NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
518324 | 2leq | 17723 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 -14.386 13.582 -22.945 2 H2 MET 1 2H MET 1 -12.957 14.485 -22.774 3 H3 MET 1 3H MET 1 -14.446 15.147 -22.295 4 HA MET 1 HA MET 1 -13.403 14.502 -20.309 5 HB2 MET 1 1HB MET 1 -15.342 12.357 -21.239 6 HB3 MET 1 2HB MET 1 -14.849 12.589 -19.562 7 HG2 MET 1 1HG MET 1 -16.929 13.756 -19.807 8 HG3 MET 1 2HG MET 1 -15.681 15.002 -19.787 9 HE1 MET 1 3HE MET 1 -16.598 16.899 -20.941 10 HE2 MET 1 1HE MET 1 -18.176 16.117 -20.764 11 HE3 MET 1 2HE MET 1 -17.719 16.849 -22.299 12 H GLU 2 H GLU 2 -12.262 12.825 -19.082 13 HA GLU 2 HA GLU 2 -11.219 10.483 -20.344 14 HB2 GLU 2 1HB GLU 2 -8.845 11.217 -20.431 15 HB3 GLU 2 2HB GLU 2 -9.865 12.091 -21.573 16 HG2 GLU 2 1HG GLU 2 -10.050 13.963 -19.957 17 HG3 GLU 2 2HG GLU 2 -8.987 13.097 -18.848 18 H ILE 3 H ILE 3 -8.850 10.202 -18.886 19 HA ILE 3 HA ILE 3 -9.765 9.316 -16.400 20 HB ILE 3 HB ILE 3 -7.336 9.241 -15.755 21 HG12 ILE 3 1HG1 ILE 3 -6.906 10.366 -18.546 22 HG13 ILE 3 2HG1 ILE 3 -6.720 11.314 -17.073 23 HG21 ILE 3 1HG2 ILE 3 -8.450 7.414 -17.035 24 HG22 ILE 3 2HG2 ILE 3 -6.738 7.566 -17.423 25 HG23 ILE 3 3HG2 ILE 3 -7.952 8.195 -18.536 26 HD11 ILE 3 3HD1 ILE 3 -4.541 10.483 -17.744 27 HD12 ILE 3 1HD1 ILE 3 -5.156 8.833 -17.821 28 HD13 ILE 3 2HD1 ILE 3 -5.038 9.659 -16.269 29 H LYS 4 H LYS 4 -9.666 10.128 -14.321 30 HA LYS 4 HA LYS 4 -9.832 13.020 -14.092 31 HB2 LYS 4 1HB LYS 4 -10.031 10.962 -11.886 32 HB3 LYS 4 2HB LYS 4 -10.635 12.617 -11.872 33 HG2 LYS 4 1HG LYS 4 -12.119 11.984 -13.842 34 HG3 LYS 4 2HG LYS 4 -11.614 10.318 -13.588 35 HD2 LYS 4 1HD LYS 4 -13.589 10.360 -12.324 36 HD3 LYS 4 2HD LYS 4 -12.405 10.757 -11.083 37 HE2 LYS 4 1HE LYS 4 -14.340 12.283 -10.984 38 HE3 LYS 4 2HE LYS 4 -12.881 13.170 -11.418 39 HZ1 LYS 4 3HZ LYS 4 -14.000 12.239 -13.776 40 HZ2 LYS 4 1HZ LYS 4 -13.921 13.843 -13.232 41 HZ3 LYS 4 2HZ LYS 4 -15.279 12.890 -12.866 42 H LEU 5 H LEU 5 -8.905 13.345 -11.472 43 HA LEU 5 HA LEU 5 -6.128 13.849 -11.933 44 HB2 LEU 5 1HB LEU 5 -7.994 14.192 -9.588 45 HB3 LEU 5 2HB LEU 5 -6.265 14.479 -9.396 46 HG LEU 5 HG LEU 5 -6.323 16.148 -11.202 47 HD11 LEU 5 1HD1 LEU 5 -8.071 15.364 -12.638 48 HD12 LEU 5 2HD1 LEU 5 -8.642 16.896 -11.992 49 HD13 LEU 5 3HD1 LEU 5 -9.255 15.379 -11.329 50 HD21 LEU 5 3HD2 LEU 5 -7.693 17.841 -10.021 51 HD22 LEU 5 1HD2 LEU 5 -6.731 16.884 -8.895 52 HD23 LEU 5 2HD2 LEU 5 -8.455 16.559 -9.080 53 H ILE 6 H ILE 6 -4.333 12.919 -11.052 54 HA ILE 6 HA ILE 6 -4.664 10.279 -9.717 55 HB ILE 6 HB ILE 6 -2.475 11.204 -11.593 56 HG12 ILE 6 1HG1 ILE 6 -4.579 9.050 -12.025 57 HG13 ILE 6 2HG1 ILE 6 -4.765 10.700 -12.615 58 HG21 ILE 6 1HG2 ILE 6 -2.959 8.594 -10.115 59 HG22 ILE 6 2HG2 ILE 6 -1.552 9.652 -9.987 60 HG23 ILE 6 3HG2 ILE 6 -1.836 8.744 -11.466 61 HD11 ILE 6 3HD1 ILE 6 -2.381 8.954 -13.295 62 HD12 ILE 6 1HD1 ILE 6 -2.811 10.508 -14.010 63 HD13 ILE 6 2HD1 ILE 6 -3.813 9.088 -14.310 64 H ALA 7 H ALA 7 -3.781 10.064 -7.771 65 HA ALA 7 HA ALA 7 -2.182 12.242 -6.633 66 HB1 ALA 7 3HB ALA 7 -2.912 9.698 -5.172 67 HB2 ALA 7 1HB ALA 7 -4.132 10.929 -5.479 68 HB3 ALA 7 2HB ALA 7 -2.700 11.326 -4.530 69 H GLN 8 H GLN 8 -0.035 12.151 -6.247 70 HA GLN 8 HA GLN 8 1.393 9.561 -6.364 71 HB2 GLN 8 1HB GLN 8 3.147 10.725 -7.841 72 HB3 GLN 8 2HB GLN 8 1.639 10.265 -8.626 73 HG2 GLN 8 1HG GLN 8 0.776 12.518 -8.436 74 HG3 GLN 8 2HG GLN 8 2.172 13.009 -7.487 75 HE21 GLN 8 2HE2 GLN 8 4.192 11.642 -9.068 76 HE22 GLN 8 1HE2 GLN 8 4.274 12.427 -10.568 77 H VAL 9 H VAL 9 3.087 9.431 -5.008 78 HA VAL 9 HA VAL 9 4.184 11.868 -3.736 79 HB VAL 9 HB VAL 9 4.039 10.751 -1.506 80 HG11 VAL 9 1HG1 VAL 9 1.380 11.128 -2.907 81 HG12 VAL 9 2HG1 VAL 9 2.370 12.427 -2.238 82 HG13 VAL 9 3HG1 VAL 9 1.658 11.218 -1.169 83 HG21 VAL 9 3HG2 VAL 9 2.435 8.865 -1.274 84 HG22 VAL 9 1HG2 VAL 9 3.821 8.425 -2.272 85 HG23 VAL 9 2HG2 VAL 9 2.273 8.805 -3.029 86 H LYS 10 H LYS 10 6.247 11.532 -2.727 87 HA LYS 10 HA LYS 10 7.613 8.991 -3.017 88 HB2 LYS 10 1HB LYS 10 9.391 9.933 -4.520 89 HB3 LYS 10 2HB LYS 10 7.821 9.727 -5.293 90 HG2 LYS 10 1HG LYS 10 7.318 12.090 -5.030 91 HG3 LYS 10 2HG LYS 10 8.787 12.336 -4.093 92 HD2 LYS 10 1HD LYS 10 9.200 13.093 -6.352 93 HD3 LYS 10 2HD LYS 10 10.130 11.624 -6.075 94 HE2 LYS 10 1HE LYS 10 8.654 10.310 -7.400 95 HE3 LYS 10 2HE LYS 10 7.377 11.529 -7.344 96 HZ1 LYS 10 3HZ LYS 10 8.237 12.555 -9.091 97 HZ2 LYS 10 1HZ LYS 10 9.264 11.223 -9.300 98 HZ3 LYS 10 2HZ LYS 10 9.799 12.572 -8.419 99 H THR 11 H THR 11 9.443 8.852 -1.762 100 HA THR 11 HA THR 11 10.579 11.274 -0.549 101 HB THR 11 HB THR 11 8.881 10.800 1.063 102 HG1 THR 11 HG1 THR 11 10.167 10.432 2.800 103 HG21 THR 11 3HG2 THR 11 8.312 8.524 0.307 104 HG22 THR 11 1HG2 THR 11 8.593 8.555 2.047 105 HG23 THR 11 2HG2 THR 11 9.834 7.921 0.965 106 H VAL 12 H VAL 12 12.664 11.050 0.145 107 HA VAL 12 HA VAL 12 14.127 8.738 -0.874 108 HB VAL 12 HB VAL 12 15.210 11.141 0.623 109 HG11 VAL 12 1HG1 VAL 12 16.760 9.235 0.405 110 HG12 VAL 12 2HG1 VAL 12 17.277 10.573 -0.620 111 HG13 VAL 12 3HG1 VAL 12 16.460 9.181 -1.333 112 HG21 VAL 12 3HG2 VAL 12 15.637 12.066 -1.654 113 HG22 VAL 12 1HG2 VAL 12 13.915 11.908 -1.307 114 HG23 VAL 12 2HG2 VAL 12 14.718 10.728 -2.344 115 H ILE 13 H ILE 13 14.232 6.960 0.327 116 HA ILE 13 HA ILE 13 14.552 7.197 3.285 117 HB ILE 13 HB ILE 13 13.477 4.825 1.738 118 HG12 ILE 13 1HG1 ILE 13 11.926 6.684 1.476 119 HG13 ILE 13 2HG1 ILE 13 11.257 5.538 2.630 120 HG21 ILE 13 1HG2 ILE 13 13.556 5.533 4.689 121 HG22 ILE 13 2HG2 ILE 13 14.428 4.224 3.896 122 HG23 ILE 13 3HG2 ILE 13 12.671 4.164 4.016 123 HD11 ILE 13 3HD1 ILE 13 12.392 8.278 3.124 124 HD12 ILE 13 1HD1 ILE 13 12.411 7.095 4.425 125 HD13 ILE 13 2HD1 ILE 13 10.886 7.577 3.705 126 H ASN 14 H ASN 14 16.355 6.460 4.155 127 HA ASN 14 HA ASN 14 18.337 5.098 2.444 128 HB2 ASN 14 1HB ASN 14 18.535 6.374 5.183 129 HB3 ASN 14 2HB ASN 14 19.874 5.571 4.364 130 HD21 ASN 14 2HD2 ASN 14 19.472 8.526 5.050 131 HD22 ASN 14 1HD2 ASN 14 19.663 9.330 3.569 132 H ALA 15 H ALA 15 17.644 2.980 2.356 133 HA ALA 15 HA ALA 15 18.298 1.335 4.603 134 HB1 ALA 15 3HB ALA 15 15.734 0.377 4.480 135 HB2 ALA 15 1HB ALA 15 15.451 2.082 4.140 136 HB3 ALA 15 2HB ALA 15 16.249 1.607 5.633 137 HA PRO 16 HA PRO 16 18.901 -1.594 1.358 138 HB2 PRO 16 1HB PRO 16 18.234 -4.002 2.589 139 HB3 PRO 16 2HB PRO 16 19.762 -3.140 2.853 140 HG2 PRO 16 1HG PRO 16 17.273 -3.125 4.525 141 HG3 PRO 16 2HG PRO 16 18.971 -3.220 5.038 142 HD2 PRO 16 1HD PRO 16 17.609 -0.889 5.179 143 HD3 PRO 16 2HD PRO 16 19.329 -0.910 4.735 144 H ILE 17 H ILE 17 17.828 -2.608 -0.293 145 HA ILE 17 HA ILE 17 15.089 -2.079 -0.699 146 HB ILE 17 HB ILE 17 16.815 -2.358 -2.489 147 HG12 ILE 17 1HG1 ILE 17 15.350 -3.674 -4.047 148 HG13 ILE 17 2HG1 ILE 17 14.376 -4.171 -2.674 149 HG21 ILE 17 1HG2 ILE 17 17.569 -4.540 -3.156 150 HG22 ILE 17 2HG2 ILE 17 16.493 -5.335 -2.010 151 HG23 ILE 17 3HG2 ILE 17 17.869 -4.399 -1.424 152 HD11 ILE 17 3HD1 ILE 17 13.715 -2.064 -4.157 153 HD12 ILE 17 1HD1 ILE 17 14.821 -1.223 -3.073 154 HD13 ILE 17 2HD1 ILE 17 13.421 -2.076 -2.421 155 H GLU 18 H GLU 18 16.789 -5.004 0.360 156 HA GLU 18 HA GLU 18 14.773 -6.890 0.116 157 HB2 GLU 18 1HB GLU 18 16.816 -6.630 2.337 158 HB3 GLU 18 2HB GLU 18 15.918 -8.092 1.933 159 HG2 GLU 18 1HG GLU 18 17.734 -6.634 -0.006 160 HG3 GLU 18 2HG GLU 18 18.229 -8.027 0.950 161 H LYS 19 H LYS 19 15.547 -5.002 3.022 162 HA LYS 19 HA LYS 19 13.341 -5.922 4.520 163 HB2 LYS 19 1HB LYS 19 15.413 -4.951 5.447 164 HB3 LYS 19 2HB LYS 19 14.886 -3.359 4.917 165 HG2 LYS 19 1HG LYS 19 12.850 -3.566 6.297 166 HG3 LYS 19 2HG LYS 19 13.360 -5.167 6.822 167 HD2 LYS 19 1HD LYS 19 14.973 -2.637 7.283 168 HD3 LYS 19 2HD LYS 19 13.875 -3.332 8.472 169 HE2 LYS 19 1HE LYS 19 15.252 -5.512 8.217 170 HE3 LYS 19 2HE LYS 19 16.455 -4.510 7.405 171 HZ1 LYS 19 3HZ LYS 19 16.657 -3.141 9.319 172 HZ2 LYS 19 1HZ LYS 19 16.827 -4.754 9.815 173 HZ3 LYS 19 2HZ LYS 19 15.370 -3.930 10.102 174 H VAL 20 H VAL 20 13.738 -2.983 2.544 175 HA VAL 20 HA VAL 20 11.219 -1.854 3.260 176 HB VAL 20 HB VAL 20 12.881 -1.464 0.751 177 HG11 VAL 20 1HG1 VAL 20 10.493 0.054 1.850 178 HG12 VAL 20 2HG1 VAL 20 10.605 -0.761 0.290 179 HG13 VAL 20 3HG1 VAL 20 11.557 0.688 0.596 180 HG21 VAL 20 3HG2 VAL 20 12.604 0.242 3.246 181 HG22 VAL 20 1HG2 VAL 20 13.679 0.545 1.881 182 HG23 VAL 20 2HG2 VAL 20 13.958 -0.844 2.932 183 H TRP 21 H TRP 21 12.277 -3.828 0.510 184 HA TRP 21 HA TRP 21 9.826 -4.086 -0.825 185 HB2 TRP 21 1HB TRP 21 12.068 -4.775 -1.704 186 HB3 TRP 21 2HB TRP 21 12.061 -6.131 -0.582 187 HD1 TRP 21 HD1 TRP 21 10.499 -8.176 -1.122 188 HE1 TRP 21 HE1 TRP 21 9.239 -8.897 -3.254 189 HE3 TRP 21 HE3 TRP 21 10.786 -3.854 -3.822 190 HZ2 TRP 21 HZ2 TRP 21 8.451 -7.783 -5.771 191 HZ3 TRP 21 HZ3 TRP 21 9.775 -3.710 -6.081 192 HH2 TRP 21 HH2 TRP 21 8.614 -5.669 -7.061 193 H GLU 22 H GLU 22 11.289 -5.979 1.792 194 HA GLU 22 HA GLU 22 9.361 -8.007 2.023 195 HB2 GLU 22 1HB GLU 22 11.607 -7.931 3.170 196 HB3 GLU 22 2HB GLU 22 10.939 -6.742 4.285 197 HG2 GLU 22 1HG GLU 22 10.740 -8.876 5.365 198 HG3 GLU 22 2HG GLU 22 9.118 -8.444 4.839 199 H ALA 23 H ALA 23 9.597 -4.850 3.657 200 HA ALA 23 HA ALA 23 7.348 -5.080 5.299 201 HB1 ALA 23 3HB ALA 23 8.408 -2.554 4.028 202 HB2 ALA 23 1HB ALA 23 9.095 -3.315 5.464 203 HB3 ALA 23 2HB ALA 23 7.451 -2.677 5.504 204 H LEU 24 H LEU 24 7.582 -4.327 1.894 205 HA LEU 24 HA LEU 24 4.958 -3.225 1.649 206 HB2 LEU 24 1HB LEU 24 6.712 -2.707 0.024 207 HB3 LEU 24 2HB LEU 24 6.791 -4.400 -0.452 208 HG LEU 24 HG LEU 24 4.472 -4.299 -1.271 209 HD11 LEU 24 1HD1 LEU 24 4.570 -1.509 -0.119 210 HD12 LEU 24 2HD1 LEU 24 3.323 -2.746 0.069 211 HD13 LEU 24 3HD1 LEU 24 3.481 -1.890 -1.450 212 HD21 LEU 24 3HD2 LEU 24 4.863 -2.775 -3.175 213 HD22 LEU 24 1HD2 LEU 24 6.308 -3.715 -2.801 214 HD23 LEU 24 2HD2 LEU 24 6.199 -2.034 -2.296 215 H VAL 25 H VAL 25 6.323 -6.443 1.063 216 HA VAL 25 HA VAL 25 3.557 -7.543 0.823 217 HB VAL 25 HB VAL 25 4.751 -9.444 -0.457 218 HG11 VAL 25 1HG1 VAL 25 3.305 -7.819 -1.576 219 HG12 VAL 25 2HG1 VAL 25 4.724 -8.145 -2.571 220 HG13 VAL 25 3HG1 VAL 25 4.630 -6.658 -1.635 221 HG21 VAL 25 3HG2 VAL 25 6.857 -7.269 -0.730 222 HG22 VAL 25 1HG2 VAL 25 6.862 -8.837 -1.533 223 HG23 VAL 25 2HG2 VAL 25 7.066 -8.740 0.213 224 H ASN 26 H ASN 26 3.568 -7.676 3.148 225 HA ASN 26 HA ASN 26 4.456 -10.282 3.974 226 HB2 ASN 26 1HB ASN 26 6.455 -8.882 4.334 227 HB3 ASN 26 2HB ASN 26 5.535 -7.919 5.480 228 HD21 ASN 26 2HD2 ASN 26 4.129 -10.680 6.168 229 HD22 ASN 26 1HD2 ASN 26 5.228 -11.380 7.247 230 HA PRO 27 HA PRO 27 0.548 -9.207 6.050 231 HB2 PRO 27 1HB PRO 27 -0.120 -11.734 6.911 232 HB3 PRO 27 2HB PRO 27 -0.366 -11.180 5.247 233 HG2 PRO 27 1HG PRO 27 1.834 -12.862 6.369 234 HG3 PRO 27 2HG PRO 27 0.958 -13.033 4.834 235 HD2 PRO 27 1HD PRO 27 3.442 -11.916 4.997 236 HD3 PRO 27 2HD PRO 27 2.269 -11.426 3.754 237 H GLU 28 H GLU 28 3.397 -10.546 7.402 238 HA GLU 28 HA GLU 28 2.450 -10.519 10.159 239 HB2 GLU 28 1HB GLU 28 4.179 -12.140 9.300 240 HB3 GLU 28 2HB GLU 28 5.294 -10.784 9.159 241 HG2 GLU 28 1HG GLU 28 5.720 -11.818 11.289 242 HG3 GLU 28 2HG GLU 28 4.881 -10.311 11.623 243 H ILE 29 H ILE 29 4.774 -8.640 8.213 244 HA ILE 29 HA ILE 29 5.261 -6.710 10.267 245 HB ILE 29 HB ILE 29 5.666 -6.427 7.283 246 HG12 ILE 29 1HG1 ILE 29 7.675 -7.262 9.401 247 HG13 ILE 29 2HG1 ILE 29 6.822 -8.413 8.379 248 HG21 ILE 29 1HG2 ILE 29 5.742 -4.286 8.406 249 HG22 ILE 29 2HG2 ILE 29 7.389 -4.757 8.007 250 HG23 ILE 29 3HG2 ILE 29 6.796 -4.932 9.661 251 HD11 ILE 29 3HD1 ILE 29 8.681 -6.210 7.448 252 HD12 ILE 29 1HD1 ILE 29 7.730 -7.230 6.368 253 HD13 ILE 29 2HD1 ILE 29 8.985 -7.946 7.380 254 H ILE 30 H ILE 30 3.114 -6.881 7.463 255 HA ILE 30 HA ILE 30 2.060 -4.281 7.638 256 HB ILE 30 HB ILE 30 0.876 -6.871 6.601 257 HG12 ILE 30 1HG1 ILE 30 2.925 -5.644 5.494 258 HG13 ILE 30 2HG1 ILE 30 1.608 -6.193 4.469 259 HG21 ILE 30 1HG2 ILE 30 -0.755 -5.262 5.380 260 HG22 ILE 30 2HG2 ILE 30 -0.298 -4.074 6.603 261 HG23 ILE 30 3HG2 ILE 30 -1.066 -5.584 7.087 262 HD11 ILE 30 3HD1 ILE 30 2.515 -3.776 4.137 263 HD12 ILE 30 1HD1 ILE 30 1.584 -3.380 5.576 264 HD13 ILE 30 2HD1 ILE 30 0.771 -4.021 4.156 265 H LYS 31 H LYS 31 1.507 -7.132 9.526 266 HA LYS 31 HA LYS 31 -0.954 -6.227 10.728 267 HB2 LYS 31 1HB LYS 31 -0.381 -8.628 10.497 268 HB3 LYS 31 2HB LYS 31 0.948 -8.403 11.631 269 HG2 LYS 31 1HG LYS 31 -0.602 -7.753 13.390 270 HG3 LYS 31 2HG LYS 31 -1.957 -7.800 12.258 271 HD2 LYS 31 1HD LYS 31 -1.566 -10.211 11.894 272 HD3 LYS 31 2HD LYS 31 -0.231 -10.167 13.046 273 HE2 LYS 31 1HE LYS 31 -3.121 -9.493 13.672 274 HE3 LYS 31 2HE LYS 31 -2.300 -10.992 14.110 275 HZ1 LYS 31 3HZ LYS 31 -0.602 -9.234 15.109 276 HZ2 LYS 31 1HZ LYS 31 -1.912 -9.846 15.995 277 HZ3 LYS 31 2HZ LYS 31 -2.032 -8.326 15.244 278 H GLU 32 H GLU 32 2.477 -5.980 11.420 279 HA GLU 32 HA GLU 32 2.392 -5.278 14.129 280 HB2 GLU 32 1HB GLU 32 4.281 -4.321 11.960 281 HB3 GLU 32 2HB GLU 32 4.518 -4.023 13.672 282 HG2 GLU 32 1HG GLU 32 4.608 -6.414 14.124 283 HG3 GLU 32 2HG GLU 32 4.251 -6.774 12.440 284 H TYR 33 H TYR 33 2.025 -3.249 11.231 285 HA TYR 33 HA TYR 33 1.742 -0.782 12.645 286 HB2 TYR 33 1HB TYR 33 0.966 -1.650 9.846 287 HB3 TYR 33 2HB TYR 33 0.735 -0.003 10.430 288 HD1 TYR 33 HD2 TYR 33 2.671 1.428 10.988 289 HD2 TYR 33 HD1 TYR 33 3.202 -2.515 9.364 290 HE1 TYR 33 HE2 TYR 33 5.030 1.965 10.449 291 HE2 TYR 33 HE1 TYR 33 5.560 -1.967 8.826 292 HH TYR 33 HH TYR 33 7.275 -0.474 9.410 293 H MET 34 H MET 34 -0.505 -3.278 11.583 294 HA MET 34 HA MET 34 -2.853 -1.709 12.360 295 HB2 MET 34 1HB MET 34 -2.569 -4.523 11.279 296 HB3 MET 34 2HB MET 34 -4.099 -3.697 11.575 297 HG2 MET 34 1HG MET 34 -1.938 -2.592 9.755 298 HG3 MET 34 2HG MET 34 -3.279 -3.581 9.182 299 HE1 MET 34 3HE MET 34 -5.414 -0.817 8.045 300 HE2 MET 34 1HE MET 34 -5.369 -2.568 8.297 301 HE3 MET 34 2HE MET 34 -4.009 -1.748 7.535 302 H PHE 35 H PHE 35 -4.321 -2.346 13.945 303 HA PHE 35 HA PHE 35 -3.220 -3.170 16.396 304 HB2 PHE 35 1HB PHE 35 -6.113 -3.055 15.514 305 HB3 PHE 35 2HB PHE 35 -5.571 -3.235 17.181 306 HD1 PHE 35 HD2 PHE 35 -4.268 -1.419 18.295 307 HD2 PHE 35 HD1 PHE 35 -5.977 -0.911 14.384 308 HE1 PHE 35 HE2 PHE 35 -3.969 1.036 18.480 309 HE2 PHE 35 HE1 PHE 35 -5.677 1.543 14.573 310 HZ PHE 35 HZ PHE 35 -4.674 2.516 16.620 311 H GLY 36 H GLY 36 -5.113 -4.999 13.997 312 HA2 GLY 36 1HA GLY 36 -3.975 -7.483 14.801 313 HA3 GLY 36 2HA GLY 36 -5.593 -7.314 15.469 314 H THR 37 H THR 37 -4.499 -6.092 12.332 315 HA THR 37 HA THR 37 -6.731 -7.322 10.987 316 HB THR 37 HB THR 37 -4.307 -5.997 9.749 317 HG1 THR 37 HG1 THR 37 -6.760 -4.723 10.104 318 HG21 THR 37 3HG2 THR 37 -5.955 -5.536 7.913 319 HG22 THR 37 1HG2 THR 37 -7.112 -6.571 8.750 320 HG23 THR 37 2HG2 THR 37 -5.608 -7.251 8.129 321 H THR 38 H THR 38 -6.840 -9.245 10.031 322 HA THR 38 HA THR 38 -4.432 -10.945 9.948 323 HB THR 38 HB THR 38 -7.303 -11.716 9.363 324 HG1 THR 38 HG1 THR 38 -7.453 -11.234 11.421 325 HG21 THR 38 3HG2 THR 38 -5.630 -13.293 8.526 326 HG22 THR 38 1HG2 THR 38 -6.448 -13.981 9.926 327 HG23 THR 38 2HG2 THR 38 -4.827 -13.309 10.097 328 H VAL 39 H VAL 39 -3.334 -10.187 8.142 329 HA VAL 39 HA VAL 39 -4.698 -10.100 5.536 330 HB VAL 39 HB VAL 39 -1.829 -9.484 6.299 331 HG11 VAL 39 1HG1 VAL 39 -1.853 -8.300 4.068 332 HG12 VAL 39 2HG1 VAL 39 -3.400 -9.069 3.740 333 HG13 VAL 39 3HG1 VAL 39 -1.962 -10.051 3.943 334 HG21 VAL 39 3HG2 VAL 39 -2.594 -7.114 5.994 335 HG22 VAL 39 1HG2 VAL 39 -3.368 -7.921 7.358 336 HG23 VAL 39 2HG2 VAL 39 -4.248 -7.707 5.844 337 H VAL 40 H VAL 40 -4.627 -11.716 4.123 338 HA VAL 40 HA VAL 40 -2.624 -13.902 4.480 339 HB VAL 40 HB VAL 40 -5.461 -14.137 3.449 340 HG11 VAL 40 1HG1 VAL 40 -4.949 -16.597 3.676 341 HG12 VAL 40 2HG1 VAL 40 -3.265 -16.166 3.972 342 HG13 VAL 40 3HG1 VAL 40 -4.011 -15.792 2.419 343 HG21 VAL 40 3HG2 VAL 40 -5.877 -15.338 5.562 344 HG22 VAL 40 1HG2 VAL 40 -5.340 -13.690 5.888 345 HG23 VAL 40 2HG2 VAL 40 -4.215 -15.036 6.071 346 H SER 41 H SER 41 -1.344 -14.274 2.809 347 HA SER 41 HA SER 41 -2.211 -13.798 0.059 348 HB2 SER 41 1HB SER 41 -0.231 -12.336 -0.429 349 HB3 SER 41 2HB SER 41 -1.437 -11.577 0.609 350 HG SER 41 HG SER 41 0.280 -11.260 1.814 351 H ASP 42 H ASP 42 -0.752 -14.609 -1.499 352 HA ASP 42 HA ASP 42 0.925 -16.845 -0.547 353 HB2 ASP 42 1HB ASP 42 -0.233 -16.130 -3.255 354 HB3 ASP 42 2HB ASP 42 0.839 -17.499 -2.978 355 H TRP 43 H TRP 43 1.063 -13.699 -1.842 356 HA TRP 43 HA TRP 43 2.772 -12.276 -2.372 357 HB2 TRP 43 1HB TRP 43 4.779 -14.401 -1.603 358 HB3 TRP 43 2HB TRP 43 4.940 -12.649 -1.507 359 HD1 TRP 43 HD1 TRP 43 2.221 -11.989 -0.015 360 HE1 TRP 43 HE1 TRP 43 1.951 -12.647 2.463 361 HE3 TRP 43 HE3 TRP 43 5.786 -15.624 0.326 362 HZ2 TRP 43 HZ2 TRP 43 3.106 -14.471 4.348 363 HZ3 TRP 43 HZ3 TRP 43 6.183 -16.804 2.468 364 HH2 TRP 43 HH2 TRP 43 4.849 -16.233 4.478 365 H LYS 44 H LYS 44 1.677 -13.699 -4.485 366 HA LYS 44 HA LYS 44 3.934 -13.727 -6.355 367 HB2 LYS 44 1HB LYS 44 3.378 -15.928 -7.275 368 HB3 LYS 44 2HB LYS 44 3.830 -16.040 -5.577 369 HG2 LYS 44 1HG LYS 44 1.496 -16.203 -4.912 370 HG3 LYS 44 2HG LYS 44 0.966 -15.940 -6.568 371 HD2 LYS 44 1HD LYS 44 0.868 -18.313 -6.111 372 HD3 LYS 44 2HD LYS 44 2.168 -18.007 -7.258 373 HE2 LYS 44 1HE LYS 44 3.849 -18.380 -5.625 374 HE3 LYS 44 2HE LYS 44 2.730 -18.147 -4.283 375 HZ1 LYS 44 3HZ LYS 44 2.589 -20.354 -4.279 376 HZ2 LYS 44 1HZ LYS 44 3.291 -20.506 -5.817 377 HZ3 LYS 44 2HZ LYS 44 1.628 -20.192 -5.673 378 H GLU 45 H GLU 45 3.281 -13.681 -8.588 379 HA GLU 45 HA GLU 45 1.305 -11.841 -9.185 380 HB2 GLU 45 1HB GLU 45 3.172 -12.434 -10.692 381 HB3 GLU 45 2HB GLU 45 2.391 -13.977 -11.036 382 HG2 GLU 45 1HG GLU 45 0.465 -12.838 -12.004 383 HG3 GLU 45 2HG GLU 45 1.121 -11.269 -11.540 384 H GLY 46 H GLY 46 -0.804 -11.876 -9.459 385 HA2 GLY 46 1HA GLY 46 -2.933 -12.633 -10.015 386 HA3 GLY 46 2HA GLY 46 -2.270 -14.234 -10.316 387 H SER 47 H SER 47 -1.176 -13.212 -7.331 388 HA SER 47 HA SER 47 -2.815 -15.104 -5.936 389 HB2 SER 47 1HB SER 47 -0.555 -14.734 -5.187 390 HB3 SER 47 2HB SER 47 -0.867 -13.017 -4.940 391 HG SER 47 HG SER 47 -2.181 -15.162 -3.613 392 H GLN 48 H GLN 48 -4.610 -14.839 -4.788 393 HA GLN 48 HA GLN 48 -6.000 -12.281 -4.863 394 HB2 GLN 48 1HB GLN 48 -7.224 -14.419 -5.187 395 HB3 GLN 48 2HB GLN 48 -6.811 -14.886 -3.538 396 HG2 GLN 48 1HG GLN 48 -8.036 -12.987 -2.636 397 HG3 GLN 48 2HG GLN 48 -8.334 -12.363 -4.257 398 HE21 GLN 48 2HE2 GLN 48 -10.471 -13.001 -2.431 399 HE22 GLN 48 1HE2 GLN 48 -11.332 -14.313 -3.077 400 H ILE 49 H ILE 49 -6.582 -11.066 -3.026 401 HA ILE 49 HA ILE 49 -5.240 -11.765 -0.470 402 HB ILE 49 HB ILE 49 -3.836 -10.138 -1.724 403 HG12 ILE 49 1HG1 ILE 49 -5.148 -8.912 0.728 404 HG13 ILE 49 2HG1 ILE 49 -3.972 -10.223 0.806 405 HG21 ILE 49 1HG2 ILE 49 -6.127 -8.195 -1.306 406 HG22 ILE 49 2HG2 ILE 49 -5.802 -8.993 -2.844 407 HG23 ILE 49 3HG2 ILE 49 -4.608 -7.899 -2.148 408 HD11 ILE 49 3HD1 ILE 49 -3.513 -7.455 -0.339 409 HD12 ILE 49 1HD1 ILE 49 -2.350 -8.776 -0.439 410 HD13 ILE 49 2HD1 ILE 49 -2.802 -8.119 1.131 411 H VAL 50 H VAL 50 -6.405 -11.468 1.286 412 HA VAL 50 HA VAL 50 -8.832 -9.768 1.191 413 HB VAL 50 HB VAL 50 -8.725 -12.589 2.300 414 HG11 VAL 50 1HG1 VAL 50 -11.210 -12.162 2.587 415 HG12 VAL 50 2HG1 VAL 50 -10.892 -10.466 2.225 416 HG13 VAL 50 3HG1 VAL 50 -10.185 -11.209 3.659 417 HG21 VAL 50 3HG2 VAL 50 -10.312 -13.103 0.500 418 HG22 VAL 50 1HG2 VAL 50 -8.829 -12.453 -0.195 419 HG23 VAL 50 2HG2 VAL 50 -10.258 -11.430 -0.054 420 H TRP 51 H TRP 51 -9.276 -8.669 2.998 421 HA TRP 51 HA TRP 51 -7.465 -9.002 5.345 422 HB2 TRP 51 1HB TRP 51 -8.780 -6.443 4.401 423 HB3 TRP 51 2HB TRP 51 -7.614 -6.621 5.708 424 HD1 TRP 51 HD1 TRP 51 -5.702 -8.650 3.909 425 HE1 TRP 51 HE1 TRP 51 -4.176 -7.552 2.164 426 HE3 TRP 51 HE3 TRP 51 -8.074 -4.172 3.365 427 HZ2 TRP 51 HZ2 TRP 51 -3.973 -5.100 0.723 428 HZ3 TRP 51 HZ3 TRP 51 -7.195 -2.470 1.796 429 HH2 TRP 51 HH2 TRP 51 -5.147 -2.926 0.473 430 H LYS 52 H LYS 52 -8.399 -9.358 7.240 431 HA LYS 52 HA LYS 52 -11.358 -9.242 7.414 432 HB2 LYS 52 1HB LYS 52 -9.384 -10.543 9.297 433 HB3 LYS 52 2HB LYS 52 -11.136 -10.700 9.337 434 HG2 LYS 52 1HG LYS 52 -9.391 -11.568 7.007 435 HG3 LYS 52 2HG LYS 52 -9.988 -12.652 8.261 436 HD2 LYS 52 1HD LYS 52 -12.356 -11.814 7.610 437 HD3 LYS 52 2HD LYS 52 -11.592 -11.154 6.165 438 HE2 LYS 52 1HE LYS 52 -12.416 -13.337 5.592 439 HE3 LYS 52 2HE LYS 52 -10.661 -13.460 5.710 440 HZ1 LYS 52 3HZ LYS 52 -12.137 -15.193 6.894 441 HZ2 LYS 52 1HZ LYS 52 -12.334 -13.987 8.070 442 HZ3 LYS 52 2HZ LYS 52 -10.780 -14.569 7.703 443 H GLY 53 H GLY 53 -12.399 -8.002 8.863 444 HA2 GLY 53 1HA GLY 53 -11.111 -6.682 11.056 445 HA3 GLY 53 2HA GLY 53 -11.360 -5.590 9.700 446 H GLU 54 H GLU 54 -12.621 -4.779 11.792 447 HA GLU 54 HA GLU 54 -15.466 -5.551 11.416 448 HB2 GLU 54 1HB GLU 54 -14.540 -6.429 13.561 449 HB3 GLU 54 2HB GLU 54 -14.175 -4.771 14.039 450 HG2 GLU 54 1HG GLU 54 -16.556 -4.179 13.865 451 HG3 GLU 54 2HG GLU 54 -16.933 -5.815 13.328 452 H TRP 55 H TRP 55 -16.818 -3.928 11.074 453 HA TRP 55 HA TRP 55 -15.974 -1.136 11.628 454 HB2 TRP 55 1HB TRP 55 -15.524 -1.751 9.239 455 HB3 TRP 55 2HB TRP 55 -17.243 -2.076 9.042 456 HD1 TRP 55 HD1 TRP 55 -18.620 -0.095 8.226 457 HE1 TRP 55 HE1 TRP 55 -18.334 2.466 8.177 458 HE3 TRP 55 HE3 TRP 55 -14.214 0.366 10.788 459 HZ2 TRP 55 HZ2 TRP 55 -16.492 4.445 9.092 460 HZ3 TRP 55 HZ3 TRP 55 -13.223 2.604 11.179 461 HH2 TRP 55 HH2 TRP 55 -14.355 4.642 10.335 462 H LYS 56 H LYS 56 -17.420 -0.298 12.936 463 HA LYS 56 HA LYS 56 -19.420 0.156 14.008 464 HB2 LYS 56 1HB LYS 56 -20.651 -0.331 11.287 465 HB3 LYS 56 2HB LYS 56 -21.264 0.708 12.571 466 HG2 LYS 56 1HG LYS 56 -18.647 1.149 11.094 467 HG3 LYS 56 2HG LYS 56 -20.149 1.998 10.751 468 HD2 LYS 56 1HD LYS 56 -20.152 2.798 13.145 469 HD3 LYS 56 2HD LYS 56 -18.545 2.096 13.322 470 HE2 LYS 56 1HE LYS 56 -17.657 3.517 11.576 471 HE3 LYS 56 2HE LYS 56 -19.264 4.177 11.253 472 HZ1 LYS 56 3HZ LYS 56 -18.778 4.411 13.987 473 HZ2 LYS 56 1HZ LYS 56 -18.923 5.656 12.845 474 HZ3 LYS 56 2HZ LYS 56 -17.397 4.992 13.186 475 H GLY 57 H GLY 57 -18.552 -2.486 14.231 476 HA2 GLY 57 1HA GLY 57 -19.378 -4.432 15.187 477 HA3 GLY 57 2HA GLY 57 -21.001 -3.765 15.051 478 H LYS 58 H LYS 58 -19.933 -3.342 12.070 479 HA LYS 58 HA LYS 58 -21.079 -5.891 11.098 480 HB2 LYS 58 1HB LYS 58 -22.015 -3.712 10.300 481 HB3 LYS 58 2HB LYS 58 -20.456 -3.359 9.559 482 HG2 LYS 58 1HG LYS 58 -20.637 -5.362 8.154 483 HG3 LYS 58 2HG LYS 58 -22.165 -5.783 8.930 484 HD2 LYS 58 1HD LYS 58 -23.163 -3.681 8.116 485 HD3 LYS 58 2HD LYS 58 -21.635 -3.250 7.347 486 HE2 LYS 58 1HE LYS 58 -23.156 -4.231 5.693 487 HE3 LYS 58 2HE LYS 58 -21.779 -5.301 5.955 488 HZ1 LYS 58 3HZ LYS 58 -23.900 -5.834 7.782 489 HZ2 LYS 58 1HZ LYS 58 -23.105 -6.888 6.719 490 HZ3 LYS 58 2HZ LYS 58 -24.425 -5.969 6.172 491 H ALA 59 H ALA 59 -19.685 -7.442 10.634 492 HA ALA 59 HA ALA 59 -16.890 -7.031 10.231 493 HB1 ALA 59 3HB ALA 59 -17.731 -9.112 11.173 494 HB2 ALA 59 1HB ALA 59 -16.866 -9.448 9.673 495 HB3 ALA 59 2HB ALA 59 -18.631 -9.446 9.694 496 H TYR 60 H TYR 60 -15.757 -6.715 8.401 497 HA TYR 60 HA TYR 60 -17.085 -7.125 5.775 498 HB2 TYR 60 1HB TYR 60 -16.438 -4.970 4.990 499 HB3 TYR 60 2HB TYR 60 -17.220 -4.712 6.547 500 HD1 TYR 60 HD2 TYR 60 -15.697 -4.612 8.656 501 HD2 TYR 60 HD1 TYR 60 -14.228 -4.157 4.640 502 HE1 TYR 60 HE2 TYR 60 -13.638 -3.531 9.523 503 HE2 TYR 60 HE1 TYR 60 -12.182 -3.078 5.509 504 HH TYR 60 HH TYR 60 -11.306 -3.157 8.785 505 H GLU 61 H GLU 61 -15.674 -7.419 4.018 506 HA GLU 61 HA GLU 61 -12.820 -7.845 4.646 507 HB2 GLU 61 1HB GLU 61 -12.836 -10.008 3.518 508 HB3 GLU 61 2HB GLU 61 -13.938 -10.026 4.892 509 HG2 GLU 61 1HG GLU 61 -15.813 -9.492 3.280 510 HG3 GLU 61 2HG GLU 61 -14.666 -9.732 1.963 511 H ASP 62 H ASP 62 -11.504 -7.140 3.135 512 HA ASP 62 HA ASP 62 -12.591 -5.917 0.709 513 HB2 ASP 62 1HB ASP 62 -9.804 -5.927 1.896 514 HB3 ASP 62 2HB ASP 62 -10.295 -5.013 0.471 515 H LYS 63 H LYS 63 -11.285 -6.284 -1.370 516 HA LYS 63 HA LYS 63 -9.973 -8.878 -1.577 517 HB2 LYS 63 1HB LYS 63 -11.601 -9.713 -3.294 518 HB3 LYS 63 2HB LYS 63 -12.242 -9.622 -1.655 519 HG2 LYS 63 1HG LYS 63 -13.363 -7.510 -2.165 520 HG3 LYS 63 2HG LYS 63 -12.651 -7.490 -3.770 521 HD2 LYS 63 1HD LYS 63 -14.898 -8.307 -4.009 522 HD3 LYS 63 2HD LYS 63 -13.809 -9.669 -4.253 523 HE2 LYS 63 1HE LYS 63 -14.313 -10.593 -2.118 524 HE3 LYS 63 2HE LYS 63 -15.011 -9.083 -1.529 525 HZ1 LYS 63 3HZ LYS 63 -16.952 -9.916 -2.150 526 HZ2 LYS 63 1HZ LYS 63 -16.234 -11.197 -2.998 527 HZ3 LYS 63 2HZ LYS 63 -16.460 -9.698 -3.762 528 H GLY 64 H GLY 64 -8.533 -8.952 -3.133 529 HA2 GLY 64 1HA GLY 64 -8.776 -7.491 -5.612 530 HA3 GLY 64 2HA GLY 64 -7.540 -6.846 -4.533 531 H THR 65 H THR 65 -6.377 -7.610 -6.666 532 HA THR 65 HA THR 65 -5.073 -10.169 -6.003 533 HB THR 65 HB THR 65 -6.239 -9.617 -8.745 534 HG1 THR 65 HG1 THR 65 -7.615 -11.312 -8.218 535 HG21 THR 65 3HG2 THR 65 -4.582 -11.884 -7.607 536 HG22 THR 65 1HG2 THR 65 -4.210 -10.868 -9.000 537 HG23 THR 65 2HG2 THR 65 -5.525 -12.038 -9.088 538 H ILE 66 H ILE 66 -3.048 -10.474 -7.035 539 HA ILE 66 HA ILE 66 -1.549 -8.028 -7.327 540 HB ILE 66 HB ILE 66 -0.670 -10.858 -7.944 541 HG12 ILE 66 1HG1 ILE 66 -1.533 -10.761 -5.670 542 HG13 ILE 66 2HG1 ILE 66 0.217 -10.864 -5.625 543 HG21 ILE 66 1HG2 ILE 66 0.847 -8.317 -7.304 544 HG22 ILE 66 2HG2 ILE 66 0.870 -9.213 -8.825 545 HG23 ILE 66 3HG2 ILE 66 1.579 -9.919 -7.373 546 HD11 ILE 66 3HD1 ILE 66 0.084 -8.220 -5.498 547 HD12 ILE 66 1HD1 ILE 66 -0.203 -9.188 -4.057 548 HD13 ILE 66 2HD1 ILE 66 -1.563 -8.533 -4.964 549 H LEU 67 H LEU 67 -1.575 -6.843 -9.107 550 HA LEU 67 HA LEU 67 -2.474 -7.766 -11.635 551 HB2 LEU 67 1HB LEU 67 -2.692 -5.421 -11.030 552 HB3 LEU 67 2HB LEU 67 -0.947 -5.265 -10.864 553 HG LEU 67 HG LEU 67 -0.648 -5.681 -13.269 554 HD11 LEU 67 1HD1 LEU 67 -2.353 -7.176 -13.910 555 HD12 LEU 67 2HD1 LEU 67 -2.860 -5.673 -14.667 556 HD13 LEU 67 3HD1 LEU 67 -3.626 -6.204 -13.169 557 HD21 LEU 67 3HD2 LEU 67 -1.091 -3.370 -12.487 558 HD22 LEU 67 1HD2 LEU 67 -2.812 -3.621 -12.765 559 HD23 LEU 67 2HD2 LEU 67 -1.689 -3.637 -14.122 560 H GLN 68 H GLN 68 0.727 -7.178 -10.265 561 HA GLN 68 HA GLN 68 1.959 -9.069 -12.082 562 HB2 GLN 68 1HB GLN 68 1.916 -7.010 -13.470 563 HB3 GLN 68 2HB GLN 68 2.784 -6.152 -12.198 564 HG2 GLN 68 1HG GLN 68 4.707 -7.605 -12.435 565 HG3 GLN 68 2HG GLN 68 3.833 -8.658 -13.547 566 HE21 GLN 68 2HE2 GLN 68 6.050 -7.862 -14.725 567 HE22 GLN 68 1HE2 GLN 68 5.828 -6.541 -15.766 568 H PHE 69 H PHE 69 4.009 -9.715 -11.365 569 HA PHE 69 HA PHE 69 4.961 -8.518 -8.815 570 HB2 PHE 69 1HB PHE 69 3.559 -10.637 -8.499 571 HB3 PHE 69 2HB PHE 69 4.868 -11.507 -9.292 572 HD1 PHE 69 HD1 PHE 69 7.197 -11.393 -8.338 573 HD2 PHE 69 HD2 PHE 69 3.770 -9.925 -6.203 574 HE1 PHE 69 HE1 PHE 69 8.490 -11.419 -6.226 575 HE2 PHE 69 HE2 PHE 69 5.070 -9.956 -4.096 576 HZ PHE 69 HZ PHE 69 7.432 -10.701 -4.108 577 H ASN 70 H ASN 70 6.891 -7.741 -9.253 578 HA ASN 70 HA ASN 70 8.830 -9.391 -10.801 579 HB2 ASN 70 1HB ASN 70 8.716 -6.370 -10.596 580 HB3 ASN 70 2HB ASN 70 9.870 -7.318 -11.533 581 HD21 ASN 70 2HD2 ASN 70 7.812 -9.299 -12.408 582 HD22 ASN 70 1HD2 ASN 70 6.859 -8.495 -13.558 583 H GLU 71 H GLU 71 9.977 -10.360 -9.273 584 HA GLU 71 HA GLU 71 10.479 -9.787 -6.677 585 HB2 GLU 71 1HB GLU 71 12.381 -10.968 -8.714 586 HB3 GLU 71 2HB GLU 71 12.675 -11.000 -6.976 587 HG2 GLU 71 1HG GLU 71 10.658 -12.279 -6.593 588 HG3 GLU 71 2HG GLU 71 10.173 -12.117 -8.280 589 H ARG 72 H ARG 72 11.320 -8.184 -5.586 590 HA ARG 72 HA ARG 72 12.315 -6.153 -5.124 591 HB2 ARG 72 1HB ARG 72 14.623 -7.643 -6.377 592 HB3 ARG 72 2HB ARG 72 14.753 -6.247 -5.307 593 HG2 ARG 72 1HG ARG 72 13.641 -7.501 -3.506 594 HG3 ARG 72 2HG ARG 72 13.472 -8.896 -4.576 595 HD2 ARG 72 1HD ARG 72 16.135 -7.645 -3.839 596 HD3 ARG 72 2HD ARG 72 15.451 -9.059 -3.038 597 HE ARG 72 HE ARG 72 15.440 -9.550 -5.798 598 HH11 ARG 72 1HH2 ARG 72 17.715 -9.060 -3.219 599 HH12 ARG 72 2HH2 ARG 72 18.938 -10.042 -3.945 600 HH21 ARG 72 1HH1 ARG 72 17.033 -10.817 -6.734 601 HH22 ARG 72 2HH1 ARG 72 18.552 -11.037 -5.937 602 H SER 73 H SER 73 10.868 -5.550 -7.276 603 HA SER 73 HA SER 73 12.543 -3.611 -8.656 604 HB2 SER 73 1HB SER 73 11.171 -5.807 -10.216 605 HB3 SER 73 2HB SER 73 11.952 -4.391 -10.916 606 HG SER 73 HG SER 73 13.532 -5.864 -10.919 607 H ILE 74 H ILE 74 9.406 -5.159 -9.381 608 HA ILE 74 HA ILE 74 8.036 -2.590 -8.810 609 HB ILE 74 HB ILE 74 7.790 -4.095 -11.435 610 HG12 ILE 74 1HG1 ILE 74 8.764 -1.274 -10.846 611 HG13 ILE 74 2HG1 ILE 74 9.822 -2.636 -11.178 612 HG21 ILE 74 1HG2 ILE 74 6.300 -1.695 -10.314 613 HG22 ILE 74 2HG2 ILE 74 5.604 -3.242 -10.794 614 HG23 ILE 74 3HG2 ILE 74 6.249 -2.159 -12.010 615 HD11 ILE 74 3HD1 ILE 74 7.769 -1.479 -13.056 616 HD12 ILE 74 1HD1 ILE 74 8.692 -2.950 -13.370 617 HD13 ILE 74 2HD1 ILE 74 9.522 -1.401 -13.224 618 H LEU 75 H LEU 75 6.066 -2.770 -7.993 619 HA LEU 75 HA LEU 75 4.707 -5.409 -8.013 620 HB2 LEU 75 1HB LEU 75 5.990 -4.886 -5.846 621 HB3 LEU 75 2HB LEU 75 4.813 -3.603 -5.587 622 HG LEU 75 HG LEU 75 3.056 -5.592 -6.075 623 HD11 LEU 75 1HD1 LEU 75 5.424 -7.066 -4.884 624 HD12 LEU 75 2HD1 LEU 75 4.868 -7.253 -6.545 625 HD13 LEU 75 3HD1 LEU 75 3.827 -7.734 -5.210 626 HD21 LEU 75 3HD2 LEU 75 3.090 -4.320 -4.004 627 HD22 LEU 75 1HD2 LEU 75 4.533 -5.174 -3.471 628 HD23 LEU 75 2HD2 LEU 75 3.004 -6.038 -3.612 629 H GLN 76 H GLN 76 2.687 -5.256 -8.693 630 HA GLN 76 HA GLN 76 1.160 -2.736 -8.278 631 HB2 GLN 76 1HB GLN 76 1.271 -4.364 -10.831 632 HB3 GLN 76 2HB GLN 76 0.192 -3.003 -10.524 633 HG2 GLN 76 1HG GLN 76 2.120 -1.520 -10.215 634 HG3 GLN 76 2HG GLN 76 3.218 -2.869 -10.466 635 HE21 GLN 76 2HE2 GLN 76 4.142 -2.497 -12.487 636 HE22 GLN 76 1HE2 GLN 76 3.267 -2.138 -13.894 637 H TYR 77 H TYR 77 -0.927 -2.991 -7.683 638 HA TYR 77 HA TYR 77 -2.217 -5.607 -7.966 639 HB2 TYR 77 1HB TYR 77 -2.748 -5.760 -5.556 640 HB3 TYR 77 2HB TYR 77 -1.022 -5.904 -5.880 641 HD1 TYR 77 HD2 TYR 77 -3.682 -3.695 -4.557 642 HD2 TYR 77 HD1 TYR 77 0.545 -4.169 -5.178 643 HE1 TYR 77 HE2 TYR 77 -3.241 -1.792 -3.027 644 HE2 TYR 77 HE1 TYR 77 0.980 -2.269 -3.646 645 HH TYR 77 HH TYR 77 -0.874 -1.185 -1.485 646 H SER 78 H SER 78 -4.382 -5.579 -7.929 647 HA SER 78 HA SER 78 -5.689 -2.964 -8.145 648 HB2 SER 78 1HB SER 78 -7.629 -4.244 -8.891 649 HB3 SER 78 2HB SER 78 -6.200 -4.775 -9.775 650 HG SER 78 HG SER 78 -7.708 -6.075 -7.825 651 H HIS 79 H HIS 79 -7.543 -2.415 -6.825 652 HA HIS 79 HA HIS 79 -7.954 -4.042 -4.415 653 HB2 HIS 79 1HB HIS 79 -6.077 -2.465 -3.910 654 HB3 HIS 79 2HB HIS 79 -7.181 -1.122 -4.209 655 HD1 HIS 79 HD1 HIS 79 -8.544 -0.384 -2.245 656 HD2 HIS 79 HD2 HIS 79 -7.158 -4.288 -1.785 657 HE1 HIS 79 HE1 HIS 79 -9.291 -1.142 0.053 658 HE2 HIS 79 HE2 HIS 79 -8.452 -3.522 0.349 659 H PHE 80 H PHE 80 -9.881 -3.843 -3.483 660 HA PHE 80 HA PHE 80 -11.743 -1.733 -4.377 661 HB2 PHE 80 1HB PHE 80 -12.240 -3.495 -5.924 662 HB3 PHE 80 2HB PHE 80 -12.171 -4.718 -4.661 663 HD1 PHE 80 HD1 PHE 80 -14.111 -1.833 -5.964 664 HD2 PHE 80 HD2 PHE 80 -14.071 -5.129 -3.215 665 HE1 PHE 80 HE1 PHE 80 -16.523 -1.487 -5.516 666 HE2 PHE 80 HE2 PHE 80 -16.487 -4.788 -2.770 667 HZ PHE 80 HZ PHE 80 -17.712 -2.964 -3.920 668 H SER 81 H SER 81 -13.015 -1.026 -2.796 669 HA SER 81 HA SER 81 -12.994 -2.458 -0.204 670 HB2 SER 81 1HB SER 81 -11.962 -0.308 -0.004 671 HB3 SER 81 2HB SER 81 -13.341 0.474 -0.779 672 HG SER 81 HG SER 81 -14.292 0.477 1.090 673 HA PRO 82 HA PRO 82 -17.404 -2.862 -1.238 674 HB2 PRO 82 1HB PRO 82 -18.185 -4.385 0.923 675 HB3 PRO 82 2HB PRO 82 -17.354 -5.058 -0.492 676 HG2 PRO 82 1HG PRO 82 -16.255 -4.361 2.196 677 HG3 PRO 82 2HG PRO 82 -15.845 -5.707 1.129 678 HD2 PRO 82 1HD PRO 82 -14.304 -3.425 1.369 679 HD3 PRO 82 2HD PRO 82 -14.297 -4.461 -0.078 680 H LEU 83 H LEU 83 -16.055 -1.506 1.642 681 HA LEU 83 HA LEU 83 -18.369 -0.650 2.993 682 HB2 LEU 83 1HB LEU 83 -15.726 0.814 2.818 683 HB3 LEU 83 2HB LEU 83 -16.927 0.949 4.101 684 HG LEU 83 HG LEU 83 -15.431 -1.601 3.388 685 HD11 LEU 83 1HD1 LEU 83 -15.045 0.388 5.652 686 HD12 LEU 83 2HD1 LEU 83 -13.914 0.060 4.340 687 HD13 LEU 83 3HD1 LEU 83 -14.248 -1.181 5.548 688 HD21 LEU 83 3HD2 LEU 83 -16.327 -2.238 5.739 689 HD22 LEU 83 1HD2 LEU 83 -17.488 -2.243 4.419 690 HD23 LEU 83 2HD2 LEU 83 -17.445 -0.890 5.550 691 H THR 84 H THR 84 -17.192 0.235 -0.040 692 HA THR 84 HA THR 84 -17.937 2.964 -0.159 693 HB THR 84 HB THR 84 -17.976 2.587 -2.631 694 HG1 THR 84 HG1 THR 84 -18.745 0.511 -2.717 695 HG21 THR 84 3HG2 THR 84 -15.859 3.111 -1.608 696 HG22 THR 84 1HG2 THR 84 -15.584 1.820 -2.777 697 HG23 THR 84 2HG2 THR 84 -15.657 1.448 -1.055 698 H GLY 85 H GLY 85 -19.749 -0.027 -0.625 699 HA2 GLY 85 1HA GLY 85 -21.994 -0.438 -0.959 700 HA3 GLY 85 2HA GLY 85 -22.244 1.009 0.015 701 H LYS 86 H LYS 86 -20.514 1.077 -3.028 702 HA LYS 86 HA LYS 86 -22.479 2.952 -4.070 703 HB2 LYS 86 1HB LYS 86 -19.720 2.117 -4.943 704 HB3 LYS 86 2HB LYS 86 -20.737 3.135 -5.961 705 HG2 LYS 86 1HG LYS 86 -20.914 4.800 -4.184 706 HG3 LYS 86 2HG LYS 86 -19.971 3.780 -3.102 707 HD2 LYS 86 1HD LYS 86 -18.076 3.877 -4.719 708 HD3 LYS 86 2HD LYS 86 -19.022 4.983 -5.716 709 HE2 LYS 86 1HE LYS 86 -19.126 6.590 -3.864 710 HE3 LYS 86 2HE LYS 86 -18.221 5.480 -2.834 711 HZ1 LYS 86 3HZ LYS 86 -16.509 5.554 -4.732 712 HZ2 LYS 86 1HZ LYS 86 -16.589 6.863 -3.657 713 HZ3 LYS 86 2HZ LYS 86 -17.303 6.984 -5.195 714 HA PRO 87 HA PRO 87 -24.600 0.172 -6.833 715 HB2 PRO 87 1HB PRO 87 -24.007 2.126 -9.049 716 HB3 PRO 87 2HB PRO 87 -25.565 1.432 -8.554 717 HG2 PRO 87 1HG PRO 87 -24.927 3.950 -7.949 718 HG3 PRO 87 2HG PRO 87 -25.820 2.931 -6.802 719 HD2 PRO 87 1HD PRO 87 -22.926 3.751 -6.729 720 HD3 PRO 87 2HD PRO 87 -24.073 3.480 -5.397 721 H ASP 88 H ASP 88 -24.124 -1.445 -8.374 722 HA ASP 88 HA ASP 88 -21.605 -2.451 -8.637 723 HB2 ASP 88 1HB ASP 88 -23.928 -2.635 -10.565 724 HB3 ASP 88 2HB ASP 88 -22.492 -3.654 -10.668 725 H LEU 89 H LEU 89 -19.974 -1.053 -9.145 726 HA LEU 89 HA LEU 89 -19.674 -0.387 -11.970 727 HB2 LEU 89 1HB LEU 89 -20.813 1.577 -10.803 728 HB3 LEU 89 2HB LEU 89 -19.309 1.793 -9.915 729 HG LEU 89 HG LEU 89 -18.219 1.724 -12.355 730 HD11 LEU 89 1HD1 LEU 89 -20.369 1.203 -13.518 731 HD12 LEU 89 2HD1 LEU 89 -19.657 2.712 -14.071 732 HD13 LEU 89 3HD1 LEU 89 -21.018 2.740 -12.954 733 HD21 LEU 89 3HD2 LEU 89 -18.498 4.202 -12.508 734 HD22 LEU 89 1HD2 LEU 89 -18.066 3.661 -10.887 735 HD23 LEU 89 2HD2 LEU 89 -19.732 4.110 -11.252 736 HA PRO 90 HA PRO 90 -15.824 -2.133 -10.039 737 HB2 PRO 90 1HB PRO 90 -15.204 -2.334 -12.979 738 HB3 PRO 90 2HB PRO 90 -14.960 -3.535 -11.695 739 HG2 PRO 90 1HG PRO 90 -16.972 -3.775 -13.427 740 HG3 PRO 90 2HG PRO 90 -17.186 -4.206 -11.718 741 HD2 PRO 90 1HD PRO 90 -18.169 -1.768 -13.181 742 HD3 PRO 90 2HD PRO 90 -18.931 -2.660 -11.842 743 H GLU 91 H GLU 91 -16.260 0.358 -12.467 744 HA GLU 91 HA GLU 91 -13.586 1.361 -12.470 745 HB2 GLU 91 1HB GLU 91 -16.220 2.648 -13.234 746 HB3 GLU 91 2HB GLU 91 -14.643 3.377 -13.518 747 HG2 GLU 91 1HG GLU 91 -15.281 2.258 -15.552 748 HG3 GLU 91 2HG GLU 91 -14.008 1.293 -14.813 749 H ASN 92 H ASN 92 -15.786 1.254 -10.033 750 HA ASN 92 HA ASN 92 -15.626 3.876 -8.924 751 HB2 ASN 92 1HB ASN 92 -16.527 2.824 -6.892 752 HB3 ASN 92 2HB ASN 92 -17.413 2.320 -8.328 753 HD21 ASN 92 2HD2 ASN 92 -18.061 0.218 -7.627 754 HD22 ASN 92 1HD2 ASN 92 -16.955 -1.010 -7.244 755 H TYR 93 H TYR 93 -13.471 1.158 -8.838 756 HA TYR 93 HA TYR 93 -11.875 2.415 -6.663 757 HB2 TYR 93 1HB TYR 93 -10.982 0.288 -6.154 758 HB3 TYR 93 2HB TYR 93 -12.712 0.055 -6.352 759 HD1 TYR 93 HD1 TYR 93 -9.394 -0.508 -7.863 760 HD2 TYR 93 HD2 TYR 93 -13.603 -1.258 -8.228 761 HE1 TYR 93 HE1 TYR 93 -8.932 -2.234 -9.570 762 HE2 TYR 93 HE2 TYR 93 -13.141 -2.985 -9.945 763 HH TYR 93 HH TYR 93 -9.834 -3.963 -10.720 764 H HIS 94 H HIS 94 -9.459 1.705 -6.895 765 HA HIS 94 HA HIS 94 -8.507 2.169 -9.669 766 HB2 HIS 94 1HB HIS 94 -6.703 3.688 -8.508 767 HB3 HIS 94 2HB HIS 94 -8.287 4.355 -8.863 768 HD1 HIS 94 HD1 HIS 94 -8.732 5.898 -6.965 769 HD2 HIS 94 HD2 HIS 94 -7.330 2.201 -5.638 770 HE1 HIS 94 HE1 HIS 94 -8.867 5.950 -4.439 771 HE2 HIS 94 HE2 HIS 94 -8.005 3.707 -3.611 772 H VAL 95 H VAL 95 -6.232 1.746 -9.946 773 HA VAL 95 HA VAL 95 -5.350 -0.580 -8.341 774 HB VAL 95 HB VAL 95 -5.657 -0.981 -10.750 775 HG11 VAL 95 1HG1 VAL 95 -4.379 0.177 -12.419 776 HG12 VAL 95 2HG1 VAL 95 -3.416 1.012 -11.203 777 HG13 VAL 95 3HG1 VAL 95 -5.120 1.419 -11.411 778 HG21 VAL 95 3HG2 VAL 95 -3.507 -2.016 -11.143 779 HG22 VAL 95 1HG2 VAL 95 -3.840 -2.120 -9.419 780 HG23 VAL 95 2HG2 VAL 95 -2.709 -0.914 -10.028 781 H VAL 96 H VAL 96 -3.579 -0.464 -7.154 782 HA VAL 96 HA VAL 96 -2.033 2.050 -7.131 783 HB VAL 96 HB VAL 96 -1.947 -0.232 -5.145 784 HG11 VAL 96 1HG1 VAL 96 -1.024 1.559 -3.673 785 HG12 VAL 96 2HG1 VAL 96 -1.020 2.655 -5.054 786 HG13 VAL 96 3HG1 VAL 96 0.009 1.221 -5.061 787 HG21 VAL 96 3HG2 VAL 96 -4.215 0.684 -5.249 788 HG22 VAL 96 1HG2 VAL 96 -3.578 2.327 -5.150 789 HG23 VAL 96 2HG2 VAL 96 -3.423 1.235 -3.774 790 H THR 97 H THR 97 0.026 2.179 -7.721 791 HA THR 97 HA THR 97 1.525 -0.323 -8.309 792 HB THR 97 HB THR 97 0.924 0.558 -10.450 793 HG1 THR 97 HG1 THR 97 3.506 1.563 -9.889 794 HG21 THR 97 3HG2 THR 97 0.319 2.862 -9.622 795 HG22 THR 97 1HG2 THR 97 1.255 2.858 -11.114 796 HG23 THR 97 2HG2 THR 97 2.040 3.242 -9.588 797 H ILE 98 H ILE 98 3.268 -0.520 -7.161 798 HA ILE 98 HA ILE 98 4.555 1.891 -5.990 799 HB ILE 98 HB ILE 98 4.927 -0.980 -5.096 800 HG12 ILE 98 1HG1 ILE 98 2.546 -0.500 -4.933 801 HG13 ILE 98 2HG1 ILE 98 3.257 -0.469 -3.328 802 HG21 ILE 98 1HG2 ILE 98 5.576 0.150 -2.974 803 HG22 ILE 98 2HG2 ILE 98 5.369 1.709 -3.759 804 HG23 ILE 98 3HG2 ILE 98 6.619 0.601 -4.319 805 HD11 ILE 98 3HD1 ILE 98 2.360 1.859 -5.013 806 HD12 ILE 98 1HD1 ILE 98 3.463 2.089 -3.663 807 HD13 ILE 98 2HD1 ILE 98 1.859 1.430 -3.387 808 H THR 99 H THR 99 6.531 2.424 -6.606 809 HA THR 99 HA THR 99 8.132 0.494 -8.224 810 HB THR 99 HB THR 99 8.214 3.519 -8.317 811 HG1 THR 99 HG1 THR 99 6.983 1.566 -9.951 812 HG21 THR 99 3HG2 THR 99 10.345 2.569 -8.926 813 HG22 THR 99 1HG2 THR 99 9.527 3.027 -10.418 814 HG23 THR 99 2HG2 THR 99 9.573 1.335 -9.923 815 H LEU 100 H LEU 100 9.887 -0.227 -7.256 816 HA LEU 100 HA LEU 100 11.253 1.470 -5.227 817 HB2 LEU 100 1HB LEU 100 10.867 -1.528 -5.222 818 HB3 LEU 100 2HB LEU 100 11.837 -0.630 -4.061 819 HG LEU 100 HG LEU 100 8.889 -0.074 -4.526 820 HD11 LEU 100 1HD1 LEU 100 8.582 -1.321 -2.331 821 HD12 LEU 100 2HD1 LEU 100 10.230 -1.920 -2.528 822 HD13 LEU 100 3HD1 LEU 100 8.989 -2.328 -3.717 823 HD21 LEU 100 3HD2 LEU 100 10.907 0.771 -2.418 824 HD22 LEU 100 1HD2 LEU 100 9.171 0.878 -2.138 825 HD23 LEU 100 2HD2 LEU 100 9.898 1.801 -3.436 826 H THR 101 H THR 101 13.283 1.896 -5.586 827 HA THR 101 HA THR 101 14.898 0.115 -7.331 828 HB THR 101 HB THR 101 15.829 2.049 -8.480 829 HG1 THR 101 HG1 THR 101 14.208 3.978 -7.911 830 HG21 THR 101 3HG2 THR 101 12.801 2.150 -8.485 831 HG22 THR 101 1HG2 THR 101 13.776 0.992 -9.391 832 HG23 THR 101 2HG2 THR 101 13.865 2.711 -9.774 833 H ALA 102 H ALA 102 17.025 -0.033 -6.812 834 HA ALA 102 HA ALA 102 17.808 1.093 -4.198 835 HB1 ALA 102 3HB ALA 102 18.963 -1.177 -5.826 836 HB2 ALA 102 1HB ALA 102 17.980 -1.316 -4.367 837 HB3 ALA 102 2HB ALA 102 19.600 -0.621 -4.276 838 H LEU 103 H LEU 103 18.778 3.013 -4.406 839 HA LEU 103 HA LEU 103 20.596 3.549 -6.667 840 HB2 LEU 103 1HB LEU 103 19.637 5.427 -4.497 841 HB3 LEU 103 2HB LEU 103 20.436 5.862 -6.008 842 HG LEU 103 HG LEU 103 17.723 4.520 -5.765 843 HD11 LEU 103 1HD1 LEU 103 16.856 6.667 -6.607 844 HD12 LEU 103 2HD1 LEU 103 18.487 7.335 -6.594 845 HD13 LEU 103 3HD1 LEU 103 17.707 6.882 -5.079 846 HD21 LEU 103 3HD2 LEU 103 18.586 3.765 -7.837 847 HD22 LEU 103 1HD2 LEU 103 19.441 5.276 -8.146 848 HD23 LEU 103 2HD2 LEU 103 17.685 5.201 -8.294 849 H LYS 104 H LYS 104 22.545 4.904 -6.061 850 HA LYS 104 HA LYS 104 24.301 3.338 -4.514 851 HB2 LYS 104 1HB LYS 104 24.563 6.147 -5.602 852 HB3 LYS 104 2HB LYS 104 25.889 5.267 -4.840 853 HG2 LYS 104 1HG LYS 104 25.668 3.469 -6.518 854 HG3 LYS 104 2HG LYS 104 24.340 4.342 -7.283 855 HD2 LYS 104 1HD LYS 104 25.847 6.245 -7.735 856 HD3 LYS 104 2HD LYS 104 27.178 5.370 -6.978 857 HE2 LYS 104 1HE LYS 104 26.954 3.575 -8.666 858 HE3 LYS 104 2HE LYS 104 25.639 4.469 -9.432 859 HZ1 LYS 104 3HZ LYS 104 28.397 5.506 -9.060 860 HZ2 LYS 104 1HZ LYS 104 27.132 6.277 -9.888 861 HZ3 LYS 104 2HZ LYS 104 27.800 4.843 -10.506 862 H LYS 105 H LYS 105 22.690 6.403 -3.733 863 HA LYS 105 HA LYS 105 23.931 6.585 -1.107 864 HB2 LYS 105 1HB LYS 105 21.732 8.205 -2.423 865 HB3 LYS 105 2HB LYS 105 22.387 8.542 -0.821 866 HG2 LYS 105 1HG LYS 105 24.646 8.808 -1.813 867 HG3 LYS 105 2HG LYS 105 23.964 8.519 -3.414 868 HD2 LYS 105 1HD LYS 105 22.504 10.492 -3.159 869 HD3 LYS 105 2HD LYS 105 23.168 10.781 -1.551 870 HE2 LYS 105 1HE LYS 105 25.419 11.077 -2.538 871 HE3 LYS 105 2HE LYS 105 24.743 10.809 -4.145 872 HZ1 LYS 105 3HZ LYS 105 24.220 13.057 -2.293 873 HZ2 LYS 105 1HZ LYS 105 23.196 12.717 -3.602 874 HZ3 LYS 105 2HZ LYS 105 24.823 13.118 -3.880 875 H GLY 106 H GLY 106 20.869 5.480 -2.459 876 HA2 GLY 106 1HA GLY 106 20.249 3.912 -0.194 877 HA3 GLY 106 2HA GLY 106 19.321 5.409 -0.141 878 H VAL 107 H VAL 107 17.317 4.623 -0.569 879 HA VAL 107 HA VAL 107 16.895 3.482 -3.278 880 HB VAL 107 HB VAL 107 15.564 1.752 -2.476 881 HG11 VAL 107 1HG1 VAL 107 17.952 1.438 -1.891 882 HG12 VAL 107 2HG1 VAL 107 16.867 0.569 -0.813 883 HG13 VAL 107 3HG1 VAL 107 17.613 2.078 -0.292 884 HG21 VAL 107 3HG2 VAL 107 14.831 1.649 -0.006 885 HG22 VAL 107 1HG2 VAL 107 14.022 2.849 -1.014 886 HG23 VAL 107 2HG2 VAL 107 15.312 3.340 0.084 887 H GLU 108 H GLU 108 15.376 4.478 -4.409 888 HA GLU 108 HA GLU 108 13.734 6.551 -3.113 889 HB2 GLU 108 1HB GLU 108 14.979 7.092 -5.195 890 HB3 GLU 108 2HB GLU 108 14.032 5.878 -6.055 891 HG2 GLU 108 1HG GLU 108 11.968 7.083 -5.576 892 HG3 GLU 108 2HG GLU 108 12.839 8.239 -4.570 893 H VAL 109 H VAL 109 11.549 6.516 -3.051 894 HA VAL 109 HA VAL 109 10.136 4.109 -4.092 895 HB VAL 109 HB VAL 109 8.916 3.847 -2.068 896 HG11 VAL 109 1HG1 VAL 109 11.335 3.089 -2.049 897 HG12 VAL 109 2HG1 VAL 109 10.650 3.384 -0.453 898 HG13 VAL 109 3HG1 VAL 109 11.728 4.573 -1.185 899 HG21 VAL 109 3HG2 VAL 109 10.074 6.545 -1.295 900 HG22 VAL 109 1HG2 VAL 109 9.311 5.474 -0.120 901 HG23 VAL 109 2HG2 VAL 109 8.373 6.114 -1.465 902 H GLU 110 H GLU 110 7.982 4.398 -4.677 903 HA GLU 110 HA GLU 110 6.824 7.081 -4.613 904 HB2 GLU 110 1HB GLU 110 8.252 7.082 -6.641 905 HB3 GLU 110 2HB GLU 110 7.367 5.680 -7.242 906 HG2 GLU 110 1HG GLU 110 5.287 6.955 -7.285 907 HG3 GLU 110 2HG GLU 110 6.085 8.340 -6.542 908 H LEU 111 H LEU 111 4.683 7.023 -4.504 909 HA LEU 111 HA LEU 111 3.263 4.487 -5.138 910 HB2 LEU 111 1HB LEU 111 3.585 4.964 -2.668 911 HB3 LEU 111 2HB LEU 111 2.574 6.382 -2.873 912 HG LEU 111 HG LEU 111 1.440 3.788 -3.922 913 HD11 LEU 111 1HD1 LEU 111 1.537 4.398 -0.959 914 HD12 LEU 111 2HD1 LEU 111 2.424 3.100 -1.758 915 HD13 LEU 111 3HD1 LEU 111 0.662 3.074 -1.727 916 HD21 LEU 111 3HD2 LEU 111 0.137 5.894 -4.044 917 HD22 LEU 111 1HD2 LEU 111 0.239 6.051 -2.293 918 HD23 LEU 111 2HD2 LEU 111 -0.646 4.709 -3.012 919 H THR 112 H THR 112 1.688 4.725 -6.574 920 HA THR 112 HA THR 112 0.517 7.427 -6.988 921 HB THR 112 HB THR 112 0.812 5.334 -9.148 922 HG1 THR 112 HG1 THR 112 2.661 6.966 -8.007 923 HG21 THR 112 3HG2 THR 112 -0.881 7.106 -9.496 924 HG22 THR 112 1HG2 THR 112 0.473 7.297 -10.610 925 HG23 THR 112 2HG2 THR 112 0.347 8.339 -9.192 926 H GLN 113 H GLN 113 -1.630 7.617 -7.317 927 HA GLN 113 HA GLN 113 -3.347 5.216 -7.342 928 HB2 GLN 113 1HB GLN 113 -3.036 5.871 -4.952 929 HB3 GLN 113 2HB GLN 113 -3.705 7.455 -5.335 930 HG2 GLN 113 1HG GLN 113 -5.806 6.376 -6.099 931 HG3 GLN 113 2HG GLN 113 -5.131 4.802 -5.687 932 HE21 GLN 113 2HE2 GLN 113 -7.122 7.196 -4.494 933 HE22 GLN 113 1HE2 GLN 113 -6.942 6.898 -2.836 934 H ASP 114 H ASP 114 -4.989 5.452 -8.708 935 HA ASP 114 HA ASP 114 -5.544 8.134 -9.834 936 HB2 ASP 114 1HB ASP 114 -6.117 5.396 -10.944 937 HB3 ASP 114 2HB ASP 114 -6.406 6.930 -11.764 938 H ASN 115 H ASN 115 -7.884 7.822 -10.990 939 HA ASN 115 HA ASN 115 -10.124 7.991 -10.748 940 HB2 ASN 115 1HB ASN 115 -9.884 5.552 -10.177 941 HB3 ASN 115 2HB ASN 115 -9.907 6.017 -8.474 942 HD21 ASN 115 2HD2 ASN 115 -11.997 4.725 -8.390 943 HD22 ASN 115 1HD2 ASN 115 -13.430 5.477 -8.898 944 H ASN 116 H ASN 116 -8.582 9.943 -9.317 945 HA ASN 116 HA ASN 116 -9.940 10.326 -6.746 946 HB2 ASN 116 1HB ASN 116 -8.074 12.141 -8.306 947 HB3 ASN 116 2HB ASN 116 -8.713 12.491 -6.707 948 HD21 ASN 116 2HD2 ASN 116 -5.927 11.447 -8.055 949 HD22 ASN 116 1HD2 ASN 116 -5.397 10.366 -6.857 950 H GLU 117 H GLU 117 -11.857 11.413 -6.539 951 HA GLU 117 HA GLU 117 -13.304 12.170 -8.858 952 HB2 GLU 117 1HB GLU 117 -14.335 11.330 -6.747 953 HB3 GLU 117 2HB GLU 117 -13.963 12.879 -5.995 954 HG2 GLU 117 1HG GLU 117 -16.252 12.962 -6.764 955 HG3 GLU 117 2HG GLU 117 -15.307 13.998 -7.824 956 H THR 118 H THR 118 -11.617 14.109 -6.408 957 HA THR 118 HA THR 118 -11.484 16.343 -8.304 958 HB THR 118 HB THR 118 -13.514 16.976 -7.239 959 HG1 THR 118 HG1 THR 118 -12.630 18.842 -6.982 960 HG21 THR 118 3HG2 THR 118 -13.612 15.437 -5.398 961 HG22 THR 118 1HG2 THR 118 -13.657 17.060 -4.711 962 HG23 THR 118 2HG2 THR 118 -12.166 16.126 -4.665 963 H GLU 119 H GLU 119 -10.277 18.234 -7.172 964 HA GLU 119 HA GLU 119 -7.690 17.351 -6.515 965 HB2 GLU 119 1HB GLU 119 -9.049 20.020 -6.041 966 HB3 GLU 119 2HB GLU 119 -7.325 19.739 -5.793 967 HG2 GLU 119 1HG GLU 119 -7.039 19.131 -8.127 968 HG3 GLU 119 2HG GLU 119 -8.775 19.246 -8.409 969 H LYS 120 H LYS 120 -10.437 18.297 -4.543 970 HA LYS 120 HA LYS 120 -9.182 18.355 -2.026 971 HB2 LYS 120 1HB LYS 120 -12.015 17.773 -2.904 972 HB3 LYS 120 2HB LYS 120 -11.563 17.717 -1.201 973 HG2 LYS 120 1HG LYS 120 -12.460 19.923 -1.768 974 HG3 LYS 120 2HG LYS 120 -10.753 20.050 -1.342 975 HD2 LYS 120 1HD LYS 120 -10.090 20.300 -3.622 976 HD3 LYS 120 2HD LYS 120 -11.663 19.773 -4.222 977 HE2 LYS 120 1HE LYS 120 -12.705 21.799 -3.342 978 HE3 LYS 120 2HE LYS 120 -11.173 22.307 -2.630 979 HZ1 LYS 120 3HZ LYS 120 -11.950 22.179 -5.466 980 HZ2 LYS 120 1HZ LYS 120 -10.314 22.052 -5.036 981 HZ3 LYS 120 2HZ LYS 120 -11.196 23.442 -4.614 982 H GLU 121 H GLU 121 -10.646 15.677 -3.843 983 HA GLU 121 HA GLU 121 -10.188 13.717 -1.816 984 HB2 GLU 121 1HB GLU 121 -11.910 13.521 -3.639 985 HB3 GLU 121 2HB GLU 121 -10.594 13.261 -4.782 986 HG2 GLU 121 1HG GLU 121 -11.400 11.089 -4.126 987 HG3 GLU 121 2HG GLU 121 -9.847 11.309 -3.337 988 H GLN 122 H GLN 122 -8.428 14.769 -4.699 989 HA GLN 122 HA GLN 122 -6.431 12.768 -4.645 990 HB2 GLN 122 1HB GLN 122 -6.801 14.223 -6.600 991 HB3 GLN 122 2HB GLN 122 -6.277 15.623 -5.671 992 HG2 GLN 122 1HG GLN 122 -4.470 13.211 -6.005 993 HG3 GLN 122 2HG GLN 122 -4.533 14.464 -7.231 994 HE21 GLN 122 2HE2 GLN 122 -2.170 13.884 -5.642 995 HE22 GLN 122 1HE2 GLN 122 -1.844 15.258 -4.703 996 H LYS 123 H LYS 123 -6.635 16.006 -3.233 997 HA LYS 123 HA LYS 123 -4.090 16.006 -2.011 998 HB2 LYS 123 1HB LYS 123 -5.626 18.007 -2.380 999 HB3 LYS 123 2HB LYS 123 -6.574 17.431 -1.017 1000 HG2 LYS 123 1HG LYS 123 -5.128 18.928 0.067 1001 HG3 LYS 123 2HG LYS 123 -4.232 17.425 0.251 1002 HD2 LYS 123 1HD LYS 123 -2.870 17.986 -1.733 1003 HD3 LYS 123 2HD LYS 123 -3.796 19.467 -1.956 1004 HE2 LYS 123 1HE LYS 123 -3.045 20.275 0.245 1005 HE3 LYS 123 2HE LYS 123 -2.121 18.789 0.477 1006 HZ1 LYS 123 3HZ LYS 123 -0.762 19.305 -1.383 1007 HZ2 LYS 123 1HZ LYS 123 -0.803 20.685 -0.399 1008 HZ3 LYS 123 2HZ LYS 123 -1.737 20.626 -1.819 1009 H HIS 124 H HIS 124 -7.296 15.047 -0.912 1010 HA HIS 124 HA HIS 124 -6.693 14.383 1.748 1011 HB2 HIS 124 1HB HIS 124 -8.986 14.592 0.744 1012 HB3 HIS 124 2HB HIS 124 -8.717 13.057 -0.075 1013 HD1 HIS 124 HD1 HIS 124 -8.761 14.461 3.465 1014 HD2 HIS 124 HD2 HIS 124 -9.379 10.858 1.460 1015 HE1 HIS 124 HE1 HIS 124 -9.585 12.807 5.199 1016 HE2 HIS 124 HE2 HIS 124 -9.966 10.606 3.991 1017 H SER 125 H SER 125 -6.510 12.540 -1.256 1018 HA SER 125 HA SER 125 -5.727 10.067 -0.014 1019 HB2 SER 125 1HB SER 125 -5.179 9.356 -2.316 1020 HB3 SER 125 2HB SER 125 -6.781 10.087 -2.232 1021 HG SER 125 HG SER 125 -4.395 11.074 -3.326 1022 H GLU 126 H GLU 126 -4.019 12.648 -1.749 1023 HA GLU 126 HA GLU 126 -1.427 11.608 -1.651 1024 HB2 GLU 126 1HB GLU 126 -2.206 13.633 -2.945 1025 HB3 GLU 126 2HB GLU 126 -2.196 14.534 -1.435 1026 HG2 GLU 126 1HG GLU 126 0.223 13.962 -1.155 1027 HG3 GLU 126 2HG GLU 126 0.174 13.171 -2.726 1028 H ASP 127 H ASP 127 -3.116 13.753 0.635 1029 HA ASP 127 HA ASP 127 -1.002 13.943 2.511 1030 HB2 ASP 127 1HB ASP 127 -3.998 14.310 2.766 1031 HB3 ASP 127 2HB ASP 127 -2.880 14.620 4.092 1032 H ASN 128 H ASN 128 -3.678 11.685 2.101 1033 HA ASN 128 HA ASN 128 -3.367 10.296 4.552 1034 HB2 ASN 128 1HB ASN 128 -5.389 10.101 3.169 1035 HB3 ASN 128 2HB ASN 128 -4.454 9.327 1.895 1036 HD21 ASN 128 2HD2 ASN 128 -4.981 7.138 1.917 1037 HD22 ASN 128 1HD2 ASN 128 -5.093 6.183 3.314 1038 H TRP 129 H TRP 129 -2.262 9.481 1.257 1039 HA TRP 129 HA TRP 129 -0.769 7.220 2.017 1040 HB2 TRP 129 1HB TRP 129 -0.528 9.091 -0.356 1041 HB3 TRP 129 2HB TRP 129 0.488 7.660 -0.172 1042 HD1 TRP 129 HD1 TRP 129 -2.719 8.661 -1.618 1043 HE1 TRP 129 HE1 TRP 129 -4.240 6.629 -2.036 1044 HE3 TRP 129 HE3 TRP 129 -0.203 5.111 1.059 1045 HZ2 TRP 129 HZ2 TRP 129 -4.370 3.857 -1.339 1046 HZ3 TRP 129 HZ3 TRP 129 -1.047 2.786 1.162 1047 HH2 TRP 129 HH2 TRP 129 -3.124 2.152 -0.033 1048 H ASN 130 H ASN 130 0.065 10.647 1.933 1049 HA ASN 130 HA ASN 130 2.839 10.387 2.373 1050 HB2 ASN 130 1HB ASN 130 0.842 12.534 3.130 1051 HB3 ASN 130 2HB ASN 130 2.555 12.685 3.516 1052 HD21 ASN 130 2HD2 ASN 130 0.914 14.302 1.579 1053 HD22 ASN 130 1HD2 ASN 130 1.704 14.141 0.087 1054 H THR 131 H THR 131 0.062 10.286 4.530 1055 HA THR 131 HA THR 131 1.483 10.291 6.978 1056 HB THR 131 HB THR 131 -1.157 8.887 6.480 1057 HG1 THR 131 HG1 THR 131 -1.702 10.809 5.801 1058 HG21 THR 131 3HG2 THR 131 -1.582 9.569 8.812 1059 HG22 THR 131 1HG2 THR 131 0.023 10.297 8.886 1060 HG23 THR 131 2HG2 THR 131 -0.147 8.552 8.690 1061 H MET 132 H MET 132 0.377 7.719 4.816 1062 HA MET 132 HA MET 132 1.238 5.532 6.405 1063 HB2 MET 132 1HB MET 132 0.645 5.904 3.464 1064 HB3 MET 132 2HB MET 132 1.326 4.380 4.035 1065 HG2 MET 132 1HG MET 132 -1.159 4.325 3.947 1066 HG3 MET 132 2HG MET 132 -0.545 4.089 5.585 1067 HE1 MET 132 3HE MET 132 -3.685 6.017 6.479 1068 HE2 MET 132 1HE MET 132 -2.565 4.718 6.919 1069 HE3 MET 132 2HE MET 132 -3.411 4.672 5.374 1070 H LEU 133 H LEU 133 2.792 7.276 3.724 1071 HA LEU 133 HA LEU 133 5.235 5.854 3.799 1072 HB2 LEU 133 1HB LEU 133 4.283 8.439 2.623 1073 HB3 LEU 133 2HB LEU 133 6.022 8.245 2.772 1074 HG LEU 133 HG LEU 133 5.188 7.511 0.563 1075 HD11 LEU 133 1HD1 LEU 133 6.714 5.825 0.422 1076 HD12 LEU 133 2HD1 LEU 133 5.988 4.884 1.720 1077 HD13 LEU 133 3HD1 LEU 133 7.067 6.222 2.097 1078 HD21 LEU 133 3HD2 LEU 133 3.704 5.328 2.072 1079 HD22 LEU 133 1HD2 LEU 133 3.727 5.584 0.331 1080 HD23 LEU 133 2HD2 LEU 133 2.945 6.749 1.376 1081 H GLU 134 H GLU 134 4.110 8.747 5.469 1082 HA GLU 134 HA GLU 134 6.575 9.376 6.732 1083 HB2 GLU 134 1HB GLU 134 4.670 10.956 6.499 1084 HB3 GLU 134 2HB GLU 134 3.748 9.980 7.639 1085 HG2 GLU 134 1HG GLU 134 5.433 10.388 9.378 1086 HG3 GLU 134 2HG GLU 134 6.399 11.322 8.235 1087 H GLY 135 H GLY 135 3.769 7.422 7.639 1088 HA2 GLY 135 1HA GLY 135 4.606 6.742 10.255 1089 HA3 GLY 135 2HA GLY 135 3.449 5.843 9.275 1090 H LEU 136 H LEU 136 5.198 5.329 7.078 1091 HA LEU 136 HA LEU 136 6.475 2.960 7.986 1092 HB2 LEU 136 1HB LEU 136 5.560 3.140 5.716 1093 HB3 LEU 136 2HB LEU 136 6.704 4.426 5.341 1094 HG LEU 136 HG LEU 136 8.589 2.863 5.629 1095 HD11 LEU 136 1HD1 LEU 136 7.963 1.283 7.249 1096 HD12 LEU 136 2HD1 LEU 136 7.879 0.335 5.770 1097 HD13 LEU 136 3HD1 LEU 136 6.400 0.968 6.494 1098 HD21 LEU 136 3HD2 LEU 136 6.445 1.680 3.841 1099 HD22 LEU 136 1HD2 LEU 136 8.190 1.509 3.648 1100 HD23 LEU 136 2HD2 LEU 136 7.430 3.084 3.426 1101 H LYS 137 H LYS 137 7.671 6.130 6.958 1102 HA LYS 137 HA LYS 137 10.426 5.515 7.190 1103 HB2 LYS 137 1HB LYS 137 9.556 7.467 5.922 1104 HB3 LYS 137 2HB LYS 137 9.098 8.225 7.447 1105 HG2 LYS 137 1HG LYS 137 11.439 8.236 8.181 1106 HG3 LYS 137 2HG LYS 137 11.924 7.390 6.715 1107 HD2 LYS 137 1HD LYS 137 11.113 9.301 5.357 1108 HD3 LYS 137 2HD LYS 137 10.652 10.144 6.835 1109 HE2 LYS 137 1HE LYS 137 13.002 10.118 7.588 1110 HE3 LYS 137 2HE LYS 137 13.468 9.269 6.114 1111 HZ1 LYS 137 3HZ LYS 137 13.613 11.864 6.283 1112 HZ2 LYS 137 1HZ LYS 137 11.973 11.776 5.861 1113 HZ3 LYS 137 2HZ LYS 137 13.150 11.107 4.835 1114 H LYS 138 H LYS 138 8.053 6.810 9.473 1115 HA LYS 138 HA LYS 138 9.836 7.475 11.532 1116 HB2 LYS 138 1HB LYS 138 7.347 8.063 11.325 1117 HB3 LYS 138 2HB LYS 138 7.025 6.466 11.987 1118 HG2 LYS 138 1HG LYS 138 7.081 7.734 13.960 1119 HG3 LYS 138 2HG LYS 138 8.762 7.217 13.871 1120 HD2 LYS 138 1HD LYS 138 9.364 9.365 12.794 1121 HD3 LYS 138 2HD LYS 138 7.679 9.869 12.860 1122 HE2 LYS 138 1HE LYS 138 7.726 9.714 15.317 1123 HE3 LYS 138 2HE LYS 138 9.413 9.199 15.252 1124 HZ1 LYS 138 3HZ LYS 138 10.076 11.260 14.397 1125 HZ2 LYS 138 1HZ LYS 138 8.994 11.642 15.646 1126 HZ3 LYS 138 2HZ LYS 138 8.485 11.726 14.028 1127 H PHE 139 H PHE 139 8.205 4.440 10.757 1128 HA PHE 139 HA PHE 139 9.133 3.083 13.122 1129 HB2 PHE 139 1HB PHE 139 7.065 2.438 11.877 1130 HB3 PHE 139 2HB PHE 139 8.085 1.898 10.543 1131 HD1 PHE 139 HD1 PHE 139 7.108 1.260 14.060 1132 HD2 PHE 139 HD2 PHE 139 9.425 -0.134 10.717 1133 HE1 PHE 139 HE1 PHE 139 7.453 -0.915 15.202 1134 HE2 PHE 139 HE2 PHE 139 9.766 -2.306 11.863 1135 HZ PHE 139 HZ PHE 139 8.782 -2.697 14.104 1136 H LEU 140 H LEU 140 10.050 3.082 9.693 1137 HA LEU 140 HA LEU 140 12.138 1.199 9.968 1138 HB2 LEU 140 1HB LEU 140 10.909 2.292 7.832 1139 HB3 LEU 140 2HB LEU 140 12.330 3.321 7.846 1140 HG LEU 140 HG LEU 140 12.788 1.420 6.413 1141 HD11 LEU 140 1HD1 LEU 140 14.853 0.729 7.329 1142 HD12 LEU 140 2HD1 LEU 140 14.260 0.786 8.977 1143 HD13 LEU 140 3HD1 LEU 140 14.561 2.286 8.095 1144 HD21 LEU 140 3HD2 LEU 140 11.073 -0.042 8.028 1145 HD22 LEU 140 1HD2 LEU 140 12.637 -0.674 8.537 1146 HD23 LEU 140 2HD2 LEU 140 12.162 -0.745 6.844 1147 H GLU 141 H GLU 141 12.125 4.730 10.092 1148 HA GLU 141 HA GLU 141 14.980 4.946 10.445 1149 HB2 GLU 141 1HB GLU 141 14.637 7.279 10.526 1150 HB3 GLU 141 2HB GLU 141 13.355 6.706 9.469 1151 HG2 GLU 141 1HG GLU 141 12.122 8.092 10.905 1152 HG3 GLU 141 2HG GLU 141 11.961 6.545 11.726 1153 H ASN 142 H ASN 142 12.633 3.775 12.403 1154 HA ASN 142 HA ASN 142 13.069 4.972 14.902 1155 HB2 ASN 142 1HB ASN 142 11.221 3.368 14.315 1156 HB3 ASN 142 2HB ASN 142 12.404 2.063 14.406 1157 HD21 ASN 142 2HD2 ASN 142 10.120 2.241 16.155 1158 HD22 ASN 142 1HD2 ASN 142 10.699 2.481 17.731 1159 H LYS 143 H LYS 143 14.860 2.505 13.160 1160 HA LYS 143 HA LYS 143 16.393 1.332 15.094 1161 HB2 LYS 143 1HB LYS 143 18.130 1.039 13.388 1162 HB3 LYS 143 2HB LYS 143 16.529 0.753 12.711 1163 HG2 LYS 143 1HG LYS 143 16.522 3.089 11.826 1164 HG3 LYS 143 2HG LYS 143 18.171 3.290 12.422 1165 HD2 LYS 143 1HD LYS 143 18.911 1.396 11.015 1166 HD3 LYS 143 2HD LYS 143 17.267 1.210 10.406 1167 HE2 LYS 143 1HE LYS 143 17.346 3.485 9.464 1168 HE3 LYS 143 2HE LYS 143 18.983 3.693 10.088 1169 HZ1 LYS 143 3HZ LYS 143 19.601 2.887 8.113 1170 HZ2 LYS 143 1HZ LYS 143 18.069 2.245 7.770 1171 HZ3 LYS 143 2HZ LYS 143 19.161 1.368 8.734 1172 H VAL 144 H VAL 144 16.419 4.650 14.192 1173 HA VAL 144 HA VAL 144 19.038 5.373 14.950 1174 HB VAL 144 HB VAL 144 17.431 6.838 13.698 1175 HG11 VAL 144 1HG1 VAL 144 15.486 6.345 15.273 1176 HG12 VAL 144 2HG1 VAL 144 15.704 8.041 14.847 1177 HG13 VAL 144 3HG1 VAL 144 16.240 7.450 16.419 1178 HG21 VAL 144 3HG2 VAL 144 18.594 8.027 16.240 1179 HG22 VAL 144 1HG2 VAL 144 18.166 8.927 14.784 1180 HG23 VAL 144 2HG2 VAL 144 19.480 7.752 14.740 1181 H SER 145 H SER 145 16.086 4.935 16.832 1182 HA SER 145 HA SER 145 16.920 6.062 19.263 1183 HB2 SER 145 1HB SER 145 15.080 3.701 18.796 1184 HB3 SER 145 2HB SER 145 15.218 4.604 20.305 1185 HG SER 145 HG SER 145 14.334 6.351 19.348 1186 H ALA 146 H ALA 146 17.338 2.811 17.947 1187 HA ALA 146 HA ALA 146 18.517 1.615 20.213 1188 HB1 ALA 146 3HB ALA 146 19.290 -0.100 18.650 1189 HB2 ALA 146 1HB ALA 146 18.953 0.966 17.287 1190 HB3 ALA 146 2HB ALA 146 17.628 0.353 18.276 Start of MODEL 2 1 H1 MET 1 1H MET 1 -11.973 15.668 -20.847 2 H2 MET 1 2H MET 1 -12.409 14.060 -21.168 3 H3 MET 1 3H MET 1 -11.289 14.856 -22.167 4 HA MET 1 HA MET 1 -9.587 14.709 -20.658 5 HB2 MET 1 1HB MET 1 -11.751 14.309 -18.565 6 HB3 MET 1 2HB MET 1 -10.018 14.277 -18.234 7 HG2 MET 1 1HG MET 1 -9.839 16.594 -19.137 8 HG3 MET 1 2HG MET 1 -11.588 16.628 -19.340 9 HE1 MET 1 3HE MET 1 -12.687 15.110 -16.509 10 HE2 MET 1 1HE MET 1 -13.244 16.308 -17.683 11 HE3 MET 1 2HE MET 1 -13.123 16.731 -15.979 12 H GLU 2 H GLU 2 -8.523 12.861 -20.989 13 HA GLU 2 HA GLU 2 -9.824 10.415 -21.588 14 HB2 GLU 2 1HB GLU 2 -6.928 11.001 -20.928 15 HB3 GLU 2 2HB GLU 2 -7.516 9.471 -21.572 16 HG2 GLU 2 1HG GLU 2 -7.904 12.143 -22.947 17 HG3 GLU 2 2HG GLU 2 -6.599 11.022 -23.327 18 H ILE 3 H ILE 3 -8.096 11.547 -18.695 19 HA ILE 3 HA ILE 3 -9.508 9.517 -17.092 20 HB ILE 3 HB ILE 3 -7.419 8.912 -15.908 21 HG12 ILE 3 1HG1 ILE 3 -6.045 10.392 -18.179 22 HG13 ILE 3 2HG1 ILE 3 -6.129 10.973 -16.518 23 HG21 ILE 3 1HG2 ILE 3 -7.221 8.406 -18.890 24 HG22 ILE 3 2HG2 ILE 3 -8.342 7.563 -17.821 25 HG23 ILE 3 3HG2 ILE 3 -6.605 7.385 -17.591 26 HD11 ILE 3 3HD1 ILE 3 -4.021 9.896 -16.685 27 HD12 ILE 3 1HD1 ILE 3 -4.701 8.525 -17.560 28 HD13 ILE 3 2HD1 ILE 3 -5.053 8.739 -15.846 29 H LYS 4 H LYS 4 -9.244 9.915 -14.746 30 HA LYS 4 HA LYS 4 -9.687 12.709 -14.176 31 HB2 LYS 4 1HB LYS 4 -9.584 10.275 -12.377 32 HB3 LYS 4 2HB LYS 4 -10.096 11.886 -11.879 33 HG2 LYS 4 1HG LYS 4 -11.900 11.850 -13.555 34 HG3 LYS 4 2HG LYS 4 -11.386 10.247 -14.078 35 HD2 LYS 4 1HD LYS 4 -11.855 9.343 -11.850 36 HD3 LYS 4 2HD LYS 4 -12.319 10.943 -11.282 37 HE2 LYS 4 1HE LYS 4 -14.320 9.662 -11.844 38 HE3 LYS 4 2HE LYS 4 -14.127 10.989 -12.987 39 HZ1 LYS 4 3HZ LYS 4 -14.180 9.481 -14.591 40 HZ2 LYS 4 1HZ LYS 4 -14.151 8.199 -13.479 41 HZ3 LYS 4 2HZ LYS 4 -12.694 8.879 -14.029 42 H LEU 5 H LEU 5 -8.656 13.077 -11.683 43 HA LEU 5 HA LEU 5 -5.915 13.765 -12.250 44 HB2 LEU 5 1HB LEU 5 -7.764 14.132 -9.892 45 HB3 LEU 5 2HB LEU 5 -6.051 14.493 -9.724 46 HG LEU 5 HG LEU 5 -6.192 16.088 -11.587 47 HD11 LEU 5 1HD1 LEU 5 -9.084 15.185 -11.661 48 HD12 LEU 5 2HD1 LEU 5 -7.911 15.160 -12.976 49 HD13 LEU 5 3HD1 LEU 5 -8.544 16.696 -12.393 50 HD21 LEU 5 3HD2 LEU 5 -7.564 17.774 -10.451 51 HD22 LEU 5 1HD2 LEU 5 -6.642 16.835 -9.276 52 HD23 LEU 5 2HD2 LEU 5 -8.359 16.510 -9.511 53 H ILE 6 H ILE 6 -4.054 12.975 -11.368 54 HA ILE 6 HA ILE 6 -4.195 10.348 -9.963 55 HB ILE 6 HB ILE 6 -2.086 11.452 -11.840 56 HG12 ILE 6 1HG1 ILE 6 -3.946 9.076 -12.191 57 HG13 ILE 6 2HG1 ILE 6 -4.281 10.676 -12.855 58 HG21 ILE 6 1HG2 ILE 6 -0.982 10.073 -10.208 59 HG22 ILE 6 2HG2 ILE 6 -1.177 9.068 -11.638 60 HG23 ILE 6 3HG2 ILE 6 -2.262 8.862 -10.265 61 HD11 ILE 6 3HD1 ILE 6 -3.187 9.200 -14.520 62 HD12 ILE 6 1HD1 ILE 6 -1.800 9.037 -13.453 63 HD13 ILE 6 2HD1 ILE 6 -2.198 10.607 -14.147 64 H ALA 7 H ALA 7 -3.343 10.235 -7.993 65 HA ALA 7 HA ALA 7 -2.128 12.519 -6.733 66 HB1 ALA 7 3HB ALA 7 -2.612 9.673 -5.831 67 HB2 ALA 7 1HB ALA 7 -3.522 11.113 -5.379 68 HB3 ALA 7 2HB ALA 7 -1.873 10.896 -4.798 69 H GLN 8 H GLN 8 -0.015 12.814 -6.112 70 HA GLN 8 HA GLN 8 2.016 10.820 -6.986 71 HB2 GLN 8 1HB GLN 8 2.038 13.806 -7.514 72 HB3 GLN 8 2HB GLN 8 3.424 12.743 -7.751 73 HG2 GLN 8 1HG GLN 8 2.146 11.402 -9.365 74 HG3 GLN 8 2HG GLN 8 0.733 12.426 -9.114 75 HE21 GLN 8 2HE2 GLN 8 3.399 12.002 -11.137 76 HE22 GLN 8 1HE2 GLN 8 3.465 13.565 -11.798 77 H VAL 9 H VAL 9 3.294 10.279 -5.378 78 HA VAL 9 HA VAL 9 4.120 12.272 -3.346 79 HB VAL 9 HB VAL 9 3.733 10.593 -1.543 80 HG11 VAL 9 1HG1 VAL 9 1.325 10.968 -1.387 81 HG12 VAL 9 2HG1 VAL 9 1.238 11.300 -3.117 82 HG13 VAL 9 3HG1 VAL 9 2.095 12.410 -2.048 83 HG21 VAL 9 3HG2 VAL 9 2.242 9.134 -3.746 84 HG22 VAL 9 1HG2 VAL 9 2.199 8.705 -2.038 85 HG23 VAL 9 2HG2 VAL 9 3.705 8.569 -2.941 86 H LYS 10 H LYS 10 6.187 12.008 -2.636 87 HA LYS 10 HA LYS 10 7.659 9.523 -3.120 88 HB2 LYS 10 1HB LYS 10 7.797 10.798 -5.259 89 HB3 LYS 10 2HB LYS 10 8.563 12.122 -4.389 90 HG2 LYS 10 1HG LYS 10 10.394 10.616 -3.689 91 HG3 LYS 10 2HG LYS 10 9.632 9.282 -4.546 92 HD2 LYS 10 1HD LYS 10 10.445 11.855 -5.934 93 HD3 LYS 10 2HD LYS 10 11.541 10.488 -5.773 94 HE2 LYS 10 1HE LYS 10 9.723 9.071 -6.898 95 HE3 LYS 10 2HE LYS 10 8.921 10.590 -7.290 96 HZ1 LYS 10 3HZ LYS 10 10.574 11.221 -8.702 97 HZ2 LYS 10 1HZ LYS 10 10.639 9.540 -8.921 98 HZ3 LYS 10 2HZ LYS 10 11.769 10.309 -7.912 99 H THR 11 H THR 11 9.301 9.241 -1.719 100 HA THR 11 HA THR 11 10.377 11.513 -0.183 101 HB THR 11 HB THR 11 8.516 10.846 1.202 102 HG1 THR 11 HG1 THR 11 10.184 11.246 2.498 103 HG21 THR 11 3HG2 THR 11 8.157 8.609 0.235 104 HG22 THR 11 1HG2 THR 11 8.271 8.526 1.993 105 HG23 THR 11 2HG2 THR 11 9.642 8.040 0.996 106 H VAL 12 H VAL 12 12.406 11.178 0.624 107 HA VAL 12 HA VAL 12 13.842 8.826 -0.428 108 HB VAL 12 HB VAL 12 14.961 11.294 0.931 109 HG11 VAL 12 1HG1 VAL 12 17.037 10.570 -0.270 110 HG12 VAL 12 2HG1 VAL 12 16.198 9.103 -0.772 111 HG13 VAL 12 3HG1 VAL 12 16.505 9.404 0.938 112 HG21 VAL 12 3HG2 VAL 12 14.625 10.658 -2.018 113 HG22 VAL 12 1HG2 VAL 12 15.432 12.081 -1.359 114 HG23 VAL 12 2HG2 VAL 12 13.698 11.863 -1.125 115 H ILE 13 H ILE 13 14.322 7.152 0.813 116 HA ILE 13 HA ILE 13 14.544 7.500 3.768 117 HB ILE 13 HB ILE 13 13.256 5.167 2.317 118 HG12 ILE 13 1HG1 ILE 13 11.973 7.236 4.138 119 HG13 ILE 13 2HG1 ILE 13 11.927 7.342 2.380 120 HG21 ILE 13 1HG2 ILE 13 12.628 4.542 4.705 121 HG22 ILE 13 2HG2 ILE 13 13.731 5.802 5.252 122 HG23 ILE 13 3HG2 ILE 13 14.347 4.419 4.351 123 HD11 ILE 13 3HD1 ILE 13 9.881 6.280 3.225 124 HD12 ILE 13 1HD1 ILE 13 10.844 5.047 4.039 125 HD13 ILE 13 2HD1 ILE 13 10.825 5.132 2.277 126 H ASN 14 H ASN 14 16.343 6.693 4.623 127 HA ASN 14 HA ASN 14 18.232 5.237 2.905 128 HB2 ASN 14 1HB ASN 14 19.805 5.591 4.783 129 HB3 ASN 14 2HB ASN 14 19.108 7.100 4.197 130 HD21 ASN 14 2HD2 ASN 14 20.093 7.260 6.727 131 HD22 ASN 14 1HD2 ASN 14 18.848 7.231 7.884 132 H ALA 15 H ALA 15 17.582 3.126 2.775 133 HA ALA 15 HA ALA 15 18.049 1.451 5.038 134 HB1 ALA 15 3HB ALA 15 15.752 2.372 5.512 135 HB2 ALA 15 1HB ALA 15 15.844 0.614 5.464 136 HB3 ALA 15 2HB ALA 15 15.185 1.506 4.089 137 HA PRO 16 HA PRO 16 18.821 -1.473 1.778 138 HB2 PRO 16 1HB PRO 16 17.474 -3.607 3.420 139 HB3 PRO 16 2HB PRO 16 19.111 -3.592 2.728 140 HG2 PRO 16 1HG PRO 16 18.735 -3.221 5.341 141 HG3 PRO 16 2HG PRO 16 19.966 -2.293 4.455 142 HD2 PRO 16 1HD PRO 16 17.240 -1.393 5.389 143 HD3 PRO 16 2HD PRO 16 18.790 -0.526 5.378 144 H ILE 17 H ILE 17 17.815 -2.372 0.009 145 HA ILE 17 HA ILE 17 15.122 -1.697 -0.565 146 HB ILE 17 HB ILE 17 16.953 -1.911 -2.250 147 HG12 ILE 17 1HG1 ILE 17 15.602 -3.126 -3.987 148 HG13 ILE 17 2HG1 ILE 17 14.507 -3.661 -2.720 149 HG21 ILE 17 1HG2 ILE 17 16.542 -4.901 -1.969 150 HG22 ILE 17 2HG2 ILE 17 17.881 -4.032 -1.218 151 HG23 ILE 17 3HG2 ILE 17 17.725 -4.062 -2.972 152 HD11 ILE 17 3HD1 ILE 17 13.959 -1.518 -4.140 153 HD12 ILE 17 1HD1 ILE 17 15.054 -0.712 -3.022 154 HD13 ILE 17 2HD1 ILE 17 13.613 -1.532 -2.413 155 H GLU 18 H GLU 18 16.659 -4.721 0.471 156 HA GLU 18 HA GLU 18 14.514 -6.469 -0.024 157 HB2 GLU 18 1HB GLU 18 16.686 -6.582 2.086 158 HB3 GLU 18 2HB GLU 18 15.586 -7.911 1.726 159 HG2 GLU 18 1HG GLU 18 16.388 -7.977 -0.590 160 HG3 GLU 18 2HG GLU 18 17.471 -6.621 -0.268 161 H LYS 19 H LYS 19 15.398 -4.766 2.969 162 HA LYS 19 HA LYS 19 13.222 -5.759 4.474 163 HB2 LYS 19 1HB LYS 19 14.986 -3.334 4.891 164 HB3 LYS 19 2HB LYS 19 13.779 -3.879 6.059 165 HG2 LYS 19 1HG LYS 19 14.877 -6.106 6.139 166 HG3 LYS 19 2HG LYS 19 16.101 -5.529 5.011 167 HD2 LYS 19 1HD LYS 19 16.786 -3.805 6.633 168 HD3 LYS 19 2HD LYS 19 15.555 -4.379 7.757 169 HE2 LYS 19 1HE LYS 19 16.622 -6.606 7.791 170 HE3 LYS 19 2HE LYS 19 17.866 -6.020 6.688 171 HZ1 LYS 19 3HZ LYS 19 18.727 -5.856 8.867 172 HZ2 LYS 19 1HZ LYS 19 17.326 -5.097 9.450 173 HZ3 LYS 19 2HZ LYS 19 18.354 -4.274 8.377 174 H VAL 20 H VAL 20 13.533 -2.772 2.566 175 HA VAL 20 HA VAL 20 11.013 -1.706 3.376 176 HB VAL 20 HB VAL 20 12.627 -1.212 0.855 177 HG11 VAL 20 1HG1 VAL 20 11.236 0.910 0.771 178 HG12 VAL 20 2HG1 VAL 20 10.190 0.195 1.998 179 HG13 VAL 20 3HG1 VAL 20 10.337 -0.563 0.411 180 HG21 VAL 20 3HG2 VAL 20 13.358 0.799 2.037 181 HG22 VAL 20 1HG2 VAL 20 13.709 -0.616 3.029 182 HG23 VAL 20 2HG2 VAL 20 12.320 0.404 3.404 183 H TRP 21 H TRP 21 12.049 -3.648 0.600 184 HA TRP 21 HA TRP 21 9.573 -3.898 -0.704 185 HB2 TRP 21 1HB TRP 21 11.810 -4.525 -1.641 186 HB3 TRP 21 2HB TRP 21 11.832 -5.918 -0.569 187 HD1 TRP 21 HD1 TRP 21 10.003 -7.851 -1.026 188 HE1 TRP 21 HE1 TRP 21 8.786 -8.531 -3.196 189 HE3 TRP 21 HE3 TRP 21 10.827 -3.674 -3.845 190 HZ2 TRP 21 HZ2 TRP 21 8.241 -7.449 -5.789 191 HZ3 TRP 21 HZ3 TRP 21 9.950 -3.523 -6.158 192 HH2 TRP 21 HH2 TRP 21 8.662 -5.403 -7.133 193 H GLU 22 H GLU 22 11.117 -5.797 1.848 194 HA GLU 22 HA GLU 22 9.228 -7.866 2.060 195 HB2 GLU 22 1HB GLU 22 11.496 -7.829 3.126 196 HB3 GLU 22 2HB GLU 22 10.885 -6.652 4.287 197 HG2 GLU 22 1HG GLU 22 9.185 -8.268 5.043 198 HG3 GLU 22 2HG GLU 22 9.769 -9.440 3.866 199 H ALA 23 H ALA 23 9.438 -4.737 3.740 200 HA ALA 23 HA ALA 23 7.271 -5.015 5.480 201 HB1 ALA 23 3HB ALA 23 8.209 -2.491 4.109 202 HB2 ALA 23 1HB ALA 23 8.913 -3.181 5.572 203 HB3 ALA 23 2HB ALA 23 7.253 -2.586 5.587 204 H LEU 24 H LEU 24 7.316 -4.224 2.064 205 HA LEU 24 HA LEU 24 4.611 -3.285 1.959 206 HB2 LEU 24 1HB LEU 24 6.692 -3.018 0.279 207 HB3 LEU 24 2HB LEU 24 5.954 -4.416 -0.486 208 HG LEU 24 HG LEU 24 5.086 -2.420 -1.545 209 HD11 LEU 24 1HD1 LEU 24 2.863 -3.309 0.294 210 HD12 LEU 24 2HD1 LEU 24 3.525 -4.391 -0.933 211 HD13 LEU 24 3HD1 LEU 24 2.778 -2.867 -1.407 212 HD21 LEU 24 3HD2 LEU 24 4.480 -0.492 -0.474 213 HD22 LEU 24 1HD2 LEU 24 5.447 -1.110 0.855 214 HD23 LEU 24 2HD2 LEU 24 3.698 -1.324 0.862 215 H VAL 25 H VAL 25 6.103 -6.404 1.080 216 HA VAL 25 HA VAL 25 3.389 -7.637 0.984 217 HB VAL 25 HB VAL 25 4.641 -9.453 -0.363 218 HG11 VAL 25 1HG1 VAL 25 3.129 -7.854 -1.425 219 HG12 VAL 25 2HG1 VAL 25 4.549 -8.088 -2.445 220 HG13 VAL 25 3HG1 VAL 25 4.405 -6.639 -1.452 221 HG21 VAL 25 3HG2 VAL 25 6.932 -8.605 0.343 222 HG22 VAL 25 1HG2 VAL 25 6.660 -7.205 -0.692 223 HG23 VAL 25 2HG2 VAL 25 6.729 -8.822 -1.393 224 H ASN 26 H ASN 26 3.497 -7.741 3.321 225 HA ASN 26 HA ASN 26 4.497 -10.330 4.133 226 HB2 ASN 26 1HB ASN 26 6.460 -8.918 4.447 227 HB3 ASN 26 2HB ASN 26 5.542 -7.880 5.526 228 HD21 ASN 26 2HD2 ASN 26 4.269 -10.793 6.220 229 HD22 ASN 26 1HD2 ASN 26 5.333 -11.321 7.428 230 HA PRO 27 HA PRO 27 0.590 -9.301 6.255 231 HB2 PRO 27 1HB PRO 27 -0.054 -11.837 7.132 232 HB3 PRO 27 2HB PRO 27 -0.345 -11.275 5.472 233 HG2 PRO 27 1HG PRO 27 1.905 -12.936 6.531 234 HG3 PRO 27 2HG PRO 27 0.973 -13.133 5.032 235 HD2 PRO 27 1HD PRO 27 3.438 -12.002 5.061 236 HD3 PRO 27 2HD PRO 27 2.193 -11.484 3.904 237 H GLU 28 H GLU 28 3.477 -10.596 7.542 238 HA GLU 28 HA GLU 28 2.625 -10.614 10.323 239 HB2 GLU 28 1HB GLU 28 4.397 -12.141 9.471 240 HB3 GLU 28 2HB GLU 28 5.423 -10.736 9.174 241 HG2 GLU 28 1HG GLU 28 5.405 -10.159 11.538 242 HG3 GLU 28 2HG GLU 28 4.255 -11.449 11.880 243 H ILE 29 H ILE 29 4.804 -8.595 8.337 244 HA ILE 29 HA ILE 29 5.268 -6.660 10.390 245 HB ILE 29 HB ILE 29 5.588 -6.452 7.383 246 HG12 ILE 29 1HG1 ILE 29 7.689 -6.818 9.552 247 HG13 ILE 29 2HG1 ILE 29 6.977 -8.167 8.671 248 HG21 ILE 29 1HG2 ILE 29 6.476 -4.620 9.627 249 HG22 ILE 29 2HG2 ILE 29 5.425 -4.204 8.274 250 HG23 ILE 29 3HG2 ILE 29 7.131 -4.532 7.994 251 HD11 ILE 29 3HD1 ILE 29 9.070 -7.530 7.595 252 HD12 ILE 29 1HD1 ILE 29 8.524 -5.859 7.458 253 HD13 ILE 29 2HD1 ILE 29 7.722 -7.126 6.532 254 H ILE 30 H ILE 30 3.037 -6.873 7.661 255 HA ILE 30 HA ILE 30 1.850 -4.336 7.867 256 HB ILE 30 HB ILE 30 0.762 -6.997 6.900 257 HG12 ILE 30 1HG1 ILE 30 1.514 -4.526 5.303 258 HG13 ILE 30 2HG1 ILE 30 2.670 -5.811 5.661 259 HG21 ILE 30 1HG2 ILE 30 -0.515 -4.243 6.847 260 HG22 ILE 30 2HG2 ILE 30 -1.199 -5.732 7.496 261 HG23 ILE 30 3HG2 ILE 30 -1.014 -5.535 5.755 262 HD11 ILE 30 3HD1 ILE 30 1.632 -6.178 3.456 263 HD12 ILE 30 1HD1 ILE 30 0.031 -6.161 4.197 264 HD13 ILE 30 2HD1 ILE 30 1.166 -7.457 4.577 265 H LYS 31 H LYS 31 1.102 -7.392 9.524 266 HA LYS 31 HA LYS 31 -1.180 -6.467 10.925 267 HB2 LYS 31 1HB LYS 31 -0.585 -8.864 10.637 268 HB3 LYS 31 2HB LYS 31 0.773 -8.636 11.737 269 HG2 LYS 31 1HG LYS 31 -0.755 -8.006 13.543 270 HG3 LYS 31 2HG LYS 31 -2.132 -8.131 12.445 271 HD2 LYS 31 1HD LYS 31 -1.675 -10.510 12.108 272 HD3 LYS 31 2HD LYS 31 -0.261 -10.404 13.154 273 HE2 LYS 31 1HE LYS 31 -2.174 -11.299 14.399 274 HE3 LYS 31 2HE LYS 31 -1.721 -9.717 15.031 275 HZ1 LYS 31 3HZ LYS 31 -4.178 -10.523 13.943 276 HZ2 LYS 31 1HZ LYS 31 -3.523 -9.316 12.945 277 HZ3 LYS 31 2HZ LYS 31 -3.756 -9.014 14.600 278 H GLU 32 H GLU 32 2.278 -6.366 11.632 279 HA GLU 32 HA GLU 32 2.036 -5.478 14.329 280 HB2 GLU 32 1HB GLU 32 4.298 -5.240 12.322 281 HB3 GLU 32 2HB GLU 32 4.433 -4.698 13.993 282 HG2 GLU 32 1HG GLU 32 3.666 -7.522 13.215 283 HG3 GLU 32 2HG GLU 32 5.315 -7.029 13.572 284 H TYR 33 H TYR 33 2.035 -3.856 11.225 285 HA TYR 33 HA TYR 33 2.418 -1.204 12.204 286 HB2 TYR 33 1HB TYR 33 1.439 -2.426 9.630 287 HB3 TYR 33 2HB TYR 33 1.211 -0.702 9.882 288 HD1 TYR 33 HD2 TYR 33 4.127 -2.764 11.081 289 HD2 TYR 33 HD1 TYR 33 2.738 0.183 8.268 290 HE1 TYR 33 HE2 TYR 33 6.448 -2.352 10.358 291 HE2 TYR 33 HE1 TYR 33 5.074 0.583 7.551 292 HH TYR 33 HH TYR 33 7.275 0.276 8.198 293 H MET 34 H MET 34 -0.396 -3.261 11.708 294 HA MET 34 HA MET 34 -2.222 -1.092 12.549 295 HB2 MET 34 1HB MET 34 -2.758 -3.826 11.354 296 HB3 MET 34 2HB MET 34 -3.994 -2.646 11.786 297 HG2 MET 34 1HG MET 34 -1.743 -2.091 9.835 298 HG3 MET 34 2HG MET 34 -3.355 -2.605 9.346 299 HE1 MET 34 3HE MET 34 -5.511 -1.397 10.329 300 HE2 MET 34 1HE MET 34 -5.119 -0.922 8.672 301 HE3 MET 34 2HE MET 34 -5.639 0.290 9.840 302 H PHE 35 H PHE 35 -4.150 -2.060 13.833 303 HA PHE 35 HA PHE 35 -3.184 -2.721 16.409 304 HB2 PHE 35 1HB PHE 35 -5.986 -2.817 15.265 305 HB3 PHE 35 2HB PHE 35 -5.600 -2.990 16.976 306 