737 6.705 849 H LYS 127 H LYS 127 18.782 0.264 2.116 850 HA LYS 127 HA LYS 127 18.566 -2.567 1.676 851 1HB LYS 127 2HB LYS 127 19.930 -0.373 0.110 852 2HB LYS 127 1HB LYS 127 19.992 -2.067 -0.353 853 1HG LYS 127 2HG LYS 127 17.613 -2.122 -0.567 854 2HG LYS 127 1HG LYS 127 17.481 -0.432 -0.069 855 1HD LYS 127 2HD LYS 127 17.271 -0.690 -2.452 856 2HD LYS 127 1HD LYS 127 18.735 0.216 -2.062 857 1HE LYS 127 2HE LYS 127 20.074 -1.818 -2.368 858 2HE LYS 127 1HE LYS 127 18.609 -2.727 -2.748 859 1HZ LYS 127 1HZ LYS 127 19.898 -2.031 -4.687 860 2HZ LYS 127 2HZ LYS 127 19.594 -0.407 -4.306 861 3HZ LYS 127 3HZ LYS 127 18.316 -1.441 -4.708 862 HA PRO 128 HA PRO 128 22.482 -3.833 3.325 863 1HB PRO 128 2HB PRO 128 23.127 -5.782 1.481 864 2HB PRO 128 1HB PRO 128 22.004 -6.042 2.823 865 1HG PRO 128 2HG PRO 128 21.427 -5.430 -0.042 866 2HG PRO 128 1HG PRO 128 20.605 -6.558 1.050 867 1HD PRO 128 2HD PRO 128 19.575 -4.148 0.464 868 2HD PRO 128 1HD PRO 128 19.385 -4.876 2.070 869 H GLY 129 H GLY 129 23.788 -2.096 2.989 870 1HA GLY 129 2HA GLY 129 25.961 -1.809 1.757 871 2HA GLY 129 1HA GLY 129 24.935 -1.767 0.322 872 H GLY 130 H GLY 130 22.785 -0.365 1.776 873 1HA GLY 130 2HA GLY 130 22.865 1.793 3.032 874 2HA GLY 130 1HA GLY 130 24.081 2.271 1.862 875 HA PRO 131 HA PRO 131 21.325 4.465 -0.657 876 1HB PRO 131 2HB PRO 131 21.774 3.270 -3.161 877 2HB PRO 131 1HB PRO 131 22.658 4.636 -2.473 878 1HG PRO 131 2HG PRO 131 23.336 1.730 -2.457 879 2HG PRO 131 1HG PRO 131 24.413 3.128 -2.658 880 1HD PRO 131 2HD PRO 131 24.339 1.829 -0.349 881 2HD PRO 131 1HD PRO 131 24.388 3.607 -0.355 882 H GLY 132 H GLY 132 19.247 4.216 -0.362 883 1HA GLY 132 2HA GLY 132 17.148 3.641 -1.297 884 2HA GLY 132 1HA GLY 132 17.865 2.154 -1.904 885 H SER 133 H SER 133 15.732 1.445 -0.843 886 HA SER 133 HA SER 133 16.509 0.218 1.613 887 1HB SER 133 2HB SER 133 14.444 0.983 2.824 888 2HB SER 133 1HB SER 133 15.666 2.219 2.571 889 HG SER 133 HG SER 133 14.389 2.894 0.713 890 H ILE 134 H ILE 134 15.093 -1.503 2.281 891 HA ILE 134 HA ILE 134 13.633 -2.593 0.042 892 HB ILE 134 HB ILE 134 15.033 -3.887 2.355 893 1HG1 ILE 134 2HG1 ILE 134 15.516 -5.671 0.724 894 2HG1 ILE 134 1HG1 ILE 134 14.550 -4.816 -0.464 895 1HG2 ILE 134 1HG2 ILE 134 13.822 -5.964 2.166 896 2HG2 ILE 134 2HG2 ILE 134 12.616 -5.151 1.166 897 3HG2 ILE 134 3HG2 ILE 134 12.848 -4.649 2.852 898 1HD1 ILE 134 1HD1 ILE 134 15.990 -3.002 -0.337 899 2HD1 ILE 134 2HD1 ILE 134 16.849 -4.491 -0.800 900 3HD1 ILE 134 3HD1 ILE 134 17.008 -3.822 0.860 901 H VAL 135 H VAL 135 11.500 -2.587 0.101 902 HA VAL 135 HA VAL 135 10.172 -2.113 2.622 903 HB VAL 135 HB VAL 135 9.367 -0.708 0.765 904 1HG1 VAL 135 1HG1 VAL 135 8.702 -3.228 -0.674 905 2HG1 VAL 135 2HG1 VAL 135 9.951 -2.064 -1.117 906 3HG1 VAL 135 3HG1 VAL 135 8.247 -1.600 -1.182 907 1HG2 VAL 135 1HG2 VAL 135 7.340 -2.808 1.488 908 2HG2 VAL 135 2HG2 VAL 135 6.977 -1.209 0.834 909 3HG2 VAL 135 3HG2 VAL 135 7.727 -1.365 2.424 910 H HIS 136 H HIS 136 9.532 -3.734 3.759 911 HA HIS 136 HA HIS 136 9.481 -6.376 2.543 912 1HB HIS 136 2HB HIS 136 9.276 -5.512 5.430 913 2HB HIS 136 1HB HIS 136 9.033 -7.171 4.917 914 HD1 HIS 136 1HD HIS 136 11.115 -8.540 4.346 915 HD2 HIS 136 2HD HIS 136 11.923 -4.583 5.332 916 HE1 HIS 136 1HE HIS 136 13.594 -8.418 4.648 917 HE2 HIS 136 2HE HIS 136 13.943 -6.156 5.647 918 H TRP 137 H TRP 137 7.716 -6.957 1.596 919 HA TRP 137 HA TRP 137 5.172 -5.946 2.520 920 1HB TRP 137 2HB TRP 137 5.931 -7.723 0.188 921 2HB TRP 137 1HB TRP 137 4.313 -7.196 0.577 922 HD1 TRP 137 HD TRP 137 7.712 -5.529 -0.465 923 HE1 TRP 137 1HE TRP 137 7.111 -3.438 -1.787 924 HE3 TRP 137 3HE TRP 137 2.626 -5.658 0.034 925 HZ2 TRP 137 2HZ TRP 137 4.889 -2.024 -2.508 926 HZ3 TRP 137 3HZ TRP 137 1.316 -3.895 -0.998 927 HH2 TRP 137 HH TRP 137 2.389 -2.086 -2.249 928 H HIS 138 H HIS 138 4.089 -7.030 3.954 929 HA HIS 138 HA HIS 138 4.527 -9.938 4.149 930 1HB HIS 138 2HB HIS 138 3.463 -8.106 6.324 931 2HB HIS 138 1HB HIS 138 3.930 -9.785 6.504 932 HD1 HIS 138 1HD HIS 138 6.670 -10.229 6.419 933 HD2 HIS 138 2HD HIS 138 5.371 -6.287 6.773 934 HE1 HIS 138 1HE HIS 138 8.635 -8.961 7.187 935 HE2 HIS 138 2HE HIS 138 7.784 -6.669 7.680 936 H LEU 139 H LEU 139 2.836 -10.853 3.129 937 HA LEU 139 HA LEU 139 0.245 -9.524 3.391 938 1HB LEU 139 2HB LEU 139 1.141 -11.495 1.266 939 2HB LEU 139 1HB LEU 139 -0.441 -10.770 1.367 940 HG LEU 139 HG LEU 139 0.755 -8.504 0.946 941 1HD1 LEU 139 1HD1 LEU 139 3.001 -9.136 1.478 942 2HD1 LEU 139 2HD1 LEU 139 2.867 -8.580 -0.196 943 3HD1 LEU 139 3HD1 LEU 139 3.006 -10.300 0.153 944 1HD2 LEU 139 1HD2 LEU 139 0.809 -10.617 -1.195 945 2HD2 LEU 139 2HD2 LEU 139 0.837 -8.875 -1.458 946 3HD2 LEU 139 3HD2 LEU 139 -0.584 -9.633 -0.741 947 H GLU 140 H GLU 140 -1.229 -10.545 4.525 948 HA GLU 140 HA GLU 140 -0.877 -13.421 5.051 949 1HB GLU 140 2HB GLU 140 -0.251 -11.994 7.019 950 2HB GLU 140 1HB GLU 140 -1.864 -11.306 6.984 951 1HG GLU 140 2HG GLU 140 -2.803 -13.520 7.468 952 2HG GLU 140 1HG GLU 140 -1.168 -14.183 7.515 953 H TYR 141 H TYR 141 -2.699 -14.551 4.521 954 HA TYR 141 HA TYR 141 -5.221 -13.168 4.444 955 1HB TYR 141 2HB TYR 141 -5.559 -13.635 1.980 956 2HB TYR 141 1HB TYR 141 -4.422 -12.366 2.438 957 HD1 TYR 141 1HD TYR 141 -2.069 -12.562 1.962 958 HD2 TYR 141 2HD TYR 141 -4.724 -15.728 1.012 959 HE1 TYR 141 1HE TYR 141 -0.303 -13.625 0.627 960 HE2 TYR 141 2HE TYR 141 -2.982 -16.789 -0.334 961 HH TYR 141 HH TYR 141 0.276 -15.865 -0.219 962 H GLU 142 H GLU 142 -6.995 -14.455 3.792 963 HA GLU 142 HA GLU 142 -6.629 -17.300 4.502 964 1HB GLU 142 2HB GLU 142 -7.977 -15.879 6.063 965 2HB GLU 142 1HB GLU 142 -9.046 -15.489 4.735 966 1HG GLU 142 2HG GLU 142 -10.131 -17.094 6.105 967 2HG GLU 142 1HG GLU 142 -9.671 -17.886 4.610 968 H LYS 143 H LYS 143 -6.737 -18.554 2.656 969 HA LYS 143 HA LYS 143 -7.798 -17.665 0.194 970 1HB LYS 143 2HB LYS 143 -7.063 -20.399 1.209 971 2HB LYS 143 1HB LYS 143 -7.868 -20.207 -0.322 972 1HG LYS 143 2HG LYS 143 -5.525 -20.531 -0.666 973 2HG LYS 143 1HG LYS 143 -5.944 -18.888 -1.119 974 1HD LYS 143 2HD LYS 143 -4.954 -18.033 0.873 975 2HD LYS 143 1HD LYS 143 -4.733 -19.663 1.521 976 1HE LYS 143 2HE LYS 143 -3.519 -18.678 -1.031 977 2HE LYS 143 1HE LYS 143 -2.666 -18.660 0.521 978 1HZ LYS 143 1HZ LYS 143 -2.100 -20.634 -0.824 979 2HZ LYS 143 2HZ LYS 143 -3.702 -21.125 -0.860 980 3HZ LYS 143 3HZ LYS 143 -2.877 -21.075 0.604 981 H ILE 144 H ILE 144 -9.860 -17.955 -0.647 982 HA ILE 144 HA ILE 144 -11.923 -19.103 1.011 983 HB ILE 144 HB ILE 144 -11.930 -18.455 -1.958 984 1HG1 ILE 144 2HG1 ILE 144 -12.972 -16.842 0.362 985 2HG1 ILE 144 1HG1 ILE 144 -11.520 -16.479 -0.563 986 1HG2 ILE 144 1HG2 ILE 144 -14.244 -18.995 -0.088 987 2HG2 ILE 144 2HG2 ILE 144 -13.685 -20.056 -1.378 988 3HG2 ILE 144 3HG2 ILE 144 -14.393 -18.485 -1.770 989 1HD1 ILE 144 1HD1 ILE 144 -13.328 -15.071 -1.263 990 2HD1 ILE 144 2HD1 ILE 144 -14.340 -16.488 -1.587 991 3HD1 ILE 144 3HD1 ILE 144 -12.901 -16.212 -2.562 992 H SER 145 H SER 145 -9.855 -19.929 -1.610 993 HA SER 145 HA SER 145 -9.744 -22.649 -1.110 994 1HB SER 145 2HB SER 145 -11.937 -22.601 -2.325 995 2HB SER 145 1HB SER 145 -11.169 -21.754 -3.663 996 HG SER 145 HG SER 145 -10.483 -23.562 -4.381 997 H GLU 146 H GLU 146 -8.357 -23.488 -3.160 998 HA GLU 146 HA GLU 146 -6.095 -21.802 -3.120 999 1HB GLU 146 2HB GLU 146 -6.738 -24.349 -4.366 1000 2HB GLU 146 1HB GLU 146 -5.226 -23.549 -4.769 1001 1HG GLU 146 2HG GLU 146 -6.105 -24.305 -1.973 1002 2HG GLU 146 1HG GLU 146 -4.895 -25.174 -2.927 1003 H GLU 147 H GLU 147 -7.834 -23.152 -5.886 1004 HA GLU 147 HA GLU 147 -6.430 -21.619 -7.780 1005 1HB GLU 147 2HB GLU 147 -7.991 -22.498 -9.458 1006 2HB GLU 147 1HB GLU 147 -7.394 -23.766 -8.408 1007 1HG GLU 147 2HG GLU 147 -10.123 -22.475 -8.265 1008 2HG GLU 147 1HG GLU 147 -9.766 -24.056 -8.947 1009 H VAL 148 H VAL 148 -9.051 -20.899 -5.874 1010 HA VAL 148 HA VAL 148 -10.087 -18.802 -7.621 1011 HB VAL 148 HB VAL 148 -11.639 -19.933 -5.938 1012 1HG1 VAL 148 1HG1 VAL 148 -10.231 -18.268 -3.917 1013 2HG1 VAL 148 2HG1 VAL 148 -10.100 -20.019 -4.073 1014 3HG1 VAL 148 3HG1 VAL 148 -11.657 -19.283 -3.681 1015 1HG2 VAL 148 1HG2 VAL 148 -11.450 -16.937 -5.713 1016 2HG2 VAL 148 2HG2 VAL 148 -12.854 -17.918 -5.294 1017 3HG2 VAL 148 3HG2 VAL 148 -12.299 -17.840 -6.965 1018 H ALA 149 H ALA 149 -7.737 -19.054 -5.127 1019 HA ALA 149 HA ALA 149 -7.405 -16.175 -4.863 1020 1HB ALA 149 1HB ALA 149 -7.314 -17.535 -2.831 1021 2HB ALA 149 2HB ALA 149 -5.742 -16.805 -3.155 1022 3HB ALA 149 3HB ALA 149 -6.016 -18.506 -3.527 1023 H HIS 150 H HIS 150 -5.374 -15.173 -5.482 1024 HA HIS 150 HA HIS 150 -3.631 -16.861 -7.068 1025 1HB HIS 150 2HB HIS 150 -5.051 -14.444 -8.174 1026 2HB HIS 150 1HB HIS 150 -3.597 -15.089 -8.912 1027 HD1 HIS 150 1HD HIS 150 -3.834 -17.265 -10.288 1028 HD2 HIS 150 2HD HIS 150 -7.352 -16.069 -8.420 1029 HE1 HIS 150 1HE HIS 150 -5.626 -18.692 -11.262 1030 HE2 HIS 150 2HE HIS 150 -7.585 -18.247 -9.786 1031 HA PRO 151 HA PRO 151 -0.958 -14.325 -4.350 1032 1HB PRO 151 2HB PRO 151 0.861 -16.504 -5.287 1033 2HB PRO 151 1HB PRO 151 0.633 -15.862 -3.655 1034 1HG PRO 151 2HG PRO 151 -0.392 -18.220 -4.301 1035 2HG PRO 151 1HG PRO 151 -1.309 -17.085 -3.298 1036 1HD PRO 151 2HD PRO 151 -1.654 -17.750 -6.195 1037 2HD PRO 151 1HD PRO 151 -2.873 -17.430 -4.939 1038 H GLU 152 H GLU 152 -0.665 -15.552 -7.506 1039 HA GLU 152 HA GLU 152 1.583 -14.256 -8.515 1040 1HB GLU 152 2HB GLU 152 0.435 -14.502 -10.690 1041 2HB GLU 152 1HB GLU 152 0.605 -16.021 -9.762 1042 1HG GLU 152 2HG GLU 152 -1.749 -15.674 -9.065 1043 2HG GLU 152 1HG GLU 152 -1.835 -14.300 -10.168 1044 H THR 153 H THR 153 -1.771 -13.076 -8.190 1045 HA THR 153 HA THR 153 -1.203 -10.686 -9.653 1046 HB THR 153 HB THR 153 -3.510 -10.027 -9.033 1047 HG1 THR 153 1HG THR 153 -4.717 -11.380 -7.691 1048 1HG2 THR 153 1HG2 THR 153 -3.200 -11.557 -10.937 1049 2HG2 THR 153 2HG2 THR 153 -4.716 -11.885 -10.090 1050 3HG2 THR 153 3HG2 THR 153 -3.318 -12.926 -9.832 1051 H LEU 154 H LEU 154 -1.184 -11.839 -6.480 1052 HA LEU 154 HA LEU 154 -1.254 -9.376 -5.039 1053 1HB LEU 154 2HB LEU 154 0.080 -11.959 -4.223 1054 2HB LEU 154 1HB LEU 154 -0.242 -10.603 -3.166 1055 HG LEU 154 HG LEU 154 -2.307 -12.363 -4.485 1056 1HD1 LEU 154 1HD1 LEU 154 -2.775 -13.101 -2.220 1057 2HD1 LEU 154 2HD1 LEU 154 -1.499 -12.055 -1.604 1058 3HD1 LEU 154 3HD1 LEU 154 -1.086 -13.418 -2.631 1059 1HD2 LEU 154 1HD2 LEU 154 -3.116 -10.040 -4.264 1060 2HD2 LEU 154 2HD2 LEU 154 -2.654 -10.080 -2.555 1061 3HD2 LEU 154 3HD2 LEU 154 -3.932 -11.131 -3.144 1062 H LEU 155 H LEU 155 1.445 -11.347 -6.192 1063 HA LEU 155 HA LEU 155 3.477 -9.635 -5.343 1064 1HB LEU 155 2HB LEU 155 3.401 -11.494 -7.698 1065 2HB LEU 155 1HB LEU 155 4.837 -10.612 -7.220 1066 HG LEU 155 HG LEU 155 3.395 -12.647 -5.520 1067 1HD1 LEU 155 1HD1 LEU 155 6.048 -12.718 -6.902 1068 2HD1 LEU 155 2HD1 LEU 155 4.607 -13.616 -7.421 1069 3HD1 LEU 155 3HD1 LEU 155 5.387 -13.983 -5.870 1070 1HD2 LEU 155 1HD2 LEU 155 5.914 -11.068 -5.060 1071 2HD2 LEU 155 2HD2 LEU 155 5.366 -12.409 -4.063 1072 3HD2 LEU 155 3HD2 LEU 155 4.416 -10.925 -4.148 1073 H GLN 156 H GLN 156 1.675 -9.621 -8.358 1074 HA GLN 156 HA GLN 156 3.075 -7.469 -9.497 1075 1HB GLN 156 2HB GLN 156 0.285 -8.475 -9.990 1076 2HB GLN 156 1HB GLN 156 1.012 -7.188 -10.932 1077 1HG GLN 156 2HG GLN 156 2.001 -10.006 -10.694 1078 2HG GLN 156 1HG GLN 156 1.197 -9.280 -12.092 1079 1HE2 GLN 156 1HE2 GLN 156 4.137 -9.534 -10.293 1080 2HE2 GLN 156 2HE2 GLN 156 5.140 -8.709 -11.422 1081 H PHE 157 H PHE 157 0.157 -7.544 -7.515 1082 HA PHE 157 HA PHE 157 -0.392 -4.810 -7.558 1083 1HB PHE 157 2HB PHE 157 -1.976 -6.498 -6.693 1084 2HB PHE 157 1HB PHE 157 -0.910 -6.809 -5.333 1085 HD1 PHE 157 1HD PHE 157 -1.211 -5.620 -3.346 1086 HD2 PHE 157 2HD PHE 157 -2.895 -4.113 -6.950 1087 HE1 PHE 157 1HE PHE 157 -2.410 -3.853 -2.056 1088 HE2 PHE 157 2HE PHE 157 -4.082 -2.372 -5.675 1089 HZ PHE 157 HZ PHE 157 -3.832 -2.244 -3.233 1090 H CYS 158 H CYS 158 1.811 -6.701 -5.575 1091 HA CYS 158 HA CYS 158 2.569 -4.601 -3.840 1092 1HB CYS 158 2HB CYS 158 4.155 -7.042 -4.679 1093 2HB CYS 158 1HB CYS 158 4.526 -6.007 -3.307 1094 HG CYS 158 HG CYS 158 1.743 -7.922 -3.664 1095 H VAL 159 H VAL 159 3.912 -5.819 -6.862 1096 HA VAL 159 HA VAL 159 6.157 -4.166 -6.977 1097 HB VAL 159 HB VAL 159 4.590 -5.384 -9.267 1098 1HG1 VAL 159 1HG1 VAL 159 7.383 -4.240 -9.215 1099 2HG1 VAL 159 2HG1 VAL 159 5.980 -3.569 -10.050 1100 3HG1 VAL 159 3HG1 VAL 159 6.652 -5.114 -10.570 1101 1HG2 VAL 159 1HG2 VAL 159 7.055 -6.330 -7.828 1102 2HG2 VAL 159 2HG2 VAL 159 6.309 -7.107 -9.230 1103 3HG2 VAL 159 3HG2 VAL 159 5.439 -7.023 -7.699 1104 H GLU 160 H GLU 160 2.922 -3.693 -8.335 1105 HA GLU 160 HA GLU 160 3.598 -1.291 -9.667 1106 1HB GLU 160 2HB GLU 160 1.167 -0.912 -9.927 1107 2HB GLU 160 1HB GLU 160 1.666 -2.525 -10.403 1108 1HG GLU 160 2HG GLU 160 0.866 -3.355 -8.220 1109 2HG GLU 160 1HG GLU 160 0.279 -1.736 -7.854 1110 H VAL 161 H VAL 161 2.335 -1.866 -6.465 1111 HA VAL 161 HA VAL 161 2.030 0.886 -5.843 1112 HB VAL 161 HB VAL 161 2.237 -1.522 -4.029 1113 1HG1 VAL 161 1HG1 VAL 161 1.251 -0.069 -2.263 1114 2HG1 VAL 161 2HG1 VAL 161 1.348 1.308 -3.362 1115 3HG1 VAL 161 3HG1 VAL 161 2.825 0.531 -2.790 1116 1HG2 VAL 161 1HG2 VAL 161 0.300 -1.584 -5.477 1117 2HG2 VAL 161 2HG2 VAL 161 -0.156 0.046 -4.982 1118 3HG2 VAL 161 3HG2 VAL 161 -0.209 -1.273 -3.814 1119 H SER 162 H SER 162 4.695 -1.407 -5.579 1120 HA SER 162 HA SER 162 6.401 0.005 -3.934 1121 1HB SER 162 2HB SER 162 7.070 -1.695 -6.328 1122 2HB SER 162 1HB SER 162 8.231 -1.166 -5.104 1123 HG SER 162 HG SER 162 5.929 -2.799 -4.675 1124 H LYS 163 H LYS 163 5.745 0.555 -7.365 1125 HA LYS 163 HA LYS 163 7.776 2.541 -7.694 1126 1HB LYS 163 2HB LYS 163 5.216 2.130 -9.246 1127 2HB LYS 163 1HB LYS 163 6.370 3.384 -9.635 1128 1HG LYS 163 2HG LYS 163 6.650 1.573 -11.162 1129 2HG LYS 163 1HG LYS 163 8.046 1.604 -10.092 1130 1HD LYS 163 2HD LYS 163 7.149 -0.235 -8.824 1131 2HD LYS 163 1HD LYS 163 5.668 -0.210 -9.775 1132 1HE LYS 163 2HE LYS 163 8.428 -0.779 -10.850 1133 2HE LYS 163 1HE LYS 163 7.197 -1.990 -10.496 1134 1HZ LYS 163 1HZ LYS 163 7.003 0.172 -12.529 1135 2HZ LYS 163 2HZ LYS 163 5.767 -0.910 -12.165 1136 3HZ LYS 163 3HZ LYS 163 7.212 -1.454 -12.841 1137 H GLU 164 H GLU 164 4.401 2.631 -6.801 1138 HA GLU 164 HA GLU 164 3.914 5.369 -6.881 1139 1HB GLU 164 2HB GLU 164 2.210 3.544 -6.597 1140 2HB GLU 164 1HB GLU 164 2.782 3.377 -4.939 1141 1HG GLU 164 2HG GLU 164 0.721 4.673 -5.056 1142 2HG GLU 164 1HG GLU 164 2.065 5.628 -4.424 1143 H ILE 165 H ILE 165 4.956 3.352 -4.184 1144 HA ILE 165 HA ILE 165 5.104 5.513 -2.368 1145 HB ILE 165 HB ILE 165 4.670 3.208 -1.685 1146 1HG1 ILE 165 2HG1 ILE 165 5.675 4.794 0.019 1147 2HG1 ILE 165 1HG1 ILE 165 5.898 3.095 0.394 1148 1HG2 ILE 165 1HG2 ILE 165 6.432 1.505 -1.500 1149 2HG2 ILE 165 2HG2 ILE 165 7.492 2.566 -2.427 1150 3HG2 ILE 165 3HG2 ILE 165 6.009 1.948 -3.155 1151 1HD1 ILE 165 1HD1 ILE 165 7.983 4.937 -0.779 1152 2HD1 ILE 165 2HD1 ILE 165 8.219 3.247 -0.351 1153 3HD1 ILE 165 3HD1 ILE 165 7.883 4.429 0.914 1154 H ASP 166 H ASP 166 7.490 3.839 -4.317 1155 HA ASP 166 HA ASP 166 9.760 5.164 -3.271 1156 1HB ASP 166 2HB ASP 166 9.898 3.052 -4.537 1157 2HB ASP 166 1HB ASP 166 9.386 3.886 -5.990 1158 H GLU 167 H GLU 167 7.848 5.850 -6.208 1159 HA GLU 167 HA GLU 167 9.188 8.270 -6.993 1160 1HB GLU 167 2HB GLU 167 6.319 7.416 -7.434 1161 2HB GLU 167 1HB GLU 167 7.101 8.772 -8.224 1162 1HG GLU 167 2HG GLU 167 7.891 5.877 -8.526 1163 2HG GLU 167 1HG GLU 167 6.915 6.791 -9.666 1164 H HIS 168 H HIS 168 6.717 7.695 -4.628 1165 HA HIS 168 HA HIS 168 6.004 10.405 -4.283 1166 1HB HIS 168 2HB HIS 168 4.666 8.512 -3.368 1167 2HB HIS 168 1HB HIS 168 5.955 8.172 -2.228 1168 HD1 HIS 168 1HD HIS 168 2.884 10.063 -2.602 1169 HD2 HIS 168 2HD HIS 168 6.301 10.376 -0.273 1170 HE1 HIS 168 1HE HIS 168 2.268 11.579 -0.687 1171 HE2 HIS 168 2HE HIS 168 4.442 11.918 0.560 1172 H LEU 169 H LEU 169 8.431 8.366 -2.678 1173 HA LEU 169 HA LEU 169 9.341 10.516 -1.053 1174 1HB LEU 169 2HB LEU 169 10.278 7.715 -1.471 1175 2HB LEU 169 1HB LEU 169 11.250 8.865 -0.584 1176 HG LEU 169 HG LEU 169 9.990 7.406 0.875 1177 1HD1 LEU 169 1HD1 LEU 169 9.116 10.284 0.972 1178 2HD1 LEU 169 2HD1 LEU 169 10.548 9.549 1.715 1179 3HD1 LEU 169 3HD1 LEU 169 8.936 9.115 2.281 1180 1HD2 LEU 169 1HD2 LEU 169 8.035 6.980 -0.484 1181 2HD2 LEU 169 2HD2 LEU 169 7.521 8.654 -0.311 1182 3HD2 LEU 169 3HD2 LEU 169 7.556 7.589 1.100 1183 H LEU 170 H LEU 170 10.306 9.271 -4.144 1184 HA LEU 170 HA LEU 170 12.822 10.699 -4.069 1185 1HB LEU 170 2HB LEU 170 11.374 9.465 -6.397 1186 2HB LEU 170 1HB LEU 170 13.025 10.050 -6.415 1187 HG LEU 170 HG LEU 170 11.991 7.725 -4.804 1188 1HD1 LEU 170 1HD1 LEU 170 12.098 7.378 -7.224 1189 2HD1 LEU 170 2HD1 LEU 170 13.212 6.354 -6.335 1190 3HD1 LEU 170 3HD1 LEU 170 13.812 7.782 -7.193 1191 1HD2 LEU 170 1HD2 LEU 170 14.363 7.319 -4.297 1192 2HD2 LEU 170 2HD2 LEU 170 13.812 8.847 -3.632 1193 3HD2 LEU 170 3HD2 LEU 170 14.795 8.827 -5.101 1194 H ALA 171 H ALA 171 9.662 11.069 -5.524 1195 HA ALA 171 HA ALA 171 8.677 12.616 -6.702 1196 1HB ALA 171 1HB ALA 171 8.333 14.679 -5.570 1197 2HB ALA 171 2HB ALA 171 9.832 14.449 -4.635 1198 3HB ALA 171 3HB ALA 171 8.471 13.334 -4.424 1199 H GLU 172 H GLU 172 9.953 12.213 -8.439 1200 HA GLU 172 HA GLU 172 11.278 14.611 -9.467 1201 1HB GLU 172 2HB GLU 172 12.157 11.727 -9.797 1202 2HB GLU 172 1HB GLU 172 12.821 13.073 -10.709 1203 1HG GLU 172 2HG GLU 172 13.661 14.051 -8.645 1204 2HG GLU 172 1HG GLU 172 12.993 12.695 -7.733 1205 H GLU 173 H GLU 173 11.665 13.384 -12.021 1206 HA GLU 173 HA GLU 173 9.016 13.545 -12.997 1207 1HB GLU 173 2HB GLU 173 10.111 13.284 -15.225 1208 2HB GLU 173 1HB GLU 173 10.766 14.592 -14.264 1209 1HG GLU 173 2HG GLU 173 12.654 13.138 -13.638 1210 2HG GLU 173 1HG GLU 173 12.007 11.887 -14.695 Start of MODEL 6 1 H THR 17 H THR 17 -16.802 -24.856 9.624 2 HA THR 17 HA THR 17 -14.594 -25.291 11.499 3 HB THR 17 HB THR 17 -16.501 -26.807 11.920 4 HG1 THR 17 1HG THR 17 -14.067 -27.827 10.996 5 1HG2 THR 17 1HG2 THR 17 -16.007 -27.850 9.123 6 2HG2 THR 17 2HG2 THR 17 -17.419 -26.937 9.650 7 3HG2 THR 17 3HG2 THR 17 -17.119 -28.549 10.297 8 H GLU 18 H GLU 18 -14.968 -24.497 8.429 9 HA GLU 18 HA GLU 18 -12.503 -25.837 7.609 10 1HB GLU 18 2HB GLU 18 -14.914 -25.426 5.810 11 2HB GLU 18 1HB GLU 18 -13.357 -26.041 5.310 12 1HG GLU 18 2HG GLU 18 -13.692 -28.021 6.670 13 2HG GLU 18 1HG GLU 18 -15.233 -27.375 7.237 14 H ALA 19 H ALA 19 -11.635 -24.641 5.609 15 HA ALA 19 HA ALA 19 -10.913 -22.849 4.491 16 1HB ALA 19 1HB ALA 19 -13.271 -22.357 3.991 17 2HB ALA 19 2HB ALA 19 -12.303 -20.889 4.126 18 3HB ALA 19 3HB ALA 19 -13.367 -21.369 5.448 19 H SER 20 H SER 20 -11.332 -22.730 7.814 20 HA SER 20 HA SER 20 -10.183 -20.217 8.341 21 1HB SER 20 2HB SER 20 -9.965 -21.294 10.637 22 2HB SER 20 1HB SER 20 -11.594 -21.165 9.964 23 HG SER 20 HG SER 20 -10.678 -23.298 10.864 24 H SER 21 H SER 21 -8.956 -23.439 7.832 25 HA SER 21 HA SER 21 -6.286 -22.734 8.637 26 1HB SER 21 2HB SER 21 -7.261 -25.212 7.227 27 2HB SER 21 1HB SER 21 -5.705 -24.958 8.036 28 HG SER 21 HG SER 21 -7.054 -24.449 9.933 29 H LEU 22 H LEU 22 -8.113 -22.109 5.935 30 HA LEU 22 HA LEU 22 -6.047 -22.470 3.958 31 1HB LEU 22 2HB LEU 22 -8.735 -21.102 3.787 32 2HB LEU 22 1HB LEU 22 -7.627 -21.290 2.445 33 HG LEU 22 HG LEU 22 -9.010 -23.533 3.922 34 1HD1 LEU 22 1HD1 LEU 22 -10.219 -23.842 1.815 35 2HD1 LEU 22 2HD1 LEU 22 -9.390 -22.444 1.136 36 3HD1 LEU 22 3HD1 LEU 22 -10.504 -22.231 2.480 37 1HD2 LEU 22 1HD2 LEU 22 -8.068 -24.978 2.171 38 2HD2 LEU 22 2HD2 LEU 22 -6.808 -24.236 3.147 39 3HD2 LEU 22 3HD2 LEU 22 -7.158 -23.607 1.533 40 H VAL 23 H VAL 23 -5.848 -20.646 6.340 41 HA VAL 23 HA VAL 23 -5.401 -18.051 5.279 42 HB VAL 23 HB VAL 23 -5.849 -18.412 7.680 43 1HG1 VAL 23 1HG1 VAL 23 -3.196 -19.808 7.729 44 2HG1 VAL 23 2HG1 VAL 23 -4.766 -20.565 7.984 45 3HG1 VAL 23 3HG1 VAL 23 -4.143 -19.396 9.163 46 1HG2 VAL 23 1HG2 VAL 23 -3.097 -17.280 7.167 47 2HG2 VAL 23 2HG2 VAL 23 -4.057 -16.995 8.618 48 3HG2 VAL 23 3HG2 VAL 23 -4.622 -16.401 7.056 49 H GLY 24 H GLY 24 -3.573 -17.266 4.420 50 1HA GLY 24 2HA GLY 24 -1.236 -19.009 4.288 51 2HA GLY 24 1HA GLY 24 -1.971 -18.442 2.791 52 H LYS 25 H LYS 25 0.567 -17.906 3.211 53 HA LYS 25 HA LYS 25 0.635 -15.047 3.882 54 1HB LYS 25 2HB LYS 25 2.792 -17.079 4.339 55 2HB LYS 25 1HB LYS 25 2.894 -15.330 4.433 56 1HG LYS 25 2HG LYS 25 1.465 -15.297 6.353 57 2HG LYS 25 1HG LYS 25 1.230 -17.053 6.237 58 1HD LYS 25 2HD LYS 25 3.006 -16.425 7.881 59 2HD LYS 25 1HD LYS 25 3.565 -17.464 6.578 60 1HE LYS 25 2HE LYS 25 4.459 -15.504 5.370 61 2HE LYS 25 1HE LYS 25 3.914 -14.452 6.668 62 1HZ LYS 25 1HZ LYS 25 5.909 -16.624 6.901 63 2HZ LYS 25 2HZ LYS 25 5.467 -15.591 8.166 64 3HZ LYS 25 3HZ LYS 25 6.270 -14.999 6.783 65 H LEU 26 H LEU 26 2.052 -13.841 2.642 66 HA LEU 26 HA LEU 26 3.883 -15.267 1.022 67 1HB LEU 26 2HB LEU 26 1.962 -14.988 -0.502 68 2HB LEU 26 1HB LEU 26 1.953 -13.269 -0.185 69 HG LEU 26 HG LEU 26 4.159 -13.083 -1.285 70 1HD1 LEU 26 1HD1 LEU 26 4.987 -15.342 -0.899 71 2HD1 LEU 26 2HD1 LEU 26 4.992 -14.956 -2.620 72 3HD1 LEU 26 3HD1 LEU 26 3.733 -15.995 -1.951 73 1HD2 LEU 26 1HD2 LEU 26 2.118 -12.665 -2.514 74 2HD2 LEU 26 2HD2 LEU 26 1.991 -14.380 -2.917 75 3HD2 LEU 26 3HD2 LEU 26 3.336 -13.422 -3.545 76 H GLU 27 H GLU 27 5.793 -14.148 0.873 77 HA GLU 27 HA GLU 27 5.735 -11.380 1.781 78 1HB GLU 27 2HB GLU 27 7.666 -13.480 2.805 79 2HB GLU 27 1HB GLU 27 7.759 -11.762 3.158 80 1HG GLU 27 2HG GLU 27 5.528 -11.920 4.251 81 2HG GLU 27 1HG GLU 27 5.565 -13.653 3.965 82 H THR 28 H THR 28 7.247 -10.057 0.894 83 HA THR 28 HA THR 28 9.291 -11.124 -0.812 84 HB THR 28 HB THR 28 7.305 -11.039 -2.351 85 HG1 THR 28 1HG THR 28 9.186 -10.639 -3.355 86 1HG2 THR 28 1HG2 THR 28 6.045 -9.243 -1.233 87 2HG2 THR 28 2HG2 THR 28 6.294 -8.877 -2.939 88 3HG2 THR 28 3HG2 THR 28 7.275 -8.075 -1.717 89 H ASP 29 H ASP 29 10.641 -9.243 -1.603 90 HA ASP 29 HA ASP 29 10.274 -6.872 0.013 91 1HB ASP 29 2HB ASP 29 12.687 -6.749 0.551 92 2HB ASP 29 1HB ASP 29 11.949 -8.181 1.240 93 H VAL 30 H VAL 30 10.493 -5.107 -1.046 94 HA VAL 30 HA VAL 30 11.545 -5.247 -3.795 95 HB VAL 30 HB VAL 30 9.379 -3.393 -2.700 96 1HG1 VAL 30 1HG1 VAL 30 10.697 -2.324 -4.453 97 2HG1 VAL 30 2HG1 VAL 30 9.054 -2.661 -4.993 98 3HG1 VAL 30 3HG1 VAL 30 10.386 -3.690 -5.526 99 1HG2 VAL 30 1HG2 VAL 30 9.157 -5.704 -4.612 100 2HG2 VAL 30 2HG2 VAL 30 7.848 -4.594 -4.182 101 3HG2 VAL 30 3HG2 VAL 30 8.543 -5.665 -2.954 102 H GLU 31 H GLU 31 12.956 -3.629 -4.395 103 HA GLU 31 HA GLU 31 14.002 -2.037 -2.184 104 1HB GLU 31 2HB GLU 31 15.188 -1.894 -4.952 105 2HB GLU 31 1HB GLU 31 15.886 -1.626 -3.359 106 1HG GLU 31 2HG GLU 31 16.906 -3.575 -4.197 107 2HG GLU 31 1HG GLU 31 15.745 -4.096 -2.982 108 H ILE 32 H ILE 32 13.645 0.083 -2.041 109 HA ILE 32 HA ILE 32 12.487 1.403 -4.379 110 HB ILE 32 HB ILE 32 11.753 3.228 -2.863 111 1HG1 ILE 32 2HG1 ILE 32 12.717 1.439 -0.612 112 2HG1 ILE 32 1HG1 ILE 32 13.476 2.946 -1.108 113 1HG2 ILE 32 1HG2 ILE 32 10.181 1.475 -3.383 114 2HG2 ILE 32 2HG2 ILE 32 9.934 2.029 -1.728 115 3HG2 ILE 32 3HG2 ILE 32 10.770 0.506 -2.032 116 1HD1 ILE 32 1HD1 ILE 32 12.126 3.266 0.890 117 2HD1 ILE 32 2HD1 ILE 32 10.706 2.650 0.045 118 3HD1 ILE 32 3HD1 ILE 32 11.449 4.165 -0.465 119 H LYS 33 H LYS 33 13.360 3.514 -4.893 120 HA LYS 33 HA LYS 33 16.269 3.398 -4.607 121 1HB LYS 33 2HB LYS 33 14.569 5.267 -6.233 122 2HB LYS 33 1HB LYS 33 16.303 5.043 -6.394 123 1HG LYS 33 2HG LYS 33 15.895 2.720 -7.133 124 2HG LYS 33 1HG LYS 33 14.161 3.022 -7.021 125 1HD LYS 33 2HD LYS 33 14.422 4.869 -8.657 126 2HD LYS 33 1HD LYS 33 16.122 4.437 -8.820 127 1HE LYS 33 2HE LYS 33 14.889 3.464 -10.637 128 2HE LYS 33 1HE LYS 33 15.437 2.185 -9.557 129 1HZ LYS 33 1HZ LYS 33 13.152 1.841 -10.250 130 2HZ LYS 33 2HZ LYS 33 12.707 3.336 -9.651 131 3HZ LYS 33 3HZ LYS 33 13.196 2.120 -8.588 132 H ALA 34 H ALA 34 13.727 4.822 -3.114 133 HA ALA 34 HA ALA 34 15.023 7.347 -2.541 134 1HB ALA 34 1HB ALA 34 12.345 6.314 -1.654 135 2HB ALA 34 2HB ALA 34 12.647 7.342 -3.056 136 3HB ALA 34 3HB ALA 34 12.955 7.952 -1.428 137 H SER 35 H SER 35 15.188 8.107 -0.369 138 HA SER 35 HA SER 35 16.399 6.207 1.369 139 1HB SER 35 2HB SER 35 17.259 8.492 1.194 140 2HB SER 35 1HB SER 35 15.726 9.134 1.765 141 HG SER 35 HG SER 35 17.805 8.315 3.185 142 H ALA 36 H ALA 36 15.684 5.577 3.385 143 HA ALA 36 HA ALA 36 12.924 5.135 3.731 144 1HB ALA 36 1HB ALA 36 14.643 3.641 4.662 145 2HB ALA 36 2HB ALA 36 13.550 4.215 5.919 146 3HB ALA 36 3HB ALA 36 15.159 4.920 5.763 147 H ASP 37 H ASP 37 15.037 7.676 4.609 148 HA ASP 37 HA ASP 37 13.692 8.861 6.767 149 1HB ASP 37 2HB ASP 37 15.979 9.485 5.983 150 2HB ASP 37 1HB ASP 37 15.251 10.256 4.579 151 H LYS 38 H LYS 38 13.217 9.111 3.297 152 HA LYS 38 HA LYS 38 11.309 11.210 3.382 153 1HB LYS 38 2HB LYS 38 11.969 9.193 1.285 154 2HB LYS 38 1HB LYS 38 10.643 10.334 1.104 155 1HG LYS 38 2HG LYS 38 12.239 12.161 1.472 156 2HG LYS 38 1HG LYS 38 13.535 10.956 1.471 157 1HD LYS 38 2HD LYS 38 13.106 10.342 -0.746 158 2HD LYS 38 1HD LYS 38 11.552 11.173 -0.756 159 1HE LYS 38 2HE LYS 38 13.060 12.490 -1.954 160 2HE LYS 38 1HE LYS 38 12.673 13.223 -0.392 161 1HZ LYS 38 1HZ LYS 38 15.211 11.741 -0.934 162 2HZ LYS 38 2HZ LYS 38 14.792 12.509 0.510 163 3HZ LYS 38 3HZ LYS 38 15.074 13.416 -0.867 164 H PHE 39 H PHE 39 11.046 7.706 3.492 165 HA PHE 39 HA PHE 39 8.229 7.651 3.125 166 1HB PHE 39 2HB PHE 39 9.736 5.671 2.793 167 2HB PHE 39 1HB PHE 39 9.963 5.598 4.534 168 HD1 PHE 39 1HD PHE 39 7.534 5.189 1.804 169 HD2 PHE 39 2HD PHE 39 8.310 4.605 5.941 170 HE1 PHE 39 1HE PHE 39 5.551 3.739 1.966 171 HE2 PHE 39 2HE PHE 39 6.334 3.152 6.112 172 HZ PHE 39 HZ PHE 39 4.950 2.718 4.123 173 H HIS 40 H HIS 40 10.362 7.728 5.891 174 HA HIS 40 HA HIS 40 8.452 7.688 7.989 175 1HB HIS 40 2HB HIS 40 10.951 7.372 8.219 176 2HB HIS 40 1HB HIS 40 11.152 9.084 7.894 177 HD1 HIS 40 1HD HIS 40 11.318 6.881 10.592 178 HD2 HIS 40 2HD HIS 40 9.458 10.567 10.112 179 HE1 HIS 40 1HE HIS 40 11.063 7.808 12.890 180 HE2 HIS 40 2HE HIS 40 9.700 9.880 12.594 181 H HIS 41 H HIS 41 9.709 10.125 5.887 182 HA HIS 41 HA HIS 41 8.991 12.514 7.190 183 1HB HIS 41 2HB HIS 41 10.571 12.214 5.230 184 2HB HIS 41 1HB HIS 41 9.153 12.062 4.213 185 HD1 HIS 41 1HD HIS 41 7.540 14.371 4.281 186 HD2 HIS 41 2HD HIS 41 11.489 14.594 5.461 187 HE1 HIS 41 1HE HIS 41 8.093 16.800 4.187 188 HE2 HIS 41 2HE HIS 41 10.557 16.877 4.575 189 H MET 42 H MET 42 7.238 10.365 5.025 190 HA MET 42 HA MET 42 5.128 12.214 4.500 191 1HB MET 42 2HB MET 42 5.196 9.227 4.051 192 2HB MET 42 1HB MET 42 3.995 10.332 3.396 193 1HG MET 42 2HG MET 42 6.935 10.270 2.762 194 2HG MET 42 1HG MET 42 5.610 9.798 1.699 195 1HE MET 42 1HE MET 42 6.999 13.070 0.013 196 2HE MET 42 2HE MET 42 6.603 11.369 -0.225 197 3HE MET 42 3HE MET 42 7.932 11.821 0.842 198 H PHE 43 H PHE 43 5.759 9.947 6.990 199 HA PHE 43 HA PHE 43 3.012 10.122 7.931 200 1HB PHE 43 2HB PHE 43 5.335 8.452 8.921 201 2HB PHE 43 1HB PHE 43 3.744 8.478 9.668 202 HD1 PHE 43 1HD PHE 43 1.807 7.536 8.503 203 HD2 PHE 43 2HD PHE 43 5.727 7.257 6.882 204 HE1 PHE 43 1HE PHE 43 1.039 5.780 6.969 205 HE2 PHE 43 2HE PHE 43 4.966 5.501 5.346 206 HZ PHE 43 HZ PHE 43 2.619 4.758 5.384 207 H ALA 44 H ALA 44 5.551 12.018 8.069 208 HA ALA 44 HA ALA 44 5.077 12.834 10.854 209 1HB ALA 44 1HB ALA 44 7.384 12.086 10.462 210 2HB ALA 44 2HB ALA 44 7.315 13.802 10.870 211 3HB ALA 44 3HB ALA 44 7.553 13.302 9.197 212 H GLY 45 H GLY 45 5.860 14.095 7.621 213 1HA GLY 45 2HA GLY 45 4.377 16.532 8.339 214 2HA GLY 45 1HA GLY 45 5.902 16.597 7.460 215 H LYS 46 H LYS 46 5.083 17.517 5.600 216 HA LYS 46 HA LYS 46 3.015 15.989 4.180 217 1HB LYS 46 2HB LYS 46 3.916 18.854 3.697 218 2HB LYS 46 1HB LYS 46 2.688 18.020 2.777 219 1HG LYS 46 2HG LYS 46 1.573 19.507 4.249 220 2HG LYS 46 1HG LYS 46 1.343 17.893 4.914 221 1HD LYS 46 2HD LYS 46 3.145 18.290 6.502 222 2HD LYS 46 1HD LYS 46 3.405 19.891 5.815 223 1HE LYS 46 2HE LYS 46 1.130 20.524 6.472 224 2HE LYS 46 1HE LYS 46 0.903 18.920 7.175 225 1HZ LYS 46 1HZ LYS 46 2.710 19.362 8.688 226 2HZ LYS 46 2HZ LYS 46 1.524 20.543 8.852 227 3HZ LYS 46 3HZ LYS 46 2.945 20.892 8.020 228 HA PRO 47 HA PRO 47 6.067 15.023 1.023 229 1HB PRO 47 2HB PRO 47 3.994 15.505 -1.022 230 2HB PRO 47 1HB PRO 47 4.835 14.001 -0.639 231 1HG PRO 47 2HG PRO 47 2.242 14.366 -0.049 232 2HG PRO 47 1HG PRO 47 3.316 13.411 0.991 233 1HD PRO 47 2HD PRO 47 2.325 16.208 1.331 234 2HD PRO 47 1HD PRO 47 2.530 14.924 2.542 235 H HIS 48 H HIS 48 7.534 16.547 0.448 236 HA HIS 48 HA HIS 48 6.497 19.082 -0.630 237 1HB HIS 48 2HB HIS 48 7.568 19.208 1.668 238 2HB HIS 48 1HB HIS 48 9.074 18.702 0.922 239 HD1 HIS 48 1HD HIS 48 6.899 21.653 1.483 240 HD2 HIS 48 2HD HIS 48 10.265 20.699 -0.767 241 HE1 HIS 48 1HE HIS 48 7.860 23.834 0.766 242 HE2 HIS 48 2HE HIS 48 9.643 23.198 -0.874 243 H HIS 49 H HIS 49 7.171 19.616 -2.591 244 HA HIS 49 HA HIS 49 8.962 17.724 -3.894 245 1HB HIS 49 2HB HIS 49 8.091 18.558 -6.012 246 2HB HIS 49 1HB HIS 49 6.782 18.067 -4.951 247 HD1 HIS 49 1HD HIS 49 4.896 19.713 -4.843 248 HD2 HIS 49 2HD HIS 49 8.479 21.436 -5.930 249 HE1 HIS 49 1HE HIS 49 4.300 22.073 -5.455 250 HE2 HIS 49 2HE HIS 49 6.426 22.926 -6.515 251 H VAL 50 H VAL 50 10.413 18.476 -5.552 252 HA VAL 50 HA VAL 50 12.280 20.267 -4.460 253 HB VAL 50 HB VAL 50 12.979 18.343 -5.807 254 1HG1 VAL 50 1HG1 VAL 50 12.725 18.276 -8.240 255 2HG1 VAL 50 2HG1 VAL 50 11.717 19.723 -8.163 256 3HG1 VAL 50 3HG1 VAL 50 11.175 18.228 -7.403 257 1HG2 VAL 50 1HG2 VAL 50 14.631 19.433 -7.258 258 2HG2 VAL 50 2HG2 VAL 50 14.511 20.206 -5.677 259 3HG2 VAL 50 3HG2 VAL 50 13.757 20.959 -7.082 260 H SER 51 H SER 51 12.533 22.387 -4.749 261 HA SER 51 HA SER 51 11.576 23.754 -7.065 262 1HB SER 51 2HB SER 51 9.449 23.389 -5.799 263 2HB SER 51 1HB SER 51 10.140 24.283 -4.451 264 HG SER 51 HG SER 51 9.019 25.154 -6.756 265 H LYS 52 H LYS 52 12.532 23.981 -3.658 266 HA LYS 52 HA LYS 52 14.030 25.197 -2.530 267 1HB LYS 52 2HB LYS 52 15.618 24.687 -4.358 268 2HB LYS 52 1HB LYS 52 15.013 26.087 -5.233 269 1HG LYS 52 2HG LYS 52 15.882 27.554 -3.475 270 2HG LYS 52 1HG LYS 52 16.482 26.143 -2.600 271 1HD LYS 52 2HD LYS 52 18.275 27.197 -3.872 272 2HD LYS 52 1HD LYS 52 17.915 25.584 -4.499 273 1HE LYS 52 2HE LYS 52 16.563 26.555 -6.261 274 2HE LYS 52 1HE LYS 52 16.889 28.172 -5.645 275 1HZ LYS 52 1HZ LYS 52 18.857 26.263 -6.784 276 2HZ LYS 52 2HZ LYS 52 19.276 27.769 -6.136 277 3HZ LYS 52 3HZ LYS 52 18.314 27.645 -7.511 278 H ALA 53 H ALA 53 14.242 27.213 -1.614 279 HA ALA 53 HA ALA 53 13.454 29.130 -0.842 280 1HB ALA 53 1HB ALA 53 13.135 29.917 -3.734 281 2HB ALA 53 2HB ALA 53 14.624 30.047 -2.803 282 3HB ALA 53 3HB ALA 53 13.217 31.017 -2.357 283 H SER 54 H SER 54 11.786 27.920 -0.014 284 HA SER 54 HA SER 54 9.151 28.836 -0.877 285 1HB SER 54 2HB SER 54 9.903 26.005 -0.045 286 2HB SER 54 1HB SER 54 8.289 26.553 -0.480 287 HG SER 54 HG SER 54 9.684 27.229 -2.506 288 HA PRO 55 HA PRO 55 8.803 29.575 3.551 289 1HB PRO 55 2HB PRO 55 6.368 28.452 4.190 290 2HB PRO 55 1HB PRO 55 6.545 30.047 3.455 291 1HG PRO 55 2HG PRO 55 5.919 27.427 2.170 292 2HG PRO 55 1HG PRO 55 5.212 29.022 1.856 293 1HD PRO 55 2HD PRO 55 7.048 27.979 0.216 294 2HD PRO 55 1HD PRO 55 7.035 29.712 0.585 295 H GLY 56 H GLY 56 9.081 28.526 5.548 296 1HA GLY 56 2HA GLY 56 9.968 25.782 5.278 297 2HA GLY 56 1HA GLY 56 10.236 26.851 6.648 298 H ASN 57 H ASN 57 9.449 25.776 8.317 299 HA ASN 57 HA ASN 57 7.057 24.201 8.055 300 1HB ASN 57 2HB ASN 57 8.906 23.411 9.478 301 2HB ASN 57 1HB ASN 57 8.701 24.815 10.516 302 1HD2 ASN 57 1HD2 ASN 57 7.369 21.774 9.534 303 2HD2 ASN 57 2HD2 ASN 57 6.254 21.607 10.840 304 H ILE 58 H ILE 58 5.233 25.291 7.844 305 HA ILE 58 HA ILE 58 4.426 27.054 9.998 306 HB ILE 58 HB ILE 58 3.217 28.461 8.345 307 1HG1 ILE 58 2HG1 ILE 58 4.916 27.052 6.268 308 2HG1 ILE 58 1HG1 ILE 58 3.179 26.869 6.470 309 1HG2 ILE 58 1HG2 ILE 58 5.133 29.814 7.597 310 2HG2 ILE 58 2HG2 ILE 58 6.212 28.490 8.042 311 3HG2 ILE 58 3HG2 ILE 58 5.263 29.309 9.282 312 1HD1 ILE 58 1HD1 ILE 58 4.608 29.403 5.684 313 2HD1 ILE 58 2HD1 ILE 58 2.868 29.217 5.871 314 3HD1 ILE 58 3HD1 ILE 58 3.715 28.334 4.601 315 H GLN 59 H GLN 59 1.986 27.361 9.705 316 HA GLN 59 HA GLN 59 0.810 24.770 9.210 317 1HB GLN 59 2HB GLN 59 -1.282 25.769 10.076 318 2HB GLN 59 1HB GLN 59 0.058 25.986 11.188 319 1HG GLN 59 2HG GLN 59 0.305 28.303 10.399 320 2HG GLN 59 1HG GLN 59 -1.074 28.063 9.328 321 1HE2 GLN 59 1HE2 GLN 59 -0.727 29.917 11.506 322 2HE2 GLN 59 2HE2 GLN 59 -1.987 29.625 12.644 323 H GLY 60 H GLY 60 -0.813 24.378 7.688 324 1HA GLY 60 2HA GLY 60 -2.192 25.246 5.867 325 2HA GLY 60 1HA GLY 60 -0.884 26.371 5.523 326 H CYS 61 H CYS 61 -2.236 23.511 4.630 327 HA CYS 61 HA CYS 61 0.281 22.348 3.736 328 1HB CYS 61 2HB CYS 61 -1.381 20.873 4.830 329 2HB CYS 61 1HB CYS 61 -2.523 21.222 3.543 330 HG CYS 61 HG CYS 61 -1.148 18.623 3.459 331 H ASP 62 H ASP 62 0.582 21.754 1.535 332 HA ASP 62 HA ASP 62 -0.700 23.635 -0.314 333 1HB ASP 62 2HB ASP 62 1.890 22.096 -0.547 334 2HB ASP 62 1HB ASP 62 1.221 23.093 -1.832 335 H LEU 63 H LEU 63 -0.821 20.406 0.549 336 HA LEU 63 HA LEU 63 -2.392 19.829 -1.771 337 1HB LEU 63 2HB LEU 63 -1.270 17.709 -2.332 338 2HB LEU 63 1HB LEU 63 -0.222 19.081 -2.576 339 HG LEU 63 HG LEU 63 -0.035 17.164 -0.229 340 1HD1 LEU 63 1HD1 LEU 63 0.484 16.050 -2.327 341 2HD1 LEU 63 2HD1 LEU 63 1.933 16.269 -1.347 342 3HD1 LEU 63 3HD1 LEU 63 1.639 17.324 -2.727 343 1HD2 LEU 63 1HD2 LEU 63 0.895 19.384 0.272 344 2HD2 LEU 63 2HD2 LEU 63 1.886 19.300 -1.184 345 3HD2 LEU 63 3HD2 LEU 63 2.175 18.178 0.143 346 H HIS 64 H HIS 64 -4.155 19.666 -0.532 347 HA HIS 64 HA HIS 64 -4.023 17.917 1.755 348 1HB HIS 64 2HB HIS 64 -6.371 18.586 2.285 349 2HB HIS 64 1HB HIS 64 -5.280 19.948 2.162 350 HD1 HIS 64 1HD HIS 64 -5.911 21.767 0.480 351 HD2 HIS 64 2HD HIS 64 -8.285 18.373 0.156 352 HE1 HIS 64 1HE HIS 64 -7.802 22.416 -1.003 353 HE2 HIS 64 2HE HIS 64 -8.997 20.269 -1.443 354 H GLU 65 H GLU 65 -4.254 15.902 1.671 355 HA GLU 65 HA GLU 65 -5.637 14.656 -0.550 356 1HB GLU 65 2HB GLU 65 -3.905 13.502 1.647 357 2HB GLU 65 1HB GLU 65 -4.592 12.571 0.327 358 1HG GLU 65 2HG GLU 65 -3.308 13.897 -1.282 359 2HG GLU 65 1HG GLU 65 -2.632 14.841 0.041 360 H GLY 66 H GLY 66 -6.923 12.608 0.139 361 1HA GLY 66 2HA GLY 66 -8.952 13.541 1.995 362 2HA GLY 66 1HA GLY 66 -9.062 12.130 0.955 363 H ASP 67 H ASP 67 -7.057 13.242 3.615 364 HA ASP 67 HA ASP 67 -6.698 10.545 4.630 365 1HB ASP 67 2HB ASP 67 -5.828 13.203 5.758 366 2HB ASP 67 1HB ASP 67 -5.342 11.645 6.392 367 H TRP 68 H TRP 68 -7.254 9.938 6.818 368 HA TRP 68 HA TRP 68 -9.685 11.277 7.750 369 1HB TRP 68 2HB TRP 68 -8.514 8.577 8.462 370 2HB TRP 68 1HB TRP 68 -9.957 9.246 9.205 371 HD1 TRP 68 HD TRP 68 -9.036 9.021 5.425 372 HE1 TRP 68 1HE TRP 68 -10.912 7.785 4.215 373 HE3 TRP 68 3HE TRP 68 -11.987 7.907 9.447 374 HZ2 TRP 68 2HZ TRP 68 -13.339 6.498 4.862 375 HZ3 TRP 68 3HZ TRP 68 -14.077 6.654 9.049 376 HH2 TRP 68 HH TRP 68 -14.730 5.972 6.807 377 H GLY 69 H GLY 69 -6.375 10.916 8.448 378 1HA GLY 69 2HA GLY 69 -5.171 12.334 9.859 379 2HA GLY 69 1HA GLY 69 -6.664 12.767 10.669 380 H THR 70 H THR 70 -6.916 9.596 10.663 381 HA THR 70 HA THR 70 -5.230 9.090 12.971 382 HB THR 70 HB THR 70 -7.331 8.004 14.016 383 HG1 THR 70 1HG THR 70 -8.790 10.014 12.803 384 1HG2 THR 70 1HG2 THR 70 -7.974 10.124 15.129 385 2HG2 THR 70 2HG2 THR 70 -7.064 11.019 13.912 386 3HG2 THR 70 3HG2 THR 70 -6.223 9.940 15.022 387 H VAL 71 H VAL 71 -5.490 6.716 13.649 388 HA VAL 71 HA VAL 71 -5.007 5.056 11.408 389 HB VAL 71 HB VAL 71 -5.625 4.197 14.265 390 1HG1 VAL 71 1HG1 VAL 71 -4.111 2.761 12.089 391 2HG1 VAL 71 2HG1 VAL 71 -5.741 2.363 12.630 392 3HG1 VAL 71 3HG1 VAL 71 -4.369 2.168 13.726 393 1HG2 VAL 71 1HG2 VAL 71 -3.185 4.127 14.602 394 2HG2 VAL 71 2HG2 VAL 71 -3.756 5.758 14.256 395 3HG2 VAL 71 3HG2 VAL 71 -2.960 4.825 12.997 396 H GLY 72 H GLY 72 -6.349 3.484 10.474 397 1HA GLY 72 2HA GLY 72 -8.430 2.317 10.317 398 2HA GLY 72 1HA GLY 72 -9.171 3.590 11.286 399 H SER 73 H SER 73 -7.147 5.111 9.326 400 HA SER 73 HA SER 73 -9.025 6.384 7.734 401 1HB SER 73 2HB SER 73 -6.796 7.298 8.341 402 2HB SER 73 1HB SER 73 -6.046 6.074 7.329 403 HG SER 73 HG SER 73 -6.627 7.074 5.590 404 H ILE 74 H ILE 74 -9.546 6.198 5.583 405 HA ILE 74 HA ILE 74 -8.630 3.846 4.112 406 HB ILE 74 HB ILE 74 -11.465 4.862 4.377 407 1HG1 ILE 74 2HG1 ILE 74 -10.219 2.185 4.917 408 2HG1 ILE 74 1HG1 ILE 74 -10.584 3.392 6.140 409 1HG2 ILE 74 1HG2 ILE 74 -12.100 3.128 2.753 410 2HG2 ILE 74 2HG2 ILE 74 -10.398 2.743 2.498 411 3HG2 ILE 74 3HG2 ILE 74 -11.025 4.321 2.022 412 1HD1 ILE 74 1HD1 ILE 74 -12.524 1.971 4.352 413 2HD1 ILE 74 2HD1 ILE 74 -12.955 3.179 5.574 414 3HD1 ILE 74 3HD1 ILE 74 -12.253 1.624 6.064 415 H VAL 75 H VAL 75 -7.641 4.557 2.401 416 HA VAL 75 HA VAL 75 -8.700 6.880 0.903 417 HB VAL 75 HB VAL 75 -5.748 6.378 1.464 418 1HG1 VAL 75 1HG1 VAL 75 -6.098 7.274 -0.770 419 2HG1 VAL 75 2HG1 VAL 75 -5.325 8.464 0.278 420 3HG1 VAL 75 3HG1 VAL 75 -7.042 8.606 -0.102 421 1HG2 VAL 75 1HG2 VAL 75 -7.516 8.639 2.389 422 2HG2 VAL 75 2HG2 VAL 75 -5.783 8.502 2.681 423 3HG2 VAL 75 3HG2 VAL 75 -6.897 7.338 3.400 424 H PHE 76 H PHE 76 -8.601 6.663 -1.318 425 HA PHE 76 HA PHE 76 -7.675 4.037 -2.177 426 1HB PHE 76 2HB PHE 76 -9.868 5.735 -3.347 427 2HB PHE 76 1HB PHE 76 -9.324 4.188 -3.988 428 HD1 PHE 76 1HD PHE 76 -9.105 2.425 -1.921 429 HD2 PHE 76 2HD PHE 76 -11.882 5.588 -2.268 430 HE1 PHE 76 1HE PHE 76 -10.624 1.213 -0.438 431 HE2 PHE 76 2HE PHE 76 -13.446 4.402 -0.783 432 HZ PHE 76 HZ PHE 76 -12.820 2.200 0.142 433 H TRP 77 H TRP 77 -6.368 3.840 -3.810 434 HA TRP 77 HA TRP 77 -5.440 6.285 -5.110 435 1HB TRP 77 2HB TRP 77 -4.032 3.623 -4.747 436 2HB TRP 77 1HB TRP 77 -3.387 4.974 -5.670 437 HD1 TRP 77 HD TRP 77 -3.174 7.286 -4.195 438 HE1 TRP 77 1HE TRP 77 -2.240 7.590 -1.794 439 HE3 TRP 77 3HE TRP 77 -3.676 2.502 -2.584 440 HZ2 TRP 77 2HZ TRP 77 -1.786 5.962 0.461 441 HZ3 TRP 77 3HZ TRP 77 -2.967 1.936 -0.307 442 HH2 TRP 77 HH TRP 77 -2.043 3.640 1.187 443 H ASN 78 H ASN 78 -5.572 6.465 -7.250 444 HA ASN 78 HA ASN 78 -6.757 4.195 -8.692 445 1HB ASN 78 2HB ASN 78 -7.326 7.135 -9.149 446 2HB ASN 78 1HB ASN 78 -7.971 5.812 -10.098 447 1HD2 ASN 78 1HD2 ASN 78 -8.391 4.191 -7.622 448 2HD2 ASN 78 2HD2 ASN 78 -9.802 4.857 -6.882 449 H TYR 79 H TYR 79 -5.738 3.608 -10.463 450 HA TYR 79 HA TYR 79 -4.008 5.518 -11.800 451 1HB TYR 79 2HB TYR 79 -2.196 3.870 -12.032 452 2HB TYR 79 1HB TYR 79 -2.513 4.216 -10.343 453 HD1 TYR 79 1HD TYR 79 -2.432 1.712 -12.932 454 HD2 TYR 79 2HD TYR 79 -3.668 2.491 -8.943 455 HE1 TYR 79 1HE TYR 79 -2.592 -0.693 -12.526 456 HE2 TYR 79 2HE TYR 79 -3.844 0.078 -8.516 457 HH TYR 79 HH TYR 79 -2.455 -2.160 -10.629 458 H VAL 80 H VAL 80 -3.498 4.746 -14.066 459 HA VAL 80 HA VAL 80 -5.972 3.467 -14.966 460 HB VAL 80 HB VAL 80 -4.280 5.489 -16.441 461 1HG1 VAL 80 1HG1 VAL 80 -6.149 5.580 -18.042 462 2HG1 VAL 80 2HG1 VAL 80 -6.977 4.313 -17.150 463 3HG1 VAL 80 3HG1 VAL 80 -5.459 3.961 -17.962 464 1HG2 VAL 80 1HG2 VAL 80 -6.120 7.041 -16.011 465 2HG2 VAL 80 2HG2 VAL 80 -5.421 6.450 -14.503 466 3HG2 VAL 80 3HG2 VAL 80 -6.951 5.794 -15.082 467 H HIS 81 H HIS 81 -5.865 1.628 -15.931 468 HA HIS 81 HA HIS 81 -3.617 0.967 -17.656 469 1HB HIS 81 2HB HIS 81 -3.133 -0.041 -15.387 470 2HB HIS 81 1HB HIS 81 -4.649 -0.917 -15.498 471 HD1 HIS 81 1HD HIS 81 -1.103 -0.992 -16.634 472 HD2 HIS 81 2HD HIS 81 -4.607 -3.090 -17.324 473 HE1 HIS 81 1HE HIS 81 -0.398 -3.099 -17.760 474 HE2 HIS 81 2HE HIS 81 -2.555 -4.095 -18.516 475 H ASP 82 H ASP 82 -4.336 -0.004 -19.480 476 HA ASP 82 HA ASP 82 -5.732 -0.641 -21.159 477 1HB ASP 82 2HB ASP 82 -7.315 -1.926 -18.912 478 2HB ASP 82 1HB ASP 82 -7.706 -2.134 -20.607 479 H GLY 83 H GLY 83 -6.092 1.860 -19.800 480 1HA GLY 83 2HA GLY 83 -7.450 3.679 -20.171 481 2HA GLY 83 1HA GLY 83 -8.550 2.630 -21.054 482 H GLU 84 H GLU 84 -8.118 1.120 -18.169 483 HA GLU 84 HA GLU 84 -10.516 2.371 -17.054 484 1HB GLU 84 2HB GLU 84 -9.211 -0.265 -16.426 485 2HB GLU 84 1HB GLU 84 -10.593 0.387 -15.573 486 1HG GLU 84 2HG GLU 84 -11.854 0.314 -17.683 487 2HG GLU 84 1HG GLU 84 -10.435 -0.435 -18.429 488 H ALA 85 H ALA 85 -10.579 2.849 -14.939 489 HA ALA 85 HA ALA 85 -8.002 3.499 -13.761 490 1HB ALA 85 1HB ALA 85 -10.784 4.207 -12.818 491 2HB ALA 85 2HB ALA 85 -9.728 5.255 -13.765 492 3HB ALA 85 3HB ALA 85 -9.277 4.798 -12.120 493 H LYS 86 H LYS 86 -7.116 2.179 -12.435 494 HA LYS 86 HA LYS 86 -8.658 0.047 -11.224 495 1HB LYS 86 2HB LYS 86 -5.725 0.479 -11.690 496 2HB LYS 86 1HB LYS 86 -6.263 -0.682 -10.496 497 1HG LYS 86 2HG LYS 86 -5.708 -1.696 -12.654 498 2HG LYS 86 1HG LYS 86 -7.390 -1.976 -12.199 499 1HD LYS 86 2HD LYS 86 -8.018 -0.164 -13.766 500 2HD LYS 86 1HD LYS 86 -6.313 -0.003 -14.201 501 1HE LYS 86 2HE LYS 86 -7.499 -1.382 -15.813 502 2HE LYS 86 1HE LYS 86 -6.257 -2.288 -14.953 503 1HZ LYS 86 1HZ LYS 86 -9.181 -2.396 -14.381 504 2HZ LYS 86 2HZ LYS 86 -7.995 -3.268 -13.558 505 3HZ LYS 86 3HZ LYS 86 -8.282 -3.552 -15.190 506 H VAL 87 H VAL 87 -8.546 -0.319 -8.987 507 HA VAL 87 HA VAL 87 -7.916 2.120 -7.492 508 HB VAL 87 HB VAL 87 -10.249 0.245 -7.084 509 1HG1 VAL 87 1HG1 VAL 87 -9.571 2.804 -5.643 510 2HG1 VAL 87 2HG1 VAL 87 -9.508 1.177 -4.966 511 3HG1 VAL 87 3HG1 VAL 87 -11.060 1.881 -5.431 512 1HG2 VAL 87 1HG2 VAL 87 -10.223 3.068 -8.145 513 2HG2 VAL 87 2HG2 VAL 87 -11.670 2.128 -7.776 514 3HG2 VAL 87 3HG2 VAL 87 -10.578 1.599 -9.056 515 H ALA 88 H ALA 88 -6.948 1.876 -5.579 516 HA ALA 88 HA ALA 88 -6.273 -0.830 -4.662 517 1HB ALA 88 1HB ALA 88 -4.336 0.616 -5.123 518 2HB ALA 88 2HB ALA 88 -4.474 0.347 -3.385 519 3HB ALA 88 3HB ALA 88 -5.014 1.872 -4.092 520 H LYS 89 H LYS 89 -7.513 -1.490 -2.965 521 HA LYS 89 HA LYS 89 -9.003 0.555 -1.510 522 1HB LYS 89 2HB LYS 89 -9.711 -2.430 -1.471 523 2HB LYS 89 1HB LYS 89 -10.662 -1.055 -1.041 524 1HG LYS 89 2HG LYS 89 -11.564 -1.902 -3.069 525 2HG LYS 89 1HG LYS 89 -10.763 -0.384 -3.457 526 1HD LYS 89 2HD LYS 89 -8.833 -1.627 -4.336 527 2HD LYS 89 1HD LYS 89 -9.590 -3.152 -3.885 528 1HE LYS 89 2HE LYS 89 -11.413 -2.709 -5.457 529 2HE LYS 89 1HE LYS 89 -10.688 -1.164 -5.876 530 1HZ LYS 89 1HZ LYS 89 -9.501 -3.873 -6.443 531 2HZ LYS 89 2HZ LYS 89 -8.720 -2.422 -6.684 532 3HZ LYS 89 3HZ LYS 89 -10.085 -2.764 -7.564 533 H GLU 90 H GLU 90 -8.526 0.867 0.696 534 HA GLU 90 HA GLU 90 -7.125 -1.186 2.078 535 1HB GLU 90 2HB GLU 90 -5.176 0.233 2.575 536 2HB GLU 90 1HB GLU 90 -5.282 -0.200 0.879 537 1HG GLU 90 2HG GLU 90 -4.721 2.022 0.678 538 2HG GLU 90 1HG GLU 90 -6.477 2.130 0.713 539 H ARG 91 H ARG 91 -6.950 -0.826 4.221 540 HA ARG 91 HA ARG 91 -8.254 1.511 5.426 541 1HB ARG 91 2HB ARG 91 -9.799 -0.481 5.216 542 2HB ARG 91 1HB ARG 91 -8.685 -1.397 6.192 543 1HG ARG 91 2HG ARG 91 -10.205 1.034 7.140 544 2HG ARG 91 1HG ARG 91 -10.747 -0.631 7.329 545 1HD ARG 91 2HD ARG 91 -8.679 -1.042 8.685 546 2HD ARG 91 1HD ARG 91 -8.343 0.688 8.582 547 HE ARG 91 HE ARG 91 -10.965 0.335 9.502 548 1HH1 ARG 91 1HH1 ARG 91 -7.648 -0.013 10.731 549 2HH1 ARG 91 2HH1 ARG 91 -8.111 0.092 12.361 550 1HH2 ARG 91 1HH2 ARG 91 -11.556 0.495 11.794 551 2HH2 ARG 91 2HH2 ARG 91 -10.339 0.366 12.970 552 H ILE 92 H ILE 92 -6.718 2.308 6.845 553 HA ILE 92 HA ILE 92 -4.299 0.851 7.349 554 HB ILE 92 HB ILE 92 -5.371 3.214 8.931 555 1HG1 ILE 92 2HG1 ILE 92 -3.469 3.150 6.573 556 2HG1 ILE 92 1HG1 ILE 92 -5.113 3.784 6.562 557 1HG2 ILE 92 1HG2 ILE 92 -3.030 3.554 9.609 558 2HG2 ILE 92 2HG2 ILE 92 -2.580 2.097 8.720 559 3HG2 ILE 92 3HG2 ILE 92 -3.633 1.973 10.128 560 1HD1 ILE 92 1HD1 ILE 92 -2.751 4.887 8.068 561 2HD1 ILE 92 2HD1 ILE 92 -4.386 5.487 8.217 562 3HD1 ILE 92 3HD1 ILE 92 -3.543 5.611 6.667 563 H GLU 93 H GLU 93 -3.996 -0.751 8.705 564 HA GLU 93 HA GLU 93 -6.025 -1.273 10.762 565 1HB GLU 93 2HB GLU 93 -5.349 -3.054 9.150 566 2HB GLU 93 1HB GLU 93 -3.728 -2.982 9.818 567 1HG GLU 93 2HG GLU 93 -4.956 -4.864 10.698 568 2HG GLU 93 1HG GLU 93 -4.584 -3.712 11.983 569 H ALA 94 H ALA 94 -2.556 -0.818 10.342 570 HA ALA 94 HA ALA 94 -2.287 0.240 12.988 571 1HB ALA 94 1HB ALA 94 -0.477 -1.318 13.619 572 2HB ALA 94 2HB ALA 94 -0.784 -2.263 12.161 573 3HB ALA 94 3HB ALA 94 -2.011 -2.167 13.424 574 H VAL 95 H VAL 95 -0.401 1.517 13.099 575 HA VAL 95 HA VAL 95 1.362 1.507 10.802 576 HB VAL 95 HB VAL 95 -0.456 3.041 10.147 577 1HG1 VAL 95 1HG1 VAL 95 0.233 4.608 12.617 578 2HG1 VAL 95 2HG1 VAL 95 -1.256 3.717 12.314 579 3HG1 VAL 95 3HG1 VAL 95 -0.863 5.139 11.341 580 1HG2 VAL 95 1HG2 VAL 95 2.106 4.502 10.800 581 2HG2 VAL 95 2HG2 VAL 95 0.884 5.051 9.655 582 3HG2 VAL 95 3HG2 VAL 95 1.784 3.563 9.344 583 H GLU 96 H GLU 96 3.411 2.221 11.312 584 HA GLU 96 HA GLU 96 3.729 3.472 13.960 585 1HB GLU 96 2HB GLU 96 4.805 0.976 13.558 586 2HB GLU 96 1HB GLU 96 6.012 1.931 12.721 587 1HG GLU 96 2HG GLU 96 6.722 1.454 14.819 588 2HG GLU 96 1HG GLU 96 6.442 3.196 14.686 589 HA PRO 97 HA PRO 97 5.061 6.415 10.741 590 1HB PRO 97 2HB PRO 97 5.314 8.548 12.464 591 2HB PRO 97 1HB PRO 97 3.789 8.077 11.713 592 1HG PRO 97 2HG PRO 97 4.805 7.501 14.459 593 2HG PRO 97 1HG PRO 97 3.169 7.923 13.937 594 1HD PRO 97 2HD PRO 97 3.875 5.397 14.528 595 2HD PRO 97 1HD PRO 97 2.686 5.767 13.266 596 H ASP 98 H ASP 98 6.480 5.772 13.812 597 HA ASP 98 HA ASP 98 8.984 7.025 13.210 598 1HB ASP 98 2HB ASP 98 8.133 6.948 15.505 599 2HB ASP 98 1HB ASP 98 8.192 5.194 15.466 600 H LYS 99 H LYS 99 7.707 3.798 13.025 601 HA LYS 99 HA LYS 99 10.395 2.784 12.478 602 1HB LYS 99 2HB LYS 99 7.866 1.236 12.942 603 2HB LYS 99 1HB LYS 99 9.471 0.565 12.709 604 1HG LYS 99 2HG LYS 99 10.169 1.941 14.641 605 2HG LYS 99 1HG LYS 99 8.499 2.238 14.982 606 1HD LYS 99 2HD LYS 99 8.050 -0.179 15.093 607 2HD LYS 99 1HD LYS 99 9.767 -0.456 14.760 608 1HE LYS 99 2HE LYS 99 10.391 0.645 16.826 609 2HE LYS 99 1HE LYS 99 8.702 1.013 17.170 610 1HZ LYS 99 1HZ LYS 99 9.572 -0.909 18.391 611 2HZ LYS 99 2HZ LYS 99 9.823 -1.723 16.947 612 3HZ LYS 99 3HZ LYS 99 8.254 -1.330 17.428 613 H ASN 100 H ASN 100 8.195 4.186 10.659 614 HA ASN 100 HA ASN 100 7.551 4.085 8.430 615 1HB ASN 100 2HB ASN 100 10.055 2.378 8.270 616 2HB ASN 100 1HB ASN 100 9.153 2.903 6.861 617 1HD2 ASN 100 1HD2 ASN 100 10.855 4.024 6.043 618 2HD2 ASN 100 2HD2 ASN 100 11.443 5.501 6.708 619 H LEU 101 H LEU 101 6.091 2.451 9.988 620 HA LEU 101 HA LEU 101 5.903 -0.129 8.547 621 1HB LEU 101 2HB LEU 101 6.559 -0.367 10.890 622 2HB LEU 101 1HB LEU 101 5.165 0.577 11.375 623 HG LEU 101 HG LEU 101 3.742 -1.204 10.309 624 1HD1 LEU 101 1HD1 LEU 101 6.319 -2.717 10.326 625 2HD1 LEU 101 2HD1 LEU 101 5.317 -2.260 8.936 626 3HD1 LEU 101 3HD1 LEU 101 4.704 -3.413 10.114 627 1HD2 LEU 101 1HD2 LEU 101 3.886 -2.695 12.248 628 2HD2 LEU 101 2HD2 LEU 101 3.906 -0.995 12.690 629 3HD2 LEU 101 3HD2 LEU 101 5.410 -1.927 12.707 630 H ILE 102 H ILE 102 3.953 -0.576 7.661 631 HA ILE 102 HA ILE 102 1.596 0.750 8.646 632 HB ILE 102 HB ILE 102 2.284 2.365 7.075 633 1HG1 ILE 102 2HG1 ILE 102 0.465 2.317 5.338 634 2HG1 ILE 102 1HG1 ILE 102 0.103 0.674 5.842 635 1HG2 ILE 102 1HG2 ILE 102 2.728 1.854 4.667 636 2HG2 ILE 102 2HG2 ILE 102 2.645 0.149 5.104 637 3HG2 ILE 102 3HG2 ILE 102 3.889 1.156 5.804 638 1HD1 ILE 102 1HD1 ILE 102 -1.428 2.258 6.827 639 2HD1 ILE 102 2HD1 ILE 102 -0.082 3.131 7.563 640 3HD1 ILE 102 3HD1 ILE 102 -0.453 1.481 8.074 641 H THR 103 H THR 103 0.098 -0.652 8.830 642 HA THR 103 HA THR 103 0.045 -3.097 7.215 643 HB THR 103 HB THR 103 -1.483 -2.398 9.744 644 HG1 THR 103 1HG THR 103 0.673 -4.184 9.353 645 1HG2 THR 103 1HG2 THR 103 -2.020 -4.786 9.822 646 2HG2 THR 103 2HG2 THR 103 -1.141 -5.033 8.310 647 3HG2 THR 103 3HG2 THR 103 -2.607 -4.060 8.320 648 H PHE 104 H PHE 104 -1.313 -3.235 5.570 649 HA PHE 104 HA PHE 104 -3.575 -1.375 5.246 650 1HB PHE 104 2HB PHE 104 -2.156 -3.214 3.325 651 2HB PHE 104 1HB PHE 104 -3.473 -2.192 2.840 652 HD1 PHE 104 1HD PHE 104 -3.090 0.225 2.603 653 HD2 PHE 104 2HD PHE 104 0.050 -2.429 3.661 654 HE1 PHE 104 1HE PHE 104 -1.446 1.925 1.971 655 HE2 PHE 104 2HE PHE 104 1.698 -0.714 3.033 656 HZ PHE 104 HZ PHE 104 0.954 1.456 2.189 657 H ARG 105 H ARG 105 -5.628 -2.240 5.519 658 HA ARG 105 HA ARG 105 -5.939 -5.140 5.102 659 1HB ARG 105 2HB ARG 105 -6.829 -4.349 7.282 660 2HB ARG 105 1HB ARG 105 -7.828 -3.167 6.446 661 1HG ARG 105 2HG ARG 105 -8.927 -5.085 5.238 662 2HG ARG 105 1HG ARG 105 -8.058 -6.165 6.316 663 1HD ARG 105 2HD ARG 105 -10.025 -4.041 7.159 664 2HD ARG 105 1HD ARG 105 -10.394 -5.750 7.006 665 HE ARG 105 HE ARG 105 -8.336 -4.838 8.912 666 1HH1 ARG 105 1HH1 ARG 105 -11.424 -6.531 8.312 667 2HH1 ARG 105 2HH1 ARG 105 -11.610 -6.968 9.943 668 1HH2 ARG 105 1HH2 ARG 105 -8.586 -5.456 10.999 669 2HH2 ARG 105 2HH2 ARG 105 -9.929 -6.363 11.569 670 H VAL 106 H VAL 106 -6.802 -5.688 3.156 671 HA VAL 106 HA VAL 106 -7.967 -3.611 1.541 672 HB VAL 106 HB VAL 106 -7.767 -6.607 1.036 673 1HG1 VAL 106 1HG1 VAL 106 -8.209 -6.038 -1.305 674 2HG1 VAL 106 2HG1 VAL 106 -8.441 -4.350 -0.858 675 3HG1 VAL 106 3HG1 VAL 106 -9.562 -5.581 -0.269 676 1HG2 VAL 106 1HG2 VAL 106 -5.585 -5.557 1.217 677 2HG2 VAL 106 2HG2 VAL 106 -6.062 -4.324 0.053 678 3HG2 VAL 106 3HG2 VAL 106 -5.910 -6.007 -0.459 679 H ILE 107 H ILE 107 -10.017 -3.113 1.525 680 HA ILE 107 HA ILE 107 -11.800 -4.814 3.125 681 HB ILE 107 HB ILE 107 -13.140 -2.922 3.696 682 1HG1 ILE 107 2HG1 ILE 107 -13.050 -1.641 1.545 683 2HG1 ILE 107 1HG1 ILE 107 -12.768 -0.633 2.948 684 1HG2 ILE 107 1HG2 ILE 107 -11.576 -1.545 4.895 685 2HG2 ILE 107 2HG2 ILE 107 -10.263 -2.137 3.881 686 3HG2 ILE 107 3HG2 ILE 107 -11.093 -3.244 4.998 687 1HD1 ILE 107 1HD1 ILE 107 -11.324 0.006 1.144 688 2HD1 ILE 107 2HD1 ILE 107 -10.690 -1.627 1.001 689 3HD1 ILE 107 3HD1 ILE 107 -10.357 -0.675 2.451 690 H GLU 108 H GLU 108 -11.429 -3.472 -0.015 691 HA GLU 108 HA GLU 108 -14.069 -4.503 -0.754 692 1HB GLU 108 2HB GLU 108 -14.084 -2.003 -0.283 693 2HB GLU 108 1HB GLU 108 -12.948 -1.828 -1.576 694 1HG GLU 108 2HG GLU 108 -14.569 -2.782 -3.168 695 2HG GLU 108 1HG GLU 108 -15.754 -2.877 -1.870 696 H GLY 109 H GLY 109 -14.173 -4.699 -3.134 697 1HA GLY 109 2HA GLY 109 -13.137 -4.419 -5.234 698 2HA GLY 109 1HA GLY 109 -11.588 -4.552 -4.424 699 H ASP 110 H ASP 110 -11.631 -5.837 -6.421 700 HA ASP 110 HA ASP 110 -12.720 -8.326 -6.766 701 1HB ASP 110 2HB ASP 110 -10.733 -8.585 -8.269 702 2HB ASP 110 1HB ASP 110 -11.672 -7.118 -8.531 703 H LEU 111 H LEU 111 -10.038 -7.292 -4.817 704 HA LEU 111 HA LEU 111 -8.791 -9.811 -4.511 705 1HB LEU 111 2HB LEU 111 -8.721 -7.400 -2.717 706 2HB LEU 111 1HB LEU 111 -7.633 -8.772 -2.593 707 HG LEU 111 HG LEU 111 -7.808 -6.869 -4.938 708 1HD1 LEU 111 1HD1 LEU 111 -5.589 -6.121 -4.215 709 2HD1 LEU 111 2HD1 LEU 111 -5.715 -7.165 -2.796 710 3HD1 LEU 111 3HD1 LEU 111 -6.822 -5.808 -2.995 711 1HD2 LEU 111 1HD2 LEU 111 -7.166 -9.104 -5.662 712 2HD2 LEU 111 2HD2 LEU 111 -5.918 -9.168 -4.413 713 3HD2 LEU 111 3HD2 LEU 111 -5.789 -8.012 -5.740 714 H MET 112 H MET 112 -11.521 -8.341 -2.910 715 HA MET 112 HA MET 112 -11.428 -10.209 -0.731 716 1HB MET 112 2HB MET 112 -13.414 -8.090 -1.467 717 2HB MET 112 1HB MET 112 -13.691 -9.201 -0.144 718 1HG MET 112 2HG MET 112 -11.256 -7.438 -0.264 719 2HG MET 112 1HG MET 112 -12.778 -6.856 0.383 720 1HE MET 112 1HE MET 112 -10.925 -10.516 0.977 721 2HE MET 112 2HE MET 112 -10.105 -10.085 2.450 722 3HE MET 112 3HE MET 112 -9.672 -9.269 0.948 723 H LYS 113 H LYS 113 -12.598 -10.343 -3.876 724 HA LYS 113 HA LYS 113 -14.439 -12.407 -3.049 725 1HB LYS 113 2HB LYS 113 -15.379 -12.380 -5.325 726 2HB LYS 113 1HB LYS 113 -15.497 -10.840 -4.496 727 1HG LYS 113 2HG LYS 113 -15.013 -10.353 -6.647 728 2HG LYS 113 1HG LYS 113 -13.462 -10.171 -5.820 729 1HD LYS 113 2HD LYS 113 -12.830 -12.440 -6.583 730 2HD LYS 113 1HD LYS 113 -14.357 -12.546 -7.457 731 1HE LYS 113 2HE LYS 113 -13.697 -10.645 -8.830 732 2HE LYS 113 1HE LYS 113 -12.161 -10.551 -7.964 733 1HZ LYS 113 1HZ LYS 113 -11.896 -11.752 -10.023 734 2HZ LYS 113 2HZ LYS 113 -13.136 -12.810 -9.595 735 3HZ LYS 113 3HZ LYS 113 -11.704 -12.833 -8.720 736 H GLU 114 H GLU 114 -11.393 -12.109 -3.831 737 HA GLU 114 HA GLU 114 -11.114 -14.804 -4.997 738 1HB GLU 114 2HB GLU 114 -9.007 -12.710 -4.390 739 2HB GLU 114 1HB GLU 114 -8.708 -14.246 -5.177 740 1HG GLU 114 2HG GLU 114 -10.421 -12.038 -6.305 741 2HG GLU 114 1HG GLU 114 -8.722 -12.315 -6.680 742 H TYR 115 H TYR 115 -10.177 -12.752 -2.266 743 HA TYR 115 HA TYR 115 -9.482 -15.108 -0.652 744 1HB TYR 115 2HB TYR 115 -8.447 -12.276 -0.330 745 2HB TYR 115 1HB TYR 115 -7.865 -13.722 0.481 746 HD1 TYR 115 1HD TYR 115 -7.785 -11.739 -2.558 747 HD2 TYR 115 2HD TYR 115 -6.425 -15.346 -0.752 748 HE1 TYR 115 1HE TYR 115 -6.163 -12.021 -4.355 749 HE2 TYR 115 2HE TYR 115 -4.797 -15.616 -2.549 750 HH TYR 115 HH TYR 115 -4.101 -13.148 -4.773 751 H LYS 116 H LYS 116 -10.492 -15.139 1.342 752 HA LYS 116 HA LYS 116 -12.638 -13.224 1.618 753 1HB LYS 116 2HB LYS 116 -13.378 -14.731 3.527 754 2HB LYS 116 1HB LYS 116 -13.528 -15.371 1.908 755 1HG LYS 116 2HG LYS 116 -11.300 -16.535 2.345 756 2HG LYS 116 1HG LYS 116 -11.510 -16.074 4.036 757 1HD LYS 116 2HD LYS 116 -13.481 -17.707 2.415 758 2HD LYS 116 1HD LYS 116 -12.334 -18.382 3.573 759 1HE LYS 116 2HE LYS 116 -14.490 -16.380 4.233 760 2HE LYS 116 1HE LYS 116 -14.675 -18.120 4.422 761 1HZ LYS 116 1HZ LYS 116 -14.052 -16.912 6.477 762 2HZ LYS 116 2HZ LYS 116 -12.555 -16.538 5.799 763 3HZ LYS 116 3HZ LYS 116 -12.990 -18.138 6.067 764 H SER 117 H SER 117 -9.639 -13.182 2.453 765 HA SER 117 HA SER 117 -9.956 -10.939 4.095 766 1HB SER 117 2HB SER 117 -10.341 -12.578 5.767 767 2HB SER 117 1HB SER 117 -8.813 -13.414 5.387 768 HG SER 117 HG SER 117 -9.308 -11.181 6.913 769 H PHE 118 H PHE 118 -8.103 -9.742 4.025 770 HA PHE 118 HA PHE 118 -5.604 -10.862 3.249 771 1HB PHE 118 2HB PHE 118 -6.643 -10.719 1.039 772 2HB PHE 118 1HB PHE 118 -7.095 -9.046 1.323 773 HD1 PHE 118 1HD PHE 118 -3.762 -10.377 2.240 774 HD2 PHE 118 2HD PHE 118 -6.029 -8.244 -0.664 775 HE1 PHE 118 1HE PHE 118 -1.693 -9.675 1.145 776 HE2 PHE 118 2HE PHE 118 -3.940 -7.529 -1.758 777 HZ PHE 118 HZ PHE 118 -1.779 -8.243 -0.859 778 H LEU 119 H LEU 119 -4.209 -9.882 4.449 779 HA LEU 119 HA LEU 119 -4.492 -7.036 5.103 780 1HB LEU 119 2HB LEU 119 -5.278 -8.551 6.936 781 2HB LEU 119 1HB LEU 119 -3.710 -9.324 6.917 782 HG LEU 119 HG LEU 119 -2.712 -7.126 7.597 783 1HD1 LEU 119 1HD1 LEU 119 -4.217 -5.458 8.555 784 2HD1 LEU 119 2HD1 LEU 119 -5.599 -6.366 7.955 785 3HD1 LEU 119 3HD1 LEU 119 -4.454 -5.644 6.819 786 1HD2 LEU 119 1HD2 LEU 119 -3.421 -7.311 9.932 787 2HD2 LEU 119 2HD2 LEU 119 -3.144 -8.898 9.217 788 3HD2 LEU 119 3HD2 LEU 119 -4.790 -8.308 9.438 789 H LEU 120 H LEU 120 -2.526 -6.022 4.682 790 HA LEU 120 HA LEU 120 -0.167 -7.713 4.642 791 1HB LEU 120 2HB LEU 120 0.704 -6.716 2.580 792 2HB LEU 120 1HB LEU 120 -0.764 -7.619 2.305 793 HG LEU 120 HG LEU 120 -0.615 -4.590 2.425 794 1HD1 LEU 120 1HD1 LEU 120 -0.789 -4.682 -0.008 795 2HD1 LEU 120 2HD1 LEU 120 -0.711 -6.445 0.049 796 3HD1 LEU 120 3HD1 LEU 120 0.676 -5.483 0.559 797 1HD2 LEU 120 1HD2 LEU 120 -2.850 -5.495 2.916 798 2HD2 LEU 120 2HD2 LEU 120 -2.792 -6.446 1.432 799 3HD2 LEU 120 3HD2 LEU 120 -2.821 -4.684 1.350 800 H THR 121 H THR 121 1.571 -6.907 5.461 801 HA THR 121 HA THR 121 1.464 -4.100 6.345 802 HB THR 121 HB THR 121 2.857 -6.434 7.675 803 HG1 THR 121 1HG THR 121 0.599 -6.563 7.865 804 1HG2 THR 121 1HG2 THR 121 3.934 -4.276 8.056 805 2HG2 THR 121 2HG2 THR 121 3.149 -4.852 9.532 806 3HG2 THR 121 3HG2 THR 121 2.400 -3.585 8.559 807 H ILE 122 H ILE 122 3.116 -2.828 5.697 808 HA ILE 122 HA ILE 122 5.511 -4.194 4.707 809 HB ILE 122 HB ILE 122 5.860 -2.436 3.069 810 1HG1 ILE 122 2HG1 ILE 122 3.223 -1.348 3.961 811 2HG1 ILE 122 1HG1 ILE 122 4.779 -0.610 4.301 812 1HG2 ILE 122 1HG2 ILE 122 4.547 -4.355 2.366 813 2HG2 ILE 122 2HG2 ILE 122 3.960 -2.898 1.574 814 3HG2 ILE 122 3HG2 ILE 122 3.072 -3.568 2.935 815 1HD1 ILE 122 1HD1 ILE 122 3.581 -0.985 1.556 816 2HD1 ILE 122 2HD1 ILE 122 5.154 -0.263 1.902 817 3HD1 ILE 122 3HD1 ILE 122 3.676 0.535 2.449 818 H GLN 123 H GLN 123 7.445 -3.214 5.133 819 HA GLN 123 HA GLN 123 7.414 -0.775 6.685 820 1HB GLN 123 2HB GLN 123 7.339 -2.665 8.333 821 2HB GLN 123 1HB GLN 123 8.848 -3.253 7.658 822 1HG GLN 123 2HG GLN 123 10.014 -1.277 8.367 823 2HG GLN 123 1HG GLN 123 8.513 -0.531 8.900 824 1HE2 GLN 123 1HE2 GLN 123 9.232 -0.271 10.955 825 2HE2 GLN 123 2HE2 GLN 123 9.433 -1.554 12.087 826 H VAL 124 H VAL 124 9.085 0.463 6.247 827 HA VAL 124 HA VAL 124 10.937 -0.514 4.208 828 HB VAL 124 HB VAL 124 10.452 2.327 5.178 829 1HG1 VAL 124 1HG1 VAL 124 11.745 3.019 3.222 830 2HG1 VAL 124 2HG1 VAL 124 12.055 1.327 2.829 831 3HG1 VAL 124 3HG1 VAL 124 12.714 2.028 4.310 832 1HG2 VAL 124 1HG2 VAL 124 8.525 1.411 4.004 833 2HG2 VAL 124 2HG2 VAL 124 9.556 0.939 2.655 834 3HG2 VAL 124 3HG2 VAL 124 9.317 2.646 3.029 835 H THR 125 H THR 125 12.962 -0.938 4.651 836 HA THR 125 HA THR 125 14.061 -0.116 7.242 837 HB THR 125 HB THR 125 14.135 -2.882 6.002 838 HG1 THR 125 1HG THR 125 12.312 -1.622 7.492 839 1HG2 THR 125 1HG2 THR 125 15.068 -3.597 8.154 840 2HG2 THR 125 2HG2 THR 125 15.033 -1.933 8.740 841 3HG2 THR 125 3HG2 THR 125 16.110 -2.378 7.414 842 HA PRO 126 HA PRO 126 17.742 0.987 4.794 843 1HB PRO 126 2HB PRO 126 19.039 -0.350 7.148 844 2HB PRO 126 1HB PRO 126 19.459 1.184 6.373 845 1HG PRO 126 2HG PRO 126 18.126 1.164 8.664 846 2HG PRO 126 1HG PRO 126 17.710 2.329 7.390 847 1HD PRO 126 2HD PRO 126 16.279 -0.111 8.286 848 2HD PRO 126 1HD PRO 126 15.631 1.398 7.615 849 H LYS 127 H LYS 127 18.377 -0.246 3.164 850 HA LYS 127 HA LYS 127 17.964 -3.013 3.100 851 1HB LYS 127 2HB LYS 127 18.916 -3.053 0.833 852 2HB LYS 127 1HB LYS 127 17.880 -1.649 1.064 853 1HG LYS 127 2HG LYS 127 20.849 -1.498 1.252 854 2HG LYS 127 1HG LYS 127 19.968 -1.325 -0.264 855 1HD LYS 127 2HD LYS 127 18.684 0.435 0.685 856 2HD LYS 127 1HD LYS 127 19.562 0.313 2.202 857 1HE LYS 127 2HE LYS 127 21.715 0.743 1.016 858 2HE LYS 127 1HE LYS 127 20.813 0.998 -0.476 859 1HZ LYS 127 1HZ LYS 127 21.345 3.102 0.503 860 2HZ LYS 127 2HZ LYS 127 20.647 2.672 1.980 861 3HZ LYS 127 3HZ LYS 127 19.692 2.857 0.631 862 HA PRO 128 HA PRO 128 21.823 -4.603 4.708 863 1HB PRO 128 2HB PRO 128 21.304 -6.995 3.056 864 2HB PRO 128 1HB PRO 128 21.413 -6.872 4.813 865 1HG PRO 128 2HG PRO 128 19.073 -7.323 3.582 866 2HG PRO 128 1HG PRO 128 19.178 -6.332 5.047 867 1HD PRO 128 2HD PRO 128 18.930 -5.469 2.189 868 2HD PRO 128 1HD PRO 128 18.117 -4.833 3.636 869 H GLY 129 H GLY 129 20.910 -4.575 1.371 870 1HA GLY 129 2HA GLY 129 23.434 -3.643 0.497 871 2HA GLY 129 1HA GLY 129 23.131 -5.307 -0.021 872 H GLY 130 H GLY 130 23.227 -2.834 -1.662 873 1HA GLY 130 2HA GLY 130 21.959 -2.855 -3.730 874 2HA GLY 130 1HA GLY 130 20.510 -3.103 -2.760 875 HA PRO 131 HA PRO 131 20.987 1.464 -3.256 876 1HB PRO 131 2HB PRO 131 19.186 1.988 -5.102 877 2HB PRO 131 1HB PRO 131 20.725 1.250 -5.553 878 1HG PRO 131 2HG PRO 131 18.027 0.006 -5.349 879 2HG PRO 131 1HG PRO 131 19.350 -0.367 -6.459 880 1HD PRO 131 2HD PRO 131 18.704 -1.729 -4.042 881 2HD PRO 131 1HD PRO 131 20.139 -1.979 -5.055 882 H GLY 132 H GLY 132 19.522 3.187 -2.729 883 1HA GLY 132 2HA GLY 132 17.830 4.252 -1.627 884 2HA GLY 132 1HA GLY 132 16.774 3.071 -2.370 885 H SER 133 H SER 133 15.840 1.585 -1.124 886 HA SER 133 HA SER 133 16.757 0.959 1.569 887 1HB SER 133 2HB SER 133 14.025 2.191 1.108 888 2HB SER 133 1HB SER 133 14.711 1.684 2.648 889 HG SER 133 HG SER 133 15.356 3.857 1.011 890 H ILE 134 H ILE 134 15.532 -0.970 2.385 891 HA ILE 134 HA ILE 134 14.381 -2.194 0.164 892 HB ILE 134 HB ILE 134 15.340 -3.413 2.751 893 1HG1 ILE 134 2HG1 ILE 134 16.894 -3.162 0.925 894 2HG1 ILE 134 1HG1 ILE 134 16.621 -4.865 1.308 895 1HG2 ILE 134 1HG2 ILE 134 14.513 -5.647 2.117 896 2HG2 ILE 134 2HG2 ILE 134 13.600 -4.895 0.805 897 3HG2 ILE 134 3HG2 ILE 134 13.212 -4.510 2.481 898 1HD1 ILE 134 1HD1 ILE 134 15.491 -3.323 -1.010 899 2HD1 ILE 134 2HD1 ILE 134 15.140 -5.009 -0.625 900 3HD1 ILE 134 3HD1 ILE 134 16.782 -4.524 -1.059 901 H VAL 135 H VAL 135 12.090 -2.682 0.231 902 HA VAL 135 HA VAL 135 10.749 -2.106 2.764 903 HB VAL 135 HB VAL 135 9.910 -0.604 1.005 904 1HG1 VAL 135 1HG1 VAL 135 9.085 -3.055 -0.496 905 2HG1 VAL 135 2HG1 VAL 135 10.343 -1.908 -0.958 906 3HG1 VAL 135 3HG1 VAL 135 8.654 -1.398 -0.918 907 1HG2 VAL 135 1HG2 VAL 135 7.854 -2.668 1.776 908 2HG2 VAL 135 2HG2 VAL 135 7.499 -1.047 1.180 909 3HG2 VAL 135 3HG2 VAL 135 8.328 -1.257 2.722 910 H HIS 136 H HIS 136 10.043 -3.680 3.883 911 HA HIS 136 HA HIS 136 9.952 -6.327 2.687 912 1HB HIS 136 2HB HIS 136 9.954 -5.401 5.555 913 2HB HIS 136 1HB HIS 136 9.590 -7.064 5.138 914 HD1 HIS 136 1HD HIS 136 11.564 -8.529 4.291 915 HD2 HIS 136 2HD HIS 136 12.675 -4.662 5.376 916 HE1 HIS 136 1HE HIS 136 14.055 -8.556 4.433 917 HE2 HIS 136 2HE HIS 136 14.676 -6.314 5.328 918 H TRP 137 H TRP 137 8.172 -7.002 1.842 919 HA TRP 137 HA TRP 137 5.612 -5.994 2.765 920 1HB TRP 137 2HB TRP 137 6.395 -7.661 0.362 921 2HB TRP 137 1HB TRP 137 4.756 -7.222 0.784 922 HD1 TRP 137 HD TRP 137 8.073 -5.338 -0.135 923 HE1 TRP 137 1HE TRP 137 7.393 -3.240 -1.429 924 HE3 TRP 137 3HE TRP 137 2.986 -5.796 0.155 925 HZ2 TRP 137 2HZ TRP 137 5.037 -1.931 -2.223 926 HZ3 TRP 137 3HZ TRP 137 1.592 -4.072 -0.900 927 HH2 TRP 137 HH TRP 137 2.574 -2.198 -2.049 928 H HIS 138 H HIS 138 4.401 -7.150 4.084 929 HA HIS 138 HA HIS 138 4.845 -10.062 4.253 930 1HB HIS 138 2HB HIS 138 3.752 -8.283 6.449 931 2HB HIS 138 1HB HIS 138 4.224 -9.969 6.582 932 HD1 HIS 138 1HD HIS 138 6.888 -10.422 6.520 933 HD2 HIS 138 2HD HIS 138 5.671 -6.475 6.909 934 HE1 HIS 138 1HE HIS 138 8.895 -9.159 7.326 935 HE2 HIS 138 2HE HIS 138 7.964 -6.969 7.970 936 H LEU 139 H LEU 139 3.124 -11.006 3.248 937 HA LEU 139 HA LEU 139 0.579 -9.585 3.399 938 1HB LEU 139 2HB LEU 139 1.574 -11.480 1.272 939 2HB LEU 139 1HB LEU 139 -0.003 -10.734 1.282 940 HG LEU 139 HG LEU 139 1.250 -8.507 1.163 941 1HD1 LEU 139 1HD1 LEU 139 3.460 -9.187 1.728 942 2HD1 LEU 139 2HD1 LEU 139 3.443 -8.550 0.074 943 3HD1 LEU 139 3HD1 LEU 139 3.513 -10.287 0.352 944 1HD2 LEU 139 1HD2 LEU 139 1.404 -10.393 -1.137 945 2HD2 LEU 139 2HD2 LEU 139 1.497 -8.633 -1.263 946 3HD2 LEU 139 3HD2 LEU 139 0.009 -9.409 -0.705 947 H GLU 140 H GLU 140 -1.020 -10.565 4.409 948 HA GLU 140 HA GLU 140 -0.902 -13.463 4.765 949 1HB GLU 140 2HB GLU 140 -1.700 -11.378 6.807 950 2HB GLU 140 1HB GLU 140 -1.827 -13.120 7.036 951 1HG GLU 140 2HG GLU 140 0.574 -13.347 6.849 952 2HG GLU 140 1HG GLU 140 0.735 -11.624 6.550 953 H TYR 141 H TYR 141 -2.720 -14.431 4.221 954 HA TYR 141 HA TYR 141 -5.183 -12.936 3.943 955 1HB TYR 141 2HB TYR 141 -5.353 -13.534 1.487 956 2HB TYR 141 1HB TYR 141 -4.214 -12.263 1.886 957 HD1 TYR 141 1HD TYR 141 -1.754 -12.850 2.014 958 HD2 TYR 141 2HD TYR 141 -4.644 -15.451 0.333 959 HE1 TYR 141 1HE TYR 141 0.028 -14.035 0.862 960 HE2 TYR 141 2HE TYR 141 -2.891 -16.663 -0.838 961 HH TYR 141 HH TYR 141 0.424 -16.257 -0.109 962 H GLU 142 H GLU 142 -6.917 -14.306 3.047 963 HA GLU 142 HA GLU 142 -6.565 -17.113 3.880 964 1HB GLU 142 2HB GLU 142 -7.646 -15.704 5.627 965 2HB GLU 142 1HB GLU 142 -8.867 -15.254 4.455 966 1HG GLU 142 2HG GLU 142 -9.645 -17.560 4.380 967 2HG GLU 142 1HG GLU 142 -8.400 -18.017 5.546 968 H LYS 143 H LYS 143 -7.184 -18.478 2.315 969 HA LYS 143 HA LYS 143 -8.271 -17.495 -0.145 970 1HB LYS 143 2HB LYS 143 -7.696 -20.329 0.757 971 2HB LYS 143 1HB LYS 143 -8.359 -19.939 -0.804 972 1HG LYS 143 2HG LYS 143 -6.009 -20.390 -1.008 973 2HG LYS 143 1HG LYS 143 -6.304 -18.688 -1.331 974 1HD LYS 143 2HD LYS 143 -5.512 -18.115 0.879 975 2HD LYS 143 1HD LYS 143 -5.296 -19.824 1.272 976 1HE LYS 143 2HE LYS 143 -3.934 -18.346 -0.941 977 2HE LYS 143 1HE LYS 143 -3.186 -18.691 0.626 978 1HZ LYS 143 1HZ LYS 143 -2.445 -20.306 -0.913 979 2HZ LYS 143 2HZ LYS 143 -3.978 -20.666 -1.489 980 3HZ LYS 143 3HZ LYS 143 -3.503 -21.095 0.077 981 H ILE 144 H ILE 144 -10.362 -17.585 -0.878 982 HA ILE 144 HA ILE 144 -12.496 -18.492 0.819 983 HB ILE 144 HB ILE 144 -12.468 -17.820 -2.152 984 1HG1 ILE 144 2HG1 ILE 144 -13.388 -16.237 0.225 985 2HG1 ILE 144 1HG1 ILE 144 -11.919 -15.929 -0.695 986 1HG2 ILE 144 1HG2 ILE 144 -14.839 -18.240 -0.332 987 2HG2 ILE 144 2HG2 ILE 144 -14.343 -19.294 -1.656 988 3HG2 ILE 144 3HG2 ILE 144 -14.916 -17.659 -1.996 989 1HD1 ILE 144 1HD1 ILE 144 -13.662 -14.367 -1.270 990 2HD1 ILE 144 2HD1 ILE 144 -14.749 -15.700 -1.675 991 3HD1 ILE 144 3HD1 ILE 144 -13.299 -15.423 -2.643 992 H SER 145 H SER 145 -10.689 -19.615 -1.851 993 HA SER 145 HA SER 145 -10.822 -22.295 -1.124 994 1HB SER 145 2HB SER 145 -12.992 -22.115 -2.350 995 2HB SER 145 1HB SER 145 -12.144 -21.464 -3.744 996 HG SER 145 HG SER 145 -12.462 -24.017 -2.889 997 H GLU 146 H GLU 146 -9.355 -23.420 -2.720 998 HA GLU 146 HA GLU 146 -7.045 -21.727 -2.905 999 1HB GLU 146 2HB GLU 146 -7.487 -24.503 -3.762 1000 2HB GLU 146 1HB GLU 146 -5.912 -23.719 -3.686 1001 1HG GLU 146 2HG GLU 146 -6.234 -23.392 -1.235 1002 2HG GLU 146 1HG GLU 146 -7.736 -24.307 -1.342 1003 H GLU 147 H GLU 147 -9.026 -23.523 -5.161 1004 HA GLU 147 HA GLU 147 -7.713 -22.850 -7.543 1005 1HB GLU 147 2HB GLU 147 -9.853 -23.425 -8.643 1006 2HB GLU 147 1HB GLU 147 -9.375 -24.619 -7.445 1007 1HG GLU 147 2HG GLU 147 -10.957 -23.642 -5.844 1008 2HG GLU 147 1HG GLU 147 -11.413 -22.446 -7.051 1009 H VAL 148 H VAL 148 -9.553 -21.054 -5.473 1010 HA VAL 148 HA VAL 148 -10.514 -19.100 -7.431 1011 HB VAL 148 HB VAL 148 -10.859 -19.128 -4.420 1012 1HG1 VAL 148 1HG1 VAL 148 -12.258 -17.422 -6.486 1013 2HG1 VAL 148 2HG1 VAL 148 -11.053 -16.864 -5.320 1014 3HG1 VAL 148 3HG1 VAL 148 -12.612 -17.466 -4.758 1015 1HG2 VAL 148 1HG2 VAL 148 -12.762 -19.887 -6.621 1016 2HG2 VAL 148 2HG2 VAL 148 -13.111 -19.906 -4.884 1017 3HG2 VAL 148 3HG2 VAL 148 -11.893 -20.993 -5.564 1018 H ALA 149 H ALA 149 -8.043 -19.383 -5.004 1019 HA ALA 149 HA ALA 149 -7.407 -16.537 -5.134 1020 1HB ALA 149 1HB ALA 149 -7.586 -17.598 -2.953 1021 2HB ALA 149 2HB ALA 149 -5.948 -17.017 -3.267 1022 3HB ALA 149 3HB ALA 149 -6.311 -18.732 -3.423 1023 H HIS 150 H HIS 150 -5.512 -15.758 -5.945 1024 HA HIS 150 HA HIS 150 -3.527 -17.649 -6.945 1025 1HB HIS 150 2HB HIS 150 -4.861 -15.526 -8.629 1026 2HB HIS 150 1HB HIS 150 -3.279 -16.168 -9.023 1027 HD1 HIS 150 1HD HIS 150 -3.369 -17.927 -10.675 1028 HD2 HIS 150 2HD HIS 150 -6.843 -17.861 -8.416 1029 HE1 HIS 150 1HE HIS 150 -4.827 -19.770 -11.612 1030 HE2 HIS 150 2HE HIS 150 -6.651 -19.938 -9.944 1031 HA PRO 151 HA PRO 151 -1.332 -14.682 -4.233 1032 1HB PRO 151 2HB PRO 151 0.687 -16.815 -4.760 1033 2HB PRO 151 1HB PRO 151 0.250 -16.035 -3.231 1034 1HG PRO 151 2HG PRO 151 -0.604 -18.482 -3.748 1035 2HG PRO 151 1HG PRO 151 -1.691 -17.301 -2.992 1036 1HD PRO 151 2HD PRO 151 -1.641 -18.291 -5.816 1037 2HD PRO 151 1HD PRO 151 -3.016 -17.883 -4.779 1038 H GLU 152 H GLU 152 -0.689 -15.807 -7.355 1039 HA GLU 152 HA GLU 152 1.735 -14.791 -8.264 1040 1HB GLU 152 2HB GLU 152 -0.887 -14.502 -9.705 1041 2HB GLU 152 1HB GLU 152 0.709 -14.667 -10.408 1042 1HG GLU 152 2HG GLU 152 0.849 -16.888 -9.647 1043 2HG GLU 152 1HG GLU 152 -0.713 -16.793 -8.840 1044 H THR 153 H THR 153 -1.371 -13.351 -7.916 1045 HA THR 153 HA THR 153 -0.897 -10.927 -9.216 1046 HB THR 153 HB THR 153 -3.178 -10.427 -8.495 1047 HG1 THR 153 1HG THR 153 -3.322 -12.870 -7.096 1048 1HG2 THR 153 1HG2 THR 153 -2.816 -12.046 -10.338 1049 2HG2 THR 153 2HG2 THR 153 -4.252 -12.450 -9.387 1050 3HG2 THR 153 3HG2 THR 153 -2.747 -13.352 -9.163 1051 H LEU 154 H LEU 154 -0.656 -11.974 -5.901 1052 HA LEU 154 HA LEU 154 -0.658 -9.412 -4.782 1053 1HB LEU 154 2HB LEU 154 0.156 -12.080 -3.754 1054 2HB LEU 154 1HB LEU 154 0.548 -10.636 -2.850 1055 HG LEU 154 HG LEU 154 -1.824 -10.080 -2.670 1056 1HD1 LEU 154 1HD1 LEU 154 -2.656 -11.017 -4.694 1057 2HD1 LEU 154 2HD1 LEU 154 -3.540 -11.657 -3.309 1058 3HD1 LEU 154 3HD1 LEU 154 -2.316 -12.652 -4.111 1059 1HD2 LEU 154 1HD2 LEU 154 -1.192 -12.881 -1.810 1060 2HD2 LEU 154 2HD2 LEU 154 -2.489 -11.864 -1.176 1061 3HD2 LEU 154 3HD2 LEU 154 -0.808 -11.395 -0.940 1062 H LEU 155 H LEU 155 1.933 -11.411 -6.008 1063 HA LEU 155 HA LEU 155 4.029 -9.784 -5.060 1064 1HB LEU 155 2HB LEU 155 3.912 -11.525 -7.510 1065 2HB LEU 155 1HB LEU 155 5.368 -10.741 -6.929 1066 HG LEU 155 HG LEU 155 3.795 -12.857 -5.467 1067 1HD1 LEU 155 1HD1 LEU 155 6.485 -12.875 -6.776 1068 2HD1 LEU 155 2HD1 LEU 155 5.041 -13.703 -7.369 1069 3HD1 LEU 155 3HD1 LEU 155 5.793 -14.205 -5.840 1070 1HD2 LEU 155 1HD2 LEU 155 6.349 -11.430 -4.717 1071 2HD2 LEU 155 2HD2 LEU 155 5.669 -12.816 -3.866 1072 3HD2 LEU 155 3HD2 LEU 155 4.802 -11.280 -3.894 1073 H GLN 156 H GLN 156 2.232 -9.739 -8.092 1074 HA GLN 156 HA GLN 156 3.644 -7.429 -8.844 1075 1HB GLN 156 2HB GLN 156 2.174 -7.294 -10.867 1076 2HB GLN 156 1HB GLN 156 3.090 -8.769 -10.693 1077 1HG GLN 156 2HG GLN 156 1.016 -9.454 -11.486 1078 2HG GLN 156 1HG GLN 156 0.978 -9.782 -9.759 1079 1HE2 GLN 156 1HE2 GLN 156 0.604 -6.546 -10.995 1080 2HE2 GLN 156 2HE2 GLN 156 -1.063 -6.396 -10.638 1081 H PHE 157 H PHE 157 0.670 -7.878 -7.204 1082 HA PHE 157 HA PHE 157 -0.275 -5.255 -7.296 1083 1HB PHE 157 2HB PHE 157 -1.571 -7.114 -6.296 1084 2HB PHE 157 1HB PHE 157 -0.387 -7.254 -5.008 1085 HD1 PHE 157 1HD PHE 157 -0.894 -6.278 -2.971 1086 HD2 PHE 157 2HD PHE 157 -2.669 -4.714 -6.508 1087 HE1 PHE 157 1HE PHE 157 -2.231 -4.672 -1.598 1088 HE2 PHE 157 2HE PHE 157 -3.991 -3.133 -5.151 1089 HZ PHE 157 HZ PHE 157 -3.764 -3.123 -2.703 1090 H CYS 158 H CYS 158 2.232 -6.765 -5.307 1091 HA CYS 158 HA CYS 158 2.869 -4.553 -3.688 1092 1HB CYS 158 2HB CYS 158 4.699 -6.742 -4.721 1093 2HB CYS 158 1HB CYS 158 5.057 -5.665 -3.375 1094 HG CYS 158 HG CYS 158 2.567 -7.998 -3.464 1095 H VAL 159 H VAL 159 4.024 -5.634 -6.822 1096 HA VAL 159 HA VAL 159 5.967 -3.706 -7.365 1097 HB VAL 159 HB VAL 159 4.090 -5.037 -9.344 1098 1HG1 VAL 159 1HG1 VAL 159 6.760 -3.725 -9.805 1099 2HG1 VAL 159 2HG1 VAL 159 5.183 -3.134 -10.332 1100 3HG1 VAL 159 3HG1 VAL 159 5.828 -4.628 -11.010 1101 1HG2 VAL 159 1HG2 VAL 159 6.838 -5.893 -8.434 1102 2HG2 VAL 159 2HG2 VAL 159 5.860 -6.673 -9.678 1103 3HG2 VAL 159 3HG2 VAL 159 5.311 -6.669 -8.003 1104 H GLU 160 H GLU 160 2.501 -3.687 -8.079 1105 HA GLU 160 HA GLU 160 2.213 -1.324 -9.471 1106 1HB GLU 160 2HB GLU 160 0.366 -2.550 -7.431 1107 2HB GLU 160 1HB GLU 160 -0.093 -1.256 -8.528 1108 1HG GLU 160 2HG GLU 160 0.891 -3.954 -9.400 1109 2HG GLU 160 1HG GLU 160 -0.808 -3.508 -9.253 1110 H VAL 161 H VAL 161 2.078 -1.765 -5.978 1111 HA VAL 161 HA VAL 161 1.697 0.999 -5.424 1112 HB VAL 161 HB VAL 161 2.670 -1.189 -3.613 1113 1HG1 VAL 161 1HG1 VAL 161 1.809 0.233 -1.758 1114 2HG1 VAL 161 2HG1 VAL 161 1.431 1.492 -2.936 1115 3HG1 VAL 161 3HG1 VAL 161 3.105 1.018 -2.661 1116 1HG2 VAL 161 1HG2 VAL 161 0.524 -1.786 -4.558 1117 2HG2 VAL 161 2HG2 VAL 161 -0.145 -0.218 -4.107 1118 3HG2 VAL 161 3HG2 VAL 161 0.315 -1.373 -2.857 1119 H SER 162 H SER 162 4.522 -1.116 -5.659 1120 HA SER 162 HA SER 162 6.403 0.393 -4.356 1121 1HB SER 162 2HB SER 162 6.771 -1.355 -6.784 1122 2HB SER 162 1HB SER 162 8.078 -0.755 -5.760 1123 HG SER 162 HG SER 162 5.912 -2.409 -4.897 1124 H LYS 163 H LYS 163 5.547 0.682 -7.822 1125 HA LYS 163 HA LYS 163 7.495 2.739 -8.260 1126 1HB LYS 163 2HB LYS 163 5.020 2.240 -9.929 1127 2HB LYS 163 1HB LYS 163 6.332 3.302 -10.387 1128 1HG LYS 163 2HG LYS 163 6.759 1.405 -11.640 1129 2HG LYS 163 1HG LYS 163 7.776 1.149 -10.229 1130 1HD LYS 163 2HD LYS 163 6.736 -0.915 -10.637 1131 2HD LYS 163 1HD LYS 163 5.849 -0.228 -9.284 1132 1HE LYS 163 2HE LYS 163 4.966 -0.237 -12.189 1133 2HE LYS 163 1HE LYS 163 4.345 -1.286 -10.934 1134 1HZ LYS 163 1HZ LYS 163 3.949 1.670 -11.154 1135 2HZ LYS 163 2HZ LYS 163 3.380 0.767 -9.843 1136 3HZ LYS 163 3HZ LYS 163 2.815 0.485 -11.380 1137 H GLU 164 H GLU 164 4.151 2.761 -7.363 1138 HA GLU 164 HA GLU 164 3.470 5.425 -7.796 1139 1HB GLU 164 2HB GLU 164 1.954 3.484 -7.189 1140 2HB GLU 164 1HB GLU 164 2.533 3.689 -5.540 1141 1HG GLU 164 2HG GLU 164 0.371 4.751 -5.843 1142 2HG GLU 164 1HG GLU 164 1.626 5.935 -5.470 1143 H ILE 165 H ILE 165 4.683 3.804 -4.909 1144 HA ILE 165 HA ILE 165 4.820 6.249 -3.467 1145 HB ILE 165 HB ILE 165 4.310 4.215 -2.265 1146 1HG1 ILE 165 2HG1 ILE 165 5.893 4.392 -0.375 1147 2HG1 ILE 165 1HG1 ILE 165 6.996 5.292 -1.408 1148 1HG2 ILE 165 1HG2 ILE 165 5.972 2.453 -1.834 1149 2HG2 ILE 165 2HG2 ILE 165 7.057 3.231 -2.988 1150 3HG2 ILE 165 3HG2 ILE 165 5.515 2.574 -3.534 1151 1HD1 ILE 165 1HD1 ILE 165 4.231 6.167 -0.617 1152 2HD1 ILE 165 2HD1 ILE 165 5.371 7.030 -1.660 1153 3HD1 ILE 165 3HD1 ILE 165 5.761 6.779 0.045 1154 H ASP 166 H ASP 166 7.157 4.155 -4.916 1155 HA ASP 166 HA ASP 166 9.567 5.307 -4.059 1156 1HB ASP 166 2HB ASP 166 9.487 3.176 -5.200 1157 2HB ASP 166 1HB ASP 166 8.930 3.951 -6.670 1158 H GLU 167 H GLU 167 7.846 5.995 -7.110 1159 HA GLU 167 HA GLU 167 9.600 8.159 -7.763 1160 1HB GLU 167 2HB GLU 167 6.941 7.354 -8.944 1161 2HB GLU 167 1HB GLU 167 7.942 8.664 -9.555 1162 1HG GLU 167 2HG GLU 167 9.752 7.082 -9.992 1163 2HG GLU 167 1HG GLU 167 8.738 5.767 -9.406 1164 H HIS 168 H HIS 168 6.687 7.971 -5.983 1165 HA HIS 168 HA HIS 168 6.212 10.775 -6.000 1166 1HB HIS 168 2HB HIS 168 4.520 9.011 -5.355 1167 2HB HIS 168 1HB HIS 168 5.410 8.790 -3.859 1168 HD1 HIS 168 1HD HIS 168 2.956 10.968 -5.525 1169 HD2 HIS 168 2HD HIS 168 5.156 10.963 -2.008 1170 HE1 HIS 168 1HE HIS 168 1.907 12.723 -4.075 1171 HE2 HIS 168 2HE HIS 168 2.921 12.236 -1.865 1172 H LEU 169 H LEU 169 8.218 8.624 -4.078 1173 HA LEU 169 HA LEU 169 9.038 10.642 -2.130 1174 1HB LEU 169 2HB LEU 169 10.275 7.984 -2.851 1175 2HB LEU 169 1HB LEU 169 10.693 8.973 -1.473 1176 HG LEU 169 HG LEU 169 8.062 7.551 -1.897 1177 1HD1 LEU 169 1HD1 LEU 169 10.335 6.984 -0.001 1178 2HD1 LEU 169 2HD1 LEU 169 9.876 6.018 -1.403 1179 3HD1 LEU 169 3HD1 LEU 169 8.782 6.150 -0.028 1180 1HD2 LEU 169 1HD2 LEU 169 7.556 8.219 0.397 1181 2HD2 LEU 169 2HD2 LEU 169 7.774 9.626 -0.643 1182 3HD2 LEU 169 3HD2 LEU 169 9.055 9.140 0.468 1183 H LEU 170 H LEU 170 10.490 9.232 -5.044 1184 HA LEU 170 HA LEU 170 12.863 10.782 -4.799 1185 1HB LEU 170 2HB LEU 170 11.602 9.615 -7.270 1186 2HB LEU 170 1HB LEU 170 13.237 10.224 -7.144 1187 HG LEU 170 HG LEU 170 12.163 7.839 -5.657 1188 1HD1 LEU 170 1HD1 LEU 170 12.321 7.488 -8.075 1189 2HD1 LEU 170 2HD1 LEU 170 13.531 6.549 -7.215 1190 3HD1 LEU 170 3HD1 LEU 170 13.994 8.035 -8.049 1191 1HD2 LEU 170 1HD2 LEU 170 14.528 7.443 -5.114 1192 2HD2 LEU 170 2HD2 LEU 170 13.961 8.970 -4.450 1193 3HD2 LEU 170 3HD2 LEU 170 14.963 8.958 -5.904 1194 H ALA 171 H ALA 171 9.889 11.175 -6.612 1195 HA ALA 171 HA ALA 171 9.020 12.813 -7.854 1196 1HB ALA 171 1HB ALA 171 8.291 14.662 -6.519 1197 2HB ALA 171 2HB ALA 171 9.591 14.354 -5.347 1198 3HB ALA 171 3HB ALA 171 8.307 13.160 -5.588 1199 H GLU 172 H GLU 172 10.367 13.114 -9.579 1200 HA GLU 172 HA GLU 172 12.221 15.354 -9.350 1201 1HB GLU 172 2HB GLU 172 13.107 14.656 -11.520 1202 2HB GLU 172 1HB GLU 172 13.252 13.414 -10.294 1203 1HG GLU 172 2HG GLU 172 11.243 12.316 -11.246 1204 2HG GLU 172 1HG GLU 172 11.204 13.605 -12.452 1205 H GLU 173 H GLU 173 12.040 17.060 -10.494 1206 HA GLU 173 HA GLU 173 9.796 17.399 -12.318 1207 1HB GLU 173 2HB GLU 173 10.292 19.253 -9.975 1208 2HB GLU 173 1HB GLU 173 9.104 19.494 -11.245 1209 1HG GLU 173 2HG GLU 173 7.923 17.477 -10.501 1210 2HG GLU 173 1HG GLU 173 9.098 17.280 -9.198 Start of MODEL 7 1 H THR 17 H THR 17 -6.966 -32.883 0.294 2 HA THR 17 HA THR 17 -6.804 -30.583 -1.489 3 HB THR 17 HB THR 17 -9.076 -31.192 0.417 4 HG1 THR 17 1HG THR 17 -8.509 -32.048 -1.996 5 1HG2 THR 17 1HG2 THR 17 -10.176 -29.268 -0.675 6 2HG2 THR 17 2HG2 THR 17 -8.738 -29.006 -1.661 7 3HG2 THR 17 3HG2 THR 17 -8.667 -28.772 0.086 8 H GLU 18 H GLU 18 -5.130 -29.649 -0.646 9 HA GLU 18 HA GLU 18 -4.791 -29.485 2.235 10 1HB GLU 18 2HB GLU 18 -2.939 -28.815 -0.039 11 2HB GLU 18 1HB GLU 18 -2.530 -28.696 1.667 12 1HG GLU 18 2HG GLU 18 -2.847 -31.077 1.940 13 2HG GLU 18 1HG GLU 18 -3.343 -31.222 0.256 14 H ALA 19 H ALA 19 -3.530 -27.283 2.769 15 HA ALA 19 HA ALA 19 -3.782 -25.102 3.273 16 1HB ALA 19 1HB ALA 19 -5.024 -24.893 0.506 17 2HB ALA 19 2HB ALA 19 -3.309 -24.704 0.879 18 3HB ALA 19 3HB ALA 19 -4.477 -23.532 1.488 19 H SER 20 H SER 20 -5.638 -27.007 4.015 20 HA SER 20 HA SER 20 -8.324 -26.424 3.705 21 1HB SER 20 2HB SER 20 -6.913 -27.709 6.035 22 2HB SER 20 1HB SER 20 -8.627 -27.866 5.637 23 HG SER 20 HG SER 20 -8.058 -28.825 3.708 24 H SER 21 H SER 21 -5.924 -24.985 5.800 25 HA SER 21 HA SER 21 -7.842 -23.770 7.530 26 1HB SER 21 2HB SER 21 -5.566 -24.272 8.337 27 2HB SER 21 1HB SER 21 -4.890 -23.168 7.146 28 HG SER 21 HG SER 21 -6.710 -21.827 8.459 29 H LEU 22 H LEU 22 -6.767 -23.137 4.376 30 HA LEU 22 HA LEU 22 -6.828 -21.522 2.924 31 1HB LEU 22 2HB LEU 22 -9.173 -20.721 4.594 32 2HB LEU 22 1HB LEU 22 -8.832 -20.045 3.013 33 HG LEU 22 HG LEU 22 -9.365 -22.964 3.568 34 1HD1 LEU 22 1HD1 LEU 22 -11.442 -22.584 2.461 35 2HD1 LEU 22 2HD1 LEU 22 -11.084 -20.848 2.339 36 3HD1 LEU 22 3HD1 LEU 22 -11.266 -21.614 3.935 37 1HD2 LEU 22 1HD2 LEU 22 -9.531 -23.153 1.130 38 2HD2 LEU 22 2HD2 LEU 22 -7.919 -22.655 1.621 39 3HD2 LEU 22 3HD2 LEU 22 -9.047 -21.472 0.955 40 H VAL 23 H VAL 23 -5.376 -20.962 5.506 41 HA VAL 23 HA VAL 23 -5.275 -18.072 5.285 42 HB VAL 23 HB VAL 23 -3.861 -19.901 7.270 43 1HG1 VAL 23 1HG1 VAL 23 -2.537 -17.880 6.792 44 2HG1 VAL 23 2HG1 VAL 23 -3.208 -17.827 8.422 45 3HG1 VAL 23 3HG1 VAL 23 -3.944 -16.875 7.132 46 1HG2 VAL 23 1HG2 VAL 23 -6.136 -17.983 7.540 47 2HG2 VAL 23 2HG2 VAL 23 -5.388 -18.841 8.896 48 3HG2 VAL 23 3HG2 VAL 23 -6.256 -19.737 7.632 49 H GLY 24 H GLY 24 -4.020 -17.265 3.964 50 1HA GLY 24 2HA GLY 24 -1.659 -18.786 3.085 51 2HA GLY 24 1HA GLY 24 -2.648 -17.811 1.995 52 H LYS 25 H LYS 25 0.176 -17.668 2.803 53 HA LYS 25 HA LYS 25 0.152 -14.834 3.272 54 1HB LYS 25 2HB LYS 25 1.933 -15.082 5.017 55 2HB LYS 25 1HB LYS 25 0.297 -15.473 5.520 56 1HG LYS 25 2HG LYS 25 0.689 -17.751 5.431 57 2HG LYS 25 1HG LYS 25 2.251 -17.566 4.626 58 1HD LYS 25 2HD LYS 25 1.583 -16.639 7.432 59 2HD LYS 25 1HD LYS 25 2.485 -18.108 7.043 60 1HE LYS 25 2HE LYS 25 4.183 -16.745 5.914 61 2HE LYS 25 1HE LYS 25 3.313 -15.290 6.344 62 1HZ LYS 25 1HZ LYS 25 4.475 -17.203 8.295 63 2HZ LYS 25 2HZ LYS 25 3.658 -15.790 8.674 64 3HZ LYS 25 3HZ LYS 25 5.120 -15.710 7.858 65 H LEU 26 H LEU 26 2.078 -13.825 2.707 66 HA LEU 26 HA LEU 26 4.174 -15.452 1.613 67 1HB LEU 26 2HB LEU 26 2.339 -15.181 -0.160 68 2HB LEU 26 1HB LEU 26 2.666 -13.475 -0.135 69 HG LEU 26 HG LEU 26 4.659 -15.576 -0.974 70 1HD1 LEU 26 1HD1 LEU 26 4.185 -14.832 -3.248 71 2HD1 LEU 26 2HD1 LEU 26 2.904 -13.791 -2.626 72 3HD1 LEU 26 3HD1 LEU 26 2.768 -15.551 -2.467 73 1HD2 LEU 26 1HD2 LEU 26 5.694 -13.469 -0.240 74 2HD2 LEU 26 2HD2 LEU 26 4.678 -12.584 -1.374 75 3HD2 LEU 26 3HD2 LEU 26 5.885 -13.718 -1.981 76 H GLU 27 H GLU 27 6.078 -14.218 1.541 77 HA GLU 27 HA GLU 27 5.820 -11.443 2.392 78 1HB GLU 27 2HB GLU 27 6.227 -12.817 4.383 79 2HB GLU 27 1HB GLU 27 7.682 -13.467 3.645 80 1HG GLU 27 2HG GLU 27 8.726 -11.301 3.713 81 2HG GLU 27 1HG GLU 27 7.236 -10.571 4.317 82 H THR 28 H THR 28 7.000 -10.126 1.233 83 HA THR 28 HA THR 28 9.239 -11.226 -0.268 84 HB THR 28 HB THR 28 7.278 -11.122 -1.804 85 HG1 THR 28 1HG THR 28 8.335 -9.462 -3.296 86 1HG2 THR 28 1HG2 THR 28 6.064 -9.253 -0.751 87 2HG2 THR 28 2HG2 THR 28 6.332 -8.955 -2.468 88 3HG2 THR 28 3HG2 THR 28 7.329 -8.136 -1.273 89 H ASP 29 H ASP 29 10.523 -9.348 -1.226 90 HA ASP 29 HA ASP 29 10.411 -6.990 0.451 91 1HB ASP 29 2HB ASP 29 12.824 -7.014 0.856 92 2HB ASP 29 1HB ASP 29 12.123 -8.495 1.474 93 H VAL 30 H VAL 30 10.501 -5.270 -0.749 94 HA VAL 30 HA VAL 30 11.558 -5.561 -3.473 95 HB VAL 30 HB VAL 30 9.374 -3.673 -2.515 96 1HG1 VAL 30 1HG1 VAL 30 10.739 -2.630 -4.246 97 2HG1 VAL 30 2HG1 VAL 30 9.144 -3.040 -4.876 98 3HG1 VAL 30 3HG1 VAL 30 10.537 -4.044 -5.284 99 1HG2 VAL 30 1HG2 VAL 30 9.258 -6.033 -4.375 100 2HG2 VAL 30 2HG2 VAL 30 7.915 -4.946 -4.030 101 3HG2 VAL 30 3HG2 VAL 30 8.580 -5.971 -2.747 102 H GLU 31 H GLU 31 13.168 -4.274 -4.012 103 HA GLU 31 HA GLU 31 14.102 -2.420 -1.967 104 1HB GLU 31 2HB GLU 31 15.526 -2.965 -4.563 105 2HB GLU 31 1HB GLU 31 16.121 -2.394 -2.997 106 1HG GLU 31 2HG GLU 31 15.700 -4.580 -2.025 107 2HG GLU 31 1HG GLU 31 15.172 -5.176 -3.594 108 H ILE 32 H ILE 32 14.091 -0.258 -2.240 109 HA ILE 32 HA ILE 32 12.928 0.711 -4.742 110 HB ILE 32 HB ILE 32 12.034 2.627 -3.414 111 1HG1 ILE 32 2HG1 ILE 32 12.849 0.932 -1.030 112 2HG1 ILE 32 1HG1 ILE 32 13.562 2.469 -1.487 113 1HG2 ILE 32 1HG2 ILE 32 10.570 0.807 -4.057 114 2HG2 ILE 32 2HG2 ILE 32 10.135 1.385 -2.449 115 3HG2 ILE 32 3HG2 ILE 32 11.049 -0.110 -2.629 116 1HD1 ILE 32 1HD1 ILE 32 12.033 2.719 0.374 117 2HD1 ILE 32 2HD1 ILE 32 10.723 2.031 -0.587 118 3HD1 ILE 32 3HD1 ILE 32 11.429 3.583 -1.042 119 H LYS 33 H LYS 33 13.414 3.125 -5.065 120 HA LYS 33 HA LYS 33 16.293 3.429 -5.155 121 1HB LYS 33 2HB LYS 33 14.051 5.310 -5.858 122 2HB LYS 33 1HB LYS 33 15.740 5.556 -6.242 123 1HG LYS 33 2HG LYS 33 15.658 3.788 -7.856 124 2HG LYS 33 1HG LYS 33 14.008 3.362 -7.354 125 1HD LYS 33 2HD LYS 33 13.243 5.617 -7.963 126 2HD LYS 33 1HD LYS 33 14.869 6.020 -8.502 127 1HE LYS 33 2HE LYS 33 14.721 4.410 -10.269 128 2HE LYS 33 1HE LYS 33 13.174 3.817 -9.662 129 1HZ LYS 33 1HZ LYS 33 12.922 5.353 -11.540 130 2HZ LYS 33 2HZ LYS 33 13.606 6.622 -10.632 131 3HZ LYS 33 3HZ LYS 33 12.170 5.940 -10.165 132 H ALA 34 H ALA 34 13.451 4.684 -3.608 133 HA ALA 34 HA ALA 34 14.615 6.921 -2.358 134 1HB ALA 34 1HB ALA 34 12.063 5.508 -1.672 135 2HB ALA 34 2HB ALA 34 12.243 6.749 -2.909 136 3HB ALA 34 3HB ALA 34 12.519 7.148 -1.213 137 H SER 35 H SER 35 14.665 7.328 -0.110 138 HA SER 35 HA SER 35 15.821 5.093 1.353 139 1HB SER 35 2HB SER 35 16.026 8.070 1.816 140 2HB SER 35 1HB SER 35 16.979 6.813 2.610 141 HG SER 35 HG SER 35 18.195 6.627 0.912 142 H ALA 36 H ALA 36 15.157 4.692 3.460 143 HA ALA 36 HA ALA 36 12.470 4.862 4.125 144 1HB ALA 36 1HB ALA 36 14.044 3.196 5.022 145 2HB ALA 36 2HB ALA 36 13.110 3.984 6.297 146 3HB ALA 36 3HB ALA 36 14.784 4.452 6.009 147 H ASP 37 H ASP 37 15.094 6.997 4.957 148 HA ASP 37 HA ASP 37 13.786 8.492 6.924 149 1HB ASP 37 2HB ASP 37 15.446 10.309 6.442 150 2HB ASP 37 1HB ASP 37 16.173 8.743 6.730 151 H LYS 38 H LYS 38 13.565 8.644 3.468 152 HA LYS 38 HA LYS 38 12.163 11.145 3.444 153 1HB LYS 38 2HB LYS 38 12.403 9.039 1.326 154 2HB LYS 38 1HB LYS 38 11.692 10.641 1.111 155 1HG LYS 38 2HG LYS 38 13.847 11.635 1.794 156 2HG LYS 38 1HG LYS 38 14.527 10.015 1.852 157 1HD LYS 38 2HD LYS 38 15.086 11.068 -0.199 158 2HD LYS 38 1HD LYS 38 13.966 9.711 -0.466 159 1HE LYS 38 2HE LYS 38 13.415 11.679 -1.858 160 2HE LYS 38 1HE LYS 38 12.112 11.270 -0.751 161 1HZ LYS 38 1HZ LYS 38 14.114 13.440 -0.361 162 2HZ LYS 38 2HZ LYS 38 12.859 13.086 0.704 163 3HZ LYS 38 3HZ LYS 38 12.516 13.631 -0.847 164 H PHE 39 H PHE 39 11.319 7.768 3.576 165 HA PHE 39 HA PHE 39 8.542 7.966 3.071 166 1HB PHE 39 2HB PHE 39 9.843 5.818 3.106 167 2HB PHE 39 1HB PHE 39 10.026 5.992 4.842 168 HD1 PHE 39 1HD PHE 39 7.748 5.120 2.128 169 HD2 PHE 39 2HD PHE 39 8.146 5.565 6.337 170 HE1 PHE 39 1HE PHE 39 5.664 3.863 2.452 171 HE2 PHE 39 2HE PHE 39 6.053 4.304 6.670 172 HZ PHE 39 HZ PHE 39 4.813 3.455 4.726 173 H HIS 40 H HIS 40 10.461 7.988 5.988 174 HA HIS 40 HA HIS 40 8.449 8.419 7.913 175 1HB HIS 40 2HB HIS 40 10.819 7.701 8.339 176 2HB HIS 40 1HB HIS 40 11.344 9.326 7.946 177 HD1 HIS 40 1HD HIS 40 10.823 7.281 10.710 178 HD2 HIS 40 2HD HIS 40 9.873 11.240 9.919 179 HE1 HIS 40 1HE HIS 40 10.556 8.380 12.958 180 HE2 HIS 40 2HE HIS 40 9.759 10.684 12.452 181 H HIS 41 H HIS 41 10.505 10.595 6.072 182 HA HIS 41 HA HIS 41 9.740 13.026 7.234 183 1HB HIS 41 2HB HIS 41 11.798 12.845 6.008 184 2HB HIS 41 1HB HIS 41 10.940 12.396 4.548 185 HD1 HIS 41 1HD HIS 41 11.623 15.392 6.738 186 HD2 HIS 41 2HD HIS 41 10.114 14.466 2.992 187 HE1 HIS 41 1HE HIS 41 11.392 17.591 5.549 188 HE2 HIS 41 2HE HIS 41 10.422 17.042 3.310 189 H MET 42 H MET 42 8.474 11.380 4.335 190 HA MET 42 HA MET 42 6.882 13.589 3.565 191 1HB MET 42 2HB MET 42 5.843 12.159 1.958 192 2HB MET 42 1HB MET 42 7.562 11.805 1.978 193 1HG MET 42 2HG MET 42 7.141 9.799 3.274 194 2HG MET 42 1HG MET 42 5.423 10.181 3.330 195 1HE MET 42 1HE MET 42 6.399 7.383 2.440 196 2HE MET 42 2HE MET 42 5.445 7.107 0.986 197 3HE MET 42 3HE MET 42 4.701 7.863 2.393 198 H PHE 43 H PHE 43 6.308 10.891 5.705 199 HA PHE 43 HA PHE 43 3.481 11.224 5.808 200 1HB PHE 43 2HB PHE 43 4.626 9.089 6.406 201 2HB PHE 43 1HB PHE 43 5.315 9.876 7.818 202 HD1 PHE 43 1HD PHE 43 2.206 8.656 6.273 203 HD2 PHE 43 2HD PHE 43 4.012 10.175 9.816 204 HE1 PHE 43 1HE PHE 43 0.214 8.011 7.560 205 HE2 PHE 43 2HE PHE 43 2.021 9.526 11.110 206 HZ PHE 43 HZ PHE 43 0.121 8.446 9.984 207 H ALA 44 H ALA 44 6.143 12.785 7.287 208 HA ALA 44 HA ALA 44 4.571 13.930 9.446 209 1HB ALA 44 1HB ALA 44 6.887 13.227 9.873 210 2HB ALA 44 2HB ALA 44 6.679 14.955 10.148 211 3HB ALA 44 3HB ALA 44 7.456 14.385 8.672 212 H GLY 45 H GLY 45 4.438 14.528 6.351 213 1HA GLY 45 2HA GLY 45 3.741 17.284 6.674 214 2HA GLY 45 1HA GLY 45 5.194 17.049 5.707 215 H LYS 46 H LYS 46 4.159 17.868 3.891 216 HA LYS 46 HA LYS 46 2.251 15.994 2.651 217 1HB LYS 46 2HB LYS 46 1.368 17.909 1.356 218 2HB LYS 46 1HB LYS 46 1.149 18.145 3.080 219 1HG LYS 46 2HG LYS 46 3.032 19.660 3.161 220 2HG LYS 46 1HG LYS 46 3.386 19.358 1.468 221 1HD LYS 46 2HD LYS 46 0.734 20.492 2.340 222 2HD LYS 46 1HD LYS 46 2.131 21.534 2.106 223 1HE LYS 46 2HE LYS 46 0.710 21.549 0.123 224 2HE LYS 46 1HE LYS 46 2.258 20.816 -0.254 225 1HZ LYS 46 1HZ LYS 46 1.206 18.654 -0.236 226 2HZ LYS 46 2HZ LYS 46 0.386 19.717 -1.251 227 3HZ LYS 46 3HZ LYS 46 -0.293 19.359 0.229 228 HA PRO 47 HA PRO 47 5.331 15.928 -0.602 229 1HB PRO 47 2HB PRO 47 3.785 15.317 -2.747 230 2HB PRO 47 1HB PRO 47 4.197 14.100 -1.536 231 1HG PRO 47 2HG PRO 47 1.672 15.655 -1.877 232 2HG PRO 47 1HG PRO 47 1.890 13.956 -1.426 233 1HD PRO 47 2HD PRO 47 1.347 15.932 0.375 234 2HD PRO 47 1HD PRO 47 2.243 14.459 0.782 235 H HIS 48 H HIS 48 6.089 17.463 -2.053 236 HA HIS 48 HA HIS 48 4.714 19.939 -2.188 237 1HB HIS 48 2HB HIS 48 7.160 19.847 -2.368 238 2HB HIS 48 1HB HIS 48 7.036 18.950 -3.875 239 HD1 HIS 48 1HD HIS 48 6.912 20.320 -5.988 240 HD2 HIS 48 2HD HIS 48 6.172 22.589 -2.585 241 HE1 HIS 48 1HE HIS 48 6.779 22.687 -6.778 242 HE2 HIS 48 2HE HIS 48 6.619 24.042 -4.638 243 H HIS 49 H HIS 49 5.346 17.416 -4.555 244 HA HIS 49 HA HIS 49 4.299 16.678 -6.359 245 1HB HIS 49 2HB HIS 49 2.399 16.359 -4.848 246 2HB HIS 49 1HB HIS 49 1.899 18.019 -5.098 247 HD1 HIS 49 1HD HIS 49 -0.189 17.976 -6.391 248 HD2 HIS 49 2HD HIS 49 2.476 15.085 -7.730 249 HE1 HIS 49 1HE HIS 49 -1.337 16.837 -8.305 250 HE2 HIS 49 2HE HIS 49 0.131 14.868 -8.779 251 H VAL 50 H VAL 50 2.485 19.739 -6.170 252 HA VAL 50 HA VAL 50 3.950 20.784 -8.419 253 HB VAL 50 HB VAL 50 1.873 21.369 -9.679 254 1HG1 VAL 50 1HG1 VAL 50 2.310 18.401 -9.341 255 2HG1 VAL 50 2HG1 VAL 50 3.175 19.471 -10.444 256 3HG1 VAL 50 3HG1 VAL 50 1.454 19.161 -10.687 257 1HG2 VAL 50 1HG2 VAL 50 0.249 21.180 -7.871 258 2HG2 VAL 50 2HG2 VAL 50 0.519 19.442 -7.796 259 3HG2 VAL 50 3HG2 VAL 50 -0.220 20.152 -9.230 260 H SER 51 H SER 51 3.854 22.994 -8.544 261 HA SER 51 HA SER 51 2.596 24.311 -6.281 262 1HB SER 51 2HB SER 51 5.060 24.603 -6.541 263 2HB SER 51 1HB SER 51 4.789 25.240 -8.162 264 HG SER 51 HG SER 51 3.828 26.401 -5.746 265 H LYS 52 H LYS 52 0.734 25.274 -6.772 266 HA LYS 52 HA LYS 52 0.289 26.069 -9.572 267 1HB LYS 52 2HB LYS 52 -1.653 24.978 -7.595 268 2HB LYS 52 1HB LYS 52 -2.087 25.554 -9.195 269 1HG LYS 52 2HG LYS 52 -0.695 23.771 -10.182 270 2HG LYS 52 1HG LYS 52 -0.326 23.192 -8.554 271 1HD LYS 52 2HD LYS 52 -3.078 23.382 -9.774 272 2HD LYS 52 1HD LYS 52 -2.144 21.899 -9.584 273 1HE LYS 52 2HE LYS 52 -2.177 22.161 -7.171 274 2HE LYS 52 1HE LYS 52 -3.017 23.698 -7.338 275 1HZ LYS 52 1HZ LYS 52 -4.898 22.615 -8.229 276 2HZ LYS 52 2HZ LYS 52 -4.522 21.842 -6.787 277 3HZ LYS 52 3HZ LYS 52 -4.143 21.115 -8.265 278 H ALA 53 H ALA 53 -1.682 27.558 -9.637 279 HA ALA 53 HA ALA 53 -1.248 29.668 -7.687 280 1HB ALA 53 1HB ALA 53 -2.820 29.732 -10.272 281 2HB ALA 53 2HB ALA 53 -1.166 30.310 -10.067 282 3HB ALA 53 3HB ALA 53 -2.493 31.114 -9.229 283 H SER 54 H SER 54 -2.296 28.914 -5.944 284 HA SER 54 HA SER 54 -5.197 28.707 -6.166 285 1HB SER 54 2HB SER 54 -4.138 26.426 -5.990 286 2HB SER 54 1HB SER 54 -3.401 26.932 -4.476 287 HG SER 54 HG SER 54 -6.028 27.392 -4.288 288 HA PRO 55 HA PRO 55 -4.286 32.042 -3.188 289 1HB PRO 55 2HB PRO 55 -7.235 32.264 -3.319 290 2HB PRO 55 1HB PRO 55 -6.010 33.516 -3.565 291 1HG PRO 55 2HG PRO 55 -7.369 32.534 -5.629 292 2HG PRO 55 1HG PRO 55 -5.640 32.894 -5.775 293 1HD PRO 55 2HD PRO 55 -6.994 30.253 -5.395 294 2HD PRO 55 1HD PRO 55 -5.631 30.690 -6.453 295 H GLY 56 H GLY 56 -6.871 29.649 -2.939 296 1HA GLY 56 2HA GLY 56 -6.771 29.868 -0.034 297 2HA GLY 56 1HA GLY 56 -8.010 29.028 -0.969 298 H ASN 57 H ASN 57 -7.888 27.036 -0.157 299 HA ASN 57 HA ASN 57 -7.169 24.896 0.226 300 1HB ASN 57 2HB ASN 57 -6.555 25.060 -2.215 301 2HB ASN 57 1HB ASN 57 -4.960 25.619 -1.745 302 1HD2 ASN 57 1HD2 ASN 57 -3.893 23.939 -2.705 303 2HD2 ASN 57 2HD2 ASN 57 -3.958 22.311 -2.140 304 H ILE 58 H ILE 58 -6.261 27.087 1.862 305 HA ILE 58 HA ILE 58 -3.509 26.771 2.460 306 HB ILE 58 HB ILE 58 -5.677 28.131 4.072 307 1HG1 ILE 58 2HG1 ILE 58 -5.402 29.103 1.830 308 2HG1 ILE 58 1HG1 ILE 58 -4.873 30.229 3.078 309 1HG2 ILE 58 1HG2 ILE 58 -3.829 29.317 5.198 310 2HG2 ILE 58 2HG2 ILE 58 -2.669 28.353 4.285 311 3HG2 ILE 58 3HG2 ILE 58 -3.739 27.575 5.446 312 1HD1 ILE 58 1HD1 ILE 58 -2.542 29.603 2.580 313 2HD1 ILE 58 2HD1 ILE 58 -3.385 30.275 1.181 314 3HD1 ILE 58 3HD1 ILE 58 -3.121 28.536 1.302 315 H GLN 59 H GLN 59 -2.791 25.031 3.339 316 HA GLN 59 HA GLN 59 -2.276 23.458 4.886 317 1HB GLN 59 2HB GLN 59 -2.696 25.066 6.627 318 2HB GLN 59 1HB GLN 59 -4.428 24.818 6.503 319 1HG GLN 59 2HG GLN 59 -4.161 22.545 7.345 320 2HG GLN 59 1HG GLN 59 -2.422 22.801 7.483 321 1HE2 GLN 59 1HE2 GLN 59 -2.481 22.441 9.660 322 2HE2 GLN 59 2HE2 GLN 59 -3.106 23.562 10.804 323 H GLY 60 H GLY 60 -5.786 23.742 4.960 324 1HA GLY 60 2HA GLY 60 -6.929 21.820 3.724 325 2HA GLY 60 1HA GLY 60 -5.950 20.802 4.784 326 H CYS 61 H CYS 61 -8.807 22.549 4.468 327 HA CYS 61 HA CYS 61 -9.317 23.054 7.231 328 1HB CYS 61 2HB CYS 61 -11.255 22.909 4.920 329 2HB CYS 61 1HB CYS 61 -11.527 23.695 6.475 330 HG CYS 61 HG CYS 61 -9.275 25.488 5.970 331 H ASP 62 H ASP 62 -9.548 20.308 5.235 332 HA ASP 62 HA ASP 62 -11.614 18.983 6.782 333 1HB ASP 62 2HB ASP 62 -11.310 17.147 5.163 334 2HB ASP 62 1HB ASP 62 -11.660 18.685 4.381 335 H LEU 63 H LEU 63 -8.397 19.462 7.309 336 HA LEU 63 HA LEU 63 -8.226 16.851 8.596 337 1HB LEU 63 2HB LEU 63 -5.745 16.991 8.470 338 2HB LEU 63 1HB LEU 63 -6.529 16.893 6.918 339 HG LEU 63 HG LEU 63 -6.157 19.405 6.715 340 1HD1 LEU 63 1HD1 LEU 63 -5.745 19.952 9.037 341 2HD1 LEU 63 2HD1 LEU 63 -4.360 20.390 8.034 342 3HD1 LEU 63 3HD1 LEU 63 -4.300 18.941 9.037 343 1HD2 LEU 63 1HD2 LEU 63 -3.753 17.606 6.885 344 2HD2 LEU 63 2HD2 LEU 63 -3.838 19.141 6.025 345 3HD2 LEU 63 3HD2 LEU 63 -4.830 17.782 5.502 346 H HIS 64 H HIS 64 -7.509 16.664 10.673 347 HA HIS 64 HA HIS 64 -6.987 19.147 12.158 348 1HB HIS 64 2HB HIS 64 -9.432 18.780 12.227 349 2HB HIS 64 1HB HIS 64 -9.164 17.178 12.897 350 HD1 HIS 64 1HD HIS 64 -8.672 17.032 15.459 351 HD2 HIS 64 2HD HIS 64 -9.012 20.917 13.999 352 HE1 HIS 64 1HE HIS 64 -8.813 18.495 17.458 353 HE2 HIS 64 2HE HIS 64 -9.506 20.679 16.499 354 H GLU 65 H GLU 65 -6.976 15.684 11.889 355 HA GLU 65 HA GLU 65 -5.749 14.076 12.668 356 1HB GLU 65 2HB GLU 65 -3.718 15.485 12.828 357 2HB GLU 65 1HB GLU 65 -4.245 16.070 14.402 358 1HG GLU 65 2HG GLU 65 -4.004 13.872 15.358 359 2HG GLU 65 1HG GLU 65 -3.641 13.186 13.780 360 H GLY 66 H GLY 66 -6.520 12.606 13.842 361 1HA GLY 66 2HA GLY 66 -7.593 11.642 15.640 362 2HA GLY 66 1HA GLY 66 -7.777 13.239 16.384 363 H ASP 67 H ASP 67 -8.463 13.314 13.146 364 HA ASP 67 HA ASP 67 -11.329 13.453 13.704 365 1HB ASP 67 2HB ASP 67 -11.536 14.764 11.628 366 2HB ASP 67 1HB ASP 67 -10.345 15.478 12.699 367 H TRP 68 H TRP 68 -9.051 12.039 11.397 368 HA TRP 68 HA TRP 68 -11.208 10.282 10.521 369 1HB TRP 68 2HB TRP 68 -10.012 11.755 8.831 370 2HB TRP 68 1HB TRP 68 -8.569 10.805 9.122 371 HD1 TRP 68 HD TRP 68 -8.222 9.319 7.086 372 HE1 TRP 68 1HE TRP 68 -9.688 7.853 5.567 373 HE3 TRP 68 3HE TRP 68 -12.793 10.320 9.165 374 HZ2 TRP 68 2HZ TRP 68 -12.417 7.196 5.295 375 HZ3 TRP 68 3HZ TRP 68 -14.775 9.227 8.216 376 HH2 TRP 68 HH TRP 68 -14.592 7.697 6.320 377 H GLY 69 H GLY 69 -8.584 10.440 12.478 378 1HA GLY 69 2HA GLY 69 -8.202 8.899 14.177 379 2HA GLY 69 1HA GLY 69 -8.976 7.674 13.217 380 H THR 70 H THR 70 -6.854 8.664 11.036 381 HA THR 70 HA THR 70 -4.955 7.803 10.208 382 HB THR 70 HB THR 70 -3.974 7.825 13.093 383 HG1 THR 70 1HG THR 70 -3.591 9.769 11.055 384 1HG2 THR 70 1HG2 THR 70 -1.741 8.045 12.076 385 2HG2 THR 70 2HG2 THR 70 -2.462 7.916 10.470 386 3HG2 THR 70 3HG2 THR 70 -2.524 6.541 11.576 387 H VAL 71 H VAL 71 -4.849 5.860 13.262 388 HA VAL 71 HA VAL 71 -4.729 3.467 11.684 389 HB VAL 71 HB VAL 71 -5.271 3.793 14.662 390 1HG1 VAL 71 1HG1 VAL 71 -4.597 1.317 13.069 391 2HG1 VAL 71 2HG1 VAL 71 -6.165 1.694 13.771 392 3HG1 VAL 71 3HG1 VAL 71 -4.777 1.390 14.828 393 1HG2 VAL 71 1HG2 VAL 71 -2.949 3.074 14.959 394 2HG2 VAL 71 2HG2 VAL 71 -3.055 4.549 13.997 395 3HG2 VAL 71 3HG2 VAL 71 -2.756 2.998 13.208 396 H GLY 72 H GLY 72 -6.437 2.466 10.807 397 1HA GLY 72 2HA GLY 72 -8.666 1.744 10.763 398 2HA GLY 72 1HA GLY 72 -9.066 2.986 11.948 399 H SER 73 H SER 73 -7.085 4.493 9.903 400 HA SER 73 HA SER 73 -9.038 6.082 8.670 401 1HB SER 73 2HB SER 73 -6.762 6.868 9.135 402 2HB SER 73 1HB SER 73 -6.109 5.685 8.018 403 HG SER 73 HG SER 73 -6.847 8.112 7.548 404 H ILE 74 H ILE 74 -9.821 6.044 6.661 405 HA ILE 74 HA ILE 74 -9.143 3.718 5.056 406 HB ILE 74 HB ILE 74 -11.797 5.106 5.401 407 1HG1 ILE 74 2HG1 ILE 74 -10.918 2.259 5.745 408 2HG1 ILE 74 1HG1 ILE 74 -11.067 3.402 7.065 409 1HG2 ILE 74 1HG2 ILE 74 -12.684 3.577 3.703 410 2HG2 ILE 74 2HG2 ILE 74 -11.054 2.975 3.393 411 3HG2 ILE 74 3HG2 ILE 74 -11.462 4.649 3.016 412 1HD1 ILE 74 1HD1 ILE 74 -13.243 2.397 5.258 413 2HD1 ILE 74 2HD1 ILE 74 -13.475 3.566 6.567 414 3HD1 ILE 74 3HD1 ILE 74 -12.977 1.906 6.931 415 H VAL 75 H VAL 75 -8.071 4.198 3.340 416 HA VAL 75 HA VAL 75 -8.649 6.614 1.821 417 HB VAL 75 HB VAL 75 -6.217 6.928 1.362 418 1HG1 VAL 75 1HG1 VAL 75 -6.864 7.029 4.303 419 2HG1 VAL 75 2HG1 VAL 75 -7.184 8.289 3.111 420 3HG1 VAL 75 3HG1 VAL 75 -5.523 7.868 3.525 421 1HG2 VAL 75 1HG2 VAL 75 -5.440 4.648 1.773 422 2HG2 VAL 75 2HG2 VAL 75 -5.780 4.826 3.494 423 3HG2 VAL 75 3HG2 VAL 75 -4.517 5.798 2.740 424 H PHE 76 H PHE 76 -8.288 6.328 -0.405 425 HA PHE 76 HA PHE 76 -7.937 3.510 -1.153 426 1HB PHE 76 2HB PHE 76 -9.954 5.457 -2.277 427 2HB PHE 76 1HB PHE 76 -9.640 3.848 -2.907 428 HD1 PHE 76 1HD PHE 76 -9.408 2.327 -0.428 429 HD2 PHE 76 2HD PHE 76 -12.138 5.374 -1.517 430 HE1 PHE 76 1HE PHE 76 -11.016 1.362 1.085 431 HE2 PHE 76 2HE PHE 76 -13.818 4.424 0.025 432 HZ PHE 76 HZ PHE 76 -13.267 2.404 1.332 433 H TRP 77 H TRP 77 -7.053 3.110 -3.129 434 HA TRP 77 HA TRP 77 -5.660 5.403 -4.326 435 1HB TRP 77 2HB TRP 77 -4.993 2.457 -4.546 436 2HB TRP 77 1HB TRP 77 -4.148 3.741 -5.386 437 HD1 TRP 77 HD TRP 77 -3.408 5.748 -3.319 438 HE1 TRP 77 1HE TRP 77 -1.901 5.202 -1.302 439 HE3 TRP 77 3HE TRP 77 -4.117 0.705 -3.171 440 HZ2 TRP 77 2HZ TRP 77 -1.121 2.899 0.154 441 HZ3 TRP 77 3HZ TRP 77 -2.952 -0.604 -1.445 442 HH2 TRP 77 HH TRP 77 -1.489 0.471 0.179 443 H ASN 78 H ASN 78 -5.986 5.942 -6.373 444 HA ASN 78 HA ASN 78 -7.699 4.198 -8.015 445 1HB ASN 78 2HB ASN 78 -8.826 6.328 -7.449 446 2HB ASN 78 1HB ASN 78 -7.448 7.224 -8.076 447 1HD2 ASN 78 1HD2 ASN 78 -10.315 5.434 -8.897 448 2HD2 ASN 78 2HD2 ASN 78 -10.282 5.810 -10.580 449 H TYR 79 H TYR 79 -6.831 3.573 -9.930 450 HA TYR 79 HA TYR 79 -4.638 5.026 -11.085 451 1HB TYR 79 2HB TYR 79 -3.085 3.129 -11.055 452 2HB TYR 79 1HB TYR 79 -3.501 3.603 -9.416 453 HD1 TYR 79 1HD TYR 79 -3.409 0.937 -11.807 454 HD2 TYR 79 2HD TYR 79 -5.200 2.138 -8.140 455 HE1 TYR 79 1HE TYR 79 -3.981 -1.395 -11.326 456 HE2 TYR 79 2HE TYR 79 -5.786 -0.209 -7.662 457 HH TYR 79 HH TYR 79 -4.430 -2.761 -9.480 458 H VAL 80 H VAL 80 -3.939 3.783 -13.135 459 HA VAL 80 HA VAL 80 -6.354 2.625 -14.314 460 HB VAL 80 HB VAL 80 -4.108 4.131 -15.704 461 1HG1 VAL 80 1HG1 VAL 80 -5.526 4.007 -17.719 462 2HG1 VAL 80 2HG1 VAL 80 -6.690 3.026 -16.839 463 3HG1 VAL 80 3HG1 VAL 80 -5.073 2.406 -17.155 464 1HG2 VAL 80 1HG2 VAL 80 -5.803 5.873 -16.109 465 2HG2 VAL 80 2HG2 VAL 80 -5.512 5.609 -14.386 466 3HG2 VAL 80 3HG2 VAL 80 -6.954 4.941 -15.140 467 H HIS 81 H HIS 81 -6.204 0.616 -15.001 468 HA HIS 81 HA HIS 81 -3.563 -0.484 -15.554 469 1HB HIS 81 2HB HIS 81 -4.058 -1.019 -13.234 470 2HB HIS 81 1HB HIS 81 -5.597 -1.731 -13.695 471 HD1 HIS 81 1HD HIS 81 -1.887 -2.368 -13.794 472 HD2 HIS 81 2HD HIS 81 -5.435 -4.386 -14.511 473 HE1 HIS 81 1HE HIS 81 -1.248 -4.771 -14.027 474 HE2 HIS 81 2HE HIS 81 -3.327 -5.789 -14.944 475 H ASP 82 H ASP 82 -3.633 -1.214 -17.509 476 HA ASP 82 HA ASP 82 -4.223 -2.099 -19.495 477 1HB ASP 82 2HB ASP 82 -6.258 -3.623 -17.844 478 2HB ASP 82 1HB ASP 82 -6.015 -3.898 -19.563 479 H GLY 83 H GLY 83 -5.338 0.331 -18.584 480 1HA GLY 83 2HA GLY 83 -6.564 1.900 -19.823 481 2HA GLY 83 1HA GLY 83 -7.406 0.587 -20.624 482 H GLU 84 H GLU 84 -7.734 -0.381 -17.605 483 HA GLU 84 HA GLU 84 -10.291 0.992 -17.313 484 1HB GLU 84 2HB GLU 84 -9.158 -1.439 -15.964 485 2HB GLU 84 1HB GLU 84 -10.582 -0.626 -15.364 486 1HG GLU 84 2HG GLU 84 -11.200 -2.523 -16.603 487 2HG GLU 84 1HG GLU 84 -11.711 -1.093 -17.473 488 H ALA 85 H ALA 85 -10.876 2.108 -15.583 489 HA ALA 85 HA ALA 85 -8.792 3.154 -13.875 490 1HB ALA 85 1HB ALA 85 -11.777 3.614 -13.874 491 2HB ALA 85 2HB ALA 85 -10.592 4.645 -14.666 492 3HB ALA 85 3HB ALA 85 -10.608 4.508 -12.906 493 H LYS 86 H LYS 86 -8.226 2.073 -12.110 494 HA LYS 86 HA LYS 86 -10.193 0.219 -11.023 495 1HB LYS 86 2HB LYS 86 -7.213 -0.161 -11.067 496 2HB LYS 86 1HB LYS 86 -8.426 -1.309 -10.502 497 1HG LYS 86 2HG LYS 86 -9.420 -1.089 -12.865 498 2HG LYS 86 1HG LYS 86 -7.873 -0.388 -13.290 499 1HD LYS 86 2HD LYS 86 -7.722 -2.657 -13.877 500 2HD LYS 86 1HD LYS 86 -6.845 -2.513 -12.352 501 1HE LYS 86 2HE LYS 86 -9.729 -3.241 -12.409 502 2HE LYS 86 1HE LYS 86 -8.522 -4.465 -12.693 503 1HZ LYS 86 1HZ LYS 86 -8.774 -2.829 -10.185 504 2HZ LYS 86 2HZ LYS 86 -7.612 -4.013 -10.484 505 3HZ LYS 86 3HZ LYS 86 -9.226 -4.432 -10.405 506 H VAL 87 H VAL 87 -10.473 0.249 -8.867 507 HA VAL 87 HA VAL 87 -8.989 2.278 -7.350 508 HB VAL 87 HB VAL 87 -11.857 1.345 -6.952 509 1HG1 VAL 87 1HG1 VAL 87 -10.327 3.534 -5.538 510 2HG1 VAL 87 2HG1 VAL 87 -10.826 1.993 -4.844 511 3HG1 VAL 87 3HG1 VAL 87 -12.041 3.177 -5.322 512 1HG2 VAL 87 1HG2 VAL 87 -10.819 3.968 -8.011 513 2HG2 VAL 87 2HG2 VAL 87 -12.511 3.590 -7.685 514 3HG2 VAL 87 3HG2 VAL 87 -11.641 2.726 -8.953 515 H ALA 88 H ALA 88 -8.245 1.693 -5.382 516 HA ALA 88 HA ALA 88 -8.409 -1.148 -4.701 517 1HB ALA 88 1HB ALA 88 -6.136 -0.307 -5.142 518 2HB ALA 88 2HB ALA 88 -6.328 -0.689 -3.430 519 3HB ALA 88 3HB ALA 88 -6.382 0.987 -3.975 520 H LYS 89 H LYS 89 -9.127 -1.652 -2.637 521 HA LYS 89 HA LYS 89 -10.031 0.623 -1.086 522 1HB LYS 89 2HB LYS 89 -11.650 -1.859 -1.683 523 2HB LYS 89 1HB LYS 89 -12.119 -0.599 -0.552 524 1HG LYS 89 2HG LYS 89 -12.172 1.037 -2.345 525 2HG LYS 89 1HG LYS 89 -11.645 -0.190 -3.495 526 1HD LYS 89 2HD LYS 89 -13.716 -1.435 -3.092 527 2HD LYS 89 1HD LYS 89 -14.228 -0.202 -1.934 528 1HE LYS 89 2HE LYS 89 -14.161 1.487 -3.689 529 2HE LYS 89 1HE LYS 89 -13.645 0.275 -4.855 530 1HZ LYS 89 1HZ LYS 89 -16.233 0.277 -3.406 531 2HZ LYS 89 2HZ LYS 89 -15.755 -0.858 -4.559 532 3HZ LYS 89 3HZ LYS 89 -16.006 0.763 -4.986 533 H GLU 90 H GLU 90 -9.319 0.613 0.898 534 HA GLU 90 HA GLU 90 -8.871 -1.776 2.323 535 1HB GLU 90 2HB GLU 90 -6.465 -1.187 2.803 536 2HB GLU 90 1HB GLU 90 -6.793 -1.837 1.209 537 1HG GLU 90 2HG GLU 90 -6.646 1.099 1.688 538 2HG GLU 90 1HG GLU 90 -5.153 0.167 1.414 539 H ARG 91 H ARG 91 -7.860 -1.260 4.400 540 HA ARG 91 HA ARG 91 -8.734 1.301 5.494 541 1HB ARG 91 2HB ARG 91 -10.393 -0.376 6.061 542 2HB ARG 91 1HB ARG 91 -9.149 -1.482 6.612 543 1HG ARG 91 2HG ARG 91 -8.604 0.158 8.415 544 2HG ARG 91 1HG ARG 91 -10.012 1.094 7.905 545 1HD ARG 91 2HD ARG 91 -11.473 -0.766 8.384 546 2HD ARG 91 1HD ARG 91 -10.095 -1.800 8.757 547 HE ARG 91 HE ARG 91 -11.179 0.366 10.371 548 1HH1 ARG 91 1HH1 ARG 91 -8.743 -2.173 9.976 549 2HH1 ARG 91 2HH1 ARG 91 -8.280 -2.257 11.597 550 1HH2 ARG 91 1HH2 ARG 91 -10.585 0.248 12.682 551 2HH2 ARG 91 2HH2 ARG 91 -9.399 -0.851 13.195 552 H ILE 92 H ILE 92 -7.167 2.066 7.029 553 HA ILE 92 HA ILE 92 -4.604 0.731 7.152 554 HB ILE 92 HB ILE 92 -5.661 3.080 8.756 555 1HG1 ILE 92 2HG1 ILE 92 -5.590 3.630 6.383 556 2HG1 ILE 92 1HG1 ILE 92 -4.306 4.485 7.227 557 1HG2 ILE 92 1HG2 ILE 92 -3.320 3.584 9.293 558 2HG2 ILE 92 2HG2 ILE 92 -2.822 2.092 8.488 559 3HG2 ILE 92 3HG2 ILE 92 -3.831 2.030 9.935 560 1HD1 ILE 92 1HD1 ILE 92 -2.711 2.802 6.440 561 2HD1 ILE 92 2HD1 ILE 92 -3.509 3.649 5.111 562 3HD1 ILE 92 3HD1 ILE 92 -3.997 2.007 5.541 563 H GLU 93 H GLU 93 -4.066 -0.833 8.471 564 HA GLU 93 HA GLU 93 -5.868 -1.415 10.710 565 1HB GLU 93 2HB GLU 93 -5.335 -3.206 9.075 566 2HB GLU 93 1HB GLU 93 -3.649 -3.116 9.563 567 1HG GLU 93 2HG GLU 93 -4.694 -4.975 10.648 568 2HG GLU 93 1HG GLU 93 -4.321 -3.746 11.858 569 H ALA 94 H ALA 94 -2.475 -0.761 9.980 570 HA ALA 94 HA ALA 94 -2.029 0.180 12.664 571 1HB ALA 94 1HB ALA 94 -0.076 -1.290 13.035 572 2HB ALA 94 2HB ALA 94 -0.468 -2.170 11.560 573 3HB ALA 94 3HB ALA 94 -1.572 -2.216 12.936 574 H VAL 95 H VAL 95 -0.365 1.707 12.655 575 HA VAL 95 HA VAL 95 1.342 1.842 10.360 576 HB VAL 95 HB VAL 95 -0.573 3.111 9.527 577 1HG1 VAL 95 1HG1 VAL 95 -0.268 4.864 11.950 578 2HG1 VAL 95 2HG1 VAL 95 -1.614 3.781 11.586 579 3HG1 VAL 95 3HG1 VAL 95 -1.313 5.186 10.564 580 1HG2 VAL 95 1HG2 VAL 95 1.635 3.887 8.834 581 2HG2 VAL 95 2HG2 VAL 95 1.731 4.928 10.249 582 3HG2 VAL 95 3HG2 VAL 95 0.534 5.254 8.999 583 H GLU 96 H GLU 96 3.260 2.357 10.908 584 HA GLU 96 HA GLU 96 3.740 3.692 13.487 585 1HB GLU 96 2HB GLU 96 5.435 1.727 11.970 586 2HB GLU 96 1HB GLU 96 5.959 2.549 13.408 587 1HG GLU 96 2HG GLU 96 3.651 0.637 13.229 588 2HG GLU 96 1HG GLU 96 5.254 0.314 13.909 589 HA PRO 97 HA PRO 97 5.345 6.747 10.526 590 1HB PRO 97 2HB PRO 97 5.591 8.372 12.976 591 2HB PRO 97 1HB PRO 97 4.712 8.726 11.487 592 1HG PRO 97 2HG PRO 97 3.423 8.117 13.755 593 2HG PRO 97 1HG PRO 97 2.819 7.592 12.174 594 1HD PRO 97 2HD PRO 97 4.320 6.037 14.242 595 2HD PRO 97 1HD PRO 97 2.930 5.550 13.244 596 H ASP 98 H ASP 98 6.622 5.928 13.736 597 HA ASP 98 HA ASP 98 9.203 6.930 13.048 598 1HB ASP 98 2HB ASP 98 8.240 5.524 15.532 599 2HB ASP 98 1HB ASP 98 9.912 5.992 15.278 600 H LYS 99 H LYS 99 7.680 3.809 13.190 601 HA LYS 99 HA LYS 99 10.260 2.572 12.631 602 1HB LYS 99 2HB LYS 99 7.601 1.230 13.051 603 2HB LYS 99 1HB LYS 99 9.140 0.414 12.838 604 1HG LYS 99 2HG LYS 99 9.928 1.728 14.862 605 2HG LYS 99 1HG LYS 99 8.225 2.087 15.124 606 1HD LYS 99 2HD LYS 99 9.395 -0.623 14.822 607 2HD LYS 99 1HD LYS 99 9.011 0.100 16.390 608 1HE LYS 99 2HE LYS 99 6.618 0.210 15.669 609 2HE LYS 99 1HE LYS 99 7.076 -0.580 14.158 610 1HZ LYS 99 1HZ LYS 99 7.364 -1.763 16.863 611 2HZ LYS 99 2HZ LYS 99 7.791 -2.503 15.436 612 3HZ LYS 99 3HZ LYS 99 6.170 -2.173 15.746 613 H ASN 100 H ASN 100 8.050 4.052 10.785 614 HA ASN 100 HA ASN 100 7.549 4.110 8.566 615 1HB ASN 100 2HB ASN 100 10.050 2.406 8.300 616 2HB ASN 100 1HB ASN 100 9.230 3.206 6.972 617 1HD2 ASN 100 1HD2 ASN 100 11.932 3.481 7.906 618 2HD2 ASN 100 2HD2 ASN 100 12.163 5.151 8.291 619 H LEU 101 H LEU 101 6.085 2.300 9.929 620 HA LEU 101 HA LEU 101 5.853 0.007 8.090 621 1HB LEU 101 2HB LEU 101 6.574 -0.912 10.184 622 2HB LEU 101 1HB LEU 101 5.456 0.056 11.098 623 HG LEU 101 HG LEU 101 4.469 -2.146 9.242 624 1HD1 LEU 101 1HD1 LEU 101 5.099 -2.315 12.169 625 2HD1 LEU 101 2HD1 LEU 101 6.009 -3.140 10.873 626 3HD1 LEU 101 3HD1 LEU 101 4.291 -3.519 11.161 627 1HD2 LEU 101 1HD2 LEU 101 2.521 -2.142 10.704 628 2HD2 LEU 101 2HD2 LEU 101 2.783 -0.529 10.043 629 3HD2 LEU 101 3HD2 LEU 101 3.246 -0.890 11.711 630 H ILE 102 H ILE 102 3.907 -0.455 7.282 631 HA ILE 102 HA ILE 102 1.598 0.657 8.539 632 HB ILE 102 HB ILE 102 2.221 2.473 7.148 633 1HG1 ILE 102 2HG1 ILE 102 -0.099 1.035 5.843 634 2HG1 ILE 102 1HG1 ILE 102 -0.191 1.981 7.323 635 1HG2 ILE 102 1HG2 ILE 102 2.425 2.289 4.675 636 2HG2 ILE 102 2HG2 ILE 102 2.250 0.541 4.840 637 3HG2 ILE 102 3HG2 ILE 102 3.632 1.324 5.544 638 1HD1 ILE 102 1HD1 ILE 102 0.540 3.034 4.601 639 2HD1 ILE 102 2HD1 ILE 102 0.439 3.988 6.080 640 3HD1 ILE 102 3HD1 ILE 102 -1.013 3.245 5.406 641 H THR 103 H THR 103 0.197 -0.796 8.655 642 HA THR 103 HA THR 103 0.104 -3.099 6.824 643 HB THR 103 HB THR 103 -1.426 -2.607 9.393 644 HG1 THR 103 1HG THR 103 0.838 -4.262 8.938 645 1HG2 THR 103 1HG2 THR 103 -1.834 -5.039 9.341 646 2HG2 THR 103 2HG2 THR 103 -0.979 -5.148 7.804 647 3HG2 THR 103 3HG2 THR 103 -2.496 -4.256 7.905 648 H PHE 104 H PHE 104 -1.293 -3.164 5.206 649 HA PHE 104 HA PHE 104 -3.656 -1.411 5.174 650 1HB PHE 104 2HB PHE 104 -2.277 -2.992 3.010 651 2HB PHE 104 1HB PHE 104 -3.627 -1.956 2.665 652 HD1 PHE 104 1HD PHE 104 -3.237 0.573 3.285 653 HD2 PHE 104 2HD PHE 104 -0.149 -2.307 2.794 654 HE1 PHE 104 1HE PHE 104 -1.619 2.375 2.849 655 HE2 PHE 104 2HE PHE 104 1.463 -0.521 2.358 656 HZ PHE 104 HZ PHE 104 0.748 1.814 2.385 657 H ARG 105 H ARG 105 -5.578 -2.371 5.547 658 HA ARG 105 HA ARG 105 -5.850 -5.294 5.215 659 1HB ARG 105 2HB ARG 105 -6.215 -4.131 7.468 660 2HB ARG 105 1HB ARG 105 -7.579 -3.323 6.746 661 1HG ARG 105 2HG ARG 105 -7.320 -6.311 7.230 662 2HG ARG 105 1HG ARG 105 -8.192 -5.161 8.213 663 1HD ARG 105 2HD ARG 105 -9.715 -4.749 6.293 664 2HD ARG 105 1HD ARG 105 -8.858 -6.000 5.386 665 HE ARG 105 HE ARG 105 -9.733 -6.867 7.957 666 1HH1 ARG 105 1HH1 ARG 105 -10.798 -6.575 4.561 667 2HH1 ARG 105 2HH1 ARG 105 -12.068 -7.682 4.726 668 1HH2 ARG 105 1HH2 ARG 105 -11.490 -8.477 8.120 669 2HH2 ARG 105 2HH2 ARG 105 -12.455 -8.792 6.765 670 H VAL 106 H VAL 106 -6.892 -5.740 3.291 671 HA VAL 106 HA VAL 106 -8.291 -3.655 1.902 672 HB VAL 106 HB VAL 106 -7.765 -6.573 1.230 673 1HG1 VAL 106 1HG1 VAL 106 -8.663 -6.109 -1.005 674 2HG1 VAL 106 2HG1 VAL 106 -9.143 -4.496 -0.487 675 3HG1 VAL 106 3HG1 VAL 106 -9.916 -5.913 0.221 676 1HG2 VAL 106 1HG2 VAL 106 -5.848 -5.082 1.124 677 2HG2 VAL 106 2HG2 VAL 106 -6.753 -3.983 0.085 678 3HG2 VAL 106 3HG2 VAL 106 -6.329 -5.588 -0.499 679 H ILE 107 H ILE 107 -10.386 -3.229 1.990 680 HA ILE 107 HA ILE 107 -11.961 -5.137 3.550 681 HB ILE 107 HB ILE 107 -13.493 -3.448 4.266 682 1HG1 ILE 107 2HG1 ILE 107 -13.720 -2.093 2.108 683 2HG1 ILE 107 1HG1 ILE 107 -13.499 -1.111 3.560 684 1HG2 ILE 107 1HG2 ILE 107 -12.054 -1.830 5.393 685 2HG2 ILE 107 2HG2 ILE 107 -10.752 -2.267 4.287 686 3HG2 ILE 107 3HG2 ILE 107 -11.367 -3.466 5.434 687 1HD1 ILE 107 1HD1 ILE 107 -12.338 -0.266 1.675 688 2HD1 ILE 107 2HD1 ILE 107 -11.452 -1.779 1.514 689 3HD1 ILE 107 3HD1 ILE 107 -11.215 -0.764 2.940 690 H GLU 108 H GLU 108 -11.840 -3.622 0.460 691 HA GLU 108 HA GLU 108 -13.797 -5.493 -0.543 692 1HB GLU 108 2HB GLU 108 -14.219 -2.518 -0.720 693 2HB GLU 108 1HB GLU 108 -14.936 -3.636 -1.861 694 1HG GLU 108 2HG GLU 108 -16.117 -4.722 -0.074 695 2HG GLU 108 1HG GLU 108 -15.305 -3.653 1.071 696 H GLY 109 H GLY 109 -14.055 -5.039 -2.858 697 1HA GLY 109 2HA GLY 109 -13.046 -3.994 -4.855 698 2HA GLY 109 1HA GLY 109 -11.498 -4.113 -4.037 699 H ASP 110 H ASP 110 -10.897 -4.980 -6.083 700 HA ASP 110 HA ASP 110 -11.761 -7.309 -7.324 701 1HB ASP 110 2HB ASP 110 -8.944 -6.221 -7.175 702 2HB ASP 110 1HB ASP 110 -9.576 -7.306 -8.403 703 H LEU 111 H LEU 111 -9.193 -6.803 -4.978 704 HA LEU 111 HA LEU 111 -8.231 -9.445 -4.881 705 1HB LEU 111 2HB LEU 111 -8.091 -7.299 -2.767 706 2HB LEU 111 1HB LEU 111 -7.133 -8.766 -2.778 707 HG LEU 111 HG LEU 111 -6.977 -6.555 -4.837 708 1HD1 LEU 111 1HD1 LEU 111 -4.787 -6.096 -3.864 709 2HD1 LEU 111 2HD1 LEU 111 -5.087 -7.308 -2.618 710 3HD1 LEU 111 3HD1 LEU 111 -6.087 -5.854 -2.699 711 1HD2 LEU 111 1HD2 LEU 111 -6.441 -8.735 -5.802 712 2HD2 LEU 111 2HD2 LEU 111 -5.299 -9.042 -4.493 713 3HD2 LEU 111 3HD2 LEU 111 -4.994 -7.745 -5.644 714 H MET 112 H MET 112 -10.923 -7.935 -3.335 715 HA MET 112 HA MET 112 -11.198 -9.808 -1.180 716 1HB MET 112 2HB MET 112 -12.085 -7.415 -1.325 717 2HB MET 112 1HB MET 112 -13.329 -8.082 -2.375 718 1HG MET 112 2HG MET 112 -14.461 -8.102 -0.373 719 2HG MET 112 1HG MET 112 -13.730 -9.699 -0.343 720 1HE MET 112 1HE MET 112 -11.405 -10.203 1.192 721 2HE MET 112 2HE MET 112 -10.714 -9.018 2.265 722 3HE MET 112 3HE MET 112 -10.557 -8.798 0.521 723 H LYS 113 H LYS 113 -11.923 -9.885 -4.554 724 HA LYS 113 HA LYS 113 -14.080 -11.780 -4.456 725 1HB LYS 113 2HB LYS 113 -12.269 -11.002 -6.748 726 2HB LYS 113 1HB LYS 113 -13.761 -11.917 -6.879 727 1HG LYS 113 2HG LYS 113 -13.534 -9.081 -5.906 728 2HG LYS 113 1HG LYS 113 -14.038 -9.579 -7.522 729 1HD LYS 113 2HD LYS 113 -15.965 -10.707 -6.625 730 2HD LYS 113 1HD LYS 113 -15.438 -10.382 -4.974 731 1HE LYS 113 2HE LYS 113 -16.090 -8.315 -7.026 732 2HE LYS 113 1HE LYS 113 -17.206 -8.842 -5.746 733 1HZ LYS 113 1HZ LYS 113 -15.529 -8.025 -4.128 734 2HZ LYS 113 2HZ LYS 113 -16.131 -6.817 -5.127 735 3HZ LYS 113 3HZ LYS 113 -14.602 -7.425 -5.415 736 H GLU 114 H GLU 114 -10.722 -11.936 -4.181 737 HA GLU 114 HA GLU 114 -10.751 -14.825 -4.794 738 1HB GLU 114 2HB GLU 114 -8.430 -12.912 -4.608 739 2HB GLU 114 1HB GLU 114 -8.229 -14.649 -4.670 740 1HG GLU 114 2HG GLU 114 -9.307 -14.676 -6.867 741 2HG GLU 114 1HG GLU 114 -9.477 -12.920 -6.785 742 H TYR 115 H TYR 115 -9.781 -12.445 -2.418 743 HA TYR 115 HA TYR 115 -9.423 -14.624 -0.490 744 1HB TYR 115 2HB TYR 115 -8.213 -11.875 -0.216 745 2HB TYR 115 1HB TYR 115 -7.664 -13.396 0.485 746 HD1 TYR 115 1HD TYR 115 -7.083 -11.040 -2.021 747 HD2 TYR 115 2HD TYR 115 -6.930 -15.228 -1.315 748 HE1 TYR 115 1HE TYR 115 -5.628 -11.304 -3.970 749 HE2 TYR 115 2HE TYR 115 -5.452 -15.498 -3.250 750 HH TYR 115 HH TYR 115 -5.224 -14.033 -5.490 751 H LYS 116 H LYS 116 -10.608 -14.429 1.301 752 HA LYS 116 HA LYS 116 -12.609 -12.355 1.271 753 1HB LYS 116 2HB LYS 116 -13.612 -13.711 3.183 754 2HB LYS 116 1HB LYS 116 -13.654 -14.406 1.572 755 1HG LYS 116 2HG LYS 116 -11.598 -15.711 2.208 756 2HG LYS 116 1HG LYS 116 -11.832 -15.133 3.860 757 1HD LYS 116 2HD LYS 116 -13.919 -16.634 2.275 758 2HD LYS 116 1HD LYS 116 -12.817 -17.408 3.398 759 1HE LYS 116 2HE LYS 116 -14.722 -15.196 4.168 760 2HE LYS 116 1HE LYS 116 -15.105 -16.912 4.283 761 1HZ LYS 116 1HZ LYS 116 -14.338 -15.944 6.385 762 2HZ LYS 116 2HZ LYS 116 -12.834 -15.592 5.713 763 3HZ LYS 116 3HZ LYS 116 -13.344 -17.187 5.871 764 H SER 117 H SER 117 -9.661 -12.522 2.417 765 HA SER 117 HA SER 117 -9.955 -10.134 3.801 766 1HB SER 117 2HB SER 117 -10.619 -11.582 5.570 767 2HB SER 117 1HB SER 117 -9.163 -12.586 5.400 768 HG SER 117 HG SER 117 -8.652 -11.227 6.989 769 H PHE 118 H PHE 118 -7.988 -9.098 3.752 770 HA PHE 118 HA PHE 118 -5.623 -10.564 3.022 771 1HB PHE 118 2HB PHE 118 -6.641 -10.321 0.831 772 2HB PHE 118 1HB PHE 118 -6.951 -8.617 1.113 773 HD1 PHE 118 1HD PHE 118 -4.234 -11.098 0.619 774 HD2 PHE 118 2HD PHE 118 -5.354 -7.020 0.531 775 HE1 PHE 118 1HE PHE 118 -2.092 -10.546 -0.407 776 HE2 PHE 118 2HE PHE 118 -3.208 -6.452 -0.528 777 HZ PHE 118 HZ PHE 118 -1.573 -8.212 -0.989 778 H LEU 119 H LEU 119 -4.099 -9.708 4.300 779 HA LEU 119 HA LEU 119 -4.059 -6.806 4.504 780 1HB LEU 119 2HB LEU 119 -3.364 -8.729 6.717 781 2HB LEU 119 1HB LEU 119 -3.031 -7.016 6.742 782 HG LEU 119 HG LEU 119 -5.570 -6.775 6.454 783 1HD1 LEU 119 1HD1 LEU 119 -6.906 -8.525 7.505 784 2HD1 LEU 119 2HD1 LEU 119 -5.481 -9.566 7.543 785 3HD1 LEU 119 3HD1 LEU 119 -6.147 -9.035 5.996 786 1HD2 LEU 119 1HD2 LEU 119 -4.378 -6.009 8.328 787 2HD2 LEU 119 2HD2 LEU 119 -4.293 -7.627 9.041 788 3HD2 LEU 119 3HD2 LEU 119 -5.856 -6.798 8.885 789 H LEU 120 H LEU 120 -2.154 -5.879 4.444 790 HA LEU 120 HA LEU 120 0.196 -7.543 4.240 791 1HB LEU 120 2HB LEU 120 1.001 -6.563 2.178 792 2HB LEU 120 1HB LEU 120 -0.528 -7.360 1.911 793 HG LEU 120 HG LEU 120 -0.123 -4.361 2.091 794 1HD1 LEU 120 1HD1 LEU 120 -0.475 -4.367 -0.303 795 2HD1 LEU 120 2HD1 LEU 120 -0.618 -6.130 -0.291 796 3HD1 LEU 120 3HD1 LEU 120 0.908 -5.372 0.141 797 1HD2 LEU 120 1HD2 LEU 120 -2.384 -5.034 2.767 798 2HD2 LEU 120 2HD2 LEU 120 -2.545 -5.976 1.290 799 3HD2 LEU 120 3HD2 LEU 120 -2.410 -4.223 1.196 800 H THR 121 H THR 121 1.766 -6.736 5.262 801 HA THR 121 HA THR 121 1.640 -3.911 6.080 802 HB THR 121 HB THR 121 3.213 -6.182 7.313 803 HG1 THR 121 1HG THR 121 0.907 -6.306 7.556 804 1HG2 THR 121 1HG2 THR 121 4.234 -3.985 7.654 805 2HG2 THR 121 2HG2 THR 121 3.548 -4.580 9.167 806 3HG2 THR 121 3HG2 THR 121 2.702 -3.343 8.221 807 H ILE 122 H ILE 122 3.125 -2.545 5.351 808 HA ILE 122 HA ILE 122 5.551 -3.742 4.272 809 HB ILE 122 HB ILE 122 5.813 -1.828 2.773 810 1HG1 ILE 122 2HG1 ILE 122 3.072 -0.956 3.654 811 2HG1 ILE 122 1HG1 ILE 122 4.578 -0.163 4.110 812 1HG2 ILE 122 1HG2 ILE 122 4.663 -3.783 1.916 813 2HG2 ILE 122 2HG2 ILE 122 3.971 -2.314 1.217 814 3HG2 ILE 122 3HG2 ILE 122 3.123 -3.150 2.514 815 1HD1 ILE 122 1HD1 ILE 122 3.504 -0.431 1.306 816 2HD1 ILE 122 2HD1 ILE 122 5.014 0.352 1.759 817 3HD1 ILE 122 3HD1 ILE 122 3.476 1.034 2.293 818 H GLN 123 H GLN 123 7.393 -3.066 5.054 819 HA GLN 123 HA GLN 123 7.404 -0.632 6.654 820 1HB GLN 123 2HB GLN 123 7.179 -2.580 8.185 821 2HB GLN 123 1HB GLN 123 8.664 -3.240 7.518 822 1HG GLN 123 2HG GLN 123 9.942 -1.411 8.400 823 2HG GLN 123 1HG GLN 123 8.478 -0.588 8.930 824 1HE2 GLN 123 1HE2 GLN 123 9.079 -0.544 11.050 825 2HE2 GLN 123 2HE2 GLN 123 9.139 -1.958 12.053 826 H VAL 124 H VAL 124 8.965 0.639 6.104 827 HA VAL 124 HA VAL 124 10.899 -0.377 4.168 828 HB VAL 124 HB VAL 124 10.247 2.503 4.860 829 1HG1 VAL 124 1HG1 VAL 124 11.415 3.046 2.779 830 2HG1 VAL 124 2HG1 VAL 124 11.826 1.342 2.570 831 3HG1 VAL 124 3HG1 VAL 124 12.476 2.240 3.938 832 1HG2 VAL 124 1HG2 VAL 124 8.315 1.384 3.872 833 2HG2 VAL 124 2HG2 VAL 124 9.314 0.816 2.536 834 3HG2 VAL 124 3HG2 VAL 124 9.010 2.540 2.737 835 H THR 125 H THR 125 12.787 -0.972 4.919 836 HA THR 125 HA THR 125 13.916 0.533 7.118 837 HB THR 125 HB THR 125 15.415 -1.574 7.295 838 HG1 THR 125 1HG THR 125 14.918 -2.983 5.877 839 1HG2 THR 125 1HG2 THR 125 12.536 -1.539 8.222 840 2HG2 THR 125 2HG2 THR 125 13.957 -0.858 9.020 841 3HG2 THR 125 3HG2 THR 125 13.801 -2.613 8.854 842 HA PRO 126 HA PRO 126 17.286 2.044 4.636 843 1HB PRO 126 2HB PRO 126 19.268 1.430 6.533 844 2HB PRO 126 1HB PRO 126 18.353 2.941 6.453 845 1HG PRO 126 2HG PRO 126 17.795 0.488 8.127 846 2HG PRO 126 1HG PRO 126 17.688 2.204 8.589 847 1HD PRO 126 2HD PRO 126 15.571 0.831 8.089 848 2HD PRO 126 1HD PRO 126 15.709 2.468 7.395 849 H LYS 127 H LYS 127 18.674 1.122 3.175 850 HA LYS 127 HA LYS 127 18.839 -1.671 2.835 851 1HB LYS 127 2HB LYS 127 19.056 -0.073 0.976 852 2HB LYS 127 1HB LYS 127 20.535 0.556 1.671 853 1HG LYS 127 2HG LYS 127 21.050 -0.853 -0.212 854 2HG LYS 127 1HG LYS 127 21.616 -1.627 1.262 855 1HD LYS 127 2HD LYS 127 19.648 -3.098 1.250 856 2HD LYS 127 1HD LYS 127 19.055 -2.292 -0.202 857 1HE LYS 127 2HE LYS 127 21.016 -3.017 -1.449 858 2HE LYS 127 1HE LYS 127 21.686 -3.745 0.002 859 1HZ LYS 127 1HZ LYS 127 19.864 -5.336 0.006 860 2HZ LYS 127 2HZ LYS 127 20.707 -5.383 -1.431 861 3HZ LYS 127 3HZ LYS 127 19.208 -4.671 -1.420 862 HA PRO 128 HA PRO 128 21.772 -2.403 6.197 863 1HB PRO 128 2HB PRO 128 22.040 -4.956 4.718 864 2HB PRO 128 1HB PRO 128 21.734 -4.685 6.436 865 1HG PRO 128 2HG PRO 128 19.768 -5.470 4.844 866 2HG PRO 128 1HG PRO 128 19.471 -4.251 6.095 867 1HD PRO 128 2HD PRO 128 19.771 -3.906 3.148 868 2HD PRO 128 1HD PRO 128 18.715 -3.062 4.298 869 H GLY 129 H GLY 129 22.501 -2.709 2.824 870 1HA GLY 129 2HA GLY 129 25.359 -2.795 3.512 871 2HA GLY 129 1HA GLY 129 24.707 -3.455 2.029 872 H GLY 130 H GLY 130 23.591 -0.313 3.170 873 1HA GLY 130 2HA GLY 130 25.245 1.558 2.520 874 2HA GLY 130 1HA GLY 130 25.088 0.848 0.924 875 HA PRO 131 HA PRO 131 21.956 4.172 1.089 876 1HB PRO 131 2HB PRO 131 22.062 4.799 -1.532 877 2HB PRO 131 1HB PRO 131 23.230 5.419 -0.361 878 1HG PRO 131 2HG PRO 131 23.509 3.156 -2.295 879 2HG PRO 131 1HG PRO 131 24.690 4.400 -1.855 880 1HD PRO 131 2HD PRO 131 24.735 1.875 -0.850 881 2HD PRO 131 1HD PRO 131 25.345 3.283 0.039 882 H GLY 132 H GLY 132 19.856 4.320 0.301 883 1HA GLY 132 2HA GLY 132 18.058 3.614 -1.108 884 2HA GLY 132 1HA GLY 132 18.875 2.064 -1.304 885 H SER 133 H SER 133 16.437 1.608 -0.628 886 HA SER 133 HA SER 133 16.667 0.735 2.093 887 1HB SER 133 2HB SER 133 14.427 2.550 1.197 888 2HB SER 133 1HB SER 133 14.422 1.632 2.709 889 HG SER 133 HG SER 133 16.715 3.019 2.295 890 H ILE 134 H ILE 134 15.085 -0.824 2.689 891 HA ILE 134 HA ILE 134 14.188 -2.355 0.362 892 HB ILE 134 HB ILE 134 14.839 -3.280 3.172 893 1HG1 ILE 134 2HG1 ILE 134 16.802 -2.627 1.925 894 2HG1 ILE 134 1HG1 ILE 134 16.719 -4.390 2.193 895 1HG2 ILE 134 1HG2 ILE 134 14.625 -5.563 2.298 896 2HG2 ILE 134 2HG2 ILE 134 14.092 -4.916 0.745 897 3HG2 ILE 134 3HG2 ILE 134 13.107 -4.675 2.189 898 1HD1 ILE 134 1HD1 ILE 134 16.087 -2.932 -0.361 899 2HD1 ILE 134 2HD1 ILE 134 15.988 -4.671 -0.082 900 3HD1 ILE 134 3HD1 ILE 134 17.552 -3.861 -0.025 901 H VAL 135 H VAL 135 12.105 -2.861 0.376 902 HA VAL 135 HA VAL 135 10.422 -1.961 2.645 903 HB VAL 135 HB VAL 135 9.325 -2.853 -0.015 904 1HG1 VAL 135 1HG1 VAL 135 7.747 -2.808 1.768 905 2HG1 VAL 135 2HG1 VAL 135 7.387 -1.518 0.620 906 3HG1 VAL 135 3HG1 VAL 135 8.170 -1.138 2.155 907 1HG2 VAL 135 1HG2 VAL 135 9.125 -0.550 -0.682 908 2HG2 VAL 135 2HG2 VAL 135 10.808 -1.067 -0.527 909 3HG2 VAL 135 3HG2 VAL 135 10.080 -0.031 0.720 910 H HIS 136 H HIS 136 9.957 -3.541 3.977 911 HA HIS 136 HA HIS 136 9.930 -6.255 2.952 912 1HB HIS 136 2HB HIS 136 9.683 -5.185 5.765 913 2HB HIS 136 1HB HIS 136 9.517 -6.890 5.366 914 HD1 HIS 136 1HD HIS 136 11.634 -8.199 5.002 915 HD2 HIS 136 2HD HIS 136 12.319 -4.136 5.463 916 HE1 HIS 136 1HE HIS 136 14.127 -7.964 5.282 917 HE2 HIS 136 2HE HIS 136 14.482 -5.509 5.733 918 H TRP 137 H TRP 137 8.180 -6.910 2.031 919 HA TRP 137 HA TRP 137 5.603 -5.851 2.873 920 1HB TRP 137 2HB TRP 137 6.456 -7.571 0.539 921 2HB TRP 137 1HB TRP 137 4.809 -7.116 0.882 922 HD1 TRP 137 HD TRP 137 8.183 -5.157 0.042 923 HE1 TRP 137 1HE TRP 137 7.531 -3.239 -1.454 924 HE3 TRP 137 3HE TRP 137 3.086 -5.820 -0.046 925 HZ2 TRP 137 2HZ TRP 137 5.218 -2.083 -2.554 926 HZ3 TRP 137 3HZ TRP 137 1.743 -4.243 -1.358 927 HH2 TRP 137 HH TRP 137 2.781 -2.414 -2.584 928 H HIS 138 H HIS 138 4.557 -7.038 4.321 929 HA HIS 138 HA HIS 138 4.984 -9.943 4.342 930 1HB HIS 138 2HB HIS 138 5.819 -8.890 6.395 931 2HB HIS 138 1HB HIS 138 4.299 -8.042 6.606 932 HD1 HIS 138 1HD HIS 138 5.938 -11.363 7.084 933 HD2 HIS 138 2HD HIS 138 2.289 -9.526 7.670 934 HE1 HIS 138 1HE HIS 138 4.656 -12.935 8.558 935 HE2 HIS 138 2HE HIS 138 2.648 -11.609 9.216 936 H LEU 139 H LEU 139 3.272 -10.895 3.409 937 HA LEU 139 HA LEU 139 0.697 -9.527 3.620 938 1HB LEU 139 2HB LEU 139 1.629 -11.488 1.512 939 2HB LEU 139 1HB LEU 139 0.070 -10.710 1.565 940 HG LEU 139 HG LEU 139 1.319 -8.509 1.237 941 1HD1 LEU 139 1HD1 LEU 139 3.545 -9.185 1.838 942 2HD1 LEU 139 2HD1 LEU 139 3.505 -8.613 0.167 943 3HD1 LEU 139 3HD1 LEU 139 3.580 -10.340 0.507 944 1HD2 LEU 139 1HD2 LEU 139 1.446 -10.572 -0.944 945 2HD2 LEU 139 2HD2 LEU 139 1.515 -8.822 -1.171 946 3HD2 LEU 139 3HD2 LEU 139 0.054 -9.575 -0.524 947 H GLU 140 H GLU 140 -0.946 -10.597 4.458 948 HA GLU 140 HA GLU 140 -0.882 -13.480 4.584 949 1HB GLU 140 2HB GLU 140 0.015 -12.724 6.804 950 2HB GLU 140 1HB GLU 140 -1.478 -11.836 7.069 951 1HG GLU 140 2HG GLU 140 -2.754 -13.889 7.067 952 2HG GLU 140 1HG GLU 140 -1.318 -14.822 6.669 953 H TYR 141 H TYR 141 -2.762 -14.304 4.138 954 HA TYR 141 HA TYR 141 -5.143 -12.633 4.142 955 1HB TYR 141 2HB TYR 141 -5.463 -12.953 1.688 956 2HB TYR 141 1HB TYR 141 -4.149 -11.899 2.227 957 HD1 TYR 141 1HD TYR 141 -1.809 -12.530 1.896 958 HD2 TYR 141 2HD TYR 141 -4.956 -15.004 0.457 959 HE1 TYR 141 1HE TYR 141 -0.195 -13.722 0.498 960 HE2 TYR 141 2HE TYR 141 -3.352 -16.219 -0.956 961 HH TYR 141 HH TYR 141 -0.017 -15.984 -0.598 962 H GLU 142 H GLU 142 -6.967 -13.705 3.202 963 HA GLU 142 HA GLU 142 -6.966 -16.483 4.136 964 1HB GLU 142 2HB GLU 142 -7.958 -14.863 5.696 965 2HB GLU 142 1HB GLU 142 -9.022 -14.321 4.412 966 1HG GLU 142 2HG GLU 142 -10.108 -16.460 4.373 967 2HG GLU 142 1HG GLU 142 -9.002 -17.057 5.615 968 H LYS 143 H LYS 143 -7.415 -17.773 2.498 969 HA LYS 143 HA LYS 143 -8.429 -16.887 -0.008 970 1HB LYS 143 2HB LYS 143 -7.882 -19.600 1.125 971 2HB LYS 143 1HB LYS 143 -8.688 -19.407 -0.412 972 1HG LYS 143 2HG LYS 143 -6.389 -19.899 -0.746 973 2HG LYS 143 1HG LYS 143 -6.703 -18.254 -1.253 974 1HD LYS 143 2HD LYS 143 -5.606 -17.379 0.644 975 2HD LYS 143 1HD LYS 143 -5.500 -18.980 1.412 976 1HE LYS 143 2HE LYS 143 -4.281 -18.263 -1.228 977 2HE LYS 143 1HE LYS 143 -3.371 -18.222 0.279 978 1HZ LYS 143 1HZ LYS 143 -3.105 -20.363 -1.017 979 2HZ LYS 143 2HZ LYS 143 -4.732 -20.669 -0.804 980 3HZ LYS 143 3HZ LYS 143 -3.735 -20.596 0.525 981 H ILE 144 H ILE 144 -10.475 -17.136 -0.859 982 HA ILE 144 HA ILE 144 -12.662 -17.934 0.841 983 HB ILE 144 HB ILE 144 -12.576 -17.551 -2.182 984 1HG1 ILE 144 2HG1 ILE 144 -13.499 -15.636 -0.040 985 2HG1 ILE 144 1HG1 ILE 144 -11.978 -15.500 -0.918 986 1HG2 ILE 144 1HG2 ILE 144 -14.926 -17.678 -0.305 987 2HG2 ILE 144 2HG2 ILE 144 -14.475 -18.906 -1.492 988 3HG2 ILE 144 3HG2 ILE 144 -15.016 -17.308 -2.029 989 1HD1 ILE 144 1HD1 ILE 144 -13.635 -13.978 -1.809 990 2HD1 ILE 144 2HD1 ILE 144 -14.746 -15.322 -2.089 991 3HD1 ILE 144 3HD1 ILE 144 -13.236 -15.226 -2.997 992 H SER 145 H SER 145 -10.684 -19.216 -1.724 993 HA SER 145 HA SER 145 -10.839 -21.884 -0.941 994 1HB SER 145 2HB SER 145 -13.055 -21.737 -2.120 995 2HB SER 145 1HB SER 145 -12.240 -21.111 -3.546 996 HG SER 145 HG SER 145 -12.744 -23.398 -3.543 997 H GLU 146 H GLU 146 -9.394 -23.081 -2.471 998 HA GLU 146 HA GLU 146 -7.137 -21.453 -3.223 999 1HB GLU 146 2HB GLU 146 -7.782 -24.279 -3.675 1000 2HB GLU 146 1HB GLU 146 -6.238 -23.550 -4.108 1001 1HG GLU 146 2HG GLU 146 -7.356 -23.782 -1.293 1002 2HG GLU 146 1HG GLU 146 -6.039 -24.759 -1.946 1003 H GLU 147 H GLU 147 -9.734 -23.056 -4.789 1004 HA GLU 147 HA GLU 147 -8.863 -23.184 -7.452 1005 1HB GLU 147 2HB GLU 147 -10.829 -24.344 -6.465 1006 2HB GLU 147 1HB GLU 147 -11.666 -22.805 -6.383 1007 1HG GLU 147 2HG GLU 147 -11.494 -22.650 -8.854 1008 2HG GLU 147 1HG GLU 147 -10.793 -24.269 -8.854 1009 H VAL 148 H VAL 148 -9.737 -20.619 -5.536 1010 HA VAL 148 HA VAL 148 -10.316 -18.894 -7.886 1011 HB VAL 148 HB VAL 148 -12.251 -19.005 -6.335 1012 1HG1 VAL 148 1HG1 VAL 148 -12.203 -18.010 -4.151 1013 2HG1 VAL 148 2HG1 VAL 148 -10.467 -17.725 -4.300 1014 3HG1 VAL 148 3HG1 VAL 148 -11.089 -19.374 -4.256 1015 1HG2 VAL 148 1HG2 VAL 148 -10.944 -16.291 -6.429 1016 2HG2 VAL 148 2HG2 VAL 148 -12.646 -16.592 -6.085 1017 3HG2 VAL 148 3HG2 VAL 148 -11.982 -16.995 -7.667 1018 H ALA 149 H ALA 149 -8.243 -19.276 -5.176 1019 HA ALA 149 HA ALA 149 -7.280 -16.566 -5.155 1020 1HB ALA 149 1HB ALA 149 -7.453 -17.802 -3.100 1021 2HB ALA 149 2HB ALA 149 -5.747 -17.422 -3.430 1022 3HB ALA 149 3HB ALA 149 -6.363 -19.035 -3.725 1023 H HIS 150 H HIS 150 -5.526 -15.813 -6.131 1024 HA HIS 150 HA HIS 150 -3.637 -17.760 -7.296 1025 1HB HIS 150 2HB HIS 150 -4.374 -15.076 -8.488 1026 2HB HIS 150 1HB HIS 150 -3.222 -16.218 -9.159 1027 HD1 HIS 150 1HD HIS 150 -4.214 -18.203 -10.518 1028 HD2 HIS 150 2HD HIS 150 -7.056 -15.684 -8.846 1029 HE1 HIS 150 1HE HIS 150 -6.375 -18.775 -11.648 1030 HE2 HIS 150 2HE HIS 150 -7.983 -17.031 -10.825 1031 HA PRO 151 HA PRO 151 -1.222 -15.428 -4.102 1032 1HB PRO 151 2HB PRO 151 0.685 -17.561 -4.942 1033 2HB PRO 151 1HB PRO 151 0.253 -17.018 -3.318 1034 1HG PRO 151 2HG PRO 151 -0.726 -19.289 -4.247 1035 2HG PRO 151 1HG PRO 151 -1.753 -18.181 -3.319 1036 1HD PRO 151 2HD PRO 151 -1.701 -18.681 -6.269 1037 2HD PRO 151 1HD PRO 151 -3.073 -18.386 -5.186 1038 H GLU 152 H GLU 152 -0.669 -15.943 -7.363 1039 HA GLU 152 HA GLU 152 1.945 -14.844 -7.754 1040 1HB GLU 152 2HB GLU 152 -0.357 -14.946 -9.673 1041 2HB GLU 152 1HB GLU 152 1.354 -14.820 -10.055 1042 1HG GLU 152 2HG GLU 152 -0.038 -17.107 -8.772 1043 2HG GLU 152 1HG GLU 152 0.497 -17.007 -10.450 1044 H THR 153 H THR 153 -1.307 -13.687 -7.853 1045 HA THR 153 HA THR 153 -0.880 -11.273 -9.186 1046 HB THR 153 HB THR 153 -3.146 -10.712 -8.568 1047 HG1 THR 153 1HG THR 153 -3.321 -13.001 -6.836 1048 1HG2 THR 153 1HG2 THR 153 -2.842 -12.433 -10.275 1049 2HG2 THR 153 2HG2 THR 153 -4.280 -12.778 -9.307 1050 3HG2 THR 153 3HG2 THR 153 -2.784 -13.679 -9.039 1051 H LEU 154 H LEU 154 -0.670 -12.103 -5.803 1052 HA LEU 154 HA LEU 154 -0.863 -9.467 -4.824 1053 1HB LEU 154 2HB LEU 154 0.498 -11.808 -3.497 1054 2HB LEU 154 1HB LEU 154 0.063 -10.303 -2.723 1055 HG LEU 154 HG LEU 154 -1.549 -11.719 -2.008 1056 1HD1 LEU 154 1HD1 LEU 154 -2.781 -10.478 -4.439 1057 2HD1 LEU 154 2HD1 LEU 154 -2.585 -9.746 -2.847 1058 3HD1 LEU 154 3HD1 LEU 154 -3.657 -11.130 -3.054 1059 1HD2 LEU 154 1HD2 LEU 154 -1.798 -12.926 -4.756 1060 2HD2 LEU 154 2HD2 LEU 154 -2.735 -13.381 -3.334 1061 3HD2 LEU 154 3HD2 LEU 154 -0.992 -13.628 -3.343 1062 H LEU 155 H LEU 155 1.837 -11.404 -5.899 1063 HA LEU 155 HA LEU 155 3.813 -9.556 -5.066 1064 1HB LEU 155 2HB LEU 155 3.879 -11.688 -7.177 1065 2HB LEU 155 1HB LEU 155 5.273 -10.739 -6.697 1066 HG LEU 155 HG LEU 155 3.723 -12.601 -4.903 1067 1HD1 LEU 155 1HD1 LEU 155 6.451 -12.802 -6.127 1068 2HD1 LEU 155 2HD1 LEU 155 5.030 -13.743 -6.587 1069 3HD1 LEU 155 3HD1 LEU 155 5.741 -13.943 -4.975 1070 1HD2 LEU 155 1HD2 LEU 155 6.204 -10.960 -4.417 1071 2HD2 LEU 155 2HD2 LEU 155 5.562 -12.185 -3.328 1072 3HD2 LEU 155 3HD2 LEU 155 4.638 -10.721 -3.656 1073 H GLN 156 H GLN 156 1.922 -9.955 -7.949 1074 HA GLN 156 HA GLN 156 3.308 -7.961 -9.395 1075 1HB GLN 156 2HB GLN 156 0.522 -9.047 -9.800 1076 2HB GLN 156 1HB GLN 156 1.373 -8.011 -10.939 1077 1HG GLN 156 2HG GLN 156 3.181 -9.739 -11.027 1078 2HG GLN 156 1HG GLN 156 2.122 -10.790 -10.091 1079 1HE2 GLN 156 1HE2 GLN 156 2.671 -9.215 -13.040 1080 2HE2 GLN 156 2HE2 GLN 156 1.536 -10.090 -14.016 1081 H PHE 157 H PHE 157 0.540 -7.932 -7.254 1082 HA PHE 157 HA PHE 157 -0.163 -5.224 -7.518 1083 1HB PHE 157 2HB PHE 157 -1.571 -6.894 -6.311 1084 2HB PHE 157 1HB PHE 157 -0.343 -7.008 -5.062 1085 HD1 PHE 157 1HD PHE 157 -0.620 -5.727 -3.118 1086 HD2 PHE 157 2HD PHE 157 -2.550 -4.483 -6.717 1087 HE1 PHE 157 1HE PHE 157 -1.807 -3.901 -1.872 1088 HE2 PHE 157 2HE PHE 157 -3.711 -2.700 -5.479 1089 HZ PHE 157 HZ PHE 157 -3.330 -2.418 -3.064 1090 H CYS 158 H CYS 158 2.224 -6.890 -5.532 1091 HA CYS 158 HA CYS 158 3.138 -4.670 -4.088 1092 1HB CYS 158 2HB CYS 158 4.728 -7.097 -4.966 1093 2HB CYS 158 1HB CYS 158 5.200 -5.968 -3.703 1094 HG CYS 158 HG CYS 158 2.386 -7.884 -3.557 1095 H VAL 159 H VAL 159 4.237 -6.035 -7.156 1096 HA VAL 159 HA VAL 159 6.376 -4.333 -7.660 1097 HB VAL 159 HB VAL 159 4.493 -5.529 -9.711 1098 1HG1 VAL 159 1HG1 VAL 159 5.848 -3.734 -10.612 1099 2HG1 VAL 159 2HG1 VAL 159 6.339 -5.297 -11.298 1100 3HG1 VAL 159 3HG1 VAL 159 7.308 -4.514 -10.034 1101 1HG2 VAL 159 1HG2 VAL 159 7.097 -6.613 -8.630 1102 2HG2 VAL 159 2HG2 VAL 159 6.097 -7.333 -9.906 1103 3HG2 VAL 159 3HG2 VAL 159 5.476 -7.215 -8.263 1104 H GLU 160 H GLU 160 2.971 -3.957 -8.634 1105 HA GLU 160 HA GLU 160 3.494 -1.587 -10.106 1106 1HB GLU 160 2HB GLU 160 1.075 -1.388 -10.375 1107 2HB GLU 160 1HB GLU 160 1.614 -3.027 -10.698 1108 1HG GLU 160 2HG GLU 160 0.865 -3.633 -8.415 1109 2HG GLU 160 1HG GLU 160 0.209 -2.004 -8.251 1110 H VAL 161 H VAL 161 2.514 -2.187 -6.827 1111 HA VAL 161 HA VAL 161 2.012 0.571 -6.297 1112 HB VAL 161 HB VAL 161 2.395 -1.762 -4.396 1113 1HG1 VAL 161 1HG1 VAL 161 1.456 -0.292 -2.642 1114 2HG1 VAL 161 2HG1 VAL 161 1.445 1.052 -3.786 1115 3HG1 VAL 161 3HG1 VAL 161 2.976 0.349 -3.268 1116 1HG2 VAL 161 1HG2 VAL 161 0.396 -1.924 -5.764 1117 2HG2 VAL 161 2HG2 VAL 161 -0.086 -0.297 -5.287 1118 3HG2 VAL 161 3HG2 VAL 161 -0.040 -1.589 -4.088 1119 H SER 162 H SER 162 4.811 -1.593 -5.997 1120 HA SER 162 HA SER 162 6.401 0.041 -4.369 1121 1HB SER 162 2HB SER 162 7.211 -1.932 -6.496 1122 2HB SER 162 1HB SER 162 8.311 -1.201 -5.322 1123 HG SER 162 HG SER 162 6.071 -2.859 -4.802 1124 H LYS 163 H LYS 163 6.291 -0.150 -7.901 1125 HA LYS 163 HA LYS 163 8.186 1.900 -8.304 1126 1HB LYS 163 2HB LYS 163 7.387 1.964 -10.642 1127 2HB LYS 163 1HB LYS 163 7.673 0.322 -10.086 1128 1HG LYS 163 2HG LYS 163 5.278 0.002 -9.785 1129 2HG LYS 163 1HG LYS 163 4.985 1.665 -10.279 1130 1HD LYS 163 2HD LYS 163 4.542 0.165 -12.133 1131 2HD LYS 163 1HD LYS 163 5.957 1.152 -12.486 1132 1HE LYS 163 2HE LYS 163 7.423 -0.697 -11.905 1133 2HE LYS 163 1HE LYS 163 6.034 -1.690 -11.460 1134 1HZ LYS 163 1HZ LYS 163 6.617 -0.631 -14.180 1135 2HZ LYS 163 2HZ LYS 163 5.285 -1.554 -13.763 1136 3HZ LYS 163 3HZ LYS 163 6.821 -2.230 -13.707 1137 H GLU 164 H GLU 164 4.756 1.942 -7.771 1138 HA GLU 164 HA GLU 164 4.201 4.586 -8.631 1139 1HB GLU 164 2HB GLU 164 2.523 2.748 -8.283 1140 2HB GLU 164 1HB GLU 164 2.800 2.922 -6.554 1141 1HG GLU 164 2HG GLU 164 0.755 4.045 -7.232 1142 2HG GLU 164 1HG GLU 164 1.949 5.188 -6.617 1143 H ILE 165 H ILE 165 4.767 3.121 -5.449 1144 HA ILE 165 HA ILE 165 4.510 5.594 -4.130 1145 HB ILE 165 HB ILE 165 3.906 3.501 -3.013 1146 1HG1 ILE 165 2HG1 ILE 165 4.910 3.934 -0.817 1147 2HG1 ILE 165 1HG1 ILE 165 6.158 4.913 -1.587 1148 1HG2 ILE 165 1HG2 ILE 165 5.614 1.975 -2.092 1149 2HG2 ILE 165 2HG2 ILE 165 6.855 2.877 -2.965 1150 3HG2 ILE 165 3HG2 ILE 165 5.607 2.008 -3.856 1151 1HD1 ILE 165 1HD1 ILE 165 3.212 5.495 -1.623 1152 2HD1 ILE 165 2HD1 ILE 165 4.513 6.448 -2.354 1153 3HD1 ILE 165 3HD1 ILE 165 4.421 6.296 -0.596 1154 H ASP 166 H ASP 166 7.203 3.661 -5.070 1155 HA ASP 166 HA ASP 166 9.293 5.049 -3.809 1156 1HB ASP 166 2HB ASP 166 9.624 2.875 -4.833 1157 2HB ASP 166 1HB ASP 166 9.306 3.544 -6.421 1158 H GLU 167 H GLU 167 7.979 5.585 -7.072 1159 HA GLU 167 HA GLU 167 9.468 7.974 -7.751 1160 1HB GLU 167 2HB GLU 167 6.672 7.145 -8.557 1161 2HB GLU 167 1HB GLU 167 7.622 8.417 -9.296 1162 1HG GLU 167 2HG GLU 167 8.364 5.502 -9.300 1163 2HG GLU 167 1HG GLU 167 7.506 6.311 -10.602 1164 H HIS 168 H HIS 168 6.740 7.477 -5.716 1165 HA HIS 168 HA HIS 168 6.091 10.249 -5.689 1166 1HB HIS 168 2HB HIS 168 4.368 8.555 -5.215 1167 2HB HIS 168 1HB HIS 168 5.228 8.081 -3.759 1168 HD1 HIS 168 1HD HIS 168 3.130 10.877 -5.165 1169 HD2 HIS 168 2HD HIS 168 4.786 9.709 -1.543 1170 HE1 HIS 168 1HE HIS 168 2.104 12.359 -3.460 1171 HE2 HIS 168 2HE HIS 168 2.908 11.441 -1.267 1172 H LEU 169 H LEU 169 8.240 8.236 -3.692 1173 HA LEU 169 HA LEU 169 8.509 10.269 -1.694 1174 1HB LEU 169 2HB LEU 169 10.116 7.792 -2.247 1175 2HB LEU 169 1HB LEU 169 10.639 8.965 -1.066 1176 HG LEU 169 HG LEU 169 8.561 8.540 0.228 1177 1HD1 LEU 169 1HD1 LEU 169 7.222 6.588 -0.268 1178 2HD1 LEU 169 2HD1 LEU 169 8.109 6.357 -1.777 1179 3HD1 LEU 169 3HD1 LEU 169 7.114 7.794 -1.545 1180 1HD2 LEU 169 1HD2 LEU 169 9.213 6.346 1.040 1181 2HD2 LEU 169 2HD2 LEU 169 10.615 7.390 0.776 1182 3HD2 LEU 169 3HD2 LEU 169 10.222 6.127 -0.392 1183 H LEU 170 H LEU 170 10.416 9.277 -4.463 1184 HA LEU 170 HA LEU 170 12.418 11.305 -3.975 1185 1HB LEU 170 2HB LEU 170 11.903 9.617 -6.397 1186 2HB LEU 170 1HB LEU 170 13.314 10.620 -6.135 1187 HG LEU 170 HG LEU 170 12.521 8.232 -4.507 1188 1HD1 LEU 170 1HD1 LEU 170 13.286 7.641 -6.726 1189 2HD1 LEU 170 2HD1 LEU 170 14.536 7.246 -5.534 1190 3HD1 LEU 170 3HD1 LEU 170 14.692 8.687 -6.539 1191 1HD2 LEU 170 1HD2 LEU 170 14.777 8.495 -3.528 1192 2HD2 LEU 170 2HD2 LEU 170 13.692 9.828 -3.121 1193 3HD2 LEU 170 3HD2 LEU 170 14.936 10.029 -4.363 1194 H ALA 171 H ALA 171 9.701 10.810 -6.076 1195 HA ALA 171 HA ALA 171 8.598 11.991 -7.479 1196 1HB ALA 171 1HB ALA 171 9.497 14.361 -5.875 1197 2HB ALA 171 2HB ALA 171 8.151 13.267 -5.524 1198 3HB ALA 171 3HB ALA 171 8.103 14.277 -6.988 1199 H GLU 172 H GLU 172 9.965 11.257 -8.976 1200 HA GLU 172 HA GLU 172 11.432 13.341 -10.373 1201 1HB GLU 172 2HB GLU 172 13.050 11.574 -11.073 1202 2HB GLU 172 1HB GLU 172 13.103 11.987 -9.363 1203 1HG GLU 172 2HG GLU 172 11.930 9.989 -8.769 1204 2HG GLU 172 1HG GLU 172 11.619 9.618 -10.463 1205 H GLU 173 H GLU 173 11.519 12.921 -12.653 1206 HA GLU 173 HA GLU 173 10.160 10.813 -13.882 1207 1HB GLU 173 2HB GLU 173 8.262 12.249 -12.806 1208 2HB GLU 173 1HB GLU 173 8.663 13.449 -14.018 1209 1HG GLU 173 2HG GLU 173 7.813 10.633 -14.658 1210 2HG GLU 173 1HG GLU 173 6.696 11.972 -14.512 Start of MODEL 8 1 H THR 17 H THR 17 -17.628 -22.137 6.959 2 HA THR 17 HA THR 17 -17.767 -24.271 6.383 3 HB THR 17 HB THR 17 -17.665 -23.299 3.533 4 HG1 THR 17 1HG THR 17 -19.465 -23.060 5.498 5 1HG2 THR 17 1HG2 THR 17 -18.825 -25.423 3.008 6 2HG2 THR 17 2HG2 THR 17 -18.698 -25.904 4.700 7 3HG2 THR 17 3HG2 THR 17 -17.240 -25.725 3.723 8 H GLU 18 H GLU 18 -15.262 -22.719 4.419 9 HA GLU 18 HA GLU 18 -13.818 -25.120 4.029 10 1HB GLU 18 2HB GLU 18 -12.968 -22.265 3.617 11 2HB GLU 18 1HB GLU 18 -12.055 -23.676 3.107 12 1HG GLU 18 2HG GLU 18 -14.789 -22.868 2.150 13 2HG GLU 18 1HG GLU 18 -13.282 -22.789 1.238 14 H ALA 19 H ALA 19 -11.495 -25.324 4.570 15 HA ALA 19 HA ALA 19 -11.278 -25.468 7.388 16 1HB ALA 19 1HB ALA 19 -10.359 -27.198 5.911 17 2HB ALA 19 2HB ALA 19 -9.126 -26.524 6.980 18 3HB ALA 19 3HB ALA 19 -9.191 -26.036 5.285 19 H SER 20 H SER 20 -9.898 -24.468 8.773 20 HA SER 20 HA SER 20 -9.443 -21.744 8.316 21 1HB SER 20 2HB SER 20 -8.360 -23.534 10.489 22 2HB SER 20 1HB SER 20 -8.509 -21.779 10.543 23 HG SER 20 HG SER 20 -10.838 -22.394 9.945 24 H SER 21 H SER 21 -7.458 -24.565 7.903 25 HA SER 21 HA SER 21 -4.939 -23.387 8.037 26 1HB SER 21 2HB SER 21 -5.745 -25.886 6.578 27 2HB SER 21 1HB SER 21 -4.115 -25.384 7.058 28 HG SER 21 HG SER 21 -4.482 -25.908 9.052 29 H LEU 22 H LEU 22 -7.214 -22.736 5.695 30 HA LEU 22 HA LEU 22 -5.620 -22.611 3.314 31 1HB LEU 22 2HB LEU 22 -8.160 -21.228 4.131 32 2HB LEU 22 1HB LEU 22 -7.459 -21.074 2.539 33 HG LEU 22 HG LEU 22 -8.465 -23.646 3.757 34 1HD1 LEU 22 1HD1 LEU 22 -10.240 -23.432 2.121 35 2HD1 LEU 22 2HD1 LEU 22 -9.603 -21.875 1.600 36 3HD1 LEU 22 3HD1 LEU 22 -10.247 -22.065 3.233 37 1HD2 LEU 22 1HD2 LEU 22 -8.166 -24.529 1.478 38 2HD2 LEU 22 2HD2 LEU 22 -6.628 -24.034 2.189 39 3HD2 LEU 22 3HD2 LEU 22 -7.417 -23.011 0.994 40 H VAL 23 H VAL 23 -4.333 -21.399 5.557 41 HA VAL 23 HA VAL 23 -4.415 -18.565 5.378 42 HB VAL 23 HB VAL 23 -2.282 -20.330 6.576 43 1HG1 VAL 23 1HG1 VAL 23 -1.516 -18.020 6.261 44 2HG1 VAL 23 2HG1 VAL 23 -1.749 -18.359 7.970 45 3HG1 VAL 23 3HG1 VAL 23 -2.954 -17.426 7.087 46 1HG2 VAL 23 1HG2 VAL 23 -3.486 -19.977 8.702 47 2HG2 VAL 23 2HG2 VAL 23 -4.424 -20.863 7.493 48 3HG2 VAL 23 3HG2 VAL 23 -4.737 -19.136 7.770 49 H GLY 24 H GLY 24 -3.433 -17.396 4.060 50 1HA GLY 24 2HA GLY 24 -1.214 -18.473 2.461 51 2HA GLY 24 1HA GLY 24 -2.368 -17.280 1.858 52 H LYS 25 H LYS 25 0.687 -17.583 3.101 53 HA LYS 25 HA LYS 25 0.606 -14.823 3.948 54 1HB LYS 25 2HB LYS 25 0.801 -16.477 5.833 55 2HB LYS 25 1HB LYS 25 2.285 -17.044 5.066 56 1HG LYS 25 2HG LYS 25 3.059 -14.711 5.129 57 2HG LYS 25 1HG LYS 25 1.664 -14.383 6.183 58 1HD LYS 25 2HD LYS 25 3.669 -14.768 7.570 59 2HD LYS 25 1HD LYS 25 2.518 -16.095 7.774 60 1HE LYS 25 2HE LYS 25 3.731 -17.462 6.265 61 2HE LYS 25 1HE LYS 25 4.833 -16.148 5.851 62 1HZ LYS 25 1HZ LYS 25 5.872 -17.647 7.382 63 2HZ LYS 25 2HZ LYS 25 4.594 -17.565 8.467 64 3HZ LYS 25 3HZ LYS 25 5.592 -16.225 8.210 65 H LEU 26 H LEU 26 2.206 -13.679 2.945 66 HA LEU 26 HA LEU 26 4.363 -15.173 1.687 67 1HB LEU 26 2HB LEU 26 2.490 -14.943 0.044 68 2HB LEU 26 1HB LEU 26 2.583 -13.214 0.203 69 HG LEU 26 HG LEU 26 4.839 -14.892 -0.935 70 1HD1 LEU 26 1HD1 LEU 26 4.015 -14.223 -3.114 71 2HD1 LEU 26 2HD1 LEU 26 2.629 -13.425 -2.353 72 3HD1 LEU 26 3HD1 LEU 26 2.811 -15.181 -2.248 73 1HD2 LEU 26 1HD2 LEU 26 5.467 -12.625 -0.180 74 2HD2 LEU 26 2HD2 LEU 26 4.201 -11.948 -1.213 75 3HD2 LEU 26 3HD2 LEU 26 5.568 -12.802 -1.929 76 H GLU 27 H GLU 27 6.265 -13.999 1.539 77 HA GLU 27 HA GLU 27 6.216 -11.213 2.421 78 1HB GLU 27 2HB GLU 27 6.888 -12.755 4.291 79 2HB GLU 27 1HB GLU 27 8.191 -13.334 3.286 80 1HG GLU 27 2HG GLU 27 7.967 -10.476 4.240 81 2HG GLU 27 1HG GLU 27 8.818 -11.749 5.101 82 H THR 28 H THR 28 7.188 -9.994 0.984 83 HA THR 28 HA THR 28 9.316 -11.146 -0.596 84 HB THR 28 HB THR 28 7.257 -11.344 -2.032 85 HG1 THR 28 1HG THR 28 8.576 -11.040 -3.511 86 1HG2 THR 28 1HG2 THR 28 5.967 -9.456 -1.122 87 2HG2 THR 28 2HG2 THR 28 6.147 -9.308 -2.870 88 3HG2 THR 28 3HG2 THR 28 7.136 -8.318 -1.797 89 H ASP 29 H ASP 29 10.925 -9.762 -0.972 90 HA ASP 29 HA ASP 29 10.637 -7.132 0.252 91 1HB ASP 29 2HB ASP 29 13.111 -7.120 0.421 92 2HB ASP 29 1HB ASP 29 12.382 -8.461 1.284 93 H VAL 30 H VAL 30 10.390 -5.528 -1.016 94 HA VAL 30 HA VAL 30 11.514 -5.676 -3.718 95 HB VAL 30 HB VAL 30 9.236 -3.874 -2.738 96 1HG1 VAL 30 1HG1 VAL 30 10.545 -2.883 -4.545 97 2HG1 VAL 30 2HG1 VAL 30 8.925 -3.324 -5.065 98 3HG1 VAL 30 3HG1 VAL 30 10.298 -4.336 -5.523 99 1HG2 VAL 30 1HG2 VAL 30 9.153 -6.315 -4.497 100 2HG2 VAL 30 2HG2 VAL 30 7.783 -5.270 -4.111 101 3HG2 VAL 30 3HG2 VAL 30 8.557 -6.225 -2.837 102 H GLU 31 H GLU 31 12.744 -3.912 -4.410 103 HA GLU 31 HA GLU 31 13.875 -2.448 -2.153 104 1HB GLU 31 2HB GLU 31 14.990 -2.571 -4.937 105 2HB GLU 31 1HB GLU 31 15.731 -2.112 -3.399 106 1HG GLU 31 2HG GLU 31 15.671 -4.365 -2.615 107 2HG GLU 31 1HG GLU 31 14.832 -4.886 -4.077 108 H ILE 32 H ILE 32 13.660 -0.304 -2.011 109 HA ILE 32 HA ILE 32 12.507 1.037 -4.317 110 HB ILE 32 HB ILE 32 11.798 2.864 -2.837 111 1HG1 ILE 32 2HG1 ILE 32 12.800 1.158 -0.537 112 2HG1 ILE 32 1HG1 ILE 32 13.556 2.642 -1.099 113 1HG2 ILE 32 1HG2 ILE 32 10.220 1.086 -3.261 114 2HG2 ILE 32 2HG2 ILE 32 10.007 1.698 -1.623 115 3HG2 ILE 32 3HG2 ILE 32 10.843 0.170 -1.890 116 1HD1 ILE 32 1HD1 ILE 32 12.228 3.049 0.903 117 2HD1 ILE 32 2HD1 ILE 32 10.793 2.416 0.102 118 3HD1 ILE 32 3HD1 ILE 32 11.543 3.901 -0.473 119 H LYS 33 H LYS 33 13.284 3.304 -4.560 120 HA LYS 33 HA LYS 33 16.203 3.172 -4.447 121 1HB LYS 33 2HB LYS 33 14.392 4.731 -6.301 122 2HB LYS 33 1HB LYS 33 16.149 4.615 -6.419 123 1HG LYS 33 2HG LYS 33 15.992 2.221 -6.817 124 2HG LYS 33 1HG LYS 33 14.244 2.292 -6.648 125 1HD LYS 33 2HD LYS 33 14.178 3.803 -8.619 126 2HD LYS 33 1HD LYS 33 15.921 3.577 -8.798 127 1HE LYS 33 2HE LYS 33 15.574 1.153 -9.036 128 2HE LYS 33 1HE LYS 33 13.841 1.398 -8.871 129 1HZ LYS 33 1HZ LYS 33 14.476 1.170 -11.175 130 2HZ LYS 33 2HZ LYS 33 15.538 2.460 -11.056 131 3HZ LYS 33 3HZ LYS 33 13.877 2.714 -10.908 132 H ALA 34 H ALA 34 13.414 4.811 -3.424 133 HA ALA 34 HA ALA 34 14.675 7.240 -2.624 134 1HB ALA 34 1HB ALA 34 12.079 5.982 -1.737 135 2HB ALA 34 2HB ALA 34 12.271 7.127 -3.062 136 3HB ALA 34 3HB ALA 34 12.586 7.639 -1.403 137 H SER 35 H SER 35 14.625 7.828 -0.222 138 HA SER 35 HA SER 35 15.954 5.670 1.211 139 1HB SER 35 2HB SER 35 15.761 8.621 1.837 140 2HB SER 35 1HB SER 35 16.776 7.442 2.678 141 HG SER 35 HG SER 35 16.949 7.724 -0.096 142 H ALA 36 H ALA 36 15.188 4.815 3.085 143 HA ALA 36 HA ALA 36 12.500 4.718 3.645 144 1HB ALA 36 1HB ALA 36 14.161 3.051 4.360 145 2HB ALA 36 2HB ALA 36 13.117 3.574 5.681 146 3HB ALA 36 3HB ALA 36 14.763 4.189 5.565 147 H ASP 37 H ASP 37 14.921 6.892 4.907 148 HA ASP 37 HA ASP 37 13.432 7.887 7.045 149 1HB ASP 37 2HB ASP 37 15.823 8.357 6.866 150 2HB ASP 37 1HB ASP 37 15.527 9.393 5.471 151 H LYS 38 H LYS 38 13.158 8.625 3.653 152 HA LYS 38 HA LYS 38 11.686 11.003 4.078 153 1HB LYS 38 2HB LYS 38 11.694 9.228 1.662 154 2HB LYS 38 1HB LYS 38 10.968 10.830 1.753 155 1HG LYS 38 2HG LYS 38 13.268 11.655 2.440 156 2HG LYS 38 1HG LYS 38 13.864 10.082 1.912 157 1HD LYS 38 2HD LYS 38 14.126 11.591 0.113 158 2HD LYS 38 1HD LYS 38 12.770 10.504 -0.265 159 1HE LYS 38 2HE LYS 38 11.175 12.237 0.399 160 2HE LYS 38 1HE LYS 38 12.507 13.293 0.857 161 1HZ LYS 38 1HZ LYS 38 11.843 12.339 -1.857 162 2HZ LYS 38 2HZ LYS 38 13.191 13.277 -1.500 163 3HZ LYS 38 3HZ LYS 38 11.629 13.904 -1.275 164 H PHE 39 H PHE 39 10.855 7.642 3.992 165 HA PHE 39 HA PHE 39 8.019 7.942 3.872 166 1HB PHE 39 2HB PHE 39 9.336 5.788 3.461 167 2HB PHE 39 1HB PHE 39 9.638 5.727 5.186 168 HD1 PHE 39 1HD PHE 39 7.378 4.976 2.536 169 HD2 PHE 39 2HD PHE 39 7.660 5.446 6.747 170 HE1 PHE 39 1HE PHE 39 5.264 3.727 2.815 171 HE2 PHE 39 2HE PHE 39 5.557 4.194 7.040 172 HZ PHE 39 HZ PHE 39 4.361 3.338 5.073 173 H HIS 40 H HIS 40 10.450 7.663 6.318 174 HA HIS 40 HA HIS 40 9.014 7.833 8.682 175 1HB HIS 40 2HB HIS 40 11.346 7.186 8.614 176 2HB HIS 40 1HB HIS 40 11.796 8.734 7.937 177 HD1 HIS 40 1HD HIS 40 13.329 9.629 9.641 178 HD2 HIS 40 2HD HIS 40 9.851 8.114 11.331 179 HE1 HIS 40 1HE HIS 40 13.488 10.139 12.090 180 HE2 HIS 40 2HE HIS 40 11.547 8.910 13.092 181 H HIS 41 H HIS 41 9.881 10.384 6.439 182 HA HIS 41 HA HIS 41 9.074 12.539 8.190 183 1HB HIS 41 2HB HIS 41 9.697 12.575 5.237 184 2HB HIS 41 1HB HIS 41 9.139 13.993 6.105 185 HD1 HIS 41 1HD HIS 41 10.870 15.193 7.613 186 HD2 HIS 41 2HD HIS 41 12.335 11.793 5.767 187 HE1 HIS 41 1HE HIS 41 13.353 15.291 7.885 188 HE2 HIS 41 2HE HIS 41 14.082 12.990 7.118 189 H MET 42 H MET 42 7.394 10.524 5.975 190 HA MET 42 HA MET 42 5.462 12.255 4.908 191 1HB MET 42 2HB MET 42 5.217 9.309 5.379 192 2HB MET 42 1HB MET 42 4.108 10.263 4.424 193 1HG MET 42 2HG MET 42 7.029 9.814 3.813 194 2HG MET 42 1HG MET 42 5.696 8.953 3.069 195 1HE MET 42 1HE MET 42 6.636 12.962 3.687 196 2HE MET 42 2HE MET 42 7.171 13.205 2.038 197 3HE MET 42 3HE MET 42 8.010 12.048 3.040 198 H PHE 43 H PHE 43 5.352 11.017 8.156 199 HA PHE 43 HA PHE 43 2.494 11.638 8.189 200 1HB PHE 43 2HB PHE 43 3.179 9.449 9.125 201 2HB PHE 43 1HB PHE 43 4.187 10.278 10.297 202 HD1 PHE 43 1HD PHE 43 0.683 9.798 9.217 203 HD2 PHE 43 2HD PHE 43 3.308 11.005 12.344 204 HE1 PHE 43 1HE PHE 43 -1.217 9.883 10.778 205 HE2 PHE 43 2HE PHE 43 1.422 11.084 13.901 206 HZ PHE 43 HZ PHE 43 -0.848 10.526 13.120 207 H ALA 44 H ALA 44 5.478 12.945 9.020 208 HA ALA 44 HA ALA 44 4.750 14.472 11.259 209 1HB ALA 44 1HB ALA 44 7.074 13.867 10.812 210 2HB ALA 44 2HB ALA 44 6.878 15.615 10.923 211 3HB ALA 44 3HB ALA 44 7.048 14.848 9.346 212 H GLY 45 H GLY 45 3.255 15.775 11.080 213 1HA GLY 45 2HA GLY 45 2.588 17.326 8.763 214 2HA GLY 45 1HA GLY 45 1.856 17.496 10.354 215 H LYS 46 H LYS 46 4.877 18.105 8.705 216 HA LYS 46 HA LYS 46 5.309 20.491 10.308 217 1HB LYS 46 2HB LYS 46 7.020 19.114 8.229 218 2HB LYS 46 1HB LYS 46 7.450 20.646 8.966 219 1HG LYS 46 2HG LYS 46 7.100 18.026 10.420 220 2HG LYS 46 1HG LYS 46 8.638 18.787 10.005 221 1HD LYS 46 2HD LYS 46 7.927 20.775 11.364 222 2HD LYS 46 1HD LYS 46 6.519 19.850 11.872 223 1HE LYS 46 2HE LYS 46 8.225 19.725 13.572 224 2HE LYS 46 1HE LYS 46 8.012 18.143 12.832 225 1HZ LYS 46 1HZ LYS 46 10.002 18.464 11.549 226 2HZ LYS 46 2HZ LYS 46 10.352 18.738 13.160 227 3HZ LYS 46 3HZ LYS 46 10.203 20.039 12.101 228 HA PRO 47 HA PRO 47 3.609 23.457 7.550 229 1HB PRO 47 2HB PRO 47 6.301 24.736 7.625 230 2HB PRO 47 1HB PRO 47 4.704 25.456 7.870 231 1HG PRO 47 2HG PRO 47 6.264 24.957 9.937 232 2HG PRO 47 1HG PRO 47 4.519 24.646 10.026 233 1HD PRO 47 2HD PRO 47 6.774 22.721 9.750 234 2HD PRO 47 1HD PRO 47 5.227 22.541 10.600 235 H HIS 48 H HIS 48 3.295 22.827 5.548 236 HA HIS 48 HA HIS 48 5.447 22.011 3.854 237 1HB HIS 48 2HB HIS 48 2.503 22.431 3.213 238 2HB HIS 48 1HB HIS 48 3.681 21.748 2.097 239 HD1 HIS 48 1HD HIS 48 1.052 20.567 4.158 240 HD2 HIS 48 2HD HIS 48 5.022 19.377 3.630 241 HE1 HIS 48 1HE HIS 48 1.176 18.217 4.951 242 HE2 HIS 48 2HE HIS 48 3.506 17.455 4.442 243 H HIS 49 H HIS 49 6.758 23.445 3.246 244 HA HIS 49 HA HIS 49 6.333 26.180 3.180 245 1HB HIS 49 2HB HIS 49 8.531 26.343 1.919 246 2HB HIS 49 1HB HIS 49 8.559 25.575 3.500 247 HD1 HIS 49 1HD HIS 49 10.013 23.622 3.504 248 HD2 HIS 49 2HD HIS 49 8.174 24.214 -0.138 249 HE1 HIS 49 1HE HIS 49 10.929 21.806 2.031 250 HE2 HIS 49 2HE HIS 49 9.786 22.097 -0.172 251 H VAL 50 H VAL 50 7.084 27.613 1.331 252 HA VAL 50 HA VAL 50 6.500 28.726 -0.478 253 HB VAL 50 HB VAL 50 5.072 26.223 -1.485 254 1HG1 VAL 50 1HG1 VAL 50 5.005 27.345 -3.676 255 2HG1 VAL 50 2HG1 VAL 50 5.703 28.792 -2.954 256 3HG1 VAL 50 3HG1 VAL 50 4.101 28.246 -2.461 257 1HG2 VAL 50 1HG2 VAL 50 6.965 26.004 -3.041 258 2HG2 VAL 50 2HG2 VAL 50 7.497 25.930 -1.360 259 3HG2 VAL 50 3HG2 VAL 50 7.732 27.406 -2.295 260 H SER 51 H SER 51 5.423 30.171 0.540 261 HA SER 51 HA SER 51 2.550 29.811 0.894 262 1HB SER 51 2HB SER 51 3.676 29.502 3.044 263 2HB SER 51 1HB SER 51 4.560 31.004 2.821 264 HG SER 51 HG SER 51 1.755 30.775 2.938 265 H LYS 52 H LYS 52 1.445 31.923 0.938 266 HA LYS 52 HA LYS 52 2.997 34.118 -0.176 267 1HB LYS 52 2HB LYS 52 1.941 32.936 -2.031 268 2HB LYS 52 1HB LYS 52 0.368 33.103 -1.270 269 1HG LYS 52 2HG LYS 52 0.439 35.489 -1.523 270 2HG LYS 52 1HG LYS 52 2.087 35.409 -2.138 271 1HD LYS 52 2HD LYS 52 -0.322 34.173 -3.422 272 2HD LYS 52 1HD LYS 52 0.436 35.698 -3.927 273 1HE LYS 52 2HE LYS 52 2.539 34.417 -4.288 274 2HE LYS 52 1HE LYS 52 1.651 32.934 -3.967 275 1HZ LYS 52 1HZ LYS 52 0.199 33.475 -5.850 276 2HZ LYS 52 2HZ LYS 52 1.811 33.278 -6.298 277 3HZ LYS 52 3HZ LYS 52 1.158 34.832 -6.191 278 H ALA 53 H ALA 53 2.119 36.153 0.270 279 HA ALA 53 HA ALA 53 0.941 36.397 2.821 280 1HB ALA 53 1HB ALA 53 1.177 38.523 0.687 281 2HB ALA 53 2HB ALA 53 2.417 38.122 1.871 282 3HB ALA 53 3HB ALA 53 0.882 38.806 2.404 283 H SER 54 H SER 54 -0.988 35.459 3.051 284 HA SER 54 HA SER 54 -3.346 36.696 2.140 285 1HB SER 54 2HB SER 54 -4.132 34.674 0.849 286 2HB SER 54 1HB SER 54 -2.806 35.524 0.057 287 HG SER 54 HG SER 54 -1.449 33.903 1.285 288 HA PRO 55 HA PRO 55 -4.859 34.330 5.702 289 1HB PRO 55 2HB PRO 55 -6.871 32.922 4.004 290 2HB PRO 55 1HB PRO 55 -7.114 33.855 5.487 291 1HG PRO 55 2HG PRO 55 -7.814 34.887 3.145 292 2HG PRO 55 1HG PRO 55 -7.031 35.895 4.375 293 1HD PRO 55 2HD PRO 55 -5.859 34.657 1.921 294 2HD PRO 55 1HD PRO 55 -5.592 36.276 2.602 295 H GLY 56 H GLY 56 -3.480 32.848 6.330 296 1HA GLY 56 2HA GLY 56 -3.077 30.470 6.593 297 2HA GLY 56 1HA GLY 56 -3.320 30.307 4.854 298 H ASN 57 H ASN 57 -1.338 32.286 7.034 299 HA ASN 57 HA ASN 57 0.829 32.341 5.143 300 1HB ASN 57 2HB ASN 57 0.766 33.236 8.039 301 2HB ASN 57 1HB ASN 57 2.148 33.435 6.978 302 1HD2 ASN 57 1HD2 ASN 57 1.990 34.936 5.268 303 2HD2 ASN 57 2HD2 ASN 57 0.825 36.210 5.309 304 H ILE 58 H ILE 58 2.699 31.211 5.151 305 HA ILE 58 HA ILE 58 4.108 29.556 5.414 306 HB ILE 58 HB ILE 58 3.076 29.503 8.254 307 1HG1 ILE 58 2HG1 ILE 58 4.214 31.558 7.545 308 2HG1 ILE 58 1HG1 ILE 58 5.138 30.714 8.769 309 1HG2 ILE 58 1HG2 ILE 58 5.045 28.156 8.824 310 2HG2 ILE 58 2HG2 ILE 58 5.478 28.069 7.114 311 3HG2 ILE 58 3HG2 ILE 58 3.987 27.317 7.691 312 1HD1 ILE 58 1HD1 ILE 58 6.600 31.592 7.063 313 2HD1 ILE 58 2HD1 ILE 58 5.691 30.770 5.803 314 3HD1 ILE 58 3HD1 ILE 58 6.610 29.833 6.985 315 H GLN 59 H GLN 59 1.162 28.570 7.061 316 HA GLN 59 HA GLN 59 1.252 26.041 5.592 317 1HB GLN 59 2HB GLN 59 -0.683 26.990 7.718 318 2HB GLN 59 1HB GLN 59 -0.684 25.403 6.976 319 1HG GLN 59 2HG GLN 59 1.478 24.921 7.970 320 2HG GLN 59 1HG GLN 59 1.516 26.534 8.681 321 1HE2 GLN 59 1HE2 GLN 59 1.534 23.889 9.955 322 2HE2 GLN 59 2HE2 GLN 59 0.192 23.894 11.025 323 H GLY 60 H GLY 60 0.726 26.703 3.538 324 1HA GLY 60 2HA GLY 60 -1.400 28.516 2.990 325 2HA GLY 60 1HA GLY 60 -0.554 27.509 1.820 326 H CYS 61 H CYS 61 -1.190 25.284 1.634 327 HA CYS 61 HA CYS 61 -3.487 24.274 2.929 328 1HB CYS 61 2HB CYS 61 -4.655 25.891 1.509 329 2HB CYS 61 1HB CYS 61 -3.860 25.232 0.090 330 HG CYS 61 HG CYS 61 -6.274 23.781 1.999 331 H ASP 62 H ASP 62 -3.457 22.149 2.773 332 HA ASP 62 HA ASP 62 -2.611 20.906 0.343 333 1HB ASP 62 2HB ASP 62 -1.164 19.234 1.450 334 2HB ASP 62 1HB ASP 62 -0.511 20.844 1.656 335 H LEU 63 H LEU 63 -3.704 19.107 -0.067 336 HA LEU 63 HA LEU 63 -5.343 17.807 1.881 337 1HB LEU 63 2HB LEU 63 -6.610 19.929 1.346 338 2HB LEU 63 1HB LEU 63 -6.616 19.465 -0.334 339 HG LEU 63 HG LEU 63 -8.052 17.929 1.860 340 1HD1 LEU 63 1HD1 LEU 63 -10.086 18.979 0.999 341 2HD1 LEU 63 2HD1 LEU 63 -9.121 19.949 -0.110 342 3HD1 LEU 63 3HD1 LEU 63 -8.964 20.182 1.632 343 1HD2 LEU 63 1HD2 LEU 63 -7.569 16.588 -0.155 344 2HD2 LEU 63 2HD2 LEU 63 -8.329 17.828 -1.153 345 3HD2 LEU 63 3HD2 LEU 63 -9.293 16.914 0.007 346 H HIS 64 H HIS 64 -5.100 15.772 1.224 347 HA HIS 64 HA HIS 64 -4.699 15.330 -1.654 348 1HB HIS 64 2HB HIS 64 -2.772 14.649 -0.266 349 2HB HIS 64 1HB HIS 64 -3.814 13.554 0.634 350 HD1 HIS 64 1HD HIS 64 -3.531 11.214 -0.085 351 HD2 HIS 64 2HD HIS 64 -2.899 13.852 -3.236 352 HE1 HIS 64 1HE HIS 64 -2.952 9.787 -2.069 353 HE2 HIS 64 2HE HIS 64 -2.364 11.428 -3.885 354 H GLU 65 H GLU 65 -6.781 14.692 0.945 355 HA GLU 65 HA GLU 65 -8.741 13.665 1.175 356 1HB GLU 65 2HB GLU 65 -9.412 14.738 -0.908 357 2HB GLU 65 1HB GLU 65 -8.694 13.434 -1.840 358 1HG GLU 65 2HG GLU 65 -10.313 11.866 -0.895 359 2HG GLU 65 1HG GLU 65 -11.032 13.177 0.035 360 H GLY 66 H GLY 66 -8.702 11.918 2.249 361 1HA GLY 66 2HA GLY 66 -9.140 9.496 2.068 362 2HA GLY 66 1HA GLY 66 -7.797 9.440 0.930 363 H ASP 67 H ASP 67 -6.210 11.300 2.352 364 HA ASP 67 HA ASP 67 -5.097 9.574 4.376 365 1HB ASP 67 2HB ASP 67 -4.266 12.336 3.442 366 2HB ASP 67 1HB ASP 67 -3.359 11.342 4.569 367 H TRP 68 H TRP 68 -6.320 9.574 6.169 368 HA TRP 68 HA TRP 68 -7.329 12.122 7.149 369 1HB TRP 68 2HB TRP 68 -7.860 9.301 8.111 370 2HB TRP 68 1HB TRP 68 -8.587 10.748 8.801 371 HD1 TRP 68 HD TRP 68 -8.818 8.427 5.777 372 HE1 TRP 68 1HE TRP 68 -10.949 8.999 4.438 373 HE3 TRP 68 3HE TRP 68 -10.195 12.708 8.216 374 HZ2 TRP 68 2HZ TRP 68 -12.936 10.984 4.419 375 HZ3 TRP 68 3HZ TRP 68 -12.226 13.879 7.472 376 HH2 TRP 68 HH TRP 68 -13.565 13.035 5.613 377 H GLY 69 H GLY 69 -4.708 10.015 7.611 378 1HA GLY 69 2HA GLY 69 -2.850 10.294 8.936 379 2HA GLY 69 1HA GLY 69 -3.607 11.712 9.647 380 H THR 70 H THR 70 -5.561 8.957 9.704 381 HA THR 70 HA THR 70 -4.775 8.318 12.433 382 HB THR 70 HB THR 70 -7.237 8.197 12.986 383 HG1 THR 70 1HG THR 70 -8.285 9.862 11.341 384 1HG2 THR 70 1HG2 THR 70 -7.532 10.628 13.289 385 2HG2 THR 70 2HG2 THR 70 -6.218 10.928 12.154 386 3HG2 THR 70 3HG2 THR 70 -5.885 10.138 13.692 387 H VAL 71 H VAL 71 -5.708 6.243 13.125 388 HA VAL 71 HA VAL 71 -5.584 4.216 11.160 389 HB VAL 71 HB VAL 71 -6.727 4.118 13.976 390 1HG1 VAL 71 1HG1 VAL 71 -5.895 1.847 12.166 391 2HG1 VAL 71 2HG1 VAL 71 -7.547 2.251 12.635 392 3HG1 VAL 71 3HG1 VAL 71 -6.400 1.681 13.849 393 1HG2 VAL 71 1HG2 VAL 71 -4.570 3.119 14.603 394 2HG2 VAL 71 2HG2 VAL 71 -4.378 4.755 13.972 395 3HG2 VAL 71 3HG2 VAL 71 -3.988 3.364 12.958 396 H GLY 72 H GLY 72 -7.204 3.221 10.037 397 1HA GLY 72 2HA GLY 72 -9.475 2.749 9.524 398 2HA GLY 72 1HA GLY 72 -9.938 4.133 10.513 399 H SER 73 H SER 73 -7.394 5.185 8.863 400 HA SER 73 HA SER 73 -8.820 6.882 7.147 401 1HB SER 73 2HB SER 73 -6.579 7.370 8.106 402 2HB SER 73 1HB SER 73 -5.896 6.101 7.107 403 HG SER 73 HG SER 73 -6.848 7.488 5.271 404 H ILE 74 H ILE 74 -9.469 6.593 5.073 405 HA ILE 74 HA ILE 74 -8.468 4.261 3.649 406 HB ILE 74 HB ILE 74 -11.316 5.263 3.775 407 1HG1 ILE 74 2HG1 ILE 74 -10.067 2.599 4.394 408 2HG1 ILE 74 1HG1 ILE 74 -10.494 3.796 5.602 409 1HG2 ILE 74 1HG2 ILE 74 -11.866 3.507 2.138 410 2HG2 ILE 74 2HG2 ILE 74 -10.151 3.127 1.970 411 3HG2 ILE 74 3HG2 ILE 74 -10.760 4.693 1.445 412 1HD1 ILE 74 1HD1 ILE 74 -12.352 2.372 3.731 413 2HD1 ILE 74 2HD1 ILE 74 -12.844 3.558 4.943 414 3HD1 ILE 74 3HD1 ILE 74 -12.137 2.010 5.450 415 H VAL 75 H VAL 75 -7.539 4.763 1.861 416 HA VAL 75 HA VAL 75 -8.298 7.121 0.325 417 HB VAL 75 HB VAL 75 -6.327 7.730 1.720 418 1HG1 VAL 75 1HG1 VAL 75 -5.391 5.572 2.130 419 2HG1 VAL 75 2HG1 VAL 75 -4.167 6.625 1.416 420 3HG1 VAL 75 3HG1 VAL 75 -4.958 5.395 0.430 421 1HG2 VAL 75 1HG2 VAL 75 -5.588 7.369 -1.190 422 2HG2 VAL 75 2HG2 VAL 75 -4.767 8.443 -0.057 423 3HG2 VAL 75 3HG2 VAL 75 -6.445 8.745 -0.499 424 H PHE 76 H PHE 76 -7.584 6.808 -1.986 425 HA PHE 76 HA PHE 76 -7.059 3.990 -2.517 426 1HB PHE 76 2HB PHE 76 -9.020 5.741 -4.012 427 2HB PHE 76 1HB PHE 76 -8.542 4.117 -4.500 428 HD1 PHE 76 1HD PHE 76 -8.795 2.310 -2.642 429 HD2 PHE 76 2HD PHE 76 -10.942 5.969 -2.738 430 HE1 PHE 76 1HE PHE 76 -10.481 1.325 -1.198 431 HE2 PHE 76 2HE PHE 76 -12.672 4.997 -1.286 432 HZ PHE 76 HZ PHE 76 -12.450 2.661 -0.507 433 H TRP 77 H TRP 77 -5.423 3.596 -3.823 434 HA TRP 77 HA TRP 77 -4.314 5.876 -5.255 435 1HB TRP 77 2HB TRP 77 -2.914 4.721 -3.481 436 2HB TRP 77 1HB TRP 77 -2.964 3.276 -4.477 437 HD1 TRP 77 HD TRP 77 -1.791 3.519 -6.916 438 HE1 TRP 77 1HE TRP 77 0.305 4.903 -7.638 439 HE3 TRP 77 3HE TRP 77 -1.629 6.759 -3.014 440 HZ2 TRP 77 2HZ TRP 77 1.807 7.067 -6.612 441 HZ3 TRP 77 3HZ TRP 77 0.155 8.449 -2.932 442 HH2 TRP 77 HH TRP 77 1.833 8.598 -4.694 443 H ASN 78 H ASN 78 -3.917 5.615 -7.413 444 HA ASN 78 HA ASN 78 -5.081 3.218 -8.654 445 1HB ASN 78 2HB ASN 78 -4.794 6.013 -9.786 446 2HB ASN 78 1HB ASN 78 -5.415 4.625 -10.669 447 1HD2 ASN 78 1HD2 ASN 78 -7.455 3.839 -10.171 448 2HD2 ASN 78 2HD2 ASN 78 -8.580 4.757 -9.240 449 H TYR 79 H TYR 79 -3.797 2.017 -9.865 450 HA TYR 79 HA TYR 79 -1.271 3.196 -10.688 451 1HB TYR 79 2HB TYR 79 -0.091 1.045 -10.244 452 2HB TYR 79 1HB TYR 79 -0.722 1.780 -8.783 453 HD1 TYR 79 1HD TYR 79 -0.830 -1.105 -10.988 454 HD2 TYR 79 2HD TYR 79 -2.675 0.736 -7.628 455 HE1 TYR 79 1HE TYR 79 -1.898 -3.248 -10.405 456 HE2 TYR 79 2HE TYR 79 -3.751 -1.397 -7.040 457 HH TYR 79 HH TYR 79 -2.856 -4.364 -8.482 458 H VAL 80 H VAL 80 -0.469 2.449 -12.672 459 HA VAL 80 HA VAL 80 -2.640 1.297 -14.272 460 HB VAL 80 HB VAL 80 -0.270 2.956 -15.186 461 1HG1 VAL 80 1HG1 VAL 80 -1.430 3.059 -17.349 462 2HG1 VAL 80 2HG1 VAL 80 -2.670 1.968 -16.728 463 3HG1 VAL 80 3HG1 VAL 80 -1.014 1.400 -16.917 464 1HG2 VAL 80 1HG2 VAL 80 -1.926 4.713 -15.593 465 2HG2 VAL 80 2HG2 VAL 80 -1.872 4.251 -13.889 466 3HG2 VAL 80 3HG2 VAL 80 -3.183 3.674 -14.916 467 H HIS 81 H HIS 81 -2.451 -0.666 -14.841 468 HA HIS 81 HA HIS 81 0.188 -1.807 -15.393 469 1HB HIS 81 2HB HIS 81 -0.598 -2.388 -13.062 470 2HB HIS 81 1HB HIS 81 -2.002 -3.155 -13.783 471 HD1 HIS 81 1HD HIS 81 1.730 -3.468 -13.674 472 HD2 HIS 81 2HD HIS 81 -1.623 -5.751 -14.436 473 HE1 HIS 81 1HE HIS 81 2.581 -5.847 -13.925 474 HE2 HIS 81 2HE HIS 81 0.553 -7.136 -14.656 475 H ASP 82 H ASP 82 0.172 -2.763 -17.328 476 HA ASP 82 HA ASP 82 -0.480 -3.533 -19.361 477 1HB ASP 82 2HB ASP 82 -2.877 -4.537 -17.801 478 2HB ASP 82 1HB ASP 82 -2.659 -4.848 -19.517 479 H GLY 83 H GLY 83 -1.127 -0.876 -18.493 480 1HA GLY 83 2HA GLY 83 -1.941 0.929 -19.701 481 2HA GLY 83 1HA GLY 83 -2.818 -0.191 -20.732 482 H GLU 84 H GLU 84 -3.810 -1.267 -17.912 483 HA GLU 84 HA GLU 84 -6.126 0.521 -17.902 484 1HB GLU 84 2HB GLU 84 -5.741 -2.136 -16.543 485 2HB GLU 84 1HB GLU 84 -7.203 -1.169 -16.519 486 1HG GLU 84 2HG GLU 84 -7.392 -1.438 -18.929 487 2HG GLU 84 1HG GLU 84 -5.929 -2.427 -18.884 488 H ALA 85 H ALA 85 -6.903 1.325 -16.040 489 HA ALA 85 HA ALA 85 -4.867 1.839 -14.016 490 1HB ALA 85 1HB ALA 85 -7.597 3.086 -14.365 491 2HB ALA 85 2HB ALA 85 -6.067 3.780 -14.910 492 3HB ALA 85 3HB ALA 85 -6.386 3.583 -13.186 493 H LYS 86 H LYS 86 -4.788 0.565 -12.368 494 HA LYS 86 HA LYS 86 -7.147 -0.891 -11.613 495 1HB LYS 86 2HB LYS 86 -4.243 -1.271 -10.936 496 2HB LYS 86 1HB LYS 86 -5.499 -2.084 -10.029 497 1HG LYS 86 2HG LYS 86 -4.532 -3.532 -11.715 498 2HG LYS 86 1HG LYS 86 -6.235 -3.227 -12.080 499 1HD LYS 86 2HD LYS 86 -5.489 -1.568 -13.739 500 2HD LYS 86 1HD LYS 86 -3.817 -1.968 -13.355 501 1HE LYS 86 2HE LYS 86 -4.483 -3.167 -15.314 502 2HE LYS 86 1HE LYS 86 -4.255 -4.282 -13.955 503 1HZ LYS 86 1HZ LYS 86 -6.876 -3.304 -14.971 504 2HZ LYS 86 2HZ LYS 86 -6.647 -4.319 -13.657 505 3HZ LYS 86 3HZ LYS 86 -6.246 -4.860 -15.189 506 H VAL 87 H VAL 87 -7.677 -0.942 -9.279 507 HA VAL 87 HA VAL 87 -6.916 1.573 -7.965 508 HB VAL 87 HB VAL 87 -9.517 0.037 -7.689 509 1HG1 VAL 87 1HG1 VAL 87 -8.743 2.742 -6.594 510 2HG1 VAL 87 2HG1 VAL 87 -8.938 1.257 -5.662 511 3HG1 VAL 87 3HG1 VAL 87 -10.334 1.987 -6.452 512 1HG2 VAL 87 1HG2 VAL 87 -8.938 2.597 -9.165 513 2HG2 VAL 87 2HG2 VAL 87 -10.544 1.928 -8.897 514 3HG2 VAL 87 3HG2 VAL 87 -9.375 1.050 -9.885 515 H ALA 88 H ALA 88 -6.298 1.459 -5.863 516 HA ALA 88 HA ALA 88 -6.008 -1.222 -4.740 517 1HB ALA 88 1HB ALA 88 -3.915 0.020 -5.106 518 2HB ALA 88 2HB ALA 88 -4.213 -0.235 -3.385 519 3HB ALA 88 3HB ALA 88 -4.534 1.338 -4.115 520 H LYS 89 H LYS 89 -7.305 -1.695 -3.151 521 HA LYS 89 HA LYS 89 -8.699 0.435 -1.786 522 1HB LYS 89 2HB LYS 89 -10.263 -1.338 -0.958 523 2HB LYS 89 1HB LYS 89 -10.338 -1.169 -2.676 524 1HG LYS 89 2HG LYS 89 -8.562 -3.309 -1.598 525 2HG LYS 89 1HG LYS 89 -10.290 -3.526 -1.386 526 1HD LYS 89 2HD LYS 89 -9.661 -4.681 -3.401 527 2HD LYS 89 1HD LYS 89 -10.546 -3.253 -3.883 528 1HE LYS 89 2HE LYS 89 -8.425 -2.139 -4.421 529 2HE LYS 89 1HE LYS 89 -7.541 -3.584 -3.923 530 1HZ LYS 89 1HZ LYS 89 -9.403 -3.299 -6.216 531 2HZ LYS 89 2HZ LYS 89 -8.750 -4.786 -5.790 532 3HZ LYS 89 3HZ LYS 89 -7.761 -3.513 -6.305 533 H GLU 90 H GLU 90 -8.222 0.915 0.296 534 HA GLU 90 HA GLU 90 -6.725 -0.975 1.830 535 1HB GLU 90 2HB GLU 90 -4.839 0.568 2.110 536 2HB GLU 90 1HB GLU 90 -4.988 -0.009 0.453 537 1HG GLU 90 2HG GLU 90 -6.108 2.088 -0.150 538 2HG GLU 90 1HG GLU 90 -5.904 2.660 1.491 539 H ARG 91 H ARG 91 -6.621 -0.428 3.901 540 HA ARG 91 HA ARG 91 -7.791 2.034 4.901 541 1HB ARG 91 2HB ARG 91 -9.597 0.559 5.185 542 2HB ARG 91 1HB ARG 91 -8.556 -0.786 5.628 543 1HG ARG 91 2HG ARG 91 -8.085 0.284 7.772 544 2HG ARG 91 1HG ARG 91 -9.085 1.661 7.313 545 1HD ARG 91 2HD ARG 91 -11.055 0.410 7.404 546 2HD ARG 91 1HD ARG 91 -10.204 -1.130 7.349 547 HE ARG 91 HE ARG 91 -9.263 -0.212 9.585 548 1HH1 ARG 91 1HH1 ARG 91 -12.640 -0.101 8.483 549 2HH1 ARG 91 2HH1 ARG 91 -13.300 -0.201 10.046 550 1HH2 ARG 91 1HH2 ARG 91 -10.184 -0.335 11.713 551 2HH2 ARG 91 2HH2 ARG 91 -11.866 -0.330 11.936 552 H ILE 92 H ILE 92 -6.591 2.872 6.454 553 HA ILE 92 HA ILE 92 -4.092 1.624 7.123 554 HB ILE 92 HB ILE 92 -5.431 4.071 8.303 555 1HG1 ILE 92 2HG1 ILE 92 -4.991 4.391 5.935 556 2HG1 ILE 92 1HG1 ILE 92 -3.878 5.374 6.878 557 1HG2 ILE 92 1HG2 ILE 92 -3.207 4.708 9.139 558 2HG2 ILE 92 2HG2 ILE 92 -2.575 3.147 8.609 559 3HG2 ILE 92 3HG2 ILE 92 -3.811 3.221 9.864 560 1HD1 ILE 92 1HD1 ILE 92 -2.126 3.713 6.499 561 2HD1 ILE 92 2HD1 ILE 92 -2.767 4.368 4.993 562 3HD1 ILE 92 3HD1 ILE 92 -3.247 2.757 5.527 563 H GLU 93 H GLU 93 -3.881 0.139 8.584 564 HA GLU 93 HA GLU 93 -5.827 -0.083 10.778 565 1HB GLU 93 2HB GLU 93 -3.867 -2.054 9.627 566 2HB GLU 93 1HB GLU 93 -4.819 -2.357 11.074 567 1HG GLU 93 2HG GLU 93 -5.989 -1.704 8.393 568 2HG GLU 93 1HG GLU 93 -5.747 -3.343 9.004 569 H ALA 94 H ALA 94 -2.504 0.423 10.052 570 HA ALA 94 HA ALA 94 -1.940 1.443 12.631 571 1HB ALA 94 1HB ALA 94 -0.144 -0.154 13.174 572 2HB ALA 94 2HB ALA 94 -0.608 -1.137 11.789 573 3HB ALA 94 3HB ALA 94 -1.720 -0.948 13.146 574 H VAL 95 H VAL 95 -0.260 2.853 12.412 575 HA VAL 95 HA VAL 95 1.529 2.494 10.188 576 HB VAL 95 HB VAL 95 -0.237 3.862 9.196 577 1HG1 VAL 95 1HG1 VAL 95 0.272 5.857 11.394 578 2HG1 VAL 95 2HG1 VAL 95 -1.186 4.894 11.168 579 3HG1 VAL 95 3HG1 VAL 95 -0.751 6.127 9.982 580 1HG2 VAL 95 1HG2 VAL 95 2.035 4.285 8.443 581 2HG2 VAL 95 2HG2 VAL 95 2.265 5.470 9.726 582 3HG2 VAL 95 3HG2 VAL 95 1.111 5.785 8.433 583 H GLU 96 H GLU 96 3.464 2.789 10.791 584 HA GLU 96 HA GLU 96 4.080 4.464 13.135 585 1HB GLU 96 2HB GLU 96 5.596 2.123 11.978 586 2HB GLU 96 1HB GLU 96 6.143 3.127 13.284 587 1HG GLU 96 2HG GLU 96 3.670 1.451 13.391 588 2HG GLU 96 1HG GLU 96 5.259 0.946 13.980 589 HA PRO 97 HA PRO 97 6.303 6.547 9.702 590 1HB PRO 97 2HB PRO 97 6.790 8.817 11.149 591 2HB PRO 97 1HB PRO 97 5.316 8.567 10.205 592 1HG PRO 97 2HG PRO 97 5.760 8.273 13.149 593 2HG PRO 97 1HG PRO 97 4.356 8.932 12.292 594 1HD PRO 97 2HD PRO 97 4.395 6.443 13.341 595 2HD PRO 97 1HD PRO 97 3.475 6.844 11.884 596 H ASP 98 H ASP 98 6.903 6.178 13.066 597 HA ASP 98 HA ASP 98 9.687 6.702 13.106 598 1HB ASP 98 2HB ASP 98 8.480 7.006 15.147 599 2HB ASP 98 1HB ASP 98 7.780 5.405 15.013 600 H LYS 99 H LYS 99 7.864 3.895 12.452 601 HA LYS 99 HA LYS 99 10.361 2.343 12.477 602 1HB LYS 99 2HB LYS 99 7.554 1.392 12.814 603 2HB LYS 99 1HB LYS 99 8.993 0.377 12.812 604 1HG LYS 99 2HG LYS 99 9.855 1.554 14.725 605 2HG LYS 99 1HG LYS 99 8.449 2.616 14.715 606 1HD LYS 99 2HD LYS 99 7.045 0.632 14.979 607 2HD LYS 99 1HD LYS 99 8.548 -0.303 15.139 608 1HE LYS 99 2HE LYS 99 7.571 0.330 17.343 609 2HE LYS 99 1HE LYS 99 9.208 0.953 17.062 610 1HZ LYS 99 1HZ LYS 99 7.674 2.594 18.028 611 2HZ LYS 99 2HZ LYS 99 6.719 2.543 16.630 612 3HZ LYS 99 3HZ LYS 99 8.319 3.098 16.561 613 H ASN 100 H ASN 100 8.543 3.965 10.454 614 HA ASN 100 HA ASN 100 7.805 3.838 8.261 615 1HB ASN 100 2HB ASN 100 10.155 1.934 8.071 616 2HB ASN 100 1HB ASN 100 9.304 2.619 6.696 617 1HD2 ASN 100 1HD2 ASN 100 12.058 2.818 7.466 618 2HD2 ASN 100 2HD2 ASN 100 12.389 4.516 7.620 619 H LEU 101 H LEU 101 6.235 2.308 9.801 620 HA LEU 101 HA LEU 101 5.847 -0.237 8.336 621 1HB LEU 101 2HB LEU 101 6.489 -0.618 10.658 622 2HB LEU 101 1HB LEU 101 5.225 0.459 11.201 623 HG LEU 101 HG LEU 101 3.571 -1.111 10.182 624 1HD1 LEU 101 1HD1 LEU 101 5.940 -2.926 10.010 625 2HD1 LEU 101 2HD1 LEU 101 4.946 -2.293 8.680 626 3HD1 LEU 101 3HD1 LEU 101 4.247 -3.404 9.851 627 1HD2 LEU 101 1HD2 LEU 101 3.649 -2.668 12.032 628 2HD2 LEU 101 2HD2 LEU 101 3.898 -1.002 12.531 629 3HD2 LEU 101 3HD2 LEU 101 5.279 -2.116 12.450 630 H ILE 102 H ILE 102 3.858 -0.524 7.458 631 HA ILE 102 HA ILE 102 1.651 0.972 8.522 632 HB ILE 102 HB ILE 102 2.541 2.528 6.928 633 1HG1 ILE 102 2HG1 ILE 102 0.059 1.240 5.767 634 2HG1 ILE 102 1HG1 ILE 102 0.084 2.382 7.107 635 1HG2 ILE 102 1HG2 ILE 102 2.692 1.985 4.494 636 2HG2 ILE 102 2HG2 ILE 102 2.340 0.315 4.913 637 3HG2 ILE 102 3HG2 ILE 102 3.810 1.061 5.500 638 1HD1 ILE 102 1HD1 ILE 102 0.970 2.953 4.289 639 2HD1 ILE 102 2HD1 ILE 102 0.975 4.105 5.626 640 3HD1 ILE 102 3HD1 ILE 102 -0.551 3.461 5.019 641 H THR 103 H THR 103 -0.003 -0.205 8.638 642 HA THR 103 HA THR 103 -0.174 -2.776 7.215 643 HB THR 103 HB THR 103 -1.858 -1.734 9.502 644 HG1 THR 103 1HG THR 103 0.670 -2.463 9.455 645 1HG2 THR 103 1HG2 THR 103 -2.410 -4.104 9.838 646 2HG2 THR 103 2HG2 THR 103 -1.426 -4.542 8.439 647 3HG2 THR 103 3HG2 THR 103 -2.884 -3.576 8.223 648 H PHE 104 H PHE 104 -1.506 -3.002 5.488 649 HA PHE 104 HA PHE 104 -3.698 -1.104 5.027 650 1HB PHE 104 2HB PHE 104 -2.281 -2.984 3.150 651 2HB PHE 104 1HB PHE 104 -3.549 -1.901 2.643 652 HD1 PHE 104 1HD PHE 104 -3.035 0.647 3.099 653 HD2 PHE 104 2HD PHE 104 -0.102 -2.418 2.900 654 HE1 PHE 104 1HE PHE 104 -1.319 2.322 2.572 655 HE2 PHE 104 2HE PHE 104 1.612 -0.755 2.373 656 HZ PHE 104 HZ PHE 104 1.012 1.617 2.207 657 H ARG 105 H ARG 105 -5.716 -1.987 4.382 658 HA ARG 105 HA ARG 105 -6.185 -4.855 4.872 659 1HB ARG 105 2HB ARG 105 -6.584 -3.682 6.953 660 2HB ARG 105 1HB ARG 105 -7.626 -2.536 6.139 661 1HG ARG 105 2HG ARG 105 -9.175 -4.428 5.628 662 2HG ARG 105 1HG ARG 105 -8.153 -5.460 6.633 663 1HD ARG 105 2HD ARG 105 -8.473 -3.892 8.507 664 2HD ARG 105 1HD ARG 105 -9.514 -2.944 7.438 665 HE ARG 105 HE ARG 105 -10.785 -5.224 7.358 666 1HH1 ARG 105 1HH1 ARG 105 -9.277 -3.705 10.214 667 2HH1 ARG 105 2HH1 ARG 105 -10.475 -4.212 11.285 668 1HH2 ARG 105 1HH2 ARG 105 -12.433 -5.946 8.872 669 2HH2 ARG 105 2HH2 ARG 105 -12.300 -5.546 10.517 670 H VAL 106 H VAL 106 -7.911 -5.720 3.635 671 HA VAL 106 HA VAL 106 -8.961 -4.180 1.495 672 HB VAL 106 HB VAL 106 -8.610 -6.606 1.306 673 1HG1 VAL 106 1HG1 VAL 106 -9.982 -8.211 2.550 674 2HG1 VAL 106 2HG1 VAL 106 -10.742 -6.874 3.420 675 3HG1 VAL 106 3HG1 VAL 106 -9.024 -7.204 3.622 676 1HG2 VAL 106 1HG2 VAL 106 -10.351 -5.646 -0.108 677 2HG2 VAL 106 2HG2 VAL 106 -11.532 -5.853 1.182 678 3HG2 VAL 106 3HG2 VAL 106 -10.827 -7.268 0.408 679 H ILE 107 H ILE 107 -10.974 -3.191 1.343 680 HA ILE 107 HA ILE 107 -12.730 -3.416 3.679 681 HB ILE 107 HB ILE 107 -13.369 -1.047 3.614 682 1HG1 ILE 107 2HG1 ILE 107 -12.747 -0.581 1.213 683 2HG1 ILE 107 1HG1 ILE 107 -12.207 0.642 2.350 684 1HG2 ILE 107 1HG2 ILE 107 -11.410 -0.111 4.617 685 2HG2 ILE 107 2HG2 ILE 107 -10.421 -1.349 3.890 686 3HG2 ILE 107 3HG2 ILE 107 -11.601 -1.796 5.146 687 1HD1 ILE 107 1HD1 ILE 107 -10.491 0.183 0.690 688 2HD1 ILE 107 2HD1 ILE 107 -10.509 -1.527 1.131 689 3HD1 ILE 107 3HD1 ILE 107 -9.971 -0.330 2.298 690 H GLU 108 H GLU 108 -12.589 -2.975 0.190 691 HA GLU 108 HA GLU 108 -15.444 -2.636 0.215 692 1HB GLU 108 2HB GLU 108 -14.091 -1.232 -1.267 693 2HB GLU 108 1HB GLU 108 -13.592 -2.660 -2.159 694 1HG GLU 108 2HG GLU 108 -15.353 -1.473 -3.331 695 2HG GLU 108 1HG GLU 108 -15.922 -3.056 -2.798 696 H GLY 109 H GLY 109 -13.937 -4.582 -2.338 697 1HA GLY 109 2HA GLY 109 -14.985 -7.029 -1.219 698 2HA GLY 109 1HA GLY 109 -16.021 -6.363 -2.462 699 H ASP 110 H ASP 110 -13.479 -5.382 -3.886 700 HA ASP 110 HA ASP 110 -13.216 -7.263 -5.853 701 1HB ASP 110 2HB ASP 110 -12.372 -5.062 -6.139 702 2HB ASP 110 1HB ASP 110 -11.236 -5.251 -4.812 703 H LEU 111 H LEU 111 -11.083 -6.970 -3.072 704 HA LEU 111 HA LEU 111 -9.546 -9.271 -3.792 705 1HB LEU 111 2HB LEU 111 -9.657 -7.705 -1.225 706 2HB LEU 111 1HB LEU 111 -8.473 -8.949 -1.585 707 HG LEU 111 HG LEU 111 -8.796 -6.410 -3.182 708 1HD1 LEU 111 1HD1 LEU 111 -6.740 -5.668 -2.096 709 2HD1 LEU 111 2HD1 LEU 111 -6.767 -7.105 -1.072 710 3HD1 LEU 111 3HD1 LEU 111 -8.043 -5.895 -0.932 711 1HD2 LEU 111 1HD2 LEU 111 -7.836 -8.242 -4.460 712 2HD2 LEU 111 2HD2 LEU 111 -6.650 -8.528 -3.188 713 3HD2 LEU 111 3HD2 LEU 111 -6.608 -7.026 -4.108 714 H MET 112 H MET 112 -12.451 -8.802 -2.073 715 HA MET 112 HA MET 112 -12.241 -11.154 -0.407 716 1HB MET 112 2HB MET 112 -14.563 -9.360 -0.991 717 2HB MET 112 1HB MET 112 -14.601 -10.682 0.150 718 1HG MET 112 2HG MET 112 -12.774 -8.281 0.428 719 2HG MET 112 1HG MET 112 -14.379 -8.342 1.122 720 1HE MET 112 1HE MET 112 -11.302 -11.151 1.171 721 2HE MET 112 2HE MET 112 -10.699 -10.671 2.732 722 3HE MET 112 3HE MET 112 -10.607 -9.536 1.387 723 H LYS 113 H LYS 113 -12.951 -10.715 -3.621 724 HA LYS 113 HA LYS 113 -14.985 -12.752 -3.827 725 1HB LYS 113 2HB LYS 113 -13.265 -11.521 -5.989 726 2HB LYS 113 1HB LYS 113 -14.698 -12.504 -6.251 727 1HG LYS 113 2HG LYS 113 -14.653 -9.825 -4.875 728 2HG LYS 113 1HG LYS 113 -15.158 -10.121 -6.536 729 1HD LYS 113 2HD LYS 113 -17.004 -11.484 -5.780 730 2HD LYS 113 1HD LYS 113 -16.452 -11.373 -4.110 731 1HE LYS 113 2HE LYS 113 -18.317 -9.853 -4.542 732 2HE LYS 113 1HE LYS 113 -16.844 -8.983 -4.113 733 1HZ LYS 113 1HZ LYS 113 -17.966 -7.918 -5.961 734 2HZ LYS 113 2HZ LYS 113 -17.926 -9.330 -6.859 735 3HZ LYS 113 3HZ LYS 113 -16.499 -8.544 -6.487 736 H GLU 114 H GLU 114 -11.631 -12.538 -3.811 737 HA GLU 114 HA GLU 114 -11.302 -15.340 -4.654 738 1HB GLU 114 2HB GLU 114 -9.336 -13.060 -4.541 739 2HB GLU 114 1HB GLU 114 -8.798 -14.717 -4.648 740 1HG GLU 114 2HG GLU 114 -8.739 -13.646 -6.813 741 2HG GLU 114 1HG GLU 114 -9.925 -14.939 -6.810 742 H TYR 115 H TYR 115 -10.816 -13.103 -2.007 743 HA TYR 115 HA TYR 115 -9.781 -15.303 -0.361 744 1HB TYR 115 2HB TYR 115 -9.046 -12.375 -0.149 745 2HB TYR 115 1HB TYR 115 -8.378 -13.703 0.801 746 HD1 TYR 115 1HD TYR 115 -8.199 -11.851 -2.255 747 HD2 TYR 115 2HD TYR 115 -7.016 -15.464 -0.364 748 HE1 TYR 115 1HE TYR 115 -6.499 -12.218 -4.009 749 HE2 TYR 115 2HE TYR 115 -5.359 -15.838 -2.088 750 HH TYR 115 HH TYR 115 -4.421 -13.491 -4.326 751 H LYS 116 H LYS 116 -10.481 -15.290 1.756 752 HA LYS 116 HA LYS 116 -12.953 -13.816 2.073 753 1HB LYS 116 2HB LYS 116 -13.345 -15.478 3.995 754 2HB LYS 116 1HB LYS 116 -13.467 -16.062 2.347 755 1HG LYS 116 2HG LYS 116 -11.089 -16.842 2.578 756 2HG LYS 116 1HG LYS 116 -11.229 -16.517 4.315 757 1HD LYS 116 2HD LYS 116 -13.050 -18.334 2.721 758 2HD LYS 116 1HD LYS 116 -11.687 -18.906 3.680 759 1HE LYS 116 2HE LYS 116 -14.043 -17.368 4.780 760 2HE LYS 116 1HE LYS 116 -13.925 -19.124 4.770 761 1HZ LYS 116 1HZ LYS 116 -13.275 -18.045 6.880 762 2HZ LYS 116 2HZ LYS 116 -11.955 -17.344 6.116 763 3HZ LYS 116 3HZ LYS 116 -12.063 -19.019 6.206 764 H SER 117 H SER 117 -9.819 -13.541 2.998 765 HA SER 117 HA SER 117 -10.413 -11.247 4.514 766 1HB SER 117 2HB SER 117 -10.651 -13.007 6.165 767 2HB SER 117 1HB SER 117 -8.980 -13.539 5.868 768 HG SER 117 HG SER 117 -8.435 -12.045 7.291 769 H PHE 118 H PHE 118 -8.486 -9.919 4.560 770 HA PHE 118 HA PHE 118 -6.077 -10.967 3.382 771 1HB PHE 118 2HB PHE 118 -7.388 -10.755 1.382 772 2HB PHE 118 1HB PHE 118 -7.860 -9.102 1.785 773 HD1 PHE 118 1HD PHE 118 -5.241 -11.300 0.499 774 HD2 PHE 118 2HD PHE 118 -6.293 -7.281 1.380 775 HE1 PHE 118 1HE PHE 118 -3.345 -10.510 -0.846 776 HE2 PHE 118 2HE PHE 118 -4.404 -6.489 0.025 777 HZ PHE 118 HZ PHE 118 -2.923 -8.103 -1.084 778 H LEU 119 H LEU 119 -4.437 -9.958 4.314 779 HA LEU 119 HA LEU 119 -4.623 -7.111 4.838 780 1HB LEU 119 2HB LEU 119 -3.749 -9.255 6.737 781 2HB LEU 119 1HB LEU 119 -3.185 -7.605 6.891 782 HG LEU 119 HG LEU 119 -6.025 -8.297 6.751 783 1HD1 LEU 119 1HD1 LEU 119 -4.213 -7.996 9.207 784 2HD1 LEU 119 2HD1 LEU 119 -5.026 -9.491 8.730 785 3HD1 LEU 119 3HD1 LEU 119 -5.963 -8.115 9.312 786 1HD2 LEU 119 1HD2 LEU 119 -5.525 -6.000 6.384 787 2HD2 LEU 119 2HD2 LEU 119 -4.550 -5.926 7.849 788 3HD2 LEU 119 3HD2 LEU 119 -6.294 -6.153 7.960 789 H LEU 120 H LEU 120 -2.803 -6.120 4.723 790 HA LEU 120 HA LEU 120 -0.347 -7.576 4.225 791 1HB LEU 120 2HB LEU 120 0.346 -6.388 2.221 792 2HB LEU 120 1HB LEU 120 -1.138 -7.260 1.932 793 HG LEU 120 HG LEU 120 -0.947 -4.278 2.383 794 1HD1 LEU 120 1HD1 LEU 120 -1.313 -4.090 -0.014 795 2HD1 LEU 120 2HD1 LEU 120 -1.258 -5.852 -0.162 796 3HD1 LEU 120 3HD1 LEU 120 0.177 -4.965 0.350 797 1HD2 LEU 120 1HD2 LEU 120 -3.129 -5.145 2.975 798 2HD2 LEU 120 2HD2 LEU 120 -3.217 -6.039 1.460 799 3HD2 LEU 120 3HD2 LEU 120 -3.247 -4.271 1.450 800 H THR 121 H THR 121 1.375 -6.693 5.028 801 HA THR 121 HA THR 121 1.122 -3.945 6.005 802 HB THR 121 HB THR 121 2.339 -6.272 7.505 803 HG1 THR 121 1HG THR 121 -0.174 -5.582 7.153 804 1HG2 THR 121 1HG2 THR 121 3.313 -4.094 8.030 805 2HG2 THR 121 2HG2 THR 121 2.335 -4.664 9.390 806 3HG2 THR 121 3HG2 THR 121 1.709 -3.427 8.294 807 H ILE 122 H ILE 122 2.860 -2.724 5.427 808 HA ILE 122 HA ILE 122 5.228 -4.203 4.541 809 HB ILE 122 HB ILE 122 5.731 -2.424 2.964 810 1HG1 ILE 122 2HG1 ILE 122 3.076 -1.226 3.719 811 2HG1 ILE 122 1HG1 ILE 122 4.644 -0.568 4.165 812 1HG2 ILE 122 1HG2 ILE 122 4.394 -4.296 2.174 813 2HG2 ILE 122 2HG2 ILE 122 3.901 -2.814 1.364 814 3HG2 ILE 122 3HG2 ILE 122 2.921 -3.471 2.673 815 1HD1 ILE 122 1HD1 ILE 122 3.604 -0.866 1.349 816 2HD1 ILE 122 2HD1 ILE 122 5.169 -0.202 1.807 817 3HD1 ILE 122 3HD1 ILE 122 3.688 0.633 2.275 818 H GLN 123 H GLN 123 7.206 -3.348 5.015 819 HA GLN 123 HA GLN 123 7.263 -0.970 6.660 820 1HB GLN 123 2HB GLN 123 7.047 -2.994 8.155 821 2HB GLN 123 1HB GLN 123 8.599 -3.531 7.538 822 1HG GLN 123 2HG GLN 123 9.714 -1.647 8.474 823 2HG GLN 123 1HG GLN 123 8.181 -0.890 8.902 824 1HE2 GLN 123 1HE2 GLN 123 8.617 -0.754 11.029 825 2HE2 GLN 123 2HE2 GLN 123 8.691 -2.093 12.108 826 H VAL 124 H VAL 124 8.937 0.247 6.193 827 HA VAL 124 HA VAL 124 10.744 -0.769 4.141 828 HB VAL 124 HB VAL 124 10.356 2.104 5.039 829 1HG1 VAL 124 1HG1 VAL 124 11.506 2.674 2.966 830 2HG1 VAL 124 2HG1 VAL 124 11.730 0.959 2.617 831 3HG1 VAL 124 3HG1 VAL 124 12.520 1.677 4.014 832 1HG2 VAL 124 1HG2 VAL 124 8.303 1.211 4.056 833 2HG2 VAL 124 2HG2 VAL 124 9.210 0.666 2.646 834 3HG2 VAL 124 3HG2 VAL 124 9.052 2.391 2.982 835 H THR 125 H THR 125 12.626 -1.400 4.651 836 HA THR 125 HA THR 125 13.883 -0.532 7.155 837 HB THR 125 HB THR 125 14.029 -3.174 5.666 838 HG1 THR 125 1HG THR 125 12.198 -2.203 7.199 839 1HG2 THR 125 1HG2 THR 125 15.162 -4.028 7.636 840 2HG2 THR 125 2HG2 THR 125 15.107 -2.437 8.406 841 3HG2 THR 125 3HG2 THR 125 16.082 -2.679 6.954 842 HA PRO 126 HA PRO 126 17.252 1.226 4.663 843 1HB PRO 126 2HB PRO 126 18.904 -0.258 6.660 844 2HB PRO 126 1HB PRO 126 19.067 1.408 6.096 845 1HG PRO 126 2HG PRO 126 17.970 0.857 8.459 846 2HG PRO 126 1HG PRO 126 17.351 2.176 7.442 847 1HD PRO 126 2HD PRO 126 16.175 -0.476 8.050 848 2HD PRO 126 1HD PRO 126 15.374 1.044 7.604 849 H LYS 127 H LYS 127 18.689 0.533 3.111 850 HA LYS 127 HA LYS 127 18.652 -2.320 2.558 851 1HB LYS 127 2HB LYS 127 17.825 -1.049 0.727 852 2HB LYS 127 1HB LYS 127 19.183 0.062 0.795 853 1HG LYS 127 2HG LYS 127 20.681 -1.649 0.007 854 2HG LYS 127 1HG LYS 127 19.396 -2.853 0.085 855 1HD LYS 127 2HD LYS 127 18.177 -1.744 -1.664 856 2HD LYS 127 1HD LYS 127 19.327 -0.402 -1.663 857 1HE LYS 127 2HE LYS 127 21.077 -1.814 -2.476 858 2HE LYS 127 1HE LYS 127 20.079 -3.252 -2.268 859 1HZ LYS 127 1HZ LYS 127 18.706 -2.624 -4.000 860 2HZ LYS 127 2HZ LYS 127 20.267 -2.428 -4.557 861 3HZ LYS 127 3HZ LYS 127 19.377 -1.052 -4.143 862 HA PRO 128 HA PRO 128 22.987 -2.562 3.733 863 1HB PRO 128 2HB PRO 128 22.793 -5.145 2.291 864 2HB PRO 128 1HB PRO 128 23.291 -4.848 3.960 865 1HG PRO 128 2HG PRO 128 20.937 -5.980 3.419 866 2HG PRO 128 1HG PRO 128 21.110 -4.804 4.738 867 1HD PRO 128 2HD PRO 128 19.993 -4.417 1.991 868 2HD PRO 128 1HD PRO 128 19.395 -3.821 3.561 869 H GLY 129 H GLY 129 24.308 -1.407 2.498 870 1HA GLY 129 2HA GLY 129 25.745 -1.875 0.409 871 2HA GLY 129 1HA GLY 129 24.190 -1.715 -0.404 872 H GLY 130 H GLY 130 23.144 0.274 1.340 873 1HA GLY 130 2HA GLY 130 24.083 2.480 2.078 874 2HA GLY 130 1HA GLY 130 24.832 2.528 0.489 875 HA PRO 131 HA PRO 131 21.355 4.765 -0.924 876 1HB PRO 131 2HB PRO 131 21.370 4.203 -3.576 877 2HB PRO 131 1HB PRO 131 22.593 5.222 -2.808 878 1HG PRO 131 2HG PRO 131 22.743 2.323 -3.539 879 2HG PRO 131 1HG PRO 131 23.952 3.598 -3.785 880 1HD PRO 131 2HD PRO 131 24.102 1.835 -1.740 881 2HD PRO 131 1HD PRO 131 24.671 3.511 -1.594 882 H GLY 132 H GLY 132 19.226 4.545 -1.101 883 1HA GLY 132 2HA GLY 132 17.204 3.606 -1.825 884 2HA GLY 132 1HA GLY 132 18.057 2.120 -2.208 885 H SER 133 H SER 133 15.907 1.552 -1.006 886 HA SER 133 HA SER 133 16.758 0.619 1.572 887 1HB SER 133 2HB SER 133 14.267 2.334 1.269 888 2HB SER 133 1HB SER 133 14.687 1.412 2.716 889 HG SER 133 HG SER 133 16.722 2.981 1.839 890 H ILE 134 H ILE 134 15.087 -1.003 2.412 891 HA ILE 134 HA ILE 134 14.000 -2.392 0.074 892 HB ILE 134 HB ILE 134 14.817 -3.507 2.768 893 1HG1 ILE 134 2HG1 ILE 134 16.721 -2.806 1.463 894 2HG1 ILE 134 1HG1 ILE 134 16.613 -4.579 1.610 895 1HG2 ILE 134 1HG2 ILE 134 14.516 -5.719 1.739 896 2HG2 ILE 134 2HG2 ILE 134 13.904 -4.942 0.279 897 3HG2 ILE 134 3HG2 ILE 134 13.010 -4.801 1.794 898 1HD1 ILE 134 1HD1 ILE 134 15.885 -2.938 -0.808 899 2HD1 ILE 134 2HD1 ILE 134 15.764 -4.692 -0.655 900 3HD1 ILE 134 3HD1 ILE 134 17.345 -3.911 -0.605 901 H VAL 135 H VAL 135 11.944 -2.846 0.151 902 HA VAL 135 HA VAL 135 10.471 -2.254 2.610 903 HB VAL 135 HB VAL 135 9.713 -0.754 0.808 904 1HG1 VAL 135 1HG1 VAL 135 8.940 -3.200 -0.731 905 2HG1 VAL 135 2HG1 VAL 135 10.233 -2.072 -1.136 906 3HG1 VAL 135 3HG1 VAL 135 8.552 -1.537 -1.171 907 1HG2 VAL 135 1HG2 VAL 135 7.629 -2.819 1.486 908 2HG2 VAL 135 2HG2 VAL 135 7.302 -1.194 0.889 909 3HG2 VAL 135 3HG2 VAL 135 8.061 -1.415 2.465 910 H HIS 136 H HIS 136 9.840 -3.887 3.689 911 HA HIS 136 HA HIS 136 9.637 -6.440 2.328 912 1HB HIS 136 2HB HIS 136 9.795 -5.765 5.264 913 2HB HIS 136 1HB HIS 136 9.388 -7.380 4.681 914 HD1 HIS 136 1HD HIS 136 11.239 -8.726 3.546 915 HD2 HIS 136 2HD HIS 136 12.507 -5.043 5.049 916 HE1 HIS 136 1HE HIS 136 13.766 -8.792 3.530 917 HE2 HIS 136 2HE HIS 136 14.464 -6.642 4.659 918 H TRP 137 H TRP 137 7.847 -7.158 1.674 919 HA TRP 137 HA TRP 137 5.381 -5.992 2.661 920 1HB TRP 137 2HB TRP 137 6.045 -7.754 0.307 921 2HB TRP 137 1HB TRP 137 4.417 -7.256 0.733 922 HD1 TRP 137 HD TRP 137 7.804 -5.505 -0.256 923 HE1 TRP 137 1HE TRP 137 7.191 -3.469 -1.651 924 HE3 TRP 137 3HE TRP 137 2.700 -5.813 0.012 925 HZ2 TRP 137 2HZ TRP 137 4.922 -2.144 -2.516 926 HZ3 TRP 137 3HZ TRP 137 1.374 -4.106 -1.134 927 HH2 TRP 137 HH TRP 137 2.440 -2.302 -2.367 928 H HIS 138 H HIS 138 4.353 -7.072 4.242 929 HA HIS 138 HA HIS 138 4.603 -9.982 4.284 930 1HB HIS 138 2HB HIS 138 5.204 -8.919 6.445 931 2HB HIS 138 1HB HIS 138 3.688 -8.034 6.440 932 HD1 HIS 138 1HD HIS 138 5.183 -11.343 7.328 933 HD2 HIS 138 2HD HIS 138 1.470 -9.559 7.078 934 HE1 HIS 138 1HE HIS 138 3.659 -12.877 8.580 935 HE2 HIS 138 2HE HIS 138 1.403 -11.821 8.487 936 H LEU 139 H LEU 139 3.031 -10.832 3.171 937 HA LEU 139 HA LEU 139 0.419 -9.516 3.168 938 1HB LEU 139 2HB LEU 139 1.503 -11.654 1.317 939 2HB LEU 139 1HB LEU 139 -0.095 -10.965 1.228 940 HG LEU 139 HG LEU 139 1.022 -8.756 0.681 941 1HD1 LEU 139 1HD1 LEU 139 3.253 -9.209 1.480 942 2HD1 LEU 139 2HD1 LEU 139 3.279 -8.835 -0.248 943 3HD1 LEU 139 3HD1 LEU 139 3.435 -10.500 0.296 944 1HD2 LEU 139 1HD2 LEU 139 1.391 -11.066 -1.206 945 2HD2 LEU 139 2HD2 LEU 139 1.393 -9.362 -1.663 946 3HD2 LEU 139 3HD2 LEU 139 -0.069 -10.093 -0.999 947 H GLU 140 H GLU 140 -1.181 -10.536 4.187 948 HA GLU 140 HA GLU 140 -0.835 -13.371 4.730 949 1HB GLU 140 2HB GLU 140 0.002 -11.860 6.602 950 2HB GLU 140 1HB GLU 140 -1.649 -11.304 6.760 951 1HG GLU 140 2HG GLU 140 -2.343 -13.562 7.374 952 2HG GLU 140 1HG GLU 140 -0.666 -14.101 7.168 953 H TYR 141 H TYR 141 -2.670 -14.290 4.187 954 HA TYR 141 HA TYR 141 -5.196 -12.881 4.181 955 1HB TYR 141 2HB TYR 141 -5.478 -13.192 1.714 956 2HB TYR 141 1HB TYR 141 -4.244 -12.013 2.150 957 HD1 TYR 141 1HD TYR 141 -1.792 -12.746 2.008 958 HD2 TYR 141 2HD TYR 141 -4.966 -14.980 0.334 959 HE1 TYR 141 1HE TYR 141 -0.170 -13.962 0.610 960 HE2 TYR 141 2HE TYR 141 -3.395 -16.214 -1.058 961 HH TYR 141 HH TYR 141 -1.124 -15.966 -1.992 962 H GLU 142 H GLU 142 -6.891 -14.283 3.305 963 HA GLU 142 HA GLU 142 -6.239 -17.071 3.919 964 1HB GLU 142 2HB GLU 142 -7.307 -15.911 5.798 965 2HB GLU 142 1HB GLU 142 -8.643 -15.466 4.760 966 1HG GLU 142 2HG GLU 142 -9.276 -17.790 4.552 967 2HG GLU 142 1HG GLU 142 -7.880 -18.266 5.524 968 H LYS 143 H LYS 143 -6.635 -18.294 2.208 969 HA LYS 143 HA LYS 143 -7.963 -17.431 -0.121 970 1HB LYS 143 2HB LYS 143 -7.073 -20.137 0.818 971 2HB LYS 143 1HB LYS 143 -8.040 -19.971 -0.624 972 1HG LYS 143 2HG LYS 143 -5.745 -20.231 -1.205 973 2HG LYS 143 1HG LYS 143 -6.243 -18.601 -1.601 974 1HD LYS 143 2HD LYS 143 -5.071 -17.738 0.306 975 2HD LYS 143 1HD LYS 143 -4.698 -19.376 0.866 976 1HE LYS 143 2HE LYS 143 -3.844 -18.240 -1.790 977 2HE LYS 143 1HE LYS 143 -2.798 -18.303 -0.364 978 1HZ LYS 143 1HZ LYS 143 -2.422 -20.168 -1.917 979 2HZ LYS 143 2HZ LYS 143 -4.011 -20.730 -1.657 980 3HZ LYS 143 3HZ LYS 143 -2.924 -20.683 -0.411 981 H ILE 144 H ILE 144 -10.055 -17.749 -0.814 982 HA ILE 144 HA ILE 144 -12.002 -18.899 0.949 983 HB ILE 144 HB ILE 144 -12.058 -18.088 -1.968 984 1HG1 ILE 144 2HG1 ILE 144 -13.409 -16.972 0.485 985 2HG1 ILE 144 1HG1 ILE 144 -12.030 -16.270 -0.345 986 1HG2 ILE 144 1HG2 ILE 144 -14.356 -19.241 -0.404 987 2HG2 ILE 144 2HG2 ILE 144 -13.506 -20.005 -1.749 988 3HG2 ILE 144 3HG2 ILE 144 -14.464 -18.543 -2.028 989 1HD1 ILE 144 1HD1 ILE 144 -14.050 -15.088 -0.839 990 2HD1 ILE 144 2HD1 ILE 144 -14.817 -16.576 -1.408 991 3HD1 ILE 144 3HD1 ILE 144 -13.457 -15.877 -2.303 992 H SER 145 H SER 145 -10.347 -19.753 -1.972 993 HA SER 145 HA SER 145 -10.047 -22.438 -1.218 994 1HB SER 145 2HB SER 145 -11.721 -21.699 -3.640 995 2HB SER 145 1HB SER 145 -11.104 -23.322 -3.347 996 HG SER 145 HG SER 145 -12.463 -22.244 -1.234 997 H GLU 146 H GLU 146 -8.521 -23.403 -2.694 998 HA GLU 146 HA GLU 146 -6.319 -21.720 -3.089 999 1HB GLU 146 2HB GLU 146 -6.942 -24.449 -4.018 1000 2HB GLU 146 1HB GLU 146 -5.373 -23.705 -4.277 1001 1HG GLU 146 2HG GLU 146 -6.647 -24.113 -1.570 1002 2HG GLU 146 1HG GLU 146 -5.424 -25.179 -2.264 1003 H GLU 147 H GLU 147 -8.169 -23.467 -5.520 1004 HA GLU 147 HA GLU 147 -6.897 -22.354 -7.773 1005 1HB GLU 147 2HB GLU 147 -9.628 -23.610 -7.518 1006 2HB GLU 147 1HB GLU 147 -8.769 -23.331 -9.025 1007 1HG GLU 147 2HG GLU 147 -7.826 -25.099 -6.787 1008 2HG GLU 147 1HG GLU 147 -8.592 -25.655 -8.273 1009 H VAL 148 H VAL 148 -9.220 -21.206 -5.720 1010 HA VAL 148 HA VAL 148 -10.486 -19.351 -7.567 1011 HB VAL 148 HB VAL 148 -10.774 -19.554 -4.551 1012 1HG1 VAL 148 1HG1 VAL 148 -12.512 -18.132 -6.562 1013 2HG1 VAL 148 2HG1 VAL 148 -11.452 -17.359 -5.380 1014 3HG1 VAL 148 3HG1 VAL 148 -12.851 -18.291 -4.838 1015 1HG2 VAL 148 1HG2 VAL 148 -12.466 -20.706 -6.768 1016 2HG2 VAL 148 2HG2 VAL 148 -12.875 -20.730 -5.053 1017 3HG2 VAL 148 3HG2 VAL 148 -11.441 -21.589 -5.630 1018 H ALA 149 H ALA 149 -7.882 -19.364 -5.332 1019 HA ALA 149 HA ALA 149 -7.708 -16.498 -5.060 1020 1HB ALA 149 1HB ALA 149 -7.166 -17.918 -3.206 1021 2HB ALA 149 2HB ALA 149 -5.745 -17.002 -3.707 1022 3HB ALA 149 3HB ALA 149 -5.895 -18.710 -4.144 1023 H HIS 150 H HIS 150 -5.661 -15.354 -5.587 1024 HA HIS 150 HA HIS 150 -4.214 -16.500 -7.848 1025 1HB HIS 150 2HB HIS 150 -5.538 -13.768 -7.886 1026 2HB HIS 150 1HB HIS 150 -4.337 -14.286 -9.046 1027 HD1 HIS 150 1HD HIS 150 -5.235 -15.382 -11.113 1028 HD2 HIS 150 2HD HIS 150 -8.024 -15.323 -8.039 1029 HE1 HIS 150 1HE HIS 150 -7.377 -16.170 -12.134 1030 HE2 HIS 150 2HE HIS 150 -9.078 -15.735 -10.333 1031 HA PRO 151 HA PRO 151 -1.278 -14.585 -4.790 1032 1HB PRO 151 2HB PRO 151 0.479 -16.565 -6.139 1033 2HB PRO 151 1HB PRO 151 0.273 -16.239 -4.414 1034 1HG PRO 151 2HG PRO 151 -0.764 -18.442 -5.486 1035 2HG PRO 151 1HG PRO 151 -1.646 -17.526 -4.258 1036 1HD PRO 151 2HD PRO 151 -2.074 -17.595 -7.222 1037 2HD PRO 151 1HD PRO 151 -3.248 -17.562 -5.875 1038 H GLU 152 H GLU 152 -1.127 -15.259 -8.190 1039 HA GLU 152 HA GLU 152 1.213 -13.953 -9.024 1040 1HB GLU 152 2HB GLU 152 -1.434 -14.097 -10.427 1041 2HB GLU 152 1HB GLU 152 0.108 -13.773 -11.186 1042 1HG GLU 152 2HG GLU 152 -0.757 -16.275 -9.837 1043 2HG GLU 152 1HG GLU 152 -0.634 -15.986 -11.574 1044 H THR 153 H THR 153 -2.094 -12.807 -8.680 1045 HA THR 153 HA THR 153 -1.545 -10.268 -9.729 1046 HB THR 153 HB THR 153 -3.894 -9.766 -9.136 1047 HG1 THR 153 1HG THR 153 -5.069 -11.431 -8.091 1048 1HG2 THR 153 1HG2 THR 153 -3.384 -10.995 -11.186 1049 2HG2 THR 153 2HG2 THR 153 -4.897 -11.580 -10.489 1050 3HG2 THR 153 3HG2 THR 153 -3.402 -12.514 -10.309 1051 H LEU 154 H LEU 154 -1.604 -11.594 -6.502 1052 HA LEU 154 HA LEU 154 -1.430 -9.190 -5.081 1053 1HB LEU 154 2HB LEU 154 -0.562 -11.984 -4.496 1054 2HB LEU 154 1HB LEU 154 -0.057 -10.689 -3.442 1055 HG LEU 154 HG LEU 154 -2.354 -10.193 -2.887 1056 1HD1 LEU 154 1HD1 LEU 154 -3.072 -12.405 -4.761 1057 2HD1 LEU 154 2HD1 LEU 154 -3.463 -10.676 -4.910 1058 3HD1 LEU 154 3HD1 LEU 154 -4.162 -11.630 -3.592 1059 1HD2 LEU 154 1HD2 LEU 154 -1.689 -13.103 -2.681 1060 2HD2 LEU 154 2HD2 LEU 154 -2.918 -12.276 -1.727 1061 3HD2 LEU 154 3HD2 LEU 154 -1.226 -11.820 -1.561 1062 H LEU 155 H LEU 155 1.104 -11.234 -6.493 1063 HA LEU 155 HA LEU 155 3.155 -9.512 -5.591 1064 1HB LEU 155 2HB LEU 155 3.202 -11.580 -7.772 1065 2HB LEU 155 1HB LEU 155 4.616 -10.682 -7.259 1066 HG LEU 155 HG LEU 155 3.011 -12.604 -5.570 1067 1HD1 LEU 155 1HD1 LEU 155 5.805 -12.703 -6.636 1068 2HD1 LEU 155 2HD1 LEU 155 4.448 -13.699 -7.190 1069 3HD1 LEU 155 3HD1 LEU 155 5.085 -13.876 -5.542 1070 1HD2 LEU 155 1HD2 LEU 155 5.421 -10.934 -4.859 1071 2HD2 LEU 155 2HD2 LEU 155 4.747 -12.219 -3.863 1072 3HD2 LEU 155 3HD2 LEU 155 3.805 -10.764 -4.183 1073 H GLN 156 H GLN 156 1.310 -9.639 -8.550 1074 HA GLN 156 HA GLN 156 2.704 -7.568 -9.859 1075 1HB GLN 156 2HB GLN 156 -0.231 -8.295 -10.078 1076 2HB GLN 156 1HB GLN 156 0.619 -7.221 -11.177 1077 1HG GLN 156 2HG GLN 156 1.195 -10.146 -10.766 1078 2HG GLN 156 1HG GLN 156 0.345 -9.437 -12.134 1079 1HE2 GLN 156 1HE2 GLN 156 2.733 -11.029 -12.095 1080 2HE2 GLN 156 2HE2 GLN 156 3.987 -10.111 -12.836 1081 H PHE 157 H PHE 157 0.028 -7.559 -7.553 1082 HA PHE 157 HA PHE 157 -0.500 -4.810 -7.525 1083 1HB PHE 157 2HB PHE 157 -2.028 -6.469 -6.547 1084 2HB PHE 157 1HB PHE 157 -0.809 -6.926 -5.376 1085 HD1 PHE 157 1HD PHE 157 -1.475 -6.355 -3.263 1086 HD2 PHE 157 2HD PHE 157 -2.256 -3.657 -6.460 1087 HE1 PHE 157 1HE PHE 157 -2.470 -4.719 -1.662 1088 HE2 PHE 157 2HE PHE 157 -3.246 -2.058 -4.880 1089 HZ PHE 157 HZ PHE 157 -3.346 -2.595 -2.483 1090 H CYS 158 H CYS 158 1.670 -6.793 -5.561 1091 HA CYS 158 HA CYS 158 2.621 -4.740 -3.913 1092 1HB CYS 158 2HB CYS 158 3.993 -7.314 -4.702 1093 2HB CYS 158 1HB CYS 158 4.461 -6.276 -3.362 1094 HG CYS 158 HG CYS 158 1.551 -7.999 -3.662 1095 H VAL 159 H VAL 159 3.985 -6.079 -6.930 1096 HA VAL 159 HA VAL 159 6.297 -4.519 -6.772 1097 HB VAL 159 HB VAL 159 6.051 -6.533 -8.239 1098 1HG1 VAL 159 1HG1 VAL 159 4.591 -4.742 -10.130 1099 2HG1 VAL 159 2HG1 VAL 159 3.944 -6.114 -9.244 1100 3HG1 VAL 159 3HG1 VAL 159 5.175 -6.375 -10.487 1101 1HG2 VAL 159 1HG2 VAL 159 7.104 -4.052 -9.583 1102 2HG2 VAL 159 2HG2 VAL 159 7.499 -5.705 -10.059 1103 3HG2 VAL 159 3HG2 VAL 159 7.989 -5.099 -8.475 1104 H GLU 160 H GLU 160 3.262 -3.931 -8.378 1105 HA GLU 160 HA GLU 160 4.015 -1.550 -9.689 1106 1HB GLU 160 2HB GLU 160 1.288 -2.477 -8.826 1107 2HB GLU 160 1HB GLU 160 1.560 -1.046 -9.813 1108 1HG GLU 160 2HG GLU 160 2.397 -3.839 -10.548 1109 2HG GLU 160 1HG GLU 160 0.948 -3.021 -11.131 1110 H VAL 161 H VAL 161 2.376 -1.976 -6.589 1111 HA VAL 161 HA VAL 161 2.216 0.753 -5.989 1112 HB VAL 161 HB VAL 161 2.326 -1.620 -4.119 1113 1HG1 VAL 161 1HG1 VAL 161 1.314 -0.114 -2.412 1114 2HG1 VAL 161 2HG1 VAL 161 1.465 1.237 -3.537 1115 3HG1 VAL 161 3HG1 VAL 161 2.911 0.452 -2.907 1116 1HG2 VAL 161 1HG2 VAL 161 0.434 -1.679 -5.629 1117 2HG2 VAL 161 2HG2 VAL 161 -0.005 -0.030 -5.183 1118 3HG2 VAL 161 3HG2 VAL 161 -0.119 -1.325 -3.991 1119 H SER 162 H SER 162 4.810 -1.563 -5.587 1120 HA SER 162 HA SER 162 6.449 -0.135 -3.878 1121 1HB SER 162 2HB SER 162 7.201 -1.991 -6.113 1122 2HB SER 162 1HB SER 162 8.300 -1.405 -4.854 1123 HG SER 162 HG SER 162 5.952 -2.977 -4.501 1124 H LYS 163 H LYS 163 6.178 0.188 -7.442 1125 HA LYS 163 HA LYS 163 8.229 2.209 -7.463 1126 1HB LYS 163 2HB LYS 163 6.156 1.588 -9.578 1127 2HB LYS 163 1HB LYS 163 7.303 2.890 -9.741 1128 1HG LYS 163 2HG LYS 163 8.107 1.077 -11.052 1129 2HG LYS 163 1HG LYS 163 9.136 1.164 -9.633 1130 1HD LYS 163 2HD LYS 163 8.593 -1.140 -10.178 1131 2HD LYS 163 1HD LYS 163 7.883 -0.686 -8.632 1132 1HE LYS 163 2HE LYS 163 6.321 -1.982 -9.984 1133 2HE LYS 163 1HE LYS 163 5.716 -0.367 -9.682 1134 1HZ LYS 163 1HZ LYS 163 6.295 0.240 -11.948 1135 2HZ LYS 163 2HZ LYS 163 5.342 -1.154 -11.890 1136 3HZ LYS 163 3HZ LYS 163 6.982 -1.295 -12.206 1137 H GLU 164 H GLU 164 4.732 2.223 -7.391 1138 HA GLU 164 HA GLU 164 4.227 4.921 -7.709 1139 1HB GLU 164 2HB GLU 164 2.771 2.961 -5.956 1140 2HB GLU 164 1HB GLU 164 2.141 4.508 -6.492 1141 1HG GLU 164 2HG GLU 164 2.837 2.168 -8.261 1142 2HG GLU 164 1HG GLU 164 1.218 2.717 -7.832 1143 H ILE 165 H ILE 165 4.802 3.166 -4.689 1144 HA ILE 165 HA ILE 165 4.568 5.528 -3.117 1145 HB ILE 165 HB ILE 165 4.043 3.179 -2.349 1146 1HG1 ILE 165 2HG1 ILE 165 4.303 5.013 -0.660 1147 2HG1 ILE 165 1HG1 ILE 165 4.677 3.430 -0.014 1148 1HG2 ILE 165 1HG2 ILE 165 5.820 1.739 -1.452 1149 2HG2 ILE 165 2HG2 ILE 165 7.016 2.830 -2.158 1150 3HG2 ILE 165 3HG2 ILE 165 5.892 1.959 -3.200 1151 1HD1 ILE 165 1HD1 ILE 165 6.188 5.142 0.802 1152 2HD1 ILE 165 2HD1 ILE 165 6.666 5.520 -0.858 1153 3HD1 ILE 165 3HD1 ILE 165 7.059 3.949 -0.161 1154 H ASP 166 H ASP 166 7.258 3.706 -4.459 1155 HA ASP 166 HA ASP 166 9.404 5.034 -3.198 1156 1HB ASP 166 2HB ASP 166 9.752 2.945 -4.346 1157 2HB ASP 166 1HB ASP 166 9.224 3.650 -5.865 1158 H GLU 167 H GLU 167 7.961 5.559 -6.383 1159 HA GLU 167 HA GLU 167 9.527 7.819 -6.976 1160 1HB GLU 167 2HB GLU 167 6.875 6.972 -8.152 1161 2HB GLU 167 1HB GLU 167 7.937 8.202 -8.827 1162 1HG GLU 167 2HG GLU 167 9.685 6.499 -9.124 1163 2HG GLU 167 1HG GLU 167 8.573 5.276 -8.510 1164 H HIS 168 H HIS 168 6.514 7.374 -5.317 1165 HA HIS 168 HA HIS 168 5.719 10.080 -5.202 1166 1HB HIS 168 2HB HIS 168 4.213 8.224 -4.531 1167 2HB HIS 168 1HB HIS 168 5.251 7.885 -3.160 1168 HD1 HIS 168 1HD HIS 168 2.753 10.429 -4.403 1169 HD2 HIS 168 2HD HIS 168 4.815 9.487 -0.915 1170 HE1 HIS 168 1HE HIS 168 1.670 11.771 -2.583 1171 HE2 HIS 168 2HE HIS 168 2.714 10.917 -0.488 1172 H LEU 169 H LEU 169 7.891 8.143 -3.180 1173 HA LEU 169 HA LEU 169 8.361 10.237 -1.331 1174 1HB LEU 169 2HB LEU 169 10.064 7.829 -1.959 1175 2HB LEU 169 1HB LEU 169 10.341 8.917 -0.624 1176 HG LEU 169 HG LEU 169 7.956 7.113 -0.975 1177 1HD1 LEU 169 1HD1 LEU 169 10.289 6.997 0.938 1178 2HD1 LEU 169 2HD1 LEU 169 9.997 5.909 -0.418 1179 3HD1 LEU 169 3HD1 LEU 169 8.890 5.925 0.954 1180 1HD2 LEU 169 1HD2 LEU 169 7.366 7.800 1.308 1181 2HD2 LEU 169 2HD2 LEU 169 7.322 9.159 0.188 1182 3HD2 LEU 169 3HD2 LEU 169 8.685 8.968 1.295 1183 H LEU 170 H LEU 170 9.967 9.191 -4.258 1184 HA LEU 170 HA LEU 170 12.168 10.950 -4.108 1185 1HB LEU 170 2HB LEU 170 10.744 9.884 -6.554 1186 2HB LEU 170 1HB LEU 170 12.309 10.665 -6.569 1187 HG LEU 170 HG LEU 170 11.689 8.041 -5.205 1188 1HD1 LEU 170 1HD1 LEU 170 11.626 7.859 -7.635 1189 2HD1 LEU 170 2HD1 LEU 170 13.047 7.051 -6.974 1190 3HD1 LEU 170 3HD1 LEU 170 13.210 8.629 -7.740 1191 1HD2 LEU 170 1HD2 LEU 170 14.126 7.876 -4.940 1192 2HD2 LEU 170 2HD2 LEU 170 13.475 9.264 -4.071 1193 3HD2 LEU 170 3HD2 LEU 170 14.306 9.498 -5.607 1194 H ALA 171 H ALA 171 8.913 11.343 -5.227 1195 HA ALA 171 HA ALA 171 9.237 13.912 -6.397 1196 1HB ALA 171 1HB ALA 171 6.815 13.894 -6.542 1197 2HB ALA 171 2HB ALA 171 6.780 12.497 -5.450 1198 3HB ALA 171 3HB ALA 171 7.493 12.338 -7.052 1199 H GLU 172 H GLU 172 8.083 12.766 -3.244 1200 HA GLU 172 HA GLU 172 7.258 15.335 -2.385 1201 1HB GLU 172 2HB GLU 172 7.858 12.879 -0.758 1202 2HB GLU 172 1HB GLU 172 7.165 14.354 -0.107 1203 1HG GLU 172 2HG GLU 172 5.946 12.528 -2.148 1204 2HG GLU 172 1HG GLU 172 5.485 12.760 -0.449 1205 H GLU 173 H GLU 173 8.059 16.148 -0.291 1206 HA GLU 173 HA GLU 173 10.757 17.080 -0.756 1207 1HB GLU 173 2HB GLU 173 8.753 17.833 1.385 1208 2HB GLU 173 1HB GLU 173 10.304 18.613 1.140 1209 1HG GLU 173 2HG GLU 173 8.093 18.523 -0.900 1210 2HG GLU 173 1HG GLU 173 8.411 19.874 0.183 Start of MODEL 9 1 H THR 17 H THR 17 0.073 -25.313 -5.933 2 HA THR 17 HA THR 17 0.486 -27.173 -3.759 3 HB THR 17 HB THR 17 1.834 -24.469 -3.944 4 HG1 THR 17 1HG THR 17 2.577 -26.956 -4.706 5 1HG2 THR 17 1HG2 THR 17 2.064 -26.618 -1.820 6 2HG2 THR 17 2HG2 THR 17 1.164 -25.108 -1.647 7 3HG2 THR 17 3HG2 THR 17 2.914 -25.079 -1.838 8 H GLU 18 H GLU 18 -1.355 -26.948 -2.586 9 HA GLU 18 HA GLU 18 -2.824 -24.454 -2.862 10 1HB GLU 18 2HB GLU 18 -4.760 -25.663 -2.050 11 2HB GLU 18 1HB GLU 18 -4.096 -26.479 -3.461 12 1HG GLU 18 2HG GLU 18 -3.721 -27.320 -0.578 13 2HG GLU 18 1HG GLU 18 -4.919 -27.981 -1.681 14 H ALA 19 H ALA 19 -3.817 -23.597 -0.960 15 HA ALA 19 HA ALA 19 -2.148 -23.888 1.374 16 1HB ALA 19 1HB ALA 19 -4.567 -22.145 0.831 17 2HB ALA 19 2HB ALA 19 -2.876 -21.653 0.774 18 3HB ALA 19 3HB ALA 19 -3.606 -22.097 2.313 19 H SER 20 H SER 20 -2.514 -25.668 2.467 20 HA SER 20 HA SER 20 -4.857 -27.203 2.361 21 1HB SER 20 2HB SER 20 -3.838 -28.433 4.299 22 2HB SER 20 1HB SER 20 -2.762 -28.242 2.917 23 HG SER 20 HG SER 20 -1.597 -26.754 3.997 24 H SER 21 H SER 21 -3.752 -24.821 4.667 25 HA SER 21 HA SER 21 -6.067 -25.167 6.351 26 1HB SER 21 2HB SER 21 -3.796 -23.187 6.524 27 2HB SER 21 1HB SER 21 -4.964 -23.576 7.786 28 HG SER 21 HG SER 21 -3.886 -25.839 6.932 29 H LEU 22 H LEU 22 -5.551 -23.675 3.466 30 HA LEU 22 HA LEU 22 -6.311 -22.024 2.269 31 1HB LEU 22 2HB LEU 22 -8.449 -21.933 4.360 32 2HB LEU 22 1HB LEU 22 -8.512 -21.009 2.867 33 HG LEU 22 HG LEU 22 -8.269 -24.009 2.945 34 1HD1 LEU 22 1HD1 LEU 22 -10.592 -24.061 2.382 35 2HD1 LEU 22 2HD1 LEU 22 -10.693 -22.290 2.585 36 3HD1 LEU 22 3HD1 LEU 22 -10.274 -23.322 3.962 37 1HD2 LEU 22 1HD2 LEU 22 -8.974 -23.834 0.595 38 2HD2 LEU 22 2HD2 LEU 22 -7.454 -22.989 0.874 39 3HD2 LEU 22 3HD2 LEU 22 -8.950 -22.081 0.721 40 H VAL 23 H VAL 23 -5.587 -21.199 5.490 41 HA VAL 23 HA VAL 23 -5.198 -18.428 4.869 42 HB VAL 23 HB VAL 23 -4.117 -20.105 7.172 43 1HG1 VAL 23 1HG1 VAL 23 -2.707 -18.133 6.730 44 2HG1 VAL 23 2HG1 VAL 23 -3.586 -17.957 8.251 45 3HG1 VAL 23 3HG1 VAL 23 -4.128 -17.098 6.808 46 1HG2 VAL 23 1HG2 VAL 23 -6.373 -18.151 7.006 47 2HG2 VAL 23 2HG2 VAL 23 -5.823 -18.937 8.492 48 3HG2 VAL 23 3HG2 VAL 23 -6.537 -19.899 7.182 49 H GLY 24 H GLY 24 -3.481 -17.612 3.972 50 1HA GLY 24 2HA GLY 24 -1.103 -19.301 3.710 51 2HA GLY 24 1HA GLY 24 -1.848 -18.623 2.267 52 H LYS 25 H LYS 25 0.752 -18.164 3.026 53 HA LYS 25 HA LYS 25 0.697 -15.327 3.764 54 1HB LYS 25 2HB LYS 25 2.876 -17.345 4.092 55 2HB LYS 25 1HB LYS 25 3.062 -15.605 4.159 56 1HG LYS 25 2HG LYS 25 1.573 -15.577 6.107 57 2HG LYS 25 1HG LYS 25 1.528 -17.347 6.053 58 1HD LYS 25 2HD LYS 25 3.241 -16.503 7.632 59 2HD LYS 25 1HD LYS 25 3.924 -17.481 6.337 60 1HE LYS 25 2HE LYS 25 4.612 -15.433 5.112 61 2HE LYS 25 1HE LYS 25 3.881 -14.432 6.350 62 1HZ LYS 25 1HZ LYS 25 6.209 -16.251 6.715 63 2HZ LYS 25 2HZ LYS 25 5.514 -15.333 7.951 64 3HZ LYS 25 3HZ LYS 25 6.274 -14.566 6.672 65 H LEU 26 H LEU 26 1.977 -13.999 2.600 66 HA LEU 26 HA LEU 26 3.762 -15.227 0.777 67 1HB LEU 26 2HB LEU 26 1.763 -14.728 -0.592 68 2HB LEU 26 1HB LEU 26 1.841 -13.056 -0.085 69 HG LEU 26 HG LEU 26 3.994 -12.815 -1.251 70 1HD1 LEU 26 1HD1 LEU 26 4.765 -15.130 -1.162 71 2HD1 LEU 26 2HD1 LEU 26 4.710 -14.551 -2.825 72 3HD1 LEU 26 3HD1 LEU 26 3.442 -15.620 -2.223 73 1HD2 LEU 26 1HD2 LEU 26 1.926 -12.214 -2.318 74 2HD2 LEU 26 2HD2 LEU 26 1.733 -13.867 -2.921 75 3HD2 LEU 26 3HD2 LEU 26 3.085 -12.875 -3.484 76 H GLU 27 H GLU 27 5.637 -14.265 0.837 77 HA GLU 27 HA GLU 27 5.747 -11.641 2.083 78 1HB GLU 27 2HB GLU 27 5.934 -13.466 3.800 79 2HB GLU 27 1HB GLU 27 7.397 -13.996 3.000 80 1HG GLU 27 2HG GLU 27 8.501 -11.961 3.550 81 2HG GLU 27 1HG GLU 27 7.013 -11.272 4.208 82 H THR 28 H THR 28 7.275 -10.348 1.163 83 HA THR 28 HA THR 28 9.439 -11.547 -0.316 84 HB THR 28 HB THR 28 7.569 -11.439 -2.033 85 HG1 THR 28 1HG THR 28 9.631 -11.273 -2.776 86 1HG2 THR 28 1HG2 THR 28 6.392 -9.448 -1.150 87 2HG2 THR 28 2HG2 THR 28 6.828 -9.221 -2.840 88 3HG2 THR 28 3HG2 THR 28 7.766 -8.433 -1.580 89 H ASP 29 H ASP 29 10.850 -9.694 -1.247 90 HA ASP 29 HA ASP 29 10.716 -7.355 0.525 91 1HB ASP 29 2HB ASP 29 13.251 -8.795 -0.295 92 2HB ASP 29 1HB ASP 29 13.172 -7.328 0.664 93 H VAL 30 H VAL 30 10.486 -5.626 -0.645 94 HA VAL 30 HA VAL 30 11.536 -5.625 -3.385 95 HB VAL 30 HB VAL 30 9.334 -3.891 -2.184 96 1HG1 VAL 30 1HG1 VAL 30 10.593 -2.705 -3.920 97 2HG1 VAL 30 2HG1 VAL 30 8.952 -3.060 -4.431 98 3HG1 VAL 30 3HG1 VAL 30 10.294 -4.032 -5.048 99 1HG2 VAL 30 1HG2 VAL 30 9.158 -6.135 -4.194 100 2HG2 VAL 30 2HG2 VAL 30 7.823 -5.099 -3.683 101 3HG2 VAL 30 3HG2 VAL 30 8.589 -6.188 -2.522 102 H GLU 31 H GLU 31 12.797 -3.857 -4.028 103 HA GLU 31 HA GLU 31 13.947 -2.447 -1.735 104 1HB GLU 31 2HB GLU 31 15.180 -2.513 -4.468 105 2HB GLU 31 1HB GLU 31 15.853 -2.279 -2.845 106 1HG GLU 31 2HG GLU 31 15.631 -4.585 -2.322 107 2HG GLU 31 1HG GLU 31 14.799 -4.903 -3.839 108 H ILE 32 H ILE 32 13.310 -0.390 -1.580 109 HA ILE 32 HA ILE 32 12.477 0.983 -4.007 110 HB ILE 32 HB ILE 32 11.891 2.903 -2.548 111 1HG1 ILE 32 2HG1 ILE 32 12.692 1.115 -0.233 112 2HG1 ILE 32 1HG1 ILE 32 13.589 2.523 -0.791 113 1HG2 ILE 32 1HG2 ILE 32 10.170 1.291 -3.018 114 2HG2 ILE 32 2HG2 ILE 32 9.979 1.894 -1.370 115 3HG2 ILE 32 3HG2 ILE 32 10.676 0.298 -1.650 116 1HD1 ILE 32 1HD1 ILE 32 12.291 3.028 1.190 117 2HD1 ILE 32 2HD1 ILE 32 10.810 2.536 0.367 118 3HD1 ILE 32 3HD1 ILE 32 11.705 3.952 -0.192 119 H LYS 33 H LYS 33 13.579 2.959 -4.614 120 HA LYS 33 HA LYS 33 16.375 2.598 -3.851 121 1HB LYS 33 2HB LYS 33 15.275 3.692 -6.443 122 2HB LYS 33 1HB LYS 33 16.986 3.496 -6.062 123 1HG LYS 33 2HG LYS 33 16.629 1.069 -5.841 124 2HG LYS 33 1HG LYS 33 14.935 1.305 -6.251 125 1HD LYS 33 2HD LYS 33 15.656 2.260 -8.412 126 2HD LYS 33 1HD LYS 33 17.324 1.859 -7.989 127 1HE LYS 33 2HE LYS 33 15.042 -0.091 -8.233 128 2HE LYS 33 1HE LYS 33 16.320 0.149 -9.426 129 1HZ LYS 33 1HZ LYS 33 16.697 -0.864 -6.640 130 2HZ LYS 33 2HZ LYS 33 17.921 -0.658 -7.770 131 3HZ LYS 33 3HZ LYS 33 16.719 -1.800 -8.025 132 H ALA 34 H ALA 34 14.231 4.178 -2.698 133 HA ALA 34 HA ALA 34 15.696 6.695 -2.514 134 1HB ALA 34 1HB ALA 34 12.840 6.042 -1.764 135 2HB ALA 34 2HB ALA 34 13.352 7.003 -3.152 136 3HB ALA 34 3HB ALA 34 13.627 7.603 -1.514 137 H SER 35 H SER 35 15.920 7.455 -0.251 138 HA SER 35 HA SER 35 16.665 5.214 1.378 139 1HB SER 35 2HB SER 35 18.086 7.258 1.276 140 2HB SER 35 1HB SER 35 16.808 8.155 2.097 141 HG SER 35 HG SER 35 17.786 7.459 3.893 142 H ALA 36 H ALA 36 15.893 4.655 3.348 143 HA ALA 36 HA ALA 36 13.147 4.707 3.810 144 1HB ALA 36 1HB ALA 36 14.645 2.995 4.722 145 2HB ALA 36 2HB ALA 36 13.645 3.716 5.982 146 3HB ALA 36 3HB ALA 36 15.335 4.190 5.818 147 H ASP 37 H ASP 37 15.624 6.901 4.791 148 HA ASP 37 HA ASP 37 14.408 8.308 6.886 149 1HB ASP 37 2HB ASP 37 16.090 9.465 4.661 150 2HB ASP 37 1HB ASP 37 15.743 10.247 6.196 151 H LYS 38 H LYS 38 14.007 8.475 3.412 152 HA LYS 38 HA LYS 38 12.487 10.852 3.470 153 1HB LYS 38 2HB LYS 38 12.656 8.802 1.303 154 2HB LYS 38 1HB LYS 38 12.005 10.424 1.143 155 1HG LYS 38 2HG LYS 38 14.300 11.227 1.888 156 2HG LYS 38 1HG LYS 38 14.841 9.578 1.554 157 1HD LYS 38 2HD LYS 38 15.228 10.585 -0.468 158 2HD LYS 38 1HD LYS 38 13.592 9.938 -0.675 159 1HE LYS 38 2HE LYS 38 14.338 12.833 -0.101 160 2HE LYS 38 1HE LYS 38 13.626 12.122 -1.561 161 1HZ LYS 38 1HZ LYS 38 11.602 11.749 -0.404 162 2HZ LYS 38 2HZ LYS 38 12.051 13.333 -0.251 163 3HZ LYS 38 3HZ LYS 38 12.226 12.350 1.055 164 H PHE 39 H PHE 39 11.765 7.465 3.761 165 HA PHE 39 HA PHE 39 8.967 7.693 3.275 166 1HB PHE 39 2HB PHE 39 10.212 5.506 3.204 167 2HB PHE 39 1HB PHE 39 10.434 5.616 4.942 168 HD1 PHE 39 1HD PHE 39 7.976 5.119 2.256 169 HD2 PHE 39 2HD PHE 39 8.663 5.059 6.452 170 HE1 PHE 39 1HE PHE 39 5.830 3.966 2.587 171 HE2 PHE 39 2HE PHE 39 6.516 3.905 6.789 172 HZ PHE 39 HZ PHE 39 5.097 3.360 4.858 173 H HIS 40 H HIS 40 11.052 7.982 6.035 174 HA HIS 40 HA HIS 40 9.009 8.360 7.987 175 1HB HIS 40 2HB HIS 40 11.275 7.655 8.598 176 2HB HIS 40 1HB HIS 40 11.932 9.154 7.962 177 HD1 HIS 40 1HD HIS 40 10.033 7.761 10.869 178 HD2 HIS 40 2HD HIS 40 11.791 11.331 9.705 179 HE1 HIS 40 1HE HIS 40 10.143 9.171 12.944 180 HE2 HIS 40 2HE HIS 40 11.280 11.298 12.231 181 H HIS 41 H HIS 41 10.883 10.466 5.938 182 HA HIS 41 HA HIS 41 9.809 12.861 7.065 183 1HB HIS 41 2HB HIS 41 11.632 12.423 4.732 184 2HB HIS 41 1HB HIS 41 10.894 13.991 5.001 185 HD1 HIS 41 1HD HIS 41 12.007 15.504 6.682 186 HD2 HIS 41 2HD HIS 41 13.398 11.594 6.910 187 HE1 HIS 41 1HE HIS 41 13.941 15.569 8.236 188 HE2 HIS 41 2HE HIS 41 14.848 13.251 8.275 189 H MET 42 H MET 42 8.778 10.839 4.479 190 HA MET 42 HA MET 42 7.539 12.710 2.858 191 1HB MET 42 2HB MET 42 6.205 10.929 1.811 192 2HB MET 42 1HB MET 42 7.885 10.489 1.983 193 1HG MET 42 2HG MET 42 6.563 8.568 2.423 194 2HG MET 42 1HG MET 42 7.253 9.105 3.948 195 1HE MET 42 1HE MET 42 5.532 7.459 5.175 196 2HE MET 42 2HE MET 42 4.841 7.002 3.619 197 3HE MET 42 3HE MET 42 3.787 7.521 4.931 198 H PHE 43 H PHE 43 6.398 11.752 5.896 199 HA PHE 43 HA PHE 43 3.662 12.362 5.509 200 1HB PHE 43 2HB PHE 43 5.360 12.600 8.007 201 2HB PHE 43 1HB PHE 43 3.608 12.718 7.978 202 HD1 PHE 43 1HD PHE 43 2.251 10.724 7.540 203 HD2 PHE 43 2HD PHE 43 6.487 10.498 7.885 204 HE1 PHE 43 1HE PHE 43 2.090 8.293 7.858 205 HE2 PHE 43 2HE PHE 43 6.336 8.064 8.206 206 HZ PHE 43 HZ PHE 43 4.136 6.957 8.196 207 H ALA 44 H ALA 44 6.506 14.279 6.118 208 HA ALA 44 HA ALA 44 4.902 16.739 6.054 209 1HB ALA 44 1HB ALA 44 6.484 16.571 7.923 210 2HB ALA 44 2HB ALA 44 6.950 17.872 6.828 211 3HB ALA 44 3HB ALA 44 7.812 16.335 6.785 212 H GLY 45 H GLY 45 7.734 15.181 4.640 213 1HA GLY 45 2HA GLY 45 7.840 15.171 2.177 214 2HA GLY 45 1HA GLY 45 7.486 16.895 2.262 215 H LYS 46 H LYS 46 9.165 18.086 1.990 216 HA LYS 46 HA LYS 46 11.814 17.177 2.822 217 1HB LYS 46 2HB LYS 46 10.840 19.312 0.937 218 2HB LYS 46 1HB LYS 46 12.511 19.271 1.469 219 1HG LYS 46 2HG LYS 46 11.125 17.019 0.014 220 2HG LYS 46 1HG LYS 46 12.119 18.256 -0.766 221 1HD LYS 46 2HD LYS 46 14.042 17.569 0.591 222 2HD LYS 46 1HD LYS 46 13.063 16.342 1.380 223 1HE LYS 46 2HE LYS 46 14.484 15.392 -0.376 224 2HE LYS 46 1HE LYS 46 12.784 15.172 -0.740 225 1HZ LYS 46 1HZ LYS 46 14.545 17.266 -1.934 226 2HZ LYS 46 2HZ LYS 46 12.908 17.020 -2.285 227 3HZ LYS 46 3HZ LYS 46 14.039 15.852 -2.671 228 HA PRO 47 HA PRO 47 12.393 19.892 6.323 229 1HB PRO 47 2HB PRO 47 14.291 21.645 5.060 230 2HB PRO 47 1HB PRO 47 14.612 20.349 6.212 231 1HG PRO 47 2HG PRO 47 14.766 20.319 3.253 232 2HG PRO 47 1HG PRO 47 15.637 19.330 4.435 233 1HD PRO 47 2HD PRO 47 13.704 18.293 2.942 234 2HD PRO 47 1HD PRO 47 13.878 17.825 4.646 235 H HIS 48 H HIS 48 12.416 21.662 3.242 236 HA HIS 48 HA HIS 48 10.146 23.214 4.170 237 1HB HIS 48 2HB HIS 48 12.108 24.593 4.844 238 2HB HIS 48 1HB HIS 48 12.651 24.610 3.176 239 HD1 HIS 48 1HD HIS 48 10.209 26.210 5.492 240 HD2 HIS 48 2HD HIS 48 11.138 26.282 1.444 241 HE1 HIS 48 1HE HIS 48 9.013 28.203 4.554 242 HE2 HIS 48 2HE HIS 48 9.942 28.410 2.246 243 H HIS 49 H HIS 49 12.429 22.663 1.533 244 HA HIS 49 HA HIS 49 12.225 22.389 -0.675 245 1HB HIS 49 2HB HIS 49 10.451 20.761 -0.306 246 2HB HIS 49 1HB HIS 49 9.260 22.040 -0.109 247 HD1 HIS 49 1HD HIS 49 10.601 19.736 -2.590 248 HD2 HIS 49 2HD HIS 49 8.893 23.517 -2.675 249 HE1 HIS 49 1HE HIS 49 9.820 20.051 -4.928 250 HE2 HIS 49 2HE HIS 49 8.405 22.118 -4.793 251 H VAL 50 H VAL 50 12.753 24.035 -1.864 252 HA VAL 50 HA VAL 50 10.811 26.204 -2.118 253 HB VAL 50 HB VAL 50 12.691 27.749 -2.583 254 1HG1 VAL 50 1HG1 VAL 50 12.980 26.268 0.020 255 2HG1 VAL 50 2HG1 VAL 50 11.846 27.575 -0.309 256 3HG1 VAL 50 3HG1 VAL 50 13.583 27.899 -0.299 257 1HG2 VAL 50 1HG2 VAL 50 14.294 26.126 -3.449 258 2HG2 VAL 50 2HG2 VAL 50 14.454 25.415 -1.843 259 3HG2 VAL 50 3HG2 VAL 50 15.012 27.064 -2.135 260 H SER 51 H SER 51 10.518 27.044 -4.197 261 HA SER 51 HA SER 51 11.303 25.220 -6.322 262 1HB SER 51 2HB SER 51 8.907 25.806 -6.106 263 2HB SER 51 1HB SER 51 9.301 27.513 -6.285 264 HG SER 51 HG SER 51 8.908 27.085 -8.270 265 H LYS 52 H LYS 52 13.150 25.687 -7.314 266 HA LYS 52 HA LYS 52 14.826 26.764 -8.378 267 1HB LYS 52 2HB LYS 52 13.089 28.052 -9.544 268 2HB LYS 52 1HB LYS 52 13.021 29.196 -8.215 269 1HG LYS 52 2HG LYS 52 15.330 29.886 -8.698 270 2HG LYS 52 1HG LYS 52 15.387 28.724 -10.024 271 1HD LYS 52 2HD LYS 52 13.448 30.995 -9.798 272 2HD LYS 52 1HD LYS 52 14.936 31.033 -10.764 273 1HE LYS 52 2HE LYS 52 14.108 29.161 -12.090 274 2HE LYS 52 1HE LYS 52 12.642 29.104 -11.124 275 1HZ LYS 52 1HZ LYS 52 12.277 30.240 -13.195 276 2HZ LYS 52 2HZ LYS 52 13.465 31.389 -12.845 277 3HZ LYS 52 3HZ LYS 52 12.065 31.299 -11.910 278 H ALA 53 H ALA 53 16.622 28.234 -7.901 279 HA ALA 53 HA ALA 53 16.866 28.539 -5.052 280 1HB ALA 53 1HB ALA 53 18.797 27.714 -6.321 281 2HB ALA 53 2HB ALA 53 19.181 29.234 -5.508 282 3HB ALA 53 3HB ALA 53 18.843 29.218 -7.236 283 H SER 54 H SER 54 15.317 30.008 -4.646 284 HA SER 54 HA SER 54 16.010 32.778 -4.848 285 1HB SER 54 2HB SER 54 13.481 31.676 -6.158 286 2HB SER 54 1HB SER 54 13.848 33.384 -5.955 287 HG SER 54 HG SER 54 15.855 32.030 -7.153 288 HA PRO 55 HA PRO 55 13.532 32.765 -1.042 289 1HB PRO 55 2HB PRO 55 11.659 34.718 -2.312 290 2HB PRO 55 1HB PRO 55 12.453 34.812 -0.735 291 1HG PRO 55 2HG PRO 55 13.349 36.296 -2.721 292 2HG PRO 55 1HG PRO 55 14.499 35.452 -1.666 293 1HD PRO 55 2HD PRO 55 13.594 34.747 -4.427 294 2HD PRO 55 1HD PRO 55 15.224 34.653 -3.721 295 H GLY 56 H GLY 56 12.481 30.893 -0.884 296 1HA GLY 56 2HA GLY 56 10.697 29.860 -2.790 297 2HA GLY 56 1HA GLY 56 10.957 29.225 -1.177 298 H ASN 57 H ASN 57 10.087 30.993 0.508 299 HA ASN 57 HA ASN 57 8.268 31.850 1.560 300 1HB ASN 57 2HB ASN 57 8.172 33.447 -0.373 301 2HB ASN 57 1HB ASN 57 7.133 32.322 -1.222 302 1HD2 ASN 57 1HD2 ASN 57 6.659 35.071 -0.440 303 2HD2 ASN 57 2HD2 ASN 57 5.237 35.062 0.539 304 H ILE 58 H ILE 58 6.809 30.312 -1.234 305 HA ILE 58 HA ILE 58 4.910 28.916 0.365 306 HB ILE 58 HB ILE 58 5.665 28.543 -2.554 307 1HG1 ILE 58 2HG1 ILE 58 3.456 30.192 -1.314 308 2HG1 ILE 58 1HG1 ILE 58 4.925 30.830 -2.032 309 1HG2 ILE 58 1HG2 ILE 58 3.187 27.683 -1.038 310 2HG2 ILE 58 2HG2 ILE 58 4.462 26.614 -1.619 311 3HG2 ILE 58 3HG2 ILE 58 3.448 27.483 -2.770 312 1HD1 ILE 58 1HD1 ILE 58 3.024 31.031 -3.556 313 2HD1 ILE 58 2HD1 ILE 58 2.776 29.287 -3.487 314 3HD1 ILE 58 3HD1 ILE 58 4.246 29.946 -4.213 315 H GLN 59 H GLN 59 5.418 27.220 1.418 316 HA GLN 59 HA GLN 59 7.848 25.751 0.780 317 1HB GLN 59 2HB GLN 59 7.513 24.642 2.967 318 2HB GLN 59 1HB GLN 59 7.681 26.386 3.072 319 1HG GLN 59 2HG GLN 59 5.288 26.618 3.352 320 2HG GLN 59 1HG GLN 59 5.085 24.875 3.175 321 1HE2 GLN 59 1HE2 GLN 59 4.168 24.700 5.173 322 2HE2 GLN 59 2HE2 GLN 59 5.072 24.836 6.635 323 H GLY 60 H GLY 60 7.913 23.522 0.622 324 1HA GLY 60 2HA GLY 60 5.527 22.445 -0.653 325 2HA GLY 60 1HA GLY 60 7.139 21.739 -0.699 326 H CYS 61 H CYS 61 6.518 22.674 2.397 327 HA CYS 61 HA CYS 61 6.126 19.983 3.286 328 1HB CYS 61 2HB CYS 61 5.981 22.538 4.902 329 2HB CYS 61 1HB CYS 61 6.230 20.911 5.524 330 HG CYS 61 HG CYS 61 8.801 20.616 4.496 331 H ASP 62 H ASP 62 4.193 19.509 2.274 332 HA ASP 62 HA ASP 62 1.801 21.023 2.707 333 1HB ASP 62 2HB ASP 62 2.119 19.786 0.641 334 2HB ASP 62 1HB ASP 62 2.251 18.280 1.539 335 H LEU 63 H LEU 63 3.339 18.296 4.099 336 HA LEU 63 HA LEU 63 2.905 16.872 5.769 337 1HB LEU 63 2HB LEU 63 2.727 18.960 7.123 338 2HB LEU 63 1HB LEU 63 1.022 19.041 6.757 339 HG LEU 63 HG LEU 63 0.652 16.969 8.043 340 1HD1 LEU 63 1HD1 LEU 63 2.832 15.924 7.731 341 2HD1 LEU 63 2HD1 LEU 63 2.439 16.071 9.444 342 3HD1 LEU 63 3HD1 LEU 63 3.588 17.189 8.702 343 1HD2 LEU 63 1HD2 LEU 63 2.139 19.129 9.529 344 2HD2 LEU 63 2HD2 LEU 63 1.089 17.918 10.254 345 3HD2 LEU 63 3HD2 LEU 63 0.413 19.118 9.152 346 H HIS 64 H HIS 64 2.131 15.369 4.525 347 HA HIS 64 HA HIS 64 -0.668 15.402 3.736 348 1HB HIS 64 2HB HIS 64 1.088 14.971 2.036 349 2HB HIS 64 1HB HIS 64 1.574 13.531 2.911 350 HD1 HIS 64 1HD HIS 64 -0.780 14.766 0.356 351 HD2 HIS 64 2HD HIS 64 -0.392 11.388 2.756 352 HE1 HIS 64 1HE HIS 64 -2.228 13.047 -0.677 353 HE2 HIS 64 2HE HIS 64 -2.287 11.221 1.012 354 H GLU 65 H GLU 65 -1.789 14.834 5.504 355 HA GLU 65 HA GLU 65 -1.163 12.267 6.798 356 1HB GLU 65 2HB GLU 65 -2.852 14.572 7.765 357 2HB GLU 65 1HB GLU 65 -2.535 13.094 8.655 358 1HG GLU 65 2HG GLU 65 -0.169 13.660 8.762 359 2HG GLU 65 1HG GLU 65 -0.473 15.130 7.841 360 H GLY 66 H GLY 66 -2.968 10.868 7.240 361 1HA GLY 66 2HA GLY 66 -4.821 10.715 5.078 362 2HA GLY 66 1HA GLY 66 -4.823 9.690 6.513 363 H ASP 67 H ASP 67 -6.901 11.348 4.998 364 HA ASP 67 HA ASP 67 -7.607 13.521 6.621 365 1HB ASP 67 2HB ASP 67 -9.304 12.006 4.653 366 2HB ASP 67 1HB ASP 67 -9.780 13.513 5.426 367 H TRP 68 H TRP 68 -8.182 10.217 7.158 368 HA TRP 68 HA TRP 68 -10.226 10.916 9.143 369 1HB TRP 68 2HB TRP 68 -9.296 8.233 8.186 370 2HB TRP 68 1HB TRP 68 -10.595 8.478 9.350 371 HD1 TRP 68 HD TRP 68 -9.917 8.281 5.667 372 HE1 TRP 68 1HE TRP 68 -12.085 8.693 4.338 373 HE3 TRP 68 3HE TRP 68 -12.884 9.962 9.469 374 HZ2 TRP 68 2HZ TRP 68 -14.697 9.612 4.837 375 HZ3 TRP 68 3HZ TRP 68 -15.205 10.592 8.960 376 HH2 TRP 68 HH TRP 68 -16.093 10.421 6.688 377 H GLY 69 H GLY 69 -7.175 11.324 9.276 378 1HA GLY 69 2HA GLY 69 -5.987 11.591 11.308 379 2HA GLY 69 1HA GLY 69 -6.907 10.263 12.000 380 H THR 70 H THR 70 -5.801 9.676 8.899 381 HA THR 70 HA THR 70 -4.224 8.383 7.953 382 HB THR 70 HB THR 70 -2.578 8.831 10.469 383 HG1 THR 70 1HG THR 70 -2.019 10.678 9.599 384 1HG2 THR 70 1HG2 THR 70 -0.645 8.283 9.028 385 2HG2 THR 70 2HG2 THR 70 -1.746 7.953 7.689 386 3HG2 THR 70 3HG2 THR 70 -1.774 6.931 9.125 387 H VAL 71 H VAL 71 -3.887 7.307 11.369 388 HA VAL 71 HA VAL 71 -4.060 4.595 10.486 389 HB VAL 71 HB VAL 71 -4.280 5.690 13.318 390 1HG1 VAL 71 1HG1 VAL 71 -3.817 2.889 12.316 391 2HG1 VAL 71 2HG1 VAL 71 -5.269 3.488 13.103 392 3HG1 VAL 71 3HG1 VAL 71 -3.757 3.389 14.015 393 1HG2 VAL 71 1HG2 VAL 71 -1.938 4.990 13.545 394 2HG2 VAL 71 2HG2 VAL 71 -2.122 6.212 12.282 395 3HG2 VAL 71 3HG2 VAL 71 -1.924 4.513 11.848 396 H GLY 72 H GLY 72 -5.863 3.504 10.011 397 1HA GLY 72 2HA GLY 72 -8.054 2.830 10.291 398 2HA GLY 72 1HA GLY 72 -8.346 4.236 11.313 399 H SER 73 H SER 73 -6.656 5.340 8.734 400 HA SER 73 HA SER 73 -9.046 6.503 7.600 401 1HB SER 73 2HB SER 73 -6.917 7.823 8.125 402 2HB SER 73 1HB SER 73 -6.153 6.963 6.797 403 HG SER 73 HG SER 73 -7.512 8.045 5.347 404 H ILE 74 H ILE 74 -9.501 6.450 5.366 405 HA ILE 74 HA ILE 74 -8.496 4.055 4.043 406 HB ILE 74 HB ILE 74 -11.337 5.039 4.216 407 1HG1 ILE 74 2HG1 ILE 74 -10.015 2.459 4.994 408 2HG1 ILE 74 1HG1 ILE 74 -10.479 3.743 6.101 409 1HG2 ILE 74 1HG2 ILE 74 -11.919 3.180 2.739 410 2HG2 ILE 74 2HG2 ILE 74 -10.207 2.811 2.531 411 3HG2 ILE 74 3HG2 ILE 74 -10.862 4.334 1.930 412 1HD1 ILE 74 1HD1 ILE 74 -12.290 2.071 4.389 413 2HD1 ILE 74 2HD1 ILE 74 -12.824 3.346 5.495 414 3HD1 ILE 74 3HD1 ILE 74 -12.044 1.887 6.128 415 H VAL 75 H VAL 75 -7.566 4.523 2.250 416 HA VAL 75 HA VAL 75 -8.401 6.854 0.633 417 HB VAL 75 HB VAL 75 -5.643 5.558 0.755 418 1HG1 VAL 75 1HG1 VAL 75 -6.105 6.549 -1.420 419 2HG1 VAL 75 2HG1 VAL 75 -4.878 7.479 -0.558 420 3HG1 VAL 75 3HG1 VAL 75 -6.536 8.074 -0.647 421 1HG2 VAL 75 1HG2 VAL 75 -4.877 7.602 1.888 422 2HG2 VAL 75 2HG2 VAL 75 -6.101 6.755 2.835 423 3HG2 VAL 75 3HG2 VAL 75 -6.533 8.200 1.920 424 H PHE 76 H PHE 76 -8.539 6.452 -1.660 425 HA PHE 76 HA PHE 76 -8.555 3.584 -2.303 426 1HB PHE 76 2HB PHE 76 -10.494 5.686 -3.247 427 2HB PHE 76 1HB PHE 76 -10.419 4.047 -3.870 428 HD1 PHE 76 1HD PHE 76 -10.302 2.301 -1.843 429 HD2 PHE 76 2HD PHE 76 -12.207 6.073 -1.791 430 HE1 PHE 76 1HE PHE 76 -11.755 1.499 -0.072 431 HE2 PHE 76 2HE PHE 76 -13.715 5.304 0.000 432 HZ PHE 76 HZ PHE 76 -13.499 2.998 0.868 433 H TRP 77 H TRP 77 -7.976 2.932 -4.319 434 HA TRP 77 HA TRP 77 -6.973 5.000 -6.139 435 1HB TRP 77 2HB TRP 77 -6.059 2.108 -5.944 436 2HB TRP 77 1HB TRP 77 -5.559 3.248 -7.173 437 HD1 TRP 77 HD TRP 77 -4.758 5.700 -5.416 438 HE1 TRP 77 1HE TRP 77 -2.688 5.562 -3.883 439 HE3 TRP 77 3HE TRP 77 -4.419 0.633 -4.996 440 HZ2 TRP 77 2HZ TRP 77 -1.114 3.562 -2.696 441 HZ3 TRP 77 3HZ TRP 77 -2.594 -0.320 -3.658 442 HH2 TRP 77 HH TRP 77 -0.977 1.110 -2.531 443 H ASN 78 H ASN 78 -8.244 5.211 -7.831 444 HA ASN 78 HA ASN 78 -9.764 2.863 -8.751 445 1HB ASN 78 2HB ASN 78 -10.241 5.818 -9.335 446 2HB ASN 78 1HB ASN 78 -11.178 4.500 -10.008 447 1HD2 ASN 78 1HD2 ASN 78 -13.080 5.276 -9.178 448 2HD2 ASN 78 2HD2 ASN 78 -13.456 5.251 -7.493 449 H TYR 79 H TYR 79 -9.180 2.061 -10.730 450 HA TYR 79 HA TYR 79 -7.765 3.688 -12.591 451 1HB TYR 79 2HB TYR 79 -5.656 2.365 -12.520 452 2HB TYR 79 1HB TYR 79 -5.922 3.315 -11.066 453 HD1 TYR 79 1HD TYR 79 -5.459 0.003 -12.440 454 HD2 TYR 79 2HD TYR 79 -6.662 2.134 -8.963 455 HE1 TYR 79 1HE TYR 79 -5.156 -2.023 -11.091 456 HE2 TYR 79 2HE TYR 79 -6.364 0.104 -7.608 457 HH TYR 79 HH TYR 79 -4.741 -2.632 -8.760 458 H VAL 80 H VAL 80 -7.424 2.620 -14.550 459 HA VAL 80 HA VAL 80 -8.885 0.101 -14.763 460 HB VAL 80 HB VAL 80 -8.222 2.124 -16.930 461 1HG1 VAL 80 1HG1 VAL 80 -9.638 0.750 -18.386 462 2HG1 VAL 80 2HG1 VAL 80 -9.882 -0.394 -17.065 463 3HG1 VAL 80 3HG1 VAL 80 -8.282 -0.183 -17.766 464 1HG2 VAL 80 1HG2 VAL 80 -10.644 2.541 -16.972 465 2HG2 VAL 80 2HG2 VAL 80 -9.939 2.920 -15.398 466 3HG2 VAL 80 3HG2 VAL 80 -10.840 1.422 -15.618 467 H HIS 81 H HIS 81 -7.714 -1.609 -14.977 468 HA HIS 81 HA HIS 81 -4.932 -1.298 -15.859 469 1HB HIS 81 2HB HIS 81 -5.305 -2.054 -13.495 470 2HB HIS 81 1HB HIS 81 -6.177 -3.445 -14.108 471 HD1 HIS 81 1HD HIS 81 -2.815 -2.228 -13.267 472 HD2 HIS 81 2HD HIS 81 -4.456 -5.357 -15.449 473 HE1 HIS 81 1HE HIS 81 -0.975 -3.886 -13.536 474 HE2 HIS 81 2HE HIS 81 -1.933 -5.661 -15.045 475 H ASP 82 H ASP 82 -4.851 -1.826 -17.930 476 HA ASP 82 HA ASP 82 -4.965 -2.942 -19.881 477 1HB ASP 82 2HB ASP 82 -5.357 -5.268 -18.018 478 2HB ASP 82 1HB ASP 82 -5.316 -5.482 -19.766 479 H GLY 83 H GLY 83 -7.298 -1.653 -19.032 480 1HA GLY 83 2HA GLY 83 -9.295 -1.356 -20.255 481 2HA GLY 83 1HA GLY 83 -9.138 -3.000 -20.853 482 H GLU 84 H GLU 84 -8.646 -3.569 -17.773 483 HA GLU 84 HA GLU 84 -11.491 -3.730 -17.197 484 1HB GLU 84 2HB GLU 84 -9.201 -5.334 -16.101 485 2HB GLU 84 1HB GLU 84 -10.830 -5.408 -15.439 486 1HG GLU 84 2HG GLU 84 -11.660 -6.110 -17.613 487 2HG GLU 84 1HG GLU 84 -10.015 -6.078 -18.232 488 H ALA 85 H ALA 85 -12.315 -2.783 -15.607 489 HA ALA 85 HA ALA 85 -10.806 -0.704 -14.316 490 1HB ALA 85 1HB ALA 85 -13.684 -1.504 -13.922 491 2HB ALA 85 2HB ALA 85 -13.088 -0.291 -15.056 492 3HB ALA 85 3HB ALA 85 -12.931 -0.028 -13.320 493 H LYS 86 H LYS 86 -9.870 -0.757 -12.413 494 HA LYS 86 HA LYS 86 -10.607 -2.867 -10.559 495 1HB LYS 86 2HB LYS 86 -7.896 -1.929 -11.389 496 2HB LYS 86 1HB LYS 86 -8.134 -2.477 -9.747 497 1HG LYS 86 2HG LYS 86 -7.202 -4.201 -11.185 498 2HG LYS 86 1HG LYS 86 -8.775 -4.682 -10.550 499 1HD LYS 86 2HD LYS 86 -9.762 -4.083 -12.720 500 2HD LYS 86 1HD LYS 86 -8.161 -3.633 -13.307 501 1HE LYS 86 2HE LYS 86 -8.783 -5.879 -14.028 502 2HE LYS 86 1HE LYS 86 -7.367 -5.897 -12.966 503 1HZ LYS 86 1HZ LYS 86 -10.160 -6.586 -12.188 504 2HZ LYS 86 2HZ LYS 86 -8.841 -6.604 -11.137 505 3HZ LYS 86 3HZ LYS 86 -8.919 -7.669 -12.427 506 H VAL 87 H VAL 87 -10.671 -2.278 -8.420 507 HA VAL 87 HA VAL 87 -10.169 0.512 -7.764 508 HB VAL 87 HB VAL 87 -12.547 -1.108 -6.770 509 1HG1 VAL 87 1HG1 VAL 87 -11.839 1.795 -6.343 510 2HG1 VAL 87 2HG1 VAL 87 -11.733 0.515 -5.140 511 3HG1 VAL 87 3HG1 VAL 87 -13.307 1.003 -5.774 512 1HG2 VAL 87 1HG2 VAL 87 -12.543 1.183 -8.746 513 2HG2 VAL 87 2HG2 VAL 87 -13.978 0.418 -8.065 514 3HG2 VAL 87 3HG2 VAL 87 -12.899 -0.503 -9.111 515 H ALA 88 H ALA 88 -9.025 0.674 -5.939 516 HA ALA 88 HA ALA 88 -8.529 -1.816 -4.477 517 1HB ALA 88 1HB ALA 88 -6.540 -0.812 -5.519 518 2HB ALA 88 2HB ALA 88 -6.430 -0.781 -3.758 519 3HB ALA 88 3HB ALA 88 -6.850 0.686 -4.633 520 H LYS 89 H LYS 89 -9.627 -1.947 -2.709 521 HA LYS 89 HA LYS 89 -10.144 0.479 -1.185 522 1HB LYS 89 2HB LYS 89 -11.807 -2.044 -1.316 523 2HB LYS 89 1HB LYS 89 -12.163 -0.656 -0.302 524 1HG LYS 89 2HG LYS 89 -12.392 0.715 -2.369 525 2HG LYS 89 1HG LYS 89 -12.188 -0.762 -3.308 526 1HD LYS 89 2HD LYS 89 -14.163 -1.716 -2.251 527 2HD LYS 89 1HD LYS 89 -14.360 -0.255 -1.279 528 1HE LYS 89 2HE LYS 89 -14.593 1.040 -3.386 529 2HE LYS 89 1HE LYS 89 -14.522 -0.470 -4.287 530 1HZ LYS 89 1HZ LYS 89 -16.613 0.392 -2.368 531 2HZ LYS 89 2HZ LYS 89 -16.546 -1.174 -2.998 532 3HZ LYS 89 3HZ LYS 89 -16.782 0.148 -4.010 533 H GLU 90 H GLU 90 -9.282 0.571 0.763 534 HA GLU 90 HA GLU 90 -8.281 -1.798 2.050 535 1HB GLU 90 2HB GLU 90 -6.051 -0.754 2.176 536 2HB GLU 90 1HB GLU 90 -6.501 -1.174 0.523 537 1HG GLU 90 2HG GLU 90 -7.126 1.102 0.069 538 2HG GLU 90 1HG GLU 90 -6.817 1.557 1.722 539 H ARG 91 H ARG 91 -7.527 -1.183 4.152 540 HA ARG 91 HA ARG 91 -8.275 1.490 5.033 541 1HB ARG 91 2HB ARG 91 -10.071 -0.036 5.719 542 2HB ARG 91 1HB ARG 91 -8.889 -1.068 6.517 543 1HG ARG 91 2HG ARG 91 -8.319 0.831 8.013 544 2HG ARG 91 1HG ARG 91 -9.618 1.758 7.264 545 1HD ARG 91 2HD ARG 91 -11.224 0.075 7.972 546 2HD ARG 91 1HD ARG 91 -9.913 -0.860 8.703 547 HE ARG 91 HE ARG 91 -10.521 1.875 9.576 548 1HH1 ARG 91 1HH1 ARG 91 -10.177 -1.584 10.353 549 2HH1 ARG 91 2HH1 ARG 91 -10.230 -1.343 12.023 550 1HH2 ARG 91 1HH2 ARG 91 -10.612 2.157 11.916 551 2HH2 ARG 91 2HH2 ARG 91 -10.464 0.804 12.944 552 H ILE 92 H ILE 92 -6.646 2.369 6.208 553 HA ILE 92 HA ILE 92 -4.277 0.881 6.755 554 HB ILE 92 HB ILE 92 -5.216 3.598 7.699 555 1HG1 ILE 92 2HG1 ILE 92 -3.200 2.794 5.587 556 2HG1 ILE 92 1HG1 ILE 92 -4.801 3.459 5.294 557 1HG2 ILE 92 1HG2 ILE 92 -2.935 3.986 8.432 558 2HG2 ILE 92 2HG2 ILE 92 -2.514 2.321 8.026 559 3HG2 ILE 92 3HG2 ILE 92 -3.671 2.650 9.317 560 1HD1 ILE 92 1HD1 ILE 92 -2.539 4.894 6.683 561 2HD1 ILE 92 2HD1 ILE 92 -4.129 5.557 6.322 562 3HD1 ILE 92 3HD1 ILE 92 -3.039 5.135 5.003 563 H GLU 93 H GLU 93 -3.941 -0.404 8.368 564 HA GLU 93 HA GLU 93 -5.899 -0.472 10.533 565 1HB GLU 93 2HB GLU 93 -5.134 -2.499 9.098 566 2HB GLU 93 1HB GLU 93 -3.657 -2.432 10.025 567 1HG GLU 93 2HG GLU 93 -6.398 -2.858 11.198 568 2HG GLU 93 1HG GLU 93 -5.285 -4.147 10.776 569 H ALA 94 H ALA 94 -2.483 0.079 9.866 570 HA ALA 94 HA ALA 94 -2.157 1.483 12.353 571 1HB ALA 94 1HB ALA 94 -0.294 0.137 13.162 572 2HB ALA 94 2HB ALA 94 -0.519 -0.996 11.832 573 3HB ALA 94 3HB ALA 94 -1.768 -0.828 13.066 574 H VAL 95 H VAL 95 -0.446 2.909 12.277 575 HA VAL 95 HA VAL 95 1.530 2.700 10.151 576 HB VAL 95 HB VAL 95 -0.151 5.231 10.581 577 1HG1 VAL 95 1HG1 VAL 95 2.344 4.866 8.909 578 2HG1 VAL 95 2HG1 VAL 95 2.233 5.806 10.396 579 3HG1 VAL 95 3HG1 VAL 95 1.340 6.315 8.962 580 1HG2 VAL 95 1HG2 VAL 95 0.430 3.667 8.102 581 2HG2 VAL 95 2HG2 VAL 95 -0.626 5.069 8.231 582 3HG2 VAL 95 3HG2 VAL 95 -1.061 3.546 9.036 583 H GLU 96 H GLU 96 3.383 2.907 11.047 584 HA GLU 96 HA GLU 96 3.654 4.442 13.560 585 1HB GLU 96 2HB GLU 96 5.473 2.341 12.402 586 2HB GLU 96 1HB GLU 96 5.628 3.097 13.968 587 1HG GLU 96 2HG GLU 96 3.339 1.322 13.171 588 2HG GLU 96 1HG GLU 96 4.813 0.785 13.993 589 HA PRO 97 HA PRO 97 5.800 6.985 10.411 590 1HB PRO 97 2HB PRO 97 6.031 8.846 12.699 591 2HB PRO 97 1HB PRO 97 5.343 9.127 11.097 592 1HG PRO 97 2HG PRO 97 3.770 8.912 13.239 593 2HG PRO 97 1HG PRO 97 3.282 8.228 11.675 594 1HD PRO 97 2HD PRO 97 4.449 6.844 14.067 595 2HD PRO 97 1HD PRO 97 3.094 6.337 13.030 596 H ASP 98 H ASP 98 6.768 6.329 13.720 597 HA ASP 98 HA ASP 98 9.508 7.122 13.290 598 1HB ASP 98 2HB ASP 98 8.483 7.383 15.503 599 2HB ASP 98 1HB ASP 98 8.204 5.650 15.585 600 H LYS 99 H LYS 99 7.717 4.165 13.323 601 HA LYS 99 HA LYS 99 10.131 2.544 13.179 602 1HB LYS 99 2HB LYS 99 7.265 1.707 13.108 603 2HB LYS 99 1HB LYS 99 8.667 0.670 13.326 604 1HG LYS 99 2HG LYS 99 9.193 1.803 15.420 605 2HG LYS 99 1HG LYS 99 7.790 2.860 15.153 606 1HD LYS 99 2HD LYS 99 6.372 0.918 15.116 607 2HD LYS 99 1HD LYS 99 7.812 -0.064 15.477 608 1HE LYS 99 2HE LYS 99 8.104 0.966 17.586 609 2HE LYS 99 1HE LYS 99 6.918 2.214 17.209 610 1HZ LYS 99 1HZ LYS 99 6.017 0.563 18.710 611 2HZ LYS 99 2HZ LYS 99 6.297 -0.666 17.602 612 3HZ LYS 99 3HZ LYS 99 5.206 0.586 17.239 613 H ASN 100 H ASN 100 8.257 4.220 11.032 614 HA ASN 100 HA ASN 100 7.777 4.163 8.800 615 1HB ASN 100 2HB ASN 100 10.222 2.359 8.698 616 2HB ASN 100 1HB ASN 100 9.470 3.106 7.300 617 1HD2 ASN 100 1HD2 ASN 100 12.154 3.332 8.248 618 2HD2 ASN 100 2HD2 ASN 100 12.452 5.006 8.551 619 H LEU 101 H LEU 101 6.164 2.571 10.164 620 HA LEU 101 HA LEU 101 5.980 0.020 8.676 621 1HB LEU 101 2HB LEU 101 6.500 -0.350 11.022 622 2HB LEU 101 1HB LEU 101 5.159 0.674 11.496 623 HG LEU 101 HG LEU 101 3.617 -0.969 10.439 624 1HD1 LEU 101 1HD1 LEU 101 6.080 -2.646 10.283 625 2HD1 LEU 101 2HD1 LEU 101 5.116 -2.023 8.930 626 3HD1 LEU 101 3HD1 LEU 101 4.425 -3.204 10.045 627 1HD2 LEU 101 1HD2 LEU 101 3.753 -2.578 12.246 628 2HD2 LEU 101 2HD2 LEU 101 3.950 -0.925 12.815 629 3HD2 LEU 101 3HD2 LEU 101 5.363 -1.983 12.663 630 H ILE 102 H ILE 102 4.002 -0.473 7.775 631 HA ILE 102 HA ILE 102 1.678 0.921 8.667 632 HB ILE 102 HB ILE 102 2.444 2.496 7.026 633 1HG1 ILE 102 2HG1 ILE 102 0.227 0.877 5.756 634 2HG1 ILE 102 1HG1 ILE 102 -0.017 1.978 7.101 635 1HG2 ILE 102 1HG2 ILE 102 2.805 1.855 4.643 636 2HG2 ILE 102 2HG2 ILE 102 2.617 0.170 5.136 637 3HG2 ILE 102 3HG2 ILE 102 3.948 1.112 5.767 638 1HD1 ILE 102 1HD1 ILE 102 0.941 2.711 4.336 639 2HD1 ILE 102 2HD1 ILE 102 0.739 3.841 5.676 640 3HD1 ILE 102 3HD1 ILE 102 -0.664 3.011 5.006 641 H THR 103 H THR 103 0.094 -0.352 8.790 642 HA THR 103 HA THR 103 0.134 -3.001 7.520 643 HB THR 103 HB THR 103 -1.598 -1.927 9.767 644 HG1 THR 103 1HG THR 103 0.562 -3.707 10.152 645 1HG2 THR 103 1HG2 THR 103 -1.983 -4.299 10.273 646 2HG2 THR 103 2HG2 THR 103 -0.979 -4.749 8.899 647 3HG2 THR 103 3HG2 THR 103 -2.510 -3.915 8.632 648 H PHE 104 H PHE 104 -1.204 -3.347 5.725 649 HA PHE 104 HA PHE 104 -3.487 -1.533 5.256 650 1HB PHE 104 