NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
512665 | 2lci | 17613 | 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 1.911 7.826 16.914 2 H2 MET 1 2H MET 1 0.733 8.288 15.795 3 H3 MET 1 3H MET 1 1.971 9.367 16.206 4 HA MET 1 HA MET 1 2.375 8.408 14.054 5 HB2 MET 1 2HB MET 1 4.345 8.959 15.400 6 HB3 MET 1 3HB MET 1 4.241 7.430 16.261 7 HG2 MET 1 2HG MET 1 4.721 6.257 14.069 8 HG3 MET 1 3HG MET 1 5.016 7.840 13.353 9 HE1 MET 1 3HE MET 1 6.987 9.499 14.275 10 HE2 MET 1 1HE MET 1 8.077 9.034 15.580 11 HE3 MET 1 2HE MET 1 6.367 9.296 15.915 12 H LYS 2 H LYS 2 2.061 6.681 12.725 13 HA LYS 2 HA LYS 2 3.085 4.160 13.160 14 HB2 LYS 2 2HB LYS 2 0.985 2.722 13.076 15 HB3 LYS 2 3HB LYS 2 1.300 3.513 14.616 16 HG2 LYS 2 2HG LYS 2 -0.367 5.324 13.851 17 HG3 LYS 2 3HG LYS 2 -0.822 4.200 12.566 18 HD2 LYS 2 2HD LYS 2 -0.931 3.576 15.544 19 HD3 LYS 2 3HD LYS 2 -2.312 4.071 14.564 20 HE2 LYS 2 2HE LYS 2 -2.169 2.048 13.238 21 HE3 LYS 2 3HE LYS 2 -0.670 1.578 14.044 22 HZ1 LYS 2 3HZ LYS 2 -2.543 0.397 14.960 23 HZ2 LYS 2 1HZ LYS 2 -3.324 1.845 15.347 24 HZ3 LYS 2 2HZ LYS 2 -1.885 1.423 16.129 25 H ILE 3 H ILE 3 3.452 3.336 11.184 26 HA ILE 3 HA ILE 3 2.542 5.020 8.934 27 HB ILE 3 HB ILE 3 5.086 3.347 9.190 28 HG12 ILE 3 2HG1 ILE 3 4.793 6.381 9.439 29 HG13 ILE 3 3HG1 ILE 3 4.907 5.297 10.820 30 HG21 ILE 3 1HG2 ILE 3 5.848 4.636 7.201 31 HG22 ILE 3 2HG2 ILE 3 4.268 5.409 7.104 32 HG23 ILE 3 3HG2 ILE 3 4.415 3.669 6.846 33 HD11 ILE 3 3HD1 ILE 3 7.132 4.599 10.061 34 HD12 ILE 3 1HD1 ILE 3 7.015 6.324 10.401 35 HD13 ILE 3 2HD1 ILE 3 7.021 5.758 8.732 36 H LEU 4 H LEU 4 1.372 4.090 7.368 37 HA LEU 4 HA LEU 4 1.169 1.138 7.212 38 HB2 LEU 4 2HB LEU 4 -0.844 3.185 6.170 39 HB3 LEU 4 3HB LEU 4 -1.084 1.454 6.374 40 HG LEU 4 HG LEU 4 -0.815 3.494 8.628 41 HD11 LEU 4 1HD1 LEU 4 -2.939 3.713 7.481 42 HD12 LEU 4 2HD1 LEU 4 -3.171 3.042 9.093 43 HD13 LEU 4 3HD1 LEU 4 -3.258 1.986 7.677 44 HD21 LEU 4 3HD2 LEU 4 0.098 1.341 9.333 45 HD22 LEU 4 1HD2 LEU 4 -1.384 0.522 8.833 46 HD23 LEU 4 2HD2 LEU 4 -1.414 1.680 10.168 47 H ILE 5 H ILE 5 2.609 0.570 5.644 48 HA ILE 5 HA ILE 5 3.127 2.187 3.288 49 HB ILE 5 HB ILE 5 4.020 -0.684 3.851 50 HG12 ILE 5 2HG1 ILE 5 4.837 0.862 5.638 51 HG13 ILE 5 3HG1 ILE 5 6.157 0.215 4.674 52 HG21 ILE 5 1HG2 ILE 5 5.808 -0.233 2.177 53 HG22 ILE 5 2HG2 ILE 5 5.099 1.354 1.863 54 HG23 ILE 5 3HG2 ILE 5 4.192 -0.109 1.475 55 HD11 ILE 5 3HD1 ILE 5 6.510 2.536 5.185 56 HD12 ILE 5 1HD1 ILE 5 4.973 2.977 4.448 57 HD13 ILE 5 2HD1 ILE 5 6.283 2.338 3.449 58 H LEU 6 H LEU 6 1.520 2.246 1.777 59 HA LEU 6 HA LEU 6 -0.450 0.078 1.635 60 HB2 LEU 6 2HB LEU 6 -0.802 2.787 1.692 61 HB3 LEU 6 3HB LEU 6 -0.712 2.575 -0.039 62 HG LEU 6 HG LEU 6 -3.032 2.570 0.496 63 HD11 LEU 6 1HD1 LEU 6 -2.315 -0.365 0.222 64 HD12 LEU 6 2HD1 LEU 6 -2.482 0.793 -1.099 65 HD13 LEU 6 3HD1 LEU 6 -3.885 0.374 -0.120 66 HD21 LEU 6 3HD2 LEU 6 -4.051 1.188 2.246 67 HD22 LEU 6 1HD2 LEU 6 -2.857 2.304 2.900 68 HD23 LEU 6 2HD2 LEU 6 -2.459 0.594 2.718 69 H ILE 7 H ILE 7 -0.274 -1.406 0.021 70 HA ILE 7 HA ILE 7 1.051 -0.696 -2.520 71 HB ILE 7 HB ILE 7 1.416 -3.355 -1.046 72 HG12 ILE 7 2HG1 ILE 7 3.482 -1.153 -1.544 73 HG13 ILE 7 3HG1 ILE 7 2.708 -1.468 0.005 74 HG21 ILE 7 1HG2 ILE 7 3.022 -3.889 -2.872 75 HG22 ILE 7 2HG2 ILE 7 2.599 -2.380 -3.677 76 HG23 ILE 7 3HG2 ILE 7 1.386 -3.648 -3.487 77 HD11 ILE 7 3HD1 ILE 7 4.933 -2.380 -0.055 78 HD12 ILE 7 1HD1 ILE 7 4.538 -3.351 -1.473 79 HD13 ILE 7 2HD1 ILE 7 3.744 -3.674 0.071 80 H ASN 8 H ASN 8 -0.380 -0.929 -4.086 81 HA ASN 8 HA ASN 8 -2.396 -3.087 -4.057 82 HB2 ASN 8 2HB ASN 8 -3.429 -0.901 -4.332 83 HB3 ASN 8 3HB ASN 8 -2.278 -0.448 -5.580 84 HD21 ASN 8 1HD2 ASN 8 -5.050 -2.469 -4.833 85 HD22 ASN 8 2HD2 ASN 8 -5.527 -2.749 -6.470 86 H THR 9 H THR 9 -1.716 -4.785 -5.171 87 HA THR 9 HA THR 9 -0.183 -4.396 -7.675 88 HB THR 9 HB THR 9 1.355 -5.372 -6.085 89 HG1 THR 9 HG1 THR 9 1.897 -6.418 -7.829 90 HG21 THR 9 3HG2 THR 9 -0.682 -7.585 -5.606 91 HG22 THR 9 1HG2 THR 9 -0.219 -6.342 -4.441 92 HG23 THR 9 2HG2 THR 9 0.963 -7.543 -4.967 93 H ASN 10 H ASN 10 -0.762 -5.715 -9.386 94 HA ASN 10 HA ASN 10 -3.468 -6.766 -9.365 95 HB2 ASN 10 2HB ASN 10 -2.622 -5.367 -11.231 96 HB3 ASN 10 3HB ASN 10 -1.360 -6.550 -11.560 97 HD21 ASN 10 1HD2 ASN 10 -2.042 -6.777 -13.684 98 HD22 ASN 10 2HD2 ASN 10 -3.486 -7.620 -14.123 99 H ASN 11 H ASN 11 -0.335 -8.021 -8.837 100 HA ASN 11 HA ASN 11 -1.118 -10.793 -9.585 101 HB2 ASN 11 2HB ASN 11 1.695 -9.693 -9.176 102 HB3 ASN 11 3HB ASN 11 1.294 -11.339 -9.649 103 HD21 ASN 11 1HD2 ASN 11 2.181 -11.446 -11.642 104 HD22 ASN 11 2HD2 ASN 11 1.781 -10.395 -12.955 105 H ASP 12 H ASP 12 -1.338 -12.290 -8.065 106 HA ASP 12 HA ASP 12 -1.035 -11.875 -5.267 107 HB2 ASP 12 2HB ASP 12 -1.336 -14.481 -6.827 108 HB3 ASP 12 3HB ASP 12 -1.452 -14.346 -5.072 109 H GLU 13 H GLU 13 1.091 -13.005 -7.754 110 HA GLU 13 HA GLU 13 3.120 -14.320 -6.350 111 HB2 GLU 13 2HB GLU 13 3.336 -12.471 -8.764 112 HB3 GLU 13 3HB GLU 13 4.596 -13.590 -8.243 113 HG2 GLU 13 2HG GLU 13 3.356 -15.493 -8.871 114 HG3 GLU 13 3HG GLU 13 1.830 -14.607 -8.909 115 H LEU 14 H LEU 14 2.680 -10.866 -7.071 116 HA LEU 14 HA LEU 14 5.012 -9.907 -5.835 117 HB2 LEU 14 2HB LEU 14 2.459 -8.660 -6.784 118 HB3 LEU 14 3HB LEU 14 3.425 -7.711 -5.675 119 HG LEU 14 HG LEU 14 3.941 -7.086 -7.967 120 HD11 LEU 14 1HD1 LEU 14 5.736 -6.961 -6.289 121 HD12 LEU 14 2HD1 LEU 14 6.360 -7.269 -7.903 122 HD13 LEU 14 3HD1 LEU 14 6.275 -8.586 -6.733 123 HD21 LEU 14 3HD2 LEU 14 4.801 -9.964 -8.442 124 HD22 LEU 14 1HD2 LEU 14 4.958 -8.621 -9.578 125 HD23 LEU 14 2HD2 LEU 14 3.365 -9.190 -9.107 126 H ILE 15 H ILE 15 1.777 -10.546 -4.507 127 HA ILE 15 HA ILE 15 1.955 -9.140 -2.090 128 HB ILE 15 HB ILE 15 0.536 -11.816 -2.499 129 HG12 ILE 15 2HG1 ILE 15 -0.542 -8.986 -2.919 130 HG13 ILE 15 3HG1 ILE 15 -0.173 -10.141 -4.196 131 HG21 ILE 15 1HG2 ILE 15 -0.937 -11.111 -0.635 132 HG22 ILE 15 2HG2 ILE 15 0.010 -9.637 -0.433 133 HG23 ILE 15 3HG2 ILE 15 0.746 -11.208 -0.112 134 HD11 ILE 15 3HD1 ILE 15 -2.539 -10.043 -3.814 135 HD12 ILE 15 1HD1 ILE 15 -2.332 -10.425 -2.104 136 HD13 ILE 15 2HD1 ILE 15 -1.935 -11.628 -3.337 137 H LYS 16 H LYS 16 2.829 -12.536 -2.785 138 HA LYS 16 HA LYS 16 3.781 -13.078 -0.141 139 HB2 LYS 16 2HB LYS 16 4.485 -15.264 -1.024 140 HB3 LYS 16 3HB LYS 16 2.833 -14.872 -1.493 141 HG2 LYS 16 2HG LYS 16 3.681 -14.158 -3.734 142 HG3 LYS 16 3HG LYS 16 5.297 -14.691 -3.256 143 HD2 LYS 16 2HD LYS 16 4.415 -17.009 -2.970 144 HD3 LYS 16 3HD LYS 16 2.824 -16.449 -3.498 145 HE2 LYS 16 2HE LYS 16 3.838 -15.773 -5.680 146 HE3 LYS 16 3HE LYS 16 5.373 -16.464 -5.145 147 HZ1 LYS 16 3HZ LYS 16 4.285 -18.605 -4.948 148 HZ2 LYS 16 1HZ LYS 16 4.150 -18.003 -6.521 149 HZ3 LYS 16 2HZ LYS 16 2.823 -17.940 -5.476 150 H LYS 17 H LYS 17 5.385 -12.096 -3.178 151 HA LYS 17 HA LYS 17 8.061 -12.561 -2.315 152 HB2 LYS 17 2HB LYS 17 7.070 -10.567 -4.407 153 HB3 LYS 17 3HB LYS 17 8.752 -11.041 -4.168 154 HG2 LYS 17 2HG LYS 17 8.087 -13.412 -4.708 155 HG3 LYS 17 3HG LYS 17 6.482 -12.817 -5.104 156 HD2 LYS 17 2HD LYS 17 7.637 -13.029 -7.188 157 HD3 LYS 17 3HD LYS 17 7.590 -11.299 -6.841 158 HE2 LYS 17 2HE LYS 17 9.915 -11.377 -6.043 159 HE3 LYS 17 3HE LYS 17 9.959 -13.124 -6.280 160 HZ1 LYS 17 3HZ LYS 17 11.038 -11.965 -8.086 161 HZ2 LYS 17 1HZ LYS 17 9.629 -11.093 -8.425 162 HZ3 LYS 17 2HZ LYS 17 9.663 -12.768 -8.653 163 H ILE 18 H ILE 18 5.934 -9.744 -2.134 164 HA ILE 18 HA ILE 18 7.710 -7.902 -0.908 165 HB ILE 18 HB ILE 18 4.663 -8.027 -0.930 166 HG12 ILE 18 2HG1 ILE 18 6.537 -6.110 -2.389 167 HG13 ILE 18 3HG1 ILE 18 5.909 -7.589 -3.103 168 HG21 ILE 18 1HG2 ILE 18 4.610 -5.697 -0.081 169 HG22 ILE 18 2HG2 ILE 18 6.360 -5.740 0.141 170 HG23 ILE 18 3HG2 ILE 18 5.326 -6.796 1.103 171 HD11 ILE 18 3HD1 ILE 18 3.633 -6.728 -2.896 172 HD12 ILE 18 1HD1 ILE 18 4.665 -5.673 -3.861 173 HD13 ILE 18 2HD1 ILE 18 4.263 -5.230 -2.202 174 H LYS 19 H LYS 19 5.459 -10.344 0.432 175 HA LYS 19 HA LYS 19 5.631 -9.755 3.162 176 HB2 LYS 19 2HB LYS 19 5.297 -12.416 1.726 177 HB3 LYS 19 3HB LYS 19 5.247 -12.298 3.483 178 HG2 LYS 19 2HG LYS 19 3.257 -10.913 3.400 179 HG3 LYS 19 3HG LYS 19 3.351 -10.804 1.638 180 HD2 LYS 19 2HD LYS 19 2.966 -13.237 1.447 181 HD3 LYS 19 3HD LYS 19 2.920 -13.385 3.203 182 HE2 LYS 19 2HE LYS 19 0.958 -11.659 1.666 183 HE3 LYS 19 3HE LYS 19 0.671 -13.367 1.988 184 HZ1 LYS 19 3HZ LYS 19 1.096 -11.280 4.056 185 HZ2 LYS 19 1HZ LYS 19 0.806 -12.919 4.344 186 HZ3 LYS 19 2HZ LYS 19 -0.387 -11.965 3.625 187 H LYS 20 H LYS 20 7.914 -11.521 1.076 188 HA LYS 20 HA LYS 20 9.660 -12.335 3.233 189 HB2 LYS 20 2HB LYS 20 10.344 -12.309 0.265 190 HB3 LYS 20 3HB LYS 20 11.076 -13.298 1.525 191 HG2 LYS 20 2HG LYS 20 8.286 -13.551 0.381 192 HG3 LYS 20 3HG LYS 20 9.621 -14.670 0.150 193 HD2 LYS 20 2HD LYS 20 8.363 -14.134 2.871 194 HD3 LYS 20 3HD LYS 20 7.766 -15.373 1.773 195 HE2 LYS 20 2HE LYS 20 9.180 -16.468 3.354 196 HE3 LYS 20 3HE LYS 20 10.072 -16.412 1.837 197 HZ1 LYS 20 3HZ LYS 20 11.325 -14.524 2.704 198 HZ2 LYS 20 1HZ LYS 20 11.479 -15.882 3.704 199 HZ3 LYS 20 2HZ LYS 20 10.469 -14.605 4.164 200 H GLU 21 H GLU 21 9.773 -9.885 0.660 201 HA GLU 21 HA GLU 21 12.175 -8.606 1.155 202 HB2 GLU 21 2HB GLU 21 9.556 -7.346 0.255 203 HB3 GLU 21 3HB GLU 21 11.109 -6.516 0.192 204 HG2 GLU 21 2HG GLU 21 10.474 -9.089 -1.288 205 HG3 GLU 21 3HG GLU 21 10.364 -7.478 -1.985 206 H VAL 22 H VAL 22 9.204 -8.315 2.979 207 HA VAL 22 HA VAL 22 10.312 -6.089 4.612 208 HB VAL 22 HB VAL 22 8.083 -5.404 5.103 209 HG11 VAL 22 1HG1 VAL 22 8.183 -6.246 2.174 210 HG12 VAL 22 2HG1 VAL 22 8.810 -4.750 2.856 211 HG13 VAL 22 3HG1 VAL 22 7.081 -5.050 2.847 212 HG21 VAL 22 3HG2 VAL 22 6.051 -6.663 4.390 213 HG22 VAL 22 1HG2 VAL 22 7.014 -7.542 5.579 214 HG23 VAL 22 2HG2 VAL 22 7.081 -8.004 3.878 215 H GLU 23 H GLU 23 10.044 -9.371 4.740 216 HA GLU 23 HA GLU 23 9.046 -9.984 7.319 217 HB2 GLU 23 2HB GLU 23 9.403 -11.612 5.432 218 HB3 GLU 23 3HB GLU 23 11.140 -11.484 5.680 219 HG2 GLU 23 2HG GLU 23 10.853 -12.434 7.967 220 HG3 GLU 23 3HG GLU 23 9.124 -12.603 7.657 221 H ASN 24 H ASN 24 12.302 -9.281 6.119 222 HA ASN 24 HA ASN 24 13.547 -9.419 8.749 223 HB2 ASN 24 2HB ASN 24 14.699 -8.670 6.021 224 HB3 ASN 24 3HB ASN 24 15.646 -8.780 7.501 225 HD21 ASN 24 1HD2 ASN 24 16.972 -10.398 6.664 226 HD22 ASN 24 2HD2 ASN 24 16.419 -12.013 6.410 227 H GLN 25 H GLN 25 11.679 -7.101 7.275 228 HA GLN 25 HA GLN 25 13.249 -4.775 8.226 229 HB2 GLN 25 2HB GLN 25 10.799 -4.818 6.407 230 HB3 GLN 25 3HB GLN 25 11.748 -3.397 6.832 231 HG2 GLN 25 2HG GLN 25 12.651 -5.754 5.157 232 HG3 GLN 25 3HG GLN 25 12.318 -4.118 4.604 233 HE21 GLN 25 1HE2 GLN 25 14.617 -6.205 6.098 234 HE22 GLN 25 2HE2 GLN 25 15.931 -5.089 6.130 235 H GLY 26 H GLY 26 10.680 -6.751 9.214 236 HA2 GLY 26 2HA GLY 26 9.352 -6.666 11.067 237 HA3 GLY 26 3HA GLY 26 10.116 -5.151 11.509 238 H TYR 27 H TYR 27 8.425 -5.588 8.440 239 HA TYR 27 HA TYR 27 6.250 -3.795 9.364 240 HB2 TYR 27 2HB TYR 27 7.432 -4.247 6.592 241 HB3 TYR 27 3HB TYR 27 5.860 -3.481 6.810 242 HD1 TYR 27 HD2 TYR 27 9.505 -3.087 7.392 243 HD2 TYR 27 HD1 TYR 27 5.677 -1.198 7.686 244 HE1 TYR 27 HE2 TYR 27 10.603 -0.931 7.807 245 HE2 TYR 27 HE1 TYR 27 6.780 0.961 8.104 246 HH TYR 27 HH TYR 27 10.099 1.478 7.620 247 H GLN 28 H GLN 28 4.501 -4.840 9.917 248 HA GLN 28 HA GLN 28 3.954 -7.568 9.211 249 HB2 GLN 28 2HB GLN 28 2.289 -5.528 10.753 250 HB3 GLN 28 3HB GLN 28 1.936 -7.252 10.653 251 HG2 GLN 28 2HG GLN 28 4.064 -7.750 11.806 252 HG3 GLN 28 3HG GLN 28 4.414 -6.027 11.911 253 HE21 GLN 28 1HE2 GLN 28 1.186 -7.402 12.434 254 HE22 GLN 28 2HE2 GLN 28 1.127 -7.039 14.118 255 H VAL 29 H VAL 29 3.252 -7.989 7.201 256 HA VAL 29 HA VAL 29 1.709 -6.257 5.548 257 HB VAL 29 HB VAL 29 2.217 -9.261 5.247 258 HG11 VAL 29 1HG1 VAL 29 0.232 -8.553 3.928 259 HG12 VAL 29 2HG1 VAL 29 1.577 -8.989 2.872 260 HG13 VAL 29 3HG1 VAL 29 1.195 -7.289 3.158 261 HG21 VAL 29 3HG2 VAL 29 3.962 -8.613 3.636 262 HG22 VAL 29 1HG2 VAL 29 4.292 -7.933 5.232 263 HG23 VAL 29 2HG2 VAL 29 3.635 -6.907 3.953 264 H ARG 30 H ARG 30 -0.432 -6.084 5.349 265 HA ARG 30 HA ARG 30 -2.281 -8.103 6.462 266 HB2 ARG 30 2HB ARG 30 -2.556 -5.064 6.318 267 HB3 ARG 30 3HB ARG 30 -3.875 -6.151 6.748 268 HG2 ARG 30 2HG ARG 30 -1.290 -5.814 8.306 269 HG3 ARG 30 3HG ARG 30 -2.856 -5.109 8.726 270 HD2 ARG 30 2HD ARG 30 -2.252 -8.084 8.553 271 HD3 ARG 30 3HD ARG 30 -2.382 -7.137 10.039 272 HE ARG 30 HE ARG 30 -4.727 -6.972 8.372 273 HH11 ARG 30 1HH1 ARG 30 -3.182 -8.898 10.897 274 HH12 ARG 30 2HH1 ARG 30 -4.679 -9.578 11.444 275 HH21 ARG 30 1HH2 ARG 30 -6.650 -7.869 9.101 276 HH22 ARG 30 2HH2 ARG 30 -6.641 -8.993 10.424 277 H ASP 31 H ASP 31 -3.126 -9.139 4.774 278 HA ASP 31 HA ASP 31 -3.379 -7.812 2.153 279 HB2 ASP 31 2HB ASP 31 -3.671 -10.058 1.191 280 HB3 ASP 31 3HB ASP 31 -2.188 -9.974 2.129 281 H VAL 32 H VAL 32 -5.261 -6.969 1.654 282 HA VAL 32 HA VAL 32 -7.748 -7.845 3.002 283 HB VAL 32 HB VAL 32 -7.184 -5.038 1.909 284 HG11 VAL 32 1HG1 VAL 32 -9.571 -5.641 1.976 285 HG12 VAL 32 2HG1 VAL 32 -9.214 -4.403 3.180 286 HG13 VAL 32 3HG1 VAL 32 -9.431 -6.081 3.680 287 HG21 VAL 32 3HG2 VAL 32 -6.939 -4.287 4.263 288 HG22 VAL 32 1HG2 VAL 32 -5.671 -5.430 3.804 289 HG23 VAL 32 2HG2 VAL 32 -7.024 -5.964 4.805 290 H ASN 33 H ASN 33 -8.944 -8.946 1.593 291 HA ASN 33 HA ASN 33 -9.238 -8.020 -1.203 292 HB2 ASN 33 2HB ASN 33 -8.860 -10.905 -0.276 293 HB3 ASN 33 3HB ASN 33 -9.266 -10.427 -1.921 294 HD21 ASN 33 1HD2 ASN 33 -7.460 -8.153 -2.087 295 HD22 ASN 33 2HD2 ASN 33 -5.856 -8.804 -2.122 296 H ASP 34 H ASP 34 -10.819 -8.094 1.521 297 HA ASP 34 HA ASP 34 -13.412 -8.406 0.186 298 HB2 ASP 34 2HB ASP 34 -12.868 -10.597 1.362 299 HB3 ASP 34 3HB ASP 34 -12.811 -9.723 2.888 300 H SER 35 H SER 35 -14.962 -7.000 0.964 301 HA SER 35 HA SER 35 -14.168 -4.586 2.079 302 HB2 SER 35 2HB SER 35 -16.651 -4.094 2.114 303 HB3 SER 35 3HB SER 35 -16.044 -4.700 0.574 304 HG SER 35 HG SER 35 -17.724 -5.926 2.436 305 H ASP 36 H ASP 36 -15.769 -7.343 3.651 306 HA ASP 36 HA ASP 36 -16.296 -6.148 6.158 307 HB2 ASP 36 2HB ASP 36 -17.307 -8.314 5.520 308 HB3 ASP 36 3HB ASP 36 -15.724 -9.088 5.543 309 H GLU 37 H GLU 37 -13.480 -7.884 4.899 310 HA GLU 37 HA GLU 37 -11.963 -8.058 7.284 311 HB2 GLU 37 2HB GLU 37 -11.104 -8.065 4.360 312 HB3 GLU 37 3HB GLU 37 -10.014 -8.424 5.697 313 HG2 GLU 37 2HG GLU 37 -12.511 -10.008 4.991 314 HG3 GLU 37 3HG GLU 37 -10.859 -10.467 4.582 315 H LEU 38 H LEU 38 -12.072 -5.668 4.674 316 HA LEU 38 HA LEU 38 -10.168 -3.794 5.466 317 HB2 LEU 38 2HB LEU 38 -11.267 -3.544 3.342 318 HB3 LEU 38 3HB LEU 38 -12.854 -3.594 4.071 319 HG LEU 38 HG LEU 38 -11.870 -1.263 5.198 320 HD11 LEU 38 1HD1 LEU 38 -10.706 -1.300 2.411 321 HD12 LEU 38 2HD1 LEU 38 -9.796 -1.299 3.925 322 HD13 LEU 38 3HD1 LEU 38 -10.793 0.091 3.498 323 HD21 LEU 38 3HD2 LEU 38 -13.261 -0.032 3.614 324 HD22 LEU 38 1HD2 LEU 38 -14.075 -1.489 4.182 325 HD23 LEU 38 2HD2 LEU 38 -13.360 -1.448 2.564 326 H LYS 39 H LYS 39 -13.648 -3.880 6.262 327 HA LYS 39 HA LYS 39 -13.623 -1.534 7.869 328 HB2 LYS 39 2HB LYS 39 -15.712 -3.704 7.436 329 HB3 LYS 39 3HB LYS 39 -16.018 -2.279 8.430 330 HG2 LYS 39 2HG LYS 39 -15.517 -0.824 6.489 331 HG3 LYS 39 3HG LYS 39 -15.335 -2.268 5.481 332 HD2 LYS 39 2HD LYS 39 -17.648 -2.860 5.760 333 HD3 LYS 39 3HD LYS 39 -17.872 -1.668 7.044 334 HE2 LYS 39 2HE LYS 39 -18.883 -0.895 4.981 335 HE3 LYS 39 3HE LYS 39 -17.534 0.147 5.408 336 HZ1 LYS 39 3HZ LYS 39 -16.178 -0.922 3.755 337 HZ2 LYS 39 1HZ LYS 39 -17.618 -0.422 3.026 338 HZ3 LYS 39 2HZ LYS 39 -17.390 -2.052 3.409 339 H LYS 40 H LYS 40 -13.039 -4.871 8.632 340 HA LYS 40 HA LYS 40 -13.407 -4.622 11.493 341 HB2 LYS 40 2HB LYS 40 -12.062 -6.776 9.799 342 HB3 LYS 40 3HB LYS 40 -12.246 -6.890 11.546 343 HG2 LYS 40 2HG LYS 40 -14.570 -6.636 9.610 344 HG3 LYS 40 3HG LYS 40 -13.956 -8.176 10.216 345 HD2 LYS 40 2HD LYS 40 -14.540 -7.522 12.521 346 HD3 LYS 40 3HD LYS 40 -15.080 -5.937 11.959 347 HE2 LYS 40 2HE LYS 40 -16.971 -7.507 12.389 348 HE3 LYS 40 3HE LYS 40 -16.916 -6.959 10.713 349 HZ1 LYS 40 3HZ LYS 40 -15.885 -9.567 11.695 350 HZ2 LYS 40 1HZ LYS 40 -15.898 -9.045 10.086 351 HZ3 LYS 40 2HZ LYS 40 -17.357 -9.338 10.893 352 H GLU 41 H GLU 41 -10.498 -4.930 9.357 353 HA GLU 41 HA GLU 41 -8.770 -4.814 11.681 354 HB2 GLU 41 2HB GLU 41 -6.926 -5.232 10.194 355 HB3 GLU 41 3HB GLU 41 -8.246 -6.312 9.773 356 HG2 GLU 41 2HG GLU 41 -8.739 -5.110 7.779 357 HG3 GLU 41 3HG GLU 41 -7.756 -3.732 8.268 358 H MET 42 H MET 42 -9.778 -2.532 9.188 359 HA MET 42 HA MET 42 -7.675 -0.672 9.550 360 HB2 MET 42 2HB MET 42 -9.466 -0.879 7.586 361 HB3 MET 42 3HB MET 42 -10.397 0.236 8.578 362 HG2 MET 42 2HG MET 42 -7.585 0.696 7.584 363 HG3 MET 42 3HG MET 42 -9.045 1.390 6.888 364 HE1 MET 42 3HE MET 42 -6.119 2.483 8.545 365 HE2 MET 42 1HE MET 42 -6.725 4.062 9.040 366 HE3 MET 42 2HE MET 42 -7.000 3.492 7.394 367 H LYS 43 H LYS 43 -10.883 -1.033 11.005 368 HA LYS 43 HA LYS 43 -10.864 1.252 12.667 369 HB2 LYS 43 2HB LYS 43 -12.161 -1.464 13.110 370 HB3 LYS 43 3HB LYS 43 -12.389 -0.088 14.191 371 HG2 LYS 43 2HG LYS 43 -13.219 1.168 12.080 372 HG3 LYS 43 3HG LYS 43 -13.346 -0.431 11.350 373 HD2 LYS 43 2HD LYS 43 -14.844 0.638 13.773 374 HD3 LYS 43 3HD LYS 43 -15.518 0.175 12.214 375 HE2 LYS 43 2HE LYS 43 -16.107 -1.622 13.605 376 HE3 LYS 43 3HE LYS 43 -14.657 -2.224 12.806 377 HZ1 LYS 43 3HZ LYS 43 -14.726 -2.654 15.214 378 HZ2 LYS 43 1HZ LYS 43 -14.706 -0.994 15.514 379 HZ3 LYS 43 2HZ LYS 43 -13.379 -1.738 14.778 380 H LYS 44 H LYS 44 -9.297 -1.878 12.950 381 HA LYS 44 HA LYS 44 -8.482 -1.666 15.692 382 HB2 LYS 44 2HB LYS 44 -7.328 -3.352 13.432 383 HB3 LYS 44 3HB LYS 44 -6.909 -3.531 15.131 384 HG2 LYS 44 2HG LYS 44 -9.681 -3.945 13.966 385 HG3 LYS 44 3HG LYS 44 -8.535 -5.234 14.343 386 HD2 LYS 44 2HD LYS 44 -9.721 -3.289 16.367 387 HD3 LYS 44 3HD LYS 44 -10.268 -4.943 16.098 388 HE2 LYS 44 2HE LYS 44 -7.513 -4.131 17.096 389 HE3 LYS 44 3HE LYS 44 -8.816 -4.807 18.074 390 HZ1 LYS 44 3HZ LYS 44 -8.709 -6.828 16.737 391 HZ2 LYS 44 1HZ LYS 44 -7.228 -6.497 17.482 392 HZ3 LYS 44 2HZ LYS 44 -7.429 -6.183 15.834 393 H LEU 45 H LEU 45 -7.075 -0.640 12.605 394 HA LEU 45 HA LEU 45 -4.513 0.109 13.594 395 HB2 LEU 45 2HB LEU 45 -6.054 1.263 11.231 396 HB3 LEU 45 3HB LEU 45 -4.336 1.495 11.537 397 HG LEU 45 HG LEU 45 -5.666 -1.177 10.909 398 HD11 LEU 45 1HD1 LEU 45 -5.617 0.292 8.955 399 HD12 LEU 45 2HD1 LEU 45 -4.522 -1.073 8.758 400 HD13 LEU 45 3HD1 LEU 45 -3.876 0.523 9.153 401 HD21 LEU 45 3HD2 LEU 45 -2.715 -0.543 11.280 402 HD22 LEU 45 1HD2 LEU 45 -3.387 -2.095 10.769 403 HD23 LEU 45 2HD2 LEU 45 -3.726 -1.480 12.383 404 H ALA 46 H ALA 46 -7.661 1.649 13.695 405 HA ALA 46 HA ALA 46 -6.666 4.213 14.671 406 HB1 ALA 46 3HB ALA 46 -9.503 3.153 14.448 407 HB2 ALA 46 1HB ALA 46 -8.663 4.116 13.230 408 HB3 ALA 46 2HB ALA 46 -9.039 4.821 14.803 409 H GLU 47 H GLU 47 -8.156 1.278 15.997 410 HA GLU 47 HA GLU 47 -8.738 2.473 18.588 411 HB2 GLU 47 2HB GLU 47 -9.230 -0.317 17.475 412 HB3 GLU 47 3HB GLU 47 -9.690 0.175 19.107 413 HG2 GLU 47 2HG GLU 47 -11.192 1.898 18.189 414 HG3 GLU 47 3HG GLU 47 -10.707 1.470 16.550 415 H GLU 48 H GLU 48 -6.189 0.571 17.201 416 HA GLU 48 HA GLU 48 -5.029 -0.014 19.854 417 HB2 GLU 48 2HB GLU 48 -3.845 -0.720 17.119 418 HB3 GLU 48 3HB GLU 48 -3.271 -1.266 18.692 419 HG2 GLU 48 2HG GLU 48 -5.805 -2.088 17.249 420 HG3 GLU 48 3HG GLU 48 -4.430 -3.099 17.675 421 H LYS 49 H LYS 49 -4.091 1.722 20.706 422 HA LYS 49 HA LYS 49 -3.364 4.030 19.156 423 HB2 LYS 49 2HB LYS 49 -4.433 4.031 21.474 424 HB3 LYS 49 3HB LYS 49 -2.869 3.549 22.121 425 HG2 LYS 49 2HG LYS 49 -1.891 5.668 21.179 426 HG3 LYS 49 3HG LYS 49 -3.517 6.144 20.678 427 HD2 LYS 49 2HD LYS 49 -4.246 6.090 23.062 428 HD3 LYS 49 3HD LYS 49 -2.608 5.634 23.540 429 HE2 LYS 49 2HE LYS 49 -3.408 8.238 22.194 430 HE3 LYS 49 3HE LYS 49 -2.989 8.036 23.895 431 HZ1 LYS 49 3HZ LYS 49 -0.756 7.370 23.220 432 HZ2 LYS 49 1HZ LYS 49 -1.137 8.911 22.634 433 HZ3 LYS 49 2HZ LYS 49 -1.165 7.580 21.592 434 H ASN 50 H ASN 50 -1.681 1.200 19.813 435 HA ASN 50 HA ASN 50 0.947 2.027 20.368 436 HB2 ASN 50 2HB ASN 50 -0.083 -0.441 18.903 437 HB3 ASN 50 3HB ASN 50 1.618 -0.197 19.289 438 HD21 ASN 50 1HD2 ASN 50 1.755 -1.960 20.617 439 HD22 ASN 50 2HD2 ASN 50 0.987 -2.048 22.166 440 H PHE 51 H PHE 51 2.612 2.732 19.162 441 HA PHE 51 HA PHE 51 2.220 3.514 16.398 442 HB2 PHE 51 2HB PHE 51 4.613 4.404 16.582 443 HB3 PHE 51 3HB PHE 51 3.430 5.146 17.638 444 HD1 PHE 51 HD1 PHE 51 3.494 4.718 20.105 445 HD2 PHE 51 HD2 PHE 51 6.539 3.210 17.499 446 HE1 PHE 51 HE1 PHE 51 4.973 4.345 22.030 447 HE2 PHE 51 HE2 PHE 51 8.000 2.830 19.436 448 HZ PHE 51 HZ PHE 51 7.221 3.394 21.699 449 H GLU 52 H GLU 52 1.955 1.618 15.303 450 HA GLU 52 HA GLU 52 4.062 -0.458 15.475 451 HB2 GLU 52 2HB GLU 52 2.243 -2.026 14.684 452 HB3 GLU 52 3HB GLU 52 1.962 -1.306 16.265 453 HG2 GLU 52 2HG GLU 52 0.481 0.399 15.118 454 HG3 GLU 52 3HG GLU 52 0.630 -0.561 13.653 455 H LYS 53 H LYS 53 4.943 -1.326 13.669 456 HA LYS 53 HA LYS 53 4.966 0.245 11.227 457 HB2 LYS 53 2HB LYS 53 6.505 -2.280 11.983 458 HB3 LYS 53 3HB LYS 53 6.856 -1.231 10.610 459 HG2 LYS 53 2HG LYS 53 7.617 0.535 12.032 460 HG3 LYS 53 3HG LYS 53 6.971 -0.252 13.477 461 HD2 LYS 53 2HD LYS 53 9.394 -0.516 13.413 462 HD3 LYS 53 3HD LYS 53 8.625 -2.089 13.202 463 HE2 LYS 53 2HE LYS 53 9.039 -1.961 10.770 464 HE3 LYS 53 3HE LYS 53 9.775 -0.368 10.977 465 HZ1 LYS 53 3HZ LYS 53 10.771 -2.895 12.177 466 HZ2 LYS 53 1HZ LYS 53 11.488 -1.370 12.341 467 HZ3 LYS 53 2HZ LYS 53 11.429 -2.124 10.826 468 H ILE 54 H ILE 54 3.134 -0.180 10.008 469 HA ILE 54 HA ILE 54 2.413 -3.014 9.490 470 HB ILE 54 HB ILE 54 0.511 -0.621 9.520 471 HG12 ILE 54 2HG1 ILE 54 1.200 -1.164 11.818 472 HG13 ILE 54 3HG1 ILE 54 -0.476 -1.645 11.579 473 HG21 ILE 54 1HG2 ILE 54 -0.238 -2.318 7.922 474 HG22 ILE 54 2HG2 ILE 54 -1.312 -2.302 9.322 475 HG23 ILE 54 3HG2 ILE 54 -0.102 -3.577 9.152 476 HD11 ILE 54 3HD1 ILE 54 0.722 -3.289 12.865 477 HD12 ILE 54 1HD1 ILE 54 1.927 -3.472 11.593 478 HD13 ILE 54 2HD1 ILE 54 0.258 -3.981 11.312 479 H LEU 55 H LEU 55 1.933 -3.552 7.446 480 HA LEU 55 HA LEU 55 2.194 -1.599 5.246 481 HB2 LEU 55 2HB LEU 55 4.224 -3.067 5.546 482 HB3 LEU 55 3HB LEU 55 3.221 -4.483 5.296 483 HG LEU 55 HG LEU 55 3.368 -2.351 3.141 484 HD11 LEU 55 1HD1 LEU 55 5.695 -2.831 3.685 485 HD12 LEU 55 2HD1 LEU 55 5.264 -3.456 2.095 486 HD13 LEU 55 3HD1 LEU 55 5.402 -4.559 3.469 487 HD21 LEU 55 3HD2 LEU 55 2.971 -4.235 1.614 488 HD22 LEU 55 1HD2 LEU 55 1.705 -4.116 2.833 489 HD23 LEU 55 2HD2 LEU 55 2.955 -5.353 2.982 490 H ILE 56 H ILE 56 0.314 -1.578 4.098 491 HA ILE 56 HA ILE 56 -1.624 -3.796 4.429 492 HB ILE 56 HB ILE 56 -2.126 -0.945 3.447 493 HG12 ILE 56 2HG1 ILE 56 -1.564 -1.015 5.907 494 HG13 ILE 56 3HG1 ILE 56 -3.193 -0.438 5.584 495 HG21 ILE 56 1HG2 ILE 56 -3.714 -2.543 2.472 496 HG22 ILE 56 2HG2 ILE 56 -4.539 -1.504 3.633 497 HG23 ILE 56 3HG2 ILE 56 -4.118 -3.160 4.076 498 HD11 ILE 56 3HD1 ILE 56 -2.450 -3.199 6.532 499 HD12 ILE 56 1HD1 ILE 56 -4.090 -2.619 6.223 500 HD13 ILE 56 2HD1 ILE 56 -3.122 -1.894 7.505 501 H ILE 57 H ILE 57 -1.273 -5.203 2.736 502 HA ILE 57 HA ILE 57 -1.136 -4.164 -0.016 503 HB ILE 57 HB ILE 57 -1.034 -7.046 1.002 504 HG12 ILE 57 2HG1 ILE 57 1.098 -5.265 -0.266 505 HG13 ILE 57 3HG1 ILE 57 1.052 -5.813 1.403 506 HG21 ILE 57 1HG2 ILE 57 -0.625 -7.725 -1.347 507 HG22 ILE 57 2HG2 ILE 57 -0.866 -6.060 -1.873 508 HG23 ILE 57 3HG2 ILE 57 -2.208 -6.964 -1.172 509 HD11 ILE 57 3HD1 ILE 57 1.492 -7.542 -1.027 510 HD12 ILE 57 1HD1 ILE 57 1.388 -8.122 0.638 511 HD13 ILE 57 2HD1 ILE 57 2.695 -7.042 0.160 512 H SER 58 H SER 58 -2.975 -3.804 -1.062 513 HA SER 58 HA SER 58 -5.281 -5.588 -0.701 514 HB2 SER 58 2HB SER 58 -5.838 -3.600 0.667 515 HB3 SER 58 3HB SER 58 -5.489 -2.528 -0.683 516 HG SER 58 HG SER 58 -7.574 -4.446 -0.479 517 H ASN 59 H ASN 59 -5.615 -6.427 -2.599 518 HA ASN 59 HA ASN 59 -4.545 -5.243 -5.054 519 HB2 ASN 59 2HB ASN 59 -5.828 -7.959 -4.516 520 HB3 ASN 59 3HB ASN 59 -5.197 -7.450 -6.083 521 HD21 ASN 59 1HD2 ASN 59 -3.517 -8.850 -6.316 522 HD22 ASN 59 2HD2 ASN 59 -2.174 -8.951 -5.238 523 H ASP 60 H ASP 60 -7.280 -4.926 -3.363 524 HA ASP 60 HA ASP 60 -9.102 -4.579 -5.647 525 HB2 ASP 60 2HB ASP 60 -9.666 -4.716 -2.641 526 HB3 ASP 60 3HB ASP 60 -10.883 -4.539 -3.904 527 H LYS 61 H LYS 61 -8.985 -2.575 -6.398 528 HA LYS 61 HA LYS 61 -7.671 -0.438 -5.076 529 HB2 LYS 61 2HB LYS 61 -9.255 -0.561 -7.675 530 HB3 LYS 61 3HB LYS 61 -8.406 0.883 -7.130 531 HG2 LYS 61 2HG LYS 61 -6.260 -0.345 -7.169 532 HG3 LYS 61 3HG LYS 61 -7.094 -1.803 -7.707 533 HD2 LYS 61 2HD LYS 61 -6.993 0.816 -9.269 534 HD3 LYS 61 3HD LYS 61 -5.938 -0.569 -9.562 535 HE2 LYS 61 2HE LYS 61 -7.936 -1.953 -10.098 536 HE3 LYS 61 3HE LYS 61 -8.967 -0.540 -9.852 537 HZ1 LYS 61 3HZ LYS 61 -6.839 -0.802 -11.908 538 HZ2 LYS 61 1HZ LYS 61 -7.817 0.556 -11.675 539 HZ3 LYS 61 2HZ LYS 61 -8.507 -0.895 -12.184 540 H GLN 62 H GLN 62 -11.048 -1.369 -5.306 541 HA GLN 62 HA GLN 62 -12.224 1.089 -4.478 542 HB2 GLN 62 2HB GLN 62 -13.613 -0.678 -5.470 543 HB3 GLN 62 3HB GLN 62 -13.211 -1.781 -4.160 544 HG2 GLN 62 2HG GLN 62 -15.475 -0.882 -3.880 545 HG3 GLN 62 3HG GLN 62 -14.426 -0.373 -2.559 546 HE21 GLN 62 1HE2 GLN 62 -15.664 1.408 -2.018 547 HE22 GLN 62 2HE2 GLN 62 -15.835 2.802 -3.024 548 H LEU 63 H LEU 63 -11.055 -1.779 -2.705 549 HA LEU 63 HA LEU 63 -11.702 -0.859 -0.088 550 HB2 LEU 63 2HB LEU 63 -9.626 -2.921 -0.933 551 HB3 LEU 63 3HB LEU 63 -10.221 -2.686 0.709 552 HG LEU 63 HG LEU 63 -11.832 -3.686 -1.668 553 HD11 LEU 63 1HD1 LEU 63 -10.293 -5.356 -0.772 554 HD12 LEU 63 2HD1 LEU 63 -11.969 -5.794 -0.453 555 HD13 LEU 63 3HD1 LEU 63 -10.969 -5.136 0.846 556 HD21 LEU 63 3HD2 LEU 63 -12.769 -3.174 1.177 557 HD22 LEU 63 1HD2 LEU 63 -13.696 -3.997 -0.083 558 HD23 LEU 63 2HD2 LEU 63 -13.271 -2.300 -0.276 559 H LEU 64 H LEU 64 -8.910 -0.484 -2.194 560 HA LEU 64 HA LEU 64 -7.097 0.652 -0.353 561 HB2 LEU 64 2HB LEU 64 -6.414 -0.154 -2.563 562 HB3 LEU 64 3HB LEU 64 -7.382 1.077 -3.347 563 HG LEU 64 HG LEU 64 -5.141 1.964 -1.510 564 HD11 LEU 64 1HD1 LEU 64 -3.528 1.912 -3.346 565 HD12 LEU 64 2HD1 LEU 64 -4.713 1.109 -4.381 566 HD13 LEU 64 3HD1 LEU 64 -4.089 0.289 -2.948 567 HD21 LEU 64 3HD2 LEU 64 -4.958 3.858 -3.102 568 HD22 LEU 64 1HD2 LEU 64 -6.565 3.727 -2.393 569 HD23 LEU 64 2HD2 LEU 64 -6.286 3.175 -4.038 570 H LYS 65 H LYS 65 -9.516 2.121 -2.532 571 HA LYS 65 HA LYS 65 -9.108 4.822 -2.019 572 HB2 LYS 65 2HB LYS 65 -11.678 3.307 -2.635 573 HB3 LYS 65 3HB LYS 65 -11.607 5.067 -2.585 574 HG2 LYS 65 2HG LYS 65 -10.204 5.176 -4.497 575 HG3 LYS 65 3HG LYS 65 -9.844 3.447 -4.431 576 HD2 LYS 65 2HD LYS 65 -11.445 3.968 -6.245 577 HD3 LYS 65 3HD LYS 65 -12.156 2.900 -5.035 578 HE2 LYS 65 2HE LYS 65 -13.277 4.916 -4.015 579 HE3 LYS 65 3HE LYS 65 -12.659 5.882 -5.356 580 HZ1 LYS 65 3HZ LYS 65 -13.895 4.456 -6.883 581 HZ2 LYS 65 1HZ LYS 65 -14.921 5.190 -5.755 582 HZ3 LYS 65 2HZ LYS 65 -14.502 3.562 -5.583 583 H GLU 66 H GLU 66 -11.403 2.582 -0.463 584 HA GLU 66 HA GLU 66 -12.508 4.259 1.489 585 HB2 GLU 66 2HB GLU 66 -12.147 1.222 1.590 586 HB3 GLU 66 3HB GLU 66 -13.224 2.153 2.632 587 HG2 GLU 66 2HG GLU 66 -14.516 2.866 0.660 588 HG3 GLU 66 3HG GLU 66 -13.434 1.929 -0.373 589 H MET 67 H MET 67 -9.728 2.075 1.602 590 HA MET 67 HA MET 67 -8.970 2.239 4.273 591 HB2 MET 67 2HB MET 67 -8.024 0.611 2.651 592 HB3 MET 67 3HB MET 67 -7.190 1.909 1.808 593 HG2 MET 67 2HG MET 67 -5.579 0.773 3.159 594 HG3 MET 67 3HG MET 67 -5.887 2.325 3.934 595 HE1 MET 67 3HE MET 67 -7.450 -1.748 5.494 596 HE2 MET 67 1HE MET 67 -6.309 -1.588 4.158 597 HE3 MET 67 2HE MET 67 -7.981 -1.072 3.955 598 H LEU 68 H LEU 68 -7.885 4.266 1.494 599 HA LEU 68 HA LEU 68 -6.072 5.842 3.025 600 HB2 LEU 68 2HB LEU 68 -7.262 6.327 0.272 601 HB3 LEU 68 3HB LEU 68 -6.036 7.360 0.994 602 HG LEU 68 HG LEU 68 -5.689 4.429 0.242 603 HD11 LEU 68 1HD1 LEU 68 -4.448 6.922 -0.945 604 HD12 LEU 68 2HD1 LEU 68 -5.721 5.940 -1.677 605 HD13 LEU 68 3HD1 LEU 68 -4.118 5.254 -1.425 606 HD21 LEU 68 3HD2 LEU 68 -3.647 6.316 1.478 607 HD22 LEU 68 1HD2 LEU 68 -3.329 4.684 0.881 608 HD23 LEU 68 2HD2 LEU 68 -4.389 4.920 2.266 609 H GLU 69 H GLU 69 -9.492 6.289 2.171 610 HA GLU 69 HA GLU 69 -9.762 8.963 3.091 611 HB2 GLU 69 2HB GLU 69 -11.912 6.795 3.190 612 HB3 GLU 69 3HB GLU 69 -12.177 8.535 3.264 613 HG2 GLU 69 2HG GLU 69 -11.256 6.900 0.899 614 HG3 GLU 69 3HG GLU 69 -12.769 7.779 1.070 615 H LEU 70 H LEU 70 -10.252 5.817 4.688 616 HA LEU 70 HA LEU 70 -10.873 6.611 7.292 617 HB2 LEU 70 2HB LEU 70 -9.452 4.165 6.183 618 HB3 LEU 70 3HB LEU 70 -9.825 4.311 7.891 619 HG LEU 70 HG LEU 70 -12.051 4.527 5.836 620 HD11 LEU 70 1HD1 LEU 70 -11.072 1.899 6.987 621 HD12 LEU 70 2HD1 LEU 70 -10.880 2.421 5.313 622 HD13 LEU 70 3HD1 LEU 70 -12.492 2.142 5.965 623 HD21 LEU 70 3HD2 LEU 70 -12.537 5.172 8.164 624 HD22 LEU 70 1HD2 LEU 70 -12.033 3.569 8.716 625 HD23 LEU 70 2HD2 LEU 70 -13.451 3.748 7.676 626 H ILE 71 H ILE 71 -7.715 6.074 5.737 627 HA ILE 71 HA ILE 71 -6.055 6.415 8.012 628 HB ILE 71 HB ILE 71 -5.362 6.784 5.055 629 HG12 ILE 71 2HG1 ILE 71 -4.813 4.407 6.894 630 HG13 ILE 71 3HG1 ILE 71 -6.083 4.463 5.686 631 HG21 ILE 71 1HG2 ILE 71 -3.733 8.005 6.381 632 HG22 ILE 71 2HG2 ILE 71 -2.978 6.525 5.802 633 HG23 ILE 71 3HG2 ILE 71 -3.529 6.633 7.465 634 HD11 ILE 71 3HD1 ILE 71 -4.229 3.178 4.876 635 HD12 ILE 71 1HD1 ILE 71 -3.118 4.519 5.156 636 HD13 ILE 71 2HD1 ILE 71 -4.375 4.654 3.925 637 H SER 72 H SER 72 -7.314 8.656 5.559 638 HA SER 72 HA SER 72 -5.636 10.856 6.132 639 HB2 SER 72 2HB SER 72 -6.905 10.547 3.995 640 HB3 SER 72 3HB SER 72 -8.406 10.892 4.856 641 HG SER 72 HG SER 72 -6.179 12.624 4.527 642 H LYS 73 H LYS 73 -8.773 9.818 7.443 643 HA LYS 73 HA LYS 73 -9.291 12.176 8.979 644 HB2 LYS 73 2HB LYS 73 -10.343 9.416 9.726 645 HB3 LYS 73 3HB LYS 73 -11.098 10.982 10.006 646 HG2 LYS 73 2HG LYS 73 -10.842 9.487 7.390 647 HG3 LYS 73 3HG LYS 73 -12.322 9.829 8.282 648 HD2 LYS 73 2HD LYS 73 -12.124 12.226 7.748 649 HD3 LYS 73 3HD LYS 73 -10.562 11.951 6.969 650 HE2 LYS 73 2HE LYS 73 -11.698 10.492 5.290 651 HE3 LYS 73 3HE LYS 73 -13.249 10.876 6.039 652 HZ1 LYS 73 3HZ LYS 73 -11.406 12.854 4.818 653 HZ2 LYS 73 1HZ LYS 73 -12.928 13.184 5.475 654 HZ3 LYS 73 2HZ LYS 73 -12.795 12.231 4.084 655 H LEU 74 H LEU 74 -7.322 9.368 9.449 656 HA LEU 74 HA LEU 74 -6.925 9.769 12.330 657 HB2 LEU 74 2HB LEU 74 -5.774 7.654 10.462 658 HB3 LEU 74 3HB LEU 74 -5.703 7.635 12.220 659 HG LEU 74 HG LEU 74 -8.264 7.426 10.585 660 HD11 LEU 74 1HD1 LEU 74 -6.896 5.430 10.288 661 HD12 LEU 74 2HD1 LEU 74 -8.345 5.076 11.224 662 HD13 LEU 74 3HD1 LEU 74 -6.785 5.220 12.039 663 HD21 LEU 74 3HD2 LEU 74 -7.855 7.113 13.574 664 HD22 LEU 74 1HD2 LEU 74 -9.363 6.848 12.693 665 HD23 LEU 74 2HD2 LEU 74 -8.660 8.460 12.762 666 H GLY 75 H GLY 75 -5.427 10.524 9.324 667 HA2 GLY 75 2HA GLY 75 -3.536 11.612 8.705 668 HA3 GLY 75 3HA GLY 75 -3.387 12.151 10.367 669 H TYR 76 H TYR 76 -3.226 8.824 9.038 670 HA TYR 76 HA TYR 76 -0.616 8.416 10.308 671 HB2 TYR 76 2HB TYR 76 -2.318 6.440 8.739 672 HB3 TYR 76 3HB TYR 76 -0.814 6.045 9.556 673 HD1 TYR 76 HD1 TYR 76 -1.624 7.957 12.027 674 HD2 TYR 76 HD2 TYR 76 -3.486 4.667 10.021 675 HE1 TYR 76 HE1 TYR 76 -2.822 7.390 14.074 676 HE2 TYR 76 HE2 TYR 76 -4.700 4.105 12.079 677 HH TYR 76 HH TYR 76 -4.881 6.194 14.728 678 H LYS 77 H LYS 77 1.290 7.856 9.206 679 HA LYS 77 HA LYS 77 1.613 9.228 6.691 680 HB2 LYS 77 2HB LYS 77 3.362 9.297 8.499 681 HB3 LYS 77 3HB LYS 77 3.673 7.583 8.233 682 HG2 LYS 77 2HG LYS 77 5.367 8.864 7.070 683 HG3 LYS 77 3HG LYS 77 4.321 8.100 5.870 684 HD2 LYS 77 2HD LYS 77 3.046 10.319 5.745 685 HD3 LYS 77 3HD LYS 77 4.328 11.019 6.739 686 HE2 LYS 77 2HE LYS 77 4.765 11.523 4.409 687 HE3 LYS 77 3HE LYS 77 5.979 10.369 4.965 688 HZ1 LYS 77 3HZ LYS 77 3.538 9.690 3.397 689 HZ2 LYS 77 1HZ LYS 77 4.728 8.594 3.902 690 HZ3 LYS 77 2HZ LYS 77 5.107 9.800 2.781 691 H VAL 78 H VAL 78 1.544 8.342 4.717 692 HA VAL 78 HA VAL 78 1.584 5.393 4.384 693 HB VAL 78 HB VAL 78 -0.102 7.440 2.864 694 HG11 VAL 78 1HG1 VAL 78 0.006 4.420 2.485 695 HG12 VAL 78 2HG1 VAL 78 0.599 5.623 1.338 696 HG13 VAL 78 3HG1 VAL 78 -1.127 5.517 1.687 697 HG21 VAL 78 3HG2 VAL 78 -2.031 6.300 3.886 698 HG22 VAL 78 1HG2 VAL 78 -0.956 6.976 5.114 699 HG23 VAL 78 2HG2 VAL 78 -0.936 5.243 4.779 700 H PHE 79 H PHE 79 2.937 4.613 2.917 701 HA PHE 79 HA PHE 79 3.922 6.323 0.703 702 HB2 PHE 79 2HB PHE 79 5.261 3.939 2.070 703 HB3 PHE 79 3HB PHE 79 5.865 4.720 0.617 704 HD1 PHE 79 HD2 PHE 79 5.213 5.288 4.263 705 HD2 PHE 79 HD1 PHE 79 7.255 6.673 0.760 706 HE1 PHE 79 HE2 PHE 79 6.537 6.832 5.639 707 HE2 PHE 79 HE1 PHE 79 8.578 8.211 2.154 708 HZ PHE 79 HZ PHE 79 8.222 8.292 4.590 709 H LEU 80 H LEU 80 2.923 5.727 -1.131 710 HA LEU 80 HA LEU 80 1.425 3.193 -1.259 711 HB2 LEU 80 2HB LEU 80 0.027 5.186 -1.322 712 HB3 LEU 80 3HB LEU 80 0.959 5.850 -2.656 713 HG LEU 80 HG LEU 80 0.145 3.972 -4.130 714 HD11 LEU 80 1HD1 LEU 80 -1.629 3.215 -1.795 715 HD12 LEU 80 2HD1 LEU 80 -0.288 2.267 -2.444 716 HD13 LEU 80 3HD1 LEU 80 -1.718 2.554 -3.431 717 HD21 LEU 80 3HD2 LEU 80 -1.000 6.118 -4.180 718 HD22 LEU 80 1HD2 LEU 80 -2.067 5.610 -2.868 719 HD23 LEU 80 2HD2 LEU 80 -2.135 4.797 -4.436 720 H LEU 81 H LEU 81 1.956 1.697 -2.709 721 HA LEU 81 HA LEU 81 3.381 2.405 -5.202 722 HB2 LEU 81 2HB LEU 81 4.729 0.952 -3.702 723 HB3 LEU 81 3HB LEU 81 3.425 -0.220 -3.645 724 HG LEU 81 HG LEU 81 3.721 -0.667 -6.082 725 HD11 LEU 81 1HD1 LEU 81 6.016 1.303 -5.914 726 HD12 LEU 81 2HD1 LEU 81 4.531 1.475 -6.851 727 HD13 LEU 81 3HD1 LEU 81 5.697 0.227 -7.276 728 HD21 LEU 81 3HD2 LEU 81 5.843 -1.879 -5.935 729 HD22 LEU 81 1HD2 LEU 81 4.899 -2.066 -4.458 730 HD23 LEU 81 2HD2 LEU 81 6.283 -0.968 -4.487 731 H LEU 82 H LEU 82 1.873 2.433 -6.781 732 HA LEU 82 HA LEU 82 -0.314 0.465 -6.842 733 HB2 LEU 82 2HB LEU 82 0.209 2.975 -8.478 734 HB3 LEU 82 3HB LEU 82 -1.150 1.897 -8.753 735 HG LEU 82 HG LEU 82 -0.673 3.513 -6.212 736 HD11 LEU 82 1HD1 LEU 82 -1.305 4.935 -8.101 737 HD12 LEU 82 2HD1 LEU 82 -2.593 4.850 -6.903 738 HD13 LEU 82 3HD1 LEU 82 -2.726 3.928 -8.404 739 HD21 LEU 82 3HD2 LEU 82 -1.821 1.403 -5.729 740 HD22 LEU 82 1HD2 LEU 82 -3.028 1.751 -6.973 741 HD23 LEU 82 2HD2 LEU 82 -2.912 2.771 -5.535 742 H GLN 83 H GLN 83 -0.237 -1.227 -8.187 743 HA GLN 83 HA GLN 83 1.516 -1.218 -10.560 744 HB2 GLN 83 2HB GLN 83 2.559 -2.602 -8.754 745 HB3 GLN 83 3HB GLN 83 1.087 -3.564 -8.653 746 HG2 GLN 83 2HG GLN 83 1.435 -4.289 -11.017 747 HG3 GLN 83 3HG GLN 83 2.935 -3.373 -11.060 748 HE21 GLN 83 1HE2 GLN 83 2.385 -6.265 -11.376 749 HE22 GLN 83 2HE2 GLN 83 3.433 -7.044 -10.249 750 H ASP 84 H ASP 84 0.025 -1.016 -12.082 751 HA ASP 84 HA ASP 84 -2.117 -3.030 -12.329 752 HB2 ASP 84 2HB ASP 84 -2.976 -0.748 -11.425 753 HB3 ASP 84 3HB ASP 84 -2.546 -0.072 -12.986 754 H GLN 85 H GLN 85 -2.420 -3.685 -14.481 755 HA GLN 85 HA GLN 85 -0.189 -3.339 -16.234 756 HB2 GLN 85 2HB GLN 85 -1.421 -5.484 -16.073 757 HB3 GLN 85 3HB GLN 85 -2.867 -4.714 -16.714 758 HG2 GLN 85 2HG GLN 85 -1.793 -6.013 -18.473 759 HG3 GLN 85 3HG GLN 85 -1.683 -4.299 -18.864 760 HE21 GLN 85 1HE2 GLN 85 0.098 -7.106 -17.775 761 HE22 GLN 85 2HE2 GLN 85 1.678 -6.496 -18.131 762 H ASP 86 H ASP 86 -3.518 -2.170 -16.171 763 HA ASP 86 HA ASP 86 -3.303 -0.852 -18.782 764 HB2 ASP 86 2HB ASP 86 -5.389 -2.086 -18.268 765 HB3 ASP 86 3HB ASP 86 -5.631 -1.125 -16.813 766 H GLU 87 H GLU 87 -2.439 1.178 -18.792 767 HA GLU 87 HA GLU 87 -2.121 2.604 -16.311 768 HB2 GLU 87 2HB GLU 87 -1.148 3.279 -19.093 769 HB3 GLU 87 3HB GLU 87 -0.861 4.300 -17.683 770 HG2 GLU 87 2HG GLU 87 0.171 2.165 -16.612 771 HG3 GLU 87 3HG GLU 87 0.220 1.539 -18.261 772 H ASN 88 H ASN 88 -4.625 2.600 -18.566 773 HA ASN 88 HA ASN 88 -5.453 5.347 -18.184 774 HB2 ASN 88 2HB ASN 88 -7.221 2.967 -18.945 775 HB3 ASN 88 3HB ASN 88 -7.590 4.674 -19.187 776 HD21 ASN 88 1HD2 ASN 88 -5.791 1.938 -20.327 777 HD22 ASN 88 2HD2 ASN 88 -5.303 2.625 -21.832 778 H GLU 89 H GLU 89 -5.789 2.300 -16.498 779 HA GLU 89 HA GLU 89 -7.503 3.349 -14.400 780 HB2 GLU 89 2HB GLU 89 -5.985 0.734 -14.741 781 HB3 GLU 89 3HB GLU 89 -6.842 1.129 -13.255 782 HG2 GLU 89 2HG GLU 89 -8.109 0.892 -16.003 783 HG3 GLU 89 3HG GLU 89 -8.166 -0.332 -14.733 784 H LEU 90 H LEU 90 -4.124 2.248 -14.668 785 HA LEU 90 HA LEU 90 -3.224 2.706 -12.106 786 HB2 LEU 90 2HB LEU 90 -2.012 1.411 -13.793 787 HB3 LEU 90 3HB LEU 90 -1.723 2.857 -14.729 788 HG LEU 90 HG LEU 90 -0.168 3.721 -13.066 789 HD11 LEU 90 1HD1 LEU 90 0.494 2.431 -11.087 790 HD12 LEU 90 2HD1 LEU 90 -0.795 1.266 -11.412 791 HD13 LEU 90 3HD1 LEU 90 -1.190 2.946 -11.018 792 HD21 LEU 90 3HD2 LEU 90 0.753 2.239 -14.779 793 HD22 LEU 90 1HD2 LEU 90 0.456 0.830 -13.753 794 HD23 LEU 90 2HD2 LEU 90 1.630 2.057 -13.262 795 H GLU 91 H GLU 91 -2.987 4.999 -14.872 796 HA GLU 91 HA GLU 91 -1.452 6.936 -13.439 797 HB2 GLU 91 2HB GLU 91 -1.410 6.639 -15.949 798 HB3 GLU 91 3HB GLU 91 -3.034 7.291 -16.022 799 HG2 GLU 91 2HG GLU 91 -1.296 8.963 -16.618 800 HG3 GLU 91 3HG GLU 91 -2.305 9.459 -15.260 801 H GLU 92 H GLU 92 -4.876 6.798 -14.472 802 HA GLU 92 HA GLU 92 -5.674 9.306 -13.468 803 HB2 GLU 92 2HB GLU 92 -7.328 6.808 -13.986 804 HB3 GLU 92 3HB GLU 92 -8.009 8.404 -13.673 805 HG2 GLU 92 2HG GLU 92 -6.275 7.613 -16.031 806 HG3 GLU 92 3HG GLU 92 -8.013 7.905 -16.063 807 H PHE 93 H PHE 93 -5.727 6.094 -12.026 808 HA PHE 93 HA PHE 93 -7.092 6.728 -9.615 809 HB2 PHE 93 2HB PHE 93 -6.763 4.427 -10.663 810 HB3 PHE 93 3HB PHE 93 -5.094 4.475 -10.107 811 HD1 PHE 93 HD1 PHE 93 -8.523 5.062 -8.703 812 HD2 PHE 93 HD2 PHE 93 -4.680 3.261 -8.136 813 HE1 PHE 93 HE1 PHE 93 -9.284 4.087 -6.596 814 HE2 PHE 93 HE2 PHE 93 -5.459 2.296 -6.019 815 HZ PHE 93 HZ PHE 93 -7.762 2.709 -5.252 816 H LYS 94 H LYS 94 -3.701 6.559 -10.558 817 HA LYS 94 HA LYS 94 -2.363 6.979 -8.154 818 HB2 LYS 94 2HB LYS 94 -0.967 6.316 -9.899 819 HB3 LYS 94 3HB LYS 94 -1.751 7.367 -11.069 820 HG2 LYS 94 2HG LYS 94 -0.585 9.326 -10.098 821 HG3 LYS 94 3HG LYS 94 0.222 8.260 -8.939 822 HD2 LYS 94 2HD LYS 94 1.372 7.098 -10.718 823 HD3 LYS 94 3HD LYS 94 0.446 7.955 -11.953 824 HE2 LYS 94 2HE LYS 94 2.404 9.252 -10.035 825 HE3 LYS 94 3HE LYS 94 2.753 8.808 -11.708 826 HZ1 LYS 94 3HZ LYS 94 2.178 11.140 -11.512 827 HZ2 LYS 94 1HZ LYS 94 0.682 10.752 -10.831 828 HZ3 LYS 94 2HZ LYS 94 1.016 10.327 -12.433 829 H ARG 95 H ARG 95 -3.462 9.331 -10.596 830 HA ARG 95 HA ARG 95 -2.143 11.540 -9.349 831 HB2 ARG 95 2HB ARG 95 -2.961 12.855 -11.187 832 HB3 ARG 95 3HB ARG 95 -2.488 11.280 -11.816 833 HG2 ARG 95 2HG ARG 95 -5.000 10.664 -11.622 834 HG3 ARG 95 3HG ARG 95 -5.271 12.399 -11.437 835 HD2 ARG 95 2HD ARG 95 -4.017 10.976 -13.801 836 HD3 ARG 95 3HD ARG 95 -5.587 11.784 -13.751 837 HE ARG 95 HE ARG 95 -3.617 13.671 -13.109 838 HH11 ARG 95 1HH1 ARG 95 -4.697 11.796 -15.883 839 HH12 ARG 95 2HH1 ARG 95 -4.125 12.960 -17.037 840 HH21 ARG 95 1HH2 ARG 95 -2.863 15.162 -14.654 841 HH22 ARG 95 2HH2 ARG 95 -3.098 14.858 -16.342 842 H LYS 96 H LYS 96 -5.351 10.179 -9.062 843 HA LYS 96 HA LYS 96 -6.718 12.302 -7.797 844 HB2 LYS 96 2HB LYS 96 -6.929 9.290 -7.341 845 HB3 LYS 96 3HB LYS 96 -8.088 10.468 -6.725 846 HG2 LYS 96 2HG LYS 96 -8.728 11.094 -8.990 847 HG3 LYS 96 3HG LYS 96 -7.485 10.040 -9.664 848 HD2 LYS 96 2HD LYS 96 -8.668 8.062 -8.665 849 HD3 LYS 96 3HD LYS 96 -9.934 9.151 -8.084 850 HE2 LYS 96 2HE LYS 96 -10.369 9.816 -10.465 851 HE3 LYS 96 3HE LYS 96 -9.198 8.597 -10.977 852 HZ1 LYS 96 3HZ LYS 96 -11.449 7.768 -11.112 853 HZ2 LYS 96 1HZ LYS 96 -11.701 8.072 -9.468 854 HZ3 LYS 96 2HZ LYS 96 -10.578 6.906 -9.948 855 H ILE 97 H ILE 97 -4.621 9.763 -6.551 856 HA ILE 97 HA ILE 97 -4.848 10.503 -3.750 857 HB ILE 97 HB ILE 97 -3.087 8.413 -5.117 858 HG12 ILE 97 2HG1 ILE 97 -5.791 7.913 -3.780 859 HG13 ILE 97 3HG1 ILE 97 -5.627 8.192 -5.510 860 HG21 ILE 97 1HG2 ILE 97 -3.920 8.688 -2.206 861 HG22 ILE 97 2HG2 ILE 97 -2.299 8.932 -2.860 862 HG23 ILE 97 3HG2 ILE 97 -3.025 7.325 -2.880 863 HD11 ILE 97 3HD1 ILE 97 -5.808 5.840 -5.044 864 HD12 ILE 97 1HD1 ILE 97 -4.416 5.903 -3.962 865 HD13 ILE 97 2HD1 ILE 97 -4.210 6.203 -5.691 866 H GLU 98 H GLU 98 -2.674 10.980 -6.404 867 HA GLU 98 HA GLU 98 -0.321 11.778 -4.954 868 HB2 GLU 98 2HB GLU 98 -0.115 10.774 -7.163 869 HB3 GLU 98 3HB GLU 98 -1.144 12.011 -7.875 870 HG2 GLU 98 2HG GLU 98 0.599 13.717 -7.404 871 HG3 GLU 98 3HG GLU 98 1.626 12.459 -6.711 872 H SER 99 H SER 99 -3.098 13.376 -6.475 873 HA SER 99 HA SER 99 -2.300 16.065 -6.134 874 HB2 SER 99 2HB SER 99 -4.171 15.314 -7.613 875 HB3 SER 99 3HB SER 99 -5.125 14.907 -6.187 876 HG SER 99 HG SER 99 -5.759 16.897 -6.289 877 H GLN 100 H GLN 100 -3.393 13.671 -3.897 878 HA GLN 100 HA GLN 100 -4.131 15.516 -1.752 879 HB2 GLN 100 2HB GLN 100 -3.840 12.483 -1.742 880 HB3 GLN 100 3HB GLN 100 -4.576 13.448 -0.466 881 HG2 GLN 100 2HG GLN 100 -6.441 14.020 -1.878 882 HG3 GLN 100 3HG GLN 100 -5.656 13.317 -3.294 883 HE21 GLN 100 1HE2 GLN 100 -7.316 11.865 -3.721 884 HE22 GLN 100 2HE2 GLN 100 -7.682 10.517 -2.701 885 H GLY 101 H GLY 101 -1.221 14.533 -3.019 886 HA2 GLY 101 2HA GLY 101 0.864 15.211 -2.268 887 HA3 GLY 101 3HA GLY 101 0.214 15.473 -0.660 888 H TYR 102 H TYR 102 -0.665 12.397 -1.764 889 HA TYR 102 HA TYR 102 1.068 11.037 0.075 890 HB2 TYR 102 2HB TYR 102 -0.891 10.013 -2.023 891 HB3 TYR 102 3HB TYR 102 0.086 8.919 -1.055 892 HD1 TYR 102 HD2 TYR 102 -2.434 11.686 -0.685 893 HD2 TYR 102 HD1 TYR 102 -0.763 8.147 1.011 894 HE1 TYR 102 HE2 TYR 102 -4.185 11.691 1.044 895 HE2 TYR 102 HE1 TYR 102 -2.511 8.144 2.737 896 HH TYR 102 HH TYR 102 -5.311 10.003 2.556 897 H GLU 103 H GLU 103 2.859 9.813 -0.337 898 HA GLU 103 HA GLU 103 4.422 10.136 -2.702 899 HB2 GLU 103 2HB GLU 103 5.521 9.772 -0.551 900 HB3 GLU 103 3HB GLU 103 4.658 8.261 -0.301 901 HG2 GLU 103 2HG GLU 103 7.016 7.874 -0.895 902 HG3 GLU 103 3HG GLU 103 5.923 7.190 -2.094 903 H VAL 104 H VAL 104 3.328 9.371 -4.526 904 HA VAL 104 HA VAL 104 2.329 6.574 -4.522 905 HB VAL 104 HB VAL 104 1.507 8.808 -6.440 906 HG11 VAL 104 1HG1 VAL 104 -0.321 7.262 -7.086 907 HG12 VAL 104 2HG1 VAL 104 0.317 6.043 -5.980 908 HG13 VAL 104 3HG1 VAL 104 1.264 6.541 -7.384 909 HG21 VAL 104 3HG2 VAL 104 0.732 9.355 -4.163 910 HG22 VAL 104 1HG2 VAL 104 -0.022 7.765 -4.025 911 HG23 VAL 104 2HG2 VAL 104 -0.630 8.932 -5.203 912 H ARG 105 H ARG 105 3.453 5.176 -5.730 913 HA ARG 105 HA ARG 105 5.127 6.120 -7.989 914 HB2 ARG 105 2HB ARG 105 5.587 3.751 -6.117 915 HB3 ARG 105 3HB ARG 105 6.569 4.115 -7.532 916 HG2 ARG 105 2HG ARG 105 6.275 5.953 -5.130 917 HG3 ARG 105 3HG ARG 105 7.599 4.812 -5.366 918 HD2 ARG 105 2HD ARG 105 8.159 6.022 -7.511 919 HD3 ARG 105 3HD ARG 105 6.936 7.223 -7.082 920 HE ARG 105 HE ARG 105 8.327 8.076 -5.463 921 HH11 ARG 105 1HH1 ARG 105 9.745 5.080 -6.664 922 HH12 ARG 105 2HH1 ARG 105 11.266 5.342 -5.875 923 HH21 ARG 105 1HH2 ARG 105 10.343 8.409 -4.464 924 HH22 ARG 105 2HH2 ARG 105 11.603 7.223 -4.635 925 H LYS 106 H LYS 106 4.881 5.056 -9.904 926 HA LYS 106 HA LYS 106 2.886 2.898 -10.163 927 HB2 LYS 106 2HB LYS 106 4.419 4.464 -12.294 928 HB3 LYS 106 3HB LYS 106 3.245 3.192 -12.634 929 HG2 LYS 106 2HG LYS 106 1.491 4.585 -11.525 930 HG3 LYS 106 3HG LYS 106 2.682 5.880 -11.347 931 HD2 LYS 106 2HD LYS 106 1.756 4.666 -13.990 932 HD3 LYS 106 3HD LYS 106 1.233 6.221 -13.339 933 HE2 LYS 106 2HE LYS 106 3.463 7.143 -13.578 934 HE3 LYS 106 3HE LYS 106 4.126 5.566 -14.015 935 HZ1 LYS 106 3HZ LYS 106 2.783 5.590 -16.014 936 HZ2 LYS 106 1HZ LYS 106 3.788 6.949 -15.952 937 HZ3 LYS 106 2HZ LYS 106 2.143 7.102 -15.601 938 H VAL 107 H VAL 107 3.450 0.897 -11.083 939 HA VAL 107 HA VAL 107 6.087 0.398 -12.116 940 HB VAL 107 HB VAL 107 6.388 0.158 -9.613 941 HG11 VAL 107 1HG1 VAL 107 5.523 -1.800 -8.430 942 HG12 VAL 107 2HG1 VAL 107 4.633 -2.305 -9.867 943 HG13 VAL 107 3HG1 VAL 107 4.195 -0.810 -9.040 944 HG21 VAL 107 3HG2 VAL 107 6.898 -2.359 -11.229 945 HG22 VAL 107 1HG2 VAL 107 7.727 -1.897 -9.739 946 HG23 VAL 107 2HG2 VAL 107 7.924 -0.920 -11.194 947 H THR 108 H THR 108 6.161 -1.405 -13.398 948 HA THR 108 HA THR 108 3.833 -3.227 -13.568 949 HB THR 108 HB THR 108 4.383 -3.351 -16.088 950 HG1 THR 108 HG1 THR 108 6.252 -2.335 -16.410 951 HG21 THR 108 3HG2 THR 108 2.362 -2.150 -15.311 952 HG22 THR 108 1HG2 THR 108 3.105 -1.305 -16.674 953 HG23 THR 108 2HG2 THR 108 3.328 -0.699 -15.033 954 H ASP 109 H ASP 109 7.203 -2.841 -13.171 955 HA ASP 109 HA ASP 109 7.926 -5.585 -13.896 956 HB2 ASP 109 2HB ASP 109 9.524 -3.301 -12.665 957 HB3 ASP 109 3HB ASP 109 10.196 -4.896 -12.984 958 H ASP 110 H ASP 110 8.170 -7.214 -12.403 959 HA ASP 110 HA ASP 110 6.863 -6.910 -9.867 960 HB2 ASP 110 2HB ASP 110 7.167 -9.301 -9.579 961 HB3 ASP 110 3HB ASP 110 6.635 -8.975 -11.221 962 H GLU 111 H GLU 111 10.230 -7.327 -10.887 963 HA GLU 111 HA GLU 111 11.328 -7.713 -8.257 964 HB2 GLU 111 2HB GLU 111 12.722 -6.932 -10.860 965 HB3 GLU 111 3HB GLU 111 13.529 -7.509 -9.399 966 HG2 GLU 111 2HG GLU 111 12.522 -9.703 -9.626 967 HG3 GLU 111 3HG GLU 111 11.499 -9.150 -10.952 968 H GLU 112 H GLU 112 11.005 -5.007 -10.521 969 HA GLU 112 HA GLU 112 12.425 -3.049 -9.055 970 HB2 GLU 112 2HB GLU 112 11.900 -2.844 -11.467 971 HB3 GLU 112 3HB GLU 112 10.190 -2.705 -11.093 972 HG2 GLU 112 2HG GLU 112 11.184 -0.524 -11.644 973 HG3 GLU 112 3HG GLU 112 10.562 -0.554 -9.993 974 H ALA 113 H ALA 113 8.992 -4.025 -9.092 975 HA ALA 113 HA ALA 113 7.805 -2.137 -7.455 976 HB1 ALA 113 3HB ALA 113 6.560 -3.934 -8.601 977 HB2 ALA 113 1HB ALA 113 6.152 -3.876 -6.885 978 HB3 ALA 113 2HB ALA 113 7.242 -5.127 -7.494 979 H LEU 114 H LEU 114 9.519 -5.094 -6.546 980 HA LEU 114 HA LEU 114 9.199 -5.014 -3.750 981 HB2 LEU 114 2HB LEU 114 11.545 -6.189 -5.293 982 HB3 LEU 114 3HB LEU 114 11.056 -6.617 -3.660 983 HG LEU 114 HG LEU 114 9.494 -7.201 -6.198 984 HD11 LEU 114 1HD1 LEU 114 10.027 -9.554 -5.758 985 HD12 LEU 114 2HD1 LEU 114 11.031 -9.079 -4.385 986 HD13 LEU 114 3HD1 LEU 114 11.479 -8.591 -6.023 987 HD21 LEU 114 3HD2 LEU 114 7.959 -6.813 -4.343 988 HD22 LEU 114 1HD2 LEU 114 8.835 -7.973 -3.340 989 HD23 LEU 114 2HD2 LEU 114 7.976 -8.516 -4.785 990 H LYS 115 H LYS 115 11.529 -3.448 -5.893 991 HA LYS 115 HA LYS 115 13.405 -2.691 -3.835 992 HB2 LYS 115 2HB LYS 115 13.214 -1.549 -6.654 993 HB3 LYS 115 3HB LYS 115 14.600 -1.470 -5.575 994 HG2 LYS 115 2HG LYS 115 13.509 -3.930 -6.966 995 HG3 LYS 115 3HG LYS 115 14.992 -3.073 -7.349 996 HD2 LYS 115 2HD LYS 115 15.930 -4.789 -6.140 997 HD3 LYS 115 3HD LYS 115 15.567 -3.735 -4.777 998 HE2 LYS 115 2HE LYS 115 13.499 -5.001 -4.346 999 HE3 LYS 115 3HE LYS 115 13.797 -5.998 -5.768 1000 HZ1 LYS 115 3HZ LYS 115 14.414 -7.030 -3.630 1001 HZ2 LYS 115 1HZ LYS 115 15.626 -5.861 -3.443 1002 HZ3 LYS 115 2HZ LYS 115 15.691 -6.943 -4.740 1003 H ILE 116 H ILE 116 10.722 -1.133 -5.551 1004 HA ILE 116 HA ILE 116 11.008 1.492 -4.522 1005 HB ILE 116 HB ILE 116 8.428 0.078 -5.360 1006 HG12 ILE 116 2HG1 ILE 116 10.203 0.118 -7.174 1007 HG13 ILE 116 3HG1 ILE 116 8.731 0.972 -7.603 1008 HG21 ILE 116 1HG2 ILE 116 7.963 2.101 -4.068 1009 HG22 ILE 116 2HG2 ILE 116 7.544 2.363 -5.760 1010 HG23 ILE 116 3HG2 ILE 116 9.033 3.049 -5.104 1011 HD11 ILE 116 3HD1 ILE 116 9.832 3.103 -7.200 1012 HD12 ILE 116 1HD1 ILE 116 10.736 2.121 -8.351 1013 HD13 ILE 116 2HD1 ILE 116 11.300 2.264 -6.687 1014 H VAL 117 H VAL 117 9.387 -1.431 -3.318 1015 HA VAL 117 HA VAL 117 8.183 -0.384 -0.986 1016 HB VAL 117 HB VAL 117 9.306 -3.211 -1.329 1017 HG11 VAL 117 1HG1 VAL 117 8.754 -2.692 1.020 1018 HG12 VAL 117 2HG1 VAL 117 7.623 -3.878 0.367 1019 HG13 VAL 117 3HG1 VAL 117 7.128 -2.192 0.544 1020 HG21 VAL 117 3HG2 VAL 117 7.759 -2.691 -3.162 1021 HG22 VAL 117 1HG2 VAL 117 6.523 -2.194 -2.008 1022 HG23 VAL 117 2HG2 VAL 117 7.048 -3.880 -2.075 1023 H ARG 118 H ARG 118 11.484 -1.531 -1.660 1024 HA ARG 118 HA ARG 118 12.473 -1.480 0.998 1025 HB2 ARG 118 2HB ARG 118 13.965 -1.281 -1.644 1026 HB3 ARG 118 3HB ARG 118 14.763 -1.424 -0.076 1027 HG2 ARG 118 2HG ARG 118 13.583 -3.584 0.292 1028 HG3 ARG 118 3HG ARG 118 12.896 -3.460 -1.331 1029 HD2 ARG 118 2HD ARG 118 15.132 -3.561 -2.315 1030 HD3 ARG 118 3HD ARG 118 15.869 -3.555 -0.705 1031 HE ARG 118 HE ARG 118 13.983 -5.699 -1.349 1032 HH11 ARG 118 1HH1 ARG 118 17.354 -4.781 -0.856 1033 HH12 ARG 118 2HH1 ARG 118 17.886 -6.424 -0.701 1034 HH21 ARG 118 1HH2 ARG 118 14.722 -7.823 -1.243 1035 HH22 ARG 118 2HH2 ARG 118 16.398 -8.141 -0.919 1036 H GLU 119 H GLU 119 12.337 1.017 -1.544 1037 HA GLU 119 HA GLU 119 13.642 3.114 -0.200 1038 HB2 GLU 119 2HB GLU 119 11.238 3.250 -2.066 1039 HB3 GLU 119 3HB GLU 119 12.137 4.664 -1.514 1040 HG2 GLU 119 2HG GLU 119 14.185 3.709 -2.609 1041 HG3 GLU 119 3HG GLU 119 13.170 2.416 -3.266 1042 H PHE 120 H PHE 120 10.231 2.181 -0.246 1043 HA PHE 120 HA PHE 120 9.155 4.130 1.411 1044 HB2 PHE 120 2HB PHE 120 8.245 1.288 0.826 1045 HB3 PHE 120 3HB PHE 120 7.264 2.446 1.726 1046 HD1 PHE 120 HD2 PHE 120 8.769 4.563 -0.551 1047 HD2 PHE 120 HD1 PHE 120 5.958 1.321 -0.467 1048 HE1 PHE 120 HE2 PHE 120 7.723 5.409 -2.601 1049 HE2 PHE 120 HE1 PHE 120 4.935 2.198 -2.503 1050 HZ PHE 120 HZ PHE 120 5.800 4.224 -3.573 1051 H MET 121 H MET 121 10.365 0.906 2.285 1052 HA MET 121 HA MET 121 9.639 1.008 5.021 1053 HB2 MET 121 2HB MET 121 11.629 -0.738 3.527 1054 HB3 MET 121 3HB MET 121 11.225 -0.972 5.224 1055 HG2 MET 121 2HG MET 121 8.864 -1.351 4.591 1056 HG3 MET 121 3HG MET 121 9.308 -1.192 2.889 1057 HE1 MET 121 3HE MET 121 10.606 -3.018 1.507 1058 HE2 MET 121 1HE MET 121 11.455 -4.375 2.242 1059 HE3 MET 121 2HE MET 121 12.025 -2.728 2.517 1060 H GLN 122 H GLN 122 12.633 1.877 3.322 1061 HA GLN 122 HA GLN 122 14.183 2.292 5.708 1062 HB2 GLN 122 2HB GLN 122 15.080 1.694 3.400 1063 HB3 GLN 122 3HB GLN 122 14.759 3.352 2.909 1064 HG2 GLN 122 2HG GLN 122 16.370 4.181 4.566 1065 HG3 GLN 122 3HG GLN 122 16.637 2.540 5.152 1066 HE21 GLN 122 1HE2 GLN 122 17.214 4.763 2.519 1067 HE22 GLN 122 2HE2 GLN 122 18.453 3.842 1.745 1068 H LYS 123 H LYS 123 12.241 4.350 3.620 1069 HA LYS 123 HA LYS 123 13.044 6.865 4.796 1070 HB2 LYS 123 2HB LYS 123 10.729 6.152 2.937 1071 HB3 LYS 123 3HB LYS 123 11.159 7.802 3.396 1072 HG2 LYS 123 2HG LYS 123 13.315 7.613 2.307 1073 HG3 LYS 123 3HG LYS 123 13.061 5.897 1.989 1074 HD2 LYS 123 2HD LYS 123 11.188 6.481 0.452 1075 HD3 LYS 123 3HD LYS 123 11.486 8.198 0.754 1076 HE2 LYS 123 2HE LYS 123 13.740 7.991 -0.213 1077 HE3 LYS 123 3HE LYS 123 13.494 6.261 -0.457 1078 HZ1 LYS 123 3HZ LYS 123 11.994 8.447 -1.782 1079 HZ2 LYS 123 1HZ LYS 123 11.697 6.797 -1.995 1080 HZ3 LYS 123 2HZ LYS 123 13.166 7.458 -2.495 1081 H ALA 124 H ALA 124 10.249 4.693 5.059 1082 HA ALA 124 HA ALA 124 8.846 6.062 7.114 1083 HB1 ALA 124 3HB ALA 124 7.771 4.330 5.733 1084 HB2 ALA 124 1HB ALA 124 7.657 3.921 7.449 1085 HB3 ALA 124 2HB ALA 124 8.839 3.106 6.420 1086 H GLY 125 H GLY 125 11.455 3.687 7.081 1087 HA2 GLY 125 2HA GLY 125 11.598 3.017 9.810 1088 HA3 GLY 125 3HA GLY 125 12.926 2.950 8.666 1089 H SER 126 H SER 126 12.906 5.751 8.007 1090 HA SER 126 HA SER 126 14.578 6.818 10.065 1091 HB2 SER 126 2HB SER 126 13.384 8.143 7.596 1092 HB3 SER 126 3HB SER 126 14.680 8.822 8.588 1093 HG SER 126 HG SER 126 14.877 6.261 7.414 1094 H LEU 127 H LEU 127 11.185 7.009 9.405 1095 HA LEU 127 HA LEU 127 10.616 9.222 11.225 1096 HB2 LEU 127 2HB LEU 127 8.739 7.285 9.806 1097 HB3 LEU 127 3HB LEU 127 8.246 8.738 10.667 1098 HG LEU 127 HG LEU 127 9.979 8.729 8.161 1099 HD11 LEU 127 1HD1 LEU 127 7.738 7.924 7.627 1100 HD12 LEU 127 2HD1 LEU 127 8.012 9.527 6.949 1101 HD13 LEU 127 3HD1 LEU 127 7.021 9.341 8.400 1102 HD21 LEU 127 3HD2 LEU 127 9.530 11.148 8.104 1103 HD22 LEU 127 1HD2 LEU 127 10.391 10.680 9.569 1104 HD23 LEU 127 2HD2 LEU 127 8.661 11.033 9.637 1105 H GLU 128 H GLU 128 10.508 5.705 11.118 1106 HA GLU 128 HA GLU 128 9.026 5.247 13.514 1107 HB2 GLU 128 2HB GLU 128 9.112 3.636 11.661 1108 HB3 GLU 128 3HB GLU 128 10.844 3.439 11.857 1109 HG2 GLU 128 2HG GLU 128 9.045 2.756 14.169 1110 HG3 GLU 128 3HG GLU 128 9.104 1.655 12.801 1111 H HIS 129 H HIS 129 12.465 4.358 12.901 1112 HA HIS 129 HA HIS 129 13.270 5.108 15.589 1113 HB2 HIS 129 2HB HIS 129 14.861 4.233 13.137 1114 HB3 HIS 129 3HB HIS 129 15.632 4.720 14.645 1115 HD1 HIS 129 HD1 HIS 129 15.082 1.752 13.046 1116 HD2 HIS 129 HD2 HIS 129 14.033 3.076 16.839 1117 HE1 HIS 129 HE1 HIS 129 14.764 -0.321 14.420 1118 HE2 HIS 129 HE2 HIS 129 13.907 0.513 16.629 1119 H HIS 130 H HIS 130 13.362 7.169 16.114 1120 HA HIS 130 HA HIS 130 12.865 9.282 14.367 1121 HB2 HIS 130 2HB HIS 130 12.184 9.349 16.708 1122 HB3 HIS 130 3HB HIS 130 13.859 9.290 17.245 1123 HD1 HIS 130 HD1 HIS 130 15.138 11.476 17.339 1124 HD2 HIS 130 HD2 HIS 130 11.388 11.890 15.612 1125 HE1 HIS 130 HE1 HIS 130 14.748 13.946 17.148 1126 HE2 HIS 130 HE2 HIS 130 12.526 14.157 15.993 1127 H HIS 131 H HIS 131 14.400 9.457 12.758 1128 HA HIS 131 HA HIS 131 17.143 10.223 13.305 1129 HB2 HIS 131 2HB HIS 131 15.422 10.205 10.790 1130 HB3 HIS 131 3HB HIS 131 17.055 10.858 10.791 1131 HD1 HIS 131 HD1 HIS 131 17.580 8.967 9.005 1132 HD2 HIS 131 HD2 HIS 131 16.697 7.575 12.811 1133 HE1 HIS 131 HE1 HIS 131 18.339 6.586 9.038 1134 HE2 HIS 131 HE2 HIS 131 17.651 5.730 11.297 1135 H HIS 132 H HIS 132 17.694 12.457 11.965 1136 HA HIS 132 HA HIS 132 16.560 14.609 13.483 1137 HB2 HIS 132 2HB HIS 132 18.424 14.629 11.064 1138 HB3 HIS 132 3HB HIS 132 18.009 16.061 12.005 1139 HD1 HIS 132 HD1 HIS 132 18.761 15.993 14.584 1140 HD2 HIS 132 HD2 HIS 132 20.533 13.167 12.106 1141 HE1 HIS 132 HE1 HIS 132 20.747 15.124 15.856 1142 HE2 HIS 132 HE2 HIS 132 21.832 13.465 14.309 1143 H HIS 133 H HIS 133 15.434 16.490 12.579 1144 HA HIS 133 HA HIS 133 13.038 15.655 11.385 1145 HB2 HIS 133 2HB HIS 133 13.181 17.595 12.925 1146 HB3 HIS 133 3HB HIS 133 14.066 18.508 11.707 1147 HD1 HIS 133 HD1 HIS 133 10.626 17.275 12.559 1148 HD2 HIS 133 HD2 HIS 133 12.453 19.604 9.639 1149 HE1 HIS 133 HE1 HIS 133 8.758 18.362 11.286 1150 HE2 HIS 133 HE2 HIS 133 9.881 19.675 9.461 1151 H HIS 134 H HIS 134 12.543 15.260 9.346 1152 HA HIS 134 HA HIS 134 13.793 16.781 7.137 1153 HB2 HIS 134 2HB HIS 134 13.603 14.537 5.812 1154 HB3 HIS 134 3HB HIS 134 14.937 14.724 6.940 1155 HD1 HIS 134 HD1 HIS 134 15.140 13.017 8.780 1156 HD2 HIS 134 HD2 HIS 134 11.518 12.731 6.777 1157 HE1 HIS 134 HE1 HIS 134 14.085 10.899 9.596 1158 HE2 HIS 134 HE2 HIS 134 12.019 10.646 8.193 Start of MODEL 2 1 H1 MET 1 1H MET 1 0.210 7.116 16.988 2 H2 MET 1 2H MET 1 -1.133 7.225 15.964 3 H3 MET 1 3H MET 1 -0.463 8.620 16.622 4 HA MET 1 HA MET 1 0.159 8.409 14.326 5 HB2 MET 1 2HB MET 1 2.602 7.744 16.030 6 HB3 MET 1 3HB MET 1 2.554 8.738 14.584 7 HG2 MET 1 2HG MET 1 1.404 10.501 15.811 8 HG3 MET 1 3HG MET 1 1.319 9.473 17.246 9 HE1 MET 1 3HE MET 1 3.974 11.957 18.576 10 HE2 MET 1 1HE MET 1 2.536 11.010 18.964 11 HE3 MET 1 2HE MET 1 2.454 12.283 17.743 12 H LYS 2 H LYS 2 0.326 6.894 12.687 13 HA LYS 2 HA LYS 2 1.814 4.397 13.133 14 HB2 LYS 2 2HB LYS 2 -1.040 4.481 12.029 15 HB3 LYS 2 3HB LYS 2 0.036 3.094 11.846 16 HG2 LYS 2 2HG LYS 2 0.170 2.943 14.352 17 HG3 LYS 2 3HG LYS 2 -1.029 4.230 14.451 18 HD2 LYS 2 2HD LYS 2 -2.110 2.076 14.767 19 HD3 LYS 2 3HD LYS 2 -2.657 2.787 13.248 20 HE2 LYS 2 2HE LYS 2 -1.351 1.260 11.962 21 HE3 LYS 2 3HE LYS 2 -0.414 0.757 13.371 22 HZ1 LYS 2 3HZ LYS 2 -2.318 -0.333 14.271 23 HZ2 LYS 2 1HZ LYS 2 -2.091 -0.878 12.686 24 HZ3 LYS 2 2HZ LYS 2 -3.316 0.235 13.031 25 H ILE 3 H ILE 3 3.094 3.910 11.447 26 HA ILE 3 HA ILE 3 2.942 5.522 8.979 27 HB ILE 3 HB ILE 3 5.201 3.661 9.876 28 HG12 ILE 3 2HG1 ILE 3 5.036 6.705 10.180 29 HG13 ILE 3 3HG1 ILE 3 4.846 5.552 11.498 30 HG21 ILE 3 1HG2 ILE 3 5.106 5.837 7.735 31 HG22 ILE 3 2HG2 ILE 3 5.157 4.096 7.447 32 HG23 ILE 3 3HG2 ILE 3 6.538 4.905 8.184 33 HD11 ILE 3 3HD1 ILE 3 7.047 6.513 11.513 34 HD12 ILE 3 1HD1 ILE 3 7.335 5.984 9.856 35 HD13 ILE 3 2HD1 ILE 3 7.148 4.792 11.147 36 H LEU 4 H LEU 4 1.950 4.584 7.287 37 HA LEU 4 HA LEU 4 1.492 1.650 7.342 38 HB2 LEU 4 2HB LEU 4 -0.333 3.787 6.176 39 HB3 LEU 4 3HB LEU 4 -0.687 2.069 6.343 40 HG LEU 4 HG LEU 4 -0.379 4.075 8.620 41 HD11 LEU 4 1HD1 LEU 4 -2.473 4.326 7.398 42 HD12 LEU 4 2HD1 LEU 4 -2.743 3.701 9.023 43 HD13 LEU 4 3HD1 LEU 4 -2.833 2.611 7.637 44 HD21 LEU 4 3HD2 LEU 4 -1.017 1.111 8.788 45 HD22 LEU 4 1HD2 LEU 4 -1.050 2.261 10.130 46 HD23 LEU 4 2HD2 LEU 4 0.471 1.894 9.324 47 H ILE 5 H ILE 5 2.814 0.776 5.835 48 HA ILE 5 HA ILE 5 3.283 2.077 3.262 49 HB ILE 5 HB ILE 5 4.021 -0.774 4.081 50 HG12 ILE 5 2HG1 ILE 5 5.052 0.828 5.672 51 HG13 ILE 5 3HG1 ILE 5 6.271 0.055 4.670 52 HG21 ILE 5 1HG2 ILE 5 5.728 -0.613 2.283 53 HG22 ILE 5 2HG2 ILE 5 5.127 0.994 1.864 54 HG23 ILE 5 3HG2 ILE 5 4.089 -0.418 1.654 55 HD11 ILE 5 3HD1 ILE 5 6.760 2.388 5.010 56 HD12 ILE 5 1HD1 ILE 5 5.203 2.854 4.330 57 HD13 ILE 5 2HD1 ILE 5 6.422 2.087 3.307 58 H LEU 6 H LEU 6 1.433 2.151 2.063 59 HA LEU 6 HA LEU 6 -0.467 -0.076 2.016 60 HB2 LEU 6 2HB LEU 6 -0.832 2.681 1.894 61 HB3 LEU 6 3HB LEU 6 -0.925 2.261 0.208 62 HG LEU 6 HG LEU 6 -3.175 2.289 0.966 63 HD11 LEU 6 1HD1 LEU 6 -2.731 0.322 -0.424 64 HD12 LEU 6 2HD1 LEU 6 -4.025 0.035 0.734 65 HD13 LEU 6 3HD1 LEU 6 -2.422 -0.647 1.022 66 HD21 LEU 6 3HD2 LEU 6 -2.741 2.363 3.357 67 HD22 LEU 6 1HD2 LEU 6 -2.303 0.651 3.365 68 HD23 LEU 6 2HD2 LEU 6 -3.957 1.144 2.999 69 H ILE 7 H ILE 7 -0.338 -1.565 0.417 70 HA ILE 7 HA ILE 7 0.956 -0.867 -2.159 71 HB ILE 7 HB ILE 7 1.449 -3.432 -0.558 72 HG12 ILE 7 2HG1 ILE 7 3.419 -1.247 -1.384 73 HG13 ILE 7 3HG1 ILE 7 2.735 -1.419 0.227 74 HG21 ILE 7 1HG2 ILE 7 2.956 -4.125 -2.407 75 HG22 ILE 7 2HG2 ILE 7 2.477 -2.698 -3.328 76 HG23 ILE 7 3HG2 ILE 7 1.289 -3.950 -2.962 77 HD11 ILE 7 3HD1 ILE 7 4.973 -2.262 0.157 78 HD12 ILE 7 1HD1 ILE 7 4.563 -3.373 -1.150 79 HD13 ILE 7 2HD1 ILE 7 3.845 -3.584 0.450 80 H ASN 8 H ASN 8 -0.570 -1.088 -3.659 81 HA ASN 8 HA ASN 8 -2.600 -3.223 -3.412 82 HB2 ASN 8 2HB ASN 8 -3.468 -0.892 -3.687 83 HB3 ASN 8 3HB ASN 8 -2.626 -0.760 -5.225 84 HD21 ASN 8 1HD2 ASN 8 -3.335 -2.170 -6.969 85 HD22 ASN 8 2HD2 ASN 8 -4.952 -2.779 -6.994 86 H THR 9 H THR 9 -1.754 -4.974 -4.346 87 HA THR 9 HA THR 9 -1.043 -4.793 -7.201 88 HB THR 9 HB THR 9 1.058 -5.331 -6.232 89 HG1 THR 9 HG1 THR 9 1.380 -6.958 -7.508 90 HG21 THR 9 3HG2 THR 9 1.456 -7.165 -4.619 91 HG22 THR 9 1HG2 THR 9 -0.286 -7.438 -4.515 92 HG23 THR 9 2HG2 THR 9 0.403 -5.917 -3.947 93 H ASN 10 H ASN 10 -2.276 -6.064 -8.480 94 HA ASN 10 HA ASN 10 -4.400 -7.667 -7.252 95 HB2 ASN 10 2HB ASN 10 -4.871 -5.971 -9.091 96 HB3 ASN 10 3HB ASN 10 -3.973 -7.000 -10.199 97 HD21 ASN 10 1HD2 ASN 10 -6.878 -6.720 -8.256 98 HD22 ASN 10 2HD2 ASN 10 -7.777 -7.956 -9.067 99 H ASN 11 H ASN 11 -1.285 -8.082 -8.402 100 HA ASN 11 HA ASN 11 -1.608 -10.753 -9.581 101 HB2 ASN 11 2HB ASN 11 0.874 -8.991 -9.299 102 HB3 ASN 11 3HB ASN 11 0.836 -10.556 -10.107 103 HD21 ASN 11 1HD2 ASN 11 1.424 -9.766 -12.129 104 HD22 ASN 11 2HD2 ASN 11 0.411 -8.730 -13.071 105 H ASP 12 H ASP 12 -1.506 -12.475 -8.312 106 HA ASP 12 HA ASP 12 -1.046 -12.460 -5.540 107 HB2 ASP 12 2HB ASP 12 -1.010 -14.859 -7.425 108 HB3 ASP 12 3HB ASP 12 -1.221 -14.926 -5.677 109 H GLU 13 H GLU 13 1.080 -13.247 -8.224 110 HA GLU 13 HA GLU 13 3.266 -14.416 -6.909 111 HB2 GLU 13 2HB GLU 13 3.207 -12.606 -9.366 112 HB3 GLU 13 3HB GLU 13 4.587 -13.599 -8.893 113 HG2 GLU 13 2HG GLU 13 3.417 -15.630 -9.350 114 HG3 GLU 13 3HG GLU 13 1.862 -14.805 -9.461 115 H LEU 14 H LEU 14 2.557 -10.995 -7.637 116 HA LEU 14 HA LEU 14 4.978 -10.016 -6.464 117 HB2 LEU 14 2HB LEU 14 2.530 -8.669 -7.602 118 HB3 LEU 14 3HB LEU 14 3.705 -7.723 -6.706 119 HG LEU 14 HG LEU 14 4.188 -7.509 -9.069 120 HD11 LEU 14 1HD1 LEU 14 6.520 -8.156 -9.128 121 HD12 LEU 14 2HD1 LEU 14 6.288 -9.307 -7.816 122 HD13 LEU 14 3HD1 LEU 14 6.107 -7.575 -7.519 123 HD21 LEU 14 3HD2 LEU 14 4.783 -9.401 -10.521 124 HD22 LEU 14 1HD2 LEU 14 3.133 -9.552 -9.919 125 HD23 LEU 14 2HD2 LEU 14 4.419 -10.536 -9.217 126 H ILE 15 H ILE 15 1.717 -10.545 -5.233 127 HA ILE 15 HA ILE 15 1.889 -9.122 -2.816 128 HB ILE 15 HB ILE 15 0.507 -11.815 -3.270 129 HG12 ILE 15 2HG1 ILE 15 -0.658 -8.990 -3.424 130 HG13 ILE 15 3HG1 ILE 15 -0.346 -10.045 -4.797 131 HG21 ILE 15 1HG2 ILE 15 -0.875 -11.281 -1.287 132 HG22 ILE 15 2HG2 ILE 15 0.052 -9.802 -1.027 133 HG23 ILE 15 3HG2 ILE 15 0.835 -11.375 -0.860 134 HD11 ILE 15 3HD1 ILE 15 -2.043 -11.617 -3.960 135 HD12 ILE 15 1HD1 ILE 15 -2.700 -10.008 -4.258 136 HD13 ILE 15 2HD1 ILE 15 -2.367 -10.529 -2.606 137 H LYS 16 H LYS 16 2.675 -12.600 -3.403 138 HA LYS 16 HA LYS 16 3.649 -13.082 -0.795 139 HB2 LYS 16 2HB LYS 16 4.496 -15.253 -1.697 140 HB3 LYS 16 3HB LYS 16 2.807 -14.933 -2.077 141 HG2 LYS 16 2HG LYS 16 3.404 -14.306 -4.369 142 HG3 LYS 16 3HG LYS 16 5.118 -14.523 -4.009 143 HD2 LYS 16 2HD LYS 16 3.022 -16.735 -3.913 144 HD3 LYS 16 3HD LYS 16 4.116 -16.441 -5.267 145 HE2 LYS 16 2HE LYS 16 6.055 -16.890 -3.783 146 HE3 LYS 16 3HE LYS 16 4.950 -17.207 -2.443 147 HZ1 LYS 16 3HZ LYS 16 5.066 -18.752 -4.980 148 HZ2 LYS 16 1HZ LYS 16 4.028 -19.054 -3.683 149 HZ3 LYS 16 2HZ LYS 16 5.696 -19.249 -3.492 150 H LYS 17 H LYS 17 5.351 -12.089 -3.737 151 HA LYS 17 HA LYS 17 8.025 -12.530 -2.870 152 HB2 LYS 17 2HB LYS 17 6.884 -10.569 -4.892 153 HB3 LYS 17 3HB LYS 17 8.611 -10.839 -4.661 154 HG2 LYS 17 2HG LYS 17 8.436 -13.123 -5.442 155 HG3 LYS 17 3HG LYS 17 6.670 -13.024 -5.472 156 HD2 LYS 17 2HD LYS 17 7.545 -12.791 -7.743 157 HD3 LYS 17 3HD LYS 17 6.797 -11.275 -7.234 158 HE2 LYS 17 2HE LYS 17 8.838 -10.707 -8.346 159 HE3 LYS 17 3HE LYS 17 9.144 -10.463 -6.627 160 HZ1 LYS 17 3HZ LYS 17 10.177 -12.691 -6.603 161 HZ2 LYS 17 1HZ LYS 17 10.972 -11.598 -7.613 162 HZ3 LYS 17 2HZ LYS 17 9.976 -12.784 -8.277 163 H ILE 18 H ILE 18 6.028 -9.558 -2.924 164 HA ILE 18 HA ILE 18 7.889 -7.831 -1.673 165 HB ILE 18 HB ILE 18 4.863 -7.674 -1.949 166 HG12 ILE 18 2HG1 ILE 18 7.100 -6.125 -3.352 167 HG13 ILE 18 3HG1 ILE 18 6.208 -7.476 -4.043 168 HG21 ILE 18 1HG2 ILE 18 4.954 -5.307 -1.236 169 HG22 ILE 18 2HG2 ILE 18 6.658 -5.499 -0.819 170 HG23 ILE 18 3HG2 ILE 18 5.425 -6.397 0.068 171 HD11 ILE 18 3HD1 ILE 18 5.399 -5.401 -4.942 172 HD12 ILE 18 1HD1 ILE 18 5.074 -4.768 -3.328 173 HD13 ILE 18 2HD1 ILE 18 4.142 -6.134 -3.949 174 H LYS 19 H LYS 19 5.454 -10.043 -0.324 175 HA LYS 19 HA LYS 19 5.485 -9.143 2.348 176 HB2 LYS 19 2HB LYS 19 4.933 -11.947 1.285 177 HB3 LYS 19 3HB LYS 19 4.672 -11.447 2.958 178 HG2 LYS 19 2HG LYS 19 3.110 -9.650 2.049 179 HG3 LYS 19 3HG LYS 19 3.224 -10.463 0.491 180 HD2 LYS 19 2HD LYS 19 2.145 -11.636 3.073 181 HD3 LYS 19 3HD LYS 19 1.198 -11.152 1.668 182 HE2 LYS 19 2HE LYS 19 2.224 -12.947 0.345 183 HE3 LYS 19 3HE LYS 19 3.233 -13.407 1.721 184 HZ1 LYS 19 3HZ LYS 19 1.332 -14.839 1.604 185 HZ2 LYS 19 1HZ LYS 19 0.274 -13.523 1.593 186 HZ3 LYS 19 2HZ LYS 19 1.186 -13.854 2.972 187 H LYS 20 H LYS 20 7.644 -11.384 0.621 188 HA LYS 20 HA LYS 20 9.122 -12.222 2.936 189 HB2 LYS 20 2HB LYS 20 9.928 -12.299 -0.002 190 HB3 LYS 20 3HB LYS 20 10.779 -13.123 1.301 191 HG2 LYS 20 2HG LYS 20 7.958 -13.707 0.332 192 HG3 LYS 20 3HG LYS 20 9.393 -14.687 0.033 193 HD2 LYS 20 2HD LYS 20 8.090 -14.191 2.745 194 HD3 LYS 20 3HD LYS 20 7.993 -15.675 1.794 195 HE2 LYS 20 2HE LYS 20 10.436 -15.988 2.035 196 HE3 LYS 20 3HE LYS 20 10.528 -14.510 2.999 197 HZ1 LYS 20 3HZ LYS 20 9.058 -16.991 3.699 198 HZ2 LYS 20 1HZ LYS 20 8.993 -15.552 4.587 199 HZ3 LYS 20 2HZ LYS 20 10.451 -16.388 4.443 200 H GLU 21 H GLU 21 9.749 -9.857 0.352 201 HA GLU 21 HA GLU 21 12.114 -8.700 1.093 202 HB2 GLU 21 2HB GLU 21 9.646 -7.181 0.147 203 HB3 GLU 21 3HB GLU 21 11.293 -6.549 0.112 204 HG2 GLU 21 2HG GLU 21 10.180 -8.872 -1.492 205 HG3 GLU 21 3HG GLU 21 10.668 -7.292 -2.102 206 H VAL 22 H VAL 22 8.964 -7.997 2.505 207 HA VAL 22 HA VAL 22 10.062 -5.975 4.322 208 HB VAL 22 HB VAL 22 7.796 -5.373 4.802 209 HG11 VAL 22 1HG1 VAL 22 8.088 -6.027 1.860 210 HG12 VAL 22 2HG1 VAL 22 8.649 -4.570 2.678 211 HG13 VAL 22 3HG1 VAL 22 6.926 -4.889 2.533 212 HG21 VAL 22 3HG2 VAL 22 6.889 -7.895 3.356 213 HG22 VAL 22 1HG2 VAL 22 5.818 -6.621 3.951 214 HG23 VAL 22 2HG2 VAL 22 6.758 -7.585 5.088 215 H GLU 23 H GLU 23 9.297 -9.319 4.400 216 HA GLU 23 HA GLU 23 8.468 -9.718 7.072 217 HB2 GLU 23 2HB GLU 23 8.331 -11.379 5.171 218 HB3 GLU 23 3HB GLU 23 10.068 -11.632 5.310 219 HG2 GLU 23 2HG GLU 23 9.721 -12.462 7.635 220 HG3 GLU 23 3HG GLU 23 7.980 -12.260 7.425 221 H ASN 24 H ASN 24 11.667 -9.856 5.546 222 HA ASN 24 HA ASN 24 13.136 -10.355 7.965 223 HB2 ASN 24 2HB ASN 24 14.077 -9.497 5.191 224 HB3 ASN 24 3HB ASN 24 15.150 -9.983 6.505 225 HD21 ASN 24 1HD2 ASN 24 15.232 -12.174 7.113 226 HD22 ASN 24 2HD2 ASN 24 14.583 -13.432 6.123 227 H GLN 25 H GLN 25 11.766 -7.531 6.658 228 HA GLN 25 HA GLN 25 13.624 -5.698 8.053 229 HB2 GLN 25 2HB GLN 25 11.300 -5.046 6.184 230 HB3 GLN 25 3HB GLN 25 12.463 -3.893 6.836 231 HG2 GLN 25 2HG GLN 25 13.099 -6.154 4.907 232 HG3 GLN 25 3HG GLN 25 12.915 -4.457 4.481 233 HE21 GLN 25 1HE2 GLN 25 14.983 -6.830 5.939 234 HE22 GLN 25 2HE2 GLN 25 16.386 -5.836 6.047 235 H GLY 26 H GLY 26 11.129 -7.544 8.963 236 HA2 GLY 26 2HA GLY 26 9.754 -7.569 10.769 237 HA3 GLY 26 3HA GLY 26 10.562 -6.117 11.323 238 H TYR 27 H TYR 27 8.745 -6.321 8.299 239 HA TYR 27 HA TYR 27 6.777 -4.386 9.303 240 HB2 TYR 27 2HB TYR 27 7.604 -5.232 6.521 241 HB3 TYR 27 3HB TYR 27 6.060 -4.424 6.760 242 HD1 TYR 27 HD2 TYR 27 9.727 -4.009 7.472 243 HD2 TYR 27 HD1 TYR 27 5.990 -2.049 6.778 244 HE1 TYR 27 HE2 TYR 27 10.860 -1.832 7.519 245 HE2 TYR 27 HE1 TYR 27 7.125 0.134 6.834 246 HH TYR 27 HH TYR 27 10.538 0.454 6.822 247 H GLN 28 H GLN 28 5.028 -5.130 10.149 248 HA GLN 28 HA GLN 28 4.108 -7.820 9.992 249 HB2 GLN 28 2HB GLN 28 2.887 -5.280 11.151 250 HB3 GLN 28 3HB GLN 28 2.089 -6.842 11.257 251 HG2 GLN 28 2HG GLN 28 3.278 -6.177 13.342 252 HG3 GLN 28 3HG GLN 28 3.796 -7.725 12.694 253 HE21 GLN 28 1HE2 GLN 28 4.673 -4.303 12.831 254 HE22 GLN 28 2HE2 GLN 28 6.379 -4.546 12.752 255 H VAL 29 H VAL 29 3.278 -8.557 8.153 256 HA VAL 29 HA VAL 29 1.983 -6.926 6.180 257 HB VAL 29 HB VAL 29 2.210 -9.968 6.317 258 HG11 VAL 29 1HG1 VAL 29 1.676 -9.911 3.893 259 HG12 VAL 29 2HG1 VAL 29 1.419 -8.171 3.987 260 HG13 VAL 29 3HG1 VAL 29 0.352 -9.269 4.864 261 HG21 VAL 29 3HG2 VAL 29 4.076 -9.718 4.712 262 HG22 VAL 29 1HG2 VAL 29 4.427 -8.888 6.231 263 HG23 VAL 29 2HG2 VAL 29 3.936 -7.961 4.810 264 H ARG 30 H ARG 30 -0.028 -6.290 6.382 265 HA ARG 30 HA ARG 30 -2.147 -8.054 7.458 266 HB2 ARG 30 2HB ARG 30 -2.079 -4.996 7.297 267 HB3 ARG 30 3HB ARG 30 -3.402 -5.959 7.952 268 HG2 ARG 30 2HG ARG 30 -0.599 -5.747 9.121 269 HG3 ARG 30 3HG ARG 30 -2.046 -4.937 9.735 270 HD2 ARG 30 2HD ARG 30 -1.526 -7.930 9.657 271 HD3 ARG 30 3HD ARG 30 -1.570 -6.899 11.090 272 HE ARG 30 HE ARG 30 -4.009 -6.473 10.239 273 HH11 ARG 30 1HH1 ARG 30 -2.345 -9.569 10.247 274 HH12 ARG 30 2HH1 ARG 30 -3.807 -10.484 10.402 275 HH21 ARG 30 1HH2 ARG 30 -5.918 -7.695 10.409 276 HH22 ARG 30 2HH2 ARG 30 -5.836 -9.425 10.493 277 H ASP 31 H ASP 31 -3.146 -8.933 5.733 278 HA ASP 31 HA ASP 31 -3.157 -7.493 3.138 279 HB2 ASP 31 2HB ASP 31 -3.477 -9.676 2.051 280 HB3 ASP 31 3HB ASP 31 -2.052 -9.712 3.081 281 H VAL 32 H VAL 32 -5.046 -7.147 2.051 282 HA VAL 32 HA VAL 32 -7.620 -7.826 3.345 283 HB VAL 32 HB VAL 32 -6.794 -5.118 2.183 284 HG11 VAL 32 1HG1 VAL 32 -9.089 -5.606 1.449 285 HG12 VAL 32 2HG1 VAL 32 -9.095 -4.327 2.664 286 HG13 VAL 32 3HG1 VAL 32 -9.570 -5.967 3.110 287 HG21 VAL 32 3HG2 VAL 32 -7.313 -4.234 4.441 288 HG22 VAL 32 1HG2 VAL 32 -6.041 -5.458 4.501 289 HG23 VAL 32 2HG2 VAL 32 -7.685 -5.867 4.999 290 H ASN 33 H ASN 33 -8.618 -9.135 1.992 291 HA ASN 33 HA ASN 33 -8.626 -8.608 -0.931 292 HB2 ASN 33 2HB ASN 33 -8.954 -11.254 0.560 293 HB3 ASN 33 3HB ASN 33 -9.119 -11.061 -1.182 294 HD21 ASN 33 1HD2 ASN 33 -6.888 -11.123 1.496 295 HD22 ASN 33 2HD2 ASN 33 -5.441 -11.257 0.564 296 H ASP 34 H ASP 34 -10.438 -8.184 1.776 297 HA ASP 34 HA ASP 34 -13.028 -8.361 0.378 298 HB2 ASP 34 2HB ASP 34 -12.546 -10.518 1.680 299 HB3 ASP 34 3HB ASP 34 -12.542 -9.560 3.154 300 H SER 35 H SER 35 -14.606 -6.924 1.227 301 HA SER 35 HA SER 35 -13.726 -4.472 2.230 302 HB2 SER 35 2HB SER 35 -16.201 -3.962 2.443 303 HB3 SER 35 3HB SER 35 -15.724 -4.601 0.871 304 HG SER 35 HG SER 35 -17.252 -5.988 1.221 305 H ASP 36 H ASP 36 -15.133 -7.228 3.960 306 HA ASP 36 HA ASP 36 -15.487 -5.986 6.474 307 HB2 ASP 36 2HB ASP 36 -16.517 -8.171 5.946 308 HB3 ASP 36 3HB ASP 36 -14.927 -8.931 5.910 309 H GLU 37 H GLU 37 -12.712 -7.695 5.047 310 HA GLU 37 HA GLU 37 -11.004 -7.729 7.318 311 HB2 GLU 37 2HB GLU 37 -10.281 -7.662 4.352 312 HB3 GLU 37 3HB GLU 37 -9.144 -8.027 5.651 313 HG2 GLU 37 2HG GLU 37 -11.593 -9.660 4.909 314 HG3 GLU 37 3HG GLU 37 -9.921 -10.059 4.517 315 H LEU 38 H LEU 38 -11.547 -5.393 4.746 316 HA LEU 38 HA LEU 38 -9.636 -3.435 5.341 317 HB2 LEU 38 2HB LEU 38 -10.941 -3.512 3.294 318 HB3 LEU 38 3HB LEU 38 -12.429 -3.251 4.169 319 HG LEU 38 HG LEU 38 -10.356 -1.068 4.353 320 HD11 LEU 38 1HD1 LEU 38 -10.292 -1.670 1.984 321 HD12 LEU 38 2HD1 LEU 38 -11.021 -0.087 2.236 322 HD13 LEU 38 3HD1 LEU 38 -12.045 -1.483 1.881 323 HD21 LEU 38 3HD2 LEU 38 -12.521 -0.784 5.534 324 HD22 LEU 38 1HD2 LEU 38 -13.381 -0.956 3.998 325 HD23 LEU 38 2HD2 LEU 38 -12.313 0.425 4.268 326 H LYS 39 H LYS 39 -13.014 -3.754 6.478 327 HA LYS 39 HA LYS 39 -12.972 -1.428 8.130 328 HB2 LYS 39 2HB LYS 39 -14.908 -3.775 8.124 329 HB3 LYS 39 3HB LYS 39 -15.177 -2.234 8.947 330 HG2 LYS 39 2HG LYS 39 -15.076 -1.076 6.731 331 HG3 LYS 39 3HG LYS 39 -14.897 -2.646 5.948 332 HD2 LYS 39 2HD LYS 39 -17.214 -1.985 5.761 333 HD3 LYS 39 3HD LYS 39 -17.122 -3.323 6.909 334 HE2 LYS 39 2HE LYS 39 -17.327 -1.767 8.789 335 HE3 LYS 39 3HE LYS 39 -17.273 -0.388 7.690 336 HZ1 LYS 39 3HZ LYS 39 -19.351 -1.166 6.704 337 HZ2 LYS 39 1HZ LYS 39 -19.523 -0.857 8.354 338 HZ3 LYS 39 2HZ LYS 39 -19.410 -2.447 7.799 339 H LYS 40 H LYS 40 -12.070 -4.778 8.690 340 HA LYS 40 HA LYS 40 -11.984 -4.750 11.535 341 HB2 LYS 40 2HB LYS 40 -10.170 -6.320 9.640 342 HB3 LYS 40 3HB LYS 40 -10.379 -6.642 11.359 343 HG2 LYS 40 2HG LYS 40 -12.496 -6.951 9.216 344 HG3 LYS 40 3HG LYS 40 -11.580 -8.260 9.948 345 HD2 LYS 40 2HD LYS 40 -13.481 -6.425 11.467 346 HD3 LYS 40 3HD LYS 40 -13.919 -8.005 10.815 347 HE2 LYS 40 2HE LYS 40 -12.155 -9.044 12.244 348 HE3 LYS 40 3HE LYS 40 -11.833 -7.458 12.956 349 HZ1 LYS 40 3HZ LYS 40 -14.421 -8.915 13.051 350 HZ2 LYS 40 1HZ LYS 40 -14.121 -7.395 13.724 351 HZ3 LYS 40 2HZ LYS 40 -13.329 -8.753 14.331 352 H GLU 41 H GLU 41 -9.655 -3.929 8.966 353 HA GLU 41 HA GLU 41 -7.529 -3.265 10.769 354 HB2 GLU 41 2HB GLU 41 -7.861 -2.805 7.785 355 HB3 GLU 41 3HB GLU 41 -6.411 -2.335 8.675 356 HG2 GLU 41 2HG GLU 41 -7.505 -5.140 8.303 357 HG3 GLU 41 3HG GLU 41 -6.017 -4.478 7.626 358 H MET 42 H MET 42 -10.114 -1.322 9.266 359 HA MET 42 HA MET 42 -9.037 1.246 9.770 360 HB2 MET 42 2HB MET 42 -11.975 0.422 9.770 361 HB3 MET 42 3HB MET 42 -11.387 2.076 9.705 362 HG2 MET 42 2HG MET 42 -10.930 -0.038 7.593 363 HG3 MET 42 3HG MET 42 -12.105 1.267 7.514 364 HE1 MET 42 3HE MET 42 -8.782 0.141 6.264 365 HE2 MET 42 1HE MET 42 -8.152 0.594 7.850 366 HE3 MET 42 2HE MET 42 -7.684 1.514 6.420 367 H LYS 43 H LYS 43 -10.877 -0.969 11.798 368 HA LYS 43 HA LYS 43 -11.071 0.544 14.167 369 HB2 LYS 43 2HB LYS 43 -10.849 -2.456 13.721 370 HB3 LYS 43 3HB LYS 43 -11.185 -1.737 15.294 371 HG2 LYS 43 2HG LYS 43 -13.291 -0.827 14.497 372 HG3 LYS 43 3HG LYS 43 -12.936 -1.342 12.845 373 HD2 LYS 43 2HD LYS 43 -14.576 -2.822 14.026 374 HD3 LYS 43 3HD LYS 43 -13.144 -3.675 13.448 375 HE2 LYS 43 2HE LYS 43 -13.866 -4.383 15.732 376 HE3 LYS 43 3HE LYS 43 -12.223 -3.751 15.702 377 HZ1 LYS 43 3HZ LYS 43 -12.996 -1.689 16.615 378 HZ2 LYS 43 1HZ LYS 43 -13.546 -2.954 17.594 379 HZ3 LYS 43 2HZ LYS 43 -14.607 -2.186 16.526 380 H LYS 44 H LYS 44 -8.590 -1.730 13.039 381 HA LYS 44 HA LYS 44 -6.968 -1.809 15.353 382 HB2 LYS 44 2HB LYS 44 -6.328 -2.386 12.429 383 HB3 LYS 44 3HB LYS 44 -5.286 -2.846 13.775 384 HG2 LYS 44 2HG LYS 44 -8.155 -3.781 13.774 385 HG3 LYS 44 3HG LYS 44 -7.011 -4.569 12.688 386 HD2 LYS 44 2HD LYS 44 -6.595 -4.312 15.697 387 HD3 LYS 44 3HD LYS 44 -7.318 -5.718 14.903 388 HE2 LYS 44 2HE LYS 44 -4.495 -4.664 14.511 389 HE3 LYS 44 3HE LYS 44 -4.974 -6.179 15.281 390 HZ1 LYS 44 3HZ LYS 44 -5.301 -5.479 12.404 391 HZ2 LYS 44 1HZ LYS 44 -5.915 -6.880 13.127 392 HZ3 LYS 44 2HZ LYS 44 -4.251 -6.627 13.063 393 H LEU 45 H LEU 45 -6.886 0.292 12.513 394 HA LEU 45 HA LEU 45 -4.376 1.521 12.992 395 HB2 LEU 45 2HB LEU 45 -6.785 2.623 11.498 396 HB3 LEU 45 3HB LEU 45 -5.159 3.273 11.424 397 HG LEU 45 HG LEU 45 -6.068 0.586 10.351 398 HD11 LEU 45 1HD1 LEU 45 -5.533 1.499 8.156 399 HD12 LEU 45 2HD1 LEU 45 -5.114 3.051 8.889 400 HD13 LEU 45 3HD1 LEU 45 -6.774 2.450 8.969 401 HD21 LEU 45 3HD2 LEU 45 -3.802 0.291 9.463 402 HD22 LEU 45 1HD2 LEU 45 -3.806 0.342 11.225 403 HD23 LEU 45 2HD2 LEU 45 -3.271 1.751 10.304 404 H ALA 46 H ALA 46 -7.710 2.471 13.796 405 HA ALA 46 HA ALA 46 -7.051 4.924 15.102 406 HB1 ALA 46 3HB ALA 46 -9.581 3.251 15.273 407 HB2 ALA 46 1HB ALA 46 -9.253 4.513 14.081 408 HB3 ALA 46 2HB ALA 46 -9.416 4.933 15.788 409 H GLU 47 H GLU 47 -7.410 1.601 16.203 410 HA GLU 47 HA GLU 47 -7.574 2.313 19.036 411 HB2 GLU 47 2HB GLU 47 -7.890 -0.301 17.513 412 HB3 GLU 47 3HB GLU 47 -7.919 -0.228 19.273 413 HG2 GLU 47 2HG GLU 47 -9.909 1.166 19.245 414 HG3 GLU 47 3HG GLU 47 -9.826 1.333 17.491 415 H GLU 48 H GLU 48 -5.133 1.417 16.794 416 HA GLU 48 HA GLU 48 -3.220 0.949 19.017 417 HB2 GLU 48 2HB GLU 48 -3.175 -0.791 17.280 418 HB3 GLU 48 3HB GLU 48 -2.944 0.418 16.024 419 HG2 GLU 48 2HG GLU 48 -0.711 0.920 16.810 420 HG3 GLU 48 3HG GLU 48 -0.941 -0.063 18.259 421 H LYS 49 H LYS 49 -2.147 2.726 19.643 422 HA LYS 49 HA LYS 49 -2.081 5.107 17.911 423 HB2 LYS 49 2HB LYS 49 -2.973 5.016 20.394 424 HB3 LYS 49 3HB LYS 49 -1.276 5.075 20.838 425 HG2 LYS 49 2HG LYS 49 -2.240 7.297 20.933 426 HG3 LYS 49 3HG LYS 49 -1.045 7.225 19.640 427 HD2 LYS 49 2HD LYS 49 -2.973 8.496 18.887 428 HD3 LYS 49 3HD LYS 49 -2.882 6.998 17.968 429 HE2 LYS 49 2HE LYS 49 -4.696 7.292 20.385 430 HE3 LYS 49 3HE LYS 49 -5.203 7.780 18.772 431 HZ1 LYS 49 3HZ LYS 49 -4.457 5.036 19.638 432 HZ2 LYS 49 1HZ LYS 49 -4.773 5.477 18.033 433 HZ3 LYS 49 2HZ LYS 49 -5.987 5.593 19.197 434 H ASN 50 H ASN 50 -0.048 2.581 18.888 435 HA ASN 50 HA ASN 50 2.466 4.042 18.904 436 HB2 ASN 50 2HB ASN 50 1.865 1.048 19.013 437 HB3 ASN 50 3HB ASN 50 3.479 1.744 19.168 438 HD21 ASN 50 1HD2 ASN 50 1.968 0.142 21.110 439 HD22 ASN 50 2HD2 ASN 50 1.859 1.109 22.539 440 H PHE 51 H PHE 51 3.842 4.246 17.252 441 HA PHE 51 HA PHE 51 2.976 3.627 14.554 442 HB2 PHE 51 2HB PHE 51 5.247 4.887 13.993 443 HB3 PHE 51 3HB PHE 51 3.841 5.778 14.552 444 HD1 PHE 51 HD1 PHE 51 3.794 6.813 16.777 445 HD2 PHE 51 HD2 PHE 51 7.242 4.644 15.473 446 HE1 PHE 51 HE1 PHE 51 5.098 7.810 18.592 447 HE2 PHE 51 HE2 PHE 51 8.534 5.648 17.305 448 HZ PHE 51 HZ PHE 51 7.467 7.228 18.859 449 H GLU 52 H GLU 52 3.054 1.397 14.856 450 HA GLU 52 HA GLU 52 5.606 -0.006 14.799 451 HB2 GLU 52 2HB GLU 52 3.655 -0.927 16.045 452 HB3 GLU 52 3HB GLU 52 2.713 -0.977 14.565 453 HG2 GLU 52 2HG GLU 52 3.496 -3.205 15.174 454 HG3 GLU 52 3HG GLU 52 4.207 -2.693 13.644 455 H LYS 53 H LYS 53 6.170 -1.377 12.960 456 HA LYS 53 HA LYS 53 5.760 -0.318 10.358 457 HB2 LYS 53 2HB LYS 53 6.937 -2.939 11.363 458 HB3 LYS 53 3HB LYS 53 6.774 -2.589 9.654 459 HG2 LYS 53 2HG LYS 53 8.984 -2.092 10.115 460 HG3 LYS 53 3HG LYS 53 8.190 -0.518 10.056 461 HD2 LYS 53 2HD LYS 53 8.343 -0.232 12.413 462 HD3 LYS 53 3HD LYS 53 8.703 -1.940 12.693 463 HE2 LYS 53 2HE LYS 53 10.892 -1.673 11.580 464 HE3 LYS 53 3HE LYS 53 10.525 0.022 11.242 465 HZ1 LYS 53 3HZ LYS 53 11.947 -0.195 13.155 466 HZ2 LYS 53 1HZ LYS 53 10.817 -1.183 13.935 467 HZ3 LYS 53 2HZ LYS 53 10.445 0.433 13.616 468 H ILE 54 H ILE 54 3.547 -0.267 9.876 469 HA ILE 54 HA ILE 54 2.143 -2.885 9.738 470 HB ILE 54 HB ILE 54 0.848 -0.115 9.937 471 HG12 ILE 54 2HG1 ILE 54 1.925 -0.760 12.079 472 HG13 ILE 54 3HG1 ILE 54 0.176 -0.800 12.234 473 HG21 ILE 54 1HG2 ILE 54 -1.284 -1.358 10.225 474 HG22 ILE 54 2HG2 ILE 54 -0.436 -2.881 9.948 475 HG23 ILE 54 3HG2 ILE 54 -0.545 -1.685 8.654 476 HD11 ILE 54 3HD1 ILE 54 1.188 -2.650 13.383 477 HD12 ILE 54 1HD1 ILE 54 1.986 -3.183 11.905 478 HD13 ILE 54 2HD1 ILE 54 0.223 -3.245 12.032 479 H LEU 55 H LEU 55 2.135 -3.612 7.763 480 HA LEU 55 HA LEU 55 2.027 -1.772 5.448 481 HB2 LEU 55 2HB LEU 55 3.989 -3.415 5.747 482 HB3 LEU 55 3HB LEU 55 2.850 -4.704 5.409 483 HG LEU 55 HG LEU 55 3.322 -2.423 3.449 484 HD11 LEU 55 1HD1 LEU 55 4.802 -5.051 3.499 485 HD12 LEU 55 2HD1 LEU 55 5.475 -3.464 3.880 486 HD13 LEU 55 3HD1 LEU 55 4.911 -3.807 2.248 487 HD21 LEU 55 3HD2 LEU 55 2.249 -5.226 2.987 488 HD22 LEU 55 1HD2 LEU 55 2.509 -3.996 1.744 489 HD23 LEU 55 2HD2 LEU 55 1.303 -3.735 2.999 490 H ILE 56 H ILE 56 0.098 -1.672 4.479 491 HA ILE 56 HA ILE 56 -1.886 -3.827 4.897 492 HB ILE 56 HB ILE 56 -2.362 -0.965 3.953 493 HG12 ILE 56 2HG1 ILE 56 -1.659 -1.025 6.370 494 HG13 ILE 56 3HG1 ILE 56 -3.302 -0.442 6.157 495 HG21 ILE 56 1HG2 ILE 56 -4.767 -1.469 4.300 496 HG22 ILE 56 2HG2 ILE 56 -4.352 -3.136 4.705 497 HG23 ILE 56 3HG2 ILE 56 -4.037 -2.518 3.083 498 HD11 ILE 56 3HD1 ILE 56 -4.165 -2.617 6.878 499 HD12 ILE 56 1HD1 ILE 56 -3.105 -1.888 8.084 500 HD13 ILE 56 2HD1 ILE 56 -2.510 -3.204 7.075 501 H ILE 57 H ILE 57 -1.717 -5.236 3.215 502 HA ILE 57 HA ILE 57 -1.354 -4.350 0.453 503 HB ILE 57 HB ILE 57 -1.844 -7.162 1.555 504 HG12 ILE 57 2HG1 ILE 57 0.720 -5.831 0.573 505 HG13 ILE 57 3HG1 ILE 57 0.356 -6.296 2.231 506 HG21 ILE 57 1HG2 ILE 57 -1.116 -6.337 -1.286 507 HG22 ILE 57 2HG2 ILE 57 -2.679 -6.967 -0.765 508 HG23 ILE 57 3HG2 ILE 57 -1.251 -7.999 -0.702 509 HD11 ILE 57 3HD1 ILE 57 0.361 -8.658 1.544 510 HD12 ILE 57 1HD1 ILE 57 1.895 -7.848 1.240 511 HD13 ILE 57 2HD1 ILE 57 0.793 -8.166 -0.098 512 H SER 58 H SER 58 -3.007 -4.146 -0.978 513 HA SER 58 HA SER 58 -5.663 -5.293 -0.391 514 HB2 SER 58 2HB SER 58 -5.740 -2.832 0.053 515 HB3 SER 58 3HB SER 58 -5.164 -2.516 -1.582 516 HG SER 58 HG SER 58 -7.078 -2.976 -2.359 517 H ASN 59 H ASN 59 -6.408 -6.481 -2.092 518 HA ASN 59 HA ASN 59 -4.779 -6.714 -4.506 519 HB2 ASN 59 2HB ASN 59 -5.641 -8.733 -3.308 520 HB3 ASN 59 3HB ASN 59 -7.291 -8.228 -3.653 521 HD21 ASN 59 1HD2 ASN 59 -4.331 -9.509 -5.021 522 HD22 ASN 59 2HD2 ASN 59 -5.024 -10.062 -6.505 523 H ASP 60 H ASP 60 -7.722 -5.239 -3.476 524 HA ASP 60 HA ASP 60 -8.691 -4.748 -6.225 525 HB2 ASP 60 2HB ASP 60 -10.217 -6.076 -4.800 526 HB3 ASP 60 3HB ASP 60 -10.172 -4.831 -3.559 527 H LYS 61 H LYS 61 -8.864 -2.664 -6.923 528 HA LYS 61 HA LYS 61 -7.458 -0.619 -5.457 529 HB2 LYS 61 2HB LYS 61 -8.825 -0.562 -8.175 530 HB3 LYS 61 3HB LYS 61 -7.856 0.762 -7.526 531 HG2 LYS 61 2HG LYS 61 -5.862 -0.630 -7.507 532 HG3 LYS 61 3HG LYS 61 -6.794 -2.047 -7.994 533 HD2 LYS 61 2HD LYS 61 -6.424 0.458 -9.697 534 HD3 LYS 61 3HD LYS 61 -5.476 -1.024 -9.866 535 HE2 LYS 61 2HE LYS 61 -7.570 -2.273 -10.383 536 HE3 LYS 61 3HE LYS 61 -8.480 -0.764 -10.274 537 HZ1 LYS 61 3HZ LYS 61 -7.251 0.104 -12.131 538 HZ2 LYS 61 1HZ LYS 61 -7.925 -1.383 -12.563 539 HZ3 LYS 61 2HZ LYS 61 -6.274 -1.269 -12.204 540 H GLN 62 H GLN 62 -10.823 -1.398 -5.833 541 HA GLN 62 HA GLN 62 -11.826 1.188 -5.014 542 HB2 GLN 62 2HB GLN 62 -13.253 -0.339 -6.339 543 HB3 GLN 62 3HB GLN 62 -13.195 -1.535 -5.052 544 HG2 GLN 62 2HG GLN 62 -15.333 -0.373 -4.998 545 HG3 GLN 62 3HG GLN 62 -14.404 0.014 -3.546 546 HE21 GLN 62 1HE2 GLN 62 -15.684 1.876 -3.250 547 HE22 GLN 62 2HE2 GLN 62 -15.457 3.306 -4.189 548 H LEU 63 H LEU 63 -11.045 -1.936 -3.430 549 HA LEU 63 HA LEU 63 -11.691 -1.209 -0.776 550 HB2 LEU 63 2HB LEU 63 -9.562 -3.111 -1.835 551 HB3 LEU 63 3HB LEU 63 -9.888 -2.903 -0.119 552 HG LEU 63 HG LEU 63 -11.791 -4.050 -2.195 553 HD11 LEU 63 1HD1 LEU 63 -10.390 -5.348 0.163 554 HD12 LEU 63 2HD1 LEU 63 -10.012 -5.592 -1.544 555 HD13 LEU 63 3HD1 LEU 63 -11.563 -6.130 -0.904 556 HD21 LEU 63 3HD2 LEU 63 -12.269 -3.555 0.764 557 HD22 LEU 63 1HD2 LEU 63 -13.339 -4.457 -0.317 558 HD23 LEU 63 2HD2 LEU 63 -13.069 -2.738 -0.582 559 H LEU 64 H LEU 64 -8.804 -0.721 -2.761 560 HA LEU 64 HA LEU 64 -7.117 0.479 -0.882 561 HB2 LEU 64 2HB LEU 64 -6.333 -0.188 -3.080 562 HB3 LEU 64 3HB LEU 64 -7.410 0.965 -3.845 563 HG LEU 64 HG LEU 64 -5.951 2.657 -2.221 564 HD11 LEU 64 1HD1 LEU 64 -3.921 0.654 -3.126 565 HD12 LEU 64 2HD1 LEU 64 -4.506 0.826 -1.475 566 HD13 LEU 64 3HD1 LEU 64 -3.652 2.156 -2.248 567 HD21 LEU 64 3HD2 LEU 64 -5.252 1.872 -5.048 568 HD22 LEU 64 1HD2 LEU 64 -4.741 3.346 -4.216 569 HD23 LEU 64 2HD2 LEU 64 -6.453 3.071 -4.545 570 H LYS 65 H LYS 65 -9.610 1.953 -3.020 571 HA LYS 65 HA LYS 65 -9.291 4.644 -2.312 572 HB2 LYS 65 2HB LYS 65 -11.700 3.079 -3.263 573 HB3 LYS 65 3HB LYS 65 -11.840 4.786 -2.862 574 HG2 LYS 65 2HG LYS 65 -10.096 5.307 -4.554 575 HG3 LYS 65 3HG LYS 65 -10.042 3.598 -4.992 576 HD2 LYS 65 2HD LYS 65 -11.438 5.014 -6.536 577 HD3 LYS 65 3HD LYS 65 -12.301 3.651 -5.825 578 HE2 LYS 65 2HE LYS 65 -13.648 5.759 -5.890 579 HE3 LYS 65 3HE LYS 65 -13.445 5.125 -4.258 580 HZ1 LYS 65 3HZ LYS 65 -11.739 7.270 -5.389 581 HZ2 LYS 65 1HZ LYS 65 -11.844 6.781 -3.775 582 HZ3 LYS 65 2HZ LYS 65 -13.147 7.579 -4.504 583 H GLU 66 H GLU 66 -11.626 2.282 -0.943 584 HA GLU 66 HA GLU 66 -12.742 3.920 1.025 585 HB2 GLU 66 2HB GLU 66 -12.318 0.933 1.467 586 HB3 GLU 66 3HB GLU 66 -13.627 1.939 2.072 587 HG2 GLU 66 2HG GLU 66 -13.194 0.957 -0.757 588 HG3 GLU 66 3HG GLU 66 -14.462 0.468 0.357 589 H MET 67 H MET 67 -9.973 1.730 1.187 590 HA MET 67 HA MET 67 -9.151 1.837 3.811 591 HB2 MET 67 