HD1 PHE 35 HD2 PHE 35 -4.499 -1.115 18.215 307 HD2 PHE 35 HD1 PHE 35 -5.939 -0.637 14.195 308 HE1 PHE 35 HE2 PHE 35 -4.395 1.349 18.470 309 HE2 PHE 35 HE1 PHE 35 -5.833 1.827 14.450 310 HZ PHE 35 HZ PHE 35 -5.062 2.820 16.589 311 H GLY 36 H GLY 36 -4.596 -4.736 13.852 312 HA2 GLY 36 1HA GLY 36 -3.335 -7.089 14.442 313 HA3 GLY 36 2HA GLY 36 -4.727 -7.104 15.518 314 H THR 37 H THR 37 -4.002 -6.420 12.089 315 HA THR 37 HA THR 37 -6.614 -7.572 11.308 316 HB THR 37 HB THR 37 -4.543 -6.128 9.631 317 HG1 THR 37 HG1 THR 37 -5.457 -4.405 10.356 318 HG21 THR 37 3HG2 THR 37 -6.534 -5.910 8.074 319 HG22 THR 37 1HG2 THR 37 -7.361 -7.098 9.078 320 HG23 THR 37 2HG2 THR 37 -5.884 -7.542 8.220 321 H THR 38 H THR 38 -6.783 -9.563 10.549 322 HA THR 38 HA THR 38 -4.450 -11.243 10.211 323 HB THR 38 HB THR 38 -6.125 -12.998 9.677 324 HG1 THR 38 HG1 THR 38 -8.139 -12.488 9.313 325 HG21 THR 38 3HG2 THR 38 -5.559 -12.633 12.004 326 HG22 THR 38 1HG2 THR 38 -7.296 -12.909 11.891 327 HG23 THR 38 2HG2 THR 38 -6.675 -11.272 12.102 328 H VAL 39 H VAL 39 -3.317 -10.436 8.433 329 HA VAL 39 HA VAL 39 -4.664 -10.297 5.814 330 HB VAL 39 HB VAL 39 -1.818 -9.610 6.595 331 HG11 VAL 39 1HG1 VAL 39 -3.443 -9.145 4.078 332 HG12 VAL 39 2HG1 VAL 39 -1.967 -10.086 4.223 333 HG13 VAL 39 3HG1 VAL 39 -1.916 -8.337 4.414 334 HG21 VAL 39 3HG2 VAL 39 -2.675 -7.249 6.376 335 HG22 VAL 39 1HG2 VAL 39 -3.361 -8.132 7.741 336 HG23 VAL 39 2HG2 VAL 39 -4.306 -7.907 6.270 337 H VAL 40 H VAL 40 -4.457 -11.819 4.302 338 HA VAL 40 HA VAL 40 -2.393 -13.955 4.646 339 HB VAL 40 HB VAL 40 -5.226 -14.277 3.623 340 HG11 VAL 40 1HG1 VAL 40 -2.943 -16.227 4.061 341 HG12 VAL 40 2HG1 VAL 40 -3.738 -15.847 2.533 342 HG13 VAL 40 3HG1 VAL 40 -4.613 -16.724 3.786 343 HG21 VAL 40 3HG2 VAL 40 -3.923 -15.165 6.218 344 HG22 VAL 40 1HG2 VAL 40 -5.560 -15.569 5.705 345 HG23 VAL 40 2HG2 VAL 40 -5.136 -13.894 6.058 346 H SER 41 H SER 41 -1.113 -14.254 2.965 347 HA SER 41 HA SER 41 -2.003 -13.710 0.231 348 HB2 SER 41 1HB SER 41 -0.078 -12.196 -0.213 349 HB3 SER 41 2HB SER 41 -1.233 -11.506 0.920 350 HG SER 41 HG SER 41 1.235 -11.640 1.368 351 H ASP 42 H ASP 42 -0.725 -14.614 -1.340 352 HA ASP 42 HA ASP 42 1.060 -16.792 -0.466 353 HB2 ASP 42 1HB ASP 42 -0.260 -16.134 -3.115 354 HB3 ASP 42 2HB ASP 42 0.840 -17.490 -2.875 355 H TRP 43 H TRP 43 1.066 -13.686 -1.890 356 HA TRP 43 HA TRP 43 2.742 -12.262 -2.530 357 HB2 TRP 43 1HB TRP 43 4.827 -14.337 -1.820 358 HB3 TRP 43 2HB TRP 43 4.934 -12.584 -1.719 359 HD1 TRP 43 HD1 TRP 43 2.602 -11.724 0.003 360 HE1 TRP 43 HE1 TRP 43 2.333 -12.516 2.440 361 HE3 TRP 43 HE3 TRP 43 5.474 -15.937 -0.112 362 HZ2 TRP 43 HZ2 TRP 43 3.226 -14.654 4.130 363 HZ3 TRP 43 HZ3 TRP 43 5.753 -17.332 1.914 364 HH2 TRP 43 HH2 TRP 43 4.633 -16.698 4.034 365 H LYS 44 H LYS 44 1.556 -13.726 -4.548 366 HA LYS 44 HA LYS 44 3.735 -13.847 -6.506 367 HB2 LYS 44 1HB LYS 44 3.088 -16.023 -7.383 368 HB3 LYS 44 2HB LYS 44 3.568 -16.165 -5.695 369 HG2 LYS 44 1HG LYS 44 1.212 -16.174 -5.010 370 HG3 LYS 44 2HG LYS 44 0.703 -16.003 -6.690 371 HD2 LYS 44 1HD LYS 44 1.852 -18.125 -7.234 372 HD3 LYS 44 2HD LYS 44 2.277 -18.312 -5.533 373 HE2 LYS 44 1HE LYS 44 -0.086 -18.366 -4.915 374 HE3 LYS 44 2HE LYS 44 -0.553 -18.086 -6.593 375 HZ1 LYS 44 3HZ LYS 44 0.698 -20.481 -5.401 376 HZ2 LYS 44 1HZ LYS 44 0.811 -20.178 -7.066 377 HZ3 LYS 44 2HZ LYS 44 -0.713 -20.374 -6.338 378 H GLU 45 H GLU 45 3.020 -13.761 -8.693 379 HA GLU 45 HA GLU 45 1.015 -11.905 -9.204 380 HB2 GLU 45 1HB GLU 45 2.908 -12.528 -10.733 381 HB3 GLU 45 2HB GLU 45 2.010 -13.977 -11.169 382 HG2 GLU 45 1HG GLU 45 0.153 -12.607 -11.988 383 HG3 GLU 45 2HG GLU 45 0.983 -11.142 -11.484 384 H GLY 46 H GLY 46 -1.102 -11.971 -9.426 385 HA2 GLY 46 1HA GLY 46 -3.217 -12.774 -10.031 386 HA3 GLY 46 2HA GLY 46 -2.527 -14.366 -10.298 387 H SER 47 H SER 47 -1.366 -13.497 -7.364 388 HA SER 47 HA SER 47 -3.050 -15.287 -5.943 389 HB2 SER 47 1HB SER 47 -0.809 -14.970 -5.168 390 HB3 SER 47 2HB SER 47 -1.041 -13.237 -5.005 391 HG SER 47 HG SER 47 -2.437 -15.260 -3.573 392 H GLN 48 H GLN 48 -4.844 -14.986 -4.787 393 HA GLN 48 HA GLN 48 -6.083 -12.321 -4.771 394 HB2 GLN 48 1HB GLN 48 -7.429 -14.339 -5.379 395 HB3 GLN 48 2HB GLN 48 -7.195 -14.951 -3.742 396 HG2 GLN 48 1HG GLN 48 -8.311 -12.975 -2.811 397 HG3 GLN 48 2HG GLN 48 -8.465 -12.280 -4.424 398 HE21 GLN 48 2HE2 GLN 48 -10.779 -12.768 -2.837 399 HE22 GLN 48 1HE2 GLN 48 -11.671 -14.024 -3.552 400 H ILE 49 H ILE 49 -6.627 -11.225 -2.881 401 HA ILE 49 HA ILE 49 -5.594 -12.288 -0.312 402 HB ILE 49 HB ILE 49 -4.667 -10.038 0.211 403 HG12 ILE 49 1HG1 ILE 49 -6.066 -8.967 -1.797 404 HG13 ILE 49 2HG1 ILE 49 -4.524 -8.284 -1.322 405 HG21 ILE 49 1HG2 ILE 49 -2.622 -10.332 -1.244 406 HG22 ILE 49 2HG2 ILE 49 -3.503 -11.583 -2.116 407 HG23 ILE 49 3HG2 ILE 49 -3.166 -11.780 -0.403 408 HD11 ILE 49 3HD1 ILE 49 -4.694 -10.343 -3.539 409 HD12 ILE 49 1HD1 ILE 49 -3.406 -9.183 -3.203 410 HD13 ILE 49 2HD1 ILE 49 -4.952 -8.625 -3.833 411 H VAL 50 H VAL 50 -6.569 -11.534 1.526 412 HA VAL 50 HA VAL 50 -8.866 -9.699 1.264 413 HB VAL 50 HB VAL 50 -10.309 -11.263 2.542 414 HG11 VAL 50 1HG1 VAL 50 -10.346 -11.113 0.030 415 HG12 VAL 50 2HG1 VAL 50 -10.862 -12.680 0.652 416 HG13 VAL 50 3HG1 VAL 50 -9.244 -12.488 -0.020 417 HG21 VAL 50 3HG2 VAL 50 -8.032 -13.205 2.022 418 HG22 VAL 50 1HG2 VAL 50 -9.619 -13.657 2.642 419 HG23 VAL 50 2HG2 VAL 50 -8.561 -12.623 3.600 420 H TRP 51 H TRP 51 -9.586 -8.820 3.246 421 HA TRP 51 HA TRP 51 -7.726 -9.118 5.559 422 HB2 TRP 51 1HB TRP 51 -8.963 -6.527 4.588 423 HB3 TRP 51 2HB TRP 51 -7.867 -6.728 5.948 424 HD1 TRP 51 HD1 TRP 51 -5.728 -8.632 4.501 425 HE1 TRP 51 HE1 TRP 51 -4.164 -7.626 2.735 426 HE3 TRP 51 HE3 TRP 51 -8.408 -4.483 3.239 427 HZ2 TRP 51 HZ2 TRP 51 -4.051 -5.351 1.013 428 HZ3 TRP 51 HZ3 TRP 51 -7.545 -2.907 1.531 429 HH2 TRP 51 HH2 TRP 51 -5.373 -3.335 0.418 430 H LYS 52 H LYS 52 -8.757 -9.717 7.326 431 HA LYS 52 HA LYS 52 -11.686 -9.474 7.464 432 HB2 LYS 52 1HB LYS 52 -10.366 -11.598 8.118 433 HB3 LYS 52 2HB LYS 52 -9.887 -10.712 9.564 434 HG2 LYS 52 1HG LYS 52 -11.833 -11.764 10.353 435 HG3 LYS 52 2HG LYS 52 -12.500 -10.236 9.789 436 HD2 LYS 52 1HD LYS 52 -13.974 -11.730 8.742 437 HD3 LYS 52 2HD LYS 52 -12.761 -11.585 7.471 438 HE2 LYS 52 1HE LYS 52 -13.215 -13.931 7.786 439 HE3 LYS 52 2HE LYS 52 -11.618 -13.618 8.472 440 HZ1 LYS 52 3HZ LYS 52 -12.524 -13.554 10.644 441 HZ2 LYS 52 1HZ LYS 52 -13.134 -14.957 9.909 442 HZ3 LYS 52 2HZ LYS 52 -14.121 -13.584 10.062 443 H GLY 53 H GLY 53 -12.774 -8.212 8.905 444 HA2 GLY 53 1HA GLY 53 -11.501 -6.866 11.111 445 HA3 GLY 53 2HA GLY 53 -11.793 -5.786 9.753 446 H GLU 54 H GLU 54 -13.026 -5.114 11.980 447 HA GLU 54 HA GLU 54 -15.864 -5.945 11.630 448 HB2 GLU 54 1HB GLU 54 -14.898 -6.733 13.768 449 HB3 GLU 54 2HB GLU 54 -14.501 -5.066 14.188 450 HG2 GLU 54 1HG GLU 54 -16.870 -4.453 14.128 451 HG3 GLU 54 2HG GLU 54 -17.299 -6.072 13.581 452 H TRP 55 H TRP 55 -17.209 -4.400 11.087 453 HA TRP 55 HA TRP 55 -16.492 -1.545 11.554 454 HB2 TRP 55 1HB TRP 55 -16.075 -2.105 9.209 455 HB3 TRP 55 2HB TRP 55 -17.688 -2.793 9.062 456 HD1 TRP 55 HD1 TRP 55 -16.284 0.600 10.327 457 HE1 TRP 55 HE1 TRP 55 -17.747 2.479 9.335 458 HE3 TRP 55 HE3 TRP 55 -19.602 -2.197 7.641 459 HZ2 TRP 55 HZ2 TRP 55 -20.026 2.754 7.626 460 HZ3 TRP 55 HZ3 TRP 55 -21.407 -1.105 6.342 461 HH2 TRP 55 HH2 TRP 55 -21.623 1.364 6.330 462 H LYS 56 H LYS 56 -17.903 -0.821 12.987 463 HA LYS 56 HA LYS 56 -19.873 -0.416 14.115 464 HB2 LYS 56 1HB LYS 56 -20.914 -0.729 11.286 465 HB3 LYS 56 2HB LYS 56 -21.875 -0.107 12.629 466 HG2 LYS 56 1HG LYS 56 -20.217 1.700 12.971 467 HG3 LYS 56 2HG LYS 56 -19.281 1.089 11.605 468 HD2 LYS 56 1HD LYS 56 -21.205 1.468 10.110 469 HD3 LYS 56 2HD LYS 56 -22.144 2.077 11.473 470 HE2 LYS 56 1HE LYS 56 -20.501 3.888 11.803 471 HE3 LYS 56 2HE LYS 56 -19.561 3.282 10.439 472 HZ1 LYS 56 3HZ LYS 56 -21.826 3.510 9.210 473 HZ2 LYS 56 1HZ LYS 56 -20.838 4.871 9.432 474 HZ3 LYS 56 2HZ LYS 56 -22.175 4.617 10.449 475 H GLY 57 H GLY 57 -18.991 -3.072 14.258 476 HA2 GLY 57 1HA GLY 57 -19.803 -5.037 15.206 477 HA3 GLY 57 2HA GLY 57 -21.441 -4.416 15.024 478 H LYS 58 H LYS 58 -20.400 -3.912 12.080 479 HA LYS 58 HA LYS 58 -21.365 -6.515 11.063 480 HB2 LYS 58 1HB LYS 58 -22.413 -4.389 10.276 481 HB3 LYS 58 2HB LYS 58 -20.868 -3.932 9.569 482 HG2 LYS 58 1HG LYS 58 -20.901 -5.892 8.113 483 HG3 LYS 58 2HG LYS 58 -22.394 -6.458 8.868 484 HD2 LYS 58 1HD LYS 58 -23.546 -4.400 8.116 485 HD3 LYS 58 2HD LYS 58 -22.057 -3.857 7.344 486 HE2 LYS 58 1HE LYS 58 -22.076 -5.825 5.878 487 HE3 LYS 58 2HE LYS 58 -23.538 -6.412 6.669 488 HZ1 LYS 58 3HZ LYS 58 -23.225 -4.342 4.688 489 HZ2 LYS 58 1HZ LYS 58 -24.216 -3.897 5.991 490 HZ3 LYS 58 2HZ LYS 58 -24.588 -5.278 5.077 491 H ALA 59 H ALA 59 -19.889 -7.978 10.550 492 HA ALA 59 HA ALA 59 -17.114 -7.403 10.219 493 HB1 ALA 59 3HB ALA 59 -17.847 -9.570 11.062 494 HB2 ALA 59 1HB ALA 59 -16.941 -9.790 9.565 495 HB3 ALA 59 2HB ALA 59 -18.701 -9.894 9.552 496 H TYR 60 H TYR 60 -15.964 -6.962 8.423 497 HA TYR 60 HA TYR 60 -17.256 -7.283 5.756 498 HB2 TYR 60 1HB TYR 60 -16.531 -5.104 5.078 499 HB3 TYR 60 2HB TYR 60 -17.376 -4.905 6.610 500 HD1 TYR 60 HD2 TYR 60 -16.043 -4.656 8.756 501 HD2 TYR 60 HD1 TYR 60 -14.197 -4.565 4.875 502 HE1 TYR 60 HE2 TYR 60 -14.007 -3.638 9.739 503 HE2 TYR 60 HE1 TYR 60 -12.167 -3.550 5.863 504 HH TYR 60 HH TYR 60 -12.030 -2.709 9.322 505 H GLU 61 H GLU 61 -15.843 -7.554 4.007 506 HA GLU 61 HA GLU 61 -12.985 -8.000 4.615 507 HB2 GLU 61 1HB GLU 61 -13.005 -10.152 3.468 508 HB3 GLU 61 2HB GLU 61 -14.100 -10.184 4.849 509 HG2 GLU 61 1HG GLU 61 -15.989 -9.651 3.259 510 HG3 GLU 61 2HG GLU 61 -14.855 -9.861 1.929 511 H ASP 62 H ASP 62 -11.681 -7.282 3.106 512 HA ASP 62 HA ASP 62 -12.772 -6.029 0.694 513 HB2 ASP 62 1HB ASP 62 -9.955 -6.090 1.809 514 HB3 ASP 62 2HB ASP 62 -10.511 -5.099 0.460 515 H LYS 63 H LYS 63 -11.473 -6.373 -1.383 516 HA LYS 63 HA LYS 63 -10.234 -9.012 -1.628 517 HB2 LYS 63 1HB LYS 63 -11.835 -9.740 -3.389 518 HB3 LYS 63 2HB LYS 63 -12.563 -9.613 -1.792 519 HG2 LYS 63 1HG LYS 63 -13.423 -7.348 -2.400 520 HG3 LYS 63 2HG LYS 63 -12.778 -7.571 -4.026 521 HD2 LYS 63 1HD LYS 63 -14.171 -9.565 -4.332 522 HD3 LYS 63 2HD LYS 63 -14.819 -9.371 -2.702 523 HE2 LYS 63 1HE LYS 63 -15.734 -7.169 -3.317 524 HE3 LYS 63 2HE LYS 63 -15.079 -7.347 -4.946 525 HZ1 LYS 63 3HZ LYS 63 -16.427 -9.605 -4.754 526 HZ2 LYS 63 1HZ LYS 63 -17.132 -8.169 -5.320 527 HZ3 LYS 63 2HZ LYS 63 -17.368 -8.655 -3.708 528 H GLY 64 H GLY 64 -8.674 -9.002 -3.042 529 HA2 GLY 64 1HA GLY 64 -8.779 -7.444 -5.504 530 HA3 GLY 64 2HA GLY 64 -7.544 -6.946 -4.346 531 H THR 65 H THR 65 -6.428 -7.692 -6.547 532 HA THR 65 HA THR 65 -5.217 -10.303 -5.945 533 HB THR 65 HB THR 65 -6.443 -9.704 -8.652 534 HG1 THR 65 HG1 THR 65 -8.124 -10.556 -7.762 535 HG21 THR 65 3HG2 THR 65 -4.860 -12.047 -7.561 536 HG22 THR 65 1HG2 THR 65 -4.450 -11.022 -8.937 537 HG23 THR 65 2HG2 THR 65 -5.817 -12.130 -9.038 538 H ILE 66 H ILE 66 -3.213 -10.656 -6.965 539 HA ILE 66 HA ILE 66 -1.692 -8.229 -7.402 540 HB ILE 66 HB ILE 66 -0.804 -11.099 -7.771 541 HG12 ILE 66 1HG1 ILE 66 -1.716 -10.847 -5.523 542 HG13 ILE 66 2HG1 ILE 66 0.036 -10.943 -5.438 543 HG21 ILE 66 1HG2 ILE 66 0.682 -8.495 -7.340 544 HG22 ILE 66 2HG2 ILE 66 0.769 -9.562 -8.742 545 HG23 ILE 66 3HG2 ILE 66 1.431 -10.082 -7.192 546 HD11 ILE 66 3HD1 ILE 66 -0.072 -8.313 -5.458 547 HD12 ILE 66 1HD1 ILE 66 -0.451 -9.184 -3.977 548 HD13 ILE 66 2HD1 ILE 66 -1.754 -8.561 -4.988 549 H LEU 67 H LEU 67 -1.447 -7.244 -9.272 550 HA LEU 67 HA LEU 67 -2.275 -8.526 -11.779 551 HB2 LEU 67 1HB LEU 67 -1.526 -5.726 -10.946 552 HB3 LEU 67 2HB LEU 67 -1.594 -6.133 -12.657 553 HG LEU 67 HG LEU 67 -3.726 -5.149 -11.721 554 HD11 LEU 67 1HD1 LEU 67 -5.103 -6.412 -13.079 555 HD12 LEU 67 2HD1 LEU 67 -4.427 -7.955 -12.560 556 HD13 LEU 67 3HD1 LEU 67 -3.541 -6.938 -13.697 557 HD21 LEU 67 3HD2 LEU 67 -5.090 -6.413 -10.206 558 HD22 LEU 67 1HD2 LEU 67 -3.481 -6.347 -9.496 559 HD23 LEU 67 2HD2 LEU 67 -4.029 -7.813 -10.307 560 H GLN 68 H GLN 68 0.656 -6.903 -10.553 561 HA GLN 68 HA GLN 68 2.312 -8.632 -12.320 562 HB2 GLN 68 1HB GLN 68 2.670 -5.657 -11.822 563 HB3 GLN 68 2HB GLN 68 3.805 -6.687 -12.693 564 HG2 GLN 68 1HG GLN 68 0.909 -6.299 -13.485 565 HG3 GLN 68 2HG GLN 68 2.253 -5.415 -14.201 566 HE21 GLN 68 2HE2 GLN 68 3.948 -6.797 -15.329 567 HE22 GLN 68 1HE2 GLN 68 3.455 -8.262 -16.032 568 H PHE 69 H PHE 69 4.078 -9.480 -11.375 569 HA PHE 69 HA PHE 69 4.874 -8.497 -8.680 570 HB2 PHE 69 1HB PHE 69 3.354 -10.470 -8.475 571 HB3 PHE 69 2HB PHE 69 4.519 -11.412 -9.395 572 HD1 PHE 69 HD2 PHE 69 3.883 -9.679 -6.186 573 HD2 PHE 69 HD1 PHE 69 6.690 -12.014 -8.455 574 HE1 PHE 69 HE2 PHE 69 5.212 -10.079 -4.135 575 HE2 PHE 69 HE1 PHE 69 8.015 -12.412 -6.402 576 HZ PHE 69 HZ PHE 69 7.279 -11.445 -4.242 577 H ASN 70 H ASN 70 6.832 -7.715 -9.115 578 HA ASN 70 HA ASN 70 8.841 -9.532 -10.365 579 HB2 ASN 70 1HB ASN 70 8.625 -6.517 -10.589 580 HB3 ASN 70 2HB ASN 70 9.956 -7.499 -11.201 581 HD21 ASN 70 2HD2 ASN 70 7.336 -5.941 -12.354 582 HD22 ASN 70 1HD2 ASN 70 6.878 -6.995 -13.605 583 H GLU 71 H GLU 71 9.543 -10.317 -8.433 584 HA GLU 71 HA GLU 71 9.976 -9.113 -6.025 585 HB2 GLU 71 1HB GLU 71 11.575 -10.856 -5.548 586 HB3 GLU 71 2HB GLU 71 10.280 -11.521 -6.538 587 HG2 GLU 71 1HG GLU 71 12.088 -12.380 -7.725 588 HG3 GLU 71 2HG GLU 71 11.948 -10.833 -8.552 589 H ARG 72 H ARG 72 11.102 -7.457 -5.357 590 HA ARG 72 HA ARG 72 12.672 -5.839 -5.114 591 HB2 ARG 72 1HB ARG 72 14.123 -7.940 -4.962 592 HB3 ARG 72 2HB ARG 72 14.570 -7.642 -6.639 593 HG2 ARG 72 1HG ARG 72 15.371 -5.365 -5.989 594 HG3 ARG 72 2HG ARG 72 14.960 -5.724 -4.322 595 HD2 ARG 72 1HD ARG 72 16.578 -7.547 -4.272 596 HD3 ARG 72 2HD ARG 72 16.943 -7.297 -5.983 597 HE ARG 72 HE ARG 72 17.346 -4.853 -4.709 598 HH11 ARG 72 1HH2 ARG 72 18.607 -8.069 -4.611 599 HH12 ARG 72 2HH2 ARG 72 20.195 -7.573 -4.115 600 HH21 ARG 72 1HH1 ARG 72 19.392 -4.194 -4.064 601 HH22 ARG 72 2HH1 ARG 72 20.641 -5.370 -3.804 602 H SER 73 H SER 73 10.981 -5.196 -7.125 603 HA SER 73 HA SER 73 12.592 -3.489 -8.761 604 HB2 SER 73 1HB SER 73 12.947 -5.584 -9.991 605 HB3 SER 73 2HB SER 73 11.210 -5.781 -10.152 606 HG SER 73 HG SER 73 12.747 -3.591 -11.104 607 H ILE 74 H ILE 74 9.516 -5.129 -9.486 608 HA ILE 74 HA ILE 74 8.058 -2.568 -9.065 609 HB ILE 74 HB ILE 74 7.862 -4.300 -11.554 610 HG12 ILE 74 1HG1 ILE 74 8.756 -1.410 -11.235 611 HG13 ILE 74 2HG1 ILE 74 9.863 -2.767 -11.400 612 HG21 ILE 74 1HG2 ILE 74 6.309 -1.861 -10.624 613 HG22 ILE 74 2HG2 ILE 74 5.659 -3.454 -11.008 614 HG23 ILE 74 3HG2 ILE 74 6.291 -2.431 -12.291 615 HD11 ILE 74 3HD1 ILE 74 7.810 -1.878 -13.437 616 HD12 ILE 74 1HD1 ILE 74 8.798 -3.334 -13.582 617 HD13 ILE 74 2HD1 ILE 74 9.563 -1.744 -13.576 618 H LEU 75 H LEU 75 6.187 -2.754 -8.092 619 HA LEU 75 HA LEU 75 4.787 -5.365 -8.024 620 HB2 LEU 75 1HB LEU 75 6.120 -5.118 -5.932 621 HB3 LEU 75 2HB LEU 75 5.278 -3.607 -5.607 622 HG LEU 75 HG LEU 75 3.101 -4.874 -5.586 623 HD11 LEU 75 1HD1 LEU 75 3.481 -7.458 -5.207 624 HD12 LEU 75 2HD1 LEU 75 4.961 -7.195 -6.132 625 HD13 LEU 75 3HD1 LEU 75 3.389 -6.827 -6.846 626 HD21 LEU 75 3HD2 LEU 75 4.452 -4.385 -3.517 627 HD22 LEU 75 1HD2 LEU 75 5.144 -6.004 -3.656 628 HD23 LEU 75 2HD2 LEU 75 3.412 -5.802 -3.393 629 H GLN 76 H GLN 76 2.745 -5.146 -8.593 630 HA GLN 76 HA GLN 76 1.292 -2.621 -7.995 631 HB2 GLN 76 1HB GLN 76 1.086 -4.108 -10.627 632 HB3 GLN 76 2HB GLN 76 0.352 -2.561 -10.199 633 HG2 GLN 76 1HG GLN 76 2.669 -1.625 -9.895 634 HG3 GLN 76 2HG GLN 76 3.309 -3.143 -10.510 635 HE21 GLN 76 2HE2 GLN 76 3.981 -2.741 -12.616 636 HE22 GLN 76 1HE2 GLN 76 3.059 -1.923 -13.785 637 H TYR 77 H TYR 77 -0.825 -2.883 -7.427 638 HA TYR 77 HA TYR 77 -2.102 -5.503 -7.762 639 HB2 TYR 77 1HB TYR 77 -2.678 -5.616 -5.324 640 HB3 TYR 77 2HB TYR 77 -0.975 -5.882 -5.681 641 HD1 TYR 77 HD1 TYR 77 -3.435 -3.290 -4.588 642 HD2 TYR 77 HD2 TYR 77 0.702 -4.454 -4.742 643 HE1 TYR 77 HE1 TYR 77 -2.845 -1.419 -3.076 644 HE2 TYR 77 HE2 TYR 77 1.282 -2.579 -3.238 645 HH TYR 77 HH TYR 77 -0.367 -1.180 -1.324 646 H SER 78 H SER 78 -4.305 -5.545 -7.447 647 HA SER 78 HA SER 78 -5.646 -2.932 -7.750 648 HB2 SER 78 1HB SER 78 -7.634 -4.421 -8.316 649 HB3 SER 78 2HB SER 78 -6.287 -4.508 -9.441 650 HG SER 78 HG SER 78 -6.571 -6.583 -9.025 651 H HIS 79 H HIS 79 -7.431 -2.370 -6.368 652 HA HIS 79 HA HIS 79 -7.979 -4.078 -4.070 653 HB2 HIS 79 1HB HIS 79 -6.158 -1.732 -3.922 654 HB3 HIS 79 2HB HIS 79 -7.419 -1.721 -2.693 655 HD1 HIS 79 HD1 HIS 79 -4.108 -2.753 -2.933 656 HD2 HIS 79 HD2 HIS 79 -7.545 -4.747 -1.680 657 HE1 HIS 79 HE1 HIS 79 -3.330 -4.730 -1.555 658 HE2 HIS 79 HE2 HIS 79 -5.414 -5.955 -0.778 659 H PHE 80 H PHE 80 -9.818 -3.674 -3.020 660 HA PHE 80 HA PHE 80 -11.481 -1.376 -3.827 661 HB2 PHE 80 1HB PHE 80 -12.151 -3.065 -5.406 662 HB3 PHE 80 2HB PHE 80 -12.231 -4.297 -4.148 663 HD1 PHE 80 HD2 PHE 80 -13.592 -0.865 -4.825 664 HD2 PHE 80 HD1 PHE 80 -14.408 -4.807 -3.324 665 HE1 PHE 80 HE2 PHE 80 -15.936 -0.211 -4.389 666 HE2 PHE 80 HE1 PHE 80 -16.754 -4.147 -2.880 667 HZ PHE 80 HZ PHE 80 -17.519 -1.848 -3.411 668 H SER 81 H SER 81 -12.701 -0.614 -2.234 669 HA SER 81 HA SER 81 -12.647 -2.013 0.380 670 HB2 SER 81 1HB SER 81 -11.607 0.202 0.332 671 HB3 SER 81 2HB SER 81 -13.116 0.905 -0.222 672 HG SER 81 HG SER 81 -12.374 -0.049 2.278 673 HA PRO 82 HA PRO 82 -17.076 -2.387 -0.599 674 HB2 PRO 82 1HB PRO 82 -17.844 -3.992 1.510 675 HB3 PRO 82 2HB PRO 82 -17.025 -4.616 0.062 676 HG2 PRO 82 1HG PRO 82 -15.890 -4.014 2.762 677 HG3 PRO 82 2HG PRO 82 -15.514 -5.343 1.651 678 HD2 PRO 82 1HD PRO 82 -13.934 -3.089 1.934 679 HD3 PRO 82 2HD PRO 82 -13.975 -4.067 0.454 680 H LEU 83 H LEU 83 -15.640 -1.108 2.256 681 HA LEU 83 HA LEU 83 -18.032 -0.225 3.565 682 HB2 LEU 83 1HB LEU 83 -15.223 0.877 3.816 683 HB3 LEU 83 2HB LEU 83 -16.540 1.074 4.974 684 HG LEU 83 HG LEU 83 -15.276 -1.570 4.186 685 HD11 LEU 83 1HD1 LEU 83 -15.018 0.144 6.672 686 HD12 LEU 83 2HD1 LEU 83 -13.745 -0.233 5.511 687 HD13 LEU 83 3HD1 LEU 83 -14.410 -1.507 6.535 688 HD21 LEU 83 3HD2 LEU 83 -17.486 -2.113 4.829 689 HD22 LEU 83 1HD2 LEU 83 -17.557 -0.834 6.045 690 HD23 LEU 83 2HD2 LEU 83 -16.596 -2.287 6.335 691 H THR 84 H THR 84 -16.425 0.783 0.782 692 HA THR 84 HA THR 84 -16.815 3.585 0.885 693 HB THR 84 HB THR 84 -16.805 1.894 -1.628 694 HG1 THR 84 HG1 THR 84 -15.052 1.300 -0.399 695 HG21 THR 84 3HG2 THR 84 -15.807 3.878 -2.629 696 HG22 THR 84 1HG2 THR 84 -15.778 4.688 -1.064 697 HG23 THR 84 2HG2 THR 84 -17.319 4.333 -1.842 698 H GLY 85 H GLY 85 -18.944 0.933 0.089 699 HA2 GLY 85 1HA GLY 85 -21.274 0.938 -0.019 700 HA3 GLY 85 2HA GLY 85 -21.260 2.693 0.125 701 H LYS 86 H LYS 86 -19.254 1.141 -2.251 702 HA LYS 86 HA LYS 86 -21.015 2.155 -4.422 703 HB2 LYS 86 1HB LYS 86 -18.021 1.821 -4.276 704 HB3 LYS 86 2HB LYS 86 -18.895 2.290 -5.734 705 HG2 LYS 86 1HG LYS 86 -19.302 3.869 -3.174 706 HG3 LYS 86 2HG LYS 86 -17.883 4.171 -4.164 707 HD2 LYS 86 1HD LYS 86 -19.330 4.640 -6.114 708 HD3 LYS 86 2HD LYS 86 -20.760 4.359 -5.121 709 HE2 LYS 86 1HE LYS 86 -18.653 6.443 -4.495 710 HE3 LYS 86 2HE LYS 86 -20.168 6.786 -5.329 711 HZ1 LYS 86 3HZ LYS 86 -20.828 5.321 -3.080 712 HZ2 LYS 86 1HZ LYS 86 -21.113 6.972 -3.349 713 HZ3 LYS 86 2HZ LYS 86 -19.694 6.473 -2.558 714 HA PRO 87 HA PRO 87 -21.303 -2.448 -4.934 715 HB2 PRO 87 1HB PRO 87 -23.136 -1.384 -7.092 716 HB3 PRO 87 2HB PRO 87 -23.386 -2.758 -5.988 717 HG2 PRO 87 1HG PRO 87 -24.614 -0.450 -5.535 718 HG3 PRO 87 2HG PRO 87 -23.918 -1.372 -4.185 719 HD2 PRO 87 1HD PRO 87 -22.859 1.116 -5.511 720 HD3 PRO 87 2HD PRO 87 -22.789 0.641 -3.798 721 H ASP 88 H ASP 88 -21.271 -3.691 -7.205 722 HA ASP 88 HA ASP 88 -18.841 -3.596 -8.367 723 HB2 ASP 88 1HB ASP 88 -21.482 -4.223 -9.695 724 HB3 ASP 88 2HB ASP 88 -19.918 -4.590 -10.419 725 H LEU 89 H LEU 89 -18.026 -1.525 -8.662 726 HA LEU 89 HA LEU 89 -18.925 -0.137 -11.137 727 HB2 LEU 89 1HB LEU 89 -18.475 1.062 -8.402 728 HB3 LEU 89 2HB LEU 89 -18.326 2.046 -9.859 729 HG LEU 89 HG LEU 89 -20.822 0.362 -9.484 730 HD11 LEU 89 1HD1 LEU 89 -20.672 1.528 -7.360 731 HD12 LEU 89 2HD1 LEU 89 -21.905 2.312 -8.346 732 HD13 LEU 89 3HD1 LEU 89 -20.311 3.050 -8.174 733 HD21 LEU 89 3HD2 LEU 89 -20.410 3.122 -10.687 734 HD22 LEU 89 1HD2 LEU 89 -21.853 2.119 -10.807 735 HD23 LEU 89 2HD2 LEU 89 -20.371 1.629 -11.622 736 HA PRO 90 HA PRO 90 -14.402 -1.169 -11.362 737 HB2 PRO 90 1HB PRO 90 -15.039 -0.547 -14.243 738 HB3 PRO 90 2HB PRO 90 -14.098 -1.897 -13.568 739 HG2 PRO 90 1HG PRO 90 -16.579 -2.288 -14.459 740 HG3 PRO 90 2HG PRO 90 -15.999 -3.105 -12.991 741 HD2 PRO 90 1HD PRO 90 -17.838 -0.725 -13.217 742 HD3 PRO 90 2HD PRO 90 -17.889 -2.082 -12.069 743 H GLU 91 H GLU 91 -16.269 1.605 -12.213 744 HA GLU 91 HA GLU 91 -13.969 3.303 -12.853 745 HB2 GLU 91 1HB GLU 91 -16.915 3.946 -12.526 746 HB3 GLU 91 2HB GLU 91 -15.682 5.068 -13.099 747 HG2 GLU 91 1HG GLU 91 -16.318 2.420 -14.429 748 HG3 GLU 91 2HG GLU 91 -16.980 3.966 -14.949 749 H ASN 92 H ASN 92 -15.819 2.369 -10.108 750 HA ASN 92 HA ASN 92 -15.328 4.708 -8.509 751 HB2 ASN 92 1HB ASN 92 -17.260 3.270 -8.109 752 HB3 ASN 92 2HB ASN 92 -16.195 1.925 -7.712 753 HD21 ASN 92 2HD2 ASN 92 -16.566 5.382 -6.737 754 HD22 ASN 92 1HD2 ASN 92 -16.347 5.084 -5.080 755 H TYR 93 H TYR 93 -13.782 1.533 -8.797 756 HA TYR 93 HA TYR 93 -11.824 2.268 -6.710 757 HB2 TYR 93 1HB TYR 93 -11.429 0.004 -6.401 758 HB3 TYR 93 2HB TYR 93 -13.085 -0.044 -6.971 759 HD1 TYR 93 HD1 TYR 93 -12.743 0.428 -9.883 760 HD2 TYR 93 HD2 TYR 93 -10.492 -2.045 -7.192 761 HE1 TYR 93 HE1 TYR 93 -12.052 -1.023 -11.777 762 HE2 TYR 93 HE2 TYR 93 -9.808 -3.488 -9.077 763 HH TYR 93 HH TYR 93 -11.208 -3.150 -12.253 764 H HIS 94 H HIS 94 -9.537 1.466 -7.159 765 HA HIS 94 HA HIS 94 -8.660 1.864 -9.945 766 HB2 HIS 94 1HB HIS 94 -6.869 3.510 -9.012 767 HB3 HIS 94 2HB HIS 94 -8.497 4.117 -9.278 768 HD1 HIS 94 HD1 HIS 94 -8.812 5.769 -7.425 769 HD2 HIS 94 HD2 HIS 94 -7.243 2.165 -6.041 770 HE1 HIS 94 HE1 HIS 94 -8.763 5.936 -4.900 771 HE2 HIS 94 HE2 HIS 94 -7.807 3.745 -4.039 772 H VAL 95 H VAL 95 -6.273 1.593 -10.127 773 HA VAL 95 HA VAL 95 -5.375 -0.665 -8.414 774 HB VAL 95 HB VAL 95 -5.670 -1.207 -10.803 775 HG11 VAL 95 1HG1 VAL 95 -5.174 1.149 -11.607 776 HG12 VAL 95 2HG1 VAL 95 -4.382 -0.132 -12.523 777 HG13 VAL 95 3HG1 VAL 95 -3.464 0.802 -11.345 778 HG21 VAL 95 3HG2 VAL 95 -3.501 -2.232 -11.132 779 HG22 VAL 95 1HG2 VAL 95 -3.842 -2.243 -9.402 780 HG23 VAL 95 2HG2 VAL 95 -2.726 -1.054 -10.073 781 H VAL 96 H VAL 96 -3.598 -0.466 -7.248 782 HA VAL 96 HA VAL 96 -2.139 2.093 -7.268 783 HB VAL 96 HB VAL 96 -1.912 -0.201 -5.310 784 HG11 VAL 96 1HG1 VAL 96 -1.029 1.612 -3.836 785 HG12 VAL 96 2HG1 VAL 96 -1.103 2.719 -5.205 786 HG13 VAL 96 3HG1 VAL 96 -0.016 1.331 -5.251 787 HG21 VAL 96 3HG2 VAL 96 -4.222 0.649 -5.378 788 HG22 VAL 96 1HG2 VAL 96 -3.626 2.300 -5.213 789 HG23 VAL 96 2HG2 VAL 96 -3.427 1.154 -3.888 790 H THR 97 H THR 97 -0.095 2.324 -7.871 791 HA THR 97 HA THR 97 1.501 -0.104 -8.541 792 HB THR 97 HB THR 97 0.705 0.871 -10.621 793 HG1 THR 97 HG1 THR 97 3.396 1.637 -10.186 794 HG21 THR 97 3HG2 THR 97 0.428 3.223 -9.602 795 HG22 THR 97 1HG2 THR 97 1.054 3.138 -11.250 796 HG23 THR 97 2HG2 THR 97 2.157 3.418 -9.907 797 H ILE 98 H ILE 98 3.323 -0.225 -7.498 798 HA ILE 98 HA ILE 98 4.608 2.252 -6.449 799 HB ILE 98 HB ILE 98 4.585 -0.515 -5.207 800 HG12 ILE 98 1HG1 ILE 98 3.218 2.029 -4.253 801 HG13 ILE 98 2HG1 ILE 98 2.379 0.757 -5.136 802 HG21 ILE 98 1HG2 ILE 98 5.718 2.159 -4.320 803 HG22 ILE 98 2HG2 ILE 98 6.627 0.699 -4.693 804 HG23 ILE 98 3HG2 ILE 98 5.593 0.747 -3.272 805 HD11 ILE 98 3HD1 ILE 98 3.740 0.511 -2.454 806 HD12 ILE 98 1HD1 ILE 98 3.117 -0.865 -3.361 807 HD13 ILE 98 2HD1 ILE 98 2.015 0.385 -2.784 808 H THR 99 H THR 99 6.641 2.579 -7.026 809 HA THR 99 HA THR 99 8.173 0.370 -8.331 810 HB THR 99 HB THR 99 8.391 3.350 -8.859 811 HG1 THR 99 HG1 THR 99 6.788 3.004 -10.141 812 HG21 THR 99 3HG2 THR 99 9.719 2.499 -10.837 813 HG22 THR 99 1HG2 THR 99 9.676 0.898 -10.103 814 HG23 THR 99 2HG2 THR 99 10.490 2.225 -9.275 815 H LEU 100 H LEU 100 9.878 -0.272 -7.219 816 HA LEU 100 HA LEU 100 11.171 1.608 -5.298 817 HB2 LEU 100 1HB LEU 100 10.876 -1.407 -5.196 818 HB3 LEU 100 2HB LEU 100 11.845 -0.464 -4.067 819 HG LEU 100 HG LEU 100 8.924 0.223 -4.479 820 HD11 LEU 100 1HD1 LEU 100 10.022 -1.832 -2.544 821 HD12 LEU 100 2HD1 LEU 100 8.968 -2.172 -3.916 822 HD13 LEU 100 3HD1 LEU 100 8.366 -1.224 -2.556 823 HD21 LEU 100 3HD2 LEU 100 10.810 0.479 -2.111 824 HD22 LEU 100 1HD2 LEU 100 9.131 1.022 -2.146 825 HD23 LEU 100 2HD2 LEU 100 10.325 1.790 -3.177 826 H THR 101 H THR 101 13.145 2.194 -5.733 827 HA THR 101 HA THR 101 14.897 0.445 -7.396 828 HB THR 101 HB THR 101 15.814 2.473 -8.434 829 HG1 THR 101 HG1 THR 101 15.416 3.991 -6.881 830 HG21 THR 101 3HG2 THR 101 13.931 2.962 -9.877 831 HG22 THR 101 1HG2 THR 101 12.796 2.421 -8.642 832 HG23 THR 101 2HG2 THR 101 13.855 1.256 -9.434 833 H ALA 102 H ALA 102 16.918 0.175 -6.690 834 HA ALA 102 HA ALA 102 17.647 1.380 -4.092 835 HB1 ALA 102 3HB ALA 102 19.055 -0.839 -5.596 836 HB2 ALA 102 1HB ALA 102 17.738 -1.111 -4.454 837 HB3 ALA 102 2HB ALA 102 19.249 -0.389 -3.900 838 H LEU 103 H LEU 103 18.588 3.316 -4.368 839 HA LEU 103 HA LEU 103 20.471 3.794 -6.574 840 HB2 LEU 103 1HB LEU 103 19.578 5.712 -4.406 841 HB3 LEU 103 2HB LEU 103 20.303 6.105 -5.964 842 HG LEU 103 HG LEU 103 17.580 4.852 -5.508 843 HD11 LEU 103 1HD1 LEU 103 16.790 6.986 -6.541 844 HD12 LEU 103 2HD1 LEU 103 18.454 7.572 -6.522 845 HD13 LEU 103 3HD1 LEU 103 17.623 7.226 -5.004 846 HD21 LEU 103 3HD2 LEU 103 17.401 5.303 -8.067 847 HD22 LEU 103 1HD2 LEU 103 18.334 3.901 -7.554 848 HD23 LEU 103 2HD2 LEU 103 19.164 5.378 -8.044 849 H LYS 104 H LYS 104 22.458 5.074 -5.954 850 HA LYS 104 HA LYS 104 24.156 3.486 -4.373 851 HB2 LYS 104 1HB LYS 104 24.496 6.291 -5.421 852 HB3 LYS 104 2HB LYS 104 25.797 5.356 -4.686 853 HG2 LYS 104 1HG LYS 104 25.407 3.566 -6.393 854 HG3 LYS 104 2HG LYS 104 24.226 4.613 -7.174 855 HD2 LYS 104 1HD LYS 104 27.126 5.374 -6.704 856 HD3 LYS 104 2HD LYS 104 26.520 4.699 -8.213 857 HE2 LYS 104 1HE LYS 104 24.842 6.659 -8.233 858 HE3 LYS 104 2HE LYS 104 25.843 7.374 -6.969 859 HZ1 LYS 104 3HZ LYS 104 26.638 8.204 -9.003 860 HZ2 LYS 104 1HZ LYS 104 26.647 6.670 -9.728 861 HZ3 LYS 104 2HZ LYS 104 27.768 7.037 -8.506 862 H LYS 105 H LYS 105 22.575 6.561 -3.619 863 HA LYS 105 HA LYS 105 23.829 6.862 -1.047 864 HB2 LYS 105 1HB LYS 105 21.451 8.228 -2.324 865 HB3 LYS 105 2HB LYS 105 22.097 8.669 -0.745 866 HG2 LYS 105 1HG LYS 105 24.289 9.150 -1.766 867 HG3 LYS 105 2HG LYS 105 23.654 8.701 -3.348 868 HD2 LYS 105 1HD LYS 105 21.996 10.508 -3.224 869 HD3 LYS 105 2HD LYS 105 22.568 10.938 -1.613 870 HE2 LYS 105 1HE LYS 105 23.555 12.432 -3.296 871 HE3 LYS 105 2HE LYS 105 24.805 11.439 -2.547 872 HZ1 LYS 105 3HZ LYS 105 24.677 9.925 -4.428 873 HZ2 LYS 105 1HZ LYS 105 25.054 11.496 -4.946 874 HZ3 LYS 105 2HZ LYS 105 23.481 10.891 -5.149 875 H GLY 106 H GLY 106 20.701 5.661 -2.203 876 HA2 GLY 106 1HA GLY 106 20.347 3.967 0.042 877 HA3 GLY 106 2HA GLY 106 19.352 5.410 0.209 878 H VAL 107 H VAL 107 17.354 4.564 -0.118 879 HA VAL 107 HA VAL 107 16.797 3.291 -2.754 880 HB VAL 107 HB VAL 107 16.621 1.591 -1.048 881 HG11 VAL 107 1HG1 VAL 107 14.730 3.451 0.412 882 HG12 VAL 107 2HG1 VAL 107 16.395 3.129 0.893 883 HG13 VAL 107 3HG1 VAL 107 15.203 1.833 0.918 884 HG21 VAL 107 3HG2 VAL 107 14.811 1.756 -2.826 885 HG22 VAL 107 1HG2 VAL 107 13.790 2.534 -1.614 886 HG23 VAL 107 2HG2 VAL 107 14.347 0.880 -1.370 887 H GLU 108 H GLU 108 15.242 4.164 -3.927 888 HA GLU 108 HA GLU 108 13.723 6.458 -2.831 889 HB2 GLU 108 1HB GLU 108 15.020 6.805 -4.928 890 HB3 GLU 108 2HB GLU 108 14.052 5.554 -5.707 891 HG2 GLU 108 1HG GLU 108 12.006 6.868 -5.341 892 HG3 GLU 108 2HG GLU 108 12.927 8.087 -4.464 893 H VAL 109 H VAL 109 11.542 6.492 -2.783 894 HA VAL 109 HA VAL 109 10.064 4.078 -3.698 895 HB VAL 109 HB VAL 109 8.848 3.944 -1.682 896 HG11 VAL 109 1HG1 VAL 109 10.540 3.678 0.035 897 HG12 VAL 109 2HG1 VAL 109 11.634 4.768 -0.814 898 HG13 VAL 109 3HG1 VAL 109 11.237 3.201 -1.510 899 HG21 VAL 109 3HG2 VAL 109 8.255 6.245 -1.271 900 HG22 VAL 109 1HG2 VAL 109 9.940 6.710 -1.076 901 HG23 VAL 109 2HG2 VAL 109 9.155 5.719 0.149 902 H GLU 110 H GLU 110 8.170 4.413 -4.701 903 HA GLU 110 HA GLU 110 6.960 7.104 -4.705 904 HB2 GLU 110 1HB GLU 110 8.606 6.881 -6.640 905 HB3 GLU 110 2HB GLU 110 7.556 5.628 -7.290 906 HG2 GLU 110 1HG GLU 110 6.579 8.424 -6.623 907 HG3 GLU 110 2HG GLU 110 7.158 7.960 -8.218 908 H LEU 111 H LEU 111 4.838 7.035 -4.633 909 HA LEU 111 HA LEU 111 3.393 4.535 -5.366 910 HB2 LEU 111 1HB LEU 111 3.587 4.851 -2.899 911 HB3 LEU 111 2HB LEU 111 2.749 6.388 -3.047 912 HG LEU 111 HG LEU 111 1.333 4.053 -4.317 913 HD11 LEU 111 1HD1 LEU 111 2.206 3.003 -2.254 914 HD12 LEU 111 2HD1 LEU 111 0.454 3.205 -2.194 915 HD13 LEU 111 3HD1 LEU 111 1.499 4.310 -1.300 916 HD21 LEU 111 3HD2 LEU 111 -0.632 5.123 -3.382 917 HD22 LEU 111 1HD2 LEU 111 0.367 6.377 -4.111 918 HD23 LEU 111 2HD2 LEU 111 0.360 6.166 -2.363 919 H THR 112 H THR 112 1.752 4.792 -6.724 920 HA THR 112 HA THR 112 0.659 7.528 -7.182 921 HB THR 112 HB THR 112 1.155 5.489 -9.359 922 HG1 THR 112 HG1 THR 112 2.637 7.788 -9.322 923 HG21 THR 112 3HG2 THR 112 -0.621 7.135 -9.799 924 HG22 THR 112 1HG2 THR 112 0.785 7.448 -10.817 925 HG23 THR 112 2HG2 THR 112 0.494 8.437 -9.389 926 H GLN 113 H GLN 113 -1.464 7.706 -7.555 927 HA GLN 113 HA GLN 113 -3.147 5.289 -7.788 928 HB2 GLN 113 1HB GLN 113 -2.926 5.885 -5.350 929 HB3 GLN 113 2HB GLN 113 -3.667 7.444 -5.717 930 HG2 GLN 113 1HG GLN 113 -5.671 6.290 -6.586 931 HG3 GLN 113 2HG GLN 113 -4.928 4.731 -6.233 932 HE21 GLN 113 2HE2 GLN 113 -6.839 7.262 -4.910 933 HE22 GLN 113 1HE2 GLN 113 -6.814 6.739 -3.295 934 H ASP 114 H ASP 114 -4.923 5.590 -9.028 935 HA ASP 114 HA ASP 114 -5.384 8.309 -10.156 936 HB2 ASP 114 1HB ASP 114 -6.299 7.058 -12.121 937 HB3 ASP 114 2HB ASP 114 -4.591 6.772 -11.827 938 H ASN 115 H ASN 115 -7.706 7.917 -11.418 939 HA ASN 115 HA ASN 115 -9.953 8.079 -11.212 940 HB2 ASN 115 1HB ASN 115 -9.688 5.640 -10.695 941 HB3 ASN 115 2HB ASN 115 -9.741 6.066 -8.985 942 HD21 ASN 115 2HD2 ASN 115 -11.799 5.071 -8.555 943 HD22 ASN 115 1HD2 ASN 115 -13.244 5.660 -9.227 944 H ASN 116 H ASN 116 -8.470 10.020 -9.681 945 HA ASN 116 HA ASN 116 -9.882 10.313 -7.134 946 HB2 ASN 116 1HB ASN 116 -7.976 12.123 -8.641 947 HB3 ASN 116 2HB ASN 116 -8.699 12.539 -7.090 948 HD21 ASN 116 2HD2 ASN 116 -5.806 11.700 -8.083 949 HD22 ASN 116 1HD2 ASN 116 -5.337 10.575 -6.898 950 H GLU 117 H GLU 117 -11.953 11.054 -7.114 951 HA GLU 117 HA GLU 117 -13.287 12.012 -9.400 952 HB2 GLU 117 1HB GLU 117 -14.369 10.949 -7.394 953 HB3 GLU 117 2HB GLU 117 -14.152 12.476 -6.540 954 HG2 GLU 117 1HG GLU 117 -15.480 13.637 -8.278 955 HG3 GLU 117 2HG GLU 117 -15.689 12.111 -9.132 956 H THR 118 H THR 118 -11.818 13.789 -6.702 957 HA THR 118 HA THR 118 -11.861 16.234 -8.362 958 HB THR 118 HB THR 118 -12.815 17.602 -6.646 959 HG1 THR 118 HG1 THR 118 -13.589 16.020 -4.771 960 HG21 THR 118 3HG2 THR 118 -15.047 16.722 -6.486 961 HG22 THR 118 1HG2 THR 118 -14.468 15.069 -6.676 962 HG23 THR 118 2HG2 THR 118 -14.395 16.190 -8.035 963 H GLU 119 H GLU 119 -10.549 17.983 -7.324 964 HA GLU 119 HA GLU 119 -7.941 17.097 -6.774 965 HB2 GLU 119 1HB GLU 119 -9.279 19.756 -6.198 966 HB3 GLU 119 2HB GLU 119 -7.547 19.468 -6.040 967 HG2 GLU 119 1HG GLU 119 -7.354 18.931 -8.380 968 HG3 GLU 119 2HG GLU 119 -9.102 18.997 -8.596 969 H LYS 120 H LYS 120 -10.636 17.925 -4.692 970 HA LYS 120 HA LYS 120 -9.289 18.004 -2.220 971 HB2 LYS 120 1HB LYS 120 -12.133 17.214 -2.904 972 HB3 LYS 120 2HB LYS 120 -11.546 17.422 -1.254 973 HG2 LYS 120 1HG LYS 120 -10.945 19.751 -1.737 974 HG3 LYS 120 2HG LYS 120 -11.471 19.556 -3.408 975 HD2 LYS 120 1HD LYS 120 -13.761 19.028 -2.609 976 HD3 LYS 120 2HD LYS 120 -13.226 19.294 -0.950 977 HE2 LYS 120 1HE LYS 120 -13.028 21.385 -3.135 978 HE3 LYS 120 2HE LYS 120 -14.363 21.288 -1.989 979 HZ1 LYS 120 3HZ LYS 120 -11.842 22.455 -1.623 980 HZ2 LYS 120 1HZ LYS 120 -11.973 21.146 -0.551 981 HZ3 LYS 120 2HZ LYS 120 -13.139 22.380 -0.528 982 H GLU 121 H GLU 121 -10.696 15.318 -4.048 983 HA GLU 121 HA GLU 121 -10.184 13.326 -2.077 984 HB2 GLU 121 1HB GLU 121 -10.633 13.100 -5.063 985 HB3 GLU 121 2HB GLU 121 -10.585 11.732 -3.951 986 HG2 GLU 121 1HG GLU 121 -12.505 14.061 -3.677 987 HG3 GLU 121 2HG GLU 121 -12.914 12.540 -4.467 988 H GLN 122 H GLN 122 -8.381 14.506 -4.884 989 HA GLN 122 HA GLN 122 -6.309 12.578 -4.808 990 HB2 GLN 122 1HB GLN 122 -6.695 14.132 -6.722 991 HB3 GLN 122 2HB GLN 122 -6.137 15.471 -5.721 992 HG2 GLN 122 1HG GLN 122 -3.942 14.299 -5.443 993 HG3 GLN 122 2HG GLN 122 -4.515 13.034 -6.527 994 HE21 GLN 122 2HE2 GLN 122 -3.930 13.359 -8.670 995 HE22 GLN 122 1HE2 GLN 122 -3.592 14.866 -9.372 996 H LYS 123 H LYS 123 -6.615 15.814 -3.390 997 HA LYS 123 HA LYS 123 -4.139 15.874 -2.072 998 HB2 LYS 123 1HB LYS 123 -5.625 17.857 -2.374 999 HB3 LYS 123 2HB LYS 123 -6.746 17.157 -1.214 1000 HG2 LYS 123 1HG LYS 123 -5.395 18.815 -0.081 1001 HG3 LYS 123 2HG LYS 123 -4.938 17.227 0.522 1002 HD2 LYS 123 1HD LYS 123 -2.888 17.227 -0.714 1003 HD3 LYS 123 2HD LYS 123 -3.415 18.566 -1.735 1004 HE2 LYS 123 1HE LYS 123 -2.916 18.754 1.253 1005 HE3 LYS 123 2HE LYS 123 -1.773 19.270 0.012 1006 HZ1 LYS 123 3HZ LYS 123 -2.860 21.174 -0.204 1007 HZ2 LYS 123 1HZ LYS 123 -3.865 20.732 1.091 1008 HZ3 LYS 123 2HZ LYS 123 -4.326 20.367 -0.501 1009 H HIS 124 H HIS 124 -7.314 14.716 -1.073 1010 HA HIS 124 HA HIS 124 -6.708 13.996 1.577 1011 HB2 HIS 124 1HB HIS 124 -9.006 14.156 0.581 1012 HB3 HIS 124 2HB HIS 124 -8.678 12.674 -0.312 1013 HD1 HIS 124 HD1 HIS 124 -8.687 13.876 3.311 1014 HD2 HIS 124 HD2 HIS 124 -9.310 10.396 1.103 1015 HE1 HIS 124 HE1 HIS 124 -9.474 12.117 4.954 1016 HE2 HIS 124 HE2 HIS 124 -9.858 9.988 3.622 1017 H SER 125 H SER 125 -6.398 12.302 -1.497 1018 HA SER 125 HA SER 125 -5.621 9.783 -0.414 1019 HB2 SER 125 1HB SER 125 -5.069 10.981 -3.140 1020 HB3 SER 125 2HB SER 125 -4.824 9.296 -2.703 1021 HG SER 125 HG SER 125 -6.882 8.988 -2.955 1022 H GLU 126 H GLU 126 -3.756 12.421 -1.907 1023 HA GLU 126 HA GLU 126 -1.189 11.406 -1.510 1024 HB2 GLU 126 1HB GLU 126 -2.184 14.271 -1.518 1025 HB3 GLU 126 2HB GLU 126 -0.476 13.831 -1.533 1026 HG2 GLU 126 1HG GLU 126 -0.737 12.647 -3.627 1027 HG3 GLU 126 2HG GLU 126 -2.480 12.893 -3.601 1028 H ASP 127 H ASP 127 -3.187 13.404 0.649 1029 HA ASP 127 HA ASP 127 -1.297 13.668 2.727 1030 HB2 ASP 127 1HB ASP 127 -3.353 15.038 2.546 1031 HB3 ASP 127 2HB ASP 127 -4.318 13.613 2.917 1032 H ASN 128 H ASN 128 -3.796 11.244 2.070 1033 HA ASN 128 HA ASN 128 -3.450 9.753 4.460 1034 HB2 ASN 128 1HB ASN 128 -5.449 9.524 3.057 1035 HB3 ASN 128 2HB ASN 128 -4.466 8.882 1.744 1036 HD21 ASN 128 2HD2 ASN 128 -4.930 6.675 1.633 1037 HD22 ASN 128 1HD2 ASN 128 -4.966 5.628 2.969 1038 H TRP 129 H TRP 129 -2.273 9.170 1.144 1039 HA TRP 129 HA TRP 129 -0.676 6.950 1.810 1040 HB2 TRP 129 1HB TRP 129 -0.505 8.929 -0.481 1041 HB3 TRP 129 2HB TRP 129 0.557 7.524 -0.348 1042 HD1 TRP 129 HD1 TRP 129 -2.701 8.488 -1.737 1043 HE1 TRP 129 HE1 TRP 129 -4.122 6.411 -2.289 1044 HE3 TRP 129 HE3 TRP 129 -0.008 4.911 0.708 1045 HZ2 TRP 129 HZ2 TRP 129 -4.116 3.592 -1.758 1046 HZ3 TRP 129 HZ3 TRP 129 -0.729 2.542 0.670 1047 HH2 TRP 129 HH2 TRP 129 -2.778 1.877 -0.561 1048 H ASN 130 H ASN 130 0.025 10.425 1.789 1049 HA ASN 130 HA ASN 130 2.792 10.246 2.290 1050 HB2 ASN 130 1HB ASN 130 0.730 12.342 3.020 1051 HB3 ASN 130 2HB ASN 130 2.435 12.534 3.415 1052 HD21 ASN 130 2HD2 ASN 130 1.090 14.310 1.604 1053 HD22 ASN 130 1HD2 ASN 130 1.758 14.088 0.058 1054 H THR 131 H THR 131 -0.025 10.141 4.411 1055 HA THR 131 HA THR 131 1.373 10.128 6.873 1056 HB THR 131 HB THR 131 -1.276 8.750 6.330 1057 HG1 THR 131 HG1 THR 131 -0.986 11.418 7.163 1058 HG21 THR 131 3HG2 THR 131 -0.214 8.377 8.540 1059 HG22 THR 131 1HG2 THR 131 -1.712 9.300 8.671 1060 HG23 THR 131 2HG2 THR 131 -0.157 10.123 8.786 1061 H MET 132 H MET 132 0.310 7.577 4.674 1062 HA MET 132 HA MET 132 1.138 5.369 6.266 1063 HB2 MET 132 1HB MET 132 0.814 5.641 3.266 1064 HB3 MET 132 2HB MET 132 1.089 4.111 4.100 1065 HG2 MET 132 1HG MET 132 -0.974 4.384 5.372 1066 HG3 MET 132 2HG MET 132 -1.230 5.980 4.666 1067 HE1 MET 132 3HE MET 132 -0.386 2.281 3.590 1068 HE2 MET 132 1HE MET 132 -1.916 1.868 2.806 1069 HE3 MET 132 2HE MET 132 -1.889 2.325 4.508 1070 H LEU 133 H LEU 133 2.698 7.055 3.554 1071 HA LEU 133 HA LEU 133 5.132 5.617 3.655 1072 HB2 LEU 133 1HB LEU 133 4.205 8.186 2.425 1073 HB3 LEU 133 2HB LEU 133 5.944 7.993 2.580 1074 HG LEU 133 HG LEU 133 5.118 7.243 0.377 1075 HD11 LEU 133 1HD1 LEU 133 5.901 4.635 1.615 1076 HD12 LEU 133 2HD1 LEU 133 7.008 5.986 1.862 1077 HD13 LEU 133 3HD1 LEU 133 6.574 5.490 0.232 1078 HD21 LEU 133 3HD2 LEU 133 3.578 5.134 1.924 1079 HD22 LEU 133 1HD2 LEU 133 3.684 5.274 0.169 1080 HD23 LEU 133 2HD2 LEU 133 2.866 6.523 1.103 1081 H GLU 134 H GLU 134 4.048 8.562 5.274 1082 HA GLU 134 HA GLU 134 6.531 9.158 6.545 1083 HB2 GLU 134 1HB GLU 134 4.695 10.816 6.235 1084 HB3 GLU 134 2HB GLU 134 3.713 9.909 7.385 1085 HG2 GLU 134 1HG GLU 134 5.395 10.302 9.147 1086 HG3 GLU 134 2HG GLU 134 6.396 11.186 7.996 1087 H GLY 135 H GLY 135 3.656 7.316 7.425 1088 HA2 GLY 135 1HA GLY 135 4.409 6.725 10.095 1089 HA3 GLY 135 2HA GLY 135 3.219 5.848 9.132 1090 H LEU 136 H LEU 136 4.901 5.119 6.986 1091 HA LEU 136 HA LEU 136 6.082 2.743 7.982 1092 HB2 LEU 136 1HB LEU 136 5.153 2.893 5.722 1093 HB3 LEU 136 2HB LEU 136 6.353 4.102 5.276 1094 HG LEU 136 HG LEU 136 7.523 1.568 6.381 1095 HD11 LEU 136 1HD1 LEU 136 7.216 0.301 4.274 1096 HD12 LEU 136 2HD1 LEU 136 6.114 1.552 3.694 1097 HD13 LEU 136 3HD1 LEU 136 5.683 0.579 5.101 1098 HD21 LEU 136 3HD2 LEU 136 8.076 3.051 3.785 1099 HD22 LEU 136 1HD2 LEU 136 9.116 1.865 4.577 1100 HD23 LEU 136 2HD2 LEU 136 8.847 3.439 5.324 1101 H LYS 137 H LYS 137 7.431 5.828 6.874 1102 HA LYS 137 HA LYS 137 10.144 5.111 7.071 1103 HB2 LYS 137 1HB LYS 137 9.267 7.174 5.942 1104 HB3 LYS 137 2HB LYS 137 8.974 7.865 7.536 1105 HG2 LYS 137 1HG LYS 137 11.359 7.654 8.094 1106 HG3 LYS 137 2HG LYS 137 11.670 6.903 6.528 1107 HD2 LYS 137 1HD LYS 137 10.873 8.958 5.398 1108 HD3 LYS 137 2HD LYS 137 10.611 9.708 6.971 1109 HE2 LYS 137 1HE LYS 137 13.286 8.662 6.004 1110 HE3 LYS 137 2HE LYS 137 12.794 10.353 5.942 1111 HZ1 LYS 137 3HZ LYS 137 13.932 10.218 7.926 1112 HZ2 LYS 137 1HZ LYS 137 13.340 8.672 8.298 1113 HZ3 LYS 137 2HZ LYS 137 12.322 10.026 8.434 1114 H LYS 138 H LYS 138 7.812 6.176 9.472 1115 HA LYS 138 HA LYS 138 9.574 6.842 11.536 1116 HB2 LYS 138 1HB LYS 138 7.033 7.229 11.418 1117 HB3 LYS 138 2HB LYS 138 6.871 5.567 11.976 1118 HG2 LYS 138 1HG LYS 138 6.840 6.742 14.020 1119 HG3 LYS 138 2HG LYS 138 8.544 6.319 13.890 1120 HD2 LYS 138 1HD LYS 138 9.051 8.564 12.999 1121 HD3 LYS 138 2HD LYS 138 7.337 8.977 13.038 1122 HE2 LYS 138 1HE LYS 138 8.414 9.890 15.019 1123 HE3 LYS 138 2HE LYS 138 7.347 8.574 15.503 1124 HZ1 LYS 138 3HZ LYS 138 10.215 8.131 14.934 1125 HZ2 LYS 138 1HZ LYS 138 9.145 7.127 15.786 1126 HZ3 LYS 138 2HZ LYS 138 9.670 8.587 16.478 1127 H PHE 139 H PHE 139 8.238 3.727 10.545 1128 HA PHE 139 HA PHE 139 9.272 2.286 12.814 1129 HB2 PHE 139 1HB PHE 139 7.287 1.640 11.266 1130 HB3 PHE 139 2HB PHE 139 8.516 1.009 10.171 1131 HD1 PHE 139 HD2 PHE 139 10.062 -0.815 10.936 1132 HD2 PHE 139 HD1 PHE 139 6.742 0.492 13.333 1133 HE1 PHE 139 HE2 PHE 139 10.240 -2.874 12.306 1134 HE2 PHE 139 HE1 PHE 139 6.923 -1.566 14.703 1135 HZ PHE 139 HZ PHE 139 8.672 -3.249 14.191 1136 H LEU 140 H LEU 140 10.220 2.516 9.394 1137 HA LEU 140 HA LEU 140 12.522 0.880 9.607 1138 HB2 LEU 140 1HB LEU 140 11.517 2.912 7.634 1139 HB3 LEU 140 2HB LEU 140 13.177 2.356 7.464 1140 HG LEU 140 HG LEU 140 11.535 1.053 6.089 1141 HD11 LEU 140 1HD1 LEU 140 12.704 -0.898 6.327 1142 HD12 LEU 140 2HD1 LEU 140 12.464 -0.986 8.072 1143 HD13 LEU 140 3HD1 LEU 140 13.714 0.062 7.403 1144 HD21 LEU 140 3HD2 LEU 140 9.865 -0.325 7.093 1145 HD22 LEU 140 1HD2 LEU 140 9.697 1.252 7.858 1146 HD23 LEU 140 2HD2 LEU 140 10.507 -0.056 8.712 1147 H GLU 141 H GLU 141 12.115 4.390 9.926 1148 HA GLU 141 HA GLU 141 14.928 4.886 10.345 1149 HB2 GLU 141 1HB GLU 141 14.335 7.170 10.545 1150 HB3 GLU 141 2HB GLU 141 13.126 6.524 9.443 1151 HG2 GLU 141 1HG GLU 141 11.757 7.709 10.945 1152 HG3 GLU 141 2HG GLU 141 11.738 6.098 11.651 1153 H ASN 142 H ASN 142 12.625 3.435 12.222 1154 HA ASN 142 HA ASN 142 13.020 4.519 14.792 1155 HB2 ASN 142 1HB ASN 142 11.225 2.864 14.054 1156 HB3 ASN 142 2HB ASN 142 12.447 1.604 14.204 1157 HD21 ASN 142 2HD2 ASN 142 10.033 1.789 15.843 1158 HD22 ASN 142 1HD2 ASN 142 10.545 2.004 17.449 1159 H LYS 143 H LYS 143 14.757 2.023 12.993 1160 HA LYS 143 HA LYS 143 16.408 1.099 15.064 1161 HB2 LYS 143 1HB LYS 143 16.099 -0.088 12.947 1162 HB3 LYS 143 2HB LYS 143 16.913 1.211 12.082 1163 HG2 LYS 143 1HG LYS 143 18.472 0.069 14.372 1164 HG3 LYS 143 2HG LYS 143 18.204 -1.051 13.046 1165 HD2 LYS 143 1HD LYS 143 19.217 1.746 12.462 1166 HD3 LYS 143 2HD LYS 143 20.335 0.492 12.995 1167 HE2 LYS 143 1HE LYS 143 18.493 0.255 10.589 1168 HE3 LYS 143 2HE LYS 143 20.214 0.628 10.524 1169 HZ1 LYS 143 3HZ LYS 143 18.951 -1.893 10.802 1170 HZ2 LYS 143 1HZ LYS 143 19.981 -1.610 12.118 1171 HZ3 LYS 143 2HZ LYS 143 20.592 -1.538 10.536 1172 H VAL 144 H VAL 144 16.912 3.685 12.676 1173 HA VAL 144 HA VAL 144 19.531 4.345 13.549 1174 HB VAL 144 HB VAL 144 17.481 5.983 12.037 1175 HG11 VAL 144 1HG1 VAL 144 19.087 7.515 12.990 1176 HG12 VAL 144 2HG1 VAL 144 19.550 7.275 11.308 1177 HG13 VAL 144 3HG1 VAL 144 20.430 6.443 12.589 1178 HG21 VAL 144 3HG2 VAL 144 18.221 3.872 10.944 1179 HG22 VAL 144 1HG2 VAL 144 19.897 4.398 11.103 1180 HG23 VAL 144 2HG2 VAL 144 18.784 5.297 10.072 1181 H SER 145 H SER 145 16.325 5.654 14.336 1182 HA SER 145 HA SER 145 17.164 7.758 15.998 1183 HB2 SER 145 1HB SER 145 14.631 6.108 16.156 1184 HB3 SER 145 2HB SER 145 14.891 7.666 16.936 1185 HG SER 145 HG SER 145 15.448 8.348 14.671 1186 H ALA 146 H ALA 146 16.474 4.367 16.679 1187 HA ALA 146 HA ALA 146 16.742 4.500 19.497 1188 HB1 ALA 146 3HB ALA 146 16.887 2.075 19.402 1189 HB2 ALA 146 1HB ALA 146 17.239 2.135 17.676 1190 HB3 ALA 146 2HB ALA 146 15.653 2.626 18.270 Start of MODEL 3 1 H1 MET 1 1H MET 1 -7.038 16.003 -19.252 2 H2 MET 1 2H MET 1 -6.643 14.428 -19.751 3 H3 MET 1 3H MET 1 -7.457 14.677 -18.282 4 HA MET 1 HA MET 1 -9.421 15.402 -19.382 5 HB2 MET 1 1HB MET 1 -8.131 16.576 -21.216 6 HB3 MET 1 2HB MET 1 -7.902 15.004 -21.979 7 HG2 MET 1 1HG MET 1 -9.823 16.010 -23.018 8 HG3 MET 1 2HG MET 1 -10.434 14.744 -21.959 9 HE1 MET 1 3HE MET 1 -12.507 16.116 -22.704 10 HE2 MET 1 1HE MET 1 -11.900 17.719 -23.139 11 HE3 MET 1 2HE MET 1 -13.108 17.545 -21.869 12 H GLU 2 H GLU 2 -7.102 12.939 -20.288 13 HA GLU 2 HA GLU 2 -8.943 11.002 -21.258 14 HB2 GLU 2 1HB GLU 2 -6.201 10.666 -20.023 15 HB3 GLU 2 2HB GLU 2 -7.091 9.399 -20.865 16 HG2 GLU 2 1HG GLU 2 -6.336 12.058 -22.113 17 HG3 GLU 2 2HG GLU 2 -5.398 10.577 -22.302 18 H ILE 3 H ILE 3 -7.698 11.753 -18.035 19 HA ILE 3 HA ILE 3 -9.839 10.113 -16.861 20 HB ILE 3 HB ILE 3 -8.415 8.895 -15.409 21 HG12 ILE 3 1HG1 ILE 3 -6.792 10.539 -14.717 22 HG13 ILE 3 2HG1 ILE 3 -5.903 9.209 -15.439 23 HG21 ILE 3 1HG2 ILE 3 -8.506 8.080 -17.755 24 HG22 ILE 3 2HG2 ILE 3 -7.016 7.625 -16.929 25 HG23 ILE 3 3HG2 ILE 3 -7.008 8.950 -18.089 26 HD11 ILE 3 3HD1 ILE 3 -6.482 11.919 -16.638 27 HD12 ILE 3 1HD1 ILE 3 -5.967 10.557 -17.633 28 HD13 ILE 3 2HD1 ILE 3 -4.923 11.161 -16.350 29 H LYS 4 H LYS 4 -9.759 10.437 -14.359 30 HA LYS 4 HA LYS 4 -10.063 13.255 -13.886 31 HB2 LYS 4 1HB LYS 4 -10.110 11.021 -11.842 32 HB3 LYS 4 2HB LYS 4 -10.850 12.618 -11.713 33 HG2 LYS 4 1HG LYS 4 -12.298 12.052 -13.684 34 HG3 LYS 4 2HG LYS 4 -11.593 10.440 -13.691 35 HD2 LYS 4 1HD LYS 4 -13.561 10.080 -12.458 36 HD3 LYS 4 2HD LYS 4 -12.381 10.337 -11.176 37 HE2 LYS 4 1HE LYS 4 -14.467 11.611 -10.787 38 HE3 LYS 4 2HE LYS 4 -13.096 12.695 -10.990 39 HZ1 LYS 4 3HZ LYS 4 -14.689 11.922 -13.335 40 HZ2 LYS 4 1HZ LYS 4 -13.796 13.339 -13.063 41 HZ3 LYS 4 2HZ LYS 4 -15.290 13.114 -12.282 42 H LEU 5 H LEU 5 -9.190 13.286 -11.162 43 HA LEU 5 HA LEU 5 -6.457 14.105 -11.543 44 HB2 LEU 5 1HB LEU 5 -8.390 14.087 -9.239 45 HB3 LEU 5 2HB LEU 5 -6.704 14.454 -8.938 46 HG LEU 5 HG LEU 5 -8.133 16.478 -9.299 47 HD11 LEU 5 1HD1 LEU 5 -6.509 17.665 -10.455 48 HD12 LEU 5 2HD1 LEU 5 -6.217 16.392 -11.627 49 HD13 LEU 5 3HD1 LEU 5 -5.589 16.244 -9.985 50 HD21 LEU 5 3HD2 LEU 5 -8.303 15.570 -12.180 51 HD22 LEU 5 1HD2 LEU 5 -9.127 16.933 -11.421 52 HD23 LEU 5 2HD2 LEU 5 -9.593 15.285 -11.011 53 H ILE 6 H ILE 6 -4.601 13.224 -10.791 54 HA ILE 6 HA ILE 6 -4.716 10.457 -9.680 55 HB ILE 6 HB ILE 6 -2.612 11.694 -11.473 56 HG12 ILE 6 1HG1 ILE 6 -4.628 9.508 -12.101 57 HG13 ILE 6 2HG1 ILE 6 -4.852 11.194 -12.555 58 HG21 ILE 6 1HG2 ILE 6 -1.614 10.032 -10.012 59 HG22 ILE 6 2HG2 ILE 6 -1.815 9.293 -11.595 60 HG23 ILE 6 3HG2 ILE 6 -2.946 8.914 -10.297 61 HD11 ILE 6 3HD1 ILE 6 -2.579 9.396 -13.431 62 HD12 ILE 6 1HD1 ILE 6 -2.696 11.115 -13.804 63 HD13 ILE 6 2HD1 ILE 6 -3.895 9.992 -14.439 64 H ALA 7 H ALA 7 -3.772 10.137 -7.779 65 HA ALA 7 HA ALA 7 -2.197 12.320 -6.552 66 HB1 ALA 7 3HB ALA 7 -3.141 9.769 -5.216 67 HB2 ALA 7 1HB ALA 7 -4.165 11.195 -5.371 68 HB3 ALA 7 2HB ALA 7 -2.662 11.287 -4.453 69 H GLN 8 H GLN 8 -0.076 12.149 -6.060 70 HA GLN 8 HA GLN 8 1.289 9.541 -6.215 71 HB2 GLN 8 1HB GLN 8 3.081 10.613 -7.669 72 HB3 GLN 8 2HB GLN 8 1.546 10.302 -8.472 73 HG2 GLN 8 1HG GLN 8 0.865 12.610 -8.206 74 HG3 GLN 8 2HG GLN 8 2.296 12.953 -7.245 75 HE21 GLN 8 2HE2 GLN 8 1.436 14.095 -9.930 76 HE22 GLN 8 1HE2 GLN 8 2.757 13.811 -10.956 77 H VAL 9 H VAL 9 3.129 9.408 -4.990 78 HA VAL 9 HA VAL 9 4.113 11.815 -3.562 79 HB VAL 9 HB VAL 9 4.166 10.431 -1.437 80 HG11 VAL 9 1HG1 VAL 9 2.450 12.141 -1.778 81 HG12 VAL 9 2HG1 VAL 9 1.754 10.745 -0.958 82 HG13 VAL 9 3HG1 VAL 9 1.457 10.992 -2.678 83 HG21 VAL 9 3HG2 VAL 9 2.264 8.681 -3.023 84 HG22 VAL 9 1HG2 VAL 9 2.703 8.475 -1.328 85 HG23 VAL 9 2HG2 VAL 9 3.914 8.231 -2.587 86 H LYS 10 H LYS 10 6.232 11.561 -2.669 87 HA LYS 10 HA LYS 10 7.781 9.170 -3.332 88 HB2 LYS 10 1HB LYS 10 7.739 10.532 -5.427 89 HB3 LYS 10 2HB LYS 10 8.521 11.844 -4.552 90 HG2 LYS 10 1HG LYS 10 10.419 10.324 -4.008 91 HG3 LYS 10 2HG LYS 10 9.652 9.052 -4.957 92 HD2 LYS 10 1HD LYS 10 10.414 11.771 -6.076 93 HD3 LYS 10 2HD LYS 10 11.454 10.356 -6.171 94 HE2 LYS 10 1HE LYS 10 9.474 9.175 -7.325 95 HE3 LYS 10 2HE LYS 10 8.771 10.783 -7.500 96 HZ1 LYS 10 3HZ LYS 10 11.251 9.717 -8.678 97 HZ2 LYS 10 1HZ LYS 10 11.067 11.387 -8.448 98 HZ3 LYS 10 2HZ LYS 10 9.972 10.541 -9.435 99 H THR 11 H THR 11 9.380 8.873 -1.910 100 HA THR 11 HA THR 11 10.584 11.136 -0.479 101 HB THR 11 HB THR 11 8.718 10.616 0.966 102 HG1 THR 11 HG1 THR 11 10.590 11.027 2.067 103 HG21 THR 11 3HG2 THR 11 8.289 8.336 0.101 104 HG22 THR 11 1HG2 THR 11 8.377 8.360 1.862 105 HG23 THR 11 2HG2 THR 11 9.743 7.764 0.918 106 H VAL 12 H VAL 12 12.602 10.717 0.353 107 HA VAL 12 HA VAL 12 13.884 8.210 -0.592 108 HB VAL 12 HB VAL 12 16.014 9.587 0.036 109 HG11 VAL 12 1HG1 VAL 12 15.896 10.818 -2.131 110 HG12 VAL 12 2HG1 VAL 12 14.178 10.430 -2.229 111 HG13 VAL 12 3HG1 VAL 12 15.379 9.136 -2.273 112 HG21 VAL 12 3HG2 VAL 12 13.996 11.842 -0.172 113 HG22 VAL 12 1HG2 VAL 12 15.728 11.987 0.123 114 HG23 VAL 12 2HG2 VAL 12 14.680 11.280 1.354 115 H ILE 13 H ILE 13 14.588 6.707 0.760 116 HA ILE 13 HA ILE 13 14.820 7.315 3.670 117 HB ILE 13 HB ILE 13 13.621 4.795 2.480 118 HG12 ILE 13 1HG1 ILE 13 12.250 7.029 4.026 119 HG13 ILE 13 2HG1 ILE 13 12.182 6.872 2.271 120 HG21 ILE 13 1HG2 ILE 13 14.770 4.406 4.607 121 HG22 ILE 13 2HG2 ILE 13 13.036 4.371 4.886 122 HG23 ILE 13 3HG2 ILE 13 13.970 5.797 5.329 123 HD11 ILE 13 3HD1 ILE 13 11.226 4.580 2.552 124 HD12 ILE 13 1HD1 ILE 13 10.197 5.843 3.228 125 HD13 ILE 13 2HD1 ILE 13 11.189 4.847 4.296 126 H ASN 14 H ASN 14 16.639 6.640 4.573 127 HA ASN 14 HA ASN 14 18.617 5.213 2.957 128 HB2 ASN 14 1HB ASN 14 18.751 6.370 5.752 129 HB3 ASN 14 2HB ASN 14 20.109 5.654 4.888 130 HD21 ASN 14 2HD2 ASN 14 19.256 6.775 2.244 131 HD22 ASN 14 1HD2 ASN 14 19.591 8.435 2.324 132 H ALA 15 H ALA 15 17.954 3.100 2.798 133 HA ALA 15 HA ALA 15 18.554 1.378 4.981 134 HB1 ALA 15 3HB ALA 15 15.739 2.247 4.635 135 HB2 ALA 15 1HB ALA 15 16.528 1.600 6.066 136 HB3 ALA 15 2HB ALA 15 15.927 0.508 4.817 137 HA PRO 16 HA PRO 16 19.031 -1.495 1.659 138 HB2 PRO 16 1HB PRO 16 18.226 -3.912 2.804 139 HB3 PRO 16 2HB PRO 16 19.790 -3.131 3.122 140 HG2 PRO 16 1HG PRO 16 17.269 -3.025 4.745 141 HG3 PRO 16 2HG PRO 16 18.943 -3.253 5.287 142 HD2 PRO 16 1HD PRO 16 17.762 -0.839 5.497 143 HD3 PRO 16 2HD PRO 16 19.475 -0.967 5.038 144 H ILE 17 H ILE 17 17.931 -2.344 -0.047 145 HA ILE 17 HA ILE 17 15.209 -1.682 -0.426 146 HB ILE 17 HB ILE 17 16.944 -1.845 -2.219 147 HG12 ILE 17 1HG1 ILE 17 15.467 -2.947 -3.912 148 HG13 ILE 17 2HG1 ILE 17 14.463 -3.565 -2.610 149 HG21 ILE 17 1HG2 ILE 17 17.926 -4.000 -1.346 150 HG22 ILE 17 2HG2 ILE 17 17.623 -3.986 -3.083 151 HG23 ILE 17 3HG2 ILE 17 16.522 -4.839 -2.007 152 HD11 ILE 17 3HD1 ILE 17 13.515 -1.502 -2.184 153 HD12 ILE 17 1HD1 ILE 17 13.898 -1.279 -3.886 154 HD13 ILE 17 2HD1 ILE 17 14.958 -0.603 -2.656 155 H GLU 18 H GLU 18 16.807 -4.675 0.507 156 HA GLU 18 HA GLU 18 14.751 -6.502 0.049 157 HB2 GLU 18 1HB GLU 18 17.092 -7.067 0.673 158 HB3 GLU 18 2HB GLU 18 16.753 -6.519 2.314 159 HG2 GLU 18 1HG GLU 18 15.014 -8.224 2.566 160 HG3 GLU 18 2HG GLU 18 15.241 -8.728 0.894 161 H LYS 19 H LYS 19 15.477 -4.681 3.010 162 HA LYS 19 HA LYS 19 13.296 -5.706 4.497 163 HB2 LYS 19 1HB LYS 19 14.890 -3.174 4.878 164 HB3 LYS 19 2HB LYS 19 13.786 -3.858 6.069 165 HG2 LYS 19 1HG LYS 19 16.151 -5.381 4.910 166 HG3 LYS 19 2HG LYS 19 16.233 -4.461 6.410 167 HD2 LYS 19 1HD LYS 19 14.222 -5.913 7.193 168 HD3 LYS 19 2HD LYS 19 14.608 -6.963 5.833 169 HE2 LYS 19 1HE LYS 19 15.742 -7.838 7.767 170 HE3 LYS 19 2HE LYS 19 16.964 -7.123 6.713 171 HZ1 LYS 19 3HZ LYS 19 17.553 -5.837 8.395 172 HZ2 LYS 19 1HZ LYS 19 16.301 -6.443 9.365 173 HZ3 LYS 19 2HZ LYS 19 16.021 -5.102 8.359 174 H VAL 20 H VAL 20 13.575 -2.768 2.522 175 HA VAL 20 HA VAL 20 11.015 -1.740 3.256 176 HB VAL 20 HB VAL 20 12.650 -1.281 0.740 177 HG11 VAL 20 1HG1 VAL 20 11.237 0.814 0.597 178 HG12 VAL 20 2HG1 VAL 20 10.209 0.137 1.857 179 HG13 VAL 20 3HG1 VAL 20 10.339 -0.672 0.297 180 HG21 VAL 20 3HG2 VAL 20 13.382 0.747 1.876 181 HG22 VAL 20 1HG2 VAL 20 13.705 -0.632 2.927 182 HG23 VAL 20 2HG2 VAL 20 12.316 0.409 3.239 183 H TRP 21 H TRP 21 12.152 -3.692 0.527 184 HA TRP 21 HA TRP 21 9.700 -4.052 -0.798 185 HB2 TRP 21 1HB TRP 21 11.959 -4.603 -1.716 186 HB3 TRP 21 2HB TRP 21 12.046 -5.965 -0.606 187 HD1 TRP 21 HD1 TRP 21 10.793 -8.147 -1.252 188 HE1 TRP 21 HE1 TRP 21 9.467 -8.894 -3.336 189 HE3 TRP 21 HE3 TRP 21 10.285 -3.659 -3.640 190 HZ2 TRP 21 HZ2 TRP 21 8.344 -7.741 -5.699 191 HZ3 TRP 21 HZ3 TRP 21 9.091 -3.516 -5.807 192 HH2 TRP 21 HH2 TRP 21 8.129 -5.554 -6.838 193 H GLU 22 H GLU 22 11.310 -5.905 1.755 194 HA GLU 22 HA GLU 22 9.503 -8.034 1.983 195 HB2 GLU 22 1HB GLU 22 11.733 -7.893 3.105 196 HB3 GLU 22 2HB GLU 22 11.063 -6.698 4.213 197 HG2 GLU 22 1HG GLU 22 9.415 -8.339 5.017 198 HG3 GLU 22 2HG GLU 22 10.023 -9.529 3.871 199 H ALA 23 H ALA 23 9.585 -4.924 3.720 200 HA ALA 23 HA ALA 23 7.366 -5.297 5.355 201 HB1 ALA 23 3HB ALA 23 8.917 -3.427 5.619 202 HB2 ALA 23 1HB ALA 23 7.259 -2.845 5.478 203 HB3 ALA 23 2HB ALA 23 8.351 -2.734 4.098 204 H LEU 24 H LEU 24 7.498 -4.368 1.970 205 HA LEU 24 HA LEU 24 4.806 -3.468 1.777 206 HB2 LEU 24 1HB LEU 24 6.895 -3.224 0.152 207 HB3 LEU 24 2HB LEU 24 6.231 -4.670 -0.595 208 HG LEU 24 HG LEU 24 4.795 -2.028 -0.171 209 HD11 LEU 24 1HD1 LEU 24 4.752 -2.070 -2.707 210 HD12 LEU 24 2HD1 LEU 24 5.894 -3.411 -2.628 211 HD13 LEU 24 3HD1 LEU 24 6.335 -1.839 -1.976 212 HD21 LEU 24 3HD2 LEU 24 3.797 -4.711 -1.155 213 HD22 LEU 24 1HD2 LEU 24 3.037 -3.209 -1.691 214 HD23 LEU 24 2HD2 LEU 24 3.069 -3.608 0.017 215 H VAL 25 H VAL 25 6.311 -6.629 1.105 216 HA VAL 25 HA VAL 25 3.597 -7.860 0.963 217 HB VAL 25 HB VAL 25 4.782 -9.689 -0.366 218 HG11 VAL 25 1HG1 VAL 25 4.889 -6.918 -1.597 219 HG12 VAL 25 2HG1 VAL 25 3.408 -7.841 -1.398 220 HG13 VAL 25 3HG1 VAL 25 4.684 -8.446 -2.446 221 HG21 VAL 25 3HG2 VAL 25 6.905 -9.068 -1.440 222 HG22 VAL 25 1HG2 VAL 25 7.119 -9.072 0.306 223 HG23 VAL 25 2HG2 VAL 25 6.936 -7.549 -0.550 224 H ASN 26 H ASN 26 3.660 -7.974 3.295 225 HA ASN 26 HA ASN 26 4.732 -10.535 4.134 226 HB2 ASN 26 1HB ASN 26 6.572 -8.888 4.519 227 HB3 ASN 26 2HB ASN 26 5.547 -8.103 5.697 228 HD21 ASN 26 2HD2 ASN 26 4.427 -10.821 6.506 229 HD22 ASN 26 1HD2 ASN 26 5.645 -11.505 7.464 230 HA PRO 27 HA PRO 27 0.772 -9.785 6.194 231 HB2 PRO 27 1HB PRO 27 0.223 -12.340 7.022 232 HB3 PRO 27 2HB PRO 27 0.033 -11.816 5.335 233 HG2 PRO 27 1HG PRO 27 2.267 -13.357 6.597 234 HG3 PRO 27 2HG PRO 27 1.500 -13.580 5.013 235 HD2 PRO 27 1HD PRO 27 3.908 -12.269 5.369 236 HD3 PRO 27 2HD PRO 27 2.815 -11.941 4.012 237 H GLU 28 H GLU 28 3.720 -10.559 7.544 238 HA GLU 28 HA GLU 28 2.757 -10.695 10.328 239 HB2 GLU 28 1HB GLU 28 4.550 -12.230 9.628 240 HB3 GLU 28 2HB GLU 28 5.571 -10.859 9.208 241 HG2 GLU 28 1HG GLU 28 4.417 -11.134 11.998 242 HG3 GLU 28 2HG GLU 28 5.900 -11.965 11.547 243 H ILE 29 H ILE 29 5.006 -8.710 8.373 244 HA ILE 29 HA ILE 29 5.372 -6.724 10.376 245 HB ILE 29 HB ILE 29 5.709 -6.545 7.371 246 HG12 ILE 29 1HG1 ILE 29 7.812 -6.833 9.546 247 HG13 ILE 29 2HG1 ILE 29 7.133 -8.216 8.689 248 HG21 ILE 29 1HG2 ILE 29 6.522 -4.655 9.592 249 HG22 ILE 29 2HG2 ILE 29 5.483 -4.300 8.212 250 HG23 ILE 29 3HG2 ILE 29 7.202 -4.584 7.965 251 HD11 ILE 29 3HD1 ILE 29 7.895 -7.302 6.550 252 HD12 ILE 29 1HD1 ILE 29 9.255 -7.463 7.663 253 HD13 ILE 29 2HD1 ILE 29 8.540 -5.877 7.368 254 H ILE 30 H ILE 30 3.158 -7.042 7.635 255 HA ILE 30 HA ILE 30 1.907 -4.527 7.843 256 HB ILE 30 HB ILE 30 0.894 -7.195 6.801 257 HG12 ILE 30 1HG1 ILE 30 1.722 -4.679 5.315 258 HG13 ILE 30 2HG1 ILE 30 2.821 -6.019 5.643 259 HG21 ILE 30 1HG2 ILE 30 -0.865 -5.739 5.635 260 HG22 ILE 30 2HG2 ILE 30 -0.409 -4.451 6.749 261 HG23 ILE 30 3HG2 ILE 30 -1.092 -5.953 7.368 262 HD11 ILE 30 3HD1 ILE 30 1.237 -7.552 4.456 263 HD12 ILE 30 1HD1 ILE 30 1.892 -6.292 3.411 264 HD13 ILE 30 2HD1 ILE 30 0.250 -6.151 4.038 265 H LYS 31 H LYS 31 1.293 -7.614 9.453 266 HA LYS 31 HA LYS 31 -1.078 -6.835 10.807 267 HB2 LYS 31 1HB LYS 31 -0.344 -9.187 10.460 268 HB3 LYS 31 2HB LYS 31 0.956 -8.914 11.616 269 HG2 LYS 31 1HG LYS 31 -0.656 -8.463 13.385 270 HG3 LYS 31 2HG LYS 31 -1.987 -8.546 12.232 271 HD2 LYS 31 1HD LYS 31 -1.864 -10.658 13.434 272 HD3 LYS 31 2HD LYS 31 -1.391 -10.924 11.759 273 HE2 LYS 31 1HE LYS 31 0.915 -11.120 12.331 274 HE3 LYS 31 2HE LYS 31 0.667 -10.397 13.924 275 HZ1 LYS 31 3HZ LYS 31 -0.301 -13.044 12.987 276 HZ2 LYS 31 1HZ LYS 31 -0.736 -12.346 14.471 277 HZ3 LYS 31 2HZ LYS 31 0.887 -12.748 14.164 278 H GLU 32 H GLU 32 2.357 -6.585 11.605 279 HA GLU 32 HA GLU 32 2.116 -5.875 14.317 280 HB2 GLU 32 1HB GLU 32 4.199 -5.094 12.255 281 HB3 GLU 32 2HB GLU 32 4.322 -4.638 13.947 282 HG2 GLU 32 1HG GLU 32 4.015 -7.508 13.030 283 HG3 GLU 32 2HG GLU 32 5.574 -6.753 13.327 284 H TYR 33 H TYR 33 1.788 -3.946 11.382 285 HA TYR 33 HA TYR 33 1.658 -1.404 12.677 286 HB2 TYR 33 1HB TYR 33 0.900 -2.453 9.945 287 HB3 TYR 33 2HB TYR 33 0.412 -0.827 10.410 288 HD1 TYR 33 HD2 TYR 33 2.162 0.808 11.191 289 HD2 TYR 33 HD1 TYR 33 3.168 -2.862 9.208 290 HE1 TYR 33 HE2 TYR 33 4.396 1.718 10.640 291 HE2 TYR 33 HE1 TYR 33 5.411 -1.952 8.660 292 HH TYR 33 HH TYR 33 6.203 0.992 8.517 293 H MET 34 H MET 34 -0.718 -3.885 11.900 294 HA MET 34 HA MET 34 -2.939 -2.180 12.825 295 HB2 MET 34 1HB MET 34 -2.914 -4.950 11.600 296 HB3 MET 34 2HB MET 34 -4.361 -4.023 12.000 297 HG2 MET 34 1HG MET 34 -2.198 -3.083 10.093 298 HG3 MET 34 2HG MET 34 -3.702 -3.842 9.581 299 HE1 MET 34 3HE MET 34 -6.433 -1.363 10.136 300 HE2 MET 34 1HE MET 34 -6.002 -3.037 10.516 301 HE3 MET 34 2HE MET 34 -5.736 -2.401 8.895 302 H PHE 35 H PHE 35 -4.412 -2.936 14.394 303 HA PHE 35 HA PHE 35 -3.218 -3.849 16.773 304 HB2 PHE 35 1HB PHE 35 -6.134 -3.714 15.973 305 HB3 PHE 35 2HB PHE 35 -5.559 -3.992 17.618 306 HD1 PHE 35 HD2 PHE 35 -4.367 -2.223 18.864 307 HD2 PHE 35 HD1 PHE 35 -5.903 -1.519 14.913 308 HE1 PHE 35 HE2 PHE 35 -4.072 0.217 19.182 309 HE2 PHE 35 HE1 PHE 35 -5.606 0.921 15.234 310 HZ PHE 35 HZ PHE 35 -4.690 1.791 17.368 311 H GLY 36 H GLY 36 -5.244 -5.593 14.408 312 HA2 GLY 36 1HA GLY 36 -4.016 -8.098 15.037 313 HA3 GLY 36 2HA GLY 36 -5.607 -7.982 15.781 314 H THR 37 H THR 37 -4.524 -6.741 12.630 315 HA THR 37 HA THR 37 -6.852 -7.845 11.314 316 HB THR 37 HB THR 37 -4.417 -6.389 10.249 317 HG1 THR 37 HG1 THR 37 -6.745 -5.672 11.377 318 HG21 THR 37 3HG2 THR 37 -5.172 -7.689 8.396 319 HG22 THR 37 1HG2 THR 37 -5.944 -6.117 8.191 320 HG23 THR 37 2HG2 THR 37 -6.869 -7.475 8.830 321 H THR 38 H THR 38 -7.042 -9.748 10.330 322 HA THR 38 HA THR 38 -4.712 -11.542 10.181 323 HB THR 38 HB THR 38 -7.635 -12.116 9.622 324 HG1 THR 38 HG1 THR 38 -7.843 -12.267 11.691 325 HG21 THR 38 3HG2 THR 38 -6.859 -14.476 10.056 326 HG22 THR 38 1HG2 THR 38 -5.202 -13.878 10.034 327 HG23 THR 38 2HG2 THR 38 -6.201 -13.760 8.587 328 H VAL 39 H VAL 39 -3.589 -10.729 8.394 329 HA VAL 39 HA VAL 39 -4.954 -10.664 5.769 330 HB VAL 39 HB VAL 39 -3.660 -8.691 6.184 331 HG11 VAL 39 1HG1 VAL 39 -2.305 -9.508 8.037 332 HG12 VAL 39 2HG1 VAL 39 -1.279 -8.772 6.816 333 HG13 VAL 39 3HG1 VAL 39 -1.379 -10.527 6.937 334 HG21 VAL 39 3HG2 VAL 39 -2.169 -8.677 4.318 335 HG22 VAL 39 1HG2 VAL 39 -3.352 -9.919 3.911 336 HG23 VAL 39 2HG2 VAL 39 -1.766 -10.383 4.518 337 H VAL 40 H VAL 40 -4.632 -12.168 4.267 338 HA VAL 40 HA VAL 40 -2.418 -14.134 4.583 339 HB VAL 40 HB VAL 40 -5.287 -14.753 3.822 340 HG11 VAL 40 1HG1 VAL 40 -3.800 -16.221 2.617 341 HG12 VAL 40 2HG1 VAL 40 -4.418 -17.136 3.990 342 HG13 VAL 40 3HG1 VAL 40 -2.789 -16.463 4.043 343 HG21 VAL 40 3HG2 VAL 40 -4.961 -14.282 6.239 344 HG22 VAL 40 1HG2 VAL 40 -3.673 -15.485 6.290 345 HG23 VAL 40 2HG2 VAL 40 -5.331 -15.983 5.956 346 H SER 41 H SER 41 -1.280 -14.472 2.814 347 HA SER 41 HA SER 41 -2.409 -14.092 0.146 348 HB2 SER 41 1HB SER 41 -0.109 -12.399 1.092 349 HB3 SER 41 2HB SER 41 -0.779 -12.418 -0.530 350 HG SER 41 HG SER 41 -1.646 -11.155 1.729 351 H ASP 42 H ASP 42 -0.806 -14.561 -1.541 352 HA ASP 42 HA ASP 42 1.133 -16.654 -0.701 353 HB2 ASP 42 1HB ASP 42 -0.403 -16.241 -3.284 354 HB3 ASP 42 2HB ASP 42 0.867 -17.442 -3.078 355 H TRP 43 H TRP 43 0.698 -13.603 -2.173 356 HA TRP 43 HA TRP 43 2.090 -12.053 -3.113 357 HB2 TRP 43 1HB TRP 43 4.332 -13.681 -1.904 358 HB3 TRP 43 2HB TRP 43 4.382 -11.982 -2.371 359 HD1 TRP 43 HD1 TRP 43 3.921 -14.057 0.547 360 HE1 TRP 43 HE1 TRP 43 2.799 -12.782 2.468 361 HE3 TRP 43 HE3 TRP 43 2.205 -9.965 -1.988 362 HZ2 TRP 43 HZ2 TRP 43 1.372 -10.335 2.896 363 HZ3 TRP 43 HZ3 TRP 43 0.967 -8.180 -0.799 364 HH2 TRP 43 HH2 TRP 43 0.548 -8.358 1.638 365 H LYS 44 H LYS 44 1.286 -13.645 -5.041 366 HA LYS 44 HA LYS 44 3.607 -13.797 -6.809 367 HB2 LYS 44 1HB LYS 44 3.192 -16.115 -7.508 368 HB3 LYS 44 2HB LYS 44 3.618 -16.022 -5.801 369 HG2 LYS 44 1HG LYS 44 1.301 -16.273 -5.143 370 HG3 LYS 44 2HG LYS 44 0.764 -16.167 -6.818 371 HD2 LYS 44 1HD LYS 44 0.783 -18.498 -6.106 372 HD3 LYS 44 2HD LYS 44 2.001 -18.233 -7.351 373 HE2 LYS 44 1HE LYS 44 3.784 -18.371 -5.792 374 HE3 LYS 44 2HE LYS 44 2.725 -18.073 -4.414 375 HZ1 LYS 44 3HZ LYS 44 3.495 -20.456 -4.875 376 HZ2 LYS 44 1HZ LYS 44 2.346 -20.445 -6.122 377 HZ3 LYS 44 2HZ LYS 44 1.854 -20.199 -4.515 378 H GLU 45 H GLU 45 3.047 -14.003 -9.040 379 HA GLU 45 HA GLU 45 1.145 -12.347 -10.024 380 HB2 GLU 45 1HB GLU 45 2.107 -14.918 -11.288 381 HB3 GLU 45 2HB GLU 45 1.241 -13.647 -12.150 382 HG2 GLU 45 1HG GLU 45 3.041 -12.044 -11.498 383 HG3 GLU 45 2HG GLU 45 3.910 -13.388 -10.760 384 H GLY 46 H GLY 46 -0.972 -12.236 -9.884 385 HA2 GLY 46 1HA GLY 46 -3.208 -12.848 -10.132 386 HA3 GLY 46 2HA GLY 46 -2.694 -14.494 -10.476 387 H SER 47 H SER 47 -1.291 -13.294 -7.625 388 HA SER 47 HA SER 47 -2.731 -15.174 -6.005 389 HB2 SER 47 1HB SER 47 -0.467 -14.715 -5.408 390 HB3 SER 47 2HB SER 47 -0.766 -12.987 -5.327 391 HG SER 47 HG SER 47 -1.983 -13.290 -3.513 392 H GLN 48 H GLN 48 -4.503 -14.924 -4.840 393 HA GLN 48 HA GLN 48 -5.863 -12.324 -4.793 394 HB2 GLN 48 1HB GLN 48 -7.157 -14.381 -5.291 395 HB3 GLN 48 2HB GLN 48 -6.750 -15.013 -3.695 396 HG2 GLN 48 1HG GLN 48 -7.918 -13.178 -2.610 397 HG3 GLN 48 2HG GLN 48 -8.197 -12.386 -4.159 398 HE21 GLN 48 2HE2 GLN 48 -10.450 -12.567 -4.436 399 HE22 GLN 48 1HE2 GLN 48 -11.305 -14.032 -4.345 400 H ILE 49 H ILE 49 -6.460 -11.282 -2.854 401 HA ILE 49 HA ILE 49 -5.283 -12.263 -0.328 402 HB ILE 49 HB ILE 49 -4.138 -10.176 0.140 403 HG12 ILE 49 1HG1 ILE 49 -4.989 -9.323 -2.650 404 HG13 ILE 49 2HG1 ILE 49 -5.615 -8.652 -1.147 405 HG21 ILE 49 1HG2 ILE 49 -3.019 -12.038 -1.178 406 HG22 ILE 49 2HG2 ILE 49 -2.289 -10.447 -1.368 407 HG23 ILE 49 3HG2 ILE 49 -3.329 -11.095 -2.635 408 HD11 ILE 49 3HD1 ILE 49 -3.914 -7.150 -1.923 409 HD12 ILE 49 1HD1 ILE 49 -2.777 -8.474 -2.175 410 HD13 ILE 49 2HD1 ILE 49 -3.249 -8.017 -0.539 411 H VAL 50 H VAL 50 -6.198 -11.435 1.527 412 HA VAL 50 HA VAL 50 -8.420 -9.517 1.267 413 HB VAL 50 HB VAL 50 -9.910 -11.007 2.602 414 HG11 VAL 50 1HG1 VAL 50 -10.579 -12.405 0.733 415 HG12 VAL 50 2HG1 VAL 50 -8.983 -12.259 -0.001 416 HG13 VAL 50 3HG1 VAL 50 -10.039 -10.850 0.102 417 HG21 VAL 50 3HG2 VAL 50 -7.735 -13.041 2.017 418 HG22 VAL 50 1HG2 VAL 50 -9.326 -13.427 2.676 419 HG23 VAL 50 2HG2 VAL 50 -8.201 -12.439 3.607 420 H TRP 51 H TRP 51 -9.078 -8.569 3.236 421 HA TRP 51 HA TRP 51 -7.221 -8.925 5.540 422 HB2 TRP 51 1HB TRP 51 -8.307 -6.269 4.562 423 HB3 TRP 51 2HB TRP 51 -7.162 -6.538 5.872 424 HD1 TRP 51 HD1 TRP 51 -5.207 -8.557 4.408 425 HE1 TRP 51 HE1 TRP 51 -3.669 -7.710 2.534 426 HE3 TRP 51 HE3 TRP 51 -7.714 -4.329 3.086 427 HZ2 TRP 51 HZ2 TRP 51 -3.518 -5.514 0.712 428 HZ3 TRP 51 HZ3 TRP 51 -6.849 -2.867 1.284 429 HH2 TRP 51 HH2 TRP 51 -4.756 -3.453 0.092 430 H LYS 52 H LYS 52 -8.200 -9.162 7.437 431 HA LYS 52 HA LYS 52 -11.139 -8.939 7.549 432 HB2 LYS 52 1HB LYS 52 -9.978 -10.978 8.437 433 HB3 LYS 52 2HB LYS 52 -9.240 -9.964 9.678 434 HG2 LYS 52 1HG LYS 52 -11.445 -9.337 10.532 435 HG3 LYS 52 2HG LYS 52 -12.231 -10.240 9.238 436 HD2 LYS 52 1HD LYS 52 -11.209 -12.327 10.084 437 HD3 LYS 52 2HD LYS 52 -10.453 -11.416 11.394 438 HE2 LYS 52 1HE LYS 52 -12.671 -10.730 12.212 439 HE3 LYS 52 2HE LYS 52 -13.439 -11.612 10.890 440 HZ1 LYS 52 3HZ LYS 52 -13.480 -13.000 12.787 441 HZ2 LYS 52 1HZ LYS 52 -11.839 -12.734 13.118 442 HZ3 LYS 52 2HZ LYS 52 -12.293 -13.633 11.751 443 H GLY 53 H GLY 53 -12.224 -7.504 8.804 444 HA2 GLY 53 1HA GLY 53 -10.916 -5.871 10.808 445 HA3 GLY 53 2HA GLY 53 -11.291 -4.990 9.328 446 H GLU 54 H GLU 54 -12.457 -4.082 11.533 447 HA GLU 54 HA GLU 54 -15.298 -4.879 11.253 448 HB2 GLU 54 1HB GLU 54 -14.335 -5.804 13.358 449 HB3 GLU 54 2HB GLU 54 -13.932 -4.163 13.859 450 HG2 GLU 54 1HG GLU 54 -16.297 -3.530 13.788 451 HG3 GLU 54 2HG GLU 54 -16.727 -5.131 13.185 452 H TRP 55 H TRP 55 -16.664 -3.260 10.989 453 HA TRP 55 HA TRP 55 -15.833 -0.472 11.588 454 HB2 TRP 55 1HB TRP 55 -15.338 -0.932 9.212 455 HB3 TRP 55 2HB TRP 55 -17.009 -1.432 8.963 456 HD1 TRP 55 HD1 TRP 55 -18.782 0.413 8.603 457 HE1 TRP 55 HE1 TRP 55 -18.698 2.983 8.443 458 HE3 TRP 55 HE3 TRP 55 -14.004 1.245 10.216 459 HZ2 TRP 55 HZ2 TRP 55 -16.853 5.109 8.930 460 HZ3 TRP 55 HZ3 TRP 55 -13.113 3.554 10.355 461 HH2 TRP 55 HH2 TRP 55 -14.529 5.485 9.716 462 H LYS 56 H LYS 56 -17.313 0.349 12.880 463 HA LYS 56 HA LYS 56 -19.330 0.772 13.929 464 HB2 LYS 56 1HB LYS 56 -20.276 0.371 11.077 465 HB3 LYS 56 2HB LYS 56 -21.287 1.011 12.374 466 HG2 LYS 56 1HG LYS 56 -19.696 2.857 12.719 467 HG3 LYS 56 2HG LYS 56 -18.671 2.220 11.432 468 HD2 LYS 56 1HD LYS 56 -20.506 2.513 9.814 469 HD3 LYS 56 2HD LYS 56 -21.540 3.145 11.098 470 HE2 LYS 56 1HE LYS 56 -19.946 4.995 11.468 471 HE3 LYS 56 2HE LYS 56 -18.923 4.369 10.173 472 HZ1 LYS 56 3HZ LYS 56 -21.427 4.527 9.080 473 HZ2 LYS 56 1HZ LYS 56 -20.141 5.600 8.806 474 HZ3 LYS 56 2HZ LYS 56 -21.292 5.945 10.006 475 H GLY 57 H GLY 57 -18.397 -1.924 14.051 476 HA2 GLY 57 1HA GLY 57 -19.192 -3.891 15.004 477 HA3 GLY 57 2HA GLY 57 -20.829 -3.251 14.880 478 H LYS 58 H LYS 58 -19.696 -2.782 11.909 479 HA LYS 58 HA LYS 58 -20.852 -5.306 10.882 480 HB2 LYS 58 1HB LYS 58 -20.131 -2.776 9.392 481 HB3 LYS 58 2HB LYS 58 -21.076 -4.128 8.780 482 HG2 LYS 58 1HG LYS 58 -21.866 -2.364 11.123 483 HG3 LYS 58 2HG LYS 58 -22.500 -2.218 9.485 484 HD2 LYS 58 1HD LYS 58 -23.212 -4.706 9.739 485 HD3 LYS 58 2HD LYS 58 -22.925 -4.475 11.466 486 HE2 LYS 58 1HE LYS 58 -25.284 -4.060 10.958 487 HE3 LYS 58 2HE LYS 58 -24.503 -2.562 11.466 488 HZ1 LYS 58 3HZ LYS 58 -24.718 -3.313 8.615 489 HZ2 LYS 58 1HZ LYS 58 -24.410 -1.786 9.284 490 HZ3 LYS 58 2HZ LYS 58 -25.961 -2.470 9.411 491 H ALA 59 H ALA 59 -19.447 -6.874 10.541 492 HA ALA 59 HA ALA 59 -16.648 -6.478 10.143 493 HB1 ALA 59 3HB ALA 59 -17.600 -8.516 11.168 494 HB2 ALA 59 1HB ALA 59 -16.566 -8.890 9.787 495 HB3 ALA 59 2HB ALA 59 -18.322 -8.942 9.616 496 H TYR 60 H TYR 60 -15.483 -6.336 8.294 497 HA TYR 60 HA TYR 60 -16.795 -6.883 5.696 498 HB2 TYR 60 1HB TYR 60 -16.198 -4.756 4.783 499 HB3 TYR 60 2HB TYR 60 -17.036 -4.438 6.298 500 HD1 TYR 60 HD2 TYR 60 -15.604 -4.110 8.430 501 HD2 TYR 60 HD1 TYR 60 -13.990 -3.912 4.451 502 HE1 TYR 60 HE2 TYR 60 -13.618 -2.898 9.289 503 HE2 TYR 60 HE1 TYR 60 -12.011 -2.705 5.310 504 HH TYR 60 HH TYR 60 -10.991 -1.885 7.094 505 H GLU 61 H GLU 61 -15.339 -7.167 3.951 506 HA GLU 61 HA GLU 61 -12.486 -7.521 4.659 507 HB2 GLU 61 1HB GLU 61 -12.563 -9.679 3.287 508 HB3 GLU 61 2HB GLU 61 -13.290 -9.749 4.889 509 HG2 GLU 61 1HG GLU 61 -14.917 -9.166 2.396 510 HG3 GLU 61 2HG GLU 61 -14.645 -10.801 2.986 511 H ASP 62 H ASP 62 -11.133 -6.834 3.179 512 HA ASP 62 HA ASP 62 -12.160 -5.597 0.730 513 HB2 ASP 62 1HB ASP 62 -9.402 -5.667 1.994 514 HB3 ASP 62 2HB ASP 62 -9.799 -4.793 0.514 515 H LYS 63 H LYS 63 -11.591 -6.258 -1.358 516 HA LYS 63 HA LYS 63 -10.076 -8.821 -1.586 517 HB2 LYS 63 1HB LYS 63 -12.573 -9.137 -1.591 518 HB3 LYS 63 2HB LYS 63 -12.632 -8.228 -3.099 519 HG2 LYS 63 1HG LYS 63 -11.019 -9.856 -4.098 520 HG3 LYS 63 2HG LYS 63 -11.083 -10.796 -2.611 521 HD2 LYS 63 1HD LYS 63 -13.517 -10.135 -4.299 522 HD3 LYS 63 2HD LYS 63 -12.604 -11.632 -4.446 523 HE2 LYS 63 1HE LYS 63 -13.039 -11.967 -1.929 524 HE3 LYS 63 2HE LYS 63 -14.233 -10.677 -2.082 525 HZ1 LYS 63 3HZ LYS 63 -15.581 -11.929 -3.385 526 HZ2 LYS 63 1HZ LYS 63 -14.878 -13.172 -2.469 527 HZ3 LYS 63 2HZ LYS 63 -14.309 -12.849 -4.037 528 H GLY 64 H GLY 64 -8.553 -8.806 -3.035 529 HA2 GLY 64 1HA GLY 64 -8.793 -7.388 -5.567 530 HA3 GLY 64 2HA GLY 64 -7.539 -6.779 -4.487 531 H THR 65 H THR 65 -6.419 -7.584 -6.630 532 HA THR 65 HA THR 65 -5.173 -10.177 -5.968 533 HB THR 65 HB THR 65 -6.352 -9.581 -8.694 534 HG1 THR 65 HG1 THR 65 -7.350 -11.747 -7.844 535 HG21 THR 65 3HG2 THR 65 -5.670 -11.991 -9.097 536 HG22 THR 65 1HG2 THR 65 -4.721 -11.894 -7.615 537 HG23 THR 65 2HG2 THR 65 -4.331 -10.849 -8.982 538 H ILE 66 H ILE 66 -3.154 -10.515 -6.949 539 HA ILE 66 HA ILE 66 -1.622 -8.090 -7.286 540 HB ILE 66 HB ILE 66 -0.827 -10.982 -7.686 541 HG12 ILE 66 1HG1 ILE 66 -1.591 -10.598 -5.400 542 HG13 ILE 66 2HG1 ILE 66 0.154 -10.789 -5.416 543 HG21 ILE 66 1HG2 ILE 66 0.807 -8.438 -7.494 544 HG22 ILE 66 2HG2 ILE 66 0.785 -9.618 -8.808 545 HG23 ILE 66 3HG2 ILE 66 1.494 -10.043 -7.252 546 HD11 ILE 66 3HD1 ILE 66 -0.081 -8.957 -4.011 547 HD12 ILE 66 1HD1 ILE 66 -1.478 -8.328 -4.880 548 HD13 ILE 66 2HD1 ILE 66 0.140 -8.135 -5.552 549 H LEU 67 H LEU 67 -1.595 -6.981 -9.108 550 HA LEU 67 HA LEU 67 -2.410 -8.039 -11.634 551 HB2 LEU 67 1HB LEU 67 -2.756 -5.685 -11.141 552 HB3 LEU 67 2HB LEU 67 -1.035 -5.444 -10.901 553 HG LEU 67 HG LEU 67 -0.596 -5.909 -13.268 554 HD11 LEU 67 1HD1 LEU 67 -2.189 -7.519 -13.934 555 HD12 LEU 67 2HD1 LEU 67 -2.707 -6.072 -14.786 556 HD13 LEU 67 3HD1 LEU 67 -3.547 -6.577 -13.321 557 HD21 LEU 67 3HD2 LEU 67 -1.766 -3.953 -14.236 558 HD22 LEU 67 1HD2 LEU 67 -1.148 -3.609 -12.620 559 HD23 LEU 67 2HD2 LEU 67 -2.865 -3.938 -12.857 560 H GLN 68 H GLN 68 0.713 -7.265 -10.178 561 HA GLN 68 HA GLN 68 2.071 -9.110 -11.992 562 HB2 GLN 68 1HB GLN 68 2.078 -6.883 -13.164 563 HB3 GLN 68 2HB GLN 68 2.965 -6.219 -11.794 564 HG2 GLN 68 1HG GLN 68 4.777 -7.848 -12.156 565 HG3 GLN 68 2HG GLN 68 3.885 -8.550 -13.505 566 HE21 GLN 68 2HE2 GLN 68 5.156 -7.931 -15.293 567 HE22 GLN 68 1HE2 GLN 68 5.575 -6.326 -15.650 568 H PHE 69 H PHE 69 4.032 -9.846 -11.160 569 HA PHE 69 HA PHE 69 4.812 -8.858 -8.461 570 HB2 PHE 69 1HB PHE 69 3.427 -10.908 -8.274 571 HB3 PHE 69 2HB PHE 69 4.594 -11.756 -9.270 572 HD1 PHE 69 HD1 PHE 69 4.142 -9.935 -6.063 573 HD2 PHE 69 HD2 PHE 69 6.665 -12.546 -8.357 574 HE1 PHE 69 HE1 PHE 69 5.548 -10.336 -4.055 575 HE2 PHE 69 HE2 PHE 69 8.076 -12.941 -6.352 576 HZ PHE 69 HZ PHE 69 7.518 -11.833 -4.206 577 H ASN 70 H ASN 70 6.699 -7.928 -8.912 578 HA ASN 70 HA ASN 70 8.825 -9.596 -10.178 579 HB2 ASN 70 1HB ASN 70 8.363 -6.612 -10.439 580 HB3 ASN 70 2HB ASN 70 9.807 -7.458 -10.987 581 HD21 ASN 70 2HD2 ASN 70 8.025 -6.058 -12.805 582 HD22 ASN 70 1HD2 ASN 70 7.328 -7.221 -13.824 583 H GLU 71 H GLU 71 9.906 -10.276 -8.472 584 HA GLU 71 HA GLU 71 10.176 -9.230 -5.959 585 HB2 GLU 71 1HB GLU 71 12.221 -10.763 -7.573 586 HB3 GLU 71 2HB GLU 71 12.328 -10.496 -5.831 587 HG2 GLU 71 1HG GLU 71 10.171 -11.632 -5.507 588 HG3 GLU 71 2HG GLU 71 10.024 -11.872 -7.248 589 H ARG 72 H ARG 72 11.293 -7.702 -4.965 590 HA ARG 72 HA ARG 72 12.287 -5.610 -4.793 591 HB2 ARG 72 1HB ARG 72 14.764 -5.783 -5.159 592 HB3 ARG 72 2HB ARG 72 14.082 -7.059 -4.157 593 HG2 ARG 72 1HG ARG 72 14.133 -8.630 -6.001 594 HG3 ARG 72 2HG ARG 72 14.607 -7.361 -7.132 595 HD2 ARG 72 1HD ARG 72 16.563 -8.675 -6.485 596 HD3 ARG 72 2HD ARG 72 16.700 -7.045 -5.832 597 HE ARG 72 HE ARG 72 16.476 -7.914 -3.680 598 HH11 ARG 72 1HH2 ARG 72 15.677 -10.268 -6.083 599 HH12 ARG 72 2HH2 ARG 72 15.565 -11.582 -4.962 600 HH21 ARG 72 1HH1 ARG 72 16.321 -9.613 -2.197 601 HH22 ARG 72 2HH1 ARG 72 15.933 -11.209 -2.747 602 H SER 73 H SER 73 10.770 -5.211 -6.950 603 HA