2HB PHE 104 -2.036 -3.362 3.312 651 2HB PHE 104 1HB PHE 104 -3.336 -2.296 2.879 652 HD1 PHE 104 1HD PHE 104 -2.914 0.226 3.262 653 HD2 PHE 104 2HD PHE 104 0.128 -2.734 3.133 654 HE1 PHE 104 1HE PHE 104 -1.258 1.947 2.677 655 HE2 PHE 104 2HE PHE 104 1.777 -1.027 2.557 656 HZ PHE 104 HZ PHE 104 1.098 1.312 2.324 657 H ARG 105 H ARG 105 -5.476 -2.399 5.539 658 HA ARG 105 HA ARG 105 -5.826 -5.326 5.336 659 1HB ARG 105 2HB ARG 105 -6.492 -4.342 7.498 660 2HB ARG 105 1HB ARG 105 -7.542 -3.209 6.657 661 1HG ARG 105 2HG ARG 105 -8.818 -5.165 5.776 662 2HG ARG 105 1HG ARG 105 -7.845 -6.196 6.819 663 1HD ARG 105 2HD ARG 105 -8.638 -4.904 8.771 664 2HD ARG 105 1HD ARG 105 -9.632 -3.944 7.662 665 HE ARG 105 HE ARG 105 -10.307 -6.541 7.174 666 1HH1 ARG 105 1HH1 ARG 105 -10.424 -4.465 10.064 667 2HH1 ARG 105 2HH1 ARG 105 -11.826 -5.216 10.684 668 1HH2 ARG 105 1HH2 ARG 105 -12.185 -7.561 8.091 669 2HH2 ARG 105 2HH2 ARG 105 -12.820 -7.022 9.569 670 H VAL 106 H VAL 106 -7.249 -6.067 3.691 671 HA VAL 106 HA VAL 106 -8.377 -3.988 1.998 672 HB VAL 106 HB VAL 106 -7.360 -6.138 0.983 673 1HG1 VAL 106 1HG1 VAL 106 -8.754 -8.123 0.899 674 2HG1 VAL 106 2HG1 VAL 106 -9.814 -7.398 2.098 675 3HG1 VAL 106 3HG1 VAL 106 -8.143 -7.763 2.526 676 1HG2 VAL 106 1HG2 VAL 106 -8.822 -4.726 -0.352 677 2HG2 VAL 106 2HG2 VAL 106 -10.236 -5.561 0.290 678 3HG2 VAL 106 3HG2 VAL 106 -9.085 -6.430 -0.727 679 H ILE 107 H ILE 107 -10.495 -3.377 2.100 680 HA ILE 107 HA ILE 107 -12.062 -4.923 4.040 681 HB ILE 107 HB ILE 107 -13.393 -3.041 4.676 682 1HG1 ILE 107 2HG1 ILE 107 -13.602 -1.929 2.405 683 2HG1 ILE 107 1HG1 ILE 107 -13.269 -0.822 3.727 684 1HG2 ILE 107 1HG2 ILE 107 -11.728 -1.486 5.557 685 2HG2 ILE 107 2HG2 ILE 107 -10.555 -2.130 4.412 686 3HG2 ILE 107 3HG2 ILE 107 -11.178 -3.166 5.706 687 1HD1 ILE 107 1HD1 ILE 107 -12.039 -0.213 1.801 688 2HD1 ILE 107 2HD1 ILE 107 -11.313 -1.826 1.711 689 3HD1 ILE 107 3HD1 ILE 107 -10.955 -0.772 3.077 690 H GLU 108 H GLU 108 -11.998 -3.839 0.829 691 HA GLU 108 HA GLU 108 -14.054 -5.642 0.069 692 1HB GLU 108 2HB GLU 108 -15.308 -3.584 0.948 693 2HB GLU 108 1HB GLU 108 -14.566 -2.679 -0.352 694 1HG GLU 108 2HG GLU 108 -15.672 -4.164 -1.978 695 2HG GLU 108 1HG GLU 108 -16.470 -4.995 -0.639 696 H GLY 109 H GLY 109 -14.325 -5.207 -2.497 697 1HA GLY 109 2HA GLY 109 -13.290 -3.938 -4.323 698 2HA GLY 109 1HA GLY 109 -11.771 -4.107 -3.466 699 H ASP 110 H ASP 110 -11.216 -4.840 -5.645 700 HA ASP 110 HA ASP 110 -12.090 -7.101 -6.978 701 1HB ASP 110 2HB ASP 110 -10.521 -5.387 -7.864 702 2HB ASP 110 1HB ASP 110 -9.264 -6.021 -6.818 703 H LEU 111 H LEU 111 -9.516 -6.866 -4.575 704 HA LEU 111 HA LEU 111 -8.751 -9.604 -4.675 705 1HB LEU 111 2HB LEU 111 -8.233 -7.526 -2.559 706 2HB LEU 111 1HB LEU 111 -7.477 -9.102 -2.606 707 HG LEU 111 HG LEU 111 -7.139 -6.956 -4.711 708 1HD1 LEU 111 1HD1 LEU 111 -4.878 -6.749 -3.824 709 2HD1 LEU 111 2HD1 LEU 111 -5.256 -7.912 -2.556 710 3HD1 LEU 111 3HD1 LEU 111 -6.083 -6.356 -2.596 711 1HD2 LEU 111 1HD2 LEU 111 -6.924 -9.206 -5.629 712 2HD2 LEU 111 2HD2 LEU 111 -5.787 -9.629 -4.350 713 3HD2 LEU 111 3HD2 LEU 111 -5.352 -8.413 -5.546 714 H MET 112 H MET 112 -11.260 -7.983 -2.975 715 HA MET 112 HA MET 112 -11.424 -9.768 -0.741 716 1HB MET 112 2HB MET 112 -12.279 -7.399 -0.789 717 2HB MET 112 1HB MET 112 -13.546 -7.952 -1.869 718 1HG MET 112 2HG MET 112 -14.666 -7.893 0.153 719 2HG MET 112 1HG MET 112 -14.145 -9.571 0.102 720 1HE MET 112 1HE MET 112 -11.956 -10.424 1.566 721 2HE MET 112 2HE MET 112 -11.154 -9.437 2.776 722 3HE MET 112 3HE MET 112 -10.910 -9.102 1.063 723 H LYS 113 H LYS 113 -12.407 -9.952 -4.011 724 HA LYS 113 HA LYS 113 -14.493 -11.916 -3.531 725 1HB LYS 113 2HB LYS 113 -13.413 -10.688 -6.062 726 2HB LYS 113 1HB LYS 113 -14.658 -11.927 -6.042 727 1HG LYS 113 2HG LYS 113 -14.877 -9.222 -4.741 728 2HG LYS 113 1HG LYS 113 -15.581 -9.679 -6.295 729 1HD LYS 113 2HD LYS 113 -16.915 -11.410 -5.189 730 2HD LYS 113 1HD LYS 113 -16.212 -10.971 -3.638 731 1HE LYS 113 2HE LYS 113 -17.163 -8.750 -3.825 732 2HE LYS 113 1HE LYS 113 -17.866 -9.161 -5.383 733 1HZ LYS 113 1HZ LYS 113 -19.491 -9.369 -3.592 734 2HZ LYS 113 2HZ LYS 113 -18.500 -10.482 -2.808 735 3HZ LYS 113 3HZ LYS 113 -19.186 -10.890 -4.282 736 H GLU 114 H GLU 114 -11.260 -11.993 -3.615 737 HA GLU 114 HA GLU 114 -11.257 -14.764 -4.597 738 1HB GLU 114 2HB GLU 114 -8.987 -12.760 -4.633 739 2HB GLU 114 1HB GLU 114 -8.832 -14.452 -5.089 740 1HG GLU 114 2HG GLU 114 -10.373 -14.180 -6.854 741 2HG GLU 114 1HG GLU 114 -10.662 -12.475 -6.450 742 H TYR 115 H TYR 115 -10.239 -12.519 -2.144 743 HA TYR 115 HA TYR 115 -9.577 -14.784 -0.414 744 1HB TYR 115 2HB TYR 115 -8.430 -11.989 -0.257 745 2HB TYR 115 1HB TYR 115 -7.893 -13.426 0.613 746 HD1 TYR 115 1HD TYR 115 -7.623 -11.481 -2.377 747 HD2 TYR 115 2HD TYR 115 -6.762 -15.292 -0.692 748 HE1 TYR 115 1HE TYR 115 -6.051 -11.940 -4.214 749 HE2 TYR 115 2HE TYR 115 -5.200 -15.745 -2.507 750 HH TYR 115 HH TYR 115 -4.142 -13.356 -4.683 751 H LYS 116 H LYS 116 -10.751 -14.758 1.407 752 HA LYS 116 HA LYS 116 -12.761 -12.715 1.603 753 1HB LYS 116 2HB LYS 116 -13.621 -14.060 3.566 754 2HB LYS 116 1HB LYS 116 -13.662 -14.860 2.008 755 1HG LYS 116 2HG LYS 116 -11.530 -16.002 2.643 756 2HG LYS 116 1HG LYS 116 -11.699 -15.280 4.243 757 1HD LYS 116 2HD LYS 116 -13.764 -17.037 2.939 758 2HD LYS 116 1HD LYS 116 -12.553 -17.634 4.071 759 1HE LYS 116 2HE LYS 116 -14.643 -15.528 4.693 760 2HE LYS 116 1HE LYS 116 -14.757 -17.232 5.114 761 1HZ LYS 116 1HZ LYS 116 -13.996 -15.868 6.962 762 2HZ LYS 116 2HZ LYS 116 -12.641 -15.383 6.110 763 3HZ LYS 116 3HZ LYS 116 -12.833 -16.988 6.553 764 H SER 117 H SER 117 -9.708 -13.019 2.700 765 HA SER 117 HA SER 117 -9.915 -10.566 4.039 766 1HB SER 117 2HB SER 117 -10.535 -11.954 5.854 767 2HB SER 117 1HB SER 117 -9.136 -13.027 5.642 768 HG SER 117 HG SER 117 -8.004 -11.656 6.756 769 H PHE 118 H PHE 118 -8.111 -9.506 3.661 770 HA PHE 118 HA PHE 118 -5.654 -10.919 3.061 771 1HB PHE 118 2HB PHE 118 -6.769 -10.613 0.848 772 2HB PHE 118 1HB PHE 118 -7.002 -8.927 1.217 773 HD1 PHE 118 1HD PHE 118 -4.380 -11.450 0.556 774 HD2 PHE 118 2HD PHE 118 -5.419 -7.335 0.661 775 HE1 PHE 118 1HE PHE 118 -2.268 -10.894 -0.560 776 HE2 PHE 118 2HE PHE 118 -3.307 -6.769 -0.462 777 HZ PHE 118 HZ PHE 118 -1.732 -8.539 -1.072 778 H LEU 119 H LEU 119 -4.232 -9.975 4.437 779 HA LEU 119 HA LEU 119 -4.334 -7.113 4.599 780 1HB LEU 119 2HB LEU 119 -5.655 -8.041 6.483 781 2HB LEU 119 1HB LEU 119 -4.262 -8.957 6.999 782 HG LEU 119 HG LEU 119 -4.215 -5.967 6.865 783 1HD1 LEU 119 1HD1 LEU 119 -4.807 -5.966 9.259 784 2HD1 LEU 119 2HD1 LEU 119 -5.076 -7.717 9.186 785 3HD1 LEU 119 3HD1 LEU 119 -6.099 -6.620 8.250 786 1HD2 LEU 119 1HD2 LEU 119 -2.502 -6.225 8.606 787 2HD2 LEU 119 2HD2 LEU 119 -2.067 -7.070 7.116 788 3HD2 LEU 119 3HD2 LEU 119 -2.675 -7.975 8.504 789 H LEU 120 H LEU 120 -2.418 -6.243 4.545 790 HA LEU 120 HA LEU 120 -0.100 -7.983 4.774 791 1HB LEU 120 2HB LEU 120 0.897 -7.075 2.763 792 2HB LEU 120 1HB LEU 120 -0.612 -7.871 2.394 793 HG LEU 120 HG LEU 120 -0.192 -4.865 2.496 794 1HD1 LEU 120 1HD1 LEU 120 -0.407 -4.975 0.066 795 2HD1 LEU 120 2HD1 LEU 120 -0.482 -6.733 0.155 796 3HD1 LEU 120 3HD1 LEU 120 0.986 -5.887 0.646 797 1HD2 LEU 120 1HD2 LEU 120 -2.528 -5.464 2.991 798 2HD2 LEU 120 2HD2 LEU 120 -2.568 -6.477 1.547 799 3HD2 LEU 120 3HD2 LEU 120 -2.390 -4.732 1.395 800 H THR 121 H THR 121 1.657 -7.059 5.581 801 HA THR 121 HA THR 121 1.386 -4.241 6.367 802 HB THR 121 HB THR 121 2.827 -6.430 7.887 803 HG1 THR 121 1HG THR 121 0.327 -6.191 7.678 804 1HG2 THR 121 1HG2 THR 121 3.696 -4.154 8.182 805 2HG2 THR 121 2HG2 THR 121 2.938 -4.746 9.658 806 3HG2 THR 121 3HG2 THR 121 2.089 -3.590 8.620 807 H ILE 122 H ILE 122 3.115 -2.935 5.858 808 HA ILE 122 HA ILE 122 5.514 -4.302 4.909 809 HB ILE 122 HB ILE 122 5.910 -2.540 3.278 810 1HG1 ILE 122 2HG1 ILE 122 3.190 -1.481 3.994 811 2HG1 ILE 122 1HG1 ILE 122 4.712 -0.725 4.451 812 1HG2 ILE 122 1HG2 ILE 122 4.685 -4.498 2.555 813 2HG2 ILE 122 2HG2 ILE 122 4.084 -3.064 1.722 814 3HG2 ILE 122 3HG2 ILE 122 3.166 -3.747 3.057 815 1HD1 ILE 122 1HD1 ILE 122 3.752 -1.154 1.619 816 2HD1 ILE 122 2HD1 ILE 122 5.257 -0.376 2.096 817 3HD1 ILE 122 3HD1 ILE 122 3.717 0.373 2.509 818 H GLN 123 H GLN 123 7.433 -3.392 5.417 819 HA GLN 123 HA GLN 123 7.388 -0.931 6.944 820 1HB GLN 123 2HB GLN 123 7.159 -2.828 8.559 821 2HB GLN 123 1HB GLN 123 8.706 -3.431 8.002 822 1HG GLN 123 2HG GLN 123 9.861 -1.552 8.869 823 2HG GLN 123 1HG GLN 123 8.356 -0.691 9.184 824 1HE2 GLN 123 1HE2 GLN 123 8.741 -0.429 11.332 825 2HE2 GLN 123 2HE2 GLN 123 8.686 -1.725 12.470 826 H VAL 124 H VAL 124 8.957 0.322 6.403 827 HA VAL 124 HA VAL 124 11.002 -0.687 4.567 828 HB VAL 124 HB VAL 124 10.271 2.171 5.260 829 1HG1 VAL 124 1HG1 VAL 124 11.488 2.764 3.229 830 2HG1 VAL 124 2HG1 VAL 124 11.928 1.072 2.998 831 3HG1 VAL 124 3HG1 VAL 124 12.526 1.956 4.402 832 1HG2 VAL 124 1HG2 VAL 124 8.376 1.071 4.203 833 2HG2 VAL 124 2HG2 VAL 124 9.406 0.524 2.883 834 3HG2 VAL 124 3HG2 VAL 124 9.095 2.245 3.105 835 H THR 125 H THR 125 13.099 -0.824 5.242 836 HA THR 125 HA THR 125 13.824 0.822 7.516 837 HB THR 125 HB THR 125 13.195 -1.611 8.253 838 HG1 THR 125 1HG THR 125 14.542 -1.324 9.864 839 1HG2 THR 125 1HG2 THR 125 14.406 -2.721 6.358 840 2HG2 THR 125 2HG2 THR 125 14.944 -3.284 7.965 841 3HG2 THR 125 3HG2 THR 125 15.898 -2.090 7.087 842 HA PRO 126 HA PRO 126 17.552 1.498 5.078 843 1HB PRO 126 2HB PRO 126 19.312 1.920 7.126 844 2HB PRO 126 1HB PRO 126 18.118 3.142 6.648 845 1HG PRO 126 2HG PRO 126 17.851 1.005 8.741 846 2HG PRO 126 1HG PRO 126 17.621 2.777 8.983 847 1HD PRO 126 2HD PRO 126 15.580 1.198 8.666 848 2HD PRO 126 1HD PRO 126 15.640 2.684 7.683 849 H LYS 127 H LYS 127 18.107 -0.441 4.205 850 HA LYS 127 HA LYS 127 19.534 -2.236 5.964 851 1HB LYS 127 2HB LYS 127 17.434 -3.267 5.528 852 2HB LYS 127 1HB LYS 127 17.527 -3.046 3.811 853 1HG LYS 127 2HG LYS 127 19.354 -4.657 3.721 854 2HG LYS 127 1HG LYS 127 19.268 -4.847 5.470 855 1HD LYS 127 2HD LYS 127 16.987 -5.652 5.299 856 2HD LYS 127 1HD LYS 127 16.981 -5.405 3.570 857 1HE LYS 127 2HE LYS 127 18.813 -7.297 5.062 858 2HE LYS 127 1HE LYS 127 17.356 -7.778 4.202 859 1HZ LYS 127 1HZ LYS 127 19.360 -8.143 2.899 860 2HZ LYS 127 2HZ LYS 127 19.748 -6.510 2.960 861 3HZ LYS 127 3HZ LYS 127 18.359 -7.027 2.135 862 HA PRO 128 HA PRO 128 22.104 -2.282 1.976 863 1HB PRO 128 2HB PRO 128 20.832 -0.464 0.048 864 2HB PRO 128 1HB PRO 128 21.349 -2.136 -0.195 865 1HG PRO 128 2HG PRO 128 18.746 -1.461 -0.134 866 2HG PRO 128 1HG PRO 128 19.324 -3.006 0.519 867 1HD PRO 128 2HD PRO 128 18.695 -0.460 1.964 868 2HD PRO 128 1HD PRO 128 18.186 -2.107 2.372 869 H GLY 129 H GLY 129 20.330 0.838 1.816 870 1HA GLY 129 2HA GLY 129 21.142 2.607 3.303 871 2HA GLY 129 1HA GLY 129 22.768 2.147 2.813 872 H GLY 130 H GLY 130 21.092 4.655 2.575 873 1HA GLY 130 2HA GLY 130 21.126 6.430 1.146 874 2HA GLY 130 1HA GLY 130 22.205 5.506 0.114 875 HA PRO 131 HA PRO 131 18.596 5.635 -2.589 876 1HB PRO 131 2HB PRO 131 19.816 4.842 -4.803 877 2HB PRO 131 1HB PRO 131 20.134 6.424 -4.051 878 1HG PRO 131 2HG PRO 131 21.756 3.906 -3.848 879 2HG PRO 131 1HG PRO 131 22.312 5.541 -4.247 880 1HD PRO 131 2HD PRO 131 22.462 4.504 -1.747 881 2HD PRO 131 1HD PRO 131 22.241 6.241 -2.066 882 H GLY 132 H GLY 132 19.033 3.521 -0.881 883 1HA GLY 132 2HA GLY 132 17.612 1.440 -2.262 884 2HA GLY 132 1HA GLY 132 19.235 0.951 -1.789 885 H SER 133 H SER 133 16.077 1.096 -0.847 886 HA SER 133 HA SER 133 16.858 0.387 1.885 887 1HB SER 133 2HB SER 133 14.453 2.065 1.118 888 2HB SER 133 1HB SER 133 14.893 1.560 2.750 889 HG SER 133 HG SER 133 16.058 3.414 1.051 890 H ILE 134 H ILE 134 15.536 -1.278 2.779 891 HA ILE 134 HA ILE 134 14.192 -2.708 0.656 892 HB ILE 134 HB ILE 134 15.332 -3.725 3.260 893 1HG1 ILE 134 2HG1 ILE 134 16.954 -3.248 1.510 894 2HG1 ILE 134 1HG1 ILE 134 16.812 -4.995 1.781 895 1HG2 ILE 134 1HG2 ILE 134 14.690 -5.981 2.538 896 2HG2 ILE 134 2HG2 ILE 134 13.847 -5.291 1.147 897 3HG2 ILE 134 3HG2 ILE 134 13.275 -4.955 2.777 898 1HD1 ILE 134 1HD1 ILE 134 15.683 -3.396 -0.474 899 2HD1 ILE 134 2HD1 ILE 134 15.435 -5.134 -0.219 900 3HD1 ILE 134 3HD1 ILE 134 17.050 -4.494 -0.531 901 H VAL 135 H VAL 135 12.140 -3.033 0.753 902 HA VAL 135 HA VAL 135 10.718 -2.437 3.239 903 HB VAL 135 HB VAL 135 9.951 -0.921 1.443 904 1HG1 VAL 135 1HG1 VAL 135 9.171 -3.358 -0.090 905 2HG1 VAL 135 2HG1 VAL 135 10.459 -2.225 -0.504 906 3HG1 VAL 135 3HG1 VAL 135 8.774 -1.695 -0.521 907 1HG2 VAL 135 1HG2 VAL 135 7.868 -2.985 2.122 908 2HG2 VAL 135 2HG2 VAL 135 7.542 -1.354 1.536 909 3HG2 VAL 135 3HG2 VAL 135 8.313 -1.591 3.105 910 H HIS 136 H HIS 136 9.920 -4.015 4.274 911 HA HIS 136 HA HIS 136 10.005 -6.636 3.030 912 1HB HIS 136 2HB HIS 136 9.400 -5.915 5.901 913 2HB HIS 136 1HB HIS 136 9.655 -7.535 5.274 914 HD1 HIS 136 1HD HIS 136 12.231 -7.847 4.186 915 HD2 HIS 136 2HD HIS 136 11.579 -4.764 6.886 916 HE1 HIS 136 1HE HIS 136 14.475 -7.274 5.095 917 HE2 HIS 136 2HE HIS 136 13.932 -5.825 7.025 918 H TRP 137 H TRP 137 8.218 -7.303 2.014 919 HA TRP 137 HA TRP 137 5.651 -6.302 2.933 920 1HB TRP 137 2HB TRP 137 6.332 -7.962 0.474 921 2HB TRP 137 1HB TRP 137 4.754 -7.432 0.951 922 HD1 TRP 137 HD TRP 137 8.129 -5.625 0.030 923 HE1 TRP 137 1HE TRP 137 7.492 -3.501 -1.198 924 HE3 TRP 137 3HE TRP 137 3.032 -5.969 0.349 925 HZ2 TRP 137 2HZ TRP 137 5.169 -2.093 -1.930 926 HZ3 TRP 137 3HZ TRP 137 1.677 -4.165 -0.643 927 HH2 TRP 137 HH TRP 137 2.721 -2.281 -1.748 928 H HIS 138 H HIS 138 4.569 -7.425 4.298 929 HA HIS 138 HA HIS 138 4.911 -10.334 4.362 930 1HB HIS 138 2HB HIS 138 5.889 -9.302 6.352 931 2HB HIS 138 1HB HIS 138 4.460 -8.317 6.580 932 HD1 HIS 138 1HD HIS 138 5.796 -11.815 7.126 933 HD2 HIS 138 2HD HIS 138 2.433 -9.509 7.940 934 HE1 HIS 138 1HE HIS 138 4.482 -13.102 8.820 935 HE2 HIS 138 2HE HIS 138 2.354 -11.779 9.145 936 H LEU 139 H LEU 139 3.129 -11.179 3.439 937 HA LEU 139 HA LEU 139 0.574 -9.790 3.792 938 1HB LEU 139 2HB LEU 139 1.435 -11.658 1.566 939 2HB LEU 139 1HB LEU 139 -0.124 -10.890 1.698 940 HG LEU 139 HG LEU 139 1.124 -8.655 1.361 941 1HD1 LEU 139 1HD1 LEU 139 3.339 -9.305 1.912 942 2HD1 LEU 139 2HD1 LEU 139 3.243 -8.700 0.258 943 3HD1 LEU 139 3HD1 LEU 139 3.371 -10.435 0.557 944 1HD2 LEU 139 1HD2 LEU 139 1.211 -10.676 -0.864 945 2HD2 LEU 139 2HD2 LEU 139 1.230 -8.922 -1.047 946 3HD2 LEU 139 3HD2 LEU 139 -0.195 -9.724 -0.390 947 H GLU 140 H GLU 140 -1.028 -10.909 4.734 948 HA GLU 140 HA GLU 140 -0.880 -13.813 4.821 949 1HB GLU 140 2HB GLU 140 -1.528 -12.034 7.202 950 2HB GLU 140 1HB GLU 140 -1.743 -13.779 7.176 951 1HG GLU 140 2HG GLU 140 0.664 -14.063 6.819 952 2HG GLU 140 1HG GLU 140 0.874 -12.322 6.879 953 H TYR 141 H TYR 141 -2.743 -14.728 4.277 954 HA TYR 141 HA TYR 141 -5.158 -13.140 4.225 955 1HB TYR 141 2HB TYR 141 -5.397 -13.401 1.734 956 2HB TYR 141 1HB TYR 141 -4.159 -12.285 2.296 957 HD1 TYR 141 1HD TYR 141 -1.739 -13.088 2.312 958 HD2 TYR 141 2HD TYR 141 -4.819 -15.141 0.231 959 HE1 TYR 141 1HE TYR 141 -0.054 -14.212 0.983 960 HE2 TYR 141 2HE TYR 141 -3.158 -16.278 -1.119 961 HH TYR 141 HH TYR 141 -0.807 -15.957 -1.851 962 H GLU 142 H GLU 142 -6.968 -14.165 3.676 963 HA GLU 142 HA GLU 142 -6.998 -17.043 4.296 964 1HB GLU 142 2HB GLU 142 -8.117 -15.465 5.822 965 2HB GLU 142 1HB GLU 142 -9.061 -14.852 4.482 966 1HG GLU 142 2HG GLU 142 -10.480 -16.248 5.707 967 2HG GLU 142 1HG GLU 142 -10.030 -17.158 4.271 968 H LYS 143 H LYS 143 -7.239 -18.216 2.403 969 HA LYS 143 HA LYS 143 -8.395 -17.167 0.016 970 1HB LYS 143 2HB LYS 143 -7.621 -19.921 0.885 971 2HB LYS 143 1HB LYS 143 -8.628 -19.720 -0.522 972 1HG LYS 143 2HG LYS 143 -6.374 -20.023 -1.204 973 2HG LYS 143 1HG LYS 143 -6.861 -18.375 -1.550 974 1HD LYS 143 2HD LYS 143 -5.569 -17.552 0.288 975 2HD LYS 143 1HD LYS 143 -5.234 -19.200 0.841 976 1HE LYS 143 2HE LYS 143 -4.413 -18.111 -1.854 977 2HE LYS 143 1HE LYS 143 -3.329 -18.212 -0.473 978 1HZ LYS 143 1HZ LYS 143 -3.083 -20.098 -1.993 979 2HZ LYS 143 2HZ LYS 143 -4.683 -20.584 -1.716 980 3HZ LYS 143 3HZ LYS 143 -3.575 -20.587 -0.473 981 H ILE 144 H ILE 144 -10.453 -17.323 -0.754 982 HA ILE 144 HA ILE 144 -12.539 -18.332 0.946 983 HB ILE 144 HB ILE 144 -12.623 -17.611 -2.018 984 1HG1 ILE 144 2HG1 ILE 144 -13.405 -15.996 0.409 985 2HG1 ILE 144 1HG1 ILE 144 -11.985 -15.713 -0.591 986 1HG2 ILE 144 1HG2 ILE 144 -14.888 -18.002 -0.048 987 2HG2 ILE 144 2HG2 ILE 144 -14.468 -19.089 -1.371 988 3HG2 ILE 144 3HG2 ILE 144 -15.066 -17.465 -1.717 989 1HD1 ILE 144 1HD1 ILE 144 -13.742 -14.132 -1.082 990 2HD1 ILE 144 2HD1 ILE 144 -14.851 -15.458 -1.440 991 3HD1 ILE 144 3HD1 ILE 144 -13.451 -15.175 -2.479 992 H SER 145 H SER 145 -10.809 -19.253 -1.947 993 HA SER 145 HA SER 145 -10.795 -21.978 -1.313 994 1HB SER 145 2HB SER 145 -13.060 -21.788 -2.415 995 2HB SER 145 1HB SER 145 -12.261 -21.103 -3.832 996 HG SER 145 HG SER 145 -12.319 -23.239 -4.344 997 H GLU 146 H GLU 146 -9.597 -23.026 -3.285 998 HA GLU 146 HA GLU 146 -7.280 -21.374 -3.689 999 1HB GLU 146 2HB GLU 146 -8.017 -24.091 -4.413 1000 2HB GLU 146 1HB GLU 146 -6.486 -23.357 -4.896 1001 1HG GLU 146 2HG GLU 146 -7.424 -23.711 -2.039 1002 2HG GLU 146 1HG GLU 146 -6.218 -24.725 -2.845 1003 H GLU 147 H GLU 147 -9.857 -22.706 -5.583 1004 HA GLU 147 HA GLU 147 -8.831 -22.310 -8.145 1005 1HB GLU 147 2HB GLU 147 -11.737 -22.190 -7.299 1006 2HB GLU 147 1HB GLU 147 -11.173 -22.322 -8.952 1007 1HG GLU 147 2HG GLU 147 -11.910 -24.474 -8.247 1008 2HG GLU 147 1HG GLU 147 -10.154 -24.525 -8.346 1009 H VAL 148 H VAL 148 -9.831 -20.141 -5.858 1010 HA VAL 148 HA VAL 148 -10.140 -18.041 -7.906 1011 HB VAL 148 HB VAL 148 -11.364 -16.647 -6.336 1012 1HG1 VAL 148 1HG1 VAL 148 -12.647 -18.107 -7.754 1013 2HG1 VAL 148 2HG1 VAL 148 -13.431 -17.945 -6.185 1014 3HG1 VAL 148 3HG1 VAL 148 -12.524 -19.410 -6.570 1015 1HG2 VAL 148 1HG2 VAL 148 -12.149 -17.522 -4.174 1016 2HG2 VAL 148 2HG2 VAL 148 -10.400 -17.351 -4.233 1017 3HG2 VAL 148 3HG2 VAL 148 -11.133 -18.950 -4.390 1018 H ALA 149 H ALA 149 -7.786 -19.149 -6.047 1019 HA ALA 149 HA ALA 149 -6.945 -16.587 -4.966 1020 1HB ALA 149 1HB ALA 149 -6.744 -18.596 -3.570 1021 2HB ALA 149 2HB ALA 149 -5.190 -17.813 -3.844 1022 3HB ALA 149 3HB ALA 149 -5.609 -19.279 -4.733 1023 H HIS 150 H HIS 150 -5.413 -15.330 -5.828 1024 HA HIS 150 HA HIS 150 -3.750 -16.462 -7.966 1025 1HB HIS 150 2HB HIS 150 -5.168 -13.814 -7.997 1026 2HB HIS 150 1HB HIS 150 -3.780 -14.143 -9.018 1027 HD1 HIS 150 1HD HIS 150 -4.452 -14.761 -11.284 1028 HD2 HIS 150 2HD HIS 150 -7.244 -16.011 -8.479 1029 HE1 HIS 150 1HE HIS 150 -6.273 -15.824 -12.591 1030 HE2 HIS 150 2HE HIS 150 -7.792 -16.813 -10.864 1031 HA PRO 151 HA PRO 151 -0.707 -14.682 -4.923 1032 1HB PRO 151 2HB PRO 151 0.744 -16.868 -6.385 1033 2HB PRO 151 1HB PRO 151 0.861 -16.411 -4.675 1034 1HG PRO 151 2HG PRO 151 -0.541 -18.553 -5.249 1035 2HG PRO 151 1HG PRO 151 -1.238 -17.333 -4.182 1036 1HD PRO 151 2HD PRO 151 -1.808 -17.769 -7.092 1037 2HD PRO 151 1HD PRO 151 -2.929 -17.510 -5.732 1038 H GLU 152 H GLU 152 -0.682 -15.482 -8.338 1039 HA GLU 152 HA GLU 152 1.568 -14.108 -9.281 1040 1HB GLU 152 2HB GLU 152 0.273 -15.644 -10.653 1041 2HB GLU 152 1HB GLU 152 -1.126 -14.597 -10.567 1042 1HG GLU 152 2HG GLU 152 -0.131 -14.441 -12.737 1043 2HG GLU 152 1HG GLU 152 0.090 -12.915 -11.900 1044 H THR 153 H THR 153 -1.786 -12.947 -8.802 1045 HA THR 153 HA THR 153 -1.162 -10.385 -9.821 1046 HB THR 153 HB THR 153 -3.445 -9.732 -9.065 1047 HG1 THR 153 1HG THR 153 -4.678 -11.154 -7.953 1048 1HG2 THR 153 1HG2 THR 153 -3.112 -10.814 -11.258 1049 2HG2 THR 153 2HG2 THR 153 -4.664 -11.247 -10.542 1050 3HG2 THR 153 3HG2 THR 153 -3.324 -12.392 -10.489 1051 H LEU 154 H LEU 154 -1.179 -11.841 -6.694 1052 HA LEU 154 HA LEU 154 -1.177 -9.514 -5.099 1053 1HB LEU 154 2HB LEU 154 0.173 -12.146 -4.530 1054 2HB LEU 154 1HB LEU 154 -0.179 -10.903 -3.351 1055 HG LEU 154 HG LEU 154 -2.197 -12.566 -4.850 1056 1HD1 LEU 154 1HD1 LEU 154 -2.703 -13.477 -2.656 1057 2HD1 LEU 154 2HD1 LEU 154 -1.417 -12.507 -1.947 1058 3HD1 LEU 154 3HD1 LEU 154 -1.024 -13.782 -3.100 1059 1HD2 LEU 154 1HD2 LEU 154 -3.060 -10.316 -4.478 1060 2HD2 LEU 154 2HD2 LEU 154 -2.610 -10.420 -2.774 1061 3HD2 LEU 154 3HD2 LEU 154 -3.858 -11.484 -3.417 1062 H LEU 155 H LEU 155 1.520 -11.411 -6.416 1063 HA LEU 155 HA LEU 155 3.508 -9.704 -5.378 1064 1HB LEU 155 2HB LEU 155 3.617 -11.630 -7.666 1065 2HB LEU 155 1HB LEU 155 5.007 -10.704 -7.135 1066 HG LEU 155 HG LEU 155 3.481 -12.713 -5.493 1067 1HD1 LEU 155 1HD1 LEU 155 6.215 -12.745 -6.707 1068 2HD1 LEU 155 2HD1 LEU 155 4.842 -13.731 -7.233 1069 3HD1 LEU 155 3HD1 LEU 155 5.565 -13.967 -5.621 1070 1HD2 LEU 155 1HD2 LEU 155 5.940 -11.088 -4.829 1071 2HD2 LEU 155 2HD2 LEU 155 5.309 -12.418 -3.870 1072 3HD2 LEU 155 3HD2 LEU 155 4.355 -10.950 -4.058 1073 H GLN 156 H GLN 156 1.786 -9.613 -8.419 1074 HA GLN 156 HA GLN 156 3.422 -7.459 -9.155 1075 1HB GLN 156 2HB GLN 156 1.864 -7.072 -11.121 1076 2HB GLN 156 1HB GLN 156 2.653 -8.628 -11.042 1077 1HG GLN 156 2HG GLN 156 0.604 -9.339 -11.591 1078 2HG GLN 156 1HG GLN 156 0.421 -9.256 -9.842 1079 1HE2 GLN 156 1HE2 GLN 156 0.177 -6.245 -9.885 1080 2HE2 GLN 156 2HE2 GLN 156 -1.355 -5.936 -10.503 1081 H PHE 157 H PHE 157 0.433 -7.644 -7.441 1082 HA PHE 157 HA PHE 157 -0.245 -4.926 -7.522 1083 1HB PHE 157 2HB PHE 157 -1.782 -6.602 -6.603 1084 2HB PHE 157 1HB PHE 157 -0.645 -6.978 -5.317 1085 HD1 PHE 157 1HD PHE 157 -0.821 -5.870 -3.243 1086 HD2 PHE 157 2HD PHE 157 -2.750 -4.220 -6.668 1087 HE1 PHE 157 1HE PHE 157 -1.953 -4.172 -1.795 1088 HE2 PHE 157 2HE PHE 157 -3.861 -2.551 -5.242 1089 HZ PHE 157 HZ PHE 157 -3.461 -2.534 -2.814 1090 H CYS 158 H CYS 158 1.885 -6.733 -5.321 1091 HA CYS 158 HA CYS 158 2.459 -4.481 -3.758 1092 1HB CYS 158 2HB CYS 158 4.313 -5.787 -2.773 1093 2HB CYS 158 1HB CYS 158 2.798 -6.667 -2.795 1094 HG CYS 158 HG CYS 158 4.363 -7.552 -5.514 1095 H VAL 159 H VAL 159 3.998 -5.672 -6.689 1096 HA VAL 159 HA VAL 159 6.268 -3.969 -6.367 1097 HB VAL 159 HB VAL 159 6.241 -6.015 -7.836 1098 1HG1 VAL 159 1HG1 VAL 159 4.838 -4.278 -9.836 1099 2HG1 VAL 159 2HG1 VAL 159 4.175 -5.692 -9.026 1100 3HG1 VAL 159 3HG1 VAL 159 5.512 -5.874 -10.155 1101 1HG2 VAL 159 1HG2 VAL 159 7.234 -3.466 -9.078 1102 2HG2 VAL 159 2HG2 VAL 159 7.758 -5.082 -9.554 1103 3HG2 VAL 159 3HG2 VAL 159 8.099 -4.489 -7.928 1104 H GLU 160 H GLU 160 3.211 -3.686 -7.929 1105 HA GLU 160 HA GLU 160 3.646 -1.234 -9.245 1106 1HB GLU 160 2HB GLU 160 1.042 -2.280 -8.120 1107 2HB GLU 160 1HB GLU 160 1.190 -0.935 -9.240 1108 1HG GLU 160 2HG GLU 160 2.196 -2.484 -10.886 1109 2HG GLU 160 1HG GLU 160 1.914 -3.802 -9.758 1110 H VAL 161 H VAL 161 2.317 -1.915 -6.051 1111 HA VAL 161 HA VAL 161 1.969 0.767 -5.258 1112 HB VAL 161 HB VAL 161 2.499 -1.658 -3.533 1113 1HG1 VAL 161 1HG1 VAL 161 1.405 -0.367 -1.710 1114 2HG1 VAL 161 2HG1 VAL 161 1.319 1.034 -2.777 1115 3HG1 VAL 161 3HG1 VAL 161 2.887 0.411 -2.269 1116 1HG2 VAL 161 1HG2 VAL 161 0.532 -1.940 -4.917 1117 2HG2 VAL 161 2HG2 VAL 161 -0.102 -0.385 -4.375 1118 3HG2 VAL 161 3HG2 VAL 161 0.057 -1.721 -3.234 1119 H SER 162 H SER 162 4.748 -1.399 -5.032 1120 HA SER 162 HA SER 162 6.435 0.126 -3.441 1121 1HB SER 162 2HB SER 162 7.116 -1.685 -5.749 1122 2HB SER 162 1HB SER 162 8.264 -1.091 -4.546 1123 HG SER 162 HG SER 162 5.993 -2.754 -4.081 1124 H LYS 163 H LYS 163 5.767 0.345 -6.889 1125 HA LYS 163 HA LYS 163 7.774 2.292 -7.457 1126 1HB LYS 163 2HB LYS 163 5.234 1.638 -8.947 1127 2HB LYS 163 1HB LYS 163 6.574 2.577 -9.580 1128 1HG LYS 163 2HG LYS 163 8.025 0.647 -9.479 1129 2HG LYS 163 1HG LYS 163 6.735 -0.308 -8.739 1130 1HD LYS 163 2HD LYS 163 5.371 0.043 -10.731 1131 2HD LYS 163 1HD LYS 163 6.700 0.930 -11.482 1132 1HE LYS 163 2HE LYS 163 8.105 -1.055 -11.360 1133 2HE LYS 163 1HE LYS 163 6.801 -1.942 -10.573 1134 1HZ LYS 163 1HZ LYS 163 6.703 -0.820 -13.322 1135 2HZ LYS 163 2HZ LYS 163 5.464 -1.657 -12.584 1136 3HZ LYS 163 3HZ LYS 163 6.918 -2.453 -12.918 1137 H GLU 164 H GLU 164 4.333 2.398 -6.724 1138 HA GLU 164 HA GLU 164 3.790 5.110 -7.100 1139 1HB GLU 164 2HB GLU 164 2.663 3.301 -4.973 1140 2HB GLU 164 1HB GLU 164 1.962 4.809 -5.500 1141 1HG GLU 164 2HG GLU 164 2.261 2.326 -7.183 1142 2HG GLU 164 1HG GLU 164 0.770 2.928 -6.472 1143 H ILE 165 H ILE 165 4.858 3.387 -4.205 1144 HA ILE 165 HA ILE 165 4.894 5.729 -2.647 1145 HB ILE 165 HB ILE 165 4.528 3.596 -1.592 1146 1HG1 ILE 165 2HG1 ILE 165 6.060 3.779 0.339 1147 2HG1 ILE 165 1HG1 ILE 165 7.104 4.827 -0.615 1148 1HG2 ILE 165 1HG2 ILE 165 6.332 1.951 -1.227 1149 2HG2 ILE 165 2HG2 ILE 165 7.369 2.897 -2.300 1150 3HG2 ILE 165 3HG2 ILE 165 5.904 2.145 -2.929 1151 1HD1 ILE 165 1HD1 ILE 165 4.263 5.422 0.153 1152 2HD1 ILE 165 2HD1 ILE 165 5.354 6.438 -0.801 1153 3HD1 ILE 165 3HD1 ILE 165 5.722 6.112 0.900 1154 H ASP 166 H ASP 166 7.386 3.923 -4.221 1155 HA ASP 166 HA ASP 166 9.693 5.318 -3.450 1156 1HB ASP 166 2HB ASP 166 9.690 3.230 -4.823 1157 2HB ASP 166 1HB ASP 166 9.109 4.147 -6.196 1158 H GLU 167 H GLU 167 7.483 6.032 -6.137 1159 HA GLU 167 HA GLU 167 8.660 8.464 -7.049 1160 1HB GLU 167 2HB GLU 167 5.818 7.488 -7.150 1161 2HB GLU 167 1HB GLU 167 6.366 8.978 -7.900 1162 1HG GLU 167 2HG GLU 167 7.381 6.227 -8.543 1163 2HG GLU 167 1HG GLU 167 6.188 7.126 -9.482 1164 H HIS 168 H HIS 168 6.535 7.911 -4.368 1165 HA HIS 168 HA HIS 168 6.025 10.710 -4.053 1166 1HB HIS 168 2HB HIS 168 5.676 8.500 -2.006 1167 2HB HIS 168 1HB HIS 168 5.167 10.162 -1.765 1168 HD1 HIS 168 1HD HIS 168 3.673 10.668 -4.479 1169 HD2 HIS 168 2HD HIS 168 3.326 7.190 -2.210 1170 HE1 HIS 168 1HE HIS 168 1.509 9.665 -5.124 1171 HE2 HIS 168 2HE HIS 168 1.167 7.916 -3.379 1172 H LEU 169 H LEU 169 8.456 8.519 -2.895 1173 HA LEU 169 HA LEU 169 9.723 10.457 -1.131 1174 1HB LEU 169 2HB LEU 169 10.505 7.732 -2.128 1175 2HB LEU 169 1HB LEU 169 11.610 8.754 -1.240 1176 HG LEU 169 HG LEU 169 10.121 8.681 0.712 1177 1HD1 LEU 169 1HD1 LEU 169 8.254 7.134 0.826 1178 2HD1 LEU 169 2HD1 LEU 169 8.437 6.786 -0.893 1179 3HD1 LEU 169 3HD1 LEU 169 7.980 8.405 -0.364 1180 1HD2 LEU 169 1HD2 LEU 169 10.815 5.971 -0.382 1181 2HD2 LEU 169 2HD2 LEU 169 10.497 6.347 1.314 1182 3HD2 LEU 169 3HD2 LEU 169 11.898 7.045 0.498 1183 H LEU 170 H LEU 170 10.340 9.364 -4.432 1184 HA LEU 170 HA LEU 170 12.677 11.006 -4.627 1185 1HB LEU 170 2HB LEU 170 10.802 10.167 -6.824 1186 2HB LEU 170 1HB LEU 170 12.426 10.775 -7.032 1187 HG LEU 170 HG LEU 170 11.627 8.155 -5.805 1188 1HD1 LEU 170 1HD1 LEU 170 11.345 8.293 -8.216 1189 2HD1 LEU 170 2HD1 LEU 170 12.663 7.213 -7.813 1190 3HD1 LEU 170 3HD1 LEU 170 13.006 8.843 -8.402 1191 1HD2 LEU 170 1HD2 LEU 170 14.057 7.680 -5.719 1192 2HD2 LEU 170 2HD2 LEU 170 13.648 9.044 -4.698 1193 3HD2 LEU 170 3HD2 LEU 170 14.391 9.320 -6.274 1194 H ALA 171 H ALA 171 9.305 11.379 -5.473 1195 HA ALA 171 HA ALA 171 8.115 13.039 -6.334 1196 1HB ALA 171 1HB ALA 171 7.579 14.688 -4.676 1197 2HB ALA 171 2HB ALA 171 9.105 14.348 -3.824 1198 3HB ALA 171 3HB ALA 171 7.863 13.096 -3.967 1199 H GLU 172 H GLU 172 9.280 13.394 -8.190 1200 HA GLU 172 HA GLU 172 10.321 16.099 -8.284 1201 1HB GLU 172 2HB GLU 172 11.917 15.346 -10.047 1202 2HB GLU 172 1HB GLU 172 12.279 14.735 -8.439 1203 1HG GLU 172 2HG GLU 172 11.237 12.586 -9.070 1204 2HG GLU 172 1HG GLU 172 10.949 13.255 -10.678 1205 H GLU 173 H GLU 173 9.962 17.122 -10.248 1206 HA GLU 173 HA GLU 173 7.529 16.078 -11.511 1207 1HB GLU 173 2HB GLU 173 8.427 18.930 -11.111 1208 2HB GLU 173 1HB GLU 173 6.918 18.436 -11.872 1209 1HG GLU 173 2HG GLU 173 6.164 17.442 -9.806 1210 2HG GLU 173 1HG GLU 173 7.698 17.812 -9.031 Start of MODEL 10 1 H THR 17 H THR 17 -4.432 -32.343 -0.505 2 HA THR 17 HA THR 17 -4.779 -32.303 1.724 3 HB THR 17 HB THR 17 -1.908 -33.225 2.006 4 HG1 THR 17 1HG THR 17 -4.369 -34.594 1.693 5 1HG2 THR 17 1HG2 THR 17 -2.613 -34.038 4.228 6 2HG2 THR 17 2HG2 THR 17 -4.229 -33.382 3.957 7 3HG2 THR 17 3HG2 THR 17 -2.843 -32.299 4.096 8 H GLU 18 H GLU 18 -1.873 -30.796 0.547 9 HA GLU 18 HA GLU 18 -1.551 -29.013 2.716 10 1HB GLU 18 2HB GLU 18 -0.363 -28.863 -0.041 11 2HB GLU 18 1HB GLU 18 0.170 -27.947 1.360 12 1HG GLU 18 2HG GLU 18 0.312 -30.928 0.972 13 2HG GLU 18 1HG GLU 18 1.662 -29.797 1.015 14 H ALA 19 H ALA 19 -3.374 -28.070 2.990 15 HA ALA 19 HA ALA 19 -3.770 -25.458 2.064 16 1HB ALA 19 1HB ALA 19 -5.805 -27.496 1.089 17 2HB ALA 19 2HB ALA 19 -4.762 -26.507 0.065 18 3HB ALA 19 3HB ALA 19 -6.024 -25.745 1.034 19 H SER 20 H SER 20 -3.445 -27.233 4.335 20 HA SER 20 HA SER 20 -5.725 -28.048 5.615 21 1HB SER 20 2HB SER 20 -3.106 -27.193 6.817 22 2HB SER 20 1HB SER 20 -4.269 -28.344 7.485 23 HG SER 20 HG SER 20 -3.391 -29.836 6.293 24 H SER 21 H SER 21 -3.898 -25.009 6.030 25 HA SER 21 HA SER 21 -5.726 -24.134 8.075 26 1HB SER 21 2HB SER 21 -3.389 -22.705 6.811 27 2HB SER 21 1HB SER 21 -4.228 -22.242 8.291 28 HG SER 21 HG SER 21 -2.233 -23.983 7.942 29 H LEU 22 H LEU 22 -5.248 -23.673 4.638 30 HA LEU 22 HA LEU 22 -6.071 -22.372 3.049 31 1HB LEU 22 2HB LEU 22 -8.299 -21.979 5.021 32 2HB LEU 22 1HB LEU 22 -8.363 -21.447 3.357 33 HG LEU 22 HG LEU 22 -7.929 -24.326 4.112 34 1HD1 LEU 22 1HD1 LEU 22 -10.250 -24.649 3.607 35 2HD1 LEU 22 2HD1 LEU 22 -10.470 -22.887 3.423 36 3HD1 LEU 22 3HD1 LEU 22 -9.979 -23.561 4.983 37 1HD2 LEU 22 1HD2 LEU 22 -8.628 -24.723 1.803 38 2HD2 LEU 22 2HD2 LEU 22 -7.190 -23.713 1.865 39 3HD2 LEU 22 3HD2 LEU 22 -8.765 -22.987 1.538 40 H VAL 23 H VAL 23 -4.746 -21.164 5.603 41 HA VAL 23 HA VAL 23 -5.262 -18.380 4.993 42 HB VAL 23 HB VAL 23 -3.513 -19.602 7.156 43 1HG1 VAL 23 1HG1 VAL 23 -2.707 -17.387 6.446 44 2HG1 VAL 23 2HG1 VAL 23 -3.393 -17.318 8.067 45 3HG1 VAL 23 3HG1 VAL 23 -4.320 -16.720 6.692 46 1HG2 VAL 23 1HG2 VAL 23 -5.270 -18.822 8.676 47 2HG2 VAL 23 2HG2 VAL 23 -5.895 -19.983 7.488 48 3HG2 VAL 23 3HG2 VAL 23 -6.182 -18.259 7.264 49 H GLY 24 H GLY 24 -4.110 -17.417 3.664 50 1HA GLY 24 2HA GLY 24 -1.606 -18.657 2.757 51 2HA GLY 24 1HA GLY 24 -2.605 -17.559 1.807 52 H LYS 25 H LYS 25 0.224 -17.654 3.061 53 HA LYS 25 HA LYS 25 0.185 -14.845 3.343 54 1HB LYS 25 2HB LYS 25 1.708 -14.937 5.395 55 2HB LYS 25 1HB LYS 25 0.005 -15.239 5.665 56 1HG LYS 25 2HG LYS 25 1.195 -16.741 7.026 57 2HG LYS 25 1HG LYS 25 0.560 -17.669 5.670 58 1HD LYS 25 2HD LYS 25 2.867 -18.370 6.118 59 2HD LYS 25 1HD LYS 25 2.752 -17.514 4.574 60 1HE LYS 25 2HE LYS 25 3.598 -15.466 5.630 61 2HE LYS 25 1HE LYS 25 3.693 -16.307 7.177 62 1HZ LYS 25 1HZ LYS 25 5.341 -17.796 6.198 63 2HZ LYS 25 2HZ LYS 25 5.829 -16.176 6.087 64 3HZ LYS 25 3HZ LYS 25 5.232 -16.983 4.732 65 H LEU 26 H LEU 26 1.803 -13.859 2.530 66 HA LEU 26 HA LEU 26 3.992 -15.509 1.535 67 1HB LEU 26 2HB LEU 26 2.209 -15.310 -0.167 68 2HB LEU 26 1HB LEU 26 2.329 -13.570 -0.066 69 HG LEU 26 HG LEU 26 4.599 -13.668 -0.985 70 1HD1 LEU 26 1HD1 LEU 26 5.260 -15.859 -0.122 71 2HD1 LEU 26 2HD1 LEU 26 5.447 -15.787 -1.874 72 3HD1 LEU 26 3HD1 LEU 26 4.071 -16.635 -1.173 73 1HD2 LEU 26 1HD2 LEU 26 3.973 -14.387 -3.228 74 2HD2 LEU 26 2HD2 LEU 26 2.696 -13.429 -2.476 75 3HD2 LEU 26 3HD2 LEU 26 2.543 -15.185 -2.576 76 H GLU 27 H GLU 27 5.922 -14.363 1.472 77 HA GLU 27 HA GLU 27 5.756 -11.580 2.325 78 1HB GLU 27 2HB GLU 27 7.604 -13.691 3.466 79 2HB GLU 27 1HB GLU 27 7.612 -11.984 3.883 80 1HG GLU 27 2HG GLU 27 5.386 -12.162 4.830 81 2HG GLU 27 1HG GLU 27 5.291 -13.847 4.331 82 H THR 28 H THR 28 7.298 -10.261 1.446 83 HA THR 28 HA THR 28 9.411 -11.397 -0.143 84 HB THR 28 HB THR 28 7.439 -11.374 -1.706 85 HG1 THR 28 1HG THR 28 8.713 -10.830 -3.231 86 1HG2 THR 28 1HG2 THR 28 6.211 -9.466 -0.742 87 2HG2 THR 28 2HG2 THR 28 6.504 -9.223 -2.459 88 3HG2 THR 28 3HG2 THR 28 7.479 -8.362 -1.278 89 H ASP 29 H ASP 29 10.928 -9.722 -0.755 90 HA ASP 29 HA ASP 29 10.453 -7.213 0.631 91 1HB ASP 29 2HB ASP 29 12.830 -7.066 1.286 92 2HB ASP 29 1HB ASP 29 12.070 -8.483 1.985 93 H VAL 30 H VAL 30 10.429 -5.601 -0.603 94 HA VAL 30 HA VAL 30 11.591 -5.838 -3.293 95 HB VAL 30 HB VAL 30 9.311 -4.065 -2.323 96 1HG1 VAL 30 1HG1 VAL 30 10.575 -2.977 -4.084 97 2HG1 VAL 30 2HG1 VAL 30 8.993 -3.508 -4.673 98 3HG1 VAL 30 3HG1 VAL 30 10.438 -4.427 -5.081 99 1HG2 VAL 30 1HG2 VAL 30 9.282 -6.467 -4.139 100 2HG2 VAL 30 2HG2 VAL 30 7.903 -5.423 -3.778 101 3HG2 VAL 30 3HG2 VAL 30 8.631 -6.398 -2.496 102 H GLU 31 H GLU 31 13.003 -4.320 -3.957 103 HA GLU 31 HA GLU 31 13.999 -2.522 -1.891 104 1HB GLU 31 2HB GLU 31 15.198 -2.653 -4.656 105 2HB GLU 31 1HB GLU 31 15.864 -2.160 -3.102 106 1HG GLU 31 2HG GLU 31 16.935 -4.187 -3.774 107 2HG GLU 31 1HG GLU 31 15.898 -4.515 -2.395 108 H ILE 32 H ILE 32 13.916 -0.322 -2.057 109 HA ILE 32 HA ILE 32 12.723 0.725 -4.495 110 HB ILE 32 HB ILE 32 11.765 2.593 -3.152 111 1HG1 ILE 32 2HG1 ILE 32 12.562 0.920 -0.749 112 2HG1 ILE 32 1HG1 ILE 32 13.271 2.462 -1.201 113 1HG2 ILE 32 1HG2 ILE 32 10.321 0.766 -3.795 114 2HG2 ILE 32 2HG2 ILE 32 9.871 1.350 -2.198 115 3HG2 ILE 32 3HG2 ILE 32 10.789 -0.141 -2.361 116 1HD1 ILE 32 1HD1 ILE 32 11.704 2.707 0.642 117 2HD1 ILE 32 2HD1 ILE 32 10.416 2.009 -0.332 118 3HD1 ILE 32 3HD1 ILE 32 11.108 3.563 -0.777 119 H LYS 33 H LYS 33 13.292 3.103 -4.705 120 HA LYS 33 HA LYS 33 16.177 3.347 -4.252 121 1HB LYS 33 2HB LYS 33 14.339 4.759 -6.203 122 2HB LYS 33 1HB LYS 33 16.081 4.989 -6.101 123 1HG LYS 33 2HG LYS 33 16.447 2.682 -6.727 124 2HG LYS 33 1HG LYS 33 14.708 2.398 -6.786 125 1HD LYS 33 2HD LYS 33 14.528 4.054 -8.589 126 2HD LYS 33 1HD LYS 33 16.278 4.296 -8.533 127 1HE LYS 33 2HE LYS 33 14.871 1.698 -9.158 128 2HE LYS 33 1HE LYS 33 15.621 2.758 -10.345 129 1HZ LYS 33 1HZ LYS 33 17.077 0.878 -9.714 130 2HZ LYS 33 2HZ LYS 33 17.097 1.415 -8.125 131 3HZ LYS 33 3HZ LYS 33 17.751 2.365 -9.341 132 H ALA 34 H ALA 34 13.074 4.573 -3.585 133 HA ALA 34 HA ALA 34 13.780 7.105 -2.595 134 1HB ALA 34 1HB ALA 34 11.456 5.331 -1.877 135 2HB ALA 34 2HB ALA 34 11.496 6.508 -3.190 136 3HB ALA 34 3HB ALA 34 11.594 7.048 -1.513 137 H SER 35 H SER 35 13.708 7.722 -0.328 138 HA SER 35 HA SER 35 15.276 5.835 1.246 139 1HB SER 35 2HB SER 35 14.768 8.775 1.677 140 2HB SER 35 1HB SER 35 15.959 7.771 2.512 141 HG SER 35 HG SER 35 15.905 7.969 -0.280 142 H ALA 36 H ALA 36 14.599 5.005 3.136 143 HA ALA 36 HA ALA 36 11.957 4.798 3.930 144 1HB ALA 36 1HB ALA 36 13.791 3.312 4.651 145 2HB ALA 36 2HB ALA 36 12.813 3.880 6.006 146 3HB ALA 36 3HB ALA 36 14.391 4.602 5.694 147 H ASP 37 H ASP 37 14.338 7.149 4.788 148 HA ASP 37 HA ASP 37 13.232 8.379 7.001 149 1HB ASP 37 2HB ASP 37 15.464 8.891 6.213 150 2HB ASP 37 1HB ASP 37 14.810 9.605 4.743 151 H LYS 38 H LYS 38 12.522 8.972 3.572 152 HA LYS 38 HA LYS 38 10.902 11.227 4.146 153 1HB LYS 38 2HB LYS 38 10.997 9.584 1.637 154 2HB LYS 38 1HB LYS 38 10.168 11.126 1.823 155 1HG LYS 38 2HG LYS 38 12.388 12.103 2.488 156 2HG LYS 38 1HG LYS 38 13.109 10.586 1.960 157 1HD LYS 38 2HD LYS 38 13.261 12.135 0.182 158 2HD LYS 38 1HD LYS 38 12.026 10.915 -0.212 159 1HE LYS 38 2HE LYS 38 10.250 12.456 0.358 160 2HE LYS 38 1HE LYS 38 11.418 13.651 0.927 161 1HZ LYS 38 1HZ LYS 38 10.959 12.783 -1.896 162 2HZ LYS 38 2HZ LYS 38 12.262 13.693 -1.382 163 3HZ LYS 38 3HZ LYS 38 10.719 14.316 -1.188 164 H PHE 39 H PHE 39 10.350 7.841 3.866 165 HA PHE 39 HA PHE 39 7.538 7.816 3.651 166 1HB PHE 39 2HB PHE 39 9.075 5.853 3.280 167 2HB PHE 39 1HB PHE 39 9.383 5.814 5.006 168 HD1 PHE 39 1HD PHE 39 7.183 4.865 2.327 169 HD2 PHE 39 2HD PHE 39 7.519 5.168 6.559 170 HE1 PHE 39 1HE PHE 39 5.267 3.336 2.586 171 HE2 PHE 39 2HE PHE 39 5.610 3.636 6.825 172 HZ PHE 39 HZ PHE 39 4.484 2.722 4.838 173 H HIS 40 H HIS 40 9.809 7.763 6.312 174 HA HIS 40 HA HIS 40 8.133 7.670 8.538 175 1HB HIS 40 2HB HIS 40 10.639 7.408 8.461 176 2HB HIS 40 1HB HIS 40 10.762 9.143 8.250 177 HD1 HIS 40 1HD HIS 40 11.300 6.781 10.679 178 HD2 HIS 40 2HD HIS 40 9.224 10.365 10.733 179 HE1 HIS 40 1HE HIS 40 11.282 7.502 13.072 180 HE2 HIS 40 2HE HIS 40 10.244 9.777 13.045 181 H HIS 41 H HIS 41 9.481 10.458 6.787 182 HA HIS 41 HA HIS 41 8.329 12.450 8.459 183 1HB HIS 41 2HB HIS 41 9.521 12.649 5.711 184 2HB HIS 41 1HB HIS 41 8.795 14.039 6.499 185 HD1 HIS 41 1HD HIS 41 10.369 15.394 7.875 186 HD2 HIS 41 2HD HIS 41 11.768 11.544 7.258 187 HE1 HIS 41 1HE HIS 41 12.687 15.372 8.791 188 HE2 HIS 41 2HE HIS 41 13.592 13.147 8.033 189 H MET 42 H MET 42 7.220 11.104 5.376 190 HA MET 42 HA MET 42 5.250 13.081 4.986 191 1HB MET 42 2HB MET 42 4.357 11.764 3.199 192 2HB MET 42 1HB MET 42 6.106 11.680 3.153 193 1HG MET 42 2HG MET 42 6.075 9.469 4.092 194 2HG MET 42 1HG MET 42 4.327 9.554 4.315 195 1HE MET 42 1HE MET 42 3.943 7.287 3.036 196 2HE MET 42 2HE MET 42 5.690 7.107 2.830 197 3HE MET 42 3HE MET 42 4.616 6.929 1.445 198 H PHE 43 H PHE 43 5.142 10.256 7.004 199 HA PHE 43 HA PHE 43 2.235 10.556 7.065 200 1HB PHE 43 2HB PHE 43 3.207 8.242 6.663 201 2HB PHE 43 1HB PHE 43 3.810 8.286 8.317 202 HD1 PHE 43 1HD PHE 43 0.737 8.354 6.266 203 HD2 PHE 43 2HD PHE 43 2.375 7.789 10.149 204 HE1 PHE 43 1HE PHE 43 -1.444 7.563 7.065 205 HE2 PHE 43 2HE PHE 43 0.193 6.997 10.956 206 HZ PHE 43 HZ PHE 43 -1.722 6.886 9.414 207 H ALA 44 H ALA 44 4.655 11.963 8.552 208 HA ALA 44 HA ALA 44 3.849 11.670 11.313 209 1HB ALA 44 1HB ALA 44 6.178 12.118 10.738 210 2HB ALA 44 2HB ALA 44 5.521 13.421 11.733 211 3HB ALA 44 3HB ALA 44 5.708 13.648 9.997 212 H GLY 45 H GLY 45 1.930 12.648 9.238 213 1HA GLY 45 2HA GLY 45 0.273 14.245 10.568 214 2HA GLY 45 1HA GLY 45 1.376 15.387 9.791 215 H LYS 46 H LYS 46 -0.021 16.193 8.294 216 HA LYS 46 HA LYS 46 -0.465 14.467 6.042 217 1HB LYS 46 2HB LYS 46 -2.829 15.082 5.738 218 2HB LYS 46 1HB LYS 46 -2.626 14.265 7.271 219 1HG LYS 46 2HG LYS 46 -2.883 17.259 6.931 220 2HG LYS 46 1HG LYS 46 -4.209 16.174 7.346 221 1HD LYS 46 2HD LYS 46 -3.083 15.562 9.402 222 2HD LYS 46 1HD LYS 46 -1.692 16.546 8.958 223 1HE LYS 46 2HE LYS 46 -3.130 18.534 8.993 224 2HE LYS 46 1HE LYS 46 -4.484 17.528 9.498 225 1HZ LYS 46 1HZ LYS 46 -1.954 17.881 10.977 226 2HZ LYS 46 2HZ LYS 46 -3.270 16.937 11.482 227 3HZ LYS 46 3HZ LYS 46 -3.423 18.618 11.366 228 HA PRO 47 HA PRO 47 0.859 18.163 4.100 229 1HB PRO 47 2HB PRO 47 0.034 17.758 1.572 230 2HB PRO 47 1HB PRO 47 1.330 16.790 2.286 231 1HG PRO 47 2HG PRO 47 -1.574 16.126 1.963 232 2HG PRO 47 1HG PRO 47 -0.164 15.109 1.623 233 1HD PRO 47 2HD PRO 47 -1.601 14.889 3.904 234 2HD PRO 47 1HD PRO 47 0.144 14.578 3.849 235 H HIS 48 H HIS 48 0.041 19.947 2.715 236 HA HIS 48 HA HIS 48 -2.582 20.734 3.614 237 1HB HIS 48 2HB HIS 48 -0.453 22.245 2.084 238 2HB HIS 48 1HB HIS 48 -2.042 22.926 2.400 239 HD1 HIS 48 1HD HIS 48 -2.322 24.115 4.607 240 HD2 HIS 48 2HD HIS 48 1.047 21.679 4.538 241 HE1 HIS 48 1HE HIS 48 -1.122 24.575 6.727 242 HE2 HIS 48 2HE HIS 48 0.967 23.195 6.633 243 H HIS 49 H HIS 49 -4.086 19.735 2.630 244 HA HIS 49 HA HIS 49 -3.994 19.510 -0.291 245 1HB HIS 49 2HB HIS 49 -3.861 17.361 0.909 246 2HB HIS 49 1HB HIS 49 -5.352 17.735 1.752 247 HD1 HIS 49 1HD HIS 49 -4.031 16.164 -1.283 248 HD2 HIS 49 2HD HIS 49 -7.681 17.687 -0.026 249 HE1 HIS 49 1HE HIS 49 -5.739 15.151 -2.811 250 HE2 HIS 49 2HE HIS 49 -7.961 15.964 -1.922 251 H VAL 50 H VAL 50 -5.403 20.768 -1.267 252 HA VAL 50 HA VAL 50 -7.609 21.873 0.215 253 HB VAL 50 HB VAL 50 -8.094 23.174 -1.871 254 1HG1 VAL 50 1HG1 VAL 50 -5.237 23.316 -0.915 255 2HG1 VAL 50 2HG1 VAL 50 -6.625 24.114 -0.175 256 3HG1 VAL 50 3HG1 VAL 50 -6.086 24.596 -1.784 257 1HG2 VAL 50 1HG2 VAL 50 -5.601 21.832 -2.921 258 2HG2 VAL 50 2HG2 VAL 50 -6.496 23.120 -3.729 259 3HG2 VAL 50 3HG2 VAL 50 -7.238 21.530 -3.482 260 H SER 51 H SER 51 -9.753 21.477 -0.233 261 HA SER 51 HA SER 51 -10.303 19.307 -2.063 262 1HB SER 51 2HB SER 51 -9.726 18.397 0.240 263 2HB SER 51 1HB SER 51 -11.103 19.303 0.861 264 HG SER 51 HG SER 51 -11.143 17.228 -1.066 265 H LYS 52 H LYS 52 -12.968 19.042 -1.612 266 HA LYS 52 HA LYS 52 -13.856 21.578 -2.530 267 1HB LYS 52 2HB LYS 52 -14.814 19.605 -3.494 268 2HB LYS 52 1HB LYS 52 -15.432 19.090 -1.933 269 1HG LYS 52 2HG LYS 52 -17.003 20.862 -1.853 270 2HG LYS 52 1HG LYS 52 -16.272 21.657 -3.245 271 1HD LYS 52 2HD LYS 52 -17.552 18.947 -3.310 272 2HD LYS 52 1HD LYS 52 -18.377 20.449 -3.760 273 1HE LYS 52 2HE LYS 52 -16.628 20.844 -5.452 274 2HE LYS 52 1HE LYS 52 -15.902 19.302 -5.053 275 1HZ LYS 52 1HZ LYS 52 -18.669 19.634 -6.048 276 2HZ LYS 52 2HZ LYS 52 -17.902 18.181 -5.736 277 3HZ LYS 52 3HZ LYS 52 -17.374 19.166 -7.013 278 H ALA 53 H ALA 53 -14.640 23.147 -1.558 279 HA ALA 53 HA ALA 53 -14.584 23.236 1.275 280 1HB ALA 53 1HB ALA 53 -15.489 25.320 -0.696 281 2HB ALA 53 2HB ALA 53 -13.846 25.109 -0.092 282 3HB ALA 53 3HB ALA 53 -15.138 25.580 1.010 283 H SER 54 H SER 54 -16.166 22.342 2.392 284 HA SER 54 HA SER 54 -18.818 23.386 2.006 285 1HB SER 54 2HB SER 54 -18.327 20.391 2.045 286 2HB SER 54 1HB SER 54 -19.907 21.178 2.055 287 HG SER 54 HG SER 54 -18.481 22.179 0.088 288 HA PRO 55 HA PRO 55 -17.610 23.071 6.430 289 1HB PRO 55 2HB PRO 55 -18.932 25.679 6.646 290 2HB PRO 55 1HB PRO 55 -17.263 25.255 7.031 291 1HG PRO 55 2HG PRO 55 -17.905 26.820 4.920 292 2HG PRO 55 1HG PRO 55 -16.512 25.729 4.908 293 1HD PRO 55 2HD PRO 55 -19.225 25.346 3.699 294 2HD PRO 55 1HD PRO 55 -17.627 24.970 3.019 295 H GLY 56 H GLY 56 -18.977 22.588 8.146 296 1HA GLY 56 2HA GLY 56 -21.773 22.226 7.428 297 2HA GLY 56 1HA GLY 56 -20.919 21.491 8.782 298 H ASN 57 H ASN 57 -23.098 22.340 9.651 299 HA ASN 57 HA ASN 57 -23.053 25.150 10.314 300 1HB ASN 57 2HB ASN 57 -25.211 24.107 9.850 301 2HB ASN 57 1HB ASN 57 -24.950 22.927 11.121 302 1HD2 ASN 57 1HD2 ASN 57 -25.256 23.542 13.262 303 2HD2 ASN 57 2HD2 ASN 57 -26.013 25.019 13.706 304 H ILE 58 H ILE 58 -21.492 25.671 11.689 305 HA ILE 58 HA ILE 58 -20.342 25.909 13.620 306 HB ILE 58 HB ILE 58 -22.628 24.302 14.880 307 1HG1 ILE 58 2HG1 ILE 58 -23.496 26.218 13.634 308 2HG1 ILE 58 1HG1 ILE 58 -23.676 26.473 15.360 309 1HG2 ILE 58 1HG2 ILE 58 -20.721 26.282 16.141 310 2HG2 ILE 58 2HG2 ILE 58 -20.728 24.528 16.381 311 3HG2 ILE 58 3HG2 ILE 58 -22.080 25.505 16.958 312 1HD1 ILE 58 1HD1 ILE 58 -21.705 27.953 15.323 313 2HD1 ILE 58 2HD1 ILE 58 -22.984 28.515 14.243 314 3HD1 ILE 58 3HD1 ILE 58 -21.569 27.699 13.582 315 H GLN 59 H GLN 59 -20.001 23.512 11.859 316 HA GLN 59 HA GLN 59 -17.931 22.271 13.319 317 1HB GLN 59 2HB GLN 59 -18.753 19.927 13.141 318 2HB GLN 59 1HB GLN 59 -19.685 20.889 14.276 319 1HG GLN 59 2HG GLN 59 -21.482 21.072 12.737 320 2HG GLN 59 1HG GLN 59 -20.541 20.310 11.446 321 1HE2 GLN 59 1HE2 GLN 59 -23.107 19.473 12.616 322 2HE2 GLN 59 2HE2 GLN 59 -22.836 17.888 13.233 323 H GLY 60 H GLY 60 -17.142 20.247 11.814 324 1HA GLY 60 2HA GLY 60 -17.646 19.843 9.282 325 2HA GLY 60 1HA GLY 60 -16.973 21.464 9.196 326 H CYS 61 H CYS 61 -15.392 20.389 7.846 327 HA CYS 61 HA CYS 61 -13.122 19.522 9.422 328 1HB CYS 61 2HB CYS 61 -14.307 17.449 8.749 329 2HB CYS 61 1HB CYS 61 -14.241 17.970 7.071 330 HG CYS 61 HG CYS 61 -12.055 16.790 6.562 331 H ASP 62 H ASP 62 -11.126 19.890 8.241 332 HA ASP 62 HA ASP 62 -11.348 22.084 6.368 333 1HB ASP 62 2HB ASP 62 -9.559 22.089 8.062 334 2HB ASP 62 1HB ASP 62 -8.887 20.619 7.371 335 H LEU 63 H LEU 63 -9.985 18.840 6.317 336 HA LEU 63 HA LEU 63 -9.942 18.907 3.423 337 1HB LEU 63 2HB LEU 63 -9.136 16.710 5.349 338 2HB LEU 63 1HB LEU 63 -9.071 16.546 3.614 339 HG LEU 63 HG LEU 63 -7.370 18.428 3.611 340 1HD1 LEU 63 1HD1 LEU 63 -7.839 19.414 5.767 341 2HD1 LEU 63 2HD1 LEU 63 -6.159 18.885 5.671 342 3HD1 LEU 63 3HD1 LEU 63 -7.334 17.933 6.577 343 1HD2 LEU 63 1HD2 LEU 63 -6.676 15.902 5.095 344 2HD2 LEU 63 2HD2 LEU 63 -5.523 16.977 4.304 345 3HD2 LEU 63 3HD2 LEU 63 -6.721 16.108 3.345 346 H HIS 64 H HIS 64 -11.801 18.608 2.458 347 HA HIS 64 HA HIS 64 -14.064 17.335 3.567 348 1HB HIS 64 2HB HIS 64 -14.011 18.991 1.630 349 2HB HIS 64 1HB HIS 64 -13.389 17.696 0.633 350 HD1 HIS 64 1HD HIS 64 -16.435 19.191 1.905 351 HD2 HIS 64 2HD HIS 64 -15.383 15.623 0.075 352 HE1 HIS 64 1HE HIS 64 -18.601 18.202 1.031 353 HE2 HIS 64 2HE HIS 64 -17.890 16.093 -0.172 354 H GLU 65 H GLU 65 -11.500 16.313 1.394 355 HA GLU 65 HA GLU 65 -11.767 13.523 2.187 356 1HB GLU 65 2HB GLU 65 -11.611 14.533 -0.674 357 2HB GLU 65 1HB GLU 65 -11.411 12.853 -0.198 358 1HG GLU 65 2HG GLU 65 -13.675 12.697 0.487 359 2HG GLU 65 1HG GLU 65 -13.899 14.437 0.332 360 H GLY 66 H GLY 66 -9.658 12.490 2.116 361 1HA GLY 66 2HA GLY 66 -7.402 13.098 0.867 362 2HA GLY 66 1HA GLY 66 -7.474 14.413 2.028 363 H ASP 67 H ASP 67 -5.499 13.591 2.849 364 HA ASP 67 HA ASP 67 -5.347 10.974 4.076 365 1HB ASP 67 2HB ASP 67 -3.447 13.333 4.150 366 2HB ASP 67 1HB ASP 67 -3.114 11.775 4.879 367 H TRP 68 H TRP 68 -5.839 10.520 6.152 368 HA TRP 68 HA TRP 68 -6.600 12.796 7.772 369 1HB TRP 68 2HB TRP 68 -7.017 9.848 8.319 370 2HB TRP 68 1HB TRP 68 -7.713 11.183 9.237 371 HD1 TRP 68 HD TRP 68 -8.594 8.881 6.551 372 HE1 TRP 68 1HE TRP 68 -10.626 9.724 5.195 373 HE3 TRP 68 3HE TRP 68 -8.725 13.729 8.177 374 HZ2 TRP 68 2HZ TRP 68 -12.066 12.105 4.848 375 HZ3 TRP 68 3HZ TRP 68 -10.456 15.221 7.273 376 HH2 TRP 68 HH TRP 68 -12.087 14.425 5.645 377 H GLY 69 H GLY 69 -4.028 10.586 7.418 378 1HA GLY 69 2HA GLY 69 -1.903 10.818 8.284 379 2HA GLY 69 1HA GLY 69 -2.478 12.174 9.223 380 H THR 70 H THR 70 -4.234 9.274 9.766 381 HA THR 70 HA THR 70 -2.503 8.539 11.977 382 HB THR 70 HB THR 70 -3.957 10.309 12.912 383 HG1 THR 70 1HG THR 70 -4.925 9.053 14.608 384 1HG2 THR 70 1HG2 THR 70 -6.260 8.492 12.163 385 2HG2 THR 70 2HG2 THR 70 -5.897 10.057 11.438 386 3HG2 THR 70 3HG2 THR 70 -6.391 9.963 13.129 387 H VAL 71 H VAL 71 -3.908 6.734 13.268 388 HA VAL 71 HA VAL 71 -4.036 4.511 11.494 389 HB VAL 71 HB VAL 71 -5.152 4.675 14.306 390 1HG1 VAL 71 1HG1 VAL 71 -4.206 2.308 12.711 391 2HG1 VAL 71 2HG1 VAL 71 -5.876 2.702 13.120 392 3HG1 VAL 71 3HG1 VAL 71 -4.735 2.260 14.392 393 1HG2 VAL 71 1HG2 VAL 71 -2.992 3.822 15.105 394 2HG2 VAL 71 2HG2 VAL 71 -2.824 5.403 14.348 395 3HG2 VAL 71 3HG2 VAL 71 -2.340 3.946 13.476 396 H GLY 72 H GLY 72 -5.806 3.604 10.496 397 1HA GLY 72 2HA GLY 72 -8.082 3.167 10.193 398 2HA GLY 72 1HA GLY 72 -8.461 4.489 11.291 399 H SER 73 H SER 73 -6.163 5.724 9.352 400 HA SER 73 HA SER 73 -7.901 7.377 7.908 401 1HB SER 73 2HB SER 73 -5.518 7.969 8.462 402 2HB SER 73 1HB SER 73 -4.993 6.756 7.301 403 HG SER 73 HG SER 73 -5.211 8.187 5.807 404 H ILE 74 H ILE 74 -8.543 7.326 5.791 405 HA ILE 74 HA ILE 74 -8.023 4.889 4.289 406 HB ILE 74 HB ILE 74 -10.672 6.295 4.679 407 1HG1 ILE 74 2HG1 ILE 74 -9.750 3.495 5.265 408 2HG1 ILE 74 1HG1 ILE 74 -9.918 4.785 6.448 409 1HG2 ILE 74 1HG2 ILE 74 -11.608 4.627 3.134 410 2HG2 ILE 74 2HG2 ILE 74 -9.986 3.998 2.840 411 3HG2 ILE 74 3HG2 ILE 74 -10.400 5.631 2.329 412 1HD1 ILE 74 1HD1 ILE 74 -12.092 3.564 4.791 413 2HD1 ILE 74 2HD1 ILE 74 -12.320 4.839 5.992 414 3HD1 ILE 74 3HD1 ILE 74 -11.780 3.227 6.502 415 H VAL 75 H VAL 75 -7.051 5.447 2.527 416 HA VAL 75 HA VAL 75 -7.668 8.013 1.232 417 HB VAL 75 HB VAL 75 -5.041 6.472 1.112 418 1HG1 VAL 75 1HG1 VAL 75 -4.102 8.481 0.105 419 2HG1 VAL 75 2HG1 VAL 75 -5.689 9.256 0.153 420 3HG1 VAL 75 3HG1 VAL 75 -5.427 7.833 -0.857 421 1HG2 VAL 75 1HG2 VAL 75 -4.088 8.246 2.523 422 2HG2 VAL 75 2HG2 VAL 75 -5.354 7.336 3.354 423 3HG2 VAL 75 3HG2 VAL 75 -5.701 8.939 2.706 424 H PHE 76 H PHE 76 -7.282 7.818 -1.247 425 HA PHE 76 HA PHE 76 -7.971 5.112 -2.093 426 1HB PHE 76 2HB PHE 76 -9.252 7.655 -3.118 427 2HB PHE 76 1HB PHE 76 -9.595 6.018 -3.689 428 HD1 PHE 76 1HD PHE 76 -10.047 4.357 -1.718 429 HD2 PHE 76 2HD PHE 76 -10.768 8.512 -1.596 430 HE1 PHE 76 1HE PHE 76 -11.607 3.989 0.092 431 HE2 PHE 76 2HE PHE 76 -12.396 8.186 0.229 432 HZ PHE 76 HZ PHE 76 -12.832 5.920 1.083 433 H TRP 77 H TRP 77 -6.920 4.354 -3.747 434 HA TRP 77 HA TRP 77 -5.107 6.195 -5.151 435 1HB TRP 77 2HB TRP 77 -4.933 3.169 -4.966 436 2HB TRP 77 1HB TRP 77 -3.809 4.211 -5.807 437 HD1 TRP 77 HD TRP 77 -2.907 6.264 -3.828 438 HE1 TRP 77 1HE TRP 77 -1.720 5.647 -1.607 439 HE3 TRP 77 3HE TRP 77 -4.495 1.434 -3.349 440 HZ2 TRP 77 2HZ TRP 77 -1.479 3.418 0.083 441 HZ3 TRP 77 3HZ TRP 77 -3.739 0.127 -1.417 442 HH2 TRP 77 HH TRP 77 -2.261 1.096 0.267 443 H ASN 78 H ASN 78 -5.468 6.571 -7.227 444 HA ASN 78 HA ASN 78 -7.432 4.886 -8.597 445 1HB ASN 78 2HB ASN 78 -6.411 7.668 -9.247 446 2HB ASN 78 1HB ASN 78 -7.489 6.750 -10.292 447 1HD2 ASN 78 1HD2 ASN 78 -9.644 6.512 -9.698 448 2HD2 ASN 78 2HD2 ASN 78 -10.371 7.461 -8.464 449 H TYR 79 H TYR 79 -6.784 3.643 -10.228 450 HA TYR 79 HA TYR 79 -4.274 4.170 -11.521 451 1HB TYR 79 2HB TYR 79 -3.358 1.927 -11.047 452 2HB TYR 79 1HB TYR 79 -3.510 2.892 -9.591 453 HD1 TYR 79 1HD TYR 79 -4.233 -0.242 -11.144 454 HD2 TYR 79 2HD TYR 79 -5.589 2.417 -8.114 455 HE1 TYR 79 1HE TYR 79 -5.453 -2.091 -10.074 456 HE2 TYR 79 2HE TYR 79 -6.817 0.580 -7.043 457 HH TYR 79 HH TYR 79 -7.782 -1.585 -7.670 458 H VAL 80 H VAL 80 -4.081 3.045 -13.464 459 HA VAL 80 HA VAL 80 -6.659 2.021 -14.363 460 HB VAL 80 HB VAL 80 -4.401 3.251 -15.982 461 1HG1 VAL 80 1HG1 VAL 80 -5.954 3.147 -17.884 462 2HG1 VAL 80 2HG1 VAL 80 -7.135 2.318 -16.877 463 3HG1 VAL 80 3HG1 VAL 80 -5.608 1.533 -17.266 464 1HG2 VAL 80 1HG2 VAL 80 -5.983 5.092 -16.356 465 2HG2 VAL 80 2HG2 VAL 80 -5.619 4.885 -14.641 466 3HG2 VAL 80 3HG2 VAL 80 -7.143 4.292 -15.297 467 H HIS 81 H HIS 81 -6.765 -0.027 -14.623 468 HA HIS 81 HA HIS 81 -4.334 -1.496 -15.380 469 1HB HIS 81 2HB HIS 81 -4.920 -1.857 -12.960 470 2HB HIS 81 1HB HIS 81 -6.471 -2.503 -13.476 471 HD1 HIS 81 1HD HIS 81 -2.773 -3.270 -13.709 472 HD2 HIS 81 2HD HIS 81 -6.442 -5.185 -14.100 473 HE1 HIS 81 1HE HIS 81 -2.247 -5.715 -13.972 474 HE2 HIS 81 2HE HIS 81 -4.449 -6.845 -14.238 475 H ASP 82 H ASP 82 -4.586 -2.304 -17.302 476 HA ASP 82 HA ASP 82 -5.414 -3.232 -19.156 477 1HB ASP 82 2HB ASP 82 -7.396 -4.367 -17.199 478 2HB ASP 82 1HB ASP 82 -7.554 -4.671 -18.922 479 H GLY 83 H GLY 83 -6.080 -0.587 -18.489 480 1HA GLY 83 2HA GLY 83 -7.050 0.985 -19.934 481 2HA GLY 83 1HA GLY 83 -8.110 -0.266 -20.547 482 H GLU 84 H GLU 84 -8.592 -0.736 -17.470 483 HA GLU 84 HA GLU 84 -10.792 1.224 -17.373 484 1HB GLU 84 2HB GLU 84 -10.322 -1.191 -15.669 485 2HB GLU 84 1HB GLU 84 -11.693 -0.117 -15.543 486 1HG GLU 84 2HG GLU 84 -12.369 -0.771 -17.805 487 2HG GLU 84 1HG GLU 84 -10.940 -1.837 -17.813 488 H ALA 85 H ALA 85 -11.126 2.411 -15.592 489 HA ALA 85 HA ALA 85 -8.724 2.954 -14.053 490 1HB ALA 85 1HB ALA 85 -11.390 4.371 -14.091 491 2HB ALA 85 2HB ALA 85 -9.942 4.854 -14.979 492 3HB ALA 85 3HB ALA 85 -9.952 4.901 -13.216 493 H LYS 86 H LYS 86 -8.427 1.852 -12.314 494 HA LYS 86 HA LYS 86 -10.710 0.862 -10.822 495 1HB LYS 86 2HB LYS 86 -7.870 -0.061 -11.044 496 2HB LYS 86 1HB LYS 86 -8.796 -0.430 -9.608 497 1HG LYS 86 2HG LYS 86 -8.787 -2.304 -11.051 498 2HG LYS 86 1HG LYS 86 -10.423 -1.663 -11.034 499 1HD LYS 86 2HD LYS 86 -9.979 -0.708 -13.283 500 2HD LYS 86 1HD LYS 86 -8.348 -1.400 -13.233 501 1HE LYS 86 2HE LYS 86 -9.474 -3.679 -12.800 502 2HE LYS 86 1HE LYS 86 -10.979 -2.857 -13.178 503 1HZ LYS 86 1HZ LYS 86 -10.518 -2.860 -15.407 504 2HZ LYS 86 2HZ LYS 86 -9.803 -4.190 -14.870 505 3HZ LYS 86 3HZ LYS 86 -8.783 -2.920 -15.170 506 H VAL 87 H VAL 87 -10.744 1.116 -8.600 507 HA VAL 87 HA VAL 87 -9.005 3.238 -7.572 508 HB VAL 87 HB VAL 87 -11.944 2.827 -6.896 509 1HG1 VAL 87 1HG1 VAL 87 -10.026 4.983 -6.013 510 2HG1 VAL 87 2HG1 VAL 87 -10.673 3.692 -5.000 511 3HG1 VAL 87 3HG1 VAL 87 -11.748 4.934 -5.642 512 1HG2 VAL 87 1HG2 VAL 87 -10.632 5.021 -8.495 513 2HG2 VAL 87 2HG2 VAL 87 -12.332 4.977 -8.024 514 3HG2 VAL 87 3HG2 VAL 87 -11.688 3.758 -9.131 515 H ALA 88 H ALA 88 -8.121 2.792 -5.644 516 HA ALA 88 HA ALA 88 -8.823 0.214 -4.467 517 1HB ALA 88 1HB ALA 88 -6.491 0.314 -5.173 518 2HB ALA 88 2HB ALA 88 -6.583 0.324 -3.419 519 3HB ALA 88 3HB ALA 88 -6.290 1.829 -4.273 520 H LYS 89 H LYS 89 -9.609 0.175 -2.446 521 HA LYS 89 HA LYS 89 -9.635 2.672 -0.969 522 1HB LYS 89 2HB LYS 89 -11.637 0.390 -0.905 523 2HB LYS 89 1HB LYS 89 -11.767 1.928 -0.065 524 1HG LYS 89 2HG LYS 89 -12.005 3.098 -2.209 525 2HG LYS 89 1HG LYS 89 -11.859 1.561 -3.063 526 1HD LYS 89 2HD LYS 89 -13.895 0.763 -1.845 527 2HD LYS 89 1HD LYS 89 -14.035 2.368 -1.136 528 1HE LYS 89 2HE LYS 89 -14.112 1.775 -4.100 529 2HE LYS 89 1HE LYS 89 -15.521 2.030 -3.080 530 1HZ LYS 89 1HZ LYS 89 -14.776 4.287 -2.663 531 2HZ LYS 89 2HZ LYS 89 -14.925 4.017 -4.300 532 3HZ LYS 89 3HZ LYS 89 -13.404 4.091 -3.603 533 H GLU 90 H GLU 90 -8.739 2.556 1.013 534 HA GLU 90 HA GLU 90 -7.549 -0.006 1.784 535 1HB GLU 90 2HB GLU 90 -5.617 1.308 2.491 536 2HB GLU 90 1HB GLU 90 -5.930 1.523 0.766 537 1HG GLU 90 2HG GLU 90 -7.088 3.628 1.241 538 2HG GLU 90 1HG GLU 90 -6.788 3.414 2.936 539 H ARG 91 H ARG 91 -7.073 -0.117 4.014 540 HA ARG 91 HA ARG 91 -8.251 1.893 5.772 541 1HB ARG 91 2HB ARG 91 -9.831 0.094 5.663 542 2HB ARG 91 1HB ARG 91 -8.587 -1.109 5.867 543 1HG ARG 91 2HG ARG 91 -9.824 -0.909 7.896 544 2HG ARG 91 1HG ARG 91 -8.227 -0.225 8.178 545 1HD ARG 91 2HD ARG 91 -9.111 1.989 7.845 546 2HD ARG 91 1HD ARG 91 -10.719 1.312 7.528 547 HE ARG 91 HE ARG 91 -9.588 0.543 10.061 548 1HH1 ARG 91 1HH1 ARG 91 -11.588 2.997 8.451 549 2HH1 ARG 91 2HH1 ARG 91 -12.340 3.516 9.886 550 1HH2 ARG 91 1HH2 ARG 91 -10.624 1.277 12.023 551 2HH2 ARG 91 2HH2 ARG 91 -11.755 2.548 11.979 552 H ILE 92 H ILE 92 -6.547 2.605 7.017 553 HA ILE 92 HA ILE 92 -4.221 0.943 7.282 554 HB ILE 92 HB ILE 92 -4.904 3.569 8.640 555 1HG1 ILE 92 2HG1 ILE 92 -3.099 2.914 6.301 556 2HG1 ILE 92 1HG1 ILE 92 -4.615 3.801 6.239 557 1HG2 ILE 92 1HG2 ILE 92 -2.530 3.687 9.288 558 2HG2 ILE 92 2HG2 ILE 92 -2.284 2.056 8.655 559 3HG2 ILE 92 3HG2 ILE 92 -3.350 2.319 10.034 560 1HD1 ILE 92 1HD1 ILE 92 -2.050 4.675 7.526 561 2HD1 ILE 92 2HD1 ILE 92 -3.551 5.575 7.639 562 3HD1 ILE 92 3HD1 ILE 92 -2.770 5.342 6.067 563 H GLU 93 H GLU 93 -3.898 -0.543 8.750 564 HA GLU 93 HA GLU 93 -5.914 -0.766 10.862 565 1HB GLU 93 2HB GLU 93 -5.477 -2.651 9.240 566 2HB GLU 93 1HB GLU 93 -3.906 -2.841 10.009 567 1HG GLU 93 2HG GLU 93 -5.469 -4.436 10.906 568 2HG GLU 93 1HG GLU 93 -5.029 -3.258 12.146 569 H ALA 94 H ALA 94 -2.423 -0.755 10.359 570 HA ALA 94 HA ALA 94 -2.022 0.176 13.069 571 1HB ALA 94 1HB ALA 94 -0.234 -1.476 13.489 572 2HB ALA 94 2HB ALA 94 -0.621 -2.277 11.972 573 3HB ALA 94 3HB ALA 94 -1.795 -2.272 13.287 574 H VAL 95 H VAL 95 -0.333 1.631 13.084 575 HA VAL 95 HA VAL 95 1.543 1.491 10.940 576 HB VAL 95 HB VAL 95 -0.207 2.833 9.909 577 1HG1 VAL 95 1HG1 VAL 95 0.085 4.700 12.246 578 2HG1 VAL 95 2HG1 VAL 95 -1.315 3.714 11.818 579 3HG1 VAL 95 3HG1 VAL 95 -0.824 5.038 10.765 580 1HG2 VAL 95 1HG2 VAL 95 2.096 3.354 9.326 581 2HG2 VAL 95 2HG2 VAL 95 2.195 4.493 10.665 582 3HG2 VAL 95 3HG2 VAL 95 1.115 4.822 9.311 583 H GLU 96 H GLU 96 3.452 2.009 11.532 584 HA GLU 96 HA GLU 96 3.813 3.600 13.962 585 1HB GLU 96 2HB GLU 96 4.434 1.187 14.329 586 2HB GLU 96 1HB GLU 96 5.480 1.344 12.915 587 1HG GLU 96 2HG GLU 96 6.658 1.344 15.028 588 2HG GLU 96 1HG GLU 96 6.957 2.726 14.004 589 HA PRO 97 HA PRO 97 5.682 6.035 10.638 590 1HB PRO 97 2HB PRO 97 5.954 7.977 12.847 591 2HB PRO 97 1HB PRO 97 5.175 8.176 11.274 592 1HG PRO 97 2HG PRO 97 3.713 7.979 13.498 593 2HG PRO 97 1HG PRO 97 3.194 7.215 11.987 594 1HD PRO 97 2HD PRO 97 4.520 5.969 14.359 595 2HD PRO 97 1HD PRO 97 3.139 5.390 13.389 596 H ASP 98 H ASP 98 6.856 5.300 13.838 597 HA ASP 98 HA ASP 98 9.427 6.508 13.361 598 1HB ASP 98 2HB ASP 98 8.650 6.436 15.657 599 2HB ASP 98 1HB ASP 98 8.553 4.677 15.598 600 H LYS 99 H LYS 99 8.124 3.356 13.113 601 HA LYS 99 HA LYS 99 10.777 2.258 12.535 602 1HB LYS 99 2HB LYS 99 8.172 0.771 12.958 603 2HB LYS 99 1HB LYS 99 9.783 0.092 12.767 604 1HG LYS 99 2HG LYS 99 8.952 1.847 15.038 605 2HG LYS 99 1HG LYS 99 8.989 0.085 15.071 606 1HD LYS 99 2HD LYS 99 11.366 0.163 14.486 607 2HD LYS 99 1HD LYS 99 11.324 1.920 14.578 608 1HE LYS 99 2HE LYS 99 10.760 0.013 16.862 609 2HE LYS 99 1HE LYS 99 12.211 0.988 16.657 610 1HZ LYS 99 1HZ LYS 99 10.736 2.043 18.222 611 2HZ LYS 99 2HZ LYS 99 9.461 2.017 17.122 612 3HZ LYS 99 3HZ LYS 99 10.794 2.985 16.823 613 H ASN 100 H ASN 100 8.418 3.733 10.870 614 HA ASN 100 HA ASN 100 7.692 3.794 8.696 615 1HB ASN 100 2HB ASN 100 10.153 2.081 8.220 616 2HB ASN 100 1HB ASN 100 9.217 2.877 6.961 617 1HD2 ASN 100 1HD2 ASN 100 12.006 3.138 7.778 618 2HD2 ASN 100 2HD2 ASN 100 12.231 4.828 8.122 619 H LEU 101 H LEU 101 6.334 2.064 10.195 620 HA LEU 101 HA LEU 101 6.060 -0.452 8.642 621 1HB LEU 101 2HB LEU 101 6.826 -0.823 10.926 622 2HB LEU 101 1HB LEU 101 5.508 0.164 11.521 623 HG LEU 101 HG LEU 101 3.944 -1.521 10.510 624 1HD1 LEU 101 1HD1 LEU 101 6.431 -3.164 10.340 625 2HD1 LEU 101 2HD1 LEU 101 5.374 -2.620 9.017 626 3HD1 LEU 101 3HD1 LEU 101 4.773 -3.760 10.216 627 1HD2 LEU 101 1HD2 LEU 101 4.127 -3.054 12.392 628 2HD2 LEU 101 2HD2 LEU 101 4.243 -1.370 12.873 629 3HD2 LEU 101 3HD2 LEU 101 5.707 -2.369 12.802 630 H ILE 102 H ILE 102 4.051 -0.798 7.792 631 HA ILE 102 HA ILE 102 1.782 0.410 9.066 632 HB ILE 102 HB ILE 102 2.444 2.192 7.574 633 1HG1 ILE 102 2HG1 ILE 102 0.023 0.759 6.438 634 2HG1 ILE 102 1HG1 ILE 102 0.009 1.752 7.889 635 1HG2 ILE 102 1HG2 ILE 102 2.498 1.850 5.100 636 2HG2 ILE 102 2HG2 ILE 102 2.302 0.128 5.405 637 3HG2 ILE 102 3HG2 ILE 102 3.742 0.935 5.968 638 1HD1 ILE 102 1HD1 ILE 102 0.628 2.695 5.098 639 2HD1 ILE 102 2HD1 ILE 102 0.620 3.704 6.547 640 3HD1 ILE 102 3HD1 ILE 102 -0.875 2.961 5.981 641 H THR 103 H THR 103 0.218 -0.882 9.123 642 HA THR 103 HA THR 103 0.037 -3.248 7.411 643 HB THR 103 HB THR 103 -1.516 -2.471 9.895 644 HG1 THR 103 1HG THR 103 0.562 -4.377 9.634 645 1HG2 THR 103 1HG2 THR 103 -2.153 -4.834 9.968 646 2HG2 THR 103 2HG2 THR 103 -1.265 -5.128 8.473 647 3HG2 THR 103 3HG2 THR 103 -2.685 -4.082 8.463 648 H PHE 104 H PHE 104 -1.267 -3.146 5.692 649 HA PHE 104 HA PHE 104 -3.432 -1.160 5.525 650 1HB PHE 104 2HB PHE 104 -2.053 -2.855 3.475 651 2HB PHE 104 1HB PHE 104 -3.374 -1.839 3.023 652 HD1 PHE 104 1HD PHE 104 -3.000 0.707 3.336 653 HD2 PHE 104 2HD PHE 104 0.101 -2.197 3.482 654 HE1 PHE 104 1HE PHE 104 -1.344 2.447 2.803 655 HE2 PHE 104 2HE PHE 104 1.746 -0.474 2.959 656 HZ PHE 104 HZ PHE 104 1.060 1.828 2.616 657 H ARG 105 H ARG 105 -5.489 -1.875 5.603 658 HA ARG 105 HA ARG 105 -6.016 -4.714 5.046 659 1HB ARG 105 2HB ARG 105 -6.928 -3.973 7.232 660 2HB ARG 105 1HB ARG 105 -7.774 -2.643 6.476 661 1HG ARG 105 2HG ARG 105 -9.023 -4.361 5.094 662 2HG ARG 105 1HG ARG 105 -8.299 -5.592 6.116 663 1HD ARG 105 2HD ARG 105 -10.086 -3.341 7.030 664 2HD ARG 105 1HD ARG 105 -10.593 -5.005 6.792 665 HE ARG 105 HE ARG 105 -8.575 -4.247 8.820 666 1HH1 ARG 105 1HH1 ARG 105 -11.532 -6.031 7.955 667 2HH1 ARG 105 2HH1 ARG 105 -11.744 -6.667 9.505 668 1HH2 ARG 105 1HH2 ARG 105 -8.890 -5.070 10.877 669 2HH2 ARG 105 2HH2 ARG 105 -10.190 -6.144 11.256 670 H VAL 106 H VAL 106 -6.710 -5.020 3.020 671 HA VAL 106 HA VAL 106 -7.574 -2.743 1.492 672 HB VAL 106 HB VAL 106 -7.439 -5.679 0.715 673 1HG1 VAL 106 1HG1 VAL 106 -7.525 -4.875 -1.576 674 2HG1 VAL 106 2HG1 VAL 106 -7.731 -3.215 -0.999 675 3HG1 VAL 106 3HG1 VAL 106 -8.976 -4.429 -0.684 676 1HG2 VAL 106 1HG2 VAL 106 -5.253 -4.821 1.272 677 2HG2 VAL 106 2HG2 VAL 106 -5.503 -3.424 0.228 678 3HG2 VAL 106 3HG2 VAL 106 -5.385 -5.038 -0.476 679 H ILE 107 H ILE 107 -9.619 -2.113 1.250 680 HA ILE 107 HA ILE 107 -11.608 -3.839 2.497 681 HB ILE 107 HB ILE 107 -13.012 -1.881 2.860 682 1HG1 ILE 107 2HG1 ILE 107 -10.813 -0.373 1.454 683 2HG1 ILE 107 1HG1 ILE 107 -12.450 -0.623 0.860 684 1HG2 ILE 107 1HG2 ILE 107 -11.568 -0.684 4.409 685 2HG2 ILE 107 2HG2 ILE 107 -10.163 -1.258 3.565 686 3HG2 ILE 107 3HG2 ILE 107 -11.160 -2.415 4.485 687 1HD1 ILE 107 1HD1 ILE 107 -13.328 0.672 2.660 688 2HD1 ILE 107 2HD1 ILE 107 -12.060 1.580 1.772 689 3HD1 ILE 107 3HD1 ILE 107 -11.700 0.819 3.338 690 H GLU 108 H GLU 108 -11.210 -1.868 -0.404 691 HA GLU 108 HA GLU 108 -13.596 -2.843 -1.688 692 1HB GLU 108 2HB GLU 108 -12.599 -0.723 -2.374 693 2HB GLU 108 1HB GLU 108 -11.101 -1.514 -2.808 694 1HG GLU 108 2HG GLU 108 -12.365 -0.912 -4.780 695 2HG GLU 108 1HG GLU 108 -12.268 -2.666 -4.635 696 H GLY 109 H GLY 109 -10.296 -3.224 -2.806 697 1HA GLY 109 2HA GLY 109 -8.998 -4.985 -3.272 698 2HA GLY 109 1HA GLY 109 -10.053 -5.939 -2.272 699 H ASP 110 H ASP 110 -8.936 -5.293 -5.378 700 HA ASP 110 HA ASP 110 -10.858 -6.789 -6.867 701 1HB ASP 110 2HB ASP 110 -9.068 -5.408 -7.934 702 2HB ASP 110 1HB ASP 110 -7.856 -6.478 -7.253 703 H LEU 111 H LEU 111 -8.297 -7.364 -4.751 704 HA LEU 111 HA LEU 111 -7.749 -10.100 -5.062 705 1HB LEU 111 2HB LEU 111 -7.507 -8.397 -2.571 706 2HB LEU 111 1HB LEU 111 -6.757 -9.948 -2.786 707 HG LEU 111 HG LEU 111 -5.041 -8.405 -3.007 708 1HD1 LEU 111 1HD1 LEU 111 -5.835 -9.084 -5.802 709 2HD1 LEU 111 2HD1 LEU 111 -4.912 -10.084 -4.685 710 3HD1 LEU 111 3HD1 LEU 111 -4.230 -8.565 -5.282 711 1HD2 LEU 111 1HD2 LEU 111 -6.708 -6.754 -4.921 712 2HD2 LEU 111 2HD2 LEU 111 -5.052 -6.409 -4.433 713 3HD2 LEU 111 3HD2 LEU 111 -6.348 -6.351 -3.242 714 H MET 112 H MET 112 -10.268 -8.341 -3.395 715 HA MET 112 HA MET 112 -11.137 -10.326 -1.575 716 1HB MET 112 2HB MET 112 -12.339 -7.874 -2.699 717 2HB MET 112 1HB MET 112 -13.365 -9.013 -1.862 718 1HG MET 112 2HG MET 112 -12.596 -7.082 -0.465 719 2HG MET 112 1HG MET 112 -12.220 -8.649 0.211 720 1HE MET 112 1HE MET 112 -9.537 -9.685 -0.734 721 2HE MET 112 2HE MET 112 -9.905 -9.361 0.963 722 3HE MET 112 3HE MET 112 -8.420 -8.756 0.258 723 H LYS 113 H LYS 113 -11.396 -10.341 -4.911 724 HA LYS 113 HA LYS 113 -13.874 -11.826 -4.840 725 1HB LYS 113 2HB LYS 113 -12.042 -11.257 -7.171 726 2HB LYS 113 1HB LYS 113 -13.657 -11.942 -7.272 727 1HG LYS 113 2HG LYS 113 -12.938 -9.159 -6.348 728 2HG LYS 113 1HG LYS 113 -13.708 -9.589 -7.871 729 1HD LYS 113 2HD LYS 113 -14.893 -9.965 -5.104 730 2HD LYS 113 1HD LYS 113 -15.329 -8.702 -6.246 731 1HE LYS 113 2HE LYS 113 -16.157 -10.392 -7.809 732 2HE LYS 113 1HE LYS 113 -15.691 -11.672 -6.688 733 1HZ LYS 113 1HZ LYS 113 -17.269 -10.764 -5.081 734 2HZ LYS 113 2HZ LYS 113 -18.049 -11.164 -6.498 735 3HZ LYS 113 3HZ LYS 113 -17.710 -9.556 -6.159 736 H GLU 114 H GLU 114 -10.561 -12.372 -4.669 737 HA GLU 114 HA GLU 114 -10.959 -15.248 -5.148 738 1HB GLU 114 2HB GLU 114 -8.409 -13.628 -5.265 739 2HB GLU 114 1HB GLU 114 -8.417 -15.375 -5.240 740 1HG GLU 114 2HG GLU 114 -8.100 -14.641 -7.493 741 2HG GLU 114 1HG GLU 114 -9.700 -15.352 -7.360 742 H TYR 115 H TYR 115 -9.838 -12.865 -2.872 743 HA TYR 115 HA TYR 115 -9.471 -14.957 -0.834 744 1HB TYR 115 2HB TYR 115 -8.152 -12.233 -0.843 745 2HB TYR 115 1HB TYR 115 -7.722 -13.644 0.123 746 HD1 TYR 115 1HD TYR 115 -7.139 -11.844 -2.840 747 HD2 TYR 115 2HD TYR 115 -6.845 -15.689 -1.129 748 HE1 TYR 115 1HE TYR 115 -5.633 -12.515 -4.661 749 HE2 TYR 115 2HE TYR 115 -5.318 -16.376 -2.931 750 HH TYR 115 HH TYR 115 -4.009 -14.101 -5.104 751 H LYS 116 H LYS 116 -10.591 -14.591 0.990 752 HA LYS 116 HA LYS 116 -12.656 -12.604 0.762 753 1HB LYS 116 2HB LYS 116 -13.552 -13.663 2.856 754 2HB LYS 116 1HB LYS 116 -13.474 -14.694 1.439 755 1HG LYS 116 2HG LYS 116 -11.254 -15.523 2.395 756 2HG LYS 116 1HG LYS 116 -11.741 -14.711 3.885 757 1HD LYS 116 2HD LYS 116 -13.330 -16.813 2.439 758 2HD LYS 116 1HD LYS 116 -12.319 -17.119 3.849 759 1HE LYS 116 2HE LYS 116 -13.734 -15.628 5.174 760 2HE LYS 116 1HE LYS 116 -14.727 -15.292 3.756 761 1HZ LYS 116 1HZ LYS 116 -15.690 -17.021 5.242 762 2HZ LYS 116 2HZ LYS 116 -14.355 -17.976 4.967 763 3HZ LYS 116 3HZ LYS 116 -15.376 -17.620 3.692 764 H SER 117 H SER 117 -9.663 -12.420 1.855 765 HA SER 117 HA SER 117 -9.987 -9.841 2.806 766 1HB SER 117 2HB SER 117 -10.799 -10.874 4.756 767 2HB SER 117 1HB SER 117 -9.340 -11.890 4.926 768 HG SER 117 HG SER 117 -9.317 -9.036 4.905 769 H PHE 118 H PHE 118 -8.016 -8.800 2.921 770 HA PHE 118 HA PHE 118 -5.606 -10.357 2.599 771 1HB PHE 118 2HB PHE 118 -6.342 -9.994 0.290 772 2HB PHE 118 1HB PHE 118 -6.559 -8.271 0.606 773 HD1 PHE 118 1HD PHE 118 -4.040 -10.954 0.380 774 HD2 PHE 118 2HD PHE 118 -4.818 -6.804 0.275 775 HE1 PHE 118 1HE PHE 118 -1.726 -10.545 -0.357 776 HE2 PHE 118 2HE PHE 118 -2.523 -6.377 -0.485 777 HZ PHE 118 HZ PHE 118 -0.974 -8.234 -0.794 778 H LEU 119 H LEU 119 -4.387 -9.636 4.162 779 HA LEU 119 HA LEU 119 -4.449 -6.790 4.888 780 1HB LEU 119 2HB LEU 119 -5.344 -8.444 6.559 781 2HB LEU 119 1HB LEU 119 -3.781 -9.226 6.543 782 HG LEU 119 HG LEU 119 -2.795 -7.096 7.431 783 1HD1 LEU 119 1HD1 LEU 119 -4.324 -5.488 8.462 784 2HD1 LEU 119 2HD1 LEU 119 -5.687 -6.333 7.736 785 3HD1 LEU 119 3HD1 LEU 119 -4.492 -5.536 6.708 786 1HD2 LEU 119 1HD2 LEU 119 -3.600 -7.455 9.718 787 2HD2 LEU 119 2HD2 LEU 119 -3.297 -8.985 8.894 788 3HD2 LEU 119 3HD2 LEU 119 -4.948 -8.402 9.091 789 H LEU 120 H LEU 120 -2.467 -5.818 4.610 790 HA LEU 120 HA LEU 120 -0.150 -7.574 4.478 791 1HB LEU 120 2HB LEU 120 0.798 -6.456 2.546 792 2HB LEU 120 1HB LEU 120 -0.736 -7.185 2.147 793 HG LEU 120 HG LEU 120 -0.323 -4.222 2.635 794 1HD1 LEU 120 1HD1 LEU 120 -0.492 -3.998 0.207 795 2HD1 LEU 120 2HD1 LEU 120 -0.538 -5.758 0.051 796 3HD1 LEU 120 3HD1 LEU 120 0.903 -4.964 0.686 797 1HD2 LEU 120 1HD2 LEU 120 -2.633 -4.939 3.016 798 2HD2 LEU 120 2HD2 LEU 120 -2.649 -5.756 1.464 799 3HD2 LEU 120 3HD2 LEU 120 -2.519 -3.995 1.530 800 H THR 121 H THR 121 1.577 -6.876 5.469 801 HA THR 121 HA THR 121 1.487 -4.129 6.470 802 HB THR 121 HB THR 121 2.790 -6.545 7.743 803 HG1 THR 121 1HG THR 121 0.420 -6.435 7.697 804 1HG2 THR 121 1HG2 THR 121 3.869 -4.427 8.270 805 2HG2 THR 121 2HG2 THR 121 3.011 -5.049 9.684 806 3HG2 THR 121 3HG2 THR 121 2.322 -3.731 8.716 807 H ILE 122 H ILE 122 3.085 -2.875 5.788 808 HA ILE 122 HA ILE 122 5.456 -4.214 4.710 809 HB ILE 122 HB ILE 122 5.796 -2.341 3.199 810 1HG1 ILE 122 2HG1 ILE 122 3.177 -1.250 4.171 811 2HG1 ILE 122 1HG1 ILE 122 4.756 -0.598 4.592 812 1HG2 ILE 122 1HG2 ILE 122 4.446 -4.177 2.342 813 2HG2 ILE 122 2HG2 ILE 122 3.857 -2.636 1.706 814 3HG2 ILE 122 3HG2 ILE 122 2.993 -3.420 3.018 815 1HD1 ILE 122 1HD1 ILE 122 3.591 -0.715 1.811 816 2HD1 ILE 122 2HD1 ILE 122 5.173 -0.071 2.239 817 3HD1 ILE 122 3HD1 ILE 122 3.712 0.722 2.829 818 H GLN 123 H GLN 123 7.409 -3.293 5.176 819 HA GLN 123 HA GLN 123 7.435 -0.950 6.871 820 1HB GLN 123 2HB GLN 123 7.368 -2.923 8.388 821 2HB GLN 123 1HB GLN 123 8.850 -3.498 7.640 822 1HG GLN 123 2HG GLN 123 10.078 -1.620 8.445 823 2HG GLN 123 1HG GLN 123 8.606 -0.843 9.016 824 1HE2 GLN 123 1HE2 GLN 123 9.309 -0.700 11.072 825 2HE2 GLN 123 2HE2 GLN 123 9.434 -2.057 12.134 826 H VAL 124 H VAL 124 8.966 0.346 6.299 827 HA VAL 124 HA VAL 124 10.806 -0.615 4.254 828 HB VAL 124 HB VAL 124 10.246 2.254 5.080 829 1HG1 VAL 124 1HG1 VAL 124 11.282 2.827 2.946 830 2HG1 VAL 124 2HG1 VAL 124 11.595 1.118 2.640 831 3HG1 VAL 124 3HG1 VAL 124 12.393 1.927 3.984 832 1HG2 VAL 124 1HG2 VAL 124 8.218 1.208 4.200 833 2HG2 VAL 124 2HG2 VAL 124 9.109 0.668 2.777 834 3HG2 VAL 124 3HG2 VAL 124 8.857 2.392 3.059 835 H THR 125 H THR 125 12.672 -1.232 4.893 836 HA THR 125 HA THR 125 13.902 -0.022 7.264 837 HB THR 125 HB THR 125 13.934 -2.926 6.394 838 HG1 THR 125 1HG THR 125 12.438 -1.477 8.288 839 1HG2 THR 125 1HG2 THR 125 14.950 -3.367 8.557 840 2HG2 THR 125 2HG2 THR 125 14.968 -1.638 8.927 841 3HG2 THR 125 3HG2 THR 125 15.967 -2.276 7.613 842 HA PRO 126 HA PRO 126 17.281 0.664 4.338 843 1HB PRO 126 2HB PRO 126 19.271 1.001 6.206 844 2HB PRO 126 1HB PRO 126 18.138 2.274 5.743 845 1HG PRO 126 2HG PRO 126 18.066 0.439 8.099 846 2HG PRO 126 1HG PRO 126 17.724 2.179 8.025 847 1HD PRO 126 2HD PRO 126 15.761 0.367 8.124 848 2HD PRO 126 1HD PRO 126 15.603 1.845 7.151 849 H LYS 127 H LYS 127 19.147 -0.429 3.623 850 HA LYS 127 HA LYS 127 19.937 -2.826 5.004 851 1HB LYS 127 2HB LYS 127 18.047 -3.638 3.812 852 2HB LYS 127 1HB LYS 127 18.566 -2.950 2.307 853 1HG LYS 127 2HG LYS 127 20.476 -4.535 2.319 854 2HG LYS 127 1HG LYS 127 19.804 -5.250 3.792 855 1HD LYS 127 2HD LYS 127 17.719 -5.730 2.613 856 2HD LYS 127 1HD LYS 127 18.353 -5.042 1.142 857 1HE LYS 127 2HE LYS 127 20.161 -6.738 1.156 858 2HE LYS 127 1HE LYS 127 19.452 -7.433 2.610 859 1HZ LYS 127 1HZ LYS 127 17.440 -7.877 1.343 860 2HZ LYS 127 2HZ LYS 127 18.764 -8.657 0.676 861 3HZ LYS 127 3HZ LYS 127 18.151 -7.277 -0.054 862 HA PRO 128 HA PRO 128 23.316 -1.905 1.859 863 1HB PRO 128 2HB PRO 128 22.951 -0.662 -0.455 864 2HB PRO 128 1HB PRO 128 22.349 -2.309 -0.238 865 1HG PRO 128 2HG PRO 128 20.840 0.266 -0.207 866 2HG PRO 128 1HG PRO 128 20.368 -1.302 -0.876 867 1HD PRO 128 2HD PRO 128 19.590 -0.287 1.614 868 2HD PRO 128 1HD PRO 128 19.489 -1.973 1.052 869 H GLY 129 H GLY 129 21.420 0.327 3.192 870 1HA GLY 129 2HA GLY 129 23.009 2.152 4.176 871 2HA GLY 129 1HA GLY 129 22.880 2.734 2.516 872 H GLY 130 H GLY 130 21.880 4.598 3.688 873 1HA GLY 130 2HA GLY 130 19.235 4.252 4.764 874 2HA GLY 130 1HA GLY 130 20.044 5.780 4.435 875 HA PRO 131 HA PRO 131 17.709 6.500 0.680 876 1HB PRO 131 2HB PRO 131 19.820 6.771 -1.157 877 2HB PRO 131 1HB PRO 131 19.108 8.084 -0.215 878 1HG PRO 131 2HG PRO 131 21.579 6.495 0.307 879 2HG PRO 131 1HG PRO 131 21.267 8.211 0.610 880 1HD PRO 131 2HD PRO 131 21.273 6.448 2.606 881 2HD PRO 131 1HD PRO 131 20.093 7.772 2.567 882 H GLY 132 H GLY 132 16.722 5.019 -0.599 883 1HA GLY 132 2HA GLY 132 16.520 3.203 -2.009 884 2HA GLY 132 1HA GLY 132 18.267 2.950 -1.888 885 H SER 133 H SER 133 15.291 2.703 -0.069 886 HA SER 133 HA SER 133 16.599 0.919 1.828 887 1HB SER 133 2HB SER 133 13.877 2.214 1.920 888 2HB SER 133 1HB SER 133 14.691 1.365 3.236 889 HG SER 133 HG SER 133 16.404 3.197 2.466 890 H ILE 134 H ILE 134 14.987 -0.868 2.674 891 HA ILE 134 HA ILE 134 14.020 -2.281 0.327 892 HB ILE 134 HB ILE 134 14.842 -3.270 3.045 893 1HG1 ILE 134 2HG1 ILE 134 16.618 -2.473 1.655 894 2HG1 ILE 134 1HG1 ILE 134 16.660 -4.237 1.874 895 1HG2 ILE 134 1HG2 ILE 134 14.601 -5.523 2.116 896 2HG2 ILE 134 2HG2 ILE 134 13.967 -4.846 0.614 897 3HG2 ILE 134 3HG2 ILE 134 13.056 -4.674 2.117 898 1HD1 ILE 134 1HD1 ILE 134 15.765 -2.728 -0.577 899 2HD1 ILE 134 2HD1 ILE 134 15.715 -4.477 -0.363 900 3HD1 ILE 134 3HD1 ILE 134 17.267 -3.641 -0.391 901 H VAL 135 H VAL 135 11.898 -2.879 0.396 902 HA VAL 135 HA VAL 135 10.278 -2.105 2.747 903 HB VAL 135 HB VAL 135 9.149 -3.011 0.117 904 1HG1 VAL 135 1HG1 VAL 135 7.620 -3.025 1.961 905 2HG1 VAL 135 2HG1 VAL 135 7.177 -1.746 0.831 906 3HG1 VAL 135 3HG1 VAL 135 7.996 -1.343 2.339 907 1HG2 VAL 135 1HG2 VAL 135 8.860 -0.736 -0.555 908 2HG2 VAL 135 2HG2 VAL 135 10.561 -1.168 -0.399 909 3HG2 VAL 135 3HG2 VAL 135 9.797 -0.165 0.851 910 H HIS 136 H HIS 136 9.897 -3.716 4.054 911 HA HIS 136 HA HIS 136 9.970 -6.429 3.021 912 1HB HIS 136 2HB HIS 136 9.721 -5.379 5.860 913 2HB HIS 136 1HB HIS 136 9.778 -7.087 5.444 914 HD1 HIS 136 1HD HIS 136 12.081 -8.025 4.680 915 HD2 HIS 136 2HD HIS 136 12.197 -4.034 5.841 916 HE1 HIS 136 1HE HIS 136 14.514 -7.444 4.893 917 HE2 HIS 136 2HE HIS 136 14.565 -5.058 5.636 918 H TRP 137 H TRP 137 8.188 -7.184 2.177 919 HA TRP 137 HA TRP 137 5.605 -6.075 2.949 920 1HB TRP 137 2HB TRP 137 6.502 -7.745 0.602 921 2HB TRP 137 1HB TRP 137 4.833 -7.324 0.921 922 HD1 TRP 137 HD TRP 137 8.220 -5.419 0.110 923 HE1 TRP 137 1HE TRP 137 7.617 -3.433 -1.281 924 HE3 TRP 137 3HE TRP 137 3.088 -5.858 0.148 925 HZ2 TRP 137 2HZ TRP 137 5.333 -2.124 -2.260 926 HZ3 TRP 137 3HZ TRP 137 1.792 -4.153 -1.071 927 HH2 TRP 137 HH TRP 137 2.896 -2.333 -2.239 928 H HIS 138 H HIS 138 4.369 -7.233 4.276 929 HA HIS 138 HA HIS 138 4.690 -10.164 4.263 930 1HB HIS 138 2HB HIS 138 3.626 -8.464 6.544 931 2HB HIS 138 1HB HIS 138 3.933 -10.191 6.580 932 HD1 HIS 138 1HD HIS 138 6.509 -10.944 6.810 933 HD2 HIS 138 2HD HIS 138 5.744 -6.860 6.943 934 HE1 HIS 138 1HE HIS 138 8.587 -9.938 7.647 935 HE2 HIS 138 2HE HIS 138 8.120 -7.484 7.873 936 H LEU 139 H LEU 139 3.023 -11.015 3.164 937 HA LEU 139 HA LEU 139 0.509 -9.524 3.122 938 1HB LEU 139 2HB LEU 139 1.560 -11.595 1.176 939 2HB LEU 139 1HB LEU 139 0.032 -10.764 1.043 940 HG LEU 139 HG LEU 139 1.338 -8.618 0.787 941 1HD1 LEU 139 1HD1 LEU 139 3.489 -9.279 1.677 942 2HD1 LEU 139 2HD1 LEU 139 3.648 -8.767 -0.007 943 3HD1 LEU 139 3HD1 LEU 139 3.671 -10.480 0.397 944 1HD2 LEU 139 1HD2 LEU 139 1.726 -10.743 -1.293 945 2HD2 LEU 139 2HD2 LEU 139 1.863 -9.003 -1.565 946 3HD2 LEU 139 3HD2 LEU 139 0.320 -9.697 -1.077 947 H GLU 140 H GLU 140 -1.159 -10.424 4.139 948 HA GLU 140 HA GLU 140 -1.132 -13.304 4.654 949 1HB GLU 140 2HB GLU 140 -1.876 -11.098 6.598 950 2HB GLU 140 1HB GLU 140 -2.042 -12.823 6.912 951 1HG GLU 140 2HG GLU 140 0.324 -13.130 6.762 952 2HG GLU 140 1HG GLU 140 0.562 -11.445 6.318 953 H TYR 141 H TYR 141 -2.978 -14.243 4.112 954 HA TYR 141 HA TYR 141 -5.400 -12.687 3.855 955 1HB TYR 141 2HB TYR 141 -5.667 -13.281 1.408 956 2HB TYR 141 1HB TYR 141 -4.462 -12.066 1.819 957 HD1 TYR 141 1HD TYR 141 -2.059 -12.603 1.668 958 HD2 TYR 141 2HD TYR 141 -5.019 -15.354 0.385 959 HE1 TYR 141 1HE TYR 141 -0.338 -13.843 0.461 960 HE2 TYR 141 2HE TYR 141 -3.305 -16.619 -0.861 961 HH TYR 141 HH TYR 141 0.009 -16.187 -0.445 962 H GLU 142 H GLU 142 -7.245 -13.910 3.163 963 HA GLU 142 HA GLU 142 -7.100 -16.664 4.221 964 1HB GLU 142 2HB GLU 142 -8.402 -14.944 5.511 965 2HB GLU 142 1HB GLU 142 -9.442 -14.757 4.113 966 1HG GLU 142 2HG GLU 142 -10.555 -16.166 5.694 967 2HG GLU 142 1HG GLU 142 -10.051 -17.157 4.326 968 H LYS 143 H LYS 143 -7.662 -18.260 2.826 969 HA LYS 143 HA LYS 143 -8.372 -17.650 0.107 970 1HB LYS 143 2HB LYS 143 -7.800 -20.181 1.598 971 2HB LYS 143 1HB LYS 143 -8.632 -20.275 0.066 972 1HG LYS 143 2HG LYS 143 -6.244 -20.704 -0.132 973 2HG LYS 143 1HG LYS 143 -6.728 -19.295 -1.055 974 1HD LYS 143 2HD LYS 143 -5.778 -17.848 0.660 975 2HD LYS 143 1HD LYS 143 -5.369 -19.262 1.639 976 1HE LYS 143 2HE LYS 143 -4.348 -18.756 -1.154 977 2HE LYS 143 1HE LYS 143 -3.412 -18.392 0.278 978 1HZ LYS 143 1HZ LYS 143 -2.765 -20.502 -0.598 979 2HZ LYS 143 2HZ LYS 143 -4.345 -21.078 -0.585 980 3HZ LYS 143 3HZ LYS 143 -3.535 -20.763 0.854 981 H ILE 144 H ILE 144 -10.321 -17.611 -0.804 982 HA ILE 144 HA ILE 144 -12.678 -18.287 0.693 983 HB ILE 144 HB ILE 144 -12.315 -17.711 -2.276 984 1HG1 ILE 144 2HG1 ILE 144 -13.383 -15.994 -0.044 985 2HG1 ILE 144 1HG1 ILE 144 -11.808 -15.803 -0.808 986 1HG2 ILE 144 1HG2 ILE 144 -14.893 -17.936 -0.702 987 2HG2 ILE 144 2HG2 ILE 144 -14.317 -19.070 -1.924 988 3HG2 ILE 144 3HG2 ILE 144 -14.757 -17.426 -2.383 989 1HD1 ILE 144 1HD1 ILE 144 -13.389 -14.159 -1.615 990 2HD1 ILE 144 2HD1 ILE 144 -14.498 -15.445 -2.106 991 3HD1 ILE 144 3HD1 ILE 144 -12.935 -15.268 -2.916 992 H SER 145 H SER 145 -10.775 -19.652 -1.889 993 HA SER 145 HA SER 145 -11.457 -22.310 -1.131 994 1HB SER 145 2HB SER 145 -13.326 -21.757 -2.646 995 2HB SER 145 1HB SER 145 -12.179 -21.225 -3.867 996 HG SER 145 HG SER 145 -13.163 -23.445 -3.888 997 H GLU 146 H GLU 146 -10.167 -23.797 -2.558 998 HA GLU 146 HA GLU 146 -7.430 -23.027 -2.396 999 1HB GLU 146 2HB GLU 146 -8.743 -25.324 -3.726 1000 2HB GLU 146 1HB GLU 146 -7.006 -25.193 -3.534 1001 1HG GLU 146 2HG GLU 146 -7.289 -25.230 -1.079 1002 2HG GLU 146 1HG GLU 146 -9.034 -25.393 -1.299 1003 H GLU 147 H GLU 147 -9.376 -24.028 -5.143 1004 HA GLU 147 HA GLU 147 -7.472 -23.532 -7.173 1005 1HB GLU 147 2HB GLU 147 -9.372 -23.885 -8.690 1006 2HB GLU 147 1HB GLU 147 -9.283 -25.107 -7.433 1007 1HG GLU 147 2HG GLU 147 -11.046 -23.999 -6.185 1008 2HG GLU 147 1HG GLU 147 -11.101 -22.712 -7.388 1009 H VAL 148 H VAL 148 -9.601 -21.561 -5.527 1010 HA VAL 148 HA VAL 148 -9.984 -19.590 -7.613 1011 HB VAL 148 HB VAL 148 -10.707 -19.444 -4.670 1012 1HG1 VAL 148 1HG1 VAL 148 -11.622 -17.708 -6.965 1013 2HG1 VAL 148 2HG1 VAL 148 -10.530 -17.221 -5.672 1014 3HG1 VAL 148 3HG1 VAL 148 -12.210 -17.621 -5.302 1015 1HG2 VAL 148 1HG2 VAL 148 -12.383 -20.132 -7.077 1016 2HG2 VAL 148 2HG2 VAL 148 -12.971 -19.970 -5.419 1017 3HG2 VAL 148 3HG2 VAL 148 -11.828 -21.248 -5.831 1018 H ALA 149 H ALA 149 -7.901 -20.050 -4.898 1019 HA ALA 149 HA ALA 149 -6.900 -17.359 -4.876 1020 1HB ALA 149 1HB ALA 149 -6.990 -18.593 -2.835 1021 2HB ALA 149 2HB ALA 149 -5.298 -18.280 -3.240 1022 3HB ALA 149 3HB ALA 149 -5.982 -19.872 -3.533 1023 H HIS 150 H HIS 150 -5.101 -16.602 -5.850 1024 HA HIS 150 HA HIS 150 -3.252 -18.471 -7.091 1025 1HB HIS 150 2HB HIS 150 -4.614 -16.201 -8.573 1026 2HB HIS 150 1HB HIS 150 -3.127 -16.944 -9.135 1027 HD1 HIS 150 1HD HIS 150 -3.352 -19.019 -10.486 1028 HD2 HIS 150 2HD HIS 150 -6.903 -17.996 -8.604 1029 HE1 HIS 150 1HE HIS 150 -5.086 -20.580 -11.423 1030 HE2 HIS 150 2HE HIS 150 -7.247 -19.678 -10.520 1031 HA PRO 151 HA PRO 151 -1.047 -15.701 -4.232 1032 1HB PRO 151 2HB PRO 151 1.017 -17.602 -5.286 1033 2HB PRO 151 1HB PRO 151 0.834 -16.947 -3.649 1034 1HG PRO 151 2HG PRO 151 -0.109 -19.356 -4.057 1035 2HG PRO 151 1HG PRO 151 -1.130 -18.169 -3.243 1036 1HD PRO 151 2HD PRO 151 -1.287 -19.104 -6.086 1037 2HD PRO 151 1HD PRO 151 -2.587 -18.780 -4.917 1038 H GLU 152 H GLU 152 -0.331 -16.301 -7.560 1039 HA GLU 152 HA GLU 152 1.852 -14.655 -8.137 1040 1HB GLU 152 2HB GLU 152 -0.609 -14.883 -9.848 1041 2HB GLU 152 1HB GLU 152 1.039 -14.583 -10.363 1042 1HG GLU 152 2HG GLU 152 -0.060 -17.093 -9.204 1043 2HG GLU 152 1HG GLU 152 0.339 -16.802 -10.893 1044 H THR 153 H THR 153 -1.555 -13.985 -7.904 1045 HA THR 153 HA THR 153 -1.631 -11.430 -8.995 1046 HB THR 153 HB THR 153 -3.890 -11.294 -7.995 1047 HG1 THR 153 1HG THR 153 -3.473 -13.856 -6.907 1048 1HG2 THR 153 1HG2 THR 153 -3.536 -12.612 -10.059 1049 2HG2 THR 153 2HG2 THR 153 -4.789 -13.342 -9.051 1050 3HG2 THR 153 3HG2 THR 153 -3.167 -14.032 -9.083 1051 H LEU 154 H LEU 154 -0.945 -12.465 -5.706 1052 HA LEU 154 HA LEU 154 -1.251 -9.856 -4.577 1053 1HB LEU 154 2HB LEU 154 0.254 -12.218 -3.458 1054 2HB LEU 154 1HB LEU 154 -0.202 -10.776 -2.586 1055 HG LEU 154 HG LEU 154 -1.696 -12.314 -1.844 1056 1HD1 LEU 154 1HD1 LEU 154 -3.125 -11.000 -4.102 1057 2HD1 LEU 154 2HD1 LEU 154 -2.881 -10.364 -2.477 1058 3HD1 LEU 154 3HD1 LEU 154 -3.895 -11.788 -2.724 1059 1HD2 LEU 154 1HD2 LEU 154 -2.040 -13.384 -4.630 1060 2HD2 LEU 154 2HD2 LEU 154 -2.908 -13.937 -3.189 1061 3HD2 LEU 154 3HD2 LEU 154 -1.150 -14.098 -3.283 1062 H LEU 155 H LEU 155 1.396 -11.717 -5.899 1063 HA LEU 155 HA LEU 155 3.384 -9.839 -5.120 1064 1HB LEU 155 2HB LEU 155 3.424 -12.019 -7.191 1065 2HB LEU 155 1HB LEU 155 4.816 -11.045 -6.763 1066 HG LEU 155 HG LEU 155 3.339 -12.898 -4.906 1067 1HD1 LEU 155 1HD1 LEU 155 6.037 -13.061 -6.183 1068 2HD1 LEU 155 2HD1 LEU 155 4.636 -14.074 -6.571 1069 3HD1 LEU 155 3HD1 LEU 155 5.410 -14.188 -4.981 1070 1HD2 LEU 155 1HD2 LEU 155 5.796 -11.201 -4.468 1071 2HD2 LEU 155 2HD2 LEU 155 5.190 -12.418 -3.348 1072 3HD2 LEU 155 3HD2 LEU 155 4.231 -10.980 -3.693 1073 H GLN 156 H GLN 156 1.256 -10.196 -7.800 1074 HA GLN 156 HA GLN 156 2.514 -8.245 -9.414 1075 1HB GLN 156 2HB GLN 156 -0.346 -9.195 -9.432 1076 2HB GLN 156 1HB GLN 156 0.404 -8.201 -10.679 1077 1HG GLN 156 2HG GLN 156 2.063 -10.002 -11.019 1078 2HG GLN 156 1HG GLN 156 1.127 -11.002 -9.909 1079 1HE2 GLN 156 1HE2 GLN 156 1.269 -9.484 -12.922 1080 2HE2 GLN 156 2HE2 GLN 156 -0.040 -10.324 -13.694 1081 H PHE 157 H PHE 157 -0.171 -8.175 -7.094 1082 HA PHE 157 HA PHE 157 -0.756 -5.436 -7.240 1083 1HB PHE 157 2HB PHE 157 -2.178 -7.068 -6.020 1084 2HB PHE 157 1HB PHE 157 -0.900 -7.306 -4.840 1085 HD1 PHE 157 1HD PHE 157 -0.998 -6.109 -2.851 1086 HD2 PHE 157 2HD PHE 157 -3.045 -4.612 -6.263 1087 HE1 PHE 157 1HE PHE 157 -2.012 -4.273 -1.453 1088 HE2 PHE 157 2HE PHE 157 -4.042 -2.822 -4.892 1089 HZ PHE 157 HZ PHE 157 -3.512 -2.666 -2.494 1090 H CYS 158 H CYS 158 1.575 -7.237 -5.354 1091 HA CYS 158 HA CYS 158 2.680 -5.206 -3.828 1092 1HB CYS 158 2HB CYS 158 3.123 -7.518 -3.356 1093 2HB CYS 158 1HB CYS 158 3.888 -7.735 -4.925 1094 HG CYS 158 HG CYS 158 5.129 -5.898 -2.311 1095 H VAL 159 H VAL 159 3.783 -6.390 -7.031 1096 HA VAL 159 HA VAL 159 5.984 -4.617 -7.098 1097 HB VAL 159 HB VAL 159 5.884 -6.692 -8.418 1098 1HG1 VAL 159 1HG1 VAL 159 3.991 -5.261 -10.232 1099 2HG1 VAL 159 2HG1 VAL 159 3.629 -6.644 -9.213 1100 3HG1 VAL 159 3HG1 VAL 159 4.741 -6.819 -10.575 1101 1HG2 VAL 159 1HG2 VAL 159 6.400 -4.205 -10.018 1102 2HG2 VAL 159 2HG2 VAL 159 6.972 -5.815 -10.465 1103 3HG2 VAL 159 3HG2 VAL 159 7.556 -5.041 -8.985 1104 H GLU 160 H GLU 160 2.783 -4.388 -8.333 1105 HA GLU 160 HA GLU 160 3.204 -1.976 -9.805 1106 1HB GLU 160 2HB GLU 160 0.587 -3.022 -8.717 1107 2HB GLU 160 1HB GLU 160 0.755 -1.756 -9.919 1108 1HG GLU 160 2HG GLU 160 1.502 -4.659 -10.230 1109 2HG GLU 160 1HG GLU 160 0.159 -3.821 -11.001 1110 H VAL 161 H VAL 161 2.196 -2.587 -6.497 1111 HA VAL 161 HA VAL 161 1.818 0.191 -5.974 1112 HB VAL 161 HB VAL 161 2.133 -2.129 -4.041 1113 1HG1 VAL 161 1HG1 VAL 161 1.239 -0.597 -2.313 1114 2HG1 VAL 161 2HG1 VAL 161 1.253 0.721 -3.488 1115 3HG1 VAL 161 3HG1 VAL 161 2.771 -0.005 -2.956 1116 1HG2 VAL 161 1HG2 VAL 161 0.127 -2.261 -5.407 1117 2HG2 VAL 161 2HG2 VAL 161 -0.312 -0.613 -4.954 1118 3HG2 VAL 161 3HG2 VAL 161 -0.293 -1.890 -3.735 1119 H SER 162 H SER 162 4.534 -2.087 -5.530 1120 HA SER 162 HA SER 162 6.252 -0.486 -4.048 1121 1HB SER 162 2HB SER 162 6.932 -2.436 -6.247 1122 2HB SER 162 1HB SER 162 8.057 -1.789 -5.050 1123 HG SER 162 HG SER 162 5.780 -3.426 -4.568 1124 H LYS 163 H LYS 163 5.802 -0.579 -7.555 1125 HA LYS 163 HA LYS 163 7.862 1.323 -8.066 1126 1HB LYS 163 2HB LYS 163 7.015 1.385 -10.366 1127 2HB LYS 163 1HB LYS 163 7.163 -0.265 -9.794 1128 1HG LYS 163 2HG LYS 163 4.740 -0.324 -9.381 1129 2HG LYS 163 1HG LYS 163 4.608 1.323 -9.965 1130 1HD LYS 163 2HD LYS 163 3.919 -0.063 -11.759 1131 2HD LYS 163 1HD LYS 163 5.537 0.484 -12.166 1132 1HE LYS 163 2HE LYS 163 4.873 -2.227 -10.974 1133 2HE LYS 163 1HE LYS 163 5.098 -1.916 -12.685 1134 1HZ LYS 163 1HZ LYS 163 7.409 -1.248 -12.146 1135 2HZ LYS 163 2HZ LYS 163 7.049 -2.842 -11.767 1136 3HZ LYS 163 3HZ LYS 163 7.153 -1.743 -10.539 1137 H GLU 164 H GLU 164 4.421 1.540 -7.496 1138 HA GLU 164 HA GLU 164 3.984 4.188 -8.348 1139 1HB GLU 164 2HB GLU 164 2.227 2.472 -7.961 1140 2HB GLU 164 1HB GLU 164 2.545 2.574 -6.238 1141 1HG GLU 164 2HG GLU 164 0.561 3.819 -6.754 1142 2HG GLU 164 1HG GLU 164 1.841 4.938 -6.285 1143 H ILE 165 H ILE 165 4.565 2.779 -5.143 1144 HA ILE 165 HA ILE 165 4.456 5.273 -3.795 1145 HB ILE 165 HB ILE 165 3.876 3.057 -2.794 1146 1HG1 ILE 165 2HG1 ILE 165 4.331 5.016 -1.271 1147 2HG1 ILE 165 1HG1 ILE 165 4.601 3.463 -0.514 1148 1HG2 ILE 165 1HG2 ILE 165 5.610 1.593 -1.845 1149 2HG2 ILE 165 2HG2 ILE 165 6.823 2.542 -2.707 1150 3HG2 ILE 165 3HG2 ILE 165 5.592 1.658 -3.608 1151 1HD1 ILE 165 1HD1 ILE 165 6.283 5.096 0.130 1152 2HD1 ILE 165 2HD1 ILE 165 6.722 5.325 -1.563 1153 3HD1 ILE 165 3HD1 ILE 165 7.015 3.772 -0.782 1154 H ASP 166 H ASP 166 7.093 3.278 -4.994 1155 HA ASP 166 HA ASP 166 9.249 4.577 -3.747 1156 1HB ASP 166 2HB ASP 166 9.611 2.479 -4.835 1157 2HB ASP 166 1HB ASP 166 9.137 3.150 -6.392 1158 H GLU 167 H GLU 167 7.955 5.185 -7.007 1159 HA GLU 167 HA GLU 167 9.717 7.391 -7.206 1160 1HB GLU 167 2HB GLU 167 8.666 7.946 -9.363 1161 2HB GLU 167 1HB GLU 167 9.242 6.297 -9.272 1162 1HG GLU 167 2HG GLU 167 6.938 5.549 -8.924 1163 2HG GLU 167 1HG GLU 167 6.396 7.227 -9.078 1164 H HIS 168 H HIS 168 6.471 7.035 -6.165 1165 HA HIS 168 HA HIS 168 5.599 9.679 -6.257 1166 1HB HIS 168 2HB HIS 168 4.140 7.819 -5.518 1167 2HB HIS 168 1HB HIS 168 5.094 7.633 -4.060 1168 HD1 HIS 168 1HD HIS 168 2.234 9.491 -5.465 1169 HD2 HIS 168 2HD HIS 168 4.702 9.767 -2.137 1170 HE1 HIS 168 1HE HIS 168 1.077 11.067 -3.893 1171 HE2 HIS 168 2HE HIS 168 2.511 11.050 -1.812 1172 H LEU 169 H LEU 169 7.832 8.143 -3.985 1173 HA LEU 169 HA LEU 169 7.959 10.440 -2.274 1174 1HB LEU 169 2HB LEU 169 9.830 8.086 -2.459 1175 2HB LEU 169 1HB LEU 169 9.875 9.305 -1.205 1176 HG LEU 169 HG LEU 169 7.666 7.308 -1.689 1177 1HD1 LEU 169 1HD1 LEU 169 9.672 7.584 0.545 1178 2HD1 LEU 169 2HD1 LEU 169 9.644 6.322 -0.687 1179 3HD1 LEU 169 3HD1 LEU 169 8.341 6.428 0.497 1180 1HD2 LEU 169 1HD2 LEU 169 6.679 8.193 0.361 1181 2HD2 LEU 169 2HD2 LEU 169 6.754 9.420 -0.902 1182 3HD2 LEU 169 3HD2 LEU 169 7.925 9.435 0.421 1183 H LEU 170 H LEU 170 9.717 9.370 -5.047 1184 HA LEU 170 HA LEU 170 11.833 11.302 -4.694 1185 1HB LEU 170 2HB LEU 170 11.146 9.513 -7.021 1186 2HB LEU 170 1HB LEU 170 12.589 10.501 -6.910 1187 HG LEU 170 HG LEU 170 11.898 8.183 -5.095 1188 1HD1 LEU 170 1HD1 LEU 170 12.484 7.469 -7.319 1189 2HD1 LEU 170 2HD1 LEU 170 13.757 7.050 -6.174 1190 3HD1 LEU 170 3HD1 LEU 170 13.961 8.429 -7.267 1191 1HD2 LEU 170 1HD2 LEU 170 14.181 8.460 -4.243 1192 2HD2 LEU 170 2HD2 LEU 170 13.173 9.869 -3.912 1193 3HD2 LEU 170 3HD2 LEU 170 14.358 9.917 -5.220 1194 H ALA 171 H ALA 171 8.820 11.074 -6.259 1195 HA ALA 171 HA ALA 171 9.035 13.116 -8.196 1196 1HB ALA 171 1HB ALA 171 6.592 13.007 -8.272 1197 2HB ALA 171 2HB ALA 171 6.615 12.064 -6.770 1198 3HB ALA 171 3HB ALA 171 7.312 11.389 -8.237 1199 H GLU 172 H GLU 172 8.711 13.257 -4.805 1200 HA GLU 172 HA GLU 172 7.995 16.094 -4.987 1201 1HB GLU 172 2HB GLU 172 6.977 15.872 -2.745 1202 2HB GLU 172 1HB GLU 172 6.152 14.922 -3.971 1203 1HG GLU 172 2HG GLU 172 7.243 12.909 -3.177 1204 2HG GLU 172 1HG GLU 172 8.152 13.850 -2.002 1205 H GLU 173 H GLU 173 8.825 17.380 -3.236 1206 HA GLU 173 HA GLU 173 11.456 16.462 -2.403 1207 1HB GLU 173 2HB GLU 173 10.216 19.232 -2.376 1208 2HB GLU 173 1HB GLU 173 11.808 18.859 -1.739 1209 1HG GLU 173 2HG GLU 173 12.012 19.907 -3.894 1210 2HG GLU 173 1HG GLU 173 12.525 18.230 -4.022 Start of MODEL 11 1 H THR 17 H THR 17 -0.131 -24.494 -4.478 2 HA THR 17 HA THR 17 -0.980 -23.411 -2.692 3 HB THR 17 HB THR 17 -3.449 -22.934 -4.387 4 HG1 THR 17 1HG THR 17 -2.346 -21.459 -5.440 5 1HG2 THR 17 1HG2 THR 17 -3.617 -22.206 -2.022 6 2HG2 THR 17 2HG2 THR 17 -3.606 -20.841 -3.134 7 3HG2 THR 17 3HG2 THR 17 -2.146 -21.250 -2.229 8 H GLU 18 H GLU 18 -1.673 -26.374 -3.236 9 HA GLU 18 HA GLU 18 -4.190 -26.829 -2.020 10 1HB GLU 18 2HB GLU 18 -2.987 -28.476 -3.484 11 2HB GLU 18 1HB GLU 18 -1.831 -28.587 -2.133 12 1HG GLU 18 2HG GLU 18 -3.444 -29.469 -0.673 13 2HG GLU 18 1HG GLU 18 -4.729 -29.218 -1.857 14 H ALA 19 H ALA 19 -4.657 -26.635 0.062 15 HA ALA 19 HA ALA 19 -2.706 -27.222 2.079 16 1HB ALA 19 1HB ALA 19 -3.813 -24.455 1.737 17 2HB ALA 19 2HB ALA 19 -2.200 -25.016 1.324 18 3HB ALA 19 3HB ALA 19 -2.709 -25.004 3.033 19 H SER 20 H SER 20 -3.670 -27.688 4.017 20 HA SER 20 HA SER 20 -6.407 -28.315 3.900 21 1HB SER 20 2HB SER 20 -5.937 -29.071 6.288 22 2HB SER 20 1HB SER 20 -5.018 -29.865 5.009 23 HG SER 20 HG SER 20 -3.322 -29.224 6.024 24 H SER 21 H SER 21 -4.557 -25.753 5.480 25 HA SER 21 HA SER 21 -6.873 -24.905 6.980 26 1HB SER 21 2HB SER 21 -5.372 -23.143 7.814 27 2HB SER 21 1HB SER 21 -4.676 -24.756 7.999 28 HG SER 21 HG SER 21 -3.082 -23.635 7.151 29 H LEU 22 H LEU 22 -5.509 -24.273 3.913 30 HA LEU 22 HA LEU 22 -5.752 -22.790 2.275 31 1HB LEU 22 2HB LEU 22 -8.275 -22.130 3.752 32 2HB LEU 22 1HB LEU 22 -7.889 -21.504 2.169 33 HG LEU 22 HG LEU 22 -8.050 -24.452 2.755 34 1HD1 LEU 22 1HD1 LEU 22 -10.200 -24.375 1.677 35 2HD1 LEU 22 2HD1 LEU 22 -10.104 -22.590 1.631 36 3HD1 LEU 22 3HD1 LEU 22 -10.120 -23.462 3.183 37 1HD2 LEU 22 1HD2 LEU 22 -8.235 -24.628 0.313 38 2HD2 LEU 22 2HD2 LEU 22 -6.711 -23.889 0.787 39 3HD2 LEU 22 3HD2 LEU 22 -8.027 -22.889 0.168 40 H VAL 23 H VAL 23 -5.108 -21.807 5.296 41 HA VAL 23 HA VAL 23 -5.056 -18.993 4.876 42 HB VAL 23 HB VAL 23 -3.609 -20.679 6.950 43 1HG1 VAL 23 1HG1 VAL 23 -2.538 -18.498 6.637 44 2HG1 VAL 23 2HG1 VAL 23 -3.358 -18.586 8.196 45 3HG1 VAL 23 3HG1 VAL 23 -4.093 -17.692 6.866 46 1HG2 VAL 23 1HG2 VAL 23 -6.153 -19.117 7.070 47 2HG2 VAL 23 2HG2 VAL 23 -5.387 -19.898 8.459 48 3HG2 VAL 23 3HG2 VAL 23 -6.008 -20.874 7.117 49 H GLY 24 H GLY 24 -3.526 -17.856 4.032 50 1HA GLY 24 2HA GLY 24 -0.986 -19.156 3.457 51 2HA GLY 24 1HA GLY 24 -1.910 -18.455 2.128 52 H LYS 25 H LYS 25 0.676 -17.768 3.124 53 HA LYS 25 HA LYS 25 0.162 -15.012 3.229 54 1HB LYS 25 2HB LYS 25 1.692 -14.604 5.171 55 2HB LYS 25 1HB LYS 25 0.164 -15.341 5.604 56 1HG LYS 25 2HG LYS 25 1.732 -16.380 6.941 57 2HG LYS 25 1HG LYS 25 1.431 -17.516 5.633 58 1HD LYS 25 2HD LYS 25 3.842 -17.428 6.092 59 2HD LYS 25 1HD LYS 25 3.483 -16.725 4.510 60 1HE LYS 25 2HE LYS 25 3.700 -14.485 5.388 61 2HE LYS 25 1HE LYS 25 3.876 -15.102 7.033 62 1HZ LYS 25 1HZ LYS 25 5.952 -16.100 6.395 63 2HZ LYS 25 2HZ LYS 25 6.006 -14.468 6.060 64 3HZ LYS 25 3HZ LYS 25 5.816 -15.588 4.811 65 H LEU 26 H LEU 26 1.856 -13.794 2.580 66 HA LEU 26 HA LEU 26 4.008 -15.309 1.333 67 1HB LEU 26 2HB LEU 26 2.198 -15.007 -0.316 68 2HB LEU 26 1HB LEU 26 2.203 -13.287 -0.029 69 HG LEU 26 HG LEU 26 4.575 -14.743 -1.240 70 1HD1 LEU 26 1HD1 LEU 26 3.737 -13.987 -3.391 71 2HD1 LEU 26 2HD1 LEU 26 2.279 -13.363 -2.614 72 3HD1 LEU 26 3HD1 LEU 26 2.607 -15.101 -2.612 73 1HD2 LEU 26 1HD2 LEU 26 5.002 -12.489 -0.315 74 2HD2 LEU 26 2HD2 LEU 26 3.716 -11.845 -1.333 75 3HD2 LEU 26 3HD2 LEU 26 5.171 -12.532 -2.067 76 H GLU 27 H GLU 27 5.896 -14.229 1.318 77 HA GLU 27 HA GLU 27 5.828 -11.483 2.259 78 1HB GLU 27 2HB GLU 27 6.241 -13.041 4.178 79 2HB GLU 27 1HB GLU 27 7.691 -13.590 3.353 80 1HG GLU 27 2HG GLU 27 8.692 -11.433 3.542 81 2HG GLU 27 1HG GLU 27 7.191 -10.748 4.167 82 H THR 28 H THR 28 7.099 -10.209 1.088 83 HA THR 28 HA THR 28 9.293 -11.388 -0.375 84 HB THR 28 HB THR 28 7.321 -11.464 -1.965 85 HG1 THR 28 1HG THR 28 9.060 -11.266 -3.088 86 1HG2 THR 28 1HG2 THR 28 6.082 -9.526 -1.088 87 2HG2 THR 28 2HG2 THR 28 6.393 -9.352 -2.813 88 3HG2 THR 28 3HG2 THR 28 7.363 -8.449 -1.651 89 H ASP 29 H ASP 29 10.670 -9.661 -1.294 90 HA ASP 29 HA ASP 29 10.425 -7.186 0.219 91 1HB ASP 29 2HB ASP 29 12.847 -7.129 0.605 92 2HB ASP 29 1HB ASP 29 12.135 -8.559 1.333 93 H VAL 30 H VAL 30 10.684 -5.442 -0.921 94 HA VAL 30 HA VAL 30 11.818 -5.746 -3.601 95 HB VAL 30 HB VAL 30 9.561 -3.851 -2.770 96 1HG1 VAL 30 1HG1 VAL 30 11.022 -2.820 -4.421 97 2HG1 VAL 30 2HG1 VAL 30 9.453 -3.227 -5.108 98 3HG1 VAL 30 3HG1 VAL 30 10.858 -4.236 -5.471 99 1HG2 VAL 30 1HG2 VAL 30 9.540 -6.222 -4.627 100 2HG2 VAL 30 2HG2 VAL 30 8.183 -5.137 -4.310 101 3HG2 VAL 30 3HG2 VAL 30 8.809 -6.164 -3.017 102 H GLU 31 H GLU 31 13.339 -4.262 -4.150 103 HA GLU 31 HA GLU 31 14.276 -2.604 -1.939 104 1HB GLU 31 2HB GLU 31 15.641 -2.952 -4.604 105 2HB GLU 31 1HB GLU 31 16.231 -2.323 -3.064 106 1HG GLU 31 2HG GLU 31 16.170 -4.491 -2.072 107 2HG GLU 31 1HG GLU 31 15.467 -5.178 -3.537 108 H ILE 32 H ILE 32 14.201 -0.425 -2.002 109 HA ILE 32 HA ILE 32 13.366 0.768 -4.519 110 HB ILE 32 HB ILE 32 12.334 2.615 -3.228 111 1HG1 ILE 32 2HG1 ILE 32 12.864 0.871 -0.807 112 2HG1 ILE 32 1HG1 ILE 32 13.661 2.395 -1.164 113 1HG2 ILE 32 1HG2 ILE 32 10.909 0.825 -4.023 114 2HG2 ILE 32 2HG2 ILE 32 10.329 1.406 -2.462 115 3HG2 ILE 32 3HG2 ILE 32 11.227 -0.110 -2.560 116 1HD1 ILE 32 1HD1 ILE 32 11.961 2.680 0.522 117 2HD1 ILE 32 2HD1 ILE 32 10.735 2.020 -0.561 118 3HD1 ILE 32 3HD1 ILE 32 11.513 3.556 -0.941 119 H LYS 33 H LYS 33 14.182 2.962 -4.801 120 HA LYS 33 HA LYS 33 17.022 2.978 -4.048 121 1HB LYS 33 2HB LYS 33 15.542 4.908 -5.813 122 2HB LYS 33 1HB LYS 33 17.261 4.566 -5.803 123 1HG LYS 33 2HG LYS 33 16.901 2.382 -6.719 124 2HG LYS 33 1HG LYS 33 15.155 2.580 -6.593 125 1HD LYS 33 2HD LYS 33 15.393 4.558 -8.140 126 2HD LYS 33 1HD LYS 33 17.059 4.036 -8.400 127 1HE LYS 33 2HE LYS 33 15.563 3.173 -10.140 128 2HE LYS 33 1HE LYS 33 16.282 1.873 -9.189 129 1HZ LYS 33 1HZ LYS 33 13.873 1.580 -9.588 130 2HZ LYS 33 2HZ LYS 33 13.550 2.971 -8.705 131 3HZ LYS 33 3HZ LYS 33 14.239 1.654 -7.951 132 H ALA 34 H ALA 34 14.070 4.256 -3.238 133 HA ALA 34 HA ALA 34 14.859 6.828 -2.313 134 1HB ALA 34 1HB ALA 34 12.341 5.277 -1.805 135 2HB ALA 34 2HB ALA 34 12.618 6.392 -3.141 136 3HB ALA 34 3HB ALA 34 12.593 6.989 -1.480 137 H SER 35 H SER 35 14.940 7.543 -0.255 138 HA SER 35 HA SER 35 16.083 5.780 1.664 139 1HB SER 35 2HB SER 35 15.423 8.651 1.463 140 2HB SER 35 1HB SER 35 16.212 8.110 2.905 141 HG SER 35 HG SER 35 17.655 7.117 1.031 142 H ALA 36 H ALA 36 15.017 4.808 3.329 143 HA ALA 36 HA ALA 36 12.264 5.096 3.862 144 1HB ALA 36 1HB ALA 36 13.605 3.130 4.570 145 2HB ALA 36 2HB ALA 36 12.686 3.845 5.890 146 3HB ALA 36 3HB ALA 36 14.424 4.152 5.758 147 H ASP 37 H ASP 37 15.152 6.543 5.113 148 HA ASP 37 HA ASP 37 14.162 8.085 7.214 149 1HB ASP 37 2HB ASP 37 16.545 7.916 6.816 150 2HB ASP 37 1HB ASP 37 16.372 8.665 5.234 151 H LYS 38 H LYS 38 14.269 8.670 3.766 152 HA LYS 38 HA LYS 38 13.294 11.347 3.872 153 1HB LYS 38 2HB LYS 38 14.636 10.425 2.008 154 2HB LYS 38 1HB LYS 38 13.256 9.415 1.556 155 1HG LYS 38 2HG LYS 38 11.933 11.420 1.336 156 2HG LYS 38 1HG LYS 38 13.412 12.335 1.727 157 1HD LYS 38 2HD LYS 38 14.481 11.461 -0.265 158 2HD LYS 38 1HD LYS 38 13.021 10.559 -0.683 159 1HE LYS 38 2HE LYS 38 11.761 12.611 -0.730 160 2HE LYS 38 1HE LYS 38 13.225 13.522 -0.339 161 1HZ LYS 38 1HZ LYS 38 12.673 11.960 -2.809 162 2HZ LYS 38 2HZ LYS 38 14.183 12.643 -2.449 163 3HZ LYS 38 3HZ LYS 38 12.830 13.632 -2.692 164 H PHE 39 H PHE 39 11.806 8.189 3.393 165 HA PHE 39 HA PHE 39 9.176 9.103 2.844 166 1HB PHE 39 2HB PHE 39 10.170 6.709 2.625 167 2HB PHE 39 1HB PHE 39 9.892 6.564 4.347 168 HD1 PHE 39 1HD PHE 39 8.809 4.784 2.167 169 HD2 PHE 39 2HD PHE 39 7.134 8.190 4.081 170 HE1 PHE 39 1HE PHE 39 6.553 3.937 1.690 171 HE2 PHE 39 2HE PHE 39 4.876 7.350 3.609 172 HZ PHE 39 HZ PHE 39 4.581 5.219 2.407 173 H HIS 40 H HIS 40 10.946 8.322 5.767 174 HA HIS 40 HA HIS 40 8.973 8.744 7.702 175 1HB HIS 40 2HB HIS 40 11.041 7.591 8.202 176 2HB HIS 40 1HB HIS 40 11.978 9.018 7.814 177 HD1 HIS 40 1HD HIS 40 12.896 10.001 9.833 178 HD2 HIS 40 2HD HIS 40 9.180 8.322 10.564 179 HE1 HIS 40 1HE HIS 40 12.509 10.324 12.253 180 HE2 HIS 40 2HE HIS 40 10.458 9.014 12.740 181 H HIS 41 H HIS 41 10.985 10.997 5.950 182 HA HIS 41 HA HIS 41 10.556 13.322 7.513 183 1HB HIS 41 2HB HIS 41 11.054 13.121 4.536 184 2HB HIS 41 1HB HIS 41 10.972 14.635 5.414 185 HD1 HIS 41 1HD HIS 41 13.449 14.470 4.029 186 HD2 HIS 41 2HD HIS 41 12.997 12.445 7.615 187 HE1 HIS 41 1HE HIS 41 15.765 14.088 4.873 188 HE2 HIS 41 2HE HIS 41 15.398 12.439 6.671 189 H MET 42 H MET 42 8.562 11.696 5.191 190 HA MET 42 HA MET 42 6.790 13.902 4.835 191 1HB MET 42 2HB MET 42 6.475 10.987 4.128 192 2HB MET 42 1HB MET 42 5.307 12.232 3.705 193 1HG MET 42 2HG MET 42 7.017 13.394 2.404 194 2HG MET 42 1HG MET 42 8.186 12.149 2.834 195 1HE MET 42 1HE MET 42 7.552 13.108 -0.143 196 2HE MET 42 2HE MET 42 7.515 11.563 -0.990 197 3HE MET 42 3HE MET 42 8.740 11.864 0.240 198 H PHE 43 H PHE 43 7.004 11.319 7.121 199 HA PHE 43 HA PHE 43 4.334 11.826 8.131 200 1HB PHE 43 2HB PHE 43 6.603 10.194 9.291 201 2HB PHE 43 1HB PHE 43 5.010 10.333 10.021 202 HD1 PHE 43 1HD PHE 43 3.043 9.373 8.843 203 HD2 PHE 43 2HD PHE 43 7.022 8.715 7.516 204 HE1 PHE 43 1HE PHE 43 2.275 7.445 7.526 205 HE2 PHE 43 2HE PHE 43 6.266 6.788 6.191 206 HZ PHE 43 HZ PHE 43 3.893 6.146 6.196 207 H ALA 44 H ALA 44 7.591 12.746 8.814 208 HA ALA 44 HA ALA 44 6.792 14.364 11.120 209 1HB ALA 44 1HB ALA 44 8.816 12.992 11.325 210 2HB ALA 44 2HB ALA 44 9.233 14.706 11.373 211 3HB ALA 44 3HB ALA 44 9.495 13.772 9.897 212 H GLY 45 H GLY 45 5.930 14.888 8.396 213 1HA GLY 45 2HA GLY 45 7.542 17.101 7.470 214 2HA GLY 45 1HA GLY 45 6.204 16.346 6.628 215 H LYS 46 H LYS 46 6.358 17.779 9.870 216 HA LYS 46 HA LYS 46 4.510 19.791 8.844 217 1HB LYS 46 2HB LYS 46 4.733 18.828 11.737 218 2HB LYS 46 1HB LYS 46 3.827 20.232 11.240 219 1HG LYS 46 2HG LYS 46 2.225 18.550 11.513 220 2HG LYS 46 1HG LYS 46 2.456 18.675 9.778 221 1HD LYS 46 2HD LYS 46 2.309 16.342 10.358 222 2HD LYS 46 1HD LYS 46 3.983 16.689 9.927 223 1HE LYS 46 2HE LYS 46 4.641 16.747 12.239 224 2HE LYS 46 1HE LYS 46 2.965 16.651 12.766 225 1HZ LYS 46 1HZ LYS 46 2.847 14.408 11.880 226 2HZ LYS 46 2HZ LYS 46 4.098 14.534 12.969 227 3HZ LYS 46 3HZ LYS 46 4.433 14.482 11.328 228 HA PRO 47 HA PRO 47 8.407 21.974 9.334 229 1HB PRO 47 2HB PRO 47 7.104 23.996 7.655 230 2HB PRO 47 1HB PRO 47 8.563 23.054 7.345 231 1HG PRO 47 2HG PRO 47 6.284 22.619 5.989 232 2HG PRO 47 1HG PRO 47 7.401 21.307 6.403 233 1HD PRO 47 2HD PRO 47 4.842 22.101 7.738 234 2HD PRO 47 1HD PRO 47 5.458 20.485 7.320 235 H HIS 48 H HIS 48 8.875 24.331 9.730 236 HA HIS 48 HA HIS 48 7.358 25.152 12.027 237 1HB HIS 48 2HB HIS 48 9.760 26.433 10.694 238 2HB HIS 48 1HB HIS 48 9.070 26.911 12.239 239 HD1 HIS 48 1HD HIS 48 11.533 24.711 10.754 240 HD2 HIS 48 2HD HIS 48 9.360 24.836 14.286 241 HE1 HIS 48 1HE HIS 48 12.712 23.130 12.329 242 HE2 HIS 48 2HE HIS 48 11.241 23.062 14.363 243 H HIS 49 H HIS 49 6.353 27.210 12.191 244 HA HIS 49 HA HIS 49 5.706 28.421 9.610 245 1HB HIS 49 2HB HIS 49 3.902 26.859 10.405 246 2HB HIS 49 1HB HIS 49 3.741 27.855 11.840 247 HD1 HIS 49 1HD HIS 49 2.532 27.464 8.463 248 HD2 HIS 49 2HD HIS 49 2.761 30.558 11.210 249 HE1 HIS 49 1HE HIS 49 0.914 29.205 7.653 250 HE2 HIS 49 2HE HIS 49 1.278 31.149 9.188 251 H VAL 50 H VAL 50 6.549 30.404 9.770 252 HA VAL 50 HA VAL 50 6.991 31.626 12.306 253 HB VAL 50 HB VAL 50 7.898 33.559 11.062 254 1HG1 VAL 50 1HG1 VAL 50 8.855 30.888 10.055 255 2HG1 VAL 50 2HG1 VAL 50 9.370 31.697 11.536 256 3HG1 VAL 50 3HG1 VAL 50 9.758 32.398 9.963 257 1HG2 VAL 50 1HG2 VAL 50 8.071 33.489 8.612 258 2HG2 VAL 50 2HG2 VAL 50 6.394 33.557 9.149 259 3HG2 VAL 50 3HG2 VAL 50 7.079 32.030 8.588 260 H SER 51 H SER 51 6.142 33.600 13.091 261 HA SER 51 HA SER 51 3.643 34.425 11.885 262 1HB SER 51 2HB SER 51 2.986 32.682 13.470 263 2HB SER 51 1HB SER 51 3.887 33.480 14.752 264 HG SER 51 HG SER 51 2.018 34.352 15.116 265 H LYS 52 H LYS 52 4.671 36.347 11.384 266 HA LYS 52 HA LYS 52 5.612 38.038 13.557 267 1HB LYS 52 2HB LYS 52 6.636 38.186 11.272 268 2HB LYS 52 1HB LYS 52 5.079 38.772 10.683 269 1HG LYS 52 2HG LYS 52 5.262 40.735 12.115 270 2HG LYS 52 1HG LYS 52 6.793 40.137 12.756 271 1HD LYS 52 2HD LYS 52 7.194 41.824 11.051 272 2HD LYS 52 1HD LYS 52 7.750 40.239 10.498 273 1HE LYS 52 2HE LYS 52 5.679 39.956 9.247 274 2HE LYS 52 1HE LYS 52 5.139 41.547 9.784 275 1HZ LYS 52 1HZ LYS 52 6.067 41.631 7.565 276 2HZ LYS 52 2HZ LYS 52 7.526 40.981 8.112 277 3HZ LYS 52 3HZ LYS 52 7.039 42.517 8.624 278 H ALA 53 H ALA 53 2.885 37.740 11.423 279 HA ALA 53 HA ALA 53 1.222 38.957 13.420 280 1HB ALA 53 1HB ALA 53 1.255 39.974 10.571 281 2HB ALA 53 2HB ALA 53 1.848 40.849 11.975 282 3HB ALA 53 3HB ALA 53 0.128 40.482 11.834 283 H SER 54 H SER 54 0.461 36.860 13.661 284 HA SER 54 HA SER 54 -1.381 36.018 11.600 285 1HB SER 54 2HB SER 54 0.899 34.249 12.491 286 2HB SER 54 1HB SER 54 -0.432 33.772 11.436 287 HG SER 54 HG SER 54 0.497 35.930 10.392 288 HA PRO 55 HA PRO 55 -3.185 34.882 15.655 289 1HB PRO 55 2HB PRO 55 -5.699 35.057 14.125 290 2HB PRO 55 1HB PRO 55 -5.235 35.931 15.585 291 1HG PRO 55 2HG PRO 55 -5.449 37.165 13.200 292 2HG PRO 55 1HG PRO 55 -4.247 37.653 14.403 293 1HD PRO 55 2HD PRO 55 -3.897 35.969 11.952 294 2HD PRO 55 1HD PRO 55 -2.850 37.256 12.594 295 H GLY 56 H GLY 56 -3.493 33.797 12.419 296 1HA GLY 56 2HA GLY 56 -3.154 31.098 12.837 297 2HA GLY 56 1HA GLY 56 -4.901 31.372 12.802 298 H ASN 57 H ASN 57 -1.934 32.028 11.019 299 HA ASN 57 HA ASN 57 -3.561 32.675 8.714 300 1HB ASN 57 2HB ASN 57 -0.645 33.178 9.230 301 2HB ASN 57 1HB ASN 57 -1.404 33.448 7.668 302 1HD2 ASN 57 1HD2 ASN 57 -0.904 35.633 7.809 303 2HD2 ASN 57 2HD2 ASN 57 -1.816 36.715 8.802 304 H ILE 58 H ILE 58 -4.245 30.828 8.017 305 HA ILE 58 HA ILE 58 -2.262 29.186 6.635 306 HB ILE 58 HB ILE 58 -4.924 28.345 7.845 307 1HG1 ILE 58 2HG1 ILE 58 -3.115 28.437 9.500 308 2HG1 ILE 58 1HG1 ILE 58 -3.633 26.779 9.217 309 1HG2 ILE 58 1HG2 ILE 58 -4.449 26.075 7.022 310 2HG2 ILE 58 2HG2 ILE 58 -3.059 26.703 6.140 311 3HG2 ILE 58 3HG2 ILE 58 -4.689 27.237 5.720 312 1HD1 ILE 58 1HD1 ILE 58 -1.144 28.085 8.118 313 2HD1 ILE 58 2HD1 ILE 58 -1.671 26.433 7.780 314 3HD1 ILE 58 3HD1 ILE 58 -1.226 26.900 9.418 315 H GLN 59 H GLN 59 -2.503 29.385 4.507 316 HA GLN 59 HA GLN 59 -4.750 30.919 3.547 317 1HB GLN 59 2HB GLN 59 -3.596 30.903 1.348 318 2HB GLN 59 1HB GLN 59 -2.624 31.552 2.656 319 1HG GLN 59 2HG GLN 59 -1.456 29.382 2.806 320 2HG GLN 59 1HG GLN 59 -2.397 28.816 1.430 321 1HE2 GLN 59 1HE2 GLN 59 0.112 30.956 2.492 322 2HE2 GLN 59 2HE2 GLN 59 0.745 31.315 0.928 323 H GLY 60 H GLY 60 -4.288 27.733 4.038 324 1HA GLY 60 2HA GLY 60 -5.732 25.981 3.628 325 2HA GLY 60 1HA GLY 60 -6.755 27.121 2.768 326 H CYS 61 H CYS 61 -3.759 25.311 2.438 327 HA CYS 61 HA CYS 61 -4.189 25.191 -0.466 328 1HB CYS 61 2HB CYS 61 -1.766 24.444 1.183 329 2HB CYS 61 1HB CYS 61 -1.864 24.484 -0.575 330 HG CYS 61 HG CYS 61 -2.175 27.204 -0.764 331 H ASP 62 H ASP 62 -4.953 23.570 2.234 332 HA ASP 62 HA ASP 62 -4.235 20.915 1.373 333 1HB ASP 62 2HB ASP 62 -5.161 20.139 3.484 334 2HB ASP 62 1HB ASP 62 -4.032 21.459 3.749 335 H LEU 63 H LEU 63 -5.468 19.530 0.495 336 HA LEU 63 HA LEU 63 -8.386 19.743 0.585 337 1HB LEU 63 2HB LEU 63 -6.686 18.947 -1.798 338 2HB LEU 63 1HB LEU 63 -8.423 18.750 -1.720 339 HG LEU 63 HG LEU 63 -6.958 21.394 -1.711 340 1HD1 LEU 63 1HD1 LEU 63 -8.547 20.017 -3.876 341 2HD1 LEU 63 2HD1 LEU 63 -6.797 20.253 -3.861 342 3HD1 LEU 63 3HD1 LEU 63 -7.874 21.644 -3.963 343 1HD2 LEU 63 1HD2 LEU 63 -9.073 21.504 -0.493 344 2HD2 LEU 63 2HD2 LEU 63 -9.907 20.752 -1.856 345 3HD2 LEU 63 3HD2 LEU 63 -9.195 22.354 -2.032 346 H HIS 64 H HIS 64 -5.741 17.663 -0.532 347 HA HIS 64 HA HIS 64 -6.283 15.736 1.550 348 1HB HIS 64 2HB HIS 64 -6.211 14.937 -1.397 349 2HB HIS 64 1HB HIS 64 -6.198 13.830 -0.043 350 HD1 HIS 64 1HD HIS 64 -8.447 15.745 -2.217 351 HD2 HIS 64 2HD HIS 64 -8.716 13.693 1.387 352 HE1 HIS 64 1HE HIS 64 -10.899 15.410 -1.805 353 HE2 HIS 64 2HE HIS 64 -10.997 14.453 0.523 354 H GLU 65 H GLU 65 -4.329 15.497 2.438 355 HA GLU 65 HA GLU 65 -1.991 16.128 0.817 356 1HB GLU 65 2HB GLU 65 -2.225 15.615 3.793 357 2HB GLU 65 1HB GLU 65 -0.797 16.205 2.954 358 1HG GLU 65 2HG GLU 65 -1.983 18.241 2.328 359 2HG GLU 65 1HG GLU 65 -3.437 17.651 3.123 360 H GLY 66 H GLY 66 -3.771 13.517 1.620 361 1HA GLY 66 2HA GLY 66 -2.496 11.533 0.426 362 2HA GLY 66 1HA GLY 66 -1.658 11.595 1.982 363 H ASP 67 H ASP 67 -2.433 9.956 3.132 364 HA ASP 67 HA ASP 67 -5.287 9.465 3.041 365 1HB ASP 67 2HB ASP 67 -4.876 7.509 4.414 366 2HB ASP 67 1HB ASP 67 -3.657 7.536 3.152 367 H TRP 68 H TRP 68 -5.840 8.820 5.650 368 HA TRP 68 HA TRP 68 -6.191 11.487 6.638 369 1HB TRP 68 2HB TRP 68 -7.091 8.856 7.796 370 2HB TRP 68 1HB TRP 68 -7.582 10.443 8.378 371 HD1 TRP 68 HD TRP 68 -8.204 7.966 5.547 372 HE1 TRP 68 1HE TRP 68 -10.245 8.743 4.188 373 HE3 TRP 68 3HE TRP 68 -8.891 12.574 7.664 374 HZ2 TRP 68 2HZ TRP 68 -11.924 11.001 4.029 375 HZ3 TRP 68 3HZ TRP 68 -10.738 13.977 6.847 376 HH2 TRP 68 HH TRP 68 -12.221 13.203 5.068 377 H GLY 69 H GLY 69 -3.872 8.985 7.240 378 1HA GLY 69 2HA GLY 69 -1.989 9.118 8.520 379 2HA GLY 69 1HA GLY 69 -2.508 10.704 9.077 380 H THR 70 H THR 70 -4.792 8.220 9.408 381 HA THR 70 HA THR 70 -4.184 8.055 12.261 382 HB THR 70 HB THR 70 -6.904 8.426 10.984 383 HG1 THR 70 1HG THR 70 -4.950 10.127 11.681 384 1HG2 THR 70 1HG2 THR 70 -6.059 8.474 13.892 385 2HG2 THR 70 2HG2 THR 70 -6.977 7.180 13.115 386 3HG2 THR 70 3HG2 THR 70 -7.685 8.787 13.282 387 H VAL 71 H VAL 71 -4.574 6.064 13.198 388 HA VAL 71 HA VAL 71 -4.762 3.761 11.537 389 HB VAL 71 HB VAL 71 -5.020 3.996 14.551 390 1HG1 VAL 71 1HG1 VAL 71 -4.450 1.586 12.847 391 2HG1 VAL 71 2HG1 VAL 71 -5.926 1.899 13.751 392 3HG1 VAL 71 3HG1 VAL 71 -4.408 1.628 14.609 393 1HG2 VAL 71 1HG2 VAL 71 -2.672 3.365 14.636 394 2HG2 VAL 71 2HG2 VAL 71 -2.879 4.859 13.715 395 3HG2 VAL 71 3HG2 VAL 71 -2.612 3.329 12.880 396 H GLY 72 H GLY 72 -6.547 2.590 10.945 397 1HA GLY 72 2HA GLY 72 -8.689 1.731 11.169 398 2HA GLY 72 1HA GLY 72 -9.064 2.960 12.370 399 H SER 73 H SER 73 -7.558 4.582 10.006 400 HA SER 73 HA SER 73 -10.003 5.639 8.991 401 1HB SER 73 2HB SER 73 -7.137 6.240 8.316 402 2HB SER 73 1HB SER 73 -8.534 7.162 7.755 403 HG SER 73 HG SER 73 -8.716 6.842 10.393 404 H ILE 74 H ILE 74 -10.677 5.659 6.873 405 HA ILE 74 HA ILE 74 -9.576 3.536 5.214 406 HB ILE 74 HB ILE 74 -12.423 4.467 5.600 407 1HG1 ILE 74 2HG1 ILE 74 -11.100 1.791 5.870 408 2HG1 ILE 74 1HG1 ILE 74 -11.373 2.878 7.216 409 1HG2 ILE 74 1HG2 ILE 74 -13.075 2.851 3.866 410 2HG2 ILE 74 2HG2 ILE 74 -11.379 2.527 3.525 411 3HG2 ILE 74 3HG2 ILE 74 -12.057 4.118 3.188 412 1HD1 ILE 74 1HD1 ILE 74 -13.426 1.541 5.481 413 2HD1 ILE 74 2HD1 ILE 74 -13.795 2.671 6.798 414 3HD1 ILE 74 3HD1 ILE 74 -12.998 1.133 7.154 415 H VAL 75 H VAL 75 -8.850 4.147 3.291 416 HA VAL 75 HA VAL 75 -9.621 6.760 2.237 417 HB VAL 75 HB VAL 75 -7.409 6.928 3.396 418 1HG1 VAL 75 1HG1 VAL 75 -6.600 4.690 3.150 419 2HG1 VAL 75 2HG1 VAL 75 -5.428 5.825 2.479 420 3HG1 VAL 75 3HG1 VAL 75 -6.471 4.888 1.402 421 1HG2 VAL 75 1HG2 VAL 75 -7.235 7.221 0.394 422 2HG2 VAL 75 2HG2 VAL 75 -6.126 7.957 1.545 423 3HG2 VAL 75 3HG2 VAL 75 -7.824 8.435 1.529 424 H PHE 76 H PHE 76 -9.263 6.864 -0.166 425 HA PHE 76 HA PHE 76 -9.157 4.183 -1.309 426 1HB PHE 76 2HB PHE 76 -11.042 6.399 -2.160 427 2HB PHE 76 1HB PHE 76 -10.878 4.812 -2.920 428 HD1 PHE 76 1HD PHE 76 -11.015 2.849 -1.227 429 HD2 PHE 76 2HD PHE 76 -12.801 6.635 -0.651 430 HE1 PHE 76 1HE PHE 76 -12.550 1.836 0.353 431 HE2 PHE 76 2HE PHE 76 -14.389 5.654 0.955 432 HZ PHE 76 HZ PHE 76 -14.285 3.245 1.467 433 H TRP 77 H TRP 77 -7.681 3.949 -2.807 434 HA TRP 77 HA TRP 77 -6.494 6.367 -3.951 435 1HB TRP 77 2HB TRP 77 -5.122 4.861 -2.439 436 2HB TRP 77 1HB TRP 77 -5.306 3.610 -3.656 437 HD1 TRP 77 HD TRP 77 -4.115 4.029 -5.959 438 HE1 TRP 77 1HE TRP 77 -1.988 5.423 -6.585 439 HE3 TRP 77 3HE TRP 77 -3.892 6.953 -1.834 440 HZ2 TRP 77 2HZ TRP 77 -0.461 7.506 -5.410 441 HZ3 TRP 77 3HZ TRP 77 -2.095 8.621 -1.629 442 HH2 TRP 77 HH TRP 77 -0.420 8.890 -3.377 443 H ASN 78 H ASN 78 -6.369 6.555 -6.110 444 HA ASN 78 HA ASN 78 -7.759 4.541 -7.732 445 1HB ASN 78 2HB ASN 78 -7.078 7.440 -8.336 446 2HB ASN 78 1HB ASN 78 -7.865 6.344 -9.458 447 1HD2 ASN 78 1HD2 ASN 78 -8.208 8.224 -6.580 448 2HD2 ASN 78 2HD2 ASN 78 -9.929 8.137 -6.488 449 H TYR 79 H TYR 79 -6.651 3.443 -9.236 450 HA TYR 79 HA TYR 79 -4.005 4.331 -9.996 451 1HB TYR 79 2HB TYR 79 -3.117 2.014 -9.485 452 2HB TYR 79 1HB TYR 79 -3.449 3.015 -8.078 453 HD1 TYR 79 1HD TYR 79 -4.552 0.021 -9.992 454 HD2 TYR 79 2HD TYR 79 -5.222 2.430 -6.545 455 HE1 TYR 79 1HE TYR 79 -5.945 -1.727 -9.041 456 HE2 TYR 79 2HE TYR 79 -6.628 0.692 -5.606 457 HH TYR 79 HH TYR 79 -7.956 -1.172 -6.357 458 H VAL 80 H VAL 80 -3.236 3.202 -11.836 459 HA VAL 80 HA VAL 80 -5.379 1.904 -13.328 460 HB VAL 80 HB VAL 80 -2.829 3.194 -14.380 461 1HG1 VAL 80 1HG1 VAL 80 -3.816 2.850 -16.619 462 2HG1 VAL 80 2HG1 VAL 80 -5.181 2.009 -15.890 463 3HG1 VAL 80 3HG1 VAL 80 -3.571 1.315 -15.797 464 1HG2 VAL 80 1HG2 VAL 80 -4.324 4.910 -15.313 465 2HG2 VAL 80 2HG2 VAL 80 -4.421 4.845 -13.549 466 3HG2 VAL 80 3HG2 VAL 80 -5.694 4.116 -14.521 467 H HIS 81 H HIS 81 -5.228 -0.118 -13.446 468 HA HIS 81 HA HIS 81 -2.631 -1.433 -13.436 469 1HB HIS 81 2HB HIS 81 -3.332 -1.348 -11.100 470 2HB HIS 81 1HB HIS 81 -4.878 -2.066 -11.487 471 HD1 HIS 81 1HD HIS 81 -1.290 -2.814 -10.972 472 HD2 HIS 81 2HD HIS 81 -4.818 -4.830 -11.757 473 HE1 HIS 81 1HE HIS 81 -0.732 -5.255 -10.689 474 HE2 HIS 81 2HE HIS 81 -2.926 -6.435 -10.949 475 H ASP 82 H ASP 82 -2.578 -2.822 -15.043 476 HA ASP 82 HA ASP 82 -3.137 -4.082 -16.817 477 1HB ASP 82 2HB ASP 82 -5.634 -4.699 -15.213 478 2HB ASP 82 1HB ASP 82 -5.258 -5.462 -16.751 479 H GLY 83 H GLY 83 -3.812 -1.316 -16.664 480 1HA GLY 83 2HA GLY 83 -4.564 0.112 -18.336 481 2HA GLY 83 1HA GLY 83 -5.423 -1.226 -19.067 482 H GLU 84 H GLU 84 -6.415 -1.434 -16.020 483 HA GLU 84 HA GLU 84 -8.810 0.156 -16.539 484 1HB GLU 84 2HB GLU 84 -8.068 -1.854 -14.500 485 2HB GLU 84 1HB GLU 84 -9.562 -0.919 -14.359 486 1HG GLU 84 2HG GLU 84 -10.256 -1.949 -16.444 487 2HG GLU 84 1HG GLU 84 -8.701 -2.833 -16.439 488 H ALA 85 H ALA 85 -9.259 1.851 -15.459 489 HA ALA 85 HA ALA 85 -7.489 2.775 -13.334 490 1HB ALA 85 1HB ALA 85 -10.013 3.985 -14.521 491 2HB ALA 85 2HB ALA 85 -8.358 4.479 -14.881 492 3HB ALA 85 3HB ALA 85 -9.026 4.742 -13.271 493 H LYS 86 H LYS 86 -7.862 1.961 -11.415 494 HA LYS 86 HA LYS 86 -10.561 1.210 -10.753 495 1HB LYS 86 2HB LYS 86 -9.740 -1.044 -10.038 496 2HB LYS 86 1HB LYS 86 -9.730 -0.766 -11.781 497 1HG LYS 86 2HG LYS 86 -7.244 -0.147 -11.272 498 2HG LYS 86 1HG LYS 86 -7.565 -1.131 -9.842 499 1HD LYS 86 2HD LYS 86 -7.816 -1.952 -12.723 500 2HD LYS 86 1HD LYS 86 -6.661 -2.583 -11.560 501 1HE LYS 86 2HE LYS 86 -8.594 -3.519 -10.290 502 2HE LYS 86 1HE LYS 86 -9.610 -2.924 -11.638 503 1HZ LYS 86 1HZ LYS 86 -9.026 -5.316 -11.829 504 2HZ LYS 86 2HZ LYS 86 -7.424 -4.887 -12.029 505 3HZ LYS 86 3HZ LYS 86 -8.581 -4.407 -13.147 506 H VAL 87 H VAL 87 -10.840 0.669 -8.494 507 HA VAL 87 HA VAL 87 -9.080 2.409 -6.903 508 HB VAL 87 HB VAL 87 -12.038 1.887 -6.501 509 1HG1 VAL 87 1HG1 VAL 87 -10.230 3.903 -5.176 510 2HG1 VAL 87 2HG1 VAL 87 -10.915 2.463 -4.425 511 3HG1 VAL 87 3HG1 VAL 87 -11.973 3.776 -4.940 512 1HG2 VAL 87 1HG2 VAL 87 -10.692 4.306 -7.696 513 2HG2 VAL 87 2HG2 VAL 87 -12.405 4.177 -7.309 514 3HG2 VAL 87 3HG2 VAL 87 -11.704 3.139 -8.549 515 H ALA 88 H ALA 88 -8.573 1.737 -4.833 516 HA ALA 88 HA ALA 88 -9.287 -1.021 -4.144 517 1HB ALA 88 1HB ALA 88 -6.872 -0.722 -4.312 518 2HB ALA 88 2HB ALA 88 -7.326 -0.900 -2.616 519 3HB ALA 88 3HB ALA 88 -6.971 0.698 -3.271 520 H LYS 89 H LYS 89 -10.457 -1.328 -2.285 521 HA LYS 89 HA LYS 89 -11.014 1.024 -0.731 522 1HB LYS 89 2HB LYS 89 -12.358 -1.682 -0.944 523 2HB LYS 89 1HB LYS 89 -12.926 -0.350 0.047 524 1HG LYS 89 2HG LYS 89 -13.408 0.974 -1.915 525 2HG LYS 89 1HG LYS 89 -12.714 -0.263 -2.962 526 1HD LYS 89 2HD LYS 89 -14.409 -1.830 -2.285 527 2HD LYS 89 1HD LYS 89 -15.115 -0.650 -1.165 528 1HE LYS 89 2HE LYS 89 -15.630 0.778 -3.107 529 2HE LYS 89 1HE LYS 89 -14.930 -0.445 -4.167 530 1HZ LYS 89 1HZ LYS 89 -17.298 -0.853 -2.408 531 2HZ LYS 89 2HZ LYS 89 -16.614 -2.024 -3.385 532 3HZ LYS 89 3HZ LYS 89 -17.349 -0.676 -4.069 533 H GLU 90 H GLU 90 -9.934 1.130 1.148 534 HA GLU 90 HA GLU 90 -8.790 -1.295 2.263 535 1HB GLU 90 2HB GLU 90 -6.578 -0.183 2.276 536 2HB GLU 90 1HB GLU 90 -7.167 -0.562 0.660 537 1HG GLU 90 2HG GLU 90 -7.965 1.756 0.438 538 2HG GLU 90 1HG GLU 90 -7.280 2.127 2.002 539 H ARG 91 H ARG 91 -8.091 -1.021 4.348 540 HA ARG 91 HA ARG 91 -8.889 1.466 5.710 541 1HB ARG 91 2HB ARG 91 -10.360 -0.465 6.274 542 2HB ARG 91 1HB ARG 91 -8.939 -1.363 6.789 543 1HG ARG 91 2HG ARG 91 -8.530 0.397 8.508 544 2HG ARG 91 