2HB MET 67 -8.196 0.451 1.876 592 HB3 MET 67 3HB MET 67 -7.277 1.867 1.403 593 HG2 MET 67 2HG MET 67 -5.761 0.533 2.605 594 HG3 MET 67 3HG MET 67 -6.246 1.776 3.757 595 HE1 MET 67 3HE MET 67 -7.871 -2.550 3.825 596 HE2 MET 67 1HE MET 67 -6.680 -1.988 2.657 597 HE3 MET 67 2HE MET 67 -8.335 -1.381 2.587 598 H LEU 68 H LEU 68 -7.900 3.896 1.157 599 HA LEU 68 HA LEU 68 -6.157 5.431 2.798 600 HB2 LEU 68 2HB LEU 68 -7.132 5.815 -0.049 601 HB3 LEU 68 3HB LEU 68 -5.900 6.836 0.687 602 HG LEU 68 HG LEU 68 -5.616 3.823 0.350 603 HD11 LEU 68 1HD1 LEU 68 -5.749 4.905 -1.836 604 HD12 LEU 68 2HD1 LEU 68 -4.129 4.291 -1.517 605 HD13 LEU 68 3HD1 LEU 68 -4.459 6.020 -1.376 606 HD21 LEU 68 3HD2 LEU 68 -4.257 4.720 2.178 607 HD22 LEU 68 1HD2 LEU 68 -3.580 5.953 1.107 608 HD23 LEU 68 2HD2 LEU 68 -3.234 4.244 0.828 609 H GLU 69 H GLU 69 -9.448 5.984 1.669 610 HA GLU 69 HA GLU 69 -9.490 8.797 2.330 611 HB2 GLU 69 2HB GLU 69 -11.786 6.902 1.672 612 HB3 GLU 69 3HB GLU 69 -11.914 8.660 1.783 613 HG2 GLU 69 2HG GLU 69 -10.274 8.857 -0.102 614 HG3 GLU 69 3HG GLU 69 -10.253 7.098 -0.225 615 H LEU 70 H LEU 70 -10.506 5.783 3.891 616 HA LEU 70 HA LEU 70 -11.529 7.001 6.285 617 HB2 LEU 70 2HB LEU 70 -10.588 4.179 5.669 618 HB3 LEU 70 3HB LEU 70 -11.229 4.636 7.240 619 HG LEU 70 HG LEU 70 -12.833 4.960 4.673 620 HD11 LEU 70 1HD1 LEU 70 -14.015 2.891 5.188 621 HD12 LEU 70 2HD1 LEU 70 -12.935 2.592 6.552 622 HD13 LEU 70 3HD1 LEU 70 -12.302 2.586 4.905 623 HD21 LEU 70 3HD2 LEU 70 -13.572 6.312 6.596 624 HD22 LEU 70 1HD2 LEU 70 -13.730 4.839 7.564 625 HD23 LEU 70 2HD2 LEU 70 -14.759 5.091 6.146 626 H ILE 71 H ILE 71 -8.315 6.034 5.190 627 HA ILE 71 HA ILE 71 -7.000 6.448 7.740 628 HB ILE 71 HB ILE 71 -5.785 6.248 4.942 629 HG12 ILE 71 2HG1 ILE 71 -5.894 4.136 7.145 630 HG13 ILE 71 3HG1 ILE 71 -6.948 4.160 5.742 631 HG21 ILE 71 1HG2 ILE 71 -4.399 6.178 7.649 632 HG22 ILE 71 2HG2 ILE 71 -4.246 7.443 6.429 633 HG23 ILE 71 3HG2 ILE 71 -3.620 5.827 6.105 634 HD11 ILE 71 3HD1 ILE 71 -5.154 2.560 5.465 635 HD12 ILE 71 1HD1 ILE 71 -3.949 3.831 5.674 636 HD13 ILE 71 2HD1 ILE 71 -5.023 3.851 4.272 637 H SER 72 H SER 72 -7.978 8.450 5.064 638 HA SER 72 HA SER 72 -6.206 10.627 5.337 639 HB2 SER 72 2HB SER 72 -7.593 10.319 3.329 640 HB3 SER 72 3HB SER 72 -9.064 10.558 4.270 641 HG SER 72 HG SER 72 -7.007 12.491 4.042 642 H LYS 73 H LYS 73 -9.403 9.964 6.802 643 HA LYS 73 HA LYS 73 -9.415 12.391 8.359 644 HB2 LYS 73 2HB LYS 73 -11.477 11.455 9.412 645 HB3 LYS 73 3HB LYS 73 -11.547 11.510 7.664 646 HG2 LYS 73 2HG LYS 73 -12.557 9.465 8.183 647 HG3 LYS 73 3HG LYS 73 -10.921 9.004 7.719 648 HD2 LYS 73 2HD LYS 73 -11.690 7.748 9.702 649 HD3 LYS 73 3HD LYS 73 -10.293 8.750 10.088 650 HE2 LYS 73 2HE LYS 73 -11.812 10.434 11.117 651 HE3 LYS 73 3HE LYS 73 -13.190 9.395 10.743 652 HZ1 LYS 73 3HZ LYS 73 -12.453 9.143 13.031 653 HZ2 LYS 73 1HZ LYS 73 -10.919 8.657 12.505 654 HZ3 LYS 73 2HZ LYS 73 -12.270 7.698 12.172 655 H LEU 74 H LEU 74 -8.081 9.232 8.787 656 HA LEU 74 HA LEU 74 -7.630 9.416 11.638 657 HB2 LEU 74 2HB LEU 74 -6.504 7.626 9.453 658 HB3 LEU 74 3HB LEU 74 -5.984 7.505 11.125 659 HG LEU 74 HG LEU 74 -8.877 7.108 10.261 660 HD11 LEU 74 1HD1 LEU 74 -6.781 4.973 10.775 661 HD12 LEU 74 2HD1 LEU 74 -7.484 5.383 9.209 662 HD13 LEU 74 3HD1 LEU 74 -8.500 4.693 10.472 663 HD21 LEU 74 3HD2 LEU 74 -7.434 6.473 12.856 664 HD22 LEU 74 1HD2 LEU 74 -9.110 6.058 12.484 665 HD23 LEU 74 2HD2 LEU 74 -8.629 7.747 12.601 666 H GLY 75 H GLY 75 -5.953 10.428 8.724 667 HA2 GLY 75 2HA GLY 75 -4.232 11.869 8.353 668 HA3 GLY 75 3HA GLY 75 -4.328 12.333 10.044 669 H TYR 76 H TYR 76 -3.318 9.440 8.198 670 HA TYR 76 HA TYR 76 -0.879 9.220 9.885 671 HB2 TYR 76 2HB TYR 76 -2.301 7.087 8.240 672 HB3 TYR 76 3HB TYR 76 -0.784 6.827 9.095 673 HD1 TYR 76 HD1 TYR 76 -1.439 8.399 11.646 674 HD2 TYR 76 HD2 TYR 76 -3.697 5.531 9.422 675 HE1 TYR 76 HE1 TYR 76 -2.682 7.800 13.668 676 HE2 TYR 76 HE2 TYR 76 -4.937 4.952 11.447 677 HH TYR 76 HH TYR 76 -4.952 6.823 14.200 678 H LYS 77 H LYS 77 1.077 8.429 8.895 679 HA LYS 77 HA LYS 77 1.666 9.764 6.366 680 HB2 LYS 77 2HB LYS 77 3.135 10.075 8.392 681 HB3 LYS 77 3HB LYS 77 3.544 8.367 8.325 682 HG2 LYS 77 2HG LYS 77 5.324 9.723 7.357 683 HG3 LYS 77 3HG LYS 77 4.598 8.686 6.124 684 HD2 LYS 77 2HD LYS 77 3.295 10.600 5.262 685 HD3 LYS 77 3HD LYS 77 3.953 11.641 6.530 686 HE2 LYS 77 2HE LYS 77 6.196 11.420 5.590 687 HE3 LYS 77 3HE LYS 77 5.611 10.265 4.389 688 HZ1 LYS 77 3HZ LYS 77 4.243 11.990 3.433 689 HZ2 LYS 77 1HZ LYS 77 5.857 12.487 3.472 690 HZ3 LYS 77 2HZ LYS 77 4.757 13.102 4.596 691 H VAL 78 H VAL 78 0.894 8.497 4.763 692 HA VAL 78 HA VAL 78 1.419 5.589 4.751 693 HB VAL 78 HB VAL 78 -0.628 7.198 3.164 694 HG11 VAL 78 1HG1 VAL 78 -0.249 4.189 3.331 695 HG12 VAL 78 2HG1 VAL 78 0.035 5.198 1.912 696 HG13 VAL 78 3HG1 VAL 78 -1.602 5.003 2.539 697 HG21 VAL 78 3HG2 VAL 78 -1.019 5.378 5.565 698 HG22 VAL 78 1HG2 VAL 78 -2.310 6.155 4.643 699 HG23 VAL 78 2HG2 VAL 78 -1.167 7.138 5.562 700 H PHE 79 H PHE 79 2.855 4.773 3.364 701 HA PHE 79 HA PHE 79 3.707 6.288 0.966 702 HB2 PHE 79 2HB PHE 79 4.957 3.893 2.402 703 HB3 PHE 79 3HB PHE 79 5.578 4.591 0.912 704 HD1 PHE 79 HD2 PHE 79 5.176 5.130 4.558 705 HD2 PHE 79 HD1 PHE 79 6.823 6.676 0.922 706 HE1 PHE 79 HE2 PHE 79 6.553 6.706 5.839 707 HE2 PHE 79 HE1 PHE 79 8.196 8.245 2.214 708 HZ PHE 79 HZ PHE 79 8.062 8.265 4.668 709 H LEU 80 H LEU 80 2.590 5.670 -0.812 710 HA LEU 80 HA LEU 80 1.220 3.068 -0.849 711 HB2 LEU 80 2HB LEU 80 -0.277 4.961 -0.961 712 HB3 LEU 80 3HB LEU 80 0.628 5.667 -2.291 713 HG LEU 80 HG LEU 80 -0.090 3.836 -3.796 714 HD11 LEU 80 1HD1 LEU 80 -1.684 2.748 -1.464 715 HD12 LEU 80 2HD1 LEU 80 -0.256 2.005 -2.189 716 HD13 LEU 80 3HD1 LEU 80 -1.733 2.166 -3.132 717 HD21 LEU 80 3HD2 LEU 80 -2.473 4.384 -3.957 718 HD22 LEU 80 1HD2 LEU 80 -1.482 5.816 -3.694 719 HD23 LEU 80 2HD2 LEU 80 -2.412 5.134 -2.359 720 H LEU 81 H LEU 81 1.630 1.599 -2.353 721 HA LEU 81 HA LEU 81 3.151 2.276 -4.784 722 HB2 LEU 81 2HB LEU 81 4.343 0.698 -3.230 723 HB3 LEU 81 3HB LEU 81 2.995 -0.415 -3.358 724 HG LEU 81 HG LEU 81 3.429 -0.688 -5.789 725 HD11 LEU 81 1HD1 LEU 81 5.753 1.195 -5.327 726 HD12 LEU 81 2HD1 LEU 81 4.331 1.479 -6.335 727 HD13 LEU 81 3HD1 LEU 81 5.496 0.240 -6.789 728 HD21 LEU 81 3HD2 LEU 81 5.903 -1.201 -4.112 729 HD22 LEU 81 1HD2 LEU 81 5.498 -1.978 -5.647 730 HD23 LEU 81 2HD2 LEU 81 4.489 -2.252 -4.228 731 H LEU 82 H LEU 82 1.722 2.404 -6.416 732 HA LEU 82 HA LEU 82 -0.645 0.674 -6.516 733 HB2 LEU 82 2HB LEU 82 0.148 3.171 -8.050 734 HB3 LEU 82 3HB LEU 82 -1.229 2.185 -8.511 735 HG LEU 82 HG LEU 82 -0.904 3.732 -5.917 736 HD11 LEU 82 1HD1 LEU 82 -1.495 5.127 -7.847 737 HD12 LEU 82 2HD1 LEU 82 -2.825 5.027 -6.697 738 HD13 LEU 82 3HD1 LEU 82 -2.881 4.087 -8.192 739 HD21 LEU 82 3HD2 LEU 82 -3.140 2.933 -5.323 740 HD22 LEU 82 1HD2 LEU 82 -2.009 1.593 -5.465 741 HD23 LEU 82 2HD2 LEU 82 -3.176 1.902 -6.756 742 H GLN 83 H GLN 83 -0.484 -1.164 -7.570 743 HA GLN 83 HA GLN 83 1.082 -1.354 -10.063 744 HB2 GLN 83 2HB GLN 83 1.823 -2.917 -8.240 745 HB3 GLN 83 3HB GLN 83 0.213 -3.626 -8.218 746 HG2 GLN 83 2HG GLN 83 0.499 -4.437 -10.509 747 HG3 GLN 83 3HG GLN 83 2.063 -3.633 -10.627 748 HE21 GLN 83 1HE2 GLN 83 1.310 -6.459 -10.924 749 HE22 GLN 83 2HE2 GLN 83 2.340 -7.322 -9.844 750 H ASP 84 H ASP 84 0.035 -1.945 -11.864 751 HA ASP 84 HA ASP 84 -2.806 -2.727 -11.845 752 HB2 ASP 84 2HB ASP 84 -2.258 -0.090 -12.059 753 HB3 ASP 84 3HB ASP 84 -1.936 -0.505 -13.728 754 H GLN 85 H GLN 85 -3.406 -3.071 -14.292 755 HA GLN 85 HA GLN 85 -1.287 -4.602 -15.638 756 HB2 GLN 85 2HB GLN 85 -4.283 -4.418 -16.183 757 HB3 GLN 85 3HB GLN 85 -3.164 -5.525 -16.981 758 HG2 GLN 85 2HG GLN 85 -2.753 -6.693 -14.877 759 HG3 GLN 85 3HG GLN 85 -3.730 -5.519 -13.996 760 HE21 GLN 85 1HE2 GLN 85 -5.093 -7.138 -13.212 761 HE22 GLN 85 2HE2 GLN 85 -6.268 -7.923 -14.208 762 H ASP 86 H ASP 86 -3.461 -1.856 -16.053 763 HA ASP 86 HA ASP 86 -2.177 -1.093 -18.625 764 HB2 ASP 86 2HB ASP 86 -4.564 -1.387 -18.903 765 HB3 ASP 86 3HB ASP 86 -4.910 -0.469 -17.442 766 H GLU 87 H GLU 87 -1.111 0.819 -18.803 767 HA GLU 87 HA GLU 87 -0.274 2.244 -16.463 768 HB2 GLU 87 2HB GLU 87 0.267 2.690 -19.427 769 HB3 GLU 87 3HB GLU 87 0.866 3.794 -18.193 770 HG2 GLU 87 2HG GLU 87 1.550 0.856 -18.351 771 HG3 GLU 87 3HG GLU 87 2.554 2.164 -18.970 772 H ASN 88 H ASN 88 -2.598 2.845 -19.043 773 HA ASN 88 HA ASN 88 -2.805 5.648 -18.842 774 HB2 ASN 88 2HB ASN 88 -4.763 3.552 -19.856 775 HB3 ASN 88 3HB ASN 88 -5.123 5.271 -19.919 776 HD21 ASN 88 1HD2 ASN 88 -5.265 5.118 -22.183 777 HD22 ASN 88 2HD2 ASN 88 -3.857 5.016 -23.181 778 H GLU 89 H GLU 89 -4.820 3.086 -17.361 779 HA GLU 89 HA GLU 89 -6.414 4.979 -15.863 780 HB2 GLU 89 2HB GLU 89 -7.565 3.037 -14.946 781 HB3 GLU 89 3HB GLU 89 -7.409 2.882 -16.692 782 HG2 GLU 89 2HG GLU 89 -5.572 1.289 -16.421 783 HG3 GLU 89 3HG GLU 89 -5.633 1.478 -14.667 784 H LEU 90 H LEU 90 -3.651 2.850 -15.204 785 HA LEU 90 HA LEU 90 -3.447 3.017 -12.428 786 HB2 LEU 90 2HB LEU 90 -2.014 1.578 -13.795 787 HB3 LEU 90 3HB LEU 90 -1.268 2.968 -14.551 788 HG LEU 90 HG LEU 90 -0.087 3.544 -12.487 789 HD11 LEU 90 1HD1 LEU 90 -1.741 2.945 -10.822 790 HD12 LEU 90 2HD1 LEU 90 -0.198 2.175 -10.462 791 HD13 LEU 90 3HD1 LEU 90 -1.509 1.227 -11.165 792 HD21 LEU 90 3HD2 LEU 90 0.210 0.583 -13.094 793 HD22 LEU 90 1HD2 LEU 90 1.403 1.608 -12.285 794 HD23 LEU 90 2HD2 LEU 90 0.985 1.908 -13.970 795 H GLU 91 H GLU 91 -2.181 5.200 -14.918 796 HA GLU 91 HA GLU 91 -0.933 7.085 -13.205 797 HB2 GLU 91 2HB GLU 91 -0.288 6.762 -15.564 798 HB3 GLU 91 3HB GLU 91 -1.875 7.294 -16.098 799 HG2 GLU 91 2HG GLU 91 -0.228 9.060 -16.421 800 HG3 GLU 91 3HG GLU 91 -1.430 9.553 -15.221 801 H GLU 92 H GLU 92 -3.944 7.136 -15.059 802 HA GLU 92 HA GLU 92 -5.094 9.543 -14.511 803 HB2 GLU 92 2HB GLU 92 -5.779 7.430 -15.951 804 HB3 GLU 92 3HB GLU 92 -6.723 6.969 -14.552 805 HG2 GLU 92 2HG GLU 92 -7.053 9.616 -15.980 806 HG3 GLU 92 3HG GLU 92 -7.920 8.163 -16.452 807 H PHE 93 H PHE 93 -5.274 6.611 -12.603 808 HA PHE 93 HA PHE 93 -6.962 7.598 -10.493 809 HB2 PHE 93 2HB PHE 93 -7.003 5.264 -11.312 810 HB3 PHE 93 3HB PHE 93 -5.339 5.041 -10.794 811 HD1 PHE 93 HD1 PHE 93 -8.390 6.460 -9.088 812 HD2 PHE 93 HD2 PHE 93 -5.294 3.497 -9.044 813 HE1 PHE 93 HE1 PHE 93 -9.247 5.584 -6.959 814 HE2 PHE 93 HE2 PHE 93 -6.157 2.637 -6.914 815 HZ PHE 93 HZ PHE 93 -8.131 3.675 -5.872 816 H LYS 94 H LYS 94 -3.483 7.106 -10.944 817 HA LYS 94 HA LYS 94 -2.620 7.192 -8.257 818 HB2 LYS 94 2HB LYS 94 -1.324 6.309 -10.224 819 HB3 LYS 94 3HB LYS 94 -1.054 7.955 -10.765 820 HG2 LYS 94 2HG LYS 94 -0.150 7.110 -8.019 821 HG3 LYS 94 3HG LYS 94 0.797 6.631 -9.417 822 HD2 LYS 94 2HD LYS 94 0.135 9.510 -8.657 823 HD3 LYS 94 3HD LYS 94 1.662 8.693 -8.309 824 HE2 LYS 94 2HE LYS 94 2.043 8.401 -10.739 825 HE3 LYS 94 3HE LYS 94 0.528 9.241 -11.075 826 HZ1 LYS 94 3HZ LYS 94 2.872 10.411 -9.685 827 HZ2 LYS 94 1HZ LYS 94 1.440 11.220 -10.058 828 HZ3 LYS 94 2HZ LYS 94 2.455 10.682 -11.298 829 H ARG 95 H ARG 95 -3.083 9.692 -10.689 830 HA ARG 95 HA ARG 95 -1.836 11.891 -9.448 831 HB2 ARG 95 2HB ARG 95 -4.224 11.889 -11.347 832 HB3 ARG 95 3HB ARG 95 -3.179 13.273 -11.019 833 HG2 ARG 95 2HG ARG 95 -1.287 12.157 -12.075 834 HG3 ARG 95 3HG ARG 95 -2.223 10.677 -12.272 835 HD2 ARG 95 2HD ARG 95 -2.151 11.796 -14.401 836 HD3 ARG 95 3HD ARG 95 -3.796 11.942 -13.768 837 HE ARG 95 HE ARG 95 -1.998 14.158 -13.202 838 HH11 ARG 95 1HH1 ARG 95 -4.498 12.952 -15.367 839 HH12 ARG 95 2HH1 ARG 95 -4.890 14.528 -15.973 840 HH21 ARG 95 1HH2 ARG 95 -2.525 16.188 -13.978 841 HH22 ARG 95 2HH2 ARG 95 -3.763 16.372 -15.180 842 H LYS 96 H LYS 96 -5.045 10.526 -9.084 843 HA LYS 96 HA LYS 96 -6.355 12.626 -7.704 844 HB2 LYS 96 2HB LYS 96 -6.897 9.625 -7.581 845 HB3 LYS 96 3HB LYS 96 -8.035 10.901 -7.134 846 HG2 LYS 96 2HG LYS 96 -8.187 11.655 -9.425 847 HG3 LYS 96 3HG LYS 96 -6.890 10.559 -9.923 848 HD2 LYS 96 2HD LYS 96 -8.347 8.611 -9.344 849 HD3 LYS 96 3HD LYS 96 -9.648 9.730 -8.909 850 HE2 LYS 96 2HE LYS 96 -9.753 10.554 -11.200 851 HE3 LYS 96 3HE LYS 96 -8.360 9.575 -11.652 852 HZ1 LYS 96 3HZ LYS 96 -10.308 8.505 -12.400 853 HZ2 LYS 96 1HZ LYS 96 -11.043 8.602 -10.880 854 HZ3 LYS 96 2HZ LYS 96 -9.704 7.601 -11.106 855 H ILE 97 H ILE 97 -4.643 9.729 -6.613 856 HA ILE 97 HA ILE 97 -5.176 10.116 -3.808 857 HB ILE 97 HB ILE 97 -3.211 8.193 -5.131 858 HG12 ILE 97 2HG1 ILE 97 -6.117 7.655 -4.333 859 HG13 ILE 97 3HG1 ILE 97 -5.590 7.968 -5.983 860 HG21 ILE 97 1HG2 ILE 97 -4.492 8.161 -2.370 861 HG22 ILE 97 2HG2 ILE 97 -2.788 8.449 -2.732 862 HG23 ILE 97 3HG2 ILE 97 -3.499 6.866 -3.037 863 HD11 ILE 97 3HD1 ILE 97 -4.225 5.947 -5.934 864 HD12 ILE 97 1HD1 ILE 97 -5.920 5.611 -5.597 865 HD13 ILE 97 2HD1 ILE 97 -4.750 5.625 -4.278 866 H GLU 98 H GLU 98 -2.548 10.814 -6.017 867 HA GLU 98 HA GLU 98 -0.507 11.473 -4.166 868 HB2 GLU 98 2HB GLU 98 -0.177 11.041 -6.631 869 HB3 GLU 98 3HB GLU 98 -0.938 12.594 -6.969 870 HG2 GLU 98 2HG GLU 98 0.909 13.648 -5.530 871 HG3 GLU 98 3HG GLU 98 1.709 12.076 -5.584 872 H SER 99 H SER 99 -3.226 13.250 -5.538 873 HA SER 99 HA SER 99 -2.460 15.874 -4.670 874 HB2 SER 99 2HB SER 99 -3.959 15.526 -6.598 875 HB3 SER 99 3HB SER 99 -5.164 14.778 -5.553 876 HG SER 99 HG SER 99 -4.570 17.440 -5.957 877 H GLN 100 H GLN 100 -4.033 13.168 -3.138 878 HA GLN 100 HA GLN 100 -5.241 14.590 -0.935 879 HB2 GLN 100 2HB GLN 100 -4.457 11.643 -1.113 880 HB3 GLN 100 3HB GLN 100 -5.572 12.359 0.051 881 HG2 GLN 100 2HG GLN 100 -7.167 12.848 -1.727 882 HG3 GLN 100 3HG GLN 100 -6.034 12.270 -2.945 883 HE21 GLN 100 1HE2 GLN 100 -5.199 9.933 -1.324 884 HE22 GLN 100 2HE2 GLN 100 -6.514 8.821 -1.419 885 H GLY 101 H GLY 101 -2.022 13.984 -1.738 886 HA2 GLY 101 2HA GLY 101 -0.141 14.732 -0.614 887 HA3 GLY 101 3HA GLY 101 -1.073 14.873 0.870 888 H TYR 102 H TYR 102 -0.523 12.139 -1.322 889 HA TYR 102 HA TYR 102 0.791 10.616 0.873 890 HB2 TYR 102 2HB TYR 102 -1.037 9.583 -1.347 891 HB3 TYR 102 3HB TYR 102 -0.098 8.535 -0.288 892 HD1 TYR 102 HD1 TYR 102 -0.445 9.268 2.363 893 HD2 TYR 102 HD2 TYR 102 -3.326 9.714 -0.761 894 HE1 TYR 102 HE1 TYR 102 -2.250 9.239 4.024 895 HE2 TYR 102 HE2 TYR 102 -5.133 9.687 0.905 896 HH TYR 102 HH TYR 102 -5.501 8.837 3.219 897 H GLU 103 H GLU 103 2.716 9.615 0.391 898 HA GLU 103 HA GLU 103 4.150 10.251 -2.023 899 HB2 GLU 103 2HB GLU 103 5.375 10.023 0.099 900 HB3 GLU 103 3HB GLU 103 4.780 8.388 0.319 901 HG2 GLU 103 2HG GLU 103 7.064 8.210 -0.344 902 HG3 GLU 103 3HG GLU 103 6.101 7.699 -1.726 903 H VAL 104 H VAL 104 3.007 9.368 -3.759 904 HA VAL 104 HA VAL 104 2.342 6.482 -3.706 905 HB VAL 104 HB VAL 104 1.194 8.568 -5.622 906 HG11 VAL 104 1HG1 VAL 104 -0.520 6.838 -6.064 907 HG12 VAL 104 2HG1 VAL 104 0.288 5.748 -4.934 908 HG13 VAL 104 3HG1 VAL 104 1.102 6.237 -6.420 909 HG21 VAL 104 3HG2 VAL 104 -0.091 7.526 -3.070 910 HG22 VAL 104 1HG2 VAL 104 -0.862 8.576 -4.263 911 HG23 VAL 104 2HG2 VAL 104 0.512 9.164 -3.324 912 H ARG 105 H ARG 105 3.586 5.224 -4.932 913 HA ARG 105 HA ARG 105 4.961 6.308 -7.330 914 HB2 ARG 105 2HB ARG 105 5.824 4.025 -5.493 915 HB3 ARG 105 3HB ARG 105 6.672 4.526 -6.954 916 HG2 ARG 105 2HG ARG 105 6.275 6.266 -4.490 917 HG3 ARG 105 3HG ARG 105 7.734 5.343 -4.853 918 HD2 ARG 105 2HD ARG 105 8.186 6.702 -6.810 919 HD3 ARG 105 3HD ARG 105 6.627 7.520 -6.663 920 HE ARG 105 HE ARG 105 7.435 8.783 -4.908 921 HH11 ARG 105 1HH1 ARG 105 9.931 6.492 -5.859 922 HH12 ARG 105 2HH1 ARG 105 11.174 7.308 -4.969 923 HH21 ARG 105 1HH2 ARG 105 9.063 9.814 -3.739 924 HH22 ARG 105 2HH2 ARG 105 10.684 9.188 -3.768 925 H LYS 106 H LYS 106 4.938 5.005 -9.167 926 HA LYS 106 HA LYS 106 2.740 3.050 -9.374 927 HB2 LYS 106 2HB LYS 106 4.392 4.428 -11.533 928 HB3 LYS 106 3HB LYS 106 3.017 3.366 -11.828 929 HG2 LYS 106 2HG LYS 106 1.498 4.976 -10.804 930 HG3 LYS 106 3HG LYS 106 2.852 6.013 -10.340 931 HD2 LYS 106 2HD LYS 106 1.743 6.897 -12.356 932 HD3 LYS 106 3HD LYS 106 3.392 6.394 -12.727 933 HE2 LYS 106 2HE LYS 106 2.434 4.228 -13.619 934 HE3 LYS 106 3HE LYS 106 0.826 4.923 -13.394 935 HZ1 LYS 106 3HZ LYS 106 1.670 5.154 -15.662 936 HZ2 LYS 106 1HZ LYS 106 2.955 6.091 -15.090 937 HZ3 LYS 106 2HZ LYS 106 1.373 6.660 -14.940 938 H VAL 107 H VAL 107 3.068 1.048 -10.474 939 HA VAL 107 HA VAL 107 5.667 0.180 -11.353 940 HB VAL 107 HB VAL 107 5.910 -0.296 -8.937 941 HG11 VAL 107 1HG1 VAL 107 4.492 -1.933 -7.768 942 HG12 VAL 107 2HG1 VAL 107 3.452 -2.062 -9.189 943 HG13 VAL 107 3HG1 VAL 107 3.550 -0.538 -8.304 944 HG21 VAL 107 3HG2 VAL 107 6.475 -2.695 -9.084 945 HG22 VAL 107 1HG2 VAL 107 7.002 -1.815 -10.510 946 HG23 VAL 107 2HG2 VAL 107 5.562 -2.829 -10.582 947 H THR 108 H THR 108 5.503 -1.419 -12.855 948 HA THR 108 HA THR 108 3.174 -3.223 -12.840 949 HB THR 108 HB THR 108 3.319 -3.228 -15.444 950 HG1 THR 108 HG1 THR 108 4.120 -0.570 -15.372 951 HG21 THR 108 3HG2 THR 108 1.369 -2.300 -14.261 952 HG22 THR 108 1HG2 THR 108 1.763 -1.325 -15.680 953 HG23 THR 108 2HG2 THR 108 2.201 -0.757 -14.068 954 H ASP 109 H ASP 109 6.556 -2.802 -12.951 955 HA ASP 109 HA ASP 109 7.108 -5.401 -14.182 956 HB2 ASP 109 2HB ASP 109 8.931 -3.172 -13.204 957 HB3 ASP 109 3HB ASP 109 9.533 -4.699 -13.851 958 H ASP 110 H ASP 110 8.098 -7.088 -13.221 959 HA ASP 110 HA ASP 110 7.246 -7.847 -10.706 960 HB2 ASP 110 2HB ASP 110 7.705 -9.410 -12.525 961 HB3 ASP 110 3HB ASP 110 9.408 -8.982 -12.523 962 H GLU 111 H GLU 111 10.634 -7.241 -11.695 963 HA GLU 111 HA GLU 111 11.796 -7.442 -9.118 964 HB2 GLU 111 2HB GLU 111 13.803 -6.389 -10.175 965 HB3 GLU 111 3HB GLU 111 13.166 -7.741 -11.103 966 HG2 GLU 111 2HG GLU 111 12.144 -6.235 -12.719 967 HG3 GLU 111 3HG GLU 111 12.586 -4.829 -11.753 968 H GLU 112 H GLU 112 10.452 -4.776 -10.924 969 HA GLU 112 HA GLU 112 11.574 -2.576 -9.583 970 HB2 GLU 112 2HB GLU 112 10.602 -2.439 -11.805 971 HB3 GLU 112 3HB GLU 112 9.022 -2.908 -11.193 972 HG2 GLU 112 2HG GLU 112 8.870 -0.773 -9.953 973 HG3 GLU 112 3HG GLU 112 10.458 -0.302 -10.574 974 H ALA 113 H ALA 113 8.525 -4.360 -9.115 975 HA ALA 113 HA ALA 113 7.245 -2.783 -7.218 976 HB1 ALA 113 3HB ALA 113 6.001 -4.809 -6.591 977 HB2 ALA 113 1HB ALA 113 7.208 -5.815 -7.407 978 HB3 ALA 113 2HB ALA 113 6.198 -4.712 -8.342 979 H LEU 114 H LEU 114 9.609 -5.367 -6.734 980 HA LEU 114 HA LEU 114 9.681 -5.407 -3.913 981 HB2 LEU 114 2HB LEU 114 12.043 -6.009 -5.740 982 HB3 LEU 114 3HB LEU 114 11.728 -6.672 -4.139 983 HG LEU 114 HG LEU 114 10.184 -7.299 -6.690 984 HD11 LEU 114 1HD1 LEU 114 11.131 -9.547 -6.482 985 HD12 LEU 114 2HD1 LEU 114 12.060 -9.040 -5.068 986 HD13 LEU 114 3HD1 LEU 114 12.390 -8.326 -6.650 987 HD21 LEU 114 3HD2 LEU 114 8.661 -7.334 -4.773 988 HD22 LEU 114 1HD2 LEU 114 9.744 -8.424 -3.901 989 HD23 LEU 114 2HD2 LEU 114 8.943 -8.961 -5.379 990 H LYS 115 H LYS 115 11.580 -3.648 -6.336 991 HA LYS 115 HA LYS 115 13.523 -2.483 -4.675 992 HB2 LYS 115 2HB LYS 115 12.458 -1.604 -7.383 993 HB3 LYS 115 3HB LYS 115 13.868 -0.883 -6.607 994 HG2 LYS 115 2HG LYS 115 15.050 -3.025 -6.698 995 HG3 LYS 115 3HG LYS 115 13.629 -3.800 -7.415 996 HD2 LYS 115 2HD LYS 115 13.809 -2.332 -9.395 997 HD3 LYS 115 3HD LYS 115 15.191 -1.502 -8.673 998 HE2 LYS 115 2HE LYS 115 16.467 -3.625 -8.738 999 HE3 LYS 115 3HE LYS 115 15.087 -4.418 -9.508 1000 HZ1 LYS 115 3HZ LYS 115 16.694 -3.754 -11.147 1001 HZ2 LYS 115 1HZ LYS 115 16.643 -2.148 -10.621 1002 HZ3 LYS 115 2HZ LYS 115 15.287 -2.850 -11.345 1003 H ILE 116 H ILE 116 10.360 -1.198 -5.770 1004 HA ILE 116 HA ILE 116 10.717 1.448 -4.798 1005 HB ILE 116 HB ILE 116 7.987 0.106 -5.026 1006 HG12 ILE 116 2HG1 ILE 116 9.159 -0.343 -7.164 1007 HG13 ILE 116 3HG1 ILE 116 7.833 0.777 -7.392 1008 HG21 ILE 116 1HG2 ILE 116 8.860 2.996 -5.390 1009 HG22 ILE 116 2HG2 ILE 116 8.028 2.327 -3.985 1010 HG23 ILE 116 3HG2 ILE 116 7.209 2.388 -5.545 1011 HD11 ILE 116 3HD1 ILE 116 9.779 1.345 -8.726 1012 HD12 ILE 116 1HD1 ILE 116 10.756 1.517 -7.270 1013 HD13 ILE 116 2HD1 ILE 116 9.408 2.620 -7.568 1014 H VAL 117 H VAL 117 9.318 -1.487 -3.420 1015 HA VAL 117 HA VAL 117 8.343 -0.419 -0.979 1016 HB VAL 117 HB VAL 117 9.201 -3.278 -1.628 1017 HG11 VAL 117 1HG1 VAL 117 7.735 -3.963 0.249 1018 HG12 VAL 117 2HG1 VAL 117 7.442 -2.266 0.642 1019 HG13 VAL 117 3HG1 VAL 117 9.064 -2.943 0.807 1020 HG21 VAL 117 3HG2 VAL 117 6.438 -2.016 -1.730 1021 HG22 VAL 117 1HG2 VAL 117 6.830 -3.701 -2.095 1022 HG23 VAL 117 2HG2 VAL 117 7.435 -2.407 -3.131 1023 H ARG 118 H ARG 118 11.479 -1.760 -1.949 1024 HA ARG 118 HA ARG 118 12.754 -1.873 0.559 1025 HB2 ARG 118 2HB ARG 118 13.924 -1.365 -2.204 1026 HB3 ARG 118 3HB ARG 118 14.897 -1.697 -0.771 1027 HG2 ARG 118 2HG ARG 118 14.028 -3.933 -0.589 1028 HG3 ARG 118 3HG ARG 118 12.796 -3.620 -1.811 1029 HD2 ARG 118 2HD ARG 118 14.641 -3.271 -3.486 1030 HD3 ARG 118 3HD ARG 118 15.795 -3.784 -2.249 1031 HE ARG 118 HE ARG 118 13.990 -5.830 -2.348 1032 HH11 ARG 118 1HH1 ARG 118 15.977 -4.270 -4.797 1033 HH12 ARG 118 2HH1 ARG 118 16.116 -5.695 -5.768 1034 HH21 ARG 118 1HH2 ARG 118 14.187 -7.700 -3.648 1035 HH22 ARG 118 2HH2 ARG 118 15.101 -7.634 -5.118 1036 H GLU 119 H GLU 119 12.349 0.796 -1.744 1037 HA GLU 119 HA GLU 119 13.805 2.774 -0.315 1038 HB2 GLU 119 2HB GLU 119 11.530 3.032 -2.311 1039 HB3 GLU 119 3HB GLU 119 12.354 4.425 -1.611 1040 HG2 GLU 119 2HG GLU 119 14.522 3.401 -2.554 1041 HG3 GLU 119 3HG GLU 119 13.468 2.338 -3.500 1042 H PHE 120 H PHE 120 10.343 1.889 -0.334 1043 HA PHE 120 HA PHE 120 9.381 3.881 1.399 1044 HB2 PHE 120 2HB PHE 120 8.320 1.109 0.746 1045 HB3 PHE 120 3HB PHE 120 7.449 2.220 1.804 1046 HD1 PHE 120 HD2 PHE 120 8.413 4.728 -0.007 1047 HD2 PHE 120 HD1 PHE 120 6.368 1.035 -0.756 1048 HE1 PHE 120 HE2 PHE 120 7.257 5.750 -1.915 1049 HE2 PHE 120 HE1 PHE 120 5.223 2.081 -2.652 1050 HZ PHE 120 HZ PHE 120 5.654 4.422 -3.231 1051 H MET 121 H MET 121 10.559 0.622 2.126 1052 HA MET 121 HA MET 121 10.089 0.639 4.889 1053 HB2 MET 121 2HB MET 121 12.064 -0.953 3.201 1054 HB3 MET 121 3HB MET 121 11.801 -1.247 4.917 1055 HG2 MET 121 2HG MET 121 9.383 -1.689 4.406 1056 HG3 MET 121 3HG MET 121 9.771 -1.572 2.690 1057 HE1 MET 121 3HE MET 121 11.047 -3.437 1.322 1058 HE2 MET 121 1HE MET 121 11.922 -4.772 2.071 1059 HE3 MET 121 2HE MET 121 12.501 -3.119 2.271 1060 H GLN 122 H GLN 122 12.879 1.662 2.962 1061 HA GLN 122 HA GLN 122 14.648 2.294 5.071 1062 HB2 GLN 122 2HB GLN 122 15.327 1.963 2.698 1063 HB3 GLN 122 3HB GLN 122 14.516 3.462 2.258 1064 HG2 GLN 122 2HG GLN 122 16.099 4.726 3.682 1065 HG3 GLN 122 3HG GLN 122 16.906 3.221 4.118 1066 HE21 GLN 122 1HE2 GLN 122 17.882 5.656 2.708 1067 HE22 GLN 122 2HE2 GLN 122 18.584 5.075 1.239 1068 H LYS 123 H LYS 123 12.139 4.183 3.448 1069 HA LYS 123 HA LYS 123 12.844 6.738 4.584 1070 HB2 LYS 123 2HB LYS 123 10.374 5.790 3.069 1071 HB3 LYS 123 3HB LYS 123 10.628 7.463 3.563 1072 HG2 LYS 123 2HG LYS 123 12.608 7.625 2.135 1073 HG3 LYS 123 3HG LYS 123 12.470 5.918 1.700 1074 HD2 LYS 123 2HD LYS 123 10.389 6.320 0.517 1075 HD3 LYS 123 3HD LYS 123 10.318 7.987 1.094 1076 HE2 LYS 123 2HE LYS 123 11.050 7.891 -1.255 1077 HE3 LYS 123 3HE LYS 123 12.322 8.539 -0.223 1078 HZ1 LYS 123 3HZ LYS 123 12.176 5.777 -1.296 1079 HZ2 LYS 123 1HZ LYS 123 13.373 6.343 -0.248 1080 HZ3 LYS 123 2HZ LYS 123 13.230 6.993 -1.802 1081 H ALA 124 H ALA 124 10.295 4.341 5.164 1082 HA ALA 124 HA ALA 124 8.728 5.665 7.055 1083 HB1 ALA 124 3HB ALA 124 8.008 3.662 5.825 1084 HB2 ALA 124 1HB ALA 124 7.813 3.434 7.567 1085 HB3 ALA 124 2HB ALA 124 9.167 2.681 6.720 1086 H GLY 125 H GLY 125 11.522 3.534 7.496 1087 HA2 GLY 125 2HA GLY 125 11.411 3.112 10.269 1088 HA3 GLY 125 3HA GLY 125 12.851 2.988 9.284 1089 H SER 126 H SER 126 12.510 5.890 8.499 1090 HA SER 126 HA SER 126 14.193 7.018 10.556 1091 HB2 SER 126 2HB SER 126 12.946 8.364 8.118 1092 HB3 SER 126 3HB SER 126 14.337 8.940 9.051 1093 HG SER 126 HG SER 126 14.519 6.362 8.018 1094 H LEU 127 H LEU 127 10.817 7.277 9.582 1095 HA LEU 127 HA LEU 127 10.275 9.817 10.829 1096 HB2 LEU 127 2HB LEU 127 8.347 7.741 9.742 1097 HB3 LEU 127 3HB LEU 127 7.964 9.423 10.094 1098 HG LEU 127 HG LEU 127 9.954 8.519 7.968 1099 HD11 LEU 127 1HD1 LEU 127 7.101 9.460 7.631 1100 HD12 LEU 127 2HD1 LEU 127 7.705 7.821 7.372 1101 HD13 LEU 127 3HD1 LEU 127 8.249 9.131 6.328 1102 HD21 LEU 127 3HD2 LEU 127 8.802 11.274 8.537 1103 HD22 LEU 127 1HD2 LEU 127 9.858 10.851 7.185 1104 HD23 LEU 127 2HD2 LEU 127 10.463 10.756 8.835 1105 H GLU 128 H GLU 128 10.144 6.507 11.852 1106 HA GLU 128 HA GLU 128 8.429 6.613 14.075 1107 HB2 GLU 128 2HB GLU 128 10.990 4.995 13.770 1108 HB3 GLU 128 3HB GLU 128 9.703 4.683 14.938 1109 HG2 GLU 128 2HG GLU 128 8.145 4.195 13.097 1110 HG3 GLU 128 3HG GLU 128 9.429 4.506 11.922 1111 H HIS 129 H HIS 129 11.614 7.899 13.607 1112 HA HIS 129 HA HIS 129 12.200 8.209 16.444 1113 HB2 HIS 129 2HB HIS 129 13.759 9.039 13.953 1114 HB3 HIS 129 3HB HIS 129 14.344 9.202 15.609 1115 HD1 HIS 129 HD1 HIS 129 15.763 7.309 16.369 1116 HD2 HIS 129 HD2 HIS 129 13.114 6.110 13.403 1117 HE1 HIS 129 HE1 HIS 129 16.281 4.895 15.931 1118 HE2 HIS 129 HE2 HIS 129 14.805 4.263 13.991 1119 H HIS 130 H HIS 130 9.996 9.699 14.744 1120 HA HIS 130 HA HIS 130 10.419 12.332 16.039 1121 HB2 HIS 130 2HB HIS 130 8.507 11.530 13.792 1122 HB3 HIS 130 3HB HIS 130 8.545 13.116 14.555 1123 HD1 HIS 130 HD1 HIS 130 10.043 14.805 13.501 1124 HD2 HIS 130 HD2 HIS 130 11.032 10.930 12.362 1125 HE1 HIS 130 HE1 HIS 130 11.812 15.042 11.734 1126 HE2 HIS 130 HE2 HIS 130 12.512 12.691 11.198 1127 H HIS 131 H HIS 131 9.931 11.512 18.079 1128 HA HIS 131 HA HIS 131 7.350 10.252 18.643 1129 HB2 HIS 131 2HB HIS 131 9.717 10.973 20.425 1130 HB3 HIS 131 3HB HIS 131 8.229 10.258 21.041 1131 HD1 HIS 131 HD1 HIS 131 8.399 7.804 21.330 1132 HD2 HIS 131 HD2 HIS 131 10.835 9.132 18.242 1133 HE1 HIS 131 HE1 HIS 131 9.605 5.767 20.488 1134 HE2 HIS 131 HE2 HIS 131 11.111 6.610 18.663 1135 H HIS 132 H HIS 132 8.843 13.386 18.773 1136 HA HIS 132 HA HIS 132 6.636 14.639 20.255 1137 HB2 HIS 132 2HB HIS 132 9.163 15.829 19.022 1138 HB3 HIS 132 3HB HIS 132 7.980 16.741 19.951 1139 HD1 HIS 132 HD1 HIS 132 11.041 14.813 20.298 1140 HD2 HIS 132 HD2 HIS 132 7.870 15.897 22.761 1141 HE1 HIS 132 HE1 HIS 132 11.857 14.466 22.647 1142 HE2 HIS 132 HE2 HIS 132 9.893 15.053 24.112 1143 H HIS 133 H HIS 133 6.242 13.344 17.596 1144 HA HIS 133 HA HIS 133 5.898 15.195 15.507 1145 HB2 HIS 133 2HB HIS 133 5.977 12.784 15.128 1146 HB3 HIS 133 3HB HIS 133 4.522 12.544 16.084 1147 HD1 HIS 133 HD1 HIS 133 5.308 14.738 13.049 1148 HD2 HIS 133 HD2 HIS 133 2.510 11.969 14.367 1149 HE1 HIS 133 HE1 HIS 133 3.632 14.536 11.198 1150 HE2 HIS 133 HE2 HIS 133 2.055 12.730 11.954 1151 H HIS 134 H HIS 134 3.859 14.423 18.261 1152 HA HIS 134 HA HIS 134 2.888 17.123 18.080 1153 HB2 HIS 134 2HB HIS 134 0.548 16.821 18.121 1154 HB3 HIS 134 3HB HIS 134 1.061 15.648 16.926 1155 HD1 HIS 134 HD1 HIS 134 0.570 13.182 17.425 1156 HD2 HIS 134 HD2 HIS 134 -0.489 15.713 20.533 1157 HE1 HIS 134 HE1 HIS 134 -0.780 11.791 19.006 1158 HE2 HIS 134 HE2 HIS 134 -1.235 13.291 20.959 Start of MODEL 3 1 H1 MET 1 1H MET 1 3.971 6.705 13.297 2 H2 MET 1 2H MET 1 4.826 5.679 14.323 3 H3 MET 1 3H MET 1 4.660 7.308 14.718 4 HA MET 1 HA MET 1 3.156 5.904 16.042 5 HB2 MET 1 2HB MET 1 1.648 7.598 14.002 6 HB3 MET 1 3HB MET 1 1.068 7.164 15.602 7 HG2 MET 1 2HG MET 1 2.824 8.537 16.610 8 HG3 MET 1 3HG MET 1 3.425 8.959 15.006 9 HE1 MET 1 3HE MET 1 1.761 10.217 13.149 10 HE2 MET 1 1HE MET 1 0.190 10.880 13.599 11 HE3 MET 1 2HE MET 1 0.419 9.135 13.527 12 H LYS 2 H LYS 2 3.924 4.164 13.887 13 HA LYS 2 HA LYS 2 3.438 2.525 12.514 14 HB2 LYS 2 2HB LYS 2 1.671 1.161 12.900 15 HB3 LYS 2 3HB LYS 2 1.308 2.257 14.216 16 HG2 LYS 2 2HG LYS 2 -0.309 3.446 12.687 17 HG3 LYS 2 3HG LYS 2 0.019 2.211 11.467 18 HD2 LYS 2 2HD LYS 2 -2.064 1.732 12.727 19 HD3 LYS 2 3HD LYS 2 -0.855 0.460 12.946 20 HE2 LYS 2 2HE LYS 2 -2.020 1.084 15.069 21 HE3 LYS 2 3HE LYS 2 -0.273 1.324 15.147 22 HZ1 LYS 2 3HZ LYS 2 -2.340 3.424 14.746 23 HZ2 LYS 2 1HZ LYS 2 -0.673 3.700 14.658 24 HZ3 LYS 2 2HZ LYS 2 -1.370 3.202 16.105 25 H ILE 3 H ILE 3 3.844 2.951 10.521 26 HA ILE 3 HA ILE 3 2.117 4.696 8.875 27 HB ILE 3 HB ILE 3 5.001 3.772 8.524 28 HG12 ILE 3 2HG1 ILE 3 3.700 6.509 8.876 29 HG13 ILE 3 3HG1 ILE 3 4.766 5.680 10.007 30 HG21 ILE 3 1HG2 ILE 3 3.917 3.629 6.310 31 HG22 ILE 3 2HG2 ILE 3 5.084 4.948 6.357 32 HG23 ILE 3 3HG2 ILE 3 3.357 5.296 6.467 33 HD11 ILE 3 3HD1 ILE 3 5.949 7.438 8.940 34 HD12 ILE 3 1HD1 ILE 3 5.517 6.849 7.336 35 HD13 ILE 3 2HD1 ILE 3 6.601 5.906 8.365 36 H LEU 4 H LEU 4 1.232 3.886 7.002 37 HA LEU 4 HA LEU 4 1.072 0.942 6.882 38 HB2 LEU 4 2HB LEU 4 -1.019 2.984 6.015 39 HB3 LEU 4 3HB LEU 4 -1.225 1.240 6.127 40 HG LEU 4 HG LEU 4 -0.810 3.137 8.481 41 HD11 LEU 4 1HD1 LEU 4 -3.293 1.629 7.646 42 HD12 LEU 4 2HD1 LEU 4 -3.032 3.372 7.552 43 HD13 LEU 4 3HD1 LEU 4 -3.107 2.579 9.122 44 HD21 LEU 4 3HD2 LEU 4 -1.254 0.140 8.520 45 HD22 LEU 4 1HD2 LEU 4 -1.232 1.199 9.933 46 HD23 LEU 4 2HD2 LEU 4 0.226 0.994 8.967 47 H ILE 5 H ILE 5 2.432 0.354 5.327 48 HA ILE 5 HA ILE 5 2.764 1.849 2.847 49 HB ILE 5 HB ILE 5 3.823 -0.946 3.520 50 HG12 ILE 5 2HG1 ILE 5 4.658 0.701 5.197 51 HG13 ILE 5 3HG1 ILE 5 5.955 0.074 4.191 52 HG21 ILE 5 1HG2 ILE 5 4.719 1.049 1.397 53 HG22 ILE 5 2HG2 ILE 5 3.842 -0.457 1.115 54 HG23 ILE 5 3HG2 ILE 5 5.491 -0.504 1.736 55 HD11 ILE 5 3HD1 ILE 5 5.931 2.164 2.895 56 HD12 ILE 5 1HD1 ILE 5 6.244 2.428 4.611 57 HD13 ILE 5 2HD1 ILE 5 4.651 2.782 3.944 58 H LEU 6 H LEU 6 1.086 1.730 1.460 59 HA LEU 6 HA LEU 6 -0.677 -0.631 1.445 60 HB2 LEU 6 2HB LEU 6 -1.401 1.941 1.547 61 HB3 LEU 6 3HB LEU 6 -1.162 1.886 -0.182 62 HG LEU 6 HG LEU 6 -3.512 1.591 0.256 63 HD11 LEU 6 1HD1 LEU 6 -4.084 -0.569 -0.730 64 HD12 LEU 6 2HD1 LEU 6 -2.442 -1.156 -0.449 65 HD13 LEU 6 3HD1 LEU 6 -2.726 0.173 -1.574 66 HD21 LEU 6 3HD2 LEU 6 -3.373 0.946 2.594 67 HD22 LEU 6 1HD2 LEU 6 -2.802 -0.663 2.143 68 HD23 LEU 6 2HD2 LEU 6 -4.435 -0.145 1.709 69 H ILE 7 H ILE 7 -0.329 -2.124 -0.103 70 HA ILE 7 HA ILE 7 0.919 -1.336 -2.678 71 HB ILE 7 HB ILE 7 1.312 -3.971 -1.166 72 HG12 ILE 7 2HG1 ILE 7 3.315 -1.731 -1.749 73 HG13 ILE 7 3HG1 ILE 7 2.569 -2.044 -0.186 74 HG21 ILE 7 1HG2 ILE 7 2.489 -3.099 -3.843 75 HG22 ILE 7 2HG2 ILE 7 1.266 -4.351 -3.605 76 HG23 ILE 7 3HG2 ILE 7 2.897 -4.582 -2.975 77 HD11 ILE 7 3HD1 ILE 7 3.680 -4.208 -0.092 78 HD12 ILE 7 1HD1 ILE 7 4.818 -2.874 -0.258 79 HD13 ILE 7 2HD1 ILE 7 4.442 -3.885 -1.653 80 H ASN 8 H ASN 8 -0.502 -1.554 -4.258 81 HA ASN 8 HA ASN 8 -2.455 -3.787 -4.241 82 HB2 ASN 8 2HB ASN 8 -3.551 -1.545 -4.060 83 HB3 ASN 8 3HB ASN 8 -2.750 -1.036 -5.537 84 HD21 ASN 8 1HD2 ASN 8 -3.458 -1.931 -7.535 85 HD22 ASN 8 2HD2 ASN 8 -4.997 -2.694 -7.686 86 H THR 9 H THR 9 -1.752 -5.269 -5.630 87 HA THR 9 HA THR 9 -0.251 -4.451 -8.053 88 HB THR 9 HB THR 9 1.273 -5.571 -6.482 89 HG1 THR 9 HG1 THR 9 2.162 -6.631 -8.090 90 HG21 THR 9 3HG2 THR 9 -0.593 -7.971 -6.616 91 HG22 THR 9 1HG2 THR 9 -0.322 -6.948 -5.201 92 HG23 THR 9 2HG2 THR 9 0.992 -7.935 -5.841 93 H ASN 10 H ASN 10 -0.663 -5.540 -9.937 94 HA ASN 10 HA ASN 10 -3.293 -6.766 -10.230 95 HB2 ASN 10 2HB ASN 10 -2.466 -4.977 -11.784 96 HB3 ASN 10 3HB ASN 10 -1.144 -6.016 -12.286 97 HD21 ASN 10 1HD2 ASN 10 -3.450 -4.730 -13.760 98 HD22 ASN 10 2HD2 ASN 10 -4.159 -6.024 -14.658 99 H ASN 11 H ASN 11 0.073 -7.624 -10.151 100 HA ASN 11 HA ASN 11 -0.390 -10.355 -11.179 101 HB2 ASN 11 2HB ASN 11 2.218 -8.855 -10.695 102 HB3 ASN 11 3HB ASN 11 2.071 -10.458 -11.411 103 HD21 ASN 11 1HD2 ASN 11 3.231 -8.057 -12.563 104 HD22 ASN 11 2HD2 ASN 11 2.364 -7.743 -14.023 105 H ASP 12 H ASP 12 -0.592 -11.971 -9.811 106 HA ASP 12 HA ASP 12 -0.799 -11.692 -7.041 107 HB2 ASP 12 2HB ASP 12 -0.539 -14.243 -8.682 108 HB3 ASP 12 3HB ASP 12 -1.065 -14.189 -7.000 109 H GLU 13 H GLU 13 1.960 -12.987 -8.883 110 HA GLU 13 HA GLU 13 3.152 -14.415 -6.740 111 HB2 GLU 13 2HB GLU 13 4.423 -13.308 -9.275 112 HB3 GLU 13 3HB GLU 13 5.239 -14.390 -8.148 113 HG2 GLU 13 2HG GLU 13 3.530 -16.127 -8.580 114 HG3 GLU 13 3HG GLU 13 2.731 -15.040 -9.718 115 H LEU 14 H LEU 14 3.204 -11.051 -7.615 116 HA LEU 14 HA LEU 14 5.513 -10.259 -6.174 117 HB2 LEU 14 2HB LEU 14 3.098 -8.716 -7.168 118 HB3 LEU 14 3HB LEU 14 4.316 -7.936 -6.169 119 HG LEU 14 HG LEU 14 4.782 -7.489 -8.509 120 HD11 LEU 14 1HD1 LEU 14 7.110 -8.230 -8.643 121 HD12 LEU 14 2HD1 LEU 14 6.835 -9.408 -7.359 122 HD13 LEU 14 3HD1 LEU 14 6.709 -7.678 -7.019 123 HD21 LEU 14 3HD2 LEU 14 4.973 -10.490 -8.921 124 HD22 LEU 14 1HD2 LEU 14 5.305 -9.241 -10.123 125 HD23 LEU 14 2HD2 LEU 14 3.674 -9.445 -9.502 126 H ILE 15 H ILE 15 2.156 -10.725 -5.202 127 HA ILE 15 HA ILE 15 2.239 -9.554 -2.658 128 HB ILE 15 HB ILE 15 0.718 -12.078 -3.492 129 HG12 ILE 15 2HG1 ILE 15 -0.273 -9.188 -3.428 130 HG13 ILE 15 3HG1 ILE 15 0.232 -10.036 -4.885 131 HG21 ILE 15 1HG2 ILE 15 0.854 -11.877 -1.020 132 HG22 ILE 15 2HG2 ILE 15 -0.795 -11.604 -1.583 133 HG23 ILE 15 3HG2 ILE 15 0.210 -10.233 -1.108 134 HD11 ILE 15 3HD1 ILE 15 -2.150 -10.015 -4.745 135 HD12 ILE 15 1HD1 ILE 15 -2.115 -10.728 -3.131 136 HD13 ILE 15 2HD1 ILE 15 -1.580 -11.668 -4.526 137 H LYS 16 H LYS 16 2.797 -13.009 -3.527 138 HA LYS 16 HA LYS 16 3.470 -13.850 -0.923 139 HB2 LYS 16 2HB LYS 16 4.143 -15.980 -1.936 140 HB3 LYS 16 3HB LYS 16 2.639 -15.404 -2.642 141 HG2 LYS 16 2HG LYS 16 3.878 -14.622 -4.640 142 HG3 LYS 16 3HG LYS 16 5.383 -15.211 -3.930 143 HD2 LYS 16 2HD LYS 16 4.646 -16.861 -5.519 144 HD3 LYS 16 3HD LYS 16 4.381 -17.536 -3.912 145 HE2 LYS 16 2HE LYS 16 1.971 -16.841 -4.100 146 HE3 LYS 16 3HE LYS 16 2.294 -16.339 -5.760 147 HZ1 LYS 16 3HZ LYS 16 2.565 -19.095 -4.677 148 HZ2 LYS 16 1HZ LYS 16 2.955 -18.632 -6.254 149 HZ3 LYS 16 2HZ LYS 16 1.364 -18.541 -5.719 150 H LYS 17 H LYS 17 5.506 -12.649 -3.544 151 HA LYS 17 HA LYS 17 8.029 -13.212 -2.314 152 HB2 LYS 17 2HB LYS 17 7.253 -11.224 -4.490 153 HB3 LYS 17 3HB LYS 17 8.916 -11.593 -4.035 154 HG2 LYS 17 2HG LYS 17 8.625 -13.937 -4.721 155 HG3 LYS 17 3HG LYS 17 6.926 -13.638 -5.088 156 HD2 LYS 17 2HD LYS 17 8.206 -13.673 -7.157 157 HD3 LYS 17 3HD LYS 17 7.612 -12.034 -6.871 158 HE2 LYS 17 2HE LYS 17 9.938 -12.020 -7.655 159 HE3 LYS 17 3HE LYS 17 9.824 -11.378 -6.017 160 HZ1 LYS 17 3HZ LYS 17 10.512 -13.590 -5.210 161 HZ2 LYS 17 1HZ LYS 17 11.686 -12.849 -6.171 162 HZ3 LYS 17 2HZ LYS 17 10.736 -14.088 -6.805 163 H ILE 18 H ILE 18 6.109 -10.183 -2.521 164 HA ILE 18 HA ILE 18 7.822 -8.506 -1.016 165 HB ILE 18 HB ILE 18 4.829 -8.315 -1.602 166 HG12 ILE 18 2HG1 ILE 18 7.156 -6.629 -2.650 167 HG13 ILE 18 3HG1 ILE 18 6.485 -8.016 -3.498 168 HG21 ILE 18 1HG2 ILE 18 6.496 -6.193 -0.201 169 HG22 ILE 18 2HG2 ILE 18 5.185 -7.128 0.522 170 HG23 ILE 18 3HG2 ILE 18 4.841 -5.988 -0.777 171 HD11 ILE 18 3HD1 ILE 18 5.658 -5.957 -4.433 172 HD12 ILE 18 1HD1 ILE 18 5.030 -5.449 -2.864 173 HD13 ILE 18 2HD1 ILE 18 4.335 -6.850 -3.685 174 H LYS 19 H LYS 19 5.297 -10.763 -0.051 175 HA LYS 19 HA LYS 19 4.676 -10.232 2.554 176 HB2 LYS 19 2HB LYS 19 5.252 -12.902 1.201 177 HB3 LYS 19 3HB LYS 19 4.664 -12.828 2.853 178 HG2 LYS 19 2HG LYS 19 3.170 -11.598 0.526 179 HG3 LYS 19 3HG LYS 19 2.931 -13.265 1.031 180 HD2 LYS 19 2HD LYS 19 2.517 -10.852 2.825 181 HD3 LYS 19 3HD LYS 19 1.229 -11.650 1.923 182 HE2 LYS 19 2HE LYS 19 1.608 -13.724 3.149 183 HE3 LYS 19 3HE LYS 19 2.976 -13.006 3.993 184 HZ1 LYS 19 3HZ LYS 19 1.005 -12.994 5.364 185 HZ2 LYS 19 1HZ LYS 19 0.155 -12.132 4.194 186 HZ3 LYS 19 2HZ LYS 19 1.451 -11.410 4.993 187 H LYS 20 H LYS 20 7.575 -11.916 1.379 188 HA LYS 20 HA LYS 20 8.693 -12.220 4.051 189 HB2 LYS 20 2HB LYS 20 9.770 -13.063 1.322 190 HB3 LYS 20 3HB LYS 20 10.557 -13.416 2.858 191 HG2 LYS 20 2HG LYS 20 7.812 -14.383 2.001 192 HG3 LYS 20 3HG LYS 20 9.284 -15.360 2.063 193 HD2 LYS 20 2HD LYS 20 9.380 -15.130 4.503 194 HD3 LYS 20 3HD LYS 20 8.007 -14.020 4.489 195 HE2 LYS 20 2HE LYS 20 6.559 -15.848 3.641 196 HE3 LYS 20 3HE LYS 20 7.934 -16.955 3.709 197 HZ1 LYS 20 3HZ LYS 20 6.828 -15.497 6.054 198 HZ2 LYS 20 1HZ LYS 20 8.043 -16.669 6.081 199 HZ3 LYS 20 2HZ LYS 20 6.468 -17.103 5.665 200 H GLU 21 H GLU 21 9.402 -10.389 1.076 201 HA GLU 21 HA GLU 21 11.792 -9.154 1.614 202 HB2 GLU 21 2HB GLU 21 9.355 -7.807 0.368 203 HB3 GLU 21 3HB GLU 21 10.991 -7.165 0.297 204 HG2 GLU 21 2HG GLU 21 10.060 -9.767 -0.929 205 HG3 GLU 21 3HG GLU 21 10.325 -8.260 -1.799 206 H VAL 22 H VAL 22 8.656 -8.284 2.950 207 HA VAL 22 HA VAL 22 9.777 -5.983 4.422 208 HB VAL 22 HB VAL 22 7.536 -5.129 4.590 209 HG11 VAL 22 1HG1 VAL 22 7.997 -6.271 1.806 210 HG12 VAL 22 2HG1 VAL 22 8.651 -4.762 2.442 211 HG13 VAL 22 3HG1 VAL 22 6.918 -4.929 2.196 212 HG21 VAL 22 3HG2 VAL 22 6.268 -7.150 5.088 213 HG22 VAL 22 1HG2 VAL 22 6.553 -7.783 3.463 214 HG23 VAL 22 2HG2 VAL 22 5.546 -6.351 3.692 215 H GLU 23 H GLU 23 8.449 -9.174 4.944 216 HA GLU 23 HA GLU 23 7.561 -9.060 7.598 217 HB2 GLU 23 2HB GLU 23 7.259 -11.045 6.121 218 HB3 GLU 23 3HB GLU 23 8.983 -11.383 6.211 219 HG2 GLU 23 2HG GLU 23 8.704 -11.727 8.698 220 HG3 GLU 23 3HG GLU 23 6.965 -11.541 8.476 221 H ASN 24 H ASN 24 10.793 -9.745 6.315 222 HA ASN 24 HA ASN 24 12.082 -10.087 8.849 223 HB2 ASN 24 2HB ASN 24 13.295 -9.570 6.098 224 HB3 ASN 24 3HB ASN 24 14.207 -10.043 7.526 225 HD21 ASN 24 1HD2 ASN 24 12.118 -11.123 5.001 226 HD22 ASN 24 2HD2 ASN 24 12.202 -12.806 5.348 227 H GLN 25 H GLN 25 11.149 -7.275 7.109 228 HA GLN 25 HA GLN 25 13.179 -5.511 8.275 229 HB2 GLN 25 2HB GLN 25 10.828 -4.911 6.424 230 HB3 GLN 25 3HB GLN 25 12.035 -3.736 6.935 231 HG2 GLN 25 2HG GLN 25 12.608 -6.221 5.297 232 HG3 GLN 25 3HG GLN 25 12.436 -4.593 4.651 233 HE21 GLN 25 1HE2 GLN 25 14.499 -6.766 6.418 234 HE22 GLN 25 2HE2 GLN 25 15.908 -5.770 6.402 235 H GLY 26 H GLY 26 10.526 -6.899 9.531 236 HA2 GLY 26 2HA GLY 26 9.414 -6.497 11.505 237 HA3 GLY 26 3HA GLY 26 10.242 -4.955 11.637 238 H TYR 27 H TYR 27 8.465 -5.646 8.728 239 HA TYR 27 HA TYR 27 6.317 -3.780 9.511 240 HB2 TYR 27 2HB TYR 27 7.348 -4.724 6.799 241 HB3 TYR 27 3HB TYR 27 5.774 -3.948 6.957 242 HD1 TYR 27 HD2 TYR 27 9.355 -3.350 8.005 243 HD2 TYR 27 HD1 TYR 27 5.692 -1.611 6.635 244 HE1 TYR 27 HE2 TYR 27 10.417 -1.133 7.967 245 HE2 TYR 27 HE1 TYR 27 6.759 0.604 6.606 246 HH TYR 27 HH TYR 27 10.146 1.058 7.010 247 H GLN 28 H GLN 28 4.638 -4.754 10.409 248 HA GLN 28 HA GLN 28 4.053 -7.533 10.232 249 HB2 GLN 28 2HB GLN 28 2.251 -5.278 11.209 250 HB3 GLN 28 3HB GLN 28 2.009 -6.995 11.517 251 HG2 GLN 28 2HG GLN 28 4.142 -7.021 12.816 252 HG3 GLN 28 3HG GLN 28 4.291 -5.283 12.553 253 HE21 GLN 28 1HE2 GLN 28 4.201 -4.820 14.783 254 HE22 GLN 28 2HE2 GLN 28 2.757 -4.977 15.716 255 H VAL 29 H VAL 29 3.363 -8.428 8.376 256 HA VAL 29 HA VAL 29 2.070 -6.857 6.323 257 HB VAL 29 HB VAL 29 2.377 -9.877 6.094 258 HG11 VAL 29 1HG1 VAL 29 2.743 -9.339 3.706 259 HG12 VAL 29 2HG1 VAL 29 2.592 -7.619 4.062 260 HG13 VAL 29 3HG1 VAL 29 1.209 -8.692 4.290 261 HG21 VAL 29 3HG2 VAL 29 4.544 -9.161 6.966 262 HG22 VAL 29 1HG2 VAL 29 4.658 -7.900 5.737 263 HG23 VAL 29 2HG2 VAL 29 4.696 -9.602 5.264 264 H ARG 30 H ARG 30 -0.005 -6.656 6.099 265 HA ARG 30 HA ARG 30 -1.963 -8.709 6.909 266 HB2 ARG 30 2HB ARG 30 -2.097 -5.660 7.139 267 HB3 ARG 30 3HB ARG 30 -3.551 -6.652 7.158 268 HG2 ARG 30 2HG ARG 30 -1.288 -6.948 9.161 269 HG3 ARG 30 3HG ARG 30 -2.717 -5.940 9.417 270 HD2 ARG 30 2HD ARG 30 -2.702 -8.945 8.975 271 HD3 ARG 30 3HD ARG 30 -2.993 -8.114 10.510 272 HE ARG 30 HE ARG 30 -4.942 -7.039 9.171 273 HH11 ARG 30 1HH1 ARG 30 -3.939 -10.403 8.884 274 HH12 ARG 30 2HH1 ARG 30 -5.520 -10.945 8.418 275 HH21 ARG 30 1HH2 ARG 30 -6.985 -7.772 8.526 276 HH22 ARG 30 2HH2 ARG 30 -7.236 -9.459 8.217 277 H ASP 31 H ASP 31 -3.707 -8.943 5.388 278 HA ASP 31 HA ASP 31 -3.656 -7.236 2.988 279 HB2 ASP 31 2HB ASP 31 -3.870 -9.063 1.426 280 HB3 ASP 31 3HB ASP 31 -2.436 -9.353 2.397 281 H VAL 32 H VAL 32 -5.625 -6.916 2.045 282 HA VAL 32 HA VAL 32 -8.019 -7.780 3.540 283 HB VAL 32 HB VAL 32 -7.416 -4.945 2.555 284 HG11 VAL 32 1HG1 VAL 32 -9.540 -4.299 3.650 285 HG12 VAL 32 2HG1 VAL 32 -9.871 -5.995 4.014 286 HG13 VAL 32 3HG1 VAL 32 -9.797 -5.448 2.337 287 HG21 VAL 32 3HG2 VAL 32 -7.572 -5.989 5.411 288 HG22 VAL 32 1HG2 VAL 32 -7.398 -4.291 4.948 289 HG23 VAL 32 2HG2 VAL 32 -6.120 -5.445 4.570 290 H ASN 33 H ASN 33 -9.245 -8.865 2.153 291 HA ASN 33 HA ASN 33 -9.728 -7.781 -0.566 292 HB2 ASN 33 2HB ASN 33 -9.375 -10.699 0.249 293 HB3 ASN 33 3HB ASN 33 -10.119 -10.222 -1.273 294 HD21 ASN 33 1HD2 ASN 33 -7.131 -10.354 0.535 295 HD22 ASN 33 2HD2 ASN 33 -6.080 -10.035 -0.796 296 H ASP 34 H ASP 34 -11.026 -7.604 2.188 297 HA ASP 34 HA ASP 34 -13.776 -7.820 1.226 298 HB2 ASP 34 2HB ASP 34 -13.512 -9.978 2.306 299 HB3 ASP 34 3HB ASP 34 -12.725 -9.254 3.704 300 H SER 35 H SER 35 -15.102 -6.257 2.092 301 HA SER 35 HA SER 35 -13.894 -3.928 3.147 302 HB2 SER 35 2HB SER 35 -16.301 -3.083 3.187 303 HB3 SER 35 3HB SER 35 -15.718 -3.677 1.636 304 HG SER 35 HG SER 35 -17.079 -5.294 1.716 305 H ASP 36 H ASP 36 -15.916 -6.438 4.695 306 HA ASP 36 HA ASP 36 -16.308 -5.126 7.186 307 HB2 ASP 36 2HB ASP 36 -17.693 -7.039 6.578 308 HB3 ASP 36 3HB ASP 36 -16.292 -8.092 6.481 309 H GLU 37 H GLU 37 -13.713 -7.133 5.914 310 HA GLU 37 HA GLU 37 -12.087 -7.317 8.245 311 HB2 GLU 37 2HB GLU 37 -11.381 -7.419 5.276 312 HB3 GLU 37 3HB GLU 37 -10.200 -7.682 6.552 313 HG2 GLU 37 2HG GLU 37 -12.683 -9.355 6.113 314 HG3 GLU 37 3HG GLU 37 -11.060 -9.785 5.573 315 H LEU 38 H LEU 38 -12.164 -4.992 5.527 316 HA LEU 38 HA LEU 38 -10.019 -3.334 6.147 317 HB2 LEU 38 2HB LEU 38 -11.105 -3.174 4.028 318 HB3 LEU 38 3HB LEU 38 -12.664 -2.837 4.737 319 HG LEU 38 HG LEU 38 -10.476 -0.768 5.101 320 HD11 LEU 38 1HD1 LEU 38 -10.996 0.283 2.954 321 HD12 LEU 38 2HD1 LEU 38 -12.057 -1.064 2.525 322 HD13 LEU 38 3HD1 LEU 38 -10.322 -1.328 2.718 323 HD21 LEU 38 3HD2 LEU 38 -13.475 -0.500 4.621 324 HD22 LEU 38 1HD2 LEU 38 -12.350 0.829 4.938 325 HD23 LEU 38 2HD2 LEU 38 -12.662 -0.375 6.184 326 H LYS 39 H LYS 39 -13.362 -3.146 7.253 327 HA LYS 39 HA LYS 39 -13.198 -0.742 8.732 328 HB2 LYS 39 2HB LYS 39 -15.071 -3.133 9.023 329 HB3 LYS 39 3HB LYS 39 -15.340 -1.560 9.771 330 HG2 LYS 39 2HG LYS 39 -15.644 -0.501 7.622 331 HG3 LYS 39 3HG LYS 39 -15.094 -1.943 6.772 332 HD2 LYS 39 2HD LYS 39 -17.502 -1.807 6.560 333 HD3 LYS 39 3HD LYS 39 -17.115 -3.169 7.611 334 HE2 LYS 39 2HE LYS 39 -17.724 -1.875 9.579 335 HE3 LYS 39 3HE LYS 39 -17.961 -0.426 8.600 336 HZ1 LYS 39 3HZ LYS 39 -19.550 -2.920 8.315 337 HZ2 LYS 39 1HZ LYS 39 -19.810 -1.465 7.505 338 HZ3 LYS 39 2HZ LYS 39 -20.049 -1.559 9.171 339 H LYS 40 H LYS 40 -12.649 -4.139 9.609 340 HA LYS 40 HA LYS 40 -12.252 -3.624 12.415 341 HB2 LYS 40 2HB LYS 40 -11.829 -6.130 10.747 342 HB3 LYS 40 3HB LYS 40 -11.522 -6.066 12.480 343 HG2 LYS 40 2HG LYS 40 -13.936 -5.299 12.770 344 HG3 LYS 40 3HG LYS 40 -14.182 -5.678 11.070 345 HD2 LYS 40 2HD LYS 40 -13.272 -7.696 13.158 346 HD3 LYS 40 3HD LYS 40 -14.953 -7.447 12.692 347 HE2 LYS 40 2HE LYS 40 -14.215 -9.344 11.480 348 HE3 LYS 40 3HE LYS 40 -14.249 -8.027 10.312 349 HZ1 LYS 40 3HZ LYS 40 -11.799 -8.916 11.726 350 HZ2 LYS 40 1HZ LYS 40 -11.889 -7.846 10.428 351 HZ3 LYS 40 2HZ LYS 40 -12.257 -9.475 10.208 352 H GLU 41 H GLU 41 -10.131 -3.733 9.620 353 HA GLU 41 HA GLU 41 -7.639 -3.746 10.919 354 HB2 GLU 41 2HB GLU 41 -8.413 -2.093 8.464 355 HB3 GLU 41 3HB GLU 41 -6.770 -2.474 8.966 356 HG2 GLU 41 2HG GLU 41 -8.852 -4.440 7.989 357 HG3 GLU 41 3HG GLU 41 -7.467 -3.852 7.082 358 H MET 42 H MET 42 -9.805 -1.072 10.030 359 HA MET 42 HA MET 42 -8.247 1.066 10.976 360 HB2 MET 42 2HB MET 42 -11.256 0.914 10.526 361 HB3 MET 42 3HB MET 42 -10.355 2.409 10.786 362 HG2 MET 42 2HG MET 42 -9.984 0.488 8.485 363 HG3 MET 42 3HG MET 42 -10.770 2.069 8.420 364 HE1 MET 42 3HE MET 42 -8.984 2.347 6.281 365 HE2 MET 42 1HE MET 42 -8.175 0.836 6.703 366 HE3 MET 42 2HE MET 42 -7.237 2.317 6.516 367 H LYS 43 H LYS 43 -10.491 -1.025 12.668 368 HA LYS 43 HA LYS 43 -10.833 0.384 15.075 369 HB2 LYS 43 2HB LYS 43 -10.546 -2.625 14.619 370 HB3 LYS 43 3HB LYS 43 -11.061 -1.909 16.144 371 HG2 LYS 43 2HG LYS 43 -13.069 -0.994 15.056 372 HG3 LYS 43 3HG LYS 43 -12.550 -1.672 13.506 373 HD2 LYS 43 2HD LYS 43 -12.685 -3.958 14.467 374 HD3 LYS 43 3HD LYS 43 -13.216 -3.285 16.011 375 HE2 LYS 43 2HE LYS 43 -14.719 -3.016 13.384 376 HE3 LYS 43 3HE LYS 43 -15.080 -4.195 14.642 377 HZ1 LYS 43 3HZ LYS 43 -15.213 -1.251 14.954 378 HZ2 LYS 43 1HZ LYS 43 -15.568 -2.383 16.157 379 HZ3 LYS 43 2HZ LYS 43 -16.533 -2.284 14.776 380 H LYS 44 H LYS 44 -8.319 -1.957 14.111 381 HA LYS 44 HA LYS 44 -6.891 -1.809 16.606 382 HB2 LYS 44 2HB LYS 44 -6.061 -3.127 13.971 383 HB3 LYS 44 3HB LYS 44 -5.338 -3.420 15.553 384 HG2 LYS 44 2HG LYS 44 -8.169 -4.087 14.727 385 HG3 LYS 44 3HG LYS 44 -6.854 -5.237 15.004 386 HD2 LYS 44 2HD LYS 44 -6.800 -4.694 17.378 387 HD3 LYS 44 3HD LYS 44 -7.939 -3.366 17.148 388 HE2 LYS 44 2HE LYS 44 -9.643 -5.067 16.412 389 HE3 LYS 44 3HE LYS 44 -8.501 -6.321 16.906 390 HZ1 LYS 44 3HZ LYS 44 -8.525 -5.396 19.152 391 HZ2 LYS 44 1HZ LYS 44 -10.087 -5.830 18.666 392 HZ3 LYS 44 2HZ LYS 44 -9.623 -4.206 18.670 393 H LEU 45 H LEU 45 -6.521 -0.381 13.431 394 HA LEU 45 HA LEU 45 -3.928 0.712 13.712 395 HB2 LEU 45 2HB LEU 45 -6.258 1.665 11.997 396 HB3 LEU 45 3HB LEU 45 -4.584 2.162 11.789 397 HG LEU 45 HG LEU 45 -5.624 -0.676 11.409 398 HD11 LEU 45 1HD1 LEU 45 -6.504 0.772 9.667 399 HD12 LEU 45 2HD1 LEU 45 -5.295 -0.321 9.000 400 HD13 LEU 45 3HD1 LEU 45 -4.883 1.368 9.300 401 HD21 LEU 45 3HD2 LEU 45 -3.285 -0.674 12.124 402 HD22 LEU 45 1HD2 LEU 45 -2.867 0.444 10.822 403 HD23 LEU 45 2HD2 LEU 45 -3.427 -1.188 10.446 404 H ALA 46 H ALA 46 -7.108 1.776 14.778 405 HA ALA 46 HA ALA 46 -6.154 4.412 15.667 406 HB1 ALA 46 3HB ALA 46 -8.931 3.187 15.813 407 HB2 ALA 46 1HB ALA 46 -8.340 4.269 14.552 408 HB3 ALA 46 2HB ALA 46 -8.506 4.858 16.204 409 H GLU 47 H GLU 47 -7.034 1.263 16.999 410 HA GLU 47 HA GLU 47 -7.230 2.072 19.755 411 HB2 GLU 47 2HB GLU 47 -6.988 -0.640 18.402 412 HB3 GLU 47 3HB GLU 47 -6.953 -0.490 20.157 413 HG2 GLU 47 2HG GLU 47 -9.208 0.495 20.138 414 HG3 GLU 47 3HG GLU 47 -9.242 0.408 18.379 415 H GLU 48 H GLU 48 -4.657 1.191 17.611 416 HA GLU 48 HA GLU 48 -2.702 1.085 19.832 417 HB2 GLU 48 2HB GLU 48 -2.667 -0.840 18.218 418 HB3 GLU 48 3HB GLU 48 -2.328 0.279 16.904 419 HG2 GLU 48 2HG GLU 48 -0.290 -0.880 17.648 420 HG3 GLU 48 3HG GLU 48 -0.164 0.858 17.918 421 H LYS 49 H LYS 49 -1.048 2.606 19.906 422 HA LYS 49 HA LYS 49 -0.969 4.737 17.838 423 HB2 LYS 49 2HB LYS 49 -0.851 5.138 20.859 424 HB3 LYS 49 3HB LYS 49 -0.523 6.398 19.673 425 HG2 LYS 49 2HG LYS 49 -3.169 4.951 20.004 426 HG3 LYS 49 3HG LYS 49 -2.798 6.563 20.623 427 HD2 LYS 49 2HD LYS 49 -2.525 7.418 18.345 428 HD3 LYS 49 3HD LYS 49 -2.739 5.796 17.675 429 HE2 LYS 49 2HE LYS 49 -4.788 7.099 17.425 430 HE3 LYS 49 3HE LYS 49 -5.055 5.758 18.537 431 HZ1 LYS 49 3HZ LYS 49 -4.522 8.565 19.354 432 HZ2 LYS 49 1HZ LYS 49 -4.861 7.270 20.385 433 HZ3 LYS 49 2HZ LYS 49 -6.044 7.828 19.319 434 H ASN 50 H ASN 50 0.761 2.346 19.447 435 HA ASN 50 HA ASN 50 3.341 3.519 19.637 436 HB2 ASN 50 2HB ASN 50 2.361 0.653 19.551 437 HB3 ASN 50 3HB ASN 50 4.080 0.959 19.343 438 HD21 ASN 50 1HD2 ASN 50 1.555 0.668 21.609 439 HD22 ASN 50 2HD2 ASN 50 2.454 1.077 23.019 440 H PHE 51 H PHE 51 5.184 2.476 18.319 441 HA PHE 51 HA PHE 51 4.780 3.556 15.631 442 HB2 PHE 51 2HB PHE 51 7.346 2.917 17.163 443 HB3 PHE 51 3HB PHE 51 7.233 3.821 15.655 444 HD1 PHE 51 HD1 PHE 51 6.142 6.090 15.650 445 HD2 PHE 51 HD2 PHE 51 6.973 4.027 19.297 446 HE1 PHE 51 HE1 PHE 51 5.906 8.197 16.893 447 HE2 PHE 51 HE2 PHE 51 6.733 6.142 20.538 448 HZ PHE 51 HZ PHE 51 6.200 8.227 19.338 449 H GLU 52 H GLU 52 3.859 0.837 16.260 450 HA GLU 52 HA GLU 52 5.655 -1.025 14.950 451 HB2 GLU 52 2HB GLU 52 2.769 -1.397 15.869 452 HB3 GLU 52 3HB GLU 52 3.853 -2.677 15.323 453 HG2 GLU 52 2HG GLU 52 5.357 -2.168 17.250 454 HG3 GLU 52 3HG GLU 52 4.179 -0.979 17.812 455 H LYS 53 H LYS 53 5.883 -0.572 12.817 456 HA LYS 53 HA LYS 53 3.836 0.633 11.221 457 HB2 LYS 53 2HB LYS 53 5.520 0.250 9.301 458 HB3 LYS 53 3HB LYS 53 5.962 1.356 10.581 459 HG2 LYS 53 2HG LYS 53 6.912 -1.477 10.833 460 HG3 LYS 53 3HG LYS 53 7.659 -0.458 9.605 461 HD2 LYS 53 2HD LYS 53 8.123 1.245 11.441 462 HD3 LYS 53 3HD LYS 53 7.600 0.022 12.607 463 HE2 LYS 53 2HE LYS 53 9.908 -0.239 10.647 464 HE3 LYS 53 3HE LYS 53 10.047 0.048 12.381 465 HZ1 LYS 53 3HZ LYS 53 9.143 -2.094 12.827 466 HZ2 LYS 53 1HZ LYS 53 10.390 -2.289 11.713 467 HZ3 LYS 53 2HZ LYS 53 8.784 -2.363 11.202 468 H ILE 54 H ILE 54 2.450 -0.247 9.836 469 HA ILE 54 HA ILE 54 2.367 -3.201 9.534 470 HB ILE 54 HB ILE 54 -0.004 -1.290 9.294 471 HG12 ILE 54 2HG1 ILE 54 0.842 -1.099 11.611 472 HG13 ILE 54 3HG1 ILE 54 -0.725 -1.893 11.571 473 HG21 ILE 54 1HG2 ILE 54 -0.341 -3.447 8.192 474 HG22 ILE 54 2HG2 ILE 54 -1.395 -3.299 9.597 475 HG23 ILE 54 3HG2 ILE 54 0.056 -4.301 9.688 476 HD11 ILE 54 3HD1 ILE 54 0.385 -4.062 11.888 477 HD12 ILE 54 1HD1 ILE 54 0.737 -2.926 13.189 478 HD13 ILE 54 2HD1 ILE 54 1.947 -3.241 11.947 479 H LEU 55 H LEU 55 1.933 -3.990 7.461 480 HA LEU 55 HA LEU 55 1.878 -2.051 5.206 481 HB2 LEU 55 2HB LEU 55 3.999 -3.379 5.404 482 HB3 LEU 55 3HB LEU 55 3.086 -4.861 5.196 483 HG LEU 55 HG LEU 55 2.877 -2.746 3.036 484 HD11 LEU 55 1HD1 LEU 55 4.874 -3.531 1.904 485 HD12 LEU 55 2HD1 LEU 55 5.249 -4.602 3.253 486 HD13 LEU 55 3HD1 LEU 55 5.276 -2.853 3.481 487 HD21 LEU 55 3HD2 LEU 55 1.500 -4.771 2.820 488 HD22 LEU 55 1HD2 LEU 55 2.950 -5.780 2.875 489 HD23 LEU 55 2HD2 LEU 55 2.693 -4.666 1.529 490 H ILE 56 H ILE 56 0.055 -2.158 4.006 491 HA ILE 56 HA ILE 56 -1.796 -4.445 4.417 492 HB ILE 56 HB ILE 56 -2.524 -1.599 3.565 493 HG12 ILE 56 2HG1 ILE 56 -1.753 -1.673 5.956 494 HG13 ILE 56 3HG1 ILE 56 -3.436 -1.202 5.792 495 HG21 ILE 56 1HG2 ILE 56 -4.101 -3.252 2.689 496 HG22 ILE 56 2HG2 ILE 56 -4.873 -2.306 3.958 497 HG23 ILE 56 3HG2 ILE 56 -4.322 -3.946 4.300 498 HD11 ILE 56 3HD1 ILE 56 -4.122 -3.461 6.466 499 HD12 ILE 56 1HD1 ILE 56 -3.113 -2.672 7.679 500 HD13 ILE 56 2HD1 ILE 56 -2.423 -3.913 6.635 501 H ILE 57 H ILE 57 -1.683 -5.764 2.697 502 HA ILE 57 HA ILE 57 -1.324 -4.797 -0.052 503 HB ILE 57 HB ILE 57 -1.659 -7.660 0.998 504 HG12 ILE 57 2HG1 ILE 57 0.880 -6.217 0.096 505 HG13 ILE 57 3HG1 ILE 57 0.454 -6.575 1.764 506 HG21 ILE 57 1HG2 ILE 57 -0.900 -8.400 -1.245 507 HG22 ILE 57 2HG2 ILE 57 -0.877 -6.724 -1.797 508 HG23 ILE 57 3HG2 ILE 57 -2.406 -7.482 -1.346 509 HD11 ILE 57 3HD1 ILE 57 2.116 -8.113 0.947 510 HD12 ILE 57 1HD1 ILE 57 1.067 -8.604 -0.385 511 HD13 ILE 57 2HD1 ILE 57 0.615 -8.974 1.283 512 H SER 58 H SER 58 -3.098 -4.309 -1.254 513 HA SER 58 HA SER 58 -5.644 -5.762 -0.788 514 HB2 SER 58 2HB SER 58 -5.886 -3.396 -0.043 515 HB3 SER 58 3HB SER 58 -5.328 -2.832 -1.616 516 HG SER 58 HG SER 58 -7.318 -2.989 -2.240 517 H ASN 59 H ASN 59 -6.684 -6.442 -2.674 518 HA ASN 59 HA ASN 59 -5.175 -6.157 -5.223 519 HB2 ASN 59 2HB ASN 59 -7.129 -8.321 -4.324 520 HB3 ASN 59 3HB ASN 59 -6.375 -8.247 -5.914 521 HD21 ASN 59 1HD2 ASN 59 -5.850 -8.887 -2.527 522 HD22 ASN 59 2HD2 ASN 59 -4.289 -9.610 -2.697 523 H ASP 60 H ASP 60 -7.715 -4.845 -3.677 524 HA ASP 60 HA ASP 60 -9.246 -4.331 -6.156 525 HB2 ASP 60 2HB ASP 60 -10.567 -5.789 -4.683 526 HB3 ASP 60 3HB ASP 60 -10.341 -4.687 -3.329 527 H LYS 61 H LYS 61 -9.642 -2.266 -6.612 528 HA LYS 61 HA LYS 61 -8.076 -0.240 -5.340 529 HB2 LYS 61 2HB LYS 61 -10.084 -0.039 -7.613 530 HB3 LYS 61 3HB LYS 61 -8.999 1.255 -7.118 531 HG2 LYS 61 2HG LYS 61 -7.055 -0.237 -7.693 532 HG3 LYS 61 3HG LYS 61 -8.208 -1.419 -8.324 533 HD2 LYS 61 2HD LYS 61 -7.767 1.417 -9.347 534 HD3 LYS 61 3HD LYS 61 -7.294 -0.077 -10.158 535 HE2 LYS 61 2HE LYS 61 -10.149 0.809 -9.595 536 HE3 LYS 61 3HE LYS 61 -9.332 0.873 -11.156 537 HZ1 LYS 61 3HZ LYS 61 -9.979 -1.590 -9.629 538 HZ2 LYS 61 1HZ LYS 61 -9.123 -1.544 -11.083 539 HZ3 LYS 61 2HZ LYS 61 -10.731 -1.047 -11.038 540 H GLN 62 H GLN 62 -11.470 -1.154 -5.139 541 HA GLN 62 HA GLN 62 -12.410 1.382 -4.142 542 HB2 GLN 62 2HB GLN 62 -13.979 -0.157 -5.253 543 HB3 GLN 62 3HB GLN 62 -13.703 -1.378 -4.016 544 HG2 GLN 62 2HG GLN 62 -15.845 -0.233 -3.667 545 HG3 GLN 62 3HG GLN 62 -14.744 0.065 -2.321 546 HE21 GLN 62 1HE2 GLN 62 -15.662 1.987 -1.655 547 HE22 GLN 62 2HE2 GLN 62 -15.637 3.438 -2.587 548 H LEU 63 H LEU 63 -11.427 -1.723 -2.667 549 HA LEU 63 HA LEU 63 -11.729 -1.057 0.050 550 HB2 LEU 63 2HB LEU 63 -9.678 -2.849 -1.323 551 HB3 LEU 63 3HB LEU 63 -9.900 -2.778 0.420 552 HG LEU 63 HG LEU 63 -12.010 -3.713 -1.565 553 HD11 LEU 63 1HD1 LEU 63 -11.562 -5.967 -0.711 554 HD12 LEU 63 2HD1 LEU 63 -10.261 -5.342 0.308 555 HD13 LEU 63 3HD1 LEU 63 -10.122 -5.269 -1.451 556 HD21 LEU 63 3HD2 LEU 63 -13.249 -4.474 0.424 557 HD22 LEU 63 1HD2 LEU 63 -13.022 -2.727 0.433 558 HD23 LEU 63 2HD2 LEU 63 -12.030 -3.748 1.476 559 H LEU 64 H LEU 64 -9.057 -0.609 -2.226 560 HA LEU 64 HA LEU 64 -7.150 0.528 -0.529 561 HB2 LEU 64 2HB LEU 64 -6.616 -0.315 -2.726 562 HB3 LEU 64 3HB LEU 64 -7.651 0.860 -3.507 563 HG LEU 64 HG LEU 64 -5.284 1.872 -1.903 564 HD11 LEU 64 1HD1 LEU 64 -5.072 0.787 -4.723 565 HD12 LEU 64 2HD1 LEU 64 -4.335 0.094 -3.275 566 HD13 LEU 64 3HD1 LEU 64 -3.820 1.676 -3.847 567 HD21 LEU 64 3HD2 LEU 64 -5.249 3.646 -3.623 568 HD22 LEU 64 1HD2 LEU 64 -6.820 3.545 -2.829 569 HD23 LEU 64 2HD2 LEU 64 -6.609 2.880 -4.448 570 H LYS 65 H LYS 65 -9.718 2.096 -2.445 571 HA LYS 65 HA LYS 65 -9.071 4.784 -1.973 572 HB2 LYS 65 2HB LYS 65 -11.667 3.370 -2.655 573 HB3 LYS 65 3HB LYS 65 -11.638 5.114 -2.410 574 HG2 LYS 65 2HG LYS 65 -10.204 5.456 -4.299 575 HG3 LYS 65 3HG LYS 65 -9.843 3.732 -4.428 576 HD2 LYS 65 2HD LYS 65 -11.455 4.566 -6.169 577 HD3 LYS 65 3HD LYS 65 -12.078 3.236 -5.191 578 HE2 LYS 65 2HE LYS 65 -13.787 4.973 -5.571 579 HE3 LYS 65 3HE LYS 65 -13.405 4.811 -3.857 580 HZ1 LYS 65 3HZ LYS 65 -13.558 7.125 -4.495 581 HZ2 LYS 65 1HZ LYS 65 -12.378 6.914 -5.683 582 HZ3 LYS 65 2HZ LYS 65 -11.968 6.766 -4.054 583 H GLU 66 H GLU 66 -11.583 2.805 -0.357 584 HA GLU 66 HA GLU 66 -12.316 4.665 1.600 585 HB2 GLU 66 2HB GLU 66 -12.451 1.621 1.820 586 HB3 GLU 66 3HB GLU 66 -13.353 2.769 2.809 587 HG2 GLU 66 2HG GLU 66 -13.674 2.233 -0.151 588 HG3 GLU 66 3HG GLU 66 -14.827 1.887 1.138 589 H MET 67 H MET 67 -9.842 2.150 1.606 590 HA MET 67 HA MET 67 -8.970 2.112 4.213 591 HB2 MET 67 2HB MET 67 -8.158 0.664 2.266 592 HB3 MET 67 3HB MET 67 -7.136 2.002 1.773 593 HG2 MET 67 2HG MET 67 -5.688 0.599 2.944 594 HG3 MET 67 3HG MET 67 -6.105 1.811 4.148 595 HE1 MET 67 3HE MET 67 -7.851 -2.472 4.057 596 HE2 MET 67 1HE MET 67 -6.667 -1.869 2.894 597 HE3 MET 67 2HE MET 67 -8.318 -1.245 2.882 598 H LEU 68 H LEU 68 -7.586 4.106 1.569 599 HA LEU 68 HA LEU 68 -5.692 5.423 3.210 600 HB2 LEU 68 2HB LEU 68 -6.712 6.284 0.476 601 HB3 LEU 68 3HB LEU 68 -5.211 6.805 1.236 602 HG LEU 68 HG LEU 68 -5.872 4.004 0.261 603 HD11 LEU 68 1HD1 LEU 68 -3.814 5.976 -0.739 604 HD12 LEU 68 2HD1 LEU 68 -5.330 5.544 -1.537 605 HD13 LEU 68 3HD1 LEU 68 -4.067 4.333 -1.337 606 HD21 LEU 68 3HD2 LEU 68 -4.564 3.789 2.285 607 HD22 LEU 68 1HD2 LEU 68 -3.368 4.939 1.677 608 HD23 LEU 68 2HD2 LEU 68 -3.578 3.375 0.889 609 H GLU 69 H GLU 69 -8.927 6.322 2.157 610 HA GLU 69 HA GLU 69 -8.912 9.034 3.050 611 HB2 GLU 69 2HB GLU 69 -11.207 7.094 2.545 612 HB3 GLU 69 3HB GLU 69 -11.426 8.816 2.870 613 HG2 GLU 69 2HG GLU 69 -10.236 9.414 0.845 614 HG3 GLU 69 3HG GLU 69 -9.799 7.731 0.555 615 H LEU 70 H LEU 70 -9.824 5.971 4.598 616 HA LEU 70 HA LEU 70 -10.687 7.123 7.076 617 HB2 LEU 70 2HB LEU 70 -9.860 4.301 6.310 618 HB3 LEU 70 3HB LEU 70 -10.367 4.717 7.939 619 HG LEU 70 HG LEU 70 -12.119 5.060 5.470 620 HD11 LEU 70 1HD1 LEU 70 -13.364 3.092 6.242 621 HD12 LEU 70 2HD1 LEU 70 -12.208 2.857 7.556 622 HD13 LEU 70 3HD1 LEU 70 -11.687 2.687 5.880 623 HD21 LEU 70 3HD2 LEU 70 -12.678 6.623 7.281 624 HD22 LEU 70 1HD2 LEU 70 -12.822 5.277 8.418 625 HD23 LEU 70 2HD2 LEU 70 -13.947 5.423 7.063 626 H ILE 71 H ILE 71 -7.570 5.961 5.852 627 HA ILE 71 HA ILE 71 -6.092 6.054 8.282 628 HB ILE 71 HB ILE 71 -5.070 6.384 5.414 629 HG12 ILE 71 2HG1 ILE 71 -5.102 3.859 7.139 630 HG13 ILE 71 3HG1 ILE 71 -6.290 4.214 5.898 631 HG21 ILE 71 1HG2 ILE 71 -3.408 7.216 7.021 632 HG22 ILE 71 2HG2 ILE 71 -2.856 5.700 6.314 633 HG23 ILE 71 3HG2 ILE 71 -3.516 5.717 7.949 634 HD11 ILE 71 3HD1 ILE 71 -3.338 3.799 5.443 635 HD12 ILE 71 1HD1 ILE 71 -4.533 4.164 4.194 636 HD13 ILE 71 2HD1 ILE 71 -4.631 2.651 5.093 637 H SER 72 H SER 72 -6.864 8.459 5.809 638 HA SER 72 HA SER 72 -5.317 10.624 6.769 639 HB2 SER 72 2HB SER 72 -7.955 10.648 5.245 640 HB3 SER 72 3HB SER 72 -6.864 12.027 5.419 641 HG SER 72 HG SER 72 -5.712 9.699 4.438 642 H LYS 73 H LYS 73 -8.470 9.320 7.692 643 HA LYS 73 HA LYS 73 -9.163 11.466 9.508 644 HB2 LYS 73 2HB LYS 73 -10.361 8.674 9.172 645 HB3 LYS 73 3HB LYS 73 -11.035 9.938 10.195 646 HG2 LYS 73 2HG LYS 73 -10.754 10.073 7.174 647 HG3 LYS 73 3HG LYS 73 -12.246 9.755 8.065 648 HD2 LYS 73 2HD LYS 73 -12.126 11.996 9.091 649 HD3 LYS 73 3HD LYS 73 -10.610 12.317 8.247 650 HE2 LYS 73 2HE LYS 73 -12.470 13.421 7.118 651 HE3 LYS 73 3HE LYS 73 -11.801 12.165 6.080 652 HZ1 LYS 73 3HZ LYS 73 -14.259 11.935 7.727 653 HZ2 LYS 73 1HZ LYS 73 -13.623 10.717 6.746 654 HZ3 LYS 73 2HZ LYS 73 -14.201 12.143 6.057 655 H LEU 74 H LEU 74 -7.414 8.442 9.689 656 HA LEU 74 HA LEU 74 -7.284 8.300 12.578 657 HB2 LEU 74 2HB LEU 74 -5.605 6.880 10.464 658 HB3 LEU 74 3HB LEU 74 -5.603 6.502 12.180 659 HG LEU 74 HG LEU 74 -7.935 6.109 10.264 660 HD11 LEU 74 1HD1 LEU 74 -6.150 4.489 9.908 661 HD12 LEU 74 2HD1 LEU 74 -7.568 3.710 10.603 662 HD13 LEU 74 3HD1 LEU 74 -6.165 4.055 11.621 663 HD21 LEU 74 3HD2 LEU 74 -8.784 6.711 12.473 664 HD22 LEU 74 1HD2 LEU 74 -7.797 5.454 13.222 665 HD23 LEU 74 2HD2 LEU 74 -9.112 5.016 12.127 666 H GLY 75 H GLY 75 -5.498 9.862 10.039 667 HA2 GLY 75 2HA GLY 75 -4.042 11.649 10.199 668 HA3 GLY 75 3HA GLY 75 -3.948 11.420 11.938 669 H TYR 76 H TYR 76 -3.327 8.964 9.470 670 HA TYR 76 HA TYR 76 -0.435 8.955 10.170 671 HB2 TYR 76 2HB TYR 76 -2.075 6.626 9.078 672 HB3 TYR 76 3HB TYR 76 -0.377 6.568 9.536 673 HD1 TYR 76 HD1 TYR 76 -0.301 7.892 12.148 674 HD2 TYR 76 HD2 TYR 76 -3.240 5.217 10.574 675 HE1 TYR 76 HE1 TYR 76 -0.932 7.241 14.429 676 HE2 TYR 76 HE2 TYR 76 -3.870 4.571 12.862 677 HH TYR 76 HH TYR 76 -3.014 6.307 15.561 678 H LYS 77 H LYS 77 1.032 8.343 8.422 679 HA LYS 77 HA LYS 77 0.202 9.486 5.825 680 HB2 LYS 77 2HB LYS 77 2.155 10.486 7.229 681 HB3 LYS 77 3HB LYS 77 3.075 9.065 6.775 682 HG2 LYS 77 2HG LYS 77 1.841 10.907 4.703 683 HG3 LYS 77 3HG LYS 77 3.425 11.222 5.407 684 HD2 LYS 77 2HD LYS 77 4.272 9.093 4.530 685 HD3 LYS 77 3HD LYS 77 2.674 8.690 3.898 686 HE2 LYS 77 2HE LYS 77 4.110 9.490 2.100 687 HE3 LYS 77 3HE LYS 77 2.804 10.646 2.375 688 HZ1 LYS 77 3HZ LYS 77 4.928 11.745 2.075 689 HZ2 LYS 77 1HZ LYS 77 5.589 10.906 3.381 690 HZ3 LYS 77 2HZ LYS 77 4.346 12.017 3.634 691 H VAL 78 H VAL 78 0.335 8.289 4.022 692 HA VAL 78 HA VAL 78 1.020 5.412 4.194 693 HB VAL 78 HB VAL 78 -0.820 6.807 2.183 694 HG11 VAL 78 1HG1 VAL 78 -1.533 4.557 1.513 695 HG12 VAL 78 2HG1 VAL 78 -0.409 3.828 2.659 696 HG13 VAL 78 3HG1 VAL 78 0.205 4.745 1.282 697 HG21 VAL 78 3HG2 VAL 78 -1.587 5.160 4.619 698 HG22 VAL 78 1HG2 VAL 78 -2.704 5.768 3.393 699 HG23 VAL 78 2HG2 VAL 78 -1.813 6.900 4.412 700 H PHE 79 H PHE 79 2.511 4.573 2.818 701 HA PHE 79 HA PHE 79 3.422 6.135 0.464 702 HB2 PHE 79 2HB PHE 79 4.789 3.872 1.996 703 HB3 PHE 79 3HB PHE 79 5.387 4.553 0.491 704 HD1 PHE 79 HD2 PHE 79 4.717 5.336 4.074 705 HD2 PHE 79 HD1 PHE 79 6.691 6.570 0.484 706 HE1 PHE 79 HE2 PHE 79 5.966 7.038 5.338 707 HE2 PHE 79 HE1 PHE 79 7.931 8.264 1.760 708 HZ PHE 79 HZ PHE 79 7.572 8.502 4.182 709 H LEU 80 H LEU 80 2.494 5.412 -1.363 710 HA LEU 80 HA LEU 80 1.146 2.769 -1.330 711 HB2 LEU 80 2HB LEU 80 -0.449 4.603 -1.370 712 HB3 LEU 80 3HB LEU 80 0.381 5.371 -2.711 713 HG LEU 80 HG LEU 80 -0.316 3.530 -4.223 714 HD11 LEU 80 1HD1 LEU 80 -0.415 1.671 -2.665 715 HD12 LEU 80 2HD1 LEU 80 -1.932 1.833 -3.542 716 HD13 LEU 80 3HD1 LEU 80 -1.819 2.381 -1.867 717 HD21 LEU 80 3HD2 LEU 80 -2.723 4.038 -4.335 718 HD22 LEU 80 1HD2 LEU 80 -1.758 5.489 -4.069 719 HD23 LEU 80 2HD2 LEU 80 -2.648 4.767 -2.728 720 H LEU 81 H LEU 81 1.958 1.301 -2.656 721 HA LEU 81 HA LEU 81 3.247 2.110 -5.182 722 HB2 LEU 81 2HB LEU 81 4.611 0.648 -3.646 723 HB3 LEU 81 3HB LEU 81 3.379 -0.600 -3.785 724 HG LEU 81 HG LEU 81 3.822 -0.807 -6.211 725 HD11 LEU 81 1HD1 LEU 81 5.725 0.377 -7.262 726 HD12 LEU 81 2HD1 LEU 81 5.906 1.356 -5.805 727 HD13 LEU 81 3HD1 LEU 81 4.429 1.462 -6.765 728 HD21 LEU 81 3HD2 LEU 81 5.122 -2.230 -4.702 729 HD22 LEU 81 1HD2 LEU 81 6.377 -0.993 -4.583 730 HD23 LEU 81 2HD2 LEU 81 6.065 -1.797 -6.125 731 H LEU 82 H LEU 82 1.805 2.131 -6.763 732 HA LEU 82 HA LEU 82 -0.272 0.048 -6.958 733 HB2 LEU 82 2HB LEU 82 0.121 2.693 -8.420 734 HB3 LEU 82 3HB LEU 82 -1.130 1.534 -8.833 735 HG LEU 82 HG LEU 82 -0.923 3.015 -6.184 736 HD11 LEU 82 1HD1 LEU 82 -2.893 4.272 -6.921 737 HD12 LEU 82 2HD1 LEU 82 -2.879 3.433 -8.475 738 HD13 LEU 82 3HD1 LEU 82 -1.550 4.510 -8.040 739 HD21 LEU 82 3HD2 LEU 82 -3.130 2.066 -5.700 740 HD22 LEU 82 1HD2 LEU 82 -1.919 0.801 -5.904 741 HD23 LEU 82 2HD2 LEU 82 -3.075 1.132 -7.198 742 H GLN 83 H GLN 83 0.425 -1.704 -8.024 743 HA GLN 83 HA GLN 83 2.174 -1.445 -10.396 744 HB2 GLN 83 2HB GLN 83 3.004 -2.927 -8.504 745 HB3 GLN 83 3HB GLN 83 1.606 -3.965 -8.764 746 HG2 GLN 83 2HG GLN 83 2.380 -4.330 -11.119 747 HG3 GLN 83 3HG GLN 83 3.831 -3.398 -10.751 748 HE21 GLN 83 1HE2 GLN 83 3.670 -6.110 -11.658 749 HE22 GLN 83 2HE2 GLN 83 4.427 -7.089 -10.457 750 H ASP 84 H ASP 84 1.074 -1.548 -12.247 751 HA ASP 84 HA ASP 84 -1.155 -3.455 -12.567 752 HB2 ASP 84 2HB ASP 84 -2.025 -1.073 -12.051 753 HB3 ASP 84 3HB ASP 84 -1.356 -0.587 -13.604 754 H GLN 85 H GLN 85 -1.720 -3.643 -14.976 755 HA GLN 85 HA GLN 85 0.779 -4.010 -16.474 756 HB2 GLN 85 2HB GLN 85 -2.062 -4.984 -16.969 757 HB3 GLN 85 3HB GLN 85 -0.691 -5.367 -18.008 758 HG2 GLN 85 2HG GLN 85 0.401 -6.561 -16.140 759 HG3 GLN 85 3HG GLN 85 -0.952 -6.149 -15.084 760 HE21 GLN 85 1HE2 GLN 85 -1.389 -8.348 -14.685 761 HE22 GLN 85 2HE2 GLN 85 -2.128 -9.369 -15.868 762 H ASP 86 H ASP 86 -1.790 -1.772 -16.330 763 HA ASP 86 HA ASP 86 -1.046 -0.592 -18.957 764 HB2 ASP 86 2HB ASP 86 -3.451 -1.430 -18.745 765 HB3 ASP 86 3HB ASP 86 -3.713 -0.215 -17.503 766 H GLU 87 H GLU 87 0.018 1.275 -18.763 767 HA GLU 87 HA GLU 87 0.453 2.511 -16.205 768 HB2 GLU 87 2HB GLU 87 1.539 3.271 -18.948 769 HB3 GLU 87 3HB GLU 87 2.092 3.927 -17.407 770 HG2 GLU 87 2HG GLU 87 2.767 1.609 -16.729 771 HG3 GLU 87 3HG GLU 87 2.337 1.058 -18.346 772 H ASN 88 H ASN 88 -1.638 3.257 -18.934 773 HA ASN 88 HA ASN 88 -1.940 6.072 -18.377 774 HB2 ASN 88 2HB ASN 88 -3.756 4.172 -19.927 775 HB3 ASN 88 3HB ASN 88 -4.019 5.906 -19.817 776 HD21 ASN 88 1HD2 ASN 88 -2.106 3.398 -21.235 777 HD22 ASN 88 2HD2 ASN 88 -1.253 4.397 -22.357 778 H GLU 89 H GLU 89 -3.877 3.174 -17.618 779 HA GLU 89 HA GLU 89 -5.891 4.514 -16.079 780 HB2 GLU 89 2HB GLU 89 -5.081 1.569 -15.938 781 HB3 GLU 89 3HB GLU 89 -6.596 2.265 -15.370 782 HG2 GLU 89 2HG GLU 89 -5.672 2.055 -18.247 783 HG3 GLU 89 3HG GLU 89 -6.932 1.095 -17.477 784 H LEU 90 H LEU 90 -2.831 2.992 -15.406 785 HA LEU 90 HA LEU 90 -2.789 2.953 -12.602 786 HB2 LEU 90 2HB LEU 90 -1.239 1.714 -14.050 787 HB3 LEU 90 3HB LEU 90 -0.569 3.212 -14.664 788 HG LEU 90 HG LEU 90 0.557 3.663 -12.579 789 HD11 LEU 90 1HD1 LEU 90 -0.915 1.283 -11.440 790 HD12 LEU 90 2HD1 LEU 90 -1.119 2.987 -11.002 791 HD13 LEU 90 3HD1 LEU 90 0.393 2.161 -10.640 792 HD21 LEU 90 3HD2 LEU 90 1.725 2.120 -14.090 793 HD22 LEU 90 1HD2 LEU 90 0.930 0.735 -13.333 794 HD23 LEU 90 2HD2 LEU 90 2.074 1.715 -12.412 795 H GLU 91 H GLU 91 -1.768 5.437 -14.941 796 HA GLU 91 HA GLU 91 -0.671 7.297 -13.084 797 HB2 GLU 91 2HB GLU 91 0.027 7.346 -15.412 798 HB3 GLU 91 3HB GLU 91 -1.625 7.579 -15.968 799 HG2 GLU 91 2HG GLU 91 -0.325 9.645 -16.155 800 HG3 GLU 91 3HG GLU 91 -1.658 9.837 -15.020 801 H GLU 92 H GLU 92 -3.776 7.171 -14.826 802 HA GLU 92 HA GLU 92 -4.906 9.545 -13.878 803 HB2 GLU 92 2HB GLU 92 -6.256 6.999 -14.861 804 HB3 GLU 92 3HB GLU 92 -7.113 8.513 -14.567 805 HG2 GLU 92 2HG GLU 92 -5.719 9.637 -16.263 806 HG3 GLU 92 3HG GLU 92 -4.859 8.129 -16.560 807 H PHE 93 H PHE 93 -5.220 6.233 -12.583 808 HA PHE 93 HA PHE 93 -6.982 6.944 -10.445 809 HB2 PHE 93 2HB PHE 93 -6.835 4.629 -11.356 810 HB3 PHE 93 3HB PHE 93 -5.194 4.483 -10.738 811 HD1 PHE 93 HD1 PHE 93 -8.649 5.344 -9.505 812 HD2 PHE 93 HD2 PHE 93 -4.942 3.371 -8.668 813 HE1 PHE 93 HE1 PHE 93 -9.562 4.517 -7.375 814 HE2 PHE 93 HE2 PHE 93 -5.868 2.551 -6.543 815 HZ PHE 93 HZ PHE 93 -8.175 3.123 -5.895 816 H LYS 94 H LYS 94 -3.466 6.675 -10.789 817 HA LYS 94 HA LYS 94 -2.658 6.866 -8.114 818 HB2 LYS 94 2HB LYS 94 -1.023 6.277 -9.786 819 HB3 LYS 94 3HB LYS 94 -1.295 7.772 -10.678 820 HG2 LYS 94 2HG LYS 94 -0.283 9.071 -8.833 821 HG3 LYS 94 3HG LYS 94 -0.058 7.590 -7.916 822 HD2 LYS 94 2HD LYS 94 2.052 8.171 -8.901 823 HD3 LYS 94 3HD LYS 94 1.445 6.741 -9.740 824 HE2 LYS 94 2HE LYS 94 2.363 8.300 -11.358 825 HE3 LYS 94 3HE LYS 94 0.617 8.219 -11.574 826 HZ1 LYS 94 3HZ LYS 94 1.381 10.475 -11.694 827 HZ2 LYS 94 1HZ LYS 94 2.122 10.364 -10.177 828 HZ3 LYS 94 2HZ LYS 94 0.442 10.290 -10.302 829 H ARG 95 H ARG 95 -3.163 9.456 -10.530 830 HA ARG 95 HA ARG 95 -2.113 11.524 -8.901 831 HB2 ARG 95 2HB ARG 95 -2.772 13.070 -10.659 832 HB3 ARG 95 3HB ARG 95 -2.041 11.630 -11.352 833 HG2 ARG 95 2HG ARG 95 -4.376 10.800 -11.864 834 HG3 ARG 95 3HG ARG 95 -4.980 12.377 -11.347 835 HD2 ARG 95 2HD ARG 95 -3.097 11.819 -13.673 836 HD3 ARG 95 3HD ARG 95 -4.781 12.336 -13.770 837 HE ARG 95 HE ARG 95 -3.042 14.163 -12.349 838 HH11 ARG 95 1HH1 ARG 95 -4.346 13.354 -15.527 839 HH12 ARG 95 2HH1 ARG 95 -4.062 14.942 -16.168 840 HH21 ARG 95 1HH2 ARG 95 -2.686 16.233 -13.208 841 HH22 ARG 95 2HH2 ARG 95 -3.125 16.568 -14.857 842 H LYS 96 H LYS 96 -5.316 10.204 -9.146 843 HA LYS 96 HA LYS 96 -6.839 12.218 -7.860 844 HB2 LYS 96 2HB LYS 96 -7.175 9.190 -7.644 845 HB3 LYS 96 3HB LYS 96 -8.414 10.390 -7.293 846 HG2 LYS 96 2HG LYS 96 -8.489 11.034 -9.666 847 HG3 LYS 96 3HG LYS 96 -7.200 9.881 -10.026 848 HD2 LYS 96 2HD LYS 96 -8.749 8.048 -9.132 849 HD3 LYS 96 3HD LYS 96 -10.034 9.260 -9.100 850 HE2 LYS 96 2HE LYS 96 -8.485 8.379 -11.560 851 HE3 LYS 96 3HE LYS 96 -10.119 7.874 -11.138 852 HZ1 LYS 96 3HZ LYS 96 -10.114 9.623 -12.789 853 HZ2 LYS 96 1HZ LYS 96 -9.279 10.652 -11.740 854 HZ3 LYS 96 2HZ LYS 96 -10.849 10.156 -11.365 855 H ILE 97 H ILE 97 -4.936 9.528 -6.629 856 HA ILE 97 HA ILE 97 -5.528 9.963 -3.813 857 HB ILE 97 HB ILE 97 -3.601 8.042 -5.203 858 HG12 ILE 97 2HG1 ILE 97 -6.413 7.431 -4.173 859 HG13 ILE 97 3HG1 ILE 97 -6.066 7.828 -5.852 860 HG21 ILE 97 1HG2 ILE 97 -4.675 7.985 -2.360 861 HG22 ILE 97 2HG2 ILE 97 -3.012 8.334 -2.843 862 HG23 ILE 97 3HG2 ILE 97 -3.689 6.727 -3.106 863 HD11 ILE 97 3HD1 ILE 97 -4.624 5.871 -6.017 864 HD12 ILE 97 1HD1 ILE 97 -6.270 5.456 -5.550 865 HD13 ILE 97 2HD1 ILE 97 -4.991 5.462 -4.338 866 H GLU 98 H GLU 98 -3.057 10.744 -6.089 867 HA GLU 98 HA GLU 98 -0.804 11.215 -4.450 868 HB2 GLU 98 2HB GLU 98 -0.750 10.825 -6.878 869 HB3 GLU 98 3HB GLU 98 -1.617 12.326 -7.171 870 HG2 GLU 98 2HG GLU 98 0.311 13.612 -6.398 871 HG3 GLU 98 3HG GLU 98 1.169 12.121 -5.999 872 H SER 99 H SER 99 -3.647 13.066 -5.161 873 HA SER 99 HA SER 99 -2.840 15.678 -4.406 874 HB2 SER 99 2HB SER 99 -4.852 15.245 -5.755 875 HB3 SER 99 3HB SER 99 -5.588 14.358 -4.422 876 HG SER 99 HG SER 99 -6.015 16.189 -3.409 877 H GLN 100 H GLN 100 -3.494 12.862 -2.500 878 HA GLN 100 HA GLN 100 -4.344 14.248 -0.085 879 HB2 GLN 100 2HB GLN 100 -3.678 11.313 -0.572 880 HB3 GLN 100 3HB GLN 100 -4.385 11.957 0.907 881 HG2 GLN 100 2HG GLN 100 -6.382 12.679 -0.397 882 HG3 GLN 100 3HG GLN 100 -5.679 11.951 -1.840 883 HE21 GLN 100 1HE2 GLN 100 -5.553 9.656 -1.950 884 HE22 GLN 100 2HE2 GLN 100 -6.523 8.644 -0.945 885 H GLY 101 H GLY 101 -1.376 13.982 -1.499 886 HA2 GLY 101 2HA GLY 101 0.725 14.548 -0.717 887 HA3 GLY 101 3HA GLY 101 0.055 14.698 0.901 888 H TYR 102 H TYR 102 -0.265 11.820 -1.035 889 HA TYR 102 HA TYR 102 1.627 10.329 0.696 890 HB2 TYR 102 2HB TYR 102 -0.692 9.297 -1.009 891 HB3 TYR 102 3HB TYR 102 0.376 8.290 -0.036 892 HD1 TYR 102 HD1 TYR 102 0.443 10.214 2.425 893 HD2 TYR 102 HD2 TYR 102 -2.764 8.627 0.075 894 HE1 TYR 102 HE1 TYR 102 -1.056 10.381 4.360 895 HE2 TYR 102 HE2 TYR 102 -4.266 8.803 2.022 896 HH TYR 102 HH TYR 102 -3.450 10.543 4.833 897 H GLU 103 H GLU 103 3.495 9.617 -0.261 898 HA GLU 103 HA GLU 103 4.061 10.056 -3.008 899 HB2 GLU 103 2HB GLU 103 5.559 8.433 -0.912 900 HB3 GLU 103 3HB GLU 103 6.112 8.567 -2.576 901 HG2 GLU 103 2HG GLU 103 7.377 10.184 -1.471 902 HG3 GLU 103 3HG GLU 103 6.080 11.119 -2.204 903 H VAL 104 H VAL 104 2.660 9.060 -4.360 904 HA VAL 104 HA VAL 104 2.322 6.133 -4.246 905 HB VAL 104 HB VAL 104 0.885 8.068 -6.125 906 HG11 VAL 104 1HG1 VAL 104 -0.726 6.204 -6.382 907 HG12 VAL 104 2HG1 VAL 104 0.255 5.201 -5.311 908 HG13 VAL 104 3HG1 VAL 104 0.904 5.730 -6.864 909 HG21 VAL 104 3HG2 VAL 104 -0.129 7.062 -3.432 910 HG22 VAL 104 1HG2 VAL 104 -1.072 7.981 -4.612 911 HG23 VAL 104 2HG2 VAL 104 0.320 8.723 -3.822 912 H ARG 105 H ARG 105 3.193 4.853 -5.831 913 HA ARG 105 HA ARG 105 4.859 6.151 -7.932 914 HB2 ARG 105 2HB ARG 105 6.056 4.988 -5.996 915 HB3 ARG 105 3HB ARG 105 5.378 3.475 -6.569 916 HG2 ARG 105 2HG ARG 105 7.608 3.589 -7.364 917 HG3 ARG 105 3HG ARG 105 6.574 3.867 -8.762 918 HD2 ARG 105 2HD ARG 105 7.313 6.030 -9.033 919 HD3 ARG 105 3HD ARG 105 7.484 6.317 -7.300 920 HE ARG 105 HE ARG 105 9.506 5.386 -9.128 921 HH11 ARG 105 1HH1 ARG 105 8.559 5.421 -5.725 922 HH12 ARG 105 2HH1 ARG 105 10.174 5.143 -5.163 923 HH21 ARG 105 1HH2 ARG 105 11.611 4.940 -8.331 924 HH22 ARG 105 2HH2 ARG 105 11.882 4.873 -6.617 925 H LYS 106 H LYS 106 4.891 5.214 -9.962 926 HA LYS 106 HA LYS 106 2.951 3.109 -10.643 927 HB2 LYS 106 2HB LYS 106 4.771 4.806 -12.424 928 HB3 LYS 106 3HB LYS 106 3.541 3.676 -12.991 929 HG2 LYS 106 2HG LYS 106 1.782 5.087 -11.966 930 HG3 LYS 106 3HG LYS 106 3.025 6.213 -11.410 931 HD2 LYS 106 2HD LYS 106 2.007 7.092 -13.436 932 HD3 LYS 106 3HD LYS 106 3.676 6.637 -13.783 933 HE2 LYS 106 2HE LYS 106 2.895 4.554 -14.834 934 HE3 LYS 106 3HE LYS 106 1.222 4.976 -14.446 935 HZ1 LYS 106 3HZ LYS 106 1.507 6.988 -15.821 936 HZ2 LYS 106 1HZ LYS 106 1.685 5.561 -16.705 937 HZ3 LYS 106 2HZ LYS 106 3.045 6.459 -16.270 938 H VAL 107 H VAL 107 3.621 1.070 -11.218 939 HA VAL 107 HA VAL 107 6.260 0.636 -12.313 940 HB VAL 107 HB VAL 107 6.673 0.418 -9.863 941 HG11 VAL 107 1HG1 VAL 107 5.805 -1.469 -8.570 942 HG12 VAL 107 2HG1 VAL 107 4.800 -1.961 -9.934 943 HG13 VAL 107 3HG1 VAL 107 4.499 -0.420 -9.128 944 HG21 VAL 107 3HG2 VAL 107 7.022 -2.180 -11.403 945 HG22 VAL 107 1HG2 VAL 107 7.920 -1.703 -9.959 946 HG23 VAL 107 2HG2 VAL 107 8.102 -0.783 -11.451 947 H THR 108 H THR 108 6.344 -1.098 -13.633 948 HA THR 108 HA THR 108 3.945 -2.803 -13.992 949 HB THR 108 HB THR 108 4.690 -2.841 -16.483 950 HG1 THR 108 HG1 THR 108 6.309 -1.593 -17.038 951 HG21 THR 108 3HG2 THR 108 3.525 -0.745 -17.045 952 HG22 THR 108 1HG2 THR 108 3.660 -0.198 -15.372 953 HG23 THR 108 2HG2 THR 108 2.668 -1.605 -15.768 954 H ASP 109 H ASP 109 7.447 -2.526 -13.898 955 HA ASP 109 HA ASP 109 8.008 -5.262 -14.641 956 HB2 ASP 109 2HB ASP 109 9.802 -3.151 -13.354 957 HB3 ASP 109 3HB ASP 109 10.349 -4.710 -13.970 958 H ASP 110 H ASP 110 8.120 -6.944 -13.300 959 HA ASP 110 HA ASP 110 6.978 -6.805 -10.703 960 HB2 ASP 110 2HB ASP 110 8.466 -9.144 -11.977 961 HB3 ASP 110 3HB ASP 110 7.306 -9.234 -10.654 962 H GLU 111 H GLU 111 10.298 -7.313 -11.869 963 HA GLU 111 HA GLU 111 11.499 -7.831 -9.342 964 HB2 GLU 111 2HB GLU 111 13.655 -7.483 -10.506 965 HB3 GLU 111 3HB GLU 111 12.579 -8.522 -11.431 966 HG2 GLU 111 2HG GLU 111 12.036 -6.662 -12.938 967 HG3 GLU 111 3HG GLU 111 13.047 -5.577 -11.988 968 H GLU 112 H GLU 112 10.912 -4.904 -11.206 969 HA GLU 112 HA GLU 112 12.504 -3.113 -9.661 970 HB2 GLU 112 2HB GLU 112 11.731 -2.717 -12.046 971 HB3 GLU 112 3HB GLU 112 10.111 -2.424 -11.430 972 HG2 GLU 112 2HG GLU 112 11.197 -0.307 -11.867 973 HG3 GLU 112 3HG GLU 112 10.979 -0.490 -10.127 974 H ALA 113 H ALA 113 9.119 -4.137 -9.586 975 HA ALA 113 HA ALA 113 7.981 -2.331 -7.817 976 HB1 ALA 113 3HB ALA 113 7.352 -5.291 -8.089 977 HB2 ALA 113 1HB ALA 113 6.693 -3.994 -9.088 978 HB3 ALA 113 2HB ALA 113 6.298 -4.069 -7.368 979 H LEU 114 H LEU 114 9.655 -5.388 -7.082 980 HA LEU 114 HA LEU 114 9.389 -5.519 -4.301 981 HB2 LEU 114 2HB LEU 114 11.792 -6.361 -5.976 982 HB3 LEU 114 3HB LEU 114 11.440 -6.936 -4.352 983 HG LEU 114 HG LEU 114 9.683 -7.473 -6.785 984 HD11 LEU 114 1HD1 LEU 114 11.652 -9.344 -5.433 985 HD12 LEU 114 2HD1 LEU 114 11.877 -8.569 -7.006 986 HD13 LEU 114 3HD1 LEU 114 10.578 -9.735 -6.779 987 HD21 LEU 114 3HD2 LEU 114 8.573 -9.141 -5.347 988 HD22 LEU 114 1HD2 LEU 114 8.415 -7.512 -4.692 989 HD23 LEU 114 2HD2 LEU 114 9.572 -8.638 -3.980 990 H LYS 115 H LYS 115 11.858 -3.949 -6.281 991 HA LYS 115 HA LYS 115 13.593 -2.989 -4.296 992 HB2 LYS 115 2HB LYS 115 14.292 -3.157 -6.612 993 HB3 LYS 115 3HB LYS 115 12.998 -2.092 -7.144 994 HG2 LYS 115 2HG LYS 115 14.099 -0.216 -5.909 995 HG3 LYS 115 3HG LYS 115 15.440 -1.303 -5.528 996 HD2 LYS 115 2HD LYS 115 15.953 -1.568 -7.913 997 HD3 LYS 115 3HD LYS 115 14.530 -0.620 -8.352 998 HE2 LYS 115 2HE LYS 115 15.579 1.334 -7.117 999 HE3 LYS 115 3HE LYS 115 17.046 0.362 -6.980 1000 HZ1 LYS 115 3HZ LYS 115 17.145 1.833 -8.881 1001 HZ2 LYS 115 1HZ LYS 115 15.725 1.169 -9.518 1002 HZ3 LYS 115 2HZ LYS 115 17.124 0.226 -9.397 1003 H ILE 116 H ILE 116 10.756 -1.495 -5.887 1004 HA ILE 116 HA ILE 116 11.077 1.105 -4.785 1005 HB ILE 116 HB ILE 116 8.445 -0.111 -5.749 1006 HG12 ILE 116 2HG1 ILE 116 10.064 -0.373 -7.562 1007 HG13 ILE 116 3HG1 ILE 116 8.943 0.904 -7.984 1008 HG21 ILE 116 1HG2 ILE 116 7.785 2.211 -6.210 1009 HG22 ILE 116 2HG2 ILE 116 9.325 2.796 -5.581 1010 HG23 ILE 116 3HG2 ILE 116 8.180 1.991 -4.505 1011 HD11 ILE 116 3HD1 ILE 116 10.656 2.572 -7.438 1012 HD12 ILE 116 1HD1 ILE 116 11.201 1.433 -8.668 1013 HD13 ILE 116 2HD1 ILE 116 11.776 1.277 -7.009 1014 H VAL 117 H VAL 117 9.237 -1.754 -3.721 1015 HA VAL 117 HA VAL 117 7.823 -0.694 -1.533 1016 HB VAL 117 HB VAL 117 9.083 -3.477 -1.739 1017 HG11 VAL 117 1HG1 VAL 117 8.431 -2.988 0.574 1018 HG12 VAL 117 2HG1 VAL 117 7.347 -4.193 -0.119 1019 HG13 VAL 117 3HG1 VAL 117 6.810 -2.518 0.049 1020 HG21 VAL 117 3HG2 VAL 117 7.594 -3.035 -3.629 1021 HG22 VAL 117 1HG2 VAL 117 6.293 -2.585 -2.529 1022 HG23 VAL 117 2HG2 VAL 117 6.895 -4.245 -2.557 1023 H ARG 118 H ARG 118 11.110 -1.980 -1.782 1024 HA ARG 118 HA ARG 118 11.770 -1.800 0.980 1025 HB2 ARG 118 2HB ARG 118 13.601 -2.036 -1.445 1026 HB3 ARG 118 3HB ARG 118 14.095 -2.294 0.231 1027 HG2 ARG 118 2HG ARG 118 12.546 -4.200 0.418 1028 HG3 ARG 118 3HG ARG 118 11.983 -3.921 -1.229 1029 HD2 ARG 118 2HD ARG 118 13.497 -5.760 -1.311 1030 HD3 ARG 118 3HD ARG 118 14.348 -4.383 -2.013 1031 HE ARG 118 HE ARG 118 15.350 -4.174 0.348 1032 HH11 ARG 118 1HH1 ARG 118 14.578 -7.275 -1.161 1033 HH12 ARG 118 2HH1 ARG 118 15.796 -8.134 -0.266 1034 HH21 ARG 118 1HH2 ARG 118 16.902 -5.339 1.524 1035 HH22 ARG 118 2HH2 ARG 118 17.106 -7.042 1.247 1036 H GLU 119 H GLU 119 11.910 0.501 -1.669 1037 HA GLU 119 HA GLU 119 13.467 2.504 -0.335 1038 HB2 GLU 119 2HB GLU 119 11.327 2.894 -2.478 1039 HB3 GLU 119 3HB GLU 119 12.500 4.102 -1.950 1040 HG2 GLU 119 2HG GLU 119 14.320 2.518 -2.745 1041 HG3 GLU 119 3HG GLU 119 13.037 1.549 -3.478 1042 H PHE 120 H PHE 120 9.958 1.966 -0.712 1043 HA PHE 120 HA PHE 120 8.986 4.133 0.727 1044 HB2 PHE 120 2HB PHE 120 7.810 1.374 0.233 1045 HB3 PHE 120 3HB PHE 120 6.916 2.613 1.107 1046 HD1 PHE 120 HD2 PHE 120 7.760 5.049 -0.492 1047 HD2 PHE 120 HD1 PHE 120 6.455 1.164 -1.727 1048 HE1 PHE 120 HE2 PHE 120 6.881 5.999 -2.576 1049 HE2 PHE 120 HE1 PHE 120 5.584 2.143 -3.808 1050 HZ PHE 120 HZ PHE 120 5.788 4.551 -4.226 1051 H MET 121 H MET 121 9.894 0.932 1.904 1052 HA MET 121 HA MET 121 9.205 1.319 4.621 1053 HB2 MET 121 2HB MET 121 11.248 -0.562 3.361 1054 HB3 MET 121 3HB MET 121 10.780 -0.611 5.058 1055 HG2 MET 121 2HG MET 121 8.410 -1.012 4.314 1056 HG3 MET 121 3HG MET 121 9.017 -1.177 2.666 1057 HE1 MET 121 3HE MET 121 10.604 -3.188 1.866 1058 HE2 MET 121 1HE MET 121 11.268 -4.393 2.969 1059 HE3 MET 121 2HE MET 121 11.796 -2.715 3.080 1060 H GLN 122 H GLN 122 12.208 1.929 2.823 1061 HA GLN 122 HA GLN 122 13.880 2.616 5.008 1062 HB2 GLN 122 2HB GLN 122 14.698 2.028 2.710 1063 HB3 GLN 122 3HB GLN 122 14.045 3.545 2.101 1064 HG2 GLN 122 2HG GLN 122 15.600 4.735 3.721 1065 HG3 GLN 122 3HG GLN 122 16.342 3.171 4.044 1066 HE21 GLN 122 1HE2 GLN 122 17.503 5.604 2.894 1067 HE22 GLN 122 2HE2 GLN 122 18.139 5.151 1.353 1068 H LYS 123 H LYS 123 11.735 4.524 2.947 1069 HA LYS 123 HA LYS 123 12.498 7.115 3.934 1070 HB2 LYS 123 2HB LYS 123 10.142 6.188 2.232 1071 HB3 LYS 123 3HB LYS 123 10.520 7.880 2.558 1072 HG2 LYS 123 2HG LYS 123 12.634 7.695 1.371 1073 HG3 LYS 123 3HG LYS 123 12.406 5.955 1.158 1074 HD2 LYS 123 2HD LYS 123 10.460 6.354 -0.281 1075 HD3 LYS 123 3HD LYS 123 10.590 8.098 -0.021 1076 HE2 LYS 123 2HE LYS 123 12.691 6.368 -1.379 1077 HE3 LYS 123 3HE LYS 123 11.526 7.404 -2.204 1078 HZ1 LYS 123 3HZ LYS 123 12.503 9.317 -1.067 1079 HZ2 LYS 123 1HZ LYS 123 13.645 8.504 -2.004 1080 HZ3 LYS 123 2HZ LYS 123 13.640 8.313 -0.329 1081 H ALA 124 H ALA 124 9.759 4.904 4.429 1082 HA ALA 124 HA ALA 124 8.085 6.302 6.072 1083 HB1 ALA 124 3HB ALA 124 7.353 4.141 6.998 1084 HB2 ALA 124 1HB ALA 124 8.810 3.361 6.359 1085 HB3 ALA 124 2HB ALA 124 7.604 4.029 5.258 1086 H GLY 125 H GLY 125 11.127 4.779 6.926 1087 HA2 GLY 125 2HA GLY 125 11.004 4.561 9.685 1088 HA3 GLY 125 3HA GLY 125 12.484 4.834 8.785 1089 H SER 126 H SER 126 11.689 7.517 7.818 1090 HA SER 126 HA SER 126 12.640 9.100 9.980 1091 HB2 SER 126 2HB SER 126 12.232 11.027 8.419 1092 HB3 SER 126 3HB SER 126 13.133 9.713 7.661 1093 HG SER 126 HG SER 126 11.550 9.419 6.303 1094 H LEU 127 H LEU 127 9.452 8.885 8.388 1095 HA LEU 127 HA LEU 127 8.200 10.871 10.084 1096 HB2 LEU 127 2HB LEU 127 6.867 8.860 8.227 1097 HB3 LEU 127 3HB LEU 127 6.149 10.332 8.854 1098 HG LEU 127 HG LEU 127 8.423 10.170 6.837 1099 HD11 LEU 127 1HD1 LEU 127 5.515 10.959 6.447 1100 HD12 LEU 127 2HD1 LEU 127 6.289 9.481 5.871 1101 HD13 LEU 127 3HD1 LEU 127 6.781 11.040 5.219 1102 HD21 LEU 127 3HD2 LEU 127 7.003 12.609 7.946 1103 HD22 LEU 127 1HD2 LEU 127 8.164 12.614 6.617 1104 HD23 LEU 127 2HD2 LEU 127 8.682 12.146 8.233 1105 H GLU 128 H GLU 128 8.686 7.475 10.099 1106 HA GLU 128 HA GLU 128 6.506 6.557 11.655 1107 HB2 GLU 128 2HB GLU 128 7.738 5.048 10.174 1108 HB3 GLU 128 3HB GLU 128 9.238 5.329 11.047 1109 HG2 GLU 128 2HG GLU 128 8.226 3.127 11.556 1110 HG3 GLU 128 3HG GLU 128 8.394 4.150 12.988 1111 H HIS 129 H HIS 129 9.950 7.106 12.433 1112 HA HIS 129 HA HIS 129 9.703 6.445 15.188 1113 HB2 HIS 129 2HB HIS 129 11.807 6.317 13.769 1114 HB3 HIS 129 3HB HIS 129 11.924 8.069 13.879 1115 HD1 HIS 129 HD1 HIS 129 13.414 8.846 15.696 1116 HD2 HIS 129 HD2 HIS 129 11.836 5.094 16.540 1117 HE1 HIS 129 HE1 HIS 129 14.487 8.131 17.849 1118 HE2 HIS 129 HE2 HIS 129 13.423 5.923 18.399 1119 H HIS 130 H HIS 130 8.804 9.232 13.499 1120 HA HIS 130 HA HIS 130 8.671 10.937 15.918 1121 HB2 HIS 130 2HB HIS 130 8.331 11.667 12.963 1122 HB3 HIS 130 3HB HIS 130 8.282 12.802 14.311 1123 HD1 HIS 130 HD1 HIS 130 10.491 11.905 11.769 1124 HD2 HIS 130 HD2 HIS 130 10.969 12.389 15.862 1125 HE1 HIS 130 HE1 HIS 130 12.953 12.252 12.124 1126 HE2 HIS 130 HE2 HIS 130 13.220 12.532 14.607 1127 H HIS 131 H HIS 131 6.560 12.465 15.614 1128 HA HIS 131 HA HIS 131 4.222 10.716 15.333 1129 HB2 HIS 131 2HB HIS 131 4.642 13.432 16.606 1130 HB3 HIS 131 3HB HIS 131 3.019 12.899 16.184 1131 HD1 HIS 131 HD1 HIS 131 5.941 11.822 18.363 1132 HD2 HIS 131 HD2 HIS 131 1.843 11.223 17.999 1133 HE1 HIS 131 HE1 HIS 131 5.270 10.461 20.368 1134 HE2 HIS 131 HE2 HIS 131 2.827 10.000 20.050 1135 H HIS 132 H HIS 132 4.825 14.132 14.341 1136 HA HIS 132 HA HIS 132 3.711 13.502 11.671 1137 HB2 HIS 132 2HB HIS 132 2.815 15.745 13.519 1138 HB3 HIS 132 3HB HIS 132 2.590 15.854 11.779 1139 HD1 HIS 132 HD1 HIS 132 0.514 14.831 10.861 1140 HD2 HIS 132 HD2 HIS 132 1.322 13.494 14.714 1141 HE1 HIS 132 HE1 HIS 132 -1.488 13.487 11.537 1142 HE2 HIS 132 HE2 HIS 132 -0.935 12.608 13.825 1143 H HIS 133 H HIS 133 4.993 14.181 10.093 1144 HA HIS 133 HA HIS 133 6.446 16.758 10.358 1145 HB2 HIS 133 2HB HIS 133 7.694 14.583 9.621 1146 HB3 HIS 133 3HB HIS 133 6.811 14.729 8.110 1147 HD1 HIS 133 HD1 HIS 133 9.683 16.110 10.004 1148 HD2 HIS 133 HD2 HIS 133 7.664 16.924 6.468 1149 HE1 HIS 133 HE1 HIS 133 11.188 17.642 8.707 1150 HE2 HIS 133 HE2 HIS 133 9.899 18.216 6.630 1151 H HIS 134 H HIS 134 3.660 15.281 9.307 1152 HA HIS 134 HA HIS 134 2.704 17.552 7.790 1153 HB2 HIS 134 2HB HIS 134 3.635 16.137 5.990 1154 HB3 HIS 134 3HB HIS 134 2.804 14.720 6.621 1155 HD1 HIS 134 HD1 HIS 134 1.332 14.226 4.637 1156 HD2 HIS 134 HD2 HIS 134 0.989 18.171 5.892 1157 HE1 HIS 134 HE1 HIS 134 -0.567 15.194 3.301 1158 HE2 HIS 134 HE2 HIS 134 -0.788 17.556 4.124 Start of MODEL 4 1 H1 MET 1 1H MET 1 0.567 8.889 15.960 2 H2 MET 1 2H MET 1 1.494 10.150 16.595 3 H3 MET 1 3H MET 1 1.779 8.552 17.087 4 HA MET 1 HA MET 1 2.180 9.643 14.366 5 HB2 MET 1 2HB MET 1 3.911 10.425 15.923 6 HB3 MET 1 3HB MET 1 4.162 8.793 16.528 7 HG2 MET 1 2HG MET 1 5.973 9.472 15.019 8 HG3 MET 1 3HG MET 1 5.079 8.109 14.349 9 HE1 MET 1 3HE MET 1 5.566 