SER 73 HA SER 73 12.404 -3.422 -8.546 604 HB2 SER 73 1HB SER 73 12.667 -5.768 -9.551 605 HB3 SER 73 2HB SER 73 10.993 -5.621 -10.064 606 HG SER 73 HG SER 73 12.217 -3.353 -10.662 607 H ILE 74 H ILE 74 9.360 -5.117 -9.305 608 HA ILE 74 HA ILE 74 7.872 -2.558 -8.958 609 HB ILE 74 HB ILE 74 7.697 -4.355 -11.401 610 HG12 ILE 74 1HG1 ILE 74 8.688 -1.491 -11.130 611 HG13 ILE 74 2HG1 ILE 74 9.741 -2.892 -11.263 612 HG21 ILE 74 1HG2 ILE 74 5.516 -3.414 -10.883 613 HG22 ILE 74 2HG2 ILE 74 6.188 -2.483 -12.213 614 HG23 ILE 74 3HG2 ILE 74 6.221 -1.830 -10.577 615 HD11 ILE 74 3HD1 ILE 74 8.660 -3.459 -13.437 616 HD12 ILE 74 1HD1 ILE 74 9.513 -1.915 -13.455 617 HD13 ILE 74 2HD1 ILE 74 7.754 -1.949 -13.332 618 H LEU 75 H LEU 75 6.010 -2.757 -7.960 619 HA LEU 75 HA LEU 75 4.601 -5.370 -7.931 620 HB2 LEU 75 1HB LEU 75 6.038 -5.008 -5.832 621 HB3 LEU 75 2HB LEU 75 4.958 -3.676 -5.443 622 HG LEU 75 HG LEU 75 3.048 -5.521 -5.825 623 HD11 LEU 75 1HD1 LEU 75 5.445 -7.212 -5.033 624 HD12 LEU 75 2HD1 LEU 75 4.603 -7.306 -6.578 625 HD13 LEU 75 3HD1 LEU 75 3.771 -7.757 -5.093 626 HD21 LEU 75 3HD2 LEU 75 3.419 -4.379 -3.713 627 HD22 LEU 75 1HD2 LEU 75 4.818 -5.393 -3.377 628 HD23 LEU 75 2HD2 LEU 75 3.205 -6.103 -3.408 629 H GLN 76 H GLN 76 2.554 -5.131 -8.479 630 HA GLN 76 HA GLN 76 1.061 -2.700 -7.715 631 HB2 GLN 76 1HB GLN 76 0.091 -2.752 -10.137 632 HB3 GLN 76 2HB GLN 76 1.682 -2.036 -9.901 633 HG2 GLN 76 1HG GLN 76 2.790 -4.040 -10.644 634 HG3 GLN 76 2HG GLN 76 1.266 -4.920 -10.707 635 HE21 GLN 76 2HE2 GLN 76 0.837 -1.690 -11.726 636 HE22 GLN 76 1HE2 GLN 76 0.906 -1.959 -13.400 637 H TYR 77 H TYR 77 -1.110 -3.035 -7.411 638 HA TYR 77 HA TYR 77 -2.287 -5.627 -8.122 639 HB2 TYR 77 1HB TYR 77 -3.011 -6.082 -5.800 640 HB3 TYR 77 2HB TYR 77 -1.261 -6.143 -5.986 641 HD1 TYR 77 HD1 TYR 77 -4.096 -4.136 -4.698 642 HD2 TYR 77 HD2 TYR 77 0.180 -4.508 -4.912 643 HE1 TYR 77 HE1 TYR 77 -3.854 -2.422 -2.921 644 HE2 TYR 77 HE2 TYR 77 0.418 -2.792 -3.138 645 HH TYR 77 HH TYR 77 -1.767 -0.687 -2.303 646 H SER 78 H SER 78 -4.517 -5.753 -7.909 647 HA SER 78 HA SER 78 -5.884 -3.171 -8.211 648 HB2 SER 78 1HB SER 78 -7.852 -4.653 -8.753 649 HB3 SER 78 2HB SER 78 -6.470 -4.867 -9.823 650 HG SER 78 HG SER 78 -6.707 -6.889 -9.264 651 H HIS 79 H HIS 79 -7.679 -2.576 -6.871 652 HA HIS 79 HA HIS 79 -8.089 -4.148 -4.421 653 HB2 HIS 79 1HB HIS 79 -6.227 -2.576 -3.931 654 HB3 HIS 79 2HB HIS 79 -7.290 -1.227 -4.332 655 HD1 HIS 79 HD1 HIS 79 -8.839 -0.424 -2.520 656 HD2 HIS 79 HD2 HIS 79 -7.243 -4.175 -1.664 657 HE1 HIS 79 HE1 HIS 79 -9.638 -1.025 -0.194 658 HE2 HIS 79 HE2 HIS 79 -8.671 -3.311 0.347 659 H PHE 80 H PHE 80 -9.996 -3.889 -3.447 660 HA PHE 80 HA PHE 80 -11.875 -1.830 -4.402 661 HB2 PHE 80 1HB PHE 80 -12.413 -3.614 -5.900 662 HB3 PHE 80 2HB PHE 80 -12.282 -4.826 -4.629 663 HD1 PHE 80 HD1 PHE 80 -14.268 -1.874 -5.757 664 HD2 PHE 80 HD2 PHE 80 -14.186 -5.373 -3.267 665 HE1 PHE 80 HE1 PHE 80 -16.665 -1.554 -5.224 666 HE2 PHE 80 HE2 PHE 80 -16.592 -5.057 -2.744 667 HZ PHE 80 HZ PHE 80 -17.829 -3.142 -3.723 668 H SER 81 H SER 81 -13.142 -1.079 -2.835 669 HA SER 81 HA SER 81 -13.068 -2.415 -0.186 670 HB2 SER 81 1HB SER 81 -13.665 -0.129 0.702 671 HB3 SER 81 2HB SER 81 -12.070 -0.259 -0.033 672 HG SER 81 HG SER 81 -13.799 1.496 -0.636 673 HA PRO 82 HA PRO 82 -17.471 -2.940 -1.176 674 HB2 PRO 82 1HB PRO 82 -18.239 -4.401 1.026 675 HB3 PRO 82 2HB PRO 82 -17.365 -5.109 -0.348 676 HG2 PRO 82 1HG PRO 82 -16.316 -4.239 2.318 677 HG3 PRO 82 2HG PRO 82 -15.883 -5.655 1.348 678 HD2 PRO 82 1HD PRO 82 -14.347 -3.369 1.445 679 HD3 PRO 82 2HD PRO 82 -14.352 -4.468 0.046 680 H LEU 83 H LEU 83 -16.118 -1.407 1.588 681 HA LEU 83 HA LEU 83 -18.426 -0.554 2.967 682 HB2 LEU 83 1HB LEU 83 -15.822 0.955 2.644 683 HB3 LEU 83 2HB LEU 83 -16.994 1.140 3.947 684 HG LEU 83 HG LEU 83 -15.466 -1.420 3.344 685 HD11 LEU 83 1HD1 LEU 83 -13.955 0.312 4.146 686 HD12 LEU 83 2HD1 LEU 83 -14.241 -0.844 5.447 687 HD13 LEU 83 3HD1 LEU 83 -15.059 0.718 5.461 688 HD21 LEU 83 3HD2 LEU 83 -16.301 -1.904 5.769 689 HD22 LEU 83 1HD2 LEU 83 -17.459 -2.067 4.459 690 HD23 LEU 83 2HD2 LEU 83 -17.477 -0.629 5.480 691 H THR 84 H THR 84 -17.219 0.305 -0.104 692 HA THR 84 HA THR 84 -18.150 2.980 -0.300 693 HB THR 84 HB THR 84 -18.050 2.583 -2.760 694 HG1 THR 84 HG1 THR 84 -17.006 0.053 -2.299 695 HG21 THR 84 3HG2 THR 84 -16.028 3.226 -1.573 696 HG22 THR 84 1HG2 THR 84 -15.621 2.027 -2.803 697 HG23 THR 84 2HG2 THR 84 -15.737 1.550 -1.108 698 H GLY 85 H GLY 85 -19.729 -0.132 -0.711 699 HA2 GLY 85 1HA GLY 85 -21.982 -0.642 -0.684 700 HA3 GLY 85 2HA GLY 85 -22.346 1.076 -0.548 701 H LYS 86 H LYS 86 -20.287 1.049 -3.020 702 HA LYS 86 HA LYS 86 -22.433 1.097 -5.005 703 HB2 LYS 86 1HB LYS 86 -19.522 1.769 -5.439 704 HB3 LYS 86 2HB LYS 86 -20.904 2.304 -6.389 705 HG2 LYS 86 1HG LYS 86 -20.259 3.085 -3.526 706 HG3 LYS 86 2HG LYS 86 -20.182 4.123 -4.948 707 HD2 LYS 86 1HD LYS 86 -22.697 3.612 -5.251 708 HD3 LYS 86 2HD LYS 86 -22.645 2.966 -3.609 709 HE2 LYS 86 1HE LYS 86 -23.330 5.263 -3.439 710 HE3 LYS 86 2HE LYS 86 -21.663 5.182 -2.869 711 HZ1 LYS 86 3HZ LYS 86 -22.636 6.102 -5.512 712 HZ2 LYS 86 1HZ LYS 86 -21.005 5.758 -5.202 713 HZ3 LYS 86 2HZ LYS 86 -21.788 6.997 -4.343 714 HA PRO 87 HA PRO 87 -21.608 -2.849 -6.902 715 HB2 PRO 87 1HB PRO 87 -21.282 -1.354 -9.505 716 HB3 PRO 87 2HB PRO 87 -22.279 -2.782 -9.153 717 HG2 PRO 87 1HG PRO 87 -23.376 -0.359 -9.390 718 HG3 PRO 87 2HG PRO 87 -23.970 -1.521 -8.188 719 HD2 PRO 87 1HD PRO 87 -22.319 0.948 -7.751 720 HD3 PRO 87 2HD PRO 87 -23.514 0.170 -6.687 721 H ASP 88 H ASP 88 -19.795 -4.084 -7.399 722 HA ASP 88 HA ASP 88 -17.209 -2.823 -7.181 723 HB2 ASP 88 1HB ASP 88 -17.732 -4.991 -6.116 724 HB3 ASP 88 2HB ASP 88 -17.939 -5.706 -7.713 725 H LEU 89 H LEU 89 -17.108 -1.550 -9.081 726 HA LEU 89 HA LEU 89 -16.465 -3.091 -11.533 727 HB2 LEU 89 1HB LEU 89 -17.893 -0.440 -11.400 728 HB3 LEU 89 2HB LEU 89 -17.442 -1.280 -12.882 729 HG LEU 89 HG LEU 89 -19.260 -2.464 -10.751 730 HD11 LEU 89 1HD1 LEU 89 -20.270 -0.451 -11.783 731 HD12 LEU 89 2HD1 LEU 89 -21.125 -1.917 -12.262 732 HD13 LEU 89 3HD1 LEU 89 -20.003 -1.144 -13.383 733 HD21 LEU 89 3HD2 LEU 89 -18.442 -3.333 -13.543 734 HD22 LEU 89 1HD2 LEU 89 -19.920 -3.929 -12.791 735 HD23 LEU 89 2HD2 LEU 89 -18.368 -4.260 -12.045 736 HA PRO 90 HA PRO 90 -12.454 -1.182 -11.575 737 HB2 PRO 90 1HB PRO 90 -13.067 -0.382 -14.410 738 HB3 PRO 90 2HB PRO 90 -11.622 -1.182 -13.763 739 HG2 PRO 90 1HG PRO 90 -13.493 -2.551 -15.102 740 HG3 PRO 90 2HG PRO 90 -12.636 -3.262 -13.720 741 HD2 PRO 90 1HD PRO 90 -15.472 -2.299 -13.868 742 HD3 PRO 90 2HD PRO 90 -14.739 -3.545 -12.831 743 H GLU 91 H GLU 91 -15.173 0.644 -12.889 744 HA GLU 91 HA GLU 91 -13.946 3.218 -12.840 745 HB2 GLU 91 1HB GLU 91 -16.855 2.373 -12.765 746 HB3 GLU 91 2HB GLU 91 -16.311 4.040 -12.962 747 HG2 GLU 91 1HG GLU 91 -15.121 3.452 -15.011 748 HG3 GLU 91 2HG GLU 91 -15.540 1.753 -14.796 749 H ASN 92 H ASN 92 -15.750 1.327 -10.490 750 HA ASN 92 HA ASN 92 -16.139 3.405 -8.588 751 HB2 ASN 92 1HB ASN 92 -17.443 1.286 -8.698 752 HB3 ASN 92 2HB ASN 92 -16.019 0.423 -8.116 753 HD21 ASN 92 2HD2 ASN 92 -17.376 -0.149 -6.184 754 HD22 ASN 92 1HD2 ASN 92 -17.558 0.989 -4.939 755 H TYR 93 H TYR 93 -13.607 0.959 -8.985 756 HA TYR 93 HA TYR 93 -12.058 2.248 -6.784 757 HB2 TYR 93 1HB TYR 93 -11.068 0.144 -6.281 758 HB3 TYR 93 2HB TYR 93 -12.811 -0.064 -6.302 759 HD1 TYR 93 HD2 TYR 93 -13.929 -1.279 -8.147 760 HD2 TYR 93 HD1 TYR 93 -9.651 -0.910 -7.978 761 HE1 TYR 93 HE2 TYR 93 -13.702 -3.095 -9.819 762 HE2 TYR 93 HE1 TYR 93 -9.428 -2.738 -9.636 763 HH TYR 93 HH TYR 93 -10.513 -4.349 -10.752 764 H HIS 94 H HIS 94 -9.636 1.549 -7.011 765 HA HIS 94 HA HIS 94 -8.723 1.957 -9.807 766 HB2 HIS 94 1HB HIS 94 -6.925 3.517 -8.721 767 HB3 HIS 94 2HB HIS 94 -8.531 4.158 -9.022 768 HD1 HIS 94 HD1 HIS 94 -8.881 5.733 -7.104 769 HD2 HIS 94 HD2 HIS 94 -7.472 2.020 -5.828 770 HE1 HIS 94 HE1 HIS 94 -8.934 5.777 -4.571 771 HE2 HIS 94 HE2 HIS 94 -8.073 3.524 -3.779 772 H VAL 95 H VAL 95 -6.387 1.643 -10.030 773 HA VAL 95 HA VAL 95 -5.488 -0.708 -8.442 774 HB VAL 95 HB VAL 95 -4.648 0.189 -11.215 775 HG11 VAL 95 1HG1 VAL 95 -2.876 -1.057 -10.103 776 HG12 VAL 95 2HG1 VAL 95 -3.652 -2.117 -11.277 777 HG13 VAL 95 3HG1 VAL 95 -4.029 -2.277 -9.562 778 HG21 VAL 95 3HG2 VAL 95 -5.952 -1.792 -11.957 779 HG22 VAL 95 1HG2 VAL 95 -6.981 -0.597 -11.167 780 HG23 VAL 95 2HG2 VAL 95 -6.487 -2.049 -10.295 781 H VAL 96 H VAL 96 -3.797 -0.489 -7.179 782 HA VAL 96 HA VAL 96 -2.281 2.029 -7.161 783 HB VAL 96 HB VAL 96 -2.068 -0.319 -5.260 784 HG11 VAL 96 1HG1 VAL 96 -1.168 1.437 -3.745 785 HG12 VAL 96 2HG1 VAL 96 -1.253 2.596 -5.071 786 HG13 VAL 96 3HG1 VAL 96 -0.163 1.213 -5.177 787 HG21 VAL 96 3HG2 VAL 96 -3.576 1.031 -3.814 788 HG22 VAL 96 1HG2 VAL 96 -4.373 0.537 -5.308 789 HG23 VAL 96 2HG2 VAL 96 -3.778 2.187 -5.130 790 H THR 97 H THR 97 -0.253 2.263 -7.812 791 HA THR 97 HA THR 97 1.338 -0.151 -8.530 792 HB THR 97 HB THR 97 0.591 0.824 -10.599 793 HG1 THR 97 HG1 THR 97 3.152 1.908 -10.366 794 HG21 THR 97 3HG2 THR 97 0.114 3.121 -9.586 795 HG22 THR 97 1HG2 THR 97 0.847 3.126 -11.190 796 HG23 THR 97 2HG2 THR 97 1.836 3.452 -9.772 797 H ILE 98 H ILE 98 3.113 -0.314 -7.420 798 HA ILE 98 HA ILE 98 4.440 2.135 -6.352 799 HB ILE 98 HB ILE 98 4.383 -0.655 -5.158 800 HG12 ILE 98 1HG1 ILE 98 3.081 1.894 -4.121 801 HG13 ILE 98 2HG1 ILE 98 2.205 0.681 -5.054 802 HG21 ILE 98 1HG2 ILE 98 6.456 0.491 -4.618 803 HG22 ILE 98 2HG2 ILE 98 5.416 0.567 -3.201 804 HG23 ILE 98 3HG2 ILE 98 5.588 1.978 -4.241 805 HD11 ILE 98 3HD1 ILE 98 3.672 0.119 -2.462 806 HD12 ILE 98 1HD1 ILE 98 2.682 -1.022 -3.375 807 HD13 ILE 98 2HD1 ILE 98 1.932 0.374 -2.600 808 H THR 99 H THR 99 6.456 2.467 -6.975 809 HA THR 99 HA THR 99 7.988 0.249 -8.261 810 HB THR 99 HB THR 99 8.187 3.224 -8.826 811 HG1 THR 99 HG1 THR 99 6.274 2.349 -9.633 812 HG21 THR 99 3HG2 THR 99 9.508 0.763 -10.027 813 HG22 THR 99 1HG2 THR 99 10.301 2.119 -9.221 814 HG23 THR 99 2HG2 THR 99 9.531 2.352 -10.790 815 H LEU 100 H LEU 100 9.582 -0.422 -7.024 816 HA LEU 100 HA LEU 100 10.971 1.508 -5.230 817 HB2 LEU 100 1HB LEU 100 10.294 -1.418 -4.948 818 HB3 LEU 100 2HB LEU 100 11.607 -0.720 -4.008 819 HG LEU 100 HG LEU 100 8.872 0.600 -3.999 820 HD11 LEU 100 1HD1 LEU 100 8.407 -1.702 -3.383 821 HD12 LEU 100 2HD1 LEU 100 8.398 -0.724 -1.915 822 HD13 LEU 100 3HD1 LEU 100 9.793 -1.732 -2.293 823 HD21 LEU 100 3HD2 LEU 100 11.121 0.423 -1.953 824 HD22 LEU 100 1HD2 LEU 100 9.614 1.307 -1.737 825 HD23 LEU 100 2HD2 LEU 100 10.769 1.825 -2.958 826 H THR 101 H THR 101 12.961 1.974 -5.683 827 HA THR 101 HA THR 101 14.696 0.005 -7.058 828 HB THR 101 HB THR 101 14.636 2.930 -7.863 829 HG1 THR 101 HG1 THR 101 12.701 2.225 -8.535 830 HG21 THR 101 3HG2 THR 101 15.674 0.440 -9.252 831 HG22 THR 101 1HG2 THR 101 16.679 1.546 -8.310 832 HG23 THR 101 2HG2 THR 101 15.889 2.111 -9.783 833 H ALA 102 H ALA 102 16.811 0.077 -6.482 834 HA ALA 102 HA ALA 102 17.459 1.698 -4.105 835 HB1 ALA 102 3HB ALA 102 19.125 -0.514 -5.327 836 HB2 ALA 102 1HB ALA 102 17.803 -0.817 -4.199 837 HB3 ALA 102 2HB ALA 102 19.197 0.128 -3.682 838 H LEU 103 H LEU 103 18.635 3.474 -4.266 839 HA LEU 103 HA LEU 103 20.234 3.976 -6.723 840 HB2 LEU 103 1HB LEU 103 19.268 6.022 -4.709 841 HB3 LEU 103 2HB LEU 103 19.885 6.305 -6.336 842 HG LEU 103 HG LEU 103 17.303 4.891 -5.606 843 HD11 LEU 103 1HD1 LEU 103 17.881 7.553 -6.939 844 HD12 LEU 103 2HD1 LEU 103 17.189 7.306 -5.336 845 HD13 LEU 103 3HD1 LEU 103 16.277 6.839 -6.770 846 HD21 LEU 103 3HD2 LEU 103 18.058 3.810 -7.599 847 HD22 LEU 103 1HD2 LEU 103 18.695 5.308 -8.276 848 HD23 LEU 103 2HD2 LEU 103 16.953 5.051 -8.172 849 H LYS 104 H LYS 104 22.077 5.546 -6.245 850 HA LYS 104 HA LYS 104 24.000 4.229 -4.678 851 HB2 LYS 104 1HB LYS 104 24.014 7.052 -5.742 852 HB3 LYS 104 2HB LYS 104 25.429 6.167 -5.173 853 HG2 LYS 104 1HG LYS 104 23.647 5.241 -7.453 854 HG3 LYS 104 2HG LYS 104 25.137 6.152 -7.677 855 HD2 LYS 104 1HD LYS 104 26.284 4.252 -6.326 856 HD3 LYS 104 2HD LYS 104 24.809 3.329 -6.609 857 HE2 LYS 104 1HE LYS 104 26.336 2.753 -8.372 858 HE3 LYS 104 2HE LYS 104 25.094 3.784 -9.081 859 HZ1 LYS 104 3HZ LYS 104 27.205 5.353 -8.042 860 HZ2 LYS 104 1HZ LYS 104 26.621 5.269 -9.631 861 HZ3 LYS 104 2HZ LYS 104 27.827 4.189 -9.112 862 H LYS 105 H LYS 105 22.115 7.132 -3.966 863 HA LYS 105 HA LYS 105 23.417 7.665 -1.455 864 HB2 LYS 105 1HB LYS 105 20.723 8.634 -2.445 865 HB3 LYS 105 2HB LYS 105 21.667 9.334 -1.133 866 HG2 LYS 105 1HG LYS 105 22.649 9.163 -3.997 867 HG3 LYS 105 2HG LYS 105 21.833 10.573 -3.333 868 HD2 LYS 105 1HD LYS 105 23.626 10.699 -1.569 869 HD3 LYS 105 2HD LYS 105 24.478 9.405 -2.406 870 HE2 LYS 105 1HE LYS 105 24.642 10.749 -4.430 871 HE3 LYS 105 2HE LYS 105 23.717 12.045 -3.669 872 HZ1 LYS 105 3HZ LYS 105 26.479 11.228 -3.232 873 HZ2 LYS 105 1HZ LYS 105 25.611 11.723 -1.862 874 HZ3 LYS 105 2HZ LYS 105 25.782 12.777 -3.184 875 H GLY 106 H GLY 106 20.337 6.153 -2.382 876 HA2 GLY 106 1HA GLY 106 20.342 4.423 -0.131 877 HA3 GLY 106 2HA GLY 106 19.236 5.770 0.129 878 H VAL 107 H VAL 107 17.236 5.070 -0.210 879 HA VAL 107 HA VAL 107 16.637 3.535 -2.701 880 HB VAL 107 HB VAL 107 15.547 3.099 0.079 881 HG11 VAL 107 1HG1 VAL 107 14.266 1.204 -1.065 882 HG12 VAL 107 2HG1 VAL 107 14.659 1.989 -2.594 883 HG13 VAL 107 3HG1 VAL 107 13.672 2.831 -1.399 884 HG21 VAL 107 3HG2 VAL 107 16.511 0.864 -0.172 885 HG22 VAL 107 1HG2 VAL 107 17.755 2.094 -0.389 886 HG23 VAL 107 2HG2 VAL 107 17.072 1.274 -1.791 887 H GLU 108 H GLU 108 15.047 4.293 -3.892 888 HA GLU 108 HA GLU 108 13.419 6.566 -2.863 889 HB2 GLU 108 1HB GLU 108 14.846 7.015 -4.861 890 HB3 GLU 108 2HB GLU 108 13.947 5.779 -5.741 891 HG2 GLU 108 1HG GLU 108 11.853 7.035 -5.386 892 HG3 GLU 108 2HG GLU 108 12.734 8.255 -4.468 893 H VAL 109 H VAL 109 11.301 6.351 -2.693 894 HA VAL 109 HA VAL 109 9.949 3.995 -3.922 895 HB VAL 109 HB VAL 109 10.230 3.631 -1.509 896 HG11 VAL 109 1HG1 VAL 109 8.631 6.180 -1.171 897 HG12 VAL 109 2HG1 VAL 109 10.354 6.008 -0.851 898 HG13 VAL 109 3HG1 VAL 109 9.189 5.114 0.116 899 HG21 VAL 109 3HG2 VAL 109 7.932 3.111 -1.016 900 HG22 VAL 109 1HG2 VAL 109 8.134 2.919 -2.756 901 HG23 VAL 109 2HG2 VAL 109 7.347 4.361 -2.114 902 H GLU 110 H GLU 110 7.996 4.312 -4.809 903 HA GLU 110 HA GLU 110 6.732 6.985 -4.642 904 HB2 GLU 110 1HB GLU 110 8.195 6.988 -6.639 905 HB3 GLU 110 2HB GLU 110 7.369 5.551 -7.238 906 HG2 GLU 110 1HG GLU 110 5.264 6.755 -7.388 907 HG3 GLU 110 2HG GLU 110 5.973 8.173 -6.617 908 H LEU 111 H LEU 111 4.606 6.925 -4.564 909 HA LEU 111 HA LEU 111 3.159 4.414 -5.250 910 HB2 LEU 111 1HB LEU 111 3.441 4.661 -2.797 911 HB3 LEU 111 2HB LEU 111 2.629 6.220 -2.865 912 HG LEU 111 HG LEU 111 1.121 3.941 -4.129 913 HD11 LEU 111 1HD1 LEU 111 2.030 2.804 -2.150 914 HD12 LEU 111 2HD1 LEU 111 0.299 3.092 -1.973 915 HD13 LEU 111 3HD1 LEU 111 1.454 4.118 -1.120 916 HD21 LEU 111 3HD2 LEU 111 0.262 6.034 -2.099 917 HD22 LEU 111 1HD2 LEU 111 -0.789 5.000 -3.063 918 HD23 LEU 111 2HD2 LEU 111 0.166 6.256 -3.844 919 H THR 112 H THR 112 1.512 4.699 -6.589 920 HA THR 112 HA THR 112 0.392 7.440 -6.931 921 HB THR 112 HB THR 112 0.632 5.423 -9.165 922 HG1 THR 112 HG1 THR 112 2.675 6.211 -8.153 923 HG21 THR 112 3HG2 THR 112 -1.027 7.251 -9.413 924 HG22 THR 112 1HG2 THR 112 0.302 7.418 -10.560 925 HG23 THR 112 2HG2 THR 112 0.249 8.432 -9.118 926 H GLN 113 H GLN 113 -1.754 7.661 -7.246 927 HA GLN 113 HA GLN 113 -3.493 5.274 -7.301 928 HB2 GLN 113 1HB GLN 113 -3.121 5.940 -4.892 929 HB3 GLN 113 2HB GLN 113 -3.875 7.488 -5.263 930 HG2 GLN 113 1HG GLN 113 -5.917 6.260 -6.039 931 HG3 GLN 113 2HG GLN 113 -5.155 4.753 -5.537 932 HE21 GLN 113 2HE2 GLN 113 -7.326 7.036 -4.470 933 HE22 GLN 113 1HE2 GLN 113 -7.119 6.850 -2.795 934 H ASP 114 H ASP 114 -4.982 5.553 -8.806 935 HA ASP 114 HA ASP 114 -5.586 8.275 -9.790 936 HB2 ASP 114 1HB ASP 114 -6.287 5.641 -11.073 937 HB3 ASP 114 2HB ASP 114 -6.235 7.233 -11.828 938 H ASN 115 H ASN 115 -7.915 7.900 -11.041 939 HA ASN 115 HA ASN 115 -10.164 8.067 -10.829 940 HB2 ASN 115 1HB ASN 115 -9.875 5.598 -10.392 941 HB3 ASN 115 2HB ASN 115 -9.971 5.966 -8.669 942 HD21 ASN 115 2HD2 ASN 115 -12.036 4.934 -8.336 943 HD22 ASN 115 1HD2 ASN 115 -13.467 5.540 -9.018 944 H ASN 116 H ASN 116 -8.699 9.957 -9.240 945 HA ASN 116 HA ASN 116 -10.117 10.135 -6.681 946 HB2 ASN 116 1HB ASN 116 -8.229 12.039 -8.087 947 HB3 ASN 116 2HB ASN 116 -8.939 12.339 -6.506 948 HD21 ASN 116 2HD2 ASN 116 -6.106 11.340 -7.815 949 HD22 ASN 116 1HD2 ASN 116 -5.590 10.251 -6.620 950 H GLU 117 H GLU 117 -12.003 11.284 -6.384 951 HA GLU 117 HA GLU 117 -13.549 12.020 -8.620 952 HB2 GLU 117 1HB GLU 117 -14.535 11.319 -6.481 953 HB3 GLU 117 2HB GLU 117 -13.964 12.809 -5.731 954 HG2 GLU 117 1HG GLU 117 -15.354 14.149 -7.206 955 HG3 GLU 117 2HG GLU 117 -15.815 12.721 -8.133 956 H THR 118 H THR 118 -11.725 14.044 -6.334 957 HA THR 118 HA THR 118 -11.628 16.180 -8.353 958 HB THR 118 HB THR 118 -13.599 16.885 -7.213 959 HG1 THR 118 HG1 THR 118 -12.743 18.772 -7.043 960 HG21 THR 118 3HG2 THR 118 -13.574 15.446 -5.284 961 HG22 THR 118 1HG2 THR 118 -13.598 17.107 -4.696 962 HG23 THR 118 2HG2 THR 118 -12.095 16.189 -4.680 963 H GLU 119 H GLU 119 -10.336 18.097 -7.368 964 HA GLU 119 HA GLU 119 -7.738 17.191 -6.797 965 HB2 GLU 119 1HB GLU 119 -9.015 19.905 -6.356 966 HB3 GLU 119 2HB GLU 119 -7.286 19.590 -6.199 967 HG2 GLU 119 1HG GLU 119 -7.164 18.869 -8.518 968 HG3 GLU 119 2HG GLU 119 -8.906 19.046 -8.703 969 H LYS 120 H LYS 120 -10.363 18.287 -4.730 970 HA LYS 120 HA LYS 120 -8.988 18.423 -2.288 971 HB2 LYS 120 1HB LYS 120 -11.316 19.247 -2.673 972 HB3 LYS 120 2HB LYS 120 -11.863 17.572 -2.721 973 HG2 LYS 120 1HG LYS 120 -11.072 17.219 -0.423 974 HG3 LYS 120 2HG LYS 120 -10.443 18.867 -0.370 975 HD2 LYS 120 1HD LYS 120 -12.716 19.755 -0.706 976 HD3 LYS 120 2HD LYS 120 -13.352 18.113 -0.781 977 HE2 LYS 120 1HE LYS 120 -13.690 19.036 1.463 978 HE3 LYS 120 2HE LYS 120 -12.532 17.708 1.527 979 HZ1 LYS 120 3HZ LYS 120 -12.148 20.253 2.460 980 HZ2 LYS 120 1HZ LYS 120 -11.255 20.205 1.019 981 HZ3 LYS 120 2HZ LYS 120 -10.952 19.067 2.245 982 H GLU 121 H GLU 121 -10.518 15.704 -3.958 983 HA GLU 121 HA GLU 121 -10.083 13.801 -1.877 984 HB2 GLU 121 1HB GLU 121 -11.778 13.564 -3.740 985 HB3 GLU 121 2HB GLU 121 -10.436 13.233 -4.832 986 HG2 GLU 121 1HG GLU 121 -11.294 11.104 -4.108 987 HG3 GLU 121 2HG GLU 121 -9.759 11.338 -3.283 988 H GLN 122 H GLN 122 -8.260 14.785 -4.745 989 HA GLN 122 HA GLN 122 -6.286 12.755 -4.596 990 HB2 GLN 122 1HB GLN 122 -6.388 13.921 -6.656 991 HB3 GLN 122 2HB GLN 122 -6.353 15.494 -5.879 992 HG2 GLN 122 1HG GLN 122 -4.027 15.265 -5.307 993 HG3 GLN 122 2HG GLN 122 -4.030 13.558 -5.724 994 HE21 GLN 122 2HE2 GLN 122 -2.914 16.438 -6.855 995 HE22 GLN 122 1HE2 GLN 122 -2.964 16.142 -8.525 996 H LYS 123 H LYS 123 -6.443 16.064 -3.354 997 HA LYS 123 HA LYS 123 -3.925 16.090 -2.096 998 HB2 LYS 123 1HB LYS 123 -5.444 18.086 -2.556 999 HB3 LYS 123 2HB LYS 123 -6.413 17.562 -1.182 1000 HG2 LYS 123 1HG LYS 123 -4.969 19.133 -0.188 1001 HG3 LYS 123 2HG LYS 123 -4.139 17.619 0.147 1002 HD2 LYS 123 1HD LYS 123 -2.641 17.996 -1.784 1003 HD3 LYS 123 2HD LYS 123 -3.522 19.467 -2.190 1004 HE2 LYS 123 1HE LYS 123 -2.181 19.051 0.496 1005 HE3 LYS 123 2HE LYS 123 -1.369 19.812 -0.873 1006 HZ1 LYS 123 3HZ LYS 123 -3.077 21.011 0.943 1007 HZ2 LYS 123 1HZ LYS 123 -3.938 20.933 -0.517 1008 HZ3 LYS 123 2HZ LYS 123 -2.422 21.699 -0.467 1009 H HIS 124 H HIS 124 -7.124 15.105 -1.030 1010 HA HIS 124 HA HIS 124 -6.548 14.558 1.673 1011 HB2 HIS 124 1HB HIS 124 -8.832 14.735 0.671 1012 HB3 HIS 124 2HB HIS 124 -8.555 13.194 -0.139 1013 HD1 HIS 124 HD1 HIS 124 -8.730 14.642 3.374 1014 HD2 HIS 124 HD2 HIS 124 -9.070 10.974 1.426 1015 HE1 HIS 124 HE1 HIS 124 -9.521 12.977 5.114 1016 HE2 HIS 124 HE2 HIS 124 -9.732 10.734 3.938 1017 H SER 125 H SER 125 -6.324 12.636 -1.273 1018 HA SER 125 HA SER 125 -5.573 10.187 0.020 1019 HB2 SER 125 1HB SER 125 -5.240 11.120 -2.840 1020 HB3 SER 125 2HB SER 125 -4.919 9.484 -2.281 1021 HG SER 125 HG SER 125 -7.304 10.788 -2.728 1022 H GLU 126 H GLU 126 -3.791 12.689 -1.762 1023 HA GLU 126 HA GLU 126 -1.211 11.648 -1.551 1024 HB2 GLU 126 1HB GLU 126 -1.936 13.643 -2.913 1025 HB3 GLU 126 2HB GLU 126 -1.976 14.581 -1.421 1026 HG2 GLU 126 1HG GLU 126 0.411 14.089 -1.045 1027 HG3 GLU 126 2HG GLU 126 0.446 13.147 -2.530 1028 H ASP 127 H ASP 127 -2.951 13.849 0.646 1029 HA ASP 127 HA ASP 127 -0.887 14.083 2.572 1030 HB2 ASP 127 1HB ASP 127 -3.893 14.430 2.745 1031 HB3 ASP 127 2HB ASP 127 -2.812 14.771 4.095 1032 H ASN 128 H ASN 128 -3.556 11.807 2.158 1033 HA ASN 128 HA ASN 128 -3.260 10.462 4.642 1034 HB2 ASN 128 1HB ASN 128 -5.291 10.266 3.270 1035 HB3 ASN 128 2HB ASN 128 -4.367 9.459 2.007 1036 HD21 ASN 128 2HD2 ASN 128 -4.774 7.251 2.070 1037 HD22 ASN 128 1HD2 ASN 128 -4.953 6.333 3.487 1038 H TRP 129 H TRP 129 -2.195 9.567 1.357 1039 HA TRP 129 HA TRP 129 -0.717 7.308 2.139 1040 HB2 TRP 129 1HB TRP 129 -0.474 9.136 -0.269 1041 HB3 TRP 129 2HB TRP 129 0.516 7.688 -0.069 1042 HD1 TRP 129 HD1 TRP 129 -2.701 8.733 -1.490 1043 HE1 TRP 129 HE1 TRP 129 -4.251 6.710 -1.880 1044 HE3 TRP 129 HE3 TRP 129 -0.188 5.175 1.169 1045 HZ2 TRP 129 HZ2 TRP 129 -4.404 3.944 -1.157 1046 HZ3 TRP 129 HZ3 TRP 129 -1.051 2.858 1.301 1047 HH2 TRP 129 HH2 TRP 129 -3.153 2.237 0.141 1048 H ASN 130 H ASN 130 0.161 10.727 1.960 1049 HA ASN 130 HA ASN 130 2.928 10.481 2.353 1050 HB2 ASN 130 1HB ASN 130 0.945 12.607 3.205 1051 HB3 ASN 130 2HB ASN 130 2.669 12.763 3.530 1052 HD21 ASN 130 2HD2 ASN 130 1.094 14.493 1.742 1053 HD22 ASN 130 1HD2 ASN 130 1.770 14.324 0.194 1054 H THR 131 H THR 131 0.227 10.460 4.632 1055 HA THR 131 HA THR 131 1.753 10.364 7.009 1056 HB THR 131 HB THR 131 -0.976 9.105 6.611 1057 HG1 THR 131 HG1 THR 131 -1.742 11.026 6.364 1058 HG21 THR 131 3HG2 THR 131 0.396 10.395 8.985 1059 HG22 THR 131 1HG2 THR 131 0.113 8.667 8.763 1060 HG23 THR 131 2HG2 THR 131 -1.252 9.764 8.977 1061 H MET 132 H MET 132 0.477 7.893 4.838 1062 HA MET 132 HA MET 132 1.226 5.619 6.349 1063 HB2 MET 132 1HB MET 132 -0.325 5.633 4.351 1064 HB3 MET 132 2HB MET 132 1.097 5.816 3.328 1065 HG2 MET 132 1HG MET 132 0.611 3.473 3.387 1066 HG3 MET 132 2HG MET 132 2.015 3.697 4.422 1067 HE1 MET 132 3HE MET 132 0.115 1.181 4.413 1068 HE2 MET 132 1HE MET 132 -1.381 2.087 4.141 1069 HE3 MET 132 2HE MET 132 -1.175 1.140 5.612 1070 H LEU 133 H LEU 133 2.854 7.299 3.671 1071 HA LEU 133 HA LEU 133 5.223 5.754 3.716 1072 HB2 LEU 133 1HB LEU 133 4.400 8.397 2.565 1073 HB3 LEU 133 2HB LEU 133 6.128 8.102 2.683 1074 HG LEU 133 HG LEU 133 5.200 7.449 0.477 1075 HD11 LEU 133 1HD1 LEU 133 6.583 5.644 0.252 1076 HD12 LEU 133 2HD1 LEU 133 5.913 4.781 1.633 1077 HD13 LEU 133 3HD1 LEU 133 7.082 6.075 1.883 1078 HD21 LEU 133 3HD2 LEU 133 2.947 6.807 1.349 1079 HD22 LEU 133 1HD2 LEU 133 3.646 5.329 2.002 1080 HD23 LEU 133 2HD2 LEU 133 3.632 5.611 0.262 1081 H GLU 134 H GLU 134 4.249 8.674 5.436 1082 HA GLU 134 HA GLU 134 6.758 9.201 6.671 1083 HB2 GLU 134 1HB GLU 134 4.871 10.841 6.488 1084 HB3 GLU 134 2HB GLU 134 3.982 9.885 7.672 1085 HG2 GLU 134 1HG GLU 134 5.743 10.250 9.332 1086 HG3 GLU 134 2HG GLU 134 6.697 11.140 8.145 1087 H GLY 135 H GLY 135 3.887 7.353 7.595 1088 HA2 GLY 135 1HA GLY 135 4.714 6.615 10.193 1089 HA3 GLY 135 2HA GLY 135 3.519 5.769 9.211 1090 H LEU 136 H LEU 136 5.147 5.117 7.013 1091 HA LEU 136 HA LEU 136 6.421 2.747 7.937 1092 HB2 LEU 136 1HB LEU 136 5.398 2.904 5.694 1093 HB3 LEU 136 2HB LEU 136 6.585 4.117 5.233 1094 HG LEU 136 HG LEU 136 8.401 2.440 5.565 1095 HD11 LEU 136 1HD1 LEU 136 6.069 0.674 6.331 1096 HD12 LEU 136 2HD1 LEU 136 7.616 0.885 7.153 1097 HD13 LEU 136 3HD1 LEU 136 7.541 -0.022 5.651 1098 HD21 LEU 136 3HD2 LEU 136 7.798 1.039 3.582 1099 HD22 LEU 136 1HD2 LEU 136 7.466 2.756 3.343 1100 HD23 LEU 136 2HD2 LEU 136 6.145 1.643 3.703 1101 H LYS 137 H LYS 137 7.614 5.877 6.798 1102 HA LYS 137 HA LYS 137 10.366 5.239 6.857 1103 HB2 LYS 137 1HB LYS 137 9.470 7.212 5.671 1104 HB3 LYS 137 2HB LYS 137 9.055 7.947 7.219 1105 HG2 LYS 137 1HG LYS 137 11.409 7.982 7.876 1106 HG3 LYS 137 2HG LYS 137 11.864 7.130 6.398 1107 HD2 LYS 137 1HD LYS 137 11.028 9.026 5.057 1108 HD3 LYS 137 2HD LYS 137 10.565 9.869 6.536 1109 HE2 LYS 137 1HE LYS 137 12.724 10.718 5.811 1110 HE3 LYS 137 2HE LYS 137 12.959 9.767 7.277 1111 HZ1 LYS 137 3HZ LYS 137 13.620 7.888 5.920 1112 HZ2 LYS 137 1HZ LYS 137 14.604 9.228 5.588 1113 HZ3 LYS 137 2HZ LYS 137 13.373 8.791 4.501 1114 H LYS 138 H LYS 138 8.229 6.679 9.301 1115 HA LYS 138 HA LYS 138 10.197 7.169 11.247 1116 HB2 LYS 138 1HB LYS 138 7.872 8.066 11.309 1117 HB3 LYS 138 2HB LYS 138 7.295 6.449 11.713 1118 HG2 LYS 138 1HG LYS 138 8.622 6.442 13.763 1119 HG3 LYS 138 2HG LYS 138 9.331 8.000 13.339 1120 HD2 LYS 138 1HD LYS 138 7.086 9.035 13.426 1121 HD3 LYS 138 2HD LYS 138 6.390 7.474 13.866 1122 HE2 LYS 138 1HE LYS 138 6.759 8.844 15.875 1123 HE3 LYS 138 2HE LYS 138 7.802 7.422 15.896 1124 HZ1 LYS 138 3HZ LYS 138 8.575 10.179 15.104 1125 HZ2 LYS 138 1HZ LYS 138 9.583 8.824 14.958 1126 HZ3 LYS 138 2HZ LYS 138 9.078 9.340 16.494 1127 H PHE 139 H PHE 139 8.234 4.285 10.591 1128 HA PHE 139 HA PHE 139 9.078 2.813 12.864 1129 HB2 PHE 139 1HB PHE 139 7.064 2.219 11.582 1130 HB3 PHE 139 2HB PHE 139 8.068 1.817 10.190 1131 HD1 PHE 139 HD2 PHE 139 9.553 -0.156 10.216 1132 HD2 PHE 139 HD1 PHE 139 6.982 0.743 13.547 1133 HE1 PHE 139 HE2 PHE 139 9.909 -2.440 11.113 1134 HE2 PHE 139 HE1 PHE 139 7.345 -1.544 14.440 1135 HZ PHE 139 HZ PHE 139 8.809 -3.134 13.224 1136 H LEU 140 H LEU 140 10.144 2.745 9.474 1137 HA LEU 140 HA LEU 140 12.192 0.839 9.885 1138 HB2 LEU 140 1HB LEU 140 11.028 1.815 7.686 1139 HB3 LEU 140 2HB LEU 140 12.428 2.880 7.679 1140 HG LEU 140 HG LEU 140 12.440 -0.152 7.670 1141 HD11 LEU 140 1HD1 LEU 140 13.393 1.867 5.621 1142 HD12 LEU 140 2HD1 LEU 140 11.879 0.967 5.537 1143 HD13 LEU 140 3HD1 LEU 140 13.419 0.111 5.449 1144 HD21 LEU 140 3HD2 LEU 140 14.990 0.266 7.326 1145 HD22 LEU 140 1HD2 LEU 140 14.341 0.387 8.957 1146 HD23 LEU 140 2HD2 LEU 140 14.683 1.852 8.035 1147 H GLU 141 H GLU 141 12.206 4.380 9.888 1148 HA GLU 141 HA GLU 141 15.050 4.587 10.358 1149 HB2 GLU 141 1HB GLU 141 12.828 6.638 10.567 1150 HB3 GLU 141 2HB GLU 141 14.546 6.999 10.738 1151 HG2 GLU 141 1HG GLU 141 13.330 5.695 8.286 1152 HG3 GLU 141 2HG GLU 141 13.651 7.420 8.425 1153 H ASN 142 H ASN 142 12.618 3.518 12.252 1154 HA ASN 142 HA ASN 142 12.966 4.839 14.714 1155 HB2 ASN 142 1HB ASN 142 11.112 3.230 14.106 1156 HB3 ASN 142 2HB ASN 142 12.264 1.919 14.350 1157 HD21 ASN 142 2HD2 ASN 142 11.278 1.037 16.243 1158 HD22 ASN 142 1HD2 ASN 142 11.191 1.885 17.711 1159 H LYS 143 H LYS 143 14.712 2.162 13.219 1160 HA LYS 143 HA LYS 143 16.199 1.322 15.441 1161 HB2 LYS 143 1HB LYS 143 17.709 0.292 13.836 1162 HB3 LYS 143 2HB LYS 143 16.044 0.069 13.310 1163 HG2 LYS 143 1HG LYS 143 16.307 2.051 11.797 1164 HG3 LYS 143 2HG LYS 143 18.010 2.127 12.254 1165 HD2 LYS 143 1HD LYS 143 18.268 -0.243 11.475 1166 HD3 LYS 143 2HD LYS 143 16.612 -0.176 10.872 1167 HE2 LYS 143 1HE LYS 143 18.812 1.732 10.029 1168 HE3 LYS 143 2HE LYS 143 18.328 0.307 9.110 1169 HZ1 LYS 143 3HZ LYS 143 16.755 1.538 8.191 1170 HZ2 LYS 143 1HZ LYS 143 17.120 2.859 9.188 1171 HZ3 LYS 143 2HZ LYS 143 16.005 1.688 9.709 1172 H VAL 144 H VAL 144 16.781 3.929 13.134 1173 HA VAL 144 HA VAL 144 19.420 4.541 13.932 1174 HB VAL 144 HB VAL 144 17.283 6.322 12.731 1175 HG11 VAL 144 1HG1 VAL 144 20.271 6.717 13.103 1176 HG12 VAL 144 2HG1 VAL 144 18.974 7.749 13.709 1177 HG13 VAL 144 3HG1 VAL 144 19.303 7.673 11.980 1178 HG21 VAL 144 3HG2 VAL 144 17.830 4.406 11.326 1179 HG22 VAL 144 1HG2 VAL 144 19.556 4.709 11.531 1180 HG23 VAL 144 2HG2 VAL 144 18.560 5.853 10.631 1181 H SER 145 H SER 145 16.278 5.776 15.044 1182 HA SER 145 HA SER 145 17.220 7.724 16.833 1183 HB2 SER 145 1HB SER 145 14.728 6.017 17.023 1184 HB3 SER 145 2HB SER 145 15.029 7.481 17.950 1185 HG SER 145 HG SER 145 13.951 7.325 15.592 1186 H ALA 146 H ALA 146 16.596 4.277 17.277 1187 HA ALA 146 HA ALA 146 17.062 4.140 20.055 1188 HB1 ALA 146 3HB ALA 146 17.460 2.047 17.905 1189 HB2 ALA 146 1HB ALA 146 15.991 2.317 18.844 1190 HB3 ALA 146 2HB ALA 146 17.450 1.722 19.639 Start of MODEL 4 1 H1 MET 1 1H MET 1 -7.316 7.302 -23.781 2 H2 MET 1 2H MET 1 -6.867 7.092 -22.157 3 H3 MET 1 3H MET 1 -6.022 6.277 -23.385 4 HA MET 1 HA MET 1 -4.630 8.039 -22.781 5 HB2 MET 1 1HB MET 1 -6.291 8.754 -25.218 6 HB3 MET 1 2HB MET 1 -4.780 9.559 -24.801 7 HG2 MET 1 1HG MET 1 -3.587 7.410 -24.914 8 HG3 MET 1 2HG MET 1 -5.095 6.585 -25.302 9 HE1 MET 1 3HE MET 1 -3.477 5.660 -27.052 10 HE2 MET 1 1HE MET 1 -2.165 6.839 -27.158 11 HE3 MET 1 2HE MET 1 -3.101 6.427 -28.593 12 H GLU 2 H GLU 2 -7.251 8.331 -21.331 13 HA GLU 2 HA GLU 2 -6.906 11.037 -20.455 14 HB2 GLU 2 1HB GLU 2 -8.190 11.413 -22.548 15 HB3 GLU 2 2HB GLU 2 -9.478 10.396 -21.909 16 HG2 GLU 2 1HG GLU 2 -9.776 11.925 -20.010 17 HG3 GLU 2 2HG GLU 2 -8.446 12.924 -20.593 18 H ILE 3 H ILE 3 -7.329 10.994 -18.346 19 HA ILE 3 HA ILE 3 -9.574 9.400 -17.294 20 HB ILE 3 HB ILE 3 -8.262 8.200 -15.710 21 HG12 ILE 3 1HG1 ILE 3 -6.646 9.860 -15.002 22 HG13 ILE 3 2HG1 ILE 3 -5.743 8.482 -15.605 23 HG21 ILE 3 1HG2 ILE 3 -6.825 6.839 -17.101 24 HG22 ILE 3 2HG2 ILE 3 -6.668 8.135 -18.283 25 HG23 ILE 3 3HG2 ILE 3 -8.222 7.326 -18.063 26 HD11 ILE 3 3HD1 ILE 3 -4.655 10.347 -16.571 27 HD12 ILE 3 1HD1 ILE 3 -6.175 11.165 -16.929 28 HD13 ILE 3 2HD1 ILE 3 -5.688 9.753 -17.872 29 H LYS 4 H LYS 4 -9.554 9.757 -14.754 30 HA LYS 4 HA LYS 4 -9.935 12.577 -14.344 31 HB2 LYS 4 1HB LYS 4 -10.041 10.220 -12.442 32 HB3 LYS 4 2HB LYS 4 -10.534 11.860 -12.026 33 HG2 LYS 4 1HG LYS 4 -12.203 11.832 -13.834 34 HG3 LYS 4 2HG LYS 4 -11.717 10.191 -14.261 35 HD2 LYS 4 1HD LYS 4 -12.355 9.414 -12.008 36 HD3 LYS 4 2HD LYS 4 -12.849 11.051 -11.588 37 HE2 LYS 4 1HE LYS 4 -14.028 9.475 -13.890 38 HE3 LYS 4 2HE LYS 4 -14.758 9.571 -12.289 39 HZ1 LYS 4 3HZ LYS 4 -14.377 12.141 -12.777 40 HZ2 LYS 4 1HZ LYS 4 -15.796 11.323 -13.222 41 HZ3 LYS 4 2HZ LYS 4 -14.575 11.594 -14.372 42 H LEU 5 H LEU 5 -9.092 12.855 -11.672 43 HA LEU 5 HA LEU 5 -6.355 13.667 -12.045 44 HB2 LEU 5 1HB LEU 5 -8.331 13.786 -9.775 45 HB3 LEU 5 2HB LEU 5 -6.646 14.204 -9.489 46 HG LEU 5 HG LEU 5 -6.757 15.926 -11.231 47 HD11 LEU 5 1HD1 LEU 5 -9.070 16.478 -12.163 48 HD12 LEU 5 2HD1 LEU 5 -9.594 14.903 -11.565 49 HD13 LEU 5 3HD1 LEU 5 -8.332 15.011 -12.794 50 HD21 LEU 5 3HD2 LEU 5 -8.320 17.453 -10.081 51 HD22 LEU 5 1HD2 LEU 5 -7.388 16.505 -8.920 52 HD23 LEU 5 2HD2 LEU 5 -9.062 16.074 -9.266 53 H ILE 6 H ILE 6 -4.504 12.849 -11.224 54 HA ILE 6 HA ILE 6 -4.603 10.174 -9.910 55 HB ILE 6 HB ILE 6 -2.490 11.314 -11.749 56 HG12 ILE 6 1HG1 ILE 6 -4.447 9.041 -12.244 57 HG13 ILE 6 2HG1 ILE 6 -4.705 10.685 -12.825 58 HG21 ILE 6 1HG2 ILE 6 -1.520 9.767 -10.118 59 HG22 ILE 6 2HG2 ILE 6 -1.617 8.951 -11.672 60 HG23 ILE 6 3HG2 ILE 6 -2.804 8.597 -10.420 61 HD11 ILE 6 3HD1 ILE 6 -2.341 8.919 -13.504 62 HD12 ILE 6 1HD1 ILE 6 -2.560 10.581 -14.052 63 HD13 ILE 6 2HD1 ILE 6 -3.678 9.322 -14.582 64 H ALA 7 H ALA 7 -3.711 10.009 -7.960 65 HA ALA 7 HA ALA 7 -2.472 12.291 -6.691 66 HB1 ALA 7 3HB ALA 7 -2.428 10.923 -4.709 67 HB2 ALA 7 1HB ALA 7 -2.691 9.459 -5.653 68 HB3 ALA 7 2HB ALA 7 -3.974 10.659 -5.513 69 H GLN 8 H GLN 8 -0.340 12.499 -6.002 70 HA GLN 8 HA GLN 8 1.634 10.466 -6.894 71 HB2 GLN 8 1HB GLN 8 1.726 13.427 -7.512 72 HB3 GLN 8 2HB GLN 8 3.077 12.319 -7.744 73 HG2 GLN 8 1HG GLN 8 1.701 10.964 -9.283 74 HG3 GLN 8 2HG GLN 8 0.355 12.080 -9.055 75 HE21 GLN 8 2HE2 GLN 8 0.411 14.104 -10.182 76 HE22 GLN 8 1HE2 GLN 8 1.637 14.497 -11.289 77 H VAL 9 H VAL 9 3.024 9.992 -5.344 78 HA VAL 9 HA VAL 9 3.804 12.021 -3.332 79 HB VAL 9 HB VAL 9 3.562 10.269 -1.540 80 HG11 VAL 9 1HG1 VAL 9 1.889 12.046 -1.846 81 HG12 VAL 9 2HG1 VAL 9 1.131 10.543 -1.317 82 HG13 VAL 9 3HG1 VAL 9 1.028 11.032 -3.006 83 HG21 VAL 9 3HG2 VAL 9 3.503 8.307 -3.044 84 HG22 VAL 9 1HG2 VAL 9 1.958 8.854 -3.694 85 HG23 VAL 9 2HG2 VAL 9 2.080 8.360 -2.005 86 H LYS 10 H LYS 10 5.902 11.881 -2.698 87 HA LYS 10 HA LYS 10 7.471 9.464 -3.187 88 HB2 LYS 10 1HB LYS 10 7.485 10.713 -5.368 89 HB3 LYS 10 2HB LYS 10 8.250 12.060 -4.531 90 HG2 LYS 10 1HG LYS 10 10.159 10.689 -3.935 91 HG3 LYS 10 2HG LYS 10 9.385 9.251 -4.600 92 HD2 LYS 10 1HD LYS 10 9.381 10.301 -6.840 93 HD3 LYS 10 2HD LYS 10 10.200 11.713 -6.170 94 HE2 LYS 10 1HE LYS 10 11.299 8.891 -6.037 95 HE3 LYS 10 2HE LYS 10 11.768 10.078 -7.253 96 HZ1 LYS 10 3HZ LYS 10 12.261 10.114 -4.348 97 HZ2 LYS 10 1HZ LYS 10 12.252 11.562 -5.231 98 HZ3 LYS 10 2HZ LYS 10 13.361 10.335 -5.621 99 H THR 11 H THR 11 9.093 9.254 -1.756 100 HA THR 11 HA THR 11 10.172 11.614 -0.358 101 HB THR 11 HB THR 11 8.337 10.994 1.099 102 HG1 THR 11 HG1 THR 11 10.515 9.735 2.314 103 HG21 THR 11 3HG2 THR 11 8.121 8.637 0.205 104 HG22 THR 11 1HG2 THR 11 8.035 8.758 1.961 105 HG23 THR 11 2HG2 THR 11 9.520 8.210 1.191 106 H VAL 12 H VAL 12 12.215 11.348 0.442 107 HA VAL 12 HA VAL 12 13.696 8.997 -0.534 108 HB VAL 12 HB VAL 12 14.546 11.282 -0.991 109 HG11 VAL 12 1HG1 VAL 12 13.711 12.216 1.244 110 HG12 VAL 12 2HG1 VAL 12 15.327 12.720 0.757 111 HG13 VAL 12 3HG1 VAL 12 15.131 11.471 1.981 112 HG21 VAL 12 3HG2 VAL 12 16.064 9.283 -0.771 113 HG22 VAL 12 1HG2 VAL 12 16.343 9.741 0.909 114 HG23 VAL 12 2HG2 VAL 12 16.851 10.816 -0.392 115 H ILE 13 H ILE 13 14.387 7.406 0.728 116 HA ILE 13 HA ILE 13 14.518 7.799 3.678 117 HB ILE 13 HB ILE 13 13.380 5.363 2.279 118 HG12 ILE 13 1HG1 ILE 13 11.972 7.452 3.982 119 HG13 ILE 13 2HG1 ILE 13 11.911 7.424 2.221 120 HG21 ILE 13 1HG2 ILE 13 12.783 4.713 4.630 121 HG22 ILE 13 2HG2 ILE 13 13.656 6.127 5.213 122 HG23 ILE 13 3HG2 ILE 13 14.524 4.826 4.402 123 HD11 ILE 13 3HD1 ILE 13 11.003 5.084 2.351 124 HD12 ILE 13 1HD1 ILE 13 9.937 6.305 3.045 125 HD13 ILE 13 2HD1 ILE 13 10.906 5.277 4.102 126 H ASN 14 H ASN 14 16.344 7.105 4.562 127 HA ASN 14 HA ASN 14 18.335 5.757 2.871 128 HB2 ASN 14 1HB ASN 14 19.004 7.686 4.275 129 HB3 ASN 14 2HB ASN 14 18.552 6.777 5.716 130 HD21 ASN 14 2HD2 ASN 14 20.830 6.817 6.458 131 HD22 ASN 14 1HD2 ASN 14 21.988 5.810 5.727 132 H ALA 15 H ALA 15 17.624 3.648 2.702 133 HA ALA 15 HA ALA 15 18.317 1.919 4.813 134 HB1 ALA 15 3HB ALA 15 16.330 2.383 5.983 135 HB2 ALA 15 1HB ALA 15 15.871 0.963 5.048 136 HB3 ALA 15 2HB ALA 15 15.394 2.569 4.502 137 HA PRO 16 HA PRO 16 18.524 -0.965 1.440 138 HB2 PRO 16 1HB PRO 16 17.369 -3.136 3.147 139 HB3 PRO 16 2HB PRO 16 18.954 -3.064 2.347 140 HG2 PRO 16 1HG PRO 16 18.726 -2.781 4.996 141 HG3 PRO 16 2HG PRO 16 19.907 -1.830 4.070 142 HD2 PRO 16 1HD PRO 16 17.222 -0.965 5.141 143 HD3 PRO 16 2HD PRO 16 18.760 -0.095 5.133 144 H ILE 17 H ILE 17 17.282 -1.793 -0.217 145 HA ILE 17 HA ILE 17 14.537 -1.090 -0.382 146 HB ILE 17 HB ILE 17 16.035 -1.110 -2.303 147 HG12 ILE 17 1HG1 ILE 17 13.806 -3.137 -2.672 148 HG13 ILE 17 2HG1 ILE 17 13.520 -1.405 -2.521 149 HG21 ILE 17 1HG2 ILE 17 15.899 -4.134 -2.148 150 HG22 ILE 17 2HG2 ILE 17 17.283 -3.188 -1.605 151 HG23 ILE 17 3HG2 ILE 17 16.811 -3.161 -3.301 152 HD11 ILE 17 3HD1 ILE 17 15.121 -2.805 -4.668 153 HD12 ILE 17 1HD1 ILE 17 15.075 -1.054 -4.467 154 HD13 ILE 17 2HD1 ILE 17 13.603 -1.934 -4.865 155 H GLU 18 H GLU 18 16.220 -4.049 0.429 156 HA GLU 18 HA GLU 18 14.138 -5.910 -0.005 157 HB2 GLU 18 1HB GLU 18 16.522 -6.502 0.377 158 HB3 GLU 18 2HB GLU 18 16.342 -6.015 2.060 159 HG2 GLU 18 1HG GLU 18 14.659 -7.746 2.429 160 HG3 GLU 18 2HG GLU 18 14.692 -8.183 0.721 161 H LYS 19 H LYS 19 15.102 -4.193 2.953 162 HA LYS 19 HA LYS 19 13.165 -5.386 4.628 163 HB2 LYS 19 1HB LYS 19 14.663 -2.773 4.855 164 HB3 LYS 19 2HB LYS 19 13.656 -3.439 6.144 165 HG2 LYS 19 1HG LYS 19 15.015 -5.500 6.158 166 HG3 LYS 19 2HG LYS 19 16.008 -4.863 4.850 167 HD2 LYS 19 1HD LYS 19 16.655 -2.959 6.318 168 HD3 LYS 19 2HD LYS 19 15.744 -3.692 7.631 169 HE2 LYS 19 1HE LYS 19 18.009 -5.087 6.170 170 HE3 LYS 19 2HE LYS 19 18.214 -4.210 7.681 171 HZ1 LYS 19 3HZ LYS 19 17.618 -6.054 8.721 172 HZ2 LYS 19 1HZ LYS 19 17.233 -6.830 7.265 173 HZ3 LYS 19 2HZ LYS 19 16.061 -5.894 8.062 174 H VAL 20 H VAL 20 13.035 -2.293 2.847 175 HA VAL 20 HA VAL 20 10.409 -1.629 3.769 176 HB VAL 20 HB VAL 20 11.769 0.153 2.892 177 HG11 VAL 20 1HG1 VAL 20 11.776 -1.277 0.228 178 HG12 VAL 20 2HG1 VAL 20 13.115 -1.290 1.374 179 HG13 VAL 20 3HG1 VAL 20 12.608 0.221 0.633 180 HG21 VAL 20 3HG2 VAL 20 9.272 0.200 2.421 181 HG22 VAL 20 1HG2 VAL 20 9.639 -0.361 0.789 182 HG23 VAL 20 2HG2 VAL 20 10.247 1.197 1.345 183 H TRP 21 H TRP 21 11.652 -3.199 0.846 184 HA TRP 21 HA TRP 21 9.251 -3.621 -0.513 185 HB2 TRP 21 1HB TRP 21 11.386 -4.036 -1.576 186 HB3 TRP 21 2HB TRP 21 11.806 -5.248 -0.375 187 HD1 TRP 21 HD1 TRP 21 10.479 -7.583 -0.473 188 HE1 TRP 21 HE1 TRP 21 9.356 -8.798 -2.450 189 HE3 TRP 21 HE3 TRP 21 10.113 -3.721 -3.787 190 HZ2 TRP 21 HZ2 TRP 21 8.413 -8.199 -5.087 191 HZ3 TRP 21 HZ3 TRP 21 9.103 -4.067 -6.019 192 HH2 TRP 21 HH2 TRP 21 8.251 -6.299 -6.672 193 H GLU 22 H GLU 22 10.859 -5.505 2.018 194 HA GLU 22 HA GLU 22 9.166 -7.736 2.088 195 HB2 GLU 22 1HB GLU 22 11.372 -7.424 3.306 196 HB3 GLU 22 2HB GLU 22 10.502 -6.449 4.482 197 HG2 GLU 22 1HG GLU 22 10.579 -8.671 5.377 198 HG3 GLU 22 2HG GLU 22 8.932 -8.432 4.802 199 H ALA 23 H ALA 23 8.990 -4.653 3.848 200 HA ALA 23 HA ALA 23 6.814 -5.171 5.491 201 HB1 ALA 23 3HB ALA 23 6.492 -2.744 5.561 202 HB2 ALA 23 1HB ALA 23 7.518 -2.555 4.140 203 HB3 ALA 23 2HB ALA 23 8.204 -3.150 5.651 204 H LEU 24 H LEU 24 6.865 -4.269 2.075 205 HA LEU 24 HA LEU 24 4.077 -3.712 1.892 206 HB2 LEU 24 1HB LEU 24 6.131 -3.146 0.273 207 HB3 LEU 24 2HB LEU 24 5.606 -4.622 -0.525 208 HG LEU 24 HG LEU 24 4.477 -2.749 -1.567 209 HD11 LEU 24 1HD1 LEU 24 3.199 -4.934 -1.034 210 HD12 LEU 24 2HD1 LEU 24 2.239 -3.525 -1.478 211 HD13 LEU 24 3HD1 LEU 24 2.373 -3.991 0.212 212 HD21 LEU 24 3HD2 LEU 24 4.604 -1.452 0.875 213 HD22 LEU 24 1HD2 LEU 24 2.896 -1.896 0.824 214 HD23 LEU 24 2HD2 LEU 24 3.598 -0.925 -0.469 215 H VAL 25 H VAL 25 5.994 -6.570 1.011 216 HA VAL 25 HA VAL 25 3.483 -8.140 0.722 217 HB VAL 25 HB VAL 25 5.061 -9.801 -0.442 218 HG11 VAL 25 1HG1 VAL 25 4.653 -7.045 -1.642 219 HG12 VAL 25 2HG1 VAL 25 3.508 -8.384 -1.703 220 HG13 VAL 25 3HG1 VAL 25 5.046 -8.498 -2.556 221 HG21 VAL 25 3HG2 VAL 25 7.162 -8.716 0.477 222 HG22 VAL 25 1HG2 VAL 25 6.850 -7.345 -0.584 223 HG23 VAL 25 2HG2 VAL 25 7.168 -8.938 -1.269 224 H ASN 26 H ASN 26 3.447 -8.123 3.111 225 HA ASN 26 HA ASN 26 4.526 -10.616 4.021 226 HB2 ASN 26 1HB ASN 26 6.420 -9.061 4.353 227 HB3 ASN 26 2HB ASN 26 5.421 -8.128 5.460 228 HD21 ASN 26 2HD2 ASN 26 4.194 -10.934 6.267 229 HD22 ASN 26 1HD2 ASN 26 5.348 -11.538 7.353 230 HA PRO 27 HA PRO 27 0.548 -9.766 6.059 231 HB2 PRO 27 1HB PRO 27 0.023 -12.302 6.966 232 HB3 PRO 27 2HB PRO 27 -0.226 -11.808 5.277 233 HG2 PRO 27 1HG PRO 27 2.063 -13.316 6.476 234 HG3 PRO 27 2HG PRO 27 1.232 -13.579 4.929 235 HD2 PRO 27 1HD PRO 27 3.639 -12.283 5.121 236 HD3 PRO 27 2HD PRO 27 2.464 -11.918 3.839 237 H GLU 28 H GLU 28 3.444 -10.978 7.476 238 HA GLU 28 HA GLU 28 2.494 -10.932 10.222 239 HB2 GLU 28 1HB GLU 28 5.315 -11.073 9.126 240 HB3 GLU 28 2HB GLU 28 4.840 -11.363 10.800 241 HG2 GLU 28 1HG GLU 28 3.798 -12.951 8.436 242 HG3 GLU 28 2HG GLU 28 5.116 -13.476 9.479 243 H ILE 29 H ILE 29 4.603 -8.884 8.223 244 HA ILE 29 HA ILE 29 4.963 -6.897 10.266 245 HB ILE 29 HB ILE 29 5.345 -6.623 7.270 246 HG12 ILE 29 1HG1 ILE 29 7.410 -7.282 9.403 247 HG13 ILE 29 2HG1 ILE 29 6.648 -8.505 8.389 248 HG21 ILE 29 1HG2 ILE 29 5.258 -4.462 8.391 249 HG22 ILE 29 2HG2 ILE 29 6.933 -4.816 7.977 250 HG23 ILE 29 3HG2 ILE 29 6.373 -5.029 9.635 251 HD11 ILE 29 3HD1 ILE 29 8.816 -7.822 7.445 252 HD12 ILE 29 1HD1 ILE 29 8.265 -6.147 7.385 253 HD13 ILE 29 2HD1 ILE 29 7.493 -7.367 6.373 254 H ILE 30 H ILE 30 2.855 -7.274 7.449 255 HA ILE 30 HA ILE 30 1.598 -4.770 7.563 256 HB ILE 30 HB ILE 30 0.629 -7.458 6.583 257 HG12 ILE 30 1HG1 ILE 30 2.556 -6.077 5.433 258 HG13 ILE 30 2HG1 ILE 30 1.289 -6.771 4.434 259 HG21 ILE 30 1HG2 ILE 30 -0.798 -4.786 6.542 260 HG22 ILE 30 2HG2 ILE 30 -1.428 -6.353 7.053 261 HG23 ILE 30 3HG2 ILE 30 -1.150 -6.030 5.341 262 HD11 ILE 30 3HD1 ILE 30 1.951 -4.295 4.014 263 HD12 ILE 30 1HD1 ILE 30 1.027 -3.948 5.474 264 HD13 ILE 30 2HD1 ILE 30 0.234 -4.700 4.093 265 H LYS 31 H LYS 31 0.873 -7.813 9.216 266 HA LYS 31 HA LYS 31 -1.488 -6.880 10.505 267 HB2 LYS 31 1HB LYS 31 -0.960 -9.270 10.154 268 HB3 LYS 31 2HB LYS 31 0.363 -9.137 11.310 269 HG2 LYS 31 1HG LYS 31 -1.223 -8.505 13.076 270 HG3 LYS 31 2HG LYS 31 -2.550 -8.563 11.917 271 HD2 LYS 31 1HD LYS 31 -2.107 -10.958 11.524 272 HD3 LYS 31 2HD LYS 31 -0.790 -10.902 12.696 273 HE2 LYS 31 1HE LYS 31 -2.368 -10.262 14.465 274 HE3 LYS 31 2HE LYS 31 -3.690 -10.269 13.302 275 HZ1 LYS 31 3HZ LYS 31 -3.555 -12.564 13.046 276 HZ2 LYS 31 1HZ LYS 31 -3.346 -12.341 14.714 277 HZ3 LYS 31 2HZ LYS 31 -2.001 -12.656 13.726 278 H GLU 32 H GLU 32 1.928 -6.746 11.242 279 HA GLU 32 HA GLU 32 1.775 -6.147 13.990 280 HB2 GLU 32 1HB GLU 32 3.871 -6.723 12.675 281 HB3 GLU 32 2HB GLU 32 3.857 -5.078 12.062 282 HG2 GLU 32 1HG GLU 32 3.839 -5.695 15.033 283 HG3 GLU 32 2HG GLU 32 5.328 -5.502 14.116 284 H TYR 33 H TYR 33 1.465 -4.137 11.119 285 HA TYR 33 HA TYR 33 1.528 -1.618 12.446 286 HB2 TYR 33 1HB TYR 33 0.626 -2.603 9.747 287 HB3 TYR 33 2HB TYR 33 0.224 -0.961 10.230 288 HD1 TYR 33 HD2 TYR 33 3.298 -3.110 10.692 289 HD2 TYR 33 HD1 TYR 33 1.679 0.570 9.168 290 HE1 TYR 33 HE2 TYR 33 5.563 -2.395 10.020 291 HE2 TYR 33 HE1 TYR 33 3.952 1.287 8.519 292 HH TYR 33 HH TYR 33 6.634 -0.860 8.519 293 H MET 34 H MET 34 -1.007 -3.943 11.710 294 HA MET 34 HA MET 34 -3.091 -2.143 12.773 295 HB2 MET 34 1HB MET 34 -3.273 -4.834 11.396 296 HB3 MET 34 2HB MET 34 -4.647 -3.856 11.909 297 HG2 MET 34 1HG MET 34 -2.511 -2.873 9.991 298 HG3 MET 34 2HG MET 34 -4.039 -3.578 9.469 299 HE1 MET 34 3HE MET 34 -6.270 -2.847 10.408 300 HE2 MET 34 1HE MET 34 -6.044 -1.998 8.874 301 HE3 MET 34 2HE MET 34 -6.726 -1.152 10.260 302 H PHE 35 H PHE 35 -4.666 -3.047 14.251 303 HA PHE 35 HA PHE 35 -3.474 -4.022 16.604 304 HB2 PHE 35 1HB PHE 35 -6.381 -3.904 15.778 305 HB3 PHE 35 2HB PHE 35 -5.825 -4.261 17.412 306 HD1 PHE 35 HD1 PHE 35 -4.625 -2.545 18.750 307 HD2 PHE 35 HD2 PHE 35 -6.235 -1.644 14.867 308 HE1 PHE 35 HE1 PHE 35 -4.382 -0.119 19.207 309 HE2 PHE 35 HE2 PHE 35 -5.992 0.779 15.331 310 HZ PHE 35 HZ PHE 35 -5.066 1.542 17.500 311 H GLY 36 H GLY 36 -5.367 -5.713 14.109 312 HA2 GLY 36 1HA GLY 36 -4.118 -8.209 14.662 313 HA3 GLY 36 2HA GLY 36 -5.713 -8.154 15.397 314 H THR 37 H THR 37 -4.658 -6.739 12.313 315 HA THR 37 HA THR 37 -6.951 -7.742 10.928 316 HB THR 37 HB THR 37 -4.392 -6.620 9.765 317 HG1 THR 37 HG1 THR 37 -6.076 -5.457 11.322 318 HG21 THR 37 3HG2 THR 37 -7.172 -7.055 8.643 319 HG22 THR 37 1HG2 THR 37 -5.651 -7.711 8.039 320 HG23 THR 37 2HG2 THR 37 -5.990 -5.987 7.890 321 H THR 38 H THR 38 -7.258 -9.631 9.941 322 HA THR 38 HA THR 38 -5.049 -11.576 9.829 323 HB THR 38 HB THR 38 -7.986 -11.951 9.227 324 HG1 THR 38 HG1 THR 38 -7.670 -11.406 11.378 325 HG21 THR 38 3HG2 THR 38 -6.676 -13.677 8.173 326 HG22 THR 38 1HG2 THR 38 -7.376 -14.367 9.635 327 HG23 THR 38 2HG2 THR 38 -5.682 -13.878 9.615 328 H VAL 39 H VAL 39 -3.830 -10.855 8.076 329 HA VAL 39 HA VAL 39 -5.143 -10.832 5.414 330 HB VAL 39 HB VAL 39 -3.988 -8.777 5.812 331 HG11 VAL 39 1HG1 VAL 39 -2.636 -9.446 7.710 332 HG12 VAL 39 2HG1 VAL 39 -1.591 -8.741 6.478 333 HG13 VAL 39 3HG1 VAL 39 -1.653 -10.488 6.688 334 HG21 VAL 39 3HG2 VAL 39 -3.584 -9.984 3.578 335 HG22 VAL 39 1HG2 VAL 39 -2.004 -10.437 4.218 336 HG23 VAL 39 2HG2 VAL 39 -2.413 -8.738 3.998 337 H VAL 40 H VAL 40 -4.633 -12.308 3.918 338 HA VAL 40 HA VAL 40 -2.380 -14.189 4.437 339 HB VAL 40 HB VAL 40 -4.550 -15.257 4.944 340 HG11 VAL 40 1HG1 VAL 40 -5.208 -14.809 2.018 341 HG12 VAL 40 2HG1 VAL 40 -5.898 -13.865 3.338 342 HG13 VAL 40 3HG1 VAL 40 -6.218 -15.595 3.227 343 HG21 VAL 40 3HG2 VAL 40 -4.186 -17.237 3.607 344 HG22 VAL 40 1HG2 VAL 40 -2.609 -16.518 3.930 345 HG23 VAL 40 2HG2 VAL 40 -3.370 -16.304 2.353 346 H SER 41 H SER 41 -1.094 -14.633 2.753 347 HA SER 41 HA SER 41 -1.926 -14.073 0.002 348 HB2 SER 41 1HB SER 41 0.041 -12.579 -0.401 349 HB3 SER 41 2HB SER 41 -1.162 -11.872 0.668 350 HG SER 41 HG SER 41 0.185 -12.057 2.309 351 H ASP 42 H ASP 42 -0.505 -14.893 -1.552 352 HA ASP 42 HA ASP 42 1.183 -17.138 -0.642 353 HB2 ASP 42 1HB ASP 42 0.069 -16.332 -3.341 354 HB3 ASP 42 2HB ASP 42 1.141 -17.707 -3.099 355 H TRP 43 H TRP 43 1.336 -13.968 -1.906 356 HA TRP 43 HA TRP 43 3.065 -12.523 -2.306 357 HB2 TRP 43 1HB TRP 43 5.082 -14.691 -1.717 358 HB3 TRP 43 2HB TRP 43 5.231 -12.955 -1.485 359 HD1 TRP 43 HD1 TRP 43 2.717 -12.267 0.161 360 HE1 TRP 43 HE1 TRP 43 2.415 -13.169 2.556 361 HE3 TRP 43 HE3 TRP 43 5.862 -16.281 -0.003 362 HZ2 TRP 43 HZ2 TRP 43 3.391 -15.305 4.197 363 HZ3 TRP 43 HZ3 TRP 43 6.161 -17.731 1.984 364 HH2 TRP 43 HH2 TRP 43 4.930 -17.249 4.082 365 H LYS 44 H LYS 44 1.924 -13.774 -4.488 366 HA LYS 44 HA LYS 44 4.131 -13.672 -6.402 367 HB2 LYS 44 1HB LYS 44 3.688 -15.831 -7.423 368 HB3 LYS 44 2HB LYS 44 4.076 -16.050 -5.721 369 HG2 LYS 44 1HG LYS 44 1.721 -16.311 -5.158 370 HG3 LYS 44 2HG LYS 44 1.250 -15.965 -6.824 371 HD2 LYS 44 1HD LYS 44 2.463 -17.925 -7.590 372 HD3 LYS 44 2HD LYS 44 2.944 -18.290 -5.933 373 HE2 LYS 44 1HE LYS 44 0.572 -18.538 -5.294 374 HE3 LYS 44 2HE LYS 44 0.086 -18.148 -6.946 375 HZ1 LYS 44 3HZ LYS 44 1.874 -20.410 -6.263 376 HZ2 LYS 44 1HZ LYS 44 1.140 -20.088 -7.757 377 HZ3 LYS 44 2HZ LYS 44 0.192 -20.565 -6.430 378 H GLU 45 H GLU 45 3.462 -13.374 -8.574 379 HA GLU 45 HA GLU 45 1.351 -11.651 -8.991 380 HB2 GLU 45 1HB GLU 45 1.593 -12.194 -11.428 381 HB3 GLU 45 2HB GLU 45 3.107 -11.802 -10.617 382 HG2 GLU 45 1HG GLU 45 3.607 -14.205 -10.375 383 HG3 GLU 45 2HG GLU 45 2.098 -14.605 -11.187 384 H GLY 46 H GLY 46 -0.752 -11.772 -9.307 385 HA2 GLY 46 1HA GLY 46 -2.813 -12.633 -9.995 386 HA3 GLY 46 2HA GLY 46 -2.072 -14.203 -10.246 387 H SER 47 H SER 47 -0.986 -13.399 -7.293 388 HA SER 47 HA SER 47 -2.687 -15.205 -5.936 389 HB2 SER 47 1HB SER 47 -0.800 -13.125 -4.830 390 HB3 SER 47 2HB SER 47 -1.554 -14.412 -3.890 391 HG SER 47 HG SER 47 0.655 -14.632 -5.062 392 H GLN 48 H GLN 48 -4.464 -14.937 -4.717 393 HA GLN 48 HA GLN 48 -5.796 -12.316 -4.756 394 HB2 GLN 48 1HB GLN 48 -7.068 -14.399 -5.298 395 HB3 GLN 48 2HB GLN 48 -6.780 -14.964 -3.652 396 HG2 GLN 48 1HG GLN 48 -7.983 -13.063 -2.730 397 HG3 GLN 48 2HG GLN 48 -8.155 -12.348 -4.331 398 HE21 GLN 48 2HE2 GLN 48 -10.466 -12.894 -2.789 399 HE22 GLN 48 1HE2 GLN 48 -11.320 -14.173 -3.512 400 H ILE 49 H ILE 49 -6.459 -11.247 -2.851 401 HA ILE 49 HA ILE 49 -5.308 -12.191 -0.286 402 HB ILE 49 HB ILE 49 -4.414 -9.953 0.197 403 HG12 ILE 49 1HG1 ILE 49 -5.059 -9.350 -2.711 404 HG13 ILE 49 2HG1 ILE 49 -5.940 -8.689 -1.334 405 HG21 ILE 49 1HG2 ILE 49 -3.017 -11.765 -0.871 406 HG22 ILE 49 2HG2 ILE 49 -2.447 -10.131 -1.204 407 HG23 ILE 49 3HG2 ILE 49 -3.342 -11.018 -2.434 408 HD11 ILE 49 3HD1 ILE 49 -3.765 -7.741 -0.487 409 HD12 ILE 49 1HD1 ILE 49 -4.312 -7.043 -2.012 410 HD13 ILE 49 2HD1 ILE 49 -3.022 -8.245 -2.006 411 H VAL 50 H VAL 50 -6.318 -11.507 1.549 412 HA VAL 50 HA VAL 50 -8.679 -9.764 1.305 413 HB VAL 50 HB VAL 50 -8.901 -12.478 2.638 414 HG11 VAL 50 1HG1 VAL 50 -10.974 -10.487 1.669 415 HG12 VAL 50 2HG1 VAL 50 -10.447 -10.640 3.344 416 HG13 VAL 50 3HG1 VAL 50 -11.297 -11.972 2.561 417 HG21 VAL 50 3HG2 VAL 50 -8.538 -12.901 0.274 418 HG22 VAL 50 1HG2 VAL 50 -9.676 -11.629 -0.173 419 HG23 VAL 50 2HG2 VAL 50 -10.259 -13.100 0.609 420 H TRP 51 H TRP 51 -9.157 -8.634 3.105 421 HA TRP 51 HA TRP 51 -7.411 -9.040 5.496 422 HB2 TRP 51 1HB TRP 51 -8.610 -6.421 4.567 423 HB3 TRP 51 2HB TRP 51 -7.429 -6.667 5.845 424 HD1 TRP 51 HD1 TRP 51 -5.631 -8.760 4.005 425 HE1 TRP 51 HE1 TRP 51 -4.112 -7.716 2.215 426 HE3 TRP 51 HE3 TRP 51 -7.845 -4.186 3.539 427 HZ2 TRP 51 HZ2 TRP 51 -3.854 -5.262 0.781 428 HZ3 TRP 51 HZ3 TRP 51 -6.931 -2.507 1.966 429 HH2 TRP 51 HH2 TRP 51 -4.942 -3.041 0.582 430 H LYS 52 H LYS 52 -8.362 -9.148 7.443 431 HA LYS 52 HA LYS 52 -11.323 -9.054 7.499 432 HB2 LYS 52 1HB LYS 52 -10.029 -11.126 8.288 433 HB3 LYS 52 2HB LYS 52 -9.527 -10.154 9.668 434 HG2 LYS 52 1HG LYS 52 -11.483 -11.156 10.519 435 HG3 LYS 52 2HG LYS 52 -12.127 -9.638 9.901 436 HD2 LYS 52 1HD LYS 52 -12.808 -10.773 7.808 437 HD3 LYS 52 2HD LYS 52 -12.121 -12.281 8.403 438 HE2 LYS 52 1HE LYS 52 -13.697 -12.251 10.291 439 HE3 LYS 52 2HE LYS 52 -14.385 -10.742 9.687 440 HZ1 LYS 52 3HZ LYS 52 -14.894 -13.403 8.844 441 HZ2 LYS 52 1HZ LYS 52 -14.350 -12.463 7.541 442 HZ3 LYS 52 2HZ LYS 52 -15.710 -11.971 8.429 443 H GLY 53 H GLY 53 -12.405 -7.599 8.662 444 HA2 GLY 53 1HA GLY 53 -11.180 -6.139 10.845 445 HA3 GLY 53 2HA GLY 53 -11.449 -5.168 9.402 446 H GLU 54 H GLU 54 -12.721 -4.332 11.553 447 HA GLU 54 HA GLU 54 -15.560 -5.136 11.161 448 HB2 GLU 54 1HB GLU 54 -14.683 -5.939 13.334 449 HB3 GLU 54 2HB GLU 54 -14.266 -4.279 13.756 450 HG2 GLU 54 1HG GLU 54 -16.615 -3.609 13.598 451 HG3 GLU 54 2HG GLU 54 -17.060 -5.225 13.060 452 H TRP 55 H TRP 55 -16.941 -3.555 10.752 453 HA TRP 55 HA TRP 55 -16.164 -0.730 11.231 454 HB2 TRP 55 1HB TRP 55 -15.575 -1.318 8.899 455 HB3 TRP 55 2HB TRP 55 -17.233 -1.830 8.616 456 HD1 TRP 55 HD1 TRP 55 -18.846 -0.028 7.783 457 HE1 TRP 55 HE1 TRP 55 -18.797 2.540 7.597 458 HE3 TRP 55 HE3 TRP 55 -14.477 0.965 10.256 459 HZ2 TRP 55 HZ2 TRP 55 -17.137 4.725 8.384 460 HZ3 TRP 55 HZ3 TRP 55 -13.690 3.303 10.516 461 HH2 TRP 55 HH2 TRP 55 -15.014 5.181 9.585 462 H LYS 56 H LYS 56 -17.679 0.069 12.482 463 HA LYS 56 HA LYS 56 -19.729 0.488 13.465 464 HB2 LYS 56 1HB LYS 56 -20.828 -0.002 10.691 465 HB3 LYS 56 2HB LYS 56 -21.512 1.024 11.949 466 HG2 LYS 56 1HG LYS 56 -18.838 1.501 10.588 467 HG3 LYS 56 2HG LYS 56 -20.332 2.345 10.194 468 HD2 LYS 56 1HD LYS 56 -20.432 3.108 12.608 469 HD3 LYS 56 2HD LYS 56 -18.819 2.431 12.821 470 HE2 LYS 56 1HE LYS 56 -17.936 3.880 11.075 471 HE3 LYS 56 2HE LYS 56 -19.542 4.560 10.804 472 HZ1 LYS 56 3HZ LYS 56 -19.252 4.832 13.457 473 HZ2 LYS 56 1HZ LYS 56 -18.912 6.050 12.327 474 HZ3 LYS 56 2HZ LYS 56 -17.658 5.074 12.925 475 H GLY 57 H GLY 57 -18.822 -2.164 13.666 476 HA2 GLY 57 1HA GLY 57 -19.674 -4.091 14.635 477 HA3 GLY 57 2HA GLY 57 -21.304 -3.470 14.377 478 H LYS 58 H LYS 58 -20.055 -3.032 11.479 479 HA LYS 58 HA LYS 58 -21.034 -5.623 10.460 480 HB2 LYS 58 1HB LYS 58 -21.964 -3.401 9.629 481 HB3 LYS 58 2HB LYS 58 -20.399 -3.128 8.870 482 HG2 LYS 58 1HG LYS 58 -21.562 -4.142 7.100 483 HG3 LYS 58 2HG LYS 58 -20.808 -5.554 7.831 484 HD2 LYS 58 1HD LYS 58 -22.909 -5.933 9.151 485 HD3 LYS 58 2HD LYS 58 -23.644 -4.584 8.293 486 HE2 LYS 58 1HE LYS 58 -22.513 -7.067 6.982 487 HE3 LYS 58 2HE LYS 58 -24.227 -6.767 7.277 488 HZ1 LYS 58 3HZ LYS 58 -22.806 -5.997 5.078 489 HZ2 LYS 58 1HZ LYS 58 -22.961 -4.568 5.978 490 HZ3 LYS 58 2HZ LYS 58 -24.346 -5.441 5.525 491 H ALA 59 H ALA 59 -19.572 -7.117 10.039 492 HA ALA 59 HA ALA 59 -16.778 -6.607 9.802 493 HB1 ALA 59 3HB ALA 59 -17.820 -8.738 10.641 494 HB2 ALA 59 1HB ALA 59 -16.569 -8.970 9.419 495 HB3 ALA 59 2HB ALA 59 -18.270 -9.100 8.975 496 H TYR 60 H TYR 60 -15.603 -6.099 8.067 497 HA TYR 60 HA TYR 60 -16.770 -6.500 5.350 498 HB2 TYR 60 1HB TYR 60 -16.006 -4.344 4.664 499 HB3 TYR 60 2HB TYR 60 -16.874 -4.106 6.179 500 HD1 TYR 60 HD2 TYR 60 -15.588 -3.857 8.341 501 HD2 TYR 60 HD1 TYR 60 -13.653 -3.875 4.501 502 HE1 TYR 60 HE2 TYR 60 -13.548 -2.871 9.355 503 HE2 TYR 60 HE1 TYR 60 -11.619 -2.896 5.519 504 HH TYR 60 HH TYR 60 -10.574 -2.814 7.832 505 H GLU 61 H GLU 61 -15.332 -6.884 3.683 506 HA GLU 61 HA GLU 61 -12.504 -7.386 4.417 507 HB2 GLU 61 1HB GLU 61 -12.697 -9.498 2.955 508 HB3 GLU 61 2HB GLU 61 -13.379 -9.581 4.574 509 HG2 GLU 61 1HG GLU 61 -15.066 -8.828 2.168 510 HG3 GLU 61 2HG GLU 61 -14.841 -10.501 2.662 511 H ASP 62 H ASP 62 -11.172 -6.500 3.056 512 HA ASP 62 HA ASP 62 -12.122 -5.346 0.538 513 HB2 ASP 62 1HB ASP 62 -9.477 -5.218 2.008 514 HB3 ASP 62 2HB ASP 62 -9.804 -4.390 0.485 515 H LYS 63 H LYS 63 -11.658 -6.160 -1.459 516 HA LYS 63 HA LYS 63 -9.926 -8.599 -1.586 517 HB2 LYS 63 1HB LYS 63 -12.438 -7.958 -3.132 518 HB3 LYS 63 2HB LYS 63 -11.401 -9.352 -3.420 519 HG2 LYS 63 1HG LYS 63 -11.764 -10.085 -1.080 520 HG3 LYS 63 2HG LYS 63 -12.847 -8.715 -0.836 521 HD2 LYS 63 1HD LYS 63 -14.315 -9.549 -2.642 522 HD3 LYS 63 2HD LYS 63 -13.235 -10.921 -2.882 523 HE2 LYS 63 1HE LYS 63 -13.656 -11.672 -0.571 524 HE3 LYS 63 2HE LYS 63 -14.734 -10.299 -0.319 525 HZ1 LYS 63 3HZ LYS 63 -15.401 -12.765 -1.353 526 HZ2 LYS 63 1HZ LYS 63 -15.427 -11.712 -2.682 527 HZ3 LYS 63 2HZ LYS 63 -16.377 -11.379 -1.312 528 H GLY 64 H GLY 64 -8.274 -8.572 -2.875 529 HA2 GLY 64 1HA GLY 64 -8.262 -6.988 -5.345 530 HA3 GLY 64 2HA GLY 64 -7.045 -6.580 -4.134 531 H THR 65 H THR 65 -6.010 -7.364 -6.439 532 HA THR 65 HA THR 65 -4.899 -10.035 -5.841 533 HB THR 65 HB THR 65 -6.002 -9.300 -8.564 534 HG1 THR 65 HG1 THR 65 -6.899 -11.066 -6.540 535 HG21 THR 65 3HG2 THR 65 -4.655 -11.783 -7.477 536 HG22 THR 65 1HG2 THR 65 -4.071 -10.744 -8.774 537 HG23 THR 65 2HG2 THR 65 -5.512 -11.734 -9.012 538 H ILE 66 H ILE 66 -2.872 -10.441 -6.735 539 HA ILE 66 HA ILE 66 -1.210 -8.111 -7.059 540 HB ILE 66 HB ILE 66 -0.487 -10.996 -7.583 541 HG12 ILE 66 1HG1 ILE 66 -1.437 -10.844 -5.360 542 HG13 ILE 66 2HG1 ILE 66 0.305 -10.999 -5.222 543 HG21 ILE 66 1HG2 ILE 66 1.786 -10.212 -6.979 544 HG22 ILE 66 2HG2 ILE 66 1.163 -8.572 -6.821 545 HG23 ILE 66 3HG2 ILE 66 1.163 -9.364 -8.395 546 HD11 ILE 66 3HD1 ILE 66 0.284 -8.376 -5.108 547 HD12 ILE 66 1HD1 ILE 66 -0.193 -9.299 -3.686 548 HD13 ILE 66 2HD1 ILE 66 -1.424 -8.586 -4.726 549 H LEU 67 H LEU 67 -1.164 -6.974 -8.871 550 HA LEU 67 HA LEU 67 -2.019 -7.966 -11.389 551 HB2 LEU 67 1HB LEU 67 -1.798 -5.490 -10.426 552 HB3 LEU 67 2HB LEU 67 -0.217 -5.564 -11.191 553 HG LEU 67 HG LEU 67 -1.793 -4.617 -12.767 554 HD11 LEU 67 1HD1 LEU 67 -0.028 -6.338 -13.522 555 HD12 LEU 67 2HD1 LEU 67 -1.339 -5.991 -14.650 556 HD13 LEU 67 3HD1 LEU 67 -1.377 -7.465 -13.691 557 HD21 LEU 67 3HD2 LEU 67 -3.941 -5.371 -13.156 558 HD22 LEU 67 1HD2 LEU 67 -3.764 -6.113 -11.568 559 HD23 LEU 67 2HD2 LEU 67 -3.498 -7.072 -13.024 560 H GLN 68 H GLN 68 1.211 -7.169 -10.140 561 HA GLN 68 HA GLN 68 2.417 -9.264 -11.793 562 HB2 GLN 68 1HB GLN 68 2.439 -7.217 -13.228 563 HB3 GLN 68 2HB GLN 68 3.338 -6.376 -11.965 564 HG2 GLN 68 1HG GLN 68 5.185 -7.936 -12.156 565 HG3 GLN 68 2HG GLN 68 4.274 -8.941 -13.279 566 HE21 GLN 68 2HE2 GLN 68 6.820 -7.816 -13.978 567 HE22 GLN 68 1HE2 GLN 68 6.569 -6.679 -15.216 568 H PHE 69 H PHE 69 4.393 -9.965 -10.995 569 HA PHE 69 HA PHE 69 5.243 -8.785 -8.389 570 HB2 PHE 69 1HB PHE 69 3.973 -10.901 -8.102 571 HB3 PHE 69 2HB PHE 69 5.176 -11.718 -9.102 572 HD1 PHE 69 HD1 PHE 69 4.612 -9.931 -5.906 573 HD2 PHE 69 HD2 PHE 69 7.402 -12.206 -8.253 574 HE1 PHE 69 HE1 PHE 69 6.091 -10.164 -3.929 575 HE2 PHE 69 HE2 PHE 69 8.874 -12.440 -6.272 576 HZ PHE 69 HZ PHE 69 8.218 -11.418 -4.112 577 H ASN 70 H ASN 70 7.133 -7.860 -8.728 578 HA ASN 70 HA ASN 70 9.249 -9.403 -10.154 579 HB2 ASN 70 1HB ASN 70 8.318 -7.338 -11.404 580 HB3 ASN 70 2HB ASN 70 9.101 -6.376 -10.151 581 HD21 ASN 70 2HD2 ASN 70 11.184 -8.769 -10.095 582 HD22 ASN 70 1HD2 ASN 70 12.227 -8.374 -11.377 583 H GLU 71 H GLU 71 10.039 -10.226 -8.256 584 HA GLU 71 HA GLU 71 10.454 -9.254 -5.792 585 HB2 GLU 71 1HB GLU 71 11.215 -11.474 -6.578 586 HB3 GLU 71 2HB GLU 71 12.583 -10.704 -7.378 587 HG2 GLU 71 1HG GLU 71 13.441 -9.899 -5.250 588 HG3 GLU 71 2HG GLU 71 12.014 -10.495 -4.409 589 H ARG 72 H ARG 72 11.441 -7.634 -4.821 590 HA ARG 72 HA ARG 72 12.518 -5.608 -4.582 591 HB2 ARG 72 1HB ARG 72 14.714 -7.371 -5.670 592 HB3 ARG 72 2HB ARG 72 14.976 -5.819 -4.883 593 HG2 ARG 72 1HG ARG 72 13.919 -6.635 -2.839 594 HG3 ARG 72 2HG ARG 72 13.568 -8.179 -3.606 595 HD2 ARG 72 1HD ARG 72 15.597 -8.392 -2.258 596 HD3 ARG 72 2HD ARG 72 16.012 -8.519 -3.972 597 HE ARG 72 HE ARG 72 16.180 -5.813 -3.131 598 HH11 ARG 72 1HH2 ARG 72 17.800 -8.880 -2.833 599 HH12 ARG 72 2HH2 ARG 72 19.367 -8.167 -2.600 600 HH21 ARG 72 1HH1 ARG 72 18.209 -4.900 -2.834 601 HH22 ARG 72 2HH1 ARG 72 19.598 -5.916 -2.602 602 H SER 73 H SER 73 11.049 -5.093 -6.710 603 HA SER 73 HA SER 73 12.715 -3.329 -8.265 604 HB2 SER 73 1HB SER 73 13.018 -5.636 -9.325 605 HB3 SER 73 2HB SER 73 11.346 -5.500 -9.843 606 HG SER 73 HG SER 73 12.742 -4.690 -11.429 607 H ILE 74 H ILE 74 9.677 -5.029 -9.045 608 HA ILE 74 HA ILE 74 8.188 -2.473 -8.747 609 HB ILE 74 HB ILE 74 8.087 -4.261 -11.192 610 HG12 ILE 74 1HG1 ILE 74 8.966 -1.367 -10.895 611 HG13 ILE 74 2HG1 ILE 74 10.076 -2.728 -11.013 612 HG21 ILE 74 1HG2 ILE 74 5.858 -3.404 -10.734 613 HG22 ILE 74 2HG2 ILE 74 6.528 -2.421 -12.026 614 HG23 ILE 74 3HG2 ILE 74 6.496 -1.798 -10.380 615 HD11 ILE 74 3HD1 ILE 74 9.861 -1.780 -13.207 616 HD12 ILE 74 1HD1 ILE 74 8.100 -1.819 -13.103 617 HD13 ILE 74 2HD1 ILE 74 9.010 -3.326 -13.202 618 H LEU 75 H LEU 75 6.327 -2.661 -7.767 619 HA LEU 75 HA LEU 75 4.936 -5.284 -7.716 620 HB2 LEU 75 1HB LEU 75 6.314 -4.782 -5.612 621 HB3 LEU 75 2HB LEU 75 5.173 -3.477 -5.309 622 HG LEU 75 HG LEU 75 3.353 -5.414 -5.705 623 HD11 LEU 75 1HD1 LEU 75 5.071 -7.130 -6.282 624 HD12 LEU 75 2HD1 LEU 75 4.112 -7.590 -4.878 625 HD13 LEU 75 3HD1 LEU 75 5.748 -6.963 -4.664 626 HD21 LEU 75 3HD2 LEU 75 3.367 -5.856 -3.262 627 HD22 LEU 75 1HD2 LEU 75 3.576 -4.145 -3.621 628 HD23 LEU 75 2HD2 LEU 75 4.968 -5.120 -3.149 629 H GLN 76 H GLN 76 2.919 -5.082 -8.405 630 HA GLN 76 HA GLN 76 1.379 -2.634 -7.765 631 HB2 GLN 76 1HB GLN 76 1.326 -3.877 -10.522 632 HB3 GLN 76 2HB GLN 76 0.619 -2.344 -10.008 633 HG2 GLN 76 1HG GLN 76 2.945 -1.524 -9.517 634 HG3 GLN 76 2HG GLN 76 3.556 -3.019 -10.210 635 HE21 GLN 76 2HE2 GLN 76 4.555 -1.167 -11.687 636 HE22 GLN 76 1HE2 GLN 76 3.649 -0.790 -13.075 637 H TYR 77 H TYR 77 -0.773 -2.960 -7.410 638 HA TYR 77 HA TYR 77 -1.972 -5.557 -8.034 639 HB2 TYR 77 1HB TYR 77 -2.598 -6.027 -5.705 640 HB3 TYR 77 2HB TYR 77 -0.852 -6.039 -5.923 641 HD1 TYR 77 HD2 TYR 77 -3.715 -4.158 -4.523 642 HD2 TYR 77 HD1 TYR 77 0.561 -4.306 -4.924 643 HE1 TYR 77 HE2 TYR 77 -3.483 -2.448 -2.745 644 HE2 TYR 77 HE1 TYR 77 0.777 -2.599 -3.141 645 HH TYR 77 HH TYR 77 -2.036 -0.980 -1.784 646 H SER 78 H SER 78 -4.207 -5.670 -7.718 647 HA SER 78 HA SER 78 -5.558 -3.082 -7.992 648 HB2 SER 78 1HB SER 78 -7.569 -4.552 -8.416 649 HB3 SER 78 2HB SER 78 -6.247 -4.775 -9.555 650 HG SER 78 HG SER 78 -5.896 -6.710 -8.767 651 H HIS 79 H HIS 79 -7.288 -2.437 -6.575 652 HA HIS 79 HA HIS 79 -7.612 -3.985 -4.097 653 HB2 HIS 79 1HB HIS 79 -5.689 -2.437 -3.714 654 HB3 HIS 79 2HB HIS 79 -6.769 -1.078 -4.048 655 HD1 HIS 79 HD1 HIS 79 -7.478 -0.070 -1.880 656 HD2 HIS 79 HD2 HIS 79 -7.338 -4.230 -1.682 657 HE1 HIS 79 HE1 HIS 79 -8.338 -0.708 0.417 658 HE2 HIS 79 HE2 HIS 79 -8.258 -3.243 0.548 659 H PHE 80 H PHE 80 -9.517 -3.816 -3.170 660 HA PHE 80 HA PHE 80 -11.396 -1.688 -4.017 661 HB2 PHE 80 1HB PHE 80 -11.889 -3.578 -5.457 662 HB3 PHE 80 2HB PHE 80 -11.922 -4.669 -4.076 663 HD1 PHE 80 HD1 PHE 80 -13.729 -4.495 -2.367 664 HD2 PHE 80 HD2 PHE 80 -13.773 -2.133 -5.954 665 HE1 PHE 80 HE1 PHE 80 -16.124 -3.971 -1.995 666 HE2 PHE 80 HE2 PHE 80 -16.167 -1.610 -5.581 667 HZ PHE 80 HZ PHE 80 -17.343 -2.528 -3.601 668 H SER 81 H SER 81 -12.367 -0.810 -2.339 669 HA SER 81 HA SER 81 -12.868 -2.411 0.088 670 HB2 SER 81 1HB SER 81 -10.765 -1.149 0.457 671 HB3 SER 81 2HB SER 81 -11.642 0.347 0.168 672 HG SER 81 HG SER 81 -12.889 -0.067 1.966 673 HA PRO 82 HA PRO 82 -16.743 -0.200 -0.641 674 HB2 PRO 82 1HB PRO 82 -18.199 -1.195 1.487 675 HB3 PRO 82 2HB PRO 82 -17.918 -2.101 -0.015 676 HG2 PRO 82 1HG PRO 82 -16.555 -2.361 2.628 677 HG3 PRO 82 2HG PRO 82 -16.990 -3.617 1.457 678 HD2 PRO 82 1HD PRO 82 -14.429 -2.606 1.740 679 HD3 PRO 82 2HD PRO 82 -15.033 -3.329 0.229 680 H LEU 83 H LEU 83 -14.839 -0.033 2.246 681 HA LEU 83 HA LEU 83 -16.359 2.052 3.538 682 HB2 LEU 83 1HB LEU 83 -13.459 1.350 4.035 683 HB3 LEU 83 2HB LEU 83 -14.596 2.101 5.153 684 HG LEU 83 HG LEU 83 -14.743 -0.733 4.077 685 HD11 LEU 83 1HD1 LEU 83 -13.015 -0.515 5.749 686 HD12 LEU 83 2HD1 LEU 83 -14.405 -1.286 6.510 687 HD13 LEU 83 3HD1 LEU 83 -14.080 0.418 6.801 688 HD21 LEU 83 3HD2 LEU 83 -16.605 -0.893 5.868 689 HD22 LEU 83 1HD2 LEU 83 -17.011 -0.045 4.377 690 HD23 LEU 83 2HD2 LEU 83 -16.628 0.872 5.834 691 H THR 84 H THR 84 -14.522 2.030 0.796 692 HA THR 84 HA THR 84 -12.953 4.368 1.026 693 HB THR 84 HB THR 84 -14.219 3.273 -1.493 694 HG1 THR 84 HG1 THR 84 -12.755 1.758 -1.465 695 HG21 THR 84 3HG2 THR 84 -11.750 4.943 -0.959 696 HG22 THR 84 1HG2 THR 84 -13.205 5.453 -1.813 697 HG23 THR 84 2HG2 THR 84 -12.150 4.234 -2.523 698 H GLY 85 H GLY 85 -16.346 3.895 0.599 699 HA2 GLY 85 1HA GLY 85 -17.699 5.912 1.219 700 HA3 GLY 85 2HA GLY 85 -16.758 6.794 0.022 701 H LYS 86 H LYS 86 -16.798 4.206 -1.649 702 HA LYS 86 HA LYS 86 -19.084 4.939 -3.207 703 HB2 LYS 86 1HB LYS 86 -18.348 3.093 -4.687 704 HB3 LYS 86 2HB LYS 86 -17.050 4.217 -4.304 705 HG2 LYS 86 1HG LYS 86 -16.305 2.659 -2.490 706 HG3 LYS 86 2HG LYS 86 -17.532 1.511 -3.024 707 HD2 LYS 86 1HD LYS 86 -16.508 1.321 -5.201 708 HD3 LYS 86 2HD LYS 86 -15.365 2.612 -4.833 709 HE2 LYS 86 1HE LYS 86 -14.338 1.255 -3.087 710 HE3 LYS 86 2HE LYS 86 -15.527 -0.021 -3.346 711 HZ1 LYS 86 3HZ LYS 86 -13.420 -0.448 -4.497 712 HZ2 LYS 86 1HZ LYS 86 -13.629 0.973 -5.401 713 HZ3 LYS 86 2HZ LYS 86 -14.724 -0.315 -5.579 714 HA PRO 87 HA PRO 87 -21.955 2.033 -1.416 715 HB2 PRO 87 1HB PRO 87 -23.718 1.663 -3.494 716 HB3 PRO 87 2HB PRO 87 -23.650 3.166 -2.544 717 HG2 PRO 87 1HG PRO 87 -22.439 2.582 -5.226 718 HG3 PRO 87 2HG PRO 87 -23.302 4.034 -4.678 719 HD2 PRO 87 1HD PRO 87 -20.568 3.927 -4.788 720 HD3 PRO 87 2HD PRO 87 -21.425 4.889 -3.566 721 H ASP 88 H ASP 88 -22.262 0.878 -4.690 722 HA ASP 88 HA ASP 88 -20.622 -1.516 -4.158 723 HB2 ASP 88 1HB ASP 88 -22.926 -2.033 -3.372 724 HB3 ASP 88 2HB ASP 88 -23.530 -1.660 -4.984 725 H LEU 89 H LEU 89 -19.341 -0.414 -5.802 726 HA LEU 89 HA LEU 89 -20.122 -1.325 -8.443 727 HB2 LEU 89 1HB LEU 89 -21.005 1.052 -8.181 728 HB3 LEU 89 2HB LEU 89 -19.319 1.566 -8.150 729 HG LEU 89 HG LEU 89 -19.067 0.242 -10.385 730 HD11 LEU 89 1HD1 LEU 89 -22.098 0.477 -10.227 731 HD12 LEU 89 2HD1 LEU 89 -21.168 -1.005 -10.421 732 HD13 LEU 89 3HD1 LEU 89 -21.220 0.171 -11.726 733 HD21 LEU 89 3HD2 LEU 89 -20.773 2.752 -10.240 734 HD22 LEU 89 1HD2 LEU 89 -19.969 2.175 -11.698 735 HD23 LEU 89 2HD2 LEU 89 -19.013 2.687 -10.307 736 HA PRO 90 HA PRO 90 -15.636 -1.959 -7.977 737 HB2 PRO 90 1HB PRO 90 -15.248 -3.653 -10.101 738 HB3 PRO 90 2HB PRO 90 -15.967 -4.184 -8.566 739 HG2 PRO 90 1HG PRO 90 -17.312 -3.532 -11.152 740 HG3 PRO 90 2HG PRO 90 -17.699 -4.797 -9.969 741 HD2 PRO 90 1HD PRO 90 -19.070 -2.384 -10.169 742 HD3 PRO 90 2HD PRO 90 -19.013 -3.370 -8.688 743 H GLU 91 H GLU 91 -17.274 -0.309 -10.396 744 HA GLU 91 HA GLU 91 -14.993 0.229 -12.129 745 HB2 GLU 91 1HB GLU 91 -17.377 0.165 -12.921 746 HB3 GLU 91 2HB GLU 91 -17.666 1.638 -12.002 747 HG2 GLU 91 1HG GLU 91 -16.038 2.855 -13.317 748 HG3 GLU 91 2HG GLU 91 -15.546 1.384 -14.151 749 H ASN 92 H ASN 92 -16.124 1.385 -9.153 750 HA ASN 92 HA ASN 92 -15.033 4.098 -9.441 751 HB2 ASN 92 1HB ASN 92 -16.417 2.705 -7.151 752 HB3 ASN 92 2HB ASN 92 -15.886 4.381 -7.124 753 HD21 ASN 92 2HD2 ASN 92 -16.620 4.662 -10.086 754 HD22 ASN 92 1HD2 ASN 92 -18.312 4.799 -10.081 755 H TYR 93 H TYR 93 -13.525 1.305 -9.077 756 HA TYR 93 HA TYR 93 -11.772 2.120 -6.832 757 HB2 TYR 93 1HB TYR 93 -11.215 -0.116 -6.540 758 HB3 TYR 93 2HB TYR 93 -12.876 -0.235 -7.089 759 HD1 TYR 93 HD2 TYR 93 -12.315 0.381 -10.091 760 HD2 TYR 93 HD1 TYR 93 -10.450 -2.265 -7.265 761 HE1 TYR 93 HE2 TYR 93 -11.577 -1.078 -11.939 762 HE2 TYR 93 HE1 TYR 93 -9.710 -3.719 -9.112 763 HH TYR 93 HH TYR 93 -9.701 -4.051 -11.296 764 H HIS 94 H HIS 94 -9.413 1.349 -7.182 765 HA HIS 94 HA HIS 94 -8.421 1.953 -9.899 766 HB2 HIS 94 1HB HIS 94 -6.642 3.467 -8.673 767 HB3 HIS 94 2HB HIS 94 -8.215 4.137 -9.075 768 HD1 HIS 94 HD1 HIS 94 -8.856 5.598 -7.184 769 HD2 HIS 94 HD2 HIS 94 -7.244 1.999 -5.831 770 HE1 HIS 94 HE1 HIS 94 -9.043 5.638 -4.664 771 HE2 HIS 94 HE2 HIS 94 -8.058 3.454 -3.817 772 H VAL 95 H VAL 95 -6.181 1.488 -10.187 773 HA VAL 95 HA VAL 95 -5.263 -0.780 -8.493 774 HB VAL 95 HB VAL 95 -4.499 -0.061 -11.336 775 HG11 VAL 95 1HG1 VAL 95 -3.841 -2.422 -9.538 776 HG12 VAL 95 2HG1 VAL 95 -2.700 -1.253 -10.202 777 HG13 VAL 95 3HG1 VAL 95 -3.519 -2.387 -11.272 778 HG21 VAL 95 3HG2 VAL 95 -5.832 -2.084 -11.909 779 HG22 VAL 95 1HG2 VAL 95 -6.831 -0.828 -11.178 780 HG23 VAL 95 2HG2 VAL 95 -6.323 -2.218 -10.220 781 H VAL 96 H VAL 96 -3.802 -0.210 -7.074 782 HA VAL 96 HA VAL 96 -2.130 2.148 -7.403 783 HB VAL 96 HB VAL 96 -1.228 1.359 -5.127 784 HG11 VAL 96 1HG1 VAL 96 -2.933 3.104 -5.310 785 HG12 VAL 96 2HG1 VAL 96 -3.319 2.041 -3.957 786 HG13 VAL 96 3HG1 VAL 96 -4.196 1.886 -5.479 787 HG21 VAL 96 3HG2 VAL 96 -1.924 -1.025 -5.481 788 HG22 VAL 96 1HG2 VAL 96 -3.605 -0.514 -5.321 789 HG23 VAL 96 2HG2 VAL 96 -2.495 -0.324 -3.969 790 H THR 97 H THR 97 0.004 2.232 -7.783 791 HA THR 97 HA THR 97 1.480 -0.308 -8.178 792 HB THR 97 HB THR 97 0.968 0.361 -10.409 793 HG1 THR 97 HG1 THR 97 3.153 1.289 -10.995 794 HG21 THR 97 3HG2 THR 97 0.216 2.657 -9.892 795 HG22 THR 97 1HG2 THR 97 1.366 2.644 -11.227 796 HG23 THR 97 2HG2 THR 97 1.889 3.136 -9.619 797 H ILE 98 H ILE 98 3.363 -0.419 -7.223 798 HA ILE 98 HA ILE 98 4.590 2.071 -6.128 799 HB ILE 98 HB ILE 98 4.815 -0.746 -5.038 800 HG12 ILE 98 1HG1 ILE 98 3.404 0.639 -3.116 801 HG13 ILE 98 2HG1 ILE 98 2.773 1.416 -4.566 802 HG21 ILE 98 1HG2 ILE 98 5.692 0.516 -3.032 803 HG22 ILE 98 2HG2 ILE 98 5.718 1.966 -4.031 804 HG23 ILE 98 3HG2 ILE 98 6.731 0.585 -4.455 805 HD11 ILE 98 3HD1 ILE 98 2.751 -1.539 -3.922 806 HD12 ILE 98 1HD1 ILE 98 2.264 -0.873 -5.479 807 HD13 ILE 98 2HD1 ILE 98 1.355 -0.461 -4.024 808 H THR 99 H THR 99 6.567 2.550 -6.760 809 HA THR 99 HA THR 99 8.191 0.478 -8.169 810 HB THR 99 HB THR 99 8.226 3.467 -8.620 811 HG1 THR 99 HG1 THR 99 6.362 2.006 -9.337 812 HG21 THR 99 3HG2 THR 99 9.603 1.130 -9.967 813 HG22 THR 99 1HG2 THR 99 10.370 2.461 -9.103 814 HG23 THR 99 2HG2 THR 99 9.558 2.758 -10.637 815 H LEU 100 H LEU 100 9.880 -0.130 -7.029 816 HA LEU 100 HA LEU 100 11.165 1.807 -5.166 817 HB2 LEU 100 1HB LEU 100 10.800 -1.185 -5.047 818 HB3 LEU 100 2HB LEU 100 12.003 -0.364 -4.058 819 HG LEU 100 HG LEU 100 9.154 0.650 -4.024 820 HD11 LEU 100 1HD1 LEU 100 10.189 -1.734 -2.474 821 HD12 LEU 100 2HD1 LEU 100 8.842 -1.710 -3.611 822 HD13 LEU 100 3HD1 LEU 100 8.711 -0.860 -2.073 823 HD21 LEU 100 3HD2 LEU 100 9.754 1.420 -1.811 824 HD22 LEU 100 1HD2 LEU 100 11.086 1.841 -2.883 825 HD23 LEU 100 2HD2 LEU 100 11.232 0.454 -1.813 826 H THR 101 H THR 101 13.179 2.348 -5.482 827 HA THR 101 HA THR 101 14.920 0.649 -7.194 828 HB THR 101 HB THR 101 15.694 2.545 -8.432 829 HG1 THR 101 HG1 THR 101 13.965 4.394 -7.473 830 HG21 THR 101 3HG2 THR 101 13.672 3.236 -9.590 831 HG22 THR 101 1HG2 THR 101 12.684 2.768 -8.208 832 HG23 THR 101 2HG2 THR 101 13.526 1.535 -9.146 833 H ALA 102 H ALA 102 16.818 0.266 -6.292 834 HA ALA 102 HA ALA 102 17.578 1.661 -3.825 835 HB1 ALA 102 3HB ALA 102 18.886 -0.661 -5.262 836 HB2 ALA 102 1HB ALA 102 17.722 -0.802 -3.945 837 HB3 ALA 102 2HB ALA 102 19.299 -0.068 -3.654 838 H LEU 103 H LEU 103 18.644 3.517 -4.043 839 HA LEU 103 HA LEU 103 20.476 3.953 -6.322 840 HB2 LEU 103 1HB LEU 103 19.645 5.938 -4.197 841 HB3 LEU 103 2HB LEU 103 20.335 6.276 -5.786 842 HG LEU 103 HG LEU 103 17.610 5.061 -5.230 843 HD11 LEU 103 1HD1 LEU 103 17.645 7.443 -4.805 844 HD12 LEU 103 2HD1 LEU 103 16.818 7.164 -6.339 845 HD13 LEU 103 3HD1 LEU 103 18.482 7.746 -6.329 846 HD21 LEU 103 3HD2 LEU 103 19.152 5.486 -7.809 847 HD22 LEU 103 1HD2 LEU 103 17.387 5.432 -7.802 848 HD23 LEU 103 2HD2 LEU 103 18.312 4.036 -7.258 849 H LYS 104 H LYS 104 22.418 5.373 -5.652 850 HA LYS 104 HA LYS 104 24.171 3.772 -4.137 851 HB2 LYS 104 1HB LYS 104 24.830 5.232 -6.010 852 HB3 LYS 104 2HB LYS 104 24.539 6.641 -4.997 853 HG2 LYS 104 1HG LYS 104 26.238 5.854 -3.388 854 HG3 LYS 104 2HG LYS 104 26.523 4.425 -4.375 855 HD2 LYS 104 1HD LYS 104 26.881 7.248 -5.419 856 HD3 LYS 104 2HD LYS 104 28.191 6.331 -4.687 857 HE2 LYS 104 1HE LYS 104 27.680 4.504 -6.435 858 HE3 LYS 104 2HE LYS 104 26.702 5.718 -7.254 859 HZ1 LYS 104 3HZ LYS 104 29.317 5.388 -7.638 860 HZ2 LYS 104 1HZ LYS 104 29.321 6.613 -6.464 861 HZ3 LYS 104 2HZ LYS 104 28.480 6.839 -7.922 862 H LYS 105 H LYS 105 22.512 6.782 -3.317 863 HA LYS 105 HA LYS 105 23.784 7.016 -0.729 864 HB2 LYS 105 1HB LYS 105 23.024 9.005 -2.016 865 HB3 LYS 105 2HB LYS 105 21.360 8.474 -1.797 866 HG2 LYS 105 1HG LYS 105 21.521 8.702 0.604 867 HG3 LYS 105 2HG LYS 105 23.254 8.979 0.516 868 HD2 LYS 105 1HD LYS 105 22.172 11.121 0.840 869 HD3 LYS 105 2HD LYS 105 22.811 11.069 -0.798 870 HE2 LYS 105 1HE LYS 105 20.429 11.990 -0.535 871 HE3 LYS 105 2HE LYS 105 20.638 10.724 -1.743 872 HZ1 LYS 105 3HZ LYS 105 19.538 9.211 -0.482 873 HZ2 LYS 105 1HZ LYS 105 18.753 10.612 0.061 874 HZ3 LYS 105 2HZ LYS 105 19.995 9.919 0.992 875 H GLY 106 H GLY 106 20.621 5.968 -1.949 876 HA2 GLY 106 1HA GLY 106 20.195 4.230 0.265 877 HA3 GLY 106 2HA GLY 106 19.228 5.693 0.420 878 H VAL 107 H VAL 107 17.238 4.805 0.092 879 HA VAL 107 HA VAL 107 16.678 3.726 -2.629 880 HB VAL 107 HB VAL 107 16.674 1.919 -0.935 881 HG11 VAL 107 1HG1 VAL 107 15.955 3.422 0.974 882 HG12 VAL 107 2HG1 VAL 107 15.088 1.890 0.871 883 HG13 VAL 107 3HG1 VAL 107 14.322 3.369 0.311 884 HG21 VAL 107 3HG2 VAL 107 14.507 1.001 -1.533 885 HG22 VAL 107 1HG2 VAL 107 15.142 1.885 -2.913 886 HG23 VAL 107 2HG2 VAL 107 13.884 2.604 -1.910 887 H GLU 108 H GLU 108 15.082 4.668 -3.683 888 HA GLU 108 HA GLU 108 13.472 6.738 -2.313 889 HB2 GLU 108 1HB GLU 108 12.886 7.419 -4.663 890 HB3 GLU 108 2HB GLU 108 14.602 7.553 -4.282 891 HG2 GLU 108 1HG GLU 108 15.098 5.493 -5.425 892 HG3 GLU 108 2HG GLU 108 13.390 5.133 -5.645 893 H VAL 109 H VAL 109 11.274 6.719 -2.338 894 HA VAL 109 HA VAL 109 9.933 4.260 -3.374 895 HB VAL 109 HB VAL 109 8.622 4.091 -1.421 896 HG11 VAL 109 1HG1 VAL 109 10.250 3.863 0.374 897 HG12 VAL 109 2HG1 VAL 109 11.366 4.944 -0.459 898 HG13 VAL 109 3HG1 VAL 109 10.991 3.368 -1.140 899 HG21 VAL 109 3HG2 VAL 109 7.984 6.392 -1.009 900 HG22 VAL 