1HG ARG 91 -10.066 1.131 8.047 545 1HD ARG 91 2HD ARG 91 -11.197 -0.993 8.588 546 2HD ARG 91 1HD ARG 91 -9.652 -1.645 9.139 547 HE ARG 91 HE ARG 91 -10.820 0.761 10.343 548 1HH1 ARG 91 1HH1 ARG 91 -9.587 -2.543 10.751 549 2HH1 ARG 91 2HH1 ARG 91 -9.595 -2.490 12.437 550 1HH2 ARG 91 1HH2 ARG 91 -10.878 0.812 12.696 551 2HH2 ARG 91 2HH2 ARG 91 -10.329 -0.553 13.563 552 H ILE 92 H ILE 92 -7.296 2.343 6.948 553 HA ILE 92 HA ILE 92 -4.658 1.173 6.961 554 HB ILE 92 HB ILE 92 -5.817 3.401 8.679 555 1HG1 ILE 92 2HG1 ILE 92 -5.979 4.032 6.320 556 2HG1 ILE 92 1HG1 ILE 92 -4.749 4.997 7.120 557 1HG2 ILE 92 1HG2 ILE 92 -3.493 4.108 9.047 558 2HG2 ILE 92 2HG2 ILE 92 -2.932 2.694 8.154 559 3HG2 ILE 92 3HG2 ILE 92 -3.813 2.494 9.670 560 1HD1 ILE 92 1HD1 ILE 92 -3.014 3.582 6.122 561 2HD1 ILE 92 2HD1 ILE 92 -4.053 4.334 4.908 562 3HD1 ILE 92 3HD1 ILE 92 -4.271 2.632 5.318 563 H GLU 93 H GLU 93 -4.137 -0.430 8.299 564 HA GLU 93 HA GLU 93 -6.020 -1.033 10.445 565 1HB GLU 93 2HB GLU 93 -4.729 -2.614 8.599 566 2HB GLU 93 1HB GLU 93 -3.779 -2.870 10.054 567 1HG GLU 93 2HG GLU 93 -6.741 -3.316 9.749 568 2HG GLU 93 1HG GLU 93 -5.495 -4.554 9.830 569 H ALA 94 H ALA 94 -2.672 -0.220 9.887 570 HA ALA 94 HA ALA 94 -2.343 0.761 12.549 571 1HB ALA 94 1HB ALA 94 -0.389 -0.652 13.063 572 2HB ALA 94 2HB ALA 94 -0.696 -1.600 11.606 573 3HB ALA 94 3HB ALA 94 -1.860 -1.617 12.930 574 H VAL 95 H VAL 95 -0.716 2.329 12.534 575 HA VAL 95 HA VAL 95 1.118 2.315 10.341 576 HB VAL 95 HB VAL 95 -0.711 3.589 9.339 577 1HG1 VAL 95 1HG1 VAL 95 -0.516 5.427 11.713 578 2HG1 VAL 95 2HG1 VAL 95 -1.871 4.377 11.300 579 3HG1 VAL 95 3HG1 VAL 95 -1.467 5.743 10.261 580 1HG2 VAL 95 1HG2 VAL 95 1.544 4.286 8.759 581 2HG2 VAL 95 2HG2 VAL 95 1.584 5.376 10.143 582 3HG2 VAL 95 3HG2 VAL 95 0.482 5.693 8.808 583 H GLU 96 H GLU 96 2.999 2.770 11.011 584 HA GLU 96 HA GLU 96 3.331 4.297 13.499 585 1HB GLU 96 2HB GLU 96 5.318 2.514 12.068 586 2HB GLU 96 1HB GLU 96 5.636 3.415 13.518 587 1HG GLU 96 2HG GLU 96 3.683 1.156 13.255 588 2HG GLU 96 1HG GLU 96 5.277 1.112 14.022 589 HA PRO 97 HA PRO 97 4.512 7.410 10.443 590 1HB PRO 97 2HB PRO 97 4.819 8.991 12.936 591 2HB PRO 97 1HB PRO 97 3.897 9.375 11.477 592 1HG PRO 97 2HG PRO 97 2.643 8.668 13.701 593 2HG PRO 97 1HG PRO 97 2.082 8.087 12.122 594 1HD PRO 97 2HD PRO 97 3.686 6.651 14.201 595 2HD PRO 97 1HD PRO 97 2.329 6.065 13.213 596 H ASP 98 H ASP 98 6.091 6.959 13.598 597 HA ASP 98 HA ASP 98 8.543 8.035 12.572 598 1HB ASP 98 2HB ASP 98 7.941 8.493 14.893 599 2HB ASP 98 1HB ASP 98 8.026 6.771 15.263 600 H LYS 99 H LYS 99 7.299 4.826 13.233 601 HA LYS 99 HA LYS 99 9.930 3.691 12.850 602 1HB LYS 99 2HB LYS 99 7.313 2.295 13.254 603 2HB LYS 99 1HB LYS 99 8.881 1.518 13.154 604 1HG LYS 99 2HG LYS 99 9.607 2.979 15.074 605 2HG LYS 99 1HG LYS 99 7.913 3.431 15.215 606 1HD LYS 99 2HD LYS 99 7.265 1.163 15.573 607 2HD LYS 99 1HD LYS 99 8.936 0.651 15.271 608 1HE LYS 99 2HE LYS 99 8.137 2.530 17.431 609 2HE LYS 99 1HE LYS 99 8.316 0.781 17.721 610 1HZ LYS 99 1HZ LYS 99 10.272 1.973 18.377 611 2HZ LYS 99 2HZ LYS 99 10.399 2.736 16.880 612 3HZ LYS 99 3HZ LYS 99 10.661 1.078 16.995 613 H ASN 100 H ASN 100 7.550 4.752 10.896 614 HA ASN 100 HA ASN 100 6.875 4.506 8.787 615 1HB ASN 100 2HB ASN 100 9.265 4.890 8.243 616 2HB ASN 100 1HB ASN 100 9.565 3.160 8.363 617 1HD2 ASN 100 1HD2 ASN 100 8.229 5.696 6.453 618 2HD2 ASN 100 2HD2 ASN 100 7.956 4.741 5.033 619 H LEU 101 H LEU 101 5.285 3.102 9.666 620 HA LEU 101 HA LEU 101 5.463 0.448 8.420 621 1HB LEU 101 2HB LEU 101 5.927 0.175 10.825 622 2HB LEU 101 1HB LEU 101 4.444 1.034 11.188 623 HG LEU 101 HG LEU 101 3.171 -0.763 10.073 624 1HD1 LEU 101 1HD1 LEU 101 5.826 -2.141 10.002 625 2HD1 LEU 101 2HD1 LEU 101 4.846 -1.593 8.629 626 3HD1 LEU 101 3HD1 LEU 101 4.251 -2.883 9.675 627 1HD2 LEU 101 1HD2 LEU 101 3.415 -2.378 11.885 628 2HD2 LEU 101 2HD2 LEU 101 3.373 -0.717 12.454 629 3HD2 LEU 101 3HD2 LEU 101 4.916 -1.584 12.387 630 H ILE 102 H ILE 102 3.615 -0.014 7.310 631 HA ILE 102 HA ILE 102 1.184 1.200 8.240 632 HB ILE 102 HB ILE 102 1.911 2.834 6.650 633 1HG1 ILE 102 2HG1 ILE 102 -0.257 1.133 5.384 634 2HG1 ILE 102 1HG1 ILE 102 -0.506 2.294 6.681 635 1HG2 ILE 102 1HG2 ILE 102 2.320 2.247 4.241 636 2HG2 ILE 102 2HG2 ILE 102 2.223 0.551 4.730 637 3HG2 ILE 102 3HG2 ILE 102 3.492 1.563 5.377 638 1HD1 ILE 102 1HD1 ILE 102 0.428 2.924 3.887 639 2HD1 ILE 102 2HD1 ILE 102 0.182 4.102 5.175 640 3HD1 ILE 102 3HD1 ILE 102 -1.188 3.199 4.531 641 H THR 103 H THR 103 -0.281 -0.191 8.360 642 HA THR 103 HA THR 103 -0.082 -2.727 6.905 643 HB THR 103 HB THR 103 -1.844 -1.984 9.244 644 HG1 THR 103 1HG THR 103 0.733 -2.191 9.166 645 1HG2 THR 103 1HG2 THR 103 -1.996 -4.409 9.548 646 2HG2 THR 103 2HG2 THR 103 -0.974 -4.660 8.131 647 3HG2 THR 103 3HG2 THR 103 -2.573 -3.940 7.948 648 H PHE 104 H PHE 104 -1.440 -3.104 5.212 649 HA PHE 104 HA PHE 104 -3.788 -1.389 4.801 650 1HB PHE 104 2HB PHE 104 -2.261 -3.216 2.944 651 2HB PHE 104 1HB PHE 104 -3.643 -2.330 2.400 652 HD1 PHE 104 1HD PHE 104 -3.458 0.248 2.502 653 HD2 PHE 104 2HD PHE 104 -0.147 -2.394 2.834 654 HE1 PHE 104 1HE PHE 104 -1.946 2.059 1.815 655 HE2 PHE 104 2HE PHE 104 1.364 -0.592 2.154 656 HZ PHE 104 HZ PHE 104 0.485 1.627 1.643 657 H ARG 105 H ARG 105 -5.716 -2.284 5.144 658 HA ARG 105 HA ARG 105 -5.981 -5.235 5.079 659 1HB ARG 105 2HB ARG 105 -6.315 -3.972 7.315 660 2HB ARG 105 1HB ARG 105 -7.715 -3.232 6.581 661 1HG ARG 105 2HG ARG 105 -7.381 -6.204 7.094 662 2HG ARG 105 1HG ARG 105 -8.227 -5.097 8.151 663 1HD ARG 105 2HD ARG 105 -9.843 -4.668 6.278 664 2HD ARG 105 1HD ARG 105 -9.006 -5.892 5.332 665 HE ARG 105 HE ARG 105 -9.781 -6.869 7.906 666 1HH1 ARG 105 1HH1 ARG 105 -11.025 -6.461 4.605 667 2HH1 ARG 105 2HH1 ARG 105 -12.294 -7.568 4.817 668 1HH2 ARG 105 1HH2 ARG 105 -11.468 -8.372 8.136 669 2HH2 ARG 105 2HH2 ARG 105 -12.568 -8.702 6.881 670 H VAL 106 H VAL 106 -7.105 -5.807 3.223 671 HA VAL 106 HA VAL 106 -8.419 -3.735 1.735 672 HB VAL 106 HB VAL 106 -7.255 -5.844 0.627 673 1HG1 VAL 106 1HG1 VAL 106 -8.471 -7.813 0.380 674 2HG1 VAL 106 2HG1 VAL 106 -9.713 -7.204 1.475 675 3HG1 VAL 106 3HG1 VAL 106 -8.091 -7.469 2.087 676 1HG2 VAL 106 1HG2 VAL 106 -8.680 -4.315 -0.676 677 2HG2 VAL 106 2HG2 VAL 106 -10.102 -5.227 -0.177 678 3HG2 VAL 106 3HG2 VAL 106 -8.874 -5.988 -1.188 679 H ILE 107 H ILE 107 -10.545 -3.252 1.782 680 HA ILE 107 HA ILE 107 -12.077 -4.770 3.765 681 HB ILE 107 HB ILE 107 -13.646 -2.830 3.793 682 1HG1 ILE 107 2HG1 ILE 107 -11.521 -1.643 2.020 683 2HG1 ILE 107 1HG1 ILE 107 -13.188 -1.982 1.581 684 1HG2 ILE 107 1HG2 ILE 107 -12.134 -1.368 5.068 685 2HG2 ILE 107 2HG2 ILE 107 -10.748 -2.224 4.401 686 3HG2 ILE 107 3HG2 ILE 107 -11.874 -3.067 5.469 687 1HD1 ILE 107 1HD1 ILE 107 -13.931 -0.305 3.113 688 2HD1 ILE 107 2HD1 ILE 107 -12.718 0.305 1.935 689 3HD1 ILE 107 3HD1 ILE 107 -12.240 -0.056 3.613 690 H GLU 108 H GLU 108 -12.308 -3.583 0.476 691 HA GLU 108 HA GLU 108 -14.154 -5.684 -0.208 692 1HB GLU 108 2HB GLU 108 -15.395 -3.578 0.741 693 2HB GLU 108 1HB GLU 108 -14.903 -2.785 -0.727 694 1HG GLU 108 2HG GLU 108 -16.717 -5.190 -0.483 695 2HG GLU 108 1HG GLU 108 -17.204 -3.548 -0.858 696 H GLY 109 H GLY 109 -14.138 -5.795 -2.637 697 1HA GLY 109 2HA GLY 109 -13.135 -4.431 -4.565 698 2HA GLY 109 1HA GLY 109 -11.649 -4.626 -3.643 699 H ASP 110 H ASP 110 -11.240 -5.553 -5.912 700 HA ASP 110 HA ASP 110 -12.196 -7.982 -6.845 701 1HB ASP 110 2HB ASP 110 -9.360 -6.944 -7.040 702 2HB ASP 110 1HB ASP 110 -10.073 -8.187 -8.058 703 H LEU 111 H LEU 111 -9.518 -7.339 -4.695 704 HA LEU 111 HA LEU 111 -8.513 -9.937 -4.408 705 1HB LEU 111 2HB LEU 111 -8.402 -7.664 -2.436 706 2HB LEU 111 1HB LEU 111 -7.404 -9.102 -2.385 707 HG LEU 111 HG LEU 111 -7.359 -7.021 -4.574 708 1HD1 LEU 111 1HD1 LEU 111 -5.164 -6.438 -3.686 709 2HD1 LEU 111 2HD1 LEU 111 -5.392 -7.587 -2.369 710 3HD1 LEU 111 3HD1 LEU 111 -6.440 -6.174 -2.497 711 1HD2 LEU 111 1HD2 LEU 111 -6.787 -9.240 -5.425 712 2HD2 LEU 111 2HD2 LEU 111 -5.617 -9.450 -4.125 713 3HD2 LEU 111 3HD2 LEU 111 -5.356 -8.214 -5.356 714 H MET 112 H MET 112 -11.310 -8.509 -2.996 715 HA MET 112 HA MET 112 -11.409 -10.383 -0.837 716 1HB MET 112 2HB MET 112 -13.342 -8.274 -1.745 717 2HB MET 112 1HB MET 112 -13.706 -9.370 -0.424 718 1HG MET 112 2HG MET 112 -11.248 -7.648 -0.379 719 2HG MET 112 1HG MET 112 -12.799 -6.990 0.090 720 1HE MET 112 1HE MET 112 -11.180 -10.672 0.957 721 2HE MET 112 2HE MET 112 -10.507 -10.249 2.512 722 3HE MET 112 3HE MET 112 -9.869 -9.490 1.059 723 H LYS 113 H LYS 113 -12.138 -10.600 -4.055 724 HA LYS 113 HA LYS 113 -14.227 -12.613 -3.663 725 1HB LYS 113 2HB LYS 113 -12.983 -11.451 -6.163 726 2HB LYS 113 1HB LYS 113 -14.235 -12.685 -6.159 727 1HG LYS 113 2HG LYS 113 -14.523 -9.931 -4.997 728 2HG LYS 113 1HG LYS 113 -15.117 -10.426 -6.581 729 1HD LYS 113 2HD LYS 113 -16.544 -12.101 -5.525 730 2HD LYS 113 1HD LYS 113 -15.945 -11.627 -3.939 731 1HE LYS 113 2HE LYS 113 -16.832 -9.382 -4.289 732 2HE LYS 113 1HE LYS 113 -17.438 -9.877 -5.869 733 1HZ LYS 113 1HZ LYS 113 -19.171 -9.941 -4.183 734 2HZ LYS 113 2HZ LYS 113 -18.263 -11.016 -3.256 735 3HZ LYS 113 3HZ LYS 113 -18.866 -11.499 -4.758 736 H GLU 114 H GLU 114 -10.977 -12.259 -3.821 737 HA GLU 114 HA GLU 114 -10.392 -14.917 -4.916 738 1HB GLU 114 2HB GLU 114 -8.424 -12.911 -3.831 739 2HB GLU 114 1HB GLU 114 -8.145 -14.184 -5.001 740 1HG GLU 114 2HG GLU 114 -9.801 -11.740 -5.485 741 2HG GLU 114 1HG GLU 114 -8.100 -11.891 -5.940 742 H TYR 115 H TYR 115 -9.953 -12.837 -2.091 743 HA TYR 115 HA TYR 115 -9.506 -15.170 -0.349 744 1HB TYR 115 2HB TYR 115 -8.335 -12.398 0.025 745 2HB TYR 115 1HB TYR 115 -7.930 -13.862 0.911 746 HD1 TYR 115 1HD TYR 115 -7.355 -11.894 -2.036 747 HD2 TYR 115 2HD TYR 115 -6.535 -15.671 -0.229 748 HE1 TYR 115 1HE TYR 115 -5.556 -12.318 -3.677 749 HE2 TYR 115 2HE TYR 115 -4.801 -16.073 -1.842 750 HH TYR 115 HH TYR 115 -3.580 -13.703 -3.918 751 H LYS 116 H LYS 116 -10.341 -14.806 1.777 752 HA LYS 116 HA LYS 116 -12.588 -12.914 1.782 753 1HB LYS 116 2HB LYS 116 -13.404 -14.286 3.726 754 2HB LYS 116 1HB LYS 116 -13.377 -15.115 2.183 755 1HG LYS 116 2HG LYS 116 -11.169 -16.078 2.865 756 2HG LYS 116 1HG LYS 116 -11.442 -15.396 4.465 757 1HD LYS 116 2HD LYS 116 -13.243 -17.319 3.032 758 2HD LYS 116 1HD LYS 116 -12.098 -17.788 4.292 759 1HE LYS 116 2HE LYS 116 -13.338 -16.268 5.844 760 2HE LYS 116 1HE LYS 116 -14.510 -15.995 4.560 761 1HZ LYS 116 1HZ LYS 116 -15.269 -17.724 6.066 762 2HZ LYS 116 2HZ LYS 116 -13.868 -18.596 5.808 763 3HZ LYS 116 3HZ LYS 116 -14.961 -18.397 4.543 764 H SER 117 H SER 117 -9.571 -12.924 2.663 765 HA SER 117 HA SER 117 -9.790 -10.667 4.333 766 1HB SER 117 2HB SER 117 -10.246 -12.367 5.980 767 2HB SER 117 1HB SER 117 -8.784 -13.257 5.533 768 HG SER 117 HG SER 117 -8.046 -12.134 7.148 769 H PHE 118 H PHE 118 -8.098 -9.485 3.654 770 HA PHE 118 HA PHE 118 -5.608 -10.835 2.977 771 1HB PHE 118 2HB PHE 118 -6.871 -10.438 0.806 772 2HB PHE 118 1HB PHE 118 -6.955 -8.759 1.235 773 HD1 PHE 118 1HD PHE 118 -4.536 -11.453 0.467 774 HD2 PHE 118 2HD PHE 118 -5.331 -7.279 0.553 775 HE1 PHE 118 1HE PHE 118 -2.464 -11.031 -0.767 776 HE2 PHE 118 2HE PHE 118 -3.257 -6.859 -0.685 777 HZ PHE 118 HZ PHE 118 -1.824 -8.725 -1.347 778 H LEU 119 H LEU 119 -4.235 -9.999 4.318 779 HA LEU 119 HA LEU 119 -4.395 -7.142 4.980 780 1HB LEU 119 2HB LEU 119 -4.991 -8.704 6.822 781 2HB LEU 119 1HB LEU 119 -3.432 -9.471 6.643 782 HG LEU 119 HG LEU 119 -2.378 -7.280 7.247 783 1HD1 LEU 119 1HD1 LEU 119 -3.783 -5.641 8.401 784 2HD1 LEU 119 2HD1 LEU 119 -5.217 -6.557 7.939 785 3HD1 LEU 119 3HD1 LEU 119 -4.210 -5.808 6.701 786 1HD2 LEU 119 1HD2 LEU 119 -2.828 -7.521 9.638 787 2HD2 LEU 119 2HD2 LEU 119 -2.599 -9.086 8.860 788 3HD2 LEU 119 3HD2 LEU 119 -4.222 -8.537 9.272 789 H LEU 120 H LEU 120 -2.538 -6.082 4.418 790 HA LEU 120 HA LEU 120 -0.110 -7.661 4.269 791 1HB LEU 120 2HB LEU 120 0.637 -6.637 2.196 792 2HB LEU 120 1HB LEU 120 -0.847 -7.521 1.946 793 HG LEU 120 HG LEU 120 -0.667 -4.506 2.166 794 1HD1 LEU 120 1HD1 LEU 120 -0.916 -4.480 -0.238 795 2HD1 LEU 120 2HD1 LEU 120 -0.901 -6.246 -0.280 796 3HD1 LEU 120 3HD1 LEU 120 0.535 -5.360 0.229 797 1HD2 LEU 120 1HD2 LEU 120 -2.873 -5.373 2.733 798 2HD2 LEU 120 2HD2 LEU 120 -2.904 -6.325 1.253 799 3HD2 LEU 120 3HD2 LEU 120 -2.919 -4.561 1.172 800 H THR 121 H THR 121 1.541 -6.768 5.176 801 HA THR 121 HA THR 121 1.232 -3.952 5.959 802 HB THR 121 HB THR 121 2.838 -6.075 7.379 803 HG1 THR 121 1HG THR 121 0.303 -5.964 7.210 804 1HG2 THR 121 1HG2 THR 121 3.550 -3.779 7.753 805 2HG2 THR 121 2HG2 THR 121 2.782 -4.420 9.207 806 3HG2 THR 121 3HG2 THR 121 1.908 -3.307 8.135 807 H ILE 122 H ILE 122 2.797 -2.575 5.271 808 HA ILE 122 HA ILE 122 5.263 -3.807 4.332 809 HB ILE 122 HB ILE 122 5.576 -1.964 2.765 810 1HG1 ILE 122 2HG1 ILE 122 2.803 -1.072 3.511 811 2HG1 ILE 122 1HG1 ILE 122 4.285 -0.252 3.986 812 1HG2 ILE 122 1HG2 ILE 122 4.482 -3.951 1.936 813 2HG2 ILE 122 2HG2 ILE 122 3.799 -2.520 1.162 814 3HG2 ILE 122 3HG2 ILE 122 2.912 -3.317 2.455 815 1HD1 ILE 122 1HD1 ILE 122 3.312 -0.627 1.150 816 2HD1 ILE 122 2HD1 ILE 122 4.796 0.196 1.631 817 3HD1 ILE 122 3HD1 ILE 122 3.230 0.864 2.088 818 H GLN 123 H GLN 123 7.107 -2.954 4.960 819 HA GLN 123 HA GLN 123 7.098 -0.471 6.437 820 1HB GLN 123 2HB GLN 123 6.857 -2.270 8.130 821 2HB GLN 123 1HB GLN 123 8.295 -3.041 7.491 822 1HG GLN 123 2HG GLN 123 9.693 -1.281 8.262 823 2HG GLN 123 1HG GLN 123 8.305 -0.264 8.640 824 1HE2 GLN 123 1HE2 GLN 123 8.881 -0.004 10.762 825 2HE2 GLN 123 2HE2 GLN 123 8.789 -1.292 11.913 826 H VAL 124 H VAL 124 8.752 0.746 5.830 827 HA VAL 124 HA VAL 124 10.602 -0.490 3.983 828 HB VAL 124 HB VAL 124 10.120 2.453 4.559 829 1HG1 VAL 124 1HG1 VAL 124 11.360 2.862 2.527 830 2HG1 VAL 124 2HG1 VAL 124 11.603 1.127 2.294 831 3HG1 VAL 124 3HG1 VAL 124 12.337 1.949 3.672 832 1HG2 VAL 124 1HG2 VAL 124 8.133 1.423 3.587 833 2HG2 VAL 124 2HG2 VAL 124 9.104 0.748 2.282 834 3HG2 VAL 124 3HG2 VAL 124 8.909 2.495 2.419 835 H THR 125 H THR 125 12.454 -1.014 4.642 836 HA THR 125 HA THR 125 13.560 0.161 7.085 837 HB THR 125 HB THR 125 13.828 -2.654 6.006 838 HG1 THR 125 1HG THR 125 12.258 -1.552 8.095 839 1HG2 THR 125 1HG2 THR 125 14.762 -3.181 8.180 840 2HG2 THR 125 2HG2 THR 125 14.654 -1.483 8.672 841 3HG2 THR 125 3HG2 THR 125 15.752 -1.968 7.369 842 HA PRO 126 HA PRO 126 16.759 1.479 4.168 843 1HB PRO 126 2HB PRO 126 18.794 1.644 6.088 844 2HB PRO 126 1HB PRO 126 17.698 2.951 5.634 845 1HG PRO 126 2HG PRO 126 17.553 1.077 7.948 846 2HG PRO 126 1HG PRO 126 17.114 2.791 7.862 847 1HD PRO 126 2HD PRO 126 15.266 0.875 7.884 848 2HD PRO 126 1HD PRO 126 15.049 2.338 6.898 849 H LYS 127 H LYS 127 18.345 0.452 3.029 850 HA LYS 127 HA LYS 127 18.787 -2.338 3.726 851 1HB LYS 127 2HB LYS 127 19.720 -2.540 1.443 852 2HB LYS 127 1HB LYS 127 18.131 -1.815 1.410 853 1HG LYS 127 2HG LYS 127 19.185 0.401 1.167 854 2HG LYS 127 1HG LYS 127 20.760 -0.392 1.100 855 1HD LYS 127 2HD LYS 127 18.480 -0.941 -0.807 856 2HD LYS 127 1HD LYS 127 19.820 0.153 -1.147 857 1HE LYS 127 2HE LYS 127 21.388 -1.702 -0.948 858 2HE LYS 127 1HE LYS 127 20.062 -2.801 -0.564 859 1HZ LYS 127 1HZ LYS 127 20.840 -2.866 -2.859 860 2HZ LYS 127 2HZ LYS 127 20.250 -1.307 -3.138 861 3HZ LYS 127 3HZ LYS 127 19.206 -2.586 -2.735 862 HA PRO 128 HA PRO 128 22.991 -2.049 5.164 863 1HB PRO 128 2HB PRO 128 23.912 -3.525 2.726 864 2HB PRO 128 1HB PRO 128 24.269 -3.855 4.421 865 1HG PRO 128 2HG PRO 128 22.519 -5.366 3.134 866 2HG PRO 128 1HG PRO 128 22.202 -4.859 4.802 867 1HD PRO 128 2HD PRO 128 21.044 -3.831 2.255 868 2HD PRO 128 1HD PRO 128 20.246 -4.072 3.819 869 H GLY 129 H GLY 129 23.796 -0.078 5.016 870 1HA GLY 129 2HA GLY 129 25.550 1.114 3.596 871 2HA GLY 129 1HA GLY 129 24.278 1.085 2.373 872 H GLY 130 H GLY 130 22.021 1.756 3.549 873 1HA GLY 130 2HA GLY 130 21.324 3.325 5.398 874 2HA GLY 130 1HA GLY 130 22.651 4.329 4.849 875 HA PRO 131 HA PRO 131 20.312 6.672 1.937 876 1HB PRO 131 2HB PRO 131 21.539 5.282 -0.391 877 2HB PRO 131 1HB PRO 131 21.426 7.012 -0.062 878 1HG PRO 131 2HG PRO 131 23.705 5.762 0.283 879 2HG PRO 131 1HG PRO 131 23.167 6.960 1.479 880 1HD PRO 131 2HD PRO 131 23.135 3.977 1.622 881 2HD PRO 131 1HD PRO 131 23.514 5.160 2.889 882 H GLY 132 H GLY 132 20.577 3.464 0.402 883 1HA GLY 132 2HA GLY 132 17.922 3.710 -0.694 884 2HA GLY 132 1HA GLY 132 19.019 2.346 -0.886 885 H SER 133 H SER 133 16.328 1.877 -0.362 886 HA SER 133 HA SER 133 16.589 0.665 2.247 887 1HB SER 133 2HB SER 133 14.275 2.450 1.484 888 2HB SER 133 1HB SER 133 14.377 1.471 2.951 889 HG SER 133 HG SER 133 16.571 3.045 2.504 890 H ILE 134 H ILE 134 14.904 -0.946 2.679 891 HA ILE 134 HA ILE 134 14.082 -2.275 0.203 892 HB ILE 134 HB ILE 134 14.448 -3.451 2.973 893 1HG1 ILE 134 2HG1 ILE 134 16.550 -2.730 2.092 894 2HG1 ILE 134 1HG1 ILE 134 16.421 -4.499 2.171 895 1HG2 ILE 134 1HG2 ILE 134 14.341 -5.631 1.852 896 2HG2 ILE 134 2HG2 ILE 134 14.026 -4.817 0.320 897 3HG2 ILE 134 3HG2 ILE 134 12.858 -4.699 1.634 898 1HD1 ILE 134 1HD1 ILE 134 16.158 -2.822 -0.324 899 2HD1 ILE 134 2HD1 ILE 134 16.038 -4.581 -0.196 900 3HD1 ILE 134 3HD1 ILE 134 17.574 -3.776 0.147 901 H VAL 135 H VAL 135 11.961 -2.783 0.182 902 HA VAL 135 HA VAL 135 10.365 -2.021 2.519 903 HB VAL 135 HB VAL 135 9.632 -0.728 0.562 904 1HG1 VAL 135 1HG1 VAL 135 9.073 -3.338 -0.775 905 2HG1 VAL 135 2HG1 VAL 135 10.324 -2.180 -1.213 906 3HG1 VAL 135 3HG1 VAL 135 8.621 -1.750 -1.399 907 1HG2 VAL 135 1HG2 VAL 135 7.598 -2.819 1.309 908 2HG2 VAL 135 2HG2 VAL 135 7.239 -1.271 0.548 909 3HG2 VAL 135 3HG2 VAL 135 7.913 -1.315 2.176 910 H HIS 136 H HIS 136 9.649 -3.521 3.727 911 HA HIS 136 HA HIS 136 9.757 -6.251 2.718 912 1HB HIS 136 2HB HIS 136 9.533 -5.195 5.549 913 2HB HIS 136 1HB HIS 136 9.519 -6.904 5.134 914 HD1 HIS 136 1HD HIS 136 11.768 -7.993 4.543 915 HD2 HIS 136 2HD HIS 136 12.101 -3.920 5.373 916 HE1 HIS 136 1HE HIS 136 14.227 -7.520 4.727 917 HE2 HIS 136 2HE HIS 136 14.398 -5.079 5.266 918 H TRP 137 H TRP 137 7.997 -7.050 1.872 919 HA TRP 137 HA TRP 137 5.398 -6.016 2.667 920 1HB TRP 137 2HB TRP 137 6.227 -7.839 0.392 921 2HB TRP 137 1HB TRP 137 4.601 -7.317 0.738 922 HD1 TRP 137 HD TRP 137 8.002 -5.618 -0.227 923 HE1 TRP 137 1HE TRP 137 7.421 -3.604 -1.690 924 HE3 TRP 137 3HE TRP 137 2.888 -5.859 -0.019 925 HZ2 TRP 137 2HZ TRP 137 5.189 -2.284 -2.619 926 HZ3 TRP 137 3HZ TRP 137 1.600 -4.158 -1.238 927 HH2 TRP 137 HH TRP 137 2.708 -2.407 -2.505 928 H HIS 138 H HIS 138 4.253 -7.122 4.089 929 HA HIS 138 HA HIS 138 4.681 -10.044 4.272 930 1HB HIS 138 2HB HIS 138 3.647 -8.232 6.484 931 2HB HIS 138 1HB HIS 138 4.059 -9.929 6.620 932 HD1 HIS 138 1HD HIS 138 6.667 -10.518 6.844 933 HD2 HIS 138 2HD HIS 138 5.693 -6.484 6.624 934 HE1 HIS 138 1HE HIS 138 8.701 -9.324 7.580 935 HE2 HIS 138 2HE HIS 138 8.058 -6.920 7.695 936 H LEU 139 H LEU 139 2.971 -10.982 3.287 937 HA LEU 139 HA LEU 139 0.382 -9.607 3.432 938 1HB LEU 139 2HB LEU 139 1.365 -11.565 1.340 939 2HB LEU 139 1HB LEU 139 -0.205 -10.807 1.360 940 HG LEU 139 HG LEU 139 1.028 -8.573 1.015 941 1HD1 LEU 139 1HD1 LEU 139 3.240 -9.206 1.698 942 2HD1 LEU 139 2HD1 LEU 139 3.225 -8.668 0.017 943 3HD1 LEU 139 3HD1 LEU 139 3.325 -10.385 0.388 944 1HD2 LEU 139 1HD2 LEU 139 1.275 -10.663 -1.131 945 2HD2 LEU 139 2HD2 LEU 139 1.264 -8.915 -1.367 946 3HD2 LEU 139 3HD2 LEU 139 -0.176 -9.731 -0.758 947 H GLU 140 H GLU 140 -1.165 -10.651 4.465 948 HA GLU 140 HA GLU 140 -0.988 -13.570 4.826 949 1HB GLU 140 2HB GLU 140 -1.876 -11.560 6.904 950 2HB GLU 140 1HB GLU 140 -2.044 -13.299 7.063 951 1HG GLU 140 2HG GLU 140 0.404 -13.511 6.942 952 2HG GLU 140 1HG GLU 140 0.521 -11.753 6.878 953 H TYR 141 H TYR 141 -2.805 -14.657 4.340 954 HA TYR 141 HA TYR 141 -5.310 -13.220 4.192 955 1HB TYR 141 2HB TYR 141 -5.619 -13.826 1.738 956 2HB TYR 141 1HB TYR 141 -4.515 -12.508 2.132 957 HD1 TYR 141 1HD TYR 141 -2.258 -12.621 1.614 958 HD2 TYR 141 2HD TYR 141 -4.684 -16.046 1.059 959 HE1 TYR 141 1HE TYR 141 -0.418 -13.716 0.436 960 HE2 TYR 141 2HE TYR 141 -2.960 -17.144 -0.113 961 HH TYR 141 HH TYR 141 0.307 -15.989 -0.163 962 H GLU 142 H GLU 142 -7.088 -14.378 4.119 963 HA GLU 142 HA GLU 142 -6.908 -17.304 4.432 964 1HB GLU 142 2HB GLU 142 -8.018 -16.044 6.260 965 2HB GLU 142 1HB GLU 142 -9.124 -15.337 5.098 966 1HG GLU 142 2HG GLU 142 -10.272 -17.093 6.279 967 2HG GLU 142 1HG GLU 142 -9.984 -17.598 4.615 968 H LYS 143 H LYS 143 -7.984 -18.582 2.923 969 HA LYS 143 HA LYS 143 -8.768 -17.107 0.534 970 1HB LYS 143 2HB LYS 143 -8.081 -20.009 0.816 971 2HB LYS 143 1HB LYS 143 -8.459 -19.184 -0.692 972 1HG LYS 143 2HG LYS 143 -6.610 -17.653 -0.267 973 2HG LYS 143 1HG LYS 143 -6.180 -18.615 1.146 974 1HD LYS 143 2HD LYS 143 -5.881 -20.558 -0.322 975 2HD LYS 143 1HD LYS 143 -6.232 -19.516 -1.721 976 1HE LYS 143 2HE LYS 143 -3.885 -19.472 -1.573 977 2HE LYS 143 1HE LYS 143 -4.556 -18.023 -0.833 978 1HZ LYS 143 1HZ LYS 143 -2.796 -18.994 0.564 979 2HZ LYS 143 2HZ LYS 143 -3.683 -20.387 0.691 980 3HZ LYS 143 3HZ LYS 143 -4.290 -18.981 1.383 981 H ILE 144 H ILE 144 -10.751 -17.393 -0.469 982 HA ILE 144 HA ILE 144 -12.909 -18.549 1.053 983 HB ILE 144 HB ILE 144 -12.888 -17.532 -1.815 984 1HG1 ILE 144 2HG1 ILE 144 -13.761 -16.174 0.701 985 2HG1 ILE 144 1HG1 ILE 144 -12.234 -15.825 -0.112 986 1HG2 ILE 144 1HG2 ILE 144 -15.187 -18.050 0.085 987 2HG2 ILE 144 2HG2 ILE 144 -14.785 -19.004 -1.345 988 3HG2 ILE 144 3HG2 ILE 144 -15.328 -17.333 -1.519 989 1HD1 ILE 144 1HD1 ILE 144 -13.868 -14.136 -0.579 990 2HD1 ILE 144 2HD1 ILE 144 -15.025 -15.352 -1.129 991 3HD1 ILE 144 3HD1 ILE 144 -13.548 -15.046 -2.062 992 H SER 145 H SER 145 -11.081 -19.223 -1.831 993 HA SER 145 HA SER 145 -11.527 -22.007 -1.577 994 1HB SER 145 2HB SER 145 -13.442 -21.294 -3.002 995 2HB SER 145 1HB SER 145 -12.336 -20.492 -4.103 996 HG SER 145 HG SER 145 -13.148 -22.981 -4.143 997 H GLU 146 H GLU 146 -10.140 -22.943 -3.481 998 HA GLU 146 HA GLU 146 -7.539 -21.735 -3.078 999 1HB GLU 146 2HB GLU 146 -8.064 -24.154 -2.756 1000 2HB GLU 146 1HB GLU 146 -8.410 -24.135 -4.489 1001 1HG GLU 146 2HG GLU 146 -5.678 -23.412 -3.516 1002 2HG GLU 146 1HG GLU 146 -6.133 -25.104 -3.633 1003 H GLU 147 H GLU 147 -9.415 -22.925 -5.853 1004 HA GLU 147 HA GLU 147 -7.653 -21.894 -7.778 1005 1HB GLU 147 2HB GLU 147 -9.408 -22.338 -9.429 1006 2HB GLU 147 1HB GLU 147 -9.152 -23.702 -8.357 1007 1HG GLU 147 2HG GLU 147 -11.149 -23.112 -7.110 1008 2HG GLU 147 1HG GLU 147 -11.389 -21.701 -8.143 1009 H VAL 148 H VAL 148 -9.932 -20.398 -5.905 1010 HA VAL 148 HA VAL 148 -10.319 -18.177 -7.793 1011 HB VAL 148 HB VAL 148 -11.850 -17.149 -6.324 1012 1HG1 VAL 148 1HG1 VAL 148 -12.807 -18.952 -7.515 1013 2HG1 VAL 148 2HG1 VAL 148 -13.534 -18.871 -5.908 1014 3HG1 VAL 148 3HG1 VAL 148 -12.323 -20.100 -6.267 1015 1HG2 VAL 148 1HG2 VAL 148 -12.327 -17.968 -4.032 1016 2HG2 VAL 148 2HG2 VAL 148 -10.713 -17.291 -4.237 1017 3HG2 VAL 148 3HG2 VAL 148 -10.932 -19.042 -4.157 1018 H ALA 149 H ALA 149 -8.044 -19.032 -5.532 1019 HA ALA 149 HA ALA 149 -7.390 -16.305 -4.782 1020 1HB ALA 149 1HB ALA 149 -7.305 -18.020 -3.054 1021 2HB ALA 149 2HB ALA 149 -5.697 -17.363 -3.368 1022 3HB ALA 149 3HB ALA 149 -6.147 -18.941 -4.016 1023 H HIS 150 H HIS 150 -5.555 -15.283 -5.526 1024 HA HIS 150 HA HIS 150 -4.062 -16.711 -7.616 1025 1HB HIS 150 2HB HIS 150 -5.056 -13.849 -7.808 1026 2HB HIS 150 1HB HIS 150 -4.026 -14.641 -8.980 1027 HD1 HIS 150 1HD HIS 150 -5.564 -14.668 -11.034 1028 HD2 HIS 150 2HD HIS 150 -7.482 -16.034 -7.614 1029 HE1 HIS 150 1HE HIS 150 -7.815 -15.419 -11.771 1030 HE2 HIS 150 2HE HIS 150 -9.025 -15.765 -9.605 1031 HA PRO 151 HA PRO 151 -1.024 -14.821 -4.613 1032 1HB PRO 151 2HB PRO 151 0.558 -17.109 -5.685 1033 2HB PRO 151 1HB PRO 151 0.340 -16.597 -4.009 1034 1HG PRO 151 2HG PRO 151 -0.891 -18.788 -4.885 1035 2HG PRO 151 1HG PRO 151 -1.726 -17.651 -3.812 1036 1HD PRO 151 2HD PRO 151 -2.001 -17.979 -6.783 1037 2HD PRO 151 1HD PRO 151 -3.248 -17.745 -5.530 1038 H GLU 152 H GLU 152 -1.158 -15.740 -7.817 1039 HA GLU 152 HA GLU 152 1.213 -14.976 -9.064 1040 1HB GLU 152 2HB GLU 152 -1.534 -14.555 -10.203 1041 2HB GLU 152 1HB GLU 152 -0.049 -14.934 -11.053 1042 1HG GLU 152 2HG GLU 152 -1.616 -16.769 -9.261 1043 2HG GLU 152 1HG GLU 152 -1.529 -16.819 -11.016 1044 H THR 153 H THR 153 -1.766 -13.167 -8.356 1045 HA THR 153 HA THR 153 -0.876 -10.843 -9.708 1046 HB THR 153 HB THR 153 -3.055 -9.902 -8.960 1047 HG1 THR 153 1HG THR 153 -4.448 -11.448 -7.877 1048 1HG2 THR 153 1HG2 THR 153 -2.892 -11.235 -11.034 1049 2HG2 THR 153 2HG2 THR 153 -4.447 -11.466 -10.235 1050 3HG2 THR 153 3HG2 THR 153 -3.194 -12.700 -10.096 1051 H LEU 154 H LEU 154 -0.986 -11.951 -6.408 1052 HA LEU 154 HA LEU 154 -0.589 -9.623 -4.994 1053 1HB LEU 154 2HB LEU 154 0.230 -12.431 -4.583 1054 2HB LEU 154 1HB LEU 154 0.917 -11.212 -3.538 1055 HG LEU 154 HG LEU 154 -1.242 -10.622 -2.700 1056 1HD1 LEU 154 1HD1 LEU 154 -2.380 -12.577 -4.665 1057 2HD1 LEU 154 2HD1 LEU 154 -2.594 -10.812 -4.633 1058 3HD1 LEU 154 3HD1 LEU 154 -3.241 -11.795 -3.315 1059 1HD2 LEU 154 1HD2 LEU 154 -0.842 -13.577 -2.826 1060 2HD2 LEU 154 2HD2 LEU 154 -1.881 -12.748 -1.673 1061 3HD2 LEU 154 3HD2 LEU 154 -0.140 -12.457 -1.658 1062 H LEU 155 H LEU 155 1.945 -11.678 -6.420 1063 HA LEU 155 HA LEU 155 3.982 -9.942 -5.593 1064 1HB LEU 155 2HB LEU 155 3.992 -11.991 -7.793 1065 2HB LEU 155 1HB LEU 155 5.406 -11.064 -7.338 1066 HG LEU 155 HG LEU 155 3.914 -13.003 -5.574 1067 1HD1 LEU 155 1HD1 LEU 155 6.649 -13.067 -6.789 1068 2HD1 LEU 155 2HD1 LEU 155 5.289 -14.099 -7.254 1069 3HD1 LEU 155 3HD1 LEU 155 6.021 -14.238 -5.635 1070 1HD2 LEU 155 1HD2 LEU 155 6.312 -11.277 -5.017 1071 2HD2 LEU 155 2HD2 LEU 155 5.774 -12.606 -3.993 1072 3HD2 LEU 155 3HD2 LEU 155 4.748 -11.185 -4.218 1073 H GLN 156 H GLN 156 2.074 -9.993 -8.495 1074 HA GLN 156 HA GLN 156 3.638 -7.945 -9.702 1075 1HB GLN 156 2HB GLN 156 0.830 -8.799 -10.374 1076 2HB GLN 156 1HB GLN 156 1.882 -7.808 -11.382 1077 1HG GLN 156 2HG GLN 156 3.513 -9.704 -11.365 1078 2HG GLN 156 1HG GLN 156 2.251 -10.673 -10.614 1079 1HE2 GLN 156 1HE2 GLN 156 3.313 -9.068 -13.394 1080 2HE2 GLN 156 2HE2 GLN 156 2.201 -9.761 -14.523 1081 H PHE 157 H PHE 157 0.853 -7.990 -7.623 1082 HA PHE 157 HA PHE 157 0.127 -5.289 -7.781 1083 1HB PHE 157 2HB PHE 157 -1.296 -7.000 -6.699 1084 2HB PHE 157 1HB PHE 157 -0.075 -7.263 -5.473 1085 HD1 PHE 157 1HD PHE 157 -0.764 -6.503 -3.399 1086 HD2 PHE 157 2HD PHE 157 -1.812 -4.265 -6.861 1087 HE1 PHE 157 1HE PHE 157 -1.934 -4.789 -1.960 1088 HE2 PHE 157 2HE PHE 157 -2.965 -2.604 -5.441 1089 HZ PHE 157 HZ PHE 157 -3.007 -2.880 -3.010 1090 H CYS 158 H CYS 158 2.368 -6.999 -5.573 1091 HA CYS 158 HA CYS 158 3.116 -4.619 -4.305 1092 1HB CYS 158 2HB CYS 158 5.013 -5.887 -3.330 1093 2HB CYS 158 1HB CYS 158 3.472 -6.696 -3.134 1094 HG CYS 158 HG CYS 158 4.851 -7.862 -5.866 1095 H VAL 159 H VAL 159 4.354 -6.140 -7.210 1096 HA VAL 159 HA VAL 159 6.759 -4.681 -7.433 1097 HB VAL 159 HB VAL 159 4.978 -5.740 -9.656 1098 1HG1 VAL 159 1HG1 VAL 159 6.419 -3.950 -10.453 1099 2HG1 VAL 159 2HG1 VAL 159 6.928 -5.512 -11.121 1100 3HG1 VAL 159 3HG1 VAL 159 7.828 -4.765 -9.781 1101 1HG2 VAL 159 1HG2 VAL 159 7.514 -6.856 -8.470 1102 2HG2 VAL 159 2HG2 VAL 159 6.565 -7.558 -9.800 1103 3HG2 VAL 159 3HG2 VAL 159 5.879 -7.456 -8.182 1104 H GLU 160 H GLU 160 3.529 -3.972 -8.770 1105 HA GLU 160 HA GLU 160 4.526 -1.597 -9.927 1106 1HB GLU 160 2HB GLU 160 2.238 -1.227 -10.756 1107 2HB GLU 160 1HB GLU 160 2.851 -2.824 -11.114 1108 1HG GLU 160 2HG GLU 160 0.815 -3.453 -10.444 1109 2HG GLU 160 1HG GLU 160 1.513 -3.310 -8.831 1110 H VAL 161 H VAL 161 2.899 -2.263 -6.937 1111 HA VAL 161 HA VAL 161 2.477 0.473 -6.300 1112 HB VAL 161 HB VAL 161 2.831 -1.885 -4.419 1113 1HG1 VAL 161 1HG1 VAL 161 1.730 -0.450 -2.719 1114 2HG1 VAL 161 2HG1 VAL 161 1.732 0.886 -3.870 1115 3HG1 VAL 161 3HG1 VAL 161 3.257 0.241 -3.267 1116 1HG2 VAL 161 1HG2 VAL 161 0.892 -2.133 -5.883 1117 2HG2 VAL 161 2HG2 VAL 161 0.315 -0.539 -5.399 1118 3HG2 VAL 161 3HG2 VAL 161 0.387 -1.843 -4.217 1119 H SER 162 H SER 162 5.214 -1.771 -5.880 1120 HA SER 162 HA SER 162 6.720 -0.088 -4.209 1121 1HB SER 162 2HB SER 162 7.613 -2.256 -6.084 1122 2HB SER 162 1HB SER 162 8.634 -1.443 -4.886 1123 HG SER 162 HG SER 162 6.424 -3.137 -4.486 1124 H LYS 163 H LYS 163 6.490 -0.363 -7.708 1125 HA LYS 163 HA LYS 163 8.621 1.439 -8.151 1126 1HB LYS 163 2HB LYS 163 6.370 0.656 -9.994 1127 2HB LYS 163 1HB LYS 163 7.789 1.575 -10.478 1128 1HG LYS 163 2HG LYS 163 9.196 -0.343 -9.738 1129 2HG LYS 163 1HG LYS 163 7.716 -1.252 -9.458 1130 1HD LYS 163 2HD LYS 163 8.601 -0.090 -12.094 1131 2HD LYS 163 1HD LYS 163 8.734 -1.776 -11.609 1132 1HE LYS 163 2HE LYS 163 6.291 -1.924 -11.461 1133 2HE LYS 163 1HE LYS 163 6.159 -0.231 -11.937 1134 1HZ LYS 163 1HZ LYS 163 7.185 -0.772 -14.040 1135 2HZ LYS 163 2HZ LYS 163 5.804 -1.712 -13.797 1136 3HZ LYS 163 3HZ LYS 163 7.330 -2.401 -13.589 1137 H GLU 164 H GLU 164 5.131 1.851 -7.834 1138 HA GLU 164 HA GLU 164 4.909 4.545 -8.591 1139 1HB GLU 164 2HB GLU 164 3.012 2.897 -8.041 1140 2HB GLU 164 1HB GLU 164 3.385 3.201 -6.354 1141 1HG GLU 164 2HG GLU 164 2.407 5.311 -8.310 1142 2HG GLU 164 1HG GLU 164 1.380 4.433 -7.195 1143 H ILE 165 H ILE 165 5.447 3.064 -5.416 1144 HA ILE 165 HA ILE 165 5.607 5.545 -4.125 1145 HB ILE 165 HB ILE 165 4.917 3.546 -2.930 1146 1HG1 ILE 165 2HG1 ILE 165 6.164 3.870 -0.839 1147 2HG1 ILE 165 1HG1 ILE 165 7.425 4.712 -1.736 1148 1HG2 ILE 165 1HG2 ILE 165 6.536 1.852 -2.161 1149 2HG2 ILE 165 2HG2 ILE 165 7.776 2.627 -3.150 1150 3HG2 ILE 165 3HG2 ILE 165 6.368 1.899 -3.918 1151 1HD1 ILE 165 1HD1 ILE 165 4.568 5.612 -1.505 1152 2HD1 ILE 165 2HD1 ILE 165 5.887 6.411 -2.359 1153 3HD1 ILE 165 3HD1 ILE 165 5.944 6.268 -0.591 1154 H ASP 166 H ASP 166 7.984 3.430 -5.361 1155 HA ASP 166 HA ASP 166 10.357 4.646 -4.406 1156 1HB ASP 166 2HB ASP 166 10.402 2.474 -5.565 1157 2HB ASP 166 1HB ASP 166 9.909 3.244 -7.061 1158 H GLU 167 H GLU 167 8.685 5.226 -7.497 1159 HA GLU 167 HA GLU 167 10.264 7.581 -8.049 1160 1HB GLU 167 2HB GLU 167 8.785 7.910 -9.999 1161 2HB GLU 167 1HB GLU 167 9.441 6.284 -9.946 1162 1HG GLU 167 2HG GLU 167 7.288 5.511 -8.999 1163 2HG GLU 167 1HG GLU 167 6.655 7.141 -9.219 1164 H HIS 168 H HIS 168 7.334 7.059 -6.439 1165 HA HIS 168 HA HIS 168 6.385 9.747 -6.278 1166 1HB HIS 168 2HB HIS 168 5.246 7.547 -5.617 1167 2HB HIS 168 1HB HIS 168 6.236 7.591 -4.177 1168 HD1 HIS 168 1HD HIS 168 3.008 8.037 -5.084 1169 HD2 HIS 168 2HD HIS 168 5.608 10.428 -2.903 1170 HE1 HIS 168 1HE HIS 168 1.543 9.505 -3.639 1171 HE2 HIS 168 2HE HIS 168 3.133 10.964 -2.364 1172 H LEU 169 H LEU 169 8.599 7.875 -4.204 1173 HA LEU 169 HA LEU 169 9.060 10.060 -2.376 1174 1HB LEU 169 2HB LEU 169 10.525 7.452 -2.715 1175 2HB LEU 169 1HB LEU 169 10.776 8.594 -1.414 1176 HG LEU 169 HG LEU 169 8.236 7.044 -1.922 1177 1HD1 LEU 169 1HD1 LEU 169 10.369 6.716 0.180 1178 2HD1 LEU 169 2HD1 LEU 169 10.051 5.624 -1.169 1179 3HD1 LEU 169 3HD1 LEU 169 8.846 5.828 0.103 1180 1HD2 LEU 169 1HD2 LEU 169 7.550 7.888 0.273 1181 2HD2 LEU 169 2HD2 LEU 169 7.792 9.206 -0.870 1182 3HD2 LEU 169 3HD2 LEU 169 9.011 8.867 0.356 1183 H LEU 170 H LEU 170 10.990 8.532 -4.958 1184 HA LEU 170 HA LEU 170 13.225 10.273 -4.620 1185 1HB LEU 170 2HB LEU 170 12.272 8.891 -7.121 1186 2HB LEU 170 1HB LEU 170 13.863 9.561 -6.859 1187 HG LEU 170 HG LEU 170 12.697 7.205 -5.398 1188 1HD1 LEU 170 1HD1 LEU 170 13.162 6.807 -7.778 1189 2HD1 LEU 170 2HD1 LEU 170 14.239 5.892 -6.729 1190 3HD1 LEU 170 3HD1 LEU 170 14.820 7.350 -7.532 1191 1HD2 LEU 170 1HD2 LEU 170 14.985 6.911 -4.566 1192 2HD2 LEU 170 2HD2 LEU 170 14.290 8.443 -4.033 1193 3HD2 LEU 170 3HD2 LEU 170 15.464 8.411 -5.351 1194 H ALA 171 H ALA 171 10.338 10.226 -6.590 1195 HA ALA 171 HA ALA 171 9.237 11.632 -7.833 1196 1HB ALA 171 1HB ALA 171 10.682 13.742 -6.257 1197 2HB ALA 171 2HB ALA 171 9.197 12.856 -5.831 1198 3HB ALA 171 3HB ALA 171 9.189 13.959 -7.216 1199 H GLU 172 H GLU 172 12.001 10.809 -8.385 1200 HA GLU 172 HA GLU 172 12.851 12.731 -10.365 1201 1HB GLU 172 2HB GLU 172 14.017 10.123 -9.414 1202 2HB GLU 172 1HB GLU 172 14.753 11.156 -10.629 1203 1HG GLU 172 2HG GLU 172 15.018 12.927 -9.073 1204 2HG GLU 172 1HG GLU 172 14.127 12.050 -7.835 1205 H GLU 173 H GLU 173 13.041 12.113 -12.484 1206 HA GLU 173 HA GLU 173 11.297 9.913 -13.256 1207 1HB GLU 173 2HB GLU 173 11.306 12.689 -14.446 1208 2HB GLU 173 1HB GLU 173 10.353 11.334 -15.033 1209 1HG GLU 173 2HG GLU 173 9.117 11.250 -12.966 1210 2HG GLU 173 1HG GLU 173 10.128 12.518 -12.277 Start of MODEL 12 1 H THR 17 H THR 17 -4.135 -30.713 -1.258 2 HA THR 17 HA THR 17 -2.314 -30.129 0.767 3 HB THR 17 HB THR 17 -3.925 -28.143 -0.835 4 HG1 THR 17 1HG THR 17 -1.396 -29.327 -1.453 5 1HG2 THR 17 1HG2 THR 17 -2.633 -27.165 1.018 6 2HG2 THR 17 2HG2 THR 17 -1.944 -26.702 -0.538 7 3HG2 THR 17 3HG2 THR 17 -1.178 -27.962 0.430 8 H GLU 18 H GLU 18 -2.897 -30.189 2.759 9 HA GLU 18 HA GLU 18 -5.529 -29.471 3.665 10 1HB GLU 18 2HB GLU 18 -3.108 -30.220 5.237 11 2HB GLU 18 1HB GLU 18 -4.732 -30.019 5.876 12 1HG GLU 18 2HG GLU 18 -5.517 -31.890 4.469 13 2HG GLU 18 1HG GLU 18 -3.880 -32.081 3.847 14 H ALA 19 H ALA 19 -6.180 -27.614 4.306 15 HA ALA 19 HA ALA 19 -4.471 -25.939 5.865 16 1HB ALA 19 1HB ALA 19 -5.802 -24.961 3.349 17 2HB ALA 19 2HB ALA 19 -4.072 -25.175 3.615 18 3HB ALA 19 3HB ALA 19 -4.955 -23.935 4.528 19 H SER 20 H SER 20 -5.738 -26.173 7.594 20 HA SER 20 HA SER 20 -8.494 -26.584 7.527 21 1HB SER 20 2HB SER 20 -6.749 -25.689 9.818 22 2HB SER 20 1HB SER 20 -8.373 -26.366 9.967 23 HG SER 20 HG SER 20 -7.509 -28.197 8.767 24 H SER 21 H SER 21 -6.675 -23.617 8.335 25 HA SER 21 HA SER 21 -9.186 -22.193 8.478 26 1HB SER 21 2HB SER 21 -7.438 -21.784 10.193 27 2HB SER 21 1HB SER 21 -6.361 -21.184 8.941 28 HG SER 21 HG SER 21 -8.277 -19.688 8.502 29 H LEU 22 H LEU 22 -7.179 -23.159 6.035 30 HA LEU 22 HA LEU 22 -6.564 -22.490 3.990 31 1HB LEU 22 2HB LEU 22 -9.154 -21.009 4.295 32 2HB LEU 22 1HB LEU 22 -8.270 -21.070 2.782 33 HG LEU 22 HG LEU 22 -9.251 -23.531 4.229 34 1HD1 LEU 22 1HD1 LEU 22 -10.996 -23.588 2.582 35 2HD1 LEU 22 2HD1 LEU 22 -10.448 -22.027 1.923 36 3HD1 LEU 22 3HD1 LEU 22 -11.054 -22.122 3.582 37 1HD2 LEU 22 1HD2 LEU 22 -8.841 -24.614 2.077 38 2HD2 LEU 22 2HD2 LEU 22 -7.359 -23.902 2.704 39 3HD2 LEU 22 3HD2 LEU 22 -8.246 -23.095 1.412 40 H VAL 23 H VAL 23 -5.520 -20.941 6.192 41 HA VAL 23 HA VAL 23 -5.241 -18.285 5.087 42 HB VAL 23 HB VAL 23 -4.034 -19.501 7.603 43 1HG1 VAL 23 1HG1 VAL 23 -3.924 -16.640 6.626 44 2HG1 VAL 23 2HG1 VAL 23 -2.558 -17.752 6.710 45 3HG1 VAL 23 3HG1 VAL 23 -3.349 -17.214 8.191 46 1HG2 VAL 23 1HG2 VAL 23 -6.219 -17.476 7.201 47 2HG2 VAL 23 2HG2 VAL 23 -5.587 -18.005 8.760 48 3HG2 VAL 23 3HG2 VAL 23 -6.437 -19.151 7.717 49 H GLY 24 H GLY 24 -3.625 -17.580 3.974 50 1HA GLY 24 2HA GLY 24 -1.208 -19.211 3.733 51 2HA GLY 24 1HA GLY 24 -2.021 -18.580 2.295 52 H LYS 25 H LYS 25 0.642 -17.928 3.180 53 HA LYS 25 HA LYS 25 0.241 -15.124 3.243 54 1HB LYS 25 2HB LYS 25 1.903 -14.822 5.144 55 2HB LYS 25 1HB LYS 25 0.290 -15.347 5.590 56 1HG LYS 25 2HG LYS 25 1.796 -16.546 6.932 57 2HG LYS 25 1HG LYS 25 1.210 -17.659 5.702 58 1HD LYS 25 2HD LYS 25 3.626 -17.969 5.988 59 2HD LYS 25 1HD LYS 25 3.251 -17.269 4.406 60 1HE LYS 25 2HE LYS 25 3.889 -15.054 5.185 61 2HE LYS 25 1HE LYS 25 4.172 -15.689 6.809 62 1HZ LYS 25 1HZ LYS 25 5.961 -17.030 5.914 63 2HZ LYS 25 2HZ LYS 25 6.239 -15.411 5.585 64 3HZ LYS 25 3HZ LYS 25 5.695 -16.445 4.363 65 H LEU 26 H LEU 26 1.931 -13.902 2.585 66 HA LEU 26 HA LEU 26 4.103 -15.364 1.317 67 1HB LEU 26 2HB LEU 26 2.348 -15.190 -0.326 68 2HB LEU 26 1HB LEU 26 2.158 -13.486 0.003 69 HG LEU 26 HG LEU 26 4.361 -13.046 -0.987 70 1HD1 LEU 26 1HD1 LEU 26 5.446 -15.177 -0.468 71 2HD1 LEU 26 2HD1 LEU 26 5.542 -14.797 -2.185 72 3HD1 LEU 26 3HD1 LEU 26 4.382 -15.994 -1.613 73 1HD2 LEU 26 1HD2 LEU 26 3.751 -13.555 -3.277 74 2HD2 LEU 26 2HD2 LEU 26 2.373 -12.947 -2.357 75 3HD2 LEU 26 3HD2 LEU 26 2.517 -14.676 -2.704 76 H GLU 27 H GLU 27 5.952 -14.224 1.301 77 HA GLU 27 HA GLU 27 5.834 -11.416 2.077 78 1HB GLU 27 2HB GLU 27 7.719 -13.489 3.197 79 2HB GLU 27 1HB GLU 27 7.838 -11.757 3.466 80 1HG GLU 27 2HG GLU 27 5.678 -11.781 4.600 81 2HG GLU 27 1HG GLU 27 5.553 -13.517 4.314 82 H THR 28 H THR 28 7.185 -10.161 0.990 83 HA THR 28 HA THR 28 9.312 -11.328 -0.566 84 HB THR 28 HB THR 28 7.317 -11.357 -2.113 85 HG1 THR 28 1HG THR 28 8.349 -9.756 -3.685 86 1HG2 THR 28 1HG2 THR 28 6.086 -9.454 -1.131 87 2HG2 THR 28 2HG2 THR 28 6.334 -9.229 -2.860 88 3HG2 THR 28 3HG2 THR 28 7.330 -8.345 -1.712 89 H ASP 29 H ASP 29 10.570 -9.447 -1.547 90 HA ASP 29 HA ASP 29 10.225 -7.023 0.033 91 1HB ASP 29 2HB ASP 29 12.583 -6.858 0.568 92 2HB ASP 29 1HB ASP 29 11.984 -8.404 1.140 93 H VAL 30 H VAL 30 10.745 -5.190 -0.975 94 HA VAL 30 HA VAL 30 11.657 -5.343 -3.760 95 HB VAL 30 HB VAL 30 9.377 -3.622 -2.672 96 1HG1 VAL 30 1HG1 VAL 30 10.692 -2.408 -4.358 97 2HG1 VAL 30 2HG1 VAL 30 9.075 -2.806 -4.945 98 3HG1 VAL 30 3HG1 VAL 30 10.466 -3.745 -5.486 99 1HG2 VAL 30 1HG2 VAL 30 9.336 -5.829 -4.707 100 2HG2 VAL 30 2HG2 VAL 30 7.953 -4.848 -4.231 101 3HG2 VAL 30 3HG2 VAL 30 8.709 -5.933 -3.055 102 H GLU 31 H GLU 31 12.983 -3.567 -4.365 103 HA GLU 31 HA GLU 31 13.904 -2.065 -2.032 104 1HB GLU 31 2HB GLU 31 15.397 -2.012 -4.648 105 2HB GLU 31 1HB GLU 31 15.883 -1.672 -2.986 106 1HG GLU 31 2HG GLU 31 16.999 -3.641 -3.587 107 2HG GLU 31 1HG GLU 31 15.684 -4.128 -2.527 108 H ILE 32 H ILE 32 13.457 0.002 -1.871 109 HA ILE 32 HA ILE 32 12.619 1.407 -4.298 110 HB ILE 32 HB ILE 32 11.730 3.186 -2.849 111 1HG1 ILE 32 2HG1 ILE 32 12.559 1.459 -0.496 112 2HG1 ILE 32 1HG1 ILE 32 13.379 2.929 -1.010 113 1HG2 ILE 32 1HG2 ILE 32 10.178 1.339 -3.391 114 2HG2 ILE 32 2HG2 ILE 32 9.853 1.983 -1.785 115 3HG2 ILE 32 3HG2 ILE 32 10.722 0.470 -1.968 116 1HD1 ILE 32 1HD1 ILE 32 11.946 3.350 0.897 117 2HD1 ILE 32 2HD1 ILE 32 10.549 2.742 0.003 118 3HD1 ILE 32 3HD1 ILE 32 11.369 4.214 -0.524 119 H LYS 33 H LYS 33 13.558 3.377 -4.785 120 HA LYS 33 HA LYS 33 16.414 3.193 -4.159 121 1HB LYS 33 2HB LYS 33 15.055 4.659 -6.441 122 2HB LYS 33 1HB LYS 33 16.790 4.495 -6.232 123 1HG LYS 33 2HG LYS 33 16.047 2.965 -7.957 124 2HG LYS 33 1HG LYS 33 16.499 2.000 -6.545 125 1HD LYS 33 2HD LYS 33 14.148 1.870 -5.919 126 2HD LYS 33 1HD LYS 33 13.719 2.867 -7.296 127 1HE LYS 33 2HE LYS 33 14.503 1.091 -8.778 128 2HE LYS 33 1HE LYS 33 14.920 0.120 -7.363 129 1HZ LYS 33 1HZ LYS 33 12.641 -0.363 -8.345 130 2HZ LYS 33 2HZ LYS 33 12.224 1.199 -7.812 131 3HZ LYS 33 3HZ LYS 33 12.679 0.036 -6.695 132 H ALA 34 H ALA 34 14.208 4.536 -2.672 133 HA ALA 34 HA ALA 34 15.578 7.096 -2.327 134 1HB ALA 34 1HB ALA 34 12.661 6.481 -1.882 135 2HB ALA 34 2HB ALA 34 13.323 7.436 -3.210 136 3HB ALA 34 3HB ALA 34 13.448 8.021 -1.548 137 H SER 35 H SER 35 15.319 7.891 -0.080 138 HA SER 35 HA SER 35 16.023 5.815 1.745 139 1HB SER 35 2HB SER 35 15.620 8.777 2.162 140 2HB SER 35 1HB SER 35 16.397 7.683 3.305 141 HG SER 35 HG SER 35 17.564 7.305 0.985 142 H ALA 36 H ALA 36 14.875 5.141 3.507 143 HA ALA 36 HA ALA 36 12.099 4.869 3.312 144 1HB ALA 36 1HB ALA 36 13.584 3.314 4.516 145 2HB ALA 36 2HB ALA 36 12.208 3.827 5.494 146 3HB ALA 36 3HB ALA 36 13.799 4.530 5.776 147 H ASP 37 H ASP 37 14.034 7.234 4.867 148 HA ASP 37 HA ASP 37 12.157 8.343 6.615 149 1HB ASP 37 2HB ASP 37 14.554 9.575 5.285 150 2HB ASP 37 1HB ASP 37 13.532 10.485 6.388 151 H LYS 38 H LYS 38 12.523 8.778 3.152 152 HA LYS 38 HA LYS 38 10.957 11.126 3.048 153 1HB LYS 38 2HB LYS 38 11.398 9.113 0.859 154 2HB LYS 38 1HB LYS 38 10.733 10.733 0.659 155 1HG LYS 38 2HG LYS 38 12.907 11.567 1.689 156 2HG LYS 38 1HG LYS 38 13.513 9.936 1.429 157 1HD LYS 38 2HD LYS 38 14.174 11.262 -0.406 158 2HD LYS 38 1HD LYS 38 12.879 10.172 -0.947 159 1HE LYS 38 2HE LYS 38 11.256 11.982 -0.798 160 2HE LYS 38 1HE LYS 38 12.487 13.061 -0.146 161 1HZ LYS 38 1HZ LYS 38 12.476 11.857 -2.848 162 2HZ LYS 38 2HZ LYS 38 13.644 12.942 -2.299 163 3HZ LYS 38 3HZ LYS 38 12.040 13.417 -2.500 164 H PHE 39 H PHE 39 10.272 7.740 2.996 165 HA PHE 39 HA PHE 39 7.519 7.859 2.321 166 1HB PHE 39 2HB PHE 39 8.901 5.779 2.216 167 2HB PHE 39 1HB PHE 39 9.035 5.803 3.965 168 HD1 PHE 39 1HD PHE 39 6.752 5.315 1.142 169 HD2 PHE 39 2HD PHE 39 7.272 4.970 5.342 170 HE1 PHE 39 1HE PHE 39 4.704 3.966 1.279 171 HE2 PHE 39 2HE PHE 39 5.226 3.617 5.492 172 HZ PHE 39 HZ PHE 39 3.937 3.116 3.449 173 H HIS 40 H HIS 40 9.361 7.974 5.294 174 HA HIS 40 HA HIS 40 7.207 8.028 7.116 175 1HB HIS 40 2HB HIS 40 9.521 7.572 7.845 176 2HB HIS 40 1HB HIS 40 9.987 9.209 7.412 177 HD1 HIS 40 1HD HIS 40 8.281 7.230 10.080 178 HD2 HIS 40 2HD HIS 40 9.155 11.208 9.259 179 HE1 HIS 40 1HE HIS 40 7.890 8.448 12.203 180 HE2 HIS 40 2HE HIS 40 8.024 10.834 11.568 181 H HIS 41 H HIS 41 8.905 10.582 5.367 182 HA HIS 41 HA HIS 41 7.630 12.764 6.594 183 1HB HIS 41 2HB HIS 41 8.898 12.510 3.871 184 2HB HIS 41 1HB HIS 41 8.036 13.968 4.320 185 HD1 HIS 41 1HD HIS 41 9.295 15.654 5.687 186 HD2 HIS 41 2HD HIS 41 11.276 12.017 5.459 187 HE1 HIS 41 1HE HIS 41 11.574 16.074 6.630 188 HE2 HIS 41 2HE HIS 41 12.824 13.954 6.195 189 H MET 42 H MET 42 6.599 10.711 3.964 190 HA MET 42 HA MET 42 4.449 12.286 3.121 191 1HB MET 42 2HB MET 42 4.738 9.292 2.977 192 2HB MET 42 1HB MET 42 3.474 10.210 2.174 193 1HG MET 42 2HG MET 42 5.220 11.430 0.916 194 2HG MET 42 1HG MET 42 6.432 10.401 1.676 195 1HE MET 42 1HE MET 42 2.813 9.284 0.453 196 2HE MET 42 2HE MET 42 3.180 8.809 -1.200 197 3HE MET 42 3HE MET 42 3.316 10.501 -0.729 198 H PHE 43 H PHE 43 4.698 10.274 5.920 199 HA PHE 43 HA PHE 43 1.799 10.500 6.298 200 1HB PHE 43 2HB PHE 43 2.814 8.242 6.525 201 2HB PHE 43 1HB PHE 43 3.792 8.836 7.856 202 HD1 PHE 43 1HD PHE 43 0.318 8.152 6.780 203 HD2 PHE 43 2HD PHE 43 2.922 8.912 10.061 204 HE1 PHE 43 1HE PHE 43 -1.480 7.545 8.343 205 HE2 PHE 43 2HE PHE 43 1.129 8.302 11.630 206 HZ PHE 43 HZ PHE 43 -1.075 7.620 10.773 207 H ALA 44 H ALA 44 4.852 11.547 7.674 208 HA ALA 44 HA ALA 44 3.624 12.571 10.083 209 1HB ALA 44 1HB ALA 44 5.918 11.691 10.116 210 2HB ALA 44 2HB ALA 44 5.846 13.364 10.673 211 3HB ALA 44 3HB ALA 44 6.423 13.000 9.049 212 H GLY 45 H GLY 45 4.772 13.911 7.048 213 1HA GLY 45 2HA GLY 45 3.170 16.256 7.353 214 2HA GLY 45 1HA GLY 45 4.903 16.573 7.463 215 H LYS 46 H LYS 46 2.389 15.254 5.483 216 HA LYS 46 HA LYS 46 3.743 14.146 3.417 217 1HB LYS 46 2HB LYS 46 1.801 14.329 2.023 218 2HB LYS 46 1HB LYS 46 1.278 14.051 3.667 219 1HG LYS 46 2HG LYS 46 1.262 16.706 2.242 220 2HG LYS 46 1HG LYS 46 -0.139 15.662 2.453 221 1HD LYS 46 2HD LYS 46 0.011 15.957 4.872 222 2HD LYS 46 1HD LYS 46 1.461 16.944 4.665 223 1HE LYS 46 2HE LYS 46 0.180 18.581 3.399 224 2HE LYS 46 1HE LYS 46 -1.273 17.612 3.570 225 1HZ LYS 46 1HZ LYS 46 0.244 18.866 5.797 226 2HZ LYS 46 2HZ LYS 46 -1.149 17.949 5.976 227 3HZ LYS 46 3HZ LYS 46 -1.210 19.418 5.175 228 HA PRO 47 HA PRO 47 5.750 17.457 1.173 229 1HB PRO 47 2HB PRO 47 6.883 15.934 -0.707 230 2HB PRO 47 1HB PRO 47 7.412 15.801 0.974 231 1HG PRO 47 2HG PRO 47 5.524 14.051 -0.551 232 2HG PRO 47 1HG PRO 47 6.866 13.584 0.509 233 1HD PRO 47 2HD PRO 47 4.246 13.648 1.324 234 2HD PRO 47 1HD PRO 47 5.626 13.903 2.420 235 H HIS 48 H HIS 48 3.061 15.853 0.431 236 HA HIS 48 HA HIS 48 2.641 17.216 -2.123 237 1HB HIS 48 2HB HIS 48 3.139 14.820 -2.561 238 2HB HIS 48 1HB HIS 48 1.824 14.366 -1.492 239 HD1 HIS 48 1HD HIS 48 2.612 15.402 -4.887 240 HD2 HIS 48 2HD HIS 48 -0.797 14.879 -2.599 241 HE1 HIS 48 1HE HIS 48 0.683 15.307 -6.535 242 HE2 HIS 48 2HE HIS 48 -1.271 14.662 -5.123 243 H HIS 49 H HIS 49 1.392 18.738 -1.119 244 HA HIS 49 HA HIS 49 -0.864 17.766 0.453 245 1HB HIS 49 2HB HIS 49 -1.239 20.117 1.149 246 2HB HIS 49 1HB HIS 49 0.385 19.575 1.527 247 HD1 HIS 49 1HD HIS 49 2.004 21.422 1.156 248 HD2 HIS 49 2HD HIS 49 -1.134 21.461 -1.537 249 HE1 HIS 49 1HE HIS 49 2.429 23.428 -0.279 250 HE2 HIS 49 2HE HIS 49 0.506 23.488 -1.914 251 H VAL 50 H VAL 50 -2.992 18.406 0.003 252 HA VAL 50 HA VAL 50 -3.296 18.833 -2.838 253 HB VAL 50 HB VAL 50 -5.648 17.975 -2.560 254 1HG1 VAL 50 1HG1 VAL 50 -4.954 15.622 -2.318 255 2HG1 VAL 50 2HG1 VAL 50 -3.406 16.172 -1.661 256 3HG1 VAL 50 3HG1 VAL 50 -3.837 16.543 -3.329 257 1HG2 VAL 50 1HG2 VAL 50 -4.660 17.258 0.200 258 2HG2 VAL 50 2HG2 VAL 50 -6.202 16.751 -0.500 259 3HG2 VAL 50 3HG2 VAL 50 -5.889 18.462 -0.169 260 H SER 51 H SER 51 -3.199 20.841 -3.187 261 HA SER 51 HA SER 51 -5.398 22.482 -2.262 262 1HB SER 51 2HB SER 51 -2.503 23.362 -2.183 263 2HB SER 51 1HB SER 51 -3.908 24.346 -1.764 264 HG SER 51 HG SER 51 -4.109 22.192 -0.319 265 H LYS 52 H LYS 52 -6.253 22.481 -4.258 266 HA LYS 52 HA LYS 52 -4.636 23.680 -6.372 267 1HB LYS 52 2HB LYS 52 -4.589 21.307 -6.739 268 2HB LYS 52 1HB LYS 52 -6.334 21.220 -6.599 269 1HG LYS 52 2HG LYS 52 -6.615 22.401 -8.673 270 2HG LYS 52 1HG LYS 52 -4.879 22.700 -8.783 271 1HD LYS 52 2HD LYS 52 -5.567 20.814 -10.223 272 2HD LYS 52 1HD LYS 52 -4.451 20.328 -8.951 273 1HE LYS 52 2HE LYS 52 -6.332 19.526 -7.606 274 2HE LYS 52 1HE LYS 52 -7.447 19.976 -8.889 275 1HZ LYS 52 1HZ LYS 52 -6.354 18.365 -10.339 276 2HZ LYS 52 2HZ LYS 52 -6.873 17.593 -8.927 277 3HZ LYS 52 3HZ LYS 52 -5.265 17.969 -9.125 278 H ALA 53 H ALA 53 -7.908 22.514 -5.676 279 HA ALA 53 HA ALA 53 -9.951 23.336 -5.982 280 1HB ALA 53 1HB ALA 53 -8.689 26.082 -5.977 281 2HB ALA 53 2HB ALA 53 -9.165 25.188 -4.533 282 3HB ALA 53 3HB ALA 53 -10.389 25.710 -5.689 283 H SER 54 H SER 54 -11.033 23.003 -7.702 284 HA SER 54 HA SER 54 -9.979 23.239 -10.267 285 1HB SER 54 2HB SER 54 -12.349 22.628 -10.952 286 2HB SER 54 1HB SER 54 -11.541 21.514 -9.848 287 HG SER 54 HG SER 54 -12.825 22.073 -8.275 288 HA PRO 55 HA PRO 55 -10.837 27.510 -11.341 289 1HB PRO 55 2HB PRO 55 -11.052 26.371 -14.080 290 2HB PRO 55 1HB PRO 55 -10.051 27.710 -13.507 291 1HG PRO 55 2HG PRO 55 -8.956 25.350 -14.051 292 2HG PRO 55 1HG PRO 55 -8.419 26.297 -12.650 293 1HD PRO 55 2HD PRO 55 -10.190 23.892 -12.744 294 2HD PRO 55 1HD PRO 55 -8.936 24.347 -11.566 295 H GLY 56 H GLY 56 -12.759 28.344 -11.019 296 1HA GLY 56 2HA GLY 56 -14.954 28.888 -11.779 297 2HA GLY 56 1HA GLY 56 -15.064 27.277 -12.493 298 H ASN 57 H ASN 57 -14.084 28.407 -9.312 299 HA ASN 57 HA ASN 57 -16.296 26.997 -8.022 300 1HB ASN 57 2HB ASN 57 -14.344 25.388 -8.291 301 2HB ASN 57 1HB ASN 57 -13.356 26.510 -7.386 302 1HD2 ASN 57 1HD2 ASN 57 -13.959 23.747 -6.873 303 2HD2 ASN 57 2HD2 ASN 57 -14.686 23.651 -5.313 304 H ILE 58 H ILE 58 -16.428 27.731 -5.782 305 HA ILE 58 HA ILE 58 -15.863 30.472 -5.345 306 HB ILE 58 HB ILE 58 -16.562 28.277 -3.364 307 1HG1 ILE 58 2HG1 ILE 58 -18.332 30.321 -4.734 308 2HG1 ILE 58 1HG1 ILE 58 -18.265 28.606 -5.111 309 1HG2 ILE 58 1HG2 ILE 58 -15.505 30.168 -2.306 310 2HG2 ILE 58 2HG2 ILE 58 -17.215 30.068 -1.829 311 3HG2 ILE 58 3HG2 ILE 58 -16.673 31.263 -3.025 312 1HD1 ILE 58 1HD1 ILE 58 -19.177 29.810 -2.502 313 2HD1 ILE 58 2HD1 ILE 58 -19.122 28.088 -2.877 314 3HD1 ILE 58 3HD1 ILE 58 -20.216 29.150 -3.764 315 H GLN 59 H GLN 59 -14.301 27.488 -4.622 316 HA GLN 59 HA GLN 59 -12.222 26.861 -4.122 317 1HB GLN 59 2HB GLN 59 -11.413 29.761 -4.267 318 2HB GLN 59 1HB GLN 59 -10.329 28.379 -4.255 319 1HG GLN 59 2HG GLN 59 -11.356 27.625 -6.379 320 2HG GLN 59 1HG GLN 59 -12.320 29.109 -6.344 321 1HE2 GLN 59 1HE2 GLN 59 -11.336 31.059 -6.720 322 2HE2 GLN 59 2HE2 GLN 59 -9.760 31.215 -7.392 323 H GLY 60 H GLY 60 -12.563 26.064 -2.229 324 1HA GLY 60 2HA GLY 60 -12.013 27.835 0.050 325 2HA GLY 60 1HA GLY 60 -13.096 26.445 0.123 326 H CYS 61 H CYS 61 -11.935 24.419 -0.921 327 HA CYS 61 HA CYS 61 -10.483 22.729 -0.583 328 1HB CYS 61 2HB CYS 61 -8.965 24.367 -1.810 329 2HB CYS 61 1HB CYS 61 -8.397 24.921 -0.245 330 HG CYS 61 HG CYS 61 -6.768 22.945 0.276 331 H ASP 62 H ASP 62 -11.919 23.945 1.512 332 HA ASP 62 HA ASP 62 -10.363 24.159 3.911 333 1HB ASP 62 2HB ASP 62 -12.339 25.531 3.618 334 2HB ASP 62 1HB ASP 62 -13.324 24.098 3.388 335 H LEU 63 H LEU 63 -12.167 21.707 2.299 336 HA LEU 63 HA LEU 63 -12.256 19.918 4.525 337 1HB LEU 63 2HB LEU 63 -12.555 19.352 1.570 338 2HB LEU 63 1HB LEU 63 -12.933 18.228 2.857 339 HG LEU 63 HG LEU 63 -14.369 20.824 2.286 340 1HD1 LEU 63 1HD1 LEU 63 -15.235 17.963 1.943 341 2HD1 LEU 63 2HD1 LEU 63 -14.854 19.104 0.653 342 3HD1 LEU 63 3HD1 LEU 63 -16.248 19.384 1.697 343 1HD2 LEU 63 1HD2 LEU 63 -14.349 20.367 4.683 344 2HD2 LEU 63 2HD2 LEU 63 -14.919 18.723 4.392 345 3HD2 LEU 63 3HD2 LEU 63 -15.955 20.102 4.017 346 H HIS 64 H HIS 64 -10.508 19.108 5.361 347 HA HIS 64 HA HIS 64 -8.001 18.965 3.975 348 1HB HIS 64 2HB HIS 64 -8.098 19.469 6.386 349 2HB HIS 64 1HB HIS 64 -8.799 17.891 6.694 350 HD1 HIS 64 1HD HIS 64 -5.575 19.645 6.229 351 HD2 HIS 64 2HD HIS 64 -6.925 15.715 6.385 352 HE1 HIS 64 1HE HIS 64 -3.548 18.249 6.563 353 HE2 HIS 64 2HE HIS 64 -4.359 15.879 6.383 354 H GLU 65 H GLU 65 -7.282 17.383 2.743 355 HA GLU 65 HA GLU 65 -8.301 14.712 3.228 356 1HB GLU 65 2HB GLU 65 -9.591 15.762 1.377 357 2HB GLU 65 1HB GLU 65 -8.093 16.041 0.510 358 1HG GLU 65 2HG GLU 65 -7.755 13.671 0.255 359 2HG GLU 65 1HG GLU 65 -9.161 13.333 1.262 360 H GLY 66 H GLY 66 -6.857 13.060 2.315 361 1HA GLY 66 2HA GLY 66 -4.691 12.586 1.263 362 2HA GLY 66 1HA GLY 66 -4.076 14.024 2.073 363 H ASP 67 H ASP 67 -5.986 13.101 4.312 364 HA ASP 67 HA ASP 67 -5.094 10.747 5.460 365 1HB ASP 67 2HB ASP 67 -3.589 11.503 7.212 366 2HB ASP 67 1HB ASP 67 -2.910 12.028 5.679 367 H TRP 68 H TRP 68 -6.166 10.446 7.423 368 HA TRP 68 HA TRP 68 -8.140 12.528 8.034 369 1HB TRP 68 2HB TRP 68 -8.168 9.570 8.683 370 2HB TRP 68 1HB TRP 68 -9.417 10.710 9.158 371 HD1 TRP 68 HD TRP 68 -7.912 9.168 5.936 372 HE1 TRP 68 1HE TRP 68 -9.738 9.158 4.114 373 HE3 TRP 68 3HE TRP 68 -11.590 11.653 8.463 374 HZ2 TRP 68 2HZ TRP 68 -12.380 10.070 3.799 375 HZ3 TRP 68 3HZ TRP 68 -13.734 12.035 7.332 376 HH2 TRP 68 HH TRP 68 -14.120 11.263 5.053 377 H GLY 69 H GLY 69 -5.351 10.982 9.172 378 1HA GLY 69 2HA GLY 69 -4.039 11.620 10.977 379 2HA GLY 69 1HA GLY 69 -5.385 12.565 11.588 380 H THR 70 H THR 70 -6.764 9.685 11.027 381 HA THR 70 HA THR 70 -6.188 8.733 13.733 382 HB THR 70 HB THR 70 -8.531 7.783 13.566 383 HG1 THR 70 1HG THR 70 -9.534 9.537 11.843 384 1HG2 THR 70 1HG2 THR 70 -9.601 9.917 14.122 385 2HG2 THR 70 2HG2 THR 70 -8.237 10.793 13.427 386 3HG2 THR 70 3HG2 THR 70 -8.013 9.805 14.873 387 H VAL 71 H VAL 71 -5.872 6.524 14.058 388 HA VAL 71 HA VAL 71 -5.163 4.919 11.805 389 HB VAL 71 HB VAL 71 -5.644 4.044 14.679 390 1HG1 VAL 71 1HG1 VAL 71 -4.088 2.702 12.478 391 2HG1 VAL 71 2HG1 VAL 71 -5.643 2.186 13.125 392 3HG1 VAL 71 3HG1 VAL 71 -4.204 2.142 14.147 393 1HG2 VAL 71 1HG2 VAL 71 -3.202 4.214 14.978 394 2HG2 VAL 71 2HG2 VAL 71 -3.944 5.776 14.622 395 3HG2 VAL 71 3HG2 VAL 71 -3.072 4.908 13.361 396 H GLY 72 H GLY 72 -6.420 3.358 10.762 397 1HA GLY 72 2HA GLY 72 -8.298 1.934 10.553 398 2HA GLY 72 1HA GLY 72 -9.109 2.839 11.829 399 H SER 73 H SER 73 -7.706 5.061 9.929 400 HA SER 73 HA SER 73 -10.162 5.756 8.724 401 1HB SER 73 2HB SER 73 -8.831 7.637 7.756 402 2HB SER 73 1HB SER 73 -8.744 7.516 9.515 403 HG SER 73 HG SER 73 -6.725 7.012 9.410 404 H ILE 74 H ILE 74 -10.462 6.108 6.448 405 HA ILE 74 HA ILE 74 -8.990 4.114 4.942 406 HB ILE 74 HB ILE 74 -11.927 4.754 4.849 407 1HG1 ILE 74 2HG1 ILE 74 -10.373 2.217 5.267 408 2HG1 ILE 74 1HG1 ILE 74 -11.010 3.189 6.575 409 1HG2 ILE 74 1HG2 ILE 74 -12.103 3.153 2.984 410 2HG2 ILE 74 2HG2 ILE 74 -10.340 3.044 2.915 411 3HG2 ILE 74 3HG2 ILE 74 -11.146 4.563 2.526 412 1HD1 ILE 74 1HD1 ILE 74 -12.556 1.719 4.458 413 2HD1 ILE 74 2HD1 ILE 74 -13.270 2.722 5.741 414 3HD1 ILE 74 3HD1 ILE 74 -12.350 1.268 6.155 415 H VAL 75 H VAL 75 -7.791 4.844 3.494 416 HA VAL 75 HA VAL 75 -8.547 7.117 1.848 417 HB VAL 75 HB VAL 75 -6.141 7.710 1.663 418 1HG1 VAL 75 1HG1 VAL 75 -7.062 7.645 4.526 419 2HG1 VAL 75 2HG1 VAL 75 -7.435 8.892 3.337 420 3HG1 VAL 75 3HG1 VAL 75 -5.774 8.665 3.890 421 1HG2 VAL 75 1HG2 VAL 75 -5.162 5.520 2.101 422 2HG2 VAL 75 2HG2 VAL 75 -5.686 5.607 3.783 423 3HG2 VAL 75 3HG2 VAL 75 -4.470 6.733 3.177 424 H PHE 76 H PHE 76 -7.290 6.891 -0.287 425 HA PHE 76 HA PHE 76 -6.987 4.025 -0.867 426 1HB PHE 76 2HB PHE 76 -8.255 6.101 -2.662 427 2HB PHE 76 1HB PHE 76 -7.983 4.410 -3.072 428 HD1 PHE 76 1HD PHE 76 -8.951 2.778 -1.228 429 HD2 PHE 76 2HD PHE 76 -10.381 6.666 -2.030 430 HE1 PHE 76 1HE PHE 76 -11.145 2.158 -0.250 431 HE2 PHE 76 2HE PHE 76 -12.559 6.088 -1.055 432 HZ PHE 76 HZ PHE 76 -12.944 3.815 -0.164 433 H TRP 77 H TRP 77 -5.388 3.464 -2.341 434 HA TRP 77 HA TRP 77 -3.562 5.640 -2.977 435 1HB TRP 77 2HB TRP 77 -3.053 2.692 -2.627 436 2HB TRP 77 1HB TRP 77 -1.898 3.751 -3.427 437 HD1 TRP 77 HD TRP 77 -3.864 4.722 -0.371 438 HE1 TRP 77 1HE TRP 77 -2.225 5.088 1.632 439 HE3 TRP 77 3HE TRP 77 0.423 3.228 -2.622 440 HZ2 TRP 77 2HZ TRP 77 0.545 4.788 2.114 441 HZ3 TRP 77 3HZ TRP 77 2.530 3.291 -1.356 442 HH2 TRP 77 HH TRP 77 2.591 4.058 0.965 443 H ASN 78 H ASN 78 -3.166 6.145 -4.785 444 HA ASN 78 HA ASN 78 -4.388 4.757 -7.090 445 1HB ASN 78 2HB ASN 78 -3.369 7.604 -6.870 446 2HB ASN 78 1HB ASN 78 -4.032 6.884 -8.329 447 1HD2 ASN 78 1HD2 ASN 78 -4.737 8.085 -5.153 448 2HD2 ASN 78 2HD2 ASN 78 -6.447 8.176 -5.362 449 H TYR 79 H TYR 79 -3.155 3.870 -8.587 450 HA TYR 79 HA TYR 79 -0.380 4.666 -8.881 451 1HB TYR 79 2HB TYR 79 0.339 2.243 -8.896 452 2HB TYR 79 1HB TYR 79 -0.165 2.825 -7.319 453 HD1 TYR 79 1HD TYR 79 -0.857 0.479 -10.018 454 HD2 TYR 79 2HD TYR 79 -2.325 2.066 -6.354 455 HE1 TYR 79 1HE TYR 79 -2.425 -1.408 -9.828 456 HE2 TYR 79 2HE TYR 79 -3.895 0.187 -6.160 457 HH TYR 79 HH TYR 79 -3.691 -2.602 -8.103 458 H VAL 80 H VAL 80 0.497 3.961 -10.992 459 HA VAL 80 HA VAL 80 -1.747 3.684 -12.846 460 HB VAL 80 HB VAL 80 1.009 4.856 -13.353 461 1HG1 VAL 80 1HG1 VAL 80 0.122 5.534 -15.535 462 2HG1 VAL 80 2HG1 VAL 80 -1.384 4.684 -15.187 463 3HG1 VAL 80 3HG1 VAL 80 0.119 3.778 -15.357 464 1HG2 VAL 80 1HG2 VAL 80 -0.172 6.987 -13.570 465 2HG2 VAL 80 2HG2 VAL 80 -0.414 6.287 -11.965 466 3HG2 VAL 80 3HG2 VAL 80 -1.692 6.186 -13.173 467 H HIS 81 H HIS 81 -1.967 1.898 -13.888 468 HA HIS 81 HA HIS 81 0.351 0.348 -14.701 469 1HB HIS 81 2HB HIS 81 -0.400 -0.578 -12.502 470 2HB HIS 81 1HB HIS 81 -1.986 -0.858 -13.204 471 HD1 HIS 81 1HD HIS 81 1.615 -1.882 -13.992 472 HD2 HIS 81 2HD HIS 81 -2.252 -3.342 -14.086 473 HE1 HIS 81 1HE HIS 81 1.840 -4.265 -14.688 474 HE2 HIS 81 2HE HIS 81 -0.472 -5.193 -14.355 475 H ASP 82 H ASP 82 0.123 -0.328 -16.708 476 HA ASP 82 HA ASP 82 -0.700 -0.555 -18.818 477 1HB ASP 82 2HB ASP 82 -3.308 -1.067 -17.360 478 2HB ASP 82 1HB ASP 82 -3.158 -1.155 -19.105 479 H GLY 83 H GLY 83 -0.553 1.942 -17.471 480 1HA GLY 83 2HA GLY 83 -0.848 4.122 -18.173 481 2HA GLY 83 1HA GLY 83 -1.922 3.527 -19.429 482 H GLU 84 H GLU 84 -3.334 2.153 -16.876 483 HA GLU 84 HA GLU 84 -5.177 4.391 -16.632 484 1HB GLU 84 2HB GLU 84 -6.020 2.105 -17.283 485 2HB GLU 84 1HB GLU 84 -5.523 1.525 -15.693 486 1HG GLU 84 2HG GLU 84 -7.061 3.026 -14.627 487 2HG GLU 84 1HG GLU 84 -7.545 3.683 -16.192 488 H ALA 85 H ALA 85 -5.744 5.222 -14.669 489 HA ALA 85 HA ALA 85 -3.866 4.778 -12.520 490 1HB ALA 85 1HB ALA 85 -6.310 6.567 -12.687 491 2HB ALA 85 2HB ALA 85 -4.636 7.069 -12.942 492 3HB ALA 85 3HB ALA 85 -5.164 6.533 -11.348 493 H LYS 86 H LYS 86 -4.162 3.201 -11.202 494 HA LYS 86 HA LYS 86 -6.782 1.906 -11.083 495 1HB LYS 86 2HB LYS 86 -4.224 0.826 -9.943 496 2HB LYS 86 1HB LYS 86 -5.640 -0.052 -10.483 497 1HG LYS 86 2HG LYS 86 -3.658 1.354 -12.253 498 2HG LYS 86 1HG LYS 86 -3.703 -0.379 -11.926 499 1HD LYS 86 2HD LYS 86 -5.883 1.205 -13.317 500 2HD LYS 86 1HD LYS 86 -4.642 0.264 -14.142 501 1HE LYS 86 2HE LYS 86 -5.465 -1.737 -12.937 502 2HE LYS 86 1HE LYS 86 -6.779 -0.715 -12.299 503 1HZ LYS 86 1HZ LYS 86 -7.494 -0.328 -14.572 504 2HZ LYS 86 2HZ LYS 86 -7.479 -1.983 -14.213 505 3HZ LYS 86 3HZ LYS 86 -6.255 -1.313 -15.152 506 H VAL 87 H VAL 87 -7.659 1.569 -9.096 507 HA VAL 87 HA VAL 87 -6.466 3.069 -6.852 508 HB VAL 87 HB VAL 87 -9.423 2.833 -7.473 509 1HG1 VAL 87 1HG1 VAL 87 -7.994 4.485 -5.394 510 2HG1 VAL 87 2HG1 VAL 87 -8.988 3.058 -5.096 511 3HG1 VAL 87 3HG1 VAL 87 -9.726 4.532 -5.727 512 1HG2 VAL 87 1HG2 VAL 87 -7.588 5.199 -7.858 513 2HG2 VAL 87 2HG2 VAL 87 -9.342 5.228 -8.043 514 3HG2 VAL 87 3HG2 VAL 87 -8.356 4.250 -9.131 515 H ALA 88 H ALA 88 -6.344 1.972 -4.962 516 HA ALA 88 HA ALA 88 -7.617 -0.664 -4.850 517 1HB ALA 88 1HB ALA 88 -5.174 -0.745 -4.768 518 2HB ALA 88 2HB ALA 88 -5.867 -1.244 -3.225 519 3HB ALA 88 3HB ALA 88 -5.179 0.369 -3.394 520 H LYS 89 H LYS 89 -8.943 -1.136 -3.170 521 HA LYS 89 HA LYS 89 -9.577 1.035 -1.340 522 1HB LYS 89 2HB LYS 89 -11.051 -1.598 -1.727 523 2HB LYS 89 1HB LYS 89 -11.576 -0.218 -0.784 524 1HG LYS 89 2HG LYS 89 -11.782 1.145 -2.733 525 2HG LYS 89 1HG LYS 89 -11.134 -0.130 -3.752 526 1HD LYS 89 2HD LYS 89 -13.059 -1.555 -3.094 527 2HD LYS 89 1HD LYS 89 -13.717 -0.181 -2.200 528 1HE LYS 89 2HE LYS 89 -14.762 -0.331 -4.388 529 2HE LYS 89 1HE LYS 89 -13.773 1.122 -4.291 530 1HZ LYS 89 1HZ LYS 89 -13.002 -1.424 -5.621 531 2HZ LYS 89 2HZ LYS 89 -12.020 -0.059 -5.539 532 3HZ LYS 89 3HZ LYS 89 -13.453 -0.004 -6.390 533 H GLU 90 H GLU 90 -9.016 0.994 0.790 534 HA GLU 90 HA GLU 90 -7.954 -1.371 1.966 535 1HB GLU 90 2HB GLU 90 -5.740 -0.290 2.283 536 2HB GLU 90 1HB GLU 90 -6.084 -0.680 0.601 537 1HG GLU 90 2HG GLU 90 -6.750 1.649 0.207 538 2HG GLU 90 1HG GLU 90 -6.355 2.035 1.875 539 H ARG 91 H ARG 91 -7.146 -0.754 4.116 540 HA ARG 91 HA ARG 91 -8.310 1.698 5.234 541 1HB ARG 91 2HB ARG 91 -9.794 -0.259 5.721 542 2HB ARG 91 1HB ARG 91 -8.431 -1.066 6.481 543 1HG ARG 91 2HG ARG 91 -8.308 0.836 8.095 544 2HG ARG 91 1HG ARG 91 -9.800 1.457 7.397 545 1HD ARG 91 2HD ARG 91 -10.883 -0.715 7.977 546 2HD ARG 91 1HD ARG 91 -9.401 -1.180 8.814 547 HE ARG 91 HE ARG 91 -10.921 1.227 9.503 548 1HH1 ARG 91 1HH1 ARG 91 -9.200 -1.756 10.632 549 2HH1 ARG 91 2HH1 ARG 91 -9.580 -1.475 12.241 550 1HH2 ARG 91 1HH2 ARG 91 -11.376 1.536 11.794 551 2HH2 ARG 91 2HH2 ARG 91 -10.801 0.414 12.933 552 H ILE 92 H ILE 92 -6.940 2.588 6.805 553 HA ILE 92 HA ILE 92 -4.302 1.443 7.067 554 HB ILE 92 HB ILE 92 -5.657 3.711 8.584 555 1HG1 ILE 92 2HG1 ILE 92 -3.645 3.796 6.316 556 2HG1 ILE 92 1HG1 ILE 92 -5.354 4.194 6.197 557 1HG2 ILE 92 1HG2 ILE 92 -3.412 4.357 9.359 558 2HG2 ILE 92 2HG2 ILE 92 -2.747 2.900 8.623 559 3HG2 ILE 92 3HG2 ILE 92 -3.897 2.771 9.954 560 1HD1 ILE 92 1HD1 ILE 92 -3.296 5.682 7.821 561 2HD1 ILE 92 2HD1 ILE 92 -5.006 6.090 7.704 562 3HD1 ILE 92 3HD1 ILE 92 -3.974 6.197 6.278 563 H GLU 93 H GLU 93 -3.878 -0.178 8.458 564 HA GLU 93 HA GLU 93 -5.882 -0.624 10.563 565 1HB GLU 93 2HB GLU 93 -5.630 -2.407 8.862 566 2HB GLU 93 1HB GLU 93 -3.957 -2.609 9.350 567 1HG GLU 93 2HG GLU 93 -5.421 -4.321 10.293 568 2HG GLU 93 1HG GLU 93 -4.646 -3.345 11.542 569 H ALA 94 H ALA 94 -2.408 -0.550 9.963 570 HA ALA 94 HA ALA 94 -2.003 0.190 12.724 571 1HB ALA 94 1HB ALA 94 -0.227 -1.475 13.048 572 2HB ALA 94 2HB ALA 94 -0.602 -2.189 11.483 573 3HB ALA 94 3HB ALA 94 -1.787 -2.254 12.787 574 H VAL 95 H VAL 95 -0.240 1.495 12.942 575 HA VAL 95 HA VAL 95 1.583 1.734 10.744 576 HB VAL 95 HB VAL 95 -0.184 3.304 10.081 577 1HG1 VAL 95 1HG1 VAL 95 0.238 4.668 12.728 578 2HG1 VAL 95 2HG1 VAL 95 -1.197 3.785 12.208 579 3HG1 VAL 95 3HG1 VAL 95 -0.747 5.283 11.398 580 1HG2 VAL 95 1HG2 VAL 95 2.283 4.729 11.075 581 2HG2 VAL 95 2HG2 VAL 95 1.156 5.360 9.871 582 3HG2 VAL 95 3HG2 VAL 95 2.104 3.910 9.523 583 H GLU 96 H GLU 96 3.504 1.915 11.472 584 HA GLU 96 HA GLU 96 3.961 2.784 14.255 585 1HB GLU 96 2HB GLU 96 5.698 1.095 12.453 586 2HB GLU 96 1HB GLU 96 6.087 1.566 14.076 587 1HG GLU 96 2HG GLU 96 3.743 -0.178 13.357 588 2HG GLU 96 1HG GLU 96 5.326 -0.737 13.926 589 HA PRO 97 HA PRO 97 5.807 6.254 11.994 590 1HB PRO 97 2HB PRO 97 6.388 7.166 14.744 591 2HB PRO 97 1HB PRO 97 5.524 7.999 13.450 592 1HG PRO 97 2HG PRO 97 4.211 7.024 15.561 593 2HG PRO 97 1HG PRO 97 3.514 6.952 13.933 594 1HD PRO 97 2HD PRO 97 4.856 4.796 15.515 595 2HD PRO 97 1HD PRO 97 3.395 4.720 14.502 596 H ASP 98 H ASP 98 7.248 4.837 14.943 597 HA ASP 98 HA ASP 98 9.871 5.690 14.167 598 1HB ASP 98 2HB ASP 98 9.006 3.941 16.473 599 2HB ASP 98 1HB ASP 98 10.627 4.564 16.216 600 H LYS 99 H LYS 99 8.084 2.674 14.134 601 HA LYS 99 HA LYS 99 10.447 1.170 13.330 602 1HB LYS 99 2HB LYS 99 7.586 0.254 13.466 603 2HB LYS 99 1HB LYS 99 8.989 -0.761 13.184 604 1HG LYS 99 2HG LYS 99 9.860 -0.012 15.408 605 2HG LYS 99 1HG LYS 99 8.287 0.765 15.636 606 1HD LYS 99 2HD LYS 99 7.169 -1.338 15.351 607 2HD LYS 99 1HD LYS 99 8.746 -2.101 15.062 608 1HE LYS 99 2HE LYS 99 9.475 -1.518 17.311 609 2HE LYS 99 1HE LYS 99 7.937 -0.716 17.622 610 1HZ LYS 99 1HZ LYS 99 8.046 -2.903 18.597 611 2HZ LYS 99 2HZ LYS 99 8.286 -3.607 17.072 612 3HZ LYS 99 3HZ LYS 99 6.823 -2.833 17.434 613 H ASN 100 H ASN 100 8.301 3.130 11.863 614 HA ASN 100 HA ASN 100 7.503 3.543 9.834 615 1HB ASN 100 2HB ASN 100 9.961 3.928 9.475 616 2HB ASN 100 1HB ASN 100 10.077 2.293 8.836 617 1HD2 ASN 100 1HD2 ASN 100 10.720 2.990 6.840 618 2HD2 ASN 100 2HD2 ASN 100 9.654 3.798 5.729 619 H LEU 101 H LEU 101 5.941 1.978 10.351 620 HA LEU 101 HA LEU 101 5.860 -0.205 8.402 621 1HB LEU 101 2HB LEU 101 6.406 -1.301 10.475 622 2HB LEU 101 1HB LEU 101 5.243 -0.357 11.358 623 HG LEU 101 HG LEU 101 4.370 -2.425 9.311 624 1HD1 LEU 101 1HD1 LEU 101 4.760 -2.735 12.266 625 2HD1 LEU 101 2HD1 LEU 101 5.745 -3.536 11.012 626 3HD1 LEU 101 3HD1 LEU 101 4.000 -3.878 11.162 627 1HD2 LEU 101 1HD2 LEU 101 2.308 -2.441 10.607 628 2HD2 LEU 101 2HD2 LEU 101 2.652 -0.806 10.047 629 3HD2 LEU 101 3HD2 LEU 101 2.968 -1.252 11.726 630 H ILE 102 H ILE 102 3.958 -0.479 7.431 631 HA ILE 102 HA ILE 102 1.627 0.733 8.607 632 HB ILE 102 HB ILE 102 2.296 2.467 7.131 633 1HG1 ILE 102 2HG1 ILE 102 0.438 2.567 5.455 634 2HG1 ILE 102 1HG1 ILE 102 0.072 0.888 5.822 635 1HG2 ILE 102 1HG2 ILE 102 2.655 2.137 4.705 636 2HG2 ILE 102 2HG2 ILE 102 2.578 0.400 4.992 637 3HG2 ILE 102 3HG2 ILE 102 3.856 1.344 5.730 638 1HD1 ILE 102 1HD1 ILE 102 -1.433 2.404 6.960 639 2HD1 ILE 102 2HD1 ILE 102 -0.068 3.195 7.753 640 3HD1 ILE 102 3HD1 ILE 102 -0.453 1.512 8.122 641 H THR 103 H THR 103 0.180 -0.668 8.740 642 HA THR 103 HA THR 103 0.080 -3.029 7.022 643 HB THR 103 HB THR 103 -1.494 -2.327 9.508 644 HG1 THR 103 1HG THR 103 0.767 -3.966 9.056 645 1HG2 THR 103 1HG2 THR 103 -2.079 -4.712 9.546 646 2HG2 THR 103 2HG2 THR 103 -1.205 -4.951 8.033 647 3HG2 THR 103 3HG2 THR 103 -2.652 -3.945 8.064 648 H PHE 104 H PHE 104 -1.266 -3.143 5.381 649 HA PHE 104 HA PHE 104 -3.506 -1.280 5.121 650 1HB PHE 104 2HB PHE 104 -2.132 -3.056 3.106 651 2HB PHE 104 1HB PHE 104 -3.414 -1.948 2.690 652 HD1 PHE 104 1HD PHE 104 -2.878 0.571 3.268 653 HD2 PHE 104 2HD PHE 104 0.033 -2.491 2.837 654 HE1 PHE 104 1HE PHE 104 -1.158 2.270 2.772 655 HE2 PHE 104 2HE PHE 104 1.739 -0.808 2.347 656 HZ PHE 104 HZ PHE 104 1.147 1.578 2.315 657 H ARG 105 H ARG 105 -5.488 -2.079 4.968 658 HA ARG 105 HA ARG 105 -5.908 -4.993 5.011 659 1HB ARG 105 2HB ARG 105 -6.298 -4.241 7.226 660 2HB ARG 105 1HB ARG 105 -7.140 -2.815 6.685 661 1HG ARG 105 2HG ARG 105 -8.531 -4.587 7.798 662 2HG ARG 105 1HG ARG 105 -9.112 -4.045 6.225 663 1HD ARG 105 2HD ARG 105 -8.522 -5.953 5.212 664 2HD ARG 105 1HD ARG 105 -7.393 -6.498 6.478 665 HE ARG 105 HE ARG 105 -9.608 -6.585 7.843 666 1HH1 ARG 105 1HH1 ARG 105 -9.543 -7.357 4.400 667 2HH1 ARG 105 2HH1 ARG 105 -10.685 -8.632 4.551 668 1HH2 ARG 105 1HH2 ARG 105 -11.137 -8.321 7.998 669 2HH2 ARG 105 2HH2 ARG 105 -11.587 -9.198 6.606 670 H VAL 106 H VAL 106 -7.066 -5.683 3.236 671 HA VAL 106 HA VAL 106 -8.335 -3.676 1.660 672 HB VAL 106 HB VAL 106 -7.139 -5.803 0.671 673 1HG1 VAL 106 1HG1 VAL 106 -8.361 -7.801 0.499 674 2HG1 VAL 106 2HG1 VAL 106 -9.543 -7.179 1.641 675 3HG1 VAL 106 3HG1 VAL 106 -7.881 -7.411 2.169 676 1HG2 VAL 106 1HG2 VAL 106 -8.591 -4.404 -0.721 677 2HG2 VAL 106 2HG2 VAL 106 -9.992 -5.312 -0.161 678 3HG2 VAL 106 3HG2 VAL 106 -8.750 -6.115 -1.124 679 H ILE 107 H ILE 107 -10.381 -3.092 1.877 680 HA ILE 107 HA ILE 107 -12.027 -4.726 3.686 681 HB ILE 107 HB ILE 107 -13.375 -2.795 4.268 682 1HG1 ILE 107 2HG1 ILE 107 -13.394 -1.642 2.028 683 2HG1 ILE 107 1HG1 ILE 107 -13.067 -0.549 3.368 684 1HG2 ILE 107 1HG2 ILE 107 -11.734 -1.345 5.319 685 2HG2 ILE 107 2HG2 ILE 107 -10.516 -1.917 4.209 686 3HG2 ILE 107 3HG2 ILE 107 -11.188 -3.036 5.422 687 1HD1 ILE 107 1HD1 ILE 107 -11.616 0.020 1.552 688 2HD1 ILE 107 2HD1 ILE 107 -11.114 -1.677 1.402 689 3HD1 ILE 107 3HD1 ILE 107 -10.666 -0.790 2.825 690 H GLU 108 H GLU 108 -11.827 -3.509 0.503 691 HA GLU 108 HA GLU 108 -14.000 -5.090 -0.422 692 1HB GLU 108 2HB GLU 108 -14.796 -2.678 0.517 693 2HB GLU 108 1HB GLU 108 -14.109 -2.130 -0.987 694 1HG GLU 108 2HG GLU 108 -16.365 -4.121 -0.732 695 2HG GLU 108 1HG GLU 108 -16.532 -2.418 -1.127 696 H GLY 109 H GLY 109 -13.761 -4.796 -2.958 697 1HA GLY 109 2HA GLY 109 -12.187 -3.386 -4.439 698 2HA GLY 109 1HA GLY 109 -10.953 -4.112 -3.436 699 H ASP 110 H ASP 110 -10.184 -4.756 -5.505 700 HA ASP 110 HA ASP 110 -11.473 -6.579 -7.231 701 1HB ASP 110 2HB ASP 110 -9.647 -5.148 -7.957 702 2HB ASP 110 1HB ASP 110 -8.560 -5.894 -6.805 703 H LEU 111 H LEU 111 -9.092 -6.996 -4.679 704 HA LEU 111 HA LEU 111 -8.720 -9.791 -5.097 705 1HB LEU 111 2HB LEU 111 -7.950 -8.062 -2.761 706 2HB LEU 111 1HB LEU 111 -7.398 -9.702 -3.020 707 HG LEU 111 HG LEU 111 -6.793 -7.357 -4.823 708 1HD1 LEU 111 1HD1 LEU 111 -4.517 -7.565 -3.969 709 2HD1 LEU 111 2HD1 LEU 111 -5.047 -8.824 -2.854 710 3HD1 LEU 111 3HD1 LEU 111 -5.659 -7.178 -2.684 711 1HD2 LEU 111 1HD2 LEU 111 -6.866 -9.465 -6.058 712 2HD2 LEU 111 2HD2 LEU 111 -5.790 -10.203 -4.874 713 3HD2 LEU 111 3HD2 LEU 111 -5.204 -8.896 -5.896 714 H MET 112 H MET 112 -10.974 -8.006 -3.226 715 HA MET 112 HA MET 112 -11.441 -9.909 -1.174 716 1HB MET 112 2HB MET 112 -13.090 -7.660 -2.201 717 2HB MET 112 1HB MET 112 -13.653 -8.699 -0.906 718 1HG MET 112 2HG MET 112 -11.019 -7.276 -0.696 719 2HG MET 112 1HG MET 112 -12.501 -6.418 -0.339 720 1HE MET 112 1HE MET 112 -11.421 -10.294 0.674 721 2HE MET 112 2HE MET 112 -10.806 -9.895 2.261 722 3HE MET 112 3HE MET 112 -9.984 -9.245 0.864 723 H LYS 113 H LYS 113 -12.344 -10.009 -4.414 724 HA LYS 113 HA LYS 113 -14.668 -11.653 -3.862 725 1HB LYS 113 2HB LYS 113 -13.489 -10.732 -6.481 726 2HB LYS 113 1HB LYS 113 -14.967 -11.670 -6.318 727 1HG LYS 113 2HG LYS 113 -14.534 -8.909 -5.180 728 2HG LYS 113 1HG LYS 113 -15.427 -9.274 -6.659 729 1HD LYS 113 2HD LYS 113 -17.053 -10.576 -5.375 730 2HD LYS 113 1HD LYS 113 -16.136 -10.300 -3.898 731 1HE LYS 113 2HE LYS 113 -18.074 -8.823 -4.031 732 2HE LYS 113 1HE LYS 113 -16.570 -7.914 -4.047 733 1HZ LYS 113 1HZ LYS 113 -18.190 -7.089 -5.645 734 2HZ LYS 113 2HZ LYS 113 -18.172 -8.558 -6.481 735 3HZ LYS 113 3HZ LYS 113 -16.793 -7.605 -6.408 736 H GLU 114 H GLU 114 -11.383 -12.013 -4.356 737 HA GLU 114 HA GLU 114 -11.741 -14.873 -4.975 738 1HB GLU 114 2HB GLU 114 -9.290 -13.149 -5.359 739 2HB GLU 114 1HB GLU 114 -9.235 -14.893 -5.443 740 1HG GLU 114 2HG GLU 114 -9.284 -14.064 -7.674 741 2HG GLU 114 1HG GLU 114 -10.854 -14.768 -7.354 742 H TYR 115 H TYR 115 -10.334 -12.618 -2.746 743 HA TYR 115 HA TYR 115 -9.559 -14.837 -0.992 744 1HB TYR 115 2HB TYR 115 -8.643 -11.947 -0.954 745 2HB TYR 115 1HB TYR 115 -8.033 -13.250 0.058 746 HD1 TYR 115 1HD TYR 115 -8.021 -11.787 -3.300 747 HD2 TYR 115 2HD TYR 115 -6.472 -14.884 -0.845 748 HE1 TYR 115 1HE TYR 115 -6.318 -12.258 -4.988 749 HE2 TYR 115 2HE TYR 115 -4.769 -15.366 -2.513 750 HH TYR 115 HH TYR 115 -4.171 -13.244 -5.139 751 H LYS 116 H LYS 116 -10.441 -14.838 1.051 752 HA LYS 116 HA LYS 116 -12.683 -13.028 1.344 753 1HB LYS 116 2HB LYS 116 -13.345 -14.478 3.267 754 2HB LYS 116 1HB LYS 116 -13.346 -15.274 1.711 755 1HG LYS 116 2HG LYS 116 -11.113 -16.232 2.319 756 2HG LYS 116 1HG LYS 116 -11.327 -15.538 3.925 757 1HD LYS 116 2HD LYS 116 -13.202 -17.475 2.590 758 2HD LYS 116 1HD LYS 116 -12.018 -17.920 3.825 759 1HE LYS 116 2HE LYS 116 -13.172 -16.408 5.415 760 2HE LYS 116 1HE LYS 116 -14.357 -16.023 4.172 761 1HZ LYS 116 1HZ LYS 116 -15.145 -17.691 5.730 762 2HZ LYS 116 2HZ LYS 116 -13.890 -18.724 5.323 763 3HZ LYS 116 3HZ LYS 116 -15.075 -18.338 4.183 764 H SER 117 H SER 117 -9.560 -13.043 2.214 765 HA SER 117 HA SER 117 -9.857 -10.693 3.716 766 1HB SER 117 2HB SER 117 -10.374 -12.260 5.453 767 2HB SER 117 1HB SER 117 -8.861 -13.146 5.186 768 HG SER 117 HG SER 117 -8.997 -11.478 6.938 769 H PHE 118 H PHE 118 -7.975 -9.549 3.654 770 HA PHE 118 HA PHE 118 -5.512 -10.810 2.919 771 1HB PHE 118 2HB PHE 118 -6.628 -10.370 0.676 772 2HB PHE 118 1HB PHE 118 -6.799 -8.709 1.156 773 HD1 PHE 118 1HD PHE 118 -4.190 -11.276 0.568 774 HD2 PHE 118 2HD PHE 118 -5.226 -7.158 0.568 775 HE1 PHE 118 1HE PHE 118 -2.023 -10.737 -0.434 776 HE2 PHE 118 2HE PHE 118 -3.060 -6.615 -0.457 777 HZ PHE 118 HZ PHE 118 -1.457 -8.400 -0.957 778 H LEU 119 H LEU 119 -4.138 -9.940 4.259 779 HA LEU 119 HA LEU 119 -4.430 -7.129 5.055 780 1HB LEU 119 2HB LEU 119 -5.132 -8.791 6.784 781 2HB LEU 119 1HB LEU 119 -3.550 -9.523 6.679 782 HG LEU 119 HG LEU 119 -2.575 -7.381 7.504 783 1HD1 LEU 119 1HD1 LEU 119 -4.077 -5.774 8.567 784 2HD1 LEU 119 2HD1 LEU 119 -5.470 -6.657 7.944 785 3HD1 LEU 119 3HD1 LEU 119 -4.350 -5.870 6.829 786 1HD2 LEU 119 1HD2 LEU 119 -3.278 -7.726 9.820 787 2HD2 LEU 119 2HD2 LEU 119 -2.984 -9.259 9.000 788 3HD2 LEU 119 3HD2 LEU 119 -4.637 -8.701 9.265 789 H LEU 120 H LEU 120 -2.476 -6.046 4.652 790 HA LEU 120 HA LEU 120 -0.092 -7.691 4.484 791 1HB LEU 120 2HB LEU 120 0.692 -6.724 2.413 792 2HB LEU 120 1HB LEU 120 -0.842 -7.507 2.158 793 HG LEU 120 HG LEU 120 -0.446 -4.511 2.372 794 1HD1 LEU 120 1HD1 LEU 120 -0.792 -4.491 -0.037 795 2HD1 LEU 120 2HD1 LEU 120 -0.863 -6.256 -0.044 796 3HD1 LEU 120 3HD1 LEU 120 0.630 -5.436 0.407 797 1HD2 LEU 120 1HD2 LEU 120 -2.705 -5.191 3.008 798 2HD2 LEU 120 2HD2 LEU 120 -2.842 -6.155 1.547 799 3HD2 LEU 120 3HD2 LEU 120 -2.734 -4.397 1.431 800 H THR 121 H THR 121 1.682 -6.785 5.154 801 HA THR 121 HA THR 121 1.460 -4.004 6.078 802 HB THR 121 HB THR 121 2.922 -6.286 7.409 803 HG1 THR 121 1HG THR 121 0.676 -6.434 7.607 804 1HG2 THR 121 1HG2 THR 121 3.983 -4.120 7.766 805 2HG2 THR 121 2HG2 THR 121 3.215 -4.680 9.252 806 3HG2 THR 121 3HG2 THR 121 2.444 -3.433 8.262 807 H ILE 122 H ILE 122 3.091 -2.679 5.471 808 HA ILE 122 HA ILE 122 5.461 -4.004 4.427 809 HB ILE 122 HB ILE 122 5.895 -2.088 2.977 810 1HG1 ILE 122 2HG1 ILE 122 3.182 -1.079 3.775 811 2HG1 ILE 122 1HG1 ILE 122 4.709 -0.376 4.302 812 1HG2 ILE 122 1HG2 ILE 122 4.681 -3.960 2.065 813 2HG2 ILE 122 2HG2 ILE 122 4.098 -2.461 1.348 814 3HG2 ILE 122 3HG2 ILE 122 3.155 -3.263 2.606 815 1HD1 ILE 122 1HD1 ILE 122 3.736 -0.533 1.447 816 2HD1 ILE 122 2HD1 ILE 122 5.254 0.180 1.986 817 3HD1 ILE 122 3HD1 ILE 122 3.723 0.905 2.472 818 H GLN 123 H GLN 123 7.329 -3.398 5.139 819 HA GLN 123 HA GLN 123 7.441 -1.157 6.995 820 1HB GLN 123 2HB GLN 123 7.153 -3.306 8.225 821 2HB GLN 123 1HB GLN 123 8.623 -3.895 7.473 822 1HG GLN 123 2HG GLN 123 9.933 -2.300 8.625 823 2HG GLN 123 1HG GLN 123 8.495 -1.471 9.229 824 1HE2 GLN 123 1HE2 GLN 123 9.019 -1.744 11.326 825 2HE2 GLN 123 2HE2 GLN 123 8.951 -3.275 12.131 826 H VAL 124 H VAL 124 8.992 0.160 6.417 827 HA VAL 124 HA VAL 124 10.937 -0.809 4.422 828 HB VAL 124 HB VAL 124 10.019 2.036 4.840 829 1HG1 VAL 124 1HG1 VAL 124 10.967 2.435 2.629 830 2HG1 VAL 124 2HG1 VAL 124 11.510 0.757 2.561 831 3HG1 VAL 124 3HG1 VAL 124 12.177 1.853 3.773 832 1HG2 VAL 124 1HG2 VAL 124 8.104 0.700 4.144 833 2HG2 VAL 124 2HG2 VAL 124 9.043 0.063 2.787 834 3HG2 VAL 124 3HG2 VAL 124 8.623 1.772 2.842 835 H THR 125 H THR 125 13.068 -0.635 4.898 836 HA THR 125 HA THR 125 13.843 1.374 6.844 837 HB THR 125 HB THR 125 13.659 -0.985 7.966 838 HG1 THR 125 1HG THR 125 15.406 -0.481 9.217 839 1HG2 THR 125 1HG2 THR 125 14.694 -2.244 6.082 840 2HG2 THR 125 2HG2 THR 125 15.577 -2.454 7.608 841 3HG2 THR 125 3HG2 THR 125 16.176 -1.320 6.391 842 HA PRO 126 HA PRO 126 17.124 2.041 3.813 843 1HB PRO 126 2HB PRO 126 19.063 2.978 5.477 844 2HB PRO 126 1HB PRO 126 17.653 3.959 5.040 845 1HG PRO 126 2HG PRO 126 17.974 2.135 7.410 846 2HG PRO 126 1HG PRO 126 17.571 3.893 7.462 847 1HD PRO 126 2HD PRO 126 15.720 2.093 7.683 848 2HD PRO 126 1HD PRO 126 15.453 3.417 6.521 849 H LYS 127 H LYS 127 17.957 0.084 3.095 850 HA LYS 127 HA LYS 127 19.471 -1.415 5.056 851 1HB LYS 127 2HB LYS 127 17.671 -2.683 4.068 852 2HB LYS 127 1HB LYS 127 18.256 -2.441 2.451 853 1HG LYS 127 2HG LYS 127 20.274 -3.762 3.055 854 2HG LYS 127 1HG LYS 127 19.558 -4.032 4.650 855 1HD LYS 127 2HD LYS 127 17.555 -4.987 3.483 856 2HD LYS 127 1HD LYS 127 18.426 -4.871 1.986 857 1HE LYS 127 2HE LYS 127 19.286 -6.507 4.386 858 2HE LYS 127 1HE LYS 127 18.610 -7.138 2.892 859 1HZ LYS 127 1HZ LYS 127 20.994 -7.379 2.944 860 2HZ LYS 127 2HZ LYS 127 21.234 -5.730 3.133 861 3HZ LYS 127 3HZ LYS 127 20.560 -6.335 1.705 862 HA PRO 128 HA PRO 128 22.870 -0.951 1.651 863 1HB PRO 128 2HB PRO 128 21.539 0.821 -0.332 864 2HB PRO 128 1HB PRO 128 22.644 -0.526 -0.619 865 1HG PRO 128 2HG PRO 128 20.044 -0.747 -1.150 866 2HG PRO 128 1HG PRO 128 20.961 -2.104 -0.474 867 1HD PRO 128 2HD PRO 128 19.045 -0.256 0.880 868 2HD PRO 128 1HD PRO 128 19.337 -2.007 1.069 869 H GLY 129 H GLY 129 20.429 1.622 1.833 870 1HA GLY 129 2HA GLY 129 20.664 3.479 3.312 871 2HA GLY 129 1HA GLY 129 22.413 3.348 3.143 872 H GLY 130 H GLY 130 20.232 5.478 2.567 873 1HA GLY 130 2HA GLY 130 20.329 7.335 1.224 874 2HA GLY 130 1HA GLY 130 21.589 6.558 0.269 875 HA PRO 131 HA PRO 131 18.285 6.028 -2.719 876 1HB PRO 131 2HB PRO 131 19.746 5.079 -4.705 877 2HB PRO 131 1HB PRO 131 19.917 6.748 -4.103 878 1HG PRO 131 2HG PRO 131 21.634 4.362 -3.491 879 2HG PRO 131 1HG PRO 131 22.143 5.981 -4.007 880 1HD PRO 131 2HD PRO 131 22.088 5.185 -1.405 881 2HD PRO 131 1HD PRO 131 21.855 6.872 -1.915 882 H GLY 132 H GLY 132 18.963 4.016 -0.736 883 1HA GLY 132 2HA GLY 132 17.749 1.739 -2.089 884 2HA GLY 132 1HA GLY 132 19.337 1.442 -1.393 885 H SER 133 H SER 133 16.019 1.578 -0.847 886 HA SER 133 HA SER 133 16.493 0.818 1.941 887 1HB SER 133 2HB SER 133 14.163 2.472 0.918 888 2HB SER 133 1HB SER 133 14.409 1.937 2.580 889 HG SER 133 HG SER 133 15.628 3.927 1.119 890 H ILE 134 H ILE 134 15.132 -0.868 2.647 891 HA ILE 134 HA ILE 134 14.041 -2.309 0.404 892 HB ILE 134 HB ILE 134 14.993 -3.299 3.076 893 1HG1 ILE 134 2HG1 ILE 134 16.639 -2.863 1.342 894 2HG1 ILE 134 1HG1 ILE 134 16.486 -4.593 1.736 895 1HG2 ILE 134 1HG2 ILE 134 14.366 -5.580 2.389 896 2HG2 ILE 134 2HG2 ILE 134 13.568 -4.919 0.959 897 3HG2 ILE 134 3HG2 ILE 134 12.946 -4.547 2.563 898 1HD1 ILE 134 1HD1 ILE 134 15.384 -3.194 -0.687 899 2HD1 ILE 134 2HD1 ILE 134 15.170 -4.901 -0.289 900 3HD1 ILE 134 3HD1 ILE 134 16.774 -4.267 -0.626 901 H VAL 135 H VAL 135 11.920 -2.617 0.323 902 HA VAL 135 HA VAL 135 10.334 -2.071 2.710 903 HB VAL 135 HB VAL 135 9.539 -0.705 0.828 904 1HG1 VAL 135 1HG1 VAL 135 9.125 -3.251 -0.669 905 2HG1 VAL 135 2HG1 VAL 135 10.330 -2.013 -1.028 906 3HG1 VAL 135 3HG1 VAL 135 8.610 -1.652 -1.204 907 1HG2 VAL 135 1HG2 VAL 135 7.614 -2.950 1.378 908 2HG2 VAL 135 2HG2 VAL 135 7.191 -1.364 0.736 909 3HG2 VAL 135 3HG2 VAL 135 7.841 -1.508 2.370 910 H HIS 136 H HIS 136 9.790 -3.676 3.848 911 HA HIS 136 HA HIS 136 9.870 -6.347 2.714 912 1HB HIS 136 2HB HIS 136 9.516 -5.399 5.567 913 2HB HIS 136 1HB HIS 136 9.590 -7.091 5.092 914 HD1 HIS 136 1HD HIS 136 11.975 -7.988 4.372 915 HD2 HIS 136 2HD HIS 136 11.923 -4.071 5.777 916 HE1 HIS 136 1HE HIS 136 14.357 -7.412 4.867 917 HE2 HIS 136 2HE HIS 136 14.230 -5.215 6.026 918 H TRP 137 H TRP 137 8.085 -7.056 1.803 919 HA TRP 137 HA TRP 137 5.501 -6.034 2.648 920 1HB TRP 137 2HB TRP 137 6.310 -7.790 0.315 921 2HB TRP 137 1HB TRP 137 4.676 -7.316 0.697 922 HD1 TRP 137 HD TRP 137 8.022 -5.566 -0.367 923 HE1 TRP 137 1HE TRP 137 7.370 -3.484 -1.683 924 HE3 TRP 137 3HE TRP 137 2.942 -5.791 0.201 925 HZ2 TRP 137 2HZ TRP 137 5.041 -2.080 -2.380 926 HZ3 TRP 137 3HZ TRP 137 1.577 -4.025 -0.819 927 HH2 TRP 137 HH TRP 137 2.591 -2.220 -2.072 928 H HIS 138 H HIS 138 4.342 -7.133 4.041 929 HA HIS 138 HA HIS 138 4.785 -10.047 4.237 930 1HB HIS 138 2HB HIS 138 3.749 -8.209 6.421 931 2HB HIS 138 1HB HIS 138 4.162 -9.901 6.603 932 HD1 HIS 138 1HD HIS 138 6.801 -10.469 6.724 933 HD2 HIS 138 2HD HIS 138 5.788 -6.440 6.592 934 HE1 HIS 138 1HE HIS 138 8.841 -9.260 7.411 935 HE2 HIS 138 2HE HIS 138 8.158 -6.868 7.593 936 H LEU 139 H LEU 139 3.090 -11.010 3.229 937 HA LEU 139 HA LEU 139 0.496 -9.654 3.313 938 1HB LEU 139 2HB LEU 139 1.529 -11.672 1.303 939 2HB LEU 139 1HB LEU 139 -0.050 -10.942 1.277 940 HG LEU 139 HG LEU 139 1.133 -8.704 0.859 941 1HD1 LEU 139 1HD1 LEU 139 3.338 -9.257 1.616 942 2HD1 LEU 139 2HD1 LEU 139 3.350 -8.765 -0.081 943 3HD1 LEU 139 3HD1 LEU 139 3.488 -10.473 0.342 944 1HD2 LEU 139 1HD2 LEU 139 1.463 -10.884 -1.188 945 2HD2 LEU 139 2HD2 LEU 139 1.442 -9.154 -1.515 946 3HD2 LEU 139 3HD2 LEU 139 -0.005 -9.956 -0.900 947 H GLU 140 H GLU 140 -1.022 -10.630 4.439 948 HA GLU 140 HA GLU 140 -0.869 -13.530 4.865 949 1HB GLU 140 2HB GLU 140 -1.688 -11.396 6.848 950 2HB GLU 140 1HB GLU 140 -1.800 -13.132 7.116 951 1HG GLU 140 2HG GLU 140 0.561 -13.357 6.973 952 2HG GLU 140 1HG GLU 140 0.749 -11.650 6.576 953 H TYR 141 H TYR 141 -2.714 -14.520 4.324 954 HA TYR 141 HA TYR 141 -5.160 -13.010 4.127 955 1HB TYR 141 2HB TYR 141 -5.394 -13.374 1.659 956 2HB TYR 141 1HB TYR 141 -4.153 -12.233 2.179 957 HD1 TYR 141 1HD TYR 141 -1.758 -12.951 2.154 958 HD2 TYR 141 2HD TYR 141 -4.827 -15.204 0.336 959 HE1 TYR 141 1HE TYR 141 -0.065 -14.125 0.858 960 HE2 TYR 141 2HE TYR 141 -3.143 -16.421 -1.004 961 HH TYR 141 HH TYR 141 0.122 -16.349 -0.349 962 H GLU 142 H GLU 142 -6.928 -14.275 3.132 963 HA GLU 142 HA GLU 142 -6.605 -17.081 3.905 964 1HB GLU 142 2HB GLU 142 -7.653 -15.730 5.693 965 2HB GLU 142 1HB GLU 142 -8.930 -15.280 4.580 966 1HG GLU 142 2HG GLU 142 -9.689 -17.543 4.468 967 2HG GLU 142 1HG GLU 142 -8.340 -18.093 5.475 968 H LYS 143 H LYS 143 -7.371 -18.487 2.518 969 HA LYS 143 HA LYS 143 -8.385 -17.584 -0.017 970 1HB LYS 143 2HB LYS 143 -7.634 -20.311 1.027 971 2HB LYS 143 1HB LYS 143 -8.393 -20.091 -0.528 972 1HG LYS 143 2HG LYS 143 -6.031 -20.390 -0.818 973 2HG LYS 143 1HG LYS 143 -6.455 -18.743 -1.239 974 1HD LYS 143 2HD LYS 143 -5.590 -17.953 0.863 975 2HD LYS 143 1HD LYS 143 -5.217 -19.615 1.371 976 1HE LYS 143 2HE LYS 143 -4.075 -18.154 -1.003 977 2HE LYS 143 1HE LYS 143 -3.221 -18.433 0.517 978 1HZ LYS 143 1HZ LYS 143 -2.508 -20.016 -1.091 979 2HZ LYS 143 2HZ LYS 143 -4.050 -20.484 -1.500 980 3HZ LYS 143 3HZ LYS 143 -3.422 -20.854 0.021 981 H ILE 144 H ILE 144 -10.410 -17.748 -0.787 982 HA ILE 144 HA ILE 144 -12.572 -18.736 0.847 983 HB ILE 144 HB ILE 144 -12.502 -18.088 -2.125 984 1HG1 ILE 144 2HG1 ILE 144 -13.409 -16.396 0.174 985 2HG1 ILE 144 1HG1 ILE 144 -11.887 -16.172 -0.689 986 1HG2 ILE 144 1HG2 ILE 144 -14.849 -18.374 -0.249 987 2HG2 ILE 144 2HG2 ILE 144 -14.406 -19.492 -1.540 988 3HG2 ILE 144 3HG2 ILE 144 -14.939 -17.856 -1.933 989 1HD1 ILE 144 1HD1 ILE 144 -13.528 -14.581 -1.420 990 2HD1 ILE 144 2HD1 ILE 144 -14.660 -15.889 -1.785 991 3HD1 ILE 144 3HD1 ILE 144 -13.176 -15.730 -2.727 992 H SER 145 H SER 145 -10.652 -19.674 -1.850 993 HA SER 145 HA SER 145 -10.931 -22.452 -1.357 994 1HB SER 145 2HB SER 145 -12.794 -22.073 -2.933 995 2HB SER 145 1HB SER 145 -11.727 -21.186 -4.013 996 HG SER 145 HG SER 145 -12.149 -23.446 -4.516 997 H GLU 146 H GLU 146 -9.274 -23.490 -2.719 998 HA GLU 146 HA GLU 146 -6.828 -22.032 -2.656 999 1HB GLU 146 2HB GLU 146 -7.609 -24.524 -3.968 1000 2HB GLU 146 1HB GLU 146 -5.933 -24.043 -3.702 1001 1HG GLU 146 2HG GLU 146 -6.365 -24.116 -1.233 1002 2HG GLU 146 1HG GLU 146 -7.983 -24.724 -1.571 1003 H GLU 147 H GLU 147 -9.047 -23.231 -5.036 1004 HA GLU 147 HA GLU 147 -7.605 -22.846 -7.412 1005 1HB GLU 147 2HB GLU 147 -10.573 -22.886 -6.966 1006 2HB GLU 147 1HB GLU 147 -9.742 -23.187 -8.484 1007 1HG GLU 147 2HG GLU 147 -8.722 -25.171 -7.555 1008 2HG GLU 147 1HG GLU 147 -9.491 -24.859 -5.999 1009 H VAL 148 H VAL 148 -9.326 -20.777 -5.443 1010 HA VAL 148 HA VAL 148 -9.791 -18.848 -7.635 1011 HB VAL 148 HB VAL 148 -11.718 -19.318 -6.082 1012 1HG1 VAL 148 1HG1 VAL 148 -11.811 -18.327 -3.921 1013 2HG1 VAL 148 2HG1 VAL 148 -10.128 -17.817 -4.053 1014 3HG1 VAL 148 3HG1 VAL 148 -10.530 -19.537 -4.015 1015 1HG2 VAL 148 1HG2 VAL 148 -10.805 -16.459 -6.132 1016 2HG2 VAL 148 2HG2 VAL 148 -12.457 -17.003 -5.831 1017 3HG2 VAL 148 3HG2 VAL 148 -11.704 -17.277 -7.408 1018 H ALA 149 H ALA 149 -7.729 -19.312 -4.975 1019 HA ALA 149 HA ALA 149 -6.897 -16.529 -4.913 1020 1HB ALA 149 1HB ALA 149 -7.166 -17.665 -2.805 1021 2HB ALA 149 2HB ALA 149 -5.459 -17.262 -3.080 1022 3HB ALA 149 3HB ALA 149 -6.029 -18.912 -3.320 1023 H HIS 150 H HIS 150 -5.179 -15.834 -5.983 1024 HA HIS 150 HA HIS 150 -3.244 -17.826 -6.862 1025 1HB HIS 150 2HB HIS 150 -4.404 -15.700 -8.693 1026 2HB HIS 150 1HB HIS 150 -3.069 -16.765 -9.094 1027 HD1 HIS 150 1HD HIS 150 -3.696 -19.344 -9.479 1028 HD2 HIS 150 2HD HIS 150 -6.944 -16.788 -9.003 1029 HE1 HIS 150 1HE HIS 150 -5.680 -20.615 -10.282 1030 HE2 HIS 150 2HE HIS 150 -7.606 -19.216 -9.560 1031 HA PRO 151 HA PRO 151 -0.981 -14.727 -4.404 1032 1HB PRO 151 2HB PRO 151 1.058 -16.807 -5.083 1033 2HB PRO 151 1HB PRO 151 0.772 -15.985 -3.544 1034 1HG PRO 151 2HG PRO 151 -0.086 -18.454 -3.876 1035 2HG PRO 151 1HG PRO 151 -1.121 -17.259 -3.073 1036 1HD PRO 151 2HD PRO 151 -1.327 -18.378 -5.838 1037 2HD PRO 151 1HD PRO 151 -2.601 -17.914 -4.702 1038 H GLU 152 H GLU 152 -0.454 -15.858 -7.569 1039 HA GLU 152 HA GLU 152 1.826 -14.496 -8.486 1040 1HB GLU 152 2HB GLU 152 -0.751 -14.794 -10.024 1041 2HB GLU 152 1HB GLU 152 0.877 -14.681 -10.668 1042 1HG GLU 152 2HG GLU 152 -0.285 -16.936 -9.094 1043 2HG GLU 152 1HG GLU 152 -0.000 -16.908 -10.828 1044 H THR 153 H THR 153 -1.536 -13.555 -8.202 1045 HA THR 153 HA THR 153 -1.397 -11.039 -9.470 1046 HB THR 153 HB THR 153 -3.663 -10.722 -8.579 1047 HG1 THR 153 1HG THR 153 -3.523 -13.163 -7.188 1048 1HG2 THR 153 1HG2 THR 153 -3.385 -12.299 -10.461 1049 2HG2 THR 153 2HG2 THR 153 -4.702 -12.799 -9.395 1050 3HG2 THR 153 3HG2 THR 153 -3.142 -13.615 -9.310 1051 H LEU 154 H LEU 154 -0.908 -12.158 -6.242 1052 HA LEU 154 HA LEU 154 -1.104 -9.639 -4.932 1053 1HB LEU 154 2HB LEU 154 0.208 -12.177 -3.999 1054 2HB LEU 154 1HB LEU 154 -0.275 -10.824 -2.995 1055 HG LEU 154 HG LEU 154 -2.125 -12.663 -4.502 1056 1HD1 LEU 154 1HD1 LEU 154 -2.833 -13.364 -2.288 1057 2HD1 LEU 154 2HD1 LEU 154 -1.584 -12.335 -1.578 1058 3HD1 LEU 154 3HD1 LEU 154 -1.130 -13.702 -2.578 1059 1HD2 LEU 154 1HD2 LEU 154 -3.050 -10.408 -4.427 1060 2HD2 LEU 154 2HD2 LEU 154 -2.760 -10.345 -2.687 1061 3HD2 LEU 154 3HD2 LEU 154 -3.931 -11.484 -3.340 1062 H LEU 155 H LEU 155 1.559 -11.687 -6.050 1063 HA LEU 155 HA LEU 155 3.606 -9.951 -5.240 1064 1HB LEU 155 2HB LEU 155 3.533 -11.957 -7.470 1065 2HB LEU 155 1HB LEU 155 4.962 -11.020 -7.082 1066 HG LEU 155 HG LEU 155 3.595 -12.995 -5.258 1067 1HD1 LEU 155 1HD1 LEU 155 6.225 -13.048 -6.689 1068 2HD1 LEU 155 2HD1 LEU 155 4.807 -14.027 -7.101 1069 3HD1 LEU 155 3HD1 LEU 155 5.649 -14.271 -5.558 1070 1HD2 LEU 155 1HD2 LEU 155 6.083 -11.331 -4.867 1071 2HD2 LEU 155 2HD2 LEU 155 5.561 -12.633 -3.811 1072 3HD2 LEU 155 3HD2 LEU 155 4.575 -11.180 -3.957 1073 H GLN 156 H GLN 156 1.705 -10.094 -8.174 1074 HA GLN 156 HA GLN 156 3.126 -7.958 -9.328 1075 1HB GLN 156 2HB GLN 156 0.372 -8.981 -9.954 1076 2HB GLN 156 1HB GLN 156 1.183 -7.728 -10.883 1077 1HG GLN 156 2HG GLN 156 3.063 -9.353 -11.235 1078 2HG GLN 156 1HG GLN 156 2.018 -10.584 -10.532 1079 1HE2 GLN 156 1HE2 GLN 156 2.550 -8.460 -13.150 1080 2HE2 GLN 156 2HE2 GLN 156 1.477 -9.198 -14.283 1081 H PHE 157 H PHE 157 0.254 -8.034 -7.318 1082 HA PHE 157 HA PHE 157 -0.408 -5.321 -7.475 1083 1HB PHE 157 2HB PHE 157 -1.923 -6.945 -6.435 1084 2HB PHE 157 1HB PHE 157 -0.765 -7.236 -5.146 1085 HD1 PHE 157 1HD PHE 157 -0.970 -6.047 -3.136 1086 HD2 PHE 157 2HD PHE 157 -2.793 -4.507 -6.665 1087 HE1 PHE 157 1HE PHE 157 -2.047 -4.247 -1.801 1088 HE2 PHE 157 2HE PHE 157 -3.855 -2.729 -5.343 1089 HZ PHE 157 HZ PHE 157 -3.479 -2.603 -2.912 1090 H CYS 158 H CYS 158 1.924 -6.969 -5.332 1091 HA CYS 158 HA CYS 158 2.505 -4.566 -3.974 1092 1HB CYS 158 2HB CYS 158 4.478 -5.686 -3.018 1093 2HB CYS 158 1HB CYS 158 3.054 -6.701 -2.907 1094 HG CYS 158 HG CYS 158 4.336 -7.721 -5.610 1095 H VAL 159 H VAL 159 3.698 -5.944 -6.934 1096 HA VAL 159 HA VAL 159 5.891 -4.170 -7.268 1097 HB VAL 159 HB VAL 159 4.222 -5.542 -9.412 1098 1HG1 VAL 159 1HG1 VAL 159 6.995 -4.365 -9.610 1099 2HG1 VAL 159 2HG1 VAL 159 5.526 -3.631 -10.230 1100 3HG1 VAL 159 3HG1 VAL 159 6.093 -5.162 -10.915 1101 1HG2 VAL 159 1HG2 VAL 159 6.833 -6.392 -8.165 1102 2HG2 VAL 159 2HG2 VAL 159 6.007 -7.199 -9.501 1103 3HG2 VAL 159 3HG2 VAL 159 5.255 -7.145 -7.908 1104 H GLU 160 H GLU 160 2.511 -4.116 -8.397 1105 HA GLU 160 HA GLU 160 2.445 -1.707 -9.729 1106 1HB GLU 160 2HB GLU 160 0.392 -3.253 -8.235 1107 2HB GLU 160 1HB GLU 160 0.007 -1.596 -8.639 1108 1HG GLU 160 2HG GLU 160 -0.889 -3.138 -10.282 1109 2HG GLU 160 1HG GLU 160 0.305 -2.075 -10.991 1110 H VAL 161 H VAL 161 1.975 -2.205 -6.275 1111 HA VAL 161 HA VAL 161 1.611 0.549 -5.713 1112 HB VAL 161 HB VAL 161 2.524 -1.657 -3.875 1113 1HG1 VAL 161 1HG1 VAL 161 1.725 -0.178 -2.033 1114 2HG1 VAL 161 2HG1 VAL 161 1.395 1.083 -3.221 1115 3HG1 VAL 161 3HG1 VAL 161 3.054 0.551 -2.939 1116 1HG2 VAL 161 1HG2 VAL 161 0.352 -2.129 -4.844 1117 2HG2 VAL 161 2HG2 VAL 161 -0.235 -0.538 -4.367 1118 3HG2 VAL 161 3HG2 VAL 161 0.170 -1.731 -3.134 1119 H SER 162 H SER 162 4.475 -1.584 -5.636 1120 HA SER 162 HA SER 162 6.357 0.221 -4.602 1121 1HB SER 162 2HB SER 162 6.731 -2.009 -6.604 1122 2HB SER 162 1HB SER 162 8.022 -1.196 -5.718 1123 HG SER 162 HG SER 162 5.963 -2.862 -4.729 1124 H LYS 163 H LYS 163 5.092 -0.149 -7.854 1125 HA LYS 163 HA LYS 163 6.916 1.458 -9.245 1126 1HB LYS 163 2HB LYS 163 3.950 1.178 -9.719 1127 2HB LYS 163 1HB LYS 163 5.100 1.847 -10.866 1128 1HG LYS 163 2HG LYS 163 6.195 -0.284 -11.049 1129 2HG LYS 163 1HG LYS 163 5.121 -0.973 -9.829 1130 1HD LYS 163 2HD LYS 163 3.203 -0.533 -11.292 1131 2HD LYS 163 1HD LYS 163 4.291 0.150 -12.496 1132 1HE LYS 163 2HE LYS 163 4.347 -2.684 -11.482 1133 2HE LYS 163 1HE LYS 163 3.692 -2.170 -13.025 1134 1HZ LYS 163 1HZ LYS 163 5.874 -1.406 -13.683 1135 2HZ LYS 163 2HZ LYS 163 5.941 -3.012 -13.296 1136 3HZ LYS 163 3HZ LYS 163 6.548 -1.880 -12.212 1137 H GLU 164 H GLU 164 3.818 2.357 -7.792 1138 HA GLU 164 HA GLU 164 4.046 5.110 -8.386 1139 1HB GLU 164 2HB GLU 164 1.884 4.056 -7.884 1140 2HB GLU 164 1HB GLU 164 2.511 3.690 -6.270 1141 1HG GLU 164 2HG GLU 164 0.914 5.609 -6.315 1142 2HG GLU 164 1HG GLU 164 2.487 5.967 -5.617 1143 H ILE 165 H ILE 165 4.590 3.253 -5.423 1144 HA ILE 165 HA ILE 165 5.048 5.571 -3.954 1145 HB ILE 165 HB ILE 165 4.259 3.512 -2.920 1146 1HG1 ILE 165 2HG1 ILE 165 5.602 3.597 -0.856 1147 2HG1 ILE 165 1HG1 ILE 165 6.844 4.497 -1.731 1148 1HG2 ILE 165 1HG2 ILE 165 5.814 1.687 -2.318 1149 2HG2 ILE 165 2HG2 ILE 165 7.055 2.462 -3.316 1150 3HG2 ILE 165 3HG2 ILE 165 5.557 1.878 -4.053 1151 1HD1 ILE 165 1HD1 ILE 165 4.014 5.396 -1.315 1152 2HD1 ILE 165 2HD1 ILE 165 5.316 6.252 -2.159 1153 3HD1 ILE 165 3HD1 ILE 165 5.435 5.974 -0.418 1154 H ASP 166 H ASP 166 7.258 3.348 -5.371 1155 HA ASP 166 HA ASP 166 9.651 4.490 -4.281 1156 1HB ASP 166 2HB ASP 166 9.759 2.240 -5.116 1157 2HB ASP 166 1HB ASP 166 9.176 2.738 -6.690 1158 H GLU 167 H GLU 167 8.192 4.862 -7.480 1159 HA GLU 167 HA GLU 167 10.073 6.827 -8.218 1160 1HB GLU 167 2HB GLU 167 7.408 6.143 -9.466 1161 2HB GLU 167 1HB GLU 167 8.554 7.278 -10.169 1162 1HG GLU 167 2HG GLU 167 10.231 5.480 -10.303 1163 2HG GLU 167 1HG GLU 167 9.058 4.352 -9.641 1164 H HIS 168 H HIS 168 7.030 6.976 -6.578 1165 HA HIS 168 HA HIS 168 6.456 9.723 -6.832 1166 1HB HIS 168 2HB HIS 168 4.986 7.868 -5.858 1167 2HB HIS 168 1HB HIS 168 5.919 8.037 -4.382 1168 HD1 HIS 168 1HD HIS 168 3.031 9.206 -6.070 1169 HD2 HIS 168 2HD HIS 168 5.644 10.774 -3.266 1170 HE1 HIS 168 1HE HIS 168 1.814 11.164 -5.022 1171 HE2 HIS 168 2HE HIS 168 3.722 12.313 -3.837 1172 H LEU 169 H LEU 169 8.409 7.901 -4.464 1173 HA LEU 169 HA LEU 169 9.100 10.102 -2.889 1174 1HB LEU 169 2HB LEU 169 10.148 7.335 -3.194 1175 2HB LEU 169 1HB LEU 169 11.134 8.498 -2.343 1176 HG LEU 169 HG LEU 169 9.404 8.813 -0.702 1177 1HD1 LEU 169 1HD1 LEU 169 7.414 7.442 -0.602 1178 2HD1 LEU 169 2HD1 LEU 169 7.803 6.785 -2.192 1179 3HD1 LEU 169 3HD1 LEU 169 7.429 8.498 -2.012 1180 1HD2 LEU 169 1HD2 LEU 169 10.024 5.916 -1.161 1181 2HD2 LEU 169 2HD2 LEU 169 9.452 6.608 0.355 1182 3HD2 LEU 169 3HD2 LEU 169 11.023 7.081 -0.292 1183 H LEU 170 H LEU 170 10.472 8.848 -5.792 1184 HA LEU 170 HA LEU 170 12.791 10.557 -5.564 1185 1HB LEU 170 2HB LEU 170 11.797 8.898 -7.857 1186 2HB LEU 170 1HB LEU 170 13.354 9.700 -7.786 1187 HG LEU 170 HG LEU 170 12.432 7.489 -5.967 1188 1HD1 LEU 170 1HD1 LEU 170 12.868 6.737 -8.204 1189 2HD1 LEU 170 2HD1 LEU 170 14.131 6.177 -7.101 1190 3HD1 LEU 170 3HD1 LEU 170 14.443 7.532 -8.194 1191 1HD2 LEU 170 1HD2 LEU 170 14.758 7.502 -5.152 1192 2HD2 LEU 170 2HD2 LEU 170 13.926 9.011 -4.793 1193 3HD2 LEU 170 3HD2 LEU 170 15.084 8.934 -6.123 1194 H ALA 171 H ALA 171 9.665 10.763 -6.701 1195 HA ALA 171 HA ALA 171 10.050 12.858 -8.628 1196 1HB ALA 171 1HB ALA 171 7.595 12.922 -8.689 1197 2HB ALA 171 2HB ALA 171 7.576 11.820 -7.302 1198 3HB ALA 171 3HB ALA 171 8.220 11.270 -8.845 1199 H GLU 172 H GLU 172 8.829 12.662 -5.287 1200 HA GLU 172 HA GLU 172 8.792 15.585 -5.305 1201 1HB GLU 172 2HB GLU 172 7.237 13.738 -3.498 1202 2HB GLU 172 1HB GLU 172 7.148 15.497 -3.501 1203 1HG GLU 172 2HG GLU 172 6.434 15.393 -5.859 1204 2HG GLU 172 1HG GLU 172 6.340 13.641 -5.717 1205 H GLU 173 H GLU 173 9.058 16.556 -3.094 1206 HA GLU 173 HA GLU 173 11.119 15.238 -1.548 1207 1HB GLU 173 2HB GLU 173 12.348 16.486 -3.243 1208 2HB GLU 173 1HB GLU 173 11.454 17.945 -2.847 1209 1HG GLU 173 2HG GLU 173 12.443 17.974 -0.635 1210 2HG GLU 173 1HG GLU 173 13.292 16.473 -0.991 Start of MODEL 13 1 H THR 17 H THR 17 -14.927 -27.802 1.589 2 HA THR 17 HA THR 17 -16.575 -28.480 3.859 3 HB THR 17 HB THR 17 -15.233 -30.144 2.549 4 HG1 THR 17 1HG THR 17 -14.827 -29.949 5.362 5 1HG2 THR 17 1HG2 THR 17 -12.822 -30.388 3.057 6 2HG2 THR 17 2HG2 THR 17 -12.885 -28.880 3.974 7 3HG2 THR 17 3HG2 THR 17 -13.182 -28.871 2.234 8 H GLU 18 H GLU 18 -14.136 -26.198 3.198 9 HA GLU 18 HA GLU 18 -12.973 -24.701 4.377 10 1HB GLU 18 2HB GLU 18 -14.705 -25.557 6.685 11 2HB GLU 18 1HB GLU 18 -13.549 -24.232 6.720 12 1HG GLU 18 2HG GLU 18 -14.826 -23.052 5.007 13 2HG GLU 18 1HG GLU 18 -15.960 -24.397 4.918 14 H ALA 19 H ALA 19 -11.099 -24.529 5.615 15 HA ALA 19 HA ALA 19 -10.248 -26.709 7.243 16 1HB ALA 19 1HB ALA 19 -9.873 -27.624 5.022 17 2HB ALA 19 2HB ALA 19 -8.333 -27.332 5.848 18 3HB ALA 19 3HB ALA 19 -8.901 -26.219 4.592 19 H SER 20 H SER 20 -8.670 -26.034 8.591 20 HA SER 20 HA SER 20 -8.221 -23.304 8.918 21 1HB SER 20 2HB SER 20 -6.506 -24.084 10.597 22 2HB SER 20 1HB SER 20 -8.122 -24.751 10.810 23 HG SER 20 HG SER 20 -7.419 -26.643 10.399 24 H SER 21 H SER 21 -6.484 -25.692 7.122 25 HA SER 21 HA SER 21 -4.072 -24.249 6.885 26 1HB SER 21 2HB SER 21 -5.095 -26.512 5.189 27 2HB SER 21 1HB SER 21 -3.430 -25.905 5.304 28 HG SER 21 HG SER 21 -3.809 -26.307 7.682 29 H LEU 22 H LEU 22 -7.043 -23.575 5.536 30 HA LEU 22 HA LEU 22 -6.175 -22.683 2.975 31 1HB LEU 22 2HB LEU 22 -8.618 -21.964 4.593 32 2HB LEU 22 1HB LEU 22 -8.339 -21.397 2.958 33 HG LEU 22 HG LEU 22 -8.703 -24.285 3.781 34 1HD1 LEU 22 1HD1 LEU 22 -10.830 -24.124 2.597 35 2HD1 LEU 22 2HD1 LEU 22 -10.549 -22.405 2.318 36 3HD1 LEU 22 3HD1 LEU 22 -10.768 -23.016 3.963 37 1HD2 LEU 22 1HD2 LEU 22 -8.811 -24.719 1.369 38 2HD2 LEU 22 2HD2 LEU 22 -7.242 -24.074 1.839 39 3HD2 LEU 22 3HD2 LEU 22 -8.427 -23.032 1.049 40 H VAL 23 H VAL 23 -5.466 -21.575 5.983 41 HA VAL 23 HA VAL 23 -5.346 -18.795 5.552 42 HB VAL 23 HB VAL 23 -5.103 -19.813 7.813 43 1HG1 VAL 23 1HG1 VAL 23 -2.431 -20.767 6.833 44 2HG1 VAL 23 2HG1 VAL 23 -3.811 -21.786 7.226 45 3HG1 VAL 23 3HG1 VAL 23 -2.993 -20.871 8.502 46 1HG2 VAL 23 1HG2 VAL 23 -2.691 -18.203 6.974 47 2HG2 VAL 23 2HG2 VAL 23 -3.240 -18.428 8.634 48 3HG2 VAL 23 3HG2 VAL 23 -4.252 -17.553 7.482 49 H GLY 24 H GLY 24 -3.768 -17.550 4.563 50 1HA GLY 24 2HA GLY 24 -1.482 -18.958 3.460 51 2HA GLY 24 1HA GLY 24 -2.590 -18.152 2.360 52 H LYS 25 H LYS 25 0.251 -17.677 3.135 53 HA LYS 25 HA LYS 25 -0.114 -14.831 3.275 54 1HB LYS 25 2HB LYS 25 1.745 -14.608 4.918 55 2HB LYS 25 1HB LYS 25 0.240 -15.212 5.570 56 1HG LYS 25 2HG LYS 25 1.029 -17.386 5.705 57 2HG LYS 25 1HG LYS 25 2.510 -17.026 4.793 58 1HD LYS 25 2HD LYS 25 1.785 -15.719 7.411 59 2HD LYS 25 1HD LYS 25 2.786 -17.170 7.326 60 1HE LYS 25 2HE LYS 25 3.509 -14.749 5.714 61 2HE LYS 25 1HE LYS 25 3.987 -14.832 7.434 62 1HZ LYS 25 1HZ LYS 25 4.683 -16.706 5.227 63 2HZ LYS 25 2HZ LYS 25 5.152 -16.882 6.828 64 3HZ LYS 25 3HZ LYS 25 5.703 -15.552 5.948 65 H LEU 26 H LEU 26 1.702 -13.676 2.558 66 HA LEU 26 HA LEU 26 3.788 -15.260 1.457 67 1HB LEU 26 2HB LEU 26 2.065 -15.234 -0.315 68 2HB LEU 26 1HB LEU 26 2.041 -13.485 -0.265 69 HG LEU 26 HG LEU 26 4.346 -13.434 -1.127 70 1HD1 LEU 26 1HD1 LEU 26 5.131 -15.543 -0.214 71 2HD1 LEU 26 2HD1 LEU 26 5.362 -15.498 -1.962 72 3HD1 LEU 26 3HD1 LEU 26 4.027 -16.422 -1.270 73 1HD2 LEU 26 1HD2 LEU 26 3.827 -14.212 -3.384 74 2HD2 LEU 26 2HD2 LEU 26 2.460 -13.348 -2.678 75 3HD2 LEU 26 3HD2 LEU 26 2.443 -15.109 -2.761 76 H GLU 27 H GLU 27 5.655 -14.067 1.249 77 HA GLU 27 HA GLU 27 5.431 -11.261 1.993 78 1HB GLU 27 2HB GLU 27 7.375 -13.250 3.174 79 2HB GLU 27 1HB GLU 27 7.312 -11.531 3.530 80 1HG GLU 27 2HG GLU 27 5.113 -11.763 4.513 81 2HG GLU 27 1HG GLU 27 5.071 -13.464 4.069 82 H THR 28 H THR 28 6.961 -9.965 1.119 83 HA THR 28 HA THR 28 9.099 -11.078 -0.424 84 HB THR 28 HB THR 28 7.160 -11.102 -2.024 85 HG1 THR 28 1HG THR 28 8.257 -9.384 -3.507 86 1HG2 THR 28 1HG2 THR 28 5.858 -9.238 -1.094 87 2HG2 THR 28 2HG2 THR 28 6.192 -8.969 -2.803 88 3HG2 THR 28 3HG2 THR 28 7.118 -8.102 -1.578 89 H ASP 29 H ASP 29 10.430 -9.203 -1.198 90 HA ASP 29 HA ASP 29 9.819 -6.773 0.210 91 1HB ASP 29 2HB ASP 29 12.106 -6.498 1.039 92 2HB ASP 29 1HB ASP 29 11.399 -7.962 1.686 93 H VAL 30 H VAL 30 10.167 -5.078 -0.896 94 HA VAL 30 HA VAL 30 11.322 -5.413 -3.578 95 HB VAL 30 HB VAL 30 9.119 -3.523 -2.661 96 1HG1 VAL 30 1HG1 VAL 30 10.465 -2.516 -4.421 97 2HG1 VAL 30 2HG1 VAL 30 8.854 -2.921 -4.997 98 3HG1 VAL 30 3HG1 VAL 30 10.228 -3.940 -5.440 99 1HG2 VAL 30 1HG2 VAL 30 8.977 -5.946 -4.445 100 2HG2 VAL 30 2HG2 VAL 30 7.644 -4.833 -4.110 101 3HG2 VAL 30 3HG2 VAL 30 8.323 -5.815 -2.810 102 H GLU 31 H GLU 31 12.717 -3.818 -4.254 103 HA GLU 31 HA GLU 31 13.704 -2.164 -2.079 104 1HB GLU 31 2HB GLU 31 15.085 -2.279 -4.762 105 2HB GLU 31 1HB GLU 31 15.642 -1.901 -3.128 106 1HG GLU 31 2HG GLU 31 16.652 -3.971 -3.812 107 2HG GLU 31 1HG GLU 31 15.499 -4.280 -2.524 108 H ILE 32 H ILE 32 13.379 -0.073 -2.071 109 HA ILE 32 HA ILE 32 12.311 1.213 -4.498 110 HB ILE 32 HB ILE 32 11.498 3.024 -3.025 111 1HG1 ILE 32 2HG1 ILE 32 12.465 1.288 -0.726 112 2HG1 ILE 32 1HG1 ILE 32 13.173 2.817 -1.229 113 1HG2 ILE 32 1HG2 ILE 32 9.953 1.242 -3.545 114 2HG2 ILE 32 2HG2 ILE 32 9.675 1.812 -1.900 115 3HG2 ILE 32 3HG2 ILE 32 10.537 0.300 -2.174 116 1HD1 ILE 32 1HD1 ILE 32 11.793 3.092 0.751 117 2HD1 ILE 32 2HD1 ILE 32 10.401 2.433 -0.107 118 3HD1 ILE 32 3HD1 ILE 32 11.099 3.969 -0.613 119 H LYS 33 H LYS 33 13.208 3.177 -5.130 120 HA LYS 33 HA LYS 33 16.045 3.249 -4.485 121 1HB LYS 33 2HB LYS 33 16.237 4.734 -6.458 122 2HB LYS 33 1HB LYS 33 15.510 3.178 -6.824 123 1HG LYS 33 2HG LYS 33 13.321 4.189 -6.825 124 2HG LYS 33 1HG LYS 33 14.018 5.751 -6.437 125 1HD LYS 33 2HD LYS 33 15.344 5.599 -8.534 126 2HD LYS 33 1HD LYS 33 14.482 4.108 -8.913 127 1HE LYS 33 2HE LYS 33 12.347 5.332 -8.857 128 2HE LYS 33 1HE LYS 33 13.216 6.817 -8.496 129 1HZ LYS 33 1HZ LYS 33 13.319 5.230 -10.983 130 2HZ LYS 33 2HZ LYS 33 14.385 6.505 -10.666 131 3HZ LYS 33 3HZ LYS 33 12.716 6.789 -10.767 132 H ALA 34 H ALA 34 13.523 4.389 -3.144 133 HA ALA 34 HA ALA 34 14.399 7.116 -2.662 134 1HB ALA 34 1HB ALA 34 12.004 5.614 -1.630 135 2HB ALA 34 2HB ALA 34 12.009 6.705 -3.013 136 3HB ALA 34 3HB ALA 34 12.327 7.333 -1.394 137 H SER 35 H SER 35 14.263 7.778 -0.267 138 HA SER 35 HA SER 35 16.144 6.094 1.144 139 1HB SER 35 2HB SER 35 16.361 8.702 0.912 140 2HB SER 35 1HB SER 35 14.953 8.711 1.894 141 HG SER 35 HG SER 35 17.315 8.679 2.803 142 H ALA 36 H ALA 36 15.600 4.873 2.882 143 HA ALA 36 HA ALA 36 12.941 4.628 3.853 144 1HB ALA 36 1HB ALA 36 14.559 2.788 4.033 145 2HB ALA 36 2HB ALA 36 13.942 3.237 5.619 146 3HB ALA 36 3HB ALA 36 15.547 3.763 5.118 147 H ASP 37 H ASP 37 15.749 6.442 4.738 148 HA ASP 37 HA ASP 37 14.811 7.404 7.243 149 1HB ASP 37 2HB ASP 37 16.875 8.590 5.371 150 2HB ASP 37 1HB ASP 37 16.548 9.174 6.998 151 H LYS 38 H LYS 38 14.637 8.541 3.940 152 HA LYS 38 HA LYS 38 13.354 10.986 4.579 153 1HB LYS 38 2HB LYS 38 14.492 10.543 2.390 154 2HB LYS 38 1HB LYS 38 13.136 9.476 1.969 155 1HG LYS 38 2HG LYS 38 11.639 11.295 2.259 156 2HG LYS 38 1HG LYS 38 13.032 12.324 2.676 157 1HD LYS 38 2HD LYS 38 13.923 11.983 0.438 158 2HD LYS 38 1HD LYS 38 12.512 10.992 0.027 159 1HE LYS 38 2HE LYS 38 11.054 12.843 0.543 160 2HE LYS 38 1HE LYS 38 12.447 13.834 0.950 161 1HZ LYS 38 1HZ LYS 38 11.810 12.704 -1.719 162 2HZ LYS 38 2HZ LYS 38 13.199 13.587 -1.372 163 3HZ LYS 38 3HZ LYS 38 11.678 14.327 -1.293 164 H PHE 39 H PHE 39 12.204 7.701 4.033 165 HA PHE 39 HA PHE 39 9.447 8.342 3.861 166 1HB PHE 39 2HB PHE 39 10.331 6.124 3.192 167 2HB PHE 39 1HB PHE 39 10.754 5.791 4.868 168 HD1 PHE 39 1HD PHE 39 7.942 6.308 2.535 169 HD2 PHE 39 2HD PHE 39 9.129 4.961 6.387 170 HE1 PHE 39 1HE PHE 39 5.711 5.334 2.873 171 HE2 PHE 39 2HE PHE 39 6.899 3.981 6.735 172 HZ PHE 39 HZ PHE 39 5.187 4.166 4.978 173 H HIS 40 H HIS 40 11.578 7.534 6.516 174 HA HIS 40 HA HIS 40 9.701 7.732 8.642 175 1HB HIS 40 2HB HIS 40 11.942 6.639 8.795 176 2HB HIS 40 1HB HIS 40 12.696 8.214 8.635 177 HD1 HIS 40 1HD HIS 40 13.214 9.377 10.773 178 HD2 HIS 40 2HD HIS 40 10.401 6.373 11.261 179 HE1 HIS 40 1HE HIS 40 12.818 9.214 13.242 180 HE2 HIS 40 2HE HIS 40 11.378 7.228 13.513 181 H HIS 41 H HIS 41 11.677 9.952 6.923 182 HA HIS 41 HA HIS 41 11.556 12.317 8.440 183 1HB HIS 41 2HB HIS 41 13.096 11.756 6.555 184 2HB HIS 41 1HB HIS 41 11.744 11.958 5.457 185 HD1 HIS 41 1HD HIS 41 10.871 14.533 5.222 186 HD2 HIS 41 2HD HIS 41 14.498 13.862 7.080 187 HE1 HIS 41 1HE HIS 41 12.023 16.739 5.183 188 HE2 HIS 41 2HE HIS 41 14.135 16.398 6.467 189 H MET 42 H MET 42 9.355 10.825 6.164 190 HA MET 42 HA MET 42 7.769 13.012 5.394 191 1HB MET 42 2HB MET 42 7.015 10.100 5.631 192 2HB MET 42 1HB MET 42 6.012 11.310 4.863 193 1HG MET 42 2HG MET 42 8.783 10.530 3.985 194 2HG MET 42 1HG MET 42 7.289 9.936 3.270 195 1HE MET 42 1HE MET 42 5.470 12.597 3.270 196 2HE MET 42 2HE MET 42 5.593 11.472 1.913 197 3HE MET 42 3HE MET 42 5.822 13.198 1.654 198 H PHE 43 H PHE 43 7.781 11.240 8.364 199 HA PHE 43 HA PHE 43 5.122 12.002 9.120 200 1HB PHE 43 2HB PHE 43 6.105 9.977 10.083 201 2HB PHE 43 1HB PHE 43 7.392 10.930 10.816 202 HD1 PHE 43 1HD PHE 43 3.690 10.512 10.815 203 HD2 PHE 43 2HD PHE 43 7.139 11.757 12.984 204 HE1 PHE 43 1HE PHE 43 2.311 10.805 12.831 205 HE2 PHE 43 2HE PHE 43 5.763 12.050 15.005 206 HZ PHE 43 HZ PHE 43 3.346 11.575 14.929 207 H ALA 44 H ALA 44 8.251 13.435 9.365 208 HA ALA 44 HA ALA 44 7.250 15.437 11.228 209 1HB ALA 44 1HB ALA 44 9.441 14.446 11.738 210 2HB ALA 44 2HB ALA 44 9.577 16.174 11.402 211 3HB ALA 44 3HB ALA 44 10.050 14.994 10.178 212 H GLY 45 H GLY 45 5.976 16.730 10.022 213 1HA GLY 45 2HA GLY 45 6.580 18.911 8.806 214 2HA GLY 45 1HA GLY 45 7.073 17.799 7.536 215 H LYS 46 H LYS 46 5.392 19.143 6.445 216 HA LYS 46 HA LYS 46 2.711 18.078 6.957 217 1HB LYS 46 2HB LYS 46 3.584 20.638 5.618 218 2HB LYS 46 1HB LYS 46 1.957 20.020 5.427 219 1HG LYS 46 2HG LYS 46 1.936 21.728 7.104 220 2HG LYS 46 1HG LYS 46 1.670 20.183 7.896 221 1HD LYS 46 2HD LYS 46 4.059 20.163 8.551 222 2HD LYS 46 1HD LYS 46 4.243 21.751 7.802 223 1HE LYS 46 2HE LYS 46 2.358 21.092 10.053 224 2HE LYS 46 1HE LYS 46 3.916 21.888 10.250 225 1HZ LYS 46 1HZ LYS 46 3.115 23.754 9.012 226 2HZ LYS 46 2HZ LYS 46 2.053 23.423 10.252 227 3HZ LYS 46 3HZ LYS 46 1.624 23.011 8.681 228 HA PRO 47 HA PRO 47 2.730 15.676 3.275 229 1HB PRO 47 2HB PRO 47 0.186 16.184 2.322 230 2HB PRO 47 1HB PRO 47 0.562 15.017 3.591 231 1HG PRO 47 2HG PRO 47 -0.426 17.820 3.827 232 2HG PRO 47 1HG PRO 47 -0.902 16.385 4.756 233 1HD PRO 47 2HD PRO 47 0.748 18.221 5.772 234 2HD PRO 47 1HD PRO 47 0.980 16.493 6.104 235 H HIS 48 H HIS 48 2.537 15.788 0.954 236 HA HIS 48 HA HIS 48 3.461 18.326 0.017 237 1HB HIS 48 2HB HIS 48 3.175 15.676 -1.374 238 2HB HIS 48 1HB HIS 48 3.620 17.140 -2.245 239 HD1 HIS 48 1HD HIS 48 6.048 17.724 -2.255 240 HD2 HIS 48 2HD HIS 48 5.090 14.994 0.725 241 HE1 HIS 48 1HE HIS 48 8.212 17.080 -1.228 242 HE2 HIS 48 2HE HIS 48 7.550 15.789 0.790 243 H HIS 49 H HIS 49 2.212 19.852 -0.392 244 HA HIS 49 HA HIS 49 -0.542 19.651 -0.959 245 1HB HIS 49 2HB HIS 49 0.561 21.641 0.081 246 2HB HIS 49 1HB HIS 49 1.370 21.972 -1.437 247 HD1 HIS 49 1HD HIS 49 -1.586 22.862 0.472 248 HD2 HIS 49 2HD HIS 49 -0.627 22.656 -3.572 249 HE1 HIS 49 1HE HIS 49 -3.273 24.272 -0.688 250 HE2 HIS 49 2HE HIS 49 -2.402 24.440 -3.020 251 H VAL 50 H VAL 50 -1.516 19.342 -2.871 252 HA VAL 50 HA VAL 50 0.179 19.410 -5.243 253 HB VAL 50 HB VAL 50 -0.527 17.128 -4.665 254 1HG1 VAL 50 1HG1 VAL 50 -2.864 16.424 -4.747 255 2HG1 VAL 50 2HG1 VAL 50 -3.353 18.113 -4.917 256 3HG1 VAL 50 3HG1 VAL 50 -2.544 17.575 -3.446 257 1HG2 VAL 50 1HG2 VAL 50 -0.237 17.622 -7.009 258 2HG2 VAL 50 2HG2 VAL 50 -1.897 18.190 -7.131 259 3HG2 VAL 50 3HG2 VAL 50 -1.569 16.483 -6.812 260 H SER 51 H SER 51 -0.517 20.612 -6.965 261 HA SER 51 HA SER 51 -2.759 22.305 -6.379 262 1HB SER 51 2HB SER 51 -0.600 23.291 -7.141 263 2HB SER 51 1HB SER 51 -0.781 22.442 -8.663 264 HG SER 51 HG SER 51 -2.616 24.316 -7.614 265 H LYS 52 H LYS 52 -4.597 21.442 -6.831 266 HA LYS 52 HA LYS 52 -5.050 20.298 -9.486 267 1HB LYS 52 2HB LYS 52 -6.208 19.405 -6.844 268 2HB LYS 52 1HB LYS 52 -6.727 18.827 -8.420 269 1HG LYS 52 2HG LYS 52 -4.574 17.813 -8.809 270 2HG LYS 52 1HG LYS 52 -3.947 18.525 -7.321 271 1HD LYS 52 2HD LYS 52 -4.487 16.180 -6.988 272 2HD LYS 52 1HD LYS 52 -5.536 17.222 -6.023 273 1HE LYS 52 2HE LYS 52 -7.322 16.950 -7.692 274 2HE LYS 52 1HE LYS 52 -6.270 15.909 -8.647 275 1HZ LYS 52 1HZ LYS 52 -7.797 14.636 -7.304 276 2HZ LYS 52 2HZ LYS 52 -7.264 15.363 -5.906 277 3HZ LYS 52 3HZ LYS 52 -6.230 14.339 -6.764 278 H ALA 53 H ALA 53 -7.050 20.897 -10.355 279 HA ALA 53 HA ALA 53 -8.278 23.223 -9.229 280 1HB ALA 53 1HB ALA 53 -9.166 21.462 -11.534 281 2HB ALA 53 2HB ALA 53 -8.184 22.919 -11.676 282 3HB ALA 53 3HB ALA 53 -9.856 23.031 -11.125 283 H SER 54 H SER 54 -9.603 20.075 -10.146 284 HA SER 54 HA SER 54 -11.162 18.728 -9.396 285 1HB SER 54 2HB SER 54 -11.184 18.192 -6.949 286 2HB SER 54 1HB SER 54 -9.571 18.218 -7.649 287 HG SER 54 HG SER 54 -10.014 20.642 -6.844 288 HA PRO 55 HA PRO 55 -14.968 20.908 -8.585 289 1HB PRO 55 2HB PRO 55 -16.186 18.356 -7.791 290 2HB PRO 55 1HB PRO 55 -16.560 19.365 -9.189 291 1HG PRO 55 2HG PRO 55 -15.331 16.971 -9.445 292 2HG PRO 55 1HG PRO 55 -14.997 18.330 -10.528 293 1HD PRO 55 2HD PRO 55 -13.412 17.337 -8.190 294 2HD PRO 55 1HD PRO 55 -12.858 17.876 -9.793 295 H GLY 56 H GLY 56 -14.569 22.037 -6.748 296 1HA GLY 56 2HA GLY 56 -14.470 20.578 -4.214 297 2HA GLY 56 1HA GLY 56 -13.915 22.227 -4.469 298 H ASN 57 H ASN 57 -15.484 21.602 -2.363 299 HA ASN 57 HA ASN 57 -18.178 22.342 -3.064 300 1HB ASN 57 2HB ASN 57 -18.636 22.096 -0.576 301 2HB ASN 57 1HB ASN 57 -18.073 20.634 -1.364 302 1HD2 ASN 57 1HD2 ASN 57 -17.418 23.021 1.018 303 2HD2 ASN 57 2HD2 ASN 57 -15.997 22.305 1.675 304 H ILE 58 H ILE 58 -18.430 24.296 -3.640 305 HA ILE 58 HA ILE 58 -18.471 26.524 -3.738 306 HB ILE 58 HB ILE 58 -17.516 26.512 -0.839 307 1HG1 ILE 58 2HG1 ILE 58 -20.298 26.884 -1.989 308 2HG1 ILE 58 1HG1 ILE 58 -19.711 25.438 -1.180 309 1HG2 ILE 58 1HG2 ILE 58 -18.299 28.852 -0.761 310 2HG2 ILE 58 2HG2 ILE 58 -18.672 28.781 -2.482 311 3HG2 ILE 58 3HG2 ILE 58 -16.998 28.645 -1.936 312 1HD1 ILE 58 1HD1 ILE 58 -19.448 26.702 0.889 313 2HD1 ILE 58 2HD1 ILE 58 -21.108 26.783 0.291 314 3HD1 ILE 58 3HD1 ILE 58 -20.020 28.157 0.075 315 H GLN 59 H GLN 59 -17.086 26.933 -5.246 316 HA GLN 59 HA GLN 59 -14.390 26.388 -5.224 317 1HB GLN 59 2HB GLN 59 -14.209 27.841 -7.229 318 2HB GLN 59 1HB GLN 59 -15.536 26.705 -7.321 319 1HG GLN 59 2HG GLN 59 -17.093 28.525 -6.697 320 2HG GLN 59 1HG GLN 59 -15.718 29.632 -6.694 321 1HE2 GLN 59 1HE2 GLN 59 -14.765 30.211 -8.630 322 2HE2 GLN 59 2HE2 GLN 59 -15.530 29.960 -10.151 323 H GLY 60 H GLY 60 -12.737 27.179 -4.333 324 1HA GLY 60 2HA GLY 60 -11.680 29.552 -4.020 325 2HA GLY 60 1HA GLY 60 -12.923 29.591 -2.761 326 H CYS 61 H CYS 61 -12.568 28.567 -0.876 327 HA CYS 61 HA CYS 61 -10.719 26.380 -0.777 328 1HB CYS 61 2HB CYS 61 -9.216 28.310 -0.526 329 2HB CYS 61 1HB CYS 61 -10.208 28.919 0.792 330 HG CYS 61 HG CYS 61 -9.559 27.041 2.592 331 H ASP 62 H ASP 62 -11.316 24.986 0.752 332 HA ASP 62 HA ASP 62 -12.796 25.859 3.078 333 1HB ASP 62 2HB ASP 62 -14.566 25.214 1.425 334 2HB ASP 62 1HB ASP 62 -13.772 23.662 1.210 335 H LEU 63 H LEU 63 -12.421 24.364 4.799 336 HA LEU 63 HA LEU 63 -10.015 22.865 4.354 337 1HB LEU 63 2HB LEU 63 -11.688 23.055 6.864 338 2HB LEU 63 1HB LEU 63 -10.087 22.361 6.753 339 HG LEU 63 HG LEU 63 -10.800 25.271 6.377 340 1HD1 LEU 63 1HD1 LEU 63 -10.893 24.567 8.688 341 2HD1 LEU 63 2HD1 LEU 63 -9.507 25.621 8.413 342 3HD1 LEU 63 3HD1 LEU 63 -9.274 23.881 8.562 343 1HD2 LEU 63 1HD2 LEU 63 -8.102 23.914 6.254 344 2HD2 LEU 63 2HD2 LEU 63 -8.373 25.656 6.242 345 3HD2 LEU 63 3HD2 LEU 63 -8.951 24.664 4.903 346 H HIS 64 H HIS 64 -11.087 21.568 2.749 347 HA HIS 64 HA HIS 64 -12.757 19.403 3.794 348 1HB HIS 64 2HB HIS 64 -13.464 20.622 1.717 349 2HB HIS 64 1HB HIS 64 -12.003 20.059 0.927 350 HD1 HIS 64 1HD HIS 64 -12.122 17.763 -0.179 351 HD2 HIS 64 2HD HIS 64 -15.376 18.556 2.288 352 HE1 HIS 64 1HE HIS 64 -13.757 15.939 -0.620 353 HE2 HIS 64 2HE HIS 64 -15.616 16.316 1.031 354 H GLU 65 H GLU 65 -11.503 17.896 4.695 355 HA GLU 65 HA GLU 65 -8.921 17.294 3.450 356 1HB GLU 65 2HB GLU 65 -9.854 16.857 6.289 357 2HB GLU 65 1HB GLU 65 -8.265 16.460 5.657 358 1HG GLU 65 2HG GLU 65 -9.435 19.232 5.799 359 2HG GLU 65 1HG GLU 65 -8.285 18.550 6.945 360 H GLY 66 H GLY 66 -8.379 15.224 3.023 361 1HA GLY 66 2HA GLY 66 -10.505 13.205 3.213 362 2HA GLY 66 1HA GLY 66 -9.095 13.128 2.149 363 H ASP 67 H ASP 67 -8.637 14.272 5.263 364 HA ASP 67 HA ASP 67 -6.957 12.002 5.964 365 1HB ASP 67 2HB ASP 67 -6.071 14.318 6.163 366 2HB ASP 67 1HB ASP 67 -7.333 14.680 7.331 367 H TRP 68 H TRP 68 -7.566 10.540 7.433 368 HA TRP 68 HA TRP 68 -10.081 10.999 8.901 369 1HB TRP 68 2HB TRP 68 -8.698 8.424 8.138 370 2HB TRP 68 1HB TRP 68 -10.156 8.519 9.108 371 HD1 TRP 68 HD TRP 68 -9.009 9.533 5.518 372 HE1 TRP 68 1HE TRP 68 -11.009 9.171 3.926 373 HE3 TRP 68 3HE TRP 68 -12.521 8.076 8.933 374 HZ2 TRP 68 2HZ TRP 68 -13.694 8.363 4.096 375 HZ3 TRP 68 3HZ TRP 68 -14.774 7.520 8.138 376 HH2 TRP 68 HH TRP 68 -15.351 7.660 5.767 377 H GLY 69 H GLY 69 -7.014 11.543 9.581 378 1HA GLY 69 2HA GLY 69 -6.105 11.711 11.735 379 2HA GLY 69 1HA GLY 69 -7.244 10.490 12.295 380 H THR 70 H THR 70 -5.770 9.758 9.371 381 HA THR 70 HA THR 70 -4.248 8.354 8.643 382 HB THR 70 HB THR 70 -2.998 8.423 11.419 383 HG1 THR 70 1HG THR 70 -2.133 10.231 10.789 384 1HG2 THR 70 1HG2 THR 70 -0.971 7.617 10.270 385 2HG2 THR 70 2HG2 THR 70 -1.870 7.520 8.754 386 3HG2 THR 70 3HG2 THR 70 -2.293 6.463 10.099 387 H VAL 71 H VAL 71 -4.842 7.161 11.970 388 HA VAL 71 HA VAL 71 -5.085 4.484 10.992 389 HB VAL 71 HB VAL 71 -5.933 5.609 13.681 390 1HG1 VAL 71 1HG1 VAL 71 -5.445 2.762 12.805 391 2HG1 VAL 71 2HG1 VAL 71 -7.011 3.482 13.169 392 3HG1 VAL 71 3HG1 VAL 71 -5.817 3.274 14.455 393 1HG2 VAL 71 1HG2 VAL 71 -3.795 4.720 14.507 394 2HG2 VAL 71 2HG2 VAL 71 -3.550 5.948 13.265 395 3HG2 VAL 71 3HG2 VAL 71 -3.369 4.241 12.865 396 H GLY 72 H GLY 72 -6.843 3.569 10.081 397 1HA GLY 72 2HA GLY 72 -9.139 3.099 9.983 398 2HA GLY 72 1HA GLY 72 -9.465 4.622 10.796 399 H SER 73 H SER 73 -7.228 5.302 8.513 400 HA SER 73 HA SER 73 -9.119 6.706 6.923 401 1HB SER 73 2HB SER 73 -6.192 6.230 6.381 402 2HB SER 73 1HB SER 73 -7.213 7.448 5.621 403 HG SER 73 HG SER 73 -6.174 7.306 8.174 404 H ILE 74 H ILE 74 -9.839 6.363 4.923 405 HA ILE 74 HA ILE 74 -8.948 3.995 3.487 406 HB ILE 74 HB ILE 74 -11.786 5.015 3.771 407 1HG1 ILE 74 2HG1 ILE 74 -10.524 2.366 4.419 408 2HG1 ILE 74 1HG1 ILE 74 -10.873 3.625 5.591 409 1HG2 ILE 74 1HG2 ILE 74 -12.426 3.202 2.222 410 2HG2 ILE 74 2HG2 ILE 74 -10.726 2.814 1.969 411 3HG2 ILE 74 3HG2 ILE 74 -11.360 4.363 1.427 412 1HD1 ILE 74 1HD1 ILE 74 -12.844 2.135 3.900 413 2HD1 ILE 74 2HD1 ILE 74 -13.256 3.394 5.082 414 3HD1 ILE 74 3HD1 ILE 74 -12.547 1.861 5.620 415 H VAL 75 H VAL 75 -8.030 4.685 1.746 416 HA VAL 75 HA VAL 75 -9.127 6.961 0.245 417 HB VAL 75 HB VAL 75 -6.146 6.491 0.716 418 1HG1 VAL 75 1HG1 VAL 75 -6.592 7.473 -1.465 419 2HG1 VAL 75 2HG1 VAL 75 -5.810 8.652 -0.409 420 3HG1 VAL 75 3HG1 VAL 75 -7.544 8.752 -0.718 421 1HG2 VAL 75 1HG2 VAL 75 -6.144 8.596 2.000 422 2HG2 VAL 75 2HG2 VAL 75 -7.162 7.368 2.755 423 3HG2 VAL 75 3HG2 VAL 75 -7.899 8.683 1.841 424 H PHE 76 H PHE 76 -8.702 6.715 -2.074 425 HA PHE 76 HA PHE 76 -7.869 3.991 -2.642 426 1HB PHE 76 2HB PHE 76 -10.009 5.595 -4.037 427 2HB PHE 76 1HB PHE 76 -9.386 4.058 -4.633 428 HD1 PHE 76 1HD PHE 76 -9.224 2.258 -2.675 429 HD2 PHE 76 2HD PHE 76 -12.028 5.432 -2.859 430 HE1 PHE 76 1HE PHE 76 -10.683 1.010 -1.197 431 HE2 PHE 76 2HE PHE 76 -13.542 4.185 -1.370 432 HZ PHE 76 HZ PHE 76 -12.866 1.945 -0.533 433 H TRP 77 H TRP 77 -6.623 3.563 -4.367 434 HA TRP 77 HA TRP 77 -5.144 5.920 -5.349 435 1HB TRP 77 2HB TRP 77 -4.240 3.031 -5.502 436 2HB TRP 77 1HB TRP 77 -3.333 4.447 -5.948 437 HD1 TRP 77 HD TRP 77 -5.227 4.248 -2.842 438 HE1 TRP 77 1HE TRP 77 -3.602 4.186 -0.749 439 HE3 TRP 77 3HE TRP 77 -0.907 3.952 -5.357 440 HZ2 TRP 77 2HZ TRP 77 -0.786 4.074 -0.376 441 HZ3 TRP 77 3HZ TRP 77 1.234 3.878 -4.125 442 HH2 TRP 77 HH TRP 77 1.287 3.942 -1.692 443 H ASN 78 H ASN 78 -5.076 6.223 -7.225 444 HA ASN 78 HA ASN 78 -6.179 4.283 -9.161 445 1HB ASN 78 2HB ASN 78 -6.387 7.303 -9.286 446 2HB ASN 78 1HB ASN 78 -6.800 6.242 -10.630 447 1HD2 ASN 78 1HD2 ASN 78 -8.684 5.029 -10.521 448 2HD2 ASN 78 2HD2 ASN 78 -9.896 5.308 -9.330 449 H TYR 79 H TYR 79 -4.883 3.668 -10.694 450 HA TYR 79 HA TYR 79 -2.761 5.311 -11.654 451 1HB TYR 79 2HB TYR 79 -0.961 3.698 -11.127 452 2HB TYR 79 1HB TYR 79 -1.651 4.383 -9.668 453 HD1 TYR 79 1HD TYR 79 -1.052 1.363 -11.598 454 HD2 TYR 79 2HD TYR 79 -3.074 2.934 -8.196 455 HE1 TYR 79 1HE TYR 79 -1.330 -0.907 -10.727 456 HE2 TYR 79 2HE TYR 79 -3.353 0.651 -7.312 457 HH TYR 79 HH TYR 79 -1.642 -1.977 -8.514 458 H VAL 80 H VAL 80 -1.532 3.929 -13.360 459 HA VAL 80 HA VAL 80 -3.640 2.375 -14.659 460 HB VAL 80 HB VAL 80 -1.524 4.087 -15.998 461 1HG1 VAL 80 1HG1 VAL 80 -2.731 3.622 -18.075 462 2HG1 VAL 80 2HG1 VAL 80 -3.824 2.547 -17.199 463 3HG1 VAL 80 3HG1 VAL 80 -2.114 2.139 -17.346 464 1HG2 VAL 80 1HG2 VAL 80 -3.428 5.507 -16.672 465 2HG2 VAL 80 2HG2 VAL 80 -3.221 5.447 -14.919 466 3HG2 VAL 80 3HG2 VAL 80 -4.494 4.504 -15.695 467 H HIS 81 H HIS 81 -3.219 0.366 -15.151 468 HA HIS 81 HA HIS 81 -0.496 -0.438 -15.704 469 1HB HIS 81 2HB HIS 81 -0.783 -1.105 -13.342 470 2HB HIS 81 1HB HIS 81 -2.294 -1.909 -13.751 471 HD1 HIS 81 1HD HIS 81 1.418 -2.314 -14.083 472 HD2 HIS 81 2HD HIS 81 -2.034 -4.481 -14.834 473 HE1 HIS 81 1HE HIS 81 2.185 -4.637 -14.679 474 HE2 HIS 81 2HE HIS 81 0.067 -5.966 -14.822 475 H ASP 82 H ASP 82 -0.409 -1.638 -17.430 476 HA ASP 82 HA ASP 82 -0.990 -2.947 -19.245 477 1HB ASP 82 2HB ASP 82 -1.788 -4.455 -17.356 478 2HB ASP 82 1HB ASP 82 -3.355 -3.727 -17.521 479 H GLY 83 H GLY 83 -1.914 -0.216 -18.813 480 1HA GLY 83 2HA GLY 83 -3.049 1.310 -20.096 481 2HA GLY 83 1HA GLY 83 -3.791 -0.012 -20.986 482 H GLU 84 H GLU 84 -4.474 -0.938 -18.005 483 HA GLU 84 HA GLU 84 -7.064 0.403 -18.066 484 1HB GLU 84 2HB GLU 84 -7.070 -2.043 -18.073 485 2HB GLU 84 1HB GLU 84 -6.129 -2.053 -16.583 486 1HG GLU 84 2HG GLU 84 -7.993 -0.977 -15.423 487 2HG GLU 84 1HG GLU 84 -8.933 -1.004 -16.911 488 H ALA 85 H ALA 85 -7.806 1.521 -16.375 489 HA ALA 85 HA ALA 85 -5.913 2.526 -14.470 490 1HB ALA 85 1HB ALA 85 -8.902 2.970 -14.662 491 2HB ALA 85 2HB ALA 85 -7.658 4.008 -15.368 492 3HB ALA 85 3HB ALA 85 -7.796 3.864 -13.619 493 H LYS 86 H LYS 86 -5.420 1.504 -12.717 494 HA LYS 86 HA LYS 86 -7.169 -0.614 -11.696 495 1HB LYS 86 2HB LYS 86 -4.280 0.006 -11.062 496 2HB LYS 86 1HB LYS 86 -5.184 -1.385 -10.495 497 1HG LYS 86 2HG LYS 86 -4.462 -0.816 -13.371 498 2HG LYS 86 1HG LYS 86 -3.646 -1.943 -12.286 499 1HD LYS 86 2HD LYS 86 -5.683 -3.273 -12.113 500 2HD LYS 86 1HD LYS 86 -6.528 -2.136 -13.170 501 1HE LYS 86 2HE LYS 86 -4.971 -2.652 -14.980 502 2HE LYS 86 1HE LYS 86 -4.096 -3.756 -13.938 503 1HZ LYS 86 1HZ LYS 86 -6.940 -4.064 -14.732 504 2HZ LYS 86 2HZ LYS 86 -6.036 -5.172 -13.824 505 3HZ LYS 86 3HZ LYS 86 -5.650 -4.884 -15.433 506 H VAL 87 H VAL 87 -7.562 -0.688 -9.410 507 HA VAL 87 HA VAL 87 -7.217 1.905 -8.105 508 HB VAL 87 HB VAL 87 -9.638 0.079 -7.932 509 1HG1 VAL 87 1HG1 VAL 87 -9.147 2.761 -6.628 510 2HG1 VAL 87 2HG1 VAL 87 -9.210 1.202 -5.807 511 3HG1 VAL 87 3HG1 VAL 87 -10.659 1.853 -6.569 512 1HG2 VAL 87 1HG2 VAL 87 -9.351 2.814 -9.178 513 2HG2 VAL 87 2HG2 VAL 87 -10.856 1.908 -9.030 514 3HG2 VAL 87 3HG2 VAL 87 -9.550 1.293 -10.046 515 H ALA 88 H ALA 88 -6.485 1.824 -6.089 516 HA ALA 88 HA ALA 88 -6.099 -0.831 -4.919 517 1HB ALA 88 1HB ALA 88 -3.994 0.463 -5.297 518 2HB ALA 88 2HB ALA 88 -4.293 0.067 -3.601 519 3HB ALA 88 3HB ALA 88 -4.618 1.689 -4.172 520 H LYS 89 H LYS 89 -6.709 -1.212 -2.872 521 HA LYS 89 HA LYS 89 -8.673 0.611 -1.781 522 1HB LYS 89 2HB LYS 89 -9.953 -1.611 -1.453 523 2HB LYS 89 1HB LYS 89 -9.926 -0.901 -3.056 524 1HG LYS 89 2HG LYS 89 -7.831 -2.413 -3.439 525 2HG LYS 89 1HG LYS 89 -8.421 -3.328 -2.064 526 1HD LYS 89 2HD LYS 89 -9.117 -4.303 -4.181 527 2HD LYS 89 1HD LYS 89 -10.544 -3.760 -3.321 528 1HE LYS 89 2HE LYS 89 -10.583 -1.701 -4.717 529 2HE LYS 89 1HE LYS 89 -9.110 -2.225 -5.525 530 1HZ LYS 89 1HZ LYS 89 -11.755 -3.607 -5.635 531 2HZ LYS 89 2HZ LYS 89 -10.361 -4.087 -6.454 532 3HZ LYS 89 3HZ LYS 89 -11.113 -2.632 -6.822 533 H GLU 90 H GLU 90 -8.425 0.936 0.391 534 HA GLU 90 HA GLU 90 -6.743 -0.874 1.903 535 1HB GLU 90 2HB GLU 90 -5.329 0.992 2.619 536 2HB GLU 90 1HB GLU 90 -5.167 0.687 0.887 537 1HG GLU 90 2HG GLU 90 -6.516 2.564 0.344 538 2HG GLU 90 1HG GLU 90 -7.023 2.764 1.998 539 H ARG 91 H ARG 91 -7.084 -0.663 4.030 540 HA ARG 91 HA ARG 91 -8.468 1.663 5.101 541 1HB ARG 91 2HB ARG 91 -10.004 -0.399 4.891 542 2HB ARG 91 1HB ARG 91 -8.944 -1.201 6.025 543 1HG ARG 91 2HG ARG 91 -10.509 1.312 6.630 544 2HG ARG 91 1HG ARG 91 -11.059 -0.320 6.999 545 1HD ARG 91 2HD ARG 91 -9.166 -0.611 8.498 546 2HD ARG 91 1HD ARG 91 -8.569 0.991 8.069 547 HE ARG 91 HE ARG 91 -11.049 1.509 8.961 548 1HH1 ARG 91 1HH1 ARG 91 -8.519 -0.498 10.357 549 2HH1 ARG 91 2HH1 ARG 91 -8.795 -0.022 11.964 550 1HH2 ARG 91 1HH2 ARG 91 -11.496 2.156 11.139 551 2HH2 ARG 91 2HH2 ARG 91 -10.580 1.554 12.442 552 H ILE 92 H ILE 92 -7.076 2.500 6.567 553 HA ILE 92 HA ILE 92 -4.677 1.024 7.177 554 HB ILE 92 HB ILE 92 -5.588 3.746 8.140 555 1HG1 ILE 92 2HG1 ILE 92 -3.556 2.893 6.057 556 2HG1 ILE 92 1HG1 ILE 92 -5.113 3.644 5.747 557 1HG2 ILE 92 1HG2 ILE 92 -3.282 4.083 8.948 558 2HG2 ILE 92 2HG2 ILE 92 -2.913 2.401 8.566 559 3HG2 ILE 92 3HG2 ILE 92 -4.104 2.780 9.809 560 1HD1 ILE 92 1HD1 ILE 92 -2.761 4.921 7.134 561 2HD1 ILE 92 2HD1 ILE 92 -4.318 5.695 6.851 562 3HD1 ILE 92 3HD1 ILE 92 -3.303 5.237 5.486 563 H GLU 93 H GLU 93 -4.336 -0.291 8.691 564 HA GLU 93 HA GLU 93 -6.258 -0.602 10.874 565 1HB GLU 93 2HB GLU 93 -3.952 -2.308 9.968 566 2HB GLU 93 1HB GLU 93 -5.043 -2.703 11.281 567 1HG GLU 93 2HG GLU 93 -5.885 -2.298 8.430 568 2HG GLU 93 1HG GLU 93 -5.525 -3.858 9.168 569 H ALA 94 H ALA 94 -2.798 -0.078 10.312 570 HA ALA 94 HA ALA 94 -2.421 1.071 12.899 571 1HB ALA 94 1HB ALA 94 -0.723 -0.526 13.624 572 2HB ALA 94 2HB ALA 94 -1.037 -1.519 12.200 573 3HB ALA 94 3HB ALA 94 -2.285 -1.323 13.431 574 H VAL 95 H VAL 95 -0.407 2.106 13.054 575 HA VAL 95 HA VAL 95 1.336 2.045 10.754 576 HB VAL 95 HB VAL 95 -0.327 3.764 10.162 577 1HG1 VAL 95 1HG1 VAL 95 0.489 5.150 12.705 578 2HG1 VAL 95 2HG1 VAL 95 -1.078 4.423 12.357 579 3HG1 VAL 95 3HG1 VAL 95 -0.540 5.842 11.453 580 1HG2 VAL 95 1HG2 VAL 95 2.357 4.955 10.882 581 2HG2 VAL 95 2HG2 VAL 95 1.202 5.658 9.751 582 3HG2 VAL 95 3HG2 VAL 95 1.960 4.107 9.388 583 H GLU 96 H GLU 96 3.403 2.374 11.316 584 HA GLU 96 HA GLU 96 4.005 3.419 14.019 585 1HB GLU 96 2HB GLU 96 5.688 1.559 12.299 586 2HB GLU 96 1HB GLU 96 6.224 2.320 13.749 587 1HG GLU 96 2HG GLU 96 3.935 0.387 13.660 588 2HG GLU 96 1HG GLU 96 5.617 -0.024 14.031 589 HA PRO 97 HA PRO 97 5.743 6.632 11.285 590 1HB PRO 97 2HB PRO 97 6.005 8.010 13.893 591 2HB PRO 97 1HB PRO 97 5.238 8.579 12.411 592 1HG PRO 97 2HG PRO 97 3.745 7.891 14.494 593 2HG PRO 97 1HG PRO 97 3.249 7.455 12.849 594 1HD PRO 97 2HD PRO 97 4.585 5.759 14.921 595 2HD PRO 97 1HD PRO 97 3.200 5.368 13.874 596 H ASP 98 H ASP 98 6.828 5.341 14.332 597 HA ASP 98 HA ASP 98 9.559 6.183 14.022 598 1HB ASP 98 2HB ASP 98 8.916 6.134 16.279 599 2HB ASP 98 1HB ASP 98 8.067 4.621 16.117 600 H LYS 99 H LYS 99 7.812 3.274 13.435 601 HA LYS 99 HA LYS 99 10.356 1.935 12.885 602 1HB LYS 99 2HB LYS 99 7.638 0.755 13.273 603 2HB LYS 99 1HB LYS 99 9.139 -0.141 13.041 604 1HG LYS 99 2HG LYS 99 10.078 0.858 15.008 605 2HG LYS 99 1HG LYS 99 8.616 1.805 15.237 606 1HD LYS 99 2HD LYS 99 7.367 -0.284 15.420 607 2HD LYS 99 1HD LYS 99 8.932 -1.130 15.317 608 1HE LYS 99 2HE LYS 99 8.152 -0.778 17.687 609 2HE LYS 99 1HE LYS 99 9.728 -0.072 17.309 610 1HZ LYS 99 1HZ LYS 99 8.257 1.424 18.587 611 2HZ LYS 99 2HZ LYS 99 7.175 1.452 17.282 612 3HZ LYS 99 3HZ LYS 99 8.743 2.076 17.113 613 H ASN 100 H ASN 100 8.244 3.675 11.249 614 HA ASN 100 HA ASN 100 7.533 3.889 9.065 615 1HB ASN 100 2HB ASN 100 9.842 2.001 8.502 616 2HB ASN 100 1HB ASN 100 8.996 2.951 7.293 617 1HD2 ASN 100 1HD2 ASN 100 11.737 2.906 7.916 618 2HD2 ASN 100 2HD2 ASN 100 12.216 4.504 8.389 619 H LEU 101 H LEU 101 5.887 2.239 10.313 620 HA LEU 101 HA LEU 101 5.555 -0.151 8.580 621 1HB LEU 101 2HB LEU 101 6.055 -0.714 10.943 622 2HB LEU 101 1HB LEU 101 4.681 0.258 11.426 623 HG LEU 101 HG LEU 101 3.211 -1.278 10.157 624 1HD1 LEU 101 1HD1 LEU 101 5.700 -2.923 9.978 625 2HD1 LEU 101 2HD1 LEU 101 4.748 -2.240 8.653 626 3HD1 LEU 101 3HD1 LEU 101 4.057 -3.504 9.666 627 1HD2 LEU 101 1HD2 LEU 101 3.234 -3.019 11.854 628 2HD2 LEU 101 2HD2 LEU 101 3.396 -1.409 12.549 629 3HD2 LEU 101 3HD2 LEU 101 4.812 -2.456 12.418 630 H ILE 102 H ILE 102 3.570 -0.464 7.686 631 HA ILE 102 HA ILE 102 1.310 1.000 8.687 632 HB ILE 102 HB ILE 102 2.162 2.592 7.145 633 1HG1 ILE 102 2HG1 ILE 102 0.327 2.755 5.437 634 2HG1 ILE 102 1HG1 ILE 102 -0.196 1.151 5.936 635 1HG2 ILE 102 1HG2 ILE 102 2.534 2.134 4.744 636 2HG2 ILE 102 2HG2 ILE 102 2.249 0.424 5.085 637 3HG2 ILE 102 3HG2 ILE 102 3.615 1.233 5.810 638 1HD1 ILE 102 1HD1 ILE 102 -1.520 2.883 6.979 639 2HD1 ILE 102 2HD1 ILE 102 -0.067 3.585 7.687 640 3HD1 ILE 102 3HD1 ILE 102 -0.604 1.978 8.183 641 H THR 103 H THR 103 -0.307 -0.271 8.789 642 HA THR 103 HA THR 103 -0.356 -2.813 7.313 643 HB THR 103 HB THR 103 -2.029 -1.919 9.671 644 HG1 THR 103 1HG THR 103 0.188 -3.683 9.749 645 1HG2 THR 103 1HG2 THR 103 -2.453 -4.328 9.966 646 2HG2 THR 103 2HG2 THR 103 -1.487 -4.676 8.532 647 3HG2 THR 103 3HG2 THR 103 -3.003 -3.790 8.378 648 H PHE 104 H PHE 104 -1.700 -3.013 5.559 649 HA PHE 104 HA PHE 104 -3.982 -1.178 5.232 650 1HB PHE 104 2HB PHE 104 -2.486 -2.864 3.211 651 2HB PHE 104 1HB PHE 104 -3.779 -1.804 2.773 652 HD1 PHE 104 1HD PHE 104 -3.372 0.739 3.303 653 HD2 PHE 104 2HD PHE 104 -0.322 -2.220 3.129 654 HE1 PHE 104 1HE PHE 104 -1.699 2.489 2.859 655 HE2 PHE 104 2HE PHE 104 1.347 -0.480 2.693 656 HZ PHE 104 HZ PHE 104 0.684 1.858 2.557 657 H ARG 105 H ARG 105 -5.989 -2.102 5.384 658 HA ARG 105 HA ARG 105 -6.259 -5.011 4.953 659 1HB ARG 105 2HB ARG 105 -7.204 -4.222 7.097 660 2HB ARG 105 1HB ARG 105 -8.180 -3.035 6.244 661 1HG ARG 105 2HG ARG 105 -9.310 -4.929 5.053 662 2HG ARG 105 1HG ARG 105 -8.449 -6.040 6.103 663 1HD ARG 105 2HD ARG 105 -10.367 -3.893 6.950 664 2HD ARG 105 1HD ARG 105 -10.734 -5.610 6.871 665 HE ARG 105 HE ARG 105 -8.722 -4.467 8.716 666 1HH1 ARG 105 1HH1 ARG 105 -11.344 -6.777 8.120 667 2HH1 ARG 105 2HH1 ARG 105 -11.394 -7.349 9.715 668 1HH2 ARG 105 1HH2 ARG 105 -8.767 -5.210 10.826 669 2HH2 ARG 105 2HH2 ARG 105 -9.860 -6.439 11.341 670 H VAL 106 H VAL 106 -7.434 -5.714 3.167 671 HA VAL 106 HA VAL 106 -8.415 -3.630 1.454 672 HB VAL 106 HB VAL 106 -8.183 -6.623 1.037 673 1HG1 VAL 106 1HG1 VAL 106 -8.846 -6.113 -1.313 674 2HG1 VAL 106 2HG1 VAL 106 -9.280 -4.490 -0.805 675 3HG1 VAL 106 3HG1 VAL 106 -10.168 -5.875 -0.167 676 1HG2 VAL 106 1HG2 VAL 106 -6.107 -5.349 0.975 677 2HG2 VAL 106 2HG2 VAL 106 -6.810 -4.245 -0.203 678 3HG2 VAL 106 3HG2 VAL 106 -6.526 -5.926 -0.638 679 H ILE 107 H ILE 107 -10.344 -3.011 1.303 680 HA ILE 107 HA ILE 107 -12.395 -4.364 2.902 681 HB ILE 107 HB ILE 107 -13.590 -2.263 3.079 682 1HG1 ILE 107 2HG1 ILE 107 -13.034 -1.270 0.825 683 2HG1 ILE 107 1HG1 ILE 107 -12.830 -0.141 2.149 684 1HG2 ILE 107 1HG2 ILE 107 -11.995 -0.972 4.353 685 2HG2 ILE 107 2HG2 ILE 107 -10.687 -1.799 3.540 686 3HG2 ILE 107 3HG2 ILE 107 -11.743 -2.709 4.650 687 1HD1 ILE 107 1HD1 ILE 107 -10.995 0.175 0.639 688 2HD1 ILE 107 2HD1 ILE 107 -10.637 -1.555 0.605 689 3HD1 ILE 107 3HD1 ILE 107 -10.383 -0.651 2.071 690 H GLU 108 H GLU 108 -11.764 -3.201 -0.318 691 HA GLU 108 HA GLU 108 -14.508 -3.368 -1.115 692 1HB GLU 108 2HB GLU 108 -12.870 -1.609 -1.888 693 2HB GLU 108 1HB GLU 108 -12.023 -2.829 -2.784 694 1HG GLU 108 2HG GLU 108 -14.848 -1.893 -3.294 695 2HG GLU 108 1HG GLU 108 -13.418 -1.415 -4.196 696 H GLY 109 H GLY 109 -15.332 -4.755 -2.666 697 1HA GLY 109 2HA GLY 109 -14.993 -7.402 -2.050 698 2HA GLY 109 1HA GLY 109 -15.951 -6.766 -3.348 699 H ASP 110 H ASP 110 -13.375 -5.771 -4.818 700 HA ASP 110 HA ASP 110 -13.226 -8.009 -6.501 701 1HB ASP 110 2HB ASP 110 -11.254 -5.754 -6.252 702 2HB ASP 110 1HB ASP 110 -10.990 -7.076 -7.375 703 H LEU 111 H LEU 111 -10.842 -7.200 -4.034 704 HA LEU 111 HA LEU 111 -9.402 -9.611 -4.608 705 1HB LEU 111 2HB LEU 111 -9.114 -7.699 -2.304 706 2HB LEU 111 1HB LEU 111 -8.023 -9.033 -2.622 707 HG LEU 111 HG LEU 111 -8.451 -6.655 -4.452 708 1HD1 LEU 111 1HD1 LEU 111 -6.130 -6.089 -3.906 709 2HD1 LEU 111 2HD1 LEU 111 -6.108 -7.369 -2.697 710 3HD1 LEU 111 3HD1 LEU 111 -7.200 -5.983 -2.523 711 1HD2 LEU 111 1HD2 LEU 111 -7.939 -8.649 -5.749 712 2HD2 LEU 111 2HD2 LEU 111 -6.560 -8.993 -4.700 713 3HD2 LEU 111 3HD2 LEU 111 -6.554 -7.562 -5.726 714 H MET 112 H MET 112 -12.012 -8.773 -2.641 715 HA MET 112 HA MET 112 -11.821 -10.973 -0.797 716 1HB MET 112 2HB MET 112 -14.133 -9.151 -1.444 717 2HB MET 112 1HB MET 112 -14.094 -10.299 -0.127 718 1HG MET 112 2HG MET 112 -12.154 -8.001 -0.326 719 2HG MET 112 1HG MET 112 -13.725 -7.838 0.435 720 1HE MET 112 1HE MET 112 -10.959 -10.916 0.764 721 2HE MET 112 2HE MET 112 -10.203 -10.326 2.210 722 3HE MET 112 3HE MET 112 -10.064 -9.389 0.721 723 H LYS 113 H LYS 113 -12.644 -10.784 -4.002 724 HA LYS 113 HA LYS 113 -14.627 -12.910 -3.962 725 1HB LYS 113 2HB LYS 113 -13.050 -11.797 -6.288 726 2HB LYS 113 1HB LYS 113 -14.469 -12.819 -6.402 727 1HG LYS 113 2HG LYS 113 -14.390 -10.012 -5.316 728 2HG LYS 113 1HG LYS 113 -14.974 -10.490 -6.907 729 1HD LYS 113 2HD LYS 113 -16.744 -11.824 -5.835 730 2HD LYS 113 1HD LYS 113 -16.134 -11.337 -4.255 731 1HE LYS 113 2HE LYS 113 -16.605 -9.028 -4.710 732 2HE LYS 113 1HE LYS 113 -17.092 -9.408 -6.356 733 1HZ LYS 113 1HZ LYS 113 -18.494 -10.373 -3.909 734 2HZ LYS 113 2HZ LYS 113 -18.947 -10.644 -5.512 735 3HZ LYS 113 3HZ LYS 113 -18.979 -9.079 -4.866 736 H GLU 114 H GLU 114 -11.285 -12.536 -3.909 737 HA GLU 114 HA GLU 114 -10.712 -15.220 -4.989 738 1HB GLU 114 2HB GLU 114 -8.713 -13.137 -4.118 739 2HB GLU 114 1HB GLU 114 -8.457 -14.498 -5.187 740 1HG GLU 114 2HG GLU 114 -10.050 -12.013 -5.826 741 2HG GLU 114 1HG GLU 114 -8.412 -12.375 -6.360 742 H TYR 115 H TYR 115 -10.411 -13.119 -2.152 743 HA TYR 115 HA TYR 115 -9.602 -15.409 -0.480 744 1HB TYR 115 2HB TYR 115 -8.720 -12.530 -0.149 745 2HB TYR 115 1HB TYR 115 -8.202 -13.906 0.817 746 HD1 TYR 115 1HD TYR 115 -7.745 -12.041 -2.223 747 HD2 TYR 115 2HD TYR 115 -6.751 -15.651 -0.214 748 HE1 TYR 115 1HE TYR 115 -5.944 -12.441 -3.839 749 HE2 TYR 115 2HE TYR 115 -4.958 -16.041 -1.805 750 HH TYR 115 HH TYR 115 -3.850 -13.714 -3.985 751 H LYS 116 H LYS 116 -10.455 -15.327 1.648 752 HA LYS 116 HA LYS 116 -12.992 -13.915 1.760 753 1HB LYS 116 2HB LYS 116 -11.749 -15.622 3.955 754 2HB LYS 116 1HB LYS 116 -13.426 -15.070 3.778 755 1HG LYS 116 2HG LYS 116 -13.686 -16.467 1.836 756 2HG LYS 116 1HG LYS 116 -11.988 -16.968 2.023 757 1HD LYS 116 2HD LYS 116 -13.506 -18.619 2.867 758 2HD LYS 116 1HD LYS 116 -12.489 -17.971 4.162 759 1HE LYS 116 2HE LYS 116 -14.755 -18.213 4.981 760 2HE LYS 116 1HE LYS 116 -14.417 -16.497 4.827 761 1HZ LYS 116 1HZ LYS 116 -16.605 -17.031 3.970 762 2HZ LYS 116 2HZ LYS 116 -15.969 -18.171 2.922 763 3HZ LYS 116 3HZ LYS 116 -15.660 -16.541 2.670 764 H SER 117 H SER 117 -9.797 -13.557 2.881 765 HA SER 117 HA SER 117 -10.363 -10.977 3.970 766 1HB SER 117 2HB SER 117 -10.742 -12.380 5.827 767 2HB SER 117 1HB SER 117 -9.191 -13.224 5.603 768 HG SER 117 HG SER 117 -8.730 -11.763 7.115 769 H PHE 118 H PHE 118 -8.568 -9.674 3.625 770 HA PHE 118 HA PHE 118 -6.010 -10.885 3.066 771 1HB PHE 118 2HB PHE 118 -7.021 -10.946 0.838 772 2HB PHE 118 1HB PHE 118 -7.492 -9.261 0.974 773 HD1 PHE 118 1HD PHE 118 -4.583 -11.527 0.625 774 HD2 PHE 118 2HD PHE 118 -5.983 -7.532 0.439 775 HE1 PHE 118 1HE PHE 118 -2.460 -10.838 -0.374 776 HE2 PHE 118 2HE PHE 118 -3.860 -6.830 -0.586 777 HZ PHE 118 HZ PHE 118 -2.094 -8.480 -0.988 778 H LEU 119 H LEU 119 -4.643 -9.758 4.257 779 HA LEU 119 HA LEU 119 -4.850 -6.863 4.132 780 1HB LEU 119 2HB LEU 119 -4.097 -8.454 6.594 781 2HB LEU 119 1HB LEU 119 -3.903 -6.726 6.425 782 HG LEU 119 HG LEU 119 -6.450 -6.669 6.120 783 1HD1 LEU 119 1HD1 LEU 119 -7.703 -8.438 7.211 784 2HD1 LEU 119 2HD1 LEU 119 -6.225 -9.393 7.348 785 3HD1 LEU 119 3HD1 LEU 119 -6.874 -8.991 5.756 786 1HD2 LEU 119 1HD2 LEU 119 -5.339 -5.775 8.019 787 2HD2 LEU 119 2HD2 LEU 119 -5.206 -7.374 8.762 788 3HD2 LEU 119 3HD2 LEU 119 -6.795 -6.618 8.551 789 H LEU 120 H LEU 120 -2.871 -5.805 4.321 790 HA LEU 120 HA LEU 120 -0.524 -7.462 4.096 791 1HB LEU 120 2HB LEU 120 0.337 -6.350 2.106 792 2HB LEU 120 1HB LEU 120 -1.164 -7.168 1.759 793 HG LEU 120 HG LEU 120 -0.872 -4.172 2.118 794 1HD1 LEU 120 1HD1 LEU 120 -1.081 -4.058 -0.290 795 2HD1 LEU 120 2HD1 LEU 120 -1.179 -5.817 -0.377 796 3HD1 LEU 120 3HD1 LEU 120 0.311 -5.047 0.166 797 1HD2 LEU 120 1HD2 LEU 120 -3.143 -4.971 2.613 798 2HD2 LEU 120 2HD2 LEU 120 -3.178 -5.840 1.086 799 3HD2 LEU 120 3HD2 LEU 120 -3.116 -4.075 1.092 800 H THR 121 H THR 121 1.243 -6.564 4.888 801 HA THR 121 HA THR 121 0.960 -3.849 5.972 802 HB THR 121 HB THR 121 2.237 -6.229 7.340 803 HG1 THR 121 1HG THR 121 -0.294 -5.633 7.000 804 1HG2 THR 121 1HG2 THR 121 3.103 -4.034 7.968 805 2HG2 THR 121 2HG2 THR 121 2.187 -4.751 9.303 806 3HG2 THR 121 3HG2 THR 121 1.474 -3.476 8.310 807 H ILE 122 H ILE 122 2.737 -2.571 5.542 808 HA ILE 122 HA ILE 122 5.123 -3.973 4.571 809 HB ILE 122 HB ILE 122 5.596 -2.131 3.041 810 1HG1 ILE 122 2HG1 ILE 122 2.930 -1.015 3.856 811 2HG1 ILE 122 1HG1 ILE 122 4.488 -0.334 4.307 812 1HG2 ILE 122 1HG2 ILE 122 4.281 -3.988 2.185 813 2HG2 ILE 122 2HG2 ILE 122 3.752 -2.473 1.447 814 3HG2 ILE 122 3HG2 ILE 122 2.800 -3.192 2.737 815 1HD1 ILE 122 1HD1 ILE 122 3.405 -0.561 1.498 816 2HD1 ILE 122 2HD1 ILE 122 4.971 0.113 1.944 817 3HD1 ILE 122 3HD1 ILE 122 3.486 0.909 2.467 818 H GLN 123 H GLN 123 7.086 -3.187 5.180 819 HA GLN 123 HA GLN 123 7.111 -0.834 6.900 820 1HB GLN 123 2HB GLN 123 6.951 -3.095 8.198 821 2HB GLN 123 1HB GLN 123 8.630 -3.299 7.723 822 1HG GLN 123 2HG GLN 123 9.268 -1.305 8.868 823 2HG GLN 123 1HG GLN 123 7.589 -0.908 9.212 824 1HE2 GLN 123 1HE2 GLN 123 9.621 -1.127 11.070 825 2HE2 GLN 123 2HE2 GLN 123 9.254 -2.390 12.187 826 H VAL 124 H VAL 124 8.738 0.457 6.416 827 HA VAL 124 HA VAL 124 10.630 -0.460 4.355 828 HB VAL 124 HB VAL 124 9.929 2.379 5.147 829 1HG1 VAL 124 1HG1 VAL 124 11.005 3.019 3.042 830 2HG1 VAL 124 2HG1 VAL 124 11.456 1.339 2.765 831 3HG1 VAL 124 3HG1 VAL 124 12.128 2.216 4.139 832 1HG2 VAL 124 1HG2 VAL 124 7.986 1.249 4.197 833 2HG2 VAL 124 2HG2 VAL 124 8.943 0.754 2.800 834 3HG2 VAL 124 3HG2 VAL 124 8.611 2.463 3.080 835 H THR 125 H THR 125 12.689 -0.817 4.909 836 HA THR 125 HA THR 125 13.877 0.883 6.939 837 HB THR 125 HB THR 125 13.073 -1.358 7.958 838 HG1 THR 125 1HG THR 125 14.625 -0.151 8.989 839 1HG2 THR 125 1HG2 THR 125 13.761 -2.786 6.062 840 2HG2 THR 125 2HG2 THR 125 14.512 -3.297 7.590 841 3HG2 THR 125 3HG2 THR 125 15.439 -2.351 6.425 842 HA PRO 126 HA PRO 126 17.260 1.064 3.976 843 1HB PRO 126 2HB PRO 126 19.415 1.160 5.594 844 2HB PRO 126 1HB PRO 126 18.279 2.515 5.453 845 1HG PRO 126 2HG PRO 126 18.231 0.267 7.449 846 2HG PRO 126 1HG PRO 126 18.305 2.022 7.816 847 1HD PRO 126 2HD PRO 126 16.023 0.782 7.893 848 2HD PRO 126 1HD PRO 126 16.106 2.304 6.969 849 H LYS 127 H LYS 127 19.139 -0.058 3.190 850 HA LYS 127 HA LYS 127 20.213 -2.318 4.379 851 1HB LYS 127 2HB LYS 127 18.220 -3.473 3.757 852 2HB LYS 127 1HB LYS 127 18.208 -2.853 2.138 853 1HG LYS 127 2HG LYS 127 20.250 -4.241 1.690 854 2HG LYS 127 1HG LYS 127 20.086 -4.908 3.321 855 1HD LYS 127 2HD LYS 127 17.816 -5.685 2.762 856 2HD LYS 127 1HD LYS 127 17.990 -5.021 1.150 857 1HE LYS 127 2HE LYS 127 19.855 -6.564 0.716 858 2HE LYS 127 1HE LYS 127 19.670 -7.237 2.334 859 1HZ LYS 127 1HZ LYS 127 17.455 -8.030 1.728 860 2HZ LYS 127 2HZ LYS 127 18.588 -8.582 0.621 861 3HZ LYS 127 3HZ LYS 127 17.582 -7.312 0.210 862 HA PRO 128 HA PRO 128 22.607 -1.368 0.290 863 1HB PRO 128 2HB PRO 128 20.857 0.603 -1.077 864 2HB PRO 128 1HB PRO 128 21.815 -0.706 -1.776 865 1HG PRO 128 2HG PRO 128 19.175 -0.903 -1.642 866 2HG PRO 128 1HG PRO 128 20.205 -2.310 -1.310 867 1HD PRO 128 2HD PRO 128 18.781 -0.512 0.620 868 2HD PRO 128 1HD PRO 128 18.970 -2.290 0.589 869 H GLY 129 H GLY 129 20.443 1.457 0.863 870 1HA GLY 129 2HA GLY 129 21.199 2.977 2.685 871 2HA GLY 129 1HA GLY 129 22.801 2.839 1.980 872 H GLY 130 H GLY 130 20.002 4.643 2.117 873 1HA GLY 130 2HA GLY 130 19.562 6.699 1.164 874 2HA GLY 130 1HA GLY 130 20.965 6.489 0.112 875 HA PRO 131 HA PRO 131 17.838 5.570 -2.985 876 1HB PRO 131 2HB PRO 131 19.619 5.034 -5.001 877 2HB PRO 131 1HB PRO 131 19.069 6.666 -4.608 878 1HG PRO 131 2HG PRO 131 21.612 5.289 -3.883 879 2HG PRO 131 1HG PRO 131 21.342 6.988 -4.308 880 1HD PRO 131 2HD PRO 131 21.678 6.108 -1.754 881 2HD PRO 131 1HD PRO 131 20.716 7.545 -2.162 882 H GLY 132 H GLY 132 17.253 3.741 -1.956 883 1HA GLY 132 2HA GLY 132 17.180 1.357 -2.842 884 2HA GLY 132 1HA GLY 132 18.876 1.352 -2.350 885 H SER 133 H SER 133 15.635 1.422 -1.309 886 HA SER 133 HA SER 133 16.515 0.662 1.376 887 1HB SER 133 2HB SER 133 14.151 2.412 0.671 888 2HB SER 133 1HB SER 133 14.576 1.855 2.289 889 HG SER 133 HG SER 133 15.842 3.716 0.627 890 H ILE 134 H ILE 134 15.006 -0.840 2.409 891 HA ILE 134 HA ILE 134 13.801 -2.388 0.306 892 HB ILE 134 HB ILE 134 14.726 -3.189 3.048 893 1HG1 ILE 134 2HG1 ILE 134 16.410 -2.795 1.382 894 2HG1 ILE 134 1HG1 ILE 134 16.259 -4.514 1.844 895 1HG2 ILE 134 1HG2 ILE 134 14.143 -5.492 2.428 896 2HG2 ILE 134 2HG2 ILE 134 13.414 -4.896 0.935 897 3HG2 ILE 134 3HG2 ILE 134 12.707 -4.465 2.492 898 1HD1 ILE 134 1HD1 ILE 134 15.274 -3.223 -0.700 899 2HD1 ILE 134 2HD1 ILE 134 15.069 -4.921 -0.257 900 3HD1 ILE 134 3HD1 ILE 134 16.679 -4.267 -0.531 901 H VAL 135 H VAL 135 11.696 -2.568 0.319 902 HA VAL 135 HA VAL 135 10.221 -1.908 2.747 903 HB VAL 135 HB VAL 135 9.467 -0.478 0.894 904 1HG1 VAL 135 1HG1 VAL 135 8.795 -2.978 -0.594 905 2HG1 VAL 135 2HG1 VAL 135 10.065 -1.825 -0.999 906 3HG1 VAL 135 3HG1 VAL 135 8.371 -1.339 -1.089 907 1HG2 VAL 135 1HG2 VAL 135 7.403 -2.564 1.561 908 2HG2 VAL 135 2HG2 VAL 135 7.065 -0.959 0.911 909 3HG2 VAL 135 3HG2 VAL 135 7.781 -1.130 2.516 910 H HIS 136 H HIS 136 9.570 -3.478 3.883 911 HA HIS 136 HA HIS 136 9.583 -6.150 2.742 912 1HB HIS 136 2HB HIS 136 9.300 -5.170 5.585 913 2HB HIS 136 1HB HIS 136 9.222 -6.863 5.142 914 HD1 HIS 136 1HD HIS 136 11.486 -8.036 4.589 915 HD2 HIS 136 2HD HIS 136 11.855 -4.005 5.554 916 HE1 HIS 136 1HE HIS 136 13.923 -7.656 4.952 917 HE2 HIS 136 2HE HIS 136 14.060 -5.347 5.864 918 H TRP 137 H TRP 137 7.799 -6.932 1.905 919 HA TRP 137 HA TRP 137 5.234 -5.858 2.744 920 1HB TRP 137 2HB TRP 137 6.019 -7.585 0.381 921 2HB TRP 137 1HB TRP 137 4.391 -7.098 0.769 922 HD1 TRP 137 HD TRP 137 7.772 -5.311 -0.150 923 HE1 TRP 137 1HE TRP 137 7.167 -3.241 -1.493 924 HE3 TRP 137 3HE TRP 137 2.664 -5.613 0.088 925 HZ2 TRP 137 2HZ TRP 137 4.872 -1.872 -2.342 926 HZ3 TRP 137 3HZ TRP 137 1.350 -3.863 -1.026 927 HH2 TRP 137 HH TRP 137 2.427 -2.040 -2.203 928 H HIS 138 H HIS 138 4.137 -6.963 4.166 929 HA HIS 138 HA HIS 138 4.434 -9.869 4.239 930 1HB HIS 138 2HB HIS 138 5.106 -8.829 6.374 931 2HB HIS 138 1HB HIS 138 3.621 -7.898 6.403 932 HD1 HIS 138 1HD HIS 138 5.011 -11.309 7.153 933 HD2 HIS 138 2HD HIS 138 1.411 -9.258 7.280 934 HE1 HIS 138 1HE HIS 138 3.480 -12.752 8.508 935 HE2 HIS 138 2HE HIS 138 1.268 -11.583 8.516 936 H LEU 139 H LEU 139 2.781 -10.722 3.109 937 HA LEU 139 HA LEU 139 0.191 -9.362 3.218 938 1HB LEU 139 2HB LEU 139 1.195 -11.471 1.279 939 2HB LEU 139 1HB LEU 139 -0.380 -10.723 1.231 940 HG LEU 139 HG LEU 139 0.827 -8.520 0.723 941 1HD1 LEU 139 1HD1 LEU 139 3.040 -9.074 1.484 942 2HD1 LEU 139 2HD1 LEU 139 3.049 -8.634 -0.224 943 3HD1 LEU 139 3HD1 LEU 139 3.173 -10.327 0.256 944 1HD2 LEU 139 1HD2 LEU 139 1.095 -10.788 -1.237 945 2HD2 LEU 139 2HD2 LEU 139 1.121 -9.070 -1.635 946 3HD2 LEU 139 3HD2 LEU 139 -0.343 -9.801 -0.977 947 H GLU 140 H GLU 140 -1.421 -10.396 4.265 948 HA GLU 140 HA GLU 140 -1.021 -13.220 4.885 949 1HB GLU 140 2HB GLU 140 -0.253 -11.697 6.756 950 2HB GLU 140 1HB GLU 140 -1.906 -11.130 6.882 951 1HG GLU 140 2HG GLU 140 -2.646 -13.320 7.545 952 2HG GLU 140 1HG GLU 140 -1.034 -13.980 7.265 953 H TYR 141 H TYR 141 -2.852 -14.339 4.524 954 HA TYR 141 HA TYR 141 -5.361 -12.967 4.340 955 1HB TYR 141 2HB TYR 141 -5.646 -13.503 1.907 956 2HB TYR 141 1HB TYR 141 -4.469 -12.254 2.330 957 HD1 TYR 141 1HD TYR 141 -2.135 -12.514 1.825 958 HD2 TYR 141 2HD TYR 141 -4.848 -15.697 1.103 959 HE1 TYR 141 1HE TYR 141 -0.409 -13.669 0.534 960 HE2 TYR 141 2HE TYR 141 -3.169 -16.858 -0.190 961 HH TYR 141 HH TYR 141 0.134 -15.991 -0.189 962 H GLU 142 H GLU 142 -7.073 -14.391 3.491 963 HA GLU 142 HA GLU 142 -6.507 -17.178 4.224 964 1HB GLU 142 2HB GLU 142 -7.818 -16.032 5.953 965 2HB GLU 142 1HB GLU 142 -9.025 -15.602 4.753 966 1HG GLU 142 2HG GLU 142 -9.533 -17.942 4.404 967 2HG GLU 142 1HG GLU 142 -8.301 -18.397 5.582 968 H LYS 143 H LYS 143 -6.791 -18.539 2.565 969 HA LYS 143 HA LYS 143 -7.977 -17.815 0.107 970 1HB LYS 143 2HB LYS 143 -7.195 -20.487 1.264 971 2HB LYS 143 1HB LYS 143 -8.041 -20.374 -0.259 972 1HG LYS 143 2HG LYS 143 -5.716 -20.720 -0.653 973 2HG LYS 143 1HG LYS 143 -6.127 -19.089 -1.155 974 1HD LYS 143 2HD LYS 143 -5.118 -18.204 0.854 975 2HD LYS 143 1HD LYS 143 -4.804 -19.839 1.443 976 1HE LYS 143 2HE LYS 143 -3.719 -18.680 -1.111 977 2HE LYS 143 1HE LYS 143 -2.803 -18.811 0.397 978 1HZ LYS 143 1HZ LYS 143 -2.290 -20.607 -1.111 979 2HZ LYS 143 2HZ LYS 143 -3.877 -21.082 -1.230 980 3HZ LYS 143 3HZ LYS 143 -3.067 -21.250 0.237 981 H ILE 144 H ILE 144 -10.048 -18.141 -0.604 982 HA ILE 144 HA ILE 144 -12.064 -19.041 1.271 983 HB ILE 144 HB ILE 144 -12.441 -18.839 -1.728 984 1HG1 ILE 144 2HG1 ILE 144 -12.461 -16.558 0.279 985 2HG1 ILE 144 1HG1 ILE 144 -11.395 -16.754 -1.098 986 1HG2 ILE 144 1HG2 ILE 144 -14.260 -18.382 0.624 987 2HG2 ILE 144 2HG2 ILE 144 -14.215 -19.836 -0.389 988 3HG2 ILE 144 3HG2 ILE 144 -14.735 -18.287 -1.082 989 1HD1 ILE 144 1HD1 ILE 144 -13.082 -15.107 -1.428 990 2HD1 ILE 144 2HD1 ILE 144 -14.317 -16.326 -1.125 991 3HD1 ILE 144 3HD1 ILE 144 -13.303 -16.463 -2.582 992 H SER 145 H SER 145 -10.195 -20.130 -1.342 993 HA SER 145 HA SER 145 -10.275 -22.831 -0.703 994 1HB SER 145 2HB SER 145 -12.421 -22.617 -1.984 995 2HB SER 145 1HB SER 145 -11.556 -21.866 -3.312 996 HG SER 145 HG SER 145 -12.014 -24.397 -2.942 997 H GLU 146 H GLU 146 -8.604 -23.783 -2.253 998 HA GLU 146 HA GLU 146 -6.392 -22.019 -2.434 999 1HB GLU 146 2HB GLU 146 -6.925 -24.646 -3.587 1000 2HB GLU 146 1HB GLU 146 -5.367 -23.860 -3.747 1001 1HG GLU 146 2HG GLU 146 -6.686 -24.695 -1.145 1002 2HG GLU 146 1HG GLU 146 -5.287 -25.467 -1.892 1003 H GLU 147 H GLU 147 -8.168 -23.645 -5.007 1004 HA GLU 147 HA GLU 147 -6.720 -22.531 -7.126 1005 1HB GLU 147 2HB GLU 147 -9.463 -23.760 -7.112 1006 2HB GLU 147 1HB GLU 147 -8.494 -23.449 -8.548 1007 1HG GLU 147 2HG GLU 147 -6.797 -24.967 -7.789 1008 2HG GLU 147 1HG GLU 147 -7.643 -25.229 -6.276 1009 H VAL 148 H VAL 148 -9.155 -21.222 -5.282 1010 HA VAL 148 HA VAL 148 -9.999 -19.358 -7.402 1011 HB VAL 148 HB VAL 148 -11.731 -20.153 -5.709 1012 1HG1 VAL 148 1HG1 VAL 148 -11.883 -19.141 -3.570 1013 2HG1 VAL 148 2HG1 VAL 148 -10.328 -18.334 -3.807 1014 3HG1 VAL 148 3HG1 VAL 148 -10.412 -20.097 -3.721 1015 1HG2 VAL 148 1HG2 VAL 148 -11.381 -17.166 -5.907 1016 2HG2 VAL 148 2HG2 VAL 148 -12.871 -17.998 -5.459 1017 3HG2 VAL 148 3HG2 VAL 148 -12.199 -18.206 -7.073 1018 H ALA 149 H ALA 149 -7.636 -19.503 -5.035 1019 HA ALA 149 HA ALA 149 -7.297 -16.633 -4.743 1020 1HB ALA 149 1HB ALA 149 -6.991 -18.043 -2.798 1021 2HB ALA 149 2HB ALA 149 -5.458 -17.298 -3.261 1022 3HB ALA 149 3HB ALA 149 -5.763 -18.987 -3.651 1023 H HIS 150 H HIS 150 -5.198 -15.646 -5.275 1024 HA HIS 150 HA HIS 150 -3.578 -17.053 -7.248 1025 1HB HIS 150 2HB HIS 150 -4.920 -14.399 -7.865 1026 2HB HIS 150 1HB HIS 150 -3.656 -15.128 -8.832 1027 HD1 HIS 150 1HD HIS 150 -4.425 -16.658 -10.679 1028 HD2 HIS 150 2HD HIS 150 -7.432 -15.891 -7.924 1029 HE1 HIS 150 1HE HIS 150 -6.512 -17.633 -11.672 1030 HE2 HIS 150 2HE HIS 150 -8.347 -16.939 -10.076 1031 HA PRO 151 HA PRO 151 -0.973 -14.612 -4.283 1032 1HB PRO 151 2HB PRO 151 0.944 -16.675 -5.244 1033 2HB PRO 151 1HB PRO 151 0.624 -16.131 -3.593 1034 1HG PRO 151 2HG PRO 151 -0.271 -18.496 -4.420 1035 2HG PRO 151 1HG PRO 151 -1.259 -17.465 -3.373 1036 1HD PRO 151 2HD PRO 151 -1.507 -17.961 -6.311 1037 2HD PRO 151 1HD PRO 151 -2.763 -17.767 -5.063 1038 H GLU 152 H GLU 152 -0.663 -15.608 -7.524 1039 HA GLU 152 HA GLU 152 1.707 -14.413 -8.452 1040 1HB GLU 152 2HB GLU 152 -0.897 -14.675 -9.925 1041 2HB GLU 152 1HB GLU 152 0.705 -14.600 -10.624 1042 1HG GLU 152 2HG GLU 152 -0.319 -16.794 -8.872 1043 2HG GLU 152 1HG GLU 152 -0.315 -16.824 -10.623 1044 H THR 153 H THR 153 -1.644 -13.234 -8.317 1045 HA THR 153 HA THR 153 -1.058 -10.800 -9.635 1046 HB THR 153 HB THR 153 -3.450 -10.299 -9.251 1047 HG1 THR 153 1HG THR 153 -4.570 -12.223 -8.209 1048 1HG2 THR 153 1HG2 THR 153 -2.827 -11.774 -11.117 1049 2HG2 THR 153 2HG2 THR 153 -4.378 -12.268 -10.427 1050 3HG2 THR 153 3HG2 THR 153 -2.911 -13.164 -10.036 1051 H LEU 154 H LEU 154 -1.289 -11.885 -6.383 1052 HA LEU 154 HA LEU 154 -1.528 -9.439 -5.012 1053 1HB LEU 154 2HB LEU 154 -0.011 -11.897 -4.174 1054 2HB LEU 154 1HB LEU 154 -0.525 -10.599 -3.121 1055 HG LEU 154 HG LEU 154 -2.308 -12.534 -4.573 1056 1HD1 LEU 154 1HD1 LEU 154 -2.848 -13.311 -2.323 1057 2HD1 LEU 154 2HD1 LEU 154 -1.684 -12.174 -1.652 1058 3HD1 LEU 154 3HD1 LEU 154 -1.125 -13.488 -2.666 1059 1HD2 LEU 154 1HD2 LEU 154 -3.362 -10.333 -4.437 1060 2HD2 LEU 154 2HD2 LEU 154 -2.999 -10.272 -2.710 1061 3HD2 LEU 154 3HD2 LEU 154 -4.130 -11.472 -3.317 1062 H LEU 155 H LEU 155 1.324 -11.219 -6.123 1063 HA LEU 155 HA LEU 155 3.181 -9.359 -5.129 1064 1HB LEU 155 2HB LEU 155 3.427 -11.305 -7.404 1065 2HB LEU 155 1HB LEU 155 4.761 -10.361 -6.765 1066 HG LEU 155 HG LEU 155 3.195 -12.456 -5.263 1067 1HD1 LEU 155 1HD1 LEU 155 6.005 -12.395 -6.304 1068 2HD1 LEU 155 2HD1 LEU 155 4.680 -13.367 -6.945 1069 3HD1 LEU 155 3HD1 LEU 155 5.302 -13.686 -5.319 1070 1HD2 LEU 155 1HD2 LEU 155 5.558 -10.779 -4.407 1071 2HD2 LEU 155 2HD2 LEU 155 4.876 -12.128 -3.503 1072 3HD2 LEU 155 3HD2 LEU 155 3.920 -10.672 -3.755 1073 H GLN 156 H GLN 156 1.539 -9.628 -8.210 1074 HA GLN 156 HA GLN 156 2.821 -7.533 -9.574 1075 1HB GLN 156 2HB GLN 156 -0.080 -8.360 -9.779 1076 2HB GLN 156 1HB GLN 156 0.805 -7.411 -10.962 1077 1HG GLN 156 2HG GLN 156 1.491 -10.210 -10.166 1078 2HG GLN 156 1HG GLN 156 0.505 -9.816 -11.590 1079 1HE2 GLN 156 1HE2 GLN 156 2.292 -7.461 -12.124 1080 2HE2 GLN 156 2HE2 GLN 156 3.734 -8.131 -12.749 1081 H PHE 157 H PHE 157 -0.038 -7.536 -7.468 1082 HA PHE 157 HA PHE 157 -0.654 -4.809 -7.553 1083 1HB PHE 157 2HB PHE 157 -2.171 -6.479 -6.566 1084 2HB PHE 157 1HB PHE 157 -1.018 -6.801 -5.287 1085 HD1 PHE 157 1HD PHE 157 -1.315 -5.739 -3.237 1086 HD2 PHE 157 2HD PHE 157 -3.005 -3.996 -6.736 1087 HE1 PHE 157 1HE PHE 157 -2.452 -3.977 -1.830 1088 HE2 PHE 157 2HE PHE 157 -4.110 -2.277 -5.355 1089 HZ PHE 157 HZ PHE 157 -3.825 -2.282 -2.915 1090 H CYS 158 H CYS 158 1.543 -6.620 -5.485 1091 HA CYS 158 HA CYS 158 2.362 -4.492 -3.857 1092 1HB CYS 158 2HB CYS 158 3.930 -6.947 -4.674 1093 2HB CYS 158 1HB CYS 158 4.332 -5.882 -3.332 1094 HG CYS 158 HG CYS 158 1.559 -7.847 -3.589 1095 H VAL 159 H VAL 159 3.729 -5.749 -6.892 1096 HA VAL 159 HA VAL 159 5.948 -4.027 -7.010 1097 HB VAL 159 HB VAL 159 4.443 -5.128 -9.398 1098 1HG1 VAL 159 1HG1 VAL 159 7.290 -4.199 -9.096 1099 2HG1 VAL 159 2HG1 VAL 159 6.005 -3.395 -9.991 1100 3HG1 VAL 159 3HG1 VAL 159 6.626 -4.954 -10.543 1101 1HG2 VAL 159 1HG2 VAL 159 6.049 -7.007 -9.343 1102 2HG2 VAL 159 2HG2 VAL 159 5.009 -6.966 -7.938 1103 3HG2 VAL 159 3HG2 VAL 159 6.683 -6.404 -7.806 1104 H GLU 160 H GLU 160 2.687 -3.677 -8.337 1105 HA GLU 160 HA GLU 160 3.213 -1.228 -9.620 1106 1HB GLU 160 2HB GLU 160 0.589 -2.419 -8.760 1107 2HB GLU 160 1HB GLU 160 0.743 -0.956 -9.724 1108 1HG GLU 160 2HG GLU 160 1.673 -3.706 -10.482 1109 2HG GLU 160 1HG GLU 160 0.292 -2.840 -11.150 1110 H VAL 161 H VAL 161 2.077 -1.941 -6.383 1111 HA VAL 161 HA VAL 161 1.663 0.819 -5.804 1112 HB VAL 161 HB VAL 161 1.958 -1.562 -3.960 1113 1HG1 VAL 161 1HG1 VAL 161 1.001 -0.102 -2.186 1114 2HG1 VAL 161 2HG1 VAL 161 1.044 1.260 -3.304 1115 3HG1 VAL 161 3HG1 VAL 161 2.548 0.522 -2.762 1116 1HG2 VAL 161 1HG2 VAL 161 -0.013 -1.659 -5.361 1117 2HG2 VAL 161 2HG2 VAL 161 -0.481 -0.034 -4.862 1118 3HG2 VAL 161 3HG2 VAL 161 -0.479 -1.350 -3.689 1119 H SER 162 H SER 162 4.357 -1.419 -5.522 1120 HA SER 162 HA SER 162 6.084 0.074 -3.925 1121 1HB SER 162 2HB SER 162 6.742 -1.785 -6.206 1122 2HB SER 162 1HB SER 162 7.900 -1.162 -5.027 1123 HG SER 162 HG SER 162 5.613 -2.762 -4.478 1124 H LYS 163 H LYS 163 5.690 0.135 -7.445 1125 HA LYS 163 HA LYS 163 7.667 2.113 -7.838 1126 1HB LYS 163 2HB LYS 163 6.749 2.346 -10.135 1127 2HB LYS 163 1HB LYS 163 7.080 0.685 -9.675 1128 1HG LYS 163 2HG LYS 163 4.670 0.399 -9.186 1129 2HG LYS 163 1HG LYS 163 4.396 2.026 -9.797 1130 1HD LYS 163 2HD LYS 163 3.900 0.359 -11.519 1131 2HD LYS 163 1HD LYS 163 5.290 1.349 -11.976 1132 1HE LYS 163 2HE LYS 163 6.811 -0.420 -11.390 1133 2HE LYS 163 1HE LYS 163 5.501 -1.367 -10.688 1134 1HZ LYS 163 1HZ LYS 163 5.639 -0.631 -13.565 1135 2HZ LYS 163 2HZ LYS 163 4.552 -1.676 -12.792 1136 3HZ LYS 163 3HZ LYS 163 6.183 -2.104 -12.931 1137 H GLU 164 H GLU 164 4.273 2.361 -7.074 1138 HA GLU 164 HA GLU 164 3.978 5.130 -7.644 1139 1HB GLU 164 2HB GLU 164 2.459 3.301 -5.807 1140 2HB GLU 164 1HB GLU 164 1.986 4.954 -6.137 1141 1HG GLU 164 2HG GLU 164 2.199 2.762 -8.194 1142 2HG GLU 164 1HG GLU 164 0.703 3.368 -7.483 1143 H ILE 165 H ILE 165 4.513 3.344 -4.635 1144 HA ILE 165 HA ILE 165 4.611 5.658 -3.006 1145 HB ILE 165 HB ILE 165 4.044 3.341 -2.250 1146 1HG1 ILE 165 2HG1 ILE 165 4.637 5.039 -0.508 1147 2HG1 ILE 165 1HG1 ILE 165 4.963 3.400 -0.001 1148 1HG2 ILE 165 1HG2 ILE 165 5.800 1.734 -1.624 1149 2HG2 ILE 165 2HG2 ILE 165 6.979 2.765 -2.436 1150 3HG2 ILE 165 3HG2 ILE 165 5.665 2.039 -3.359 1151 1HD1 ILE 165 1HD1 ILE 165 7.006 5.403 -0.941 1152 2HD1 ILE 165 2HD1 ILE 165 7.350 3.753 -0.423 1153 3HD1 ILE 165 3HD1 ILE 165 6.704 4.923 0.730 1154 H ASP 166 H ASP 166 7.017 3.797 -4.687 1155 HA ASP 166 HA ASP 166 9.415 4.917 -3.780 1156 1HB ASP 166 2HB ASP 166 9.278 2.947 -5.204 1157 2HB ASP 166 1HB ASP 166 8.606 3.908 -6.508 1158 H GLU 167 H GLU 167 7.379 5.884 -6.604 1159 HA GLU 167 HA GLU 167 8.880 8.152 -7.323 1160 1HB GLU 167 2HB GLU 167 7.286 6.625 -8.640 1161 2HB GLU 167 1HB GLU 167 5.995 7.492 -7.844 1162 1HG GLU 167 2HG GLU 167 8.066 8.667 -9.659 1163 2HG GLU 167 1HG GLU 167 6.423 8.171 -10.082 1164 H HIS 168 H HIS 168 6.177 7.565 -5.164 1165 HA HIS 168 HA HIS 168 5.395 10.240 -4.860 1166 1HB HIS 168 2HB HIS 168 4.035 8.298 -4.091 1167 2HB HIS 168 1HB HIS 168 5.188 8.035 -2.792 1168 HD1 HIS 168 1HD HIS 168 2.154 9.895 -3.642 1169 HD2 HIS 168 2HD HIS 168 5.190 10.224 -0.827 1170 HE1 HIS 168 1HE HIS 168 1.275 11.427 -1.851 1171 HE2 HIS 168 2HE HIS 168 2.979 11.240 -0.039 1172 H LEU 169 H LEU 169 7.952 8.396 -3.256 1173 HA LEU 169 HA LEU 169 8.431 10.466 -1.329 1174 1HB LEU 169 2HB LEU 169 10.107 8.067 -2.032 1175 2HB LEU 169 1HB LEU 169 10.404 9.139 -0.682 1176 HG LEU 169 HG LEU 169 8.025 7.320 -1.027 1177 1HD1 LEU 169 1HD1 LEU 169 10.343 7.213 0.899 1178 2HD1 LEU 169 2HD1 LEU 169 10.107 6.175 -0.502 1179 3HD1 LEU 169 3HD1 LEU 169 8.978 6.093 0.842 1180 1HD2 LEU 169 1HD2 LEU 169 7.414 8.003 1.250 1181 2HD2 LEU 169 2HD2 LEU 169 7.388 9.372 0.146 1182 3HD2 LEU 169 3HD2 LEU 169 8.738 9.166 1.260 1183 H LEU 170 H LEU 170 9.962 9.465 -4.321 1184 HA LEU 170 HA LEU 170 12.054 11.447 -3.987 1185 1HB LEU 170 2HB LEU 170 11.372 9.699 -6.328 1186 2HB LEU 170 1HB LEU 170 12.788 10.726 -6.208 1187 HG LEU 170 HG LEU 170 12.150 8.388 -4.441 1188 1HD1 LEU 170 1HD1 LEU 170 12.765 7.662 -6.646 1189 2HD1 LEU 170 2HD1 LEU 170 14.130 7.422 -5.540 1190 3HD1 LEU 170 3HD1 LEU 170 14.149 8.776 -6.662 1191 1HD2 LEU 170 1HD2 LEU 170 14.520 8.731 -3.658 1192 2HD2 LEU 170 2HD2 LEU 170 13.401 10.023 -3.203 1193 3HD2 LEU 170 3HD2 LEU 170 14.511 10.245 -4.546 1194 H ALA 171 H ALA 171 9.181 10.990 -5.921 1195 HA ALA 171 HA ALA 171 8.091 12.156 -7.370 1196 1HB ALA 171 1HB ALA 171 8.833 14.466 -5.581 1197 2HB ALA 171 2HB ALA 171 7.524 13.313 -5.328 1198 3HB ALA 171 3HB ALA 171 7.455 14.413 -6.707 1199 H GLU 172 H GLU 172 9.387 11.696 -9.039 1200 HA GLU 172 HA GLU 172 11.513 13.580 -9.634 1201 1HB GLU 172 2HB GLU 172 12.280 11.956 -11.352 1202 2HB GLU 172 1HB GLU 172 12.262 11.316 -9.720 1203 1HG GLU 172 2HG GLU 172 10.218 10.088 -10.207 1204 2HG GLU 172 1HG GLU 172 10.174 10.786 -11.827 1205 H GLU 173 H GLU 173 11.908 14.256 -11.831 1206 HA GLU 173 HA GLU 173 9.755 14.421 -13.679 1207 1HB GLU 173 2HB GLU 173 9.084 16.095 -11.998 1208 2HB GLU 173 1HB GLU 173 10.653 16.858 -12.130 1209 1HG GLU 173 2HG GLU 173 10.166 17.424 -14.468 1210 2HG GLU 173 1HG GLU 173 8.575 16.679 -14.295 Start of MODEL 14 1 H THR 17 H THR 17 -1.055 -24.691 -7.882 2 HA THR 17 HA THR 17 -0.473 -23.536 -5.330 3 HB THR 17 HB THR 17 -2.288 -22.520 -7.519 4 HG1 THR 17 1HG THR 17 0.480 -22.326 -7.021 5 1HG2 THR 17 1HG2 THR 17 -2.686 -21.515 -5.300 6 2HG2 THR 17 2HG2 THR 17 -1.974 -20.347 -6.415 7 3HG2 THR 17 3HG2 THR 17 -0.972 -21.111 -5.180 8 H GLU 18 H GLU 18 -1.438 -25.109 -3.985 9 HA GLU 18 HA GLU 18 -4.164 -24.372 -3.543 10 1HB GLU 18 2HB GLU 18 -4.881 -26.622 -2.931 11 2HB GLU 18 1HB GLU 18 -4.531 -26.511 -4.650 12 1HG GLU 18 2HG GLU 18 -2.782 -27.788 -2.530 13 2HG GLU 18 1HG GLU 18 -3.870 -28.655 -3.600 14 H ALA 19 H ALA 19 -4.885 -24.968 -1.336 15 HA ALA 19 HA ALA 19 -2.794 -25.293 0.585 16 1HB ALA 19 1HB ALA 19 -4.232 -22.674 0.314 17 2HB ALA 19 2HB ALA 19 -2.526 -22.964 -0.022 18 3HB ALA 19 3HB ALA 19 -3.141 -23.109 1.637 19 H SER 20 H SER 20 -3.914 -26.853 1.541 20 HA SER 20 HA SER 20 -6.702 -26.778 1.898 21 1HB SER 20 2HB SER 20 -4.632 -28.592 3.122 22 2HB SER 20 1HB SER 20 -6.374 -28.892 3.052 23 HG SER 20 HG SER 20 -5.755 -28.316 0.614 24 H SER 21 H SER 21 -4.007 -25.731 3.802 25 HA SER 21 HA SER 21 -5.252 -25.550 6.336 26 1HB SER 21 2HB SER 21 -3.072 -23.779 5.216 27 2HB SER 21 1HB SER 21 -3.398 -24.117 6.914 28 HG SER 21 HG SER 21 -2.875 -26.302 6.502 29 H LEU 22 H LEU 22 -5.853 -23.886 3.444 30 HA LEU 22 HA LEU 22 -6.914 -22.135 2.722 31 1HB LEU 22 2HB LEU 22 -8.296 -22.159 5.390 32 2HB LEU 22 1HB LEU 22 -8.818 -21.351 3.936 33 HG LEU 22 HG LEU 22 -8.453 -24.338 4.073 34 1HD1 LEU 22 1HD1 LEU 22 -10.851 -24.469 4.121 35 2HD1 LEU 22 2HD1 LEU 22 -10.941 -22.699 4.300 36 3HD1 LEU 22 3HD1 LEU 22 -10.158 -23.695 5.548 37 1HD2 LEU 22 1HD2 LEU 22 -9.751 -24.313 1.989 38 2HD2 LEU 22 2HD2 LEU 22 -8.240 -23.430 1.820 39 3HD2 LEU 22 3HD2 LEU 22 -9.758 -22.550 2.020 40 H VAL 23 H VAL 23 -5.466 -21.433 5.806 41 HA VAL 23 HA VAL 23 -5.406 -18.627 5.192 42 HB VAL 23 HB VAL 23 -5.465 -19.411 7.542 43 1HG1 VAL 23 1HG1 VAL 23 -2.716 -20.491 7.012 44 2HG1 VAL 23 2HG1 VAL 23 -4.166 -21.433 7.355 45 3HG1 VAL 23 3HG1 VAL 23 -3.482 -20.385 8.599 46 1HG2 VAL 23 1HG2 VAL 23 -2.950 -17.903 6.855 47 2HG2 VAL 23 2HG2 VAL 23 -3.712 -17.956 8.446 48 3HG2 VAL 23 3HG2 VAL 23 -4.553 -17.210 7.088 49 H GLY 24 H GLY 24 -3.622 -17.462 4.358 50 1HA GLY 24 2HA GLY 24 -1.246 -19.001 3.720 51 2HA GLY 24 1HA GLY 24 -2.147 -18.335 2.372 52 H LYS 25 H LYS 25 0.378 -17.647 2.630 53 HA LYS 25 HA LYS 25 0.345 -14.878 3.580 54 1HB LYS 25 2HB LYS 25 2.549 -16.867 3.950 55 2HB LYS 25 1HB LYS 25 2.693 -15.124 4.004 56 1HG LYS 25 2HG LYS 25 1.197 -15.077 5.920 57 2HG LYS 25 1HG LYS 25 1.118 -16.845 5.883 58 1HD LYS 25 2HD LYS 25 2.825 -16.001 7.488 59 2HD LYS 25 1HD LYS 25 3.498 -17.019 6.215 60 1HE LYS 25 2HE LYS 25 4.223 -14.999 4.970 61 2HE LYS 25 1HE LYS 25 3.535 -13.978 6.225 62 1HZ LYS 25 1HZ LYS 25 5.791 -15.871 6.484 63 2HZ LYS 25 2HZ LYS 25 5.137 -15.035 7.786 64 3HZ LYS 25 3HZ LYS 25 5.913 -14.201 6.531 65 H LEU 26 H LEU 26 1.739 -13.520 2.500 66 HA LEU 26 HA LEU 26 3.513 -14.744 0.652 67 1HB LEU 26 2HB LEU 26 1.639 -14.065 -0.782 68 2HB LEU 26 1HB LEU 26 1.731 -12.436 -0.140 69 HG LEU 26 HG LEU 26 3.992 -12.216 -1.116 70 1HD1 LEU 26 1HD1 LEU 26 4.632 -14.548 -1.224 71 2HD1 LEU 26 2HD1 LEU 26 4.711 -13.811 -2.822 72 3HD1 LEU 26 3HD1 LEU 26 3.362 -14.868 -2.404 73 1HD2 LEU 26 1HD2 LEU 26 2.048 -11.364 -2.242 74 2HD2 LEU 26 2HD2 LEU 26 1.796 -12.930 -3.027 75 3HD2 LEU 26 3HD2 LEU 26 3.247 -11.973 -3.384 76 H GLU 27 H GLU 27 5.439 -13.939 0.844 77 HA GLU 27 HA GLU 27 5.710 -11.316 2.091 78 1HB GLU 27 2HB GLU 27 5.799 -13.234 3.741 79 2HB GLU 27 1HB GLU 27 7.250 -13.771 2.922 80 1HG GLU 27 2HG GLU 27 8.449 -11.867 3.634 81 2HG GLU 27 1HG GLU 27 6.977 -11.074 4.206 82 H THR 28 H THR 28 7.183 -10.087 1.016 83 HA THR 28 HA THR 28 9.260 -11.379 -0.539 84 HB THR 28 HB THR 28 7.262 -11.370 -2.083 85 HG1 THR 28 1HG THR 28 9.384 -11.174 -2.913 86 1HG2 THR 28 1HG2 THR 28 6.143 -9.349 -1.254 87 2HG2 THR 28 2HG2 THR 28 6.453 -9.209 -2.980 88 3HG2 THR 28 3HG2 THR 28 7.466 -8.340 -1.830 89 H ASP 29 H ASP 29 10.729 -9.745 -1.544 90 HA ASP 29 HA ASP 29 10.863 -7.250 0.038 91 1HB ASP 29 2HB ASP 29 13.111 -8.780 -1.322 92 2HB ASP 29 1HB ASP 29 13.269 -7.213 -0.577 93 H VAL 30 H VAL 30 10.273 -5.558 -1.141 94 HA VAL 30 HA VAL 30 11.021 -5.598 -3.972 95 HB VAL 30 HB VAL 30 8.915 -3.843 -2.641 96 1HG1 VAL 30 1HG1 VAL 30 10.021 -2.724 -4.512 97 2HG1 VAL 30 2HG1 VAL 30 8.358 -3.147 -4.922 98 3HG1 VAL 30 3HG1 VAL 30 9.692 -4.116 -5.546 99 1HG2 VAL 30 1HG2 VAL 30 8.593 -6.146 -4.554 100 2HG2 VAL 30 2HG2 VAL 30 7.292 -5.102 -3.966 101 3HG2 VAL 30 3HG2 VAL 30 8.157 -6.162 -2.844 102 H GLU 31 H GLU 31 12.328 -4.009 -4.702 103 HA GLU 31 HA GLU 31 13.562 -2.497 -2.549 104 1HB GLU 31 2HB GLU 31 14.650 -2.734 -5.347 105 2HB GLU 31 1HB GLU 31 15.404 -2.330 -3.793 106 1HG GLU 31 2HG GLU 31 15.111 -4.657 -3.015 107 2HG GLU 31 1HG GLU 31 14.361 -5.034 -4.544 108 H ILE 32 H ILE 32 13.581 -0.320 -2.545 109 HA ILE 32 HA ILE 32 12.169 1.011 -4.735 110 HB ILE 32 HB ILE 32 11.515 2.759 -3.079 111 1HG1 ILE 32 2HG1 ILE 32 12.602 0.804 -1.027 112 2HG1 ILE 32 1HG1 ILE 32 13.305 2.364 -1.427 113 1HG2 ILE 32 1HG2 ILE 32 9.908 1.021 -3.663 114 2HG2 ILE 32 2HG2 ILE 32 9.732 1.466 -1.972 115 3HG2 ILE 32 3HG2 ILE 32 10.560 -0.026 -2.406 116 1HD1 ILE 32 1HD1 ILE 32 12.078 2.456 0.654 117 2HD1 ILE 32 2HD1 ILE 32 10.615 1.905 -0.156 118 3HD1 ILE 32 3HD1 ILE 32 11.307 3.481 -0.557 119 H LYS 33 H LYS 33 12.819 3.479 -4.658 120 HA LYS 33 HA LYS 33 15.741 3.471 -4.825 121 1HB LYS 33 2HB LYS 33 13.673 5.323 -5.956 122 2HB LYS 33 1HB LYS 33 15.402 5.474 -6.230 123 1HG LYS 33 2HG LYS 33 15.408 3.345 -7.406 124 2HG LYS 33 1HG LYS 33 13.679 3.160 -7.087 125 1HD LYS 33 2HD LYS 33 13.254 5.232 -8.339 126 2HD LYS 33 1HD LYS 33 14.976 5.350 -8.693 127 1HE LYS 33 2HE LYS 33 14.922 3.307 -9.925 128 2HE LYS 33 1HE LYS 33 13.241 3.019 -9.478 129 1HZ LYS 33 1HZ LYS 33 13.417 3.910 -11.713 130 2HZ LYS 33 2HZ LYS 33 14.250 5.257 -11.161 131 3HZ LYS 33 3HZ LYS 33 12.643 5.024 -10.707 132 H ALA 34 H ALA 34 13.002 4.948 -3.311 133 HA ALA 34 HA ALA 34 14.485 7.082 -2.096 134 1HB ALA 34 1HB ALA 34 11.773 5.974 -1.398 135 2HB ALA 34 2HB ALA 34 12.085 7.282 -2.538 136 3HB ALA 34 3HB ALA 34 12.446 7.500 -0.825 137 H SER 35 H SER 35 14.523 7.291 0.349 138 HA SER 35 HA SER 35 15.361 4.738 1.468 139 1HB SER 35 2HB SER 35 16.628 6.153 3.095 140 2HB SER 35 1HB SER 35 17.158 6.332 1.422 141 HG SER 35 HG SER 35 16.449 8.235 1.350 142 H ALA 36 H ALA 36 14.925 4.350 3.631 143 HA ALA 36 HA ALA 36 12.243 4.678 4.469 144 1HB ALA 36 1HB ALA 36 13.707 2.835 5.181 145 2HB ALA 36 2HB ALA 36 12.979 3.671 6.571 146 3HB ALA 36 3HB ALA 36 14.652 3.997 6.113 147 H ASP 37 H ASP 37 15.112 6.444 5.020 148 HA ASP 37 HA ASP 37 14.465 8.026 7.222 149 1HB ASP 37 2HB ASP 37 16.714 7.905 6.320 150 2HB ASP 37 1HB ASP 37 16.180 8.639 4.816 151 H LYS 38 H LYS 38 14.037 8.652 3.752 152 HA LYS 38 HA LYS 38 12.722 11.080 4.406 153 1HB LYS 38 2HB LYS 38 12.291 11.497 2.104 154 2HB LYS 38 1HB LYS 38 13.981 11.236 2.446 155 1HG LYS 38 2HG LYS 38 13.783 8.985 1.479 156 2HG LYS 38 1HG LYS 38 12.086 9.332 1.093 157 1HD LYS 38 2HD LYS 38 14.347 11.030 0.371 158 2HD LYS 38 1HD LYS 38 13.724 9.809 -0.795 159 1HE LYS 38 2HE LYS 38 11.512 11.049 -0.656 160 2HE LYS 38 1HE LYS 38 12.275 12.241 0.384 161 1HZ LYS 38 1HZ LYS 38 13.017 11.692 -2.436 162 2HZ LYS 38 2HZ LYS 38 13.738 12.840 -1.441 163 3HZ LYS 38 3HZ LYS 38 12.131 13.007 -1.884 164 H PHE 39 H PHE 39 11.725 7.924 3.759 165 HA PHE 39 HA PHE 39 9.042 8.163 3.123 166 1HB PHE 39 2HB PHE 39 10.184 6.003 3.279 167 2HB PHE 39 1HB PHE 39 10.434 6.231 4.999 168 HD1 PHE 39 1HD PHE 39 7.935 5.498 2.395 169 HD2 PHE 39 2HD PHE 39 8.730 5.672 6.573 170 HE1 PHE 39 1HE PHE 39 5.857 4.253 2.843 171 HE2 PHE 39 2HE PHE 39 6.655 4.434 7.027 172 HZ PHE 39 HZ PHE 39 5.216 3.722 5.158 173 H HIS 40 H HIS 40 10.686 8.683 6.163 174 HA HIS 40 HA HIS 40 8.430 8.905 7.870 175 1HB HIS 40 2HB HIS 40 11.075 10.346 8.109 176 2HB HIS 40 1HB HIS 40 9.869 10.211 9.371 177 HD1 HIS 40 1HD HIS 40 12.973 9.034 8.803 178 HD2 HIS 40 2HD HIS 40 9.404 7.074 9.539 179 HE1 HIS 40 1HE HIS 40 13.614 6.768 9.707 180 HE2 HIS 40 2HE HIS 40 11.404 5.537 9.813 181 H HIS 41 H HIS 41 10.338 11.263 6.120 182 HA HIS 41 HA HIS 41 9.067 13.598 7.076 183 1HB HIS 41 2HB HIS 41 10.598 13.202 4.497 184 2HB HIS 41 1HB HIS 41 10.130 14.756 5.161 185 HD1 HIS 41 1HD HIS 41 11.984 15.870 6.379 186 HD2 HIS 41 2HD HIS 41 12.378 11.745 6.445 187 HE1 HIS 41 1HE HIS 41 14.154 15.406 7.556 188 HE2 HIS 41 2HE HIS 41 14.441 12.917 7.415 189 H MET 42 H MET 42 8.378 11.462 4.447 190 HA MET 42 HA MET 42 6.661 13.246 3.058 191 1HB MET 42 2HB MET 42 6.930 10.259 2.838 192 2HB MET 42 1HB MET 42 5.982 11.256 1.755 193 1HG MET 42 2HG MET 42 8.950 11.615 2.127 194 2HG MET 42 1HG MET 42 8.277 10.506 0.956 195 1HE MET 42 1HE MET 42 8.710 14.285 2.048 196 2HE MET 42 2HE MET 42 6.979 14.393 1.689 197 3HE MET 42 3HE MET 42 8.124 15.136 0.608 198 H PHE 43 H PHE 43 6.067 10.847 5.557 199 HA PHE 43 HA PHE 43 3.211 11.435 5.181 200 1HB PHE 43 2HB PHE 43 4.457 9.011 6.477 201 2HB PHE 43 1HB PHE 43 2.730 9.334 6.416 202 HD1 PHE 43 1HD PHE 43 1.565 9.383 4.220 203 HD2 PHE 43 2HD PHE 43 5.606 8.114 4.603 204 HE1 PHE 43 1HE PHE 43 1.427 8.298 2.022 205 HE2 PHE 43 2HE PHE 43 5.476 7.026 2.406 206 HZ PHE 43 HZ PHE 43 3.385 7.118 1.107 207 H ALA 44 H ALA 44 5.759 11.463 7.625 208 HA ALA 44 HA ALA 44 4.478 13.358 9.214 209 1HB ALA 44 1HB ALA 44 2.934 11.523 9.827 210 2HB ALA 44 2HB ALA 44 3.895 12.058 11.208 211 3HB ALA 44 3HB ALA 44 4.309 10.561 10.374 212 H GLY 45 H GLY 45 6.463 14.264 9.276 213 1HA GLY 45 2HA GLY 45 8.531 12.748 10.722 214 2HA GLY 45 1HA GLY 45 8.876 13.993 9.523 215 H LYS 46 H LYS 46 10.010 15.284 10.902 216 HA LYS 46 HA LYS 46 8.762 16.215 13.322 217 1HB LYS 46 2HB LYS 46 10.711 17.623 13.683 218 2HB LYS 46 1HB LYS 46 11.258 16.051 13.160 219 1HG LYS 46 2HG LYS 46 11.082 18.487 11.381 220 2HG LYS 46 1HG LYS 46 12.535 17.961 12.219 221 1HD LYS 46 2HD LYS 46 12.442 15.841 10.967 222 2HD LYS 46 1HD LYS 46 11.015 16.436 10.108 223 1HE LYS 46 2HE LYS 46 13.020 16.735 8.773 224 2HE LYS 46 1HE LYS 46 12.311 18.286 9.219 225 1HZ LYS 46 1HZ LYS 46 14.655 17.017 10.549 226 2HZ LYS 46 2HZ LYS 46 13.962 18.463 10.993 227 3HZ LYS 46 3HZ LYS 46 14.707 18.328 9.497 228 HA PRO 47 HA PRO 47 6.160 19.570 12.137 229 1HB PRO 47 2HB PRO 47 8.071 21.274 13.682 230 2HB PRO 47 1HB PRO 47 6.303 21.271 13.703 231 1HG PRO 47 2HG PRO 47 7.648 20.066 15.630 232 2HG PRO 47 1HG PRO 47 6.185 19.328 14.956 233 1HD PRO 47 2HD PRO 47 9.026 18.550 14.602 234 2HD PRO 47 1HD PRO 47 7.561 17.553 14.548 235 H HIS 48 H HIS 48 9.612 20.465 12.009 236 HA HIS 48 HA HIS 48 9.112 22.343 9.886 237 1HB HIS 48 2HB HIS 48 10.949 22.810 11.474 238 2HB HIS 48 1HB HIS 48 11.754 21.327 10.980 239 HD1 HIS 48 1HD HIS 48 13.354 21.499 9.028 240 HD2 HIS 48 2HD HIS 48 10.892 24.840 9.328 241 HE1 HIS 48 1HE HIS 48 14.217 23.116 7.359 242 HE2 HIS 48 2HE HIS 48 12.932 25.222 7.796 243 H HIS 49 H HIS 49 8.275 21.288 8.253 244 HA HIS 49 HA HIS 49 9.705 19.036 7.073 245 1HB HIS 49 2HB HIS 49 7.284 18.758 7.401 246 2HB HIS 49 1HB HIS 49 6.975 20.243 6.519 247 HD1 HIS 49 1HD HIS 49 7.300 16.619 6.065 248 HD2 HIS 49 2HD HIS 49 7.600 19.991 3.671 249 HE1 HIS 49 1HE HIS 49 7.095 15.801 3.718 250 HE2 HIS 49 2HE HIS 49 7.475 17.818 2.295 251 H VAL 50 H VAL 50 10.990 19.386 5.329 252 HA VAL 50 HA VAL 50 10.963 21.992 4.108 253 HB VAL 50 HB VAL 50 12.549 19.515 3.336 254 1HG1 VAL 50 1HG1 VAL 50 13.968 21.067 2.065 255 2HG1 VAL 50 2HG1 VAL 50 12.887 22.395 2.496 256 3HG1 VAL 50 3HG1 VAL 50 12.299 21.074 1.487 257 1HG2 VAL 50 1HG2 VAL 50 14.440 20.609 4.458 258 2HG2 VAL 50 2HG2 VAL 50 13.110 20.291 5.575 259 3HG2 VAL 50 3HG2 VAL 50 13.375 21.923 4.960 260 H SER 51 H SER 51 9.277 22.358 2.918 261 HA SER 51 HA SER 51 7.897 20.271 1.511 262 1HB SER 51 2HB SER 51 7.386 23.241 1.689 263 2HB SER 51 1HB SER 51 6.267 22.035 1.051 264 HG SER 51 HG SER 51 6.487 22.802 3.529 265 H LYS 52 H LYS 52 7.022 21.219 -0.772 266 HA LYS 52 HA LYS 52 9.247 21.067 -2.490 267 1HB LYS 52 2HB LYS 52 6.387 21.841 -3.052 268 2HB LYS 52 1HB LYS 52 7.617 21.564 -4.274 269 1HG LYS 52 2HG LYS 52 7.833 19.255 -3.556 270 2HG LYS 52 1HG LYS 52 6.629 19.525 -2.295 271 1HD LYS 52 2HD LYS 52 5.630 18.439 -4.251 272 2HD LYS 52 1HD LYS 52 4.971 20.062 -3.990 273 1HE LYS 52 2HE LYS 52 6.374 20.957 -5.751 274 2HE LYS 52 1HE LYS 52 7.162 19.397 -5.960 275 1HZ LYS 52 1HZ LYS 52 4.284 19.927 -6.439 276 2HZ LYS 52 2HZ LYS 52 5.102 18.488 -6.740 277 3HZ LYS 52 3HZ LYS 52 5.464 19.863 -7.634 278 H ALA 53 H ALA 53 10.123 22.638 -3.855 279 HA ALA 53 HA ALA 53 10.228 25.306 -2.876 280 1HB ALA 53 1HB ALA 53 11.109 24.182 -5.543 281 2HB ALA 53 2HB ALA 53 12.104 24.281 -4.092 282 3HB ALA 53 3HB ALA 53 11.564 25.757 -4.894 283 H SER 54 H SER 54 8.447 23.620 -5.306 284 HA SER 54 HA SER 54 7.175 25.667 -6.680 285 1HB SER 54 2HB SER 54 6.067 22.986 -5.862 286 2HB SER 54 1HB SER 54 5.654 23.909 -7.304 287 HG SER 54 HG SER 54 7.651 23.507 -8.147 288 HA PRO 55 HA PRO 55 4.534 27.423 -3.396 289 1HB PRO 55 2HB PRO 55 2.600 27.743 -5.646 290 2HB PRO 55 1HB PRO 55 3.166 28.944 -4.478 291 1HG PRO 55 2HG PRO 55 4.081 28.982 -6.966 292 2HG PRO 55 1HG PRO 55 5.169 29.290 -5.604 293 1HD PRO 55 2HD PRO 55 4.876 26.831 -7.276 294 2HD PRO 55 1HD PRO 55 6.341 27.571 -6.597 295 H GLY 56 H GLY 56 3.339 25.069 -5.711 296 1HA GLY 56 2HA GLY 56 2.320 23.045 -5.068 297 2HA GLY 56 1HA GLY 56 1.857 23.795 -3.545 298 H ASN 57 H ASN 57 1.389 24.738 -6.923 299 HA ASN 57 HA ASN 57 -1.323 25.459 -6.322 300 1HB ASN 57 2HB ASN 57 0.135 25.471 -8.977 301 2HB ASN 57 1HB ASN 57 -1.488 26.090 -8.717 302 1HD2 ASN 57 1HD2 ASN 57 -1.748 27.979 -7.533 303 2HD2 ASN 57 2HD2 ASN 57 -0.445 29.079 -7.263 304 H ILE 58 H ILE 58 -2.101 23.498 -5.670 305 HA ILE 58 HA ILE 58 -2.865 21.732 -7.879 306 HB ILE 58 HB ILE 58 -2.160 20.934 -5.034 307 1HG1 ILE 58 2HG1 ILE 58 -0.163 21.267 -6.408 308 2HG1 ILE 58 1HG1 ILE 58 -0.383 19.562 -6.041 309 1HG2 ILE 58 1HG2 ILE 58 -2.621 18.614 -5.702 310 2HG2 ILE 58 2HG2 ILE 58 -3.200 19.194 -7.261 311 3HG2 ILE 58 3HG2 ILE 58 -4.055 19.637 -5.785 312 1HD1 ILE 58 1HD1 ILE 58 -1.027 20.925 -8.654 313 2HD1 ILE 58 2HD1 ILE 58 -1.303 19.225 -8.301 314 3HD1 ILE 58 3HD1 ILE 58 0.342 19.860 -8.334 315 H GLN 59 H GLN 59 -4.989 21.565 -8.062 316 HA GLN 59 HA GLN 59 -6.706 23.032 -6.349 317 1HB GLN 59 2HB GLN 59 -7.374 21.009 -8.491 318 2HB GLN 59 1HB GLN 59 -8.525 22.096 -7.724 319 1HG GLN 59 2HG GLN 59 -7.335 24.013 -8.637 320 2HG GLN 59 1HG GLN 59 -6.161 22.936 -9.383 321 1HE2 GLN 59 1HE2 GLN 59 -7.953 24.874 -10.558 322 2HE2 GLN 59 2HE2 GLN 59 -8.891 24.037 -11.734 323 H GLY 60 H GLY 60 -6.975 22.385 -4.359 324 1HA GLY 60 2HA GLY 60 -8.090 21.075 -2.773 325 2HA GLY 60 1HA GLY 60 -8.115 19.745 -3.917 326 H CYS 61 H CYS 61 -5.859 21.683 -2.015 327 HA CYS 61 HA CYS 61 -4.055 19.419 -1.892 328 1HB CYS 61 2HB CYS 61 -3.844 22.186 -0.673 329 2HB CYS 61 1HB CYS 61 -2.589 20.955 -0.614 330 HG CYS 61 HG CYS 61 -3.734 22.149 -3.613 331 H ASP 62 H ASP 62 -5.002 17.904 -0.633 332 HA ASP 62 HA ASP 62 -6.274 18.724 1.831 333 1HB ASP 62 2HB ASP 62 -5.914 15.928 0.708 334 2HB ASP 62 1HB ASP 62 -6.835 16.330 2.148 335 H LEU 63 H LEU 63 -4.516 19.588 2.808 336 HA LEU 63 HA LEU 63 -2.432 17.711 3.678 337 1HB LEU 63 2HB LEU 63 -1.628 19.688 2.494 338 2HB LEU 63 1HB LEU 63 -2.477 20.727 3.617 339 HG LEU 63 HG LEU 63 -0.995 19.916 5.436 340 1HD1 LEU 63 1HD1 LEU 63 -0.399 17.753 4.521 341 2HD1 LEU 63 2HD1 LEU 63 1.044 18.704 4.865 342 3HD1 LEU 63 3HD1 LEU 63 0.475 18.536 3.204 343 1HD2 LEU 63 1HD2 LEU 63 0.979 21.156 4.717 344 2HD2 LEU 63 2HD2 LEU 63 -0.510 21.985 4.262 345 3HD2 LEU 63 3HD2 LEU 63 0.408 21.095 3.049 346 H HIS 64 H HIS 64 -4.095 20.583 4.931 347 HA HIS 64 HA HIS 64 -3.780 19.600 7.635 348 1HB HIS 64 2HB HIS 64 -3.520 22.024 7.136 349 2HB HIS 64 1HB HIS 64 -5.205 22.082 6.635 350 HD1 HIS 64 1HD HIS 64 -6.995 22.232 8.504 351 HD2 HIS 64 2HD HIS 64 -3.118 21.750 9.939 352 HE1 HIS 64 1HE HIS 64 -7.118 22.684 10.955 353 HE2 HIS 64 2HE HIS 64 -4.863 21.962 11.793 354 H GLU 65 H GLU 65 -6.271 20.060 5.242 355 HA GLU 65 HA GLU 65 -8.379 19.268 7.040 356 1HB GLU 65 2HB GLU 65 -8.436 19.719 4.061 357 2HB GLU 65 1HB GLU 65 -9.836 19.568 5.116 358 1HG GLU 65 2HG GLU 65 -7.781 21.755 5.175 359 2HG GLU 65 1HG GLU 65 -9.433 21.888 4.574 360 H GLY 66 H GLY 66 -6.159 17.760 5.007 361 1HA GLY 66 2HA GLY 66 -7.814 15.415 4.502 362 2HA GLY 66 1HA GLY 66 -6.167 15.682 3.929 363 H ASP 67 H ASP 67 -7.896 15.339 7.007 364 HA ASP 67 HA ASP 67 -5.811 13.465 7.783 365 1HB ASP 67 2HB ASP 67 -5.149 15.538 8.826 366 2HB ASP 67 1HB ASP 67 -6.759 15.742 9.518 367 H TRP 68 H TRP 68 -6.655 11.670 8.216 368 HA TRP 68 HA TRP 68 -9.341 11.470 9.356 369 1HB TRP 68 2HB TRP 68 -7.556 9.484 7.950 370 2HB TRP 68 1HB TRP 68 -9.074 9.047 8.719 371 HD1 TRP 68 HD TRP 68 -11.232 9.385 7.355 372 HE1 TRP 68 1HE TRP 68 -11.768 10.185 4.988 373 HE3 TRP 68 3HE TRP 68 -6.661 11.307 6.080 374 HZ2 TRP 68 2HZ TRP 68 -10.451 11.477 2.852 375 HZ3 TRP 68 3HZ TRP 68 -6.392 12.307 3.855 376 HH2 TRP 68 HH TRP 68 -8.248 12.390 2.272 377 H GLY 69 H GLY 69 -6.546 12.024 10.614 378 1HA GLY 69 2HA GLY 69 -5.845 11.643 12.799 379 2HA GLY 69 1HA GLY 69 -6.943 10.271 12.891 380 H THR 70 H THR 70 -5.130 10.320 10.082 381 HA THR 70 HA THR 70 -3.450 9.145 9.222 382 HB THR 70 HB THR 70 -2.437 8.721 12.070 383 HG1 THR 70 1HG THR 70 -2.329 10.867 10.291 384 1HG2 THR 70 1HG2 THR 70 -0.262 8.370 10.990 385 2HG2 THR 70 2HG2 THR 70 -1.004 8.615 9.405 386 3HG2 THR 70 3HG2 THR 70 -1.457 7.220 10.378 387 H VAL 71 H VAL 71 -3.921 7.328 12.240 388 HA VAL 71 HA VAL 71 -4.234 4.873 10.811 389 HB VAL 71 HB VAL 71 -4.851 5.477 13.710 390 1HG1 VAL 71 1HG1 VAL 71 -4.358 2.849 12.313 391 2HG1 VAL 71 2HG1 VAL 71 -5.909 3.431 12.919 392 3HG1 VAL 71 3HG1 VAL 71 -4.604 3.051 14.048 393 1HG2 VAL 71 1HG2 VAL 71 -2.643 4.568 14.215 394 2HG2 VAL 71 2HG2 VAL 71 -2.523 5.982 13.172 395 3HG2 VAL 71 3HG2 VAL 71 -2.329 4.359 12.494 396 H GLY 72 H GLY 72 -6.090 4.063 9.982 397 1HA GLY 72 2HA GLY 72 -8.415 3.643 10.058 398 2HA GLY 72 1HA GLY 72 -8.620 5.111 11.011 399 H SER 73 H SER 73 -6.475 5.903 8.724 400 HA SER 73 HA SER 73 -8.212 7.548 7.266 401 1HB SER 73 2HB SER 73 -5.765 7.956 7.563 402 2HB SER 73 1HB SER 73 -5.459 6.566 6.529 403 HG SER 73 HG SER 73 -5.998 7.684 4.809 404 H ILE 74 H ILE 74 -9.380 7.198 5.501 405 HA ILE 74 HA ILE 74 -8.894 4.772 3.983 406 HB ILE 74 HB ILE 74 -11.574 5.895 4.818 407 1HG1 ILE 74 2HG1 ILE 74 -10.279 3.207 5.233 408 2HG1 ILE 74 1HG1 ILE 74 -10.354 4.481 6.436 409 1HG2 ILE 74 1HG2 ILE 74 -12.585 4.097 3.462 410 2HG2 ILE 74 2HG2 ILE 74 -10.989 3.653 2.857 411 3HG2 ILE 74 3HG2 ILE 74 -11.673 5.221 2.454 412 1HD1 ILE 74 1HD1 ILE 74 -12.654 3.016 5.197 413 2HD1 ILE 74 2HD1 ILE 74 -12.803 4.308 6.399 414 3HD1 ILE 74 3HD1 ILE 74 -12.032 2.769 6.833 415 H VAL 75 H VAL 75 -8.323 5.298 2.081 416 HA VAL 75 HA VAL 75 -9.566 7.530 0.678 417 HB VAL 75 HB VAL 75 -7.378 8.160 -0.325 418 1HG1 VAL 75 1HG1 VAL 75 -7.343 8.282 2.685 419 2HG1 VAL 75 2HG1 VAL 75 -8.124 9.430 1.602 420 3HG1 VAL 75 3HG1 VAL 75 -6.366 9.281 1.605 421 1HG2 VAL 75 1HG2 VAL 75 -6.208 6.029 -0.096 422 2HG2 VAL 75 2HG2 VAL 75 -6.180 6.217 1.656 423 3HG2 VAL 75 3HG2 VAL 75 -5.266 7.330 0.635 424 H PHE 76 H PHE 76 -9.291 7.221 -1.694 425 HA PHE 76 HA PHE 76 -8.854 4.385 -2.267 426 1HB PHE 76 2HB PHE 76 -10.877 6.193 -3.627 427 2HB PHE 76 1HB PHE 76 -10.605 4.473 -3.933 428 HD1 PHE 76 1HD PHE 76 -10.452 3.227 -1.540 429 HD2 PHE 76 2HD PHE 76 -12.883 6.522 -2.487 430 HE1 PHE 76 1HE PHE 76 -11.939 2.580 0.261 431 HE2 PHE 76 2HE PHE 76 -14.434 5.917 -0.663 432 HZ PHE 76 HZ PHE 76 -13.980 3.937 0.721 433 H TRP 77 H TRP 77 -7.278 4.042 -3.618 434 HA TRP 77 HA TRP 77 -6.314 6.365 -5.076 435 1HB TRP 77 2HB TRP 77 -4.916 5.384 -3.233 436 2HB TRP 77 1HB TRP 77 -4.776 3.931 -4.220 437 HD1 TRP 77 HD TRP 77 -3.424 4.137 -6.420 438 HE1 TRP 77 1HE TRP 77 -1.526 5.798 -7.176 439 HE3 TRP 77 3HE TRP 77 -4.191 7.773 -2.991 440 HZ2 TRP 77 2HZ TRP 77 -0.558 8.308 -6.356 441 HZ3 TRP 77 3HZ TRP 77 -2.768 9.776 -3.011 442 HH2 TRP 77 HH TRP 77 -0.984 10.039 -4.662 443 H ASN 78 H ASN 78 -6.003 6.245 -7.165 444 HA ASN 78 HA ASN 78 -6.905 3.807 -8.542 445 1HB ASN 78 2HB ASN 78 -6.777 6.673 -9.516 446 2HB ASN 78 1HB ASN 78 -7.140 5.308 -10.549 447 1HD2 ASN 78 1HD2 ASN 78 -8.338 5.615 -7.269 448 2HD2 ASN 78 2HD2 ASN 78 -9.989 5.881 -7.694 449 H TYR 79 H TYR 79 -5.535 2.733 -9.757 450 HA TYR 79 HA TYR 79 -3.135 4.067 -10.699 451 1HB TYR 79 2HB TYR 79 -1.686 2.188 -10.053 452 2HB TYR 79 1HB TYR 79 -2.451 2.866 -8.630 453 HD1 TYR 79 1HD TYR 79 -1.943 -0.080 -10.639 454 HD2 TYR 79 2HD TYR 79 -4.379 1.578 -7.565 455 HE1 TYR 79 1HE TYR 79 -2.692 -2.337 -10.024 456 HE2 TYR 79 2HE TYR 79 -5.131 -0.684 -6.941 457 HH TYR 79 HH TYR 79 -3.592 -3.467 -8.021 458 H VAL 80 H VAL 80 -2.213 2.894 -12.551 459 HA VAL 80 HA VAL 80 -4.411 1.556 -13.944 460 HB VAL 80 HB VAL 80 -1.986 2.938 -15.119 461 1HG1 VAL 80 1HG1 VAL 80 -3.164 2.722 -17.258 462 2HG1 VAL 80 2HG1 VAL 80 -4.464 1.844 -16.462 463 3HG1 VAL 80 3HG1 VAL 80 -2.851 1.147 -16.541 464 1HG2 VAL 80 1HG2 VAL 80 -3.560 4.703 -15.795 465 2HG2 VAL 80 2HG2 VAL 80 -3.486 4.531 -14.039 466 3HG2 VAL 80 3HG2 VAL 80 -4.850 3.861 -14.928 467 H HIS 81 H HIS 81 -4.194 -0.456 -14.483 468 HA HIS 81 HA HIS 81 -1.524 -1.643 -14.652 469 1HB HIS 81 2HB HIS 81 -2.362 -2.143 -12.384 470 2HB HIS 81 1HB HIS 81 -3.826 -2.825 -13.073 471 HD1 HIS 81 1HD HIS 81 -0.101 -3.465 -13.040 472 HD2 HIS 81 2HD HIS 81 -3.678 -5.471 -13.581 473 HE1 HIS 81 1HE HIS 81 0.516 -5.909 -13.186 474 HE2 HIS 81 2HE HIS 81 -1.597 -6.923 -14.023 475 H ASP 82 H ASP 82 -1.346 -2.366 -16.579 476 HA ASP 82 HA ASP 82 -1.702 -3.270 -18.615 477 1HB ASP 82 2HB ASP 82 -3.866 -4.782 -17.154 478 2HB ASP 82 1HB ASP 82 -3.484 -5.061 -18.846 479 H GLY 83 H GLY 83 -3.024 -0.838 -17.870 480 1HA GLY 83 2HA GLY 83 -4.099 0.622 -19.348 481 2HA GLY 83 1HA GLY 83 -4.743 -0.766 -20.202 482 H GLU 84 H GLU 84 -5.563 -1.600 -17.171 483 HA GLU 84 HA GLU 84 -8.074 -0.121 -17.417 484 1HB GLU 84 2HB GLU 84 -7.421 -2.322 -15.452 485 2HB GLU 84 1HB GLU 84 -8.951 -1.504 -15.584 486 1HG GLU 84 2HG GLU 84 -9.318 -3.538 -16.575 487 2HG GLU 84 1HG GLU 84 -9.007 -2.480 -17.947 488 H ALA 85 H ALA 85 -8.908 1.072 -15.765 489 HA ALA 85 HA ALA 85 -6.967 2.218 -13.958 490 1HB ALA 85 1HB ALA 85 -9.908 2.807 -14.391 491 2HB ALA 85 2HB ALA 85 -8.564 3.707 -15.088 492 3HB ALA 85 3HB ALA 85 -8.830 3.729 -13.345 493 H LYS 86 H LYS 86 -6.647 1.293 -12.051 494 HA LYS 86 HA LYS 86 -8.650 -0.571 -11.042 495 1HB LYS 86 2HB LYS 86 -5.742 -0.292 -10.289 496 2HB LYS 86 1HB LYS 86 -6.841 -1.564 -9.809 497 1HG LYS 86 2HG LYS 86 -5.838 -1.068 -12.597 498 2HG LYS 86 1HG LYS 86 -5.210 -2.276 -11.470 499 1HD LYS 86 2HD LYS 86 -7.424 -3.363 -11.484 500 2HD LYS 86 1HD LYS 86 -7.980 -2.180 -12.675 501 1HE LYS 86 2HE LYS 86 -6.134 -2.937 -14.187 502 2HE LYS 86 1HE LYS 86 -5.728 -4.146 -12.997 503 1HZ LYS 86 1HZ LYS 86 -8.401 -3.995 -14.238 504 2HZ LYS 86 2HZ LYS 86 -7.779 -5.297 -13.364 505 3HZ LYS 86 3HZ LYS 86 -7.165 -4.891 -14.890 506 H VAL 87 H VAL 87 -9.313 -0.246 -9.001 507 HA VAL 87 HA VAL 87 -8.136 1.952 -7.530 508 HB VAL 87 HB VAL 87 -10.038 2.983 -8.577 509 1HG1 VAL 87 1HG1 VAL 87 -12.325 2.130 -8.374 510 2HG1 VAL 87 2HG1 VAL 87 -11.692 0.680 -7.569 511 3HG1 VAL 87 3HG1 VAL 87 -11.228 1.040 -9.234 512 1HG2 VAL 87 1HG2 VAL 87 -9.701 3.616 -6.251 513 2HG2 VAL 87 2HG2 VAL 87 -10.732 2.295 -5.712 514 3HG2 VAL 87 3HG2 VAL 87 -11.423 3.632 -6.635 515 H ALA 88 H ALA 88 -7.860 1.552 -5.483 516 HA ALA 88 HA ALA 88 -8.806 -1.033 -4.498 517 1HB ALA 88 1HB ALA 88 -6.380 -0.858 -4.737 518 2HB ALA 88 2HB ALA 88 -6.850 -0.982 -3.036 519 3HB ALA 88 3HB ALA 88 -6.397 0.581 -3.717 520 H LYS 89 H LYS 89 -9.926 -1.102 -2.544 521 HA LYS 89 HA LYS 89 -10.297 1.460 -1.333 522 1HB LYS 89 2HB LYS 89 -11.945 -1.079 -1.095 523 2HB LYS 89 1HB LYS 89 -12.334 0.450 -0.341 524 1HG LYS 89 2HG LYS 89 -13.797 0.331 -2.156 525 2HG LYS 89 1HG LYS 89 -12.504 1.373 -2.740 526 1HD LYS 89 2HD LYS 89 -11.501 -0.543 -3.907 527 2HD LYS 89 1HD LYS 89 -12.795 -1.586 -3.324 528 1HE LYS 89 2HE LYS 89 -14.401 -0.007 -4.497 529 2HE LYS 89 1HE LYS 89 -12.982 0.723 -5.242 530 1HZ LYS 89 1HZ LYS 89 -13.805 -2.104 -5.453 531 2HZ LYS 89 2HZ LYS 89 -12.432 -1.464 -6.216 532 3HZ LYS 89 3HZ LYS 89 -13.993 -0.959 -6.657 533 H GLU 90 H GLU 90 -9.315 1.751 0.576 534 HA GLU 90 HA GLU 90 -8.081 -0.582 1.813 535 1HB GLU 90 2HB GLU 90 -5.984 0.696 1.938 536 2HB GLU 90 1HB GLU 90 -6.459 0.322 0.286 537 1HG GLU 90 2HG GLU 90 -7.335 2.569 0.006 538 2HG GLU 90 1HG GLU 90 -6.926 2.955 1.661 539 H ARG 91 H ARG 91 -7.376 -0.217 3.885 540 HA ARG 91 HA ARG 91 -8.199 2.229 5.227 541 1HB ARG 91 2HB ARG 91 -9.989 0.714 5.684 542 2HB ARG 91 1HB ARG 91 -8.875 -0.592 6.040 543 1HG ARG 91 2HG ARG 91 -8.154 0.540 8.053 544 2HG ARG 91 1HG ARG 91 -9.209 1.905 7.680 545 1HD ARG 91 2HD ARG 91 -11.160 0.534 7.907 546 2HD ARG 91 1HD ARG 91 -10.173 -0.920 8.071 547 HE ARG 91 HE ARG 91 -9.301 0.033 10.104 548 1HH1 ARG 91 1HH1 ARG 91 -12.462 1.201 8.952 549 2HH1 ARG 91 2HH1 ARG 91 -13.027 1.613 10.512 550 1HH2 ARG 91 1HH2 ARG 91 -10.154 0.625 12.262 551 2HH2 ARG 91 2HH2 ARG 91 -11.712 1.285 12.389 552 H ILE 92 H ILE 92 -6.540 3.012 6.413 553 HA ILE 92 HA ILE 92 -4.177 1.406 6.792 554 HB ILE 92 HB ILE 92 -4.840 4.207 7.761 555 1HG1 ILE 92 2HG1 ILE 92 -3.032 3.205 5.543 556 2HG1 ILE 92 1HG1 ILE 92 -4.570 4.032 5.341 557 1HG2 ILE 92 1HG2 ILE 92 -2.462 4.447 8.366 558 2HG2 ILE 92 2HG2 ILE 92 -2.208 2.734 8.018 559 3HG2 ILE 92 3HG2 ILE 92 -3.274 3.226 9.337 560 1HD1 ILE 92 1HD1 ILE 92 -2.053 5.199 6.506 561 2HD1 ILE 92 2HD1 ILE 92 -3.576 6.060 6.343 562 3HD1 ILE 92 3HD1 ILE 92 -2.709 5.523 4.902 563 H GLU 93 H GLU 93 -3.751 0.146 8.407 564 HA GLU 93 HA GLU 93 -5.593 0.112 10.675 565 1HB GLU 93 2HB GLU 93 -3.827 -1.974 9.479 566 2HB GLU 93 1HB GLU 93 -4.622 -2.186 11.038 567 1HG GLU 93 2HG GLU 93 -6.034 -1.564 8.466 568 2HG GLU 93 1HG GLU 93 -5.856 -3.181 9.168 569 H ALA 94 H ALA 94 -2.133 0.153 10.016 570 HA ALA 94 HA ALA 94 -1.674 1.211 12.649 571 1HB ALA 94 1HB ALA 94 -0.014 -0.490 13.251 572 2HB ALA 94 2HB ALA 94 -0.416 -1.400 11.793 573 3HB ALA 94 3HB ALA 94 -1.615 -1.213 13.070 574 H VAL 95 H VAL 95 0.163 2.409 12.689 575 HA VAL 95 HA VAL 95 2.065 2.114 10.577 576 HB VAL 95 HB VAL 95 0.501 3.721 9.572 577 1HG1 VAL 95 1HG1 VAL 95 0.148 5.943 10.536 578 2HG1 VAL 95 2HG1 VAL 95 1.000 5.430 11.992 579 3HG1 VAL 95 3HG1 VAL 95 -0.516 4.650 11.541 580 1HG2 VAL 95 1HG2 VAL 95 3.074 5.035 10.449 581 2HG2 VAL 95 2HG2 VAL 95 2.064 5.565 9.101 582 3HG2 VAL 95 3HG2 VAL 95 2.858 3.990 9.044 583 H GLU 96 H GLU 96 3.955 2.238 11.324 584 HA GLU 96 HA GLU 96 4.458 3.406 13.978 585 1HB GLU 96 2HB GLU 96 5.978 1.319 12.422 586 2HB GLU 96 1HB GLU 96 6.446 1.946 13.977 587 1HG GLU 96 2HG GLU 96 3.923 0.405 13.425 588 2HG GLU 96 1HG GLU 96 5.418 -0.246 14.104 589 HA PRO 97 HA PRO 97 6.644 6.442 11.357 590 1HB PRO 97 2HB PRO 97 7.232 7.518 14.071 591 2HB PRO 97 1HB PRO 97 6.591 8.361 12.658 592 1HG PRO 97 2HG PRO 97 4.991 7.787 14.687 593 2HG PRO 97 1HG PRO 97 4.427 7.589 13.019 594 1HD PRO 97 2HD PRO 97 5.371 5.508 14.949 595 2HD PRO 97 1HD PRO 97 3.988 5.462 13.832 596 H ASP 98 H ASP 98 7.845 5.202 14.451 597 HA ASP 98 HA ASP 98 10.588 5.574 13.676 598 1HB ASP 98 2HB ASP 98 10.000 5.940 15.993 599 2HB ASP 98 1HB ASP 98 9.366 4.309 16.128 600 H LYS 99 H LYS 99 8.373 2.898 13.823 601 HA LYS 99 HA LYS 99 10.584 1.063 13.312 602 1HB LYS 99 2HB LYS 99 7.654 0.325 13.629 603 2HB LYS 99 1HB LYS 99 9.049 -0.742 13.582 604 1HG LYS 99 2HG LYS 99 8.629 1.325 15.690 605 2HG LYS 99 1HG LYS 99 8.190 -0.383 15.847 606 1HD LYS 99 2HD LYS 99 10.497 -0.989 15.437 607 2HD LYS 99 1HD LYS 99 10.938 0.711 15.302 608 1HE LYS 99 2HE LYS 99 9.778 -0.602 17.765 609 2HE LYS 99 1HE LYS 99 11.470 -0.169 17.549 610 1HZ LYS 99 1HZ LYS 99 10.769 2.169 17.349 611 2HZ LYS 99 2HZ LYS 99 10.366 1.505 18.836 612 3HZ LYS 99 3HZ LYS 99 9.173 1.737 17.689 613 H ASN 100 H ASN 100 8.818 3.006 11.406 614 HA ASN 100 HA ASN 100 8.466 3.175 9.123 615 1HB ASN 100 2HB ASN 100 10.439 0.877 8.964 616 2HB ASN 100 1HB ASN 100 9.982 1.938 7.645 617 1HD2 ASN 100 1HD2 ASN 100 12.538 1.371 8.666 618 2HD2 ASN 100 2HD2 ASN 100 13.271 2.833 9.228 619 H LEU 101 H LEU 101 6.587 1.612 10.477 620 HA LEU 101 HA LEU 101 6.132 -0.741 8.724 621 1HB LEU 101 2HB LEU 101 6.663 -1.315 11.052 622 2HB LEU 101 1HB LEU 101 5.347 -0.300 11.598 623 HG LEU 101 HG LEU 101 3.802 -1.787 10.317 624 1HD1 LEU 101 1HD1 LEU 101 6.244 -3.503 10.140 625 2HD1 LEU 101 2HD1 LEU 101 5.278 -2.802 8.818 626 3HD1 LEU 101 3HD1 LEU 101 4.582 -4.030 9.870 627 1HD2 LEU 101 1HD2 LEU 101 3.784 -3.526 12.032 628 2HD2 LEU 101 2HD2 LEU 101 3.947 -1.905 12.699 629 3HD2 LEU 101 3HD2 LEU 101 5.363 -2.967 12.609 630 H ILE 102 H ILE 102 4.114 -0.893 7.772 631 HA ILE 102 HA ILE 102 1.932 0.555 8.925 632 HB ILE 102 HB ILE 102 2.831 2.275 7.499 633 1HG1 ILE 102 2HG1 ILE 102 0.382 1.076 6.169 634 2HG1 ILE 102 1HG1 ILE 102 0.351 2.059 7.630 635 1HG2 ILE 102 1HG2 ILE 102 3.069 1.964 5.053 636 2HG2 ILE 102 2HG2 ILE 102 2.660 0.264 5.288 637 3HG2 ILE 102 3HG2 ILE 102 4.118 0.887 6.002 638 1HD1 ILE 102 1HD1 ILE 102 1.258 2.958 4.899 639 2HD1 ILE 102 2HD1 ILE 102 1.224 3.957 6.353 640 3HD1 ILE 102 3HD1 ILE 102 -0.283 3.347 5.668 641 H THR 103 H THR 103 0.266 -0.567 8.915 642 HA THR 103 HA THR 103 -0.061 -2.975 7.255 643 HB THR 103 HB THR 103 -1.641 -2.040 9.664 644 HG1 THR 103 1HG THR 103 0.334 -4.066 9.680 645 1HG2 THR 103 1HG2 THR 103 -2.310 -4.395 9.834 646 2HG2 THR 103 2HG2 THR 103 -1.384 -4.764 8.382 647 3HG2 THR 103 3HG2 THR 103 -2.795 -3.715 8.280 648 H PHE 104 H PHE 104 -1.600 -3.075 5.559 649 HA PHE 104 HA PHE 104 -3.663 -0.976 5.412 650 1HB PHE 104 2HB PHE 104 -2.419 -2.685 3.242 651 2HB PHE 104 1HB PHE 104 -3.653 -1.517 2.921 652 HD1 PHE 104 1HD PHE 104 -3.082 0.932 3.204 653 HD2 PHE 104 2HD PHE 104 -0.173 -2.162 3.362 654 HE1 PHE 104 1HE PHE 104 -1.311 2.575 2.745 655 HE2 PHE 104 2HE PHE 104 1.596 -0.531 2.911 656 HZ PHE 104 HZ PHE 104 1.049 1.826 2.601 657 H ARG 105 H ARG 105 -5.740 -1.744 5.372 658 HA ARG 105 HA ARG 105 -6.141 -4.682 5.261 659 1HB ARG 105 2HB ARG 105 -7.040 -3.514 7.292 660 2HB ARG 105 1HB ARG 105 -8.043 -2.524 6.236 661 1HG ARG 105 2HG ARG 105 -9.013 -4.724 5.373 662 2HG ARG 105 1HG ARG 105 -8.238 -5.474 6.764 663 1HD ARG 105 2HD ARG 105 -10.322 -3.289 6.813 664 2HD ARG 105 1HD ARG 105 -10.564 -4.982 7.222 665 HE ARG 105 HE ARG 105 -8.562 -3.793 8.844 666 1HH1 ARG 105 1HH1 ARG 105 -12.097 -4.078 8.469 667 2HH1 ARG 105 2HH1 ARG 105 -12.398 -3.691 10.108 668 1HH2 ARG 105 1HH2 ARG 105 -9.038 -3.242 11.025 669 2HH2 ARG 105 2HH2 ARG 105 -10.664 -3.227 11.581 670 H VAL 106 H VAL 106 -7.437 -5.498 3.491 671 HA VAL 106 HA VAL 106 -8.268 -3.459 1.651 672 HB VAL 106 HB VAL 106 -7.270 -5.716 0.834 673 1HG1 VAL 106 1HG1 VAL 106 -8.693 -7.610 0.732 674 2HG1 VAL 106 2HG1 VAL 106 -9.850 -6.812 1.790 675 3HG1 VAL 106 3HG1 VAL 106 -8.234 -7.184 2.399 676 1HG2 VAL 106 1HG2 VAL 106 -8.554 -4.289 -0.685 677 2HG2 VAL 106 2HG2 VAL 106 -10.047 -5.045 -0.136 678 3HG2 VAL 106 3HG2 VAL 106 -8.848 -5.999 -1.007 679 H ILE 107 H ILE 107 -10.267 -2.684 1.618 680 HA ILE 107 HA ILE 107 -12.154 -3.929 3.475 681 HB ILE 107 HB ILE 107 -13.414 -1.797 3.420 682 1HG1 ILE 107 2HG1 ILE 107 -11.123 -0.908 1.693 683 2HG1 ILE 107 1HG1 ILE 107 -12.782 -1.148 1.161 684 1HG2 ILE 107 1HG2 ILE 107 -11.775 -0.469 4.649 685 2HG2 ILE 107 2HG2 ILE 107 -10.478 -1.437 3.979 686 3HG2 ILE 107 3HG2 ILE 107 -11.630 -2.174 5.110 687 1HD1 ILE 107 1HD1 ILE 107 -13.494 0.631 2.570 688 2HD1 ILE 107 2HD1 ILE 107 -12.170 1.097 1.445 689 3HD1 ILE 107 3HD1 ILE 107 -11.821 0.809 3.164 690 H GLU 108 H GLU 108 -11.782 -2.891 0.175 691 HA GLU 108 HA GLU 108 -13.763 -4.786 -0.716 692 1HB GLU 108 2HB GLU 108 -14.848 -2.455 -0.156 693 2HB GLU 108 1HB GLU 108 -14.000 -1.880 -1.571 694 1HG GLU 108 2HG GLU 108 -16.142 -4.006 -1.484 695 2HG GLU 108 1HG GLU 108 -16.342 -2.361 -2.045 696 H GLY 109 H GLY 109 -13.349 -5.100 -3.085 697 1HA GLY 109 2HA GLY 109 -11.874 -3.816 -4.800 698 2HA GLY 109 1HA GLY 109 -10.609 -4.386 -3.722 699 H ASP 110 H ASP 110 -10.581 -5.081 -6.282 700 HA ASP 110 HA ASP 110 -11.777 -7.371 -7.226 701 1HB ASP 110 2HB ASP 110 -10.297 -5.978 -8.560 702 2HB ASP 110 1HB ASP 110 -8.921 -6.448 -7.575 703 H LEU 111 H LEU 111 -9.152 -7.106 -4.951 704 HA LEU 111 HA LEU 111 -8.267 -9.777 -4.979 705 1HB LEU 111 2HB LEU 111 -8.079 -7.765 -2.730 706 2HB LEU 111 1HB LEU 111 -7.253 -9.303 -2.747 707 HG LEU 111 HG LEU 111 -5.652 -7.668 -3.273 708 1HD1 LEU 111 1HD1 LEU 111 -6.433 -8.990 -5.842 709 2HD1 LEU 111 2HD1 LEU 111 -5.409 -9.658 -4.570 710 3HD1 LEU 111 3HD1 LEU 111 -4.875 -8.253 -5.495 711 1HD2 LEU 111 1HD2 LEU 111 -7.482 -6.607 -5.432 712 2HD2 LEU 111 2HD2 LEU 111 -5.845 -6.043 -5.107 713 3HD2 LEU 111 3HD2 LEU 111 -7.107 -5.809 -3.903 714 H MET 112 H MET 112 -11.052 -8.367 -3.504 715 HA MET 112 HA MET 112 -11.425 -10.342 -1.470 716 1HB MET 112 2HB MET 112 -13.367 -8.417 -2.747 717 2HB MET 112 1HB MET 112 -13.764 -9.441 -1.388 718 1HG MET 112 2HG MET 112 -11.508 -7.464 -1.205 719 2HG MET 112 1HG MET 112 -13.166 -6.930 -1.021 720 1HE MET 112 1HE MET 112 -11.291 -10.298 0.454 721 2HE MET 112 2HE MET 112 -10.957 -9.687 2.056 722 3HE MET 112 3HE MET 112 -10.156 -8.949 0.684 723 H LYS 113 H LYS 113 -11.713 -10.508 -4.828 724 HA LYS 113 HA LYS 113 -13.921 -12.401 -4.839 725 1HB LYS 113 2HB LYS 113 -12.117 -11.511 -7.101 726 2HB LYS 113 1HB LYS 113 -13.571 -12.486 -7.266 727 1HG LYS 113 2HG LYS 113 -13.434 -9.625 -6.323 728 2HG LYS 113 1HG LYS 113 -14.006 -10.184 -7.897 729 1HD LYS 113 2HD LYS 113 -15.830 -11.394 -6.796 730 2HD LYS 113 1HD LYS 113 -15.243 -10.849 -5.225 731 1HE LYS 113 2HE LYS 113 -15.601 -8.517 -5.933 732 2HE LYS 113 1HE LYS 113 -16.257 -9.103 -7.462 733 1HZ LYS 113 1HZ LYS 113 -17.355 -9.647 -4.769 734 2HZ LYS 113 2HZ LYS 113 -18.005 -10.246 -6.184 735 3HZ LYS 113 3HZ LYS 113 -18.020 -8.582 -5.883 736 H GLU 114 H GLU 114 -10.676 -12.483 -4.273 737 HA GLU 114 HA GLU 114 -10.520 -15.353 -4.962 738 1HB GLU 114 2HB GLU 114 -8.254 -13.342 -4.851 739 2HB GLU 114 1HB GLU 114 -8.075 -15.056 -5.191 740 1HG GLU 114 2HG GLU 114 -9.322 -14.829 -7.233 741 2HG GLU 114 1HG GLU 114 -9.669 -13.142 -6.872 742 H TYR 115 H TYR 115 -9.800 -12.809 -2.657 743 HA TYR 115 HA TYR 115 -9.194 -14.820 -0.609 744 1HB TYR 115 2HB TYR 115 -8.210 -11.949 -0.649 745 2HB TYR 115 1HB TYR 115 -7.603 -13.290 0.328 746 HD1 TYR 115 1HD TYR 115 -7.302 -11.505 -2.736 747 HD2 TYR 115 2HD TYR 115 -6.450 -15.223 -0.867 748 HE1 TYR 115 1HE TYR 115 -5.751 -12.071 -4.568 749 HE2 TYR 115 2HE TYR 115 -4.919 -15.783 -2.683 750 HH TYR 115 HH TYR 115 -3.908 -13.581 -5.076 751 H LYS 116 H LYS 116 -10.492 -14.681 1.112 752 HA LYS 116 HA LYS 116 -12.666 -12.741 0.975 753 1HB LYS 116 2HB LYS 116 -13.661 -14.104 2.808 754 2HB LYS 116 1HB LYS 116 -13.398 -14.985 1.313 755 1HG LYS 116 2HG LYS 116 -11.301 -15.897 2.292 756 2HG LYS 116 1HG LYS 116 -11.714 -15.095 3.805 757 1HD LYS 116 2HD LYS 116 -13.391 -17.148 2.394 758 2HD LYS 116 1HD LYS 116 -12.343 -17.488 3.777 759 1HE LYS 116 2HE LYS 116 -13.685 -15.871 5.109 760 2HE LYS 116 1HE LYS 116 -14.754 -15.668 3.725 761 1HZ LYS 116 1HZ LYS 116 -15.639 -17.231 5.318 762 2HZ LYS 116 2HZ LYS 116 -14.271 -18.202 5.173 763 3HZ LYS 116 3HZ LYS 116 -15.315 -18.014 3.859 764 H SER 117 H SER 117 -9.751 -12.674 2.160 765 HA SER 117 HA SER 117 -10.167 -10.433 3.788 766 1HB SER 117 2HB SER 117 -10.802 -12.043 5.379 767 2HB SER 117 1HB SER 117 -9.348 -13.027 5.116 768 HG SER 117 HG SER 117 -9.599 -10.447 6.288 769 H PHE 118 H PHE 118 -8.232 -9.326 3.939 770 HA PHE 118 HA PHE 118 -5.782 -10.576 3.155 771 1HB PHE 118 2HB PHE 118 -6.863 -10.247 0.937 772 2HB PHE 118 1HB PHE 118 -7.180 -8.594 1.362 773 HD1 PHE 118 1HD PHE 118 -3.930 -10.174 2.038 774 HD2 PHE 118 2HD PHE 118 -6.210 -7.713 -0.561 775 HE1 PHE 118 1HE PHE 118 -1.886 -9.477 0.923 776 HE2 PHE 118 2HE PHE 118 -4.142 -6.983 -1.690 777 HZ PHE 118 HZ PHE 118 -1.983 -7.865 -0.956 778 H LEU 119 H LEU 119 -4.405 -9.707 4.513 779 HA LEU 119 HA LEU 119 -4.704 -6.887 5.245 780 1HB LEU 119 2HB LEU 119 -5.195 -8.552 7.050 781 2HB LEU 119 1HB LEU 119 -3.558 -9.148 6.879 782 HG LEU 119 HG LEU 119 -2.730 -6.892 7.534 783 1HD1 LEU 119 1HD1 LEU 119 -4.314 -5.362 8.630 784 2HD1 LEU 119 2HD1 LEU 119 -5.641 -6.396 8.108 785 3HD1 LEU 119 3HD1 LEU 119 -4.651 -5.565 6.912 786 1HD2 LEU 119 1HD2 LEU 119 -3.250 -7.158 9.913 787 2HD2 LEU 119 2HD2 LEU 119 -2.873 -8.707 9.157 788 3HD2 LEU 119 3HD2 LEU 119 -4.550 -8.275 9.498 789 H LEU 120 H LEU 120 -2.933 -5.669 4.845 790 HA LEU 120 HA LEU 120 -0.514 -7.054 3.875 791 1HB LEU 120 2HB LEU 120 -1.362 -4.239 3.266 792 2HB LEU 120 1HB LEU 120 -0.018 -5.101 2.579 793 HG LEU 120 HG LEU 120 -1.744 -6.662 1.649 794 1HD1 LEU 120 1HD1 LEU 120 -3.571 -4.327 2.186 795 2HD1 LEU 120 2HD1 LEU 120 -3.705 -5.954 2.851 796 3HD1 LEU 120 3HD1 LEU 120 -3.957 -5.687 1.127 797 1HD2 LEU 120 1HD2 LEU 120 -1.491 -3.864 0.587 798 2HD2 LEU 120 2HD2 LEU 120 -2.060 -5.260 -0.340 799 3HD2 LEU 120 3HD2 LEU 120 -0.407 -5.223 0.273 800 H THR 121 H THR 121 1.305 -6.640 5.034 801 HA THR 121 HA THR 121 1.338 -4.067 6.367 802 HB THR 121 HB THR 121 2.562 -6.576 7.551 803 HG1 THR 121 1HG THR 121 0.026 -5.787 7.462 804 1HG2 THR 121 1HG2 THR 121 3.595 -4.440 8.123 805 2HG2 THR 121 2HG2 THR 121 2.760 -5.123 9.522 806 3HG2 THR 121 3HG2 THR 121 2.041 -3.796 8.584 807 H ILE 122 H ILE 122 2.995 -2.861 5.681 808 HA ILE 122 HA ILE 122 5.249 -4.340 4.535 809 HB ILE 122 HB ILE 122 5.693 -2.491 3.017 810 1HG1 ILE 122 2HG1 ILE 122 3.152 -1.260 4.038 811 2HG1 ILE 122 1HG1 ILE 122 4.770 -0.682 4.419 812 1HG2 ILE 122 1HG2 ILE 122 4.225 -4.257 2.222 813 2HG2 ILE 122 2HG2 ILE 122 3.727 -2.700 1.551 814 3HG2 ILE 122 3HG2 ILE 122 2.828 -3.404 2.887 815 1HD1 ILE 122 1HD1 ILE 122 3.518 -0.750 1.670 816 2HD1 ILE 122 2HD1 ILE 122 5.148 -0.190 2.047 817 3HD1 ILE 122 3HD1 ILE 122 3.751 0.680 2.679 818 H GLN 123 H GLN 123 7.286 -3.553 4.940 819 HA GLN 123 HA GLN 123 7.482 -1.322 6.777 820 1HB GLN 123 2HB GLN 123 7.245 -3.470 8.082 821 2HB GLN 123 1HB GLN 123 8.760 -3.987 7.367 822 1HG GLN 123 2HG GLN 123 9.946 -2.211 8.446 823 2HG GLN 123 1HG GLN 123 8.440 -1.508 9.037 824 1HE2 GLN 123 1HE2 GLN 123 8.946 -1.664 11.181 825 2HE2 GLN 123 2HE2 GLN 123 9.086 -3.154 12.031 826 H VAL 124 H VAL 124 9.101 -0.087 6.213 827 HA VAL 124 HA VAL 124 10.909 -1.036 4.114 828 HB VAL 124 HB VAL 124 10.557 1.783 5.168 829 1HG1 VAL 124 1HG1 VAL 124 11.620 2.470 3.073 830 2HG1 VAL 124 2HG1 VAL 124 11.812 0.777 2.623 831 3HG1 VAL 124 3HG1 VAL 124 12.664 1.412 4.029 832 1HG2 VAL 124 1HG2 VAL 124 8.438 1.018 4.236 833 2HG2 VAL 124 2HG2 VAL 124 9.254 0.517 2.754 834 3HG2 VAL 124 3HG2 VAL 124 9.174 2.225 3.181 835 H THR 125 H THR 125 12.896 -1.717 4.747 836 HA THR 125 HA THR 125 13.798 -0.631 7.278 837 HB THR 125 HB THR 125 15.255 -2.708 7.364 838 HG1 THR 125 1HG THR 125 14.952 -4.223 6.042 839 1HG2 THR 125 1HG2 THR 125 12.259 -2.852 7.741 840 2HG2 THR 125 2HG2 THR 125 13.524 -2.348 8.888 841 3HG2 THR 125 3HG2 THR 125 13.426 -4.030 8.387 842 HA PRO 126 HA PRO 126 17.671 0.884 5.619 843 1HB PRO 126 2HB PRO 126 19.151 0.500 7.857 844 2HB PRO 126 1HB PRO 126 17.899 1.748 7.732 845 1HG PRO 126 2HG PRO 126 17.574 -1.043 8.877 846 2HG PRO 126 1HG PRO 126 17.226 0.506 9.682 847 1HD PRO 126 2HD PRO 126 15.354 -0.862 8.569 848 2HD PRO 126 1HD PRO 126 15.417 0.896 8.291 849 H LYS 127 H LYS 127 16.985 -1.723 4.951 850 HA LYS 127 HA LYS 127 18.673 -3.787 5.737 851 1HB LYS 127 2HB LYS 127 16.608 -4.218 4.523 852 2HB LYS 127 1HB LYS 127 17.202 -3.486 3.070 853 1HG LYS 127 2HG LYS 127 18.861 -5.278 2.855 854 2HG LYS 127 1HG LYS 127 18.246 -6.017 4.334 855 1HD LYS 127 2HD LYS 127 16.033 -6.250 3.278 856 2HD LYS 127 1HD LYS 127 16.649 -5.540 1.798 857 1HE LYS 127 2HE LYS 127 18.278 -7.387 1.621 858 2HE LYS 127 1HE LYS 127 17.610 -8.106 3.085 859 1HZ LYS 127 1HZ LYS 127 16.691 -9.192 1.172 860 2HZ LYS 127 2HZ LYS 127 16.246 -7.746 0.471 861 3HZ LYS 127 3HZ LYS 127 15.422 -8.285 1.815 862 HA PRO 128 HA PRO 128 22.000 -2.696 2.513 863 1HB PRO 128 2HB PRO 128 21.314 -0.277 1.058 864 2HB PRO 128 1HB PRO 128 21.592 -1.897 0.412 865 1HG PRO 128 2HG PRO 128 19.145 -0.713 0.379 866 2HG PRO 128 1HG PRO 128 19.360 -2.465 0.517 867 1HD PRO 128 2HD PRO 128 18.856 -0.448 2.662 868 2HD PRO 128 1HD PRO 128 18.058 -2.000 2.412 869 H GLY 129 H GLY 129 20.392 -0.277 4.341 870 1HA GLY 129 2HA GLY 129 22.101 0.613 6.048 871 2HA GLY 129 1HA GLY 129 22.821 1.328 4.611 872 H GLY 130 H GLY 130 22.472 3.402 5.414 873 1HA GLY 130 2HA GLY 130 19.833 4.404 5.976 874 2HA GLY 130 1HA GLY 130 21.288 5.369 5.689 875 HA PRO 131 HA PRO 131 19.961 6.148 1.498 876 1HB PRO 131 2HB PRO 131 22.312 5.796 0.114 877 2HB PRO 131 1HB PRO 131 21.932 7.270 1.013 878 1HG PRO 131 2HG PRO 131 23.628 4.940 1.818 879 2HG PRO 131 1HG PRO 131 23.903 6.672 2.092 880 1HD PRO 131 2HD PRO 131 22.986 5.026 4.010 881 2HD PRO 131 1HD PRO 131 22.490 6.727 3.901 882 H GLY 132 H GLY 132 18.733 4.610 0.605 883 1HA GLY 132 2HA GLY 132 18.562 2.715 -0.863 884 2HA GLY 132 1HA GLY 132 19.986 2.052 -0.070 885 H SER 133 H SER 133 16.687 1.875 -0.157 886 HA SER 133 HA SER 133 16.670 0.457 2.381 887 1HB SER 133 2HB SER 133 14.631 2.541 1.574 888 2HB SER 133 1HB SER 133 14.551 1.515 3.007 889 HG SER 133 HG SER 133 16.930 2.662 2.995 890 H ILE 134 H ILE 134 15.186 -1.236 2.439 891 HA ILE 134 HA ILE 134 14.009 -1.926 -0.171 892 HB ILE 134 HB ILE 134 15.066 -3.810 1.954 893 1HG1 ILE 134 2HG1 ILE 134 16.881 -2.675 0.910 894 2HG1 ILE 134 1HG1 ILE 134 16.810 -4.341 0.296 895 1HG2 ILE 134 1HG2 ILE 134 14.744 -5.573 0.272 896 2HG2 ILE 134 2HG2 ILE 134 14.026 -4.389 -0.822 897 3HG2 ILE 134 3HG2 ILE 134 13.222 -4.788 0.695 898 1HD1 ILE 134 1HD1 ILE 134 15.952 -1.830 -1.106 899 2HD1 ILE 134 2HD1 ILE 134 15.750 -3.469 -1.738 900 3HD1 ILE 134 3HD1 ILE 134 17.371 -2.819 -1.457 901 H VAL 135 H VAL 135 11.945 -2.729 -0.030 902 HA VAL 135 HA VAL 135 10.707 -2.431 2.607 903 HB VAL 135 HB VAL 135 9.734 -0.833 1.012 904 1HG1 VAL 135 1HG1 VAL 135 8.879 -3.194 -0.604 905 2HG1 VAL 135 2HG1 VAL 135 10.076 -1.984 -1.063 906 3HG1 VAL 135 3HG1 VAL 135 8.382 -1.526 -0.880 907 1HG2 VAL 135 1HG2 VAL 135 7.790 -3.012 1.753 908 2HG2 VAL 135 2HG2 VAL 135 7.356 -1.359 1.314 909 3HG2 VAL 135 3HG2 VAL 135 8.290 -1.667 2.779 910 H HIS 136 H HIS 136 9.956 -4.040 3.614 911 HA HIS 136 HA HIS 136 9.794 -6.608 2.253 912 1HB HIS 136 2HB HIS 136 9.637 -5.904 5.192 913 2HB HIS 136 1HB HIS 136 9.493 -7.529 4.543 914 HD1 HIS 136 1HD HIS 136 11.640 -8.770 4.087 915 HD2 HIS 136 2HD HIS 136 12.251 -4.773 4.995 916 HE1 HIS 136 1HE HIS 136 14.091 -8.544 4.445 917 HE2 HIS 136 2HE HIS 136 14.317 -6.249 5.403 918 H TRP 137 H TRP 137 7.927 -7.300 1.594 919 HA TRP 137 HA TRP 137 5.517 -6.064 2.670 920 1HB TRP 137 2HB TRP 137 5.936 -7.771 0.199 921 2HB TRP 137 1HB TRP 137 4.400 -7.200 0.793 922 HD1 TRP 137 HD TRP 137 7.749 -5.477 -0.316 923 HE1 TRP 137 1HE TRP 137 7.097 -3.396 -1.616 924 HE3 TRP 137 3HE TRP 137 2.647 -5.750 0.144 925 HZ2 TRP 137 2HZ TRP 137 4.767 -1.998 -2.353 926 HZ3 TRP 137 3HZ TRP 137 1.288 -3.983 -0.895 927 HH2 TRP 137 HH TRP 137 2.326 -2.151 -2.112 928 H HIS 138 H HIS 138 4.479 -7.134 4.169 929 HA HIS 138 HA HIS 138 4.676 -10.048 4.228 930 1HB HIS 138 2HB HIS 138 5.679 -8.971 6.208 931 2HB HIS 138 1HB HIS 138 4.232 -8.007 6.423 932 HD1 HIS 138 1HD HIS 138 5.638 -11.450 7.014 933 HD2 HIS 138 2HD HIS 138 2.178 -9.263 7.692 934 HE1 HIS 138 1HE HIS 138 4.350 -12.763 8.688 935 HE2 HIS 138 2HE HIS 138 2.125 -11.548 8.883 936 H LEU 139 H LEU 139 2.872 -10.821 3.331 937 HA LEU 139 HA LEU 139 0.361 -9.352 3.713 938 1HB LEU 139 2HB LEU 139 1.185 -11.193 1.475 939 2HB LEU 139 1HB LEU 139 -0.391 -10.474 1.633 940 HG LEU 139 HG LEU 139 0.786 -8.203 1.327 941 1HD1 LEU 139 1HD1 LEU 139 3.040 -8.822 1.822 942 2HD1 LEU 139 2HD1 LEU 139 2.892 -8.234 0.165 943 3HD1 LEU 139 3HD1 LEU 139 3.047 -9.967 0.474 944 1HD2 LEU 139 1HD2 LEU 139 0.894 -10.201 -0.900 945 2HD2 LEU 139 2HD2 LEU 139 0.929 -8.449 -1.087 946 3HD2 LEU 139 3HD2 LEU 139 -0.508 -9.243 -0.444 947 H GLU 140 H GLU 140 -1.271 -10.432 4.620 948 HA GLU 140 HA GLU 140 -1.123 -13.332 4.699 949 1HB GLU 140 2HB GLU 140 -1.834 -11.542 7.041 950 2HB GLU 140 1HB GLU 140 -2.091 -13.283 7.009 951 1HG GLU 140 2HG GLU 140 0.320 -13.608 6.685 952 2HG GLU 140 1HG GLU 140 0.558 -11.874 6.804 953 H TYR 141 H TYR 141 -2.939 -14.302 4.131 954 HA TYR 141 HA TYR 141 -5.372 -12.780 4.013 955 1HB TYR 141 2HB TYR 141 -5.603 -13.335 1.512 956 2HB TYR 141 1HB TYR 141 -4.564 -12.000 1.965 957 HD1 TYR 141 1HD TYR 141 -2.133 -12.207 1.775 958 HD2 TYR 141 2HD TYR 141 -4.705 -15.334 0.522 959 HE1 TYR 141 1HE TYR 141 -0.270 -13.221 0.543 960 HE2 TYR 141 2HE TYR 141 -2.865 -16.357 -0.717 961 HH TYR 141 HH TYR 141 0.381 -15.448 -0.298 962 H GLU 142 H GLU 142 -7.180 -13.971 3.335 963 HA GLU 142 HA GLU 142 -7.016 -16.751 4.284 964 1HB GLU 142 2HB GLU 142 -8.401 -15.049 5.505 965 2HB GLU 142 1HB GLU 142 -9.385 -14.898 4.062 966 1HG GLU 142 2HG GLU 142 -10.523 -16.316 5.614 967 2HG GLU 142 1HG GLU 142 -9.938 -17.318 4.284 968 H LYS 143 H LYS 143 -7.258 -18.278 2.742 969 HA LYS 143 HA LYS 143 -8.024 -17.654 0.060 970 1HB LYS 143 2HB LYS 143 -7.360 -20.228 1.475 971 2HB LYS 143 1HB LYS 143 -8.031 -20.244 -0.141 972 1HG LYS 143 2HG LYS 143 -5.601 -20.510 -0.143 973 2HG LYS 143 1HG LYS 143 -6.096 -19.048 -0.975 974 1HD LYS 143 2HD LYS 143 -5.489 -17.755 1.043 975 2HD LYS 143 1HD LYS 143 -4.940 -19.252 1.801 976 1HE LYS 143 2HE LYS 143 -3.901 -18.173 -0.795 977 2HE LYS 143 1HE LYS 143 -3.089 -17.902 0.733 978 1HZ LYS 143 1HZ LYS 143 -2.071 -19.684 -0.420 979 2HZ LYS 143 2HZ LYS 143 -3.505 -20.524 -0.639 980 3HZ LYS 143 3HZ LYS 143 -2.805 -20.339 0.899 981 H ILE 144 H ILE 144 -10.001 -17.577 -0.745 982 HA ILE 144 HA ILE 144 -12.315 -18.459 0.646 983 HB ILE 144 HB ILE 144 -11.842 -17.860 -2.290 984 1HG1 ILE 144 2HG1 ILE 144 -13.256 -16.314 -0.130 985 2HG1 ILE 144 1HG1 ILE 144 -11.663 -15.930 -0.782 986 1HG2 ILE 144 1HG2 ILE 144 -14.477 -18.458 -0.946 987 2HG2 ILE 144 2HG2 ILE 144 -13.643 -19.446 -2.149 988 3HG2 ILE 144 3HG2 ILE 144 -14.280 -17.858 -2.599 989 1HD1 ILE 144 1HD1 ILE 144 -13.353 -14.459 -1.674 990 2HD1 ILE 144 2HD1 ILE 144 -14.286 -15.848 -2.241 991 3HD1 ILE 144 3HD1 ILE 144 -12.710 -15.490 -2.961 992 H SER 145 H SER 145 -10.322 -19.719 -1.920 993 HA SER 145 HA SER 145 -10.874 -22.386 -1.116 994 1HB SER 145 2HB SER 145 -11.471 -21.412 -3.927 995 2HB SER 145 1HB SER 145 -11.527 -23.091 -3.401 996 HG SER 145 HG SER 145 -12.969 -21.815 -1.714 997 H GLU 146 H GLU 146 -9.385 -23.810 -2.444 998 HA GLU 146 HA GLU 146 -6.763 -22.838 -2.023 999 1HB GLU 146 2HB GLU 146 -7.728 -25.248 -3.471 1000 2HB GLU 146 1HB GLU 146 -6.089 -24.998 -2.894 1001 1HG GLU 146 2HG GLU 146 -6.881 -24.976 -0.577 1002 2HG GLU 146 1HG GLU 146 -8.538 -25.188 -1.132 1003 H GLU 147 H GLU 147 -8.293 -24.045 -4.980 1004 HA GLU 147 HA GLU 147 -6.194 -23.194 -6.698 1005 1HB GLU 147 2HB GLU 147 -7.675 -23.806 -8.531 1006 2HB GLU 147 1HB GLU 147 -7.649 -25.060 -7.298 1007 1HG GLU 147 2HG GLU 147 -9.792 -24.388 -6.484 1008 2HG GLU 147 1HG GLU 147 -9.794 -22.962 -7.518 1009 H VAL 148 H VAL 148 -8.796 -21.640 -5.353 1010 HA VAL 148 HA VAL 148 -9.224 -19.683 -7.444 1011 HB VAL 148 HB VAL 148 -10.324 -19.736 -4.605 1012 1HG1 VAL 148 1HG1 VAL 148 -11.149 -17.989 -6.922 1013 2HG1 VAL 148 2HG1 VAL 148 -10.325 -17.453 -5.459 1014 3HG1 VAL 148 3HG1 VAL 148 -11.966 -18.093 -5.361 1015 1HG2 VAL 148 1HG2 VAL 148 -11.554 -20.511 -7.246 1016 2HG2 VAL 148 2HG2 VAL 148 -12.396 -20.480 -5.696 1017 3HG2 VAL 148 3HG2 VAL 148 -11.063 -21.604 -5.954 1018 H ALA 149 H ALA 149 -7.199 -19.926 -4.685 1019 HA ALA 149 HA ALA 149 -6.624 -17.066 -4.672 1020 1HB ALA 149 1HB ALA 149 -6.917 -18.133 -2.550 1021 2HB ALA 149 2HB ALA 149 -5.199 -17.680 -2.744 1022 3HB ALA 149 3HB ALA 149 -5.709 -19.340 -2.977 1023 H HIS 150 H HIS 150 -4.747 -16.232 -5.481 1024 HA HIS 150 HA HIS 150 -2.637 -18.079 -6.187 1025 1HB HIS 150 2HB HIS 150 -4.047 -16.295 -8.137 1026 2HB HIS 150 1HB HIS 150 -2.367 -16.747 -8.384 1027 HD1 HIS 150 1HD HIS 150 -1.909 -18.941 -9.387 1028 HD2 HIS 150 2HD HIS 150 -5.868 -18.557 -8.195 1029 HE1 HIS 150 1HE HIS 150 -3.091 -20.981 -10.291 1030 HE2 HIS 150 2HE HIS 150 -5.363 -20.867 -9.225 1031 HA PRO 151 HA PRO 151 -0.580 -14.928 -3.639 1032 1HB PRO 151 2HB PRO 151 1.513 -16.761 -4.773 1033 2HB PRO 151 1HB PRO 151 1.446 -16.005 -3.170 1034 1HG PRO 151 2HG PRO 151 0.610 -18.499 -3.349 1035 2HG PRO 151 1HG PRO 151 -0.365 -17.307 -2.487 1036 1HD PRO 151 2HD PRO 151 -0.840 -18.496 -5.177 1037 2HD PRO 151 1HD PRO 151 -1.989 -18.025 -3.919 1038 H GLU 152 H GLU 152 0.301 -15.889 -6.916 1039 HA GLU 152 HA GLU 152 2.078 -13.881 -7.580 1040 1HB GLU 152 2HB GLU 152 1.092 -14.108 -9.878 1041 2HB GLU 152 1HB GLU 152 1.970 -15.511 -9.216 1042 1HG GLU 152 2HG GLU 152 -1.027 -15.229 -9.074 1043 2HG GLU 152 1HG GLU 152 -0.270 -15.791 -10.555 1044 H THR 153 H THR 153 -1.445 -13.696 -7.426 1045 HA THR 153 HA THR 153 -1.579 -11.356 -8.990 1046 HB THR 153 HB THR 153 -3.921 -11.211 -8.277 1047 HG1 THR 153 1HG THR 153 -4.679 -12.756 -6.783 1048 1HG2 THR 153 1HG2 THR 153 -3.327 -12.811 -10.014 1049 2HG2 THR 153 2HG2 THR 153 -4.636 -13.459 -9.018 1050 3HG2 THR 153 3HG2 THR 153 -2.975 -14.025 -8.793 1051 H LEU 154 H LEU 154 -1.007 -12.019 -5.654 1052 HA LEU 154 HA LEU 154 -1.437 -9.302 -4.810 1053 1HB LEU 154 2HB LEU 154 0.176 -11.449 -3.437 1054 2HB LEU 154 1HB LEU 154 -0.287 -9.914 -2.746 1055 HG LEU 154 HG LEU 154 -1.668 -11.397 -1.764 1056 1HD1 LEU 154 1HD1 LEU 154 -3.267 -10.349 -4.049 1057 2HD1 LEU 154 2HD1 LEU 154 -2.954 -9.559 -2.498 1058 3HD1 LEU 154 3HD1 LEU 154 -3.937 -11.023 -2.562 1059 1HD2 LEU 154 1HD2 LEU 154 -2.085 -12.781 -4.385 1060 2HD2 LEU 154 2HD2 LEU 154 -2.960 -13.149 -2.884 1061 3HD2 LEU 154 3HD2 LEU 154 -1.211 -13.326 -2.939 1062 H LEU 155 H LEU 155 1.287 -11.222 -5.899 1063 HA LEU 155 HA LEU 155 3.254 -9.256 -5.499 1064 1HB LEU 155 2HB LEU 155 3.076 -11.392 -7.611 1065 2HB LEU 155 1HB LEU 155 4.472 -10.354 -7.405 1066 HG LEU 155 HG LEU 155 3.424 -12.314 -5.358 1067 1HD1 LEU 155 1HD1 LEU 155 5.850 -12.334 -7.104 1068 2HD1 LEU 155 2HD1 LEU 155 4.450 -13.414 -7.254 1069 3HD1 LEU 155 3HD1 LEU 155 5.502 -13.495 -5.824 1070 1HD2 LEU 155 1HD2 LEU 155 5.876 -10.550 -5.339 1071 2HD2 LEU 155 2HD2 LEU 155 5.490 -11.788 -4.147 1072 3HD2 LEU 155 3HD2 LEU 155 4.462 -10.371 -4.297 1073 H GLN 156 H GLN 156 0.920 -9.740 -8.026 1074 HA GLN 156 HA GLN 156 1.868 -7.737 -9.800 1075 1HB GLN 156 2HB GLN 156 -0.977 -8.713 -9.447 1076 2HB GLN 156 1HB GLN 156 -0.351 -7.841 -10.836 1077 1HG GLN 156 2HG GLN 156 0.491 -10.580 -9.949 1078 2HG GLN 156 1HG GLN 156 -0.611 -10.226 -11.287 1079 1HE2 GLN 156 1HE2 GLN 156 2.653 -10.340 -10.195 1080 2HE2 GLN 156 2HE2 GLN 156 3.395 -10.020 -11.703 1081 H PHE 157 H PHE 157 -0.309 -7.731 -7.065 1082 HA PHE 157 HA PHE 157 -1.128 -5.019 -7.346 1083 1HB PHE 157 2HB PHE 157 -2.458 -6.685 -6.082 1084 2HB PHE 157 1HB PHE 157 -1.152 -6.844 -4.919 1085 HD1 PHE 157 1HD PHE 157 -1.153 -5.528 -3.013 1086 HD2 PHE 157 2HD PHE 157 -3.524 -4.369 -6.333 1087 HE1 PHE 157 1HE PHE 157 -2.200 -3.686 -1.641 1088 HE2 PHE 157 2HE PHE 157 -4.549 -2.572 -4.998 1089 HZ PHE 157 HZ PHE 157 -3.882 -2.240 -2.659 1090 H CYS 158 H CYS 158 1.238 -6.684 -5.295 1091 HA CYS 158 HA CYS 158 2.248 -4.528 -3.892 1092 1HB CYS 158 2HB CYS 158 3.681 -7.032 -4.773 1093 2HB CYS 158 1HB CYS 158 4.259 -5.918 -3.542 1094 HG CYS 158 HG CYS 158 2.638 -6.640 -1.599 1095 H VAL 159 H VAL 159 3.397 -5.861 -7.000 1096 HA VAL 159 HA VAL 159 5.665 -4.245 -7.178 1097 HB VAL 159 HB VAL 159 5.251 -6.289 -8.557 1098 1HG1 VAL 159 1HG1 VAL 159 3.439 -4.596 -10.195 1099 2HG1 VAL 159 2HG1 VAL 159 3.005 -5.989 -9.213 1100 3HG1 VAL 159 3HG1 VAL 159 4.024 -6.204 -10.632 1101 1HG2 VAL 159 1HG2 VAL 159 5.975 -3.826 -10.116 1102 2HG2 VAL 159 2HG2 VAL 159 6.363 -5.482 -10.598 1103 3HG2 VAL 159 3HG2 VAL 159 7.071 -4.790 -9.133 1104 H GLU 160 H GLU 160 2.452 -3.702 -8.366 1105 HA GLU 160 HA GLU 160 2.983 -1.282 -9.767 1106 1HB GLU 160 2HB GLU 160 0.379 -2.205 -8.558 1107 2HB GLU 160 1HB GLU 160 0.565 -0.956 -9.783 1108 1HG GLU 160 2HG GLU 160 1.274 -3.859 -10.121 1109 2HG GLU 160 1HG GLU 160 -0.190 -3.086 -10.708 1110 H VAL 161 H VAL 161 1.745 -1.959 -6.532 1111 HA VAL 161 HA VAL 161 1.464 0.748 -5.789 1112 HB VAL 161 HB VAL 161 1.778 -1.698 -4.011 1113 1HG1 VAL 161 1HG1 VAL 161 0.778 -0.317 -2.229 1114 2HG1 VAL 161 2HG1 VAL 161 0.792 1.077 -3.309 1115 3HG1 VAL 161 3HG1 VAL 161 2.314 0.360 -2.776 1116 1HG2 VAL 161 1HG2 VAL 161 -0.179 -1.814 -5.453 1117 2HG2 VAL 161 2HG2 VAL 161 -0.687 -0.212 -4.918 1118 3HG2 VAL 161 3HG2 VAL 161 -0.663 -1.557 -3.776 1119 H SER 162 H SER 162 4.174 -1.518 -5.606 1120 HA SER 162 HA SER 162 5.870 0.016 -3.987 1121 1HB SER 162 2HB SER 162 6.554 -1.867 -6.236 1122 2HB SER 162 1HB SER 162 7.675 -1.255 -5.012 1123 HG SER 162 HG SER 162 5.393 -2.883 -4.622 1124 H LYS 163 H LYS 163 5.397 0.025 -7.504 1125 HA LYS 163 HA LYS 163 7.353 1.957 -8.095 1126 1HB LYS 163 2HB LYS 163 4.752 1.387 -9.535 1127 2HB LYS 163 1HB LYS 163 6.083 2.328 -10.188 1128 1HG LYS 163 2HG LYS 163 7.506 0.349 -10.143 1129 2HG LYS 163 1HG LYS 163 6.178 -0.592 -9.459 1130 1HD LYS 163 2HD LYS 163 4.835 -0.148 -11.465 1131 2HD LYS 163 1HD LYS 163 6.167 0.789 -12.143 1132 1HE LYS 163 2HE LYS 163 6.258 -2.145 -11.437 1133 2HE LYS 163 1HE LYS 163 6.080 -1.490 -13.061 1134 1HZ LYS 163 1HZ LYS 163 8.276 -0.451 -12.816 1135 2HZ LYS 163 2HZ LYS 163 8.362 -2.116 -12.608 1136 3HZ LYS 163 3HZ LYS 163 8.430 -1.109 -11.278 1137 H GLU 164 H GLU 164 3.910 2.196 -7.443 1138 HA GLU 164 HA GLU 164 3.489 4.928 -7.756 1139 1HB GLU 164 2HB GLU 164 1.719 3.234 -7.601 1140 2HB GLU 164 1HB GLU 164 2.154 2.955 -5.923 1141 1HG GLU 164 2HG GLU 164 0.154 4.302 -6.057 1142 2HG GLU 164 1HG GLU 164 1.489 5.217 -5.363 1143 H ILE 165 H ILE 165 4.189 3.094 -4.776 1144 HA ILE 165 HA ILE 165 4.053 5.394 -3.135 1145 HB ILE 165 HB ILE 165 3.607 2.969 -2.475 1146 1HG1 ILE 165 2HG1 ILE 165 3.741 4.775 -0.740 1147 2HG1 ILE 165 1HG1 ILE 165 4.204 3.201 -0.129 1148 1HG2 ILE 165 1HG2 ILE 165 5.452 1.606 -1.604 1149 2HG2 ILE 165 2HG2 ILE 165 6.594 2.797 -2.233 1150 3HG2 ILE 165 3HG2 ILE 165 5.549 1.907 -3.340 1151 1HD1 ILE 165 1HD1 ILE 165 5.610 4.979 0.746 1152 2HD1 ILE 165 2HD1 ILE 165 6.061 5.435 -0.897 1153 3HD1 ILE 165 3HD1 ILE 165 6.552 3.867 -0.249 1154 H ASP 166 H ASP 166 6.704 3.689 -4.701 1155 HA ASP 166 HA ASP 166 8.812 5.056 -3.397 1156 1HB ASP 166 2HB ASP 166 9.272 2.996 -4.555 1157 2HB ASP 166 1HB ASP 166 8.747 3.691 -6.083 1158 H GLU 167 H GLU 167 7.269 5.686 -6.537 1159 HA GLU 167 HA GLU 167 8.741 8.139 -6.978 1160 1HB GLU 167 2HB GLU 167 7.154 8.594 -8.757 1161 2HB GLU 167 1HB GLU 167 7.724 6.937 -8.878 1162 1HG GLU 167 2HG GLU 167 5.672 6.133 -7.909 1163 2HG GLU 167 1HG GLU 167 5.107 7.784 -7.670 1164 H HIS 168 H HIS 168 5.857 7.398 -5.271 1165 HA HIS 168 HA HIS 168 4.997 10.063 -4.922 1166 1HB HIS 168 2HB HIS 168 3.698 7.969 -4.317 1167 2HB HIS 168 1HB HIS 168 4.760 7.784 -2.936 1168 HD1 HIS 168 1HD HIS 168 1.735 9.428 -4.068 1169 HD2 HIS 168 2HD HIS 168 4.410 9.872 -0.928 1170 HE1 HIS 168 1HE HIS 168 0.543 10.845 -2.365 1171 HE2 HIS 168 2HE HIS 168 2.367 11.419 -0.740 1172 H LEU 169 H LEU 169 7.416 8.085 -3.308 1173 HA LEU 169 HA LEU 169 8.041 10.023 -1.289 1174 1HB LEU 169 2HB LEU 169 9.645 7.660 -2.245 1175 2HB LEU 169 1HB LEU 169 9.968 8.589 -0.805 1176 HG LEU 169 HG LEU 169 7.560 6.849 -1.292 1177 1HD1 LEU 169 1HD1 LEU 169 9.935 6.487 0.531 1178 2HD1 LEU 169 2HD1 LEU 169 9.610 5.584 -0.950 1179 3HD1 LEU 169 3HD1 LEU 169 8.532 5.422 0.434 1180 1HD2 LEU 169 1HD2 LEU 169 7.044 7.258 1.067 1181 2HD2 LEU 169 2HD2 LEU 169 6.985 8.747 0.123 1182 3HD2 LEU 169 3HD2 LEU 169 8.380 8.404 1.154 1183 H LEU 170 H LEU 170 9.561 8.981 -4.346 1184 HA LEU 170 HA LEU 170 11.843 10.688 -4.141 1185 1HB LEU 170 2HB LEU 170 10.558 9.599 -6.640 1186 2HB LEU 170 1HB LEU 170 12.169 10.254 -6.499 1187 HG LEU 170 HG LEU 170 11.205 7.702 -5.222 1188 1HD1 LEU 170 1HD1 LEU 170 11.344 7.611 -7.662 1189 2HD1 LEU 170 2HD1 LEU 170 12.582 6.626 -6.901 1190 3HD1 LEU 170 3HD1 LEU 170 13.009 8.191 -7.592 1191 1HD2 LEU 170 1HD2 LEU 170 13.565 7.336 -4.720 1192 2HD2 LEU 170 2HD2 LEU 170 12.987 8.808 -3.944 1193 3HD2 LEU 170 3HD2 LEU 170 13.967 8.910 -5.406 1194 H ALA 171 H ALA 171 8.738 10.912 -5.807 1195 HA ALA 171 HA ALA 171 7.589 12.510 -6.820 1196 1HB ALA 171 1HB ALA 171 7.483 14.644 -5.657 1197 2HB ALA 171 2HB ALA 171 8.989 14.224 -4.795 1198 3HB ALA 171 3HB ALA 171 7.531 13.244 -4.574 1199 H GLU 172 H GLU 172 10.302 11.951 -7.823 1200 HA GLU 172 HA GLU 172 11.244 14.466 -8.876 1201 1HB GLU 172 2HB GLU 172 13.003 13.111 -9.934 1202 2HB GLU 172 1HB GLU 172 12.917 12.900 -8.191 1203 1HG GLU 172 2HG GLU 172 11.792 10.782 -8.467 1204 2HG GLU 172 1HG GLU 172 11.698 11.057 -10.204 1205 H GLU 173 H GLU 173 11.395 14.968 -10.969 1206 HA GLU 173 HA GLU 173 10.313 13.346 -13.072 1207 1HB GLU 173 2HB GLU 173 9.178 16.093 -12.455 1208 2HB GLU 173 1HB GLU 173 8.905 15.237 -13.959 1209 1HG GLU 173 2HG GLU 173 7.747 13.458 -12.674 1210 2HG GLU 173 1HG GLU 173 7.958 14.425 -11.217 Start of MODEL 15 1 H THR 17 H THR 17 -6.374 -31.534 -5.573 2 HA THR 17 HA THR 17 -4.711 -29.702 -4.142 3 HB THR 17 HB THR 17 -6.013 -28.988 -6.172 4 HG1 THR 17 1HG THR 17 -6.929 -27.458 -3.962 5 1HG2 THR 17 1HG2 THR 17 -8.092 -30.224 -5.743 6 2HG2 THR 17 2HG2 THR 17 -8.411 -28.497 -5.891 7 3HG2 THR 17 3HG2 THR 17 -8.378 -29.257 -4.299 8 H GLU 18 H GLU 18 -5.234 -28.948 -2.321 9 HA GLU 18 HA GLU 18 -7.507 -29.039 -0.803 10 1HB GLU 18 2HB GLU 18 -6.871 -30.612 0.959 11 2HB GLU 18 1HB GLU 18 -7.319 -31.420 -0.549 12 1HG GLU 18 2HG GLU 18 -4.943 -31.788 -1.011 13 2HG GLU 18 1HG GLU 18 -4.525 -30.943 0.484 14 H ALA 19 H ALA 19 -7.134 -28.294 1.366 15 HA ALA 19 HA ALA 19 -4.502 -27.465 2.119 16 1HB ALA 19 1HB ALA 19 -6.578 -25.433 1.352 17 2HB ALA 19 2HB ALA 19 -5.079 -25.757 0.485 18 3HB ALA 19 3HB ALA 19 -5.024 -25.058 2.113 19 H SER 20 H SER 20 -4.606 -28.063 4.155 20 HA SER 20 HA SER 20 -6.997 -28.443 5.554 21 1HB SER 20 2HB SER 20 -5.426 -28.803 7.501 22 2HB SER 20 1HB SER 20 -5.148 -29.805 6.079 23 HG SER 20 HG SER 20 -3.240 -29.083 6.153 24 H SER 21 H SER 21 -4.614 -25.847 5.689 25 HA SER 21 HA SER 21 -6.044 -24.573 7.845 26 1HB SER 21 2HB SER 21 -4.180 -22.937 7.706 27 2HB SER 21 1HB SER 21 -3.656 -24.601 7.983 28 HG SER 21 HG SER 21 -2.385 -24.028 6.356 29 H LEU 22 H LEU 22 -5.506 -24.088 4.392 30 HA LEU 22 HA LEU 22 -6.105 -22.550 2.891 31 1HB LEU 22 2HB LEU 22 -8.365 -22.255 4.819 32 2HB LEU 22 1HB LEU 22 -8.329 -21.404 3.290 33 HG LEU 22 HG LEU 22 -8.178 -24.405 3.509 34 1HD1 LEU 22 1HD1 LEU 22 -10.490 -24.372 2.900 35 2HD1 LEU 22 2HD1 LEU 22 -10.515 -22.593 3.026 36 3HD1 LEU 22 3HD1 LEU 22 -10.170 -23.578 4.456 37 1HD2 LEU 22 1HD2 LEU 22 -8.799 -24.315 1.154 38 2HD2 LEU 22 2HD2 LEU 22 -7.298 -23.431 1.419 39 3HD2 LEU 22 3HD2 LEU 22 -8.810 -22.557 1.201 40 H VAL 23 H VAL 23 -4.578 -21.744 5.391 41 HA VAL 23 HA VAL 23 -4.952 -18.866 5.202 42 HB VAL 23 HB VAL 23 -3.028 -20.486 6.929 43 1HG1 VAL 23 1HG1 VAL 23 -2.121 -18.253 6.420 44 2HG1 VAL 23 2HG1 VAL 23 -2.596 -18.370 8.114 45 3HG1 VAL 23 3HG1 VAL 23 -3.626 -17.516 6.966 46 1HG2 VAL 23 1HG2 VAL 23 -4.484 -19.781 8.777 47 2HG2 VAL 23 2HG2 VAL 23 -5.360 -20.748 7.576 48 3HG2 VAL 23 3HG2 VAL 23 -5.537 -18.994 7.593 49 H GLY 24 H GLY 24 -3.597 -17.608 4.119 50 1HA GLY 24 2HA GLY 24 -1.344 -18.946 2.776 51 2HA GLY 24 1HA GLY 24 -2.449 -17.888 1.907 52 H LYS 25 H LYS 25 0.450 -17.708 2.392 53 HA LYS 25 HA LYS 25 0.461 -14.989 3.511 54 1HB LYS 25 2HB LYS 25 2.714 -16.908 3.572 55 2HB LYS 25 1HB LYS 25 2.659 -15.333 4.325 56 1HG LYS 25 2HG LYS 25 0.998 -16.307 5.927 57 2HG LYS 25 1HG LYS 25 1.342 -17.890 5.203 58 1HD LYS 25 2HD LYS 25 3.277 -16.050 6.613 59 2HD LYS 25 1HD LYS 25 2.809 -17.689 7.061 60 1HE LYS 25 2HE LYS 25 4.336 -16.948 4.539 61 2HE LYS 25 1HE LYS 25 5.088 -17.567 6.008 62 1HZ LYS 25 1HZ LYS 25 3.157 -18.993 4.252 63 2HZ LYS 25 2HZ LYS 25 3.791 -19.626 5.696 64 3HZ LYS 25 3HZ LYS 25 4.800 -19.272 4.388 65 H LEU 26 H LEU 26 1.984 -13.690 2.431 66 HA LEU 26 HA LEU 26 3.720 -15.046 0.667 67 1HB LEU 26 2HB LEU 26 1.850 -14.498 -0.840 68 2HB LEU 26 1HB LEU 26 1.916 -12.822 -0.343 69 HG LEU 26 HG LEU 26 4.156 -12.629 -1.385 70 1HD1 LEU 26 1HD1 LEU 26 4.867 -14.939 -1.257 71 2HD1 LEU 26 2HD1 LEU 26 4.911 -14.368 -2.923 72 3HD1 LEU 26 3HD1 LEU 26 3.598 -15.415 -2.389 73 1HD2 LEU 26 1HD2 LEU 26 2.163 -11.954 -2.599 74 2HD2 LEU 26 2HD2 LEU 26 1.966 -13.600 -3.208 75 3HD2 LEU 26 3HD2 LEU 26 3.371 -12.641 -3.685 76 H GLU 27 H GLU 27 5.681 -14.032 0.645 77 HA GLU 27 HA GLU 27 5.734 -11.335 1.713 78 1HB GLU 27 2HB GLU 27 6.250 -12.911 3.561 79 2HB GLU 27 1HB GLU 27 7.596 -13.537 2.615 80 1HG GLU 27 2HG GLU 27 8.685 -11.381 2.679 81 2HG GLU 27 1HG GLU 27 7.310 -10.692 3.532 82 H THR 28 H THR 28 7.209 -10.036 0.802 83 HA THR 28 HA THR 28 9.202 -11.133 -0.929 84 HB THR 28 HB THR 28 7.240 -11.093 -2.463 85 HG1 THR 28 1HG THR 28 8.335 -8.961 -3.592 86 1HG2 THR 28 1HG2 THR 28 5.920 -9.358 -1.301 87 2HG2 THR 28 2HG2 THR 28 6.119 -8.987 -3.011 88 3HG2 THR 28 3HG2 THR 28 7.086 -8.136 -1.814 89 H ASP 29 H ASP 29 10.820 -9.664 -1.262 90 HA ASP 29 HA ASP 29 10.505 -7.124 0.155 91 1HB ASP 29 2HB ASP 29 12.934 -7.075 0.449 92 2HB ASP 29 1HB ASP 29 12.276 -8.544 1.147 93 H VAL 30 H VAL 30 10.705 -5.350 -0.934 94 HA VAL 30 HA VAL 30 11.661 -5.581 -3.681 95 HB VAL 30 HB VAL 30 9.547 -3.633 -2.632 96 1HG1 VAL 30 1HG1 VAL 30 10.933 -2.597 -4.354 97 2HG1 VAL 30 2HG1 VAL 30 9.314 -2.942 -4.963 98 3HG1 VAL 30 3HG1 VAL 30 10.663 -3.983 -5.414 99 1HG2 VAL 30 1HG2 VAL 30 9.318 -5.948 -4.552 100 2HG2 VAL 30 2HG2 VAL 30 8.024 -4.831 -4.114 101 3HG2 VAL 30 3HG2 VAL 30 8.704 -5.913 -2.900 102 H GLU 31 H GLU 31 13.224 -4.242 -4.270 103 HA GLU 31 HA GLU 31 14.364 -2.701 -2.085 104 1HB GLU 31 2HB GLU 31 15.731 -3.431 -4.679 105 2HB GLU 31 1HB GLU 31 16.349 -2.953 -3.069 106 1HG GLU 31 2HG GLU 31 15.712 -5.012 -2.069 107 2HG GLU 31 1HG GLU 31 14.839 -5.491 -3.507 108 H ILE 32 H ILE 32 14.215 -0.539 -2.162 109 HA ILE 32 HA ILE 32 13.324 0.601 -4.702 110 HB ILE 32 HB ILE 32 12.221 2.391 -3.377 111 1HG1 ILE 32 2HG1 ILE 32 12.955 0.659 -0.993 112 2HG1 ILE 32 1HG1 ILE 32 13.594 2.256 -1.341 113 1HG2 ILE 32 1HG2 ILE 32 10.901 0.513 -4.175 114 2HG2 ILE 32 2HG2 ILE 32 10.311 1.030 -2.597 115 3HG2 ILE 32 3HG2 ILE 32 11.306 -0.416 -2.738 116 1HD1 ILE 32 1HD1 ILE 32 11.938 2.339 0.416 117 2HD1 ILE 32 2HD1 ILE 32 10.730 1.607 -0.636 118 3HD1 ILE 32 3HD1 ILE 32 11.350 3.214 -0.996 119 H LYS 33 H LYS 33 13.694 3.101 -4.651 120 HA LYS 33 HA LYS 33 16.573 3.514 -4.264 121 1HB LYS 33 2HB LYS 33 14.509 4.984 -5.910 122 2HB LYS 33 1HB LYS 33 16.202 5.437 -5.797 123 1HG LYS 33 2HG LYS 33 16.851 3.345 -6.837 124 2HG LYS 33 1HG LYS 33 15.162 2.835 -6.895 125 1HD LYS 33 2HD LYS 33 14.633 4.687 -8.377 126 2HD LYS 33 1HD LYS 33 16.292 5.273 -8.268 127 1HE LYS 33 2HE LYS 33 15.461 2.594 -9.378 128 2HE LYS 33 1HE LYS 33 15.859 4.013 -10.344 129 1HZ LYS 33 1HZ LYS 33 17.710 2.470 -10.161 130 2HZ LYS 33 2HZ LYS 33 17.752 2.618 -8.495 131 3HZ LYS 33 3HZ LYS 33 18.107 3.950 -9.475 132 H ALA 34 H ALA 34 13.410 4.541 -3.409 133 HA ALA 34 HA ALA 34 14.092 6.944 -2.123 134 1HB ALA 34 1HB ALA 34 11.763 5.105 -1.618 135 2HB ALA 34 2HB ALA 34 11.813 6.402 -2.808 136 3HB ALA 34 3HB ALA 34 11.900 6.784 -1.088 137 H SER 35 H SER 35 14.200 7.370 0.106 138 HA SER 35 HA SER 35 15.518 5.250 1.573 139 1HB SER 35 2HB SER 35 15.406 8.223 1.980 140 2HB SER 35 1HB SER 35 16.268 7.121 3.049 141 HG SER 35 HG SER 35 17.603 6.614 1.507 142 H ALA 36 H ALA 36 14.976 4.664 3.595 143 HA ALA 36 HA ALA 36 12.295 4.567 4.373 144 1HB ALA 36 1HB ALA 36 14.061 2.953 4.984 145 2HB ALA 36 2HB ALA 36 13.191 3.551 6.405 146 3HB ALA 36 3HB ALA 36 14.799 4.167 6.008 147 H ASP 37 H ASP 37 14.960 6.605 5.227 148 HA ASP 37 HA ASP 37 13.916 8.098 7.334 149 1HB ASP 37 2HB ASP 37 16.243 8.221 6.665 150 2HB ASP 37 1HB ASP 37 15.791 8.946 5.128 151 H LYS 38 H LYS 38 13.504 8.461 3.884 152 HA LYS 38 HA LYS 38 12.178 10.953 4.000 153 1HB LYS 38 2HB LYS 38 12.311 8.889 1.831 154 2HB LYS 38 1HB LYS 38 11.581 10.486 1.648 155 1HG LYS 38 2HG LYS 38 13.679 11.555 2.157 156 2HG LYS 38 1HG LYS 38 14.435 9.997 2.458 157 1HD LYS 38 2HD LYS 38 15.031 10.829 0.292 158 2HD LYS 38 1HD LYS 38 14.023 9.373 0.166 159 1HE LYS 38 2HE LYS 38 13.370 11.072 -1.495 160 2HE LYS 38 1HE LYS 38 12.076 10.743 -0.354 161 1HZ LYS 38 1HZ LYS 38 13.893 13.107 -0.288 162 2HZ LYS 38 2HZ LYS 38 12.662 12.786 0.831 163 3HZ LYS 38 3HZ LYS 38 12.288 13.066 -0.766 164 H PHE 39 H PHE 39 11.169 7.613 3.929 165 HA PHE 39 HA PHE 39 8.386 7.925 3.616 166 1HB PHE 39 2HB PHE 39 9.720 5.761 3.506 167 2HB PHE 39 1HB PHE 39 9.859 5.827 5.251 168 HD1 PHE 39 1HD PHE 39 7.889 4.795 2.460 169 HD2 PHE 39 2HD PHE 39 7.710 5.661 6.626 170 HE1 PHE 39 1HE PHE 39 5.786 3.525 2.631 171 HE2 PHE 39 2HE PHE 39 5.613 4.383 6.805 172 HZ PHE 39 HZ PHE 39 4.648 3.320 4.806 173 H HIS 40 H HIS 40 10.533 8.012 6.347 174 HA HIS 40 HA HIS 40 8.690 8.243 8.456 175 1HB HIS 40 2HB HIS 40 11.009 7.585 8.807 176 2HB HIS 40 1HB HIS 40 11.569 9.137 8.226 177 HD1 HIS 40 1HD HIS 40 12.566 10.314 10.211 178 HD2 HIS 40 2HD HIS 40 9.046 8.329 11.202 179 HE1 HIS 40 1HE HIS 40 12.181 10.795 12.611 180 HE2 HIS 40 2HE HIS 40 9.965 9.788 13.136 181 H HIS 41 H HIS 41 10.104 10.678 6.321 182 HA HIS 41 HA HIS 41 9.241 12.888 7.970 183 1HB HIS 41 2HB HIS 41 10.204 12.970 5.105 184 2HB HIS 41 1HB HIS 41 9.900 14.371 6.111 185 HD1 HIS 41 1HD HIS 41 11.459 14.040 8.530 186 HD2 HIS 41 2HD HIS 41 12.793 12.527 4.918 187 HE1 HIS 41 1HE HIS 41 13.926 13.699 8.814 188 HE2 HIS 41 2HE HIS 41 14.544 12.384 6.735 189 H MET 42 H MET 42 8.202 11.546 4.889 190 HA MET 42 HA MET 42 6.296 13.487 4.342 191 1HB MET 42 2HB MET 42 5.467 12.028 2.584 192 2HB MET 42 1HB MET 42 7.217 12.069 2.609 193 1HG MET 42 2HG MET 42 6.612 9.842 2.150 194 2HG MET 42 1HG MET 42 7.120 9.860 3.836 195 1HE MET 42 1HE MET 42 4.298 7.117 3.793 196 2HE MET 42 2HE MET 42 5.971 7.472 4.218 197 3HE MET 42 3HE MET 42 5.478 7.441 2.525 198 H PHE 43 H PHE 43 5.925 10.674 6.348 199 HA PHE 43 HA PHE 43 3.039 10.996 6.351 200 1HB PHE 43 2HB PHE 43 4.046 8.714 6.500 201 2HB PHE 43 1HB PHE 43 4.723 9.141 8.066 202 HD1 PHE 43 1HD PHE 43 1.694 8.263 6.230 203 HD2 PHE 43 2HD PHE 43 3.263 9.337 10.037 204 HE1 PHE 43 1HE PHE 43 -0.391 7.510 7.301 205 HE2 PHE 43 2HE PHE 43 1.187 8.582 11.113 206 HZ PHE 43 HZ PHE 43 -0.647 7.671 9.740 207 H ALA 44 H ALA 44 5.762 11.857 8.295 208 HA ALA 44 HA ALA 44 4.210 12.516 10.620 209 1HB ALA 44 1HB ALA 44 6.542 11.777 10.822 210 2HB ALA 44 2HB ALA 44 6.295 13.370 11.543 211 3HB ALA 44 3HB ALA 44 7.071 13.223 9.965 212 H GLY 45 H GLY 45 5.748 14.306 8.006 213 1HA GLY 45 2HA GLY 45 4.799 16.839 9.064 214 2HA GLY 45 1HA GLY 45 5.755 16.601 7.605 215 H LYS 46 H LYS 46 3.515 18.286 7.693 216 HA LYS 46 HA LYS 46 1.585 16.709 6.156 217 1HB LYS 46 2HB LYS 46 1.079 19.179 7.811 218 2HB LYS 46 1HB LYS 46 -0.067 18.582 6.630 219 1HG LYS 46 2HG LYS 46 -0.773 17.858 8.783 220 2HG LYS 46 1HG LYS 46 -0.175 16.450 7.921 221 1HD LYS 46 2HD LYS 46 1.949 16.646 9.160 222 2HD LYS 46 1HD LYS 46 1.285 18.029 10.033 223 1HE LYS 46 2HE LYS 46 0.209 15.211 10.057 224 2HE LYS 46 1HE LYS 46 1.100 15.993 11.360 225 1HZ LYS 46 1HZ LYS 46 -0.730 17.610 11.547 226 2HZ LYS 46 2HZ LYS 46 -1.254 16.034 11.805 227 3HZ LYS 46 3HZ LYS 46 -1.596 16.758 10.350 228 HA PRO 47 HA PRO 47 2.864 19.487 2.834 229 1HB PRO 47 2HB PRO 47 2.056 17.311 1.078 230 2HB PRO 47 1HB PRO 47 3.675 17.967 1.312 231 1HG PRO 47 2HG PRO 47 2.941 15.456 2.099 232 2HG PRO 47 1HG PRO 47 4.237 16.388 2.865 233 1HD PRO 47 2HD PRO 47 1.414 15.974 3.758 234 2HD PRO 47 1HD PRO 47 2.911 16.010 4.715 235 H HIS 48 H HIS 48 1.378 20.581 1.420 236 HA HIS 48 HA HIS 48 -1.332 20.409 2.294 237 1HB HIS 48 2HB HIS 48 -0.238 22.538 1.465 238 2HB HIS 48 1HB HIS 48 -0.363 21.896 -0.166 239 HD1 HIS 48 1HD HIS 48 -2.340 23.421 2.564 240 HD2 HIS 48 2HD HIS 48 -3.022 21.852 -1.217 241 HE1 HIS 48 1HE HIS 48 -4.671 24.124 1.955 242 HE2 HIS 48 2HE HIS 48 -4.916 23.429 -0.441 243 H HIS 49 H HIS 49 0.420 19.201 -0.435 244 HA HIS 49 HA HIS 49 -1.648 17.243 -0.857 245 1HB HIS 49 2HB HIS 49 -0.606 18.994 -3.105 246 2HB HIS 49 1HB HIS 49 -1.288 17.405 -3.392 247 HD1 HIS 49 1HD HIS 49 -2.238 20.749 -3.598 248 HD2 HIS 49 2HD HIS 49 -4.038 17.376 -2.012 249 HE1 HIS 49 1HE HIS 49 -4.693 21.266 -3.516 250 HE2 HIS 49 2HE HIS 49 -5.498 19.428 -2.015 251 H VAL 50 H VAL 50 -0.803 15.446 -2.111 252 HA VAL 50 HA VAL 50 1.830 14.821 -1.236 253 HB VAL 50 HB VAL 50 1.567 12.729 -2.452 254 1HG1 VAL 50 1HG1 VAL 50 0.583 12.865 -0.251 255 2HG1 VAL 50 2HG1 VAL 50 -0.408 11.840 -1.287 256 3HG1 VAL 50 3HG1 VAL 50 -0.917 13.490 -0.926 257 1HG2 VAL 50 1HG2 VAL 50 0.419 13.528 -4.451 258 2HG2 VAL 50 2HG2 VAL 50 -1.022 13.892 -3.502 259 3HG2 VAL 50 3HG2 VAL 50 -0.501 12.220 -3.710 260 H SER 51 H SER 51 3.531 14.061 -2.699 261 HA SER 51 HA SER 51 4.346 16.093 -4.389 262 1HB SER 51 2HB SER 51 6.067 14.457 -5.098 263 2HB SER 51 1HB SER 51 5.944 14.734 -3.366 264 HG SER 51 HG SER 51 5.087 12.843 -3.065 265 H LYS 52 H LYS 52 4.567 16.296 -6.506 266 HA LYS 52 HA LYS 52 4.011 16.330 -8.656 267 1HB LYS 52 2HB LYS 52 5.077 14.090 -8.676 268 2HB LYS 52 1HB LYS 52 3.506 13.354 -8.386 269 1HG LYS 52 2HG LYS 52 2.697 14.356 -10.501 270 2HG LYS 52 1HG LYS 52 4.324 14.960 -10.796 271 1HD LYS 52 2HD LYS 52 3.502 12.096 -10.490 272 2HD LYS 52 1HD LYS 52 3.934 12.889 -12.011 273 1HE LYS 52 2HE LYS 52 6.220 13.287 -11.047 274 2HE LYS 52 1HE LYS 52 5.724 12.360 -9.637 275 1HZ LYS 52 1HZ LYS 52 5.928 11.344 -12.411 276 2HZ LYS 52 2HZ LYS 52 5.356 10.444 -11.098 277 3HZ LYS 52 3HZ LYS 52 6.937 10.979 -11.114 278 H ALA 53 H ALA 53 1.767 13.778 -7.739 279 HA ALA 53 HA ALA 53 -0.454 13.502 -7.894 280 1HB ALA 53 1HB ALA 53 -1.922 15.298 -7.145 281 2HB ALA 53 2HB ALA 53 -0.628 16.473 -7.364 282 3HB ALA 53 3HB ALA 53 -0.488 15.229 -6.121 283 H SER 54 H SER 54 0.061 16.611 -9.417 284 HA SER 54 HA SER 54 -1.789 16.033 -11.542 285 1HB SER 54 2HB SER 54 0.025 18.388 -11.061 286 2HB SER 54 1HB SER 54 -1.389 18.331 -12.117 287 HG SER 54 HG SER 54 -2.446 17.645 -10.007 288 HA PRO 55 HA PRO 55 1.739 15.195 -14.364 289 1HB PRO 55 2HB PRO 55 -0.039 15.886 -16.586 290 2HB PRO 55 1HB PRO 55 0.598 14.296 -16.163 291 1HG PRO 55 2HG PRO 55 -2.028 14.941 -15.942 292 2HG PRO 55 1HG PRO 55 -1.229 13.763 -14.883 293 1HD PRO 55 2HD PRO 55 -1.909 16.633 -14.359 294 2HD PRO 55 1HD PRO 55 -2.069 15.212 -13.302 295 H GLY 56 H GLY 56 1.698 16.726 -16.903 296 1HA GLY 56 2HA GLY 56 2.579 19.292 -15.905 297 2HA GLY 56 1HA GLY 56 2.580 18.767 -17.587 298 H ASN 57 H ASN 57 0.089 19.173 -15.133 299 HA ASN 57 HA ASN 57 -1.456 21.006 -16.821 300 1HB ASN 57 2HB ASN 57 -2.145 18.597 -17.316 301 2HB ASN 57 1HB ASN 57 -2.575 18.436 -15.626 302 1HD2 ASN 57 1HD2 ASN 57 -4.221 18.071 -17.942 303 2HD2 ASN 57 2HD2 ASN 57 -5.525 19.197 -17.825 304 H ILE 58 H ILE 58 -2.841 22.273 -15.477 305 HA ILE 58 HA ILE 58 -1.983 22.415 -12.733 306 HB ILE 58 HB ILE 58 -3.775 24.208 -14.372 307 1HG1 ILE 58 2HG1 ILE 58 -0.976 24.602 -13.280 308 2HG1 ILE 58 1HG1 ILE 58 -1.389 24.276 -14.955 309 1HG2 ILE 58 1HG2 ILE 58 -2.866 24.566 -11.525 310 2HG2 ILE 58 2HG2 ILE 58 -4.503 24.221 -12.064 311 3HG2 ILE 58 3HG2 ILE 58 -3.750 25.774 -12.474 312 1HD1 ILE 58 1HD1 ILE 58 -2.159 26.733 -13.387 313 2HD1 ILE 58 2HD1 ILE 58 -2.570 26.413 -15.072 314 3HD1 ILE 58 3HD1 ILE 58 -0.884 26.630 -14.603 315 H GLN 59 H GLN 59 -2.942 21.252 -11.299 316 HA GLN 59 HA GLN 59 -5.864 20.922 -11.424 317 1HB GLN 59 2HB GLN 59 -3.835 19.109 -10.128 318 2HB GLN 59 1HB GLN 59 -5.575 18.906 -10.039 319 1HG GLN 59 2HG GLN 59 -5.658 18.577 -12.442 320 2HG GLN 59 1HG GLN 59 -3.909 18.797 -12.527 321 1HE2 GLN 59 1HE2 GLN 59 -5.529 16.445 -13.226 322 2HE2 GLN 59 2HE2 GLN 59 -4.904 15.148 -12.272 323 H GLY 60 H GLY 60 -6.924 20.849 -9.346 324 1HA GLY 60 2HA GLY 60 -5.463 21.953 -7.107 325 2HA GLY 60 1HA GLY 60 -6.826 22.876 -7.739 326 H CYS 61 H CYS 61 -7.606 22.467 -5.540 327 HA CYS 61 HA CYS 61 -9.173 21.596 -4.199 328 1HB CYS 61 2HB CYS 61 -9.755 19.729 -6.510 329 2HB