12.029 14.206 10 HE2 MET 1 1HE MET 1 3.816 11.865 14.364 11 HE3 MET 1 2HE MET 1 4.513 12.455 12.856 12 H LYS 2 H LYS 2 1.958 8.082 12.820 13 HA LYS 2 HA LYS 2 3.037 5.428 13.178 14 HB2 LYS 2 2HB LYS 2 0.791 5.202 14.251 15 HB3 LYS 2 3HB LYS 2 0.029 5.705 12.749 16 HG2 LYS 2 2HG LYS 2 0.973 3.673 11.626 17 HG3 LYS 2 3HG LYS 2 1.663 3.173 13.174 18 HD2 LYS 2 2HD LYS 2 -1.299 3.509 12.555 19 HD3 LYS 2 3HD LYS 2 -0.440 1.974 12.695 20 HE2 LYS 2 2HE LYS 2 -0.053 2.344 15.060 21 HE3 LYS 2 3HE LYS 2 -0.685 3.986 14.960 22 HZ1 LYS 2 3HZ LYS 2 -2.291 1.564 14.425 23 HZ2 LYS 2 1HZ LYS 2 -2.848 3.158 14.524 24 HZ3 LYS 2 2HZ LYS 2 -2.252 2.382 15.901 25 H ILE 3 H ILE 3 3.365 4.358 11.241 26 HA ILE 3 HA ILE 3 2.750 5.814 8.726 27 HB ILE 3 HB ILE 3 5.262 4.177 9.343 28 HG12 ILE 3 2HG1 ILE 3 5.033 7.208 9.005 29 HG13 ILE 3 3HG1 ILE 3 5.151 6.394 10.564 30 HG21 ILE 3 1HG2 ILE 3 4.617 4.071 6.969 31 HG22 ILE 3 2HG2 ILE 3 6.082 5.033 7.157 32 HG23 ILE 3 3HG2 ILE 3 4.531 5.834 6.888 33 HD11 ILE 3 3HD1 ILE 3 7.350 5.518 9.916 34 HD12 ILE 3 1HD1 ILE 3 7.281 7.278 9.915 35 HD13 ILE 3 2HD1 ILE 3 7.233 6.398 8.388 36 H LEU 4 H LEU 4 1.627 4.618 7.317 37 HA LEU 4 HA LEU 4 1.655 1.646 7.497 38 HB2 LEU 4 2HB LEU 4 -0.563 3.415 6.376 39 HB3 LEU 4 3HB LEU 4 -0.604 1.663 6.552 40 HG LEU 4 HG LEU 4 -0.582 3.684 8.837 41 HD11 LEU 4 1HD1 LEU 4 -2.818 1.915 7.827 42 HD12 LEU 4 2HD1 LEU 4 -2.704 3.670 7.659 43 HD13 LEU 4 3HD1 LEU 4 -2.874 2.954 9.259 44 HD21 LEU 4 3HD2 LEU 4 -0.787 0.654 8.966 45 HD22 LEU 4 1HD2 LEU 4 -0.986 1.766 10.327 46 HD23 LEU 4 2HD2 LEU 4 0.572 1.637 9.518 47 H ILE 5 H ILE 5 2.293 0.590 5.641 48 HA ILE 5 HA ILE 5 2.785 2.206 3.191 49 HB ILE 5 HB ILE 5 3.833 -0.599 3.775 50 HG12 ILE 5 2HG1 ILE 5 4.774 1.010 5.446 51 HG13 ILE 5 3HG1 ILE 5 6.006 0.349 4.380 52 HG21 ILE 5 1HG2 ILE 5 3.762 -0.053 1.385 53 HG22 ILE 5 2HG2 ILE 5 5.436 -0.137 1.935 54 HG23 ILE 5 3HG2 ILE 5 4.672 1.432 1.670 55 HD11 ILE 5 3HD1 ILE 5 6.363 2.692 4.822 56 HD12 ILE 5 1HD1 ILE 5 4.772 3.093 4.178 57 HD13 ILE 5 2HD1 ILE 5 6.021 2.437 3.114 58 H LEU 6 H LEU 6 1.081 2.084 1.816 59 HA LEU 6 HA LEU 6 -0.707 -0.262 1.813 60 HB2 LEU 6 2HB LEU 6 -1.388 2.344 1.857 61 HB3 LEU 6 3HB LEU 6 -1.208 2.198 0.129 62 HG LEU 6 HG LEU 6 -3.540 1.960 0.655 63 HD11 LEU 6 1HD1 LEU 6 -4.168 -0.237 -0.180 64 HD12 LEU 6 2HD1 LEU 6 -2.524 -0.832 0.076 65 HD13 LEU 6 3HD1 LEU 6 -2.833 0.435 -1.115 66 HD21 LEU 6 3HD2 LEU 6 -2.792 -0.182 2.649 67 HD22 LEU 6 1HD2 LEU 6 -4.426 0.336 2.235 68 HD23 LEU 6 2HD2 LEU 6 -3.323 1.461 3.020 69 H ILE 7 H ILE 7 -0.503 -1.736 0.181 70 HA ILE 7 HA ILE 7 0.868 -0.952 -2.325 71 HB ILE 7 HB ILE 7 1.357 -3.517 -0.731 72 HG12 ILE 7 2HG1 ILE 7 3.268 -1.218 -1.391 73 HG13 ILE 7 3HG1 ILE 7 2.488 -1.451 0.167 74 HG21 ILE 7 1HG2 ILE 7 3.014 -4.099 -2.484 75 HG22 ILE 7 2HG2 ILE 7 2.544 -2.665 -3.404 76 HG23 ILE 7 3HG2 ILE 7 1.387 -3.975 -3.155 77 HD11 ILE 7 3HD1 ILE 7 4.770 -2.168 0.246 78 HD12 ILE 7 1HD1 ILE 7 4.518 -3.271 -1.106 79 HD13 ILE 7 2HD1 ILE 7 3.707 -3.561 0.437 80 H ASN 8 H ASN 8 -0.520 -1.203 -3.934 81 HA ASN 8 HA ASN 8 -2.437 -3.459 -3.972 82 HB2 ASN 8 2HB ASN 8 -3.574 -1.292 -4.164 83 HB3 ASN 8 3HB ASN 8 -2.494 -0.793 -5.457 84 HD21 ASN 8 1HD2 ASN 8 -5.357 -2.574 -4.657 85 HD22 ASN 8 2HD2 ASN 8 -5.794 -3.024 -6.266 86 H THR 9 H THR 9 -1.620 -5.061 -5.142 87 HA THR 9 HA THR 9 -0.508 -4.437 -7.807 88 HB THR 9 HB THR 9 1.351 -5.362 -6.643 89 HG1 THR 9 HG1 THR 9 1.265 -6.329 -8.598 90 HG21 THR 9 3HG2 THR 9 0.202 -6.297 -4.666 91 HG22 THR 9 1HG2 THR 9 1.302 -7.481 -5.382 92 HG23 THR 9 2HG2 THR 9 -0.435 -7.615 -5.654 93 H ASN 10 H ASN 10 -1.295 -5.720 -9.501 94 HA ASN 10 HA ASN 10 -3.973 -6.729 -9.156 95 HB2 ASN 10 2HB ASN 10 -2.228 -7.154 -11.617 96 HB3 ASN 10 3HB ASN 10 -3.984 -7.097 -11.540 97 HD21 ASN 10 1HD2 ASN 10 -3.795 -4.574 -9.786 98 HD22 ASN 10 2HD2 ASN 10 -3.395 -3.333 -10.916 99 H ASN 11 H ASN 11 -0.803 -8.097 -9.048 100 HA ASN 11 HA ASN 11 -1.681 -10.816 -9.838 101 HB2 ASN 11 2HB ASN 11 0.220 -9.581 -11.072 102 HB3 ASN 11 3HB ASN 11 1.195 -9.820 -9.627 103 HD21 ASN 11 1HD2 ASN 11 1.843 -10.785 -12.195 104 HD22 ASN 11 2HD2 ASN 11 1.843 -12.514 -12.146 105 H ASP 12 H ASP 12 -1.571 -12.489 -8.445 106 HA ASP 12 HA ASP 12 -1.218 -12.182 -5.652 107 HB2 ASP 12 2HB ASP 12 -1.463 -14.643 -7.419 108 HB3 ASP 12 3HB ASP 12 -1.247 -14.782 -5.676 109 H GLU 13 H GLU 13 0.989 -13.159 -8.202 110 HA GLU 13 HA GLU 13 3.078 -14.332 -6.742 111 HB2 GLU 13 2HB GLU 13 3.186 -12.609 -9.259 112 HB3 GLU 13 3HB GLU 13 4.569 -13.500 -8.626 113 HG2 GLU 13 2HG GLU 13 3.408 -15.620 -8.987 114 HG3 GLU 13 3HG GLU 13 1.969 -14.761 -9.549 115 H LEU 14 H LEU 14 2.541 -10.922 -7.636 116 HA LEU 14 HA LEU 14 4.822 -9.886 -6.325 117 HB2 LEU 14 2HB LEU 14 2.321 -8.632 -7.441 118 HB3 LEU 14 3HB LEU 14 3.393 -7.657 -6.458 119 HG LEU 14 HG LEU 14 3.938 -7.208 -8.732 120 HD11 LEU 14 1HD1 LEU 14 5.835 -7.382 -7.194 121 HD12 LEU 14 2HD1 LEU 14 6.282 -7.798 -8.840 122 HD13 LEU 14 3HD1 LEU 14 6.060 -9.075 -7.647 123 HD21 LEU 14 3HD2 LEU 14 4.228 -10.193 -9.212 124 HD22 LEU 14 1HD2 LEU 14 4.587 -8.916 -10.379 125 HD23 LEU 14 2HD2 LEU 14 2.933 -9.156 -9.817 126 H ILE 15 H ILE 15 1.467 -10.430 -5.208 127 HA ILE 15 HA ILE 15 1.561 -9.006 -2.796 128 HB ILE 15 HB ILE 15 0.081 -11.626 -3.348 129 HG12 ILE 15 2HG1 ILE 15 -0.896 -8.729 -3.477 130 HG13 ILE 15 3HG1 ILE 15 -0.577 -9.765 -4.863 131 HG21 ILE 15 1HG2 ILE 15 -1.377 -11.051 -1.421 132 HG22 ILE 15 2HG2 ILE 15 -0.356 -9.656 -1.062 133 HG23 ILE 15 3HG2 ILE 15 0.294 -11.291 -0.918 134 HD11 ILE 15 3HD1 ILE 15 -2.954 -9.554 -4.433 135 HD12 ILE 15 1HD1 ILE 15 -2.746 -10.185 -2.799 136 HD13 ILE 15 2HD1 ILE 15 -2.431 -11.222 -4.196 137 H LYS 16 H LYS 16 2.228 -12.512 -3.255 138 HA LYS 16 HA LYS 16 3.000 -12.956 -0.567 139 HB2 LYS 16 2HB LYS 16 3.654 -15.214 -1.330 140 HB3 LYS 16 3HB LYS 16 2.071 -14.735 -1.932 141 HG2 LYS 16 2HG LYS 16 3.235 -14.106 -4.122 142 HG3 LYS 16 3HG LYS 16 4.675 -14.905 -3.486 143 HD2 LYS 16 2HD LYS 16 3.414 -16.416 -4.961 144 HD3 LYS 16 3HD LYS 16 3.421 -17.032 -3.305 145 HE2 LYS 16 2HE LYS 16 1.129 -16.229 -2.961 146 HE3 LYS 16 3HE LYS 16 1.128 -15.464 -4.551 147 HZ1 LYS 16 3HZ LYS 16 1.294 -18.378 -4.014 148 HZ2 LYS 16 1HZ LYS 16 1.341 -17.665 -5.546 149 HZ3 LYS 16 2HZ LYS 16 -0.054 -17.543 -4.600 150 H LYS 17 H LYS 17 4.923 -12.140 -3.439 151 HA LYS 17 HA LYS 17 7.500 -12.674 -2.317 152 HB2 LYS 17 2HB LYS 17 6.605 -10.907 -4.624 153 HB3 LYS 17 3HB LYS 17 8.303 -11.137 -4.202 154 HG2 LYS 17 2HG LYS 17 8.175 -13.499 -4.694 155 HG3 LYS 17 3HG LYS 17 6.426 -13.412 -4.909 156 HD2 LYS 17 2HD LYS 17 7.568 -13.536 -7.073 157 HD3 LYS 17 3HD LYS 17 6.711 -12.006 -6.901 158 HE2 LYS 17 2HE LYS 17 8.805 -10.836 -6.458 159 HE3 LYS 17 3HE LYS 17 9.694 -12.359 -6.436 160 HZ1 LYS 17 3HZ LYS 17 9.130 -12.670 -8.771 161 HZ2 LYS 17 1HZ LYS 17 9.973 -11.224 -8.534 162 HZ3 LYS 17 2HZ LYS 17 8.304 -11.196 -8.787 163 H ILE 18 H ILE 18 5.618 -9.677 -2.677 164 HA ILE 18 HA ILE 18 7.416 -7.925 -1.380 165 HB ILE 18 HB ILE 18 4.426 -7.760 -1.897 166 HG12 ILE 18 2HG1 ILE 18 6.767 -6.217 -3.133 167 HG13 ILE 18 3HG1 ILE 18 5.997 -7.626 -3.853 168 HG21 ILE 18 1HG2 ILE 18 4.458 -5.377 -1.239 169 HG22 ILE 18 2HG2 ILE 18 6.119 -5.556 -0.668 170 HG23 ILE 18 3HG2 ILE 18 4.810 -6.435 0.125 171 HD11 ILE 18 3HD1 ILE 18 3.895 -6.366 -4.055 172 HD12 ILE 18 1HD1 ILE 18 5.232 -5.600 -4.912 173 HD13 ILE 18 2HD1 ILE 18 4.692 -4.947 -3.368 174 H LYS 19 H LYS 19 4.875 -10.046 -0.133 175 HA LYS 19 HA LYS 19 4.699 -9.144 2.513 176 HB2 LYS 19 2HB LYS 19 4.327 -11.965 1.416 177 HB3 LYS 19 3HB LYS 19 3.943 -11.498 3.074 178 HG2 LYS 19 2HG LYS 19 2.322 -9.816 2.163 179 HG3 LYS 19 3HG LYS 19 2.640 -10.436 0.554 180 HD2 LYS 19 2HD LYS 19 0.581 -11.395 1.364 181 HD3 LYS 19 3HD LYS 19 1.794 -12.675 1.273 182 HE2 LYS 19 2HE LYS 19 2.102 -12.637 3.669 183 HE3 LYS 19 3HE LYS 19 1.124 -11.180 3.829 184 HZ1 LYS 19 3HZ LYS 19 -0.807 -12.423 3.117 185 HZ2 LYS 19 1HZ LYS 19 -0.095 -13.154 4.466 186 HZ3 LYS 19 2HZ LYS 19 0.126 -13.820 2.933 187 H LYS 20 H LYS 20 7.046 -11.352 0.982 188 HA LYS 20 HA LYS 20 8.410 -12.004 3.445 189 HB2 LYS 20 2HB LYS 20 9.222 -12.417 0.540 190 HB3 LYS 20 3HB LYS 20 10.182 -12.983 1.910 191 HG2 LYS 20 2HG LYS 20 7.355 -13.865 1.208 192 HG3 LYS 20 3HG LYS 20 8.834 -14.806 0.969 193 HD2 LYS 20 2HD LYS 20 9.189 -14.840 3.448 194 HD3 LYS 20 3HD LYS 20 7.703 -13.914 3.666 195 HE2 LYS 20 2HE LYS 20 6.430 -15.798 2.618 196 HE3 LYS 20 3HE LYS 20 7.930 -16.729 2.553 197 HZ1 LYS 20 3HZ LYS 20 6.581 -17.280 4.493 198 HZ2 LYS 20 1HZ LYS 20 6.668 -15.677 5.031 199 HZ3 LYS 20 2HZ LYS 20 8.068 -16.618 4.950 200 H GLU 21 H GLU 21 9.073 -9.839 0.707 201 HA GLU 21 HA GLU 21 11.431 -8.619 1.393 202 HB2 GLU 21 2HB GLU 21 8.954 -7.301 0.189 203 HB3 GLU 21 3HB GLU 21 10.526 -6.510 0.272 204 HG2 GLU 21 2HG GLU 21 9.907 -9.062 -1.244 205 HG3 GLU 21 3HG GLU 21 10.073 -7.457 -1.953 206 H VAL 22 H VAL 22 8.274 -7.977 2.833 207 HA VAL 22 HA VAL 22 9.388 -5.805 4.510 208 HB VAL 22 HB VAL 22 7.127 -5.048 4.841 209 HG11 VAL 22 1HG1 VAL 22 7.576 -5.849 1.939 210 HG12 VAL 22 2HG1 VAL 22 8.171 -4.387 2.728 211 HG13 VAL 22 3HG1 VAL 22 6.441 -4.616 2.485 212 HG21 VAL 22 3HG2 VAL 22 5.151 -6.215 3.869 213 HG22 VAL 22 1HG2 VAL 22 5.939 -7.186 5.112 214 HG23 VAL 22 2HG2 VAL 22 6.183 -7.572 3.408 215 H GLU 23 H GLU 23 8.310 -9.065 4.703 216 HA GLU 23 HA GLU 23 7.583 -9.383 7.399 217 HB2 GLU 23 2HB GLU 23 7.312 -11.139 5.708 218 HB3 GLU 23 3HB GLU 23 9.054 -11.244 5.482 219 HG2 GLU 23 2HG GLU 23 9.225 -12.050 7.866 220 HG3 GLU 23 3HG GLU 23 7.461 -12.100 7.915 221 H ASN 24 H ASN 24 10.725 -9.653 5.781 222 HA ASN 24 HA ASN 24 12.226 -10.046 8.226 223 HB2 ASN 24 2HB ASN 24 13.097 -9.714 5.326 224 HB3 ASN 24 3HB ASN 24 14.197 -10.070 6.657 225 HD21 ASN 24 1HD2 ASN 24 11.662 -11.364 4.610 226 HD22 ASN 24 2HD2 ASN 24 11.867 -13.013 5.065 227 H GLN 25 H GLN 25 10.834 -7.350 7.101 228 HA GLN 25 HA GLN 25 12.984 -5.516 7.995 229 HB2 GLN 25 2HB GLN 25 10.665 -5.078 6.068 230 HB3 GLN 25 3HB GLN 25 11.601 -3.747 6.746 231 HG2 GLN 25 2HG GLN 25 12.718 -5.992 5.038 232 HG3 GLN 25 3HG GLN 25 12.349 -4.357 4.490 233 HE21 GLN 25 1HE2 GLN 25 14.553 -6.319 6.357 234 HE22 GLN 25 2HE2 GLN 25 15.771 -5.112 6.540 235 H GLY 26 H GLY 26 10.609 -7.073 9.398 236 HA2 GLY 26 2HA GLY 26 9.488 -6.767 11.362 237 HA3 GLY 26 3HA GLY 26 10.369 -5.264 11.566 238 H TYR 27 H TYR 27 8.369 -5.678 8.746 239 HA TYR 27 HA TYR 27 6.306 -3.874 9.844 240 HB2 TYR 27 2HB TYR 27 6.992 -4.657 6.969 241 HB3 TYR 27 3HB TYR 27 5.527 -3.774 7.390 242 HD1 TYR 27 HD1 TYR 27 5.672 -1.439 8.266 243 HD2 TYR 27 HD2 TYR 27 9.172 -3.529 6.981 244 HE1 TYR 27 HE1 TYR 27 6.914 0.680 8.209 245 HE2 TYR 27 HE2 TYR 27 10.415 -1.408 6.932 246 HH TYR 27 HH TYR 27 9.385 1.385 8.413 247 H GLN 28 H GLN 28 4.618 -4.829 10.711 248 HA GLN 28 HA GLN 28 4.000 -7.582 10.561 249 HB2 GLN 28 2HB GLN 28 2.265 -5.251 11.505 250 HB3 GLN 28 3HB GLN 28 1.938 -6.956 11.819 251 HG2 GLN 28 2HG GLN 28 4.053 -7.109 13.101 252 HG3 GLN 28 3HG GLN 28 4.346 -5.394 12.805 253 HE21 GLN 28 1HE2 GLN 28 1.168 -6.781 13.583 254 HE22 GLN 28 2HE2 GLN 28 1.034 -6.034 15.133 255 H VAL 29 H VAL 29 3.369 -8.491 8.718 256 HA VAL 29 HA VAL 29 2.247 -6.953 6.567 257 HB VAL 29 HB VAL 29 2.511 -9.984 6.469 258 HG11 VAL 29 1HG1 VAL 29 2.809 -7.810 4.353 259 HG12 VAL 29 2HG1 VAL 29 1.409 -8.864 4.574 260 HG13 VAL 29 3HG1 VAL 29 2.954 -9.547 4.072 261 HG21 VAL 29 3HG2 VAL 29 4.657 -9.231 7.377 262 HG22 VAL 29 1HG2 VAL 29 4.804 -8.019 6.102 263 HG23 VAL 29 2HG2 VAL 29 4.857 -9.736 5.699 264 H ARG 30 H ARG 30 0.178 -6.613 6.307 265 HA ARG 30 HA ARG 30 -1.855 -8.644 6.957 266 HB2 ARG 30 2HB ARG 30 -1.921 -5.649 7.508 267 HB3 ARG 30 3HB ARG 30 -3.393 -6.612 7.435 268 HG2 ARG 30 2HG ARG 30 -1.196 -7.494 9.303 269 HG3 ARG 30 3HG ARG 30 -2.165 -6.094 9.754 270 HD2 ARG 30 2HD ARG 30 -2.967 -8.292 10.699 271 HD3 ARG 30 3HD ARG 30 -4.181 -7.386 9.799 272 HE ARG 30 HE ARG 30 -2.752 -9.448 8.314 273 HH11 ARG 30 1HH1 ARG 30 -5.655 -8.660 10.136 274 HH12 ARG 30 2HH1 ARG 30 -6.575 -9.965 9.463 275 HH21 ARG 30 1HH2 ARG 30 -4.013 -11.125 7.414 276 HH22 ARG 30 2HH2 ARG 30 -5.648 -11.358 7.926 277 H ASP 31 H ASP 31 -3.460 -8.840 5.411 278 HA ASP 31 HA ASP 31 -3.583 -6.936 3.208 279 HB2 ASP 31 2HB ASP 31 -3.580 -8.680 1.443 280 HB3 ASP 31 3HB ASP 31 -2.040 -8.583 2.271 281 H VAL 32 H VAL 32 -5.543 -6.759 2.319 282 HA VAL 32 HA VAL 32 -7.764 -7.777 3.981 283 HB VAL 32 HB VAL 32 -7.464 -5.291 2.218 284 HG11 VAL 32 1HG1 VAL 32 -9.730 -4.613 2.928 285 HG12 VAL 32 2HG1 VAL 32 -9.938 -6.155 3.762 286 HG13 VAL 32 3HG1 VAL 32 -9.785 -6.117 2.005 287 HG21 VAL 32 3HG2 VAL 32 -7.846 -5.593 5.227 288 HG22 VAL 32 1HG2 VAL 32 -7.730 -4.060 4.357 289 HG23 VAL 32 2HG2 VAL 32 -6.343 -5.149 4.414 290 H ASN 33 H ASN 33 -8.786 -9.505 3.066 291 HA ASN 33 HA ASN 33 -8.744 -10.080 0.261 292 HB2 ASN 33 2HB ASN 33 -10.351 -11.348 2.522 293 HB3 ASN 33 3HB ASN 33 -10.162 -12.022 0.906 294 HD21 ASN 33 1HD2 ASN 33 -9.296 -13.902 1.709 295 HD22 ASN 33 2HD2 ASN 33 -7.711 -14.003 2.373 296 H ASP 34 H ASP 34 -11.054 -8.614 2.466 297 HA ASP 34 HA ASP 34 -13.136 -8.328 0.413 298 HB2 ASP 34 2HB ASP 34 -13.547 -10.558 1.307 299 HB3 ASP 34 3HB ASP 34 -13.385 -9.991 2.966 300 H SER 35 H SER 35 -14.996 -7.017 1.210 301 HA SER 35 HA SER 35 -14.336 -4.587 2.313 302 HB2 SER 35 2HB SER 35 -16.355 -4.980 0.947 303 HB3 SER 35 3HB SER 35 -17.071 -5.930 2.249 304 HG SER 35 HG SER 35 -16.294 -3.215 2.485 305 H ASP 36 H ASP 36 -15.702 -7.424 4.004 306 HA ASP 36 HA ASP 36 -15.986 -6.157 6.529 307 HB2 ASP 36 2HB ASP 36 -15.817 -9.101 5.793 308 HB3 ASP 36 3HB ASP 36 -16.064 -8.550 7.449 309 H GLU 37 H GLU 37 -13.311 -7.942 5.034 310 HA GLU 37 HA GLU 37 -11.572 -8.143 7.260 311 HB2 GLU 37 2HB GLU 37 -10.783 -7.805 4.326 312 HB3 GLU 37 3HB GLU 37 -9.740 -8.416 5.611 313 HG2 GLU 37 2HG GLU 37 -12.239 -9.760 4.528 314 HG3 GLU 37 3HG GLU 37 -10.579 -10.212 4.153 315 H LEU 38 H LEU 38 -12.061 -5.595 4.844 316 HA LEU 38 HA LEU 38 -10.150 -3.687 5.556 317 HB2 LEU 38 2HB LEU 38 -11.482 -3.394 3.568 318 HB3 LEU 38 3HB LEU 38 -12.973 -3.444 4.478 319 HG LEU 38 HG LEU 38 -11.870 -1.212 5.600 320 HD11 LEU 38 1HD1 LEU 38 -10.837 0.193 3.898 321 HD12 LEU 38 2HD1 LEU 38 -10.822 -1.168 2.773 322 HD13 LEU 38 3HD1 LEU 38 -9.861 -1.232 4.252 323 HD21 LEU 38 3HD2 LEU 38 -14.117 -1.300 4.699 324 HD22 LEU 38 1HD2 LEU 38 -13.488 -1.238 3.044 325 HD23 LEU 38 2HD2 LEU 38 -13.282 0.144 4.123 326 H LYS 39 H LYS 39 -13.566 -3.885 6.596 327 HA LYS 39 HA LYS 39 -13.493 -1.650 8.313 328 HB2 LYS 39 2HB LYS 39 -15.458 -3.978 8.234 329 HB3 LYS 39 3HB LYS 39 -15.728 -2.455 9.080 330 HG2 LYS 39 2HG LYS 39 -15.725 -1.220 6.987 331 HG3 LYS 39 3HG LYS 39 -15.313 -2.680 6.083 332 HD2 LYS 39 2HD LYS 39 -17.893 -2.253 7.658 333 HD3 LYS 39 3HD LYS 39 -17.738 -2.079 5.908 334 HE2 LYS 39 2HE LYS 39 -17.120 -4.482 5.741 335 HE3 LYS 39 3HE LYS 39 -17.298 -4.645 7.487 336 HZ1 LYS 39 3HZ LYS 39 -19.642 -4.091 7.255 337 HZ2 LYS 39 1HZ LYS 39 -19.239 -5.448 6.328 338 HZ3 LYS 39 2HZ LYS 39 -19.467 -3.943 5.583 339 H LYS 40 H LYS 40 -12.760 -5.028 8.889 340 HA LYS 40 HA LYS 40 -12.804 -4.983 11.747 341 HB2 LYS 40 2HB LYS 40 -11.353 -6.849 9.826 342 HB3 LYS 40 3HB LYS 40 -11.461 -7.112 11.563 343 HG2 LYS 40 2HG LYS 40 -13.847 -6.985 9.699 344 HG3 LYS 40 3HG LYS 40 -13.051 -8.480 10.184 345 HD2 LYS 40 2HD LYS 40 -13.705 -8.101 12.520 346 HD3 LYS 40 3HD LYS 40 -14.386 -6.522 12.106 347 HE2 LYS 40 2HE LYS 40 -16.092 -7.601 10.701 348 HE3 LYS 40 3HE LYS 40 -15.387 -9.186 11.026 349 HZ1 LYS 40 3HZ LYS 40 -16.033 -9.052 13.279 350 HZ2 LYS 40 1HZ LYS 40 -17.386 -8.623 12.361 351 HZ3 LYS 40 2HZ LYS 40 -16.481 -7.427 13.146 352 H GLU 41 H GLU 41 -10.140 -4.734 9.331 353 HA GLU 41 HA GLU 41 -8.116 -4.570 11.367 354 HB2 GLU 41 2HB GLU 41 -7.921 -4.141 8.363 355 HB3 GLU 41 3HB GLU 41 -6.533 -4.186 9.455 356 HG2 GLU 41 2HG GLU 41 -8.439 -6.446 8.773 357 HG3 GLU 41 3HG GLU 41 -6.712 -6.342 8.427 358 H MET 42 H MET 42 -9.855 -2.150 9.491 359 HA MET 42 HA MET 42 -8.114 0.043 9.995 360 HB2 MET 42 2HB MET 42 -11.088 0.021 9.322 361 HB3 MET 42 3HB MET 42 -10.079 1.468 9.343 362 HG2 MET 42 2HG MET 42 -9.840 -0.906 7.481 363 HG3 MET 42 3HG MET 42 -10.278 0.750 7.060 364 HE1 MET 42 3HE MET 42 -8.149 2.410 8.820 365 HE2 MET 42 1HE MET 42 -8.474 2.809 7.129 366 HE3 MET 42 2HE MET 42 -6.814 2.580 7.680 367 H LYS 43 H LYS 43 -10.753 -1.383 11.829 368 HA LYS 43 HA LYS 43 -10.978 0.531 13.900 369 HB2 LYS 43 2HB LYS 43 -11.463 -2.476 13.880 370 HB3 LYS 43 3HB LYS 43 -11.800 -1.470 15.286 371 HG2 LYS 43 2HG LYS 43 -13.450 -0.185 14.026 372 HG3 LYS 43 3HG LYS 43 -13.068 -1.094 12.558 373 HD2 LYS 43 2HD LYS 43 -13.890 -3.168 13.613 374 HD3 LYS 43 3HD LYS 43 -14.238 -2.290 15.105 375 HE2 LYS 43 2HE LYS 43 -16.279 -2.676 13.750 376 HE3 LYS 43 3HE LYS 43 -15.943 -0.955 13.944 377 HZ1 LYS 43 3HZ LYS 43 -15.236 -2.569 11.553 378 HZ2 LYS 43 1HZ LYS 43 -15.007 -0.904 11.734 379 HZ3 LYS 43 2HZ LYS 43 -16.574 -1.540 11.665 380 H LYS 44 H LYS 44 -8.780 -2.212 13.426 381 HA LYS 44 HA LYS 44 -7.622 -2.224 16.036 382 HB2 LYS 44 2HB LYS 44 -6.269 -3.266 13.510 383 HB3 LYS 44 3HB LYS 44 -5.999 -3.795 15.169 384 HG2 LYS 44 2HG LYS 44 -8.481 -4.277 13.489 385 HG3 LYS 44 3HG LYS 44 -7.242 -5.464 13.893 386 HD2 LYS 44 2HD LYS 44 -9.081 -4.102 15.901 387 HD3 LYS 44 3HD LYS 44 -9.351 -5.699 15.209 388 HE2 LYS 44 2HE LYS 44 -8.401 -6.190 17.293 389 HE3 LYS 44 3HE LYS 44 -7.005 -6.276 16.220 390 HZ1 LYS 44 3HZ LYS 44 -6.571 -5.065 18.290 391 HZ2 LYS 44 1HZ LYS 44 -7.740 -3.916 17.871 392 HZ3 LYS 44 2HZ LYS 44 -6.345 -4.087 16.932 393 H LEU 45 H LEU 45 -6.826 -0.593 13.016 394 HA LEU 45 HA LEU 45 -4.301 0.481 13.763 395 HB2 LEU 45 2HB LEU 45 -6.317 1.507 11.720 396 HB3 LEU 45 3HB LEU 45 -4.627 1.995 11.817 397 HG LEU 45 HG LEU 45 -5.628 -0.806 11.147 398 HD11 LEU 45 1HD1 LEU 45 -6.047 0.734 9.315 399 HD12 LEU 45 2HD1 LEU 45 -4.778 -0.412 8.893 400 HD13 LEU 45 3HD1 LEU 45 -4.358 1.248 9.328 401 HD21 LEU 45 3HD2 LEU 45 -2.785 0.245 11.210 402 HD22 LEU 45 1HD2 LEU 45 -3.288 -1.350 10.638 403 HD23 LEU 45 2HD2 LEU 45 -3.501 -0.918 12.330 404 H ALA 46 H ALA 46 -7.641 1.679 14.000 405 HA ALA 46 HA ALA 46 -7.057 4.271 14.997 406 HB1 ALA 46 3HB ALA 46 -9.209 3.694 13.947 407 HB2 ALA 46 1HB ALA 46 -9.447 4.373 15.559 408 HB3 ALA 46 2HB ALA 46 -9.590 2.633 15.304 409 H GLU 47 H GLU 47 -7.069 1.174 16.551 410 HA GLU 47 HA GLU 47 -7.641 2.075 19.236 411 HB2 GLU 47 2HB GLU 47 -6.731 -0.586 18.092 412 HB3 GLU 47 3HB GLU 47 -6.969 -0.339 19.820 413 HG2 GLU 47 2HG GLU 47 -9.330 0.233 19.423 414 HG3 GLU 47 3HG GLU 47 -9.104 0.004 17.693 415 H GLU 48 H GLU 48 -4.854 2.494 17.437 416 HA GLU 48 HA GLU 48 -3.302 2.931 19.911 417 HB2 GLU 48 2HB GLU 48 -2.637 0.699 19.100 418 HB3 GLU 48 3HB GLU 48 -2.262 1.360 17.516 419 HG2 GLU 48 2HG GLU 48 -0.207 0.981 18.717 420 HG3 GLU 48 3HG GLU 48 -0.440 2.710 18.517 421 H LYS 49 H LYS 49 -1.967 4.668 19.872 422 HA LYS 49 HA LYS 49 -1.988 6.402 17.486 423 HB2 LYS 49 2HB LYS 49 -1.250 8.197 19.117 424 HB3 LYS 49 3HB LYS 49 -2.848 7.540 19.386 425 HG2 LYS 49 2HG LYS 49 -1.953 7.784 21.542 426 HG3 LYS 49 3HG LYS 49 -1.805 6.062 21.199 427 HD2 LYS 49 2HD LYS 49 0.589 6.340 20.715 428 HD3 LYS 49 3HD LYS 49 0.460 8.086 20.951 429 HE2 LYS 49 2HE LYS 49 -0.022 5.967 23.073 430 HE3 LYS 49 3HE LYS 49 1.432 6.953 22.917 431 HZ1 LYS 49 3HZ LYS 49 0.027 8.935 23.274 432 HZ2 LYS 49 1HZ LYS 49 0.011 7.876 24.592 433 HZ3 LYS 49 2HZ LYS 49 -1.311 7.932 23.542 434 H ASN 50 H ASN 50 0.127 4.471 19.431 435 HA ASN 50 HA ASN 50 2.652 5.621 18.699 436 HB2 ASN 50 2HB ASN 50 2.377 4.209 20.722 437 HB3 ASN 50 3HB ASN 50 1.951 2.833 19.717 438 HD21 ASN 50 1HD2 ASN 50 3.604 1.544 20.473 439 HD22 ASN 50 2HD2 ASN 50 5.271 1.823 20.122 440 H PHE 51 H PHE 51 4.257 4.595 17.267 441 HA PHE 51 HA PHE 51 3.070 4.031 14.709 442 HB2 PHE 51 2HB PHE 51 5.471 4.083 13.841 443 HB3 PHE 51 3HB PHE 51 4.869 5.558 14.574 444 HD1 PHE 51 HD1 PHE 51 5.677 6.240 16.865 445 HD2 PHE 51 HD2 PHE 51 7.433 2.962 14.734 446 HE1 PHE 51 HE1 PHE 51 7.671 6.367 18.296 447 HE2 PHE 51 HE2 PHE 51 9.414 3.095 16.182 448 HZ PHE 51 HZ PHE 51 9.537 4.796 17.960 449 H GLU 52 H GLU 52 2.087 2.012 15.543 450 HA GLU 52 HA GLU 52 3.622 -0.407 15.425 451 HB2 GLU 52 2HB GLU 52 0.622 0.001 14.974 452 HB3 GLU 52 3HB GLU 52 1.431 -1.542 15.270 453 HG2 GLU 52 2HG GLU 52 1.172 0.775 17.210 454 HG3 GLU 52 3HG GLU 52 0.286 -0.745 17.273 455 H LYS 53 H LYS 53 4.562 -1.040 13.592 456 HA LYS 53 HA LYS 53 4.017 0.360 11.109 457 HB2 LYS 53 2HB LYS 53 6.109 -1.755 11.780 458 HB3 LYS 53 3HB LYS 53 6.083 -0.729 10.341 459 HG2 LYS 53 2HG LYS 53 6.301 1.277 11.810 460 HG3 LYS 53 3HG LYS 53 6.415 0.206 13.209 461 HD2 LYS 53 2HD LYS 53 8.348 0.265 10.870 462 HD3 LYS 53 3HD LYS 53 8.607 1.029 12.435 463 HE2 LYS 53 2HE LYS 53 8.464 -1.245 13.494 464 HE3 LYS 53 3HE LYS 53 8.408 -1.941 11.870 465 HZ1 LYS 53 3HZ LYS 53 10.649 -1.921 12.768 466 HZ2 LYS 53 1HZ LYS 53 10.597 -0.240 12.952 467 HZ3 LYS 53 2HZ LYS 53 10.547 -0.928 11.410 468 H ILE 54 H ILE 54 2.010 -0.439 10.524 469 HA ILE 54 HA ILE 54 1.710 -3.338 10.014 470 HB ILE 54 HB ILE 54 -0.475 -1.190 10.063 471 HG12 ILE 54 2HG1 ILE 54 0.551 -1.394 12.329 472 HG13 ILE 54 3HG1 ILE 54 -1.115 -1.955 12.311 473 HG21 ILE 54 1HG2 ILE 54 -0.694 -4.227 10.115 474 HG22 ILE 54 2HG2 ILE 54 -1.071 -3.177 8.747 475 HG23 ILE 54 3HG2 ILE 54 -2.048 -3.094 10.213 476 HD11 ILE 54 3HD1 ILE 54 0.278 -3.360 13.686 477 HD12 ILE 54 1HD1 ILE 54 1.349 -3.690 12.326 478 HD13 ILE 54 2HD1 ILE 54 -0.319 -4.271 12.301 479 H LEU 55 H LEU 55 2.272 -3.760 7.973 480 HA LEU 55 HA LEU 55 1.855 -1.827 5.803 481 HB2 LEU 55 2HB LEU 55 3.992 -3.097 5.984 482 HB3 LEU 55 3HB LEU 55 3.117 -4.598 5.766 483 HG LEU 55 HG LEU 55 2.671 -2.614 3.581 484 HD11 LEU 55 1HD1 LEU 55 4.998 -2.114 4.005 485 HD12 LEU 55 2HD1 LEU 55 4.811 -2.974 2.480 486 HD13 LEU 55 3HD1 LEU 55 5.410 -3.825 3.904 487 HD21 LEU 55 3HD2 LEU 55 1.808 -4.907 3.419 488 HD22 LEU 55 1HD2 LEU 55 3.452 -5.550 3.520 489 HD23 LEU 55 2HD2 LEU 55 2.961 -4.573 2.130 490 H ILE 56 H ILE 56 0.116 -1.943 4.485 491 HA ILE 56 HA ILE 56 -1.672 -4.297 4.680 492 HB ILE 56 HB ILE 56 -2.470 -1.470 3.854 493 HG12 ILE 56 2HG1 ILE 56 -1.858 -1.578 6.318 494 HG13 ILE 56 3HG1 ILE 56 -3.541 -1.144 6.023 495 HG21 ILE 56 1HG2 ILE 56 -4.134 -3.956 4.422 496 HG22 ILE 56 2HG2 ILE 56 -3.885 -3.187 2.853 497 HG23 ILE 56 3HG2 ILE 56 -4.797 -2.352 4.108 498 HD11 ILE 56 3HD1 ILE 56 -4.220 -3.423 6.590 499 HD12 ILE 56 1HD1 ILE 56 -3.313 -2.659 7.894 500 HD13 ILE 56 2HD1 ILE 56 -2.531 -3.860 6.868 501 H ILE 57 H ILE 57 -1.992 -5.414 2.857 502 HA ILE 57 HA ILE 57 -1.399 -4.211 0.214 503 HB ILE 57 HB ILE 57 -1.395 -7.171 0.997 504 HG12 ILE 57 2HG1 ILE 57 0.913 -5.347 0.144 505 HG13 ILE 57 3HG1 ILE 57 0.623 -5.936 1.777 506 HG21 ILE 57 1HG2 ILE 57 -0.850 -5.913 -1.724 507 HG22 ILE 57 2HG2 ILE 57 -2.267 -6.872 -1.291 508 HG23 ILE 57 3HG2 ILE 57 -0.676 -7.629 -1.332 509 HD11 ILE 57 3HD1 ILE 57 2.411 -7.164 0.716 510 HD12 ILE 57 1HD1 ILE 57 1.351 -7.629 -0.616 511 HD13 ILE 57 2HD1 ILE 57 1.040 -8.230 1.017 512 H SER 58 H SER 58 -3.169 -3.761 -0.946 513 HA SER 58 HA SER 58 -5.657 -5.330 -0.522 514 HB2 SER 58 2HB SER 58 -5.866 -2.966 0.322 515 HB3 SER 58 3HB SER 58 -5.486 -2.373 -1.291 516 HG SER 58 HG SER 58 -7.392 -3.150 -2.033 517 H ASN 59 H ASN 59 -5.972 -6.557 -2.236 518 HA ASN 59 HA ASN 59 -4.654 -6.190 -4.780 519 HB2 ASN 59 2HB ASN 59 -4.963 -8.420 -3.785 520 HB3 ASN 59 3HB ASN 59 -6.707 -8.209 -3.776 521 HD21 ASN 59 1HD2 ASN 59 -4.525 -7.421 -6.489 522 HD22 ASN 59 2HD2 ASN 59 -5.161 -8.619 -7.553 523 H ASP 60 H ASP 60 -7.615 -5.202 -3.404 524 HA ASP 60 HA ASP 60 -9.014 -4.765 -5.972 525 HB2 ASP 60 2HB ASP 60 -10.200 -6.043 -4.166 526 HB3 ASP 60 3HB ASP 60 -10.029 -4.665 -3.087 527 H LYS 61 H LYS 61 -9.586 -2.685 -6.600 528 HA LYS 61 HA LYS 61 -7.951 -0.518 -5.681 529 HB2 LYS 61 2HB LYS 61 -10.264 -0.526 -7.668 530 HB3 LYS 61 3HB LYS 61 -9.157 0.824 -7.418 531 HG2 LYS 61 2HG LYS 61 -8.335 -1.930 -8.407 532 HG3 LYS 61 3HG LYS 61 -8.657 -0.537 -9.447 533 HD2 LYS 61 2HD LYS 61 -6.796 0.693 -8.357 534 HD3 LYS 61 3HD LYS 61 -6.473 -0.704 -7.324 535 HE2 LYS 61 2HE LYS 61 -5.890 -2.045 -9.287 536 HE3 LYS 61 3HE LYS 61 -6.296 -0.699 -10.358 537 HZ1 LYS 61 3HZ LYS 61 -3.912 -0.907 -9.975 538 HZ2 LYS 61 1HZ LYS 61 -4.143 -0.670 -8.316 539 HZ3 LYS 61 2HZ LYS 61 -4.504 0.571 -9.412 540 H GLN 62 H GLN 62 -11.327 -1.425 -5.132 541 HA GLN 62 HA GLN 62 -12.162 1.200 -4.255 542 HB2 GLN 62 2HB GLN 62 -13.719 -0.411 -5.369 543 HB3 GLN 62 3HB GLN 62 -13.613 -1.465 -3.967 544 HG2 GLN 62 2HG GLN 62 -15.679 -0.179 -3.905 545 HG3 GLN 62 3HG GLN 62 -14.631 0.293 -2.564 546 HE21 GLN 62 1HE2 GLN 62 -15.594 2.297 -2.321 547 HE22 GLN 62 2HE2 GLN 62 -15.418 3.582 -3.457 548 H LEU 63 H LEU 63 -11.313 -1.896 -2.658 549 HA LEU 63 HA LEU 63 -11.797 -1.146 0.016 550 HB2 LEU 63 2HB LEU 63 -9.745 -3.100 -1.115 551 HB3 LEU 63 3HB LEU 63 -10.150 -2.970 0.593 552 HG LEU 63 HG LEU 63 -12.062 -3.824 -1.617 553 HD11 LEU 63 1HD1 LEU 63 -10.791 -5.480 0.576 554 HD12 LEU 63 2HD1 LEU 63 -10.386 -5.539 -1.141 555 HD13 LEU 63 3HD1 LEU 63 -11.986 -6.040 -0.599 556 HD21 LEU 63 3HD2 LEU 63 -12.508 -3.643 1.378 557 HD22 LEU 63 1HD2 LEU 63 -13.630 -4.347 0.208 558 HD23 LEU 63 2HD2 LEU 63 -13.256 -2.629 0.139 559 H LEU 64 H LEU 64 -9.029 -0.700 -2.098 560 HA LEU 64 HA LEU 64 -7.172 0.423 -0.314 561 HB2 LEU 64 2HB LEU 64 -6.546 -0.388 -2.509 562 HB3 LEU 64 3HB LEU 64 -7.607 0.756 -3.300 563 HG LEU 64 HG LEU 64 -5.290 1.829 -1.668 564 HD11 LEU 64 1HD1 LEU 64 -3.820 1.722 -3.619 565 HD12 LEU 64 2HD1 LEU 64 -5.031 0.779 -4.493 566 HD13 LEU 64 3HD1 LEU 64 -4.261 0.115 -3.050 567 HD21 LEU 64 3HD2 LEU 64 -6.877 3.469 -2.597 568 HD22 LEU 64 1HD2 LEU 64 -6.621 2.822 -4.221 569 HD23 LEU 64 2HD2 LEU 64 -5.303 3.628 -3.366 570 H LYS 65 H LYS 65 -9.623 1.982 -2.421 571 HA LYS 65 HA LYS 65 -9.097 4.671 -1.868 572 HB2 LYS 65 2HB LYS 65 -11.700 3.277 -2.607 573 HB3 LYS 65 3HB LYS 65 -11.578 5.031 -2.455 574 HG2 LYS 65 2HG LYS 65 -9.865 5.060 -4.241 575 HG3 LYS 65 3HG LYS 65 -10.017 3.308 -4.408 576 HD2 LYS 65 2HD LYS 65 -11.295 4.557 -6.139 577 HD3 LYS 65 3HD LYS 65 -12.326 3.521 -5.149 578 HE2 LYS 65 2HE LYS 65 -13.325 5.763 -5.609 579 HE3 LYS 65 3HE LYS 65 -13.131 5.447 -3.887 580 HZ1 LYS 65 3HZ LYS 65 -11.129 6.805 -3.902 581 HZ2 LYS 65 1HZ LYS 65 -12.452 7.688 -4.472 582 HZ3 LYS 65 2HZ LYS 65 -11.306 7.092 -5.557 583 H GLU 66 H GLU 66 -11.582 2.594 -0.401 584 HA GLU 66 HA GLU 66 -12.628 4.312 1.500 585 HB2 GLU 66 2HB GLU 66 -12.276 1.293 1.802 586 HB3 GLU 66 3HB GLU 66 -13.425 2.296 2.688 587 HG2 GLU 66 2HG GLU 66 -13.457 1.592 -0.257 588 HG3 GLU 66 3HG GLU 66 -14.614 1.105 0.974 589 H MET 67 H MET 67 -9.941 2.040 1.779 590 HA MET 67 HA MET 67 -9.375 2.246 4.488 591 HB2 MET 67 2HB MET 67 -8.496 0.578 2.792 592 HB3 MET 67 3HB MET 67 -7.338 1.793 2.278 593 HG2 MET 67 2HG MET 67 -6.275 1.772 4.450 594 HG3 MET 67 3HG MET 67 -7.528 0.708 5.096 595 HE1 MET 67 3HE MET 67 -6.797 -2.539 2.846 596 HE2 MET 67 1HE MET 67 -7.799 -1.192 2.306 597 HE3 MET 67 2HE MET 67 -7.962 -1.809 3.951 598 H LEU 68 H LEU 68 -7.869 4.050 1.763 599 HA LEU 68 HA LEU 68 -6.045 5.507 3.392 600 HB2 LEU 68 2HB LEU 68 -6.975 5.985 0.540 601 HB3 LEU 68 3HB LEU 68 -5.655 6.867 1.303 602 HG LEU 68 HG LEU 68 -5.699 3.858 0.796 603 HD11 LEU 68 1HD1 LEU 68 -4.079 6.000 -0.595 604 HD12 LEU 68 2HD1 LEU 68 -5.456 5.133 -1.281 605 HD13 LEU 68 3HD1 LEU 68 -3.984 4.256 -0.873 606 HD21 LEU 68 3HD2 LEU 68 -3.501 5.619 1.929 607 HD22 LEU 68 1HD2 LEU 68 -3.339 3.909 1.505 608 HD23 LEU 68 2HD2 LEU 68 -4.421 4.392 2.804 609 H GLU 69 H GLU 69 -9.332 6.155 2.328 610 HA GLU 69 HA GLU 69 -9.402 8.922 3.145 611 HB2 GLU 69 2HB GLU 69 -11.640 6.934 2.546 612 HB3 GLU 69 3HB GLU 69 -11.892 8.661 2.831 613 HG2 GLU 69 2HG GLU 69 -10.554 9.225 0.873 614 HG3 GLU 69 3HG GLU 69 -10.150 7.526 0.620 615 H LEU 70 H LEU 70 -10.121 5.836 4.712 616 HA LEU 70 HA LEU 70 -11.095 6.907 7.189 617 HB2 LEU 70 2HB LEU 70 -9.812 4.220 6.539 618 HB3 LEU 70 3HB LEU 70 -10.560 4.604 8.085 619 HG LEU 70 HG LEU 70 -12.066 4.609 5.437 620 HD11 LEU 70 1HD1 LEU 70 -13.043 2.470 6.093 621 HD12 LEU 70 2HD1 LEU 70 -12.004 2.414 7.521 622 HD13 LEU 70 3HD1 LEU 70 -11.295 2.341 5.904 623 HD21 LEU 70 3HD2 LEU 70 -13.087 6.032 7.148 624 HD22 LEU 70 1HD2 LEU 70 -13.089 4.685 8.291 625 HD23 LEU 70 2HD2 LEU 70 -14.082 4.614 6.832 626 H ILE 71 H ILE 71 -7.897 6.072 5.920 627 HA ILE 71 HA ILE 71 -6.399 6.424 8.334 628 HB ILE 71 HB ILE 71 -5.446 6.468 5.429 629 HG12 ILE 71 2HG1 ILE 71 -5.252 4.198 7.467 630 HG13 ILE 71 3HG1 ILE 71 -6.498 4.304 6.236 631 HG21 ILE 71 1HG2 ILE 71 -3.796 7.599 6.818 632 HG22 ILE 71 2HG2 ILE 71 -3.174 6.013 6.381 633 HG23 ILE 71 3HG2 ILE 71 -3.821 6.284 7.996 634 HD11 ILE 71 3HD1 ILE 71 -4.792 4.142 4.485 635 HD12 ILE 71 1HD1 ILE 71 -4.763 2.760 5.581 636 HD13 ILE 71 2HD1 ILE 71 -3.541 4.020 5.726 637 H SER 72 H SER 72 -7.452 8.577 5.744 638 HA SER 72 HA SER 72 -5.809 10.803 6.212 639 HB2 SER 72 2HB SER 72 -7.273 10.550 4.209 640 HB3 SER 72 3HB SER 72 -8.700 10.760 5.222 641 HG SER 72 HG SER 72 -6.673 12.654 4.634 642 H LYS 73 H LYS 73 -8.796 9.701 7.769 643 HA LYS 73 HA LYS 73 -9.194 11.951 9.484 644 HB2 LYS 73 2HB LYS 73 -10.189 9.074 9.708 645 HB3 LYS 73 3HB LYS 73 -10.754 10.417 10.706 646 HG2 LYS 73 2HG LYS 73 -11.607 11.553 8.688 647 HG3 LYS 73 3HG LYS 73 -11.055 10.198 7.694 648 HD2 LYS 73 2HD LYS 73 -12.626 8.689 8.779 649 HD3 LYS 73 3HD LYS 73 -13.064 9.924 9.965 650 HE2 LYS 73 2HE LYS 73 -13.600 10.093 6.979 651 HE3 LYS 73 3HE LYS 73 -14.792 9.668 8.210 652 HZ1 LYS 73 3HZ LYS 73 -14.989 11.979 7.615 653 HZ2 LYS 73 1HZ LYS 73 -13.364 12.267 7.981 654 HZ3 LYS 73 2HZ LYS 73 -14.448 11.863 9.214 655 H LEU 74 H LEU 74 -7.453 8.899 9.738 656 HA LEU 74 HA LEU 74 -6.835 9.057 12.542 657 HB2 LEU 74 2HB LEU 74 -5.590 7.369 10.333 658 HB3 LEU 74 3HB LEU 74 -5.349 7.117 12.058 659 HG LEU 74 HG LEU 74 -8.014 6.834 10.602 660 HD11 LEU 74 1HD1 LEU 74 -6.201 4.651 11.664 661 HD12 LEU 74 2HD1 LEU 74 -6.480 5.042 9.965 662 HD13 LEU 74 3HD1 LEU 74 -7.804 4.427 10.949 663 HD21 LEU 74 3HD2 LEU 74 -8.859 5.875 12.701 664 HD22 LEU 74 1HD2 LEU 74 -8.336 7.542 12.921 665 HD23 LEU 74 2HD2 LEU 74 -7.318 6.215 13.492 666 H GLY 75 H GLY 75 -5.360 10.257 9.630 667 HA2 GLY 75 2HA GLY 75 -3.732 11.826 9.310 668 HA3 GLY 75 3HA GLY 75 -3.566 11.971 11.051 669 H TYR 76 H TYR 76 -3.167 8.923 9.320 670 HA TYR 76 HA TYR 76 -0.351 8.740 10.157 671 HB2 TYR 76 2HB TYR 76 -2.038 6.636 8.733 672 HB3 TYR 76 3HB TYR 76 -0.466 6.384 9.474 673 HD1 TYR 76 HD1 TYR 76 -1.380 8.139 12.053 674 HD2 TYR 76 HD2 TYR 76 -2.953 4.744 9.983 675 HE1 TYR 76 HE1 TYR 76 -2.454 7.359 14.115 676 HE2 TYR 76 HE2 TYR 76 -4.024 3.977 12.045 677 HH TYR 76 HH TYR 76 -4.379 5.929 14.753 678 H LYS 77 H LYS 77 1.367 8.834 8.738 679 HA LYS 77 HA LYS 77 0.866 9.774 6.040 680 HB2 LYS 77 2HB LYS 77 2.792 10.549 7.647 681 HB3 LYS 77 3HB LYS 77 3.633 9.094 7.128 682 HG2 LYS 77 2HG LYS 77 2.622 11.236 5.216 683 HG3 LYS 77 3HG LYS 77 4.246 11.236 5.900 684 HD2 LYS 77 2HD LYS 77 4.801 9.177 4.744 685 HD3 LYS 77 3HD LYS 77 3.133 8.952 4.223 686 HE2 LYS 77 2HE LYS 77 4.550 9.758 2.383 687 HE3 LYS 77 3HE LYS 77 3.284 10.919 2.778 688 HZ1 LYS 77 3HZ LYS 77 4.901 12.240 3.981 689 HZ2 LYS 77 1HZ LYS 77 5.421 11.988 2.392 690 HZ3 LYS 77 2HZ LYS 77 6.120 11.113 3.660 691 H VAL 78 H VAL 78 0.365 8.359 4.506 692 HA VAL 78 HA VAL 78 1.423 5.610 4.563 693 HB VAL 78 HB VAL 78 -0.848 6.764 2.886 694 HG11 VAL 78 1HG1 VAL 78 0.073 3.876 3.187 695 HG12 VAL 78 2HG1 VAL 78 0.231 4.868 1.734 696 HG13 VAL 78 3HG1 VAL 78 -1.368 4.408 2.315 697 HG21 VAL 78 3HG2 VAL 78 -0.927 4.963 5.334 698 HG22 VAL 78 1HG2 VAL 78 -2.325 5.453 4.370 699 HG23 VAL 78 2HG2 VAL 78 -1.413 6.661 5.276 700 H PHE 79 H PHE 79 2.721 4.810 3.041 701 HA PHE 79 HA PHE 79 3.398 6.393 0.631 702 HB2 PHE 79 2HB PHE 79 4.863 4.072 1.981 703 HB3 PHE 79 3HB PHE 79 5.394 4.889 0.514 704 HD1 PHE 79 HD2 PHE 79 5.006 5.226 4.191 705 HD2 PHE 79 HD1 PHE 79 6.441 7.072 0.613 706 HE1 PHE 79 HE2 PHE 79 6.243 6.871 5.528 707 HE2 PHE 79 HE1 PHE 79 7.666 8.711 1.960 708 HZ PHE 79 HZ PHE 79 7.571 8.616 4.416 709 H LEU 80 H LEU 80 2.335 5.672 -1.145 710 HA LEU 80 HA LEU 80 1.005 3.036 -1.076 711 HB2 LEU 80 2HB LEU 80 -0.544 4.886 -1.213 712 HB3 LEU 80 3HB LEU 80 0.350 5.604 -2.540 713 HG LEU 80 HG LEU 80 -0.308 3.660 -4.003 714 HD11 LEU 80 1HD1 LEU 80 -2.076 2.135 -3.298 715 HD12 LEU 80 2HD1 LEU 80 -2.075 2.848 -1.683 716 HD13 LEU 80 3HD1 LEU 80 -0.656 1.977 -2.268 717 HD21 LEU 80 3HD2 LEU 80 -1.594 5.723 -4.120 718 HD22 LEU 80 1HD2 LEU 80 -2.631 5.191 -2.792 719 HD23 LEU 80 2HD2 LEU 80 -2.649 4.330 -4.336 720 H LEU 81 H LEU 81 1.696 1.500 -2.468 721 HA LEU 81 HA LEU 81 3.139 2.287 -4.921 722 HB2 LEU 81 2HB LEU 81 4.449 0.850 -3.351 723 HB3 LEU 81 3HB LEU 81 3.210 -0.389 -3.467 724 HG LEU 81 HG LEU 81 3.705 -0.721 -5.866 725 HD11 LEU 81 1HD1 LEU 81 5.741 1.496 -5.514 726 HD12 LEU 81 2HD1 LEU 81 4.293 1.525 -6.523 727 HD13 LEU 81 3HD1 LEU 81 5.623 0.448 -6.931 728 HD21 LEU 81 3HD2 LEU 81 5.003 -2.033 -4.255 729 HD22 LEU 81 1HD2 LEU 81 6.241 -0.772 -4.200 730 HD23 LEU 81 2HD2 LEU 81 5.954 -1.673 -5.693 731 H LEU 82 H LEU 82 1.824 2.225 -6.635 732 HA LEU 82 HA LEU 82 -0.282 0.164 -6.829 733 HB2 LEU 82 2HB LEU 82 0.152 2.755 -8.357 734 HB3 LEU 82 3HB LEU 82 -1.110 1.593 -8.742 735 HG LEU 82 HG LEU 82 -0.885 3.162 -6.138 736 HD11 LEU 82 1HD1 LEU 82 -1.528 4.589 -8.019 737 HD12 LEU 82 2HD1 LEU 82 -2.859 4.375 -6.885 738 HD13 LEU 82 3HD1 LEU 82 -2.854 3.491 -8.415 739 HD21 LEU 82 3HD2 LEU 82 -3.055 1.257 -7.074 740 HD22 LEU 82 1HD2 LEU 82 -3.107 2.253 -5.613 741 HD23 LEU 82 2HD2 LEU 82 -1.909 0.973 -5.761 742 H GLN 83 H GLN 83 0.303 -1.587 -7.905 743 HA GLN 83 HA GLN 83 2.149 -1.458 -10.201 744 HB2 GLN 83 2HB GLN 83 2.805 -2.985 -8.268 745 HB3 GLN 83 3HB GLN 83 1.356 -3.929 -8.578 746 HG2 GLN 83 2HG GLN 83 3.478 -3.515 -10.706 747 HG3 GLN 83 3HG GLN 83 3.606 -4.791 -9.505 748 HE21 GLN 83 1HE2 GLN 83 3.406 -5.002 -12.413 749 HE22 GLN 83 2HE2 GLN 83 2.028 -5.993 -12.732 750 H ASP 84 H ASP 84 1.024 -1.271 -11.956 751 HA ASP 84 HA ASP 84 -1.292 -3.036 -12.472 752 HB2 ASP 84 2HB ASP 84 -1.009 -0.083 -13.191 753 HB3 ASP 84 3HB ASP 84 -2.141 -1.149 -14.019 754 H GLN 85 H GLN 85 -1.672 -3.007 -14.965 755 HA GLN 85 HA GLN 85 0.904 -3.773 -16.193 756 HB2 GLN 85 2HB GLN 85 -1.937 -4.471 -17.066 757 HB3 GLN 85 3HB GLN 85 -0.446 -5.137 -17.734 758 HG2 GLN 85 2HG GLN 85 0.037 -6.161 -15.498 759 HG3 GLN 85 3HG GLN 85 -1.518 -5.555 -14.921 760 HE21 GLN 85 1HE2 GLN 85 -2.307 -7.625 -14.492 761 HE22 GLN 85 2HE2 GLN 85 -2.728 -8.747 -15.736 762 H ASP 86 H ASP 86 -1.877 -1.619 -16.560 763 HA ASP 86 HA ASP 86 -0.674 -0.403 -18.983 764 HB2 ASP 86 2HB ASP 86 -3.061 -1.097 -19.224 765 HB3 ASP 86 3HB ASP 86 -3.506 -0.055 -17.870 766 H GLU 87 H GLU 87 0.252 1.543 -18.809 767 HA GLU 87 HA GLU 87 0.648 2.685 -16.195 768 HB2 GLU 87 2HB GLU 87 1.697 3.459 -18.933 769 HB3 GLU 87 3HB GLU 87 2.114 4.339 -17.461 770 HG2 GLU 87 2HG GLU 87 3.056 2.243 -16.512 771 HG3 GLU 87 3HG GLU 87 2.722 1.422 -18.041 772 H ASN 88 H ASN 88 -1.477 3.453 -18.875 773 HA ASN 88 HA ASN 88 -1.817 6.251 -18.319 774 HB2 ASN 88 2HB ASN 88 -3.795 4.415 -19.747 775 HB3 ASN 88 3HB ASN 88 -3.729 6.177 -19.846 776 HD21 ASN 88 1HD2 ASN 88 -2.293 3.183 -20.873 777 HD22 ASN 88 2HD2 ASN 88 -1.301 3.854 -22.119 778 H GLU 89 H GLU 89 -3.543 3.296 -17.422 779 HA GLU 89 HA GLU 89 -5.646 4.613 -15.911 780 HB2 GLU 89 2HB GLU 89 -4.918 1.652 -16.150 781 HB3 GLU 89 3HB GLU 89 -6.391 2.285 -15.403 782 HG2 GLU 89 2HG GLU 89 -7.071 3.238 -17.567 783 HG3 GLU 89 3HG GLU 89 -5.604 2.622 -18.315 784 H LEU 90 H LEU 90 -2.684 2.822 -15.295 785 HA LEU 90 HA LEU 90 -2.549 2.719 -12.526 786 HB2 LEU 90 2HB LEU 90 -0.929 1.647 -13.954 787 HB3 LEU 90 3HB LEU 90 -0.434 3.171 -14.655 788 HG LEU 90 HG LEU 90 0.792 3.794 -12.663 789 HD11 LEU 90 1HD1 LEU 90 0.932 2.338 -10.682 790 HD12 LEU 90 2HD1 LEU 90 -0.323 1.299 -11.361 791 HD13 LEU 90 3HD1 LEU 90 -0.692 2.973 -10.930 792 HD21 LEU 90 3HD2 LEU 90 1.967 2.322 -14.226 793 HD22 LEU 90 1HD2 LEU 90 1.340 0.892 -13.396 794 HD23 LEU 90 2HD2 LEU 90 2.468 1.973 -12.573 795 H GLU 91 H GLU 91 -1.509 5.373 -14.690 796 HA GLU 91 HA GLU 91 -0.724 7.154 -12.603 797 HB2 GLU 91 2HB GLU 91 0.270 7.254 -14.863 798 HB3 GLU 91 3HB GLU 91 -1.285 7.710 -15.540 799 HG2 GLU 91 2HG GLU 91 0.141 9.669 -15.352 800 HG3 GLU 91 3HG GLU 91 -1.236 9.829 -14.270 801 H GLU 92 H GLU 92 -3.658 6.827 -14.602 802 HA GLU 92 HA GLU 92 -5.043 9.141 -14.004 803 HB2 GLU 92 2HB GLU 92 -5.575 6.921 -15.515 804 HB3 GLU 92 3HB GLU 92 -6.665 6.604 -14.184 805 HG2 GLU 92 2HG GLU 92 -6.670 9.140 -15.849 806 HG3 GLU 92 3HG GLU 92 -7.689 7.746 -16.150 807 H PHE 93 H PHE 93 -5.019 6.070 -12.251 808 HA PHE 93 HA PHE 93 -6.835 6.948 -10.162 809 HB2 PHE 93 2HB PHE 93 -6.797 4.617 -11.068 810 HB3 PHE 93 3HB PHE 93 -5.165 4.410 -10.452 811 HD1 PHE 93 HD1 PHE 93 -8.581 5.386 -9.195 812 HD2 PHE 93 HD2 PHE 93 -4.954 3.235 -8.423 813 HE1 PHE 93 HE1 PHE 93 -9.533 4.505 -7.106 814 HE2 PHE 93 HE2 PHE 93 -5.919 2.372 -6.335 815 HZ PHE 93 HZ PHE 93 -8.206 3.003 -5.676 816 H LYS 94 H LYS 94 -3.351 6.508 -10.569 817 HA LYS 94 HA LYS 94 -2.455 6.677 -7.918 818 HB2 LYS 94 2HB LYS 94 -0.872 5.911 -9.468 819 HB3 LYS 94 3HB LYS 94 -1.229 7.183 -10.626 820 HG2 LYS 94 2HG LYS 94 -0.009 8.809 -9.291 821 HG3 LYS 94 3HG LYS 94 0.280 7.605 -8.032 822 HD2 LYS 94 2HD LYS 94 1.716 6.318 -9.476 823 HD3 LYS 94 3HD LYS 94 1.243 7.267 -10.892 824 HE2 LYS 94 2HE LYS 94 2.809 8.332 -8.515 825 HE3 LYS 94 3HE LYS 94 3.501 7.867 -10.072 826 HZ1 LYS 94 3HZ LYS 94 3.204 10.200 -10.086 827 HZ2 LYS 94 1HZ LYS 94 1.606 10.086 -9.544 828 HZ3 LYS 94 2HZ LYS 94 2.009 9.557 -11.096 829 H ARG 95 H ARG 95 -2.844 9.218 -10.361 830 HA ARG 95 HA ARG 95 -1.603 11.297 -8.933 831 HB2 ARG 95 2HB ARG 95 -2.410 12.763 -10.711 832 HB3 ARG 95 3HB ARG 95 -1.829 11.242 -11.389 833 HG2 ARG 95 2HG ARG 95 -4.268 10.482 -11.444 834 HG3 ARG 95 3HG ARG 95 -4.703 12.154 -11.063 835 HD2 ARG 95 2HD ARG 95 -3.227 11.140 -13.510 836 HD3 ARG 95 3HD ARG 95 -4.846 11.838 -13.459 837 HE ARG 95 HE ARG 95 -2.311 13.233 -13.464 838 HH11 ARG 95 1HH1 ARG 95 -5.746 13.564 -12.761 839 HH12 ARG 95 2HH1 ARG 95 -5.720 15.293 -12.900 840 HH21 ARG 95 1HH2 ARG 95 -2.294 15.470 -13.633 841 HH22 ARG 95 2HH2 ARG 95 -3.755 16.377 -13.398 842 H LYS 96 H LYS 96 -4.872 10.098 -8.864 843 HA LYS 96 HA LYS 96 -6.275 12.287 -7.745 844 HB2 LYS 96 2HB LYS 96 -6.781 9.312 -7.253 845 HB3 LYS 96 3HB LYS 96 -7.946 10.615 -7.048 846 HG2 LYS 96 2HG LYS 96 -7.915 11.022 -9.485 847 HG3 LYS 96 3HG LYS 96 -6.751 9.704 -9.681 848 HD2 LYS 96 2HD LYS 96 -8.469 8.141 -8.658 849 HD3 LYS 96 3HD LYS 96 -9.616 9.486 -8.671 850 HE2 LYS 96 2HE LYS 96 -8.307 8.220 -11.103 851 HE3 LYS 96 3HE LYS 96 -9.984 8.024 -10.593 852 HZ1 LYS 96 3HZ LYS 96 -8.727 10.569 -11.457 853 HZ2 LYS 96 1HZ LYS 96 -10.339 10.382 -10.978 854 HZ3 LYS 96 2HZ LYS 96 -9.773 9.620 -12.381 855 H ILE 97 H ILE 97 -4.578 9.554 -6.359 856 HA ILE 97 HA ILE 97 -5.226 10.146 -3.596 857 HB ILE 97 HB ILE 97 -3.436 7.987 -4.813 858 HG12 ILE 97 2HG1 ILE 97 -6.369 7.701 -3.987 859 HG13 ILE 97 3HG1 ILE 97 -5.856 8.004 -5.644 860 HG21 ILE 97 1HG2 ILE 97 -3.006 8.301 -2.418 861 HG22 ILE 97 2HG2 ILE 97 -3.816 6.760 -2.693 862 HG23 ILE 97 3HG2 ILE 97 -4.726 8.133 -2.060 863 HD11 ILE 97 3HD1 ILE 97 -4.642 5.886 -5.657 864 HD12 ILE 97 1HD1 ILE 97 -6.354 5.672 -5.298 865 HD13 ILE 97 2HD1 ILE 97 -5.166 5.576 -4.001 866 H GLU 98 H GLU 98 -2.513 10.408 -5.783 867 HA GLU 98 HA GLU 98 -0.415 10.903 -3.935 868 HB2 GLU 98 2HB GLU 98 -0.213 10.106 -6.357 869 HB3 GLU 98 3HB GLU 98 -0.581 11.746 -6.872 870 HG2 GLU 98 2HG GLU 98 1.791 11.061 -5.106 871 HG3 GLU 98 3HG GLU 98 1.884 11.021 -6.862 872 H SER 99 H SER 99 -2.788 12.878 -5.623 873 HA SER 99 HA SER 99 -1.728 15.436 -4.933 874 HB2 SER 99 2HB SER 99 -3.250 15.049 -6.890 875 HB3 SER 99 3HB SER 99 -4.578 14.747 -5.769 876 HG SER 99 HG SER 99 -3.049 17.141 -5.859 877 H GLN 100 H GLN 100 -3.660 13.098 -3.222 878 HA GLN 100 HA GLN 100 -4.761 14.902 -1.257 879 HB2 GLN 100 2HB GLN 100 -4.472 11.869 -1.157 880 HB3 GLN 100 3HB GLN 100 -5.416 12.843 -0.032 881 HG2 GLN 100 2HG GLN 100 -6.822 13.566 -2.025 882 HG3 GLN 100 3HG GLN 100 -5.967 12.344 -2.970 883 HE21 GLN 100 1HE2 GLN 100 -8.308 12.897 -0.445 884 HE22 GLN 100 2HE2 GLN 100 -8.885 11.271 -0.345 885 H GLY 101 H GLY 101 -1.636 13.870 -1.788 886 HA2 GLY 101 2HA GLY 101 0.201 14.585 -0.514 887 HA3 GLY 101 3HA GLY 101 -0.796 14.610 0.933 888 H TYR 102 H TYR 102 -0.490 11.993 -1.432 889 HA TYR 102 HA TYR 102 0.928 10.321 0.573 890 HB2 TYR 102 2HB TYR 102 -1.078 9.453 -1.557 891 HB3 TYR 102 3HB TYR 102 -0.128 8.338 -0.577 892 HD1 TYR 102 HD1 TYR 102 -0.310 8.899 2.094 893 HD2 TYR 102 HD2 TYR 102 -3.306 9.794 -0.820 894 HE1 TYR 102 HE1 TYR 102 -2.019 8.926 3.857 895 HE2 TYR 102 HE2 TYR 102 -5.017 9.823 0.944 896 HH TYR 102 HH TYR 102 -5.359 8.916 3.206 897 H GLU 103 H GLU 103 2.798 9.394 -0.054 898 HA GLU 103 HA GLU 103 4.047 10.167 -2.546 899 HB2 GLU 103 2HB GLU 103 5.424 10.188 -0.573 900 HB3 GLU 103 3HB GLU 103 4.937 8.564 -0.119 901 HG2 GLU 103 2HG GLU 103 7.237 8.591 -0.920 902 HG3 GLU 103 3HG GLU 103 6.215 7.616 -1.965 903 H VAL 104 H VAL 104 3.267 9.123 -4.330 904 HA VAL 104 HA VAL 104 2.920 6.181 -4.264 905 HB VAL 104 HB VAL 104 1.438 8.001 -6.207 906 HG11 VAL 104 1HG1 VAL 104 0.879 5.158 -5.267 907 HG12 VAL 104 2HG1 VAL 104 1.592 5.612 -6.816 908 HG13 VAL 104 3HG1 VAL 104 -0.076 6.059 -6.453 909 HG21 VAL 104 3HG2 VAL 104 -0.572 7.864 -4.767 910 HG22 VAL 104 1HG2 VAL 104 0.740 8.725 -3.958 911 HG23 VAL 104 2HG2 VAL 104 0.376 7.058 -3.516 912 H ARG 105 H ARG 105 3.919 5.013 -5.840 913 HA ARG 105 HA ARG 105 5.326 6.422 -8.052 914 HB2 ARG 105 2HB ARG 105 6.839 5.392 -6.305 915 HB3 ARG 105 3HB ARG 105 6.146 3.825 -6.678 916 HG2 ARG 105 2HG ARG 105 8.253 3.933 -7.793 917 HG3 ARG 105 3HG ARG 105 7.012 4.078 -9.041 918 HD2 ARG 105 2HD ARG 105 7.353 6.544 -9.062 919 HD3 ARG 105 3HD ARG 105 8.617 6.362 -7.838 920 HE ARG 105 HE ARG 105 8.788 5.148 -10.542 921 HH11 ARG 105 1HH1 ARG 105 10.345 6.930 -7.919 922 HH12 ARG 105 2HH1 ARG 105 11.874 6.999 -8.732 923 HH21 ARG 105 1HH2 ARG 105 10.799 5.311 -11.593 924 HH22 ARG 105 2HH2 ARG 105 12.130 6.089 -10.797 925 H LYS 106 H LYS 106 5.363 5.324 -10.067 926 HA LYS 106 HA LYS 106 3.253 3.348 -10.599 927 HB2 LYS 106 2HB LYS 106 5.173 4.863 -12.427 928 HB3 LYS 106 3HB LYS 106 4.001 3.678 -12.998 929 HG2 LYS 106 2HG LYS 106 2.159 5.098 -12.280 930 HG3 LYS 106 3HG LYS 106 3.293 6.258 -11.579 931 HD2 LYS 106 2HD LYS 106 2.466 7.005 -13.792 932 HD3 LYS 106 3HD LYS 106 4.214 6.763 -13.791 933 HE2 LYS 106 2HE LYS 106 3.810 4.486 -14.835 934 HE3 LYS 106 3HE LYS 106 2.107 4.924 -14.981 935 HZ1 LYS 106 3HZ LYS 106 3.455 5.295 -17.003 936 HZ2 LYS 106 1HZ LYS 106 4.330 6.474 -16.175 937 HZ3 LYS 106 2HZ LYS 106 2.678 6.694 -16.450 938 H VAL 107 H VAL 107 3.706 1.246 -11.145 939 HA VAL 107 HA VAL 107 6.322 0.459 -12.096 940 HB VAL 107 HB VAL 107 6.637 0.294 -9.646 941 HG11 VAL 107 1HG1 VAL 107 5.442 -1.350 -8.271 942 HG12 VAL 107 2HG1 VAL 107 4.405 -1.761 -9.637 943 HG13 VAL 107 3HG1 VAL 107 4.329 -0.147 -8.928 944 HG21 VAL 107 3HG2 VAL 107 6.574 -2.436 -10.988 945 HG22 VAL 107 1HG2 VAL 107 7.512 -2.003 -9.557 946 HG23 VAL 107 2HG2 VAL 107 7.875 -1.250 -11.104 947 H THR 108 H THR 108 6.267 -1.283 -13.378 948 HA THR 108 HA THR 108 3.777 -2.890 -13.653 949 HB THR 108 HB THR 108 4.407 -3.140 -16.091 950 HG1 THR 108 HG1 THR 108 6.484 -2.636 -16.314 951 HG21 THR 108 3HG2 THR 108 3.695 -0.883 -16.843 952 HG22 THR 108 1HG2 THR 108 3.985 -0.245 -15.222 953 HG23 THR 108 2HG2 THR 108 2.707 -1.432 -15.488 954 H ASP 109 H ASP 109 7.286 -2.795 -13.463 955 HA ASP 109 HA ASP 109 7.742 -5.554 -14.248 956 HB2 ASP 109 2HB ASP 109 9.642 -3.526 -12.988 957 HB3 ASP 109 3HB ASP 109 10.112 -5.060 -13.705 958 H ASP 110 H ASP 110 8.322 -7.245 -12.852 959 HA ASP 110 HA ASP 110 7.172 -7.114 -10.229 960 HB2 ASP 110 2HB ASP 110 7.579 -9.482 -10.082 961 HB3 ASP 110 3HB ASP 110 7.015 -9.131 -11.706 962 H GLU 111 H GLU 111 10.484 -7.162 -11.497 963 HA GLU 111 HA GLU 111 11.844 -7.490 -9.001 964 HB2 GLU 111 2HB GLU 111 12.842 -6.251 -11.614 965 HB3 GLU 111 3HB GLU 111 13.866 -6.642 -10.227 966 HG2 GLU 111 2HG GLU 111 13.181 -9.040 -10.478 967 HG3 GLU 111 3HG GLU 111 12.327 -8.600 -11.960 968 H GLU 112 H GLU 112 11.092 -4.652 -11.013 969 HA GLU 112 HA GLU 112 12.178 -2.646 -9.386 970 HB2 GLU 112 2HB GLU 112 9.804 -2.499 -11.285 971 HB3 GLU 112 3HB GLU 112 10.603 -1.099 -10.588 972 HG2 GLU 112 2HG GLU 112 11.794 -3.103 -12.525 973 HG3 GLU 112 3HG GLU 112 11.334 -1.441 -12.884 974 H ALA 113 H ALA 113 8.959 -4.158 -9.366 975 HA ALA 113 HA ALA 113 7.581 -2.584 -7.546 976 HB1 ALA 113 3HB ALA 113 6.170 -4.562 -7.100 977 HB2 ALA 113 1HB ALA 113 7.376 -5.602 -7.854 978 HB3 ALA 113 2HB ALA 113 6.520 -4.399 -8.825 979 H LEU 114 H LEU 114 9.614 -5.449 -6.841 980 HA LEU 114 HA LEU 114 9.377 -5.467 -4.026 981 HB2 LEU 114 2HB LEU 114 11.785 -6.395 -5.651 982 HB3 LEU 114 3HB LEU 114 11.362 -6.907 -4.019 983 HG LEU 114 HG LEU 114 9.774 -7.539 -6.538 984 HD11 LEU 114 1HD1 LEU 114 10.527 -9.841 -6.229 985 HD12 LEU 114 2HD1 LEU 114 11.526 -9.349 -4.860 986 HD13 LEU 114 3HD1 LEU 114 11.885 -8.750 -6.483 987 HD21 LEU 114 3HD2 LEU 114 9.317 -8.506 -3.695 988 HD22 LEU 114 1HD2 LEU 114 8.438 -9.041 -5.132 989 HD23 LEU 114 2HD2 LEU 114 8.296 -7.374 -4.586 990 H LYS 115 H LYS 115 11.501 -3.703 -6.196 991 HA LYS 115 HA LYS 115 13.377 -2.747 -4.263 992 HB2 LYS 115 2HB LYS 115 12.722 -1.704 -7.051 993 HB3 LYS 115 3HB LYS 115 14.125 -1.224 -6.091 994 HG2 LYS 115 2HG LYS 115 15.007 -3.499 -6.180 995 HG3 LYS 115 3HG LYS 115 13.567 -4.052 -7.044 996 HD2 LYS 115 2HD LYS 115 14.157 -2.504 -8.927 997 HD3 LYS 115 3HD LYS 115 15.636 -2.062 -8.066 998 HE2 LYS 115 2HE LYS 115 16.383 -4.429 -8.191 999 HE3 LYS 115 3HE LYS 115 14.919 -4.834 -9.087 1000 HZ1 LYS 115 3HZ LYS 115 15.611 -3.363 -10.847 1001 HZ2 LYS 115 1HZ LYS 115 16.833 -4.489 -10.535 1002 HZ3 LYS 115 2HZ LYS 115 16.989 -2.903 -9.982 1003 H ILE 116 H ILE 116 10.487 -1.316 -5.803 1004 HA ILE 116 HA ILE 116 10.817 1.275 -4.661 1005 HB ILE 116 HB ILE 116 8.264 0.113 -5.852 1006 HG12 ILE 116 2HG1 ILE 116 10.051 -0.028 -7.538 1007 HG13 ILE 116 3HG1 ILE 116 8.927 1.236 -7.987 1008 HG21 ILE 116 1HG2 ILE 116 7.653 2.482 -6.257 1009 HG22 ILE 116 2HG2 ILE 116 9.125 2.996 -5.427 1010 HG23 ILE 116 3HG2 ILE 116 7.863 2.138 -4.541 1011 HD11 ILE 116 3HD1 ILE 116 10.514 2.919 -7.248 1012 HD12 ILE 116 1HD1 ILE 116 11.240 1.830 -8.431 1013 HD13 ILE 116 2HD1 ILE 116 11.631 1.656 -6.720 1014 H VAL 117 H VAL 117 9.122 -1.657 -3.682 1015 HA VAL 117 HA VAL 117 7.700 -0.747 -1.444 1016 HB VAL 117 HB VAL 117 9.218 -3.384 -1.793 1017 HG11 VAL 117 1HG1 VAL 117 8.827 -2.968 0.598 1018 HG12 VAL 117 2HG1 VAL 117 7.780 -4.269 0.031 1019 HG13 VAL 117 3HG1 VAL 117 7.118 -2.650 0.285 1020 HG21 VAL 117 3HG2 VAL 117 6.256 -2.773 -2.155 1021 HG22 VAL 117 1HG2 VAL 117 7.027 -4.349 -2.358 1022 HG23 VAL 117 2HG2 VAL 117 7.415 -3.029 -3.456 1023 H ARG 118 H ARG 118 11.103 -1.779 -1.756 1024 HA ARG 118 HA ARG 118 11.819 -1.238 0.952 1025 HB2 ARG 118 2HB ARG 118 13.613 -1.646 -1.482 1026 HB3 ARG 118 3HB ARG 118 14.150 -1.651 0.201 1027 HG2 ARG 118 2HG ARG 118 12.638 -3.612 0.622 1028 HG3 ARG 118 3HG ARG 118 12.259 -3.641 -1.102 1029 HD2 ARG 118 2HD ARG 118 14.976 -4.092 0.173 1030 HD3 ARG 118 3HD ARG 118 13.952 -5.322 -0.566 1031 HE ARG 118 HE ARG 118 15.540 -3.264 -1.939 1032 HH11 ARG 118 1HH1 ARG 118 13.402 -6.046 -2.271 1033 HH12 ARG 118 2HH1 ARG 118 13.811 -6.299 -3.936 1034 HH21 ARG 118 1HH2 ARG 118 16.067 -3.661 -4.106 1035 HH22 ARG 118 2HH2 ARG 118 15.308 -4.956 -4.965 1036 H GLU 119 H GLU 119 11.639 0.794 -1.908 1037 HA GLU 119 HA GLU 119 13.185 3.000 -0.935 1038 HB2 GLU 119 2HB GLU 119 10.975 2.813 -3.026 1039 HB3 GLU 119 3HB GLU 119 11.766 4.339 -2.635 1040 HG2 GLU 119 2HG GLU 119 13.155 1.870 -3.734 1041 HG3 GLU 119 3HG GLU 119 12.665 3.278 -4.679 1042 H PHE 120 H PHE 120 9.698 2.241 -0.948 1043 HA PHE 120 HA PHE 120 8.826 4.494 0.503 1044 HB2 PHE 120 2HB PHE 120 7.551 1.785 0.019 1045 HB3 PHE 120 3HB PHE 120 6.723 3.078 0.890 1046 HD1 PHE 120 HD2 PHE 120 7.982 5.348 -0.932 1047 HD2 PHE 120 HD1 PHE 120 5.865 1.720 -1.770 1048 HE1 PHE 120 HE2 PHE 120 7.160 6.304 -3.029 1049 HE2 PHE 120 HE1 PHE 120 5.060 2.714 -3.860 1050 HZ PHE 120 HZ PHE 120 5.694 4.991 -4.485 1051 H MET 121 H MET 121 9.848 1.290 1.578 1052 HA MET 121 HA MET 121 9.316 1.736 4.351 1053 HB2 MET 121 2HB MET 121 11.141 -0.289 2.993 1054 HB3 MET 121 3HB MET 121 10.798 -0.276 4.718 1055 HG2 MET 121 2HG MET 121 8.353 -0.563 4.135 1056 HG3 MET 121 3HG MET 121 8.854 -0.829 2.464 1057 HE1 MET 121 3HE MET 121 11.644 -2.475 2.977 1058 HE2 MET 121 1HE MET 121 10.465 -2.926 1.742 1059 HE3 MET 121 2HE MET 121 11.040 -4.129 2.900 1060 H GLN 122 H GLN 122 11.975 2.548 2.210 1061 HA GLN 122 HA GLN 122 13.913 3.207 4.218 1062 HB2 GLN 122 2HB GLN 122 14.603 2.716 1.923 1063 HB3 GLN 122 3HB GLN 122 13.661 4.067 1.308 1064 HG2 GLN 122 2HG GLN 122 15.158 5.654 2.436 1065 HG3 GLN 122 3HG GLN 122 16.075 4.312 3.123 1066 HE21 GLN 122 1HE2 GLN 122 15.341 6.073 0.198 1067 HE22 GLN 122 2HE2 GLN 122 16.661 5.472 -0.737 1068 H LYS 123 H LYS 123 11.602 5.116 2.303 1069 HA LYS 123 HA LYS 123 12.142 7.652 3.476 1070 HB2 LYS 123 2HB LYS 123 9.615 6.667 2.083 1071 HB3 LYS 123 3HB LYS 123 9.994 8.353 2.439 1072 HG2 LYS 123 2HG LYS 123 11.872 8.303 0.892 1073 HG3 LYS 123 3HG LYS 123 11.627 6.574 0.602 1074 HD2 LYS 123 2HD LYS 123 9.362 7.085 -0.343 1075 HD3 LYS 123 3HD LYS 123 9.667 8.807 -0.103 1076 HE2 LYS 123 2HE LYS 123 11.562 8.684 -1.677 1077 HE3 LYS 123 3HE LYS 123 11.273 6.961 -1.901 1078 HZ1 LYS 123 3HZ LYS 123 9.420 9.160 -2.661 1079 HZ2 LYS 123 1HZ LYS 123 9.104 7.508 -2.849 1080 HZ3 LYS 123 2HZ LYS 123 10.363 8.229 -3.711 1081 H ALA 124 H ALA 124 9.836 5.058 4.162 1082 HA ALA 124 HA ALA 124 8.437 6.193 6.317 1083 HB1 ALA 124 3HB ALA 124 9.079 3.267 5.818 1084 HB2 ALA 124 1HB ALA 124 7.679 4.137 5.185 1085 HB3 ALA 124 2HB ALA 124 7.839 3.873 6.924 1086 H GLY 125 H GLY 125 11.395 4.246 6.158 1087 HA2 GLY 125 2HA GLY 125 11.850 3.894 8.909 1088 HA3 GLY 125 3HA GLY 125 13.061 3.761 7.642 1089 H SER 126 H SER 126 12.549 6.571 6.763 1090 HA SER 126 HA SER 126 14.399 7.963 8.438 1091 HB2 SER 126 2HB SER 126 14.245 8.301 5.970 1092 HB3 SER 126 3HB SER 126 12.629 8.977 6.160 1093 HG SER 126 HG SER 126 14.128 10.377 7.769 1094 H LEU 127 H LEU 127 10.871 7.991 7.995 1095 HA LEU 127 HA LEU 127 10.420 10.180 9.897 1096 HB2 LEU 127 2HB LEU 127 8.460 8.440 8.348 1097 HB3 LEU 127 3HB LEU 127 8.012 9.820 9.343 1098 HG LEU 127 HG LEU 127 9.667 9.929 6.787 1099 HD11 LEU 127 1HD1 LEU 127 6.825 10.851 7.304 1100 HD12 LEU 127 2HD1 LEU 127 7.308 9.447 6.348 1101 HD13 LEU 127 3HD1 LEU 127 7.737 11.066 5.805 1102 HD21 LEU 127 3HD2 LEU 127 9.497 12.380 7.000 1103 HD22 LEU 127 1HD2 LEU 127 10.387 11.671 8.344 1104 HD23 LEU 127 2HD2 LEU 127 8.716 12.195 8.574 1105 H GLU 128 H GLU 128 10.702 6.796 9.937 1106 HA GLU 128 HA GLU 128 8.944 6.153 12.149 1107 HB2 GLU 128 2HB GLU 128 9.291 4.507 10.384 1108 HB3 GLU 128 3HB GLU 128 11.035 4.603 10.575 1109 HG2 GLU 128 2HG GLU 128 10.476 3.720 13.023 1110 HG3 GLU 128 3HG GLU 128 9.008 3.145 12.238 1111 H HIS 129 H HIS 129 12.432 5.678 11.591 1112 HA HIS 129 HA HIS 129 13.173 5.808 14.369 1113 HB2 HIS 129 2HB HIS 129 14.397 4.435 12.637 1114 HB3 HIS 129 3HB HIS 129 14.915 5.916 11.855 1115 HD1 HIS 129 HD1 HIS 129 15.593 3.702 14.761 1116 HD2 HIS 129 HD2 HIS 129 17.002 7.293 13.201 1117 HE1 HIS 129 HE1 HIS 129 17.752 4.155 15.947 1118 HE2 HIS 129 HE2 HIS 129 18.630 6.279 14.924 1119 H HIS 130 H HIS 130 12.743 7.761 15.266 1120 HA HIS 130 HA HIS 130 12.593 10.161 13.706 1121 HB2 HIS 130 2HB HIS 130 12.098 9.576 16.641 1122 HB3 HIS 130 3HB HIS 130 11.953 11.199 15.971 1123 HD1 HIS 130 HD1 HIS 130 10.054 8.127 16.461 1124 HD2 HIS 130 HD2 HIS 130 9.943 11.369 13.870 1125 HE1 HIS 130 HE1 HIS 130 7.796 8.045 15.378 1126 HE2 HIS 130 HE2 HIS 130 7.865 9.872 13.640 1127 H HIS 131 H HIS 131 14.741 10.339 12.992 1128 HA HIS 131 HA HIS 131 16.891 11.220 14.666 1129 HB2 HIS 131 2HB HIS 131 17.184 10.351 12.318 1130 HB3 HIS 131 3HB HIS 131 16.368 11.779 11.701 1131 HD1 HIS 131 HD1 HIS 131 19.651 10.563 12.909 1132 HD2 HIS 131 HD2 HIS 131 17.913 14.200 11.890 1133 HE1 HIS 131 HE1 HIS 131 21.556 12.174 12.632 1134 HE2 HIS 131 HE2 HIS 131 20.484 14.324 11.886 1135 H HIS 132 H HIS 132 14.076 12.651 13.240 1136 HA HIS 132 HA HIS 132 12.928 14.512 13.432 1137 HB2 HIS 132 2HB HIS 132 12.789 15.607 15.641 1138 HB3 HIS 132 3HB HIS 132 12.757 13.869 15.765 1139 HD1 HIS 132 HD1 HIS 132 14.675 12.715 17.056 1140 HD2 HIS 132 HD2 HIS 132 15.053 16.849 16.853 1141 HE1 HIS 132 HE1 HIS 132 16.468 13.316 18.700 1142 HE2 HIS 132 HE2 HIS 132 16.511 15.834 18.718 1143 H HIS 133 H HIS 133 13.459 15.851 11.858 1144 HA HIS 133 HA HIS 133 15.724 17.679 11.988 1145 HB2 HIS 133 2HB HIS 133 15.154 16.708 9.809 1146 HB3 HIS 133 3HB HIS 133 13.508 17.321 9.923 1147 HD1 HIS 133 HD1 HIS 133 13.105 19.624 8.962 1148 HD2 HIS 133 HD2 HIS 133 17.150 18.801 9.470 1149 HE1 HIS 133 HE1 HIS 133 14.331 21.568 7.948 1150 HE2 HIS 133 HE2 HIS 133 16.767 20.939 8.091 1151 H HIS 134 H HIS 134 12.218 18.050 11.498 1152 HA HIS 134 HA HIS 134 11.784 19.851 13.637 1153 HB2 HIS 134 2HB HIS 134 12.817 21.554 12.173 1154 HB3 HIS 134 3HB HIS 134 11.733 21.121 10.852 1155 HD1 HIS 134 HD1 HIS 134 10.245 23.118 10.595 1156 HD2 HIS 134 HD2 HIS 134 10.730 22.061 14.584 1157 HE1 HIS 134 HE1 HIS 134 8.686 24.604 11.885 1158 HE2 HIS 134 HE2 HIS 134 8.888 23.839 14.275 Start of MODEL 5 1 H1 MET 1 1H MET 1 1.540 9.540 16.115 2 H2 MET 1 2H MET 1 0.390 9.461 14.886 3 H3 MET 1 3H MET 1 1.169 10.919 15.212 4 HA MET 1 HA MET 1 2.048 9.922 13.231 5 HB2 MET 1 2HB MET 1 3.614 11.250 14.552 6 HB3 MET 1 3HB MET 1 3.902 9.912 15.660 7 HG2 MET 1 2HG MET 1 5.802 10.288 14.152 8 HG3 MET 1 3HG MET 1 5.097 8.688 13.922 9 HE1 MET 1 3HE MET 1 7.143 10.092 11.866 10 HE2 MET 1 1HE MET 1 6.388 9.711 10.318 11 HE3 MET 1 2HE MET 1 6.473 8.484 11.580 12 H LYS 2 H LYS 2 1.763 7.998 12.230 13 HA LYS 2 HA LYS 2 3.439 5.798 13.061 14 HB2 LYS 2 2HB LYS 2 1.875 4.090 13.338 15 HB3 LYS 2 3HB LYS 2 1.080 5.426 14.151 16 HG2 LYS 2 2HG LYS 2 -0.386 5.759 12.203 17 HG3 LYS 2 3HG LYS 2 0.449 4.467 11.339 18 HD2 LYS 2 2HD LYS 2 -1.223 4.168 13.869 19 HD3 LYS 2 3HD LYS 2 -1.660 3.619 12.252 20 HE2 LYS 2 2HE LYS 2 0.593 2.542 13.983 21 HE3 LYS 2 3HE LYS 2 -0.915 1.720 13.586 22 HZ1 LYS 2 3HZ LYS 2 -0.236 1.673 11.273 23 HZ2 LYS 2 1HZ LYS 2 0.920 0.918 12.247 24 HZ3 LYS 2 2HZ LYS 2 1.206 2.469 11.644 25 H ILE 3 H ILE 3 3.626 4.170 11.351 26 HA ILE 3 HA ILE 3 3.315 5.416 8.674 27 HB ILE 3 HB ILE 3 5.410 3.390 9.616 28 HG12 ILE 3 2HG1 ILE 3 5.797 6.367 8.998 29 HG13 ILE 3 3HG1 ILE 3 5.635 5.721 10.624 30 HG21 ILE 3 1HG2 ILE 3 4.927 3.168 7.205 31 HG22 ILE 3 2HG2 ILE 3 6.537 3.836 7.455 32 HG23 ILE 3 3HG2 ILE 3 5.213 4.896 6.970 33 HD11 ILE 3 3HD1 ILE 3 7.937 6.154 10.110 34 HD12 ILE 3 1HD1 ILE 3 7.857 5.125 8.682 35 HD13 ILE 3 2HD1 ILE 3 7.693 4.417 10.291 36 H LEU 4 H LEU 4 2.091 4.402 7.234 37 HA LEU 4 HA LEU 4 1.589 1.487 7.392 38 HB2 LEU 4 2HB LEU 4 -0.344 3.672 6.496 39 HB3 LEU 4 3HB LEU 4 -0.642 1.947 6.328 40 HG LEU 4 HG LEU 4 -0.277 3.326 9.018 41 HD11 LEU 4 1HD1 LEU 4 -2.705 3.157 9.298 42 HD12 LEU 4 2HD1 LEU 4 -2.872 2.525 7.657 43 HD13 LEU 4 3HD1 LEU 4 -2.309 4.180 7.915 44 HD21 LEU 4 3HD2 LEU 4 -1.211 1.247 9.931 45 HD22 LEU 4 1HD2 LEU 4 0.269 0.936 9.026 46 HD23 LEU 4 2HD2 LEU 4 -1.297 0.558 8.307 47 H ILE 5 H ILE 5 2.614 0.541 5.704 48 HA ILE 5 HA ILE 5 3.072 2.032 3.204 49 HB ILE 5 HB ILE 5 3.947 -0.830 3.843 50 HG12 ILE 5 2HG1 ILE 5 4.905 0.681 5.570 51 HG13 ILE 5 3HG1 ILE 5 6.153 0.022 4.523 52 HG21 ILE 5 1HG2 ILE 5 5.638 -0.443 2.068 53 HG22 ILE 5 2HG2 ILE 5 4.965 1.160 1.768 54 HG23 ILE 5 3HG2 ILE 5 3.992 -0.280 1.457 55 HD11 ILE 5 3HD1 ILE 5 6.583 2.344 5.038 56 HD12 ILE 5 1HD1 ILE 5 5.006 2.809 4.399 57 HD13 ILE 5 2HD1 ILE 5 6.242 2.164 3.318 58 H LEU 6 H LEU 6 1.263 2.025 1.924 59 HA LEU 6 HA LEU 6 -0.526 -0.310 1.846 60 HB2 LEU 6 2HB LEU 6 -1.215 2.266 1.993 61 HB3 LEU 6 3HB LEU 6 -0.955 2.254 0.261 62 HG LEU 6 HG LEU 6 -3.335 1.979 0.780 63 HD11 LEU 6 1HD1 LEU 6 -2.248 -0.645 -0.303 64 HD12 LEU 6 2HD1 LEU 6 -2.617 0.800 -1.242 65 HD13 LEU 6 3HD1 LEU 6 -3.916 -0.079 -0.445 66 HD21 LEU 6 3HD2 LEU 6 -2.536 -0.476 2.363 67 HD22 LEU 6 1HD2 LEU 6 -4.190 0.011 2.001 68 HD23 LEU 6 2HD2 LEU 6 -3.175 1.038 3.007 69 H ILE 7 H ILE 7 -0.224 -1.775 0.262 70 HA ILE 7 HA ILE 7 1.047 -0.994 -2.296 71 HB ILE 7 HB ILE 7 1.462 -3.598 -0.727 72 HG12 ILE 7 2HG1 ILE 7 3.443 -1.367 -1.436 73 HG13 ILE 7 3HG1 ILE 7 2.746 -1.639 0.154 74 HG21 ILE 7 1HG2 ILE 7 3.001 -4.272 -2.555 75 HG22 ILE 7 2HG2 ILE 7 2.557 -2.831 -3.470 76 HG23 ILE 7 3HG2 ILE 7 1.349 -4.076 -3.141 77 HD11 ILE 7 3HD1 ILE 7 4.606 -3.491 -1.306 78 HD12 ILE 7 1HD1 ILE 7 3.893 -3.788 0.283 79 HD13 ILE 7 2HD1 ILE 7 5.002 -2.437 0.048 80 H ASN 8 H ASN 8 -0.426 -1.174 -3.823 81 HA ASN 8 HA ASN 8 -2.453 -3.318 -3.838 82 HB2 ASN 8 2HB ASN 8 -3.403 -1.095 -4.167 83 HB3 ASN 8 3HB ASN 8 -2.227 -0.708 -5.413 84 HD21 ASN 8 1HD2 ASN 8 -2.472 -1.665 -7.482 85 HD22 ASN 8 2HD2 ASN 8 -3.962 -2.346 -7.993 86 H THR 9 H THR 9 -1.959 -5.003 -5.076 87 HA THR 9 HA THR 9 -0.212 -4.656 -7.434 88 HB THR 9 HB THR 9 1.097 -5.782 -5.715 89 HG1 THR 9 HG1 THR 9 1.443 -6.538 -7.783 90 HG21 THR 9 3HG2 THR 9 -1.110 -7.882 -5.580 91 HG22 THR 9 1HG2 THR 9 -0.695 -6.727 -4.306 92 HG23 THR 9 2HG2 THR 9 0.460 -7.975 -4.776 93 H ASN 10 H ASN 10 -0.926 -5.619 -9.286 94 HA ASN 10 HA ASN 10 -3.546 -6.866 -9.413 95 HB2 ASN 10 2HB ASN 10 -2.825 -5.386 -11.237 96 HB3 ASN 10 3HB ASN 10 -1.372 -6.339 -11.501 97 HD21 ASN 10 1HD2 ASN 10 -1.522 -8.267 -12.656 98 HD22 ASN 10 2HD2 ASN 10 -2.916 -8.702 -13.576 99 H ASN 11 H ASN 11 -0.221 -7.838 -9.209 100 HA ASN 11 HA ASN 11 -0.755 -10.623 -10.039 101 HB2 ASN 11 2HB ASN 11 1.898 -9.215 -9.549 102 HB3 ASN 11 3HB ASN 11 1.696 -10.842 -10.199 103 HD21 ASN 11 1HD2 ASN 11 3.029 -8.541 -11.431 104 HD22 ASN 11 2HD2 ASN 11 2.207 -8.258 -12.926 105 H ASP 12 H ASP 12 -1.032 -12.135 -8.562 106 HA ASP 12 HA ASP 12 -0.862 -11.833 -5.768 107 HB2 ASP 12 2HB ASP 12 -1.073 -14.338 -7.485 108 HB3 ASP 12 3HB ASP 12 -1.188 -14.360 -5.726 109 H GLU 13 H GLU 13 1.583 -12.738 -8.044 110 HA GLU 13 HA GLU 13 3.432 -14.075 -6.434 111 HB2 GLU 13 2HB GLU 13 3.959 -12.084 -8.687 112 HB3 GLU 13 3HB GLU 13 5.177 -13.153 -7.989 113 HG2 GLU 13 2HG GLU 13 3.920 -15.114 -8.741 114 HG3 GLU 13 3HG GLU 13 2.662 -14.065 -9.399 115 H LEU 14 H LEU 14 2.876 -10.572 -6.839 116 HA LEU 14 HA LEU 14 5.026 -9.715 -5.186 117 HB2 LEU 14 2HB LEU 14 2.528 -8.271 -6.119 118 HB3 LEU 14 3HB LEU 14 3.634 -7.522 -4.983 119 HG LEU 14 HG LEU 14 4.193 -6.665 -7.131 120 HD11 LEU 14 1HD1 LEU 14 6.138 -7.175 -5.712 121 HD12 LEU 14 2HD1 LEU 14 6.538 -7.308 -7.420 122 HD13 LEU 14 3HD1 LEU 14 6.287 -8.768 -6.463 123 HD21 LEU 14 3HD2 LEU 14 3.105 -8.316 -8.559 124 HD22 LEU 14 1HD2 LEU 14 4.357 -9.508 -8.193 125 HD23 LEU 14 2HD2 LEU 14 4.760 -8.042 -9.089 126 H ILE 15 H ILE 15 1.762 -10.733 -4.415 127 HA ILE 15 HA ILE 15 1.546 -9.662 -1.813 128 HB ILE 15 HB ILE 15 0.347 -12.282 -2.843 129 HG12 ILE 15 2HG1 ILE 15 -0.837 -9.462 -2.854 130 HG13 ILE 15 3HG1 ILE 15 -0.293 -10.356 -4.269 131 HG21 ILE 15 1HG2 ILE 15 0.250 -12.145 -0.381 132 HG22 ILE 15 2HG2 ILE 15 -1.363 -12.002 -1.076 133 HG23 ILE 15 3HG2 ILE 15 -0.530 -10.564 -0.482 134 HD11 ILE 15 3HD1 ILE 15 -2.688 -10.396 -4.123 135 HD12 ILE 15 1HD1 ILE 15 -2.624 -11.068 -2.494 136 HD13 ILE 15 2HD1 ILE 15 -2.061 -12.023 -3.868 137 H LYS 16 H LYS 16 2.508 -12.988 -2.785 138 HA LYS 16 HA LYS 16 3.268 -13.859 -0.208 139 HB2 LYS 16 2HB LYS 16 4.150 -15.847 -1.292 140 HB3 LYS 16 3HB LYS 16 2.674 -15.373 -2.125 141 HG2 LYS 16 2HG LYS 16 4.034 -14.353 -3.938 142 HG3 LYS 16 3HG LYS 16 5.502 -14.845 -3.097 143 HD2 LYS 16 2HD LYS 16 5.117 -16.429 -4.859 144 HD3 LYS 16 3HD LYS 16 4.761 -17.245 -3.338 145 HE2 LYS 16 2HE LYS 16 2.352 -16.917 -3.717 146 HE3 LYS 16 3HE LYS 16 2.694 -16.056 -5.221 147 HZ1 LYS 16 3HZ LYS 16 2.092 -18.338 -5.649 148 HZ2 LYS 16 1HZ LYS 16 3.341 -18.905 -4.663 149 HZ3 LYS 16 2HZ LYS 16 3.698 -18.084 -6.095 150 H LYS 17 H LYS 17 5.179 -12.457 -2.862 151 HA LYS 17 HA LYS 17 7.743 -12.990 -1.765 152 HB2 LYS 17 2HB LYS 17 6.879 -11.039 -3.947 153 HB3 LYS 17 3HB LYS 17 8.564 -11.358 -3.528 154 HG2 LYS 17 2HG LYS 17 8.271 -13.744 -4.130 155 HG3 LYS 17 3HG LYS 17 6.583 -13.431 -4.535 156 HD2 LYS 17 2HD LYS 17 7.886 -13.513 -6.586 157 HD3 LYS 17 3HD LYS 17 7.332 -11.858 -6.329 158 HE2 LYS 17 2HE LYS 17 9.538 -11.209 -5.516 159 HE3 LYS 17 3HE LYS 17 10.105 -12.876 -5.615 160 HZ1 LYS 17 3HZ LYS 17 9.292 -11.167 -7.910 161 HZ2 LYS 17 1HZ LYS 17 9.766 -12.785 -8.024 162 HZ3 LYS 17 2HZ LYS 17 10.866 -11.618 -7.501 163 H ILE 18 H ILE 18 5.874 -9.931 -1.983 164 HA ILE 18 HA ILE 18 7.679 -8.259 -0.618 165 HB ILE 18 HB ILE 18 4.653 -8.018 -0.979 166 HG12 ILE 18 2HG1 ILE 18 6.949 -6.484 -2.321 167 HG13 ILE 18 3HG1 ILE 18 6.106 -7.851 -3.042 168 HG21 ILE 18 1HG2 ILE 18 4.817 -5.659 -0.265 169 HG22 ILE 18 2HG2 ILE 18 6.510 -5.900 0.165 170 HG23 ILE 18 3HG2 ILE 18 5.248 -6.758 1.048 171 HD11 ILE 18 3HD1 ILE 18 4.028 -6.558 -3.063 172 HD12 ILE 18 1HD1 ILE 18 5.322 -5.762 -3.957 173 HD13 ILE 18 2HD1 ILE 18 4.881 -5.184 -2.351 174 H LYS 19 H LYS 19 5.063 -10.363 0.599 175 HA LYS 19 HA LYS 19 4.996 -9.626 3.293 176 HB2 LYS 19 2HB LYS 19 4.526 -12.276 1.902 177 HB3 LYS 19 3HB LYS 19 4.439 -12.179 3.660 178 HG2 LYS 19 2HG LYS 19 2.645 -10.531 3.522 179 HG3 LYS 19 3HG LYS 19 2.768 -10.506 1.761 180 HD2 LYS 19 2HD LYS 19 2.037 -12.844 1.641 181 HD3 LYS 19 3HD LYS 19 2.000 -12.955 3.405 182 HE2 LYS 19 2HE LYS 19 0.271 -11.057 1.780 183 HE3 LYS 19 3HE LYS 19 -0.249 -12.645 2.340 184 HZ1 LYS 19 3HZ LYS 19 0.074 -11.915 4.613 185 HZ2 LYS 19 1HZ LYS 19 -1.002 -10.896 3.804 186 HZ3 LYS 19 2HZ LYS 19 0.588 -10.401 4.082 187 H LYS 20 H LYS 20 7.272 -11.838 1.668 188 HA LYS 20 HA LYS 20 8.704 -12.560 4.074 189 HB2 LYS 20 2HB LYS 20 9.251 -13.063 1.117 190 HB3 LYS 20 3HB LYS 20 10.321 -13.639 2.392 191 HG2 LYS 20 2HG LYS 20 7.410 -14.428 2.024 192 HG3 LYS 20 3HG LYS 20 8.819 -15.417 1.624 193 HD2 LYS 20 2HD LYS 20 9.478 -15.464 4.008 194 HD3 LYS 20 3HD LYS 20 8.093 -14.453 4.425 195 HE2 LYS 20 2HE LYS 20 7.940 -17.244 3.239 196 HE3 LYS 20 3HE LYS 20 7.708 -16.837 4.937 197 HZ1 LYS 20 3HZ LYS 20 5.599 -17.082 3.898 198 HZ2 LYS 20 1HZ LYS 20 6.002 -15.994 2.668 199 HZ3 LYS 20 2HZ LYS 20 5.816 -15.444 4.252 200 H GLU 21 H GLU 21 9.505 -10.549 1.225 201 HA GLU 21 HA GLU 21 11.961 -9.530 1.870 202 HB2 GLU 21 2HB GLU 21 9.759 -7.759 0.738 203 HB3 GLU 21 3HB GLU 21 11.493 -7.558 0.522 204 HG2 GLU 21 2HG GLU 21 9.710 -9.678 -0.677 205 HG3 GLU 21 3HG GLU 21 10.547 -8.390 -1.523 206 H VAL 22 H VAL 22 8.844 -8.257 3.021 207 HA VAL 22 HA VAL 22 10.170 -6.232 4.676 208 HB VAL 22 HB VAL 22 8.041 -5.208 4.996 209 HG11 VAL 22 1HG1 VAL 22 8.993 -4.871 2.755 210 HG12 VAL 22 2HG1 VAL 22 7.237 -4.865 2.679 211 HG13 VAL 22 3HG1 VAL 22 8.136 -6.286 2.148 212 HG21 VAL 22 3HG2 VAL 22 6.669 -7.129 5.558 213 HG22 VAL 22 1HG2 VAL 22 6.765 -7.740 3.904 214 HG23 VAL 22 2HG2 VAL 22 5.901 -6.241 4.244 215 H GLU 23 H GLU 23 8.910 -9.432 5.066 216 HA GLU 23 HA GLU 23 8.528 -9.498 7.874 217 HB2 GLU 23 2HB GLU 23 7.971 -11.412 6.384 218 HB3 GLU 23 3HB GLU 23 9.676 -11.656 6.044 219 HG2 GLU 23 2HG GLU 23 9.053 -13.335 7.595 220 HG3 GLU 23 3HG GLU 23 10.000 -12.162 8.499 221 H ASN 24 H ASN 24 11.375 -9.677 5.820 222 HA ASN 24 HA ASN 24 13.372 -10.082 7.811 223 HB2 ASN 24 2HB ASN 24 13.657 -8.745 5.074 224 HB3 ASN 24 3HB ASN 24 14.969 -9.419 6.038 225 HD21 ASN 24 1HD2 ASN 24 13.915 -10.023 3.305 226 HD22 ASN 24 2HD2 ASN 24 13.645 -11.727 3.301 227 H GLN 25 H GLN 25 11.587 -7.283 6.774 228 HA GLN 25 HA GLN 25 13.457 -5.372 8.024 229 HB2 GLN 25 2HB GLN 25 11.111 -4.877 6.149 230 HB3 GLN 25 3HB GLN 25 12.222 -3.647 6.744 231 HG2 GLN 25 2HG GLN 25 12.982 -5.985 4.974 232 HG3 GLN 25 3HG GLN 25 12.702 -4.340 4.420 233 HE21 GLN 25 1HE2 GLN 25 14.087 -3.032 6.608 234 HE22 GLN 25 2HE2 GLN 25 15.766 -3.343 6.387 235 H GLY 26 H GLY 26 10.896 -7.132 9.054 236 HA2 GLY 26 2HA GLY 26 9.620 -7.036 10.946 237 HA3 GLY 26 3HA GLY 26 10.517 -5.601 11.394 238 H TYR 27 H TYR 27 8.338 -6.026 8.572 239 HA TYR 27 HA TYR 27 6.496 -4.007 9.723 240 HB2 TYR 27 2HB TYR 27 6.954 -4.910 6.851 241 HB3 TYR 27 3HB TYR 27 5.566 -3.930 7.320 242 HD1 TYR 27 HD2 TYR 27 9.288 -3.964 7.139 243 HD2 TYR 27 HD1 TYR 27 5.803 -1.549 7.705 244 HE1 TYR 27 HE2 TYR 27 10.661 -1.935 6.983 245 HE2 TYR 27 HE1 TYR 27 7.187 0.479 7.559 246 HH TYR 27 HH TYR 27 9.550 1.119 7.902 247 H GLN 28 H GLN 28 4.605 -4.632 10.501 248 HA GLN 28 HA GLN 28 3.671 -7.351 10.450 249 HB2 GLN 28 2HB GLN 28 2.206 -4.836 11.376 250 HB3 GLN 28 3HB GLN 28 1.761 -6.495 11.762 251 HG2 GLN 28 2HG GLN 28 3.886 -6.732 13.041 252 HG3 GLN 28 3HG GLN 28 4.258 -5.046 12.679 253 HE21 GLN 28 1HE2 GLN 28 1.042 -6.283 13.521 254 HE22 GLN 28 2HE2 GLN 28 0.927 -5.451 15.025 255 H VAL 29 H VAL 29 3.002 -8.064 8.429 256 HA VAL 29 HA VAL 29 1.617 -6.302 6.583 257 HB VAL 29 HB VAL 29 2.193 -9.276 6.194 258 HG11 VAL 29 1HG1 VAL 29 2.005 -8.740 3.780 259 HG12 VAL 29 2HG1 VAL 29 1.587 -7.072 4.178 260 HG13 VAL 29 3HG1 VAL 29 0.504 -8.387 4.640 261 HG21 VAL 29 3HG2 VAL 29 3.910 -6.895 5.419 262 HG22 VAL 29 1HG2 VAL 29 4.213 -8.577 4.969 263 HG23 VAL 29 2HG2 VAL 29 4.280 -8.090 6.664 264 H ARG 30 H ARG 30 -0.472 -6.251 6.167 265 HA ARG 30 HA ARG 30 -2.357 -8.306 7.157 266 HB2 ARG 30 2HB ARG 30 -2.896 -5.302 6.932 267 HB3 ARG 30 3HB ARG 30 -3.946 -6.503 7.664 268 HG2 ARG 30 2HG ARG 30 -1.217 -5.907 8.819 269 HG3 ARG 30 3HG ARG 30 -2.598 -4.878 9.186 270 HD2 ARG 30 2HD ARG 30 -2.186 -6.570 10.926 271 HD3 ARG 30 3HD ARG 30 -3.781 -6.733 10.194 272 HE ARG 30 HE ARG 30 -1.508 -8.478 9.432 273 HH11 ARG 30 1HH1 ARG 30 -4.860 -8.115 10.458 274 HH12 ARG 30 2HH1 ARG 30 -5.202 -9.812 10.333 275 HH21 ARG 30 1HH2 ARG 30 -1.979 -10.706 9.309 276 HH22 ARG 30 2HH2 ARG 30 -3.574 -11.273 9.686 277 H ASP 31 H ASP 31 -3.276 -9.244 5.345 278 HA ASP 31 HA ASP 31 -3.324 -7.704 2.799 279 HB2 ASP 31 2HB ASP 31 -3.630 -9.872 1.621 280 HB3 ASP 31 3HB ASP 31 -2.135 -9.810 2.538 281 H VAL 32 H VAL 32 -5.192 -7.200 1.821 282 HA VAL 32 HA VAL 32 -7.757 -7.957 3.075 283 HB VAL 32 HB VAL 32 -6.866 -5.120 2.319 284 HG11 VAL 32 1HG1 VAL 32 -9.104 -4.360 3.053 285 HG12 VAL 32 2HG1 VAL 32 -9.609 -6.040 3.269 286 HG13 VAL 32 3HG1 VAL 32 -9.201 -5.439 1.660 287 HG21 VAL 32 3HG2 VAL 32 -7.236 -4.569 4.709 288 HG22 VAL 32 1HG2 VAL 32 -6.005 -5.820 4.521 289 HG23 VAL 32 2HG2 VAL 32 -7.632 -6.256 5.049 290 H ASN 33 H ASN 33 -8.840 -8.962 1.559 291 HA ASN 33 HA ASN 33 -9.363 -7.626 -1.016 292 HB2 ASN 33 2HB ASN 33 -8.653 -10.567 -0.666 293 HB3 ASN 33 3HB ASN 33 -9.606 -10.019 -2.038 294 HD21 ASN 33 1HD2 ASN 33 -6.464 -10.112 -0.613 295 HD22 ASN 33 2HD2 ASN 33 -5.606 -9.462 -1.961 296 H ASP 34 H ASP 34 -10.562 -7.892 1.701 297 HA ASP 34 HA ASP 34 -13.303 -8.596 0.891 298 HB2 ASP 34 2HB ASP 34 -12.479 -10.531 2.119 299 HB3 ASP 34 3HB ASP 34 -11.852 -9.508 3.406 300 H SER 35 H SER 35 -14.859 -7.239 1.748 301 HA SER 35 HA SER 35 -14.272 -4.700 2.690 302 HB2 SER 35 2HB SER 35 -16.416 -5.271 1.635 303 HB3 SER 35 3HB SER 35 -16.855 -6.292 3.005 304 HG SER 35 HG SER 35 -17.492 -4.575 4.039 305 H ASP 36 H ASP 36 -15.278 -7.583 4.583 306 HA ASP 36 HA ASP 36 -15.319 -6.198 7.080 307 HB2 ASP 36 2HB ASP 36 -15.308 -9.153 6.409 308 HB3 ASP 36 3HB ASP 36 -15.279 -8.591 8.079 309 H GLU 37 H GLU 37 -12.699 -7.787 5.319 310 HA GLU 37 HA GLU 37 -10.832 -7.719 7.497 311 HB2 GLU 37 2HB GLU 37 -10.490 -7.980 4.498 312 HB3 GLU 37 3HB GLU 37 -9.081 -7.732 5.528 313 HG2 GLU 37 2HG GLU 37 -11.037 -10.041 5.664 314 HG3 GLU 37 3HG GLU 37 -9.370 -10.095 5.099 315 H LEU 38 H LEU 38 -11.660 -5.418 4.910 316 HA LEU 38 HA LEU 38 -9.807 -3.378 5.412 317 HB2 LEU 38 2HB LEU 38 -11.247 -3.294 3.466 318 HB3 LEU 38 3HB LEU 38 -12.689 -3.347 4.456 319 HG LEU 38 HG LEU 38 -11.438 -0.982 5.326 320 HD11 LEU 38 1HD1 LEU 38 -9.815 -1.031 3.525 321 HD12 LEU 38 2HD1 LEU 38 -10.914 0.332 3.348 322 HD13 LEU 38 3HD1 LEU 38 -11.108 -1.094 2.324 323 HD21 LEU 38 3HD2 LEU 38 -13.259 0.213 4.183 324 HD22 LEU 38 1HD2 LEU 38 -13.841 -1.237 5.009 325 HD23 LEU 38 2HD2 LEU 38 -13.638 -1.240 3.254 326 H LYS 39 H LYS 39 -13.081 -3.820 6.686 327 HA LYS 39 HA LYS 39 -13.240 -1.531 8.315 328 HB2 LYS 39 2HB LYS 39 -14.775 -4.162 8.381 329 HB3 LYS 39 3HB LYS 39 -15.245 -2.728 9.287 330 HG2 LYS 39 2HG LYS 39 -15.986 -1.586 7.394 331 HG3 LYS 39 3HG LYS 39 -14.914 -2.475 6.308 332 HD2 LYS 39 2HD LYS 39 -17.286 -3.087 5.941 333 HD3 LYS 39 3HD LYS 39 -16.328 -4.469 6.463 334 HE2 LYS 39 2HE LYS 39 -17.206 -4.089 8.797 335 HE3 LYS 39 3HE LYS 39 -18.280 -2.859 8.131 336 HZ1 LYS 39 3HZ LYS 39 -19.263 -4.572 6.711 337 HZ2 LYS 39 1HZ LYS 39 -19.410 -4.960 8.347 338 HZ3 LYS 39 2HZ LYS 39 -18.257 -5.742 7.400 339 H LYS 40 H LYS 40 -12.380 -4.912 9.035 340 HA LYS 40 HA LYS 40 -12.239 -4.767 11.825 341 HB2 LYS 40 2HB LYS 40 -12.294 -6.815 10.244 342 HB3 LYS 40 3HB LYS 40 -10.562 -6.626 10.077 343 HG2 LYS 40 2HG LYS 40 -11.684 -6.811 12.845 344 HG3 LYS 40 3HG LYS 40 -11.692 -8.271 11.876 345 HD2 LYS 40 2HD LYS 40 -9.135 -6.681 12.225 346 HD3 LYS 40 3HD LYS 40 -9.667 -7.804 13.475 347 HE2 LYS 40 2HE LYS 40 -8.042 -8.881 11.986 348 HE3 LYS 40 3HE LYS 40 -9.613 -9.664 11.836 349 HZ1 LYS 40 3HZ LYS 40 -9.975 -8.535 9.762 350 HZ2 LYS 40 1HZ LYS 40 -8.467 -9.292 9.698 351 HZ3 LYS 40 2HZ LYS 40 -8.558 -7.625 9.947 352 H GLU 41 H GLU 41 -9.768 -4.317 9.301 353 HA GLU 41 HA GLU 41 -7.599 -3.858 11.103 354 HB2 GLU 41 2HB GLU 41 -7.870 -3.146 8.158 355 HB3 GLU 41 3HB GLU 41 -6.389 -2.966 9.089 356 HG2 GLU 41 2HG GLU 41 -7.801 -5.514 8.319 357 HG3 GLU 41 3HG GLU 41 -6.189 -4.986 7.846 358 H MET 42 H MET 42 -10.022 -1.720 9.654 359 HA MET 42 HA MET 42 -8.757 0.747 10.366 360 HB2 MET 42 2HB MET 42 -11.643 0.065 9.667 361 HB3 MET 42 3HB MET 42 -11.118 1.708 10.043 362 HG2 MET 42 2HG MET 42 -10.035 -0.020 7.818 363 HG3 MET 42 3HG MET 42 -11.165 1.325 7.637 364 HE1 MET 42 3HE MET 42 -9.204 2.041 5.758 365 HE2 MET 42 1HE MET 42 -8.118 0.773 6.328 366 HE3 MET 42 2HE MET 42 -7.558 2.443 6.237 367 H LYS 43 H LYS 43 -10.971 -1.427 12.026 368 HA LYS 43 HA LYS 43 -11.458 0.170 14.326 369 HB2 LYS 43 2HB LYS 43 -11.337 -2.883 14.189 370 HB3 LYS 43 3HB LYS 43 -12.076 -1.933 15.475 371 HG2 LYS 43 2HG LYS 43 -13.028 -2.159 12.609 372 HG3 LYS 43 3HG LYS 43 -13.803 -2.843 14.038 373 HD2 LYS 43 2HD LYS 43 -14.284 -0.568 14.877 374 HD3 LYS 43 3HD LYS 43 -13.462 0.134 13.480 375 HE2 LYS 43 2HE LYS 43 -15.877 0.202 13.146 376 HE3 LYS 43 3HE LYS 43 -15.151 -0.912 11.986 377 HZ1 LYS 43 3HZ LYS 43 -17.174 -1.794 12.992 378 HZ2 LYS 43 1HZ LYS 43 -16.465 -1.712 14.526 379 HZ3 LYS 43 2HZ LYS 43 -15.832 -2.753 13.354 380 H LYS 44 H LYS 44 -8.955 -2.173 13.462 381 HA LYS 44 HA LYS 44 -7.466 -2.176 15.859 382 HB2 LYS 44 2HB LYS 44 -6.623 -2.729 12.982 383 HB3 LYS 44 3HB LYS 44 -5.591 -3.037 14.373 384 HG2 LYS 44 2HG LYS 44 -8.288 -4.347 13.885 385 HG3 LYS 44 3HG LYS 44 -6.727 -5.081 13.527 386 HD2 LYS 44 2HD LYS 44 -7.722 -4.277 16.294 387 HD3 LYS 44 3HD LYS 44 -7.671 -5.922 15.660 388 HE2 LYS 44 2HE LYS 44 -5.284 -4.127 16.200 389 HE3 LYS 44 3HE LYS 44 -5.766 -5.531 17.149 390 HZ1 LYS 44 3HZ LYS 44 -4.790 -5.536 14.344 391 HZ2 LYS 44 1HZ LYS 44 -5.358 -6.903 15.161 392 HZ3 LYS 44 2HZ LYS 44 -3.970 -6.109 15.701 393 H LEU 45 H LEU 45 -7.222 -0.114 12.949 394 HA LEU 45 HA LEU 45 -4.854 1.276 13.730 395 HB2 LEU 45 2HB LEU 45 -7.061 2.042 11.776 396 HB3 LEU 45 3HB LEU 45 -5.561 2.939 11.955 397 HG LEU 45 HG LEU 45 -5.810 0.069 10.968 398 HD11 LEU 45 1HD1 LEU 45 -5.081 2.586 9.437 399 HD12 LEU 45 2HD1 LEU 45 -6.603 1.701 9.319 400 HD13 LEU 45 3HD1 LEU 45 -5.104 0.944 8.786 401 HD21 LEU 45 3HD2 LEU 45 -3.719 0.343 12.216 402 HD22 LEU 45 1HD2 LEU 45 -3.304 1.764 11.255 403 HD23 LEU 45 2HD2 LEU 45 -3.389 0.172 10.495 404 H ALA 46 H ALA 46 -8.269 1.765 14.348 405 HA ALA 46 HA ALA 46 -8.029 4.390 15.516 406 HB1 ALA 46 3HB ALA 46 -10.315 2.395 15.673 407 HB2 ALA 46 1HB ALA 46 -10.106 3.637 14.438 408 HB3 ALA 46 2HB ALA 46 -10.393 4.106 16.113 409 H GLU 47 H GLU 47 -7.922 1.091 16.742 410 HA GLU 47 HA GLU 47 -8.070 1.838 19.564 411 HB2 GLU 47 2HB GLU 47 -7.629 -0.810 18.122 412 HB3 GLU 47 3HB GLU 47 -7.648 -0.671 19.877 413 HG2 GLU 47 2HG GLU 47 -9.964 0.040 19.865 414 HG3 GLU 47 3HG GLU 47 -9.972 0.151 18.108 415 H GLU 48 H GLU 48 -5.613 1.013 17.203 416 HA GLU 48 HA GLU 48 -3.530 0.783 19.276 417 HB2 GLU 48 2HB GLU 48 -3.335 -0.043 16.346 418 HB3 GLU 48 3HB GLU 48 -2.145 -0.341 17.606 419 HG2 GLU 48 2HG GLU 48 -4.901 -1.577 17.364 420 HG3 GLU 48 3HG GLU 48 -3.352 -2.386 17.161 421 H LYS 49 H LYS 49 -3.314 2.910 19.662 422 HA LYS 49 HA LYS 49 -2.863 4.923 17.641 423 HB2 LYS 49 2HB LYS 49 -2.504 5.202 20.650 424 HB3 LYS 49 3HB LYS 49 -2.811 6.478 19.476 425 HG2 LYS 49 2HG LYS 49 -5.081 5.383 19.063 426 HG3 LYS 49 3HG LYS 49 -4.738 4.354 20.453 427 HD2 LYS 49 2HD LYS 49 -6.125 6.231 21.155 428 HD3 LYS 49 3HD LYS 49 -4.522 6.385 21.882 429 HE2 LYS 49 2HE LYS 49 -5.378 8.548 21.017 430 HE3 LYS 49 3HE LYS 49 -3.891 8.055 20.202 431 HZ1 LYS 49 3HZ LYS 49 -6.658 7.803 19.156 432 HZ2 LYS 49 1HZ LYS 49 -5.292 7.175 18.384 433 HZ3 LYS 49 2HZ LYS 49 -5.458 8.838 18.590 434 H ASN 50 H ASN 50 -0.888 2.599 18.802 435 HA ASN 50 HA ASN 50 1.573 3.943 19.328 436 HB2 ASN 50 2HB ASN 50 1.031 1.066 18.464 437 HB3 ASN 50 3HB ASN 50 2.548 1.657 19.139 438 HD21 ASN 50 1HD2 ASN 50 0.747 -0.440 20.103 439 HD22 ASN 50 2HD2 ASN 50 0.299 0.007 21.711 440 H PHE 51 H PHE 51 3.536 3.709 17.930 441 HA PHE 51 HA PHE 51 2.904 4.426 15.168 442 HB2 PHE 51 2HB PHE 51 5.263 5.219 15.037 443 HB3 PHE 51 3HB PHE 51 4.356 5.975 16.331 444 HD1 PHE 51 HD2 PHE 51 7.092 3.616 15.546 445 HD2 PHE 51 HD1 PHE 51 4.994 5.663 18.658 446 HE1 PHE 51 HE2 PHE 51 8.865 3.011 17.135 447 HE2 PHE 51 HE1 PHE 51 6.778 5.048 20.253 448 HZ PHE 51 HZ PHE 51 8.710 3.719 19.490 449 H GLU 52 H GLU 52 2.635 1.674 15.966 450 HA GLU 52 HA GLU 52 4.620 -0.085 15.237 451 HB2 GLU 52 2HB GLU 52 1.617 -0.401 14.859 452 HB3 GLU 52 3HB GLU 52 2.777 -1.721 14.764 453 HG2 GLU 52 2HG GLU 52 2.219 -0.037 17.218 454 HG3 GLU 52 3HG GLU 52 1.584 -1.648 16.916 455 H LYS 53 H LYS 53 5.503 -0.725 13.421 456 HA LYS 53 HA LYS 53 5.006 0.652 10.930 457 HB2 LYS 53 2HB LYS 53 6.986 -1.529 11.715 458 HB3 LYS 53 3HB LYS 53 7.002 -0.657 10.183 459 HG2 LYS 53 2HG LYS 53 7.714 1.352 11.168 460 HG3 LYS 53 3HG LYS 53 7.161 0.874 12.776 461 HD2 LYS 53 2HD LYS 53 9.636 0.867 12.577 462 HD3 LYS 53 3HD LYS 53 8.985 -0.720 12.994 463 HE2 LYS 53 2HE LYS 53 9.290 -1.496 10.703 464 HE3 LYS 53 3HE LYS 53 9.797 0.117 10.187 465 HZ1 LYS 53 3HZ LYS 53 11.720 -1.231 10.523 466 HZ2 LYS 53 1HZ LYS 53 11.235 -1.666 12.078 467 HZ3 LYS 53 2HZ LYS 53 11.674 -0.074 11.744 468 H ILE 54 H ILE 54 3.113 -0.028 10.027 469 HA ILE 54 HA ILE 54 2.613 -2.942 9.718 470 HB ILE 54 HB ILE 54 0.530 -0.692 9.901 471 HG12 ILE 54 2HG1 ILE 54 1.243 -2.863 11.944 472 HG13 ILE 54 3HG1 ILE 54 1.621 -1.152 12.102 473 HG21 ILE 54 1HG2 ILE 54 0.107 -3.710 9.756 474 HG22 ILE 54 2HG2 ILE 54 -0.219 -2.563 8.456 475 HG23 ILE 54 3HG2 ILE 54 -1.159 -2.494 9.945 476 HD11 ILE 54 3HD1 ILE 54 -0.268 -1.762 13.470 477 HD12 ILE 54 1HD1 ILE 54 -1.136 -2.366 12.059 478 HD13 ILE 54 2HD1 ILE 54 -0.773 -0.643 12.203 479 H LEU 55 H LEU 55 2.013 -3.658 7.730 480 HA LEU 55 HA LEU 55 2.071 -1.786 5.425 481 HB2 LEU 55 2HB LEU 55 4.200 -3.128 5.736 482 HB3 LEU 55 3HB LEU 55 3.280 -4.602 5.508 483 HG LEU 55 HG LEU 55 3.280 -2.474 3.338 484 HD11 LEU 55 1HD1 LEU 55 5.432 -4.584 3.635 485 HD12 LEU 55 2HD1 LEU 55 5.641 -2.846 3.873 486 HD13 LEU 55 3HD1 LEU 55 5.225 -3.470 2.280 487 HD21 LEU 55 3HD2 LEU 55 1.704 -4.325 3.056 488 HD22 LEU 55 1HD2 LEU 55 3.023 -5.494 3.182 489 HD23 LEU 55 2HD2 LEU 55 2.959 -4.367 1.824 490 H ILE 56 H ILE 56 0.226 -1.955 4.237 491 HA ILE 56 HA ILE 56 -1.540 -4.306 4.652 492 HB ILE 56 HB ILE 56 -2.433 -1.576 3.607 493 HG12 ILE 56 2HG1 ILE 56 -1.517 -1.264 5.926 494 HG13 ILE 56 3HG1 ILE 56 -3.235 -0.915 5.803 495 HG21 ILE 56 1HG2 ILE 56 -4.694 -2.354 4.245 496 HG22 ILE 56 2HG2 ILE 56 -4.020 -3.896 4.777 497 HG23 ILE 56 3HG2 ILE 56 -3.933 -3.433 3.075 498 HD11 ILE 56 3HD1 ILE 56 -2.690 -2.090 7.856 499 HD12 ILE 56 1HD1 ILE 56 -2.027 -3.435 6.928 500 HD13 ILE 56 2HD1 ILE 56 -3.749 -3.064 6.837 501 H ILE 57 H ILE 57 -1.617 -5.615 2.894 502 HA ILE 57 HA ILE 57 -1.092 -4.548 0.169 503 HB ILE 57 HB ILE 57 -1.316 -7.498 1.006 504 HG12 ILE 57 2HG1 ILE 57 1.197 -5.839 0.462 505 HG13 ILE 57 3HG1 ILE 57 0.678 -6.426 2.035 506 HG21 ILE 57 1HG2 ILE 57 -0.335 -6.279 -1.622 507 HG22 ILE 57 2HG2 ILE 57 -1.870 -7.116 -1.384 508 HG23 ILE 57 3HG2 ILE 57 -0.356 -8.002 -1.226 509 HD11 ILE 57 3HD1 ILE 57 1.560 -8.131 -0.288 510 HD12 ILE 57 1HD1 ILE 57 1.019 -8.730 1.285 511 HD13 ILE 57 2HD1 ILE 57 2.482 -7.755 1.167 512 H SER 58 H SER 58 -2.714 -4.500 -1.331 513 HA SER 58 HA SER 58 -5.122 -6.148 -1.052 514 HB2 SER 58 2HB SER 58 -5.758 -3.863 -0.201 515 HB3 SER 58 3HB SER 58 -5.237 -3.155 -1.726 516 HG SER 58 HG SER 58 -7.478 -4.752 -1.168 517 H ASN 59 H ASN 59 -6.262 -6.236 -3.199 518 HA ASN 59 HA ASN 59 -4.428 -5.877 -5.518 519 HB2 ASN 59 2HB ASN 59 -6.579 -8.011 -5.082 520 HB3 ASN 59 3HB ASN 59 -5.661 -7.797 -6.574 521 HD21 ASN 59 1HD2 ASN 59 -3.547 -8.561 -6.677 522 HD22 ASN 59 2HD2 ASN 59 -2.817 -9.499 -5.427 523 H ASP 60 H ASP 60 -7.091 -4.621 -4.066 524 HA ASP 60 HA ASP 60 -8.634 -4.195 -6.559 525 HB2 ASP 60 2HB ASP 60 -9.743 -5.749 -4.951 526 HB3 ASP 60 3HB ASP 60 -9.704 -4.494 -3.716 527 H LYS 61 H LYS 61 -9.262 -2.196 -7.032 528 HA LYS 61 HA LYS 61 -7.878 0.021 -5.797 529 HB2 LYS 61 2HB LYS 61 -9.397 -0.447 -8.349 530 HB3 LYS 61 3HB LYS 61 -9.361 1.210 -7.765 531 HG2 LYS 61 2HG LYS 61 -7.569 0.725 -9.419 532 HG3 LYS 61 3HG LYS 61 -6.966 1.302 -7.872 533 HD2 LYS 61 2HD LYS 61 -5.505 -0.447 -8.616 534 HD3 LYS 61 3HD LYS 61 -6.429 -1.069 -7.252 535 HE2 LYS 61 2HE LYS 61 -7.934 -2.242 -8.839 536 HE3 LYS 61 3HE LYS 61 -6.953 -1.645 -10.183 537 HZ1 LYS 61 3HZ LYS 61 -5.896 -3.335 -7.977 538 HZ2 LYS 61 1HZ LYS 61 -5.088 -2.888 -9.401 539 HZ3 LYS 61 2HZ LYS 61 -6.415 -3.935 -9.470 540 H GLN 62 H GLN 62 -11.145 -1.239 -5.665 541 HA GLN 62 HA GLN 62 -12.374 1.204 -4.730 542 HB2 GLN 62 2HB GLN 62 -13.650 -0.588 -5.943 543 HB3 GLN 62 3HB GLN 62 -13.453 -1.650 -4.553 544 HG2 GLN 62 2HG GLN 62 -14.744 -0.048 -3.165 545 HG3 GLN 62 3HG GLN 62 -14.933 1.001 -4.572 546 HE21 GLN 62 1HE2 GLN 62 -16.261 0.267 -6.314 547 HE22 GLN 62 2HE2 GLN 62 -17.477 -0.932 -6.067 548 H LEU 63 H LEU 63 -11.244 -1.819 -3.217 549 HA LEU 63 HA LEU 63 -11.827 -1.160 -0.518 550 HB2 LEU 63 2HB LEU 63 -9.784 -3.050 -1.751 551 HB3 LEU 63 3HB LEU 63 -10.069 -2.944 -0.020 552 HG LEU 63 HG LEU 63 -12.175 -3.779 -2.060 553 HD11 LEU 63 1HD1 LEU 63 -10.370 -5.449 -1.901 554 HD12 LEU 63 2HD1 LEU 63 -11.869 -6.060 -1.211 555 HD13 LEU 63 3HD1 LEU 63 -10.570 -5.517 -0.146 556 HD21 LEU 63 3HD2 LEU 63 -13.486 -4.470 -0.084 557 HD22 LEU 63 1HD2 LEU 63 -13.158 -2.737 -0.071 558 HD23 LEU 63 2HD2 LEU 63 -12.237 -3.816 0.979 559 H LEU 64 H LEU 64 -9.067 -0.595 -2.637 560 HA LEU 64 HA LEU 64 -7.300 0.522 -0.732 561 HB2 LEU 64 2HB LEU 64 -6.545 -0.259 -2.893 562 HB3 LEU 64 3HB LEU 64 -7.536 0.912 -3.740 563 HG LEU 64 HG LEU 64 -5.404 1.968 -1.862 564 HD11 LEU 64 1HD1 LEU 64 -3.713 1.860 -3.639 565 HD12 LEU 64 2HD1 LEU 64 -4.813 0.902 -4.633 566 HD13 LEU 64 3HD1 LEU 64 -4.209 0.257 -3.105 567 HD21 LEU 64 3HD2 LEU 64 -5.219 3.759 -3.557 568 HD22 LEU 64 1HD2 LEU 64 -6.864 3.592 -2.945 569 HD23 LEU 64 2HD2 LEU 64 -6.450 2.954 -4.533 570 H LYS 65 H LYS 65 -9.787 1.974 -2.837 571 HA LYS 65 HA LYS 65 -9.390 4.670 -2.183 572 HB2 LYS 65 2HB LYS 65 -11.721 3.089 -3.265 573 HB3 LYS 65 3HB LYS 65 -12.050 4.711 -2.663 574 HG2 LYS 65 2HG LYS 65 -10.398 5.643 -4.245 575 HG3 LYS 65 3HG LYS 65 -10.052 4.015 -4.838 576 HD2 LYS 65 2HD LYS 65 -11.642 5.375 -6.280 577 HD3 LYS 65 3HD LYS 65 -12.230 3.782 -5.796 578 HE2 LYS 65 2HE LYS 65 -13.956 5.616 -5.663 579 HE3 LYS 65 3HE LYS 65 -13.712 4.749 -4.147 580 HZ1 LYS 65 3HZ LYS 65 -12.442 6.555 -3.292 581 HZ2 LYS 65 1HZ LYS 65 -13.872 7.197 -3.920 582 HZ3 LYS 65 2HZ LYS 65 -12.430 7.351 -4.786 583 H GLU 66 H GLU 66 -11.824 2.416 -0.808 584 HA GLU 66 HA GLU 66 -12.775 3.970 1.267 585 HB2 GLU 66 2HB GLU 66 -12.352 0.949 1.280 586 HB3 GLU 66 3HB GLU 66 -13.381 1.825 2.408 587 HG2 GLU 66 2HG GLU 66 -13.785 1.567 -0.578 588 HG3 GLU 66 3HG GLU 66 -14.715 0.756 0.680 589 H MET 67 H MET 67 -9.952 1.840 1.234 590 HA MET 67 HA MET 67 -9.087 1.936 3.844 591 HB2 MET 67 2HB MET 67 -8.142 0.539 1.952 592 HB3 MET 67 3HB MET 67 -7.295 1.967 1.375 593 HG2 MET 67 2HG MET 67 -5.675 0.815 2.564 594 HG3 MET 67 3HG MET 67 -6.212 2.017 3.725 595 HE1 MET 67 3HE MET 67 -8.052 -1.380 2.682 596 HE2 MET 67 1HE MET 67 -7.375 -2.462 3.900 597 HE3 MET 67 2HE MET 67 -6.331 -1.767 2.660 598 H LEU 68 H LEU 68 -7.921 4.027 1.186 599 HA LEU 68 HA LEU 68 -6.242 5.592 2.877 600 HB2 LEU 68 2HB LEU 68 -7.113 6.019 -0.001 601 HB3 LEU 68 3HB LEU 68 -5.884 6.983 0.813 602 HG LEU 68 HG LEU 68 -5.705 