109 1HG2 VAL 109 9.657 6.859 -0.741 901 HG23 VAL 109 2HG2 VAL 109 8.825 5.853 0.442 902 H GLU 110 H GLU 110 8.152 4.546 -4.543 903 HA GLU 110 HA GLU 110 6.781 7.170 -4.522 904 HB2 GLU 110 1HB GLU 110 8.489 7.196 -6.343 905 HB3 GLU 110 2HB GLU 110 7.691 5.797 -7.057 906 HG2 GLU 110 1HG GLU 110 5.620 7.063 -7.330 907 HG3 GLU 110 2HG GLU 110 6.330 8.449 -6.505 908 H LEU 111 H LEU 111 4.675 6.963 -4.502 909 HA LEU 111 HA LEU 111 3.415 4.436 -5.444 910 HB2 LEU 111 1HB LEU 111 3.490 4.625 -2.967 911 HB3 LEU 111 2HB LEU 111 2.592 6.131 -3.079 912 HG LEU 111 HG LEU 111 1.321 3.840 -4.539 913 HD11 LEU 111 1HD1 LEU 111 1.483 3.846 -1.516 914 HD12 LEU 111 2HD1 LEU 111 2.126 2.614 -2.597 915 HD13 LEU 111 3HD1 LEU 111 0.384 2.846 -2.467 916 HD21 LEU 111 3HD2 LEU 111 -0.724 4.771 -3.609 917 HD22 LEU 111 1HD2 LEU 111 0.262 6.113 -4.186 918 HD23 LEU 111 2HD2 LEU 111 0.187 5.754 -2.463 919 H THR 112 H THR 112 1.585 4.635 -6.639 920 HA THR 112 HA THR 112 0.489 7.363 -7.096 921 HB THR 112 HB THR 112 1.033 5.341 -9.278 922 HG1 THR 112 HG1 THR 112 2.331 7.807 -8.995 923 HG21 THR 112 3HG2 THR 112 -0.846 6.787 -9.797 924 HG22 THR 112 1HG2 THR 112 0.549 7.332 -10.731 925 HG23 THR 112 2HG2 THR 112 0.063 8.208 -9.283 926 H GLN 113 H GLN 113 -1.640 7.518 -7.484 927 HA GLN 113 HA GLN 113 -3.298 5.080 -7.695 928 HB2 GLN 113 1HB GLN 113 -3.107 5.604 -5.271 929 HB3 GLN 113 2HB GLN 113 -3.747 7.216 -5.593 930 HG2 GLN 113 1HG GLN 113 -5.837 6.256 -6.441 931 HG3 GLN 113 2HG GLN 113 -5.192 4.628 -6.241 932 HE21 GLN 113 2HE2 GLN 113 -7.149 6.886 -4.739 933 HE22 GLN 113 1HE2 GLN 113 -7.000 6.340 -3.136 934 H ASP 114 H ASP 114 -5.105 5.363 -8.881 935 HA ASP 114 HA ASP 114 -5.618 8.083 -9.988 936 HB2 ASP 114 1HB ASP 114 -6.127 5.406 -11.255 937 HB3 ASP 114 2HB ASP 114 -6.341 6.980 -12.011 938 H ASN 115 H ASN 115 -7.931 7.512 -11.304 939 HA ASN 115 HA ASN 115 -10.171 7.632 -11.109 940 HB2 ASN 115 1HB ASN 115 -9.816 5.198 -10.533 941 HB3 ASN 115 2HB ASN 115 -9.949 5.664 -8.838 942 HD21 ASN 115 2HD2 ASN 115 -11.945 4.186 -8.961 943 HD22 ASN 115 1HD2 ASN 115 -13.401 4.889 -9.487 944 H ASN 116 H ASN 116 -8.738 9.616 -9.562 945 HA ASN 116 HA ASN 116 -10.225 9.911 -7.058 946 HB2 ASN 116 1HB ASN 116 -8.312 11.754 -8.521 947 HB3 ASN 116 2HB ASN 116 -9.073 12.146 -6.980 948 HD21 ASN 116 2HD2 ASN 116 -6.147 11.355 -7.912 949 HD22 ASN 116 1HD2 ASN 116 -5.689 10.225 -6.730 950 H GLU 117 H GLU 117 -12.263 10.748 -7.026 951 HA GLU 117 HA GLU 117 -13.546 11.630 -9.388 952 HB2 GLU 117 1HB GLU 117 -14.388 11.791 -6.488 953 HB3 GLU 117 2HB GLU 117 -15.433 12.236 -7.835 954 HG2 GLU 117 1HG GLU 117 -15.178 9.970 -8.790 955 HG3 GLU 117 2HG GLU 117 -14.130 9.522 -7.451 956 H THR 118 H THR 118 -12.182 13.444 -6.658 957 HA THR 118 HA THR 118 -12.153 15.860 -8.357 958 HB THR 118 HB THR 118 -13.150 17.263 -6.663 959 HG1 THR 118 HG1 THR 118 -13.673 16.521 -4.705 960 HG21 THR 118 3HG2 THR 118 -14.637 15.983 -8.265 961 HG22 THR 118 1HG2 THR 118 -15.425 16.498 -6.775 962 HG23 THR 118 2HG2 THR 118 -14.913 14.822 -6.966 963 H GLU 119 H GLU 119 -10.959 17.667 -7.197 964 HA GLU 119 HA GLU 119 -8.347 16.847 -6.586 965 HB2 GLU 119 1HB GLU 119 -9.797 19.428 -5.940 966 HB3 GLU 119 2HB GLU 119 -8.061 19.198 -5.725 967 HG2 GLU 119 1HG GLU 119 -7.796 18.722 -8.106 968 HG3 GLU 119 2HG GLU 119 -9.536 18.846 -8.351 969 H LYS 120 H LYS 120 -11.099 17.593 -4.526 970 HA LYS 120 HA LYS 120 -9.821 17.531 -2.031 971 HB2 LYS 120 1HB LYS 120 -12.641 16.763 -2.831 972 HB3 LYS 120 2HB LYS 120 -12.103 16.883 -1.156 973 HG2 LYS 120 1HG LYS 120 -11.471 19.244 -1.534 974 HG3 LYS 120 2HG LYS 120 -12.033 19.125 -3.198 975 HD2 LYS 120 1HD LYS 120 -14.308 18.612 -2.414 976 HD3 LYS 120 2HD LYS 120 -13.754 18.689 -0.741 977 HE2 LYS 120 1HE LYS 120 -14.822 20.810 -1.383 978 HE3 LYS 120 2HE LYS 120 -13.106 21.057 -1.069 979 HZ1 LYS 120 3HZ LYS 120 -14.485 21.689 -3.373 980 HZ2 LYS 120 1HZ LYS 120 -13.533 20.344 -3.777 981 HZ3 LYS 120 2HZ LYS 120 -12.802 21.737 -3.140 982 H GLU 121 H GLU 121 -11.171 14.928 -4.024 983 HA GLU 121 HA GLU 121 -10.685 12.844 -2.141 984 HB2 GLU 121 1HB GLU 121 -12.309 12.725 -4.071 985 HB3 GLU 121 2HB GLU 121 -10.924 12.569 -5.146 986 HG2 GLU 121 1HG GLU 121 -11.708 10.340 -4.666 987 HG3 GLU 121 2HG GLU 121 -10.199 10.556 -3.784 988 H GLN 122 H GLN 122 -8.847 14.174 -4.860 989 HA GLN 122 HA GLN 122 -6.762 12.250 -4.831 990 HB2 GLN 122 1HB GLN 122 -7.165 13.857 -6.707 991 HB3 GLN 122 2HB GLN 122 -6.593 15.163 -5.674 992 HG2 GLN 122 1HG GLN 122 -4.406 13.967 -5.436 993 HG3 GLN 122 2HG GLN 122 -4.993 12.737 -6.554 994 HE21 GLN 122 2HE2 GLN 122 -4.445 13.109 -8.697 995 HE22 GLN 122 1HE2 GLN 122 -4.073 14.627 -9.359 996 H LYS 123 H LYS 123 -7.187 15.399 -3.283 997 HA LYS 123 HA LYS 123 -4.704 15.472 -1.969 998 HB2 LYS 123 1HB LYS 123 -6.198 17.443 -2.229 999 HB3 LYS 123 2HB LYS 123 -7.338 16.705 -1.113 1000 HG2 LYS 123 1HG LYS 123 -6.045 18.309 0.133 1001 HG3 LYS 123 2HG LYS 123 -5.511 16.712 0.643 1002 HD2 LYS 123 1HD LYS 123 -3.491 16.866 -0.641 1003 HD3 LYS 123 2HD LYS 123 -4.079 18.264 -1.538 1004 HE2 LYS 123 1HE LYS 123 -4.022 19.601 0.524 1005 HE3 LYS 123 2HE LYS 123 -3.458 18.190 1.424 1006 HZ1 LYS 123 3HZ LYS 123 -1.762 19.885 0.454 1007 HZ2 LYS 123 1HZ LYS 123 -2.009 19.022 -0.987 1008 HZ3 LYS 123 2HZ LYS 123 -1.433 18.219 0.395 1009 H HIS 124 H HIS 124 -7.885 14.306 -0.997 1010 HA HIS 124 HA HIS 124 -7.315 13.528 1.628 1011 HB2 HIS 124 1HB HIS 124 -9.580 13.667 0.603 1012 HB3 HIS 124 2HB HIS 124 -9.211 12.229 -0.342 1013 HD1 HIS 124 HD1 HIS 124 -11.390 11.355 1.080 1014 HD2 HIS 124 HD2 HIS 124 -7.829 11.797 3.203 1015 HE1 HIS 124 HE1 HIS 124 -11.654 10.011 3.208 1016 HE2 HIS 124 HE2 HIS 124 -9.493 10.270 4.514 1017 H SER 125 H SER 125 -6.936 11.859 -1.453 1018 HA SER 125 HA SER 125 -6.055 9.370 -0.330 1019 HB2 SER 125 1HB SER 125 -5.731 10.526 -3.110 1020 HB3 SER 125 2HB SER 125 -5.338 8.873 -2.655 1021 HG SER 125 HG SER 125 -7.369 8.507 -3.033 1022 H GLU 126 H GLU 126 -4.423 12.128 -1.854 1023 HA GLU 126 HA GLU 126 -1.779 11.246 -1.700 1024 HB2 GLU 126 1HB GLU 126 -2.579 13.286 -2.906 1025 HB3 GLU 126 2HB GLU 126 -2.780 14.087 -1.351 1026 HG2 GLU 126 1HG GLU 126 -0.360 13.748 -0.888 1027 HG3 GLU 126 2HG GLU 126 -0.189 12.994 -2.468 1028 H ASP 127 H ASP 127 -3.670 13.143 0.651 1029 HA ASP 127 HA ASP 127 -1.639 13.317 2.614 1030 HB2 ASP 127 1HB ASP 127 -3.624 14.783 2.591 1031 HB3 ASP 127 2HB ASP 127 -4.649 13.397 2.955 1032 H ASN 128 H ASN 128 -4.177 10.959 1.963 1033 HA ASN 128 HA ASN 128 -3.879 9.430 4.329 1034 HB2 ASN 128 1HB ASN 128 -5.845 9.230 2.874 1035 HB3 ASN 128 2HB ASN 128 -4.834 8.593 1.581 1036 HD21 ASN 128 2HD2 ASN 128 -5.651 6.458 1.472 1037 HD22 ASN 128 1HD2 ASN 128 -5.578 5.366 2.770 1038 H TRP 129 H TRP 129 -2.682 8.807 1.024 1039 HA TRP 129 HA TRP 129 -1.083 6.605 1.710 1040 HB2 TRP 129 1HB TRP 129 -0.894 8.597 -0.566 1041 HB3 TRP 129 2HB TRP 129 0.180 7.199 -0.433 1042 HD1 TRP 129 HD1 TRP 129 -3.063 8.145 -1.857 1043 HE1 TRP 129 HE1 TRP 129 -4.478 6.070 -2.412 1044 HE3 TRP 129 HE3 TRP 129 -0.398 4.568 0.631 1045 HZ2 TRP 129 HZ2 TRP 129 -4.480 3.257 -1.879 1046 HZ3 TRP 129 HZ3 TRP 129 -1.128 2.201 0.591 1047 HH2 TRP 129 HH2 TRP 129 -3.165 1.541 -0.660 1048 H ASN 130 H ASN 130 -0.382 10.075 1.715 1049 HA ASN 130 HA ASN 130 2.374 9.965 2.192 1050 HB2 ASN 130 1HB ASN 130 0.251 11.903 3.147 1051 HB3 ASN 130 2HB ASN 130 1.963 12.142 3.495 1052 HD21 ASN 130 2HD2 ASN 130 0.454 13.977 1.872 1053 HD22 ASN 130 1HD2 ASN 130 1.072 13.903 0.292 1054 H THR 131 H THR 131 -0.372 9.673 4.409 1055 HA THR 131 HA THR 131 1.120 9.489 6.802 1056 HB THR 131 HB THR 131 -1.547 8.166 6.249 1057 HG1 THR 131 HG1 THR 131 -0.797 10.832 6.708 1058 HG21 THR 131 3HG2 THR 131 -0.481 7.555 8.373 1059 HG22 THR 131 1HG2 THR 131 -1.888 8.579 8.659 1060 HG23 THR 131 2HG2 THR 131 -0.266 9.261 8.767 1061 H MET 132 H MET 132 -0.019 7.105 4.466 1062 HA MET 132 HA MET 132 0.847 4.798 5.868 1063 HB2 MET 132 1HB MET 132 -0.741 4.810 3.911 1064 HB3 MET 132 2HB MET 132 0.632 5.132 2.857 1065 HG2 MET 132 1HG MET 132 0.254 2.757 2.814 1066 HG3 MET 132 2HG MET 132 1.702 3.018 3.787 1067 HE1 MET 132 3HE MET 132 -0.709 0.570 3.620 1068 HE2 MET 132 1HE MET 132 -0.382 -0.037 5.247 1069 HE3 MET 132 2HE MET 132 0.950 0.441 4.199 1070 H LEU 133 H LEU 133 2.333 6.672 3.234 1071 HA LEU 133 HA LEU 133 4.760 5.263 3.133 1072 HB2 LEU 133 1HB LEU 133 3.821 7.961 2.229 1073 HB3 LEU 133 2HB LEU 133 5.559 7.693 2.266 1074 HG LEU 133 HG LEU 133 4.614 7.188 0.054 1075 HD11 LEU 133 1HD1 LEU 133 5.981 5.395 -0.324 1076 HD12 LEU 133 2HD1 LEU 133 5.299 4.429 0.979 1077 HD13 LEU 133 3HD1 LEU 133 6.484 5.686 1.338 1078 HD21 LEU 133 3HD2 LEU 133 3.070 5.302 -0.269 1079 HD22 LEU 133 1HD2 LEU 133 2.353 6.517 0.782 1080 HD23 LEU 133 2HD2 LEU 133 3.009 5.036 1.475 1081 H GLU 134 H GLU 134 3.758 8.045 5.050 1082 HA GLU 134 HA GLU 134 6.284 8.463 6.299 1083 HB2 GLU 134 1HB GLU 134 3.453 9.254 6.948 1084 HB3 GLU 134 2HB GLU 134 4.775 9.665 8.032 1085 HG2 GLU 134 1HG GLU 134 4.788 10.379 5.077 1086 HG3 GLU 134 2HG GLU 134 4.155 11.459 6.314 1087 H GLY 135 H GLY 135 3.451 6.492 7.007 1088 HA2 GLY 135 1HA GLY 135 4.129 5.661 9.609 1089 HA3 GLY 135 2HA GLY 135 3.103 4.769 8.484 1090 H LEU 136 H LEU 136 4.935 4.357 6.418 1091 HA LEU 136 HA LEU 136 6.338 2.061 7.341 1092 HB2 LEU 136 1HB LEU 136 6.456 3.596 4.738 1093 HB3 LEU 136 2HB LEU 136 7.295 2.070 5.002 1094 HG LEU 136 HG LEU 136 4.299 2.412 5.364 1095 HD11 LEU 136 1HD1 LEU 136 4.089 1.284 3.153 1096 HD12 LEU 136 2HD1 LEU 136 5.837 1.404 2.949 1097 HD13 LEU 136 3HD1 LEU 136 4.856 2.868 3.029 1098 HD21 LEU 136 3HD2 LEU 136 4.959 0.431 6.527 1099 HD22 LEU 136 1HD2 LEU 136 6.160 0.010 5.305 1100 HD23 LEU 136 2HD2 LEU 136 4.439 -0.163 4.959 1101 H LYS 137 H LYS 137 7.350 5.324 6.435 1102 HA LYS 137 HA LYS 137 10.123 4.898 6.669 1103 HB2 LYS 137 1HB LYS 137 9.088 6.879 5.570 1104 HB3 LYS 137 2HB LYS 137 8.619 7.477 7.157 1105 HG2 LYS 137 1HG LYS 137 10.988 7.546 7.847 1106 HG3 LYS 137 2HG LYS 137 11.467 6.915 6.273 1107 HD2 LYS 137 1HD LYS 137 10.488 8.901 5.178 1108 HD3 LYS 137 2HD LYS 137 10.021 9.537 6.754 1109 HE2 LYS 137 1HE LYS 137 12.403 9.558 7.443 1110 HE3 LYS 137 2HE LYS 137 12.859 8.969 5.844 1111 HZ1 LYS 137 3HZ LYS 137 11.823 11.598 6.635 1112 HZ2 LYS 137 1HZ LYS 137 11.468 11.024 5.079 1113 HZ3 LYS 137 2HZ LYS 137 13.084 11.211 5.565 1114 H LYS 138 H LYS 138 7.663 5.777 9.050 1115 HA LYS 138 HA LYS 138 9.339 6.458 11.178 1116 HB2 LYS 138 1HB LYS 138 6.887 6.827 11.136 1117 HB3 LYS 138 2HB LYS 138 6.659 5.093 11.353 1118 HG2 LYS 138 1HG LYS 138 7.766 5.140 13.507 1119 HG3 LYS 138 2HG LYS 138 8.258 6.815 13.274 1120 HD2 LYS 138 1HD LYS 138 6.332 6.766 14.753 1121 HD3 LYS 138 2HD LYS 138 5.853 7.478 13.213 1122 HE2 LYS 138 1HE LYS 138 4.672 5.523 12.545 1123 HE3 LYS 138 2HE LYS 138 5.472 4.520 13.757 1124 HZ1 LYS 138 3HZ LYS 138 4.367 6.195 15.380 1125 HZ2 LYS 138 1HZ LYS 138 3.465 4.910 14.736 1126 HZ3 LYS 138 2HZ LYS 138 3.308 6.471 14.082 1127 H PHE 139 H PHE 139 8.167 3.305 10.093 1128 HA PHE 139 HA PHE 139 9.286 1.868 12.329 1129 HB2 PHE 139 1HB PHE 139 7.317 1.064 11.016 1130 HB3 PHE 139 2HB PHE 139 8.387 0.787 9.643 1131 HD1 PHE 139 HD2 PHE 139 7.564 -0.267 13.104 1132 HD2 PHE 139 HD1 PHE 139 9.969 -1.063 9.631 1133 HE1 PHE 139 HE2 PHE 139 8.211 -2.466 14.053 1134 HE2 PHE 139 HE1 PHE 139 10.613 -3.258 10.582 1135 HZ PHE 139 HZ PHE 139 9.736 -3.961 12.792 1136 H LEU 140 H LEU 140 10.189 2.374 8.937 1137 HA LEU 140 HA LEU 140 12.525 0.780 8.981 1138 HB2 LEU 140 1HB LEU 140 11.682 3.093 7.237 1139 HB3 LEU 140 2HB LEU 140 13.139 2.144 6.932 1140 HG LEU 140 HG LEU 140 10.395 0.865 7.188 1141 HD11 LEU 140 1HD1 LEU 140 11.800 1.773 4.659 1142 HD12 LEU 140 2HD1 LEU 140 10.335 2.481 5.337 1143 HD13 LEU 140 3HD1 LEU 140 10.311 0.828 4.725 1144 HD21 LEU 140 3HD2 LEU 140 13.079 -0.070 6.103 1145 HD22 LEU 140 1HD2 LEU 140 11.571 -0.916 5.751 1146 HD23 LEU 140 2HD2 LEU 140 12.140 -0.791 7.409 1147 H GLU 141 H GLU 141 12.008 4.216 9.575 1148 HA GLU 141 HA GLU 141 14.812 4.762 9.981 1149 HB2 GLU 141 1HB GLU 141 14.180 7.002 10.277 1150 HB3 GLU 141 2HB GLU 141 12.905 6.393 9.226 1151 HG2 GLU 141 1HG GLU 141 11.571 5.916 11.368 1152 HG3 GLU 141 2HG GLU 141 12.771 6.881 12.214 1153 H ASN 142 H ASN 142 12.688 3.027 11.743 1154 HA ASN 142 HA ASN 142 12.965 3.999 14.368 1155 HB2 ASN 142 1HB ASN 142 11.297 2.288 13.567 1156 HB3 ASN 142 2HB ASN 142 12.604 1.106 13.567 1157 HD21 ASN 142 2HD2 ASN 142 11.967 -0.186 15.326 1158 HD22 ASN 142 1HD2 ASN 142 11.786 0.405 16.908 1159 H LYS 143 H LYS 143 14.920 1.776 12.451 1160 HA LYS 143 HA LYS 143 16.620 0.867 14.494 1161 HB2 LYS 143 1HB LYS 143 16.420 -0.093 12.190 1162 HB3 LYS 143 2HB LYS 143 17.318 1.295 11.586 1163 HG2 LYS 143 1HG LYS 143 19.257 0.703 12.908 1164 HG3 LYS 143 2HG LYS 143 18.365 -0.572 13.730 1165 HD2 LYS 143 1HD LYS 143 19.711 -1.633 12.039 1166 HD3 LYS 143 2HD LYS 143 18.042 -1.693 11.492 1167 HE2 LYS 143 1HE LYS 143 18.389 0.037 9.885 1168 HE3 LYS 143 2HE LYS 143 19.907 0.536 10.631 1169 HZ1 LYS 143 3HZ LYS 143 19.421 -2.078 9.312 1170 HZ2 LYS 143 1HZ LYS 143 20.888 -1.557 9.982 1171 HZ3 LYS 143 2HZ LYS 143 20.254 -0.768 8.620 1172 H VAL 144 H VAL 144 17.244 3.461 12.100 1173 HA VAL 144 HA VAL 144 19.630 4.347 13.342 1174 HB VAL 144 HB VAL 144 19.093 4.838 10.985 1175 HG11 VAL 144 1HG1 VAL 144 17.085 6.821 12.086 1176 HG12 VAL 144 2HG1 VAL 144 16.663 5.263 11.379 1177 HG13 VAL 144 3HG1 VAL 144 17.439 6.493 10.390 1178 HG21 VAL 144 3HG2 VAL 144 19.925 7.112 10.965 1179 HG22 VAL 144 1HG2 VAL 144 20.683 6.267 12.314 1180 HG23 VAL 144 2HG2 VAL 144 19.355 7.388 12.611 1181 H SER 145 H SER 145 16.259 5.329 13.685 1182 HA SER 145 HA SER 145 16.677 7.624 15.273 1183 HB2 SER 145 1HB SER 145 14.505 7.108 14.214 1184 HB3 SER 145 2HB SER 145 14.321 5.726 15.282 1185 HG SER 145 HG SER 145 13.814 7.027 16.862 1186 H ALA 146 H ALA 146 16.206 4.226 16.111 1187 HA ALA 146 HA ALA 146 16.200 4.584 18.932 1188 HB1 ALA 146 3HB ALA 146 16.565 2.136 18.996 1189 HB2 ALA 146 1HB ALA 146 16.866 2.149 17.258 1190 HB3 ALA 146 2HB ALA 146 15.272 2.577 17.880 Start of MODEL 5 1 H1 MET 1 1H MET 1 -12.008 12.928 -24.589 2 H2 MET 1 2H MET 1 -10.499 12.202 -24.872 3 H3 MET 1 3H MET 1 -10.626 13.512 -23.798 4 HA MET 1 HA MET 1 -12.030 12.157 -22.330 5 HB2 MET 1 1HB MET 1 -12.836 10.639 -24.141 6 HB3 MET 1 2HB MET 1 -11.220 9.942 -24.238 7 HG2 MET 1 1HG MET 1 -11.367 9.187 -21.916 8 HG3 MET 1 2HG MET 1 -12.937 9.969 -21.740 9 HE1 MET 1 3HE MET 1 -11.039 6.869 -22.531 10 HE2 MET 1 1HE MET 1 -10.990 7.559 -24.157 11 HE3 MET 1 2HE MET 1 -11.878 6.067 -23.858 12 H GLU 2 H GLU 2 -10.880 11.535 -20.542 13 HA GLU 2 HA GLU 2 -8.282 10.313 -20.673 14 HB2 GLU 2 1HB GLU 2 -7.189 12.315 -19.435 15 HB3 GLU 2 2HB GLU 2 -7.404 12.455 -21.175 16 HG2 GLU 2 1HG GLU 2 -8.113 14.523 -20.106 17 HG3 GLU 2 2HG GLU 2 -9.519 13.724 -20.792 18 H ILE 3 H ILE 3 -7.467 9.782 -18.556 19 HA ILE 3 HA ILE 3 -9.482 9.079 -16.710 20 HB ILE 3 HB ILE 3 -7.740 8.177 -15.359 21 HG12 ILE 3 1HG1 ILE 3 -6.214 10.045 -15.128 22 HG13 ILE 3 2HG1 ILE 3 -5.313 8.696 -15.800 23 HG21 ILE 3 1HG2 ILE 3 -6.843 8.055 -18.251 24 HG22 ILE 3 2HG2 ILE 3 -8.093 7.052 -17.514 25 HG23 ILE 3 3HG2 ILE 3 -6.420 6.905 -16.983 26 HD11 ILE 3 3HD1 ILE 3 -4.669 10.632 -17.044 27 HD12 ILE 3 1HD1 ILE 3 -6.339 11.137 -17.270 28 HD13 ILE 3 2HD1 ILE 3 -5.729 9.702 -18.100 29 H LYS 4 H LYS 4 -9.328 9.677 -14.326 30 HA LYS 4 HA LYS 4 -9.647 12.530 -14.061 31 HB2 LYS 4 1HB LYS 4 -9.822 10.271 -12.048 32 HB3 LYS 4 2HB LYS 4 -10.216 11.951 -11.697 33 HG2 LYS 4 1HG LYS 4 -11.935 11.927 -13.470 34 HG3 LYS 4 2HG LYS 4 -11.551 10.240 -13.809 35 HD2 LYS 4 1HD LYS 4 -12.184 9.614 -11.520 36 HD3 LYS 4 2HD LYS 4 -12.533 11.301 -11.151 37 HE2 LYS 4 1HE LYS 4 -14.283 11.338 -12.871 38 HE3 LYS 4 2HE LYS 4 -13.925 9.662 -13.283 39 HZ1 LYS 4 3HZ LYS 4 -15.443 9.156 -11.756 40 HZ2 LYS 4 1HZ LYS 4 -15.449 10.720 -11.098 41 HZ3 LYS 4 2HZ LYS 4 -14.280 9.593 -10.598 42 H LEU 5 H LEU 5 -8.738 12.924 -11.437 43 HA LEU 5 HA LEU 5 -5.988 13.595 -11.930 44 HB2 LEU 5 1HB LEU 5 -7.882 13.935 -9.605 45 HB3 LEU 5 2HB LEU 5 -6.173 14.288 -9.398 46 HG LEU 5 HG LEU 5 -6.275 15.893 -11.268 47 HD11 LEU 5 1HD1 LEU 5 -8.015 15.001 -12.657 48 HD12 LEU 5 2HD1 LEU 5 -8.617 16.545 -12.063 49 HD13 LEU 5 3HD1 LEU 5 -9.184 15.043 -11.336 50 HD21 LEU 5 3HD2 LEU 5 -6.687 16.663 -8.975 51 HD22 LEU 5 1HD2 LEU 5 -8.405 16.303 -9.150 52 HD23 LEU 5 2HD2 LEU 5 -7.668 17.580 -10.119 53 H ILE 6 H ILE 6 -4.150 12.714 -11.151 54 HA ILE 6 HA ILE 6 -4.328 10.118 -9.695 55 HB ILE 6 HB ILE 6 -2.200 11.122 -11.609 56 HG12 ILE 6 1HG1 ILE 6 -4.194 8.858 -11.976 57 HG13 ILE 6 2HG1 ILE 6 -4.452 10.481 -12.613 58 HG21 ILE 6 1HG2 ILE 6 -1.198 9.654 -9.970 59 HG22 ILE 6 2HG2 ILE 6 -1.420 8.709 -11.437 60 HG23 ILE 6 3HG2 ILE 6 -2.538 8.516 -10.088 61 HD11 ILE 6 3HD1 ILE 6 -2.387 10.323 -13.928 62 HD12 ILE 6 1HD1 ILE 6 -3.461 8.979 -14.316 63 HD13 ILE 6 2HD1 ILE 6 -2.070 8.720 -13.265 64 H ALA 7 H ALA 7 -3.412 9.995 -7.750 65 HA ALA 7 HA ALA 7 -2.075 12.274 -6.574 66 HB1 ALA 7 3HB ALA 7 -3.548 10.958 -5.188 67 HB2 ALA 7 1HB ALA 7 -1.906 10.766 -4.579 68 HB3 ALA 7 2HB ALA 7 -2.642 9.488 -5.542 69 H GLN 8 H GLN 8 0.064 12.500 -6.061 70 HA GLN 8 HA GLN 8 1.959 10.321 -6.749 71 HB2 GLN 8 1HB GLN 8 2.106 13.183 -7.736 72 HB3 GLN 8 2HB GLN 8 3.427 12.019 -7.854 73 HG2 GLN 8 1HG GLN 8 1.998 10.519 -9.187 74 HG3 GLN 8 2HG GLN 8 0.669 11.667 -9.066 75 HE21 GLN 8 2HE2 GLN 8 2.684 10.668 -11.344 76 HE22 GLN 8 1HE2 GLN 8 3.051 12.126 -12.135 77 H VAL 9 H VAL 9 3.128 9.934 -5.008 78 HA VAL 9 HA VAL 9 4.260 12.171 -3.431 79 HB VAL 9 HB VAL 9 3.711 10.988 -1.324 80 HG11 VAL 9 1HG1 VAL 9 1.275 11.574 -3.024 81 HG12 VAL 9 2HG1 VAL 9 2.264 12.807 -2.245 82 HG13 VAL 9 3HG1 VAL 9 1.366 11.647 -1.267 83 HG21 VAL 9 3HG2 VAL 9 1.941 9.221 -1.421 84 HG22 VAL 9 1HG2 VAL 9 3.447 8.714 -2.183 85 HG23 VAL 9 2HG2 VAL 9 2.084 9.218 -3.180 86 H LYS 10 H LYS 10 6.142 11.572 -2.208 87 HA LYS 10 HA LYS 10 7.287 8.977 -2.239 88 HB2 LYS 10 1HB LYS 10 9.186 9.503 -3.833 89 HB3 LYS 10 2HB LYS 10 7.620 9.262 -4.598 90 HG2 LYS 10 1HG LYS 10 7.278 11.715 -4.666 91 HG3 LYS 10 2HG LYS 10 8.869 11.942 -3.936 92 HD2 LYS 10 1HD LYS 10 9.924 10.820 -5.848 93 HD3 LYS 10 2HD LYS 10 8.340 10.540 -6.573 94 HE2 LYS 10 1HE LYS 10 7.956 12.968 -6.687 95 HE3 LYS 10 2HE LYS 10 9.535 13.256 -5.955 96 HZ1 LYS 10 3HZ LYS 10 9.201 13.232 -8.551 97 HZ2 LYS 10 1HZ LYS 10 9.424 11.565 -8.335 98 HZ3 LYS 10 2HZ LYS 10 10.626 12.656 -7.833 99 H THR 11 H THR 11 9.276 8.884 -1.136 100 HA THR 11 HA THR 11 10.468 11.396 -0.156 101 HB THR 11 HB THR 11 8.829 10.945 1.553 102 HG1 THR 11 HG1 THR 11 10.513 11.506 2.690 103 HG21 THR 11 3HG2 THR 11 9.989 8.145 1.627 104 HG22 THR 11 1HG2 THR 11 8.396 8.584 1.009 105 HG23 THR 11 2HG2 THR 11 8.759 8.774 2.723 106 H VAL 12 H VAL 12 12.587 11.231 0.436 107 HA VAL 12 HA VAL 12 14.014 8.867 -0.521 108 HB VAL 12 HB VAL 12 15.156 11.381 0.733 109 HG11 VAL 12 1HG1 VAL 12 16.308 9.233 -1.079 110 HG12 VAL 12 2HG1 VAL 12 16.747 9.536 0.600 111 HG13 VAL 12 3HG1 VAL 12 17.142 10.723 -0.642 112 HG21 VAL 12 3HG2 VAL 12 14.530 10.740 -2.166 113 HG22 VAL 12 1HG2 VAL 12 15.436 12.149 -1.617 114 HG23 VAL 12 2HG2 VAL 12 13.737 11.969 -1.183 115 H ILE 13 H ILE 13 14.628 7.238 0.725 116 HA ILE 13 HA ILE 13 15.031 7.666 3.650 117 HB ILE 13 HB ILE 13 13.709 5.256 2.368 118 HG12 ILE 13 1HG1 ILE 13 12.489 7.376 4.168 119 HG13 ILE 13 2HG1 ILE 13 12.324 7.390 2.416 120 HG21 ILE 13 1HG2 ILE 13 13.240 4.715 4.809 121 HG22 ILE 13 2HG2 ILE 13 14.326 6.032 5.242 122 HG23 ILE 13 3HG2 ILE 13 14.941 4.631 4.367 123 HD11 ILE 13 3HD1 ILE 13 10.365 6.323 3.400 124 HD12 ILE 13 1HD1 ILE 13 11.393 5.188 4.277 125 HD13 ILE 13 2HD1 ILE 13 11.308 5.121 2.517 126 H ASN 14 H ASN 14 16.875 6.885 4.423 127 HA ASN 14 HA ASN 14 18.716 5.497 2.609 128 HB2 ASN 14 1HB ASN 14 19.037 6.633 5.400 129 HB3 ASN 14 2HB ASN 14 20.323 5.798 4.529 130 HD21 ASN 14 2HD2 ASN 14 20.066 8.730 5.347 131 HD22 ASN 14 1HD2 ASN 14 20.294 9.590 3.900 132 H ALA 15 H ALA 15 17.991 3.411 2.423 133 HA ALA 15 HA ALA 15 18.694 1.609 4.488 134 HB1 ALA 15 3HB ALA 15 16.716 2.205 5.647 135 HB2 ALA 15 1HB ALA 15 16.293 0.697 4.830 136 HB3 ALA 15 2HB ALA 15 15.773 2.247 4.163 137 HA PRO 16 HA PRO 16 18.810 -1.136 1.003 138 HB2 PRO 16 1HB PRO 16 17.733 -3.382 2.674 139 HB3 PRO 16 2HB PRO 16 19.278 -3.272 1.803 140 HG2 PRO 16 1HG PRO 16 19.165 -3.090 4.472 141 HG3 PRO 16 2HG PRO 16 20.315 -2.123 3.523 142 HD2 PRO 16 1HD PRO 16 17.717 -1.253 4.790 143 HD3 PRO 16 2HD PRO 16 19.273 -0.409 4.675 144 H ILE 17 H ILE 17 17.506 -1.972 -0.614 145 HA ILE 17 HA ILE 17 14.759 -1.260 -0.645 146 HB ILE 17 HB ILE 17 16.142 -1.269 -2.669 147 HG12 ILE 17 1HG1 ILE 17 13.964 -3.376 -2.924 148 HG13 ILE 17 2HG1 ILE 17 13.619 -1.654 -2.754 149 HG21 ILE 17 1HG2 ILE 17 17.486 -3.281 -2.010 150 HG22 ILE 17 2HG2 ILE 17 16.899 -3.345 -3.669 151 HG23 ILE 17 3HG2 ILE 17 16.101 -4.291 -2.418 152 HD11 ILE 17 3HD1 ILE 17 15.226 -2.953 -4.973 153 HD12 ILE 17 1HD1 ILE 17 15.008 -1.212 -4.779 154 HD13 ILE 17 2HD1 ILE 17 13.617 -2.242 -5.116 155 H GLU 18 H GLU 18 16.443 -4.192 0.186 156 HA GLU 18 HA GLU 18 14.432 -6.096 -0.223 157 HB2 GLU 18 1HB GLU 18 16.811 -6.581 0.345 158 HB3 GLU 18 2HB GLU 18 16.487 -6.058 1.996 159 HG2 GLU 18 1HG GLU 18 14.776 -7.825 2.232 160 HG3 GLU 18 2HG GLU 18 15.065 -8.328 0.566 161 H LYS 19 H LYS 19 15.181 -4.229 2.709 162 HA LYS 19 HA LYS 19 13.076 -5.344 4.253 163 HB2 LYS 19 1HB LYS 19 14.846 -2.928 4.559 164 HB3 LYS 19 2HB LYS 19 13.515 -3.197 5.684 165 HG2 LYS 19 1HG LYS 19 15.669 -4.172 6.497 166 HG3 LYS 19 2HG LYS 19 14.408 -5.385 6.294 167 HD2 LYS 19 1HD LYS 19 15.363 -6.186 4.245 168 HD3 LYS 19 2HD LYS 19 16.453 -4.805 4.129 169 HE2 LYS 19 1HE LYS 19 17.695 -6.751 4.905 170 HE3 LYS 19 2HE LYS 19 17.579 -5.588 6.224 171 HZ1 LYS 19 3HZ LYS 19 17.038 -8.039 6.686 172 HZ2 LYS 19 1HZ LYS 19 15.561 -7.716 5.917 173 HZ3 LYS 19 2HZ LYS 19 15.999 -6.852 7.313 174 H VAL 20 H VAL 20 13.197 -2.377 2.285 175 HA VAL 20 HA VAL 20 10.605 -1.467 3.071 176 HB VAL 20 HB VAL 20 12.169 -0.901 0.533 177 HG11 VAL 20 1HG1 VAL 20 10.677 1.142 0.463 178 HG12 VAL 20 2HG1 VAL 20 9.704 0.403 1.735 179 HG13 VAL 20 3HG1 VAL 20 9.829 -0.373 0.156 180 HG21 VAL 20 3HG2 VAL 20 11.834 0.749 3.056 181 HG22 VAL 20 1HG2 VAL 20 12.866 1.125 1.680 182 HG23 VAL 20 2HG2 VAL 20 13.247 -0.249 2.717 183 H TRP 21 H TRP 21 11.781 -3.311 0.280 184 HA TRP 21 HA TRP 21 9.346 -3.759 -1.030 185 HB2 TRP 21 1HB TRP 21 11.589 -4.258 -1.967 186 HB3 TRP 21 2HB TRP 21 11.761 -5.579 -0.821 187 HD1 TRP 21 HD1 TRP 21 10.177 -7.719 -1.155 188 HE1 TRP 21 HE1 TRP 21 9.015 -8.644 -3.263 189 HE3 TRP 21 HE3 TRP 21 10.447 -3.618 -4.186 190 HZ2 TRP 21 HZ2 TRP 21 8.299 -7.762 -5.887 191 HZ3 TRP 21 HZ3 TRP 21 9.519 -3.687 -6.482 192 HH2 TRP 21 HH2 TRP 21 8.449 -5.755 -7.335 193 H GLU 22 H GLU 22 10.980 -5.570 1.542 194 HA GLU 22 HA GLU 22 9.223 -7.740 1.766 195 HB2 GLU 22 1HB GLU 22 11.445 -7.543 2.898 196 HB3 GLU 22 2HB GLU 22 10.740 -6.363 4.000 197 HG2 GLU 22 1HG GLU 22 9.123 -8.041 4.794 198 HG3 GLU 22 2HG GLU 22 9.775 -9.219 3.657 199 H ALA 23 H ALA 23 9.183 -4.584 3.398 200 HA ALA 23 HA ALA 23 7.023 -4.975 5.100 201 HB1 ALA 23 3HB ALA 23 6.785 -2.541 5.104 202 HB2 ALA 23 1HB ALA 23 7.789 -2.432 3.659 203 HB3 ALA 23 2HB ALA 23 8.484 -3.006 5.175 204 H LEU 24 H LEU 24 7.017 -4.157 1.674 205 HA LEU 24 HA LEU 24 4.261 -3.489 1.519 206 HB2 LEU 24 1HB LEU 24 6.314 -3.162 -0.174 207 HB3 LEU 24 2HB LEU 24 5.692 -4.653 -0.861 208 HG LEU 24 HG LEU 24 4.679 -2.792 -2.033 209 HD11 LEU 24 1HD1 LEU 24 3.261 -4.837 -1.303 210 HD12 LEU 24 2HD1 LEU 24 2.410 -3.405 -1.884 211 HD13 LEU 24 3HD1 LEU 24 2.507 -3.726 -0.154 212 HD21 LEU 24 3HD2 LEU 24 3.217 -1.684 0.334 213 HD22 LEU 24 1HD2 LEU 24 3.886 -0.865 -1.075 214 HD23 LEU 24 2HD2 LEU 24 4.937 -1.311 0.261 215 H VAL 25 H VAL 25 5.976 -6.540 0.869 216 HA VAL 25 HA VAL 25 3.356 -7.961 0.796 217 HB VAL 25 HB VAL 25 4.780 -9.774 -0.392 218 HG11 VAL 25 1HG1 VAL 25 3.129 -8.382 -1.563 219 HG12 VAL 25 2HG1 VAL 25 4.555 -8.629 -2.572 220 HG13 VAL 25 3HG1 VAL 25 4.319 -7.094 -1.737 221 HG21 VAL 25 3HG2 VAL 25 6.797 -8.989 -1.499 222 HG22 VAL 25 1HG2 VAL 25 6.978 -8.718 0.233 223 HG23 VAL 25 2HG2 VAL 25 6.586 -7.371 -0.831 224 H ASN 26 H ASN 26 3.400 -7.945 3.128 225 HA ASN 26 HA ASN 26 4.596 -10.388 4.106 226 HB2 ASN 26 1HB ASN 26 6.401 -8.732 4.377 227 HB3 ASN 26 2HB ASN 26 5.358 -7.808 5.442 228 HD21 ASN 26 2HD2 ASN 26 4.351 -10.743 6.232 229 HD22 ASN 26 1HD2 ASN 26 5.486 -11.194 7.405 230 HA PRO 27 HA PRO 27 0.589 -9.595 6.123 231 HB2 PRO 27 1HB PRO 27 0.064 -12.149 6.991 232 HB3 PRO 27 2HB PRO 27 -0.162 -11.639 5.304 233 HG2 PRO 27 1HG PRO 27 2.115 -13.146 6.529 234 HG3 PRO 27 2HG PRO 27 1.299 -13.409 4.975 235 HD2 PRO 27 1HD PRO 27 3.696 -12.105 5.199 236 HD3 PRO 27 2HD PRO 27 2.540 -11.749 3.899 237 H GLU 28 H GLU 28 3.554 -10.233 7.452 238 HA GLU 28 HA GLU 28 2.603 -10.375 10.253 239 HB2 GLU 28 1HB GLU 28 5.406 -10.548 9.108 240 HB3 GLU 28 2HB GLU 28 4.969 -10.758 10.802 241 HG2 GLU 28 1HG GLU 28 3.835 -12.448 8.555 242 HG3 GLU 28 2HG GLU 28 5.213 -12.928 9.541 243 H ILE 29 H ILE 29 4.720 -8.372 8.193 244 HA ILE 29 HA ILE 29 5.116 -6.342 10.165 245 HB ILE 29 HB ILE 29 5.408 -6.248 7.152 246 HG12 ILE 29 1HG1 ILE 29 7.550 -6.447 9.299 247 HG13 ILE 29 2HG1 ILE 29 6.876 -7.860 8.489 248 HG21 ILE 29 1HG2 ILE 29 6.220 -4.285 9.313 249 HG22 ILE 29 2HG2 ILE 29 5.168 -3.983 7.931 250 HG23 ILE 29 3HG2 ILE 29 6.889 -4.250 7.681 251 HD11 ILE 29 3HD1 ILE 29 7.587 -6.972 6.308 252 HD12 ILE 29 1HD1 ILE 29 8.966 -7.115 7.397 253 HD13 ILE 29 2HD1 ILE 29 8.241 -5.536 7.096 254 H ILE 30 H ILE 30 2.895 -6.733 7.433 255 HA ILE 30 HA ILE 30 1.617 -4.222 7.627 256 HB ILE 30 HB ILE 30 0.648 -6.907 6.598 257 HG12 ILE 30 1HG1 ILE 30 2.528 -5.905 5.367 258 HG13 ILE 30 2HG1 ILE 30 1.072 -5.936 4.386 259 HG21 ILE 30 1HG2 ILE 30 -1.365 -5.719 7.128 260 HG22 ILE 30 2HG2 ILE 30 -1.122 -5.508 5.394 261 HG23 ILE 30 3HG2 ILE 30 -0.718 -4.200 6.505 262 HD11 ILE 30 3HD1 ILE 30 2.576 -3.611 5.495 263 HD12 ILE 30 1HD1 ILE 30 0.822 -3.435 5.427 264 HD13 ILE 30 2HD1 ILE 30 1.735 -3.774 3.958 265 H LYS 31 H LYS 31 0.958 -7.339 9.178 266 HA LYS 31 HA LYS 31 -1.385 -6.490 10.564 267 HB2 LYS 31 1HB LYS 31 -0.745 -8.865 10.070 268 HB3 LYS 31 2HB LYS 31 0.502 -8.744 11.309 269 HG2 LYS 31 1HG LYS 31 -1.320 -8.089 12.940 270 HG3 LYS 31 2HG LYS 31 -2.496 -8.470 11.685 271 HD2 LYS 31 1HD LYS 31 -0.456 -10.407 12.829 272 HD3 LYS 31 2HD LYS 31 -2.169 -10.374 13.233 273 HE2 LYS 31 1HE LYS 31 -2.594 -10.679 10.699 274 HE3 LYS 31 2HE LYS 31 -0.891 -11.130 10.599 275 HZ1 LYS 31 3HZ LYS 31 -2.845 -12.392 12.434 276 HZ2 LYS 31 1HZ LYS 31 -1.241 -12.874 12.164 277 HZ3 LYS 31 2HZ LYS 31 -2.394 -13.032 10.926 278 H GLU 32 H GLU 32 2.049 -6.349 11.231 279 HA GLU 32 HA GLU 32 1.989 -5.909 14.001 280 HB2 GLU 32 1HB GLU 32 4.059 -6.294 12.623 281 HB3 GLU 32 2HB GLU 32 3.918 -4.638 12.044 282 HG2 GLU 32 1HG GLU 32 4.082 -3.791 14.342 283 HG3 GLU 32 2HG GLU 32 4.175 -5.441 14.953 284 H TYR 33 H TYR 33 1.697 -3.630 11.291 285 HA TYR 33 HA TYR 33 1.509 -1.289 12.908 286 HB2 TYR 33 1HB TYR 33 0.752 -1.904 10.038 287 HB3 TYR 33 2HB TYR 33 0.470 -0.319 10.750 288 HD1 TYR 33 HD2 TYR 33 2.448 0.882 11.840 289 HD2 TYR 33 HD1 TYR 33 2.921 -2.430 9.146 290 HE1 TYR 33 HE2 TYR 33 4.784 1.571 11.405 291 HE2 TYR 33 HE1 TYR 33 5.262 -1.734 8.711 292 HH TYR 33 HH TYR 33 6.763 -0.066 8.973 293 H MET 34 H MET 34 -0.831 -3.618 11.676 294 HA MET 34 HA MET 34 -3.115 -2.037 12.600 295 HB2 MET 34 1HB MET 34 -2.897 -4.731 11.236 296 HB3 MET 34 2HB MET 34 -4.426 -3.985 11.707 297 HG2 MET 34 1HG MET 34 -3.881 -2.009 10.318 298 HG3 MET 34 2HG MET 34 -2.373 -2.779 9.824 299 HE1 MET 34 3HE MET 34 -2.734 -2.708 7.368 300 HE2 MET 34 1HE MET 34 -4.194 -1.748 7.643 301 HE3 MET 34 2HE MET 34 -4.232 -3.113 6.531 302 H PHE 35 H PHE 35 -4.591 -2.759 14.142 303 HA PHE 35 HA PHE 35 -3.506 -3.776 16.522 304 HB2 PHE 35 1HB PHE 35 -6.379 -3.518 15.604 305 HB3 PHE 35 2HB PHE 35 -5.923 -3.970 17.244 306 HD1 PHE 35 HD2 PHE 35 -4.695 -2.384 18.698 307 HD2 PHE 35 HD1 PHE 35 -6.090 -1.229 14.801 308 HE1 PHE 35 HE2 PHE 35 -4.359 -0.001 19.286 309 HE2 PHE 35 HE1 PHE 35 -5.751 1.157 15.390 310 HZ PHE 35 HZ PHE 35 -4.886 1.770 17.633 311 H GLY 36 H GLY 36 -5.567 -5.440 14.112 312 HA2 GLY 36 1HA GLY 36 -4.331 -7.971 14.671 313 HA3 GLY 36 2HA GLY 36 -5.929 -7.866 15.399 314 H THR 37 H THR 37 -4.657 -6.694 12.280 315 HA THR 37 HA THR 37 -7.020 -7.690 10.889 316 HB THR 37 HB THR 37 -4.519 -6.413 9.755 317 HG1 THR 37 HG1 THR 37 -7.007 -5.175 10.239 318 HG21 THR 37 3HG2 THR 37 -5.767 -7.553 8.034 319 HG22 THR 37 1HG2 THR 37 -6.122 -5.832 7.895 320 HG23 THR 37 2HG2 THR 37 -7.295 -6.914 8.644 321 H THR 38 H THR 38 -7.157 -9.789 10.452 322 HA THR 38 HA THR 38 -4.840 -11.492 10.123 323 HB THR 38 HB THR 38 -7.765 -12.085 9.604 324 HG1 THR 38 HG1 THR 38 -6.170 -11.995 11.887 325 HG21 THR 38 3HG2 THR 38 -6.366 -13.749 8.559 326 HG22 THR 38 1HG2 THR 38 -6.980 -14.441 10.060 327 HG23 THR 38 2HG2 THR 38 -5.325 -13.840 9.981 328 H VAL 39 H VAL 39 -3.728 -10.720 8.312 329 HA VAL 39 HA VAL 39 -5.095 -10.816 5.680 330 HB VAL 39 HB VAL 39 -3.968 -8.728 6.042 331 HG11 VAL 39 1HG1 VAL 39 -2.557 -9.349 7.911 332 HG12 VAL 39 2HG1 VAL 39 -1.558 -8.638 6.645 333 HG13 VAL 39 3HG1 VAL 39 -1.579 -10.382 6.874 334 HG21 VAL 39 3HG2 VAL 39 -1.964 -10.334 4.421 335 HG22 VAL 39 1HG2 VAL 39 -2.458 -8.659 4.187 336 HG23 VAL 39 2HG2 VAL 39 -3.571 -9.971 3.804 337 H VAL 40 H VAL 40 -4.609 -12.269 4.204 338 HA VAL 40 HA VAL 40 -2.337 -14.131 4.645 339 HB VAL 40 HB VAL 40 -3.807 -15.913 3.751 340 HG11 VAL 40 1HG1 VAL 40 -5.162 -16.183 5.812 341 HG12 VAL 40 2HG1 VAL 40 -4.820 -14.506 6.230 342 HG13 VAL 40 3HG1 VAL 40 -3.509 -15.683 6.169 343 HG21 VAL 40 3HG2 VAL 40 -5.963 -13.810 4.064 344 HG22 VAL 40 1HG2 VAL 40 -6.256 -15.517 3.730 345 HG23 VAL 40 2HG2 VAL 40 -5.422 -14.518 2.542 346 H SER 41 H SER 41 -1.162 -14.630 2.901 347 HA SER 41 HA SER 41 -2.110 -14.101 0.189 348 HB2 SER 41 1HB SER 41 -0.155 -12.603 -0.311 349 HB3 SER 41 2HB SER 41 -1.363 -11.886 0.747 350 HG SER 41 HG SER 41 0.735 -13.337 1.901 351 H ASP 42 H ASP 42 -0.681 -14.843 -1.426 352 HA ASP 42 HA ASP 42 1.016 -17.105 -0.586 353 HB2 ASP 42 1HB ASP 42 -0.839 -17.468 -2.211 354 HB3 ASP 42 2HB ASP 42 -0.072 -16.338 -3.311 355 H TRP 43 H TRP 43 1.089 -13.957 -1.970 356 HA TRP 43 HA TRP 43 2.804 -12.515 -2.472 357 HB2 TRP 43 1HB TRP 43 4.855 -14.618 -1.744 358 HB3 TRP 43 2HB TRP 43 4.969 -12.868 -1.603 359 HD1 TRP 43 HD1 TRP 43 2.384 -12.179 -0.028 360 HE1 TRP 43 HE1 TRP 43 2.103 -12.943 2.422 361 HE3 TRP 43 HE3 TRP 43 5.708 -16.049 0.072 362 HZ2 TRP 43 HZ2 TRP 43 3.157 -14.938 4.189 363 HZ3 TRP 43 HZ3 TRP 43 6.051 -17.365 2.142 364 HH2 TRP 43 HH2 TRP 43 4.782 -16.815 4.201 365 H LYS 44 H LYS 44 1.692 -13.842 -4.586 366 HA LYS 44 HA LYS 44 3.884 -13.834 -6.491 367 HB2 LYS 44 1HB LYS 44 3.376 -16.079 -7.415 368 HB3 LYS 44 2HB LYS 44 4.038 -16.129 -5.787 369 HG2 LYS 44 1HG LYS 44 2.262 -17.584 -5.436 370 HG3 LYS 44 2HG LYS 44 1.399 -16.086 -5.140 371 HD2 LYS 44 1HD LYS 44 0.590 -16.069 -7.469 372 HD3 LYS 44 2HD LYS 44 1.519 -17.525 -7.809 373 HE2 LYS 44 1HE LYS 44 0.198 -18.761 -6.145 374 HE3 LYS 44 2HE LYS 44 -0.719 -17.298 -5.780 375 HZ1 LYS 44 3HZ LYS 44 -2.085 -18.000 -7.382 376 HZ2 LYS 44 1HZ LYS 44 -0.958 -19.100 -8.011 377 HZ3 LYS 44 2HZ LYS 44 -0.896 -17.465 -8.469 378 H GLU 45 H GLU 45 3.215 -13.666 -8.656 379 HA GLU 45 HA GLU 45 1.074 -12.026 -9.187 380 HB2 GLU 45 1HB GLU 45 3.045 -12.638 -10.703 381 HB3 GLU 45 2HB GLU 45 2.099 -14.027 -11.215 382 HG2 GLU 45 1HG GLU 45 1.082 -11.169 -11.375 383 HG3 GLU 45 2HG GLU 45 1.896 -11.982 -12.705 384 H GLY 46 H GLY 46 -1.034 -12.211 -9.463 385 HA2 GLY 46 1HA GLY 46 -3.096 -13.146 -10.060 386 HA3 GLY 46 2HA GLY 46 -2.314 -14.703 -10.285 387 H SER 47 H SER 47 -1.357 -13.455 -7.335 388 HA SER 47 HA SER 47 -2.935 -15.388 -5.887 389 HB2 SER 47 1HB SER 47 -0.662 -14.951 -5.202 390 HB3 SER 47 2HB SER 47 -1.020 -13.252 -4.938 391 HG SER 47 HG SER 47 -2.407 -15.360 -3.643 392 H GLN 48 H GLN 48 -4.710 -15.106 -4.712 393 HA GLN 48 HA GLN 48 -6.120 -12.562 -4.855 394 HB2 GLN 48 1HB GLN 48 -7.265 -14.804 -5.060 395 HB3 GLN 48 2HB GLN 48 -6.913 -15.078 -3.355 396 HG2 GLN 48 1HG GLN 48 -9.158 -14.201 -3.501 397 HG3 GLN 48 2HG GLN 48 -8.142 -12.924 -2.843 398 HE21 GLN 48 2HE2 GLN 48 -9.284 -11.096 -3.669 399 HE22 GLN 48 1HE2 GLN 48 -9.481 -10.803 -5.330 400 H ILE 49 H ILE 49 -6.613 -11.242 -3.096 401 HA ILE 49 HA ILE 49 -5.270 -11.833 -0.510 402 HB ILE 49 HB ILE 49 -3.816 -10.322 -1.821 403 HG12 ILE 49 1HG1 ILE 49 -5.176 -8.852 0.465 404 HG13 ILE 49 2HG1 ILE 49 -4.046 -10.185 0.706 405 HG21 ILE 49 1HG2 ILE 49 -6.103 -8.339 -1.655 406 HG22 ILE 49 2HG2 ILE 49 -5.701 -9.253 -3.104 407 HG23 ILE 49 3HG2 ILE 49 -4.542 -8.108 -2.440 408 HD11 ILE 49 3HD1 ILE 49 -2.839 -8.079 0.890 409 HD12 ILE 49 1HD1 ILE 49 -3.450 -7.553 -0.677 410 HD13 ILE 49 2HD1 ILE 49 -2.327 -8.908 -0.578 411 H VAL 50 H VAL 50 -6.397 -11.397 1.239 412 HA VAL 50 HA VAL 50 -8.743 -9.597 1.103 413 HB VAL 50 HB VAL 50 -9.687 -11.790 0.707 414 HG11 VAL 50 1HG1 VAL 50 -9.326 -13.644 2.301 415 HG12 VAL 50 2HG1 VAL 50 -8.178 -12.646 3.192 416 HG13 VAL 50 3HG1 VAL 50 -7.819 -13.139 1.536 417 HG21 VAL 50 3HG2 VAL 50 -11.263 -11.884 2.514 418 HG22 VAL 50 1HG2 VAL 50 -10.786 -10.193 2.383 419 HG23 VAL 50 2HG2 VAL 50 -10.109 -11.202 3.658 420 H TRP 51 H TRP 51 -9.356 -8.714 3.058 421 HA TRP 51 HA TRP 51 -7.527 -9.129 5.373 422 HB2 TRP 51 1HB TRP 51 -8.667 -6.457 4.507 423 HB3 TRP 51 2HB TRP 51 -7.496 -6.762 5.781 424 HD1 TRP 51 HD1 TRP 51 -5.505 -8.660 4.234 425 HE1 TRP 51 HE1 TRP 51 -4.027 -7.705 2.354 426 HE3 TRP 51 HE3 TRP 51 -8.192 -4.495 3.057 427 HZ2 TRP 51 HZ2 TRP 51 -3.992 -5.458 0.580 428 HZ3 TRP 51 HZ3 TRP 51 -7.421 -2.962 1.271 429 HH2 TRP 51 HH2 TRP 51 -5.326 -3.436 0.030 430 H LYS 52 H LYS 52 -8.498 -9.288 7.309 431 HA LYS 52 HA LYS 52 -11.465 -9.059 7.389 432 HB2 LYS 52 1HB LYS 52 -10.454 -11.272 7.988 433 HB3 LYS 52 2HB LYS 52 -9.638 -10.491 9.342 434 HG2 LYS 52 1HG LYS 52 -11.801 -9.807 10.288 435 HG3 LYS 52 2HG LYS 52 -12.643 -10.494 8.900 436 HD2 LYS 52 1HD LYS 52 -11.802 -12.734 9.490 437 HD3 LYS 52 2HD LYS 52 -10.947 -12.048 10.873 438 HE2 LYS 52 1HE LYS 52 -13.066 -12.978 11.640 439 HE3 LYS 52 2HE LYS 52 -13.130 -11.221 11.763 440 HZ1 LYS 52 3HZ LYS 52 -15.139 -11.922 10.770 441 HZ2 LYS 52 1HZ LYS 52 -14.340 -12.929 9.663 442 HZ3 LYS 52 2HZ LYS 52 -14.207 -11.242 9.523 443 H GLY 53 H GLY 53 -12.381 -7.523 8.559 444 HA2 GLY 53 1HA GLY 53 -11.033 -6.315 10.858 445 HA3 GLY 53 2HA GLY 53 -11.314 -5.247 9.485 446 H GLU 54 H GLU 54 -12.493 -4.340 11.557 447 HA GLU 54 HA GLU 54 -15.362 -5.036 11.274 448 HB2 GLU 54 1HB GLU 54 -14.428 -6.033 13.367 449 HB3 GLU 54 2HB GLU 54 -13.992 -4.410 13.898 450 HG2 GLU 54 1HG GLU 54 -16.337 -3.717 13.824 451 HG3 GLU 54 2HG GLU 54 -16.804 -5.291 13.182 452 H TRP 55 H TRP 55 -16.660 -3.348 11.037 453 HA TRP 55 HA TRP 55 -15.738 -0.626 11.751 454 HB2 TRP 55 1HB TRP 55 -15.119 -0.889 9.418 455 HB3 TRP 55 2HB TRP 55 -16.715 -1.510 9.019 456 HD1 TRP 55 HD1 TRP 55 -15.343 1.691 10.734 457 HE1 TRP 55 HE1 TRP 55 -16.664 3.710 9.826 458 HE3 TRP 55 HE3 TRP 55 -18.550 -0.708 7.568 459 HZ2 TRP 55 HZ2 TRP 55 -18.800 4.237 7.998 460 HZ3 TRP 55 HZ3 TRP 55 -20.217 0.575 6.256 461 HH2 TRP 55 HH2 TRP 55 -20.345 3.041 6.468 462 H LYS 56 H LYS 56 -17.267 0.367 12.857 463 HA LYS 56 HA LYS 56 -19.305 0.857 13.806 464 HB2 LYS 56 1HB LYS 56 -20.167 0.282 10.962 465 HB3 LYS 56 2HB LYS 56 -21.188 1.068 12.163 466 HG2 LYS 56 1HG LYS 56 -18.458 2.159 11.407 467 HG3 LYS 56 2HG LYS 56 -19.917 2.609 10.530 468 HD2 LYS 56 1HD LYS 56 -20.918 3.396 12.693 469 HD3 LYS 56 2HD LYS 56 -19.376 3.082 13.484 470 HE2 LYS 56 1HE LYS 56 -19.749 4.940 11.126 471 HE3 LYS 56 2HE LYS 56 -19.579 5.452 12.805 472 HZ1 LYS 56 3HZ LYS 56 -17.563 4.722 10.956 473 HZ2 LYS 56 1HZ LYS 56 -17.496 3.704 12.312 474 HZ3 LYS 56 2HZ LYS 56 -17.397 5.388 12.511 475 H GLY 57 H GLY 57 -18.410 -1.831 14.092 476 HA2 GLY 57 1HA GLY 57 -19.246 -3.753 15.091 477 HA3 GLY 57 2HA GLY 57 -20.863 -3.066 14.967 478 H LYS 58 H LYS 58 -19.751 -2.732 11.963 479 HA LYS 58 HA LYS 58 -20.980 -5.263 11.063 480 HB2 LYS 58 1HB LYS 58 -21.961 -3.233 10.141 481 HB3 LYS 58 2HB LYS 58 -20.385 -2.681 9.594 482 HG2 LYS 58 1HG LYS 58 -21.726 -3.646 7.746 483 HG3 LYS 58 2HG LYS 58 -20.239 -4.549 8.002 484 HD2 LYS 58 1HD LYS 58 -21.397 -6.343 9.095 485 HD3 LYS 58 2HD LYS 58 -22.867 -5.384 9.275 486 HE2 LYS 58 1HE LYS 58 -23.129 -6.997 7.453 487 HE3 LYS 58 2HE LYS 58 -23.095 -5.363 6.787 488 HZ1 LYS 58 3HZ LYS 58 -21.162 -5.742 5.752 489 HZ2 LYS 58 1HZ LYS 58 -21.536 -7.385 5.952 490 HZ3 LYS 58 2HZ LYS 58 -20.504 -6.610 7.055 491 H ALA 59 H ALA 59 -19.633 -6.866 10.617 492 HA ALA 59 HA ALA 59 -16.831 -6.532 10.183 493 HB1 ALA 59 3HB ALA 59 -18.614 -8.929 9.709 494 HB2 ALA 59 1HB ALA 59 -17.738 -8.566 11.195 495 HB3 ALA 59 2HB ALA 59 -16.851 -8.957 9.722 496 H TYR 60 H TYR 60 -15.710 -6.313 8.329 497 HA TYR 60 HA TYR 60 -17.082 -6.780 5.732 498 HB2 TYR 60 1HB TYR 60 -16.378 -4.675 4.855 499 HB3 TYR 60 2HB TYR 60 -17.150 -4.334 6.400 500 HD1 TYR 60 HD1 TYR 60 -15.614 -4.216 8.500 501 HD2 TYR 60 HD2 TYR 60 -14.156 -3.909 4.469 502 HE1 TYR 60 HE1 TYR 60 -13.527 -3.164 9.330 503 HE2 TYR 60 HE2 TYR 60 -12.083 -2.854 5.296 504 HH TYR 60 HH TYR 60 -11.519 -2.389 8.789 505 H GLU 61 H GLU 61 -15.698 -7.170 3.966 506 HA GLU 61 HA GLU 61 -12.849 -7.678 4.589 507 HB2 GLU 61 1HB GLU 61 -12.952 -9.848 3.484 508 HB3 GLU 61 2HB GLU 61 -14.056 -9.810 4.857 509 HG2 GLU 61 1HG GLU 61 -15.909 -9.221 3.235 510 HG3 GLU 61 2HG GLU 61 -14.771 -9.521 1.924 511 H ASP 62 H ASP 62 -11.509 -7.066 3.065 512 HA ASP 62 HA ASP 62 -12.560 -5.841 0.605 513 HB2 ASP 62 1HB ASP 62 -9.804 -5.870 1.873 514 HB3 ASP 62 2HB ASP 62 -10.202 -5.036 0.371 515 H LYS 63 H LYS 63 -11.245 -6.283 -1.443 516 HA LYS 63 HA LYS 63 -9.945 -8.887 -1.579 517 HB2 LYS 63 1HB LYS 63 -11.559 -9.835 -3.195 518 HB3 LYS 63 2HB LYS 63 -12.264 -9.587 -1.603 519 HG2 LYS 63 1HG LYS 63 -13.225 -7.424 -2.407 520 HG3 LYS 63 2HG LYS 63 -12.600 -7.780 -4.016 521 HD2 LYS 63 1HD LYS 63 -13.921 -9.863 -4.077 522 HD3 LYS 63 2HD LYS 63 -14.562 -9.497 -2.475 523 HE2 LYS 63 1HE LYS 63 -15.574 -7.429 -3.328 524 HE3 LYS 63 2HE LYS 63 -14.898 -7.745 -4.927 525 HZ1 LYS 63 3HZ LYS 63 -16.823 -8.787 -5.292 526 HZ2 LYS 63 1HZ LYS 63 -17.200 -8.907 -3.642 527 HZ3 LYS 63 2HZ LYS 63 -16.170 -10.050 -4.364 528 H GLY 64 H GLY 64 -8.517 -9.001 -3.151 529 HA2 GLY 64 1HA GLY 64 -8.800 -7.582 -5.667 530 HA3 GLY 64 2HA GLY 64 -7.535 -6.944 -4.618 531 H THR 65 H THR 65 -6.375 -7.731 -6.720 532 HA THR 65 HA THR 65 -5.143 -10.331 -6.074 533 HB THR 65 HB THR 65 -6.189 -9.706 -8.847 534 HG1 THR 65 HG1 THR 65 -7.430 -10.641 -6.705 535 HG21 THR 65 3HG2 THR 65 -5.642 -12.163 -9.163 536 HG22 THR 65 1HG2 THR 65 -4.785 -12.099 -7.624 537 HG23 THR 65 2HG2 THR 65 -4.241 -11.109 -8.979 538 H ILE 66 H ILE 66 -3.110 -10.670 -7.054 539 HA ILE 66 HA ILE 66 -1.557 -8.248 -7.314 540 HB ILE 66 HB ILE 66 -0.694 -11.096 -7.863 541 HG12 ILE 66 1HG1 ILE 66 -1.666 -10.996 -5.632 542 HG13 ILE 66 2HG1 ILE 66 0.084 -11.112 -5.502 543 HG21 ILE 66 1HG2 ILE 66 0.813 -8.558 -7.186 544 HG22 ILE 66 2HG2 ILE 66 0.913 -9.499 -8.675 545 HG23 ILE 66 3HG2 ILE 66 1.535 -10.165 -7.165 546 HD11 ILE 66 3HD1 ILE 66 -0.460 -9.445 -3.940 547 HD12 ILE 66 1HD1 ILE 66 -1.695 -8.735 -4.976 548 HD13 ILE 66 2HD1 ILE 66 0.014 -8.494 -5.345 549 H LEU 67 H LEU 67 -1.352 -7.118 -9.115 550 HA LEU 67 HA LEU 67 -2.173 -8.149 -11.690 551 HB2 LEU 67 1HB LEU 67 -2.487 -5.756 -10.912 552 HB3 LEU 67 2HB LEU 67 -0.748 -5.547 -11.088 553 HG LEU 67 HG LEU 67 -1.128 -6.429 -13.549 554 HD11 LEU 67 1HD1 LEU 67 -3.374 -5.767 -14.440 555 HD12 LEU 67 2HD1 LEU 67 -3.926 -5.521 -12.785 556 HD13 LEU 67 3HD1 LEU 67 -3.460 -7.130 -13.332 557 HD21 LEU 67 3HD2 LEU 67 -1.647 -4.117 -14.301 558 HD22 LEU 67 1HD2 LEU 67 -0.435 -4.139 -13.020 559 HD23 LEU 67 2HD2 LEU 67 -2.102 -3.700 -12.648 560 H GLN 68 H GLN 68 0.901 -7.061 -10.286 561 HA GLN 68 HA GLN 68 2.375 -8.863 -12.116 562 HB2 GLN 68 1HB GLN 68 2.938 -5.906 -11.723 563 HB3 GLN 68 2HB GLN 68 4.066 -7.035 -12.475 564 HG2 GLN 68 1HG GLN 68 2.371 -7.590 -14.182 565 HG3 GLN 68 2HG GLN 68 1.258 -6.442 -13.443 566 HE21 GLN 68 2HE2 GLN 68 1.543 -5.637 -15.878 567 HE22 GLN 68 1HE2 GLN 68 2.744 -4.456 -16.101 568 H PHE 69 H PHE 69 4.397 -9.527 -11.301 569 HA PHE 69 HA PHE 69 5.149 -8.662 -8.586 570 HB2 PHE 69 1HB PHE 69 3.564 -10.548 -8.299 571 HB3 PHE 69 2HB PHE 69 4.626 -11.563 -9.266 572 HD1 PHE 69 HD1 PHE 69 4.284 -9.707 -6.080 573 HD2 PHE 69 HD2 PHE 69 6.746 -12.371 -8.379 574 HE1 PHE 69 HE1 PHE 69 5.671 -10.156 -4.074 575 HE2 PHE 69 HE2 PHE 69 8.128 -12.826 -6.374 576 HZ PHE 69 HZ PHE 69 7.592 -11.718 -4.221 577 H ASN 70 H ASN 70 7.109 -7.909 -9.212 578 HA ASN 70 HA ASN 70 9.043 -9.899 -10.313 579 HB2 ASN 70 1HB ASN 70 8.436 -8.087 -11.956 580 HB3 ASN 70 2HB ASN 70 9.088 -6.916 -10.814 581 HD21 ASN 70 2HD2 ASN 70 10.208 -7.407 -13.463 582 HD22 ASN 70 1HD2 ASN 70 11.777 -8.018 -13.236 583 H GLU 71 H GLU 71 10.165 -10.471 -8.595 584 HA GLU 71 HA GLU 71 10.567 -9.369 -6.174 585 HB2 GLU 71 1HB GLU 71 12.762 -10.520 -6.091 586 HB3 GLU 71 2HB GLU 71 11.487 -11.531 -6.767 587 HG2 GLU 71 1HG GLU 71 12.254 -10.860 -9.062 588 HG3 GLU 71 2HG GLU 71 13.603 -10.013 -8.315 589 H ARG 72 H ARG 72 11.554 -7.720 -5.252 590 HA ARG 72 HA ARG 72 12.401 -5.566 -5.147 591 HB2 ARG 72 1HB ARG 72 14.887 -5.579 -5.501 592 HB3 ARG 72 2HB ARG 72 14.291 -6.867 -4.463 593 HG2 ARG 72 1HG ARG 72 14.456 -8.486 -6.258 594 HG3 ARG 72 2HG ARG 72 14.852 -7.224 -7.425 595 HD2 ARG 72 1HD ARG 72 16.884 -8.381 -6.721 596 HD3 ARG 72 2HD ARG 72 16.908 -6.722 -6.122 597 HE ARG 72 HE ARG 72 15.741 -8.460 -4.196 598 HH11 ARG 72 1HH2 ARG 72 18.738 -7.562 -5.658 599 HH12 ARG 72 2HH2 ARG 72 19.691 -7.949 -4.260 600 HH21 ARG 72 1HH1 ARG 72 16.959 -8.966 -2.374 601 HH22 ARG 72 2HH1 ARG 72 18.679 -8.747 -2.392 602 H SER 73 H SER 73 10.869 -5.332 -7.313 603 HA SER 73 HA SER 73 12.458 -3.579 -9.042 604 HB2 SER 73 1HB SER 73 11.167 -6.119 -10.005 605 HB3 SER 73 2HB SER 73 11.400 -4.762 -11.102 606 HG SER 73 HG SER 73 13.655 -4.837 -10.232 607 H ILE 74 H ILE 74 9.233 -5.136 -9.238 608 HA ILE 74 HA ILE 74 7.960 -2.534 -8.800 609 HB ILE 74 HB ILE 74 8.565 -2.917 -11.338 610 HG12 ILE 74 1HG1 ILE 74 5.753 -2.160 -10.480 611 HG13 ILE 74 2HG1 ILE 74 7.144 -1.079 -10.488 612 HG21 ILE 74 1HG2 ILE 74 7.483 -5.259 -11.262 613 HG22 ILE 74 2HG2 ILE 74 7.067 -4.241 -12.634 614 HG23 ILE 74 3HG2 ILE 74 5.931 -4.425 -11.295 615 HD11 ILE 74 3HD1 ILE 74 5.943 -0.647 -12.511 616 HD12 ILE 74 1HD1 ILE 74 5.792 -2.365 -12.870 617 HD13 ILE 74 2HD1 ILE 74 7.368 -1.577 -12.974 618 H LEU 75 H LEU 75 5.982 -2.655 -7.944 619 HA LEU 75 HA LEU 75 4.627 -5.303 -7.896 620 HB2 LEU 75 1HB LEU 75 5.949 -4.444 -5.714 621 HB3 LEU 75 2HB LEU 75 4.476 -3.520 -5.469 622 HG LEU 75 HG LEU 75 4.209 -5.613 -4.294 623 HD11 LEU 75 1HD1 LEU 75 2.153 -6.333 -5.168 624 HD12 LEU 75 2HD1 LEU 75 2.650 -6.069 -6.840 625 HD13 LEU 75 3HD1 LEU 75 2.309 -4.696 -5.793 626 HD21 LEU 75 3HD2 LEU 75 4.948 -7.659 -5.030 627 HD22 LEU 75 1HD2 LEU 75 5.938 -6.731 -6.150 628 HD23 LEU 75 2HD2 LEU 75 4.398 -7.397 -6.683 629 H GLN 76 H GLN 76 2.674 -5.181 -8.706 630 HA GLN 76 HA GLN 76 1.065 -2.710 -8.363 631 HB2 GLN 76 1HB GLN 76 1.302 -4.322 -10.914 632 HB3 GLN 76 2HB GLN 76 0.273 -2.910 -10.666 633 HG2 GLN 76 1HG GLN 76 2.290 -1.543 -10.209 634 HG3 GLN 76 2HG GLN 76 3.301 -2.950 -10.512 635 HE21 GLN 76 2HE2 GLN 76 1.953 -0.229 -11.987 636 HE22 GLN 76 1HE2 GLN 76 2.090 -0.728 -13.604 637 H TYR 77 H TYR 77 -1.023 -3.042 -7.811 638 HA TYR 77 HA TYR 77 -2.231 -5.687 -8.231 639 HB2 TYR 77 1HB TYR 77 -2.926 -5.878 -5.857 640 HB3 TYR 77 2HB TYR 77 -1.186 -6.009 -6.076 641 HD1 TYR 77 HD2 TYR 77 -3.900 -3.550 -5.196 642 HD2 TYR 77 HD1 TYR 77 0.263 -4.543 -4.890 643 HE1 TYR 77 HE2 TYR 77 -3.552 -1.656 -3.643 644 HE2 TYR 77 HE1 TYR 77 0.612 -2.653 -3.342 645 HH TYR 77 HH TYR 77 -1.870 -0.273 -2.776 646 H SER 78 H SER 78 -4.462 -5.788 -7.882 647 HA SER 78 HA SER 78 -5.847 -3.191 -8.243 648 HB2 SER 78 1HB SER 78 -7.666 -4.503 -9.179 649 HB3 SER 78 2HB SER 78 -6.172 -4.969 -9.982 650 HG SER 78 HG SER 78 -6.095 -6.801 -8.724 651 H HIS 79 H HIS 79 -7.727 -2.758 -6.961 652 HA HIS 79 HA HIS 79 -8.354 -4.566 -4.761 653 HB2 HIS 79 1HB HIS 79 -6.647 -2.148 -4.419 654 HB3 HIS 79 2HB HIS 79 -7.947 -2.291 -3.241 655 HD1 HIS 79 HD1 HIS 79 -4.578 -3.173 -3.517 656 HD2 HIS 79 HD2 HIS 79 -7.943 -5.322 -2.352 657 HE1 HIS 79 HE1 HIS 79 -3.730 -5.187 -2.243 658 HE2 HIS 79 HE2 HIS 79 -5.773 -6.508 -1.514 659 H PHE 80 H PHE 80 -10.192 -4.064 -3.598 660 HA PHE 80 HA PHE 80 -11.882 -1.855 -4.569 661 HB2 PHE 80 1HB PHE 80 -12.531 -3.640 -6.040 662 HB3 PHE 80 2HB PHE 80 -12.597 -4.797 -4.714 663 HD1 PHE 80 HD1 PHE 80 -14.206 -1.781 -6.168 664 HD2 PHE 80 HD2 PHE 80 -14.543 -4.941 -3.280 665 HE1 PHE 80 HE1 PHE 80 -16.568 -1.160 -5.768 666 HE2 PHE 80 HE2 PHE 80 -16.908 -4.322 -2.879 667 HZ PHE 80 HZ PHE 80 -17.921 -2.428 -4.120 668 H SER 81 H SER 81 -13.015 -0.953 -2.990 669 HA SER 81 HA SER 81 -13.014 -2.222 -0.317 670 HB2 SER 81 1HB SER 81 -11.976 -0.011 -0.460 671 HB3 SER 81 2HB SER 81 -13.479 0.666 -1.074 672 HG SER 81 HG SER 81 -12.902 0.622 1.359 673 HA PRO 82 HA PRO 82 -17.443 -2.623 -1.269 674 HB2 PRO 82 1HB PRO 82 -18.212 -4.124 0.904 675 HB3 PRO 82 2HB PRO 82 -17.373 -4.815 -0.501 676 HG2 PRO 82 1HG PRO 82 -16.266 -4.061 2.175 677 HG3 PRO 82 2HG PRO 82 -15.878 -5.449 1.146 678 HD2 PRO 82 1HD PRO 82 -14.312 -3.172 1.311 679 HD3 PRO 82 2HD PRO 82 -14.323 -4.248 -0.104 680 H LEU 83 H LEU 83 -15.996 -1.209 1.517 681 HA LEU 83 HA LEU 83 -18.288 -0.318 2.912 682 HB2 LEU 83 1HB LEU 83 -15.604 1.069 2.706 683 HB3 LEU 83 2HB LEU 83 -16.794 1.254 3.994 684 HG LEU 83 HG LEU 83 -15.376 -1.341 3.301 685 HD11 LEU 83 1HD1 LEU 83 -13.817 0.282 4.236 686 HD12 LEU 83 2HD1 LEU 83 -14.194 -0.922 5.468 687 HD13 LEU 83 3HD1 LEU 83 -14.946 0.670 5.535 688 HD21 LEU 83 3HD2 LEU 83 -17.427 -1.949 4.327 689 HD22 LEU 83 1HD2 LEU 83 -17.410 -0.564 5.420 690 HD23 LEU 83 2HD2 LEU 83 -16.302 -1.912 5.674 691 H THR 84 H THR 84 -17.243 0.444 -0.161 692 HA THR 84 HA THR 84 -17.808 3.218 -0.320 693 HB THR 84 HB THR 84 -18.044 2.758 -2.791 694 HG1 THR 84 HG1 THR 84 -17.136 0.349 -2.927 695 HG21 THR 84 3HG2 THR 84 -15.854 3.276 -1.950 696 HG22 THR 84 1HG2 THR 84 -15.678 1.898 -3.036 697 HG23 THR 84 2HG2 THR 84 -15.656 1.652 -1.289 698 H GLY 85 H GLY 85 -19.841 0.361 -0.497 699 HA2 GLY 85 1HA GLY 85 -22.139 0.140 -0.378 700 HA3 GLY 85 2HA GLY 85 -22.225 1.858 -0.005 701 H LYS 86 H LYS 86 -20.472 1.200 -2.836 702 HA LYS 86 HA LYS 86 -22.615 2.336 -4.474 703 HB2 LYS 86 1HB LYS 86 -19.684 1.763 -4.963 704 HB3 LYS 86 2HB LYS 86 -20.750 2.397 -6.213 705 HG2 LYS 86 1HG LYS 86 -21.301 4.320 -4.706 706 HG3 LYS 86 2HG LYS 86 -20.124 3.703 -3.546 707 HD2 LYS 86 1HD LYS 86 -18.377 3.840 -5.347 708 HD3 LYS 86 2HD LYS 86 -19.568 4.624 -6.382 709 HE2 LYS 86 1HE LYS 86 -18.261 6.363 -5.335 710 HE3 LYS 86 2HE LYS 86 -19.850 6.371 -4.572 711 HZ1 LYS 86 3HZ LYS 86 -18.503 6.371 -2.749 712 HZ2 LYS 86 1HZ LYS 86 -17.275 5.475 -3.500 713 HZ3 LYS 86 2HZ LYS 86 -18.685 4.696 -2.962 714 HA PRO 87 HA PRO 87 -23.690 -1.579 -6.320 715 HB2 PRO 87 1HB PRO 87 -24.536 -0.796 -8.827 716 HB3 PRO 87 2HB PRO 87 -25.479 -0.488 -7.352 717 HG2 PRO 87 1HG PRO 87 -23.625 1.365 -8.817 718 HG3 PRO 87 2HG PRO 87 -25.250 1.683 -8.176 719 HD2 PRO 87 1HD PRO 87 -23.031 2.450 -6.821 720 HD3 PRO 87 2HD PRO 87 -24.482 1.886 -5.965 721 H ASP 88 H ASP 88 -23.298 -2.782 -8.563 722 HA ASP 88 HA ASP 88 -20.603 -3.365 -8.808 723 HB2 ASP 88 1HB ASP 88 -21.218 -4.534 -10.883 724 HB3 ASP 88 2HB ASP 88 -22.372 -4.851 -9.589 725 H LEU 89 H LEU 89 -19.420 -1.436 -8.994 726 HA LEU 89 HA LEU 89 -19.302 -0.314 -11.751 727 HB2 LEU 89 1HB LEU 89 -19.209 1.214 -9.147 728 HB3 LEU 89 2HB LEU 89 -18.784 1.901 -10.713 729 HG LEU 89 HG LEU 89 -21.479 0.626 -10.117 730 HD11 LEU 89 1HD1 LEU 89 -20.634 3.538 -10.053 731 HD12 LEU 89 2HD1 LEU 89 -21.236 2.583 -8.699 732 HD13 LEU 89 3HD1 LEU 89 -22.312 2.992 -10.034 733 HD21 LEU 89 3HD2 LEU 89 -20.339 2.169 -12.469 734 HD22 LEU 89 1HD2 LEU 89 -22.077 2.148 -12.166 735 HD23 LEU 89 2HD2 LEU 89 -21.226 0.645 -12.474 736 HA PRO 90 HA PRO 90 -15.188 -2.092 -10.567 737 HB2 PRO 90 1HB PRO 90 -14.905 -1.762 -13.551 738 HB3 PRO 90 2HB PRO 90 -14.445 -3.141 -12.526 739 HG2 PRO 90 1HG PRO 90 -16.629 -3.252 -14.046 740 HG3 PRO 90 2HG PRO 90 -16.625 -3.947 -12.412 741 HD2 PRO 90 1HD PRO 90 -17.861 -1.366 -13.356 742 HD3 PRO 90 2HD PRO 90 -18.460 -2.524 -12.147 743 H GLU 91 H GLU 91 -15.968 0.645 -12.653 744 HA GLU 91 HA GLU 91 -13.387 1.855 -12.644 745 HB2 GLU 91 1HB GLU 91 -16.152 2.991 -13.142 746 HB3 GLU 91 2HB GLU 91 -14.656 3.888 -13.401 747 HG2 GLU 91 1HG GLU 91 -13.904 2.243 -15.039 748 HG3 GLU 91 2HG GLU 91 -15.323 1.246 -14.731 749 H ASN 92 H ASN 92 -15.524 1.355 -10.167 750 HA ASN 92 HA ASN 92 -15.470 3.827 -8.776 751 HB2 ASN 92 1HB ASN 92 -17.133 2.090 -8.315 752 HB3 ASN 92 2HB ASN 92 -15.861 1.015 -7.744 753 HD21 ASN 92 2HD2 ASN 92 -15.886 4.503 -7.056 754 HD22 ASN 92 1HD2 ASN 92 -16.156 4.336 -5.387 755 H TYR 93 H TYR 93 -13.351 0.998 -8.712 756 HA TYR 93 HA TYR 93 -11.680 2.261 -6.623 757 HB2 TYR 93 1HB TYR 93 -10.727 0.138 -6.231 758 HB3 TYR 93 2HB TYR 93 -12.457 -0.116 -6.374 759 HD1 TYR 93 HD1 TYR 93 -13.413 -1.279 -8.348 760 HD2 TYR 93 HD2 TYR 93 -9.184 -0.662 -7.952 761 HE1 TYR 93 HE1 TYR 93 -12.995 -2.951 -10.131 762 HE2 TYR 93 HE2 TYR 93 -8.770 -2.325 -9.733 763 HH TYR 93 HH TYR 93 -11.467 -4.042 -11.310 764 H HIS 94 H HIS 94 -9.261 1.617 -6.918 765 HA HIS 94 HA HIS 94 -8.369 2.214 -9.690 766 HB2 HIS 94 1HB HIS 94 -6.512 3.619 -8.367 767 HB3 HIS 94 2HB HIS 94 -8.046 4.346 -8.814 768 HD1 HIS 94 HD1 HIS 94 -8.553 5.852 -6.895 769 HD2 HIS 94 HD2 HIS 94 -7.408 2.051 -5.617 770 HE1 HIS 94 HE1 HIS 94 -8.888 5.815 -4.389 771 HE2 HIS 94 HE2 HIS 94 -8.184 3.507 -3.588 772 H VAL 95 H VAL 95 -6.159 1.749 -10.096 773 HA VAL 95 HA VAL 95 -5.230 -0.661 -8.632 774 HB VAL 95 HB VAL 95 -4.352 0.327 -11.365 775 HG11 VAL 95 1HG1 VAL 95 -2.809 -1.232 -10.218 776 HG12 VAL 95 2HG1 VAL 95 -3.576 -2.005 -11.605 777 HG13 VAL 95 3HG1 VAL 95 -4.139 -2.365 -9.975 778 HG21 VAL 95 3HG2 VAL 95 -6.746 -0.138 -11.442 779 HG22 VAL 95 1HG2 VAL 95 -6.509 -1.664 -10.589 780 HG23 VAL 95 2HG2 VAL 95 -5.883 -1.462 -12.225 781 H VAL 96 H VAL 96 -3.738 -0.272 -7.177 782 HA VAL 96 HA VAL 96 -2.026 2.092 -7.295 783 HB VAL 96 HB VAL 96 -2.032 -0.138 -5.257 784 HG11 VAL 96 1HG1 VAL 96 -1.053 1.638 -3.812 785 HG12 VAL 96 2HG1 VAL 96 -1.005 2.708 -5.211 786 HG13 VAL 96 3HG1 VAL 96 -0.023 1.244 -5.188 787 HG21 VAL 96 3HG2 VAL 96 -3.459 1.436 -3.937 788 HG22 VAL 96 1HG2 VAL 96 -4.260 0.850 -5.395 789 HG23 VAL 96 2HG2 VAL 96 -3.567 2.472 -5.362 790 H THR 97 H THR 97 0.066 2.157 -7.812 791 HA THR 97 HA THR 97 1.501 -0.389 -8.345 792 HB THR 97 HB THR 97 0.966 0.475 -10.512 793 HG1 THR 97 HG1 THR 97 3.514 1.558 -10.168 794 HG21 THR 97 3HG2 THR 97 2.132 3.137 -9.664 795 HG22 THR 97 1HG2 THR 97 0.402 2.802 -9.731 796 HG23 THR 97 2HG2 THR 97 1.370 2.749 -11.203 797 H ILE 98 H ILE 98 3.227 -0.625 -7.192 798 HA ILE 98 HA ILE 98 4.532 1.740 -5.956 799 HB ILE 98 HB ILE 98 4.892 -1.164 -5.182 800 HG12 ILE 98 1HG1 ILE 98 2.518 -0.708 -4.982 801 HG13 ILE 98 2HG1 ILE 98 3.233 -0.714 -3.374 802 HG21 ILE 98 1HG2 ILE 98 6.598 0.400 -4.371 803 HG22 ILE 98 2HG2 ILE 98 5.594 -0.160 -3.033 804 HG23 ILE 98 3HG2 ILE 98 5.342 1.448 -3.711 805 HD11 ILE 98 3HD1 ILE 98 2.343 1.666 -5.009 806 HD12 ILE 98 1HD1 ILE 98 3.418 1.848 -3.623 807 HD13 ILE 98 2HD1 ILE 98 1.803 1.178 -3.407 808 H THR 99 H THR 99 6.477 2.319 -6.603 809 HA THR 99 HA THR 99 8.133 0.428 -8.230 810 HB THR 99 HB THR 99 8.070 3.455 -8.386 811 HG1 THR 99 HG1 THR 99 6.333 1.817 -9.287 812 HG21 THR 99 3HG2 THR 99 9.394 2.994 -10.486 813 HG22 THR 99 1HG2 THR 99 9.523 1.314 -9.970 814 HG23 THR 99 2HG2 THR 99 10.249 2.595 -8.998 815 H LEU 100 H LEU 100 10.019 -0.120 -7.374 816 HA LEU 100 HA LEU 100 11.303 1.670 -5.375 817 HB2 LEU 100 1HB LEU 100 10.836 -1.317 -5.237 818 HB3 LEU 100 2HB LEU 100 12.047 -0.515 -4.239 819 HG LEU 100 HG LEU 100 9.201 0.534 -4.259 820 HD11 LEU 100 1HD1 LEU 100 8.733 -0.933 -2.285 821 HD12 LEU 100 2HD1 LEU 100 10.231 -1.800 -2.628 822 HD13 LEU 100 3HD1 LEU 100 8.911 -1.826 -3.794 823 HD21 LEU 100 3HD2 LEU 100 11.004 1.829 -3.088 824 HD22 LEU 100 1HD2 LEU 100 11.325 0.414 -2.085 825 HD23 LEU 100 2HD2 LEU 100 9.772 1.239 -1.979 826 H THR 101 H THR 101 13.268 2.217 -5.871 827 HA THR 101 HA THR 101 14.937 0.441 -7.586 828 HB THR 101 HB THR 101 15.839 2.484 -8.656 829 HG1 THR 101 HG1 THR 101 14.484 4.390 -8.337 830 HG21 THR 101 3HG2 THR 101 13.967 2.858 -10.127 831 HG22 THR 101 1HG2 THR 101 12.823 2.366 -8.879 832 HG23 THR 101 2HG2 THR 101 13.895 1.172 -9.613 833 H ALA 102 H ALA 102 16.851 0.001 -6.769 834 HA ALA 102 HA ALA 102 17.725 1.352 -4.305 835 HB1 ALA 102 3HB ALA 102 19.279 -0.470 -4.073 836 HB2 ALA 102 1HB ALA 102 18.964 -1.020 -5.719 837 HB3 ALA 102 2HB ALA 102 17.704 -1.144 -4.490 838 H LEU 103 H LEU 103 18.793 3.193 -4.648 839 HA LEU 103 HA LEU 103 20.661 3.450 -6.919 840 HB2 LEU 103 1HB LEU 103 19.876 5.606 -4.940 841 HB3 LEU 103 2HB LEU 103 20.518 5.798 -6.573 842 HG LEU 103 HG LEU 103 17.787 4.729 -5.799 843 HD11 LEU 103 1HD1 LEU 103 16.996 6.701 -7.052 844 HD12 LEU 103 2HD1 LEU 103 18.665 7.181 -7.353 845 HD13 LEU 103 3HD1 LEU 103 18.033 7.172 -5.705 846 HD21 LEU 103 3HD2 LEU 103 19.201 4.821 -8.487 847 HD22 LEU 103 1HD2 LEU 103 17.441 4.740 -8.354 848 HD23 LEU 103 2HD2 LEU 103 18.435 3.436 -7.710 849 H LYS 104 H LYS 104 22.658 4.791 -6.350 850 HA LYS 104 HA LYS 104 24.334 3.275 -4.680 851 HB2 LYS 104 1HB LYS 104 24.691 6.024 -5.890 852 HB3 LYS 104 2HB LYS 104 25.977 5.147 -5.060 853 HG2 LYS 104 1HG LYS 104 25.718 3.271 -6.650 854 HG3 LYS 104 2HG LYS 104 24.451 4.162 -7.492 855 HD2 LYS 104 1HD LYS 104 26.029 5.947 -8.048 856 HD3 LYS 104 2HD LYS 104 27.301 5.134 -7.136 857 HE2 LYS 104 1HE LYS 104 27.554 4.651 -9.525 858 HE3 LYS 104 2HE LYS 104 27.119 3.179 -8.657 859 HZ1 LYS 104 3HZ LYS 104 25.853 3.628 -10.763 860 HZ2 LYS 104 1HZ LYS 104 25.110 4.926 -9.961 861 HZ3 LYS 104 2HZ LYS 104 24.900 3.341 -9.386 862 H LYS 105 H LYS 105 22.712 6.358 -4.074 863 HA LYS 105 HA LYS 105 23.955 6.788 -1.504 864 HB2 LYS 105 1HB LYS 105 23.108 8.632 -2.966 865 HB3 LYS 105 2HB LYS 105 21.465 8.099 -2.623 866 HG2 LYS 105 1HG LYS 105 21.851 8.447 -0.203 867 HG3 LYS 105 2HG LYS 105 23.492 8.985 -0.538 868 HD2 LYS 105 1HD LYS 105 21.046 10.341 -1.719 869 HD3 LYS 105 2HD LYS 105 21.751 10.832 -0.184 870 HE2 LYS 105 1HE LYS 105 23.965 11.113 -1.448 871 HE3 LYS 105 2HE LYS 105 23.024 10.957 -2.929 872 HZ1 LYS 105 3HZ LYS 105 22.085 12.839 -0.898 873 HZ2 LYS 105 1HZ LYS 105 21.963 12.918 -2.589 874 HZ3 LYS 105 2HZ LYS 105 23.439 13.277 -1.826 875 H GLY 106 H GLY 106 20.795 5.609 -2.620 876 HA2 GLY 106 1HA GLY 106 20.416 3.965 -0.338 877 HA3 GLY 106 2HA GLY 106 19.470 5.442 -0.183 878 H VAL 107 H VAL 107 17.449 4.599 -0.438 879 HA VAL 107 HA VAL 107 16.796 3.419 -3.091 880 HB VAL 107 HB VAL 107 16.803 1.660 -1.365 881 HG11 VAL 107 1HG1 VAL 107 16.260 3.240 0.539 882 HG12 VAL 107 2HG1 VAL 107 15.334 1.742 0.537 883 HG13 VAL 107 3HG1 VAL 107 14.588 3.235 -0.022 884 HG21 VAL 107 3HG2 VAL 107 14.592 0.793 -1.836 885 HG22 VAL 107 1HG2 VAL 107 15.133 1.676 -3.259 886 HG23 VAL 107 2HG2 VAL 107 13.968 2.407 -2.158 887 H GLU 108 H GLU 108 15.153 4.309 -4.123 888 HA GLU 108 HA GLU 108 13.626 6.474 -2.805 889 HB2 GLU 108 1HB GLU 108 13.983 5.759 -5.731 890 HB3 GLU 108 2HB GLU 108 12.980 7.080 -5.137 891 HG2 GLU 108 1HG GLU 108 15.946 6.812 -4.578 892 HG3 GLU 108 2HG GLU 108 15.265 7.815 -5.857 893 H VAL 109 H VAL 109 11.425 6.492 -2.756 894 HA VAL 109 HA VAL 109 9.968 4.074 -3.698 895 HB VAL 109 HB VAL 109 10.406 3.839 -1.290 896 HG11 VAL 109 1HG1 VAL 109 10.559 6.301 -0.835 897 HG12 VAL 109 2HG1 VAL 109 9.545 5.430 0.313 898 HG13 VAL 109 3HG1 VAL 109 8.803 6.390 -0.967 899 HG21 VAL 109 3HG2 VAL 109 8.236 3.076 -2.355 900 HG22 VAL 109 1HG2 VAL 109 7.501 4.571 -1.777 901 HG23 VAL 109 2HG2 VAL 109 8.129 3.393 -0.625 902 H GLU 110 H GLU 110 7.980 4.408 -4.500 903 HA GLU 110 HA GLU 110 6.711 7.060 -4.297 904 HB2 GLU 110 1HB GLU 110 8.226 7.147 -6.277 905 HB3 GLU 110 2HB GLU 110 7.353 5.780 -6.966 906 HG2 GLU 110 1HG GLU 110 5.279 7.064 -7.001 907 HG3 GLU 110 2HG GLU 110 6.064 8.414 -6.187 908 H LEU 111 H LEU 111 4.585 6.935 -4.224 909 HA LEU 111 HA LEU 111 3.236 4.392 -4.977 910 HB2 LEU 111 1HB LEU 111 3.440 4.809 -2.505 911 HB3 LEU 111 2HB LEU 111 2.460 6.253 -2.712 912 HG LEU 111 HG LEU 111 1.294 3.729 -3.885 913 HD11 LEU 111 1HD1 LEU 111 1.413 4.170 -0.889 914 HD12 LEU 111 2HD1 LEU 111 2.231 2.878 -1.771 915 HD13 LEU 111 3HD1 LEU 111 0.469 2.932 -1.720 916 HD21 LEU 111 3HD2 LEU 111 0.099 5.947 -3.833 917 HD22 LEU 111 1HD2 LEU 111 0.086 5.845 -2.073 918 HD23 LEU 111 2HD2 LEU 111 -0.779 4.646 -3.035 919 H THR 112 H THR 112 1.664 4.578 -6.409 920 HA THR 112 HA THR 112 0.527 7.279 -6.979 921 HB THR 112 HB THR 112 0.856 5.039 -8.992 922 HG1 THR 112 HG1 THR 112 2.878 5.571 -8.930 923 HG21 THR 112 3HG2 THR 112 -0.847 6.771 -9.475 924 HG22 THR 112 1HG2 THR 112 0.514 6.876 -10.594 925 HG23 THR 112 2HG2 THR 112 0.381 8.018 -9.257 926 H GLN 113 H GLN 113 -1.601 7.484 -7.237 927 HA GLN 113 HA GLN 113 -3.355 5.105 -7.240 928 HB2 GLN 113 1HB GLN 113 -3.013 5.813 -4.856 929 HB3 GLN 113 2HB GLN 113 -3.710 7.378 -5.268 930 HG2 GLN 113 1HG GLN 113 -5.792 6.224 -6.020 931 HG3 GLN 113 2HG GLN 113 -5.085 4.688 -5.525 932 HE21 GLN 113 2HE2 GLN 113 -7.181 7.030 -4.458 933 HE22 GLN 113 1HE2 GLN 113 -6.985 6.837 -2.782 934 H ASP 114 H ASP 114 -4.897 5.345 -8.712 935 HA ASP 114 HA ASP 114 -5.458 8.035 -9.812 936 HB2 ASP 114 1HB ASP 114 -6.388 6.735 -11.734 937 HB3 ASP 114 2HB ASP 114 -4.676 6.450 -11.440 938 H ASN 115 H ASN 115 -7.775 7.701 -11.020 939 HA ASN 115 HA ASN 115 -10.021 7.865 -10.817 940 HB2 ASN 115 1HB ASN 115 -9.772 5.417 -10.273 941 HB3 ASN 115 2HB ASN 115 -9.843 5.861 -8.568 942 HD21 ASN 115 2HD2 ASN 115 -11.928 4.593 -8.495 943 HD22 ASN 115 1HD2 ASN 115 -13.355 5.329 -9.049 944 H ASN 116 H ASN 116 -8.518 9.805 -9.321 945 HA ASN 116 HA ASN 116 -9.924 10.142 -6.774 946 HB2 ASN 116 1HB ASN 116 -8.028 11.965 -8.286 947 HB3 ASN 116 2HB ASN 116 -8.724 12.331 -6.711 948 HD21 ASN 116 2HD2 ASN 116 -5.855 11.481 -7.823 949 HD22 ASN 116 1HD2 ASN 116 -5.360 10.346 -6.659 950 H GLU 117 H GLU 117 -11.938 11.002 -6.690 951 HA GLU 117 HA GLU 117 -13.304 11.894 -8.994 952 HB2 GLU 117 1HB GLU 117 -13.979 12.129 -6.056 953 HB3 GLU 117 2HB GLU 117 -15.082 12.599 -7.350 954 HG2 GLU 117 1HG GLU 117 -15.013 10.328 -8.275 955 HG3 GLU 117 2HG GLU 117 -13.846 9.843 -7.050 956 H THR 118 H THR 118 -11.804 13.741 -6.353 957 HA THR 118 HA THR 118 -11.778 16.111 -8.118 958 HB THR 118 HB THR 118 -12.706 17.570 -6.458 959 HG1 THR 118 HG1 THR 118 -11.800 16.363 -4.676 960 HG21 THR 118 3HG2 THR 118 -14.976 16.775 -6.349 961 HG22 THR 118 1HG2 THR 118 -14.452 15.097 -6.490 962 HG23 THR 118 2HG2 THR 118 -14.294 16.189 -7.867 963 H GLU 119 H GLU 119 -10.502 17.915 -7.025 964 HA GLU 119 HA GLU 119 -7.892 17.008 -6.474 965 HB2 GLU 119 1HB GLU 119 -9.209 19.688 -5.949 966 HB3 GLU 119 2HB GLU 119 -7.479 19.388 -5.781 967 HG2 GLU 119 1HG GLU 119 -7.289 18.807 -8.116 968 HG3 GLU 119 2HG GLU 119 -9.036 18.891 -8.332 969 H LYS 120 H LYS 120 -10.548 18.019 -4.400 970 HA LYS 120 HA LYS 120 -9.219 18.067 -1.932 971 HB2 LYS 120 1HB LYS 120 -11.550 18.873 -2.322 972 HB3 LYS 120 2HB LYS 120 -12.074 17.195 -2.447 973 HG2 LYS 120 1HG LYS 120 -11.333 16.753 -0.157 974 HG3 LYS 120 2HG LYS 120 -10.696 18.394 -0.024 975 HD2 LYS 120 1HD LYS 120 -12.973 19.297 -0.381 976 HD3 LYS 120 2HD LYS 120 -13.603 17.653 -0.475 977 HE2 LYS 120 1HE LYS 120 -12.127 18.773 1.926 978 HE3 LYS 120 2HE LYS 120 -13.884 18.698 1.788 979 HZ1 LYS 120 3HZ LYS 120 -12.500 16.773 2.896 980 HZ2 LYS 120 1HZ LYS 120 -12.376 16.245 1.288 981 HZ3 LYS 120 2HZ LYS 120 -13.906 16.456 1.996 982 H GLU 121 H GLU 121 -10.708 15.391 -3.716 983 HA GLU 121 HA GLU 121 -10.255 13.418 -1.706 984 HB2 GLU 121 1HB GLU 121 -11.947 13.232 -3.569 985 HB3 GLU 121 2HB GLU 121 -10.604 12.967 -4.679 986 HG2 GLU 121 1HG GLU 121 -11.434 10.798 -4.041 987 HG3 GLU 121 2HG GLU 121 -9.896 11.017 -3.215 988 H GLN 122 H GLN 122 -8.428 14.519 -4.527 989 HA GLN 122 HA GLN 122 -6.433 12.505 -4.456 990 HB2 GLN 122 1HB GLN 122 -6.803 14.053 -6.386 991 HB3 GLN 122 2HB GLN 122 -6.154 15.372 -5.417 992 HG2 GLN 122 1HG GLN 122 -4.015 14.126 -5.178 993 HG3 GLN 122 2HG GLN 122 -4.670 12.839 -6.189 994 HE21 GLN 122 2HE2 GLN 122 -4.052 13.030 -8.334 995 HE22 GLN 122 1HE2 GLN 122 -3.703 14.489 -9.127 996 H LYS 123 H LYS 123 -6.609 15.765 -3.075 997 HA LYS 123 HA LYS 123 -4.111 15.761 -1.771 998 HB2 LYS 123 1HB LYS 123 -6.718 17.176 -1.163 999 HB3 LYS 123 2HB LYS 123 -5.234 17.498 -0.268 1000 HG2 LYS 123 1HG LYS 123 -5.179 17.622 -3.288 1001 HG3 LYS 123 2HG LYS 123 -5.865 18.978 -2.401 1002 HD2 LYS 123 1HD LYS 123 -3.151 17.920 -1.571 1003 HD3 LYS 123 2HD LYS 123 -3.270 18.955 -2.990 1004 HE2 LYS 123 1HE LYS 123 -4.192 20.764 -1.715 1005 HE3 LYS 123 2HE LYS 123 -4.447 19.737 -0.306 1006 HZ1 LYS 123 3HZ LYS 123 -1.930 20.819 -1.383 1007 HZ2 LYS 123 1HZ LYS 123 -1.905 19.378 -0.486 1008 HZ3 LYS 123 2HZ LYS 123 -2.496 20.805 0.220 1009 H HIS 124 H HIS 124 -7.327 14.722 -0.748 1010 HA HIS 124 HA HIS 124 -6.768 14.046 1.911 1011 HB2 HIS 124 1HB HIS 124 -9.042 14.194 0.842 1012 HB3 HIS 124 2HB HIS 124 -8.705 12.667 0.029 1013 HD1 HIS 124 HD1 HIS 124 -8.942 14.088 3.549 1014 HD2 HIS 124 HD2 HIS 124 -9.243 10.431 1.574 1015 HE1 HIS 124 HE1 HIS 124 -9.736 12.409 5.270 1016 HE2 HIS 124 HE2 HIS 124 -9.924 10.173 4.082 1017 H SER 125 H SER 125 -6.394 12.277 -1.113 1018 HA SER 125 HA SER 125 -5.602 9.797 0.079 1019 HB2 SER 125 1HB SER 125 -6.519 10.150 -2.287 1020 HB3 SER 125 2HB SER 125 -4.913 10.719 -2.722 1021 HG SER 125 HG SER 125 -5.520 8.222 -1.500 1022 H GLU 126 H GLU 126 -3.814 12.391 -1.579 1023 HA GLU 126 HA GLU 126 -1.224 11.414 -1.217 1024 HB2 GLU 126 1HB GLU 126 -2.253 14.261 -1.348 1025 HB3 GLU 126 2HB GLU 126 -0.542 13.839 -1.391 1026 HG2 GLU 126 1HG GLU 126 -0.848 12.549 -3.410 1027 HG3 GLU 126 2HG GLU 126 -2.591 12.761 -3.343 1028 H ASP 127 H ASP 127 -3.140 13.567 0.872 1029 HA ASP 127 HA ASP 127 -1.192 13.898 2.891 1030 HB2 ASP 127 1HB ASP 127 -4.217 14.051 2.949 1031 HB3 ASP 127 2HB ASP 127 -3.208 14.463 4.334 1032 H ASN 128 H ASN 128 -3.702 11.464 2.370 1033 HA ASN 128 HA ASN 128 -3.367 10.122 4.865 1034 HB2 ASN 128 1HB ASN 128 -5.397 9.851 3.513 1035 HB3 ASN 128 2HB ASN 128 -4.453 9.113 2.223 1036 HD21 ASN 128 2HD2 ASN 128 -4.704 6.884 2.243 1037 HD22 ASN 128 1HD2 ASN 128 -4.846 5.930 3.641 1038 H TRP 129 H TRP 129 -2.249 9.351 1.571 1039 HA TRP 129 HA TRP 129 -0.687 7.130 2.332 1040 HB2 TRP 129 1HB TRP 129 -0.547 8.963 -0.080 1041 HB3 TRP 129 2HB TRP 129 0.508 7.559 0.113 1042 HD1 TRP 129 HD1 TRP 129 -2.755 8.459 -1.282 1043 HE1 TRP 129 HE1 TRP 129 -4.221 6.375 -1.652 1044 HE3 TRP 129 HE3 TRP 129 -0.081 5.021 1.378 1045 HZ2 TRP 129 HZ2 TRP 129 -4.255 3.604 -0.916 1046 HZ3 TRP 129 HZ3 TRP 129 -0.847 2.670 1.528 1047 HH2 TRP 129 HH2 TRP 129 -2.928 1.957 0.384 1048 H ASN 130 H ASN 130 0.048 10.582 2.130 1049 HA ASN 130 HA ASN 130 2.827 10.422 2.523 1050 HB2 ASN 130 1HB ASN 130 0.787 12.523 3.303 1051 HB3 ASN 130 2HB ASN 130 2.507 12.730 3.629 1052 HD21 ASN 130 2HD2 ASN 130 1.025 14.438 1.821 1053 HD22 ASN 130 1HD2 ASN 130 1.659 14.205 0.264 1054 H THR 131 H THR 131 0.114 10.374 4.786 1055 HA THR 131 HA THR 131 1.626 10.402 7.173 1056 HB THR 131 HB THR 131 -1.036 9.005 6.783 1057 HG1 THR 131 HG1 THR 131 -1.921 10.886 6.567 1058 HG21 THR 131 3HG2 THR 131 -1.366 9.648 9.130 1059 HG22 THR 131 1HG2 THR 131 0.215 10.429 9.145 1060 HG23 THR 131 2HG2 THR 131 0.098 8.681 8.953 1061 H MET 132 H MET 132 0.577 7.841 4.998 1062 HA MET 132 HA MET 132 1.449 5.651 6.611 1063 HB2 MET 132 1HB MET 132 -0.161 5.505 4.659 1064 HB3 MET 132 2HB MET 132 1.221 5.717 3.587 1065 HG2 MET 132 1HG MET 132 0.860 3.349 3.764 1066 HG3 MET 132 2HG MET 132 2.282 3.704 4.739 1067 HE1 MET 132 3HE MET 132 -1.459 3.483 4.628 1068 HE2 MET 132 1HE MET 132 -1.942 2.615 6.090 1069 HE3 MET 132 2HE MET 132 -1.073 1.774 4.808 1070 H LEU 133 H LEU 133 2.898 7.335 3.832 1071 HA LEU 133 HA LEU 133 5.345 5.923 3.838 1072 HB2 LEU 133 1HB LEU 133 4.361 8.503 2.672 1073 HB3 LEU 133 2HB LEU 133 6.106 8.297 2.745 1074 HG LEU 133 HG LEU 133 5.166 7.562 0.577 1075 HD11 LEU 133 1HD1 LEU 133 5.979 4.927 1.707 1076 HD12 LEU 133 2HD1 LEU 133 7.098 6.251 2.026 1077 HD13 LEU 133 3HD1 LEU 133 6.655 5.853 0.370 1078 HD21 LEU 133 3HD2 LEU 133 3.705 5.443 2.185 1079 HD22 LEU 133 1HD2 LEU 133 3.691 5.628 0.431 1080 HD23 LEU 133 2HD2 LEU 133 2.954 6.858 1.449 1081 H GLU 134 H GLU 134 4.325 8.888 5.477 1082 HA GLU 134 HA GLU 134 6.860 9.427 6.682 1083 HB2 GLU 134 1HB GLU 134 4.033 10.339 7.287 1084 HB3 GLU 134 2HB GLU 134 5.404 10.853 8.270 1085 HG2 GLU 134 1HG GLU 134 6.479 11.852 6.333 1086 HG3 GLU 134 2HG GLU 134 5.224 11.240 5.265 1087 H GLY 135 H GLY 135 3.926 7.731 7.714 1088 HA2 GLY 135 1HA GLY 135 4.737 7.125 10.343 1089 HA3 GLY 135 2HA GLY 135 3.536 6.232 9.408 1090 H LEU 136 H LEU 136 5.252 5.511 7.250 1091 HA LEU 136 HA LEU 136 6.413 3.133 8.268 1092 HB2 LEU 136 1HB LEU 136 5.529 3.372 5.941 1093 HB3 LEU 136 2HB LEU 136 6.859 4.462 5.576 1094 HG LEU 136 HG LEU 136 8.472 2.619 6.114 1095 HD11 LEU 136 1HD1 LEU 136 7.329 0.250 6.041 1096 HD12 LEU 136 2HD1 LEU 136 5.898 1.109 6.611 1097 HD13 LEU 136 3HD1 LEU 136 7.381 1.126 7.566 1098 HD21 LEU 136 3HD2 LEU 136 7.783 3.056 3.803 1099 HD22 LEU 136 1HD2 LEU 136 6.385 1.998 4.005 1100 HD23 LEU 136 2HD2 LEU 136 8.014 1.324 4.052 1101 H LYS 137 H LYS 137 7.748 6.237 7.218 1102 HA LYS 137 HA LYS 137 10.475 5.564 7.381 1103 HB2 LYS 137 1HB LYS 137 9.546 7.638 6.325 1104 HB3 LYS 137 2HB LYS 137 9.263 8.281 7.942 1105 HG2 LYS 137 1HG LYS 137 11.771 7.861 8.381 1106 HG3 LYS 137 2HG LYS 137 11.919 7.593 6.647 1107 HD2 LYS 137 1HD LYS 137 10.796 10.118 7.905 1108 HD3 LYS 137 2HD LYS 137 12.453 9.939 7.340 1109 HE2 LYS 137 1HE LYS 137 11.469 9.331 5.058 1110 HE3 LYS 137 2HE LYS 137 9.919 9.886 5.687 1111 HZ1 LYS 137 3HZ LYS 137 12.122 11.411 4.759 1112 HZ2 LYS 137 1HZ LYS 137 11.735 11.837 6.356 1113 HZ3 LYS 137 2HZ LYS 137 10.545 11.918 5.146 1114 H LYS 138 H LYS 138 8.174 6.627 9.845 1115 HA LYS 138 HA LYS 138 10.002 7.148 11.910 1116 HB2 LYS 138 1HB LYS 138 7.119 6.257 11.976 1117 HB3 LYS 138 2HB LYS 138 8.027 6.688 13.424 1118 HG2 LYS 138 1HG LYS 138 8.480 8.922 12.486 1119 HG3 LYS 138 2HG LYS 138 7.578 8.498 11.036 1120 HD2 LYS 138 1HD LYS 138 5.553 8.122 12.425 1121 HD3 LYS 138 2HD LYS 138 6.465 8.626 13.850 1122 HE2 LYS 138 1HE LYS 138 6.047 10.342 11.388 1123 HE3 LYS 138 2HE LYS 138 5.106 10.480 12.873 1124 HZ1 LYS 138 3HZ LYS 138 7.816 10.477 13.555 1125 HZ2 LYS 138 1HZ LYS 138 6.697 11.741 13.718 1126 HZ3 LYS 138 2HZ LYS 138 7.609 11.595 12.292 1127 H PHE 139 H PHE 139 8.449 4.144 10.867 1128 HA PHE 139 HA PHE 139 9.453 2.584 13.063 1129 HB2 PHE 139 1HB PHE 139 7.409 2.098 11.536 1130 HB3 PHE 139 2HB PHE 139 8.581 1.440 10.398 1131 HD1 PHE 139 HD2 PHE 139 10.065 -0.475 11.094 1132 HD2 PHE 139 HD1 PHE 139 6.816 0.897 13.548 1133 HE1 PHE 139 HE2 PHE 139 10.153 -2.584 12.392 1134 HE2 PHE 139 HE1 PHE 139 6.908 -1.211 14.847 1135 HZ PHE 139 HZ PHE 139 8.577 -2.951 14.269 1136 H LEU 140 H LEU 140 10.371 2.865 9.630 1137 HA LEU 140 HA LEU 140 12.593 1.103 9.784 1138 HB2 LEU 140 1HB LEU 140 11.635 3.176 7.834 1139 HB3 LEU 140 2HB LEU 140 13.285 2.591 7.656 1140 HG LEU 140 HG LEU 140 12.467 0.275 7.514 1141 HD11 LEU 140 1HD1 LEU 140 10.488 0.380 8.906 1142 HD12 LEU 140 2HD1 LEU 140 9.982 -0.090 7.285 1143 HD13 LEU 140 3HD1 LEU 140 9.747 1.565 7.838 1144 HD21 LEU 140 3HD2 LEU 140 11.039 2.215 5.673 1145 HD22 LEU 140 1HD2 LEU 140 11.268 0.497 5.350 1146 HD23 LEU 140 2HD2 LEU 140 12.665 1.570 5.449 1147 H GLU 141 H GLU 141 12.342 4.615 10.162 1148 HA GLU 141 HA GLU 141 15.189 4.969 10.536 1149 HB2 GLU 141 1HB GLU 141 14.730 7.274 10.749 1150 HB3 GLU 141 2HB GLU 141 13.454 6.707 9.679 1151 HG2 GLU 141 1HG GLU 141 12.185 7.942 11.222 1152 HG3 GLU 141 2HG GLU 141 12.120 6.340 11.945 1153 H ASN 142 H ASN 142 12.905 3.553 12.415 1154 HA ASN 142 HA ASN 142 13.282 4.624 14.986 1155 HB2 ASN 142 1HB ASN 142 11.501 2.971 14.285 1156 HB3 ASN 142 2HB ASN 142 12.737 1.717 14.339 1157 HD21 ASN 142 2HD2 ASN 142 10.424 1.716 16.068 1158 HD22 ASN 142 1HD2 ASN 142 10.975 1.915 17.662 1159 H LYS 143 H LYS 143 15.080 2.178 13.181 1160 HA LYS 143 HA LYS 143 16.715 1.217 15.221 1161 HB2 LYS 143 1HB LYS 143 18.220 0.485 13.453 1162 HB3 LYS 143 2HB LYS 143 16.550 0.216 12.963 1163 HG2 LYS 143 1HG LYS 143 16.636 2.393 11.706 1164 HG3 LYS 143 2HG LYS 143 18.353 2.494 12.085 1165 HD2 LYS 143 1HD LYS 143 18.752 0.348 10.957 1166 HD3 LYS 143 2HD LYS 143 17.036 0.222 10.577 1167 HE2 LYS 143 1HE LYS 143 17.175 2.309 9.264 1168 HE3 LYS 143 2HE LYS 143 18.894 2.427 9.638 1169 HZ1 LYS 143 3HZ LYS 143 18.275 1.371 7.439 1170 HZ2 LYS 143 1HZ LYS 143 17.732 0.038 8.335 1171 HZ3 LYS 143 2HZ LYS 143 19.361 0.504 8.416 1172 H VAL 144 H VAL 144 17.096 4.088 13.181 1173 HA VAL 144 HA VAL 144 19.699 4.777 14.035 1174 HB VAL 144 HB VAL 144 17.459 6.542 13.006 1175 HG11 VAL 144 1HG1 VAL 144 19.385 8.060 12.374 1176 HG12 VAL 144 2HG1 VAL 144 20.428 7.046 13.370 1177 HG13 VAL 144 3HG1 VAL 144 19.102 7.943 14.109 1178 HG21 VAL 144 3HG2 VAL 144 18.090 4.788 11.428 1179 HG22 VAL 144 1HG2 VAL 144 19.798 5.166 11.648 1180 HG23 VAL 144 2HG2 VAL 144 18.731 6.331 10.864 1181 H SER 145 H SER 145 16.496 5.797 15.214 1182 HA SER 145 HA SER 145 17.406 7.553 17.223 1183 HB2 SER 145 1HB SER 145 15.072 7.525 16.458 1184 HB3 SER 145 2HB SER 145 14.862 5.914 17.133 1185 HG SER 145 HG SER 145 14.924 8.372 18.366 1186 H ALA 146 H ALA 146 16.658 4.102 17.272 1187 HA ALA 146 HA ALA 146 17.001 3.657 20.034 1188 HB1 ALA 146 3HB ALA 146 17.199 1.305 19.443 1189 HB2 ALA 146 1HB ALA 146 17.527 1.728 17.762 1190 HB3 