CYS 61 1HB CYS 61 -10.786 19.915 -5.096 330 HG CYS 61 HG CYS 61 -10.585 22.885 -5.944 331 H ASP 62 H ASP 62 -9.726 19.637 -2.914 332 HA ASP 62 HA ASP 62 -7.320 17.969 -2.659 333 1HB ASP 62 2HB ASP 62 -9.220 18.901 -0.489 334 2HB ASP 62 1HB ASP 62 -7.870 17.806 -0.241 335 H LEU 63 H LEU 63 -7.647 15.790 -1.908 336 HA LEU 63 HA LEU 63 -10.086 14.673 -2.980 337 1HB LEU 63 2HB LEU 63 -7.653 13.288 -1.797 338 2HB LEU 63 1HB LEU 63 -9.023 12.468 -2.497 339 HG LEU 63 HG LEU 63 -7.260 12.360 -4.061 340 1HD1 LEU 63 1HD1 LEU 63 -9.390 12.695 -5.059 341 2HD1 LEU 63 2HD1 LEU 63 -8.140 13.479 -6.024 342 3HD1 LEU 63 3HD1 LEU 63 -9.188 14.446 -4.989 343 1HD2 LEU 63 1HD2 LEU 63 -5.826 14.159 -3.254 344 2HD2 LEU 63 2HD2 LEU 63 -6.970 15.362 -3.857 345 3HD2 LEU 63 3HD2 LEU 63 -6.098 14.325 -4.988 346 H HIS 64 H HIS 64 -11.735 14.907 -1.678 347 HA HIS 64 HA HIS 64 -11.360 14.688 1.188 348 1HB HIS 64 2HB HIS 64 -12.736 16.541 0.279 349 2HB HIS 64 1HB HIS 64 -13.866 15.365 -0.377 350 HD1 HIS 64 1HD HIS 64 -15.770 14.725 1.129 351 HD2 HIS 64 2HD HIS 64 -12.630 16.467 3.222 352 HE1 HIS 64 1HE HIS 64 -16.589 14.999 3.471 353 HE2 HIS 64 2HE HIS 64 -14.722 16.171 4.692 354 H GLU 65 H GLU 65 -12.296 12.700 -1.407 355 HA GLU 65 HA GLU 65 -13.905 10.942 0.172 356 1HB GLU 65 2HB GLU 65 -12.593 10.450 -2.507 357 2HB GLU 65 1HB GLU 65 -13.689 9.332 -1.712 358 1HG GLU 65 2HG GLU 65 -15.448 11.070 -1.802 359 2HG GLU 65 1HG GLU 65 -14.338 12.089 -2.715 360 H GLY 66 H GLY 66 -12.802 10.457 1.927 361 1HA GLY 66 2HA GLY 66 -11.649 8.712 3.001 362 2HA GLY 66 1HA GLY 66 -10.656 8.520 1.560 363 H ASP 67 H ASP 67 -8.913 8.567 3.054 364 HA ASP 67 HA ASP 67 -7.120 9.477 4.026 365 1HB ASP 67 2HB ASP 67 -6.755 10.695 1.975 366 2HB ASP 67 1HB ASP 67 -7.905 11.934 2.444 367 H TRP 68 H TRP 68 -7.584 9.280 6.025 368 HA TRP 68 HA TRP 68 -8.890 11.490 7.439 369 1HB TRP 68 2HB TRP 68 -8.339 8.633 8.288 370 2HB TRP 68 1HB TRP 68 -9.121 9.844 9.292 371 HD1 TRP 68 HD TRP 68 -9.747 7.954 5.957 372 HE1 TRP 68 1HE TRP 68 -12.308 7.752 5.631 373 HE3 TRP 68 3HE TRP 68 -11.305 10.664 9.993 374 HZ2 TRP 68 2HZ TRP 68 -14.645 8.609 6.913 375 HZ3 TRP 68 3HZ TRP 68 -13.720 10.917 10.377 376 HH2 TRP 68 HH TRP 68 -15.350 9.921 8.871 377 H GLY 69 H GLY 69 -5.896 10.000 6.810 378 1HA GLY 69 2HA GLY 69 -3.802 10.794 7.309 379 2HA GLY 69 1HA GLY 69 -4.537 11.962 8.388 380 H THR 70 H THR 70 -5.883 9.350 9.540 381 HA THR 70 HA THR 70 -3.676 8.743 11.368 382 HB THR 70 HB THR 70 -5.575 8.370 13.020 383 HG1 THR 70 1HG THR 70 -7.507 8.513 12.217 384 1HG2 THR 70 1HG2 THR 70 -5.848 10.786 13.492 385 2HG2 THR 70 2HG2 THR 70 -5.220 11.161 11.887 386 3HG2 THR 70 3HG2 THR 70 -4.176 10.397 13.084 387 H VAL 71 H VAL 71 -4.361 6.607 12.647 388 HA VAL 71 HA VAL 71 -4.539 4.509 10.793 389 HB VAL 71 HB VAL 71 -3.427 4.271 13.008 390 1HG1 VAL 71 1HG1 VAL 71 -4.742 3.937 15.001 391 2HG1 VAL 71 2HG1 VAL 71 -6.190 4.328 14.043 392 3HG1 VAL 71 3HG1 VAL 71 -4.938 5.564 14.300 393 1HG2 VAL 71 1HG2 VAL 71 -4.336 2.056 13.660 394 2HG2 VAL 71 2HG2 VAL 71 -4.051 2.204 11.927 395 3HG2 VAL 71 3HG2 VAL 71 -5.687 2.331 12.559 396 H GLY 72 H GLY 72 -6.271 3.138 10.246 397 1HA GLY 72 2HA GLY 72 -8.503 2.472 10.255 398 2HA GLY 72 1HA GLY 72 -8.908 3.895 11.211 399 H SER 73 H SER 73 -6.913 5.121 9.059 400 HA SER 73 HA SER 73 -8.879 6.458 7.582 401 1HB SER 73 2HB SER 73 -6.604 7.373 8.034 402 2HB SER 73 1HB SER 73 -5.952 6.154 6.945 403 HG SER 73 HG SER 73 -6.195 7.688 5.554 404 H ILE 74 H ILE 74 -9.645 6.164 5.634 405 HA ILE 74 HA ILE 74 -8.812 3.821 4.129 406 HB ILE 74 HB ILE 74 -11.527 5.122 4.420 407 1HG1 ILE 74 2HG1 ILE 74 -10.529 2.339 4.938 408 2HG1 ILE 74 1HG1 ILE 74 -10.741 3.564 6.169 409 1HG2 ILE 74 1HG2 ILE 74 -12.356 3.471 2.804 410 2HG2 ILE 74 2HG2 ILE 74 -10.705 2.913 2.524 411 3HG2 ILE 74 3HG2 ILE 74 -11.172 4.547 2.058 412 1HD1 ILE 74 1HD1 ILE 74 -12.864 2.335 4.440 413 2HD1 ILE 74 2HD1 ILE 74 -13.152 3.585 5.664 414 3HD1 ILE 74 3HD1 ILE 74 -12.583 1.977 6.145 415 H VAL 75 H VAL 75 -7.944 4.311 2.239 416 HA VAL 75 HA VAL 75 -8.426 6.970 1.065 417 HB VAL 75 HB VAL 75 -5.756 5.504 1.071 418 1HG1 VAL 75 1HG1 VAL 75 -4.815 7.615 0.233 419 2HG1 VAL 75 2HG1 VAL 75 -6.435 8.303 0.181 420 3HG1 VAL 75 3HG1 VAL 75 -6.027 6.938 -0.859 421 1HG2 VAL 75 1HG2 VAL 75 -4.935 7.225 2.632 422 2HG2 VAL 75 2HG2 VAL 75 -6.234 6.261 3.335 423 3HG2 VAL 75 3HG2 VAL 75 -6.566 7.886 2.739 424 H PHE 76 H PHE 76 -8.216 6.950 -1.304 425 HA PHE 76 HA PHE 76 -8.280 4.248 -2.418 426 1HB PHE 76 2HB PHE 76 -10.022 6.565 -3.302 427 2HB PHE 76 1HB PHE 76 -9.982 4.947 -4.014 428 HD1 PHE 76 1HD PHE 76 -10.076 3.119 -2.030 429 HD2 PHE 76 2HD PHE 76 -11.921 6.924 -2.036 430 HE1 PHE 76 1HE PHE 76 -11.653 2.299 -0.430 431 HE2 PHE 76 2HE PHE 76 -13.588 6.131 -0.404 432 HZ PHE 76 HZ PHE 76 -13.477 3.810 0.416 433 H TRP 77 H TRP 77 -6.760 3.949 -3.854 434 HA TRP 77 HA TRP 77 -5.690 6.295 -5.228 435 1HB TRP 77 2HB TRP 77 -4.246 5.204 -3.435 436 2HB TRP 77 1HB TRP 77 -4.214 3.779 -4.465 437 HD1 TRP 77 HD TRP 77 -2.915 3.955 -6.678 438 HE1 TRP 77 1HE TRP 77 -0.946 5.548 -7.469 439 HE3 TRP 77 3HE TRP 77 -3.425 7.594 -3.204 440 HZ2 TRP 77 2HZ TRP 77 0.145 8.007 -6.658 441 HZ3 TRP 77 3HZ TRP 77 -1.910 9.540 -3.250 442 HH2 TRP 77 HH TRP 77 -0.164 9.737 -4.941 443 H ASN 78 H ASN 78 -5.252 6.053 -7.364 444 HA ASN 78 HA ASN 78 -6.543 3.750 -8.661 445 1HB ASN 78 2HB ASN 78 -6.109 6.571 -9.700 446 2HB ASN 78 1HB ASN 78 -6.855 5.261 -10.603 447 1HD2 ASN 78 1HD2 ASN 78 -8.989 4.684 -10.142 448 2HD2 ASN 78 2HD2 ASN 78 -9.991 5.644 -9.132 449 H TYR 79 H TYR 79 -5.307 2.553 -9.997 450 HA TYR 79 HA TYR 79 -2.757 3.626 -10.912 451 1HB TYR 79 2HB TYR 79 -1.560 1.573 -10.249 452 2HB TYR 79 1HB TYR 79 -2.229 2.378 -8.839 453 HD1 TYR 79 1HD TYR 79 -2.214 -0.634 -10.849 454 HD2 TYR 79 2HD TYR 79 -4.256 1.384 -7.706 455 HE1 TYR 79 1HE TYR 79 -3.296 -2.740 -10.206 456 HE2 TYR 79 2HE TYR 79 -5.338 -0.721 -7.057 457 HH TYR 79 HH TYR 79 -4.326 -3.735 -8.289 458 H VAL 80 H VAL 80 -1.925 2.346 -12.754 459 HA VAL 80 HA VAL 80 -4.210 1.150 -14.136 460 HB VAL 80 HB VAL 80 -1.692 2.341 -15.325 461 1HG1 VAL 80 1HG1 VAL 80 -2.860 2.132 -17.495 462 2HG1 VAL 80 2HG1 VAL 80 -4.200 1.326 -16.693 463 3HG1 VAL 80 3HG1 VAL 80 -2.624 0.557 -16.742 464 1HG2 VAL 80 1HG2 VAL 80 -3.167 4.155 -16.103 465 2HG2 VAL 80 2HG2 VAL 80 -3.116 4.041 -14.339 466 3HG2 VAL 80 3HG2 VAL 80 -4.505 3.409 -15.217 467 H HIS 81 H HIS 81 -4.209 -0.891 -14.314 468 HA HIS 81 HA HIS 81 -1.727 -2.341 -14.718 469 1HB HIS 81 2HB HIS 81 -2.196 -2.395 -12.262 470 2HB HIS 81 1HB HIS 81 -3.761 -3.112 -12.602 471 HD1 HIS 81 1HD HIS 81 -0.069 -3.900 -12.988 472 HD2 HIS 81 2HD HIS 81 -3.737 -5.813 -12.732 473 HE1 HIS 81 1HE HIS 81 0.458 -6.357 -12.869 474 HE2 HIS 81 2HE HIS 81 -1.781 -7.504 -12.795 475 H ASP 82 H ASP 82 -1.946 -3.865 -16.181 476 HA ASP 82 HA ASP 82 -2.757 -5.092 -17.910 477 1HB ASP 82 2HB ASP 82 -5.414 -5.049 -16.433 478 2HB ASP 82 1HB ASP 82 -5.019 -6.085 -17.788 479 H GLY 83 H GLY 83 -2.925 -2.176 -17.760 480 1HA GLY 83 2HA GLY 83 -3.524 -0.563 -19.292 481 2HA GLY 83 1HA GLY 83 -4.522 -1.733 -20.125 482 H GLU 84 H GLU 84 -5.656 -2.115 -17.157 483 HA GLU 84 HA GLU 84 -7.725 -0.091 -17.518 484 1HB GLU 84 2HB GLU 84 -7.612 -2.563 -15.816 485 2HB GLU 84 1HB GLU 84 -8.802 -1.326 -15.540 486 1HG GLU 84 2HG GLU 84 -9.793 -3.059 -16.792 487 2HG GLU 84 1HG GLU 84 -9.647 -1.657 -17.818 488 H ALA 85 H ALA 85 -8.198 1.380 -16.060 489 HA ALA 85 HA ALA 85 -6.221 1.887 -14.005 490 1HB ALA 85 1HB ALA 85 -8.743 3.384 -14.761 491 2HB ALA 85 2HB ALA 85 -7.106 3.807 -15.264 492 3HB ALA 85 3HB ALA 85 -7.568 3.925 -13.564 493 H LYS 86 H LYS 86 -6.436 0.931 -12.166 494 HA LYS 86 HA LYS 86 -9.060 -0.078 -11.443 495 1HB LYS 86 2HB LYS 86 -6.324 -1.249 -10.925 496 2HB LYS 86 1HB LYS 86 -7.815 -1.882 -10.232 497 1HG LYS 86 2HG LYS 86 -8.709 -2.313 -12.444 498 2HG LYS 86 1HG LYS 86 -7.278 -1.611 -13.181 499 1HD LYS 86 2HD LYS 86 -5.914 -3.382 -12.336 500 2HD LYS 86 1HD LYS 86 -7.286 -4.080 -11.432 501 1HE LYS 86 2HE LYS 86 -8.441 -4.373 -13.600 502 2HE LYS 86 1HE LYS 86 -6.999 -3.733 -14.386 503 1HZ LYS 86 1HZ LYS 86 -7.023 -6.198 -12.734 504 2HZ LYS 86 2HZ LYS 86 -5.744 -5.693 -13.717 505 3HZ LYS 86 3HZ LYS 86 -7.177 -6.196 -14.405 506 H VAL 87 H VAL 87 -9.430 -0.229 -9.099 507 HA VAL 87 HA VAL 87 -8.166 2.046 -7.735 508 HB VAL 87 HB VAL 87 -10.963 0.944 -7.322 509 1HG1 VAL 87 1HG1 VAL 87 -9.684 3.454 -6.248 510 2HG1 VAL 87 2HG1 VAL 87 -10.082 2.008 -5.323 511 3HG1 VAL 87 3HG1 VAL 87 -11.371 2.985 -6.029 512 1HG2 VAL 87 1HG2 VAL 87 -10.110 3.429 -8.799 513 2HG2 VAL 87 2HG2 VAL 87 -11.777 2.982 -8.430 514 3HG2 VAL 87 3HG2 VAL 87 -10.811 1.975 -9.512 515 H ALA 88 H ALA 88 -7.483 1.721 -5.700 516 HA ALA 88 HA ALA 88 -7.705 -0.984 -4.614 517 1HB ALA 88 1HB ALA 88 -5.402 -0.243 -5.020 518 2HB ALA 88 2HB ALA 88 -5.713 -0.367 -3.287 519 3HB ALA 88 3HB ALA 88 -5.707 1.213 -4.071 520 H LYS 89 H LYS 89 -9.281 -1.094 -3.052 521 HA LYS 89 HA LYS 89 -9.713 1.281 -1.501 522 1HB LYS 89 2HB LYS 89 -11.385 -1.209 -1.916 523 2HB LYS 89 1HB LYS 89 -11.851 0.113 -0.868 524 1HG LYS 89 2HG LYS 89 -11.756 1.609 -2.885 525 2HG LYS 89 1HG LYS 89 -11.543 0.152 -3.853 526 1HD LYS 89 2HD LYS 89 -13.671 -0.706 -3.060 527 2HD LYS 89 1HD LYS 89 -13.885 0.717 -2.028 528 1HE LYS 89 2HE LYS 89 -13.799 2.115 -4.073 529 2HE LYS 89 1HE LYS 89 -13.741 0.640 -5.034 530 1HZ LYS 89 1HZ LYS 89 -15.960 1.526 -3.273 531 2HZ LYS 89 2HZ LYS 89 -15.904 0.015 -4.030 532 3HZ LYS 89 3HZ LYS 89 -15.970 1.412 -4.948 533 H GLU 90 H GLU 90 -8.923 1.340 0.457 534 HA GLU 90 HA GLU 90 -7.936 -1.115 1.694 535 1HB GLU 90 2HB GLU 90 -5.807 0.095 2.052 536 2HB GLU 90 1HB GLU 90 -6.144 -0.261 0.354 537 1HG GLU 90 2HG GLU 90 -7.034 2.019 0.079 538 2HG GLU 90 1HG GLU 90 -6.624 2.367 1.730 539 H ARG 91 H ARG 91 -7.356 -0.757 3.890 540 HA ARG 91 HA ARG 91 -8.273 1.722 5.148 541 1HB ARG 91 2HB ARG 91 -10.030 0.017 5.444 542 2HB ARG 91 1HB ARG 91 -8.840 -1.097 6.100 543 1HG ARG 91 2HG ARG 91 -8.440 0.513 7.950 544 2HG ARG 91 1HG ARG 91 -9.767 1.491 7.320 545 1HD ARG 91 2HD ARG 91 -11.300 -0.375 7.637 546 2HD ARG 91 1HD ARG 91 -9.979 -1.379 8.234 547 HE ARG 91 HE ARG 91 -11.136 0.958 9.570 548 1HH1 ARG 91 1HH1 ARG 91 -9.090 -1.945 9.720 549 2HH1 ARG 91 2HH1 ARG 91 -8.925 -1.946 11.388 550 1HH2 ARG 91 1HH2 ARG 91 -10.961 0.965 11.875 551 2HH2 ARG 91 2HH2 ARG 91 -10.070 -0.230 12.685 552 H ILE 92 H ILE 92 -6.812 2.435 6.619 553 HA ILE 92 HA ILE 92 -4.355 1.008 7.060 554 HB ILE 92 HB ILE 92 -5.500 3.480 8.382 555 1HG1 ILE 92 2HG1 ILE 92 -3.314 3.115 6.319 556 2HG1 ILE 92 1HG1 ILE 92 -4.880 3.865 6.088 557 1HG2 ILE 92 1HG2 ILE 92 -3.250 3.887 9.372 558 2HG2 ILE 92 2HG2 ILE 92 -2.814 2.217 8.974 559 3HG2 ILE 92 3HG2 ILE 92 -4.161 2.569 10.063 560 1HD1 ILE 92 1HD1 ILE 92 -2.611 4.932 7.757 561 2HD1 ILE 92 2HD1 ILE 92 -4.201 5.681 7.636 562 3HD1 ILE 92 3HD1 ILE 92 -3.177 5.561 6.211 563 H GLU 93 H GLU 93 -4.016 -0.548 8.468 564 HA GLU 93 HA GLU 93 -6.065 -1.062 10.517 565 1HB GLU 93 2HB GLU 93 -5.304 -2.829 8.862 566 2HB GLU 93 1HB GLU 93 -3.759 -2.827 9.692 567 1HG GLU 93 2HG GLU 93 -5.074 -4.666 10.466 568 2HG GLU 93 1HG GLU 93 -4.925 -3.487 11.771 569 H ALA 94 H ALA 94 -2.593 -0.533 10.099 570 HA ALA 94 HA ALA 94 -2.301 0.474 12.775 571 1HB ALA 94 1HB ALA 94 -0.443 -1.051 13.344 572 2HB ALA 94 2HB ALA 94 -0.727 -1.954 11.863 573 3HB ALA 94 3HB ALA 94 -1.948 -1.951 13.138 574 H VAL 95 H VAL 95 -0.499 1.900 12.854 575 HA VAL 95 HA VAL 95 1.284 1.873 10.594 576 HB VAL 95 HB VAL 95 -0.539 3.303 9.794 577 1HG1 VAL 95 1HG1 VAL 95 -0.020 5.018 12.209 578 2HG1 VAL 95 2HG1 VAL 95 -1.464 4.057 11.886 579 3HG1 VAL 95 3HG1 VAL 95 -1.076 5.442 10.862 580 1HG2 VAL 95 1HG2 VAL 95 1.710 3.858 9.062 581 2HG2 VAL 95 2HG2 VAL 95 1.941 4.882 10.480 582 3HG2 VAL 95 3HG2 VAL 95 0.758 5.330 9.251 583 H GLU 96 H GLU 96 3.283 2.500 11.082 584 HA GLU 96 HA GLU 96 3.692 3.985 13.568 585 1HB GLU 96 2HB GLU 96 4.287 1.485 13.814 586 2HB GLU 96 1HB GLU 96 5.474 1.817 12.551 587 1HG GLU 96 2HG GLU 96 6.443 1.745 14.724 588 2HG GLU 96 1HG GLU 96 6.688 3.257 13.884 589 HA PRO 97 HA PRO 97 5.722 6.283 10.226 590 1HB PRO 97 2HB PRO 97 6.122 8.557 11.710 591 2HB PRO 97 1HB PRO 97 4.638 8.190 10.826 592 1HG PRO 97 2HG PRO 97 5.230 7.912 13.728 593 2HG PRO 97 1HG PRO 97 3.727 8.411 12.936 594 1HD PRO 97 2HD PRO 97 4.142 5.927 13.970 595 2HD PRO 97 1HD PRO 97 3.042 6.240 12.612 596 H ASP 98 H ASP 98 6.776 5.705 13.482 597 HA ASP 98 HA ASP 98 9.426 6.775 13.072 598 1HB ASP 98 2HB ASP 98 8.509 6.845 15.310 599 2HB ASP 98 1HB ASP 98 8.313 5.097 15.321 600 H LYS 99 H LYS 99 7.956 3.662 12.924 601 HA LYS 99 HA LYS 99 10.552 2.418 12.418 602 1HB LYS 99 2HB LYS 99 7.845 1.140 12.880 603 2HB LYS 99 1HB LYS 99 9.371 0.301 12.622 604 1HG LYS 99 2HG LYS 99 8.850 2.149 14.911 605 2HG LYS 99 1HG LYS 99 8.659 0.396 14.969 606 1HD LYS 99 2HD LYS 99 11.000 0.144 14.295 607 2HD LYS 99 1HD LYS 99 11.197 1.893 14.324 608 1HE LYS 99 2HE LYS 99 10.643 1.934 16.717 609 2HE LYS 99 1HE LYS 99 10.443 0.185 16.703 610 1HZ LYS 99 1HZ LYS 99 12.600 0.827 17.558 611 2HZ LYS 99 2HZ LYS 99 12.972 1.624 16.112 612 3HZ LYS 99 3HZ LYS 99 12.775 -0.043 16.127 613 H ASN 100 H ASN 100 8.316 3.989 10.679 614 HA ASN 100 HA ASN 100 7.721 4.102 8.463 615 1HB ASN 100 2HB ASN 100 10.055 2.202 8.058 616 2HB ASN 100 1HB ASN 100 9.294 3.182 6.816 617 1HD2 ASN 100 1HD2 ASN 100 12.006 3.043 7.743 618 2HD2 ASN 100 2HD2 ASN 100 12.468 4.649 8.196 619 H LEU 101 H LEU 101 6.197 2.451 9.877 620 HA LEU 101 HA LEU 101 5.933 -0.080 8.366 621 1HB LEU 101 2HB LEU 101 6.609 -0.402 10.699 622 2HB LEU 101 1HB LEU 101 5.259 0.589 11.208 623 HG LEU 101 HG LEU 101 3.730 -1.109 10.225 624 1HD1 LEU 101 1HD1 LEU 101 6.233 -2.737 10.031 625 2HD1 LEU 101 2HD1 LEU 101 5.189 -2.184 8.709 626 3HD1 LEU 101 3HD1 LEU 101 4.583 -3.347 9.882 627 1HD2 LEU 101 1HD2 LEU 101 3.923 -2.647 12.095 628 2HD2 LEU 101 2HD2 LEU 101 4.104 -0.972 12.602 629 3HD2 LEU 101 3HD2 LEU 101 5.530 -2.011 12.473 630 H ILE 102 H ILE 102 3.975 -0.427 7.460 631 HA ILE 102 HA ILE 102 1.655 0.882 8.540 632 HB ILE 102 HB ILE 102 2.294 2.523 6.954 633 1HG1 ILE 102 2HG1 ILE 102 0.425 2.478 5.280 634 2HG1 ILE 102 1HG1 ILE 102 0.102 0.818 5.759 635 1HG2 ILE 102 1HG2 ILE 102 2.675 2.014 4.540 636 2HG2 ILE 102 2HG2 ILE 102 2.605 0.305 4.984 637 3HG2 ILE 102 3HG2 ILE 102 3.871 1.315 5.641 638 1HD1 ILE 102 1HD1 ILE 102 -0.097 3.243 7.520 639 2HD1 ILE 102 2HD1 ILE 102 -0.416 1.579 8.021 640 3HD1 ILE 102 3HD1 ILE 102 -1.438 2.347 6.808 641 H THR 103 H THR 103 0.141 -0.488 8.717 642 HA THR 103 HA THR 103 0.144 -2.989 7.196 643 HB THR 103 HB THR 103 -1.502 -2.192 9.614 644 HG1 THR 103 1HG THR 103 1.076 -2.607 9.447 645 1HG2 THR 103 1HG2 THR 103 -1.794 -4.613 9.880 646 2HG2 THR 103 2HG2 THR 103 -0.821 -4.890 8.437 647 3HG2 THR 103 3HG2 THR 103 -2.382 -4.082 8.303 648 H PHE 104 H PHE 104 -1.216 -3.124 5.465 649 HA PHE 104 HA PHE 104 -3.515 -1.309 5.250 650 1HB PHE 104 2HB PHE 104 -2.089 -2.983 3.183 651 2HB PHE 104 1HB PHE 104 -3.440 -1.969 2.785 652 HD1 PHE 104 1HD PHE 104 -3.106 0.575 3.220 653 HD2 PHE 104 2HD PHE 104 0.050 -2.267 3.050 654 HE1 PHE 104 1HE PHE 104 -1.505 2.381 2.720 655 HE2 PHE 104 2HE PHE 104 1.642 -0.477 2.546 656 HZ PHE 104 HZ PHE 104 0.886 1.834 2.378 657 H ARG 105 H ARG 105 -5.510 -2.129 5.017 658 HA ARG 105 HA ARG 105 -5.904 -5.054 5.085 659 1HB ARG 105 2HB ARG 105 -6.224 -3.903 7.274 660 2HB ARG 105 1HB ARG 105 -7.390 -2.840 6.544 661 1HG ARG 105 2HG ARG 105 -7.769 -5.823 6.839 662 2HG ARG 105 1HG ARG 105 -8.271 -4.654 8.043 663 1HD ARG 105 2HD ARG 105 -9.676 -3.604 6.166 664 2HD ARG 105 1HD ARG 105 -9.348 -5.085 5.261 665 HE ARG 105 HE ARG 105 -10.312 -5.509 7.928 666 1HH1 ARG 105 1HH1 ARG 105 -11.309 -5.275 4.532 667 2HH1 ARG 105 2HH1 ARG 105 -12.876 -5.868 4.837 668 1HH2 ARG 105 1HH2 ARG 105 -12.446 -6.303 8.303 669 2HH2 ARG 105 2HH2 ARG 105 -13.547 -6.459 7.008 670 H VAL 106 H VAL 106 -7.020 -5.665 3.255 671 HA VAL 106 HA VAL 106 -8.050 -3.634 1.514 672 HB VAL 106 HB VAL 106 -7.029 -5.868 0.677 673 1HG1 VAL 106 1HG1 VAL 106 -8.442 -7.781 0.516 674 2HG1 VAL 106 2HG1 VAL 106 -9.655 -6.961 1.498 675 3HG1 VAL 106 3HG1 VAL 106 -8.091 -7.333 2.202 676 1HG2 VAL 106 1HG2 VAL 106 -8.257 -4.388 -0.849 677 2HG2 VAL 106 2HG2 VAL 106 -9.774 -5.138 -0.358 678 3HG2 VAL 106 3HG2 VAL 106 -8.563 -6.087 -1.222 679 H ILE 107 H ILE 107 -10.131 -3.092 1.102 680 HA ILE 107 HA ILE 107 -12.078 -4.208 2.996 681 HB ILE 107 HB ILE 107 -13.366 -2.091 2.712 682 1HG1 ILE 107 2HG1 ILE 107 -10.870 -1.246 1.251 683 2HG1 ILE 107 1HG1 ILE 107 -12.462 -1.477 0.543 684 1HG2 ILE 107 1HG2 ILE 107 -11.864 -0.746 4.117 685 2HG2 ILE 107 2HG2 ILE 107 -10.523 -1.798 3.687 686 3HG2 ILE 107 3HG2 ILE 107 -11.868 -2.436 4.635 687 1HD1 ILE 107 1HD1 ILE 107 -13.314 0.343 1.796 688 2HD1 ILE 107 2HD1 ILE 107 -11.835 0.800 0.884 689 3HD1 ILE 107 3HD1 ILE 107 -11.754 0.504 2.634 690 H GLU 108 H GLU 108 -11.733 -3.195 -0.394 691 HA GLU 108 HA GLU 108 -13.811 -5.066 -1.121 692 1HB GLU 108 2HB GLU 108 -15.049 -3.016 -0.602 693 2HB GLU 108 1HB GLU 108 -14.020 -2.110 -1.690 694 1HG GLU 108 2HG GLU 108 -14.909 -3.305 -3.595 695 2HG GLU 108 1HG GLU 108 -15.852 -4.347 -2.531 696 H GLY 109 H GLY 109 -13.675 -5.716 -3.282 697 1HA GLY 109 2HA GLY 109 -12.773 -4.813 -5.494 698 2HA GLY 109 1HA GLY 109 -11.233 -4.893 -4.649 699 H ASP 110 H ASP 110 -10.732 -6.352 -6.427 700 HA ASP 110 HA ASP 110 -11.955 -8.842 -6.922 701 1HB ASP 110 2HB ASP 110 -9.058 -8.069 -7.287 702 2HB ASP 110 1HB ASP 110 -9.772 -9.545 -7.904 703 H LEU 111 H LEU 111 -9.473 -7.893 -4.651 704 HA LEU 111 HA LEU 111 -8.533 -10.471 -4.045 705 1HB LEU 111 2HB LEU 111 -8.440 -7.998 -2.335 706 2HB LEU 111 1HB LEU 111 -7.464 -9.435 -2.106 707 HG LEU 111 HG LEU 111 -7.325 -7.550 -4.457 708 1HD1 LEU 111 1HD1 LEU 111 -5.106 -7.024 -3.634 709 2HD1 LEU 111 2HD1 LEU 111 -5.372 -8.066 -2.237 710 3HD1 LEU 111 3HD1 LEU 111 -6.356 -6.619 -2.455 711 1HD2 LEU 111 1HD2 LEU 111 -6.896 -9.825 -5.183 712 2HD2 LEU 111 2HD2 LEU 111 -5.733 -10.036 -3.877 713 3HD2 LEU 111 3HD2 LEU 111 -5.399 -8.891 -5.175 714 H MET 112 H MET 112 -11.144 -8.611 -2.710 715 HA MET 112 HA MET 112 -11.522 -10.288 -0.420 716 1HB MET 112 2HB MET 112 -13.325 -8.271 -1.726 717 2HB MET 112 1HB MET 112 -13.729 -9.132 -0.255 718 1HG MET 112 2HG MET 112 -11.212 -7.515 -0.362 719 2HG MET 112 1HG MET 112 -12.745 -6.686 -0.181 720 1HE MET 112 1HE MET 112 -11.595 -10.219 1.491 721 2HE MET 112 2HE MET 112 -11.004 -9.626 3.025 722 3HE MET 112 3HE MET 112 -10.158 -9.207 1.538 723 H LYS 113 H LYS 113 -12.113 -10.831 -3.653 724 HA LYS 113 HA LYS 113 -14.610 -12.236 -3.285 725 1HB LYS 113 2HB LYS 113 -12.913 -11.974 -5.765 726 2HB LYS 113 1HB LYS 113 -14.529 -12.662 -5.703 727 1HG LYS 113 2HG LYS 113 -13.751 -9.794 -5.166 728 2HG LYS 113 1HG LYS 113 -14.654 -10.402 -6.548 729 1HD LYS 113 2HD LYS 113 -15.574 -10.392 -3.664 730 2HD LYS 113 1HD LYS 113 -16.144 -9.329 -4.939 731 1HE LYS 113 2HE LYS 113 -17.057 -11.264 -6.152 732 2HE LYS 113 1HE LYS 113 -16.446 -12.328 -4.892 733 1HZ LYS 113 1HZ LYS 113 -17.910 -11.262 -3.307 734 2HZ LYS 113 2HZ LYS 113 -18.790 -11.850 -4.600 735 3HZ LYS 113 3HZ LYS 113 -18.477 -10.203 -4.485 736 H GLU 114 H GLU 114 -11.439 -12.965 -2.907 737 HA GLU 114 HA GLU 114 -12.131 -15.818 -2.834 738 1HB GLU 114 2HB GLU 114 -10.697 -15.639 -4.746 739 2HB GLU 114 1HB GLU 114 -9.494 -14.751 -3.819 740 1HG GLU 114 2HG GLU 114 -8.797 -17.067 -4.098 741 2HG GLU 114 1HG GLU 114 -9.094 -16.711 -2.397 742 H TYR 115 H TYR 115 -10.246 -13.143 -1.580 743 HA TYR 115 HA TYR 115 -9.532 -14.904 0.579 744 1HB TYR 115 2HB TYR 115 -8.512 -12.094 0.075 745 2HB TYR 115 1HB TYR 115 -7.814 -13.313 1.132 746 HD1 TYR 115 1HD TYR 115 -7.640 -11.788 -2.043 747 HD2 TYR 115 2HD TYR 115 -6.861 -15.543 -0.131 748 HE1 TYR 115 1HE TYR 115 -6.149 -12.446 -3.864 749 HE2 TYR 115 2HE TYR 115 -5.439 -16.166 -1.887 750 HH TYR 115 HH TYR 115 -4.275 -13.962 -4.210 751 H LYS 116 H LYS 116 -10.765 -14.745 2.242 752 HA LYS 116 HA LYS 116 -12.808 -12.721 2.375 753 1HB LYS 116 2HB LYS 116 -13.480 -13.911 4.483 754 2HB LYS 116 1HB LYS 116 -13.454 -14.920 3.044 755 1HG LYS 116 2HG LYS 116 -11.195 -15.717 3.742 756 2HG LYS 116 1HG LYS 116 -11.414 -14.826 5.247 757 1HD LYS 116 2HD LYS 116 -13.236 -16.990 4.231 758 2HD LYS 116 1HD LYS 116 -11.962 -17.236 5.426 759 1HE LYS 116 2HE LYS 116 -13.102 -15.623 6.915 760 2HE LYS 116 1HE LYS 116 -14.370 -15.440 5.702 761 1HZ LYS 116 1HZ LYS 116 -15.009 -16.980 7.441 762 2HZ LYS 116 2HZ LYS 116 -13.690 -17.974 7.102 763 3HZ LYS 116 3HZ LYS 116 -14.909 -17.781 5.962 764 H SER 117 H SER 117 -9.676 -12.882 3.286 765 HA SER 117 HA SER 117 -9.806 -10.341 4.486 766 1HB SER 117 2HB SER 117 -10.270 -11.690 6.381 767 2HB SER 117 1HB SER 117 -8.838 -12.706 6.115 768 HG SER 117 HG SER 117 -9.025 -9.983 6.841 769 H PHE 118 H PHE 118 -7.997 -9.278 3.950 770 HA PHE 118 HA PHE 118 -5.594 -10.735 3.223 771 1HB PHE 118 2HB PHE 118 -6.762 -10.407 1.042 772 2HB PHE 118 1HB PHE 118 -6.979 -8.727 1.430 773 HD1 PHE 118 1HD PHE 118 -4.331 -11.244 0.740 774 HD2 PHE 118 2HD PHE 118 -5.440 -7.142 0.769 775 HE1 PHE 118 1HE PHE 118 -2.259 -10.680 -0.411 776 HE2 PHE 118 2HE PHE 118 -3.357 -6.576 -0.403 777 HZ PHE 118 HZ PHE 118 -1.769 -8.328 -0.989 778 H LEU 119 H LEU 119 -4.217 -9.943 4.610 779 HA LEU 119 HA LEU 119 -4.295 -7.075 5.196 780 1HB LEU 119 2HB LEU 119 -4.865 -8.683 7.047 781 2HB LEU 119 1HB LEU 119 -3.264 -9.363 6.872 782 HG LEU 119 HG LEU 119 -2.333 -7.122 7.483 783 1HD1 LEU 119 1HD1 LEU 119 -3.847 -5.540 8.593 784 2HD1 LEU 119 2HD1 LEU 119 -5.221 -6.525 8.106 785 3HD1 LEU 119 3HD1 LEU 119 -4.219 -5.739 6.882 786 1HD2 LEU 119 1HD2 LEU 119 -2.816 -7.357 9.871 787 2HD2 LEU 119 2HD2 LEU 119 -2.512 -8.922 9.116 788 3HD2 LEU 119 3HD2 LEU 119 -4.164 -8.429 9.494 789 H LEU 120 H LEU 120 -2.449 -6.032 4.607 790 HA LEU 120 HA LEU 120 -0.049 -7.643 4.279 791 1HB LEU 120 2HB LEU 120 0.618 -6.529 2.224 792 2HB LEU 120 1HB LEU 120 -0.905 -7.348 2.006 793 HG LEU 120 HG LEU 120 -0.602 -4.355 2.380 794 1HD1 LEU 120 1HD1 LEU 120 -1.030 -4.203 -0.011 795 2HD1 LEU 120 2HD1 LEU 120 -1.023 -5.963 -0.138 796 3HD1 LEU 120 3HD1 LEU 120 0.447 -5.106 0.321 797 1HD2 LEU 120 1HD2 LEU 120 -2.811 -5.167 3.032 798 2HD2 LEU 120 2HD2 LEU 120 -2.950 -6.049 1.521 799 3HD2 LEU 120 3HD2 LEU 120 -2.915 -4.283 1.507 800 H THR 121 H THR 121 1.719 -6.791 5.034 801 HA THR 121 HA THR 121 1.489 -4.054 6.057 802 HB THR 121 HB THR 121 3.036 -6.343 7.274 803 HG1 THR 121 1HG THR 121 0.444 -5.952 7.204 804 1HG2 THR 121 1HG2 THR 121 3.830 -4.091 7.806 805 2HG2 THR 121 2HG2 THR 121 3.093 -4.849 9.222 806 3HG2 THR 121 3HG2 THR 121 2.208 -3.627 8.296 807 H ILE 122 H ILE 122 3.092 -2.715 5.396 808 HA ILE 122 HA ILE 122 5.486 -3.990 4.313 809 HB ILE 122 HB ILE 122 5.785 -2.162 2.742 810 1HG1 ILE 122 2HG1 ILE 122 3.157 -1.093 3.701 811 2HG1 ILE 122 1HG1 ILE 122 4.722 -0.394 4.105 812 1HG2 ILE 122 1HG2 ILE 122 4.424 -4.041 1.982 813 2HG2 ILE 122 2HG2 ILE 122 3.859 -2.529 1.269 814 3HG2 ILE 122 3HG2 ILE 122 2.980 -3.240 2.614 815 1HD1 ILE 122 1HD1 ILE 122 3.538 -0.603 1.335 816 2HD1 ILE 122 2HD1 ILE 122 5.116 0.080 1.723 817 3HD1 ILE 122 3HD1 ILE 122 3.649 0.862 2.308 818 H GLN 123 H GLN 123 7.403 -3.059 4.817 819 HA GLN 123 HA GLN 123 7.359 -0.693 6.483 820 1HB GLN 123 2HB GLN 123 7.238 -2.684 8.004 821 2HB GLN 123 1HB GLN 123 8.771 -3.223 7.342 822 1HG GLN 123 2HG GLN 123 9.904 -1.317 8.232 823 2HG GLN 123 1HG GLN 123 8.380 -0.584 8.725 824 1HE2 GLN 123 1HE2 GLN 123 8.934 -0.448 10.843 825 2HE2 GLN 123 2HE2 GLN 123 9.062 -1.793 11.900 826 H VAL 124 H VAL 124 8.935 0.610 5.950 827 HA VAL 124 HA VAL 124 10.873 -0.381 4.006 828 HB VAL 124 HB VAL 124 10.251 2.497 4.761 829 1HG1 VAL 124 1HG1 VAL 124 11.465 3.066 2.709 830 2HG1 VAL 124 2HG1 VAL 124 11.816 1.359 2.444 831 3HG1 VAL 124 3HG1 VAL 124 12.505 2.193 3.837 832 1HG2 VAL 124 1HG2 VAL 124 8.330 1.417 3.726 833 2HG2 VAL 124 2HG2 VAL 124 9.343 0.881 2.383 834 3HG2 VAL 124 3HG2 VAL 124 9.043 2.604 2.632 835 H THR 125 H THR 125 12.717 -0.967 4.725 836 HA THR 125 HA THR 125 13.658 0.077 7.293 837 HB THR 125 HB THR 125 14.177 -2.602 5.984 838 HG1 THR 125 1HG THR 125 12.575 -2.346 8.279 839 1HG2 THR 125 1HG2 THR 125 14.912 -3.266 8.200 840 2HG2 THR 125 2HG2 THR 125 14.627 -1.633 8.806 841 3HG2 THR 125 3HG2 THR 125 15.891 -1.925 7.599 842 HA PRO 126 HA PRO 126 17.216 1.394 4.848 843 1HB PRO 126 2HB PRO 126 18.777 2.221 6.943 844 2HB PRO 126 1HB PRO 126 17.487 3.214 6.263 845 1HG PRO 126 2HG PRO 126 17.500 1.578 8.752 846 2HG PRO 126 1HG PRO 126 16.698 3.121 8.428 847 1HD PRO 126 2HD PRO 126 15.438 0.671 8.439 848 2HD PRO 126 1HD PRO 126 14.839 2.098 7.572 849 H LYS 127 H LYS 127 17.612 -0.700 4.266 850 HA LYS 127 HA LYS 127 19.085 -2.410 6.042 851 1HB LYS 127 2HB LYS 127 17.196 -3.384 4.889 852 2HB LYS 127 1HB LYS 127 17.839 -2.958 3.344 853 1HG LYS 127 2HG LYS 127 19.661 -4.542 3.600 854 2HG LYS 127 1HG LYS 127 19.095 -4.945 5.224 855 1HD LYS 127 2HD LYS 127 16.993 -5.785 4.300 856 2HD LYS 127 1HD LYS 127 17.466 -5.378 2.681 857 1HE LYS 127 2HE LYS 127 19.364 -6.924 2.808 858 2HE LYS 127 1HE LYS 127 18.943 -7.323 4.472 859 1HZ LYS 127 1HZ LYS 127 16.849 -8.229 3.639 860 2HZ LYS 127 2HZ LYS 127 18.181 -8.998 2.961 861 3HZ LYS 127 3HZ LYS 127 17.316 -7.890 2.051 862 HA PRO 128 HA PRO 128 22.512 -2.051 2.768 863 1HB PRO 128 2HB PRO 128 21.854 -0.038 0.774 864 2HB PRO 128 1HB PRO 128 22.192 -1.751 0.521 865 1HG PRO 128 2HG PRO 128 19.732 -0.654 0.125 866 2HG PRO 128 1HG PRO 128 19.969 -2.339 0.623 867 1HD PRO 128 2HD PRO 128 19.282 0.053 2.289 868 2HD PRO 128 1HD PRO 128 18.583 -1.569 2.339 869 H GLY 129 H GLY 129 20.676 0.779 3.545 870 1HA GLY 129 2HA GLY 129 22.368 2.054 5.161 871 2HA GLY 129 1HA GLY 129 22.872 2.591 3.559 872 H GLY 130 H GLY 130 22.175 4.684 3.903 873 1HA GLY 130 2HA GLY 130 19.471 5.264 4.650 874 2HA GLY 130 1HA GLY 130 20.674 6.412 4.072 875 HA PRO 131 HA PRO 131 18.719 6.654 0.102 876 1HB PRO 131 2HB PRO 131 20.887 6.386 -1.593 877 2HB PRO 131 1HB PRO 131 20.424 7.897 -0.799 878 1HG PRO 131 2HG PRO 131 22.507 5.902 -0.026 879 2HG PRO 131 1HG PRO 131 22.581 7.674 0.032 880 1HD PRO 131 2HD PRO 131 22.172 6.219 2.237 881 2HD PRO 131 1HD PRO 131 21.355 7.777 1.994 882 H GLY 132 H GLY 132 17.615 5.166 -1.004 883 1HA GLY 132 2HA GLY 132 17.101 3.205 -2.048 884 2HA GLY 132 1HA GLY 132 18.804 2.763 -1.990 885 H SER 133 H SER 133 15.802 2.793 -0.209 886 HA SER 133 HA SER 133 16.965 1.016 1.811 887 1HB SER 133 2HB SER 133 14.347 2.509 1.750 888 2HB SER 133 1HB SER 133 14.946 1.520 3.088 889 HG SER 133 HG SER 133 16.799 3.337 2.265 890 H ILE 134 H ILE 134 15.239 -0.634 2.638 891 HA ILE 134 HA ILE 134 14.420 -2.163 0.279 892 HB ILE 134 HB ILE 134 15.385 -3.051 2.979 893 1HG1 ILE 134 2HG1 ILE 134 17.014 -2.183 1.408 894 2HG1 ILE 134 1HG1 ILE 134 17.235 -3.916 1.715 895 1HG2 ILE 134 1HG2 ILE 134 15.179 -5.349 2.107 896 2HG2 ILE 134 2HG2 ILE 134 14.437 -4.724 0.633 897 3HG2 ILE 134 3HG2 ILE 134 13.602 -4.563 2.180 898 1HD1 ILE 134 1HD1 ILE 134 16.066 -2.612 -0.715 899 2HD1 ILE 134 2HD1 ILE 134 16.143 -4.348 -0.380 900 3HD1 ILE 134 3HD1 ILE 134 17.632 -3.412 -0.554 901 H VAL 135 H VAL 135 12.352 -2.664 0.270 902 HA VAL 135 HA VAL 135 10.808 -2.108 2.693 903 HB VAL 135 HB VAL 135 10.021 -0.656 0.865 904 1HG1 VAL 135 1HG1 VAL 135 9.322 -3.158 -0.608 905 2HG1 VAL 135 2HG1 VAL 135 10.575 -1.994 -1.048 906 3HG1 VAL 135 3HG1 VAL 135 8.873 -1.522 -1.088 907 1HG2 VAL 135 1HG2 VAL 135 7.990 -2.762 1.588 908 2HG2 VAL 135 2HG2 VAL 135 7.617 -1.167 0.943 909 3HG2 VAL 135 3HG2 VAL 135 8.383 -1.321 2.526 910 H HIS 136 H HIS 136 9.942 -3.583 3.754 911 HA HIS 136 HA HIS 136 10.023 -6.311 2.719 912 1HB HIS 136 2HB HIS 136 9.583 -5.247 5.528 913 2HB HIS 136 1HB HIS 136 9.605 -6.957 5.113 914 HD1 HIS 136 1HD HIS 136 11.945 -7.989 4.643 915 HD2 HIS 136 2HD HIS 136 12.042 -3.987 5.751 916 HE1 HIS 136 1HE HIS 136 14.323 -7.511 5.193 917 HE2 HIS 136 2HE HIS 136 14.204 -5.291 6.302 918 H TRP 137 H TRP 137 8.182 -6.961 1.707 919 HA TRP 137 HA TRP 137 5.614 -5.943 2.669 920 1HB TRP 137 2HB TRP 137 6.258 -7.639 0.230 921 2HB TRP 137 1HB TRP 137 4.694 -7.063 0.710 922 HD1 TRP 137 HD TRP 137 8.090 -5.358 -0.214 923 HE1 TRP 137 1HE TRP 137 7.510 -3.289 -1.591 924 HE3 TRP 137 3HE TRP 137 2.996 -5.689 -0.070 925 HZ2 TRP 137 2HZ TRP 137 5.233 -1.949 -2.487 926 HZ3 TRP 137 3HZ TRP 137 1.680 -3.976 -1.210 927 HH2 TRP 137 HH TRP 137 2.761 -2.135 -2.393 928 H HIS 138 H HIS 138 4.573 -7.179 4.083 929 HA HIS 138 HA HIS 138 4.958 -10.063 3.893 930 1HB HIS 138 2HB HIS 138 6.060 -9.132 5.895 931 2HB HIS 138 1HB HIS 138 4.563 -8.342 6.352 932 HD1 HIS 138 1HD HIS 138 6.313 -11.644 6.376 933 HD2 HIS 138 2HD HIS 138 2.704 -9.948 7.472 934 HE1 HIS 138 1HE HIS 138 5.210 -13.364 7.827 935 HE2 HIS 138 2HE HIS 138 3.173 -12.157 8.746 936 H LEU 139 H LEU 139 3.150 -10.889 3.098 937 HA LEU 139 HA LEU 139 0.612 -9.508 3.578 938 1HB LEU 139 2HB LEU 139 1.379 -11.402 1.340 939 2HB LEU 139 1HB LEU 139 -0.162 -10.616 1.515 940 HG LEU 139 HG LEU 139 1.075 -8.387 1.092 941 1HD1 LEU 139 1HD1 LEU 139 3.309 -9.053 1.629 942 2HD1 LEU 139 2HD1 LEU 139 3.188 -8.458 -0.027 943 3HD1 LEU 139 3HD1 LEU 139 3.309 -10.192 0.278 944 1HD2 LEU 139 1HD2 LEU 139 1.174 -10.455 -1.089 945 2HD2 LEU 139 2HD2 LEU 139 1.128 -8.708 -1.307 946 3HD2 LEU 139 3HD2 LEU 139 -0.262 -9.560 -0.616 947 H GLU 140 H GLU 140 -0.951 -10.622 4.622 948 HA GLU 140 HA GLU 140 -0.782 -13.526 4.751 949 1HB GLU 140 2HB GLU 140 -1.373 -11.680 7.087 950 2HB GLU 140 1HB GLU 140 -1.600 -13.423 7.115 951 1HG GLU 140 2HG GLU 140 0.800 -13.731 6.728 952 2HG GLU 140 1HG GLU 140 1.012 -11.985 6.728 953 H TYR 141 H TYR 141 -2.644 -14.476 4.282 954 HA TYR 141 HA TYR 141 -5.065 -12.939 4.386 955 1HB TYR 141 2HB TYR 141 -5.531 -13.437 1.919 956 2HB TYR 141 1HB TYR 141 -4.370 -12.178 2.338 957 HD1 TYR 141 1HD TYR 141 -1.960 -12.554 2.006 958 HD2 TYR 141 2HD TYR 141 -4.817 -15.414 0.670 959 HE1 TYR 141 1HE TYR 141 -0.243 -13.614 0.615 960 HE2 TYR 141 2HE TYR 141 -3.176 -16.448 -0.690 961 HH TYR 141 HH TYR 141 0.202 -15.797 -0.409 962 H GLU 142 H GLU 142 -6.937 -14.100 3.856 963 HA GLU 142 HA GLU 142 -6.749 -16.899 4.780 964 1HB GLU 142 2HB GLU 142 -7.845 -15.144 6.221 965 2HB GLU 142 1HB GLU 142 -9.036 -14.934 4.955 966 1HG GLU 142 2HG GLU 142 -9.987 -16.311 6.626 967 2HG GLU 142 1HG GLU 142 -9.637 -17.323 5.228 968 H LYS 143 H LYS 143 -7.316 -18.373 3.204 969 HA LYS 143 HA LYS 143 -8.467 -17.493 0.691 970 1HB LYS 143 2HB LYS 143 -7.806 -20.276 1.672 971 2HB LYS 143 1HB LYS 143 -8.263 -19.856 0.043 972 1HG LYS 143 2HG LYS 143 -5.687 -18.949 1.386 973 2HG LYS 143 1HG LYS 143 -5.882 -20.316 0.273 974 1HD LYS 143 2HD LYS 143 -6.571 -18.789 -1.419 975 2HD LYS 143 1HD LYS 143 -6.327 -17.442 -0.297 976 1HE LYS 143 2HE LYS 143 -4.340 -17.779 -1.742 977 2HE LYS 143 1HE LYS 143 -3.982 -18.052 -0.037 978 1HZ LYS 143 1HZ LYS 143 -2.965 -19.716 -1.387 979 2HZ LYS 143 2HZ LYS 143 -4.419 -20.157 -2.094 980 3HZ LYS 143 3HZ LYS 143 -4.145 -20.436 -0.455 981 H ILE 144 H ILE 144 -10.629 -17.623 0.169 982 HA ILE 144 HA ILE 144 -12.517 -18.825 1.958 983 HB ILE 144 HB ILE 144 -12.801 -17.838 -0.901 984 1HG1 ILE 144 2HG1 ILE 144 -13.697 -16.495 1.644 985 2HG1 ILE 144 1HG1 ILE 144 -12.222 -16.080 0.768 986 1HG2 ILE 144 1HG2 ILE 144 -14.903 -18.556 1.097 987 2HG2 ILE 144 2HG2 ILE 144 -14.517 -19.450 -0.382 988 3HG2 ILE 144 3HG2 ILE 144 -15.193 -17.809 -0.483 989 1HD1 ILE 144 1HD1 ILE 144 -13.981 -14.524 0.228 990 2HD1 ILE 144 2HD1 ILE 144 -15.035 -15.859 -0.280 991 3HD1 ILE 144 3HD1 ILE 144 -13.554 -15.513 -1.180 992 H SER 145 H SER 145 -11.197 -19.404 -1.232 993 HA SER 145 HA SER 145 -11.563 -22.277 -0.949 994 1HB SER 145 2HB SER 145 -13.379 -21.259 -2.369 995 2HB SER 145 1HB SER 145 -12.127 -20.599 -3.414 996 HG SER 145 HG SER 145 -13.059 -23.180 -3.124 997 H GLU 146 H GLU 146 -10.488 -22.589 -3.522 998 HA GLU 146 HA GLU 146 -7.696 -21.594 -3.197 999 1HB GLU 146 2HB GLU 146 -8.660 -24.090 -4.316 1000 2HB GLU 146 1HB GLU 146 -6.966 -23.640 -4.200 1001 1HG GLU 146 2HG GLU 146 -7.201 -23.672 -1.685 1002 2HG GLU 146 1HG GLU 146 -8.840 -24.298 -1.895 1003 H GLU 147 H GLU 147 -10.361 -22.476 -5.165 1004 HA GLU 147 HA GLU 147 -9.222 -22.710 -7.719 1005 1HB GLU 147 2HB GLU 147 -12.005 -21.813 -7.040 1006 2HB GLU 147 1HB GLU 147 -11.450 -22.622 -8.497 1007 1HG GLU 147 2HG GLU 147 -11.013 -24.637 -7.234 1008 2HG GLU 147 1HG GLU 147 -11.525 -23.832 -5.748 1009 H VAL 148 H VAL 148 -10.042 -20.075 -5.781 1010 HA VAL 148 HA VAL 148 -10.139 -18.266 -8.130 1011 HB VAL 148 HB VAL 148 -11.162 -17.555 -5.328 1012 1HG1 VAL 148 1HG1 VAL 148 -11.841 -16.282 -7.955 1013 2HG1 VAL 148 2HG1 VAL 148 -10.671 -15.666 -6.773 1014 3HG1 VAL 148 3HG1 VAL 148 -12.352 -15.821 -6.315 1015 1HG2 VAL 148 1HG2 VAL 148 -12.739 -18.707 -7.637 1016 2HG2 VAL 148 2HG2 VAL 148 -13.402 -18.053 -6.130 1017 3HG2 VAL 148 3HG2 VAL 148 -12.376 -19.489 -6.091 1018 H ALA 149 H ALA 149 -8.448 -19.113 -5.312 1019 HA ALA 149 HA ALA 149 -7.034 -16.777 -4.699 1020 1HB ALA 149 1HB ALA 149 -7.116 -18.835 -3.255 1021 2HB ALA 149 2HB ALA 149 -5.561 -18.103 -3.405 1022 3HB ALA 149 3HB ALA 149 -5.926 -19.571 -4.331 1023 H HIS 150 H HIS 150 -5.345 -15.835 -5.334 1024 HA HIS 150 HA HIS 150 -3.651 -16.910 -7.364 1025 1HB HIS 150 2HB HIS 150 -4.152 -15.155 -9.077 1026 2HB HIS 150 1HB HIS 150 -5.387 -16.378 -8.902 1027 HD1 HIS 150 1HD HIS 150 -6.113 -13.826 -10.280 1028 HD2 HIS 150 2HD HIS 150 -6.537 -14.305 -6.182 1029 HE1 HIS 150 1HE HIS 150 -7.884 -12.200 -9.598 1030 HE2 HIS 150 2HE HIS 150 -8.395 -12.863 -7.269 1031 HA PRO 151 HA PRO 151 -1.283 -14.090 -4.762 1032 1HB PRO 151 2HB PRO 151 0.701 -16.206 -5.471 1033 2HB PRO 151 1HB PRO 151 0.361 -15.486 -3.889 1034 1HG PRO 151 2HG PRO 151 -0.489 -17.953 -4.331 1035 2HG PRO 151 1HG PRO 151 -1.565 -16.775 -3.578 1036 1HD PRO 151 2HD PRO 151 -1.499 -17.615 -6.464 1037 2HD PRO 151 1HD PRO 151 -2.886 -17.522 -5.354 1038 H GLU 152 H GLU 152 -1.247 -15.384 -7.821 1039 HA GLU 152 HA GLU 152 0.867 -14.391 -9.282 1040 1HB GLU 152 2HB GLU 152 -2.023 -14.251 -10.148 1041 2HB GLU 152 1HB GLU 152 -0.610 -14.452 -11.160 1042 1HG GLU 152 2HG GLU 152 -1.662 -16.491 -9.209 1043 2HG GLU 152 1HG GLU 152 -1.939 -16.491 -10.943 1044 H THR 153 H THR 153 -2.209 -12.846 -8.343 1045 HA THR 153 HA THR 153 -1.578 -10.412 -9.686 1046 HB THR 153 HB THR 153 -3.819 -9.713 -8.979 1047 HG1 THR 153 1HG THR 153 -4.867 -10.728 -7.452 1048 1HG2 THR 153 1HG2 THR 153 -3.572 -11.277 -10.896 1049 2HG2 THR 153 2HG2 THR 153 -5.108 -11.489 -10.036 1050 3HG2 THR 153 3HG2 THR 153 -3.799 -12.617 -9.752 1051 H LEU 154 H LEU 154 -1.483 -11.704 -6.500 1052 HA LEU 154 HA LEU 154 -1.423 -9.331 -4.971 1053 1HB LEU 154 2HB LEU 154 -0.152 -11.988 -4.346 1054 2HB LEU 154 1HB LEU 154 -0.463 -10.702 -3.200 1055 HG LEU 154 HG LEU 154 -2.551 -12.315 -4.664 1056 1HD1 LEU 154 1HD1 LEU 154 -3.059 -13.221 -2.479 1057 2HD1 LEU 154 2HD1 LEU 154 -1.779 -12.251 -1.764 1058 3HD1 LEU 154 3HD1 LEU 154 -1.370 -13.546 -2.875 1059 1HD2 LEU 154 1HD2 LEU 154 -3.302 -10.032 -4.288 1060 2HD2 LEU 154 2HD2 LEU 154 -2.822 -10.162 -2.593 1061 3HD2 LEU 154 3HD2 LEU 154 -4.133 -11.164 -3.210 1062 H LEU 155 H LEU 155 1.236 -11.332 -6.361 1063 HA LEU 155 HA LEU 155 3.208 -9.757 -5.244 1064 1HB LEU 155 2HB LEU 155 3.484 -12.079 -5.809 1065 2HB LEU 155 1HB LEU 155 3.157 -11.731 -7.496 1066 HG LEU 155 HG LEU 155 5.045 -10.438 -7.658 1067 1HD1 LEU 155 1HD1 LEU 155 5.310 -9.596 -5.345 1068 2HD1 LEU 155 2HD1 LEU 155 6.798 -10.432 -5.795 1069 3HD1 LEU 155 3HD1 LEU 155 5.616 -11.234 -4.760 1070 1HD2 LEU 155 1HD2 LEU 155 6.766 -12.206 -7.412 1071 2HD2 LEU 155 2HD2 LEU 155 5.254 -12.759 -8.169 1072 3HD2 LEU 155 3HD2 LEU 155 5.581 -13.116 -6.468 1073 H GLN 156 H GLN 156 1.405 -9.721 -8.259 1074 HA GLN 156 HA GLN 156 3.058 -7.754 -9.464 1075 1HB GLN 156 2HB GLN 156 0.225 -8.568 -10.096 1076 2HB GLN 156 1HB GLN 156 1.134 -7.393 -11.039 1077 1HG GLN 156 2HG GLN 156 1.892 -10.280 -10.623 1078 2HG GLN 156 1HG GLN 156 1.162 -9.603 -12.074 1079 1HE2 GLN 156 1HE2 GLN 156 2.806 -7.119 -11.918 1080 2HE2 GLN 156 2HE2 GLN 156 4.380 -7.614 -12.408 1081 H PHE 157 H PHE 157 0.115 -7.600 -7.505 1082 HA PHE 157 HA PHE 157 -0.377 -4.855 -7.628 1083 1HB PHE 157 2HB PHE 157 -1.922 -6.447 -6.554 1084 2HB PHE 157 1HB PHE 157 -0.740 -6.778 -5.299 1085 HD1 PHE 157 1HD PHE 157 -0.926 -5.643 -3.265 1086 HD2 PHE 157 2HD PHE 157 -2.690 -3.954 -6.758 1087 HE1 PHE 157 1HE PHE 157 -1.946 -3.826 -1.885 1088 HE2 PHE 157 2HE PHE 157 -3.689 -2.170 -5.397 1089 HZ PHE 157 HZ PHE 157 -3.312 -2.112 -2.963 1090 H CYS 158 H CYS 158 1.767 -6.729 -5.612 1091 HA CYS 158 HA CYS 158 2.873 -4.761 -4.012 1092 1HB CYS 158 2HB CYS 158 3.307 -7.075 -3.583 1093 2HB CYS 158 1HB CYS 158 4.034 -7.295 -5.166 1094 HG CYS 158 HG CYS 158 5.382 -5.456 -2.606 1095 H VAL 159 H VAL 159 3.973 -5.907 -7.193 1096 HA VAL 159 HA VAL 159 6.188 -4.195 -7.421 1097 HB VAL 159 HB VAL 159 4.530 -5.413 -9.649 1098 1HG1 VAL 159 1HG1 VAL 159 7.336 -4.306 -9.699 1099 2HG1 VAL 159 2HG1 VAL 159 5.911 -3.587 -10.443 1100 3HG1 VAL 159 3HG1 VAL 159 6.534 -5.129 -11.043 1101 1HG2 VAL 159 1HG2 VAL 159 7.026 -6.410 -8.283 1102 2HG2 VAL 159 2HG2 VAL 159 6.253 -7.165 -9.678 1103 3HG2 VAL 159 3HG2 VAL 159 5.410 -7.098 -8.130 1104 H GLU 160 H GLU 160 2.851 -3.803 -8.494 1105 HA GLU 160 HA GLU 160 3.196 -1.413 -9.954 1106 1HB GLU 160 2HB GLU 160 0.706 -2.284 -8.472 1107 2HB GLU 160 1HB GLU 160 0.780 -1.142 -9.803 1108 1HG GLU 160 2HG GLU 160 1.390 -4.086 -9.937 1109 2HG GLU 160 1HG GLU 160 -0.054 -3.286 -10.541 1110 H VAL 161 H VAL 161 2.232 -1.989 -6.607 1111 HA VAL 161 HA VAL 161 2.029 0.754 -5.967 1112 HB VAL 161 HB VAL 161 2.379 -1.636 -4.153 1113 1HG1 VAL 161 1HG1 VAL 161 1.527 -0.164 -2.332 1114 2HG1 VAL 161 2HG1 VAL 161 1.533 1.197 -3.453 1115 3HG1 VAL 161 3HG1 VAL 161 3.052 0.437 -2.987 1116 1HG2 VAL 161 1HG2 VAL 161 0.332 -1.726 -5.447 1117 2HG2 VAL 161 2HG2 VAL 161 -0.091 -0.092 -4.937 1118 3HG2 VAL 161 3HG2 VAL 161 -0.041 -1.399 -3.755 1119 H SER 162 H SER 162 4.700 -1.562 -5.834 1120 HA SER 162 HA SER 162 6.518 0.003 -4.358 1121 1HB SER 162 2HB SER 162 7.067 -1.984 -6.563 1122 2HB SER 162 1HB SER 162 8.264 -1.320 -5.449 1123 HG SER 162 HG SER 162 6.040 -2.968 -4.850 1124 H LYS 163 H LYS 163 5.837 -0.080 -7.822 1125 HA LYS 163 HA LYS 163 7.769 1.794 -8.659 1126 1HB LYS 163 2HB LYS 163 5.009 1.240 -9.760 1127 2HB LYS 163 1HB LYS 163 6.229 2.200 -10.568 1128 1HG LYS 163 2HG LYS 163 7.647 0.269 -10.806 1129 2HG LYS 163 1HG LYS 163 6.508 -0.713 -9.876 1130 1HD LYS 163 2HD LYS 163 4.803 -0.400 -11.555 1131 2HD LYS 163 1HD LYS 163 5.845 0.690 -12.464 1132 1HE LYS 163 2HE LYS 163 6.434 -2.207 -11.894 1133 2HE LYS 163 1HE LYS 163 5.753 -1.599 -13.401 1134 1HZ LYS 163 1HZ LYS 163 7.760 -0.287 -13.718 1135 2HZ LYS 163 2HZ LYS 163 8.122 -1.914 -13.603 1136 3HZ LYS 163 3HZ LYS 163 8.442 -0.873 -12.311 1137 H GLU 164 H GLU 164 4.427 2.112 -7.637 1138 HA GLU 164 HA GLU 164 4.072 4.845 -8.079 1139 1HB GLU 164 2HB GLU 164 2.288 3.142 -7.653 1140 2HB GLU 164 1HB GLU 164 2.800 3.134 -5.966 1141 1HG GLU 164 2HG GLU 164 0.838 4.501 -6.215 1142 2HG GLU 164 1HG GLU 164 2.225 5.504 -5.791 1143 H ILE 165 H ILE 165 4.915 3.077 -5.096 1144 HA ILE 165 HA ILE 165 4.976 5.447 -3.581 1145 HB ILE 165 HB ILE 165 4.366 3.321 -2.557 1146 1HG1 ILE 165 2HG1 ILE 165 5.628 3.515 -0.464 1147 2HG1 ILE 165 1HG1 ILE 165 6.855 4.468 -1.297 1148 1HG2 ILE 165 1HG2 ILE 165 6.051 1.628 -1.954 1149 2HG2 ILE 165 2HG2 ILE 165 7.254 2.525 -2.883 1150 3HG2 ILE 165 3HG2 ILE 165 5.860 1.814 -3.698 1151 1HD1 ILE 165 1HD1 ILE 165 3.977 5.249 -0.936 1152 2HD1 ILE 165 2HD1 ILE 165 5.253 6.169 -1.754 1153 3HD1 ILE 165 3HD1 ILE 165 5.358 5.876 -0.011 1154 H ASP 166 H ASP 166 7.450 3.469 -4.944 1155 HA ASP 166 HA ASP 166 9.701 4.684 -3.736 1156 1HB ASP 166 2HB ASP 166 9.917 2.561 -4.891 1157 2HB ASP 166 1HB ASP 166 9.524 3.323 -6.426 1158 H GLU 167 H GLU 167 8.289 5.359 -6.923 1159 HA GLU 167 HA GLU 167 10.012 7.556 -7.402 1160 1HB GLU 167 2HB GLU 167 7.386 6.815 -8.697 1161 2HB GLU 167 1HB GLU 167 8.415 8.128 -9.250 1162 1HG GLU 167 2HG GLU 167 10.218 6.536 -9.673 1163 2HG GLU 167 1HG GLU 167 9.175 5.223 -9.127 1164 H HIS 168 H HIS 168 6.948 7.228 -5.846 1165 HA HIS 168 HA HIS 168 6.196 9.946 -5.792 1166 1HB HIS 168 2HB HIS 168 4.650 8.059 -5.328 1167 2HB HIS 168 1HB HIS 168 5.515 7.743 -3.836 1168 HD1 HIS 168 1HD HIS 168 2.915 9.857 -5.328 1169 HD2 HIS 168 2HD HIS 168 5.053 9.675 -1.790 1170 HE1 HIS 168 1HE HIS 168 1.683 11.319 -3.754 1171 HE2 HIS 168 2HE HIS 168 3.377 11.548 -1.855 1172 H LEU 169 H LEU 169 8.019 7.930 -3.494 1173 HA LEU 169 HA LEU 169 8.245 9.967 -1.544 1174 1HB LEU 169 2HB LEU 169 9.967 7.538 -1.972 1175 2HB LEU 169 1HB LEU 169 10.035 8.568 -0.558 1176 HG LEU 169 HG LEU 169 7.677 6.887 -1.399 1177 1HD1 LEU 169 1HD1 LEU 169 9.618 6.567 0.883 1178 2HD1 LEU 169 2HD1 LEU 169 9.539 5.562 -0.567 1179 3HD1 LEU 169 3HD1 LEU 169 8.195 5.570 0.573 1180 1HD2 LEU 169 1HD2 LEU 169 6.737 7.521 0.770 1181 2HD2 LEU 169 2HD2 LEU 169 6.955 8.918 -0.272 1182 3HD2 LEU 169 3HD2 LEU 169 8.094 8.611 1.043 1183 H LEU 170 H LEU 170 10.181 9.147 -4.306 1184 HA LEU 170 HA LEU 170 12.430 10.759 -3.657 1185 1HB LEU 170 2HB LEU 170 11.367 9.919 -6.348 1186 2HB LEU 170 1HB LEU 170 12.945 10.616 -6.064 1187 HG LEU 170 HG LEU 170 11.997 7.953 -5.008 1188 1HD1 LEU 170 1HD1 LEU 170 12.323 7.955 -7.401 1189 2HD1 LEU 170 2HD1 LEU 170 13.594 7.020 -6.601 1190 3HD1 LEU 170 3HD1 LEU 170 13.935 8.642 -7.208 1191 1HD2 LEU 170 1HD2 LEU 170 14.338 7.656 -4.337 1192 2HD2 LEU 170 2HD2 LEU 170 13.587 9.022 -3.510 1193 3HD2 LEU 170 3HD2 LEU 170 14.696 9.304 -4.854 1194 H ALA 171 H ALA 171 9.317 11.493 -4.718 1195 HA ALA 171 HA ALA 171 10.056 14.037 -5.867 1196 1HB ALA 171 1HB ALA 171 7.711 14.251 -6.455 1197 2HB ALA 171 2HB ALA 171 7.347 12.806 -5.495 1198 3HB ALA 171 3HB ALA 171 8.346 12.673 -6.937 1199 H GLU 172 H GLU 172 9.009 12.891 -2.750 1200 HA GLU 172 HA GLU 172 8.687 15.674 -1.983 1201 1HB GLU 172 2HB GLU 172 7.200 14.828 -0.077 1202 2HB GLU 172 1HB GLU 172 6.461 14.956 -1.639 1203 1HG GLU 172 2HG GLU 172 6.960 12.444 -1.855 1204 2HG GLU 172 1HG GLU 172 7.333 12.501 -0.133 1205 H GLU 173 H GLU 173 8.640 15.629 0.660 1206 HA GLU 173 HA GLU 173 11.377 15.654 1.205 1207 1HB GLU 173 2HB GLU 173 10.646 16.350 3.500 1208 2HB GLU 173 1HB GLU 173 10.021 17.322 2.179 1209 1HG GLU 173 2HG GLU 173 7.891 15.986 2.339 1210 2HG GLU 173 1HG GLU 173 8.552 15.255 3.798 Start of MODEL 16 1 H THR 17 H THR 17 1.176 -24.905 -2.426 2 HA THR 17 HA THR 17 0.721 -27.478 -3.591 3 HB THR 17 HB THR 17 1.218 -27.137 -0.612 4 HG1 THR 17 1HG THR 17 2.900 -27.769 -2.703 5 1HG2 THR 17 1HG2 THR 17 0.799 -29.655 -2.255 6 2HG2 THR 17 2HG2 THR 17 -0.386 -28.934 -1.167 7 3HG2 THR 17 3HG2 THR 17 1.113 -29.597 -0.521 8 H GLU 18 H GLU 18 -1.460 -28.160 -2.827 9 HA GLU 18 HA GLU 18 -3.312 -26.119 -2.663 10 1HB GLU 18 2HB GLU 18 -4.935 -27.837 -1.874 11 2HB GLU 18 1HB GLU 18 -4.111 -28.241 -3.371 12 1HG GLU 18 2HG GLU 18 -2.620 -29.747 -2.119 13 2HG GLU 18 1HG GLU 18 -3.465 -29.333 -0.631 14 H ALA 19 H ALA 19 -4.551 -25.259 -1.074 15 HA ALA 19 HA ALA 19 -3.071 -24.882 1.366 16 1HB ALA 19 1HB ALA 19 -5.514 -23.471 0.356 17 2HB ALA 19 2HB ALA 19 -3.852 -22.957 0.085 18 3HB ALA 19 3HB ALA 19 -4.513 -22.965 1.728 19 H SER 20 H SER 20 -3.423 -26.660 2.599 20 HA SER 20 HA SER 20 -5.968 -27.725 3.183 21 1HB SER 20 2HB SER 20 -4.626 -28.884 4.982 22 2HB SER 20 1HB SER 20 -4.034 -29.102 3.333 23 HG SER 20 HG SER 20 -2.536 -28.430 5.172 24 H SER 21 H SER 21 -3.835 -25.440 4.721 25 HA SER 21 HA SER 21 -5.520 -25.115 7.041 26 1HB SER 21 2HB SER 21 -3.047 -25.037 7.197 27 2HB SER 21 1HB SER 21 -3.034 -23.616 6.166 28 HG SER 21 HG SER 21 -4.577 -23.602 8.499 29 H LEU 22 H LEU 22 -5.542 -23.942 3.909 30 HA LEU 22 HA LEU 22 -6.355 -22.262 2.751 31 1HB LEU 22 2HB LEU 22 -8.144 -22.018 5.136 32 2HB LEU 22 1HB LEU 22 -8.406 -21.165 3.625 33 HG LEU 22 HG LEU 22 -8.252 -24.173 3.818 34 1HD1 LEU 22 1HD1 LEU 22 -10.647 -24.127 3.573 35 2HD1 LEU 22 2HD1 LEU 22 -10.624 -22.352 3.717 36 3HD1 LEU 22 3HD1 LEU 22 -10.082 -23.376 5.065 37 1HD2 LEU 22 1HD2 LEU 22 -9.284 -24.069 1.591 38 2HD2 LEU 22 2HD2 LEU 22 -7.706 -23.294 1.601 39 3HD2 LEU 22 3HD2 LEU 22 -9.173 -22.314 1.623 40 H VAL 23 H VAL 23 -5.567 -21.134 5.972 41 HA VAL 23 HA VAL 23 -5.288 -18.436 5.137 42 HB VAL 23 HB VAL 23 -5.549 -19.011 7.544 43 1HG1 VAL 23 1HG1 VAL 23 -2.758 -20.079 7.339 44 2HG1 VAL 23 2HG1 VAL 23 -4.218 -21.018 7.649 45 3HG1 VAL 23 3HG1 VAL 23 -3.651 -19.843 8.846 46 1HG2 VAL 23 1HG2 VAL 23 -2.998 -17.523 6.926 47 2HG2 VAL 23 2HG2 VAL 23 -3.873 -17.453 8.458 48 3HG2 VAL 23 3HG2 VAL 23 -4.620 -16.838 6.981 49 H GLY 24 H GLY 24 -3.605 -17.368 4.311 50 1HA GLY 24 2HA GLY 24 -1.191 -18.905 3.784 51 2HA GLY 24 1HA GLY 24 -2.080 -18.187 2.448 52 H LYS 25 H LYS 25 0.454 -17.586 2.915 53 HA LYS 25 HA LYS 25 0.353 -14.776 3.733 54 1HB LYS 25 2HB LYS 25 2.492 -16.786 4.322 55 2HB LYS 25 1HB LYS 25 2.695 -15.038 4.281 56 1HG LYS 25 2HG LYS 25 1.321 -14.757 6.144 57 2HG LYS 25 1HG LYS 25 0.850 -16.469 6.151 58 1HD LYS 25 2HD LYS 25 2.664 -15.892 7.783 59 2HD LYS 25 1HD LYS 25 3.098 -17.146 6.618 60 1HE LYS 25 2HE LYS 25 4.272 -15.430 5.234 61 2HE LYS 25 1HE LYS 25 3.861 -14.216 6.422 62 1HZ LYS 25 1HZ LYS 25 5.501 -16.620 7.006 63 2HZ LYS 25 2HZ LYS 25 5.169 -15.384 8.084 64 3HZ LYS 25 3HZ LYS 25 6.145 -15.098 6.737 65 H LEU 26 H LEU 26 1.788 -13.469 2.623 66 HA LEU 26 HA LEU 26 3.565 -14.775 0.867 67 1HB LEU 26 2HB LEU 26 1.683 -14.341 -0.621 68 2HB LEU 26 1HB LEU 26 1.615 -12.672 -0.092 69 HG LEU 26 HG LEU 26 3.859 -12.325 -1.103 70 1HD1 LEU 26 1HD1 LEU 26 4.663 -14.593 -1.106 71 2HD1 LEU 26 2HD1 LEU 26 4.669 -13.935 -2.742 72 3HD1 LEU 26 3HD1 LEU 26 3.408 -15.067 -2.251 73 1HD2 LEU 26 1HD2 LEU 26 1.842 -11.659 -2.238 74 2HD2 LEU 26 2HD2 LEU 26 1.688 -13.271 -2.950 75 3HD2 LEU 26 3HD2 LEU 26 3.063 -12.234 -3.371 76 H GLU 27 H GLU 27 5.465 -13.784 0.901 77 HA GLU 27 HA GLU 27 5.516 -11.046 1.824 78 1HB GLU 27 2HB GLU 27 5.886 -12.493 3.784 79 2HB GLU 27 1HB GLU 27 7.240 -13.247 2.961 80 1HG GLU 27 2HG GLU 27 8.506 -11.242 3.045 81 2HG GLU 27 1HG GLU 27 7.112 -10.322 3.620 82 H THR 28 H THR 28 6.793 -9.817 0.684 83 HA THR 28 HA THR 28 8.912 -10.997 -0.878 84 HB THR 28 HB THR 28 6.999 -11.105 -2.424 85 HG1 THR 28 1HG THR 28 9.102 -10.346 -3.200 86 1HG2 THR 28 1HG2 THR 28 5.566 -9.397 -1.399 87 2HG2 THR 28 2HG2 THR 28 5.776 -9.092 -3.124 88 3HG2 THR 28 3HG2 THR 28 6.671 -8.134 -1.949 89 H ASP 29 H ASP 29 10.603 -9.625 -1.108 90 HA ASP 29 HA ASP 29 10.248 -6.996 0.084 91 1HB ASP 29 2HB ASP 29 12.710 -6.974 0.474 92 2HB ASP 29 1HB ASP 29 11.915 -8.303 1.294 93 H VAL 30 H VAL 30 10.195 -5.333 -1.152 94 HA VAL 30 HA VAL 30 11.365 -5.550 -3.831 95 HB VAL 30 HB VAL 30 9.077 -3.687 -2.948 96 1HG1 VAL 30 1HG1 VAL 30 10.465 -2.653 -4.635 97 2HG1 VAL 30 2HG1 VAL 30 8.885 -3.107 -5.261 98 3HG1 VAL 30 3HG1 VAL 30 10.295 -4.066 -5.677 99 1HG2 VAL 30 1HG2 VAL 30 9.070 -6.102 -4.743 100 2HG2 VAL 30 2HG2 VAL 30 7.706 -5.040 -4.394 101 3HG2 VAL 30 3HG2 VAL 30 8.403 -6.025 -3.112 102 H GLU 31 H GLU 31 12.790 -4.024 -4.487 103 HA GLU 31 HA GLU 31 13.893 -2.495 -2.290 104 1HB GLU 31 2HB GLU 31 15.144 -2.481 -5.013 105 2HB GLU 31 1HB GLU 31 15.786 -2.292 -3.379 106 1HG GLU 31 2HG GLU 31 16.632 -4.359 -4.255 107 2HG GLU 31 1HG GLU 31 15.465 -4.725 -2.994 108 H ILE 32 H ILE 32 14.001 -0.281 -2.266 109 HA ILE 32 HA ILE 32 13.001 1.053 -4.621 110 HB ILE 32 HB ILE 32 11.903 2.767 -3.163 111 1HG1 ILE 32 2HG1 ILE 32 12.349 0.712 -0.986 112 2HG1 ILE 32 1HG1 ILE 32 13.081 2.307 -1.069 113 1HG2 ILE 32 1HG2 ILE 32 10.554 1.104 -4.288 114 2HG2 ILE 32 2HG2 ILE 32 9.874 1.452 -2.695 115 3HG2 ILE 32 3HG2 ILE 32 10.797 -0.027 -2.956 116 1HD1 ILE 32 1HD1 ILE 32 11.297 2.270 0.523 117 2HD1 ILE 32 2HD1 ILE 32 10.157 1.696 -0.698 118 3HD1 ILE 32 3HD1 ILE 32 10.853 3.316 -0.823 119 H LYS 33 H LYS 33 13.789 3.081 -4.988 120 HA LYS 33 HA LYS 33 16.572 3.381 -4.243 121 1HB LYS 33 2HB LYS 33 14.777 5.149 -5.886 122 2HB LYS 33 1HB LYS 33 16.535 5.202 -5.841 123 1HG LYS 33 2HG LYS 33 16.665 3.031 -6.879 124 2HG LYS 33 1HG LYS 33 14.909 2.866 -6.819 125 1HD LYS 33 2HD LYS 33 14.712 4.864 -8.259 126 2HD LYS 33 1HD LYS 33 16.469 4.918 -8.373 127 1HE LYS 33 2HE LYS 33 16.494 2.724 -9.410 128 2HE LYS 33 1HE LYS 33 14.744 2.608 -9.242 129 1HZ LYS 33 1HZ LYS 33 15.379 3.281 -11.459 130 2HZ LYS 33 2HZ LYS 33 16.194 4.621 -10.855 131 3HZ LYS 33 3HZ LYS 33 14.519 4.518 -10.702 132 H ALA 34 H ALA 34 13.662 4.291 -3.046 133 HA ALA 34 HA ALA 34 14.066 6.922 -2.204 134 1HB ALA 34 1HB ALA 34 12.264 4.826 -1.027 135 2HB ALA 34 2HB ALA 34 11.854 5.898 -2.364 136 3HB ALA 34 3HB ALA 34 12.145 6.561 -0.756 137 H SER 35 H SER 35 14.283 7.633 -0.007 138 HA SER 35 HA SER 35 16.217 6.068 1.502 139 1HB SER 35 2HB SER 35 15.355 8.964 1.779 140 2HB SER 35 1HB SER 35 16.747 8.204 2.551 141 HG SER 35 HG SER 35 17.369 7.709 0.271 142 H ALA 36 H ALA 36 15.666 5.333 3.533 143 HA ALA 36 HA ALA 36 12.963 4.975 4.153 144 1HB ALA 36 1HB ALA 36 14.700 3.442 4.943 145 2HB ALA 36 2HB ALA 36 13.729 4.044 6.280 146 3HB ALA 36 3HB ALA 36 15.331 4.722 5.996 147 H ASP 37 H ASP 37 15.221 7.429 5.186 148 HA ASP 37 HA ASP 37 13.560 8.461 7.241 149 1HB ASP 37 2HB ASP 37 15.963 8.958 7.229 150 2HB ASP 37 1HB ASP 37 15.766 9.873 5.738 151 H LYS 38 H LYS 38 13.890 9.227 3.835 152 HA LYS 38 HA LYS 38 12.211 11.487 3.951 153 1HB LYS 38 2HB LYS 38 12.935 9.755 1.599 154 2HB LYS 38 1HB LYS 38 11.925 11.195 1.459 155 1HG LYS 38 2HG LYS 38 13.732 12.547 2.418 156 2HG LYS 38 1HG LYS 38 14.746 11.114 2.516 157 1HD LYS 38 2HD LYS 38 15.346 12.406 0.600 158 2HD LYS 38 1HD LYS 38 14.608 10.889 0.077 159 1HE LYS 38 2HE LYS 38 13.818 12.738 -1.307 160 2HE LYS 38 1HE LYS 38 12.498 12.074 -0.362 161 1HZ LYS 38 1HZ LYS 38 13.996 14.552 0.337 162 2HZ LYS 38 2HZ LYS 38 12.644 13.948 1.135 163 3HZ LYS 38 3HZ LYS 38 12.501 14.492 -0.441 164 H PHE 39 H PHE 39 11.617 8.106 3.653 165 HA PHE 39 HA PHE 39 8.820 8.222 3.078 166 1HB PHE 39 2HB PHE 39 10.289 6.205 2.716 167 2HB PHE 39 1HB PHE 39 10.425 6.037 4.455 168 HD1 PHE 39 1HD PHE 39 8.266 5.617 1.537 169 HD2 PHE 39 2HD PHE 39 8.565 5.147 5.753 170 HE1 PHE 39 1HE PHE 39 6.290 4.161 1.509 171 HE2 PHE 39 2HE PHE 39 6.588 3.681 5.733 172 HZ PHE 39 HZ PHE 39 5.445 3.188 3.610 173 H HIS 40 H HIS 40 10.772 7.985 5.986 174 HA HIS 40 HA HIS 40 8.835 7.790 7.998 175 1HB HIS 40 2HB HIS 40 11.247 7.453 8.378 176 2HB HIS 40 1HB HIS 40 11.556 9.142 8.023 177 HD1 HIS 40 1HD HIS 40 11.607 10.714 10.063 178 HD2 HIS 40 2HD HIS 40 9.836 7.036 10.893 179 HE1 HIS 40 1HE HIS 40 11.215 10.699 12.499 180 HE2 HIS 40 2HE HIS 40 10.562 8.360 12.995 181 H HIS 41 H HIS 41 10.050 10.556 6.249 182 HA HIS 41 HA HIS 41 9.006 12.568 7.953 183 1HB HIS 41 2HB HIS 41 10.009 12.683 5.137 184 2HB HIS 41 1HB HIS 41 9.258 14.082 5.885 185 HD1 HIS 41 1HD HIS 41 11.313 15.521 6.042 186 HD2 HIS 41 2HD HIS 41 11.848 11.785 7.727 187 HE1 HIS 41 1HE HIS 41 13.561 15.597 7.163 188 HE2 HIS 41 2HE HIS 41 13.954 13.139 7.632 189 H MET 42 H MET 42 7.543 10.909 5.213 190 HA MET 42 HA MET 42 5.527 12.923 5.068 191 1HB MET 42 2HB MET 42 4.355 11.572 3.427 192 2HB MET 42 1HB MET 42 6.064 11.688 3.053 193 1HG MET 42 2HG MET 42 6.410 9.444 3.890 194 2HG MET 42 1HG MET 42 4.700 9.322 4.309 195 1HE MET 42 1HE MET 42 4.343 7.148 2.910 196 2HE MET 42 2HE MET 42 6.053 7.132 2.486 197 3HE MET 42 3HE MET 42 4.830 6.951 1.228 198 H PHE 43 H PHE 43 5.835 10.047 6.910 199 HA PHE 43 HA PHE 43 3.032 10.158 7.649 200 1HB PHE 43 2HB PHE 43 5.258 8.366 8.631 201 2HB PHE 43 1HB PHE 43 3.622 8.314 9.269 202 HD1 PHE 43 1HD PHE 43 1.749 7.691 7.770 203 HD2 PHE 43 2HD PHE 43 5.815 7.313 6.599 204 HE1 PHE 43 1HE PHE 43 1.079 6.151 5.976 205 HE2 PHE 43 2HE PHE 43 5.156 5.778 4.804 206 HZ PHE 43 HZ PHE 43 2.788 5.191 4.485 207 H ALA 44 H ALA 44 6.118 11.157 8.906 208 HA ALA 44 HA ALA 44 4.776 12.138 11.284 209 1HB ALA 44 1HB ALA 44 6.868 10.891 11.658 210 2HB ALA 44 2HB ALA 44 7.001 12.565 12.199 211 3HB ALA 44 3HB ALA 44 7.738 12.067 10.674 212 H GLY 45 H GLY 45 3.628 13.635 10.019 213 1HA GLY 45 2HA GLY 45 4.623 16.232 10.118 214 2HA GLY 45 1HA GLY 45 4.750 15.652 8.458 215 H LYS 46 H LYS 46 3.158 17.271 7.917 216 HA LYS 46 HA LYS 46 0.480 16.638 8.875 217 1HB LYS 46 2HB LYS 46 1.528 19.122 7.509 218 2HB LYS 46 1HB LYS 46 -0.176 18.840 7.779 219 1HG LYS 46 2HG LYS 46 0.636 20.339 9.463 220 2HG LYS 46 1HG LYS 46 0.288 18.797 10.232 221 1HD LYS 46 2HD LYS 46 2.681 18.243 10.152 222 2HD LYS 46 1HD LYS 46 3.003 19.802 9.396 223 1HE LYS 46 2HE LYS 46 1.792 19.391 12.121 224 2HE LYS 46 1HE LYS 46 3.464 19.832 11.808 225 1HZ LYS 46 1HZ LYS 46 2.149 21.760 12.364 226 2HZ LYS 46 2HZ LYS 46 1.080 21.463 11.100 227 3HZ LYS 46 3HZ LYS 46 2.674 21.888 10.772 228 HA PRO 47 HA PRO 47 -0.380 14.807 4.866 229 1HB PRO 47 2HB PRO 47 -3.218 15.242 5.524 230 2HB PRO 47 1HB PRO 47 -2.365 13.721 5.245 231 1HG PRO 47 2HG PRO 47 -3.209 14.439 7.694 232 2HG PRO 47 1HG PRO 47 -1.702 13.535 7.451 233 1HD PRO 47 2HD PRO 47 -2.103 16.448 8.003 234 2HD PRO 47 1HD PRO 47 -0.884 15.315 8.642 235 H HIS 48 H HIS 48 -1.568 17.824 6.011 236 HA HIS 48 HA HIS 48 -2.345 18.668 3.307 237 1HB HIS 48 2HB HIS 48 -2.866 20.014 5.979 238 2HB HIS 48 1HB HIS 48 -3.335 20.678 4.430 239 HD1 HIS 48 1HD HIS 48 -5.564 19.902 3.471 240 HD2 HIS 48 2HD HIS 48 -4.351 17.645 6.746 241 HE1 HIS 48 1HE HIS 48 -7.514 18.477 4.064 242 HE2 HIS 48 2HE HIS 48 -6.838 17.245 6.124 243 H HIS 49 H HIS 49 -1.375 20.475 2.373 244 HA HIS 49 HA HIS 49 1.126 21.224 3.690 245 1HB HIS 49 2HB HIS 49 0.661 20.837 0.742 246 2HB HIS 49 1HB HIS 49 2.100 21.569 1.431 247 HD1 HIS 49 1HD HIS 49 0.461 18.292 0.911 248 HD2 HIS 49 2HD HIS 49 3.741 19.896 2.840 249 HE1 HIS 49 1HE HIS 49 1.853 16.304 1.569 250 HE2 HIS 49 2HE HIS 49 3.973 17.314 2.463 251 H VAL 50 H VAL 50 1.895 23.203 3.539 252 HA VAL 50 HA VAL 50 1.892 25.376 3.626 253 HB VAL 50 HB VAL 50 -0.064 25.334 1.315 254 1HG1 VAL 50 1HG1 VAL 50 0.876 27.541 0.768 255 2HG1 VAL 50 2HG1 VAL 50 1.905 27.446 2.193 256 3HG1 VAL 50 3HG1 VAL 50 0.154 27.526 2.381 257 1HG2 VAL 50 1HG2 VAL 50 1.935 23.970 0.826 258 2HG2 VAL 50 2HG2 VAL 50 2.960 25.326 1.244 259 3HG2 VAL 50 3HG2 VAL 50 1.910 25.440 -0.167 260 H SER 51 H SER 51 1.011 25.315 5.628 261 HA SER 51 HA SER 51 -1.813 25.423 6.048 262 1HB SER 51 2HB SER 51 0.475 25.832 7.979 263 2HB SER 51 1HB SER 51 -1.213 25.534 8.407 264 HG SER 51 HG SER 51 -0.993 23.570 7.150 265 H LYS 52 H LYS 52 0.691 27.656 5.518 266 HA LYS 52 HA LYS 52 -1.206 29.843 5.686 267 1HB LYS 52 2HB LYS 52 -0.063 29.831 7.896 268 2HB LYS 52 1HB LYS 52 1.478 29.930 7.055 269 1HG LYS 52 2HG LYS 52 0.783 32.100 6.115 270 2HG LYS 52 1HG LYS 52 -0.698 32.003 7.067 271 1HD LYS 52 2HD LYS 52 0.934 33.385 8.211 272 2HD LYS 52 1HD LYS 52 0.657 31.890 9.116 273 1HE LYS 52 2HE LYS 52 2.681 30.930 8.220 274 2HE LYS 52 1HE LYS 52 2.959 32.346 7.216 275 1HZ LYS 52 1HZ LYS 52 4.329 32.412 9.179 276 2HZ LYS 52 2HZ LYS 52 2.996 32.267 10.193 277 3HZ LYS 52 3HZ LYS 52 3.205 33.658 9.260 278 H ALA 53 H ALA 53 2.311 29.343 5.315 279 HA ALA 53 HA ALA 53 2.126 30.153 2.548 280 1HB ALA 53 1HB ALA 53 3.800 31.902 2.803 281 2HB ALA 53 2HB ALA 53 3.813 31.651 4.551 282 3HB ALA 53 3HB ALA 53 2.365 32.266 3.760 283 H SER 54 H SER 54 4.354 30.054 1.565 284 HA SER 54 HA SER 54 6.385 28.475 2.764 285 1HB SER 54 2HB SER 54 4.652 27.320 0.526 286 2HB SER 54 1HB SER 54 6.193 26.627 1.028 287 HG SER 54 HG SER 54 4.441 27.063 3.076 288 HA PRO 55 HA PRO 55 8.835 30.609 -0.400 289 1HB PRO 55 2HB PRO 55 9.454 27.987 -1.710 290 2HB PRO 55 1HB PRO 55 10.560 29.279 -1.229 291 1HG PRO 55 2HG PRO 55 10.419 27.097 0.245 292 2HG PRO 55 1HG PRO 55 10.477 28.685 1.028 293 1HD PRO 55 2HD PRO 55 8.152 26.869 0.595 294 2HD PRO 55 1HD PRO 55 8.553 27.850 2.022 295 H GLY 56 H GLY 56 7.782 31.727 -1.939 296 1HA GLY 56 2HA GLY 56 6.837 32.088 -4.052 297 2HA GLY 56 1HA GLY 56 6.555 30.352 -4.207 298 H ASN 57 H ASN 57 5.285 29.716 -2.058 299 HA ASN 57 HA ASN 57 3.387 29.570 -0.917 300 1HB ASN 57 2HB ASN 57 3.863 31.820 -0.025 301 2HB ASN 57 1HB ASN 57 2.970 32.528 -1.373 302 1HD2 ASN 57 1HD2 ASN 57 1.402 33.472 -0.055 303 2HD2 ASN 57 2HD2 ASN 57 0.231 32.539 0.808 304 H ILE 58 H ILE 58 2.589 28.228 -2.357 305 HA ILE 58 HA ILE 58 0.185 29.242 -3.619 306 HB ILE 58 HB ILE 58 2.003 27.113 -4.821 307 1HG1 ILE 58 2HG1 ILE 58 1.269 29.872 -5.861 308 2HG1 ILE 58 1HG1 ILE 58 2.828 29.426 -5.182 309 1HG2 ILE 58 1HG2 ILE 58 -0.354 26.592 -5.107 310 2HG2 ILE 58 2HG2 ILE 58 0.346 27.062 -6.664 311 3HG2 ILE 58 3HG2 ILE 58 -0.653 28.202 -5.751 312 1HD1 ILE 58 1HD1 ILE 58 2.910 29.508 -7.597 313 2HD1 ILE 58 2HD1 ILE 58 1.607 28.323 -7.702 314 3HD1 ILE 58 3HD1 ILE 58 3.167 27.861 -7.024 315 H GLN 59 H GLN 59 -1.274 28.474 -2.332 316 HA GLN 59 HA GLN 59 -0.871 26.137 -0.728 317 1HB GLN 59 2HB GLN 59 -3.424 27.698 -1.153 318 2HB GLN 59 1HB GLN 59 -3.055 26.613 0.180 319 1HG GLN 59 2HG GLN 59 -1.247 28.131 0.876 320 2HG GLN 59 1HG GLN 59 -1.696 29.209 -0.440 321 1HE2 GLN 59 1HE2 GLN 59 -1.645 29.733 2.414 322 2HE2 GLN 59 2HE2 GLN 59 -3.232 30.198 2.863 323 H GLY 60 H GLY 60 -2.523 26.931 -3.672 324 1HA GLY 60 2HA GLY 60 -3.096 25.440 -5.383 325 2HA GLY 60 1HA GLY 60 -2.865 24.103 -4.258 326 H CYS 61 H CYS 61 -4.376 24.565 -2.262 327 HA CYS 61 HA CYS 61 -6.389 24.453 -1.353 328 1HB CYS 61 2HB CYS 61 -6.699 26.780 -2.140 329 2HB CYS 61 1HB CYS 61 -7.323 26.178 -3.665 330 HG CYS 61 HG CYS 61 -8.949 25.110 -0.923 331 H ASP 62 H ASP 62 -6.475 22.312 -1.598 332 HA ASP 62 HA ASP 62 -8.108 21.304 -3.834 333 1HB ASP 62 2HB ASP 62 -6.140 19.816 -2.081 334 2HB ASP 62 1HB ASP 62 -7.165 19.069 -3.293 335 H LEU 63 H LEU 63 -7.289 20.420 -0.520 336 HA LEU 63 HA LEU 63 -8.454 19.632 1.192 337 1HB LEU 63 2HB LEU 63 -9.162 21.971 1.252 338 2HB LEU 63 1HB LEU 63 -10.496 21.615 0.180 339 HG LEU 63 HG LEU 63 -11.501 20.207 1.957 340 1HD1 LEU 63 1HD1 LEU 63 -10.628 20.355 4.232 341 2HD1 LEU 63 2HD1 LEU 63 -9.241 21.262 3.641 342 3HD1 LEU 63 3HD1 LEU 63 -9.473 19.582 3.146 343 1HD2 LEU 63 1HD2 LEU 63 -12.170 22.067 3.402 344 2HD2 LEU 63 2HD2 LEU 63 -12.172 22.530 1.699 345 3HD2 LEU 63 3HD2 LEU 63 -10.851 23.040 2.754 346 H HIS 64 H HIS 64 -8.509 17.569 0.076 347 HA HIS 64 HA HIS 64 -11.277 16.718 -0.353 348 1HB HIS 64 2HB HIS 64 -8.843 15.779 -1.905 349 2HB HIS 64 1HB HIS 64 -10.445 15.071 -2.039 350 HD1 HIS 64 1HD HIS 64 -8.348 17.197 -3.844 351 HD2 HIS 64 2HD HIS 64 -12.363 17.406 -2.803 352 HE1 HIS 64 1HE HIS 64 -9.376 18.793 -5.467 353 HE2 HIS 64 2HE HIS 64 -11.848 18.693 -4.965 354 H GLU 65 H GLU 65 -11.417 14.247 0.004 355 HA GLU 65 HA GLU 65 -9.957 13.826 2.428 356 1HB GLU 65 2HB GLU 65 -11.390 11.877 2.885 357 2HB GLU 65 1HB GLU 65 -12.329 13.312 2.557 358 1HG GLU 65 2HG GLU 65 -11.867 11.028 0.631 359 2HG GLU 65 1HG GLU 65 -13.313 11.272 1.596 360 H GLY 66 H GLY 66 -7.956 13.456 1.971 361 1HA GLY 66 2HA GLY 66 -7.295 11.104 0.359 362 2HA GLY 66 1HA GLY 66 -6.149 12.338 0.902 363 H ASP 67 H ASP 67 -4.959 11.871 2.602 364 HA ASP 67 HA ASP 67 -5.758 9.610 4.232 365 1HB ASP 67 2HB ASP 67 -3.407 9.664 3.534 366 2HB ASP 67 1HB ASP 67 -3.206 11.244 4.292 367 H TRP 68 H TRP 68 -6.408 9.728 6.261 368 HA TRP 68 HA TRP 68 -7.459 12.223 7.156 369 1HB TRP 68 2HB TRP 68 -7.450 9.492 8.451 370 2HB TRP 68 1HB TRP 68 -8.308 10.887 9.086 371 HD1 TRP 68 HD TRP 68 -8.261 8.979 5.664 372 HE1 TRP 68 1HE TRP 68 -10.690 8.773 4.838 373 HE3 TRP 68 3HE TRP 68 -10.616 11.466 9.465 374 HZ2 TRP 68 2HZ TRP 68 -13.264 9.555 5.698 375 HZ3 TRP 68 3HZ TRP 68 -13.071 11.683 9.379 376 HH2 TRP 68 HH TRP 68 -14.354 10.748 7.540 377 H GLY 69 H GLY 69 -4.435 10.706 7.603 378 1HA GLY 69 2HA GLY 69 -2.615 11.563 8.685 379 2HA GLY 69 1HA GLY 69 -3.642 12.805 9.381 380 H THR 70 H THR 70 -4.834 9.688 9.818 381 HA THR 70 HA THR 70 -3.412 9.093 12.226 382 HB THR 70 HB THR 70 -6.378 9.804 12.385 383 HG1 THR 70 1HG THR 70 -4.078 11.222 12.756 384 1HG2 THR 70 1HG2 THR 70 -6.116 9.457 14.808 385 2HG2 THR 70 2HG2 THR 70 -4.429 9.002 14.566 386 3HG2 THR 70 3HG2 THR 70 -5.718 7.985 13.921 387 H VAL 71 H VAL 71 -3.680 6.905 12.721 388 HA VAL 71 HA VAL 71 -4.397 5.088 10.788 389 HB VAL 71 HB VAL 71 -2.981 4.560 12.758 390 1HG1 VAL 71 1HG1 VAL 71 -3.965 4.025 14.854 391 2HG1 VAL 71 2HG1 VAL 71 -5.535 4.539 14.191 392 3HG1 VAL 71 3HG1 VAL 71 -4.227 5.730 14.396 393 1HG2 VAL 71 1HG2 VAL 71 -3.888 2.316 13.272 394 2HG2 VAL 71 2HG2 VAL 71 -3.846 2.675 11.546 395 3HG2 VAL 71 3HG2 VAL 71 -5.366 2.766 12.425 396 H GLY 72 H GLY 72 -6.225 3.763 10.387 397 1HA GLY 72 2HA GLY 72 -8.497 3.187 10.662 398 2HA GLY 72 1HA GLY 72 -8.731 4.648 11.630 399 H SER 73 H SER 73 -6.764 5.609 9.443 400 HA SER 73 HA SER 73 -8.469 7.215 7.930 401 1HB SER 73 2HB SER 73 -6.144 7.762 8.437 402 2HB SER 73 1HB SER 73 -5.612 6.364 7.525 403 HG SER 73 HG SER 73 -5.385 7.969 6.130 404 H ILE 74 H ILE 74 -9.275 6.966 5.893 405 HA ILE 74 HA ILE 74 -8.625 4.495 4.515 406 HB ILE 74 HB ILE 74 -11.280 5.943 4.593 407 1HG1 ILE 74 2HG1 ILE 74 -10.452 3.168 5.397 408 2HG1 ILE 74 1HG1 ILE 74 -10.691 4.503 6.512 409 1HG2 ILE 74 1HG2 ILE 74 -12.085 4.185 3.066 410 2HG2 ILE 74 2HG2 ILE 74 -10.450 3.534 2.951 411 3HG2 ILE 74 3HG2 ILE 74 -10.805 5.140 2.311 412 1HD1 ILE 74 1HD1 ILE 74 -12.731 3.231 4.734 413 2HD1 ILE 74 2HD1 ILE 74 -13.048 4.583 5.836 414 3HD1 ILE 74 3HD1 ILE 74 -12.586 2.991 6.477 415 H VAL 75 H VAL 75 -7.493 4.897 2.858 416 HA VAL 75 HA VAL 75 -8.076 7.126 1.115 417 HB VAL 75 HB VAL 75 -6.215 7.906 2.565 418 1HG1 VAL 75 1HG1 VAL 75 -5.282 5.794 3.271 419 2HG1 VAL 75 2HG1 VAL 75 -4.025 6.808 2.561 420 3HG1 VAL 75 3HG1 VAL 75 -4.709 5.473 1.635 421 1HG2 VAL 75 1HG2 VAL 75 -5.294 7.228 -0.229 422 2HG2 VAL 75 2HG2 VAL 75 -4.558 8.434 0.825 423 3HG2 VAL 75 3HG2 VAL 75 -6.211 8.655 0.259 424 H PHE 76 H PHE 76 -7.735 6.552 -1.035 425 HA PHE 76 HA PHE 76 -7.182 3.707 -1.324 426 1HB PHE 76 2HB PHE 76 -8.851 5.505 -3.078 427 2HB PHE 76 1HB PHE 76 -8.512 3.804 -3.408 428 HD1 PHE 76 1HD PHE 76 -8.839 2.388 -1.119 429 HD2 PHE 76 2HD PHE 76 -10.977 5.836 -2.276 430 HE1 PHE 76 1HE PHE 76 -10.662 1.663 0.286 431 HE2 PHE 76 2HE PHE 76 -12.878 5.150 -0.860 432 HZ PHE 76 HZ PHE 76 -12.739 3.049 0.439 433 H TRP 77 H TRP 77 -6.054 2.938 -3.028 434 HA TRP 77 HA TRP 77 -4.023 4.817 -4.067 435 1HB TRP 77 2HB TRP 77 -3.224 2.976 -2.594 436 2HB TRP 77 1HB TRP 77 -3.906 1.812 -3.714 437 HD1 TRP 77 HD TRP 77 -2.761 1.787 -6.185 438 HE1 TRP 77 1HE TRP 77 -0.295 2.171 -6.881 439 HE3 TRP 77 3HE TRP 77 -1.172 4.200 -2.014 440 HZ2 TRP 77 2HZ TRP 77 2.009 3.351 -5.753 441 HZ3 TRP 77 3HZ TRP 77 1.177 4.929 -1.884 442 HH2 TRP 77 HH TRP 77 2.729 4.507 -3.719 443 H ASN 78 H ASN 78 -3.939 5.213 -6.122 444 HA ASN 78 HA ASN 78 -5.511 3.539 -7.958 445 1HB ASN 78 2HB ASN 78 -4.364 6.321 -8.341 446 2HB ASN 78 1HB ASN 78 -5.171 5.412 -9.600 447 1HD2 ASN 78 1HD2 ASN 78 -6.763 6.912 -9.877 448 2HD2 ASN 78 2HD2 ASN 78 -8.006 7.222 -8.726 449 H TYR 79 H TYR 79 -4.489 2.328 -9.463 450 HA TYR 79 HA TYR 79 -1.672 2.870 -9.932 451 1HB TYR 79 2HB TYR 79 -1.048 0.516 -9.646 452 2HB TYR 79 1HB TYR 79 -1.687 1.176 -8.155 453 HD1 TYR 79 1HD TYR 79 -1.971 -1.389 -10.653 454 HD2 TYR 79 2HD TYR 79 -4.069 0.525 -7.485 455 HE1 TYR 79 1HE TYR 79 -3.508 -3.297 -10.529 456 HE2 TYR 79 2HE TYR 79 -5.611 -1.385 -7.352 457 HH TYR 79 HH TYR 79 -5.020 -4.349 -8.884 458 H VAL 80 H VAL 80 -0.935 2.244 -11.931 459 HA VAL 80 HA VAL 80 -3.064 1.481 -13.787 460 HB VAL 80 HB VAL 80 -0.434 2.888 -14.360 461 1HG1 VAL 80 1HG1 VAL 80 -1.344 3.238 -16.610 462 2HG1 VAL 80 2HG1 VAL 80 -2.769 2.293 -16.181 463 3HG1 VAL 80 3HG1 VAL 80 -1.187 1.518 -16.243 464 1HG2 VAL 80 1HG2 VAL 80 -1.842 4.850 -14.833 465 2HG2 VAL 80 2HG2 VAL 80 -1.972 4.318 -13.148 466 3HG2 VAL 80 3HG2 VAL 80 -3.248 3.918 -14.296 467 H HIS 81 H HIS 81 -2.952 -0.500 -14.451 468 HA HIS 81 HA HIS 81 -0.323 -1.799 -14.678 469 1HB HIS 81 2HB HIS 81 -1.318 -2.566 -12.563 470 2HB HIS 81 1HB HIS 81 -2.790 -3.035 -13.396 471 HD1 HIS 81 1HD HIS 81 0.894 -4.066 -13.135 472 HD2 HIS 81 2HD HIS 81 -2.777 -5.569 -14.360 473 HE1 HIS 81 1HE HIS 81 1.295 -6.456 -13.668 474 HE2 HIS 81 2HE HIS 81 -0.806 -7.125 -14.846 475 H ASP 82 H ASP 82 0.005 -2.529 -16.626 476 HA ASP 82 HA ASP 82 -0.257 -3.172 -18.767 477 1HB ASP 82 2HB ASP 82 -2.891 -4.288 -17.768 478 2HB ASP 82 1HB ASP 82 -2.325 -4.483 -19.420 479 H GLY 83 H GLY 83 -0.990 -0.625 -17.859 480 1HA GLY 83 2HA GLY 83 -1.610 1.301 -18.969 481 2HA GLY 83 1HA GLY 83 -2.269 0.302 -20.255 482 H GLU 84 H GLU 84 -3.625 -0.930 -17.563 483 HA GLU 84 HA GLU 84 -6.021 0.625 -18.042 484 1HB GLU 84 2HB GLU 84 -6.015 -1.865 -18.211 485 2HB GLU 84 1HB GLU 84 -5.684 -1.903 -16.472 486 1HG GLU 84 2HG GLU 84 -7.792 -0.977 -15.973 487 2HG GLU 84 1HG GLU 84 -8.111 -0.613 -17.670 488 H ALA 85 H ALA 85 -6.870 1.811 -16.598 489 HA ALA 85 HA ALA 85 -5.296 2.494 -14.258 490 1HB ALA 85 1HB ALA 85 -7.879 3.713 -15.257 491 2HB ALA 85 2HB ALA 85 -6.256 4.294 -15.634 492 3HB ALA 85 3HB ALA 85 -6.856 4.354 -13.978 493 H LYS 86 H LYS 86 -5.575 1.484 -12.427 494 HA LYS 86 HA LYS 86 -8.201 0.383 -11.869 495 1HB LYS 86 2HB LYS 86 -5.484 -0.816 -11.371 496 2HB LYS 86 1HB LYS 86 -6.986 -1.473 -10.732 497 1HG LYS 86 2HG LYS 86 -7.830 -1.825 -12.965 498 2HG LYS 86 1HG LYS 86 -6.400 -1.068 -13.650 499 1HD LYS 86 2HD LYS 86 -5.018 -2.818 -12.911 500 2HD LYS 86 1HD LYS 86 -6.328 -3.587 -11.972 501 1HE LYS 86 2HE LYS 86 -7.533 -3.842 -14.112 502 2HE LYS 86 1HE LYS 86 -6.131 -3.173 -14.933 503 1HZ LYS 86 1HZ LYS 86 -6.214 -5.704 -13.380 504 2HZ LYS 86 2HZ LYS 86 -4.822 -5.092 -14.092 505 3HZ LYS 86 3HZ LYS 86 -6.121 -5.578 -15.044 506 H VAL 87 H VAL 87 -8.605 0.149 -9.563 507 HA VAL 87 HA VAL 87 -7.070 1.998 -7.892 508 HB VAL 87 HB VAL 87 -10.101 1.663 -7.925 509 1HG1 VAL 87 1HG1 VAL 87 -8.399 3.489 -6.211 510 2HG1 VAL 87 2HG1 VAL 87 -9.278 2.070 -5.646 511 3HG1 VAL 87 3HG1 VAL 87 -10.160 3.467 -6.252 512 1HG2 VAL 87 1HG2 VAL 87 -8.393 4.021 -8.716 513 2HG2 VAL 87 2HG2 VAL 87 -10.153 4.019 -8.638 514 3HG2 VAL 87 3HG2 VAL 87 -9.322 2.993 -9.809 515 H ALA 88 H ALA 88 -6.802 1.356 -5.809 516 HA ALA 88 HA ALA 88 -7.536 -1.387 -5.170 517 1HB ALA 88 1HB ALA 88 -5.139 -0.958 -5.262 518 2HB ALA 88 2HB ALA 88 -5.649 -1.264 -3.600 519 3HB ALA 88 3HB ALA 88 -5.326 0.387 -4.140 520 H LYS 89 H LYS 89 -8.547 -1.714 -3.212 521 HA LYS 89 HA LYS 89 -9.492 0.745 -1.951 522 1HB LYS 89 2HB LYS 89 -11.017 -1.856 -2.120 523 2HB LYS 89 1HB LYS 89 -11.605 -0.353 -1.464 524 1HG LYS 89 2HG LYS 89 -12.678 -0.638 -3.581 525 2HG LYS 89 1HG LYS 89 -11.472 0.627 -3.805 526 1HD LYS 89 2HD LYS 89 -9.960 -0.980 -4.849 527 2HD LYS 89 1HD LYS 89 -11.080 -2.295 -4.587 528 1HE LYS 89 2HE LYS 89 -12.710 -1.127 -6.042 529 2HE LYS 89 1HE LYS 89 -11.506 0.123 -6.332 530 1HZ LYS 89 1HZ LYS 89 -11.178 -2.762 -7.041 531 2HZ LYS 89 2HZ LYS 89 -10.037 -1.551 -7.288 532 3HZ LYS 89 3HZ LYS 89 -11.484 -1.509 -8.121 533 H GLU 90 H GLU 90 -8.963 0.889 0.179 534 HA GLU 90 HA GLU 90 -8.480 -1.407 1.732 535 1HB GLU 90 2HB GLU 90 -6.139 -0.827 2.267 536 2HB GLU 90 1HB GLU 90 -6.350 -1.347 0.606 537 1HG GLU 90 2HG GLU 90 -6.346 1.537 1.319 538 2HG GLU 90 1HG GLU 90 -4.798 0.689 1.096 539 H ARG 91 H ARG 91 -7.683 -0.764 3.828 540 HA ARG 91 HA ARG 91 -8.399 1.930 4.688 541 1HB ARG 91 2HB ARG 91 -10.334 0.647 5.228 542 2HB ARG 91 1HB ARG 91 -9.367 -0.685 5.836 543 1HG ARG 91 2HG ARG 91 -8.662 0.671 7.726 544 2HG ARG 91 1HG ARG 91 -9.587 2.034 7.107 545 1HD ARG 91 2HD ARG 91 -11.643 0.863 7.419 546 2HD ARG 91 1HD ARG 91 -10.782 -0.633 7.796 547 HE ARG 91 HE ARG 91 -9.871 0.520 9.713 548 1HH1 ARG 91 1HH1 ARG 91 -12.988 1.664 8.396 549 2HH1 ARG 91 2HH1 ARG 91 -13.555 2.290 9.863 550 1HH2 ARG 91 1HH2 ARG 91 -10.698 1.388 11.763 551 2HH2 ARG 91 2HH2 ARG 91 -12.231 2.116 11.830 552 H ILE 92 H ILE 92 -7.026 2.692 6.390 553 HA ILE 92 HA ILE 92 -4.671 1.128 6.926 554 HB ILE 92 HB ILE 92 -5.585 3.870 7.802 555 1HG1 ILE 92 2HG1 ILE 92 -3.271 2.926 6.099 556 2HG1 ILE 92 1HG1 ILE 92 -4.747 3.684 5.525 557 1HG2 ILE 92 1HG2 ILE 92 -3.414 4.223 8.969 558 2HG2 ILE 92 2HG2 ILE 92 -3.078 2.497 8.805 559 3HG2 ILE 92 3HG2 ILE 92 -4.442 3.066 9.765 560 1HD1 ILE 92 1HD1 ILE 92 -2.653 5.008 7.253 561 2HD1 ILE 92 2HD1 ILE 92 -4.098 5.778 6.598 562 3HD1 ILE 92 3HD1 ILE 92 -2.845 5.205 5.511 563 H GLU 93 H GLU 93 -4.473 -0.264 8.435 564 HA GLU 93 HA GLU 93 -6.420 -0.349 10.628 565 1HB GLU 93 2HB GLU 93 -4.551 -2.411 9.526 566 2HB GLU 93 1HB GLU 93 -5.576 -2.674 10.936 567 1HG GLU 93 2HG GLU 93 -6.547 -2.013 8.160 568 2HG GLU 93 1HG GLU 93 -6.546 -3.614 8.904 569 H ALA 94 H ALA 94 -3.005 -0.287 9.939 570 HA ALA 94 HA ALA 94 -2.485 0.733 12.576 571 1HB ALA 94 1HB ALA 94 -0.712 -0.910 13.038 572 2HB ALA 94 2HB ALA 94 -1.161 -1.802 11.583 573 3HB ALA 94 3HB ALA 94 -2.293 -1.689 12.933 574 H VAL 95 H VAL 95 -0.780 2.100 12.497 575 HA VAL 95 HA VAL 95 1.043 1.922 10.284 576 HB VAL 95 HB VAL 95 -0.685 3.372 9.333 577 1HG1 VAL 95 1HG1 VAL 95 -0.283 5.159 11.718 578 2HG1 VAL 95 2HG1 VAL 95 -1.713 4.195 11.326 579 3HG1 VAL 95 3HG1 VAL 95 -1.250 5.546 10.289 580 1HG2 VAL 95 1HG2 VAL 95 1.613 3.878 8.727 581 2HG2 VAL 95 2HG2 VAL 95 1.762 4.959 10.112 582 3HG2 VAL 95 3HG2 VAL 95 0.659 5.359 8.794 583 H GLU 96 H GLU 96 2.995 2.307 10.900 584 HA GLU 96 HA GLU 96 3.371 3.701 13.462 585 1HB GLU 96 2HB GLU 96 3.966 1.150 13.397 586 2HB GLU 96 1HB GLU 96 5.241 1.632 12.298 587 1HG GLU 96 2HG GLU 96 5.968 1.271 14.402 588 2HG GLU 96 1HG GLU 96 6.293 2.931 13.908 589 HA PRO 97 HA PRO 97 5.305 6.423 10.379 590 1HB PRO 97 2HB PRO 97 5.731 8.039 12.829 591 2HB PRO 97 1HB PRO 97 4.996 8.509 11.292 592 1HG PRO 97 2HG PRO 97 3.495 8.132 13.459 593 2HG PRO 97 1HG PRO 97 2.932 7.622 11.858 594 1HD PRO 97 2HD PRO 97 4.052 5.967 14.083 595 2HD PRO 97 1HD PRO 97 2.718 5.619 12.968 596 H ASP 98 H ASP 98 6.499 5.363 13.465 597 HA ASP 98 HA ASP 98 9.201 6.270 13.004 598 1HB ASP 98 2HB ASP 98 8.394 6.227 15.281 599 2HB ASP 98 1HB ASP 98 8.058 4.508 15.167 600 H LYS 99 H LYS 99 7.483 3.260 12.699 601 HA LYS 99 HA LYS 99 9.939 1.793 12.199 602 1HB LYS 99 2HB LYS 99 7.097 0.842 12.142 603 2HB LYS 99 1HB LYS 99 8.544 -0.121 11.926 604 1HG LYS 99 2HG LYS 99 9.273 0.467 14.103 605 2HG LYS 99 1HG LYS 99 7.804 1.348 14.425 606 1HD LYS 99 2HD LYS 99 6.534 -0.715 13.853 607 2HD LYS 99 1HD LYS 99 8.088 -1.530 13.698 608 1HE LYS 99 2HE LYS 99 7.145 -2.020 15.876 609 2HE LYS 99 1HE LYS 99 8.586 -1.006 16.036 610 1HZ LYS 99 1HZ LYS 99 7.140 0.909 16.385 611 2HZ LYS 99 2HZ LYS 99 6.781 -0.312 17.486 612 3HZ LYS 99 3HZ LYS 99 5.774 -0.074 16.164 613 H ASN 100 H ASN 100 7.903 3.727 10.433 614 HA ASN 100 HA ASN 100 7.397 4.008 8.227 615 1HB ASN 100 2HB ASN 100 9.791 2.177 7.926 616 2HB ASN 100 1HB ASN 100 8.972 2.915 6.561 617 1HD2 ASN 100 1HD2 ASN 100 10.846 3.910 6.003 618 2HD2 ASN 100 2HD2 ASN 100 11.467 5.317 6.797 619 H LEU 101 H LEU 101 5.868 2.292 9.579 620 HA LEU 101 HA LEU 101 5.382 0.044 7.753 621 1HB LEU 101 2HB LEU 101 6.114 -0.933 9.789 622 2HB LEU 101 1HB LEU 101 5.181 0.177 10.755 623 HG LEU 101 HG LEU 101 3.755 -1.871 9.025 624 1HD1 LEU 101 1HD1 LEU 101 4.741 -2.228 11.835 625 2HD1 LEU 101 2HD1 LEU 101 5.345 -3.117 10.407 626 3HD1 LEU 101 3HD1 LEU 101 3.656 -3.283 10.906 627 1HD2 LEU 101 1HD2 LEU 101 2.034 -1.673 10.751 628 2HD2 LEU 101 2HD2 LEU 101 2.414 -0.090 10.065 629 3HD2 LEU 101 3HD2 LEU 101 3.053 -0.538 11.646 630 H ILE 102 H ILE 102 3.412 -0.292 7.044 631 HA ILE 102 HA ILE 102 1.180 0.956 8.314 632 HB ILE 102 HB ILE 102 1.796 2.725 6.866 633 1HG1 ILE 102 2HG1 ILE 102 -0.525 1.248 5.605 634 2HG1 ILE 102 1HG1 ILE 102 -0.615 2.287 7.021 635 1HG2 ILE 102 1HG2 ILE 102 2.024 2.491 4.405 636 2HG2 ILE 102 2HG2 ILE 102 1.869 0.751 4.593 637 3HG2 ILE 102 3HG2 ILE 102 3.237 1.585 5.302 638 1HD1 ILE 102 1HD1 ILE 102 0.136 3.154 4.237 639 2HD1 ILE 102 2HD1 ILE 102 0.042 4.203 5.653 640 3HD1 ILE 102 3HD1 ILE 102 -1.414 3.430 5.029 641 H THR 103 H THR 103 -0.338 -0.423 8.462 642 HA THR 103 HA THR 103 -0.447 -2.804 6.787 643 HB THR 103 HB THR 103 -1.944 -2.043 9.304 644 HG1 THR 103 1HG THR 103 0.211 -3.838 8.892 645 1HG2 THR 103 1HG2 THR 103 -2.521 -4.419 9.440 646 2HG2 THR 103 2HG2 THR 103 -1.710 -4.708 7.899 647 3HG2 THR 103 3HG2 THR 103 -3.152 -3.694 7.960 648 H PHE 104 H PHE 104 -1.801 -2.911 5.117 649 HA PHE 104 HA PHE 104 -4.103 -1.103 4.844 650 1HB PHE 104 2HB PHE 104 -2.597 -2.803 2.855 651 2HB PHE 104 1HB PHE 104 -3.958 -1.847 2.375 652 HD1 PHE 104 1HD PHE 104 -3.707 0.725 2.834 653 HD2 PHE 104 2HD PHE 104 -0.482 -2.036 2.691 654 HE1 PHE 104 1HE PHE 104 -2.155 2.566 2.301 655 HE2 PHE 104 2HE PHE 104 1.066 -0.214 2.165 656 HZ PHE 104 HZ PHE 104 0.246 2.080 1.967 657 H ARG 105 H ARG 105 -6.068 -1.966 4.998 658 HA ARG 105 HA ARG 105 -6.433 -4.899 4.814 659 1HB ARG 105 2HB ARG 105 -7.167 -4.022 6.931 660 2HB ARG 105 1HB ARG 105 -8.097 -2.754 6.135 661 1HG ARG 105 2HG ARG 105 -9.474 -4.563 5.078 662 2HG ARG 105 1HG ARG 105 -8.640 -5.708 6.126 663 1HD ARG 105 2HD ARG 105 -9.505 -4.608 8.085 664 2HD ARG 105 1HD ARG 105 -10.197 -3.324 7.086 665 HE ARG 105 HE ARG 105 -11.142 -5.831 6.248 666 1HH1 ARG 105 1HH1 ARG 105 -11.607 -3.528 8.912 667 2HH1 ARG 105 2HH1 ARG 105 -13.218 -3.952 9.167 668 1HH2 ARG 105 1HH2 ARG 105 -13.331 -6.366 6.560 669 2HH2 ARG 105 2HH2 ARG 105 -14.255 -5.645 7.782 670 H VAL 106 H VAL 106 -7.498 -5.593 2.992 671 HA VAL 106 HA VAL 106 -8.804 -3.627 1.351 672 HB VAL 106 HB VAL 106 -8.509 -6.636 0.999 673 1HG1 VAL 106 1HG1 VAL 106 -9.407 -6.295 -1.247 674 2HG1 VAL 106 2HG1 VAL 106 -9.728 -4.601 -0.883 675 3HG1 VAL 106 3HG1 VAL 106 -10.615 -5.867 -0.030 676 1HG2 VAL 106 1HG2 VAL 106 -6.470 -5.329 0.705 677 2HG2 VAL 106 2HG2 VAL 106 -7.307 -4.278 -0.437 678 3HG2 VAL 106 3HG2 VAL 106 -7.034 -5.968 -0.842 679 H ILE 107 H ILE 107 -10.831 -3.127 1.355 680 HA ILE 107 HA ILE 107 -12.542 -4.523 3.326 681 HB ILE 107 HB ILE 107 -13.624 -2.454 3.869 682 1HG1 ILE 107 2HG1 ILE 107 -13.592 -1.414 1.514 683 2HG1 ILE 107 1HG1 ILE 107 -13.186 -0.308 2.819 684 1HG2 ILE 107 1HG2 ILE 107 -11.767 -1.142 4.757 685 2HG2 ILE 107 2HG2 ILE 107 -10.681 -1.927 3.617 686 3HG2 ILE 107 3HG2 ILE 107 -11.417 -2.875 4.919 687 1HD1 ILE 107 1HD1 ILE 107 -11.877 0.064 0.909 688 2HD1 ILE 107 2HD1 ILE 107 -11.353 -1.612 0.851 689 3HD1 ILE 107 3HD1 ILE 107 -10.843 -0.572 2.187 690 H GLU 108 H GLU 108 -12.367 -3.654 0.090 691 HA GLU 108 HA GLU 108 -14.942 -3.038 -0.390 692 1HB GLU 108 2HB GLU 108 -14.481 -3.475 -2.852 693 2HB GLU 108 1HB GLU 108 -13.688 -2.192 -1.969 694 1HG GLU 108 2HG GLU 108 -12.101 -3.083 -3.200 695 2HG GLU 108 1HG GLU 108 -11.837 -3.768 -1.590 696 H GLY 109 H GLY 109 -13.872 -6.150 -1.814 697 1HA GLY 109 2HA GLY 109 -15.729 -7.845 -0.880 698 2HA GLY 109 1HA GLY 109 -16.665 -6.871 -2.000 699 H ASP 110 H ASP 110 -14.668 -6.449 -3.935 700 HA ASP 110 HA ASP 110 -14.974 -8.804 -5.504 701 1HB ASP 110 2HB ASP 110 -15.021 -6.648 -6.577 702 2HB ASP 110 1HB ASP 110 -13.423 -6.255 -5.967 703 H LEU 111 H LEU 111 -12.111 -7.351 -3.951 704 HA LEU 111 HA LEU 111 -10.411 -9.577 -4.672 705 1HB LEU 111 2HB LEU 111 -10.128 -7.358 -2.674 706 2HB LEU 111 1HB LEU 111 -8.906 -8.608 -2.825 707 HG LEU 111 HG LEU 111 -9.705 -6.685 -5.032 708 1HD1 LEU 111 1HD1 LEU 111 -7.545 -5.631 -4.594 709 2HD1 LEU 111 2HD1 LEU 111 -7.268 -6.733 -3.244 710 3HD1 LEU 111 3HD1 LEU 111 -8.572 -5.545 -3.162 711 1HD2 LEU 111 1HD2 LEU 111 -8.839 -8.841 -5.842 712 2HD2 LEU 111 2HD2 LEU 111 -7.428 -8.649 -4.797 713 3HD2 LEU 111 3HD2 LEU 111 -7.692 -7.530 -6.131 714 H MET 112 H MET 112 -12.589 -8.827 -2.224 715 HA MET 112 HA MET 112 -11.837 -10.820 -0.328 716 1HB MET 112 2HB MET 112 -14.458 -9.398 -0.741 717 2HB MET 112 1HB MET 112 -14.114 -10.445 0.617 718 1HG MET 112 2HG MET 112 -12.397 -8.037 0.087 719 2HG MET 112 1HG MET 112 -13.948 -7.849 0.881 720 1HE MET 112 1HE MET 112 -11.290 -10.905 1.497 721 2HE MET 112 2HE MET 112 -10.377 -10.169 2.770 722 3HE MET 112 3HE MET 112 -10.298 -9.459 1.163 723 H LYS 113 H LYS 113 -13.157 -11.085 -3.386 724 HA LYS 113 HA LYS 113 -14.676 -13.497 -2.826 725 1HB LYS 113 2HB LYS 113 -13.989 -12.209 -5.476 726 2HB LYS 113 1HB LYS 113 -15.043 -13.597 -5.272 727 1HG LYS 113 2HG LYS 113 -15.531 -10.803 -4.257 728 2HG LYS 113 1HG LYS 113 -16.347 -11.594 -5.605 729 1HD LYS 113 2HD LYS 113 -17.266 -13.262 -4.068 730 2HD LYS 113 1HD LYS 113 -16.441 -12.480 -2.720 731 1HE LYS 113 2HE LYS 113 -17.725 -10.435 -3.159 732 2HE LYS 113 1HE LYS 113 -18.575 -11.273 -4.457 733 1HZ LYS 113 1HZ LYS 113 -18.588 -12.056 -1.606 734 2HZ LYS 113 2HZ LYS 113 -19.438 -12.847 -2.816 735 3HZ LYS 113 3HZ LYS 113 -19.835 -11.265 -2.387 736 H GLU 114 H GLU 114 -11.506 -12.706 -3.265 737 HA GLU 114 HA GLU 114 -10.860 -15.423 -4.181 738 1HB GLU 114 2HB GLU 114 -9.102 -12.955 -4.065 739 2HB GLU 114 1HB GLU 114 -8.549 -14.546 -4.566 740 1HG GLU 114 2HG GLU 114 -10.131 -14.498 -6.434 741 2HG GLU 114 1HG GLU 114 -10.665 -12.902 -5.921 742 H TYR 115 H TYR 115 -10.592 -13.149 -1.592 743 HA TYR 115 HA TYR 115 -9.351 -15.203 0.098 744 1HB TYR 115 2HB TYR 115 -8.804 -12.232 0.215 745 2HB TYR 115 1HB TYR 115 -8.040 -13.488 1.188 746 HD1 TYR 115 1HD TYR 115 -7.958 -11.638 -1.878 747 HD2 TYR 115 2HD TYR 115 -6.588 -15.187 0.013 748 HE1 TYR 115 1HE TYR 115 -6.254 -11.892 -3.618 749 HE2 TYR 115 2HE TYR 115 -4.873 -15.445 -1.715 750 HH TYR 115 HH TYR 115 -4.117 -13.000 -3.948 751 H LYS 116 H LYS 116 -10.309 -15.378 2.078 752 HA LYS 116 HA LYS 116 -12.883 -14.108 2.438 753 1HB LYS 116 2HB LYS 116 -11.381 -15.856 4.439 754 2HB LYS 116 1HB LYS 116 -13.109 -15.466 4.384 755 1HG LYS 116 2HG LYS 116 -13.357 -16.722 2.369 756 2HG LYS 116 1HG LYS 116 -11.607 -17.052 2.387 757 1HD LYS 116 2HD LYS 116 -12.919 -18.929 3.178 758 2HD LYS 116 1HD LYS 116 -11.851 -18.308 4.444 759 1HE LYS 116 2HE LYS 116 -13.787 -17.099 5.413 760 2HE LYS 116 1HE LYS 116 -14.818 -17.776 4.152 761 1HZ LYS 116 1HZ LYS 116 -15.027 -19.056 6.156 762 2HZ LYS 116 2HZ LYS 116 -13.357 -19.306 6.237 763 3HZ LYS 116 3HZ LYS 116 -14.258 -19.985 4.996 764 H SER 117 H SER 117 -9.696 -13.480 3.218 765 HA SER 117 HA SER 117 -10.288 -11.002 4.452 766 1HB SER 117 2HB SER 117 -10.413 -12.478 6.311 767 2HB SER 117 1HB SER 117 -8.813 -13.160 5.947 768 HG SER 117 HG SER 117 -8.680 -11.605 7.575 769 H PHE 118 H PHE 118 -8.530 -9.645 4.022 770 HA PHE 118 HA PHE 118 -6.078 -10.849 3.126 771 1HB PHE 118 2HB PHE 118 -7.372 -10.741 1.053 772 2HB PHE 118 1HB PHE 118 -7.731 -9.041 1.333 773 HD1 PHE 118 1HD PHE 118 -4.946 -11.413 0.722 774 HD2 PHE 118 2HD PHE 118 -6.310 -7.414 0.488 775 HE1 PHE 118 1HE PHE 118 -2.928 -10.808 -0.521 776 HE2 PHE 118 2HE PHE 118 -4.293 -6.787 -0.764 777 HZ PHE 118 HZ PHE 118 -2.599 -8.474 -1.272 778 H LEU 119 H LEU 119 -4.596 -9.867 4.295 779 HA LEU 119 HA LEU 119 -4.875 -7.001 4.769 780 1HB LEU 119 2HB LEU 119 -5.448 -8.494 6.723 781 2HB LEU 119 1HB LEU 119 -3.811 -9.103 6.657 782 HG LEU 119 HG LEU 119 -3.003 -6.787 7.129 783 1HD1 LEU 119 1HD1 LEU 119 -4.635 -5.194 8.032 784 2HD1 LEU 119 2HD1 LEU 119 -5.939 -6.272 7.551 785 3HD1 LEU 119 3HD1 LEU 119 -4.901 -5.531 6.326 786 1HD2 LEU 119 1HD2 LEU 119 -3.609 -6.836 9.498 787 2HD2 LEU 119 2HD2 LEU 119 -3.204 -8.445 8.903 788 3HD2 LEU 119 3HD2 LEU 119 -4.891 -7.995 9.145 789 H LEU 120 H LEU 120 -2.964 -5.893 4.388 790 HA LEU 120 HA LEU 120 -0.534 -7.453 4.162 791 1HB LEU 120 2HB LEU 120 0.173 -6.406 2.084 792 2HB LEU 120 1HB LEU 120 -1.298 -7.316 1.849 793 HG LEU 120 HG LEU 120 -1.159 -4.292 2.063 794 1HD1 LEU 120 1HD1 LEU 120 -1.470 -4.293 -0.345 795 2HD1 LEU 120 2HD1 LEU 120 -1.402 -6.057 -0.368 796 3HD1 LEU 120 3HD1 LEU 120 0.020 -5.125 0.099 797 1HD2 LEU 120 1HD2 LEU 120 -3.359 -5.216 2.656 798 2HD2 LEU 120 2HD2 LEU 120 -3.384 -6.128 1.148 799 3HD2 LEU 120 3HD2 LEU 120 -3.422 -4.365 1.113 800 H THR 121 H THR 121 1.232 -6.474 4.819 801 HA THR 121 HA THR 121 0.970 -3.673 5.681 802 HB THR 121 HB THR 121 2.462 -5.926 7.049 803 HG1 THR 121 1HG THR 121 0.010 -5.601 7.047 804 1HG2 THR 121 1HG2 THR 121 3.516 -3.718 7.370 805 2HG2 THR 121 2HG2 THR 121 2.785 -4.295 8.868 806 3HG2 THR 121 3HG2 THR 121 1.973 -3.063 7.905 807 H ILE 122 H ILE 122 2.608 -2.357 5.045 808 HA ILE 122 HA ILE 122 4.950 -3.673 3.887 809 HB ILE 122 HB ILE 122 5.307 -1.691 2.483 810 1HG1 ILE 122 2HG1 ILE 122 2.603 -0.780 3.419 811 2HG1 ILE 122 1HG1 ILE 122 4.136 -0.054 3.891 812 1HG2 ILE 122 1HG2 ILE 122 4.103 -3.570 1.531 813 2HG2 ILE 122 2HG2 ILE 122 3.460 -2.049 0.898 814 3HG2 ILE 122 3HG2 ILE 122 2.580 -2.923 2.149 815 1HD1 ILE 122 1HD1 ILE 122 3.024 -0.149 1.085 816 2HD1 ILE 122 2HD1 ILE 122 4.560 0.572 1.561 817 3HD1 ILE 122 3HD1 ILE 122 3.046 1.260 2.147 818 H GLN 123 H GLN 123 6.899 -2.977 4.494 819 HA GLN 123 HA GLN 123 7.017 -0.709 6.311 820 1HB GLN 123 2HB GLN 123 6.730 -2.834 7.618 821 2HB GLN 123 1HB GLN 123 8.257 -3.381 6.949 822 1HG GLN 123 2HG GLN 123 9.426 -1.599 8.022 823 2HG GLN 123 1HG GLN 123 7.915 -0.883 8.577 824 1HE2 GLN 123 1HE2 GLN 123 8.339 -1.010 10.652 825 2HE2 GLN 123 2HE2 GLN 123 8.468 -2.443 11.595 826 H VAL 124 H VAL 124 8.553 0.563 5.722 827 HA VAL 124 HA VAL 124 10.564 -0.384 3.816 828 HB VAL 124 HB VAL 124 9.657 2.425 4.487 829 1HG1 VAL 124 1HG1 VAL 124 11.016 3.130 2.570 830 2HG1 VAL 124 2HG1 VAL 124 11.633 1.479 2.417 831 3HG1 VAL 124 3HG1 VAL 124 12.001 2.429 3.855 832 1HG2 VAL 124 1HG2 VAL 124 8.010 1.136 3.247 833 2HG2 VAL 124 2HG2 VAL 124 9.229 0.717 2.045 834 3HG2 VAL 124 3HG2 VAL 124 8.712 2.393 2.229 835 H THR 125 H THR 125 12.451 -0.926 4.645 836 HA THR 125 HA THR 125 13.657 0.854 6.586 837 HB THR 125 HB THR 125 12.523 -1.173 7.766 838 HG1 THR 125 1HG THR 125 13.983 -0.207 8.974 839 1HG2 THR 125 1HG2 THR 125 13.202 -2.881 6.092 840 2HG2 THR 125 2HG2 THR 125 13.753 -3.285 7.730 841 3HG2 THR 125 3HG2 THR 125 14.880 -2.591 6.571 842 HA PRO 126 HA PRO 126 17.222 0.397 3.889 843 1HB PRO 126 2HB PRO 126 19.253 0.249 5.706 844 2HB PRO 126 1HB PRO 126 18.411 1.754 5.306 845 1HG PRO 126 2HG PRO 126 17.820 -0.176 7.530 846 2HG PRO 126 1HG PRO 126 18.102 1.587 7.664 847 1HD PRO 126 2HD PRO 126 15.669 0.671 7.667 848 2HD PRO 126 1HD PRO 126 16.048 2.035 6.587 849 H LYS 127 H LYS 127 18.837 -1.051 3.190 850 HA LYS 127 HA LYS 127 19.119 -3.608 4.535 851 1HB LYS 127 2HB LYS 127 17.251 -3.997 3.064 852 2HB LYS 127 1HB LYS 127 18.102 -3.362 1.690 853 1HG LYS 127 2HG LYS 127 19.620 -5.313 1.766 854 2HG LYS 127 1HG LYS 127 18.702 -5.938 3.144 855 1HD LYS 127 2HD LYS 127 16.668 -6.004 1.805 856 2HD LYS 127 1HD LYS 127 17.492 -5.319 0.427 857 1HE LYS 127 2HE LYS 127 18.939 -7.325 0.332 858 2HE LYS 127 1HE LYS 127 18.065 -8.002 1.705 859 1HZ LYS 127 1HZ LYS 127 17.235 -8.888 -0.387 860 2HZ LYS 127 2HZ LYS 127 16.868 -7.360 -0.958 861 3HZ LYS 127 3HZ LYS 127 16.019 -7.991 0.345 862 HA PRO 128 HA PRO 128 22.805 -3.046 1.309 863 1HB PRO 128 2HB PRO 128 22.507 -0.129 0.784 864 2HB PRO 128 1HB PRO 128 23.034 -1.409 -0.317 865 1HG PRO 128 2HG PRO 128 20.627 -0.348 -0.580 866 2HG PRO 128 1HG PRO 128 20.858 -2.097 -0.762 867 1HD PRO 128 2HD PRO 128 19.751 -0.564 1.557 868 2HD PRO 128 1HD PRO 128 19.210 -2.094 0.839 869 H GLY 129 H GLY 129 21.695 -0.341 3.275 870 1HA GLY 129 2HA GLY 129 23.312 -0.654 5.410 871 2HA GLY 129 1HA GLY 129 24.298 0.278 4.289 872 H GLY 130 H GLY 130 24.102 2.384 4.381 873 1HA GLY 130 2HA GLY 130 22.208 3.656 6.109 874 2HA GLY 130 1HA GLY 130 23.334 4.460 5.017 875 HA PRO 131 HA PRO 131 19.950 5.247 2.285 876 1HB PRO 131 2HB PRO 131 21.186 5.374 -0.115 877 2HB PRO 131 1HB PRO 131 21.425 6.616 1.118 878 1HG PRO 131 2HG PRO 131 23.185 4.315 0.383 879 2HG PRO 131 1HG PRO 131 23.632 5.985 0.785 880 1HD PRO 131 2HD PRO 131 23.789 3.883 2.533 881 2HD PRO 131 1HD PRO 131 23.584 5.574 3.030 882 H GLY 132 H GLY 132 18.781 4.327 0.444 883 1HA GLY 132 2HA GLY 132 18.166 2.578 -0.973 884 2HA GLY 132 1HA GLY 132 19.506 1.623 -0.336 885 H SER 133 H SER 133 16.178 2.238 -0.149 886 HA SER 133 HA SER 133 16.092 0.651 2.276 887 1HB SER 133 2HB SER 133 13.874 1.696 2.699 888 2HB SER 133 1HB SER 133 15.213 2.836 2.732 889 HG SER 133 HG SER 133 14.627 3.527 0.664 890 H ILE 134 H ILE 134 14.412 -0.853 2.480 891 HA ILE 134 HA ILE 134 13.609 -1.921 -0.116 892 HB ILE 134 HB ILE 134 14.243 -3.340 2.459 893 1HG1 ILE 134 2HG1 ILE 134 16.151 -2.493 1.324 894 2HG1 ILE 134 1HG1 ILE 134 16.043 -4.262 1.211 895 1HG2 ILE 134 1HG2 ILE 134 13.952 -5.413 1.193 896 2HG2 ILE 134 2HG2 ILE 134 13.403 -4.488 -0.208 897 3HG2 ILE 134 3HG2 ILE 134 12.443 -4.502 1.273 898 1HD1 ILE 134 1HD1 ILE 134 15.444 -2.256 -0.934 899 2HD1 ILE 134 2HD1 ILE 134 15.244 -4.011 -1.088 900 3HD1 ILE 134 3HD1 ILE 134 16.845 -3.305 -0.850 901 H VAL 135 H VAL 135 11.490 -2.294 -0.214 902 HA VAL 135 HA VAL 135 9.896 -1.745 2.155 903 HB VAL 135 HB VAL 135 9.165 -0.432 0.205 904 1HG1 VAL 135 1HG1 VAL 135 8.616 -3.022 -1.157 905 2HG1 VAL 135 2HG1 VAL 135 9.888 -1.873 -1.584 906 3HG1 VAL 135 3HG1 VAL 135 8.186 -1.426 -1.769 907 1HG2 VAL 135 1HG2 VAL 135 7.162 -2.562 0.913 908 2HG2 VAL 135 2HG2 VAL 135 6.783 -1.010 0.166 909 3HG2 VAL 135 3HG2 VAL 135 7.454 -1.062 1.796 910 H HIS 136 H HIS 136 9.377 -3.309 3.336 911 HA HIS 136 HA HIS 136 9.445 -6.026 2.309 912 1HB HIS 136 2HB HIS 136 9.114 -4.939 5.115 913 2HB HIS 136 1HB HIS 136 9.100 -6.650 4.717 914 HD1 HIS 136 1HD HIS 136 11.278 -7.741 5.082 915 HD2 HIS 136 2HD HIS 136 11.729 -3.697 4.249 916 HE1 HIS 136 1HE HIS 136 13.739 -7.275 5.289 917 HE2 HIS 136 2HE HIS 136 13.988 -4.836 4.877 918 H TRP 137 H TRP 137 7.645 -6.706 1.386 919 HA TRP 137 HA TRP 137 5.099 -5.712 2.348 920 1HB TRP 137 2HB TRP 137 5.795 -7.552 0.052 921 2HB TRP 137 1HB TRP 137 4.193 -7.019 0.487 922 HD1 TRP 137 HD TRP 137 7.537 -5.309 -0.598 923 HE1 TRP 137 1HE TRP 137 6.889 -3.313 -2.050 924 HE3 TRP 137 3HE TRP 137 2.447 -5.638 -0.243 925 HZ2 TRP 137 2HZ TRP 137 4.653 -2.052 -2.899 926 HZ3 TRP 137 3HZ TRP 137 1.095 -3.967 -1.419 927 HH2 TRP 137 HH TRP 137 2.128 -2.207 -2.719 928 H HIS 138 H HIS 138 4.122 -6.800 3.858 929 HA HIS 138 HA HIS 138 4.600 -9.673 4.004 930 1HB HIS 138 2HB HIS 138 5.563 -8.403 5.909 931 2HB HIS 138 1HB HIS 138 3.993 -7.672 6.195 932 HD1 HIS 138 1HD HIS 138 5.973 -10.774 6.717 933 HD2 HIS 138 2HD HIS 138 2.174 -9.287 7.416 934 HE1 HIS 138 1HE HIS 138 4.958 -12.361 8.360 935 HE2 HIS 138 2HE HIS 138 2.683 -11.369 8.912 936 H LEU 139 H LEU 139 2.844 -10.570 3.144 937 HA LEU 139 HA LEU 139 0.248 -9.298 3.605 938 1HB LEU 139 2HB LEU 139 1.048 -11.196 1.384 939 2HB LEU 139 1HB LEU 139 -0.520 -10.465 1.588 940 HG LEU 139 HG LEU 139 0.667 -8.223 1.162 941 1HD1 LEU 139 1HD1 LEU 139 2.939 -8.872 1.498 942 2HD1 LEU 139 2HD1 LEU 139 2.692 -8.293 -0.158 943 3HD1 LEU 139 3HD1 LEU 139 2.834 -10.018 0.159 944 1HD2 LEU 139 1HD2 LEU 139 0.525 -10.262 -1.045 945 2HD2 LEU 139 2HD2 LEU 139 0.560 -8.512 -1.261 946 3HD2 LEU 139 3HD2 LEU 139 -0.807 -9.273 -0.453 947 H GLU 140 H GLU 140 -1.253 -10.519 4.587 948 HA GLU 140 HA GLU 140 -0.891 -13.371 4.607 949 1HB GLU 140 2HB GLU 140 0.152 -12.421 6.713 950 2HB GLU 140 1HB GLU 140 -1.459 -11.857 7.141 951 1HG GLU 140 2HG GLU 140 -2.264 -14.188 7.058 952 2HG GLU 140 1HG GLU 140 -0.607 -14.688 6.697 953 H TYR 141 H TYR 141 -2.766 -14.360 4.394 954 HA TYR 141 HA TYR 141 -5.227 -12.881 4.635 955 1HB TYR 141 2HB TYR 141 -5.692 -13.250 2.167 956 2HB TYR 141 1HB TYR 141 -4.504 -12.013 2.580 957 HD1 TYR 141 1HD TYR 141 -2.353 -12.059 1.647 958 HD2 TYR 141 2HD TYR 141 -4.769 -15.547 1.498 959 HE1 TYR 141 1HE TYR 141 -0.676 -13.143 0.259 960 HE2 TYR 141 2HE TYR 141 -3.122 -16.638 0.101 961 HH TYR 141 HH TYR 141 0.014 -15.467 -0.339 962 H GLU 142 H GLU 142 -7.035 -14.256 3.920 963 HA GLU 142 HA GLU 142 -6.333 -17.067 4.327 964 1HB GLU 142 2HB GLU 142 -7.657 -16.124 6.174 965 2HB GLU 142 1HB GLU 142 -8.911 -15.661 5.037 966 1HG GLU 142 2HG GLU 142 -9.386 -17.973 4.551 967 2HG GLU 142 1HG GLU 142 -8.045 -18.493 5.573 968 H LYS 143 H LYS 143 -6.535 -18.266 2.591 969 HA LYS 143 HA LYS 143 -7.708 -17.246 0.239 970 1HB LYS 143 2HB LYS 143 -6.681 -20.004 0.905 971 2HB LYS 143 1HB LYS 143 -7.095 -19.440 -0.711 972 1HG LYS 143 2HG LYS 143 -5.415 -17.687 -0.522 973 2HG LYS 143 1HG LYS 143 -4.977 -18.292 1.072 974 1HD LYS 143 2HD LYS 143 -4.278 -20.409 0.083 975 2HD LYS 143 1HD LYS 143 -4.755 -19.822 -1.519 976 1HE LYS 143 2HE LYS 143 -3.257 -17.990 -1.313 977 2HE LYS 143 1HE LYS 143 -2.746 -18.546 0.284 978 1HZ LYS 143 1HZ LYS 143 -1.118 -19.213 -1.356 979 2HZ LYS 143 2HZ LYS 143 -2.274 -19.976 -2.306 980 3HZ LYS 143 3HZ LYS 143 -1.896 -20.579 -0.772 981 H ILE 144 H ILE 144 -9.849 -17.679 -0.469 982 HA ILE 144 HA ILE 144 -11.620 -18.954 1.381 983 HB ILE 144 HB ILE 144 -12.288 -18.504 -1.549 984 1HG1 ILE 144 2HG1 ILE 144 -12.321 -16.508 0.737 985 2HG1 ILE 144 1HG1 ILE 144 -11.470 -16.392 -0.784 986 1HG2 ILE 144 1HG2 ILE 144 -13.935 -18.546 0.975 987 2HG2 ILE 144 2HG2 ILE 144 -13.853 -19.853 -0.222 988 3HG2 ILE 144 3HG2 ILE 144 -14.577 -18.293 -0.657 989 1HD1 ILE 144 1HD1 ILE 144 -13.395 -14.952 -0.667 990 2HD1 ILE 144 2HD1 ILE 144 -14.408 -16.367 -0.396 991 3HD1 ILE 144 3HD1 ILE 144 -13.569 -16.167 -1.956 992 H SER 145 H SER 145 -10.061 -19.787 -1.562 993 HA SER 145 HA SER 145 -9.914 -22.477 -0.798 994 1HB SER 145 2HB SER 145 -12.158 -22.382 -1.907 995 2HB SER 145 1HB SER 145 -11.398 -21.772 -3.364 996 HG SER 145 HG SER 145 -10.394 -24.187 -2.283 997 H GLU 146 H GLU 146 -8.568 -23.565 -2.427 998 HA GLU 146 HA GLU 146 -6.104 -22.385 -2.470 999 1HB GLU 146 2HB GLU 146 -6.932 -24.516 -4.394 1000 2HB GLU 146 1HB GLU 146 -5.327 -24.246 -3.741 1001 1HG GLU 146 2HG GLU 146 -6.086 -26.131 -2.583 1002 2HG GLU 146 1HG GLU 146 -6.394 -24.817 -1.455 1003 H GLU 147 H GLU 147 -7.868 -23.215 -5.429 1004 HA GLU 147 HA GLU 147 -6.155 -21.587 -7.021 1005 1HB GLU 147 2HB GLU 147 -8.553 -23.236 -7.785 1006 2HB GLU 147 1HB GLU 147 -7.484 -22.418 -8.920 1007 1HG GLU 147 2HG GLU 147 -5.601 -23.733 -8.067 1008 2HG GLU 147 1HG GLU 147 -6.708 -24.578 -6.992 1009 H VAL 148 H VAL 148 -8.974 -21.110 -5.402 1010 HA VAL 148 HA VAL 148 -10.071 -19.060 -7.097 1011 HB VAL 148 HB VAL 148 -10.613 -19.583 -4.147 1012 1HG1 VAL 148 1HG1 VAL 148 -12.238 -18.037 -6.171 1013 2HG1 VAL 148 2HG1 VAL 148 -11.335 -17.355 -4.819 1014 3HG1 VAL 148 3HG1 VAL 148 -12.729 -18.391 -4.512 1015 1HG2 VAL 148 1HG2 VAL 148 -12.076 -20.570 -6.589 1016 2HG2 VAL 148 2HG2 VAL 148 -12.600 -20.796 -4.920 1017 3HG2 VAL 148 3HG2 VAL 148 -11.101 -21.538 -5.482 1018 H ALA 149 H ALA 149 -7.687 -19.268 -4.617 1019 HA ALA 149 HA ALA 149 -7.430 -16.381 -4.369 1020 1HB ALA 149 1HB ALA 149 -7.160 -17.736 -2.372 1021 2HB ALA 149 2HB ALA 149 -5.625 -16.965 -2.810 1022 3HB ALA 149 3HB ALA 149 -5.891 -18.667 -3.170 1023 H HIS 150 H HIS 150 -5.542 -15.271 -5.156 1024 HA HIS 150 HA HIS 150 -3.842 -16.897 -6.845 1025 1HB HIS 150 2HB HIS 150 -5.290 -14.427 -7.800 1026 2HB HIS 150 1HB HIS 150 -3.902 -15.114 -8.639 1027 HD1 HIS 150 1HD HIS 150 -4.272 -17.277 -9.964 1028 HD2 HIS 150 2HD HIS 150 -7.639 -15.991 -7.920 1029 HE1 HIS 150 1HE HIS 150 -6.141 -18.699 -10.800 1030 HE2 HIS 150 2HE HIS 150 -7.902 -18.240 -9.116 1031 HA PRO 151 HA PRO 151 -1.094 -14.537 -4.145 1032 1HB PRO 151 2HB PRO 151 0.717 -16.686 -5.079 1033 2HB PRO 151 1HB PRO 151 0.380 -16.137 -3.435 1034 1HG PRO 151 2HG PRO 151 -0.600 -18.451 -4.331 1035 2HG PRO 151 1HG PRO 151 -1.549 -17.407 -3.259 1036 1HD PRO 151 2HD PRO 151 -1.784 -17.798 -6.215 1037 2HD PRO 151 1HD PRO 151 -3.051 -17.600 -4.991 1038 H GLU 152 H GLU 152 -0.586 -15.713 -7.443 1039 HA GLU 152 HA GLU 152 1.845 -14.319 -7.828 1040 1HB GLU 152 2HB GLU 152 1.415 -14.572 -10.259 1041 2HB GLU 152 1HB GLU 152 1.569 -16.101 -9.362 1042 1HG GLU 152 2HG GLU 152 -0.977 -14.777 -10.316 1043 2HG GLU 152 1HG GLU 152 -0.118 -16.026 -11.205 1044 H THR 153 H THR 153 -1.420 -13.494 -8.391 1045 HA THR 153 HA THR 153 -0.904 -11.168 -9.879 1046 HB THR 153 HB THR 153 -3.287 -10.592 -9.488 1047 HG1 THR 153 1HG THR 153 -3.092 -12.679 -7.510 1048 1HG2 THR 153 1HG2 THR 153 -2.684 -12.168 -11.248 1049 2HG2 THR 153 2HG2 THR 153 -4.217 -12.664 -10.507 1050 3HG2 THR 153 3HG2 THR 153 -2.711 -13.486 -10.090 1051 H LEU 154 H LEU 154 -0.900 -11.864 -6.543 1052 HA LEU 154 HA LEU 154 -1.226 -9.233 -5.502 1053 1HB LEU 154 2HB LEU 154 0.229 -11.580 -4.292 1054 2HB LEU 154 1HB LEU 154 -0.302 -10.149 -3.436 1055 HG LEU 154 HG LEU 154 -2.116 -12.205 -4.702 1056 1HD1 LEU 154 1HD1 LEU 154 -2.647 -12.814 -2.408 1057 2HD1 LEU 154 2HD1 LEU 154 -1.464 -11.641 -1.825 1058 3HD1 LEU 154 3HD1 LEU 154 -0.928 -13.035 -2.749 1059 1HD2 LEU 154 1HD2 LEU 154 -3.129 -9.923 -4.669 1060 2HD2 LEU 154 2HD2 LEU 154 -2.772 -9.850 -2.940 1061 3HD2 LEU 154 3HD2 LEU 154 -3.921 -11.024 -3.543 1062 H LEU 155 H LEU 155 1.564 -11.107 -6.590 1063 HA LEU 155 HA LEU 155 3.622 -9.355 -5.772 1064 1HB LEU 155 2HB LEU 155 3.439 -11.189 -8.148 1065 2HB LEU 155 1HB LEU 155 4.845 -10.198 -7.855 1066 HG LEU 155 HG LEU 155 5.189 -12.424 -7.248 1067 1HD1 LEU 155 1HD1 LEU 155 6.354 -10.756 -5.920 1068 2HD1 LEU 155 2HD1 LEU 155 5.961 -12.136 -4.893 1069 3HD1 LEU 155 3HD1 LEU 155 5.003 -10.658 -4.794 1070 1HD2 LEU 155 1HD2 LEU 155 4.032 -13.413 -5.247 1071 2HD2 LEU 155 2HD2 LEU 155 3.056 -13.273 -6.721 1072 3HD2 LEU 155 3HD2 LEU 155 2.866 -12.119 -5.397 1073 H GLN 156 H GLN 156 1.760 -9.538 -8.643 1074 HA GLN 156 HA GLN 156 2.983 -7.348 -9.897 1075 1HB GLN 156 2HB GLN 156 0.236 -8.444 -10.424 1076 2HB GLN 156 1HB GLN 156 1.079 -7.287 -11.453 1077 1HG GLN 156 2HG GLN 156 2.947 -8.977 -11.594 1078 2HG GLN 156 1HG GLN 156 1.825 -10.115 -10.847 1079 1HE2 GLN 156 1HE2 GLN 156 2.561 -8.224 -13.588 1080 2HE2 GLN 156 2HE2 GLN 156 1.499 -8.996 -14.707 1081 H PHE 157 H PHE 157 0.098 -7.411 -7.846 1082 HA PHE 157 HA PHE 157 -0.460 -4.648 -7.991 1083 1HB PHE 157 2HB PHE 157 -2.045 -6.180 -6.920 1084 2HB PHE 157 1HB PHE 157 -0.861 -6.586 -5.682 1085 HD1 PHE 157 1HD PHE 157 -1.204 -5.616 -3.603 1086 HD2 PHE 157 2HD PHE 157 -2.458 -3.520 -7.093 1087 HE1 PHE 157 1HE PHE 157 -2.122 -3.757 -2.179 1088 HE2 PHE 157 2HE PHE 157 -3.344 -1.717 -5.698 1089 HZ PHE 157 HZ PHE 157 -3.171 -1.842 -3.245 1090 H CYS 158 H CYS 158 1.619 -6.500 -5.882 1091 HA CYS 158 HA CYS 158 2.717 -4.565 -4.273 1092 1HB CYS 158 2HB CYS 158 3.121 -6.873 -3.847 1093 2HB CYS 158 1HB CYS 158 3.809 -7.115 -5.443 1094 HG CYS 158 HG CYS 158 5.260 -5.518 -2.789 1095 H VAL 159 H VAL 159 3.855 -5.633 -7.454 1096 HA VAL 159 HA VAL 159 6.086 -3.966 -7.660 1097 HB VAL 159 HB VAL 159 4.303 -4.928 -9.906 1098 1HG1 VAL 159 1HG1 VAL 159 5.744 -3.086 -10.581 1099 2HG1 VAL 159 2HG1 VAL 159 6.253 -4.596 -11.349 1100 3HG1 VAL 159 3HG1 VAL 159 7.151 -3.945 -9.966 1101 1HG2 VAL 159 1HG2 VAL 159 6.824 -6.141 -8.782 1102 2HG2 VAL 159 2HG2 VAL 159 5.923 -6.732 -10.181 1103 3HG2 VAL 159 3HG2 VAL 159 5.183 -6.769 -8.580 1104 H GLU 160 H GLU 160 2.738 -3.408 -8.705 1105 HA GLU 160 HA GLU 160 3.163 -0.983 -10.054 1106 1HB GLU 160 2HB GLU 160 0.650 -1.796 -8.601 1107 2HB GLU 160 1HB GLU 160 0.787 -0.567 -9.851 1108 1HG GLU 160 2HG GLU 160 1.114 -3.535 -10.148 1109 2HG GLU 160 1HG GLU 160 -0.158 -2.519 -10.814 1110 H VAL 161 H VAL 161 2.321 -1.604 -6.725 1111 HA VAL 161 HA VAL 161 2.137 1.122 -5.993 1112 HB VAL 161 HB VAL 161 2.674 -1.305 -4.299 1113 1HG1 VAL 161 1HG1 VAL 161 1.866 0.065 -2.392 1114 2HG1 VAL 161 2HG1 VAL 161 1.749 1.460 -3.465 1115 3HG1 VAL 161 3HG1 VAL 161 3.322 0.744 -3.115 1116 1HG2 VAL 161 1HG2 VAL 161 0.568 -1.484 -5.472 1117 2HG2 VAL 161 2HG2 VAL 161 0.086 0.118 -4.915 1118 3HG2 VAL 161 3HG2 VAL 161 0.267 -1.201 -3.757 1119 H SER 162 H SER 162 4.748 -1.297 -5.790 1120 HA SER 162 HA SER 162 6.505 0.202 -4.234 1121 1HB SER 162 2HB SER 162 7.094 -1.955 -6.232 1122 2HB SER 162 1HB SER 162 8.210 -1.313 -5.015 1123 HG SER 162 HG SER 162 5.860 -2.822 -4.661 1124 H LYS 163 H LYS 163 6.405 -0.119 -7.767 1125 HA LYS 163 HA LYS 163 8.650 1.548 -8.124 1126 1HB LYS 163 2HB LYS 163 7.962 1.643 -10.534 1127 2HB LYS 163 1HB LYS 163 8.208 0.033 -9.887 1128 1HG LYS 163 2HG LYS 163 5.741 -0.149 -9.624 1129 2HG LYS 163 1HG LYS 163 5.596 1.408 -10.443 1130 1HD LYS 163 2HD LYS 163 6.654 0.519 -12.425 1131 2HD LYS 163 1HD LYS 163 6.983 -0.999 -11.596 1132 1HE LYS 163 2HE LYS 163 5.059 -1.222 -13.069 1133 2HE LYS 163 1HE LYS 163 4.604 -1.433 -11.389 1134 1HZ LYS 163 1HZ LYS 163 4.140 0.978 -13.063 1135 2HZ LYS 163 2HZ LYS 163 3.765 0.893 -11.416 1136 3HZ LYS 163 3HZ LYS 163 3.013 -0.132 -12.510 1137 H GLU 164 H GLU 164 5.284 2.298 -7.840 1138 HA GLU 164 HA GLU 164 5.585 4.971 -8.818 1139 1HB GLU 164 2HB GLU 164 3.395 3.740 -8.788 1140 2HB GLU 164 1HB GLU 164 3.467 3.903 -7.021 1141 1HG GLU 164 2HG GLU 164 3.387 6.284 -7.156 1142 2HG GLU 164 1HG GLU 164 3.497 6.230 -8.910 1143 H ILE 165 H ILE 165 5.355 3.455 -5.643 1144 HA ILE 165 HA ILE 165 5.363 5.858 -4.232 1145 HB ILE 165 HB ILE 165 4.515 3.677 -3.354 1146 1HG1 ILE 165 2HG1 ILE 165 5.213 4.001 -1.030 1147 2HG1 ILE 165 1HG1 ILE 165 6.556 5.003 -1.578 1148 1HG2 ILE 165 1HG2 ILE 165 6.072 2.093 -2.271 1149 2HG2 ILE 165 2HG2 ILE 165 7.429 3.034 -2.886 1150 3HG2 ILE 165 3HG2 ILE 165 6.341 2.219 -4.014 1151 1HD1 ILE 165 1HD1 ILE 165 3.660 5.607 -2.048 1152 2HD1 ILE 165 2HD1 ILE 165 5.073 6.572 -2.501 1153 3HD1 ILE 165 3HD1 ILE 165 4.688 6.354 -0.792 1154 H ASP 166 H ASP 166 7.773 3.768 -5.288 1155 HA ASP 166 HA ASP 166 10.178 4.557 -4.143 1156 1HB ASP 166 2HB ASP 166 9.991 2.722 -5.727 1157 2HB ASP 166 1HB ASP 166 9.546 3.831 -7.005 1158 H GLU 167 H GLU 167 8.647 5.921 -7.035 1159 HA GLU 167 HA GLU 167 10.536 8.029 -7.373 1160 1HB GLU 167 2HB GLU 167 7.770 7.681 -8.478 1161 2HB GLU 167 1HB GLU 167 8.938 8.877 -9.028 1162 1HG GLU 167 2HG GLU 167 10.429 7.095 -9.737 1163 2HG GLU 167 1HG GLU 167 9.272 5.897 -9.153 1164 H HIS 168 H HIS 168 7.489 7.735 -5.710 1165 HA HIS 168 HA HIS 168 6.943 10.487 -5.396 1166 1HB HIS 168 2HB HIS 168 5.225 8.747 -4.992 1167 2HB HIS 168 1HB HIS 168 6.123 8.190 -3.590 1168 HD1 HIS 168 1HD HIS 168 3.537 10.600 -4.622 1169 HD2 HIS 168 2HD HIS 168 6.094 10.096 -1.383 1170 HE1 HIS 168 1HE HIS 168 2.591 12.019 -2.779 1171 HE2 HIS 168 2HE HIS 168 4.335 11.898 -0.949 1172 H LEU 169 H LEU 169 8.731 8.191 -3.272 1173 HA LEU 169 HA LEU 169 9.255 10.263 -1.434 1174 1HB LEU 169 2HB LEU 169 10.287 7.467 -1.614 1175 2HB LEU 169 1HB LEU 169 10.904 8.606 -0.438 1176 HG LEU 169 HG LEU 169 9.346 7.213 0.598 1177 1HD1 LEU 169 1HD1 LEU 169 8.070 9.903 0.119 1178 2HD1 LEU 169 2HD1 LEU 169 9.289 9.514 1.335 1179 3HD1 LEU 169 3HD1 LEU 169 7.673 8.809 1.435 1180 1HD2 LEU 169 1HD2 LEU 169 8.096 6.428 -1.283 1181 2HD2 LEU 169 2HD2 LEU 169 7.343 8.010 -1.482 1182 3HD2 LEU 169 3HD2 LEU 169 6.993 7.039 -0.050 1183 H LEU 170 H LEU 170 10.874 9.268 -4.274 1184 HA LEU 170 HA LEU 170 13.367 10.459 -3.554 1185 1HB LEU 170 2HB LEU 170 12.159 9.964 -6.261 1186 2HB LEU 170 1HB LEU 170 13.806 10.514 -5.996 1187 HG LEU 170 HG LEU 170 12.660 7.894 -5.064 1188 1HD1 LEU 170 1HD1 LEU 170 12.961 8.009 -7.471 1189 2HD1 LEU 170 2HD1 LEU 170 14.152 6.926 -6.746 1190 3HD1 LEU 170 3HD1 LEU 170 14.625 8.554 -7.255 1191 1HD2 LEU 170 1HD2 LEU 170 14.979 7.380 -4.409 1192 2HD2 LEU 170 2HD2 LEU 170 14.372 8.778 -3.531 1193 3HD2 LEU 170 3HD2 LEU 170 15.464 9.005 -4.890 1194 H ALA 171 H ALA 171 10.393 11.683 -4.505 1195 HA ALA 171 HA ALA 171 11.466 14.366 -4.846 1196 1HB ALA 171 1HB ALA 171 9.143 14.893 -5.535 1197 2HB ALA 171 2HB ALA 171 8.709 13.205 -5.236 1198 3HB ALA 171 3HB ALA 171 9.853 13.606 -6.514 1199 H GLU 172 H GLU 172 9.206 15.728 -3.790 1200 HA GLU 172 HA GLU 172 8.655 16.724 -1.944 1201 1HB GLU 172 2HB GLU 172 7.998 13.858 -1.334 1202 2HB GLU 172 1HB GLU 172 7.674 15.179 -0.219 1203 1HG GLU 172 2HG GLU 172 5.681 14.602 -1.536 1204 2HG GLU 172 1HG GLU 172 6.211 16.255 -1.802 1205 H GLU 173 H GLU 173 8.735 16.163 0.780 1206 HA GLU 173 HA GLU 173 11.601 16.478 1.212 1207 1HB GLU 173 2HB GLU 173 9.295 17.322 2.978 1208 2HB GLU 173 1HB GLU 173 10.992 17.637 3.294 1209 1HG GLU 173 2HG GLU 173 11.099 18.950 1.205 1210 2HG GLU 173 1HG GLU 173 9.365 18.707 1.006 Start of MODEL 17 1 H THR 17 H THR 17 2.924 -25.045 -5.206 2 HA THR 17 HA THR 17 3.593 -26.537 -2.879 3 HB THR 17 HB THR 17 4.775 -24.395 -2.428 4 HG1 THR 17 1HG THR 17 4.022 -24.104 -0.447 5 1HG2 THR 17 1HG2 THR 17 2.069 -23.080 -2.756 6 2HG2 THR 17 2HG2 THR 17 3.462 -22.871 -3.815 7 3HG2 THR 17 3HG2 THR 17 3.520 -22.278 -2.155 8 H GLU 18 H GLU 18 1.756 -27.338 -2.081 9 HA GLU 18 HA GLU 18 -0.654 -26.828 -3.524 10 1HB GLU 18 2HB GLU 18 -1.613 -28.585 -2.117 11 2HB GLU 18 1HB GLU 18 -0.109 -29.085 -2.884 12 1HG GLU 18 2HG GLU 18 1.069 -28.601 -0.763 13 2HG GLU 18 1HG GLU 18 -0.491 -28.243 -0.022 14 H ALA 19 H ALA 19 -2.752 -26.524 -2.370 15 HA ALA 19 HA ALA 19 -2.416 -24.530 -0.246 16 1HB ALA 19 1HB ALA 19 -4.384 -24.599 -2.528 17 2HB ALA 19 2HB ALA 19 -3.030 -23.486 -2.349 18 3HB ALA 19 3HB ALA 19 -4.392 -23.406 -1.228 19 H SER 20 H SER 20 -2.751 -27.317 0.115 20 HA SER 20 HA SER 20 -5.335 -28.249 0.512 21 1HB SER 20 2HB SER 20 -3.332 -29.689 0.611 22 2HB SER 20 1HB SER 20 -2.856 -28.919 2.117 23 HG SER 20 HG SER 20 -4.453 -30.971 1.730 24 H SER 21 H SER 21 -3.282 -26.444 2.791 25 HA SER 21 HA SER 21 -5.406 -26.450 4.761 26 1HB SER 21 2HB SER 21 -3.040 -26.808 5.449 27 2HB SER 21 1HB SER 21 -2.648 -25.197 4.869 28 HG SER 21 HG SER 21 -3.106 -25.504 7.188 29 H LEU 22 H LEU 22 -4.645 -24.742 2.079 30 HA LEU 22 HA LEU 22 -5.093 -22.805 1.130 31 1HB LEU 22 2HB LEU 22 -6.987 -22.607 3.440 32 2HB LEU 22 1HB LEU 22 -7.037 -21.513 2.080 33 HG LEU 22 HG LEU 22 -7.410 -24.509 1.880 34 1HD1 LEU 22 1HD1 LEU 22 -9.731 -24.003 1.526 35 2HD1 LEU 22 2HD1 LEU 22 -9.403 -22.284 1.890 36 3HD1 LEU 22 3HD1 LEU 22 -9.132 -23.544 3.120 37 1HD2 LEU 22 1HD2 LEU 22 -8.248 -24.023 -0.355 38 2HD2 LEU 22 2HD2 LEU 22 -6.576 -23.506 -0.179 39 3HD2 LEU 22 3HD2 LEU 22 -7.877 -22.316 -0.137 40 H VAL 23 H VAL 23 -5.155 -22.174 4.500 41 HA VAL 23 HA VAL 23 -4.531 -20.466 5.795 42 HB VAL 23 HB VAL 23 -1.940 -20.893 4.375 43 1HG1 VAL 23 1HG1 VAL 23 -0.903 -19.778 6.336 44 2HG1 VAL 23 2HG1 VAL 23 -2.519 -19.671 7.091 45 3HG1 VAL 23 3HG1 VAL 23 -2.209 -18.772 5.642 46 1HG2 VAL 23 1HG2 VAL 23 -2.830 -22.915 5.389 47 2HG2 VAL 23 2HG2 VAL 23 -3.065 -22.062 6.914 48 3HG2 VAL 23 3HG2 VAL 23 -1.431 -22.351 6.307 49 H GLY 24 H GLY 24 -2.489 -19.341 3.038 50 1HA GLY 24 2HA GLY 24 -2.726 -17.389 1.904 51 2HA GLY 24 1HA GLY 24 -3.926 -16.849 3.041 52 H LYS 25 H LYS 25 -0.609 -17.345 2.557 53 HA LYS 25 HA LYS 25 0.008 -14.947 4.170 54 1HB LYS 25 2HB LYS 25 1.577 -17.503 4.484 55 2HB LYS 25 1HB LYS 25 1.925 -15.875 5.049 56 1HG LYS 25 2HG LYS 25 0.254 -15.949 6.666 57 2HG LYS 25 1HG LYS 25 -0.419 -17.455 6.009 58 1HD LYS 25 2HD LYS 25 1.064 -17.801 7.991 59 2HD LYS 25 1HD LYS 25 1.575 -18.673 6.544 60 1HE LYS 25 2HE LYS 25 3.555 -17.684 7.532 61 2HE LYS 25 1HE LYS 25 3.173 -16.794 6.061 62 1HZ LYS 25 1HZ LYS 25 2.490 -15.926 8.820 63 2HZ LYS 25 2HZ LYS 25 2.149 -15.063 7.401 64 3HZ LYS 25 3HZ LYS 25 3.740 -15.335 7.880 65 H LEU 26 H LEU 26 1.619 -13.722 3.175 66 HA LEU 26 HA LEU 26 3.590 -15.264 1.904 67 1HB LEU 26 2HB LEU 26 2.036 -14.975 0.080 68 2HB LEU 26 1HB LEU 26 1.972 -13.244 0.327 69 HG LEU 26 HG LEU 26 4.345 -13.126 -0.437 70 1HD1 LEU 26 1HD1 LEU 26 5.276 -15.067 -1.608 71 2HD1 LEU 26 2HD1 LEU 26 3.883 -16.021 -1.095 72 3HD1 LEU 26 3HD1 LEU 26 5.014 -15.395 0.111 73 1HD2 LEU 26 1HD2 LEU 26 3.816 -13.491 -2.804 74 2HD2 LEU 26 2HD2 LEU 26 2.503 -12.669 -1.960 75 3HD2 LEU 26 3HD2 LEU 26 2.371 -14.388 -2.339 76 H GLU 27 H GLU 27 5.642 -14.048 1.708 77 HA GLU 27 HA GLU 27 5.445 -11.241 2.334 78 1HB GLU 27 2HB GLU 27 6.246 -12.321 4.446 79 2HB GLU 27 1HB GLU 27 7.611 -13.003 3.563 80 1HG GLU 27 2HG GLU 27 8.487 -10.805 3.096 81 2HG GLU 27 1HG GLU 27 7.065 -10.043 3.777 82 H THR 28 H THR 28 6.677 -9.964 1.181 83 HA THR 28 HA THR 28 8.648 -11.130 -0.594 84 HB THR 28 HB THR 28 6.640 -11.090 -1.990 85 HG1 THR 28 1HG THR 28 7.464 -8.906 -3.173 86 1HG2 THR 28 1HG2 THR 28 5.337 -9.446 -0.679 87 2HG2 THR 28 2HG2 THR 28 5.366 -9.049 -2.403 88 3HG2 THR 28 3HG2 THR 28 6.402 -8.169 -1.291 89 H ASP 29 H ASP 29 10.317 -9.735 -1.072 90 HA ASP 29 HA ASP 29 10.244 -7.193 0.361 91 1HB ASP 29 2HB ASP 29 12.708 -7.282 0.393 92 2HB ASP 29 1HB ASP 29 12.030 -8.684 1.195 93 H VAL 30 H VAL 30 10.147 -5.473 -0.790 94 HA VAL 30 HA VAL 30 11.009 -5.608 -3.592 95 HB VAL 30 HB VAL 30 8.982 -3.735 -2.311 96 1HG1 VAL 30 1HG1 VAL 30 10.312 -2.602 -4.040 97 2HG1 VAL 30 2HG1 VAL 30 8.629 -2.772 -4.503 98 3HG1 VAL 30 3HG1 VAL 30 9.857 -3.840 -5.210 99 1HG2 VAL 30 1HG2 VAL 30 8.666 -5.896 -4.376 100 2HG2 VAL 30 2HG2 VAL 30 7.386 -4.812 -3.816 101 3HG2 VAL 30 3HG2 VAL 30 8.113 -5.975 -2.698 102 H GLU 31 H GLU 31 12.705 -4.473 -4.109 103 HA GLU 31 HA GLU 31 13.588 -2.597 -2.136 104 1HB GLU 31 2HB GLU 31 15.851 -2.626 -3.194 105 2HB GLU 31 1HB GLU 31 15.317 -4.145 -2.516 106 1HG GLU 31 2HG GLU 31 16.478 -4.644 -4.471 107 2HG GLU 31 1HG GLU 31 14.759 -4.851 -4.821 108 H ILE 32 H ILE 32 13.673 -0.693 -2.271 109 HA ILE 32 HA ILE 32 12.967 0.644 -4.787 110 HB ILE 32 HB ILE 32 11.886 2.394 -3.391 111 1HG1 ILE 32 2HG1 ILE 32 12.412 0.470 -1.104 112 2HG1 ILE 32 1HG1 ILE 32 13.156 2.045 -1.320 113 1HG2 ILE 32 1HG2 ILE 32 10.502 0.647 -4.360 114 2HG2 ILE 32 2HG2 ILE 32 9.872 1.111 -2.782 115 3HG2 ILE 32 3HG2 ILE 32 10.788 -0.384 -2.959 116 1HD1 ILE 32 1HD1 ILE 32 11.445 2.102 0.364 117 2HD1 ILE 32 2HD1 ILE 32 10.242 1.509 -0.783 118 3HD1 ILE 32 3HD1 ILE 32 10.969 3.104 -1.009 119 H LYS 33 H LYS 33 13.694 3.005 -4.662 120 HA LYS 33 HA LYS 33 16.462 2.917 -3.720 121 1HB LYS 33 2HB LYS 33 15.158 4.741 -5.737 122 2HB LYS 33 1HB LYS 33 16.869 4.749 -5.313 123 1HG LYS 33 2HG LYS 33 17.072 2.464 -6.164 124 2HG LYS 33 1HG LYS 33 15.366 2.479 -6.593 125 1HD LYS 33 2HD LYS 33 15.774 4.368 -8.094 126 2HD LYS 33 1HD LYS 33 17.493 4.304 -7.693 127 1HE LYS 33 2HE LYS 33 15.885 2.101 -8.978 128 2HE LYS 33 1HE LYS 33 17.034 3.155 -9.806 129 1HZ LYS 33 1HZ LYS 33 17.683 1.220 -7.640 130 2HZ LYS 33 2HZ LYS 33 18.789 2.234 -8.378 131 3HZ LYS 33 3HZ LYS 33 18.014 1.030 -9.275 132 H ALA 34 H ALA 34 13.442 4.252 -3.193 133 HA ALA 34 HA ALA 34 14.204 6.615 -1.835 134 1HB ALA 34 1HB ALA 34 11.722 4.926 -1.561 135 2HB ALA 34 2HB ALA 34 11.946 6.254 -2.692 136 3HB ALA 34 3HB ALA 34 11.924 6.569 -0.954 137 H SER 35 H SER 35 14.840 6.894 0.186 138 HA SER 35 HA SER 35 15.734 4.670 1.723 139 1HB SER 35 2HB SER 35 16.840 7.035 1.555 140 2HB SER 35 1HB SER 35 15.510 7.529 2.533 141 HG SER 35 HG SER 35 17.140 5.425 3.401 142 H ALA 36 H ALA 36 14.814 3.793 3.522 143 HA ALA 36 HA ALA 36 12.116 4.098 4.200 144 1HB ALA 36 1HB ALA 36 13.503 2.110 4.749 145 2HB ALA 36 2HB ALA 36 12.642 2.746 6.153 146 3HB ALA 36 3HB ALA 36 14.353 3.078 5.947 147 H ASP 37 H ASP 37 15.030 5.525 5.434 148 HA ASP 37 HA ASP 37 13.902 6.949 7.612 149 1HB ASP 37 2HB ASP 37 16.321 6.564 7.413 150 2HB ASP 37 1HB ASP 37 16.364 7.541 5.950 151 H LYS 38 H LYS 38 14.554 7.715 4.257 152 HA LYS 38 HA LYS 38 13.791 10.441 4.285 153 1HB LYS 38 2HB LYS 38 15.167 9.393 2.541 154 2HB LYS 38 1HB LYS 38 13.731 8.521 1.959 155 1HG LYS 38 2HG LYS 38 12.681 10.656 1.563 156 2HG LYS 38 1HG LYS 38 14.166 11.437 2.149 157 1HD LYS 38 2HD LYS 38 15.410 10.396 0.327 158 2HD LYS 38 1HD LYS 38 13.908 9.679 -0.282 159 1HE LYS 38 2HE LYS 38 12.941 11.861 -0.499 160 2HE LYS 38 1HE LYS 38 14.427 12.590 0.114 161 1HZ LYS 38 1HZ LYS 38 14.185 11.025 -2.421 162 2HZ LYS 38 2HZ LYS 38 15.603 11.721 -1.858 163 3HZ LYS 38 3HZ LYS 38 14.338 12.691 -2.333 164 H PHE 39 H PHE 39 11.929 7.495 3.951 165 HA PHE 39 HA PHE 39 9.486 8.498 3.022 166 1HB PHE 39 2HB PHE 39 10.054 6.065 3.456 167 2HB PHE 39 1HB PHE 39 9.887 6.380 5.170 168 HD1 PHE 39 1HD PHE 39 8.287 5.094 2.372 169 HD2 PHE 39 2HD PHE 39 7.498 7.466 5.803 170 HE1 PHE 39 1HE PHE 39 5.904 4.507 2.223 171 HE2 PHE 39 2HE PHE 39 5.108 6.871 5.672 172 HZ PHE 39 HZ PHE 39 4.313 5.394 3.873 173 H HIS 40 H HIS 40 10.740 8.198 6.303 174 HA HIS 40 HA HIS 40 8.640 9.408 7.716 175 1HB HIS 40 2HB HIS 40 10.285 8.064 8.867 176 2HB HIS 40 1HB HIS 40 11.583 9.128 8.358 177 HD1 HIS 40 1HD HIS 40 12.443 10.233 10.411 178 HD2 HIS 40 2HD HIS 40 8.296 9.980 10.451 179 HE1 HIS 40 1HE HIS 40 11.731 11.341 12.517 180 HE2 HIS 40 2HE HIS 40 9.304 10.810 12.686 181 H HIS 41 H HIS 41 11.298 10.790 5.961 182 HA HIS 41 HA HIS 41 10.964 13.383 7.151 183 1HB HIS 41 2HB HIS 41 12.625 12.495 4.788 184 2HB HIS 41 1HB HIS 41 12.541 14.161 5.339 185 HD1 HIS 41 1HD HIS 41 14.468 14.751 6.790 186 HD2 HIS 41 2HD HIS 41 13.457 10.756 7.123 187 HE1 HIS 41 1HE HIS 41 16.151 13.750 8.361 188 HE2 HIS 41 2HE HIS 41 15.727 11.271 8.028 189 H MET 42 H MET 42 9.945 11.806 4.217 190 HA MET 42 HA MET 42 8.791 14.176 3.106 191 1HB MET 42 2HB MET 42 8.503 11.275 2.384 192 2HB MET 42 1HB MET 42 7.636 12.553 1.546 193 1HG MET 42 2HG MET 42 10.609 12.299 1.787 194 2HG MET 42 1HG MET 42 9.662 11.879 0.354 195 1HE MET 42 1HE MET 42 11.317 15.137 -0.978 196 2HE MET 42 2HE MET 42 10.890 13.463 -1.334 197 3HE MET 42 3HE MET 42 12.059 13.822 -0.067 198 H PHE 43 H PHE 43 7.692 11.806 5.324 199 HA PHE 43 HA PHE 43 4.919 12.487 4.954 200 1HB PHE 43 2HB PHE 43 5.567 10.208 5.632 201 2HB PHE 43 1HB PHE 43 6.263 10.846 7.112 202 HD1 PHE 43 1HD PHE 43 3.118 10.265 5.284 203 HD2 PHE 43 2HD PHE 43 4.888 11.321 9.008 204 HE1 PHE 43 1HE PHE 43 0.938 9.982 6.397 205 HE2 PHE 43 2HE PHE 43 2.713 11.038 10.127 206 HZ PHE 43 HZ PHE 43 0.738 10.368 8.821 207 H ALA 44 H ALA 44 7.539 13.418 7.057 208 HA ALA 44 HA ALA 44 5.721 14.987 8.721 209 1HB ALA 44 1HB ALA 44 7.358 13.576 9.876 210 2HB ALA 44 2HB ALA 44 7.621 15.285 10.225 211 3HB ALA 44 3HB ALA 44 8.668 14.446 9.081 212 H GLY 45 H GLY 45 8.953 15.559 7.333 213 1HA GLY 45 2HA GLY 45 8.378 18.404 7.165 214 2HA GLY 45 1HA GLY 45 9.945 17.628 6.935 215 H LYS 46 H LYS 46 6.810 18.024 5.546 216 HA LYS 46 HA LYS 46 7.357 16.871 3.031 217 1HB LYS 46 2HB LYS 46 5.264 18.882 3.837 218 2HB LYS 46 1HB LYS 46 5.246 17.923 2.370 219 1HG LYS 46 2HG LYS 46 5.007 15.880 3.616 220 2HG LYS 46 1HG LYS 46 5.202 16.742 5.138 221 1HD LYS 46 2HD LYS 46 2.939 17.181 3.185 222 2HD LYS 46 1HD LYS 46 2.849 16.180 4.633 223 1HE LYS 46 2HE LYS 46 3.364 18.157 6.011 224 2HE LYS 46 1HE LYS 46 3.419 19.146 