3.995 0.245 603 HD11 LEU 68 1HD1 LEU 68 -4.180 6.302 -1.000 604 HD12 LEU 68 2HD1 LEU 68 -5.457 5.359 -1.774 605 HD13 LEU 68 3HD1 LEU 68 -3.936 4.585 -1.337 606 HD21 LEU 68 3HD2 LEU 68 -3.655 5.821 1.552 607 HD22 LEU 68 1HD2 LEU 68 -3.379 4.144 1.070 608 HD23 LEU 68 2HD2 LEU 68 -4.546 4.514 2.337 609 H GLU 69 H GLU 69 -9.555 5.971 1.827 610 HA GLU 69 HA GLU 69 -9.742 8.795 2.479 611 HB2 GLU 69 2HB GLU 69 -11.906 6.724 1.901 612 HB3 GLU 69 3HB GLU 69 -12.203 8.450 2.100 613 HG2 GLU 69 2HG GLU 69 -10.798 8.939 0.135 614 HG3 GLU 69 3HG GLU 69 -10.450 7.221 -0.052 615 H LEU 70 H LEU 70 -10.475 5.731 4.087 616 HA LEU 70 HA LEU 70 -11.496 6.856 6.520 617 HB2 LEU 70 2HB LEU 70 -10.336 4.130 5.837 618 HB3 LEU 70 3HB LEU 70 -10.903 4.519 7.452 619 HG LEU 70 HG LEU 70 -12.688 4.662 4.983 620 HD11 LEU 70 1HD1 LEU 70 -11.935 2.335 5.341 621 HD12 LEU 70 2HD1 LEU 70 -13.658 2.525 5.656 622 HD13 LEU 70 3HD1 LEU 70 -12.526 2.400 7.005 623 HD21 LEU 70 3HD2 LEU 70 -13.379 4.675 7.941 624 HD22 LEU 70 1HD2 LEU 70 -14.537 4.708 6.605 625 HD23 LEU 70 2HD2 LEU 70 -13.444 6.068 6.854 626 H ILE 71 H ILE 71 -8.258 5.971 5.392 627 HA ILE 71 HA ILE 71 -6.893 6.497 7.875 628 HB ILE 71 HB ILE 71 -5.742 6.310 5.042 629 HG12 ILE 71 2HG1 ILE 71 -5.748 4.215 7.275 630 HG13 ILE 71 3HG1 ILE 71 -6.819 4.194 5.881 631 HG21 ILE 71 1HG2 ILE 71 -3.544 5.953 6.191 632 HG22 ILE 71 2HG2 ILE 71 -4.305 6.341 7.730 633 HG23 ILE 71 3HG2 ILE 71 -4.202 7.566 6.464 634 HD11 ILE 71 3HD1 ILE 71 -4.894 3.913 4.400 635 HD12 ILE 71 1HD1 ILE 71 -4.990 2.638 5.613 636 HD13 ILE 71 2HD1 ILE 71 -3.816 3.939 5.800 637 H SER 72 H SER 72 -7.934 8.429 5.149 638 HA SER 72 HA SER 72 -6.355 10.743 5.554 639 HB2 SER 72 2HB SER 72 -7.678 10.264 3.476 640 HB3 SER 72 3HB SER 72 -9.170 10.568 4.371 641 HG SER 72 HG SER 72 -7.055 12.398 3.878 642 H LYS 73 H LYS 73 -9.390 9.600 6.957 643 HA LYS 73 HA LYS 73 -9.966 11.882 8.582 644 HB2 LYS 73 2HB LYS 73 -10.775 8.969 9.009 645 HB3 LYS 73 3HB LYS 73 -11.526 10.368 9.765 646 HG2 LYS 73 2HG LYS 73 -11.556 9.752 6.798 647 HG3 LYS 73 3HG LYS 73 -12.878 9.433 7.922 648 HD2 LYS 73 2HD LYS 73 -13.099 11.855 8.359 649 HD3 LYS 73 3HD LYS 73 -11.757 12.183 7.257 650 HE2 LYS 73 2HE LYS 73 -13.079 11.215 5.386 651 HE3 LYS 73 3HE LYS 73 -14.426 10.941 6.497 652 HZ1 LYS 73 3HZ LYS 73 -14.606 13.297 6.853 653 HZ2 LYS 73 1HZ LYS 73 -14.653 12.991 5.193 654 HZ3 LYS 73 2HZ LYS 73 -13.248 13.603 5.898 655 H LEU 74 H LEU 74 -8.149 8.879 9.073 656 HA LEU 74 HA LEU 74 -7.651 9.144 11.864 657 HB2 LEU 74 2HB LEU 74 -6.173 7.506 9.762 658 HB3 LEU 74 3HB LEU 74 -5.970 7.325 11.496 659 HG LEU 74 HG LEU 74 -8.606 6.817 10.052 660 HD11 LEU 74 1HD1 LEU 74 -6.916 5.200 9.289 661 HD12 LEU 74 2HD1 LEU 74 -8.149 4.416 10.273 662 HD13 LEU 74 3HD1 LEU 74 -6.559 4.762 10.962 663 HD21 LEU 74 3HD2 LEU 74 -7.742 6.160 12.890 664 HD22 LEU 74 1HD2 LEU 74 -9.269 5.676 12.144 665 HD23 LEU 74 2HD2 LEU 74 -8.920 7.383 12.407 666 H GLY 75 H GLY 75 -5.916 10.212 8.990 667 HA2 GLY 75 2HA GLY 75 -4.204 11.697 8.669 668 HA3 GLY 75 3HA GLY 75 -4.231 12.060 10.387 669 H TYR 76 H TYR 76 -3.638 8.929 8.765 670 HA TYR 76 HA TYR 76 -1.032 8.728 10.143 671 HB2 TYR 76 2HB TYR 76 -2.698 6.597 8.759 672 HB3 TYR 76 3HB TYR 76 -1.132 6.298 9.511 673 HD1 TYR 76 HD1 TYR 76 -1.789 8.336 11.881 674 HD2 TYR 76 HD2 TYR 76 -3.815 4.923 10.271 675 HE1 TYR 76 HE1 TYR 76 -2.857 7.959 14.046 676 HE2 TYR 76 HE2 TYR 76 -4.888 4.560 12.458 677 HH TYR 76 HH TYR 76 -4.890 6.888 14.899 678 H LYS 77 H LYS 77 0.900 8.449 9.129 679 HA LYS 77 HA LYS 77 1.167 9.510 6.474 680 HB2 LYS 77 2HB LYS 77 2.843 9.619 8.571 681 HB3 LYS 77 3HB LYS 77 3.479 8.132 7.893 682 HG2 LYS 77 2HG LYS 77 3.385 10.858 6.547 683 HG3 LYS 77 3HG LYS 77 4.821 10.030 7.145 684 HD2 LYS 77 2HD LYS 77 4.584 8.309 5.411 685 HD3 LYS 77 3HD LYS 77 3.067 9.032 4.874 686 HE2 LYS 77 2HE LYS 77 4.376 11.135 4.317 687 HE3 LYS 77 3HE LYS 77 5.849 10.206 4.624 688 HZ1 LYS 77 3HZ LYS 77 3.765 9.487 2.629 689 HZ2 LYS 77 1HZ LYS 77 5.231 8.678 2.880 690 HZ3 LYS 77 2HZ LYS 77 5.231 10.255 2.270 691 H VAL 78 H VAL 78 0.538 8.272 4.813 692 HA VAL 78 HA VAL 78 1.241 5.408 4.716 693 HB VAL 78 HB VAL 78 -0.875 6.944 3.139 694 HG11 VAL 78 1HG1 VAL 78 -1.583 4.741 2.241 695 HG12 VAL 78 2HG1 VAL 78 -0.186 3.983 3.008 696 HG13 VAL 78 3HG1 VAL 78 0.049 5.167 1.723 697 HG21 VAL 78 3HG2 VAL 78 -1.479 6.549 5.483 698 HG22 VAL 78 1HG2 VAL 78 -1.142 4.826 5.299 699 HG23 VAL 78 2HG2 VAL 78 -2.478 5.568 4.412 700 H PHE 79 H PHE 79 2.553 4.619 3.218 701 HA PHE 79 HA PHE 79 3.429 6.266 0.906 702 HB2 PHE 79 2HB PHE 79 4.650 3.791 2.226 703 HB3 PHE 79 3HB PHE 79 5.233 4.506 0.736 704 HD1 PHE 79 HD2 PHE 79 4.928 5.041 4.402 705 HD2 PHE 79 HD1 PHE 79 6.689 6.434 0.761 706 HE1 PHE 79 HE2 PHE 79 6.482 6.456 5.685 707 HE2 PHE 79 HE1 PHE 79 8.235 7.842 2.053 708 HZ PHE 79 HZ PHE 79 8.136 7.854 4.510 709 H LEU 80 H LEU 80 2.218 5.772 -0.834 710 HA LEU 80 HA LEU 80 0.789 3.215 -1.015 711 HB2 LEU 80 2HB LEU 80 -0.560 5.260 -1.233 712 HB3 LEU 80 3HB LEU 80 0.436 5.814 -2.572 713 HG LEU 80 HG LEU 80 -0.361 3.896 -3.953 714 HD11 LEU 80 1HD1 LEU 80 -0.818 2.273 -2.184 715 HD12 LEU 80 2HD1 LEU 80 -2.218 2.489 -3.231 716 HD13 LEU 80 3HD1 LEU 80 -2.190 3.239 -1.632 717 HD21 LEU 80 3HD2 LEU 80 -1.537 6.023 -4.141 718 HD22 LEU 80 1HD2 LEU 80 -2.602 5.589 -2.803 719 HD23 LEU 80 2HD2 LEU 80 -2.670 4.688 -4.322 720 H LEU 81 H LEU 81 1.104 1.743 -2.565 721 HA LEU 81 HA LEU 81 2.810 2.324 -4.914 722 HB2 LEU 81 2HB LEU 81 3.898 0.762 -3.261 723 HB3 LEU 81 3HB LEU 81 2.554 -0.344 -3.443 724 HG LEU 81 HG LEU 81 3.154 -0.780 -5.775 725 HD11 LEU 81 1HD1 LEU 81 5.198 0.211 -6.793 726 HD12 LEU 81 2HD1 LEU 81 5.324 1.304 -5.415 727 HD13 LEU 81 3HD1 LEU 81 3.925 1.391 -6.489 728 HD21 LEU 81 3HD2 LEU 81 5.625 -0.962 -4.003 729 HD22 LEU 81 1HD2 LEU 81 5.337 -1.888 -5.480 730 HD23 LEU 81 2HD2 LEU 81 4.312 -2.141 -4.070 731 H LEU 82 H LEU 82 1.622 2.181 -6.741 732 HA LEU 82 HA LEU 82 -0.676 0.318 -6.874 733 HB2 LEU 82 2HB LEU 82 -0.020 2.779 -8.557 734 HB3 LEU 82 3HB LEU 82 -1.402 1.728 -8.816 735 HG LEU 82 HG LEU 82 -0.967 3.414 -6.315 736 HD11 LEU 82 1HD1 LEU 82 -1.372 4.852 -8.271 737 HD12 LEU 82 2HD1 LEU 82 -2.747 4.881 -7.173 738 HD13 LEU 82 3HD1 LEU 82 -2.833 3.937 -8.663 739 HD21 LEU 82 3HD2 LEU 82 -3.301 2.849 -5.785 740 HD22 LEU 82 1HD2 LEU 82 -2.288 1.408 -5.868 741 HD23 LEU 82 2HD2 LEU 82 -3.377 1.798 -7.202 742 H GLN 83 H GLN 83 -0.043 -1.568 -7.799 743 HA GLN 83 HA GLN 83 1.788 -1.518 -10.123 744 HB2 GLN 83 2HB GLN 83 2.631 -2.829 -8.154 745 HB3 GLN 83 3HB GLN 83 1.237 -3.888 -8.273 746 HG2 GLN 83 2HG GLN 83 3.055 -3.549 -10.670 747 HG3 GLN 83 3HG GLN 83 3.559 -4.576 -9.344 748 HE21 GLN 83 1HE2 GLN 83 2.794 -5.143 -12.177 749 HE22 GLN 83 2HE2 GLN 83 1.607 -6.389 -12.076 750 H ASP 84 H ASP 84 0.502 -1.337 -11.773 751 HA ASP 84 HA ASP 84 -1.424 -3.406 -12.479 752 HB2 ASP 84 2HB ASP 84 -2.230 -0.467 -12.275 753 HB3 ASP 84 3HB ASP 84 -3.151 -1.653 -13.184 754 H GLN 85 H GLN 85 -1.439 -3.695 -14.713 755 HA GLN 85 HA GLN 85 0.887 -2.654 -16.042 756 HB2 GLN 85 2HB GLN 85 0.162 -5.028 -16.219 757 HB3 GLN 85 3HB GLN 85 -1.272 -4.523 -17.104 758 HG2 GLN 85 2HG GLN 85 0.171 -3.659 -18.932 759 HG3 GLN 85 3HG GLN 85 1.597 -4.165 -18.022 760 HE21 GLN 85 1HE2 GLN 85 2.199 -5.454 -19.830 761 HE22 GLN 85 2HE2 GLN 85 1.460 -6.991 -20.112 762 H ASP 86 H ASP 86 -2.499 -1.793 -16.069 763 HA ASP 86 HA ASP 86 -2.428 -0.433 -18.651 764 HB2 ASP 86 2HB ASP 86 -4.507 -0.451 -16.415 765 HB3 ASP 86 3HB ASP 86 -4.704 0.428 -17.926 766 H GLU 87 H GLU 87 -0.627 1.033 -18.338 767 HA GLU 87 HA GLU 87 -0.372 2.693 -16.043 768 HB2 GLU 87 2HB GLU 87 1.038 2.967 -18.722 769 HB3 GLU 87 3HB GLU 87 1.506 3.752 -17.213 770 HG2 GLU 87 2HG GLU 87 1.783 1.433 -16.214 771 HG3 GLU 87 3HG GLU 87 1.573 0.793 -17.842 772 H ASN 88 H ASN 88 -2.278 3.036 -18.835 773 HA ASN 88 HA ASN 88 -2.611 5.864 -18.925 774 HB2 ASN 88 2HB ASN 88 -4.497 3.613 -19.768 775 HB3 ASN 88 3HB ASN 88 -4.764 5.317 -20.133 776 HD21 ASN 88 1HD2 ASN 88 -4.747 4.870 -22.347 777 HD22 ASN 88 2HD2 ASN 88 -3.292 4.515 -23.208 778 H GLU 89 H GLU 89 -4.533 3.273 -17.421 779 HA GLU 89 HA GLU 89 -6.337 5.018 -16.008 780 HB2 GLU 89 2HB GLU 89 -5.815 2.065 -15.436 781 HB3 GLU 89 3HB GLU 89 -7.270 2.985 -15.064 782 HG2 GLU 89 2HG GLU 89 -6.285 2.100 -17.785 783 HG3 GLU 89 3HG GLU 89 -7.740 1.571 -16.944 784 H LEU 90 H LEU 90 -3.388 3.312 -15.281 785 HA LEU 90 HA LEU 90 -3.250 3.655 -12.480 786 HB2 LEU 90 2HB LEU 90 -1.917 1.953 -13.434 787 HB3 LEU 90 3HB LEU 90 -1.289 3.007 -14.673 788 HG LEU 90 HG LEU 90 0.189 4.109 -13.030 789 HD11 LEU 90 1HD1 LEU 90 -1.136 3.925 -11.026 790 HD12 LEU 90 2HD1 LEU 90 0.449 3.208 -10.761 791 HD13 LEU 90 3HD1 LEU 90 -0.958 2.168 -11.016 792 HD21 LEU 90 3HD2 LEU 90 1.752 2.247 -12.649 793 HD22 LEU 90 1HD2 LEU 90 1.054 2.161 -14.265 794 HD23 LEU 90 2HD2 LEU 90 0.476 1.077 -12.996 795 H GLU 91 H GLU 91 -2.218 5.690 -15.211 796 HA GLU 91 HA GLU 91 -0.758 7.645 -13.792 797 HB2 GLU 91 2HB GLU 91 -0.669 7.501 -16.232 798 HB3 GLU 91 3HB GLU 91 -2.384 7.847 -16.355 799 HG2 GLU 91 2HG GLU 91 -1.036 9.791 -16.991 800 HG3 GLU 91 3HG GLU 91 -2.028 10.133 -15.583 801 H GLU 92 H GLU 92 -4.202 7.504 -14.731 802 HA GLU 92 HA GLU 92 -4.889 10.042 -13.637 803 HB2 GLU 92 2HB GLU 92 -6.746 7.737 -14.345 804 HB3 GLU 92 3HB GLU 92 -7.221 9.415 -14.103 805 HG2 GLU 92 2HG GLU 92 -5.549 8.275 -16.350 806 HG3 GLU 92 3HG GLU 92 -7.157 8.983 -16.462 807 H PHE 93 H PHE 93 -5.157 6.730 -12.421 808 HA PHE 93 HA PHE 93 -6.614 7.385 -10.055 809 HB2 PHE 93 2HB PHE 93 -6.509 5.087 -11.161 810 HB3 PHE 93 3HB PHE 93 -4.895 4.900 -10.474 811 HD1 PHE 93 HD1 PHE 93 -8.345 5.924 -9.343 812 HD2 PHE 93 HD2 PHE 93 -4.808 3.696 -8.443 813 HE1 PHE 93 HE1 PHE 93 -9.375 5.126 -7.256 814 HE2 PHE 93 HE2 PHE 93 -5.849 2.898 -6.367 815 HZ PHE 93 HZ PHE 93 -8.131 3.610 -5.769 816 H LYS 94 H LYS 94 -3.186 7.079 -10.851 817 HA LYS 94 HA LYS 94 -1.972 7.347 -8.345 818 HB2 LYS 94 2HB LYS 94 -0.704 6.826 -10.423 819 HB3 LYS 94 3HB LYS 94 -1.038 8.433 -11.044 820 HG2 LYS 94 2HG LYS 94 0.240 9.138 -8.748 821 HG3 LYS 94 3HG LYS 94 0.971 7.554 -8.998 822 HD2 LYS 94 2HD LYS 94 2.390 9.240 -10.040 823 HD3 LYS 94 3HD LYS 94 1.642 8.276 -11.317 824 HE2 LYS 94 2HE LYS 94 -0.044 10.044 -11.672 825 HE3 LYS 94 3HE LYS 94 0.688 11.012 -10.389 826 HZ1 LYS 94 3HZ LYS 94 1.460 11.802 -12.478 827 HZ2 LYS 94 1HZ LYS 94 1.917 10.255 -12.978 828 HZ3 LYS 94 2HZ LYS 94 2.756 11.018 -11.729 829 H ARG 95 H ARG 95 -2.770 9.910 -10.722 830 HA ARG 95 HA ARG 95 -1.733 12.036 -9.150 831 HB2 ARG 95 2HB ARG 95 -2.700 13.545 -10.894 832 HB3 ARG 95 3HB ARG 95 -1.707 12.247 -11.546 833 HG2 ARG 95 2HG ARG 95 -3.766 10.974 -12.094 834 HG3 ARG 95 3HG ARG 95 -4.737 12.318 -11.502 835 HD2 ARG 95 2HD ARG 95 -2.766 12.558 -13.802 836 HD3 ARG 95 3HD ARG 95 -4.478 12.189 -14.015 837 HE ARG 95 HE ARG 95 -3.463 14.698 -12.796 838 HH11 ARG 95 1HH1 ARG 95 -5.790 13.049 -14.874 839 HH12 ARG 95 2HH1 ARG 95 -6.647 14.506 -15.266 840 HH21 ARG 95 1HH2 ARG 95 -4.580 16.591 -13.329 841 HH22 ARG 95 2HH2 ARG 95 -5.956 16.532 -14.384 842 H LYS 96 H LYS 96 -4.922 10.630 -9.233 843 HA LYS 96 HA LYS 96 -6.294 12.834 -7.980 844 HB2 LYS 96 2HB LYS 96 -7.006 10.002 -8.689 845 HB3 LYS 96 3HB LYS 96 -7.934 10.726 -7.382 846 HG2 LYS 96 2HG LYS 96 -9.091 10.993 -9.519 847 HG3 LYS 96 3HG LYS 96 -8.633 12.562 -8.849 848 HD2 LYS 96 2HD LYS 96 -6.632 12.555 -10.379 849 HD3 LYS 96 3HD LYS 96 -7.255 11.072 -11.109 850 HE2 LYS 96 2HE LYS 96 -8.636 13.766 -11.071 851 HE3 LYS 96 3HE LYS 96 -7.847 13.024 -12.462 852 HZ1 LYS 96 3HZ LYS 96 -9.483 11.237 -12.371 853 HZ2 LYS 96 1HZ LYS 96 -10.229 12.740 -12.553 854 HZ3 LYS 96 2HZ LYS 96 -10.241 11.971 -11.051 855 H ILE 97 H ILE 97 -4.660 9.918 -6.778 856 HA ILE 97 HA ILE 97 -5.282 10.495 -3.979 857 HB ILE 97 HB ILE 97 -3.387 8.389 -5.128 858 HG12 ILE 97 2HG1 ILE 97 -6.330 8.044 -4.344 859 HG13 ILE 97 3HG1 ILE 97 -5.760 8.181 -6.004 860 HG21 ILE 97 1HG2 ILE 97 -4.738 8.572 -2.403 861 HG22 ILE 97 2HG2 ILE 97 -3.026 8.842 -2.730 862 HG23 ILE 97 3HG2 ILE 97 -3.720 7.239 -2.957 863 HD11 ILE 97 3HD1 ILE 97 -4.473 6.127 -5.731 864 HD12 ILE 97 1HD1 ILE 97 -6.190 5.883 -5.414 865 HD13 ILE 97 2HD1 ILE 97 -5.055 5.986 -4.069 866 H GLU 98 H GLU 98 -2.748 11.075 -6.255 867 HA GLU 98 HA GLU 98 -0.619 11.973 -4.599 868 HB2 GLU 98 2HB GLU 98 -0.334 11.448 -6.995 869 HB3 GLU 98 3HB GLU 98 -1.467 12.717 -7.437 870 HG2 GLU 98 2HG GLU 98 0.153 14.396 -6.535 871 HG3 GLU 98 3HG GLU 98 1.300 13.082 -6.265 872 H SER 99 H SER 99 -3.567 13.423 -5.867 873 HA SER 99 HA SER 99 -3.137 16.121 -5.023 874 HB2 SER 99 2HB SER 99 -4.719 15.581 -6.827 875 HB3 SER 99 3HB SER 99 -5.694 14.612 -5.724 876 HG SER 99 HG SER 99 -5.268 17.187 -4.852 877 H GLN 100 H GLN 100 -4.338 13.210 -3.478 878 HA GLN 100 HA GLN 100 -5.484 14.503 -1.157 879 HB2 GLN 100 2HB GLN 100 -4.771 11.589 -1.680 880 HB3 GLN 100 3HB GLN 100 -5.659 12.157 -0.273 881 HG2 GLN 100 2HG GLN 100 -6.632 12.496 -3.130 882 HG3 GLN 100 3HG GLN 100 -7.070 11.141 -2.093 883 HE21 GLN 100 1HE2 GLN 100 -9.277 11.753 -2.342 884 HE22 GLN 100 2HE2 GLN 100 -9.949 13.073 -1.456 885 H GLY 101 H GLY 101 -2.331 14.140 -2.127 886 HA2 GLY 101 2HA GLY 101 -0.431 14.878 -1.026 887 HA3 GLY 101 3HA GLY 101 -1.314 14.871 0.493 888 H TYR 102 H TYR 102 -1.670 11.932 -1.171 889 HA TYR 102 HA TYR 102 0.111 10.538 0.651 890 HB2 TYR 102 2HB TYR 102 -1.828 9.571 -1.481 891 HB3 TYR 102 3HB TYR 102 -0.776 8.466 -0.594 892 HD1 TYR 102 HD1 TYR 102 -0.829 8.812 2.071 893 HD2 TYR 102 HD2 TYR 102 -4.012 9.900 -0.566 894 HE1 TYR 102 HE1 TYR 102 -2.405 8.735 3.952 895 HE2 TYR 102 HE2 TYR 102 -5.596 9.816 1.328 896 HH TYR 102 HH TYR 102 -5.746 8.744 3.570 897 H GLU 103 H GLU 103 1.899 9.404 0.149 898 HA GLU 103 HA GLU 103 3.502 10.187 -2.102 899 HB2 GLU 103 2HB GLU 103 4.479 9.742 0.122 900 HB3 GLU 103 3HB GLU 103 3.868 8.092 0.095 901 HG2 GLU 103 2HG GLU 103 6.246 8.096 -0.330 902 HG3 GLU 103 3HG GLU 103 5.386 7.556 -1.766 903 H VAL 104 H VAL 104 2.553 9.431 -4.058 904 HA VAL 104 HA VAL 104 1.686 6.595 -4.163 905 HB VAL 104 HB VAL 104 0.936 8.795 -6.167 906 HG11 VAL 104 1HG1 VAL 104 -0.849 7.202 -6.821 907 HG12 VAL 104 2HG1 VAL 104 -0.242 6.025 -5.653 908 HG13 VAL 104 3HG1 VAL 104 0.753 6.494 -7.033 909 HG21 VAL 104 3HG2 VAL 104 -0.666 7.818 -3.770 910 HG22 VAL 104 1HG2 VAL 104 -1.251 8.922 -5.021 911 HG23 VAL 104 2HG2 VAL 104 0.066 9.412 -3.957 912 H ARG 105 H ARG 105 3.066 5.273 -5.139 913 HA ARG 105 HA ARG 105 4.756 6.244 -7.376 914 HB2 ARG 105 2HB ARG 105 5.305 4.050 -5.327 915 HB3 ARG 105 3HB ARG 105 6.302 4.329 -6.753 916 HG2 ARG 105 2HG ARG 105 5.812 6.416 -4.614 917 HG3 ARG 105 3HG ARG 105 7.196 5.321 -4.613 918 HD2 ARG 105 2HD ARG 105 8.015 6.275 -6.700 919 HD3 ARG 105 3HD ARG 105 6.547 7.240 -6.873 920 HE ARG 105 HE ARG 105 7.228 8.498 -4.907 921 HH11 ARG 105 1HH1 ARG 105 9.772 6.690 -6.519 922 HH12 ARG 105 2HH1 ARG 105 11.030 7.706 -5.904 923 HH21 ARG 105 1HH2 ARG 105 8.863 9.806 -4.138 924 HH22 ARG 105 2HH2 ARG 105 10.511 9.475 -4.548 925 H LYS 106 H LYS 106 4.568 5.232 -9.253 926 HA LYS 106 HA LYS 106 2.625 3.040 -9.570 927 HB2 LYS 106 2HB LYS 106 2.750 3.636 -11.994 928 HB3 LYS 106 3HB LYS 106 2.231 4.974 -10.982 929 HG2 LYS 106 2HG LYS 106 4.252 6.148 -11.248 930 HG3 LYS 106 3HG LYS 106 5.132 4.721 -11.793 931 HD2 LYS 106 2HD LYS 106 2.942 6.128 -13.374 932 HD3 LYS 106 3HD LYS 106 4.675 6.348 -13.627 933 HE2 LYS 106 2HE LYS 106 4.818 3.850 -14.073 934 HE3 LYS 106 3HE LYS 106 3.054 3.823 -14.056 935 HZ1 LYS 106 3HZ LYS 106 4.009 3.996 -16.299 936 HZ2 LYS 106 1HZ LYS 106 4.689 5.483 -15.892 937 HZ3 LYS 106 2HZ LYS 106 3.019 5.306 -15.926 938 H VAL 107 H VAL 107 3.159 1.203 -10.882 939 HA VAL 107 HA VAL 107 5.745 0.692 -11.973 940 HB VAL 107 HB VAL 107 6.269 0.432 -9.513 941 HG11 VAL 107 1HG1 VAL 107 4.127 -0.433 -8.720 942 HG12 VAL 107 2HG1 VAL 107 5.457 -1.489 -8.242 943 HG13 VAL 107 3HG1 VAL 107 4.402 -1.953 -9.579 944 HG21 VAL 107 3HG2 VAL 107 6.564 -2.123 -11.130 945 HG22 VAL 107 1HG2 VAL 107 7.495 -1.702 -9.688 946 HG23 VAL 107 2HG2 VAL 107 7.653 -0.734 -11.151 947 H THR 108 H THR 108 5.824 -1.470 -13.002 948 HA THR 108 HA THR 108 3.208 -2.847 -13.287 949 HB THR 108 HB THR 108 3.827 -3.261 -15.717 950 HG1 THR 108 HG1 THR 108 5.988 -2.837 -15.797 951 HG21 THR 108 3HG2 THR 108 2.216 -1.455 -15.107 952 HG22 THR 108 1HG2 THR 108 3.157 -1.062 -16.547 953 HG23 THR 108 2HG2 THR 108 3.564 -0.318 -15.001 954 H ASP 109 H ASP 109 6.733 -3.041 -13.197 955 HA ASP 109 HA ASP 109 6.774 -5.921 -13.761 956 HB2 ASP 109 2HB ASP 109 8.998 -3.873 -13.345 957 HB3 ASP 109 3HB ASP 109 9.293 -5.593 -13.607 958 H ASP 110 H ASP 110 7.517 -7.477 -12.278 959 HA ASP 110 HA ASP 110 6.767 -6.994 -9.545 960 HB2 ASP 110 2HB ASP 110 6.940 -9.345 -9.195 961 HB3 ASP 110 3HB ASP 110 6.398 -9.188 -10.858 962 H GLU 111 H GLU 111 9.812 -7.476 -11.241 963 HA GLU 111 HA GLU 111 11.536 -7.717 -8.981 964 HB2 GLU 111 2HB GLU 111 13.355 -7.214 -10.659 965 HB3 GLU 111 3HB GLU 111 12.271 -8.510 -11.153 966 HG2 GLU 111 2HG GLU 111 11.081 -6.978 -12.665 967 HG3 GLU 111 3HG GLU 111 12.106 -5.645 -12.147 968 H GLU 112 H GLU 112 10.438 -5.017 -10.969 969 HA GLU 112 HA GLU 112 12.020 -3.022 -9.648 970 HB2 GLU 112 2HB GLU 112 11.273 -2.817 -12.015 971 HB3 GLU 112 3HB GLU 112 9.603 -2.679 -11.479 972 HG2 GLU 112 2HG GLU 112 10.531 -0.493 -12.064 973 HG3 GLU 112 3HG GLU 112 10.121 -0.562 -10.352 974 H ALA 113 H ALA 113 8.755 -4.326 -9.272 975 HA ALA 113 HA ALA 113 7.626 -2.334 -7.641 976 HB1 ALA 113 3HB ALA 113 7.000 -5.301 -7.674 977 HB2 ALA 113 1HB ALA 113 6.272 -4.068 -8.702 978 HB3 ALA 113 2HB ALA 113 5.985 -4.040 -6.961 979 H LEU 114 H LEU 114 9.470 -5.260 -6.800 980 HA LEU 114 HA LEU 114 9.421 -5.039 -3.975 981 HB2 LEU 114 2HB LEU 114 11.649 -6.188 -5.703 982 HB3 LEU 114 3HB LEU 114 11.426 -6.481 -3.985 983 HG LEU 114 HG LEU 114 9.536 -7.428 -6.174 984 HD11 LEU 114 1HD1 LEU 114 11.538 -9.018 -4.532 985 HD12 LEU 114 2HD1 LEU 114 11.721 -8.577 -6.232 986 HD13 LEU 114 3HD1 LEU 114 10.424 -9.661 -5.741 987 HD21 LEU 114 3HD2 LEU 114 8.346 -7.034 -4.068 988 HD22 LEU 114 1HD2 LEU 114 9.521 -8.022 -3.196 989 HD23 LEU 114 2HD2 LEU 114 8.462 -8.759 -4.401 990 H LYS 115 H LYS 115 11.485 -3.622 -6.436 991 HA LYS 115 HA LYS 115 13.431 -2.394 -4.733 992 HB2 LYS 115 2HB LYS 115 12.619 -1.861 -7.620 993 HB3 LYS 115 3HB LYS 115 13.971 -1.052 -6.831 994 HG2 LYS 115 2HG LYS 115 15.192 -3.122 -6.625 995 HG3 LYS 115 3HG LYS 115 13.786 -4.061 -7.140 996 HD2 LYS 115 2HD LYS 115 15.456 -3.824 -8.965 997 HD3 LYS 115 3HD LYS 115 13.902 -3.106 -9.387 998 HE2 LYS 115 2HE LYS 115 14.844 -0.861 -8.759 999 HE3 LYS 115 3HE LYS 115 16.413 -1.632 -8.527 1000 HZ1 LYS 115 3HZ LYS 115 14.870 -1.548 -11.066 1001 HZ2 LYS 115 1HZ LYS 115 16.369 -2.299 -10.854 1002 HZ3 LYS 115 2HZ LYS 115 16.236 -0.623 -10.705 1003 H ILE 116 H ILE 116 10.229 -1.404 -5.899 1004 HA ILE 116 HA ILE 116 10.511 1.342 -5.010 1005 HB ILE 116 HB ILE 116 7.869 -0.110 -5.535 1006 HG12 ILE 116 2HG1 ILE 116 9.192 -0.358 -7.568 1007 HG13 ILE 116 3HG1 ILE 116 7.936 0.826 -7.851 1008 HG21 ILE 116 1HG2 ILE 116 7.002 2.151 -6.012 1009 HG22 ILE 116 2HG2 ILE 116 8.574 2.852 -5.623 1010 HG23 ILE 116 3HG2 ILE 116 7.638 2.034 -4.372 1011 HD11 ILE 116 3HD1 ILE 116 10.024 1.455 -8.908 1012 HD12 ILE 116 1HD1 ILE 116 10.853 1.433 -7.352 1013 HD13 ILE 116 2HD1 ILE 116 9.584 2.623 -7.663 1014 H VAL 117 H VAL 117 9.217 -1.689 -3.721 1015 HA VAL 117 HA VAL 117 8.068 -0.738 -1.317 1016 HB VAL 117 HB VAL 117 9.319 -3.473 -1.875 1017 HG11 VAL 117 1HG1 VAL 117 7.385 -2.697 0.345 1018 HG12 VAL 117 2HG1 VAL 117 9.086 -3.122 0.544 1019 HG13 VAL 117 3HG1 VAL 117 7.940 -4.336 -0.019 1020 HG21 VAL 117 3HG2 VAL 117 7.035 -4.252 -2.333 1021 HG22 VAL 117 1HG2 VAL 117 7.498 -2.961 -3.437 1022 HG23 VAL 117 2HG2 VAL 117 6.412 -2.618 -2.096 1023 H ARG 118 H ARG 118 11.383 -1.754 -2.163 1024 HA ARG 118 HA ARG 118 12.490 -1.652 0.429 1025 HB2 ARG 118 2HB ARG 118 14.539 -2.070 -0.543 1026 HB3 ARG 118 3HB ARG 118 13.524 -2.498 -1.909 1027 HG2 ARG 118 2HG ARG 118 13.953 -0.339 -2.956 1028 HG3 ARG 118 3HG ARG 118 14.855 0.205 -1.549 1029 HD2 ARG 118 2HD ARG 118 16.502 -1.669 -2.012 1030 HD3 ARG 118 3HD ARG 118 15.649 -1.937 -3.542 1031 HE ARG 118 HE ARG 118 16.179 0.721 -3.602 1032 HH11 ARG 118 1HH1 ARG 118 18.279 -2.061 -3.111 1033 HH12 ARG 118 2HH1 ARG 118 19.668 -1.260 -3.780 1034 HH21 ARG 118 1HH2 ARG 118 18.002 1.765 -4.418 1035 HH22 ARG 118 2HH2 ARG 118 19.511 0.911 -4.521 1036 H GLU 119 H GLU 119 11.926 0.831 -1.999 1037 HA GLU 119 HA GLU 119 13.366 2.952 -0.829 1038 HB2 GLU 119 2HB GLU 119 10.830 3.126 -2.518 1039 HB3 GLU 119 3HB GLU 119 11.917 4.467 -2.173 1040 HG2 GLU 119 2HG GLU 119 12.502 2.018 -3.838 1041 HG3 GLU 119 3HG GLU 119 12.290 3.667 -4.412 1042 H PHE 120 H PHE 120 9.947 1.957 -0.568 1043 HA PHE 120 HA PHE 120 9.020 3.919 1.199 1044 HB2 PHE 120 2HB PHE 120 8.083 1.026 0.956 1045 HB3 PHE 120 3HB PHE 120 7.199 2.306 1.785 1046 HD1 PHE 120 HD2 PHE 120 7.429 4.594 -0.087 1047 HD2 PHE 120 HD1 PHE 120 6.746 0.448 -0.881 1048 HE1 PHE 120 HE2 PHE 120 6.222 5.179 -2.155 1049 HE2 PHE 120 HE1 PHE 120 5.565 1.047 -2.939 1050 HZ PHE 120 HZ PHE 120 5.287 3.402 -3.578 1051 H MET 121 H MET 121 10.363 0.695 1.923 1052 HA MET 121 HA MET 121 10.111 0.815 4.734 1053 HB2 MET 121 2HB MET 121 11.946 -0.886 2.987 1054 HB3 MET 121 3HB MET 121 11.716 -1.131 4.715 1055 HG2 MET 121 2HG MET 121 9.291 -1.550 4.281 1056 HG3 MET 121 3HG MET 121 9.628 -1.450 2.550 1057 HE1 MET 121 3HE MET 121 11.872 -4.616 1.943 1058 HE2 MET 121 1HE MET 121 12.411 -2.947 2.143 1059 HE3 MET 121 2HE MET 121 10.977 -3.304 1.177 1060 H GLN 122 H GLN 122 12.772 1.661 2.570 1061 HA GLN 122 HA GLN 122 14.746 2.229 4.531 1062 HB2 GLN 122 2HB GLN 122 15.479 1.703 2.338 1063 HB3 GLN 122 3HB GLN 122 14.419 2.875 1.580 1064 HG2 GLN 122 2HG GLN 122 16.589 3.924 3.361 1065 HG3 GLN 122 3HG GLN 122 17.073 3.238 1.815 1066 HE21 GLN 122 1HE2 GLN 122 17.196 6.040 2.786 1067 HE22 GLN 122 2HE2 GLN 122 16.324 6.965 1.618 1068 H LYS 123 H LYS 123 12.362 4.284 2.904 1069 HA LYS 123 HA LYS 123 13.259 6.764 4.089 1070 HB2 LYS 123 2HB LYS 123 10.737 6.011 2.552 1071 HB3 LYS 123 3HB LYS 123 11.094 7.653 3.090 1072 HG2 LYS 123 2HG LYS 123 12.994 7.832 1.640 1073 HG3 LYS 123 3HG LYS 123 13.006 6.094 1.326 1074 HD2 LYS 123 2HD LYS 123 10.848 6.309 0.103 1075 HD3 LYS 123 3HD LYS 123 10.878 8.056 0.381 1076 HE2 LYS 123 2HE LYS 123 11.688 7.394 -1.894 1077 HE3 LYS 123 3HE LYS 123 12.889 8.291 -0.965 1078 HZ1 LYS 123 3HZ LYS 123 14.105 6.335 -0.552 1079 HZ2 LYS 123 1HZ LYS 123 13.718 6.278 -2.195 1080 HZ3 LYS 123 2HZ LYS 123 12.863 5.332 -1.088 1081 H ALA 124 H ALA 124 10.707 4.398 4.766 1082 HA ALA 124 HA ALA 124 9.488 5.749 6.963 1083 HB1 ALA 124 3HB ALA 124 8.483 3.544 7.462 1084 HB2 ALA 124 1HB ALA 124 9.568 2.782 6.292 1085 HB3 ALA 124 2HB ALA 124 8.353 3.941 5.750 1086 H GLY 125 H GLY 125 12.145 3.462 6.601 1087 HA2 GLY 125 2HA GLY 125 12.883 2.972 9.247 1088 HA3 GLY 125 3HA GLY 125 13.983 2.990 7.877 1089 H SER 126 H SER 126 13.584 5.709 7.141 1090 HA SER 126 HA SER 126 15.368 7.045 8.957 1091 HB2 SER 126 2HB SER 126 13.843 8.117 6.547 1092 HB3 SER 126 3HB SER 126 15.210 8.905 7.345 1093 HG SER 126 HG SER 126 15.594 6.272 6.484 1094 H LEU 127 H LEU 127 11.883 7.020 8.364 1095 HA LEU 127 HA LEU 127 11.291 9.386 9.945 1096 HB2 LEU 127 2HB LEU 127 9.412 7.253 8.867 1097 HB3 LEU 127 3HB LEU 127 8.907 8.760 9.613 1098 HG LEU 127 HG LEU 127 10.254 8.385 6.916 1099 HD11 LEU 127 1HD1 LEU 127 8.252 9.508 6.040 1100 HD12 LEU 127 2HD1 LEU 127 7.594 9.634 7.674 1101 HD13 LEU 127 3HD1 LEU 127 7.830 8.049 6.935 1102 HD21 LEU 127 3HD2 LEU 127 11.346 10.293 7.989 1103 HD22 LEU 127 1HD2 LEU 127 9.773 11.021 8.337 1104 HD23 LEU 127 2HD2 LEU 127 10.312 10.829 6.668 1105 H GLU 128 H GLU 128 12.188 6.304 10.795 1106 HA GLU 128 HA GLU 128 10.772 6.096 13.299 1107 HB2 GLU 128 2HB GLU 128 13.262 4.706 12.226 1108 HB3 GLU 128 3HB GLU 128 12.528 4.327 13.784 1109 HG2 GLU 128 2HG GLU 128 10.422 3.700 12.634 1110 HG3 GLU 128 3HG GLU 128 11.182 4.045 11.080 1111 H HIS 129 H HIS 129 13.477 7.897 12.181 1112 HA HIS 129 HA HIS 129 14.122 8.798 14.931 1113 HB2 HIS 129 2HB HIS 129 16.146 8.195 12.735 1114 HB3 HIS 129 3HB HIS 129 16.534 8.992 14.258 1115 HD1 HIS 129 HD1 HIS 129 16.791 7.504 16.322 1116 HD2 HIS 129 HD2 HIS 129 15.566 5.414 12.945 1117 HE1 HIS 129 HE1 HIS 129 16.979 5.069 16.920 1118 HE2 HIS 129 HE2 HIS 129 16.163 3.833 14.895 1119 H HIS 130 H HIS 130 14.613 10.985 15.143 1120 HA HIS 130 HA HIS 130 14.659 13.212 14.740 1121 HB2 HIS 130 2HB HIS 130 15.510 12.397 11.928 1122 HB3 HIS 130 3HB HIS 130 15.653 14.018 12.603 1123 HD1 HIS 130 HD1 HIS 130 17.405 10.792 12.372 1124 HD2 HIS 130 HD2 HIS 130 17.631 14.202 14.751 1125 HE1 HIS 130 HE1 HIS 130 19.624 10.647 13.547 1126 HE2 HIS 130 HE2 HIS 130 19.753 12.728 14.955 1127 H HIS 131 H HIS 131 12.193 11.617 14.144 1128 HA HIS 131 HA HIS 131 10.805 13.078 12.029 1129 HB2 HIS 131 2HB HIS 131 8.992 11.439 12.381 1130 HB3 HIS 131 3HB HIS 131 10.529 10.624 12.154 1131 HD1 HIS 131 HD1 HIS 131 11.247 9.017 13.962 1132 HD2 HIS 131 HD2 HIS 131 7.981 11.302 15.124 1133 HE1 HIS 131 HE1 HIS 131 10.437 7.995 16.109 1134 HE2 HIS 131 HE2 HIS 131 8.407 9.326 16.735 1135 H HIS 132 H HIS 132 11.602 14.463 14.527 1136 HA HIS 132 HA HIS 132 9.621 14.871 16.405 1137 HB2 HIS 132 2HB HIS 132 11.927 15.815 16.526 1138 HB3 HIS 132 3HB HIS 132 11.517 16.971 15.264 1139 HD1 HIS 132 HD1 HIS 132 11.276 16.382 18.895 1140 HD2 HIS 132 HD2 HIS 132 9.683 19.048 16.134 1141 HE1 HIS 132 HE1 HIS 132 10.292 18.249 20.252 1142 HE2 HIS 132 HE2 HIS 132 9.531 19.942 18.556 1143 H HIS 133 H HIS 133 10.081 16.587 13.322 1144 HA HIS 133 HA HIS 133 7.190 16.704 12.971 1145 HB2 HIS 133 2HB HIS 133 7.806 18.932 14.002 1146 HB3 HIS 133 3HB HIS 133 8.879 19.233 12.633 1147 HD1 HIS 133 HD1 HIS 133 7.804 20.144 10.517 1148 HD2 HIS 133 HD2 HIS 133 4.996 18.851 13.302 1149 HE1 HIS 133 HE1 HIS 133 5.570 20.809 9.584 1150 HE2 HIS 133 HE2 HIS 133 3.889 19.902 11.212 1151 H HIS 134 H HIS 134 7.168 15.430 11.215 1152 HA HIS 134 HA HIS 134 8.399 16.363 8.744 1153 HB2 HIS 134 2HB HIS 134 10.048 14.695 9.683 1154 HB3 HIS 134 3HB HIS 134 8.778 13.473 9.703 1155 HD1 HIS 134 HD1 HIS 134 7.705 12.983 7.195 1156 HD2 HIS 134 HD2 HIS 134 11.465 14.765 7.327 1157 HE1 HIS 134 HE1 HIS 134 8.663 12.712 4.890 1158 HE2 HIS 134 HE2 HIS 134 10.900 13.845 4.970 Start of MODEL 6 1 H1 MET 1 1H MET 1 4.267 5.666 16.963 2 H2 MET 1 2H MET 1 3.295 6.531 15.893 3 H3 MET 1 3H MET 1 4.650 7.260 16.588 4 HA MET 1 HA MET 1 5.111 6.695 14.334 5 HB2 MET 1 2HB MET 1 6.530 4.938 16.377 6 HB3 MET 1 3HB MET 1 7.111 5.180 14.732 7 HG2 MET 1 2HG MET 1 8.305 6.602 16.311 8 HG3 MET 1 3HG MET 1 7.388 7.567 15.160 9 HE1 MET 1 3HE MET 1 7.254 9.803 18.358 10 HE2 MET 1 1HE MET 1 7.633 9.743 16.636 11 HE3 MET 1 2HE MET 1 8.611 8.831 17.791 12 H LYS 2 H LYS 2 3.464 5.785 13.149 13 HA LYS 2 HA LYS 2 3.776 2.968 12.530 14 HB2 LYS 2 2HB LYS 2 2.043 2.674 14.150 15 HB3 LYS 2 3HB LYS 2 1.157 4.088 13.600 16 HG2 LYS 2 2HG LYS 2 0.290 2.968 11.705 17 HG3 LYS 2 3HG LYS 2 1.499 1.686 11.790 18 HD2 LYS 2 2HD LYS 2 -0.781 0.945 12.491 19 HD3 LYS 2 3HD LYS 2 0.440 0.723 13.741 20 HE2 LYS 2 2HE LYS 2 -0.381 2.908 14.766 21 HE3 LYS 2 3HE LYS 2 -1.717 2.844 13.616 22 HZ1 LYS 2 3HZ LYS 2 -2.335 0.685 14.556 23 HZ2 LYS 2 1HZ LYS 2 -2.374 1.907 15.725 24 HZ3 LYS 2 2HZ LYS 2 -1.089 0.805 15.688 25 H ILE 3 H ILE 3 4.552 3.580 10.599 26 HA ILE 3 HA ILE 3 2.955 5.221 8.764 27 HB ILE 3 HB ILE 3 5.766 4.040 8.540 28 HG12 ILE 3 2HG1 ILE 3 4.671 6.855 8.974 29 HG13 ILE 3 3HG1 ILE 3 5.675 5.919 10.071 30 HG21 ILE 3 1HG2 ILE 3 4.749 4.034 6.305 31 HG22 ILE 3 2HG2 ILE 3 5.979 5.294 6.404 32 HG23 ILE 3 3HG2 ILE 3 4.271 5.722 6.496 33 HD11 ILE 3 3HD1 ILE 3 7.554 6.161 8.524 34 HD12 ILE 3 1HD1 ILE 3 6.917 7.711 9.066 35 HD13 ILE 3 2HD1 ILE 3 6.537 7.124 7.446 36 H LEU 4 H LEU 4 1.771 4.344 7.118 37 HA LEU 4 HA LEU 4 1.541 1.398 7.082 38 HB2 LEU 4 2HB LEU 4 -0.502 3.509 6.257 39 HB3 LEU 4 3HB LEU 4 -0.773 1.770 6.319 40 HG LEU 4 HG LEU 4 -0.250 3.583 8.717 41 HD11 LEU 4 1HD1 LEU 4 -2.787 2.157 7.889 42 HD12 LEU 4 2HD1 LEU 4 -2.480 3.891 7.782 43 HD13 LEU 4 3HD1 LEU 4 -2.553 3.112 9.358 44 HD21 LEU 4 3HD2 LEU 4 0.701 1.385 9.140 45 HD22 LEU 4 1HD2 LEU 4 -0.808 0.602 8.661 46 HD23 LEU 4 2HD2 LEU 4 -0.751 1.612 10.110 47 H ILE 5 H ILE 5 2.693 0.610 5.431 48 HA ILE 5 HA ILE 5 3.026 2.038 2.912 49 HB ILE 5 HB ILE 5 3.930 -0.795 3.622 50 HG12 ILE 5 2HG1 ILE 5 4.953 0.824 5.209 51 HG13 ILE 5 3HG1 ILE 5 6.164 0.131 4.140 52 HG21 ILE 5 1HG2 ILE 5 5.553 -0.518 1.764 53 HG22 ILE 5 2HG2 ILE 5 4.858 1.065 1.399 54 HG23 ILE 5 3HG2 ILE 5 3.882 -0.394 1.204 55 HD11 ILE 5 3HD1 ILE 5 4.957 2.888 3.918 56 HD12 ILE 5 1HD1 ILE 5 6.156 2.201 2.814 57 HD13 ILE 5 2HD1 ILE 5 6.568 2.477 4.506 58 H LEU 6 H LEU 6 1.286 1.999 1.566 59 HA LEU 6 HA LEU 6 -0.620 -0.245 1.614 60 HB2 LEU 6 2HB LEU 6 -1.082 2.438 1.599 61 HB3 LEU 6 3HB LEU 6 -1.014 2.192 -0.128 62 HG LEU 6 HG LEU 6 -3.323 2.163 0.557 63 HD11 LEU 6 1HD1 LEU 6 -2.841 0.551 -1.209 64 HD12 LEU 6 2HD1 LEU 6 -4.162 -0.003 -0.185 65 HD13 LEU 6 3HD1 LEU 6 -2.554 -0.711 -0.007 66 HD21 LEU 6 3HD2 LEU 6 -3.042 1.713 2.918 67 HD22 LEU 6 1HD2 LEU 6 -2.604 0.034 2.583 68 HD23 LEU 6 2HD2 LEU 6 -4.233 0.613 2.230 69 H ILE 7 H ILE 7 -0.798 -1.626 -0.172 70 HA ILE 7 HA ILE 7 0.699 -1.007 -2.649 71 HB ILE 7 HB ILE 7 0.881 -3.661 -1.128 72 HG12 ILE 7 2HG1 ILE 7 3.078 -1.621 -1.715 73 HG13 ILE 7 3HG1 ILE 7 2.272 -1.805 -0.163 74 HG21 ILE 7 1HG2 ILE 7 2.459 -4.377 -2.902 75 HG22 ILE 7 2HG2 ILE 7 2.150 -2.877 -3.780 76 HG23 ILE 7 3HG2 ILE 7 0.853 -4.053 -3.556 77 HD11 ILE 7 3HD1 ILE 7 4.422 -2.844 -0.130 78 HD12 ILE 7 1HD1 ILE 7 4.007 -3.853 -1.515 79 HD13 ILE 7 2HD1 ILE 7 3.161 -4.066 0.021 80 H ASN 8 H ASN 8 -0.535 -1.368 -4.401 81 HA ASN 8 HA ASN 8 -2.641 -3.461 -4.351 82 HB2 ASN 8 2HB ASN 8 -3.724 -1.299 -4.653 83 HB3 ASN 8 3HB ASN 8 -2.551 -0.815 -5.865 84 HD21 ASN 8 1HD2 ASN 8 -4.247 -3.966 -5.729 85 HD22 ASN 8 2HD2 ASN 8 -5.102 -3.740 -7.209 86 H THR 9 H THR 9 -1.826 -5.154 -5.394 87 HA THR 9 HA THR 9 -0.442 -4.750 -7.978 88 HB THR 9 HB THR 9 1.219 -5.585 -6.376 89 HG1 THR 9 HG1 THR 9 1.936 -6.741 -7.966 90 HG21 THR 9 3HG2 THR 9 -0.617 -7.960 -5.896 91 HG22 THR 9 1HG2 THR 9 -0.257 -6.684 -4.728 92 HG23 THR 9 2HG2 THR 9 1.023 -7.776 -5.267 93 H ASN 10 H ASN 10 -1.136 -6.065 -9.660 94 HA ASN 10 HA ASN 10 -3.641 -7.541 -9.289 95 HB2 ASN 10 2HB ASN 10 -2.050 -6.895 -11.807 96 HB3 ASN 10 3HB ASN 10 -3.581 -7.758 -11.793 97 HD21 ASN 10 1HD2 ASN 10 -2.041 -4.651 -11.450 98 HD22 ASN 10 2HD2 ASN 10 -3.486 -3.705 -11.519 99 H ASN 11 H ASN 11 -0.353 -8.132 -9.189 100 HA ASN 11 HA ASN 11 -0.349 -10.863 -10.230 101 HB2 ASN 11 2HB ASN 11 1.884 -9.253 -8.907 102 HB3 ASN 11 3HB ASN 11 2.066 -10.818 -9.691 103 HD21 ASN 11 1HD2 ASN 11 3.533 -10.113 -11.199 104 HD22 ASN 11 2HD2 ASN 11 3.138 -9.015 -12.473 105 H ASP 12 H ASP 12 -0.626 -12.606 -8.998 106 HA ASP 12 HA ASP 12 -1.223 -12.514 -6.197 107 HB2 ASP 12 2HB ASP 12 -0.600 -14.918 -7.983 108 HB3 ASP 12 3HB ASP 12 -1.228 -15.026 -6.339 109 H GLU 13 H GLU 13 1.669 -13.372 -8.040 110 HA GLU 13 HA GLU 13 3.163 -14.657 -6.031 111 HB2 GLU 13 2HB GLU 13 4.134 -13.082 -8.464 112 HB3 GLU 13 3HB GLU 13 5.161 -14.120 -7.473 113 HG2 GLU 13 2HG GLU 13 3.784 -16.078 -8.085 114 HG3 GLU 13 3HG GLU 13 2.748 -15.045 -9.067 115 H LEU 14 H LEU 14 2.939 -11.227 -6.968 116 HA LEU 14 HA LEU 14 5.097 -10.280 -5.420 117 HB2 LEU 14 2HB LEU 14 2.789 -8.949 -6.811 118 HB3 LEU 14 3HB LEU 14 3.679 -8.001 -5.633 119 HG LEU 14 HG LEU 14 4.558 -7.578 -7.865 120 HD11 LEU 14 1HD1 LEU 14 6.133 -7.475 -5.974 121 HD12 LEU 14 2HD1 LEU 14 6.931 -7.972 -7.460 122 HD13 LEU 14 3HD1 LEU 14 6.563 -9.173 -6.223 123 HD21 LEU 14 3HD2 LEU 14 3.955 -9.731 -8.929 124 HD22 LEU 14 1HD2 LEU 14 5.250 -10.535 -8.046 125 HD23 LEU 14 2HD2 LEU 14 5.624 -9.287 -9.238 126 H ILE 15 H ILE 15 1.817 -10.991 -4.504 127 HA ILE 15 HA ILE 15 1.606 -9.547 -2.116 128 HB ILE 15 HB ILE 15 0.478 -12.315 -2.767 129 HG12 ILE 15 2HG1 ILE 15 -0.800 -9.553 -3.069 130 HG13 ILE 15 3HG1 ILE 15 -0.179 -10.539 -4.389 131 HG21 ILE 15 1HG2 ILE 15 -1.227 -11.873 -1.019 132 HG22 ILE 15 2HG2 ILE 15 -0.416 -10.360 -0.603 133 HG23 ILE 15 3HG2 ILE 15 0.398 -11.902 -0.329 134 HD11 ILE 15 3HD1 ILE 15 -2.594 -10.657 -4.253 135 HD12 ILE 15 1HD1 ILE 15 -2.501 -11.256 -2.597 136 HD13 ILE 15 2HD1 ILE 15 -1.874 -12.234 -3.930 137 H LYS 16 H LYS 16 2.772 -12.962 -2.517 138 HA LYS 16 HA LYS 16 3.618 -13.122 0.234 139 HB2 LYS 16 2HB LYS 16 4.399 -15.350 -0.253 140 HB3 LYS 16 3HB LYS 16 2.840 -15.117 -1.038 141 HG2 LYS 16 2HG LYS 16 3.957 -14.812 -3.213 142 HG3 LYS 16 3HG LYS 16 5.535 -14.967 -2.436 143 HD2 LYS 16 2HD LYS 16 4.931 -17.077 -3.517 144 HD3 LYS 16 3HD LYS 16 4.991 -17.290 -1.767 145 HE2 LYS 16 2HE LYS 16 2.545 -17.210 -1.650 146 HE3 LYS 16 3HE LYS 16 2.451 -16.874 -3.380 147 HZ1 LYS 16 3HZ LYS 16 3.382 -19.046 -3.837 148 HZ2 LYS 16 1HZ LYS 16 2.016 -19.211 -2.859 149 HZ3 LYS 16 2HZ LYS 16 3.554 -19.366 -2.185 150 H LYS 17 H LYS 17 5.248 -12.372 -2.810 151 HA LYS 17 HA LYS 17 7.946 -12.736 -2.043 152 HB2 LYS 17 2HB LYS 17 6.760 -10.796 -4.083 153 HB3 LYS 17 3HB LYS 17 8.485 -11.112 -3.908 154 HG2 LYS 17 2HG LYS 17 8.196 -13.424 -4.611 155 HG3 LYS 17 3HG LYS 17 6.441 -13.240 -4.617 156 HD2 LYS 17 2HD LYS 17 7.178 -13.126 -6.904 157 HD3 LYS 17 3HD LYS 17 6.679 -11.504 -6.427 158 HE2 LYS 17 2HE LYS 17 8.702 -11.314 -7.716 159 HE3 LYS 17 3HE LYS 17 9.123 -10.964 -6.036 160 HZ1 LYS 17 3HZ LYS 17 9.921 -13.262 -5.834 161 HZ2 LYS 17 1HZ LYS 17 10.746 -12.416 -7.037 162 HZ3 LYS 17 2HZ LYS 17 9.560 -13.536 -7.463 163 H ILE 18 H ILE 18 5.916 -9.805 -2.083 164 HA ILE 18 HA ILE 18 7.769 -8.064 -0.827 165 HB ILE 18 HB ILE 18 4.737 -7.894 -1.110 166 HG12 ILE 18 2HG1 ILE 18 6.957 -6.390 -2.583 167 HG13 ILE 18 3HG1 ILE 18 6.087 -7.775 -3.227 168 HG21 ILE 18 1HG2 ILE 18 6.610 -5.735 -0.085 169 HG22 ILE 18 2HG2 ILE 18 5.378 -6.577 0.858 170 HG23 ILE 18 3HG2 ILE 18 4.900 -5.516 -0.462 171 HD11 ILE 18 3HD1 ILE 18 5.267 -5.713 -4.177 172 HD12 ILE 18 1HD1 ILE 18 4.886 -5.083 -2.573 173 HD13 ILE 18 2HD1 ILE 18 4.011 -6.481 -3.208 174 H LYS 19 H LYS 19 5.197 -10.202 0.473 175 HA LYS 19 HA LYS 19 5.180 -9.346 3.140 176 HB2 LYS 19 2HB LYS 19 4.659 -12.082 1.933 177 HB3 LYS 19 3HB LYS 19 4.563 -11.820 3.675 178 HG2 LYS 19 2HG LYS 19 2.842 -10.070 3.283 179 HG3 LYS 19 3HG LYS 19 2.879 -10.455 1.560 180 HD2 LYS 19 2HD LYS 19 2.152 -12.755 2.034 181 HD3 LYS 19 3HD LYS 19 2.187 -12.428 3.770 182 HE2 LYS 19 2HE LYS 19 0.406 -10.717 3.443 183 HE3 LYS 19 3HE LYS 19 0.341 -11.144 1.731 184 HZ1 LYS 19 3HZ LYS 19 -1.384 -12.269 2.981 185 HZ2 LYS 19 1HZ LYS 19 -0.233 -12.976 4.002 186 HZ3 LYS 19 2HZ LYS 19 -0.287 -13.396 2.366 187 H LYS 20 H LYS 20 7.368 -11.671 1.535 188 HA LYS 20 HA LYS 20 8.765 -12.422 3.939 189 HB2 LYS 20 2HB LYS 20 9.592 -12.755 1.024 190 HB3 LYS 20 3HB LYS 20 10.403 -13.515 2.395 191 HG2 LYS 20 2HG LYS 20 7.565 -14.014 1.457 192 HG3 LYS 20 3HG LYS 20 8.935 -15.112 1.281 193 HD2 LYS 20 2HD LYS 20 9.043 -15.326 3.775 194 HD3 LYS 20 3HD LYS 20 7.657 -14.240 3.915 195 HE2 LYS 20 2HE LYS 20 6.265 -15.871 2.676 196 HE3 LYS 20 3HE LYS 20 7.650 -16.964 2.563 197 HZ1 LYS 20 3HZ LYS 20 6.399 -16.037 5.100 198 HZ2 LYS 20 1HZ LYS 20 7.685 -17.117 4.973 199 HZ3 LYS 20 2HZ LYS 20 6.163 -17.555 4.399 200 H GLU 21 H GLU 21 9.494 -10.287 1.213 201 HA GLU 21 HA GLU 21 11.901 -9.185 1.897 202 HB2 GLU 21 2HB GLU 21 9.497 -7.824 0.629 203 HB3 GLU 21 3HB GLU 21 11.063 -7.030 0.772 204 HG2 GLU 21 2HG GLU 21 10.439 -9.551 -0.788 205 HG3 GLU 21 3HG GLU 21 10.800 -7.961 -1.454 206 H VAL 22 H VAL 22 8.750 -8.138 3.142 207 HA VAL 22 HA VAL 22 9.978 -6.066 4.807 208 HB VAL 22 HB VAL 22 7.775 -5.198 5.164 209 HG11 VAL 22 1HG1 VAL 22 6.977 -4.817 2.853 210 HG12 VAL 22 2HG1 VAL 22 7.970 -6.154 2.279 211 HG13 VAL 22 3HG1 VAL 22 8.730 -4.713 2.945 212 HG21 VAL 22 3HG2 VAL 22 5.708 -6.325 4.369 213 HG22 VAL 22 1HG2 VAL 22 6.534 -7.253 5.621 214 HG23 VAL 22 2HG2 VAL 22 6.664 -7.745 3.929 215 H GLU 23 H GLU 23 8.890 -9.313 5.120 216 HA GLU 23 HA GLU 23 8.245 -9.470 7.868 217 HB2 GLU 23 2HB GLU 23 7.943 -11.312 6.139 218 HB3 GLU 23 3HB GLU 23 9.679 -11.586 6.187 219 HG2 GLU 23 2HG GLU 23 8.660 -13.261 7.547 220 HG3 GLU 23 3HG GLU 23 9.449 -12.123 8.642 221 H ASN 24 H ASN 24 11.267 -9.720 6.093 222 HA ASN 24 HA ASN 24 13.067 -10.101 8.244 223 HB2 ASN 24 2HB ASN 24 13.514 -8.968 5.444 224 HB3 ASN 24 3HB ASN 24 14.815 -9.404 6.553 225 HD21 ASN 24 1HD2 ASN 24 14.201 -10.474 3.899 226 HD22 ASN 24 2HD2 ASN 24 13.975 -12.175 4.106 227 H GLN 25 H GLN 25 11.482 -7.291 6.972 228 HA GLN 25 HA GLN 25 13.239 -5.355 8.296 229 HB2 GLN 25 2HB GLN 25 10.752 -4.939 6.578 230 HB3 GLN 25 3HB GLN 25 11.805 -3.659 7.177 231 HG2 GLN 25 2HG GLN 25 12.629 -5.844 5.242 232 HG3 GLN 25 3HG GLN 25 12.197 -4.198 4.801 233 HE21 GLN 25 1HE2 GLN 25 14.656 -6.246 6.128 234 HE22 GLN 25 2HE2 GLN 25 15.901 -5.052 6.196 235 H GLY 26 H GLY 26 10.724 -7.267 9.315 236 HA2 GLY 26 2HA GLY 26 9.394 -7.272 11.149 237 HA3 GLY 26 3HA GLY 26 10.259 -5.855 11.711 238 H TYR 27 H TYR 27 8.350 -5.994 8.733 239 HA TYR 27 HA TYR 27 6.350 -4.135 9.885 240 HB2 TYR 27 2HB TYR 27 7.125 -4.739 6.995 241 HB3 TYR 27 3HB TYR 27 5.653 -3.864 7.405 242 HD1 TYR 27 HD2 TYR 27 9.366 -3.737 7.923 243 HD2 TYR 27 HD1 TYR 27 5.739 -1.502 7.625 244 HE1 TYR 27 HE2 TYR 27 10.654 -1.648 7.990 245 HE2 TYR 27 HE1 TYR 27 7.027 0.595 7.698 246 HH TYR 27 HH TYR 27 10.391 0.739 7.298 247 H GLN 28 H GLN 28 4.362 -4.916 10.361 248 HA GLN 28 HA GLN 28 3.740 -7.712 9.815 249 HB2 GLN 28 2HB GLN 28 1.937 -5.684 11.200 250 HB3 GLN 28 3HB GLN 28 1.873 -7.441 11.316 251 HG2 GLN 28 2HG GLN 28 3.975 -5.597 12.452 252 HG3 GLN 28 3HG GLN 28 2.784 -6.532 13.348 253 HE21 GLN 28 1HE2 GLN 28 5.719 -6.455 13.533 254 HE22 GLN 28 2HE2 GLN 28 6.254 -8.086 13.316 255 H VAL 29 H VAL 29 2.681 -8.330 8.049 256 HA VAL 29 HA VAL 29 1.433 -6.353 6.280 257 HB VAL 29 HB VAL 29 1.799 -9.344 5.750 258 HG11 VAL 29 1HG1 VAL 29 0.098 -8.277 4.308 259 HG12 VAL 29 2HG1 VAL 29 1.528 -8.697 3.363 260 HG13 VAL 29 3HG1 VAL 29 1.254 -7.023 3.850 261 HG21 VAL 29 3HG2 VAL 29 3.789 -8.732 4.446 262 HG22 VAL 29 1HG2 VAL 29 3.981 -8.281 6.143 263 HG23 VAL 29 2HG2 VAL 29 3.603 -7.045 4.940 264 H ARG 30 H ARG 30 -0.694 -6.264 5.843 265 HA ARG 30 HA ARG 30 -2.541 -8.412 6.663 266 HB2 ARG 30 2HB ARG 30 -3.087 -5.401 6.591 267 HB3 ARG 30 3HB ARG 30 -4.311 -6.635 6.884 268 HG2 ARG 30 2HG ARG 30 -1.929 -6.032 8.674 269 HG3 ARG 30 3HG ARG 30 -3.598 -5.530 8.965 270 HD2 ARG 30 2HD ARG 30 -4.261 -7.940 9.057 271 HD3 ARG 30 3HD ARG 30 -2.562 -8.383 8.874 272 HE ARG 30 HE ARG 30 -2.110 -7.497 11.026 273 HH11 ARG 30 1HH1 ARG 30 -5.541 -7.576 10.276 274 HH12 ARG 30 2HH1 ARG 30 -6.032 -7.468 11.934 275 HH21 ARG 30 1HH2 ARG 30 -2.761 -7.334 13.192 276 HH22 ARG 30 2HH2 ARG 30 -4.447 -7.335 13.587 277 H ASP 31 H ASP 31 -3.822 -9.095 4.983 278 HA ASP 31 HA ASP 31 -3.761 -7.564 2.436 279 HB2 ASP 31 2HB ASP 31 -3.901 -9.726 1.186 280 HB3 ASP 31 3HB ASP 31 -2.400 -9.563 2.086 281 H VAL 32 H VAL 32 -5.700 -7.085 1.644 282 HA VAL 32 HA VAL 32 -8.058 -7.829 3.271 283 HB VAL 32 HB VAL 32 -7.497 -5.316 1.617 284 HG11 VAL 32 1HG1 VAL 32 -9.895 -5.864 1.555 285 HG12 VAL 32 2HG1 VAL 32 -9.607 -4.425 2.533 286 HG13 VAL 32 3HG1 VAL 32 -9.930 -5.972 3.319 287 HG21 VAL 32 3HG2 VAL 32 -6.201 -5.385 3.708 288 HG22 VAL 32 1HG2 VAL 32 -7.673 -5.696 4.634 289 HG23 VAL 32 2HG2 VAL 32 -7.459 -4.149 3.807 290 H ASN 33 H ASN 33 -9.276 -9.324 2.265 291 HA ASN 33 HA ASN 33 -9.518 -9.410 -0.656 292 HB2 ASN 33 2HB ASN 33 -10.491 -11.316 1.513 293 HB3 ASN 33 3HB ASN 33 -10.666 -11.593 -0.221 294 HD21 ASN 33 1HD2 ASN 33 -9.283 -13.179 1.797 295 HD22 ASN 33 2HD2 ASN 33 -7.639 -13.304 1.269 296 H ASP 34 H ASP 34 -11.259 -8.148 2.022 297 HA ASP 34 HA ASP 34 -13.682 -7.766 0.410 298 HB2 ASP 34 2HB ASP 34 -14.041 -9.928 1.562 299 HB3 ASP 34 3HB ASP 34 -13.675 -9.185 3.118 300 H SER 35 H SER 35 -15.071 -6.129 1.202 301 HA SER 35 HA SER 35 -13.935 -3.835 2.228 302 HB2 SER 35 2HB SER 35 -16.387 -3.107 2.533 303 HB3 SER 35 3HB SER 35 -15.923 -3.657 0.923 304 HG SER 35 HG SER 35 -17.551 -4.908 2.836 305 H ASP 36 H ASP 36 -15.934 -6.233 3.970 306 HA ASP 36 HA ASP 36 -16.040 -4.838 6.431 307 HB2 ASP 36 2HB ASP 36 -16.355 -7.802 5.807 308 HB3 ASP 36 3HB ASP 36 -16.649 -7.118 7.403 309 H GLU 37 H GLU 37 -13.666 -7.093 5.097 310 HA GLU 37 HA GLU 37 -12.063 -7.500 7.390 311 HB2 GLU 37 2HB GLU 37 -11.270 -7.435 4.449 312 HB3 GLU 37 3HB GLU 37 -10.219 -8.008 5.747 313 HG2 GLU 37 2HG GLU 37 -12.887 -9.215 4.950 314 HG3 GLU 37 3HG GLU 37 -11.303 -9.859 4.527 315 H LEU 38 H LEU 38 -11.823 -5.128 4.749 316 HA LEU 38 HA LEU 38 -9.629 -3.611 5.464 317 HB2 LEU 38 2HB LEU 38 -10.919 -3.434 3.383 318 HB3 LEU 38 3HB LEU 38 -12.275 -2.749 4.243 319 HG LEU 38 HG LEU 38 -9.621 -1.263 4.165 320 HD11 LEU 38 1HD1 LEU 38 -10.415 -0.089 2.168 321 HD12 LEU 38 2HD1 LEU 38 -11.807 -1.172 2.072 322 HD13 LEU 38 3HD1 LEU 38 -10.170 -1.805 1.852 323 HD21 LEU 38 3HD2 LEU 38 -12.496 -0.263 4.340 324 HD22 LEU 38 1HD2 LEU 38 -11.043 0.745 4.360 325 HD23 LEU 38 2HD2 LEU 38 -11.366 -0.358 5.695 326 H LYS 39 H LYS 39 -12.991 -3.268 6.520 327 HA LYS 39 HA LYS 39 -12.564 -0.888 8.048 328 HB2 LYS 39 2HB LYS 39 -14.961 -2.771 8.047 329 HB3 LYS 39 3HB LYS 39 -14.932 -1.112 8.660 330 HG2 LYS 39 2HG LYS 39 -14.283 -0.385 6.282 331 HG3 LYS 39 3HG LYS 39 -14.651 -2.033 5.788 332 HD2 LYS 39 2HD LYS 39 -16.639 -0.934 5.301 333 HD3 LYS 39 3HD LYS 39 -16.982 -1.611 6.892 334 HE2 LYS 39 2HE LYS 39 -17.780 0.679 6.791 335 HE3 LYS 39 3HE LYS 39 -16.412 0.611 7.906 336 HZ1 LYS 39 3HZ LYS 39 -16.265 1.478 5.062 337 HZ2 LYS 39 1HZ LYS 39 -14.989 1.492 6.169 338 HZ3 LYS 39 2HZ LYS 39 -16.314 2.520 6.390 339 H LYS 40 H LYS 40 -12.471 -4.335 8.794 340 HA LYS 40 HA LYS 40 -12.393 -4.096 11.646 341 HB2 LYS 40 2HB LYS 40 -11.312 -6.275 9.807 342 HB3 LYS 40 3HB LYS 40 -11.249 -6.379 11.562 343 HG2 LYS 40 2HG LYS 40 -13.764 -6.248 9.879 344 HG3 LYS 40 3HG LYS 40 -13.086 -7.695 10.633 345 HD2 LYS 40 2HD LYS 40 -13.411 -6.559 12.884 346 HD3 LYS 40 3HD LYS 40 -14.265 -5.261 12.037 347 HE2 LYS 40 2HE LYS 40 -15.073 -8.191 12.148 348 HE3 LYS 40 3HE LYS 40 -15.875 -6.848 12.962 349 HZ1 LYS 40 3HZ LYS 40 -15.667 -7.223 10.023 350 HZ2 LYS 40 1HZ LYS 40 -16.420 -5.925 10.792 351 HZ3 LYS 40 2HZ LYS 40 -17.050 -7.483 10.962 352 H GLU 41 H GLU 41 -9.926 -4.101 9.073 353 HA GLU 41 HA GLU 41 -7.621 -4.244 10.665 354 HB2 GLU 41 2HB GLU 41 -7.769 -2.718 8.026 355 HB3 GLU 41 3HB GLU 41 -6.343 -3.459 8.750 356 HG2 GLU 41 2HG GLU 41 -8.695 -4.806 7.423 357 HG3 GLU 41 3HG GLU 41 -7.005 -4.853 6.944 358 H MET 42 H MET 42 -9.478 -1.452 9.534 359 HA MET 42 HA MET 42 -7.862 0.639 10.488 360 HB2 MET 42 2HB MET 42 -10.879 0.518 10.084 361 HB3 MET 42 3HB MET 42 -9.991 2.009 10.423 362 HG2 MET 42 2HG MET 42 -9.591 0.204 8.036 363 HG3 MET 42 3HG MET 42 -10.387 1.784 8.044 364 HE1 MET 42 3HE MET 42 -6.781 2.034 6.245 365 HE2 MET 42 1HE MET 42 -8.516 2.070 5.944 366 HE3 MET 42 2HE MET 42 -7.729 0.557 6.395 367 H LYS 43 H LYS 43 -10.319 -1.276 12.085 368 HA LYS 43 HA LYS 43 -10.506 0.251 14.478 369 HB2 LYS 43 2HB LYS 43 -11.237 -2.630 13.824 370 HB3 LYS 43 3HB LYS 43 -11.619 -1.859 15.366 371 HG2 LYS 43 2HG LYS 43 -13.100 -0.297 14.344 372 HG3 LYS 43 3HG LYS 43 -12.516 -0.680 12.722 373 HD2 LYS 43 2HD LYS 43 -13.546 -2.901 12.848 374 HD3 LYS 43 3HD LYS 43 -14.087 -2.586 14.501 375 HE2 LYS 43 2HE LYS 43 -15.877 -2.299 12.764 376 HE3 LYS 43 3HE LYS 43 -15.599 -0.854 13.735 377 HZ1 LYS 43 3HZ LYS 43 -14.345 0.107 11.946 378 HZ2 LYS 43 1HZ LYS 43 -15.852 -0.389 11.359 379 HZ3 LYS 43 2HZ LYS 43 -14.470 -1.306 11.025 380 H LYS 44 H LYS 44 -8.542 -2.544 13.453 381 HA LYS 44 HA LYS 44 -7.222 -2.945 15.950 382 HB2 LYS 44 2HB LYS 44 -6.168 -3.666 13.180 383 HB3 LYS 44 3HB LYS 44 -5.661 -4.371 14.709 384 HG2 LYS 44 2HG LYS 44 -8.342 -4.724 13.330 385 HG3 LYS 44 3HG LYS 44 -7.063 -5.919 13.468 386 HD2 LYS 44 2HD LYS 44 -8.404 -6.698 15.161 387 HD3 LYS 44 3HD LYS 44 -7.514 -5.515 16.117 388 HE2 LYS 44 2HE LYS 44 -9.386 -3.886 15.704 389 HE3 LYS 44 3HE LYS 44 -10.258 -5.167 14.860 390 HZ1 LYS 44 3HZ LYS 44 -9.396 -5.321 17.698 391 HZ2 LYS 44 1HZ LYS 44 -10.370 -6.426 16.878 392 HZ3 LYS 44 2HZ LYS 44 -10.941 -4.866 17.195 393 H LEU 45 H LEU 45 -6.523 -0.933 13.121 394 HA LEU 45 HA LEU 45 -3.988 0.066 13.878 395 HB2 LEU 45 2HB LEU 45 -6.156 1.378 12.189 396 HB3 LEU 45 3HB LEU 45 -4.499 1.957 12.298 397 HG LEU 45 HG LEU 45 -5.371 -0.719 11.134 398 HD11 LEU 45 1HD1 LEU 45 -4.706 0.179 8.967 399 HD12 LEU 45 2HD1 LEU 45 -4.339 1.741 9.706 400 HD13 LEU 45 3HD1 LEU 45 -5.999 1.138 9.686 401 HD21 LEU 45 3HD2 LEU 45 -3.167 -0.925 12.153 402 HD22 LEU 45 1HD2 LEU 45 -2.593 0.487 11.258 403 HD23 LEU 45 2HD2 LEU 45 -3.048 -0.989 10.398 404 H ALA 46 H ALA 46 -7.223 0.918 14.881 405 HA ALA 46 HA ALA 46 -6.497 3.390 16.200 406 HB1 ALA 46 3HB ALA 46 -9.059 1.771 16.328 407 HB2 ALA 46 1HB ALA 46 -8.728 3.093 15.203 408 HB3 ALA 46 2HB ALA 46 -8.840 3.416 16.937 409 H GLU 47 H GLU 47 -7.415 0.080 17.213 410 HA GLU 47 HA GLU 47 -7.407 0.567 20.024 411 HB2 GLU 47 2HB GLU 47 -7.418 -1.997 18.370 412 HB3 GLU 47 3HB GLU 47 -7.574 -1.983 20.124 413 HG2 GLU 47 2HG GLU 47 -9.681 -0.832 20.016 414 HG3 GLU 47 3HG GLU 47 -9.486 -0.512 18.289 415 H GLU 48 H GLU 48 -5.130 -0.921 17.773 416 HA GLU 48 HA GLU 48 -3.150 -1.482 19.857 417 HB2 GLU 48 2HB GLU 48 -3.477 -3.119 17.970 418 HB3 GLU 48 3HB GLU 48 -2.933 -1.891 16.830 419 HG2 GLU 48 2HG GLU 48 -0.716 -1.855 17.871 420 HG3 GLU 48 3HG GLU 48 -1.246 -3.000 19.101 421 H LYS 49 H LYS 49 -1.564 -0.109 20.323 422 HA LYS 49 HA LYS 49 -1.754 2.596 19.468 423 HB2 LYS 49 2HB LYS 49 0.414 1.308 21.197 424 HB3 LYS 49 3HB LYS 49 0.044 3.031 21.094 425 HG2 LYS 49 2HG LYS 49 -1.714 0.847 22.258 426 HG3 LYS 49 3HG LYS 49 -0.894 2.136 23.145 427 HD2 LYS 49 2HD LYS 49 -2.330 3.819 22.007 428 HD3 LYS 49 3HD LYS 49 -3.138 2.527 21.115 429 HE2 LYS 49 2HE LYS 49 -4.512 3.239 23.011 430 HE3 LYS 49 3HE LYS 49 -3.963 1.579 23.249 431 HZ1 LYS 49 3HZ LYS 49 -3.768 2.883 25.274 432 HZ2 LYS 49 1HZ LYS 49 -2.756 3.994 24.497 433 HZ3 LYS 49 2HZ LYS 49 -2.246 2.406 24.736 434 H ASN 50 H ASN 50 -0.021 3.884 18.641 435 HA ASN 50 HA ASN 50 1.130 2.672 16.292 436 HB2 ASN 50 2HB ASN 50 1.840 5.051 15.763 437 HB3 ASN 50 3HB ASN 50 0.109 4.803 15.940 438 HD21 ASN 50 1HD2 ASN 50 -0.950 5.673 17.780 439 HD22 ASN 50 2HD2 ASN 50 -0.218 6.908 18.745 440 H PHE 51 H PHE 51 2.469 1.245 17.651 441 HA PHE 51 HA PHE 51 5.229 2.296 17.716 442 HB2 PHE 51 2HB PHE 51 4.025 0.423 19.814 443 HB3 PHE 51 3HB PHE 51 5.729 0.844 19.700 444 HD1 PHE 51 HD1 PHE 51 6.174 3.529 19.681 445 HD2 PHE 51 HD2 PHE 51 2.769 1.593 21.421 446 HE1 PHE 51 HE1 PHE 51 5.818 5.457 21.168 447 HE2 PHE 51 HE2 PHE 51 2.427 3.530 22.895 448 HZ PHE 51 HZ PHE 51 3.951 5.459 22.769 449 H GLU 52 H GLU 52 3.345 0.697 15.926 450 HA GLU 52 HA GLU 52 5.309 -1.216 14.996 451 HB2 GLU 52 2HB GLU 52 4.096 -2.655 16.566 452 HB3 GLU 52 3HB GLU 52 2.544 -2.147 15.909 453 HG2 GLU 52 2HG GLU 52 3.172 -4.420 15.165 454 HG3 GLU 52 3HG GLU 52 2.995 -3.306 13.812 455 H LYS 53 H LYS 53 5.308 -1.128 12.823 456 HA LYS 53 HA LYS 53 3.284 0.531 11.500 457 HB2 LYS 53 2HB LYS 53 5.923 -0.517 10.404 458 HB3 LYS 53 3HB LYS 53 4.870 0.653 9.627 459 HG2 LYS 53 2HG LYS 53 6.571 1.986 10.525 460 HG3 LYS 53 3HG LYS 53 5.277 2.144 11.709 461 HD2 LYS 53 2HD LYS 53 7.441 1.871 12.829 462 HD3 LYS 53 3HD LYS 53 6.409 0.473 13.160 463 HE2 LYS 53 2HE LYS 53 8.723 -0.217 12.670 464 HE3 LYS 53 3HE LYS 53 7.616 -0.828 11.443 465 HZ1 LYS 53 3HZ LYS 53 9.461 1.481 11.213 466 HZ2 LYS 53 1HZ LYS 53 8.288 1.122 10.052 467 HZ3 LYS 53 2HZ LYS 53 9.543 0.032 10.360 468 H ILE 54 H ILE 54 1.846 -0.240 10.015 469 HA ILE 54 HA ILE 54 1.795 -3.166 9.561 470 HB ILE 54 HB ILE 54 -0.581 -1.248 9.662 471 HG12 ILE 54 2HG1 ILE 54 0.459 -1.455 11.925 472 HG13 ILE 54 3HG1 ILE 54 -1.138 -2.188 11.880 473 HG21 ILE 54 1HG2 ILE 54 -0.502 -4.282 9.559 474 HG22 ILE 54 2HG2 ILE 54 -0.993 -3.206 8.251 475 HG23 ILE 54 3HG2 ILE 54 -1.962 -3.300 9.722 476 HD11 ILE 54 3HD1 ILE 54 0.425 -3.502 13.180 477 HD12 ILE 54 1HD1 ILE 54 1.489 -3.668 11.785 478 HD13 ILE 54 2HD1 ILE 54 -0.116 -4.406 11.767 479 H LEU 55 H LEU 55 2.337 -3.618 7.500 480 HA LEU 55 HA LEU 55 1.839 -1.811 5.266 481 HB2 LEU 55 2HB LEU 55 3.924 -3.168 5.471 482 HB3 LEU 55 3HB LEU 55 2.983 -4.640 5.340 483 HG LEU 55 HG LEU 55 2.874 -2.621 3.077 484 HD11 LEU 55 1HD1 LEU 55 4.796 -3.644 1.991 485 HD12 LEU 55 2HD1 LEU 55 5.084 -4.658 3.410 486 HD13 LEU 55 3HD1 LEU 55 5.263 -2.903 3.520 487 HD21 LEU 55 3HD2 LEU 55 2.559 -4.611 1.677 488 HD22 LEU 55 1HD2 LEU 55 1.358 -4.553 2.963 489 HD23 LEU 55 2HD2 LEU 55 2.732 -5.654 3.094 490 H ILE 56 H ILE 56 0.099 -2.006 3.870 491 HA ILE 56 HA ILE 56 -1.762 -4.287 4.234 492 HB ILE 56 HB ILE 56 -2.529 -1.521 3.203 493 HG12 ILE 56 2HG1 ILE 56 -1.820 -1.373 5.631 494 HG13 ILE 56 3HG1 ILE 56 -3.503 -0.944 5.359 495 HG21 ILE 56 1HG2 ILE 56 -4.857 -2.292 3.620 496 HG22 ILE 56 2HG2 ILE 56 -4.236 -3.870 4.103 497 HG23 ILE 56 3HG2 ILE 56 -4.015 -3.304 2.446 498 HD11 ILE 56 3HD1 ILE 56 -3.197 -2.245 7.381 499 HD12 ILE 56 1HD1 ILE 56 -2.513 -3.575 6.448 500 HD13 ILE 56 2HD1 ILE 56 -4.204 -3.111 6.221 501 H ILE 57 H ILE 57 -2.211 -5.461 2.453 502 HA ILE 57 HA ILE 57 -1.561 -4.498 -0.261 503 HB ILE 57 HB ILE 57 -1.718 -7.394 0.739 504 HG12 ILE 57 2HG1 ILE 57 0.732 -5.797 -0.158 505 HG13 ILE 57 3HG1 ILE 57 0.344 -6.213 1.505 506 HG21 ILE 57 1HG2 ILE 57 -1.005 -6.363 -2.033 507 HG22 ILE 57 2HG2 ILE 57 -2.501 -7.190 -1.591 508 HG23 ILE 57 3HG2 ILE 57 -0.965 -8.054 -1.519 509 HD11 ILE 57 3HD1 ILE 57 1.034 -8.164 -0.693 510 HD12 ILE 57 1HD1 ILE 57 0.609 -8.589 0.969 511 HD13 ILE 57 2HD1 ILE 57 2.066 -7.656 0.643 512 H SER 58 H SER 58 -3.286 -4.406 -1.648 513 HA SER 58 HA SER 58 -5.770 -5.884 -1.094 514 HB2 SER 58 2HB SER 58 -6.111 -3.593 -0.142 515 HB3 SER 58 3HB SER 58 -5.677 -2.880 -1.696 516 HG SER 58 HG SER 58 -7.741 -3.044 -2.093 517 H ASN 59 H ASN 59 -6.459 -6.834 -2.922 518 HA ASN 59 HA ASN 59 -5.069 -6.357 -5.432 519 HB2 ASN 59 2HB ASN 59 -7.223 -8.385 -4.684 520 HB3 ASN 59 3HB ASN 59 -6.475 -8.285 -6.276 521 HD21 ASN 59 1HD2 ASN 59 -5.573 -10.333 -6.199 522 HD22 ASN 59 2HD2 ASN 59 -4.279 -10.753 -5.137 523 H ASP 60 H ASP 60 -7.735 -5.002 -3.930 524 HA ASP 60 HA ASP 60 -9.071 -4.305 -6.482 525 HB2 ASP 60 2HB ASP 60 -10.528 -5.636 -5.006 526 HB3 ASP 60 3HB ASP 60 -10.283 -4.488 -3.691 527 H LYS 61 H LYS 61 -9.472 -2.232 -6.936 528 HA LYS 61 HA LYS 61 -7.776 -0.266 -5.674 529 HB2 LYS 61 2HB LYS 61 -9.545 -0.142 -8.142 530 HB3 LYS 61 3HB LYS 61 -8.441 1.138 -7.639 531 HG2 LYS 61 2HG LYS 61 -6.519 -0.306 -7.927 532 HG3 LYS 61 3HG LYS 61 -7.557 -1.701 -8.258 533 HD2 LYS 61 2HD LYS 61 -8.367 -0.581 -10.325 534 HD3 LYS 61 3HD LYS 61 -7.309 0.796 -9.991 535 HE2 LYS 61 2HE LYS 61 -5.340 -0.554 -10.305 536 HE3 LYS 61 3HE LYS 61 -6.292 -2.039 -10.362 537 HZ1 LYS 61 3HZ LYS 61 -7.245 -1.358 -12.432 538 HZ2 LYS 61 1HZ LYS 61 -5.567 -1.253 -12.554 539 HZ3 LYS 61 2HZ LYS 61 -6.483 0.148 -12.359 540 H GLN 62 H GLN 62 -11.253 -0.893 -5.764 541 HA GLN 62 HA GLN 62 -12.087 1.726 -4.908 542 HB2 GLN 62 2HB GLN 62 -13.716 0.287 -5.994 543 HB3 GLN 62 3HB GLN 62 -13.480 -0.978 -4.792 544 HG2 GLN 62 2HG GLN 62 -14.484 0.449 -3.057 545 HG3 GLN 62 3HG GLN 62 -14.682 1.754 -4.227 546 HE21 GLN 62 1HE2 GLN 62 -16.294 1.551 -5.847 547 HE22 GLN 62 2HE2 GLN 62 -17.584 0.411 -5.705 548 H LEU 63 H LEU 63 -11.381 -1.369 -3.290 549 HA LEU 63 HA LEU 63 -11.857 -0.643 -0.634 550 HB2 LEU 63 2HB LEU 63 -9.821 -2.586 -1.808 551 HB3 LEU 63 3HB LEU 63 -10.140 -2.444 -0.083 552 HG LEU 63 HG LEU 63 -12.090 -3.403 -2.213 553 HD11 LEU 63 1HD1 LEU 63 -10.804 -4.880 0.101 554 HD12 LEU 63 2HD1 LEU 63 -10.415 -5.074 -1.610 555 HD13 LEU 63 3HD1 LEU 63 -12.005 -5.542 -1.013 556 HD21 LEU 63 3HD2 LEU 63 -13.662 -3.835 -0.340 557 HD22 LEU 63 1HD2 LEU 63 -13.352 -2.120 -0.588 558 HD23 LEU 63 2HD2 LEU 63 -12.578 -2.968 0.756 559 H LEU 64 H LEU 64 -8.952 -0.347 -2.638 560 HA LEU 64 HA LEU 64 -7.143 0.679 -0.814 561 HB2 LEU 64 2HB LEU 64 -6.531 -0.082 -3.018 562 HB3 LEU 64 3HB LEU 64 -7.478 1.172 -3.781 563 HG LEU 64 HG LEU 64 -5.168 2.039 -2.032 564 HD11 LEU 64 1HD1 LEU 64 -4.183 0.252 -3.362 565 HD12 LEU 64 2HD1 LEU 64 -3.596 1.823 -3.899 566 HD13 LEU 64 3HD1 LEU 64 -4.821 0.972 -4.845 567 HD21 LEU 64 3HD2 LEU 64 -6.610 3.772 -3.037 568 HD22 LEU 64 1HD2 LEU 64 -6.284 3.125 -4.648 569 HD23 LEU 64 2HD2 LEU 64 -4.981 3.850 -3.703 570 H LYS 65 H LYS 65 -9.460 2.529 -2.869 571 HA LYS 65 HA LYS 65 -8.756 5.128 -2.045 572 HB2 LYS 65 2HB LYS 65 -11.504 4.126 -2.896 573 HB3 LYS 65 3HB LYS 65 -10.994 5.816 -2.861 574 HG2 LYS 65 2HG LYS 65 -9.359 5.404 -4.619 575 HG3 LYS 65 3HG LYS 65 -9.725 3.675 -4.591 576 HD2 LYS 65 2HD LYS 65 -10.867 4.709 -6.484 577 HD3 LYS 65 3HD LYS 65 -12.051 4.155 -5.304 578 HE2 LYS 65 2HE LYS 65 -12.283 6.483 -4.466 579 HE3 LYS 65 3HE LYS 65 -11.114 7.026 -5.673 580 HZ1 LYS 65 3HZ LYS 65 -12.623 6.326 -7.415 581 HZ2 LYS 65 1HZ LYS 65 -13.408 7.401 -6.376 582 HZ3 LYS 65 2HZ LYS 65 -13.734 5.747 -6.281 583 H GLU 66 H GLU 66 -11.400 3.058 -0.851 584 HA GLU 66 HA GLU 66 -12.590 4.676 1.075 585 HB2 GLU 66 2HB GLU 66 -13.153 2.273 0.027 586 HB3 GLU 66 3HB GLU 66 -12.369 1.667 1.477 587 HG2 GLU 66 2HG GLU 66 -14.758 3.534 1.443 588 HG3 GLU 66 3HG GLU 66 -14.881 1.786 1.556 589 H MET 67 H MET 67 -10.116 2.228 1.428 590 HA MET 67 HA MET 67 -9.421 2.316 4.083 591 HB2 MET 67 2HB MET 67 -8.655 0.560 2.712 592 HB3 MET 67 3HB MET 67 -7.955 1.637 1.528 593 HG2 MET 67 2HG MET 67 -5.971 1.786 2.656 594 HG3 MET 67 3HG MET 67 -6.739 1.664 4.235 595 HE1 MET 67 3HE MET 67 -6.426 -2.137 1.610 596 HE2 MET 67 1HE MET 67 -6.211 -0.523 0.932 597 HE3 MET 67 2HE MET 67 -7.793 -1.026 1.539 598 H LEU 68 H LEU 68 -7.914 4.207 1.423 599 HA LEU 68 HA LEU 68 -5.948 5.442 3.054 600 HB2 LEU 68 2HB LEU 68 -7.050 6.236 0.336 601 HB3 LEU 68 3HB LEU 68 -5.657 7.008 1.090 602 HG LEU 68 HG LEU 68 -5.841 4.090 0.246 603 HD11 LEU 68 1HD1 LEU 68 -5.584 5.632 -1.633 604 HD12 LEU 68 2HD1 LEU 68 -4.136 4.659 -1.390 605 HD13 LEU 68 3HD1 LEU 68 -4.163 6.346 -0.864 606 HD21 LEU 68 3HD2 LEU 68 -3.561 5.573 1.578 607 HD22 LEU 68 1HD2 LEU 68 -3.466 3.950 0.885 608 HD23 LEU 68 2HD2 LEU 68 -4.514 4.253 2.266 609 H GLU 69 H GLU 69 -9.206 6.438 2.158 610 HA GLU 69 HA GLU 69 -9.030 9.101 3.211 611 HB2 GLU 69 2HB GLU 69 -11.482 7.388 2.631 612 HB3 GLU 69 3HB GLU 69 -11.497 9.125 2.947 613 HG2 GLU 69 2HG GLU 69 -10.144 9.518 0.925 614 HG3 GLU 69 3HG GLU 69 -10.089 7.784 0.611 615 H LEU 70 H LEU 70 -9.908 5.939 4.572 616 HA LEU 70 HA LEU 70 -10.696 6.920 7.152 617 HB2 LEU 70 2HB LEU 70 -9.733 4.190 6.232 618 HB3 LEU 70 3HB LEU 70 -10.264 4.511 7.877 619 HG LEU 70 HG LEU 70 -12.016 4.793 5.394 620 HD11 LEU 70 1HD1 LEU 70 -12.028 2.627 7.514 621 HD12 LEU 70 2HD1 LEU 70 -11.439 2.451 5.856 622 HD13 LEU 70 3HD1 LEU 70 -13.147 2.773 6.151 623 HD21 LEU 70 3HD2 LEU 70 -12.763 4.969 8.335 624 HD22 LEU 70 1HD2 LEU 70 -13.882 5.037 6.969 625 HD23 LEU 70 2HD2 LEU 70 -12.700 6.323 7.200 626 H ILE 71 H ILE 71 -7.576 5.897 5.755 627 HA ILE 71 HA ILE 71 -6.035 6.043 8.158 628 HB ILE 71 HB ILE 71 -5.035 6.317 5.278 629 HG12 ILE 71 2HG1 ILE 71 -5.117 3.821 7.040 630 HG13 ILE 71 3HG1 ILE 71 -6.224 4.149 5.716 631 HG21 ILE 71 1HG2 ILE 71 -2.824 5.632 6.209 632 HG22 ILE 71 2HG2 ILE 71 -3.505 5.691 7.835 633 HG23 ILE 71 3HG2 ILE 71 -3.379 7.167 6.876 634 HD11 ILE 71 3HD1 ILE 71 -4.522 2.576 5.039 635 HD12 ILE 71 1HD1 ILE 71 -3.246 3.717 5.467 636 HD13 ILE 71 2HD1 ILE 71 -4.347 4.078 4.134 637 H SER 72 H SER 72 -7.041 8.391 5.751 638 HA SER 72 HA SER 72 -5.373 10.556 6.375 639 HB2 SER 72 2HB SER 72 -6.836 10.439 4.365 640 HB3 SER 72 3HB SER 72 -8.261 10.622 5.387 641 HG SER 72 HG SER 72 -7.401 12.684 6.018 642 H LYS 73 H LYS 73 -8.329 9.345 7.904 643 HA LYS 73 HA LYS 73 -8.692 11.554 9.692 644 HB2 LYS 73 2HB LYS 73 -9.706 8.720 10.147 645 HB3 LYS 73 3HB LYS 73 -10.401 10.224 10.746 646 HG2 LYS 73 2HG LYS 73 -10.424 9.172 7.899 647 HG3 LYS 73 3HG LYS 73 -11.806 9.373 8.978 648 HD2 LYS 73 2HD LYS 73 -10.122 11.660 7.862 649 HD3 LYS 73 3HD LYS 73 -11.658 11.117 7.187 650 HE2 LYS 73 2HE LYS 73 -11.306 12.183 10.010 651 HE3 LYS 73 3HE LYS 73 -11.874 13.135 8.639 652 HZ1 LYS 73 3HZ LYS 73 -13.774 11.684 8.436 653 HZ2 LYS 73 1HZ LYS 73 -13.692 12.311 10.003 654 HZ3 LYS 73 2HZ LYS 73 -13.225 10.715 9.706 655 H LEU 74 H LEU 74 -6.887 8.556 9.766 656 HA LEU 74 HA LEU 74 -6.065 8.702 12.529 657 HB2 LEU 74 2HB LEU 74 -4.881 7.108 10.219 658 HB3 LEU 74 3HB LEU 74 -4.554 6.845 11.926 659 HG LEU 74 HG LEU 74 -7.252 6.407 10.569 660 HD11 LEU 74 1HD1 LEU 74 -5.587 4.750 9.854 661 HD12 LEU 74 2HD1 LEU 74 -6.826 4.014 10.867 662 HD13 LEU 74 3HD1 LEU 74 -5.229 4.359 11.541 663 HD21 LEU 74 3HD2 LEU 74 -7.523 7.051 12.915 664 HD22 LEU 74 1HD2 LEU 74 -6.389 5.791 13.416 665 HD23 LEU 74 2HD2 LEU 74 -7.935 5.356 12.681 666 H GLY 75 H GLY 75 -4.972 10.037 9.519 667 HA2 GLY 75 2HA GLY 75 -3.422 11.623 9.005 668 HA3 GLY 75 3HA GLY 75 -3.174 11.868 10.724 669 H TYR 76 H TYR 76 -2.672 8.796 9.083 670 HA TYR 76 HA TYR 76 0.125 8.765 9.944 671 HB2 TYR 76 2HB TYR 76 -1.653 6.583 8.790 672 HB3 TYR 76 3HB TYR 76 0.060 6.341 9.121 673 HD1 TYR 76 HD1 TYR 76 0.318 7.831 11.731 674 HD2 TYR 76 HD2 TYR 76 -2.681 5.107 10.363 675 HE1 TYR 76 HE1 TYR 76 -0.149 7.188 14.051 676 HE2 TYR 76 HE2 TYR 76 -3.163 4.473 12.693 677 HH TYR 76 HH TYR 76 -1.957 6.228 15.373 678 H LYS 77 H LYS 77 1.872 8.380 8.640 679 HA LYS 77 HA LYS 77 1.961 9.465 6.022 680 HB2 LYS 77 2HB LYS 77 3.968 7.635 7.407 681 HB3 LYS 77 3HB LYS 77 4.289 8.586 5.962 682 HG2 LYS 77 2HG LYS 77 3.610 9.764 8.676 683 HG3 LYS 77 3HG LYS 77 5.252 9.513 8.080 684 HD2 LYS 77 2HD LYS 77 3.165 11.289 6.754 685 HD3 LYS 77 3HD LYS 77 4.468 11.856 7.801 686 HE2 LYS 77 2HE LYS 77 6.126 10.926 6.180 687 HE3 LYS 77 3HE LYS 77 4.794 10.473 5.111 688 HZ1 LYS 77 3HZ LYS 77 4.199 12.786 4.920 689 HZ2 LYS 77 1HZ LYS 77 5.817 12.588 4.496 690 HZ3 LYS 77 2HZ LYS 77 5.412 13.242 5.998 691 H VAL 78 H VAL 78 1.108 8.476 4.263 692 HA VAL 78 HA VAL 78 1.198 5.519 4.050 693 HB VAL 78 HB VAL 78 -0.530 7.442 2.422 694 HG11 VAL 78 1HG1 VAL 78 -1.670 5.408 1.617 695 HG12 VAL 78 2HG1 VAL 78 -0.559 4.399 2.544 696 HG13 VAL 78 3HG1 VAL 78 0.041 5.366 1.193 697 HG21 VAL 78 3HG2 VAL 78 -1.320 5.616 4.715 698 HG22 VAL 78 1HG2 VAL 78 -2.431 6.574 3.730 699 HG23 VAL 78 2HG2 VAL 78 -1.253 7.380 4.770 700 H PHE 79 H PHE 79 2.761 4.748 2.803 701 HA PHE 79 HA PHE 79 3.539 6.222 0.347 702 HB2 PHE 79 2HB PHE 79 5.016 4.046 1.914 703 HB3 PHE 79 3HB PHE 79 5.554 4.716 0.382 704 HD1 PHE 79 HD2 PHE 79 4.940 5.582 3.967 705 HD2 PHE 79 HD1 PHE 79 6.831 6.750 0.310 706 HE1 PHE 79 HE2 PHE 79 6.200 7.323 5.168 707 HE2 PHE 79 HE1 PHE 79 8.086 8.485 1.524 708 HZ PHE 79 HZ PHE 79 7.772 8.772 3.947 709 H LEU 80 H LEU 80 2.357 5.450 -1.297 710 HA LEU 80 HA LEU 80 1.292 2.704 -1.226 711 HB2 LEU 80 2HB LEU 80 -0.482 4.298 -1.246 712 HB3 LEU 80 3HB LEU 80 0.272 5.250 -2.512 713 HG LEU 80 HG LEU 80 -0.252 3.498 -4.187 714 HD11 LEU 80 1HD1 LEU 80 -0.114 1.498 -2.789 715 HD12 LEU 80 2HD1 LEU 80 -1.633 1.559 -3.675 716 HD13 LEU 80 3HD1 LEU 80 -1.601 1.961 -1.956 717 HD21 LEU 80 3HD2 LEU 80 -2.675 4.270 -2.547 718 HD22 LEU 80 1HD2 LEU 80 -2.683 3.741 -4.233 719 HD23 LEU 80 2HD2 LEU 80 -1.896 5.255 -3.790 720 H LEU 81 H LEU 81 1.854 1.285 -2.735 721 HA LEU 81 HA LEU 81 3.234 2.205 -5.182 722 HB2 LEU 81 2HB LEU 81 4.650 0.830 -3.663 723 HB3 LEU 81 3HB LEU 81 3.486 -0.483 -3.773 724 HG LEU 81 HG LEU 81 3.951 -0.717 -6.201 725 HD11 LEU 81 1HD1 LEU 81 5.820 0.521 -7.238 726 HD12 LEU 81 2HD1 LEU 81 5.944 1.523 -5.791 727 HD13 LEU 81 3HD1 LEU 81 4.483 1.568 -6.777 728 HD21 LEU 81 3HD2 LEU 81 6.216 -1.623 -6.059 729 HD22 LEU 81 1HD2 LEU 81 5.279 -2.046 -4.626 730 HD23 LEU 81 2HD2 LEU 81 6.488 -0.761 -4.540 731 H LEU 82 H LEU 82 1.994 2.055 -6.913 732 HA LEU 82 HA LEU 82 -0.203 0.100 -7.078 733 HB2 LEU 82 2HB LEU 82 0.378 2.652 -8.630 734 HB3 LEU 82 3HB LEU 82 -0.931 1.551 -9.028 735 HG LEU 82 HG LEU 82 -0.693 3.162 -6.452 736 HD11 LEU 82 1HD1 LEU 82 -1.249 4.557 -8.398 737 HD12 LEU 82 2HD1 LEU 82 -2.615 4.427 -7.294 738 HD13 LEU 82 3HD1 LEU 82 -2.602 3.492 -8.792 739 HD21 LEU 82 3HD2 LEU 82 -1.801 1.036 -6.025 740 HD22 LEU 82 1HD2 LEU 82 -2.899 1.299 -7.383 741 HD23 LEU 82 2HD2 LEU 82 -2.968 2.354 -5.966 742 H GLN 83 H GLN 83 0.132 -1.655 -8.306 743 HA GLN 83 HA GLN 83 2.153 -1.635 -10.469 744 HB2 GLN 83 2HB GLN 83 2.627 -3.194 -8.523 745 HB3 GLN 83 3HB GLN 83 1.141 -4.058 -8.901 746 HG2 GLN 83 2HG GLN 83 2.025 -4.722 -11.070 747 HG3 GLN 83 3HG GLN 83 3.472 -3.739 -10.825 748 HE21 GLN 83 1HE2 GLN 83 3.312 -6.568 -11.376 749 HE22 GLN 83 2HE2 GLN 83 4.100 -7.365 -10.063 750 H ASP 84 H ASP 84 1.108 -1.396 -12.374 751 HA ASP 84 HA ASP 84 -1.136 -3.106 -13.079 752 HB2 ASP 84 2HB ASP 84 -2.100 -1.055 -11.854 753 HB3 ASP 84 3HB ASP 84 -1.523 -0.078 -13.197 754 H GLN 85 H GLN 85 -1.474 -3.218 -15.336 755 HA GLN 85 HA GLN 85 0.846 -2.587 -16.933 756 HB2 GLN 85 2HB GLN 85 -0.391 -3.866 -18.728 757 HB3 GLN 85 3HB GLN 85 -0.103 -4.763 -17.242 758 HG2 GLN 85 2HG GLN 85 -2.408 -4.467 -16.547 759 HG3 GLN 85 3HG GLN 85 -2.727 -3.406 -17.916 760 HE21 GLN 85 1HE2 GLN 85 -4.434 -4.722 -18.583 761 HE22 GLN 85 2HE2 GLN 85 -4.183 -6.261 -19.334 762 H ASP 86 H ASP 86 -2.510 -1.428 -16.779 763 HA ASP 86 HA ASP 86 -2.236 0.080 -19.274 764 HB2 ASP 86 2HB ASP 86 -4.577 -0.296 -17.352 765 HB3 ASP 86 3HB ASP 86 -4.650 0.748 -18.771 766 H GLU 87 H GLU 87 -0.833 1.740 -18.882 767 HA GLU 87 HA GLU 87 -0.764 3.210 -16.440 768 HB2 GLU 87 2HB GLU 87 0.585 3.784 -19.093 769 HB3 GLU 87 3HB GLU 87 0.885 4.682 -17.603 770 HG2 GLU 87 2HG GLU 87 1.623 2.512 -16.535 771 HG3 GLU 87 3HG GLU 87 1.497 1.752 -18.124 772 H ASN 88 H ASN 88 -2.636 3.632 -19.340 773 HA ASN 88 HA ASN 88 -3.304 6.383 -19.067 774 HB2 ASN 88 2HB ASN 88 -4.930 4.070 -20.224 775 HB3 ASN 88 3HB ASN 88 -5.429 5.759 -20.311 776 HD21 ASN 88 1HD2 ASN 88 -5.425 5.695 -22.542 777 HD22 ASN 88 2HD2 ASN 88 -3.968 5.688 -23.472 778 H GLU 89 H GLU 89 -4.746 3.412 -17.771 779 HA GLU 89 HA GLU 89 -6.780 4.744 -16.220 780 HB2 GLU 89 2HB GLU 89 -5.788 1.860 -16.071 781 HB3 GLU 89 3HB GLU 89 -7.265 2.480 -15.327 782 HG2 GLU 89 2HG GLU 89 -6.664 2.233 -18.286 783 HG3 GLU 89 3HG GLU 89 -7.810 1.270 -17.356 784 H LEU 90 H LEU 90 -3.566 3.445 -15.685 785 HA LEU 90 HA LEU 90 -3.606 3.331 -12.862 786 HB2 LEU 90 2HB LEU 90 -2.050 2.008 -14.228 787 HB3 LEU 90 3HB LEU 90 -1.275 3.470 -14.801 788 HG LEU 90 HG LEU 90 -0.346 3.926 -12.578 789 HD11 LEU 90 1HD1 LEU 90 -0.648 2.322 -10.729 790 HD12 LEU 90 2HD1 LEU 90 -1.874 1.476 -11.674 791 HD13 LEU 90 3HD1 LEU 90 -2.134 3.153 -11.168 792 HD21 LEU 90 3HD2 LEU 90 0.135 1.034 -13.387 793 HD22 LEU 90 1HD2 LEU 90 1.184 2.013 -12.353 794 HD23 LEU 90 2HD2 LEU 90 0.963 2.448 -14.048 795 H GLU 91 H GLU 91 -2.138 5.685 -15.123 796 HA GLU 91 HA GLU 91 -1.157 7.518 -13.246 797 HB2 GLU 91 2HB GLU 91 -0.602 7.452 -15.696 798 HB3 GLU 91 3HB GLU 91 -2.201 8.084 -16.053 799 HG2 GLU 91 2HG GLU 91 -0.710 9.915 -16.213 800 HG3 GLU 91 3HG GLU 91 -1.595 10.135 -14.699 801 H GLU 92 H GLU 92 -4.225 7.501 -15.061 802 HA GLU 92 HA GLU 92 -5.407 9.834 -14.189 803 HB2 GLU 92 2HB GLU 92 -6.103 7.719 -15.825 804 HB3 GLU 92 3HB GLU 92 -7.248 7.488 -14.519 805 HG2 GLU 92 2HG GLU 92 -6.912 9.939 -16.247 806 HG3 GLU 92 3HG GLU 92 -8.215 8.767 -16.328 807 H PHE 93 H PHE 93 -5.857 6.584 -12.825 808 HA PHE 93 HA PHE 93 -7.467 7.221 -10.602 809 HB2 PHE 93 2HB PHE 93 -7.323 4.955 -11.517 810 HB3 PHE 93 3HB PHE 93 -5.600 4.878 -11.184 811 HD1 PHE 93 HD1 PHE 93 -8.724 5.631 -9.213 812 HD2 PHE 93 HD2 PHE 93 -5.056 3.424 -9.431 813 HE1 PHE 93 HE1 PHE 93 -9.209 4.580 -7.053 814 HE2 PHE 93 HE2 PHE 93 -5.564 2.384 -7.259 815 HZ PHE 93 HZ PHE 93 -7.642 2.964 -6.070 816 H LYS 94 H LYS 94 -3.959 6.971 -10.981 817 HA LYS 94 HA LYS 94 -3.196 7.198 -8.277 818 HB2 LYS 94 2HB LYS 94 -1.787 6.260 -10.077 819 HB3 LYS 94 3HB LYS 94 -1.648 7.840 -10.823 820 HG2 LYS 94 2HG LYS 94 -0.677 7.447 -7.999 821 HG3 LYS 94 3HG LYS 94 0.297 6.830 -9.331 822 HD2 LYS 94 2HD LYS 94 -0.533 9.733 -8.914 823 HD3 LYS 94 3HD LYS 94 1.070 9.051 -8.613 824 HE2 LYS 94 2HE LYS 94 1.239 8.467 -11.030 825 HE3 LYS 94 3HE LYS 94 -0.322 9.246 -11.308 826 HZ1 LYS 94 3HZ LYS 94 1.509 10.709 -11.855 827 HZ2 LYS 94 1HZ LYS 94 2.132 10.568 -10.292 828 HZ3 LYS 94 2HZ LYS 94 0.650 11.336 -10.533 829 H ARG 95 H ARG 95 -4.019 9.633 -10.730 830 HA ARG 95 HA ARG 95 -2.832 11.907 -9.511 831 HB2 ARG 95 2HB ARG 95 -5.348 11.875 -11.235 832 HB3 ARG 95 3HB ARG 95 -4.339 13.278 -10.895 833 HG2 ARG 95 2HG ARG 95 -3.710 10.894 -12.639 834 HG3 ARG 95 3HG ARG 95 -3.836 12.586 -13.103 835 HD2 ARG 95 2HD ARG 95 -1.635 11.388 -11.380 836 HD3 ARG 95 3HD ARG 95 -1.509 11.795 -13.094 837 HE ARG 95 HE ARG 95 -2.227 13.941 -11.234 838 HH11 ARG 95 1HH1 ARG 95 0.279 12.491 -13.239 839 HH12 ARG 95 2HH1 ARG 95 1.276 13.904 -13.216 840 HH21 ARG 95 1HH2 ARG 95 -0.906 15.793 -11.233 841 HH22 ARG 95 2HH2 ARG 95 0.605 15.769 -12.083 842 H LYS 96 H LYS 96 -5.966 10.366 -9.103 843 HA LYS 96 HA LYS 96 -7.253 12.214 -7.417 844 HB2 LYS 96 2HB LYS 96 -7.561 9.263 -7.975 845 HB3 LYS 96 3HB LYS 96 -8.405 9.917 -6.587 846 HG2 LYS 96 2HG LYS 96 -9.881 9.830 -8.503 847 HG3 LYS 96 3HG LYS 96 -9.601 11.505 -8.013 848 HD2 LYS 96 2HD LYS 96 -7.977 11.773 -9.871 849 HD3 LYS 96 3HD LYS 96 -8.248 10.096 -10.358 850 HE2 LYS 96 2HE LYS 96 -10.583 10.607 -10.889 851 HE3 LYS 96 3HE LYS 96 -10.381 12.255 -10.296 852 HZ1 LYS 96 3HZ LYS 96 -8.944 11.092 -12.617 853 HZ2 LYS 96 1HZ LYS 96 -8.813 12.673 -12.056 854 HZ3 LYS 96 2HZ LYS 96 -10.267 12.131 -12.704 855 H ILE 97 H ILE 97 -5.181 9.455 -6.728 856 HA ILE 97 HA ILE 97 -5.372 9.580 -3.865 857 HB ILE 97 HB ILE 97 -3.244 8.119 -5.491 858 HG12 ILE 97 2HG1 ILE 97 -5.949 6.954 -4.674 859 HG13 ILE 97 3HG1 ILE 97 -5.648 7.635 -6.272 860 HG21 ILE 97 1HG2 ILE 97 -4.442 7.565 -2.750 861 HG22 ILE 97 2HG2 ILE 97 -2.833 8.215 -3.065 862 HG23 ILE 97 3HG2 ILE 97 -3.229 6.570 -3.556 863 HD11 ILE 97 3HD1 ILE 97 -5.452 5.237 -6.302 864 HD12 ILE 97 1HD1 ILE 97 -4.207 5.286 -5.057 865 HD13 ILE 97 2HD1 ILE 97 -3.894 5.983 -6.651 866 H GLU 98 H GLU 98 -3.258 10.843 -6.290 867 HA GLU 98 HA GLU 98 -1.040 11.669 -4.705 868 HB2 GLU 98 2HB GLU 98 -0.985 11.265 -7.180 869 HB3 GLU 98 3HB GLU 98 -2.005 12.680 -7.422 870 HG2 GLU 98 2HG GLU 98 -0.214 14.105 -6.461 871 HG3 GLU 98 3HG GLU 98 0.800 12.674 -6.269 872 H SER 99 H SER 99 -4.100 13.132 -5.706 873 HA SER 99 HA SER 99 -3.614 15.751 -4.660 874 HB2 SER 99 2HB SER 99 -5.252 15.241 -6.497 875 HB3 SER 99 3HB SER 99 -6.280 14.426 -5.319 876 HG SER 99 HG SER 99 -5.758 16.784 -4.286 877 H GLN 100 H GLN 100 -4.680 12.712 -3.276 878 HA GLN 100 HA GLN 100 -5.778 13.752 -0.836 879 HB2 GLN 100 2HB GLN 100 -4.493 11.030 -1.328 880 HB3 GLN 100 3HB GLN 100 -5.524 11.452 0.033 881 HG2 GLN 100 2HG GLN 100 -6.440 11.400 -2.857 882 HG3 GLN 100 3HG GLN 100 -6.613 10.060 -1.730 883 HE21 GLN 100 1HE2 GLN 100 -8.848 10.048 -1.935 884 HE22 GLN 100 2HE2 GLN 100 -9.855 11.262 -1.225 885 H GLY 101 H GLY 101 -2.603 13.618 -2.083 886 HA2 GLY 101 2HA GLY 101 -0.661 14.516 -1.216 887 HA3 GLY 101 3HA GLY 101 -1.453 14.708 0.345 888 H TYR 102 H TYR 102 -0.735 11.940 -1.773 889 HA TYR 102 HA TYR 102 0.772 10.650 0.437 890 HB2 TYR 102 2HB TYR 102 -1.237 9.314 -1.437 891 HB3 TYR 102 3HB TYR 102 -0.157 8.429 -0.363 892 HD1 TYR 102 HD1 TYR 102 -0.339 10.114 2.115 893 HD2 TYR 102 HD2 TYR 102 -3.404 8.784 -0.556 894 HE1 TYR 102 HE1 TYR 102 -1.971 10.231 3.934 895 HE2 TYR 102 HE2 TYR 102 -5.043 8.909 1.282 896 HH TYR 102 HH TYR 102 -4.347 10.481 4.236 897 H GLU 103 H GLU 103 2.596 9.503 -0.158 898 HA GLU 103 HA GLU 103 3.805 10.067 -2.713 899 HB2 GLU 103 2HB GLU 103 5.238 10.007 -0.751 900 HB3 GLU 103 3HB GLU 103 4.701 8.391 -0.326 901 HG2 GLU 103 2HG GLU 103 6.980 8.376 -1.254 902 HG3 GLU 103 3HG GLU 103 5.864 7.449 -2.260 903 H VAL 104 H VAL 104 2.643 9.064 -4.329 904 HA VAL 104 HA VAL 104 2.152 6.148 -4.138 905 HB VAL 104 HB VAL 104 0.723 8.133 -5.969 906 HG11 VAL 104 1HG1 VAL 104 0.066 5.282 -5.158 907 HG12 VAL 104 2HG1 VAL 104 0.678 5.799 -6.728 908 HG13 VAL 104 3HG1 VAL 104 -0.928 6.303 -6.200 909 HG21 VAL 104 3HG2 VAL 104 -1.167 8.084 -4.400 910 HG22 VAL 104 1HG2 VAL 104 0.271 8.727 -3.607 911 HG23 VAL 104 2HG2 VAL 104 -0.247 7.068 -3.287 912 H ARG 105 H ARG 105 3.752 5.105 -5.215 913 HA ARG 105 HA ARG 105 4.873 6.271 -7.684 914 HB2 ARG 105 2HB ARG 105 6.129 5.041 -5.458 915 HB3 ARG 105 3HB ARG 105 6.213 3.815 -6.707 916 HG2 ARG 105 2HG ARG 105 8.232 5.127 -6.758 917 HG3 ARG 105 3HG ARG 105 7.295 5.490 -8.214 918 HD2 ARG 105 2HD ARG 105 6.466 7.572 -7.178 919 HD3 ARG 105 3HD ARG 105 7.351 7.197 -5.695 920 HE ARG 105 HE ARG 105 9.116 7.279 -7.907 921 HH11 ARG 105 1HH1 ARG 105 7.267 9.444 -5.834 922 HH12 ARG 105 2HH1 ARG 105 8.344 10.778 -6.069 923 HH21 ARG 105 1HH2 ARG 105 10.531 9.055 -8.191 924 HH22 ARG 105 2HH2 ARG 105 10.187 10.557 -7.402 925 H LYS 106 H LYS 106 4.976 5.009 -9.564 926 HA LYS 106 HA LYS 106 3.035 2.801 -9.819 927 HB2 LYS 106 2HB LYS 106 4.517 4.500 -11.873 928 HB3 LYS 106 3HB LYS 106 3.350 3.245 -12.279 929 HG2 LYS 106 2HG LYS 106 1.516 4.515 -11.420 930 HG3 LYS 106 3HG LYS 106 2.586 5.622 -10.550 931 HD2 LYS 106 2HD LYS 106 1.635 6.679 -12.587 932 HD3 LYS 106 3HD LYS 106 3.393 6.578 -12.646 933 HE2 LYS 106 2HE LYS 106 3.095 4.475 -14.079 934 HE3 LYS 106 3HE LYS 106 1.382 4.891 -14.162 935 HZ1 LYS 106 3HZ LYS 106 3.610 6.646 -15.071 936 HZ2 LYS 106 1HZ LYS 106 1.963 6.991 -15.192 937 HZ3 LYS 106 2HZ LYS 106 2.621 5.721 -16.082 938 H VAL 107 H VAL 107 3.697 0.831 -10.878 939 HA VAL 107 HA VAL 107 6.485 0.362 -11.563 940 HB VAL 107 HB VAL 107 6.491 -0.069 -9.123 941 HG11 VAL 107 1HG1 VAL 107 5.246 -1.921 -8.111 942 HG12 VAL 107 2HG1 VAL 107 4.421 -2.221 -9.643 943 HG13 VAL 107 3HG1 VAL 107 4.152 -0.706 -8.779 944 HG21 VAL 107 3HG2 VAL 107 7.493 -2.299 -9.132 945 HG22 VAL 107 1HG2 VAL 107 7.998 -1.381 -10.546 946 HG23 VAL 107 2HG2 VAL 107 6.776 -2.641 -10.708 947 H THR 108 H THR 108 6.791 -1.538 -12.806 948 HA THR 108 HA THR 108 4.326 -2.858 -13.801 949 HB THR 108 HB THR 108 5.670 -3.177 -15.962 950 HG1 THR 108 HG1 THR 108 7.742 -2.748 -15.283 951 HG21 THR 108 3HG2 THR 108 3.892 -1.450 -15.822 952 HG22 THR 108 1HG2 THR 108 5.242 -0.901 -16.824 953 HG23 THR 108 2HG2 THR 108 5.062 -0.295 -15.177 954 H ASP 109 H ASP 109 7.767 -3.317 -12.942 955 HA ASP 109 HA ASP 109 7.625 -6.191 -13.571 956 HB2 ASP 109 2HB ASP 109 10.009 -4.469 -12.779 957 HB3 ASP 109 3HB ASP 109 10.087 -6.145 -13.316 958 H ASP 110 H ASP 110 8.440 -7.780 -12.088 959 HA ASP 110 HA ASP 110 7.203 -7.583 -9.535 960 HB2 ASP 110 2HB ASP 110 7.825 -9.908 -9.206 961 HB3 ASP 110 3HB ASP 110 7.273 -9.700 -10.860 962 H GLU 111 H GLU 111 10.633 -7.686 -10.540 963 HA GLU 111 HA GLU 111 11.673 -7.804 -7.859 964 HB2 GLU 111 2HB GLU 111 13.070 -7.080 -10.474 965 HB3 GLU 111 3HB GLU 111 13.890 -7.393 -8.944 966 HG2 GLU 111 2HG GLU 111 13.165 -9.713 -8.970 967 HG3 GLU 111 3HG GLU 111 12.167 -9.426 -10.398 968 H GLU 112 H GLU 112 11.069 -5.300 -10.245 969 HA GLU 112 HA GLU 112 12.177 -3.064 -8.966 970 HB2 GLU 112 2HB GLU 112 11.563 -3.178 -11.349 971 HB3 GLU 112 3HB GLU 112 9.858 -3.289 -10.929 972 HG2 GLU 112 2HG GLU 112 9.938 -1.013 -9.992 973 HG3 GLU 112 3HG GLU 112 11.659 -0.910 -10.374 974 H ALA 113 H ALA 113 8.979 -4.611 -8.710 975 HA ALA 113 HA ALA 113 7.713 -2.689 -7.075 976 HB1 ALA 113 3HB ALA 113 7.256 -5.687 -7.172 977 HB2 ALA 113 1HB ALA 113 6.479 -4.479 -8.200 978 HB3 ALA 113 2HB ALA 113 6.159 -4.495 -6.463 979 H LEU 114 H LEU 114 9.658 -5.561 -6.276 980 HA LEU 114 HA LEU 114 9.505 -5.468 -3.465 981 HB2 LEU 114 2HB LEU 114 11.855 -6.426 -5.154 982 HB3 LEU 114 3HB LEU 114 11.541 -6.865 -3.478 983 HG LEU 114 HG LEU 114 9.831 -7.646 -5.875 984 HD11 LEU 114 1HD1 LEU 114 11.960 -8.838 -5.827 985 HD12 LEU 114 2HD1 LEU 114 10.622 -9.922 -5.454 986 HD13 LEU 114 3HD1 LEU 114 11.667 -9.334 -4.157 987 HD21 LEU 114 3HD2 LEU 114 9.520 -8.442 -2.967 988 HD22 LEU 114 1HD2 LEU 114 8.570 -9.052 -4.325 989 HD23 LEU 114 2HD2 LEU 114 8.457 -7.356 -3.866 990 H LYS 115 H LYS 115 11.517 -3.745 -5.772 991 HA LYS 115 HA LYS 115 13.384 -2.630 -3.926 992 HB2 LYS 115 2HB LYS 115 12.632 -1.791 -6.757 993 HB3 LYS 115 3HB LYS 115 13.957 -1.069 -5.843 994 HG2 LYS 115 2HG LYS 115 13.746 -3.986 -6.636 995 HG3 LYS 115 3HG LYS 115 14.725 -2.775 -7.458 996 HD2 LYS 115 2HD LYS 115 15.123 -3.527 -4.532 997 HD3 LYS 115 3HD LYS 115 15.953 -4.329 -5.865 998 HE2 LYS 115 2HE LYS 115 17.457 -2.692 -5.009 999 HE3 LYS 115 3HE LYS 115 16.871 -2.082 -6.551 1000 HZ1 LYS 115 3HZ LYS 115 16.993 -0.385 -4.809 1001 HZ2 LYS 115 1HZ LYS 115 15.850 -1.212 -3.890 1002 HZ3 LYS 115 2HZ LYS 115 15.424 -0.563 -5.395 1003 H ILE 116 H ILE 116 10.488 -1.213 -5.563 1004 HA ILE 116 HA ILE 116 10.838 1.351 -4.423 1005 HB ILE 116 HB ILE 116 8.208 0.179 -5.435 1006 HG12 ILE 116 2HG1 ILE 116 9.951 -0.008 -7.186 1007 HG13 ILE 116 3HG1 ILE 116 8.767 1.209 -7.632 1008 HG21 ILE 116 1HG2 ILE 116 9.099 3.074 -5.131 1009 HG22 ILE 116 2HG2 ILE 116 7.888 2.246 -4.150 1010 HG23 ILE 116 3HG2 ILE 116 7.583 2.538 -5.861 1011 HD11 ILE 116 3HD1 ILE 116 11.011 1.902 -8.209 1012 HD12 ILE 116 1HD1 ILE 116 11.536 1.737 -6.536 1013 HD13 ILE 116 2HD1 ILE 116 10.351 2.974 -6.975 1014 H VAL 117 H VAL 117 9.083 -1.509 -3.257 1015 HA VAL 117 HA VAL 117 7.813 -0.362 -1.000 1016 HB VAL 117 HB VAL 117 8.815 -3.229 -1.351 1017 HG11 VAL 117 1HG1 VAL 117 6.785 -2.135 0.639 1018 HG12 VAL 117 2HG1 VAL 117 8.397 -2.743 1.026 1019 HG13 VAL 117 3HG1 VAL 117 7.171 -3.844 0.398 1020 HG21 VAL 117 3HG2 VAL 117 6.052 -2.065 -1.860 1021 HG22 VAL 117 1HG2 VAL 117 6.500 -3.769 -2.002 1022 HG23 VAL 117 2HG2 VAL 117 7.201 -2.576 -3.096 1023 H ARG 118 H ARG 118 11.066 -1.865 -1.370 1024 HA ARG 118 HA ARG 118 11.725 -1.622 1.402 1025 HB2 ARG 118 2HB ARG 118 13.889 -2.456 0.907 1026 HB3 ARG 118 3HB ARG 118 12.799 -3.290 -0.193 1027 HG2 ARG 118 2HG ARG 118 13.515 -1.941 -2.046 1028 HG3 ARG 118 3HG ARG 118 14.442 -0.875 -0.994 1029 HD2 ARG 118 2HD ARG 118 15.031 -3.782 -1.605 1030 HD3 ARG 118 3HD ARG 118 15.935 -2.378 -2.172 1031 HE ARG 118 HE ARG 118 16.214 -3.706 0.335 1032 HH11 ARG 118 1HH1 ARG 118 16.496 -0.489 -1.118 1033 HH12 ARG 118 2HH1 ARG 118 17.605 0.077 0.089 1034 HH21 ARG 118 1HH2 ARG 118 17.618 -2.919 1.919 1035 HH22 ARG 118 2HH2 ARG 118 18.241 -1.311 1.807 1036 H GLU 119 H GLU 119 12.098 0.503 -1.388 1037 HA GLU 119 HA GLU 119 13.850 2.380 -0.147 1038 HB2 GLU 119 2HB GLU 119 11.856 2.912 -2.396 1039 HB3 GLU 119 3HB GLU 119 13.205 3.946 -1.936 1040 HG2 GLU 119 2HG GLU 119 13.287 1.258 -3.307 1041 HG3 GLU 119 3HG GLU 119 13.858 2.803 -3.916 1042 H PHE 120 H PHE 120 10.309 2.175 -0.544 1043 HA PHE 120 HA PHE 120 9.436 4.433 0.790 1044 HB2 PHE 120 2HB PHE 120 8.212 1.679 0.461 1045 HB3 PHE 120 3HB PHE 120 7.372 2.914 1.391 1046 HD1 PHE 120 HD2 PHE 120 8.660 5.066 -0.830 1047 HD2 PHE 120 HD1 PHE 120 6.067 1.649 -0.864 1048 HE1 PHE 120 HE2 PHE 120 7.522 5.934 -2.829 1049 HE2 PHE 120 HE1 PHE 120 4.945 2.539 -2.852 1050 HZ PHE 120 HZ PHE 120 5.656 4.674 -3.824 1051 H MET 121 H MET 121 10.207 1.262 2.158 1052 HA MET 121 HA MET 121 9.483 1.907 4.839 1053 HB2 MET 121 2HB MET 121 11.187 -0.361 3.748 1054 HB3 MET 121 3HB MET 121 10.657 -0.240 5.421 1055 HG2 MET 121 2HG MET 121 8.293 -0.321 4.647 1056 HG3 MET 121 3HG MET 121 8.868 -0.549 2.993 1057 HE1 MET 121 3HE MET 121 10.314 -2.691 2.226 1058 HE2 MET 121 1HE MET 121 10.717 -4.020 3.311 1059 HE3 MET 121 2HE MET 121 11.458 -2.437 3.548 1060 H GLN 122 H GLN 122 12.488 2.248 3.031 1061 HA GLN 122 HA GLN 122 14.126 2.862 5.315 1062 HB2 GLN 122 2HB GLN 122 15.085 1.984 3.205 1063 HB3 GLN 122 3HB GLN 122 14.576 3.439 2.360 1064 HG2 GLN 122 2HG GLN 122 16.991 3.457 2.871 1065 HG3 GLN 122 3HG GLN 122 16.145 4.796 3.635 1066 HE21 GLN 122 1HE2 GLN 122 16.021 4.874 5.889 1067 HE22 GLN 122 2HE2 GLN 122 16.973 3.861 6.912 1068 H LYS 123 H LYS 123 12.293 4.781 2.930 1069 HA LYS 123 HA LYS 123 12.917 7.393 3.801 1070 HB2 LYS 123 2HB LYS 123 10.295 6.327 2.632 1071 HB3 LYS 123 3HB LYS 123 10.673 8.037 2.821 1072 HG2 LYS 123 2HG LYS 123 12.467 7.863 1.176 1073 HG3 LYS 123 3HG LYS 123 12.222 6.117 1.054 1074 HD2 LYS 123 2HD LYS 123 9.942 6.488 0.157 1075 HD3 LYS 123 3HD LYS 123 10.157 8.234 0.306 1076 HE2 LYS 123 2HE LYS 123 11.818 6.424 -1.483 1077 HE3 LYS 123 3HE LYS 123 10.462 7.419 -2.021 1078 HZ1 LYS 123 3HZ LYS 123 12.527 8.545 -2.456 1079 HZ2 LYS 123 1HZ LYS 123 13.005 8.406 -0.840 1080 HZ3 LYS 123 2HZ LYS 123 11.694 9.384 -1.253 1081 H ALA 124 H ALA 124 10.315 5.182 4.636 1082 HA ALA 124 HA ALA 124 8.919 6.614 6.558 1083 HB1 ALA 124 3HB ALA 124 8.047 4.600 5.451 1084 HB2 ALA 124 1HB ALA 124 7.976 4.425 7.210 1085 HB3 ALA 124 2HB ALA 124 9.239 3.603 6.287 1086 H GLY 125 H GLY 125 11.594 4.317 6.871 1087 HA2 GLY 125 2HA GLY 125 11.656 4.082 9.681 1088 HA3 GLY 125 3HA GLY 125 12.973 3.700 8.589 1089 H SER 126 H SER 126 12.945 6.526 7.541 1090 HA SER 126 HA SER 126 14.785 7.677 9.451 1091 HB2 SER 126 2HB SER 126 13.649 8.874 6.885 1092 HB3 SER 126 3HB SER 126 15.075 9.438 7.764 1093 HG SER 126 HG SER 126 15.207 6.781 7.162 1094 H LEU 127 H LEU 127 11.453 8.178 8.431 1095 HA LEU 127 HA LEU 127 11.147 10.801 9.587 1096 HB2 LEU 127 2HB LEU 127 9.047 8.886 8.485 1097 HB3 LEU 127 3HB LEU 127 8.797 10.594 8.830 1098 HG LEU 127 HG LEU 127 10.665 9.477 6.702 1099 HD11 LEU 127 1HD1 LEU 127 9.089 10.419 5.084 1100 HD12 LEU 127 2HD1 LEU 127 8.005 10.881 6.401 1101 HD13 LEU 127 3HD1 LEU 127 8.342 9.176 6.084 1102 HD21 LEU 127 3HD2 LEU 127 11.566 11.552 7.594 1103 HD22 LEU 127 1HD2 LEU 127 10.015 12.364 7.359 1104 HD23 LEU 127 2HD2 LEU 127 10.948 11.809 5.965 1105 H GLU 128 H GLU 128 9.984 7.535 10.410 1106 HA GLU 128 HA GLU 128 8.238 7.911 12.498 1107 HB2 GLU 128 2HB GLU 128 10.375 5.753 12.222 1108 HB3 GLU 128 3HB GLU 128 9.010 5.653 13.330 1109 HG2 GLU 128 2HG GLU 128 7.456 5.378 11.595 1110 HG3 GLU 128 3HG GLU 128 8.562 6.004 10.372 1111 H HIS 129 H HIS 129 11.723 7.382 12.829 1112 HA HIS 129 HA HIS 129 11.753 7.841 15.665 1113 HB2 HIS 129 2HB HIS 129 14.126 7.651 13.757 1114 HB3 HIS 129 3HB HIS 129 14.139 7.399 15.500 1115 HD1 HIS 129 HD1 HIS 129 14.087 5.544 12.457 1116 HD2 HIS 129 HD2 HIS 129 12.335 5.053 16.185 1117 HE1 HIS 129 HE1 HIS 129 13.400 3.135 12.571 1118 HE2 HIS 129 HE2 HIS 129 12.158 2.938 14.735 1119 H HIS 130 H HIS 130 11.056 9.883 16.089 1120 HA HIS 130 HA HIS 130 11.987 12.196 14.575 1121 HB2 HIS 130 2HB HIS 130 9.532 11.675 15.462 1122 HB3 HIS 130 3HB HIS 130 10.114 12.396 16.953 1123 HD1 HIS 130 HD1 HIS 130 7.861 13.569 15.082 1124 HD2 HIS 130 HD2 HIS 130 11.816 14.838 15.172 1125 HE1 HIS 130 HE1 HIS 130 7.847 15.887 14.131 1126 HE2 HIS 130 HE2 HIS 130 10.265 16.577 14.073 1127 H HIS 131 H HIS 131 14.129 12.305 15.159 1128 HA HIS 131 HA HIS 131 15.972 13.001 16.199 1129 HB2 HIS 131 2HB HIS 131 14.061 14.469 18.056 1130 HB3 HIS 131 3HB HIS 131 15.795 14.759 17.971 1131 HD1 HIS 131 HD1 HIS 131 13.179 16.682 17.169 1132 HD2 HIS 131 HD2 HIS 131 16.071 15.021 14.682 1133 HE1 HIS 131 HE1 HIS 131 13.232 18.135 15.120 1134 HE2 HIS 131 HE2 HIS 131 15.109 17.212 13.729 1135 H HIS 132 H HIS 132 14.181 12.888 19.281 1136 HA HIS 132 HA HIS 132 15.964 10.687 20.172 1137 HB2 HIS 132 2HB HIS 132 14.603 12.890 21.779 1138 HB3 HIS 132 3HB HIS 132 15.383 11.501 22.527 1139 HD1 HIS 132 HD1 HIS 132 17.915 11.515 22.706 1140 HD2 HIS 132 HD2 HIS 132 16.431 14.741 20.539 1141 HE1 HIS 132 HE1 HIS 132 19.863 13.068 22.383 1142 HE2 HIS 132 HE2 HIS 132 18.913 15.060 21.176 1143 H HIS 133 H HIS 133 12.655 11.592 19.646 1144 HA HIS 133 HA HIS 133 11.446 9.428 21.111 1145 HB2 HIS 133 2HB HIS 133 10.408 11.155 18.819 1146 HB3 HIS 133 3HB HIS 133 9.425 9.962 19.659 1147 HD1 HIS 133 HD1 HIS 133 8.829 10.483 22.167 1148 HD2 HIS 133 HD2 HIS 133 10.657 13.591 20.110 1149 HE1 HIS 133 HE1 HIS 133 8.420 12.536 23.547 1150 HE2 HIS 133 HE2 HIS 133 9.736 14.340 22.392 1151 H HIS 134 H HIS 134 11.705 7.342 20.548 1152 HA HIS 134 HA HIS 134 12.759 6.600 17.930 1153 HB2 HIS 134 2HB HIS 134 12.262 4.936 20.441 1154 HB3 HIS 134 3HB HIS 134 13.049 4.344 18.978 1155 HD1 HIS 134 HD1 HIS 134 13.648 6.424 22.018 1156 HD2 HIS 134 HD2 HIS 134 15.691 5.330 18.568 1157 HE1 HIS 134 HE1 HIS 134 16.046 7.057 22.421 1158 HE2 HIS 134 HE2 HIS 134 17.236 6.469 20.285 Start of MODEL 7 1 H1 MET 1 1H MET 1 3.015 9.079 13.529 2 H2 MET 1 2H MET 1 1.767 10.042 14.135 3 H3 MET 1 3H MET 1 1.465 8.965 12.871 4 HA MET 1 HA MET 1 2.298 8.212 15.598 5 HB2 MET 1 2HB MET 1 -0.055 9.166 15.400 6 HB3 MET 1 3HB MET 1 -0.447 7.810 14.347 7 HG2 MET 1 2HG MET 1 -1.222 7.370 16.606 8 HG3 MET 1 3HG MET 1 0.084 6.251 16.197 9 HE1 MET 1 3HE MET 1 0.552 7.004 20.096 10 HE2 MET 1 1HE MET 1 0.296 5.725 18.910 11 HE3 MET 1 2HE MET 1 -0.978 6.904 19.225 12 H LYS 2 H LYS 2 0.829 7.059 12.537 13 HA LYS 2 HA LYS 2 2.597 4.683 12.672 14 HB2 LYS 2 2HB LYS 2 -0.248 4.696 11.569 15 HB3 LYS 2 3HB LYS 2 0.859 3.329 11.560 16 HG2 LYS 2 2HG LYS 2 0.811 3.318 14.052 17 HG3 LYS 2 3HG LYS 2 -0.381 4.622 13.996 18 HD2 LYS 2 2HD LYS 2 -1.846 3.085 12.592 19 HD3 LYS 2 3HD LYS 2 -0.698 1.786 12.951 20 HE2 LYS 2 2HE LYS 2 -2.580 