ALA 146 2HB ALA 146 15.939 2.050 18.457 Start of MODEL 6 1 H1 MET 1 1H MET 1 -12.379 12.803 -20.414 2 H2 MET 1 2H MET 1 -12.969 13.867 -21.600 3 H3 MET 1 3H MET 1 -12.396 14.474 -20.120 4 HA MET 1 HA MET 1 -10.840 13.292 -22.344 5 HB2 MET 1 1HB MET 1 -10.756 15.911 -20.817 6 HB3 MET 1 2HB MET 1 -9.562 15.433 -22.024 7 HG2 MET 1 1HG MET 1 -11.342 15.262 -23.725 8 HG3 MET 1 2HG MET 1 -12.541 15.732 -22.519 9 HE1 MET 1 3HE MET 1 -13.480 17.812 -23.671 10 HE2 MET 1 1HE MET 1 -12.559 17.194 -25.050 11 HE3 MET 1 2HE MET 1 -12.490 18.905 -24.635 12 H GLU 2 H GLU 2 -9.325 11.887 -21.722 13 HA GLU 2 HA GLU 2 -7.772 10.746 -20.470 14 HB2 GLU 2 1HB GLU 2 -7.395 13.512 -19.285 15 HB3 GLU 2 2HB GLU 2 -6.339 12.143 -18.952 16 HG2 GLU 2 1HG GLU 2 -5.782 11.947 -21.319 17 HG3 GLU 2 2HG GLU 2 -6.915 13.239 -21.717 18 H ILE 3 H ILE 3 -7.465 9.703 -18.428 19 HA ILE 3 HA ILE 3 -9.791 9.262 -16.955 20 HB ILE 3 HB ILE 3 -8.481 7.895 -15.506 21 HG12 ILE 3 1HG1 ILE 3 -6.738 9.387 -14.759 22 HG13 ILE 3 2HG1 ILE 3 -5.943 8.024 -15.524 23 HG21 ILE 3 1HG2 ILE 3 -8.622 7.188 -17.890 24 HG22 ILE 3 2HG2 ILE 3 -7.184 6.579 -17.073 25 HG23 ILE 3 3HG2 ILE 3 -7.055 7.948 -18.175 26 HD11 ILE 3 3HD1 ILE 3 -5.860 9.424 -17.656 27 HD12 ILE 3 1HD1 ILE 3 -4.833 9.974 -16.337 28 HD13 ILE 3 2HD1 ILE 3 -6.351 10.797 -16.666 29 H LYS 4 H LYS 4 -9.565 9.436 -14.371 30 HA LYS 4 HA LYS 4 -9.860 12.235 -13.802 31 HB2 LYS 4 1HB LYS 4 -10.067 9.684 -12.201 32 HB3 LYS 4 2HB LYS 4 -10.109 11.237 -11.384 33 HG2 LYS 4 1HG LYS 4 -12.386 10.514 -11.848 34 HG3 LYS 4 2HG LYS 4 -12.018 11.926 -12.833 35 HD2 LYS 4 1HD LYS 4 -11.678 10.573 -14.795 36 HD3 LYS 4 2HD LYS 4 -11.734 9.084 -13.851 37 HE2 LYS 4 1HE LYS 4 -13.870 9.373 -14.971 38 HE3 LYS 4 2HE LYS 4 -14.111 9.644 -13.247 39 HZ1 LYS 4 3HZ LYS 4 -14.951 11.609 -13.786 40 HZ2 LYS 4 1HZ LYS 4 -14.508 11.432 -15.413 41 HZ3 LYS 4 2HZ LYS 4 -13.404 12.091 -14.302 42 H LEU 5 H LEU 5 -8.834 12.607 -11.314 43 HA LEU 5 HA LEU 5 -6.075 13.199 -11.862 44 HB2 LEU 5 1HB LEU 5 -7.939 13.614 -9.530 45 HB3 LEU 5 2HB LEU 5 -6.220 13.924 -9.333 46 HG LEU 5 HG LEU 5 -6.277 15.532 -11.186 47 HD11 LEU 5 1HD1 LEU 5 -8.593 16.191 -12.060 48 HD12 LEU 5 2HD1 LEU 5 -9.186 14.689 -11.351 49 HD13 LEU 5 3HD1 LEU 5 -7.970 14.644 -12.630 50 HD21 LEU 5 3HD2 LEU 5 -6.809 16.257 -8.865 51 HD22 LEU 5 1HD2 LEU 5 -8.525 16.028 -9.214 52 HD23 LEU 5 2HD2 LEU 5 -7.603 17.252 -10.088 53 H ILE 6 H ILE 6 -4.258 12.268 -11.112 54 HA ILE 6 HA ILE 6 -4.491 9.691 -9.630 55 HB ILE 6 HB ILE 6 -2.312 10.617 -11.524 56 HG12 ILE 6 1HG1 ILE 6 -4.457 8.503 -11.943 57 HG13 ILE 6 2HG1 ILE 6 -4.565 10.137 -12.590 58 HG21 ILE 6 1HG2 ILE 6 -1.464 9.049 -9.848 59 HG22 ILE 6 2HG2 ILE 6 -1.644 8.190 -11.371 60 HG23 ILE 6 3HG2 ILE 6 -2.846 7.984 -10.101 61 HD11 ILE 6 3HD1 ILE 6 -2.403 8.107 -13.208 62 HD12 ILE 6 1HD1 ILE 6 -2.408 9.774 -13.784 63 HD13 ILE 6 2HD1 ILE 6 -3.669 8.657 -14.305 64 H ALA 7 H ALA 7 -3.602 9.571 -7.673 65 HA ALA 7 HA ALA 7 -2.282 11.823 -6.479 66 HB1 ALA 7 3HB ALA 7 -2.191 10.499 -4.479 67 HB2 ALA 7 1HB ALA 7 -2.404 9.000 -5.387 68 HB3 ALA 7 2HB ALA 7 -3.735 10.151 -5.259 69 H GLN 8 H GLN 8 -0.137 12.065 -5.880 70 HA GLN 8 HA GLN 8 1.831 10.040 -6.797 71 HB2 GLN 8 1HB GLN 8 1.855 12.989 -7.497 72 HB3 GLN 8 2HB GLN 8 3.218 11.896 -7.744 73 HG2 GLN 8 1HG GLN 8 1.815 10.475 -9.200 74 HG3 GLN 8 2HG GLN 8 0.457 11.572 -8.960 75 HE21 GLN 8 2HE2 GLN 8 0.230 12.640 -10.943 76 HE22 GLN 8 1HE2 GLN 8 1.499 13.416 -11.763 77 H VAL 9 H VAL 9 3.184 9.587 -5.215 78 HA VAL 9 HA VAL 9 4.121 11.696 -3.360 79 HB VAL 9 HB VAL 9 3.821 10.115 -1.434 80 HG11 VAL 9 1HG1 VAL 9 1.428 10.540 -1.179 81 HG12 VAL 9 2HG1 VAL 9 1.273 10.812 -2.913 82 HG13 VAL 9 3HG1 VAL 9 2.207 11.937 -1.923 83 HG21 VAL 9 3HG2 VAL 9 2.101 8.593 -3.417 84 HG22 VAL 9 1HG2 VAL 9 2.275 8.228 -1.701 85 HG23 VAL 9 2HG2 VAL 9 3.650 8.030 -2.789 86 H LYS 10 H LYS 10 6.138 11.239 -2.384 87 HA LYS 10 HA LYS 10 7.552 8.795 -2.843 88 HB2 LYS 10 1HB LYS 10 9.326 9.814 -4.326 89 HB3 LYS 10 2HB LYS 10 7.760 9.572 -5.102 90 HG2 LYS 10 1HG LYS 10 7.181 11.906 -4.816 91 HG3 LYS 10 2HG LYS 10 8.620 12.193 -3.844 92 HD2 LYS 10 1HD LYS 10 9.034 13.012 -6.086 93 HD3 LYS 10 2HD LYS 10 10.031 11.586 -5.814 94 HE2 LYS 10 1HE LYS 10 8.641 10.223 -7.186 95 HE3 LYS 10 2HE LYS 10 7.310 11.382 -7.143 96 HZ1 LYS 10 3HZ LYS 10 9.538 11.253 -8.901 97 HZ2 LYS 10 1HZ LYS 10 9.453 12.769 -8.143 98 HZ3 LYS 10 2HZ LYS 10 8.122 12.183 -9.021 99 H THR 11 H THR 11 9.386 8.636 -1.602 100 HA THR 11 HA THR 11 10.499 11.026 -0.303 101 HB THR 11 HB THR 11 8.832 10.493 1.306 102 HG1 THR 11 HG1 THR 11 10.935 10.722 2.163 103 HG21 THR 11 3HG2 THR 11 8.061 8.353 0.561 104 HG22 THR 11 1HG2 THR 11 8.660 8.115 2.201 105 HG23 THR 11 2HG2 THR 11 9.643 7.616 0.823 106 H VAL 12 H VAL 12 12.574 10.797 0.406 107 HA VAL 12 HA VAL 12 13.999 8.315 -0.429 108 HB VAL 12 HB VAL 12 14.681 10.381 -1.582 109 HG11 VAL 12 1HG1 VAL 12 15.649 12.242 -0.416 110 HG12 VAL 12 2HG1 VAL 12 15.628 11.380 1.120 111 HG13 VAL 12 3HG1 VAL 12 14.114 11.899 0.380 112 HG21 VAL 12 3HG2 VAL 12 17.058 10.117 -1.252 113 HG22 VAL 12 1HG2 VAL 12 16.322 8.534 -1.017 114 HG23 VAL 12 2HG2 VAL 12 16.822 9.490 0.378 115 H ILE 13 H ILE 13 15.048 7.118 1.027 116 HA ILE 13 HA ILE 13 15.745 8.245 3.656 117 HB ILE 13 HB ILE 13 13.402 6.960 3.498 118 HG12 ILE 13 1HG1 ILE 13 13.945 6.041 5.936 119 HG13 ILE 13 2HG1 ILE 13 15.493 6.847 5.694 120 HG21 ILE 13 1HG2 ILE 13 13.477 4.612 3.903 121 HG22 ILE 13 2HG2 ILE 13 15.220 4.644 4.126 122 HG23 ILE 13 3HG2 ILE 13 14.536 4.917 2.531 123 HD11 ILE 13 3HD1 ILE 13 12.783 8.195 5.455 124 HD12 ILE 13 1HD1 ILE 13 14.353 8.991 5.361 125 HD13 ILE 13 2HD1 ILE 13 13.824 8.269 6.875 126 H ASN 14 H ASN 14 17.390 7.145 4.747 127 HA ASN 14 HA ASN 14 19.162 5.605 3.001 128 HB2 ASN 14 1HB ASN 14 19.474 6.698 5.809 129 HB3 ASN 14 2HB ASN 14 20.728 5.803 4.949 130 HD21 ASN 14 2HD2 ASN 14 20.993 8.587 5.780 131 HD22 ASN 14 1HD2 ASN 14 21.139 9.517 4.367 132 H ALA 15 H ALA 15 18.222 3.590 2.800 133 HA ALA 15 HA ALA 15 18.677 1.749 4.962 134 HB1 ALA 15 3HB ALA 15 15.820 2.378 4.197 135 HB2 ALA 15 1HB ALA 15 16.565 2.629 5.773 136 HB3 ALA 15 2HB ALA 15 16.292 0.996 5.169 137 HA PRO 16 HA PRO 16 19.014 -0.928 1.427 138 HB2 PRO 16 1HB PRO 16 18.473 -3.413 2.531 139 HB3 PRO 16 2HB PRO 16 20.006 -2.547 2.769 140 HG2 PRO 16 1HG PRO 16 17.609 -2.662 4.575 141 HG3 PRO 16 2HG PRO 16 19.330 -2.829 4.985 142 HD2 PRO 16 1HD PRO 16 18.044 -0.497 5.392 143 HD3 PRO 16 2HD PRO 16 19.726 -0.508 4.830 144 H ILE 17 H ILE 17 17.793 -1.890 -0.153 145 HA ILE 17 HA ILE 17 15.003 -1.339 -0.218 146 HB ILE 17 HB ILE 17 16.456 -1.296 -2.210 147 HG12 ILE 17 1HG1 ILE 17 14.316 -3.431 -2.500 148 HG13 ILE 17 2HG1 ILE 17 13.946 -1.715 -2.340 149 HG21 ILE 17 1HG2 ILE 17 17.291 -3.330 -3.204 150 HG22 ILE 17 2HG2 ILE 17 16.454 -4.323 -2.015 151 HG23 ILE 17 3HG2 ILE 17 17.813 -3.314 -1.520 152 HD11 ILE 17 3HD1 ILE 17 15.752 -2.860 -4.492 153 HD12 ILE 17 1HD1 ILE 17 15.175 -1.198 -4.365 154 HD13 ILE 17 2HD1 ILE 17 14.041 -2.501 -4.723 155 H GLU 18 H GLU 18 16.873 -4.204 0.549 156 HA GLU 18 HA GLU 18 14.999 -6.221 0.177 157 HB2 GLU 18 1HB GLU 18 17.084 -5.927 2.352 158 HB3 GLU 18 2HB GLU 18 16.228 -7.424 1.986 159 HG2 GLU 18 1HG GLU 18 17.138 -7.416 -0.286 160 HG3 GLU 18 2HG GLU 18 17.949 -5.884 0.026 161 H LYS 19 H LYS 19 15.602 -4.368 3.149 162 HA LYS 19 HA LYS 19 13.467 -5.558 4.604 163 HB2 LYS 19 1HB LYS 19 15.228 -3.155 5.055 164 HB3 LYS 19 2HB LYS 19 13.885 -3.494 6.144 165 HG2 LYS 19 1HG LYS 19 16.016 -4.493 6.952 166 HG3 LYS 19 2HG LYS 19 14.788 -5.715 6.632 167 HD2 LYS 19 1HD LYS 19 15.823 -6.367 4.571 168 HD3 LYS 19 2HD LYS 19 16.883 -4.955 4.573 169 HE2 LYS 19 1HE LYS 19 18.153 -6.913 5.264 170 HE3 LYS 19 2HE LYS 19 17.960 -5.847 6.654 171 HZ1 LYS 19 3HZ LYS 19 16.968 -7.489 7.729 172 HZ2 LYS 19 1HZ LYS 19 17.152 -8.514 6.390 173 HZ3 LYS 19 2HZ LYS 19 15.752 -7.563 6.546 174 H VAL 20 H VAL 20 13.660 -2.529 2.745 175 HA VAL 20 HA VAL 20 11.077 -1.601 3.538 176 HB VAL 20 HB VAL 20 12.574 -0.978 0.971 177 HG11 VAL 20 1HG1 VAL 20 10.134 -0.335 1.049 178 HG12 VAL 20 2HG1 VAL 20 11.219 1.044 0.926 179 HG13 VAL 20 3HG1 VAL 20 10.485 0.635 2.473 180 HG21 VAL 20 3HG2 VAL 20 13.867 -0.539 3.103 181 HG22 VAL 20 1HG2 VAL 20 12.575 0.556 3.588 182 HG23 VAL 20 2HG2 VAL 20 13.528 0.906 2.152 183 H TRP 21 H TRP 21 12.244 -3.357 0.679 184 HA TRP 21 HA TRP 21 9.825 -3.719 -0.674 185 HB2 TRP 21 1HB TRP 21 12.071 -4.269 -1.583 186 HB3 TRP 21 2HB TRP 21 12.176 -5.630 -0.472 187 HD1 TRP 21 HD1 TRP 21 10.822 -7.796 -1.038 188 HE1 TRP 21 HE1 TRP 21 9.561 -8.584 -3.148 189 HE3 TRP 21 HE3 TRP 21 10.584 -3.400 -3.628 190 HZ2 TRP 21 HZ2 TRP 21 8.585 -7.495 -5.602 191 HZ3 TRP 21 HZ3 TRP 21 9.487 -3.304 -5.845 192 HH2 TRP 21 HH2 TRP 21 8.490 -5.346 -6.836 193 H GLU 22 H GLU 22 11.348 -5.610 1.896 194 HA GLU 22 HA GLU 22 9.533 -7.744 2.030 195 HB2 GLU 22 1HB GLU 22 11.726 -7.645 3.209 196 HB3 GLU 22 2HB GLU 22 11.047 -6.453 4.315 197 HG2 GLU 22 1HG GLU 22 9.361 -8.071 5.067 198 HG3 GLU 22 2HG GLU 22 9.965 -9.258 3.913 199 H ALA 23 H ALA 23 9.528 -4.616 3.728 200 HA ALA 23 HA ALA 23 7.255 -5.026 5.317 201 HB1 ALA 23 3HB ALA 23 8.186 -2.408 4.132 202 HB2 ALA 23 1HB ALA 23 8.877 -3.156 5.572 203 HB3 ALA 23 2HB ALA 23 7.195 -2.624 5.575 204 H LEU 24 H LEU 24 7.530 -4.175 1.939 205 HA LEU 24 HA LEU 24 4.894 -3.166 1.613 206 HB2 LEU 24 1HB LEU 24 7.061 -3.076 0.067 207 HB3 LEU 24 2HB LEU 24 6.348 -4.510 -0.661 208 HG LEU 24 HG LEU 24 5.054 -1.773 -0.391 209 HD11 LEU 24 1HD1 LEU 24 6.666 -1.782 -2.168 210 HD12 LEU 24 2HD1 LEU 24 5.083 -1.940 -2.924 211 HD13 LEU 24 3HD1 LEU 24 6.120 -3.353 -2.747 212 HD21 LEU 24 3HD2 LEU 24 3.933 -4.444 -1.274 213 HD22 LEU 24 1HD2 LEU 24 3.277 -2.937 -1.917 214 HD23 LEU 24 2HD2 LEU 24 3.228 -3.245 -0.190 215 H VAL 25 H VAL 25 6.268 -6.423 1.130 216 HA VAL 25 HA VAL 25 3.503 -7.534 0.963 217 HB VAL 25 HB VAL 25 4.629 -9.435 -0.326 218 HG11 VAL 25 1HG1 VAL 25 3.312 -7.560 -1.390 219 HG12 VAL 25 2HG1 VAL 25 4.567 -8.223 -2.430 220 HG13 VAL 25 3HG1 VAL 25 4.824 -6.690 -1.601 221 HG21 VAL 25 3HG2 VAL 25 6.855 -7.378 -0.592 222 HG22 VAL 25 1HG2 VAL 25 6.781 -8.951 -1.378 223 HG23 VAL 25 2HG2 VAL 25 6.984 -8.848 0.366 224 H ASN 26 H ASN 26 3.542 -7.589 3.288 225 HA ASN 26 HA ASN 26 4.487 -10.172 4.218 226 HB2 ASN 26 1HB ASN 26 6.393 -8.592 4.563 227 HB3 ASN 26 2HB ASN 26 5.389 -7.719 5.701 228 HD21 ASN 26 2HD2 ASN 26 4.165 -10.460 6.523 229 HD22 ASN 26 1HD2 ASN 26 5.341 -11.118 7.550 230 HA PRO 27 HA PRO 27 0.525 -9.183 6.208 231 HB2 PRO 27 1HB PRO 27 -0.148 -11.682 7.091 232 HB3 PRO 27 2HB PRO 27 -0.276 -11.210 5.388 233 HG2 PRO 27 1HG PRO 27 1.872 -12.785 6.747 234 HG3 PRO 27 2HG PRO 27 1.106 -13.054 5.169 235 HD2 PRO 27 1HD PRO 27 3.559 -11.835 5.464 236 HD3 PRO 27 2HD PRO 27 2.479 -11.498 4.097 237 H GLU 28 H GLU 28 3.429 -10.082 7.619 238 HA GLU 28 HA GLU 28 2.416 -10.080 10.392 239 HB2 GLU 28 1HB GLU 28 5.217 -10.477 9.300 240 HB3 GLU 28 2HB GLU 28 4.756 -10.593 10.998 241 HG2 GLU 28 1HG GLU 28 3.553 -12.293 8.794 242 HG3 GLU 28 2HG GLU 28 4.868 -12.820 9.841 243 H ILE 29 H ILE 29 4.643 -8.228 8.317 244 HA ILE 29 HA ILE 29 5.135 -6.203 10.298 245 HB ILE 29 HB ILE 29 5.541 -6.041 7.303 246 HG12 ILE 29 1HG1 ILE 29 7.562 -6.801 9.444 247 HG13 ILE 29 2HG1 ILE 29 6.702 -7.995 8.476 248 HG21 ILE 29 1HG2 ILE 29 6.683 -4.486 9.636 249 HG22 ILE 29 2HG2 ILE 29 5.623 -3.865 8.375 250 HG23 ILE 29 3HG2 ILE 29 7.266 -4.356 7.978 251 HD11 ILE 29 3HD1 ILE 29 8.395 -5.774 7.302 252 HD12 ILE 29 1HD1 ILE 29 7.643 -7.108 6.429 253 HD13 ILE 29 2HD1 ILE 29 8.959 -7.424 7.557 254 H ILE 30 H ILE 30 3.017 -6.525 7.488 255 HA ILE 30 HA ILE 30 1.909 -3.931 7.525 256 HB ILE 30 HB ILE 30 0.778 -6.584 6.576 257 HG12 ILE 30 1HG1 ILE 30 1.817 -4.213 4.982 258 HG13 ILE 30 2HG1 ILE 30 2.836 -5.575 5.444 259 HG21 ILE 30 1HG2 ILE 30 -0.827 -5.084 5.250 260 HG22 ILE 30 2HG2 ILE 30 -0.339 -3.771 6.319 261 HG23 ILE 30 3HG2 ILE 30 -1.147 -5.193 6.978 262 HD11 ILE 30 3HD1 ILE 30 0.329 -5.698 3.739 263 HD12 ILE 30 1HD1 ILE 30 1.235 -7.111 4.280 264 HD13 ILE 30 2HD1 ILE 30 1.986 -5.947 3.189 265 H LYS 31 H LYS 31 0.967 -6.926 9.176 266 HA LYS 31 HA LYS 31 -1.374 -5.910 10.400 267 HB2 LYS 31 1HB LYS 31 -0.848 -8.322 10.166 268 HB3 LYS 31 2HB LYS 31 0.431 -8.137 11.365 269 HG2 LYS 31 1HG LYS 31 -1.201 -7.454 13.051 270 HG3 LYS 31 2HG LYS 31 -2.497 -7.502 11.854 271 HD2 LYS 31 1HD LYS 31 -2.099 -9.920 11.525 272 HD3 LYS 31 2HD LYS 31 -0.818 -9.870 12.738 273 HE2 LYS 31 1HE LYS 31 -2.436 -9.167 14.444 274 HE3 LYS 31 2HE LYS 31 -3.723 -9.155 13.239 275 HZ1 LYS 31 3HZ LYS 31 -2.494 -11.625 13.050 276 HZ2 LYS 31 1HZ LYS 31 -4.034 -11.289 13.672 277 HZ3 LYS 31 2HZ LYS 31 -2.692 -11.336 14.713 278 H GLU 32 H GLU 32 2.017 -5.721 11.204 279 HA GLU 32 HA GLU 32 1.884 -5.102 13.922 280 HB2 GLU 32 1HB GLU 32 3.972 -5.444 12.430 281 HB3 GLU 32 2HB GLU 32 3.819 -3.739 12.024 282 HG2 GLU 32 1HG GLU 32 4.038 -4.791 14.865 283 HG3 GLU 32 2HG GLU 32 5.395 -4.184 13.925 284 H TYR 33 H TYR 33 1.548 -2.973 11.097 285 HA TYR 33 HA TYR 33 1.229 -0.564 12.595 286 HB2 TYR 33 1HB TYR 33 0.464 -1.308 9.758 287 HB3 TYR 33 2HB TYR 33 0.290 0.316 10.418 288 HD1 TYR 33 HD2 TYR 33 2.322 1.539 11.278 289 HD2 TYR 33 HD1 TYR 33 2.613 -2.099 9.007 290 HE1 TYR 33 HE2 TYR 33 4.697 2.043 10.770 291 HE2 TYR 33 HE1 TYR 33 4.985 -1.584 8.497 292 HH TYR 33 HH TYR 33 6.405 0.598 8.363 293 H MET 34 H MET 34 -0.977 -3.040 11.411 294 HA MET 34 HA MET 34 -3.364 -1.533 12.128 295 HB2 MET 34 1HB MET 34 -3.038 -4.400 11.209 296 HB3 MET 34 2HB MET 34 -4.556 -3.512 11.321 297 HG2 MET 34 1HG MET 34 -2.213 -2.680 9.578 298 HG3 MET 34 2HG MET 34 -3.617 -3.567 8.995 299 HE1 MET 34 3HE MET 34 -5.623 -2.575 8.124 300 HE2 MET 34 1HE MET 34 -6.454 -1.179 8.821 301 HE3 MET 34 2HE MET 34 -6.151 -2.608 9.804 302 H PHE 35 H PHE 35 -4.858 -2.175 13.692 303 HA PHE 35 HA PHE 35 -3.788 -2.904 16.193 304 HB2 PHE 35 1HB PHE 35 -6.657 -2.840 15.220 305 HB3 PHE 35 2HB PHE 35 -6.189 -3.055 16.906 306 HD1 PHE 35 HD1 PHE 35 -4.973 -1.257 18.124 307 HD2 PHE 35 HD2 PHE 35 -6.479 -0.667 14.143 308 HE1 PHE 35 HE1 PHE 35 -4.711 1.196 18.385 309 HE2 PHE 35 HE2 PHE 35 -6.218 1.783 14.408 310 HZ PHE 35 HZ PHE 35 -5.334 2.714 16.528 311 H GLY 36 H GLY 36 -5.617 -4.849 13.829 312 HA2 GLY 36 1HA GLY 36 -4.391 -7.274 14.663 313 HA3 GLY 36 2HA GLY 36 -5.993 -7.147 15.378 314 H THR 37 H THR 37 -4.795 -6.181 12.165 315 HA THR 37 HA THR 37 -7.091 -7.478 10.890 316 HB THR 37 HB THR 37 -4.789 -5.955 9.643 317 HG1 THR 37 HG1 THR 37 -7.040 -5.205 11.000 318 HG21 THR 37 3HG2 THR 37 -7.485 -6.883 8.608 319 HG22 THR 37 1HG2 THR 37 -5.892 -7.341 8.002 320 HG23 THR 37 2HG2 THR 37 -6.478 -5.694 7.782 321 H THR 38 H THR 38 -7.071 -9.455 10.077 322 HA THR 38 HA THR 38 -4.579 -10.991 9.979 323 HB THR 38 HB THR 38 -7.401 -11.872 9.312 324 HG1 THR 38 HG1 THR 38 -7.308 -11.152 11.431 325 HG21 THR 38 3HG2 THR 38 -4.859 -13.371 10.007 326 HG22 THR 38 1HG2 THR 38 -5.699 -13.387 8.457 327 HG23 THR 38 2HG2 THR 38 -6.450 -14.117 9.876 328 H VAL 39 H VAL 39 -3.432 -10.244 8.223 329 HA VAL 39 HA VAL 39 -4.693 -10.135 5.567 330 HB VAL 39 HB VAL 39 -1.872 -9.487 6.465 331 HG11 VAL 39 1HG1 VAL 39 -1.859 -10.034 4.102 332 HG12 VAL 39 2HG1 VAL 39 -1.812 -8.280 4.235 333 HG13 VAL 39 3HG1 VAL 39 -3.316 -9.094 3.826 334 HG21 VAL 39 3HG2 VAL 39 -3.661 -8.018 7.403 335 HG22 VAL 39 1HG2 VAL 39 -4.194 -7.667 5.760 336 HG23 VAL 39 2HG2 VAL 39 -2.592 -7.162 6.294 337 H VAL 40 H VAL 40 -4.572 -11.751 4.150 338 HA VAL 40 HA VAL 40 -2.459 -13.831 4.467 339 HB VAL 40 HB VAL 40 -4.641 -14.665 5.272 340 HG11 VAL 40 1HG1 VAL 40 -6.564 -14.814 3.873 341 HG12 VAL 40 2HG1 VAL 40 -5.655 -14.390 2.426 342 HG13 VAL 40 3HG1 VAL 40 -5.979 -13.166 3.653 343 HG21 VAL 40 3HG2 VAL 40 -4.633 -16.711 3.971 344 HG22 VAL 40 1HG2 VAL 40 -2.969 -16.145 4.115 345 HG23 VAL 40 2HG2 VAL 40 -3.860 -15.897 2.613 346 H SER 41 H SER 41 -1.248 -14.066 2.735 347 HA SER 41 HA SER 41 -2.340 -13.874 0.044 348 HB2 SER 41 1HB SER 41 -1.881 -11.515 0.553 349 HB3 SER 41 2HB SER 41 -0.229 -11.936 0.982 350 HG SER 41 HG SER 41 -1.163 -12.797 -1.491 351 H ASP 42 H ASP 42 -0.951 -14.653 -1.544 352 HA ASP 42 HA ASP 42 1.240 -16.387 -0.574 353 HB2 ASP 42 1HB ASP 42 -0.304 -16.273 -3.173 354 HB3 ASP 42 2HB ASP 42 1.056 -17.354 -2.893 355 H TRP 43 H TRP 43 0.661 -13.415 -2.051 356 HA TRP 43 HA TRP 43 1.944 -11.834 -3.099 357 HB2 TRP 43 1HB TRP 43 4.245 -13.332 -1.848 358 HB3 TRP 43 2HB TRP 43 4.253 -11.659 -2.401 359 HD1 TRP 43 HD1 TRP 43 3.844 -13.588 0.629 360 HE1 TRP 43 HE1 TRP 43 2.720 -12.231 2.488 361 HE3 TRP 43 HE3 TRP 43 2.001 -9.686 -2.110 362 HZ2 TRP 43 HZ2 TRP 43 1.231 -9.818 2.795 363 HZ3 TRP 43 HZ3 TRP 43 0.722 -7.881 -1.000 364 HH2 TRP 43 HH2 TRP 43 0.337 -7.940 1.447 365 H LYS 44 H LYS 44 1.210 -13.324 -5.037 366 HA LYS 44 HA LYS 44 3.513 -13.477 -6.797 367 HB2 LYS 44 1HB LYS 44 3.193 -15.811 -7.455 368 HB3 LYS 44 2HB LYS 44 3.602 -15.684 -5.750 369 HG2 LYS 44 1HG LYS 44 1.274 -15.993 -5.114 370 HG3 LYS 44 2HG LYS 44 0.771 -15.961 -6.801 371 HD2 LYS 44 1HD LYS 44 0.881 -18.269 -5.983 372 HD3 LYS 44 2HD LYS 44 2.071 -17.993 -7.253 373 HE2 LYS 44 1HE LYS 44 2.913 -17.624 -4.377 374 HE3 LYS 44 2HE LYS 44 2.794 -19.255 -5.037 375 HZ1 LYS 44 3HZ LYS 44 4.085 -17.764 -6.957 376 HZ2 LYS 44 1HZ LYS 44 4.771 -18.929 -5.933 377 HZ3 LYS 44 2HZ LYS 44 4.785 -17.291 -5.483 378 H GLU 45 H GLU 45 2.937 -13.767 -9.021 379 HA GLU 45 HA GLU 45 0.690 -12.273 -9.783 380 HB2 GLU 45 1HB GLU 45 1.289 -13.478 -12.133 381 HB3 GLU 45 2HB GLU 45 2.279 -12.192 -11.457 382 HG2 GLU 45 1HG GLU 45 3.610 -14.150 -12.225 383 HG3 GLU 45 2HG GLU 45 3.843 -13.799 -10.521 384 H GLY 46 H GLY 46 -1.366 -12.777 -9.733 385 HA2 GLY 46 1HA GLY 46 -3.236 -13.986 -10.612 386 HA3 GLY 46 2HA GLY 46 -2.292 -15.460 -10.561 387 H SER 47 H SER 47 -1.438 -14.282 -7.737 388 HA SER 47 HA SER 47 -3.348 -15.900 -6.296 389 HB2 SER 47 1HB SER 47 -0.928 -14.316 -5.507 390 HB3 SER 47 2HB SER 47 -2.023 -14.921 -4.267 391 HG SER 47 HG SER 47 -1.210 -16.639 -6.322 392 H GLN 48 H GLN 48 -4.995 -15.323 -5.043 393 HA GLN 48 HA GLN 48 -5.928 -12.536 -5.214 394 HB2 GLN 48 1HB GLN 48 -7.433 -14.523 -5.746 395 HB3 GLN 48 2HB GLN 48 -7.392 -14.912 -4.028 396 HG2 GLN 48 1HG GLN 48 -8.354 -12.738 -3.469 397 HG3 GLN 48 2HG GLN 48 -8.286 -12.237 -5.157 398 HE21 GLN 48 2HE2 GLN 48 -10.149 -12.607 -6.352 399 HE22 GLN 48 1HE2 GLN 48 -11.378 -13.695 -5.921 400 H ILE 49 H ILE 49 -6.710 -11.475 -3.262 401 HA ILE 49 HA ILE 49 -5.642 -12.490 -0.706 402 HB ILE 49 HB ILE 49 -4.440 -10.438 -0.210 403 HG12 ILE 49 1HG1 ILE 49 -5.213 -9.561 -3.016 404 HG13 ILE 49 2HG1 ILE 49 -5.834 -8.864 -1.522 405 HG21 ILE 49 1HG2 ILE 49 -3.324 -12.322 -1.495 406 HG22 ILE 49 2HG2 ILE 49 -2.565 -10.745 -1.691 407 HG23 ILE 49 3HG2 ILE 49 -3.598 -11.388 -2.965 408 HD11 ILE 49 3HD1 ILE 49 -2.983 -8.781 -2.530 409 HD12 ILE 49 1HD1 ILE 49 -3.442 -8.321 -0.890 410 HD13 ILE 49 2HD1 ILE 49 -4.073 -7.421 -2.268 411 H VAL 50 H VAL 50 -6.582 -11.634 1.113 412 HA VAL 50 HA VAL 50 -8.769 -9.679 0.783 413 HB VAL 50 HB VAL 50 -10.303 -11.135 2.071 414 HG11 VAL 50 1HG1 VAL 50 -9.285 -12.480 -0.449 415 HG12 VAL 50 2HG1 VAL 50 -10.307 -11.044 -0.445 416 HG13 VAL 50 3HG1 VAL 50 -10.918 -12.562 0.212 417 HG21 VAL 50 3HG2 VAL 50 -9.738 -13.568 2.202 418 HG22 VAL 50 1HG2 VAL 50 -8.675 -12.565 3.190 419 HG23 VAL 50 2HG2 VAL 50 -8.112 -13.186 1.638 420 H TRP 51 H TRP 51 -9.445 -8.711 2.732 421 HA TRP 51 HA TRP 51 -7.611 -9.058 5.054 422 HB2 TRP 51 1HB TRP 51 -8.727 -6.433 4.030 423 HB3 TRP 51 2HB TRP 51 -7.646 -6.655 5.398 424 HD1 TRP 51 HD1 TRP 51 -5.636 -8.721 3.925 425 HE1 TRP 51 HE1 TRP 51 -4.004 -7.810 2.171 426 HE3 TRP 51 HE3 TRP 51 -7.984 -4.355 2.745 427 HZ2 TRP 51 HZ2 TRP 51 -3.719 -5.523 0.488 428 HZ3 TRP 51 HZ3 TRP 51 -7.002 -2.824 1.072 429 HH2 TRP 51 HH2 TRP 51 -4.875 -3.399 -0.064 430 H LYS 52 H LYS 52 -8.783 -9.865 6.649 431 HA LYS 52 HA LYS 52 -11.641 -9.223 6.890 432 HB2 LYS 52 1HB LYS 52 -9.846 -11.114 8.439 433 HB3 LYS 52 2HB LYS 52 -11.568 -10.887 8.752 434 HG2 LYS 52 1HG LYS 52 -12.073 -11.567 6.422 435 HG3 LYS 52 2HG LYS 52 -10.351 -11.834 6.138 436 HD2 LYS 52 1HD LYS 52 -10.318 -13.531 7.936 437 HD3 LYS 52 2HD LYS 52 -12.042 -13.270 8.208 438 HE2 LYS 52 1HE LYS 52 -12.522 -13.977 5.896 439 HE3 LYS 52 2HE LYS 52 -10.799 -14.232 5.612 440 HZ1 LYS 52 3HZ LYS 52 -12.174 -15.572 7.852 441 HZ2 LYS 52 1HZ LYS 52 -10.739 -16.016 7.063 442 HZ3 LYS 52 2HZ LYS 52 -12.233 -16.226 6.283 443 H GLY 53 H GLY 53 -12.492 -7.951 8.441 444 HA2 GLY 53 1HA GLY 53 -11.038 -7.153 10.805 445 HA3 GLY 53 2HA GLY 53 -11.138 -5.869 9.602 446 H GLU 54 H GLU 54 -12.296 -4.935 11.562 447 HA GLU 54 HA GLU 54 -15.209 -5.497 11.379 448 HB2 GLU 54 1HB GLU 54 -14.232 -6.291 13.522 449 HB3 GLU 54 2HB GLU 54 -13.687 -4.647 13.849 450 HG2 GLU 54 1HG GLU 54 -15.995 -3.839 13.817 451 HG3 GLU 54 2HG GLU 54 -16.576 -5.440 13.362 452 H TRP 55 H TRP 55 -16.434 -3.816 10.909 453 HA TRP 55 HA TRP 55 -15.424 -1.055 11.308 454 HB2 TRP 55 1HB TRP 55 -14.967 -1.818 8.961 455 HB3 TRP 55 2HB TRP 55 -16.699 -2.056 8.747 456 HD1 TRP 55 HD1 TRP 55 -18.141 0.020 8.222 457 HE1 TRP 55 HE1 TRP 55 -17.644 2.529 7.907 458 HE3 TRP 55 HE3 TRP 55 -13.307 0.181 9.873 459 HZ2 TRP 55 HZ2 TRP 55 -15.485 4.363 8.301 460 HZ3 TRP 55 HZ3 TRP 55 -12.057 2.322 9.888 461 HH2 TRP 55 HH2 TRP 55 -13.138 4.410 9.106 462 H LYS 56 H LYS 56 -16.851 -0.061 12.527 463 HA LYS 56 HA LYS 56 -18.825 0.590 13.510 464 HB2 LYS 56 1HB LYS 56 -19.802 0.031 10.697 465 HB3 LYS 56 2HB LYS 56 -20.767 0.832 11.936 466 HG2 LYS 56 1HG LYS 56 -19.040 2.590 12.143 467 HG3 LYS 56 2HG LYS 56 -18.086 1.793 10.890 468 HD2 LYS 56 1HD LYS 56 -19.928 2.097 9.282 469 HD3 LYS 56 2HD LYS 56 -20.894 2.883 10.529 470 HE2 LYS 56 1HE LYS 56 -19.174 4.648 10.745 471 HE3 LYS 56 2HE LYS 56 -18.222 3.867 9.481 472 HZ1 LYS 56 3HZ LYS 56 -19.735 4.425 7.869 473 HZ2 LYS 56 1HZ LYS 56 -19.839 5.781 8.883 474 HZ3 LYS 56 2HZ LYS 56 -21.030 4.572 8.961 475 H GLY 57 H GLY 57 -18.082 -2.113 13.904 476 HA2 GLY 57 1HA GLY 57 -18.999 -3.944 14.999 477 HA3 GLY 57 2HA GLY 57 -20.589 -3.207 14.822 478 H LYS 58 H LYS 58 -19.519 -3.041 11.816 479 HA LYS 58 HA LYS 58 -20.739 -5.630 11.025 480 HB2 LYS 58 1HB LYS 58 -21.725 -3.504 10.162 481 HB3 LYS 58 2HB LYS 58 -20.198 -3.168 9.347 482 HG2 LYS 58 1HG LYS 58 -20.407 -5.206 8.023 483 HG3 LYS 58 2HG LYS 58 -21.867 -5.662 8.904 484 HD2 LYS 58 1HD LYS 58 -22.994 -3.622 8.080 485 HD3 LYS 58 2HD LYS 58 -21.540 -3.186 7.183 486 HE2 LYS 58 1HE LYS 58 -21.717 -5.246 5.858 487 HE3 LYS 58 2HE LYS 58 -23.142 -5.731 6.779 488 HZ1 LYS 58 3HZ LYS 58 -22.847 -3.500 4.870 489 HZ2 LYS 58 1HZ LYS 58 -24.075 -3.484 6.040 490 HZ3 LYS 58 2HZ LYS 58 -24.013 -4.735 4.893 491 H ALA 59 H ALA 59 -19.392 -7.201 10.499 492 HA ALA 59 HA ALA 59 -16.606 -6.837 10.040 493 HB1 ALA 59 3HB ALA 59 -18.292 -9.252 9.353 494 HB2 ALA 59 1HB ALA 59 -17.635 -8.925 10.957 495 HB3 ALA 59 2HB ALA 59 -16.545 -9.213 9.601 496 H TYR 60 H TYR 60 -15.528 -6.417 8.214 497 HA TYR 60 HA TYR 60 -16.927 -6.722 5.597 498 HB2 TYR 60 1HB TYR 60 -16.078 -4.620 4.859 499 HB3 TYR 60 2HB TYR 60 -16.770 -4.326 6.451 500 HD1 TYR 60 HD1 TYR 60 -15.177 -4.448 8.499 501 HD2 TYR 60 HD2 TYR 60 -13.799 -4.056 4.445 502 HE1 TYR 60 HE1 TYR 60 -12.982 -3.635 9.318 503 HE2 TYR 60 HE2 TYR 60 -11.616 -3.238 5.263 504 HH TYR 60 HH TYR 60 -10.826 -2.022 7.506 505 H GLU 61 H GLU 61 -15.632 -7.190 3.818 506 HA GLU 61 HA GLU 61 -12.813 -7.927 4.349 507 HB2 GLU 61 1HB GLU 61 -14.129 -9.969 4.572 508 HB3 GLU 61 2HB GLU 61 -14.844 -9.701 2.981 509 HG2 GLU 61 1HG GLU 61 -12.644 -9.910 1.926 510 HG3 GLU 61 2HG GLU 61 -11.875 -10.038 3.507 511 H ASP 62 H ASP 62 -11.473 -7.239 2.883 512 HA ASP 62 HA ASP 62 -12.436 -5.829 0.515 513 HB2 ASP 62 1HB ASP 62 -9.624 -6.238 1.578 514 HB3 ASP 62 2HB ASP 62 -10.091 -5.144 0.274 515 H LYS 63 H LYS 63 -11.162 -6.241 -1.583 516 HA LYS 63 HA LYS 63 -10.228 -8.994 -1.927 517 HB2 LYS 63 1HB LYS 63 -12.708 -9.153 -2.020 518 HB3 LYS 63 2HB LYS 63 -12.700 -8.040 -3.386 519 HG2 LYS 63 1HG LYS 63 -11.353 -9.598 -4.698 520 HG3 LYS 63 2HG LYS 63 -11.239 -10.695 -3.320 521 HD2 LYS 63 1HD LYS 63 -13.704 -10.956 -3.339 522 HD3 LYS 63 2HD LYS 63 -13.798 -9.882 -4.734 523 HE2 LYS 63 1HE LYS 63 -12.202 -11.520 -5.915 524 HE3 LYS 63 2HE LYS 63 -12.545 -12.633 -4.586 525 HZ1 LYS 63 3HZ LYS 63 -14.251 -13.231 -5.877 526 HZ2 LYS 63 1HZ LYS 63 -14.223 -11.800 -6.785 527 HZ3 LYS 63 2HZ LYS 63 -15.002 -11.832 -5.275 528 H GLY 64 H GLY 64 -8.626 -9.011 -3.308 529 HA2 GLY 64 1HA GLY 64 -8.670 -7.457 -5.776 530 HA3 GLY 64 2HA GLY 64 -7.409 -7.015 -4.625 531 H THR 65 H THR 65 -6.389 -7.838 -6.880 532 HA THR 65 HA THR 65 -5.303 -10.513 -6.274 533 HB THR 65 HB THR 65 -6.446 -9.783 -8.982 534 HG1 THR 65 HG1 THR 65 -7.297 -11.891 -7.346 535 HG21 THR 65 3HG2 THR 65 -5.963 -12.229 -9.418 536 HG22 THR 65 1HG2 THR 65 -5.031 -12.243 -7.920 537 HG23 THR 65 2HG2 THR 65 -4.530 -11.213 -9.262 538 H ILE 66 H ILE 66 -3.308 -10.965 -7.260 539 HA ILE 66 HA ILE 66 -1.644 -8.623 -7.598 540 HB ILE 66 HB ILE 66 -0.948 -11.534 -8.022 541 HG12 ILE 66 1HG1 ILE 66 -1.798 -11.179 -5.748 542 HG13 ILE 66 2HG1 ILE 66 -0.062 -11.444 -5.704 543 HG21 ILE 66 1HG2 ILE 66 0.755 -9.072 -7.539 544 HG22 ILE 66 2HG2 ILE 66 0.700 -10.030 -9.017 545 HG23 ILE 66 3HG2 ILE 66 1.366 -10.724 -7.540 546 HD11 ILE 66 3HD1 ILE 66 0.068 -8.802 -5.759 547 HD12 ILE 66 1HD1 ILE 66 -0.329 -9.623 -4.252 548 HD13 ILE 66 2HD1 ILE 66 -1.607 -8.903 -5.226 549 H LEU 67 H LEU 67 -1.606 -7.526 -9.434 550 HA LEU 67 HA LEU 67 -2.373 -8.681 -11.973 551 HB2 LEU 67 1HB LEU 67 -1.244 -5.976 -11.226 552 HB3 LEU 67 2HB LEU 67 -1.753 -6.409 -12.856 553 HG LEU 67 HG LEU 67 -3.595 -6.598 -10.443 554 HD11 LEU 67 1HD1 LEU 67 -4.581 -4.465 -11.275 555 HD12 LEU 67 2HD1 LEU 67 -3.264 -4.341 -12.441 556 HD13 LEU 67 3HD1 LEU 67 -2.921 -4.271 -10.712 557 HD21 LEU 67 3HD2 LEU 67 -5.327 -6.362 -12.400 558 HD22 LEU 67 1HD2 LEU 67 -4.538 -7.917 -12.183 559 HD23 LEU 67 2HD2 LEU 67 -3.988 -6.820 -13.447 560 H GLN 68 H GLN 68 0.641 -7.527 -10.516 561 HA GLN 68 HA GLN 68 2.190 -9.332 -12.223 562 HB2 GLN 68 1HB GLN 68 2.039 -7.230 -13.546 563 HB3 GLN 68 2HB GLN 68 2.737 -6.349 -12.190 564 HG2 GLN 68 1HG GLN 68 4.794 -7.617 -12.338 565 HG3 GLN 68 2HG GLN 68 4.099 -8.691 -13.549 566 HE21 GLN 68 2HE2 GLN 68 6.490 -7.162 -14.047 567 HE22 GLN 68 1HE2 GLN 68 6.138 -6.022 -15.254 568 H PHE 69 H PHE 69 4.238 -9.796 -11.358 569 HA PHE 69 HA PHE 69 4.925 -8.564 -8.745 570 HB2 PHE 69 1HB PHE 69 3.618 -10.659 -8.344 571 HB3 PHE 69 2HB PHE 69 4.854 -11.554 -9.225 572 HD1 PHE 69 HD2 PHE 69 7.218 -11.590 -8.380 573 HD2 PHE 69 HD1 PHE 69 4.003 -9.930 -6.064 574 HE1 PHE 69 HE2 PHE 69 8.624 -11.704 -6.342 575 HE2 PHE 69 HE1 PHE 69 5.409 -10.046 -4.025 576 HZ PHE 69 HZ PHE 69 7.720 -10.932 -4.166 577 H ASN 70 H ASN 70 6.872 -7.735 -9.035 578 HA ASN 70 HA ASN 70 8.979 -9.394 -10.332 579 HB2 ASN 70 1HB ASN 70 8.170 -7.402 -11.718 580 HB3 ASN 70 2HB ASN 70 8.863 -6.372 -10.471 581 HD21 ASN 70 2HD2 ASN 70 9.837 -6.483 -13.219 582 HD22 ASN 70 1HD2 ASN 70 11.424 -7.082 -13.164 583 H GLU 71 H GLU 71 10.028 -10.112 -8.621 584 HA GLU 71 HA GLU 71 10.317 -9.101 -6.097 585 HB2 GLU 71 1HB GLU 71 11.092 -11.330 -6.860 586 HB3 GLU 71 2HB GLU 71 12.472 -10.560 -7.637 587 HG2 GLU 71 1HG GLU 71 13.273 -9.726 -5.489 588 HG3 GLU 71 2HG GLU 71 11.838 -10.351 -4.680 589 H ARG 72 H ARG 72 11.299 -7.469 -5.160 590 HA ARG 72 HA ARG 72 12.379 -5.436 -4.948 591 HB2 ARG 72 1HB ARG 72 14.530 -7.265 -6.023 592 HB3 ARG 72 2HB ARG 72 14.860 -5.670 -5.342 593 HG2 ARG 72 1HG ARG 72 13.806 -6.346 -3.222 594 HG3 ARG 72 2HG ARG 72 13.448 -7.935 -3.896 595 HD2 ARG 72 1HD ARG 72 15.852 -8.366 -4.189 596 HD3 ARG 72 2HD ARG 72 16.220 -6.763 -3.558 597 HE ARG 72 HE ARG 72 15.711 -7.509 -1.402 598 HH11 ARG 72 1HH2 ARG 72 14.849 -9.862 -3.798 599 HH12 ARG 72 2HH2 ARG 72 14.540 -11.117 -2.646 600 HH21 ARG 72 1HH1 ARG 72 15.302 -9.155 0.103 601 HH22 ARG 72 2HH1 ARG 72 14.793 -10.718 -0.444 602 H SER 73 H SER 73 10.867 -4.985 -7.084 603 HA SER 73 HA SER 73 12.462 -3.171 -8.643 604 HB2 SER 73 1HB SER 73 13.035 -5.282 -9.774 605 HB3 SER 73 2HB SER 73 11.328 -5.586 -10.062 606 HG SER 73 HG SER 73 12.826 -4.379 -11.682 607 H ILE 74 H ILE 74 9.523 -5.043 -9.431 608 HA ILE 74 HA ILE 74 7.921 -2.541 -9.236 609 HB ILE 74 HB ILE 74 7.851 -4.491 -11.567 610 HG12 ILE 74 1HG1 ILE 74 8.658 -1.558 -11.498 611 HG13 ILE 74 2HG1 ILE 74 9.811 -2.887 -11.504 612 HG21 ILE 74 1HG2 ILE 74 6.230 -2.009 -10.899 613 HG22 ILE 74 2HG2 ILE 74 5.617 -3.645 -11.130 614 HG23 ILE 74 3HG2 ILE 74 6.251 -2.747 -12.500 615 HD11 ILE 74 3HD1 ILE 74 7.785 -2.261 -13.661 616 HD12 ILE 74 1HD1 ILE 74 8.796 -3.706 -13.638 617 HD13 ILE 74 2HD1 ILE 74 9.538 -2.113 -13.782 618 H LEU 75 H LEU 75 6.088 -2.756 -8.206 619 HA LEU 75 HA LEU 75 4.734 -5.384 -8.062 620 HB2 LEU 75 1HB LEU 75 6.226 -4.995 -6.020 621 HB3 LEU 75 2HB LEU 75 5.169 -3.647 -5.617 622 HG LEU 75 HG LEU 75 3.225 -5.461 -5.886 623 HD11 LEU 75 1HD1 LEU 75 5.650 -7.187 -5.279 624 HD12 LEU 75 2HD1 LEU 75 4.630 -7.299 -6.711 625 HD13 LEU 75 3HD1 LEU 75 3.977 -7.711 -5.131 626 HD21 LEU 75 3HD2 LEU 75 5.116 -5.367 -3.527 627 HD22 LEU 75 1HD2 LEU 75 3.494 -6.060 -3.478 628 HD23 LEU 75 2HD2 LEU 75 3.710 -4.339 -3.788 629 H GLN 76 H GLN 76 2.705 -5.117 -8.679 630 HA GLN 76 HA GLN 76 1.193 -2.725 -7.827 631 HB2 GLN 76 1HB GLN 76 0.214 -2.559 -10.127 632 HB3 GLN 76 2HB GLN 76 1.927 -2.149 -10.060 633 HG2 GLN 76 1HG GLN 76 2.538 -4.355 -10.884 634 HG3 GLN 76 2HG GLN 76 0.853 -4.869 -10.855 635 HE21 GLN 76 2HE2 GLN 76 1.254 -5.250 -13.272 636 HE22 GLN 76 1HE2 GLN 76 1.076 -3.926 -14.319 637 H TYR 77 H TYR 77 -1.004 -3.069 -7.566 638 HA TYR 77 HA TYR 77 -2.144 -5.666 -8.294 639 HB2 TYR 77 1HB TYR 77 -2.861 -6.139 -5.959 640 HB3 TYR 77 2HB TYR 77 -1.118 -6.232 -6.189 641 HD1 TYR 77 HD2 TYR 77 -3.880 -4.124 -4.866 642 HD2 TYR 77 HD1 TYR 77 0.374 -4.697 -5.060 643 HE1 TYR 77 HE2 TYR 77 -3.572 -2.435 -3.080 644 HE2 TYR 77 HE1 TYR 77 0.679 -3.007 -3.271 645 HH TYR 77 HH TYR 77 -0.337 -1.698 -1.788 646 H SER 78 H SER 78 -4.395 -5.838 -7.955 647 HA SER 78 HA SER 78 -5.805 -3.317 -8.384 648 HB2 SER 78 1HB SER 78 -7.790 -4.884 -8.600 649 HB3 SER 78 2HB SER 78 -6.494 -5.171 -9.754 650 HG SER 78 HG SER 78 -6.079 -7.023 -8.822 651 H HIS 79 H HIS 79 -7.449 -2.515 -6.970 652 HA HIS 79 HA HIS 79 -7.699 -3.828 -4.336 653 HB2 HIS 79 1HB HIS 79 -5.850 -2.235 -4.077 654 HB3 HIS 79 2HB HIS 79 -6.874 -0.934 -4.687 655 HD1 HIS 79 HD1 HIS 79 -7.452 0.457 -2.685 656 HD2 HIS 79 HD2 HIS 79 -7.799 -3.619 -1.893 657 HE1 HIS 79 HE1 HIS 79 -8.491 0.260 -0.384 658 HE2 HIS 79 HE2 HIS 79 -8.713 -2.220 0.111 659 H PHE 80 H PHE 80 -9.637 -3.754 -3.504 660 HA PHE 80 HA PHE 80 -11.558 -1.675 -4.298 661 HB2 PHE 80 1HB PHE 80 -11.969 -3.434 -5.915 662 HB3 PHE 80 2HB PHE 80 -12.015 -4.652 -4.640 663 HD1 PHE 80 HD2 PHE 80 -13.608 -1.344 -5.469 664 HD2 PHE 80 HD1 PHE 80 -14.168 -5.293 -3.868 665 HE1 PHE 80 HE2 PHE 80 -16.016 -0.875 -5.150 666 HE2 PHE 80 HE1 PHE 80 -16.574 -4.817 -3.546 667 HZ PHE 80 HZ PHE 80 -17.500 -2.610 -4.187 668 H SER 81 H SER 81 -12.788 -1.045 -2.667 669 HA SER 81 HA SER 81 -13.180 -2.801 -0.329 670 HB2 SER 81 1HB SER 81 -12.631 -0.910 1.199 671 HB3 SER 81 2HB SER 81 -11.249 -1.488 0.275 672 HG SER 81 HG SER 81 -11.367 0.272 -1.014 673 HA PRO 82 HA PRO 82 -17.213 -0.911 -0.971 674 HB2 PRO 82 1HB PRO 82 -18.591 -1.977 1.146 675 HB3 PRO 82 2HB PRO 82 -18.153 -2.928 -0.289 676 HG2 PRO 82 1HG PRO 82 -16.804 -2.821 2.387 677 HG3 PRO 82 2HG PRO 82 -17.146 -4.226 1.359 678 HD2 PRO 82 1HD PRO 82 -14.671 -3.026 1.462 679 HD3 PRO 82 2HD PRO 82 -15.273 -3.868 0.012 680 H LEU 83 H LEU 83 -15.325 -0.517 1.913 681 HA LEU 83 HA LEU 83 -16.938 1.332 3.319 682 HB2 LEU 83 1HB LEU 83 -13.915 1.224 3.247 683 HB3 LEU 83 2HB LEU 83 -14.918 1.922 4.516 684 HG LEU 83 HG LEU 83 -14.892 -1.010 3.719 685 HD11 LEU 83 1HD1 LEU 83 -13.841 -1.274 5.998 686 HD12 LEU 83 2HD1 LEU 83 -13.685 0.481 6.072 687 HD13 LEU 83 3HD1 LEU 83 -12.822 -0.431 4.831 688 HD21 LEU 83 3HD2 LEU 83 -16.469 0.575 5.771 689 HD22 LEU 83 1HD2 LEU 83 -16.145 -1.142 6.019 690 HD23 LEU 83 2HD2 LEU 83 -17.055 -0.616 4.611 691 H THR 84 H THR 84 -15.727 1.628 0.283 692 HA THR 84 HA THR 84 -14.741 4.300 0.249 693 HB THR 84 HB THR 84 -15.280 4.139 -2.242 694 HG1 THR 84 HG1 THR 84 -17.006 2.608 -1.872 695 HG21 THR 84 3HG2 THR 84 -13.069 3.544 -1.539 696 HG22 THR 84 1HG2 THR 84 -13.617 2.243 -2.596 697 HG23 THR 84 2HG2 THR 84 -13.626 2.022 -0.847 698 H GLY 85 H GLY 85 -17.899 3.039 0.586 699 HA2 GLY 85 1HA GLY 85 -19.886 4.173 1.001 700 HA3 GLY 85 2HA GLY 85 -19.055 5.694 0.690 701 H LYS 86 H LYS 86 -18.581 3.350 -1.731 702 HA LYS 86 HA LYS 86 -20.861 4.275 -3.370 703 HB2 LYS 86 1HB LYS 86 -17.952 4.535 -4.143 704 HB3 LYS 86 2HB LYS 86 -19.305 4.753 -5.250 705 HG2 LYS 86 1HG LYS 86 -20.174 6.546 -3.663 706 HG3 LYS 86 2HG LYS 86 -18.653 6.398 -2.789 707 HD2 LYS 86 1HD LYS 86 -18.127 8.160 -4.248 708 HD3 LYS 86 2HD LYS 86 -17.566 6.785 -5.197 709 HE2 LYS 86 1HE LYS 86 -18.895 8.281 -6.605 710 HE3 LYS 86 2HE LYS 86 -19.766 6.765 -6.392 711 HZ1 LYS 86 3HZ LYS 86 -20.848 9.155 -5.969 712 HZ2 LYS 86 1HZ LYS 86 -20.286 8.814 -4.406 713 HZ3 LYS 86 2HZ LYS 86 -21.360 7.744 -5.174 714 HA PRO 87 HA PRO 87 -19.782 -0.195 -4.036 715 HB2 PRO 87 1HB PRO 87 -22.309 -1.236 -3.889 716 HB3 PRO 87 2HB PRO 87 -21.331 -0.908 -2.441 717 HG2 PRO 87 1HG PRO 87 -23.520 0.747 -3.655 718 HG3 PRO 87 2HG PRO 87 -23.222 0.361 -1.947 719 HD2 PRO 87 1HD PRO 87 -22.482 2.748 -3.069 720 HD3 PRO 87 2HD PRO 87 -21.581 2.019 -1.722 721 H ASP 88 H ASP 88 -20.576 2.147 -5.873 722 HA ASP 88 HA ASP 88 -22.279 1.277 -7.919 723 HB2 ASP 88 1HB ASP 88 -19.933 3.188 -7.936 724 HB3 ASP 88 2HB ASP 88 -21.015 2.971 -9.311 725 H LEU 89 H LEU 89 -21.257 1.174 -10.264 726 HA LEU 89 HA LEU 89 -20.407 -1.316 -10.793 727 HB2 LEU 89 1HB LEU 89 -19.376 1.002 -12.432 728 HB3 LEU 89 2HB LEU 89 -19.856 -0.600 -12.992 729 HG LEU 89 HG LEU 89 -21.669 1.589 -11.917 730 HD11 LEU 89 1HD1 LEU 89 -20.911 1.806 -14.261 731 HD12 LEU 89 2HD1 LEU 89 -22.646 1.499 -14.152 732 HD13 LEU 89 3HD1 LEU 89 -21.546 0.195 -14.601 733 HD21 LEU 89 3HD2 LEU 89 -22.244 -1.322 -12.561 734 HD22 LEU 89 1HD2 LEU 89 -23.512 -0.096 -12.528 735 HD23 LEU 89 2HD2 LEU 89 -22.598 -0.455 -11.067 736 HA PRO 90 HA PRO 90 -16.248 -1.929 -9.388 737 HB2 PRO 90 1HB PRO 90 -15.563 -2.852 -12.178 738 HB3 PRO 90 2HB PRO 90 -15.238 -3.652 -10.623 739 HG2 PRO 90 1HG PRO 90 -17.212 -4.480 -12.232 740 HG3 PRO 90 2HG PRO 90 -17.389 -4.501 -10.466 741 HD2 PRO 90 1HD PRO 90 -18.633 -2.624 -12.452 742 HD3 PRO 90 2HD PRO 90 -19.237 -3.180 -10.874 743 H GLU 91 H GLU 91 -16.606 -0.387 -12.558 744 HA GLU 91 HA GLU 91 -14.103 0.692 -12.972 745 HB2 GLU 91 1HB GLU 91 -16.054 0.926 -14.506 746 HB3 GLU 91 2HB GLU 91 -16.727 2.139 -13.421 747 HG2 GLU 91 1HG GLU 91 -14.799 3.590 -13.774 748 HG3 GLU 91 2HG GLU 91 -14.010 2.356 -14.755 749 H ASN 92 H ASN 92 -16.245 1.354 -10.403 750 HA ASN 92 HA ASN 92 -15.425 4.005 -9.744 751 HB2 ASN 92 1HB ASN 92 -17.540 2.983 -8.974 752 HB3 ASN 92 2HB ASN 92 -16.616 1.866 -7.972 753 HD21 ASN 92 2HD2 ASN 92 -16.821 2.574 -5.846 754 HD22 ASN 92 1HD2 ASN 92 -16.636 4.184 -5.342 755 H TYR 93 H TYR 93 -13.726 1.105 -9.546 756 HA TYR 93 HA TYR 93 -12.146 1.923 -7.179 757 HB2 TYR 93 1HB TYR 93 -11.523 -0.303 -6.921 758 HB3 TYR 93 2HB TYR 93 -13.127 -0.468 -7.618 759 HD1 TYR 93 HD2 TYR 93 -12.342 0.289 -10.538 760 HD2 TYR 93 HD1 TYR 93 -10.615 -2.395 -7.656 761 HE1 TYR 93 HE2 TYR 93 -11.412 -1.073 -12.367 762 HE2 TYR 93 HE1 TYR 93 -9.680 -3.754 -9.494 763 HH TYR 93 HH TYR 93 -9.010 -3.305 -11.962 764 H HIS 94 H HIS 94 -9.726 1.231 -7.421 765 HA HIS 94 HA HIS 94 -8.607 2.031 -10.038 766 HB2 HIS 94 1HB HIS 94 -6.924 3.486 -8.620 767 HB3 HIS 94 2HB HIS 94 -8.484 4.150 -9.056 768 HD1 HIS 94 HD1 HIS 94 -9.067 5.555 -7.057 769 HD2 HIS 94 HD2 HIS 94 -7.807 1.734 -5.965 770 HE1 HIS 94 HE1 HIS 94 -9.453 5.360 -4.563 771 HE2 HIS 94 HE2 HIS 94 -8.693 3.033 -3.882 772 H VAL 95 H VAL 95 -6.334 1.645 -10.225 773 HA VAL 95 HA VAL 95 -5.460 -0.746 -8.686 774 HB VAL 95 HB VAL 95 -4.590 0.225 -11.425 775 HG11 VAL 95 1HG1 VAL 95 -3.549 -2.057 -11.533 776 HG12 VAL 95 2HG1 VAL 95 -3.946 -2.282 -9.832 777 HG13 VAL 95 3HG1 VAL 95 -2.806 -1.027 -10.315 778 HG21 VAL 95 3HG2 VAL 95 -5.841 -1.813 -12.189 779 HG22 VAL 95 1HG2 VAL 95 -6.888 -0.587 -11.473 780 HG23 VAL 95 2HG2 VAL 95 -6.437 -2.015 -10.541 781 H VAL 96 H VAL 96 -3.735 -0.603 -7.447 782 HA VAL 96 HA VAL 96 -2.231 1.929 -7.333 783 HB VAL 96 HB VAL 96 -2.076 -0.463 -5.479 784 HG11 VAL 96 1HG1 VAL 96 -0.148 1.024 -5.321 785 HG12 VAL 96 2HG1 VAL 96 -1.181 1.265 -3.912 786 HG13 VAL 96 3HG1 VAL 96 -1.205 2.432 -5.230 787 HG21 VAL 96 3HG2 VAL 96 -3.574 0.883 -4.021 788 HG22 VAL 96 1HG2 VAL 96 -4.362 0.433 -5.532 789 HG23 VAL 96 2HG2 VAL 96 -3.742 2.069 -5.314 790 H THR 97 H THR 97 -0.218 2.154 -8.016 791 HA THR 97 HA THR 97 1.377 -0.266 -8.718 792 HB THR 97 HB THR 97 0.710 0.678 -10.807 793 HG1 THR 97 HG1 THR 97 2.893 0.172 -10.688 794 HG21 THR 97 3HG2 THR 97 1.706 3.370 -9.844 795 HG22 THR 97 1HG2 THR 97 0.005 2.907 -9.883 796 HG23 THR 97 2HG2 THR 97 0.925 3.014 -11.380 797 H ILE 98 H ILE 98 3.152 -0.439 -7.612 798 HA ILE 98 HA ILE 98 4.476 1.999 -6.532 799 HB ILE 98 HB ILE 98 4.431 -0.762 -5.280 800 HG12 ILE 98 1HG1 ILE 98 2.936 1.736 -4.387 801 HG13 ILE 98 2HG1 ILE 98 2.181 0.416 -5.276 802 HG21 ILE 98 1HG2 ILE 98 5.413 0.392 -3.355 803 HG22 ILE 98 2HG2 ILE 98 5.297 1.939 -4.190 804 HG23 ILE 98 3HG2 ILE 98 6.401 0.704 -4.775 805 HD11 ILE 98 3HD1 ILE 98 3.546 0.181 -2.580 806 HD12 ILE 98 1HD1 ILE 98 2.861 -1.165 -3.490 807 HD13 ILE 98 2HD1 ILE 98 1.809 0.110 -2.877 808 H THR 99 H THR 99 6.553 2.265 -7.017 809 HA THR 99 HA THR 99 8.119 -0.005 -8.146 810 HB THR 99 HB THR 99 8.119 2.868 -9.125 811 HG1 THR 99 HG1 THR 99 7.520 1.063 -10.971 812 HG21 THR 99 3HG2 THR 99 9.536 1.820 -10.961 813 HG22 THR 99 1HG2 THR 99 9.665 0.385 -9.944 814 HG23 THR 99 2HG2 THR 99 10.321 1.924 -9.386 815 H LEU 100 H LEU 100 9.788 -0.405 -6.863 816 HA LEU 100 HA LEU 100 10.991 1.804 -5.273 817 HB2 LEU 100 1HB LEU 100 10.667 -1.145 -4.798 818 HB3 LEU 100 2HB LEU 100 12.098 -0.371 -4.123 819 HG LEU 100 HG LEU 100 10.632 1.300 -2.996 820 HD11 LEU 100 1HD1 LEU 100 8.449 -0.409 -4.206 821 HD12 LEU 100 2HD1 LEU 100 8.704 1.324 -4.411 822 HD13 LEU 100 3HD1 LEU 100 8.174 0.691 -2.857 823 HD21 LEU 100 3HD2 LEU 100 9.845 -0.182 -1.267 824 HD22 LEU 100 1HD2 LEU 100 11.365 -0.823 -1.881 825 HD23 LEU 100 2HD2 LEU 100 9.832 -1.551 -2.368 826 H THR 101 H THR 101 13.006 2.403 -5.523 827 HA THR 101 HA THR 101 14.801 0.854 -7.320 828 HB THR 101 HB THR 101 15.605 2.999 -8.227 829 HG1 THR 101 HG1 THR 101 15.136 4.545 -6.836 830 HG21 THR 101 3HG2 THR 101 13.685 3.437 -9.648 831 HG22 THR 101 1HG2 THR 101 12.602 2.696 -8.470 832 HG23 THR 101 2HG2 THR 101 13.777 1.704 -9.335 833 H ALA 102 H ALA 102 16.748 0.494 -6.523 834 HA ALA 102 HA ALA 102 17.495 1.721 -3.946 835 HB1 ALA 102 3HB ALA 102 17.576 -0.774 -4.283 836 HB2 ALA 102 1HB ALA 102 19.094 -0.057 -3.745 837 HB3 ALA 102 2HB ALA 102 18.886 -0.518 -5.437 838 H LEU 103 H LEU 103 18.513 3.613 -4.176 839 HA LEU 103 HA LEU 103 20.404 4.057 -6.401 840 HB2 LEU 103 1HB LEU 103 19.498 6.034 -4.293 841 HB3 LEU 103 2HB LEU 103 20.223 6.379 -5.863 842 HG LEU 103 HG LEU 103 17.485 5.167 -5.352 843 HD11 LEU 103 1HD1 LEU 103 17.566 7.576 -5.000 844 HD12 LEU 103 2HD1 LEU 103 16.731 7.244 -6.517 845 HD13 LEU 103 3HD1 LEU 103 18.402 7.805 -6.534 846 HD21 LEU 103 3HD2 LEU 103 17.307 5.468 -7.928 847 HD22 LEU 103 1HD2 LEU 103 18.248 4.098 -7.346 848 HD23 LEU 103 2HD2 LEU 103 19.068 5.552 -7.915 849 H LYS 104 H LYS 104 22.416 5.238 -5.837 850 HA LYS 104 HA LYS 104 24.053 3.717 -4.162 851 HB2 LYS 104 1HB LYS 104 24.846 5.050 -6.089 852 HB3 LYS 104 2HB LYS 104 24.538 6.520 -5.166 853 HG2 LYS 104 1HG LYS 104 26.186 5.917 -3.507 854 HG3 LYS 104 2HG LYS 104 26.376 4.310 -4.201 855 HD2 LYS 104 1HD LYS 104 28.244 5.686 -4.917 856 HD3 LYS 104 2HD LYS 104 27.216 5.363 -6.310 857 HE2 LYS 104 1HE LYS 104 26.321 7.571 -6.295 858 HE3 LYS 104 2HE LYS 104 26.894 7.887 -4.655 859 HZ1 LYS 104 3HZ LYS 104 29.123 7.204 -6.107 860 HZ2 LYS 104 1HZ LYS 104 28.687 8.754 -5.577 861 HZ3 LYS 104 2HZ LYS 104 28.235 8.230 -7.129 862 H LYS 105 H LYS 105 22.490 6.825 -3.541 863 HA LYS 105 HA LYS 105 23.711 7.217 -0.958 864 HB2 LYS 105 1HB LYS 105 21.236 8.520 -2.115 865 HB3 LYS 105 2HB LYS 105 22.166 9.094 -0.738 866 HG2 LYS 105 1HG LYS 105 23.323 8.799 -3.526 867 HG3 LYS 105 2HG LYS 105 22.636 10.301 -2.915 868 HD2 LYS 105 1HD LYS 105 24.304 10.216 -1.026 869 HD3 LYS 105 2HD LYS 105 25.051 8.827 -1.809 870 HE2 LYS 105 1HE LYS 105 25.487 10.145 -3.821 871 HE3 LYS 105 2HE LYS 105 24.708 11.546 -3.086 872 HZ1 LYS 105 3HZ LYS 105 26.437 11.020 -1.198 873 HZ2 LYS 105 1HZ LYS 105 26.854 11.970 -2.539 874 HZ3 LYS 105 2HZ LYS 105 27.298 10.330 -2.489 875 H GLY 106 H GLY 106 20.600 5.980 -2.099 876 HA2 GLY 106 1HA GLY 106 20.225 4.376 0.218 877 HA3 GLY 106 2HA GLY 106 19.237 5.831 0.318 878 H VAL 107 H VAL 107 17.232 4.985 0.016 879 HA VAL 107 HA VAL 107 16.662 3.736 -2.619 880 HB VAL 107 HB VAL 107 16.667 1.919 -1.038 881 HG11 VAL 107 1HG1 VAL 107 15.353 1.950 1.013 882 HG12 VAL 107 2HG1 VAL 107 14.754 3.560 0.633 883 HG13 VAL 107 3HG1 VAL 107 16.458 3.323 1.016 884 HG21 VAL 107 3HG2 VAL 107 13.748 2.716 -1.330 885 HG22 VAL 107 1HG2 VAL 107 14.435 1.091 -1.308 886 HG23 VAL 107 2HG2 VAL 107 14.715 2.145 -2.693 887 H GLU 108 H GLU 108 14.895 4.436 -3.624 888 HA GLU 108 HA GLU 108 13.164 6.448 -2.266 889 HB2 GLU 108 1HB GLU 108 14.034 6.243 -5.162 890 HB3 GLU 108 2HB GLU 108 12.779 7.340 -4.583 891 HG2 GLU 108 1HG GLU 108 14.385 8.408 -3.063 892 HG3 GLU 108 2HG GLU 108 15.645 7.296 -3.588 893 H VAL 109 H VAL 109 11.000 6.292 -2.510 894 HA VAL 109 HA VAL 109 9.896 3.934 -3.959 895 HB VAL 109 HB VAL 109 9.898 3.328 -1.635 896 HG11 VAL 109 1HG1 VAL 109 10.262 5.490 -0.614 897 HG12 VAL 109 2HG1 VAL 109 8.780 4.808 0.059 898 HG13 VAL 109 3HG1 VAL 109 8.691 6.068 -1.171 899 HG21 VAL 109 3HG2 VAL 109 7.092 4.391 -2.109 900 HG22 VAL 109 1HG2 VAL 109 7.574 2.911 -1.277 901 HG23 VAL 109 2HG2 VAL 109 7.733 3.033 -3.028 902 H GLU 110 H GLU 110 7.770 4.145 -4.687 903 HA GLU 110 HA GLU 110 6.536 6.820 -4.619 904 HB2 GLU 110 1HB GLU 110 7.986 6.898 -6.583 905 HB3 GLU 110 2HB GLU 110 7.308 5.387 -7.181 906 HG2 GLU 110 1HG GLU 110 5.146 6.392 -7.507 907 HG3 GLU 110 2HG GLU 110 5.636 7.864 -6.670 908 H LEU 111 H LEU 111 4.398 6.745 -4.567 909 HA LEU 111 HA LEU 111 2.971 4.244 -5.305 910 HB2 LEU 111 1HB LEU 111 3.272 4.334 -2.855 911 HB3 LEU 111 2HB LEU 111 2.494 5.911 -2.813 912 HG LEU 111 HG LEU 111 0.895 3.774 -4.203 913 HD11 LEU 111 1HD1 LEU 111 0.111 2.763 -2.095 914 HD12 LEU 111 2HD1 LEU 111 1.323 3.682 -1.202 915 HD13 LEU 111 3HD1 LEU 111 1.827 2.448 -2.356 916 HD21 LEU 111 3HD2 LEU 111 -0.948 4.814 -2.976 917 HD22 LEU 111 1HD2 LEU 111 0.037 6.083 -3.703 918 HD23 LEU 111 2HD2 LEU 111 0.189 5.727 -1.988 919 H THR 112 H THR 112 0.920 4.526 -6.145 920 HA THR 112 HA THR 112 -0.117 7.276 -6.453 921 HB THR 112 HB THR 112 -0.415 7.010 -8.850 922 HG1 THR 112 HG1 THR 112 -0.226 5.132 -9.733 923 HG21 THR 112 3HG2 THR 112 2.436 6.303 -8.125 924 HG22 THR 112 1HG2 THR 112 1.749 7.917 -7.935 925 HG23 THR 112 2HG2 THR 112 1.887 7.201 -9.540 926 H GLN 113 H GLN 113 -2.287 7.423 -6.933 927 HA GLN 113 HA GLN 113 -3.898 4.945 -6.982 928 HB2 GLN 113 1HB GLN 113 -3.651 5.703 -4.595 929 HB3 GLN 113 2HB GLN 113 -4.448 7.211 -5.043 930 HG2 GLN 113 1HG GLN 113 -6.416 5.887 -5.843 931 HG3 GLN 113 2HG GLN 113 -5.615 4.422 -5.280 932 HE21 GLN 113 2HE2 GLN 113 -7.431 7.229 -4.269 933 HE22 GLN 113 1HE2 GLN 113 -7.482 6.843 -2.616 934 H ASP 114 H ASP 114 -5.036 5.153 -8.785 935 HA ASP 114 HA ASP 114 -5.770 7.743 -9.881 936 HB2 ASP 114 1HB ASP 114 -6.364 4.959 -10.846 937 HB3 ASP 114 2HB ASP 114 -6.580 6.441 -11.770 938 H ASN 115 H ASN 115 -8.086 7.349 -11.103 939 HA ASN 115 HA ASN 115 -10.321 7.642 -10.916 940 HB2 ASN 115 1HB ASN 115 -10.131 5.169 -10.419 941 HB3 ASN 115 2HB ASN 115 -10.262 5.584 -8.708 942 HD21 ASN 115 2HD2 ASN 115 -12.335 4.158 -9.094 943 HD22 ASN 115 1HD2 ASN 115 -13.737 5.004 -9.541 944 H ASN 116 H ASN 116 -8.840 9.531 -9.367 945 HA ASN 116 HA ASN 116 -10.244 9.809 -6.811 946 HB2 ASN 116 1HB ASN 116 -8.337 11.643 -8.286 947 HB3 ASN 116 2HB ASN 116 -9.013 11.980 -6.695 948 HD21 ASN 116 2HD2 ASN 116 -6.195 11.006 -7.957 949 HD22 ASN 116 1HD2 ASN 116 -5.691 9.880 -6.791 950 H GLU 117 H GLU 117 -12.268 10.657 -6.728 951 HA GLU 117 HA GLU 117 -13.606 11.628 -9.009 952 HB2 GLU 117 1HB GLU 117 -14.314 11.908 -6.081 953 HB3 GLU 117 2HB GLU 117 -15.408 12.271 -7.416 954 HG2 GLU 117 1HG GLU 117 -14.079 9.576 -6.990 955 HG3 GLU 117 2HG GLU 117 -15.716 9.961 -6.466 956 H THR 118 H THR 118 -11.993 13.369 -6.388 957 HA THR 118 HA THR 118 -11.952 15.780 -8.066 958 HB THR 118 HB THR 118 -13.972 16.209 -6.866 959 HG1 THR 118 HG1 THR 118 -13.102 17.827 -5.275 960 HG21 THR 118 3HG2 THR 118 -12.448 15.264 -4.431 961 HG22 THR 118 1HG2 THR 118 -13.871 14.519 -5.153 962 HG23 THR 118 2HG2 THR 118 -14.004 16.082 -4.348 963 H GLU 119 H GLU 119 -10.630 17.518 -7.009 964 HA GLU 119 HA GLU 119 -8.059 16.570 -6.409 965 HB2 GLU 119 1HB GLU 119 -9.339 19.259 -5.846 966 HB3 GLU 119 2HB GLU 119 -7.617 18.929 -5.660 967 HG2 GLU 119 1HG GLU 119 -7.405 18.389 -8.004 968 HG3 GLU 119 2HG GLU 119 -9.146 18.517 -8.241 969 H LYS 120 H LYS 120 -10.730 17.546 -4.350 970 HA LYS 120 HA LYS 120 -9.449 17.565 -1.861 971 HB2 LYS 120 1HB LYS 120 -11.783 18.326 -2.320 972 HB3 LYS 120 2HB LYS 120 -12.277 16.641 -2.442 973 HG2 LYS 120 1HG LYS 120 -11.419 16.275 -0.106 974 HG3 LYS 120 2HG LYS 120 -11.086 17.999 -0.000 975 HD2 LYS 120 1HD LYS 120 -13.832 16.867 -0.622 976 HD3 LYS 120 2HD LYS 120 -13.299 17.266 1.007 977 HE2 LYS 120 1HE LYS 120 -12.810 19.624 0.125 978 HE3 LYS 120 2HE LYS 120 -13.704 19.159 -1.321 979 HZ1 LYS 120 3HZ LYS 120 -14.667 19.550 1.408 980 HZ2 LYS 120 1HZ LYS 120 -15.434 18.378 0.451 981 HZ3 LYS 120 2HZ LYS 120 -15.376 19.994 -0.071 982 H GLU 121 H GLU 121 -10.855 14.898 -3.722 983 HA GLU 121 HA GLU 121 -10.414 12.900 -1.736 984 HB2 GLU 121 1HB GLU 121 -12.071 12.732 -3.633 985 HB3 GLU 121 2HB GLU 121 -10.707 12.491 -4.724 986 HG2 GLU 121 1HG GLU 121 -11.528 10.308 -4.133 987 HG3 GLU 121 2HG GLU 121 -10.012 10.527 -3.268 988 H GLN 122 H GLN 122 -8.569 14.058 -4.524 989 HA GLN 122 HA GLN 122 -6.535 12.083 -4.431 990 HB2 GLN 122 1HB GLN 122 -6.910 13.611 -6.368 991 HB3 GLN 122 2HB GLN 122 -6.317 14.955 -5.393 992 HG2 GLN 122 1HG GLN 122 -4.146 13.772 -5.115 993 HG3 GLN 122 2HG GLN 122 -4.748 12.462 -6.129 994 HE21 GLN 122 2HE2 GLN 122 -4.067 12.657 -8.251 995 HE22 GLN 122 1HE2 GLN 122 -3.761 14.121 -9.053 996 H LYS 123 H LYS 123 -6.838 15.315 -3.015 997 HA LYS 123 HA LYS 123 -4.351 15.346 -1.686 998 HB2 LYS 123 1HB LYS 123 -6.963 16.745 -1.073 999 HB3 LYS 123 2HB LYS 123 -5.456 17.092 -0.227 1000 HG2 LYS 123 1HG LYS 123 -5.587 17.232 -3.253 1001 HG3 LYS 123 2HG LYS 123 -6.117 18.595 -2.273 1002 HD2 LYS 123 1HD LYS 123 -3.898 18.675 -1.181 1003 HD3 LYS 123 2HD LYS 123 -3.353 17.335 -2.181 1004 HE2 LYS 123 1HE LYS 123 -3.766 18.657 -4.209 1005 HE3 LYS 123 2HE LYS 123 -4.321 20.006 -3.219 1006 HZ1 LYS 123 3HZ LYS 123 -1.603 18.859 -3.406 1007 HZ2 LYS 123 1HZ LYS 123 -2.069 19.819 -2.087 1008 HZ3 LYS 123 2HZ LYS 123 -2.094 20.466 -3.657 1009 H HIS 124 H HIS 124 -7.555 14.256 -0.734 1010 HA HIS 124 HA HIS 124 -7.031 13.594 1.945 1011 HB2 HIS 124 1HB HIS 124 -9.288 13.710 0.875 1012 HB3 HIS 124 2HB HIS 124 -8.916 12.219 0.013 1013 HD1 HIS 124 HD1 HIS 124 -9.375 13.532 3.540 1014 HD2 HIS 124 HD2 HIS 124 -9.279 9.891 1.513 1015 HE1 HIS 124 HE1 HIS 124 -10.117 11.769 5.199 1016 HE2 HIS 124 HE2 HIS 124 -10.063 9.543 3.979 1017 H SER 125 H SER 125 -6.678 11.778 -1.063 1018 HA SER 125 HA SER 125 -5.802 9.342 0.191 1019 HB2 SER 125 1HB SER 125 -5.552 10.311 -2.668 1020 HB3 SER 125 2HB SER 125 -5.169 8.683 -2.118 1021 HG SER 125 HG SER 125 -7.603 9.500 -1.247 1022 H GLU 126 H GLU 126 -4.190 11.971 -1.565 1023 HA GLU 126 HA GLU 126 -1.554 11.066 -1.432 1024 HB2 GLU 126 1HB GLU 126 -2.373 13.037 -2.746 1025 HB3 GLU 126 2HB GLU 126 -2.508 13.933 -1.242 1026 HG2 GLU 126 1HG GLU 126 -0.076 13.589 -0.840 1027 HG3 GLU 126 2HG GLU 126 0.024 12.751 -2.382 1028 H ASP 127 H ASP 127 -3.312 13.199 0.828 1029 HA ASP 127 HA ASP 127 -1.229 13.443 2.720 1030 HB2 ASP 127 1HB ASP 127 -4.238 13.683 2.981 1031 HB3 ASP 127 2HB ASP 127 -3.127 14.048 4.299 1032 H ASN 128 H ASN 128 -3.833 11.089 2.320 1033 HA ASN 128 HA ASN 128 -3.447 9.712 4.770 1034 HB2 ASN 128 1HB ASN 128 -5.482 9.446 3.419 1035 HB3 ASN 128 2HB ASN 128 -4.540 8.696 2.134 1036 HD21 ASN 128 2HD2 ASN 128 -4.797 6.466 2.174 1037 HD22 ASN 128 1HD2 ASN 128 -4.931 5.526 3.581 1038 H TRP 129 H TRP 129 -2.314 8.982 1.470 1039 HA TRP 129 HA TRP 129 -0.752 6.753 2.208 1040 HB2 TRP 129 1HB TRP 129 -0.612 8.636 -0.163 1041 HB3 TRP 129 2HB TRP 129 0.483 7.262 0.011 1042 HD1 TRP 129 HD1 TRP 129 -2.793 8.088 -1.410 1043 HE1 TRP 129 HE1 TRP 129 -4.177 5.961 -1.857 1044 HE3 TRP 129 HE3 TRP 129 -0.045 4.689 1.220 1045 HZ2 TRP 129 HZ2 TRP 129 -4.118 3.175 -1.187 1046 HZ3 TRP 129 HZ3 TRP 129 -0.726 2.310 1.301 1047 HH2 TRP 129 HH2 TRP 129 -2.757 1.547 0.102 1048 H ASN 130 H ASN 130 0.016 10.211 2.038 1049 HA ASN 130 HA ASN 130 2.784 10.021 2.518 1050 HB2 ASN 130 1HB ASN 130 0.771 12.150 3.300 1051 HB3 ASN 130 2HB ASN 130 2.506 12.329 3.551 1052 HD21 ASN 130 2HD2 ASN 130 0.946 14.026 1.773 1053 HD22 ASN 130 1HD2 ASN 130 1.521 13.763 0.197 1054 H THR 131 H THR 131 -0.001 10.001 4.689 1055 HA THR 131 HA THR 131 1.448 10.019 7.123 1056 HB THR 131 HB THR 131 -1.245 8.701 6.671 1057 HG1 THR 131 HG1 THR 131 -0.548 11.206 6.205 1058 HG21 THR 131 3HG2 THR 131 -1.626 9.397 9.002 1059 HG22 THR 131 1HG2 THR 131 -0.010 10.101 9.059 1060 HG23 THR 131 2HG2 THR 131 -0.205 8.357 8.882 1061 H MET 132 H MET 132 0.263 7.440 5.013 1062 HA MET 132 HA MET 132 1.071 5.258 6.642 1063 HB2 MET 132 1HB MET 132 0.683 5.452 3.642 1064 HB3 MET 132 2HB MET 132 0.967 3.941 4.508 1065 HG2 MET 132 1HG MET 132 -1.058 4.289 5.837 1066 HG3 MET 132 2HG MET 132 -1.326 5.847 5.058 1067 HE1 MET 132 3HE MET 132 -0.497 2.100 4.136 1068 HE2 MET 132 1HE MET 132 -2.050 1.646 3.426 1069 HE3 MET 132 2HE MET 132 -1.968 2.185 5.100 1070 H LEU 133 H LEU 133 2.636 6.850 3.872 1071 HA LEU 133 HA LEU 133 5.035 5.353 3.969 1072 HB2 LEU 133 1HB LEU 133 4.189 7.944 2.713 1073 HB3 LEU 133 2HB LEU 133 5.917 7.670 2.858 1074 HG LEU 133 HG LEU 133 5.022 6.930 0.670 1075 HD11 LEU 133 1HD1 LEU 133 6.909 5.640 2.134 1076 HD12 LEU 133 2HD1 LEU 133 6.427 5.125 0.525 1077 HD13 LEU 133 3HD1 LEU 133 5.759 4.316 1.938 1078 HD21 LEU 133 3HD2 LEU 133 2.761 6.262 1.455 1079 HD22 LEU 133 1HD2 LEU 133 3.463 4.865 2.266 1080 HD23 LEU 133 2HD2 LEU 133 3.534 4.997 0.512 1081 H GLU 134 H GLU 134 4.036 8.347 5.558 1082 HA GLU 134 HA GLU 134 6.509 8.976 6.756 1083 HB2 GLU 134 1HB GLU 134 4.609 10.550 6.635 1084 HB3 GLU 134 2HB GLU 134 3.696 9.527 7.741 1085 HG2 GLU 134 1HG GLU 134 5.328 9.906 9.506 1086 HG3 GLU 134 2HG GLU 134 6.353 10.825 8.407 1087 H GLY 135 H GLY 135 3.748 7.033 7.845 1088 HA2 GLY 135 1HA GLY 135 4.835 6.336 10.380 1089 HA3 GLY 135 2HA GLY 135 3.521 5.501 9.553 1090 H LEU 136 H LEU 136 5.047 4.961 7.160 1091 HA LEU 136 HA LEU 136 6.198 2.470 7.891 1092 HB2 LEU 136 1HB LEU 136 5.150 3.313 5.613 1093 HB3 LEU 136 2HB LEU 136 6.795 3.805 5.241 1094 HG LEU 136 HG LEU 136 5.864 1.011 5.965 1095 HD11 LEU 136 1HD1 LEU 136 5.247 1.635 3.699 1096 HD12 LEU 136 2HD1 LEU 136 6.609 0.517 3.625 1097 HD13 LEU 136 3HD1 LEU 136 6.873 2.243 3.386 1098 HD21 LEU 136 3HD2 LEU 136 8.625 2.169 5.513 1099 HD22 LEU 136 1HD2 LEU 136 8.295 0.458 5.231 1100 HD23 LEU 136 2HD2 LEU 136 8.058 1.144 6.832 1101 H LYS 137 H LYS 137 7.666 5.466 6.644 1102 HA LYS 137 HA LYS 137 10.348 4.621 6.886 1103 HB2 LYS 137 1HB LYS 137 9.205 7.423 6.945 1104 HB3 LYS 137 2HB LYS 137 10.910 7.035 6.752 1105 HG2 LYS 137 1HG LYS 137 8.729 6.080 4.867 1106 HG3 LYS 137 2HG LYS 137 9.720 7.506 4.587 1107 HD2 LYS 137 1HD LYS 137 11.748 5.895 4.844 1108 HD3 LYS 137 2HD LYS 137 10.580 4.596 4.636 1109 HE2 LYS 137 1HE LYS 137 10.977 6.866 2.672 1110 HE3 LYS 137 2HE LYS 137 11.643 5.244 2.495 1111 HZ1 LYS 137 3HZ LYS 137 9.700 4.465 1.807 1112 HZ2 LYS 137 1HZ LYS 137 9.174 6.070 1.671 1113 HZ3 LYS 137 2HZ LYS 137 8.854 5.192 3.088 1114 H LYS 138 H LYS 138 8.175 6.188 9.174 1115 HA LYS 138 HA LYS 138 10.082 6.824 11.140 1116 HB2 LYS 138 1HB LYS 138 7.114 6.317 11.174 1117 HB3 LYS 138 2HB LYS 138 7.961 6.467 12.711 1118 HG2 LYS 138 1HG LYS 138 8.791 8.676 12.082 1119 HG3 LYS 138 2HG LYS 138 8.053 8.533 10.487 1120 HD2 LYS 138 1HD LYS 138 5.828 8.472 11.461 1121 HD3 LYS 138 2HD LYS 138 6.500 8.423 13.091 1122 HE2 LYS 138 1HE LYS 138 7.488 10.650 12.767 1123 HE3 LYS 138 2HE LYS 138 6.856 10.709 11.124 1124 HZ1 LYS 138 3HZ LYS 138 4.939 10.119 13.232 1125 HZ2 LYS 138 1HZ LYS 138 4.764 11.080 11.846 1126 HZ3 LYS 138 2HZ LYS 138 5.563 11.700 13.211 1127 H PHE 139 H PHE 139 8.362 3.799 10.484 1128 HA PHE 139 HA PHE 139 9.146 2.466 12.847 1129 HB2 PHE 139 1HB PHE 139 7.365 1.788 11.096 1130 HB3 PHE 139 2HB PHE 139 8.700 1.081 10.191 1131 HD1 PHE 139 HD1 PHE 139 10.229 -0.604 11.401 1132 HD2 PHE 139 HD2 PHE 139 6.391 0.591 12.924 1133 HE1 PHE 139 HE1 PHE 139 10.173 -2.615 12.849 1134 HE2 PHE 139 HE2 PHE 139 6.339 -1.419 14.369 1135 HZ PHE 139 HZ PHE 139 8.228 -3.022 14.334 1136 H LEU 140 H LEU 140 10.586 2.491 9.590 1137 HA LEU 140 HA LEU 140 12.792 0.824 10.264 1138 HB2 LEU 140 1HB LEU 140 12.151 2.670 7.970 1139 HB3 LEU 140 2HB LEU 140 13.777 2.005 8.109 1140 HG LEU 140 HG LEU 140 12.848 -0.283 8.131 1141 HD11 LEU 140 1HD1 LEU 140 10.689 0.053 9.139 1142 HD12 LEU 140 2HD1 LEU 140 10.396 -0.528 7.503 1143 HD13 LEU 140 3HD1 LEU 140 10.211 1.183 7.876 1144 HD21 LEU 140 3HD2 LEU 140 12.151 -0.345 5.792 1145 HD22 LEU 140 1HD2 LEU 140 13.443 0.841 5.986 1146 HD23 LEU 140 2HD2 LEU 140 11.768 1.375 5.834 1147 H GLU 141 H GLU 141 12.341 4.329 10.234 1148 HA GLU 141 HA GLU 141 15.063 4.962 10.833 1149 HB2 GLU 141 1HB GLU 141 12.499 6.553 11.116 1150 HB3 GLU 141 2HB GLU 141 14.093 7.219 11.462 1151 HG2 GLU 141 1HG GLU 141 13.345 5.974 8.802 1152 HG3 GLU 141 2HG GLU 141 13.248 7.701 9.133 1153 H ASN 142 H ASN 142 12.831 3.364 12.624 1154 HA ASN 142 HA ASN 142 13.077 4.546 15.187 1155 HB2 ASN 142 1HB ASN 142 11.323 2.877 14.489 1156 HB3 ASN 142 2HB ASN 142 12.564 1.627 14.571 1157 HD21 ASN 142 2HD2 ASN 142 10.545 1.152 16.290 1158 HD22 ASN 142 1HD2 ASN 142 10.945 1.583 17.882 1159 H LYS 143 H LYS 143 14.964 2.125 13.457 1160 HA LYS 143 HA LYS 143 16.552 1.225 15.598 1161 HB2 LYS 143 1HB LYS 143 16.360 0.123 13.374 1162 HB3 LYS 143 2HB LYS 143 17.316 1.435 12.684 1163 HG2 LYS 143 1HG LYS 143 19.219 0.866 14.070 1164 HG3 LYS 143 2HG LYS 143 18.270 -0.316 14.967 1165 HD2 LYS 143 1HD LYS 143 19.597 -1.540 13.376 1166 HD3 LYS 143 2HD LYS 143 17.933 -1.577 12.804 1167 HE2 LYS 143 1HE LYS 143 18.375 0.045 11.104 1168 HE3 LYS 143 2HE LYS 143 19.916 0.503 11.830 1169 HZ1 LYS 143 3HZ LYS 143 20.418 -0.895 10.033 1170 HZ2 LYS 143 1HZ LYS 143 19.224 -2.024 10.454 1171 HZ3 LYS 143 2HZ LYS 143 20.614 -1.860 11.418 1172 H VAL 144 H VAL 144 17.331 3.670 13.105 1173 HA VAL 144 HA VAL 144 19.776 4.455 14.315 1174 HB VAL 144 HB VAL 144 19.277 4.880 11.941 1175 HG11 VAL 144 1HG1 VAL 144 16.871 5.454 12.299 1176 HG12 VAL 144 2HG1 VAL 144 17.719 6.605 11.275 1177 HG13 VAL 144 3HG1 VAL 144 17.373 7.009 12.956 1178 HG21 VAL 144 3HG2 VAL 144 20.937 6.277 13.217 1179 HG22 VAL 144 1HG2 VAL 144 19.667 7.477 13.465 1180 HG23 VAL 144 2HG2 VAL 144 20.226 7.106 11.834 1181 H SER 145 H SER 145 16.469 5.639 14.611 1182 HA SER 145 HA SER 145 16.977 7.985 16.077 1183 HB2 SER 145 1HB SER 145 14.588 6.130 16.201 1184 HB3 SER 145 2HB SER 145 14.638 7.759 16.864 1185 HG SER 145 HG SER 145 14.711 8.587 14.868 1186 H ALA 146 H ALA 146 16.505 4.645 17.113 1187 HA ALA 146 HA ALA 146 16.520 5.128 19.908 1188 HB1 ALA 146 3HB ALA 146 17.050 2.683 20.061 1189 HB2 ALA 146 1HB ALA 146 17.222 2.656 18.306 1190 HB3 ALA 146 2HB ALA 146 15.662 3.039 19.033 Start of MODEL 7 1 H1 MET 1 1H MET 1 -8.240 14.399 -19.497 2 H2 MET 1 2H MET 1 -8.870 13.546 -18.170 3 H3 MET 1 3H MET 1 -9.172 15.209 -18.335 4 HA MET 1 HA MET 1 -11.136 14.426 -19.109 5 HB2 MET 1 1HB MET 1 -9.927 15.695 -20.914 6 HB3 MET 1 2HB MET 1 -9.402 14.152 -21.585 7 HG2 MET 1 1HG MET 1 -11.771 13.469 -21.848 8 HG3 MET 1 2HG MET 1 -12.281 15.025 -21.195 9 HE1 MET 1 3HE MET 1 -12.512 13.422 -24.447 10 HE2 MET 1 1HE MET 1 -13.126 14.981 -25.012 11 HE3 MET 1 2HE MET 1 -13.598 14.364 -23.431 12 H GLU 2 H GLU 2 -8.588 12.314 -20.446 13 HA GLU 2 HA GLU 2 -10.304 10.106 -20.949 14 HB2 GLU 2 1HB GLU 2 -7.298 10.214 -20.549 15 HB3 GLU 2 2HB GLU 2 -8.181 8.803 -21.123 16 HG2 GLU 2 1HG GLU 2 -7.430 9.872 -23.115 17 HG3 GLU 2 2HG GLU 2 -9.117 10.345 -22.981 18 H ILE 3 H ILE 3 -8.294 11.007 -18.175 19 HA ILE 3 HA ILE 3 -9.746 9.038 -16.508 20 HB ILE 3 HB ILE 3 -7.404 8.711 -15.335 21 HG12 ILE 3 1HG1 ILE 3 -5.505 8.813 -16.887 22 HG13 ILE 3 2HG1 ILE 3 -6.548 9.427 -18.166 23 HG21 ILE 3 1HG2 ILE 3 -8.618 6.889 -16.389 24 HG22 ILE 3 2HG2 ILE 3 -6.915 6.791 -16.832 25 HG23 ILE 3 3HG2 ILE 3 -8.091 7.415 -17.988 26 HD11 ILE 3 3HD1 ILE 3 -5.121 11.130 -16.825 27 HD12 ILE 3 1HD1 ILE 3 -6.301 10.899 -15.538 28 HD13 ILE 3 2HD1 ILE 3 -6.813 11.516 -17.111 29 H LYS 4 H LYS 4 -9.418 9.445 -14.182 30 HA LYS 4 HA LYS 4 -9.856 12.262 -13.631 31 HB2 LYS 4 1HB LYS 4 -10.024 9.703 -12.044 32 HB3 LYS 4 2HB LYS 4 -10.096 11.257 -11.225 33 HG2 LYS 4 1HG LYS 4 -12.364 10.493 -11.702 34 HG3 LYS 4 2HG LYS 4 -12.012 11.904 -12.697 35 HD2 LYS 4 1HD LYS 4 -11.614 10.540 -14.640 36 HD3 LYS 4 2HD LYS 4 -11.665 9.058 -13.686 37 HE2 LYS 4 1HE LYS 4 -14.031 9.436 -13.198 38 HE3 LYS 4 2HE LYS 4 -13.981 10.975 -14.056 39 HZ1 LYS 4 3HZ LYS 4 -13.297 8.389 -15.330 40 HZ2 LYS 4 1HZ LYS 4 -13.568 9.881 -16.091 41 HZ3 LYS 4 2HZ LYS 4 -14.861 9.053 -15.363 42 H LEU 5 H LEU 5 -8.854 12.739 -11.219 43 HA LEU 5 HA LEU 5 -6.111 13.349 -11.733 44 HB2 LEU 5 1HB LEU 5 -7.991 13.728 -9.416 45 HB3 LEU 5 2HB LEU 5 -6.280 14.067 -9.203 46 HG LEU 5 HG LEU 5 -6.363 15.668 -11.073 47 HD11 LEU 5 1HD1 LEU 5 -8.084 14.740 -12.479 48 HD12 LEU 5 2HD1 LEU 5 -8.679 16.303 -11.932 49 HD13 LEU 5 3HD1 LEU 5 -9.276 14.823 -11.182 50 HD21 LEU 5 3HD2 LEU 5 -7.815 17.350 -9.969 51 HD22 LEU 5 1HD2 LEU 5 -6.806 16.478 -8.814 52 HD23 LEU 5 2HD2 LEU 5 -8.514 16.069 -8.977 53 H ILE 6 H ILE 6 -4.268 12.522 -10.918 54 HA ILE 6 HA ILE 6 -4.421 9.934 -9.451 55 HB ILE 6 HB ILE 6 -2.318 10.929 -11.386 56 HG12 ILE 6 1HG1 ILE 6 -4.313 8.659 -11.706 57 HG13 ILE 6 2HG1 ILE 6 -4.558 10.269 -12.382 58 HG21 ILE 6 1HG2 ILE 6 -1.470 8.574 -11.185 59 HG22 ILE 6 2HG2 ILE 6 -2.644 8.304 -9.901 60 HG23 ILE 6 3HG2 ILE 6 -1.348 9.475 -9.680 61 HD11 ILE 6 3HD1 ILE 6 -2.226 8.435 -12.993 62 HD12 ILE 6 1HD1 ILE 6 -2.447 10.057 -13.649 63 HD13 ILE 6 2HD1 ILE 6 -3.583 8.774 -14.068 64 H ALA 7 H ALA 7 -3.470 9.818 -7.523 65 HA ALA 7 HA ALA 7 -2.236 12.111 -6.316 66 HB1 ALA 7 3HB ALA 7 -3.573 10.573 -4.974 67 HB2 ALA 7 1HB ALA 7 -1.910 10.586 -4.382 68 HB3 ALA 7 2HB ALA 7 -2.481 9.246 -5.372 69 H GLN 8 H GLN 8 -0.099 12.460 -5.808 70 HA GLN 8 HA GLN 8 1.931 10.495 -6.744 71 HB2 GLN 8 1HB GLN 8 1.851 13.449 -7.392 72 HB3 GLN 8 2HB GLN 8 3.242 12.405 -7.676 73 HG2 GLN 8 1HG GLN 8 1.853 10.962 -9.128 74 HG3 GLN 8 2HG GLN 8 0.478 12.032 -8.860 75 HE21 GLN 8 2HE2 GLN 8 0.429 14.057 -10.004 76 HE22 GLN 8 1HE2 GLN 8 1.589 14.466 -11.177 77 H VAL 9 H VAL 9 3.106 9.976 -5.037 78 HA VAL 9 HA VAL 9 4.154 12.099 -3.260 79 HB VAL 9 HB VAL 9 3.704 10.674 -1.278 80 HG11 VAL 9 1HG1 VAL 9 1.225 11.361 -2.878 81 HG12 VAL 9 2HG1 VAL 9 2.168 12.516 -1.937 82 HG13 VAL 9 3HG1 VAL 9 1.320 11.197 -1.127 83 HG21 VAL 9 3HG2 VAL 9 2.116 9.044 -3.291 84 HG22 VAL 9 1HG2 VAL 9 2.001 8.856 -1.542 85 HG23 VAL 9 2HG2 VAL 9 3.514 8.494 -2.368 86 H LYS 10 H LYS 10 6.241 11.794 -2.674 87 HA LYS 10 HA LYS 10 7.489 9.161 -2.794 88 HB2 LYS 10 1HB LYS 10 9.206 9.843 -4.400 89 HB3 LYS 10 2HB LYS 10 7.606 9.873 -5.139 90 HG2 LYS 10 1HG LYS 10 7.508 12.349 -4.603 91 HG3 LYS 10 2HG LYS 10 9.203 12.246 -4.130 92 HD2 LYS 10 1HD LYS 10 8.117 11.486 -6.858 93 HD3 LYS 10 2HD LYS 10 8.924 13.006 -6.485 94 HE2 LYS 10 1HE LYS 10 10.905 11.544 -5.668 95 HE3 LYS 10 2HE LYS 10 10.111 10.222 -6.524 96 HZ1 LYS 10 3HZ LYS 10 10.173 12.522 -8.147 97 HZ2 LYS 10 1HZ LYS 10 10.850 10.994 -8.431 98 HZ3 LYS 10 2HZ LYS 10 11.739 12.175 -7.593 99 H THR 11 H THR 11 9.351 9.026 -1.596 100 HA THR 11 HA THR 11 10.590 11.474 -0.521 101 HB THR 11 HB THR 11 8.953 11.108 1.177 102 HG1 THR 11 HG1 THR 11 11.114 9.648 2.206 103 HG21 THR 11 3HG2 THR 11 9.765 8.187 1.063 104 HG22 THR 11 1HG2 THR 11 8.223 8.864 0.536 105 HG23 THR 11 2HG2 THR 11 8.654 8.878 2.245 106 H VAL 12 H VAL 12 12.693 11.240 0.061 107 HA VAL 12 HA VAL 12 14.053 8.819 -0.856 108 HB VAL 12 HB VAL 12 15.263 11.315 0.360 109 HG11 VAL 12 1HG1 VAL 12 16.792 9.412 0.250 110 HG12 VAL 12 2HG1 VAL 12 17.235 10.586 -0.988 111 HG13 VAL 12 3HG1 VAL 12 16.359 9.123 -1.434 112 HG21 VAL 12 3HG2 VAL 12 15.575 12.044 -1.995 113 HG22 VAL 12 1HG2 VAL 12 13.869 11.924 -1.566 114 HG23 VAL 12 2HG2 VAL 12 14.623 10.660 -2.535 115 H ILE 13 H ILE 13 14.676 7.208 0.407 116 HA ILE 13 HA ILE 13 15.028 7.660 3.334 117 HB ILE 13 HB ILE 13 13.720 5.245 2.054 118 HG12 ILE 13 1HG1 ILE 13 12.485 7.394 3.812 119 HG13 ILE 13 2HG1 ILE 13 12.340 7.382 2.057 120 HG21 ILE 13 1HG2 ILE 13 13.218 4.708 4.480 121 HG22 ILE 13 2HG2 ILE 13 14.271 6.044 4.938 122 HG23 ILE 13 3HG2 ILE 13 14.933 4.649 4.090 123 HD11 ILE 13 3HD1 ILE 13 11.307 5.134 2.165 124 HD12 ILE 13 1HD1 ILE 13 10.368 6.330 3.059 125 HD13 ILE 13 2HD1 ILE 13 11.400 5.191 3.925 126 H ASN 14 H ASN 14 16.843 6.871 4.160 127 HA ASN 14 HA ASN 14 18.701 5.435 2.388 128 HB2 ASN 14 1HB ASN 14 19.015 6.692 5.128 129 HB3 ASN 14 2HB ASN 14 20.301 5.797 4.314 130 HD21 ASN 14 2HD2 ASN 14 20.609 8.586 4.904 131 HD22 ASN 14 1HD2 ASN 14 20.617 9.439 3.435 132 H ALA 15 H ALA 15 17.939 3.359 2.284 133 HA ALA 15 HA ALA 15 18.669 1.640 4.379 134 HB1 ALA 15 3HB ALA 15 16.265 0.754 4.816 135 HB2 ALA 15 1HB ALA 15 15.733 2.305 4.175 136 HB3 ALA 15 2HB ALA 15 16.742 2.247 5.618 137 HA PRO 16 HA PRO 16 18.654 -1.274 1.015 138 HB2 PRO 16 1HB PRO 16 17.512 -3.369 2.820 139 HB3 PRO 16 2HB PRO 16 19.034 -3.389 1.908 140 HG2 PRO 16 1HG PRO 16 19.004 -3.063 4.563 141 HG3 PRO 16 2HG PRO 16 20.173 -2.200 3.540 142 HD2 PRO 16 1HD PRO 16 17.664 -1.150 4.833 143 HD3 PRO 16 2HD PRO 16 19.240 -0.368 4.611 144 H ILE 17 H ILE 17 17.302 -2.106 -0.554 145 HA ILE 17 HA ILE 17 14.587 -1.302 -0.591 146 HB ILE 17 HB ILE 17 15.986 -1.429 -2.596 147 HG12 ILE 17 1HG1 ILE 17 13.648 -3.357 -2.829 148 HG13 ILE 17 2HG1 ILE 17 13.438 -1.614 -2.664 149 HG21 ILE 17 1HG2 ILE 17 15.697 -4.439 -2.364 150 HG22 ILE 17 2HG2 ILE 17 17.154 -3.561 -1.902 151 HG23 ILE 17 3HG2 ILE 17 16.607 -3.540 -3.576 152 HD11 ILE 17 3HD1 ILE 17 14.974 -3.013 -4.867 153 HD12 ILE 17 1HD1 ILE 17 14.817 -1.267 -4.688 154 HD13 ILE 17 2HD1 ILE 17 13.392 -2.247 -5.028 155 H GLU 18 H GLU 18 16.180 -4.275 0.286 156 HA GLU 18 HA GLU 18 14.057 -6.099 -0.037 157 HB2 GLU 18 1HB GLU 18 16.318 -6.091 1.969 158 HB3 GLU 18 2HB GLU 18 15.279 -7.475 1.634 159 HG2 GLU 18 1HG GLU 18 16.953 -6.066 -0.459 160 HG3 GLU 18 2HG GLU 18 17.463 -7.522 0.396 161 H LYS 19 H LYS 19 15.036 -4.219 2.804 162 HA LYS 19 HA LYS 19 13.069 -5.274 4.543 163 HB2 LYS 19 1HB LYS 19 14.872 -2.892 4.553 164 HB3 LYS 19 2HB LYS 19 13.579 -2.948 5.749 165 HG2 LYS 19 1HG LYS 19 15.674 -3.935 6.625 166 HG3 LYS 19 2HG LYS 19 14.381 -5.125 6.548 167 HD2 LYS 19 1HD LYS 19 15.300 -6.078 4.504 168 HD3 LYS 19 2HD LYS 19 16.503 -4.799 4.406 169 HE2 LYS 19 1HE LYS 19 17.480 -5.556 6.543 170 HE3 LYS 19 2HE LYS 19 16.280 -6.841 6.627 171 HZ1 LYS 19 3HZ LYS 19 18.733 -6.887 5.328 172 HZ2 LYS 19 1HZ LYS 19 17.548 -6.901 4.113 173 HZ3 LYS 19 2HZ LYS 19 17.534 -8.090 5.326 174 H VAL 20 H VAL 20 12.974 -2.291 2.577 175 HA VAL 20 HA VAL 20 10.343 -1.587 3.467 176 HB VAL 20 HB VAL 20 10.332 -0.066 1.461 177 HG11 VAL 20 1HG1 VAL 20 12.742 -0.047 3.303 178 HG12 VAL 20 2HG1 VAL 20 11.196 0.769 3.552 179 HG13 VAL 20 3HG1 VAL 20 12.285 1.316 2.279 180 HG21 VAL 20 3HG2 VAL 20 12.573 0.134 0.274 181 HG22 VAL 20 1HG2 VAL 20 11.667 -1.323 -0.113 182 HG23 VAL 20 2HG2 VAL 20 13.015 -1.399 1.015 183 H TRP 21 H TRP 21 11.622 -3.214 0.593 184 HA TRP 21 HA TRP 21 9.250 -3.710 -0.788 185 HB2 TRP 21 1HB TRP 21 11.450 -4.147 -1.752 186 HB3 TRP 21 2HB TRP 21 11.771 -5.380 -0.543 187 HD1 TRP 21 HD1 TRP 21 10.682 -7.740 -0.869 188 HE1 TRP 21 HE1 TRP 21 9.498 -8.861 -2.865 189 HE3 TRP 21 HE3 TRP 21 9.856 -3.649 -3.814 190 HZ2 TRP 21 HZ2 TRP 21 8.354 -8.119 -5.376 191 HZ3 TRP 21 HZ3 TRP 21 8.724 -3.891 -6.005 192 HH2 TRP 21 HH2 TRP 21 7.976 -6.119 -6.781 193 H GLU 22 H GLU 22 10.912 -5.730 1.632 194 HA GLU 22 HA GLU 22 9.021 -7.803 1.769 195 HB2 GLU 22 1HB GLU 22 11.318 -7.912 2.727 196 HB3 GLU 22 2HB GLU 22 10.831 -6.762 3.966 197 HG2 GLU 22 1HG GLU 22 9.162 -8.320 4.829 198 HG3 GLU 22 2HG GLU 22 9.507 -9.454 3.525 199 H ALA 23 H ALA 23 9.353 -4.821 3.662 200 HA ALA 23 HA ALA 23 7.303 -5.225 5.502 201 HB1 ALA 23 3HB ALA 23 7.306 -2.801 5.794 202 HB2 ALA 23 1HB ALA 23 8.187 -2.608 4.278 203 HB3 ALA 23 2HB ALA 23 8.957 -3.406 5.651 204 H LEU 24 H LEU 24 7.088 -4.530 2.133 205 HA LEU 24 HA LEU 24 4.369 -3.498 2.297 206 HB2 LEU 24 1HB LEU 24 6.409 -3.138 0.488 207 HB3 LEU 24 2HB LEU 24 5.420 -4.310 -0.372 208 HG LEU 24 HG LEU 24 4.388 -1.707 0.802 209 HD11 LEU 24 1HD1 LEU 24 4.839 -2.403 -2.106 210 HD12 LEU 24 2HD1 LEU 24 5.970 -1.453 -1.138 211 HD13 LEU 24 3HD1 LEU 24 4.339 -0.853 -1.426 212 HD21 LEU 24 3HD2 LEU 24 3.111 -3.854 -0.924 213 HD22 LEU 24 1HD2 LEU 24 2.397 -2.261 -0.664 214 HD23 LEU 24 2HD2 LEU 24 2.619 -3.358 0.694 215 H VAL 25 H VAL 25 5.942 -6.488 1.246 216 HA VAL 25 HA VAL 25 3.277 -7.771 0.924 217 HB VAL 25 HB VAL 25 4.695 -9.573 -0.279 218 HG11 VAL 25 1HG1 VAL 25 4.439 -6.773 -1.420 219 HG12 VAL 25 2HG1 VAL 25 3.237 -8.059 -1.505 220 HG13 VAL 25 3HG1 VAL 25 4.759 -8.219 -2.377 221 HG21 VAL 25 3HG2 VAL 25 6.855 -8.891 -1.117 222 HG22 VAL 25 1HG2 VAL 25 6.885 -8.641 0.627 223 HG23 VAL 25 2HG2 VAL 25 6.666 -7.271 -0.456 224 H ASN 26 H ASN 26 3.217 -7.854 3.296 225 HA ASN 26 HA ASN 26 4.078 -10.450 4.105 226 HB2 ASN 26 1HB ASN 26 5.880 -8.422 4.671 227 HB3 ASN 26 2HB ASN 26 4.987 -8.551 6.168 228 HD21 ASN 26 2HD2 ASN 26 5.673 -11.271 3.972 229 HD22 ASN 26 1HD2 ASN 26 6.607 -12.118 5.098 230 HA PRO 27 HA PRO 27 0.193 -9.630 6.199 231 HB2 PRO 27 1HB PRO 27 -0.329 -12.121 7.177 232 HB3 PRO 27 2HB PRO 27 -0.472 -11.742 5.452 233 HG2 PRO 27 1HG PRO 27 1.761 -13.125 6.879 234 HG3 PRO 27 2HG PRO 27 1.037 -13.492 5.305 235 HD2 PRO 27 1HD PRO 27 3.403 -12.093 5.590 236 HD3 PRO 27 2HD PRO 27 2.319 -11.920 4.188 237 H GLU 28 H GLU 28 3.129 -10.512 7.677 238 HA GLU 28 HA GLU 28 2.080 -10.375 10.430 239 HB2 GLU 28 1HB GLU 28 4.641 -10.674 10.928 240 HB3 GLU 28 2HB GLU 28 3.729 -12.043 10.291 241 HG2 GLU 28 1HG GLU 28 4.527 -11.637 8.056 242 HG3 GLU 28 2HG GLU 28 5.261 -10.118 8.541 243 H ILE 29 H ILE 29 4.377 -8.602 8.354 244 HA ILE 29 HA ILE 29 4.818 -6.512 10.258 245 HB ILE 29 HB ILE 29 5.293 -6.602 7.261 246 HG12 ILE 29 1HG1 ILE 29 7.273 -6.772 9.560 247 HG13 ILE 29 2HG1 ILE 29 6.592 -8.195 8.779 248 HG21 ILE 29 1HG2 ILE 29 5.116 -4.284 7.871 249 HG22 ILE 29 2HG2 ILE 29 6.837 -4.644 7.781 250 HG23 ILE 29 3HG2 ILE 29 6.044 -4.541 9.350 251 HD11 ILE 29 3HD1 ILE 29 8.282 -6.048 7.485 252 HD12 ILE 29 1HD1 ILE 29 7.458 -7.325 6.585 253 HD13 ILE 29 2HD1 ILE 29 8.723 -7.735 7.743 254 H ILE 30 H ILE 30 2.710 -6.936 7.452 255 HA ILE 30 HA ILE 30 1.588 -4.357 7.423 256 HB ILE 30 HB ILE 30 0.463 -7.030 6.546 257 HG12 ILE 30 1HG1 ILE 30 2.562 -5.888 5.409 258 HG13 ILE 30 2HG1 ILE 30 1.280 -6.527 4.388 259 HG21 ILE 30 1HG2 ILE 30 -1.491 -5.709 6.857 260 HG22 ILE 30 2HG2 ILE 30 -1.116 -5.527 5.142 261 HG23 ILE 30 3HG2 ILE 30 -0.695 -4.246 6.274 262 HD11 ILE 30 3HD1 ILE 30 2.186 -4.144 3.876 263 HD12 ILE 30 1HD1 ILE 30 1.226 -3.636 5.263 264 HD13 ILE 30 2HD1 ILE 30 0.440 -4.393 3.881 265 H LYS 31 H LYS 31 0.664 -7.299 9.148 266 HA LYS 31 HA LYS 31 -1.690 -6.273 10.323 267 HB2 LYS 31 1HB LYS 31 -1.184 -8.664 10.200 268 HB3 LYS 31 2HB LYS 31 0.180 -8.436 11.291 269 HG2 LYS 31 1HG LYS 31 -1.279 -7.778 13.095 270 HG3 LYS 31 2HG LYS 31 -2.674 -7.724 12.015 271 HD2 LYS 31 1HD LYS 31 -2.727 -9.801 13.308 272 HD3 LYS 31 2HD LYS 31 -2.424 -10.171 11.612 273 HE2 LYS 31 1HE LYS 31 -0.123 -10.641 12.007 274 HE3 LYS 31 2HE LYS 31 -0.138 -9.828 13.572 275 HZ1 LYS 31 3HZ LYS 31 -1.720 -12.257 12.969 276 HZ2 LYS 31 1HZ LYS 31 -1.450 -11.551 14.487 277 HZ3 LYS 31 2HZ LYS 31 -0.168 -12.296 13.659 278 H GLU 32 H GLU 32 1.704 -6.042 11.169 279 HA GLU 32 HA GLU 32 1.381 -5.172 13.849 280 HB2 GLU 32 1HB GLU 32 3.537 -5.983 12.803 281 HB3 GLU 32 2HB GLU 32 3.636 -4.440 11.965 282 HG2 GLU 32 1HG GLU 32 4.969 -4.254 13.956 283 HG3 GLU 32 2HG GLU 32 3.517 -3.298 14.209 284 H TYR 33 H TYR 33 1.722 -3.396 10.780 285 HA TYR 33 HA TYR 33 1.490 -0.797 11.968 286 HB2 TYR 33 1HB TYR 33 1.271 -1.817 9.125 287 HB3 TYR 33 2HB TYR 33 1.035 -0.120 9.526 288 HD1 TYR 33 HD2 TYR 33 2.898 1.037 10.912 289 HD2 TYR 33 HD1 TYR 33 3.490 -2.630 8.746 290 HE1 TYR 33 HE2 TYR 33 5.346 1.429 10.913 291 HE2 TYR 33 HE1 TYR 33 5.939 -2.222 8.749 292 HH TYR 33 HH TYR 33 7.322 0.728 9.498 293 H MET 34 H MET 34 -0.769 -3.114 10.586 294 HA MET 34 HA MET 34 -3.017 -1.231 10.814 295 HB2 MET 34 1HB MET 34 -2.915 -4.083 9.803 296 HB3 MET 34 2HB MET 34 -4.302 -2.998 9.701 297 HG2 MET 34 1HG MET 34 -1.595 -2.436 8.463 298 HG3 MET 34 2HG MET 34 -2.970 -3.094 7.581 299 HE1 MET 34 3HE MET 34 -5.248 -2.092 7.664 300 HE2 MET 34 1HE MET 34 -4.522 -1.424 6.196 301 HE3 MET 34 2HE MET 34 -5.489 -0.395 7.251 302 H PHE 35 H PHE 35 -2.268 -1.462 13.250 303 HA PHE 35 HA PHE 35 -2.650 -2.305 15.380 304 HB2 PHE 35 1HB PHE 35 -5.400 -2.280 14.120 305 HB3 PHE 35 2HB PHE 35 -5.106 -2.417 15.852 306 HD1 PHE 35 HD1 PHE 35 -4.905 -0.194 12.912 307 HD2 PHE 35 HD2 PHE 35 -4.210 -0.525 17.142 