4.556 225 1HZ LYS 46 1HZ LYS 46 1.300 19.310 5.696 226 2HZ LYS 46 2HZ LYS 46 1.053 17.663 5.532 227 3HZ LYS 46 3HZ LYS 46 1.087 18.640 4.172 228 HA PRO 47 HA PRO 47 9.565 20.289 1.202 229 1HB PRO 47 2HB PRO 47 9.407 19.558 -1.393 230 2HB PRO 47 1HB PRO 47 10.433 18.688 -0.249 231 1HG PRO 47 2HG PRO 47 7.710 17.976 -1.262 232 2HG PRO 47 1HG PRO 47 9.123 16.932 -1.030 233 1HD PRO 47 2HD PRO 47 7.066 17.064 0.746 234 2HD PRO 47 1HD PRO 47 8.736 16.699 1.223 235 H HIS 48 H HIS 48 9.158 21.673 -0.956 236 HA HIS 48 HA HIS 48 6.671 23.005 -0.536 237 1HB HIS 48 2HB HIS 48 8.750 24.200 -1.205 238 2HB HIS 48 1HB HIS 48 8.708 23.381 -2.756 239 HD1 HIS 48 1HD HIS 48 7.710 24.766 -4.563 240 HD2 HIS 48 2HD HIS 48 6.220 25.800 -0.824 241 HE1 HIS 48 1HE HIS 48 6.213 26.726 -4.952 242 HE2 HIS 48 2HE HIS 48 5.463 27.440 -2.683 243 H HIS 49 H HIS 49 7.996 20.744 -2.827 244 HA HIS 49 HA HIS 49 7.079 19.210 -4.198 245 1HB HIS 49 2HB HIS 49 5.548 18.812 -2.262 246 2HB HIS 49 1HB HIS 49 4.429 19.979 -2.942 247 HD1 HIS 49 1HD HIS 49 4.773 16.525 -2.583 248 HD2 HIS 49 2HD HIS 49 3.700 18.924 -5.794 249 HE1 HIS 49 1HE HIS 49 3.515 15.035 -4.135 250 HE2 HIS 49 2HE HIS 49 2.612 16.584 -5.877 251 H VAL 50 H VAL 50 7.356 19.864 -6.219 252 HA VAL 50 HA VAL 50 6.158 22.127 -7.343 253 HB VAL 50 HB VAL 50 6.866 21.259 -9.553 254 1HG1 VAL 50 1HG1 VAL 50 8.943 20.885 -7.408 255 2HG1 VAL 50 2HG1 VAL 50 8.504 22.406 -8.185 256 3HG1 VAL 50 3HG1 VAL 50 9.273 21.126 -9.123 257 1HG2 VAL 50 1HG2 VAL 50 7.663 18.761 -8.048 258 2HG2 VAL 50 2HG2 VAL 50 8.032 19.100 -9.738 259 3HG2 VAL 50 3HG2 VAL 50 6.358 18.885 -9.226 260 H SER 51 H SER 51 4.341 22.417 -8.516 261 HA SER 51 HA SER 51 2.263 20.579 -7.946 262 1HB SER 51 2HB SER 51 1.929 23.049 -7.916 263 2HB SER 51 1HB SER 51 2.179 23.081 -9.660 264 HG SER 51 HG SER 51 0.142 21.695 -8.262 265 H LYS 52 H LYS 52 2.509 18.746 -8.972 266 HA LYS 52 HA LYS 52 3.186 18.546 -11.756 267 1HB LYS 52 2HB LYS 52 2.245 16.440 -9.812 268 2HB LYS 52 1HB LYS 52 2.925 16.159 -11.401 269 1HG LYS 52 2HG LYS 52 5.058 17.062 -10.682 270 2HG LYS 52 1HG LYS 52 4.379 17.437 -9.095 271 1HD LYS 52 2HD LYS 52 5.629 15.380 -8.962 272 2HD LYS 52 1HD LYS 52 3.901 15.055 -8.776 273 1HE LYS 52 2HE LYS 52 3.780 14.364 -11.127 274 2HE LYS 52 1HE LYS 52 5.507 14.680 -11.306 275 1HZ LYS 52 1HZ LYS 52 5.087 12.359 -10.983 276 2HZ LYS 52 2HZ LYS 52 4.256 12.636 -9.549 277 3HZ LYS 52 3HZ LYS 52 5.907 12.952 -9.639 278 H ALA 53 H ALA 53 0.547 17.403 -9.731 279 HA ALA 53 HA ALA 53 -1.621 18.439 -11.108 280 1HB ALA 53 1HB ALA 53 -1.027 15.542 -11.793 281 2HB ALA 53 2HB ALA 53 -0.977 16.892 -12.928 282 3HB ALA 53 3HB ALA 53 -2.508 16.408 -12.196 283 H SER 54 H SER 54 -2.577 18.724 -9.155 284 HA SER 54 HA SER 54 -2.978 16.310 -7.571 285 1HB SER 54 2HB SER 54 -3.155 17.856 -5.587 286 2HB SER 54 1HB SER 54 -1.554 17.769 -6.319 287 HG SER 54 HG SER 54 -3.378 19.749 -7.141 288 HA PRO 55 HA PRO 55 -7.223 17.237 -8.679 289 1HB PRO 55 2HB PRO 55 -8.243 14.871 -7.777 290 2HB PRO 55 1HB PRO 55 -7.474 15.055 -9.353 291 1HG PRO 55 2HG PRO 55 -6.393 13.888 -6.842 292 2HG PRO 55 1HG PRO 55 -6.097 13.415 -8.520 293 1HD PRO 55 2HD PRO 55 -4.367 14.882 -6.968 294 2HD PRO 55 1HD PRO 55 -4.375 14.897 -8.742 295 H GLY 56 H GLY 56 -5.890 16.490 -5.565 296 1HA GLY 56 2HA GLY 56 -6.390 17.635 -3.592 297 2HA GLY 56 1HA GLY 56 -7.842 18.269 -4.349 298 H ASN 57 H ASN 57 -9.291 16.208 -5.012 299 HA ASN 57 HA ASN 57 -9.493 14.347 -2.760 300 1HB ASN 57 2HB ASN 57 -11.778 16.107 -3.738 301 2HB ASN 57 1HB ASN 57 -11.962 14.759 -2.628 302 1HD2 ASN 57 1HD2 ASN 57 -11.369 15.030 -0.462 303 2HD2 ASN 57 2HD2 ASN 57 -10.937 16.565 0.183 304 H ILE 58 H ILE 58 -9.616 12.352 -3.661 305 HA ILE 58 HA ILE 58 -10.891 12.203 -6.280 306 HB ILE 58 HB ILE 58 -9.684 10.049 -6.639 307 1HG1 ILE 58 2HG1 ILE 58 -8.173 10.807 -4.104 308 2HG1 ILE 58 1HG1 ILE 58 -9.242 9.430 -4.302 309 1HG2 ILE 58 1HG2 ILE 58 -7.485 11.087 -7.074 310 2HG2 ILE 58 2HG2 ILE 58 -7.992 12.475 -6.121 311 3HG2 ILE 58 3HG2 ILE 58 -8.839 12.080 -7.614 312 1HD1 ILE 58 1HD1 ILE 58 -7.720 8.456 -5.909 313 2HD1 ILE 58 2HD1 ILE 58 -6.918 8.779 -4.372 314 3HD1 ILE 58 3HD1 ILE 58 -6.653 9.852 -5.746 315 H GLN 59 H GLN 59 -10.502 10.132 -3.431 316 HA GLN 59 HA GLN 59 -13.346 9.641 -3.424 317 1HB GLN 59 2HB GLN 59 -11.295 7.401 -3.494 318 2HB GLN 59 1HB GLN 59 -13.000 7.198 -3.104 319 1HG GLN 59 2HG GLN 59 -13.600 7.925 -5.357 320 2HG GLN 59 1HG GLN 59 -11.896 8.148 -5.738 321 1HE2 GLN 59 1HE2 GLN 59 -14.429 5.841 -5.175 322 2HE2 GLN 59 2HE2 GLN 59 -13.583 4.476 -5.786 323 H GLY 60 H GLY 60 -13.495 10.744 -1.623 324 1HA GLY 60 2HA GLY 60 -13.602 10.661 0.742 325 2HA GLY 60 1HA GLY 60 -12.136 9.670 0.744 326 H CYS 61 H CYS 61 -10.369 10.849 -0.677 327 HA CYS 61 HA CYS 61 -10.207 13.652 -0.578 328 1HB CYS 61 2HB CYS 61 -9.897 13.071 1.884 329 2HB CYS 61 1HB CYS 61 -8.465 12.159 1.428 330 HG CYS 61 HG CYS 61 -8.045 14.848 2.623 331 H ASP 62 H ASP 62 -7.487 13.938 -0.687 332 HA ASP 62 HA ASP 62 -6.196 11.852 -2.175 333 1HB ASP 62 2HB ASP 62 -7.315 12.784 -4.091 334 2HB ASP 62 1HB ASP 62 -6.981 14.424 -3.566 335 H LEU 63 H LEU 63 -6.125 15.289 -1.351 336 HA LEU 63 HA LEU 63 -3.279 15.249 -0.923 337 1HB LEU 63 2HB LEU 63 -4.667 17.305 -1.566 338 2HB LEU 63 1HB LEU 63 -5.332 17.276 0.047 339 HG LEU 63 HG LEU 63 -3.639 19.024 -0.207 340 1HD1 LEU 63 1HD1 LEU 63 -2.672 16.841 1.616 341 2HD1 LEU 63 2HD1 LEU 63 -3.854 18.089 2.005 342 3HD1 LEU 63 3HD1 LEU 63 -2.179 18.531 1.680 343 1HD2 LEU 63 1HD2 LEU 63 -1.281 18.483 -0.567 344 2HD2 LEU 63 2HD2 LEU 63 -2.281 18.017 -1.943 345 3HD2 LEU 63 3HD2 LEU 63 -1.706 16.792 -0.812 346 H HIS 64 H HIS 64 -2.461 14.171 0.764 347 HA HIS 64 HA HIS 64 -4.270 13.187 2.752 348 1HB HIS 64 2HB HIS 64 -1.306 12.703 2.441 349 2HB HIS 64 1HB HIS 64 -2.323 11.910 3.639 350 HD1 HIS 64 1HD HIS 64 -0.884 11.189 0.507 351 HD2 HIS 64 2HD HIS 64 -4.683 10.661 2.107 352 HE1 HIS 64 1HE HIS 64 -1.959 9.449 -0.892 353 HE2 HIS 64 2HE HIS 64 -4.335 9.492 -0.154 354 H GLU 65 H GLU 65 -4.914 14.418 4.326 355 HA GLU 65 HA GLU 65 -2.933 16.132 5.626 356 1HB GLU 65 2HB GLU 65 -4.759 17.505 6.404 357 2HB GLU 65 1HB GLU 65 -4.967 17.249 4.684 358 1HG GLU 65 2HG GLU 65 -6.481 15.807 6.870 359 2HG GLU 65 1HG GLU 65 -7.080 17.169 5.937 360 H GLY 66 H GLY 66 -5.049 13.479 6.018 361 1HA GLY 66 2HA GLY 66 -4.860 11.884 7.777 362 2HA GLY 66 1HA GLY 66 -4.201 13.152 8.816 363 H ASP 67 H ASP 67 -7.008 13.379 6.747 364 HA ASP 67 HA ASP 67 -8.702 14.704 8.474 365 1HB ASP 67 2HB ASP 67 -9.056 14.488 6.062 366 2HB ASP 67 1HB ASP 67 -9.446 12.790 6.272 367 H TRP 68 H TRP 68 -8.228 11.293 8.146 368 HA TRP 68 HA TRP 68 -10.478 10.641 9.871 369 1HB TRP 68 2HB TRP 68 -8.506 8.936 8.396 370 2HB TRP 68 1HB TRP 68 -9.871 8.301 9.315 371 HD1 TRP 68 HD TRP 68 -12.291 8.514 8.181 372 HE1 TRP 68 1HE TRP 68 -13.051 9.022 5.783 373 HE3 TRP 68 3HE TRP 68 -7.902 10.335 6.276 374 HZ2 TRP 68 2HZ TRP 68 -11.969 10.043 3.412 375 HZ3 TRP 68 3HZ TRP 68 -7.867 11.054 3.921 376 HH2 TRP 68 HH TRP 68 -9.861 10.907 2.527 377 H GLY 69 H GLY 69 -7.689 11.865 10.738 378 1HA GLY 69 2HA GLY 69 -6.711 11.790 12.866 379 2HA GLY 69 1HA GLY 69 -7.578 10.299 13.181 380 H THR 70 H THR 70 -6.046 10.326 10.239 381 HA THR 70 HA THR 70 -4.307 9.282 9.313 382 HB THR 70 HB THR 70 -3.041 9.441 12.080 383 HG1 THR 70 1HG THR 70 -2.748 11.027 9.747 384 1HG2 THR 70 1HG2 THR 70 -0.887 9.137 10.892 385 2HG2 THR 70 2HG2 THR 70 -1.765 8.889 9.385 386 3HG2 THR 70 3HG2 THR 70 -1.943 7.734 10.701 387 H VAL 71 H VAL 71 -4.301 7.678 12.530 388 HA VAL 71 HA VAL 71 -4.396 5.102 11.277 389 HB VAL 71 HB VAL 71 -4.929 5.822 14.183 390 1HG1 VAL 71 1HG1 VAL 71 -4.260 3.172 12.902 391 2HG1 VAL 71 2HG1 VAL 71 -5.822 3.645 13.562 392 3HG1 VAL 71 3HG1 VAL 71 -4.431 3.457 14.639 393 1HG2 VAL 71 1HG2 VAL 71 -2.616 5.137 14.600 394 2HG2 VAL 71 2HG2 VAL 71 -2.685 6.506 13.488 395 3HG2 VAL 71 3HG2 VAL 71 -2.380 4.876 12.876 396 H GLY 72 H GLY 72 -6.207 4.007 10.627 397 1HA GLY 72 2HA GLY 72 -8.475 3.386 10.845 398 2HA GLY 72 1HA GLY 72 -8.778 4.897 11.700 399 H SER 73 H SER 73 -6.827 5.690 9.241 400 HA SER 73 HA SER 73 -8.780 7.084 7.785 401 1HB SER 73 2HB SER 73 -6.486 7.885 7.871 402 2HB SER 73 1HB SER 73 -5.933 6.405 7.087 403 HG SER 73 HG SER 73 -6.813 7.008 5.239 404 H ILE 74 H ILE 74 -9.885 6.686 6.023 405 HA ILE 74 HA ILE 74 -9.278 4.284 4.489 406 HB ILE 74 HB ILE 74 -12.003 5.300 5.328 407 1HG1 ILE 74 2HG1 ILE 74 -10.616 2.663 5.771 408 2HG1 ILE 74 1HG1 ILE 74 -10.724 3.964 6.950 409 1HG2 ILE 74 1HG2 ILE 74 -12.936 3.448 3.992 410 2HG2 ILE 74 2HG2 ILE 74 -11.312 3.065 3.415 411 3HG2 ILE 74 3HG2 ILE 74 -12.060 4.600 2.978 412 1HD1 ILE 74 1HD1 ILE 74 -12.983 2.411 5.746 413 2HD1 ILE 74 2HD1 ILE 74 -13.151 3.706 6.950 414 3HD1 ILE 74 3HD1 ILE 74 -12.335 2.191 7.378 415 H VAL 75 H VAL 75 -8.650 4.995 2.619 416 HA VAL 75 HA VAL 75 -10.184 6.999 1.163 417 HB VAL 75 HB VAL 75 -8.140 8.125 2.177 418 1HG1 VAL 75 1HG1 VAL 75 -6.593 6.299 2.156 419 2HG1 VAL 75 2HG1 VAL 75 -5.923 7.662 1.255 420 3HG1 VAL 75 3HG1 VAL 75 -6.601 6.276 0.395 421 1HG2 VAL 75 1HG2 VAL 75 -8.173 7.996 -0.840 422 2HG2 VAL 75 2HG2 VAL 75 -7.375 9.244 0.120 423 3HG2 VAL 75 3HG2 VAL 75 -9.128 9.080 0.175 424 H PHE 76 H PHE 76 -9.737 6.692 -1.259 425 HA PHE 76 HA PHE 76 -8.908 3.881 -1.651 426 1HB PHE 76 2HB PHE 76 -11.016 5.318 -3.274 427 2HB PHE 76 1HB PHE 76 -10.611 3.607 -3.317 428 HD1 PHE 76 1HD PHE 76 -10.449 3.064 -0.408 429 HD2 PHE 76 2HD PHE 76 -13.259 5.280 -2.664 430 HE1 PHE 76 1HE PHE 76 -12.109 2.604 1.279 431 HE2 PHE 76 2HE PHE 76 -14.969 4.845 -0.958 432 HZ PHE 76 HZ PHE 76 -14.404 3.502 1.030 433 H TRP 77 H TRP 77 -7.711 3.397 -3.504 434 HA TRP 77 HA TRP 77 -7.040 5.712 -5.181 435 1HB TRP 77 2HB TRP 77 -4.752 5.318 -5.158 436 2HB TRP 77 1HB TRP 77 -5.161 4.942 -3.500 437 HD1 TRP 77 HD TRP 77 -4.309 3.356 -6.772 438 HE1 TRP 77 1HE TRP 77 -3.155 1.036 -6.357 439 HE3 TRP 77 3HE TRP 77 -4.928 3.085 -1.760 440 HZ2 TRP 77 2HZ TRP 77 -2.616 -0.626 -4.151 441 HZ3 TRP 77 3HZ TRP 77 -4.077 1.123 -0.548 442 HH2 TRP 77 HH TRP 77 -2.948 -0.693 -1.717 443 H ASN 78 H ASN 78 -6.436 5.240 -7.264 444 HA ASN 78 HA ASN 78 -7.756 2.801 -8.208 445 1HB ASN 78 2HB ASN 78 -7.421 5.483 -9.561 446 2HB ASN 78 1HB ASN 78 -8.123 4.058 -10.324 447 1HD2 ASN 78 1HD2 ASN 78 -8.604 6.576 -7.952 448 2HD2 ASN 78 2HD2 ASN 78 -10.289 6.257 -7.696 449 H TYR 79 H TYR 79 -6.614 1.432 -9.423 450 HA TYR 79 HA TYR 79 -4.075 2.324 -10.505 451 1HB TYR 79 2HB TYR 79 -2.804 0.485 -9.526 452 2HB TYR 79 1HB TYR 79 -3.536 1.432 -8.245 453 HD1 TYR 79 1HD TYR 79 -2.940 -1.812 -9.478 454 HD2 TYR 79 2HD TYR 79 -5.828 0.439 -7.306 455 HE1 TYR 79 1HE TYR 79 -3.832 -3.892 -8.516 456 HE2 TYR 79 2HE TYR 79 -6.719 -1.653 -6.343 457 HH TYR 79 HH TYR 79 -5.085 -4.612 -6.582 458 H VAL 80 H VAL 80 -3.232 0.795 -12.055 459 HA VAL 80 HA VAL 80 -5.431 -0.689 -13.266 460 HB VAL 80 HB VAL 80 -2.942 0.478 -14.560 461 1HG1 VAL 80 1HG1 VAL 80 -3.939 -0.213 -16.677 462 2HG1 VAL 80 2HG1 VAL 80 -5.267 -0.983 -15.810 463 3HG1 VAL 80 3HG1 VAL 80 -3.628 -1.608 -15.643 464 1HG2 VAL 80 1HG2 VAL 80 -4.519 1.966 -15.706 465 2HG2 VAL 80 2HG2 VAL 80 -4.599 2.168 -13.953 466 3HG2 VAL 80 3HG2 VAL 80 -5.847 1.245 -14.792 467 H HIS 81 H HIS 81 -5.298 -2.766 -13.138 468 HA HIS 81 HA HIS 81 -2.663 -4.039 -12.858 469 1HB HIS 81 2HB HIS 81 -3.775 -3.933 -10.649 470 2HB HIS 81 1HB HIS 81 -5.176 -4.754 -11.310 471 HD1 HIS 81 1HD HIS 81 -1.827 -5.321 -9.902 472 HD2 HIS 81 2HD HIS 81 -4.740 -7.554 -11.834 473 HE1 HIS 81 1HE HIS 81 -1.230 -7.732 -9.478 474 HE2 HIS 81 2HE HIS 81 -2.800 -8.995 -10.991 475 H ASP 82 H ASP 82 -2.362 -5.606 -14.281 476 HA ASP 82 HA ASP 82 -2.634 -7.114 -15.968 477 1HB ASP 82 2HB ASP 82 -4.136 -8.191 -14.164 478 2HB ASP 82 1HB ASP 82 -5.487 -7.462 -14.994 479 H GLY 83 H GLY 83 -3.248 -4.319 -16.278 480 1HA GLY 83 2HA GLY 83 -3.890 -2.967 -18.044 481 2HA GLY 83 1HA GLY 83 -4.523 -4.397 -18.849 482 H GLU 84 H GLU 84 -5.810 -4.403 -15.834 483 HA GLU 84 HA GLU 84 -8.293 -3.218 -16.797 484 1HB GLU 84 2HB GLU 84 -7.707 -5.209 -14.660 485 2HB GLU 84 1HB GLU 84 -9.295 -4.491 -14.905 486 1HG GLU 84 2HG GLU 84 -7.753 -5.974 -16.954 487 2HG GLU 84 1HG GLU 84 -9.012 -6.692 -15.908 488 H ALA 85 H ALA 85 -9.527 -2.106 -15.453 489 HA ALA 85 HA ALA 85 -8.070 -0.207 -13.786 490 1HB ALA 85 1HB ALA 85 -10.993 -0.245 -14.533 491 2HB ALA 85 2HB ALA 85 -9.726 0.639 -15.378 492 3HB ALA 85 3HB ALA 85 -10.151 1.073 -13.720 493 H LYS 86 H LYS 86 -7.781 -0.580 -11.706 494 HA LYS 86 HA LYS 86 -9.796 -2.102 -10.242 495 1HB LYS 86 2HB LYS 86 -6.830 -2.120 -10.154 496 2HB LYS 86 1HB LYS 86 -7.694 -2.364 -8.655 497 1HG LYS 86 2HG LYS 86 -7.005 -4.453 -9.682 498 2HG LYS 86 1HG LYS 86 -8.753 -4.330 -9.561 499 1HD LYS 86 2HD LYS 86 -8.901 -3.818 -11.917 500 2HD LYS 86 1HD LYS 86 -7.138 -3.809 -12.048 501 1HE LYS 86 2HE LYS 86 -8.172 -5.926 -12.807 502 2HE LYS 86 1HE LYS 86 -7.027 -6.133 -11.479 503 1HZ LYS 86 1HZ LYS 86 -9.984 -6.049 -11.230 504 2HZ LYS 86 2HZ LYS 86 -8.911 -6.278 -9.947 505 3HZ LYS 86 3HZ LYS 86 -9.029 -7.431 -11.168 506 H VAL 87 H VAL 87 -10.436 -1.305 -8.279 507 HA VAL 87 HA VAL 87 -9.296 1.264 -7.417 508 HB VAL 87 HB VAL 87 -12.052 0.138 -6.790 509 1HG1 VAL 87 1HG1 VAL 87 -10.892 2.870 -6.242 510 2HG1 VAL 87 2HG1 VAL 87 -11.218 1.619 -5.049 511 3HG1 VAL 87 3HG1 VAL 87 -12.553 2.384 -5.912 512 1HG2 VAL 87 1HG2 VAL 87 -11.324 2.321 -8.742 513 2HG2 VAL 87 2HG2 VAL 87 -12.966 1.862 -8.284 514 3HG2 VAL 87 3HG2 VAL 87 -11.939 0.719 -9.149 515 H ALA 88 H ALA 88 -8.405 1.211 -5.421 516 HA ALA 88 HA ALA 88 -8.612 -1.327 -3.977 517 1HB ALA 88 1HB ALA 88 -6.330 -0.787 -4.716 518 2HB ALA 88 2HB ALA 88 -6.473 -0.739 -2.964 519 3HB ALA 88 3HB ALA 88 -6.446 0.759 -3.885 520 H LYS 89 H LYS 89 -9.861 -1.227 -2.324 521 HA LYS 89 HA LYS 89 -10.073 1.303 -0.975 522 1HB LYS 89 2HB LYS 89 -11.964 -1.067 -0.998 523 2HB LYS 89 1HB LYS 89 -12.239 0.366 -0.033 524 1HG LYS 89 2HG LYS 89 -12.225 1.722 -2.127 525 2HG LYS 89 1HG LYS 89 -12.118 0.220 -3.040 526 1HD LYS 89 2HD LYS 89 -14.258 -0.488 -2.208 527 2HD LYS 89 1HD LYS 89 -14.362 0.918 -1.129 528 1HE LYS 89 2HE LYS 89 -14.363 2.365 -3.113 529 2HE LYS 89 1HE LYS 89 -14.285 0.936 -4.147 530 1HZ LYS 89 1HZ LYS 89 -16.519 1.642 -2.304 531 2HZ LYS 89 2HZ LYS 89 -16.390 0.220 -3.196 532 3HZ LYS 89 3HZ LYS 89 -16.537 1.696 -4.003 533 H GLU 90 H GLU 90 -9.330 1.531 1.091 534 HA GLU 90 HA GLU 90 -8.007 -0.803 2.272 535 1HB GLU 90 2HB GLU 90 -6.082 0.639 2.726 536 2HB GLU 90 1HB GLU 90 -6.373 0.522 0.993 537 1HG GLU 90 2HG GLU 90 -7.465 2.687 0.988 538 2HG GLU 90 1HG GLU 90 -7.327 2.794 2.723 539 H ARG 91 H ARG 91 -7.603 -0.530 4.477 540 HA ARG 91 HA ARG 91 -8.698 1.831 5.754 541 1HB ARG 91 2HB ARG 91 -10.270 -0.033 6.136 542 2HB ARG 91 1HB ARG 91 -8.966 -0.997 6.816 543 1HG ARG 91 2HG ARG 91 -8.687 0.709 8.592 544 2HG ARG 91 1HG ARG 91 -10.098 1.553 7.949 545 1HD ARG 91 2HD ARG 91 -11.436 -0.456 8.322 546 2HD ARG 91 1HD ARG 91 -10.035 -1.261 9.032 547 HE ARG 91 HE ARG 91 -11.497 1.024 10.159 548 1HH1 ARG 91 1HH1 ARG 91 -9.004 -1.496 10.618 549 2HH1 ARG 91 2HH1 ARG 91 -9.088 -1.383 12.311 550 1HH2 ARG 91 1HH2 ARG 91 -11.541 1.120 12.472 551 2HH2 ARG 91 2HH2 ARG 91 -10.523 0.095 13.391 552 H ILE 92 H ILE 92 -7.071 2.699 7.053 553 HA ILE 92 HA ILE 92 -4.646 1.178 7.417 554 HB ILE 92 HB ILE 92 -5.406 3.944 8.402 555 1HG1 ILE 92 2HG1 ILE 92 -3.566 2.995 6.194 556 2HG1 ILE 92 1HG1 ILE 92 -5.094 3.840 6.009 557 1HG2 ILE 92 1HG2 ILE 92 -3.047 4.229 9.053 558 2HG2 ILE 92 2HG2 ILE 92 -2.744 2.536 8.664 559 3HG2 ILE 92 3HG2 ILE 92 -3.837 2.954 9.983 560 1HD1 ILE 92 1HD1 ILE 92 -2.570 4.966 7.211 561 2HD1 ILE 92 2HD1 ILE 92 -4.086 5.836 7.073 562 3HD1 ILE 92 3HD1 ILE 92 -3.216 5.338 5.616 563 H GLU 93 H GLU 93 -4.228 -0.110 8.956 564 HA GLU 93 HA GLU 93 -6.023 -0.340 11.243 565 1HB GLU 93 2HB GLU 93 -3.643 -1.952 10.378 566 2HB GLU 93 1HB GLU 93 -4.701 -2.358 11.713 567 1HG GLU 93 2HG GLU 93 -5.523 -2.167 8.832 568 2HG GLU 93 1HG GLU 93 -5.118 -3.649 9.695 569 H ALA 94 H ALA 94 -2.651 0.263 10.451 570 HA ALA 94 HA ALA 94 -2.181 1.737 12.852 571 1HB ALA 94 1HB ALA 94 -0.291 0.327 13.561 572 2HB ALA 94 2HB ALA 94 -0.730 -0.843 12.315 573 3HB ALA 94 3HB ALA 94 -1.829 -0.541 13.661 574 H VAL 95 H VAL 95 -0.491 3.119 12.515 575 HA VAL 95 HA VAL 95 1.289 2.643 10.337 576 HB VAL 95 HB VAL 95 -0.499 3.801 9.160 577 1HG1 VAL 95 1HG1 VAL 95 -0.215 6.000 11.185 578 2HG1 VAL 95 2HG1 VAL 95 -1.598 4.923 10.966 579 3HG1 VAL 95 3HG1 VAL 95 -1.175 6.079 9.703 580 1HG2 VAL 95 1HG2 VAL 95 1.767 4.315 8.448 581 2HG2 VAL 95 2HG2 VAL 95 1.861 5.626 9.623 582 3HG2 VAL 95 3HG2 VAL 95 0.740 5.736 8.266 583 H GLU 96 H GLU 96 3.183 3.145 10.894 584 HA GLU 96 HA GLU 96 3.610 4.876 13.227 585 1HB GLU 96 2HB GLU 96 5.383 2.771 12.004 586 2HB GLU 96 1HB GLU 96 5.819 3.799 13.335 587 1HG GLU 96 2HG GLU 96 3.570 1.810 13.370 588 2HG GLU 96 1HG GLU 96 5.175 1.593 14.083 589 HA PRO 97 HA PRO 97 5.213 7.577 9.987 590 1HB PRO 97 2HB PRO 97 5.587 9.352 12.330 591 2HB PRO 97 1HB PRO 97 4.763 9.685 10.804 592 1HG PRO 97 2HG PRO 97 3.373 9.315 13.040 593 2HG PRO 97 1HG PRO 97 2.799 8.664 11.497 594 1HD PRO 97 2HD PRO 97 4.182 7.243 13.744 595 2HD PRO 97 1HD PRO 97 2.799 6.725 12.752 596 H ASP 98 H ASP 98 6.604 7.270 13.257 597 HA ASP 98 HA ASP 98 9.210 8.000 12.310 598 1HB ASP 98 2HB ASP 98 8.304 7.093 15.038 599 2HB ASP 98 1HB ASP 98 9.942 7.602 14.653 600 H LYS 99 H LYS 99 7.621 5.011 13.197 601 HA LYS 99 HA LYS 99 10.102 3.507 12.976 602 1HB LYS 99 2HB LYS 99 7.288 2.509 13.296 603 2HB LYS 99 1HB LYS 99 8.742 1.546 13.383 604 1HG LYS 99 2HG LYS 99 9.491 2.856 15.312 605 2HG LYS 99 1HG LYS 99 7.972 3.759 15.251 606 1HD LYS 99 2HD LYS 99 6.742 1.692 15.501 607 2HD LYS 99 1HD LYS 99 8.293 0.833 15.549 608 1HE LYS 99 2HE LYS 99 8.911 1.975 17.593 609 2HE LYS 99 1HE LYS 99 7.443 2.942 17.531 610 1HZ LYS 99 1HZ LYS 99 7.228 1.131 19.102 611 2HZ LYS 99 2HZ LYS 99 7.568 -0.003 17.910 612 3HZ LYS 99 3HZ LYS 99 6.153 0.889 17.830 613 H ASN 100 H ASN 100 7.815 4.708 10.928 614 HA ASN 100 HA ASN 100 7.074 4.362 8.884 615 1HB ASN 100 2HB ASN 100 9.399 4.934 8.329 616 2HB ASN 100 1HB ASN 100 9.855 3.237 8.446 617 1HD2 ASN 100 1HD2 ASN 100 10.600 3.309 6.336 618 2HD2 ASN 100 2HD2 ASN 100 9.499 3.314 4.991 619 H LEU 101 H LEU 101 5.629 2.925 9.850 620 HA LEU 101 HA LEU 101 5.733 0.221 8.701 621 1HB LEU 101 2HB LEU 101 6.264 0.047 11.085 622 2HB LEU 101 1HB LEU 101 4.863 1.016 11.480 623 HG LEU 101 HG LEU 101 3.431 -0.776 10.534 624 1HD1 LEU 101 1HD1 LEU 101 5.988 -2.321 10.495 625 2HD1 LEU 101 2HD1 LEU 101 4.994 -1.835 9.109 626 3HD1 LEU 101 3HD1 LEU 101 4.367 -2.989 10.286 627 1HD2 LEU 101 1HD2 LEU 101 3.626 -2.234 12.465 628 2HD2 LEU 101 2HD2 LEU 101 3.749 -0.530 12.903 629 3HD2 LEU 101 3HD2 LEU 101 5.207 -1.524 12.838 630 H ILE 102 H ILE 102 3.733 -0.396 7.866 631 HA ILE 102 HA ILE 102 1.407 1.112 8.622 632 HB ILE 102 HB ILE 102 2.158 2.525 6.907 633 1HG1 ILE 102 2HG1 ILE 102 0.438 2.297 5.101 634 2HG1 ILE 102 1HG1 ILE 102 0.041 0.707 5.735 635 1HG2 ILE 102 1HG2 ILE 102 2.733 1.754 4.618 636 2HG2 ILE 102 2HG2 ILE 102 2.589 0.104 5.217 637 3HG2 ILE 102 3HG2 ILE 102 3.818 1.146 5.882 638 1HD1 ILE 102 1HD1 ILE 102 -0.254 3.326 7.166 639 2HD1 ILE 102 2HD1 ILE 102 -0.639 1.740 7.842 640 3HD1 ILE 102 3HD1 ILE 102 -1.554 2.362 6.467 641 H THR 103 H THR 103 -0.115 -0.217 8.942 642 HA THR 103 HA THR 103 -0.216 -2.813 7.604 643 HB THR 103 HB THR 103 -1.784 -1.767 9.972 644 HG1 THR 103 1HG THR 103 0.216 -3.753 9.935 645 1HG2 THR 103 1HG2 THR 103 -2.455 -4.099 10.307 646 2HG2 THR 103 2HG2 THR 103 -1.574 -4.570 8.855 647 3HG2 THR 103 3HG2 THR 103 -2.986 -3.521 8.727 648 H PHE 104 H PHE 104 -1.513 -3.017 5.851 649 HA PHE 104 HA PHE 104 -3.750 -1.145 5.399 650 1HB PHE 104 2HB PHE 104 -2.303 -3.030 3.538 651 2HB PHE 104 1HB PHE 104 -3.608 -2.033 2.998 652 HD1 PHE 104 1HD PHE 104 -3.231 0.504 3.057 653 HD2 PHE 104 2HD PHE 104 -0.129 -2.363 3.546 654 HE1 PHE 104 1HE PHE 104 -1.562 2.191 2.390 655 HE2 PHE 104 2HE PHE 104 1.531 -0.690 2.891 656 HZ PHE 104 HZ PHE 104 0.842 1.569 2.313 657 H ARG 105 H ARG 105 -5.765 -1.940 5.701 658 HA ARG 105 HA ARG 105 -6.245 -4.851 5.394 659 1HB ARG 105 2HB ARG 105 -7.039 -3.845 7.546 660 2HB ARG 105 1HB ARG 105 -8.016 -2.712 6.624 661 1HG ARG 105 2HG ARG 105 -9.166 -4.735 5.604 662 2HG ARG 105 1HG ARG 105 -8.354 -5.691 6.837 663 1HD ARG 105 2HD ARG 105 -10.306 -3.431 7.300 664 2HD ARG 105 1HD ARG 105 -10.622 -5.149 7.512 665 HE ARG 105 HE ARG 105 -8.585 -3.760 9.100 666 1HH1 ARG 105 1HH1 ARG 105 -11.642 -5.540 8.972 667 2HH1 ARG 105 2HH1 ARG 105 -11.686 -5.853 10.640 668 1HH2 ARG 105 1HH2 ARG 105 -8.642 -4.159 11.346 669 2HH2 ARG 105 2HH2 ARG 105 -9.915 -5.031 12.073 670 H VAL 106 H VAL 106 -7.606 -5.479 3.624 671 HA VAL 106 HA VAL 106 -8.500 -3.275 1.972 672 HB VAL 106 HB VAL 106 -7.491 -5.473 0.979 673 1HG1 VAL 106 1HG1 VAL 106 -8.929 -7.348 0.704 674 2HG1 VAL 106 2HG1 VAL 106 -10.080 -6.622 1.816 675 3HG1 VAL 106 3HG1 VAL 106 -8.472 -7.049 2.398 676 1HG2 VAL 106 1HG2 VAL 106 -8.736 -3.909 -0.432 677 2HG2 VAL 106 2HG2 VAL 106 -10.245 -4.684 0.045 678 3HG2 VAL 106 3HG2 VAL 106 -9.051 -5.583 -0.892 679 H ILE 107 H ILE 107 -10.607 -2.545 2.034 680 HA ILE 107 HA ILE 107 -12.333 -4.228 3.684 681 HB ILE 107 HB ILE 107 -13.775 -2.417 4.332 682 1HG1 ILE 107 2HG1 ILE 107 -13.759 -1.095 2.138 683 2HG1 ILE 107 1HG1 ILE 107 -13.619 -0.141 3.608 684 1HG2 ILE 107 1HG2 ILE 107 -12.245 -0.920 5.500 685 2HG2 ILE 107 2HG2 ILE 107 -10.954 -1.432 4.417 686 3HG2 ILE 107 3HG2 ILE 107 -11.656 -2.596 5.556 687 1HD1 ILE 107 1HD1 ILE 107 -12.220 0.684 1.905 688 2HD1 ILE 107 2HD1 ILE 107 -11.412 -0.878 1.772 689 3HD1 ILE 107 3HD1 ILE 107 -11.268 0.074 3.253 690 H GLU 108 H GLU 108 -12.003 -2.906 0.606 691 HA GLU 108 HA GLU 108 -13.862 -4.840 -0.394 692 1HB GLU 108 2HB GLU 108 -15.350 -2.892 -0.043 693 2HB GLU 108 1HB GLU 108 -14.257 -1.896 -0.973 694 1HG GLU 108 2HG GLU 108 -14.703 -3.202 -2.984 695 2HG GLU 108 1HG GLU 108 -15.742 -4.280 -2.062 696 H GLY 109 H GLY 109 -13.295 -5.492 -2.482 697 1HA GLY 109 2HA GLY 109 -11.843 -4.093 -4.366 698 2HA GLY 109 1HA GLY 109 -10.650 -4.873 -3.329 699 H ASP 110 H ASP 110 -10.663 -5.663 -5.933 700 HA ASP 110 HA ASP 110 -12.529 -7.776 -6.390 701 1HB ASP 110 2HB ASP 110 -11.353 -8.348 -8.412 702 2HB ASP 110 1HB ASP 110 -11.358 -6.600 -8.295 703 H LEU 111 H LEU 111 -9.520 -7.576 -4.861 704 HA LEU 111 HA LEU 111 -8.678 -10.235 -4.874 705 1HB LEU 111 2HB LEU 111 -8.338 -8.184 -2.691 706 2HB LEU 111 1HB LEU 111 -7.427 -9.670 -2.825 707 HG LEU 111 HG LEU 111 -7.342 -7.371 -4.784 708 1HD1 LEU 111 1HD1 LEU 111 -5.069 -7.045 -3.966 709 2HD1 LEU 111 2HD1 LEU 111 -5.314 -8.323 -2.775 710 3HD1 LEU 111 3HD1 LEU 111 -6.260 -6.838 -2.682 711 1HD2 LEU 111 1HD2 LEU 111 -6.979 -9.513 -5.913 712 2HD2 LEU 111 2HD2 LEU 111 -5.754 -9.941 -4.717 713 3HD2 LEU 111 3HD2 LEU 111 -5.482 -8.590 -5.816 714 H MET 112 H MET 112 -11.300 -8.763 -3.140 715 HA MET 112 HA MET 112 -11.518 -10.756 -1.082 716 1HB MET 112 2HB MET 112 -13.519 -8.767 -2.111 717 2HB MET 112 1HB MET 112 -13.792 -9.805 -0.729 718 1HG MET 112 2HG MET 112 -11.545 -7.790 -0.829 719 2HG MET 112 1HG MET 112 -13.154 -7.362 -0.294 720 1HE MET 112 1HE MET 112 -10.819 -10.672 0.595 721 2HE MET 112 2HE MET 112 -10.222 -10.061 2.120 722 3HE MET 112 3HE MET 112 -9.780 -9.238 0.635 723 H LYS 113 H LYS 113 -12.119 -10.914 -4.348 724 HA LYS 113 HA LYS 113 -14.358 -12.772 -4.154 725 1HB LYS 113 2HB LYS 113 -12.742 -11.872 -6.546 726 2HB LYS 113 1HB LYS 113 -14.187 -12.869 -6.599 727 1HG LYS 113 2HG LYS 113 -14.066 -10.026 -5.608 728 2HG LYS 113 1HG LYS 113 -14.633 -10.534 -7.200 729 1HD LYS 113 2HD LYS 113 -16.402 -11.862 -6.115 730 2HD LYS 113 1HD LYS 113 -15.845 -11.293 -4.542 731 1HE LYS 113 2HE LYS 113 -17.770 -10.011 -5.314 732 2HE LYS 113 1HE LYS 113 -16.336 -8.998 -5.186 733 1HZ LYS 113 1HZ LYS 113 -17.601 -8.588 -7.238 734 2HZ LYS 113 2HZ LYS 113 -17.329 -10.186 -7.727 735 3HZ LYS 113 3HZ LYS 113 -16.046 -9.133 -7.573 736 H GLU 114 H GLU 114 -11.048 -12.851 -3.939 737 HA GLU 114 HA GLU 114 -10.913 -15.681 -4.737 738 1HB GLU 114 2HB GLU 114 -8.725 -13.583 -4.877 739 2HB GLU 114 1HB GLU 114 -8.559 -15.275 -5.329 740 1HG GLU 114 2HG GLU 114 -10.155 -15.009 -7.107 741 2HG GLU 114 1HG GLU 114 -10.452 -13.335 -6.646 742 H TYR 115 H TYR 115 -9.995 -13.191 -2.446 743 HA TYR 115 HA TYR 115 -9.147 -15.238 -0.518 744 1HB TYR 115 2HB TYR 115 -8.305 -12.323 -0.547 745 2HB TYR 115 1HB TYR 115 -7.584 -13.647 0.361 746 HD1 TYR 115 1HD TYR 115 -7.713 -11.893 -2.780 747 HD2 TYR 115 2HD TYR 115 -6.145 -15.319 -0.828 748 HE1 TYR 115 1HE TYR 115 -6.166 -12.211 -4.634 749 HE2 TYR 115 2HE TYR 115 -4.577 -15.647 -2.699 750 HH TYR 115 HH TYR 115 -4.121 -13.256 -5.088 751 H LYS 116 H LYS 116 -10.306 -15.125 1.348 752 HA LYS 116 HA LYS 116 -12.608 -13.361 1.314 753 1HB LYS 116 2HB LYS 116 -13.260 -14.620 3.406 754 2HB LYS 116 1HB LYS 116 -13.185 -15.542 1.915 755 1HG LYS 116 2HG LYS 116 -10.946 -16.349 2.573 756 2HG LYS 116 1HG LYS 116 -11.105 -15.461 4.083 757 1HD LYS 116 2HD LYS 116 -13.031 -17.541 3.145 758 2HD LYS 116 1HD LYS 116 -11.685 -17.912 4.237 759 1HE LYS 116 2HE LYS 116 -12.616 -16.217 5.825 760 2HE LYS 116 1HE LYS 116 -13.994 -16.017 4.750 761 1HZ LYS 116 1HZ LYS 116 -14.443 -17.532 6.603 762 2HZ LYS 116 2HZ LYS 116 -13.227 -18.552 6.088 763 3HZ LYS 116 3HZ LYS 116 -14.577 -18.326 5.113 764 H SER 117 H SER 117 -9.575 -13.160 2.586 765 HA SER 117 HA SER 117 -10.242 -10.705 3.895 766 1HB SER 117 2HB SER 117 -10.508 -12.285 5.662 767 2HB SER 117 1HB SER 117 -8.902 -12.984 5.347 768 HG SER 117 HG SER 117 -8.048 -11.427 6.461 769 H PHE 118 H PHE 118 -8.408 -9.325 3.848 770 HA PHE 118 HA PHE 118 -5.898 -10.440 3.015 771 1HB PHE 118 2HB PHE 118 -7.093 -9.996 0.861 772 2HB PHE 118 1HB PHE 118 -7.341 -8.344 1.369 773 HD1 PHE 118 1HD PHE 118 -4.673 -10.802 0.677 774 HD2 PHE 118 2HD PHE 118 -5.824 -6.717 0.777 775 HE1 PHE 118 1HE PHE 118 -2.560 -10.189 -0.377 776 HE2 PHE 118 2HE PHE 118 -3.703 -6.089 -0.285 777 HZ PHE 118 HZ PHE 118 -2.062 -7.824 -0.863 778 H LEU 119 H LEU 119 -4.601 -9.648 4.448 779 HA LEU 119 HA LEU 119 -4.782 -6.836 5.235 780 1HB LEU 119 2HB LEU 119 -5.685 -8.347 6.977 781 2HB LEU 119 1HB LEU 119 -4.195 -9.257 6.944 782 HG LEU 119 HG LEU 119 -2.996 -7.236 7.768 783 1HD1 LEU 119 1HD1 LEU 119 -4.302 -5.425 8.735 784 2HD1 LEU 119 2HD1 LEU 119 -5.778 -6.133 8.085 785 3HD1 LEU 119 3HD1 LEU 119 -4.530 -5.526 6.992 786 1HD2 LEU 119 1HD2 LEU 119 -3.814 -7.419 10.055 787 2HD2 LEU 119 2HD2 LEU 119 -3.696 -8.997 9.279 788 3HD2 LEU 119 3HD2 LEU 119 -5.270 -8.223 9.470 789 H LEU 120 H LEU 120 -2.780 -5.857 5.095 790 HA LEU 120 HA LEU 120 -0.460 -7.574 5.038 791 1HB LEU 120 2HB LEU 120 0.480 -6.631 3.005 792 2HB LEU 120 1HB LEU 120 -1.022 -7.449 2.687 793 HG LEU 120 HG LEU 120 -0.683 -4.438 2.797 794 1HD1 LEU 120 1HD1 LEU 120 -0.923 -4.527 0.391 795 2HD1 LEU 120 2HD1 LEU 120 -0.969 -6.292 0.448 796 3HD1 LEU 120 3HD1 LEU 120 0.492 -5.430 0.928 797 1HD2 LEU 120 1HD2 LEU 120 -2.960 -5.151 3.350 798 2HD2 LEU 120 2HD2 LEU 120 -3.012 -6.130 1.885 799 3HD2 LEU 120 3HD2 LEU 120 -2.904 -4.372 1.765 800 H THR 121 H THR 121 1.058 -6.828 6.201 801 HA THR 121 HA THR 121 1.087 -3.962 6.804 802 HB THR 121 HB THR 121 2.287 -6.237 8.410 803 HG1 THR 121 1HG THR 121 0.207 -6.383 8.902 804 1HG2 THR 121 1HG2 THR 121 3.474 -4.108 8.603 805 2HG2 THR 121 2HG2 THR 121 2.635 -4.512 10.112 806 3HG2 THR 121 3HG2 THR 121 1.977 -3.296 9.011 807 H ILE 122 H ILE 122 2.734 -2.831 6.016 808 HA ILE 122 HA ILE 122 5.060 -4.380 5.163 809 HB ILE 122 HB ILE 122 5.422 -2.892 3.298 810 1HG1 ILE 122 2HG1 ILE 122 2.982 -1.394 4.144 811 2HG1 ILE 122 1HG1 ILE 122 4.625 -0.812 4.447 812 1HG2 ILE 122 1HG2 ILE 122 3.691 -4.682 2.981 813 2HG2 ILE 122 2HG2 ILE 122 3.378 -3.250 1.991 814 3HG2 ILE 122 3HG2 ILE 122 2.476 -3.505 3.470 815 1HD1 ILE 122 1HD1 ILE 122 3.343 -1.286 1.748 816 2HD1 ILE 122 2HD1 ILE 122 5.000 -0.743 2.006 817 3HD1 ILE 122 3HD1 ILE 122 3.651 0.282 2.498 818 H GLN 123 H GLN 123 7.054 -3.543 5.584 819 HA GLN 123 HA GLN 123 7.201 -0.947 6.847 820 1HB GLN 123 2HB GLN 123 6.963 -2.691 8.670 821 2HB GLN 123 1HB GLN 123 8.476 -3.385 8.115 822 1HG GLN 123 2HG GLN 123 9.701 -1.448 8.729 823 2HG GLN 123 1HG GLN 123 8.228 -0.530 9.006 824 1HE2 GLN 123 1HE2 GLN 123 8.742 -0.014 11.092 825 2HE2 GLN 123 2HE2 GLN 123 8.738 -1.159 12.374 826 H VAL 124 H VAL 124 9.030 0.095 6.362 827 HA VAL 124 HA VAL 124 10.646 -1.232 4.300 828 HB VAL 124 HB VAL 124 10.455 1.727 4.815 829 1HG1 VAL 124 1HG1 VAL 124 11.192 1.952 2.512 830 2HG1 VAL 124 2HG1 VAL 124 11.277 0.194 2.376 831 3HG1 VAL 124 3HG1 VAL 124 12.334 1.043 3.502 832 1HG2 VAL 124 1HG2 VAL 124 8.194 0.973 4.378 833 2HG2 VAL 124 2HG2 VAL 124 8.725 0.119 2.932 834 3HG2 VAL 124 3HG2 VAL 124 8.802 1.881 2.995 835 H THR 125 H THR 125 12.791 -1.528 4.600 836 HA THR 125 HA THR 125 14.133 -0.057 6.750 837 HB THR 125 HB THR 125 13.571 -2.492 7.423 838 HG1 THR 125 1HG THR 125 16.107 -2.902 7.597 839 1HG2 THR 125 1HG2 THR 125 13.899 -3.486 5.170 840 2HG2 THR 125 2HG2 THR 125 14.899 -4.288 6.397 841 3HG2 THR 125 3HG2 THR 125 15.621 -3.088 5.323 842 HA PRO 126 HA PRO 126 17.112 1.117 3.578 843 1HB PRO 126 2HB PRO 126 19.482 0.659 4.898 844 2HB PRO 126 1HB PRO 126 18.459 2.074 5.173 845 1HG PRO 126 2HG PRO 126 18.415 -0.559 6.638 846 2HG PRO 126 1HG PRO 126 18.584 1.080 7.359 847 1HD PRO 126 2HD PRO 126 16.283 -0.079 7.389 848 2HD PRO 126 1HD PRO 126 16.334 1.578 6.729 849 H LYS 127 H LYS 127 18.701 0.274 2.067 850 HA LYS 127 HA LYS 127 18.689 -2.599 1.889 851 1HB LYS 127 2HB LYS 127 19.911 -0.546 0.011 852 2HB LYS 127 1HB LYS 127 19.958 -2.281 -0.266 853 1HG LYS 127 2HG LYS 127 17.508 -2.325 -0.299 854 2HG LYS 127 1HG LYS 127 17.486 -0.587 -0.054 855 1HD LYS 127 2HD LYS 127 17.085 -1.117 -2.357 856 2HD LYS 127 1HD LYS 127 18.643 -0.289 -2.206 857 1HE LYS 127 2HE LYS 127 19.784 -2.481 -2.362 858 2HE LYS 127 1HE LYS 127 18.219 -3.271 -2.505 859 1HZ LYS 127 1HZ LYS 127 19.398 -2.923 -4.623 860 2HZ LYS 127 2HZ LYS 127 19.268 -1.274 -4.437 861 3HZ LYS 127 3HZ LYS 127 17.876 -2.212 -4.670 862 HA PRO 128 HA PRO 128 22.526 -3.360 3.948 863 1HB PRO 128 2HB PRO 128 22.971 -5.451 1.899 864 2HB PRO 128 1HB PRO 128 22.909 -5.614 3.658 865 1HG PRO 128 2HG PRO 128 20.905 -6.486 2.150 866 2HG PRO 128 1HG PRO 128 20.583 -5.664 3.690 867 1HD PRO 128 2HD PRO 128 20.367 -4.600 0.897 868 2HD PRO 128 1HD PRO 128 19.303 -4.366 2.299 869 H GLY 129 H GLY 129 22.731 -3.588 0.381 870 1HA GLY 129 2HA GLY 129 25.239 -2.087 0.559 871 2HA GLY 129 1HA GLY 129 25.119 -3.529 -0.444 872 H GLY 130 H GLY 130 23.977 -0.259 0.006 873 1HA GLY 130 2HA GLY 130 24.183 0.868 -2.297 874 2HA GLY 130 1HA GLY 130 22.920 -0.281 -2.717 875 HA PRO 131 HA PRO 131 21.301 3.640 -0.392 876 1HB PRO 131 2HB PRO 131 20.794 5.302 -2.503 877 2HB PRO 131 1HB PRO 131 22.278 5.379 -1.546 878 1HG PRO 131 2HG PRO 131 21.789 4.063 -4.186 879 2HG PRO 131 1HG PRO 131 23.179 5.029 -3.665 880 1HD PRO 131 2HD PRO 131 23.267 2.341 -3.737 881 2HD PRO 131 1HD PRO 131 24.118 3.265 -2.487 882 H GLY 132 H GLY 132 19.312 3.040 0.045 883 1HA GLY 132 2HA GLY 132 17.050 3.417 -1.286 884 2HA GLY 132 1HA GLY 132 17.600 1.890 -1.978 885 H SER 133 H SER 133 15.568 1.095 -0.970 886 HA SER 133 HA SER 133 16.241 0.009 1.617 887 1HB SER 133 2HB SER 133 13.794 1.736 1.246 888 2HB SER 133 1HB SER 133 14.113 0.702 2.645 889 HG SER 133 HG SER 133 16.194 2.302 1.971 890 H ILE 134 H ILE 134 15.035 -1.788 2.235 891 HA ILE 134 HA ILE 134 13.503 -3.038 0.114 892 HB ILE 134 HB ILE 134 15.223 -4.164 2.284 893 1HG1 ILE 134 2HG1 ILE 134 15.582 -6.000 0.673 894 2HG1 ILE 134 1HG1 ILE 134 14.421 -5.248 -0.404 895 1HG2 ILE 134 1HG2 ILE 134 14.116 -6.316 2.349 896 2HG2 ILE 134 2HG2 ILE 134 12.731 -5.607 1.516 897 3HG2 ILE 134 3HG2 ILE 134 13.182 -5.024 3.131 898 1HD1 ILE 134 1HD1 ILE 134 15.803 -3.337 -0.554 899 2HD1 ILE 134 2HD1 ILE 134 16.624 -4.820 -1.071 900 3HD1 ILE 134 3HD1 ILE 134 16.988 -4.099 0.529 901 H VAL 135 H VAL 135 11.412 -3.043 0.341 902 HA VAL 135 HA VAL 135 10.328 -2.605 2.990 903 HB VAL 135 HB VAL 135 9.427 -1.027 1.379 904 1HG1 VAL 135 1HG1 VAL 135 8.598 -3.390 -0.263 905 2HG1 VAL 135 2HG1 VAL 135 9.860 -2.224 -0.665 906 3HG1 VAL 135 3HG1 VAL 135 8.170 -1.713 -0.595 907 1HG2 VAL 135 1HG2 VAL 135 7.377 -3.153 1.988 908 2HG2 VAL 135 2HG2 VAL 135 7.020 -1.485 1.532 909 3HG2 VAL 135 3HG2 VAL 135 7.844 -1.833 3.053 910 H HIS 136 H HIS 136 9.509 -4.151 4.115 911 HA HIS 136 HA HIS 136 9.277 -6.776 2.880 912 1HB HIS 136 2HB HIS 136 9.087 -5.893 5.760 913 2HB HIS 136 1HB HIS 136 8.700 -7.521 5.233 914 HD1 HIS 136 1HD HIS 136 10.607 -9.143 5.157 915 HD2 HIS 136 2HD HIS 136 11.858 -5.173 5.357 916 HE1 HIS 136 1HE HIS 136 13.070 -9.228 5.512 917 HE2 HIS 136 2HE HIS 136 13.625 -6.871 6.108 918 H TRP 137 H TRP 137 7.471 -7.144 1.904 919 HA TRP 137 HA TRP 137 5.044 -5.994 2.947 920 1HB TRP 137 2HB TRP 137 5.668 -7.695 0.547 921 2HB TRP 137 1HB TRP 137 4.050 -7.161 0.975 922 HD1 TRP 137 HD TRP 137 7.466 -5.592 -0.031 923 HE1 TRP 137 1HE TRP 137 6.929 -3.395 -1.283 924 HE3 TRP 137 3HE TRP 137 2.431 -5.595 0.487 925 HZ2 TRP 137 2HZ TRP 137 4.707 -1.900 -1.946 926 HZ3 TRP 137 3HZ TRP 137 1.128 -3.794 -0.462 927 HH2 TRP 137 HH TRP 137 2.214 -1.943 -1.669 928 H HIS 138 H HIS 138 4.002 -7.112 4.453 929 HA HIS 138 HA HIS 138 4.351 -10.019 4.482 930 1HB HIS 138 2HB HIS 138 5.302 -8.883 6.461 931 2HB HIS 138 1HB HIS 138 3.787 -8.043 6.714 932 HD1 HIS 138 1HD HIS 138 5.540 -11.262 7.332 933 HD2 HIS 138 2HD HIS 138 1.817 -9.550 7.862 934 HE1 HIS 138 1HE HIS 138 4.360 -12.763 8.956 935 HE2 HIS 138 2HE HIS 138 2.175 -11.574 9.433 936 H LEU 139 H LEU 139 2.612 -10.894 3.616 937 HA LEU 139 HA LEU 139 0.074 -9.453 3.838 938 1HB LEU 139 2HB LEU 139 0.900 -11.449 1.728 939 2HB LEU 139 1HB LEU 139 -0.611 -10.580 1.791 940 HG LEU 139 HG LEU 139 0.801 -8.454 1.473 941 1HD1 LEU 139 1HD1 LEU 139 2.983 -9.327 1.989 942 2HD1 LEU 139 2HD1 LEU 139 2.921 -8.749 0.322 943 3HD1 LEU 139 3HD1 LEU 139 2.861 -10.475 0.656 944 1HD2 LEU 139 1HD2 LEU 139 0.670 -10.509 -0.701 945 2HD2 LEU 139 2HD2 LEU 139 0.899 -8.776 -0.946 946 3HD2 LEU 139 3HD2 LEU 139 -0.608 -9.378 -0.251 947 H GLU 140 H GLU 140 -1.585 -10.454 4.685 948 HA GLU 140 HA GLU 140 -1.476 -13.330 5.052 949 1HB GLU 140 2HB GLU 140 -2.305 -11.257 7.093 950 2HB GLU 140 1HB GLU 140 -2.569 -12.988 7.268 951 1HG GLU 140 2HG GLU 140 -0.185 -13.401 7.245 952 2HG GLU 140 1HG GLU 140 0.127 -11.710 6.930 953 H TYR 141 H TYR 141 -3.226 -14.275 4.419 954 HA TYR 141 HA TYR 141 -5.704 -12.947 4.086 955 1HB TYR 141 2HB TYR 141 -5.781 -13.587 1.607 956 2HB TYR 141 1HB TYR 141 -4.877 -12.159 2.060 957 HD1 TYR 141 1HD TYR 141 -2.586 -11.973 1.562 958 HD2 TYR 141 2HD TYR 141 -4.500 -15.749 0.933 959 HE1 TYR 141 1HE TYR 141 -0.636 -12.779 0.276 960 HE2 TYR 141 2HE TYR 141 -2.602 -16.490 -0.338 961 HH TYR 141 HH TYR 141 0.369 -14.991 -0.357 962 H GLU 142 H GLU 142 -7.255 -14.562 3.085 963 HA GLU 142 HA GLU 142 -6.373 -17.266 3.857 964 1HB GLU 142 2HB GLU 142 -7.800 -16.323 5.621 965 2HB GLU 142 1HB GLU 142 -9.017 -15.890 4.445 966 1HG GLU 142 2HG GLU 142 -9.725 -17.810 5.690 967 2HG GLU 142 1HG GLU 142 -9.436 -18.252 4.012 968 H LYS 143 H LYS 143 -6.845 -18.727 2.213 969 HA LYS 143 HA LYS 143 -7.975 -17.734 -0.227 970 1HB LYS 143 2HB LYS 143 -7.005 -20.496 0.512 971 2HB LYS 143 1HB LYS 143 -7.837 -20.197 -0.992 972 1HG LYS 143 2HG LYS 143 -5.485 -20.314 -1.372 973 2HG LYS 143 1HG LYS 143 -6.009 -18.657 -1.626 974 1HD LYS 143 2HD LYS 143 -5.109 -18.036 0.542 975 2HD LYS 143 1HD LYS 143 -4.664 -19.718 0.856 976 1HE LYS 143 2HE LYS 143 -3.627 -18.050 -1.429 977 2HE LYS 143 1HE LYS 143 -2.745 -18.344 0.070 978 1HZ LYS 143 1HZ LYS 143 -1.993 -19.818 -1.693 979 2HZ LYS 143 2HZ LYS 143 -3.541 -20.415 -1.921 980 3HZ LYS 143 3HZ LYS 143 -2.711 -20.719 -0.482 981 H ILE 144 H ILE 144 -10.007 -17.995 -0.996 982 HA ILE 144 HA ILE 144 -12.051 -19.113 0.687 983 HB ILE 144 HB ILE 144 -12.139 -18.178 -2.203 984 1HG1 ILE 144 2HG1 ILE 144 -12.937 -16.807 0.357 985 2HG1 ILE 144 1HG1 ILE 144 -11.518 -16.431 -0.612 986 1HG2 ILE 144 1HG2 ILE 144 -14.427 -18.752 -0.316 987 2HG2 ILE 144 2HG2 ILE 144 -13.984 -19.717 -1.726 988 3HG2 ILE 144 3HG2 ILE 144 -14.574 -18.068 -1.933 989 1HD1 ILE 144 1HD1 ILE 144 -13.266 -14.826 -0.961 990 2HD1 ILE 144 2HD1 ILE 144 -14.381 -16.123 -1.408 991 3HD1 ILE 144 3HD1 ILE 144 -12.987 -15.758 -2.448 992 H SER 145 H SER 145 -10.334 -19.976 -2.187 993 HA SER 145 HA SER 145 -10.736 -22.762 -1.768 994 1HB SER 145 2HB SER 145 -12.716 -22.152 -3.146 995 2HB SER 145 1HB SER 145 -11.669 -21.359 -4.314 996 HG SER 145 HG SER 145 -11.720 -24.110 -3.641 997 H GLU 146 H GLU 146 -9.164 -23.893 -3.193 998 HA GLU 146 HA GLU 146 -6.631 -22.651 -3.203 999 1HB GLU 146 2HB GLU 146 -7.594 -24.927 -4.817 1000 2HB GLU 146 1HB GLU 146 -5.907 -24.544 -4.539 1001 1HG GLU 146 2HG GLU 146 -6.272 -24.962 -2.090 1002 2HG GLU 146 1HG GLU 146 -7.912 -25.460 -2.474 1003 H GLU 147 H GLU 147 -8.522 -23.784 -5.946 1004 HA GLU 147 HA GLU 147 -6.908 -22.731 -7.955 1005 1HB GLU 147 2HB GLU 147 -9.811 -23.510 -8.073 1006 2HB GLU 147 1HB GLU 147 -8.773 -23.255 -9.463 1007 1HG GLU 147 2HG GLU 147 -7.358 -25.121 -8.745 1008 2HG GLU 147 1HG GLU 147 -8.412 -25.372 -7.352 1009 H VAL 148 H VAL 148 -9.253 -21.187 -6.061 1010 HA VAL 148 HA VAL 148 -9.871 -19.226 -8.125 1011 HB VAL 148 HB VAL 148 -11.361 -18.070 -6.672 1012 1HG1 VAL 148 1HG1 VAL 148 -12.264 -20.006 -7.644 1013 2HG1 VAL 148 2HG1 VAL 148 -12.926 -19.812 -6.020 1014 3HG1 VAL 148 3HG1 VAL 148 -11.671 -21.014 -6.326 1015 1HG2 VAL 148 1HG2 VAL 148 -11.706 -18.677 -4.300 1016 2HG2 VAL 148 2HG2 VAL 148 -10.137 -17.966 -4.615 1017 3HG2 VAL 148 3HG2 VAL 148 -10.272 -19.714 -4.375 1018 H ALA 149 H ALA 149 -7.626 -19.475 -5.585 1019 HA ALA 149 HA ALA 149 -7.125 -16.620 -5.539 1020 1HB ALA 149 1HB ALA 149 -7.114 -17.841 -3.436 1021 2HB ALA 149 2HB ALA 149 -5.531 -17.146 -3.768 1022 3HB ALA 149 3HB ALA 149 -5.817 -18.867 -4.028 1023 H HIS 150 H HIS 150 -5.164 -15.691 -6.074 1024 HA HIS 150 HA HIS 150 -3.389 -17.309 -7.747 1025 1HB HIS 150 2HB HIS 150 -4.702 -14.707 -8.526 1026 2HB HIS 150 1HB HIS 150 -3.242 -15.257 -9.306 1027 HD1 HIS 150 1HD HIS 150 -3.568 -16.626 -11.311 1028 HD2 HIS 150 2HD HIS 150 -6.951 -16.590 -8.896 1029 HE1 HIS 150 1HE HIS 150 -5.345 -17.824 -12.616 1030 HE2 HIS 150 2HE HIS 150 -7.393 -17.772 -11.151 1031 HA PRO 151 HA PRO 151 -0.903 -15.130 -4.479 1032 1HB PRO 151 2HB PRO 151 0.976 -17.085 -5.763 1033 2HB PRO 151 1HB PRO 151 0.834 -16.629 -4.061 1034 1HG PRO 151 2HG PRO 151 -0.256 -18.891 -4.830 1035 2HG PRO 151 1HG PRO 151 -1.164 -17.803 -3.774 1036 1HD PRO 151 2HD PRO 151 -1.512 -18.283 -6.709 1037 2HD PRO 151 1HD PRO 151 -2.732 -18.010 -5.447 1038 H GLU 152 H GLU 152 -0.243 -15.663 -7.857 1039 HA GLU 152 HA GLU 152 1.945 -14.060 -8.418 1040 1HB GLU 152 2HB GLU 152 0.823 -13.659 -10.572 1041 2HB GLU 152 1HB GLU 152 1.014 -15.400 -10.171 1042 1HG GLU 152 2HG GLU 152 -1.352 -15.305 -9.442 1043 2HG GLU 152 1HG GLU 152 -1.435 -13.638 -10.012 1044 H THR 153 H THR 153 -1.402 -13.122 -7.923 1045 HA THR 153 HA THR 153 -1.250 -10.556 -9.042 1046 HB THR 153 HB THR 153 -3.397 -10.138 -7.885 1047 HG1 THR 153 1HG THR 153 -3.197 -12.790 -6.885 1048 1HG2 THR 153 1HG2 THR 153 -3.385 -11.306 -10.008 1049 2HG2 THR 153 2HG2 THR 153 -4.642 -11.995 -8.969 1050 3HG2 THR 153 3HG2 THR 153 -3.096 -12.832 -9.189 1051 H LEU 154 H LEU 154 -0.550 -11.816 -5.910 1052 HA LEU 154 HA LEU 154 -0.643 -9.260 -4.642 1053 1HB LEU 154 2HB LEU 154 0.622 -11.784 -3.600 1054 2HB LEU 154 1HB LEU 154 0.310 -10.325 -2.686 1055 HG LEU 154 HG LEU 154 -1.338 -11.726 -2.015 1056 1HD1 LEU 154 1HD1 LEU 154 -2.622 -10.163 -4.221 1057 2HD1 LEU 154 2HD1 LEU 154 -2.305 -9.621 -2.574 1058 3HD1 LEU 154 3HD1 LEU 154 -3.469 -10.915 -2.871 1059 1HD2 LEU 154 1HD2 LEU 154 -1.766 -12.634 -4.843 1060 2HD2 LEU 154 2HD2 LEU 154 -2.735 -13.140 -3.448 1061 3HD2 LEU 154 3HD2 LEU 154 -1.012 -13.513 -3.507 1062 H LEU 155 H LEU 155 1.858 -11.302 -5.966 1063 HA LEU 155 HA LEU 155 4.005 -9.695 -5.115 1064 1HB LEU 155 2HB LEU 155 3.803 -11.569 -7.455 1065 2HB LEU 155 1HB LEU 155 5.291 -10.800 -6.935 1066 HG LEU 155 HG LEU 155 3.664 -12.783 -5.343 1067 1HD1 LEU 155 1HD1 LEU 155 6.357 -12.942 -6.626 1068 2HD1 LEU 155 2HD1 LEU 155 4.901 -13.779 -7.176 1069 3HD1 LEU 155 3HD1 LEU 155 5.630 -14.187 -5.607 1070 1HD2 LEU 155 1HD2 LEU 155 6.229 -11.355 -4.671 1071 2HD2 LEU 155 2HD2 LEU 155 5.551 -12.692 -3.752 1072 3HD2 LEU 155 3HD2 LEU 155 4.684 -11.155 -3.853 1073 H GLN 156 H GLN 156 2.016 -9.668 -7.997 1074 HA GLN 156 HA GLN 156 3.499 -7.502 -9.071 1075 1HB GLN 156 2HB GLN 156 0.758 -8.478 -9.825 1076 2HB GLN 156 1HB GLN 156 1.710 -7.305 -10.741 1077 1HG GLN 156 2HG GLN 156 3.502 -9.052 -10.904 1078 2HG GLN 156 1HG GLN 156 2.333 -10.190 -10.232 1079 1HE2 GLN 156 1HE2 GLN 156 3.202 -8.237 -12.887 1080 2HE2 GLN 156 2HE2 GLN 156 2.122 -8.951 -14.049 1081 H PHE 157 H PHE 157 0.593 -7.714 -7.107 1082 HA PHE 157 HA PHE 157 -0.245 -5.057 -7.178 1083 1HB PHE 157 2HB PHE 157 -1.573 -6.849 -6.124 1084 2HB PHE 157 1HB PHE 157 -0.356 -7.026 -4.874 1085 HD1 PHE 157 1HD PHE 157 -0.522 -5.764 -2.866 1086 HD2 PHE 157 2HD PHE 157 -2.827 -4.631 -6.271 1087 HE1 PHE 157 1HE PHE 157 -1.788 -4.110 -1.477 1088 HE2 PHE 157 2HE PHE 157 -4.057 -3.008 -4.894 1089 HZ PHE 157 HZ PHE 157 -3.534 -2.759 -2.509 1090 H CYS 158 H CYS 158 2.157 -6.640 -5.083 1091 HA CYS 158 HA CYS 158 2.645 -4.320 -3.588 1092 1HB CYS 158 2HB CYS 158 4.634 -5.425 -2.705 1093 2HB CYS 158 1HB CYS 158 3.274 -6.530 -2.733 1094 HG CYS 158 HG CYS 158 4.667 -7.266 -5.483 1095 H VAL 159 H VAL 159 3.962 -5.469 -6.607 1096 HA VAL 159 HA VAL 159 6.134 -3.673 -6.795 1097 HB VAL 159 HB VAL 159 4.475 -4.863 -9.052 1098 1HG1 VAL 159 1HG1 VAL 159 7.233 -3.646 -9.124 1099 2HG1 VAL 159 2HG1 VAL 159 5.758 -2.929 -9.775 1100 3HG1 VAL 159 3HG1 VAL 159 6.398 -4.417 -10.482 1101 1HG2 VAL 159 1HG2 VAL 159 7.073 -5.825 -7.859 1102 2HG2 VAL 159 2HG2 VAL 159 6.245 -6.521 -9.253 1103 3HG2 VAL 159 3HG2 VAL 159 5.490 -6.581 -7.657 1104 H GLU 160 H GLU 160 2.809 -3.525 -7.989 1105 HA GLU 160 HA GLU 160 2.960 -1.071 -9.304 1106 1HB GLU 160 2HB GLU 160 0.545 -2.340 -8.022 1107 2HB GLU 160 1HB GLU 160 0.526 -1.115 -9.288 1108 1HG GLU 160 2HG GLU 160 1.653 -2.640 -10.804 1109 2HG GLU 160 1HG GLU 160 1.706 -3.865 -9.544 1110 H VAL 161 H VAL 161 2.253 -1.790 -5.953 1111 HA VAL 161 HA VAL 161 1.641 0.940 -5.321 1112 HB VAL 161 HB VAL 161 2.352 -1.340 -3.476 1113 1HG1 VAL 161 1HG1 VAL 161 1.235 0.016 -1.710 1114 2HG1 VAL 161 2HG1 VAL 161 1.026 1.319 -2.879 1115 3HG1 VAL 161 3HG1 VAL 161 2.647 0.837 -2.378 1116 1HG2 VAL 161 1HG2 VAL 161 0.369 -1.843 -4.773 1117 2HG2 VAL 161 2HG2 VAL 161 -0.347 -0.295 -4.321 1118 3HG2 VAL 161 3HG2 VAL 161 -0.079 -1.534 -3.096 1119 H SER 162 H SER 162 4.521 -1.139 -5.099 1120 HA SER 162 HA SER 162 6.170 0.580 -3.632 1121 1HB SER 162 2HB SER 162 6.876 -1.498 -5.687 1122 2HB SER 162 1HB SER 162 8.025 -0.712 -4.595 1123 HG SER 162 HG SER 162 5.871 -2.430 -3.966 1124 H LYS 163 H LYS 163 5.383 0.437 -7.003 1125 HA LYS 163 HA LYS 163 7.341 2.054 -8.191 1126 1HB LYS 163 2HB LYS 163 4.387 1.958 -8.821 1127 2HB LYS 163 1HB LYS 163 5.613 2.611 -9.879 1128 1HG LYS 163 2HG LYS 163 6.557 0.350 -10.126 1129 2HG LYS 163 1HG LYS 163 5.303 -0.264 -9.045 1130 1HD LYS 163 2HD LYS 163 3.577 0.549 -10.585 1131 2HD LYS 163 1HD LYS 163 4.825 1.120 -11.686 1132 1HE LYS 163 2HE LYS 163 5.636 -1.167 -11.951 1133 2HE LYS 163 1HE LYS 163 4.389 -1.740 -10.847 1134 1HZ LYS 163 1HZ LYS 163 3.899 -0.430 -13.472 1135 2HZ LYS 163 2HZ LYS 163 2.700 -0.956 -12.423 1136 3HZ LYS 163 3HZ LYS 163 3.748 -2.071 -13.137 1137 H GLU 164 H GLU 164 4.170 2.840 -6.931 1138 HA GLU 164 HA GLU 164 4.076 5.570 -7.502 1139 1HB GLU 164 2HB GLU 164 2.178 3.993 -6.954 1140 2HB GLU 164 1HB GLU 164 2.675 4.146 -5.270 1141 1HG GLU 164 2HG GLU 164 0.817 5.610 -5.702 1142 2HG GLU 164 1HG GLU 164 2.268 6.567 -5.393 1143 H ILE 165 H ILE 165 4.760 3.853 -4.484 1144 HA ILE 165 HA ILE 165 5.037 6.238 -3.035 1145 HB ILE 165 HB ILE 165 4.354 4.229 -1.911 1146 1HG1 ILE 165 2HG1 ILE 165 5.794 4.307 0.082 1147 2HG1 ILE 165 1HG1 ILE 165 7.026 5.146 -0.852 1148 1HG2 ILE 165 1HG2 ILE 165 5.893 2.378 -1.400 1149 2HG2 ILE 165 2HG2 ILE 165 7.093 3.117 -2.464 1150 3HG2 ILE 165 3HG2 ILE 165 5.559 2.548 -3.124 1151 1HD1 ILE 165 1HD1 ILE 165 4.264 6.177 -0.268 1152 2HD1 ILE 165 2HD1 ILE 165 5.530 6.980 -1.210 1153 3HD1 ILE 165 3HD1 ILE 165 5.769 6.699 0.520 1154 H ASP 166 H ASP 166 7.342 4.077 -4.427 1155 HA ASP 166 HA ASP 166 9.704 5.284 -3.454 1156 1HB ASP 166 2HB ASP 166 9.812 3.108 -4.488 1157 2HB ASP 166 1HB ASP 166 9.239 3.750 -6.016 1158 H GLU 167 H GLU 167 7.989 5.904 -6.508 1159 HA GLU 167 HA GLU 167 9.726 8.110 -7.246 1160 1HB GLU 167 2HB GLU 167 8.107 8.545 -9.044 1161 2HB GLU 167 1HB GLU 167 8.580 6.856 -9.022 1162 1HG GLU 167 2HG GLU 167 6.472 6.329 -7.847 1163 2HG GLU 167 1HG GLU 167 6.005 8.018 -7.985 1164 H HIS 168 H HIS 168 6.872 7.934 -5.358 1165 HA HIS 168 HA HIS 168 6.448 10.746 -5.383 1166 1HB HIS 168 2HB HIS 168 4.737 9.034 -4.679 1167 2HB HIS 168 1HB HIS 168 5.677 8.772 -3.220 1168 HD1 HIS 168 1HD HIS 168 3.141 10.971 -4.714 1169 HD2 HIS 168 2HD HIS 168 5.636 11.014 -1.393 1170 HE1 HIS 168 1HE HIS 168 2.225 12.748 -3.209 1171 HE2 HIS 168 2HE HIS 168 3.491 12.377 -1.078 1172 H LEU 169 H LEU 169 8.386 8.571 -3.395 1173 HA LEU 169 HA LEU 169 9.219 10.622 -1.539 1174 1HB LEU 169 2HB LEU 169 10.330 7.869 -2.018 1175 2HB LEU 169 1HB LEU 169 10.775 8.925 -0.696 1176 HG LEU 169 HG LEU 169 8.061 7.688 -1.139 1177 1HD1 LEU 169 1HD1 LEU 169 10.187 7.126 0.916 1178 2HD1 LEU 169 2HD1 LEU 169 9.708 6.073 -0.419 1179 3HD1 LEU 169 3HD1 LEU 169 8.567 6.431 0.879 1180 1HD2 LEU 169 1HD2 LEU 169 7.520 8.594 1.085 1181 2HD2 LEU 169 2HD2 LEU 169 7.834 9.864 -0.093 1182 3HD2 LEU 169 3HD2 LEU 169 9.066 9.448 1.098 1183 H LEU 170 H LEU 170 10.582 9.183 -4.428 1184 HA LEU 170 HA LEU 170 13.077 10.612 -4.115 1185 1HB LEU 170 2HB LEU 170 11.925 9.148 -6.479 1186 2HB LEU 170 1HB LEU 170 13.559 9.762 -6.394 1187 HG LEU 170 HG LEU 170 12.402 7.596 -4.651 1188 1HD1 LEU 170 1HD1 LEU 170 12.742 6.943 -6.985 1189 2HD1 LEU 170 2HD1 LEU 170 13.835 6.121 -5.888 1190 3HD1 LEU 170 3HD1 LEU 170 14.430 7.461 -6.883 1191 1HD2 LEU 170 1HD2 LEU 170 14.726 7.285 -3.907 1192 2HD2 LEU 170 2HD2 LEU 170 14.110 8.874 -3.460 1193 3HD2 LEU 170 3HD2 LEU 170 15.208 8.701 -4.833 1194 H ALA 171 H ALA 171 10.176 10.888 -6.078 1195 HA ALA 171 HA ALA 171 9.211 12.477 -7.200 1196 1HB ALA 171 1HB ALA 171 9.226 14.688 -6.304 1197 2HB ALA 171 2HB ALA 171 10.736 14.337 -5.417 1198 3HB ALA 171 3HB ALA 171 9.261 13.446 -5.031 1199 H GLU 172 H GLU 172 12.098 11.668 -8.033 1200 HA GLU 172 HA GLU 172 13.376 11.918 -9.795 1201 1HB GLU 172 2HB GLU 172 11.229 13.760 -10.785 1202 2HB GLU 172 1HB GLU 172 12.504 12.933 -11.689 1203 1HG GLU 172 2HG GLU 172 11.557 10.835 -11.340 1204 2HG GLU 172 1HG GLU 172 10.423 11.453 -10.134 1205 H GLU 173 H GLU 173 14.664 13.378 -11.098 1206 HA GLU 173 HA GLU 173 15.296 15.881 -9.714 1207 1HB GLU 173 2HB GLU 173 16.933 14.152 -11.587 1208 2HB GLU 173 1HB GLU 173 17.392 15.801 -11.220 1209 1HG GLU 173 2HG GLU 173 18.679 14.207 -9.917 1210 2HG GLU 173 1HG GLU 173 17.667 15.188 -8.870 Start of MODEL 18 1 H THR 17 H THR 17 -2.745 -30.169 -1.942 2 HA THR 17 HA THR 17 -1.577 -29.421 -0.235 3 HB THR 17 HB THR 17 0.526 -28.708 -2.271 4 HG1 THR 17 1HG THR 17 1.107 -30.771 -2.150 5 1HG2 THR 17 1HG2 THR 17 0.711 -29.245 0.703 6 2HG2 THR 17 2HG2 THR 17 0.947 -27.680 -0.078 7 3HG2 THR 17 3HG2 THR 17 2.080 -28.998 -0.379 8 H GLU 18 H GLU 18 -2.723 -27.851 0.585 9 HA GLU 18 HA GLU 18 -1.614 -25.168 0.474 10 1HB GLU 18 2HB GLU 18 -4.583 -25.828 0.292 11 2HB GLU 18 1HB GLU 18 -3.982 -24.265 0.790 12 1HG GLU 18 2HG GLU 18 -3.457 -25.502 -1.909 13 2HG GLU 18 1HG GLU 18 -4.766 -24.372 -1.568 14 H ALA 19 H ALA 19 -2.712 -24.027 2.538 15 HA ALA 19 HA ALA 19 -2.226 -25.763 4.756 16 1HB ALA 19 1HB ALA 19 -3.415 -22.994 4.616 17 2HB ALA 19 2HB ALA 19 -1.720 -23.390 4.925 18 3HB ALA 19 3HB ALA 19 -2.959 -23.807 6.104 19 H SER 20 H SER 20 -3.759 -26.643 6.200 20 HA SER 20 HA SER 20 -6.226 -27.421 5.128 21 1HB SER 20 2HB SER 20 -5.319 -27.431 8.016 22 2HB SER 20 1HB SER 20 -6.702 -28.320 7.376 23 HG SER 20 HG SER 20 -5.415 -29.785 6.689 24 H SER 21 H SER 21 -5.320 -24.658 7.072 25 HA SER 21 HA SER 21 -8.056 -23.920 7.556 26 1HB SER 21 2HB SER 21 -6.944 -21.964 8.651 27 2HB SER 21 1HB SER 21 -6.479 -23.545 9.299 28 HG SER 21 HG SER 21 -4.689 -22.244 8.980 29 H LEU 22 H LEU 22 -6.053 -23.798 4.940 30 HA LEU 22 HA LEU 22 -5.736 -22.592 3.123 31 1HB LEU 22 2HB LEU 22 -8.509 -21.713 3.832 32 2HB LEU 22 1HB LEU 22 -7.732 -21.323 2.309 33 HG LEU 22 HG LEU 22 -8.178 -24.147 3.274 34 1HD1 LEU 22 1HD1 LEU 22 -9.974 -24.218 1.674 35 2HD1 LEU 22 2HD1 LEU 22 -9.771 -22.475 1.366 36 3HD1 LEU 22 3HD1 LEU 22 -10.245 -23.063 2.975 37 1HD2 LEU 22 1HD2 LEU 22 -7.723 -24.733 0.945 38 2HD2 LEU 22 2HD2 LEU 22 -6.343 -23.905 1.653 39 3HD2 LEU 22 3HD2 LEU 22 -7.422 -23.046 0.554 40 H VAL 23 H VAL 23 -5.045 -21.379 5.750 41 HA VAL 23 HA VAL 23 -5.021 -18.571 5.068 42 HB VAL 23 HB VAL 23 -3.787 -20.015 7.442 43 1HG1 VAL 23 1HG1 VAL 23 -2.607 -17.921 6.925 44 2HG1 VAL 23 2HG1 VAL 23 -3.535 -17.770 8.417 45 3HG1 VAL 23 3HG1 VAL 23 -4.143 -17.055 6.925 46 1HG2 VAL 23 1HG2 VAL 23 -6.240 -18.347 7.171 47 2HG2 VAL 23 2HG2 VAL 23 -5.631 -19.022 8.697 48 3HG2 VAL 23 3HG2 VAL 23 -6.214 -20.093 7.407 49 H GLY 24 H GLY 24 -3.546 -17.757 3.943 50 1HA GLY 24 2HA GLY 24 -0.970 -19.153 3.690 51 2HA GLY 24 1HA GLY 24 -1.800 -18.486 2.286 52 H LYS 25 H LYS 25 0.795 -17.815 3.205 53 HA LYS 25 HA LYS 25 0.388 -15.017 3.306 54 1HB LYS 25 2HB LYS 25 2.000 -14.716 5.221 55 2HB LYS 25 1HB LYS 25 0.423 -15.348 5.666 56 1HG LYS 25 2HG LYS 25 1.960 -16.531 6.958 57 2HG LYS 25 1HG LYS 25 1.488 -17.603 5.646 58 1HD LYS 25 2HD LYS 25 3.907 -17.774 5.985 59 2HD LYS 25 1HD LYS 25 3.551 -16.996 4.437 60 1HE LYS 25 2HE LYS 25 5.386 -15.858 5.570 61 2HE LYS 25 1HE LYS 25 4.000 -14.790 5.438 62 1HZ LYS 25 1HZ LYS 25 4.871 -16.301 7.826 63 2HZ LYS 25 2HZ LYS 25 3.466 -15.392 7.800 64 3HZ LYS 25 3HZ LYS 25 4.978 -14.634 7.619 65 H LEU 26 H LEU 26 2.162 -13.849 2.633 66 HA LEU 26 HA LEU 26 4.354 -15.437 1.551 67 1HB LEU 26 2HB LEU 26 2.485 -15.264 -0.133 68 2HB LEU 26 1HB LEU 26 2.677 -13.532 -0.106 69 HG LEU 26 HG LEU 26 4.821 -15.448 -1.041 70 1HD1 LEU 26 1HD1 LEU 26 4.145 -14.799 -3.295 71 2HD1 LEU 26 2HD1 LEU 26 2.795 -13.888 -2.621 72 3HD1 LEU 26 3HD1 LEU 26 2.853 -15.647 -2.433 73 1HD2 LEU 26 1HD2 LEU 26 5.683 -13.252 -0.407 74 2HD2 LEU 26 2HD2 LEU 26 4.486 -12.469 -1.430 75 3HD2 LEU 26 3HD2 LEU 26 5.756 -13.460 -2.156 76 H GLU 27 H GLU 27 6.244 -14.236 1.393 77 HA GLU 27 HA GLU 27 6.059 -11.452 2.297 78 1HB GLU 27 2HB GLU 27 6.799 -12.967 4.149 79 2HB GLU 27 1HB GLU 27 8.173 -13.438 3.161 80 1HG GLU 27 2HG GLU 27 8.962 -11.119 3.164 81 2HG GLU 27 1HG GLU 27 7.591 -10.662 4.165 82 H THR 28 H THR 28 7.417 -10.038 1.258 83 HA THR 28 HA THR 28 9.520 -11.051 -0.405 84 HB THR 28 HB THR 28 7.475 -11.201 -1.890 85 HG1 THR 28 1HG THR 28 9.275 -10.908 -2.999 86 1HG2 THR 28 1HG2 THR 28 6.195 -9.311 -0.961 87 2HG2 THR 28 2HG2 THR 28 6.431 -9.117 -2.697 88 3HG2 THR 28 3HG2 THR 28 7.407 -8.181 -1.571 89 H ASP 29 H ASP 29 10.796 -9.189 -1.287 90 HA ASP 29 HA ASP 29 10.321 -6.704 0.140 91 1HB ASP 29 2HB ASP 29 12.782 -6.415 0.425 92 2HB ASP 29 1HB ASP 29 12.163 -7.670 1.459 93 H VAL 30 H VAL 30 10.512 -4.972 -1.030 94 HA VAL 30 HA VAL 30 11.601 -5.315 -3.728 95 HB VAL 30 HB VAL 30 9.293 -3.492 -2.898 96 1HG1 VAL 30 1HG1 VAL 30 10.632 -2.464 -4.643 97 2HG1 VAL 30 2HG1 VAL 30 9.093 -3.037 -5.302 98 3HG1 VAL 30 3HG1 VAL 30 10.570 -3.950 -5.589 99 1HG2 VAL 30 1HG2 VAL 30 9.333 -5.941 -4.649 100 2HG2 VAL 30 2HG2 VAL 30 7.934 -4.914 -4.328 101 3HG2 VAL 30 3HG2 VAL 30 8.657 -5.857 -3.017 102 H GLU 31 H GLU 31 13.141 -3.961 -4.311 103 HA GLU 31 HA GLU 31 13.859 -2.020 -2.346 104 1HB GLU 31 2HB GLU 31 16.035 -1.766 -3.650 105 2HB GLU 31 1HB GLU 31 15.743 -3.265 -2.804 106 1HG GLU 31 2HG GLU 31 16.745 -3.817 -4.826 107 2HG GLU 31 1HG GLU 31 15.045 -4.253 -4.940 108 H ILE 32 H ILE 32 13.958 -0.018 -2.475 109 HA ILE 32 HA ILE 32 12.911 1.231 -4.894 110 HB ILE 32 HB ILE 32 11.670 2.831 -3.418 111 1HG1 ILE 32 2HG1 ILE 32 12.456 0.863 -1.250 112 2HG1 ILE 32 1HG1 ILE 32 12.922 2.551 -1.354 113 1HG2 ILE 32 1HG2 ILE 32 10.482 1.008 -4.497 114 2HG2 ILE 32 2HG2 ILE 32 9.801 1.318 -2.899 115 3HG2 ILE 32 3HG2 ILE 32 10.866 -0.064 -3.151 116 1HD1 ILE 32 1HD1 ILE 32 11.253 2.232 0.323 117 2HD1 ILE 32 2HD1 ILE 32 10.159 1.471 -0.830 118 3HD1 ILE 32 3HD1 ILE 32 10.553 3.191 -0.974 119 H LYS 33 H LYS 33 13.563 3.331 -5.261 120 HA LYS 33 HA LYS 33 16.276 3.920 -4.461 121 1HB LYS 33 2HB LYS 33 14.277 5.589 -5.971 122 2HB LYS 33 1HB LYS 33 16.015 5.855 -5.924 123 1HG LYS 33 2HG LYS 33 16.386 3.796 -7.135 124 2HG LYS 33 1HG LYS 33 14.657 3.432 -7.090 125 1HD LYS 33 2HD LYS 33 14.234 5.526 -8.329 126 2HD LYS 33 1HD LYS 33 15.970 5.774 -8.446 127 1HE LYS 33 2HE LYS 33 16.208 3.704 -9.702 128 2HE LYS 33 1HE LYS 33 14.480 3.392 -9.532 129 1HZ LYS 33 1HZ LYS 33 15.013 4.346 -11.686 130 2HZ LYS 33 2HZ LYS 33 15.677 5.707 -10.946 131 3HZ LYS 33 3HZ LYS 33 14.031 5.396 -10.800 132 H ALA 34 H ALA 34 13.186 4.591 -3.438 133 HA ALA 34 HA ALA 34 13.219 7.109 -2.309 134 1HB ALA 34 1HB ALA 34 11.790 4.648 -1.390 135 2HB ALA 34 2HB ALA 34 11.221 5.771 -2.623 136 3HB ALA 34 3HB ALA 34 11.379 6.300 -0.940 137 H SER 35 H SER 35 13.640 7.869 -0.272 138 HA SER 35 HA SER 35 15.652 6.444 1.231 139 1HB SER 35 2HB SER 35 14.503 9.206 1.347 140 2HB SER 35 1HB SER 35 15.864 8.731 2.341 141 HG SER 35 HG SER 35 16.299 8.067 -0.215 142 H ALA 36 H ALA 36 15.238 5.509 3.174 143 HA ALA 36 HA ALA 36 12.573 5.056 4.006 144 1HB ALA 36 1HB ALA 36 14.360 3.414 4.360 145 2HB ALA 36 2HB ALA 36 13.562 3.833 5.874 146 3HB ALA 36 3HB ALA 36 15.141 4.516 5.492 147 H ASP 37 H ASP 37 15.143 7.109 5.211 148 HA ASP 37 HA ASP 37 13.729 8.029 7.497 149 1HB ASP 37 2HB ASP 37 16.035 9.304 6.010 150 2HB ASP 37 1HB ASP 37 15.388 9.906 7.529 151 H LYS 38 H LYS 38 13.972 9.079 4.214 152 HA LYS 38 HA LYS 38 12.736 11.612 4.444 153 1HB LYS 38 2HB LYS 38 13.973 10.810 2.446 154 2HB LYS 38 1HB LYS 38 12.600 9.746 2.076 155 1HG LYS 38 2HG LYS 38 11.186 11.652 1.967 156 2HG LYS 38 1HG LYS 38 12.575 12.671 2.396 157 1HD LYS 38 2HD LYS 38 13.674 11.913 0.300 158 2HD LYS 38 1HD LYS 38 12.191 11.084 -0.155 159 1HE LYS 38 2HE LYS 38 12.416 13.923 0.599 160 2HE LYS 38 1HE LYS 38 12.359 13.358 -1.105 161 1HZ LYS 38 1HZ LYS 38 10.083 12.532 -0.620 162 2HZ LYS 38 2HZ LYS 38 10.207 14.178 -0.329 163 3HZ LYS 38 3HZ LYS 38 10.211 13.122 0.973 164 H PHE 39 H PHE 39 11.439 8.359 3.988 165 HA PHE 39 HA PHE 39 8.730 9.059 3.612 166 1HB PHE 39 2HB PHE 39 9.823 6.768 3.223 167 2HB PHE 39 1HB PHE 39 9.785 6.553 4.965 168 HD1 PHE 39 1HD PHE 39 8.070 6.028 1.937 169 HD2 PHE 39 2HD PHE 39 7.399 6.743 6.073 170 HE1 PHE 39 1HE PHE 39 5.805 5.083 1.732 171 HE2 PHE 39 2HE PHE 39 5.136 5.793 5.878 172 HZ PHE 39 HZ PHE 39 4.338 4.964 3.705 173 H HIS 40 H HIS 40 10.615 8.251 6.461 174 HA HIS 40 HA HIS 40 8.631 8.394 8.419 175 1HB HIS 40 2HB HIS 40 10.958 7.506 8.719 176 2HB HIS 40 1HB HIS 40 11.556 9.151 8.698 177 HD1 HIS 40 1HD HIS 40 10.957 6.575 11.013 178 HD2 HIS 40 2HD HIS 40 10.059 10.637 11.003 179 HE1 HIS 40 1HE HIS 40 10.665 7.197 13.393 180 HE2 HIS 40 2HE HIS 40 10.492 9.685 13.363 181 H HIS 41 H HIS 41 10.628 10.922 7.004 182 HA HIS 41 HA HIS 41 9.693 13.002 8.737 183 1HB HIS 41 2HB HIS 41 11.162 13.139 6.112 184 2HB HIS 41 1HB HIS 41 10.621 14.585 6.940 185 HD1 HIS 41 1HD HIS 41 12.391 15.606 8.323 186 HD2 HIS 41 2HD HIS 41 12.899 11.512 7.991 187 HE1 HIS 41 1HE HIS 41 14.551 15.103 9.477 188 HE2 HIS 41 2HE HIS 41 14.966 12.710 8.894 189 H MET 42 H MET 42 8.830 12.187 5.376 190 HA MET 42 HA MET 42 6.898 14.274 5.444 191 1HB MET 42 2HB MET 42 6.206 13.638 3.182 192 2HB MET 42 1HB MET 42 7.934 13.874 3.316 193 1HG MET 42 2HG MET 42 8.202 11.413 3.383 194 2HG MET 42 1HG MET 42 6.463 11.260 3.127 195 1HE MET 42 1HE MET 42 5.206 12.223 0.936 196 2HE MET 42 2HE MET 42 6.050 12.963 -0.424 197 3HE MET 42 3HE MET 42 5.979 13.799 1.120 198 H PHE 43 H PHE 43 6.723 10.961 6.297 199 HA PHE 43 HA PHE 43 3.868 10.873 6.142 200 1HB PHE 43 2HB PHE 43 5.281 8.806 6.109 201 2HB PHE 43 1HB PHE 43 5.746 9.129 7.773 202 HD1 PHE 43 1HD PHE 43 2.874 8.331 5.586 203 HD2 PHE 43 2HD PHE 43 4.375 8.442 9.570 204 HE1 PHE 43 1HE PHE 43 0.902 7.090 6.359 205 HE2 PHE 43 2HE PHE 43 2.406 7.197 10.349 206 HZ PHE 43 HZ PHE 43 0.661 6.520 8.734 207 H ALA 44 H ALA 44 6.198 12.058 8.391 208 HA ALA 44 HA ALA 44 4.342 12.286 10.592 209 1HB ALA 44 1HB ALA 44 6.743 11.936 11.020 210 2HB ALA 44 2HB ALA 44 6.180 13.447 11.736 211 3HB ALA 44 3HB ALA 44 7.104 13.473 10.235 212 H GLY 45 H GLY 45 5.150 13.999 7.824 213 1HA GLY 45 2HA GLY 45 3.735 16.390 8.793 214 2HA GLY 45 1HA GLY 45 4.965 16.415 7.524 215 H LYS 46 H LYS 46 1.862 15.070 8.349 216 HA LYS 46 HA LYS 46 1.295 14.092 5.753 217 1HB LYS 46 2HB LYS 46 -0.559 14.658 8.070 218 2HB LYS 46 1HB LYS 46 -0.991 13.744 6.631 219 1HG LYS 46 2HG LYS 46 0.650 12.054 7.158 220 2HG LYS 46 1HG LYS 46 1.196 12.978 8.552 221 1HD LYS 46 2HD LYS 46 -1.054 12.751 9.539 222 2HD LYS 46 1HD LYS 46 -1.537 11.769 8.155 223 1HE LYS 46 2HE LYS 46 -0.924 10.372 10.082 224 2HE LYS 46 1HE LYS 46 0.156 10.113 8.714 225 1HZ LYS 46 1HZ LYS 46 1.314 10.307 10.902 226 2HZ LYS 46 2HZ LYS 46 0.807 11.900 11.008 227 3HZ LYS 46 3HZ LYS 46 1.832 11.433 9.773 228 HA PRO 47 HA PRO 47 -0.002 17.721 3.568 229 1HB PRO 47 2HB PRO 47 -2.231 16.021 2.567 230 2HB PRO 47 1HB PRO 47 -1.052 16.970 1.657 231 1HG PRO 47 2HG PRO 47 -0.844 14.323 1.778 232 2HG PRO 47 1HG PRO 47 0.594 15.358 1.847 233 1HD PRO 47 2HD PRO 47 -0.790 13.894 4.052 234 2HD PRO 47 1HD PRO 47 0.943 14.181 3.783 235 H HIS 48 H HIS 48 -0.992 19.308 4.626 236 HA HIS 48 HA HIS 48 -3.363 18.669 6.130 237 1HB HIS 48 2HB HIS 48 -1.535 19.924 7.249 238 2HB HIS 48 1HB HIS 48 -1.726 21.222 6.081 239 HD1 HIS 48 1HD HIS 48 -3.003 19.962 9.288 240 HD2 HIS 48 2HD HIS 48 -4.191 22.683 6.396 241 HE1 HIS 48 1HE HIS 48 -4.731 21.395 10.385 242 HE2 HIS 48 2HE HIS 48 -5.203 23.196 8.679 243 H HIS 49 H HIS 49 -4.672 18.346 4.372 244 HA HIS 49 HA HIS 49 -6.169 18.767 2.784 245 1HB HIS 49 2HB HIS 49 -7.250 20.028 4.590 246 2HB HIS 49 1HB HIS 49 -6.381 21.491 4.112 247 HD1 HIS 49 1HD HIS 49 -8.857 22.530 3.872 248 HD2 HIS 49 2HD HIS 49 -7.864 19.514 1.223 249 HE1 HIS 49 1HE HIS 49 -10.614 22.619 2.100 250 HE2 HIS 49 2HE HIS 49 -10.204 20.531 0.775 251 H VAL 50 H VAL 50 -4.930 18.580 0.993 252 HA VAL 50 HA VAL 50 -4.236 21.102 -0.310 253 HB VAL 50 HB VAL 50 -2.327 19.959 -1.415 254 1HG1 VAL 50 1HG1 VAL 50 -0.810 19.887 0.514 255 2HG1 VAL 50 2HG1 VAL 50 -2.207 19.895 1.592 256 3HG1 VAL 50 3HG1 VAL 50 -1.879 21.288 0.562 257 1HG2 VAL 50 1HG2 VAL 50 -2.927 17.701 0.491 258 2HG2 VAL 50 2HG2 VAL 50 -1.509 17.806 -0.556 259 3HG2 VAL 50 3HG2 VAL 50 -3.122 17.655 -1.257 260 H SER 51 H SER 51 -4.324 20.999 -2.634 261 HA SER 51 HA SER 51 -5.420 18.730 -3.927 262 1HB SER 51 2HB SER 51 -7.483 19.659 -2.879 263 2HB SER 51 1HB SER 51 -7.177 21.200 -3.678 264 HG SER 51 HG SER 51 -7.252 18.942 -5.301 265 H LYS 52 H LYS 52 -3.709 18.893 -5.241 266 HA LYS 52 HA LYS 52 -3.908 20.393 -7.591 267 1HB LYS 52 2HB LYS 52 -3.074 22.273 -6.153 268 2HB LYS 52 1HB LYS 52 -1.682 21.272 -5.757 269 1HG LYS 52 2HG LYS 52 -1.022 21.257 -8.110 270 2HG LYS 52 1HG LYS 52 -2.397 22.290 -8.491 271 1HD LYS 52 2HD LYS 52 -0.372 23.620 -8.303 272 2HD LYS 52 1HD LYS 52 -1.494 24.003 -6.993 273 1HE LYS 52 2HE LYS 52 -0.268 22.638 -5.466 274 2HE LYS 52 1HE LYS 52 0.802 22.074 -6.744 275 1HZ LYS 52 1HZ LYS 52 1.649 24.314 -6.977 276 2HZ LYS 52 2HZ LYS 52 1.816 23.794 -5.390 277 3HZ LYS 52 3HZ LYS 52 0.588 24.881 -5.783 278 H ALA 53 H ALA 53 -1.202 19.427 -5.530 279 HA ALA 53 HA ALA 53 -0.121 17.873 -7.704 280 1HB ALA 53 1HB ALA 53 1.851 17.581 -6.282 281 2HB ALA 53 2HB ALA 53 0.997 18.347 -4.939 282 3HB ALA 53 3HB ALA 53 1.394 19.281 -6.380 283 H SER 54 H SER 54 -1.430 16.160 -7.940 284 HA SER 54 HA SER 54 -1.047 13.871 -6.407 285 1HB SER 54 2HB SER 54 -3.422 13.637 -5.538 286 2HB SER 54 1HB SER 54 -2.499 14.901 -4.727 287 HG SER 54 HG SER 54 -3.885 15.767 -6.947 288 HA PRO 55 HA PRO 55 -2.726 12.120 -10.203 289 1HB PRO 55 2HB PRO 55 -4.555 10.267 -9.167 290 2HB PRO 55 1HB PRO 55 -2.844 9.943 -9.447 291 1HG PRO 55 2HG PRO 55 -4.235 10.727 -6.918 292 2HG PRO 55 1HG PRO 55 -2.923 9.559 -7.154 293 1HD PRO 55 2HD PRO 55 -2.407 11.959 -6.150 294 2HD PRO 55 1HD PRO 55 -1.307 11.237 -7.339 295 H GLY 56 H GLY 56 -4.371 12.776 -11.521 296 1HA GLY 56 2HA GLY 56 -6.286 14.572 -10.380 297 2HA GLY 56 1HA GLY 56 -6.036 14.254 -12.085 298 H ASN 57 H ASN 57 -7.202 12.586 -9.206 299 HA ASN 57 HA ASN 57 -9.564 11.841 -10.769 300 1HB ASN 57 2HB ASN 57 -8.127 9.809 -10.384 301 2HB ASN 57 1HB ASN 57 -8.306 10.067 -8.650 302 1HD2 ASN 57 1HD2 ASN 57 -9.376 8.049 -8.367 303 2HD2 ASN 57 2HD2 ASN 57 -10.979 7.816 -8.914 304 H ILE 58 H ILE 58 -10.948 13.254 -10.032 305 HA ILE 58 HA ILE 58 -10.964 13.854 -7.209 306 HB ILE 58 HB ILE 58 -12.415 15.197 -9.506 307 1HG1 ILE 58 2HG1 ILE 58 -9.998 16.080 -7.904 308 2HG1 ILE 58 1HG1 ILE 58 -9.962 15.507 -9.563 309 1HG2 ILE 58 1HG2 ILE 58 -12.185 15.996 -6.598 310 2HG2 ILE 58 2HG2 ILE 58 -13.649 15.430 -7.406 311 3HG2 ILE 58 3HG2 ILE 58 -12.920 16.967 -7.875 312 1HD1 ILE 58 1HD1 ILE 58 -9.795 17.926 -9.455 313 2HD1 ILE 58 2HD1 ILE 58 -11.324 18.007 -8.582 314 3HD1 ILE 58 3HD1 ILE 58 -11.294 17.444 -10.252 315 H GLN 59 H GLN 59 -12.321 12.845 -5.984 316 HA GLN 59 HA GLN 59 -14.504 11.343 -7.136 317 1HB GLN 59 2HB GLN 59 -14.939 10.537 -4.844 318 2HB GLN 59 1HB GLN 59 -13.277 10.263 -5.343 319 1HG GLN 59 2HG GLN 59 -12.582 12.199 -4.009 320 2HG GLN 59 1HG GLN 59 -14.253 12.456 -3.517 321 1HE2 GLN 59 1HE2 GLN 59 -14.743 9.534 -3.293 322 2HE2 GLN 59 2HE2 GLN 59 -13.954 9.075 -1.832 323 H GLY 60 H GLY 60 -16.607 11.826 -7.097 324 1HA GLY 60 2HA GLY 60 -17.252 14.528 -6.177 325 2HA GLY 60 1HA GLY 60 -18.161 13.589 -7.358 326 H CYS 61 H CYS 61 -19.462 14.828 -5.349 327 HA CYS 61 HA CYS 61 -21.137 14.490 -3.920 328 1HB CYS 61 2HB CYS 61 -21.823 12.536 -5.171 329 2HB CYS 61 1HB CYS 61 -20.604 11.550 -4.377 330 HG CYS 61 HG CYS 61 -23.642 11.727 -3.610 331 H ASP 62 H ASP 62 -18.795 11.968 -3.038 332 HA ASP 62 HA ASP 62 -18.771 13.147 -0.349 333 1HB ASP 62 2HB ASP 62 -20.105 11.075 -0.375 334 2HB ASP 62 1HB ASP 62 -18.722 10.196 -1.011 335 H LEU 63 H LEU 63 -16.876 14.150 -0.473 336 HA LEU 63 HA LEU 63 -14.542 12.491 -1.051 337 1HB LEU 63 2HB LEU 63 -14.891 14.590 -2.476 338 2HB LEU 63 1HB LEU 63 -14.738 15.529 -1.014 339 HG LEU 63 HG LEU 63 -12.515 13.829 -2.200 340 1HD1 LEU 63 1HD1 LEU 63 -13.079 15.653 -3.682 341 2HD1 LEU 63 2HD1 LEU 63 -11.529 15.952 -2.897 342 3HD1 LEU 63 3HD1 LEU 63 -12.973 16.799 -2.346 343 1HD2 LEU 63 1HD2 LEU 63 -12.432 15.938 -0.031 344 2HD2 LEU 63 2HD2 LEU 63 -11.039 15.089 -0.704 345 3HD2 LEU 63 3HD2 LEU 63 -12.258 14.204 0.219 346 H HIS 64 H HIS 64 -14.143 11.615 0.871 347 HA HIS 64 HA HIS 64 -14.488 13.200 3.274 348 1HB HIS 64 2HB HIS 64 -15.264 10.804 3.080 349 2HB HIS 64 1HB HIS 64 -13.576 10.327 3.009 350 HD1 HIS 64 1HD HIS 64 -16.277 10.826 5.314 351 HD2 HIS 64 2HD HIS 64 -12.139 11.091 5.539 352 HE1 HIS 64 1HE HIS 64 -15.724 10.734 7.770 353 HE2 HIS 64 2HE HIS 64 -13.230 11.001 7.888 354 H GLU 65 H GLU 65 -12.806 14.100 4.308 355 HA GLU 65 HA GLU 65 -10.181 12.983 3.937 356 1HB GLU 65 2HB GLU 65 -10.357 14.697 2.169 357 2HB GLU 65 1HB GLU 65 -10.752 15.904 3.380 358 1HG GLU 65 2HG GLU 65 -8.521 15.434 4.422 359 2HG GLU 65 1HG GLU 65 -8.150 14.449 3.006 360 H GLY 66 H GLY 66 -10.912 16.216 5.148 361 1HA GLY 66 2HA GLY 66 -10.430 17.193 7.166 362 2HA GLY 66 1HA GLY 66 -11.452 15.906 7.786 363 H ASP 67 H ASP 67 -10.432 15.438 9.605 364 HA ASP 67 HA ASP 67 -7.692 14.464 9.406 365 1HB ASP 67 2HB ASP 67 -9.378 15.168 11.843 366 2HB ASP 67 1HB ASP 67 -7.777 14.442 11.931 367 H TRP 68 H TRP 68 -7.647 12.374 8.941 368 HA TRP 68 HA TRP 68 -10.099 10.838 9.274 369 1HB TRP 68 2HB TRP 68 -8.367 10.954 7.241 370 2HB TRP 68 1HB TRP 68 -7.593 9.671 8.153 371 HD1 TRP 68 HD TRP 68 -9.930 7.791 8.948 372 HE1 TRP 68 1HE TRP 68 -11.389 6.613 7.135 373 HE3 TRP 68 3HE TRP 68 -9.014 10.873 4.981 374 HZ2 TRP 68 2HZ TRP 68 -12.040 6.951 4.453 375 HZ3 TRP 68 3HZ TRP 68 -10.087 10.373 2.827 376 HH2 TRP 68 HH TRP 68 -11.565 8.455 2.569 377 H GLY 69 H GLY 69 -7.090 11.279 10.813 378 1HA GLY 69 2HA GLY 69 -6.686 10.520 13.029 379 2HA GLY 69 1HA GLY 69 -7.767 9.168 12.729 380 H THR 70 H THR 70 -5.760 9.591 10.146 381 HA THR 70 HA THR 70 -4.100 8.428 9.226 382 HB THR 70 HB THR 70 -3.091 7.954 12.060 383 HG1 THR 70 1HG THR 70 -3.053 10.093 11.792 384 1HG2 THR 70 1HG2 THR 70 -0.899 7.625 10.981 385 2HG2 THR 70 2HG2 THR 70 -1.644 7.847 9.398 386 3HG2 THR 70 3HG2 THR 70 -2.068 6.450 10.384 387 H VAL 71 H VAL 71 -4.470 6.412 12.164 388 HA VAL 71 HA VAL 71 -4.714 4.154 10.479 389 HB VAL 71 HB VAL 71 -3.577 3.804 12.588 390 1HG1 VAL 71 1HG1 VAL 71 -4.707 3.937 14.714 391 2HG1 VAL 71 2HG1 VAL 71 -6.138 4.584 13.869 392 3HG1 VAL 71 3HG1 VAL 71 -4.610 5.490 13.863 393 1HG2 VAL 71 1HG2 VAL 71 -6.228 2.385 12.593 394 2HG2 VAL 71 2HG2 VAL 71 -4.799 1.888 13.505 395 3HG2 VAL 71 3HG2 VAL 71 -4.777 1.871 11.740 396 H GLY 72 H GLY 72 -6.418 3.192 9.718 397 1HA GLY 72 2HA GLY 72 -8.704 2.652 9.686 398 2HA GLY 72 1HA GLY 72 -9.039 4.089 10.645 399 H SER 73 H SER 73 -6.811 5.137 8.550 400 HA SER 73 HA SER 73 -8.669 6.514 6.930 401 1HB SER 73 2HB SER 73 -6.433 7.444 7.531 402 2HB SER 73 1HB SER 73 -5.688 6.198 6.531 403 HG SER 73 HG SER 73 -5.889 8.130 5.367 404 H ILE 74 H ILE 74 -8.993 6.347 4.737 405 HA ILE 74 HA ILE 74 -8.365 3.773 3.535 406 HB ILE 74 HB ILE 74 -11.053 5.151 3.659 407 1HG1 ILE 74 2HG1 ILE 74 -10.137 2.433 4.531 408 2HG1 ILE 74 1HG1 ILE 74 -10.329 3.822 5.592 409 1HG2 ILE 74 1HG2 ILE 74 -11.886 3.324 2.285 410 2HG2 ILE 74 2HG2 ILE 74 -10.242 2.706 2.090 411 3HG2 ILE 74 3HG2 ILE 74 -10.683 4.281 1.413 412 1HD1 ILE 74 1HD1 ILE 74 -12.457 2.427 4.005 413 2HD1 ILE 74 2HD1 ILE 74 -12.728 3.839 5.037 414 3HD1 ILE 74 3HD1 ILE 74 -12.218 2.301 5.753 415 H VAL 75 H VAL 75 -7.310 4.175 1.742 416 HA VAL 75 HA VAL 75 -7.929 6.606 0.182 417 HB VAL 75 HB VAL 75 -5.153 5.391 0.520 418 1HG1 VAL 75 1HG1 VAL 75 -5.435 6.482 -1.630 419 2HG1 VAL 75 2HG1 VAL 75 -4.346 7.423 -0.610 420 3HG1 VAL 75 3HG1 VAL 75 -6.015 7.943 -0.832 421 1HG2 VAL 75 1HG2 VAL 75 -4.574 7.403 1.819 422 2HG2 VAL 75 2HG2 VAL 75 -5.832 6.451 2.606 423 3HG2 VAL 75 3HG2 VAL 75 -6.255 7.927 1.740 424 H PHE 76 H PHE 76 -7.766 6.342 -2.101 425 HA PHE 76 HA PHE 76 -7.502 3.561 -2.949 426 1HB PHE 76 2HB PHE 76 -9.580 5.538 -3.898 427 2HB PHE 76 1HB PHE 76 -9.299 3.953 -4.612 428 HD1 PHE 76 1HD PHE 76 -9.102 2.128 -2.622 429 HD2 PHE 76 2HD PHE 76 -11.473 5.622 -2.600 430 HE1 PHE 76 1HE PHE 76 -10.560 1.075 -0.991 431 HE2 PHE 76 2HE PHE 76 -12.993 4.598 -0.953 432 HZ PHE 76 HZ PHE 76 -12.553 2.308 -0.140 433 H TRP 77 H TRP 77 -6.189 3.224 -4.536 434 HA TRP 77 HA TRP 77 -5.233 5.532 -6.098 435 1HB TRP 77 2HB TRP 77 -3.943 2.833 -5.598 436 2HB TRP 77 1HB TRP 77 -3.319 4.015 -6.723 437 HD1 TRP 77 HD TRP 77 -4.475 5.864 -3.761 438 HE1 TRP 77 1HE TRP 77 -2.479 6.399 -2.187 439 HE3 TRP 77 3HE TRP 77 -0.968 2.744 -5.771 440 HZ2 TRP 77 2HZ TRP 77 0.195 5.607 -1.860 441 HZ3 TRP 77 3HZ TRP 77 1.279 2.692 -4.776 442 HH2 TRP 77 HH TRP 77 1.848 4.089 -2.862 443 H ASN 78 H ASN 78 -5.940 5.656 -8.080 444 HA ASN 78 HA ASN 78 -7.130 3.273 -9.356 445 1HB ASN 78 2HB ASN 78 -7.612 6.218 -9.922 446 2HB ASN 78 1HB ASN 78 -8.406 4.877 -10.732 447 1HD2 ASN 78 1HD2 ASN 78 -10.082 3.817 -9.691 448 2HD2 ASN 78 2HD2 ASN 78 -10.762 4.392 -8.210 449 H TYR 79 H TYR 79 -6.185 2.538 -11.209 450 HA TYR 79 HA TYR 79 -4.645 4.290 -12.864 451 1HB TYR 79 2HB TYR 79 -2.562 2.950 -12.712 452 2HB TYR 79 1HB TYR 79 -2.946 3.729 -11.186 453 HD1 TYR 79 1HD TYR 79 -2.234 0.646 -12.858 454 HD2 TYR 79 2HD TYR 79 -3.984 2.264 -9.335 455 HE1 TYR 79 1HE TYR 79 -2.002 -1.534 -11.745 456 HE2 TYR 79 2HE TYR 79 -3.753 0.087 -8.211 457 HH TYR 79 HH TYR 79 -1.833 -2.403 -9.460 458 H VAL 80 H VAL 80 -3.871 3.061 -14.813 459 HA VAL 80 HA VAL 80 -5.797 0.927 -15.376 460 HB VAL 80 HB VAL 80 -4.322 2.712 -17.344 461 1HG1 VAL 80 1HG1 VAL 80 -5.816 1.721 -19.043 462 2HG1 VAL 80 2HG1 VAL 80 -6.471 0.628 -17.829 463 3HG1 VAL 80 3HG1 VAL 80 -4.788 0.501 -18.302 464 1HG2 VAL 80 1HG2 VAL 80 -6.535 3.715 -17.765 465 2HG2 VAL 80 2HG2 VAL 80 -6.014 3.930 -16.089 466 3HG2 VAL 80 3HG2 VAL 80 -7.210 2.701 -16.481 467 H HIS 81 H HIS 81 -5.056 -1.000 -15.489 468 HA HIS 81 HA HIS 81 -2.339 -1.481 -16.417 469 1HB HIS 81 2HB HIS 81 -2.254 -1.303 -13.921 470 2HB HIS 81 1HB HIS 81 -3.408 -2.619 -13.811 471 HD1 HIS 81 1HD HIS 81 0.154 -1.889 -14.765 472 HD2 HIS 81 2HD HIS 81 -2.286 -5.145 -14.013 473 HE1 HIS 81 1HE HIS 81 1.686 -3.863 -14.684 474 HE2 HIS 81 2HE HIS 81 0.134 -5.798 -14.627 475 H ASP 82 H ASP 82 -2.238 -3.203 -17.690 476 HA ASP 82 HA ASP 82 -2.839 -4.900 -19.065 477 1HB ASP 82 2HB ASP 82 -4.884 -5.685 -16.945 478 2HB ASP 82 1HB ASP 82 -4.326 -6.679 -18.276 479 H GLY 83 H GLY 83 -4.123 -2.319 -19.073 480 1HA GLY 83 2HA GLY 83 -5.631 -1.281 -20.434 481 2HA GLY 83 1HA GLY 83 -6.284 -2.837 -20.899 482 H GLU 84 H GLU 84 -6.463 -3.157 -17.748 483 HA GLU 84 HA GLU 84 -9.187 -2.130 -17.650 484 1HB GLU 84 2HB GLU 84 -7.719 -4.102 -15.917 485 2HB GLU 84 1HB GLU 84 -9.250 -3.421 -15.444 486 1HG GLU 84 2HG GLU 84 -9.622 -5.585 -16.365 487 2HG GLU 84 1HG GLU 84 -10.284 -4.385 -17.454 488 H ALA 85 H ALA 85 -9.924 -0.869 -16.035 489 HA ALA 85 HA ALA 85 -7.981 0.800 -14.731 490 1HB ALA 85 1HB ALA 85 -11.003 0.714 -14.530 491 2HB ALA 85 2HB ALA 85 -10.068 1.790 -15.568 492 3HB ALA 85 3HB ALA 85 -9.973 1.953 -13.812 493 H LYS 86 H LYS 86 -7.081 0.160 -12.926 494 HA LYS 86 HA LYS 86 -8.561 -1.705 -11.277 495 1HB LYS 86 2HB LYS 86 -5.609 -1.714 -11.896 496 2HB LYS 86 1HB LYS 86 -6.349 -2.707 -10.639 497 1HG LYS 86 2HG LYS 86 -7.787 -3.758 -12.316 498 2HG LYS 86 1HG LYS 86 -7.031 -2.786 -13.569 499 1HD LYS 86 2HD LYS 86 -4.934 -3.863 -13.204 500 2HD LYS 86 1HD LYS 86 -5.587 -4.784 -11.824 501 1HE LYS 86 2HE LYS 86 -7.223 -5.769 -13.403 502 2HE LYS 86 1HE LYS 86 -6.408 -4.894 -14.692 503 1HZ LYS 86 1HZ LYS 86 -5.089 -6.953 -12.986 504 2HZ LYS 86 2HZ LYS 86 -4.429 -6.261 -14.396 505 3HZ LYS 86 3HZ LYS 86 -5.767 -7.244 -14.480 506 H VAL 87 H VAL 87 -8.263 -1.502 -9.027 507 HA VAL 87 HA VAL 87 -7.239 1.131 -8.256 508 HB VAL 87 HB VAL 87 -9.716 -0.214 -7.162 509 1HG1 VAL 87 1HG1 VAL 87 -8.701 2.591 -6.769 510 2HG1 VAL 87 2HG1 VAL 87 -8.702 1.292 -5.576 511 3HG1 VAL 87 3HG1 VAL 87 -10.228 1.957 -6.153 512 1HG2 VAL 87 1HG2 VAL 87 -9.575 2.018 -9.179 513 2HG2 VAL 87 2HG2 VAL 87 -11.047 1.462 -8.382 514 3HG2 VAL 87 3HG2 VAL 87 -10.167 0.381 -9.464 515 H ALA 88 H ALA 88 -6.413 1.185 -6.180 516 HA ALA 88 HA ALA 88 -5.967 -1.419 -4.927 517 1HB ALA 88 1HB ALA 88 -3.904 -0.207 -5.505 518 2HB ALA 88 2HB ALA 88 -4.094 -0.355 -3.758 519 3HB ALA 88 3HB ALA 88 -4.457 1.178 -4.548 520 H LYS 89 H LYS 89 -7.283 -1.794 -3.339 521 HA LYS 89 HA LYS 89 -8.454 0.476 -1.930 522 1HB LYS 89 2HB LYS 89 -9.505 -2.271 -2.477 523 2HB LYS 89 1HB LYS 89 -10.421 -1.151 -1.509 524 1HG LYS 89 2HG LYS 89 -10.319 0.402 -3.584 525 2HG LYS 89 1HG LYS 89 -9.723 -1.005 -4.453 526 1HD LYS 89 2HD LYS 89 -11.778 -2.208 -3.899 527 2HD LYS 89 1HD LYS 89 -12.420 -0.762 -3.062 528 1HE LYS 89 2HE LYS 89 -13.359 -0.906 -5.219 529 2HE LYS 89 1HE LYS 89 -12.116 0.349 -5.313 530 1HZ LYS 89 1HZ LYS 89 -11.820 -2.470 -6.144 531 2HZ LYS 89 2HZ LYS 89 -10.607 -1.334 -6.290 532 3HZ LYS 89 3HZ LYS 89 -12.012 -1.194 -7.222 533 H GLU 90 H GLU 90 -8.246 0.627 0.282 534 HA GLU 90 HA GLU 90 -6.959 -1.476 1.725 535 1HB GLU 90 2HB GLU 90 -5.010 -0.033 2.216 536 2HB GLU 90 1HB GLU 90 -5.083 -0.559 0.534 537 1HG GLU 90 2HG GLU 90 -6.056 1.583 -0.100 538 2HG GLU 90 1HG GLU 90 -5.993 2.108 1.564 539 H ARG 91 H ARG 91 -6.890 -0.997 3.880 540 HA ARG 91 HA ARG 91 -8.140 1.465 4.817 541 1HB ARG 91 2HB ARG 91 -9.721 -0.490 4.687 542 2HB ARG 91 1HB ARG 91 -8.684 -1.356 5.793 543 1HG ARG 91 2HG ARG 91 -10.154 1.187 6.453 544 2HG ARG 91 1HG ARG 91 -10.770 -0.438 6.747 545 1HD ARG 91 2HD ARG 91 -8.815 -0.817 8.247 546 2HD ARG 91 1HD ARG 91 -8.353 0.871 7.997 547 HE ARG 91 HE ARG 91 -11.004 0.863 8.782 548 1HH1 ARG 91 1HH1 ARG 91 -7.895 0.065 10.245 549 2HH1 ARG 91 2HH1 ARG 91 -8.442 0.280 11.846 550 1HH2 ARG 91 1HH2 ARG 91 -11.719 1.211 10.942 551 2HH2 ARG 91 2HH2 ARG 91 -10.663 0.967 12.254 552 H ILE 92 H ILE 92 -6.601 2.316 6.295 553 HA ILE 92 HA ILE 92 -4.289 0.815 7.013 554 HB ILE 92 HB ILE 92 -5.348 3.410 8.154 555 1HG1 ILE 92 2HG1 ILE 92 -3.125 2.781 6.188 556 2HG1 ILE 92 1HG1 ILE 92 -4.649 3.569 5.844 557 1HG2 ILE 92 1HG2 ILE 92 -3.136 3.741 9.228 558 2HG2 ILE 92 2HG2 ILE 92 -2.698 2.079 8.820 559 3HG2 ILE 92 3HG2 ILE 92 -4.033 2.405 9.919 560 1HD1 ILE 92 1HD1 ILE 92 -2.417 4.683 7.522 561 2HD1 ILE 92 2HD1 ILE 92 -3.955 5.480 7.235 562 3HD1 ILE 92 3HD1 ILE 92 -2.847 5.185 5.888 563 H GLU 93 H GLU 93 -3.978 -0.622 8.512 564 HA GLU 93 HA GLU 93 -6.120 -1.025 10.483 565 1HB GLU 93 2HB GLU 93 -5.568 -2.849 8.865 566 2HB GLU 93 1HB GLU 93 -3.968 -2.926 9.593 567 1HG GLU 93 2HG GLU 93 -5.402 -4.688 10.452 568 2HG GLU 93 1HG GLU 93 -4.966 -3.554 11.730 569 H ALA 94 H ALA 94 -2.598 -0.823 10.169 570 HA ALA 94 HA ALA 94 -2.426 -0.011 12.937 571 1HB ALA 94 1HB ALA 94 -0.611 -1.605 13.430 572 2HB ALA 94 2HB ALA 94 -0.822 -2.342 11.852 573 3HB ALA 94 3HB ALA 94 -2.111 -2.455 13.056 574 H VAL 95 H VAL 95 -0.579 1.247 13.307 575 HA VAL 95 HA VAL 95 1.214 1.648 11.085 576 HB VAL 95 HB VAL 95 -0.639 3.172 10.567 577 1HG1 VAL 95 1HG1 VAL 95 -0.104 4.443 13.240 578 2HG1 VAL 95 2HG1 VAL 95 -1.533 3.516 12.794 579 3HG1 VAL 95 3HG1 VAL 95 -1.204 5.066 12.011 580 1HG2 VAL 95 1HG2 VAL 95 1.831 4.615 11.517 581 2HG2 VAL 95 2HG2 VAL 95 0.625 5.273 10.411 582 3HG2 VAL 95 3HG2 VAL 95 1.594 3.873 9.936 583 H GLU 96 H GLU 96 3.208 2.267 11.737 584 HA GLU 96 HA GLU 96 3.457 3.306 14.468 585 1HB GLU 96 2HB GLU 96 4.333 0.822 14.283 586 2HB GLU 96 1HB GLU 96 5.556 1.511 13.226 587 1HG GLU 96 2HG GLU 96 6.323 1.141 15.317 588 2HG GLU 96 1HG GLU 96 6.423 2.838 14.878 589 HA PRO 97 HA PRO 97 5.275 6.382 11.686 590 1HB PRO 97 2HB PRO 97 5.419 7.901 14.216 591 2HB PRO 97 1HB PRO 97 4.662 8.358 12.685 592 1HG PRO 97 2HG PRO 97 3.184 7.702 14.810 593 2HG PRO 97 1HG PRO 97 2.698 7.233 13.170 594 1HD PRO 97 2HD PRO 97 4.000 5.584 15.304 595 2HD PRO 97 1HD PRO 97 2.686 5.157 14.182 596 H ASP 98 H ASP 98 6.374 5.237 14.796 597 HA ASP 98 HA ASP 98 8.969 6.422 14.581 598 1HB ASP 98 2HB ASP 98 7.926 4.316 16.467 599 2HB ASP 98 1HB ASP 98 9.526 5.035 16.576 600 H LYS 99 H LYS 99 7.567 3.367 13.813 601 HA LYS 99 HA LYS 99 10.195 2.202 13.298 602 1HB LYS 99 2HB LYS 99 7.479 0.946 13.178 603 2HB LYS 99 1HB LYS 99 9.007 0.123 12.926 604 1HG LYS 99 2HG LYS 99 9.686 0.773 15.130 605 2HG LYS 99 1HG LYS 99 8.131 1.456 15.481 606 1HD LYS 99 2HD LYS 99 7.140 -0.787 14.892 607 2HD LYS 99 1HD LYS 99 8.811 -1.354 14.775 608 1HE LYS 99 2HE LYS 99 7.918 -1.950 16.984 609 2HE LYS 99 1HE LYS 99 9.196 -0.744 17.107 610 1HZ LYS 99 1HZ LYS 99 7.311 -0.239 18.561 611 2HZ LYS 99 2HZ LYS 99 6.272 -0.122 17.261 612 3HZ LYS 99 3HZ LYS 99 7.532 0.978 17.447 613 H ASN 100 H ASN 100 8.017 4.033 11.710 614 HA ASN 100 HA ASN 100 7.359 4.447 9.560 615 1HB ASN 100 2HB ASN 100 9.956 4.551 9.414 616 2HB ASN 100 1HB ASN 100 9.859 2.949 8.690 617 1HD2 ASN 100 1HD2 ASN 100 8.877 2.771 6.651 618 2HD2 ASN 100 2HD2 ASN 100 8.724 4.146 5.598 619 H LEU 101 H LEU 101 5.993 2.557 10.565 620 HA LEU 101 HA LEU 101 5.978 0.162 8.814 621 1HB LEU 101 2HB LEU 101 6.546 -0.360 11.132 622 2HB LEU 101 1HB LEU 101 5.139 0.537 11.668 623 HG LEU 101 HG LEU 101 3.718 -1.114 10.462 624 1HD1 LEU 101 1HD1 LEU 101 6.267 -2.657 10.258 625 2HD1 LEU 101 2HD1 LEU 101 5.273 -2.012 8.934 626 3HD1 LEU 101 3HD1 LEU 101 4.643 -3.283 9.975 627 1HD2 LEU 101 1HD2 LEU 101 3.881 -2.813 12.196 628 2HD2 LEU 101 2HD2 LEU 101 3.939 -1.188 12.851 629 3HD2 LEU 101 3HD2 LEU 101 5.428 -2.144 12.725 630 H ILE 102 H ILE 102 4.017 -0.363 7.900 631 HA ILE 102 HA ILE 102 1.636 0.903 8.890 632 HB ILE 102 HB ILE 102 2.387 2.512 7.317 633 1HG1 ILE 102 2HG1 ILE 102 0.522 2.509 5.640 634 2HG1 ILE 102 1HG1 ILE 102 0.127 0.878 6.167 635 1HG2 ILE 102 1HG2 ILE 102 2.736 1.958 4.889 636 2HG2 ILE 102 2HG2 ILE 102 2.625 0.261 5.365 637 3HG2 ILE 102 3HG2 ILE 102 3.918 1.249 5.999 638 1HD1 ILE 102 1HD1 ILE 102 0.100 3.336 7.894 639 2HD1 ILE 102 2HD1 ILE 102 -0.325 1.705 8.410 640 3HD1 ILE 102 3HD1 ILE 102 -1.307 2.536 7.200 641 H THR 103 H THR 103 0.091 -0.497 8.966 642 HA THR 103 HA THR 103 0.208 -2.985 7.409 643 HB THR 103 HB THR 103 -1.477 -2.280 9.813 644 HG1 THR 103 1HG THR 103 1.086 -2.701 9.700 645 1HG2 THR 103 1HG2 THR 103 -1.835 -4.701 9.972 646 2HG2 THR 103 2HG2 THR 103 -0.839 -4.943 8.534 647 3HG2 THR 103 3HG2 THR 103 -2.371 -4.088 8.403 648 H PHE 104 H PHE 104 -1.158 -3.120 5.690 649 HA PHE 104 HA PHE 104 -3.486 -1.332 5.570 650 1HB PHE 104 2HB PHE 104 -2.139 -2.940 3.403 651 2HB PHE 104 1HB PHE 104 -3.467 -1.844 3.136 652 HD1 PHE 104 1HD PHE 104 -2.997 0.656 3.677 653 HD2 PHE 104 2HD PHE 104 0.011 -2.306 3.200 654 HE1 PHE 104 1HE PHE 104 -1.339 2.414 3.172 655 HE2 PHE 104 2HE PHE 104 1.655 -0.570 2.702 656 HZ PHE 104 HZ PHE 104 1.010 1.769 2.684 657 H ARG 105 H ARG 105 -5.492 -2.243 5.598 658 HA ARG 105 HA ARG 105 -5.691 -5.151 5.278 659 1HB ARG 105 2HB ARG 105 -6.665 -4.280 7.369 660 2HB ARG 105 1HB ARG 105 -7.620 -3.123 6.450 661 1HG ARG 105 2HG ARG 105 -8.710 -5.057 5.301 662 2HG ARG 105 1HG ARG 105 -7.878 -6.117 6.438 663 1HD ARG 105 2HD ARG 105 -9.006 -4.958 8.300 664 2HD ARG 105 1HD ARG 105 -9.800 -3.921 7.098 665 HE ARG 105 HE ARG 105 -10.333 -6.513 6.373 666 1HH1 ARG 105 1HH1 ARG 105 -11.103 -4.437 9.131 667 2HH1 ARG 105 2HH1 ARG 105 -12.597 -5.196 9.453 668 1HH2 ARG 105 1HH2 ARG 105 -12.403 -7.528 6.808 669 2HH2 ARG 105 2HH2 ARG 105 -13.354 -6.966 8.104 670 H VAL 106 H VAL 106 -6.407 -5.704 3.260 671 HA VAL 106 HA VAL 106 -7.448 -3.588 1.619 672 HB VAL 106 HB VAL 106 -6.857 -6.506 1.056 673 1HG1 VAL 106 1HG1 VAL 106 -7.334 -6.045 -1.273 674 2HG1 VAL 106 2HG1 VAL 106 -7.838 -4.400 -0.878 675 3HG1 VAL 106 3HG1 VAL 106 -8.778 -5.776 -0.298 676 1HG2 VAL 106 1HG2 VAL 106 -4.925 -5.064 1.300 677 2HG2 VAL 106 2HG2 VAL 106 -5.602 -3.935 0.126 678 3HG2 VAL 106 3HG2 VAL 106 -5.120 -5.552 -0.385 679 H ILE 107 H ILE 107 -9.437 -3.102 1.458 680 HA ILE 107 HA ILE 107 -11.410 -4.956 2.500 681 HB ILE 107 HB ILE 107 -13.035 -3.132 2.696 682 1HG1 ILE 107 2HG1 ILE 107 -12.427 -1.763 0.629 683 2HG1 ILE 107 1HG1 ILE 107 -12.610 -0.811 2.100 684 1HG2 ILE 107 1HG2 ILE 107 -11.886 -1.650 4.242 685 2HG2 ILE 107 2HG2 ILE 107 -10.350 -2.164 3.559 686 3HG2 ILE 107 3HG2 ILE 107 -11.339 -3.324 4.480 687 1HD1 ILE 107 1HD1 ILE 107 -10.742 -0.001 0.866 688 2HD1 ILE 107 2HD1 ILE 107 -10.027 -1.624 0.819 689 3HD1 ILE 107 3HD1 ILE 107 -10.203 -0.799 2.353 690 H GLU 108 H GLU 108 -10.896 -2.955 -0.305 691 HA GLU 108 HA GLU 108 -11.550 -3.057 -2.387 692 1HB GLU 108 2HB GLU 108 -9.578 -4.271 -2.468 693 2HB GLU 108 1HB GLU 108 -10.345 -5.714 -1.876 694 1HG GLU 108 2HG GLU 108 -9.740 -5.899 -4.236 695 2HG GLU 108 1HG GLU 108 -11.482 -5.994 -3.979 696 H GLY 109 H GLY 109 -12.568 -6.343 -1.671 697 1HA GLY 109 2HA GLY 109 -14.923 -6.964 -1.798 698 2HA GLY 109 1HA GLY 109 -15.098 -5.756 -3.074 699 H ASP 110 H ASP 110 -13.084 -6.141 -4.716 700 HA ASP 110 HA ASP 110 -13.746 -8.517 -6.110 701 1HB ASP 110 2HB ASP 110 -13.012 -6.548 -7.323 702 2HB ASP 110 1HB ASP 110 -11.438 -6.620 -6.535 703 H LEU 111 H LEU 111 -10.797 -7.593 -4.378 704 HA LEU 111 HA LEU 111 -9.564 -10.128 -4.629 705 1HB LEU 111 2HB LEU 111 -9.125 -7.903 -2.627 706 2HB LEU 111 1HB LEU 111 -8.121 -9.338 -2.710 707 HG LEU 111 HG LEU 111 -8.433 -7.368 -4.988 708 1HD1 LEU 111 1HD1 LEU 111 -6.133 -6.679 -4.412 709 2HD1 LEU 111 2HD1 LEU 111 -6.224 -7.649 -2.944 710 3HD1 LEU 111 3HD1 LEU 111 -7.303 -6.256 -3.181 711 1HD2 LEU 111 1HD2 LEU 111 -7.836 -9.619 -5.710 712 2HD2 LEU 111 2HD2 LEU 111 -6.518 -9.647 -4.536 713 3HD2 LEU 111 3HD2 LEU 111 -6.470 -8.517 -5.887 714 H MET 112 H MET 112 -11.976 -8.894 -2.580 715 HA MET 112 HA MET 112 -11.832 -10.893 -0.531 716 1HB MET 112 2HB MET 112 -14.041 -9.039 -1.315 717 2HB MET 112 1HB MET 112 -14.130 -10.151 0.029 718 1HG MET 112 2HG MET 112 -12.111 -7.906 -0.176 719 2HG MET 112 1HG MET 112 -13.667 -7.726 0.599 720 1HE MET 112 1HE MET 112 -10.514 -10.317 0.756 721 2HE MET 112 2HE MET 112 -10.028 -9.953 2.408 722 3HE MET 112 3HE MET 112 -9.884 -8.712 1.166 723 H LYS 113 H LYS 113 -12.744 -11.149 -3.743 724 HA LYS 113 HA LYS 113 -15.007 -12.871 -3.428 725 1HB LYS 113 2HB LYS 113 -13.156 -12.569 -5.797 726 2HB LYS 113 1HB LYS 113 -14.673 -13.456 -5.803 727 1HG LYS 113 2HG LYS 113 -14.338 -10.502 -5.359 728 2HG LYS 113 1HG LYS 113 -14.929 -11.278 -6.827 729 1HD LYS 113 2HD LYS 113 -16.832 -12.180 -5.559 730 2HD LYS 113 1HD LYS 113 -16.230 -11.374 -4.111 731 1HE LYS 113 2HE LYS 113 -16.460 -9.217 -5.205 732 2HE LYS 113 1HE LYS 113 -17.071 -10.011 -6.657 733 1HZ LYS 113 1HZ LYS 113 -18.342 -10.090 -3.982 734 2HZ LYS 113 2HZ LYS 113 -18.951 -10.820 -5.378 735 3HZ LYS 113 3HZ LYS 113 -18.843 -9.146 -5.278 736 H GLU 114 H GLU 114 -11.661 -13.302 -3.259 737 HA GLU 114 HA GLU 114 -12.194 -16.156 -2.909 738 1HB GLU 114 2HB GLU 114 -10.760 -15.875 -4.866 739 2HB GLU 114 1HB GLU 114 -9.594 -15.026 -3.874 740 1HG GLU 114 2HG GLU 114 -8.925 -17.361 -4.193 741 2HG GLU 114 1HG GLU 114 -9.194 -16.968 -2.498 742 H TYR 115 H TYR 115 -10.377 -13.351 -1.872 743 HA TYR 115 HA TYR 115 -9.513 -14.985 0.336 744 1HB TYR 115 2HB TYR 115 -8.692 -12.123 -0.225 745 2HB TYR 115 1HB TYR 115 -7.871 -13.299 0.795 746 HD1 TYR 115 1HD TYR 115 -7.997 -11.788 -2.421 747 HD2 TYR 115 2HD TYR 115 -6.818 -15.409 -0.478 748 HE1 TYR 115 1HE TYR 115 -6.585 -12.346 -4.306 749 HE2 TYR 115 2HE TYR 115 -5.407 -15.941 -2.378 750 HH TYR 115 HH TYR 115 -4.644 -13.672 -4.779 751 H LYS 116 H LYS 116 -10.618 -14.857 2.077 752 HA LYS 116 HA LYS 116 -12.725 -12.904 2.284 753 1HB LYS 116 2HB LYS 116 -13.295 -14.117 4.397 754 2HB LYS 116 1HB LYS 116 -13.304 -15.112 2.953 755 1HG LYS 116 2HG LYS 116 -10.974 -15.834 3.597 756 2HG LYS 116 1HG LYS 116 -11.261 -15.044 5.147 757 1HD LYS 116 2HD LYS 116 -12.937 -17.242 3.943 758 2HD LYS 116 1HD LYS 116 -11.784 -17.440 5.264 759 1HE LYS 116 2HE LYS 116 -13.144 -15.927 6.646 760 2HE LYS 116 1HE LYS 116 -14.270 -15.732 5.304 761 1HZ LYS 116 1HZ LYS 116 -15.131 -17.331 6.833 762 2HZ LYS 116 2HZ LYS 116 -13.714 -18.252 6.776 763 3HZ LYS 116 3HZ LYS 116 -14.726 -18.130 5.429 764 H SER 117 H SER 117 -9.568 -12.982 3.027 765 HA SER 117 HA SER 117 -9.666 -10.447 4.252 766 1HB SER 117 2HB SER 117 -10.054 -11.755 6.139 767 2HB SER 117 1HB SER 117 -8.657 -12.813 5.813 768 HG SER 117 HG SER 117 -8.331 -11.023 7.413 769 H PHE 118 H PHE 118 -7.845 -9.385 3.786 770 HA PHE 118 HA PHE 118 -5.445 -10.814 3.096 771 1HB PHE 118 2HB PHE 118 -6.553 -10.526 0.905 772 2HB PHE 118 1HB PHE 118 -6.755 -8.805 1.208 773 HD1 PHE 118 1HD PHE 118 -4.244 -11.456 0.581 774 HD2 PHE 118 2HD PHE 118 -5.012 -7.293 0.722 775 HE1 PHE 118 1HE PHE 118 -2.055 -11.021 -0.442 776 HE2 PHE 118 2HE PHE 118 -2.834 -6.851 -0.322 777 HZ PHE 118 HZ PHE 118 -1.354 -8.709 -0.899 778 H LEU 119 H LEU 119 -4.132 -10.014 4.510 779 HA LEU 119 HA LEU 119 -4.270 -7.158 5.181 780 1HB LEU 119 2HB LEU 119 -4.916 -8.776 6.977 781 2HB LEU 119 1HB LEU 119 -3.337 -9.509 6.835 782 HG LEU 119 HG LEU 119 -2.341 -7.321 7.542 783 1HD1 LEU 119 1HD1 LEU 119 -3.811 -5.709 8.647 784 2HD1 LEU 119 2HD1 LEU 119 -5.216 -6.620 8.101 785 3HD1 LEU 119 3HD1 LEU 119 -4.152 -5.842 6.924 786 1HD2 LEU 119 1HD2 LEU 119 -2.906 -7.597 9.905 787 2HD2 LEU 119 2HD2 LEU 119 -2.636 -9.152 9.120 788 3HD2 LEU 119 3HD2 LEU 119 -4.280 -8.608 9.461 789 H LEU 120 H LEU 120 -2.397 -6.074 4.732 790 HA LEU 120 HA LEU 120 0.006 -7.676 4.475 791 1HB LEU 120 2HB LEU 120 0.757 -6.546 2.469 792 2HB LEU 120 1HB LEU 120 -0.756 -7.356 2.177 793 HG LEU 120 HG LEU 120 -0.459 -4.371 2.592 794 1HD1 LEU 120 1HD1 LEU 120 -0.767 -4.190 0.197 795 2HD1 LEU 120 2HD1 LEU 120 -0.819 -5.951 0.054 796 3HD1 LEU 120 3HD1 LEU 120 0.656 -5.156 0.588 797 1HD2 LEU 120 1HD2 LEU 120 -2.695 -5.189 3.154 798 2HD2 LEU 120 2HD2 LEU 120 -2.788 -6.022 1.602 799 3HD2 LEU 120 3HD2 LEU 120 -2.722 -4.262 1.653 800 H THR 121 H THR 121 1.677 -6.884 5.408 801 HA THR 121 HA THR 121 1.477 -4.128 6.407 802 HB THR 121 HB THR 121 2.983 -6.435 7.653 803 HG1 THR 121 1HG THR 121 0.459 -6.132 7.529 804 1HG2 THR 121 1HG2 THR 121 3.854 -4.220 8.188 805 2HG2 THR 121 2HG2 THR 121 3.048 -4.902 9.607 806 3HG2 THR 121 3HG2 THR 121 2.246 -3.672 8.621 807 H ILE 122 H ILE 122 3.069 -2.774 5.769 808 HA ILE 122 HA ILE 122 5.479 -4.034 4.722 809 HB ILE 122 HB ILE 122 5.771 -2.240 3.118 810 1HG1 ILE 122 2HG1 ILE 122 3.100 -1.186 3.995 811 2HG1 ILE 122 1HG1 ILE 122 4.650 -0.457 4.407 812 1HG2 ILE 122 1HG2 ILE 122 4.484 -4.161 2.359 813 2HG2 ILE 122 2HG2 ILE 122 3.866 -2.676 1.617 814 3HG2 ILE 122 3HG2 ILE 122 3.004 -3.409 2.960 815 1HD1 ILE 122 1HD1 ILE 122 3.533 -0.760 1.618 816 2HD1 ILE 122 2HD1 ILE 122 5.082 -0.031 2.034 817 3HD1 ILE 122 3HD1 ILE 122 3.581 0.729 2.563 818 H GLN 123 H GLN 123 7.379 -3.111 5.253 819 HA GLN 123 HA GLN 123 7.327 -0.677 6.824 820 1HB GLN 123 2HB GLN 123 7.320 -2.653 8.394 821 2HB GLN 123 1HB GLN 123 8.848 -3.148 7.684 822 1HG GLN 123 2HG GLN 123 9.942 -1.167 8.499 823 2HG GLN 123 1HG GLN 123 8.412 -0.506 9.062 824 1HE2 GLN 123 1HE2 GLN 123 9.085 -0.329 11.166 825 2HE2 GLN 123 2HE2 GLN 123 9.326 -1.684 12.205 826 H VAL 124 H VAL 124 9.000 0.587 6.367 827 HA VAL 124 HA VAL 124 10.659 -0.334 4.157 828 HB VAL 124 HB VAL 124 10.175 2.494 5.150 829 1HG1 VAL 124 1HG1 VAL 124 11.232 3.202 3.062 830 2HG1 VAL 124 2HG1 VAL 124 11.587 1.518 2.673 831 3HG1 VAL 124 3HG1 VAL 124 12.345 2.280 4.070 832 1HG2 VAL 124 1HG2 VAL 124 8.172 1.505 4.173 833 2HG2 VAL 124 2HG2 VAL 124 9.079 1.052 2.731 834 3HG2 VAL 124 3HG2 VAL 124 8.829 2.756 3.118 835 H THR 125 H THR 125 12.626 -0.909 4.482 836 HA THR 125 HA THR 125 14.055 -0.045 6.902 837 HB THR 125 HB THR 125 14.346 -2.643 5.367 838 HG1 THR 125 1HG THR 125 12.823 -2.123 7.729 839 1HG2 THR 125 1HG2 THR 125 15.372 -3.429 7.441 840 2HG2 THR 125 2HG2 THR 125 15.154 -1.835 8.159 841 3HG2 THR 125 3HG2 THR 125 16.257 -2.037 6.792 842 HA PRO 126 HA PRO 126 16.915 1.726 3.827 843 1HB PRO 126 2HB PRO 126 19.212 1.570 5.384 844 2HB PRO 126 1HB PRO 126 18.048 2.896 5.436 845 1HG PRO 126 2HG PRO 126 18.282 0.505 7.214 846 2HG PRO 126 1HG PRO 126 17.942 2.190 7.655 847 1HD PRO 126 2HD PRO 126 15.989 0.389 7.570 848 2HD PRO 126 1HD PRO 126 15.717 2.038 6.963 849 H LYS 127 H LYS 127 18.581 1.012 2.415 850 HA LYS 127 HA LYS 127 18.793 -1.858 2.231 851 1HB LYS 127 2HB LYS 127 20.134 0.259 0.533 852 2HB LYS 127 1HB LYS 127 20.064 -1.464 0.187 853 1HG LYS 127 2HG LYS 127 17.605 -1.283 0.051 854 2HG LYS 127 1HG LYS 127 17.770 0.453 0.288 855 1HD LYS 127 2HD LYS 127 17.474 -0.040 -2.022 856 2HD LYS 127 1HD LYS 127 19.112 0.591 -1.772 857 1HE LYS 127 2HE LYS 127 19.943 -1.756 -1.805 858 2HE LYS 127 1HE LYS 127 18.296 -2.300 -2.132 859 1HZ LYS 127 1HZ LYS 127 19.558 -2.187 -4.142 860 2HZ LYS 127 2HZ LYS 127 19.982 -0.594 -3.864 861 3HZ LYS 127 3HZ LYS 127 18.378 -0.985 -4.206 862 HA PRO 128 HA PRO 128 22.661 -2.140 4.339 863 1HB PRO 128 2HB PRO 128 23.451 -4.593 3.469 864 2HB PRO 128 1HB PRO 128 22.178 -4.376 4.676 865 1HG PRO 128 2HG PRO 128 21.949 -4.963 1.761 866 2HG PRO 128 1HG PRO 128 20.976 -5.577 3.109 867 1HD PRO 128 2HD PRO 128 20.166 -3.549 1.429 868 2HD PRO 128 1HD PRO 128 19.593 -3.754 3.092 869 H GLY 129 H GLY 129 23.942 -0.622 3.459 870 1HA GLY 129 2HA GLY 129 25.703 0.217 2.249 871 2HA GLY 129 1HA GLY 129 25.988 -1.421 1.671 872 H GLY 130 H GLY 130 23.317 0.899 1.290 873 1HA GLY 130 2HA GLY 130 23.834 1.209 -1.494 874 2HA GLY 130 1HA GLY 130 22.490 0.120 -1.185 875 HA PRO 131 HA PRO 131 21.362 4.733 -0.461 876 1HB PRO 131 2HB PRO 131 21.092 5.767 -2.968 877 2HB PRO 131 1HB PRO 131 22.580 5.912 -2.025 878 1HG PRO 131 2HG PRO 131 21.915 4.014 -4.233 879 2HG PRO 131 1HG PRO 131 23.435 4.861 -3.899 880 1HD PRO 131 2HD PRO 131 23.001 2.251 -3.266 881 2HD PRO 131 1HD PRO 131 24.110 3.300 -2.364 882 H GLY 132 H GLY 132 19.311 4.303 0.105 883 1HA GLY 132 2HA GLY 132 17.049 4.600 -1.003 884 2HA GLY 132 1HA GLY 132 17.507 3.149 -1.897 885 H SER 133 H SER 133 15.603 2.148 -0.923 886 HA SER 133 HA SER 133 16.337 0.921 1.567 887 1HB SER 133 2HB SER 133 14.112 1.486 2.596 888 2HB SER 133 1HB SER 133 15.246 2.825 2.453 889 HG SER 133 HG SER 133 14.117 3.462 0.551 890 H ILE 134 H ILE 134 14.879 -0.814 2.179 891 HA ILE 134 HA ILE 134 13.573 -1.985 -0.127 892 HB ILE 134 HB ILE 134 15.202 -3.213 2.038 893 1HG1 ILE 134 2HG1 ILE 134 15.538 -5.017 0.352 894 2HG1 ILE 134 1HG1 ILE 134 14.498 -4.114 -0.736 895 1HG2 ILE 134 1HG2 ILE 134 14.099 -5.365 1.989 896 2HG2 ILE 134 2HG2 ILE 134 12.723 -4.600 1.158 897 3HG2 ILE 134 3HG2 ILE 134 13.160 -4.104 2.798 898 1HD1 ILE 134 1HD1 ILE 134 16.008 -2.307 -0.693 899 2HD1 ILE 134 2HD1 ILE 134 16.796 -3.822 -1.190 900 3HD1 ILE 134 3HD1 ILE 134 17.042 -3.218 0.460 901 H VAL 135 H VAL 135 11.470 -2.240 0.014 902 HA VAL 135 HA VAL 135 10.237 -1.805 2.593 903 HB VAL 135 HB VAL 135 9.274 -0.427 0.844 904 1HG1 VAL 135 1HG1 VAL 135 8.768 -2.937 -0.697 905 2HG1 VAL 135 2HG1 VAL 135 9.900 -1.647 -1.105 906 3HG1 VAL 135 3HG1 VAL 135 8.160 -1.331 -1.124 907 1HG2 VAL 135 1HG2 VAL 135 7.400 -2.680 1.523 908 2HG2 VAL 135 2HG2 VAL 135 6.915 -1.090 0.932 909 3HG2 VAL 135 3HG2 VAL 135 7.709 -1.243 2.500 910 H HIS 136 H HIS 136 9.714 -3.440 3.773 911 HA HIS 136 HA HIS 136 9.772 -6.105 2.594 912 1HB HIS 136 2HB HIS 136 9.657 -5.216 5.487 913 2HB HIS 136 1HB HIS 136 9.572 -6.903 5.000 914 HD1 HIS 136 1HD HIS 136 11.827 -7.967 4.146 915 HD2 HIS 136 2HD HIS 136 12.136 -4.045 5.501 916 HE1 HIS 136 1HE HIS 136 14.265 -7.555 4.468 917 HE2 HIS 136 2HE HIS 136 14.300 -5.403 5.725 918 H TRP 137 H TRP 137 7.996 -6.873 1.783 919 HA TRP 137 HA TRP 137 5.408 -5.952 2.733 920 1HB TRP 137 2HB TRP 137 6.224 -7.617 0.352 921 2HB TRP 137 1HB TRP 137 4.576 -7.198 0.763 922 HD1 TRP 137 HD TRP 137 7.882 -5.345 -0.217 923 HE1 TRP 137 1HE TRP 137 7.208 -3.303 -1.570 924 HE3 TRP 137 3HE TRP 137 2.798 -5.733 0.151 925 HZ2 TRP 137 2HZ TRP 137 4.916 -1.994 -2.365 926 HZ3 TRP 137 3HZ TRP 137 1.427 -4.034 -0.940 927 HH2 TRP 137 HH TRP 137 2.442 -2.190 -2.174 928 H HIS 138 H HIS 138 4.349 -7.136 4.137 929 HA HIS 138 HA HIS 138 4.811 -10.051 4.164 930 1HB HIS 138 2HB HIS 138 3.758 -8.303 6.417 931 2HB HIS 138 1HB HIS 138 4.100 -10.019 6.522 932 HD1 HIS 138 1HD HIS 138 6.612 -10.705 6.851 933 HD2 HIS 138 2HD HIS 138 5.898 -6.636 6.551 934 HE1 HIS 138 1HE HIS 138 8.714 -9.624 7.611 935 HE2 HIS 138 2HE HIS 138 8.194 -7.165 7.654 936 H LEU 139 H LEU 139 3.155 -10.981 3.112 937 HA LEU 139 HA LEU 139 0.536 -9.666 3.181 938 1HB LEU 139 2HB LEU 139 1.629 -11.715 1.229 939 2HB LEU 139 1HB LEU 139 0.026 -11.035 1.176 940 HG LEU 139 HG LEU 139 1.101 -8.782 0.661 941 1HD1 LEU 139 1HD1 LEU 139 3.323 -9.182 1.530 942 2HD1 LEU 139 2HD1 LEU 139 3.366 -8.755 -0.184 943 3HD1 LEU 139 3HD1 LEU 139 3.587 -10.431 0.315 944 1HD2 LEU 139 1HD2 LEU 139 1.653 -11.037 -1.255 945 2HD2 LEU 139 2HD2 LEU 139 1.539 -9.327 -1.670 946 3HD2 LEU 139 3HD2 LEU 139 0.120 -10.189 -1.076 947 H GLU 140 H GLU 140 -0.973 -10.665 4.341 948 HA GLU 140 HA GLU 140 -0.768 -13.553 4.721 949 1HB GLU 140 2HB GLU 140 -1.501 -11.509 6.831 950 2HB GLU 140 1HB GLU 140 -1.677 -13.252 7.013 951 1HG GLU 140 2HG GLU 140 0.747 -13.513 6.731 952 2HG GLU 140 1HG GLU 140 0.904 -11.762 6.611 953 H TYR 141 H TYR 141 -2.575 -14.606 4.251 954 HA TYR 141 HA TYR 141 -5.072 -13.186 4.184 955 1HB TYR 141 2HB TYR 141 -5.423 -13.577 1.723 956 2HB TYR 141 1HB TYR 141 -4.218 -12.377 2.187 957 HD1 TYR 141 1HD TYR 141 -1.741 -13.118 2.138 958 HD2 TYR 141 2HD TYR 141 -4.848 -15.256 0.189 959 HE1 TYR 141 1HE TYR 141 -0.078 -14.186 0.733 960 HE2 TYR 141 2HE TYR 141 -3.235 -16.351 -1.232 961 HH TYR 141 HH TYR 141 0.101 -16.333 -0.650 962 H GLU 142 H GLU 142 -6.848 -14.540 3.285 963 HA GLU 142 HA GLU 142 -6.401 -17.360 3.925 964 1HB GLU 142 2HB GLU 142 -7.139 -16.249 5.961 965 2HB GLU 142 1HB GLU 142 -8.498 -15.540 5.114 966 1HG GLU 142 2HG GLU 142 -9.533 -17.634 4.870 967 2HG GLU 142 1HG GLU 142 -8.129 -18.500 5.535 968 H LYS 143 H LYS 143 -7.250 -18.659 2.410 969 HA LYS 143 HA LYS 143 -8.831 -17.540 0.295 970 1HB LYS 143 2HB LYS 143 -7.846 -20.374 0.701 971 2HB LYS 143 1HB LYS 143 -8.933 -19.942 -0.586 972 1HG LYS 143 2HG LYS 143 -6.722 -20.100 -1.454 973 2HG LYS 143 1HG LYS 143 -7.194 -18.410 -1.462 974 1HD LYS 143 2HD LYS 143 -5.849 -18.004 0.514 975 2HD LYS 143 1HD LYS 143 -5.447 -19.719 0.616 976 1HE LYS 143 2HE LYS 143 -4.793 -17.942 -1.728 977 2HE LYS 143 1HE LYS 143 -3.649 -18.333 -0.445 978 1HZ LYS 143 1HZ LYS 143 -3.311 -19.722 -2.374 979 2HZ LYS 143 2HZ LYS 143 -4.889 -20.259 -2.377 980 3HZ LYS 143 3HZ LYS 143 -3.852 -20.730 -1.155 981 H ILE 144 H ILE 144 -10.930 -17.792 -0.115 982 HA ILE 144 HA ILE 144 -12.735 -18.815 1.853 983 HB ILE 144 HB ILE 144 -13.105 -17.804 -0.976 984 1HG1 ILE 144 2HG1 ILE 144 -13.751 -16.461 1.619 985 2HG1 ILE 144 1HG1 ILE 144 -12.297 -16.133 0.668 986 1HG2 ILE 144 1HG2 ILE 144 -15.154 -18.341 1.120 987 2HG2 ILE 144 2HG2 ILE 144 -14.925 -19.260 -0.394 988 3HG2 ILE 144 3HG2 ILE 144 -15.436 -17.553 -0.436 989 1HD1 ILE 144 1HD1 ILE 144 -13.985 -14.442 0.259 990 2HD1 ILE 144 2HD1 ILE 144 -15.144 -15.698 -0.206 991 3HD1 ILE 144 3HD1 ILE 144 -13.707 -15.417 -1.190 992 H SER 145 H SER 145 -11.712 -19.649 -1.412 993 HA SER 145 HA SER 145 -12.772 -22.348 -1.019 994 1HB SER 145 2HB SER 145 -14.080 -21.141 -2.648 995 2HB SER 145 1HB SER 145 -12.636 -20.698 -3.544 996 HG SER 145 HG SER 145 -13.149 -23.437 -3.131 997 H GLU 146 H GLU 146 -10.594 -20.843 -3.483 998 HA GLU 146 HA GLU 146 -8.109 -21.780 -2.966 999 1HB GLU 146 2HB GLU 146 -9.356 -24.020 -2.763 1000 2HB GLU 146 1HB GLU 146 -9.648 -23.729 -4.490 1001 1HG GLU 146 2HG GLU 146 -7.271 -23.712 -4.926 1002 2HG GLU 146 1HG GLU 146 -6.970 -24.015 -3.207 1003 H GLU 147 H GLU 147 -10.676 -22.363 -5.235 1004 HA GLU 147 HA GLU 147 -9.308 -22.455 -7.661 1005 1HB GLU 147 2HB GLU 147 -11.481 -23.436 -7.213 1006 2HB GLU 147 1HB GLU 147 -12.180 -21.844 -7.027 1007 1HG GLU 147 2HG GLU 147 -11.714 -21.379 -9.385 1008 2HG GLU 147 1HG GLU 147 -11.040 -23.003 -9.557 1009 H VAL 148 H VAL 148 -10.561 -19.818 -5.881 1010 HA VAL 148 HA VAL 148 -10.521 -18.073 -8.251 1011 HB VAL 148 HB VAL 148 -11.597 -17.443 -5.438 1012 1HG1 VAL 148 1HG1 VAL 148 -12.134 -15.962 -8.014 1013 2HG1 VAL 148 2HG1 VAL 148 -10.997 -15.449 -6.773 1014 3HG1 VAL 148 3HG1 VAL 148 -12.713 -15.569 -6.384 1015 1HG2 VAL 148 1HG2 VAL 148 -13.102 -18.283 -7.911 1016 2HG2 VAL 148 2HG2 VAL 148 -13.803 -17.794 -6.364 1017 3HG2 VAL 148 3HG2 VAL 148 -12.835 -19.263 -6.467 1018 H ALA 149 H ALA 149 -8.423 -19.033 -5.898 1019 HA ALA 149 HA ALA 149 -7.254 -16.503 -5.164 1020 1HB ALA 149 1HB ALA 149 -7.221 -18.436 -3.629 1021 2HB ALA 149 2HB ALA 149 -5.623 -17.766 -3.932 1022 3HB ALA 149 3HB ALA 149 -6.125 -19.251 -4.744 1023 H HIS 150 H HIS 150 -5.539 -15.518 -5.866 1024 HA HIS 150 HA HIS 150 -3.754 -16.769 -7.803 1025 1HB HIS 150 2HB HIS 150 -5.320 -14.263 -8.503 1026 2HB HIS 150 1HB HIS 150 -3.883 -14.781 -9.359 1027 HD1 HIS 150 1HD HIS 150 -4.200 -16.498 -11.199 1028 HD2 HIS 150 2HD HIS 150 -7.609 -15.957 -8.873 1029 HE1 HIS 150 1HE HIS 150 -6.037 -17.755 -12.367 1030 HE2 HIS 150 2HE HIS 150 -8.117 -17.070 -11.118 1031 HA PRO 151 HA PRO 151 -1.304 -14.217 -4.824 1032 1HB PRO 151 2HB PRO 151 0.651 -16.195 -5.895 1033 2HB PRO 151 1HB PRO 151 0.432 -15.639 -4.229 1034 1HG PRO 151 2HG PRO 151 -0.437 -18.035 -4.916 1035 2HG PRO 151 1HG PRO 151 -1.437 -16.989 -3.896 1036 1HD PRO 151 2HD PRO 151 -1.731 -17.603 -6.815 1037 2HD PRO 151 1HD PRO 151 -2.965 -17.422 -5.538 1038 H GLU 152 H GLU 152 -1.063 -15.127 -8.105 1039 HA GLU 152 HA GLU 152 1.145 -13.873 -9.234 1040 1HB GLU 152 2HB GLU 152 -1.651 -13.813 -10.332 1041 2HB GLU 152 1HB GLU 152 -0.156 -13.695 -11.238 1042 1HG GLU 152 2HG GLU 152 0.377 -15.916 -10.654 1043 2HG GLU 152 1HG GLU 152 -1.103 -16.076 -9.701 1044 H THR 153 H THR 153 -2.053 -12.664 -8.566 1045 HA THR 153 HA THR 153 -1.548 -10.108 -9.695 1046 HB THR 153 HB THR 153 -3.936 -9.753 -9.267 1047 HG1 THR 153 1HG THR 153 -4.994 -11.003 -7.878 1048 1HG2 THR 153 1HG2 THR 153 -3.278 -11.146 -11.206 1049 2HG2 THR 153 2HG2 THR 153 -4.809 -11.710 -10.519 1050 3HG2 THR 153 3HG2 THR 153 -3.309 -12.572 -10.178 1051 H LEU 154 H LEU 154 -1.757 -11.578 -6.566 1052 HA LEU 154 HA LEU 154 -1.875 -9.262 -4.961 1053 1HB LEU 154 2HB LEU 154 -0.544 -11.903 -4.350 1054 2HB LEU 154 1HB LEU 154 -0.952 -10.673 -3.171 1055 HG LEU 154 HG LEU 154 -2.918 -12.286 -4.796 1056 1HD1 LEU 154 1HD1 LEU 154 -3.484 -13.303 -2.659 1057 2HD1 LEU 154 2HD1 LEU 154 -2.230 -12.357 -1.869 1058 3HD1 LEU 154 3HD1 LEU 154 -1.785 -13.581 -3.041 1059 1HD2 LEU 154 1HD2 LEU 154 -3.772 -10.040 -4.340 1060 2HD2 LEU 154 2HD2 LEU 154 -3.355 -10.236 -2.634 1061 3HD2 LEU 154 3HD2 LEU 154 -4.604 -11.252 -3.339 1062 H LEU 155 H LEU 155 0.829 -11.103 -6.284 1063 HA LEU 155 HA LEU 155 2.762 -9.389 -5.149 1064 1HB LEU 155 2HB LEU 155 3.002 -11.348 -7.404 1065 2HB LEU 155 1HB LEU 155 4.356 -10.455 -6.738 1066 HG LEU 155 HG LEU 155 2.653 -12.475 -5.285 1067 1HD1 LEU 155 1HD1 LEU 155 5.540 -12.489 -6.068 1068 2HD1 LEU 155 2HD1 LEU 155 4.267 -13.423 -6.864 1069 3HD1 LEU 155 3HD1 LEU 155 4.711 -13.762 -5.182 1070 1HD2 LEU 155 1HD2 LEU 155 4.964 -10.807 -4.298 1071 2HD2 LEU 155 2HD2 LEU 155 4.235 -12.156 -3.430 1072 3HD2 LEU 155 3HD2 LEU 155 3.293 -10.700 -3.748 1073 H GLN 156 H GLN 156 1.063 -9.341 -8.209 1074 HA GLN 156 HA GLN 156 2.694 -7.223 -9.173 1075 1HB GLN 156 2HB GLN 156 -0.053 -8.047 -10.099 1076 2HB GLN 156 1HB GLN 156 0.961 -6.858 -10.901 1077 1HG GLN 156 2HG GLN 156 2.700 -8.661 -11.157 1078 2HG GLN 156 1HG GLN 156 1.488 -9.800 -10.574 1079 1HE2 GLN 156 1HE2 GLN 156 0.880 -7.052 -12.597 1080 2HE2 GLN 156 2HE2 GLN 156 0.373 -7.943 -13.995 1081 H PHE 157 H PHE 157 -0.241 -7.368 -7.282 1082 HA PHE 157 HA PHE 157 -0.918 -4.675 -7.179 1083 1HB PHE 157 2HB PHE 157 -2.249 -6.495 -6.145 1084 2HB PHE 157 1HB PHE 157 -0.962 -6.792 -4.995 1085 HD1 PHE 157 1HD PHE 157 -1.048 -5.781 -2.903 1086 HD2 PHE 157 2HD PHE 157 -3.331 -4.161 -6.104 1087 HE1 PHE 157 1HE PHE 157 -2.147 -4.201 -1.328 1088 HE2 PHE 157 2HE PHE 157 -4.414 -2.602 -4.549 1089 HZ PHE 157 HZ PHE 157 -3.820 -2.624 -2.163 1090 H CYS 158 H CYS 158 1.407 -6.561 -5.356 1091 HA CYS 158 HA CYS 158 2.574 -4.550 -3.807 1092 1HB CYS 158 2HB CYS 158 3.010 -6.833 -3.258 1093 2HB CYS 158 1HB CYS 158 3.578 -7.184 -4.880 1094 HG CYS 158 HG CYS 158 5.226 -5.641 -2.327 1095 H VAL 159 H VAL 159 3.524 -5.825 -6.943 1096 HA VAL 159 HA VAL 159 5.789 -4.305 -7.390 1097 HB VAL 159 HB VAL 159 3.809 -5.392 -9.397 1098 1HG1 VAL 159 1HG1 VAL 159 5.121 -3.628 -10.349 1099 2HG1 VAL 159 2HG1 VAL 159 5.580 -5.195 -11.027 1100 3HG1 VAL 159 3HG1 VAL 159 6.620 -4.402 -9.819 1101 1HG2 VAL 159 1HG2 VAL 159 6.437 -6.456 -8.398 1102 2HG2 VAL 159 2HG2 VAL 159 5.414 -7.196 -9.636 1103 3HG2 VAL 159 3HG2 VAL 159 4.832 -7.058 -7.972 1104 H GLU 160 H GLU 160 2.466 -3.552 -8.335 1105 HA GLU 160 HA GLU 160 3.265 -1.173 -9.695 1106 1HB GLU 160 2HB GLU 160 0.499 -2.008 -8.825 1107 2HB GLU 160 1HB GLU 160 0.843 -0.615 -9.838 1108 1HG GLU 160 2HG GLU 160 1.378 -3.503 -10.507 1109 2HG GLU 160 1HG GLU 160 0.134 -2.470 -11.208 1110 H VAL 161 H VAL 161 2.144 -1.795 -6.467 1111 HA VAL 161 HA VAL 161 1.947 0.938 -5.760 1112 HB VAL 161 HB VAL 161 2.330 -1.519 -4.028 1113 1HG1 VAL 161 1HG1 VAL 161 1.684 -0.090 -2.110 1114 2HG1 VAL 161 2HG1 VAL 161 1.682 1.321 -3.167 1115 3HG1 VAL 161 3HG1 VAL 161 3.189 0.465 -2.844 1116 1HG2 VAL 161 1HG2 VAL 161 0.201 -1.436 -5.196 1117 2HG2 VAL 161 2HG2 VAL 161 -0.093 0.189 -4.576 1118 3HG2 VAL 161 3HG2 VAL 161 -0.041 -1.180 -3.467 1119 H SER 162 H SER 162 4.564 -1.470 -5.625 1120 HA SER 162 HA SER 162 6.416 0.027 -4.185 1121 1HB SER 162 2HB SER 162 6.882 -2.040 -6.328 1122 2HB SER 162 1HB SER 162 8.080 -1.422 -5.179 1123 HG SER 162 HG SER 162 5.749 -2.946 -4.633 1124 H LYS 163 H LYS 163 5.714 -0.057 -7.618 1125 HA LYS 163 HA LYS 163 7.841 1.534 -8.533 1126 1HB LYS 163 2HB LYS 163 5.067 1.145 -9.647 1127 2HB LYS 163 1HB LYS 163 6.360 1.972 -10.501 1128 1HG LYS 163 2HG LYS 163 7.659 -0.055 -10.583 1129 2HG LYS 163 1HG LYS 163 6.482 -0.885 -9.567 1130 1HD LYS 163 2HD LYS 163 4.789 -0.663 -11.286 1131 2HD LYS 163 1HD LYS 163 5.902 0.260 -12.297 1132 1HE LYS 163 2HE LYS 163 7.339 -1.636 -12.549 1133 2HE LYS 163 1HE LYS 163 6.416 -2.560 -11.372 1134 1HZ LYS 163 1HZ LYS 163 5.400 -1.635 -14.013 1135 2HZ LYS 163 2HZ LYS 163 4.528 -2.510 -12.870 1136 3HZ LYS 163 3HZ LYS 163 5.872 -3.208 -13.621 1137 H GLU 164 H GLU 164 4.655 2.402 -7.271 1138 HA GLU 164 HA GLU 164 4.928 5.160 -8.025 1139 1HB GLU 164 2HB GLU 164 2.691 3.965 -7.736 1140 2HB GLU 164 1HB GLU 164 3.031 4.079 -5.995 1141 1HG GLU 164 2HG GLU 164 3.134 6.476 -6.106 1142 2HG GLU 164 1HG GLU 164 2.898 6.445 -7.844 1143 H ILE 165 H ILE 165 5.077 3.363 -5.002 1144 HA ILE 165 HA ILE 165 5.482 5.596 -3.365 1145 HB ILE 165 HB ILE 165 4.694 3.380 -2.628 1146 1HG1 ILE 165 2HG1 ILE 165 5.641 4.994 -0.913 1147 2HG1 ILE 165 1HG1 ILE 165 5.630 3.319 -0.401 1148 1HG2 ILE 165 1HG2 ILE 165 6.267 1.544 -2.115 1149 2HG2 ILE 165 2HG2 ILE 165 7.540 2.468 -2.922 1150 3HG2 ILE 165 3HG2 ILE 165 6.128 1.936 -3.832 1151 1HD1 ILE 165 1HD1 ILE 165 8.025 4.847 -1.408 1152 2HD1 ILE 165 2HD1 ILE 165 8.030 3.174 -0.850 1153 3HD1 ILE 165 3HD1 ILE 165 7.666 4.480 0.280 1154 H ASP 166 H ASP 166 7.674 3.559 -5.126 1155 HA ASP 166 HA ASP 166 10.183 4.402 -4.270 1156 1HB ASP 166 2HB ASP 166 9.844 2.611 -5.897 1157 2HB ASP 166 1HB ASP 166 9.206 3.755 -7.059 1158 H GLU 167 H GLU 167 8.159 5.775 -6.825 1159 HA GLU 167 HA GLU 167 9.892 7.989 -7.325 1160 1HB GLU 167 2HB GLU 167 7.060 7.529 -8.189 1161 2HB GLU 167 1HB GLU 167 8.122 8.788 -8.797 1162 1HG GLU 167 2HG GLU 167 9.633 7.062 -9.663 1163 2HG GLU 167 1HG GLU 167 8.513 5.828 -9.079 1164 H HIS 168 H HIS 168 7.074 7.480 -5.349 1165 HA HIS 168 HA HIS 168 6.222 10.126 -5.050 1166 1HB HIS 168 2HB HIS 168 4.870 8.181 -4.328 1167 2HB HIS 168 1HB HIS 168 5.990 7.901 -3.004 1168 HD1 HIS 168 1HD HIS 168 3.203 10.144 -4.097 1169 HD2 HIS 168 2HD HIS 168 5.679 9.660 -0.799 1170 HE1 HIS 168 1HE HIS 168 2.202 11.551 -2.305 1171 HE2 HIS 168 2HE HIS 168 3.465 10.881 -0.262 1172 H LEU 169 H LEU 169 8.706 8.364 -3.288 1173 HA LEU 169 HA LEU 169 9.227 10.589 -1.534 1174 1HB LEU 169 2HB LEU 169 10.672 8.023 -2.079 1175 2HB LEU 169 1HB LEU 169 11.361 9.267 -1.062 1176 HG LEU 169 HG LEU 169 10.331 7.475 0.245 1177 1HD1 LEU 169 1HD1 LEU 169 10.428 9.676 1.192 1178 2HD1 LEU 169 2HD1 LEU 169 8.964 8.826 1.694 1179 3HD1 LEU 169 3HD1 LEU 169 8.870 10.083 0.468 1180 1HD2 LEU 169 1HD2 LEU 169 7.894 7.203 0.315 1181 2HD2 LEU 169 2HD2 LEU 169 8.561 6.805 -1.269 1182 3HD2 LEU 169 3HD2 LEU 169 7.744 8.344 -1.021 1183 H LEU 170 H LEU 170 10.347 9.625 -4.640 1184 HA LEU 170 HA LEU 170 12.581 11.409 -4.480 1185 1HB LEU 170 2HB LEU 170 11.365 10.079 -6.890 1186 2HB LEU 170 1HB LEU 170 12.910 10.909 -6.840 1187 HG LEU 170 HG LEU 170 12.191 8.357 -5.420 1188 1HD1 LEU 170 1HD1 LEU 170 12.592 8.073 -7.751 1189 2HD1 LEU 170 2HD1 LEU 170 13.942 7.400 -6.827 1190 3HD1 LEU 170 3HD1 LEU 170 14.110 8.959 -7.638 1191 1HD2 LEU 170 1HD2 LEU 170 14.540 8.337 -4.638 1192 2HD2 LEU 170 2HD2 LEU 170 13.630 9.676 -3.951 1193 3HD2 LEU 170 3HD2 LEU 170 14.758 9.963 -5.280 1194 H ALA 171 H ALA 171 9.317 11.607 -5.299 1195 HA ALA 171 HA ALA 171 9.487 14.221 -6.494 1196 1HB ALA 171 1HB ALA 171 7.033 14.128 -6.400 1197 2HB ALA 171 2HB ALA 171 7.137 12.632 -5.471 1198 3HB ALA 171 3HB ALA 171 7.698 12.669 -7.142 1199 H GLU 172 H GLU 172 10.093 15.786 -5.139 1200 HA GLU 172 HA GLU 172 9.370 15.568 -2.342 1201 1HB GLU 172 2HB GLU 172 10.763 17.517 -1.942 1202 2HB GLU 172 1HB GLU 172 11.631 16.278 -2.833 1203 1HG GLU 172 2HG GLU 172 11.298 17.542 -4.891 1204 2HG GLU 172 1HG GLU 172 10.416 18.769 -3.977 1205 H GLU 173 H GLU 173 8.414 17.272 -1.188 1206 HA GLU 173 HA GLU 173 6.100 18.266 -2.559 1207 1HB GLU 173 2HB GLU 173 6.961 18.602 0.307 1208 2HB GLU 173 1HB GLU 173 5.375 18.971 -0.349 1209 1HG GLU 173 2HG GLU 173 5.061 16.588 -0.865 1210 2HG GLU 173 1HG GLU 173 6.638 16.249 -0.149 Start of MODEL 19 1 H THR 17 H THR 17 -3.898 -26.286 -2.574 2 HA THR 17 HA THR 17 -4.634 -27.065 -0.582 3 HB THR 17 HB THR 17 -3.984 -29.824 -1.664 4 HG1 THR 17 1HG THR 17 -5.439 -27.868 -2.716 5 1HG2 THR 17 1HG2 THR 17 -6.040 -30.455 -0.453 6 2HG2 THR 17 2HG2 THR 17 -6.272 -28.778 0.039 7 3HG2 THR 17 3HG2 THR 17 -4.894 -29.695 0.652 8 H GLU 18 H GLU 18 -1.902 -26.315 -0.789 9 HA GLU 18 HA GLU 18 -0.313 -28.185 0.757 10 1HB GLU 18 2HB GLU 18 0.323 -25.410 -0.263 11 2HB GLU 18 1HB GLU 18 1.471 -26.466 0.542 12 1HG GLU 18 2HG GLU 18 1.306 -28.065 -1.265 13 2HG GLU 18 1HG GLU 18 0.095 -27.068 -2.068 14 H ALA 19 H ALA 19 -2.542 -25.975 1.316 15 HA ALA 19 HA ALA 19 -1.718 -25.655 4.107 16 1HB ALA 19 1HB ALA 19 -3.159 -23.595 2.425 17 2HB ALA 19 2HB ALA 19 -1.489 -23.491 2.976 18 3HB ALA 19 3HB ALA 19 -2.806 -23.443 4.147 19 H SER 20 H SER 20 -2.991 -27.064 5.104 20 HA SER 20 HA SER 20 -5.459 -27.950 4.116 21 1HB SER 20 2HB SER 20 -4.246 -28.242 6.863 22 2HB SER 20 1HB SER 20 -5.590 -29.203 6.227 23 HG SER 20 HG SER 20 -4.280 -30.188 4.857 24 H SER 21 H SER 21 -4.608 -25.373 6.298 25 HA SER 21 HA SER 21 -7.332 -24.988 7.159 26 1HB SER 21 2HB SER 21 -4.838 -23.394 7.730 27 2HB SER 21 1HB SER 21 -6.407 -23.127 8.488 28 HG SER 21 HG SER 21 -4.877 -24.401 9.662 29 H LEU 22 H LEU 22 -5.755 -24.280 4.347 30 HA LEU 22 HA LEU 22 -5.945 -22.843 2.664 31 1HB LEU 22 2HB LEU 22 -8.545 -22.242 4.032 32 2HB LEU 22 1HB LEU 22 -8.138 -21.689 2.417 33 HG LEU 22 HG LEU 22 -8.259 -24.595 3.213 34 1HD1 LEU 22 1HD1 LEU 22 -10.363 -24.627 2.013 35 2HD1 LEU 22 2HD1 LEU 22 -10.280 -22.851 1.852 36 3HD1 LEU 22 3HD1 LEU 22 -10.369 -23.613 3.457 37 1HD2 LEU 22 1HD2 LEU 22 -8.323 -24.956 0.787 38 2HD2 LEU 22 2HD2 LEU 22 -6.830 -24.161 1.284 39 3HD2 LEU 22 3HD2 LEU 22 -8.122 -23.226 0.524 40 H VAL 23 H VAL 23 -4.862 -21.880 5.314 41 HA VAL 23 HA VAL 23 -5.085 -19.019 4.794 42 HB VAL 23 HB VAL 23 -5.481 -19.729 7.158 43 1HG1 VAL 23 1HG1 VAL 23 -2.618 -20.617 7.108 44 2HG1 VAL 23 2HG1 VAL 23 -4.027 -21.663 7.233 45 3HG1 VAL 23 3HG1 VAL 23 -3.640 -20.543 8.547 46 1HG2 VAL 23 1HG2 VAL 23 -2.985 -18.079 6.764 47 2HG2 VAL 23 2HG2 VAL 23 -3.948 -18.125 8.240 48 3HG2 VAL 23 3HG2 VAL 23 -4.644 -17.488 6.751 49 H GLY 24 H GLY 24 -3.347 -17.885 4.071 50 1HA GLY 24 2HA GLY 24 -0.804 -19.251 3.946 51 2HA GLY 24 1HA GLY 24 -1.567 -18.812 2.421 52 H LYS 25 H LYS 25 0.864 -17.829 3.215 53 HA LYS 25 HA LYS 25 0.221 -15.051 3.183 54 1HB LYS 25 2HB LYS 25 1.992 -14.546 4.865 55 2HB LYS 25 1HB LYS 25 0.530 -15.252 5.517 56 1HG LYS 25 2HG LYS 25 1.500 -17.232 5.977 57 2HG LYS 25 1HG LYS 25 2.840 -16.991 4.841 58 1HD LYS 25 2HD LYS 25 2.437 -15.340 7.338 59 2HD LYS 25 1HD LYS 25 3.463 -16.778 7.290 60 1HE LYS 25 2HE LYS 25 3.831 -14.364 5.486 61 2HE LYS 25 1HE LYS 25 4.752 -14.663 6.971 62 1HZ LYS 25 1HZ LYS 25 4.695 -16.451 4.588 63 2HZ LYS 25 2HZ LYS 25 5.607 -16.673 5.971 64 3HZ LYS 25 3HZ LYS 25 5.921 -15.386 4.943 65 H LEU 26 H LEU 26 1.948 -13.797 2.490 66 HA LEU 26 HA LEU 26 4.174 -15.245 1.367 67 1HB LEU 26 2HB LEU 26 2.441 -15.080 -0.417 68 2HB LEU 26 1HB LEU 26 2.386 -13.355 -0.202 69 HG LEU 26 HG LEU 26 4.862 -14.798 -1.206 70 1HD1 LEU 26 1HD1 LEU 26 4.146 -14.137 -3.428 71 2HD1 LEU 26 2HD1 LEU 26 2.624 -13.522 -2.759 72 3HD1 LEU 26 3HD1 LEU 26 3.000 -15.251 -2.677 73 1HD2 LEU 26 1HD2 LEU 26 5.229 -12.504 -0.369 74 2HD2 LEU 26 2HD2 LEU 26 3.963 -11.916 -1.448 75 3HD2 LEU 26 3HD2 LEU 26 5.445 -12.603 -2.116 76 H GLU 27 H GLU 27 5.981 -14.083 1.447 77 HA GLU 27 HA GLU 27 5.755 -11.326 2.371 78 1HB GLU 27 2HB GLU 27 6.133 -12.824 4.306 79 2HB GLU 27 1HB GLU 27 7.590 -13.431 3.541 80 1HG GLU 27 2HG GLU 27 8.585 -11.217 3.672 81 2HG GLU 27 1HG GLU 27 7.111 -10.598 4.419 82 H THR 28 H THR 28 7.076 -10.011 1.303 83 HA THR 28 HA THR 28 9.346 -11.130 -0.106 84 HB THR 28 HB THR 28 7.518 -11.270 -1.786 85 HG1 THR 28 1HG THR 28 9.458 -9.242 -2.227 86 1HG2 THR 28 1HG2 THR 28 6.052 -9.492 -0.899 87 2HG2 THR 28 2HG2 THR 28 6.405 -9.236 -2.607 88 3HG2 THR 28 3HG2 THR 28 7.233 -8.273 -1.390 89 H ASP 29 H ASP 29 10.948 -9.649 -0.445 90 HA ASP 29 HA ASP 29 10.531 -7.013 0.722 91 1HB ASP 29 2HB ASP 29 13.017 -6.807 0.524 92 2HB ASP 29 1HB ASP 29 12.565 -8.088 1.618 93 H VAL 30 H VAL 30 10.750 -5.213 -0.481 94 HA VAL 30 HA VAL 30 11.498 -5.583 -3.278 95 HB VAL 30 HB VAL 30 9.308 -3.716 -2.275 96 1HG1 VAL 30 1HG1 VAL 30 10.596 -2.675 -4.061 97 2HG1 VAL 30 2HG1 VAL 30 8.978 -3.107 -4.607 98 3HG1 VAL 30 3HG1 VAL 30 10.361 -4.098 -5.078 99 1HG2 VAL 30 1HG2 VAL 30 9.178 -6.097 -4.107 100 2HG2 VAL 30 2HG2 VAL 30 7.820 -5.033 -3.699 101 3HG2 VAL 30 3HG2 VAL 30 8.566 -6.043 -2.449 102 H GLU 31 H GLU 31 13.128 -4.391 -3.812 103 HA GLU 31 HA GLU 31 13.889 -2.377 -1.938 104 1HB GLU 31 2HB GLU 31 16.106 -2.317 -3.091 105 2HB GLU 31 1HB GLU 31 15.670 -3.825 -2.331 106 1HG GLU 31 2HG GLU 31 16.791 -4.314 -4.332 107 2HG GLU 31 1HG GLU 31 15.092 -4.714 -4.538 108 H ILE 32 H ILE 32 14.162 -0.378 -2.238 109 HA ILE 32 HA ILE 32 13.331 0.909 -4.789 110 HB ILE 32 HB ILE 32 12.140 2.590 -3.528 111 1HG1 ILE 32 2HG1 ILE 32 12.579 1.006 -0.986 112 2HG1 ILE 32 1HG1 ILE 32 13.637 2.322 -1.475 113 1HG2 ILE 