1.691 14.488 21 HE3 LYS 2 3HE LYS 2 -1.112 2.117 15.370 22 HZ1 LYS 2 3HZ LYS 2 -2.988 3.463 16.054 23 HZ2 LYS 2 1HZ LYS 2 -3.211 4.020 14.483 24 HZ3 LYS 2 2HZ LYS 2 -1.813 4.427 15.336 25 H ILE 3 H ILE 3 3.538 4.086 10.776 26 HA ILE 3 HA ILE 3 2.820 5.514 8.299 27 HB ILE 3 HB ILE 3 5.485 4.165 8.948 28 HG12 ILE 3 2HG1 ILE 3 4.739 7.124 8.742 29 HG13 ILE 3 3HG1 ILE 3 5.293 6.282 10.181 30 HG21 ILE 3 1HG2 ILE 3 4.593 5.688 6.466 31 HG22 ILE 3 2HG2 ILE 3 4.919 3.954 6.564 32 HG23 ILE 3 3HG2 ILE 3 6.231 5.114 6.765 33 HD11 ILE 3 3HD1 ILE 3 7.492 5.975 9.133 34 HD12 ILE 3 1HD1 ILE 3 7.037 7.669 9.290 35 HD13 ILE 3 2HD1 ILE 3 6.932 6.874 7.720 36 H LEU 4 H LEU 4 1.484 4.273 7.190 37 HA LEU 4 HA LEU 4 1.692 1.328 7.266 38 HB2 LEU 4 2HB LEU 4 -0.641 3.037 6.289 39 HB3 LEU 4 3HB LEU 4 -0.648 1.305 6.579 40 HG LEU 4 HG LEU 4 -0.412 3.446 8.734 41 HD11 LEU 4 1HD1 LEU 4 -2.774 1.675 8.039 42 HD12 LEU 4 2HD1 LEU 4 -2.650 3.415 7.771 43 HD13 LEU 4 3HD1 LEU 4 -2.679 2.781 9.414 44 HD21 LEU 4 3HD2 LEU 4 0.791 1.445 9.421 45 HD22 LEU 4 1HD2 LEU 4 -0.608 0.434 9.046 46 HD23 LEU 4 2HD2 LEU 4 -0.689 1.610 10.361 47 H ILE 5 H ILE 5 2.572 0.401 5.471 48 HA ILE 5 HA ILE 5 2.909 1.966 3.007 49 HB ILE 5 HB ILE 5 3.879 -0.875 3.603 50 HG12 ILE 5 2HG1 ILE 5 4.885 0.715 5.233 51 HG13 ILE 5 3HG1 ILE 5 6.096 0.073 4.134 52 HG21 ILE 5 1HG2 ILE 5 5.459 -0.493 1.731 53 HG22 ILE 5 2HG2 ILE 5 4.723 1.082 1.432 54 HG23 ILE 5 3HG2 ILE 5 3.777 -0.390 1.205 55 HD11 ILE 5 3HD1 ILE 5 6.466 2.421 4.572 56 HD12 ILE 5 1HD1 ILE 5 4.843 2.818 4.005 57 HD13 ILE 5 2HD1 ILE 5 6.046 2.189 2.876 58 H LEU 6 H LEU 6 1.209 1.912 1.585 59 HA LEU 6 HA LEU 6 -0.650 -0.386 1.560 60 HB2 LEU 6 2HB LEU 6 -1.226 2.264 1.554 61 HB3 LEU 6 3HB LEU 6 -1.048 2.068 -0.170 62 HG LEU 6 HG LEU 6 -3.375 1.907 0.243 63 HD11 LEU 6 1HD1 LEU 6 -4.095 -0.346 -0.351 64 HD12 LEU 6 2HD1 LEU 6 -2.496 -0.984 0.044 65 HD13 LEU 6 3HD1 LEU 6 -2.689 0.147 -1.296 66 HD21 LEU 6 3HD2 LEU 6 -2.804 0.014 2.530 67 HD22 LEU 6 1HD2 LEU 6 -4.408 0.503 1.973 68 HD23 LEU 6 2HD2 LEU 6 -3.309 1.700 2.647 69 H ILE 7 H ILE 7 -0.620 -1.822 -0.156 70 HA ILE 7 HA ILE 7 0.691 -1.080 -2.694 71 HB ILE 7 HB ILE 7 1.244 -3.689 -1.175 72 HG12 ILE 7 2HG1 ILE 7 3.191 -1.439 -1.895 73 HG13 ILE 7 3HG1 ILE 7 2.483 -1.674 -0.305 74 HG21 ILE 7 1HG2 ILE 7 2.767 -4.283 -3.035 75 HG22 ILE 7 2HG2 ILE 7 2.280 -2.833 -3.910 76 HG23 ILE 7 3HG2 ILE 7 1.104 -4.112 -3.602 77 HD11 ILE 7 3HD1 ILE 7 3.619 -3.814 -0.112 78 HD12 ILE 7 1HD1 ILE 7 4.734 -2.475 -0.368 79 HD13 ILE 7 2HD1 ILE 7 4.354 -3.566 -1.700 80 H ASN 8 H ASN 8 -0.663 -1.498 -4.340 81 HA ASN 8 HA ASN 8 -2.511 -3.812 -4.192 82 HB2 ASN 8 2HB ASN 8 -3.794 -1.716 -4.333 83 HB3 ASN 8 3HB ASN 8 -2.873 -1.214 -5.743 84 HD21 ASN 8 1HD2 ASN 8 -5.497 -3.173 -4.605 85 HD22 ASN 8 2HD2 ASN 8 -6.031 -3.732 -6.147 86 H THR 9 H THR 9 -1.501 -5.363 -5.252 87 HA THR 9 HA THR 9 -0.856 -4.913 -8.098 88 HB THR 9 HB THR 9 1.279 -5.388 -7.121 89 HG1 THR 9 HG1 THR 9 1.797 -7.024 -8.396 90 HG21 THR 9 3HG2 THR 9 0.070 -7.774 -5.678 91 HG22 THR 9 1HG2 THR 9 0.557 -6.255 -4.922 92 HG23 THR 9 2HG2 THR 9 1.768 -7.301 -5.661 93 H ASN 10 H ASN 10 -1.832 -6.358 -9.497 94 HA ASN 10 HA ASN 10 -3.915 -8.124 -8.452 95 HB2 ASN 10 2HB ASN 10 -3.156 -7.376 -11.308 96 HB3 ASN 10 3HB ASN 10 -4.558 -8.350 -10.854 97 HD21 ASN 10 1HD2 ASN 10 -6.354 -7.296 -9.894 98 HD22 ASN 10 2HD2 ASN 10 -6.522 -5.578 -9.917 99 H ASN 11 H ASN 11 -0.673 -8.345 -9.118 100 HA ASN 11 HA ASN 11 -0.653 -11.183 -9.894 101 HB2 ASN 11 2HB ASN 11 1.590 -9.132 -9.559 102 HB3 ASN 11 3HB ASN 11 1.890 -10.849 -9.833 103 HD21 ASN 11 1HD2 ASN 11 3.000 -10.327 -11.772 104 HD22 ASN 11 2HD2 ASN 11 2.137 -9.898 -13.210 105 H ASP 12 H ASP 12 -1.083 -12.453 -8.206 106 HA ASP 12 HA ASP 12 -0.552 -11.990 -5.477 107 HB2 ASP 12 2HB ASP 12 -0.969 -14.633 -6.927 108 HB3 ASP 12 3HB ASP 12 -1.076 -14.401 -5.181 109 H GLU 13 H GLU 13 1.464 -13.109 -8.021 110 HA GLU 13 HA GLU 13 3.588 -14.336 -6.712 111 HB2 GLU 13 2HB GLU 13 3.678 -12.396 -9.075 112 HB3 GLU 13 3HB GLU 13 4.979 -13.490 -8.612 113 HG2 GLU 13 2HG GLU 13 3.471 -15.429 -9.052 114 HG3 GLU 13 3HG GLU 13 2.227 -14.304 -9.583 115 H LEU 14 H LEU 14 3.114 -10.846 -7.443 116 HA LEU 14 HA LEU 14 5.355 -9.941 -5.954 117 HB2 LEU 14 2HB LEU 14 2.927 -8.490 -7.062 118 HB3 LEU 14 3HB LEU 14 4.076 -7.651 -6.033 119 HG LEU 14 HG LEU 14 4.612 -7.160 -8.329 120 HD11 LEU 14 1HD1 LEU 14 6.668 -9.094 -7.219 121 HD12 LEU 14 2HD1 LEU 14 6.510 -7.383 -6.809 122 HD13 LEU 14 3HD1 LEU 14 6.946 -7.855 -8.448 123 HD21 LEU 14 3HD2 LEU 14 3.550 -9.058 -9.426 124 HD22 LEU 14 1HD2 LEU 14 4.801 -10.148 -8.824 125 HD23 LEU 14 2HD2 LEU 14 5.207 -8.877 -9.980 126 H ILE 15 H ILE 15 1.949 -10.416 -5.084 127 HA ILE 15 HA ILE 15 1.843 -9.066 -2.649 128 HB ILE 15 HB ILE 15 0.425 -11.643 -3.472 129 HG12 ILE 15 2HG1 ILE 15 -0.500 -8.729 -3.450 130 HG13 ILE 15 3HG1 ILE 15 -0.136 -9.693 -4.873 131 HG21 ILE 15 1HG2 ILE 15 -0.207 -9.896 -1.061 132 HG22 ILE 15 2HG2 ILE 15 0.436 -11.538 -1.016 133 HG23 ILE 15 3HG2 ILE 15 -1.188 -11.249 -1.634 134 HD11 ILE 15 3HD1 ILE 15 -2.509 -9.458 -4.612 135 HD12 ILE 15 1HD1 ILE 15 -2.441 -10.115 -2.976 136 HD13 ILE 15 2HD1 ILE 15 -2.060 -11.144 -4.358 137 H LYS 16 H LYS 16 2.713 -12.532 -3.149 138 HA LYS 16 HA LYS 16 3.350 -12.966 -0.394 139 HB2 LYS 16 2HB LYS 16 4.064 -15.197 -1.038 140 HB3 LYS 16 3HB LYS 16 2.577 -14.793 -1.886 141 HG2 LYS 16 2HG LYS 16 3.808 -14.372 -3.956 142 HG3 LYS 16 3HG LYS 16 5.345 -14.620 -3.124 143 HD2 LYS 16 2HD LYS 16 4.786 -16.604 -4.422 144 HD3 LYS 16 3HD LYS 16 4.721 -16.988 -2.701 145 HE2 LYS 16 2HE LYS 16 2.839 -18.005 -3.906 146 HE3 LYS 16 3HE LYS 16 2.261 -16.797 -2.758 147 HZ1 LYS 16 3HZ LYS 16 2.634 -16.335 -5.668 148 HZ2 LYS 16 1HZ LYS 16 1.995 -15.240 -4.551 149 HZ3 LYS 16 2HZ LYS 16 1.156 -16.655 -4.919 150 H LYS 17 H LYS 17 5.324 -12.151 -3.233 151 HA LYS 17 HA LYS 17 7.877 -12.728 -2.100 152 HB2 LYS 17 2HB LYS 17 7.079 -10.914 -4.410 153 HB3 LYS 17 3HB LYS 17 8.750 -11.291 -3.999 154 HG2 LYS 17 2HG LYS 17 8.401 -13.653 -4.489 155 HG3 LYS 17 3HG LYS 17 6.677 -13.381 -4.745 156 HD2 LYS 17 2HD LYS 17 7.795 -13.589 -6.904 157 HD3 LYS 17 3HD LYS 17 7.219 -11.934 -6.705 158 HE2 LYS 17 2HE LYS 17 9.493 -11.208 -6.101 159 HE3 LYS 17 3HE LYS 17 10.071 -12.870 -6.255 160 HZ1 LYS 17 3HZ LYS 17 8.947 -11.200 -8.441 161 HZ2 LYS 17 1HZ LYS 17 9.419 -12.817 -8.591 162 HZ3 LYS 17 2HZ LYS 17 10.570 -11.635 -8.238 163 H ILE 18 H ILE 18 6.013 -9.720 -2.409 164 HA ILE 18 HA ILE 18 7.811 -7.966 -1.103 165 HB ILE 18 HB ILE 18 4.784 -7.847 -1.499 166 HG12 ILE 18 2HG1 ILE 18 7.007 -6.196 -2.800 167 HG13 ILE 18 3HG1 ILE 18 6.259 -7.605 -3.537 168 HG21 ILE 18 1HG2 ILE 18 6.514 -5.655 -0.310 169 HG22 ILE 18 2HG2 ILE 18 5.284 -6.586 0.549 170 HG23 ILE 18 3HG2 ILE 18 4.816 -5.503 -0.757 171 HD11 ILE 18 3HD1 ILE 18 4.104 -6.420 -3.577 172 HD12 ILE 18 1HD1 ILE 18 5.363 -5.580 -4.481 173 HD13 ILE 18 2HD1 ILE 18 4.888 -4.995 -2.887 174 H LYS 19 H LYS 19 5.139 -10.042 0.106 175 HA LYS 19 HA LYS 19 5.193 -9.140 2.782 176 HB2 LYS 19 2HB LYS 19 4.232 -11.772 1.607 177 HB3 LYS 19 3HB LYS 19 4.119 -11.414 3.331 178 HG2 LYS 19 2HG LYS 19 2.803 -9.349 2.744 179 HG3 LYS 19 3HG LYS 19 2.785 -9.894 1.072 180 HD2 LYS 19 2HD LYS 19 1.594 -11.395 3.432 181 HD3 LYS 19 3HD LYS 19 0.686 -10.440 2.263 182 HE2 LYS 19 2HE LYS 19 1.491 -11.996 0.462 183 HE3 LYS 19 3HE LYS 19 2.224 -12.995 1.723 184 HZ1 LYS 19 3HZ LYS 19 0.029 -13.278 2.707 185 HZ2 LYS 19 1HZ LYS 19 0.038 -13.817 1.104 186 HZ3 LYS 19 2HZ LYS 19 -0.662 -12.327 1.496 187 H LYS 20 H LYS 20 7.201 -11.545 1.120 188 HA LYS 20 HA LYS 20 8.505 -12.500 3.489 189 HB2 LYS 20 2HB LYS 20 9.378 -12.590 0.568 190 HB3 LYS 20 3HB LYS 20 10.238 -13.398 1.872 191 HG2 LYS 20 2HG LYS 20 7.444 -14.006 0.872 192 HG3 LYS 20 3HG LYS 20 8.873 -15.015 0.698 193 HD2 LYS 20 2HD LYS 20 7.461 -14.366 3.317 194 HD3 LYS 20 3HD LYS 20 7.357 -15.886 2.431 195 HE2 LYS 20 2HE LYS 20 9.756 -16.292 2.804 196 HE3 LYS 20 3HE LYS 20 9.893 -14.751 3.655 197 HZ1 LYS 20 3HZ LYS 20 8.435 -15.548 5.357 198 HZ2 LYS 20 1HZ LYS 20 9.676 -16.673 5.155 199 HZ3 LYS 20 2HZ LYS 20 8.140 -16.989 4.526 200 H GLU 21 H GLU 21 9.575 -10.248 0.917 201 HA GLU 21 HA GLU 21 11.904 -9.204 1.818 202 HB2 GLU 21 2HB GLU 21 9.563 -7.656 0.642 203 HB3 GLU 21 3HB GLU 21 11.161 -6.954 0.843 204 HG2 GLU 21 2HG GLU 21 10.491 -9.339 -0.901 205 HG3 GLU 21 3HG GLU 21 10.741 -7.689 -1.468 206 H VAL 22 H VAL 22 8.716 -8.088 2.872 207 HA VAL 22 HA VAL 22 9.818 -6.029 4.608 208 HB VAL 22 HB VAL 22 7.574 -5.205 4.842 209 HG11 VAL 22 1HG1 VAL 22 8.644 -4.718 2.690 210 HG12 VAL 22 2HG1 VAL 22 6.909 -4.902 2.467 211 HG13 VAL 22 3HG1 VAL 22 7.997 -6.206 1.999 212 HG21 VAL 22 3HG2 VAL 22 5.583 -6.401 3.962 213 HG22 VAL 22 1HG2 VAL 22 6.367 -7.284 5.276 214 HG23 VAL 22 2HG2 VAL 22 6.596 -7.802 3.606 215 H GLU 23 H GLU 23 8.535 -9.238 4.943 216 HA GLU 23 HA GLU 23 7.876 -9.371 7.662 217 HB2 GLU 23 2HB GLU 23 7.445 -11.208 6.110 218 HB3 GLU 23 3HB GLU 23 9.164 -11.431 5.825 219 HG2 GLU 23 2HG GLU 23 9.422 -12.168 8.194 220 HG3 GLU 23 3HG GLU 23 7.680 -11.997 8.412 221 H ASN 24 H ASN 24 10.996 -9.825 6.025 222 HA ASN 24 HA ASN 24 12.597 -10.222 8.336 223 HB2 ASN 24 2HB ASN 24 13.399 -9.185 5.575 224 HB3 ASN 24 3HB ASN 24 14.538 -9.664 6.823 225 HD21 ASN 24 1HD2 ASN 24 12.401 -10.768 4.356 226 HD22 ASN 24 2HD2 ASN 24 12.752 -12.453 4.495 227 H GLN 25 H GLN 25 11.379 -7.339 6.749 228 HA GLN 25 HA GLN 25 13.128 -5.481 8.150 229 HB2 GLN 25 2HB GLN 25 10.637 -4.803 6.536 230 HB3 GLN 25 3HB GLN 25 11.972 -3.736 6.935 231 HG2 GLN 25 2HG GLN 25 12.015 -6.056 5.002 232 HG3 GLN 25 3HG GLN 25 12.078 -4.352 4.596 233 HE21 GLN 25 1HE2 GLN 25 13.872 -7.099 5.687 234 HE22 GLN 25 2HE2 GLN 25 15.437 -6.379 5.600 235 H GLY 26 H GLY 26 10.571 -7.271 9.220 236 HA2 GLY 26 2HA GLY 26 9.385 -7.217 11.172 237 HA3 GLY 26 3HA GLY 26 10.144 -5.684 11.556 238 H TYR 27 H TYR 27 8.249 -6.136 8.620 239 HA TYR 27 HA TYR 27 6.120 -4.386 9.704 240 HB2 TYR 27 2HB TYR 27 6.941 -5.007 6.832 241 HB3 TYR 27 3HB TYR 27 5.427 -4.198 7.223 242 HD1 TYR 27 HD2 TYR 27 9.139 -3.871 7.538 243 HD2 TYR 27 HD1 TYR 27 5.388 -1.824 7.600 244 HE1 TYR 27 HE2 TYR 27 10.316 -1.715 7.549 245 HE2 TYR 27 HE1 TYR 27 6.565 0.334 7.613 246 HH TYR 27 HH TYR 27 9.918 0.627 6.979 247 H GLN 28 H GLN 28 4.270 -5.313 10.301 248 HA GLN 28 HA GLN 28 3.570 -8.047 9.552 249 HB2 GLN 28 2HB GLN 28 2.279 -6.006 11.398 250 HB3 GLN 28 3HB GLN 28 1.533 -7.558 11.055 251 HG2 GLN 28 2HG GLN 28 4.297 -7.277 12.271 252 HG3 GLN 28 3HG GLN 28 2.820 -7.412 13.223 253 HE21 GLN 28 1HE2 GLN 28 3.446 -9.363 14.185 254 HE22 GLN 28 2HE2 GLN 28 3.528 -10.857 13.325 255 H VAL 29 H VAL 29 2.356 -8.505 7.803 256 HA VAL 29 HA VAL 29 1.069 -6.316 6.332 257 HB VAL 29 HB VAL 29 1.580 -9.159 5.348 258 HG11 VAL 29 1HG1 VAL 29 -0.166 -7.974 4.076 259 HG12 VAL 29 2HG1 VAL 29 1.281 -8.173 3.092 260 HG13 VAL 29 3HG1 VAL 29 0.920 -6.607 3.817 261 HG21 VAL 29 3HG2 VAL 29 3.561 -8.266 4.185 262 HG22 VAL 29 1HG2 VAL 29 3.716 -8.101 5.936 263 HG23 VAL 29 2HG2 VAL 29 3.311 -6.694 4.949 264 H ARG 30 H ARG 30 -1.061 -6.292 5.778 265 HA ARG 30 HA ARG 30 -2.842 -8.499 6.654 266 HB2 ARG 30 2HB ARG 30 -3.513 -5.533 6.369 267 HB3 ARG 30 3HB ARG 30 -4.656 -6.792 6.805 268 HG2 ARG 30 2HG ARG 30 -2.320 -5.811 8.466 269 HG3 ARG 30 3HG ARG 30 -4.033 -5.525 8.763 270 HD2 ARG 30 2HD ARG 30 -4.294 -8.040 9.017 271 HD3 ARG 30 3HD ARG 30 -2.530 -8.145 8.993 272 HE ARG 30 HE ARG 30 -3.938 -6.450 10.951 273 HH11 ARG 30 1HH1 ARG 30 -1.699 -9.115 10.355 274 HH12 ARG 30 2HH1 ARG 30 -1.235 -9.231 12.026 275 HH21 ARG 30 1HH2 ARG 30 -3.359 -6.691 13.129 276 HH22 ARG 30 2HH2 ARG 30 -2.172 -7.869 13.579 277 H ASP 31 H ASP 31 -3.445 -9.598 4.891 278 HA ASP 31 HA ASP 31 -3.720 -8.397 2.238 279 HB2 ASP 31 2HB ASP 31 -4.427 -11.209 3.226 280 HB3 ASP 31 3HB ASP 31 -4.418 -10.688 1.541 281 H VAL 32 H VAL 32 -5.526 -7.320 1.711 282 HA VAL 32 HA VAL 32 -8.078 -7.857 3.120 283 HB VAL 32 HB VAL 32 -7.067 -5.166 2.058 284 HG11 VAL 32 1HG1 VAL 32 -9.109 -4.210 3.079 285 HG12 VAL 32 2HG1 VAL 32 -9.655 -5.830 3.516 286 HG13 VAL 32 3HG1 VAL 32 -9.505 -5.378 1.817 287 HG21 VAL 32 3HG2 VAL 32 -5.893 -5.841 4.126 288 HG22 VAL 32 1HG2 VAL 32 -7.440 -6.076 4.942 289 HG23 VAL 32 2HG2 VAL 32 -6.951 -4.461 4.424 290 H ASN 33 H ASN 33 -9.349 -8.870 1.771 291 HA ASN 33 HA ASN 33 -9.907 -7.767 -0.896 292 HB2 ASN 33 2HB ASN 33 -10.205 -10.184 -1.710 293 HB3 ASN 33 3HB ASN 33 -8.543 -9.675 -1.433 294 HD21 ASN 33 1HD2 ASN 33 -7.817 -11.787 -1.198 295 HD22 ASN 33 2HD2 ASN 33 -8.170 -12.758 0.185 296 H ASP 34 H ASP 34 -10.980 -7.779 1.958 297 HA ASP 34 HA ASP 34 -13.795 -8.351 1.378 298 HB2 ASP 34 2HB ASP 34 -12.937 -10.387 2.456 299 HB3 ASP 34 3HB ASP 34 -12.216 -9.445 3.754 300 H SER 35 H SER 35 -15.171 -6.862 2.295 301 HA SER 35 HA SER 35 -14.245 -4.386 3.216 302 HB2 SER 35 2HB SER 35 -16.360 -4.688 2.019 303 HB3 SER 35 3HB SER 35 -17.039 -5.583 3.374 304 HG SER 35 HG SER 35 -17.032 -3.734 4.597 305 H ASP 36 H ASP 36 -15.657 -7.110 5.093 306 HA ASP 36 HA ASP 36 -15.789 -5.722 7.577 307 HB2 ASP 36 2HB ASP 36 -15.644 -8.722 7.048 308 HB3 ASP 36 3HB ASP 36 -15.934 -8.022 8.638 309 H GLU 37 H GLU 37 -13.214 -7.543 5.999 310 HA GLU 37 HA GLU 37 -11.361 -7.601 8.168 311 HB2 GLU 37 2HB GLU 37 -11.016 -7.735 5.145 312 HB3 GLU 37 3HB GLU 37 -9.635 -7.786 6.232 313 HG2 GLU 37 2HG GLU 37 -11.935 -9.758 6.297 314 HG3 GLU 37 3HG GLU 37 -10.398 -10.032 5.481 315 H LEU 38 H LEU 38 -11.893 -5.299 5.484 316 HA LEU 38 HA LEU 38 -9.841 -3.464 5.958 317 HB2 LEU 38 2HB LEU 38 -11.128 -3.437 3.923 318 HB3 LEU 38 3HB LEU 38 -12.626 -3.141 4.774 319 HG LEU 38 HG LEU 38 -10.487 -0.995 4.935 320 HD11 LEU 38 1HD1 LEU 38 -12.241 -1.374 2.491 321 HD12 LEU 38 2HD1 LEU 38 -10.489 -1.575 2.554 322 HD13 LEU 38 3HD1 LEU 38 -11.198 0.013 2.823 323 HD21 LEU 38 3HD2 LEU 38 -12.413 0.540 4.882 324 HD22 LEU 38 1HD2 LEU 38 -12.603 -0.660 6.163 325 HD23 LEU 38 2HD2 LEU 38 -13.512 -0.823 4.658 326 H LYS 39 H LYS 39 -13.155 -3.473 7.211 327 HA LYS 39 HA LYS 39 -12.981 -1.001 8.605 328 HB2 LYS 39 2HB LYS 39 -14.979 -3.288 8.791 329 HB3 LYS 39 3HB LYS 39 -15.197 -1.718 9.560 330 HG2 LYS 39 2HG LYS 39 -15.317 -0.598 7.403 331 HG3 LYS 39 3HG LYS 39 -14.873 -2.087 6.562 332 HD2 LYS 39 2HD LYS 39 -17.279 -1.688 6.341 333 HD3 LYS 39 3HD LYS 39 -16.995 -3.138 7.303 334 HE2 LYS 39 2HE LYS 39 -17.392 -1.803 9.371 335 HE3 LYS 39 3HE LYS 39 -17.737 -0.393 8.366 336 HZ1 LYS 39 3HZ LYS 39 -19.270 -2.940 8.393 337 HZ2 LYS 39 1HZ LYS 39 -19.577 -1.632 7.360 338 HZ3 LYS 39 2HZ LYS 39 -19.767 -1.455 9.027 339 H LYS 40 H LYS 40 -12.681 -4.398 9.611 340 HA LYS 40 HA LYS 40 -12.467 -3.840 12.416 341 HB2 LYS 40 2HB LYS 40 -12.023 -6.331 10.760 342 HB3 LYS 40 3HB LYS 40 -11.639 -6.313 12.473 343 HG2 LYS 40 2HG LYS 40 -14.016 -5.624 12.947 344 HG3 LYS 40 3HG LYS 40 -14.373 -5.811 11.235 345 HD2 LYS 40 2HD LYS 40 -13.312 -8.083 12.948 346 HD3 LYS 40 3HD LYS 40 -15.029 -7.747 12.776 347 HE2 LYS 40 2HE LYS 40 -14.392 -9.545 11.276 348 HE3 LYS 40 3HE LYS 40 -14.839 -8.127 10.326 349 HZ1 LYS 40 3HZ LYS 40 -12.036 -8.915 10.960 350 HZ2 LYS 40 1HZ LYS 40 -12.531 -7.686 9.909 351 HZ3 LYS 40 2HZ LYS 40 -12.832 -9.302 9.520 352 H GLU 41 H GLU 41 -10.101 -4.008 9.788 353 HA GLU 41 HA GLU 41 -7.792 -3.915 11.460 354 HB2 GLU 41 2HB GLU 41 -8.178 -2.904 8.610 355 HB3 GLU 41 3HB GLU 41 -6.635 -2.845 9.452 356 HG2 GLU 41 2HG GLU 41 -8.152 -5.258 8.477 357 HG3 GLU 41 3HG GLU 41 -6.499 -4.771 8.116 358 H MET 42 H MET 42 -9.884 -1.410 10.050 359 HA MET 42 HA MET 42 -8.435 0.852 10.953 360 HB2 MET 42 2HB MET 42 -11.338 0.503 10.119 361 HB3 MET 42 3HB MET 42 -10.661 2.071 10.563 362 HG2 MET 42 2HG MET 42 -9.707 0.303 8.308 363 HG3 MET 42 3HG MET 42 -10.631 1.805 8.161 364 HE1 MET 42 3HE MET 42 -7.755 0.953 6.874 365 HE2 MET 42 1HE MET 42 -6.860 2.465 6.972 366 HE3 MET 42 2HE MET 42 -8.533 2.471 6.422 367 H LYS 43 H LYS 43 -10.786 -1.200 12.525 368 HA LYS 43 HA LYS 43 -11.312 0.363 14.806 369 HB2 LYS 43 2HB LYS 43 -11.201 -2.657 14.430 370 HB3 LYS 43 3HB LYS 43 -11.717 -1.903 15.933 371 HG2 LYS 43 2HG LYS 43 -13.062 -1.515 13.239 372 HG3 LYS 43 3HG LYS 43 -13.622 -2.607 14.502 373 HD2 LYS 43 2HD LYS 43 -13.424 0.421 14.737 374 HD3 LYS 43 3HD LYS 43 -14.907 -0.501 14.497 375 HE2 LYS 43 2HE LYS 43 -14.603 -1.592 16.687 376 HE3 LYS 43 3HE LYS 43 -13.091 -0.709 16.925 377 HZ1 LYS 43 3HZ LYS 43 -14.368 1.363 16.834 378 HZ2 LYS 43 1HZ LYS 43 -14.867 0.368 18.106 379 HZ3 LYS 43 2HZ LYS 43 -15.800 0.485 16.707 380 H LYS 44 H LYS 44 -8.841 -2.148 14.265 381 HA LYS 44 HA LYS 44 -7.637 -1.970 16.840 382 HB2 LYS 44 2HB LYS 44 -6.610 -3.182 14.258 383 HB3 LYS 44 3HB LYS 44 -5.852 -3.399 15.837 384 HG2 LYS 44 2HG LYS 44 -8.069 -4.340 16.659 385 HG3 LYS 44 3HG LYS 44 -8.607 -4.334 14.979 386 HD2 LYS 44 2HD LYS 44 -6.166 -5.814 16.005 387 HD3 LYS 44 3HD LYS 44 -7.753 -6.529 15.770 388 HE2 LYS 44 2HE LYS 44 -6.087 -5.270 13.569 389 HE3 LYS 44 3HE LYS 44 -6.197 -6.999 13.884 390 HZ1 LYS 44 3HZ LYS 44 -7.661 -6.188 12.086 391 HZ2 LYS 44 1HZ LYS 44 -8.539 -5.311 13.228 392 HZ3 LYS 44 2HZ LYS 44 -8.483 -6.994 13.317 393 H LEU 45 H LEU 45 -6.956 -0.401 13.761 394 HA LEU 45 HA LEU 45 -4.401 0.695 14.451 395 HB2 LEU 45 2HB LEU 45 -6.357 1.432 12.234 396 HB3 LEU 45 3HB LEU 45 -4.730 2.082 12.367 397 HG LEU 45 HG LEU 45 -5.425 -0.846 11.898 398 HD11 LEU 45 1HD1 LEU 45 -4.294 1.184 9.949 399 HD12 LEU 45 2HD1 LEU 45 -5.927 0.517 9.935 400 HD13 LEU 45 3HD1 LEU 45 -4.547 -0.535 9.629 401 HD21 LEU 45 3HD2 LEU 45 -3.353 -0.667 13.176 402 HD22 LEU 45 1HD2 LEU 45 -2.689 0.468 11.996 403 HD23 LEU 45 2HD2 LEU 45 -3.015 -1.205 11.534 404 H ALA 46 H ALA 46 -7.706 2.101 14.181 405 HA ALA 46 HA ALA 46 -6.981 4.723 15.005 406 HB1 ALA 46 3HB ALA 46 -9.384 5.144 15.206 407 HB2 ALA 46 1HB ALA 46 -9.717 3.409 15.104 408 HB3 ALA 46 2HB ALA 46 -9.018 4.262 13.726 409 H GLU 47 H GLU 47 -8.087 1.897 16.813 410 HA GLU 47 HA GLU 47 -8.357 3.143 19.373 411 HB2 GLU 47 2HB GLU 47 -7.972 0.249 18.519 412 HB3 GLU 47 3HB GLU 47 -8.136 0.702 20.209 413 HG2 GLU 47 2HG GLU 47 -10.383 1.623 19.767 414 HG3 GLU 47 3HG GLU 47 -10.210 1.233 18.058 415 H GLU 48 H GLU 48 -5.588 2.582 17.552 416 HA GLU 48 HA GLU 48 -3.363 2.679 17.884 417 HB2 GLU 48 2HB GLU 48 -4.085 3.717 20.666 418 HB3 GLU 48 3HB GLU 48 -2.481 3.781 19.954 419 HG2 GLU 48 2HG GLU 48 -4.943 5.264 19.023 420 HG3 GLU 48 3HG GLU 48 -3.484 5.953 19.742 421 H LYS 49 H LYS 49 -5.083 0.352 18.877 422 HA LYS 49 HA LYS 49 -3.617 -0.885 21.041 423 HB2 LYS 49 2HB LYS 49 -6.106 -0.935 20.791 424 HB3 LYS 49 3HB LYS 49 -5.926 -1.869 19.315 425 HG2 LYS 49 2HG LYS 49 -5.179 -3.801 20.508 426 HG3 LYS 49 3HG LYS 49 -4.924 -2.872 21.991 427 HD2 LYS 49 2HD LYS 49 -7.019 -4.299 22.006 428 HD3 LYS 49 3HD LYS 49 -7.300 -2.587 22.326 429 HE2 LYS 49 2HE LYS 49 -7.993 -2.294 19.943 430 HE3 LYS 49 3HE LYS 49 -7.785 -4.028 19.689 431 HZ1 LYS 49 3HZ LYS 49 -9.690 -2.759 21.588 432 HZ2 LYS 49 1HZ LYS 49 -9.479 -4.424 21.382 433 HZ3 LYS 49 2HZ LYS 49 -10.089 -3.486 20.119 434 H ASN 50 H ASN 50 -3.779 -1.001 17.574 435 HA ASN 50 HA ASN 50 -1.466 -2.859 17.475 436 HB2 ASN 50 2HB ASN 50 -3.503 -3.600 16.162 437 HB3 ASN 50 3HB ASN 50 -3.383 -2.130 15.204 438 HD21 ASN 50 1HD2 ASN 50 -3.331 -4.719 14.111 439 HD22 ASN 50 2HD2 ASN 50 -1.783 -4.984 13.394 440 H PHE 51 H PHE 51 -0.164 -1.017 18.153 441 HA PHE 51 HA PHE 51 -0.000 1.393 16.564 442 HB2 PHE 51 2HB PHE 51 0.482 1.469 18.978 443 HB3 PHE 51 3HB PHE 51 1.802 0.320 18.791 444 HD1 PHE 51 HD2 PHE 51 0.711 3.769 17.709 445 HD2 PHE 51 HD1 PHE 51 4.017 1.137 18.453 446 HE1 PHE 51 HE2 PHE 51 2.287 5.620 17.369 447 HE2 PHE 51 HE1 PHE 51 5.577 3.009 18.102 448 HZ PHE 51 HZ PHE 51 4.711 5.248 17.558 449 H GLU 52 H GLU 52 1.316 -1.747 16.350 450 HA GLU 52 HA GLU 52 3.874 -1.466 15.342 451 HB2 GLU 52 2HB GLU 52 2.847 -3.601 16.070 452 HB3 GLU 52 3HB GLU 52 1.807 -3.596 14.653 453 HG2 GLU 52 2HG GLU 52 3.659 -5.172 14.375 454 HG3 GLU 52 3HG GLU 52 3.774 -3.867 13.198 455 H LYS 53 H LYS 53 4.756 -1.590 13.215 456 HA LYS 53 HA LYS 53 3.499 0.202 11.359 457 HB2 LYS 53 2HB LYS 53 6.049 -1.385 10.878 458 HB3 LYS 53 3HB LYS 53 5.577 0.147 10.153 459 HG2 LYS 53 2HG LYS 53 6.443 -0.334 13.018 460 HG3 LYS 53 3HG LYS 53 7.320 0.557 11.782 461 HD2 LYS 53 2HD LYS 53 4.666 1.407 13.015 462 HD3 LYS 53 3HD LYS 53 6.247 2.058 13.444 463 HE2 LYS 53 2HE LYS 53 4.941 2.270 10.714 464 HE3 LYS 53 3HE LYS 53 5.044 3.559 11.916 465 HZ1 LYS 53 3HZ LYS 53 6.766 3.860 10.323 466 HZ2 LYS 53 1HZ LYS 53 7.310 2.266 10.502 467 HZ3 LYS 53 2HZ LYS 53 7.483 3.366 11.772 468 H ILE 54 H ILE 54 1.825 -0.567 10.182 469 HA ILE 54 HA ILE 54 1.774 -3.412 9.426 470 HB ILE 54 HB ILE 54 -0.535 -1.424 9.642 471 HG12 ILE 54 2HG1 ILE 54 0.332 -2.048 11.865 472 HG13 ILE 54 3HG1 ILE 54 -1.256 -2.749 11.615 473 HG21 ILE 54 1HG2 ILE 54 -0.987 -3.101 7.907 474 HG22 ILE 54 2HG2 ILE 54 -2.025 -3.370 9.305 475 HG23 ILE 54 3HG2 ILE 54 -0.621 -4.406 9.040 476 HD11 ILE 54 3HD1 ILE 54 0.205 -4.297 12.749 477 HD12 ILE 54 1HD1 ILE 54 1.385 -4.201 11.445 478 HD13 ILE 54 2HD1 ILE 54 -0.197 -4.929 11.153 479 H LEU 55 H LEU 55 2.254 -3.831 7.400 480 HA LEU 55 HA LEU 55 1.807 -1.921 5.227 481 HB2 LEU 55 2HB LEU 55 3.830 -3.474 5.428 482 HB3 LEU 55 3HB LEU 55 2.770 -4.815 5.032 483 HG LEU 55 HG LEU 55 3.095 -2.436 3.155 484 HD11 LEU 55 1HD1 LEU 55 4.803 -3.651 1.919 485 HD12 LEU 55 2HD1 LEU 55 4.786 -4.941 3.123 486 HD13 LEU 55 3HD1 LEU 55 5.331 -3.323 3.567 487 HD21 LEU 55 3HD2 LEU 55 2.430 -3.994 1.398 488 HD22 LEU 55 1HD2 LEU 55 1.194 -3.891 2.650 489 HD23 LEU 55 2HD2 LEU 55 2.263 -5.293 2.583 490 H ILE 56 H ILE 56 -0.087 -1.902 4.078 491 HA ILE 56 HA ILE 56 -2.001 -4.146 4.411 492 HB ILE 56 HB ILE 56 -2.537 -1.281 3.489 493 HG12 ILE 56 2HG1 ILE 56 -2.020 -1.487 5.962 494 HG13 ILE 56 3HG1 ILE 56 -3.612 -0.839 5.606 495 HG21 ILE 56 1HG2 ILE 56 -4.942 -1.881 3.623 496 HG22 ILE 56 2HG2 ILE 56 -4.502 -3.552 3.978 497 HG23 ILE 56 3HG2 ILE 56 -4.082 -2.841 2.418 498 HD11 ILE 56 3HD1 ILE 56 -4.617 -3.006 6.150 499 HD12 ILE 56 1HD1 ILE 56 -3.665 -2.365 7.486 500 HD13 ILE 56 2HD1 ILE 56 -3.012 -3.662 6.487 501 H ILE 57 H ILE 57 -1.664 -5.539 2.723 502 HA ILE 57 HA ILE 57 -1.536 -4.493 -0.040 503 HB ILE 57 HB ILE 57 -1.408 -7.362 1.015 504 HG12 ILE 57 2HG1 ILE 57 0.699 -5.684 -0.422 505 HG13 ILE 57 3HG1 ILE 57 0.651 -5.977 1.311 506 HG21 ILE 57 1HG2 ILE 57 -1.017 -8.088 -1.334 507 HG22 ILE 57 2HG2 ILE 57 -1.338 -6.447 -1.889 508 HG23 ILE 57 3HG2 ILE 57 -2.623 -7.384 -1.127 509 HD11 ILE 57 3HD1 ILE 57 2.293 -7.363 0.227 510 HD12 ILE 57 1HD1 ILE 57 1.051 -8.081 -0.803 511 HD13 ILE 57 2HD1 ILE 57 1.013 -8.338 0.947 512 H SER 58 H SER 58 -3.457 -3.945 -0.878 513 HA SER 58 HA SER 58 -5.883 -5.489 -0.130 514 HB2 SER 58 2HB SER 58 -5.986 -3.069 0.519 515 HB3 SER 58 3HB SER 58 -5.732 -2.614 -1.168 516 HG SER 58 HG SER 58 -7.759 -3.065 -1.566 517 H ASN 59 H ASN 59 -6.479 -6.841 -1.718 518 HA ASN 59 HA ASN 59 -5.245 -6.902 -4.280 519 HB2 ASN 59 2HB ASN 59 -7.747 -8.375 -3.322 520 HB3 ASN 59 3HB ASN 59 -6.838 -8.750 -4.782 521 HD21 ASN 59 1HD2 ASN 59 -6.389 -10.870 -4.129 522 HD22 ASN 59 2HD2 ASN 59 -5.294 -11.243 -2.843 523 H ASP 60 H ASP 60 -8.204 -5.530 -3.045 524 HA ASP 60 HA ASP 60 -9.246 -4.900 -5.734 525 HB2 ASP 60 2HB ASP 60 -10.792 -6.051 -4.170 526 HB3 ASP 60 3HB ASP 60 -10.600 -4.756 -2.999 527 H LYS 61 H LYS 61 -9.408 -2.811 -6.426 528 HA LYS 61 HA LYS 61 -7.757 -0.835 -5.122 529 HB2 LYS 61 2HB LYS 61 -9.323 -0.756 -7.723 530 HB3 LYS 61 3HB LYS 61 -8.239 0.521 -7.181 531 HG2 LYS 61 2HG LYS 61 -6.366 -1.170 -7.163 532 HG3 LYS 61 3HG LYS 61 -7.481 -2.326 -7.898 533 HD2 LYS 61 2HD LYS 61 -7.747 -0.855 -9.860 534 HD3 LYS 61 3HD LYS 61 -6.694 0.354 -9.116 535 HE2 LYS 61 2HE LYS 61 -4.824 -1.274 -9.162 536 HE3 LYS 61 3HE LYS 61 -5.880 -2.452 -9.943 537 HZ1 LYS 61 3HZ LYS 61 -4.456 -1.281 -11.511 538 HZ2 LYS 61 1HZ LYS 61 -5.150 0.193 -11.070 539 HZ3 LYS 61 2HZ LYS 61 -6.089 -0.987 -11.833 540 H GLN 62 H GLN 62 -11.217 -1.385 -5.315 541 HA GLN 62 HA GLN 62 -11.990 1.279 -4.502 542 HB2 GLN 62 2HB GLN 62 -13.670 -0.089 -5.603 543 HB3 GLN 62 3HB GLN 62 -13.497 -1.365 -4.406 544 HG2 GLN 62 2HG GLN 62 -15.554 -0.238 -3.957 545 HG3 GLN 62 3HG GLN 62 -14.434 0.199 -2.680 546 HE21 GLN 62 1HE2 GLN 62 -16.863 1.535 -3.507 547 HE22 GLN 62 2HE2 GLN 62 -16.428 3.153 -3.922 548 H LEU 63 H LEU 63 -11.371 -1.826 -2.816 549 HA LEU 63 HA LEU 63 -11.806 -0.929 -0.166 550 HB2 LEU 63 2HB LEU 63 -10.055 -3.159 -1.265 551 HB3 LEU 63 3HB LEU 63 -10.313 -2.904 0.453 552 HG LEU 63 HG LEU 63 -12.453 -3.648 -1.574 553 HD11 LEU 63 1HD1 LEU 63 -12.537 -5.810 -0.402 554 HD12 LEU 63 2HD1 LEU 63 -11.198 -5.310 0.635 555 HD13 LEU 63 3HD1 LEU 63 -10.945 -5.511 -1.100 556 HD21 LEU 63 3HD2 LEU 63 -13.402 -2.225 0.170 557 HD22 LEU 63 1HD2 LEU 63 -12.705 -3.253 1.426 558 HD23 LEU 63 2HD2 LEU 63 -13.965 -3.881 0.360 559 H LEU 64 H LEU 64 -9.029 -0.771 -2.328 560 HA LEU 64 HA LEU 64 -7.077 0.170 -0.533 561 HB2 LEU 64 2HB LEU 64 -6.468 -0.594 -2.723 562 HB3 LEU 64 3HB LEU 64 -7.479 0.596 -3.515 563 HG LEU 64 HG LEU 64 -5.132 1.550 -1.838 564 HD11 LEU 64 1HD1 LEU 64 -4.169 -0.161 -3.262 565 HD12 LEU 64 2HD1 LEU 64 -3.675 1.437 -3.808 566 HD13 LEU 64 3HD1 LEU 64 -4.927 0.554 -4.687 567 HD21 LEU 64 3HD2 LEU 64 -5.071 3.390 -3.487 568 HD22 LEU 64 1HD2 LEU 64 -6.652 3.268 -2.718 569 HD23 LEU 64 2HD2 LEU 64 -6.424 2.660 -4.354 570 H LYS 65 H LYS 65 -9.441 1.928 -2.546 571 HA LYS 65 HA LYS 65 -8.818 4.558 -1.820 572 HB2 LYS 65 2HB LYS 65 -11.409 3.258 -2.705 573 HB3 LYS 65 3HB LYS 65 -11.326 4.978 -2.357 574 HG2 LYS 65 2HG LYS 65 -9.617 5.239 -4.143 575 HG3 LYS 65 3HG LYS 65 -9.753 3.515 -4.500 576 HD2 LYS 65 2HD LYS 65 -11.071 4.909 -6.084 577 HD3 LYS 65 3HD LYS 65 -12.082 3.782 -5.184 578 HE2 LYS 65 2HE LYS 65 -11.770 6.692 -4.370 579 HE3 LYS 65 3HE LYS 65 -12.996 6.155 -5.513 580 HZ1 LYS 65 3HZ LYS 65 -12.782 5.495 -2.625 581 HZ2 LYS 65 1HZ LYS 65 -13.748 4.585 -3.683 582 HZ3 LYS 65 2HZ LYS 65 -14.052 6.227 -3.453 583 H GLU 66 H GLU 66 -11.354 2.420 -0.461 584 HA GLU 66 HA GLU 66 -12.354 4.171 1.466 585 HB2 GLU 66 2HB GLU 66 -12.284 1.141 1.757 586 HB3 GLU 66 3HB GLU 66 -13.431 2.249 2.486 587 HG2 GLU 66 2HG GLU 66 -13.235 1.397 -0.394 588 HG3 GLU 66 3HG GLU 66 -14.566 1.142 0.724 589 H MET 67 H MET 67 -9.770 1.774 1.643 590 HA MET 67 HA MET 67 -9.031 1.882 4.317 591 HB2 MET 67 2HB MET 67 -8.134 0.343 2.466 592 HB3 MET 67 3HB MET 67 -7.097 1.666 1.963 593 HG2 MET 67 2HG MET 67 -5.731 0.248 3.258 594 HG3 MET 67 3HG MET 67 -6.111 1.597 4.327 595 HE1 MET 67 3HE MET 67 -8.106 -2.563 4.651 596 HE2 MET 67 1HE MET 67 -6.908 -2.148 3.421 597 HE3 MET 67 2HE MET 67 -8.512 -1.414 3.379 598 H LEU 68 H LEU 68 -7.765 3.844 1.591 599 HA LEU 68 HA LEU 68 -5.951 5.347 3.226 600 HB2 LEU 68 2HB LEU 68 -6.823 5.667 0.332 601 HB3 LEU 68 3HB LEU 68 -5.553 6.628 1.079 602 HG LEU 68 HG LEU 68 -5.483 3.603 0.744 603 HD11 LEU 68 1HD1 LEU 68 -3.740 3.968 -0.917 604 HD12 LEU 68 2HD1 LEU 68 -3.899 5.717 -0.737 605 HD13 LEU 68 3HD1 LEU 68 -5.233 4.772 -1.400 606 HD21 LEU 68 3HD2 LEU 68 -3.392 5.493 1.849 607 HD22 LEU 68 1HD2 LEU 68 -3.141 3.783 1.495 608 HD23 LEU 68 2HD2 LEU 68 -4.288 4.260 2.742 609 H GLU 69 H GLU 69 -9.227 5.898 2.141 610 HA GLU 69 HA GLU 69 -9.263 8.733 2.703 611 HB2 GLU 69 2HB GLU 69 -11.503 6.725 2.195 612 HB3 GLU 69 3HB GLU 69 -11.768 8.453 2.418 613 HG2 GLU 69 2HG GLU 69 -10.349 8.922 0.426 614 HG3 GLU 69 3HG GLU 69 -10.117 7.191 0.204 615 H LEU 70 H LEU 70 -10.230 5.778 4.430 616 HA LEU 70 HA LEU 70 -11.038 7.014 6.862 617 HB2 LEU 70 2HB LEU 70 -9.976 4.234 6.243 618 HB3 LEU 70 3HB LEU 70 -10.475 4.701 7.861 619 HG LEU 70 HG LEU 70 -12.333 4.776 5.448 620 HD11 LEU 70 1HD1 LEU 70 -13.355 2.719 6.263 621 HD12 LEU 70 2HD1 LEU 70 -12.180 2.620 7.575 622 HD13 LEU 70 3HD1 LEU 70 -11.650 2.455 5.900 623 HD21 LEU 70 3HD2 LEU 70 -12.925 4.999 8.416 624 HD22 LEU 70 1HD2 LEU 70 -14.121 4.979 7.117 625 HD23 LEU 70 2HD2 LEU 70 -12.979 6.314 7.237 626 H ILE 71 H ILE 71 -7.888 5.968 5.627 627 HA ILE 71 HA ILE 71 -6.350 6.412 8.001 628 HB ILE 71 HB ILE 71 -5.539 6.193 5.066 629 HG12 ILE 71 2HG1 ILE 71 -5.034 4.283 7.391 630 HG13 ILE 71 3HG1 ILE 71 -6.335 4.110 6.222 631 HG21 ILE 71 1HG2 ILE 71 -3.170 6.044 5.815 632 HG22 ILE 71 2HG2 ILE 71 -3.672 6.514 7.432 633 HG23 ILE 71 3HG2 ILE 71 -3.870 7.639 6.089 634 HD11 ILE 71 3HD1 ILE 71 -4.674 3.819 4.434 635 HD12 ILE 71 1HD1 ILE 71 -4.525 2.608 5.707 636 HD13 ILE 71 2HD1 ILE 71 -3.379 3.946 5.630 637 H SER 72 H SER 72 -7.466 8.463 5.365 638 HA SER 72 HA SER 72 -5.745 10.687 5.822 639 HB2 SER 72 2HB SER 72 -6.956 10.322 3.679 640 HB3 SER 72 3HB SER 72 -8.494 10.617 4.494 641 HG SER 72 HG SER 72 -6.353 12.444 4.092 642 H LYS 73 H LYS 73 -8.897 9.709 7.073 643 HA LYS 73 HA LYS 73 -9.474 12.028 8.634 644 HB2 LYS 73 2HB LYS 73 -10.403 9.142 8.987 645 HB3 LYS 73 3HB LYS 73 -11.146 10.555 9.732 646 HG2 LYS 73 2HG LYS 73 -11.809 11.407 7.522 647 HG3 LYS 73 3HG LYS 73 -11.001 10.044 6.744 648 HD2 LYS 73 2HD LYS 73 -13.431 9.676 6.837 649 HD3 LYS 73 3HD LYS 73 -12.579 8.476 7.811 650 HE2 LYS 73 2HE LYS 73 -14.631 9.347 8.920 651 HE3 LYS 73 3HE LYS 73 -13.170 9.665 9.862 652 HZ1 LYS 73 3HZ LYS 73 -14.613 11.603 8.124 653 HZ2 LYS 73 1HZ LYS 73 -13.172 11.934 8.947 654 HZ3 LYS 73 2HZ LYS 73 -14.582 11.602 9.815 655 H LEU 74 H LEU 74 -7.796 8.987 9.249 656 HA LEU 74 HA LEU 74 -7.315 9.453 12.060 657 HB2 LEU 74 2HB LEU 74 -6.176 7.372 10.156 658 HB3 LEU 74 3HB LEU 74 -5.996 7.344 11.902 659 HG LEU 74 HG LEU 74 -8.644 7.086 10.415 660 HD11 LEU 74 1HD1 LEU 74 -8.641 4.731 11.123 661 HD12 LEU 74 2HD1 LEU 74 -7.034 4.934 11.827 662 HD13 LEU 74 3HD1 LEU 74 -7.262 5.096 10.085 663 HD21 LEU 74 3HD2 LEU 74 -8.965 8.162 12.573 664 HD22 LEU 74 1HD2 LEU 74 -8.055 6.883 13.383 665 HD23 LEU 74 2HD2 LEU 74 -9.605 6.522 12.619 666 H GLY 75 H GLY 75 -5.735 10.294 9.117 667 HA2 GLY 75 2HA GLY 75 -4.007 11.709 8.677 668 HA3 GLY 75 3HA GLY 75 -3.876 12.026 10.393 669 H TYR 76 H TYR 76 -3.478 8.765 9.016 670 HA TYR 76 HA TYR 76 -0.744 8.662 10.052 671 HB2 TYR 76 2HB TYR 76 -2.238 6.494 8.525 672 HB3 TYR 76 3HB TYR 76 -0.726 6.289 9.400 673 HD1 TYR 76 HD1 TYR 76 -1.376 7.742 11.966 674 HD2 TYR 76 HD2 TYR 76 -3.694 4.997 9.641 675 HE1 TYR 76 HE1 TYR 76 -2.614 7.075 13.984 676 HE2 TYR 76 HE2 TYR 76 -4.933 4.345 11.654 677 HH TYR 76 HH TYR 76 -4.761 6.089 14.582 678 H LYS 77 H LYS 77 1.134 8.398 8.868 679 HA LYS 77 HA LYS 77 1.252 9.415 6.184 680 HB2 LYS 77 2HB LYS 77 3.085 9.906 7.691 681 HB3 LYS 77 3HB LYS 77 3.339 8.205 8.050 682 HG2 LYS 77 2HG LYS 77 5.117 9.122 6.600 683 HG3 LYS 77 3HG LYS 77 4.232 7.816 5.810 684 HD2 LYS 77 2HD LYS 77 4.705 9.658 4.243 685 HD3 LYS 77 3HD LYS 77 2.968 9.454 4.477 686 HE2 LYS 77 2HE LYS 77 3.042 11.357 6.123 687 HE3 LYS 77 3HE LYS 77 4.735 11.601 5.700 688 HZ1 LYS 77 3HZ LYS 77 4.098 12.084 3.454 689 HZ2 LYS 77 1HZ LYS 77 3.202 13.072 4.490 690 HZ3 LYS 77 2HZ LYS 77 2.483 11.722 3.771 691 H VAL 78 H VAL 78 0.991 8.268 4.352 692 HA VAL 78 HA VAL 78 1.610 5.365 4.354 693 HB VAL 78 HB VAL 78 -0.705 6.727 2.904 694 HG11 VAL 78 1HG1 VAL 78 0.183 3.827 2.664 695 HG12 VAL 78 2HG1 VAL 78 0.265 5.048 1.393 696 HG13 VAL 78 3HG1 VAL 78 -1.299 4.506 1.992 697 HG21 VAL 78 3HG2 VAL 78 -0.686 4.570 5.042 698 HG22 VAL 78 1HG2 VAL 78 -2.124 5.192 4.224 699 HG23 VAL 78 2HG2 VAL 78 -1.169 6.253 5.260 700 H PHE 79 H PHE 79 2.853 4.615 2.819 701 HA PHE 79 HA PHE 79 3.456 6.204 0.397 702 HB2 PHE 79 2HB PHE 79 5.012 3.908 1.691 703 HB3 PHE 79 3HB PHE 79 5.463 4.730 0.207 704 HD1 PHE 79 HD2 PHE 79 5.185 5.121 3.897 705 HD2 PHE 79 HD1 PHE 79 6.687 6.818 0.272 706 HE1 PHE 79 HE2 PHE 79 6.549 6.704 5.196 707 HE2 PHE 79 HE1 PHE 79 8.050 8.394 1.582 708 HZ PHE 79 HZ PHE 79 7.974 8.344 4.043 709 H LEU 80 H LEU 80 2.188 5.467 -1.257 710 HA LEU 80 HA LEU 80 1.139 2.705 -1.235 711 HB2 LEU 80 2HB LEU 80 -0.620 4.343 -1.297 712 HB3 LEU 80 3HB LEU 80 0.164 5.249 -2.579 713 HG LEU 80 HG LEU 80 -0.351 3.450 -4.203 714 HD11 LEU 80 1HD1 LEU 80 -0.294 1.500 -2.726 715 HD12 LEU 80 2HD1 LEU 80 -1.769 1.555 -3.687 716 HD13 LEU 80 3HD1 LEU 80 -1.811 2.012 -1.981 717 HD21 LEU 80 3HD2 LEU 80 -1.971 5.257 -3.934 718 HD22 LEU 80 1HD2 LEU 80 -2.807 4.349 -2.675 719 HD23 LEU 80 2HD2 LEU 80 -2.785 3.746 -4.334 720 H LEU 81 H LEU 81 1.502 1.310 -2.873 721 HA LEU 81 HA LEU 81 3.006 2.184 -5.271 722 HB2 LEU 81 2HB LEU 81 4.406 0.850 -3.657 723 HB3 LEU 81 3HB LEU 81 3.276 -0.486 -3.823 724 HG LEU 81 HG LEU 81 3.841 -0.659 -6.241 725 HD11 LEU 81 1HD1 LEU 81 4.415 1.636 -6.738 726 HD12 LEU 81 2HD1 LEU 81 5.762 0.587 -7.163 727 HD13 LEU 81 3HD1 LEU 81 5.834 1.555 -5.689 728 HD21 LEU 81 3HD2 LEU 81 6.085 -1.602 -5.987 729 HD22 LEU 81 1HD2 LEU 81 5.058 -2.042 -4.625 730 HD23 LEU 81 2HD2 LEU 81 6.277 -0.778 -4.437 731 H LEU 82 H LEU 82 1.808 1.920 -7.035 732 HA LEU 82 HA LEU 82 -0.312 -0.151 -7.203 733 HB2 LEU 82 2HB LEU 82 0.027 2.494 -8.681 734 HB3 LEU 82 3HB LEU 82 -1.268 1.350 -8.990 735 HG LEU 82 HG LEU 82 -0.866 2.783 -6.335 736 HD11 LEU 82 1HD1 LEU 82 -1.410 4.403 -8.102 737 HD12 LEU 82 2HD1 LEU 82 -2.738 4.224 -6.961 738 HD13 LEU 82 3HD1 LEU 82 -2.833 3.455 -8.548 739 HD21 LEU 82 3HD2 LEU 82 -3.190 1.127 -7.363 740 HD22 LEU 82 1HD2 LEU 82 -3.139 2.002 -5.831 741 HD23 LEU 82 2HD2 LEU 82 -2.040 0.653 -6.108 742 H GLN 83 H GLN 83 0.318 -1.890 -8.464 743 HA GLN 83 HA GLN 83 2.252 -1.441 -10.659 744 HB2 GLN 83 2HB GLN 83 2.807 -3.267 -9.030 745 HB3 GLN 83 3HB GLN 83 1.347 -4.123 -9.522 746 HG2 GLN 83 2HG GLN 83 2.241 -4.183 -11.882 747 HG3 GLN 83 3HG GLN 83 3.729 -3.445 -11.286 748 HE21 GLN 83 1HE2 GLN 83 4.907 -5.215 -12.056 749 HE22 GLN 83 2HE2 GLN 83 4.883 -6.750 -11.263 750 H ASP 84 H ASP 84 1.399 -1.091 -12.576 751 HA ASP 84 HA ASP 84 -0.573 -2.932 -13.697 752 HB2 ASP 84 2HB ASP 84 -0.923 0.100 -13.757 753 HB3 ASP 84 3HB ASP 84 -1.775 -0.986 -14.841 754 H GLN 85 H GLN 85 -0.215 -3.288 -15.864 755 HA GLN 85 HA GLN 85 2.114 -2.119 -17.169 756 HB2 GLN 85 2HB GLN 85 0.047 -4.039 -18.319 757 HB3 GLN 85 3HB GLN 85 1.634 -3.686 -18.987 758 HG2 GLN 85 2HG GLN 85 1.081 -5.136 -16.378 759 HG3 GLN 85 3HG GLN 85 1.594 -5.881 -17.890 760 HE21 GLN 85 1HE2 GLN 85 2.872 -5.924 -15.253 761 HE22 GLN 85 2HE2 GLN 85 4.461 -5.295 -15.482 762 H ASP 86 H ASP 86 -1.212 -1.434 -16.862 763 HA ASP 86 HA ASP 86 -1.515 -0.027 -19.413 764 HB2 ASP 86 2HB ASP 86 -3.458 -0.430 -17.085 765 HB3 ASP 86 3HB ASP 86 -3.854 0.366 -18.604 766 H GLU 87 H GLU 87 0.026 1.637 -19.111 767 HA GLU 87 HA GLU 87 0.381 3.130 -16.761 768 HB2 GLU 87 2HB GLU 87 1.097 3.829 -19.629 769 HB3 GLU 87 3HB GLU 87 1.689 4.691 -18.211 770 HG2 GLU 87 2HG GLU 87 2.826 2.633 -17.430 771 HG3 GLU 87 3HG GLU 87 2.232 1.778 -18.855 772 H ASN 88 H ASN 88 -1.878 3.569 -19.384 773 HA ASN 88 HA ASN 88 -2.603 6.283 -19.026 774 HB2 ASN 88 2HB ASN 88 -3.182 4.805 -21.003 775 HB3 ASN 88 3HB ASN 88 -4.372 3.986 -20.004 776 HD21 ASN 88 1HD2 ASN 88 -4.802 5.401 -22.488 777 HD22 ASN 88 2HD2 ASN 88 -5.926 6.672 -22.156 778 H GLU 89 H GLU 89 -4.130 3.293 -17.792 779 HA GLU 89 HA GLU 89 -6.116 4.631 -16.198 780 HB2 GLU 89 2HB GLU 89 -5.164 1.740 -16.055 781 HB3 GLU 89 3HB GLU 89 -6.651 2.374 -15.357 782 HG2 GLU 89 2HG GLU 89 -7.495 2.871 -17.637 783 HG3 GLU 89 3HG GLU 89 -6.017 2.206 -18.322 784 H LEU 90 H LEU 90 -3.040 3.041 -15.592 785 HA LEU 90 HA LEU 90 -2.846 3.132 -12.819 786 HB2 LEU 90 2HB LEU 90 -1.338 1.829 -14.236 787 HB3 LEU 90 3HB LEU 90 -0.713 3.287 -14.982 788 HG LEU 90 HG LEU 90 0.441 3.916 -12.928 789 HD11 LEU 90 1HD1 LEU 90 -0.766 1.463 -11.644 790 HD12 LEU 90 2HD1 LEU 90 -1.121 3.153 -11.262 791 HD13 LEU 90 3HD1 LEU 90 0.480 2.498 -10.939 792 HD21 LEU 90 3HD2 LEU 90 2.102 2.109 -12.789 793 HD22 LEU 90 1HD2 LEU 90 1.637 2.423 -14.461 794 HD23 LEU 90 2HD2 LEU 90 0.996 1.009 -13.620 795 H GLU 91 H GLU 91 -2.014 5.578 -15.273 796 HA GLU 91 HA GLU 91 -0.727 7.433 -13.595 797 HB2 GLU 91 2HB GLU 91 -0.573 7.490 -16.066 798 HB3 GLU 91 3HB GLU 91 -2.278 7.927 -16.175 799 HG2 GLU 91 2HG GLU 91 -0.844 9.875 -16.519 800 HG3 GLU 91 3HG GLU 91 -1.822 10.058 -15.066 801 H GLU 92 H GLU 92 -4.100 7.244 -14.726 802 HA GLU 92 HA GLU 92 -5.100 9.542 -13.495 803 HB2 GLU 92 2HB GLU 92 -6.510 6.944 -14.210 804 HB3 GLU 92 3HB GLU 92 -7.351 8.409 -13.716 805 HG2 GLU 92 2HG GLU 92 -5.644 8.055 -16.191 806 HG3 GLU 92 3HG GLU 92 -7.399 8.210 -16.130 807 H PHE 93 H PHE 93 -5.209 6.172 -12.300 808 HA PHE 93 HA PHE 93 -6.581 6.770 -9.902 809 HB2 PHE 93 2HB PHE 93 -6.433 4.500 -11.067 810 HB3 PHE 93 3HB PHE 93 -4.817 4.332 -10.396 811 HD1 PHE 93 HD1 PHE 93 -8.178 5.401 -9.055 812 HD2 PHE 93 HD2 PHE 93 -4.793 2.825 -8.572 813 HE1 PHE 93 HE1 PHE 93 -9.188 4.438 -7.031 814 HE2 PHE 93 HE2 PHE 93 -5.814 1.874 -6.545 815 HZ PHE 93 HZ PHE 93 -8.014 2.675 -5.780 816 H LYS 94 H LYS 94 -3.133 6.634 -10.725 817 HA LYS 94 HA LYS 94 -2.018 6.682 -8.134 818 HB2 LYS 94 2HB LYS 94 -0.777 6.145 -10.256 819 HB3 LYS 94 3HB LYS 94 -0.805 7.842 -10.687 820 HG2 LYS 94 2HG LYS 94 0.485 6.946 -8.107 821 HG3 LYS 94 3HG LYS 94 1.349 6.782 -9.617 822 HD2 LYS 94 2HD LYS 94 0.312 9.402 -8.471 823 HD3 LYS 94 3HD LYS 94 1.976 8.832 -8.362 824 HE2 LYS 94 2HE LYS 94 2.049 8.820 -10.896 825 HE3 LYS 94 3HE LYS 94 0.468 9.605 -10.883 826 HZ1 LYS 94 3HZ LYS 94 1.435 11.443 -9.637 827 HZ2 LYS 94 1HZ LYS 94 2.255 11.219 -11.102 828 HZ3 LYS 94 2HZ LYS 94 2.945 10.689 -9.653 829 H ARG 95 H ARG 95 -2.561 9.391 -10.426 830 HA ARG 95 HA ARG 95 -1.486 11.382 -8.705 831 HB2 ARG 95 2HB ARG 95 -2.323 13.022 -10.368 832 HB3 ARG 95 3HB ARG 95 -1.435 11.697 -11.106 833 HG2 ARG 95 2HG ARG 95 -3.550 10.643 -11.804 834 HG3 ARG 95 3HG ARG 95 -4.457 11.959 -11.056 835 HD2 ARG 95 2HD ARG 95 -4.190 12.183 -13.545 836 HD3 ARG 95 3HD ARG 95 -3.575 13.561 -12.628 837 HE ARG 95 HE ARG 95 -1.655 11.482 -13.398 838 HH11 ARG 95 1HH1 ARG 95 -2.951 14.697 -14.094 839 HH12 ARG 95 2HH1 ARG 95 -1.578 15.169 -15.040 840 HH21 ARG 95 1HH2 ARG 95 0.158 12.150 -14.567 841 HH22 ARG 95 2HH2 ARG 95 0.197 13.718 -15.307 842 H LYS 96 H LYS 96 -4.769 10.213 -9.165 843 HA LYS 96 HA LYS 96 -6.181 12.274 -7.826 844 HB2 LYS 96 2HB LYS 96 -6.849 9.322 -8.199 845 HB3 LYS 96 3HB LYS 96 -7.979 10.500 -7.535 846 HG2 LYS 96 2HG LYS 96 -8.043 11.730 -9.612 847 HG3 LYS 96 3HG LYS 96 -6.743 10.754 -10.298 848 HD2 LYS 96 2HD LYS 96 -8.236 8.755 -10.225 849 HD3 LYS 96 3HD LYS 96 -9.534 9.763 -9.579 850 HE2 LYS 96 2HE LYS 96 -9.491 11.120 -11.658 851 HE3 LYS 96 3HE LYS 96 -8.211 10.081 -12.295 852 HZ1 LYS 96 3HZ LYS 96 -10.411 9.467 -13.130 853 HZ2 LYS 96 1HZ LYS 96 -10.940 9.165 -11.553 854 HZ3 LYS 96 2HZ LYS 96 -9.722 8.212 -12.230 855 H ILE 97 H ILE 97 -4.639 9.309 -6.642 856 HA ILE 97 HA ILE 97 -5.469 9.670 -3.877 857 HB ILE 97 HB ILE 97 -3.482 7.698 -5.090 858 HG12 ILE 97 2HG1 ILE 97 -6.402 7.192 -4.346 859 HG13 ILE 97 3HG1 ILE 97 -5.868 7.562 -5.981 860 HG21 ILE 97 1HG2 ILE 97 -4.846 7.666 -2.368 861 HG22 ILE 97 2HG2 ILE 97 -3.129 7.949 -2.672 862 HG23 ILE 97 3HG2 ILE 97 -3.839 6.373 -3.019 863 HD11 ILE 97 3HD1 ILE 97 -6.212 5.191 -5.659 864 HD12 ILE 97 1HD1 ILE 97 -5.013 5.167 -4.367 865 HD13 ILE 97 2HD1 ILE 97 -4.525 5.545 -6.022 866 H GLU 98 H GLU 98 -2.692 10.389 -5.870 867 HA GLU 98 HA GLU 98 -0.840 11.038 -3.790 868 HB2 GLU 98 2HB GLU 98 -0.080 10.490 -6.052 869 HB3 GLU 98 3HB GLU 98 -0.962 11.857 -6.726 870 HG2 GLU 98 2HG GLU 98 0.511 13.421 -5.573 871 HG3 GLU 98 3HG GLU 98 1.343 12.096 -4.767 872 H SER 99 H SER 99 -3.470 12.702 -5.393 873 HA SER 99 HA SER 99 -2.903 15.352 -4.402 874 HB2 SER 99 2HB SER 99 -4.241 14.909 -6.483 875 HB3 SER 99 3HB SER 99 -5.522 14.223 -5.488 876 HG SER 99 HG SER 99 -6.139 16.273 -5.678 877 H GLN 100 H GLN 100 -4.346 12.480 -3.073 878 HA GLN 100 HA GLN 100 -5.776 13.759 -0.906 879 HB2 GLN 100 2HB GLN 100 -4.777 10.881 -1.011 880 HB3 GLN 100 3HB GLN 100 -6.009 11.527 0.056 881 HG2 GLN 100 2HG GLN 100 -6.273 11.201 -2.942 882 HG3 GLN 100 3HG GLN 100 -6.953 10.133 -1.721 883 HE21 GLN 100 1HE2 GLN 100 -9.092 10.388 -2.203 884 HE22 GLN 100 2HE2 GLN 100 -9.946 11.887 -2.113 885 H GLY 101 H GLY 101 -2.507 13.439 -1.599 886 HA2 GLY 101 2HA GLY 101 -0.740 14.330 -0.376 887 HA3 GLY 101 3HA GLY 101 -1.712 14.271 1.089 888 H TYR 102 H TYR 102 -0.735 11.823 -1.308 889 HA TYR 102 HA TYR 102 0.719 10.315 0.784 890 HB2 TYR 102 2HB TYR 102 -1.227 9.116 -1.250 891 HB3 TYR 102 3HB TYR 102 -0.136 8.160 -0.244 892 HD1 TYR 102 HD1 TYR 102 -0.300 9.124 2.390 893 HD2 TYR 102 HD2 TYR 102 -3.462 8.950 -0.479 894 HE1 TYR 102 HE1 TYR 102 -1.939 9.100 4.211 895 HE2 TYR 102 HE2 TYR 102 -5.109 8.931 1.358 896 HH TYR 102 HH TYR 102 -5.151 8.309 3.793 897 H GLU 103 H GLU 103 2.600 9.326 0.132 898 HA GLU 103 HA GLU 103 3.724 10.013 -2.440 899 HB2 GLU 103 2HB GLU 103 5.186 9.938 -0.463 900 HB3 GLU 103 3HB GLU 103 4.794 8.245 -0.196 901 HG2 GLU 103 2HG GLU 103 7.049 8.595 -1.201 902 HG3 GLU 103 3HG GLU 103 6.003 7.579 -2.191 903 H VAL 104 H VAL 104 2.462 9.069 -3.985 904 HA VAL 104 HA VAL 104 2.022 6.144 -3.929 905 HB VAL 104 HB VAL 104 0.645 8.224 -5.715 906 HG11 VAL 104 1HG1 VAL 104 -0.118 5.344 -5.106 907 HG12 VAL 104 2HG1 VAL 104 0.639 5.909 -6.593 908 HG13 VAL 104 3HG1 VAL 104 -0.985 6.452 -6.173 909 HG21 VAL 104 3HG2 VAL 104 0.103 8.684 -3.345 910 HG22 VAL 104 1HG2 VAL 104 -0.435 7.016 -3.138 911 HG23 VAL 104 2HG2 VAL 104 -1.307 8.098 -4.226 912 H ARG 105 H ARG 105 2.999 4.910 -5.502 913 HA ARG 105 HA ARG 105 4.559 6.333 -7.598 914 HB2 ARG 105 2HB ARG 105 5.697 5.009 -5.496 915 HB3 ARG 105 3HB ARG 105 5.550 3.664 -6.611 916 HG2 ARG 105 2HG ARG 105 7.750 4.601 -6.847 917 HG3 ARG 105 3HG ARG 105 6.844 5.032 -8.303 918 HD2 ARG 105 2HD ARG 105 6.464 7.290 -7.437 919 HD3 ARG 105 3HD ARG 105 7.232 6.865 -5.900 920 HE ARG 105 HE ARG 105 8.936 6.512 -8.204 921 HH11 ARG 105 1HH1 ARG 105 7.845 8.842 -5.772 922 HH12 ARG 105 2HH1 ARG 105 9.246 9.856 -5.953 923 HH21 ARG 105 1HH2 ARG 105 10.728 7.870 -8.449 924 HH22 ARG 105 2HH2 ARG 105 10.884 9.301 -7.479 925 H LYS 106 H LYS 106 4.613 5.459 -9.612 926 HA LYS 106 HA LYS 106 2.727 3.330 -10.331 927 HB2 LYS 106 2HB LYS 106 4.401 5.235 -12.044 928 HB3 LYS 106 3HB LYS 106 3.254 4.056 -12.674 929 HG2 LYS 106 2HG LYS 106 1.391 5.266 -11.625 930 HG3 LYS 106 3HG LYS 106 2.528 6.413 -10.908 931 HD2 LYS 106 2HD LYS 106 1.504 7.404 -12.903 932 HD3 LYS 106 3HD LYS 106 3.227 7.141 -13.177 933 HE2 LYS 106 2HE LYS 106 2.623 5.013 -14.391 934 HE3 LYS 106 3HE LYS 106 0.926 5.477 -14.237 935 HZ1 LYS 106 3HZ LYS 106 1.828 6.128 -16.379 936 HZ2 LYS 106 1HZ LYS 106 3.026 7.054 -15.631 937 HZ3 LYS 106 2HZ LYS 106 1.405 7.498 -15.486 938 H VAL 107 H VAL 107 3.453 1.353 -11.046 939 HA VAL 107 HA VAL 107 6.236 1.055 -11.889 940 HB VAL 107 HB VAL 107 6.346 0.528 -9.507 941 HG11 VAL 107 1HG1 VAL 107 4.247 -1.604 -9.972 942 HG12 VAL 107 2HG1 VAL 107 4.025 -0.110 -9.060 943 HG13 VAL 107 3HG1 VAL 107 5.143 -1.342 -8.473 944 HG21 VAL 107 3HG2 VAL 107 6.538 -1.982 -11.187 945 HG22 VAL 107 1HG2 VAL 107 7.337 -1.703 -9.638 946 HG23 VAL 107 2HG2 VAL 107 7.774 -0.732 -11.039 947 H THR 108 H THR 108 6.498 -0.335 -13.496 948 HA THR 108 HA THR 108 4.206 -1.914 -14.486 949 HB THR 108 HB THR 108 5.570 -1.978 -16.641 950 HG1 THR 108 HG1 THR 108 7.492 -1.065 -16.699 951 HG21 THR 108 3HG2 THR 108 4.897 0.819 -15.634 952 HG22 THR 108 1HG2 THR 108 3.749 -0.302 -16.376 953 HG23 THR 108 2HG2 THR 108 5.089 0.348 -17.322 954 H ASP 109 H ASP 109 7.756 -2.114 -13.938 955 HA ASP 109 HA ASP 109 7.898 -4.932 -14.573 956 HB2 ASP 109 2HB ASP 109 9.973 -3.022 -13.412 957 HB3 ASP 109 3HB ASP 109 10.314 -4.680 -13.877 958 H ASP 110 H ASP 110 8.140 -6.628 -13.175 959 HA ASP 110 HA ASP 110 6.893 -6.405 -10.598 960 HB2 ASP 110 2HB ASP 110 8.375 -8.860 -11.628 961 HB3 ASP 110 3HB ASP 110 7.016 -8.807 -10.514 962 H GLU 111 H GLU 111 10.180 -6.857 -11.756 963 HA GLU 111 HA GLU 111 11.505 -7.288 -9.277 964 HB2 GLU 111 2HB GLU 111 13.564 -6.665 -10.540 965 HB3 GLU 111 3HB GLU 111 12.575 -7.828 -11.414 966 HG2 GLU 111 2HG GLU 111 11.701 -6.049 -12.864 967 HG3 GLU 111 3HG GLU 111 12.606 -4.840 -11.961 968 H GLU 112 H GLU 112 10.520 -4.443 -11.037 969 HA GLU 112 HA GLU 112 11.931 -2.471 -9.519 970 HB2 GLU 112 2HB GLU 112 11.303 -2.181 -11.881 971 HB3 GLU 112 3HB GLU 112 9.599 -2.283 -11.468 972 HG2 GLU 112 2HG GLU 112 9.785 -0.157 -10.222 973 HG3 GLU 112 3HG GLU 112 11.497 -0.066 -10.634 974 H ALA 113 H ALA 113 8.713 -3.955 -9.413 975 HA ALA 113 HA ALA 113 7.437 -2.253 -7.591 976 HB1 ALA 113 3HB ALA 113 7.065 -5.252 -7.915 977 HB2 ALA 113 1HB ALA 113 6.243 -3.994 -8.839 978 HB3 ALA 113 2HB ALA 113 5.945 -4.148 -7.107 979 H LEU 114 H LEU 114 9.365 -5.180 -7.009 980 HA LEU 114 HA LEU 114 9.227 -5.345 -4.221 981 HB2 LEU 114 2HB LEU 114 11.539 -6.121 -6.043 982 HB3 LEU 114 3HB LEU 114 11.326 -6.687 -4.396 983 HG LEU 114 HG LEU 114 9.445 -7.326 -6.707 984 HD11 LEU 114 1HD1 LEU 114 11.527 -9.106 -5.397 985 HD12 LEU 114 2HD1 LEU 114 11.642 -8.388 -7.005 986 HD13 LEU 114 3HD1 LEU 114 10.392 -9.579 -6.664 987 HD21 LEU 114 3HD2 LEU 114 8.427 -8.964 -5.185 988 HD22 LEU 114 1HD2 LEU 114 8.278 -7.325 -4.554 989 HD23 LEU 114 2HD2 LEU 114 9.480 -8.423 -3.876 990 H LYS 115 H LYS 115 11.505 -3.532 -6.291 991 HA LYS 115 HA LYS 115 13.268 -2.843 -4.121 992 HB2 LYS 115 2HB LYS 115 14.674 -1.798 -5.720 993 HB3 LYS 115 3HB LYS 115 14.000 -3.196 -6.541 994 HG2 LYS 115 2HG LYS 115 12.369 -1.700 -7.680 995 HG3 LYS 115 3HG LYS 115 13.125 -0.315 -6.899 996 HD2 LYS 115 2HD LYS 115 14.496 -2.214 -8.841 997 HD3 LYS 115 3HD LYS 115 13.905 -0.599 -9.227 998 HE2 LYS 115 2HE LYS 115 15.522 0.395 -7.671 999 HE3 LYS 115 3HE LYS 115 16.084 -1.213 -7.200 1000 HZ1 LYS 115 3HZ LYS 115 16.307 -0.003 -9.910 1001 HZ2 LYS 115 1HZ LYS 115 16.783 -1.573 -9.505 1002 HZ3 LYS 115 2HZ LYS 115 17.574 -0.254 -8.817 1003 H ILE 116 H ILE 116 10.543 -1.227 -5.730 1004 HA ILE 116 HA ILE 116 11.025 1.359 -4.569 1005 HB ILE 116 HB ILE 116 8.431 0.221 -5.712 1006 HG12 ILE 116 2HG1 ILE 116 10.218 0.382 -7.408 1007 HG13 ILE 116 3HG1 ILE 116 8.958 1.556 -7.735 1008 HG21 ILE 116 1HG2 ILE 116 7.895 2.077 -4.205 1009 HG22 ILE 116 2HG2 ILE 116 7.637 2.563 -5.878 1010 HG23 ILE 116 3HG2 ILE 116 9.073 3.113 -5.014 1011 HD11 ILE 116 3HD1 ILE 116 10.382 3.335 -6.848 1012 HD12 ILE 116 1HD1 ILE 116 11.172 2.454 -8.153 1013 HD13 ILE 116 2HD1 ILE 116 11.643 2.154 -6.482 1014 H VAL 117 H VAL 117 9.243 -1.538 -3.521 1015 HA VAL 117 HA VAL 117 8.015 -0.471 -1.199 1016 HB VAL 117 HB VAL 117 9.116 -3.303 -1.537 1017 HG11 VAL 117 1HG1 VAL 117 6.941 -2.281 0.332 1018 HG12 VAL 117 2HG1 VAL 117 8.562 -2.797 0.805 1019 HG13 VAL 117 3HG1 VAL 117 7.427 -3.969 0.138 1020 HG21 VAL 117 3HG2 VAL 117 7.583 -2.758 -3.374 1021 HG22 VAL 117 1HG2 VAL 117 6.340 -2.284 -2.219 1022 HG23 VAL 117 2HG2 VAL 117 6.879 -3.963 -2.300 1023 H ARG 118 H ARG 118 11.266 -1.778 -1.812 1024 HA ARG 118 HA ARG 118 12.317 -1.729 0.806 1025 HB2 ARG 118 2HB ARG 118 13.824 -1.291 -1.808 1026 HB3 ARG 118 3HB ARG 118 14.547 -1.747 -0.273 1027 HG2 ARG 118 2HG ARG 118 12.668 -3.442 -1.944 1028 HG3 ARG 118 3HG ARG 118 14.406 -3.663 -1.778 1029 HD2 ARG 118 2HD ARG 118 12.333 -4.001 0.410 1030 HD3 ARG 118 3HD ARG 118 13.218 -5.287 -0.414 1031 HE ARG 118 HE ARG 118 14.717 -3.252 1.100 1032 HH11 ARG 118 1HH1 ARG 118 13.707 -6.623 0.838 1033 HH12 ARG 118 2HH1 ARG 118 14.846 -7.166 2.034 1034 HH21 ARG 118 1HH2 ARG 118 16.217 -4.001 2.638 1035 HH22 ARG 118 2HH2 ARG 118 16.258 -5.694 3.047 1036 H GLU 119 H GLU 119 12.216 0.740 -1.753 1037 HA GLU 119 HA GLU 119 13.697 2.776 -0.479 1038 HB2 GLU 119 2HB GLU 119 11.473 3.029 -2.555 1039 HB3 GLU 119 3HB GLU 119 12.588 4.314 -2.112 1040 HG2 GLU 119 2HG GLU 119 13.308 1.702 -3.458 1041 HG3 GLU 119 3HG GLU 119 13.250 3.289 -4.221 1042 H PHE 120 H PHE 120 10.209 2.131 -0.596 1043 HA PHE 120 HA PHE 120 9.256 4.291 0.884 1044 HB2 PHE 120 2HB PHE 120 8.178 1.494 0.398 1045 HB3 PHE 120 3HB PHE 120 7.276 2.654 1.365 1046 HD1 PHE 120 HD2 PHE 120 8.495 4.964 -0.698 1047 HD2 PHE 120 HD1 PHE 120 6.073 1.440 -1.020 1048 HE1 PHE 120 HE2 PHE 120 7.378 5.901 -2.673 1049 HE2 PHE 120 HE1 PHE 120 4.968 2.407 -2.995 1050 HZ PHE 120 HZ PHE 120 5.610 4.632 -3.806 1051 H MET 121 H MET 121 10.138 1.042 2.017 1052 HA MET 121 HA MET 121 9.554 1.454 4.768 1053 HB2 MET 121 2HB MET 121 11.356 -0.573 3.390 1054 HB3 MET 121 3HB MET 121 10.976 -0.620 5.108 1055 HG2 MET 121 2HG MET 121 8.575 -0.878 4.552 1056 HG3 MET 121 3HG MET 121 8.991 -0.898 2.837 1057 HE1 MET 121 3HE MET 121 11.059 -4.217 2.533 1058 HE2 MET 121 1HE MET 121 11.707 -2.594 2.775 1059 HE3 MET 121 2HE MET 121 10.364 -2.857 1.658 1060 H GLN 122 H GLN 122 12.449 2.024 2.830 1061 HA GLN 122 HA GLN 122 14.256 2.540 4.957 1062 HB2 GLN 122 2HB GLN 122 15.021 2.038 2.657 1063 HB3 GLN 122 3HB GLN 122 14.332 3.553 2.079 1064 HG2 GLN 122 2HG GLN 122 15.911 4.812 3.517 1065 HG3 GLN 122 3HG GLN 122 16.608 3.294 4.082 1066 HE21 GLN 122 1HE2 GLN 122 17.907 5.525 2.689 1067 HE22 GLN 122 2HE2 GLN 122 18.594 4.849 1.255 1068 H LYS 123 H LYS 123 12.246 4.682 2.957 1069 HA LYS 123 HA LYS 123 12.996 7.146 4.169 1070 HB2 LYS 123 2HB LYS 123 10.487 6.370 2.614 1071 HB3 LYS 123 3HB LYS 123 10.862 8.019 3.101 1072 HG2 LYS 123 2HG LYS 123 12.926 7.951 1.716 1073 HG3 LYS 123 3HG LYS 123 12.514 6.310 1.208 1074 HD2 LYS 123 2HD LYS 123 10.463 7.132 0.116 1075 HD3 LYS 123 3HD LYS 123 10.793 8.772 0.688 1076 HE2 LYS 123 2HE LYS 123 11.456 8.583 -1.644 1077 HE3 LYS 123 3HE LYS 123 12.896 8.783 -0.649 1078 HZ1 LYS 123 3HZ LYS 123 11.901 6.246 -1.834 1079 HZ2 LYS 123 1HZ LYS 123 13.221 6.355 -0.778 1080 HZ3 LYS 123 2HZ LYS 123 13.280 7.110 -2.289 1081 H ALA 124 H ALA 124 10.310 4.894 4.708 1082 HA ALA 124 HA ALA 124 8.928 6.196 6.763 1083 HB1 ALA 124 3HB ALA 124 9.297 3.205 6.318 1084 HB2 ALA 124 1HB ALA 124 8.065 4.222 5.566 1085 HB3 ALA 124 2HB ALA 124 8.040 3.954 7.310 1086 H GLY 125 H GLY 125 11.696 4.014 6.816 1087 HA2 GLY 125 2HA GLY 125 11.941 3.744 9.647 1088 HA3 GLY 125 3HA GLY 125 13.152 3.317 8.444 1089 H SER 126 H SER 126 13.060 6.110 7.345 1090 HA SER 126 HA SER 126 15.072 7.265 9.094 1091 HB2 SER 126 2HB SER 126 13.992 8.173 6.391 1092 HB3 SER 126 3HB SER 126 15.378 8.878 7.231 1093 HG SER 126 HG SER 126 15.277 6.116 6.605 1094 H LEU 127 H LEU 127 11.699 7.803 8.230 1095 HA LEU 127 HA LEU 127 11.432 10.420 9.387 1096 HB2 LEU 127 2HB LEU 127 9.341 8.296 8.728 1097 HB3 LEU 127 3HB LEU 127 8.944 9.908 9.301 1098 HG LEU 127 HG LEU 127 10.364 9.292 6.679 1099 HD11 LEU 127 1HD1 LEU 127 7.494 10.171 7.141 1100 HD12 LEU 127 2HD1 LEU 127 8.025 8.568 6.626 1101 HD13 LEU 127 3HD1 LEU 127 8.277 9.955 5.570 1102 HD21 LEU 127 3HD2 LEU 127 10.033 11.683 6.159 1103 HD22 LEU 127 1HD2 LEU 127 11.078 11.446 7.559 1104 HD23 LEU 127 2HD2 LEU 127 9.403 11.950 7.786 1105 H GLU 128 H GLU 128 10.628 7.130 10.463 1106 HA GLU 128 HA GLU 128 9.736 7.806 13.072 1107 HB2 GLU 128 2HB GLU 128 10.798 5.160 12.000 1108 HB3 GLU 128 3HB GLU 128 9.913 5.358 13.505 1109 HG2 GLU 128 2HG GLU 128 8.779 6.003 10.773 1110 HG3 GLU 128 3HG GLU 128 8.547 4.475 11.618 1111 H HIS 129 H HIS 129 12.877 6.930 11.742 1112 HA HIS 129 HA HIS 129 14.167 7.340 14.381 1113 HB2 HIS 129 2HB HIS 129 14.996 5.294 12.268 1114 HB3 HIS 129 3HB HIS 129 15.769 5.554 13.831 1115 HD1 HIS 129 HD1 HIS 129 13.119 3.640 12.185 1116 HD2 HIS 129 HD2 HIS 129 14.093 4.731 16.074 1117 HE1 HIS 129 HE1 HIS 129 11.772 2.124 13.671 1118 HE2 HIS 129 HE2 HIS 129 12.229 2.943 16.000 1119 H HIS 130 H HIS 130 14.979 9.348 14.089 1120 HA HIS 130 HA HIS 130 16.107 10.332 11.652 1121 HB2 HIS 130 2HB HIS 130 16.743 12.326 12.927 1122 HB3 HIS 130 3HB HIS 130 15.091 11.866 13.292 1123 HD1 HIS 130 HD1 HIS 130 14.537 11.306 15.736 1124 HD2 HIS 130 HD2 HIS 130 18.582 12.027 15.095 1125 HE1 HIS 130 HE1 HIS 130 15.566 11.488 18.014 1126 HE2 HIS 130 HE2 HIS 130 17.952 12.136 17.598 1127 H HIS 131 H HIS 131 17.377 8.515 14.284 1128 HA HIS 131 HA HIS 131 20.076 8.524 13.048 1129 HB2 HIS 131 2HB HIS 131 19.181 7.749 15.866 1130 HB3 HIS 131 3HB HIS 131 20.784 7.391 15.227 1131 HD1 HIS 131 HD1 HIS 131 20.079 9.329 17.712 1132 HD2 HIS 131 HD2 HIS 131 21.185 10.472 13.867 1133 HE1 HIS 131 HE1 HIS 131 21.044 11.646 17.933 1134 HE2 HIS 131 HE2 HIS 131 21.936 12.177 15.647 1135 H HIS 132 H HIS 132 21.104 6.183 13.533 1136 HA HIS 132 HA HIS 132 19.177 4.038 12.953 1137 HB2 HIS 132 2HB HIS 132 20.002 5.120 10.762 1138 HB3 HIS 132 3HB HIS 132 21.600 4.501 11.151 1139 HD1 HIS 132 HD1 HIS 132 18.281 3.477 9.800 1140 HD2 HIS 132 HD2 HIS 132 21.867 1.670 10.876 1141 HE1 HIS 132 HE1 HIS 132 18.192 1.162 8.836 1142 HE2 HIS 132 HE2 HIS 132 20.367 0.098 9.485 1143 H HIS 133 H HIS 133 19.695 3.422 15.057 1144 HA HIS 133 HA HIS 133 22.246 3.089 16.187 1145 HB2 HIS 133 2HB HIS 133 20.184 3.304 17.531 1146 HB3 HIS 133 3HB HIS 133 19.596 1.761 16.930 1147 HD1 HIS 133 HD1 HIS 133 20.950 -0.401 17.778 1148 HD2 HIS 133 HD2 HIS 133 21.748 3.128 19.825 1149 HE1 HIS 133 HE1 HIS 133 22.069 -1.091 19.903 1150 HE2 HIS 133 HE2 HIS 133 22.431 1.037 21.171 1151 H HIS 134 H HIS 134 23.735 1.563 15.994 1152 HA HIS 134 HA HIS 134 23.051 -1.201 15.310 1153 HB2 HIS 134 2HB HIS 134 24.995 -1.340 13.706 1154 HB3 HIS 134 3HB HIS 134 23.646 -0.382 13.127 1155 HD1 HIS 134 HD1 HIS 134 27.002 -0.334 12.622 1156 HD2 HIS 134 HD2 HIS 134 24.438 2.572 14.129 1157 HE1 HIS 134 HE1 HIS 134 28.145 1.873 12.212 1158 HE2 HIS 134 HE2 HIS 134 26.690 3.560 13.365 Start of MODEL 8 1 H1 MET 1 1H MET 1 1.257 7.361 16.988 2 H2 MET 1 2H MET 1 -0.177 7.393 16.104 3 H3 MET 1 3H MET 1 0.558 8.843 16.563 4 HA MET 1 HA MET 1 0.886 8.337 14.230 5 HB2 MET 1 2HB MET 1 3.382 8.650 14.212 6 HB3 MET 1 3HB MET 1 2.560 9.733 15.323 7 HG2 MET 1 2HG MET 1 3.287 8.465 17.223 8 HG3 MET 1 3HG MET 1 3.907 7.172 16.198 9 HE1 MET 1 3HE MET 1 6.186 7.248 14.898 10 HE2 MET 1 1HE MET 1 7.120 8.725 14.653 11 HE3 MET 1 2HE MET 1 5.532 8.556 13.906 12 H LYS 2 H LYS 2 1.461 6.927 12.637 13 HA LYS 2 HA LYS 2 3.278 4.760 12.997 14 HB2 LYS 2 2HB LYS 2 1.816 2.880 12.418 15 HB3 LYS 2 3HB LYS 2 1.241 3.635 13.899 16 HG2 LYS 2 2HG LYS 2 -0.561 4.747 12.665 17 HG3 LYS 2 3HG LYS 2 0.045 4.088 11.145 18 HD2 LYS 2 2HD LYS 2 -1.869 2.784 11.908 19 HD3 LYS 2 3HD LYS 2 -0.409 1.795 11.950 20 HE2 LYS 2 2HE LYS 2 -0.257 2.250 14.422 21 HE3 LYS 2 3HE LYS 2 -1.813 3.083 14.312 22 HZ1 LYS 2 3HZ LYS 2 -1.760 0.617 14.964 23 HZ2 LYS 2 1HZ LYS 2 -1.507 0.323 13.324 24 HZ3 LYS 2 2HZ LYS 2 -2.905 1.124 13.842 25 H ILE 3 H ILE 3 3.773 3.729 10.908 26 HA ILE 3 HA ILE 3 3.222 5.547 8.628 27 HB ILE 3 HB ILE 3 5.530 3.575 9.006 28 HG12 ILE 3 2HG1 ILE 3 5.553 6.628 9.204 29 HG13 ILE 3 3HG1 ILE 3 5.598 5.535 10.583 30 HG21 ILE 3 1HG2 ILE 3 5.005 3.893 6.639 31 HG22 ILE 3 2HG2 ILE 3 6.512 4.723 7.018 32 HG23 ILE 3 3HG2 ILE 3 5.022 5.647 6.836 33 HD11 ILE 3 3HD1 ILE 3 7.761 4.679 9.831 34 HD12 ILE 3 1HD1 ILE 3 7.786 6.421 10.094 35 HD13 ILE 3 2HD1 ILE 3 7.720 5.783 8.453 36 H LEU 4 H LEU 4 1.952 4.760 7.026 37 HA LEU 4 HA LEU 4 1.312 1.870 6.977 38 HB2 LEU 4 2HB LEU 4 -0.280 4.226 5.878 39 HB3 LEU 4 3HB LEU 4 -0.789 2.538 5.856 40 HG LEU 4 HG LEU 4 -0.471 4.320 8.308 41 HD11 LEU 4 1HD1 LEU 4 -2.927 3.023 7.113 42 HD12 LEU 4 2HD1 LEU 4 -2.505 4.737 7.044 43 HD13 LEU 4 3HD1 LEU 4 -2.865 3.984 8.595 44 HD21 LEU 4 3HD2 LEU 4 -1.281 2.416 9.639 45 HD22 LEU 4 1HD2 LEU 4 0.278 2.078 8.895 46 HD23 LEU 4 2HD2 LEU 4 -1.193 1.373 8.218 47 H ILE 5 H ILE 5 2.562 0.888 5.463 48 HA ILE 5 HA ILE 5 3.131 2.190 2.894 49 HB ILE 5 HB ILE 5 3.811 -0.683 3.680 50 HG12 ILE 5 2HG1 ILE 5 4.812 0.764 5.400 51 HG13 ILE 5 3HG1 ILE 5 6.074 0.112 4.366 52 HG21 ILE 5 1HG2 ILE 5 5.046 1.161 1.600 53 HG22 ILE 5 2HG2 ILE 5 3.985 -0.212 1.278 54 HG23 ILE 5 3HG2 ILE 5 5.590 -0.481 1.964 55 HD11 ILE 5 3HD1 ILE 5 4.967 2.914 4.326 56 HD12 ILE 5 1HD1 ILE 5 6.163 2.288 3.186 57 HD13 ILE 5 2HD1 ILE 5 6.546 2.387 4.902 58 H LEU 6 H LEU 6 1.294 2.281 1.698 59 HA LEU 6 HA LEU 6 -0.707 0.122 1.772 60 HB2 LEU 6 2HB LEU 6 -1.083 2.782 1.972 61 HB3 LEU 6 3HB LEU 6 -1.043 2.709 0.231 62 HG LEU 6 HG LEU 6 -3.344 2.708 0.837 63 HD11 LEU 6 1HD1 LEU 6 -2.716 -0.199 0.282 64 HD12 LEU 6 2HD1 LEU 6 -2.873 1.078 -0.926 65 HD13 LEU 6 3HD1 LEU 6 -4.268 0.614 0.046 66 HD21 LEU 6 3HD2 LEU 6 -2.781 0.514 2.843 67 HD22 LEU 6 1HD2 LEU 6 -4.361 1.218 2.485 68 HD23 LEU 6 2HD2 LEU 6 -3.097 2.213 3.206 69 H ILE 7 H ILE 7 -0.301 -1.447 0.275 70 HA ILE 7 HA ILE 7 0.822 -0.695 -2.373 71 HB ILE 7 HB ILE 7 1.185 -3.332 -0.871 72 HG12 ILE 7 2HG1 ILE 7 3.180 -1.111 -1.528 73 HG13 ILE 7 3HG1 ILE 7 2.562 -1.505 0.072 74 HG21 ILE 7 1HG2 ILE 7 2.676 -4.002 -2.741 75 HG22 ILE 7 2HG2 ILE 7 2.274 -2.511 -3.594 76 HG23 ILE 7 3HG2 ILE 7 1.027 -3.724 -3.304 77 HD11 ILE 7 3HD1 ILE 7 3.694 -3.673 -0.040 78 HD12 ILE 7 1HD1 ILE 7 4.809 -2.319 -0.214 79 HD13 ILE 7 2HD1 ILE 7 4.334 -3.253 -1.632 80 H ASN 8 H ASN 8 -0.532 -0.964 -4.009 81 HA ASN 8 HA ASN 8 -2.717 -2.964 -3.856 82 HB2 ASN 8 2HB ASN 8 -3.434 -0.544 -4.067 83 HB3 ASN 8 3HB ASN 8 -2.597 -0.463 -5.612 84 HD21 ASN 8 1HD2 ASN 8 -3.483 -1.620 -7.396 85 HD22 ASN 8 2HD2 ASN 8 -5.122 -2.168 -7.394 86 H THR 9 H THR 9 -2.257 -4.714 -5.064 87 HA THR 9 HA THR 9 -0.490 -4.454 -7.441 88 HB THR 9 HB THR 9 0.883 -5.456 -5.734 89 HG1 THR 9 HG1 THR 9 1.559 -6.789 -7.211 90 HG21 THR 9 3HG2 THR 9 -1.302 -7.521 -5.290 91 HG22 THR 9 1HG2 THR 9 -0.852 -6.239 -4.166 92 HG23 THR 9 2HG2 THR 9 0.294 -7.531 -4.536 93 H ASN 10 H ASN 10 -0.935 -5.773 -9.195 94 HA ASN 10 HA ASN 10 -3.654 -6.786 -9.417 95 HB2 ASN 10 2HB ASN 10 -1.464 -6.892 -11.526 96 HB3 ASN 10 3HB ASN 10 -3.192 -7.061 -11.788 97 HD21 ASN 10 1HD2 ASN 10 -3.731 -4.698 -9.971 98 HD22 ASN 10 2HD2 ASN 10 -3.283 -3.322 -10.908 99 H ASN 11 H ASN 11 -0.401 -7.989 -9.118 100 HA ASN 11 HA ASN 11 -1.111 -10.708 -10.018 101 HB2 ASN 11 2HB ASN 11 1.622 -9.425 -9.629 102 HB3 ASN 11 3HB ASN 11 1.338 -11.039 -10.276 103 HD21 ASN 11 1HD2 ASN 11 2.581 -8.602 -11.454 104 HD22 ASN 11 2HD2 ASN 11 1.756 -8.355 -12.950 105 H ASP 12 H ASP 12 -1.130 -12.387 -8.738 106 HA ASP 12 HA ASP 12 -1.277 -12.190 -5.944 107 HB2 ASP 12 2HB ASP 12 -2.474 -13.886 -7.306 108 HB3 ASP 12 3HB ASP 12 -0.951 -14.674 -7.682 109 H GLU 13 H GLU 13 1.416 -13.025 -8.057 110 HA GLU 13 HA GLU 13 3.244 -14.259 -6.369 111 HB2 GLU 13 2HB GLU 13 3.787 -12.213 -8.567 112 HB3 GLU 13 3HB GLU 13 5.040 -13.198 -7.810 113 HG2 GLU 13 2HG GLU 13 4.015 -15.233 -8.686 114 HG3 GLU 13 3HG GLU 13 2.685 -14.299 -9.374 115 H LEU 14 H LEU 14 2.658 -10.766 -6.821 116 HA LEU 14 HA LEU 14 4.873 -9.944 -5.235 117 HB2 LEU 14 2HB LEU 14 2.483 -8.417 -6.300 118 HB3 LEU 14 3HB LEU 14 3.683 -7.647 -5.280 119 HG LEU 14 HG LEU 14 4.225 -7.112 -7.549 120 HD11 LEU 14 1HD1 LEU 14 6.132 -7.540 -6.092 121 HD12 LEU 14 2HD1 LEU 14 6.487 -7.944 -7.767 122 HD13 LEU 14 3HD1 LEU 14 6.167 -9.232 -6.603 123 HD21 LEU 14 3HD2 LEU 14 3.006 -8.889 -8.688 124 HD22 LEU 14 1HD2 LEU 14 4.213 -10.074 -8.185 125 HD23 LEU 14 2HD2 LEU 14 4.653 -8.768 -9.290 126 H ILE 15 H ILE 15 1.512 -10.631 -4.444 127 HA ILE 15 HA ILE 15 1.332 -9.373 -1.945 128 HB ILE 15 HB ILE 15 0.066 -12.002 -2.852 129 HG12 ILE 15 2HG1 ILE 15 -0.909 -9.112 -3.001 130 HG13 ILE 15 3HG1 ILE 15 -0.529 -10.172 -4.350 131 HG21 ILE 15 1HG2 ILE 15 -0.755 -10.222 -0.529 132 HG22 ILE 15 2HG2 ILE 15 -0.019 -11.821 -0.401 133 HG23 ILE 15 3HG2 ILE 15 -1.629 -11.648 -1.098 134 HD11 ILE 15 3HD1 ILE 15 -2.905 -9.895 -4.122 135 HD12 ILE 15 1HD1 ILE 15 -2.858 -10.457 -2.452 136 HD13 ILE 15 2HD1 ILE 15 -2.471 -11.567 -3.770 137 H LYS 16 H LYS 16 2.224 -12.765 -2.616 138 HA LYS 16 HA LYS 16 2.989 -13.361 0.061 139 HB2 LYS 16 2HB LYS 16 3.754 -15.540 -0.904 140 HB3 LYS 16 3HB LYS 16 2.102 -15.104 -1.336 141 HG2 LYS 16 2HG LYS 16 3.084 -14.205 -3.543 142 HG3 LYS 16 3HG LYS 16 4.568 -15.056 -3.104 143 HD2 LYS 16 2HD LYS 16 1.821 -16.322 -3.466 144 HD3 LYS 16 3HD LYS 16 3.131 -16.364 -4.646 145 HE2 LYS 16 2HE LYS 16 4.498 -17.705 -3.122 146 HE3 LYS 16 3HE LYS 16 3.259 -17.592 -1.867 147 HZ1 LYS 16 3HZ LYS 16 1.743 -18.807 -3.277 148 HZ2 LYS 16 1HZ LYS 16 3.162 -19.697 -3.069 149 HZ3 LYS 16 2HZ LYS 16 2.884 -18.883 -4.521 150 H LYS 17 H LYS 17 4.844 -12.390 -2.809 151 HA LYS 17 HA LYS 17 7.423 -13.029 -1.723 152 HB2 LYS 17 2HB LYS 17 6.625 -11.378 -4.149 153 HB3 LYS 17 3HB LYS 17 8.296 -11.757 -3.727 154 HG2 LYS 17 2HG LYS 17 7.798 -14.178 -3.950 155 HG3 LYS 17 3HG LYS 17 6.131 -13.790 -4.385 156 HD2 LYS 17 2HD LYS 17 7.384 -14.259 -6.415 157 HD3 LYS 17 3HD LYS 17 6.970 -12.544 -6.381 158 HE2 LYS 17 2HE LYS 17 9.248 -11.978 -5.663 159 HE3 LYS 17 3HE LYS 17 9.669 -13.690 -5.572 160 HZ1 LYS 17 3HZ LYS 17 9.380 -13.879 -7.934 161 HZ2 LYS 17 1HZ LYS 17 10.453 -12.615 -7.608 162 HZ3 LYS 17 2HZ LYS 17 8.858 -12.280 -8.055 163 H ILE 18 H ILE 18 5.597 -9.964 -2.060 164 HA ILE 18 HA ILE 18 7.534 -8.235 -0.927 165 HB ILE 18 HB ILE 18 4.498 -8.012 -1.060 166 HG12 ILE 18 2HG1 ILE 18 6.657 -6.407 -2.517 167 HG13 ILE 18 3HG1 ILE 18 5.814 -7.794 -3.196 168 HG21 ILE 18 1HG2 ILE 18 5.146 -6.762 0.943 169 HG22 ILE 18 2HG2 ILE 18 4.644 -5.650 -0.330 170 HG23 ILE 18 3HG2 ILE 18 6.360 -5.872 0.022 171 HD11 ILE 18 3HD1 ILE 18 4.537 -5.169 -2.417 172 HD12 ILE 18 1HD1 ILE 18 3.692 -6.572 -3.081 173 HD13 ILE 18 2HD1 ILE 18 4.896 -5.726 -4.051 174 H LYS 19 H LYS 19 5.000 -10.306 0.545 175 HA LYS 19 HA LYS 19 5.342 -9.483 3.223 176 HB2 LYS 19 2HB LYS 19 4.406 -12.144 2.076 177 HB3 LYS 19 3HB LYS 19 4.432 -11.813 3.810 178 HG2 LYS 19 2HG LYS 19 2.981 -9.792 3.346 179 HG3 LYS 19 3HG LYS 19 2.814 -10.368 1.692 180 HD2 LYS 19 2HD LYS 19 1.987 -11.957 4.152 181 HD3 LYS 19 3HD LYS 19 0.893 -10.925 3.231 182 HE2 LYS 19 2HE LYS 19 1.356 -12.354 1.214 183 HE3 LYS 19 3HE LYS 19 2.289 -13.438 2.256 184 HZ1 LYS 19 3HZ LYS 19 0.316 -13.822 3.576 185 HZ2 LYS 19 1HZ LYS 19 -0.005 -14.184 1.957 186 HZ3 LYS 19 2HZ LYS 19 -0.578 -12.742 2.634 187 H LYS 20 H LYS 20 7.223 -11.817 1.292 188 HA LYS 20 HA LYS 20 8.845 -12.836 3.397 189 HB2 LYS 20 2HB LYS 20 9.627 -12.532 0.463 190 HB3 LYS 20 3HB LYS 20 10.380 -13.611 1.635 191 HG2 LYS 20 2HG LYS 20 7.547 -13.815 0.564 192 HG3 LYS 20 3HG LYS 20 8.914 -14.821 0.079 193 HD2 LYS 20 2HD LYS 20 9.037 -15.727 2.404 194 HD3 LYS 20 3HD LYS 20 7.649 -14.730 2.854 195 HE2 LYS 20 2HE LYS 20 6.241 -15.949 1.241 196 HE3 LYS 20 3HE LYS 20 7.627 -16.925 0.750 197 HZ1 LYS 20 3HZ LYS 20 7.759 -17.809 2.986 198 HZ2 LYS 20 1HZ LYS 20 6.222 -18.089 2.339 199 HZ3 LYS 20 2HZ LYS 20 6.450 -16.861 3.472 200 H GLU 21 H GLU 21 9.553 -10.380 0.937 201 HA GLU 21 HA GLU 21 11.947 -9.323 1.666 202 HB2 GLU 21 2HB GLU 21 9.538 -7.673 0.777 203 HB3 GLU 21 3HB GLU 21 11.223 -7.174 0.643 204 HG2 GLU 21 2HG GLU 21 9.934 -9.505 -0.812 205 HG3 GLU 21 3HG GLU 21 10.273 -7.924 -1.507 206 H VAL 22 H VAL 22 8.829 -8.305 3.014 207 HA VAL 22 HA VAL 22 10.078 -6.269 4.695 208 HB VAL 22 HB VAL 22 7.874 -5.423 5.082 209 HG11 VAL 22 1HG1 VAL 22 8.077 -6.361 2.202 210 HG12 VAL 22 2HG1 VAL 22 8.803 -4.902 2.876 211 HG13 VAL 22 3HG1 VAL 22 7.053 -5.049 2.777 212 HG21 VAL 22 3HG2 VAL 22 6.642 -7.487 5.546 213 HG22 VAL 22 1HG2 VAL 22 6.778 -7.982 3.857 214 HG23 VAL 22 2HG2 VAL 22 5.806 -6.573 4.291 215 H GLU 23 H GLU 23 9.107 -9.531 5.031 216 HA GLU 23 HA GLU 23 8.390 -9.766 7.728 217 HB2 GLU 23 2HB GLU 23 8.295 -11.655 6.126 218 HB3 GLU 23 3HB GLU 23 10.047 -11.660 6.003 219 HG2 GLU 23 2HG GLU 23 9.411 -13.496 7.405 220 HG3 GLU 23 3HG GLU 23 10.178 -12.288 8.431 221 H ASN 24 H ASN 24 11.565 -9.702 6.174 222 HA ASN 24 HA ASN 24 13.175 -10.115 8.474 223 HB2 ASN 24 2HB ASN 24 14.018 -8.681 5.910 224 HB3 ASN 24 3HB ASN 24 15.068 -9.512 7.058 225 HD21 ASN 24 1HD2 ASN 24 12.815 -9.889 4.436 226 HD22 ASN 24 2HD2 ASN 24 13.129 -11.563 4.137 227 H GLN 25 H GLN 25 11.719 -7.296 7.035 228 HA GLN 25 HA GLN 25 13.312 -5.368 8.562 229 HB2 GLN 25 2HB GLN 25 11.131 -4.933 6.471 230 HB3 GLN 25 3HB GLN 25 12.146 -3.671 7.178 231 HG2 GLN 25 2HG GLN 25 13.134 -5.983 5.474 232 HG3 GLN 25 3HG GLN 25 12.895 -4.333 4.919 233 HE21 GLN 25 1HE2 GLN 25 14.026 -3.034 7.255 234 HE22 GLN 25 2HE2 GLN 25 15.726 -3.325 7.202 235 H GLY 26 H GLY 26 10.642 -7.199 9.235 236 HA2 GLY 26 2HA GLY 26 9.147 -7.164 10.940 237 HA3 GLY 26 3HA GLY 26 9.965 -5.747 11.558 238 H TYR 27 H TYR 27 8.392 -5.806 8.390 239 HA TYR 27 HA TYR 27 6.507 -3.734 9.286 240 HB2 TYR 27 2HB TYR 27 7.333 -4.706 6.530 241 HB3 TYR 27 3HB TYR 27 5.908 -3.698 6.744 242 HD1 TYR 27 HD2 TYR 27 9.395 -3.633 8.163 243 HD2 TYR 27 HD1 TYR 27 6.357 -1.468 6.079 244 HE1 TYR 27 HE2 TYR 27 10.806 -1.637 8.197 245 HE2 TYR 27 HE1 TYR 27 7.784 0.542 6.112 246 HH TYR 27 HH TYR 27 11.076 0.468 6.947 247 H GLN 28 H GLN 28 4.623 -4.333 10.047 248 HA GLN 28 HA GLN 28 3.656 -7.024 9.956 249 HB2 GLN 28 2HB GLN 28 2.138 -4.561 10.914 250 HB3 GLN 28 3HB GLN 28 1.849 -6.237 11.377 251 HG2 GLN 28 2HG GLN 28 4.037 -6.251 12.558 252 HG3 GLN 28 3HG GLN 28 4.273 -4.560 12.111 253 HE21 GLN 28 1HE2 GLN 28 4.329 -3.870 14.280 254 HE22 GLN 28 2HE2 GLN 28 2.918 -3.830 15.278 255 H VAL 29 H VAL 29 2.886 -7.740 8.028 256 HA VAL 29 HA VAL 29 1.433 -6.039 6.202 257 HB VAL 29 HB VAL 29 1.856 -9.053 6.030 258 HG11 VAL 29 1HG1 VAL 29 1.324 -8.761 3.619 259 HG12 VAL 29 2HG1 VAL 29 0.984 -7.054 3.897 260 HG13 VAL 29 3HG1 VAL 29 -0.037 -8.290 4.636 261 HG21 VAL 29 3HG2 VAL 29 3.450 -6.795 4.758 262 HG22 VAL 29 1HG2 VAL 29 3.693 -8.522 4.465 263 HG23 VAL 29 2HG2 VAL 29 4.003 -7.846 6.067 264 H ARG 30 H ARG 30 -0.685 -5.867 6.000 265 HA ARG 30 HA ARG 30 -2.535 -7.756 7.324 266 HB2 ARG 30 2HB ARG 30 -3.166 -4.855 6.599 267 HB3 ARG 30 3HB ARG 30 -4.053 -5.916 7.690 268 HG2 ARG 30 2HG ARG 30 -1.315 -4.696 8.213 269 HG3 ARG 30 3HG ARG 30 -2.842 -4.105 8.866 270 HD2 ARG 30 2HD ARG 30 -1.607 -6.818 9.469 271 HD3 ARG 30 3HD ARG 30 -1.531 -5.396 10.516 272 HE ARG 30 HE ARG 30 -4.169 -6.393 9.740 273 HH11 ARG 30 1HH1 ARG 30 -1.762 -6.115 12.287 274 HH12 ARG 30 2HH1 ARG 30 -2.878 -6.535 13.544 275 HH21 ARG 30 1HH2 ARG 30 -5.608 -6.970 11.383 276 HH22 ARG 30 2HH2 ARG 30 -5.068 -7.023 13.034 277 H ASP 31 H ASP 31 -3.162 -9.063 5.659 278 HA ASP 31 HA ASP 31 -3.356 -8.156 2.900 279 HB2 ASP 31 2HB ASP 31 -4.022 -10.851 4.183 280 HB3 ASP 31 3HB ASP 31 -4.152 -10.523 2.458 281 H VAL 32 H VAL 32 -5.074 -7.191 2.128 282 HA VAL 32 HA VAL 32 -7.761 -7.627 3.300 283 HB VAL 32 HB VAL 32 -6.696 -5.189 1.782 284 HG11 VAL 32 1HG1 VAL 32 -8.877 -4.121 2.261 285 HG12 VAL 32 2HG1 VAL 32 -9.462 -5.622 2.982 286 HG13 VAL 32 3HG1 VAL 32 -9.077 -5.562 1.262 287 HG21 VAL 32 3HG2 VAL 32 -6.981 -3.965 3.915 288 HG22 VAL 32 1HG2 VAL 32 -5.838 -5.301 4.097 289 HG23 VAL 32 2HG2 VAL 32 -7.487 -5.457 4.715 290 H ASN 33 H ASN 33 -8.794 -9.066 2.081 291 HA ASN 33 HA ASN 33 -8.493 -9.144 -0.852 292 HB2 ASN 33 2HB ASN 33 -9.763 -11.167 1.059 293 HB3 ASN 33 3HB ASN 33 -9.562 -11.382 -0.676 294 HD21 ASN 33 1HD2 ASN 33 -8.411 -13.298 -0.332 295 HD22 ASN 33 2HD2 ASN 33 -6.783 -13.299 0.239 296 H ASP 34 H ASP 34 -10.720 -8.339 1.683 297 HA ASP 34 HA ASP 34 -13.001 -8.055 -0.153 298 HB2 ASP 34 2HB ASP 34 -13.171 -10.349 0.796 299 HB3 ASP 34 3HB ASP 34 -13.057 -9.697 2.427 300 H SER 35 H SER 35 -14.740 -6.760 0.769 301 HA SER 35 HA SER 35 -14.185 -4.408 2.024 302 HB2 SER 35 2HB SER 35 -16.655 -4.302 2.512 303 HB3 SER 35 3HB SER 35 -16.281 -4.790 0.857 304 HG SER 35 HG SER 35 -16.409 -7.043 2.020 305 H ASP 36 H ASP 36 -15.358 -7.394 3.668 306 HA ASP 36 HA ASP 36 -15.426 -6.444 6.304 307 HB2 ASP 36 2HB ASP 36 -15.105 -9.200 5.107 308 HB3 ASP 36 3HB ASP 36 -14.816 -9.013 6.830 309 H GLU 37 H GLU 37 -12.746 -7.938 4.474 310 HA GLU 37 HA GLU 37 -10.852 -8.159 6.536 311 HB2 GLU 37 2HB GLU 37 -10.318 -7.652 3.578 312 HB3 GLU 37 3HB GLU 37 -9.134 -8.253 4.742 313 HG2 GLU 37 2HG GLU 37 -11.652 -9.684 3.828 314 HG3 GLU 37 3HG GLU 37 -10.006 -10.051 3.321 315 H LEU 38 H LEU 38 -11.474 -5.500 4.257 316 HA LEU 38 HA LEU 38 -9.579 -3.611 5.044 317 HB2 LEU 38 2HB LEU 38 -10.915 -3.319 3.066 318 HB3 LEU 38 3HB LEU 38 -12.405 -3.340 3.971 319 HG LEU 38 HG LEU 38 -10.487 -1.062 4.514 320 HD11 LEU 38 1HD1 LEU 38 -10.524 -1.195 2.072 321 HD12 LEU 38 2HD1 LEU 38 -11.369 0.237 2.656 322 HD13 LEU 38 3HD1 LEU 38 -12.292 -1.160 2.088 323 HD21 LEU 38 3HD2 LEU 38 -12.526 0.251 4.829 324 HD22 LEU 38 1HD2 LEU 38 -12.630 -1.219 5.802 325 HD23 LEU 38 2HD2 LEU 38 -13.525 -1.099 4.282 326 H LYS 39 H LYS 39 -12.928 -4.015 6.174 327 HA LYS 39 HA LYS 39 -12.989 -1.941 8.054 328 HB2 LYS 39 2HB LYS 39 -14.637 -4.498 7.862 329 HB3 LYS 39 3HB LYS 39 -15.035 -3.158 8.940 330 HG2 LYS 39 2HG LYS 39 -15.533 -1.695 7.127 331 HG3 LYS 39 3HG LYS 39 -14.755 -2.752 5.948 332 HD2 LYS 39 2HD LYS 39 -17.197 -2.892 5.732 333 HD3 LYS 39 3HD LYS 39 -16.526 -4.436 6.250 334 HE2 LYS 39 2HE LYS 39 -17.225 -3.958 8.574 335 HE3 LYS 39 3HE LYS 39 -17.886 -2.406 8.056 336 HZ1 LYS 39 3HZ LYS 39 -19.559 -4.188 8.273 337 HZ2 LYS 39 1HZ LYS 39 -18.807 -5.037 7.018 338 HZ3 LYS 39 2HZ LYS 39 -19.503 -3.523 6.724 339 H LYS 40 H LYS 40 -11.897 -5.286 8.363 340 HA LYS 40 HA LYS 40 -11.799 -5.433 11.205 341 HB2 LYS 40 2HB LYS 40 -10.187 -7.039 9.175 342 HB3 LYS 40 3HB LYS 40 -10.390 -7.450 10.874 343 HG2 LYS 40 2HG LYS 40 -12.600 -7.388 8.804 344 HG3 LYS 40 3HG LYS 40 -11.765 -8.836 9.347 345 HD2 LYS 40 2HD LYS 40 -12.669 -8.444 11.645 346 HD3 LYS 40 3HD LYS 40 -13.531 -7.022 11.048 347 HE2 LYS 40 2HE LYS 40 -14.867 -8.432 9.548 348 HE3 LYS 40 3HE LYS 40 -13.959 -9.861 10.046 349 HZ1 LYS 40 3HZ LYS 40 -15.691 -8.203 11.803 350 HZ2 LYS 40 1HZ LYS 40 -14.806 -9.555 12.299 351 HZ3 LYS 40 2HZ LYS 40 -16.071 -9.729 11.190 352 H GLU 41 H GLU 41 -9.287 -4.808 8.714 353 HA GLU 41 HA GLU 41 -7.144 -4.615 10.614 354 HB2 GLU 41 2HB GLU 41 -7.071 -3.668 7.718 355 HB3 GLU 41 3HB GLU 41 -5.702 -4.144 8.722 356 HG2 GLU 41 2HG GLU 41 -7.882 -5.974 7.653 357 HG3 GLU 41 3HG GLU 41 -6.232 -5.852 7.046 358 H MET 42 H MET 42 -9.260 -2.241 9.070 359 HA MET 42 HA MET 42 -7.736 0.082 9.747 360 HB2 MET 42 2HB MET 42 -10.696 -0.142 9.042 361 HB3 MET 42 3HB MET 42 -9.801 1.367 9.172 362 HG2 MET 42 2HG MET 42 -9.368 -0.832 7.136 363 HG3 MET 42 3HG MET 42 -9.998 0.788 6.838 364 HE1 MET 42 3HE MET 42 -8.448 3.013 6.931 365 HE2 MET 42 1HE MET 42 -6.769 2.968 7.464 366 HE3 MET 42 2HE MET 42 -8.065 2.609 8.607 367 H LYS 43 H LYS 43 -10.094 -1.874 11.490 368 HA LYS 43 HA LYS 43 -10.583 -0.120 13.668 369 HB2 LYS 43 2HB LYS 43 -10.490 -3.171 13.701 370 HB3 LYS 43 3HB LYS 43 -11.104 -2.173 15.015 371 HG2 LYS 43 2HG LYS 43 -12.268 -2.442 12.246 372 HG3 LYS 43 3HG LYS 43 -12.949 -3.071 13.741 373 HD2 LYS 43 2HD LYS 43 -13.407 -0.818 14.543 374 HD3 LYS 43 3HD LYS 43 -12.549 -0.101 13.174 375 HE2 LYS 43 2HE LYS 43 -14.988 0.029 12.850 376 HE3 LYS 43 3HE LYS 43 -14.248 -1.000 11.629 377 HZ1 LYS 43 3HZ LYS 43 -15.633 -1.966 14.066 378 HZ2 LYS 43 1HZ LYS 43 -14.971 -2.939 12.855 379 HZ3 LYS 43 2HZ LYS 43 -16.290 -1.941 12.515 380 H LYS 44 H LYS 44 -8.037 -2.505 13.052 381 HA LYS 44 HA LYS 44 -6.732 -2.311 15.581 382 HB2 LYS 44 2HB LYS 44 -5.746 -3.321 12.874 383 HB3 LYS 44 3HB LYS 44 -4.784 -3.419 14.345 384 HG2 LYS 44 2HG LYS 44 -7.442 -4.792 13.843 385 HG3 LYS 44 3HG LYS 44 -5.847 -5.555 13.878 386 HD2 LYS 44 2HD LYS 44 -7.244 -4.213 16.239 387 HD3 LYS 44 3HD LYS 44 -7.076 -5.951 15.983 388 HE2 LYS 44 2HE LYS 44 -4.624 -5.752 16.203 389 HE3 LYS 44 3HE LYS 44 -4.776 -4.007 16.427 390 HZ1 LYS 44 3HZ LYS 44 -5.866 -6.099 18.230 391 HZ2 LYS 44 1HZ LYS 44 -6.072 -4.434 18.432 392 HZ3 LYS 44 2HZ LYS 44 -4.526 -5.112 18.533 393 H LEU 45 H LEU 45 -6.461 -0.483 12.586 394 HA LEU 45 HA LEU 45 -4.062 0.899 13.272 395 HB2 LEU 45 2HB LEU 45 -6.251 1.685 11.309 396 HB3 LEU 45 3HB LEU 45 -4.662 2.440 11.419 397 HG LEU 45 HG LEU 45 -5.280 -0.410 10.534 398 HD11 LEU 45 1HD1 LEU 45 -4.300 0.253 8.396 399 HD12 LEU 45 2HD1 LEU 45 -4.074 1.900 8.997 400 HD13 LEU 45 3HD1 LEU 45 -5.701 1.240 8.808 401 HD21 LEU 45 3HD2 LEU 45 -3.236 -0.444 11.879 402 HD22 LEU 45 1HD2 LEU 45 -2.540 0.844 10.893 403 HD23 LEU 45 2HD2 LEU 45 -2.881 -0.736 10.182 404 H ALA 46 H ALA 46 -7.528 1.642 13.589 405 HA ALA 46 HA ALA 46 -7.208 4.287 14.633 406 HB1 ALA 46 3HB ALA 46 -9.207 3.568 13.392 407 HB2 ALA 46 1HB ALA 46 -9.636 4.187 14.989 408 HB3 ALA 46 2HB ALA 46 -9.617 2.445 14.690 409 H GLU 47 H GLU 47 -7.458 1.127 16.123 410 HA GLU 47 HA GLU 47 -8.047 2.148 18.808 411 HB2 GLU 47 2HB GLU 47 -7.884 -0.635 17.595 412 HB3 GLU 47 3HB GLU 47 -8.041 -0.407 19.331 413 HG2 GLU 47 2HG GLU 47 -10.166 0.779 19.001 414 HG3 GLU 47 3HG GLU 47 -10.004 0.607 17.250 415 H GLU 48 H GLU 48 -5.369 0.657 17.050 416 HA GLU 48 HA GLU 48 -3.777 0.444 19.557 417 HB2 GLU 48 2HB GLU 48 -4.516 -1.777 18.750 418 HB3 GLU 48 3HB GLU 48 -3.842 -1.452 17.161 419 HG2 GLU 48 2HG GLU 48 -1.579 -1.509 18.053 420 HG3 GLU 48 3HG GLU 48 -2.193 -1.660 19.700 421 H LYS 49 H LYS 49 -2.703 2.398 19.272 422 HA LYS 49 HA LYS 49 -1.114 2.797 16.801 423 HB2 LYS 49 2HB LYS 49 -1.933 4.865 18.889 424 HB3 LYS 49 3HB LYS 49 -0.875 5.183 17.526 425 HG2 LYS 49 2HG LYS 49 -2.960 6.044 16.872 426 HG3 LYS 49 3HG LYS 49 -2.822 4.513 16.009 427 HD2 LYS 49 2HD LYS 49 -5.088 4.770 16.875 428 HD3 LYS 49 3HD LYS 49 -4.288 3.441 17.716 429 HE2 LYS 49 2HE LYS 49 -3.849 4.946 19.644 430 HE3 LYS 49 3HE LYS 49 -4.668 6.259 18.788 431 HZ1 LYS 49 3HZ LYS 49 -5.916 3.699 19.629 432 HZ2 LYS 49 1HZ LYS 49 -6.694 4.946 18.792 433 HZ3 LYS 49 2HZ LYS 49 -6.137 5.201 20.363 434 H ASN 50 H ASN 50 0.396 1.205 17.609 435 HA ASN 50 HA ASN 50 2.345 2.240 19.569 436 HB2 ASN 50 2HB ASN 50 2.419 -0.333 17.909 437 HB3 ASN 50 3HB ASN 50 3.546 0.101 19.186 438 HD21 ASN 50 1HD2 ASN 50 3.113 -1.711 20.442 439 HD22 ASN 50 2HD2 ASN 50 1.597 -1.978 21.231 440 H PHE 51 H PHE 51 4.766 1.895 18.593 441 HA PHE 51 HA PHE 51 5.007 3.466 16.145 442 HB2 PHE 51 2HB PHE 51 7.135 2.175 17.909 443 HB3 PHE 51 3HB PHE 51 7.476 3.224 16.534 444 HD1 PHE 51 HD1 PHE 51 6.279 5.581 16.590 445 HD2 PHE 51 HD2 PHE 51 7.013 3.173 20.058 446 HE1 PHE 51 HE1 PHE 51 6.107 7.571 18.018 447 HE2 PHE 51 HE2 PHE 51 6.830 5.175 21.473 448 HZ PHE 51 HZ PHE 51 6.382 7.369 20.451 449 H GLU 52 H GLU 52 3.728 1.844 15.019 450 HA GLU 52 HA GLU 52 5.132 -0.636 14.231 451 HB2 GLU 52 2HB GLU 52 2.776 -1.548 13.902 452 HB3 GLU 52 3HB GLU 52 3.211 -1.195 15.571 453 HG2 GLU 52 2HG GLU 52 1.972 0.961 15.405 454 HG3 GLU 52 3HG GLU 52 1.481 0.527 13.768 455 H LYS 53 H LYS 53 5.830 -0.546 12.232 456 HA LYS 53 HA LYS 53 4.668 1.119 10.151 457 HB2 LYS 53 2HB LYS 53 6.992 -0.857 10.156 458 HB3 LYS 53 3HB LYS 53 6.420 -0.082 8.688 459 HG2 LYS 53 2HG LYS 53 8.358 1.110 9.465 460 HG3 LYS 53 3HG LYS 53 6.949 2.147 9.673 461 HD2 LYS 53 2HD LYS 53 8.424 2.340 11.613 462 HD3 LYS 53 3HD LYS 53 6.905 1.585 12.097 463 HE2 LYS 53 2HE LYS 53 8.070 -0.660 11.912 464 HE3 LYS 53 3HE LYS 53 9.579 0.217 11.647 465 HZ1 LYS 53 3HZ LYS 53 9.308 -0.419 13.953 466 HZ2 LYS 53 1HZ LYS 53 7.855 0.440 14.054 467 HZ3 LYS 53 2HZ LYS 53 9.309 1.263 13.797 468 H ILE 54 H ILE 54 2.758 0.437 9.418 469 HA ILE 54 HA ILE 54 2.122 -2.441 9.272 470 HB ILE 54 HB ILE 54 0.297 0.004 9.249 471 HG12 ILE 54 2HG1 ILE 54 1.316 -0.446 11.480 472 HG13 ILE 54 3HG1 ILE 54 -0.427 -0.689 11.494 473 HG21 ILE 54 1HG2 ILE 54 -0.457 -2.933 9.206 474 HG22 ILE 54 2HG2 ILE 54 -0.686 -1.773 7.896 475 HG23 ILE 54 3HG2 ILE 54 -1.591 -1.594 9.400 476 HD11 ILE 54 3HD1 ILE 54 0.724 -2.379 12.771 477 HD12 ILE 54 1HD1 ILE 54 1.665 -2.855 11.361 478 HD13 ILE 54 2HD1 ILE 54 -0.085 -3.109 11.387 479 H LEU 55 H LEU 55 2.448 -3.247 7.293 480 HA LEU 55 HA LEU 55 2.067 -1.627 4.876 481 HB2 LEU 55 2HB LEU 55 4.099 -3.112 5.245 482 HB3 LEU 55 3HB LEU 55 3.039 -4.502 5.130 483 HG LEU 55 HG LEU 55 3.162 -2.518 2.838 484 HD11 LEU 55 1HD1 LEU 55 5.493 -3.056 3.327 485 HD12 LEU 55 2HD1 LEU 55 4.977 -3.761 1.796 486 HD13 LEU 55 3HD1 LEU 55 5.128 -4.781 3.232 487 HD21 LEU 55 3HD2 LEU 55 2.617 -4.470 1.451 488 HD22 LEU 55 1HD2 LEU 55 1.427 -4.263 2.734 489 HD23 LEU 55 2HD2 LEU 55 2.663 -5.516 2.875 490 H ILE 56 H ILE 56 0.067 -1.652 3.973 491 HA ILE 56 HA ILE 56 -1.773 -3.911 4.477 492 HB ILE 56 HB ILE 56 -2.413 -1.254 3.112 493 HG12 ILE 56 2HG1 ILE 56 -1.772 -0.893 5.551 494 HG13 ILE 56 3HG1 ILE 56 -3.413 -0.393 5.155 495 HG21 ILE 56 1HG2 ILE 56 -4.233 -3.435 4.193 496 HG22 ILE 56 2HG2 ILE 56 -3.941 -3.054 2.495 497 HG23 ILE 56 3HG2 ILE 56 -4.779 -1.897 3.524 498 HD11 ILE 56 3HD1 ILE 56 -4.276 -2.429 6.193 499 HD12 ILE 56 1HD1 ILE 56 -3.300 -1.470 7.305 500 HD13 ILE 56 2HD1 ILE 56 -2.625 -2.927 6.579 501 H ILE 57 H ILE 57 -2.135 -5.358 2.808 502 HA ILE 57 HA ILE 57 -1.392 -4.604 0.040 503 HB ILE 57 HB ILE 57 -1.863 -7.385 1.221 504 HG12 ILE 57 2HG1 ILE 57 0.673 -6.034 0.174 505 HG13 ILE 57 3HG1 ILE 57 0.313 -6.404 1.857 506 HG21 ILE 57 1HG2 ILE 57 -1.224 -8.271 -1.013 507 HG22 ILE 57 2HG2 ILE 57 -1.169 -6.624 -1.644 508 HG23 ILE 57 3HG2 ILE 57 -2.700 -7.308 -1.093 509 HD11 ILE 57 3HD1 ILE 57 1.908 -7.964 0.958 510 HD12 ILE 57 1HD1 ILE 57 0.802 -8.415 -0.341 511 HD13 ILE 57 2HD1 ILE 57 0.403 -8.798 1.338 512 H SER 58 H SER 58 -2.995 -4.080 -1.259 513 HA SER 58 HA SER 58 -5.754 -5.039 -0.798 514 HB2 SER 58 2HB SER 58 -5.524 -2.606 -0.285 515 HB3 SER 58 3HB SER 58 -4.862 -2.318 -1.892 516 HG SER 58 HG SER 58 -6.805 -2.404 -2.703 517 H ASN 59 H ASN 59 -6.437 -6.285 -2.474 518 HA ASN 59 HA ASN 59 -4.918 -6.345 -4.987 519 HB2 ASN 59 2HB ASN 59 -5.695 -8.424 -3.616 520 HB3 ASN 59 3HB ASN 59 -7.294 -8.119 -4.277 521 HD21 ASN 59 1HD2 ASN 59 -5.656 -10.448 -4.613 522 HD22 ASN 59 2HD2 ASN 59 -5.372 -10.637 -6.306 523 H ASP 60 H ASP 60 -7.499 -4.627 -3.782 524 HA ASP 60 HA ASP 60 -8.722 -4.210 -6.459 525 HB2 ASP 60 2HB ASP 60 -10.141 -5.740 -5.173 526 HB3 ASP 60 3HB ASP 60 -10.153 -4.631 -3.807 527 H LYS 61 H LYS 61 -9.469 -2.190 -6.939 528 HA LYS 61 HA LYS 61 -8.111 -0.003 -5.725 529 HB2 LYS 61 2HB LYS 61 -10.122 -0.179 -7.993 530 HB3 LYS 61 3HB LYS 61 -9.514 1.374 -7.426 531 HG2 LYS 61 2HG LYS 61 -7.176 0.540 -7.904 532 HG3 LYS 61 3HG LYS 61 -7.902 -0.881 -8.665 533 HD2 LYS 61 2HD LYS 61 -8.896 0.430 -10.400 534 HD3 LYS 61 3HD LYS 61 -8.616 1.943 -9.534 535 HE2 LYS 61 2HE LYS 61 -7.050 1.764 -11.386 536 HE3 LYS 61 3HE LYS 61 -6.163 1.644 -9.870 537 HZ1 LYS 61 3HZ LYS 61 -6.208 -0.792 -10.170 538 HZ2 LYS 61 1HZ LYS 61 -5.349 0.021 -11.374 539 HZ3 LYS 61 2HZ LYS 61 -6.897 -0.568 -11.698 540 H GLN 62 H GLN 62 -11.480 -1.148 -5.535 541 HA GLN 62 HA GLN 62 -12.629 1.233 -4.425 542 HB2 GLN 62 2HB GLN 62 -14.131 -0.370 -5.457 543 HB3 GLN 62 3HB GLN 62 -13.550 -1.667 -4.431 544 HG2 GLN 62 2HG GLN 62 -15.698 -1.124 -3.600 545 HG3 GLN 62 3HG GLN 62 -14.564 -0.427 -2.446 546 HE21 GLN 62 1HE2 GLN 62 -17.272 0.298 -2.728 547 HE22 GLN 62 2HE2 GLN 62 -17.339 1.954 -3.214 548 H LEU 63 H LEU 63 -11.278 -1.769 -3.050 549 HA LEU 63 HA LEU 63 -11.637 -1.289 -0.325 550 HB2 LEU 63 2HB LEU 63 -9.379 -2.711 -1.794 551 HB3 LEU 63 3HB LEU 63 -9.571 -2.757 -0.044 552 HG LEU 63 HG LEU 63 -11.591 -3.839 -2.052 553 HD11 LEU 63 1HD1 LEU 63 -9.554 -5.187 -2.043 554 HD12 LEU 63 2HD1 LEU 63 -10.897 -6.062 -1.315 555 HD13 LEU 63 3HD1 LEU 63 -9.650 -5.354 -0.287 556 HD21 LEU 63 3HD2 LEU 63 -12.673 -3.057 -0.001 557 HD22 LEU 63 1HD2 LEU 63 -11.550 -4.004 0.982 558 HD23 LEU 63 2HD2 LEU 63 -12.704 -4.816 -0.083 559 H LEU 64 H LEU 64 -8.892 -0.411 -2.424 560 HA LEU 64 HA LEU 64 -7.294 0.865 -0.525 561 HB2 LEU 64 2HB LEU 64 -6.521 0.170 -2.731 562 HB3 LEU 64 3HB LEU 64 -7.546 1.362 -3.505 563 HG LEU 64 HG LEU 64 -5.471 2.362 -1.560 564 HD11 LEU 64 1HD1 LEU 64 -4.785 1.494 -4.376 565 HD12 LEU 64 2HD1 LEU 64 -4.193 0.765 -2.879 566 HD13 LEU 64 3HD1 LEU 64 -3.739 2.416 -3.290 567 HD21 LEU 64 3HD2 LEU 64 -5.317 4.248 -3.159 568 HD22 LEU 64 1HD2 LEU 64 -6.950 4.010 -2.545 569 HD23 LEU 64 2HD2 LEU 64 -6.536 3.471 -4.167 570 H LYS 65 H LYS 65 -9.865 2.207 -2.580 571 HA LYS 65 HA LYS 65 -9.604 4.940 -2.050 572 HB2 LYS 65 2HB LYS 65 -12.043 3.256 -2.743 573 HB3 LYS 65 3HB LYS 65 -12.111 5.013 -2.657 574 HG2 LYS 65 2HG LYS 65 -10.660 5.258 -4.543 575 HG3 LYS 65 3HG LYS 65 -10.219 3.549 -4.515 576 HD2 LYS 65 2HD LYS 65 -11.776 3.958 -6.345 577 HD3 LYS 65 3HD LYS 65 -12.537 2.932 -5.134 578 HE2 LYS 65 2HE LYS 65 -13.020 5.927 -5.276 579 HE3 LYS 65 3HE LYS 65 -13.988 4.764 -6.168 580 HZ1 LYS 65 3HZ LYS 65 -13.730 4.886 -3.210 581 HZ2 LYS 65 1HZ LYS 65 -14.645 3.762 -4.073 582 HZ3 LYS 65 2HZ LYS 65 -15.053 5.396 -4.118 583 H GLU 66 H GLU 66 -11.885 2.618 -0.539 584 HA GLU 66 HA GLU 66 -13.062 4.384 1.308 585 HB2 GLU 66 2HB GLU 66 -12.769 1.373 1.675 586 HB3 GLU 66 3HB GLU 66 -13.978 2.415 2.421 587 HG2 GLU 66 2HG GLU 66 -13.790 1.482 -0.445 588 HG3 GLU 66 3HG GLU 66 -15.084 1.208 0.718 589 H MET 67 H MET 67 -10.376 2.127 1.599 590 HA MET 67 HA MET 67 -9.776 2.343 4.311 591 HB2 MET 67 2HB MET 67 -8.917 0.558 2.930 592 HB3 MET 67 3HB MET 67 -8.078 1.685 1.882 593 HG2 MET 67 2HG MET 67 -6.351 2.025 3.428 594 HG3 MET 67 3HG MET 67 -7.328 1.456 4.782 595 HE1 MET 67 3HE MET 67 -6.127 -1.641 1.564 596 HE2 MET 67 1HE MET 67 -6.093 0.090 1.225 597 HE3 MET 67 2HE MET 67 -7.632 -0.723 1.532 598 H LEU 68 H LEU 68 -8.434 4.238 1.535 599 HA LEU 68 HA LEU 68 -6.672 5.842 3.094 600 HB2 LEU 68 2HB LEU 68 -7.863 6.273 0.337 601 HB3 LEU 68 3HB LEU 68 -6.754 7.427 1.067 602 HG LEU 68 HG LEU 68 -6.109 4.546 0.321 603 HD11 LEU 68 1HD1 LEU 68 -4.628 5.553 -1.344 604 HD12 LEU 68 2HD1 LEU 68 -5.150 7.169 -0.854 605 HD13 LEU 68 3HD1 LEU 68 -6.301 6.052 -1.596 606 HD21 LEU 68 3HD2 LEU 68 -3.791 5.055 0.958 607 HD22 LEU 68 1HD2 LEU 68 -4.870 5.183 2.344 608 HD23 LEU 68 2HD2 LEU 68 -4.285 6.646 1.547 609 H GLU 69 H GLU 69 -10.063 6.179 2.218 610 HA GLU 69 HA GLU 69 -10.472 8.875 2.984 611 HB2 GLU 69 2HB GLU 69 -12.064 6.768 1.926 612 HB3 GLU 69 3HB GLU 69 -12.839 