308 HE1 PHE 35 HE1 PHE 35 -4.656 2.267 13.068 309 HE2 PHE 35 HE2 PHE 35 -3.962 1.936 17.291 310 HZ PHE 35 HZ PHE 35 -4.187 3.333 15.256 311 H GLY 36 H GLY 36 -5.271 -4.179 13.932 312 HA2 GLY 36 1HA GLY 36 -3.819 -6.712 14.372 313 HA3 GLY 36 2HA GLY 36 -5.295 -6.437 15.285 314 H THR 37 H THR 37 -4.474 -5.707 11.893 315 HA THR 37 HA THR 37 -6.979 -7.005 11.032 316 HB THR 37 HB THR 37 -4.974 -5.400 9.426 317 HG1 THR 37 HG1 THR 37 -6.066 -4.202 11.036 318 HG21 THR 37 3HG2 THR 37 -6.224 -6.836 7.954 319 HG22 THR 37 1HG2 THR 37 -6.964 -5.239 7.851 320 HG23 THR 37 2HG2 THR 37 -7.726 -6.504 8.809 321 H THR 38 H THR 38 -6.944 -9.075 10.490 322 HA THR 38 HA THR 38 -4.459 -10.446 9.829 323 HB THR 38 HB THR 38 -7.291 -11.505 9.860 324 HG1 THR 38 HG1 THR 38 -5.326 -11.822 11.853 325 HG21 THR 38 3HG2 THR 38 -5.829 -12.968 8.616 326 HG22 THR 38 1HG2 THR 38 -6.077 -13.687 10.205 327 HG23 THR 38 2HG2 THR 38 -4.572 -12.842 9.847 328 H VAL 39 H VAL 39 -3.694 -10.712 7.851 329 HA VAL 39 HA VAL 39 -5.542 -10.692 5.530 330 HB VAL 39 HB VAL 39 -4.301 -8.487 5.861 331 HG11 VAL 39 1HG1 VAL 39 -1.893 -10.010 4.861 332 HG12 VAL 39 2HG1 VAL 39 -2.150 -9.709 6.578 333 HG13 VAL 39 3HG1 VAL 39 -1.960 -8.357 5.461 334 HG21 VAL 39 3HG2 VAL 39 -5.227 -9.112 3.680 335 HG22 VAL 39 1HG2 VAL 39 -3.811 -10.105 3.343 336 HG23 VAL 39 2HG2 VAL 39 -3.652 -8.354 3.445 337 H VAL 40 H VAL 40 -5.015 -12.048 3.855 338 HA VAL 40 HA VAL 40 -2.714 -13.905 4.279 339 HB VAL 40 HB VAL 40 -5.421 -14.532 3.079 340 HG11 VAL 40 1HG1 VAL 40 -3.715 -15.901 2.055 341 HG12 VAL 40 2HG1 VAL 40 -4.519 -16.900 3.262 342 HG13 VAL 40 3HG1 VAL 40 -2.939 -16.198 3.610 343 HG21 VAL 40 3HG2 VAL 40 -5.509 -14.192 5.527 344 HG22 VAL 40 1HG2 VAL 40 -4.172 -15.325 5.732 345 HG23 VAL 40 2HG2 VAL 40 -5.724 -15.896 5.121 346 H SER 41 H SER 41 -1.317 -14.061 2.672 347 HA SER 41 HA SER 41 -2.106 -13.499 -0.112 348 HB2 SER 41 1HB SER 41 -1.482 -11.283 0.864 349 HB3 SER 41 2HB SER 41 0.116 -11.930 1.221 350 HG SER 41 HG SER 41 -0.159 -12.558 -1.214 351 H ASP 42 H ASP 42 -1.064 -14.795 -1.450 352 HA ASP 42 HA ASP 42 0.931 -16.666 -0.526 353 HB2 ASP 42 1HB ASP 42 -0.269 -16.091 -3.245 354 HB3 ASP 42 2HB ASP 42 0.900 -17.376 -2.954 355 H TRP 43 H TRP 43 0.902 -13.566 -1.934 356 HA TRP 43 HA TRP 43 2.532 -12.069 -2.496 357 HB2 TRP 43 1HB TRP 43 4.688 -14.020 -1.698 358 HB3 TRP 43 2HB TRP 43 4.683 -12.264 -1.573 359 HD1 TRP 43 HD1 TRP 43 2.188 -11.608 0.029 360 HE1 TRP 43 HE1 TRP 43 1.870 -12.431 2.456 361 HE3 TRP 43 HE3 TRP 43 5.416 -15.559 0.046 362 HZ2 TRP 43 HZ2 TRP 43 2.869 -14.502 4.172 363 HZ3 TRP 43 HZ3 TRP 43 5.716 -16.937 2.083 364 HH2 TRP 43 HH2 TRP 43 4.446 -16.412 4.145 365 H LYS 44 H LYS 44 1.522 -13.594 -4.566 366 HA LYS 44 HA LYS 44 3.798 -13.594 -6.422 367 HB2 LYS 44 1HB LYS 44 3.335 -15.814 -7.296 368 HB3 LYS 44 2HB LYS 44 3.693 -15.906 -5.576 369 HG2 LYS 44 1HG LYS 44 1.331 -16.086 -5.031 370 HG3 LYS 44 2HG LYS 44 0.879 -15.863 -6.722 371 HD2 LYS 44 1HD LYS 44 2.246 -17.932 -7.247 372 HD3 LYS 44 2HD LYS 44 2.384 -18.190 -5.508 373 HE2 LYS 44 1HE LYS 44 -0.198 -18.022 -7.088 374 HE3 LYS 44 2HE LYS 44 0.502 -19.487 -6.400 375 HZ1 LYS 44 3HZ LYS 44 0.219 -18.621 -4.216 376 HZ2 LYS 44 1HZ LYS 44 -1.262 -18.466 -5.025 377 HZ3 LYS 44 2HZ LYS 44 -0.267 -17.107 -4.808 378 H GLU 45 H GLU 45 3.185 -13.546 -8.647 379 HA GLU 45 HA GLU 45 1.215 -11.762 -9.314 380 HB2 GLU 45 1HB GLU 45 3.105 -12.586 -10.773 381 HB3 GLU 45 2HB GLU 45 2.112 -13.985 -11.149 382 HG2 GLU 45 1HG GLU 45 1.138 -11.141 -11.581 383 HG3 GLU 45 2HG GLU 45 1.999 -12.044 -12.820 384 H GLY 46 H GLY 46 -0.898 -11.761 -9.477 385 HA2 GLY 46 1HA GLY 46 -3.060 -12.473 -9.934 386 HA3 GLY 46 2HA GLY 46 -2.435 -14.070 -10.309 387 H SER 47 H SER 47 -1.178 -13.209 -7.362 388 HA SER 47 HA SER 47 -2.709 -15.113 -5.945 389 HB2 SER 47 1HB SER 47 -0.492 -14.627 -5.191 390 HB3 SER 47 2HB SER 47 -0.860 -12.922 -5.002 391 HG SER 47 HG SER 47 -1.886 -15.126 -3.532 392 H GLN 48 H GLN 48 -4.518 -14.986 -4.811 393 HA GLN 48 HA GLN 48 -6.040 -12.491 -4.793 394 HB2 GLN 48 1HB GLN 48 -7.152 -14.677 -5.247 395 HB3 GLN 48 2HB GLN 48 -6.743 -15.198 -3.612 396 HG2 GLN 48 1HG GLN 48 -8.069 -13.393 -2.651 397 HG3 GLN 48 2HG GLN 48 -8.382 -12.727 -4.251 398 HE21 GLN 48 2HE2 GLN 48 -10.616 -13.087 -4.510 399 HE22 GLN 48 1HE2 GLN 48 -11.356 -14.609 -4.358 400 H ILE 49 H ILE 49 -6.563 -11.314 -2.973 401 HA ILE 49 HA ILE 49 -5.333 -12.119 -0.386 402 HB ILE 49 HB ILE 49 -5.122 -9.366 -1.621 403 HG12 ILE 49 1HG1 ILE 49 -2.977 -11.410 -0.976 404 HG13 ILE 49 2HG1 ILE 49 -3.601 -11.105 -2.593 405 HG21 ILE 49 1HG2 ILE 49 -4.134 -10.490 1.021 406 HG22 ILE 49 2HG2 ILE 49 -5.383 -9.268 0.838 407 HG23 ILE 49 3HG2 ILE 49 -3.720 -8.898 0.406 408 HD11 ILE 49 3HD1 ILE 49 -2.168 -9.117 -0.817 409 HD12 ILE 49 1HD1 ILE 49 -2.918 -8.712 -2.360 410 HD13 ILE 49 2HD1 ILE 49 -1.561 -9.835 -2.305 411 H VAL 50 H VAL 50 -6.515 -11.791 1.347 412 HA VAL 50 HA VAL 50 -8.986 -10.140 1.142 413 HB VAL 50 HB VAL 50 -8.744 -12.834 2.506 414 HG11 VAL 50 1HG1 VAL 50 -11.263 -12.501 2.728 415 HG12 VAL 50 2HG1 VAL 50 -11.009 -10.825 2.239 416 HG13 VAL 50 3HG1 VAL 50 -10.285 -11.431 3.728 417 HG21 VAL 50 3HG2 VAL 50 -8.822 -12.921 0.004 418 HG22 VAL 50 1HG2 VAL 50 -10.327 -12.003 0.051 419 HG23 VAL 50 2HG2 VAL 50 -10.258 -13.618 0.754 420 H TRP 51 H TRP 51 -9.521 -8.945 2.878 421 HA TRP 51 HA TRP 51 -7.623 -8.945 5.192 422 HB2 TRP 51 1HB TRP 51 -9.140 -6.648 3.926 423 HB3 TRP 51 2HB TRP 51 -8.229 -6.533 5.425 424 HD1 TRP 51 HD1 TRP 51 -5.669 -6.225 5.262 425 HE1 TRP 51 HE1 TRP 51 -4.011 -5.988 3.302 426 HE3 TRP 51 HE3 TRP 51 -8.702 -7.563 1.383 427 HZ2 TRP 51 HZ2 TRP 51 -3.988 -6.317 0.460 428 HZ3 TRP 51 HZ3 TRP 51 -7.841 -7.588 -0.938 429 HH2 TRP 51 HH2 TRP 51 -5.486 -6.970 -1.404 430 H LYS 52 H LYS 52 -8.521 -9.524 7.054 431 HA LYS 52 HA LYS 52 -11.471 -9.494 7.320 432 HB2 LYS 52 1HB LYS 52 -10.164 -11.573 7.858 433 HB3 LYS 52 2HB LYS 52 -9.439 -10.705 9.209 434 HG2 LYS 52 1HG LYS 52 -11.734 -10.240 10.097 435 HG3 LYS 52 2HG LYS 52 -12.403 -11.216 8.796 436 HD2 LYS 52 1HD LYS 52 -10.386 -12.261 10.797 437 HD3 LYS 52 2HD LYS 52 -12.125 -12.421 11.005 438 HE2 LYS 52 1HE LYS 52 -12.141 -13.562 8.691 439 HE3 LYS 52 2HE LYS 52 -10.390 -13.666 8.862 440 HZ1 LYS 52 3HZ LYS 52 -12.170 -15.445 9.839 441 HZ2 LYS 52 1HZ LYS 52 -11.807 -14.505 11.203 442 HZ3 LYS 52 2HZ LYS 52 -10.559 -15.279 10.351 443 H GLY 53 H GLY 53 -12.460 -7.976 8.459 444 HA2 GLY 53 1HA GLY 53 -11.215 -6.737 10.781 445 HA3 GLY 53 2HA GLY 53 -11.456 -5.658 9.411 446 H GLU 54 H GLU 54 -12.727 -4.845 11.504 447 HA GLU 54 HA GLU 54 -15.574 -5.607 11.100 448 HB2 GLU 54 1HB GLU 54 -14.648 -6.500 13.255 449 HB3 GLU 54 2HB GLU 54 -14.317 -4.838 13.743 450 HG2 GLU 54 1HG GLU 54 -16.705 -4.282 13.524 451 HG3 GLU 54 2HG GLU 54 -17.046 -5.928 12.997 452 H TRP 55 H TRP 55 -16.953 -3.984 10.824 453 HA TRP 55 HA TRP 55 -16.098 -1.200 11.388 454 HB2 TRP 55 1HB TRP 55 -15.577 -1.687 9.022 455 HB3 TRP 55 2HB TRP 55 -17.248 -2.168 8.753 456 HD1 TRP 55 HD1 TRP 55 -15.645 0.929 10.456 457 HE1 TRP 55 HE1 TRP 55 -16.747 3.040 9.486 458 HE3 TRP 55 HE3 TRP 55 -18.865 -1.213 7.113 459 HZ2 TRP 55 HZ2 TRP 55 -18.731 3.738 7.554 460 HZ3 TRP 55 HZ3 TRP 55 -20.349 0.206 5.721 461 HH2 TRP 55 HH2 TRP 55 -20.285 2.676 5.938 462 H LYS 56 H LYS 56 -17.576 -0.341 12.654 463 HA LYS 56 HA LYS 56 -19.578 0.124 13.681 464 HB2 LYS 56 1HB LYS 56 -20.559 -0.337 10.860 465 HB3 LYS 56 2HB LYS 56 -21.520 0.396 12.144 466 HG2 LYS 56 1HG LYS 56 -19.661 2.124 12.389 467 HG3 LYS 56 2HG LYS 56 -18.963 1.462 10.914 468 HD2 LYS 56 1HD LYS 56 -21.737 2.651 11.197 469 HD3 LYS 56 2HD LYS 56 -20.366 3.402 10.383 470 HE2 LYS 56 1HE LYS 56 -21.510 2.451 8.564 471 HE3 LYS 56 2HE LYS 56 -20.382 1.154 8.958 472 HZ1 LYS 56 3HZ LYS 56 -22.136 -0.134 9.241 473 HZ2 LYS 56 1HZ LYS 56 -23.211 1.171 9.100 474 HZ3 LYS 56 2HZ LYS 56 -22.538 0.783 10.611 475 H GLY 57 H GLY 57 -18.688 -2.537 13.916 476 HA2 GLY 57 1HA GLY 57 -19.504 -4.472 14.898 477 HA3 GLY 57 2HA GLY 57 -21.133 -3.821 14.745 478 H LYS 58 H LYS 58 -20.045 -3.410 11.770 479 HA LYS 58 HA LYS 58 -21.149 -5.983 10.830 480 HB2 LYS 58 1HB LYS 58 -22.214 -3.953 9.966 481 HB3 LYS 58 2HB LYS 58 -20.670 -3.380 9.354 482 HG2 LYS 58 1HG LYS 58 -21.950 -4.364 7.527 483 HG3 LYS 58 2HG LYS 58 -20.552 -5.382 7.849 484 HD2 LYS 58 1HD LYS 58 -21.871 -7.035 8.961 485 HD3 LYS 58 2HD LYS 58 -23.244 -5.943 9.132 486 HE2 LYS 58 1HE LYS 58 -23.547 -5.978 6.688 487 HE3 LYS 58 2HE LYS 58 -22.169 -7.071 6.539 488 HZ1 LYS 58 3HZ LYS 58 -23.931 -8.522 6.626 489 HZ2 LYS 58 1HZ LYS 58 -24.811 -7.573 7.721 490 HZ3 LYS 58 2HZ LYS 58 -23.468 -8.460 8.260 491 H ALA 59 H ALA 59 -19.734 -7.513 10.316 492 HA ALA 59 HA ALA 59 -16.956 -7.094 9.940 493 HB1 ALA 59 3HB ALA 59 -16.957 -9.472 9.206 494 HB2 ALA 59 1HB ALA 59 -18.718 -9.449 9.262 495 HB3 ALA 59 2HB ALA 59 -17.786 -9.223 10.743 496 H TYR 60 H TYR 60 -15.845 -6.525 8.183 497 HA TYR 60 HA TYR 60 -17.117 -6.790 5.497 498 HB2 TYR 60 1HB TYR 60 -16.441 -4.601 4.882 499 HB3 TYR 60 2HB TYR 60 -17.159 -4.426 6.482 500 HD1 TYR 60 HD2 TYR 60 -15.650 -4.321 8.520 501 HD2 TYR 60 HD1 TYR 60 -14.132 -4.075 4.506 502 HE1 TYR 60 HE2 TYR 60 -13.517 -3.387 9.377 503 HE2 TYR 60 HE1 TYR 60 -12.008 -3.143 5.360 504 HH TYR 60 HH TYR 60 -10.775 -2.780 7.220 505 H GLU 61 H GLU 61 -15.741 -7.129 3.764 506 HA GLU 61 HA GLU 61 -12.885 -7.634 4.372 507 HB2 GLU 61 1HB GLU 61 -12.968 -9.734 3.111 508 HB3 GLU 61 2HB GLU 61 -14.038 -9.798 4.510 509 HG2 GLU 61 1HG GLU 61 -15.941 -9.148 2.986 510 HG3 GLU 61 2HG GLU 61 -14.835 -9.323 1.628 511 H ASP 62 H ASP 62 -11.559 -6.851 2.920 512 HA ASP 62 HA ASP 62 -12.622 -5.538 0.519 513 HB2 ASP 62 1HB ASP 62 -9.875 -5.549 1.808 514 HB3 ASP 62 2HB ASP 62 -10.294 -4.641 0.357 515 H LYS 63 H LYS 63 -11.448 -5.873 -1.573 516 HA LYS 63 HA LYS 63 -10.196 -8.557 -1.823 517 HB2 LYS 63 1HB LYS 63 -12.576 -7.607 -3.426 518 HB3 LYS 63 2HB LYS 63 -11.645 -9.061 -3.766 519 HG2 LYS 63 1HG LYS 63 -12.185 -9.900 -1.476 520 HG3 LYS 63 2HG LYS 63 -13.200 -8.479 -1.232 521 HD2 LYS 63 1HD LYS 63 -14.588 -9.115 -3.158 522 HD3 LYS 63 2HD LYS 63 -13.578 -10.537 -3.419 523 HE2 LYS 63 1HE LYS 63 -14.180 -11.373 -1.169 524 HE3 LYS 63 2HE LYS 63 -15.208 -9.963 -0.926 525 HZ1 LYS 63 3HZ LYS 63 -16.069 -10.888 -3.294 526 HZ2 LYS 63 1HZ LYS 63 -16.787 -11.256 -1.803 527 HZ3 LYS 63 2HZ LYS 63 -15.673 -12.335 -2.502 528 H GLY 64 H GLY 64 -8.461 -8.531 -2.998 529 HA2 GLY 64 1HA GLY 64 -8.228 -6.835 -5.378 530 HA3 GLY 64 2HA GLY 64 -7.067 -6.535 -4.083 531 H THR 65 H THR 65 -6.059 -7.299 -6.469 532 HA THR 65 HA THR 65 -4.960 -9.968 -5.870 533 HB THR 65 HB THR 65 -6.187 -9.277 -8.554 534 HG1 THR 65 HG1 THR 65 -7.851 -10.362 -7.882 535 HG21 THR 65 3HG2 THR 65 -5.656 -11.727 -8.988 536 HG22 THR 65 1HG2 THR 65 -4.651 -11.684 -7.538 537 HG23 THR 65 2HG2 THR 65 -4.257 -10.657 -8.916 538 H ILE 66 H ILE 66 -2.983 -10.417 -6.878 539 HA ILE 66 HA ILE 66 -1.337 -8.076 -7.325 540 HB ILE 66 HB ILE 66 -0.606 -10.990 -7.665 541 HG12 ILE 66 1HG1 ILE 66 -1.493 -10.646 -5.423 542 HG13 ILE 66 2HG1 ILE 66 0.255 -10.815 -5.334 543 HG21 ILE 66 1HG2 ILE 66 1.682 -10.118 -7.148 544 HG22 ILE 66 2HG2 ILE 66 1.032 -8.482 -7.212 545 HG23 ILE 66 3HG2 ILE 66 1.028 -9.487 -8.658 546 HD11 ILE 66 3HD1 ILE 66 -0.112 -8.967 -3.947 547 HD12 ILE 66 1HD1 ILE 66 -1.436 -8.358 -4.937 548 HD13 ILE 66 2HD1 ILE 66 0.232 -8.168 -5.472 549 H LEU 67 H LEU 67 -1.250 -7.066 -9.206 550 HA LEU 67 HA LEU 67 -2.112 -8.289 -11.663 551 HB2 LEU 67 1HB LEU 67 -2.461 -5.879 -11.158 552 HB3 LEU 67 2HB LEU 67 -0.717 -5.635 -11.220 553 HG LEU 67 HG LEU 67 -0.709 -6.431 -13.585 554 HD11 LEU 67 1HD1 LEU 67 -3.659 -6.778 -13.043 555 HD12 LEU 67 2HD1 LEU 67 -2.549 -7.852 -13.894 556 HD13 LEU 67 3HD1 LEU 67 -3.119 -6.383 -14.677 557 HD21 LEU 67 3HD2 LEU 67 -2.542 -4.115 -12.900 558 HD22 LEU 67 1HD2 LEU 67 -1.934 -4.431 -14.526 559 HD23 LEU 67 2HD2 LEU 67 -0.810 -4.061 -13.224 560 H GLN 68 H GLN 68 0.986 -7.218 -10.323 561 HA GLN 68 HA GLN 68 2.423 -9.118 -12.053 562 HB2 GLN 68 1HB GLN 68 2.425 -6.944 -13.277 563 HB3 GLN 68 2HB GLN 68 3.175 -6.182 -11.875 564 HG2 GLN 68 1HG GLN 68 5.127 -7.628 -12.071 565 HG3 GLN 68 2HG GLN 68 4.362 -8.536 -13.372 566 HE21 GLN 68 2HE2 GLN 68 5.229 -7.942 -15.355 567 HE22 GLN 68 1HE2 GLN 68 5.701 -6.365 -15.779 568 H PHE 69 H PHE 69 4.395 -9.781 -11.198 569 HA PHE 69 HA PHE 69 5.128 -8.746 -8.513 570 HB2 PHE 69 1HB PHE 69 3.706 -10.761 -8.245 571 HB3 PHE 69 2HB PHE 69 4.859 -11.675 -9.217 572 HD1 PHE 69 HD1 PHE 69 4.475 -9.694 -6.084 573 HD2 PHE 69 HD2 PHE 69 6.908 -12.489 -8.263 574 HE1 PHE 69 HE1 PHE 69 5.883 -10.035 -4.075 575 HE2 PHE 69 HE2 PHE 69 8.304 -12.838 -6.247 576 HZ PHE 69 HZ PHE 69 7.798 -11.607 -4.154 577 H ASN 70 H ASN 70 7.047 -7.882 -8.933 578 HA ASN 70 HA ASN 70 9.138 -9.620 -10.163 579 HB2 ASN 70 1HB ASN 70 8.784 -6.625 -10.460 580 HB3 ASN 70 2HB ASN 70 10.182 -7.547 -11.020 581 HD21 ASN 70 2HD2 ASN 70 8.239 -6.057 -12.720 582 HD22 ASN 70 1HD2 ASN 70 7.555 -7.212 -13.759 583 H GLU 71 H GLU 71 10.290 -10.274 -8.501 584 HA GLU 71 HA GLU 71 10.535 -9.272 -5.972 585 HB2 GLU 71 1HB GLU 71 12.673 -10.675 -7.591 586 HB3 GLU 71 2HB GLU 71 12.698 -10.484 -5.843 587 HG2 GLU 71 1HG GLU 71 11.758 -12.634 -6.079 588 HG3 GLU 71 2HG GLU 71 10.324 -11.630 -5.927 589 H ARG 72 H ARG 72 11.574 -7.708 -4.962 590 HA ARG 72 HA ARG 72 12.492 -5.589 -4.760 591 HB2 ARG 72 1HB ARG 72 14.979 -5.673 -5.074 592 HB3 ARG 72 2HB ARG 72 14.323 -6.976 -4.094 593 HG2 ARG 72 1HG ARG 72 14.462 -8.534 -5.935 594 HG3 ARG 72 2HG ARG 72 14.908 -7.254 -7.060 595 HD2 ARG 72 1HD ARG 72 16.900 -8.473 -6.418 596 HD3 ARG 72 2HD ARG 72 16.966 -6.861 -5.694 597 HE ARG 72 HE ARG 72 15.712 -8.694 -3.920 598 HH11 ARG 72 1HH2 ARG 72 18.801 -7.808 -5.241 599 HH12 ARG 72 2HH2 ARG 72 19.690 -8.357 -3.854 600 HH21 ARG 72 1HH1 ARG 72 16.864 -9.400 -2.128 601 HH22 ARG 72 2HH1 ARG 72 18.593 -9.257 -2.093 602 H SER 73 H SER 73 11.015 -5.243 -6.952 603 HA SER 73 HA SER 73 12.664 -3.435 -8.541 604 HB2 SER 73 1HB SER 73 11.215 -5.678 -9.960 605 HB3 SER 73 2HB SER 73 12.260 -4.457 -10.673 606 HG SER 73 HG SER 73 12.932 -6.816 -9.709 607 H ILE 74 H ILE 74 9.549 -5.095 -9.122 608 HA ILE 74 HA ILE 74 8.131 -2.525 -8.756 609 HB ILE 74 HB ILE 74 7.842 -4.228 -11.245 610 HG12 ILE 74 1HG1 ILE 74 9.109 -1.491 -10.848 611 HG13 ILE 74 2HG1 ILE 74 9.983 -2.979 -11.200 612 HG21 ILE 74 1HG2 ILE 74 6.361 -2.423 -12.011 613 HG22 ILE 74 2HG2 ILE 74 6.671 -1.510 -10.538 614 HG23 ILE 74 3HG2 ILE 74 5.761 -3.014 -10.469 615 HD11 ILE 74 3HD1 ILE 74 9.747 -1.840 -13.274 616 HD12 ILE 74 1HD1 ILE 74 8.033 -1.540 -12.992 617 HD13 ILE 74 2HD1 ILE 74 8.601 -3.180 -13.307 618 H LEU 75 H LEU 75 6.215 -2.697 -7.847 619 HA LEU 75 HA LEU 75 4.864 -5.346 -7.760 620 HB2 LEU 75 1HB LEU 75 6.166 -4.730 -5.634 621 HB3 LEU 75 2HB LEU 75 4.983 -3.454 -5.412 622 HG LEU 75 HG LEU 75 3.235 -5.465 -5.800 623 HD11 LEU 75 1HD1 LEU 75 5.637 -6.873 -4.591 624 HD12 LEU 75 2HD1 LEU 75 5.049 -7.130 -6.231 625 HD13 LEU 75 3HD1 LEU 75 4.040 -7.573 -4.856 626 HD21 LEU 75 3HD2 LEU 75 3.194 -5.807 -3.328 627 HD22 LEU 75 1HD2 LEU 75 3.311 -4.105 -3.773 628 HD23 LEU 75 2HD2 LEU 75 4.742 -4.968 -3.209 629 H GLN 76 H GLN 76 2.914 -5.181 -8.621 630 HA GLN 76 HA GLN 76 1.291 -2.748 -8.109 631 HB2 GLN 76 1HB GLN 76 2.246 -2.639 -10.416 632 HB3 GLN 76 2HB GLN 76 1.451 -4.172 -10.775 633 HG2 GLN 76 1HG GLN 76 -0.738 -3.205 -10.389 634 HG3 GLN 76 2HG GLN 76 -0.020 -1.709 -9.805 635 HE21 GLN 76 2HE2 GLN 76 -1.833 -1.664 -11.967 636 HE22 GLN 76 1HE2 GLN 76 -0.989 -1.238 -13.377 637 H TYR 77 H TYR 77 -0.802 -3.104 -7.629 638 HA TYR 77 HA TYR 77 -2.002 -5.723 -8.176 639 HB2 TYR 77 1HB TYR 77 -2.597 -6.116 -5.825 640 HB3 TYR 77 2HB TYR 77 -0.855 -6.120 -6.063 641 HD1 TYR 77 HD2 TYR 77 -3.714 -4.230 -4.676 642 HD2 TYR 77 HD1 TYR 77 0.558 -4.341 -5.159 643 HE1 TYR 77 HE2 TYR 77 -3.470 -2.454 -2.962 644 HE2 TYR 77 HE1 TYR 77 0.796 -2.568 -3.443 645 HH TYR 77 HH TYR 77 -0.814 -1.811 -1.345 646 H SER 78 H SER 78 -4.220 -5.825 -7.909 647 HA SER 78 HA SER 78 -5.590 -3.257 -8.239 648 HB2 SER 78 1HB SER 78 -7.597 -4.765 -8.595 649 HB3 SER 78 2HB SER 78 -6.283 -5.001 -9.740 650 HG SER 78 HG SER 78 -5.725 -6.849 -8.723 651 H HIS 79 H HIS 79 -7.341 -2.587 -6.841 652 HA HIS 79 HA HIS 79 -7.675 -4.056 -4.332 653 HB2 HIS 79 1HB HIS 79 -5.689 -2.556 -4.008 654 HB3 HIS 79 2HB HIS 79 -6.755 -1.175 -4.299 655 HD1 HIS 79 HD1 HIS 79 -8.069 -0.335 -2.336 656 HD2 HIS 79 HD2 HIS 79 -6.627 -4.193 -1.720 657 HE1 HIS 79 HE1 HIS 79 -8.686 -0.958 0.040 658 HE2 HIS 79 HE2 HIS 79 -7.810 -3.310 0.432 659 H PHE 80 H PHE 80 -9.584 -3.826 -3.423 660 HA PHE 80 HA PHE 80 -11.322 -1.561 -4.064 661 HB2 PHE 80 1HB PHE 80 -11.832 -3.029 -5.903 662 HB3 PHE 80 2HB PHE 80 -11.952 -4.420 -4.833 663 HD1 PHE 80 HD2 PHE 80 -13.370 -0.954 -5.119 664 HD2 PHE 80 HD1 PHE 80 -14.152 -5.085 -4.223 665 HE1 PHE 80 HE2 PHE 80 -15.760 -0.423 -4.761 666 HE2 PHE 80 HE1 PHE 80 -16.543 -4.544 -3.856 667 HZ PHE 80 HZ PHE 80 -17.346 -2.216 -4.127 668 H SER 81 H SER 81 -13.025 -1.319 -2.624 669 HA SER 81 HA SER 81 -13.274 -3.237 -0.400 670 HB2 SER 81 1HB SER 81 -11.646 -1.645 0.433 671 HB3 SER 81 2HB SER 81 -12.682 -0.297 -0.027 672 HG SER 81 HG SER 81 -14.077 -0.827 1.561 673 HA PRO 82 HA PRO 82 -17.548 -2.115 -1.138 674 HB2 PRO 82 1HB PRO 82 -18.732 -3.167 1.123 675 HB3 PRO 82 2HB PRO 82 -18.178 -4.164 -0.239 676 HG2 PRO 82 1HG PRO 82 -16.842 -3.643 2.386 677 HG3 PRO 82 2HG PRO 82 -16.926 -5.144 1.450 678 HD2 PRO 82 1HD PRO 82 -14.704 -3.513 1.465 679 HD3 PRO 82 2HD PRO 82 -15.132 -4.555 0.089 680 H LEU 83 H LEU 83 -15.803 -1.067 1.665 681 HA LEU 83 HA LEU 83 -17.701 0.556 2.947 682 HB2 LEU 83 1HB LEU 83 -14.743 1.119 2.660 683 HB3 LEU 83 2HB LEU 83 -15.812 1.705 3.934 684 HG LEU 83 HG LEU 83 -15.171 -1.225 3.410 685 HD11 LEU 83 1HD1 LEU 83 -13.892 -1.044 5.537 686 HD12 LEU 83 2HD1 LEU 83 -14.198 0.691 5.556 687 HD13 LEU 83 3HD1 LEU 83 -13.222 -0.019 4.269 688 HD21 LEU 83 3HD2 LEU 83 -16.198 -1.391 5.804 689 HD22 LEU 83 1HD2 LEU 83 -17.313 -1.174 4.456 690 HD23 LEU 83 2HD2 LEU 83 -16.879 0.202 5.469 691 H THR 84 H THR 84 -16.565 0.789 -0.170 692 HA THR 84 HA THR 84 -16.334 3.595 -0.513 693 HB THR 84 HB THR 84 -16.756 3.041 -2.954 694 HG1 THR 84 HG1 THR 84 -16.708 0.712 -3.320 695 HG21 THR 84 3HG2 THR 84 -14.484 3.071 -2.166 696 HG22 THR 84 1HG2 THR 84 -14.675 1.614 -3.141 697 HG23 THR 84 2HG2 THR 84 -14.674 1.503 -1.381 698 H GLY 85 H GLY 85 -19.053 1.559 -0.041 699 HA2 GLY 85 1HA GLY 85 -21.284 2.120 0.243 700 HA3 GLY 85 2HA GLY 85 -20.875 3.797 -0.116 701 H LYS 86 H LYS 86 -19.858 1.328 -2.326 702 HA LYS 86 HA LYS 86 -22.176 1.772 -4.086 703 HB2 LYS 86 1HB LYS 86 -19.307 2.392 -4.833 704 HB3 LYS 86 2HB LYS 86 -20.623 2.283 -5.992 705 HG2 LYS 86 1HG LYS 86 -21.830 4.065 -4.670 706 HG3 LYS 86 2HG LYS 86 -20.364 4.248 -3.704 707 HD2 LYS 86 1HD LYS 86 -19.081 4.749 -5.755 708 HD3 LYS 86 2HD LYS 86 -20.559 4.610 -6.705 709 HE2 LYS 86 1HE LYS 86 -21.567 6.458 -5.427 710 HE3 LYS 86 2HE LYS 86 -20.097 6.595 -4.462 711 HZ1 LYS 86 3HZ LYS 86 -19.492 6.619 -7.231 712 HZ2 LYS 86 1HZ LYS 86 -19.133 7.780 -6.047 713 HZ3 LYS 86 2HZ LYS 86 -20.622 7.834 -6.865 714 HA PRO 87 HA PRO 87 -21.488 -2.520 -5.020 715 HB2 PRO 87 1HB PRO 87 -22.481 -2.678 -7.604 716 HB3 PRO 87 2HB PRO 87 -23.518 -2.557 -6.164 717 HG2 PRO 87 1HG PRO 87 -22.631 -0.384 -8.032 718 HG3 PRO 87 2HG PRO 87 -24.246 -0.687 -7.362 719 HD2 PRO 87 1HD PRO 87 -22.649 1.210 -6.311 720 HD3 PRO 87 2HD PRO 87 -23.686 0.222 -5.263 721 H ASP 88 H ASP 88 -20.064 -3.907 -6.186 722 HA ASP 88 HA ASP 88 -17.565 -2.969 -6.854 723 HB2 ASP 88 1HB ASP 88 -17.188 -5.165 -7.880 724 HB3 ASP 88 2HB ASP 88 -18.062 -5.314 -6.359 725 H LEU 89 H LEU 89 -17.227 -1.422 -8.341 726 HA LEU 89 HA LEU 89 -17.954 -2.008 -11.139 727 HB2 LEU 89 1HB LEU 89 -18.602 0.468 -9.573 728 HB3 LEU 89 2HB LEU 89 -18.383 0.587 -11.314 729 HG LEU 89 HG LEU 89 -20.274 -1.459 -10.106 730 HD11 LEU 89 1HD1 LEU 89 -20.948 0.772 -9.277 731 HD12 LEU 89 2HD1 LEU 89 -22.116 0.130 -10.430 732 HD13 LEU 89 3HD1 LEU 89 -20.974 1.375 -10.935 733 HD21 LEU 89 3HD2 LEU 89 -21.397 -1.172 -12.352 734 HD22 LEU 89 1HD2 LEU 89 -19.765 -1.811 -12.476 735 HD23 LEU 89 2HD2 LEU 89 -20.071 -0.115 -12.832 736 HA PRO 90 HA PRO 90 -13.759 -0.938 -11.935 737 HB2 PRO 90 1HB PRO 90 -13.913 0.100 -14.503 738 HB3 PRO 90 2HB PRO 90 -14.013 -1.636 -14.135 739 HG2 PRO 90 1HG PRO 90 -16.231 0.311 -14.662 740 HG3 PRO 90 2HG PRO 90 -16.048 -1.362 -15.228 741 HD2 PRO 90 1HD PRO 90 -17.672 -0.730 -13.137 742 HD3 PRO 90 2HD PRO 90 -16.786 -2.270 -13.198 743 H GLU 91 H GLU 91 -16.206 1.520 -12.164 744 HA GLU 91 HA GLU 91 -14.283 3.731 -12.238 745 HB2 GLU 91 1HB GLU 91 -17.306 3.637 -12.122 746 HB3 GLU 91 2HB GLU 91 -16.365 5.126 -12.166 747 HG2 GLU 91 1HG GLU 91 -15.357 4.441 -14.306 748 HG3 GLU 91 2HG GLU 91 -16.271 2.935 -14.262 749 H ASN 92 H ASN 92 -15.655 1.719 -9.928 750 HA ASN 92 HA ASN 92 -15.630 3.746 -7.775 751 HB2 ASN 92 1HB ASN 92 -16.646 0.902 -7.859 752 HB3 ASN 92 2HB ASN 92 -16.668 1.922 -6.425 753 HD21 ASN 92 2HD2 ASN 92 -17.155 4.198 -8.677 754 HD22 ASN 92 1HD2 ASN 92 -18.842 4.127 -8.848 755 H TYR 93 H TYR 93 -13.279 2.082 -9.149 756 HA TYR 93 HA TYR 93 -11.779 1.851 -6.647 757 HB2 TYR 93 1HB TYR 93 -11.466 -0.426 -6.612 758 HB3 TYR 93 2HB TYR 93 -13.033 -0.404 -7.392 759 HD1 TYR 93 HD1 TYR 93 -12.399 0.445 -10.131 760 HD2 TYR 93 HD2 TYR 93 -10.306 -2.274 -7.566 761 HE1 TYR 93 HE1 TYR 93 -11.430 -0.691 -12.120 762 HE2 TYR 93 HE2 TYR 93 -9.349 -3.409 -9.526 763 HH TYR 93 HH TYR 93 -10.403 -3.466 -12.309 764 H HIS 94 H HIS 94 -9.465 1.188 -7.082 765 HA HIS 94 HA HIS 94 -8.470 1.961 -9.748 766 HB2 HIS 94 1HB HIS 94 -6.719 3.442 -8.438 767 HB3 HIS 94 2HB HIS 94 -8.291 4.105 -8.834 768 HD1 HIS 94 HD1 HIS 94 -8.801 5.559 -6.882 769 HD2 HIS 94 HD2 HIS 94 -7.504 1.782 -5.685 770 HE1 HIS 94 HE1 HIS 94 -9.066 5.481 -4.371 771 HE2 HIS 94 HE2 HIS 94 -8.281 3.180 -3.619 772 H VAL 95 H VAL 95 -6.224 1.535 -10.048 773 HA VAL 95 HA VAL 95 -5.286 -0.801 -8.462 774 HB VAL 95 HB VAL 95 -4.478 0.109 -11.242 775 HG11 VAL 95 1HG1 VAL 95 -3.451 -2.200 -11.298 776 HG12 VAL 95 2HG1 VAL 95 -3.796 -2.336 -9.577 777 HG13 VAL 95 3HG1 VAL 95 -2.670 -1.109 -10.155 778 HG21 VAL 95 3HG2 VAL 95 -6.822 -0.741 -11.075 779 HG22 VAL 95 1HG2 VAL 95 -6.205 -2.222 -10.346 780 HG23 VAL 95 2HG2 VAL 95 -5.784 -1.820 -12.010 781 H VAL 96 H VAL 96 -3.545 -0.612 -7.250 782 HA VAL 96 HA VAL 96 -2.020 1.919 -7.280 783 HB VAL 96 HB VAL 96 -1.975 -0.342 -5.275 784 HG11 VAL 96 1HG1 VAL 96 0.073 0.939 -5.165 785 HG12 VAL 96 2HG1 VAL 96 -0.947 1.466 -3.829 786 HG13 VAL 96 3HG1 VAL 96 -0.810 2.461 -5.279 787 HG21 VAL 96 3HG2 VAL 96 -3.410 2.333 -5.233 788 HG22 VAL 96 1HG2 VAL 96 -3.364 1.175 -3.904 789 HG23 VAL 96 2HG2 VAL 96 -4.181 0.757 -5.411 790 H THR 97 H THR 97 0.019 2.073 -7.925 791 HA THR 97 HA THR 97 1.554 -0.422 -8.495 792 HB THR 97 HB THR 97 0.947 0.461 -10.631 793 HG1 THR 97 HG1 THR 97 2.947 0.088 -11.077 794 HG21 THR 97 3HG2 THR 97 0.331 2.760 -9.781 795 HG22 THR 97 1HG2 THR 97 1.251 2.759 -11.283 796 HG23 THR 97 2HG2 THR 97 2.052 3.141 -9.765 797 H ILE 98 H ILE 98 3.304 -0.614 -7.354 798 HA ILE 98 HA ILE 98 4.565 1.792 -6.153 799 HB ILE 98 HB ILE 98 4.979 -1.080 -5.321 800 HG12 ILE 98 1HG1 ILE 98 2.598 -0.632 -5.135 801 HG13 ILE 98 2HG1 ILE 98 3.315 -0.639 -3.532 802 HG21 ILE 98 1HG2 ILE 98 5.389 1.565 -3.905 803 HG22 ILE 98 2HG2 ILE 98 6.662 0.526 -4.549 804 HG23 ILE 98 3HG2 ILE 98 5.678 -0.023 -3.197 805 HD11 ILE 98 3HD1 ILE 98 2.392 1.735 -5.156 806 HD12 ILE 98 1HD1 ILE 98 3.487 1.931 -3.787 807 HD13 ILE 98 2HD1 ILE 98 1.882 1.245 -3.544 808 H THR 99 H THR 99 6.556 2.353 -6.712 809 HA THR 99 HA THR 99 8.187 0.472 -8.365 810 HB THR 99 HB THR 99 8.132 3.496 -8.508 811 HG1 THR 99 HG1 THR 99 6.272 2.393 -9.368 812 HG21 THR 99 3HG2 THR 99 9.635 1.349 -10.033 813 HG22 THR 99 1HG2 THR 99 10.317 2.670 -9.083 814 HG23 THR 99 2HG2 THR 99 9.486 3.010 -10.600 815 H LEU 100 H LEU 100 9.827 -0.271 -7.211 816 HA LEU 100 HA LEU 100 11.267 1.578 -5.364 817 HB2 LEU 100 1HB LEU 100 10.593 -1.347 -5.076 818 HB3 LEU 100 2HB LEU 100 11.820 -0.557 -4.087 819 HG LEU 100 HG LEU 100 9.067 0.689 -4.259 820 HD11 LEU 100 1HD1 LEU 100 8.571 -1.628 -3.720 821 HD12 LEU 100 2HD1 LEU 100 8.386 -0.646 -2.267 822 HD13 LEU 100 3HD1 LEU 100 9.825 -1.645 -2.479 823 HD21 LEU 100 3HD2 LEU 100 9.629 1.449 -1.985 824 HD22 LEU 100 1HD2 LEU 100 10.939 1.871 -3.083 825 HD23 LEU 100 2HD2 LEU 100 11.105 0.486 -2.008 826 H THR 101 H THR 101 13.241 1.984 -5.935 827 HA THR 101 HA THR 101 14.816 -0.082 -7.385 828 HB THR 101 HB THR 101 14.974 2.884 -7.977 829 HG1 THR 101 HG1 THR 101 13.337 2.640 -9.254 830 HG21 THR 101 3HG2 THR 101 16.939 1.474 -8.518 831 HG22 THR 101 1HG2 THR 101 16.155 2.081 -9.977 832 HG23 THR 101 2HG2 THR 101 15.897 0.412 -9.465 833 H ALA 102 H ALA 102 16.770 -0.444 -6.571 834 HA ALA 102 HA ALA 102 17.629 1.035 -4.202 835 HB1 ALA 102 3HB ALA 102 18.747 -1.383 -5.632 836 HB2 ALA 102 1HB ALA 102 17.809 -1.370 -4.139 837 HB3 ALA 102 2HB ALA 102 19.438 -0.698 -4.164 838 H LEU 103 H LEU 103 18.978 2.703 -4.270 839 HA LEU 103 HA LEU 103 20.457 3.314 -6.744 840 HB2 LEU 103 1HB LEU 103 20.235 5.010 -4.250 841 HB3 LEU 103 2HB LEU 103 20.686 5.526 -5.872 842 HG LEU 103 HG LEU 103 17.960 4.464 -5.044 843 HD11 LEU 103 1HD1 LEU 103 17.249 6.813 -5.625 844 HD12 LEU 103 2HD1 LEU 103 18.956 7.242 -5.734 845 HD13 LEU 103 3HD1 LEU 103 18.279 6.697 -4.199 846 HD21 LEU 103 3HD2 LEU 103 17.373 5.334 -7.416 847 HD22 LEU 103 1HD2 LEU 103 18.255 3.815 -7.323 848 HD23 LEU 103 2HD2 LEU 103 19.108 5.306 -7.726 849 H LYS 104 H LYS 104 22.407 4.921 -5.314 850 HA LYS 104 HA LYS 104 24.436 2.890 -4.959 851 HB2 LYS 104 1HB LYS 104 25.818 5.080 -4.360 852 HB3 LYS 104 2HB LYS 104 25.338 4.743 -6.020 853 HG2 LYS 104 1HG LYS 104 23.418 6.301 -4.290 854 HG3 LYS 104 2HG LYS 104 24.834 7.139 -4.904 855 HD2 LYS 104 1HD LYS 104 23.239 5.524 -6.892 856 HD3 LYS 104 2HD LYS 104 22.524 7.032 -6.323 857 HE2 LYS 104 1HE LYS 104 23.990 7.206 -8.422 858 HE3 LYS 104 2HE LYS 104 24.369 8.324 -7.111 859 HZ1 LYS 104 3HZ LYS 104 25.761 5.776 -7.723 860 HZ2 LYS 104 1HZ LYS 104 26.056 6.717 -6.343 861 HZ3 LYS 104 2HZ LYS 104 26.387 7.346 -7.885 862 H LYS 105 H LYS 105 23.018 5.330 -2.786 863 HA LYS 105 HA LYS 105 23.757 3.672 -0.452 864 HB2 LYS 105 1HB LYS 105 24.271 6.648 -0.744 865 HB3 LYS 105 2HB LYS 105 24.354 5.775 0.784 866 HG2 LYS 105 1HG LYS 105 26.095 4.288 -0.180 867 HG3 LYS 105 2HG LYS 105 26.047 5.224 -1.672 868 HD2 LYS 105 1HD LYS 105 26.697 7.257 -0.412 869 HD3 LYS 105 2HD LYS 105 26.765 6.307 1.070 870 HE2 LYS 105 1HE LYS 105 28.521 4.879 0.073 871 HE3 LYS 105 2HE LYS 105 28.466 5.847 -1.399 872 HZ1 LYS 105 3HZ LYS 105 30.126 6.336 0.618 873 HZ2 LYS 105 1HZ LYS 105 28.826 7.322 1.076 874 HZ3 LYS 105 2HZ LYS 105 29.564 7.539 -0.440 875 H GLY 106 H GLY 106 21.230 3.966 -1.840 876 HA2 GLY 106 1HA GLY 106 19.509 4.362 0.351 877 HA3 GLY 106 2HA GLY 106 19.515 5.828 -0.620 878 H VAL 107 H VAL 107 17.179 4.504 -0.368 879 HA VAL 107 HA VAL 107 16.775 3.254 -3.048 880 HB VAL 107 HB VAL 107 16.657 1.564 -1.269 881 HG11 VAL 107 1HG1 VAL 107 15.927 3.218 0.518 882 HG12 VAL 107 2HG1 VAL 107 15.059 1.685 0.516 883 HG13 VAL 107 3HG1 VAL 107 14.303 3.123 -0.164 884 HG21 VAL 107 3HG2 VAL 107 13.884 2.221 -2.314 885 HG22 VAL 107 1HG2 VAL 107 14.519 0.635 -1.900 886 HG23 VAL 107 2HG2 VAL 107 15.153 1.492 -3.296 887 H GLU 108 H GLU 108 15.246 4.112 -4.262 888 HA GLU 108 HA GLU 108 13.703 6.385 -3.238 889 HB2 GLU 108 1HB GLU 108 14.874 6.494 -5.457 890 HB3 GLU 108 2HB GLU 108 13.781 5.241 -6.044 891 HG2 GLU 108 1HG GLU 108 11.843 6.670 -5.604 892 HG3 GLU 108 2HG GLU 108 12.885 7.906 -4.905 893 H VAL 109 H VAL 109 11.532 6.422 -3.005 894 HA VAL 109 HA VAL 109 9.964 3.995 -3.704 895 HB VAL 109 HB VAL 109 10.491 3.769 -1.354 896 HG11 VAL 109 1HG1 VAL 109 9.863 5.515 0.271 897 HG12 VAL 109 2HG1 VAL 109 9.378 6.570 -1.055 898 HG13 VAL 109 3HG1 VAL 109 11.065 6.092 -0.879 899 HG21 VAL 109 3HG2 VAL 109 7.663 4.860 -1.522 900 HG22 VAL 109 1HG2 VAL 109 8.269 3.591 -0.459 901 HG23 VAL 109 2HG2 VAL 109 8.126 3.296 -2.191 902 H GLU 110 H GLU 110 7.978 4.362 -4.473 903 HA GLU 110 HA GLU 110 6.712 6.991 -4.201 904 HB2 GLU 110 1HB GLU 110 8.185 7.211 -6.184 905 HB3 GLU 110 2HB GLU 110 7.379 5.821 -6.909 906 HG2 GLU 110 1HG GLU 110 5.248 6.997 -6.928 907 HG3 GLU 110 2HG GLU 110 5.953 8.353 -6.052 908 H LEU 111 H LEU 111 4.575 6.870 -4.190 909 HA LEU 111 HA LEU 111 3.261 4.319 -4.980 910 HB2 LEU 111 1HB LEU 111 3.437 4.751 -2.497 911 HB3 LEU 111 2HB LEU 111 2.424 6.168 -2.740 912 HG LEU 111 HG LEU 111 1.343 3.611 -3.916 913 HD11 LEU 111 1HD1 LEU 111 2.253 2.796 -1.779 914 HD12 LEU 111 2HD1 LEU 111 0.489 2.787 -1.774 915 HD13 LEU 111 3HD1 LEU 111 1.369 4.056 -0.920 916 HD21 LEU 111 3HD2 LEU 111 0.098 5.814 -3.898 917 HD22 LEU 111 1HD2 LEU 111 0.033 5.706 -2.141 918 HD23 LEU 111 2HD2 LEU 111 -0.782 4.495 -3.132 919 H THR 112 H THR 112 1.607 4.486 -6.347 920 HA THR 112 HA THR 112 0.461 7.184 -6.893 921 HB THR 112 HB THR 112 0.854 5.021 -8.969 922 HG1 THR 112 HG1 THR 112 2.839 5.641 -9.075 923 HG21 THR 112 3HG2 THR 112 0.440 6.848 -10.525 924 HG22 THR 112 1HG2 THR 112 0.389 7.998 -9.191 925 HG23 THR 112 2HG2 THR 112 -0.879 6.785 -9.357 926 H GLN 113 H GLN 113 -1.670 7.348 -7.228 927 HA GLN 113 HA GLN 113 -3.373 4.942 -7.316 928 HB2 GLN 113 1HB GLN 113 -3.079 5.539 -4.904 929 HB3 GLN 113 2HB GLN 113 -3.764 7.126 -5.254 930 HG2 GLN 113 1HG GLN 113 -5.847 6.055 -6.055 931 HG3 GLN 113 2HG GLN 113 -5.159 4.470 -5.707 932 HE21 GLN 113 2HE2 GLN 113 -7.285 6.627 -4.441 933 HE22 GLN 113 1HE2 GLN 113 -7.061 6.327 -2.783 934 H ASP 114 H ASP 114 -5.124 5.221 -8.563 935 HA ASP 114 HA ASP 114 -5.645 7.933 -9.670 936 HB2 ASP 114 1HB ASP 114 -6.516 6.757 -11.632 937 HB3 ASP 114 2HB ASP 114 -4.850 6.301 -11.295 938 H ASN 115 H ASN 115 -7.996 7.470 -10.893 939 HA ASN 115 HA ASN 115 -10.231 7.627 -10.647 940 HB2 ASN 115 1HB ASN 115 -9.951 5.199 -10.095 941 HB3 ASN 115 2HB ASN 115 -9.979 5.652 -8.388 942 HD21 ASN 115 2HD2 ASN 115 -12.033 4.357 -8.242 943 HD22 ASN 115 1HD2 ASN 115 -13.486 5.062 -8.766 944 H ASN 116 H ASN 116 -8.737 9.599 -9.185 945 HA ASN 116 HA ASN 116 -10.142 9.945 -6.632 946 HB2 ASN 116 1HB ASN 116 -8.225 11.725 -8.167 947 HB3 ASN 116 2HB ASN 116 -8.932 12.154 -6.611 948 HD21 ASN 116 2HD2 ASN 116 -6.049 11.325 -7.583 949 HD22 ASN 116 1HD2 ASN 116 -5.586 10.177 -6.418 950 H GLU 117 H GLU 117 -12.250 10.584 -6.732 951 HA GLU 117 HA GLU 117 -13.465 11.632 -9.044 952 HB2 GLU 117 1HB GLU 117 -14.664 10.411 -7.233 953 HB3 GLU 117 2HB GLU 117 -14.506 11.836 -6.209 954 HG2 GLU 117 1HG GLU 117 -15.758 13.177 -7.849 955 HG3 GLU 117 2HG GLU 117 -15.864 11.786 -8.918 956 H THR 118 H THR 118 -12.082 13.267 -6.230 957 HA THR 118 HA THR 118 -12.200 15.822 -7.720 958 HB THR 118 HB THR 118 -13.119 17.053 -5.872 959 HG1 THR 118 HG1 THR 118 -12.564 16.194 -4.029 960 HG21 THR 118 3HG2 THR 118 -14.700 15.799 -7.397 961 HG22 THR 118 1HG2 THR 118 -15.359 16.170 -5.803 962 HG23 THR 118 2HG2 THR 118 -14.784 14.545 -6.162 963 H GLU 119 H GLU 119 -10.850 17.501 -6.707 964 HA GLU 119 HA GLU 119 -8.237 16.602 -6.212 965 HB2 GLU 119 1HB GLU 119 -9.543 19.260 -5.558 966 HB3 GLU 119 2HB GLU 119 -7.806 18.956 -5.500 967 HG2 GLU 119 1HG GLU 119 -7.740 18.462 -7.853 968 HG3 GLU 119 2HG GLU 119 -9.496 18.523 -7.976 969 H LYS 120 H LYS 120 -10.885 17.439 -4.078 970 HA LYS 120 HA LYS 120 -9.531 17.501 -1.622 971 HB2 LYS 120 1HB LYS 120 -11.894 18.192 -1.987 972 HB3 LYS 120 2HB LYS 120 -12.340 16.497 -2.147 973 HG2 LYS 120 1HG LYS 120 -11.474 16.065 0.148 974 HG3 LYS 120 2HG LYS 120 -11.089 17.774 0.310 975 HD2 LYS 120 1HD LYS 120 -13.893 16.808 -0.326 976 HD3 LYS 120 2HD LYS 120 -13.326 16.993 1.330 977 HE2 LYS 120 1HE LYS 120 -12.750 19.407 0.742 978 HE3 LYS 120 2HE LYS 120 -13.616 19.161 -0.771 979 HZ1 LYS 120 3HZ LYS 120 -14.816 20.050 1.361 980 HZ2 LYS 120 1HZ LYS 120 -14.953 18.394 1.707 981 HZ3 LYS 120 2HZ LYS 120 -15.603 19.016 0.267 982 H GLU 121 H GLU 121 -10.911 14.797 -3.458 983 HA GLU 121 HA GLU 121 -10.368 12.797 -1.512 984 HB2 GLU 121 1HB GLU 121 -12.021 12.501 -3.326 985 HB3 GLU 121 2HB GLU 121 -10.710 12.503 -4.506 986 HG2 GLU 121 1HG GLU 121 -9.744 10.496 -3.499 987 HG3 GLU 121 2HG GLU 121 -10.949 10.530 -2.213 988 H GLN 122 H GLN 122 -8.584 14.003 -4.330 989 HA GLN 122 HA GLN 122 -6.462 12.129 -4.201 990 HB2 GLN 122 1HB GLN 122 -6.831 13.511 -6.194 991 HB3 GLN 122 2HB GLN 122 -6.485 14.971 -5.270 992 HG2 GLN 122 1HG GLN 122 -4.187 14.283 -4.915 993 HG3 GLN 122 2HG GLN 122 -4.506 12.697 -5.615 994 HE21 GLN 122 2HE2 GLN 122 -4.416 16.189 -6.454 995 HE22 GLN 122 1HE2 GLN 122 -4.076 15.936 -8.099 996 H LYS 123 H LYS 123 -6.868 15.398 -2.894 997 HA LYS 123 HA LYS 123 -4.395 15.587 -1.610 998 HB2 LYS 123 1HB LYS 123 -5.947 17.501 -1.934 999 HB3 LYS 123 2HB LYS 123 -7.044 16.788 -0.760 1000 HG2 LYS 123 1HG LYS 123 -5.762 18.498 0.364 1001 HG3 LYS 123 2HG LYS 123 -5.200 16.941 0.961 1002 HD2 LYS 123 1HD LYS 123 -3.206 17.040 -0.371 1003 HD3 LYS 123 2HD LYS 123 -3.823 18.387 -1.325 1004 HE2 LYS 123 1HE LYS 123 -3.737 19.825 0.664 1005 HE3 LYS 123 2HE LYS 123 -3.154 18.463 1.624 1006 HZ1 LYS 123 3HZ LYS 123 -1.765 20.046 -0.380 1007 HZ2 LYS 123 1HZ LYS 123 -1.434 18.382 -0.377 1008 HZ3 LYS 123 2HZ LYS 123 -1.166 19.302 1.026 1009 H HIS 124 H HIS 124 -7.504 14.329 -0.538 1010 HA HIS 124 HA HIS 124 -6.806 13.693 2.119 1011 HB2 HIS 124 1HB HIS 124 -9.125 13.813 1.267 1012 HB3 HIS 124 2HB HIS 124 -8.830 12.381 0.288 1013 HD1 HIS 124 HD1 HIS 124 -8.752 13.423 3.955 1014 HD2 HIS 124 HD2 HIS 124 -9.341 10.017 1.625 1015 HE1 HIS 124 HE1 HIS 124 -9.424 11.572 5.548 1016 HE2 HIS 124 HE2 HIS 124 -9.785 9.489 4.143 1017 H SER 125 H SER 125 -6.539 11.964 -0.931 1018 HA SER 125 HA SER 125 -5.716 9.461 0.158 1019 HB2 SER 125 1HB SER 125 -5.240 10.663 -2.581 1020 HB3 SER 125 2HB SER 125 -4.928 8.988 -2.148 1021 HG SER 125 HG SER 125 -7.381 10.389 -2.288 1022 H GLU 126 H GLU 126 -3.897 12.086 -1.415 1023 HA GLU 126 HA GLU 126 -1.317 11.125 -1.061 1024 HB2 GLU 126 1HB GLU 126 -2.377 13.961 -1.050 1025 HB3 GLU 126 2HB GLU 126 -0.658 13.573 -1.083 1026 HG2 GLU 126 1HG GLU 126 -0.913 12.380 -3.175 1027 HG3 GLU 126 2HG GLU 126 -2.660 12.582 -3.127 1028 H ASP 127 H ASP 127 -3.308 13.052 1.160 1029 HA ASP 127 HA ASP 127 -1.378 13.343 3.198 1030 HB2 ASP 127 1HB ASP 127 -3.504 14.648 3.027 1031 HB3 ASP 127 2HB ASP 127 -4.385 13.200 3.506 1032 H ASN 128 H ASN 128 -3.793 10.852 2.523 1033 HA ASN 128 HA ASN 128 -3.402 9.354 4.908 1034 HB2 ASN 128 1HB ASN 128 -5.401 9.095 3.499 1035 HB3 ASN 128 2HB ASN 128 -4.404 8.457 2.196 1036 HD21 ASN 128 2HD2 ASN 128 -4.711 6.236 2.093 1037 HD22 ASN 128 1HD2 ASN 128 -4.783 5.202 3.439 1038 H TRP 129 H TRP 129 -2.186 8.896 1.590 1039 HA TRP 129 HA TRP 129 -0.522 6.696 2.237 1040 HB2 TRP 129 1HB TRP 129 -0.392 8.683 -0.053 1041 HB3 TRP 129 2HB TRP 129 0.610 7.229 0.056 1042 HD1 TRP 129 HD1 TRP 129 -2.640 8.347 -1.244 1043 HE1 TRP 129 HE1 TRP 129 -4.179 6.346 -1.756 1044 HE3 TRP 129 HE3 TRP 129 -0.059 4.619 1.113 1045 HZ2 TRP 129 HZ2 TRP 129 -4.300 3.536 -1.237 1046 HZ3 TRP 129 HZ3 TRP 129 -0.911 2.294 1.084 1047 HH2 TRP 129 HH2 TRP 129 -3.025 1.748 -0.085 1048 H ASN 130 H ASN 130 0.085 10.196 2.091 1049 HA ASN 130 HA ASN 130 2.857 10.113 2.578 1050 HB2 ASN 130 1HB ASN 130 0.743 12.160 3.308 1051 HB3 ASN 130 2HB ASN 130 2.458 12.416 3.628 1052 HD21 ASN 130 2HD2 ASN 130 0.755 13.947 1.743 1053 HD22 ASN 130 1HD2 ASN 130 1.455 13.750 0.208 1054 H THR 131 H THR 131 0.069 10.032 4.746 1055 HA THR 131 HA THR 131 1.496 10.113 7.188 1056 HB THR 131 HB THR 131 -1.186 8.836 6.585 1057 HG1 THR 131 HG1 THR 131 -0.383 11.412 7.434 1058 HG21 THR 131 3HG2 THR 131 -1.540 9.279 9.047 1059 HG22 THR 131 1HG2 THR 131 0.187 9.614 9.168 1060 HG23 THR 131 2HG2 THR 131 -0.371 8.009 8.693 1061 H MET 132 H MET 132 0.454 7.496 5.065 1062 HA MET 132 HA MET 132 1.307 5.351 6.730 1063 HB2 MET 132 1HB MET 132 -0.259 5.097 4.795 1064 HB3 MET 132 2HB MET 132 1.090 5.395 3.701 1065 HG2 MET 132 1HG MET 132 2.254 3.426 4.505 1066 HG3 MET 132 2HG MET 132 1.040 3.166 5.756 1067 HE1 MET 132 3HE MET 132 -1.523 3.064 5.158 1068 HE2 MET 132 1HE MET 132 -0.815 1.469 5.446 1069 HE3 MET 132 2HE MET 132 -1.958 1.704 4.126 1070 H LEU 133 H LEU 133 2.811 6.982 3.949 1071 HA LEU 133 HA LEU 133 5.273 5.604 4.046 1072 HB2 LEU 133 1HB LEU 133 4.271 8.114 2.773 1073 HB3 LEU 133 2HB LEU 133 6.016 7.941 2.901 1074 HG LEU 133 HG LEU 133 5.116 7.090 0.746 1075 HD11 LEU 133 1HD1 LEU 133 7.116 5.966 2.228 1076 HD12 LEU 133 2HD1 LEU 133 6.672 5.409 0.619 1077 HD13 LEU 133 3HD1 LEU 133 6.061 4.564 2.040 1078 HD21 LEU 133 3HD2 LEU 133 3.795 4.891 2.368 1079 HD22 LEU 133 1HD2 LEU 133 3.693 5.150 0.629 1080 HD23 LEU 133 2HD2 LEU 133 2.929 6.282 1.730 1081 H GLU 134 H GLU 134 4.155 8.562 5.595 1082 HA GLU 134 HA GLU 134 6.633 9.262 6.780 1083 HB2 GLU 134 1HB GLU 134 4.757 10.837 6.520 1084 HB3 GLU 134 2HB GLU 134 3.808 9.894 7.665 1085 HG2 GLU 134 1HG GLU 134 5.444 10.347 9.431 1086 HG3 GLU 134 2HG GLU 134 6.451 11.232 8.287 1087 H GLY 135 H GLY 135 3.832 7.391 7.892 1088 HA2 GLY 135 1HA GLY 135 4.832 6.807 10.488 1089 HA3 GLY 135 2HA GLY 135 3.549 5.934 9.647 1090 H LEU 136 H LEU 136 5.070 5.221 7.350 1091 HA LEU 136 HA LEU 136 6.319 2.836 8.301 1092 HB2 LEU 136 1HB LEU 136 5.142 2.844 6.164 1093 HB3 LEU 136 2HB LEU 136 6.227 4.077 5.544 1094 HG LEU 136 HG LEU 136 8.127 2.526 5.660 1095 HD11 LEU 136 1HD1 LEU 136 7.487 0.037 6.145 1096 HD12 LEU 136 2HD1 LEU 136 6.090 0.720 6.980 1097 HD13 LEU 136 3HD1 LEU 136 7.722 1.121 7.511 1098 HD21 LEU 136 3HD2 LEU 136 5.690 1.320 4.308 1099 HD22 LEU 136 1HD2 LEU 136 7.366 0.908 3.944 1100 HD23 LEU 136 2HD2 LEU 136 6.767 2.533 3.618 1101 H LYS 137 H LYS 137 7.506 5.836 6.835 1102 HA LYS 137 HA LYS 137 10.222 5.128 6.714 1103 HB2 LYS 137 1HB LYS 137 9.272 7.073 5.532 1104 HB3 LYS 137 2HB LYS 137 9.033 7.888 7.076 1105 HG2 LYS 137 1HG LYS 137 11.429 7.896 7.499 1106 HG3 LYS 137 2HG LYS 137 11.721 6.923 6.062 1107 HD2 LYS 137 1HD LYS 137 12.217 9.232 5.517 1108 HD3 LYS 137 2HD LYS 137 10.744 8.769 4.674 1109 HE2 LYS 137 1HE LYS 137 10.514 10.082 7.384 1110 HE3 LYS 137 2HE LYS 137 10.821 11.075 5.959 1111 HZ1 LYS 137 3HZ LYS 137 8.417 9.769 6.761 1112 HZ2 LYS 137 1HZ LYS 137 8.859 9.345 5.179 1113 HZ3 LYS 137 2HZ LYS 137 8.655 10.979 5.592 1114 H LYS 138 H LYS 138 8.357 6.736 9.274 1115 HA LYS 138 HA LYS 138 10.484 7.278 11.018 1116 HB2 LYS 138 1HB LYS 138 8.150 8.160 11.250 1117 HB3 LYS 138 2HB LYS 138 7.646 6.562 11.792 1118 HG2 LYS 138 1HG LYS 138 9.170 6.679 13.697 1119 HG3 LYS 138 2HG LYS 138 9.794 8.228 13.136 1120 HD2 LYS 138 1HD LYS 138 7.542 9.221 13.392 1121 HD3 LYS 138 2HD LYS 138 6.933 7.674 13.978 1122 HE2 LYS 138 1HE LYS 138 8.501 7.755 15.874 1123 HE3 LYS 138 2HE LYS 138 9.148 9.285 15.281 1124 HZ1 LYS 138 3HZ LYS 138 7.211 10.401 15.782 1125 HZ2 LYS 138 1HZ LYS 138 7.329 9.313 17.079 1126 HZ3 LYS 138 2HZ LYS 138 6.263 8.991 15.796 1127 H PHE 139 H PHE 139 8.575 4.342 10.544 1128 HA PHE 139 HA PHE 139 9.442 2.951 12.833 1129 HB2 PHE 139 1HB PHE 139 7.548 2.318 11.233 1130 HB3 PHE 139 2HB PHE 139 8.788 1.662 10.168 1131 HD1 PHE 139 HD1 PHE 139 10.300 -0.193 11.003 1132 HD2 PHE 139 HD2 PHE 139 6.858 1.133 13.206 1133 HE1 PHE 139 HE1 PHE 139 10.359 -2.271 12.348 1134 HE2 PHE 139 HE2 PHE 139 6.921 -0.946 14.550 1135 HZ PHE 139 HZ PHE 139 8.671 -2.649 14.122 1136 H LEU 140 H LEU 140 10.701 2.964 9.506 1137 HA LEU 140 HA LEU 140 12.874 1.207 10.021 1138 HB2 LEU 140 1HB LEU 140 12.142 3.092 7.801 1139 HB3 LEU 140 2HB LEU 140 13.776 2.437 7.838 1140 HG LEU 140 HG LEU 140 12.761 0.121 7.949 1141 HD11 LEU 140 1HD1 LEU 140 10.214 1.665 7.391 1142 HD12 LEU 140 2HD1 LEU 140 10.562 0.726 8.840 1143 HD13 LEU 140 3HD1 LEU 140 10.379 -0.087 7.291 1144 HD21 LEU 140 3HD2 LEU 140 12.175 0.051 5.597 1145 HD22 LEU 140 1HD2 LEU 140 13.524 1.163 5.825 1146 HD23 LEU 140 2HD2 LEU 140 11.895 1.795 5.580 1147 H GLU 141 H GLU 141 12.531 4.701 10.179 1148 HA GLU 141 HA GLU 141 15.321 5.209 10.591 1149 HB2 GLU 141 1HB GLU 141 12.854 6.898 11.065 1150 HB3 GLU 141 2HB GLU 141 14.493 7.487 11.324 1151 HG2 GLU 141 1HG GLU 141 15.042 6.987 8.973 1152 HG3 GLU 141 2HG GLU 141 13.406 6.410 8.707 1153 H ASN 142 H ASN 142 13.165 3.625 12.456 1154 HA ASN 142 HA ASN 142 13.499 4.698 15.035 1155 HB2 ASN 142 1HB ASN 142 11.777 3.026 14.439 1156 HB3 ASN 142 2HB ASN 142 13.042 1.814 14.248 1157 HD21 ASN 142 2HD2 ASN 142 11.500 0.859 16.061 1158 HD22 ASN 142 1HD2 ASN 142 11.954 1.223 17.658 1159 H LYS 143 H LYS 143 15.452 2.447 13.148 1160 HA LYS 143 HA LYS 143 17.142 1.533 15.199 1161 HB2 LYS 143 1HB LYS 143 16.927 0.621 12.850 1162 HB3 LYS 143 2HB LYS 143 17.925 1.968 12.314 1163 HG2 LYS 143 1HG LYS 143 19.609 1.141 14.167 1164 HG3 LYS 143 2HG LYS 143 18.696 -0.363 14.092 1165 HD2 LYS 143 1HD LYS 143 20.137 1.009 11.811 1166 HD3 LYS 143 2HD LYS 143 20.584 -0.514 12.574 1167 HE2 LYS 143 1HE LYS 143 18.280 -1.384 11.839 1168 HE3 LYS 143 2HE LYS 143 18.179 0.062 10.829 1169 HZ1 LYS 143 3HZ LYS 143 20.386 -1.927 10.738 1170 HZ2 LYS 143 1HZ LYS 143 20.203 -0.582 9.723 1171 HZ3 LYS 143 2HZ LYS 143 19.093 -1.861 9.640 1172 H VAL 144 H VAL 144 17.701 4.161 12.836 1173 HA VAL 144 HA VAL 144 20.119 5.040 14.041 1174 HB VAL 144 HB VAL 144 19.603 5.524 11.694 1175 HG11 VAL 144 1HG1 VAL 144 17.441 7.334 12.815 1176 HG12 VAL 144 2HG1 VAL 144 17.192 5.856 11.889 1177 HG13 VAL 144 3HG1 VAL 144 17.937 7.255 11.125 1178 HG21 VAL 144 3HG2 VAL 144 21.124 7.028 13.026 1179 HG22 VAL 144 1HG2 VAL 144 19.751 8.101 13.295 1180 HG23 VAL 144 2HG2 VAL 144 20.352 7.830 11.660 1181 H SER 145 H SER 145 16.758 5.806 14.570 1182 HA SER 145 HA SER 145 17.022 8.216 15.985 1183 HB2 SER 145 1HB SER 145 14.847 7.354 15.236 1184 HB3 SER 145 2HB SER 145 14.985 6.008 16.359 1185 HG SER 145 HG SER 145 14.514 8.730 16.836 1186 H ALA 146 H ALA 146 17.087 4.858 17.099 1187 HA ALA 146 HA ALA 146 17.312 5.370 19.860 1188 HB1 ALA 146 3HB ALA 146 18.264 3.046 19.941 1189 HB2 ALA 146 1HB ALA 146 18.256 3.038 18.177 1190 HB3 ALA 146 2HB ALA 146 16.738 3.162 19.065 Start of MODEL 8 1 H1 MET 1 1H MET 1 -7.876 7.345 -22.200 2 H2 MET 1 2H MET 1 -8.178 7.229 -23.868 3 H3 MET 1 3H MET 1 -8.905 8.463 -22.953 4 HA MET 1 HA MET 1 -5.968 8.203 -23.221 5 HB2 MET 1 1HB MET 1 -6.247 10.106 -24.917 6 HB3 MET 1 2HB MET 1 -6.712 8.501 -25.473 7 HG2 MET 1 1HG MET 1 -8.769 10.355 -24.247 8 HG3 MET 1 2HG MET 1 -8.351 10.462 -25.957 9 HE1 MET 1 3HE MET 1 -11.097 10.060 -26.018 10 HE2 MET 1 1HE MET 1 -11.107 9.697 -24.287 11 HE3 MET 1 2HE MET 1 -11.852 8.582 -25.428 12 H GLU 2 H GLU 2 -8.252 9.025 -21.231 13 HA GLU 2 HA GLU 2 -6.791 11.210 -20.044 14 HB2 GLU 2 1HB GLU 2 -8.153 12.389 -21.772 15 HB3 GLU 2 2HB GLU 2 -9.608 11.751 -21.013 16 HG2 GLU 2 1HG GLU 2 -9.057 12.902 -18.919 17 HG3 GLU 2 2HG GLU 2 -7.545 13.480 -19.616 18 H ILE 3 H ILE 3 -7.364 11.512 -17.877 19 HA ILE 3 HA ILE 3 -9.619 9.973 -16.767 20 HB ILE 3 HB ILE 3 -8.310 8.729 -15.225 21 HG12 ILE 3 1HG1 ILE 3 -6.655 10.340 -14.495 22 HG13 ILE 3 2HG1 ILE 3 -5.781 8.962 -15.150 23 HG21 ILE 3 1HG2 ILE 3 -8.319 7.905 -17.584 24 HG22 ILE 3 2HG2 ILE 3 -6.917 7.369 -16.663 25 HG23 ILE 3 3HG2 ILE 3 -6.756 8.684 -17.825 26 HD11 ILE 3 3HD1 ILE 3 -5.721 10.259 -17.379 27 HD12 ILE 3 1HD1 ILE 3 -4.704 10.866 -16.077 28 HD13 ILE 3 2HD1 ILE 3 -6.231 11.660 -16.437 29 H LYS 4 H LYS 4 -9.483 10.308 -14.213 30 HA LYS 4 HA LYS 4 -9.804 13.138 -13.820 31 HB2 LYS 4 1HB LYS 4 -9.919 10.860 -11.821 32 HB3 LYS 4 2HB LYS 4 -10.475 12.511 -11.557 33 HG2 LYS 4 1HG LYS 4 -12.098 12.277 -13.394 34 HG3 LYS 4 2HG LYS 4 -11.566 10.614 -13.646 35 HD2 LYS 4 1HD LYS 4 -12.231 10.050 -11.335 36 HD3 LYS 4 2HD LYS 4 -12.779 11.709 -11.091 37 HE2 LYS 4 1HE LYS 4 -14.411 11.442 -12.923 38 HE3 LYS 4 2HE LYS 4 -13.869 9.782 -13.163 39 HZ1 LYS 4 3HZ LYS 4 -15.897 10.412 -11.596 40 HZ2 LYS 4 1HZ LYS 4 -14.644 10.530 -10.459 41 HZ3 LYS 4 2HZ LYS 4 -14.893 9.074 -11.298 42 H LEU 5 H LEU 5 -8.904 13.166 -11.062 43 HA LEU 5 HA LEU 5 -6.169 13.997 -11.508 44 HB2 LEU 5 1HB LEU 5 -8.040 14.071 -9.144 45 HB3 LEU 5 2HB LEU 5 -6.351 14.514 -8.962 46 HG LEU 5 HG LEU 5 -7.892 16.453 -9.356 47 HD11 LEU 5 1HD1 LEU 5 -6.411 17.628 -10.727 48 HD12 LEU 5 2HD1 LEU 5 -6.045 16.242 -11.736 49 HD13 LEU 5 3HD1 LEU 5 -5.393 16.338 -10.099 50 HD21 LEU 5 3HD2 LEU 5 -9.364 15.114 -10.972 51 HD22 LEU 5 1HD2 LEU 5 -8.130 15.433 -12.194 52 HD23 LEU 5 2HD2 LEU 5 -8.990 16.772 -11.438 53 H ILE 6 H ILE 6 -4.315 13.134 -10.745 54 HA ILE 6 HA ILE 6 -4.447 10.422 -9.511 55 HB ILE 6 HB ILE 6 -2.367 11.556 -11.400 56 HG12 ILE 6 1HG1 ILE 6 -4.386 9.336 -11.864 57 HG13 ILE 6 2HG1 ILE 6 -4.631 10.996 -12.402 58 HG21 ILE 6 1HG2 ILE 6 -1.344 9.963 -9.865 59 HG22 ILE 6 2HG2 ILE 6 -1.560 9.160 -11.414 60 HG23 ILE 6 3HG2 ILE 6 -2.676 8.830 -10.092 61 HD11 ILE 6 3HD1 ILE 6 -2.354 9.174 -13.221 62 HD12 ILE 6 1HD1 ILE 6 -2.511 10.864 -13.696 63 HD13 ILE 6 2HD1 ILE 6 -3.702 9.684 -14.235 64 H ALA 7 H ALA 7 -3.506 10.195 -7.584 65 HA ALA 7 HA ALA 7 -2.051 12.419 -6.380 66 HB1 ALA 7 3HB ALA 7 -3.762 10.874 -5.199 67 HB2 ALA 7 1HB ALA 7 -2.282 11.265 -4.325 68 HB3 ALA 7 2HB ALA 7 -2.454 9.700 -5.117 69 H GLN 8 H GLN 8 0.102 12.508 -5.928 70 HA GLN 8 HA GLN 8 1.824 10.175 -6.575 71 HB2 GLN 8 1HB GLN 8 2.175 13.011 -7.580 72 HB3 GLN 8 2HB GLN 8 3.415 11.761 -7.683 73 HG2 GLN 8 1HG GLN 8 1.926 10.355 -9.025 74 HG3 GLN 8 2HG GLN 8 0.640 11.551 -8.887 75 HE21 GLN 8 2HE2 GLN 8 2.983 10.503 -11.004 76 HE22 GLN 8 1HE2 GLN 8 3.237 11.942 -11.870 77 H VAL 9 H VAL 9 3.202 9.754 -5.005 78 HA VAL 9 HA VAL 9 4.266 11.927 -3.284 79 HB VAL 9 HB VAL 9 3.921 10.463 -1.284 80 HG11 VAL 9 1HG1 VAL 9 1.525 10.962 -1.056 81 HG12 VAL 9 2HG1 VAL 9 1.402 11.200 -2.798 82 HG13 VAL 9 3HG1 VAL 9 2.369 12.308 -1.823 83 HG21 VAL 9 3HG2 VAL 9 2.284 8.627 -1.467 84 HG22 VAL 9 1HG2 VAL 9 3.682 8.319 -2.495 85 HG23 VAL 9 2HG2 VAL 9 2.174 8.892 -3.206 86 H LYS 10 H LYS 10 6.240 11.363 -2.199 87 HA LYS 10 HA LYS 10 7.564 8.870 -2.591 88 HB2 LYS 10 1HB LYS 10 9.354 9.714 -4.130 89 HB3 LYS 10 2HB LYS 10 7.770 9.568 -4.886 90 HG2 LYS 10 1HG LYS 10 7.369 11.953 -4.654 91 HG3 LYS 10 2HG LYS 10 8.854 12.155 -3.732 92 HD2 LYS 10 1HD LYS 10 9.284 12.864 -6.003 93 HD3 LYS 10 2HD LYS 10 10.151 11.357 -5.722 94 HE2 LYS 10 1HE LYS 10 8.605 10.099 -7.024 95 HE3 LYS 10 2HE LYS 10 7.385 11.374 -6.962 96 HZ1 LYS 10 3HZ LYS 10 8.200 12.059 -8.886 97 HZ2 LYS 10 1HZ LYS 10 9.540 11.024 -8.787 98 HZ3 LYS 10 2HZ LYS 10 9.596 12.558 -8.058 99 H THR 11 H THR 11 9.431 8.714 -1.373 100 HA THR 11 HA THR 11 10.611 11.137 -0.182 101 HB THR 11 HB THR 11 8.926 10.658 1.450 102 HG1 THR 11 HG1 THR 11 10.650 11.031 2.628 103 HG21 THR 11 3HG2 THR 11 9.856 7.785 1.238 104 HG22 THR 11 1HG2 THR 11 8.280 8.424 0.766 105 HG23 THR 11 2HG2 THR 11 8.741 8.381 2.467 106 H VAL 12 H VAL 12 12.700 10.900 0.470 107 HA VAL 12 HA VAL 12 14.103 8.508 -0.506 108 HB VAL 12 HB VAL 12 14.935 10.760 -1.099 109 HG11 VAL 12 1HG1 VAL 12 15.805 12.277 0.525 110 HG12 VAL 12 2HG1 VAL 12 15.722 11.081 1.815 111 HG13 VAL 12 3HG1 VAL 12 14.239 11.778 1.162 112 HG21 VAL 12 3HG2 VAL 12 16.845 9.310 0.762 113 HG22 VAL 12 1HG2 VAL 12 17.267 10.313 -0.625 114 HG23 VAL 12 2HG2 VAL 12 16.463 8.765 -0.874 115 H ILE 13 H ILE 13 14.837 6.943 0.769 116 HA ILE 13 HA ILE 13 15.163 7.429 3.692 117 HB ILE 13 HB ILE 13 13.936 4.956 2.440 118 HG12 ILE 13 1HG1 ILE 13 12.609 7.096 4.145 119 HG13 ILE 13 2HG1 ILE 13 12.476 7.032 2.390 120 HG21 ILE 13 1HG2 ILE 13 13.449 4.415 4.843 121 HG22 ILE 13 2HG2 ILE 13 14.382 5.833 5.315 122 HG23 ILE 13 3HG2 ILE 13 15.174 4.485 4.507 123 HD11 ILE 13 3HD1 ILE 13 11.565 4.702 2.599 124 HD12 ILE 13 1HD1 ILE 13 10.536 5.935 3.325 125 HD13 ILE 13 2HD1 ILE 13 11.548 4.918 4.350 126 H ASN 14 H ASN 14 16.981 6.639 4.547 127 HA ASN 14 HA ASN 14 18.918 5.330 2.767 128 HB2 ASN 14 1HB ASN 14 19.105 6.442 5.580 129 HB3 ASN 14 2HB ASN 14 20.442 5.623 4.774 130 HD21 ASN 14 2HD2 ASN 14 20.605 8.389 5.545 131 HD22 ASN 14 1HD2 ASN 14 20.684 9.323 4.130 132 H ALA 15 H ALA 15 18.171 3.244 2.516 133 HA ALA 15 HA ALA 15 18.915 1.369 4.494 134 HB1 ALA 15 3HB ALA 15 16.091 2.293 4.504 135 HB2 ALA 15 1HB ALA 15 17.028 1.589 5.816 136 HB3 ALA 15 2HB ALA 15 16.289 0.549 4.599 137 HA PRO 16 HA PRO 16 18.894 -1.228 0.915 138 HB2 PRO 16 1HB PRO 16 18.334 -3.737 1.972 139 HB3 PRO 16 2HB PRO 16 19.904 -2.924 2.151 140 HG2 PRO 16 1HG PRO 16 17.611 -3.031 4.089 141 HG3 PRO 16 2HG PRO 16 19.348 -3.249 4.393 142 HD2 PRO 16 1HD PRO 16 18.136 -0.895 4.933 143 HD3 PRO 16 2HD PRO 16 19.791 -0.943 4.288 144 H ILE 17 H ILE 17 17.560 -2.165 -0.614 145 HA ILE 17 HA ILE 17 14.798 -1.498 -0.522 146 HB ILE 17 HB ILE 17 16.159 -1.501 -2.591 147 HG12 ILE 17 1HG1 ILE 17 13.861 -3.479 -2.769 148 HG13 ILE 17 2HG1 ILE 17 13.632 -1.739 -2.598 149 HG21 ILE 17 1HG2 ILE 17 16.803 -3.560 -3.659 150 HG22 ILE 17 2HG2 ILE 17 15.963 -4.524 -2.447 151 HG23 ILE 17 3HG2 ILE 17 17.411 -3.618 -2.007 152 HD11 ILE 17 3HD1 ILE 17 14.987 -1.404 -4.676 153 HD12 ILE 17 1HD1 ILE 17 13.500 -2.312 -4.952 154 HD13 ILE 17 2HD1 ILE 17 15.047 -3.155 -4.873 155 H GLU 18 H GLU 18 16.588 -4.429 0.150 156 HA GLU 18 HA GLU 18 14.640 -6.385 -0.154 157 HB2 GLU 18 1HB GLU 18 16.816 -6.139 1.936 158 HB3 GLU 18 2HB GLU 18 15.881 -7.608 1.653 159 HG2 GLU 18 1HG GLU 18 16.680 -7.704 -0.656 160 HG3 GLU 18 2HG GLU 18 17.565 -6.195 -0.437 161 H LYS 19 H LYS 19 15.394 -4.573 2.814 162 HA LYS 19 HA LYS 19 13.261 -5.686 4.317 163 HB2 LYS 19 1HB LYS 19 14.964 -3.225 4.763 164 HB3 LYS 19 2HB LYS 19 13.789 -3.832 5.934 165 HG2 LYS 19 1HG LYS 19 14.946 -6.014 5.978 166 HG3 LYS 19 2HG LYS 19 16.115 -5.422 4.802 167 HD2 LYS 19 1HD LYS 19 16.843 -3.687 6.401 168 HD3 LYS 19 2HD LYS 19 15.672 -4.287 7.577 169 HE2 LYS 19 1HE LYS 19 16.782 -6.493 7.561 170 HE3 LYS 19 2HE LYS 19 17.959 -5.891 6.396 171 HZ1 LYS 19 3HZ LYS 19 18.772 -5.811 8.692 172 HZ2 LYS 19 1HZ LYS 19 17.515 -4.747 9.098 173 HZ3 LYS 19 2HZ LYS 19 18.703 -4.269 7.982 174 H VAL 20 H VAL 20 13.492 -2.674 2.451 175 HA VAL 20 HA VAL 20 10.968 -1.654 3.305 176 HB VAL 20 HB VAL 20 12.521 -1.118 0.758 177 HG11 VAL 20 1HG1 VAL 20 10.119 0.266 1.993 178 HG12 VAL 20 2HG1 VAL 20 10.211 -0.479 0.397 179 HG13 VAL 20 3HG1 VAL 20 11.119 0.992 0.734 180 HG21 VAL 20 3HG2 VAL 20 12.286 0.457 3.340 181 HG22 VAL 20 1HG2 VAL 20 13.268 0.888 1.940 182 HG23 VAL 20 2HG2 VAL 20 13.671 -0.539 2.894 183 H TRP 21 H TRP 21 11.991 -3.537 0.481 184 HA TRP 21 HA TRP 21 9.508 -3.817 -0.793 185 HB2 TRP 21 1HB TRP 21 11.571 -4.432 -1.909 186 HB3 TRP 21 2HB TRP 21 11.936 -5.633 -0.678 187 HD1 TRP 21 HD1 TRP 21 10.484 -7.889 -0.681 188 HE1 TRP 21 HE1 TRP 21 9.150 -9.048 -2.560 189 HE3 TRP 21 HE3 TRP 21 10.151 -4.051 -4.027 190 HZ2 TRP 21 HZ2 TRP 21 8.087 -8.421 -5.140 191 HZ3 TRP 21 HZ3 TRP 21 8.969 -4.353 -6.182 192 HH2 TRP 21 HH2 TRP 21 7.935 -6.536 -6.743 193 H GLU 22 H GLU 22 11.069 -5.702 1.760 194 HA GLU 22 HA GLU 22 9.191 -7.782 1.979 195 HB2 GLU 22 1HB GLU 22 11.463 -7.725 3.041 196 HB3 GLU 22 2HB GLU 22 10.844 -6.553 4.200 197 HG2 GLU 22 1HG GLU 22 9.164 -8.175 4.971 198 HG3 GLU 22 2HG GLU 22 9.734 -9.343 3.782 199 H ALA 23 H ALA 23 9.379 -4.629 3.603 200 HA ALA 23 HA ALA 23 7.218 -4.919 5.356 201 HB1 ALA 23 3HB ALA 23 8.265 -2.427 4.001 202 HB2 ALA 23 1HB ALA 23 8.798 -3.086 5.548 203 HB3 ALA 23 2HB ALA 23 7.163 -2.445 5.379 204 H LEU 24 H LEU 24 7.265 -4.081 1.941 205 HA LEU 24 HA LEU 24 4.563 -3.166 1.824 206 HB2 LEU 24 1HB LEU 24 6.635 -2.894 0.155 207 HB3 LEU 24 2HB LEU 24 5.910 -4.298 -0.616 208 HG LEU 24 HG LEU 24 4.553 -1.636 -0.064 209 HD11 LEU 24 1HD1 LEU 24 5.286 -3.011 -2.664 210 HD12 LEU 24 2HD1 LEU 24 6.164 -1.663 -1.947 211 HD13 LEU 24 3HD1 LEU 24 4.510 -1.437 -2.503 212 HD21 LEU 24 3HD2 LEU 24 3.473 -4.291 -1.043 213 HD22 LEU 24 1HD2 LEU 24 2.726 -2.779 -1.572 214 HD23 LEU 24 2HD2 LEU 24 2.790 -3.173 0.140 215 H VAL 25 H VAL 25 6.075 -6.313 1.198 216 HA VAL 25 HA VAL 25 3.364 -7.552 1.088 217 HB VAL 25 HB VAL 25 4.558 -9.354 -0.314 218 HG11 VAL 25 1HG1 VAL 25 4.358 -7.992 -2.388 219 HG12 VAL 25 2HG1 VAL 25 4.261 -6.537 -1.392 220 HG13 VAL 25 3HG1 VAL 25 2.990 -7.753 -1.297 221 HG21 VAL 25 3HG2 VAL 25 6.587 -8.656 -1.471 222 HG22 VAL 25 1HG2 VAL 25 6.876 -8.550 0.262 223 HG23 VAL 25 2HG2 VAL 25 6.556 -7.089 -0.665 224 H ASN 26 H ASN 26 3.556 -7.687 3.406 225 HA ASN 26 HA ASN 26 4.613 -10.271 4.170 226 HB2 ASN 26 1HB ASN 26 6.602 -8.926 4.443 227 HB3 ASN 26 2HB ASN 26 5.728 -7.813 5.483 228 HD21 ASN 26 2HD2 ASN 26 4.456 -10.835 6.075 229 HD22 ASN 26 1HD2 ASN 26 5.403 -11.289 7.395 230 HA PRO 27 HA PRO 27 0.635 -9.349 6.275 231 HB2 PRO 27 1HB PRO 27 1.031 -12.191 7.159 232 HB3 PRO 27 2HB PRO 27 -0.386 -11.414 6.462 233 HG2 PRO 27 1HG PRO 27 1.121 -13.047 4.994 234 HG3 PRO 27 2HG PRO 27 0.397 -11.589 4.303 235 HD2 PRO 27 1HD PRO 27 3.247 -12.040 5.111 236 HD3 PRO 27 2HD PRO 27 2.583 -11.123 3.737 237 H GLU 28 H GLU 28 3.578 -10.677 7.621 238 HA GLU 28 HA GLU 28 2.826 -10.483 10.382 239 HB2 GLU 28 1HB GLU 28 5.565 -10.570 9.090 240 HB3 GLU 28 2HB GLU 28 5.252 -10.751 10.817 241 HG2 GLU 28 1HG GLU 28 3.825 -12.711 10.359 242 HG3 GLU 28 2HG GLU 28 4.132 -12.532 8.634 243 H ILE 29 H ILE 29 4.912 -8.445 8.332 244 HA ILE 29 HA ILE 29 5.230 -6.380 10.276 245 HB ILE 29 HB ILE 29 5.577 -6.355 7.272 246 HG12 ILE 29 1HG1 ILE 29 7.677 -6.395 9.470 247 HG13 ILE 29 2HG1 ILE 29 7.068 -7.867 8.716 248 HG21 ILE 29 1HG2 ILE 29 6.991 -4.290 7.778 249 HG22 ILE 29 2HG2 ILE 29 6.246 -4.283 9.375 250 HG23 ILE 29 3HG2 ILE 29 5.251 -4.073 7.935 251 HD11 ILE 29 3HD1 ILE 29 9.115 -7.186 7.585 252 HD12 ILE 29 1HD1 ILE 29 8.461 -5.573 7.304 253 HD13 ILE 29 2HD1 ILE 29 7.752 -6.968 6.490 254 H ILE 30 H ILE 30 3.038 -6.859 7.541 255 HA ILE 30 HA ILE 30 1.734 -4.369 7.637 256 HB ILE 30 HB ILE 30 0.756 -7.102 6.804 257 HG12 ILE 30 1HG1 ILE 30 2.683 -5.867 5.537 258 HG13 ILE 30 2HG1 ILE 30 1.365 -6.546 4.594 259 HG21 ILE 30 1HG2 ILE 30 -0.606 -4.412 6.584 260 HG22 ILE 30 2HG2 ILE 30 -1.257 -5.906 7.259 261 HG23 ILE 30 3HG2 ILE 30 -1.022 -5.754 5.516 262 HD11 ILE 30 3HD1 ILE 30 2.153 -4.130 4.053 263 HD12 ILE 30 1HD1 ILE 30 1.256 -3.661 5.494 264 HD13 ILE 30 2HD1 ILE 30 0.420 -4.436 4.153 265 H LYS 31 H LYS 31 1.090 -7.411 9.353 266 HA LYS 31 HA LYS 31 -1.216 -6.476 10.741 267 HB2 LYS 31 1HB LYS 31 -0.722 -8.869 10.363 268 HB3 LYS 31 2HB LYS 31 0.668 -8.734 11.439 269 HG2 LYS 31 1HG LYS 31 -0.755 -8.221 13.322 270 HG3 LYS 31 2HG LYS 31 -2.169 -8.074 12.279 271 HD2 LYS 31 1HD LYS 31 -2.213 -10.247 13.402 272 HD3 LYS 31 2HD LYS 31 -1.946 -10.485 11.676 273 HE2 LYS 31 1HE LYS 31 0.362 -10.991 11.994 274 HE3 LYS 31 2HE LYS 31 0.368 -10.321 13.627 275 HZ1 LYS 31 3HZ LYS 31 0.253 -12.851 13.315 276 HZ2 LYS 31 1HZ LYS 31 -1.381 -12.589 12.940 277 HZ3 LYS 31 2HZ LYS 31 -0.775 -12.126 14.458 278 H GLU 32 H GLU 32 2.230 -6.381 11.350 279 HA GLU 32 HA GLU 32 2.230 -5.822 14.095 280 HB2 GLU 32 1HB GLU 32 4.264 -6.289 12.692 281 HB3 GLU 32 2HB GLU 32 4.131 -4.658 12.047 282 HG2 GLU 32 1HG GLU 32 4.374 -3.709 14.286 283 HG3 GLU 32 2HG GLU 32 4.426 -5.325 14.987 284 H TYR 33 H TYR 33 1.872 -3.660 11.298 285 HA TYR 33 HA TYR 33 1.750 -1.250 12.826 286 HB2 TYR 33 1HB TYR 33 0.924 -1.973 10.001 287 HB3 TYR 33 2HB TYR 33 0.668 -0.358 10.655 288 HD1 TYR 33 HD2 TYR 33 2.752 0.735 11.826 289 HD2 TYR 33 HD1 TYR 33 3.003 -2.415 8.910 290 HE1 TYR 33 HE2 TYR 33 5.086 1.391 11.316 291 HE2 TYR 33 HE1 TYR 33 5.333 -1.747 8.402 292 HH TYR 33 HH TYR 33 6.633 1.100 9.131 293 H MET 34 H MET 34 -0.633 -3.598 11.719 294 HA MET 34 HA MET 34 -2.897 -1.973 12.560 295 HB2 MET 34 1HB MET 34 -2.749 -4.834 11.580 296 HB3 MET 34 2HB MET 34 -4.229 -3.913 11.835 297 HG2 MET 34 1HG MET 34 -2.013 -3.049 9.953 298 HG3 MET 34 2HG MET 34 -3.447 -3.936 9.440 299 HE1 MET 34 3HE MET 34 -4.993 -2.576 8.097 300 HE2 MET 34 1HE MET 34 -3.450 -1.786 7.743 301 HE3 MET 34 2HE MET 34 -4.894 -0.818 8.038 302 H PHE 35 H PHE 35 -4.283 -2.439 14.238 303 HA PHE 35 HA PHE 35 -3.137 -3.305 16.655 304 HB2 PHE 35 1HB PHE 35 -6.039 -2.936 15.867 305 HB3 PHE 35 2HB PHE 35 -5.497 -3.223 17.519 306 HD1 PHE 35 HD1 PHE 35 -4.008 -1.581 18.662 307 HD2 PHE 35 HD2 PHE 35 -5.725 -0.770 14.808 308 HE1 PHE 35 HE1 PHE 35 -3.481 0.825 18.934 309 HE2 PHE 35 HE2 PHE 35 -5.199 1.637 15.081 310 HZ PHE 35 HZ PHE 35 -4.077 2.434 17.144 311 H GLY 36 H GLY 36 -5.339 -5.025 14.432 312 HA2 GLY 36 1HA GLY 36 -4.310 -7.579 15.263 313 HA3 GLY 36 2HA GLY 36 -5.914 -7.281 15.921 314 H THR 37 H THR 37 -4.624 -6.320 12.758 315 HA THR 37 HA THR 37 -6.934 -7.521 11.425 316 HB THR 37 HB THR 37 -4.568 -6.045 10.241 317 HG1 THR 37 HG1 THR 37 -6.255 -5.068 11.812 318 HG21 THR 37 3HG2 THR 37 -5.681 -7.358 8.546 319 HG22 THR 37 1HG2 THR 37 -6.220 -5.689 8.360 320 HG23 THR 37 2HG2 THR 37 -7.268 -6.872 9.140 321 H THR 38 H THR 38 -6.963 -9.474 10.529 322 HA THR 38 HA THR 38 -4.480 -11.051 10.390 323 HB THR 38 HB THR 38 -7.349 -11.889 9.900 324 HG1 THR 38 HG1 THR 38 -5.661 -12.019 12.167 325 HG21 THR 38 3HG2 THR 38 -4.760 -13.427 10.247 326 HG22 THR 38 1HG2 THR 38 -5.817 -13.423 8.835 327 HG23 THR 38 2HG2 THR 38 -6.356 -14.170 10.337 328 H VAL 39 H VAL 39 -3.348 -10.671 8.584 329 HA VAL 39 HA VAL 39 -4.740 -10.512 5.964 330 HB VAL 39 HB VAL 39 -1.945 -9.666 6.791 331 HG11 VAL 39 1HG1 VAL 39 -1.852 -10.317 4.481 332 HG12 VAL 39 2HG1 VAL 39 -2.003 -8.562 4.477 333 HG13 VAL 39 3HG1 VAL 39 -3.409 -9.569 4.135 334 HG21 VAL 39 3HG2 VAL 39 -4.496 -8.132 6.225 335 HG22 VAL 39 1HG2 VAL 39 -2.908 -7.368 6.256 336 HG23 VAL 39 2HG2 VAL 39 -3.548 -8.135 7.707 337 H VAL 40 H VAL 40 -4.424 -11.998 4.456 338 HA VAL 40 HA VAL 40 -2.331 -14.069 4.848 339 HB VAL 40 HB VAL 40 -3.977 -15.713 3.984 340 HG11 VAL 40 1HG1 VAL 40 -3.545 -15.487 6.398 341 HG12 VAL 40 2HG1 VAL 40 -5.224 -15.932 6.094 342 HG13 VAL 40 3HG1 VAL 40 -4.814 -14.266 6.506 343 HG21 VAL 40 3HG2 VAL 40 -6.407 -15.078 4.142 344 HG22 VAL 40 1HG2 VAL 40 -5.547 -14.260 2.842 345 HG23 VAL 40 2HG2 VAL 40 -5.903 -13.401 4.340 346 H SER 41 H SER 41 -1.119 -14.429 3.127 347 HA SER 41 HA SER 41 -2.109 -14.030 0.408 348 HB2 SER 41 1HB SER 41 -1.455 -11.767 0.861 349 HB3 SER 41 2HB SER 41 0.064 -12.293 1.586 350 HG SER 41 HG SER 41 -0.714 -12.154 -1.093 351 H ASP 42 H ASP 42 -0.755 -14.861 -1.187 352 HA ASP 42 HA ASP 42 1.085 -16.978 -0.276 353 HB2 ASP 42 1HB ASP 42 -0.174 -16.344 -2.960 354 HB3 ASP 42 2HB ASP 42 0.970 -17.659 -2.701 355 H TRP 43 H TRP 43 1.060 -13.850 -1.621 356 HA TRP 43 HA TRP 43 2.711 -12.378 -2.219 357 HB2 TRP 43 1HB TRP 43 4.788 -14.423 -1.402 358 HB3 TRP 43 2HB TRP 43 4.909 -12.669 -1.381 359 HD1 TRP 43 HD1 TRP 43 2.332 -11.865 0.151 360 HE1 TRP 43 HE1 TRP 43 2.043 -12.469 2.642 361 HE3 TRP 43 HE3 TRP 43 5.646 -15.728 0.511 362 HZ2 TRP 43 HZ2 TRP 43 3.090 -14.349 4.541 363 HZ3 TRP 43 HZ3 TRP 43 5.984 -16.904 2.664 364 HH2 TRP 43 HH2 TRP 43 4.712 -16.219 4.679 365 H LYS 44 H LYS 44 1.644 -13.847 -4.291 366 HA LYS 44 HA LYS 44 3.892 -13.889 -6.167 367 HB2 LYS 44 1HB LYS 44 3.359 -16.082 -7.076 368 HB3 LYS 44 2HB LYS 44 3.776 -16.218 -5.372 369 HG2 LYS 44 1HG LYS 44 1.407 -16.342 -4.773 370 HG3 LYS 44 2HG LYS 44 0.941 -16.141 -6.463 371 HD2 LYS 44 1HD LYS 44 2.172 -18.207 -7.030 372 HD3 LYS 44 2HD LYS 44 2.558 -18.431 -5.324 373 HE2 LYS 44 1HE LYS 44 0.163 -18.549 -4.785 374 HE3 LYS 44 2HE LYS 44 -0.238 -18.292 -6.484 375 HZ1 LYS 44 3HZ LYS 44 1.527 -20.510 -5.667 376 HZ2 LYS 44 1HZ LYS 44 0.608 -20.350 -7.083 377 HZ3 LYS 44 2HZ LYS 44 -0.162 -20.680 -5.604 378 H GLU 45 H GLU 45 3.241 -13.847 -8.386 379 HA GLU 45 HA GLU 45 1.242 -12.041 -8.988 380 HB2 GLU 45 1HB GLU 45 3.183 -12.790 -10.452 381 HB3 GLU 45 2HB GLU 45 2.202 -14.174 -10.911 382 HG2 GLU 45 1HG GLU 45 1.242 -11.311 -11.219 383 HG3 GLU 45 2HG GLU 45 2.102 -12.165 -12.491 384 H GLY 46 H GLY 46 -0.868 -12.096 -9.237 385 HA2 GLY 46 1HA GLY 46 -2.997 -12.872 -9.767 386 HA3 GLY 46 2HA GLY 46 -2.318 -14.461 -10.094 387 H SER 47 H SER 47 -1.166 -13.527 -7.125 388 HA SER 47 HA SER 47 -2.750 -15.428 -5.724 389 HB2 SER 47 1HB SER 47 -0.523 -15.002 -4.957 390 HB3 SER 47 2HB SER 47 -0.849 -13.283 -4.769 391 HG SER 47 HG SER 47 -2.690 -14.457 -3.385 392 H GLN 48 H GLN 48 -4.556 -15.231 -4.582 393 HA GLN 48 HA GLN 48 -6.033 -12.728 -4.645 394 HB2 GLN 48 1HB GLN 48 -7.151 -14.949 -4.911 395 HB3 GLN 48 2HB GLN 48 -6.733 -15.322 -3.239 396 HG2 GLN 48 1HG GLN 48 -8.030 -13.401 -2.448 397 HG3 GLN 48 2HG GLN 48 -8.379 -12.926 -4.109 398 HE21 GLN 48 2HE2 GLN 48 -10.449 -13.556 -2.196 399 HE22 GLN 48 1HE2 GLN 48 -11.242 -14.957 -2.735 400 H ILE 49 H ILE 49 -6.522 -11.438 -2.877 401 HA ILE 49 HA ILE 49 -5.277 -12.092 -0.269 402 HB ILE 49 HB ILE 49 -3.685 -10.659 -1.511 403 HG12 ILE 49 1HG1 ILE 49 -5.051 -9.133 0.732 404 HG13 ILE 49 2HG1 ILE 49 -4.005 -10.524 1.005 405 HG21 ILE 49 1HG2 ILE 49 -4.267 -8.399 -2.129 406 HG22 ILE 49 2HG2 ILE 49 -5.871 -8.559 -1.419 407 HG23 ILE 49 3HG2 ILE 49 -5.450 -9.479 -2.864 408 HD11 ILE 49 3HD1 ILE 49 -2.177 -9.322 -0.220 409 HD12 ILE 49 1HD1 ILE 49 -2.683 -8.507 1.258 410 HD13 ILE 49 2HD1 ILE 49 -3.225 -7.908 -0.310 411 H VAL 50 H VAL 50 -6.410 -11.532 1.455 412 HA VAL 50 HA VAL 50 -8.656 -9.631 1.201 413 HB VAL 50 HB VAL 50 -10.134 -11.208 2.441 414 HG11 VAL 50 1HG1 VAL 50 -9.067 -12.310 -0.175 415 HG12 VAL 50 2HG1 VAL 50 -10.212 -10.975 -0.042 416 HG13 VAL 50 3HG1 VAL 50 -10.671 -12.590 0.499 417 HG21 VAL 50 3HG2 VAL 50 -7.898 -13.168 1.830 418 HG22 VAL 50 1HG2 VAL 50 -9.482 -13.604 2.471 419 HG23 VAL 50 2HG2 VAL 50 -8.382 -12.621 3.436 420 H TRP 51 H TRP 51 -9.325 -8.697 3.132 421 HA TRP 51 HA TRP 51 -7.514 -9.080 5.472 422 HB2 TRP 51 1HB TRP 51 -8.750 -6.452 4.601 423 HB3 TRP 51 2HB TRP 51 -7.571 -6.715 5.878 424 HD1 TRP 51 HD1 TRP 51 -5.598 -8.629 4.198 425 HE1 TRP 51 HE1 TRP 51 -4.123 -7.584 2.376 426 HE3 TRP 51 HE3 TRP 51 -8.209 -4.336 3.327 427 HZ2 TRP 51 HZ2 TRP 51 -4.046 -5.228 0.767 428 HZ3 TRP 51 HZ3 TRP 51 -7.412 -2.705 1.641 429 HH2 TRP 51 HH2 TRP 51 -5.337 -3.145 0.356 430 H LYS 52 H LYS 52 -8.504 -9.447 7.348 431 HA LYS 52 HA LYS 52 -11.453 -9.330 7.448 432 HB2 LYS 52 1HB LYS 52 -9.522 -10.458 9.492 433 HB3 LYS 52 2HB LYS 52 -11.266 -10.703 9.424 434 HG2 LYS 52 1HG LYS 52 -9.312 -11.620 7.292 435 HG3 LYS 52 2HG LYS 52 -9.986 -12.657 8.547 436 HD2 LYS 52 1HD LYS 52 -12.296 -12.045 7.668 437 HD3 LYS 52 2HD LYS 52 -11.491 -11.267 6.306 438 HE2 LYS 52 1HE LYS 52 -10.418 -13.359 5.680 439 HE3 LYS 52 2HE LYS 52 -11.141 -14.169 7.071 440 HZ1 LYS 52 3HZ LYS 52 -13.102 -14.335 6.047 441 HZ2 LYS 52 1HZ LYS 52 -12.246 -14.031 4.614 442 HZ3 LYS 52 2HZ LYS 52 -13.031 -12.758 5.419 443 H GLY 53 H GLY 53 -12.565 -7.985 8.705 444 HA2 GLY 53 1HA GLY 53 -11.344 -6.486 10.860 445 HA3 GLY 53 2HA GLY 53 -11.707 -5.511 9.439 446 H GLU 54 H GLU 54 -12.920 -4.857 11.731 447 HA GLU 54 HA GLU 54 -15.729 -5.776 11.411 448 HB2 GLU 54 1HB GLU 54 -14.798 -6.564 13.520 449 HB3 GLU 54 2HB GLU 54 -14.304 -4.924 13.942 450 HG2 GLU 54 1HG GLU 54 -17.206 -5.523 13.284 451 HG3 GLU 54 2HG GLU 54 -16.579 -5.847 14.897 452 H TRP 55 H TRP 55 -17.020 -4.276 10.694 453 HA TRP 55 HA TRP 55 -16.376 -1.412 11.148 454 HB2 TRP 55 1HB TRP 55 -16.123 -1.892 8.812 455 HB3 TRP 55 2HB TRP 55 -17.633 -2.795 8.770 456 HD1 TRP 55 HD1 TRP 55 -19.463 -1.480 7.682 457 HE1 TRP 55 HE1 TRP 55 -20.221 0.973 7.559 458 HE3 TRP 55 HE3 TRP 55 -15.760 0.728 10.437 459 HZ2 TRP 55 HZ2 TRP 55 -19.391 3.522 8.507 460 HZ3 TRP 55 HZ3 TRP 55 -15.776 3.173 10.804 461 HH2 TRP 55 HH2 TRP 55 -17.575 4.578 9.837 462 H LYS 56 H LYS 56 -17.654 -0.549 12.577 463 HA LYS 56 HA LYS 56 -19.480 -0.291 14.012 464 HB2 LYS 56 1HB LYS 56 -21.521 0.420 12.815 465 HB3 LYS 56 2HB LYS 56 -20.080 1.150 12.123 466 HG2 LYS 56 1HG LYS 56 -20.087 -0.543 10.360 467 HG3 LYS 56 2HG LYS 56 -21.529 -1.273 10.996 468 HD2 LYS 56 1HD LYS 56 -21.207 1.518 9.863 469 HD3 LYS 56 2HD LYS 56 -22.027 0.161 9.099 470 HE2 LYS 56 1HE LYS 56 -22.911 1.788 11.478 471 HE3 LYS 56 2HE LYS 56 -23.812 1.381 10.021 472 HZ1 LYS 56 3HZ LYS 56 -24.632 0.037 11.775 473 HZ2 LYS 56 1HZ LYS 56 -23.071 -0.437 12.243 474 HZ3 LYS 56 2HZ LYS 56 -23.714 -0.978 10.767 475 H GLY 57 H GLY 57 -18.847 -2.926 14.056 476 HA2 GLY 57 1HA GLY 57 -19.778 -4.877 14.933 477 HA3 GLY 57 2HA GLY 57 -21.385 -4.197 14.683 478 H LYS 58 H LYS 58 -20.382 -3.603 11.822 479 HA LYS 58 HA LYS 58 -21.286 -6.142 10.663 480 HB2 LYS 58 1HB LYS 58 -22.223 -3.925 9.937 481 HB3 LYS 58 2HB LYS 58 -20.645 -3.522 9.272 482 HG2 LYS 58 1HG LYS 58 -20.764 -5.584 7.851 483 HG3 LYS 58 2HG LYS 58 -22.395 -5.858 8.449 484 HD2 LYS 58 1HD LYS 58 -21.520 -3.324 7.030 485 HD3 LYS 58 2HD LYS 58 -22.279 -4.684 6.213 486 HE2 LYS 58 1HE LYS 58 -24.205 -4.408 7.928 487 HE3 LYS 58 2HE LYS 58 -23.489 -2.833 8.279 488 HZ1 LYS 58 3HZ LYS 58 -24.291 -2.002 6.407 489 HZ2 LYS 58 1HZ LYS 58 -25.215 -3.415 6.240 490 HZ3 LYS 58 2HZ LYS 58 -23.701 -3.296 5.478 491 H ALA 59 H ALA 59 -19.794 -7.618 10.216 492 HA ALA 59 HA ALA 59 -16.999 -7.031 9.920 493 HB1 ALA 59 3HB ALA 59 -17.909 -9.191 10.820 494 HB2 ALA 59 1HB ALA 59 -16.718 -9.389 9.535 495 HB3 ALA 59 2HB ALA 59 -18.436 -9.587 9.182 496 H TYR 60 H TYR 60 -15.806 -6.745 8.103 497 HA TYR 60 HA TYR 60 -17.068 -7.191 5.451 498 HB2 TYR 60 1HB TYR 60 -16.463 -5.020 4.659 499 HB3 TYR 60 2HB TYR 60 -17.319 -4.777 6.179 500 HD1 TYR 60 HD2 TYR 60 -15.859 -4.629 8.350 501 HD2 TYR 60 HD1 TYR 60 -14.295 -4.078 4.381 502 HE1 TYR 60 HE2 TYR 60 -13.893 -3.446 9.281 503 HE2 TYR 60 HE1 TYR 60 -12.338 -2.900 5.314 504 HH TYR 60 HH TYR 60 -11.100 -2.849 7.518 505 H GLU 61 H GLU 61 -15.580 -7.375 3.709 506 HA GLU 61 HA GLU 61 -12.733 -7.715 4.425 507 HB2 GLU 61 1HB GLU 61 -12.755 -9.853 3.016 508 HB3 GLU 61 2HB GLU 61 -13.487 -9.965 4.613 509 HG2 GLU 61 1HG GLU 61 -15.117 -9.381 2.121 510 HG3 GLU 61 2HG GLU 61 -14.817 -11.017 2.688 511 H ASP 62 H ASP 62 -11.407 -6.914 2.977 512 HA ASP 62 HA ASP 62 -12.462 -5.710 0.521 513 HB2 ASP 62 1HB ASP 62 -9.732 -5.638 1.839 514 HB3 ASP 62 2HB ASP 62 -10.135 -4.793 0.345 515 H LYS 63 H LYS 63 -12.049 -6.472 -1.520 516 HA LYS 63 HA LYS 63 -10.390 -8.955 -1.740 517 HB2 LYS 63 1HB LYS 63 -12.859 -9.293 -1.964 518 HB3 LYS 63 2HB LYS 63 -12.827 -8.248 -3.383 519 HG2 LYS 63 1HG LYS 63 -11.271 -9.766 -4.509 520 HG3 LYS 63 2HG LYS 63 -11.185 -10.780 -3.067 521 HD2 LYS 63 1HD LYS 63 -13.601 -11.242 -3.246 522 HD3 LYS 63 2HD LYS 63 -13.681 -10.246 -4.700 523 HE2 LYS 63 1HE LYS 63 -12.071 -11.745 -5.818 524 HE3 LYS 63 2HE LYS 63 -11.992 -12.740 -4.365 525 HZ1 LYS 63 3HZ LYS 63 -13.699 -13.150 -6.387 526 HZ2 LYS 63 1HZ LYS 63 -14.661 -12.223 -5.342 527 HZ3 LYS 63 2HZ LYS 63 -13.965 -13.673 -4.792 528 H GLY 64 H GLY 64 -8.749 -8.906 -3.052 529 HA2 GLY 64 1HA GLY 64 -8.766 -7.404 -5.547 530 HA3 GLY 64 2HA GLY 64 -7.598 -6.850 -4.348 531 H THR 65 H THR 65 -6.403 -7.641 -6.513 532 HA THR 65 HA THR 65 -5.150 -10.204 -5.786 533 HB THR 65 HB THR 65 -6.251 -9.693 -8.563 534 HG1 THR 65 HG1 THR 65 -7.050 -11.787 -6.904 535 HG21 THR 65 3HG2 THR 65 -5.625 -12.155 -8.805 536 HG22 THR 65 1HG2 THR 65 -4.702 -11.981 -7.313 537 HG23 THR 65 2HG2 THR 65 -4.270 -11.031 -8.736 538 H ILE 66 H ILE 66 -3.131 -10.568 -6.824 539 HA ILE 66 HA ILE 66 -1.580 -8.159 -7.112 540 HB ILE 66 HB ILE 66 -0.742 -10.992 -7.771 541 HG12 ILE 66 1HG1 ILE 66 -1.637 -11.009 -5.515 542 HG13 ILE 66 2HG1 ILE 66 0.117 -11.064 -5.420 543 HG21 ILE 66 1HG2 ILE 66 0.809 -8.516 -6.969 544 HG22 ILE 66 2HG2 ILE 66 0.819 -9.292 -8.551 545 HG23 ILE 66 3HG2 ILE 66 1.507 -10.123 -7.157 546 HD11 ILE 66 3HD1 ILE 66 -0.035 -8.466 -5.181 547 HD12 ILE 66 1HD1 ILE 66 -0.469 -9.466 -3.797 548 HD13 ILE 66 2HD1 ILE 66 -1.733 -8.765 -4.803 549 H LEU 67 H LEU 67 -1.570 -6.963 -8.888 550 HA LEU 67 HA LEU 67 -2.460 -7.896 -11.441 551 HB2 LEU 67 1HB LEU 67 -2.769 -5.568 -10.878 552 HB3 LEU 67 2HB LEU 67 -1.048 -5.348 -10.608 553 HG LEU 67 HG LEU 67 -0.590 -5.712 -12.996 554 HD11 LEU 67 1HD1 LEU 67 -2.682 -5.805 -14.537 555 HD12 LEU 67 2HD1 LEU 67 -3.557 -6.330 -13.097 556 HD13 LEU 67 3HD1 LEU 67 -2.211 -7.287 -13.714 557 HD21 LEU 67 3HD2 LEU 67 -1.245 -3.444 -12.151 558 HD22 LEU 67 1HD2 LEU 67 -2.902 -3.791 -12.652 559 HD23 LEU 67 2HD2 LEU 67 -1.619 -3.699 -13.855 560 H GLN 68 H GLN 68 0.718 -7.169 -10.065 561 HA GLN 68 HA GLN 68 1.993 -9.046 -11.880 562 HB2 GLN 68 1HB GLN 68 1.877 -6.872 -13.169 563 HB3 GLN 68 2HB GLN 68 2.867 -6.139 -11.909 564 HG2 GLN 68 1HG GLN 68 4.334 -6.825 -13.708 565 HG3 GLN 68 2HG GLN 68 4.612 -7.905 -12.347 566 HE21 GLN 68 2HE2 GLN 68 5.152 -9.848 -13.437 567 HE22 GLN 68 1HE2 GLN 68 4.128 -10.613 -14.555 568 H PHE 69 H PHE 69 4.012 -9.713 -11.127 569 HA PHE 69 HA PHE 69 4.916 -8.570 -8.528 570 HB2 PHE 69 1HB PHE 69 3.605 -10.660 -8.174 571 HB3 PHE 69 2HB PHE 69 4.760 -11.517 -9.195 572 HD1 PHE 69 HD1 PHE 69 7.091 -11.845 -8.478 573 HD2 PHE 69 HD2 PHE 69 4.235 -9.885 -5.935 574 HE1 PHE 69 HE1 PHE 69 8.627 -12.105 -6.553 575 HE2 PHE 69 HE2 PHE 69 5.773 -10.147 -4.008 576 HZ PHE 69 HZ PHE 69 7.970 -11.256 -4.318 577 H ASN 70 H ASN 70 6.827 -7.702 -8.946 578 HA ASN 70 HA ASN 70 8.862 -9.324 -10.397 579 HB2 ASN 70 1HB ASN 70 7.961 -7.240 -11.634 580 HB3 ASN 70 2HB ASN 70 8.811 -6.296 -10.416 581 HD21 ASN 70 2HD2 ASN 70 10.770 -8.855 -10.497 582 HD22 ASN 70 1HD2 ASN 70 11.799 -8.445 -11.785 583 H GLU 71 H GLU 71 9.779 -10.149 -8.603 584 HA GLU 71 HA GLU 71 10.260 -9.169 -6.132 585 HB2 GLU 71 1HB GLU 71 12.321 -10.576 -6.089 586 HB3 GLU 71 2HB GLU 71 10.917 -11.409 -6.749 587 HG2 GLU 71 1HG GLU 71 11.719 -10.830 -9.056 588 HG3 GLU 71 2HG GLU 71 13.174 -10.152 -8.336 589 H ARG 72 H ARG 72 11.398 -7.646 -5.174 590 HA ARG 72 HA ARG 72 12.533 -5.653 -4.969 591 HB2 ARG 72 1HB ARG 72 14.617 -7.462 -6.206 592 HB3 ARG 72 2HB ARG 72 14.972 -5.943 -5.387 593 HG2 ARG 72 1HG ARG 72 13.913 -6.816 -3.323 594 HG3 ARG 72 2HG ARG 72 13.584 -8.338 -4.149 595 HD2 ARG 72 1HD ARG 72 16.352 -7.166 -3.779 596 HD3 ARG 72 2HD ARG 72 15.656 -8.412 -2.746 597 HE ARG 72 HE ARG 72 16.740 -8.786 -5.386 598 HH11 ARG 72 1HH2 ARG 72 14.415 -9.878 -3.071 599 HH12 ARG 72 2HH2 ARG 72 14.297 -11.476 -3.736 600 HH21 ARG 72 1HH1 ARG 72 16.594 -10.878 -6.260 601 HH22 ARG 72 2HH1 ARG 72 15.527 -12.040 -5.539 602 H SER 73 H SER 73 10.968 -5.128 -7.061 603 HA SER 73 HA SER 73 12.608 -3.365 -8.665 604 HB2 SER 73 1HB SER 73 11.131 -5.538 -10.160 605 HB3 SER 73 2HB SER 73 12.230 -4.333 -10.821 606 HG SER 73 HG SER 73 13.174 -6.439 -10.475 607 H ILE 74 H ILE 74 9.491 -4.986 -9.297 608 HA ILE 74 HA ILE 74 8.079 -2.410 -8.867 609 HB ILE 74 HB ILE 74 7.776 -4.083 -11.386 610 HG12 ILE 74 1HG1 ILE 74 9.015 -1.335 -10.957 611 HG13 ILE 74 2HG1 ILE 74 9.901 -2.806 -11.338 612 HG21 ILE 74 1HG2 ILE 74 6.544 -1.429 -10.550 613 HG22 ILE 74 2HG2 ILE 74 5.679 -2.960 -10.640 614 HG23 ILE 74 3HG2 ILE 74 6.298 -2.221 -12.105 615 HD11 ILE 74 3HD1 ILE 74 9.641 -1.627 -13.396 616 HD12 ILE 74 1HD1 ILE 74 7.922 -1.365 -13.102 617 HD13 ILE 74 2HD1 ILE 74 8.522 -2.989 -13.447 618 H LEU 75 H LEU 75 6.195 -2.603 -7.906 619 HA LEU 75 HA LEU 75 4.779 -5.206 -7.915 620 HB2 LEU 75 1HB LEU 75 6.204 -4.857 -5.806 621 HB3 LEU 75 2HB LEU 75 5.109 -3.536 -5.415 622 HG LEU 75 HG LEU 75 3.219 -5.405 -5.872 623 HD11 LEU 75 1HD1 LEU 75 4.831 -7.151 -6.565 624 HD12 LEU 75 2HD1 LEU 75 3.971 -7.633 -5.105 625 HD13 LEU 75 3HD1 LEU 75 5.627 -7.038 -4.997 626 HD21 LEU 75 3HD2 LEU 75 3.533 -4.242 -3.732 627 HD22 LEU 75 1HD2 LEU 75 4.890 -5.300 -3.342 628 HD23 LEU 75 2HD2 LEU 75 3.256 -5.962 -3.463 629 H GLN 76 H GLN 76 2.715 -4.972 -8.442 630 HA GLN 76 HA GLN 76 1.241 -2.524 -7.701 631 HB2 GLN 76 1HB GLN 76 0.247 -2.536 -10.074 632 HB3 GLN 76 2HB GLN 76 1.892 -1.929 -9.915 633 HG2 GLN 76 1HG GLN 76 2.826 -4.011 -10.682 634 HG3 GLN 76 2HG GLN 76 1.253 -4.795 -10.647 635 HE21 GLN 76 2HE2 GLN 76 0.967 -1.569 -11.729 636 HE22 GLN 76 1HE2 GLN 76 0.937 -1.883 -13.397 637 H TYR 77 H TYR 77 -0.966 -2.821 -7.441 638 HA TYR 77 HA TYR 77 -2.144 -5.426 -8.081 639 HB2 TYR 77 1HB TYR 77 -2.921 -5.768 -5.740 640 HB3 TYR 77 2HB TYR 77 -1.177 -5.917 -5.930 641 HD1 TYR 77 HD1 TYR 77 -3.896 -3.578 -4.867 642 HD2 TYR 77 HD2 TYR 77 0.315 -4.461 -4.742 643 HE1 TYR 77 HE1 TYR 77 -3.565 -1.810 -3.161 644 HE2 TYR 77 HE2 TYR 77 0.632 -2.693 -3.039 645 HH TYR 77 HH TYR 77 -2.120 -0.987 -1.626 646 H SER 78 H SER 78 -4.376 -5.538 -7.888 647 HA SER 78 HA SER 78 -5.746 -2.935 -8.167 648 HB2 SER 78 1HB SER 78 -7.548 -4.202 -9.161 649 HB3 SER 78 2HB SER 78 -6.043 -4.720 -9.916 650 HG SER 78 HG SER 78 -6.261 -6.625 -9.027 651 H HIS 79 H HIS 79 -7.678 -2.517 -6.922 652 HA HIS 79 HA HIS 79 -8.301 -4.341 -4.732 653 HB2 HIS 79 1HB HIS 79 -6.530 -2.030 -4.367 654 HB3 HIS 79 2HB HIS 79 -7.953 -1.884 -3.340 655 HD1 HIS 79 HD1 HIS 79 -4.689 -3.247 -3.230 656 HD2 HIS 79 HD2 HIS 79 -8.411 -4.679 -2.032 657 HE1 HIS 79 HE1 HIS 79 -4.239 -5.136 -1.609 658 HE2 HIS 79 HE2 HIS 79 -6.500 -6.020 -0.862 659 H PHE 80 H PHE 80 -10.190 -3.932 -3.650 660 HA PHE 80 HA PHE 80 -11.927 -1.761 -4.635 661 HB2 PHE 80 1HB PHE 80 -12.499 -3.533 -6.141 662 HB3 PHE 80 2HB PHE 80 -12.512 -4.728 -4.849 663 HD1 PHE 80 HD1 PHE 80 -14.251 -1.707 -6.164 664 HD2 PHE 80 HD2 PHE 80 -14.477 -5.070 -3.504 665 HE1 PHE 80 HE1 PHE 80 -16.646 -1.222 -5.756 666 HE2 PHE 80 HE2 PHE 80 -16.870 -4.589 -3.101 667 HZ PHE 80 HZ PHE 80 -17.957 -2.665 -4.221 668 H SER 81 H SER 81 -13.177 -0.940 -3.098 669 HA SER 81 HA SER 81 -13.147 -2.181 -0.416 670 HB2 SER 81 1HB SER 81 -13.809 0.650 -1.224 671 HB3 SER 81 2HB SER 81 -13.709 0.033 0.424 672 HG SER 81 HG SER 81 -11.525 -0.414 0.066 673 HA PRO 82 HA PRO 82 -17.516 -2.912 -1.504 674 HB2 PRO 82 1HB PRO 82 -18.204 -4.545 0.600 675 HB3 PRO 82 2HB PRO 82 -17.277 -5.121 -0.801 676 HG2 PRO 82 1HG PRO 82 -16.301 -4.357 1.923 677 HG3 PRO 82 2HG PRO 82 -15.776 -5.681 0.869 678 HD2 PRO 82 1HD PRO 82 -14.404 -3.298 1.132 679 HD3 PRO 82 2HD PRO 82 -14.299 -4.329 -0.311 680 H LEU 83 H LEU 83 -16.229 -1.493 1.360 681 HA LEU 83 HA LEU 83 -18.580 -0.830 2.757 682 HB2 LEU 83 1HB LEU 83 -16.034 0.795 2.570 683 HB3 LEU 83 2HB LEU 83 -17.238 0.868 3.855 684 HG LEU 83 HG LEU 83 -15.609 -1.597 3.144 685 HD11 LEU 83 1HD1 LEU 83 -15.351 0.422 5.395 686 HD12 LEU 83 2HD1 LEU 83 -14.187 0.134 4.100 687 HD13 LEU 83 3HD1 LEU 83 -14.477 -1.107 5.321 688 HD21 LEU 83 3HD2 LEU 83 -17.727 -1.007 5.238 689 HD22 LEU 83 1HD2 LEU 83 -16.499 -2.237 5.528 690 HD23 LEU 83 2HD2 LEU 83 -17.588 -2.398 4.161 691 H THR 84 H THR 84 -17.449 0.218 -0.255 692 HA THR 84 HA THR 84 -18.434 2.872 -0.306 693 HB THR 84 HB THR 84 -18.384 2.579 -2.792 694 HG1 THR 84 HG1 THR 84 -18.948 0.282 -2.581 695 HG21 THR 84 3HG2 THR 84 -15.927 2.067 -2.899 696 HG22 THR 84 1HG2 THR 84 -16.003 1.612 -1.197 697 HG23 THR 84 2HG2 THR 84 -16.356 3.269 -1.682 698 H GLY 85 H GLY 85 -19.949 -0.248 -0.897 699 HA2 GLY 85 1HA GLY 85 -22.137 -0.853 -1.320 700 HA3 GLY 85 2HA GLY 85 -22.548 0.525 -0.302 701 H LYS 86 H LYS 86 -20.758 0.881 -3.293 702 HA LYS 86 HA LYS 86 -22.882 2.585 -4.341 703 HB2 LYS 86 1HB LYS 86 -20.021 2.062 -5.119 704 HB3 LYS 86 2HB LYS 86 -21.091 2.988 -6.171 705 HG2 LYS 86 1HG LYS 86 -21.532 4.573 -4.329 706 HG3 LYS 86 2HG LYS 86 -20.472 3.645 -3.271 707 HD2 LYS 86 1HD LYS 86 -18.570 4.080 -4.775 708 HD3 LYS 86 2HD LYS 86 -19.629 4.982 -5.859 709 HE2 LYS 86 1HE LYS 86 -19.071 5.694 -2.964 710 HE3 LYS 86 2HE LYS 86 -18.374 6.505 -4.367 711 HZ1 LYS 86 3HZ LYS 86 -21.052 6.674 -3.267 712 HZ2 LYS 86 1HZ LYS 86 -20.968 6.602 -4.959 713 HZ3 LYS 86 2HZ LYS 86 -20.150 7.835 -4.122 714 HA PRO 87 HA PRO 87 -24.607 -0.304 -7.265 715 HB2 PRO 87 1HB PRO 87 -24.099 1.752 -9.413 716 HB3 PRO 87 2HB PRO 87 -25.606 0.896 -9.016 717 HG2 PRO 87 1HG PRO 87 -25.253 3.450 -8.316 718 HG3 PRO 87 2HG PRO 87 -26.094 2.310 -7.248 719 HD2 PRO 87 1HD PRO 87 -23.314 3.422 -6.987 720 HD3 PRO 87 2HD PRO 87 -24.495 2.985 -5.734 721 H ASP 88 H ASP 88 -23.902 -1.849 -8.773 722 HA ASP 88 HA ASP 88 -21.283 -2.573 -8.955 723 HB2 ASP 88 1HB ASP 88 -23.506 -3.022 -10.959 724 HB3 ASP 88 2HB ASP 88 -21.957 -3.859 -11.019 725 H LEU 89 H LEU 89 -19.731 -1.128 -9.470 726 HA LEU 89 HA LEU 89 -19.482 -0.327 -12.274 727 HB2 LEU 89 1HB LEU 89 -20.728 1.526 -11.023 728 HB3 LEU 89 2HB LEU 89 -19.231 1.791 -10.131 729 HG LEU 89 HG LEU 89 -18.149 1.894 -12.580 730 HD11 LEU 89 1HD1 LEU 89 -20.305 1.286 -13.723 731 HD12 LEU 89 2HD1 LEU 89 -19.643 2.824 -14.262 732 HD13 LEU 89 3HD1 LEU 89 -20.996 2.793 -13.131 733 HD21 LEU 89 3HD2 LEU 89 -18.135 3.775 -11.021 734 HD22 LEU 89 1HD2 LEU 89 -19.821 4.133 -11.396 735 HD23 LEU 89 2HD2 LEU 89 -18.577 4.351 -12.628 736 HA PRO 90 HA PRO 90 -15.520 -1.906 -10.442 737 HB2 PRO 90 1HB PRO 90 -14.896 -1.858 -13.395 738 HB3 PRO 90 2HB PRO 90 -14.534 -3.118 -12.192 739 HG2 PRO 90 1HG PRO 90 -16.537 -3.440 -13.914 740 HG3 PRO 90 2HG PRO 90 -16.709 -3.952 -12.221 741 HD2 PRO 90 1HD PRO 90 -17.862 -1.524 -13.578 742 HD3 PRO 90 2HD PRO 90 -18.570 -2.542 -12.304 743 H GLU 91 H GLU 91 -16.029 0.641 -12.832 744 HA GLU 91 HA GLU 91 -13.471 1.834 -12.739 745 HB2 GLU 91 1HB GLU 91 -16.192 3.025 -13.337 746 HB3 GLU 91 2HB GLU 91 -14.667 3.871 -13.588 747 HG2 GLU 91 1HG GLU 91 -13.924 2.162 -15.158 748 HG3 GLU 91 2HG GLU 91 -15.369 1.204 -14.848 749 H ASN 92 H ASN 92 -15.650 1.449 -10.289 750 HA ASN 92 HA ASN 92 -15.576 3.964 -8.976 751 HB2 ASN 92 1HB ASN 92 -17.288 2.280 -8.504 752 HB3 ASN 92 2HB ASN 92 -16.058 1.194 -7.864 753 HD21 ASN 92 2HD2 ASN 92 -16.749 1.177 -5.662 754 HD22 ASN 92 1HD2 ASN 92 -16.757 2.566 -4.685 755 H TYR 93 H TYR 93 -13.486 1.127 -8.832 756 HA TYR 93 HA TYR 93 -11.839 2.405 -6.726 757 HB2 TYR 93 1HB TYR 93 -10.901 0.266 -6.298 758 HB3 TYR 93 2HB TYR 93 -12.641 0.052 -6.423 759 HD1 TYR 93 HD2 TYR 93 -13.643 -1.081 -8.382 760 HD2 TYR 93 HD1 TYR 93 -9.388 -0.635 -7.995 761 HE1 TYR 93 HE2 TYR 93 -13.303 -2.789 -10.145 762 HE2 TYR 93 HE1 TYR 93 -9.050 -2.346 -9.756 763 HH TYR 93 HH TYR 93 -11.020 -4.495 -10.626 764 H HIS 94 H HIS 94 -9.420 1.717 -6.971 765 HA HIS 94 HA HIS 94 -8.475 2.221 -9.742 766 HB2 HIS 94 1HB HIS 94 -6.678 3.734 -8.550 767 HB3 HIS 94 2HB HIS 94 -8.262 4.397 -8.894 768 HD1 HIS 94 HD1 HIS 94 -8.580 5.956 -6.955 769 HD2 HIS 94 HD2 HIS 94 -7.438 2.142 -5.716 770 HE1 HIS 94 HE1 HIS 94 -8.769 5.937 -4.432 771 HE2 HIS 94 HE2 HIS 94 -8.059 3.623 -3.660 772 H VAL 95 H VAL 95 -6.212 1.796 -10.042 773 HA VAL 95 HA VAL 95 -5.318 -0.564 -8.488 774 HB VAL 95 HB VAL 95 -5.615 -0.847 -10.931 775 HG11 VAL 95 1HG1 VAL 95 -4.295 0.352 -12.525 776 HG12 VAL 95 2HG1 VAL 95 -3.306 1.088 -11.270 777 HG13 VAL 95 3HG1 VAL 95 -4.990 1.575 -11.464 778 HG21 VAL 95 3HG2 VAL 95 -3.874 -2.113 -9.648 779 HG22 VAL 95 1HG2 VAL 95 -2.691 -0.889 -10.109 780 HG23 VAL 95 2HG2 VAL 95 -3.456 -1.887 -11.344 781 H VAL 96 H VAL 96 -3.601 -0.446 -7.239 782 HA VAL 96 HA VAL 96 -2.054 2.063 -7.105 783 HB VAL 96 HB VAL 96 -1.943 -0.318 -5.232 784 HG11 VAL 96 1HG1 VAL 96 -1.166 2.600 -4.931 785 HG12 VAL 96 2HG1 VAL 96 -0.042 1.252 -5.096 786 HG13 VAL 96 3HG1 VAL 96 -1.059 1.382 -3.661 787 HG21 VAL 96 3HG2 VAL 96 -4.235 0.507 -5.289 788 HG22 VAL 96 1HG2 VAL 96 -3.675 2.174 -5.167 789 HG23 VAL 96 2HG2 VAL 96 -3.473 1.075 -3.803 790 H THR 97 H THR 97 -0.005 2.241 -7.693 791 HA THR 97 HA THR 97 1.563 -0.209 -8.333 792 HB THR 97 HB THR 97 0.852 0.679 -10.455 793 HG1 THR 97 HG1 THR 97 2.864 0.136 -10.793 794 HG21 THR 97 3HG2 THR 97 1.119 2.956 -11.135 795 HG22 THR 97 1HG2 THR 97 2.085 3.339 -9.714 796 HG23 THR 97 2HG2 THR 97 0.359 3.018 -9.545 797 H ILE 98 H ILE 98 3.335 -0.331 -7.213 798 HA ILE 98 HA ILE 98 4.601 2.147 -6.158 799 HB ILE 98 HB ILE 98 4.800 -0.653 -4.999 800 HG12 ILE 98 1HG1 ILE 98 3.322 0.727 -3.144 801 HG13 ILE 98 2HG1 ILE 98 2.740 1.522 -4.602 802 HG21 ILE 98 1HG2 ILE 98 6.664 0.831 -4.454 803 HG22 ILE 98 2HG2 ILE 98 5.655 0.613 -3.029 804 HG23 ILE 98 3HG2 ILE 98 5.547 2.101 -3.964 805 HD11 ILE 98 3HD1 ILE 98 2.131 -0.692 -5.551 806 HD12 ILE 98 1HD1 ILE 98 1.318 -0.400 -4.014 807 HD13 ILE 98 2HD1 ILE 98 2.716 -1.471 -4.083 808 H THR 99 H THR 99 6.641 2.546 -6.708 809 HA THR 99 HA THR 99 8.175 0.473 -8.211 810 HB THR 99 HB THR 99 8.432 3.488 -8.346 811 HG1 THR 99 HG1 THR 99 6.594 2.064 -9.343 812 HG21 THR 99 3HG2 THR 99 9.782 1.218 -9.832 813 HG22 THR 99 1HG2 THR 99 10.554 2.454 -8.838 814 HG23 THR 99 2HG2 THR 99 9.819 2.894 -10.379 815 H LEU 100 H LEU 100 9.906 -0.315 -7.240 816 HA LEU 100 HA LEU 100 11.281 1.283 -5.135 817 HB2 LEU 100 1HB LEU 100 10.713 -1.690 -5.167 818 HB3 LEU 100 2HB LEU 100 11.723 -0.868 -3.983 819 HG LEU 100 HG LEU 100 8.835 -0.105 -4.490 820 HD11 LEU 100 1HD1 LEU 100 8.618 -2.301 -3.672 821 HD12 LEU 100 2HD1 LEU 100 8.498 -1.323 -2.214 822 HD13 LEU 100 3HD1 LEU 100 10.008 -2.144 -2.596 823 HD21 LEU 100 3HD2 LEU 100 9.170 0.786 -2.055 824 HD22 LEU 100 1HD2 LEU 100 9.899 1.698 -3.365 825 HD23 LEU 100 2HD2 LEU 100 10.892 0.626 -2.383 826 H THR 101 H THR 101 13.221 1.806 -5.744 827 HA THR 101 HA THR 101 14.885 -0.176 -7.210 828 HB THR 101 HB THR 101 14.909 2.796 -7.809 829 HG1 THR 101 HG1 THR 101 12.973 1.280 -8.361 830 HG21 THR 101 3HG2 THR 101 16.168 2.081 -9.785 831 HG22 THR 101 1HG2 THR 101 15.972 0.389 -9.320 832 HG23 THR 101 2HG2 THR 101 16.958 1.469 -8.332 833 H ALA 102 H ALA 102 16.881 -0.418 -6.445 834 HA ALA 102 HA ALA 102 17.645 1.054 -4.040 835 HB1 ALA 102 3HB ALA 102 17.929 -1.411 -4.217 836 HB2 ALA 102 1HB ALA 102 19.435 -0.562 -3.873 837 HB3 ALA 102 2HB ALA 102 19.111 -1.152 -5.502 838 H LEU 103 H LEU 103 18.952 2.751 -4.028 839 HA LEU 103 HA LEU 103 20.564 3.392 -6.450 840 HB2 LEU 103 1HB LEU 103 19.640 5.283 -4.276 841 HB3 LEU 103 2HB LEU 103 20.365 5.700 -5.827 842 HG LEU 103 HG LEU 103 17.682 4.335 -5.437 843 HD11 LEU 103 1HD1 LEU 103 17.556 6.668 -4.827 844 HD12 LEU 103 2HD1 LEU 103 16.833 6.488 -6.426 845 HD13 LEU 103 3HD1 LEU 103 18.462 7.143 -6.263 846 HD21 LEU 103 3HD2 LEU 103 17.533 4.932 -7.978 847 HD22 LEU 103 1HD2 LEU 103 18.483 3.525 -7.514 848 HD23 LEU 103 2HD2 LEU 103 19.292 5.043 -7.907 849 H LYS 104 H LYS 104 22.488 4.794 -5.881 850 HA LYS 104 HA LYS 104 24.300 3.264 -4.361 851 HB2 LYS 104 1HB LYS 104 24.914 4.655 -6.307 852 HB3 LYS 104 2HB LYS 104 24.604 6.100 -5.346 853 HG2 LYS 104 1HG LYS 104 26.370 5.525 -3.783 854 HG3 LYS 104 2HG LYS 104 26.584 3.948 -4.535 855 HD2 LYS 104 1HD LYS 104 28.360 5.294 -5.392 856 HD3 LYS 104 2HD LYS 104 27.182 5.199 -6.695 857 HE2 LYS 104 1HE LYS 104 28.090 7.503 -6.324 858 HE3 LYS 104 2HE LYS 104 26.341 7.421 -6.167 859 HZ1 LYS 104 3HZ LYS 104 28.143 7.168 -3.831 860 HZ2 LYS 104 1HZ LYS 104 26.484 7.528 -3.844 861 HZ3 LYS 104 2HZ LYS 104 27.606 8.678 -4.391 862 H LYS 105 H LYS 105 22.620 6.275 -3.603 863 HA LYS 105 HA LYS 105 23.951 6.577 -1.025 864 HB2 LYS 105 1HB LYS 105 22.580 8.566 -0.771 865 HB3 LYS 105 2HB LYS 105 23.310 8.555 -2.375 866 HG2 LYS 105 1HG LYS 105 21.149 7.501 -3.229 867 HG3 LYS 105 2HG LYS 105 20.451 7.844 -1.649 868 HD2 LYS 105 1HD LYS 105 21.692 9.953 -3.443 869 HD3 LYS 105 2HD LYS 105 19.968 9.605 -3.381 870 HE2 LYS 105 1HE LYS 105 20.104 10.068 -0.862 871 HE3 LYS 105 2HE LYS 105 21.713 10.721 -1.171 872 HZ1 LYS 105 3HZ LYS 105 20.610 12.146 -2.907 873 HZ2 LYS 105 1HZ LYS 105 20.260 12.532 -1.292 874 HZ3 LYS 105 2HZ LYS 105 19.124 11.682 -2.228 875 H GLY 106 H GLY 106 20.833 5.460 -2.243 876 HA2 GLY 106 1HA GLY 106 20.315 3.894 0.064 877 HA3 GLY 106 2HA GLY 106 19.375 5.382 0.136 878 H VAL 107 H VAL 107 17.387 4.410 -0.128 879 HA VAL 107 HA VAL 107 16.841 3.236 -2.813 880 HB VAL 107 HB VAL 107 16.769 1.493 -1.085 881 HG11 VAL 107 1HG1 VAL 107 15.311 1.600 0.810 882 HG12 VAL 107 2HG1 VAL 107 14.508 3.047 0.212 883 HG13 VAL 107 3HG1 VAL 107 16.172 3.138 0.790 884 HG21 VAL 107 3HG2 VAL 107 15.134 1.515 -3.007 885 HG22 VAL 107 1HG2 VAL 107 13.954 2.255 -1.929 886 HG23 VAL 107 2HG2 VAL 107 14.565 0.637 -1.591 887 H GLU 108 H GLU 108 15.377 4.255 -3.957 888 HA GLU 108 HA GLU 108 13.754 6.387 -2.717 889 HB2 GLU 108 1HB GLU 108 15.121 6.841 -4.792 890 HB3 GLU 108 2HB GLU 108 14.068 5.726 -5.659 891 HG2 GLU 108 1HG GLU 108 13.198 7.939 -6.036 892 HG3 GLU 108 2HG GLU 108 12.100 7.157 -4.909 893 H VAL 109 H VAL 109 11.562 6.392 -2.743 894 HA VAL 109 HA VAL 109 10.154 4.017 -3.851 895 HB VAL 109 HB VAL 109 8.890 3.728 -1.864 896 HG11 VAL 109 1HG1 VAL 109 11.273 2.918 -1.808 897 HG12 VAL 109 2HG1 VAL 109 10.587 3.230 -0.215 898 HG13 VAL 109 3HG1 VAL 109 11.700 4.389 -0.936 899 HG21 VAL 109 3HG2 VAL 109 8.373 5.999 -1.222 900 HG22 VAL 109 1HG2 VAL 109 10.078 6.385 -0.986 901 HG23 VAL 109 2HG2 VAL 109 9.254 5.296 0.132 902 H GLU 110 H GLU 110 8.068 4.343 -4.557 903 HA GLU 110 HA GLU 110 6.884 7.023 -4.445 904 HB2 GLU 110 1HB GLU 110 8.430 7.077 -6.400 905 HB3 GLU 110 2HB GLU 110 7.557 5.709 -7.090 906 HG2 GLU 110 1HG GLU 110 5.489 7.019 -7.161 907 HG3 GLU 110 2HG GLU 110 6.295 8.372 -6.373 908 H LEU 111 H LEU 111 4.752 6.918 -4.368 909 HA LEU 111 HA LEU 111 3.355 4.431 -5.218 910 HB2 LEU 111 1HB LEU 111 3.533 4.589 -2.757 911 HB3 LEU 111 2HB LEU 111 2.733 6.155 -2.801 912 HG LEU 111 HG LEU 111 1.234 3.983 -4.233 913 HD11 LEU 111 1HD1 LEU 111 1.582 3.896 -1.222 914 HD12 LEU 111 2HD1 LEU 111 2.070 2.650 -2.371 915 HD13 LEU 111 3HD1 LEU 111 0.357 2.997 -2.124 916 HD21 LEU 111 3HD2 LEU 111 -0.674 5.013 -3.128 917 HD22 LEU 111 1HD2 LEU 111 0.352 6.294 -3.776 918 HD23 LEU 111 2HD2 LEU 111 0.389 5.922 -2.054 919 H THR 112 H THR 112 1.696 4.717 -6.555 920 HA THR 112 HA THR 112 0.620 7.470 -6.956 921 HB THR 112 HB THR 112 0.965 5.357 -9.098 922 HG1 THR 112 HG1 THR 112 2.962 6.004 -8.988 923 HG21 THR 112 3HG2 THR 112 -0.836 6.931 -9.559 924 HG22 THR 112 1HG2 THR 112 0.543 7.318 -10.588 925 HG23 THR 112 2HG2 THR 112 0.213 8.290 -9.156 926 H GLN 113 H GLN 113 -1.509 7.713 -7.236 927 HA GLN 113 HA GLN 113 -3.279 5.353 -7.329 928 HB2 GLN 113 1HB GLN 113 -3.091 5.748 -4.969 929 HB3 GLN 113 2HB GLN 113 -3.324 7.479 -5.170 930 HG2 GLN 113 1HG GLN 113 -5.512 5.687 -6.219 931 HG3 GLN 113 2HG GLN 113 -5.366 5.822 -4.472 932 HE21 GLN 113 2HE2 GLN 113 -7.313 7.048 -4.235 933 HE22 GLN 113 1HE2 GLN 113 -7.452 8.645 -4.767 934 H ASP 114 H ASP 114 -5.067 5.663 -8.513 935 HA ASP 114 HA ASP 114 -5.545 8.372 -9.642 936 HB2 ASP 114 1HB ASP 114 -6.085 5.673 -10.864 937 HB3 ASP 114 2HB ASP 114 -6.346 7.237 -11.631 938 H ASN 115 H ASN 115 -7.876 7.887 -10.902 939 HA ASN 115 HA ASN 115 -10.115 8.055 -10.678 940 HB2 ASN 115 1HB ASN 115 -9.833 5.621 -10.162 941 HB3 ASN 115 2HB ASN 115 -9.873 6.041 -8.448 942 HD21 ASN 115 2HD2 ASN 115 -11.925 4.845 -8.201 943 HD22 ASN 115 1HD2 ASN 115 -13.377 5.503 -8.784 944 H ASN 116 H ASN 116 -8.591 9.978 -9.129 945 HA ASN 116 HA ASN 116 -10.078 10.300 -6.619 946 HB2 ASN 116 1HB ASN 116 -8.048 12.037 -8.034 947 HB3 ASN 116 2HB ASN 116 -8.822 12.487 -6.522 948 HD21 ASN 116 2HD2 ASN 116 -5.925 11.509 -7.412 949 HD22 ASN 116 1HD2 ASN 116 -5.553 10.383 -6.196 950 H GLU 117 H GLU 117 -11.914 11.550 -6.424 951 HA GLU 117 HA GLU 117 -13.342 12.265 -8.758 952 HB2 GLU 117 1HB GLU 117 -13.796 13.044 -5.869 953 HB3 GLU 117 2HB GLU 117 -14.942 13.346 -7.171 954 HG2 GLU 117 1HG GLU 117 -13.888 10.596 -6.452 955 HG3 GLU 117 2HG GLU 117 -15.420 11.241 -5.876 956 H THR 118 H THR 118 -11.618 14.328 -6.418 957 HA THR 118 HA THR 118 -11.312 16.369 -8.521 958 HB THR 118 HB THR 118 -12.128 18.172 -7.114 959 HG1 THR 118 HG1 THR 118 -13.241 16.434 -5.269 960 HG21 THR 118 3HG2 THR 118 -13.738 16.850 -8.565 961 HG22 THR 118 1HG2 THR 118 -14.482 17.720 -7.224 962 HG23 THR 118 2HG2 THR 118 -14.217 15.981 -7.104 963 H GLU 119 H GLU 119 -10.056 18.315 -7.433 964 HA GLU 119 HA GLU 119 -7.508 17.351 -6.707 965 HB2 GLU 119 1HB GLU 119 -8.824 20.063 -6.678 966 HB3 GLU 119 2HB GLU 119 -7.237 19.879 -5.935 967 HG2 GLU 119 1HG GLU 119 -7.846 18.985 -8.771 968 HG3 GLU 119 2HG GLU 119 -7.224 20.589 -8.384 969 H LYS 120 H LYS 120 -10.247 18.486 -4.828 970 HA LYS 120 HA LYS 120 -9.009 18.628 -2.300 971 HB2 LYS 120 1HB LYS 120 -11.871 18.031 -3.097 972 HB3 LYS 120 2HB LYS 120 -11.367 18.298 -1.433 973 HG2 LYS 120 1HG LYS 120 -10.631 20.359 -3.527 974 HG3 LYS 120 2HG LYS 120 -12.278 20.339 -2.910 975 HD2 LYS 120 1HD LYS 120 -9.984 20.312 -0.928 976 HD3 LYS 120 2HD LYS 120 -10.427 21.829 -1.701 977 HE2 LYS 120 1HE LYS 120 -12.733 21.603 -0.893 978 HE3 LYS 120 2HE LYS 120 -12.349 20.047 -0.162 979 HZ1 LYS 120 3HZ LYS 120 -11.741 22.718 0.751 980 HZ2 LYS 120 1HZ LYS 120 -10.444 21.631 0.862 981 HZ3 LYS 120 2HZ LYS 120 -11.915 21.278 1.637 982 H GLU 121 H GLU 121 -10.653 15.956 -3.967 983 HA GLU 121 HA GLU 121 -10.286 14.086 -1.837 984 HB2 GLU 121 1HB GLU 121 -11.998 14.018 -3.799 985 HB3 GLU 121 2HB GLU 121 -10.691 13.306 -4.737 986 HG2 GLU 121 1HG GLU 121 -11.719 12.218 -2.090 987 HG3 GLU 121 2HG GLU 121 -12.158 11.588 -3.674 988 H GLN 122 H GLN 122 -8.512 14.800 -4.829 989 HA GLN 122 HA GLN 122 -6.627 12.700 -4.633 990 HB2 GLN 122 1HB GLN 122 -6.925 13.951 -6.700 991 HB3 GLN 122 2HB GLN 122 -6.379 15.429 -5.923 992 HG2 GLN 122 1HG GLN 122 -4.594 12.981 -5.956 993 HG3 GLN 122 2HG GLN 122 -4.654 14.046 -7.352 994 HE21 GLN 122 2HE2 GLN 122 -2.605 13.501 -4.994 995 HE22 GLN 122 1HE2 GLN 122 -2.134 15.074 -4.564 996 H LYS 123 H LYS 123 -6.616 16.050 -3.503 997 HA LYS 123 HA LYS 123 -4.054 16.036 -2.329 998 HB2 LYS 123 1HB LYS 123 -5.502 18.075 -2.818 999 HB3 LYS 123 2HB LYS 123 -6.461 17.637 -1.412 1000 HG2 LYS 123 1HG LYS 123 -4.932 19.197 -0.508 1001 HG3 LYS 123 2HG LYS 123 -4.173 17.658 -0.116 1002 HD2 LYS 123 1HD LYS 123 -2.655 17.864 -2.017 1003 HD3 LYS 123 2HD LYS 123 -3.495 19.310 -2.576 1004 HE2 LYS 123 1HE LYS 123 -2.132 19.079 0.118 1005 HE3 LYS 123 2HE LYS 123 -1.377 19.782 -1.312 1006 HZ1 LYS 123 3HZ LYS 123 -3.509 20.833 0.367 1007 HZ2 LYS 123 1HZ LYS 123 -3.667 21.109 -1.300 1008 HZ3 LYS 123 2HZ LYS 123 -2.284 21.652 -0.476 1009 H HIS 124 H HIS 124 -7.268 15.285 -1.087 1010 HA HIS 124 HA HIS 124 -6.632 14.807 1.605 1011 HB2 HIS 124 1HB HIS 124 -8.938 15.017 0.683 1012 HB3 HIS 124 2HB HIS 124 -8.738 13.453 -0.103 1013 HD1 HIS 124 HD1 HIS 124 -8.633 14.946 3.402 1014 HD2 HIS 124 HD2 HIS 124 -9.406 11.311 1.513 1015 HE1 HIS 124 HE1 HIS 124 -9.457 13.365 5.201 1016 HE2 HIS 124 HE2 HIS 124 -9.932 11.143 4.065 1017 H SER 125 H SER 125 -6.553 12.743 -1.253 1018 HA SER 125 HA SER 125 -5.865 10.333 0.116 1019 HB2 SER 125 1HB SER 125 -6.823 10.127 -2.071 1020 HB3 SER 125 2HB SER 125 -5.620 11.206 -2.768 1021 HG SER 125 HG SER 125 -4.241 9.608 -2.842 1022 H GLU 126 H GLU 126 -4.023 12.813 -1.611 1023 HA GLU 126 HA GLU 126 -1.462 11.704 -1.450 1024 HB2 GLU 126 1HB GLU 126 -2.122 13.754 -2.743 1025 HB3 GLU 126 2HB GLU 126 -2.183 14.643 -1.225 1026 HG2 GLU 126 1HG GLU 126 0.201 14.098 -0.825 1027 HG3 GLU 126 2HG GLU 126 0.245 13.233 -2.357 1028 H ASP 127 H ASP 127 -3.152 13.866 0.825 1029 HA ASP 127 HA ASP 127 -1.096 14.029 2.746 1030 HB2 ASP 127 1HB ASP 127 -3.032 15.554 2.707 1031 HB3 ASP 127 2HB ASP 127 -4.093 14.216 3.144 1032 H ASN 128 H ASN 128 -3.759 11.747 2.295 1033 HA ASN 128 HA ASN 128 -3.414 10.306 4.708 1034 HB2 ASN 128 1HB ASN 128 -5.443 10.106 3.346 1035 HB3 ASN 128 2HB ASN 128 -4.511 9.383 2.040 1036 HD21 ASN 128 2HD2 ASN 128 -5.081 7.202 2.010 1037 HD22 ASN 128 1HD2 ASN 128 -5.122 6.198 3.379 1038 H TRP 129 H TRP 129 -2.285 9.595 1.398 1039 HA TRP 129 HA TRP 129 -0.761 7.333 2.117 1040 HB2 TRP 129 1HB TRP 129 -0.525 9.246 -0.226 1041 HB3 TRP 129 2HB TRP 129 0.490 7.810 -0.056 1042 HD1 TRP 129 HD1 TRP 129 -2.723 8.846 -1.480 1043 HE1 TRP 129 HE1 TRP 129 -4.226 6.810 -1.970 1044 HE3 TRP 129 HE3 TRP 129 -0.182 5.244 1.091 1045 HZ2 TRP 129 HZ2 TRP 129 -4.332 4.014 -1.348 1046 HZ3 TRP 129 HZ3 TRP 129 -0.999 2.908 1.127 1047 HH2 TRP 129 HH2 TRP 129 -3.071 2.288 -0.088 1048 H ASN 130 H ASN 130 0.059 10.780 2.011 1049 HA ASN 130 HA ASN 130 2.824 10.522 2.496 1050 HB2 ASN 130 1HB ASN 130 0.835 12.690 3.223 1051 HB3 ASN 130 2HB ASN 130 2.552 12.836 3.588 1052 HD21 ASN 130 2HD2 ASN 130 1.220 14.622 1.772 1053 HD22 ASN 130 1HD2 ASN 130 1.856 14.358 0.221 1054 H THR 131 H THR 131 0.029 10.573 4.653 1055 HA THR 131 HA THR 131 1.454 10.539 7.093 1056 HB THR 131 HB THR 131 -1.256 9.269 6.599 1057 HG1 THR 131 HG1 THR 131 -2.093 11.219 6.568 1058 HG21 THR 131 3HG2 THR 131 -1.643 9.846 8.936 1059 HG22 THR 131 1HG2 THR 131 -0.066 10.630 9.029 1060 HG23 THR 131 2HG2 THR 131 -0.170 8.884 8.808 1061 H MET 132 H MET 132 0.227 7.988 4.971 1062 HA MET 132 HA MET 132 0.980 5.781 6.588 1063 HB2 MET 132 1HB MET 132 0.662 6.004 3.579 1064 HB3 MET 132 2HB MET 132 0.889 4.483 4.443 1065 HG2 MET 132 1HG MET 132 -1.159 4.904 5.748 1066 HG3 MET 132 2HG MET 132 -1.384 6.438 4.910 1067 HE1 MET 132 3HE MET 132 -2.217 2.803 5.041 1068 HE2 MET 132 1HE MET 132 -0.644 2.656 4.247 1069 HE3 MET 132 2HE MET 132 -2.113 2.194 3.392 1070 H LEU 133 H LEU 133 2.627 7.350 3.847 1071 HA LEU 133 HA LEU 133 5.004 5.820 3.999 1072 HB2 LEU 133 1HB LEU 133 4.207 8.410 2.721 1073 HB3 LEU 133 2HB LEU 133 5.930 8.138 2.905 1074 HG LEU 133 HG LEU 133 5.045 7.388 0.698 1075 HD11 LEU 133 1HD1 LEU 133 6.959 6.154 2.175 1076 HD12 LEU 133 2HD1 LEU 133 6.484 5.606 0.574 1077 HD13 LEU 133 3HD1 LEU 133 5.832 4.806 2.001 1078 HD21 LEU 133 3HD2 LEU 133 3.547 5.523 0.499 1079 HD22 LEU 133 1HD2 LEU 133 2.800 6.650 1.620 1080 HD23 LEU 133 2HD2 LEU 133 3.600 5.207 2.229 1081 H GLU 134 H GLU 134 3.991 8.796 5.594 1082 HA GLU 134 HA GLU 134 6.469 9.379 6.845 1083 HB2 GLU 134 1HB GLU 134 4.591 11.005 6.632 1084 HB3 GLU 134 2HB GLU 134 3.668 10.046 7.784 1085 HG2 GLU 134 1HG GLU 134 5.353 10.447 9.515 1086 HG3 GLU 134 2HG GLU 134 6.349 11.337 8.365 1087 H GLY 135 H GLY 135 3.747 7.319 7.643 1088 HA2 GLY 135 1HA GLY 135 4.698 6.662 10.299 1089 HA3 GLY 135 2HA GLY 135 3.338 5.930 9.451 1090 H LEU 136 H LEU 136 4.872 5.331 7.057 1091 HA LEU 136 HA LEU 136 5.845 2.750 7.773 1092 HB2 LEU 136 1HB LEU 136 4.865 3.674 5.489 1093 HB3 LEU 136 2HB LEU 136 6.541 4.061 5.137 1094 HG LEU 136 HG LEU 136 5.424 1.326 5.825 1095 HD11 LEU 136 1HD1 LEU 136 4.910 2.099 3.543 1096 HD12 LEU 136 2HD1 LEU 136 6.078 0.778 3.508 1097 HD13 LEU 136 3HD1 LEU 136 6.619 2.438 3.270 1098 HD21 LEU 136 3HD2 LEU 136 7.616 1.325 6.731 1099 HD22 LEU 136 1HD2 LEU 136 8.266 2.296 5.410 1100 HD23 LEU 136 2HD2 LEU 136 7.820 0.608 5.139 1101 H LYS 137 H LYS 137 7.504 5.641 6.510 1102 HA LYS 137 HA LYS 137 10.120 4.622 6.761 1103 HB2 LYS 137 1HB LYS 137 10.887 6.889 6.434 1104 HB3 LYS 137 2HB LYS 137 9.506 6.599 5.386 1105 HG2 LYS 137 1HG LYS 137 8.663 8.561 6.267 1106 HG3 LYS 137 2HG LYS 137 8.246 7.577 7.660 1107 HD2 LYS 137 1HD LYS 137 10.450 8.154 8.688 1108 HD3 LYS 137 2HD LYS 137 10.789 9.194 7.306 1109 HE2 LYS 137 1HE LYS 137 8.383 9.492 9.121 1110 HE3 LYS 137 2HE LYS 137 9.857 10.452 9.254 1111 HZ1 LYS 137 3HZ LYS 137 8.071 10.312 6.884 1112 HZ2 LYS 137 1HZ LYS 137 9.512 11.204 6.972 1113 HZ3 LYS 137 2HZ LYS 137 8.197 11.617 7.965 1114 H LYS 138 H LYS 138 7.953 6.039 9.089 1115 HA LYS 138 HA LYS 138 9.726 6.882 11.058 1116 HB2 LYS 138 1HB LYS 138 7.259 7.227 11.105 1117 HB3 LYS 138 2HB LYS 138 7.063 5.530 11.532 1118 HG2 LYS 138 1HG LYS 138 8.371 5.854 13.571 1119 HG3 LYS 138 2HG LYS 138 8.683 7.533 13.127 1120 HD2 LYS 138 1HD LYS 138 6.272 8.015 13.218 1121 HD3 LYS 138 2HD LYS 138 5.947 6.335 13.645 1122 HE2 LYS 138 1HE LYS 138 5.970 7.678 15.677 1123 HE3 LYS 138 2HE LYS 138 7.377 6.615 15.672 1124 HZ1 LYS 138 3HZ LYS 138 7.345 9.383 15.867 1125 HZ2 LYS 138 1HZ LYS 138 8.002 9.021 14.345 1126 HZ3 LYS 138 2HZ LYS 138 8.702 8.368 15.749 1127 H PHE 139 H PHE 139 8.689 3.640 10.185 1128 HA PHE 139 HA PHE 139 9.823 2.387 12.539 1129 HB2 PHE 139 1HB PHE 139 7.855 1.504 11.185 1130 HB3 PHE 139 2HB PHE 139 9.020 1.017 9.956 1131 HD1 PHE 139 HD1 PHE 139 10.705 -0.737 10.439 1132 HD2 PHE 139 HD2 PHE 139 7.752 0.385 13.353 1133 HE1 PHE 139 HE1 PHE 139 11.224 -2.774 11.751 1134 HE2 PHE 139 HE2 PHE 139 8.272 -1.655 14.662 1135 HZ PHE 139 HZ PHE 139 10.007 -3.235 13.862 1136 H LEU 140 H LEU 140 10.735 2.776 9.138 1137 HA LEU 140 HA LEU 140 13.070 1.179 9.227 1138 HB2 LEU 140 1HB LEU 140 12.078 3.373 7.412 1139 HB3 LEU 140 2HB LEU 140 13.708 2.753 7.192 1140 HG LEU 140 HG LEU 140 11.991 1.616 5.753 1141 HD11 LEU 140 1HD1 LEU 140 13.060 -0.414 5.861 1142 HD12 LEU 140 2HD1 LEU 140 12.888 -0.562 7.608 1143 HD13 LEU 140 3HD1 LEU 140 14.153 0.461 6.927 1144 HD21 LEU 140 3HD2 LEU 140 10.189 1.766 7.563 1145 HD22 LEU 140 1HD2 LEU 140 10.969 0.381 8.325 1146 HD23 LEU 140 2HD2 LEU 140 10.288 0.231 6.706 1147 H GLU 141 H GLU 141 12.569 4.631 9.821 1148 HA GLU 141 HA GLU 141 15.371 5.174 10.259 1149 HB2 GLU 141 1HB GLU 141 14.672 7.402 10.855 1150 HB3 GLU 141 2HB GLU 141 13.706 6.891 9.473 1151 HG2 GLU 141 1HG GLU 141 11.923 6.167 11.127 1152 HG3 GLU 141 2HG GLU 141 12.856 6.972 12.380 1153 H ASN 142 H ASN 142 13.188 3.463 12.007 1154 HA ASN 142 HA ASN 142 13.533 4.381 14.656 1155 HB2 ASN 142 1HB ASN 142 11.806 2.725 13.823 1156 HB3 ASN 142 2HB ASN 142 13.079 1.509 13.821 1157 HD21 ASN 142 2HD2 ASN 142 12.254 0.234 15.558 1158 HD22 ASN 142 1HD2 ASN 142 12.139 0.817 17.148 1159 H LYS 143 H LYS 143 15.349 2.042 12.713 1160 HA LYS 143 HA LYS 143 17.065 1.072 14.708 1161 HB2 LYS 143 1HB LYS 143 16.811 0.063 12.470 1162 HB3 LYS 143 2HB LYS 143 17.605 1.463 11.759 1163 HG2 LYS 143 1HG LYS 143 19.649 0.949 13.136 1164 HG3 LYS 143 2HG LYS 143 18.825 -0.477 13.749 1165 HD2 LYS 143 1HD LYS 143 20.127 -1.326 11.967 1166 HD3 LYS 143 2HD LYS 143 18.532 -1.144 11.251 1167 HE2 LYS 143 1HE LYS 143 19.183 0.891 10.133 1168 HE3 LYS 143 2HE LYS 143 20.697 0.968 11.034 1169 HZ1 LYS 143 3HZ LYS 143 21.309 0.060 9.019 1170 HZ2 LYS 143 1HZ LYS 143 19.913 -0.894 8.893 1171 HZ3 LYS 143 2HZ LYS 143 21.129 -1.313 10.002 1172 H VAL 144 H VAL 144 17.706 3.609 12.278 1173 HA VAL 144 HA VAL 144 20.177 4.401 13.408 1174 HB VAL 144 HB VAL 144 18.285 5.813 11.525 1175 HG11 VAL 144 1HG1 VAL 144 20.380 7.153 10.939 1176 HG12 VAL 144 2HG1 VAL 144 21.118 6.483 12.395 1177 HG13 VAL 144 3HG1 VAL 144 19.694 7.515 12.521 1178 HG21 VAL 144 3HG2 VAL 144 20.829 4.236 11.068 1179 HG22 VAL 144 1HG2 VAL 144 19.915 5.079 9.818 1180 HG23 VAL 144 2HG2 VAL 144 19.192 3.711 10.666 1181 H SER 145 H SER 145 16.876 5.678 13.710 1182 HA SER 145 HA SER 145 17.472 7.931 15.279 1183 HB2 SER 145 1HB SER 145 14.977 6.215 15.240 1184 HB3 SER 145 2HB SER 145 15.098 7.803 15.992 1185 HG SER 145 HG SER 145 14.296 7.653 13.725 1186 H ALA 146 H ALA 146 16.775 4.583 16.152 1187 HA ALA 146 HA ALA 146 16.798 4.991 18.979 1188 HB1 ALA 146 3HB ALA 146 17.243 2.462 17.370 1189 HB2 ALA 146 1HB ALA 146 15.681 3.060 17.931 1190 HB3 ALA 146 2HB ALA 146 16.894 2.536 19.098 Start of MODEL 9 1 H1 MET 1 1H MET 1 -11.362 13.111 -21.749 2 H2 MET 1 2H MET 1 -12.137 14.622 -21.678 3 H3 MET 1 3H MET 1 -12.839 13.266 -20.932 4 HA MET 1 HA MET 1 -10.701 15.003 -20.009 5 HB2 MET 1 1HB MET 1 -12.808 13.248 -18.712 6 HB3 MET 1 2HB MET 1 -11.676 14.255 -17.810 7 HG2 MET 1 1HG MET 1 -12.532 16.263 -18.929 8 HG3 MET 1 2HG MET 1 -13.625 15.276 -19.898 9 HE1 MET 1 3HE MET 1 -13.958 16.464 -15.495 10 HE2 MET 1 1HE MET 1 -13.163 17.342 -16.808 11 HE3 MET 1 2HE MET 1 -12.468 15.842 -16.198 12 H GLU 2 H GLU 2 -10.529 12.133 -21.400 13 HA GLU 2 HA GLU 2 -9.198 10.267 -21.239 14 HB2 GLU 2 1HB GLU 2 -7.513 12.269 -19.714 15 HB3 GLU 2 2HB GLU 2 -6.939 10.690 -20.251 16 HG2 GLU 2 1HG GLU 2 -6.269 12.290 -21.920 17 HG3 GLU 2 2HG GLU 2 -7.588 11.350 -22.610 18 H ILE 3 H ILE 3 -8.079 11.431 -18.118 19 HA ILE 3 HA ILE 3 -9.771 9.481 -16.694 20 HB ILE 3 HB ILE 3 -7.795 8.646 -15.447 21 HG12 ILE 3 1HG1 ILE 3 -6.180 10.031 -17.615 22 HG13 ILE 3 2HG1 ILE 3 -6.323 10.636 -15.967 23 HG21 ILE 3 1HG2 ILE 3 -7.024 7.146 -17.201 24 HG22 ILE 3 2HG2 ILE 3 -7.587 8.261 -18.446 25 HG23 ILE 3 3HG2 ILE 3 -8.750 7.438 -17.408 26 HD11 ILE 3 3HD1 ILE 3 -4.276 9.334 -16.154 27 HD12 ILE 3 1HD1 ILE 3 -5.172 7.962 -16.805 28 HD13 ILE 3 2HD1 ILE 3 -5.419 8.463 -15.133 29 H LYS 4 H LYS 4 -9.491 9.708 -14.297 30 HA LYS 4 HA LYS 4 -9.855 12.468 -13.577 31 HB2 LYS 4 1HB LYS 4 -9.642 10.089 -11.724 32 HB3 LYS 4 2HB LYS 4 -10.439 11.622 -11.410 33 HG2 LYS 4 1HG LYS 4 -11.317 9.654 -13.553 34 HG3 LYS 4 2HG LYS 4 -12.039 9.770 -11.954 35 HD2 LYS 4 1HD LYS 4 -12.587 12.167 -12.430 36 HD3 LYS 4 2HD LYS 4 -12.000 11.934 -14.073 37 HE2 LYS 4 1HE LYS 4 -13.666 10.203 -14.480 38 HE3 LYS 4 2HE LYS 4 -14.238 10.334 -12.816 39 HZ1 LYS 4 3HZ LYS 4 -14.135 12.783 -14.404 40 HZ2 LYS 4 1HZ LYS 4 -15.249 12.308 -13.216 41 HZ3 LYS 4 2HZ LYS 4 -15.355 11.663 -14.784 42 H LEU 5 H LEU 5 -8.798 12.942 -11.229 43 HA LEU 5 HA LEU 5 -6.070 13.559 -11.775 44 HB2 LEU 5 1HB LEU 5 -7.893 13.861 -9.393 45 HB3 LEU 5 2HB LEU 5 -6.176 14.205 -9.216 46 HG LEU 5 HG LEU 5 -6.299 15.875 -11.007 47 HD11 LEU 5 1HD1 LEU 5 -8.618 16.489 -11.874 48 HD12 LEU 5 2HD1 LEU 5 -9.187 14.968 -11.187 49 HD13 LEU 5 3HD1 LEU 5 -7.972 14.960 -12.466 50 HD21 LEU 5 3HD2 LEU 5 -7.686 17.520 -9.839 51 HD22 LEU 5 1HD2 LEU 5 -6.855 16.510 -8.655 52 HD23 LEU 5 2HD2 LEU 5 -8.560 16.230 -9.013 53 H ILE 6 H ILE 6 -4.211 12.695 -11.065 54 HA ILE 6 HA ILE 6 -4.323 10.065 -9.683 55 HB ILE 6 HB ILE 6 -2.226 11.152 -11.587 56 HG12 ILE 6 1HG1 ILE 6 -3.252 8.947 -12.850 57 HG13 ILE 6 2HG1 ILE 6 -4.697 9.455 -11.983 58 HG21 ILE 6 1HG2 ILE 6 -1.182 9.661 -10.025 59 HG22 ILE 6 2HG2 ILE 6 -1.448 8.727 -11.495 60 HG23 ILE 6 3HG2 ILE 6 -2.525 8.519 -10.114 61 HD11 ILE 6 3HD1 ILE 6 -3.081 11.058 -13.991 62 HD12 ILE 6 1HD1 ILE 6 -4.326 11.782 -12.976 63 HD13 ILE 6 2HD1 ILE 6 -4.755 10.527 -14.130 64 H ALA 7 H ALA 7 -3.509 9.987 -7.702 65 HA ALA 7 HA ALA 7 -2.066 12.221 -6.550 66 HB1 ALA 7 3HB ALA 7 -2.901 9.515 -5.480 67 HB2 ALA 7 1HB ALA 7 -3.625 11.081 -5.125 68 HB3 ALA 7 2HB ALA 7 -2.016 10.696 -4.516 69 H GLN 8 H GLN 8 0.080 12.401 -6.235 70 HA GLN 8 HA GLN 8 1.822 10.031 -6.694 71 HB2 GLN 8 1HB GLN 8 1.600 11.691 -8.695 72 HB3 GLN 8 2HB GLN 8 2.589 12.778 -7.724 73 HG2 GLN 8 1HG GLN 8 4.264 10.890 -7.497 74 HG3 GLN 8 2HG GLN 8 3.302 9.984 -8.660 75 HE21 GLN 8 2HE2 GLN 8 4.112 10.174 -10.739 76 HE22 GLN 8 1HE2 GLN 8 4.888 11.547 -11.365 77 H VAL 9 H VAL 9 3.096 9.701 -5.021 78 HA VAL 9 HA VAL 9 4.228 11.979 -3.500 79 HB VAL 9 HB VAL 9 3.715 10.886 -1.375 80 HG11 VAL 9 1HG1 VAL 9 1.244 11.148 -3.112 81 HG12 VAL 9 2HG1 VAL 9 2.096 12.496 -2.360 82 HG13 VAL 9 3HG1 VAL 9 1.299 11.284 -1.358 83 HG21 VAL 9 3HG2 VAL 9 2.065 8.949 -1.409 84 HG22 VAL 9 1HG2 VAL 9 3.679 8.552 -1.992 85 HG23 VAL 9 2HG2 VAL 9 2.370 8.816 -3.142 86 H LYS 10 H LYS 10 6.320 11.695 -2.949 87 HA LYS 10 HA LYS 10 7.508 9.024 -2.794 88 HB2 LYS 10 1HB LYS 10 9.226 9.493 -4.464 89 HB3 LYS 10 2HB LYS 10 7.628 9.548 -5.201 90 HG2 LYS 10 1HG LYS 10 7.647 12.048 -4.884 91 HG3 LYS 10 2HG LYS 10 9.328 11.919 -4.370 92 HD2 LYS 10 1HD LYS 10 8.267 10.965 -7.050 93 HD3 LYS 10 2HD LYS 10 9.098 12.493 -6.789 94 HE2 LYS 10 1HE LYS 10 11.031 11.064 -5.808 95 HE3 LYS 10 2HE LYS 10 10.226 9.697 -6.583 96 HZ1 LYS 10 3HZ LYS 10 10.214 11.390 -8.592 97 HZ2 LYS 10 1HZ LYS 10 11.525 10.358 -8.291 98 HZ3 LYS 10 2HZ LYS 10 11.588 11.979 -7.785 99 H THR 11 H THR 11 9.514 8.986 -1.751 100 HA THR 11 HA THR 11 10.657 11.514 -0.766 101 HB THR 11 HB THR 11 9.236 11.165 1.070 102 HG1 THR 11 HG1 THR 11 11.076 11.287 2.103 103 HG21 THR 11 3HG2 THR 11 8.163 9.106 0.542 104 HG22 THR 11 1HG2 THR 11 8.977 8.808 2.079 105 HG23 THR 11 2HG2 THR 11 9.684 8.213 0.574 106 H VAL 12 H VAL 12 12.797 11.427 -0.336 107 HA VAL 12 HA VAL 12 14.262 9.084 -1.293 108 HB VAL 12 HB VAL 12 15.372 11.692 -0.215 109 HG11 VAL 12 1HG1 VAL 12 17.316 11.069 -1.624 110 HG12 VAL 12 2HG1 VAL 12 16.512 9.562 -2.055 111 HG13 VAL 12 3HG1 VAL 12 17.003 9.852 -0.386 112 HG21 VAL 12 3HG2 VAL 12 15.479 12.388 -2.591 113 HG22 VAL 12 1HG2 VAL 12 13.813 12.131 -2.074 114 HG23 VAL 12 2HG2 VAL 12 14.630 10.914 -3.056 115 H ILE 13 H ILE 13 14.692 7.473 0.047 116 HA ILE 13 HA ILE 13 15.492 8.060 2.862 117 HB ILE 13 HB ILE 13 13.814 5.741 1.879 118 HG12 ILE 13 1HG1 ILE 13 12.571 7.865 1.979 119 HG13 ILE 13 2HG1 ILE 13 12.033 6.738 3.204 120 HG21 ILE 13 1HG2 ILE 13 13.612 5.295 4.381 121 HG22 ILE 13 2HG2 ILE 13 14.945 6.428 4.605 122 HG23 ILE 13 3HG2 ILE 13 15.188 4.954 3.674 123 HD11 ILE 13 3HD1 ILE 13 13.845 8.105 4.690 124 HD12 ILE 13 1HD1 ILE 13 12.178 8.631 4.508 125 HD13 ILE 13 2HD1 ILE 13 13.432 9.348 3.519 126 H ASN 14 H ASN 14 17.231 7.033 3.609 127 HA ASN 14 HA ASN 14 18.774 5.369 1.712 128 HB2 ASN 14 1HB ASN 14 19.845 7.374 2.742 129 HB3 ASN 14 2HB ASN 14 19.655 6.617 4.323 130 HD21 ASN 14 2HD2 ASN 14 22.259 7.202 3.327 131 HD22 ASN 14 1HD2 ASN 14 23.048 5.740 2.983 132 H ALA 15 H ALA 15 18.209 3.278 1.893 133 HA ALA 15 HA ALA 15 18.906 1.811 4.219 134 HB1 ALA 15 3HB ALA 15 16.154 1.104 4.226 135 HB2 ALA 15 1HB ALA 15 16.176 2.859 4.124 136 HB3 ALA 15 2HB ALA 15 16.988 2.051 5.455 137 HA PRO 16 HA PRO 16 19.027 -1.494 1.311 138 HB2 PRO 16 1HB PRO 16 18.034 -3.673 2.772 139 HB3 PRO 16 2HB PRO 16 19.680 -3.025 2.924 140 HG2 PRO 16 1HG PRO 16 17.279 -2.483 4.629 141 HG3 PRO 16 2HG PRO 16 18.955 -2.778 5.119 142 HD2 PRO 16 1HD PRO 16 17.963 -0.272 5.065 143 HD3 PRO 16 2HD PRO 16 19.633 -0.597 4.561 144 H ILE 17 H ILE 17 17.819 -2.315 -0.305 145 HA ILE 17 HA ILE 17 15.100 -1.553 -0.594 146 HB ILE 17 HB ILE 17 16.792 -1.800 -2.447 147 HG12 ILE 17 1HG1 ILE 17 15.150 -2.929 -4.058 148 HG13 ILE 17 2HG1 ILE 17 14.135 -3.268 -2.660 149 HG21 ILE 17 1HG2 ILE 17 17.667 -4.010 -1.593 150 HG22 ILE 17 2HG2 ILE 17 17.326 -3.968 -3.323 151 HG23 ILE 17 3HG2 ILE 17 16.201 -4.763 -2.225 152 HD11 ILE 17 3HD1 ILE 17 15.051 -0.434 -3.178 153 HD12 ILE 17 1HD1 ILE 17 13.609 -1.005 -2.334 154 HD13 ILE 17 2HD1 ILE 17 13.711 -1.110 -4.084 155 H GLU 18 H GLU 18 16.677 -4.544 0.351 156 HA GLU 18 HA GLU 18 14.606 -6.371 -0.021 157 HB2 GLU 18 1HB GLU 18 16.949 -6.933 0.590 158 HB3 GLU 18 2HB GLU 18 16.639 -6.332 2.218 159 HG2 GLU 18 1HG GLU 18 14.890 -8.021 2.546 160 HG3 GLU 18 2HG GLU 18 15.098 -8.581 0.887 161 H LYS 19 H LYS 19 15.400 -4.536 2.920 162 HA LYS 19 HA LYS 19 13.213 -5.524 4.423 163 HB2 LYS 19 1HB LYS 19 15.045 -3.165 4.746 164 HB3 LYS 19 2HB LYS 19 13.714 -3.429 5.861 165 HG2 LYS 19 1HG LYS 19 15.847 -4.434 6.674 166 HG3 LYS 19 2HG LYS 19 14.566 -5.625 6.461 167 HD2 LYS 19 1HD LYS 19 15.526 -6.432 4.413 168 HD3 LYS 19 2HD LYS 19 16.658 -5.077 4.332 169 HE2 LYS 19 1HE LYS 19 17.786 -5.893 6.357 170 HE3 LYS 19 2HE LYS 19 16.621 -7.207 6.500 171 HZ1 LYS 19 3HZ LYS 19 18.921 -7.534 5.302 172 HZ2 LYS 19 1HZ LYS 19 18.066 -6.919 3.971 173 HZ3 LYS 19 2HZ LYS 19 17.519 -8.325 4.754 174 H VAL 20 H VAL 20 13.520 -2.533 2.499 175 HA VAL 20 HA VAL 20 10.979 -1.486 3.222 176 HB VAL 20 HB VAL 20 12.493 -1.087 0.621 177 HG11 VAL 20 1HG1 VAL 20 10.100 -0.361 0.563 178 HG12 VAL 20 2HG1 VAL 20 11.209 1.002 0.468 179 HG13 VAL 20 3HG1 VAL 20 10.394 0.633 1.985 180 HG21 VAL 20 3HG2 VAL 20 12.510 0.635 3.114 181 HG22 VAL 20 1HG2 VAL 20 13.501 0.839 1.674 182 HG23 VAL 20 2HG2 VAL 20 13.771 -0.538 2.740 183 H TRP 21 H TRP 21 12.052 -3.481 0.490 184 HA TRP 21 HA TRP 21 9.569 -3.828 -0.787 185 HB2 TRP 21 1HB TRP 21 11.718 -4.410 -1.833 186 HB3 TRP 21 2HB TRP 21 11.979 -5.670 -0.632 187 HD1 TRP 21 HD1 TRP 21 10.677 -7.932 -0.904 188 HE1 TRP 21 HE1 TRP 21 9.303 -8.950 -2.837 189 HE3 TRP 21 HE3 TRP 21 10.079 -3.801 -3.844 190 HZ2 TRP 21 HZ2 TRP 21 8.111 -8.120 -5.303 191 HZ3 TRP 21 HZ3 TRP 21 8.825 -3.938 -5.972 192 HH2 TRP 21 HH2 TRP 21 7.842 -6.092 -6.708 193 H GLU 22 H GLU 22 11.205 -5.646 1.771 194 HA GLU 22 HA GLU 22 9.394 -7.768 2.053 195 HB2 GLU 22 1HB GLU 22 11.645 -7.614 3.140 196 HB3 GLU 22 2HB GLU 22 10.988 -6.411 4.247 197 HG2 GLU 22 1HG GLU 22 9.335 -8.058 5.062 198 HG3 GLU 22 2HG GLU 22 9.972 -9.255 3.942 199 H ALA 23 H ALA 23 9.500 -4.611 3.696 200 HA ALA 23 HA ALA 23 7.268 -4.982 5.354 201 HB1 ALA 23 3HB ALA 23 8.362 -2.426 4.175 202 HB2 ALA 23 1HB ALA 23 8.870 -3.172 5.689 203 HB3 ALA 23 2HB ALA 23 7.237 -2.526 5.528 204 H LEU 24 H LEU 24 7.470 -4.118 1.975 205 HA LEU 24 HA LEU 24 4.826 -3.073 1.748 206 HB2 LEU 24 1HB LEU 24 6.592 -2.555 0.109 207 HB3 LEU 24 2HB LEU 24 6.634 -4.245 -0.378 208 HG LEU 24 HG LEU 24 4.309 -4.102 -1.163 209 HD11 LEU 24 1HD1 LEU 24 3.168 -2.547 0.153 210 HD12 LEU 24 2HD1 LEU 24 3.384 -1.640 -1.337 211 HD13 LEU 24 3HD1 LEU 24 4.447 -1.339 0.038 212 HD21 LEU 24 3HD2 LEU 24 4.716 -2.660 -3.093 213 HD22 LEU 24 1HD2 LEU 24 6.200 -3.514 -2.670 214 HD23 LEU 24 2HD2 LEU 24 6.000 -1.819 -2.224 215 H VAL 25 H VAL 25 6.213 -6.292 1.207 216 HA VAL 25 HA VAL 25 3.452 -7.408 0.987 217 HB VAL 25 HB VAL 25 4.641 -9.300 -0.314 218 HG11 VAL 25 1HG1 VAL 25 4.424 -6.501 -1.453 219 HG12 VAL 25 2HG1 VAL 25 3.167 -7.736 -1.440 220 HG13 VAL 25 3HG1 VAL 25 4.608 -7.956 -2.433 221 HG21 VAL 25 3HG2 VAL 25 6.955 -8.525 0.357 222 HG22 VAL 25 1HG2 VAL 25 6.720 -7.108 -0.665 223 HG23 VAL 25 2HG2 VAL 25 6.741 -8.719 -1.381 224 H ASN 26 H ASN 26 3.527 -7.518 3.321 225 HA ASN 26 HA ASN 26 4.459 -10.131 4.148 226 HB2 ASN 26 1HB ASN 26 6.422 -8.687 4.500 227 HB3 ASN 26 2HB ASN 26 5.480 -7.723 5.624 228 HD21 ASN 26 2HD2 ASN 26 4.149 -10.528 6.325 229 HD22 ASN 26 1HD2 ASN 26 5.250 -11.168 7.439 230 HA PRO 27 HA PRO 27 0.541 -9.106 6.231 231 HB2 PRO 27 1HB PRO 27 -0.101 -11.631 7.122 232 HB3 PRO 27 2HB PRO 27 -0.347 -11.102 5.449 233 HG2 PRO 27 1HG PRO 27 1.881 -12.731 6.602 234 HG3 PRO 27 2HG PRO 27 0.994 -12.955 5.079 235 HD2 PRO 27 1HD PRO 27 3.457 -11.794 5.184 236 HD3 PRO 27 2HD PRO 27 2.256 -11.337 3.954 237 H GLU 28 H GLU 28 3.443 -10.243 7.576 238 HA GLU 28 HA GLU 28 2.524 -10.238 10.360 239 HB2 GLU 28 1HB GLU 28 5.293 -10.528 9.168 240 HB3 GLU 28 2HB GLU 28 4.886 -10.719 10.874 241 HG2 GLU 28 1HG GLU 28 3.308 -12.530 10.293 242 HG3 GLU 28 2HG GLU 28 3.743 -12.353 8.594 243 H ILE 29 H ILE 29 4.689 -8.296 8.300 244 HA ILE 29 HA ILE 29 5.160 -6.296 10.312 245 HB ILE 29 HB ILE 29 5.552 -6.092 7.317 246 HG12 ILE 29 1HG1 ILE 29 7.595 -6.827 9.445 247 HG13 ILE 29 2HG1 ILE 29 6.751 -8.028 8.474 248 HG21 ILE 29 1HG2 ILE 29 5.588 -3.920 8.427 249 HG22 ILE 29 2HG2 ILE 29 7.232 -4.368 7.980 250 HG23 ILE 29 3HG2 ILE 29 6.696 -4.532 9.653 251 HD11 ILE 29 3HD1 ILE 29 7.654 -7.085 6.427 252 HD12 ILE 29 1HD1 ILE 29 8.980 -7.431 7.535 253 HD13 ILE 29 2HD1 ILE 29 8.418 -5.773 7.325 254 H ILE 30 H ILE 30 3.009 -6.615 7.521 255 HA ILE 30 HA ILE 30 1.878 -4.041 7.580 256 HB ILE 30 HB ILE 30 0.759 -6.705 6.670 257 HG12 ILE 30 1HG1 ILE 30 1.651 -4.314 5.020 258 HG13 ILE 30 2HG1 ILE 30 2.752 -5.613 5.470 259 HG21 ILE 30 1HG2 ILE 30 -0.919 -5.231 5.395 260 HG22 ILE 30 2HG2 ILE 30 -0.444 -3.926 6.483 261 HG23 ILE 30 3HG2 ILE 30 -1.191 -5.386 7.130 262 HD11 ILE 30 3HD1 ILE 30 0.192 -5.909 3.866 263 HD12 ILE 30 1HD1 ILE 30 1.206 -7.251 4.389 264 HD13 ILE 30 2HD1 ILE 30 1.836 -6.063 3.250 265 H LYS 31 H LYS 31 1.011 -7.025 9.290 266 HA LYS 31 HA LYS 31 -1.302 -6.007 10.575 267 HB2 LYS 31 1HB LYS 31 -0.779 -8.425 10.348 268 HB3 LYS 31 2HB LYS 31 0.538 -8.228 11.504 269 HG2 LYS 31 1HG LYS 31 -1.055 -7.514 13.227 270 HG3 LYS 31 2HG LYS 31 -2.381 -7.618 12.066 271 HD2 LYS 31 1HD LYS 31 -1.945 -10.027 11.780 272 HD3 LYS 31 2HD LYS 31 -0.624 -9.930 12.943 273 HE2 LYS 31 1HE LYS 31 -2.617 -10.757 14.070 274 HE3 LYS 31 2HE LYS 31 -2.255 -9.135 14.660 275 HZ1 LYS 31 3HZ LYS 31 -3.875 -8.254 13.086 276 HZ2 LYS 31 1HZ LYS 31 -4.595 -9.355 14.156 277 HZ3 LYS 31 2HZ LYS 31 -4.241 -9.829 12.562 278 H GLU 32 H GLU 32 2.119 -5.849 11.315 279 HA GLU 32 HA GLU 32 2.015 -5.162 14.025 280 HB2 GLU 32 1HB GLU 32 4.111 -5.621 12.679 281 HB3 GLU 32 2HB GLU 32 3.966 -3.994 12.022 282 HG2 GLU 32 1HG GLU 32 4.066 -3.051 14.290 283 HG3 GLU 32 2HG GLU 32 4.203 -4.675 14.960 284 H TYR 33 H TYR 33 1.732 -3.118 11.132 285 HA TYR 33 HA TYR 33 1.505 -0.650 12.546 286 HB2 TYR 33 1HB TYR 33 0.672 -1.452 9.745 287 HB3 TYR 33 2HB TYR 33 0.570 0.195 10.355 288 HD1 TYR 33 HD2 TYR 33 2.782 1.095 11.512 289 HD2 TYR 33 HD1 TYR 33 2.671 -2.059 8.599 290 HE1 TYR 33 HE2 TYR 33 5.161 1.509 10.964 291 HE2 TYR 33 HE1 TYR 33 5.048 -1.635 8.047 292 HH TYR 33 HH TYR 33 7.102 -0.524 9.525 293 H MET 34 H MET 34 -0.795 -3.084 11.462 294 HA MET 34 HA MET 34 -3.121 -1.467 12.147 295 HB2 MET 34 1HB MET 34 -2.899 -4.371 11.315 296 HB3 MET 34 2HB MET 34 -4.392 -3.441 11.436 297 HG2 MET 34 1HG MET 34 -2.066 -2.716 9.628 298 HG3 MET 34 2HG MET 34 -3.503 -3.581 9.092 299 HE1 MET 34 3HE MET 34 -5.531 -2.559 8.262 300 HE2 MET 34 1HE MET 34 -6.285 -1.103 8.925 301 HE3 MET 34 2HE MET 34 -6.011 -2.504 9.956 302 H PHE 35 H PHE 35 -4.647 -2.039 13.727 303 HA PHE 35 HA PHE 35 -3.589 -2.677 16.260 304 HB2 PHE 35 1HB PHE 35 -6.455 -2.601 15.289 305 HB3 PHE 35 2HB PHE 35 -5.977 -2.713 16.983 306 HD1 PHE 35 HD1 PHE 35 -4.854 -0.831 18.115 307 HD2 PHE 35 HD2 PHE 35 -6.109 -0.537 14.016 308 HE1 PHE 35 HE1 PHE 35 -4.537 1.625 18.193 309 HE2 PHE 35 HE2 PHE 35 -5.795 1.920 14.097 310 HZ PHE 35 HZ PHE 35 -5.008 3.002 16.184 311 H GLY 36 H GLY 36 -5.268 -4.689 13.876 312 HA2 GLY 36 1HA GLY 36 -4.190 -7.099 14.839 313 HA3 GLY 36 2HA GLY 36 -5.787 -6.908 15.551 314 H THR 37 H THR 37 -4.678 -5.982 12.306 315 HA THR 37 HA THR 37 -6.965 -7.369 11.113 316 HB THR 37 HB THR 37 -4.751 -5.796 9.774 317 HG1 THR 37 HG1 THR 37 -7.365 -4.882 10.180 318 HG21 THR 37 3HG2 THR 37 -6.509 -5.605 7.965 319 HG22 THR 37 1HG2 THR 37 -7.444 -6.822 8.831 320 HG23 THR 37 2HG2 THR 37 -5.856 -7.229 8.179 321 H THR 38 H THR 38 -6.901 -9.359 10.324 322 HA THR 38 HA THR 38 -4.346 -10.798 10.143 323 HB THR 38 HB THR 38 -5.818 -12.767 9.700 324 HG1 THR 38 HG1 THR 38 -7.835 -12.468 9.288 325 HG21 THR 38 3HG2 THR 38 -6.765 -12.862 11.957 326 HG22 THR 38 1HG2 THR 38 -6.602 -11.113 12.114 327 HG23 THR 38 2HG2 THR 38 -5.162 -12.127 12.004 328 H VAL 39 H VAL 39 -3.271 -10.253 8.318 329 HA VAL 39 HA VAL 39 -4.679 -10.174 5.721 330 HB VAL 39 HB VAL 39 -1.826 -9.453 6.451 331 HG11 VAL 39 1HG1 VAL 39 -1.881 -8.318 4.210 332 HG12 VAL 39 2HG1 VAL 39 -3.425 -9.103 3.899 333 HG13 VAL 39 3HG1 VAL 39 -1.974 -10.072 4.099 334 HG21 VAL 39 3HG2 VAL 39 -2.657 -7.119 6.132 335 HG22 VAL 39 1HG2 VAL 39 -3.435 -7.935 7.488 336 HG23 VAL 39 2HG2 VAL 39 -4.292 -7.756 5.958 337 H VAL 40 H VAL 40 -4.538 -11.772 4.295 338 HA VAL 40 HA VAL 40 -2.472 -13.899 4.667 339 HB VAL 40 HB VAL 40 -5.315 -14.252 3.677 340 HG11 VAL 40 1HG1 VAL 40 -3.787 -15.874 2.684 341 HG12 VAL 40 2HG1 VAL 40 -4.731 -16.678 3.935 342 HG13 VAL 40 3HG1 VAL 40 -3.064 -16.204 4.259 343 HG21 VAL 40 3HG2 VAL 40 -5.636 -15.455 5.827 344 HG22 VAL 40 1HG2 VAL 40 -5.248 -13.753 6.085 345 HG23 VAL 40 2HG2 VAL 40 -4.009 -14.986 6.319 346 H SER 41 H SER 41 -1.201 -14.221 2.989 347 HA SER 41 HA SER 41 -2.129 -13.837 0.246 348 HB2 SER 41 1HB SER 41 -1.468 -11.574 0.738 349 HB3 SER 41 2HB SER 41 0.055 -12.119 1.436 350 HG SER 41 HG SER 41 -0.801 -12.128 -1.251 351 H ASP 42 H ASP 42 -0.755 -14.702 -1.304 352 HA ASP 42 HA ASP 42 1.069 -16.801 -0.347 353 HB2 ASP 42 1HB ASP 42 -0.705 -17.385 -1.960 354 HB3 ASP 42 2HB ASP 42 -0.071 -16.201 -3.095 355 H TRP 43 H TRP 43 1.048 -13.697 -1.784 356 HA TRP 43 HA TRP 43 2.702 -12.223 -2.379 357 HB2 TRP 43 1HB TRP 43 4.793 -14.227 -1.493 358 HB3 TRP 43 2HB TRP 43 4.887 -12.469 -1.497 359 HD1 TRP 43 HD1 TRP 43 2.181 -11.782 -0.043 360 HE1 TRP 43 HE1 TRP 43 1.911 -12.312 2.465 361 HE3 TRP 43 HE3 TRP 43 5.782 -15.356 0.495 362 HZ2 TRP 43 HZ2 TRP 43 3.079 -14.030 4.446 363 HZ3 TRP 43 HZ3 TRP 43 6.187 -16.420 2.694 364 HH2 TRP 43 HH2 TRP 43 4.842 -15.762 4.670 365 H LYS 44 H LYS 44 1.685 -13.637 -4.458 366 HA LYS 44 HA LYS 44 3.968 -13.750 -6.286 367 HB2 LYS 44 1HB LYS 44 3.486 -15.949 -7.161 368 HB3 LYS 44 2HB LYS 44 3.783 -16.072 -5.430 369 HG2 LYS 44 1HG LYS 44 1.407 -16.218 -4.976 370 HG3 LYS 44 2HG LYS 44 1.007 -15.951 -6.673 371 HD2 LYS 44 1HD LYS 44 2.294 -18.027 -7.230 372 HD3 LYS 44 2HD LYS 44 2.482 -18.319 -5.500 373 HE2 LYS 44 1HE LYS 44 0.037 -18.379 -5.234 374 HE3 LYS 44 2HE LYS 44 -0.165 -18.054 -6.955 375 HZ1 LYS 44 3HZ LYS 44 1.497 -20.155 -6.984 376 HZ2 LYS 44 1HZ LYS 44 -0.191 -20.274 -7.117 377 HZ3 LYS 44 2HZ LYS 44 0.563 -20.508 -5.611 378 H GLU 45 H GLU 45 3.378 -13.660 -8.505 379 HA GLU 45 HA GLU 45 1.411 -11.866 -9.182 380 HB2 GLU 45 1HB GLU 45 3.317 -12.600 -10.634 381 HB3 GLU 45 2HB GLU 45 2.411 -14.062 -11.006 382 HG2 GLU 45 1HG GLU 45 0.583 -12.711 -11.938 383 HG3 GLU 45 2HG GLU 45 1.438 -11.235 -11.516 384 H GLY 46 H GLY 46 -0.703 -11.897 -9.376 385 HA2 GLY 46 1HA GLY 46 -2.841 -12.652 -9.939 386 HA3 GLY 46 2HA GLY 46 -2.178 -14.249 -10.254 387 H SER 47 H SER 47 -1.025 -13.343 -7.284 388 HA SER 47 HA SER 47 -2.628 -15.223 -5.888 389 HB2 SER 47 1HB SER 47 -0.391 -14.735 -5.132 390 HB3 SER 47 2HB SER 47 -0.798 -13.051 -4.860 391 HG SER 47 HG SER 47 -2.578 -14.238 -3.513 392 H GLN 48 H GLN 48 -4.413 -15.030 -4.694 393 HA GLN 48 HA GLN 48 -5.896 -12.508 -4.787 394 HB2 GLN 48 1HB GLN 48 -6.995 -14.748 -5.161 395 HB3 GLN 48 2HB GLN 48 -6.689 -15.125 -3.467 396 HG2 GLN 48 1HG GLN 48 -8.950 -14.275 -3.648 397 HG3 GLN 48 2HG GLN 48 -7.980 -13.044 -2.847 398 HE21 GLN 48 2HE2 GLN 48 -9.082 -11.153 -3.579 399 HE22 GLN 48 1HE2 GLN 48 -9.232 -10.742 -5.219 400 H ILE 49 H ILE 49 -6.500 -11.316 -2.960 401 HA ILE 49 HA ILE 49 -5.265 -12.050 -0.364 402 HB ILE 49 HB ILE 49 -3.740 -10.480 -1.541 403 HG12 ILE 49 1HG1 ILE 49 -5.137 -9.178 0.824 404 HG13 ILE 49 2HG1 ILE 49 -4.023 -10.536 0.980 405 HG21 ILE 49 1HG2 ILE 49 -5.994 -8.468 -1.270 406 HG22 ILE 49 2HG2 ILE 49 -5.582 -9.280 -2.779 407 HG23 ILE 49 3HG2 ILE 49 -4.413 -8.214 -2.008 408 HD11 ILE 49 3HD1 ILE 49 -2.789 -8.480 1.357 409 HD12 ILE 49 1HD1 ILE 49 -3.384 -7.801 -0.159 410 HD13 ILE 49 2HD1 ILE 49 -2.273 -9.170 -0.180 411 H VAL 50 H VAL 50 -6.450 -11.650 1.365 412 HA VAL 50 HA VAL 50 -8.802 -9.861 1.179 413 HB VAL 50 HB VAL 50 -8.916 -12.690 2.269 414 HG11 VAL 50 1HG1 VAL 50 -10.975 -10.478 1.989 415 HG12 VAL 50 2HG1 VAL 50 -10.402 -11.205 3.490 416 HG13 VAL 50 3HG1 VAL 50 -11.379 -12.151 2.370 417 HG21 VAL 50 3HG2 VAL 50 -10.456 -13.068 0.343 418 HG22 VAL 50 1HG2 VAL 50 -8.819 -12.680 -0.187 419 HG23 VAL 50 2HG2 VAL 50 -10.081 -11.451 -0.248 420 H TRP 51 H TRP 51 -9.334 -8.833 3.020 421 HA TRP 51 HA TRP 51 -7.616 -9.290 5.420 422 HB2 TRP 51 1HB TRP 51 -8.820 -6.642 4.561 423 HB3 TRP 51 2HB TRP 51 -7.644 -6.930 5.841 424 HD1 TRP 51 HD1 TRP 51 -5.779 -8.913 4.015 425 HE1 TRP 51 HE1 TRP 51 -4.260 -7.828 2.249 426 HE3 TRP 51 HE3 TRP 51 -8.114 -4.415 3.502 427 HZ2 TRP 51 HZ2 TRP 51 -4.054 -5.366 0.804 428 HZ3 TRP 51 HZ3 TRP 51 -7.238 -2.713 1.935 429 HH2 TRP 51 HH2 TRP 51 -5.212 -3.181 0.581 430 H LYS 52 H LYS 52 -8.617 -9.512 7.329 431 HA LYS 52 HA LYS 52 -11.590 -9.402 7.355 432 HB2 LYS 52 1HB LYS 52 -9.645 -10.753 9.232 433 HB3 LYS 52 2HB LYS 52 -11.394 -10.755 9.416 434 HG2 LYS 52 1HG LYS 52 -11.626 -11.834 7.202 435 HG3 LYS 52 2HG LYS 52 -9.868 -11.860 7.040 436 HD2 LYS 52 1HD LYS 52 -9.682 -13.277 9.032 437 HD3 LYS 52 2HD LYS 52 -11.432 -13.217 9.254 438 HE2 LYS 52 1HE LYS 52 -10.802 -15.304 8.129 439 HE3 LYS 52 2HE LYS 52 -11.735 -14.284 7.035 440 HZ1 LYS 52 3HZ LYS 52 -9.798 -15.186 5.928 441 HZ2 LYS 52 1HZ LYS 52 -8.773 -14.514 7.101 442 HZ3 LYS 52 2HZ LYS 52 -9.658 -13.498 6.066 443 H GLY 53 H GLY 53 -12.682 -8.191 8.827 444 HA2 GLY 53 1HA GLY 53 -11.425 -6.802 11.002 445 HA3 GLY 53 2HA GLY 53 -11.698 -5.738 9.626 446 H GLU 54 H GLU 54 -12.962 -5.001 11.797 447 HA GLU 54 HA GLU 54 -15.788 -5.790 11.376 448 HB2 GLU 54 1HB GLU 54 -14.678 -6.567 13.583 449 HB3 GLU 54 2HB GLU 54 -14.721 -4.869 14.045 450 HG2 GLU 54 1HG GLU 54 -16.752 -5.791 14.903 451 HG3 GLU 54 2HG GLU 54 -17.234 -4.933 13.440 452 H TRP 55 H TRP 55 -17.049 -4.214 10.779 453 HA TRP 55 HA TRP 55 -16.235 -1.402 11.281 454 HB2 TRP 55 1HB TRP 55 -15.984 -1.829 8.930 455 HB3 TRP 55 2HB TRP 55 -17.540 -2.648 8.857 456 HD1 TRP 55 HD1 TRP 55 -19.233 -1.201 7.707 457 HE1 TRP 55 HE1 TRP 55 -19.880 1.287 7.658 458 HE3 TRP 55 HE3 TRP 55 -15.581 0.728 10.727 459 HZ2 TRP 55 HZ2 TRP 55 -18.984 3.757 8.750 460 HZ3 TRP 55 HZ3 TRP 55 -15.506 3.148 11.198 461 HH2 TRP 55 HH2 TRP 55 -17.193 4.671 10.211 462 H LYS 56 H LYS 56 -17.510 -0.430 12.644 463 HA LYS 56 HA LYS 56 -19.347 -0.091 14.053 464 HB2 LYS 56 1HB LYS 56 -21.331 0.680 12.818 465 HB3 LYS 56 2HB LYS 56 -19.857 1.319 12.099 466 HG2 LYS 56 1HG LYS 56 -19.957 -0.441 10.394 467 HG3 LYS 56 2HG LYS 56 -21.441 -1.058 11.062 468 HD2 LYS 56 1HD LYS 56 -20.954 1.665 9.818 469 HD3 LYS 56 2HD LYS 56 -21.854 0.333 9.099 470 HE2 LYS 56 1HE LYS 56 -22.634 2.092 11.424 471 HE3 LYS 56 2HE LYS 56 -23.560 1.694 9.980 472 HZ1 LYS 56 3HZ LYS 56 -23.561 -0.656 10.820 473 HZ2 LYS 56 1HZ LYS 56 -24.477 0.445 11.727 474 HZ3 LYS 56 2HZ LYS 56 -22.955 -0.056 12.289 475 H GLY 57 H GLY 57 -18.773 -2.794 14.015 476 HA2 GLY 57 1HA GLY 57 -19.791 -4.699 14.946 477 HA3 GLY 57 2HA GLY 57 -21.366 -3.953 14.698 478 H LYS 58 H LYS 58 -20.363 -3.401 11.838 479 HA LYS 58 HA LYS 58 -21.350 -5.900 10.670 480 HB2 LYS 58 1HB LYS 58 -20.679 -3.228 9.401 481 HB3 LYS 58 2HB LYS 58 -21.457 -4.578 8.590 482 HG2 LYS 58 1HG LYS 58 -22.628 -3.200 11.027 483 HG3 LYS 58 2HG LYS 58 -23.028 -2.750 9.371 484 HD2 LYS 58 1HD LYS 58 -23.788 -5.095 8.959 485 HD3 LYS 58 2HD LYS 58 -23.506 -5.456 10.656 486 HE2 LYS 58 1HE LYS 58 -25.109 -3.733 11.326 487 HE3 LYS 58 2HE LYS 58 -25.406 -3.346 9.628 488 HZ1 LYS 58 3HZ LYS 58 -25.645 -6.142 10.418 489 HZ2 LYS 58 1HZ LYS 58 -26.554 -5.253 9.296 490 HZ3 LYS 58 2HZ LYS 58 -26.867 -5.092 10.958 491 H ALA 59 H ALA 59 -19.902 -7.412 10.331 492 HA ALA 59 HA ALA 59 -17.120 -6.984 9.997 493 HB1 ALA 59 3HB ALA 59 -18.147 -9.097 10.819 494 HB2 ALA 59 1HB ALA 59 -16.988 -9.343 9.512 495 HB3 ALA 59 2HB ALA 59 -18.720 -9.403 9.182 496 H TYR 60 H TYR 60 -15.925 -6.562 8.237 497 HA TYR 60 HA TYR 60 -17.138 -6.883 5.538 498 HB2 TYR 60 1HB TYR 60 -16.410 -4.717 4.855 499 HB3 TYR 60 2HB TYR 60 -17.276 -4.496 6.372 500 HD1 TYR 60 HD1 TYR 60 -15.884 -4.482 8.563 501 HD2 TYR 60 HD2 TYR 60 -14.165 -3.935 4.661 502 HE1 TYR 60 HE1 TYR 60 -13.859 -3.474 9.584 503 HE2 TYR 60 HE2 TYR 60 -12.158 -2.923 5.684 504 HH TYR 60 HH TYR 60 -11.463 -1.854 7.700 505 H GLU 61 H GLU 61 -15.678 -7.186 3.840 506 HA GLU 61 HA GLU 61 -12.846 -7.648 4.546 507 HB2 GLU 61 1HB GLU 61 -12.924 -9.773 3.191 508 HB3 GLU 61 2HB GLU 61 -13.774 -9.852 4.730 509 HG2 GLU 61 1HG GLU 61 -15.169 -9.212 2.116 510 HG3 GLU 61 2HG GLU 61 -15.013 -10.847 2.741 511 H ASP 62 H ASP 62 -11.456 -7.040 3.053 512 HA ASP 62 HA ASP 62 -12.442 -5.696 0.642 513 HB2 ASP 62 1HB ASP 62 -9.706 -5.874 1.938 514 HB3 ASP 62 2HB ASP 62 -10.029 -4.999 0.443 515 H LYS 63 H LYS 63 -11.128 -6.091 -1.420 516 HA LYS 63 HA LYS 63 -10.022 -8.797 -1.661 517 HB2 LYS 63 1HB LYS 63 -12.475 -9.097 -1.846 518 HB3 LYS 63 2HB LYS 63 -12.485 -8.004 -3.231 519 HG2 LYS 63 1HG LYS 63 -11.026 -9.503 -4.482 520 HG3 LYS 63 2HG LYS 63 -10.849 -10.555 -3.075 521 HD2 LYS 63 1HD LYS 63 -13.285 -11.002 -3.119 522 HD3 LYS 63 2HD LYS 63 -13.438 -9.979 -4.547 523 HE2 LYS 63 1HE LYS 63 -11.759 -12.496 -4.350 524 HE3 LYS 63 2HE LYS 63 -13.303 -12.351 -5.192 525 HZ1 LYS 63 3HZ LYS 63 -12.215 -10.517 -6.505 526 HZ2 LYS 63 1HZ LYS 63 -11.652 -12.087 -6.820 527 HZ3 LYS 63 2HZ LYS 63 -10.734 -11.034 -5.851 528 H GLY 64 H GLY 64 -8.388 -8.795 -3.006 529 HA2 GLY 64 1HA GLY 64 -8.409 -7.234 -5.480 530 HA3 GLY 64 2HA GLY 64 -7.171 -6.799 -4.301 531 H THR 65 H THR 65 -6.117 -7.594 -6.552 532 HA THR 65 HA THR 65 -4.979 -10.238 -5.932 533 HB THR 65 HB THR 65 -6.191 -9.612 -8.639 534 HG1 THR 65 HG1 THR 65 -7.026 -11.781 -7.172 535 HG21 THR 65 3HG2 THR 65 -4.247 -10.998 -8.922 536 HG22 THR 65 1HG2 THR 65 -5.648 -12.063 -9.007 537 HG23 THR 65 2HG2 THR 65 -4.681 -11.999 -7.536 538 H ILE 66 H ILE 66 -3.000 -10.659 -6.945 539 HA ILE 66 HA ILE 66 -1.422 -8.267 -7.445 540 HB ILE 66 HB ILE 66 -0.545 -11.158 -7.677 541 HG12 ILE 66 1HG1 ILE 66 -1.527 -10.848 -5.470 542 HG13 ILE 66 2HG1 ILE 66 0.219 -10.917 -5.322 543 HG21 ILE 66 1HG2 ILE 66 1.664 -10.160 -7.078 544 HG22 ILE 66 2HG2 ILE 66 0.942 -8.559 -7.201 545 HG23 ILE 66 3HG2 ILE 66 1.044 -9.591 -8.627 546 HD11 ILE 66 3HD1 ILE 66 -1.604 -8.531 -5.055 547 HD12 ILE 66 1HD1 ILE 66 0.107 -8.308 -5.418 548 HD13 ILE 66 2HD1 ILE 66 -0.377 -9.118 -3.935 549 H LEU 67 H LEU 67 -1.156 -7.378 -9.369 550 HA LEU 67 HA LEU 67 -1.869 -8.850 -11.826 551 HB2 LEU 67 1HB LEU 67 -1.474 -5.958 -11.088 552 HB3 LEU 67 2HB LEU 67 -1.302 -6.419 -12.781 553 HG LEU 67 HG LEU 67 -3.559 -7.409 -12.753 554 HD11 LEU 67 1HD1 LEU 67 -3.731 -8.135 -10.453 555 HD12 LEU 67 2HD1 LEU 67 -5.008 -6.953 -10.732 556 HD13 LEU 67 3HD1 LEU 67 -3.547 -6.483 -9.867 557 HD21 LEU 67 3HD2 LEU 67 -3.393 -4.583 -11.674 558 HD22 LEU 67 1HD2 LEU 67 -4.826 -5.275 -12.429 559 HD23 LEU 67 2HD2 LEU 67 -3.349 -5.057 -13.370 560 H GLN 68 H GLN 68 0.895 -7.129 -10.419 561 HA GLN 68 HA GLN 68 2.711 -8.676 -12.190 562 HB2 GLN 68 1HB GLN 68 2.454 -6.353 -13.070 563 HB3 GLN 68 2HB GLN 68 3.022 -5.736 -11.519 564 HG2 GLN 68 1HG GLN 68 5.166 -6.830 -11.793 565 HG3 GLN 68 2HG GLN 68 4.607 -7.665 -13.242 566 HE21 GLN 68 2HE2 GLN 68 6.903 -5.994 -13.337 567 HE22 GLN 68 1HE2 GLN 68 6.542 -4.627 -14.274 568 H PHE 69 H PHE 69 4.414 -9.542 -11.159 569 HA PHE 69 HA PHE 69 5.079 -8.592 -8.417 570 HB2 PHE 69 1HB PHE 69 3.582 -10.608 -8.343 571 HB3 PHE 69 2HB PHE 69 4.838 -11.510 -9.178 572 HD1 PHE 69 HD2 PHE 69 3.953 -9.741 -6.047 573 HD2 PHE 69 HD1 PHE 69 6.917 -12.115 -8.058 574 HE1 PHE 69 HE2 PHE 69 5.126 -10.100 -3.896 575 HE2 PHE 69 HE1 PHE 69 8.088 -12.472 -5.905 576 HZ PHE 69 HZ PHE 69 7.197 -11.462 -3.824 577 H ASN 70 H ASN 70 7.026 -7.738 -8.817 578 HA ASN 70 HA ASN 70 9.132 -9.531 -9.932 579 HB2 ASN 70 1HB ASN 70 8.826 -6.536 -10.282 580 HB3 ASN 70 2HB ASN 70 10.245 -7.474 -10.756 581 HD21 ASN 70 2HD2 ASN 70 8.889 -6.114 -12.784 582 HD22 ASN 70 1HD2 ASN 70 8.046 -7.222 -13.755 583 H GLU 71 H GLU 71 10.053 -10.222 -8.130 584 HA GLU 71 HA GLU 71 10.269 -9.174 -5.633 585 HB2 GLU 71 1HB GLU 71 12.368 -10.735 -7.157 586 HB3 GLU 71 2HB GLU 71 12.397 -10.477 -5.412 587 HG2 GLU 71 1HG GLU 71 10.206 -11.579 -5.196 588 HG3 GLU 71 2HG GLU 71 10.144 -11.814 -6.942 589 H ARG 72 H ARG 72 11.158 -7.488 -4.698 590 HA ARG 72 HA ARG 72 12.236 -5.471 -4.430 591 HB2 ARG 72 1HB ARG 72 14.482 -7.183 -5.507 592 HB3 ARG 72 2HB ARG 72 14.692 -5.649 -4.663 593 HG2 ARG 72 1HG ARG 72 13.653 -6.552 -2.655 594 HG3 ARG 72 2HG ARG 72 13.271 -8.059 -3.492 595 HD2 ARG 72 1HD ARG 72 16.092 -7.010 -3.119 596 HD3 ARG 72 2HD ARG 72 15.333 -8.187 -2.049 597 HE ARG 72 HE ARG 72 15.013 -9.251 -4.561 598 HH11 ARG 72 1HH2 ARG 72 17.690 -8.129 -2.667 599 HH12 ARG 72 2HH2 ARG 72 18.825 -9.220 -3.387 600 HH21 ARG 72 1HH1 ARG 72 16.481 -10.663 -5.504 601 HH22 ARG 72 2HH1 ARG 72 18.138 -10.661 -5.001 602 H SER 73 H SER 73 10.788 -5.111 -6.660 603 HA SER 73 HA SER 73 12.464 -3.314 -8.209 604 HB2 SER 73 1HB SER 73 12.769 -5.639 -9.227 605 HB3 SER 73 2HB SER 73 11.096 -5.519 -9.750 606 HG SER 73 HG SER 73 12.816 -4.730 -11.227 607 H ILE 74 H ILE 74 9.446 -4.998 -9.064 608 HA ILE 74 HA ILE 74 7.944 -2.456 -8.719 609 HB ILE 74 HB ILE 74 7.885 -4.161 -11.234 610 HG12 ILE 74 1HG1 ILE 74 8.799 -1.290 -10.803 611 HG13 ILE 74 2HG1 ILE 74 9.885 -2.662 -10.970 612 HG21 ILE 74 1HG2 ILE 74 6.313 -1.704 -10.376 613 HG22 ILE 74 2HG2 ILE 74 5.659 -3.292 -10.768 614 HG23 ILE 74 3HG2 ILE 74 6.357 -2.296 -12.034 615 HD11 ILE 74 3HD1 ILE 74 8.867 -3.144 -13.200 616 HD12 ILE 74 1HD1 ILE 74 9.712 -1.597 -13.120 617 HD13 ILE 74 2HD1 ILE 74 7.951 -1.644 -13.051 618 H LEU 75 H LEU 75 6.028 -2.679 -7.841 619 HA LEU 75 HA LEU 75 4.692 -5.339 -7.852 620 HB2 LEU 75 1HB LEU 75 5.922 -4.781 -5.663 621 HB3 LEU 75 2HB LEU 75 4.741 -3.494 -5.450 622 HG LEU 75 HG LEU 75 2.980 -5.475 -5.917 623 HD11 LEU 75 1HD1 LEU 75 4.699 -7.195 -6.385 624 HD12 LEU 75 2HD1 LEU 75 3.760 -7.608 -4.954 625 HD13 LEU 75 3HD1 LEU 75 5.382 -6.945 -4.779 626 HD21 LEU 75 3HD2 LEU 75 4.464 -5.048 -3.319 627 HD22 LEU 75 1HD2 LEU 75 2.935 -5.917 -3.448 628 HD23 LEU 75 2HD2 LEU 75 3.016 -4.201 -3.854 629 H GLN 76 H GLN 76 2.685 -5.226 -8.579 630 HA GLN 76 HA GLN 76 1.099 -2.742 -8.190 631 HB2 GLN 76 1HB GLN 76 2.026 -2.756 -10.509 632 HB3 GLN 76 2HB GLN 76 1.216 -4.298 -10.792 633 HG2 GLN 76 1HG GLN 76 -0.959 -3.300 -10.443 634 HG3 GLN 76 2HG GLN 76 -0.239 -1.783 -9.912 635 HE21 GLN 76 2HE2 GLN 76 -2.040 -1.747 -12.067 636 HE22 GLN 76 1HE2 GLN 76 -1.195 -1.411 -13.500 637 H TYR 77 H TYR 77 -0.970 -3.066 -7.626 638 HA TYR 77 HA TYR 77 -2.216 -5.688 -8.057 639 HB2 TYR 77 1HB TYR 77 -2.813 -5.937 -5.671 640 HB3 TYR 77 2HB TYR 77 -1.078 -6.052 -5.953 641 HD1 TYR 77 HD1 TYR 77 -3.801 -3.852 -4.713 642 HD2 TYR 77 HD2 TYR 77 0.447 -4.398 -5.048 643 HE1 TYR 77 HE1 TYR 77 -3.435 -2.008 -3.094 644 HE2 TYR 77 HE2 TYR 77 0.806 -2.563 -3.428 645 HH TYR 77 HH TYR 77 -1.502 -0.348 -2.604 646 H SER 78 H SER 78 -4.429 -5.750 -7.772 647 HA SER 78 HA SER 78 -5.776 -3.171 -8.149 648 HB2 SER 78 1HB SER 78 -7.788 -4.659 -8.519 649 HB3 SER 78 2HB SER 78 -6.463 -4.927 -9.647 650 HG SER 78 HG SER 78 -6.904 -6.924 -8.959 651 H HIS 79 H HIS 79 -7.505 -2.473 -6.752 652 HA HIS 79 HA HIS 79 -7.908 -3.953 -4.258 653 HB2 HIS 79 1HB HIS 79 -5.874 -2.533 -3.887 654 HB3 HIS 79 2HB HIS 79 -6.873 -1.105 -4.168 655 HD1 HIS 79 HD1 HIS 79 -7.522 -0.126 -1.966 656 HD2 HIS 79 HD2 HIS 79 -7.540 -4.292 -1.851 657 HE1 HIS 79 HE1 HIS 79 -8.361 -0.779 0.334 658 HE2 HIS 79 HE2 HIS 79 -8.379 -3.317 0.419 659 H PHE 80 H PHE 80 -9.773 -3.549 -3.253 660 HA PHE 80 HA PHE 80 -11.454 -1.283 -4.082 661 HB2 PHE 80 1HB PHE 80 -12.151 -2.950 -5.662 662 HB3 PHE 80 2HB PHE 80 -12.188 -4.200 -4.422 663 HD1 PHE 80 HD2 PHE 80 -13.609 -0.754 -4.957 664 HD2 PHE 80 HD1 PHE 80 -14.354 -4.773 -3.626 665 HE1 PHE 80 HE2 PHE 80 -15.960 -0.159 -4.472 666 HE2 PHE 80 HE1 PHE 80 -16.706 -4.170 -3.134 667 HZ PHE 80 HZ PHE 80 -17.510 -1.864 -3.558 668 H SER 81 H SER 81 -13.017 -0.727 -2.605 669 HA SER 81 HA SER 81 -12.895 -2.092 0.032 670 HB2 SER 81 1HB SER 81 -13.125 0.851 -0.562 671 HB3 SER 81 2HB SER 81 -13.324 0.143 1.037 672 HG SER 81 HG SER 81 -11.153 0.904 0.488 673 HA PRO 82 HA PRO 82 -17.314 -2.313 -0.980 674 HB2 PRO 82 1HB PRO 82 -18.156 -3.867 1.129 675 HB3 PRO 82 2HB PRO 82 -17.321 -4.533 -0.290 676 HG2 PRO 82 1HG PRO 82 -16.231 -3.906 2.425 677 HG3 PRO 82 2HG PRO 82 -15.867 -5.267 1.354 678 HD2 PRO 82 1HD PRO 82 -14.235 -3.051 1.617 679 HD3 PRO 82 2HD PRO 82 -14.264 -4.070 0.158 680 H LEU 83 H LEU 83 -15.871 -1.010 1.853 681 HA LEU 83 HA LEU 83 -18.181 -0.111 3.236 682 HB2 LEU 83 1HB LEU 83 -15.435 1.158 3.171 683 HB3 LEU 83 2HB LEU 83 -16.662 1.372 4.419 684 HG LEU 83 HG LEU 83 -15.346 -1.271 3.706 685 HD11 LEU 83 1HD1 LEU 83 -14.264 -0.972 5.958 686 HD12 LEU 83 2HD1 LEU 83 -14.900 0.671 5.998 687 HD13 LEU 83 3HD1 LEU 83 -13.736 0.204 4.756 688 HD21 LEU 83 3HD2 LEU 83 -17.456 -1.826 4.630 689 HD22 LEU 83 1HD2 LEU 83 -17.441 -0.464 5.750 690 HD23 LEU 83 2HD2 LEU 83 -16.397 -1.860 6.029 691 H THR 84 H THR 84 -16.865 0.809 0.268 692 HA THR 84 HA THR 84 -17.429 3.587 0.238 693 HB THR 84 HB THR 84 -17.438 3.307 -2.253 694 HG1 THR 84 HG1 THR 84 -16.596 0.733 -2.158 695 HG21 THR 84 3HG2 THR 84 -15.226 1.997 -0.651 696 HG22 THR 84 1HG2 THR 84 -15.320 3.680 -1.176 697 HG23 THR 84 2HG2 THR 84 -15.085 2.396 -2.363 698 H GLY 85 H GLY 85 -19.426 0.746 -0.317 699 HA2 GLY 85 1HA GLY 85 -21.715 0.512 -0.439 700 HA3 GLY 85 2HA GLY 85 -21.845 2.182 0.108 701 H LYS 86 H LYS 86 -19.832 2.142 -2.526 702 HA LYS 86 HA LYS 86 -21.905 3.265 -4.229 703 HB2 LYS 86 1HB LYS 86 -18.914 3.042 -4.522 704 HB3 LYS 86 2HB LYS 86 -19.954 3.795 -5.731 705 HG2 LYS 86 1HG LYS 86 -20.788 5.368 -3.992 706 HG3 LYS 86 2HG LYS 86 -19.665 4.654 -2.835 707 HD2 LYS 86 1HD LYS 86 -17.765 5.288 -4.260 708 HD3 LYS 86 2HD LYS 86 -18.874 5.976 -5.448 709 HE2 LYS 86 1HE LYS 86 -18.463 6.914 -2.596 710 HE3 LYS 86 2HE LYS 86 -18.016 7.779 -4.066 711 HZ1 LYS 86 3HZ LYS 86 -20.623 7.285 -4.474 712 HZ2 LYS 86 1HZ LYS 86 -20.012 8.728 -3.826 713 HZ3 LYS 86 2HZ LYS 86 -20.594 7.513 -2.792 714 HA PRO 87 HA PRO 87 -22.676 -0.302 -6.803 715 HB2 PRO 87 1HB PRO 87 -22.008 1.488 -9.146 716 HB3 PRO 87 2HB PRO 87 -23.418 0.434 -8.911 717 HG2 PRO 87 1HG PRO 87 -23.598 3.086 -8.600 718 HG3 PRO 87 2HG PRO 87 -24.502 1.970 -7.557 719 HD2 PRO 87 1HD PRO 87 -22.085 3.615 -6.890 720 HD3 PRO 87 2HD PRO 87 -23.404 3.044 -5.842 721 H ASP 88 H ASP 88 -21.417 -1.959 -7.624 722 HA ASP 88 HA ASP 88 -18.541 -1.643 -7.629 723 HB2 ASP 88 1HB ASP 88 -18.525 -4.069 -8.042 724 HB3 ASP 88 2HB ASP 88 -19.597 -3.658 -6.705 725 H LEU 89 H LEU 89 -18.471 -0.110 -9.449 726 HA LEU 89 HA LEU 89 -18.588 -1.469 -12.095 727 HB2 LEU 89 1HB LEU 89 -19.491 1.202 -11.202 728 HB3 LEU 89 2HB LEU 89 -18.532 1.268 -12.676 729 HG LEU 89 HG LEU 89 -20.050 -0.501 -13.658 730 HD11 LEU 89 1HD1 LEU 89 -21.594 0.047 -11.105 731 HD12 LEU 89 2HD1 LEU 89 -20.915 -1.498 -11.616 732 HD13 LEU 89 3HD1 LEU 89 -22.261 -0.790 -12.504 733 HD21 LEU 89 3HD2 LEU 89 -20.381 1.878 -14.170 734 HD22 LEU 89 1HD2 LEU 89 -21.356 2.070 -12.713 735 HD23 LEU 89 2HD2 LEU 89 -21.939 1.063 -14.037 736 HA PRO 90 HA PRO 90 -14.266 -1.082 -12.819 737 HB2 PRO 90 1HB PRO 90 -14.816 0.671 -15.211 738 HB3 PRO 90 2HB PRO 90 -13.842 -0.813 -15.106 739 HG2 PRO 90 1HG PRO 90 -16.272 -0.835 -16.208 740 HG3 PRO 90 2HG PRO 90 -15.701 -2.195 -15.220 741 HD2 PRO 90 1HD PRO 90 -17.685 -0.050 -14.501 742 HD3 PRO 90 2HD PRO 90 -17.624 -1.757 -14.016 743 H GLU 91 H GLU 91 -16.114 1.916 -13.006 744 HA GLU 91 HA GLU 91 -13.795 3.622 -12.479 745 HB2 GLU 91 1HB GLU 91 -16.753 4.252 -12.699 746 HB3 GLU 91 2HB GLU 91 -15.465 5.447 -12.544 747 HG2 GLU 91 1HG GLU 91 -15.633 3.416 -14.788 748 HG3 GLU 91 2HG GLU 91 -16.215 5.075 -14.914 749 H ASN 92 H ASN 92 -15.851 1.717 -10.663 750 HA ASN 92 HA ASN 92 -16.179 3.421 -8.361 751 HB2 ASN 92 1HB ASN 92 -17.692 1.509 -9.015 752 HB3 ASN 92 2HB ASN 92 -16.426 0.409 -8.477 753 HD21 ASN 92 2HD2 ASN 92 -17.519 -0.415 -6.616 754 HD22 ASN 92 1HD2 ASN 92 -17.930 0.557 -5.287 755 H TYR 93 H TYR 93 -13.536 1.684 -9.555 756 HA TYR 93 HA TYR 93 -12.104 2.016 -7.012 757 HB2 TYR 93 1HB TYR 93 -11.533 -0.216 -6.691 758 HB3 TYR 93 2HB TYR 93 -13.187 -0.351 -7.252 759 HD1 TYR 93 HD2 TYR 93 -12.734 0.160 -10.219 760 HD2 TYR 93 HD1 TYR 93 -10.624 -2.314 -7.410 761 HE1 TYR 93 HE2 TYR 93 -11.996 -1.306 -12.063 762 HE2 TYR 93 HE1 TYR 93 -9.890 -3.781 -9.264 763 HH TYR 93 HH TYR 93 -10.050 -4.222 -11.429 764 H HIS 94 H HIS 94 -9.746 1.322 -7.297 765 HA HIS 94 HA HIS 94 -8.717 1.898 -10.009 766 HB2 HIS 94 1HB HIS 94 -6.976 3.425 -8.802 767 HB3 HIS 94 2HB HIS 94 -8.571 4.071 -9.133 768 HD1 HIS 94 HD1 HIS 94 -9.028 5.557 -7.181 769 HD2 HIS 94 HD2 HIS 94 -7.571 1.839 -5.986 770 HE1 HIS 94 HE1 HIS 94 -9.151 5.524 -4.654 771 HE2 HIS 94 HE2 HIS 94 -8.268 3.257 -3.908 772 H VAL 95 H VAL 95 -6.401 1.545 -10.179 773 HA VAL 95 HA VAL 95 -5.538 -0.800 -8.562 774 HB VAL 95 HB VAL 95 -4.646 0.072 -11.323 775 HG11 VAL 95 1HG1 VAL 95 -3.649 -2.241 -11.333 776 HG12 VAL 95 2HG1 VAL 95 -4.031 -2.360 -9.616 777 HG13 VAL 95 3HG1 VAL 95 -2.883 -1.147 -10.184 778 HG21 VAL 95 3HG2 VAL 95 -5.936 -1.898 -12.083 779 HG22 VAL 95 1HG2 VAL 95 -6.985 -0.730 -11.280 780 HG23 VAL 95 2HG2 VAL 95 -6.472 -2.185 -10.427 781 H VAL 96 H VAL 96 -3.844 -0.600 -7.296 782 HA VAL 96 HA VAL 96 -2.321 1.918 -7.271 783 HB VAL 96 HB VAL 96 -2.188 -0.391 -5.317 784 HG11 VAL 96 1HG1 VAL 96 -1.309 1.387 -3.813 785 HG12 VAL 96 2HG1 VAL 96 -1.361 2.526 -5.157 786 HG13 VAL 96 3HG1 VAL 96 -0.273 1.140 -5.219 787 HG21 VAL 96 3HG2 VAL 96 -4.477 0.457 -5.410 788 HG22 VAL 96 1HG2 VAL 96 -3.895 2.120 -5.320 789 HG23 VAL 96 2HG2 VAL 96 -3.706 1.043 -3.936 790 H THR 97 H THR 97 -0.260 2.110 -7.850 791 HA THR 97 HA THR 97 1.360 -0.332 -8.368 792 HB THR 97 HB THR 97 0.567 0.405 -10.537 793 HG1 THR 97 HG1 THR 97 2.495 0.134 -11.281 794 HG21 THR 97 3HG2 THR 97 1.857 3.091 -10.023 795 HG22 THR 97 1HG2 THR 97 0.132 2.810 -9.775 796 HG23 THR 97 2HG2 THR 97 0.837 2.624 -11.380 797 H ILE 98 H ILE 98 3.194 -0.310 -7.349 798 HA ILE 98 HA ILE 98 4.363 2.279 -6.440 799 HB ILE 98 HB ILE 98 4.761 -0.454 -5.179 800 HG12 ILE 98 1HG1 ILE 98 3.251 0.919 -3.337 801 HG13 ILE 98 2HG1 ILE 98 2.571 1.597 -4.813 802 HG21 ILE 98 1HG2 ILE 98 5.681 0.842 -3.322 803 HG22 ILE 98 2HG2 ILE 98 5.301 2.352 -4.144 804 HG23 ILE 98 3HG2 ILE 98 6.527 1.276 -4.805 805 HD11 ILE 98 3HD1 ILE 98 2.731 -1.337 -4.053 806 HD12 ILE 98 1HD1 ILE 98 2.184 -0.764 -5.626 807 HD13 ILE 98 2HD1 ILE 98 1.275 -0.351 -4.176 808 H THR 99 H THR 99 6.309 2.784 -7.169 809 HA THR 99 HA THR 99 7.894 0.742 -8.652 810 HB THR 99 HB THR 99 8.118 3.762 -8.784 811 HG1 THR 99 HG1 THR 99 6.467 3.618 -10.048 812 HG21 THR 99 3HG2 THR 99 10.183 2.658 -9.409 813 HG22 THR 99 1HG2 THR 99 9.384 3.194 -10.886 814 HG23 THR 99 2HG2 THR 99 9.312 1.497 -10.413 815 H LEU 100 H LEU 100 9.605 -0.036 -7.650 816 HA LEU 100 HA LEU 100 10.984 1.623 -5.593 817 HB2 LEU 100 1HB LEU 100 9.889 -1.095 -5.473 818 HB3 LEU 100 2HB LEU 100 11.608 -1.121 -5.126 819 HG LEU 100 HG LEU 100 11.184 0.757 -3.440 820 HD11 LEU 100 1HD1 LEU 100 8.841 0.986 -2.650 821 HD12 LEU 100 2HD1 LEU 100 8.313 -0.055 -3.968 822 HD13 LEU 100 3HD1 LEU 100 9.014 1.525 -4.320 823 HD21 LEU 100 3HD2 LEU 100 11.367 -1.737 -2.875 824 HD22 LEU 100 1HD2 LEU 100 9.604 -1.743 -2.802 825 HD23 LEU 100 2HD2 LEU 100 10.530 -0.726 -1.709 826 H THR 101 H THR 101 12.943 2.200 -6.014 827 HA THR 101 HA THR 101 14.658 0.553 -7.801 828 HB THR 101 HB THR 101 15.560 2.692 -8.720 829 HG1 THR 101 HG1 THR 101 13.717 4.384 -8.311 830 HG21 THR 101 3HG2 THR 101 13.660 3.114 -10.206 831 HG22 THR 101 1HG2 THR 101 12.570 2.329 -9.061 832 HG23 THR 101 2HG2 THR 101 13.805 1.384 -9.893 833 H ALA 102 H ALA 102 16.628 0.191 -7.072 834 HA ALA 102 HA ALA 102 17.466 1.449 -4.520 835 HB1 ALA 102 3HB ALA 102 18.904 -0.458 -4.240 836 HB2 ALA 102 1HB ALA 102 18.587 -1.008 -5.887 837 HB3 ALA 102 2HB ALA 102 17.302 -1.044 -4.681 838 H LEU 103 H LEU 103 18.713 3.182 -4.813 839 HA LEU 103 HA LEU 103 20.337 3.568 -7.169 840 HB2 LEU 103 1HB LEU 103 20.313 5.184 -4.610 841 HB3 LEU 103 2HB LEU 103 20.898 5.699 -6.192 842 HG LEU 103 HG LEU 103 18.026 4.976 -5.516 843 HD11 LEU 103 1HD1 LEU 103 19.385 7.633 -6.047 844 HD12 LEU 103 2HD1 LEU 103 18.685 7.092 -4.522 845 HD13 LEU 103 3HD1 LEU 103 17.643 7.410 -5.908 846 HD21 LEU 103 3HD2 LEU 103 19.403 5.742 -8.110 847 HD22 LEU 103 1HD2 LEU 103 17.694 6.109 -7.859 848 HD23 LEU 103 2HD2 LEU 103 18.248 4.442 -7.810 849 H LYS 104 H LYS 104 22.614 4.709 -6.268 850 HA LYS 104 HA LYS 104 24.310 2.490 -5.846 851 HB2 LYS 104 1HB LYS 104 24.917 5.428 -5.480 852 HB3 LYS 104 2HB LYS 104 26.102 4.142 -5.715 853 HG2 LYS 104 1HG LYS 104 23.932 4.881 -7.712 854 HG3 LYS 104 2HG LYS 104 25.610 5.409 -7.811 855 HD2 LYS 104 1HD LYS 104 26.207 2.877 -7.760 856 HD3 LYS 104 2HD LYS 104 24.503 2.601 -8.123 857 HE2 LYS 104 1HE LYS 104 25.781 2.660 -10.205 858 HE3 LYS 104 2HE LYS 104 24.708 4.056 -10.126 859 HZ1 LYS 104 3HZ LYS 104 27.447 4.075 -10.471 860 HZ2 LYS 104 1HZ LYS 104 27.187 4.637 -8.893 861 HZ3 LYS 104 2HZ LYS 104 26.436 5.414 -10.203 862 H LYS 105 H LYS 105 23.394 5.093 -3.611 863 HA LYS 105 HA LYS 105 24.023 3.327 -1.317 864 HB2 LYS 105 1HB LYS 105 24.949 6.192 -1.655 865 HB3 LYS 105 2HB LYS 105 24.994 5.318 -0.124 866 HG2 LYS 105 1HG LYS 105 26.393 3.550 -1.265 867 HG3 LYS 105 2HG LYS 105 26.474 4.604 -2.674 868 HD2 LYS 105 1HD LYS 105 27.366 5.453 0.102 869 HD3 LYS 105 2HD LYS 105 28.456 4.770 -1.097 870 HE2 LYS 105 1HE LYS 105 27.689 6.641 -2.668 871 HE3 LYS 105 2HE LYS 105 26.936 7.382 -1.257 872 HZ1 LYS 105 3HZ LYS 105 29.647 7.408 -2.017 873 HZ2 LYS 105 1HZ LYS 105 29.503 6.639 -0.512 874 HZ3 LYS 105 2HZ LYS 105 28.897 8.213 -0.723 875 H GLY 106 H GLY 106 21.484 3.921 -2.483 876 HA2 GLY 106 1HA GLY 106 20.051 4.700 -0.171 877 HA3 GLY 106 2HA GLY 106 20.098 6.041 -1.310 878 H VAL 107 H VAL 107 17.677 5.012 -0.680 879 HA VAL 107 HA VAL 107 16.848 3.641 -3.186 880 HB VAL 107 HB VAL 107 16.885 1.933 -1.481 881 HG11 VAL 107 1HG1 VAL 107 15.224 3.856 0.171 882 HG12 VAL 107 2HG1 VAL 107 16.891 3.376 0.492 883 HG13 VAL 107 3HG1 VAL 107 15.593 2.191 0.615 884 HG21 VAL 107 3HG2 VAL 107 14.002 2.861 -1.741 885 HG22 VAL 107 1HG2 VAL 107 14.585 1.213 -1.534 886 HG23 VAL 107 2HG2 VAL 107 14.891 2.071 -3.043 887 H GLU 108 H GLU 108 14.948 4.272 -4.032 888 HA GLU 108 HA GLU 108 13.482 6.500 -2.702 889 HB2 GLU 108 1HB GLU 108 14.096 6.076 -5.640 890 HB3 GLU 108 2HB GLU 108 12.938 7.264 -5.039 891 HG2 GLU 108 1HG GLU 108 14.714 8.344 -3.717 892 HG3 GLU 108 2HG GLU 108 15.876 7.150 -4.290 893 H VAL 109 H VAL 109 11.310 6.437 -2.732 894 HA VAL 109 HA VAL 109 9.975 4.077 -3.965 895 HB VAL 109 HB VAL 109 8.614 3.806 -1.987 896 HG11 VAL 109 1HG1 VAL 109 10.396 3.125 -0.368 897 HG12 VAL 109 2HG1 VAL 109 11.579 3.961 -1.374 898 HG13 VAL 109 3HG1 VAL 109 10.701 2.575 -2.011 899 HG21 VAL 109 3HG2 VAL 109 10.192 6.173 -0.927 900 HG22 VAL 109 1HG2 VAL 109 9.208 5.126 0.094 901 HG23 VAL 109 2HG2 VAL 109 