32 1HG2 ILE 32 10.777 0.671 -4.181 114 2HG2 ILE 32 2HG2 ILE 32 10.204 1.332 -2.649 115 3HG2 ILE 32 3HG2 ILE 32 11.170 -0.137 -2.664 116 1HD1 ILE 32 1HD1 ILE 32 11.975 3.013 0.170 117 2HD1 ILE 32 2HD1 ILE 32 10.671 2.611 -0.971 118 3HD1 ILE 32 3HD1 ILE 32 11.853 3.881 -1.347 119 H LYS 33 H LYS 33 13.762 3.178 -4.568 120 HA LYS 33 HA LYS 33 16.568 3.474 -3.868 121 1HB LYS 33 2HB LYS 33 14.630 5.256 -5.379 122 2HB LYS 33 1HB LYS 33 16.337 5.588 -5.181 123 1HG LYS 33 2HG LYS 33 15.962 4.774 -7.402 124 2HG LYS 33 1HG LYS 33 16.802 3.482 -6.530 125 1HD LYS 33 2HD LYS 33 14.634 2.364 -6.295 126 2HD LYS 33 1HD LYS 33 13.855 3.706 -7.130 127 1HE LYS 33 2HE LYS 33 15.267 3.234 -9.104 128 2HE LYS 33 1HE LYS 33 15.922 1.830 -8.261 129 1HZ LYS 33 1HZ LYS 33 13.644 0.959 -8.119 130 2HZ LYS 33 2HZ LYS 33 14.140 1.169 -9.719 131 3HZ LYS 33 3HZ LYS 33 13.097 2.285 -9.003 132 H ALA 34 H ALA 34 16.025 6.461 -3.579 133 HA ALA 34 HA ALA 34 15.389 8.001 -2.086 134 1HB ALA 34 1HB ALA 34 13.258 6.029 -1.285 135 2HB ALA 34 2HB ALA 34 13.123 7.213 -2.583 136 3HB ALA 34 3HB ALA 34 13.272 7.754 -0.911 137 H SER 35 H SER 35 14.426 7.743 0.515 138 HA SER 35 HA SER 35 16.497 6.177 1.857 139 1HB SER 35 2HB SER 35 17.098 8.675 1.752 140 2HB SER 35 1HB SER 35 15.588 8.940 2.558 141 HG SER 35 HG SER 35 17.808 7.580 3.621 142 H ALA 36 H ALA 36 15.766 5.325 3.860 143 HA ALA 36 HA ALA 36 12.978 4.992 4.158 144 1HB ALA 36 1HB ALA 36 14.622 3.354 5.007 145 2HB ALA 36 2HB ALA 36 13.517 3.882 6.275 146 3HB ALA 36 3HB ALA 36 15.161 4.520 6.207 147 H ASP 37 H ASP 37 15.295 7.235 5.370 148 HA ASP 37 HA ASP 37 13.604 8.481 7.306 149 1HB ASP 37 2HB ASP 37 16.072 9.511 5.907 150 2HB ASP 37 1HB ASP 37 15.247 10.355 7.211 151 H LYS 38 H LYS 38 14.444 9.028 3.963 152 HA LYS 38 HA LYS 38 13.102 11.497 3.595 153 1HB LYS 38 2HB LYS 38 14.876 10.610 2.105 154 2HB LYS 38 1HB LYS 38 13.737 9.402 1.498 155 1HG LYS 38 2HG LYS 38 12.342 11.175 0.694 156 2HG LYS 38 1HG LYS 38 13.473 12.345 1.406 157 1HD LYS 38 2HD LYS 38 15.242 11.467 -0.082 158 2HD LYS 38 1HD LYS 38 14.038 10.431 -0.857 159 1HE LYS 38 2HE LYS 38 12.734 12.365 -1.464 160 2HE LYS 38 1HE LYS 38 13.893 13.391 -0.626 161 1HZ LYS 38 1HZ LYS 38 14.577 11.725 -3.026 162 2HZ LYS 38 2HZ LYS 38 15.589 12.792 -2.235 163 3HZ LYS 38 3HZ LYS 38 14.256 13.384 -3.062 164 H PHE 39 H PHE 39 12.064 8.172 3.517 165 HA PHE 39 HA PHE 39 9.579 8.361 2.309 166 1HB PHE 39 2HB PHE 39 10.481 6.210 2.965 167 2HB PHE 39 1HB PHE 39 10.453 6.660 4.661 168 HD1 PHE 39 1HD PHE 39 8.315 5.855 1.747 169 HD2 PHE 39 2HD PHE 39 8.499 6.334 5.968 170 HE1 PHE 39 1HE PHE 39 6.073 4.865 1.957 171 HE2 PHE 39 2HE PHE 39 6.259 5.351 6.184 172 HZ PHE 39 HZ PHE 39 5.042 4.616 4.175 173 H HIS 40 H HIS 40 10.454 8.997 5.653 174 HA HIS 40 HA HIS 40 7.927 9.526 6.754 175 1HB HIS 40 2HB HIS 40 10.556 10.855 7.428 176 2HB HIS 40 1HB HIS 40 9.103 11.003 8.387 177 HD1 HIS 40 1HD HIS 40 8.796 9.275 10.180 178 HD2 HIS 40 2HD HIS 40 11.670 8.191 7.404 179 HE1 HIS 40 1HE HIS 40 9.977 7.293 11.155 180 HE2 HIS 40 2HE HIS 40 11.877 6.876 9.604 181 H HIS 41 H HIS 41 10.190 11.650 5.146 182 HA HIS 41 HA HIS 41 8.580 13.970 5.622 183 1HB HIS 41 2HB HIS 41 11.015 13.681 3.856 184 2HB HIS 41 1HB HIS 41 10.242 15.200 4.286 185 HD1 HIS 41 1HD HIS 41 10.537 15.997 6.809 186 HD2 HIS 41 2HD HIS 41 12.734 12.629 5.752 187 HE1 HIS 41 1HE HIS 41 12.238 15.696 8.618 188 HE2 HIS 41 2HE HIS 41 13.359 13.506 8.069 189 H MET 42 H MET 42 9.247 11.937 2.814 190 HA MET 42 HA MET 42 7.789 13.674 1.083 191 1HB MET 42 2HB MET 42 8.828 10.900 0.625 192 2HB MET 42 1HB MET 42 8.032 11.856 -0.615 193 1HG MET 42 2HG MET 42 10.580 12.538 0.825 194 2HG MET 42 1HG MET 42 10.442 11.964 -0.839 195 1HE MET 42 1HE MET 42 7.803 13.597 -1.772 196 2HE MET 42 2HE MET 42 9.234 13.380 -2.776 197 3HE MET 42 3HE MET 42 8.566 14.993 -2.531 198 H PHE 43 H PHE 43 6.885 10.829 2.912 199 HA PHE 43 HA PHE 43 4.449 10.506 1.427 200 1HB PHE 43 2HB PHE 43 5.522 8.578 2.529 201 2HB PHE 43 1HB PHE 43 5.267 9.325 4.099 202 HD1 PHE 43 1HD PHE 43 3.184 9.106 5.221 203 HD2 PHE 43 2HD PHE 43 3.579 7.794 1.194 204 HE1 PHE 43 1HE PHE 43 1.009 7.977 5.383 205 HE2 PHE 43 2HE PHE 43 1.398 6.662 1.348 206 HZ PHE 43 HZ PHE 43 0.109 6.754 3.444 207 H ALA 44 H ALA 44 5.423 12.190 4.321 208 HA ALA 44 HA ALA 44 2.684 12.838 5.021 209 1HB ALA 44 1HB ALA 44 4.328 12.422 6.790 210 2HB ALA 44 2HB ALA 44 3.668 14.055 6.901 211 3HB ALA 44 3HB ALA 44 5.278 13.795 6.225 212 H GLY 45 H GLY 45 5.341 14.220 3.311 213 1HA GLY 45 2HA GLY 45 4.321 16.923 3.406 214 2HA GLY 45 1HA GLY 45 5.776 16.372 2.590 215 H LYS 46 H LYS 46 2.877 14.650 1.978 216 HA LYS 46 HA LYS 46 2.898 15.563 -0.740 217 1HB LYS 46 2HB LYS 46 2.577 13.149 -0.136 218 2HB LYS 46 1HB LYS 46 1.101 13.569 0.698 219 1HG LYS 46 2HG LYS 46 1.506 13.960 -2.276 220 2HG LYS 46 1HG LYS 46 0.820 12.505 -1.560 221 1HD LYS 46 2HD LYS 46 -1.016 13.782 -0.656 222 2HD LYS 46 1HD LYS 46 -0.294 15.279 -1.237 223 1HE LYS 46 2HE LYS 46 -1.237 13.000 -2.993 224 2HE LYS 46 1HE LYS 46 -2.119 14.500 -2.715 225 1HZ LYS 46 1HZ LYS 46 0.546 14.277 -4.047 226 2HZ LYS 46 2HZ LYS 46 -0.283 15.718 -3.754 227 3HZ LYS 46 3HZ LYS 46 -0.922 14.568 -4.785 228 HA PRO 47 HA PRO 47 -0.122 18.712 0.406 229 1HB PRO 47 2HB PRO 47 -0.323 19.214 -2.481 230 2HB PRO 47 1HB PRO 47 0.225 20.302 -1.203 231 1HG PRO 47 2HG PRO 47 1.915 19.248 -3.030 232 2HG PRO 47 1HG PRO 47 2.410 19.613 -1.367 233 1HD PRO 47 2HD PRO 47 1.693 16.990 -2.602 234 2HD PRO 47 1HD PRO 47 2.981 17.391 -1.438 235 H HIS 48 H HIS 48 -1.902 17.630 0.958 236 HA HIS 48 HA HIS 48 -3.250 16.075 -1.047 237 1HB HIS 48 2HB HIS 48 -4.812 15.335 0.789 238 2HB HIS 48 1HB HIS 48 -3.128 14.925 1.049 239 HD1 HIS 48 1HD HIS 48 -2.119 15.663 3.249 240 HD2 HIS 48 2HD HIS 48 -5.771 17.510 2.474 241 HE1 HIS 48 1HE HIS 48 -2.717 16.874 5.339 242 HE2 HIS 48 2HE HIS 48 -4.743 18.213 4.733 243 H HIS 49 H HIS 49 -4.797 16.709 -2.217 244 HA HIS 49 HA HIS 49 -6.721 18.665 -1.355 245 1HB HIS 49 2HB HIS 49 -4.796 20.123 -1.988 246 2HB HIS 49 1HB HIS 49 -4.843 19.438 -3.602 247 HD1 HIS 49 1HD HIS 49 -6.437 21.984 -1.453 248 HD2 HIS 49 2HD HIS 49 -7.140 20.229 -5.152 249 HE1 HIS 49 1HE HIS 49 -8.147 23.433 -2.581 250 HE2 HIS 49 2HE HIS 49 -8.434 22.443 -4.866 251 H VAL 50 H VAL 50 -5.256 16.924 -4.076 252 HA VAL 50 HA VAL 50 -6.030 15.974 -5.900 253 HB VAL 50 HB VAL 50 -8.814 16.118 -4.658 254 1HG1 VAL 50 1HG1 VAL 50 -7.797 14.443 -6.952 255 2HG1 VAL 50 2HG1 VAL 50 -8.926 15.795 -7.048 256 3HG1 VAL 50 3HG1 VAL 50 -9.399 14.314 -6.222 257 1HG2 VAL 50 1HG2 VAL 50 -7.327 14.825 -3.247 258 2HG2 VAL 50 2HG2 VAL 50 -6.822 13.850 -4.630 259 3HG2 VAL 50 3HG2 VAL 50 -8.484 13.759 -4.040 260 H SER 51 H SER 51 -5.418 17.564 -7.116 261 HA SER 51 HA SER 51 -6.736 20.033 -7.334 262 1HB SER 51 2HB SER 51 -5.107 20.352 -9.251 263 2HB SER 51 1HB SER 51 -4.419 19.994 -7.666 264 HG SER 51 HG SER 51 -3.400 18.722 -9.117 265 H LYS 52 H LYS 52 -6.219 17.688 -9.942 266 HA LYS 52 HA LYS 52 -7.484 17.007 -11.709 267 1HB LYS 52 2HB LYS 52 -9.772 18.095 -10.073 268 2HB LYS 52 1HB LYS 52 -9.965 17.195 -11.565 269 1HG LYS 52 2HG LYS 52 -9.025 15.232 -10.573 270 2HG LYS 52 1HG LYS 52 -8.597 16.125 -9.114 271 1HD LYS 52 2HD LYS 52 -10.621 14.821 -8.745 272 2HD LYS 52 1HD LYS 52 -10.952 16.550 -8.671 273 1HE LYS 52 2HE LYS 52 -11.804 16.465 -10.993 274 2HE LYS 52 1HE LYS 52 -11.528 14.723 -11.011 275 1HZ LYS 52 1HZ LYS 52 -13.168 14.479 -9.244 276 2HZ LYS 52 2HZ LYS 52 -13.855 15.347 -10.508 277 3HZ LYS 52 3HZ LYS 52 -13.321 16.150 -9.138 278 H ALA 53 H ALA 53 -9.042 17.851 -13.460 279 HA ALA 53 HA ALA 53 -8.233 20.510 -14.229 280 1HB ALA 53 1HB ALA 53 -10.193 18.598 -15.538 281 2HB ALA 53 2HB ALA 53 -8.478 18.734 -15.925 282 3HB ALA 53 3HB ALA 53 -9.570 20.078 -16.261 283 H SER 54 H SER 54 -10.989 18.902 -12.930 284 HA SER 54 HA SER 54 -12.134 21.451 -12.203 285 1HB SER 54 2HB SER 54 -14.424 20.508 -12.731 286 2HB SER 54 1HB SER 54 -13.430 20.794 -14.157 287 HG SER 54 HG SER 54 -12.811 18.473 -13.819 288 HA PRO 55 HA PRO 55 -11.722 19.553 -8.189 289 1HB PRO 55 2HB PRO 55 -14.279 21.008 -7.673 290 2HB PRO 55 1HB PRO 55 -12.801 20.973 -6.707 291 1HG PRO 55 2HG PRO 55 -13.329 23.084 -8.205 292 2HG PRO 55 1HG PRO 55 -11.681 22.445 -8.122 293 1HD PRO 55 2HD PRO 55 -13.690 22.215 -10.314 294 2HD PRO 55 1HD PRO 55 -11.921 22.374 -10.399 295 H GLY 56 H GLY 56 -15.120 19.783 -9.215 296 1HA GLY 56 2HA GLY 56 -15.550 17.011 -9.308 297 2HA GLY 56 1HA GLY 56 -16.076 17.633 -7.747 298 H ASN 57 H ASN 57 -16.526 17.829 -11.166 299 HA ASN 57 HA ASN 57 -18.790 19.576 -10.744 300 1HB ASN 57 2HB ASN 57 -17.438 18.733 -13.302 301 2HB ASN 57 1HB ASN 57 -18.895 19.710 -13.254 302 1HD2 ASN 57 1HD2 ASN 57 -17.901 21.419 -14.263 303 2HD2 ASN 57 2HD2 ASN 57 -16.712 22.417 -13.507 304 H ILE 58 H ILE 58 -20.178 18.250 -9.765 305 HA ILE 58 HA ILE 58 -21.847 16.810 -11.571 306 HB ILE 58 HB ILE 58 -22.304 15.064 -9.843 307 1HG1 ILE 58 2HG1 ILE 58 -21.051 16.196 -7.962 308 2HG1 ILE 58 1HG1 ILE 58 -20.779 14.456 -8.081 309 1HG2 ILE 58 1HG2 ILE 58 -20.495 13.520 -10.485 310 2HG2 ILE 58 2HG2 ILE 58 -19.647 14.893 -11.197 311 3HG2 ILE 58 3HG2 ILE 58 -21.218 14.404 -11.830 312 1HD1 ILE 58 1HD1 ILE 58 -18.738 15.644 -7.541 313 2HD1 ILE 58 2HD1 ILE 58 -18.935 16.675 -8.962 314 3HD1 ILE 58 3HD1 ILE 58 -18.615 14.954 -9.160 315 H GLN 59 H GLN 59 -23.806 16.042 -9.880 316 HA GLN 59 HA GLN 59 -25.193 18.380 -9.271 317 1HB GLN 59 2HB GLN 59 -25.565 15.617 -8.119 318 2HB GLN 59 1HB GLN 59 -26.702 16.934 -7.919 319 1HG GLN 59 2HG GLN 59 -27.109 16.971 -10.304 320 2HG GLN 59 1HG GLN 59 -25.898 15.708 -10.540 321 1HE2 GLN 59 1HE2 GLN 59 -26.364 13.618 -9.957 322 2HE2 GLN 59 2HE2 GLN 59 -27.962 13.094 -9.569 323 H GLY 60 H GLY 60 -23.693 16.130 -6.956 324 1HA GLY 60 2HA GLY 60 -22.370 17.793 -5.336 325 2HA GLY 60 1HA GLY 60 -24.038 18.064 -4.847 326 H CYS 61 H CYS 61 -21.536 15.675 -5.151 327 HA CYS 61 HA CYS 61 -22.619 14.294 -2.845 328 1HB CYS 61 2HB CYS 61 -23.493 13.077 -4.830 329 2HB CYS 61 1HB CYS 61 -21.847 12.922 -5.430 330 HG CYS 61 HG CYS 61 -23.420 11.278 -2.968 331 H ASP 62 H ASP 62 -20.966 14.256 -1.477 332 HA ASP 62 HA ASP 62 -18.343 13.698 -2.564 333 1HB ASP 62 2HB ASP 62 -17.252 15.431 -1.180 334 2HB ASP 62 1HB ASP 62 -18.358 16.129 -2.352 335 H LEU 63 H LEU 63 -17.978 11.816 -1.793 336 HA LEU 63 HA LEU 63 -18.502 11.169 0.986 337 1HB LEU 63 2HB LEU 63 -18.846 9.543 -0.968 338 2HB LEU 63 1HB LEU 63 -17.114 9.528 -1.172 339 HG LEU 63 HG LEU 63 -18.577 8.493 1.278 340 1HD1 LEU 63 1HD1 LEU 63 -18.031 6.278 0.425 341 2HD1 LEU 63 2HD1 LEU 63 -17.368 7.004 -1.037 342 3HD1 LEU 63 3HD1 LEU 63 -19.087 7.161 -0.674 343 1HD2 LEU 63 1HD2 LEU 63 -16.261 9.175 1.765 344 2HD2 LEU 63 2HD2 LEU 63 -15.693 8.162 0.438 345 3HD2 LEU 63 3HD2 LEU 63 -16.453 7.422 1.846 346 H HIS 64 H HIS 64 -16.912 11.218 2.502 347 HA HIS 64 HA HIS 64 -14.559 12.607 1.640 348 1HB HIS 64 2HB HIS 64 -15.663 12.174 4.404 349 2HB HIS 64 1HB HIS 64 -14.093 12.925 4.110 350 HD1 HIS 64 1HD HIS 64 -14.186 15.398 3.914 351 HD2 HIS 64 2HD HIS 64 -17.778 13.642 2.829 352 HE1 HIS 64 1HE HIS 64 -15.710 17.289 3.331 353 HE2 HIS 64 2HE HIS 64 -17.619 16.098 2.211 354 H GLU 65 H GLU 65 -13.283 11.407 0.707 355 HA GLU 65 HA GLU 65 -12.286 8.915 1.858 356 1HB GLU 65 2HB GLU 65 -11.703 10.256 -0.785 357 2HB GLU 65 1HB GLU 65 -11.317 8.608 -0.325 358 1HG GLU 65 2HG GLU 65 -13.608 7.975 -0.365 359 2HG GLU 65 1HG GLU 65 -14.126 9.653 -0.547 360 H GLY 66 H GLY 66 -10.716 9.525 3.398 361 1HA GLY 66 2HA GLY 66 -8.334 10.716 2.456 362 2HA GLY 66 1HA GLY 66 -9.260 11.833 3.447 363 H ASP 67 H ASP 67 -6.831 11.044 4.276 364 HA ASP 67 HA ASP 67 -6.932 8.739 5.929 365 1HB ASP 67 2HB ASP 67 -4.815 9.558 5.062 366 2HB ASP 67 1HB ASP 67 -5.015 11.068 5.946 367 H TRP 68 H TRP 68 -7.416 8.496 7.971 368 HA TRP 68 HA TRP 68 -8.909 10.605 9.313 369 1HB TRP 68 2HB TRP 68 -8.429 7.724 10.126 370 2HB TRP 68 1HB TRP 68 -9.492 8.844 10.952 371 HD1 TRP 68 HD TRP 68 -9.814 9.026 7.187 372 HE1 TRP 68 1HE TRP 68 -11.964 7.820 6.433 373 HE3 TRP 68 3HE TRP 68 -11.043 6.724 11.586 374 HZ2 TRP 68 2HZ TRP 68 -13.908 6.123 7.547 375 HZ3 TRP 68 3HZ TRP 68 -13.061 5.325 11.651 376 HH2 TRP 68 HH TRP 68 -14.466 5.031 9.675 377 H GLY 69 H GLY 69 -5.732 9.340 9.356 378 1HA GLY 69 2HA GLY 69 -3.926 10.071 10.571 379 2HA GLY 69 1HA GLY 69 -5.018 11.039 11.551 380 H THR 70 H THR 70 -5.928 7.779 11.327 381 HA THR 70 HA THR 70 -4.403 6.905 13.586 382 HB THR 70 HB THR 70 -6.101 8.323 14.691 383 HG1 THR 70 1HG THR 70 -6.828 6.809 16.136 384 1HG2 THR 70 1HG2 THR 70 -8.130 6.495 13.384 385 2HG2 THR 70 2HG2 THR 70 -7.873 8.198 13.006 386 3HG2 THR 70 3HG2 THR 70 -8.492 7.730 14.590 387 H VAL 71 H VAL 71 -5.569 4.776 14.356 388 HA VAL 71 HA VAL 71 -5.596 2.951 12.191 389 HB VAL 71 HB VAL 71 -6.564 2.620 15.039 390 1HG1 VAL 71 1HG1 VAL 71 -5.902 0.512 12.987 391 2HG1 VAL 71 2HG1 VAL 71 -7.509 0.894 13.607 392 3HG1 VAL 71 3HG1 VAL 71 -6.291 0.202 14.680 393 1HG2 VAL 71 1HG2 VAL 71 -4.386 1.549 15.442 394 2HG2 VAL 71 2HG2 VAL 71 -4.216 3.229 14.937 395 3HG2 VAL 71 3HG2 VAL 71 -3.912 1.928 13.786 396 H GLY 72 H GLY 72 -7.296 2.124 11.044 397 1HA GLY 72 2HA GLY 72 -9.594 1.683 10.682 398 2HA GLY 72 1HA GLY 72 -9.991 2.993 11.793 399 H SER 73 H SER 73 -7.531 4.154 10.108 400 HA SER 73 HA SER 73 -8.995 6.037 8.644 401 1HB SER 73 2HB SER 73 -6.686 6.385 9.474 402 2HB SER 73 1HB SER 73 -6.107 5.187 8.324 403 HG SER 73 HG SER 73 -5.790 7.113 7.340 404 H ILE 74 H ILE 74 -9.695 6.091 6.550 405 HA ILE 74 HA ILE 74 -8.803 3.963 4.770 406 HB ILE 74 HB ILE 74 -11.645 4.963 5.087 407 1HG1 ILE 74 2HG1 ILE 74 -10.424 2.214 5.383 408 2HG1 ILE 74 1HG1 ILE 74 -10.847 3.282 6.706 409 1HG2 ILE 74 1HG2 ILE 74 -12.219 3.424 3.243 410 2HG2 ILE 74 2HG2 ILE 74 -10.510 3.064 3.018 411 3HG2 ILE 74 3HG2 ILE 74 -11.117 4.688 2.699 412 1HD1 ILE 74 1HD1 ILE 74 -12.699 2.093 4.681 413 2HD1 ILE 74 2HD1 ILE 74 -13.187 3.151 6.016 414 3HD1 ILE 74 3HD1 ILE 74 -12.511 1.547 6.356 415 H VAL 75 H VAL 75 -7.778 4.862 3.220 416 HA VAL 75 HA VAL 75 -8.727 7.283 1.915 417 HB VAL 75 HB VAL 75 -7.015 8.041 3.535 418 1HG1 VAL 75 1HG1 VAL 75 -5.748 6.031 3.832 419 2HG1 VAL 75 2HG1 VAL 75 -4.672 7.351 3.366 420 3HG1 VAL 75 3HG1 VAL 75 -5.141 6.131 2.179 421 1HG2 VAL 75 1HG2 VAL 75 -5.999 8.132 0.693 422 2HG2 VAL 75 2HG2 VAL 75 -5.464 9.190 2.001 423 3HG2 VAL 75 3HG2 VAL 75 -7.134 9.255 1.434 424 H PHE 76 H PHE 76 -7.943 7.374 -0.357 425 HA PHE 76 HA PHE 76 -7.095 4.685 -1.217 426 1HB PHE 76 2HB PHE 76 -9.054 6.514 -2.606 427 2HB PHE 76 1HB PHE 76 -8.538 4.932 -3.171 428 HD1 PHE 76 1HD PHE 76 -9.121 2.942 -1.806 429 HD2 PHE 76 2HD PHE 76 -10.814 6.749 -1.081 430 HE1 PHE 76 1HE PHE 76 -10.952 1.878 -0.536 431 HE2 PHE 76 2HE PHE 76 -12.638 5.719 0.176 432 HZ PHE 76 HZ PHE 76 -12.705 3.250 0.452 433 H TRP 77 H TRP 77 -5.586 4.557 -2.814 434 HA TRP 77 HA TRP 77 -4.808 7.072 -4.086 435 1HB TRP 77 2HB TRP 77 -2.491 6.245 -4.321 436 2HB TRP 77 1HB TRP 77 -2.938 6.368 -2.631 437 HD1 TRP 77 HD TRP 77 -3.310 3.576 -5.173 438 HE1 TRP 77 1HE TRP 77 -2.263 1.373 -4.165 439 HE3 TRP 77 3HE TRP 77 -1.654 5.442 -0.771 440 HZ2 TRP 77 2HZ TRP 77 -0.922 0.625 -1.814 441 HZ3 TRP 77 3HZ TRP 77 -0.494 3.958 0.804 442 HH2 TRP 77 HH TRP 77 -0.138 1.599 0.292 443 H ASN 78 H ASN 78 -4.070 6.993 -6.197 444 HA ASN 78 HA ASN 78 -5.354 4.818 -7.692 445 1HB ASN 78 2HB ASN 78 -4.732 7.660 -8.557 446 2HB ASN 78 1HB ASN 78 -5.442 6.427 -9.586 447 1HD2 ASN 78 1HD2 ASN 78 -6.458 9.038 -8.824 448 2HD2 ASN 78 2HD2 ASN 78 -7.971 8.779 -8.056 449 H TYR 79 H TYR 79 -4.127 3.655 -9.009 450 HA TYR 79 HA TYR 79 -1.455 4.636 -9.642 451 1HB TYR 79 2HB TYR 79 -0.527 2.332 -9.408 452 2HB TYR 79 1HB TYR 79 -1.137 2.959 -7.890 453 HD1 TYR 79 1HD TYR 79 -1.328 0.304 -10.332 454 HD2 TYR 79 2HD TYR 79 -3.334 2.050 -7.008 455 HE1 TYR 79 1HE TYR 79 -2.608 -1.766 -10.026 456 HE2 TYR 79 2HE TYR 79 -4.628 -0.024 -6.701 457 HH TYR 79 HH TYR 79 -3.819 -2.929 -8.255 458 H VAL 80 H VAL 80 -0.687 3.981 -11.733 459 HA VAL 80 HA VAL 80 -3.012 3.372 -13.395 460 HB VAL 80 HB VAL 80 -0.492 4.878 -14.158 461 1HG1 VAL 80 1HG1 VAL 80 -1.697 5.458 -16.218 462 2HG1 VAL 80 2HG1 VAL 80 -3.049 4.449 -15.707 463 3HG1 VAL 80 3HG1 VAL 80 -1.489 3.713 -16.065 464 1HG2 VAL 80 1HG2 VAL 80 -1.933 6.867 -14.222 465 2HG2 VAL 80 2HG2 VAL 80 -1.861 6.163 -12.606 466 3HG2 VAL 80 3HG2 VAL 80 -3.280 5.899 -13.622 467 H HIS 81 H HIS 81 -3.047 1.615 -14.498 468 HA HIS 81 HA HIS 81 -0.576 0.246 -15.227 469 1HB HIS 81 2HB HIS 81 -1.422 -0.690 -13.030 470 2HB HIS 81 1HB HIS 81 -2.911 -1.133 -13.849 471 HD1 HIS 81 1HD HIS 81 0.607 -2.194 -13.327 472 HD2 HIS 81 2HD HIS 81 -2.668 -3.356 -15.582 473 HE1 HIS 81 1HE HIS 81 1.169 -4.465 -14.195 474 HE2 HIS 81 2HE HIS 81 -0.686 -4.967 -15.814 475 H ASP 82 H ASP 82 -0.697 -0.372 -17.265 476 HA ASP 82 HA ASP 82 -1.371 -0.680 -19.420 477 1HB ASP 82 2HB ASP 82 -4.028 -1.517 -18.205 478 2HB ASP 82 1HB ASP 82 -3.600 -1.706 -19.893 479 H GLY 83 H GLY 83 -1.753 1.843 -18.050 480 1HA GLY 83 2HA GLY 83 -2.393 3.925 -18.822 481 2HA GLY 83 1HA GLY 83 -3.332 3.143 -20.079 482 H GLU 84 H GLU 84 -4.362 1.596 -17.380 483 HA GLU 84 HA GLU 84 -6.656 3.377 -17.182 484 1HB GLU 84 2HB GLU 84 -6.989 0.908 -17.614 485 2HB GLU 84 1HB GLU 84 -6.323 0.597 -16.008 486 1HG GLU 84 2HG GLU 84 -8.094 1.833 -14.987 487 2HG GLU 84 1HG GLU 84 -8.780 2.224 -16.567 488 H ALA 85 H ALA 85 -7.276 4.242 -15.271 489 HA ALA 85 HA ALA 85 -5.254 4.366 -13.207 490 1HB ALA 85 1HB ALA 85 -7.987 5.657 -13.390 491 2HB ALA 85 2HB ALA 85 -6.453 6.421 -13.804 492 3HB ALA 85 3HB ALA 85 -6.797 5.979 -12.131 493 H LYS 86 H LYS 86 -5.190 2.843 -11.752 494 HA LYS 86 HA LYS 86 -7.575 1.212 -11.269 495 1HB LYS 86 2HB LYS 86 -4.798 0.604 -10.308 496 2HB LYS 86 1HB LYS 86 -6.103 -0.507 -10.672 497 1HG LYS 86 2HG LYS 86 -4.511 1.038 -12.684 498 2HG LYS 86 1HG LYS 86 -4.224 -0.642 -12.232 499 1HD LYS 86 2HD LYS 86 -6.759 0.406 -13.530 500 2HD LYS 86 1HD LYS 86 -5.421 -0.337 -14.406 501 1HE LYS 86 2HE LYS 86 -5.716 -2.353 -13.095 502 2HE LYS 86 1HE LYS 86 -7.132 -1.613 -12.304 503 1HZ LYS 86 1HZ LYS 86 -8.157 -1.478 -14.524 504 2HZ LYS 86 2HZ LYS 86 -7.803 -3.071 -14.083 505 3HZ LYS 86 3HZ LYS 86 -6.819 -2.278 -15.178 506 H VAL 87 H VAL 87 -8.173 0.997 -9.112 507 HA VAL 87 HA VAL 87 -6.954 3.021 -7.350 508 HB VAL 87 HB VAL 87 -9.823 2.075 -7.251 509 1HG1 VAL 87 1HG1 VAL 87 -8.477 4.429 -5.928 510 2HG1 VAL 87 2HG1 VAL 87 -9.026 2.957 -5.134 511 3HG1 VAL 87 3HG1 VAL 87 -10.200 4.063 -5.850 512 1HG2 VAL 87 1HG2 VAL 87 -8.757 4.602 -8.505 513 2HG2 VAL 87 2HG2 VAL 87 -10.463 4.208 -8.285 514 3HG2 VAL 87 3HG2 VAL 87 -9.464 3.228 -9.361 515 H ALA 88 H ALA 88 -6.572 2.436 -5.215 516 HA ALA 88 HA ALA 88 -6.843 -0.432 -4.661 517 1HB ALA 88 1HB ALA 88 -4.525 0.371 -4.697 518 2HB ALA 88 2HB ALA 88 -5.000 -0.126 -3.075 519 3HB ALA 88 3HB ALA 88 -4.927 1.586 -3.490 520 H LYS 89 H LYS 89 -8.136 -1.024 -3.074 521 HA LYS 89 HA LYS 89 -9.187 1.060 -1.327 522 1HB LYS 89 2HB LYS 89 -10.457 -1.593 -2.136 523 2HB LYS 89 1HB LYS 89 -11.101 -0.528 -0.898 524 1HG LYS 89 2HG LYS 89 -12.360 -0.196 -2.931 525 2HG LYS 89 1HG LYS 89 -11.403 1.242 -2.613 526 1HD LYS 89 2HD LYS 89 -9.721 0.385 -4.258 527 2HD LYS 89 1HD LYS 89 -10.831 -0.936 -4.621 528 1HE LYS 89 2HE LYS 89 -11.427 2.010 -4.965 529 2HE LYS 89 1HE LYS 89 -10.967 0.889 -6.244 530 1HZ LYS 89 1HZ LYS 89 -13.451 0.639 -4.608 531 2HZ LYS 89 2HZ LYS 89 -13.005 -0.315 -5.908 532 3HZ LYS 89 3HZ LYS 89 -13.368 1.305 -6.134 533 H GLU 90 H GLU 90 -8.718 1.030 0.783 534 HA GLU 90 HA GLU 90 -7.510 -1.327 1.947 535 1HB GLU 90 2HB GLU 90 -5.557 0.010 2.624 536 2HB GLU 90 1HB GLU 90 -5.656 -0.156 0.872 537 1HG GLU 90 2HG GLU 90 -6.591 2.068 0.671 538 2HG GLU 90 1HG GLU 90 -6.631 2.236 2.415 539 H ARG 91 H ARG 91 -7.347 -1.090 4.197 540 HA ARG 91 HA ARG 91 -8.373 1.346 5.442 541 1HB ARG 91 2HB ARG 91 -10.189 -0.337 5.566 542 2HB ARG 91 1HB ARG 91 -9.081 -1.475 6.328 543 1HG ARG 91 2HG ARG 91 -8.776 0.190 8.172 544 2HG ARG 91 1HG ARG 91 -10.054 1.147 7.435 545 1HD ARG 91 2HD ARG 91 -10.323 -1.682 8.379 546 2HD ARG 91 1HD ARG 91 -10.795 -0.250 9.308 547 HE ARG 91 HE ARG 91 -12.074 -0.462 6.740 548 1HH1 ARG 91 1HH1 ARG 91 -12.194 -1.511 10.123 549 2HH1 ARG 91 2HH1 ARG 91 -13.879 -1.724 10.161 550 1HH2 ARG 91 1HH2 ARG 91 -14.446 -0.809 6.780 551 2HH2 ARG 91 2HH2 ARG 91 -15.175 -1.321 8.222 552 H ILE 92 H ILE 92 -7.168 1.936 7.207 553 HA ILE 92 HA ILE 92 -4.649 0.594 7.572 554 HB ILE 92 HB ILE 92 -5.868 2.951 9.012 555 1HG1 ILE 92 2HG1 ILE 92 -5.493 3.491 6.697 556 2HG1 ILE 92 1HG1 ILE 92 -4.254 4.290 7.655 557 1HG2 ILE 92 1HG2 ILE 92 -3.601 3.459 9.831 558 2HG2 ILE 92 2HG2 ILE 92 -3.041 1.911 9.191 559 3HG2 ILE 92 3HG2 ILE 92 -4.254 1.957 10.474 560 1HD1 ILE 92 1HD1 ILE 92 -2.674 2.524 7.042 561 2HD1 ILE 92 2HD1 ILE 92 -3.313 3.378 5.635 562 3HD1 ILE 92 3HD1 ILE 92 -3.912 1.772 6.046 563 H GLU 93 H GLU 93 -4.289 -0.997 8.888 564 HA GLU 93 HA GLU 93 -6.143 -1.546 11.082 565 1HB GLU 93 2HB GLU 93 -3.965 -3.240 9.867 566 2HB GLU 93 1HB GLU 93 -5.002 -3.744 11.194 567 1HG GLU 93 2HG GLU 93 -5.980 -2.996 8.445 568 2HG GLU 93 1HG GLU 93 -5.663 -4.638 8.996 569 H ALA 94 H ALA 94 -2.820 -0.703 10.407 570 HA ALA 94 HA ALA 94 -2.361 0.152 13.100 571 1HB ALA 94 1HB ALA 94 -0.351 -1.244 13.439 572 2HB ALA 94 2HB ALA 94 -0.705 -2.115 11.949 573 3HB ALA 94 3HB ALA 94 -1.802 -2.239 13.322 574 H VAL 95 H VAL 95 -0.724 1.742 13.093 575 HA VAL 95 HA VAL 95 0.875 1.958 10.713 576 HB VAL 95 HB VAL 95 -1.123 3.190 10.056 577 1HG1 VAL 95 1HG1 VAL 95 -0.682 4.919 12.484 578 2HG1 VAL 95 2HG1 VAL 95 -2.024 3.810 12.209 579 3HG1 VAL 95 3HG1 VAL 95 -1.842 5.240 11.194 580 1HG2 VAL 95 1HG2 VAL 95 1.001 4.011 9.216 581 2HG2 VAL 95 2HG2 VAL 95 1.193 5.033 10.643 582 3HG2 VAL 95 3HG2 VAL 95 -0.107 5.356 9.493 583 H GLU 96 H GLU 96 2.847 2.441 11.191 584 HA GLU 96 HA GLU 96 3.498 3.916 13.664 585 1HB GLU 96 2HB GLU 96 5.174 2.028 12.021 586 2HB GLU 96 1HB GLU 96 5.702 2.883 13.443 587 1HG GLU 96 2HG GLU 96 3.522 0.821 13.421 588 2HG GLU 96 1HG GLU 96 5.216 0.519 13.841 589 HA PRO 97 HA PRO 97 4.745 6.796 10.331 590 1HB PRO 97 2HB PRO 97 5.076 8.640 12.610 591 2HB PRO 97 1HB PRO 97 4.075 8.823 11.167 592 1HG PRO 97 2HG PRO 97 2.978 8.369 13.572 593 2HG PRO 97 1HG PRO 97 2.294 7.673 12.092 594 1HD PRO 97 2HD PRO 97 4.040 6.377 14.154 595 2HD PRO 97 1HD PRO 97 2.586 5.742 13.341 596 H ASP 98 H ASP 98 6.168 6.335 13.491 597 HA ASP 98 HA ASP 98 8.738 7.356 12.711 598 1HB ASP 98 2HB ASP 98 8.071 7.756 14.970 599 2HB ASP 98 1HB ASP 98 7.786 6.045 15.248 600 H LYS 99 H LYS 99 7.345 4.174 13.058 601 HA LYS 99 HA LYS 99 9.960 2.949 12.653 602 1HB LYS 99 2HB LYS 99 7.293 1.631 13.004 603 2HB LYS 99 1HB LYS 99 8.836 0.813 12.865 604 1HG LYS 99 2HG LYS 99 9.587 2.041 14.901 605 2HG LYS 99 1HG LYS 99 7.928 2.627 15.067 606 1HD LYS 99 2HD LYS 99 7.125 0.330 15.076 607 2HD LYS 99 1HD LYS 99 8.804 -0.211 14.920 608 1HE LYS 99 2HE LYS 99 8.077 -0.387 17.249 609 2HE LYS 99 1HE LYS 99 9.337 0.834 17.047 610 1HZ LYS 99 1HZ LYS 99 7.458 1.523 18.497 611 2HZ LYS 99 2HZ LYS 99 6.448 1.528 17.124 612 3HZ LYS 99 3HZ LYS 99 7.770 2.543 17.210 613 H ASN 100 H ASN 100 7.741 4.258 10.611 614 HA ASN 100 HA ASN 100 7.155 4.024 8.403 615 1HB ASN 100 2HB ASN 100 9.720 2.401 8.286 616 2HB ASN 100 1HB ASN 100 8.792 2.874 6.874 617 1HD2 ASN 100 1HD2 ASN 100 11.506 3.466 7.485 618 2HD2 ASN 100 2HD2 ASN 100 11.636 5.183 7.578 619 H LEU 101 H LEU 101 5.882 2.256 10.129 620 HA LEU 101 HA LEU 101 5.709 -0.239 8.553 621 1HB LEU 101 2HB LEU 101 6.543 -0.661 10.817 622 2HB LEU 101 1HB LEU 101 5.195 0.218 11.500 623 HG LEU 101 HG LEU 101 3.695 -1.485 10.420 624 1HD1 LEU 101 1HD1 LEU 101 6.263 -2.976 10.111 625 2HD1 LEU 101 2HD1 LEU 101 5.174 -2.397 8.841 626 3HD1 LEU 101 3HD1 LEU 101 4.630 -3.648 9.958 627 1HD2 LEU 101 1HD2 LEU 101 3.962 -3.085 12.191 628 2HD2 LEU 101 2HD2 LEU 101 4.092 -1.433 12.774 629 3HD2 LEU 101 3HD2 LEU 101 5.560 -2.415 12.594 630 H ILE 102 H ILE 102 3.721 -0.679 7.764 631 HA ILE 102 HA ILE 102 1.445 0.489 9.040 632 HB ILE 102 HB ILE 102 2.103 2.303 7.655 633 1HG1 ILE 102 2HG1 ILE 102 -0.258 0.939 6.343 634 2HG1 ILE 102 1HG1 ILE 102 -0.317 1.891 7.823 635 1HG2 ILE 102 1HG2 ILE 102 2.301 2.160 5.199 636 2HG2 ILE 102 2HG2 ILE 102 2.095 0.414 5.318 637 3HG2 ILE 102 3HG2 ILE 102 3.493 1.166 6.045 638 1HD1 ILE 102 1HD1 ILE 102 0.465 2.918 5.105 639 2HD1 ILE 102 2HD1 ILE 102 0.389 3.872 6.589 640 3HD1 ILE 102 3HD1 ILE 102 -1.082 3.186 5.906 641 H THR 103 H THR 103 -0.068 -0.863 9.111 642 HA THR 103 HA THR 103 -0.142 -3.205 7.343 643 HB THR 103 HB THR 103 -1.677 -2.643 9.895 644 HG1 THR 103 1HG THR 103 0.635 -4.202 9.356 645 1HG2 THR 103 1HG2 THR 103 -2.158 -5.050 9.872 646 2HG2 THR 103 2HG2 THR 103 -1.288 -5.207 8.347 647 3HG2 THR 103 3HG2 THR 103 -2.780 -4.276 8.412 648 H PHE 104 H PHE 104 -1.494 -3.234 5.660 649 HA PHE 104 HA PHE 104 -3.858 -1.485 5.541 650 1HB PHE 104 2HB PHE 104 -2.377 -2.998 3.397 651 2HB PHE 104 1HB PHE 104 -3.732 -1.959 3.069 652 HD1 PHE 104 1HD PHE 104 -3.392 0.537 3.626 653 HD2 PHE 104 2HD PHE 104 -0.237 -2.283 3.337 654 HE1 PHE 104 1HE PHE 104 -1.796 2.361 3.227 655 HE2 PHE 104 2HE PHE 104 1.358 -0.470 2.930 656 HZ PHE 104 HZ PHE 104 0.588 1.853 2.877 657 H ARG 105 H ARG 105 -5.817 -2.408 5.150 658 HA ARG 105 HA ARG 105 -6.051 -5.352 4.880 659 1HB ARG 105 2HB ARG 105 -6.930 -4.609 7.026 660 2HB ARG 105 1HB ARG 105 -7.864 -3.344 6.239 661 1HG ARG 105 2HG ARG 105 -9.118 -5.160 5.042 662 2HG ARG 105 1HG ARG 105 -8.295 -6.315 6.088 663 1HD ARG 105 2HD ARG 105 -9.255 -5.263 8.049 664 2HD ARG 105 1HD ARG 105 -9.982 -4.017 7.027 665 HE ARG 105 HE ARG 105 -10.730 -6.687 6.319 666 1HH1 ARG 105 1HH1 ARG 105 -11.536 -4.025 8.515 667 2HH1 ARG 105 2HH1 ARG 105 -13.199 -4.381 8.545 668 1HH2 ARG 105 1HH2 ARG 105 -13.026 -7.164 6.393 669 2HH2 ARG 105 2HH2 ARG 105 -14.067 -6.180 7.320 670 H VAL 106 H VAL 106 -7.293 -6.012 3.081 671 HA VAL 106 HA VAL 106 -8.291 -3.871 1.383 672 HB VAL 106 HB VAL 106 -7.252 -6.051 0.371 673 1HG1 VAL 106 1HG1 VAL 106 -8.618 -7.986 0.140 674 2HG1 VAL 106 2HG1 VAL 106 -9.860 -7.243 1.150 675 3HG1 VAL 106 3HG1 VAL 106 -8.291 -7.616 1.843 676 1HG2 VAL 106 1HG2 VAL 106 -8.553 -4.438 -0.962 677 2HG2 VAL 106 2HG2 VAL 106 -10.033 -5.300 -0.550 678 3HG2 VAL 106 3HG2 VAL 106 -8.796 -6.085 -1.521 679 H ILE 107 H ILE 107 -10.465 -3.385 1.056 680 HA ILE 107 HA ILE 107 -12.256 -4.820 2.914 681 HB ILE 107 HB ILE 107 -13.383 -2.851 3.644 682 1HG1 ILE 107 2HG1 ILE 107 -13.239 -1.558 1.475 683 2HG1 ILE 107 1HG1 ILE 107 -12.939 -0.591 2.903 684 1HG2 ILE 107 1HG2 ILE 107 -11.653 -1.661 4.833 685 2HG2 ILE 107 2HG2 ILE 107 -10.457 -2.242 3.700 686 3HG2 ILE 107 3HG2 ILE 107 -11.257 -3.392 4.797 687 1HD1 ILE 107 1HD1 ILE 107 -11.452 0.003 1.127 688 2HD1 ILE 107 2HD1 ILE 107 -10.908 -1.670 0.986 689 3HD1 ILE 107 3HD1 ILE 107 -10.547 -0.747 2.443 690 H GLU 108 H GLU 108 -11.995 -3.475 -0.257 691 HA GLU 108 HA GLU 108 -14.864 -3.417 -0.485 692 1HB GLU 108 2HB GLU 108 -13.582 -1.590 -1.487 693 2HB GLU 108 1HB GLU 108 -12.928 -2.718 -2.667 694 1HG GLU 108 2HG GLU 108 -15.214 -3.195 -3.450 695 2HG GLU 108 1HG GLU 108 -15.828 -1.984 -2.326 696 H GLY 109 H GLY 109 -12.933 -4.679 -3.262 697 1HA GLY 109 2HA GLY 109 -14.673 -7.018 -3.014 698 2HA GLY 109 1HA GLY 109 -14.883 -5.994 -4.407 699 H ASP 110 H ASP 110 -12.276 -5.609 -5.304 700 HA ASP 110 HA ASP 110 -12.009 -7.832 -6.925 701 1HB ASP 110 2HB ASP 110 -10.954 -5.714 -7.482 702 2HB ASP 110 1HB ASP 110 -9.803 -5.918 -6.168 703 H LEU 111 H LEU 111 -9.946 -7.217 -4.114 704 HA LEU 111 HA LEU 111 -8.733 -9.800 -4.383 705 1HB LEU 111 2HB LEU 111 -8.571 -7.865 -2.090 706 2HB LEU 111 1HB LEU 111 -7.575 -9.286 -2.281 707 HG LEU 111 HG LEU 111 -7.570 -6.926 -4.173 708 1HD1 LEU 111 1HD1 LEU 111 -5.343 -6.476 -3.294 709 2HD1 LEU 111 2HD1 LEU 111 -5.543 -7.780 -2.126 710 3HD1 LEU 111 3HD1 LEU 111 -6.577 -6.352 -2.041 711 1HD2 LEU 111 1HD2 LEU 111 -7.043 -9.010 -5.327 712 2HD2 LEU 111 2HD2 LEU 111 -5.843 -9.400 -4.097 713 3HD2 LEU 111 3HD2 LEU 111 -5.595 -8.015 -5.155 714 H MET 112 H MET 112 -11.510 -8.635 -2.824 715 HA MET 112 HA MET 112 -11.741 -10.654 -0.803 716 1HB MET 112 2HB MET 112 -13.803 -8.814 -2.001 717 2HB MET 112 1HB MET 112 -14.090 -9.843 -0.611 718 1HG MET 112 2HG MET 112 -11.931 -7.755 -0.570 719 2HG MET 112 1HG MET 112 -13.602 -7.314 -0.272 720 1HE MET 112 1HE MET 112 -11.711 -10.678 1.068 721 2HE MET 112 2HE MET 112 -11.107 -10.013 2.567 722 3HE MET 112 3HE MET 112 -10.475 -9.405 1.038 723 H LYS 113 H LYS 113 -12.364 -10.486 -4.131 724 HA LYS 113 HA LYS 113 -14.412 -12.454 -4.357 725 1HB LYS 113 2HB LYS 113 -12.389 -11.521 -6.368 726 2HB LYS 113 1HB LYS 113 -13.812 -12.499 -6.712 727 1HG LYS 113 2HG LYS 113 -15.237 -10.687 -5.911 728 2HG LYS 113 1HG LYS 113 -13.799 -9.701 -5.624 729 1HD LYS 113 2HD LYS 113 -13.214 -9.939 -7.977 730 2HD LYS 113 1HD LYS 113 -14.713 -10.868 -8.182 731 1HE LYS 113 2HE LYS 113 -16.041 -8.937 -7.510 732 2HE LYS 113 1HE LYS 113 -14.572 -7.999 -7.237 733 1HZ LYS 113 1HZ LYS 113 -15.571 -7.431 -9.325 734 2HZ LYS 113 2HZ LYS 113 -15.513 -9.035 -9.857 735 3HZ LYS 113 3HZ LYS 113 -14.088 -8.178 -9.598 736 H GLU 114 H GLU 114 -11.010 -12.447 -4.089 737 HA GLU 114 HA GLU 114 -10.807 -15.278 -4.807 738 1HB GLU 114 2HB GLU 114 -8.747 -13.119 -4.525 739 2HB GLU 114 1HB GLU 114 -8.312 -14.792 -4.769 740 1HG GLU 114 2HG GLU 114 -9.566 -14.772 -6.896 741 2HG GLU 114 1HG GLU 114 -9.932 -13.070 -6.633 742 H TYR 115 H TYR 115 -9.943 -12.994 -2.259 743 HA TYR 115 HA TYR 115 -9.403 -15.283 -0.499 744 1HB TYR 115 2HB TYR 115 -8.418 -12.467 -0.091 745 2HB TYR 115 1HB TYR 115 -7.804 -13.953 0.618 746 HD1 TYR 115 1HD TYR 115 -7.559 -11.617 -2.035 747 HD2 TYR 115 2HD TYR 115 -6.521 -15.610 -0.971 748 HE1 TYR 115 1HE TYR 115 -5.915 -11.679 -3.840 749 HE2 TYR 115 2HE TYR 115 -4.881 -15.660 -2.759 750 HH TYR 115 HH TYR 115 -4.571 -14.399 -5.028 751 H LYS 116 H LYS 116 -10.337 -15.141 1.531 752 HA LYS 116 HA LYS 116 -12.619 -13.368 1.628 753 1HB LYS 116 2HB LYS 116 -13.224 -14.738 3.690 754 2HB LYS 116 1HB LYS 116 -13.313 -15.553 2.146 755 1HG LYS 116 2HG LYS 116 -10.996 -16.444 2.640 756 2HG LYS 116 1HG LYS 116 -11.207 -15.799 4.269 757 1HD LYS 116 2HD LYS 116 -13.073 -17.728 2.933 758 2HD LYS 116 1HD LYS 116 -11.784 -18.223 4.040 759 1HE LYS 116 2HE LYS 116 -12.843 -16.881 5.810 760 2HE LYS 116 1HE LYS 116 -14.117 -16.420 4.686 761 1HZ LYS 116 1HZ LYS 116 -14.812 -18.243 6.116 762 2HZ LYS 116 2HZ LYS 116 -13.530 -19.187 5.579 763 3HZ LYS 116 3HZ LYS 116 -14.761 -18.753 4.518 764 H SER 117 H SER 117 -9.513 -13.321 2.643 765 HA SER 117 HA SER 117 -9.960 -10.843 3.890 766 1HB SER 117 2HB SER 117 -8.946 -11.373 6.065 767 2HB SER 117 1HB SER 117 -10.362 -12.393 5.763 768 HG SER 117 HG SER 117 -8.877 -13.738 6.470 769 H PHE 118 H PHE 118 -8.192 -9.578 3.573 770 HA PHE 118 HA PHE 118 -5.665 -10.859 2.997 771 1HB PHE 118 2HB PHE 118 -6.557 -10.549 0.744 772 2HB PHE 118 1HB PHE 118 -6.992 -8.890 1.100 773 HD1 PHE 118 1HD PHE 118 -4.033 -11.124 0.967 774 HD2 PHE 118 2HD PHE 118 -5.571 -7.212 0.455 775 HE1 PHE 118 1HE PHE 118 -1.863 -10.394 0.135 776 HE2 PHE 118 2HE PHE 118 -3.394 -6.467 -0.397 777 HZ PHE 118 HZ PHE 118 -1.529 -8.056 -0.559 778 H LEU 119 H LEU 119 -4.250 -10.039 4.261 779 HA LEU 119 HA LEU 119 -4.513 -7.250 5.106 780 1HB LEU 119 2HB LEU 119 -5.121 -8.991 6.798 781 2HB LEU 119 1HB LEU 119 -3.508 -9.645 6.645 782 HG LEU 119 HG LEU 119 -2.614 -7.473 7.481 783 1HD1 LEU 119 1HD1 LEU 119 -4.161 -5.954 8.575 784 2HD1 LEU 119 2HD1 LEU 119 -5.529 -6.893 7.975 785 3HD1 LEU 119 3HD1 LEU 119 -4.471 -6.049 6.840 786 1HD2 LEU 119 1HD2 LEU 119 -3.249 -7.867 9.811 787 2HD2 LEU 119 2HD2 LEU 119 -2.933 -9.385 8.971 788 3HD2 LEU 119 3HD2 LEU 119 -4.592 -8.876 9.278 789 H LEU 120 H LEU 120 -2.636 -6.108 4.687 790 HA LEU 120 HA LEU 120 -0.192 -7.653 4.361 791 1HB LEU 120 2HB LEU 120 0.514 -6.500 2.358 792 2HB LEU 120 1HB LEU 120 -1.002 -7.305 2.074 793 HG LEU 120 HG LEU 120 -0.703 -4.326 2.536 794 1HD1 LEU 120 1HD1 LEU 120 -1.060 -4.100 0.148 795 2HD1 LEU 120 2HD1 LEU 120 -1.116 -5.859 -0.027 796 3HD1 LEU 120 3HD1 LEU 120 0.370 -5.084 0.490 797 1HD2 LEU 120 1HD2 LEU 120 -2.926 -5.135 3.133 798 2HD2 LEU 120 2HD2 LEU 120 -3.055 -5.969 1.586 799 3HD2 LEU 120 3HD2 LEU 120 -2.992 -4.211 1.633 800 H THR 121 H THR 121 1.575 -6.726 5.072 801 HA THR 121 HA THR 121 1.294 -4.014 6.191 802 HB THR 121 HB THR 121 2.762 -6.355 7.394 803 HG1 THR 121 1HG THR 121 0.277 -6.064 7.299 804 1HG2 THR 121 1HG2 THR 121 3.725 -4.200 7.964 805 2HG2 THR 121 2HG2 THR 121 2.901 -4.888 9.369 806 3HG2 THR 121 3HG2 THR 121 2.141 -3.597 8.433 807 H ILE 122 H ILE 122 2.893 -2.644 5.597 808 HA ILE 122 HA ILE 122 5.315 -3.846 4.472 809 HB ILE 122 HB ILE 122 5.602 -1.871 3.075 810 1HG1 ILE 122 2HG1 ILE 122 2.901 -1.004 4.063 811 2HG1 ILE 122 1HG1 ILE 122 4.431 -0.258 4.494 812 1HG2 ILE 122 1HG2 ILE 122 4.411 -3.762 2.129 813 2HG2 ILE 122 2HG2 ILE 122 3.744 -2.250 1.506 814 3HG2 ILE 122 3HG2 ILE 122 2.889 -3.132 2.766 815 1HD1 ILE 122 1HD1 ILE 122 3.260 -0.365 1.714 816 2HD1 ILE 122 2HD1 ILE 122 4.789 0.393 2.164 817 3HD1 ILE 122 3HD1 ILE 122 3.269 1.038 2.782 818 H GLN 123 H GLN 123 7.247 -2.927 5.013 819 HA GLN 123 HA GLN 123 7.230 -0.598 6.721 820 1HB GLN 123 2HB GLN 123 7.179 -2.617 8.226 821 2HB GLN 123 1HB GLN 123 8.699 -3.123 7.513 822 1HG GLN 123 2HG GLN 123 9.834 -1.206 8.389 823 2HG GLN 123 1HG GLN 123 8.317 -0.504 8.946 824 1HE2 GLN 123 1HE2 GLN 123 8.976 -0.396 11.075 825 2HE2 GLN 123 2HE2 GLN 123 9.153 -1.802 12.064 826 H VAL 124 H VAL 124 8.826 0.717 6.222 827 HA VAL 124 HA VAL 124 10.618 -0.163 4.083 828 HB VAL 124 HB VAL 124 10.120 2.646 5.126 829 1HG1 VAL 124 1HG1 VAL 124 11.207 3.395 3.061 830 2HG1 VAL 124 2HG1 VAL 124 11.543 1.717 2.632 831 3HG1 VAL 124 3HG1 VAL 124 12.298 2.432 4.058 832 1HG2 VAL 124 1HG2 VAL 124 8.107 1.705 4.122 833 2HG2 VAL 124 2HG2 VAL 124 9.015 1.265 2.679 834 3HG2 VAL 124 3HG2 VAL 124 8.781 2.966 3.085 835 H THR 125 H THR 125 12.473 -0.934 4.671 836 HA THR 125 HA THR 125 13.804 0.086 7.067 837 HB THR 125 HB THR 125 13.912 -2.630 5.727 838 HG1 THR 125 1HG THR 125 12.399 -1.505 7.767 839 1HG2 THR 125 1HG2 THR 125 15.046 -3.357 7.757 840 2HG2 THR 125 2HG2 THR 125 15.047 -1.706 8.380 841 3HG2 THR 125 3HG2 THR 125 15.996 -2.108 6.937 842 HA PRO 126 HA PRO 126 16.829 1.568 4.073 843 1HB PRO 126 2HB PRO 126 18.921 1.914 5.798 844 2HB PRO 126 1HB PRO 126 17.574 3.054 5.665 845 1HG PRO 126 2HG PRO 126 17.999 0.849 7.643 846 2HG PRO 126 1HG PRO 126 17.465 2.515 7.937 847 1HD PRO 126 2HD PRO 126 15.729 0.487 7.865 848 2HD PRO 126 1HD PRO 126 15.302 2.074 7.184 849 H LYS 127 H LYS 127 18.374 0.639 2.836 850 HA LYS 127 HA LYS 127 19.200 -2.046 3.589 851 1HB LYS 127 2HB LYS 127 19.826 -2.305 1.214 852 2HB LYS 127 1HB LYS 127 18.163 -1.774 1.400 853 1HG LYS 127 2HG LYS 127 18.811 0.509 0.838 854 2HG LYS 127 1HG LYS 127 20.488 -0.011 0.665 855 1HD LYS 127 2HD LYS 127 18.174 -1.065 -0.958 856 2HD LYS 127 1HD LYS 127 19.273 0.196 -1.512 857 1HE LYS 127 2HE LYS 127 21.156 -1.400 -1.286 858 2HE LYS 127 1HE LYS 127 20.009 -2.654 -0.815 859 1HZ LYS 127 1HZ LYS 127 20.597 -2.789 -3.150 860 2HZ LYS 127 2HZ LYS 127 20.019 -1.229 -3.422 861 3HZ LYS 127 3HZ LYS 127 18.959 -2.457 -2.979 862 HA PRO 128 HA PRO 128 23.433 -1.007 4.411 863 1HB PRO 128 2HB PRO 128 24.335 -2.905 2.315 864 2HB PRO 128 1HB PRO 128 24.738 -2.875 4.035 865 1HG PRO 128 2HG PRO 128 23.067 -4.717 3.073 866 2HG PRO 128 1HG PRO 128 22.780 -3.963 4.653 867 1HD PRO 128 2HD PRO 128 21.432 -3.424 2.030 868 2HD PRO 128 1HD PRO 128 20.739 -3.497 3.650 869 H GLY 129 H GLY 129 23.969 0.970 3.711 870 1HA GLY 129 2HA GLY 129 25.602 1.777 1.847 871 2HA GLY 129 1HA GLY 129 24.155 1.529 0.871 872 H GLY 130 H GLY 130 24.249 3.811 0.462 873 1HA GLY 130 2HA GLY 130 23.449 5.454 2.752 874 2HA GLY 130 1HA GLY 130 24.008 6.073 1.207 875 HA PRO 131 HA PRO 131 19.734 6.241 0.010 876 1HB PRO 131 2HB PRO 131 20.168 5.938 -2.774 877 2HB PRO 131 1HB PRO 131 20.079 7.457 -1.882 878 1HG PRO 131 2HG PRO 131 22.350 6.399 -3.142 879 2HG PRO 131 1HG PRO 131 22.323 7.742 -1.986 880 1HD PRO 131 2HD PRO 131 23.036 4.885 -1.577 881 2HD PRO 131 1HD PRO 131 23.638 6.333 -0.743 882 H GLY 132 H GLY 132 18.006 4.960 -0.728 883 1HA GLY 132 2HA GLY 132 17.181 3.064 -1.888 884 2HA GLY 132 1HA GLY 132 18.714 2.256 -1.565 885 H SER 133 H SER 133 15.937 1.483 -0.913 886 HA SER 133 HA SER 133 16.497 0.654 1.786 887 1HB SER 133 2HB SER 133 14.017 2.271 1.124 888 2HB SER 133 1HB SER 133 14.273 1.401 2.637 889 HG SER 133 HG SER 133 16.308 3.085 1.880 890 H ILE 134 H ILE 134 15.041 -1.066 2.462 891 HA ILE 134 HA ILE 134 13.734 -2.333 0.217 892 HB ILE 134 HB ILE 134 15.369 -3.527 2.418 893 1HG1 ILE 134 2HG1 ILE 134 15.853 -5.258 0.720 894 2HG1 ILE 134 1HG1 ILE 134 14.783 -4.426 -0.392 895 1HG2 ILE 134 1HG2 ILE 134 14.318 -5.700 2.268 896 2HG2 ILE 134 2HG2 ILE 134 12.986 -4.960 1.362 897 3HG2 ILE 134 3HG2 ILE 134 13.278 -4.482 3.043 898 1HD1 ILE 134 1HD1 ILE 134 16.226 -2.505 -0.272 899 2HD1 ILE 134 2HD1 ILE 134 16.984 -3.981 -0.886 900 3HD1 ILE 134 3HD1 ILE 134 17.329 -3.469 0.786 901 H VAL 135 H VAL 135 11.619 -2.438 0.340 902 HA VAL 135 HA VAL 135 10.379 -2.015 2.919 903 HB VAL 135 HB VAL 135 9.488 -0.602 1.123 904 1HG1 VAL 135 1HG1 VAL 135 8.788 -3.112 -0.324 905 2HG1 VAL 135 2HG1 VAL 135 10.001 -1.922 -0.800 906 3HG1 VAL 135 3HG1 VAL 135 8.288 -1.483 -0.788 907 1HG2 VAL 135 1HG2 VAL 135 7.505 -2.721 1.920 908 2HG2 VAL 135 2HG2 VAL 135 7.097 -1.126 1.288 909 3HG2 VAL 135 3HG2 VAL 135 7.915 -1.275 2.841 910 H HIS 136 H HIS 136 9.693 -3.584 4.051 911 HA HIS 136 HA HIS 136 9.730 -6.275 2.931 912 1HB HIS 136 2HB HIS 136 9.491 -5.290 5.784 913 2HB HIS 136 1HB HIS 136 9.385 -6.986 5.345 914 HD1 HIS 136 1HD HIS 136 11.589 -8.229 5.141 915 HD2 HIS 136 2HD HIS 136 12.113 -4.104 5.375 916 HE1 HIS 136 1HE HIS 136 14.022 -7.877 5.460 917 HE2 HIS 136 2HE HIS 136 14.344 -5.409 5.303 918 H TRP 137 H TRP 137 7.938 -6.953 2.002 919 HA TRP 137 HA TRP 137 5.358 -5.969 2.891 920 1HB TRP 137 2HB TRP 137 6.169 -7.698 0.543 921 2HB TRP 137 1HB TRP 137 4.535 -7.225 0.930 922 HD1 TRP 137 HD TRP 137 7.895 -5.456 -0.052 923 HE1 TRP 137 1HE TRP 137 7.262 -3.407 -1.405 924 HE3 TRP 137 3HE TRP 137 2.795 -5.736 0.319 925 HZ2 TRP 137 2HZ TRP 137 4.989 -2.047 -2.192 926 HZ3 TRP 137 3HZ TRP 137 1.463 -3.976 -0.784 927 HH2 TRP 137 HH TRP 137 2.522 -2.188 -1.988 928 H HIS 138 H HIS 138 4.264 -7.098 4.272 929 HA HIS 138 HA HIS 138 4.683 -10.024 4.454 930 1HB HIS 138 2HB HIS 138 3.495 -8.180 6.553 931 2HB HIS 138 1HB HIS 138 3.873 -9.871 6.768 932 HD1 HIS 138 1HD HIS 138 6.492 -10.448 7.077 933 HD2 HIS 138 2HD HIS 138 5.489 -6.422 6.954 934 HE1 HIS 138 1HE HIS 138 8.451 -9.249 8.018 935 HE2 HIS 138 2HE HIS 138 7.648 -6.904 8.286 936 H LEU 139 H LEU 139 3.013 -10.958 3.341 937 HA LEU 139 HA LEU 139 0.417 -9.602 3.473 938 1HB LEU 139 2HB LEU 139 1.436 -11.550 1.390 939 2HB LEU 139 1HB LEU 139 -0.148 -10.835 1.410 940 HG LEU 139 HG LEU 139 0.990 -8.580 1.008 941 1HD1 LEU 139 1HD1 LEU 139 3.224 -9.105 1.747 942 2HD1 LEU 139 2HD1 LEU 139 3.210 -8.595 0.055 943 3HD1 LEU 139 3HD1 LEU 139 3.384 -10.301 0.459 944 1HD2 LEU 139 1HD2 LEU 139 1.339 -10.740 -1.053 945 2HD2 LEU 139 2HD2 LEU 139 1.330 -9.008 -1.369 946 3HD2 LEU 139 3HD2 LEU 139 -0.127 -9.800 -0.770 947 H GLU 140 H GLU 140 -1.010 -10.637 4.647 948 HA GLU 140 HA GLU 140 -0.793 -13.540 4.968 949 1HB GLU 140 2HB GLU 140 -1.787 -11.513 6.995 950 2HB GLU 140 1HB GLU 140 -2.019 -13.240 7.146 951 1HG GLU 140 2HG GLU 140 -0.237 -12.706 8.574 952 2HG GLU 140 1HG GLU 140 0.480 -13.457 7.155 953 H TYR 141 H TYR 141 -2.563 -14.650 4.366 954 HA TYR 141 HA TYR 141 -5.060 -13.252 4.152 955 1HB TYR 141 2HB TYR 141 -5.301 -13.617 1.673 956 2HB TYR 141 1HB TYR 141 -4.130 -12.412 2.224 957 HD1 TYR 141 1HD TYR 141 -1.719 -12.959 2.183 958 HD2 TYR 141 2HD TYR 141 -4.609 -15.406 0.339 959 HE1 TYR 141 1HE TYR 141 0.063 -13.999 0.922 960 HE2 TYR 141 2HE TYR 141 -2.863 -16.509 -0.993 961 HH TYR 141 HH TYR 141 0.463 -16.163 -0.301 962 H GLU 142 H GLU 142 -6.815 -14.438 3.491 963 HA GLU 142 HA GLU 142 -6.521 -17.287 4.123 964 1HB GLU 142 2HB GLU 142 -7.460 -15.915 5.905 965 2HB GLU 142 1HB GLU 142 -8.652 -15.275 4.811 966 1HG GLU 142 2HG GLU 142 -9.773 -17.314 4.732 967 2HG GLU 142 1HG GLU 142 -8.501 -18.150 5.672 968 H LYS 143 H LYS 143 -7.068 -18.555 2.472 969 HA LYS 143 HA LYS 143 -8.183 -17.511 0.063 970 1HB LYS 143 2HB LYS 143 -7.473 -20.333 0.880 971 2HB LYS 143 1HB LYS 143 -8.191 -19.960 -0.666 972 1HG LYS 143 2HG LYS 143 -5.812 -20.293 -0.868 973 2HG LYS 143 1HG LYS 143 -6.226 -18.629 -1.242 974 1HD LYS 143 2HD LYS 143 -5.409 -17.892 0.891 975 2HD LYS 143 1HD LYS 143 -5.171 -19.562 1.423 976 1HE LYS 143 2HE LYS 143 -3.828 -18.313 -0.932 977 2HE LYS 143 1HE LYS 143 -3.080 -18.406 0.675 978 1HZ LYS 143 1HZ LYS 143 -2.321 -20.230 -0.710 979 2HZ LYS 143 2HZ LYS 143 -3.907 -20.652 -1.078 980 3HZ LYS 143 3HZ LYS 143 -3.344 -20.874 0.467 981 H ILE 144 H ILE 144 -10.243 -17.722 -0.702 982 HA ILE 144 HA ILE 144 -12.315 -18.705 1.019 983 HB ILE 144 HB ILE 144 -12.320 -17.942 -1.915 984 1HG1 ILE 144 2HG1 ILE 144 -13.338 -16.526 0.523 985 2HG1 ILE 144 1HG1 ILE 144 -11.872 -16.099 -0.358 986 1HG2 ILE 144 1HG2 ILE 144 -14.672 -18.598 -0.141 987 2HG2 ILE 144 2HG2 ILE 144 -14.080 -19.550 -1.506 988 3HG2 ILE 144 3HG2 ILE 144 -14.772 -17.948 -1.783 989 1HD1 ILE 144 1HD1 ILE 144 -13.692 -14.602 -0.849 990 2HD1 ILE 144 2HD1 ILE 144 -14.698 -15.959 -1.343 991 3HD1 ILE 144 3HD1 ILE 144 -13.267 -15.528 -2.300 992 H SER 145 H SER 145 -10.746 -19.707 -1.943 993 HA SER 145 HA SER 145 -10.942 -22.457 -1.318 994 1HB SER 145 2HB SER 145 -12.475 -21.315 -3.675 995 2HB SER 145 1HB SER 145 -12.226 -23.032 -3.399 996 HG SER 145 HG SER 145 -13.228 -21.938 -1.198 997 H GLU 146 H GLU 146 -9.787 -23.637 -3.043 998 HA GLU 146 HA GLU 146 -7.331 -22.371 -3.593 999 1HB GLU 146 2HB GLU 146 -8.534 -24.920 -4.493 1000 2HB GLU 146 1HB GLU 146 -6.895 -24.452 -4.920 1001 1HG GLU 146 2HG GLU 146 -7.905 -24.777 -2.086 1002 2HG GLU 146 1HG GLU 146 -6.988 -26.005 -2.965 1003 H GLU 147 H GLU 147 -9.794 -23.667 -5.765 1004 HA GLU 147 HA GLU 147 -8.654 -22.849 -8.204 1005 1HB GLU 147 2HB GLU 147 -11.637 -22.898 -7.866 1006 2HB GLU 147 1HB GLU 147 -10.683 -23.382 -9.249 1007 1HG GLU 147 2HG GLU 147 -11.537 -25.380 -8.419 1008 2HG GLU 147 1HG GLU 147 -9.905 -25.331 -7.754 1009 H VAL 148 H VAL 148 -10.156 -21.124 -5.818 1010 HA VAL 148 HA VAL 148 -11.213 -19.021 -7.557 1011 HB VAL 148 HB VAL 148 -11.434 -19.307 -4.562 1012 1HG1 VAL 148 1HG1 VAL 148 -12.932 -17.524 -6.465 1013 2HG1 VAL 148 2HG1 VAL 148 -11.728 -17.018 -5.278 1014 3HG1 VAL 148 3HG1 VAL 148 -13.262 -17.703 -4.740 1015 1HG2 VAL 148 1HG2 VAL 148 -13.373 -20.061 -6.744 1016 2HG2 VAL 148 2HG2 VAL 148 -13.710 -20.097 -5.008 1017 3HG2 VAL 148 3HG2 VAL 148 -12.473 -21.158 -5.691 1018 H ALA 149 H ALA 149 -8.677 -19.464 -5.126 1019 HA ALA 149 HA ALA 149 -8.080 -16.619 -5.237 1020 1HB ALA 149 1HB ALA 149 -8.163 -17.719 -3.035 1021 2HB ALA 149 2HB ALA 149 -6.583 -17.010 -3.372 1022 3HB ALA 149 3HB ALA 149 -6.824 -18.752 -3.527 1023 H HIS 150 H HIS 150 -6.374 -15.687 -6.202 1024 HA HIS 150 HA HIS 150 -4.430 -17.520 -7.476 1025 1HB HIS 150 2HB HIS 150 -5.357 -14.863 -8.579 1026 2HB HIS 150 1HB HIS 150 -4.347 -16.052 -9.377 1027 HD1 HIS 150 1HD HIS 150 -7.150 -14.764 -10.295 1028 HD2 HIS 150 2HD HIS 150 -6.522 -18.587 -8.844 1029 HE1 HIS 150 1HE HIS 150 -8.992 -16.154 -11.271 1030 HE2 HIS 150 2HE HIS 150 -8.291 -18.481 -10.737 1031 HA PRO 151 HA PRO 151 -2.092 -14.713 -4.500 1032 1HB PRO 151 2HB PRO 151 -0.098 -16.842 -5.154 1033 2HB PRO 151 1HB PRO 151 -0.485 -16.111 -3.590 1034 1HG PRO 151 2HG PRO 151 -1.389 -18.524 -4.132 1035 2HG PRO 151 1HG PRO 151 -2.450 -17.341 -3.349 1036 1HD PRO 151 2HD PRO 151 -2.427 -18.262 -6.201 1037 2HD PRO 151 1HD PRO 151 -3.789 -17.908 -5.106 1038 H GLU 152 H GLU 152 -1.627 -15.670 -7.675 1039 HA GLU 152 HA GLU 152 0.752 -14.663 -8.693 1040 1HB GLU 152 2HB GLU 152 -1.989 -14.322 -9.916 1041 2HB GLU 152 1HB GLU 152 -0.458 -14.402 -10.762 1042 1HG GLU 152 2HG GLU 152 -0.179 -16.625 -10.146 1043 2HG GLU 152 1HG GLU 152 -1.642 -16.652 -9.168 1044 H THR 153 H THR 153 -2.280 -13.150 -8.042 1045 HA THR 153 HA THR 153 -1.802 -10.677 -9.305 1046 HB THR 153 HB THR 153 -4.052 -10.171 -8.496 1047 HG1 THR 153 1HG THR 153 -4.701 -12.396 -7.168 1048 1HG2 THR 153 1HG2 THR 153 -3.826 -11.714 -10.405 1049 2HG2 THR 153 2HG2 THR 153 -5.195 -12.213 -9.395 1050 3HG2 THR 153 3HG2 THR 153 -3.660 -13.071 -9.303 1051 H LEU 154 H LEU 154 -1.626 -11.804 -5.990 1052 HA LEU 154 HA LEU 154 -1.589 -9.321 -4.648 1053 1HB LEU 154 2HB LEU 154 -0.333 -11.918 -3.838 1054 2HB LEU 154 1HB LEU 154 -0.600 -10.546 -2.787 1055 HG LEU 154 HG LEU 154 -2.717 -12.216 -4.103 1056 1HD1 LEU 154 1HD1 LEU 154 -3.222 -12.888 -1.813 1057 2HD1 LEU 154 2HD1 LEU 154 -1.840 -11.953 -1.241 1058 3HD1 LEU 154 3HD1 LEU 154 -1.590 -13.346 -2.292 1059 1HD2 LEU 154 1HD2 LEU 154 -3.475 -9.915 -3.931 1060 2HD2 LEU 154 2HD2 LEU 154 -2.951 -9.859 -2.240 1061 3HD2 LEU 154 3HD2 LEU 154 -4.264 -10.923 -2.712 1062 H LEU 155 H LEU 155 1.124 -11.334 -5.870 1063 HA LEU 155 HA LEU 155 3.026 -9.682 -4.740 1064 1HB LEU 155 2HB LEU 155 3.387 -12.005 -5.203 1065 2HB LEU 155 1HB LEU 155 3.087 -11.747 -6.911 1066 HG LEU 155 HG LEU 155 4.956 -10.443 -7.107 1067 1HD1 LEU 155 1HD1 LEU 155 5.141 -9.450 -4.838 1068 2HD1 LEU 155 2HD1 LEU 155 6.658 -10.270 -5.202 1069 3HD1 LEU 155 3HD1 LEU 155 5.471 -11.039 -4.148 1070 1HD2 LEU 155 1HD2 LEU 155 6.699 -12.170 -6.724 1071 2HD2 LEU 155 2HD2 LEU 155 5.201 -12.796 -7.446 1072 3HD2 LEU 155 3HD2 LEU 155 5.520 -13.027 -5.725 1073 H GLN 156 H GLN 156 1.233 -9.673 -7.737 1074 HA GLN 156 HA GLN 156 2.918 -7.785 -9.063 1075 1HB GLN 156 2HB GLN 156 0.031 -8.526 -9.574 1076 2HB GLN 156 1HB GLN 156 1.024 -7.542 -10.640 1077 1HG GLN 156 2HG GLN 156 1.578 -10.391 -9.881 1078 2HG GLN 156 1HG GLN 156 0.853 -9.860 -11.408 1079 1HE2 GLN 156 1HE2 GLN 156 3.759 -10.066 -9.506 1080 2HE2 GLN 156 2HE2 GLN 156 4.847 -9.665 -10.779 1081 H PHE 157 H PHE 157 0.029 -7.630 -7.077 1082 HA PHE 157 HA PHE 157 -0.517 -4.897 -7.234 1083 1HB PHE 157 2HB PHE 157 -2.039 -6.541 -6.160 1084 2HB PHE 157 1HB PHE 157 -0.870 -6.777 -4.876 1085 HD1 PHE 157 1HD PHE 157 -1.131 -5.595 -2.911 1086 HD2 PHE 157 2HD PHE 157 -2.898 -4.087 -6.474 1087 HE1 PHE 157 1HE PHE 157 -2.254 -3.790 -1.598 1088 HE2 PHE 157 2HE PHE 157 -4.008 -2.311 -5.184 1089 HZ PHE 157 HZ PHE 157 -3.680 -2.166 -2.747 1090 H CYS 158 H CYS 158 1.692 -6.717 -5.199 1091 HA CYS 158 HA CYS 158 2.623 -4.635 -3.583 1092 1HB CYS 158 2HB CYS 158 4.139 -7.069 -4.545 1093 2HB CYS 158 1HB CYS 158 4.578 -6.058 -3.174 1094 HG CYS 158 HG CYS 158 1.687 -7.868 -3.353 1095 H VAL 159 H VAL 159 3.784 -5.819 -6.713 1096 HA VAL 159 HA VAL 159 6.034 -4.153 -6.918 1097 HB VAL 159 HB VAL 159 4.343 -5.268 -9.172 1098 1HG1 VAL 159 1HG1 VAL 159 7.186 -4.269 -9.163 1099 2HG1 VAL 159 2HG1 VAL 159 5.799 -3.480 -9.914 1100 3HG1 VAL 159 3HG1 VAL 159 6.372 -5.032 -10.537 1101 1HG2 VAL 159 1HG2 VAL 159 6.782 -6.425 -7.814 1102 2HG2 VAL 159 2HG2 VAL 159 5.995 -7.092 -9.246 1103 3HG2 VAL 159 3HG2 VAL 159 5.130 -7.043 -7.718 1104 H GLU 160 H GLU 160 2.715 -3.725 -8.064 1105 HA GLU 160 HA GLU 160 3.191 -1.289 -9.388 1106 1HB GLU 160 2HB GLU 160 0.604 -2.403 -8.320 1107 2HB GLU 160 1HB GLU 160 0.733 -1.017 -9.396 1108 1HG GLU 160 2HG GLU 160 1.557 -3.846 -10.000 1109 2HG GLU 160 1HG GLU 160 0.171 -2.980 -10.662 1110 H VAL 161 H VAL 161 2.232 -2.002 -6.116 1111 HA VAL 161 HA VAL 161 1.864 0.749 -5.455 1112 HB VAL 161 HB VAL 161 2.240 -1.680 -3.727 1113 1HG1 VAL 161 1HG1 VAL 161 1.400 -0.263 -1.840 1114 2HG1 VAL 161 2HG1 VAL 161 1.418 1.136 -2.914 1115 3HG1 VAL 161 3HG1 VAL 161 2.931 0.345 -2.477 1116 1HG2 VAL 161 1HG2 VAL 161 0.186 -1.704 -5.000 1117 2HG2 VAL 161 2HG2 VAL 161 -0.231 -0.091 -4.416 1118 3HG2 VAL 161 3HG2 VAL 161 -0.181 -1.448 -3.295 1119 H SER 162 H SER 162 4.583 -1.542 -5.243 1120 HA SER 162 HA SER 162 6.342 0.016 -3.728 1121 1HB SER 162 2HB SER 162 6.950 -1.926 -5.954 1122 2HB SER 162 1HB SER 162 8.117 -1.285 -4.794 1123 HG SER 162 HG SER 162 5.847 -2.896 -4.254 1124 H LYS 163 H LYS 163 5.748 -0.002 -7.216 1125 HA LYS 163 HA LYS 163 7.779 1.909 -7.711 1126 1HB LYS 163 2HB LYS 163 6.794 2.173 -9.959 1127 2HB LYS 163 1HB LYS 163 7.124 0.501 -9.513 1128 1HG LYS 163 2HG LYS 163 4.787 0.130 -9.092 1129 2HG LYS 163 1HG LYS 163 4.436 1.819 -9.410 1130 1HD LYS 163 2HD LYS 163 3.811 0.495 -11.345 1131 2HD LYS 163 1HD LYS 163 5.186 1.516 -11.741 1132 1HE LYS 163 2HE LYS 163 5.432 -1.408 -11.000 1133 2HE LYS 163 1HE LYS 163 5.217 -0.852 -12.650 1134 1HZ LYS 163 1HZ LYS 163 7.320 0.388 -12.420 1135 2HZ LYS 163 2HZ LYS 163 7.503 -1.263 -12.233 1136 3HZ LYS 163 3HZ LYS 163 7.572 -0.281 -10.887 1137 H GLU 164 H GLU 164 4.349 2.229 -7.012 1138 HA GLU 164 HA GLU 164 4.071 4.945 -7.630 1139 1HB GLU 164 2HB GLU 164 2.716 3.324 -5.497 1140 2HB GLU 164 1HB GLU 164 2.268 4.959 -5.908 1141 1HG GLU 164 2HG GLU 164 2.155 2.593 -7.762 1142 2HG GLU 164 1HG GLU 164 0.781 3.404 -7.005 1143 H ILE 165 H ILE 165 4.929 3.380 -4.607 1144 HA ILE 165 HA ILE 165 5.173 5.857 -3.289 1145 HB ILE 165 HB ILE 165 4.553 3.908 -2.040 1146 1HG1 ILE 165 2HG1 ILE 165 6.051 4.114 -0.092 1147 2HG1 ILE 165 1HG1 ILE 165 7.247 4.908 -1.109 1148 1HG2 ILE 165 1HG2 ILE 165 6.141 2.101 -1.463 1149 2HG2 ILE 165 2HG2 ILE 165 7.300 2.798 -2.597 1150 3HG2 ILE 165 3HG2 ILE 165 5.763 2.166 -3.188 1151 1HD1 ILE 165 1HD1 ILE 165 4.490 5.948 -0.508 1152 2HD1 ILE 165 2HD1 ILE 165 5.723 6.708 -1.524 1153 3HD1 ILE 165 3HD1 ILE 165 6.009 6.523 0.211 1154 H ASP 166 H ASP 166 7.470 3.633 -4.604 1155 HA ASP 166 HA ASP 166 9.885 4.881 -3.896 1156 1HB ASP 166 2HB ASP 166 9.871 2.686 -4.876 1157 2HB ASP 166 1HB ASP 166 9.168 3.302 -6.362 1158 H GLU 167 H GLU 167 8.003 5.296 -6.905 1159 HA GLU 167 HA GLU 167 9.617 7.388 -7.853 1160 1HB GLU 167 2HB GLU 167 6.789 6.641 -8.605 1161 2HB GLU 167 1HB GLU 167 7.722 7.875 -9.432 1162 1HG GLU 167 2HG GLU 167 9.412 6.152 -10.008 1163 2HG GLU 167 1HG GLU 167 8.377 4.936 -9.262 1164 H HIS 168 H HIS 168 6.922 7.348 -5.695 1165 HA HIS 168 HA HIS 168 6.344 10.142 -5.718 1166 1HB HIS 168 2HB HIS 168 4.781 8.473 -4.752 1167 2HB HIS 168 1HB HIS 168 5.954 8.098 -3.507 1168 HD1 HIS 168 1HD HIS 168 3.147 10.318 -4.285 1169 HD2 HIS 168 2HD HIS 168 6.294 10.276 -1.572 1170 HE1 HIS 168 1HE HIS 168 2.499 11.908 -2.478 1171 HE2 HIS 168 2HE HIS 168 4.609 12.160 -1.146 1172 H LEU 169 H LEU 169 8.643 8.143 -3.968 1173 HA LEU 169 HA LEU 169 9.422 10.214 -2.161 1174 1HB LEU 169 2HB LEU 169 10.799 7.621 -2.834 1175 2HB LEU 169 1HB LEU 169 11.191 8.662 -1.481 1176 HG LEU 169 HG LEU 169 8.624 7.122 -1.855 1177 1HD1 LEU 169 1HD1 LEU 169 10.890 6.730 0.085 1178 2HD1 LEU 169 2HD1 LEU 169 10.522 5.718 -1.311 1179 3HD1 LEU 169 3HD1 LEU 169 9.389 5.799 0.034 1180 1HD2 LEU 169 1HD2 LEU 169 8.115 7.852 0.449 1181 2HD2 LEU 169 2HD2 LEU 169 8.182 9.188 -0.694 1182 3HD2 LEU 169 3HD2 LEU 169 9.538 8.896 0.399 1183 H LEU 170 H LEU 170 10.531 9.049 -5.240 1184 HA LEU 170 HA LEU 170 12.942 10.643 -5.198 1185 1HB LEU 170 2HB LEU 170 11.625 9.157 -7.462 1186 2HB LEU 170 1HB LEU 170 13.227 9.872 -7.504 1187 HG LEU 170 HG LEU 170 12.350 7.560 -5.783 1188 1HD1 LEU 170 1HD1 LEU 170 12.586 6.987 -8.102 1189 2HD1 LEU 170 2HD1 LEU 170 13.891 6.266 -7.155 1190 3HD1 LEU 170 3HD1 LEU 170 14.199 7.701 -8.142 1191 1HD2 LEU 170 1HD2 LEU 170 14.724 7.414 -5.128 1192 2HD2 LEU 170 2HD2 LEU 170 13.990 8.917 -4.590 1193 3HD2 LEU 170 3HD2 LEU 170 15.050 8.908 -6.001 1194 H ALA 171 H ALA 171 9.716 11.040 -6.006 1195 HA ALA 171 HA ALA 171 9.998 13.241 -7.819 1196 1HB ALA 171 1HB ALA 171 7.555 13.398 -7.598 1197 2HB ALA 171 2HB ALA 171 7.620 12.229 -6.274 1198 3HB ALA 171 3HB ALA 171 8.069 11.735 -7.901 1199 H GLU 172 H GLU 172 8.055 14.896 -6.788 1200 HA GLU 172 HA GLU 172 9.388 16.099 -4.465 1201 1HB GLU 172 2HB GLU 172 8.832 18.280 -5.473 1202 2HB GLU 172 1HB GLU 172 9.946 17.334 -6.457 1203 1HG GLU 172 2HG GLU 172 8.107 16.666 -7.908 1204 2HG GLU 172 1HG GLU 172 6.986 17.595 -6.918 1205 H GLU 173 H GLU 173 7.807 17.928 -3.648 1206 HA GLU 173 HA GLU 173 5.341 16.612 -3.047 1207 1HB GLU 173 2HB GLU 173 4.996 18.576 -1.497 1208 2HB GLU 173 1HB GLU 173 6.402 17.588 -1.161 1209 1HG GLU 173 2HG GLU 173 7.838 19.256 -2.203 1210 2HG GLU 173 1HG GLU 173 6.433 20.245 -2.592 Start of MODEL 20 1 H THR 17 H THR 17 -1.025 -31.720 1.889 2 HA THR 17 HA THR 17 -2.214 -30.858 4.434 3 HB THR 17 HB THR 17 0.031 -31.560 5.387 4 HG1 THR 17 1HG THR 17 1.418 -31.978 3.860 5 1HG2 THR 17 1HG2 THR 17 -1.697 -33.729 4.169 6 2HG2 THR 17 2HG2 THR 17 -1.963 -32.940 5.730 7 3HG2 THR 17 3HG2 THR 17 -0.548 -33.957 5.486 8 H GLU 18 H GLU 18 -1.294 -29.560 1.792 9 HA GLU 18 HA GLU 18 0.870 -27.863 2.828 10 1HB GLU 18 2HB GLU 18 1.407 -27.399 0.484 11 2HB GLU 18 1HB GLU 18 1.473 -29.118 0.855 12 1HG GLU 18 2HG GLU 18 -0.768 -29.386 -0.124 13 2HG GLU 18 1HG GLU 18 -0.765 -27.678 -0.553 14 H ALA 19 H ALA 19 -2.269 -27.863 2.003 15 HA ALA 19 HA ALA 19 -2.475 -24.956 2.290 16 1HB ALA 19 1HB ALA 19 -3.836 -26.489 0.085 17 2HB ALA 19 2HB ALA 19 -2.471 -25.383 -0.128 18 3HB ALA 19 3HB ALA 19 -4.038 -24.778 0.418 19 H SER 20 H SER 20 -3.057 -27.446 3.792 20 HA SER 20 HA SER 20 -5.897 -27.721 3.922 21 1HB SER 20 2HB SER 20 -4.386 -29.593 4.515 22 2HB SER 20 1HB SER 20 -3.776 -28.655 5.878 23 HG SER 20 HG SER 20 -6.523 -29.069 5.633 24 H SER 21 H SER 21 -3.492 -25.756 5.446 25 HA SER 21 HA SER 21 -5.206 -24.883 7.554 26 1HB SER 21 2HB SER 21 -2.583 -23.759 6.564 27 2HB SER 21 1HB SER 21 -3.389 -23.354 8.083 28 HG SER 21 HG SER 21 -1.666 -25.192 7.789 29 H LEU 22 H LEU 22 -4.736 -24.013 4.242 30 HA LEU 22 HA LEU 22 -5.345 -22.337 2.912 31 1HB LEU 22 2HB LEU 22 -7.503 -22.125 4.983 32 2HB LEU 22 1HB LEU 22 -7.554 -21.282 3.447 33 HG LEU 22 HG LEU 22 -7.414 -24.285 3.719 34 1HD1 LEU 22 1HD1 LEU 22 -9.740 -24.243 3.078 35 2HD1 LEU 22 2HD1 LEU 22 -9.730 -22.466 3.197 36 3HD1 LEU 22 3HD1 LEU 22 -9.416 -23.471 4.630 37 1HD2 LEU 22 1HD2 LEU 22 -8.055 -24.255 1.351 38 2HD2 LEU 22 2HD2 LEU 22 -6.507 -23.448 1.605 39 3HD2 LEU 22 3HD2 LEU 22 -7.970 -22.497 1.352 40 H VAL 23 H VAL 23 -3.611 -21.719 5.279 41 HA VAL 23 HA VAL 23 -4.086 -18.930 5.777 42 HB VAL 23 HB VAL 23 -1.682 -20.659 6.488 43 1HG1 VAL 23 1HG1 VAL 23 -1.062 -18.280 6.303 44 2HG1 VAL 23 2HG1 VAL 23 -1.040 -18.808 7.988 45 3HG1 VAL 23 3HG1 VAL 23 -2.393 -17.851 7.374 46 1HG2 VAL 23 1HG2 VAL 23 -2.607 -20.553 8.757 47 2HG2 VAL 23 2HG2 VAL 23 -3.754 -21.287 7.617 48 3HG2 VAL 23 3HG2 VAL 23 -3.959 -19.609 8.107 49 H GLY 24 H GLY 24 -3.423 -17.365 4.590 50 1HA GLY 24 2HA GLY 24 -1.645 -18.088 2.393 51 2HA GLY 24 1HA GLY 24 -2.952 -16.908 2.294 52 H LYS 25 H LYS 25 0.157 -17.114 2.206 53 HA LYS 25 HA LYS 25 0.377 -14.381 3.082 54 1HB LYS 25 2HB LYS 25 2.314 -16.518 3.886 55 2HB LYS 25 1HB LYS 25 2.734 -14.828 3.682 56 1HG LYS 25 2HG LYS 25 1.001 -14.309 5.404 57 2HG LYS 25 1HG LYS 25 0.915 -16.049 5.720 58 1HD LYS 25 2HD LYS 25 2.520 -14.924 7.257 59 2HD LYS 25 1HD LYS 25 3.304 -16.121 6.222 60 1HE LYS 25 2HE LYS 25 4.133 -14.328 4.735 61 2HE LYS 25 1HE LYS 25 3.270 -13.129 5.677 62 1HZ LYS 25 1HZ LYS 25 5.525 -14.812 6.668 63 2HZ LYS 25 2HZ LYS 25 4.718 -13.632 7.559 64 3HZ LYS 25 3HZ LYS 25 5.640 -13.185 6.249 65 H LEU 26 H LEU 26 1.860 -13.275 2.077 66 HA LEU 26 HA LEU 26 3.682 -14.628 0.400 67 1HB LEU 26 2HB LEU 26 1.786 -14.170 -1.143 68 2HB LEU 26 1HB LEU 26 1.860 -12.476 -0.737 69 HG LEU 26 HG LEU 26 4.160 -13.895 -2.092 70 1HD1 LEU 26 1HD1 LEU 26 3.301 -12.995 -4.156 71 2HD1 LEU 26 2HD1 LEU 26 1.872 -12.382 -3.301 72 3HD1 LEU 26 3HD1 LEU 26 2.156 -14.128 -3.432 73 1HD2 LEU 26 1HD2 LEU 26 4.641 -11.717 -1.042 74 2HD2 LEU 26 2HD2 LEU 26 3.346 -10.988 -1.986 75 3HD2 LEU 26 3HD2 LEU 26 4.771 -11.640 -2.799 76 H GLU 27 H GLU 27 5.541 -13.735 0.516 77 HA GLU 27 HA GLU 27 5.660 -11.076 1.685 78 1HB GLU 27 2HB GLU 27 5.756 -12.757 3.477 79 2HB GLU 27 1HB GLU 27 7.161 -13.471 2.719 80 1HG GLU 27 2HG GLU 27 8.457 -11.516 3.160 81 2HG GLU 27 1HG GLU 27 7.027 -10.659 3.756 82 H THR 28 H THR 28 7.000 -9.847 0.624 83 HA THR 28 HA THR 28 9.282 -10.993 -0.723 84 HB THR 28 HB THR 28 7.506 -11.097 -2.490 85 HG1 THR 28 1HG THR 28 8.977 -8.868 -3.272 86 1HG2 THR 28 1HG2 THR 28 6.022 -9.328 -1.604 87 2HG2 THR 28 2HG2 THR 28 6.428 -9.043 -3.295 88 3HG2 THR 28 3HG2 THR 28 7.224 -8.110 -2.029 89 H ASP 29 H ASP 29 10.926 -9.477 -0.972 90 HA ASP 29 HA ASP 29 10.371 -6.866 0.216 91 1HB ASP 29 2HB ASP 29 12.763 -6.725 0.787 92 2HB ASP 29 1HB ASP 29 12.049 -8.155 1.500 93 H VAL 30 H VAL 30 10.872 -5.093 -0.887 94 HA VAL 30 HA VAL 30 11.887 -5.505 -3.619 95 HB VAL 30 HB VAL 30 9.596 -3.606 -2.870 96 1HG1 VAL 30 1HG1 VAL 30 10.983 -2.703 -4.639 97 2HG1 VAL 30 2HG1 VAL 30 9.403 -3.189 -5.242 98 3HG1 VAL 30 3HG1 VAL 30 10.812 -4.203 -5.561 99 1HG2 VAL 30 1HG2 VAL 30 9.563 -6.139 -4.505 100 2HG2 VAL 30 2HG2 VAL 30 8.199 -5.046 -4.251 101 3HG2 VAL 30 3HG2 VAL 30 8.875 -5.946 -2.890 102 H GLU 31 H GLU 31 13.213 -3.849 -4.385 103 HA GLU 31 HA GLU 31 14.379 -2.286 -2.211 104 1HB GLU 31 2HB GLU 31 15.420 -2.304 -5.031 105 2HB GLU 31 1HB GLU 31 16.182 -1.992 -3.460 106 1HG GLU 31 2HG GLU 31 16.164 -4.292 -2.881 107 2HG GLU 31 1HG GLU 31 15.228 -4.710 -4.312 108 H ILE 32 H ILE 32 14.405 -0.077 -2.149 109 HA ILE 32 HA ILE 32 13.199 1.209 -4.426 110 HB ILE 32 HB ILE 32 12.318 2.993 -2.916 111 1HG1 ILE 32 2HG1 ILE 32 12.808 0.939 -0.747 112 2HG1 ILE 32 1HG1 ILE 32 13.634 2.482 -0.908 113 1HG2 ILE 32 1HG2 ILE 32 10.843 1.468 -3.939 114 2HG2 ILE 32 2HG2 ILE 32 10.294 1.735 -2.282 115 3HG2 ILE 32 3HG2 ILE 32 11.139 0.241 -2.704 116 1HD1 ILE 32 1HD1 ILE 32 11.940 2.572 0.807 117 2HD1 ILE 32 2HD1 ILE 32 10.698 2.091 -0.349 118 3HD1 ILE 32 3HD1 ILE 32 11.521 3.641 -0.529 119 H LYS 33 H LYS 33 13.835 3.148 -4.961 120 HA LYS 33 HA LYS 33 16.661 3.646 -4.828 121 1HB LYS 33 2HB LYS 33 14.415 5.321 -5.916 122 2HB LYS 33 1HB LYS 33 16.123 5.544 -6.276 123 1HG LYS 33 2HG LYS 33 16.195 3.461 -7.456 124 2HG LYS 33 1HG LYS 33 14.560 3.060 -6.925 125 1HD LYS 33 2HD LYS 33 13.690 4.994 -8.164 126 2HD LYS 33 1HD LYS 33 15.325 5.366 -8.710 127 1HE LYS 33 2HE LYS 33 15.452 3.282 -9.895 128 2HE LYS 33 1HE LYS 33 13.891 2.773 -9.258 129 1HZ LYS 33 1HZ LYS 33 13.773 3.615 -11.527 130 2HZ LYS 33 2HZ LYS 33 14.332 5.119 -11.020 131 3HZ LYS 33 3HZ LYS 33 12.838 4.557 -10.480 132 H ALA 34 H ALA 34 14.208 4.431 -2.751 133 HA ALA 34 HA ALA 34 15.369 7.001 -1.959 134 1HB ALA 34 1HB ALA 34 12.680 5.836 -1.298 135 2HB ALA 34 2HB ALA 34 13.008 7.050 -2.538 136 3HB ALA 34 3HB ALA 34 13.268 7.432 -0.836 137 H SER 35 H SER 35 15.373 7.452 0.364 138 HA SER 35 HA SER 35 16.268 5.133 1.868 139 1HB SER 35 2HB SER 35 16.469 8.088 2.480 140 2HB SER 35 1HB SER 35 17.268 6.786 3.362 141 HG SER 35 HG SER 35 17.653 7.035 0.586 142 H ALA 36 H ALA 36 15.430 4.706 3.938 143 HA ALA 36 HA ALA 36 12.649 4.857 4.222 144 1HB ALA 36 1HB ALA 36 14.053 3.088 5.185 145 2HB ALA 36 2HB ALA 36 13.011 3.836 6.407 146 3HB ALA 36 3HB ALA 36 14.723 4.257 6.320 147 H ASP 37 H ASP 37 15.186 6.913 5.309 148 HA ASP 37 HA ASP 37 14.090 8.358 7.381 149 1HB ASP 37 2HB ASP 37 15.873 9.300 5.140 150 2HB ASP 37 1HB ASP 37 15.494 10.262 6.557 151 H LYS 38 H LYS 38 13.685 8.831 3.913 152 HA LYS 38 HA LYS 38 12.337 11.267 4.259 153 1HB LYS 38 2HB LYS 38 12.462 9.520 1.827 154 2HB LYS 38 1HB LYS 38 11.730 11.127 1.864 155 1HG LYS 38 2HG LYS 38 13.902 12.028 2.671 156 2HG LYS 38 1HG LYS 38 14.598 10.432 2.429 157 1HD LYS 38 2HD LYS 38 15.119 11.818 0.566 158 2HD LYS 38 1HD LYS 38 13.960 10.562 0.080 159 1HE LYS 38 2HE LYS 38 12.147 12.146 0.106 160 2HE LYS 38 1HE LYS 38 13.186 13.403 0.785 161 1HZ LYS 38 1HZ LYS 38 13.561 12.183 -1.914 162 2HZ LYS 38 2HZ LYS 38 14.434 13.428 -1.232 163 3HZ LYS 38 3HZ LYS 38 12.823 13.683 -1.616 164 H PHE 39 H PHE 39 11.209 7.988 3.985 165 HA PHE 39 HA PHE 39 8.437 8.555 3.669 166 1HB PHE 39 2HB PHE 39 9.556 6.276 3.395 167 2HB PHE 39 1HB PHE 39 9.669 6.207 5.144 168 HD1 PHE 39 1HD PHE 39 7.748 5.305 2.340 169 HD2 PHE 39 2HD PHE 39 7.338 6.477 6.417 170 HE1 PHE 39 1HE PHE 39 5.512 4.292 2.407 171 HE2 PHE 39 2HE PHE 39 5.100 5.464 6.479 172 HZ PHE 39 HZ PHE 39 4.185 4.370 4.476 173 H HIS 40 H HIS 40 10.558 8.060 6.405 174 HA HIS 40 HA HIS 40 8.721 8.236 8.500 175 1HB HIS 40 2HB HIS 40 11.027 7.427 8.796 176 2HB HIS 40 1HB HIS 40 11.648 9.033 8.459 177 HD1 HIS 40 1HD HIS 40 12.376 10.181 10.562 178 HD2 HIS 40 2HD HIS 40 9.168 7.617 11.223 179 HE1 HIS 40 1HE HIS 40 11.925 10.275 13.017 180 HE2 HIS 40 2HE HIS 40 9.987 8.718 13.400 181 H HIS 41 H HIS 41 10.469 10.771 6.772 182 HA HIS 41 HA HIS 41 9.440 12.853 8.476 183 1HB HIS 41 2HB HIS 41 10.848 13.014 5.825 184 2HB HIS 41 1HB HIS 41 10.250 14.414 6.691 185 HD1 HIS 41 1HD HIS 41 11.795 15.427 8.371 186 HD2 HIS 41 2HD HIS 41 13.004 11.637 7.211 187 HE1 HIS 41 1HE HIS 41 14.079 15.142 9.314 188 HE2 HIS 41 2HE HIS 41 14.887 13.031 8.217 189 H MET 42 H MET 42 8.702 11.844 5.103 190 HA MET 42 HA MET 42 6.868 14.003 4.880 191 1HB MET 42 2HB MET 42 6.401 13.297 2.596 192 2HB MET 42 1HB MET 42 8.113 13.326 2.912 193 1HG MET 42 2HG MET 42 7.656 11.435 1.542 194 2HG MET 42 1HG MET 42 8.048 10.836 3.147 195 1HE MET 42 1HE MET 42 4.596 12.456 2.071 196 2HE MET 42 2HE MET 42 3.745 11.041 1.465 197 3HE MET 42 3HE MET 42 5.158 11.644 0.604 198 H PHE 43 H PHE 43 6.436 10.770 5.912 199 HA PHE 43 HA PHE 43 3.657 10.656 5.363 200 1HB PHE 43 2HB PHE 43 4.988 8.622 5.858 201 2HB PHE 43 1HB PHE 43 5.227 9.188 7.507 202 HD1 PHE 43 1HD PHE 43 3.549 8.870 9.167 203 HD2 PHE 43 2HD PHE 43 2.723 7.988 5.087 204 HE1 PHE 43 1HE PHE 43 1.453 7.766 9.831 205 HE2 PHE 43 2HE PHE 43 0.630 6.880 5.744 206 HZ PHE 43 HZ PHE 43 -0.010 6.771 8.114 207 H ALA 44 H ALA 44 5.565 12.027 7.900 208 HA ALA 44 HA ALA 44 3.323 12.497 9.647 209 1HB ALA 44 1HB ALA 44 5.562 12.119 10.577 210 2HB ALA 44 2HB ALA 44 4.939 13.702 11.041 211 3HB ALA 44 3HB ALA 44 6.144 13.571 9.760 212 H GLY 45 H GLY 45 5.192 14.236 7.257 213 1HA GLY 45 2HA GLY 45 3.232 15.948 6.468 214 2HA GLY 45 1HA GLY 45 4.072 16.783 7.774 215 H LYS 46 H LYS 46 4.224 17.973 5.449 216 HA LYS 46 HA LYS 46 6.437 17.090 3.862 217 1HB LYS 46 2HB LYS 46 4.889 19.693 3.871 218 2HB LYS 46 1HB LYS 46 6.256 19.413 2.820 219 1HG LYS 46 2HG LYS 46 4.178 19.118 1.615 220 2HG LYS 46 1HG LYS 46 5.024 17.583 1.731 221 1HD LYS 46 2HD LYS 46 3.516 16.853 3.480 222 2HD LYS 46 1HD LYS 46 2.740 18.437 3.514 223 1HE LYS 46 2HE LYS 46 2.789 16.566 1.146 224 2HE LYS 46 1HE LYS 46 1.425 16.764 2.238 225 1HZ LYS 46 1HZ LYS 46 2.571 18.876 0.470 226 2HZ LYS 46 2HZ LYS 46 1.364 19.111 1.605 227 3HZ LYS 46 3HZ LYS 46 1.061 18.131 0.291 228 HA PRO 47 HA PRO 47 9.466 18.944 6.622 229 1HB PRO 47 2HB PRO 47 11.365 18.373 4.447 230 2HB PRO 47 1HB PRO 47 11.371 17.760 6.098 231 1HG PRO 47 2HG PRO 47 10.776 16.178 4.008 232 2HG PRO 47 1HG PRO 47 10.001 15.987 5.589 233 1HD PRO 47 2HD PRO 47 8.932 17.253 3.106 234 2HD PRO 47 1HD PRO 47 8.125 16.208 4.296 235 H HIS 48 H HIS 48 10.161 19.365 3.162 236 HA HIS 48 HA HIS 48 9.554 22.085 3.061 237 1HB HIS 48 2HB HIS 48 11.861 22.971 2.733 238 2HB HIS 48 1HB HIS 48 11.596 22.405 4.370 239 HD1 HIS 48 1HD HIS 48 13.202 20.612 5.245 240 HD2 HIS 48 2HD HIS 48 13.634 21.323 1.169 241 HE1 HIS 48 1HE HIS 48 15.267 19.393 4.563 242 HE2 HIS 48 2HE HIS 48 15.599 19.962 2.148 243 H HIS 49 H HIS 49 10.758 22.933 0.899 244 HA HIS 49 HA HIS 49 10.954 20.727 -0.971 245 1HB HIS 49 2HB HIS 49 9.028 23.023 -1.216 246 2HB HIS 49 1HB HIS 49 9.622 22.189 -2.641 247 HD1 HIS 49 1HD HIS 49 7.063 21.967 -0.017 248 HD2 HIS 49 2HD HIS 49 8.930 19.387 -2.681 249 HE1 HIS 49 1HE HIS 49 5.605 19.937 -0.119 250 HE2 HIS 49 2HE HIS 49 6.631 18.502 -1.902 251 H VAL 50 H VAL 50 12.230 21.031 -2.664 252 HA VAL 50 HA VAL 50 13.902 23.435 -2.544 253 HB VAL 50 HB VAL 50 15.733 22.008 -3.512 254 1HG1 VAL 50 1HG1 VAL 50 16.251 20.825 -1.413 255 2HG1 VAL 50 2HG1 VAL 50 14.589 21.072 -0.881 256 3HG1 VAL 50 3HG1 VAL 50 15.656 22.457 -1.111 257 1HG2 VAL 50 1HG2 VAL 50 13.819 19.740 -2.906 258 2HG2 VAL 50 2HG2 VAL 50 15.513 19.552 -3.372 259 3HG2 VAL 50 3HG2 VAL 50 14.351 20.246 -4.503 260 H SER 51 H SER 51 14.149 24.614 -4.371 261 HA SER 51 HA SER 51 12.632 23.588 -6.613 262 1HB SER 51 2HB SER 51 11.668 25.602 -5.628 263 2HB SER 51 1HB SER 51 13.184 26.465 -5.853 264 HG SER 51 HG SER 51 11.205 25.798 -7.690 265 H LYS 52 H LYS 52 14.153 22.466 -7.668 266 HA LYS 52 HA LYS 52 16.014 24.124 -9.185 267 1HB LYS 52 2HB LYS 52 16.508 21.275 -8.282 268 2HB LYS 52 1HB LYS 52 17.512 22.179 -9.404 269 1HG LYS 52 2HG LYS 52 17.976 23.814 -7.616 270 2HG LYS 52 1HG LYS 52 17.051 22.812 -6.498 271 1HD LYS 52 2HD LYS 52 19.392 22.336 -6.234 272 2HD LYS 52 1HD LYS 52 18.587 20.949 -6.978 273 1HE LYS 52 2HE LYS 52 19.382 21.662 -9.182 274 2HE LYS 52 1HE LYS 52 20.157 23.055 -8.457 275 1HZ LYS 52 1HZ LYS 52 20.855 20.213 -7.930 276 2HZ LYS 52 2HZ LYS 52 21.571 21.508 -7.158 277 3HZ LYS 52 3HZ LYS 52 21.764 21.307 -8.821 278 H ALA 53 H ALA 53 15.644 23.991 -11.294 279 HA ALA 53 HA ALA 53 14.472 23.592 -13.215 280 1HB ALA 53 1HB ALA 53 14.576 20.710 -12.234 281 2HB ALA 53 2HB ALA 53 15.813 21.498 -13.212 282 3HB ALA 53 3HB ALA 53 14.212 21.215 -13.886 283 H SER 54 H SER 54 12.289 21.737 -13.704 284 HA SER 54 HA SER 54 10.366 22.864 -11.833 285 1HB SER 54 2HB SER 54 9.968 23.101 -14.314 286 2HB SER 54 1HB SER 54 9.852 21.348 -14.413 287 HG SER 54 HG SER 54 8.263 22.921 -12.703 288 HA PRO 55 HA PRO 55 10.724 18.699 -10.038 289 1HB PRO 55 2HB PRO 55 9.203 19.795 -7.794 290 2HB PRO 55 1HB PRO 55 10.856 19.179 -7.813 291 1HG PRO 55 2HG PRO 55 10.295 21.815 -7.496 292 2HG PRO 55 1HG PRO 55 11.765 21.242 -8.299 293 1HD PRO 55 2HD PRO 55 9.216 22.250 -9.503 294 2HD PRO 55 1HD PRO 55 10.904 22.590 -9.956 295 H GLY 56 H GLY 56 9.381 17.083 -10.326 296 1HA GLY 56 2HA GLY 56 6.793 17.403 -11.371 297 2HA GLY 56 1HA GLY 56 7.539 15.899 -10.856 298 H ASN 57 H ASN 57 4.938 17.649 -10.417 299 HA ASN 57 HA ASN 57 4.711 17.321 -7.540 300 1HB ASN 57 2HB ASN 57 2.783 18.505 -9.555 301 2HB ASN 57 1HB ASN 57 2.465 18.392 -7.831 302 1HD2 ASN 57 1HD2 ASN 57 3.582 19.748 -6.420 303 2HD2 ASN 57 2HD2 ASN 57 4.448 21.127 -6.983 304 H ILE 58 H ILE 58 4.413 15.280 -7.013 305 HA ILE 58 HA ILE 58 2.840 13.588 -8.679 306 HB ILE 58 HB ILE 58 3.537 11.817 -7.087 307 1HG1 ILE 58 2HG1 ILE 58 5.205 14.030 -5.856 308 2HG1 ILE 58 1HG1 ILE 58 3.809 13.267 -5.109 309 1HG2 ILE 58 1HG2 ILE 58 5.876 11.775 -7.828 310 2HG2 ILE 58 2HG2 ILE 58 5.741 13.471 -8.306 311 3HG2 ILE 58 3HG2 ILE 58 4.763 12.250 -9.116 312 1HD1 ILE 58 1HD1 ILE 58 5.892 12.395 -4.216 313 2HD1 ILE 58 2HD1 ILE 58 6.384 11.892 -5.838 314 3HD1 ILE 58 3HD1 ILE 58 4.977 11.153 -5.074 315 H GLN 59 H GLN 59 1.549 12.022 -7.365 316 HA GLN 59 HA GLN 59 -0.406 13.634 -5.849 317 1HB GLN 59 2HB GLN 59 -0.922 11.107 -7.418 318 2HB GLN 59 1HB GLN 59 -2.109 12.195 -6.714 319 1HG GLN 59 2HG GLN 59 -0.238 12.873 -8.966 320 2HG GLN 59 1HG GLN 59 -1.941 12.463 -9.150 321 1HE2 GLN 59 1HE2 GLN 59 -0.511 14.846 -9.918 322 2HE2 GLN 59 2HE2 GLN 59 -1.260 16.176 -9.131 323 H GLY 60 H GLY 60 -1.387 12.650 -4.012 324 1HA GLY 60 2HA GLY 60 -1.793 10.770 -2.599 325 2HA GLY 60 1HA GLY 60 -0.324 10.035 -3.216 326 H CYS 61 H CYS 61 0.593 13.073 -2.730 327 HA CYS 61 HA CYS 61 1.605 12.453 -0.067 328 1HB CYS 61 2HB CYS 61 2.345 14.703 -1.955 329 2HB CYS 61 1HB CYS 61 3.132 14.351 -0.422 330 HG CYS 61 HG CYS 61 3.701 13.096 -3.393 331 H ASP 62 H ASP 62 -0.681 14.369 -1.676 332 HA ASP 62 HA ASP 62 -1.156 15.976 0.721 333 1HB ASP 62 2HB ASP 62 -2.321 16.266 -2.067 334 2HB ASP 62 1HB ASP 62 -2.656 17.334 -0.711 335 H LEU 63 H LEU 63 -3.288 15.992 1.600 336 HA LEU 63 HA LEU 63 -4.434 13.344 1.314 337 1HB LEU 63 2HB LEU 63 -4.875 15.420 3.455 338 2HB LEU 63 1HB LEU 63 -5.681 13.868 3.409 339 HG LEU 63 HG LEU 63 -3.965 13.684 5.008 340 1HD1 LEU 63 1HD1 LEU 63 -4.173 11.739 3.619 341 2HD1 LEU 63 2HD1 LEU 63 -2.505 11.948 4.154 342 3HD1 LEU 63 3HD1 LEU 63 -2.958 12.375 2.511 343 1HD2 LEU 63 1HD2 LEU 63 -1.586 14.175 4.569 344 2HD2 LEU 63 2HD2 LEU 63 -2.599 15.614 4.425 345 3HD2 LEU 63 3HD2 LEU 63 -2.023 14.790 2.975 346 H HIS 64 H HIS 64 -6.052 12.985 0.103 347 HA HIS 64 HA HIS 64 -7.859 15.029 -0.825 348 1HB HIS 64 2HB HIS 64 -7.260 13.150 -2.289 349 2HB HIS 64 1HB HIS 64 -7.916 12.009 -1.124 350 HD1 HIS 64 1HD HIS 64 -10.415 11.360 -1.447 351 HD2 HIS 64 2HD HIS 64 -9.304 14.782 -3.579 352 HE1 HIS 64 1HE HIS 64 -12.342 11.913 -2.873 353 HE2 HIS 64 2HE HIS 64 -11.778 14.099 -3.939 354 H GLU 65 H GLU 65 -7.794 12.622 1.705 355 HA GLU 65 HA GLU 65 -10.107 13.622 2.963 356 1HB GLU 65 2HB GLU 65 -11.467 11.576 2.714 357 2HB GLU 65 1HB GLU 65 -11.193 12.359 1.168 358 1HG GLU 65 2HG GLU 65 -9.297 10.707 0.845 359 2HG GLU 65 1HG GLU 65 -9.957 9.849 2.238 360 H GLY 66 H GLY 66 -10.519 12.286 4.947 361 1HA GLY 66 2HA GLY 66 -9.225 10.219 5.962 362 2HA GLY 66 1HA GLY 66 -7.986 11.467 6.040 363 H ASP 67 H ASP 67 -7.871 12.470 7.876 364 HA ASP 67 HA ASP 67 -8.344 13.510 9.828 365 1HB ASP 67 2HB ASP 67 -9.907 14.870 8.453 366 2HB ASP 67 1HB ASP 67 -11.183 13.699 8.736 367 H TRP 68 H TRP 68 -8.878 10.549 9.339 368 HA TRP 68 HA TRP 68 -10.745 9.832 11.451 369 1HB TRP 68 2HB TRP 68 -8.936 8.120 9.733 370 2HB TRP 68 1HB TRP 68 -10.037 7.492 10.939 371 HD1 TRP 68 HD TRP 68 -9.958 9.008 7.448 372 HE1 TRP 68 1HE TRP 68 -12.222 8.569 6.305 373 HE3 TRP 68 3HE TRP 68 -12.517 7.124 11.441 374 HZ2 TRP 68 2HZ TRP 68 -14.751 7.553 7.003 375 HZ3 TRP 68 3HZ TRP 68 -14.860 6.436 11.119 376 HH2 TRP 68 HH TRP 68 -15.949 6.648 8.946 377 H GLY 69 H GLY 69 -7.666 10.963 11.537 378 1HA GLY 69 2HA GLY 69 -6.322 10.956 13.502 379 2HA GLY 69 1HA GLY 69 -7.117 9.460 13.994 380 H THR 70 H THR 70 -6.323 9.577 10.748 381 HA THR 70 HA THR 70 -4.856 8.603 9.413 382 HB THR 70 HB THR 70 -3.027 8.366 11.829 383 HG1 THR 70 1HG THR 70 -3.862 10.497 10.819 384 1HG2 THR 70 1HG2 THR 70 -1.230 8.146 10.157 385 2HG2 THR 70 2HG2 THR 70 -2.420 8.228 8.861 386 3HG2 THR 70 3HG2 THR 70 -2.418 6.853 9.963 387 H VAL 71 H VAL 71 -4.693 6.824 12.514 388 HA VAL 71 HA VAL 71 -4.780 4.302 11.161 389 HB VAL 71 HB VAL 71 -5.474 4.870 14.060 390 1HG1 VAL 71 1HG1 VAL 71 -4.589 2.339 12.686 391 2HG1 VAL 71 2HG1 VAL 71 -6.216 2.710 13.239 392 3HG1 VAL 71 3HG1 VAL 71 -4.909 2.513 14.419 393 1HG2 VAL 71 1HG2 VAL 71 -3.161 4.279 14.595 394 2HG2 VAL 71 2HG2 VAL 71 -3.225 5.697 13.542 395 3HG2 VAL 71 3HG2 VAL 71 -2.805 4.120 12.874 396 H GLY 72 H GLY 72 -6.565 3.404 10.268 397 1HA GLY 72 2HA GLY 72 -8.804 2.701 10.400 398 2HA GLY 72 1HA GLY 72 -9.148 4.094 11.420 399 H SER 73 H SER 73 -7.213 5.220 9.044 400 HA SER 73 HA SER 73 -9.259 6.710 7.776 401 1HB SER 73 2HB SER 73 -6.865 7.428 8.131 402 2HB SER 73 1HB SER 73 -6.416 6.287 6.877 403 HG SER 73 HG SER 73 -7.041 7.626 5.420 404 H ILE 74 H ILE 74 -10.000 6.586 5.625 405 HA ILE 74 HA ILE 74 -9.387 4.128 4.168 406 HB ILE 74 HB ILE 74 -12.139 5.286 4.668 407 1HG1 ILE 74 2HG1 ILE 74 -10.934 2.604 5.269 408 2HG1 ILE 74 1HG1 ILE 74 -11.096 3.920 6.424 409 1HG2 ILE 74 1HG2 ILE 74 -13.002 3.480 3.246 410 2HG2 ILE 74 2HG2 ILE 74 -11.353 2.973 2.879 411 3HG2 ILE 74 3HG2 ILE 74 -11.934 4.540 2.323 412 1HD1 ILE 74 1HD1 ILE 74 -13.305 2.463 5.006 413 2HD1 ILE 74 2HD1 ILE 74 -13.537 3.780 6.161 414 3HD1 ILE 74 3HD1 ILE 74 -12.836 2.241 6.702 415 H VAL 75 H VAL 75 -8.690 4.604 2.201 416 HA VAL 75 HA VAL 75 -9.909 6.825 0.723 417 HB VAL 75 HB VAL 75 -7.720 7.646 1.691 418 1HG1 VAL 75 1HG1 VAL 75 -6.453 5.594 1.648 419 2HG1 VAL 75 2HG1 VAL 75 -5.609 6.871 0.775 420 3HG1 VAL 75 3HG1 VAL 75 -6.461 5.609 -0.114 421 1HG2 VAL 75 1HG2 VAL 75 -7.814 7.490 -1.324 422 2HG2 VAL 75 2HG2 VAL 75 -6.840 8.627 -0.393 423 3HG2 VAL 75 3HG2 VAL 75 -8.601 8.702 -0.311 424 H PHE 76 H PHE 76 -9.809 6.517 -1.619 425 HA PHE 76 HA PHE 76 -9.216 3.720 -2.273 426 1HB PHE 76 2HB PHE 76 -11.337 5.488 -3.521 427 2HB PHE 76 1HB PHE 76 -10.994 3.824 -3.979 428 HD1 PHE 76 1HD PHE 76 -10.552 2.721 -1.248 429 HD2 PHE 76 2HD PHE 76 -13.581 5.269 -2.754 430 HE1 PHE 76 1HE PHE 76 -12.019 1.903 0.468 431 HE2 PHE 76 2HE PHE 76 -15.123 4.466 -0.997 432 HZ PHE 76 HZ PHE 76 -14.360 2.774 0.623 433 H TRP 77 H TRP 77 -8.055 3.231 -4.008 434 HA TRP 77 HA TRP 77 -6.692 5.547 -5.237 435 1HB TRP 77 2HB TRP 77 -5.700 2.699 -5.162 436 2HB TRP 77 1HB TRP 77 -4.807 4.126 -5.648 437 HD1 TRP 77 HD TRP 77 -5.263 6.004 -3.193 438 HE1 TRP 77 1HE TRP 77 -4.261 5.408 -0.898 439 HE3 TRP 77 3HE TRP 77 -4.604 0.988 -3.882 440 HZ2 TRP 77 2HZ TRP 77 -3.296 3.091 0.431 441 HZ3 TRP 77 3HZ TRP 77 -3.629 -0.337 -2.063 442 HH2 TRP 77 HH TRP 77 -2.990 0.696 0.042 443 H ASN 78 H ASN 78 -6.790 5.833 -7.361 444 HA ASN 78 HA ASN 78 -7.903 3.677 -9.020 445 1HB ASN 78 2HB ASN 78 -7.794 6.668 -9.569 446 2HB ASN 78 1HB ASN 78 -8.305 5.473 -10.749 447 1HD2 ASN 78 1HD2 ASN 78 -10.320 6.342 -10.967 448 2HD2 ASN 78 2HD2 ASN 78 -11.542 6.257 -9.748 449 H TYR 79 H TYR 79 -6.690 2.869 -10.643 450 HA TYR 79 HA TYR 79 -4.297 4.155 -11.590 451 1HB TYR 79 2HB TYR 79 -2.773 2.326 -10.869 452 2HB TYR 79 1HB TYR 79 -3.435 3.188 -9.489 453 HD1 TYR 79 1HD TYR 79 -3.137 -0.009 -11.155 454 HD2 TYR 79 2HD TYR 79 -5.272 2.097 -8.140 455 HE1 TYR 79 1HE TYR 79 -3.916 -2.147 -10.210 456 HE2 TYR 79 2HE TYR 79 -6.054 -0.022 -7.203 457 HH TYR 79 HH TYR 79 -4.730 -3.033 -8.154 458 H VAL 80 H VAL 80 -3.264 2.685 -13.309 459 HA VAL 80 HA VAL 80 -5.428 1.132 -14.525 460 HB VAL 80 HB VAL 80 -3.016 2.379 -15.895 461 1HG1 VAL 80 1HG1 VAL 80 -4.163 1.805 -17.996 462 2HG1 VAL 80 2HG1 VAL 80 -5.443 1.017 -17.085 463 3HG1 VAL 80 3HG1 VAL 80 -3.813 0.362 -17.049 464 1HG2 VAL 80 1HG2 VAL 80 -4.630 3.962 -16.864 465 2HG2 VAL 80 2HG2 VAL 80 -4.585 4.075 -15.102 466 3HG2 VAL 80 3HG2 VAL 80 -5.911 3.230 -15.895 467 H HIS 81 H HIS 81 -5.241 -0.905 -14.590 468 HA HIS 81 HA HIS 81 -2.623 -2.237 -14.572 469 1HB HIS 81 2HB HIS 81 -3.406 -2.096 -12.243 470 2HB HIS 81 1HB HIS 81 -4.955 -2.767 -12.705 471 HD1 HIS 81 1HD HIS 81 -1.513 -3.707 -11.616 472 HD2 HIS 81 2HD HIS 81 -4.874 -5.593 -13.190 473 HE1 HIS 81 1HE HIS 81 -1.202 -6.117 -11.154 474 HE2 HIS 81 2HE HIS 81 -3.009 -7.216 -12.477 475 H ASP 82 H ASP 82 -2.620 -3.591 -16.273 476 HA ASP 82 HA ASP 82 -3.254 -4.900 -17.979 477 1HB ASP 82 2HB ASP 82 -5.464 -5.612 -16.058 478 2HB ASP 82 1HB ASP 82 -5.420 -6.299 -17.679 479 H GLY 83 H GLY 83 -3.991 -2.177 -17.926 480 1HA GLY 83 2HA GLY 83 -4.817 -0.876 -19.638 481 2HA GLY 83 1HA GLY 83 -5.687 -2.267 -20.247 482 H GLU 84 H GLU 84 -6.510 -2.074 -17.037 483 HA GLU 84 HA GLU 84 -8.760 -0.322 -17.706 484 1HB GLU 84 2HB GLU 84 -9.331 -2.770 -17.400 485 2HB GLU 84 1HB GLU 84 -8.781 -2.610 -15.733 486 1HG GLU 84 2HG GLU 84 -10.446 -1.026 -15.250 487 2HG GLU 84 1HG GLU 84 -10.986 -0.996 -16.936 488 H ALA 85 H ALA 85 -9.396 1.111 -16.160 489 HA ALA 85 HA ALA 85 -7.474 1.747 -14.119 490 1HB ALA 85 1HB ALA 85 -10.198 2.937 -14.708 491 2HB ALA 85 2HB ALA 85 -8.655 3.568 -15.285 492 3HB ALA 85 3HB ALA 85 -9.029 3.586 -13.560 493 H LYS 86 H LYS 86 -7.483 0.746 -12.298 494 HA LYS 86 HA LYS 86 -9.872 -0.776 -11.510 495 1HB LYS 86 2HB LYS 86 -7.087 -1.098 -10.416 496 2HB LYS 86 1HB LYS 86 -8.414 -2.233 -10.332 497 1HG LYS 86 2HG LYS 86 -6.814 -1.516 -12.793 498 2HG LYS 86 1HG LYS 86 -6.715 -2.997 -11.849 499 1HD LYS 86 2HD LYS 86 -9.142 -2.092 -13.414 500 2HD LYS 86 1HD LYS 86 -7.932 -3.252 -13.966 501 1HE LYS 86 2HE LYS 86 -8.481 -4.652 -12.011 502 2HE LYS 86 1HE LYS 86 -9.782 -3.499 -11.633 503 1HZ LYS 86 1HZ LYS 86 -10.766 -4.023 -13.795 504 2HZ LYS 86 2HZ LYS 86 -10.648 -5.414 -12.824 505 3HZ LYS 86 3HZ LYS 86 -9.552 -5.145 -14.085 506 H VAL 87 H VAL 87 -10.405 -0.712 -9.257 507 HA VAL 87 HA VAL 87 -9.395 1.674 -7.901 508 HB VAL 87 HB VAL 87 -12.128 0.372 -7.597 509 1HG1 VAL 87 1HG1 VAL 87 -11.043 2.910 -6.377 510 2HG1 VAL 87 2HG1 VAL 87 -11.373 1.401 -5.526 511 3HG1 VAL 87 3HG1 VAL 87 -12.700 2.325 -6.227 512 1HG2 VAL 87 1HG2 VAL 87 -11.378 2.980 -8.928 513 2HG2 VAL 87 2HG2 VAL 87 -13.022 2.401 -8.667 514 3HG2 VAL 87 3HG2 VAL 87 -11.938 1.520 -9.743 515 H ALA 88 H ALA 88 -8.498 1.345 -6.009 516 HA ALA 88 HA ALA 88 -8.669 -1.333 -4.823 517 1HB ALA 88 1HB ALA 88 -6.407 -0.746 -5.438 518 2HB ALA 88 2HB ALA 88 -6.556 -0.757 -3.686 519 3HB ALA 88 3HB ALA 88 -6.532 0.782 -4.557 520 H LYS 89 H LYS 89 -9.587 -1.522 -2.931 521 HA LYS 89 HA LYS 89 -10.348 0.925 -1.546 522 1HB LYS 89 2HB LYS 89 -11.777 -1.755 -1.661 523 2HB LYS 89 1HB LYS 89 -12.313 -0.333 -0.779 524 1HG LYS 89 2HG LYS 89 -12.705 0.898 -2.743 525 2HG LYS 89 1HG LYS 89 -11.836 -0.267 -3.735 526 1HD LYS 89 2HD LYS 89 -13.586 -1.923 -3.292 527 2HD LYS 89 1HD LYS 89 -14.439 -0.740 -2.296 528 1HE LYS 89 2HE LYS 89 -14.793 0.688 -4.166 529 2HE LYS 89 1HE LYS 89 -13.747 -0.291 -5.187 530 1HZ LYS 89 1HZ LYS 89 -16.289 -1.254 -3.984 531 2HZ LYS 89 2HZ LYS 89 -15.305 -2.059 -5.119 532 3HZ LYS 89 3HZ LYS 89 -16.115 -0.646 -5.559 533 H GLU 90 H GLU 90 -9.751 1.122 0.634 534 HA GLU 90 HA GLU 90 -8.562 -1.146 1.917 535 1HB GLU 90 2HB GLU 90 -6.391 -0.027 2.157 536 2HB GLU 90 1HB GLU 90 -6.767 -0.401 0.487 537 1HG GLU 90 2HG GLU 90 -5.873 1.756 0.314 538 2HG GLU 90 1HG GLU 90 -7.616 2.026 0.380 539 H ARG 91 H ARG 91 -7.816 -0.578 4.018 540 HA ARG 91 HA ARG 91 -8.784 1.935 5.103 541 1HB ARG 91 2HB ARG 91 -10.375 0.154 5.724 542 2HB ARG 91 1HB ARG 91 -9.050 -0.787 6.399 543 1HG ARG 91 2HG ARG 91 -8.650 1.092 8.002 544 2HG ARG 91 1HG ARG 91 -10.127 1.837 7.397 545 1HD ARG 91 2HD ARG 91 -11.381 -0.176 8.031 546 2HD ARG 91 1HD ARG 91 -9.871 -0.875 8.625 547 HE ARG 91 HE ARG 91 -10.979 1.609 9.753 548 1HH1 ARG 91 1HH1 ARG 91 -9.726 -1.671 10.225 549 2HH1 ARG 91 2HH1 ARG 91 -9.717 -1.582 11.920 550 1HH2 ARG 91 1HH2 ARG 91 -10.972 1.729 12.114 551 2HH2 ARG 91 2HH2 ARG 91 -10.460 0.392 13.009 552 H ILE 92 H ILE 92 -7.192 2.743 6.638 553 HA ILE 92 HA ILE 92 -4.700 1.235 6.885 554 HB ILE 92 HB ILE 92 -5.558 3.773 8.351 555 1HG1 ILE 92 2HG1 ILE 92 -3.704 3.406 5.983 556 2HG1 ILE 92 1HG1 ILE 92 -5.306 4.134 5.939 557 1HG2 ILE 92 1HG2 ILE 92 -3.178 4.011 8.968 558 2HG2 ILE 92 2HG2 ILE 92 -2.844 2.445 8.228 559 3HG2 ILE 92 3HG2 ILE 92 -3.892 2.548 9.642 560 1HD1 ILE 92 1HD1 ILE 92 -2.859 5.209 7.330 561 2HD1 ILE 92 2HD1 ILE 92 -4.454 5.963 7.366 562 3HD1 ILE 92 3HD1 ILE 92 -3.581 5.821 5.843 563 H GLU 93 H GLU 93 -4.381 -0.292 8.250 564 HA GLU 93 HA GLU 93 -6.353 -0.657 10.398 565 1HB GLU 93 2HB GLU 93 -5.947 -2.527 8.867 566 2HB GLU 93 1HB GLU 93 -4.253 -2.537 9.323 567 1HG GLU 93 2HG GLU 93 -5.434 -4.306 10.407 568 2HG GLU 93 1HG GLU 93 -4.883 -3.141 11.615 569 H ALA 94 H ALA 94 -2.869 -0.414 9.875 570 HA ALA 94 HA ALA 94 -2.509 0.594 12.537 571 1HB ALA 94 1HB ALA 94 -0.809 -1.072 13.142 572 2HB ALA 94 2HB ALA 94 -1.166 -1.970 11.668 573 3HB ALA 94 3HB ALA 94 -2.389 -1.829 12.931 574 H VAL 95 H VAL 95 -0.727 1.888 12.604 575 HA VAL 95 HA VAL 95 1.209 1.646 10.508 576 HB VAL 95 HB VAL 95 -0.398 3.145 9.452 577 1HG1 VAL 95 1HG1 VAL 95 -0.917 5.358 10.363 578 2HG1 VAL 95 2HG1 VAL 95 -0.093 4.920 11.861 579 3HG1 VAL 95 3HG1 VAL 95 -1.540 4.039 11.352 580 1HG2 VAL 95 1HG2 VAL 95 1.944 3.554 9.001 581 2HG2 VAL 95 2HG2 VAL 95 2.046 4.638 10.386 582 3HG2 VAL 95 3HG2 VAL 95 1.049 5.072 8.996 583 H GLU 96 H GLU 96 3.141 1.894 11.296 584 HA GLU 96 HA GLU 96 3.437 3.481 13.746 585 1HB GLU 96 2HB GLU 96 3.912 1.065 14.193 586 2HB GLU 96 1HB GLU 96 5.034 1.083 12.836 587 1HG GLU 96 2HG GLU 96 6.130 1.077 14.969 588 2HG GLU 96 1HG GLU 96 6.529 2.436 13.956 589 HA PRO 97 HA PRO 97 5.710 5.796 10.599 590 1HB PRO 97 2HB PRO 97 5.845 7.760 12.800 591 2HB PRO 97 1HB PRO 97 5.221 7.965 11.159 592 1HG PRO 97 2HG PRO 97 3.564 7.867 13.240 593 2HG PRO 97 1HG PRO 97 3.149 7.092 11.700 594 1HD PRO 97 2HD PRO 97 4.212 5.846 14.208 595 2HD PRO 97 1HD PRO 97 2.894 5.300 13.140 596 H ASP 98 H ASP 98 6.519 5.028 13.885 597 HA ASP 98 HA ASP 98 9.166 6.162 13.767 598 1HB ASP 98 2HB ASP 98 7.982 6.003 15.890 599 2HB ASP 98 1HB ASP 98 7.956 4.254 15.763 600 H LYS 99 H LYS 99 7.775 3.067 13.264 601 HA LYS 99 HA LYS 99 10.403 1.860 12.844 602 1HB LYS 99 2HB LYS 99 7.663 0.570 12.994 603 2HB LYS 99 1HB LYS 99 9.189 -0.262 12.723 604 1HG LYS 99 2HG LYS 99 8.564 1.338 15.155 605 2HG LYS 99 1HG LYS 99 8.336 -0.403 15.025 606 1HD LYS 99 2HD LYS 99 10.723 -0.641 14.431 607 2HD LYS 99 1HD LYS 99 10.949 1.086 14.676 608 1HE LYS 99 2HE LYS 99 11.700 -0.139 16.642 609 2HE LYS 99 1HE LYS 99 10.284 0.832 17.034 610 1HZ LYS 99 1HZ LYS 99 10.169 -1.382 17.981 611 2HZ LYS 99 2HZ LYS 99 10.250 -2.097 16.473 612 3HZ LYS 99 3HZ LYS 99 8.916 -1.165 16.895 613 H ASN 100 H ASN 100 8.237 3.561 11.154 614 HA ASN 100 HA ASN 100 7.601 3.838 9.017 615 1HB ASN 100 2HB ASN 100 10.116 3.952 8.742 616 2HB ASN 100 1HB ASN 100 10.106 2.243 8.356 617 1HD2 ASN 100 1HD2 ASN 100 11.023 4.480 6.783 618 2HD2 ASN 100 2HD2 ASN 100 10.103 4.426 5.314 619 H LEU 101 H LEU 101 5.926 2.354 9.801 620 HA LEU 101 HA LEU 101 5.774 -0.169 8.254 621 1HB LEU 101 2HB LEU 101 6.312 -0.613 10.600 622 2HB LEU 101 1HB LEU 101 4.959 0.394 11.075 623 HG LEU 101 HG LEU 101 3.471 -1.228 9.873 624 1HD1 LEU 101 1HD1 LEU 101 5.938 -2.909 9.886 625 2HD1 LEU 101 2HD1 LEU 101 5.038 -2.290 8.484 626 3HD1 LEU 101 3HD1 LEU 101 4.295 -3.468 9.560 627 1HD2 LEU 101 1HD2 LEU 101 3.456 -2.826 11.720 628 2HD2 LEU 101 2HD2 LEU 101 3.584 -1.156 12.260 629 3HD2 LEU 101 3HD2 LEU 101 5.018 -2.194 12.262 630 H ILE 102 H ILE 102 3.793 -0.411 7.267 631 HA ILE 102 HA ILE 102 1.492 0.870 8.418 632 HB ILE 102 HB ILE 102 2.213 2.650 6.979 633 1HG1 ILE 102 2HG1 ILE 102 -0.114 1.200 5.681 634 2HG1 ILE 102 1HG1 ILE 102 -0.217 2.239 7.097 635 1HG2 ILE 102 1HG2 ILE 102 2.508 2.390 4.543 636 2HG2 ILE 102 2HG2 ILE 102 2.265 0.649 4.737 637 3HG2 ILE 102 3HG2 ILE 102 3.654 1.406 5.458 638 1HD1 ILE 102 1HD1 ILE 102 0.577 3.098 4.320 639 2HD1 ILE 102 2HD1 ILE 102 0.478 4.147 5.735 640 3HD1 ILE 102 3HD1 ILE 102 -0.982 3.385 5.099 641 H THR 103 H THR 103 -0.152 -0.390 8.399 642 HA THR 103 HA THR 103 -0.196 -2.792 6.730 643 HB THR 103 HB THR 103 -1.966 -2.012 9.062 644 HG1 THR 103 1HG THR 103 0.308 -3.720 8.959 645 1HG2 THR 103 1HG2 THR 103 -2.540 -4.401 9.109 646 2HG2 THR 103 2HG2 THR 103 -1.520 -4.672 7.704 647 3HG2 THR 103 3HG2 THR 103 -2.966 -3.674 7.560 648 H PHE 104 H PHE 104 -1.448 -2.827 4.926 649 HA PHE 104 HA PHE 104 -3.707 -0.981 4.623 650 1HB PHE 104 2HB PHE 104 -2.272 -2.759 2.608 651 2HB PHE 104 1HB PHE 104 -3.525 -1.677 2.143 652 HD1 PHE 104 1HD PHE 104 -3.087 0.795 2.282 653 HD2 PHE 104 2HD PHE 104 -0.043 -2.108 2.844 654 HE1 PHE 104 1HE PHE 104 -1.378 2.505 1.829 655 HE2 PHE 104 2HE PHE 104 1.668 -0.403 2.377 656 HZ PHE 104 HZ PHE 104 1.002 1.901 1.876 657 H ARG 105 H ARG 105 -5.735 -1.837 4.828 658 HA ARG 105 HA ARG 105 -6.002 -4.780 4.698 659 1HB ARG 105 2HB ARG 105 -6.285 -3.537 6.947 660 2HB ARG 105 1HB ARG 105 -7.732 -2.847 6.256 661 1HG ARG 105 2HG ARG 105 -7.250 -5.797 6.695 662 2HG ARG 105 1HG ARG 105 -8.123 -4.769 7.803 663 1HD ARG 105 2HD ARG 105 -9.780 -4.377 5.934 664 2HD ARG 105 1HD ARG 105 -8.908 -5.612 5.011 665 HE ARG 105 HE ARG 105 -9.616 -6.452 7.641 666 1HH1 ARG 105 1HH1 ARG 105 -10.870 -6.369 4.296 667 2HH1 ARG 105 2HH1 ARG 105 -12.051 -7.545 4.618 668 1HH2 ARG 105 1HH2 ARG 105 -11.237 -8.047 7.999 669 2HH2 ARG 105 2HH2 ARG 105 -12.265 -8.512 6.714 670 H VAL 106 H VAL 106 -7.148 -5.319 2.892 671 HA VAL 106 HA VAL 106 -8.623 -3.281 1.483 672 HB VAL 106 HB VAL 106 -8.265 -6.259 0.940 673 1HG1 VAL 106 1HG1 VAL 106 -9.175 -5.815 -1.294 674 2HG1 VAL 106 2HG1 VAL 106 -9.508 -4.145 -0.830 675 3HG1 VAL 106 3HG1 VAL 106 -10.369 -5.468 -0.043 676 1HG2 VAL 106 1HG2 VAL 106 -6.221 -4.956 0.726 677 2HG2 VAL 106 2HG2 VAL 106 -7.040 -3.829 -0.351 678 3HG2 VAL 106 3HG2 VAL 106 -6.780 -5.498 -0.858 679 H ILE 107 H ILE 107 -10.686 -2.850 1.807 680 HA ILE 107 HA ILE 107 -12.120 -4.675 3.582 681 HB ILE 107 HB ILE 107 -13.608 -2.925 4.267 682 1HG1 ILE 107 2HG1 ILE 107 -13.978 -1.682 2.100 683 2HG1 ILE 107 1HG1 ILE 107 -13.546 -0.619 3.435 684 1HG2 ILE 107 1HG2 ILE 107 -12.078 -1.280 5.220 685 2HG2 ILE 107 2HG2 ILE 107 -10.833 -1.818 4.099 686 3HG2 ILE 107 3HG2 ILE 107 -11.439 -2.927 5.338 687 1HD1 ILE 107 1HD1 ILE 107 -12.534 0.041 1.390 688 2HD1 ILE 107 2HD1 ILE 107 -11.739 -1.526 1.239 689 3HD1 ILE 107 3HD1 ILE 107 -11.315 -0.443 2.568 690 H GLU 108 H GLU 108 -12.231 -3.430 0.401 691 HA GLU 108 HA GLU 108 -14.282 -5.331 -0.273 692 1HB GLU 108 2HB GLU 108 -15.545 -3.235 0.296 693 2HB GLU 108 1HB GLU 108 -14.592 -2.377 -0.894 694 1HG GLU 108 2HG GLU 108 -15.512 -3.718 -2.678 695 2HG GLU 108 1HG GLU 108 -16.416 -4.689 -1.523 696 H GLY 109 H GLY 109 -14.219 -5.733 -2.617 697 1HA GLY 109 2HA GLY 109 -13.070 -4.594 -4.617 698 2HA GLY 109 1HA GLY 109 -11.629 -4.956 -3.671 699 H ASP 110 H ASP 110 -11.544 -6.008 -5.942 700 HA ASP 110 HA ASP 110 -12.914 -8.452 -6.344 701 1HB ASP 110 2HB ASP 110 -11.929 -7.132 -8.172 702 2HB ASP 110 1HB ASP 110 -10.322 -7.507 -7.564 703 H LEU 111 H LEU 111 -9.976 -7.621 -4.717 704 HA LEU 111 HA LEU 111 -8.982 -10.291 -4.493 705 1HB LEU 111 2HB LEU 111 -8.329 -7.872 -2.791 706 2HB LEU 111 1HB LEU 111 -7.497 -9.400 -2.698 707 HG LEU 111 HG LEU 111 -6.776 -9.027 -5.097 708 1HD1 LEU 111 1HD1 LEU 111 -8.405 -7.356 -5.762 709 2HD1 LEU 111 2HD1 LEU 111 -6.761 -6.738 -5.940 710 3HD1 LEU 111 3HD1 LEU 111 -7.753 -6.225 -4.573 711 1HD2 LEU 111 1HD2 LEU 111 -4.972 -7.500 -4.473 712 2HD2 LEU 111 2HD2 LEU 111 -5.281 -8.712 -3.228 713 3HD2 LEU 111 3HD2 LEU 111 -5.858 -7.062 -3.010 714 H MET 112 H MET 112 -11.347 -8.449 -2.866 715 HA MET 112 HA MET 112 -11.261 -9.808 -0.346 716 1HB MET 112 2HB MET 112 -12.156 -7.481 -0.735 717 2HB MET 112 1HB MET 112 -13.519 -8.234 -1.546 718 1HG MET 112 2HG MET 112 -14.358 -7.767 0.578 719 2HG MET 112 1HG MET 112 -13.924 -9.464 0.681 720 1HE MET 112 1HE MET 112 -11.613 -10.323 2.012 721 2HE MET 112 2HE MET 112 -10.645 -9.222 2.987 722 3HE MET 112 3HE MET 112 -10.534 -9.124 1.260 723 H LYS 113 H LYS 113 -12.597 -10.572 -3.425 724 HA LYS 113 HA LYS 113 -14.370 -12.462 -2.169 725 1HB LYS 113 2HB LYS 113 -15.279 -12.993 -4.394 726 2HB LYS 113 1HB LYS 113 -15.411 -11.314 -3.946 727 1HG LYS 113 2HG LYS 113 -14.925 -11.444 -6.187 728 2HG LYS 113 1HG LYS 113 -13.487 -10.820 -5.380 729 1HD LYS 113 2HD LYS 113 -12.793 -12.421 -7.080 730 2HD LYS 113 1HD LYS 113 -12.516 -13.083 -5.459 731 1HE LYS 113 2HE LYS 113 -13.436 -14.789 -6.965 732 2HE LYS 113 1HE LYS 113 -14.550 -14.442 -5.657 733 1HZ LYS 113 1HZ LYS 113 -15.854 -13.068 -7.188 734 2HZ LYS 113 2HZ LYS 113 -15.652 -14.624 -7.800 735 3HZ LYS 113 3HZ LYS 113 -14.742 -13.359 -8.417 736 H GLU 114 H GLU 114 -11.289 -12.367 -3.132 737 HA GLU 114 HA GLU 114 -11.008 -15.201 -3.836 738 1HB GLU 114 2HB GLU 114 -8.963 -13.071 -3.261 739 2HB GLU 114 1HB GLU 114 -8.598 -14.696 -3.774 740 1HG GLU 114 2HG GLU 114 -9.674 -14.259 -5.899 741 2HG GLU 114 1HG GLU 114 -10.066 -12.621 -5.355 742 H TYR 115 H TYR 115 -9.901 -12.903 -1.446 743 HA TYR 115 HA TYR 115 -9.425 -15.099 0.423 744 1HB TYR 115 2HB TYR 115 -8.368 -12.303 0.716 745 2HB TYR 115 1HB TYR 115 -7.706 -13.803 1.341 746 HD1 TYR 115 1HD TYR 115 -7.319 -11.283 -1.023 747 HD2 TYR 115 2HD TYR 115 -6.828 -15.490 -0.613 748 HE1 TYR 115 1HE TYR 115 -5.769 -11.273 -2.908 749 HE2 TYR 115 2HE TYR 115 -5.260 -15.483 -2.499 750 HH TYR 115 HH TYR 115 -4.893 -13.999 -4.527 751 H LYS 116 H LYS 116 -10.598 -15.000 2.205 752 HA LYS 116 HA LYS 116 -12.803 -13.171 2.335 753 1HB LYS 116 2HB LYS 116 -13.310 -14.371 4.505 754 2HB LYS 116 1HB LYS 116 -13.302 -15.359 3.057 755 1HG LYS 116 2HG LYS 116 -10.992 -16.067 3.610 756 2HG LYS 116 1HG LYS 116 -11.110 -15.153 5.110 757 1HD LYS 116 2HD LYS 116 -12.955 -17.396 4.314 758 2HD LYS 116 1HD LYS 116 -11.564 -17.595 5.377 759 1HE LYS 116 2HE LYS 116 -12.580 -15.978 6.945 760 2HE LYS 116 1HE LYS 116 -13.969 -15.839 5.873 761 1HZ LYS 116 1HZ LYS 116 -14.395 -17.358 7.684 762 2HZ LYS 116 2HZ LYS 116 -13.088 -18.323 7.229 763 3HZ LYS 116 3HZ LYS 116 -14.428 -18.177 6.214 764 H SER 117 H SER 117 -9.690 -12.883 3.242 765 HA SER 117 HA SER 117 -10.108 -10.362 4.414 766 1HB SER 117 2HB SER 117 -10.455 -11.705 6.350 767 2HB SER 117 1HB SER 117 -8.923 -12.576 6.119 768 HG SER 117 HG SER 117 -7.826 -10.711 6.628 769 H PHE 118 H PHE 118 -8.301 -9.129 3.956 770 HA PHE 118 HA PHE 118 -5.898 -10.508 3.138 771 1HB PHE 118 2HB PHE 118 -7.148 -10.364 1.069 772 2HB PHE 118 1HB PHE 118 -7.458 -8.652 1.325 773 HD1 PHE 118 1HD PHE 118 -4.731 -11.106 0.730 774 HD2 PHE 118 2HD PHE 118 -5.983 -7.063 0.473 775 HE1 PHE 118 1HE PHE 118 -2.699 -10.565 -0.521 776 HE2 PHE 118 2HE PHE 118 -3.951 -6.513 -0.792 777 HZ PHE 118 HZ PHE 118 -2.308 -8.254 -1.287 778 H LEU 119 H LEU 119 -4.266 -9.605 4.069 779 HA LEU 119 HA LEU 119 -4.255 -6.731 4.596 780 1HB LEU 119 2HB LEU 119 -3.232 -9.028 6.217 781 2HB LEU 119 1HB LEU 119 -2.641 -7.397 6.435 782 HG LEU 119 HG LEU 119 -5.492 -8.026 6.533 783 1HD1 LEU 119 1HD1 LEU 119 -3.453 -7.984 8.839 784 2HD1 LEU 119 2HD1 LEU 119 -4.265 -9.440 8.265 785 3HD1 LEU 119 3HD1 LEU 119 -5.191 -8.173 9.071 786 1HD2 LEU 119 1HD2 LEU 119 -4.933 -5.724 6.343 787 2HD2 LEU 119 2HD2 LEU 119 -3.809 -5.841 7.694 788 3HD2 LEU 119 3HD2 LEU 119 -5.536 -6.012 7.976 789 H LEU 120 H LEU 120 -2.543 -5.773 4.203 790 HA LEU 120 HA LEU 120 -0.094 -7.188 3.571 791 1HB LEU 120 2HB LEU 120 0.457 -5.964 1.523 792 2HB LEU 120 1HB LEU 120 -1.002 -6.901 1.321 793 HG LEU 120 HG LEU 120 -0.942 -3.909 1.756 794 1HD1 LEU 120 1HD1 LEU 120 -1.367 -3.712 -0.594 795 2HD1 LEU 120 2HD1 LEU 120 -1.279 -5.469 -0.797 796 3HD1 LEU 120 3HD1 LEU 120 0.156 -4.548 -0.322 797 1HD2 LEU 120 1HD2 LEU 120 -3.060 -4.940 2.401 798 2HD2 LEU 120 2HD2 LEU 120 -3.128 -5.784 0.865 799 3HD2 LEU 120 3HD2 LEU 120 -3.261 -4.022 0.906 800 H THR 121 H THR 121 1.489 -6.422 4.646 801 HA THR 121 HA THR 121 1.247 -3.674 5.610 802 HB THR 121 HB THR 121 2.521 -6.055 6.964 803 HG1 THR 121 1HG THR 121 0.041 -5.590 6.604 804 1HG2 THR 121 1HG2 THR 121 3.438 -3.891 7.614 805 2HG2 THR 121 2HG2 THR 121 2.476 -4.574 8.932 806 3HG2 THR 121 3HG2 THR 121 1.818 -3.282 7.923 807 H ILE 122 H ILE 122 2.960 -2.408 5.138 808 HA ILE 122 HA ILE 122 5.357 -3.784 4.192 809 HB ILE 122 HB ILE 122 5.887 -1.821 2.833 810 1HG1 ILE 122 2HG1 ILE 122 3.139 -0.848 3.565 811 2HG1 ILE 122 1HG1 ILE 122 4.650 -0.143 4.107 812 1HG2 ILE 122 1HG2 ILE 122 4.744 -3.686 1.792 813 2HG2 ILE 122 2HG2 ILE 122 4.191 -2.172 1.077 814 3HG2 ILE 122 3HG2 ILE 122 3.181 -3.009 2.252 815 1HD1 ILE 122 1HD1 ILE 122 3.701 -0.255 1.245 816 2HD1 ILE 122 2HD1 ILE 122 5.224 0.441 1.801 817 3HD1 ILE 122 3HD1 ILE 122 3.693 1.164 2.295 818 H GLN 123 H GLN 123 7.264 -3.094 4.881 819 HA GLN 123 HA GLN 123 7.336 -0.821 6.669 820 1HB GLN 123 2HB GLN 123 7.058 -2.904 8.038 821 2HB GLN 123 1HB GLN 123 8.543 -3.518 7.337 822 1HG GLN 123 2HG GLN 123 9.848 -1.864 8.424 823 2HG GLN 123 1HG GLN 123 8.418 -0.952 8.894 824 1HE2 GLN 123 1HE2 GLN 123 8.894 -1.000 11.044 825 2HE2 GLN 123 2HE2 GLN 123 8.776 -2.418 12.021 826 H VAL 124 H VAL 124 8.941 0.443 6.150 827 HA VAL 124 HA VAL 124 10.764 -0.516 4.089 828 HB VAL 124 HB VAL 124 10.190 2.323 4.987 829 1HG1 VAL 124 1HG1 VAL 124 11.360 2.997 2.952 830 2HG1 VAL 124 2HG1 VAL 124 11.754 1.305 2.628 831 3HG1 VAL 124 3HG1 VAL 124 12.414 2.104 4.053 832 1HG2 VAL 124 1HG2 VAL 124 8.249 1.313 3.917 833 2HG2 VAL 124 2HG2 VAL 124 9.240 0.834 2.539 834 3HG2 VAL 124 3HG2 VAL 124 8.966 2.542 2.875 835 H THR 125 H THR 125 12.660 -1.091 4.608 836 HA THR 125 HA THR 125 13.951 -0.079 7.052 837 HB THR 125 HB THR 125 13.865 -2.903 5.957 838 HG1 THR 125 1HG THR 125 12.541 -1.609 8.090 839 1HG2 THR 125 1HG2 THR 125 14.942 -3.559 8.021 840 2HG2 THR 125 2HG2 THR 125 15.029 -1.876 8.554 841 3HG2 THR 125 3HG2 THR 125 15.966 -2.408 7.148 842 HA PRO 126 HA PRO 126 17.345 1.074 4.275 843 1HB PRO 126 2HB PRO 126 18.974 -0.176 6.443 844 2HB PRO 126 1HB PRO 126 19.199 1.375 5.628 845 1HG PRO 126 2HG PRO 126 18.119 1.227 8.068 846 2HG PRO 126 1HG PRO 126 17.547 2.420 6.878 847 1HD PRO 126 2HD PRO 126 16.271 -0.046 7.887 848 2HD PRO 126 1HD PRO 126 15.528 1.428 7.238 849 H LYS 127 H LYS 127 18.666 0.136 2.776 850 HA LYS 127 HA LYS 127 18.386 -2.660 2.243 851 1HB LYS 127 2HB LYS 127 20.114 -0.529 0.971 852 2HB LYS 127 1HB LYS 127 20.014 -2.183 0.388 853 1HG LYS 127 2HG LYS 127 17.706 -1.889 -0.180 854 2HG LYS 127 1HG LYS 127 17.675 -0.306 0.589 855 1HD LYS 127 2HD LYS 127 17.801 0.075 -1.765 856 2HD LYS 127 1HD LYS 127 19.376 0.452 -1.096 857 1HE LYS 127 2HE LYS 127 18.628 -2.089 -2.564 858 2HE LYS 127 1HE LYS 127 19.506 -0.735 -3.245 859 1HZ LYS 127 1HZ LYS 127 20.419 -2.651 -1.186 860 2HZ LYS 127 2HZ LYS 127 21.281 -1.225 -1.525 861 3HZ LYS 127 3HZ LYS 127 21.049 -2.425 -2.680 862 HA PRO 128 HA PRO 128 21.911 -4.270 4.421 863 1HB PRO 128 2HB PRO 128 22.806 -6.052 2.472 864 2HB PRO 128 1HB PRO 128 21.565 -6.410 3.677 865 1HG PRO 128 2HG PRO 128 21.257 -5.584 0.826 866 2HG PRO 128 1HG PRO 128 20.305 -6.737 1.777 867 1HD PRO 128 2HD PRO 128 19.395 -4.275 1.238 868 2HD PRO 128 1HD PRO 128 19.062 -5.066 2.793 869 H GLY 129 H GLY 129 23.478 -2.879 4.576 870 1HA GLY 129 2HA GLY 129 25.807 -2.568 3.647 871 2HA GLY 129 1HA GLY 129 24.967 -2.066 2.180 872 H GLY 130 H GLY 130 22.988 -0.504 2.936 873 1HA GLY 130 2HA GLY 130 22.966 1.198 4.958 874 2HA GLY 130 1HA GLY 130 24.385 1.761 4.086 875 HA PRO 131 HA PRO 131 22.165 4.465 1.455 876 1HB PRO 131 2HB PRO 131 22.889 3.509 -1.075 877 2HB PRO 131 1HB PRO 131 23.775 4.705 -0.132 878 1HG PRO 131 2HG PRO 131 24.241 1.774 -0.406 879 2HG PRO 131 1HG PRO 131 25.413 3.092 -0.242 880 1HD PRO 131 2HD PRO 131 24.858 1.478 1.798 881 2HD PRO 131 1HD PRO 131 25.135 3.213 2.057 882 H GLY 132 H GLY 132 20.073 4.486 1.108 883 1HA GLY 132 2HA GLY 132 18.117 4.069 -0.087 884 2HA GLY 132 1HA GLY 132 18.866 2.639 -0.775 885 H SER 133 H SER 133 16.374 2.240 -0.060 886 HA SER 133 HA SER 133 16.673 0.584 2.285 887 1HB SER 133 2HB SER 133 14.421 1.314 3.115 888 2HB SER 133 1HB SER 133 15.686 2.531 3.258 889 HG SER 133 HG SER 133 14.800 3.240 1.084 890 H ILE 134 H ILE 134 15.030 -0.979 2.558 891 HA ILE 134 HA ILE 134 14.197 -1.998 -0.044 892 HB ILE 134 HB ILE 134 15.897 -3.244 1.631 893 1HG1 ILE 134 2HG1 ILE 134 14.835 -5.478 1.043 894 2HG1 ILE 134 1HG1 ILE 134 13.607 -4.520 0.211 895 1HG2 ILE 134 1HG2 ILE 134 14.803 -4.795 3.126 896 2HG2 ILE 134 2HG2 ILE 134 13.261 -4.042 2.733 897 3HG2 ILE 134 3HG2 ILE 134 14.495 -3.105 3.607 898 1HD1 ILE 134 1HD1 ILE 134 15.344 -3.460 -1.081 899 2HD1 ILE 134 2HD1 ILE 134 15.316 -5.228 -1.298 900 3HD1 ILE 134 3HD1 ILE 134 16.534 -4.460 -0.258 901 H VAL 135 H VAL 135 11.920 -2.645 -0.011 902 HA VAL 135 HA VAL 135 10.515 -1.954 2.440 903 HB VAL 135 HB VAL 135 9.723 -0.554 0.600 904 1HG1 VAL 135 1HG1 VAL 135 9.070 -3.068 -0.871 905 2HG1 VAL 135 2HG1 VAL 135 10.323 -1.901 -1.290 906 3HG1 VAL 135 3HG1 VAL 135 8.619 -1.438 -1.368 907 1HG2 VAL 135 1HG2 VAL 135 7.689 -2.657 1.301 908 2HG2 VAL 135 2HG2 VAL 135 7.322 -1.064 0.639 909 3HG2 VAL 135 3HG2 VAL 135 8.064 -1.207 2.234 910 H HIS 136 H HIS 136 9.812 -3.513 3.604 911 HA HIS 136 HA HIS 136 9.761 -6.194 2.472 912 1HB HIS 136 2HB HIS 136 9.524 -5.209 5.332 913 2HB HIS 136 1HB HIS 136 9.339 -6.904 4.889 914 HD1 HIS 136 1HD HIS 136 11.533 -8.129 4.161 915 HD2 HIS 136 2HD HIS 136 12.078 -4.257 5.557 916 HE1 HIS 136 1HE HIS 136 13.984 -7.936 4.662 917 HE2 HIS 136 2HE HIS 136 14.120 -5.766 5.913 918 H TRP 137 H TRP 137 7.940 -6.802 1.508 919 HA TRP 137 HA TRP 137 5.391 -5.697 2.392 920 1HB TRP 137 2HB TRP 137 6.045 -7.497 0.028 921 2HB TRP 137 1HB TRP 137 4.488 -6.868 0.446 922 HD1 TRP 137 HD TRP 137 7.957 -5.337 -0.547 923 HE1 TRP 137 1HE TRP 137 7.448 -3.281 -1.983 924 HE3 TRP 137 3HE TRP 137 2.842 -5.348 -0.281 925 HZ2 TRP 137 2HZ TRP 137 5.281 -1.856 -2.859 926 HZ3 TRP 137 3HZ TRP 137 1.617 -3.580 -1.458 927 HH2 TRP 137 HH TRP 137 2.792 -1.861 -2.721 928 H HIS 138 H HIS 138 4.260 -6.806 3.800 929 HA HIS 138 HA HIS 138 4.557 -9.745 3.811 930 1HB HIS 138 2HB HIS 138 3.480 -8.029 6.054 931 2HB HIS 138 1HB HIS 138 3.825 -9.744 6.113 932 HD1 HIS 138 1HD HIS 138 6.417 -10.418 6.325 933 HD2 HIS 138 2HD HIS 138 5.503 -6.368 6.501 934 HE1 HIS 138 1HE HIS 138 8.451 -9.327 7.233 935 HE2 HIS 138 2HE HIS 138 7.707 -7.007 7.733 936 H LEU 139 H LEU 139 2.875 -10.492 2.666 937 HA LEU 139 HA LEU 139 0.335 -9.114 3.014 938 1HB LEU 139 2HB LEU 139 1.212 -11.065 0.860 939 2HB LEU 139 1HB LEU 139 -0.371 -10.340 0.968 940 HG LEU 139 HG LEU 139 0.797 -8.072 0.569 941 1HD1 LEU 139 1HD1 LEU 139 3.035 -8.646 1.152 942 2HD1 LEU 139 2HD1 LEU 139 2.932 -8.075 -0.512 943 3HD1 LEU 139 3HD1 LEU 139 3.111 -9.800 -0.177 944 1HD2 LEU 139 1HD2 LEU 139 0.972 -10.153 -1.595 945 2HD2 LEU 139 2HD2 LEU 139 0.927 -8.404 -1.830 946 3HD2 LEU 139 3HD2 LEU 139 -0.473 -9.239 -1.158 947 H GLU 140 H GLU 140 -1.075 -10.097 4.206 948 HA GLU 140 HA GLU 140 -0.772 -12.959 4.698 949 1HB GLU 140 2HB GLU 140 -1.323 -10.803 6.759 950 2HB GLU 140 1HB GLU 140 -1.334 -12.534 7.073 951 1HG GLU 140 2HG GLU 140 1.023 -12.676 6.493 952 2HG GLU 140 1HG GLU 140 1.055 -10.960 6.134 953 H TYR 141 H TYR 141 -2.583 -13.987 4.446 954 HA TYR 141 HA TYR 141 -5.109 -12.635 4.561 955 1HB TYR 141 2HB TYR 141 -5.654 -13.212 2.126 956 2HB TYR 141 1HB TYR 141 -4.573 -11.864 2.463 957 HD1 TYR 141 1HD TYR 141 -2.197 -11.977 1.884 958 HD2 TYR 141 2HD TYR 141 -4.814 -15.210 0.996 959 HE1 TYR 141 1HE TYR 141 -0.496 -12.940 0.415 960 HE2 TYR 141 2HE TYR 141 -3.120 -16.156 -0.482 961 HH TYR 141 HH TYR 141 0.110 -15.105 -0.499 962 H GLU 142 H GLU 142 -6.915 -14.041 3.887 963 HA GLU 142 HA GLU 142 -6.424 -16.782 4.898 964 1HB GLU 142 2HB GLU 142 -7.662 -15.200 6.400 965 2HB GLU 142 1HB GLU 142 -8.873 -15.023 5.149 966 1HG GLU 142 2HG GLU 142 -9.696 -16.501 6.817 967 2HG GLU 142 1HG GLU 142 -9.364 -17.432 5.359 968 H LYS 143 H LYS 143 -6.836 -18.324 3.292 969 HA LYS 143 HA LYS 143 -8.231 -17.553 0.890 970 1HB LYS 143 2HB LYS 143 -7.044 -20.201 1.735 971 2HB LYS 143 1HB LYS 143 -8.077 -20.056 0.333 972 1HG LYS 143 2HG LYS 143 -5.779 -20.113 -0.328 973 2HG LYS 143 1HG LYS 143 -6.451 -18.527 -0.675 974 1HD LYS 143 2HD LYS 143 -5.344 -17.611 1.257 975 2HD LYS 143 1HD LYS 143 -4.765 -19.218 1.716 976 1HE LYS 143 2HE LYS 143 -4.113 -17.846 -0.878 977 2HE LYS 143 1HE LYS 143 -3.064 -17.848 0.548 978 1HZ LYS 143 1HZ LYS 143 -2.377 -19.520 -1.012 979 2HZ LYS 143 2HZ LYS 143 -3.909 -20.205 -1.056 980 3HZ LYS 143 3HZ LYS 143 -2.981 -20.285 0.345 981 H ILE 144 H ILE 144 -10.257 -17.936 0.342 982 HA ILE 144 HA ILE 144 -12.103 -19.157 2.181 983 HB ILE 144 HB ILE 144 -12.461 -18.451 -0.755 984 1HG1 ILE 144 2HG1 ILE 144 -13.136 -16.821 1.686 985 2HG1 ILE 144 1HG1 ILE 144 -11.796 -16.494 0.593 986 1HG2 ILE 144 1HG2 ILE 144 -14.482 -18.900 1.429 987 2HG2 ILE 144 2HG2 ILE 144 -14.165 -19.987 0.067 988 3HG2 ILE 144 3HG2 ILE 144 -14.850 -18.379 -0.217 989 1HD1 ILE 144 1HD1 ILE 144 -13.649 -15.012 0.125 990 2HD1 ILE 144 2HD1 ILE 144 -14.727 -16.400 -0.079 991 3HD1 ILE 144 3HD1 ILE 144 -13.412 -16.140 -1.222 992 H SER 145 H SER 145 -10.371 -19.907 -0.744 993 HA SER 145 HA SER 145 -10.222 -22.667 -0.324 994 1HB SER 145 2HB SER 145 -12.560 -22.501 -1.305 995 2HB SER 145 1HB SER 145 -11.876 -21.686 -2.706 996 HG SER 145 HG SER 145 -11.511 -24.327 -1.822 997 H GLU 146 H GLU 146 -9.027 -23.464 -2.528 998 HA GLU 146 HA GLU 146 -6.870 -21.534 -2.886 999 1HB GLU 146 2HB GLU 146 -7.340 -24.147 -4.155 1000 2HB GLU 146 1HB GLU 146 -5.840 -23.248 -4.224 1001 1HG GLU 146 2HG GLU 146 -5.645 -23.516 -1.732 1002 2HG GLU 146 1HG GLU 146 -7.046 -24.582 -1.799 1003 H GLU 147 H GLU 147 -9.119 -23.331 -4.827 1004 HA GLU 147 HA GLU 147 -8.394 -22.441 -7.360 1005 1HB GLU 147 2HB GLU 147 -10.558 -23.402 -8.063 1006 2HB GLU 147 1HB GLU 147 -9.633 -24.470 -7.016 1007 1HG GLU 147 2HG GLU 147 -11.054 -23.610 -5.100 1008 2HG GLU 147 1HG GLU 147 -12.058 -22.847 -6.321 1009 H VAL 148 H VAL 148 -10.127 -20.911 -4.990 1010 HA VAL 148 HA VAL 148 -11.504 -19.112 -6.878 1011 HB VAL 148 HB VAL 148 -12.752 -19.804 -4.789 1012 1HG1 VAL 148 1HG1 VAL 148 -10.795 -18.065 -3.342 1013 2HG1 VAL 148 2HG1 VAL 148 -10.936 -19.822 -3.217 1014 3HG1 VAL 148 3HG1 VAL 148 -12.261 -18.793 -2.678 1015 1HG2 VAL 148 1HG2 VAL 148 -12.300 -16.835 -5.067 1016 2HG2 VAL 148 2HG2 VAL 148 -13.661 -17.593 -4.244 1017 3HG2 VAL 148 3HG2 VAL 148 -13.455 -17.804 -5.985 1018 H ALA 149 H ALA 149 -8.649 -19.202 -5.007 1019 HA ALA 149 HA ALA 149 -8.328 -16.308 -5.068 1020 1HB ALA 149 1HB ALA 149 -8.011 -17.442 -2.912 1021 2HB ALA 149 2HB ALA 149 -6.537 -16.664 -3.466 1022 3HB ALA 149 3HB ALA 149 -6.719 -18.410 -3.618 1023 H HIS 150 H HIS 150 -6.311 -15.416 -5.708 1024 HA HIS 150 HA HIS 150 -4.441 -17.087 -7.178 1025 1HB HIS 150 2HB HIS 150 -4.352 -15.440 -9.110 1026 2HB HIS 150 1HB HIS 150 -5.752 -16.490 -9.065 1027 HD1 HIS 150 1HD HIS 150 -4.785 -12.865 -8.355 1028 HD2 HIS 150 2HD HIS 150 -8.155 -15.164 -9.132 1029 HE1 HIS 150 1HE HIS 150 -6.601 -11.255 -8.801 1030 HE2 HIS 150 2HE HIS 150 -8.661 -12.676 -8.829 1031 HA PRO 151 HA PRO 151 -2.136 -14.303 -4.406 1032 1HB PRO 151 2HB PRO 151 -0.369 -16.658 -4.293 1033 2HB PRO 151 1HB PRO 151 -1.118 -15.760 -2.971 1034 1HG PRO 151 2HG PRO 151 -1.950 -18.219 -3.612 1035 2HG PRO 151 1HG PRO 151 -3.090 -16.967 -3.091 1036 1HD PRO 151 2HD PRO 151 -2.493 -17.945 -5.863 1037 2HD PRO 151 1HD PRO 151 -4.055 -17.579 -5.087 1038 H GLU 152 H GLU 152 -1.597 -15.681 -7.336 1039 HA GLU 152 HA GLU 152 1.164 -15.197 -7.846 1040 1HB GLU 152 2HB GLU 152 -0.138 -16.758 -9.099 1041 2HB GLU 152 1HB GLU 152 -1.244 -15.492 -9.602 1042 1HG GLU 152 2HG GLU 152 0.495 -14.488 -10.925 1043 2HG GLU 152 1HG GLU 152 1.645 -15.706 -10.381 1044 H THR 153 H THR 153 -1.787 -13.447 -8.467 1045 HA THR 153 HA THR 153 -0.687 -11.410 -10.020 1046 HB THR 153 HB THR 153 -2.934 -10.388 -9.797 1047 HG1 THR 153 1HG THR 153 -3.779 -10.848 -7.839 1048 1HG2 THR 153 1HG2 THR 153 -2.496 -12.284 -11.366 1049 2HG2 THR 153 2HG2 THR 153 -4.162 -12.287 -10.749 1050 3HG2 THR 153 3HG2 THR 153 -2.961 -13.391 -10.082 1051 H LEU 154 H LEU 154 -1.035 -11.823 -6.628 1052 HA LEU 154 HA LEU 154 -0.933 -9.256 -5.590 1053 1HB LEU 154 2HB LEU 154 0.483 -11.706 -4.602 1054 2HB LEU 154 1HB LEU 154 0.175 -10.265 -3.652 1055 HG LEU 154 HG LEU 154 -1.928 -12.140 -4.751 1056 1HD1 LEU 154 1HD1 LEU 154 -2.252 -12.751 -2.419 1057 2HD1 LEU 154 2HD1 LEU 154 -0.911 -11.708 -1.956 1058 3HD1 LEU 154 3HD1 LEU 154 -0.617 -13.128 -2.963 1059 1HD2 LEU 154 1HD2 LEU 154 -2.752 -9.829 -4.566 1060 2HD2 LEU 154 2HD2 LEU 154 -2.175 -9.792 -2.890 1061 3HD2 LEU 154 3HD2 LEU 154 -3.465 -10.891 -3.343 1062 H LEU 155 H LEU 155 1.754 -11.223 -6.875 1063 HA LEU 155 HA LEU 155 3.783 -9.422 -6.081 1064 1HB LEU 155 2HB LEU 155 3.775 -11.488 -8.265 1065 2HB LEU 155 1HB LEU 155 5.174 -10.505 -7.892 1066 HG LEU 155 HG LEU 155 3.844 -12.467 -6.025 1067 1HD1 LEU 155 1HD1 LEU 155 6.480 -12.481 -7.438 1068 2HD1 LEU 155 2HD1 LEU 155 5.115 -13.571 -7.773 1069 3HD1 LEU 155 3HD1 LEU 155 5.977 -13.637 -6.215 1070 1HD2 LEU 155 1HD2 LEU 155 6.278 -10.730 -5.642 1071 2HD2 LEU 155 2HD2 LEU 155 5.760 -12.022 -4.561 1072 3HD2 LEU 155 3HD2 LEU 155 4.745 -10.602 -4.770 1073 H GLN 156 H GLN 156 1.752 -9.551 -8.860 1074 HA GLN 156 HA GLN 156 3.112 -7.549 -10.335 1075 1HB GLN 156 2HB GLN 156 0.227 -8.445 -10.461 1076 2HB GLN 156 1HB GLN 156 0.992 -7.379 -11.632 1077 1HG GLN 156 2HG GLN 156 1.808 -10.221 -11.058 1078 2HG GLN 156 1HG GLN 156 0.844 -9.687 -12.434 1079 1HE2 GLN 156 1HE2 GLN 156 1.831 -8.518 -14.057 1080 2HE2 GLN 156 2HE2 GLN 156 3.542 -8.479 -14.260 1081 H PHE 157 H PHE 157 0.538 -7.539 -7.958 1082 HA PHE 157 HA PHE 157 -0.077 -4.779 -8.166 1083 1HB PHE 157 2HB PHE 157 -1.660 -6.359 -7.125 1084 2HB PHE 157 1HB PHE 157 -0.513 -6.676 -5.833 1085 HD1 PHE 157 1HD PHE 157 -0.879 -5.566 -3.802 1086 HD2 PHE 157 2HD PHE 157 -2.273 -3.775 -7.412 1087 HE1 PHE 157 1HE PHE 157 -1.937 -3.684 -2.483 1088 HE2 PHE 157 2HE PHE 157 -3.294 -1.948 -6.118 1089 HZ PHE 157 HZ PHE 157 -3.119 -1.917 -3.667 1090 H CYS 158 H CYS 158 2.077 -6.595 -6.002 1091 HA CYS 158 HA CYS 158 2.780 -4.295 -4.539 1092 1HB CYS 158 2HB CYS 158 4.598 -5.638 -3.553 1093 2HB CYS 158 1HB CYS 158 3.060 -6.482 -3.526 1094 HG CYS 158 HG CYS 158 4.521 -7.437 -6.268 1095 H VAL 159 H VAL 159 4.198 -5.722 -7.448 1096 HA VAL 159 HA VAL 159 6.610 -4.262 -7.243 1097 HB VAL 159 HB VAL 159 6.329 -6.312 -8.626 1098 1HG1 VAL 159 1HG1 VAL 159 4.962 -4.546 -10.609 1099 2HG1 VAL 159 2HG1 VAL 159 4.263 -5.891 -9.717 1100 3HG1 VAL 159 3HG1 VAL 159 5.522 -6.193 -10.917 1101 1HG2 VAL 159 1HG2 VAL 159 7.498 -3.925 -10.025 1102 2HG2 VAL 159 2HG2 VAL 159 7.833 -5.603 -10.465 1103 3HG2 VAL 159 3HG2 VAL 159 8.321 -4.982 -8.883 1104 H GLU 160 H GLU 160 3.641 -3.602 -8.938 1105 HA GLU 160 HA GLU 160 4.618 -1.214 -10.136 1106 1HB GLU 160 2HB GLU 160 2.233 -0.671 -10.660 1107 2HB GLU 160 1HB GLU 160 2.755 -2.254 -11.214 1108 1HG GLU 160 2HG GLU 160 1.624 -3.264 -9.274 1109 2HG GLU 160 1HG GLU 160 1.070 -1.661 -8.792 1110 H VAL 161 H VAL 161 2.904 -1.816 -7.143 1111 HA VAL 161 HA VAL 161 2.661 0.928 -6.483 1112 HB VAL 161 HB VAL 161 2.625 -1.496 -4.658 1113 1HG1 VAL 161 1HG1 VAL 161 1.507 -0.017 -3.010 1114 2HG1 VAL 161 2HG1 VAL 161 1.746 1.351 -4.096 1115 3HG1 VAL 161 3HG1 VAL 161 3.139 0.545 -3.381 1116 1HG2 VAL 161 1HG2 VAL 161 0.835 -1.522 -6.301 1117 2HG2 VAL 161 2HG2 VAL 161 0.372 0.119 -5.850 1118 3HG2 VAL 161 3HG2 VAL 161 0.182 -1.199 -4.695 1119 H SER 162 H SER 162 5.190 -1.473 -5.982 1120 HA SER 162 HA SER 162 6.785 -0.007 -4.207 1121 1HB SER 162 2HB SER 162 7.606 -1.990 -6.315 1122 2HB SER 162 1HB SER 162 8.632 -1.375 -5.013 1123 HG SER 162 HG SER 162 6.245 -2.885 -4.753 1124 H LYS 163 H LYS 163 6.849 -0.108 -7.775 1125 HA LYS 163 HA LYS 163 8.993 1.678 -8.132 1126 1HB LYS 163 2HB LYS 163 6.600 1.265 -9.934 1127 2HB LYS 163 1HB LYS 163 8.113 2.027 -10.403 1128 1HG LYS 163 2HG LYS 163 9.288 -0.074 -10.017 1129 2HG LYS 163 1HG LYS 163 7.767 -0.838 -9.550 1130 1HD LYS 163 2HD LYS 163 6.865 -0.334 -11.787 1131 2HD LYS 163 1HD LYS 163 8.423 0.357 -12.240 1132 1HE LYS 163 2HE LYS 163 7.909 -2.502 -11.419 1133 2HE LYS 163 1HE LYS 163 8.186 -1.924 -13.055 1134 1HZ LYS 163 1HZ LYS 163 10.414 -1.248 -12.416 1135 2HZ LYS 163 2HZ LYS 163 10.173 -2.880 -12.099 1136 3HZ LYS 163 3HZ LYS 163 10.169 -1.774 -10.831 1137 H GLU 164 H GLU 164 5.608 2.173 -7.654 1138 HA GLU 164 HA GLU 164 5.448 4.949 -8.155 1139 1HB GLU 164 2HB GLU 164 3.545 3.302 -8.017 1140 2HB GLU 164 1HB GLU 164 3.808 3.280 -6.278 1141 1HG GLU 164 2HG GLU 164 1.981 4.745 -6.736 1142 2HG GLU 164 1HG GLU 164 3.362 5.719 -6.234 1143 H ILE 165 H ILE 165 6.016 2.963 -5.280 1144 HA ILE 165 HA ILE 165 5.897 5.113 -3.484 1145 HB ILE 165 HB ILE 165 5.605 2.474 -3.101 1146 1HG1 ILE 165 2HG1 ILE 165 5.021 4.171 -1.414 1147 2HG1 ILE 165 1HG1 ILE 165 5.767 2.765 -0.675 1148 1HG2 ILE 165 1HG2 ILE 165 7.472 1.472 -1.864 1149 2HG2 ILE 165 2HG2 ILE 165 8.447 2.895 -2.223 1150 3HG2 ILE 165 3HG2 ILE 165 7.907 1.850 -3.534 1151 1HD1 ILE 165 1HD1 ILE 165 6.508 4.836 0.346 1152 2HD1 ILE 165 2HD1 ILE 165 7.085 5.404 -1.221 1153 3HD1 ILE 165 3HD1 ILE 165 7.852 4.012 -0.450 1154 H ASP 166 H ASP 166 8.566 3.574 -5.246 1155 HA ASP 166 HA ASP 166 10.837 4.742 -4.073 1156 1HB ASP 166 2HB ASP 166 10.231 4.492 -7.034 1157 2HB ASP 166 1HB ASP 166 11.785 4.983 -6.397 1158 H GLU 167 H GLU 167 8.765 5.993 -6.569 1159 HA GLU 167 HA GLU 167 9.980 8.593 -6.723 1160 1HB GLU 167 2HB GLU 167 7.409 7.533 -7.854 1161 2HB GLU 167 1HB GLU 167 8.198 9.042 -8.306 1162 1HG GLU 167 2HG GLU 167 10.130 7.763 -9.113 1163 2HG GLU 167 1HG GLU 167 9.302 6.269 -8.679 1164 H HIS 168 H HIS 168 7.299 7.255 -5.046 1165 HA HIS 168 HA HIS 168 6.057 9.666 -4.302 1166 1HB HIS 168 2HB HIS 168 5.031 7.416 -3.989 1167 2HB HIS 168 1HB HIS 168 6.230 7.066 -2.757 1168 HD1 HIS 168 1HD HIS 168 3.060 8.942 -3.349 1169 HD2 HIS 168 2HD HIS 168 5.722 8.235 -0.241 1170 HE1 HIS 168 1HE HIS 168 1.864 9.656 -1.255 1171 HE2 HIS 168 2HE HIS 168 3.389 8.933 0.599 1172 H LEU 169 H LEU 169 8.704 7.813 -2.866 1173 HA LEU 169 HA LEU 169 9.025 9.728 -0.757 1174 1HB LEU 169 2HB LEU 169 10.788 7.446 -1.561 1175 2HB LEU 169 1HB LEU 169 11.013 8.441 -0.135 1176 HG LEU 169 HG LEU 169 8.745 6.558 -0.700 1177 1HD1 LEU 169 1HD1 LEU 169 10.892 6.538 1.405 1178 2HD1 LEU 169 2HD1 LEU 169 10.799 5.490 -0.009 1179 3HD1 LEU 169 3HD1 LEU 169 9.575 5.369 1.250 1180 1HD2 LEU 169 1HD2 LEU 169 7.905 7.180 1.533 1181 2HD2 LEU 169 2HD2 LEU 169 7.874 8.538 0.411 1182 3HD2 LEU 169 3HD2 LEU 169 9.141 8.434 1.628 1183 H LEU 170 H LEU 170 10.775 9.009 -3.764 1184 HA LEU 170 HA LEU 170 12.855 10.869 -3.235 1185 1HB LEU 170 2HB LEU 170 11.775 9.937 -5.894 1186 2HB LEU 170 1HB LEU 170 13.278 10.802 -5.660 1187 HG LEU 170 HG LEU 170 12.677 8.049 -4.589 1188 1HD1 LEU 170 1HD1 LEU 170 12.873 8.052 -7.013 1189 2HD1 LEU 170 2HD1 LEU 170 14.303 7.310 -6.290 1190 3HD1 LEU 170 3HD1 LEU 170 14.383 8.956 -6.906 1191 1HD2 LEU 170 1HD2 LEU 170 15.081 7.991 -4.089 1192 2HD2 LEU 170 2HD2 LEU 170 14.257 9.259 -3.189 1193 3HD2 LEU 170 3HD2 LEU 170 15.225 9.668 -4.610 1194 H ALA 171 H ALA 171 9.812 11.098 -5.003 1195 HA ALA 171 HA ALA 171 8.550 12.707 -5.789 1196 1HB ALA 171 1HB ALA 171 7.912 14.391 -4.229 1197 2HB ALA 171 2HB ALA 171 9.437 14.192 -3.335 1198 3HB ALA 171 3HB ALA 171 8.267 12.871 -3.397 1199 H GLU 172 H GLU 172 11.032 14.783 -4.446 1200 HA GLU 172 HA GLU 172 10.971 16.484 -6.774 1201 1HB GLU 172 2HB GLU 172 12.611 16.588 -4.244 1202 2HB GLU 172 1HB GLU 172 12.527 17.855 -5.463 1203 1HG GLU 172 2HG GLU 172 10.245 18.243 -5.016 1204 2HG GLU 172 1HG GLU 172 10.144 16.846 -3.943 1205 H GLU 173 H GLU 173 13.239 17.180 -7.511 1206 HA GLU 173 HA GLU 173 15.062 14.934 -7.624 1207 1HB GLU 173 2HB GLU 173 13.301 14.792 -9.492 1208 2HB GLU 173 1HB GLU 173 13.978 16.275 -10.123 1209 1HG GLU 173 2HG GLU 173 15.478 13.674 -9.829 1210 2HG GLU 173 1HG GLU 173 14.703 14.222 -11.301
Contact the webmaster for help, if required. Tuesday, May 21, 2024 10:25:57 AM GMT (wattos1)