7.161 3.450 613 HG2 GLU 69 2HG GLU 69 -12.285 9.058 1.154 614 HG3 GLU 69 3HG GLU 69 -13.847 8.390 1.621 615 H LEU 70 H LEU 70 -10.745 5.819 4.716 616 HA LEU 70 HA LEU 70 -11.412 6.797 7.290 617 HB2 LEU 70 2HB LEU 70 -9.971 4.242 6.476 618 HB3 LEU 70 3HB LEU 70 -10.609 4.549 8.087 619 HG LEU 70 HG LEU 70 -12.302 4.359 5.556 620 HD11 LEU 70 1HD1 LEU 70 -11.338 2.180 6.110 621 HD12 LEU 70 2HD1 LEU 70 -13.077 2.200 6.386 622 HD13 LEU 70 3HD1 LEU 70 -11.967 2.302 7.756 623 HD21 LEU 70 3HD2 LEU 70 -13.306 5.814 7.256 624 HD22 LEU 70 1HD2 LEU 70 -13.158 4.526 8.460 625 HD23 LEU 70 2HD2 LEU 70 -14.223 4.324 7.065 626 H ILE 71 H ILE 71 -8.256 6.144 5.728 627 HA ILE 71 HA ILE 71 -6.578 6.601 7.985 628 HB ILE 71 HB ILE 71 -5.902 6.846 5.010 629 HG12 ILE 71 2HG1 ILE 71 -5.297 4.540 6.920 630 HG13 ILE 71 3HG1 ILE 71 -6.637 4.555 5.788 631 HG21 ILE 71 1HG2 ILE 71 -3.520 6.635 5.700 632 HG22 ILE 71 2HG2 ILE 71 -4.010 6.724 7.390 633 HG23 ILE 71 3HG2 ILE 71 -4.263 8.106 6.322 634 HD11 ILE 71 3HD1 ILE 71 -5.072 4.629 3.912 635 HD12 ILE 71 1HD1 ILE 71 -4.792 3.230 4.948 636 HD13 ILE 71 2HD1 ILE 71 -3.714 4.623 5.041 637 H SER 72 H SER 72 -7.976 8.711 5.523 638 HA SER 72 HA SER 72 -6.500 11.055 5.951 639 HB2 SER 72 2HB SER 72 -7.966 10.657 3.975 640 HB3 SER 72 3HB SER 72 -9.389 10.743 5.012 641 HG SER 72 HG SER 72 -9.222 12.743 4.241 642 H LYS 73 H LYS 73 -9.308 9.678 7.592 643 HA LYS 73 HA LYS 73 -9.802 11.881 9.365 644 HB2 LYS 73 2HB LYS 73 -10.615 8.956 9.677 645 HB3 LYS 73 3HB LYS 73 -11.328 10.331 10.521 646 HG2 LYS 73 2HG LYS 73 -11.478 9.781 7.534 647 HG3 LYS 73 3HG LYS 73 -12.779 9.522 8.704 648 HD2 LYS 73 2HD LYS 73 -12.950 11.921 9.123 649 HD3 LYS 73 3HD LYS 73 -11.528 12.243 8.123 650 HE2 LYS 73 2HE LYS 73 -14.167 11.113 7.122 651 HE3 LYS 73 3HE LYS 73 -13.612 12.779 6.921 652 HZ1 LYS 73 3HZ LYS 73 -13.204 11.455 4.939 653 HZ2 LYS 73 1HZ LYS 73 -12.261 10.366 5.823 654 HZ3 LYS 73 2HZ LYS 73 -11.748 11.963 5.622 655 H LEU 74 H LEU 74 -8.019 8.803 9.581 656 HA LEU 74 HA LEU 74 -7.566 8.876 12.396 657 HB2 LEU 74 2HB LEU 74 -6.138 7.245 10.258 658 HB3 LEU 74 3HB LEU 74 -6.034 6.958 11.989 659 HG LEU 74 HG LEU 74 -8.516 6.618 10.260 660 HD11 LEU 74 1HD1 LEU 74 -6.827 4.526 11.653 661 HD12 LEU 74 2HD1 LEU 74 -6.901 4.829 9.915 662 HD13 LEU 74 3HD1 LEU 74 -8.325 4.231 10.762 663 HD21 LEU 74 3HD2 LEU 74 -9.625 5.726 12.268 664 HD22 LEU 74 1HD2 LEU 74 -9.191 7.423 12.451 665 HD23 LEU 74 2HD2 LEU 74 -8.225 6.177 13.244 666 H GLY 75 H GLY 75 -5.662 9.973 9.639 667 HA2 GLY 75 2HA GLY 75 -4.044 11.606 9.540 668 HA3 GLY 75 3HA GLY 75 -4.077 11.726 11.292 669 H TYR 76 H TYR 76 -3.000 9.524 8.680 670 HA TYR 76 HA TYR 76 -0.515 8.946 10.209 671 HB2 TYR 76 2HB TYR 76 -2.070 6.961 8.496 672 HB3 TYR 76 3HB TYR 76 -0.517 6.637 9.258 673 HD1 TYR 76 HD1 TYR 76 -0.952 7.806 11.989 674 HD2 TYR 76 HD2 TYR 76 -3.539 5.425 9.557 675 HE1 TYR 76 HE1 TYR 76 -2.094 6.985 13.996 676 HE2 TYR 76 HE2 TYR 76 -4.680 4.610 11.568 677 HH TYR 76 HH TYR 76 -4.308 6.064 14.584 678 H LYS 77 H LYS 77 1.408 8.726 9.024 679 HA LYS 77 HA LYS 77 1.480 9.970 6.406 680 HB2 LYS 77 2HB LYS 77 3.281 10.174 8.339 681 HB3 LYS 77 3HB LYS 77 3.901 8.656 7.707 682 HG2 LYS 77 2HG LYS 77 3.642 11.261 6.140 683 HG3 LYS 77 3HG LYS 77 5.137 10.623 6.826 684 HD2 LYS 77 2HD LYS 77 5.109 8.736 5.274 685 HD3 LYS 77 3HD LYS 77 3.503 9.170 4.698 686 HE2 LYS 77 2HE LYS 77 4.479 11.308 3.804 687 HE3 LYS 77 3HE LYS 77 6.077 10.696 4.235 688 HZ1 LYS 77 3HZ LYS 77 5.766 8.859 2.738 689 HZ2 LYS 77 1HZ LYS 77 5.494 10.303 1.903 690 HZ3 LYS 77 2HZ LYS 77 4.185 9.341 2.386 691 H VAL 78 H VAL 78 0.969 8.825 4.694 692 HA VAL 78 HA VAL 78 1.398 5.909 4.571 693 HB VAL 78 HB VAL 78 -0.406 7.694 2.866 694 HG11 VAL 78 1HG1 VAL 78 -1.396 5.590 1.999 695 HG12 VAL 78 2HG1 VAL 78 -0.199 4.654 2.899 696 HG13 VAL 78 3HG1 VAL 78 0.316 5.709 1.582 697 HG21 VAL 78 3HG2 VAL 78 -2.270 6.639 4.097 698 HG22 VAL 78 1HG2 VAL 78 -1.190 7.510 5.190 699 HG23 VAL 78 2HG2 VAL 78 -1.115 5.749 5.092 700 H PHE 79 H PHE 79 2.866 5.082 3.217 701 HA PHE 79 HA PHE 79 3.812 6.598 0.859 702 HB2 PHE 79 2HB PHE 79 4.884 4.096 2.255 703 HB3 PHE 79 3HB PHE 79 5.507 4.700 0.729 704 HD1 PHE 79 HD2 PHE 79 5.288 5.374 4.374 705 HD2 PHE 79 HD1 PHE 79 7.007 6.596 0.651 706 HE1 PHE 79 HE2 PHE 79 6.901 6.788 5.572 707 HE2 PHE 79 HE1 PHE 79 8.615 7.997 1.861 708 HZ PHE 79 HZ PHE 79 8.565 8.097 4.317 709 H LEU 80 H LEU 80 2.566 6.114 -0.896 710 HA LEU 80 HA LEU 80 1.059 3.588 -0.978 711 HB2 LEU 80 2HB LEU 80 -0.295 5.616 -1.176 712 HB3 LEU 80 3HB LEU 80 0.671 6.167 -2.536 713 HG LEU 80 HG LEU 80 -0.152 4.221 -3.899 714 HD11 LEU 80 1HD1 LEU 80 -0.615 2.623 -2.131 715 HD12 LEU 80 2HD1 LEU 80 -2.044 2.872 -3.125 716 HD13 LEU 80 3HD1 LEU 80 -1.939 3.622 -1.530 717 HD21 LEU 80 3HD2 LEU 80 -2.451 5.005 -4.244 718 HD22 LEU 80 1HD2 LEU 80 -1.307 6.335 -4.108 719 HD23 LEU 80 2HD2 LEU 80 -2.358 5.943 -2.748 720 H LEU 81 H LEU 81 1.771 2.036 -2.238 721 HA LEU 81 HA LEU 81 3.194 2.594 -4.742 722 HB2 LEU 81 2HB LEU 81 4.233 0.948 -3.137 723 HB3 LEU 81 3HB LEU 81 2.820 -0.069 -3.300 724 HG LEU 81 HG LEU 81 3.324 -0.497 -5.668 725 HD11 LEU 81 1HD1 LEU 81 5.410 0.402 -6.706 726 HD12 LEU 81 2HD1 LEU 81 5.604 1.466 -5.312 727 HD13 LEU 81 3HD1 LEU 81 4.194 1.629 -6.363 728 HD21 LEU 81 3HD2 LEU 81 4.429 -1.960 -4.036 729 HD22 LEU 81 1HD2 LEU 81 5.814 -0.868 -3.965 730 HD23 LEU 81 2HD2 LEU 81 5.441 -1.733 -5.461 731 H LEU 82 H LEU 82 1.741 2.833 -6.365 732 HA LEU 82 HA LEU 82 -0.477 0.894 -6.585 733 HB2 LEU 82 2HB LEU 82 0.183 3.392 -8.197 734 HB3 LEU 82 3HB LEU 82 -1.125 2.286 -8.597 735 HG LEU 82 HG LEU 82 -0.922 3.987 -6.079 736 HD11 LEU 82 1HD1 LEU 82 -2.842 5.200 -6.962 737 HD12 LEU 82 2HD1 LEU 82 -2.825 4.213 -8.427 738 HD13 LEU 82 3HD1 LEU 82 -1.476 5.297 -8.071 739 HD21 LEU 82 3HD2 LEU 82 -2.000 1.846 -5.572 740 HD22 LEU 82 1HD2 LEU 82 -3.126 2.071 -6.915 741 HD23 LEU 82 2HD2 LEU 82 -3.167 3.161 -5.526 742 H GLN 83 H GLN 83 0.246 -0.978 -7.393 743 HA GLN 83 HA GLN 83 2.015 -0.978 -9.746 744 HB2 GLN 83 2HB GLN 83 2.687 -2.563 -7.971 745 HB3 GLN 83 3HB GLN 83 1.101 -3.336 -8.032 746 HG2 GLN 83 2HG GLN 83 1.513 -4.119 -10.313 747 HG3 GLN 83 3HG GLN 83 3.024 -3.210 -10.391 748 HE21 GLN 83 1HE2 GLN 83 4.140 -5.135 -10.918 749 HE22 GLN 83 2HE2 GLN 83 4.506 -6.317 -9.711 750 H ASP 84 H ASP 84 0.773 -0.472 -11.386 751 HA ASP 84 HA ASP 84 -1.355 -2.364 -12.132 752 HB2 ASP 84 2HB ASP 84 -1.366 0.670 -12.391 753 HB3 ASP 84 3HB ASP 84 -2.241 -0.310 -13.561 754 H GLN 85 H GLN 85 -0.704 -3.470 -13.816 755 HA GLN 85 HA GLN 85 1.754 -2.978 -15.180 756 HB2 GLN 85 2HB GLN 85 -0.491 -4.910 -15.903 757 HB3 GLN 85 3HB GLN 85 1.190 -5.025 -16.417 758 HG2 GLN 85 2HG GLN 85 1.924 -5.664 -14.257 759 HG3 GLN 85 3HG GLN 85 0.430 -5.140 -13.484 760 HE21 GLN 85 1HE2 GLN 85 -1.463 -6.433 -13.774 761 HE22 GLN 85 2HE2 GLN 85 -1.342 -8.108 -14.182 762 H ASP 86 H ASP 86 -1.544 -2.145 -15.695 763 HA ASP 86 HA ASP 86 -1.101 -1.008 -18.377 764 HB2 ASP 86 2HB ASP 86 -3.164 -2.383 -17.999 765 HB3 ASP 86 3HB ASP 86 -3.634 -1.322 -16.678 766 H GLU 87 H GLU 87 -0.368 1.088 -18.334 767 HA GLU 87 HA GLU 87 -0.444 2.562 -15.826 768 HB2 GLU 87 2HB GLU 87 1.055 3.162 -18.403 769 HB3 GLU 87 3HB GLU 87 1.157 4.141 -16.928 770 HG2 GLU 87 2HG GLU 87 1.953 2.130 -15.691 771 HG3 GLU 87 3HG GLU 87 1.945 1.221 -17.203 772 H ASN 88 H ASN 88 -2.656 2.385 -18.218 773 HA ASN 88 HA ASN 88 -3.536 5.159 -18.046 774 HB2 ASN 88 2HB ASN 88 -5.043 2.714 -19.101 775 HB3 ASN 88 3HB ASN 88 -5.592 4.381 -19.212 776 HD21 ASN 88 1HD2 ASN 88 -5.630 4.549 -21.431 777 HD22 ASN 88 2HD2 ASN 88 -4.224 4.419 -22.428 778 H GLU 89 H GLU 89 -4.187 2.021 -16.537 779 HA GLU 89 HA GLU 89 -6.120 2.859 -14.626 780 HB2 GLU 89 2HB GLU 89 -4.084 0.597 -14.619 781 HB3 GLU 89 3HB GLU 89 -5.213 0.843 -13.286 782 HG2 GLU 89 2HG GLU 89 -5.986 0.289 -16.169 783 HG3 GLU 89 3HG GLU 89 -5.956 -0.901 -14.866 784 H LEU 90 H LEU 90 -2.588 2.521 -14.519 785 HA LEU 90 HA LEU 90 -2.101 3.269 -11.883 786 HB2 LEU 90 2HB LEU 90 -0.461 2.140 -13.282 787 HB3 LEU 90 3HB LEU 90 -0.379 3.516 -14.360 788 HG LEU 90 HG LEU 90 0.786 4.856 -12.668 789 HD11 LEU 90 1HD1 LEU 90 -0.251 3.991 -10.634 790 HD12 LEU 90 2HD1 LEU 90 1.506 3.921 -10.523 791 HD13 LEU 90 3HD1 LEU 90 0.582 2.449 -10.841 792 HD21 LEU 90 3HD2 LEU 90 2.892 3.608 -12.567 793 HD22 LEU 90 1HD2 LEU 90 2.137 3.447 -14.152 794 HD23 LEU 90 2HD2 LEU 90 2.050 2.116 -12.992 795 H GLU 91 H GLU 91 -1.930 5.400 -14.831 796 HA GLU 91 HA GLU 91 -1.132 7.734 -13.464 797 HB2 GLU 91 2HB GLU 91 -0.836 7.458 -15.897 798 HB3 GLU 91 3HB GLU 91 -2.579 7.474 -16.140 799 HG2 GLU 91 2HG GLU 91 -2.675 9.814 -15.327 800 HG3 GLU 91 3HG GLU 91 -0.933 9.794 -15.067 801 H GLU 92 H GLU 92 -4.379 6.856 -14.709 802 HA GLU 92 HA GLU 92 -5.755 9.117 -13.853 803 HB2 GLU 92 2HB GLU 92 -6.713 6.279 -14.342 804 HB3 GLU 92 3HB GLU 92 -7.823 7.595 -13.964 805 HG2 GLU 92 2HG GLU 92 -5.931 7.573 -16.342 806 HG3 GLU 92 3HG GLU 92 -7.629 7.088 -16.401 807 H PHE 93 H PHE 93 -5.129 6.096 -12.096 808 HA PHE 93 HA PHE 93 -6.775 6.784 -9.832 809 HB2 PHE 93 2HB PHE 93 -6.047 4.414 -10.721 810 HB3 PHE 93 3HB PHE 93 -4.573 4.687 -9.803 811 HD1 PHE 93 HD1 PHE 93 -8.165 5.452 -9.006 812 HD2 PHE 93 HD2 PHE 93 -4.670 3.218 -7.949 813 HE1 PHE 93 HE1 PHE 93 -9.330 4.548 -7.044 814 HE2 PHE 93 HE2 PHE 93 -5.845 2.333 -5.985 815 HZ PHE 93 HZ PHE 93 -8.175 2.995 -5.532 816 H LYS 94 H LYS 94 -3.356 7.061 -10.678 817 HA LYS 94 HA LYS 94 -2.240 7.675 -8.159 818 HB2 LYS 94 2HB LYS 94 -0.810 6.923 -9.937 819 HB3 LYS 94 3HB LYS 94 -1.341 8.207 -11.014 820 HG2 LYS 94 2HG LYS 94 -0.156 9.872 -9.622 821 HG3 LYS 94 3HG LYS 94 0.361 8.587 -8.525 822 HD2 LYS 94 2HD LYS 94 1.709 7.555 -10.259 823 HD3 LYS 94 3HD LYS 94 1.060 8.645 -11.489 824 HE2 LYS 94 2HE LYS 94 3.305 9.338 -10.869 825 HE3 LYS 94 3HE LYS 94 2.141 10.549 -10.339 826 HZ1 LYS 94 3HZ LYS 94 2.304 9.730 -8.098 827 HZ2 LYS 94 1HZ LYS 94 3.855 10.062 -8.678 828 HZ3 LYS 94 2HZ LYS 94 3.323 8.466 -8.578 829 H ARG 95 H ARG 95 -3.202 9.855 -10.861 830 HA ARG 95 HA ARG 95 -2.397 12.254 -9.689 831 HB2 ARG 95 2HB ARG 95 -3.876 13.389 -11.372 832 HB3 ARG 95 3HB ARG 95 -2.797 12.183 -12.062 833 HG2 ARG 95 2HG ARG 95 -4.637 10.587 -12.261 834 HG3 ARG 95 3HG ARG 95 -5.738 11.715 -11.471 835 HD2 ARG 95 2HD ARG 95 -6.057 11.691 -13.915 836 HD3 ARG 95 3HD ARG 95 -5.529 13.276 -13.347 837 HE ARG 95 HE ARG 95 -3.276 11.764 -14.175 838 HH11 ARG 95 1HH1 ARG 95 -6.049 13.426 -15.618 839 HH12 ARG 95 2HH1 ARG 95 -5.230 13.740 -17.109 840 HH21 ARG 95 1HH2 ARG 95 -2.222 12.253 -16.129 841 HH22 ARG 95 2HH2 ARG 95 -3.069 13.079 -17.396 842 H LYS 96 H LYS 96 -5.427 10.493 -9.307 843 HA LYS 96 HA LYS 96 -6.961 12.496 -8.014 844 HB2 LYS 96 2HB LYS 96 -7.082 9.459 -7.743 845 HB3 LYS 96 3HB LYS 96 -8.335 10.570 -7.184 846 HG2 LYS 96 2HG LYS 96 -8.774 11.278 -9.492 847 HG3 LYS 96 3HG LYS 96 -7.465 10.241 -10.075 848 HD2 LYS 96 2HD LYS 96 -8.721 8.243 -9.187 849 HD3 LYS 96 3HD LYS 96 -10.049 9.320 -8.736 850 HE2 LYS 96 2HE LYS 96 -10.307 9.951 -11.127 851 HE3 LYS 96 3HE LYS 96 -9.010 8.833 -11.550 852 HZ1 LYS 96 3HZ LYS 96 -11.670 8.156 -10.429 853 HZ2 LYS 96 1HZ LYS 96 -10.406 7.044 -10.571 854 HZ3 LYS 96 2HZ LYS 96 -11.061 7.759 -11.952 855 H ILE 97 H ILE 97 -4.910 9.893 -6.756 856 HA ILE 97 HA ILE 97 -5.535 10.396 -3.983 857 HB ILE 97 HB ILE 97 -3.486 8.525 -5.246 858 HG12 ILE 97 2HG1 ILE 97 -6.305 7.865 -4.264 859 HG13 ILE 97 3HG1 ILE 97 -5.903 8.158 -5.952 860 HG21 ILE 97 1HG2 ILE 97 -2.952 8.889 -2.912 861 HG22 ILE 97 2HG2 ILE 97 -3.654 7.283 -3.075 862 HG23 ILE 97 3HG2 ILE 97 -4.625 8.608 -2.431 863 HD11 ILE 97 3HD1 ILE 97 -6.055 5.801 -5.507 864 HD12 ILE 97 1HD1 ILE 97 -4.834 5.920 -4.240 865 HD13 ILE 97 2HD1 ILE 97 -4.397 6.228 -5.924 866 H GLU 98 H GLU 98 -2.945 11.215 -6.168 867 HA GLU 98 HA GLU 98 -1.041 12.023 -4.169 868 HB2 GLU 98 2HB GLU 98 -0.445 11.106 -6.436 869 HB3 GLU 98 3HB GLU 98 -1.046 12.594 -7.158 870 HG2 GLU 98 2HG GLU 98 0.731 13.881 -6.284 871 HG3 GLU 98 3HG GLU 98 1.122 12.671 -5.067 872 H SER 99 H SER 99 -3.705 13.507 -5.870 873 HA SER 99 HA SER 99 -3.126 16.227 -5.110 874 HB2 SER 99 2HB SER 99 -5.710 14.897 -6.035 875 HB3 SER 99 3HB SER 99 -5.505 16.636 -5.804 876 HG SER 99 HG SER 99 -4.096 16.702 -7.487 877 H GLN 100 H GLN 100 -4.493 13.448 -3.541 878 HA GLN 100 HA GLN 100 -5.720 14.912 -1.333 879 HB2 GLN 100 2HB GLN 100 -5.246 11.918 -1.715 880 HB3 GLN 100 3HB GLN 100 -6.216 12.643 -0.432 881 HG2 GLN 100 2HG GLN 100 -7.838 13.451 -2.064 882 HG3 GLN 100 3HG GLN 100 -6.831 12.874 -3.391 883 HE21 GLN 100 1HE2 GLN 100 -9.040 11.922 -0.850 884 HE22 GLN 100 2HE2 GLN 100 -9.285 10.308 -1.396 885 H GLY 101 H GLY 101 -2.598 14.530 -2.122 886 HA2 GLY 101 2HA GLY 101 -0.751 15.144 -0.883 887 HA3 GLY 101 3HA GLY 101 -1.717 15.078 0.581 888 H TYR 102 H TYR 102 -1.814 12.273 -1.384 889 HA TYR 102 HA TYR 102 -0.094 10.784 0.480 890 HB2 TYR 102 2HB TYR 102 -1.994 9.827 -1.698 891 HB3 TYR 102 3HB TYR 102 -1.004 8.751 -0.718 892 HD1 TYR 102 HD1 TYR 102 -1.378 8.761 1.830 893 HD2 TYR 102 HD2 TYR 102 -4.143 10.546 -0.888 894 HE1 TYR 102 HE1 TYR 102 -3.122 8.684 3.555 895 HE2 TYR 102 HE2 TYR 102 -5.890 10.477 0.840 896 HH TYR 102 HH TYR 102 -5.228 9.934 4.089 897 H GLU 103 H GLU 103 1.879 10.090 -0.044 898 HA GLU 103 HA GLU 103 3.199 10.840 -2.470 899 HB2 GLU 103 2HB GLU 103 4.374 10.736 -0.280 900 HB3 GLU 103 3HB GLU 103 4.086 9.002 -0.197 901 HG2 GLU 103 2HG GLU 103 5.503 8.705 -2.225 902 HG3 GLU 103 3HG GLU 103 5.832 10.435 -2.226 903 H VAL 104 H VAL 104 2.426 9.794 -4.307 904 HA VAL 104 HA VAL 104 1.984 6.874 -4.237 905 HB VAL 104 HB VAL 104 1.299 8.759 -6.536 906 HG11 VAL 104 1HG1 VAL 104 0.327 5.959 -5.844 907 HG12 VAL 104 2HG1 VAL 104 1.448 6.380 -7.141 908 HG13 VAL 104 3HG1 VAL 104 -0.229 6.924 -7.216 909 HG21 VAL 104 3HG2 VAL 104 -1.051 8.745 -5.691 910 HG22 VAL 104 1HG2 VAL 104 0.060 9.555 -4.582 911 HG23 VAL 104 2HG2 VAL 104 -0.502 7.922 -4.229 912 H ARG 105 H ARG 105 3.519 5.570 -5.039 913 HA ARG 105 HA ARG 105 5.490 6.578 -6.993 914 HB2 ARG 105 2HB ARG 105 6.227 5.509 -4.743 915 HB3 ARG 105 3HB ARG 105 5.697 3.982 -5.424 916 HG2 ARG 105 2HG ARG 105 7.946 3.906 -5.950 917 HG3 ARG 105 3HG ARG 105 7.317 4.641 -7.422 918 HD2 ARG 105 2HD ARG 105 8.680 6.050 -5.100 919 HD3 ARG 105 3HD ARG 105 9.339 5.794 -6.711 920 HE ARG 105 HE ARG 105 7.489 7.297 -7.508 921 HH11 ARG 105 1HH1 ARG 105 8.750 7.612 -4.232 922 HH12 ARG 105 2HH1 ARG 105 8.313 9.282 -4.104 923 HH21 ARG 105 1HH2 ARG 105 6.880 9.482 -7.293 924 HH22 ARG 105 2HH2 ARG 105 7.255 10.340 -5.834 925 H LYS 106 H LYS 106 5.856 5.376 -8.890 926 HA LYS 106 HA LYS 106 3.606 3.761 -9.865 927 HB2 LYS 106 2HB LYS 106 6.001 5.002 -11.296 928 HB3 LYS 106 3HB LYS 106 4.670 4.165 -12.088 929 HG2 LYS 106 2HG LYS 106 3.114 5.913 -11.426 930 HG3 LYS 106 3HG LYS 106 4.362 6.715 -10.472 931 HD2 LYS 106 2HD LYS 106 4.026 7.883 -12.598 932 HD3 LYS 106 3HD LYS 106 5.645 7.196 -12.531 933 HE2 LYS 106 2HE LYS 106 3.359 5.799 -13.944 934 HE3 LYS 106 3HE LYS 106 4.346 7.012 -14.743 935 HZ1 LYS 106 3HZ LYS 106 6.286 5.612 -14.330 936 HZ2 LYS 106 1HZ LYS 106 5.122 4.823 -15.258 937 HZ3 LYS 106 2HZ LYS 106 5.306 4.433 -13.630 938 H VAL 107 H VAL 107 3.833 1.629 -10.563 939 HA VAL 107 HA VAL 107 6.297 0.683 -11.623 940 HB VAL 107 HB VAL 107 6.684 0.264 -9.148 941 HG11 VAL 107 1HG1 VAL 107 4.411 -0.389 -8.480 942 HG12 VAL 107 2HG1 VAL 107 5.594 -1.615 -8.022 943 HG13 VAL 107 3HG1 VAL 107 4.549 -1.876 -9.422 944 HG21 VAL 107 3HG2 VAL 107 7.661 -1.978 -9.454 945 HG22 VAL 107 1HG2 VAL 107 7.955 -0.948 -10.858 946 HG23 VAL 107 2HG2 VAL 107 6.713 -2.201 -10.927 947 H THR 108 H THR 108 6.035 -1.135 -12.922 948 HA THR 108 HA THR 108 3.346 -2.364 -13.189 949 HB THR 108 HB THR 108 3.964 -2.811 -15.595 950 HG1 THR 108 HG1 THR 108 6.185 -2.699 -15.572 951 HG21 THR 108 3HG2 THR 108 2.601 -0.821 -15.132 952 HG22 THR 108 1HG2 THR 108 3.720 -0.500 -16.458 953 HG23 THR 108 2HG2 THR 108 4.058 0.129 -14.845 954 H ASP 109 H ASP 109 6.864 -2.802 -13.152 955 HA ASP 109 HA ASP 109 6.810 -5.607 -13.898 956 HB2 ASP 109 2HB ASP 109 9.073 -3.753 -13.016 957 HB3 ASP 109 3HB ASP 109 9.317 -5.455 -13.415 958 H ASP 110 H ASP 110 7.474 -7.324 -12.601 959 HA ASP 110 HA ASP 110 6.430 -7.244 -9.921 960 HB2 ASP 110 2HB ASP 110 7.826 -9.596 -11.268 961 HB3 ASP 110 3HB ASP 110 6.614 -9.638 -9.987 962 H GLU 111 H GLU 111 9.582 -7.852 -11.437 963 HA GLU 111 HA GLU 111 11.068 -8.371 -9.079 964 HB2 GLU 111 2HB GLU 111 12.024 -7.364 -11.791 965 HB3 GLU 111 3HB GLU 111 13.071 -7.981 -10.511 966 HG2 GLU 111 2HG GLU 111 11.945 -10.193 -10.696 967 HG3 GLU 111 3HG GLU 111 10.965 -9.565 -12.025 968 H GLU 112 H GLU 112 10.468 -5.435 -11.005 969 HA GLU 112 HA GLU 112 12.078 -3.710 -9.410 970 HB2 GLU 112 2HB GLU 112 11.515 -3.065 -11.707 971 HB3 GLU 112 3HB GLU 112 9.805 -2.967 -11.292 972 HG2 GLU 112 2HG GLU 112 10.089 -1.014 -9.996 973 HG3 GLU 112 3HG GLU 112 11.815 -1.279 -9.799 974 H ALA 113 H ALA 113 8.657 -4.679 -9.220 975 HA ALA 113 HA ALA 113 7.664 -2.772 -7.461 976 HB1 ALA 113 3HB ALA 113 5.939 -4.416 -6.851 977 HB2 ALA 113 1HB ALA 113 6.905 -5.711 -7.569 978 HB3 ALA 113 2HB ALA 113 6.242 -4.433 -8.589 979 H LEU 114 H LEU 114 9.392 -5.811 -6.672 980 HA LEU 114 HA LEU 114 9.189 -5.697 -3.859 981 HB2 LEU 114 2HB LEU 114 11.472 -6.896 -5.476 982 HB3 LEU 114 3HB LEU 114 11.146 -7.211 -3.777 983 HG LEU 114 HG LEU 114 9.450 -8.090 -6.149 984 HD11 LEU 114 1HD1 LEU 114 10.066 -10.355 -5.454 985 HD12 LEU 114 2HD1 LEU 114 11.062 -9.705 -4.147 986 HD13 LEU 114 3HD1 LEU 114 11.498 -9.398 -5.831 987 HD21 LEU 114 3HD2 LEU 114 8.018 -9.262 -4.525 988 HD22 LEU 114 1HD2 LEU 114 7.967 -7.518 -4.284 989 HD23 LEU 114 2HD2 LEU 114 8.912 -8.529 -3.189 990 H LYS 115 H LYS 115 11.672 -4.368 -6.054 991 HA LYS 115 HA LYS 115 13.306 -3.373 -3.897 992 HB2 LYS 115 2HB LYS 115 14.876 -2.602 -5.523 993 HB3 LYS 115 3HB LYS 115 14.312 -4.185 -6.041 994 HG2 LYS 115 2HG LYS 115 12.894 -3.151 -7.746 995 HG3 LYS 115 3HG LYS 115 13.363 -1.539 -7.190 996 HD2 LYS 115 2HD LYS 115 15.727 -2.037 -7.803 997 HD3 LYS 115 3HD LYS 115 15.232 -3.628 -8.393 998 HE2 LYS 115 2HE LYS 115 15.493 -2.067 -10.263 999 HE3 LYS 115 3HE LYS 115 13.801 -2.528 -10.093 1000 HZ1 LYS 115 3HZ LYS 115 15.001 0.006 -9.120 1001 HZ2 LYS 115 1HZ LYS 115 13.378 -0.434 -8.963 1002 HZ3 LYS 115 2HZ LYS 115 14.029 -0.166 -10.497 1003 H ILE 116 H ILE 116 10.624 -2.099 -5.685 1004 HA ILE 116 HA ILE 116 11.052 0.650 -4.871 1005 HB ILE 116 HB ILE 116 8.546 -0.726 -5.950 1006 HG12 ILE 116 2HG1 ILE 116 10.348 -0.626 -7.631 1007 HG13 ILE 116 3HG1 ILE 116 9.062 0.486 -8.075 1008 HG21 ILE 116 1HG2 ILE 116 7.871 1.209 -4.628 1009 HG22 ILE 116 2HG2 ILE 116 7.643 1.551 -6.344 1010 HG23 ILE 116 3HG2 ILE 116 9.026 2.232 -5.485 1011 HD11 ILE 116 3HD1 ILE 116 11.248 1.425 -8.505 1012 HD12 ILE 116 1HD1 ILE 116 11.704 1.238 -6.813 1013 HD13 ILE 116 2HD1 ILE 116 10.418 2.364 -7.265 1014 H VAL 117 H VAL 117 9.368 -2.200 -3.572 1015 HA VAL 117 HA VAL 117 8.001 -0.986 -1.412 1016 HB VAL 117 HB VAL 117 9.171 -3.803 -1.569 1017 HG11 VAL 117 1HG1 VAL 117 8.764 -3.207 0.789 1018 HG12 VAL 117 2HG1 VAL 117 7.590 -4.408 0.249 1019 HG13 VAL 117 3HG1 VAL 117 7.113 -2.713 0.398 1020 HG21 VAL 117 3HG2 VAL 117 7.500 -3.360 -3.315 1021 HG22 VAL 117 1HG2 VAL 117 6.344 -2.819 -2.102 1022 HG23 VAL 117 2HG2 VAL 117 6.871 -4.503 -2.136 1023 H ARG 118 H ARG 118 11.333 -2.159 -1.742 1024 HA ARG 118 HA ARG 118 12.057 -1.729 0.986 1025 HB2 ARG 118 2HB ARG 118 14.217 -2.431 0.434 1026 HB3 ARG 118 3HB ARG 118 13.208 -3.292 -0.718 1027 HG2 ARG 118 2HG ARG 118 13.790 -1.598 -2.442 1028 HG3 ARG 118 3HG ARG 118 14.853 -0.800 -1.280 1029 HD2 ARG 118 2HD ARG 118 15.137 -3.630 -2.342 1030 HD3 ARG 118 3HD ARG 118 16.129 -2.238 -2.784 1031 HE ARG 118 HE ARG 118 16.539 -2.290 -0.159 1032 HH11 ARG 118 1HH1 ARG 118 16.622 -4.950 -2.467 1033 HH12 ARG 118 2HH1 ARG 118 17.778 -5.860 -1.551 1034 HH21 ARG 118 1HH2 ARG 118 18.048 -3.517 1.030 1035 HH22 ARG 118 2HH2 ARG 118 18.584 -5.052 0.423 1036 H GLU 119 H GLU 119 11.897 0.386 -1.804 1037 HA GLU 119 HA GLU 119 13.435 2.558 -0.826 1038 HB2 GLU 119 2HB GLU 119 11.004 2.500 -2.667 1039 HB3 GLU 119 3HB GLU 119 11.915 3.969 -2.319 1040 HG2 GLU 119 2HG GLU 119 13.022 1.475 -3.656 1041 HG3 GLU 119 3HG GLU 119 12.529 2.950 -4.488 1042 H PHE 120 H PHE 120 10.000 1.681 -0.471 1043 HA PHE 120 HA PHE 120 9.240 3.800 1.240 1044 HB2 PHE 120 2HB PHE 120 8.054 1.002 1.113 1045 HB3 PHE 120 3HB PHE 120 7.276 2.429 1.798 1046 HD1 PHE 120 HD2 PHE 120 7.593 4.542 -0.100 1047 HD2 PHE 120 HD1 PHE 120 6.989 0.376 -0.850 1048 HE1 PHE 120 HE2 PHE 120 6.611 5.070 -2.286 1049 HE2 PHE 120 HE1 PHE 120 6.031 0.921 -3.023 1050 HZ PHE 120 HZ PHE 120 5.832 3.250 -3.743 1051 H MET 121 H MET 121 10.438 0.496 1.965 1052 HA MET 121 HA MET 121 10.254 0.687 4.775 1053 HB2 MET 121 2HB MET 121 12.039 -1.084 3.054 1054 HB3 MET 121 3HB MET 121 11.854 -1.265 4.795 1055 HG2 MET 121 2HG MET 121 9.366 -1.590 4.377 1056 HG3 MET 121 3HG MET 121 9.755 -1.710 2.660 1057 HE1 MET 121 3HE MET 121 10.993 -3.787 1.555 1058 HE2 MET 121 1HE MET 121 11.783 -5.060 2.487 1059 HE3 MET 121 2HE MET 121 12.441 -3.424 2.498 1060 H GLN 122 H GLN 122 12.755 1.670 2.534 1061 HA GLN 122 HA GLN 122 14.853 2.391 4.266 1062 HB2 GLN 122 2HB GLN 122 15.171 2.240 1.865 1063 HB3 GLN 122 3HB GLN 122 13.925 3.436 1.563 1064 HG2 GLN 122 2HG GLN 122 15.475 5.123 2.728 1065 HG3 GLN 122 3HG GLN 122 16.728 3.884 2.612 1066 HE21 GLN 122 1HE2 GLN 122 17.994 5.139 1.197 1067 HE22 GLN 122 2HE2 GLN 122 17.548 5.409 -0.448 1068 H LYS 123 H LYS 123 12.206 4.331 2.892 1069 HA LYS 123 HA LYS 123 13.007 6.783 4.182 1070 HB2 LYS 123 2HB LYS 123 10.508 6.077 2.587 1071 HB3 LYS 123 3HB LYS 123 10.939 7.711 3.093 1072 HG2 LYS 123 2HG LYS 123 12.896 7.720 1.690 1073 HG3 LYS 123 3HG LYS 123 12.731 5.996 1.345 1074 HD2 LYS 123 2HD LYS 123 10.602 6.469 0.139 1075 HD3 LYS 123 3HD LYS 123 10.826 8.195 0.439 1076 HE2 LYS 123 2HE LYS 123 11.537 7.542 -1.847 1077 HE3 LYS 123 3HE LYS 123 12.885 8.180 -0.904 1078 HZ1 LYS 123 3HZ LYS 123 13.643 5.932 -0.503 1079 HZ2 LYS 123 1HZ LYS 123 13.482 6.192 -2.165 1080 HZ3 LYS 123 2HZ LYS 123 12.319 5.295 -1.335 1081 H ALA 124 H ALA 124 10.583 4.321 4.794 1082 HA ALA 124 HA ALA 124 9.262 5.591 6.981 1083 HB1 ALA 124 3HB ALA 124 8.181 3.789 5.705 1084 HB2 ALA 124 1HB ALA 124 8.297 3.358 7.417 1085 HB3 ALA 124 2HB ALA 124 9.414 2.648 6.246 1086 H GLY 125 H GLY 125 12.078 3.474 6.634 1087 HA2 GLY 125 2HA GLY 125 12.692 3.070 9.375 1088 HA3 GLY 125 3HA GLY 125 13.828 3.008 8.038 1089 H SER 126 H SER 126 13.189 5.776 7.200 1090 HA SER 126 HA SER 126 15.089 7.177 8.882 1091 HB2 SER 126 2HB SER 126 13.541 8.134 6.430 1092 HB3 SER 126 3HB SER 126 14.942 8.931 7.159 1093 HG SER 126 HG SER 126 15.067 6.253 6.279 1094 H LEU 127 H LEU 127 11.612 7.336 8.110 1095 HA LEU 127 HA LEU 127 11.088 9.645 9.793 1096 HB2 LEU 127 2HB LEU 127 9.196 7.771 8.323 1097 HB3 LEU 127 3HB LEU 127 8.663 9.163 9.255 1098 HG LEU 127 HG LEU 127 10.336 9.223 6.708 1099 HD11 LEU 127 1HD1 LEU 127 8.401 10.320 5.704 1100 HD12 LEU 127 2HD1 LEU 127 7.507 10.188 7.221 1101 HD13 LEU 127 3HD1 LEU 127 7.965 8.732 6.332 1102 HD21 LEU 127 3HD2 LEU 127 9.424 11.571 8.413 1103 HD22 LEU 127 1HD2 LEU 127 10.193 11.680 6.823 1104 HD23 LEU 127 2HD2 LEU 127 11.088 11.023 8.188 1105 H GLU 128 H GLU 128 11.384 6.288 10.294 1106 HA GLU 128 HA GLU 128 9.864 5.942 12.656 1107 HB2 GLU 128 2HB GLU 128 10.740 4.018 11.469 1108 HB3 GLU 128 3HB GLU 128 12.389 4.600 11.609 1109 HG2 GLU 128 2HG GLU 128 11.859 2.661 13.090 1110 HG3 GLU 128 3HG GLU 128 12.474 4.079 13.948 1111 H HIS 129 H HIS 129 13.073 7.321 12.033 1112 HA HIS 129 HA HIS 129 13.831 7.770 14.757 1113 HB2 HIS 129 2HB HIS 129 14.723 9.188 12.210 1114 HB3 HIS 129 3HB HIS 129 15.472 9.408 13.787 1115 HD1 HIS 129 HD1 HIS 129 15.836 7.513 10.772 1116 HD2 HIS 129 HD2 HIS 129 16.569 6.806 14.803 1117 HE1 HIS 129 HE1 HIS 129 17.456 5.596 10.839 1118 HE2 HIS 129 HE2 HIS 129 18.026 5.322 13.274 1119 H HIS 130 H HIS 130 11.988 9.601 12.363 1120 HA HIS 130 HA HIS 130 11.747 11.999 13.936 1121 HB2 HIS 130 2HB HIS 130 11.646 11.993 11.415 1122 HB3 HIS 130 3HB HIS 130 10.102 11.158 11.501 1123 HD1 HIS 130 HD1 HIS 130 11.576 14.513 11.501 1124 HD2 HIS 130 HD2 HIS 130 7.995 12.813 12.743 1125 HE1 HIS 130 HE1 HIS 130 9.969 16.421 11.762 1126 HE2 HIS 130 HE2 HIS 130 7.767 15.332 12.307 1127 H HIS 131 H HIS 131 10.884 11.461 15.900 1128 HA HIS 131 HA HIS 131 7.977 11.169 15.974 1129 HB2 HIS 131 2HB HIS 131 8.093 9.547 17.914 1130 HB3 HIS 131 3HB HIS 131 8.576 8.864 16.371 1131 HD1 HIS 131 HD1 HIS 131 11.101 8.267 16.065 1132 HD2 HIS 131 HD2 HIS 131 10.071 9.470 19.906 1133 HE1 HIS 131 HE1 HIS 131 13.019 7.582 17.527 1134 HE2 HIS 131 HE2 HIS 131 12.309 8.189 19.862 1135 H HIS 132 H HIS 132 7.244 12.801 17.091 1136 HA HIS 132 HA HIS 132 9.023 14.678 18.324 1137 HB2 HIS 132 2HB HIS 132 7.212 15.479 16.903 1138 HB3 HIS 132 3HB HIS 132 6.004 14.667 17.892 1139 HD1 HIS 132 HD1 HIS 132 8.745 17.245 18.651 1140 HD2 HIS 132 HD2 HIS 132 4.707 16.550 19.348 1141 HE1 HIS 132 HE1 HIS 132 7.963 19.149 20.089 1142 HE2 HIS 132 HE2 HIS 132 5.539 18.658 20.561 1143 H HIS 133 H HIS 133 9.214 15.252 20.432 1144 HA HIS 133 HA HIS 133 8.514 13.411 22.495 1145 HB2 HIS 133 2HB HIS 133 9.809 16.171 22.571 1146 HB3 HIS 133 3HB HIS 133 9.458 15.271 24.044 1147 HD1 HIS 133 HD1 HIS 133 10.994 13.362 24.662 1148 HD2 HIS 133 HD2 HIS 133 11.861 14.980 20.936 1149 HE1 HIS 133 HE1 HIS 133 13.178 12.345 23.975 1150 HE2 HIS 133 HE2 HIS 133 13.555 13.173 21.627 1151 H HIS 134 H HIS 134 7.061 13.612 24.186 1152 HA HIS 134 HA HIS 134 4.709 15.314 23.577 1153 HB2 HIS 134 2HB HIS 134 4.835 12.634 25.035 1154 HB3 HIS 134 3HB HIS 134 3.368 13.547 24.686 1155 HD1 HIS 134 HD1 HIS 134 4.986 10.703 23.500 1156 HD2 HIS 134 HD2 HIS 134 3.398 14.041 21.591 1157 HE1 HIS 134 HE1 HIS 134 4.613 10.010 21.111 1158 HE2 HIS 134 HE2 HIS 134 3.584 12.018 20.006 Start of MODEL 9 1 H1 MET 1 1H MET 1 0.549 5.830 16.332 2 H2 MET 1 2H MET 1 0.580 6.901 15.027 3 H3 MET 1 3H MET 1 0.642 7.493 16.604 4 HA MET 1 HA MET 1 2.783 7.541 15.472 5 HB2 MET 1 2HB MET 1 4.066 6.593 17.378 6 HB3 MET 1 3HB MET 1 2.688 7.535 17.918 7 HG2 MET 1 2HG MET 1 1.442 5.463 18.384 8 HG3 MET 1 3HG MET 1 2.819 4.509 17.825 9 HE1 MET 1 3HE MET 1 2.922 3.924 21.708 10 HE2 MET 1 1HE MET 1 2.800 3.164 20.122 11 HE3 MET 1 2HE MET 1 1.457 4.125 20.747 12 H LYS 2 H LYS 2 1.537 5.841 13.697 13 HA LYS 2 HA LYS 2 3.708 3.974 13.140 14 HB2 LYS 2 2HB LYS 2 2.235 2.109 12.538 15 HB3 LYS 2 3HB LYS 2 2.019 2.536 14.230 16 HG2 LYS 2 2HG LYS 2 -0.094 3.703 13.679 17 HG3 LYS 2 3HG LYS 2 0.136 3.314 11.971 18 HD2 LYS 2 2HD LYS 2 -1.472 1.757 12.990 19 HD3 LYS 2 3HD LYS 2 -0.017 0.896 12.486 20 HE2 LYS 2 2HE LYS 2 0.799 0.961 14.833 21 HE3 LYS 2 3HE LYS 2 -0.700 1.758 15.316 22 HZ1 LYS 2 3HZ LYS 2 -0.709 -0.641 15.732 23 HZ2 LYS 2 1HZ LYS 2 -0.542 -0.944 14.079 24 HZ3 LYS 2 2HZ LYS 2 -1.937 -0.184 14.668 25 H ILE 3 H ILE 3 4.264 3.962 11.044 26 HA ILE 3 HA ILE 3 2.691 5.427 9.050 27 HB ILE 3 HB ILE 3 5.516 4.249 8.919 28 HG12 ILE 3 2HG1 ILE 3 4.516 7.122 9.183 29 HG13 ILE 3 3HG1 ILE 3 5.403 6.203 10.393 30 HG21 ILE 3 1HG2 ILE 3 4.075 5.922 6.819 31 HG22 ILE 3 2HG2 ILE 3 4.496 4.215 6.673 32 HG23 ILE 3 3HG2 ILE 3 5.769 5.430 6.752 33 HD11 ILE 3 3HD1 ILE 3 6.830 7.818 9.355 34 HD12 ILE 3 1HD1 ILE 3 6.461 7.189 7.749 35 HD13 ILE 3 2HD1 ILE 3 7.366 6.201 8.900 36 H LEU 4 H LEU 4 1.780 4.429 7.292 37 HA LEU 4 HA LEU 4 1.651 1.482 7.295 38 HB2 LEU 4 2HB LEU 4 -0.397 3.449 6.205 39 HB3 LEU 4 3HB LEU 4 -0.580 1.704 6.334 40 HG LEU 4 HG LEU 4 -0.403 3.651 8.670 41 HD11 LEU 4 1HD1 LEU 4 -2.763 3.077 9.049 42 HD12 LEU 4 2HD1 LEU 4 -2.763 2.089 7.586 43 HD13 LEU 4 3HD1 LEU 4 -2.515 3.832 7.477 44 HD21 LEU 4 3HD2 LEU 4 -0.940 1.734 10.114 45 HD22 LEU 4 1HD2 LEU 4 0.597 1.496 9.284 46 HD23 LEU 4 2HD2 LEU 4 -0.846 0.646 8.726 47 H ILE 5 H ILE 5 2.830 0.625 5.708 48 HA ILE 5 HA ILE 5 3.292 2.034 3.177 49 HB ILE 5 HB ILE 5 4.224 -0.776 3.958 50 HG12 ILE 5 2HG1 ILE 5 5.132 0.806 5.625 51 HG13 ILE 5 3HG1 ILE 5 6.418 0.209 4.588 52 HG21 ILE 5 1HG2 ILE 5 5.221 1.133 1.803 53 HG22 ILE 5 2HG2 ILE 5 4.302 -0.355 1.551 54 HG23 ILE 5 3HG2 ILE 5 5.941 -0.431 2.197 55 HD11 ILE 5 3HD1 ILE 5 6.704 2.562 5.048 56 HD12 ILE 5 1HD1 ILE 5 5.097 2.915 4.411 57 HD13 ILE 5 2HD1 ILE 5 6.365 2.324 3.335 58 H LEU 6 H LEU 6 1.591 1.930 1.797 59 HA LEU 6 HA LEU 6 -0.224 -0.388 1.786 60 HB2 LEU 6 2HB LEU 6 -0.813 2.274 1.790 61 HB3 LEU 6 3HB LEU 6 -0.680 2.057 0.061 62 HG LEU 6 HG LEU 6 -2.993 1.880 0.579 63 HD11 LEU 6 1HD1 LEU 6 -2.332 0.173 -1.036 64 HD12 LEU 6 2HD1 LEU 6 -3.685 -0.381 -0.055 65 HD13 LEU 6 3HD1 LEU 6 -2.057 -0.986 0.266 66 HD21 LEU 6 3HD2 LEU 6 -3.932 0.373 2.304 67 HD22 LEU 6 1HD2 LEU 6 -2.870 1.607 2.976 68 HD23 LEU 6 2HD2 LEU 6 -2.296 -0.053 2.803 69 H ILE 7 H ILE 7 0.004 -1.884 0.192 70 HA ILE 7 HA ILE 7 1.310 -1.165 -2.374 71 HB ILE 7 HB ILE 7 1.696 -3.792 -0.827 72 HG12 ILE 7 2HG1 ILE 7 3.731 -1.576 -1.414 73 HG13 ILE 7 3HG1 ILE 7 2.974 -1.869 0.148 74 HG21 ILE 7 1HG2 ILE 7 3.283 -4.414 -2.624 75 HG22 ILE 7 2HG2 ILE 7 2.892 -2.933 -3.499 76 HG23 ILE 7 3HG2 ILE 7 1.658 -4.173 -3.263 77 HD11 ILE 7 3HD1 ILE 7 4.053 -4.054 0.259 78 HD12 ILE 7 1HD1 ILE 7 5.211 -2.736 0.096 79 HD13 ILE 7 2HD1 ILE 7 4.830 -3.745 -1.299 80 H ASN 8 H ASN 8 -0.031 -1.566 -4.031 81 HA ASN 8 HA ASN 8 -2.074 -3.703 -3.843 82 HB2 ASN 8 2HB ASN 8 -3.054 -1.407 -4.055 83 HB3 ASN 8 3HB ASN 8 -2.191 -1.188 -5.572 84 HD21 ASN 8 1HD2 ASN 8 -2.848 -2.498 -7.406 85 HD22 ASN 8 2HD2 ASN 8 -4.425 -3.203 -7.456 86 H THR 9 H THR 9 -1.520 -5.364 -5.064 87 HA THR 9 HA THR 9 -0.174 -4.913 -7.668 88 HB THR 9 HB THR 9 1.463 -5.921 -6.165 89 HG1 THR 9 HG1 THR 9 2.025 -7.026 -7.862 90 HG21 THR 9 3HG2 THR 9 -0.553 -8.157 -5.688 91 HG22 THR 9 1HG2 THR 9 -0.048 -6.945 -4.504 92 HG23 THR 9 2HG2 THR 9 1.112 -8.126 -5.107 93 H ASN 10 H ASN 10 -0.975 -6.062 -9.375 94 HA ASN 10 HA ASN 10 -3.604 -7.315 -9.043 95 HB2 ASN 10 2HB ASN 10 -2.015 -6.509 -11.521 96 HB3 ASN 10 3HB ASN 10 -3.607 -7.263 -11.576 97 HD21 ASN 10 1HD2 ASN 10 -2.548 -4.513 -12.356 98 HD22 ASN 10 2HD2 ASN 10 -3.655 -3.414 -11.620 99 H ASN 11 H ASN 11 -0.392 -8.250 -9.142 100 HA ASN 11 HA ASN 11 -1.017 -11.050 -9.879 101 HB2 ASN 11 2HB ASN 11 1.638 -9.551 -9.801 102 HB3 ASN 11 3HB ASN 11 1.493 -11.282 -10.100 103 HD21 ASN 11 1HD2 ASN 11 2.446 -8.961 -11.793 104 HD22 ASN 11 2HD2 ASN 11 1.580 -9.135 -13.276 105 H ASP 12 H ASP 12 -1.413 -12.270 -8.193 106 HA ASP 12 HA ASP 12 -1.031 -11.582 -5.488 107 HB2 ASP 12 2HB ASP 12 -1.694 -14.291 -6.726 108 HB3 ASP 12 3HB ASP 12 -1.802 -13.928 -5.004 109 H GLU 13 H GLU 13 1.152 -13.073 -7.690 110 HA GLU 13 HA GLU 13 2.815 -14.567 -6.018 111 HB2 GLU 13 2HB GLU 13 3.705 -12.791 -8.328 112 HB3 GLU 13 3HB GLU 13 4.620 -14.132 -7.643 113 HG2 GLU 13 2HG GLU 13 1.994 -14.310 -9.130 114 HG3 GLU 13 3HG GLU 13 3.571 -14.753 -9.763 115 H LEU 14 H LEU 14 2.716 -11.073 -6.636 116 HA LEU 14 HA LEU 14 5.029 -10.364 -5.169 117 HB2 LEU 14 2HB LEU 14 2.606 -8.750 -5.992 118 HB3 LEU 14 3HB LEU 14 3.890 -8.040 -5.030 119 HG LEU 14 HG LEU 14 4.191 -7.444 -7.347 120 HD11 LEU 14 1HD1 LEU 14 6.227 -7.748 -6.040 121 HD12 LEU 14 2HD1 LEU 14 6.490 -8.157 -7.731 122 HD13 LEU 14 3HD1 LEU 14 6.321 -9.443 -6.533 123 HD21 LEU 14 3HD2 LEU 14 2.988 -9.301 -8.398 124 HD22 LEU 14 1HD2 LEU 14 4.319 -10.399 -8.014 125 HD23 LEU 14 2HD2 LEU 14 4.569 -9.051 -9.128 126 H ILE 15 H ILE 15 1.725 -10.944 -4.122 127 HA ILE 15 HA ILE 15 1.832 -9.596 -1.628 128 HB ILE 15 HB ILE 15 0.186 -12.088 -2.301 129 HG12 ILE 15 2HG1 ILE 15 -0.487 -9.132 -2.684 130 HG13 ILE 15 3HG1 ILE 15 -0.248 -10.326 -3.955 131 HG21 ILE 15 1HG2 ILE 15 0.263 -11.611 0.128 132 HG22 ILE 15 2HG2 ILE 15 -1.349 -11.321 -0.519 133 HG23 ILE 15 3HG2 ILE 15 -0.284 -9.958 -0.167 134 HD11 ILE 15 3HD1 ILE 15 -2.590 -9.849 -3.626 135 HD12 ILE 15 1HD1 ILE 15 -2.481 -10.328 -1.934 136 HD13 ILE 15 2HD1 ILE 15 -2.235 -11.524 -3.210 137 H LYS 16 H LYS 16 2.244 -13.058 -2.418 138 HA LYS 16 HA LYS 16 3.021 -13.874 0.182 139 HB2 LYS 16 2HB LYS 16 3.619 -16.031 -0.905 140 HB3 LYS 16 3HB LYS 16 2.029 -15.447 -1.382 141 HG2 LYS 16 2HG LYS 16 3.110 -14.535 -3.488 142 HG3 LYS 16 3HG LYS 16 4.570 -15.413 -3.031 143 HD2 LYS 16 2HD LYS 16 1.840 -16.650 -3.577 144 HD3 LYS 16 3HD LYS 16 3.213 -16.664 -4.681 145 HE2 LYS 16 2HE LYS 16 4.494 -18.016 -3.032 146 HE3 LYS 16 3HE LYS 16 3.085 -18.026 -1.968 147 HZ1 LYS 16 3HZ LYS 16 3.204 -20.055 -3.269 148 HZ2 LYS 16 1HZ LYS 16 3.193 -19.171 -4.711 149 HZ3 LYS 16 2HZ LYS 16 1.836 -19.166 -3.711 150 H LYS 17 H LYS 17 4.904 -12.872 -2.652 151 HA LYS 17 HA LYS 17 7.479 -13.545 -1.652 152 HB2 LYS 17 2HB LYS 17 6.626 -11.591 -3.831 153 HB3 LYS 17 3HB LYS 17 8.313 -11.943 -3.459 154 HG2 LYS 17 2HG LYS 17 7.981 -14.308 -4.043 155 HG3 LYS 17 3HG LYS 17 6.270 -14.011 -4.344 156 HD2 LYS 17 2HD LYS 17 7.485 -14.117 -6.464 157 HD3 LYS 17 3HD LYS 17 6.864 -12.486 -6.208 158 HE2 LYS 17 2HE LYS 17 9.146 -12.434 -7.094 159 HE3 LYS 17 3HE LYS 17 9.097 -11.747 -5.471 160 HZ1 LYS 17 3HZ LYS 17 10.046 -14.457 -6.224 161 HZ2 LYS 17 1HZ LYS 17 9.889 -13.918 -4.633 162 HZ3 LYS 17 2HZ LYS 17 10.990 -13.174 -5.665 163 H ILE 18 H ILE 18 5.737 -10.420 -1.712 164 HA ILE 18 HA ILE 18 7.744 -8.856 -0.471 165 HB ILE 18 HB ILE 18 4.738 -8.424 -0.775 166 HG12 ILE 18 2HG1 ILE 18 7.130 -6.991 -2.035 167 HG13 ILE 18 3HG1 ILE 18 6.208 -8.277 -2.804 168 HG21 ILE 18 1HG2 ILE 18 6.666 -6.430 0.480 169 HG22 ILE 18 2HG2 ILE 18 5.331 -7.247 1.295 170 HG23 ILE 18 3HG2 ILE 18 4.999 -6.090 0.008 171 HD11 ILE 18 3HD1 ILE 18 5.171 -5.552 -2.053 172 HD12 ILE 18 1HD1 ILE 18 4.219 -6.847 -2.785 173 HD13 ILE 18 2HD1 ILE 18 5.565 -6.134 -3.670 174 H LYS 19 H LYS 19 5.164 -10.885 0.877 175 HA LYS 19 HA LYS 19 5.287 -10.119 3.582 176 HB2 LYS 19 2HB LYS 19 4.639 -12.805 2.302 177 HB3 LYS 19 3HB LYS 19 4.544 -12.554 4.044 178 HG2 LYS 19 2HG LYS 19 2.872 -10.784 3.708 179 HG3 LYS 19 3HG LYS 19 2.957 -11.020 1.963 180 HD2 LYS 19 2HD LYS 19 2.086 -13.314 2.225 181 HD3 LYS 19 3HD LYS 19 2.061 -13.116 3.980 182 HE2 LYS 19 2HE LYS 19 0.414 -11.262 3.719 183 HE3 LYS 19 3HE LYS 19 0.408 -11.541 1.978 184 HZ1 LYS 19 3HZ LYS 19 -0.493 -13.735 2.336 185 HZ2 LYS 19 1HZ LYS 19 -1.466 -12.596 3.122 186 HZ3 LYS 19 2HZ LYS 19 -0.400 -13.554 4.015 187 H LYS 20 H LYS 20 7.382 -12.311 1.729 188 HA LYS 20 HA LYS 20 8.929 -13.175 4.011 189 HB2 LYS 20 2HB LYS 20 9.932 -13.288 1.140 190 HB3 LYS 20 3HB LYS 20 10.313 -14.370 2.471 191 HG2 LYS 20 2HG LYS 20 7.712 -14.208 0.935 192 HG3 LYS 20 3HG LYS 20 8.912 -15.494 0.836 193 HD2 LYS 20 2HD LYS 20 8.395 -16.100 3.213 194 HD3 LYS 20 3HD LYS 20 7.159 -14.834 3.239 195 HE2 LYS 20 2HE LYS 20 5.991 -15.988 1.354 196 HE3 LYS 20 3HE LYS 20 7.180 -17.291 1.448 197 HZ1 LYS 20 3HZ LYS 20 5.266 -16.494 3.588 198 HZ2 LYS 20 1HZ LYS 20 6.439 -17.700 3.744 199 HZ3 LYS 20 2HZ LYS 20 5.178 -17.888 2.641 200 H GLU 21 H GLU 21 9.444 -10.918 1.341 201 HA GLU 21 HA GLU 21 11.927 -9.867 1.838 202 HB2 GLU 21 2HB GLU 21 9.493 -8.330 0.857 203 HB3 GLU 21 3HB GLU 21 11.160 -7.794 0.683 204 HG2 GLU 21 2HG GLU 21 9.861 -10.185 -0.630 205 HG3 GLU 21 3HG GLU 21 10.375 -8.694 -1.414 206 H VAL 22 H VAL 22 8.878 -8.590 3.184 207 HA VAL 22 HA VAL 22 10.323 -6.571 4.717 208 HB VAL 22 HB VAL 22 8.214 -5.508 5.141 209 HG11 VAL 22 1HG1 VAL 22 7.450 -5.066 2.827 210 HG12 VAL 22 2HG1 VAL 22 8.326 -6.489 2.259 211 HG13 VAL 22 3HG1 VAL 22 9.210 -5.119 2.934 212 HG21 VAL 22 3HG2 VAL 22 6.792 -7.431 5.629 213 HG22 VAL 22 1HG2 VAL 22 6.851 -7.951 3.943 214 HG23 VAL 22 2HG2 VAL 22 6.045 -6.442 4.377 215 H GLU 23 H GLU 23 9.365 -9.724 5.252 216 HA GLU 23 HA GLU 23 8.934 -9.759 8.055 217 HB2 GLU 23 2HB GLU 23 8.654 -11.747 6.586 218 HB3 GLU 23 3HB GLU 23 10.383 -11.780 6.277 219 HG2 GLU 23 2HG GLU 23 9.862 -13.501 7.861 220 HG3 GLU 23 3HG GLU 23 10.764 -12.239 8.700 221 H ASN 24 H ASN 24 11.820 -9.702 6.022 222 HA ASN 24 HA ASN 24 13.807 -9.809 8.068 223 HB2 ASN 24 2HB ASN 24 14.039 -8.695 5.232 224 HB3 ASN 24 3HB ASN 24 15.389 -9.098 6.282 225 HD21 ASN 24 1HD2 ASN 24 12.973 -10.327 4.139 226 HD22 ASN 24 2HD2 ASN 24 13.518 -11.966 4.118 227 H GLN 25 H GLN 25 11.661 -7.324 7.199 228 HA GLN 25 HA GLN 25 13.477 -5.126 7.991 229 HB2 GLN 25 2HB GLN 25 10.821 -4.858 6.530 230 HB3 GLN 25 3HB GLN 25 12.100 -3.657 6.678 231 HG2 GLN 25 2HG GLN 25 12.233 -6.230 5.081 232 HG3 GLN 25 3HG GLN 25 12.027 -4.614 4.425 233 HE21 GLN 25 1HE2 GLN 25 13.990 -3.313 6.041 234 HE22 GLN 25 2HE2 GLN 25 15.539 -3.879 5.541 235 H GLY 26 H GLY 26 11.093 -7.065 9.242 236 HA2 GLY 26 2HA GLY 26 9.852 -7.027 11.146 237 HA3 GLY 26 3HA GLY 26 10.753 -5.597 11.607 238 H TYR 27 H TYR 27 8.752 -5.685 8.703 239 HA TYR 27 HA TYR 27 6.818 -3.818 9.946 240 HB2 TYR 27 2HB TYR 27 7.484 -4.453 7.040 241 HB3 TYR 27 3HB TYR 27 6.005 -3.603 7.478 242 HD1 TYR 27 HD2 TYR 27 9.737 -3.380 7.710 243 HD2 TYR 27 HD1 TYR 27 6.038 -1.250 7.896 244 HE1 TYR 27 HE2 TYR 27 10.968 -1.249 7.756 245 HE2 TYR 27 HE1 TYR 27 7.265 0.883 7.949 246 HH TYR 27 HH TYR 27 10.618 1.134 7.276 247 H GLN 28 H GLN 28 4.898 -4.604 10.601 248 HA GLN 28 HA GLN 28 4.329 -7.414 10.341 249 HB2 GLN 28 2HB GLN 28 2.721 -5.191 11.668 250 HB3 GLN 28 3HB GLN 28 2.350 -6.909 11.792 251 HG2 GLN 28 2HG GLN 28 4.827 -5.513 12.838 252 HG3 GLN 28 3HG GLN 28 3.501 -6.169 13.795 253 HE21 GLN 28 1HE2 GLN 28 6.372 -6.790 13.880 254 HE22 GLN 28 2HE2 GLN 28 6.515 -8.488 13.597 255 H VAL 29 H VAL 29 3.308 -8.312 8.707 256 HA VAL 29 HA VAL 29 2.092 -6.633 6.664 257 HB VAL 29 HB VAL 29 2.319 -9.671 6.412 258 HG11 VAL 29 1HG1 VAL 29 2.601 -9.087 3.999 259 HG12 VAL 29 2HG1 VAL 29 2.401 -7.383 4.401 260 HG13 VAL 29 3HG1 VAL 29 1.073 -8.517 4.667 261 HG21 VAL 29 3HG2 VAL 29 4.591 -9.438 5.493 262 HG22 VAL 29 1HG2 VAL 29 4.528 -8.946 7.188 263 HG23 VAL 29 2HG2 VAL 29 4.599 -7.723 5.918 264 H ARG 30 H ARG 30 0.007 -6.384 6.447 265 HA ARG 30 HA ARG 30 -1.875 -8.555 7.060 266 HB2 ARG 30 2HB ARG 30 -2.128 -5.599 7.730 267 HB3 ARG 30 3HB ARG 30 -3.582 -6.535 7.386 268 HG2 ARG 30 2HG ARG 30 -1.575 -7.091 9.593 269 HG3 ARG 30 3HG ARG 30 -3.196 -6.416 9.781 270 HD2 ARG 30 2HD ARG 30 -2.481 -9.225 8.854 271 HD3 ARG 30 3HD ARG 30 -3.283 -8.762 10.365 272 HE ARG 30 HE ARG 30 -5.105 -7.869 8.889 273 HH11 ARG 30 1HH1 ARG 30 -3.209 -10.650 7.855 274 HH12 ARG 30 2HH1 ARG 30 -4.474 -11.260 6.835 275 HH21 ARG 30 1HH2 ARG 30 -6.723 -8.655 7.500 276 HH22 ARG 30 2HH2 ARG 30 -6.449 -10.139 6.631 277 H ASP 31 H ASP 31 -3.584 -8.734 5.605 278 HA ASP 31 HA ASP 31 -3.441 -7.225 3.087 279 HB2 ASP 31 2HB ASP 31 -3.495 -9.377 1.785 280 HB3 ASP 31 3HB ASP 31 -1.990 -9.131 2.653 281 H VAL 32 H VAL 32 -5.430 -6.900 2.192 282 HA VAL 32 HA VAL 32 -7.781 -8.022 3.623 283 HB VAL 32 HB VAL 32 -7.437 -5.165 2.578 284 HG11 VAL 32 1HG1 VAL 32 -9.809 -6.410 4.016 285 HG12 VAL 32 2HG1 VAL 32 -9.743 -5.972 2.307 286 HG13 VAL 32 3HG1 VAL 32 -9.648 -4.718 3.540 287 HG21 VAL 32 3HG2 VAL 32 -6.176 -5.553 4.672 288 HG22 VAL 32 1HG2 VAL 32 -7.642 -6.142 5.467 289 HG23 VAL 32 2HG2 VAL 32 -7.532 -4.458 4.939 290 H ASN 33 H ASN 33 -8.988 -9.192 2.298 291 HA ASN 33 HA ASN 33 -9.012 -8.788 -0.599 292 HB2 ASN 33 2HB ASN 33 -8.501 -11.048 0.287 293 HB3 ASN 33 3HB ASN 33 -10.029 -11.065 1.162 294 HD21 ASN 33 1HD2 ASN 33 -10.878 -12.830 0.156 295 HD22 ASN 33 2HD2 ASN 33 -11.307 -12.868 -1.512 296 H ASP 34 H ASP 34 -10.985 -8.198 2.204 297 HA ASP 34 HA ASP 34 -13.477 -8.084 0.585 298 HB2 ASP 34 2HB ASP 34 -13.183 -9.057 3.458 299 HB3 ASP 34 3HB ASP 34 -14.709 -8.860 2.606 300 H SER 35 H SER 35 -14.835 -6.336 0.971 301 HA SER 35 HA SER 35 -13.795 -3.960 2.075 302 HB2 SER 35 2HB SER 35 -16.668 -4.649 1.327 303 HB3 SER 35 3HB SER 35 -16.042 -3.016 1.576 304 HG SER 35 HG SER 35 -14.869 -4.773 -0.310 305 H ASP 36 H ASP 36 -16.111 -6.313 3.344 306 HA ASP 36 HA ASP 36 -16.962 -4.968 5.669 307 HB2 ASP 36 2HB ASP 36 -18.105 -6.983 4.760 308 HB3 ASP 36 3HB ASP 36 -16.722 -7.978 5.203 309 H GLU 37 H GLU 37 -14.195 -7.021 5.023 310 HA GLU 37 HA GLU 37 -13.150 -7.144 7.701 311 HB2 GLU 37 2HB GLU 37 -11.805 -7.635 4.997 312 HB3 GLU 37 3HB GLU 37 -11.073 -7.993 6.558 313 HG2 GLU 37 2HG GLU 37 -13.575 -9.275 5.426 314 HG3 GLU 37 3HG GLU 37 -11.974 -10.009 5.508 315 H LEU 38 H LEU 38 -12.596 -5.122 4.837 316 HA LEU 38 HA LEU 38 -10.319 -3.718 5.508 317 HB2 LEU 38 2HB LEU 38 -11.367 -3.668 3.324 318 HB3 LEU 38 3HB LEU 38 -12.786 -2.861 3.948 319 HG LEU 38 HG LEU 38 -10.138 -1.404 4.157 320 HD11 LEU 38 1HD1 LEU 38 -10.128 -2.279 1.870 321 HD12 LEU 38 2HD1 LEU 38 -10.345 -0.534 1.891 322 HD13 LEU 38 3HD1 LEU 38 -11.729 -1.588 1.579 323 HD21 LEU 38 3HD2 LEU 38 -11.509 0.593 3.762 324 HD22 LEU 38 1HD2 LEU 38 -12.178 -0.346 5.096 325 HD23 LEU 38 2HD2 LEU 38 -12.942 -0.408 3.506 326 H LYS 39 H LYS 39 -13.700 -2.744 6.101 327 HA LYS 39 HA LYS 39 -13.151 -0.294 7.368 328 HB2 LYS 39 2HB LYS 39 -15.580 -2.100 7.716 329 HB3 LYS 39 3HB LYS 39 -15.513 -0.386 8.126 330 HG2 LYS 39 2HG LYS 39 -15.114 0.154 5.728 331 HG3 LYS 39 3HG LYS 39 -15.216 -1.566 5.344 332 HD2 LYS 39 2HD LYS 39 -17.339 -0.531 4.810 333 HD3 LYS 39 3HD LYS 39 -17.569 -1.583 6.208 334 HE2 LYS 39 2HE LYS 39 -17.436 0.407 7.692 335 HE3 LYS 39 3HE LYS 39 -17.260 1.438 6.270 336 HZ1 LYS 39 3HZ LYS 39 -19.440 0.669 5.513 337 HZ2 LYS 39 1HZ LYS 39 -19.537 1.427 7.019 338 HZ3 LYS 39 2HZ LYS 39 -19.620 -0.256 6.914 339 H LYS 40 H LYS 40 -13.477 -3.565 8.668 340 HA LYS 40 HA LYS 40 -13.481 -2.820 11.441 341 HB2 LYS 40 2HB LYS 40 -13.014 -5.510 10.095 342 HB3 LYS 40 3HB LYS 40 -13.057 -5.294 11.839 343 HG2 LYS 40 2HG LYS 40 -15.391 -4.227 11.463 344 HG3 LYS 40 3HG LYS 40 -15.316 -4.963 9.861 345 HD2 LYS 40 2HD LYS 40 -15.160 -6.423 12.526 346 HD3 LYS 40 3HD LYS 40 -16.547 -6.388 11.439 347 HE2 LYS 40 2HE LYS 40 -13.841 -7.631 10.856 348 HE3 LYS 40 3HE LYS 40 -15.336 -8.495 11.223 349 HZ1 LYS 40 3HZ LYS 40 -14.940 -8.499 8.882 350 HZ2 LYS 40 1HZ LYS 40 -14.838 -6.819 8.831 351 HZ3 LYS 40 2HZ LYS 40 -16.302 -7.576 9.199 352 H GLU 41 H GLU 41 -10.976 -3.620 9.121 353 HA GLU 41 HA GLU 41 -8.884 -3.774 11.136 354 HB2 GLU 41 2HB GLU 41 -8.653 -3.942 8.102 355 HB3 GLU 41 3HB GLU 41 -7.356 -4.258 9.261 356 HG2 GLU 41 2HG GLU 41 -8.888 -6.056 10.270 357 HG3 GLU 41 3HG GLU 41 -9.900 -5.835 8.854 358 H MET 42 H MET 42 -10.230 -1.354 9.050 359 HA MET 42 HA MET 42 -8.211 0.621 9.383 360 HB2 MET 42 2HB MET 42 -11.214 0.911 8.975 361 HB3 MET 42 3HB MET 42 -10.082 2.254 8.915 362 HG2 MET 42 2HG MET 42 -9.779 -0.104 7.065 363 HG3 MET 42 3HG MET 42 -10.893 1.202 6.701 364 HE1 MET 42 3HE MET 42 -7.256 -0.023 6.746 365 HE2 MET 42 1HE MET 42 -7.054 1.108 8.083 366 HE3 MET 42 2HE MET 42 -6.300 1.440 6.524 367 H LYS 43 H LYS 43 -10.892 -0.504 11.372 368 HA LYS 43 HA LYS 43 -10.578 1.422 13.477 369 HB2 LYS 43 2HB LYS 43 -11.700 -1.406 13.693 370 HB3 LYS 43 3HB LYS 43 -11.929 -0.102 14.851 371 HG2 LYS 43 2HG LYS 43 -13.167 1.162 13.042 372 HG3 LYS 43 3HG LYS 43 -13.066 -0.292 12.049 373 HD2 LYS 43 2HD LYS 43 -14.503 -0.006 14.718 374 HD3 LYS 43 3HD LYS 43 -15.245 -0.197 13.131 375 HE2 LYS 43 2HE LYS 43 -15.419 -2.327 14.134 376 HE3 LYS 43 3HE LYS 43 -14.061 -2.483 13.029 377 HZ1 LYS 43 3HZ LYS 43 -13.746 -1.928 15.936 378 HZ2 LYS 43 1HZ LYS 43 -12.538 -2.392 14.849 379 HZ3 LYS 43 2HZ LYS 43 -13.747 -3.483 15.285 380 H LYS 44 H LYS 44 -9.357 -1.871 12.867 381 HA LYS 44 HA LYS 44 -8.105 -2.472 15.254 382 HB2 LYS 44 2HB LYS 44 -7.549 -3.317 12.399 383 HB3 LYS 44 3HB LYS 44 -6.468 -3.856 13.674 384 HG2 LYS 44 2HG LYS 44 -9.455 -4.370 13.652 385 HG3 LYS 44 3HG LYS 44 -8.243 -5.501 13.056 386 HD2 LYS 44 2HD LYS 44 -8.367 -4.482 15.925 387 HD3 LYS 44 3HD LYS 44 -9.062 -6.006 15.379 388 HE2 LYS 44 2HE LYS 44 -6.964 -6.588 16.345 389 HE3 LYS 44 3HE LYS 44 -6.700 -6.655 14.607 390 HZ1 LYS 44 3HZ LYS 44 -4.871 -5.572 15.802 391 HZ2 LYS 44 1HZ LYS 44 -5.928 -4.377 16.367 392 HZ3 LYS 44 2HZ LYS 44 -5.601 -4.511 14.714 393 H LEU 45 H LEU 45 -6.715 -0.717 12.499 394 HA LEU 45 HA LEU 45 -4.125 -0.333 13.537 395 HB2 LEU 45 2HB LEU 45 -5.702 1.451 11.636 396 HB3 LEU 45 3HB LEU 45 -3.959 1.518 11.879 397 HG LEU 45 HG LEU 45 -5.497 -0.842 10.720 398 HD11 LEU 45 1HD1 LEU 45 -5.387 1.036 9.171 399 HD12 LEU 45 2HD1 LEU 45 -4.407 -0.314 8.602 400 HD13 LEU 45 3HD1 LEU 45 -3.631 1.092 9.337 401 HD21 LEU 45 3HD2 LEU 45 -3.577 -1.659 11.974 402 HD22 LEU 45 1HD2 LEU 45 -2.506 -0.536 11.129 403 HD23 LEU 45 2HD2 LEU 45 -3.291 -1.848 10.247 404 H ALA 46 H ALA 46 -7.091 1.481 14.038 405 HA ALA 46 HA ALA 46 -5.847 3.645 15.533 406 HB1 ALA 46 3HB ALA 46 -8.779 3.010 15.050 407 HB2 ALA 46 1HB ALA 46 -7.769 4.062 14.061 408 HB3 ALA 46 2HB ALA 46 -8.135 4.514 15.724 409 H GLU 47 H GLU 47 -7.296 0.545 16.300 410 HA GLU 47 HA GLU 47 -7.934 1.232 19.089 411 HB2 GLU 47 2HB GLU 47 -8.203 -1.381 17.519 412 HB3 GLU 47 3HB GLU 47 -8.719 -1.169 19.190 413 HG2 GLU 47 2HG GLU 47 -10.459 0.336 18.578 414 HG3 GLU 47 3HG GLU 47 -9.846 0.525 16.936 415 H GLU 48 H GLU 48 -5.767 -0.711 17.174 416 HA GLU 48 HA GLU 48 -4.053 -1.442 19.446 417 HB2 GLU 48 2HB GLU 48 -4.666 -3.245 17.911 418 HB3 GLU 48 3HB GLU 48 -4.096 -2.334 16.523 419 HG2 GLU 48 2HG GLU 48 -1.790 -2.584 17.246 420 HG3 GLU 48 3HG GLU 48 -2.308 -3.329 18.761 421 H LYS 49 H LYS 49 -3.295 0.590 19.884 422 HA LYS 49 HA LYS 49 -2.291 2.381 17.823 423 HB2 LYS 49 2HB LYS 49 -2.470 2.752 20.844 424 HB3 LYS 49 3HB LYS 49 -2.130 4.017 19.664 425 HG2 LYS 49 2HG LYS 49 -4.389 3.725 18.699 426 HG3 LYS 49 3HG LYS 49 -4.715 2.446 19.869 427 HD2 LYS 49 2HD LYS 49 -5.789 4.417 20.694 428 HD3 LYS 49 3HD LYS 49 -4.374 4.153 21.713 429 HE2 LYS 49 2HE LYS 49 -4.407 6.091 19.378 430 HE3 LYS 49 3HE LYS 49 -4.810 6.554 21.027 431 HZ1 LYS 49 3HZ LYS 49 -2.198 5.518 20.074 432 HZ2 LYS 49 1HZ LYS 49 -2.574 5.810 21.696 433 HZ3 LYS 49 2HZ LYS 49 -2.545 7.084 20.591 434 H ASN 50 H ASN 50 -0.862 -0.159 19.119 435 HA ASN 50 HA ASN 50 1.505 0.599 20.354 436 HB2 ASN 50 2HB ASN 50 0.580 -1.751 20.118 437 HB3 ASN 50 3HB ASN 50 1.170 -1.772 18.461 438 HD21 ASN 50 1HD2 ASN 50 2.041 -1.967 21.805 439 HD22 ASN 50 2HD2 ASN 50 3.697 -2.404 21.570 440 H PHE 51 H PHE 51 3.670 0.841 19.546 441 HA PHE 51 HA PHE 51 3.837 2.771 17.506 442 HB2 PHE 51 2HB PHE 51 5.310 2.640 19.510 443 HB3 PHE 51 3HB PHE 51 6.095 1.218 18.838 444 HD1 PHE 51 HD2 PHE 51 5.474 4.859 18.190 445 HD2 PHE 51 HD1 PHE 51 7.985 1.488 17.394 446 HE1 PHE 51 HE2 PHE 51 7.091 6.324 17.057 447 HE2 PHE 51 HE1 PHE 51 9.598 2.963 16.259 448 HZ PHE 51 HZ PHE 51 9.153 5.383 16.091 449 H GLU 52 H GLU 52 4.132 -0.680 17.326 450 HA GLU 52 HA GLU 52 5.803 -1.208 15.201 451 HB2 GLU 52 2HB GLU 52 3.208 -2.562 16.031 452 HB3 GLU 52 3HB GLU 52 4.261 -3.227 14.781 453 HG2 GLU 52 2HG GLU 52 6.091 -3.438 16.391 454 HG3 GLU 52 3HG GLU 52 5.099 -2.702 17.650 455 H LYS 53 H LYS 53 5.820 -0.868 13.061 456 HA LYS 53 HA LYS 53 3.694 0.682 11.791 457 HB2 LYS 53 2HB LYS 53 6.211 -0.310 10.396 458 HB3 LYS 53 3HB LYS 53 5.230 1.093 9.992 459 HG2 LYS 53 2HG LYS 53 7.093 0.778 12.357 460 HG3 LYS 53 3HG LYS 53 7.334 1.816 10.950 461 HD2 LYS 53 2HD LYS 53 5.487 3.246 11.631 462 HD3 LYS 53 3HD LYS 53 5.061 2.138 12.941 463 HE2 LYS 53 2HE LYS 53 7.282 2.584 13.986 464 HE3 LYS 53 3HE LYS 53 7.594 3.788 12.729 465 HZ1 LYS 53 3HZ LYS 53 5.572 4.966 13.489 466 HZ2 LYS 53 1HZ LYS 53 6.772 4.875 14.670 467 HZ3 LYS 53 2HZ LYS 53 5.424 3.858 14.760 468 H ILE 54 H ILE 54 2.333 -0.051 10.202 469 HA ILE 54 HA ILE 54 2.260 -2.993 9.800 470 HB ILE 54 HB ILE 54 -0.106 -1.054 9.683 471 HG12 ILE 54 2HG1 ILE 54 0.779 -1.128 11.997 472 HG13 ILE 54 3HG1 ILE 54 -0.787 -1.917 11.903 473 HG21 ILE 54 1HG2 ILE 54 -1.495 -3.102 9.771 474 HG22 ILE 54 2HG2 ILE 54 -0.040 -4.102 9.745 475 HG23 ILE 54 3HG2 ILE 54 -0.444 -3.092 8.354 476 HD11 ILE 54 3HD1 ILE 54 0.733 -3.125 13.357 477 HD12 ILE 54 1HD1 ILE 54 1.890 -3.304 12.038 478 HD13 ILE 54 2HD1 ILE 54 0.320 -4.105 11.950 479 H LEU 55 H LEU 55 2.387 -3.716 7.766 480 HA LEU 55 HA LEU 55 2.184 -1.840 5.482 481 HB2 LEU 55 2HB LEU 55 4.269 -3.256 5.878 482 HB3 LEU 55 3HB LEU 55 3.313 -4.684 5.530 483 HG LEU 55 HG LEU 55 3.599 -2.434 3.495 484 HD11 LEU 55 1HD1 LEU 55 5.463 -4.808 3.770 485 HD12 LEU 55 2HD1 LEU 55 5.865 -3.120 4.098 486 HD13 LEU 55 3HD1 LEU 55 5.460 -3.622 2.460 487 HD21 LEU 55 3HD2 LEU 55 1.828 -4.028 2.992 488 HD22 LEU 55 1HD2 LEU 55 2.958 -5.378 3.141 489 HD23 LEU 55 2HD2 LEU 55 3.149 -4.196 1.843 490 H ILE 56 H ILE 56 0.326 -1.932 4.294 491 HA ILE 56 HA ILE 56 -1.520 -4.233 4.661 492 HB ILE 56 HB ILE 56 -2.204 -1.375 3.794 493 HG12 ILE 56 2HG1 ILE 56 -1.609 -1.523 6.234 494 HG13 ILE 56 3HG1 ILE 56 -3.277 -1.039 5.959 495 HG21 ILE 56 1HG2 ILE 56 -4.056 -3.730 4.334 496 HG22 ILE 56 2HG2 ILE 56 -3.722 -2.991 2.766 497 HG23 ILE 56 3HG2 ILE 56 -4.576 -2.075 4.007 498 HD11 ILE 56 3HD1 ILE 56 -2.342 -3.788 6.779 499 HD12 ILE 56 1HD1 ILE 56 -4.019 -3.317 6.498 500 HD13 ILE 56 2HD1 ILE 56 -3.105 -2.585 7.817 501 H ILE 57 H ILE 57 -1.674 -5.527 2.919 502 HA ILE 57 HA ILE 57 -1.065 -4.526 0.201 503 HB ILE 57 HB ILE 57 -1.247 -7.437 1.153 504 HG12 ILE 57 2HG1 ILE 57 1.230 -5.751 0.532 505 HG13 ILE 57 3HG1 ILE 57 0.721 -6.270 2.133 506 HG21 ILE 57 1HG2 ILE 57 -0.300 -6.303 -1.515 507 HG22 ILE 57 2HG2 ILE 57 -1.800 -7.189 -1.238 508 HG23 ILE 57 3HG2 ILE 57 -0.251 -8.006 -1.046 509 HD11 ILE 57 3HD1 ILE 57 2.558 -7.605 1.316 510 HD12 ILE 57 1HD1 ILE 57 1.626 -8.079 -0.104 511 HD13 ILE 57 2HD1 ILE 57 1.115 -8.600 1.504 512 H SER 58 H SER 58 -2.603 -4.702 -1.426 513 HA SER 58 HA SER 58 -5.096 -6.202 -0.996 514 HB2 SER 58 2HB SER 58 -5.645 -3.835 -0.389 515 HB3 SER 58 3HB SER 58 -5.047 -3.296 -1.958 516 HG SER 58 HG SER 58 -7.100 -3.555 -2.454 517 H ASN 59 H ASN 59 -6.059 -6.862 -2.964 518 HA ASN 59 HA ASN 59 -4.353 -6.781 -5.373 519 HB2 ASN 59 2HB ASN 59 -6.910 -8.345 -4.785 520 HB3 ASN 59 3HB ASN 59 -6.012 -8.428 -6.301 521 HD21 ASN 59 1HD2 ASN 59 -3.921 -9.388 -6.292 522 HD22 ASN 59 2HD2 ASN 59 -3.482 -10.521 -5.064 523 H ASP 60 H ASP 60 -7.138 -5.338 -4.017 524 HA ASP 60 HA ASP 60 -8.305 -4.648 -6.644 525 HB2 ASP 60 2HB ASP 60 -9.745 -6.092 -5.253 526 HB3 ASP 60 3HB ASP 60 -9.659 -4.944 -3.924 527 H LYS 61 H LYS 61 -8.361 -2.597 -7.178 528 HA LYS 61 HA LYS 61 -6.935 -0.649 -5.640 529 HB2 LYS 61 2HB LYS 61 -8.359 -0.516 -8.325 530 HB3 LYS 61 3HB LYS 61 -7.418 0.812 -7.659 531 HG2 LYS 61 2HG LYS 61 -5.376 -0.486 -7.720 532 HG3 LYS 61 3HG LYS 61 -6.257 -1.948 -8.167 533 HD2 LYS 61 2HD LYS 61 -6.014 0.552 -9.894 534 HD3 LYS 61 3HD LYS 61 -5.076 -0.930 -10.103 535 HE2 LYS 61 2HE LYS 61 -7.186 -2.181 -10.511 536 HE3 LYS 61 3HE LYS 61 -8.094 -0.674 -10.362 537 HZ1 LYS 61 3HZ LYS 61 -6.876 0.189 -12.279 538 HZ2 LYS 61 1HZ LYS 61 -7.696 -1.238 -12.675 539 HZ3 LYS 61 2HZ LYS 61 -6.027 -1.266 -12.415 540 H GLN 62 H GLN 62 -10.332 -1.359 -6.055 541 HA GLN 62 HA GLN 62 -11.343 1.215 -5.241 542 HB2 GLN 62 2HB GLN 62 -12.738 -0.286 -6.598 543 HB3 GLN 62 3HB GLN 62 -12.690 -1.519 -5.346 544 HG2 GLN 62 2HG GLN 62 -14.837 -0.396 -5.331 545 HG3 GLN 62 3HG GLN 62 -13.973 -0.037 -3.837 546 HE21 GLN 62 1HE2 GLN 62 -15.170 1.280 -6.845 547 HE22 GLN 62 2HE2 GLN 62 -14.967 2.947 -6.436 548 H LEU 63 H LEU 63 -10.665 -1.898 -3.630 549 HA LEU 63 HA LEU 63 -11.438 -1.271 -1.009 550 HB2 LEU 63 2HB LEU 63 -9.192 -3.043 -2.062 551 HB3 LEU 63 3HB LEU 63 -9.546 -2.905 -0.347 552 HG LEU 63 HG LEU 63 -11.419 -4.027 -2.465 553 HD11 LEU 63 1HD1 LEU 63 -11.067 -6.176 -1.329 554 HD12 LEU 63 2HD1 LEU 63 -9.938 -5.418 -0.200 555 HD13 LEU 63 3HD1 LEU 63 -9.539 -5.521 -1.920 556 HD21 LEU 63 3HD2 LEU 63 -12.901 -4.618 -0.590 557 HD22 LEU 63 1HD2 LEU 63 -12.702 -2.873 -0.734 558 HD23 LEU 63 2HD2 LEU 63 -11.844 -3.754 0.532 559 H LEU 64 H LEU 64 -8.396 -0.811 -2.725 560 HA LEU 64 HA LEU 64 -6.825 0.325 -0.744 561 HB2 LEU 64 2HB LEU 64 -5.932 -0.463 -2.816 562 HB3 LEU 64 3HB LEU 64 -6.875 0.674 -3.757 563 HG LEU 64 HG LEU 64 -4.849 1.812 -1.815 564 HD11 LEU 64 1HD1 LEU 64 -3.589 0.051 -2.881 565 HD12 LEU 64 2HD1 LEU 64 -3.083 1.609 -3.520 566 HD13 LEU 64 3HD1 LEU 64 -4.132 0.567 -4.479 567 HD21 LEU 64 3HD2 LEU 64 -4.580 3.530 -3.566 568 HD22 LEU 64 1HD2 LEU 64 -6.272 3.368 -3.095 569 HD23 LEU 64 2HD2 LEU 64 -5.709 2.662 -4.610 570 H LYS 65 H LYS 65 -9.058 1.941 -3.018 571 HA LYS 65 HA LYS 65 -8.640 4.614 -2.323 572 HB2 LYS 65 2HB LYS 65 -11.164 3.171 -3.224 573 HB3 LYS 65 3HB LYS 65 -11.087 4.919 -3.043 574 HG2 LYS 65 2HG LYS 65 -9.434 5.091 -4.806 575 HG3 LYS 65 3HG LYS 65 -9.290 3.335 -4.899 576 HD2 LYS 65 2HD LYS 65 -10.645 4.133 -6.763 577 HD3 LYS 65 3HD LYS 65 -11.652 3.188 -5.670 578 HE2 LYS 65 2HE LYS 65 -11.558 6.226 -5.700 579 HE3 LYS 65 3HE LYS 65 -12.748 5.264 -6.572 580 HZ1 LYS 65 3HZ LYS 65 -13.833 5.814 -4.622 581 HZ2 LYS 65 1HZ LYS 65 -12.455 5.636 -3.657 582 HZ3 LYS 65 2HZ LYS 65 -13.247 4.275 -4.261 583 H GLU 66 H GLU 66 -11.160 2.405 -1.056 584 HA GLU 66 HA GLU 66 -12.262 4.172 0.827 585 HB2 GLU 66 2HB GLU 66 -12.231 1.133 1.066 586 HB3 GLU 66 3HB GLU 66 -13.406 2.241 1.772 587 HG2 GLU 66 2HG GLU 66 -13.039 1.532 -1.144 588 HG3 GLU 66 3HG GLU 66 -14.431 1.198 -0.122 589 H MET 67 H MET 67 -9.729 1.772 1.123 590 HA MET 67 HA MET 67 -9.106 1.722 3.798 591 HB2 MET 67 2HB MET 67 -8.120 0.318 1.897 592 HB3 MET 67 3HB MET 67 -7.087 1.682 1.499 593 HG2 MET 67 2HG MET 67 -5.678 0.352 2.758 594 HG3 MET 67 3HG MET 67 -6.291 1.454 3.988 595 HE1 MET 67 3HE MET 67 -8.004 -1.675 2.254 596 HE2 MET 67 1HE MET 67 -7.669 -2.925 3.454 597 HE3 MET 67 2HE MET 67 -6.344 -2.198 2.551 598 H LEU 68 H LEU 68 -7.693 3.841 1.274 599 HA LEU 68 HA LEU 68 -5.916 5.199 3.030 600 HB2 LEU 68 2HB LEU 68 -6.825 5.958 0.230 601 HB3 LEU 68 3HB LEU 68 -5.507 6.740 1.097 602 HG LEU 68 HG LEU 68 -5.591 3.853 0.159 603 HD11 LEU 68 1HD1 LEU 68 -3.819 6.145 -0.715 604 HD12 LEU 68 2HD1 LEU 68 -5.166 5.462 -1.630 605 HD13 LEU 68 3HD1 LEU 68 -3.743 4.479 -1.300 606 HD21 LEU 68 3HD2 LEU 68 -4.442 3.901 2.287 607 HD22 LEU 68 1HD2 LEU 68 -3.431 5.250 1.759 608 HD23 LEU 68 2HD2 LEU 68 -3.274 3.668 0.992 609 H GLU 69 H GLU 69 -9.138 5.977 1.844 610 HA GLU 69 HA GLU 69 -9.256 8.679 2.756 611 HB2 GLU 69 2HB GLU 69 -11.505 6.685 2.229 612 HB3 GLU 69 3HB GLU 69 -11.750 8.403 2.547 613 HG2 GLU 69 2HG GLU 69 -10.429 8.958 0.529 614 HG3 GLU 69 3HG GLU 69 -10.226 7.237 0.202 615 H LEU 70 H LEU 70 -10.097 5.581 4.239 616 HA LEU 70 HA LEU 70 -11.005 6.723 6.710 617 HB2 LEU 70 2HB LEU 70 -10.183 3.882 5.997 618 HB3 LEU 70 3HB LEU 70 -10.895 4.344 7.538 619 HG LEU 70 HG LEU 70 -12.259 4.625 4.824 620 HD11 LEU 70 1HD1 LEU 70 -13.741 2.818 5.546 621 HD12 LEU 70 2HD1 LEU 70 -12.835 2.651 7.053 622 HD13 LEU 70 3HD1 LEU 70 -12.062 2.278 5.511 623 HD21 LEU 70 3HD2 LEU 70 -12.983 6.386 6.368 624 HD22 LEU 70 1HD2 LEU 70 -13.364 5.178 7.598 625 HD23 LEU 70 2HD2 LEU 70 -14.279 5.229 6.089 626 H ILE 71 H ILE 71 -7.860 5.565 5.535 627 HA ILE 71 HA ILE 71 -6.413 5.717 7.984 628 HB ILE 71 HB ILE 71 -5.390 6.017 5.114 629 HG12 ILE 71 2HG1 ILE 71 -5.220 3.614 7.003 630 HG13 ILE 71 3HG1 ILE 71 -6.386 3.777 5.697 631 HG21 ILE 71 1HG2 ILE 71 -3.768 5.667 7.672 632 HG22 ILE 71 2HG2 ILE 71 -3.790 7.091 6.631 633 HG23 ILE 71 3HG2 ILE 71 -3.112 5.579 6.035 634 HD11 ILE 71 3HD1 ILE 71 -4.558 3.786 4.069 635 HD12 ILE 71 1HD1 ILE 71 -4.566 2.329 5.059 636 HD13 ILE 71 2HD1 ILE 71 -3.393 3.603 5.384 637 H SER 72 H SER 72 -7.330 8.105 5.576 638 HA SER 72 HA SER 72 -5.731 10.285 6.394 639 HB2 SER 72 2HB SER 72 -6.969 10.195 4.233 640 HB3 SER 72 3HB SER 72 -8.497 10.333 5.103 641 HG SER 72 HG SER 72 -6.642 12.287 5.701 642 H LYS 73 H LYS 73 -8.803 8.987 7.531 643 HA LYS 73 HA LYS 73 -9.368 11.140 9.370 644 HB2 LYS 73 2HB LYS 73 -10.550 8.329 9.237 645 HB3 LYS 73 3HB LYS 73 -11.197 9.685 10.161 646 HG2 LYS 73 2HG LYS 73 -11.457 10.922 7.925 647 HG3 LYS 73 3HG LYS 73 -11.084 9.381 7.145 648 HD2 LYS 73 2HD LYS 73 -13.498 9.642 7.230 649 HD3 LYS 73 3HD LYS 73 -13.036 8.345 8.334 650 HE2 LYS 73 2HE LYS 73 -13.177 9.957 10.232 651 HE3 LYS 73 3HE LYS 73 -13.711 11.207 9.106 652 HZ1 LYS 73 3HZ LYS 73 -15.606 10.273 10.180 653 HZ2 LYS 73 1HZ LYS 73 -15.144 8.693 9.787 654 HZ3 LYS 73 2HZ LYS 73 -15.627 9.762 8.572 655 H LEU 74 H LEU 74 -7.739 8.023 9.479 656 HA LEU 74 HA LEU 74 -7.459 7.800 12.309 657 HB2 LEU 74 2HB LEU 74 -5.713 6.589 10.126 658 HB3 LEU 74 3HB LEU 74 -5.741 6.094 11.810 659 HG LEU 74 HG LEU 74 -8.001 5.751 9.808 660 HD11 LEU 74 1HD1 LEU 74 -6.165 4.205 9.399 661 HD12 LEU 74 2HD1 LEU 74 -7.563 3.337 10.029 662 HD13 LEU 74 3HD1 LEU 74 -6.191 3.682 11.087 663 HD21 LEU 74 3HD2 LEU 74 -9.170 4.492 11.574 664 HD22 LEU 74 1HD2 LEU 74 -8.941 6.187 12.001 665 HD23 LEU 74 2HD2 LEU 74 -7.912 4.951 12.723 666 H GLY 75 H GLY 75 -5.612 9.389 9.781 667 HA2 GLY 75 2HA GLY 75 -4.028 11.048 9.886 668 HA3 GLY 75 3HA GLY 75 -4.086 10.980 11.640 669 H TYR 76 H TYR 76 -3.157 8.754 8.994 670 HA TYR 76 HA TYR 76 -0.506 8.361 10.297 671 HB2 TYR 76 2HB TYR 76 -2.083 6.260 8.749 672 HB3 TYR 76 3HB TYR 76 -0.466 6.034 9.408 673 HD1 TYR 76 HD1 TYR 76 -0.776 7.175 12.161 674 HD2 TYR 76 HD2 TYR 76 -3.413 4.691 9.897 675 HE1 TYR 76 HE1 TYR 76 -1.738 6.293 14.243 676 HE2 TYR 76 HE2 TYR 76 -4.371 3.822 11.978 677 HH TYR 76 HH TYR 76 -3.778 3.577 14.321 678 H LYS 77 H LYS 77 1.271 8.016 8.894 679 HA LYS 77 HA LYS 77 1.133 9.359 6.327 680 HB2 LYS 77 2HB LYS 77 3.073 9.757 7.739 681 HB3 LYS 77 3HB LYS 77 3.411 8.036 7.857 682 HG2 LYS 77 2HG LYS 77 5.008 9.149 6.367 683 HG3 LYS 77 3HG LYS 77 4.046 7.960 5.490 684 HD2 LYS 77 2HD LYS 77 4.330 9.982 4.143 685 HD3 LYS 77 3HD LYS 77 2.630 9.779 4.575 686 HE2 LYS 77 2HE LYS 77 3.271 12.119 4.793 687 HE3 LYS 77 3HE LYS 77 2.920 11.459 6.387 688 HZ1 LYS 77 3HZ LYS 77 5.618 11.862 5.235 689 HZ2 LYS 77 1HZ LYS 77 5.292 11.236 6.770 690 HZ3 LYS 77 2HZ LYS 77 4.888 12.833 6.402 691 H VAL 78 H VAL 78 0.824 8.389 4.415 692 HA VAL 78 HA VAL 78 1.050 5.439 4.206 693 HB VAL 78 HB VAL 78 -0.516 7.357 2.405 694 HG11 VAL 78 1HG1 VAL 78 -1.466 5.331 1.363 695 HG12 VAL 78 2HG1 VAL 78 -0.419 4.311 2.353 696 HG13 VAL 78 3HG1 VAL 78 0.284 5.395 1.151 697 HG21 VAL 78 3HG2 VAL 78 -1.519 5.397 4.502 698 HG22 VAL 78 1HG2 VAL 78 -2.533 6.347 3.412 699 HG23 VAL 78 2HG2 VAL 78 -1.537 7.158 4.620 700 H PHE 79 H PHE 79 2.614 4.605 2.992 701 HA PHE 79 HA PHE 79 3.709 6.152 0.703 702 HB2 PHE 79 2HB PHE 79 4.942 3.949 2.417 703 HB3 PHE 79 3HB PHE 79 5.596 4.410 0.853 704 HD1 PHE 79 HD1 PHE 79 6.689 6.586 0.525 705 HD2 PHE 79 HD2 PHE 79 5.203 5.426 4.359 706 HE1 PHE 79 HE1 PHE 79 7.974 8.398 1.575 707 HE2 PHE 79 HE2 PHE 79 6.497 7.239 5.401 708 HZ PHE 79 HZ PHE 79 7.868 8.735 4.012 709 H LEU 80 H LEU 80 2.876 5.456 -1.149 710 HA LEU 80 HA LEU 80 1.379 2.920 -1.185 711 HB2 LEU 80 2HB LEU 80 -0.052 4.912 -1.296 712 HB3 LEU 80 3HB LEU 80 0.845 5.522 -2.682 713 HG LEU 80 HG LEU 80 0.047 3.644 -4.066 714 HD11 LEU 80 1HD1 LEU 80 -1.508 2.719 -1.639 715 HD12 LEU 80 2HD1 LEU 80 -0.098 1.918 -2.342 716 HD13 LEU 80 3HD1 LEU 80 -1.590 2.039 -3.266 717 HD21 LEU 80 3HD2 LEU 80 -2.334 4.241 -4.214 718 HD22 LEU 80 1HD2 LEU 80 -1.323 5.672 -4.016 719 HD23 LEU 80 2HD2 LEU 80 -2.240 5.045 -2.645 720 H LEU 81 H LEU 81 1.815 1.445 -2.643 721 HA LEU 81 HA LEU 81 3.448 2.053 -5.039 722 HB2 LEU 81 2HB LEU 81 4.551 0.554 -3.326 723 HB3 LEU 81 3HB LEU 81 3.238 -0.592 -3.528 724 HG LEU 81 HG LEU 81 3.892 -0.983 -5.869 725 HD11 LEU 81 1HD1 LEU 81 5.972 -0.014 -6.795 726 HD12 LEU 81 2HD1 LEU 81 6.093 1.045 -5.387 727 HD13 LEU 81 3HD1 LEU 81 4.728 1.197 -6.495 728 HD21 LEU 81 3HD2 LEU 81 4.927 -2.383 -4.130 729 HD22 LEU 81 1HD2 LEU 81 6.262 -1.234 -3.977 730 HD23 LEU 81 2HD2 LEU 81 6.031 -2.135 -5.479 731 H LEU 82 H LEU 82 2.153 2.015 -6.798 732 HA LEU 82 HA LEU 82 -0.143 0.140 -6.905 733 HB2 LEU 82 2HB LEU 82 0.450 2.698 -8.450 734 HB3 LEU 82 3HB LEU 82 -0.911 1.640 -8.797 735 HG LEU 82 HG LEU 82 -0.493 3.112 -6.166 736 HD11 LEU 82 1HD1 LEU 82 -0.994 4.678 -7.992 737 HD12 LEU 82 2HD1 LEU 82 -2.332 4.571 -6.853 738 HD13 LEU 82 3HD1 LEU 82 -2.435 3.748 -8.414 739 HD21 LEU 82 3HD2 LEU 82 -1.715 1.028 -5.861 740 HD22 LEU 82 1HD2 LEU 82 -2.842 1.464 -7.151 741 HD23 LEU 82 2HD2 LEU 82 -2.792 2.404 -5.657 742 H GLN 83 H GLN 83 0.450 -1.718 -7.892 743 HA GLN 83 HA GLN 83 2.152 -1.629 -10.291 744 HB2 GLN 83 2HB GLN 83 2.761 -3.283 -8.479 745 HB3 GLN 83 3HB GLN 83 1.230 -4.104 -8.762 746 HG2 GLN 83 2HG GLN 83 1.907 -4.579 -11.084 747 HG3 GLN 83 3HG GLN 83 3.445 -3.753 -10.816 748 HE21 GLN 83 1HE2 GLN 83 2.962 -6.523 -11.609 749 HE22 GLN 83 2HE2 GLN 83 3.737 -7.503 -10.411 750 H ASP 84 H ASP 84 0.945 -1.182 -12.006 751 HA ASP 84 HA ASP 84 -1.350 -2.822 -12.737 752 HB2 ASP 84 2HB ASP 84 -2.309 -0.958 -11.319 753 HB3 ASP 84 3HB ASP 84 -1.633 0.210 -12.445 754 H GLN 85 H GLN 85 -1.339 -3.082 -14.922 755 HA GLN 85 HA GLN 85 0.864 -1.900 -16.419 756 HB2 GLN 85 2HB GLN 85 -1.119 -4.098 -17.132 757 HB3 GLN 85 3HB GLN 85 0.224 -3.598 -18.158 758 HG2 GLN 85 2HG GLN 85 1.834 -4.308 -16.435 759 HG3 GLN 85 3HG GLN 85 0.504 -4.755 -15.366 760 HE21 GLN 85 1HE2 GLN 85 -0.736 -6.609 -15.869 761 HE22 GLN 85 2HE2 GLN 85 -0.162 -7.824 -16.955 762 H ASP 86 H ASP 86 -2.462 -1.210 -16.031 763 HA ASP 86 HA ASP 86 -2.775 -0.001 -18.697 764 HB2 ASP 86 2HB ASP 86 -4.737 -0.251 -16.363 765 HB3 ASP 86 3HB ASP 86 -5.107 0.548 -17.890 766 H GLU 87 H GLU 87 -0.881 1.390 -18.050 767 HA GLU 87 HA GLU 87 -0.911 3.267 -16.013 768 HB2 GLU 87 2HB GLU 87 0.498 3.408 -18.694 769 HB3 GLU 87 3HB GLU 87 0.792 4.523 -17.361 770 HG2 GLU 87 2HG GLU 87 1.450 2.553 -15.942 771 HG3 GLU 87 3HG GLU 87 1.322 1.538 -17.381 772 H ASN 88 H ASN 88 -2.708 3.404 -18.961 773 HA ASN 88 HA ASN 88 -3.326 6.165 -19.084 774 HB2 ASN 88 2HB ASN 88 -5.056 3.768 -19.858 775 HB3 ASN 88 3HB ASN 88 -5.394 5.438 -20.305 776 HD21 ASN 88 1HD2 ASN 88 -5.305 5.005 -22.482 777 HD22 ASN 88 2HD2 ASN 88 -3.835 4.663 -23.327 778 H GLU 89 H GLU 89 -5.107 3.465 -17.569 779 HA GLU 89 HA GLU 89 -7.020 5.056 -16.156 780 HB2 GLU 89 2HB GLU 89 -6.119 2.193 -15.547 781 HB3 GLU 89 3HB GLU 89 -7.608 2.952 -14.991 782 HG2 GLU 89 2HG GLU 89 -6.897 2.273 -17.855 783 HG3 GLU 89 3HG GLU 89 -8.030 1.397 -16.828 784 H LEU 90 H LEU 90 -3.931 3.600 -15.352 785 HA LEU 90 HA LEU 90 -3.962 3.942 -12.558 786 HB2 LEU 90 2HB LEU 90 -2.559 2.270 -13.611 787 HB3 LEU 90 3HB LEU 90 -1.713 3.489 -14.539 788 HG LEU 90 HG LEU 90 -0.664 4.364 -12.478 789 HD11 LEU 90 1HD1 LEU 90 -2.081 2.113 -11.037 790 HD12 LEU 90 2HD1 LEU 90 -2.396 3.845 -10.866 791 HD13 LEU 90 3HD1 LEU 90 -0.849 3.182 -10.358 792 HD21 LEU 90 3HD2 LEU 90 0.517 2.654 -13.781 793 HD22 LEU 90 1HD2 LEU 90 -0.249 1.374 -12.837 794 HD23 LEU 90 2HD2 LEU 90 0.876 2.496 -12.065 795 H GLU 91 H GLU 91 -2.977 6.081 -15.195 796 HA GLU 91 HA GLU 91 -1.400 7.881 -13.652 797 HB2 GLU 91 2HB GLU 91 -1.621 7.649 -16.271 798 HB3 GLU 91 3HB GLU 91 -2.985 8.746 -16.106 799 HG2 GLU 91 2HG GLU 91 -1.117 10.086 -16.670 800 HG3 GLU 91 3HG GLU 91 -1.405 10.364 -14.953 801 H GLU 92 H GLU 92 -4.776 7.913 -14.736 802 HA GLU 92 HA GLU 92 -5.660 10.286 -13.487 803 HB2 GLU 92 2HB GLU 92 -7.271 7.779 -14.144 804 HB3 GLU 92 3HB GLU 92 -7.931 9.393 -13.884 805 HG2 GLU 92 2HG GLU 92 -6.855 10.215 -15.904 806 HG3 GLU 92 3HG GLU 92 -6.019 8.681 -16.129 807 H PHE 93 H PHE 93 -5.788 6.912 -12.488 808 HA PHE 93 HA PHE 93 -7.134 7.112 -10.049 809 HB2 PHE 93 2HB PHE 93 -6.713 4.999 -11.319 810 HB3 PHE 93 3HB PHE 93 -5.007 5.091 -10.906 811 HD1 PHE 93 HD1 PHE 93 -8.406 4.930 -9.342 812 HD2 PHE 93 HD2 PHE 93 -4.255 3.981 -8.969 813 HE1 PHE 93 HE1 PHE 93 -8.874 3.656 -7.301 814 HE2 PHE 93 HE2 PHE 93 -4.737 2.709 -6.921 815 HZ PHE 93 HZ PHE 93 -7.047 2.545 -6.087 816 H LYS 94 H LYS 94 -3.693 7.250 -10.832 817 HA LYS 94 HA LYS 94 -2.595 7.362 -8.256 818 HB2 LYS 94 2HB LYS 94 -1.283 6.884 -10.334 819 HB3 LYS 94 3HB LYS 94 -1.499 8.554 -10.840 820 HG2 LYS 94 2HG LYS 94 -0.338 9.102 -8.514 821 HG3 LYS 94 3HG LYS 94 0.234 7.438 -8.644 822 HD2 LYS 94 2HD LYS 94 1.923 8.931 -9.561 823 HD3 LYS 94 3HD LYS 94 1.223 7.989 -10.880 824 HE2 LYS 94 2HE LYS 94 -0.206 9.878 -11.505 825 HE3 LYS 94 3HE LYS 94 0.430 10.830 -10.157 826 HZ1 LYS 94 3HZ LYS 94 1.874 9.919 -12.581 827 HZ2 LYS 94 1HZ LYS 94 2.670 10.520 -11.213 828 HZ3 LYS 94 2HZ LYS 94 1.601 11.507 -12.060 829 H ARG 95 H ARG 95 -3.431 9.986 -10.571 830 HA ARG 95 HA ARG 95 -2.396 12.118 -9.043 831 HB2 ARG 95 2HB ARG 95 -4.564 12.186 -11.178 832 HB3 ARG 95 3HB ARG 95 -3.831 13.622 -10.471 833 HG2 ARG 95 2HG ARG 95 -1.580 12.680 -11.318 834 HG3 ARG 95 3HG ARG 95 -2.552 11.561 -12.275 835 HD2 ARG 95 2HD ARG 95 -1.955 13.481 -13.640 836 HD3 ARG 95 3HD ARG 95 -3.699 13.514 -13.343 837 HE ARG 95 HE ARG 95 -2.523 15.046 -11.350 838 HH11 ARG 95 1HH1 ARG 95 -2.731 15.265 -14.877 839 HH12 ARG 95 2HH1 ARG 95 -2.612 16.994 -14.874 840 HH21 ARG 95 1HH2 ARG 95 -2.397 17.294 -11.385 841 HH22 ARG 95 2HH2 ARG 95 -2.423 18.144 -12.898 842 H LYS 96 H LYS 96 -5.556 10.568 -8.973 843 HA LYS 96 HA LYS 96 -7.027 12.365 -7.386 844 HB2 LYS 96 2HB LYS 96 -7.086 9.309 -7.385 845 HB3 LYS 96 3HB LYS 96 -8.320 10.322 -6.642 846 HG2 LYS 96 2HG LYS 96 -9.011 11.174 -8.799 847 HG3 LYS 96 3HG LYS 96 -7.659 10.368 -9.601 848 HD2 LYS 96 2HD LYS 96 -8.593 8.164 -8.978 849 HD3 LYS 96 3HD LYS 96 -9.953 8.953 -8.172 850 HE2 LYS 96 2HE LYS 96 -9.313 9.195 -11.135 851 HE3 LYS 96 3HE LYS 96 -10.503 8.092 -10.447 852 HZ1 LYS 96 3HZ LYS 96 -11.541 10.098 -11.286 853 HZ2 LYS 96 1HZ LYS 96 -10.593 11.054 -10.271 854 HZ3 LYS 96 2HZ LYS 96 -11.733 9.999 -9.613 855 H ILE 97 H ILE 97 -4.902 9.704 -6.475 856 HA ILE 97 HA ILE 97 -5.223 10.032 -3.622 857 HB ILE 97 HB ILE 97 -3.325 8.227 -5.196 858 HG12 ILE 97 2HG1 ILE 97 -6.089 7.508 -4.088 859 HG13 ILE 97 3HG1 ILE 97 -5.794 7.930 -5.771 860 HG21 ILE 97 1HG2 ILE 97 -2.672 8.445 -2.842 861 HG22 ILE 97 2HG2 ILE 97 -3.309 6.832 -3.150 862 HG23 ILE 97 3HG2 ILE 97 -4.308 8.029 -2.325 863 HD11 ILE 97 3HD1 ILE 97 -5.932 5.536 -5.473 864 HD12 ILE 97 1HD1 ILE 97 -4.602 5.577 -4.315 865 HD13 ILE 97 2HD1 ILE 97 -4.319 6.008 -6.004 866 H GLU 98 H GLU 98 -2.947 11.006 -6.047 867 HA GLU 98 HA GLU 98 -0.737 11.691 -4.351 868 HB2 GLU 98 2HB GLU 98 -0.391 11.056 -6.667 869 HB3 GLU 98 3HB GLU 98 -1.449 12.329 -7.251 870 HG2 GLU 98 2HG GLU 98 1.031 13.059 -5.713 871 HG3 GLU 98 3HG GLU 98 1.187 12.549 -7.389 872 H SER 99 H SER 99 -3.584 13.335 -5.637 873 HA SER 99 HA SER 99 -2.937 15.961 -4.652 874 HB2 SER 99 2HB SER 99 -5.586 14.748 -5.544 875 HB3 SER 99 3HB SER 99 -5.326 16.459 -5.189 876 HG SER 99 HG SER 99 -3.717 15.099 -7.075 877 H GLN 100 H GLN 100 -4.118 13.058 -3.209 878 HA GLN 100 HA GLN 100 -5.217 14.338 -0.826 879 HB2 GLN 100 2HB GLN 100 -4.630 11.409 -1.429 880 HB3 GLN 100 3HB GLN 100 -5.437 11.993 0.025 881 HG2 GLN 100 2HG GLN 100 -7.295 12.846 -1.336 882 HG3 GLN 100 3HG GLN 100 -6.482 12.295 -2.802 883 HE21 GLN 100 1HE2 GLN 100 -8.188 11.294 0.069 884 HE22 GLN 100 2HE2 GLN 100 -8.493 9.669 -0.430 885 H GLY 101 H GLY 101 -2.160 14.227 -1.886 886 HA2 GLY 101 2HA GLY 101 -0.211 14.857 -0.813 887 HA3 GLY 101 3HA GLY 101 -1.078 14.801 0.712 888 H TYR 102 H TYR 102 -1.141 11.970 -1.258 889 HA TYR 102 HA TYR 102 0.610 10.537 0.629 890 HB2 TYR 102 2HB TYR 102 -1.278 9.480 -1.520 891 HB3 TYR 102 3HB TYR 102 -0.335 8.470 -0.420 892 HD1 TYR 102 HD1 TYR 102 -0.644 9.797 2.185 893 HD2 TYR 102 HD2 TYR 102 -3.559 9.204 -0.882 894 HE1 TYR 102 HE1 TYR 102 -2.433 9.889 3.865 895 HE2 TYR 102 HE2 TYR 102 -5.343 9.294 0.803 896 HH TYR 102 HH TYR 102 -5.590 8.916 3.245 897 H GLU 103 H GLU 103 2.434 9.433 0.026 898 HA GLU 103 HA GLU 103 3.808 10.198 -2.398 899 HB2 GLU 103 2HB GLU 103 5.079 9.877 -0.313 900 HB3 GLU 103 3HB GLU 103 4.500 8.223 -0.168 901 HG2 GLU 103 2HG GLU 103 6.833 8.319 -0.925 902 HG3 GLU 103 3HG GLU 103 5.786 7.546 -2.113 903 H VAL 104 H VAL 104 2.925 9.327 -4.265 904 HA VAL 104 HA VAL 104 2.136 6.463 -4.253 905 HB VAL 104 HB VAL 104 0.994 8.610 -6.116 906 HG11 VAL 104 1HG1 VAL 104 0.071 5.781 -5.470 907 HG12 VAL 104 2HG1 VAL 104 0.849 6.317 -6.962 908 HG13 VAL 104 3HG1 VAL 104 -0.753 6.917 -6.543 909 HG21 VAL 104 3HG2 VAL 104 -1.038 8.633 -4.715 910 HG22 VAL 104 1HG2 VAL 104 0.368 9.184 -3.803 911 HG23 VAL 104 2HG2 VAL 104 -0.262 7.557 -3.548 912 H ARG 105 H ARG 105 3.608 5.283 -5.296 913 HA ARG 105 HA ARG 105 4.994 6.330 -7.686 914 HB2 ARG 105 2HB ARG 105 6.475 5.375 -5.962 915 HB3 ARG 105 3HB ARG 105 5.545 3.884 -5.941 916 HG2 ARG 105 2HG ARG 105 7.429 3.311 -7.192 917 HG3 ARG 105 3HG ARG 105 6.238 3.638 -8.438 918 HD2 ARG 105 2HD ARG 105 8.494 5.446 -7.533 919 HD3 ARG 105 3HD ARG 105 8.380 4.588 -9.064 920 HE ARG 105 HE ARG 105 6.919 6.996 -8.259 921 HH11 ARG 105 1HH1 ARG 105 7.604 4.657 -10.816 922 HH12 ARG 105 2HH1 ARG 105 6.892 5.648 -12.054 923 HH21 ARG 105 1HH2 ARG 105 5.912 8.211 -9.859 924 HH22 ARG 105 2HH2 ARG 105 5.939 7.661 -11.505 925 H LYS 106 H LYS 106 4.707 5.390 -9.654 926 HA LYS 106 HA LYS 106 2.706 3.270 -10.038 927 HB2 LYS 106 2HB LYS 106 4.269 4.970 -12.039 928 HB3 LYS 106 3HB LYS 106 3.066 3.764 -12.481 929 HG2 LYS 106 2HG LYS 106 1.293 5.099 -11.469 930 HG3 LYS 106 3HG LYS 106 2.477 6.266 -10.867 931 HD2 LYS 106 2HD LYS 106 1.366 7.093 -12.931 932 HD3 LYS 106 3HD LYS 106 3.101 6.882 -13.163 933 HE2 LYS 106 2HE LYS 106 2.616 4.657 -14.231 934 HE3 LYS 106 3HE LYS 106 0.897 5.037 -14.125 935 HZ1 LYS 106 3HZ LYS 106 1.917 5.533 -16.310 936 HZ2 LYS 106 1HZ LYS 106 2.881 6.712 -15.581 937 HZ3 LYS 106 2HZ LYS 106 1.201 6.884 -15.592 938 H VAL 107 H VAL 107 3.281 1.265 -10.866 939 HA VAL 107 HA VAL 107 5.906 0.767 -11.990 940 HB VAL 107 HB VAL 107 6.319 0.409 -9.556 941 HG11 VAL 107 1HG1 VAL 107 4.093 -0.279 -8.832 942 HG12 VAL 107 2HG1 VAL 107 5.309 -1.454 -8.333 943 HG13 VAL 107 3HG1 VAL 107 4.256 -1.804 -9.707 944 HG21 VAL 107 3HG2 VAL 107 7.373 -1.806 -9.728 945 HG22 VAL 107 1HG2 VAL 107 7.624 -0.860 -11.195 946 HG23 VAL 107 2HG2 VAL 107 6.426 -2.158 -11.177 947 H THR 108 H THR 108 5.928 -1.077 -13.295 948 HA THR 108 HA THR 108 3.314 -2.405 -13.781 949 HB THR 108 HB THR 108 4.099 -2.596 -16.198 950 HG1 THR 108 HG1 THR 108 6.245 -2.198 -16.176 951 HG21 THR 108 3HG2 THR 108 2.451 -0.867 -15.600 952 HG22 THR 108 1HG2 THR 108 3.575 -0.245 -16.810 953 HG23 THR 108 2HG2 THR 108 3.745 0.234 -15.122 954 H ASP 109 H ASP 109 6.768 -2.741 -13.387 955 HA ASP 109 HA ASP 109 6.779 -5.587 -14.069 956 HB2 ASP 109 2HB ASP 109 9.022 -3.660 -13.352 957 HB3 ASP 109 3HB ASP 109 9.264 -5.372 -13.683 958 H ASP 110 H ASP 110 7.374 -7.172 -12.673 959 HA ASP 110 HA ASP 110 6.279 -6.934 -10.023 960 HB2 ASP 110 2HB ASP 110 7.582 -9.352 -11.388 961 HB3 ASP 110 3HB ASP 110 6.535 -9.389 -9.966 962 H GLU 111 H GLU 111 9.464 -7.635 -11.394 963 HA GLU 111 HA GLU 111 10.847 -8.118 -8.933 964 HB2 GLU 111 2HB GLU 111 11.925 -7.361 -11.691 965 HB3 GLU 111 3HB GLU 111 12.906 -7.953 -10.350 966 HG2 GLU 111 2HG GLU 111 11.823 -10.121 -10.433 967 HG3 GLU 111 3HG GLU 111 10.659 -9.539 -11.625 968 H GLU 112 H GLU 112 10.336 -5.353 -11.037 969 HA GLU 112 HA GLU 112 11.963 -3.436 -9.785 970 HB2 GLU 112 2HB GLU 112 10.933 -3.132 -12.021 971 HB3 GLU 112 3HB GLU 112 9.331 -3.088 -11.300 972 HG2 GLU 112 2HG GLU 112 9.938 -0.848 -11.836 973 HG3 GLU 112 3HG GLU 112 10.004 -0.995 -10.083 974 H ALA 113 H ALA 113 8.526 -4.295 -9.307 975 HA ALA 113 HA ALA 113 7.743 -2.422 -7.433 976 HB1 ALA 113 3HB ALA 113 6.832 -5.310 -7.584 977 HB2 ALA 113 1HB ALA 113 6.195 -3.973 -8.545 978 HB3 ALA 113 2HB ALA 113 5.965 -3.990 -6.794 979 H LEU 114 H LEU 114 9.264 -5.583 -6.832 980 HA LEU 114 HA LEU 114 9.243 -5.688 -4.045 981 HB2 LEU 114 2HB LEU 114 11.388 -6.696 -5.951 982 HB3 LEU 114 3HB LEU 114 11.259 -7.178 -4.266 983 HG LEU 114 HG LEU 114 9.130 -7.748 -6.372 984 HD11 LEU 114 1HD1 LEU 114 9.947 -10.048 -6.381 985 HD12 LEU 114 2HD1 LEU 114 11.225 -9.630 -5.239 986 HD13 LEU 114 3HD1 LEU 114 11.233 -8.943 -6.867 987 HD21 LEU 114 3HD2 LEU 114 8.217 -7.640 -4.096 988 HD22 LEU 114 1HD2 LEU 114 9.434 -8.791 -3.531 989 HD23 LEU 114 2HD2 LEU 114 8.203 -9.296 -4.693 990 H LYS 115 H LYS 115 11.498 -4.050 -6.210 991 HA LYS 115 HA LYS 115 13.402 -3.319 -4.162 992 HB2 LYS 115 2HB LYS 115 13.161 -2.313 -7.027 993 HB3 LYS 115 3HB LYS 115 14.533 -2.050 -5.953 994 HG2 LYS 115 2HG LYS 115 14.829 -4.571 -5.872 995 HG3 LYS 115 3HG LYS 115 13.613 -4.684 -7.147 996 HD2 LYS 115 2HD LYS 115 16.296 -3.256 -7.315 997 HD3 LYS 115 3HD LYS 115 15.856 -4.760 -8.125 998 HE2 LYS 115 2HE LYS 115 14.250 -3.594 -9.532 999 HE3 LYS 115 3HE LYS 115 14.501 -2.088 -8.643 1000 HZ1 LYS 115 3HZ LYS 115 15.730 -2.077 -10.711 1001 HZ2 LYS 115 1HZ LYS 115 16.539 -3.495 -10.284 1002 HZ3 LYS 115 2HZ LYS 115 16.808 -2.075 -9.411 1003 H ILE 116 H ILE 116 10.642 -1.762 -5.751 1004 HA ILE 116 HA ILE 116 11.183 0.882 -4.805 1005 HB ILE 116 HB ILE 116 8.424 -0.220 -5.523 1006 HG12 ILE 116 2HG1 ILE 116 10.005 -0.659 -7.403 1007 HG13 ILE 116 3HG1 ILE 116 8.780 0.517 -7.836 1008 HG21 ILE 116 1HG2 ILE 116 8.466 1.982 -4.383 1009 HG22 ILE 116 2HG2 ILE 116 7.873 2.097 -6.032 1010 HG23 ILE 116 3HG2 ILE 116 9.515 2.622 -5.652 1011 HD11 ILE 116 3HD1 ILE 116 10.964 1.085 -8.743 1012 HD12 ILE 116 1HD1 ILE 116 11.645 1.152 -7.118 1013 HD13 ILE 116 2HD1 ILE 116 10.413 2.317 -7.608 1014 H VAL 117 H VAL 117 9.501 -1.923 -3.436 1015 HA VAL 117 HA VAL 117 8.189 -0.776 -1.227 1016 HB VAL 117 HB VAL 117 9.610 -3.493 -1.256 1017 HG11 VAL 117 1HG1 VAL 117 7.288 -2.542 0.468 1018 HG12 VAL 117 2HG1 VAL 117 8.946 -2.810 1.008 1019 HG13 VAL 117 3HG1 VAL 117 7.972 -4.172 0.461 1020 HG21 VAL 117 3HG2 VAL 117 6.769 -2.835 -2.103 1021 HG22 VAL 117 1HG2 VAL 117 7.443 -4.462 -1.953 1022 HG23 VAL 117 2HG2 VAL 117 8.088 -3.346 -3.151 1023 H ARG 118 H ARG 118 11.556 -1.731 -1.710 1024 HA ARG 118 HA ARG 118 12.558 -1.432 0.893 1025 HB2 ARG 118 2HB ARG 118 14.081 -0.919 -1.694 1026 HB3 ARG 118 3HB ARG 118 14.795 -1.251 -0.118 1027 HG2 ARG 118 2HG ARG 118 13.738 -3.518 -0.165 1028 HG3 ARG 118 3HG ARG 118 13.143 -3.171 -1.792 1029 HD2 ARG 118 2HD ARG 118 16.055 -3.309 -0.927 1030 HD3 ARG 118 3HD ARG 118 15.192 -4.499 -1.904 1031 HE ARG 118 HE ARG 118 15.117 -1.919 -3.119 1032 HH11 ARG 118 1HH1 ARG 118 17.306 -4.668 -2.682 1033 HH12 ARG 118 2HH1 ARG 118 18.220 -4.305 -4.109 1034 HH21 ARG 118 1HH2 ARG 118 16.359 -1.442 -4.943 1035 HH22 ARG 118 2HH2 ARG 118 17.685 -2.468 -5.393 1036 H GLU 119 H GLU 119 12.150 0.956 -1.716 1037 HA GLU 119 HA GLU 119 13.387 3.176 -0.526 1038 HB2 GLU 119 2HB GLU 119 11.003 3.088 -2.437 1039 HB3 GLU 119 3HB GLU 119 11.850 4.561 -1.979 1040 HG2 GLU 119 2HG GLU 119 13.946 3.569 -2.949 1041 HG3 GLU 119 3HG GLU 119 12.964 2.228 -3.545 1042 H PHE 120 H PHE 120 9.939 2.253 -0.538 1043 HA PHE 120 HA PHE 120 8.903 4.311 0.992 1044 HB2 PHE 120 2HB PHE 120 7.928 1.428 0.817 1045 HB3 PHE 120 3HB PHE 120 6.978 2.767 1.455 1046 HD1 PHE 120 HD2 PHE 120 7.451 4.967 -0.406 1047 HD2 PHE 120 HD1 PHE 120 6.944 0.798 -1.206 1048 HE1 PHE 120 HE2 PHE 120 6.618 5.499 -2.660 1049 HE2 PHE 120 HE1 PHE 120 6.129 1.343 -3.447 1050 HZ PHE 120 HZ PHE 120 5.951 3.679 -4.175 1051 H MET 121 H MET 121 9.976 1.137 2.129 1052 HA MET 121 HA MET 121 9.460 1.512 4.877 1053 HB2 MET 121 2HB MET 121 11.466 -0.337 3.515 1054 HB3 MET 121 3HB MET 121 11.024 -0.428 5.215 1055 HG2 MET 121 2HG MET 121 8.683 -0.904 4.572 1056 HG3 MET 121 3HG MET 121 9.157 -0.858 2.872 1057 HE1 MET 121 3HE MET 121 12.013 -2.336 2.883 1058 HE2 MET 121 1HE MET 121 10.736 -2.668 1.715 1059 HE3 MET 121 2HE MET 121 11.502 -3.998 2.584 1060 H GLN 122 H GLN 122 12.321 2.229 2.917 1061 HA GLN 122 HA GLN 122 14.102 2.851 5.067 1062 HB2 GLN 122 2HB GLN 122 14.908 2.147 2.857 1063 HB3 GLN 122 3HB GLN 122 14.186 3.561 2.101 1064 HG2 GLN 122 2HG GLN 122 15.752 5.021 3.286 1065 HG3 GLN 122 3HG GLN 122 16.447 3.634 4.121 1066 HE21 GLN 122 1HE2 GLN 122 17.681 5.622 2.287 1067 HE22 GLN 122 2HE2 GLN 122 18.425 4.686 1.041 1068 H LYS 123 H LYS 123 11.987 4.796 2.995 1069 HA LYS 123 HA LYS 123 12.859 7.367 3.923 1070 HB2 LYS 123 2HB LYS 123 10.354 6.527 2.375 1071 HB3 LYS 123 3HB LYS 123 10.831 8.200 2.659 1072 HG2 LYS 123 2HG LYS 123 12.816 7.950 1.308 1073 HG3 LYS 123 3HG LYS 123 12.585 6.204 1.193 1074 HD2 LYS 123 2HD LYS 123 10.469 6.617 -0.108 1075 HD3 LYS 123 3HD LYS 123 10.822 8.349 -0.068 1076 HE2 LYS 123 2HE LYS 123 12.890 7.994 -1.323 1077 HE3 LYS 123 3HE LYS 123 12.655 6.245 -1.278 1078 HZ1 LYS 123 3HZ LYS 123 10.598 6.578 -2.587 1079 HZ2 LYS 123 1HZ LYS 123 11.987 7.089 -3.405 1080 HZ3 LYS 123 2HZ LYS 123 10.954 8.223 -2.700 1081 H ALA 124 H ALA 124 10.080 5.258 4.584 1082 HA ALA 124 HA ALA 124 8.783 6.711 6.592 1083 HB1 ALA 124 3HB ALA 124 7.846 4.531 7.299 1084 HB2 ALA 124 1HB ALA 124 9.048 3.690 6.310 1085 HB3 ALA 124 2HB ALA 124 7.822 4.701 5.544 1086 H GLY 125 H GLY 125 11.552 4.532 6.702 1087 HA2 GLY 125 2HA GLY 125 11.898 4.318 9.510 1088 HA3 GLY 125 3HA GLY 125 13.135 4.041 8.284 1089 H SER 126 H SER 126 12.979 6.702 7.108 1090 HA SER 126 HA SER 126 14.885 8.014 8.801 1091 HB2 SER 126 2HB SER 126 13.538 8.961 6.227 1092 HB3 SER 126 3HB SER 126 14.928 9.736 6.999 1093 HG SER 126 HG SER 126 14.764 7.199 5.778 1094 H LEU 127 H LEU 127 11.484 8.438 8.015 1095 HA LEU 127 HA LEU 127 11.049 10.949 9.277 1096 HB2 LEU 127 2HB LEU 127 9.094 8.702 8.633 1097 HB3 LEU 127 3HB LEU 127 8.618 10.313 9.153 1098 HG LEU 127 HG LEU 127 10.116 9.695 6.573 1099 HD11 LEU 127 1HD1 LEU 127 8.025 10.196 5.408 1100 HD12 LEU 127 2HD1 LEU 127 7.189 10.416 6.947 1101 HD13 LEU 127 3HD1 LEU 127 7.825 8.830 6.503 1102 HD21 LEU 127 3HD2 LEU 127 8.964 12.320 7.585 1103 HD22 LEU 127 1HD2 LEU 127 9.642 12.048 5.977 1104 HD23 LEU 127 2HD2 LEU 127 10.674 11.919 7.398 1105 H GLU 128 H GLU 128 10.934 7.622 10.420 1106 HA GLU 128 HA GLU 128 10.002 8.315 13.079 1107 HB2 GLU 128 2HB GLU 128 11.117 5.712 11.946 1108 HB3 GLU 128 3HB GLU 128 10.404 5.888 13.549 1109 HG2 GLU 128 2HG GLU 128 9.014 6.195 10.875 1110 HG3 GLU 128 3HG GLU 128 8.750 4.938 12.083 1111 H HIS 129 H HIS 129 12.931 8.628 11.523 1112 HA HIS 129 HA HIS 129 15.091 8.960 12.088 1113 HB2 HIS 129 2HB HIS 129 13.902 9.668 14.817 1114 HB3 HIS 129 3HB HIS 129 15.516 10.101 14.258 1115 HD1 HIS 129 HD1 HIS 129 15.660 11.923 12.360 1116 HD2 HIS 129 HD2 HIS 129 11.842 11.291 13.864 1117 HE1 HIS 129 HE1 HIS 129 14.263 13.807 11.473 1118 HE2 HIS 129 HE2 HIS 129 11.938 13.322 12.279 1119 H HIS 130 H HIS 130 14.320 6.369 12.043 1120 HA HIS 130 HA HIS 130 14.857 4.758 14.235 1121 HB2 HIS 130 2HB HIS 130 15.036 2.900 12.693 1122 HB3 HIS 130 3HB HIS 130 13.788 3.978 12.094 1123 HD1 HIS 130 HD1 HIS 130 16.002 5.910 10.618 1124 HD2 HIS 130 HD2 HIS 130 15.486 1.810 10.178 1125 HE1 HIS 130 HE1 HIS 130 16.901 5.349 8.342 1126 HE2 HIS 130 HE2 HIS 130 16.746 2.849 8.175 1127 H HIS 131 H HIS 131 16.656 4.043 15.214 1128 HA HIS 131 HA HIS 131 19.050 5.613 14.688 1129 HB2 HIS 131 2HB HIS 131 18.134 3.966 17.076 1130 HB3 HIS 131 3HB HIS 131 19.754 4.656 16.983 1131 HD1 HIS 131 HD1 HIS 131 16.116 5.747 17.144 1132 HD2 HIS 131 HD2 HIS 131 19.926 7.365 17.568 1133 HE1 HIS 131 HE1 HIS 131 15.767 8.083 18.004 1134 HE2 HIS 131 HE2 HIS 131 18.082 9.028 18.269 1135 H HIS 132 H HIS 132 18.862 3.904 12.704 1136 HA HIS 132 HA HIS 132 21.472 2.588 12.999 1137 HB2 HIS 132 2HB HIS 132 19.066 1.543 11.427 1138 HB3 HIS 132 3HB HIS 132 20.714 0.970 11.158 1139 HD1 HIS 132 HD1 HIS 132 17.794 0.482 13.358 1140 HD2 HIS 132 HD2 HIS 132 21.848 -0.426 13.429 1141 HE1 HIS 132 HE1 HIS 132 18.086 -1.163 15.231 1142 HE2 HIS 132 HE2 HIS 132 20.555 -1.569 15.351 1143 H HIS 133 H HIS 133 22.273 4.582 12.451 1144 HA HIS 133 HA HIS 133 22.169 5.407 9.647 1145 HB2 HIS 133 2HB HIS 133 20.319 6.689 10.697 1146 HB3 HIS 133 3HB HIS 133 21.399 7.247 11.965 1147 HD1 HIS 133 HD1 HIS 133 20.663 7.744 8.295 1148 HD2 HIS 133 HD2 HIS 133 22.907 9.516 11.314 1149 HE1 HIS 133 HE1 HIS 133 21.415 9.955 7.373 1150 HE2 HIS 133 HE2 HIS 133 22.690 11.041 9.237 1151 H HIS 134 H HIS 134 24.119 6.229 9.022 1152 HA HIS 134 HA HIS 134 26.291 6.326 10.984 1153 HB2 HIS 134 2HB HIS 134 26.471 6.576 7.942 1154 HB3 HIS 134 3HB HIS 134 27.812 6.354 9.058 1155 HD1 HIS 134 HD1 HIS 134 27.741 4.368 6.890 1156 HD2 HIS 134 HD2 HIS 134 25.531 3.805 10.367 1157 HE1 HIS 134 HE1 HIS 134 27.282 1.900 7.006 1158 HE2 HIS 134 HE2 HIS 134 25.934 1.586 9.104 Start of MODEL 10 1 H1 MET 1 1H MET 1 3.102 7.927 15.519 2 H2 MET 1 2H MET 1 1.656 8.406 16.245 3 H3 MET 1 3H MET 1 1.644 7.762 14.681 4 HA MET 1 HA MET 1 2.414 6.349 17.148 5 HB2 MET 1 2HB MET 1 -0.095 6.198 15.432 6 HB3 MET 1 3HB MET 1 0.331 4.951 16.599 7 HG2 MET 1 2HG MET 1 -1.312 6.465 17.549 8 HG3 MET 1 3HG MET 1 0.218 6.614 18.414 9 HE1 MET 1 3HE MET 1 -1.180 10.261 18.634 10 HE2 MET 1 1HE MET 1 -0.474 8.923 19.538 11 HE3 MET 1 2HE MET 1 -2.061 8.740 18.788 12 H LYS 2 H LYS 2 1.705 6.049 13.644 13 HA LYS 2 HA LYS 2 3.884 4.243 13.191 14 HB2 LYS 2 2HB LYS 2 2.459 2.280 12.469 15 HB3 LYS 2 3HB LYS 2 2.442 2.596 14.198 16 HG2 LYS 2 2HG LYS 2 0.245 3.984 13.611 17 HG3 LYS 2 3HG LYS 2 0.222 2.937 12.187 18 HD2 LYS 2 2HD LYS 2 0.079 0.952 13.555 19 HD3 LYS 2 3HD LYS 2 0.446 1.866 15.020 20 HE2 LYS 2 2HE LYS 2 -1.757 3.159 14.487 21 HE3 LYS 2 3HE LYS 2 -2.125 1.785 13.445 22 HZ1 LYS 2 3HZ LYS 2 -3.065 1.471 15.618 23 HZ2 LYS 2 1HZ LYS 2 -1.559 1.693 16.356 24 HZ3 LYS 2 2HZ LYS 2 -1.830 0.338 15.387 25 H ILE 3 H ILE 3 4.080 3.592 10.994 26 HA ILE 3 HA ILE 3 2.742 5.371 9.050 27 HB ILE 3 HB ILE 3 5.465 3.984 8.957 28 HG12 ILE 3 2HG1 ILE 3 4.718 6.945 9.109 29 HG13 ILE 3 3HG1 ILE 3 5.334 5.986 10.447 30 HG21 ILE 3 1HG2 ILE 3 5.836 5.145 6.799 31 HG22 ILE 3 2HG2 ILE 3 4.177 5.742 6.834 32 HG23 ILE 3 3HG2 ILE 3 