8.448 6.084 -1.173 902 H GLU 110 H GLU 110 7.859 4.378 -4.618 903 HA GLU 110 HA GLU 110 6.601 7.007 -4.356 904 HB2 GLU 110 1HB GLU 110 8.096 7.286 -6.299 905 HB3 GLU 110 2HB GLU 110 7.351 5.889 -7.072 906 HG2 GLU 110 1HG GLU 110 5.199 7.016 -7.163 907 HG3 GLU 110 2HG GLU 110 5.821 8.366 -6.218 908 H LEU 111 H LEU 111 4.469 6.855 -4.313 909 HA LEU 111 HA LEU 111 3.159 4.328 -5.192 910 HB2 LEU 111 1HB LEU 111 3.244 4.608 -2.731 911 HB3 LEU 111 2HB LEU 111 2.399 6.143 -2.880 912 HG LEU 111 HG LEU 111 1.019 3.878 -4.273 913 HD11 LEU 111 1HD1 LEU 111 1.244 3.869 -1.249 914 HD12 LEU 111 2HD1 LEU 111 1.850 2.625 -2.344 915 HD13 LEU 111 3HD1 LEU 111 0.115 2.899 -2.196 916 HD21 LEU 111 3HD2 LEU 111 0.048 6.169 -3.902 917 HD22 LEU 111 1HD2 LEU 111 0.033 5.832 -2.170 918 HD23 LEU 111 2HD2 LEU 111 -0.952 4.864 -3.265 919 H THR 112 H THR 112 1.568 4.529 -6.610 920 HA THR 112 HA THR 112 0.457 7.242 -7.161 921 HB THR 112 HB THR 112 0.775 5.047 -9.217 922 HG1 THR 112 HG1 THR 112 2.677 5.976 -9.779 923 HG21 THR 112 3HG2 THR 112 0.480 8.046 -9.469 924 HG22 THR 112 1HG2 THR 112 -0.857 6.904 -9.609 925 HG23 THR 112 2HG2 THR 112 0.458 6.869 -10.783 926 H GLN 113 H GLN 113 -1.670 7.457 -7.480 927 HA GLN 113 HA GLN 113 -3.435 5.093 -7.545 928 HB2 GLN 113 1HB GLN 113 -3.100 5.726 -5.134 929 HB3 GLN 113 2HB GLN 113 -3.802 7.299 -5.500 930 HG2 GLN 113 1HG GLN 113 -5.872 6.160 -6.298 931 HG3 GLN 113 2HG GLN 113 -5.162 4.612 -5.849 932 HE21 GLN 113 2HE2 GLN 113 -7.329 6.815 -4.729 933 HE22 GLN 113 1HE2 GLN 113 -7.120 6.614 -3.056 934 H ASP 114 H ASP 114 -5.222 5.419 -8.756 935 HA ASP 114 HA ASP 114 -5.728 8.165 -9.808 936 HB2 ASP 114 1HB ASP 114 -6.596 6.968 -11.838 937 HB3 ASP 114 2HB ASP 114 -4.868 6.777 -11.558 938 H ASN 115 H ASN 115 -8.005 7.888 -11.067 939 HA ASN 115 HA ASN 115 -10.267 7.936 -10.906 940 HB2 ASN 115 1HB ASN 115 -9.936 5.478 -10.479 941 HB3 ASN 115 2HB ASN 115 -10.045 5.834 -8.753 942 HD21 ASN 115 2HD2 ASN 115 -12.084 4.795 -8.402 943 HD22 ASN 115 1HD2 ASN 115 -13.523 5.363 -9.095 944 H ASN 116 H ASN 116 -8.861 9.857 -9.310 945 HA ASN 116 HA ASN 116 -10.331 10.015 -6.772 946 HB2 ASN 116 1HB ASN 116 -8.375 11.893 -8.134 947 HB3 ASN 116 2HB ASN 116 -9.158 12.244 -6.596 948 HD21 ASN 116 2HD2 ASN 116 -6.272 11.882 -6.957 949 HD22 ASN 116 1HD2 ASN 116 -5.828 10.527 -6.033 950 H GLU 117 H GLU 117 -12.412 10.722 -6.814 951 HA GLU 117 HA GLU 117 -13.675 11.766 -9.083 952 HB2 GLU 117 1HB GLU 117 -14.839 10.661 -7.181 953 HB3 GLU 117 2HB GLU 117 -14.580 12.115 -6.217 954 HG2 GLU 117 1HG GLU 117 -15.869 13.443 -7.821 955 HG3 GLU 117 2HG GLU 117 -16.054 12.039 -8.869 956 H THR 118 H THR 118 -12.166 13.463 -6.370 957 HA THR 118 HA THR 118 -12.296 15.972 -7.944 958 HB THR 118 HB THR 118 -13.058 17.267 -6.075 959 HG1 THR 118 HG1 THR 118 -12.334 16.433 -4.269 960 HG21 THR 118 3HG2 THR 118 -14.776 14.777 -6.155 961 HG22 THR 118 1HG2 THR 118 -14.772 15.996 -7.431 962 HG23 THR 118 2HG2 THR 118 -15.298 16.424 -5.803 963 H GLU 119 H GLU 119 -10.824 17.629 -7.115 964 HA GLU 119 HA GLU 119 -8.219 16.611 -6.678 965 HB2 GLU 119 1HB GLU 119 -8.741 18.822 -7.737 966 HB3 GLU 119 2HB GLU 119 -9.210 19.425 -6.148 967 HG2 GLU 119 1HG GLU 119 -6.951 18.967 -5.288 968 HG3 GLU 119 2HG GLU 119 -6.478 18.308 -6.853 969 H LYS 120 H LYS 120 -10.724 17.822 -4.555 970 HA LYS 120 HA LYS 120 -9.253 18.115 -2.187 971 HB2 LYS 120 1HB LYS 120 -12.138 17.285 -2.615 972 HB3 LYS 120 2HB LYS 120 -11.453 17.689 -1.039 973 HG2 LYS 120 1HG LYS 120 -10.872 19.935 -1.848 974 HG3 LYS 120 2HG LYS 120 -11.510 19.539 -3.444 975 HD2 LYS 120 1HD LYS 120 -13.740 19.125 -2.414 976 HD3 LYS 120 2HD LYS 120 -13.086 19.630 -0.855 977 HE2 LYS 120 1HE LYS 120 -13.083 21.366 -3.342 978 HE3 LYS 120 2HE LYS 120 -14.299 21.463 -2.068 979 HZ1 LYS 120 3HZ LYS 120 -11.590 21.534 -1.098 980 HZ2 LYS 120 1HZ LYS 120 -12.906 22.536 -0.718 981 HZ3 LYS 120 2HZ LYS 120 -11.981 22.843 -2.109 982 H GLU 121 H GLU 121 -10.729 15.260 -3.668 983 HA GLU 121 HA GLU 121 -10.136 13.482 -1.510 984 HB2 GLU 121 1HB GLU 121 -10.811 12.984 -4.418 985 HB3 GLU 121 2HB GLU 121 -10.620 11.702 -3.220 986 HG2 GLU 121 1HG GLU 121 -12.415 12.652 -1.864 987 HG3 GLU 121 2HG GLU 121 -12.578 14.004 -2.981 988 H GLN 122 H GLN 122 -8.446 14.474 -4.437 989 HA GLN 122 HA GLN 122 -6.423 12.502 -4.422 990 HB2 GLN 122 1HB GLN 122 -6.870 14.091 -6.316 991 HB3 GLN 122 2HB GLN 122 -6.168 15.382 -5.343 992 HG2 GLN 122 1HG GLN 122 -4.043 14.062 -5.199 993 HG3 GLN 122 2HG GLN 122 -4.757 12.860 -6.271 994 HE21 GLN 122 2HE2 GLN 122 -3.608 13.191 -8.205 995 HE22 GLN 122 1HE2 GLN 122 -3.493 14.683 -9.002 996 H LYS 123 H LYS 123 -6.582 15.753 -3.020 997 HA LYS 123 HA LYS 123 -4.051 15.761 -1.806 998 HB2 LYS 123 1HB LYS 123 -5.514 17.775 -2.077 999 HB3 LYS 123 2HB LYS 123 -6.585 17.121 -0.847 1000 HG2 LYS 123 1HG LYS 123 -5.162 18.737 0.225 1001 HG3 LYS 123 2HG LYS 123 -4.639 17.149 0.771 1002 HD2 LYS 123 1HD LYS 123 -2.701 17.191 -0.645 1003 HD3 LYS 123 2HD LYS 123 -3.316 18.567 -1.562 1004 HE2 LYS 123 1HE LYS 123 -2.628 18.664 1.391 1005 HE3 LYS 123 2HE LYS 123 -1.526 19.162 0.107 1006 HZ1 LYS 123 3HZ LYS 123 -3.758 20.550 1.220 1007 HZ2 LYS 123 1HZ LYS 123 -3.877 20.429 -0.468 1008 HZ3 LYS 123 2HZ LYS 123 -2.502 21.137 0.235 1009 H HIS 124 H HIS 124 -7.213 14.693 -0.676 1010 HA HIS 124 HA HIS 124 -6.535 13.994 1.960 1011 HB2 HIS 124 1HB HIS 124 -8.857 14.191 1.062 1012 HB3 HIS 124 2HB HIS 124 -8.594 12.709 0.149 1013 HD1 HIS 124 HD1 HIS 124 -8.379 13.857 3.787 1014 HD2 HIS 124 HD2 HIS 124 -9.298 10.461 1.550 1015 HE1 HIS 124 HE1 HIS 124 -9.160 12.101 5.439 1016 HE2 HIS 124 HE2 HIS 124 -9.724 10.025 4.088 1017 H SER 125 H SER 125 -6.342 12.263 -1.096 1018 HA SER 125 HA SER 125 -5.590 9.736 -0.008 1019 HB2 SER 125 1HB SER 125 -6.487 10.026 -2.310 1020 HB3 SER 125 2HB SER 125 -5.006 10.868 -2.756 1021 HG SER 125 HG SER 125 -4.356 8.905 -3.186 1022 H GLU 126 H GLU 126 -3.713 12.316 -1.590 1023 HA GLU 126 HA GLU 126 -1.156 11.250 -1.238 1024 HB2 GLU 126 1HB GLU 126 -2.088 14.135 -1.293 1025 HB3 GLU 126 2HB GLU 126 -0.394 13.651 -1.359 1026 HG2 GLU 126 1HG GLU 126 -0.774 12.408 -3.408 1027 HG3 GLU 126 2HG GLU 126 -2.504 12.727 -3.327 1028 H ASP 127 H ASP 127 -3.041 13.370 0.905 1029 HA ASP 127 HA ASP 127 -1.098 13.635 2.936 1030 HB2 ASP 127 1HB ASP 127 -3.096 15.079 2.758 1031 HB3 ASP 127 2HB ASP 127 -4.118 13.704 3.169 1032 H ASN 128 H ASN 128 -3.673 11.269 2.386 1033 HA ASN 128 HA ASN 128 -3.353 9.855 4.826 1034 HB2 ASN 128 1HB ASN 128 -5.366 9.637 3.439 1035 HB3 ASN 128 2HB ASN 128 -4.409 8.913 2.149 1036 HD21 ASN 128 2HD2 ASN 128 -4.882 6.711 2.124 1037 HD22 ASN 128 1HD2 ASN 128 -4.972 5.722 3.501 1038 H TRP 129 H TRP 129 -2.179 9.191 1.531 1039 HA TRP 129 HA TRP 129 -0.661 6.922 2.225 1040 HB2 TRP 129 1HB TRP 129 -0.452 8.863 -0.096 1041 HB3 TRP 129 2HB TRP 129 0.605 7.458 0.059 1042 HD1 TRP 129 HD1 TRP 129 -2.621 8.406 -1.393 1043 HE1 TRP 129 HE1 TRP 129 -4.065 6.329 -1.905 1044 HE3 TRP 129 HE3 TRP 129 -0.013 4.858 1.194 1045 HZ2 TRP 129 HZ2 TRP 129 -4.109 3.534 -1.290 1046 HZ3 TRP 129 HZ3 TRP 129 -0.773 2.502 1.214 1047 HH2 TRP 129 HH2 TRP 129 -2.815 1.833 -0.025 1048 H ASN 130 H ASN 130 0.089 10.368 2.284 1049 HA ASN 130 HA ASN 130 2.867 10.157 2.709 1050 HB2 ASN 130 1HB ASN 130 0.830 12.223 3.584 1051 HB3 ASN 130 2HB ASN 130 2.549 12.394 3.936 1052 HD21 ASN 130 2HD2 ASN 130 2.232 10.735 1.011 1053 HD22 ASN 130 1HD2 ASN 130 2.405 12.054 -0.042 1054 H THR 131 H THR 131 0.107 10.025 4.909 1055 HA THR 131 HA THR 131 1.575 9.862 7.325 1056 HB THR 131 HB THR 131 -1.128 8.607 6.772 1057 HG1 THR 131 HG1 THR 131 -1.201 10.731 6.120 1058 HG21 THR 131 3HG2 THR 131 -1.479 9.074 9.173 1059 HG22 THR 131 1HG2 THR 131 0.157 9.723 9.282 1060 HG23 THR 131 2HG2 THR 131 -0.090 8.015 8.921 1061 H MET 132 H MET 132 0.333 7.435 5.075 1062 HA MET 132 HA MET 132 1.094 5.139 6.534 1063 HB2 MET 132 1HB MET 132 0.852 5.565 3.547 1064 HB3 MET 132 2HB MET 132 1.043 3.993 4.315 1065 HG2 MET 132 1HG MET 132 -1.201 5.909 4.979 1066 HG3 MET 132 2HG MET 132 -1.345 4.625 3.785 1067 HE1 MET 132 3HE MET 132 -0.226 2.027 4.663 1068 HE2 MET 132 1HE MET 132 -1.903 2.338 4.196 1069 HE3 MET 132 2HE MET 132 -1.547 1.401 5.641 1070 H LEU 133 H LEU 133 2.761 6.903 3.931 1071 HA LEU 133 HA LEU 133 5.134 5.372 4.007 1072 HB2 LEU 133 1HB LEU 133 4.378 8.070 2.928 1073 HB3 LEU 133 2HB LEU 133 6.090 7.734 3.089 1074 HG LEU 133 HG LEU 133 5.038 7.197 0.816 1075 HD11 LEU 133 1HD1 LEU 133 6.455 5.349 0.435 1076 HD12 LEU 133 2HD1 LEU 133 6.287 4.743 2.077 1077 HD13 LEU 133 3HD1 LEU 133 7.221 6.203 1.768 1078 HD21 LEU 133 3HD2 LEU 133 3.998 4.660 2.099 1079 HD22 LEU 133 1HD2 LEU 133 3.632 5.344 0.520 1080 HD23 LEU 133 2HD2 LEU 133 2.981 6.087 1.970 1081 H GLU 134 H GLU 134 4.127 8.265 5.765 1082 HA GLU 134 HA GLU 134 6.576 8.762 7.080 1083 HB2 GLU 134 1HB GLU 134 4.602 10.331 6.958 1084 HB3 GLU 134 2HB GLU 134 3.778 9.309 8.131 1085 HG2 GLU 134 1HG GLU 134 6.506 10.535 8.665 1086 HG3 GLU 134 2HG GLU 134 5.004 11.355 9.077 1087 H GLY 135 H GLY 135 3.741 6.814 7.942 1088 HA2 GLY 135 1HA GLY 135 4.722 5.922 10.459 1089 HA3 GLY 135 2HA GLY 135 3.419 5.182 9.530 1090 H LEU 136 H LEU 136 4.809 4.582 7.181 1091 HA LEU 136 HA LEU 136 5.996 2.097 7.826 1092 HB2 LEU 136 1HB LEU 136 4.908 2.974 5.594 1093 HB3 LEU 136 2HB LEU 136 6.535 3.506 5.199 1094 HG LEU 136 HG LEU 136 5.699 0.673 5.895 1095 HD11 LEU 136 1HD1 LEU 136 4.956 1.512 3.662 1096 HD12 LEU 136 2HD1 LEU 136 6.107 0.183 3.546 1097 HD13 LEU 136 3HD1 LEU 136 6.641 1.839 3.259 1098 HD21 LEU 136 3HD2 LEU 136 8.402 1.918 5.347 1099 HD22 LEU 136 1HD2 LEU 136 8.107 0.219 4.968 1100 HD23 LEU 136 2HD2 LEU 136 7.932 0.790 6.619 1101 H LYS 137 H LYS 137 7.451 5.140 6.689 1102 HA LYS 137 HA LYS 137 10.134 4.262 6.797 1103 HB2 LYS 137 1HB LYS 137 8.741 6.906 6.586 1104 HB3 LYS 137 2HB LYS 137 10.414 6.953 7.115 1105 HG2 LYS 137 1HG LYS 137 10.301 7.177 4.694 1106 HG3 LYS 137 2HG LYS 137 11.088 5.658 5.115 1107 HD2 LYS 137 1HD LYS 137 8.832 4.525 4.774 1108 HD3 LYS 137 2HD LYS 137 8.242 6.062 4.151 1109 HE2 LYS 137 1HE LYS 137 10.643 4.610 3.022 1110 HE3 LYS 137 2HE LYS 137 9.009 4.454 2.380 1111 HZ1 LYS 137 3HZ LYS 137 10.111 7.139 2.771 1112 HZ2 LYS 137 1HZ LYS 137 9.002 6.587 1.616 1113 HZ3 LYS 137 2HZ LYS 137 10.652 6.230 1.441 1114 H LYS 138 H LYS 138 8.031 5.714 9.235 1115 HA LYS 138 HA LYS 138 9.873 6.371 11.195 1116 HB2 LYS 138 1HB LYS 138 7.421 6.817 11.302 1117 HB3 LYS 138 2HB LYS 138 7.161 5.109 11.661 1118 HG2 LYS 138 1HG LYS 138 8.495 5.292 13.698 1119 HG3 LYS 138 2HG LYS 138 8.892 6.968 13.318 1120 HD2 LYS 138 1HD LYS 138 6.503 7.563 13.455 1121 HD3 LYS 138 2HD LYS 138 6.108 5.888 13.839 1122 HE2 LYS 138 1HE LYS 138 6.233 7.158 15.912 1123 HE3 LYS 138 2HE LYS 138 7.598 6.045 15.841 1124 HZ1 LYS 138 3HZ LYS 138 7.879 8.610 16.384 1125 HZ2 LYS 138 1HZ LYS 138 7.996 8.694 14.693 1126 HZ3 LYS 138 2HZ LYS 138 9.072 7.716 15.570 1127 H PHE 139 H PHE 139 8.606 3.192 10.325 1128 HA PHE 139 HA PHE 139 9.614 1.783 12.568 1129 HB2 PHE 139 1HB PHE 139 7.902 0.872 11.047 1130 HB3 PHE 139 2HB PHE 139 9.100 0.785 9.755 1131 HD1 PHE 139 HD1 PHE 139 8.202 -0.484 13.128 1132 HD2 PHE 139 HD2 PHE 139 10.710 -1.023 9.680 1133 HE1 PHE 139 HE1 PHE 139 8.938 -2.681 14.006 1134 HE2 PHE 139 HE2 PHE 139 11.446 -3.223 10.561 1135 HZ PHE 139 HZ PHE 139 10.560 -4.051 12.724 1136 H LEU 140 H LEU 140 10.915 2.206 9.277 1137 HA LEU 140 HA LEU 140 13.359 0.855 9.786 1138 HB2 LEU 140 1HB LEU 140 12.354 2.702 7.635 1139 HB3 LEU 140 2HB LEU 140 14.059 2.262 7.648 1140 HG LEU 140 HG LEU 140 11.954 0.078 7.815 1141 HD11 LEU 140 1HD1 LEU 140 12.938 1.440 5.300 1142 HD12 LEU 140 2HD1 LEU 140 11.274 1.379 5.883 1143 HD13 LEU 140 3HD1 LEU 140 12.069 -0.097 5.334 1144 HD21 LEU 140 3HD2 LEU 140 13.696 -1.257 6.775 1145 HD22 LEU 140 1HD2 LEU 140 14.405 -0.431 8.157 1146 HD23 LEU 140 2HD2 LEU 140 14.704 0.162 6.526 1147 H GLU 141 H GLU 141 12.437 4.264 9.908 1148 HA GLU 141 HA GLU 141 15.058 5.260 10.425 1149 HB2 GLU 141 1HB GLU 141 12.329 6.452 10.992 1150 HB3 GLU 141 2HB GLU 141 13.852 7.323 11.162 1151 HG2 GLU 141 1HG GLU 141 12.932 6.019 8.586 1152 HG3 GLU 141 2HG GLU 141 12.698 7.723 8.962 1153 H ASN 142 H ASN 142 12.753 3.621 12.329 1154 HA ASN 142 HA ASN 142 13.077 4.575 14.889 1155 HB2 ASN 142 1HB ASN 142 11.613 2.648 14.136 1156 HB3 ASN 142 2HB ASN 142 13.050 1.629 14.186 1157 HD21 ASN 142 2HD2 ASN 142 11.337 0.645 15.903 1158 HD22 ASN 142 1HD2 ASN 142 11.595 1.154 17.502 1159 H LYS 143 H LYS 143 15.351 2.743 12.956 1160 HA LYS 143 HA LYS 143 17.111 1.713 14.777 1161 HB2 LYS 143 1HB LYS 143 18.868 2.009 13.095 1162 HB3 LYS 143 2HB LYS 143 17.368 1.474 12.343 1163 HG2 LYS 143 1HG LYS 143 16.863 3.857 11.762 1164 HG3 LYS 143 2HG LYS 143 18.441 4.313 12.406 1165 HD2 LYS 143 1HD LYS 143 19.545 2.807 10.789 1166 HD3 LYS 143 2HD LYS 143 17.969 2.356 10.136 1167 HE2 LYS 143 1HE LYS 143 17.557 4.704 9.495 1168 HE3 LYS 143 2HE LYS 143 19.128 5.160 10.149 1169 HZ1 LYS 143 3HZ LYS 143 19.606 4.847 7.939 1170 HZ2 LYS 143 1HZ LYS 143 18.507 3.568 7.755 1171 HZ3 LYS 143 2HZ LYS 143 19.977 3.312 8.567 1172 H VAL 144 H VAL 144 16.515 5.071 14.135 1173 HA VAL 144 HA VAL 144 18.890 6.199 15.131 1174 HB VAL 144 HB VAL 144 17.119 7.458 13.908 1175 HG11 VAL 144 1HG1 VAL 144 15.634 7.515 16.551 1176 HG12 VAL 144 2HG1 VAL 144 15.211 6.413 15.244 1177 HG13 VAL 144 3HG1 VAL 144 15.100 8.154 14.997 1178 HG21 VAL 144 3HG2 VAL 144 17.774 8.592 16.646 1179 HG22 VAL 144 1HG2 VAL 144 17.370 9.518 15.201 1180 HG23 VAL 144 2HG2 VAL 144 18.873 8.598 15.268 1181 H SER 145 H SER 145 15.914 5.224 16.800 1182 HA SER 145 HA SER 145 16.586 6.180 19.367 1183 HB2 SER 145 1HB SER 145 14.913 4.558 20.188 1184 HB3 SER 145 2HB SER 145 14.316 5.464 18.803 1185 HG SER 145 HG SER 145 15.131 2.788 18.998 1186 H ALA 146 H ALA 146 17.375 3.215 17.673 1187 HA ALA 146 HA ALA 146 18.516 1.852 19.928 1188 HB1 ALA 146 3HB ALA 146 17.639 0.683 17.916 1189 HB2 ALA 146 1HB ALA 146 19.309 0.244 18.278 1190 HB3 ALA 146 2HB ALA 146 18.958 1.373 16.970 Start of MODEL 10 1 H1 MET 1 1H MET 1 -12.294 14.261 -21.316 2 H2 MET 1 2H MET 1 -12.392 12.622 -21.758 3 H3 MET 1 3H MET 1 -10.921 13.459 -21.907 4 HA MET 1 HA MET 1 -10.506 13.455 -19.657 5 HB2 MET 1 1HB MET 1 -12.783 14.402 -19.135 6 HB3 MET 1 2HB MET 1 -13.426 12.763 -19.207 7 HG2 MET 1 1HG MET 1 -11.864 12.082 -17.405 8 HG3 MET 1 2HG MET 1 -11.251 13.733 -17.326 9 HE1 MET 1 3HE MET 1 -14.625 11.716 -17.409 10 HE2 MET 1 1HE MET 1 -15.190 12.044 -15.764 11 HE3 MET 1 2HE MET 1 -13.657 11.216 -16.025 12 H GLU 2 H GLU 2 -9.431 11.627 -20.789 13 HA GLU 2 HA GLU 2 -10.581 9.033 -20.887 14 HB2 GLU 2 1HB GLU 2 -7.702 9.974 -20.892 15 HB3 GLU 2 2HB GLU 2 -8.174 8.292 -21.132 16 HG2 GLU 2 1HG GLU 2 -7.901 9.275 -23.314 17 HG3 GLU 2 2HG GLU 2 -9.629 9.061 -23.057 18 H ILE 3 H ILE 3 -8.435 10.595 -18.509 19 HA ILE 3 HA ILE 3 -9.352 8.650 -16.475 20 HB ILE 3 HB ILE 3 -7.039 8.460 -15.607 21 HG12 ILE 3 1HG1 ILE 3 -6.197 9.731 -18.240 22 HG13 ILE 3 2HG1 ILE 3 -6.216 10.605 -16.711 23 HG21 ILE 3 1HG2 ILE 3 -8.051 6.781 -17.188 24 HG22 ILE 3 2HG2 ILE 3 -6.290 6.850 -17.252 25 HG23 ILE 3 3HG2 ILE 3 -7.249 7.621 -18.515 26 HD11 ILE 3 3HD1 ILE 3 -4.625 8.092 -17.282 27 HD12 ILE 3 1HD1 ILE 3 -4.674 8.941 -15.737 28 HD13 ILE 3 2HD1 ILE 3 -3.970 9.724 -17.151 29 H LYS 4 H LYS 4 -9.362 9.410 -14.371 30 HA LYS 4 HA LYS 4 -9.671 12.265 -14.091 31 HB2 LYS 4 1HB LYS 4 -9.826 9.999 -12.091 32 HB3 LYS 4 2HB LYS 4 -10.214 11.679 -11.720 33 HG2 LYS 4 1HG LYS 4 -11.970 11.679 -13.441 34 HG3 LYS 4 2HG LYS 4 -11.566 10.013 -13.865 35 HD2 LYS 4 1HD LYS 4 -12.127 9.305 -11.556 36 HD3 LYS 4 2HD LYS 4 -12.579 10.966 -11.173 37 HE2 LYS 4 1HE LYS 4 -13.855 9.347 -13.398 38 HE3 LYS 4 2HE LYS 4 -14.529 9.490 -11.773 39 HZ1 LYS 4 3HZ LYS 4 -14.585 11.899 -12.060 40 HZ2 LYS 4 1HZ LYS 4 -15.520 11.110 -13.236 41 HZ3 LYS 4 2HZ LYS 4 -13.992 11.732 -13.644 42 H LEU 5 H LEU 5 -8.743 12.751 -11.537 43 HA LEU 5 HA LEU 5 -6.015 13.422 -12.017 44 HB2 LEU 5 1HB LEU 5 -7.870 13.638 -9.649 45 HB3 LEU 5 2HB LEU 5 -6.169 14.055 -9.479 46 HG LEU 5 HG LEU 5 -6.380 15.722 -11.275 47 HD11 LEU 5 1HD1 LEU 5 -8.036 14.793 -12.722 48 HD12 LEU 5 2HD1 LEU 5 -8.770 16.249 -12.057 49 HD13 LEU 5 3HD1 LEU 5 -9.219 14.667 -11.418 50 HD21 LEU 5 3HD2 LEU 5 -7.805 17.307 -10.071 51 HD22 LEU 5 1HD2 LEU 5 -6.898 16.331 -8.914 52 HD23 LEU 5 2HD2 LEU 5 -8.600 15.983 -9.220 53 H ILE 6 H ILE 6 -4.152 12.547 -11.308 54 HA ILE 6 HA ILE 6 -4.273 9.880 -9.977 55 HB ILE 6 HB ILE 6 -2.011 11.034 -11.634 56 HG12 ILE 6 1HG1 ILE 6 -3.963 10.890 -13.069 57 HG13 ILE 6 2HG1 ILE 6 -2.883 9.559 -13.453 58 HG21 ILE 6 1HG2 ILE 6 -1.352 8.646 -11.791 59 HG22 ILE 6 2HG2 ILE 6 -2.697 8.215 -10.736 60 HG23 ILE 6 3HG2 ILE 6 -1.379 9.208 -10.120 61 HD11 ILE 6 3HD1 ILE 6 -4.344 8.192 -11.788 62 HD12 ILE 6 1HD1 ILE 6 -4.993 8.536 -13.380 63 HD13 ILE 6 2HD1 ILE 6 -5.516 9.482 -11.994 64 H ALA 7 H ALA 7 -3.522 9.757 -7.961 65 HA ALA 7 HA ALA 7 -2.248 11.984 -6.655 66 HB1 ALA 7 3HB ALA 7 -2.096 10.352 -4.722 67 HB2 ALA 7 1HB ALA 7 -2.834 9.149 -5.781 68 HB3 ALA 7 2HB ALA 7 -3.720 10.610 -5.352 69 H GLN 8 H GLN 8 -0.133 12.311 -6.211 70 HA GLN 8 HA GLN 8 1.848 10.197 -6.903 71 HB2 GLN 8 1HB GLN 8 2.046 13.143 -7.596 72 HB3 GLN 8 2HB GLN 8 3.283 11.922 -7.895 73 HG2 GLN 8 1HG GLN 8 0.471 11.792 -9.025 74 HG3 GLN 8 2HG GLN 8 1.858 12.431 -9.902 75 HE21 GLN 8 2HE2 GLN 8 3.881 10.658 -9.440 76 HE22 GLN 8 1HE2 GLN 8 3.446 9.091 -9.919 77 H VAL 9 H VAL 9 3.022 9.727 -5.191 78 HA VAL 9 HA VAL 9 4.019 11.861 -3.410 79 HB VAL 9 HB VAL 9 3.442 10.515 -1.403 80 HG11 VAL 9 1HG1 VAL 9 1.028 11.157 -3.112 81 HG12 VAL 9 2HG1 VAL 9 1.975 12.367 -2.250 82 HG13 VAL 9 3HG1 VAL 9 1.094 11.131 -1.353 83 HG21 VAL 9 3HG2 VAL 9 1.931 8.845 -3.437 84 HG22 VAL 9 1HG2 VAL 9 1.697 8.728 -1.694 85 HG23 VAL 9 2HG2 VAL 9 3.252 8.301 -2.401 86 H LYS 10 H LYS 10 6.075 11.522 -2.747 87 HA LYS 10 HA LYS 10 7.247 8.842 -2.788 88 HB2 LYS 10 1HB LYS 10 9.146 9.606 -4.227 89 HB3 LYS 10 2HB LYS 10 7.599 9.521 -5.073 90 HG2 LYS 10 1HG LYS 10 7.295 11.924 -4.871 91 HG3 LYS 10 2HG LYS 10 8.731 12.061 -3.863 92 HD2 LYS 10 1HD LYS 10 9.323 12.733 -6.110 93 HD3 LYS 10 2HD LYS 10 10.104 11.193 -5.764 94 HE2 LYS 10 1HE LYS 10 8.598 9.993 -7.155 95 HE3 LYS 10 2HE LYS 10 7.417 11.307 -7.166 96 HZ1 LYS 10 3HZ LYS 10 10.082 11.907 -8.189 97 HZ2 LYS 10 1HZ LYS 10 8.566 12.450 -8.723 98 HZ3 LYS 10 2HZ LYS 10 9.105 10.895 -9.145 99 H THR 11 H THR 11 9.160 8.660 -1.593 100 HA THR 11 HA THR 11 10.245 11.050 -0.270 101 HB THR 11 HB THR 11 8.536 10.443 1.299 102 HG1 THR 11 HG1 THR 11 10.639 9.084 2.473 103 HG21 THR 11 3HG2 THR 11 9.613 7.624 1.024 104 HG22 THR 11 1HG2 THR 11 8.031 8.202 0.502 105 HG23 THR 11 2HG2 THR 11 8.418 8.127 2.221 106 H VAL 12 H VAL 12 12.332 10.846 0.393 107 HA VAL 12 HA VAL 12 13.838 8.593 -0.698 108 HB VAL 12 HB VAL 12 14.888 10.996 0.825 109 HG11 VAL 12 1HG1 VAL 12 16.160 9.092 -1.170 110 HG12 VAL 12 2HG1 VAL 12 16.477 9.130 0.564 111 HG13 VAL 12 3HG1 VAL 12 16.951 10.494 -0.449 112 HG21 VAL 12 3HG2 VAL 12 13.533 11.729 -1.105 113 HG22 VAL 12 1HG2 VAL 12 14.425 10.627 -2.154 114 HG23 VAL 12 2HG2 VAL 12 15.248 11.996 -1.410 115 H ILE 13 H ILE 13 14.033 6.802 0.468 116 HA ILE 13 HA ILE 13 14.270 6.989 3.434 117 HB ILE 13 HB ILE 13 13.537 4.538 1.809 118 HG12 ILE 13 1HG1 ILE 13 11.817 6.205 1.413 119 HG13 ILE 13 2HG1 ILE 13 11.196 5.011 2.546 120 HG21 ILE 13 1HG2 ILE 13 14.409 4.086 4.058 121 HG22 ILE 13 2HG2 ILE 13 12.678 3.753 4.000 122 HG23 ILE 13 3HG2 ILE 13 13.266 5.237 4.753 123 HD11 ILE 13 3HD1 ILE 13 12.003 6.673 4.393 124 HD12 ILE 13 1HD1 ILE 13 10.543 7.059 3.494 125 HD13 ILE 13 2HD1 ILE 13 12.061 7.844 3.083 126 H ASN 14 H ASN 14 16.154 6.516 4.317 127 HA ASN 14 HA ASN 14 18.298 5.355 2.659 128 HB2 ASN 14 1HB ASN 14 18.273 6.671 5.388 129 HB3 ASN 14 2HB ASN 14 19.715 5.956 4.668 130 HD21 ASN 14 2HD2 ASN 14 19.490 8.794 5.243 131 HD22 ASN 14 1HD2 ASN 14 19.521 9.616 3.762 132 H ALA 15 H ALA 15 17.794 3.188 2.551 133 HA ALA 15 HA ALA 15 18.633 1.600 4.735 134 HB1 ALA 15 3HB ALA 15 16.040 2.387 5.116 135 HB2 ALA 15 1HB ALA 15 16.687 0.873 5.735 136 HB3 ALA 15 2HB ALA 15 15.771 0.891 4.231 137 HA PRO 16 HA PRO 16 19.176 -1.476 1.612 138 HB2 PRO 16 1HB PRO 16 17.685 -3.556 3.157 139 HB3 PRO 16 2HB PRO 16 19.374 -3.563 2.621 140 HG2 PRO 16 1HG PRO 16 18.750 -3.196 5.185 141 HG3 PRO 16 2HG PRO 16 20.087 -2.299 4.437 142 HD2 PRO 16 1HD PRO 16 17.288 -1.333 5.052 143 HD3 PRO 16 2HD PRO 16 18.841 -0.505 5.267 144 H ILE 17 H ILE 17 18.191 -2.401 -0.188 145 HA ILE 17 HA ILE 17 15.544 -1.580 -0.833 146 HB ILE 17 HB ILE 17 17.389 -1.828 -2.480 147 HG12 ILE 17 1HG1 ILE 17 16.045 -2.988 -4.254 148 HG13 ILE 17 2HG1 ILE 17 14.924 -3.536 -3.022 149 HG21 ILE 17 1HG2 ILE 17 18.121 -3.997 -3.216 150 HG22 ILE 17 2HG2 ILE 17 16.929 -4.810 -2.205 151 HG23 ILE 17 3HG2 ILE 17 18.282 -3.956 -1.460 152 HD11 ILE 17 3HD1 ILE 17 15.522 -0.592 -3.280 153 HD12 ILE 17 1HD1 ILE 17 14.071 -1.381 -2.661 154 HD13 ILE 17 2HD1 ILE 17 14.396 -1.357 -4.390 155 H GLU 18 H GLU 18 16.936 -4.662 0.205 156 HA GLU 18 HA GLU 18 14.696 -6.293 -0.372 157 HB2 GLU 18 1HB GLU 18 16.888 -6.617 1.688 158 HB3 GLU 18 2HB GLU 18 15.734 -7.876 1.246 159 HG2 GLU 18 1HG GLU 18 16.527 -7.812 -1.076 160 HG3 GLU 18 2HG GLU 18 17.657 -6.525 -0.667 161 H LYS 19 H LYS 19 15.738 -4.738 2.635 162 HA LYS 19 HA LYS 19 13.625 -5.724 4.229 163 HB2 LYS 19 1HB LYS 19 15.654 -3.532 4.503 164 HB3 LYS 19 2HB LYS 19 14.331 -3.602 5.665 165 HG2 LYS 19 1HG LYS 19 16.319 -4.856 6.462 166 HG3 LYS 19 2HG LYS 19 14.922 -5.908 6.253 167 HD2 LYS 19 1HD LYS 19 15.790 -6.744 4.141 168 HD3 LYS 19 2HD LYS 19 17.113 -5.581 4.184 169 HE2 LYS 19 1HE LYS 19 18.001 -6.631 6.211 170 HE3 LYS 19 2HE LYS 19 16.649 -7.766 6.232 171 HZ1 LYS 19 3HZ LYS 19 18.247 -7.585 3.789 172 HZ2 LYS 19 1HZ LYS 19 17.472 -8.926 4.482 173 HZ3 LYS 19 2HZ LYS 19 18.942 -8.369 5.129 174 H VAL 20 H VAL 20 13.884 -2.661 2.414 175 HA VAL 20 HA VAL 20 11.368 -1.659 3.352 176 HB VAL 20 HB VAL 20 12.912 -0.978 0.829 177 HG11 VAL 20 1HG1 VAL 20 10.590 0.383 2.234 178 HG12 VAL 20 2HG1 VAL 20 10.590 -0.283 0.606 179 HG13 VAL 20 3HG1 VAL 20 11.555 1.142 0.969 180 HG21 VAL 20 3HG2 VAL 20 13.736 0.913 2.146 181 HG22 VAL 20 1HG2 VAL 20 14.108 -0.590 2.989 182 HG23 VAL 20 2HG2 VAL 20 12.757 0.410 3.523 183 H TRP 21 H TRP 21 12.398 -3.408 0.452 184 HA TRP 21 HA TRP 21 9.918 -3.593 -0.866 185 HB2 TRP 21 1HB TRP 21 12.053 -4.146 -1.943 186 HB3 TRP 21 2HB TRP 21 12.290 -5.491 -0.828 187 HD1 TRP 21 HD1 TRP 21 10.674 -7.623 -1.110 188 HE1 TRP 21 HE1 TRP 21 9.405 -8.519 -3.172 189 HE3 TRP 21 HE3 TRP 21 10.817 -3.490 -4.109 190 HZ2 TRP 21 HZ2 TRP 21 8.566 -7.606 -5.746 191 HZ3 TRP 21 HZ3 TRP 21 9.776 -3.531 -6.356 192 HH2 TRP 21 HH2 TRP 21 8.654 -5.581 -7.179 193 H GLU 22 H GLU 22 11.462 -5.638 1.580 194 HA GLU 22 HA GLU 22 9.649 -7.758 1.683 195 HB2 GLU 22 1HB GLU 22 11.827 -7.671 2.886 196 HB3 GLU 22 2HB GLU 22 11.136 -6.495 4.002 197 HG2 GLU 22 1HG GLU 22 9.458 -8.128 4.734 198 HG3 GLU 22 2HG GLU 22 10.055 -9.299 3.560 199 H ALA 23 H ALA 23 9.602 -4.632 3.367 200 HA ALA 23 HA ALA 23 7.396 -5.054 5.015 201 HB1 ALA 23 3HB ALA 23 8.928 -3.111 5.157 202 HB2 ALA 23 1HB ALA 23 7.227 -2.638 5.140 203 HB3 ALA 23 2HB ALA 23 8.203 -2.469 3.682 204 H LEU 24 H LEU 24 7.525 -4.250 1.601 205 HA LEU 24 HA LEU 24 4.821 -3.415 1.340 206 HB2 LEU 24 1HB LEU 24 6.942 -3.286 -0.302 207 HB3 LEU 24 2HB LEU 24 6.221 -4.736 -0.973 208 HG LEU 24 HG LEU 24 5.370 -2.835 -2.204 209 HD11 LEU 24 1HD1 LEU 24 3.053 -3.279 -2.075 210 HD12 LEU 24 2HD1 LEU 24 3.107 -3.577 -0.346 211 HD13 LEU 24 3HD1 LEU 24 3.801 -4.752 -1.468 212 HD21 LEU 24 3HD2 LEU 24 3.929 -1.543 0.070 213 HD22 LEU 24 1HD2 LEU 24 4.763 -0.818 -1.298 214 HD23 LEU 24 2HD2 LEU 24 5.674 -1.346 0.105 215 H VAL 25 H VAL 25 6.357 -6.583 0.817 216 HA VAL 25 HA VAL 25 3.653 -7.835 0.741 217 HB VAL 25 HB VAL 25 4.942 -9.729 -0.467 218 HG11 VAL 25 1HG1 VAL 25 3.340 -8.310 -1.631 219 HG12 VAL 25 2HG1 VAL 25 4.762 -8.541 -2.649 220 HG13 VAL 25 3HG1 VAL 25 4.541 -7.024 -1.777 221 HG21 VAL 25 3HG2 VAL 25 6.974 -9.064 -1.621 222 HG22 VAL 25 1HG2 VAL 25 7.212 -8.781 0.102 223 HG23 VAL 25 2HG2 VAL 25 6.861 -7.430 -0.971 224 H ASN 26 H ASN 26 3.677 -7.891 3.048 225 HA ASN 26 HA ASN 26 4.803 -10.370 4.000 226 HB2 ASN 26 1HB ASN 26 6.640 -8.709 4.268 227 HB3 ASN 26 2HB ASN 26 5.623 -7.862 5.417 228 HD21 ASN 26 2HD2 ASN 26 4.531 -10.658 6.250 229 HD22 ASN 26 1HD2 ASN 26 5.740 -11.258 7.268 230 HA PRO 27 HA PRO 27 0.824 -9.534 6.056 231 HB2 PRO 27 1HB PRO 27 0.307 -12.070 6.951 232 HB3 PRO 27 2HB PRO 27 0.074 -11.582 5.264 233 HG2 PRO 27 1HG PRO 27 2.352 -13.080 6.497 234 HG3 PRO 27 2HG PRO 27 1.533 -13.357 4.948 235 HD2 PRO 27 1HD PRO 27 3.938 -12.049 5.164 236 HD3 PRO 27 2HD PRO 27 2.786 -11.719 3.845 237 H GLU 28 H GLU 28 3.779 -10.543 7.428 238 HA GLU 28 HA GLU 28 2.838 -10.529 10.204 239 HB2 GLU 28 1HB GLU 28 5.617 -10.780 9.029 240 HB3 GLU 28 2HB GLU 28 5.227 -10.912 10.743 241 HG2 GLU 28 1HG GLU 28 3.700 -12.790 10.249 242 HG3 GLU 28 2HG GLU 28 4.111 -12.669 8.539 243 H ILE 29 H ILE 29 4.922 -8.533 8.119 244 HA ILE 29 HA ILE 29 5.363 -6.515 10.120 245 HB ILE 29 HB ILE 29 5.662 -6.296 7.119 246 HG12 ILE 29 1HG1 ILE 29 7.782 -6.957 9.186 247 HG13 ILE 29 2HG1 ILE 29 6.968 -8.182 8.221 248 HG21 ILE 29 1HG2 ILE 29 7.292 -4.506 7.721 249 HG22 ILE 29 2HG2 ILE 29 6.802 -4.678 9.409 250 HG23 ILE 29 3HG2 ILE 29 5.641 -4.125 8.203 251 HD11 ILE 29 3HD1 ILE 29 7.775 -7.119 6.157 252 HD12 ILE 29 1HD1 ILE 29 9.123 -7.545 7.208 253 HD13 ILE 29 2HD1 ILE 29 8.579 -5.870 7.107 254 H ILE 30 H ILE 30 3.192 -6.868 7.341 255 HA ILE 30 HA ILE 30 1.948 -4.344 7.485 256 HB ILE 30 HB ILE 30 0.930 -7.033 6.501 257 HG12 ILE 30 1HG1 ILE 30 1.753 -4.568 4.924 258 HG13 ILE 30 2HG1 ILE 30 2.879 -5.857 5.326 259 HG21 ILE 30 1HG2 ILE 30 -1.060 -5.787 7.001 260 HG22 ILE 30 2HG2 ILE 30 -0.803 -5.594 5.272 261 HG23 ILE 30 3HG2 ILE 30 -0.365 -4.290 6.378 262 HD11 ILE 30 3HD1 ILE 30 0.330 -6.131 3.703 263 HD12 ILE 30 1HD1 ILE 30 1.341 -7.489 4.201 264 HD13 ILE 30 2HD1 ILE 30 1.982 -6.270 3.101 265 H LYS 31 H LYS 31 1.191 -7.432 9.077 266 HA LYS 31 HA LYS 31 -1.117 -6.465 10.450 267 HB2 LYS 31 1HB LYS 31 -0.715 -8.865 9.961 268 HB3 LYS 31 2HB LYS 31 0.633 -8.852 11.100 269 HG2 LYS 31 1HG LYS 31 -0.886 -8.253 12.928 270 HG3 LYS 31 2HG LYS 31 -2.238 -8.154 11.796 271 HD2 LYS 31 1HD LYS 31 -1.951 -10.545 11.250 272 HD3 LYS 31 2HD LYS 31 -0.612 -10.646 12.392 273 HE2 LYS 31 1HE LYS 31 -2.121 -10.011 14.231 274 HE3 LYS 31 2HE LYS 31 -3.464 -9.884 13.093 275 HZ1 LYS 31 3HZ LYS 31 -3.214 -12.219 12.571 276 HZ2 LYS 31 1HZ LYS 31 -3.441 -12.020 14.241 277 HZ3 LYS 31 2HZ LYS 31 -1.890 -12.347 13.628 278 H GLU 32 H GLU 32 2.312 -6.469 11.097 279 HA GLU 32 HA GLU 32 2.310 -6.090 13.873 280 HB2 GLU 32 1HB GLU 32 4.331 -6.457 12.345 281 HB3 GLU 32 2HB GLU 32 4.244 -4.742 11.962 282 HG2 GLU 32 1HG GLU 32 4.452 -5.782 14.809 283 HG3 GLU 32 2HG GLU 32 5.855 -5.359 13.835 284 H TYR 33 H TYR 33 1.934 -3.760 11.227 285 HA TYR 33 HA TYR 33 1.863 -1.437 12.890 286 HB2 TYR 33 1HB TYR 33 1.010 -2.018 10.042 287 HB3 TYR 33 2HB TYR 33 0.738 -0.437 10.774 288 HD1 TYR 33 HD1 TYR 33 2.751 0.738 11.860 289 HD2 TYR 33 HD2 TYR 33 3.151 -2.491 9.055 290 HE1 TYR 33 HE1 TYR 33 5.075 1.432 11.390 291 HE2 TYR 33 HE2 TYR 33 5.485 -1.788 8.588 292 HH TYR 33 HH TYR 33 7.301 -0.500 9.860 293 H MET 34 H MET 34 -0.554 -3.716 11.723 294 HA MET 34 HA MET 34 -2.781 -2.114 12.737 295 HB2 MET 34 1HB MET 34 -2.684 -4.853 11.453 296 HB3 MET 34 2HB MET 34 -4.157 -3.984 11.881 297 HG2 MET 34 1HG MET 34 -3.391 -2.086 10.420 298 HG3 MET 34 2HG MET 34 -2.027 -3.083 9.918 299 HE1 MET 34 3HE MET 34 -6.464 -3.555 8.941 300 HE2 MET 34 1HE MET 34 -5.578 -2.023 8.946 301 HE3 MET 34 2HE MET 34 -5.770 -2.942 10.437 302 H PHE 35 H PHE 35 -4.252 -2.879 14.295 303 HA PHE 35 HA PHE 35 -3.089 -3.834 16.667 304 HB2 PHE 35 1HB PHE 35 -5.997 -3.686 15.837 305 HB3 PHE 35 2HB PHE 35 -5.442 -4.008 17.480 306 HD1 PHE 35 HD2 PHE 35 -4.150 -2.292 18.742 307 HD2 PHE 35 HD1 PHE 35 -5.880 -1.448 14.899 308 HE1 PHE 35 HE2 PHE 35 -3.864 0.139 19.145 309 HE2 PHE 35 HE1 PHE 35 -5.592 0.983 15.304 310 HZ PHE 35 HZ PHE 35 -4.584 1.774 17.426 311 H GLY 36 H GLY 36 -5.092 -5.550 14.259 312 HA2 GLY 36 1HA GLY 36 -3.852 -8.051 14.808 313 HA3 GLY 36 2HA GLY 36 -5.410 -7.964 15.623 314 H THR 37 H THR 37 -4.315 -6.822 12.425 315 HA THR 37 HA THR 37 -6.744 -7.828 11.175 316 HB THR 37 HB THR 37 -4.305 -6.522 9.944 317 HG1 THR 37 HG1 THR 37 -6.829 -5.538 10.774 318 HG21 THR 37 3HG2 THR 37 -5.466 -7.724 8.225 319 HG22 THR 37 1HG2 THR 37 -5.993 -6.048 8.092 320 HG23 THR 37 2HG2 THR 37 -7.041 -7.240 8.853 321 H THR 38 H THR 38 -6.992 -9.723 10.199 322 HA THR 38 HA THR 38 -4.702 -11.559 10.000 323 HB THR 38 HB THR 38 -7.647 -12.048 9.467 324 HG1 THR 38 HG1 THR 38 -6.464 -13.150 11.670 325 HG21 THR 38 3HG2 THR 38 -5.251 -13.882 9.752 326 HG22 THR 38 1HG2 THR 38 -6.310 -13.711 8.352 327 HG23 THR 38 2HG2 THR 38 -6.920 -14.442 9.834 328 H VAL 39 H VAL 39 -3.567 -10.747 8.215 329 HA VAL 39 HA VAL 39 -4.952 -10.730 5.590 330 HB VAL 39 HB VAL 39 -3.795 -8.677 6.017 331 HG11 VAL 39 1HG1 VAL 39 -1.371 -8.638 6.579 332 HG12 VAL 39 2HG1 VAL 39 -1.412 -10.390 6.740 333 HG13 VAL 39 3HG1 VAL 39 -2.358 -9.387 7.831 334 HG21 VAL 39 3HG2 VAL 39 -2.294 -8.569 4.147 335 HG22 VAL 39 1HG2 VAL 39 -3.489 -9.800 3.733 336 HG23 VAL 39 2HG2 VAL 39 -1.882 -10.276 4.285 337 H VAL 40 H VAL 40 -4.502 -12.200 4.088 338 HA VAL 40 HA VAL 40 -2.223 -14.074 4.480 339 HB VAL 40 HB VAL 40 -5.005 -14.749 3.488 340 HG11 VAL 40 1HG1 VAL 40 -3.398 -16.135 2.345 341 HG12 VAL 40 2HG1 VAL 40 -4.071 -17.111 3.647 342 HG13 VAL 40 3HG1 VAL 40 -2.474 -16.386 3.827 343 HG21 VAL 40 3HG2 VAL 40 -4.952 -14.389 5.913 344 HG22 VAL 40 1HG2 VAL 40 -3.537 -15.431 6.060 345 HG23 VAL 40 2HG2 VAL 40 -5.090 -16.115 5.576 346 H SER 41 H SER 41 -0.975 -14.403 2.771 347 HA SER 41 HA SER 41 -1.909 -13.893 0.047 348 HB2 SER 41 1HB SER 41 -1.279 -11.645 0.682 349 HB3 SER 41 2HB SER 41 0.268 -12.219 1.316 350 HG SER 41 HG SER 41 0.684 -11.522 -0.727 351 H ASP 42 H ASP 42 -0.731 -14.927 -1.481 352 HA ASP 42 HA ASP 42 1.178 -16.946 -0.614 353 HB2 ASP 42 1HB ASP 42 -0.017 -16.234 -3.309 354 HB3 ASP 42 2HB ASP 42 1.139 -17.542 -3.078 355 H TRP 43 H TRP 43 1.195 -13.780 -1.888 356 HA TRP 43 HA TRP 43 2.872 -12.288 -2.350 357 HB2 TRP 43 1HB TRP 43 4.974 -14.354 -1.682 358 HB3 TRP 43 2HB TRP 43 5.029 -12.606 -1.461 359 HD1 TRP 43 HD1 TRP 43 2.579 -11.948 0.200 360 HE1 TRP 43 HE1 TRP 43 2.239 -12.900 2.573 361 HE3 TRP 43 HE3 TRP 43 5.633 -16.027 -0.042 362 HZ2 TRP 43 HZ2 TRP 43 3.154 -15.103 4.164 363 HZ3 TRP 43 HZ3 TRP 43 5.884 -17.534 1.907 364 HH2 TRP 43 HH2 TRP 43 4.651 -17.079 4.008 365 H LYS 44 H LYS 44 1.815 -13.575 -4.520 366 HA LYS 44 HA LYS 44 4.024 -13.450 -6.400 367 HB2 LYS 44 1HB LYS 44 3.677 -15.652 -7.375 368 HB3 LYS 44 2HB LYS 44 4.157 -15.794 -5.689 369 HG2 LYS 44 1HG LYS 44 1.831 -16.132 -5.015 370 HG3 LYS 44 2HG LYS 44 1.291 -15.953 -6.682 371 HD2 LYS 44 1HD LYS 44 3.304 -18.062 -5.877 372 HD3 LYS 44 2HD LYS 44 1.573 -18.351 -5.788 373 HE2 LYS 44 1HE LYS 44 1.434 -17.718 -8.242 374 HE3 LYS 44 2HE LYS 44 3.196 -17.728 -8.268 375 HZ1 LYS 44 3HZ LYS 44 3.183 -20.013 -7.533 376 HZ2 LYS 44 1HZ LYS 44 2.274 -19.858 -8.956 377 HZ3 LYS 44 2HZ LYS 44 1.485 -20.014 -7.460 378 H GLU 45 H GLU 45 3.226 -13.780 -8.680 379 HA GLU 45 HA GLU 45 1.163 -11.981 -9.234 380 HB2 GLU 45 1HB GLU 45 3.019 -12.616 -10.794 381 HB3 GLU 45 2HB GLU 45 2.187 -14.143 -11.092 382 HG2 GLU 45 1HG GLU 45 0.240 -12.959 -11.954 383 HG3 GLU 45 2HG GLU 45 0.966 -11.406 -11.556 384 H GLY 46 H GLY 46 -0.956 -12.132 -9.318 385 HA2 GLY 46 1HA GLY 46 -3.063 -13.037 -9.811 386 HA3 GLY 46 2HA GLY 46 -2.333 -14.627 -9.993 387 H SER 47 H SER 47 -1.119 -13.446 -7.169 388 HA SER 47 HA SER 47 -2.662 -15.215 -5.555 389 HB2 SER 47 1HB SER 47 -0.900 -12.940 -4.644 390 HB3 SER 47 2HB SER 47 -1.415 -14.324 -3.687 391 HG SER 47 HG SER 47 0.702 -14.522 -4.639 392 H GLN 48 H GLN 48 -4.437 -14.924 -4.392 393 HA GLN 48 HA GLN 48 -5.884 -12.394 -4.577 394 HB2 GLN 48 1HB GLN 48 -7.017 -14.633 -4.782 395 HB3 GLN 48 2HB GLN 48 -6.659 -14.915 -3.081 396 HG2 GLN 48 1HG GLN 48 -8.911 -14.051 -3.223 397 HG3 GLN 48 2HG GLN 48 -7.903 -12.778 -2.548 398 HE21 GLN 48 2HE2 GLN 48 -9.003 -10.926 -3.362 399 HE22 GLN 48 1HE2 GLN 48 -9.222 -10.627 -5.016 400 H ILE 49 H ILE 49 -6.383 -11.067 -2.830 401 HA ILE 49 HA ILE 49 -5.100 -11.665 -0.219 402 HB ILE 49 HB ILE 49 -3.564 -10.224 -1.521 403 HG12 ILE 49 1HG1 ILE 49 -4.894 -8.727 0.766 404 HG13 ILE 49 2HG1 ILE 49 -3.793 -10.087 0.991 405 HG21 ILE 49 1HG2 ILE 49 -5.385 -9.067 -2.824 406 HG22 ILE 49 2HG2 ILE 49 -4.186 -7.976 -2.140 407 HG23 ILE 49 3HG2 ILE 49 -5.765 -8.142 -1.373 408 HD11 ILE 49 3HD1 ILE 49 -3.152 -7.441 -0.342 409 HD12 ILE 49 1HD1 ILE 49 -2.056 -8.822 -0.302 410 HD13 ILE 49 2HD1 ILE 49 -2.525 -8.027 1.200 411 H VAL 50 H VAL 50 -6.216 -11.084 1.516 412 HA VAL 50 HA VAL 50 -8.470 -9.214 1.288 413 HB VAL 50 HB VAL 50 -9.434 -11.443 0.865 414 HG11 VAL 50 1HG1 VAL 50 -8.474 -12.132 3.656 415 HG12 VAL 50 2HG1 VAL 50 -7.690 -12.690 2.178 416 HG13 VAL 50 3HG1 VAL 50 -9.344 -13.181 2.538 417 HG21 VAL 50 3HG2 VAL 50 -10.149 -10.431 3.639 418 HG22 VAL 50 1HG2 VAL 50 -11.200 -11.299 2.521 419 HG23 VAL 50 2HG2 VAL 50 -10.677 -9.660 2.147 420 H TRP 51 H TRP 51 -9.102 -8.267 3.210 421 HA TRP 51 HA TRP 51 -7.340 -8.735 5.564 422 HB2 TRP 51 1HB TRP 51 -8.470 -6.055 4.722 423 HB3 TRP 51 2HB TRP 51 -7.294 -6.378 5.991 424 HD1 TRP 51 HD1 TRP 51 -5.386 -8.329 4.278 425 HE1 TRP 51 HE1 TRP 51 -3.905 -7.306 2.439 426 HE3 TRP 51 HE3 TRP 51 -7.877 -3.953 3.491 427 HZ2 TRP 51 HZ2 TRP 51 -3.786 -4.933 0.847 428 HZ3 TRP 51 HZ3 TRP 51 -7.054 -2.321 1.823 429 HH2 TRP 51 HH2 TRP 51 -5.015 -2.804 0.495 430 H LYS 52 H LYS 52 -8.316 -8.795 7.518 431 HA LYS 52 HA LYS 52 -11.284 -8.693 7.555 432 HB2 LYS 52 1HB LYS 52 -10.187 -10.820 8.279 433 HB3 LYS 52 2HB LYS 52 -9.429 -9.931 9.601 434 HG2 LYS 52 1HG LYS 52 -11.624 -9.311 10.491 435 HG3 LYS 52 2HG LYS 52 -12.423 -10.088 9.126 436 HD2 LYS 52 1HD LYS 52 -11.480 -12.262 9.824 437 HD3 LYS 52 2HD LYS 52 -10.696 -11.475 11.196 438 HE2 LYS 52 1HE LYS 52 -12.805 -12.493 11.921 439 HE3 LYS 52 2HE LYS 52 -12.925 -10.737 12.015 440 HZ1 LYS 52 3HZ LYS 52 -13.849 -12.313 9.677 441 HZ2 LYS 52 1HZ LYS 52 -14.136 -10.672 9.995 442 HZ3 LYS 52 2HZ LYS 52 -14.864 -11.864 10.963 443 H GLY 53 H GLY 53 -12.350 -7.306 8.838 444 HA2 GLY 53 1HA GLY 53 -11.103 -5.910 11.036 445 HA3 GLY 53 2HA GLY 53 -11.331 -4.890 9.620 446 H GLU 54 H GLU 54 -12.613 -4.024 11.716 447 HA GLU 54 HA GLU 54 -15.455 -4.782 11.307 448 HB2 GLU 54 1HB GLU 54 -14.595 -5.599 13.489 449 HB3 GLU 54 2HB GLU 54 -14.188 -3.939 13.921 450 HG2 GLU 54 1HG GLU 54 -16.540 -3.281 13.724 451 HG3 GLU 54 2HG GLU 54 -16.968 -4.908 13.191 452 H TRP 55 H TRP 55 -16.852 -3.162 11.030 453 HA TRP 55 HA TRP 55 -16.019 -0.368 11.500 454 HB2 TRP 55 1HB TRP 55 -15.412 -0.990 9.157 455 HB3 TRP 55 2HB TRP 55 -17.108 -1.362 8.853 456 HD1 TRP 55 HD1 TRP 55 -18.449 0.568 7.879 457 HE1 TRP 55 HE1 TRP 55 -18.232 3.136 7.821 458 HE3 TRP 55 HE3 TRP 55 -14.305 1.182 10.814 459 HZ2 TRP 55 HZ2 TRP 55 -16.536 5.176 8.873 460 HZ3 TRP 55 HZ3 TRP 55 -13.415 3.451 11.266 461 HH2 TRP 55 HH2 TRP 55 -14.525 5.447 10.301 462 H LYS 56 H LYS 56 -17.557 0.492 12.690 463 HA LYS 56 HA LYS 56 -19.624 0.969 13.605 464 HB2 LYS 56 1HB LYS 56 -20.653 0.319 10.833 465 HB3 LYS 56 2HB LYS 56 -21.417 1.357 12.034 466 HG2 LYS 56 1HG LYS 56 -18.720 1.910 10.747 467 HG3 LYS 56 2HG LYS 56 -20.239 2.644 10.246 468 HD2 LYS 56 1HD LYS 56 -20.491 3.515 12.611 469 HD3 LYS 56 2HD LYS 56 -18.849 2.957 12.923 470 HE2 LYS 56 1HE LYS 56 -17.968 4.387 11.162 471 HE3 LYS 56 2HE LYS 56 -19.601 4.916 10.745 472 HZ1 LYS 56 3HZ LYS 56 -19.070 6.566 12.176 473 HZ2 LYS 56 1HZ LYS 56 -17.942 5.630 13.030 474 HZ3 LYS 56 2HZ LYS 56 -19.604 5.437 13.329 475 H GLY 57 H GLY 57 -18.670 -1.724 13.840 476 HA2 GLY 57 1HA GLY 57 -19.511 -3.635 14.885 477 HA3 GLY 57 2HA GLY 57 -21.140 -3.008 14.662 478 H LYS 58 H LYS 58 -19.998 -2.650 11.711 479 HA LYS 58 HA LYS 58 -21.001 -5.285 10.793 480 HB2 LYS 58 1HB LYS 58 -20.803 -2.538 9.566 481 HB3 LYS 58 2HB LYS 58 -20.852 -3.937 8.496 482 HG2 LYS 58 1HG LYS 58 -23.113 -3.115 8.824 483 HG3 LYS 58 2HG LYS 58 -22.963 -4.678 9.622 484 HD2 LYS 58 1HD LYS 58 -22.702 -3.613 11.784 485 HD3 LYS 58 2HD LYS 58 -22.635 -2.019 11.038 486 HE2 LYS 58 1HE LYS 58 -25.021 -3.872 10.823 487 HE3 LYS 58 2HE LYS 58 -24.877 -2.593 12.028 488 HZ1 LYS 58 3HZ LYS 58 -24.651 -0.977 10.262 489 HZ2 LYS 58 1HZ LYS 58 -26.089 -1.854 10.061 490 HZ3 LYS 58 2HZ LYS 58 -24.741 -2.202 9.086 491 H ALA 59 H ALA 59 -19.567 -6.778 10.357 492 HA ALA 59 HA ALA 59 -16.776 -6.303 10.069 493 HB1 ALA 59 3HB ALA 59 -16.703 -8.725 9.445 494 HB2 ALA 59 1HB ALA 59 -18.468 -8.737 9.468 495 HB3 ALA 59 2HB ALA 59 -17.567 -8.412 10.949 496 H TYR 60 H TYR 60 -15.625 -5.805 8.313 497 HA TYR 60 HA TYR 60 -16.834 -6.202 5.619 498 HB2 TYR 60 1HB TYR 60 -16.123 -4.048 4.915 499 HB3 TYR 60 2HB TYR 60 -16.904 -3.799 6.474 500 HD1 TYR 60 HD1 TYR 60 -15.479 -3.600 8.570 501 HD2 TYR 60 HD2 TYR 60 -13.804 -3.526 4.613 502 HE1 TYR 60 HE1 TYR 60 -13.382 -2.625 9.469 503 HE2 TYR 60 HE2 TYR 60 -11.720 -2.546 5.509 504 HH TYR 60 HH TYR 60 -11.156 -1.095 7.679 505 H GLU 61 H GLU 61 -15.416 -6.621 3.936 506 HA GLU 61 HA GLU 61 -12.577 -7.097 4.624 507 HB2 GLU 61 1HB GLU 61 -12.654 -9.254 3.436 508 HB3 GLU 61 2HB GLU 61 -13.696 -9.255 4.857 509 HG2 GLU 61 1HG GLU 61 -15.634 -8.705 3.360 510 HG3 GLU 61 2HG GLU 61 -14.562 -8.893 1.974 511 H ASP 62 H ASP 62 -11.214 -6.461 3.127 512 HA ASP 62 HA ASP 62 -12.241 -5.271 0.640 513 HB2 ASP 62 1HB ASP 62 -9.546 -5.153 2.022 514 HB3 ASP 62 2HB ASP 62 -9.897 -4.372 0.482 515 H LYS 63 H LYS 63 -11.633 -6.006 -1.401 516 HA LYS 63 HA LYS 63 -10.023 -8.528 -1.485 517 HB2 LYS 63 1HB LYS 63 -12.587 -7.888 -2.963 518 HB3 LYS 63 2HB LYS 63 -11.560 -9.286 -3.299 519 HG2 LYS 63 1HG LYS 63 -11.830 -10.044 -0.960 520 HG3 LYS 63 2HG LYS 63 -12.877 -8.659 -0.639 521 HD2 LYS 63 1HD LYS 63 -14.456 -9.438 -2.356 522 HD3 LYS 63 2HD LYS 63 -13.411 -10.814 -2.706 523 HE2 LYS 63 1HE LYS 63 -13.688 -11.607 -0.377 524 HE3 LYS 63 2HE LYS 63 -14.755 -10.242 -0.046 525 HZ1 LYS 63 3HZ LYS 63 -15.851 -11.278 -2.264 526 HZ2 LYS 63 1HZ LYS 63 -16.353 -11.652 -0.688 527 HZ3 LYS 63 2HZ LYS 63 -15.276 -12.684 -1.498 528 H GLY 64 H GLY 64 -8.401 -8.554 -2.823 529 HA2 GLY 64 1HA GLY 64 -8.423 -7.041 -5.332 530 HA3 GLY 64 2HA GLY 64 -7.180 -6.606 -4.160 531 H THR 65 H THR 65 -6.135 -7.435 -6.406 532 HA THR 65 HA THR 65 -5.009 -10.066 -5.749 533 HB THR 65 HB THR 65 -6.282 -9.523 -8.446 534 HG1 THR 65 HG1 THR 65 -7.244 -10.498 -6.130 535 HG21 THR 65 3HG2 THR 65 -4.750 -11.877 -7.301 536 HG22 THR 65 1HG2 THR 65 -4.364 -10.938 -8.746 537 HG23 THR 65 2HG2 THR 65 -5.771 -11.998 -8.732 538 H ILE 66 H ILE 66 -3.064 -10.542 -6.856 539 HA ILE 66 HA ILE 66 -1.453 -8.188 -7.376 540 HB ILE 66 HB ILE 66 -0.708 -11.100 -7.755 541 HG12 ILE 66 1HG1 ILE 66 -1.529 -10.794 -5.487 542 HG13 ILE 66 2HG1 ILE 66 0.218 -10.949 -5.451 543 HG21 ILE 66 1HG2 ILE 66 1.585 -10.222 -7.311 544 HG22 ILE 66 2HG2 ILE 66 0.930 -8.584 -7.334 545 HG23 ILE 66 3HG2 ILE 66 0.869 -9.580 -8.790 546 HD11 ILE 66 3HD1 ILE 66 0.194 -8.319 -5.513 547 HD12 ILE 66 1HD1 ILE 66 -0.168 -9.150 -4.005 548 HD13 ILE 66 2HD1 ILE 66 -1.477 -8.504 -4.990 549 H LEU 67 H LEU 67 -1.499 -7.181 -9.269 550 HA LEU 67 HA LEU 67 -2.453 -8.410 -11.683 551 HB2 LEU 67 1HB LEU 67 -2.759 -5.997 -11.218 552 HB3 LEU 67 2HB LEU 67 -1.016 -5.772 -11.288 553 HG LEU 67 HG LEU 67 -1.008 -6.526 -13.649 554 HD11 LEU 67 1HD1 LEU 67 -2.800 -7.986 -13.971 555 HD12 LEU 67 2HD1 LEU 67 -3.417 -6.529 -14.730 556 HD13 LEU 67 3HD1 LEU 67 -3.943 -6.960 -13.105 557 HD21 LEU 67 3HD2 LEU 67 -2.894 -4.263 -12.932 558 HD22 LEU 67 1HD2 LEU 67 -2.288 -4.545 -14.564 559 HD23 LEU 67 2HD2 LEU 67 -1.167 -4.164 -13.264 560 H GLN 68 H GLN 68 0.719 -7.403 -10.482 561 HA GLN 68 HA GLN 68 2.045 -9.366 -12.208 562 HB2 GLN 68 1HB GLN 68 1.967 -7.309 -13.590 563 HB3 GLN 68 2HB GLN 68 2.772 -6.424 -12.295 564 HG2 GLN 68 1HG GLN 68 4.747 -7.815 -12.486 565 HG3 GLN 68 2HG GLN 68 3.938 -8.883 -13.630 566 HE21 GLN 68 2HE2 GLN 68 4.975 -8.503 -15.605 567 HE22 GLN 68 1HE2 GLN 68 5.239 -6.965 -16.270 568 H PHE 69 H PHE 69 4.061 -9.985 -11.424 569 HA PHE 69 HA PHE 69 4.935 -8.780 -8.847 570 HB2 PHE 69 1HB PHE 69 3.641 -10.857 -8.437 571 HB3 PHE 69 2HB PHE 69 4.781 -11.743 -9.447 572 HD1 PHE 69 HD1 PHE 69 4.351 -9.927 -6.242 573 HD2 PHE 69 HD2 PHE 69 7.060 -12.173 -8.710 574 HE1 PHE 69 HE1 PHE 69 5.913 -10.150 -4.331 575 HE2 PHE 69 HE2 PHE 69 8.618 -12.395 -6.798 576 HZ PHE 69 HZ PHE 69 8.046 -11.383 -4.609 577 H ASN 70 H ASN 70 6.830 -7.907 -9.272 578 HA ASN 70 HA ASN 70 8.893 -9.523 -10.689 579 HB2 ASN 70 1HB ASN 70 8.467 -6.524 -10.793 580 HB3 ASN 70 2HB ASN 70 9.835 -7.385 -11.497 581 HD21 ASN 70 2HD2 ASN 70 7.877 -5.838 -13.043 582 HD22 ASN 70 1HD2 ASN 70 7.095 -6.934 -14.074 583 H GLU 71 H GLU 71 9.787 -10.324 -8.853 584 HA GLU 71 HA GLU 71 10.251 -9.304 -6.399 585 HB2 GLU 71 1HB GLU 71 12.334 -10.691 -6.334 586 HB3 GLU 71 2HB GLU 71 10.918 -11.542 -6.950 587 HG2 GLU 71 1HG GLU 71 11.684 -11.044 -9.278 588 HG3 GLU 71 2HG GLU 71 13.144 -10.318 -8.609 589 H ARG 72 H ARG 72 11.350 -7.729 -5.469 590 HA ARG 72 HA ARG 72 12.505 -5.743 -5.261 591 HB2 ARG 72 1HB ARG 72 14.613 -7.470 -6.582 592 HB3 ARG 72 2HB ARG 72 14.912 -6.012 -5.631 593 HG2 ARG 72 1HG ARG 72 13.899 -7.051 -3.661 594 HG3 ARG 72 2HG ARG 72 13.514 -8.495 -4.601 595 HD2 ARG 72 1HD ARG 72 15.937 -8.850 -5.010 596 HD3 ARG 72 2HD ARG 72 16.297 -7.439 -4.019 597 HE ARG 72 HE ARG 72 14.764 -8.976 -2.371 598 HH11 ARG 72 1HH2 ARG 72 17.614 -9.570 -4.266 599 HH12 ARG 72 2HH2 ARG 72 18.225 -10.784 -3.199 600 HH21 ARG 72 1HH1 ARG 72 15.557 -10.559 -0.989 601 HH22 ARG 72 2HH1 ARG 72 17.055 -11.348 -1.337 602 H SER 73 H SER 73 10.902 -5.250 -7.344 603 HA SER 73 HA SER 73 12.494 -3.468 -8.964 604 HB2 SER 73 1HB SER 73 12.704 -5.801 -10.027 605 HB3 SER 73 2HB SER 73 11.022 -5.601 -10.505 606 HG SER 73 HG SER 73 12.582 -3.402 -10.986 607 H ILE 74 H ILE 74 9.409 -5.142 -9.585 608 HA ILE 74 HA ILE 74 7.953 -2.568 -9.214 609 HB ILE 74 HB ILE 74 7.702 -4.375 -11.641 610 HG12 ILE 74 1HG1 ILE 74 8.607 -1.482 -11.413 611 HG13 ILE 74 2HG1 ILE 74 9.704 -2.845 -11.573 612 HG21 ILE 74 1HG2 ILE 74 5.510 -3.497 -11.060 613 HG22 ILE 74 2HG2 ILE 74 6.111 -2.545 -12.403 614 HG23 ILE 74 3HG2 ILE 74 6.176 -1.892 -10.766 615 HD11 ILE 74 3HD1 ILE 74 7.622 -1.983 -13.575 616 HD12 ILE 74 1HD1 ILE 74 8.563 -3.469 -13.700 617 HD13 ILE 74 2HD1 ILE 74 9.373 -1.904 -13.760 618 H LEU 75 H LEU 75 6.039 -2.731 -8.276 619 HA LEU 75 HA LEU 75 4.717 -5.383 -8.103 620 HB2 LEU 75 1HB LEU 75 6.153 -4.561 -5.999 621 HB3 LEU 75 2HB LEU 75 4.721 -3.611 -5.660 622 HG LEU 75 HG LEU 75 4.473 -5.700 -4.490 623 HD11 LEU 75 1HD1 LEU 75 2.358 -6.379 -5.253 624 HD12 LEU 75 2HD1 LEU 75 2.752 -6.078 -6.937 625 HD13 LEU 75 3HD1 LEU 75 2.514 -4.732 -5.832 626 HD21 LEU 75 3HD2 LEU 75 4.490 -7.478 -6.894 627 HD22 LEU 75 1HD2 LEU 75 5.122 -7.759 -5.279 628 HD23 LEU 75 2HD2 LEU 75 6.067 -6.849 -6.443 629 H GLN 76 H GLN 76 2.724 -5.212 -8.843 630 HA GLN 76 HA GLN 76 1.134 -2.780 -8.276 631 HB2 GLN 76 1HB GLN 76 1.986 -2.696 -10.622 632 HB3 GLN 76 2HB GLN 76 1.166 -4.224 -10.940 633 HG2 GLN 76 1HG GLN 76 -0.998 -3.235 -10.453 634 HG3 GLN 76 2HG GLN 76 -0.243 -1.740 -9.927 635 HE21 GLN 76 2HE2 GLN 76 1.765 -1.973 -12.240 636 HE22 GLN 76 1HE2 GLN 76 0.882 -1.468 -13.591 637 H TYR 77 H TYR 77 -0.938 -3.121 -7.705 638 HA TYR 77 HA TYR 77 -2.152 -5.755 -8.157 639 HB2 TYR 77 1HB TYR 77 -2.723 -6.053 -5.770 640 HB3 TYR 77 2HB TYR 77 -0.988 -6.122 -6.056 641 HD1 TYR 77 HD1 TYR 77 -3.754 -3.864 -4.916 642 HD2 TYR 77 HD2 TYR 77 0.471 -4.583 -4.953 643 HE1 TYR 77 HE1 TYR 77 -3.420 -2.030 -3.280 644 HE2 TYR 77 HE2 TYR 77 0.815 -2.751 -3.332 645 HH TYR 77 HH TYR 77 -1.959 -0.881 -2.076 646 H SER 78 H SER 78 -4.354 -5.838 -7.918 647 HA SER 78 HA SER 78 -5.731 -3.270 -8.206 648 HB2 SER 78 1HB SER 78 -7.556 -4.514 -9.023 649 HB3 SER 78 2HB SER 78 -6.175 -5.449 -9.573 650 HG SER 78 HG SER 78 -7.826 -6.700 -8.521 651 H HIS 79 H HIS 79 -7.493 -2.640 -6.801 652 HA HIS 79 HA HIS 79 -7.799 -4.151 -4.306 653 HB2 HIS 79 1HB HIS 79 -5.868 -2.613 -3.946 654 HB3 HIS 79 2HB HIS 79 -6.935 -1.247 -4.265 655 HD1 HIS 79 HD1 HIS 79 -8.211 -0.379 -2.297 656 HD2 HIS 79 HD2 HIS 79 -6.891 -4.283 -1.677 657 HE1 HIS 79 HE1 HIS 79 -8.888 -0.996 0.064 658 HE2 HIS 79 HE2 HIS 79 -8.088 -3.375 0.457 659 H PHE 80 H PHE 80 -9.718 -3.994 -3.417 660 HA PHE 80 HA PHE 80 -11.572 -1.835 -4.231 661 HB2 PHE 80 1HB PHE 80 -12.148 -3.621 -5.728 662 HB3 PHE 80 2HB PHE 80 -12.058 -4.815 -4.443 663 HD1 PHE 80 HD2 PHE 80 -13.809 -4.958 -2.707 664 HD2 PHE 80 HD1 PHE 80 -14.090 -2.140 -5.932 665 HE1 PHE 80 HE2 PHE 80 -16.197 -4.571 -2.165 666 HE2 PHE 80 HE1 PHE 80 -16.473 -1.747 -5.387 667 HZ PHE 80 HZ PHE 80 -17.528 -2.964 -3.503 668 H SER 81 H SER 81 -13.038 -1.257 -2.710 669 HA SER 81 HA SER 81 -13.048 -2.715 -0.135 670 HB2 SER 81 1HB SER 81 -11.534 -0.733 -0.019 671 HB3 SER 81 2HB SER 81 -12.933 0.288 -0.327 672 HG SER 81 HG SER 81 -13.767 -1.223 1.532 673 HA PRO 82 HA PRO 82 -17.443 -2.096 -0.940 674 HB2 PRO 82 1HB PRO 82 -18.481 -3.164 1.376 675 HB3 PRO 82 2HB PRO 82 -17.858 -4.157 0.047 676 HG2 PRO 82 1HG PRO 82 -16.550 -3.416 2.633 677 HG3 PRO 82 2HG PRO 82 -16.504 -4.947 1.750 678 HD2 PRO 82 1HD PRO 82 -14.449 -3.106 1.677 679 HD3 PRO 82 2HD PRO 82 -14.771 -4.260 0.357 680 H LEU 83 H LEU 83 -15.756 -0.830 1.821 681 HA LEU 83 HA LEU 83 -17.746 0.683 3.087 682 HB2 LEU 83 1HB LEU 83 -14.873 1.544 2.688 683 HB3 LEU 83 2HB LEU 83 -15.957 2.014 3.997 684 HG LEU 83 HG LEU 83 -15.011 -0.827 3.461 685 HD11 LEU 83 1HD1 LEU 83 -13.164 0.585 4.201 686 HD12 LEU 83 2HD1 LEU 83 -13.659 -0.465 5.525 687 HD13 LEU 83 3HD1 LEU 83 -14.144 1.228 5.519 688 HD21 LEU 83 3HD2 LEU 83 -15.895 -1.105 5.870 689 HD22 LEU 83 1HD2 LEU 83 -17.109 -0.949 4.609 690 HD23 LEU 83 2HD2 LEU 83 -16.719 0.432 5.635 691 H THR 84 H THR 84 -16.740 0.898 -0.074 692 HA THR 84 HA THR 84 -16.759 3.686 -0.548 693 HB THR 84 HB THR 84 -15.857 2.202 -2.220 694 HG1 THR 84 HG1 THR 84 -17.601 4.063 -2.689 695 HG21 THR 84 3HG2 THR 84 -17.419 0.276 -1.655 696 HG22 THR 84 1HG2 THR 84 -17.145 0.535 -3.372 697 HG23 THR 84 2HG2 THR 84 -18.641 1.082 -2.623 698 H GLY 85 H GLY 85 -19.328 1.276 -0.386 699 HA2 GLY 85 1HA GLY 85 -21.603 1.542 -0.091 700 HA3 GLY 85 2HA GLY 85 -21.335 3.274 0.080 701 H LYS 86 H LYS 86 -19.804 2.449 -2.691 702 HA LYS 86 HA LYS 86 -22.057 3.369 -4.334 703 HB2 LYS 86 1HB LYS 86 -19.109 3.178 -4.931 704 HB3 LYS 86 2HB LYS 86 -20.329 3.784 -6.054 705 HG2 LYS 86 1HG LYS 86 -20.932 5.564 -4.505 706 HG3 LYS 86 2HG LYS 86 -19.812 4.935 -3.298 707 HD2 LYS 86 1HD LYS 86 -17.918 5.373 -4.769 708 HD3 LYS 86 2HD LYS 86 -19.003 5.892 -6.059 709 HE2 LYS 86 1HE LYS 86 -19.796 7.754 -4.658 710 HE3 LYS 86 2HE LYS 86 -18.729 7.233 -3.351 711 HZ1 LYS 86 3HZ LYS 86 -17.038 7.372 -5.426 712 HZ2 LYS 86 1HZ LYS 86 -17.283 8.625 -4.310 713 HZ3 LYS 86 2HZ LYS 86 -18.106 8.640 -5.797 714 HA PRO 87 HA PRO 87 -22.863 -0.625 -6.191 715 HB2 PRO 87 1HB PRO 87 -22.669 0.828 -8.825 716 HB3 PRO 87 2HB PRO 87 -23.933 -0.269 -8.248 717 HG2 PRO 87 1HG PRO 87 -24.290 2.384 -8.289 718 HG3 PRO 87 2HG PRO 87 -24.969 1.376 -6.997 719 HD2 PRO 87 1HD PRO 87 -22.647 3.266 -6.871 720 HD3 PRO 87 2HD PRO 87 -23.766 2.739 -5.590 721 H ASP 88 H ASP 88 -21.797 -2.252 -7.553 722 HA ASP 88 HA ASP 88 -18.922 -2.053 -7.499 723 HB2 ASP 88 1HB ASP 88 -20.183 -4.141 -7.007 724 HB3 ASP 88 2HB ASP 88 -20.703 -4.195 -8.691 725 H LEU 89 H LEU 89 -18.504 -0.344 -8.982 726 HA LEU 89 HA LEU 89 -18.849 -1.039 -11.852 727 HB2 LEU 89 1HB LEU 89 -18.453 1.742 -10.742 728 HB3 LEU 89 2HB LEU 89 -18.947 1.305 -12.369 729 HG LEU 89 HG LEU 89 -20.557 0.749 -9.860 730 HD11 LEU 89 1HD1 LEU 89 -22.058 2.520 -10.720 731 HD12 LEU 89 2HD1 LEU 89 -20.919 2.833 -12.031 732 HD13 LEU 89 3HD1 LEU 89 -20.448 3.144 -10.360 733 HD21 LEU 89 3HD2 LEU 89 -21.129 -0.898 -11.522 734 HD22 LEU 89 1HD2 LEU 89 -21.106 0.303 -12.811 735 HD23 LEU 89 2HD2 LEU 89 -22.387 0.323 -11.601 736 HA PRO 90 HA PRO 90 -14.429 -1.289 -12.088 737 HB2 PRO 90 1HB PRO 90 -13.987 -0.620 -14.739 738 HB3 PRO 90 2HB PRO 90 -14.620 -2.191 -14.215 739 HG2 PRO 90 1HG PRO 90 -16.109 0.192 -15.257 740 HG3 PRO 90 2HG PRO 90 -16.337 -1.530 -15.631 741 HD2 PRO 90 1HD PRO 90 -17.962 -0.232 -13.883 742 HD3 PRO 90 2HD PRO 90 -17.541 -1.942 -13.655 743 H GLU 91 H GLU 91 -16.081 1.660 -12.830 744 HA GLU 91 HA GLU 91 -13.649 3.292 -12.938 745 HB2 GLU 91 1HB GLU 91 -16.596 3.990 -12.996 746 HB3 GLU 91 2HB GLU 91 -15.291 5.170 -13.128 747 HG2 GLU 91 1HG GLU 91 -14.442 4.030 -15.135 748 HG3 GLU 91 2HG GLU 91 -15.711 2.815 -14.992 749 H ASN 92 H ASN 92 -15.810 2.074 -10.584 750 HA ASN 92 HA ASN 92 -15.644 4.183 -8.660 751 HB2 ASN 92 1HB ASN 92 -17.431 2.494 -8.663 752 HB3 ASN 92 2HB ASN 92 -16.247 1.244 -8.281 753 HD21 ASN 92 2HD2 ASN 92 -17.204 0.778 -6.182 754 HD22 ASN 92 1HD2 ASN 92 -17.100 1.878 -4.897 755 H TYR 93 H TYR 93 -13.777 1.211 -9.161 756 HA TYR 93 HA TYR 93 -12.027 1.899 -6.863 757 HB2 TYR 93 1HB TYR 93 -11.515 -0.354 -6.651 758 HB3 TYR 93 2HB TYR 93 -13.155 -0.437 -7.277 759 HD1 TYR 93 HD1 TYR 93 -12.637 0.234 -10.177 760 HD2 TYR 93 HD2 TYR 93 -10.559 -2.387 -7.485 761 HE1 TYR 93 HE1 TYR 93 -11.829 -1.106 -12.096 762 HE2 TYR 93 HE2 TYR 93 -9.758 -3.719 -9.396 763 HH TYR 93 HH TYR 93 -10.082 -2.632 -12.657 764 H HIS 94 H HIS 94 -9.680 1.233 -7.189 765 HA HIS 94 HA HIS 94 -8.654 1.883 -9.881 766 HB2 HIS 94 1HB HIS 94 -6.897 3.371 -8.602 767 HB3 HIS 94 2HB HIS 94 -8.465 4.035 -9.004 768 HD1 HIS 94 HD1 HIS 94 -9.140 5.454 -7.082 769 HD2 HIS 94 HD2 HIS 94 -7.497 1.842 -5.811 770 HE1 HIS 94 HE1 HIS 94 -9.348 5.428 -4.561 771 HE2 HIS 94 HE2 HIS 94 -8.352 3.228 -3.767 772 H VAL 95 H VAL 95 -6.367 1.478 -10.108 773 HA VAL 95 HA VAL 95 -5.474 -0.852 -8.502 774 HB VAL 95 HB VAL 95 -5.804 -1.298 -10.901 775 HG11 VAL 95 1HG1 VAL 95 -4.555 -0.159 -12.603 776 HG12 VAL 95 2HG1 VAL 95 -3.581 0.701 -11.412 777 HG13 VAL 95 3HG1 VAL 95 -5.290 1.094 -11.604 778 HG21 VAL 95 3HG2 VAL 95 -3.973 -2.417 -9.588 779 HG22 VAL 95 1HG2 VAL 95 -2.851 -1.202 -10.193 780 HG23 VAL 95 2HG2 VAL 95 -3.635 -2.313 -11.311 781 H VAL 96 H VAL 96 -3.701 -0.699 -7.321 782 HA VAL 96 HA VAL 96 -2.182 1.834 -7.344 783 HB VAL 96 HB VAL 96 -2.124 -0.445 -5.351 784 HG11 VAL 96 1HG1 VAL 96 -1.054 1.318 -3.914 785 HG12 VAL 96 2HG1 VAL 96 -0.951 2.348 -5.342 786 HG13 VAL 96 3HG1 VAL 96 -0.070 0.822 -5.289 787 HG21 VAL 96 3HG2 VAL 96 -4.325 0.707 -5.488 788 HG22 VAL 96 1HG2 VAL 96 -3.513 2.253 -5.242 789 HG23 VAL 96 2HG2 VAL 96 -3.504 1.039 -3.961 790 H THR 97 H THR 97 -0.178 1.985 -8.066 791 HA THR 97 HA THR 97 1.359 -0.494 -8.661 792 HB THR 97 HB THR 97 0.720 0.399 -10.776 793 HG1 THR 97 HG1 THR 97 3.043 1.548 -11.084 794 HG21 THR 97 3HG2 THR 97 0.111 2.688 -9.908 795 HG22 THR 97 1HG2 THR 97 1.002 2.702 -11.424 796 HG23 THR 97 2HG2 THR 97 1.827 3.086 -9.918 797 H ILE 98 H ILE 98 3.110 -0.695 -7.525 798 HA ILE 98 HA ILE 98 4.417 1.722 -6.382 799 HB ILE 98 HB ILE 98 4.763 -1.127 -5.419 800 HG12 ILE 98 1HG1 ILE 98 2.376 -0.647 -5.279 801 HG13 ILE 98 2HG1 ILE 98 3.082 -0.605 -3.672 802 HG21 ILE 98 1HG2 ILE 98 6.389 0.688 -4.780 803 HG22 ILE 98 2HG2 ILE 98 5.596 -0.093 -3.426 804 HG23 ILE 98 3HG2 ILE 98 5.079 1.505 -3.954 805 HD11 ILE 98 3HD1 ILE 98 3.262 1.944 -3.992 806 HD12 ILE 98 1HD1 ILE 98 1.654 1.277 -3.770 807 HD13 ILE 98 2HD1 ILE 98 2.203 1.727 -5.374 808 H THR 99 H THR 99 6.435 2.186 -6.955 809 HA THR 99 HA THR 99 8.055 0.158 -8.438 810 HB THR 99 HB THR 99 7.965 3.145 -8.955 811 HG1 THR 99 HG1 THR 99 6.856 2.586 -10.786 812 HG21 THR 99 3HG2 THR 99 9.315 2.444 -10.976 813 HG22 THR 99 1HG2 THR 99 9.483 0.853 -10.233 814 HG23 THR 99 2HG2 THR 99 10.157 2.276 -9.437 815 H LEU 100 H LEU 100 9.828 -0.362 -7.377 816 HA LEU 100 HA LEU 100 11.095 1.631 -5.562 817 HB2 LEU 100 1HB LEU 100 10.578 -1.302 -5.268 818 HB3 LEU 100 2HB LEU 100 12.087 -0.695 -4.599 819 HG LEU 100 HG LEU 100 10.826 0.992 -3.286 820 HD11 LEU 100 1HD1 LEU 100 8.869 1.442 -4.488 821 HD12 LEU 100 2HD1 LEU 100 8.271 0.495 -3.135 822 HD13 LEU 100 3HD1 LEU 100 8.491 -0.265 -4.712 823 HD21 LEU 100 3HD2 LEU 100 9.714 -1.797 -2.868 824 HD22 LEU 100 1HD2 LEU 100 9.939 -0.550 -1.649 825 HD23 LEU 100 2HD2 LEU 100 11.343 -1.311 -2.394 826 H THR 101 H THR 101 13.083 2.210 -5.908 827 HA THR 101 HA THR 101 14.831 0.609 -7.702 828 HB THR 101 HB THR 101 15.627 2.803 -8.662 829 HG1 THR 101 HG1 THR 101 13.949 4.482 -8.395 830 HG21 THR 101 3HG2 THR 101 13.617 3.105 -10.118 831 HG22 THR 101 1HG2 THR 101 12.717 2.041 -9.034 832 HG23 THR 101 2HG2 THR 101 14.096 1.416 -9.939 833 H ALA 102 H ALA 102 16.751 0.246 -6.872 834 HA ALA 102 HA ALA 102 17.509 1.475 -4.343 835 HB1 ALA 102 3HB ALA 102 19.293 -0.150 -4.308 836 HB2 ALA 102 1HB ALA 102 19.036 -0.537 -6.012 837 HB3 ALA 102 2HB ALA 102 17.811 -0.963 -4.816 838 H LEU 103 H LEU 103 18.366 3.464 -4.456 839 HA LEU 103 HA LEU 103 20.066 4.266 -6.709 840 HB2 LEU 103 1HB LEU 103 19.231 5.929 -4.322 841 HB3 LEU 103 2HB LEU 103 19.801 6.494 -5.894 842 HG LEU 103 HG LEU 103 17.210 5.010 -5.355 843 HD11 LEU 103 1HD1 LEU 103 17.805 7.882 -6.112 844 HD12 LEU 103 2HD1 LEU 103 17.131 7.308 -4.588 845 HD13 LEU 103 3HD1 LEU 103 16.194 7.171 -6.071 846 HD21 LEU 103 3HD2 LEU 103 17.879 4.348 -7.546 847 HD22 LEU 103 1HD2 LEU 103 18.524 5.945 -7.927 848 HD23 LEU 103 2HD2 LEU 103 16.782 5.693 -7.814 849 H LYS 104 H LYS 104 22.007 5.623 -6.092 850 HA LYS 104 HA LYS 104 23.890 4.002 -4.751 851 HB2 LYS 104 1HB LYS 104 24.019 6.887 -5.633 852 HB3 LYS 104 2HB LYS 104 25.412 5.984 -5.031 853 HG2 LYS 104 1HG LYS 104 24.987 4.271 -6.834 854 HG3 LYS 104 2HG LYS 104 23.753 5.344 -7.490 855 HD2 LYS 104 1HD LYS 104 26.674 6.088 -7.093 856 HD3 LYS 104 2HD LYS 104 25.961 5.597 -8.626 857 HE2 LYS 104 1HE LYS 104 24.284 7.545 -8.264 858 HE3 LYS 104 2HE LYS 104 25.424 8.115 -7.043 859 HZ1 LYS 104 3HZ LYS 104 26.049 7.588 -9.896 860 HZ2 LYS 104 1HZ LYS 104 27.172 8.079 -8.724 861 HZ3 LYS 104 2HZ LYS 104 25.899 9.116 -9.166 862 H LYS 105 H LYS 105 22.148 6.879 -3.664 863 HA LYS 105 HA LYS 105 23.568 6.977 -1.113 864 HB2 LYS 105 1HB LYS 105 22.773 9.050 -2.280 865 HB3 LYS 105 2HB LYS 105 21.112 8.523 -1.988 866 HG2 LYS 105 1HG LYS 105 21.452 8.598 0.417 867 HG3 LYS 105 2HG LYS 105 23.170 8.923 0.206 868 HD2 LYS 105 1HD LYS 105 22.068 11.013 0.731 869 HD3 LYS 105 2HD LYS 105 22.579 11.065 -0.954 870 HE2 LYS 105 1HE LYS 105 20.353 10.755 -1.744 871 HE3 LYS 105 2HE LYS 105 19.780 10.192 -0.171 872 HZ1 LYS 105 3HZ LYS 105 19.112 12.474 -0.590 873 HZ2 LYS 105 1HZ LYS 105 20.730 12.939 -0.793 874 HZ3 LYS 105 2HZ LYS 105 20.188 12.401 0.724 875 H GLY 106 H GLY 106 20.477 5.836 -2.357 876 HA2 GLY 106 1HA GLY 106 20.067 4.072 -0.180 877 HA3 GLY 106 2HA GLY 106 19.078 5.515 0.032 878 H VAL 107 H VAL 107 17.072 4.722 -0.372 879 HA VAL 107 HA VAL 107 16.529 3.688 -3.107 880 HB VAL 107 HB VAL 107 16.536 1.750 -1.671 881 HG11 VAL 107 1HG1 VAL 107 15.131 1.614 0.333 882 HG12 VAL 107 2HG1 VAL 107 14.596 3.275 0.085 883 HG13 VAL 107 3HG1 VAL 107 16.282 2.939 0.478 884 HG21 VAL 107 3HG2 VAL 107 14.659 1.988 -3.355 885 HG22 VAL 107 1HG2 VAL 107 13.632 2.571 -2.045 886 HG23 VAL 107 2HG2 VAL 107 14.275 0.940 -1.989 887 H GLU 108 H GLU 108 14.764 4.465 -4.065 888 HA GLU 108 HA GLU 108 13.138 6.476 -2.609 889 HB2 GLU 108 1HB GLU 108 12.538 7.300 -4.875 890 HB3 GLU 108 2HB GLU 108 14.268 7.387 -4.553 891 HG2 GLU 108 1HG GLU 108 14.630 5.315 -5.812 892 HG3 GLU 108 2HG GLU 108 12.900 5.161 -6.096 893 H VAL 109 H VAL 109 10.962 6.325 -2.564 894 HA VAL 109 HA VAL 109 9.687 3.913 -3.756 895 HB VAL 109 HB VAL 109 9.956 3.633 -1.331 896 HG11 VAL 109 1HG1 VAL 109 9.976 6.059 -0.770 897 HG12 VAL 109 2HG1 VAL 109 8.851 5.141 0.232 898 HG13 VAL 109 3HG1 VAL 109 8.246 6.126 -1.100 899 HG21 VAL 109 3HG2 VAL 109 7.912 2.799 -2.579 900 HG22 VAL 109 1HG2 VAL 109 7.059 4.236 -2.013 901 HG23 VAL 109 2HG2 VAL 109 7.661 3.052 -0.852 902 H GLU 110 H GLU 110 7.791 4.178 -4.757 903 HA GLU 110 HA GLU 110 6.463 6.835 -4.668 904 HB2 GLU 110 1HB GLU 110 7.937 6.732 -6.663 905 HB3 GLU 110 2HB GLU 110 7.076 5.290 -7.201 906 HG2 GLU 110 1HG GLU 110 4.990 6.533 -7.363 907 HG3 GLU 110 2HG GLU 110 5.748 7.965 -6.666 908 H LEU 111 H LEU 111 4.350 6.735 -4.500 909 HA LEU 111 HA LEU 111 2.918 4.216 -5.152 910 HB2 LEU 111 1HB LEU 111 3.303 4.536 -2.689 911 HB3 LEU 111 2HB LEU 111 2.367 6.015 -2.771 912 HG LEU 111 HG LEU 111 1.031 3.581 -3.936 913 HD11 LEU 111 1HD1 LEU 111 1.303 3.905 -0.935 914 HD12 LEU 111 2HD1 LEU 111 2.099 2.653 -1.889 915 HD13 LEU 111 3HD1 LEU 111 0.340 2.697 -1.784 916 HD21 LEU 111 3HD2 LEU 111 -0.945 4.526 -2.887 917 HD22 LEU 111 1HD2 LEU 111 -0.105 5.814 -3.743 918 HD23 LEU 111 2HD2 LEU 111 0.030 5.690 -1.995 919 H THR 112 H THR 112 1.103 4.463 -6.308 920 HA THR 112 HA THR 112 -0.046 7.191 -6.631 921 HB THR 112 HB THR 112 -0.348 6.744 -9.021 922 HG1 THR 112 HG1 THR 112 0.639 4.291 -8.211 923 HG21 THR 112 3HG2 THR 112 1.709 7.879 -8.155 924 HG22 THR 112 1HG2 THR 112 1.970 7.028 -9.675 925 HG23 THR 112 2HG2 THR 112 2.526 6.316 -8.161 926 H GLN 113 H GLN 113 -2.206 7.313 -7.081 927 HA GLN 113 HA GLN 113 -3.835 4.858 -7.108 928 HB2 GLN 113 1HB GLN 113 -3.528 5.539 -4.703 929 HB3 GLN 113 2HB GLN 113 -4.317 7.067 -5.088 930 HG2 GLN 113 1HG GLN 113 -6.315 5.778 -5.890 931 HG3 GLN 113 2HG GLN 113 -5.524 4.298 -5.358 932 HE21 GLN 113 2HE2 GLN 113 -7.315 7.094 -4.307 933 HE22 GLN 113 1HE2 GLN 113 -7.345 6.699 -2.656 934 H ASP 114 H ASP 114 -4.921 5.163 -8.944 935 HA ASP 114 HA ASP 114 -5.702 7.792 -9.875 936 HB2 ASP 114 1HB ASP 114 -6.458 6.630 -11.852 937 HB3 ASP 114 2HB ASP 114 -4.894 5.976 -11.379 938 H ASN 115 H ASN 115 -8.030 7.465 -11.088 939 HA ASN 115 HA ASN 115 -10.278 7.637 -10.896 940 HB2 ASN 115 1HB ASN 115 -10.057 5.203 -10.355 941 HB3 ASN 115 2HB ASN 115 -10.083 5.640 -8.647 942 HD21 ASN 115 2HD2 ASN 115 -12.132 4.735 -8.140 943 HD22 ASN 115 1HD2 ASN 115 -13.576 5.303 -8.812 944 H ASN 116 H ASN 116 -8.748 9.556 -9.373 945 HA ASN 116 HA ASN 116 -10.183 9.904 -6.846 946 HB2 ASN 116 1HB ASN 116 -8.253 11.685 -8.361 947 HB3 ASN 116 2HB ASN 116 -8.968 12.108 -6.811 948 HD21 ASN 116 2HD2 ASN 116 -6.095 11.662 -7.304 949 HD22 ASN 116 1HD2 ASN 116 -5.638 10.347 -6.335 950 H GLU 117 H GLU 117 -12.198 10.784 -6.778 951 HA GLU 117 HA GLU 117 -13.517 11.694 -9.108 952 HB2 GLU 117 1HB GLU 117 -14.672 10.665 -7.170 953 HB3 GLU 117 2HB GLU 117 -14.369 12.134 -6.242 954 HG2 GLU 117 1HG GLU 117 -15.655 13.453 -7.861 955 HG3 GLU 117 2HG GLU 117 -15.892 12.023 -8.866 956 H THR 118 H THR 118 -11.917 13.455 -6.502 957 HA THR 118 HA THR 118 -11.895 15.865 -8.174 958 HB THR 118 HB THR 118 -13.927 16.299 -7.007 959 HG1 THR 118 HG1 THR 118 -11.776 17.502 -5.605 960 HG21 THR 118 3HG2 THR 118 -12.451 15.381 -4.532 961 HG22 THR 118 1HG2 THR 118 -13.821 14.586 -5.301 962 HG23 THR 118 2HG2 THR 118 -14.034 16.147 -4.506 963 H GLU 119 H GLU 119 -10.599 17.619 -7.113 964 HA GLU 119 HA GLU 119 -8.030 16.700 -6.452 965 HB2 GLU 119 1HB GLU 119 -9.347 19.385 -5.948 966 HB3 GLU 119 2HB GLU 119 -7.626 19.074 -5.723 967 HG2 GLU 119 1HG GLU 119 -7.357 18.514 -8.058 968 HG3 GLU 119 2HG GLU 119 -9.095 18.599 -8.333 969 H LYS 120 H LYS 120 -10.766 17.645 -4.461 970 HA LYS 120 HA LYS 120 -9.524 17.702 -1.945 971 HB2 LYS 120 1HB LYS 120 -11.855 18.464 -2.407 972 HB3 LYS 120 2HB LYS 120 -12.341 16.779 -2.578 973 HG2 LYS 120 1HG LYS 120 -11.682 16.319 -0.265 974 HG3 LYS 120 2HG LYS 120 -11.090 17.973 -0.084 975 HD2 LYS 120 1HD LYS 120 -13.372 18.829 -0.516 976 HD3 LYS 120 2HD LYS 120 -13.959 17.172 -0.667 977 HE2 LYS 120 1HE LYS 120 -13.287 16.705 1.651 978 HE3 LYS 120 2HE LYS 120 -12.658 18.346 1.810 979 HZ1 LYS 120 3HZ LYS 120 -15.086 18.918 1.007 980 HZ2 LYS 120 1HZ LYS 120 -14.728 18.656 2.644 981 HZ3 LYS 120 2HZ LYS 120 -15.426 17.413 1.719 982 H GLU 121 H GLU 121 -10.914 15.008 -3.789 983 HA GLU 121 HA GLU 121 -10.462 13.023 -1.785 984 HB2 GLU 121 1HB GLU 121 -12.123 12.776 -3.625 985 HB3 GLU 121 2HB GLU 121 -10.789 12.654 -4.772 986 HG2 GLU 121 1HG GLU 121 -9.957 10.647 -3.658 987 HG3 GLU 121 2HG GLU 121 -11.185 10.800 -2.402 988 H GLN 122 H GLN 122 -8.626 14.155 -4.597 989 HA GLN 122 HA GLN 122 -6.580 12.195 -4.484 990 HB2 GLN 122 1HB GLN 122 -6.936 13.688 -6.443 991 HB3 GLN 122 2HB GLN 122 -6.406 15.059 -5.476 992 HG2 GLN 122 1HG GLN 122 -4.192 13.955 -5.155 993 HG3 GLN 122 2HG GLN 122 -4.734 12.618 -6.162 994 HE21 GLN 122 2HE2 GLN 122 -3.957 12.814 -8.259 995 HE22 GLN 122 1HE2 GLN 122 -3.717 14.281 -9.077 996 H LYS 123 H LYS 123 -6.823 15.481 -3.168 997 HA LYS 123 HA LYS 123 -4.339 15.537 -1.860 998 HB2 LYS 123 1HB LYS 123 -6.201 17.397 -2.271 999 HB3 LYS 123 2HB LYS 123 -6.758 16.918 -0.674 1000 HG2 LYS 123 1HG LYS 123 -3.978 17.921 -1.394 1001 HG3 LYS 123 2HG LYS 123 -5.207 18.797 -0.484 1002 HD2 LYS 123 1HD LYS 123 -5.122 16.853 1.203 1003 HD3 LYS 123 2HD LYS 123 -3.662 16.335 0.359 1004 HE2 LYS 123 1HE LYS 123 -4.043 19.074 1.588 1005 HE3 LYS 123 2HE LYS 123 -3.140 17.751 2.326 1006 HZ1 LYS 123 3HZ LYS 123 -2.341 19.544 0.263 1007 HZ2 LYS 123 1HZ LYS 123 -2.172 17.931 -0.228 1008 HZ3 LYS 123 2HZ LYS 123 -1.401 18.474 1.186 1009 H HIS 124 H HIS 124 -7.558 14.563 -0.730 1010 HA HIS 124 HA HIS 124 -6.929 13.865 1.902 1011 HB2 HIS 124 1HB HIS 124 -9.228 14.063 0.994 1012 HB3 HIS 124 2HB HIS 124 -8.961 12.607 0.038 1013 HD1 HIS 124 HD1 HIS 124 -8.979 13.701 3.687 1014 HD2 HIS 124 HD2 HIS 124 -9.529 10.267 1.389 1015 HE1 HIS 124 HE1 HIS 124 -9.742 11.887 5.282 1016 HE2 HIS 124 HE2 HIS 124 -10.081 9.786 3.895 1017 H SER 125 H SER 125 -6.716 12.062 -1.120 1018 HA SER 125 HA SER 125 -5.978 9.563 0.031 1019 HB2 SER 125 1HB SER 125 -6.847 10.033 -2.348 1020 HB3 SER 125 2HB SER 125 -5.193 10.488 -2.741 1021 HG SER 125 HG SER 125 -5.450 8.306 -3.145 1022 H GLU 126 H GLU 126 -4.058 12.046 -1.650 1023 HA GLU 126 HA GLU 126 -1.519 10.990 -1.220 1024 HB2 GLU 126 1HB GLU 126 -2.441 13.871 -1.405 1025 HB3 GLU 126 2HB GLU 126 -0.748 13.378 -1.440 1026 HG2 GLU 126 1HG GLU 126 -1.105 12.083 -3.444 1027 HG3 GLU 126 2HG GLU 126 -2.839 12.346 -3.374 1028 H ASP 127 H ASP 127 -3.442 13.170 0.825 1029 HA ASP 127 HA ASP 127 -1.521 13.559 2.853 1030 HB2 ASP 127 1HB ASP 127 -3.610 14.903 2.563 1031 HB3 ASP 127 2HB ASP 127 -4.535 13.521 3.147 1032 H ASN 128 H ASN 128 -4.002 11.089 2.359 1033 HA ASN 128 HA ASN 128 -3.628 9.769 4.865 1034 HB2 ASN 128 1HB ASN 128 -5.677 9.494 3.538 1035 HB3 ASN 128 2HB ASN 128 -4.750 8.735 2.247 1036 HD21 ASN 128 2HD2 ASN 128 -5.029 6.506 2.307 1037 HD22 ASN 128 1HD2 ASN 128 -5.144 5.576 3.720 1038 H TRP 129 H TRP 129 -2.535 9.022 1.556 1039 HA TRP 129 HA TRP 129 -0.968 6.787 2.290 1040 HB2 TRP 129 1HB TRP 129 -0.828 8.641 -0.106 1041 HB3 TRP 129 2HB TRP 129 0.188 7.211 0.065 1042 HD1 TRP 129 HD1 TRP 129 -3.079 8.213 -1.267 1043 HE1 TRP 129 HE1 TRP 129 -4.600 6.164 -1.646 1044 HE3 TRP 129 HE3 TRP 129 -0.438 4.667 1.287 1045 HZ2 TRP 129 HZ2 TRP 129 -4.684 3.390 -0.954 1046 HZ3 TRP 129 HZ3 TRP 129 -1.258 2.333 1.410 1047 HH2 TRP 129 HH2 TRP 129 -3.377 1.689 0.294 1048 H ASN 130 H ASN 130 -0.220 10.240 2.056 1049 HA ASN 130 HA ASN 130 2.561 10.072 2.439 1050 HB2 ASN 130 1HB ASN 130 0.530 12.181 3.223 1051 HB3 ASN 130 2HB ASN 130 2.253 12.387 3.526 1052 HD21 ASN 130 2HD2 ASN 130 0.695 14.053 1.709 1053 HD22 ASN 130 1HD2 ASN 130 1.330 13.823 0.154 1054 H THR 131 H THR 131 -0.139 10.076 4.723 1055 HA THR 131 HA THR 131 1.365 10.130 7.103 1056 HB THR 131 HB THR 131 -1.277 8.697 6.726 1057 HG1 THR 131 HG1 THR 131 -0.775 11.442 7.217 1058 HG21 THR 131 3HG2 THR 131 -1.622 9.292 9.055 1059 HG22 THR 131 1HG2 THR 131 -0.108 10.197 9.081 1060 HG23 THR 131 2HG2 THR 131 -0.085 8.443 8.901 1061 H MET 132 H MET 132 0.303 7.519 4.988 1062 HA MET 132 HA MET 132 1.192 5.366 6.617 1063 HB2 MET 132 1HB MET 132 -0.397 5.173 4.662 1064 HB3 MET 132 2HB MET 132 0.980 5.402 3.591 1065 HG2 MET 132 1HG MET 132 0.998 3.211 5.683 1066 HG3 MET 132 2HG MET 132 0.253 2.966 4.110 1067 HE1 MET 132 3HE MET 132 2.269 1.104 5.011 1068 HE2 MET 132 1HE MET 132 3.532 0.995 3.775 1069 HE3 MET 132 2HE MET 132 1.835 1.032 3.305 1070 H LEU 133 H LEU 133 2.667 7.085 3.881 1071 HA LEU 133 HA LEU 133 5.115 5.682 3.881 1072 HB2 LEU 133 1HB LEU 133 4.131 8.285 2.774 1073 HB3 LEU 133 2HB LEU 133 5.876 8.107 2.893 1074 HG LEU 133 HG LEU 133 5.033 7.416 0.681 1075 HD11 LEU 133 1HD1 LEU 133 6.528 5.719 0.479 1076 HD12 LEU 133 2HD1 LEU 133 5.845 4.769 1.788 1077 HD13 LEU 133 3HD1 LEU 133 6.933 6.106 2.143 1078 HD21 LEU 133 3HD2 LEU 133 3.580 5.478 0.427 1079 HD22 LEU 133 1HD2 LEU 133 2.800 6.653 1.464 1080 HD23 LEU 133 2HD2 LEU 133 3.540 5.224 2.164 1081 H GLU 134 H GLU 134 4.063 8.589 5.601 1082 HA GLU 134 HA GLU 134 6.560 9.159 6.829 1083 HB2 GLU 134 1HB GLU 134 3.692 9.841 7.531 1084 HB3 GLU 134 2HB GLU 134 5.037 10.374 8.536 1085 HG2 GLU 134 1HG GLU 134 4.850 10.944 5.564 1086 HG3 GLU 134 2HG GLU 134 4.285 12.059 6.804 1087 H GLY 135 H GLY 135 3.776 7.191 7.770 1088 HA2 GLY 135 1HA GLY 135 4.615 6.487 10.354 1089 HA3 GLY 135 2HA GLY 135 3.547 5.529 9.332 1090 H LEU 136 H LEU 136 5.410 5.191 7.186 1091 HA LEU 136 HA LEU 136 6.827 2.895 8.133 1092 HB2 LEU 136 1HB LEU 136 5.841 3.517 5.735 1093 HB3 LEU 136 2HB LEU 136 7.445 4.171 5.468 1094 HG LEU 136 HG LEU 136 7.445 1.901 4.675 1095 HD11 LEU 136 1HD1 LEU 136 9.301 1.010 5.843 1096 HD12 LEU 136 2HD1 LEU 136 8.799 1.722 7.367 1097 HD13 LEU 136 3HD1 LEU 136 9.419 2.751 6.073 1098 HD21 LEU 136 3HD2 LEU 136 6.818 0.649 7.332 1099 HD22 LEU 136 1HD2 LEU 136 6.468 0.083 5.705 1100 HD23 LEU 136 2HD2 LEU 136 5.462 1.320 6.438 1101 H LYS 137 H LYS 137 7.861 6.091 6.961 1102 HA LYS 137 HA LYS 137 10.623 5.705 7.247 1103 HB2 LYS 137 1HB LYS 137 9.537 7.621 6.051 1104 HB3 LYS 137 2HB LYS 137 9.132 8.318 7.623 1105 HG2 LYS 137 1HG LYS 137 11.612 8.227 8.181 1106 HG3 LYS 137 2HG LYS 137 11.903 7.783 6.504 1107 HD2 LYS 137 1HD LYS 137 10.550 10.324 7.470 1108 HD3 LYS 137 2HD LYS 137 12.184 10.203 6.820 1109 HE2 LYS 137 1HE LYS 137 10.963 10.896 4.934 1110 HE3 LYS 137 2HE LYS 137 10.961 9.150 4.722 1111 HZ1 LYS 137 3HZ LYS 137 8.774 9.082 4.978 1112 HZ2 LYS 137 1HZ LYS 137 8.772 10.775 4.868 1113 HZ3 LYS 137 2HZ LYS 137 8.824 10.024 6.391 1114 H LYS 138 H LYS 138 8.215 6.931 9.574 1115 HA LYS 138 HA LYS 138 10.000 7.535 11.655 1116 HB2 LYS 138 1HB LYS 138 7.085 6.767 11.668 1117 HB3 LYS 138 2HB LYS 138 7.955 7.258 13.125 1118 HG2 LYS 138 1HG LYS 138 8.524 9.404 12.094 1119 HG3 LYS 138 2HG LYS 138 7.717 8.927 10.605 1120 HD2 LYS 138 1HD LYS 138 5.583 8.717 11.824 1121 HD3 LYS 138 2HD LYS 138 6.393 9.200 13.315 1122 HE2 LYS 138 1HE LYS 138 6.973 11.365 12.332 1123 HE3 LYS 138 2HE LYS 138 6.231 10.891 10.803 1124 HZ1 LYS 138 3HZ LYS 138 4.961 11.567 13.357 1125 HZ2 LYS 138 1HZ LYS 138 4.191 10.444 12.347 1126 HZ3 LYS 138 2HZ LYS 138 4.520 12.011 11.777 1127 H PHE 139 H PHE 139 8.272 4.537 10.855 1128 HA PHE 139 HA PHE 139 9.187 3.107 13.160 1129 HB2 PHE 139 1HB PHE 139 7.148 2.495 11.878 1130 HB3 PHE 139 2HB PHE 139 8.176 2.007 10.533 1131 HD1 PHE 139 HD1 PHE 139 7.298 1.291 14.073 1132 HD2 PHE 139 HD2 PHE 139 9.396 -0.089 10.584 1133 HE1 PHE 139 HE1 PHE 139 7.629 -0.921 15.143 1134 HE2 PHE 139 HE2 PHE 139 9.725 -2.301 11.659 1135 HZ PHE 139 HZ PHE 139 8.841 -2.716 13.938 1136 H LEU 140 H LEU 140 10.194 3.211 9.762 1137 HA LEU 140 HA LEU 140 12.260 1.283 10.022 1138 HB2 LEU 140 1HB LEU 140 11.097 2.421 7.890 1139 HB3 LEU 140 2HB LEU 140 12.483 3.488 7.979 1140 HG LEU 140 HG LEU 140 13.041 1.660 6.488 1141 HD11 LEU 140 1HD1 LEU 140 15.086 0.974 7.444 1142 HD12 LEU 140 2HD1 LEU 140 14.446 0.965 9.071 1143 HD13 LEU 140 3HD1 LEU 140 14.739 2.499 8.244 1144 HD21 LEU 140 3HD2 LEU 140 12.868 -0.517 8.530 1145 HD22 LEU 140 1HD2 LEU 140 12.484 -0.542 6.813 1146 HD23 LEU 140 2HD2 LEU 140 11.317 0.084 7.964 1147 H GLU 141 H GLU 141 12.318 4.829 10.165 1148 HA GLU 141 HA GLU 141 15.153 4.978 10.639 1149 HB2 GLU 141 1HB GLU 141 14.869 7.306 10.697 1150 HB3 GLU 141 2HB GLU 141 13.517 6.799 9.683 1151 HG2 GLU 141 1HG GLU 141 12.137 6.739 11.859 1152 HG3 GLU 141 2HG GLU 141 13.464 7.616 12.605 1153 H ASN 142 H ASN 142 12.725 3.812 12.504 1154 HA ASN 142 HA ASN 142 13.131 4.967 15.037 1155 HB2 ASN 142 1HB ASN 142 11.241 3.432 14.341 1156 HB3 ASN 142 2HB ASN 142 12.367 2.085 14.508 1157 HD21 ASN 142 2HD2 ASN 142 10.696 4.649 16.325 1158 HD22 ASN 142 1HD2 ASN 142 10.913 3.933 17.847 1159 H LYS 143 H LYS 143 14.787 2.339 13.360 1160 HA LYS 143 HA LYS 143 16.246 1.172 15.356 1161 HB2 LYS 143 1HB LYS 143 17.948 0.666 13.665 1162 HB3 LYS 143 2HB LYS 143 16.326 0.446 13.014 1163 HG2 LYS 143 1HG LYS 143 16.458 2.698 11.968 1164 HG3 LYS 143 2HG LYS 143 18.107 2.865 12.573 1165 HD2 LYS 143 1HD LYS 143 18.788 0.863 11.305 1166 HD3 LYS 143 2HD LYS 143 17.140 0.686 10.698 1167 HE2 LYS 143 1HE LYS 143 17.295 2.879 9.595 1168 HE3 LYS 143 2HE LYS 143 18.930 3.089 10.223 1169 HZ1 LYS 143 3HZ LYS 143 18.024 0.950 8.368 1170 HZ2 LYS 143 1HZ LYS 143 19.587 1.078 9.017 1171 HZ3 LYS 143 2HZ LYS 143 19.001 2.281 7.966 1172 H VAL 144 H VAL 144 16.405 4.436 14.398 1173 HA VAL 144 HA VAL 144 19.078 5.085 14.965 1174 HB VAL 144 HB VAL 144 17.447 6.611 13.855 1175 HG11 VAL 144 1HG1 VAL 144 16.407 7.195 16.643 1176 HG12 VAL 144 2HG1 VAL 144 15.584 6.098 15.539 1177 HG13 VAL 144 3HG1 VAL 144 15.785 7.797 15.106 1178 HG21 VAL 144 3HG2 VAL 144 18.699 7.779 16.363 1179 HG22 VAL 144 1HG2 VAL 144 18.313 8.650 14.878 1180 HG23 VAL 144 2HG2 VAL 144 19.583 7.426 14.877 1181 H SER 145 H SER 145 16.245 4.851 17.083 1182 HA SER 145 HA SER 145 17.383 5.863 19.438 1183 HB2 SER 145 1HB SER 145 15.319 3.660 19.168 1184 HB3 SER 145 2HB SER 145 15.629 4.620 20.616 1185 HG SER 145 HG SER 145 14.824 5.643 18.091 1186 H ALA 146 H ALA 146 17.400 2.612 18.065 1187 HA ALA 146 HA ALA 146 18.691 1.326 20.249 1188 HB1 ALA 146 3HB ALA 146 17.398 0.157 18.451 1189 HB2 ALA 146 1HB ALA 146 19.002 -0.526 18.718 1190 HB3 ALA 146 2HB ALA 146 18.708 0.520 17.328
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