4.487 4.010 6.695 33 HD11 ILE 3 3HD1 ILE 3 6.825 6.736 7.940 34 HD12 ILE 3 1HD1 ILE 3 7.452 5.705 9.232 35 HD13 ILE 3 2HD1 ILE 3 7.052 7.389 9.562 36 H LEU 4 H LEU 4 1.628 4.455 7.379 37 HA LEU 4 HA LEU 4 1.318 1.520 7.358 38 HB2 LEU 4 2HB LEU 4 -0.676 3.630 6.429 39 HB3 LEU 4 3HB LEU 4 -0.946 1.894 6.501 40 HG LEU 4 HG LEU 4 -0.642 3.789 8.864 41 HD11 LEU 4 1HD1 LEU 4 -2.996 2.123 7.935 42 HD12 LEU 4 2HD1 LEU 4 -2.827 3.875 7.794 43 HD13 LEU 4 3HD1 LEU 4 -2.946 3.130 9.386 44 HD21 LEU 4 3HD2 LEU 4 0.476 1.699 9.458 45 HD22 LEU 4 1HD2 LEU 4 -0.933 0.765 8.946 46 HD23 LEU 4 2HD2 LEU 4 -1.042 1.845 10.338 47 H ILE 5 H ILE 5 2.278 0.604 5.683 48 HA ILE 5 HA ILE 5 2.737 2.035 3.162 49 HB ILE 5 HB ILE 5 3.571 -0.829 3.840 50 HG12 ILE 5 2HG1 ILE 5 4.554 0.691 5.558 51 HG13 ILE 5 3HG1 ILE 5 5.793 0.000 4.523 52 HG21 ILE 5 1HG2 ILE 5 4.644 1.131 1.769 53 HG22 ILE 5 2HG2 ILE 5 3.636 -0.282 1.446 54 HG23 ILE 5 3HG2 ILE 5 5.273 -0.493 2.067 55 HD11 ILE 5 3HD1 ILE 5 6.266 2.313 5.013 56 HD12 ILE 5 1HD1 ILE 5 4.701 2.809 4.371 57 HD13 ILE 5 2HD1 ILE 5 5.924 2.128 3.293 58 H LEU 6 H LEU 6 0.912 2.046 1.916 59 HA LEU 6 HA LEU 6 -0.976 -0.219 1.951 60 HB2 LEU 6 2HB LEU 6 -1.507 2.423 2.065 61 HB3 LEU 6 3HB LEU 6 -1.378 2.317 0.326 62 HG LEU 6 HG LEU 6 -3.706 2.189 0.846 63 HD11 LEU 6 1HD1 LEU 6 -2.873 -0.677 0.308 64 HD12 LEU 6 2HD1 LEU 6 -3.099 0.588 -0.901 65 HD13 LEU 6 3HD1 LEU 6 -4.477 0.015 0.035 66 HD21 LEU 6 3HD2 LEU 6 -4.713 0.625 2.453 67 HD22 LEU 6 1HD2 LEU 6 -3.553 1.702 3.229 68 HD23 LEU 6 2HD2 LEU 6 -3.110 0.029 2.889 69 H ILE 7 H ILE 7 -0.882 -1.702 0.280 70 HA ILE 7 HA ILE 7 0.455 -0.963 -2.255 71 HB ILE 7 HB ILE 7 0.916 -3.552 -0.685 72 HG12 ILE 7 2HG1 ILE 7 2.819 -1.274 -1.428 73 HG13 ILE 7 3HG1 ILE 7 2.211 -1.626 0.183 74 HG21 ILE 7 1HG2 ILE 7 1.965 -2.799 -3.448 75 HG22 ILE 7 2HG2 ILE 7 0.780 -4.059 -3.098 76 HG23 ILE 7 3HG2 ILE 7 2.440 -4.231 -2.531 77 HD11 ILE 7 3HD1 ILE 7 3.420 -3.746 0.164 78 HD12 ILE 7 1HD1 ILE 7 4.477 -2.352 -0.048 79 HD13 ILE 7 2HD1 ILE 7 4.060 -3.356 -1.435 80 H ASN 8 H ASN 8 -0.841 -1.256 -3.891 81 HA ASN 8 HA ASN 8 -2.732 -3.531 -4.003 82 HB2 ASN 8 2HB ASN 8 -3.913 -1.387 -4.253 83 HB3 ASN 8 3HB ASN 8 -2.775 -0.853 -5.483 84 HD21 ASN 8 1HD2 ASN 8 -5.498 -2.941 -4.808 85 HD22 ASN 8 2HD2 ASN 8 -5.872 -3.312 -6.454 86 H THR 9 H THR 9 -1.793 -5.128 -5.123 87 HA THR 9 HA THR 9 -0.227 -4.474 -7.549 88 HB THR 9 HB THR 9 1.307 -5.483 -5.959 89 HG1 THR 9 HG1 THR 9 2.105 -6.607 -7.538 90 HG21 THR 9 3HG2 THR 9 -0.613 -7.835 -5.748 91 HG22 THR 9 1HG2 THR 9 -0.258 -6.671 -4.470 92 HG23 THR 9 2HG2 THR 9 1.006 -7.761 -5.047 93 H ASN 10 H ASN 10 -0.662 -5.653 -9.364 94 HA ASN 10 HA ASN 10 -3.329 -6.712 -9.642 95 HB2 ASN 10 2HB ASN 10 -2.239 -5.274 -11.381 96 HB3 ASN 10 3HB ASN 10 -1.024 -6.515 -11.642 97 HD21 ASN 10 1HD2 ASN 10 -4.300 -5.535 -12.261 98 HD22 ASN 10 2HD2 ASN 10 -4.665 -6.767 -13.417 99 H ASN 11 H ASN 11 -0.155 -7.937 -9.150 100 HA ASN 11 HA ASN 11 -0.734 -10.622 -10.222 101 HB2 ASN 11 2HB ASN 11 1.910 -9.387 -9.324 102 HB3 ASN 11 3HB ASN 11 1.716 -10.973 -10.069 103 HD21 ASN 11 1HD2 ASN 11 1.795 -7.551 -10.629 104 HD22 ASN 11 2HD2 ASN 11 1.761 -7.628 -12.355 105 H ASP 12 H ASP 12 -0.789 -12.412 -9.035 106 HA ASP 12 HA ASP 12 -1.267 -12.355 -6.213 107 HB2 ASP 12 2HB ASP 12 -0.804 -14.796 -7.997 108 HB3 ASP 12 3HB ASP 12 -1.552 -14.801 -6.402 109 H GLU 13 H GLU 13 1.474 -13.189 -8.238 110 HA GLU 13 HA GLU 13 3.066 -14.494 -6.273 111 HB2 GLU 13 2HB GLU 13 3.881 -13.155 -8.891 112 HB3 GLU 13 3HB GLU 13 4.960 -14.129 -7.888 113 HG2 GLU 13 2HG GLU 13 3.462 -16.084 -8.194 114 HG3 GLU 13 3HG GLU 13 2.426 -15.104 -9.233 115 H LEU 14 H LEU 14 2.789 -11.112 -7.346 116 HA LEU 14 HA LEU 14 5.040 -10.183 -5.865 117 HB2 LEU 14 2HB LEU 14 2.803 -8.803 -7.330 118 HB3 LEU 14 3HB LEU 14 3.753 -7.861 -6.190 119 HG LEU 14 HG LEU 14 4.677 -7.582 -8.425 120 HD11 LEU 14 1HD1 LEU 14 7.017 -8.164 -8.007 121 HD12 LEU 14 2HD1 LEU 14 6.548 -9.290 -6.735 122 HD13 LEU 14 3HD1 LEU 14 6.263 -7.558 -6.534 123 HD21 LEU 14 3HD2 LEU 14 3.897 -9.681 -9.458 124 HD22 LEU 14 1HD2 LEU 14 5.080 -10.598 -8.526 125 HD23 LEU 14 2HD2 LEU 14 5.614 -9.434 -9.738 126 H ILE 15 H ILE 15 1.742 -10.781 -4.938 127 HA ILE 15 HA ILE 15 1.610 -9.360 -2.526 128 HB ILE 15 HB ILE 15 0.488 -12.148 -3.102 129 HG12 ILE 15 2HG1 ILE 15 -0.854 -9.416 -3.407 130 HG13 ILE 15 3HG1 ILE 15 -0.255 -10.401 -4.737 131 HG21 ILE 15 1HG2 ILE 15 0.506 -11.673 -0.671 132 HG22 ILE 15 2HG2 ILE 15 -1.141 -11.709 -1.295 133 HG23 ILE 15 3HG2 ILE 15 -0.366 -10.163 -0.951 134 HD11 ILE 15 3HD1 ILE 15 -2.645 -10.584 -4.552 135 HD12 ILE 15 1HD1 ILE 15 -2.515 -11.115 -2.873 136 HD13 ILE 15 2HD1 ILE 15 -1.896 -12.135 -4.175 137 H LYS 16 H LYS 16 2.763 -12.735 -3.052 138 HA LYS 16 HA LYS 16 3.627 -13.092 -0.343 139 HB2 LYS 16 2HB LYS 16 4.459 -15.291 -1.085 140 HB3 LYS 16 3HB LYS 16 2.829 -14.995 -1.679 141 HG2 LYS 16 2HG LYS 16 3.693 -14.465 -3.906 142 HG3 LYS 16 3HG LYS 16 5.352 -14.653 -3.336 143 HD2 LYS 16 2HD LYS 16 4.907 -17.064 -2.896 144 HD3 LYS 16 3HD LYS 16 3.259 -16.862 -3.502 145 HE2 LYS 16 2HE LYS 16 4.155 -16.228 -5.724 146 HE3 LYS 16 3HE LYS 16 5.803 -16.423 -5.118 147 HZ1 LYS 16 3HZ LYS 16 5.054 -18.363 -6.345 148 HZ2 LYS 16 1HZ LYS 16 3.761 -18.568 -5.277 149 HZ3 LYS 16 2HZ LYS 16 5.347 -18.757 -4.728 150 H LYS 17 H LYS 17 5.303 -12.138 -3.323 151 HA LYS 17 HA LYS 17 7.974 -12.575 -2.385 152 HB2 LYS 17 2HB LYS 17 6.967 -10.827 -4.670 153 HB3 LYS 17 3HB LYS 17 8.662 -11.209 -4.371 154 HG2 LYS 17 2HG LYS 17 8.216 -13.600 -4.734 155 HG3 LYS 17 3HG LYS 17 6.503 -13.251 -4.977 156 HD2 LYS 17 2HD LYS 17 7.480 -13.527 -7.155 157 HD3 LYS 17 3HD LYS 17 7.154 -11.807 -6.953 158 HE2 LYS 17 2HE LYS 17 9.497 -11.353 -6.527 159 HE3 LYS 17 3HE LYS 17 9.870 -13.079 -6.474 160 HZ1 LYS 17 3HZ LYS 17 8.943 -11.570 -8.861 161 HZ2 LYS 17 1HZ LYS 17 9.231 -13.237 -8.809 162 HZ3 LYS 17 2HZ LYS 17 10.501 -12.154 -8.580 163 H ILE 18 H ILE 18 5.928 -9.660 -2.652 164 HA ILE 18 HA ILE 18 7.702 -7.812 -1.459 165 HB ILE 18 HB ILE 18 4.664 -7.845 -1.701 166 HG12 ILE 18 2HG1 ILE 18 6.775 -6.065 -3.025 167 HG13 ILE 18 3HG1 ILE 18 6.023 -7.463 -3.782 168 HG21 ILE 18 1HG2 ILE 18 6.304 -5.595 -0.489 169 HG22 ILE 18 2HG2 ILE 18 5.137 -6.607 0.366 170 HG23 ILE 18 3HG2 ILE 18 4.591 -5.507 -0.898 171 HD11 ILE 18 3HD1 ILE 18 5.050 -5.417 -4.606 172 HD12 ILE 18 1HD1 ILE 18 4.626 -4.914 -2.969 173 HD13 ILE 18 2HD1 ILE 18 3.848 -6.326 -3.691 174 H LYS 19 H LYS 19 5.293 -10.074 -0.063 175 HA LYS 19 HA LYS 19 5.445 -9.301 2.630 176 HB2 LYS 19 2HB LYS 19 4.904 -12.014 1.384 177 HB3 LYS 19 3HB LYS 19 4.901 -11.785 3.131 178 HG2 LYS 19 2HG LYS 19 3.087 -10.142 2.927 179 HG3 LYS 19 3HG LYS 19 3.079 -10.356 1.171 180 HD2 LYS 19 2HD LYS 19 2.441 -12.709 1.427 181 HD3 LYS 19 3HD LYS 19 2.560 -12.581 3.185 182 HE2 LYS 19 2HE LYS 19 0.713 -10.929 3.164 183 HE3 LYS 19 3HE LYS 19 0.576 -11.129 1.413 184 HZ1 LYS 19 3HZ LYS 19 0.171 -13.262 3.440 185 HZ2 LYS 19 1HZ LYS 19 0.036 -13.458 1.764 186 HZ3 LYS 19 2HZ LYS 19 -1.042 -12.456 2.588 187 H LYS 20 H LYS 20 7.614 -11.421 0.754 188 HA LYS 20 HA LYS 20 9.168 -12.315 2.974 189 HB2 LYS 20 2HB LYS 20 9.863 -12.200 0.010 190 HB3 LYS 20 3HB LYS 20 10.829 -13.028 1.220 191 HG2 LYS 20 2HG LYS 20 7.958 -13.756 0.568 192 HG3 LYS 20 3HG LYS 20 9.356 -14.509 -0.187 193 HD2 LYS 20 2HD LYS 20 8.782 -16.050 1.482 194 HD3 LYS 20 3HD LYS 20 10.071 -15.135 2.255 195 HE2 LYS 20 2HE LYS 20 8.376 -13.830 3.501 196 HE3 LYS 20 3HE LYS 20 7.090 -14.729 2.698 197 HZ1 LYS 20 3HZ LYS 20 7.595 -15.545 4.939 198 HZ2 LYS 20 1HZ LYS 20 9.163 -15.946 4.442 199 HZ3 LYS 20 2HZ LYS 20 7.833 -16.732 3.756 200 H GLU 21 H GLU 21 9.827 -9.854 0.476 201 HA GLU 21 HA GLU 21 12.165 -8.737 1.376 202 HB2 GLU 21 2HB GLU 21 9.800 -7.212 0.213 203 HB3 GLU 21 3HB GLU 21 11.445 -6.591 0.306 204 HG2 GLU 21 2HG GLU 21 10.545 -9.003 -1.296 205 HG3 GLU 21 3HG GLU 21 10.888 -7.407 -1.949 206 H VAL 22 H VAL 22 8.908 -7.942 2.563 207 HA VAL 22 HA VAL 22 9.877 -5.846 4.340 208 HB VAL 22 HB VAL 22 7.591 -5.333 4.807 209 HG11 VAL 22 1HG1 VAL 22 7.881 -6.153 1.898 210 HG12 VAL 22 2HG1 VAL 22 8.297 -4.599 2.611 211 HG13 VAL 22 3HG1 VAL 22 6.615 -5.097 2.517 212 HG21 VAL 22 3HG2 VAL 22 6.670 -7.539 5.266 213 HG22 VAL 22 1HG2 VAL 22 6.812 -7.996 3.565 214 HG23 VAL 22 2HG2 VAL 22 5.675 -6.736 4.053 215 H GLU 23 H GLU 23 9.133 -9.211 4.592 216 HA GLU 23 HA GLU 23 8.459 -9.484 7.316 217 HB2 GLU 23 2HB GLU 23 8.193 -11.236 5.518 218 HB3 GLU 23 3HB GLU 23 9.928 -11.511 5.563 219 HG2 GLU 23 2HG GLU 23 9.754 -12.293 7.889 220 HG3 GLU 23 3HG GLU 23 8.024 -11.941 7.896 221 H ASN 24 H ASN 24 11.539 -9.405 5.623 222 HA ASN 24 HA ASN 24 13.159 -9.802 8.010 223 HB2 ASN 24 2HB ASN 24 13.961 -9.119 5.143 224 HB3 ASN 24 3HB ASN 24 15.088 -9.499 6.441 225 HD21 ASN 24 1HD2 ASN 24 12.890 -10.805 4.127 226 HD22 ASN 24 2HD2 ASN 24 13.217 -12.467 4.450 227 H GLN 25 H GLN 25 11.465 -7.170 6.879 228 HA GLN 25 HA GLN 25 13.453 -5.170 7.808 229 HB2 GLN 25 2HB GLN 25 10.987 -4.726 6.070 230 HB3 GLN 25 3HB GLN 25 12.152 -3.496 6.537 231 HG2 GLN 25 2HG GLN 25 12.695 -5.874 4.748 232 HG3 GLN 25 3HG GLN 25 12.480 -4.216 4.218 233 HE21 GLN 25 1HE2 GLN 25 14.669 -6.504 5.601 234 HE22 GLN 25 2HE2 GLN 25 16.067 -5.499 5.541 235 H GLY 26 H GLY 26 10.817 -6.845 8.948 236 HA2 GLY 26 2HA GLY 26 9.578 -6.635 10.863 237 HA3 GLY 26 3HA GLY 26 10.428 -5.139 11.207 238 H TYR 27 H TYR 27 8.555 -5.693 8.273 239 HA TYR 27 HA TYR 27 6.483 -3.778 9.190 240 HB2 TYR 27 2HB TYR 27 7.682 -4.322 6.450 241 HB3 TYR 27 3HB TYR 27 6.075 -3.613 6.585 242 HD1 TYR 27 HD2 TYR 27 9.587 -3.091 7.869 243 HD2 TYR 27 HD1 TYR 27 5.889 -1.251 6.753 244 HE1 TYR 27 HE2 TYR 27 10.581 -0.870 8.235 245 HE2 TYR 27 HE1 TYR 27 6.885 0.968 7.127 246 HH TYR 27 HH TYR 27 10.223 1.466 7.538 247 H GLN 28 H GLN 28 4.687 -4.726 9.810 248 HA GLN 28 HA GLN 28 4.233 -7.556 9.333 249 HB2 GLN 28 2HB GLN 28 2.651 -5.604 11.058 250 HB3 GLN 28 3HB GLN 28 2.563 -7.359 11.122 251 HG2 GLN 28 2HG GLN 28 5.063 -5.778 11.784 252 HG3 GLN 28 3HG GLN 28 3.866 -6.264 12.975 253 HE21 GLN 28 1HE2 GLN 28 5.389 -7.459 14.141 254 HE22 GLN 28 2HE2 GLN 28 6.010 -8.972 13.576 255 H VAL 29 H VAL 29 3.019 -8.241 7.689 256 HA VAL 29 HA VAL 29 1.370 -6.418 6.130 257 HB VAL 29 HB VAL 29 1.860 -9.398 5.624 258 HG11 VAL 29 1HG1 VAL 29 -0.140 -8.545 4.452 259 HG12 VAL 29 2HG1 VAL 29 1.147 -8.902 3.297 260 HG13 VAL 29 3HG1 VAL 29 0.811 -7.231 3.756 261 HG21 VAL 29 3HG2 VAL 29 3.576 -8.692 4.005 262 HG22 VAL 29 1HG2 VAL 29 3.982 -8.146 5.635 263 HG23 VAL 29 2HG2 VAL 29 3.324 -7.004 4.461 264 H ARG 30 H ARG 30 -0.804 -6.449 5.935 265 HA ARG 30 HA ARG 30 -2.454 -8.541 7.226 266 HB2 ARG 30 2HB ARG 30 -3.153 -5.576 6.915 267 HB3 ARG 30 3HB ARG 30 -4.166 -6.799 7.669 268 HG2 ARG 30 2HG ARG 30 -1.503 -5.793 8.719 269 HG3 ARG 30 3HG ARG 30 -3.092 -5.352 9.337 270 HD2 ARG 30 2HD ARG 30 -3.479 -7.696 10.023 271 HD3 ARG 30 3HD ARG 30 -1.898 -8.146 9.386 272 HE ARG 30 HE ARG 30 -0.851 -6.916 11.132 273 HH11 ARG 30 1HH1 ARG 30 -4.336 -7.172 11.535 274 HH12 ARG 30 2HH1 ARG 30 -4.280 -6.813 13.233 275 HH21 ARG 30 1HH2 ARG 30 -0.793 -6.479 13.356 276 HH22 ARG 30 2HH2 ARG 30 -2.277 -6.421 14.262 277 H ASP 31 H ASP 31 -3.621 -9.612 5.717 278 HA ASP 31 HA ASP 31 -3.895 -8.607 2.973 279 HB2 ASP 31 2HB ASP 31 -4.808 -11.235 4.240 280 HB3 ASP 31 3HB ASP 31 -5.000 -10.838 2.538 281 H VAL 32 H VAL 32 -5.576 -7.375 2.441 282 HA VAL 32 HA VAL 32 -8.235 -7.804 3.696 283 HB VAL 32 HB VAL 32 -7.039 -5.150 2.724 284 HG11 VAL 32 1HG1 VAL 32 -9.163 -4.103 3.458 285 HG12 VAL 32 2HG1 VAL 32 -9.827 -5.696 3.823 286 HG13 VAL 32 3HG1 VAL 32 -9.434 -5.265 2.158 287 HG21 VAL 32 3HG2 VAL 32 -7.832 -6.022 5.536 288 HG22 VAL 32 1HG2 VAL 32 -7.242 -4.417 5.085 289 HG23 VAL 32 2HG2 VAL 32 -6.183 -5.822 4.940 290 H ASN 33 H ASN 33 -9.452 -8.812 2.213 291 HA ASN 33 HA ASN 33 -9.589 -7.803 -0.558 292 HB2 ASN 33 2HB ASN 33 -9.191 -10.717 0.257 293 HB3 ASN 33 3HB ASN 33 -9.808 -10.261 -1.325 294 HD21 ASN 33 1HD2 ASN 33 -6.996 -10.294 0.746 295 HD22 ASN 33 2HD2 ASN 33 -5.844 -9.914 -0.482 296 H ASP 34 H ASP 34 -11.209 -7.935 2.131 297 HA ASP 34 HA ASP 34 -13.768 -8.066 0.722 298 HB2 ASP 34 2HB ASP 34 -13.455 -10.307 1.849 299 HB3 ASP 34 3HB ASP 34 -13.354 -9.490 3.402 300 H SER 35 H SER 35 -15.359 -6.723 1.636 301 HA SER 35 HA SER 35 -14.618 -4.298 2.699 302 HB2 SER 35 2HB SER 35 -17.099 -3.999 3.060 303 HB3 SER 35 3HB SER 35 -16.674 -4.621 1.466 304 HG SER 35 HG SER 35 -16.999 -6.755 2.911 305 H ASP 36 H ASP 36 -15.856 -7.144 4.439 306 HA ASP 36 HA ASP 36 -16.054 -5.957 6.997 307 HB2 ASP 36 2HB ASP 36 -15.739 -8.873 6.183 308 HB3 ASP 36 3HB ASP 36 -16.007 -8.355 7.849 309 H GLU 37 H GLU 37 -13.401 -7.618 5.356 310 HA GLU 37 HA GLU 37 -11.562 -7.793 7.494 311 HB2 GLU 37 2HB GLU 37 -10.950 -7.404 4.527 312 HB3 GLU 37 3HB GLU 37 -9.825 -8.015 5.734 313 HG2 GLU 37 2HG GLU 37 -12.407 -9.398 4.968 314 HG3 GLU 37 3HG GLU 37 -10.851 -9.762 4.241 315 H LEU 38 H LEU 38 -12.170 -5.234 5.081 316 HA LEU 38 HA LEU 38 -10.228 -3.366 5.896 317 HB2 LEU 38 2HB LEU 38 -11.364 -3.111 3.801 318 HB3 LEU 38 3HB LEU 38 -12.936 -3.032 4.565 319 HG LEU 38 HG LEU 38 -11.038 -0.828 5.351 320 HD11 LEU 38 1HD1 LEU 38 -11.401 0.482 3.319 321 HD12 LEU 38 2HD1 LEU 38 -12.203 -0.893 2.555 322 HD13 LEU 38 3HD1 LEU 38 -10.491 -0.989 2.977 323 HD21 LEU 38 3HD2 LEU 38 -13.960 -0.787 4.493 324 HD22 LEU 38 1HD2 LEU 38 -13.053 0.582 5.145 325 HD23 LEU 38 2HD2 LEU 38 -13.371 -0.824 6.156 326 H LYS 39 H LYS 39 -13.647 -3.709 6.911 327 HA LYS 39 HA LYS 39 -13.730 -1.466 8.644 328 HB2 LYS 39 2HB LYS 39 -15.487 -3.945 8.513 329 HB3 LYS 39 3HB LYS 39 -15.847 -2.554 9.533 330 HG2 LYS 39 2HG LYS 39 -16.043 -1.118 7.535 331 HG3 LYS 39 3HG LYS 39 -15.645 -2.489 6.497 332 HD2 LYS 39 2HD LYS 39 -18.105 -2.266 8.287 333 HD3 LYS 39 3HD LYS 39 -18.086 -2.077 6.533 334 HE2 LYS 39 2HE LYS 39 -17.300 -4.442 6.328 335 HE3 LYS 39 3HE LYS 39 -17.439 -4.614 8.077 336 HZ1 LYS 39 3HZ LYS 39 -19.814 -4.121 7.861 337 HZ2 LYS 39 1HZ LYS 39 -19.370 -5.510 6.997 338 HZ3 LYS 39 2HZ LYS 39 -19.649 -4.053 6.184 339 H LYS 40 H LYS 40 -12.593 -4.725 9.138 340 HA LYS 40 HA LYS 40 -12.559 -4.598 12.033 341 HB2 LYS 40 2HB LYS 40 -11.307 -6.581 10.077 342 HB3 LYS 40 3HB LYS 40 -11.212 -6.746 11.822 343 HG2 LYS 40 2HG LYS 40 -13.738 -6.797 10.157 344 HG3 LYS 40 3HG LYS 40 -12.959 -8.188 10.898 345 HD2 LYS 40 2HD LYS 40 -14.152 -5.857 12.445 346 HD3 LYS 40 3HD LYS 40 -14.990 -7.372 12.120 347 HE2 LYS 40 2HE LYS 40 -13.380 -8.614 13.440 348 HE3 LYS 40 3HE LYS 40 -12.385 -7.168 13.660 349 HZ1 LYS 40 3HZ LYS 40 -14.211 -6.145 14.872 350 HZ2 LYS 40 1HZ LYS 40 -13.759 -7.604 15.598 351 HZ3 LYS 40 2HZ LYS 40 -15.162 -7.523 14.660 352 H GLU 41 H GLU 41 -10.063 -4.494 9.449 353 HA GLU 41 HA GLU 41 -7.890 -4.385 11.301 354 HB2 GLU 41 2HB GLU 41 -7.922 -3.900 8.294 355 HB3 GLU 41 3HB GLU 41 -6.461 -4.064 9.267 356 HG2 GLU 41 2HG GLU 41 -8.569 -6.189 8.797 357 HG3 GLU 41 3HG GLU 41 -6.944 -6.158 8.125 358 H MET 42 H MET 42 -9.596 -1.922 9.424 359 HA MET 42 HA MET 42 -7.802 0.214 9.996 360 HB2 MET 42 2HB MET 42 -10.717 0.236 9.152 361 HB3 MET 42 3HB MET 42 -9.726 1.690 9.273 362 HG2 MET 42 2HG MET 42 -9.315 -0.654 7.403 363 HG3 MET 42 3HG MET 42 -9.767 0.994 6.967 364 HE1 MET 42 3HE MET 42 -6.406 2.898 7.915 365 HE2 MET 42 1HE MET 42 -7.830 2.649 8.921 366 HE3 MET 42 2HE MET 42 -8.015 3.103 7.225 367 H LYS 43 H LYS 43 -10.515 -1.168 11.733 368 HA LYS 43 HA LYS 43 -10.621 0.863 13.764 369 HB2 LYS 43 2HB LYS 43 -11.732 -1.971 13.696 370 HB3 LYS 43 3HB LYS 43 -11.928 -0.905 15.084 371 HG2 LYS 43 2HG LYS 43 -12.970 -0.387 12.281 372 HG3 LYS 43 3HG LYS 43 -13.931 -0.874 13.681 373 HD2 LYS 43 2HD LYS 43 -13.415 1.249 14.815 374 HD3 LYS 43 3HD LYS 43 -12.358 1.733 13.485 375 HE2 LYS 43 2HE LYS 43 -14.517 2.872 13.324 376 HE3 LYS 43 3HE LYS 43 -14.311 1.773 11.960 377 HZ1 LYS 43 3HZ LYS 43 -16.509 1.565 12.787 378 HZ2 LYS 43 1HZ LYS 43 -15.973 1.345 14.375 379 HZ3 LYS 43 2HZ LYS 43 -15.680 0.158 13.213 380 H LYS 44 H LYS 44 -8.751 -2.136 13.320 381 HA LYS 44 HA LYS 44 -7.736 -2.328 15.974 382 HB2 LYS 44 2HB LYS 44 -6.187 -3.189 13.489 383 HB3 LYS 44 3HB LYS 44 -6.019 -3.805 15.128 384 HG2 LYS 44 2HG LYS 44 -8.310 -4.264 13.222 385 HG3 LYS 44 3HG LYS 44 -7.144 -5.447 13.789 386 HD2 LYS 44 2HD LYS 44 -9.226 -4.087 15.546 387 HD3 LYS 44 3HD LYS 44 -9.409 -5.680 14.819 388 HE2 LYS 44 2HE LYS 44 -8.737 -6.152 17.019 389 HE3 LYS 44 3HE LYS 44 -7.244 -6.300 16.098 390 HZ1 LYS 44 3HZ LYS 44 -6.563 -4.151 16.839 391 HZ2 LYS 44 1HZ LYS 44 -7.006 -5.062 18.188 392 HZ3 LYS 44 2HZ LYS 44 -8.051 -3.869 17.597 393 H LEU 45 H LEU 45 -6.649 -0.619 13.109 394 HA LEU 45 HA LEU 45 -4.255 0.536 14.114 395 HB2 LEU 45 2HB LEU 45 -6.127 1.482 11.898 396 HB3 LEU 45 3HB LEU 45 -4.494 2.079 12.153 397 HG LEU 45 HG LEU 45 -5.143 -0.821 11.475 398 HD11 LEU 45 1HD1 LEU 45 -4.360 -0.349 9.197 399 HD12 LEU 45 2HD1 LEU 45 -4.213 1.363 9.593 400 HD13 LEU 45 3HD1 LEU 45 -5.798 0.590 9.599 401 HD21 LEU 45 3HD2 LEU 45 -2.738 -1.017 10.989 402 HD22 LEU 45 1HD2 LEU 45 -3.026 -0.568 12.670 403 HD23 LEU 45 2HD2 LEU 45 -2.489 0.650 11.512 404 H ALA 46 H ALA 46 -7.619 1.675 13.882 405 HA ALA 46 HA ALA 46 -7.311 4.249 14.976 406 HB1 ALA 46 3HB ALA 46 -9.272 3.552 13.667 407 HB2 ALA 46 1HB ALA 46 -9.758 4.228 15.223 408 HB3 ALA 46 2HB ALA 46 -9.777 2.478 14.973 409 H GLU 47 H GLU 47 -7.745 1.133 16.527 410 HA GLU 47 HA GLU 47 -8.378 2.030 19.165 411 HB2 GLU 47 2HB GLU 47 -7.411 -0.609 18.014 412 HB3 GLU 47 3HB GLU 47 -7.586 -0.402 19.753 413 HG2 GLU 47 2HG GLU 47 -9.980 0.030 19.511 414 HG3 GLU 47 3HG GLU 47 -9.839 -0.029 17.754 415 H GLU 48 H GLU 48 -5.488 2.174 17.417 416 HA GLU 48 HA GLU 48 -3.435 2.946 17.889 417 HB2 GLU 48 2HB GLU 48 -4.410 4.292 19.769 418 HB3 GLU 48 3HB GLU 48 -4.140 2.936 20.853 419 HG2 GLU 48 2HG GLU 48 -1.644 3.132 20.199 420 HG3 GLU 48 3HG GLU 48 -2.069 4.698 19.511 421 H LYS 49 H LYS 49 -4.594 0.269 19.873 422 HA LYS 49 HA LYS 49 -2.098 -0.572 20.896 423 HB2 LYS 49 2HB LYS 49 -3.400 -2.603 21.658 424 HB3 LYS 49 3HB LYS 49 -4.080 -1.057 22.147 425 HG2 LYS 49 2HG LYS 49 -5.822 -1.197 20.481 426 HG3 LYS 49 3HG LYS 49 -5.084 -2.620 19.747 427 HD2 LYS 49 2HD LYS 49 -6.262 -2.500 22.550 428 HD3 LYS 49 3HD LYS 49 -7.071 -3.180 21.139 429 HE2 LYS 49 2HE LYS 49 -5.293 -4.896 20.949 430 HE3 LYS 49 3HE LYS 49 -4.480 -4.212 22.358 431 HZ1 LYS 49 3HZ LYS 49 -5.760 -6.100 23.032 432 HZ2 LYS 49 1HZ LYS 49 -7.161 -5.493 22.305 433 HZ3 LYS 49 2HZ LYS 49 -6.508 -4.721 23.655 434 H ASN 50 H ASN 50 -0.967 -0.573 18.814 435 HA ASN 50 HA ASN 50 0.111 -2.911 18.073 436 HB2 ASN 50 2HB ASN 50 -0.647 -3.350 15.718 437 HB3 ASN 50 3HB ASN 50 -1.880 -3.724 16.905 438 HD21 ASN 50 1HD2 ASN 50 -2.124 -3.157 14.025 439 HD22 ASN 50 2HD2 ASN 50 -3.257 -1.861 13.906 440 H PHE 51 H PHE 51 1.586 -1.224 18.618 441 HA PHE 51 HA PHE 51 2.027 1.180 17.224 442 HB2 PHE 51 2HB PHE 51 3.027 0.772 19.414 443 HB3 PHE 51 3HB PHE 51 3.958 -0.588 18.797 444 HD1 PHE 51 HD2 PHE 51 3.594 3.136 18.555 445 HD2 PHE 51 HD1 PHE 51 6.154 -0.228 17.862 446 HE1 PHE 51 HE2 PHE 51 5.466 4.650 18.046 447 HE2 PHE 51 HE1 PHE 51 8.015 1.299 17.348 448 HZ PHE 51 HZ PHE 51 7.671 3.737 17.443 449 H GLU 52 H GLU 52 2.940 -2.070 16.518 450 HA GLU 52 HA GLU 52 5.090 -2.095 14.882 451 HB2 GLU 52 2HB GLU 52 2.501 -3.623 14.375 452 HB3 GLU 52 3HB GLU 52 4.099 -4.086 13.788 453 HG2 GLU 52 2HG GLU 52 4.872 -4.499 16.054 454 HG3 GLU 52 3HG GLU 52 3.366 -3.879 16.725 455 H LYS 53 H LYS 53 5.608 -1.662 12.791 456 HA LYS 53 HA LYS 53 4.102 0.287 11.310 457 HB2 LYS 53 2HB LYS 53 6.476 -1.320 10.275 458 HB3 LYS 53 3HB LYS 53 5.943 0.259 9.729 459 HG2 LYS 53 2HG LYS 53 7.233 -0.353 12.411 460 HG3 LYS 53 3HG LYS 53 8.041 0.352 11.020 461 HD2 LYS 53 2HD LYS 53 7.645 2.277 12.235 462 HD3 LYS 53 3HD LYS 53 6.151 2.242 11.305 463 HE2 LYS 53 2HE LYS 53 4.942 1.324 13.208 464 HE3 LYS 53 3HE LYS 53 6.439 1.118 14.115 465 HZ1 LYS 53 3HZ LYS 53 6.673 3.432 14.362 466 HZ2 LYS 53 1HZ LYS 53 5.051 3.112 14.716 467 HZ3 LYS 53 2HZ LYS 53 5.486 3.780 13.220 468 H ILE 54 H ILE 54 2.343 -0.250 10.041 469 HA ILE 54 HA ILE 54 1.917 -3.122 9.492 470 HB ILE 54 HB ILE 54 -0.120 -0.869 9.816 471 HG12 ILE 54 2HG1 ILE 54 0.873 -1.605 11.977 472 HG13 ILE 54 3HG1 ILE 54 -0.830 -2.026 11.881 473 HG21 ILE 54 1HG2 ILE 54 -0.649 -3.813 9.271 474 HG22 ILE 54 2HG2 ILE 54 -0.941 -2.479 8.154 475 HG23 ILE 54 3HG2 ILE 54 -1.878 -2.601 9.643 476 HD11 ILE 54 3HD1 ILE 54 -0.208 -4.361 11.379 477 HD12 ILE 54 1HD1 ILE 54 0.448 -3.798 12.917 478 HD13 ILE 54 2HD1 ILE 54 1.498 -3.918 11.507 479 H LEU 55 H LEU 55 1.765 -3.781 7.491 480 HA LEU 55 HA LEU 55 1.534 -1.888 5.222 481 HB2 LEU 55 2HB LEU 55 3.637 -3.280 5.483 482 HB3 LEU 55 3HB LEU 55 2.678 -4.730 5.261 483 HG LEU 55 HG LEU 55 2.764 -2.568 3.114 484 HD11 LEU 55 1HD1 LEU 55 5.087 -3.130 3.600 485 HD12 LEU 55 2HD1 LEU 55 4.604 -3.740 2.022 486 HD13 LEU 55 3HD1 LEU 55 4.736 -4.849 3.390 487 HD21 LEU 55 3HD2 LEU 55 2.249 -5.554 2.927 488 HD22 LEU 55 1HD2 LEU 55 2.286 -4.421 1.572 489 HD23 LEU 55 2HD2 LEU 55 1.038 -4.274 2.805 490 H ILE 56 H ILE 56 -0.339 -2.057 4.034 491 HA ILE 56 HA ILE 56 -2.144 -4.371 4.525 492 HB ILE 56 HB ILE 56 -2.921 -1.600 3.477 493 HG12 ILE 56 2HG1 ILE 56 -2.230 -1.526 5.916 494 HG13 ILE 56 3HG1 ILE 56 -3.900 -1.060 5.633 495 HG21 ILE 56 1HG2 ILE 56 -4.657 -3.964 4.299 496 HG22 ILE 56 2HG2 ILE 56 -4.422 -3.345 2.662 497 HG23 ILE 56 3HG2 ILE 56 -5.260 -2.365 3.862 498 HD11 ILE 56 3HD1 ILE 56 -4.650 -3.244 6.434 499 HD12 ILE 56 1HD1 ILE 56 -3.661 -2.411 7.633 500 HD13 ILE 56 2HD1 ILE 56 -2.971 -3.730 6.690 501 H ILE 57 H ILE 57 -1.898 -5.798 2.854 502 HA ILE 57 HA ILE 57 -1.679 -4.850 0.072 503 HB ILE 57 HB ILE 57 -1.691 -7.696 1.194 504 HG12 ILE 57 2HG1 ILE 57 0.524 -6.036 -0.105 505 HG13 ILE 57 3HG1 ILE 57 0.406 -6.434 1.603 506 HG21 ILE 57 1HG2 ILE 57 -1.206 -8.478 -1.123 507 HG22 ILE 57 2HG2 ILE 57 -1.431 -6.834 -1.719 508 HG23 ILE 57 3HG2 ILE 57 -2.793 -7.708 -1.019 509 HD11 ILE 57 3HD1 ILE 57 2.064 -7.791 0.538 510 HD12 ILE 57 1HD1 ILE 57 0.896 -8.371 -0.650 511 HD13 ILE 57 2HD1 ILE 57 0.717 -8.802 1.055 512 H SER 58 H SER 58 -3.512 -4.223 -0.867 513 HA SER 58 HA SER 58 -5.988 -5.814 -0.525 514 HB2 SER 58 2HB SER 58 -6.231 -3.604 0.637 515 HB3 SER 58 3HB SER 58 -5.853 -2.781 -0.874 516 HG SER 58 HG SER 58 -7.912 -2.914 -1.261 517 H ASN 59 H ASN 59 -6.431 -6.773 -2.389 518 HA ASN 59 HA ASN 59 -5.303 -5.814 -4.930 519 HB2 ASN 59 2HB ASN 59 -6.766 -8.397 -4.224 520 HB3 ASN 59 3HB ASN 59 -6.130 -8.018 -5.824 521 HD21 ASN 59 1HD2 ASN 59 -3.876 -8.031 -6.149 522 HD22 ASN 59 2HD2 ASN 59 -2.793 -8.760 -5.016 523 H ASP 60 H ASP 60 -7.994 -5.142 -3.199 524 HA ASP 60 HA ASP 60 -9.631 -4.582 -5.602 525 HB2 ASP 60 2HB ASP 60 -10.749 -5.965 -3.820 526 HB3 ASP 60 3HB ASP 60 -10.522 -4.647 -2.674 527 H LYS 61 H LYS 61 -9.637 -2.514 -6.240 528 HA LYS 61 HA LYS 61 -8.015 -0.599 -4.812 529 HB2 LYS 61 2HB LYS 61 -8.152 0.774 -6.809 530 HB3 LYS 61 3HB LYS 61 -7.789 -0.888 -7.242 531 HG2 LYS 61 2HG LYS 61 -10.166 -1.217 -7.909 532 HG3 LYS 61 3HG LYS 61 -10.484 0.478 -7.524 533 HD2 LYS 61 2HD LYS 61 -10.144 0.229 -9.938 534 HD3 LYS 61 3HD LYS 61 -8.825 1.175 -9.245 535 HE2 LYS 61 2HE LYS 61 -7.414 -0.899 -9.232 536 HE3 LYS 61 3HE LYS 61 -8.728 -1.762 -10.032 537 HZ1 LYS 61 3HZ LYS 61 -7.047 -0.990 -11.595 538 HZ2 LYS 61 1HZ LYS 61 -7.311 0.608 -11.132 539 HZ3 LYS 61 2HZ LYS 61 -8.536 -0.258 -11.911 540 H GLN 62 H GLN 62 -11.440 -1.175 -5.121 541 HA GLN 62 HA GLN 62 -12.358 1.454 -4.434 542 HB2 GLN 62 2HB GLN 62 -13.917 -0.143 -5.449 543 HB3 GLN 62 3HB GLN 62 -13.717 -1.256 -4.105 544 HG2 GLN 62 2HG GLN 62 -15.846 -0.188 -3.853 545 HG3 GLN 62 3HG GLN 62 -14.792 0.455 -2.600 546 HE21 GLN 62 1HE2 GLN 62 -17.249 1.591 -3.679 547 HE22 GLN 62 2HE2 GLN 62 -16.838 3.153 -4.292 548 H LEU 63 H LEU 63 -11.726 -1.519 -2.552 549 HA LEU 63 HA LEU 63 -12.205 -0.579 0.038 550 HB2 LEU 63 2HB LEU 63 -10.208 -2.659 -0.951 551 HB3 LEU 63 3HB LEU 63 -10.556 -2.384 0.748 552 HG LEU 63 HG LEU 63 -12.499 -3.452 -1.338 553 HD11 LEU 63 1HD1 LEU 63 -11.228 -4.808 1.070 554 HD12 LEU 63 2HD1 LEU 63 -10.831 -5.101 -0.625 555 HD13 LEU 63 3HD1 LEU 63 -12.426 -5.529 -0.011 556 HD21 LEU 63 3HD2 LEU 63 -13.708 -2.020 0.241 557 HD22 LEU 63 1HD2 LEU 63 -13.004 -2.893 1.607 558 HD23 LEU 63 2HD2 LEU 63 -14.113 -3.713 0.503 559 H LEU 64 H LEU 64 -9.276 -0.525 -1.956 560 HA LEU 64 HA LEU 64 -7.450 0.615 -0.210 561 HB2 LEU 64 2HB LEU 64 -6.762 -0.300 -2.305 562 HB3 LEU 64 3HB LEU 64 -7.778 0.788 -3.220 563 HG LEU 64 HG LEU 64 -5.461 1.946 -1.628 564 HD11 LEU 64 1HD1 LEU 64 -4.458 0.096 -2.872 565 HD12 LEU 64 2HD1 LEU 64 -3.963 1.645 -3.548 566 HD13 LEU 64 3HD1 LEU 64 -5.192 0.676 -4.369 567 HD21 LEU 64 3HD2 LEU 64 -6.987 3.549 -2.694 568 HD22 LEU 64 1HD2 LEU 64 -6.757 2.769 -4.259 569 HD23 LEU 64 2HD2 LEU 64 -5.411 3.603 -3.476 570 H LYS 65 H LYS 65 -9.766 2.268 -2.373 571 HA LYS 65 HA LYS 65 -9.049 4.938 -1.828 572 HB2 LYS 65 2HB LYS 65 -11.653 3.688 -2.786 573 HB3 LYS 65 3HB LYS 65 -11.400 5.429 -2.723 574 HG2 LYS 65 2HG LYS 65 -9.757 5.377 -4.438 575 HG3 LYS 65 3HG LYS 65 -9.512 3.639 -4.272 576 HD2 LYS 65 2HD LYS 65 -10.704 4.055 -6.337 577 HD3 LYS 65 3HD LYS 65 -11.798 3.252 -5.215 578 HE2 LYS 65 2HE LYS 65 -11.797 6.258 -5.637 579 HE3 LYS 65 3HE LYS 65 -12.776 5.156 -6.604 580 HZ1 LYS 65 3HZ LYS 65 -14.082 6.045 -4.831 581 HZ2 LYS 65 1HZ LYS 65 -12.964 5.554 -3.667 582 HZ3 LYS 65 2HZ LYS 65 -13.838 4.404 -4.536 583 H GLU 66 H GLU 66 -11.673 2.939 -0.420 584 HA GLU 66 HA GLU 66 -12.773 4.787 1.368 585 HB2 GLU 66 2HB GLU 66 -12.530 1.789 1.892 586 HB3 GLU 66 3HB GLU 66 -13.731 2.879 2.567 587 HG2 GLU 66 2HG GLU 66 -13.511 1.881 -0.269 588 HG3 GLU 66 3HG GLU 66 -14.789 1.545 0.890 589 H MET 67 H MET 67 -10.215 2.436 1.766 590 HA MET 67 HA MET 67 -9.658 2.691 4.499 591 HB2 MET 67 2HB MET 67 -9.074 0.731 3.198 592 HB3 MET 67 3HB MET 67 -8.016 1.661 2.154 593 HG2 MET 67 2HG MET 67 -6.314 1.736 3.747 594 HG3 MET 67 3HG MET 67 -7.424 1.469 5.091 595 HE1 MET 67 3HE MET 67 -8.157 -0.855 2.065 596 HE2 MET 67 1HE MET 67 -6.884 -2.069 2.167 597 HE3 MET 67 2HE MET 67 -6.491 -0.425 1.667 598 H LEU 68 H LEU 68 -8.219 4.301 1.649 599 HA LEU 68 HA LEU 68 -6.144 5.642 3.069 600 HB2 LEU 68 2HB LEU 68 -7.433 6.229 0.378 601 HB3 LEU 68 3HB LEU 68 -6.072 7.148 1.007 602 HG LEU 68 HG LEU 68 -6.052 4.175 0.335 603 HD11 LEU 68 1HD1 LEU 68 -6.052 5.621 -1.644 604 HD12 LEU 68 2HD1 LEU 68 -4.512 4.788 -1.459 605 HD13 LEU 68 3HD1 LEU 68 -4.650 6.495 -1.023 606 HD21 LEU 68 3HD2 LEU 68 -3.795 5.904 1.406 607 HD22 LEU 68 1HD2 LEU 68 -3.635 4.242 0.831 608 HD23 LEU 68 2HD2 LEU 68 -4.604 4.588 2.260 609 H GLU 69 H GLU 69 -9.473 6.588 2.213 610 HA GLU 69 HA GLU 69 -9.426 9.230 3.257 611 HB2 GLU 69 2HB GLU 69 -11.752 7.270 3.070 612 HB3 GLU 69 3HB GLU 69 -11.916 8.995 3.403 613 HG2 GLU 69 2HG GLU 69 -10.981 9.543 1.209 614 HG3 GLU 69 3HG GLU 69 -10.727 7.831 0.865 615 H LEU 70 H LEU 70 -10.010 6.082 4.785 616 HA LEU 70 HA LEU 70 -10.665 7.001 7.386 617 HB2 LEU 70 2HB LEU 70 -9.462 4.367 6.445 618 HB3 LEU 70 3HB LEU 70 -10.020 4.651 8.087 619 HG LEU 70 HG LEU 70 -11.831 4.818 5.641 620 HD11 LEU 70 1HD1 LEU 70 -11.537 2.520 7.600 621 HD12 LEU 70 2HD1 LEU 70 -11.014 2.522 5.914 622 HD13 LEU 70 3HD1 LEU 70 -12.729 2.636 6.302 623 HD21 LEU 70 3HD2 LEU 70 -12.486 4.773 8.607 624 HD22 LEU 70 1HD2 LEU 70 -13.662 4.763 7.289 625 HD23 LEU 70 2HD2 LEU 70 -12.621 6.163 7.525 626 H ILE 71 H ILE 71 -7.543 6.040 5.906 627 HA ILE 71 HA ILE 71 -5.916 6.242 8.230 628 HB ILE 71 HB ILE 71 -5.035 6.538 5.307 629 HG12 ILE 71 2HG1 ILE 71 -4.961 4.016 7.031 630 HG13 ILE 71 3HG1 ILE 71 -6.178 4.340 5.814 631 HG21 ILE 71 1HG2 ILE 71 -2.778 5.883 6.130 632 HG22 ILE 71 2HG2 ILE 71 -3.382 5.909 7.786 633 HG23 ILE 71 3HG2 ILE 71 -3.329 7.400 6.845 634 HD11 ILE 71 3HD1 ILE 71 -4.500 2.819 4.977 635 HD12 ILE 71 1HD1 ILE 71 -3.229 3.999 5.300 636 HD13 ILE 71 2HD1 ILE 71 -4.459 4.333 4.077 637 H SER 72 H SER 72 -6.913 8.552 5.768 638 HA SER 72 HA SER 72 -5.215 10.717 6.393 639 HB2 SER 72 2HB SER 72 -6.499 10.601 4.294 640 HB3 SER 72 3HB SER 72 -8.018 10.694 5.183 641 HG SER 72 HG SER 72 -7.631 12.734 4.542 642 H LYS 73 H LYS 73 -8.423 9.741 7.606 643 HA LYS 73 HA LYS 73 -8.758 12.001 9.359 644 HB2 LYS 73 2HB LYS 73 -10.251 9.346 9.186 645 HB3 LYS 73 3HB LYS 73 -10.751 10.710 10.186 646 HG2 LYS 73 2HG LYS 73 -11.121 12.092 8.204 647 HG3 LYS 73 3HG LYS 73 -10.495 10.813 7.159 648 HD2 LYS 73 2HD LYS 73 -12.402 9.347 7.871 649 HD3 LYS 73 3HD LYS 73 -13.039 10.687 8.833 650 HE2 LYS 73 2HE LYS 73 -13.304 12.038 6.791 651 HE3 LYS 73 3HE LYS 73 -12.629 10.726 5.823 652 HZ1 LYS 73 3HZ LYS 73 -14.999 10.708 5.672 653 HZ2 LYS 73 1HZ LYS 73 -15.168 10.659 7.354 654 HZ3 LYS 73 2HZ LYS 73 -14.507 9.341 6.531 655 H LEU 74 H LEU 74 -7.338 8.820 9.615 656 HA LEU 74 HA LEU 74 -7.059 8.806 12.493 657 HB2 LEU 74 2HB LEU 74 -5.729 7.115 10.338 658 HB3 LEU 74 3HB LEU 74 -5.538 6.844 12.062 659 HG LEU 74 HG LEU 74 -8.139 6.571 10.502 660 HD11 LEU 74 1HD1 LEU 74 -7.951 4.164 10.963 661 HD12 LEU 74 2HD1 LEU 74 -6.393 4.424 11.754 662 HD13 LEU 74 3HD1 LEU 74 -6.573 4.747 10.028 663 HD21 LEU 74 3HD2 LEU 74 -7.618 6.070 13.449 664 HD22 LEU 74 1HD2 LEU 74 -9.117 5.701 12.588 665 HD23 LEU 74 2HD2 LEU 74 -8.594 7.374 12.765 666 H GLY 75 H GLY 75 -5.221 9.983 9.768 667 HA2 GLY 75 2HA GLY 75 -3.504 11.496 9.662 668 HA3 GLY 75 3HA GLY 75 -3.480 11.564 11.413 669 H TYR 76 H TYR 76 -2.998 8.668 9.382 670 HA TYR 76 HA TYR 76 -0.232 8.402 10.412 671 HB2 TYR 76 2HB TYR 76 -1.914 6.377 8.876 672 HB3 TYR 76 3HB TYR 76 -0.313 6.076 9.543 673 HD1 TYR 76 HD1 TYR 76 -0.390 7.074 12.244 674 HD2 TYR 76 HD2 TYR 76 -3.497 5.100 10.080 675 HE1 TYR 76 HE1 TYR 76 -1.364 6.291 14.350 676 HE2 TYR 76 HE2 TYR 76 -4.470 4.323 12.199 677 HH TYR 76 HH TYR 76 -3.569 5.560 15.200 678 H LYS 77 H LYS 77 1.543 8.094 9.009 679 HA LYS 77 HA LYS 77 1.529 9.433 6.482 680 HB2 LYS 77 2HB LYS 77 3.636 7.687 7.831 681 HB3 LYS 77 3HB LYS 77 3.915 8.515 6.309 682 HG2 LYS 77 2HG LYS 77 3.043 10.193 8.646 683 HG3 LYS 77 3HG LYS 77 4.678 9.539 8.672 684 HD2 LYS 77 2HD LYS 77 4.717 11.792 7.746 685 HD3 LYS 77 3HD LYS 77 5.145 10.632 6.489 686 HE2 LYS 77 2HE LYS 77 3.656 12.427 5.651 687 HE3 LYS 77 3HE LYS 77 2.921 10.833 5.501 688 HZ1 LYS 77 3HZ LYS 77 1.643 11.299 7.523 689 HZ2 LYS 77 1HZ LYS 77 1.332 12.442 6.316 690 HZ3 LYS 77 2HZ LYS 77 2.330 12.837 7.617 691 H VAL 78 H VAL 78 1.376 8.605 4.433 692 HA VAL 78 HA VAL 78 0.890 5.686 4.133 693 HB VAL 78 HB VAL 78 -0.391 7.928 2.486 694 HG11 VAL 78 1HG1 VAL 78 -0.875 4.918 2.379 695 HG12 VAL 78 2HG1 VAL 78 -0.021 5.866 1.159 696 HG13 VAL 78 3HG1 VAL 78 -1.740 6.140 1.441 697 HG21 VAL 78 3HG2 VAL 78 -1.645 6.110 4.572 698 HG22 VAL 78 1HG2 VAL 78 -2.512 7.274 3.564 699 HG23 VAL 78 2HG2 VAL 78 -1.334 7.839 4.752 700 H PHE 79 H PHE 79 2.451 4.750 3.021 701 HA PHE 79 HA PHE 79 3.591 6.085 0.634 702 HB2 PHE 79 2HB PHE 79 4.676 3.807 2.358 703 HB3 PHE 79 3HB PHE 79 5.381 4.304 0.828 704 HD1 PHE 79 HD2 PHE 79 4.678 5.482 4.309 705 HD2 PHE 79 HD1 PHE 79 6.940 6.127 0.734 706 HE1 PHE 79 HE2 PHE 79 6.079 7.131 5.483 707 HE2 PHE 79 HE1 PHE 79 8.334 7.774 1.920 708 HZ PHE 79 HZ PHE 79 7.898 8.281 4.292 709 H LEU 80 H LEU 80 2.662 5.336 -1.174 710 HA LEU 80 HA LEU 80 1.008 2.887 -1.064 711 HB2 LEU 80 2HB LEU 80 -0.419 4.853 -1.089 712 HB3 LEU 80 3HB LEU 80 0.462 5.544 -2.444 713 HG LEU 80 HG LEU 80 -0.376 3.670 -3.906 714 HD11 LEU 80 1HD1 LEU 80 -0.774 1.946 -2.225 715 HD12 LEU 80 2HD1 LEU 80 -2.224 2.244 -3.178 716 HD13 LEU 80 3HD1 LEU 80 -2.100 2.891 -1.540 717 HD21 LEU 80 3HD2 LEU 80 -2.654 4.500 -4.163 718 HD22 LEU 80 1HD2 LEU 80 -1.525 5.827 -3.888 719 HD23 LEU 80 2HD2 LEU 80 -2.573 5.277 -2.578 720 H LEU 81 H LEU 81 1.494 1.373 -2.482 721 HA LEU 81 HA LEU 81 3.020 2.011 -4.935 722 HB2 LEU 81 2HB LEU 81 4.056 0.392 -3.255 723 HB3 LEU 81 3HB LEU 81 2.721 -0.704 -3.573 724 HG LEU 81 HG LEU 81 3.414 -0.761 -6.003 725 HD11 LEU 81 1HD1 LEU 81 5.787 0.843 -5.017 726 HD12 LEU 81 2HD1 LEU 81 4.550 1.364 -6.163 727 HD13 LEU 81 3HD1 LEU 81 5.664 0.075 -6.602 728 HD21 LEU 81 3HD2 LEU 81 5.593 -1.649 -4.089 729 HD22 LEU 81 1HD2 LEU 81 5.313 -2.257 -5.723 730 HD23 LEU 81 2HD2 LEU 81 4.123 -2.555 -4.458 731 H LEU 82 H LEU 82 1.676 2.124 -6.663 732 HA LEU 82 HA LEU 82 -0.590 0.225 -6.908 733 HB2 LEU 82 2HB LEU 82 0.016 2.805 -8.422 734 HB3 LEU 82 3HB LEU 82 -1.373 1.770 -8.718 735 HG LEU 82 HG LEU 82 -0.852 3.296 -6.134 736 HD11 LEU 82 1HD1 LEU 82 -1.406 4.813 -7.977 737 HD12 LEU 82 2HD1 LEU 82 -2.715 4.743 -6.801 738 HD13 LEU 82 3HD1 LEU 82 -2.862 3.878 -8.334 739 HD21 LEU 82 3HD2 LEU 82 -3.267 1.646 -6.959 740 HD22 LEU 82 1HD2 LEU 82 -3.132 2.620 -5.492 741 HD23 LEU 82 2HD2 LEU 82 -2.087 1.221 -5.716 742 H GLN 83 H GLN 83 -0.024 -1.578 -8.026 743 HA GLN 83 HA GLN 83 2.003 -1.394 -10.171 744 HB2 GLN 83 2HB GLN 83 2.436 -3.007 -8.248 745 HB3 GLN 83 3HB GLN 83 1.057 -3.948 -8.804 746 HG2 GLN 83 2HG GLN 83 2.162 -4.328 -10.970 747 HG3 GLN 83 3HG GLN 83 3.537 -3.347 -10.462 748 HE21 GLN 83 1HE2 GLN 83 3.579 -6.073 -11.359 749 HE22 GLN 83 2HE2 GLN 83 4.228 -7.011 -10.066 750 H ASP 84 H ASP 84 1.072 -1.108 -12.071 751 HA ASP 84 HA ASP 84 -0.916 -3.009 -13.043 752 HB2 ASP 84 2HB ASP 84 -2.136 -0.948 -12.061 753 HB3 ASP 84 3HB ASP 84 -1.401 -0.008 -13.357 754 H GLN 85 H GLN 85 -0.388 -3.557 -15.120 755 HA GLN 85 HA GLN 85 2.066 -2.461 -16.216 756 HB2 GLN 85 2HB GLN 85 0.340 -4.794 -17.130 757 HB3 GLN 85 3HB GLN 85 1.916 -4.374 -17.802 758 HG2 GLN 85 2HG GLN 85 2.937 -4.751 -15.557 759 HG3 GLN 85 3HG GLN 85 1.365 -5.263 -14.953 760 HE21 GLN 85 1HE2 GLN 85 4.044 -6.107 -17.026 761 HE22 GLN 85 2HE2 GLN 85 3.644 -7.779 -17.178 762 H ASP 86 H ASP 86 -1.201 -1.748 -16.630 763 HA ASP 86 HA ASP 86 -0.802 -0.610 -19.335 764 HB2 ASP 86 2HB ASP 86 -2.917 -1.970 -18.831 765 HB3 ASP 86 3HB ASP 86 -3.404 -0.696 -17.721 766 H GLU 87 H GLU 87 0.270 1.230 -19.073 767 HA GLU 87 HA GLU 87 0.348 2.706 -16.640 768 HB2 GLU 87 2HB GLU 87 1.501 3.409 -19.369 769 HB3 GLU 87 3HB GLU 87 1.939 4.164 -17.837 770 HG2 GLU 87 2HG GLU 87 2.871 2.078 -17.001 771 HG3 GLU 87 3HG GLU 87 2.325 1.211 -18.434 772 H ASN 88 H ASN 88 -1.819 2.904 -19.300 773 HA ASN 88 HA ASN 88 -2.537 5.702 -18.986 774 HB2 ASN 88 2HB ASN 88 -3.862 3.384 -20.464 775 HB3 ASN 88 3HB ASN 88 -4.622 4.968 -20.352 776 HD21 ASN 88 1HD2 ASN 88 -4.563 5.238 -22.577 777 HD22 ASN 88 2HD2 ASN 88 -3.101 5.566 -23.440 778 H GLU 89 H GLU 89 -3.847 2.545 -17.975 779 HA GLU 89 HA GLU 89 -6.051 3.564 -16.455 780 HB2 GLU 89 2HB GLU 89 -4.601 0.882 -16.339 781 HB3 GLU 89 3HB GLU 89 -6.085 1.233 -15.459 782 HG2 GLU 89 2HG GLU 89 -5.795 1.273 -18.473 783 HG3 GLU 89 3HG GLU 89 -6.456 -0.064 -17.540 784 H LEU 90 H LEU 90 -2.752 2.624 -15.735 785 HA LEU 90 HA LEU 90 -2.759 2.814 -12.934 786 HB2 LEU 90 2HB LEU 90 -1.025 1.614 -14.192 787 HB3 LEU 90 3HB LEU 90 -0.505 3.102 -14.964 788 HG LEU 90 HG LEU 90 0.372 3.956 -12.823 789 HD11 LEU 90 1HD1 LEU 90 -1.215 2.984 -11.262 790 HD12 LEU 90 2HD1 LEU 90 0.432 2.569 -10.795 791 HD13 LEU 90 3HD1 LEU 90 -0.589 1.362 -11.582 792 HD21 LEU 90 3HD2 LEU 90 1.886 2.620 -14.217 793 HD22 LEU 90 1HD2 LEU 90 1.369 1.143 -13.397 794 HD23 LEU 90 2HD2 LEU 90 2.244 2.392 -12.507 795 H GLU 91 H GLU 91 -1.982 5.201 -15.498 796 HA GLU 91 HA GLU 91 -0.861 7.182 -13.848 797 HB2 GLU 91 2HB GLU 91 -0.722 7.045 -16.397 798 HB3 GLU 91 3HB GLU 91 -2.350 7.707 -16.454 799 HG2 GLU 91 2HG GLU 91 -0.917 9.550 -16.816 800 HG3 GLU 91 3HG GLU 91 -1.442 9.708 -15.143 801 H GLU 92 H GLU 92 -4.183 6.824 -15.112 802 HA GLU 92 HA GLU 92 -5.287 9.195 -14.128 803 HB2 GLU 92 2HB GLU 92 -6.682 6.529 -14.616 804 HB3 GLU 92 3HB GLU 92 -7.494 8.083 -14.453 805 HG2 GLU 92 2HG GLU 92 -5.540 7.329 -16.641 806 HG3 GLU 92 3HG GLU 92 -7.291 7.391 -16.803 807 H PHE 93 H PHE 93 -5.085 5.992 -12.613 808 HA PHE 93 HA PHE 93 -6.608 6.701 -10.279 809 HB2 PHE 93 2HB PHE 93 -6.422 4.368 -11.284 810 HB3 PHE 93 3HB PHE 93 -4.792 4.276 -10.625 811 HD1 PHE 93 HD1 PHE 93 -8.194 5.321 -9.361 812 HD2 PHE 93 HD2 PHE 93 -4.679 2.983 -8.652 813 HE1 PHE 93 HE1 PHE 93 -9.168 4.485 -7.265 814 HE2 PHE 93 HE2 PHE 93 -5.664 2.156 -6.558 815 HZ PHE 93 HZ PHE 93 -7.907 2.901 -5.865 816 H LYS 94 H LYS 94 -3.208 6.627 -11.134 817 HA LYS 94 HA LYS 94 -2.075 6.845 -8.539 818 HB2 LYS 94 2HB LYS 94 -0.907 6.081 -10.673 819 HB3 LYS 94 3HB LYS 94 -0.852 7.754 -11.192 820 HG2 LYS 94 2HG LYS 94 0.428 6.835 -8.600 821 HG3 LYS 94 3HG LYS 94 1.271 6.714 -10.134 822 HD2 LYS 94 2HD LYS 94 0.305 9.273 -8.805 823 HD3 LYS 94 3HD LYS 94 1.975 8.718 -8.926 824 HE2 LYS 94 2HE LYS 94 1.839 8.902 -11.402 825 HE3 LYS 94 3HE LYS 94 0.188 9.513 -11.250 826 HZ1 LYS 94 3HZ LYS 94 1.049 11.394 -9.996 827 HZ2 LYS 94 1HZ LYS 94 1.772 11.298 -11.524 828 HZ3 LYS 94 2HZ LYS 94 2.626 10.802 -10.151 829 H ARG 95 H ARG 95 -2.819 9.262 -11.085 830 HA ARG 95 HA ARG 95 -2.008 11.500 -9.494 831 HB2 ARG 95 2HB ARG 95 -2.756 12.924 -11.292 832 HB3 ARG 95 3HB ARG 95 -1.861 11.567 -11.953 833 HG2 ARG 95 2HG ARG 95 -3.965 10.516 -12.687 834 HG3 ARG 95 3HG ARG 95 -4.889 11.852 -11.990 835 HD2 ARG 95 2HD ARG 95 -3.775 13.434 -13.526 836 HD3 ARG 95 3HD ARG 95 -2.823 12.117 -14.208 837 HE ARG 95 HE ARG 95 -5.073 11.168 -14.931 838 HH11 ARG 95 1HH1 ARG 95 -4.518 14.638 -14.629 839 HH12 ARG 95 2HH1 ARG 95 -5.700 15.050 -15.831 840 HH21 ARG 95 1HH2 ARG 95 -6.563 11.722 -16.554 841 HH22 ARG 95 2HH2 ARG 95 -6.861 13.396 -16.925 842 H LYS 96 H LYS 96 -4.971 9.759 -9.898 843 HA LYS 96 HA LYS 96 -6.888 11.500 -8.833 844 HB2 LYS 96 2HB LYS 96 -7.366 9.290 -9.880 845 HB3 LYS 96 3HB LYS 96 -6.636 8.473 -8.503 846 HG2 LYS 96 2HG LYS 96 -8.428 9.399 -7.046 847 HG3 LYS 96 3HG LYS 96 -9.167 10.145 -8.468 848 HD2 LYS 96 2HD LYS 96 -9.422 7.880 -9.490 849 HD3 LYS 96 3HD LYS 96 -8.744 7.162 -8.025 850 HE2 LYS 96 2HE LYS 96 -11.165 6.982 -7.997 851 HE3 LYS 96 3HE LYS 96 -10.649 8.091 -6.724 852 HZ1 LYS 96 3HZ LYS 96 -12.554 8.945 -7.912 853 HZ2 LYS 96 1HZ LYS 96 -11.727 8.872 -9.384 854 HZ3 LYS 96 2HZ LYS 96 -11.219 9.939 -8.180 855 H ILE 97 H ILE 97 -4.718 9.220 -7.216 856 HA ILE 97 HA ILE 97 -5.566 9.958 -4.522 857 HB ILE 97 HB ILE 97 -3.428 7.974 -5.434 858 HG12 ILE 97 2HG1 ILE 97 -6.322 7.374 -4.638 859 HG13 ILE 97 3HG1 ILE 97 -5.777 7.490 -6.307 860 HG21 ILE 97 1HG2 ILE 97 -3.124 8.622 -3.088 861 HG22 ILE 97 2HG2 ILE 97 -3.730 6.968 -3.172 862 HG23 ILE 97 3HG2 ILE 97 -4.823 8.284 -2.746 863 HD11 ILE 97 3HD1 ILE 97 -5.958 5.196 -5.612 864 HD12 ILE 97 1HD1 ILE 97 -4.836 5.472 -4.278 865 HD13 ILE 97 2HD1 ILE 97 -4.276 5.600 -5.949 866 H GLU 98 H GLU 98 -3.114 10.840 -6.778 867 HA GLU 98 HA GLU 98 -1.042 11.787 -5.135 868 HB2 GLU 98 2HB GLU 98 -1.001 11.546 -7.644 869 HB3 GLU 98 3HB GLU 98 -2.032 12.966 -7.765 870 HG2 GLU 98 2HG GLU 98 0.285 13.538 -8.234 871 HG3 GLU 98 3HG GLU 98 -0.266 14.345 -6.763 872 H SER 99 H SER 99 -4.153 13.147 -6.042 873 HA SER 99 HA SER 99 -3.804 15.808 -5.118 874 HB2 SER 99 2HB SER 99 -5.511 15.175 -6.778 875 HB3 SER 99 3HB SER 99 -6.344 14.179 -5.583 876 HG SER 99 HG SER 99 -5.880 16.926 -5.119 877 H GLN 100 H GLN 100 -4.549 12.811 -3.473 878 HA GLN 100 HA GLN 100 -5.748 13.868 -1.099 879 HB2 GLN 100 2HB GLN 100 -4.277 11.251 -1.619 880 HB3 GLN 100 3HB GLN 100 -5.014 11.636 -0.073 881 HG2 GLN 100 2HG GLN 100 -6.581 11.485 -2.661 882 HG3 GLN 100 3HG GLN 100 -6.346 10.119 -1.577 883 HE21 GLN 100 1HE2 GLN 100 -8.505 9.866 -1.057 884 HE22 GLN 100 2HE2 GLN 100 -9.410 11.018 -0.139 885 H GLY 101 H GLY 101 -2.472 13.808 -2.239 886 HA2 GLY 101 2HA GLY 101 -0.625 14.889 -1.341 887 HA3 GLY 101 3HA GLY 101 -1.490 15.122 0.171 888 H TYR 102 H TYR 102 -0.486 12.345 -1.797 889 HA TYR 102 HA TYR 102 0.766 11.076 0.585 890 HB2 TYR 102 2HB TYR 102 -0.904 9.713 -1.579 891 HB3 TYR 102 3HB TYR 102 0.063 8.838 -0.396 892 HD1 TYR 102 HD1 TYR 102 -0.750 10.812 1.969 893 HD2 TYR 102 HD2 TYR 102 -2.966 8.593 -0.936 894 HE1 TYR 102 HE1 TYR 102 -2.654 10.689 3.509 895 HE2 TYR 102 HE2 TYR 102 -4.875 8.483 0.610 896 HH TYR 102 HH TYR 102 -5.258 8.632 3.083 897 H GLU 103 H GLU 103 2.486 9.600 0.098 898 HA GLU 103 HA GLU 103 4.011 10.020 -2.316 899 HB2 GLU 103 2HB GLU 103 5.274 9.536 -0.308 900 HB3 GLU 103 3HB GLU 103 4.284 8.135 0.078 901 HG2 GLU 103 2HG GLU 103 6.521 7.479 -0.688 902 HG3 GLU 103 3HG GLU 103 5.274 6.882 -1.773 903 H VAL 104 H VAL 104 2.851 9.353 -4.115 904 HA VAL 104 HA VAL 104 1.734 6.602 -4.165 905 HB VAL 104 HB VAL 104 0.881 8.903 -6.000 906 HG11 VAL 104 1HG1 VAL 104 0.451 6.589 -6.804 907 HG12 VAL 104 2HG1 VAL 104 -1.043 7.476 -6.502 908 HG13 VAL 104 3HG1 VAL 104 -0.486 6.265 -5.344 909 HG21 VAL 104 3HG2 VAL 104 0.310 9.539 -3.684 910 HG22 VAL 104 1HG2 VAL 104 -0.527 8.000 -3.459 911 HG23 VAL 104 2HG2 VAL 104 -1.141 9.179 -4.621 912 H ARG 105 H ARG 105 2.942 5.259 -5.407 913 HA ARG 105 HA ARG 105 4.777 6.418 -7.437 914 HB2 ARG 105 2HB ARG 105 5.469 4.923 -5.208 915 HB3 ARG 105 3HB ARG 105 5.359 3.658 -6.415 916 HG2 ARG 105 2HG ARG 105 7.643 4.360 -6.329 917 HG3 ARG 105 3HG ARG 105 6.987 5.004 -7.835 918 HD2 ARG 105 2HD ARG 105 6.826 7.216 -6.911 919 HD3 ARG 105 3HD ARG 105 7.128 6.628 -5.274 920 HE ARG 105 HE ARG 105 9.288 6.193 -7.173 921 HH11 ARG 105 1HH1 ARG 105 7.951 8.362 -4.739 922 HH12 ARG 105 2HH1 ARG 105 9.465 9.161 -4.446 923 HH21 ARG 105 1HH2 ARG 105 11.273 7.250 -6.773 924 HH22 ARG 105 2HH2 ARG 105 11.347 8.531 -5.600 925 H LYS 106 H LYS 106 4.976 5.431 -9.430 926 HA LYS 106 HA LYS 106 2.949 3.489 -10.300 927 HB2 LYS 106 2HB LYS 106 5.052 5.053 -11.881 928 HB3 LYS 106 3HB LYS 106 3.814 4.016 -12.587 929 HG2 LYS 106 2HG LYS 106 2.051 5.534 -11.800 930 HG3 LYS 106 3HG LYS 106 3.257 6.541 -10.992 931 HD2 LYS 106 2HD LYS 106 2.599 7.579 -13.112 932 HD3 LYS 106 3HD LYS 106 4.287 7.069 -13.192 933 HE2 LYS 106 2HE LYS 106 3.610 5.064 -14.475 934 HE3 LYS 106 3HE LYS 106 1.923 5.583 -14.393 935 HZ1 LYS 106 3HZ LYS 106 4.116 7.139 -15.660 936 HZ2 LYS 106 1HZ LYS 106 2.476 7.544 -15.640 937 HZ3 LYS 106 2HZ LYS 106 3.001 6.181 -16.494 938 H VAL 107 H VAL 107 3.518 1.471 -11.087 939 HA VAL 107 HA VAL 107 6.238 0.695 -11.620 940 HB VAL 107 HB VAL 107 6.292 0.345 -9.203 941 HG11 VAL 107 1HG1 VAL 107 3.852 -1.421 -9.513 942 HG12 VAL 107 2HG1 VAL 107 3.902 0.158 -8.730 943 HG13 VAL 107 3HG1 VAL 107 4.783 -1.201 -8.029 944 HG21 VAL 107 3HG2 VAL 107 7.490 -1.302 -10.564 945 HG22 VAL 107 1HG2 VAL 107 6.054 -2.322 -10.640 946 HG23 VAL 107 2HG2 VAL 107 6.864 -2.046 -9.100 947 H THR 108 H THR 108 6.347 -0.985 -12.996 948 HA THR 108 HA THR 108 3.884 -2.471 -13.721 949 HB THR 108 HB THR 108 4.722 -2.496 -16.086 950 HG1 THR 108 HG1 THR 108 6.785 -2.026 -16.221 951 HG21 THR 108 3HG2 THR 108 4.371 0.319 -14.980 952 HG22 THR 108 1HG2 THR 108 3.064 -0.765 -15.468 953 HG23 THR 108 2HG2 THR 108 4.199 -0.150 -16.672 954 H ASP 109 H ASP 109 7.369 -2.518 -13.173 955 HA ASP 109 HA ASP 109 7.673 -5.323 -13.999 956 HB2 ASP 109 2HB ASP 109 9.395 -3.642 -14.648 957 HB3 ASP 109 3HB ASP 109 9.722 -3.317 -12.957 958 H ASP 110 H ASP 110 8.438 -6.972 -12.554 959 HA ASP 110 HA ASP 110 7.031 -6.922 -10.063 960 HB2 ASP 110 2HB ASP 110 7.445 -9.253 -9.912 961 HB3 ASP 110 3HB ASP 110 7.293 -8.949 -11.632 962 H GLU 111 H GLU 111 10.510 -6.954 -10.921 963 HA GLU 111 HA GLU 111 11.407 -7.194 -8.189 964 HB2 GLU 111 2HB GLU 111 13.016 -6.335 -10.637 965 HB3 GLU 111 3HB GLU 111 13.679 -6.785 -9.065 966 HG2 GLU 111 2HG GLU 111 12.539 -9.074 -9.432 967 HG3 GLU 111 3HG GLU 111 12.329 -8.567 -11.106 968 H GLU 112 H GLU 112 10.936 -4.605 -10.528 969 HA GLU 112 HA GLU 112 11.897 -2.392 -9.141 970 HB2 GLU 112 2HB GLU 112 11.210 -2.336 -11.488 971 HB3 GLU 112 3HB GLU 112 9.544 -2.700 -11.060 972 HG2 GLU 112 2HG GLU 112 9.364 -0.496 -9.942 973 HG3 GLU 112 3HG GLU 112 11.031 -0.139 -10.392 974 H ALA 113 H ALA 113 8.734 -4.046 -8.965 975 HA ALA 113 HA ALA 113 7.402 -2.377 -7.160 976 HB1 ALA 113 3HB ALA 113 7.183 -5.399 -7.369 977 HB2 ALA 113 1HB ALA 113 6.294 -4.228 -8.341 978 HB3 ALA 113 2HB ALA 113 6.012 -4.322 -6.600 979 H LEU 114 H LEU 114 9.493 -5.189 -6.522 980 HA LEU 114 HA LEU 114 9.366 -5.243 -3.719 981 HB2 LEU 114 2HB LEU 114 11.750 -6.054 -5.440 982 HB3 LEU 114 3HB LEU 114 11.401 -6.618 -3.812 983 HG LEU 114 HG LEU 114 9.748 -7.255 -6.292 984 HD11 LEU 114 1HD1 LEU 114 10.599 -9.550 -6.063 985 HD12 LEU 114 2HD1 LEU 114 11.624 -9.045 -4.715 986 HD13 LEU 114 3HD1 LEU 114 11.908 -8.398 -6.333 987 HD21 LEU 114 3HD2 LEU 114 9.414 -8.288 -3.459 988 HD22 LEU 114 1HD2 LEU 114 8.504 -8.821 -4.874 989 HD23 LEU 114 2HD2 LEU 114 8.336 -7.167 -4.293 990 H LYS 115 H LYS 115 11.584 -3.552 -5.927 991 HA LYS 115 HA LYS 115 13.416 -2.525 -4.035 992 HB2 LYS 115 2HB LYS 115 12.726 -1.417 -6.799 993 HB3 LYS 115 3HB LYS 115 14.137 -0.966 -5.849 994 HG2 LYS 115 2HG LYS 115 13.566 -3.716 -6.970 995 HG3 LYS 115 3HG LYS 115 14.691 -2.552 -7.650 996 HD2 LYS 115 2HD LYS 115 15.023 -3.630 -4.831 997 HD3 LYS 115 3HD LYS 115 15.635 -4.495 -6.235 998 HE2 LYS 115 2HE LYS 115 17.428 -3.185 -5.226 999 HE3 LYS 115 3HE LYS 115 17.048 -2.546 -6.822 1000 HZ1 LYS 115 3HZ LYS 115 15.963 -1.379 -4.322 1001 HZ2 LYS 115 1HZ LYS 115 15.959 -0.698 -5.865 1002 HZ3 LYS 115 2HZ LYS 115 17.411 -0.867 -5.018 1003 H ILE 116 H ILE 116 10.450 -1.154 -5.460 1004 HA ILE 116 HA ILE 116 10.766 1.444 -4.308 1005 HB ILE 116 HB ILE 116 8.298 0.137 -5.539 1006 HG12 ILE 116 2HG1 ILE 116 10.187 0.446 -7.143 1007 HG13 ILE 116 3HG1 ILE 116 8.818 1.466 -7.552 1008 HG21 ILE 116 1HG2 ILE 116 7.374 2.425 -5.727 1009 HG22 ILE 116 2HG2 ILE 116 8.740 3.055 -4.806 1010 HG23 ILE 116 3HG2 ILE 116 7.601 1.943 -4.045 1011 HD11 ILE 116 3HD1 ILE 116 9.991 3.411 -6.611 1012 HD12 ILE 116 1HD1 ILE 116 10.923 2.623 -7.883 1013 HD13 ILE 116 2HD1 ILE 116 11.364 2.380 -6.195 1014 H VAL 117 H VAL 117 9.043 -1.515 -3.277 1015 HA VAL 117 HA VAL 117 7.747 -0.410 -1.003 1016 HB VAL 117 HB VAL 117 8.839 -3.261 -1.237 1017 HG11 VAL 117 1HG1 VAL 117 6.633 -2.129 0.536 1018 HG12 VAL 117 2HG1 VAL 117 8.230 -2.656 1.075 1019 HG13 VAL 117 3HG1 VAL 117 7.088 -3.831 0.425 1020 HG21 VAL 117 3HG2 VAL 117 6.615 -3.926 -2.026 1021 HG22 VAL 117 1HG2 VAL 117 7.330 -2.745 -3.119 1022 HG23 VAL 117 2HG2 VAL 117 6.078 -2.244 -1.988 1023 H ARG 118 H ARG 118 11.017 -1.648 -1.555 1024 HA ARG 118 HA ARG 118 11.877 -1.370 1.185 1025 HB2 ARG 118 2HB ARG 118 13.506 -1.881 -1.332 1026 HB3 ARG 118 3HB ARG 118 14.113 -1.999 0.320 1027 HG2 ARG 118 2HG ARG 118 12.406 -3.806 0.751 1028 HG3 ARG 118 3HG ARG 118 11.969 -3.734 -0.954 1029 HD2 ARG 118 2HD ARG 118 13.460 -5.583 -0.668 1030 HD3 ARG 118 3HD ARG 118 14.360 -4.317 -1.505 1031 HE ARG 118 HE ARG 118 15.157 -3.766 0.900 1032 HH11 ARG 118 1HH1 ARG 118 14.664 -7.014 -0.383 1033 HH12 ARG 118 2HH1 ARG 118 15.845 -7.733 0.666 1034 HH21 ARG 118 1HH2 ARG 118 16.670 -4.711 2.285 1035 HH22 ARG 118 2HH2 ARG 118 16.993 -6.410 2.193 1036 H GLU 119 H GLU 119 11.773 0.761 -1.601 1037 HA GLU 119 HA GLU 119 13.364 2.860 -0.513 1038 HB2 GLU 119 2HB GLU 119 10.890 3.014 -2.304 1039 HB3 GLU 119 3HB GLU 119 11.895 4.400 -1.895 1040 HG2 GLU 119 2HG GLU 119 12.789 1.964 -3.445 1041 HG3 GLU 119 3HG GLU 119 12.390 3.537 -4.131 1042 H PHE 120 H PHE 120 9.878 2.167 -0.421 1043 HA PHE 120 HA PHE 120 8.953 4.219 1.179 1044 HB2 PHE 120 2HB PHE 120 7.915 1.369 0.882 1045 HB3 PHE 120 3HB PHE 120 7.026 2.635 1.724 1046 HD1 PHE 120 HD2 PHE 120 8.242 4.670 -0.665 1047 HD2 PHE 120 HD1 PHE 120 5.754 1.176 -0.437 1048 HE1 PHE 120 HE2 PHE 120 7.099 5.326 -2.747 1049 HE2 PHE 120 HE1 PHE 120 4.638 1.862 -2.507 1050 HZ PHE 120 HZ PHE 120 5.295 3.924 -3.657 1051 H MET 121 H MET 121 10.037 0.991 2.177 1052 HA MET 121 HA MET 121 9.468 1.317 4.944 1053 HB2 MET 121 2HB MET 121 11.167 -0.733 3.465 1054 HB3 MET 121 3HB MET 121 10.816 -0.816 5.187 1055 HG2 MET 121 2HG MET 121 8.394 -0.958 4.658 1056 HG3 MET 121 3HG MET 121 8.797 -0.979 2.939 1057 HE1 MET 121 3HE MET 121 11.500 -2.740 2.924 1058 HE2 MET 121 1HE MET 121 10.187 -2.950 1.763 1059 HE3 MET 121 2HE MET 121 10.819 -4.341 2.641 1060 H GLN 122 H GLN 122 12.457 1.657 3.004 1061 HA GLN 122 HA GLN 122 14.284 2.006 5.144 1062 HB2 GLN 122 2HB GLN 122 14.953 1.549 2.763 1063 HB3 GLN 122 3HB GLN 122 14.447 3.177 2.324 1064 HG2 GLN 122 2HG GLN 122 16.180 4.001 4.045 1065 HG3 GLN 122 3HG GLN 122 16.789 2.347 4.056 1066 HE21 GLN 122 1HE2 GLN 122 17.849 1.556 2.173 1067 HE22 GLN 122 2HE2 GLN 122 18.418 2.622 0.938 1068 H LYS 123 H LYS 123 12.344 4.260 3.266 1069 HA LYS 123 HA LYS 123 13.380 6.677 4.420 1070 HB2 LYS 123 2HB LYS 123 10.902 6.161 2.713 1071 HB3 LYS 123 3HB LYS 123 11.494 7.766 3.150 1072 HG2 LYS 123 2HG LYS 123 13.532 7.450 1.895 1073 HG3 LYS 123 3HG LYS 123 13.166 5.744 1.620 1074 HD2 LYS 123 2HD LYS 123 11.196 6.410 0.247 1075 HD3 LYS 123 3HD LYS 123 11.613 8.107 0.485 1076 HE2 LYS 123 2HE LYS 123 13.800 7.699 -0.637 1077 HE3 LYS 123 3HE LYS 123 13.323 6.020 -0.915 1078 HZ1 LYS 123 3HZ LYS 123 12.935 7.336 -2.866 1079 HZ2 LYS 123 1HZ LYS 123 11.981 8.433 -2.002 1080 HZ3 LYS 123 2HZ LYS 123 11.446 6.846 -2.230 1081 H ALA 124 H ALA 124 10.435 4.723 4.875 1082 HA ALA 124 HA ALA 124 9.207 6.316 6.881 1083 HB1 ALA 124 3HB ALA 124 8.919 3.334 6.343 1084 HB2 ALA 124 1HB ALA 124 7.957 4.623 5.619 1085 HB3 ALA 124 2HB ALA 124 7.840 4.307 7.350 1086 H GLY 125 H GLY 125 11.612 3.734 6.951 1087 HA2 GLY 125 2HA GLY 125 11.729 3.374 9.799 1088 HA3 GLY 125 3HA GLY 125 12.912 2.815 8.622 1089 H SER 126 H SER 126 13.213 5.558 7.503 1090 HA SER 126 HA SER 126 15.160 6.645 9.360 1091 HB2 SER 126 2HB SER 126 15.660 6.578 6.951 1092 HB3 SER 126 3HB SER 126 14.258 7.584 6.598 1093 HG SER 126 HG SER 126 16.744 8.332 7.272 1094 H LEU 127 H LEU 127 11.821 7.274 8.408 1095 HA LEU 127 HA LEU 127 11.608 9.888 9.604 1096 HB2 LEU 127 2HB LEU 127 9.429 7.847 8.949 1097 HB3 LEU 127 3HB LEU 127 9.116 9.483 9.504 1098 HG LEU 127 HG LEU 127 10.389 8.709 6.849 1099 HD11 LEU 127 1HD1 LEU 127 7.986 8.277 6.895 1100 HD12 LEU 127 2HD1 LEU 127 8.352 9.625 5.823 1101 HD13 LEU 127 3HD1 LEU 127 7.671 9.932 7.426 1102 HD21 LEU 127 3HD2 LEU 127 10.343 11.100 6.271 1103 HD22 LEU 127 1HD2 LEU 127 11.388 10.793 7.658 1104 HD23 LEU 127 2HD2 LEU 127 9.785 11.492 7.898 1105 H GLU 128 H GLU 128 10.936 6.561 10.616 1106 HA GLU 128 HA GLU 128 9.810 7.078 13.158 1107 HB2 GLU 128 2HB GLU 128 11.088 4.614 11.935 1108 HB3 GLU 128 3HB GLU 128 10.432 4.602 13.567 1109 HG2 GLU 128 2HG GLU 128 8.848 5.227 11.065 1110 HG3 GLU 128 3HG GLU 128 8.877 3.671 11.890 1111 H HIS 129 H HIS 129 12.980 7.625 12.264 1112 HA HIS 129 HA HIS 129 14.526 6.796 14.444 1113 HB2 HIS 129 2HB HIS 129 16.199 8.285 13.664 1114 HB3 HIS 129 3HB HIS 129 15.287 7.913 12.206 1115 HD1 HIS 129 HD1 HIS 129 13.265 9.890 11.798 1116 HD2 HIS 129 HD2 HIS 129 16.698 10.945 13.886 1117 HE1 HIS 129 HE1 HIS 129 13.402 12.384 11.660 1118 HE2 HIS 129 HE2 HIS 129 15.559 12.983 12.793 1119 H HIS 130 H HIS 130 15.482 8.308 16.094 1120 HA HIS 130 HA HIS 130 13.435 9.285 17.815 1121 HB2 HIS 130 2HB HIS 130 15.574 8.103 18.524 1122 HB3 HIS 130 3HB HIS 130 16.467 9.564 18.117 1123 HD1 HIS 130 HD1 HIS 130 14.316 8.054 20.750 1124 HD2 HIS 130 HD2 HIS 130 16.098 11.725 19.941 1125 HE1 HIS 130 HE1 HIS 130 14.186 9.368 22.887 1126 HE2 HIS 130 HE2 HIS 130 15.065 11.646 22.304 1127 H HIS 131 H HIS 131 12.519 10.858 16.464 1128 HA HIS 131 HA HIS 131 12.327 13.351 17.123 1129 HB2 HIS 131 2HB HIS 131 14.677 13.336 15.187 1130 HB3 HIS 131 3HB HIS 131 13.554 14.689 15.151 1131 HD1 HIS 131 HD1 HIS 131 16.699 14.437 16.153 1132 HD2 HIS 131 HD2 HIS 131 13.290 15.208 18.401 1133 HE1 HIS 131 HE1 HIS 131 17.503 15.620 18.212 1134 HE2 HIS 131 HE2 HIS 131 15.454 15.836 19.650 1135 H HIS 132 H HIS 132 10.295 12.479 16.462 1136 HA HIS 132 HA HIS 132 9.519 13.199 13.752 1137 HB2 HIS 132 2HB HIS 132 8.528 11.047 13.152 1138 HB3 HIS 132 3HB HIS 132 10.241 10.826 13.478 1139 HD1 HIS 132 HD1 HIS 132 7.044 9.363 14.198 1140 HD2 HIS 132 HD2 HIS 132 10.634 9.673 16.265 1141 HE1 HIS 132 HE1 HIS 132 6.974 7.559 15.939 1142 HE2 HIS 132 HE2 HIS 132 9.109 7.831 17.235 1143 H HIS 133 H HIS 133 7.081 12.843 13.454 1144 HA HIS 133 HA HIS 133 5.511 13.776 15.642 1145 HB2 HIS 133 2HB HIS 133 4.650 12.338 13.084 1146 HB3 HIS 133 3HB HIS 133 3.520 13.010 14.250 1147 HD1 HIS 133 HD1 HIS 133 2.615 15.170 13.488 1148 HD2 HIS 133 HD2 HIS 133 6.514 14.618 12.174 1149 HE1 HIS 133 HE1 HIS 133 3.159 17.201 12.114 1150 HE2 HIS 133 HE2 HIS 133 5.465 16.770 11.217 1151 H HIS 134 H HIS 134 4.883 12.644 17.407 1152 HA HIS 134 HA HIS 134 5.960 10.199 18.088 1153 HB2 HIS 134 2HB HIS 134 5.251 11.824 19.778 1154 HB3 HIS 134 3HB HIS 134 3.558 11.627 19.329 1155 HD1 HIS 134 HD1 HIS 134 6.329 10.002 21.224 1156 HD2 HIS 134 HD2 HIS 134 2.313 9.331 20.442 1157 HE1 HIS 134 HE1 HIS 134 5.645 8.154 22.770 1158 HE2 HIS 134 HE2 HIS 134 3.275 7.624 22.122 Start of MODEL 11 1 H1 MET 1 1H MET 1 0.977 8.496 15.329 2 H2 MET 1 2H MET 1 1.779 9.821 15.998 3 H3 MET 1 3H MET 1 2.007 8.282 16.655 4 HA MET 1 HA MET 1 2.778 9.149 13.949 5 HB2 MET 1 2HB MET 1 4.221 10.181 15.650 6 HB3 MET 1 3HB MET 1 4.494 8.620 16.417 7 HG2 MET 1 2HG MET 1 6.428 9.352 15.049 8 HG3 MET 1 3HG MET 1 5.736 7.837 14.459 9 HE1 MET 1 3HE MET 1 6.890 9.508 11.116 10 HE2 MET 1 1HE MET 1 6.931 8.045 12.102 11 HE3 MET 1 2HE MET 1 7.726 9.516 12.667 12 H LYS 2 H LYS 2 2.327 7.433 12.671 13 HA LYS 2 HA LYS 2 3.548 4.837 13.172 14 HB2 LYS 2 2HB LYS 2 1.290 4.751 14.329 15 HB3 LYS 2 3HB LYS 2 0.525 5.068 12.780 16 HG2 LYS 2 2HG LYS 2 1.585 2.909 11.941 17 HG3 LYS 2 3HG LYS 2 2.064 2.592 13.613 18 HD2 LYS 2 2HD LYS 2 -0.399 2.822 14.243 19 HD3 LYS 2 3HD LYS 2 -0.761 2.871 12.517 20 HE2 LYS 2 2HE LYS 2 -1.143 0.625 13.295 21 HE3 LYS 2 3HE LYS 2 0.317 0.600 12.307 22 HZ1 LYS 2 3HZ LYS 2 0.235 0.662 15.279 23 HZ2 LYS 2 1HZ LYS 2 1.640 0.617 14.338 24 HZ3 LYS 2 2HZ LYS 2 0.573 -0.695 14.331 25 H ILE 3 H ILE 3 4.238 4.050 11.245 26 HA ILE 3 HA ILE 3 3.506 5.447 8.769 27 HB ILE 3 HB ILE 3 5.721 3.422 9.335 28 HG12 ILE 3 2HG1 ILE 3 6.103 5.646 10.419 29 HG13 ILE 3 3HG1 ILE 3 7.299 5.306 9.176 30 HG21 ILE 3 1HG2 ILE 3 6.608 3.967 7.092 31 HG22 ILE 3 2HG2 ILE 3 5.202 4.985 6.779 32 HG23 ILE 3 3HG2 ILE 3 5.004 3.245 6.996 33 HD11 ILE 3 3HD1 ILE 3 4.918 7.133 8.880 34 HD12 ILE 3 1HD1 ILE 3 6.136 6.803 7.645 35 HD13 ILE 3 2HD1 ILE 3 6.594 7.617 9.136 36 H LEU 4 H LEU 4 2.110 4.554 7.356 37 HA LEU 4 HA LEU 4 1.652 1.622 7.381 38 HB2 LEU 4 2HB LEU 4 -0.309 3.802 6.547 39 HB3 LEU 4 3HB LEU 4 -0.606 2.070 6.474 40 HG LEU 4 HG LEU 4 -0.295 3.746 9.002 41 HD11 LEU 4 1HD1 LEU 4 -2.693 2.276 7.869 42 HD12 LEU 4 2HD1 LEU 4 -2.453 4.025 7.909 43 HD13 LEU 4 3HD1 LEU 4 -2.633 3.133 9.416 44 HD21 LEU 4 3HD2 LEU 4 0.724 1.556 9.388 45 HD22 LEU 4 1HD2 LEU 4 -0.724 0.746 8.780 46 HD23 LEU 4 2HD2 LEU 4 -0.794 1.693 10.269 47 H ILE 5 H ILE 5 2.730 0.765 5.711 48 HA ILE 5 HA ILE 5 3.148 2.236 3.208 49 HB ILE 5 HB ILE 5 3.995 -0.631 3.855 50 HG12 ILE 5 2HG1 ILE 5 5.028 0.950 5.500 51 HG13 ILE 5 3HG1 ILE 5 6.226 0.193 4.462 52 HG21 ILE 5 1HG2 ILE 5 4.973 1.291 1.702 53 HG22 ILE 5 2HG2 ILE 5 3.984 -0.148 1.449 54 HG23 ILE 5 3HG2 ILE 5 5.645 -0.317 2.016 55 HD11 ILE 5 3HD1 ILE 5 6.376 2.261 3.150 56 HD12 ILE 5 1HD1 ILE 5 6.742 2.509 4.857 57 HD13 ILE 5 2HD1 ILE 5 5.179 3.008 4.215 58 H LEU 6 H LEU 6 1.377 2.235 1.870 59 HA LEU 6 HA LEU 6 -0.494 -0.040 1.822 60 HB2 LEU 6 2HB LEU 6 -1.048 2.612 1.944 61 HB3 LEU 6 3HB LEU 6 -0.943 2.478 0.207 62 HG LEU 6 HG LEU 6 -3.260 2.316 0.773 63 HD11 LEU 6 1HD1 LEU 6 -2.383 -0.536 0.255 64 HD12 LEU 6 2HD1 LEU 6 -2.658 0.711 -0.962 65 HD13 LEU 6 3HD1 LEU 6 -4.004 0.127 0.012 66 HD21 LEU 6 3HD2 LEU 6 -2.541 0.224 2.838 67 HD22 LEU 6 1HD2 LEU 6 -4.176 0.746 2.422 68 HD23 LEU 6 2HD2 LEU 6 -3.049 1.888 3.143 69 H ILE 7 H ILE 7 -0.496 -1.415 0.060 70 HA ILE 7 HA ILE 7 0.849 -0.610 -2.450 71 HB ILE 7 HB ILE 7 1.251 -3.310 -1.052 72 HG12 ILE 7 2HG1 ILE 7 3.255 -1.055 -1.578 73 HG13 ILE 7 3HG1 ILE 7 2.589 -1.486 -0.009 74 HG21 ILE 7 1HG2 ILE 7 2.375 -2.330 -3.707 75 HG22 ILE 7 2HG2 ILE 7 1.144 -3.577 -3.503 76 HG23 ILE 7 3HG2 ILE 7 2.782 -3.860 -2.920 77 HD11 ILE 7 3HD1 ILE 7 4.405 -3.198 -1.697 78 HD12 ILE 7 1HD1 ILE 7 3.713 -3.650 -0.134 79 HD13 ILE 7 2HD1 ILE 7 4.836 -2.298 -0.242 80 H ASN 8 H ASN 8 -0.341 -1.097 -4.235 81 HA ASN 8 HA ASN 8 -2.647 -2.959 -4.054 82 HB2 ASN 8 2HB ASN 8 -3.295 -0.702 -4.718 83 HB3 ASN 8 3HB ASN 8 -2.047 -0.637 -5.942 84 HD21 ASN 8 1HD2 ASN 8 -4.213 -3.422 -5.441 85 HD22 ASN 8 2HD2 ASN 8 -5.063 -3.230 -6.929 86 H THR 9 H THR 9 -1.812 -4.907 -4.635 87 HA THR 9 HA THR 9 -1.007 -5.081 -7.470 88 HB THR 9 HB THR 9 0.965 -5.771 -6.236 89 HG1 THR 9 HG1 THR 9 1.066 -7.208 -7.767 90 HG21 THR 9 3HG2 THR 9 0.990 -7.662 -4.654 91 HG22 THR 9 1HG2 THR 9 -0.768 -7.792 -4.768 92 HG23 THR 9 2HG2 THR 9 -0.033 -6.355 -4.054 93 H ASN 10 H ASN 10 -2.309 -6.349 -8.654 94 HA ASN 10 HA ASN 10 -4.749 -7.446 -7.521 95 HB2 ASN 10 2HB ASN 10 -4.630 -6.059 -9.660 96 HB3 ASN 10 3HB ASN 10 -3.809 -7.407 -10.432 97 HD21 ASN 10 1HD2 ASN 10 -5.012 -9.238 -10.995 98 HD22 ASN 10 2HD2 ASN 10 -6.739 -9.256 -10.992 99 H ASN 11 H ASN 11 -1.679 -8.571 -7.874 100 HA ASN 11 HA ASN 11 -2.382 -11.356 -8.590 101 HB2 ASN 11 2HB ASN 11 -0.768 -10.287 -10.128 102 HB3 ASN 11 3HB ASN 11 0.295 -9.899 -8.778 103 HD21 ASN 11 1HD2 ASN 11 1.930 -11.061 -9.958 104 HD22 ASN 11 2HD2 ASN 11 1.989 -12.786 -9.921 105 H ASP 12 H ASP 12 -2.266 -12.837 -7.081 106 HA ASP 12 HA ASP 12 -1.724 -12.361 -4.360 107 HB2 ASP 12 2HB ASP 12 -1.943 -15.025 -5.826 108 HB3 ASP 12 3HB ASP 12 -1.960 -14.843 -4.072 109 H GLU 13 H GLU 13 0.366 -13.436 -6.943 110 HA GLU 13 HA GLU 13 2.419 -14.705 -5.465 111 HB2 GLU 13 2HB GLU 13 2.643 -13.222 -8.124 112 HB3 GLU 13 3HB GLU 13 3.853 -14.321 -7.457 113 HG2 GLU 13 2HG GLU 13 2.219 -16.186 -7.576 114 HG3 GLU 13 3HG GLU 13 1.029 -15.087 -8.284 115 H LEU 14 H LEU 14 1.938 -11.305 -6.481 116 HA LEU 14 HA LEU 14 4.423 -10.411 -5.356 117 HB2 LEU 14 2HB LEU 14 2.080 -9.030 -6.643 118 HB3 LEU 14 3HB LEU 14 3.154 -8.058 -5.652 119 HG LEU 14 HG LEU 14 3.820 -7.906 -7.990 120 HD11 LEU 14 1HD1 LEU 14 5.584 -7.757 -6.279 121 HD12 LEU 14 2HD1 LEU 14 6.189 -8.443 -7.780 122 HD13 LEU 14 3HD1 LEU 14 5.869 -9.498 -6.403 123 HD21 LEU 14 3HD2 LEU 14 2.935 -10.075 -8.772 124 HD22 LEU 14 1HD2 LEU 14 4.243 -10.917 -7.937 125 HD23 LEU 14 2HD2 LEU 14 4.600 -9.831 -9.281 126 H ILE 15 H ILE 15 1.133 -10.690 -4.109 127 HA ILE 15 HA ILE 15 1.373 -9.068 -1.818 128 HB ILE 15 HB ILE 15 -0.154 -11.711 -2.006 129 HG12 ILE 15 2HG1 ILE 15 -1.126 -8.883 -2.631 130 HG13 ILE 15 3HG1 ILE 15 -0.820 -10.147 -3.817 131 HG21 ILE 15 1HG2 ILE 15 -0.588 -9.350 -0.125 132 HG22 ILE 15 2HG2 ILE 15 0.105 -10.908 0.324 133 HG23 ILE 15 3HG2 ILE 15 -1.576 -10.814 -0.193 134 HD11 ILE 15 3HD1 ILE 15 -2.942 -10.201 -1.676 135 HD12 ILE 15 1HD1 ILE 15 -2.619 -11.490 -2.840 136 HD13 ILE 15 2HD1 ILE 15 -3.177 -9.918 -3.399 137 H LYS 16 H LYS 16 2.050 -12.542 -2.259 138 HA LYS 16 HA LYS 16 2.989 -12.948 0.412 139 HB2 LYS 16 2HB LYS 16 3.462 -15.237 -0.296 140 HB3 LYS 16 3HB LYS 16 1.879 -14.726 -0.867 141 HG2 LYS 16 2HG LYS 16 2.960 -14.240 -3.113 142 HG3 LYS 16 3HG LYS 16 4.412 -15.037 -2.505 143 HD2 LYS 16 2HD LYS 16 1.663 -16.315 -2.776 144 HD3 LYS 16 3HD LYS 16 3.009 -16.540 -3.890 145 HE2 LYS 16 2HE LYS 16 4.316 -17.629 -2.106 146 HE3 LYS 16 3HE LYS 16 2.992 -17.370 -0.966 147 HZ1 LYS 16 3HZ LYS 16 2.957 -19.613 -1.863 148 HZ2 LYS 16 1HZ LYS 16 2.835 -19.010 -3.441 149 HZ3 LYS 16 2HZ LYS 16 1.578 -18.759 -2.338 150 H LYS 17 H LYS 17 4.610 -12.246 -2.673 151 HA LYS 17 HA LYS 17 7.267 -12.869 -1.820 152 HB2 LYS 17 2HB LYS 17 6.214 -11.183 -4.122 153 HB3 LYS 17 3HB LYS 17 7.939 -11.400 -3.829 154 HG2 LYS 17 2HG LYS 17 7.773 -13.795 -4.186 155 HG3 LYS 17 3HG LYS 17 6.013 -13.702 -4.287 156 HD2 LYS 17 2HD LYS 17 6.963 -13.910 -6.537 157 HD3 LYS 17 3HD LYS 17 6.202 -12.332 -6.346 158 HE2 LYS 17 2HE LYS 17 8.405 -11.287 -6.025 159 HE3 LYS 17 3HE LYS 17 9.186 -12.868 -6.130 160 HZ1 LYS 17 3HZ LYS 17 9.295 -11.632 -8.212 161 HZ2 LYS 17 1HZ LYS 17 7.610 -11.604 -8.311 162 HZ3 LYS 17 2HZ LYS 17 8.437 -13.075 -8.391 163 H ILE 18 H ILE 18 5.404 -9.836 -1.950 164 HA ILE 18 HA ILE 18 7.391 -8.116 -0.881 165 HB ILE 18 HB ILE 18 4.348 -7.893 -0.961 166 HG12 ILE 18 2HG1 ILE 18 6.512 -6.393 -2.521 167 HG13 ILE 18 3HG1 ILE 18 5.604 -7.770 -3.131 168 HG21 ILE 18 1HG2 ILE 18 6.259 -5.735 0.005 169 HG22 ILE 18 2HG2 ILE 18 5.074 -6.589 0.994 170 HG23 ILE 18 3HG2 ILE 18 4.531 -5.518 -0.296 171 HD11 ILE 18 3HD1 ILE 18 3.536 -6.460 -2.998 172 HD12 ILE 18 1HD1 ILE 18 4.746 -5.715 -4.043 173 HD13 ILE 18 2HD1 ILE 18 4.461 -5.069 -2.427 174 H LYS 19 H LYS 19 4.966 -10.250 0.652 175 HA LYS 19 HA LYS 19 5.283 -9.461 3.327 176 HB2 LYS 19 2HB LYS 19 4.642 -12.215 2.193 177 HB3 LYS 19 3HB LYS 19 4.635 -11.863 3.921 178 HG2 LYS 19 2HG LYS 19 2.891 -10.145 3.538 179 HG3 LYS 19 3HG LYS 19 2.852 -10.588 1.832 180 HD2 LYS 19 2HD LYS 19 2.117 -12.871 2.428 181 HD3 LYS 19 3HD LYS 19 2.206 -12.461 4.147 182 HE2 LYS 19 2HE LYS 19 0.467 -10.718 3.791 183 HE3 LYS 19 3HE LYS 19 0.354 -11.203 2.100 184 HZ1 LYS 19 3HZ LYS 19 -0.290 -13.434 2.888 185 HZ2 LYS 19 1HZ LYS 19 -1.384 -12.225 3.318 186 HZ3 LYS 19 2HZ LYS 19 -0.321 -12.844 4.471 187 H LYS 20 H LYS 20 7.256 -11.672 1.342 188 HA LYS 20 HA LYS 20 8.918 -12.584 3.507 189 HB2 LYS 20 2HB LYS 20 9.601 -12.697 0.538 190 HB3 LYS 20 3HB LYS 20 10.265 -13.699 1.822 191 HG2 LYS 20 2HG LYS 20 7.460 -13.776 0.698 192 HG3 LYS 20 3HG LYS 20 8.709 -14.995 0.499 193 HD2 LYS 20 2HD LYS 20 7.471 -14.295 3.196 194 HD3 LYS 20 3HD LYS 20 6.836 -15.546 2.133 195 HE2 LYS 20 2HE LYS 20 8.169 -16.689 3.721 196 HE3 LYS 20 3HE LYS 20 9.145 -16.643 2.255 197 HZ1 LYS 20 3HZ LYS 20 10.390 -14.795 3.200 198 HZ2 LYS 20 1HZ LYS 20 10.441 -16.142 4.222 199 HZ3 LYS 20 2HZ LYS 20 9.440 -14.837 4.596 200 H GLU 21 H GLU 21 9.388 -10.274 0.845 201 HA GLU 21 HA GLU 21 11.855 -9.183 1.323 202 HB2 GLU 21 2HB GLU 21 9.291 -7.763 0.488 203 HB3 GLU 21 3HB GLU 21 10.874 -6.995 0.422 204 HG2 GLU 21 2HG GLU 21 10.157 -9.532 -1.075 205 HG3 GLU 21 3HG GLU 21 10.047 -7.913 -1.762 206 H VAL 22 H VAL 22 8.837 -8.142 2.875 207 HA VAL 22 HA VAL 22 10.204 -6.079 4.425 208 HB VAL 22 HB VAL 22 8.019 -5.302 5.068 209 HG11 VAL 22 1HG1 VAL 22 7.969 -6.187 2.162 210 HG12 VAL 22 2HG1 VAL 22 8.697 -4.710 2.794 211 HG13 VAL 22 3HG1 VAL 22 6.952 -4.929 2.864 212 HG21 VAL 22 3HG2 VAL 22 5.934 -6.499 4.506 213 HG22 VAL 22 1HG2 VAL 22 6.932 -7.429 5.620 214 HG23 VAL 22 2HG2 VAL 22 6.874 -7.869 3.911 215 H GLU 23 H GLU 23 9.206 -9.326 4.872 216 HA GLU 23 HA GLU 23 8.885 -9.644 7.624 217 HB2 GLU 23 2HB GLU 23 8.529 -11.423 5.988 218 HB3 GLU 23 3HB GLU 23 10.229 -11.410 5.543 219 HG2 GLU 23 2HG GLU 23 10.763 -12.217 7.871 220 HG3 GLU 23 3HG GLU 23 9.026 -12.383 8.150 221 H ASN 24 H ASN 24 11.814 -9.424 5.654 222 HA ASN 24 HA ASN 24 13.741 -9.826 7.703 223 HB2 ASN 24 2HB ASN 24 14.114 -8.286 5.088 224 HB3 ASN 24 3HB ASN 24 15.388 -8.985 6.084 225 HD21 ASN 24 1HD2 ASN 24 13.107 -9.563 3.596 226 HD22 ASN 24 2HD2 ASN 24 13.471 -11.231 3.335 227 H GLN 25 H GLN 25 12.048 -6.971 6.482 228 HA GLN 25 HA GLN 25 13.658 -5.101 8.082 229 HB2 GLN 25 2HB GLN 25 11.367 -4.493 6.164 230 HB3 GLN 25 3HB GLN 25 12.479 -3.327 6.870 231 HG2 GLN 25 2HG GLN 25 13.129 -5.456 4.810 232 HG3 GLN 25 3HG GLN 25 13.064 -3.718 4.552 233 HE21 GLN 25 1HE2 GLN 25 14.979 -6.361 5.623 234 HE22 GLN 25 2HE2 GLN 25 16.426 -5.479 5.920 235 H GLY 26 H GLY 26 11.074 -7.040 8.740 236 HA2 GLY 26 2HA GLY 26 9.540 -7.155 10.407 237 HA3 GLY 26 3HA GLY 26 10.389 -5.829 11.174 238 H TYR 27 H TYR 27 8.401 -6.014 8.170 239 HA TYR 27 HA TYR 27 6.477 -4.079 9.348 240 HB2 TYR 27 2HB TYR 27 7.247 -4.530 6.430 241 HB3 TYR 27 3HB TYR 27 5.800 -3.647 6.889 242 HD1 TYR 27 HD2 TYR 27 9.488 -3.610 7.739 243 HD2 TYR 27 HD1 TYR 27 6.000 -1.294 6.861 244 HE1 TYR 27 HE2 TYR 27 10.813 -1.546 7.899 245 HE2 TYR 27 HE1 TYR 27 7.335 0.774 7.015 246 HH TYR 27 HH TYR 27 10.728 0.787 7.082 247 H GLN 28 H GLN 28 4.578 -4.938 9.890 248 HA GLN 28 HA GLN 28 3.951 -7.697 9.257 249 HB2 GLN 28 2HB GLN 28 2.511 -5.640 10.982 250 HB3 GLN 28 3HB GLN 28 1.935 -7.285 10.759 251 HG2 GLN 28 2HG GLN 28 3.063 -7.130 12.883 252 HG3 GLN 28 3HG GLN 28 4.017 -8.143 11.810 253 HE21 GLN 28 1HE2 GLN 28 3.802 -4.971 13.292 254 HE22 GLN 28 2HE2 GLN 28 5.480 -4.576 13.160 255 H VAL 29 H VAL 29 3.129 -8.058 7.267 256 HA VAL 29 HA VAL 29 1.452 -6.148 5.884 257 HB VAL 29 HB VAL 29 2.178 -8.993 5.040 258 HG11 VAL 29 1HG1 VAL 29 0.973 -6.724 3.391 259 HG12 VAL 29 2HG1 VAL 29 0.144 -8.205 3.873 260 HG13 VAL 29 3HG1 VAL 29 1.502 -8.285 2.750 261 HG21 VAL 29 3HG2 VAL 29 3.832 -7.933 3.550 262 HG22 VAL 29 1HG2 VAL 29 4.170 -7.577 5.246 263 HG23 VAL 29 2HG2 VAL 29 3.425 -6.351 4.220 264 H ARG 30 H ARG 30 -0.667 -6.213 5.605 265 HA ARG 30 HA ARG 30 -2.328 -8.540 6.364 266 HB2 ARG 30 2HB ARG 30 -3.053 -5.569 6.597 267 HB3 ARG 30 3HB ARG 30 -4.127 -6.916 6.969 268 HG2 ARG 30 2HG ARG 30 -1.551 -6.289 8.459 269 HG3 ARG 30 3HG ARG 30 -3.167 -5.824 8.998 270 HD2 ARG 30 2HD ARG 30 -2.155 -8.663 8.613 271 HD3 ARG 30 3HD ARG 30 -2.403 -7.847 10.161 272 HE ARG 30 HE ARG 30 -4.837 -7.654 9.082 273 HH11 ARG 30 1HH1 ARG 30 -2.770 -10.471 9.372 274 HH12 ARG 30 2HH1 ARG 30 -4.103 -11.574 9.440 275 HH21 ARG 30 1HH2 ARG 30 -6.556 -9.096 9.127 276 HH22 ARG 30 2HH2 ARG 30 -6.252 -10.800 9.305 277 H ASP 31 H ASP 31 -3.971 -8.960 4.784 278 HA ASP 31 HA ASP 31 -3.845 -7.354 2.274 279 HB2 ASP 31 2HB ASP 31 -4.115 -9.483 0.956 280 HB3 ASP 31 3HB ASP 31 -2.578 -9.356 1.797 281 H VAL 32 H VAL 32 -5.751 -7.055 1.189 282 HA VAL 32 HA VAL 32 -8.263 -7.882 2.515 283 HB VAL 32 HB VAL 32 -7.503 -5.028 1.707 284 HG11 VAL 32 1HG1 VAL 32 -10.179 -6.034 2.754 285 HG12 VAL 32 2HG1 VAL 32 -9.858 -5.425 1.128 286 HG13 VAL 32 3HG1 VAL 32 -9.743 -4.339 2.512 287 HG21 VAL 32 3HG2 VAL 32 -6.539 -5.661 3.878 288 HG22 VAL 32 1HG2 VAL 32 -8.126 -6.180 4.458 289 HG23 VAL 32 2HG2 VAL 32 -7.826 -4.476 4.107 290 H ASN 33 H ASN 33 -9.597 -8.747 1.084 291 HA ASN 33 HA ASN 33 -9.796 -7.705 -1.685 292 HB2 ASN 33 2HB ASN 33 -9.507 -10.573 -0.745 293 HB3 ASN 33 3HB ASN 33 -10.502 -10.260 -2.162 294 HD21 ASN 33 1HD2 ASN 33 -7.284 -9.728 -0.824 295 HD22 ASN 33 2HD2 ASN 33 -6.455 -9.734 -2.339 296 H ASP 34 H ASP 34 -11.352 -7.668 1.119 297 HA ASP 34 HA ASP 34 -13.944 -7.387 -0.199 298 HB2 ASP 34 2HB ASP 34 -13.845 -9.770 0.689 299 HB3 ASP 34 3HB ASP 34 -13.667 -9.118 2.312 300 H SER 35 H SER 35 -15.325 -5.986 0.850 301 HA SER 35 HA SER 35 -14.227 -3.798 2.154 302 HB2 SER 35 2HB SER 35 -16.715 -3.162 2.462 303 HB3 SER 35 3HB SER 35 -16.159 -3.460 0.817 304 HG SER 35 HG SER 35 -17.299 -5.271 0.720 305 H ASP 36 H ASP 36 -15.859 -6.629 3.518 306 HA ASP 36 HA ASP 36 -16.222 -5.658 6.157 307 HB2 ASP 36 2HB ASP 36 -17.419 -7.663 5.248 308 HB3 ASP 36 3HB ASP 36 -15.903 -8.564 5.248 309 H GLU 37 H GLU 37 -13.586 -7.482 4.584 310 HA GLU 37 HA GLU 37 -11.867 -7.884 6.794 311 HB2 GLU 37 2HB GLU 37 -11.109 -7.454 3.863 312 HB3 GLU 37 3HB GLU 37 -10.028 -8.084 5.105 313 HG2 GLU 37 2HG GLU 37 -11.483 -10.065 5.367 314 HG3 GLU 37 3HG GLU 37 -12.559 -9.432 4.116 315 H LEU 38 H LEU 38 -12.187 -5.227 4.481 316 HA LEU 38 HA LEU 38 -10.077 -3.567 5.247 317 HB2 LEU 38 2HB LEU 38 -11.280 -3.274 3.190 318 HB3 LEU 38 3HB LEU 38 -12.792 -3.000 4.021 319 HG LEU 38 HG LEU 38 -10.557 -0.993 4.440 320 HD11 LEU 38 1HD1 LEU 38 -10.582 -1.307 2.021 321 HD12 LEU 38 2HD1 LEU 38 -11.235 0.267 2.463 322 HD13 LEU 38 3HD1 LEU 38 -12.329 -1.034 1.986 323 HD21 LEU 38 3HD2 LEU 38 -12.630 -0.658 5.732 324 HD22 LEU 38 1HD2 LEU 38 -13.582 -0.670 4.243 325 HD23 LEU 38 2HD2 LEU 38 -12.432 0.630 4.550 326 H LYS 39 H LYS 39 -13.475 -3.500 6.368 327 HA LYS 39 HA LYS 39 -13.227 -1.328 8.174 328 HB2 LYS 39 2HB LYS 39 -15.231 -3.618 8.138 329 HB3 LYS 39 3HB LYS 39 -15.418 -2.126 9.062 330 HG2 LYS 39 2HG LYS 39 -15.551 -0.812 7.017 331 HG3 LYS 39 3HG LYS 39 -15.185 -2.234 6.037 332 HD2 LYS 39 2HD LYS 39 -17.582 -1.759 5.940 333 HD3 LYS 39 3HD LYS 39 -17.307 -3.289 6.775 334 HE2 LYS 39 2HE LYS 39 -17.625 -2.153 8.952 335 HE3 LYS 39 3HE LYS 39 -17.886 -0.620 8.118 336 HZ1 LYS 39 3HZ LYS 39 -19.961 -1.690 8.757 337 HZ2 LYS 39 1HZ LYS 39 -19.578 -3.042 7.819 338 HZ3 LYS 39 2HZ LYS 39 -19.843 -1.546 7.078 339 H LYS 40 H LYS 40 -12.765 -4.792 8.518 340 HA LYS 40 HA LYS 40 -12.452 -4.940 11.330 341 HB2 LYS 40 2HB LYS 40 -11.537 -6.742 9.075 342 HB3 LYS 40 3HB LYS 40 -11.233 -7.123 10.773 343 HG2 LYS 40 2HG LYS 40 -13.609 -7.191 11.254 344 HG3 LYS 40 3HG LYS 40 -13.996 -6.622 9.627 345 HD2 LYS 40 2HD LYS 40 -14.384 -9.012 9.825 346 HD3 LYS 40 3HD LYS 40 -13.095 -8.685 8.669 347 HE2 LYS 40 2HE LYS 40 -12.589 -10.632 10.122 348 HE3 LYS 40 3HE LYS 40 -11.412 -9.333 10.343 349 HZ1 LYS 40 3HZ LYS 40 -12.189 -10.336 12.440 350 HZ2 LYS 40 1HZ LYS 40 -13.755 -9.793 12.108 351 HZ3 LYS 40 2HZ LYS 40 -12.508 -8.678 12.351 352 H GLU 41 H GLU 41 -10.162 -4.386 8.652 353 HA GLU 41 HA GLU 41 -7.831 -4.367 10.300 354 HB2 GLU 41 2HB GLU 41 -8.253 -3.288 7.480 355 HB3 GLU 41 3HB GLU 41 -6.691 -3.333 8.296 356 HG2 GLU 41 2HG GLU 41 -8.379 -5.659 7.360 357 HG3 GLU 41 3HG GLU 41 -6.736 -5.237 6.880 358 H MET 42 H MET 42 -10.171 -1.911 9.386 359 HA MET 42 HA MET 42 -8.674 0.324 10.356 360 HB2 MET 42 2HB MET 42 -11.628 -0.074 9.754 361 HB3 MET 42 3HB MET 42 -11.018 1.434 10.445 362 HG2 MET 42 2HG MET 42 -10.138 0.192 7.830 363 HG3 MET 42 3HG MET 42 -11.158 1.628 8.026 364 HE1 MET 42 3HE MET 42 -7.369 2.617 6.810 365 HE2 MET 42 1HE MET 42 -9.009 2.385 6.211 366 HE3 MET 42 2HE MET 42 -8.021 0.988 6.647 367 H LYS 43 H LYS 43 -10.766 -2.062 11.862 368 HA LYS 43 HA LYS 43 -10.838 -0.900 14.462 369 HB2 LYS 43 2HB LYS 43 -11.018 -3.804 13.550 370 HB3 LYS 43 3HB LYS 43 -11.262 -3.300 15.217 371 HG2 LYS 43 2HG LYS 43 -12.946 -2.302 12.900 372 HG3 LYS 43 3HG LYS 43 -13.365 -3.712 13.880 373 HD2 LYS 43 2HD LYS 43 -13.395 -2.242 15.914 374 HD3 LYS 43 3HD LYS 43 -13.063 -0.846 14.882 375 HE2 LYS 43 2HE LYS 43 -15.184 -1.114 13.742 376 HE3 LYS 43 3HE LYS 43 -15.493 -2.641 14.572 377 HZ1 LYS 43 3HZ LYS 43 -15.619 -1.447 16.659 378 HZ2 LYS 43 1HZ LYS 43 -16.727 -0.809 15.551 379 HZ3 LYS 43 2HZ LYS 43 -15.292 0.016 15.881 380 H LYS 44 H LYS 44 -8.719 -3.333 12.913 381 HA LYS 44 HA LYS 44 -7.047 -3.942 15.044 382 HB2 LYS 44 2HB LYS 44 -6.365 -3.968 12.072 383 HB3 LYS 44 3HB LYS 44 -5.442 -4.786 13.325 384 HG2 LYS 44 2HG LYS 44 -8.347 -5.496 13.026 385 HG3 LYS 44 3HG LYS 44 -7.228 -6.065 11.797 386 HD2 LYS 44 2HD LYS 44 -7.423 -7.845 13.327 387 HD3 LYS 44 3HD LYS 44 -5.870 -7.110 13.704 388 HE2 LYS 44 2HE LYS 44 -8.358 -6.373 15.270 389 HE3 LYS 44 3HE LYS 44 -7.447 -7.830 15.654 390 HZ1 LYS 44 3HZ LYS 44 -6.329 -5.082 15.657 391 HZ2 LYS 44 1HZ LYS 44 -5.503 -6.488 16.080 392 HZ3 LYS 44 2HZ LYS 44 -6.799 -5.946 17.023 393 H LEU 45 H LEU 45 -6.475 -1.518 12.461 394 HA LEU 45 HA LEU 45 -3.976 -0.561 13.302 395 HB2 LEU 45 2HB LEU 45 -6.173 0.916 11.791 396 HB3 LEU 45 3HB LEU 45 -4.524 1.503 11.956 397 HG LEU 45 HG LEU 45 -5.329 -1.060 10.516 398 HD11 LEU 45 1HD1 LEU 45 -4.475 1.600 9.339 399 HD12 LEU 45 2HD1 LEU 45 -6.097 0.904 9.290 400 HD13 LEU 45 3HD1 LEU 45 -4.777 0.109 8.437 401 HD21 LEU 45 3HD2 LEU 45 -2.606 0.274 10.712 402 HD22 LEU 45 1HD2 LEU 45 -3.004 -1.128 9.709 403 HD23 LEU 45 2HD2 LEU 45 -3.082 -1.251 11.463 404 H ALA 46 H ALA 46 -7.250 0.389 14.233 405 HA ALA 46 HA ALA 46 -6.564 2.698 15.780 406 HB1 ALA 46 3HB ALA 46 -9.093 1.015 15.824 407 HB2 ALA 46 1HB ALA 46 -8.785 2.397 14.765 408 HB3 ALA 46 2HB ALA 46 -8.908 2.632 16.507 409 H GLU 47 H GLU 47 -6.973 -0.747 16.529 410 HA GLU 47 HA GLU 47 -6.913 -0.568 19.393 411 HB2 GLU 47 2HB GLU 47 -6.344 -2.848 17.441 412 HB3 GLU 47 3HB GLU 47 -6.361 -3.068 19.188 413 HG2 GLU 47 2HG GLU 47 -8.703 -2.652 19.322 414 HG3 GLU 47 3HG GLU 47 -8.758 -2.015 17.676 415 H GLU 48 H GLU 48 -4.537 -1.147 16.850 416 HA GLU 48 HA GLU 48 -2.399 -1.730 18.789 417 HB2 GLU 48 2HB GLU 48 -2.589 -2.221 15.780 418 HB3 GLU 48 3HB GLU 48 -1.200 -2.659 16.780 419 HG2 GLU 48 2HG GLU 48 -2.483 -4.263 18.023 420 HG3 GLU 48 3HG GLU 48 -3.997 -3.695 17.325 421 H LYS 49 H LYS 49 -2.388 0.531 19.367 422 HA LYS 49 HA LYS 49 -1.358 2.549 17.613 423 HB2 LYS 49 2HB LYS 49 -2.786 3.019 19.632 424 HB3 LYS 49 3HB LYS 49 -1.453 2.511 20.660 425 HG2 LYS 49 2HG LYS 49 -1.565 4.952 20.574 426 HG3 LYS 49 3HG LYS 49 -0.076 4.387 19.821 427 HD2 LYS 49 2HD LYS 49 -0.938 6.160 18.460 428 HD3 LYS 49 3HD LYS 49 -1.198 4.662 17.566 429 HE2 LYS 49 2HE LYS 49 -3.151 6.139 17.406 430 HE3 LYS 49 3HE LYS 49 -3.574 4.669 18.287 431 HZ1 LYS 49 3HZ LYS 49 -2.906 7.290 19.521 432 HZ2 LYS 49 1HZ LYS 49 -3.351 5.889 20.361 433 HZ3 LYS 49 2HZ LYS 49 -4.461 6.660 19.346 434 H ASN 50 H ASN 50 0.064 -0.117 18.988 435 HA ASN 50 HA ASN 50 2.620 0.435 19.730 436 HB2 ASN 50 2HB ASN 50 1.782 -1.776 17.802 437 HB3 ASN 50 3HB ASN 50 3.280 -1.745 18.725 438 HD21 ASN 50 1HD2 ASN 50 1.194 -3.752 18.706 439 HD22 ASN 50 2HD2 ASN 50 0.628 -3.886 20.332 440 H PHE 51 H PHE 51 4.410 1.245 18.798 441 HA PHE 51 HA PHE 51 4.312 2.574 16.275 442 HB2 PHE 51 2HB PHE 51 6.465 2.205 18.377 443 HB3 PHE 51 3HB PHE 51 6.874 2.918 16.819 444 HD1 PHE 51 HD2 PHE 51 4.323 3.324 19.578 445 HD2 PHE 51 HD1 PHE 51 6.729 5.258 16.602 446 HE1 PHE 51 HE2 PHE 51 3.537 5.522 20.356 447 HE2 PHE 51 HE1 PHE 51 5.930 7.443 17.394 448 HZ PHE 51 HZ PHE 51 4.336 7.580 19.265 449 H GLU 52 H GLU 52 4.647 -0.678 16.749 450 HA GLU 52 HA GLU 52 6.382 -1.489 14.729 451 HB2 GLU 52 2HB GLU 52 4.995 -3.498 14.539 452 HB3 GLU 52 3HB GLU 52 5.149 -3.055 16.234 453 HG2 GLU 52 2HG GLU 52 2.870 -2.068 16.181 454 HG3 GLU 52 3HG GLU 52 2.722 -2.518 14.485 455 H LYS 53 H LYS 53 6.328 -1.306 12.527 456 HA LYS 53 HA LYS 53 4.292 0.432 11.364 457 HB2 LYS 53 2HB LYS 53 6.803 -0.672 10.049 458 HB3 LYS 53 3HB LYS 53 5.759 0.598 9.417 459 HG2 LYS 53 2HG LYS 53 7.688 0.729 11.745 460 HG3 LYS 53 3HG LYS 53 7.617 1.755 10.310 461 HD2 LYS 53 2HD LYS 53 5.447 2.707 11.166 462 HD3 LYS 53 3HD LYS 53 5.638 1.738 12.629 463 HE2 LYS 53 2HE LYS 53 7.433 3.994 11.688 464 HE3 LYS 53 3HE LYS 53 6.356 3.997 13.085 465 HZ1 LYS 53 3HZ LYS 53 7.745 2.196 14.035 466 HZ2 LYS 53 1HZ LYS 53 8.587 3.644 13.811 467 HZ3 LYS 53 2HZ LYS 53 8.814 2.362 12.735 468 H ILE 54 H ILE 54 2.720 -0.191 10.001 469 HA ILE 54 HA ILE 54 2.408 -3.092 9.488 470 HB ILE 54 HB ILE 54 0.225 -0.964 9.780 471 HG12 ILE 54 2HG1 ILE 54 1.317 -1.425 11.969 472 HG13 ILE 54 3HG1 ILE 54 -0.341 -2.006 11.951 473 HG21 ILE 54 1HG2 ILE 54 -1.374 -2.861 9.792 474 HG22 ILE 54 2HG2 ILE 54 -0.045 -3.983 9.488 475 HG23 ILE 54 3HG2 ILE 54 -0.476 -2.776 8.275 476 HD11 ILE 54 3HD1 ILE 54 1.129 -3.544 13.087 477 HD12 ILE 54 1HD1 ILE 54 2.136 -3.697 11.650 478 HD13 ILE 54 2HD1 ILE 54 0.473 -4.295 11.631 479 H LEU 55 H LEU 55 2.224 -3.686 7.445 480 HA LEU 55 HA LEU 55 1.949 -1.704 5.268 481 HB2 LEU 55 2HB LEU 55 4.003 -3.194 5.454 482 HB3 LEU 55 3HB LEU 55 2.975 -4.576 5.132 483 HG LEU 55 HG LEU 55 3.099 -2.291 3.130 484 HD11 LEU 55 1HD1 LEU 55 4.950 -3.370 1.957 485 HD12 LEU 55 2HD1 LEU 55 5.108 -4.550 3.263 486 HD13 LEU 55 3HD1 LEU 55 5.431 -2.839 3.566 487 HD21 LEU 55 3HD2 LEU 55 2.672 -5.267 2.739 488 HD22 LEU 55 1HD2 LEU 55 2.624 -4.025 1.480 489 HD23 LEU 55 2HD2 LEU 55 1.405 -4.037 2.751 490 H ILE 56 H ILE 56 0.072 -1.754 4.084 491 HA ILE 56 HA ILE 56 -1.814 -4.024 4.445 492 HB ILE 56 HB ILE 56 -2.543 -1.117 3.843 493 HG12 ILE 56 2HG1 ILE 56 -1.766 -1.401 6.229 494 HG13 ILE 56 3HG1 ILE 56 -3.441 -0.885 6.097 495 HG21 ILE 56 1HG2 ILE 56 -4.351 -3.503 4.391 496 HG22 ILE 56 2HG2 ILE 56 -4.142 -2.682 2.845 497 HG23 ILE 56 3HG2 ILE 56 -4.898 -1.833 4.192 498 HD11 ILE 56 3HD1 ILE 56 -4.178 -3.162 6.585 499 HD12 ILE 56 1HD1 ILE 56 -3.144 -2.509 7.853 500 HD13 ILE 56 2HD1 ILE 56 -2.492 -3.679 6.706 501 H ILE 57 H ILE 57 -2.228 -5.075 2.612 502 HA ILE 57 HA ILE 57 -1.795 -3.848 -0.037 503 HB ILE 57 HB ILE 57 -1.731 -6.809 0.747 504 HG12 ILE 57 2HG1 ILE 57 0.464 -4.948 -0.290 505 HG13 ILE 57 3HG1 ILE 57 0.329 -5.579 1.345 506 HG21 ILE 57 1HG2 ILE 57 -1.431 -5.603 -2.036 507 HG22 ILE 57 2HG2 ILE 57 -2.807 -6.547 -1.466 508 HG23 ILE 57 3HG2 ILE 57 -1.227 -7.309 -1.623 509 HD11 ILE 57 3HD1 ILE 57 2.043 -6.737 0.129 510 HD12 ILE 57 1HD1 ILE 57 0.904 -7.191 -1.138 511 HD13 ILE 57 2HD1 ILE 57 0.719 -7.842 0.495 512 H SER 58 H SER 58 -3.515 -3.732 -1.383 513 HA SER 58 HA SER 58 -5.993 -5.232 -0.825 514 HB2 SER 58 2HB SER 58 -6.303 -2.931 0.093 515 HB3 SER 58 3HB SER 58 -5.875 -2.243 -1.476 516 HG SER 58 HG SER 58 -7.875 -2.522 -2.032 517 H ASN 59 H ASN 59 -6.517 -6.332 -2.620 518 HA ASN 59 HA ASN 59 -5.148 -5.885 -5.138 519 HB2 ASN 59 2HB ASN 59 -7.325 -7.902 -4.438 520 HB3 ASN 59 3HB ASN 59 -6.415 -7.872 -5.948 521 HD21 ASN 59 1HD2 ASN 59 -5.519 -9.879 -5.707 522 HD22 ASN 59 2HD2 ASN 59 -4.366 -10.274 -4.489 523 H ASP 60 H ASP 60 -7.924 -4.621 -3.768 524 HA ASP 60 HA ASP 60 -9.175 -4.021 -6.380 525 HB2 ASP 60 2HB ASP 60 -10.593 -5.357 -4.807 526 HB3 ASP 60 3HB ASP 60 -10.450 -4.080 -3.605 527 H LYS 61 H LYS 61 -9.308 -1.964 -6.948 528 HA LYS 61 HA LYS 61 -7.662 -0.048 -5.618 529 HB2 LYS 61 2HB LYS 61 -9.328 0.077 -8.154 530 HB3 LYS 61 3HB LYS 61 -8.347 1.424 -7.585 531 HG2 LYS 61 2HG LYS 61 -6.332 -0.091 -7.672 532 HG3 LYS 61 3HG LYS 61 -7.356 -1.317 -8.431 533 HD2 LYS 61 2HD LYS 61 -7.787 0.172 -10.331 534 HD3 LYS 61 3HD LYS 61 -6.885 1.477 -9.553 535 HE2 LYS 61 2HE LYS 61 -5.515 0.417 -11.284 536 HE3 LYS 61 3HE LYS 61 -4.817 0.108 -9.692 537 HZ1 LYS 61 3HZ LYS 61 -5.777 -2.083 -9.719 538 HZ2 LYS 61 1HZ LYS 61 -4.836 -1.859 -11.103 539 HZ3 LYS 61 2HZ LYS 61 -6.520 -1.790 -11.206 540 H GLN 62 H GLN 62 -11.144 -0.581 -5.734 541 HA GLN 62 HA GLN 62 -11.874 2.035 -4.752 542 HB2 GLN 62 2HB GLN 62 -13.570 0.710 -5.934 543 HB3 GLN 62 3HB GLN 62 -13.434 -0.588 -4.757 544 HG2 GLN 62 2HG GLN 62 -15.476 0.670 -4.337 545 HG3 GLN 62 3HG GLN 62 -14.358 0.923 -2.999 546 HE21 GLN 62 1HE2 GLN 62 -13.406 2.987 -2.738 547 HE22 GLN 62 2HE2 GLN 62 -14.023 4.384 -3.537 548 H LEU 63 H LEU 63 -11.239 -1.177 -3.314 549 HA LEU 63 HA LEU 63 -11.784 -0.499 -0.616 550 HB2 LEU 63 2HB LEU 63 -9.972 -2.642 -1.794 551 HB3 LEU 63 3HB LEU 63 -10.363 -2.525 -0.084 552 HG LEU 63 HG LEU 63 -12.328 -3.120 -2.333 553 HD11 LEU 63 1HD1 LEU 63 -10.844 -4.999 -1.839 554 HD12 LEU 63 2HD1 LEU 63 -12.493 -5.347 -1.327 555 HD13 LEU 63 3HD1 LEU 63 -11.272 -4.914 -0.127 556 HD21 LEU 63 3HD2 LEU 63 -13.436 -1.817 -0.591 557 HD22 LEU 63 1HD2 LEU 63 -12.849 -2.925 0.653 558 HD23 LEU 63 2HD2 LEU 63 -13.999 -3.484 -0.566 559 H LEU 64 H LEU 64 -8.938 -0.153 -2.675 560 HA LEU 64 HA LEU 64 -7.073 0.601 -0.687 561 HB2 LEU 64 2HB LEU 64 -6.387 -0.066 -2.923 562 HB3 LEU 64 3HB LEU 64 -7.209 1.306 -3.638 563 HG LEU 64 HG LEU 64 -5.005 1.886 -1.641 564 HD11 LEU 64 1HD1 LEU 64 -4.452 1.057 -4.489 565 HD12 LEU 64 2HD1 LEU 64 -4.000 0.173 -3.028 566 HD13 LEU 64 3HD1 LEU 64 -3.286 1.747 -3.359 567 HD21 LEU 64 3HD2 LEU 64 -4.552 3.818 -3.105 568 HD22 LEU 64 1HD2 LEU 64 -6.239 3.794 -2.601 569 HD23 LEU 64 2HD2 LEU 64 -5.802 3.276 -4.229 570 H LYS 65 H LYS 65 -9.239 2.542 -2.776 571 HA LYS 65 HA LYS 65 -8.526 5.088 -1.846 572 HB2 LYS 65 2HB LYS 65 -11.046 4.023 -3.158 573 HB3 LYS 65 3HB LYS 65 -10.924 5.713 -2.664 574 HG2 LYS 65 2HG LYS 65 -8.919 5.984 -4.101 575 HG3 LYS 65 3HG LYS 65 -9.074 4.305 -4.622 576 HD2 LYS 65 2HD LYS 65 -9.982 5.964 -6.267 577 HD3 LYS 65 3HD LYS 65 -11.165 4.767 -5.741 578 HE2 LYS 65 2HE LYS 65 -12.024 7.145 -5.909 579 HE3 LYS 65 3HE LYS 65 -12.290 6.367 -4.352 580 HZ1 LYS 65 3HZ LYS 65 -11.500 8.691 -4.225 581 HZ2 LYS 65 1HZ LYS 65 -10.038 8.216 -4.921 582 HZ3 LYS 65 2HZ LYS 65 -10.498 7.603 -3.407 583 H GLU 66 H GLU 66 -11.231 2.980 -0.794 584 HA GLU 66 HA GLU 66 -12.303 4.563 1.219 585 HB2 GLU 66 2HB GLU 66 -12.089 1.519 1.161 586 HB3 GLU 66 3HB GLU 66 -13.143 2.428 2.239 587 HG2 GLU 66 2HG GLU 66 -13.338 2.286 -0.777 588 HG3 GLU 66 3HG GLU 66 -14.391 1.479 0.383 589 H MET 67 H MET 67 -9.741 2.102 1.383 590 HA MET 67 HA MET 67 -9.114 2.042 4.061 591 HB2 MET 67 2HB MET 67 -8.175 0.574 2.201 592 HB3 MET 67 3HB MET 67 -7.072 1.880 1.798 593 HG2 MET 67 2HG MET 67 -5.817 0.363 3.114 594 HG3 MET 67 3HG MET 67 -6.205 1.689 4.208 595 HE1 MET 67 3HE MET 67 -8.238 -2.469 4.281 596 HE2 MET 67 1HE MET 67 -6.894 -2.047 3.224 597 HE3 MET 67 2HE MET 67 -8.488 -1.336 2.952 598 H LEU 68 H LEU 68 -7.619 4.139 1.559 599 HA LEU 68 HA LEU 68 -5.838 5.517 3.270 600 HB2 LEU 68 2HB LEU 68 -6.963 6.319 0.559 601 HB3 LEU 68 3HB LEU 68 -5.652 7.169 1.371 602 HG LEU 68 HG LEU 68 -5.577 4.298 0.367 603 HD11 LEU 68 1HD1 LEU 68 -4.087 6.758 -0.580 604 HD12 LEU 68 2HD1 LEU 68 -5.417 5.951 -1.418 605 HD13 LEU 68 3HD1 LEU 68 -3.886 5.111 -1.193 606 HD21 LEU 68 3HD2 LEU 68 -3.436 5.875 1.833 607 HD22 LEU 68 1HD2 LEU 68 -3.208 4.300 1.061 608 HD23 LEU 68 2HD2 LEU 68 -4.299 4.455 2.431 609 H GLU 69 H GLU 69 -9.085 6.341 2.125 610 HA GLU 69 HA GLU 69 -9.129 8.995 3.212 611 HB2 GLU 69 2HB GLU 69 -11.382 7.229 2.144 612 HB3 GLU 69 3HB GLU 69 -11.532 8.956 2.494 613 HG2 GLU 69 2HG GLU 69 -9.788 9.454 0.804 614 HG3 GLU 69 3HG GLU 69 -9.621 7.731 0.476 615 H LEU 70 H LEU 70 -9.948 5.839 4.450 616 HA LEU 70 HA LEU 70 -11.103 6.806 6.922 617 HB2 LEU 70 2HB LEU 70 -10.155 4.097 5.955 618 HB3 LEU 70 3HB LEU 70 -10.726 4.336 7.598 619 HG LEU 70 HG LEU 70 -12.444 4.999 5.174 620 HD11 LEU 70 1HD1 LEU 70 -12.419 2.403 6.733 621 HD12 LEU 70 2HD1 LEU 70 -11.884 2.627 5.065 622 HD13 LEU 70 3HD1 LEU 70 -13.580 2.860 5.480 623 HD21 LEU 70 3HD2 LEU 70 -13.095 6.094 7.279 624 HD22 LEU 70 1HD2 LEU 70 -13.172 4.522 8.084 625 HD23 LEU 70 2HD2 LEU 70 -14.293 4.908 6.774 626 H ILE 71 H ILE 71 -7.851 5.843 5.830 627 HA ILE 71 HA ILE 71 -6.536 5.985 8.365 628 HB ILE 71 HB ILE 71 -5.360 6.401 5.565 629 HG12 ILE 71 2HG1 ILE 71 -5.173 3.931 7.354 630 HG13 ILE 71 3HG1 ILE 71 -6.350 4.110 6.063 631 HG21 ILE 71 1HG2 ILE 71 -3.872 7.452 7.194 632 HG22 ILE 71 2HG2 ILE 71 -3.133 5.955 6.629 633 HG23 ILE 71 3HG2 ILE 71 -3.907 6.010 8.211 634 HD11 ILE 71 3HD1 ILE 71 -4.542 4.227 4.417 635 HD12 ILE 71 1HD1 ILE 71 -4.485 2.738 5.360 636 HD13 ILE 71 2HD1 ILE 71 -3.352 4.043 5.710 637 H SER 72 H SER 72 -7.551 8.369 6.004 638 HA SER 72 HA SER 72 -6.175 10.663 6.848 639 HB2 SER 72 2HB SER 72 -7.384 10.650 4.746 640 HB3 SER 72 3HB SER 72 -8.907 10.298 5.557 641 HG SER 72 HG SER 72 -7.432 12.706 5.498 642 H LYS 73 H LYS 73 -9.062 9.060 8.098 643 HA LYS 73 HA LYS 73 -9.820 11.104 9.968 644 HB2 LYS 73 2HB LYS 73 -10.552 8.139 9.909 645 HB3 LYS 73 3HB LYS 73 -11.369 9.382 10.860 646 HG2 LYS 73 2HG LYS 73 -12.063 10.518 8.775 647 HG3 LYS 73 3HG LYS 73 -11.263 9.258 7.825 648 HD2 LYS 73 2HD LYS 73 -12.802 7.562 8.743 649 HD3 LYS 73 3HD LYS 73 -13.567 8.786 9.766 650 HE2 LYS 73 2HE LYS 73 -14.251 10.009 7.686 651 HE3 LYS 73 3HE LYS 73 -13.599 8.674 6.732 652 HZ1 LYS 73 3HZ LYS 73 -15.178 7.195 7.795 653 HZ2 LYS 73 1HZ LYS 73 -15.976 8.478 7.037 654 HZ3 LYS 73 2HZ LYS 73 -15.798 8.468 8.719 655 H LEU 74 H LEU 74 -7.533 8.516 9.962 656 HA LEU 74 HA LEU 74 -7.209 8.352 12.863 657 HB2 LEU 74 2HB LEU 74 -5.856 6.904 10.550 658 HB3 LEU 74 3HB LEU 74 -5.519 6.584 12.244 659 HG LEU 74 HG LEU 74 -8.248 6.175 10.949 660 HD11 LEU 74 1HD1 LEU 74 -6.625 4.615 9.988 661 HD12 LEU 74 2HD1 LEU 74 -7.776 3.767 11.017 662 HD13 LEU 74 3HD1 LEU 74 -6.140 4.088 11.602 663 HD21 LEU 74 3HD2 LEU 74 -8.409 6.611 13.347 664 HD22 LEU 74 1HD2 LEU 74 -7.207 5.360 13.688 665 HD23 LEU 74 2HD2 LEU 74 -8.778 4.923 13.010 666 H GLY 75 H GLY 75 -5.531 9.698 10.049 667 HA2 GLY 75 2HA GLY 75 -3.920 11.317 9.895 668 HA3 GLY 75 3HA GLY 75 -3.882 11.428 11.645 669 H TYR 76 H TYR 76 -2.930 9.181 9.023 670 HA TYR 76 HA TYR 76 -0.272 8.818 10.325 671 HB2 TYR 76 2HB TYR 76 -1.763 6.669 8.742 672 HB3 TYR 76 3HB TYR 76 -0.163 6.501 9.451 673 HD1 TYR 76 HD1 TYR 76 -0.401 7.462 12.176 674 HD2 TYR 76 HD2 TYR 76 -3.247 5.256 9.886 675 HE1 TYR 76 HE1 TYR 76 -1.413 6.596 14.238 676 HE2 TYR 76 HE2 TYR 76 -4.251 4.408 11.947 677 HH TYR 76 HH TYR 76 -3.645 5.789 14.951 678 H LYS 77 H LYS 77 1.532 8.818 8.987 679 HA LYS 77 HA LYS 77 1.261 9.937 6.327 680 HB2 LYS 77 2HB LYS 77 3.132 10.696 7.747 681 HB3 LYS 77 3HB LYS 77 3.762 9.055 7.842 682 HG2 LYS 77 2HG LYS 77 5.033 10.446 6.232 683 HG3 LYS 77 3HG LYS 77 4.270 9.063 5.443 684 HD2 LYS 77 2HD LYS 77 2.446 10.548 4.626 685 HD3 LYS 77 3HD LYS 77 3.220 11.927 5.413 686 HE2 LYS 77 2HE LYS 77 4.456 10.266 3.185 687 HE3 LYS 77 3HE LYS 77 3.676 11.837 2.976 688 HZ1 LYS 77 3HZ LYS 77 6.026 12.133 3.094 689 HZ2 LYS 77 1HZ LYS 77 6.135 11.276 4.544 690 HZ3 LYS 77 2HZ LYS 77 5.352 12.774 4.504 691 H VAL 78 H VAL 78 0.638 8.647 4.774 692 HA VAL 78 HA VAL 78 1.316 5.795 4.716 693 HB VAL 78 HB VAL 78 -0.624 7.329 2.918 694 HG11 VAL 78 1HG1 VAL 78 0.176 5.243 1.883 695 HG12 VAL 78 2HG1 VAL 78 -1.510 5.070 2.366 696 HG13 VAL 78 3HG1 VAL 78 -0.239 4.337 3.342 697 HG21 VAL 78 3HG2 VAL 78 -2.427 6.360 4.311 698 HG22 VAL 78 1HG2 VAL 78 -1.377 7.417 5.260 699 HG23 VAL 78 2HG2 VAL 78 -1.218 5.664 5.394 700 H PHE 79 H PHE 79 2.627 4.928 3.247 701 HA PHE 79 HA PHE 79 3.637 6.518 0.958 702 HB2 PHE 79 2HB PHE 79 4.814 4.100 2.414 703 HB3 PHE 79 3HB PHE 79 5.498 4.807 0.958 704 HD1 PHE 79 HD2 PHE 79 4.771 5.473 4.559 705 HD2 PHE 79 HD1 PHE 79 6.912 6.740 1.072 706 HE1 PHE 79 HE2 PHE 79 6.084 7.039 5.913 707 HE2 PHE 79 HE1 PHE 79 8.220 8.294 2.449 708 HZ PHE 79 HZ PHE 79 7.808 8.441 4.864 709 H LEU 80 H LEU 80 2.589 5.945 -0.875 710 HA LEU 80 HA LEU 80 1.197 3.346 -0.995 711 HB2 LEU 80 2HB LEU 80 -0.255 5.316 -1.123 712 HB3 LEU 80 3HB LEU 80 0.650 5.933 -2.497 713 HG LEU 80 HG LEU 80 -0.132 4.054 -3.907 714 HD11 LEU 80 1HD1 LEU 80 -1.769 2.423 -3.138 715 HD12 LEU 80 2HD1 LEU 80 -1.691 3.081 -1.501 716 HD13 LEU 80 3HD1 LEU 80 -0.278 2.298 -2.214 717 HD21 LEU 80 3HD2 LEU 80 -2.420 5.431 -2.478 718 HD22 LEU 80 1HD2 LEU 80 -2.523 4.608 -4.040 719 HD23 LEU 80 2HD2 LEU 80 -1.519 6.043 -3.866 720 H LEU 81 H LEU 81 1.856 1.876 -2.359 721 HA LEU 81 HA LEU 81 3.399 2.563 -4.776 722 HB2 LEU 81 2HB LEU 81 4.630 1.139 -3.132 723 HB3 LEU 81 3HB LEU 81 3.350 -0.056 -3.206 724 HG LEU 81 HG LEU 81 3.884 -0.559 -5.558 725 HD11 LEU 81 1HD1 LEU 81 5.978 1.621 -5.352 726 HD12 LEU 81 2HD1 LEU 81 4.532 1.621 -6.365 727 HD13 LEU 81 3HD1 LEU 81 5.828 0.477 -6.690 728 HD21 LEU 81 3HD2 LEU 81 6.102 -1.568 -5.281 729 HD22 LEU 81 1HD2 LEU 81 5.118 -1.795 -3.837 730 HD23 LEU 81 2HD2 LEU 81 6.393 -0.573 -3.849 731 H LEU 82 H LEU 82 2.008 2.566 -6.435 732 HA LEU 82 HA LEU 82 -0.197 0.625 -6.584 733 HB2 LEU 82 2HB LEU 82 0.462 3.103 -8.226 734 HB3 LEU 82 3HB LEU 82 -0.877 2.022 -8.583 735 HG LEU 82 HG LEU 82 -0.581 3.718 -6.073 736 HD11 LEU 82 1HD1 LEU 82 -2.498 3.991 -8.405 737 HD12 LEU 82 2HD1 LEU 82 -1.130 5.046 -8.047 738 HD13 LEU 82 3HD1 LEU 82 -2.493 4.976 -6.936 739 HD21 LEU 82 3HD2 LEU 82 -2.850 2.958 -5.501 740 HD22 LEU 82 1HD2 LEU 82 -1.707 1.619 -5.544 741 HD23 LEU 82 2HD2 LEU 82 -2.837 1.856 -6.883 742 H GLN 83 H GLN 83 0.429 -1.251 -7.454 743 HA GLN 83 HA GLN 83 2.228 -1.319 -9.792 744 HB2 GLN 83 2HB GLN 83 2.726 -2.878 -7.857 745 HB3 GLN 83 3HB GLN 83 1.172 -3.659 -8.130 746 HG2 GLN 83 2HG GLN 83 1.947 -4.246 -10.456 747 HG3 GLN 83 3HG GLN 83 3.533 -3.589 -10.050 748 HE21 GLN 83 1HE2 GLN 83 2.884 -6.279 -10.863 749 HE22 GLN 83 2HE2 GLN 83 3.374 -7.325 -9.585 750 H ASP 84 H ASP 84 1.162 -1.203 -11.677 751 HA ASP 84 HA ASP 84 -1.063 -2.980 -12.246 752 HB2 ASP 84 2HB ASP 84 -2.178 -0.935 -11.274 753 HB3 ASP 84 3HB ASP 84 -1.445 0.044 -12.537 754 H GLN 85 H GLN 85 -0.878 -3.660 -14.347 755 HA GLN 85 HA GLN 85 1.532 -2.874 -15.736 756 HB2 GLN 85 2HB GLN 85 -0.546 -4.995 -16.372 757 HB3 GLN 85 3HB GLN 85 0.972 -4.791 -17.245 758 HG2 GLN 85 2HG GLN 85 2.240 -5.303 -15.199 759 HG3 GLN 85 3HG GLN 85 0.736 -5.453 -14.290 760 HE21 GLN 85 1HE2 GLN 85 1.261 -7.618 -13.712 761 HE22 GLN 85 2HE2 GLN 85 1.135 -8.911 -14.851 762 H ASP 86 H ASP 86 -1.757 -1.971 -15.997 763 HA ASP 86 HA ASP 86 -1.506 -1.057 -18.797 764 HB2 ASP 86 2HB ASP 86 -3.951 -1.022 -16.952 765 HB3 ASP 86 3HB ASP 86 -3.940 -0.595 -18.663 766 H GLU 87 H GLU 87 -0.163 0.702 -18.619 767 HA GLU 87 HA GLU 87 0.032 2.288 -16.298 768 HB2 GLU 87 2HB GLU 87 1.191 2.775 -19.057 769 HB3 GLU 87 3HB GLU 87 1.626 3.686 -17.609 770 HG2 GLU 87 2HG GLU 87 2.358 1.508 -16.555 771 HG3 GLU 87 3HG GLU 87 2.104 0.733 -18.120 772 H ASN 88 H ASN 88 -2.108 2.666 -18.992 773 HA ASN 88 HA ASN 88 -2.627 5.462 -18.719 774 HB2 ASN 88 2HB ASN 88 -4.389 3.205 -19.783 775 HB3 ASN 88 3HB ASN 88 -4.873 4.900 -19.799 776 HD21 ASN 88 1HD2 ASN 88 -5.014 4.901 -22.037 777 HD22 ASN 88 2HD2 ASN 88 -3.621 4.882 -23.056 778 H GLU 89 H GLU 89 -4.126 2.546 -17.345 779 HA GLU 89 HA GLU 89 -6.057 3.891 -15.728 780 HB2 GLU 89 2HB GLU 89 -4.918 1.087 -15.260 781 HB3 GLU 89 3HB GLU 89 -6.468 1.708 -14.700 782 HG2 GLU 89 2HG GLU 89 -5.672 1.060 -17.548 783 HG3 GLU 89 3HG GLU 89 -6.811 0.176 -16.537 784 H LEU 90 H LEU 90 -2.886 2.445 -15.129 785 HA LEU 90 HA LEU 90 -2.568 2.844 -12.404 786 HB2 LEU 90 2HB LEU 90 -1.095 1.413 -13.725 787 HB3 LEU 90 3HB LEU 90 -0.522 2.787 -14.654 788 HG LEU 90 HG LEU 90 0.650 3.682 -12.678 789 HD11 LEU 90 1HD1 LEU 90 -0.841 2.965 -10.917 790 HD12 LEU 90 2HD1 LEU 90 0.798 2.415 -10.584 791 HD13 LEU 90 3HD1 LEU 90 -0.407 1.272 -11.187 792 HD21 LEU 90 3HD2 LEU 90 1.340 0.761 -13.107 793 HD22 LEU 90 1HD2 LEU 90 2.406 2.012 -12.463 794 HD23 LEU 90 2HD2 LEU 90 1.857 2.099 -14.135 795 H GLU 91 H GLU 91 -1.831 5.050 -15.118 796 HA GLU 91 HA GLU 91 -0.420 7.002 -13.617 797 HB2 GLU 91 2HB GLU 91 -0.254 6.743 -16.106 798 HB3 GLU 91 3HB GLU 91 -1.903 7.337 -16.263 799 HG2 GLU 91 2HG GLU 91 -0.391 9.140 -16.784 800 HG3 GLU 91 3HG GLU 91 -1.179 9.504 -15.250 801 H GLU 92 H GLU 92 -3.751 6.900 -14.897 802 HA GLU 92 HA GLU 92 -4.714 9.331 -13.907 803 HB2 GLU 92 2HB GLU 92 -6.257 6.755 -14.454 804 HB3 GLU 92 3HB GLU 92 -6.990 8.349 -14.247 805 HG2 GLU 92 2HG GLU 92 -5.764 9.163 -16.235 806 HG3 GLU 92 3HG GLU 92 -5.036 7.580 -16.439 807 H PHE 93 H PHE 93 -4.814 6.095 -12.446 808 HA PHE 93 HA PHE 93 -6.301 6.789 -10.139 809 HB2 PHE 93 2HB PHE 93 -5.967 4.452 -11.107 810 HB3 PHE 93 3HB PHE 93 -4.348 4.456 -10.414 811 HD1 PHE 93 HD1 PHE 93 -7.789 5.407 -9.189 812 HD2 PHE 93 HD2 PHE 93 -4.241 3.110 -8.483 813 HE1 PHE 93 HE1 PHE 93 -8.739 4.563 -7.089 814 HE2 PHE 93 HE2 PHE 93 -5.206 2.285 -6.381 815 HZ PHE 93 HZ PHE 93 -7.451 3.010 -5.683 816 H LYS 94 H LYS 94 -2.832 6.738 -10.841 817 HA LYS 94 HA LYS 94 -1.776 7.095 -8.249 818 HB2 LYS 94 2HB LYS 94 -0.521 6.341 -10.305 819 HB3 LYS 94 3HB LYS 94 -0.571 7.984 -10.916 820 HG2 LYS 94 2HG LYS 94 0.735 7.339 -8.264 821 HG3 LYS 94 3HG LYS 94 1.601 7.098 -9.767 822 HD2 LYS 94 2HD LYS 94 0.530 9.748 -8.707 823 HD3 LYS 94 3HD LYS 94 2.220 9.240 -8.753 824 HE2 LYS 94 2HE LYS 94 2.016 9.099 -11.272 825 HE3 LYS 94 3HE LYS 94 0.420 9.839 -11.121 826 HZ1 LYS 94 3HZ LYS 94 1.514 11.734 -10.021 827 HZ2 LYS 94 1HZ LYS 94 2.029 11.508 -11.617 828 HZ3 LYS 94 2HZ LYS 94 3.019 11.029 -10.331 829 H ARG 95 H ARG 95 -2.400 9.477 -10.842 830 HA ARG 95 HA ARG 95 -1.502 11.728 -9.355 831 HB2 ARG 95 2HB ARG 95 -2.401 13.073 -11.251 832 HB3 ARG 95 3HB ARG 95 -1.371 11.743 -11.770 833 HG2 ARG 95 2HG ARG 95 -3.424 10.412 -12.289 834 HG3 ARG 95 3HG ARG 95 -4.402 11.820 -11.882 835 HD2 ARG 95 2HD ARG 95 -2.304 11.771 -14.082 836 HD3 ARG 95 3HD ARG 95 -4.029 11.486 -14.335 837 HE ARG 95 HE ARG 95 -3.402 13.991 -13.020 838 HH11 ARG 95 1HH1 ARG 95 -3.940 12.425 -16.137 839 HH12 ARG 95 2HH1 ARG 95 -4.337 13.909 -16.943 840 HH21 ARG 95 1HH2 ARG 95 -3.964 15.915 -14.090 841 HH22 ARG 95 2HH2 ARG 95 -4.357 15.887 -15.781 842 H LYS 96 H LYS 96 -4.646 10.195 -9.613 843 HA LYS 96 HA LYS 96 -6.240 12.318 -8.574 844 HB2 LYS 96 2HB LYS 96 -6.641 9.411 -9.148 845 HB3 LYS 96 3HB LYS 96 -7.626 10.007 -7.820 846 HG2 LYS 96 2HG LYS 96 -8.885 10.116 -9.884 847 HG3 LYS 96 3HG LYS 96 -8.575 11.746 -9.284 848 HD2 LYS 96 2HD LYS 96 -6.687 11.938 -10.939 849 HD3 LYS 96 3HD LYS 96 -7.126 10.346 -11.564 850 HE2 LYS 96 2HE LYS 96 -8.884 12.823 -11.606 851 HE3 LYS 96 3HE LYS 96 -8.037 12.121 -12.984 852 HZ1 LYS 96 3HZ LYS 96 -10.216 10.831 -11.435 853 HZ2 LYS 96 1HZ LYS 96 -9.378 10.115 -12.714 854 HZ3 LYS 96 2HZ LYS 96 -10.338 11.480 -12.995 855 H ILE 97 H ILE 97 -4.657 9.523 -7.051 856 HA ILE 97 HA ILE 97 -5.515 10.140 -4.365 857 HB ILE 97 HB ILE 97 -3.345 8.219 -5.328 858 HG12 ILE 97 2HG1 ILE 97 -6.238 7.567 -4.583 859 HG13 ILE 97 3HG1 ILE 97 -5.690 7.812 -6.239 860 HG21 ILE 97 1HG2 ILE 97 -3.657 7.093 -3.128 861 HG22 ILE 97 2HG2 ILE 97 -4.755 8.380 -2.635 862 HG23 ILE 97 3HG2 ILE 97 -3.057 8.742 -2.951 863 HD11 ILE 97 3HD1 ILE 97 -4.194 5.928 -6.055 864 HD12 ILE 97 1HD1 ILE 97 -5.850 5.470 -5.678 865 HD13 ILE 97 2HD1 ILE 97 -4.681 5.677 -4.375 866 H GLU 98 H GLU 98 -2.725 10.837 -6.336 867 HA GLU 98 HA GLU 98 -0.909 11.801 -4.392 868 HB2 GLU 98 2HB GLU 98 -0.621 11.209 -6.970 869 HB3 GLU 98 3HB GLU 98 -1.085 12.878 -7.243 870 HG2 GLU 98 2HG GLU 98 1.312 11.958 -5.623 871 HG3 GLU 98 3HG GLU 98 1.370 12.491 -7.299 872 H SER 99 H SER 99 -3.506 13.259 -6.325 873 HA SER 99 HA SER 99 -3.328 15.901 -5.285 874 HB2 SER 99 2HB SER 99 -4.373 15.380 -7.466 875 HB3 SER 99 3HB SER 99 -5.660 14.490 -6.651 876 HG SER 99 HG SER 99 -6.568 16.328 -6.055 877 H GLN 100 H GLN 100 -4.896 12.963 -4.105 878 HA GLN 100 HA GLN 100 -6.564 14.274 -2.134 879 HB2 GLN 100 2HB GLN 100 -5.720 11.355 -2.431 880 HB3 GLN 100 3HB GLN 100 -6.812 11.926 -1.171 881 HG2 GLN 100 2HG GLN 100 -8.401 12.690 -2.915 882 HG3 GLN 100 3HG GLN 100 -7.313 12.076 -4.156 883 HE21 GLN 100 1HE2 GLN 100 -9.528 11.177 -1.591 884 HE22 GLN 100 2HE2 GLN 100 -9.727 9.529 -2.069 885 H GLY 101 H GLY 101 -3.231 13.869 -2.327 886 HA2 GLY 101 2HA GLY 101 -1.787 14.958 -0.828 887 HA3 GLY 101 3HA GLY 101 -2.967 14.774 0.461 888 H TYR 102 H TYR 102 -1.424 12.440 -1.748 889 HA TYR 102 HA TYR 102 -0.177 11.040 0.541 890 HB2 TYR 102 2HB TYR 102 -1.756 9.660 -1.693 891 HB3 TYR 102 3HB TYR 102 -0.795 8.822 -0.476 892 HD1 TYR 102 HD1 TYR 102 -1.519 8.936 1.976 893 HD2 TYR 102 HD2 TYR 102 -3.988 10.405 -1.196 894 HE1 TYR 102 HE1 TYR 102 -3.459 8.966 3.487 895 HE2 TYR 102 HE2 TYR 102 -5.917 10.431 0.317 896 HH TYR 102 HH TYR 102 -5.616 10.140 3.671 897 H GLU 103 H GLU 103 1.806 10.147 0.141 898 HA GLU 103 HA GLU 103 3.245 10.915 -2.251 899 HB2 GLU 103 2HB GLU 103 4.366 10.932 -0.016 900 HB3 GLU 103 3HB GLU 103 4.157 9.186 0.100 901 HG2 GLU 103 2HG GLU 103 5.582 8.905 -1.928 902 HG3 GLU 103 3HG GLU 103 5.842 10.648 -1.971 903 H VAL 104 H VAL 104 2.536 9.803 -4.021 904 HA VAL 104 HA VAL 104 2.145 6.870 -3.858 905 HB VAL 104 HB VAL 104 1.029 8.677 -6.057 906 HG11 VAL 104 1HG1 VAL 104 -0.514 6.774 -6.429 907 HG12 VAL 104 2HG1 VAL 104 0.267 5.884 -5.122 908 HG13 VAL 104 3HG1 VAL 104 1.173 6.274 -6.583 909 HG21 VAL 104 3HG2 VAL 104 -1.151 8.667 -4.874 910 HG22 VAL 104 1HG2 VAL 104 0.090 9.485 -3.920 911 HG23 VAL 104 2HG2 VAL 104 -0.405 7.844 -3.500 912 H ARG 105 H ARG 105 3.250 5.553 -5.184 913 HA ARG 105 HA ARG 105 4.999 6.625 -7.338 914 HB2 ARG 105 2HB ARG 105 6.214 5.784 -5.300 915 HB3 ARG 105 3HB ARG 105 5.455 4.217 -5.517 916 HG2 ARG 105 2HG ARG 105 7.622 3.954 -6.373 917 HG3 ARG 105 3HG ARG 105 6.622 4.138 -7.808 918 HD2 ARG 105 2HD ARG 105 7.407 6.382 -8.165 919 HD3 ARG 105 3HD ARG 105 8.132 6.460 -6.559 920 HE ARG 105 HE ARG 105 9.251 5.227 -8.942 921 HH11 ARG 105 1HH1 ARG 105 9.507 5.461 -5.426 922 HH12 ARG 105 2HH1 ARG 105 11.148 4.895 -5.402 923 HH21 ARG 105 1HH2 ARG 105 11.397 4.446 -8.850 924 HH22 ARG 105 2HH2 ARG 105 12.207 4.318 -7.316 925 H LYS 106 H LYS 106 5.028 5.366 -9.241 926 HA LYS 106 HA LYS 106 2.974 3.277 -9.618 927 HB2 LYS 106 2HB LYS 106 4.735 4.798 -11.600 928 HB3 LYS 106 3HB LYS 106 3.585 3.547 -12.061 929 HG2 LYS 106 2HG LYS 106 1.709 4.905 -11.386 930 HG3 LYS 106 3HG LYS 106 2.774 6.105 -10.644 931 HD2 LYS 106 2HD LYS 106 1.921 6.892 -12.833 932 HD3 LYS 106 3HD LYS 106 3.674 6.720 -12.848 933 HE2 LYS 106 2HE LYS 106 3.392 4.514 -14.020 934 HE3 LYS 106 3HE LYS 106 1.653 4.813 -14.077 935 HZ1 LYS 106 3HZ LYS 106 2.118 6.836 -15.355 936 HZ2 LYS 106 1HZ LYS 106 2.663 5.442 -16.138 937 HZ3 LYS 106 2HZ LYS 106 3.768 6.458 -15.360 938 H VAL 107 H VAL 107 3.560 1.241 -10.554 939 HA VAL 107 HA VAL 107 6.179 0.731 -11.576 940 HB VAL 107 HB VAL 107 6.575 0.346 -9.108 941 HG11 VAL 107 1HG1 VAL 107 5.700 -1.650 -7.977 942 HG12 VAL 107 2HG1 VAL 107 4.693 -2.018 -9.379 943 HG13 VAL 107 3HG1 VAL 107 4.396 -0.553 -8.443 944 HG21 VAL 107 3HG2 VAL 107 7.814 -1.777 -9.359 945 HG22 VAL 107 1HG2 VAL 107 8.026 -0.726 -10.760 946 HG23 VAL 107 2HG2 VAL 107 6.940 -2.114 -10.857 947 H THR 108 H THR 108 6.201 -1.108 -12.892 948 HA THR 108 HA THR 108 3.626 -2.521 -13.337 949 HB THR 108 HB THR 108 4.468 -2.809 -15.734 950 HG1 THR 108 HG1 THR 108 6.658 -2.334 -15.452 951 HG21 THR 108 3HG2 THR 108 4.025 0.054 -14.810 952 HG22 THR 108 1HG2 THR 108 2.752 -1.103 -15.216 953 HG23 THR 108 2HG2 THR 108 3.857 -0.528 -16.466 954 H ASP 109 H ASP 109 7.148 -2.790 -13.121 955 HA ASP 109 HA ASP 109 7.281 -5.593 -13.826 956 HB2 ASP 109 2HB ASP 109 9.353 -3.741 -12.556 957 HB3 ASP 109 3HB ASP 109 9.679 -5.377 -13.125 958 H ASP 110 H ASP 110 7.358 -7.320 -12.414 959 HA ASP 110 HA ASP 110 6.520 -6.952 -9.681 960 HB2 ASP 110 2HB ASP 110 6.410 -9.336 -9.521 961 HB3 ASP 110 3HB ASP 110 5.820 -8.919 -11.118 962 H GLU 111 H GLU 111 9.544 -7.632 -11.368 963 HA GLU 111 HA GLU 111 11.170 -8.338 -9.162 964 HB2 GLU 111 2HB GLU 111 13.092 -7.831 -10.637 965 HB3 GLU 111 3HB GLU 111 11.883 -8.788 -11.479 966 HG2 GLU 111 2HG GLU 111 11.116 -6.862 -12.733 967 HG3 GLU 111 3HG GLU 111 12.118 -5.774 -11.778 968 H GLU 112 H GLU 112 10.336 -5.274 -10.677 969 HA GLU 112 HA GLU 112 12.138 -3.677 -9.082 970 HB2 GLU 112 2HB GLU 112 11.525 -3.130 -11.490 971 HB3 GLU 112 3HB GLU 112 9.918 -2.686 -10.919 972 HG2 GLU 112 2HG GLU 112 10.962 -0.947 -9.445 973 HG3 GLU 112 3HG GLU 112 12.539 -1.365 -10.121 974 H ALA 113 H ALA 113 8.718 -4.575 -9.057 975 HA ALA 113 HA ALA 113 7.566 -2.705 -7.373 976 HB1 ALA 113 3HB ALA 113 5.941 -4.456 -6.754 977 HB2 ALA 113 1HB ALA 113 7.011 -5.698 -7.406 978 HB3 ALA 113 2HB ALA 113 6.288 -4.501 -8.485 979 H LEU 114 H LEU 114 9.309 -5.671 -6.528 980 HA LEU 114 HA LEU 114 9.194 -5.515 -3.712 981 HB2 LEU 114 2HB LEU 114 11.409 -6.776 -5.386 982 HB3 LEU 114 3HB LEU 114 11.016 -7.157 -3.715 983 HG LEU 114 HG LEU 114 9.320 -7.797 -6.160 984 HD11 LEU 114 1HD1 LEU 114 10.836 -9.623 -4.273 985 HD12 LEU 114 2HD1 LEU 114 11.262 -9.247 -5.944 986 HD13 LEU 114 3HD1 LEU 114 9.788 -10.140 -5.599 987 HD21 LEU 114 3HD2 LEU 114 7.852 -7.257 -4.281 988 HD22 LEU 114 1HD2 LEU 114 8.714 -8.401 -3.248 989 HD23 LEU 114 2HD2 LEU 114 7.795 -8.979 -4.642 990 H LYS 115 H LYS 115 11.486 -4.208 -6.083 991 HA LYS 115 HA LYS 115 13.449 -3.271 -4.215 992 HB2 LYS 115 2HB LYS 115 13.047 -2.390 -7.111 993 HB3 LYS 115 3HB LYS 115 14.487 -2.120 -6.141 994 HG2 LYS 115 2HG LYS 115 13.465 -4.757 -7.227 995 HG3 LYS 115 3HG LYS 115 14.908 -3.885 -7.724 996 HD2 LYS 115 2HD LYS 115 15.990 -5.361 -6.339 997 HD3 LYS 115 3HD LYS 115 15.478 -4.269 -5.051 998 HE2 LYS 115 2HE LYS 115 13.439 -5.709 -4.742 999 HE3 LYS 115 3HE LYS 115 14.088 -6.814 -5.951 1000 HZ1 LYS 115 3HZ LYS 115 14.537 -7.535 -3.696 1001 HZ2 LYS 115 1HZ LYS 115 15.408 -6.119 -3.391 1002 HZ3 LYS 115 2HZ LYS 115 15.973 -7.228 -4.536 1003 H ILE 116 H ILE 116 10.474 -1.866 -5.509 1004 HA ILE 116 HA ILE 116 11.135 0.834 -4.669 1005 HB ILE 116 HB ILE 116 8.341 -0.175 -5.381 1006 HG12 ILE 116 2HG1 ILE 116 9.779 -0.663 -7.316 1007 HG13 ILE 116 3HG1 ILE 116 8.722 0.681 -7.698 1008 HG21 ILE 116 1HG2 ILE 116 7.902 2.205 -5.905 1009 HG22 ILE 116 2HG2 ILE 116 9.545 2.623 -5.416 1010 HG23 ILE 116 3HG2 ILE 116 8.401 1.996 -4.227 1011 HD11 ILE 116 3HD1 ILE 116 10.918 1.035 -8.600 1012 HD12 ILE 116 1HD1 ILE 116 11.657 0.839 -7.013 1013 HD13 ILE 116 2HD1 ILE 116 10.612 2.227 -7.337 1014 H VAL 117 H VAL 117 9.461 -1.979 -3.320 1015 HA VAL 117 HA VAL 117 8.174 -0.745 -1.126 1016 HB VAL 117 HB VAL 117 9.336 -3.575 -1.122 1017 HG11 VAL 117 1HG1 VAL 117 7.566 -4.057 0.554 1018 HG12 VAL 117 2HG1 VAL 117 7.076 -2.362 0.524 1019 HG13 VAL 117 3HG1 VAL 117 8.676 -2.809 1.120 1020 HG21 VAL 117 3HG2 VAL 117 6.578 -2.686 -2.046 1021 HG22 VAL 117 1HG2 VAL 117 7.110 -4.364 -1.867 1022 HG23 VAL 117 2HG2 VAL 117 7.867 -3.320 -3.065 1023 H ARG 118 H ARG 118 11.491 -2.058 -1.513 1024 HA ARG 118 HA ARG 118 12.299 -1.623 1.183 1025 HB2 ARG 118 2HB ARG 118 14.515 -2.200 0.577 1026 HB3 ARG 118 3HB ARG 118 13.483 -3.191 -0.446 1027 HG2 ARG 118 2HG ARG 118 13.915 -1.745 -2.357 1028 HG3 ARG 118 3HG ARG 118 14.839 -0.625 -1.355 1029 HD2 ARG 118 2HD ARG 118 15.586 -3.498 -1.997 1030 HD3 ARG 118 3HD ARG 118 16.325 -2.048 -2.680 1031 HE ARG 118 HE ARG 118 16.458 -2.168 0.195 1032 HH11 ARG 118 1HH1 ARG 118 18.117 -3.143 -2.762 1033 HH12 ARG 118 2HH1 ARG 118 19.654 -3.306 -1.973 1034 HH21 ARG 118 1HH2 ARG 118 18.459 -2.409 1.199 1035 HH22 ARG 118 2HH2 ARG 118 19.845 -2.886 0.271 1036 H GLU 119 H GLU 119 12.141 0.494 -1.629 1037 HA GLU 119 HA GLU 119 13.736 2.622 -0.667 1038 HB2 GLU 119 2HB GLU 119 11.356 2.622 -2.562 1039 HB3 GLU 119 3HB GLU 119 12.250 4.086 -2.156 1040 HG2 GLU 119 2HG GLU 119 14.328 2.933 -3.045 1041 HG3 GLU 119 3HG GLU 119 13.264 1.659 -3.655 1042 H PHE 120 H PHE 120 10.198 2.059 -0.497 1043 HA PHE 120 HA PHE 120 9.510 4.252 1.086 1044 HB2 PHE 120 2HB PHE 120 8.167 1.535 0.836 1045 HB3 PHE 120 3HB PHE 120 7.451 2.894 1.705 1046 HD1 PHE 120 HD2 PHE 120 7.824 5.219 0.136 1047 HD2 PHE 120 HD1 PHE 120 7.074 1.225 -1.226 1048 HE1 PHE 120 HE2 PHE 120 6.812 6.103 -1.915 1049 HE2 PHE 120 HE1 PHE 120 6.077 2.138 -3.272 1050 HZ PHE 120 HZ PHE 120 5.933 4.559 -3.602 1051 H MET 121 H MET 121 10.468 0.986 2.084 1052 HA MET 121 HA MET 121 10.084 1.379 4.865 1053 HB2 MET 121 2HB MET 121 11.808 -0.644 3.377 1054 HB3 MET 121 3HB MET 121 11.488 -0.698 5.108 1055 HG2 MET 121 2HG MET 121 9.031 -0.861 4.586 1056 HG3 MET 121 3HG MET 121 9.452 -1.002 2.880 1057 HE1 MET 121 3HE MET 121 11.251 -4.475 2.747 1058 HE2 MET 121 1HE MET 121 12.022 -2.893 2.837 1059 HE3 MET 121 2HE MET 121 10.611 -3.131 1.801 1060 H GLN 122 H GLN 122 12.792 2.109 2.726 1061 HA GLN 122 HA GLN 122 14.662 2.800 4.813 1062 HB2 GLN 122 2HB GLN 122 15.397 2.054 2.561 1063 HB3 GLN 122 3HB GLN 122 14.668 3.482 1.834 1064 HG2 GLN 122 2HG GLN 122 16.277 4.930 2.926 1065 HG3 GLN 122 3HG GLN 122 16.916 3.586 3.864 1066 HE21 GLN 122 1HE2 GLN 122 18.275 2.079 2.839 1067 HE22 GLN 122 2HE2 GLN 122 19.033 2.418 1.323 1068 H LYS 123 H LYS 123 12.402 4.630 2.745 1069 HA LYS 123 HA LYS 123 13.349 7.243 3.424 1070 HB2 LYS 123 2HB LYS 123 10.837 6.279 1.998 1071 HB3 LYS 123 3HB LYS 123 11.200 7.988 2.231 1072 HG2 LYS 123 2HG LYS 123 13.261 7.754 0.905 1073 HG3 LYS 123 3HG LYS 123 12.947 6.027 0.695 1074 HD2 LYS 123 2HD LYS 123 10.949 6.484 -0.614 1075 HD3 LYS 123 3HD LYS 123 11.058 8.213 -0.271 1076 HE2 LYS 123 2HE LYS 123 11.839 7.776 -2.539 1077 HE3 LYS 123 3HE LYS 123 13.195 8.303 -1.545 1078 HZ1 LYS 123 3HZ LYS 123 12.581 5.523 -2.375 1079 HZ2 LYS 123 1HZ LYS 123 13.807 5.948 -1.290 1080 HZ3 LYS 123 2HZ LYS 123 13.871 6.479 -2.890 1081 H ALA 124 H ALA 124 10.489 5.339 4.343 1082 HA ALA 124 HA ALA 124 9.317 6.958 6.257 1083 HB1 ALA 124 3HB ALA 124 8.309 4.868 5.458 1084 HB2 ALA 124 1HB ALA 124 8.384 4.893 7.225 1085 HB3 ALA 124 2HB ALA 124 9.541 3.931 6.301 1086 H GLY 125 H GLY 125 12.202 4.977 6.438 1087 HA2 GLY 125 2HA GLY 125 12.632 4.834 9.203 1088 HA3 GLY 125 3HA GLY 125 13.880 4.755 7.973 1089 H SER 126 H SER 126 13.233 7.497 6.949 1090 HA SER 126 HA SER 126 14.929 9.027 8.668 1091 HB2 SER 126 2HB SER 126 14.883 9.307 6.194 1092 HB3 SER 126 3HB SER 126 13.229 9.909 6.289 1093 HG SER 126 HG SER 126 15.572 11.088 7.369 1094 H LEU 127 H LEU 127 11.442 8.826 8.075 1095 HA LEU 127 HA LEU 127 10.680 11.109 9.653 1096 HB2 LEU 127 2HB LEU 127 9.010 8.758 8.678 1097 HB3 LEU 127 3HB LEU 127 8.359 10.221 9.408 1098 HG LEU 127 HG LEU 127 9.794 10.020 6.730 1099 HD11 LEU 127 1HD1 LEU 127 7.635 10.712 5.789 1100 HD12 LEU 127 2HD1 LEU 127 6.915 10.695 7.402 1101 HD13 LEU 127 3HD1 LEU 127 7.500 9.195 6.676 1102 HD21 LEU 127 3HD2 LEU 127 8.733 12.497 8.135 1103 HD22 LEU 127 1HD2 LEU 127 9.330 12.432 6.471 1104 HD23 LEU 127 2HD2 LEU 127 10.426 12.119 7.810 1105 H GLU 128 H GLU 128 10.949 7.647 10.187 1106 HA GLU 128 HA GLU 128 9.941 7.493 12.832 1107 HB2 GLU 128 2HB GLU 128 12.011 5.776 11.386 1108 HB3 GLU 128 3HB GLU 128 11.270 5.347 12.928 1109 HG2 GLU 128 2HG GLU 128 9.090 5.145 11.877 1110 HG3 GLU 128 3HG GLU 128 9.736 5.730 10.342 1111 H HIS 129 H HIS 129 12.909 8.672 11.467 1112 HA HIS 129 HA HIS 129 15.012 9.086 12.154 1113 HB2 HIS 129 2HB HIS 129 13.815 9.458 14.942 1114 HB3 HIS 129 3HB HIS 129 15.361 10.079 14.377 1115 HD1 HIS 129 HD1 HIS 129 15.336 12.355 13.242 1116 HD2 HIS 129 HD2 HIS 129 11.528 10.793 13.794 1117 HE1 HIS 129 HE1 HIS 129 13.749 14.214 12.685 1118 HE2 HIS 129 HE2 HIS 129 11.479 13.299 13.217 1119 H HIS 130 H HIS 130 14.311 6.572 11.806 1120 HA HIS 130 HA HIS 130 14.817 4.693 13.857 1121 HB2 HIS 130 2HB HIS 130 13.416 4.370 11.727 1122 HB3 HIS 130 3HB HIS 130 14.918 4.251 10.831 1123 HD1 HIS 130 HD1 HIS 130 12.744 2.030 10.990 1124 HD2 HIS 130 HD2 HIS 130 16.224 2.100 13.269 1125 HE1 HIS 130 HE1 HIS 130 13.194 -0.351 11.618 1126 HE2 HIS 130 HE2 HIS 130 15.237 -0.271 13.071 1127 H HIS 131 H HIS 131 16.814 5.441 14.722 1128 HA HIS 131 HA HIS 131 19.175 5.656 13.069 1129 HB2 HIS 131 2HB HIS 131 18.651 6.085 16.019 1130 HB3 HIS 131 3HB HIS 131 20.301 6.021 15.401 1131 HD1 HIS 131 HD1 HIS 131 20.696 7.725 13.263 1132 HD2 HIS 131 HD2 HIS 131 17.604 8.627 15.885 1133 HE1 HIS 131 HE1 HIS 131 20.170 10.145 12.883 1134 HE2 HIS 131 HE2 HIS 131 18.150 10.579 14.297 1135 H HIS 132 H HIS 132 19.173 3.622 12.233 1136 HA HIS 132 HA HIS 132 20.936 1.804 13.644 1137 HB2 HIS 132 2HB HIS 132 18.571 0.905 14.036 1138 HB3 HIS 132 3HB HIS 132 18.389 0.760 12.292 1139 HD1 HIS 132 HD1 HIS 132 19.862 -0.917 15.247 1140 HD2 HIS 132 HD2 HIS 132 19.999 -1.327 11.113 1141 HE1 HIS 132 HE1 HIS 132 20.788 -3.207 14.818 1142 HE2 HIS 132 HE2 HIS 132 20.829 -3.447 12.319 1143 H HIS 133 H HIS 133 22.545 2.273 12.260 1144 HA HIS 133 HA HIS 133 22.298 3.186 9.657 1145 HB2 HIS 133 2HB HIS 133 24.809 2.659 9.460 1146 HB3 HIS 133 3HB HIS 133 24.308 3.748 10.741 1147 HD1 HIS 133 HD1 HIS 133 24.734 3.042 13.139 1148 HD2 HIS 133 HD2 HIS 133 25.793 0.123 10.379 1149 HE1 HIS 133 HE1 HIS 133 26.075 1.357 14.414 1150 HE2 HIS 133 HE2 HIS 133 26.564 -0.469 12.766 1151 H HIS 134 H HIS 134 21.061 2.020 8.353 1152 HA HIS 134 HA HIS 134 21.997 -0.185 6.865 1153 HB2 HIS 134 2HB HIS 134 21.415 -1.491 8.920 1154 HB3 HIS 134 3HB HIS 134 19.782 -0.834 8.886 1155 HD1 HIS 134 HD1 HIS 134 18.110 -1.894 7.227 1156 HD2 HIS 134 HD2 HIS 134 21.945 -3.472 6.951 1157 HE1 HIS 134 HE1 HIS 134 17.901 -3.935 5.780 1158 HE2 HIS 134 HE2 HIS 134 20.256 -4.778 5.521 Start of MODEL 12 1 H1 MET 1 1H MET 1 3.151 5.442 17.557 2 H2 MET 1 2H MET 1 2.237 6.178 16.349 3 H3 MET 1 3H MET 1 3.200 7.119 17.365 4 HA MET 1 HA MET 1 4.236 6.919 15.251 5 HB2 MET 1 2HB MET 1 5.676 6.980 17.282 6 HB3 MET 1 3HB MET 1 5.644 5.224 17.369 7 HG2 MET 1 2HG MET 1 6.830 5.100 15.200 8 HG3 MET 1 3HG MET 1 6.867 6.861 15.120 9 HE1 MET 1 3HE MET 1 7.437 7.521 18.278 10 HE2 MET 1 1HE MET 1 8.236 8.372 16.956 11 HE3 MET 1 2HE MET 1 9.194 7.655 18.250 12 H LYS 2 H LYS 2 3.288 5.758 13.574 13 HA LYS 2 HA LYS 2 4.472 3.257 12.944 14 HB2 LYS 2 2HB LYS 2 2.569 1.787 12.875 15 HB3 LYS 2 3HB LYS 2 2.633 2.487 14.481 16 HG2 LYS 2 2HG LYS 2 0.856 4.197 13.340 17 HG3 LYS 2 3HG LYS 2 0.556 2.777 12.342 18 HD2 LYS 2 2HD LYS 2 0.178 3.101 15.331 19 HD3 LYS 2 3HD LYS 2 -1.025 2.671 14.118 20 HE2 LYS 2 2HE LYS 2 1.234 0.927 15.156 21 HE3 LYS 2 3HE LYS 2 -0.490 0.713 15.445 22 HZ1 LYS 2 3HZ LYS 2 -0.745 0.332 13.035 23 HZ2 LYS 2 1HZ LYS 2 0.225 -0.819 13.807 24 HZ3 LYS 2 2HZ LYS 2 0.940 0.389 12.873 25 H ILE 3 H ILE 3 4.846 3.374 10.845 26 HA ILE 3 HA ILE 3 3.294 5.208 9.137 27 HB ILE 3 HB ILE 3 6.083 4.015 8.780 28 HG12 ILE 3 2HG1 ILE 3 5.143 6.865 9.376 29 HG13 ILE 3 3HG1 ILE 3 5.929 5.783 10.515 30 HG21 ILE 3 1HG2 ILE 3 4.606 5.939 6.944 31 HG22 ILE 3 2HG2 ILE 3 5.021 4.263 6.574 32 HG23 ILE 3 3HG2 ILE 3 6.299 5.463 6.778 33 HD11 ILE 3 3HD1 ILE 3 7.178 6.992 8.054 34 HD12 ILE 3 1HD1 ILE 3 7.972 5.874 9.169 35 HD13 ILE 3 2HD1 ILE 3 7.454 7.461 9.731 36 H LEU 4 H LEU 4 2.289 4.478 7.257 37 HA LEU 4 HA LEU 4 1.792 1.567 7.213 38 HB2 LEU 4 2HB LEU 4 -0.061 3.817 6.334 39 HB3 LEU 4 3HB LEU 4 -0.453 2.103 6.388 40 HG LEU 4 HG LEU 4 0.042 3.928 8.781 41 HD11 LEU 4 1HD1 LEU 4 -2.123 4.269 7.742 42 HD12 LEU 4 2HD1 LEU 4 -2.312 3.490 9.309 43 HD13 LEU 4 3HD1 LEU 4 -2.476 2.541 7.828 44 HD21 LEU 4 3HD2 LEU 4 -0.570 0.951 8.802 45 HD22 LEU 4 1HD2 LEU 4 -0.533 2.010 10.216 46 HD23 LEU 4 2HD2 LEU 4 0.942 1.713 9.302 47 H ILE 5 H ILE 5 2.679 0.597 5.506 48 HA ILE 5 HA ILE 5 3.105 2.044 2.977 49 HB ILE 5 HB ILE 5 3.935 -0.824 3.642 50 HG12 ILE 5 2HG1 ILE 5 5.030 0.677 5.279 51 HG13 ILE 5 3HG1 ILE 5 6.216 0.045 4.146 52 HG21 ILE 5 1HG2 ILE 5 3.881 -0.336 1.240 53 HG22 ILE 5 2HG2 ILE 5 5.550 -0.525 1.777 54 HG23 ILE 5 3HG2 ILE 5 4.898 1.089 1.477 55 HD11 ILE 5 3HD1 ILE 5 6.651 2.359 4.631 56 HD12 ILE 5 1HD1 ILE 5 5.022 2.815 4.135 57 HD13 ILE 5 2HD1 ILE 5 6.171 2.200 2.942 58 H LEU 6 H LEU 6 1.251 2.094 1.789 59 HA LEU 6 HA LEU 6 -0.687 -0.128 1.857 60 HB2 LEU 6 2HB LEU 6 -1.110 2.560 1.925 61 HB3 LEU 6 3HB LEU 6 -1.087 2.373 0.192 62 HG LEU 6 HG LEU 6 -3.374 2.359 0.835 63 HD11 LEU 6 1HD1 LEU 6 -2.682 -0.561 0.424 64 HD12 LEU 6 2HD1 LEU 6 -2.932 0.646 -0.838 65 HD13 LEU 6 3HD1 LEU 6 -4.272 0.182 0.206 66 HD21 LEU 6 3HD2 LEU 6 -3.077 2.017 3.227 67 HD22 LEU 6 1HD2 LEU 6 -2.756 0.300 2.968 68 HD23 LEU 6 2HD2 LEU 6 -4.343 0.975 2.592 69 H ILE 7 H ILE 7 -0.742 -1.579 0.140 70 HA ILE 7 HA ILE 7 0.581 -0.887 -2.417 71 HB ILE 7 HB ILE 7 1.035 -3.492 -0.872 72 HG12 ILE 7 2HG1 ILE 7 2.975 -1.239 -1.576 73 HG13 ILE 7 3HG1 ILE 7 2.369 -1.618 0.031 74 HG21 ILE 7 1HG2 ILE 7 2.098 -2.710 -3.615 75 HG22 ILE 7 2HG2 ILE 7 0.880 -3.944 -3.292 76 HG23 ILE 7 3HG2 ILE 7 2.533 -4.172 -2.722 77 HD11 ILE 7 3HD1 ILE 7 3.540 -3.758 -0.039 78 HD12 ILE 7 1HD1 ILE 7 4.624 -2.383 -0.237 79 HD13 ILE 7 2HD1 ILE 7 4.176 -3.354 -1.638 80 H ASN 8 H ASN 8 -0.622 -1.414 -4.128 81 HA ASN 8 HA ASN 8 -2.701 -3.518 -3.961 82 HB2 ASN 8 2HB ASN 8 -3.673 -1.241 -4.254 83 HB3 ASN 8 3HB ASN 8 -2.692 -0.988 -5.687 84 HD21 ASN 8 1HD2 ASN 8 -3.211 -2.203 -7.590 85 HD22 ASN 8 2HD2 ASN 8 -4.774 -2.903 -7.806 86 H THR 9 H THR 9 -1.941 -5.249 -5.035 87 HA THR 9 HA THR 9 -0.450 -4.849 -7.566 88 HB THR 9 HB THR 9 1.225 -5.565 -6.005 89 HG1 THR 9 HG1 THR 9 1.899 -6.830 -7.531 90 HG21 THR 9 3HG2 THR 9 -0.177 -6.502 -4.211 91 HG22 THR 9 1HG2 THR 9 1.087 -7.642 -4.678 92 HG23 THR 9 2HG2 THR 9 -0.572 -7.890 -5.229 93 H ASN 10 H ASN 10 -0.865 -6.295 -9.222 94 HA ASN 10 HA ASN 10 -3.496 -7.435 -9.310 95 HB2 ASN 10 2HB ASN 10 -1.277 -7.851 -11.357 96 HB3 ASN 10 3HB ASN 10 -3.015 -7.929 -11.628 97 HD21 ASN 10 1HD2 ASN 10 -4.196 -5.928 -11.746 98 HD22 ASN 10 2HD2 ASN 10 -3.382 -4.441 -12.078 99 H ASN 11 H ASN 11 -0.376 -8.574 -8.486 100 HA ASN 11 HA ASN 11 -0.953 -11.392 -9.189 101 HB2 ASN 11 2HB ASN 11 1.717 -9.945 -8.907 102 HB3 ASN 11 3HB ASN 11 1.534 -11.659 -9.278 103 HD21 ASN 11 1HD2 ASN 11 2.756 -9.473 -10.840 104 HD22 ASN 11 2HD2 ASN 11 1.958 -9.487 -12.369 105 H ASP 12 H ASP 12 -1.135 -12.812 -7.638 106 HA ASP 12 HA ASP 12 -0.657 -12.415 -4.873 107 HB2 ASP 12 2HB ASP 12 -0.900 -15.047 -6.397 108 HB3 ASP 12 3HB ASP 12 -1.020 -14.861 -4.649 109 H GLU 13 H GLU 13 1.410 -13.355 -7.501 110 HA GLU 13 HA GLU 13 3.549 -14.522 -6.058 111 HB2 GLU 13 2HB GLU 13 3.659 -12.926 -8.652 112 HB3 GLU 13 3HB GLU 13 4.931 -13.981 -8.040 113 HG2 GLU 13 2HG GLU 13 2.177 -14.805 -8.991 114 HG3 GLU 13 3HG GLU 13 3.710 -15.115 -9.798 115 H LEU 14 H LEU 14 2.796 -11.149 -6.947 116 HA LEU 14 HA LEU 14 5.146 -10.084 -5.682 117 HB2 LEU 14 2HB LEU 14 2.721 -8.860 -6.992 118 HB3 LEU 14 3HB LEU 14 3.693 -7.851 -5.934 119 HG LEU 14 HG LEU 14 4.439 -7.483 -8.192 120 HD11 LEU 14 1HD1 LEU 14 6.165 -7.504 -6.435 121 HD12 LEU 14 2HD1 LEU 14 6.799 -7.968 -8.006 122 HD13 LEU 14 3HD1 LEU 14 6.505 -9.204 -6.784 123 HD21 LEU 14 3HD2 LEU 14 5.331 -9.246 -9.658 124 HD22 LEU 14 1HD2 LEU 14 3.637 -9.535 -9.263 125 HD23 LEU 14 2HD2 LEU 14 4.898 -10.476 -8.465 126 H ILE 15 H ILE 15 1.837 -10.713 -4.637 127 HA ILE 15 HA ILE 15 1.879 -9.403 -2.150 128 HB ILE 15 HB ILE 15 0.542 -12.029 -2.952 129 HG12 ILE 15 2HG1 ILE 15 -0.578 -9.204 -2.650 130 HG13 ILE 15 3HG1 ILE 15 -0.268 -10.034 -4.170 131 HG21 ILE 15 1HG2 ILE 15 0.810 -12.044 -0.503 132 HG22 ILE 15 2HG2 ILE 15 -0.886 -11.848 -0.940 133 HG23 ILE 15 3HG2 ILE 15 0.049 -10.454 -0.395 134 HD11 ILE 15 3HD1 ILE 15 -2.614 -10.039 -3.681 135 HD12 ILE 15 1HD1 ILE 15 -2.334 -10.783 -2.108 136 HD13 ILE 15 2HD1 ILE 15 -1.999 -11.688 -3.587 137 H LYS 16 H LYS 16 2.813 -12.797 -2.907 138 HA LYS 16 HA LYS 16 3.595 -13.427 -0.269 139 HB2 LYS 16 2HB LYS 16 4.439 -15.531 -1.180 140 HB3 LYS 16 3HB LYS 16 2.887 -15.134 -1.910 141 HG2 LYS 16 2HG LYS 16 4.110 -14.272 -3.920 142 HG3 LYS 16 3HG LYS 16 5.619 -14.820 -3.191 143 HD2 LYS 16 2HD LYS 16 4.834 -16.438 -4.851 144 HD3 LYS 16 3HD LYS 16 4.787 -17.158 -3.240 145 HE2 LYS 16 2HE LYS 16 2.371 -16.855 -3.130 146 HE3 LYS 16 3HE LYS 16 2.376 -15.954 -4.648 147 HZ1 LYS 16 3HZ LYS 16 3.152 -18.813 -4.362 148 HZ2 LYS 16 1HZ LYS 16 3.072 -17.938 -5.811 149 HZ3 LYS 16 2HZ LYS 16 1.662 -18.254 -4.934 150 H LYS 17 H LYS 17 5.475 -12.242 -3.059 151 HA LYS 17 HA LYS 17 8.047 -12.679 -1.896 152 HB2 LYS 17 2HB LYS 17 7.176 -10.910 -4.208 153 HB3 LYS 17 3HB LYS 17 8.858 -11.116 -3.719 154 HG2 LYS 17 2HG LYS 17 8.682 -13.555 -4.161 155 HG3 LYS 17 3HG LYS 17 7.013 -13.323 -4.694 156 HD2 LYS 17 2HD LYS 17 8.497 -13.444 -6.641 157 HD3 LYS 17 3HD LYS 17 7.813 -11.820 -6.512 158 HE2 LYS 17 2HE LYS 17 9.928 -11.053 -5.433 159 HE3 LYS 17 3HE LYS 17 10.600 -12.669 -5.647 160 HZ1 LYS 17 3HZ LYS 17 10.417 -12.405 -8.023 161 HZ2 LYS 17 1HZ LYS 17 11.316 -11.132 -7.371 162 HZ3 LYS 17 2HZ LYS 17 9.714 -10.880 -7.844 163 H ILE 18 H ILE 18 6.050 -9.709 -2.248 164 HA ILE 18 HA ILE 18 7.855 -7.935 -0.986 165 HB ILE 18 HB ILE 18 4.842 -7.788 -1.414 166 HG12 ILE 18 2HG1 ILE 18 7.131 -6.264 -2.761 167 HG13 ILE 18 3HG1 ILE 18 6.321 -7.668 -3.443 168 HG21 ILE 18 1HG2 ILE 18 4.902 -5.400 -0.796 169 HG22 ILE 18 2HG2 ILE 18 6.585 -5.567 -0.297 170 HG23 ILE 18 3HG2 ILE 18 5.319 -6.431 0.576 171 HD11 ILE 18 3HD1 ILE 18 4.219 -6.391 -3.546 172 HD12 ILE 18 1HD1 ILE 18 5.519 -5.643 -4.473 173 HD13 ILE 18 2HD1 ILE 18 5.062 -4.975 -2.906 174 H LYS 19 H LYS 19 5.323 -10.051 0.334 175 HA LYS 19 HA LYS 19 5.313 -9.112 2.991 176 HB2 LYS 19 2HB LYS 19 4.666 -11.864 1.869 177 HB3 LYS 19 3HB LYS 19 4.429 -11.432 3.563 178 HG2 LYS 19 2HG LYS 19 2.875 -9.626 2.881 179 HG3 LYS 19 3HG LYS 19 3.097 -10.084 1.193 180 HD2 LYS 19 2HD LYS 19 1.011 -11.029 1.999 181 HD3 LYS 19 3HD LYS 19 2.156 -12.342 1.714 182 HE2 LYS 19 2HE LYS 19 2.609 -12.508 4.113 183 HE3 LYS 19 3HE LYS 19 1.583 -11.106 4.430 184 HZ1 LYS 19 3HZ LYS 19 0.670 -13.710 3.333 185 HZ2 LYS 19 1HZ LYS 19 -0.311 -12.356 3.594 186 HZ3 LYS 19 2HZ LYS 19 0.413 -13.140 4.901 187 H LYS 20 H LYS 20 7.445 -11.456 1.367 188 HA LYS 20 HA LYS 20 8.834 -12.341 3.709 189 HB2 LYS 20 2HB LYS 20 9.691 -12.348 0.777 190 HB3 LYS 20 3HB LYS 20 10.591 -13.139 2.064 191 HG2 LYS 20 2HG LYS 20 7.792 -13.856 1.134 192 HG3 LYS 20 3HG LYS 20 9.275 -14.754 0.794 193 HD2 LYS 20 2HD LYS 20 9.541 -15.168 3.251 194 HD3 LYS 20 3HD LYS 20 8.004 -14.344 3.533 195 HE2 LYS 20 2HE LYS 20 8.406 -16.899 1.934 196 HE3 LYS 20 3HE LYS 20 7.685 -16.767 3.538 197 HZ1 LYS 20 3HZ LYS 20 5.886 -15.471 2.596 198 HZ2 LYS 20 1HZ LYS 20 6.012 -16.962 1.811 199 HZ3 LYS 20 2HZ LYS 20 6.582 -15.563 1.057 200 H GLU 21 H GLU 21 9.662 -10.025 1.143 201 HA GLU 21 HA GLU 21 12.010 -8.918 1.942 202 HB2 GLU 21 2HB GLU 21 9.643 -7.255 0.967 203 HB3 GLU 21 3HB GLU 21 11.335 -6.777 0.891 204 HG2 GLU 21 2HG GLU 21 9.997 -9.004 -0.666 205 HG3 GLU 21 3HG GLU 21 10.532 -7.453 -1.300 206 H VAL 22 H VAL 22 8.803 -7.912 3.118 207 HA VAL 22 HA VAL 22 9.928 -5.873 4.872 208 HB VAL 22 HB VAL 22 7.666 -5.111 5.228 209 HG11 VAL 22 1HG1 VAL 22 6.947 -4.676 2.909 210 HG12 VAL 22 2HG1 VAL 22 8.001 -5.962 2.327 211 HG13 VAL 22 3HG1 VAL 22 8.692 -4.523 3.071 212 HG21 VAL 22 3HG2 VAL 22 5.673 -6.299 4.328 213 HG22 VAL 22 1HG2 VAL 22 6.502 -7.233 5.577 214 HG23 VAL 22 2HG2 VAL 22 6.706 -7.662 3.879 215 H GLU 23 H GLU 23 8.793 -9.150 5.205 216 HA GLU 23 HA GLU 23 8.197 -9.112 7.997 217 HB2 GLU 23 2HB GLU 23 7.453 -10.933 6.496 218 HB3 GLU 23 3HB GLU 23 9.124 -11.426 6.246 219 HG2 GLU 23 2HG GLU 23 8.029 -12.933 7.809 220 HG3 GLU 23 3HG GLU 23 9.300 -12.036 8.635 221 H ASN 24 H ASN 24 11.136 -9.724 6.121 222 HA ASN 24 HA ASN 24 12.899 -10.288 8.290 223 HB2 ASN 24 2HB ASN 24 13.517 -9.177 5.511 224 HB3 ASN 24 3HB ASN 24 14.719 -9.821 6.628 225 HD21 ASN 24 1HD2 ASN 24 14.020 -10.672 3.924 226 HD22 ASN 24 2HD2 ASN 24 13.585 -12.339 4.032 227 H GLN 25 H GLN 25 11.518 -7.353 7.080 228 HA GLN 25 HA GLN 25 13.493 -5.594 8.372 229 HB2 GLN 25 2HB GLN 25 11.055 -4.768 6.732 230 HB3 GLN 25 3HB GLN 25 12.434 -3.768 7.180 231 HG2 GLN 25 2HG GLN 25 12.475 -6.106 5.266 232 HG3 GLN 25 3HG GLN 25 12.499 -4.410 4.818 233 HE21 GLN 25 1HE2 GLN 25 14.362 -7.074 6.064 234 HE22 GLN 25 2HE2 GLN 25 15.906 -6.313 5.943 235 H GLY 26 H GLY 26 10.715 -7.209 9.292 236 HA2 GLY 26 2HA GLY 26 9.272 -7.042 11.042 237 HA3 GLY 26 3HA GLY 26 10.196 -5.671 11.626 238 H TYR 27 H TYR 27 7.792 -6.582 9.181 239 HA TYR 27 HA TYR 27 6.134 -4.232 9.857 240 HB2 TYR 27 2HB TYR 27 6.975 -5.022 7.021 241 HB3 TYR 27 3HB TYR 27 5.526 -4.076 7.324 242 HD1 TYR 27 HD2 TYR 27 9.245 -4.036 7.679 243 HD2 TYR 27 HD1 TYR 27 5.665 -1.698 7.662 244 HE1 TYR 27 HE2 TYR 27 10.588 -1.982 7.668 245 HE2 TYR 27 HE1 TYR 27 7.015 0.357 7.646 246 HH TYR 27 HH TYR 27 10.393 0.365 7.082 247 H GLN 28 H GLN 28 4.265 -5.123 10.584 248 HA GLN 28 HA GLN 28 3.355 -7.745 9.872 249 HB2 GLN 28 2HB GLN 28 1.986 -5.465 11.342 250 HB3 GLN 28 3HB GLN 28 1.207 -7.017 11.072 251 HG2 GLN 28 2HG GLN 28 3.036 -8.112 12.365 252 HG3 GLN 28 3HG GLN 28 3.719 -6.522 12.701 253 HE21 GLN 28 1HE2 GLN 28 2.764 -8.482 14.613 254 HE22 GLN 28 2HE2 GLN 28 1.500 -7.728 15.516 255 H VAL 29 H VAL 29 2.698 -8.132 7.829 256 HA VAL 29 HA VAL 29 1.245 -6.227 6.212 257 HB VAL 29 HB VAL 29 1.726 -9.203 5.700 258 HG11 VAL 29 1HG1 VAL 29 0.792 -7.024 3.779 259 HG12 VAL 29 2HG1 VAL 29 -0.186 -8.367 4.381 260 HG13 VAL 29 3HG1 VAL 29 1.193 -8.684 3.330 261 HG21 VAL 29 3HG2 VAL 29 3.537 -8.469 4.197 262 HG22 VAL 29 1HG2 VAL 29 3.839 -7.956 5.859 263 HG23 VAL 29 2HG2 VAL 29 3.259 -6.790 4.665 264 H ARG 30 H ARG 30 -0.924 -6.109 5.911 265 HA ARG 30 HA ARG 30 -2.729 -8.145 7.100 266 HB2 ARG 30 2HB ARG 30 -3.282 -5.151 6.795 267 HB3 ARG 30 3HB ARG 30 -4.350 -6.338 7.534 268 HG2 ARG 30 2HG ARG 30 -1.658 -5.436 8.615 269 HG3 ARG 30 3HG ARG 30 -3.238 -4.943 9.222 270 HD2 ARG 30 2HD ARG 30 -3.710 -7.251 9.926 271 HD3 ARG 30 3HD ARG 30 -2.163 -7.783 9.256 272 HE ARG 30 HE ARG 30 -1.028 -6.746 11.006 273 HH11 ARG 30 1HH1 ARG 30 -4.506 -6.271 11.378 274 HH12 ARG 30 2HH1 ARG 30 -4.364 -5.768 13.040 275 HH21 ARG 30 1HH2 ARG 30 -0.874 -6.060 13.167 276 HH22 ARG 30 2HH2 ARG 30 -2.318 -5.653 14.040 277 H ASP 31 H ASP 31 -3.613 -9.236 5.451 278 HA ASP 31 HA ASP 31 -3.633 -8.113 2.738 279 HB2 ASP 31 2HB ASP 31 -4.164 -10.970 3.688 280 HB3 ASP 31 3HB ASP 31 -4.010 -10.453 2.009 281 H VAL 32 H VAL 32 -5.407 -7.265 1.977 282 HA VAL 32 HA VAL 32 -8.069 -7.857 3.128 283 HB VAL 32 HB VAL 32 -7.043 -5.143 2.135 284 HG11 VAL 32 1HG1 VAL 32 -9.191 -4.242 2.979 285 HG12 VAL 32 2HG1 VAL 32 -9.720 -5.875 3.390 286 HG13 VAL 32 3HG1 VAL 32 -9.447 -5.434 1.702 287 HG21 VAL 32 3HG2 VAL 32 -6.017 -5.742 4.297 288 HG22 VAL 32 1HG2 VAL 32 -7.615 -6.031 4.992 289 HG23 VAL 32 2HG2 VAL 32 -7.150 -4.403 4.488 290 H ASN 33 H ASN 33 -9.233 -8.847 1.629 291 HA ASN 33 HA ASN 33 -9.043 -8.084 -1.236 292 HB2 ASN 33 2HB ASN 33 -9.768 -10.767 0.017 293 HB3 ASN 33 3HB ASN 33 -9.890 -10.413 -1.704 294 HD21 ASN 33 1HD2 ASN 33 -8.013 -10.314 -2.940 295 HD22 ASN 33 2HD2 ASN 33 -6.477 -10.842 -2.356 296 H ASP 34 H ASP 34 -10.922 -7.681 1.443 297 HA ASP 34 HA ASP 34 -13.475 -7.579 -0.019 298 HB2 ASP 34 2HB ASP 34 -13.617 -9.769 0.945 299 HB3 ASP 34 3HB ASP 34 -12.883 -9.250 2.457 300 H SER 35 H SER 35 -14.893 -6.062 0.702 301 HA SER 35 HA SER 35 -14.073 -3.759 1.993 302 HB2 SER 35 2HB SER 35 -16.540 -3.193 2.012 303 HB3 SER 35 3HB SER 35 -15.952 -3.771 0.453 304 HG SER 35 HG SER 35 -16.686 -5.940 1.447 305 H ASP 36 H ASP 36 -15.851 -6.539 3.356 306 HA ASP 36 HA ASP 36 -16.430 -5.285 5.869 307 HB2 ASP 36 2HB ASP 36 -17.788 -7.136 4.844 308 HB3 ASP 36 3HB ASP 36 -16.469 -8.253 5.164 309 H GLU 37 H GLU 37 -13.780 -7.252 4.661 310 HA GLU 37 HA GLU 37 -12.457 -7.544 7.215 311 HB2 GLU 37 2HB GLU 37 -11.396 -7.974 4.399 312 HB3 GLU 37 3HB GLU 37 -10.584 -8.466 5.882 313 HG2 GLU 37 2HG GLU 37 -13.246 -9.517 4.874 314 HG3 GLU 37 3HG GLU 37 -11.705 -10.364 4.799 315 H LEU 38 H LEU 38 -12.373 -5.218 4.589 316 HA LEU 38 HA LEU 38 -10.197 -3.619 5.434 317 HB2 LEU 38 2HB LEU 38 -11.043 -3.260 3.257 318 HB3 LEU 38 3HB LEU 38 -12.697 -3.145 3.793 319 HG LEU 38 HG LEU 38 -10.769 -0.929 4.560 320 HD11 LEU 38 1HD1 LEU 38 -10.419 -1.226 2.150 321 HD12 LEU 38 2HD1 LEU 38 -11.281 0.270 2.492 322 HD13 LEU 38 3HD1 LEU 38 -12.162 -1.130 1.873 323 HD21 LEU 38 3HD2 LEU 38 -12.794 0.488 4.391 324 HD22 LEU 38 1HD2 LEU 38 -13.049 -0.847 5.517 325 HD23 LEU 38 2HD2 LEU 38 -13.743 -0.917 3.895 326 H LYS 39 H LYS 39 -13.648 -3.582 6.211 327 HA LYS 39 HA LYS 39 -13.782 -1.455 8.019 328 HB2 LYS 39 2HB LYS 39 -15.380 -4.049 7.943 329 HB3 LYS 39 3HB LYS 39 -15.826 -2.655 8.922 330 HG2 LYS 39 2HG LYS 39 -15.558 -2.542 5.904 331 HG3 LYS 39 3HG LYS 39 -17.067 -2.946 6.718 332 HD2 LYS 39 2HD LYS 39 -15.555 -0.339 7.163 333 HD3 LYS 39 3HD LYS 39 -16.855 -0.538 5.986 334 HE2 LYS 39 2HE LYS 39 -18.405 -1.167 7.826 335 HE3 LYS 39 3HE LYS 39 -17.103 -0.902 8.989 336 HZ1 LYS 39 3HZ LYS 39 -17.001 1.412 8.278 337 HZ2 LYS 39 1HZ LYS 39 -18.545 1.016 8.843 338 HZ3 LYS 39 2HZ LYS 39 -18.263 1.151 7.185 339 H LYS 40 H LYS 40 -12.627 -4.752 8.480 340 HA LYS 40 HA LYS 40 -12.411 -4.719 11.329 341 HB2 LYS 40 2HB LYS 40 -10.758 -6.355 9.351 342 HB3 LYS 40 3HB LYS 40 -10.922 -6.668 11.072 343 HG2 LYS 40 2HG LYS 40 -13.042 -6.984 8.940 344 HG3 LYS 40 3HG LYS 40 -12.220 -8.264 9.836 345 HD2 LYS 40 2HD LYS 40 -13.280 -7.301 11.952 346 HD3 LYS 40 3HD LYS 40 -14.242 -6.258 10.896 347 HE2 LYS 40 2HE LYS 40 -14.274 -9.287 11.030 348 HE3 LYS 40 3HE LYS 40 -15.587 -8.175 11.422 349 HZ1 LYS 40 3HZ LYS 40 -14.445 -8.702 8.732 350 HZ2 LYS 40 1HZ LYS 40 -15.588 -7.499 9.061 351 HZ3 LYS 40 2HZ LYS 40 -15.985 -9.123 9.285 352 H GLU 41 H GLU 41 -9.997 -4.284 8.691 353 HA GLU 41 HA GLU 41 -7.828 -4.173 10.531 354 HB2 GLU 41 2HB GLU 41 -7.833 -3.531 7.558 355 HB3 GLU 41 3HB GLU 41 -6.394 -3.761 8.552 356 HG2 GLU 41 2HG GLU 41 -8.469 -5.823 7.784 357 HG3 GLU 41 3HG GLU 41 -6.755 -5.810 7.384 358 H MET 42 H MET 42 -9.685 -1.625 8.993 359 HA MET 42 HA MET 42 -7.980 0.545 9.636 360 HB2 MET 42 2HB MET 42 -10.922 0.285 9.021 361 HB3 MET 42 3HB MET 42 -10.281 1.831 9.552 362 HG2 MET 42 2HG MET 42 -10.488 1.641 7.095 363 HG3 MET 42 3HG MET 42 -8.851 1.990 7.626 364 HE1 MET 42 3HE MET 42 -6.761 -0.786 6.209 365 HE2 MET 42 1HE MET 42 -6.995 -0.192 7.856 366 HE3 MET 42 2HE MET 42 -6.933 0.947 6.510 367 H LYS 43 H LYS 43 -10.491 -1.140 11.509 368 HA LYS 43 HA LYS 43 -10.395 0.567 13.816 369 HB2 LYS 43 2HB LYS 43 -11.272 -2.346 13.590 370 HB3 LYS 43 3HB LYS 43 -11.511 -1.332 15.010 371 HG2 LYS 43 2HG LYS 43 -12.968 0.172 13.651 372 HG3 LYS 43 3HG LYS 43 -12.758 -0.914 12.273 373 HD2 LYS 43 2HD LYS 43 -14.897 -1.379 13.391 374 HD3 LYS 43 3HD LYS 43 -13.812 -2.758 13.568 375 HE2 LYS 43 2HE LYS 43 -13.275 -2.044 15.871 376 HE3 LYS 43 3HE LYS 43 -14.327 -0.639 15.688 377 HZ1 LYS 43 3HZ LYS 43 -16.216 -2.104 15.459 378 HZ2 LYS 43 1HZ LYS 43 -15.397 -2.464 16.890 379 HZ3 LYS 43 2HZ LYS 43 -15.228 -3.470 15.546 380 H LYS 44 H LYS 44 -8.681 -2.360 12.767 381 HA LYS 44 HA LYS 44 -7.378 -2.964 15.188 382 HB2 LYS 44 2HB LYS 44 -6.442 -3.642 12.367 383 HB3 LYS 44 3HB LYS 44 -5.904 -4.416 13.852 384 HG2 LYS 44 2HG LYS 44 -8.631 -4.602 12.556 385 HG3 LYS 44 3HG LYS 44 -7.449 -5.893 12.769 386 HD2 LYS 44 2HD LYS 44 -8.995 -4.498 14.984 387 HD3 LYS 44 3HD LYS 44 -9.329 -6.102 14.342 388 HE2 LYS 44 2HE LYS 44 -7.167 -6.909 15.189 389 HE3 LYS 44 3HE LYS 44 -6.792 -5.291 15.798 390 HZ1 LYS 44 3HZ LYS 44 -7.633 -6.665 17.560 391 HZ2 LYS 44 1HZ LYS 44 -9.036 -7.019 16.689 392 HZ3 LYS 44 2HZ LYS 44 -8.753 -5.444 17.229 393 H LEU 45 H LEU 45 -6.382 -0.920 12.460 394 HA LEU 45 HA LEU 45 -3.785 -0.262 13.275 395 HB2 LEU 45 2HB LEU 45 -5.798 1.473 11.794 396 HB3 LEU 45 3HB LEU 45 -4.086 1.841 11.924 397 HG LEU 45 HG LEU 45 -5.286 -0.559 10.486 398 HD11 LEU 45 1HD1 LEU 45 -5.655 1.516 9.263 399 HD12 LEU 45 2HD1 LEU 45 -4.482 0.500 8.430 400 HD13 LEU 45 3HD1 LEU 45 -3.935 1.902 9.353 401 HD21 LEU 45 3HD2 LEU 45 -3.001 -1.053 9.719 402 HD22 LEU 45 1HD2 LEU 45 -3.140 -1.171 11.472 403 HD23 LEU 45 2HD2 LEU 45 -2.372 0.241 10.744 404 H ALA 46 H ALA 46 -6.859 0.894 14.473 405 HA ALA 46 HA ALA 46 -5.755 3.103 16.008 406 HB1 ALA 46 3HB ALA 46 -8.562 1.953 15.968 407 HB2 ALA 46 1HB ALA 46 -7.983 3.298 14.982 408 HB3 ALA 46 2HB ALA 46 -8.071 3.465 16.738 409 H GLU 47 H GLU 47 -6.873 -0.243 16.606 410 HA GLU 47 HA GLU 47 -6.871 -0.077 19.475 411 HB2 GLU 47 2HB GLU 47 -6.865 -2.457 17.567 412 HB3 GLU 47 3HB GLU 47 -6.989 -2.616 19.319 413 HG2 GLU 47 2HG GLU 47 -9.115 -1.292 19.236 414 HG3 GLU 47 3HG GLU 47 -8.993 -1.279 17.475 415 H GLU 48 H GLU 48 -4.688 -1.426 17.054 416 HA GLU 48 HA GLU 48 -2.748 -2.382 19.029 417 HB2 GLU 48 2HB GLU 48 -2.807 -2.659 15.988 418 HB3 GLU 48 3HB GLU 48 -1.705 -3.498 17.078 419 HG2 GLU 48 2HG GLU 48 -3.618 -4.695 18.092 420 HG3 GLU 48 3HG GLU 48 -4.719 -3.853 16.998 421 H LYS 49 H LYS 49 -3.121 0.482 18.643 422 HA LYS 49 HA LYS 49 -1.143 1.640 16.999 423 HB2 LYS 49 2HB LYS 49 -3.199 2.805 17.745 424 HB3 LYS 49 3HB LYS 49 -2.594 2.810 19.401 425 HG2 LYS 49 2HG LYS 49 -0.696 4.242 18.706 426 HG3 LYS 49 3HG LYS 49 -1.296 4.225 17.044 427 HD2 LYS 49 2HD LYS 49 -2.794 5.353 19.442 428 HD3 LYS 49 3HD LYS 49 -1.910 6.302 18.246 429 HE2 LYS 49 2HE LYS 49 -3.446 5.484 16.478 430 HE3 LYS 49 3HE LYS 49 -4.348 4.573 17.693 431 HZ1 LYS 49 3HZ LYS 49 -5.346 6.732 17.126 432 HZ2 LYS 49 1HZ LYS 49 -3.981 7.520 17.733 433 HZ3 LYS 49 2HZ LYS 49 -4.962 6.606 18.768 434 H ASN 50 H ASN 50 0.825 0.813 17.368 435 HA ASN 50 HA ASN 50 2.295 1.563 19.792 436 HB2 ASN 50 2HB ASN 50 1.464 -0.820 20.068 437 HB3 ASN 50 3HB ASN 50 2.315 -1.271 18.598 438 HD21 ASN 50 1HD2 ASN 50 2.684 -0.303 21.949 439 HD22 ASN 50 2HD2 ASN 50 4.319 -0.830 22.123 440 H PHE 51 H PHE 51 4.762 1.020 19.271 441 HA PHE 51 HA PHE 51 5.673 2.481 17.087 442 HB2 PHE 51 2HB PHE 51 7.172 0.288 18.586 443 HB3 PHE 51 3HB PHE 51 7.908 1.571 17.631 444 HD1 PHE 51 HD1 PHE 51 7.444 4.035 18.401 445 HD2 PHE 51 HD2 PHE 51 6.817 0.624 20.916 446 HE1 PHE 51 HE1 PHE 51 7.529 5.477 20.395 447 HE2 PHE 51 HE2 PHE 51 6.902 2.078 22.900 448 HZ PHE 51 HZ PHE 51 7.254 4.502 22.642 449 H GLU 52 H GLU 52 4.554 -0.750 17.123 450 HA GLU 52 HA GLU 52 5.756 -1.999 14.952 451 HB2 GLU 52 2HB GLU 52 4.289 -3.111 16.589 452 HB3 GLU 52 3HB GLU 52 2.903 -2.196 16.013 453 HG2 GLU 52 2HG GLU 52 2.801 -4.468 15.167 454 HG3 GLU 52 3HG GLU 52 3.063 -3.351 13.826 455 H LYS 53 H LYS 53 5.946 -1.110 12.960 456 HA LYS 53 HA LYS 53 3.893 0.539 11.730 457 HB2 LYS 53 2HB LYS 53 6.410 -0.597 10.435 458 HB3 LYS 53 3HB LYS 53 5.342 0.610 9.738 459 HG2 LYS 53 2HG LYS 53 7.178 1.858 10.483 460 HG3 LYS 53 3HG LYS 53 5.971 2.103 11.745 461 HD2 LYS 53 2HD LYS 53 8.166 1.736 12.742 462 HD3 LYS 53 3HD LYS 53 7.104 0.380 13.135 463 HE2 LYS 53 2HE LYS 53 9.355 -0.403 12.537 464 HE3 LYS 53 3HE LYS 53 8.173 -0.966 11.358 465 HZ1 LYS 53 3HZ LYS 53 10.239 -0.131 10.352 466 HZ2 LYS 53 1HZ LYS 53 9.934 1.397 10.999 467 HZ3 LYS 53 2HZ LYS 53 8.891 0.748 9.841 468 H ILE 54 H ILE 54 2.670 -0.040 9.867 469 HA ILE 54 HA ILE 54 2.258 -2.964 9.506 470 HB ILE 54 HB ILE 54 0.119 -0.782 9.478 471 HG12 ILE 54 2HG1 ILE 54 0.934 -1.294 11.780 472 HG13 ILE 54 3HG1 ILE 54 -0.750 -1.748 11.553 473 HG21 ILE 54 1HG2 ILE 54 -0.214 -3.786 9.151 474 HG22 ILE 54 2HG2 ILE 54 -0.465 -2.563 7.904 475 HG23 ILE 54 3HG2 ILE 54 -1.534 -2.621 9.306 476 HD11 ILE 54 3HD1 ILE 54 1.609 -3.625 11.561 477 HD12 ILE 54 1HD1 ILE 54 -0.080 -4.094 11.334 478 HD13 ILE 54 2HD1 ILE 54 0.444 -3.384 12.858 479 H LEU 55 H LEU 55 2.133 -3.685 7.463 480 HA LEU 55 HA LEU 55 1.915 -1.784 5.193 481 HB2 LEU 55 2HB LEU 55 3.953 -3.266 5.317 482 HB3 LEU 55 3HB LEU 55 2.922 -4.676 5.185 483 HG LEU 55 HG LEU 55 2.870 -2.567 2.993 484 HD11 LEU 55 1HD1 LEU 55 4.654 -3.722 1.791 485 HD12 LEU 55 2HD1 LEU 55 4.915 -4.789 3.174 486 HD13 LEU 55 3HD1 LEU 55 5.235 -3.059 3.317 487 HD21 LEU 55 3HD2 LEU 55 1.180 -4.349 2.867 488 HD22 LEU 55 1HD2 LEU 55 2.453 -5.574 2.894 489 HD23 LEU 55 2HD2 LEU 55 2.322 -4.456 1.530 490 H ILE 56 H ILE 56 -0.022 -1.833 4.093 491 HA ILE 56 HA ILE 56 -1.906 -4.082 4.608 492 HB ILE 56 HB ILE 56 -2.621 -1.306 3.537 493 HG12 ILE 56 2HG1 ILE 56 -1.816 -1.236 5.975 494 HG13 ILE 56 3HG1 ILE 56 -3.430 -0.606 5.683 495 HG21 ILE 56 1HG2 ILE 56 -4.209 -3.028 2.853 496 HG22 ILE 56 2HG2 ILE 56 -4.966 -1.976 4.049 497 HG23 ILE 56 3HG2 ILE 56 -4.394 -3.576 4.523 498 HD11 ILE 56 3HD1 ILE 56 -3.307 -1.897 7.727 499 HD12 ILE 56 1HD1 ILE 56 -2.788 -3.321 6.826 500 HD13 ILE 56 2HD1 ILE 56 -4.405 -2.653 6.573 501 H ILE 57 H ILE 57 -2.185 -5.426 2.871 502 HA ILE 57 HA ILE 57 -1.706 -4.410 0.127 503 HB ILE 57 HB ILE 57 -1.997 -7.294 1.106 504 HG12 ILE 57 2HG1 ILE 57 0.415 -5.787 -0.006 505 HG13 ILE 57 3HG1 ILE 57 0.184 -6.267 1.669 506 HG21 ILE 57 1HG2 ILE 57 -1.521 -6.302 -1.734 507 HG22 ILE 57 2HG2 ILE 57 -2.990 -7.081 -1.140 508 HG23 ILE 57 3HG2 ILE 57 -1.481 -7.990 -1.221 509 HD11 ILE 57 3HD1 ILE 57 1.755 -7.720 0.585 510 HD12 ILE 57 1HD1 ILE 57 0.589 -8.125 -0.676 511 HD13 ILE 57 2HD1 ILE 57 0.300 -8.625 0.996 512 H SER 58 H SER 58 -3.475 -3.737 -0.933 513 HA SER 58 HA SER 58 -6.099 -5.049 -0.482 514 HB2 SER 58 2HB SER 58 -6.147 -2.599 0.033 515 HB3 SER 58 3HB SER 58 -5.533 -2.247 -1.580 516 HG SER 58 HG SER 58 -7.529 -2.284 -2.203 517 H ASN 59 H ASN 59 -6.865 -6.182 -2.261 518 HA ASN 59 HA ASN 59 -5.189 -6.168 -4.694 519 HB2 ASN 59 2HB ASN 59 -7.293 -8.114 -3.683 520 HB3 ASN 59 3HB ASN 59 -6.563 -8.242 -5.276 521 HD21 ASN 59 1HD2 ASN 59 -5.037 -7.457 -2.131 522 HD22 ASN 59 2HD2 ASN 59 -3.966 -8.808 -2.150 523 H ASP 60 H ASP 60 -7.676 -4.366 -3.738 524 HA ASP 60 HA ASP 60 -8.716 -4.055 -6.488 525 HB2 ASP 60 2HB ASP 60 -10.385 -5.393 -5.355 526 HB3 ASP 60 3HB ASP 60 -10.395 -4.310 -3.968 527 H LYS 61 H LYS 61 -9.429 -2.051 -7.090 528 HA LYS 61 HA LYS 61 -7.991 0.169 -6.043 529 HB2 LYS 61 2HB LYS 61 -9.055 1.439 -7.880 530 HB3 LYS 61 3HB LYS 61 -8.451 -0.110 -8.458 531 HG2 LYS 61 2HG LYS 61 -10.707 -1.048 -8.447 532 HG3 LYS 61 3HG LYS 61 -11.354 0.442 -7.756 533 HD2 LYS 61 2HD LYS 61 -10.784 1.677 -9.803 534 HD3 LYS 61 3HD LYS 61 -10.031 0.234 -10.492 535 HE2 LYS 61 2HE LYS 61 -12.242 -0.914 -10.433 536 HE3 LYS 61 3HE LYS 61 -12.976 0.562 -9.808 537 HZ1 LYS 61 3HZ LYS 61 -11.592 0.316 -12.424 538 HZ2 LYS 61 1HZ LYS 61 -12.368 1.698 -11.836 539 HZ3 LYS 61 2HZ LYS 61 -13.267 0.314 -12.207 540 H GLN 62 H GLN 62 -11.392 -0.835 -5.869 541 HA GLN 62 HA GLN 62 -12.503 1.654 -5.016 542 HB2 GLN 62 2HB GLN 62 -13.835 -0.088 -6.158 543 HB3 GLN 62 3HB GLN 62 -13.551 -1.202 -4.834 544 HG2 GLN 62 2HG GLN 62 -15.769 -0.453 -4.557 545 HG3 GLN 62 3HG GLN 62 -14.838 0.421 -3.344 546 HE21 GLN 62 1HE2 GLN 62 -16.587 0.675 -6.357 547 HE22 GLN 62 2HE2 GLN 62 -16.737 2.394 -6.359 548 H LEU 63 H LEU 63 -11.637 -1.381 -3.370 549 HA LEU 63 HA LEU 63 -12.160 -0.739 -0.712 550 HB2 LEU 63 2HB LEU 63 -9.886 -2.441 -1.822 551 HB3 LEU 63 3HB LEU 63 -10.437 -2.459 -0.152 552 HG LEU 63 HG LEU 63 -12.004 -3.420 -2.576 553 HD11 LEU 63 1HD1 LEU 63 -11.777 -5.645 -1.564 554 HD12 LEU 63 2HD1 LEU 63 -10.796 -4.970 -0.261 555 HD13 LEU 63 3HD1 LEU 63 -10.202 -4.941 -1.925 556 HD21 LEU 63 3HD2 LEU 63 -12.829 -3.323 0.344 557 HD22 LEU 63 1HD2 LEU 63 -13.704 -4.169 -0.938 558 HD23 LEU 63 2HD2 LEU 63 -13.541 -2.417 -0.996 559 H LEU 64 H LEU 64 -9.208 -0.315 -2.627 560 HA LEU 64 HA LEU 64 -7.478 0.645 -0.678 561 HB2 LEU 64 2HB LEU 64 -6.774 -0.146 -2.859 562 HB3 LEU 64 3HB LEU 64 -7.582 1.182 -3.661 563 HG LEU 64 HG LEU 64 -5.398 1.893 -1.698 564 HD11 LEU 64 1HD1 LEU 64 -3.662 1.574 -3.394 565 HD12 LEU 64 2HD1 LEU 64 -4.834 0.795 -4.457 566 HD13 LEU 64 3HD1 LEU 64 -4.397 0.045 -2.919 567 HD21 LEU 64 3HD2 LEU 64 -6.607 3.709 -2.836 568 HD22 LEU 64 1HD2 LEU 64 -6.166 3.041 -4.408 569 HD23 LEU 64 2HD2 LEU 64 -4.918 3.680 -3.334 570 H LYS 65 H LYS 65 -9.731 2.458 -2.754 571 HA LYS 65 HA LYS 65 -8.948 5.063 -1.971 572 HB2 LYS 65 2HB LYS 65 -11.600 4.047 -3.057 573 HB3 LYS 65 3HB LYS 65 -11.202 5.755 -2.858 574 HG2 LYS 65 2HG LYS 65 -9.319 5.494 -4.458 575 HG3 LYS 65 3HG LYS 65 -9.746 3.791 -4.667 576 HD2 LYS 65 2HD LYS 65 -10.684 5.037 -6.523 577 HD3 LYS 65 3HD LYS 65 -12.012 4.509 -5.487 578 HE2 LYS 65 2HE LYS 65 -11.910 6.836 -4.412 579 HE3 LYS 65 3HE LYS 65 -10.829 7.290 -5.731 580 HZ1 LYS 65 3HZ LYS 65 -13.150 7.869 -6.161 581 HZ2 LYS 65 1HZ LYS 65 -13.588 6.238 -6.079 582 HZ3 LYS 65 2HZ LYS 65 -12.557 6.780 -7.301 583 H GLU 66 H GLU 66 -11.726 3.042 -0.870 584 HA GLU 66 HA GLU 66 -12.769 4.704 1.110 585 HB2 GLU 66 2HB GLU 66 -12.560 1.665 1.274 586 HB3 GLU 66 3HB GLU 66 -13.712 2.671 2.149 587 HG2 GLU 66 2HG GLU 66 -13.610 2.254 -0.849 588 HG3 GLU 66 3HG GLU 66 -14.748 1.500 0.263 589 H MET 67 H MET 67 -10.298 2.234 1.349 590 HA MET 67 HA MET 67 -9.617 2.155 3.999 591 HB2 MET 67 2HB MET 67 -8.897 0.580 2.240 592 HB3 MET 67 3HB MET 67 -7.871 1.809 1.528 593 HG2 MET 67 2HG MET 67 -6.390 1.746 3.435 594 HG3 MET 67 3HG MET 67 -7.485 0.656 4.289 595 HE1 MET 67 3HE MET 67 -8.401 -1.345 1.901 596 HE2 MET 67 1HE MET 67 -7.966 -1.869 3.528 597 HE3 MET 67 2HE MET 67 -7.206 -2.624 2.128 598 H LEU 68 H LEU 68 -8.103 4.158 1.445 599 HA LEU 68 HA LEU 68 -6.212 5.435 3.121 600 HB2 LEU 68 2HB LEU 68 -7.337 6.232 0.413 601 HB3 LEU 68 3HB LEU 68 -6.044 7.120 1.207 602 HG LEU 68 HG LEU 68 -5.888 4.209 0.317 603 HD11 LEU 68 1HD1 LEU 68 -4.551 6.673 -0.837 604 HD12 LEU 68 2HD1 LEU 68 -5.885 5.774 -1.567 605 HD13 LEU 68 3HD1 LEU 68 -4.313 5.005 -1.369 606 HD21 LEU 68 3HD2 LEU 68 -3.756 5.973 1.577 607 HD22 LEU 68 1HD2 LEU 68 -3.501 4.355 0.917 608 HD23 LEU 68 2HD2 LEU 68 -4.537 4.573 2.323 609 H GLU 69 H GLU 69 -9.505 6.366 2.162 610 HA GLU 69 HA GLU 69 -9.415 9.015 3.268 611 HB2 GLU 69 2HB GLU 69 -11.784 7.245 2.531 612 HB3 GLU 69 3HB GLU 69 -11.898 8.961 2.935 613 HG2 GLU 69 2HG GLU 69 -10.582 9.579 1.001 614 HG3 GLU 69 3HG GLU 69 -10.224 7.891 0.643 615 H LEU 70 H LEU 70 -10.203 5.859 4.540 616 HA LEU 70 HA LEU 70 -11.212 6.721 7.088 617 HB2 LEU 70 2HB LEU 70 -10.206 4.075 5.990 618 HB3 LEU 70 3HB LEU 70 -10.754 4.226 7.649 619 HG LEU 70 HG LEU 70 -12.484 4.805 5.196 620 HD11 LEU 70 1HD1 LEU 70 -11.921 2.425 5.314 621 HD12 LEU 70 2HD1 LEU 70 -13.629 2.699 5.651 622 HD13 LEU 70 3HD1 LEU 70 -12.512 2.352 6.978 623 HD21 LEU 70 3HD2 LEU 70 -14.367 4.868 6.746 624 HD22 LEU 70 1HD2 LEU 70 -13.169 6.082 7.190 625 HD23 LEU 70 2HD2 LEU 70 -13.290 4.581 8.115 626 H ILE 71 H ILE 71 -8.051 5.682 5.841 627 HA ILE 71 HA ILE 71 -6.594 5.830 8.297 628 HB ILE 71 HB ILE 71 -5.650 5.851 5.391 629 HG12 ILE 71 2HG1 ILE 71 -5.536 3.618 7.477 630 HG13 ILE 71 3HG1 ILE 71 -6.730 3.729 6.191 631 HG21 ILE 71 1HG2 ILE 71 -3.921 5.640 7.880 632 HG22 ILE 71 2HG2 ILE 71 -3.934 6.974 6.726 633 HG23 ILE 71 3HG2 ILE 71 -3.362 5.383 6.226 634 HD11 ILE 71 3HD1 ILE 71 -5.026 2.131 5.612 635 HD12 ILE 71 1HD1 ILE 71 -3.758 3.338 5.832 636 HD13 ILE 71 2HD1 ILE 71 -4.929 3.514 4.523 637 H SER 72 H SER 72 -7.525 8.175 5.873 638 HA SER 72 HA SER 72 -5.724 10.269 6.448 639 HB2 SER 72 2HB SER 72 -7.233 10.091 4.419 640 HB3 SER 72 3HB SER 72 -8.595 10.536 5.447 641 HG SER 72 HG SER 72 -6.336 12.071 4.711 642 H LYS 73 H LYS 73 -8.757 9.235 7.897 643 HA LYS 73 HA LYS 73 -9.077 11.421 9.720 644 HB2 LYS 73 2HB LYS 73 -10.211 8.594 9.927 645 HB3 LYS 73 3HB LYS 73 -10.805 10.025 10.762 646 HG2 LYS 73 2HG LYS 73 -10.954 9.458 7.785 647 HG3 LYS 73 3HG LYS 73 -12.295 9.474 8.935 648 HD2 LYS 73 2HD LYS 73 -11.910 11.912 9.312 649 HD3 LYS 73 3HD LYS 73 -10.610 11.877 8.114 650 HE2 LYS 73 2HE LYS 73 -13.551 11.312 7.603 651 HE3 LYS 73 3HE LYS 73 -12.660 12.754 7.121 652 HZ1 LYS 73 3HZ LYS 73 -12.216 9.994 6.111 653 HZ2 LYS 73 1HZ LYS 73 -11.277 11.337 5.692 654 HZ3 LYS 73 2HZ LYS 73 -12.911 11.281 5.262 655 H LEU 74 H LEU 74 -7.576 8.210 9.844 656 HA LEU 74 HA LEU 74 -6.854 8.199 12.602 657 HB2 LEU 74 2HB LEU 74 -5.600 6.692 10.271 658 HB3 LEU 74 3HB LEU 74 -5.324 6.334 11.968 659 HG LEU 74 HG LEU 74 -7.982 6.038 10.504 660 HD11 LEU 74 1HD1 LEU 74 -6.365 4.344 9.802 661 HD12 LEU 74 2HD1 LEU 74 -7.660 3.620 10.752 662 HD13 LEU 74 3HD1 LEU 74 -6.075 3.889 11.485 663 HD21 LEU 74 3HD2 LEU 74 -8.357 6.632 12.846 664 HD22 LEU 74 1HD2 LEU 74 -7.291 5.328 13.376 665 HD23 LEU 74 2HD2 LEU 74 -8.810 4.956 12.555 666 H GLY 75 H GLY 75 -5.371 9.537 9.729 667 HA2 GLY 75 2HA GLY 75 -3.756 11.111 9.428 668 HA3 GLY 75 3HA GLY 75 -3.770 11.383 11.159 669 H TYR 76 H TYR 76 -2.595 9.082 8.727 670 HA TYR 76 HA TYR 76 -0.006 8.872 10.186 671 HB2 TYR 76 2HB TYR 76 -1.480 6.640 8.710 672 HB3 TYR 76 3HB TYR 76 0.179 6.516 9.277 673 HD1 TYR 76 HD1 TYR 76 0.372 7.304 11.933 674 HD2 TYR 76 HD2 TYR 76 -3.025 5.504 10.064 675 HE1 TYR 76 HE1 TYR 76 -0.388 6.461 14.108 676 HE2 TYR 76 HE2 TYR 76 -3.785 4.663 12.245 677 HH TYR 76 HH TYR 76 -2.802 4.114 14.452 678 H LYS 77 H LYS 77 1.859 8.557 8.865 679 HA LYS 77 HA LYS 77 1.781 9.624 6.195 680 HB2 LYS 77 2HB LYS 77 3.776 10.028 7.523 681 HB3 LYS 77 3HB LYS 77 4.027 8.307 7.781 682 HG2 LYS 77 2HG LYS 77 5.611 9.271 6.129 683 HG3 LYS 77 3HG LYS 77 4.627 7.980 5.448 684 HD2 LYS 77 2HD LYS 77 4.909 9.848 3.856 685 HD3 LYS 77 3HD LYS 77 3.214 9.629 4.292 686 HE2 LYS 77 2HE LYS 77 3.332 11.553 5.807 687 HE3 LYS 77 3HE LYS 77 5.058 11.732 5.488 688 HZ1 LYS 77 3HZ LYS 77 4.544 12.212 3.177 689 HZ2 LYS 77 1HZ LYS 77 3.743 13.298 4.195 690 HZ3 LYS 77 2HZ LYS 77 2.894 12.031 3.475 691 H VAL 78 H VAL 78 1.170 8.513 4.506 692 HA VAL 78 HA VAL 78 1.432 5.570 4.437 693 HB VAL 78 HB VAL 78 -0.638 7.283 2.989 694 HG11 VAL 78 1HG1 VAL 78 -1.720 5.132 2.424 695 HG12 VAL 78 2HG1 VAL 78 -0.394 4.256 3.187 696 HG13 VAL 78 3HG1 VAL 78 -0.094 5.228 1.744 697 HG21 VAL 78 3HG2 VAL 78 -2.282 6.330 4.565 698 HG22 VAL 78 1HG2 VAL 78 -1.047 7.274 5.407 699 HG23 VAL 78 2HG2 VAL 78 -0.978 5.510 5.431 700 H PHE 79 H PHE 79 2.885 4.878 3.046 701 HA PHE 79 HA PHE 79 3.508 6.399 0.592 702 HB2 PHE 79 2HB PHE 79 4.904 4.031 1.930 703 HB3 PHE 79 3HB PHE 79 5.398 4.748 0.404 704 HD1 PHE 79 HD1 PHE 79 6.315 7.104 0.374 705 HD2 PHE 79 HD2 PHE 79 5.597 5.000 4.034 706 HE1 PHE 79 HE1 PHE 79 7.822 8.644 1.565 707 HE2 PHE 79 HE2 PHE 79 7.104 6.549 5.210 708 HZ PHE 79 HZ PHE 79 8.213 8.370 3.981 709 H LEU 80 H LEU 80 2.270 5.763 -1.093 710 HA LEU 80 HA LEU 80 0.948 3.126 -1.039 711 HB2 LEU 80 2HB LEU 80 -0.576 5.014 -1.146 712 HB3 LEU 80 3HB LEU 80 0.277 5.694 -2.522 713 HG LEU 80 HG LEU 80 -0.484 3.809 -3.950 714 HD11 LEU 80 1HD1 LEU 80 -2.019 2.818 -1.538 715 HD12 LEU 80 2HD1 LEU 80 -0.622 2.036 -2.283 716 HD13 LEU 80 3HD1 LEU 80 -2.127 2.184 -3.183 717 HD21 LEU 80 3HD2 LEU 80 -1.859 5.816 -3.874 718 HD22 LEU 80 1HD2 LEU 80 -2.763 5.181 -2.495 719 HD23 LEU 80 2HD2 LEU 80 -2.870 4.387 -4.071 720 H LEU 81 H LEU 81 1.413 1.621 -2.515 721 HA LEU 81 HA LEU 81 2.976 2.296 -4.925 722 HB2 LEU 81 2HB LEU 81 4.259 0.878 -3.333 723 HB3 LEU 81 3HB LEU 81 2.968 -0.313 -3.335 724 HG LEU 81 HG LEU 81 3.383 -0.790 -5.739 725 HD11 LEU 81 1HD1 LEU 81 5.589 1.268 -5.524 726 HD12 LEU 81 2HD1 LEU 81 4.135 1.360 -6.519 727 HD13 LEU 81 3HD1 LEU 81 5.370 0.156 -6.875 728 HD21 LEU 81 3HD2 LEU 81 4.570 -2.138 -4.077 729 HD22 LEU 81 1HD2 LEU 81 5.910 -0.986 -4.071 730 HD23 LEU 81 2HD2 LEU 81 5.548 -1.920 -5.526 731 H LEU 82 H LEU 82 1.650 2.251 -6.606 732 HA LEU 82 HA LEU 82 -0.597 0.349 -6.746 733 HB2 LEU 82 2HB LEU 82 0.025 2.891 -8.306 734 HB3 LEU 82 3HB LEU 82 -1.336 1.839 -8.656 735 HG LEU 82 HG LEU 82 -0.941 3.374 -6.059 736 HD11 LEU 82 1HD1 LEU 82 -1.449 4.872 -7.927 737 HD12 LEU 82 2HD1 LEU 82 -2.803 4.777 -6.805 738 HD13 LEU 82 3HD1 LEU 82 -2.869 3.905 -8.340 739 HD21 LEU 82 3HD2 LEU 82 -3.235 2.661 -5.525 740 HD22 LEU 82 1HD2 LEU 82 -2.146 1.284 -5.685 741 HD23 LEU 82 2HD2 LEU 82 -3.275 1.670 -6.987 742 H GLN 83 H GLN 83 -0.008 -1.499 -7.726 743 HA GLN 83 HA GLN 83 1.708 -1.462 -10.113 744 HB2 GLN 83 2HB GLN 83 2.343 -3.072 -8.295 745 HB3 GLN 83 3HB GLN 83 0.786 -3.871 -8.478 746 HG2 GLN 83 2HG GLN 83 1.357 -4.540 -10.766 747 HG3 GLN 83 3HG GLN 83 2.877 -3.650 -10.675 748 HE21 GLN 83 1HE2 GLN 83 2.472 -6.474 -11.228 749 HE22 GLN 83 2HE2 GLN 83 3.356 -7.332 -10.021 750 H ASP 84 H ASP 84 0.653 -1.349 -11.964 751 HA ASP 84 HA ASP 84 -1.544 -3.141 -12.556 752 HB2 ASP 84 2HB ASP 84 -2.651 -1.062 -11.582 753 HB3 ASP 84 3HB ASP 84 -1.971 -0.132 -12.916 754 H GLN 85 H GLN 85 -1.598 -3.640 -14.741 755 HA GLN 85 HA GLN 85 0.816 -3.031 -16.199 756 HB2 GLN 85 2HB GLN 85 -1.543 -4.772 -17.020 757 HB3 GLN 85 3HB GLN 85 0.052 -4.760 -17.769 758 HG2 GLN 85 2HG GLN 85 -0.596 -5.666 -14.941 759 HG3 GLN 85 3HG GLN 85 -0.214 -6.710 -16.309 760 HE21 GLN 85 1HE2 GLN 85 1.123 -6.443 -13.696 761 HE22 GLN 85 2HE2 GLN 85 2.775 -6.067 -14.039 762 H ASP 86 H ASP 86 -2.464 -1.900 -16.264 763 HA ASP 86 HA ASP 86 -2.208 -0.711 -18.944 764 HB2 ASP 86 2HB ASP 86 -4.552 -0.778 -16.986 765 HB3 ASP 86 3HB ASP 86 -4.600 -0.017 -18.574 766 H GLU 87 H GLU 87 -0.749 0.924 -18.722 767 HA GLU 87 HA GLU 87 -0.379 2.277 -16.235 768 HB2 GLU 87 2HB GLU 87 1.013 2.575 -18.914 769 HB3 GLU 87 3HB GLU 87 1.518 3.404 -17.438 770 HG2 GLU 87 2HG GLU 87 1.785 1.164 -16.332 771 HG3 GLU 87 3HG GLU 87 1.423 0.404 -17.882 772 H ASN 88 H ASN 88 -2.224 3.073 -19.030 773 HA ASN 88 HA ASN 88 -2.268 5.925 -18.637 774 HB2 ASN 88 2HB ASN 88 -4.297 4.148 -20.079 775 HB3 ASN 88 3HB ASN 88 -4.225 5.908 -20.165 776 HD21 ASN 88 1HD2 ASN 88 -3.963 5.808 -22.430 777 HD22 ASN 88 2HD2 ASN 88 -2.472 5.331 -23.164 778 H GLU 89 H GLU 89 -4.242 3.179 -17.614 779 HA GLU 89 HA GLU 89 -6.208 4.679 -16.129 780 HB2 GLU 89 2HB GLU 89 -5.535 1.704 -15.926 781 HB3 GLU 89 3HB GLU 89 -7.010 2.488 -15.360 782 HG2 GLU 89 2HG GLU 89 -7.532 3.081 -17.749 783 HG3 GLU 89 3HG GLU 89 -6.134 2.127 -18.247 784 H LEU 90 H LEU 90 -3.227 2.968 -15.439 785 HA LEU 90 HA LEU 90 -3.204 3.010 -12.635 786 HB2 LEU 90 2HB LEU 90 -1.717 1.576 -13.911 787 HB3 LEU 90 3HB LEU 90 -0.994 2.954 -14.716 788 HG LEU 90 HG LEU 90 0.126 3.639 -12.637 789 HD11 LEU 90 1HD1 LEU 90 0.069 2.204 -10.633 790 HD12 LEU 90 2HD1 LEU 90 -1.233 1.256 -11.361 791 HD13 LEU 90 3HD1 LEU 90 -1.481 2.968 -10.983 792 HD21 LEU 90 3HD2 LEU 90 0.596 0.704 -13.253 793 HD22 LEU 90 1HD2 LEU 90 1.720 1.790 -12.428 794 HD23 LEU 90 2HD2 LEU 90 1.303 2.074 -14.117 795 H GLU 91 H GLU 91 -1.948 5.325 -15.044 796 HA GLU 91 HA GLU 91 -0.787 7.162 -13.223 797 HB2 GLU 91 2HB GLU 91 -0.047 7.152 -15.516 798 HB3 GLU 91 3HB GLU 91 -1.674 7.418 -16.122 799 HG2 GLU 91 2HG GLU 91 -0.272 9.425 -16.326 800 HG3 GLU 91 3HG GLU 91 -1.662 9.699 -15.275 801 H GLU 92 H GLU 92 -3.956 7.142 -14.910 802 HA GLU 92 HA GLU 92 -5.041 9.499 -13.893 803 HB2 GLU 92 2HB GLU 92 -6.380 6.885 -14.681 804 HB3 GLU 92 3HB GLU 92 -7.310 8.299 -14.193 805 HG2 GLU 92 2HG GLU 92 -5.415 8.157 -16.552 806 HG3 GLU 92 3HG GLU 92 -7.177 8.094 -16.630 807 H PHE 93 H PHE 93 -5.348 6.215 -12.541 808 HA PHE 93 HA PHE 93 -6.889 6.867 -10.279 809 HB2 PHE 93 2HB PHE 93 -6.625 4.575 -11.264 810 HB3 PHE 93 3HB PHE 93 -4.971 4.520 -10.667 811 HD1 PHE 93 HD1 PHE 93 -8.444 5.166 -9.371 812 HD2 PHE 93 HD2 PHE 93 -4.636 3.353 -8.641 813 HE1 PHE 93 HE1 PHE 93 -9.278 4.238 -7.261 814 HE2 PHE 93 HE2 PHE 93 -5.487 2.437 -6.524 815 HZ PHE 93 HZ PHE 93 -7.807 2.879 -5.834 816 H LYS 94 H LYS 94 -3.388 6.690 -10.783 817 HA LYS 94 HA LYS 94 -2.484 7.007 -8.142 818 HB2 LYS 94 2HB LYS 94 -1.076 6.193 -10.009 819 HB3 LYS 94 3HB LYS 94 -1.127 7.772 -10.764 820 HG2 LYS 94 2HG LYS 94 0.056 7.443 -8.004 821 HG3 LYS 94 3HG LYS 94 1.005 7.015 -9.420 822 HD2 LYS 94 2HD LYS 94 -0.174 9.759 -8.829 823 HD3 LYS 94 3HD LYS 94 1.517 9.298 -8.628 824 HE2 LYS 94 2HE LYS 94 1.801 9.011 -11.004 825 HE3 LYS 94 3HE LYS 94 0.066 9.178 -11.292 826 HZ1 LYS 94 3HZ LYS 94 1.893 11.301 -10.307 827 HZ2 LYS 94 1HZ LYS 94 0.222 11.472 -10.498 828 HZ3 LYS 94 2HZ LYS 94 1.201 11.198 -11.851 829 H ARG 95 H ARG 95 -3.010 9.456 -10.723 830 HA ARG 95 HA ARG 95 -1.973 11.612 -9.166 831 HB2 ARG 95 2HB ARG 95 -2.734 13.093 -11.001 832 HB3 ARG 95 3HB ARG 95 -1.791 11.726 -11.573 833 HG2 ARG 95 2HG ARG 95 -3.771 10.622 -12.406 834 HG3 ARG 95 3HG ARG 95 -4.820 11.836 -11.677 835 HD2 ARG 95 2HD ARG 95 -4.520 12.098 -14.146 836 HD3 ARG 95 3HD ARG 95 -4.050 13.523 -13.223 837 HE ARG 95 HE ARG 95 -1.682 12.487 -13.476 838 HH11 ARG 95 1HH1 ARG 95 -4.165 12.367 -15.978 839 HH12 ARG 95 2HH1 ARG 95 -3.008 12.356 -17.266 840 HH21 ARG 95 1HH2 ARG 95 -0.214 12.520 -15.158 841 HH22 ARG 95 2HH2 ARG 95 -0.760 12.446 -16.803 842 H LYS 96 H LYS 96 -5.212 10.314 -9.537 843 HA LYS 96 HA LYS 96 -6.695 12.396 -8.345 844 HB2 LYS 96 2HB LYS 96 -7.100 9.477 -8.814 845 HB3 LYS 96 3HB LYS 96 -7.978 10.090 -7.432 846 HG2 LYS 96 2HG LYS 96 -9.524 10.173 -9.176 847 HG3 LYS 96 3HG LYS 96 -8.990 11.838 -9.011 848 HD2 LYS 96 2HD LYS 96 -7.852 9.955 -11.106 849 HD3 LYS 96 3HD LYS 96 -9.308 10.905 -11.386 850 HE2 LYS 96 2HE LYS 96 -6.565 12.043 -10.759 851 HE3 LYS 96 3HE LYS 96 -7.309 11.971 -12.355 852 HZ1 LYS 96 3HZ LYS 96 -8.457 13.451 -10.052 853 HZ2 LYS 96 1HZ LYS 96 -9.009 13.475 -11.646 854 HZ3 LYS 96 2HZ LYS 96 -7.512 14.156 -11.263 855 H ILE 97 H ILE 97 -4.899 9.696 -6.926 856 HA ILE 97 HA ILE 97 -5.609 10.285 -4.179 857 HB ILE 97 HB ILE 97 -3.624 8.288 -5.356 858 HG12 ILE 97 2HG1 ILE 97 -6.480 7.780 -4.396 859 HG13 ILE 97 3HG1 ILE 97 -6.043 8.016 -6.085 860 HG21 ILE 97 1HG2 ILE 97 -3.114 8.741 -2.998 861 HG22 ILE 97 2HG2 ILE 97 -3.776 7.117 -3.183 862 HG23 ILE 97 3HG2 ILE 97 -4.793 8.414 -2.554 863 HD11 ILE 97 3HD1 ILE 97 -6.306 5.680 -5.583 864 HD12 ILE 97 1HD1 ILE 97 -5.085 5.774 -4.315 865 HD13 ILE 97 2HD1 ILE 97 -4.631 6.030 -6.003 866 H GLU 98 H GLU 98 -2.943 10.930 -6.341 867 HA GLU 98 HA GLU 98 -0.865 11.524 -4.518 868 HB2 GLU 98 2HB GLU 98 -0.514 11.122 -6.962 869 HB3 GLU 98 3HB GLU 98 -1.341 12.633 -7.325 870 HG2 GLU 98 2HG GLU 98 0.473 13.820 -5.985 871 HG3 GLU 98 3HG GLU 98 1.329 12.279 -5.928 872 H SER 99 H SER 99 -3.427 13.444 -6.011 873 HA SER 99 HA SER 99 -2.610 16.005 -5.056 874 HB2 SER 99 2HB SER 99 -4.005 15.685 -7.089 875 HB3 SER 99 3HB SER 99 -5.326 15.080 -6.088 876 HG SER 99 HG SER 99 -4.201 17.690 -6.114 877 H GLN 100 H GLN 100 -4.605 13.408 -3.761 878 HA GLN 100 HA GLN 100 -5.898 14.842 -1.664 879 HB2 GLN 100 2HB GLN 100 -5.202 11.874 -1.818 880 HB3 GLN 100 3HB GLN 100 -6.306 12.595 -0.648 881 HG2 GLN 100 2HG GLN 100 -7.866 13.197 -2.414 882 HG3 GLN 100 3HG GLN 100 -6.735 12.641 -3.649 883 HE21 GLN 100 1HE2 GLN 100 -8.202 11.151 -4.486 884 HE22 GLN 100 2HE2 GLN 100 -8.637 9.700 -3.655 885 H GLY 101 H GLY 101 -2.640 13.753 -2.042 886 HA2 GLY 101 2HA GLY 101 -0.920 14.778 -0.733 887 HA3 GLY 101 3HA GLY 101 -1.969 14.741 0.676 888 H TYR 102 H TYR 102 -1.218 12.186 -1.660 889 HA TYR 102 HA TYR 102 0.061 10.582 0.488 890 HB2 TYR 102 2HB TYR 102 -1.734 9.667 -1.803 891 HB3 TYR 102 3HB TYR 102 -0.772 8.554 -0.832 892 HD1 TYR 102 HD1 TYR 102 -1.328 8.151 1.543 893 HD2 TYR 102 HD2 TYR 102 -3.742 10.741 -0.852 894 HE1 TYR 102 HE1 TYR 102 -3.075 8.120 3.268 895 HE2 TYR 102 HE2 TYR 102 -5.492 10.704 0.874 896 HH TYR 102 HH TYR 102 -6.219 9.284 2.747 897 H GLU 103 H GLU 103 2.006 9.665 0.054 898 HA GLU 103 HA GLU 103 3.439 10.515 -2.323 899 HB2 GLU 103 2HB GLU 103 4.477 10.513 -0.019 900 HB3 GLU 103 3HB GLU 103 4.391 8.757 -0.015 901 HG2 GLU 103 2HG GLU 103 6.649 9.471 -0.566 902 HG3 GLU 103 3HG GLU 103 5.921 8.682 -1.965 903 H VAL 104 H VAL 104 2.624 9.399 -4.078 904 HA VAL 104 HA VAL 104 2.255 6.467 -3.866 905 HB VAL 104 HB VAL 104 0.985 8.269 -5.980 906 HG11 VAL 104 1HG1 VAL 104 0.295 5.462 -5.034 907 HG12 VAL 104 2HG1 VAL 104 1.107 5.878 -6.545 908 HG13 VAL 104 3HG1 VAL 104 -0.566 6.370 -6.279 909 HG21 VAL 104 3HG2 VAL 104 -0.292 7.406 -3.358 910 HG22 VAL 104 1HG2 VAL 104 -1.114 8.236 -4.682 911 HG23 VAL 104 2HG2 VAL 104 0.174 9.052 -3.792 912 H ARG 105 H ARG 105 3.744 5.280 -4.919 913 HA ARG 105 HA ARG 105 4.887 6.237 -7.477 914 HB2 ARG 105 2HB ARG 105 5.783 4.066 -5.533 915 HB3 ARG 105 3HB ARG 105 6.425 4.181 -7.168 916 HG2 ARG 105 2HG ARG 105 6.628 6.408 -5.114 917 HG3 ARG 105 3HG ARG 105 7.876 5.191 -5.390 918 HD2 ARG 105 2HD ARG 105 6.863 7.165 -7.467 919 HD3 ARG 105 3HD ARG 105 8.367 7.310 -6.550 920 HE ARG 105 HE ARG 105 7.965 4.911 -8.202 921 HH11 ARG 105 1HH1 ARG 105 9.657 7.980 -7.799 922 HH12 ARG 105 2HH1 ARG 105 10.871 7.596 -8.981 923 HH21 ARG 105 1HH2 ARG 105 9.549 4.436 -9.750 924 HH22 ARG 105 2HH2 ARG 105 10.803 5.591 -10.080 925 H LYS 106 H LYS 106 4.771 4.895 -9.243 926 HA LYS 106 HA LYS 106 2.650 2.837 -9.337 927 HB2 LYS 106 2HB LYS 106 4.108 4.323 -11.570 928 HB3 LYS 106 3HB LYS 106 2.761 3.210 -11.789 929 HG2 LYS 106 2HG LYS 106 1.225 4.744 -10.709 930 HG3 LYS 106 3HG LYS 106 2.549 5.814 -10.232 931 HD2 LYS 106 2HD LYS 106 1.755 5.208 -13.112 932 HD3 LYS 106 3HD LYS 106 1.292 6.664 -12.222 933 HE2 LYS 106 2HE LYS 106 3.557 7.436 -12.118 934 HE3 LYS 106 3HE LYS 106 4.197 5.876 -12.638 935 HZ1 LYS 106 3HZ LYS 106 4.240 7.528 -14.405 936 HZ2 LYS 106 1HZ LYS 106 2.564 7.683 -14.326 937 HZ3 LYS 106 2HZ LYS 106 3.240 6.223 -14.806 938 H VAL 107 H VAL 107 3.156 0.930 -10.772 939 HA VAL 107 HA VAL 107 5.779 0.361 -11.696 940 HB VAL 107 HB VAL 107 6.199 -0.059 -9.273 941 HG11 VAL 107 1HG1 VAL 107 3.969 -0.778 -8.564 942 HG12 VAL 107 2HG1 VAL 107 5.197 -1.951 -8.085 943 HG13 VAL 107 3HG1 VAL 107 4.150 -2.283 -9.469 944 HG21 VAL 107 3HG2 VAL 107 6.320 -2.583 -10.954 945 HG22 VAL 107 1HG2 VAL 107 7.275 -2.258 -9.504 946 HG23 VAL 107 2HG2 VAL 107 7.505 -1.278 -10.951 947 H THR 108 H THR 108 5.853 -1.519 -12.999 948 HA THR 108 HA THR 108 3.361 -3.110 -13.336 949 HB THR 108 HB THR 108 4.146 -3.448 -15.743 950 HG1 THR 108 HG1 THR 108 6.288 -2.850 -15.654 951 HG21 THR 108 3HG2 THR 108 2.360 -1.808 -15.263 952 HG22 THR 108 1HG2 THR 108 3.399 -1.253 -16.578 953 HG23 THR 108 2HG2 THR 108 3.576 -0.564 -14.964 954 H ASP 109 H ASP 109 6.845 -3.079 -12.959 955 HA ASP 109 HA ASP 109 7.224 -5.835 -13.808 956 HB2 ASP 109 2HB ASP 109 9.217 -3.780 -12.772 957 HB3 ASP 109 3HB ASP 109 9.636 -5.360 -13.419 958 H ASP 110 H ASP 110 7.933 -7.481 -12.556 959 HA ASP 110 HA ASP 110 7.007 -7.772 -9.937 960 HB2 ASP 110 2HB ASP 110 7.106 -9.725 -11.248 961 HB3 ASP 110 3HB ASP 110 8.727 -9.385 -11.828 962 H GLU 111 H GLU 111 10.359 -7.450 -11.111 963 HA GLU 111 HA GLU 111 11.544 -7.575 -8.514 964 HB2 GLU 111 2HB GLU 111 12.627 -6.764 -11.239 965 HB3 GLU 111 3HB GLU 111 13.632 -6.804 -9.792 966 HG2 GLU 111 2HG GLU 111 12.134 -9.201 -10.904 967 HG3 GLU 111 3HG GLU 111 13.825 -8.837 -11.244 968 H GLU 112 H GLU 112 10.572 -4.960 -10.703 969 HA GLU 112 HA GLU 112 11.849 -2.843 -9.334 970 HB2 GLU 112 2HB GLU 112 11.035 -2.726 -11.687 971 HB3 GLU 112 3HB GLU 112 9.379 -2.745 -11.101 972 HG2 GLU 112 2HG GLU 112 10.068 -0.478 -11.715 973 HG3 GLU 112 3HG GLU 112 9.726 -0.579 -9.986 974 H ALA 113 H ALA 113 8.688 -4.400 -8.941 975 HA ALA 113 HA ALA 113 7.463 -2.613 -7.181 976 HB1 ALA 113 3HB ALA 113 6.277 -4.509 -8.179 977 HB2 ALA 113 1HB ALA 113 6.109 -4.521 -6.422 978 HB3 ALA 113 2HB ALA 113 7.229 -5.637 -7.210 979 H LEU 114 H LEU 114 9.650 -5.351 -6.483 980 HA LEU 114 HA LEU 114 9.658 -5.245 -3.664 981 HB2 LEU 114 2HB LEU 114 12.035 -6.034 -5.401 982 HB3 LEU 114 3HB LEU 114 11.736 -6.526 -3.741 983 HG LEU 114 HG LEU 114 10.155 -7.416 -6.188 984 HD11 LEU 114 1HD1 LEU 114 12.082 -8.962 -4.419 985 HD12 LEU 114 2HD1 LEU 114 12.401 -8.397 -6.062 986 HD13 LEU 114 3HD1 LEU 114 11.159 -9.610 -5.778 987 HD21 LEU 114 3HD2 LEU 114 8.965 -8.947 -4.681 988 HD22 LEU 114 1HD2 LEU 114 8.684 -7.267 -4.229 989 HD23 LEU 114 2HD2 LEU 114 9.804 -8.255 -3.288 990 H LYS 115 H LYS 115 11.561 -3.551 -6.088 991 HA LYS 115 HA LYS 115 13.514 -2.378 -4.396 992 HB2 LYS 115 2HB LYS 115 12.548 -1.497 -7.159 993 HB3 LYS 115 3HB LYS 115 14.016 -0.918 -6.366 994 HG2 LYS 115 2HG LYS 115 15.016 -3.132 -6.469 995 HG3 LYS 115 3HG LYS 115 13.511 -3.826 -7.082 996 HD2 LYS 115 2HD LYS 115 13.747 -2.351 -9.123 997 HD3 LYS 115 3HD LYS 115 15.329 -1.848 -8.517 998 HE2 LYS 115 2HE LYS 115 14.523 -4.689 -9.235 999 HE3 LYS 115 3HE LYS 115 15.530 -3.624 -10.215 1000 HZ1 LYS 115 3HZ LYS 115 16.187 -4.780 -7.566 1001 HZ2 LYS 115 1HZ LYS 115 17.117 -3.582 -8.316 1002 HZ3 LYS 115 2HZ LYS 115 16.942 -5.096 -9.043 1003 H ILE 116 H ILE 116 10.413 -1.131 -5.727 1004 HA ILE 116 HA ILE 116 10.665 1.466 -4.598 1005 HB ILE 116 HB ILE 116 8.091 0.031 -5.398 1006 HG12 ILE 116 2HG1 ILE 116 9.697 0.188 -7.307 1007 HG13 ILE 116 3HG1 ILE 116 8.280 1.191 -7.573 1008 HG21 ILE 116 1HG2 ILE 116 7.651 1.960 -3.952 1009 HG22 ILE 116 2HG2 ILE 116 7.130 2.299 -5.601 1010 HG23 ILE 116 3HG2 ILE 116 8.632 2.995 -4.994 1011 HD11 ILE 116 3HD1 ILE 116 9.573 3.189 -7.022 1012 HD12 ILE 116 1HD1 ILE 116 10.333 2.266 -8.315 1013 HD13 ILE 116 2HD1 ILE 116 10.992 2.193 -6.684 1014 H VAL 117 H VAL 117 9.329 -1.574 -3.351 1015 HA VAL 117 HA VAL 117 8.077 -0.532 -1.014 1016 HB VAL 117 HB VAL 117 9.197 -3.332 -1.509 1017 HG11 VAL 117 1HG1 VAL 117 7.251 -2.405 0.641 1018 HG12 VAL 117 2HG1 VAL 117 8.913 -2.941 0.904 1019 HG13 VAL 117 3HG1 VAL 117 7.702 -4.082 0.318 1020 HG21 VAL 117 3HG2 VAL 117 6.347 -2.314 -1.788 1021 HG22 VAL 117 1HG2 VAL 117 6.885 -3.977 -2.036 1022 HG23 VAL 117 2HG2 VAL 117 7.433 -2.700 -3.119 1023 H ARG 118 H ARG 118 11.380 -1.827 -1.620 1024 HA ARG 118 HA ARG 118 12.231 -1.583 1.102 1025 HB2 ARG 118 2HB ARG 118 14.405 -2.244 0.407 1026 HB3 ARG 118 3HB ARG 118 13.284 -3.138 -0.614 1027 HG2 ARG 118 2HG ARG 118 13.722 -1.658 -2.483 1028 HG3 ARG 118 3HG ARG 118 14.747 -0.629 -1.479 1029 HD2 ARG 118 2HD ARG 118 15.293 -3.522 -2.223 1030 HD3 ARG 118 3HD ARG 118 16.102 -2.100 -2.889 1031 HE ARG 118 HE ARG 118 16.325 -3.043 -0.085 1032 HH11 ARG 118 1HH1 ARG 118 17.693 -1.278 -2.808 1033 HH12 ARG 118 2HH1 ARG 118 19.201 -0.968 -2.007 1034 HH21 ARG 118 1HH2 ARG 118 18.287 -2.611 0.964 1035 HH22 ARG 118 2HH2 ARG 118 19.534 -1.730 0.140 1036 H GLU 119 H GLU 119 12.171 0.603 -1.644 1037 HA GLU 119 HA GLU 119 13.688 2.711 -0.529 1038 HB2 GLU 119 2HB GLU 119 11.378 2.728 -2.516 1039 HB3 GLU 119 3HB GLU 119 12.281 4.171 -2.083 1040 HG2 GLU 119 2HG GLU 119 13.389 1.706 -3.444 1041 HG3 GLU 119 3HG GLU 119 13.058 3.257 -4.208 1042 H PHE 120 H PHE 120 10.170 2.084 -0.535 1043 HA PHE 120 HA PHE 120 9.291 4.222 0.993 1044 HB2 PHE 120 2HB PHE 120 8.154 1.449 0.518 1045 HB3 PHE 120 3HB PHE 120 7.306 2.598 1.546 1046 HD1 PHE 120 HD2 PHE 120 8.496 4.915 -0.566 1047 HD2 PHE 120 HD1 PHE 120 5.947 1.469 -0.760 1048 HE1 PHE 120 HE2 PHE 120 7.311 5.890 -2.483 1049 HE2 PHE 120 HE1 PHE 120 4.775 2.467 -2.676 1050 HZ PHE 120 HZ PHE 120 5.444 4.670 -3.531 1051 H MET 121 H MET 121 10.375 1.040 2.126 1052 HA MET 121 HA MET 121 9.762 1.446 4.879 1053 HB2 MET 121 2HB MET 121 11.665 -0.515 3.536 1054 HB3 MET 121 3HB MET 121 11.274 -0.549 5.253 1055 HG2 MET 121 2HG MET 121 8.878 -0.888 4.659 1056 HG3 MET 121 3HG MET 121 9.344 -0.986 2.960 1057 HE1 MET 121 3HE MET 121 11.414 -4.303 2.843 1058 HE2 MET 121 1HE MET 121 12.035 -2.656 2.939 1059 HE3 MET 121 2HE MET 121 10.664 -3.023 1.889 1060 H GLN 122 H GLN 122 12.633 2.117 2.936 1061 HA GLN 122 HA GLN 122 14.373 2.801 5.109 1062 HB2 GLN 122 2HB GLN 122 15.202 2.076 2.890 1063 HB3 GLN 122 3HB GLN 122 14.516 3.516 2.149 1064 HG2 GLN 122 2HG GLN 122 16.084 4.919 3.493 1065 HG3 GLN 122 3HG GLN 122 16.787 3.445 4.165 1066 HE21 GLN 122 1HE2 GLN 122 18.845 3.998 3.281 1067 HE22 GLN 122 2HE2 GLN 122 19.173 3.822 1.596 1068 H LYS 123 H LYS 123 12.228 4.642 2.956 1069 HA LYS 123 HA LYS 123 12.892 7.264 3.855 1070 HB2 LYS 123 2HB LYS 123 10.329 6.236 2.543 1071 HB3 LYS 123 3HB LYS 123 10.774 7.934 2.704 1072 HG2 LYS 123 2HG LYS 123 12.671 7.635 1.205 1073 HG3 LYS 123 3HG LYS 123 12.393 5.892 1.147 1074 HD2 LYS 123 2HD LYS 123 10.127 6.373 0.105 1075 HD3 LYS 123 3HD LYS 123 10.600 8.074 0.010 1076 HE2 LYS 123 2HE LYS 123 11.975 5.737 -1.352 1077 HE3 LYS 123 3HE LYS 123 10.998 6.973 -2.139 1078 HZ1 LYS 123 3HZ LYS 123 13.618 7.365 -0.790 1079 HZ2 LYS 123 1HZ LYS 123 12.664 8.619 -1.404 1080 HZ3 LYS 123 2HZ LYS 123 13.305 7.460 -2.446 1081 H ALA 124 H ALA 124 10.331 4.948 4.674 1082 HA ALA 124 HA ALA 124 9.032 6.271 6.748 1083 HB1 ALA 124 3HB ALA 124 8.369 4.032 7.544 1084 HB2 ALA 124 1HB ALA 124 9.599 3.291 6.506 1085 HB3 ALA 124 2HB ALA 124 8.232 4.147 5.789 1086 H GLY 125 H GLY 125 11.952 4.267 6.759 1087 HA2 GLY 125 2HA GLY 125 12.434 4.210 9.549 1088 HA3 GLY 125 3HA GLY 125 13.607 3.876 8.288 1089 H SER 126 H SER 126 13.258 6.558 7.050 1090 HA SER 126 HA SER 126 15.251 7.975 8.541 1091 HB2 SER 126 2HB SER 126 13.579 8.869 6.149 1092 HB3 SER 126 3HB SER 126 15.038 9.667 6.745 1093 HG SER 126 HG SER 126 15.429 7.008 6.261 1094 H LEU 127 H LEU 127 11.747 8.294 8.030 1095 HA LEU 127 HA LEU 127 11.392 10.762 9.414 1096 HB2 LEU 127 2HB LEU 127 9.392 8.506 8.953 1097 HB3 LEU 127 3HB LEU 127 8.983 10.139 9.467 1098 HG LEU 127 HG LEU 127 10.185 9.368 6.776 1099 HD11 LEU 127 1HD1 LEU 127 7.398 10.353 7.438 1100 HD12 LEU 127 2HD1 LEU 127 7.845 8.714 6.957 1101 HD13 LEU 127 3HD1 LEU 127 8.038 10.044 5.820 1102 HD21 LEU 127 3HD2 LEU 127 9.369 12.115 7.779 1103 HD22 LEU 127 1HD2 LEU 127 9.884 11.721 6.135 1104 HD23 LEU 127 2HD2 LEU 127 11.016 11.557 7.473 1105 H GLU 128 H GLU 128 11.220 7.365 10.345 1106 HA GLU 128 HA GLU 128 10.589 7.655 13.085 1107 HB2 GLU 128 2HB GLU 128 12.041 5.443 11.589 1108 HB3 GLU 128 3HB GLU 128 11.498 5.310 13.261 1109 HG2 GLU 128 2HG GLU 128 9.177 5.445 12.604 1110 HG3 GLU 128 3HG GLU 128 9.616 5.860 10.945 1111 H HIS 129 H HIS 129 13.656 7.865 11.342 1112 HA HIS 129 HA HIS 129 15.347 7.958 13.683 1113 HB2 HIS 129 2HB HIS 129 15.800 8.431 10.726 1114 HB3 HIS 129 3HB HIS 129 17.026 8.947 11.875 1115 HD1 HIS 129 HD1 HIS 129 16.289 6.178 9.795 1116 HD2 HIS 129 HD2 HIS 129 17.741 6.582 13.670 1117 HE1 HIS 129 HE1 HIS 129 17.491 4.030 10.300 1118 HE2 HIS 129 HE2 HIS 129 18.280 4.269 12.675 1119 H HIS 130 H HIS 130 13.045 9.910 13.436 1120 HA HIS 130 HA HIS 130 12.555 11.741 14.586 1121 HB2 HIS 130 2HB HIS 130 15.530 12.048 15.195 1122 HB3 HIS 130 3HB HIS 130 14.217 12.889 16.014 1123 HD1 HIS 130 HD1 HIS 130 12.707 11.447 17.629 1124 HD2 HIS 130 HD2 HIS 130 15.964 9.422 16.075 1125 HE1 HIS 130 HE1 HIS 130 12.856 9.322 18.937 1126 HE2 HIS 130 HE2 HIS 130 14.689 8.026 17.808 1127 H HIS 131 H HIS 131 12.884 11.791 11.796 1128 HA HIS 131 HA HIS 131 13.664 14.460 11.070 1129 HB2 HIS 131 2HB HIS 131 13.330 12.701 9.337 1130 HB3 HIS 131 3HB HIS 131 11.625 12.593 9.755 1131 HD1 HIS 131 HD1 HIS 131 14.014 14.489 7.686 1132 HD2 HIS 131 HD2 HIS 131 10.078 14.923 8.941 1133 HE1 HIS 131 HE1 HIS 131 13.039 16.303 6.256 1134 HE2 HIS 131 HE2 HIS 131 10.751 16.703 7.209 1135 H HIS 132 H HIS 132 12.736 16.188 12.067 1136 HA HIS 132 HA HIS 132 10.379 16.021 13.602 1137 HB2 HIS 132 2HB HIS 132 10.593 18.455 13.954 1138 HB3 HIS 132 3HB HIS 132 12.126 17.634 14.185 1139 HD1 HIS 132 HD1 HIS 132 14.069 18.298 12.678 1140 HD2 HIS 132 HD2 HIS 132 10.505 20.198 11.694 1141 HE1 HIS 132 HE1 HIS 132 14.695 20.129 11.077 1142 HE2 HIS 132 HE2 HIS 132 12.530 21.305 10.553 1143 H HIS 133 H HIS 133 8.295 16.467 13.179 1144 HA HIS 133 HA HIS 133 7.478 16.753 10.398 1145 HB2 HIS 133 2HB HIS 133 5.855 16.319 12.943 1146 HB3 HIS 133 3HB HIS 133 5.159 16.403 11.329 1147 HD1 HIS 133 HD1 HIS 133 5.738 13.935 13.628 1148 HD2 HIS 133 HD2 HIS 133 6.914 14.308 9.667 1149 HE1 HIS 133 HE1 HIS 133 6.111 11.590 12.818 1150 HE2 HIS 133 HE2 HIS 133 6.595 11.849 10.358 1151 H HIS 134 H HIS 134 8.099 18.866 9.930 1152 HA HIS 134 HA HIS 134 6.654 21.073 11.293 1153 HB2 HIS 134 2HB HIS 134 9.119 21.325 11.216 1154 HB3 HIS 134 3HB HIS 134 9.099 21.146 9.466 1155 HD1 HIS 134 HD1 HIS 134 7.735 23.528 12.113 1156 HD2 HIS 134 HD2 HIS 134 8.957 23.543 8.140 1157 HE1 HIS 134 HE1 HIS 134 7.627 25.926 11.378 1158 HE2 HIS 134 HE2 HIS 134 8.218 25.878 8.940 Start of MODEL 13 1 H1 MET 1 1H MET 1 0.994 5.610 17.815 2 H2 MET 1 2H MET 1 -0.337 5.260 16.841 3 H3 MET 1 3H MET 1 -0.238 6.750 17.629 4 HA MET 1 HA MET 1 0.273 7.003 15.311 5 HB2 MET 1 2HB MET 1 1.440 8.475 16.921 6 HB3 MET 1 3HB MET 1 2.698 7.271 17.145 7 HG2 MET 1 2HG MET 1 3.414 7.586 14.807 8 HG3 MET 1 3HG MET 1 2.146 8.794 14.587 9 HE1 MET 1 3HE MET 1 5.267 9.325 13.968 10 HE2 MET 1 1HE MET 1 5.464 10.933 14.656 11 HE3 MET 1 2HE MET 1 4.015 10.547 13.725 12 H LYS 2 H LYS 2 0.930 5.939 13.493 13 HA LYS 2 HA LYS 2 3.166 4.092 13.511 14 HB2 LYS 2 2HB LYS 2 1.772 2.175 12.621 15 HB3 LYS 2 3HB LYS 2 1.478 2.570 14.310 16 HG2 LYS 2 2HG LYS 2 -0.577 3.862 13.573 17 HG3 LYS 2 3HG LYS 2 -0.302 3.238 11.943 18 HD2 LYS 2 2HD LYS 2 -1.981 1.861 13.080 19 HD3 LYS 2 3HD LYS 2 -0.522 0.910 12.802 20 HE2 LYS 2 2HE LYS 2 0.152 1.313 15.168 21 HE3 LYS 2 3HE LYS 2 -1.351 2.200 15.428 22 HZ1 LYS 2 3HZ LYS 2 -1.400 -0.149 16.185 23 HZ2 LYS 2 1HZ LYS 2 -1.241 -0.647 14.577 24 HZ3 LYS 2 2HZ LYS 2 -2.608 0.218 15.066 25 H ILE 3 H ILE 3 4.023 3.741 11.496 26 HA ILE 3 HA ILE 3 3.001 5.311 9.234 27 HB ILE 3 HB ILE 3 5.621 3.763 9.551 28 HG12 ILE 3 2HG1 ILE 3 5.134 6.774 9.579 29 HG13 ILE 3 3HG1 ILE 3 5.457 5.792 11.002 30 HG21 ILE 3 1HG2 ILE 3 6.361 4.880 7.465 31 HG22 ILE 3 2HG2 ILE 3 4.755 5.581 7.279 32 HG23 ILE 3 3HG2 ILE 3 4.966 3.833 7.186 33 HD11 ILE 3 3HD1 ILE 3 7.685 5.257 10.099 34 HD12 ILE 3 1HD1 ILE 3 7.432 6.984 10.343 35 HD13 ILE 3 2HD1 ILE 3 7.361 6.309 8.716 36 H LEU 4 H LEU 4 1.998 4.348 7.537 37 HA LEU 4 HA LEU 4 1.730 1.396 7.522 38 HB2 LEU 4 2HB LEU 4 -0.228 3.461 6.437 39 HB3 LEU 4 3HB LEU 4 -0.507 1.735 6.593 40 HG LEU 4 HG LEU 4 -0.160 3.665 8.929 41 HD11 LEU 4 1HD1 LEU 4 -2.254 4.092 7.762 42 HD12 LEU 4 2HD1 LEU 4 -2.551 3.376 9.344 43 HD13 LEU 4 3HD1 LEU 4 -2.699 2.388 7.887 44 HD21 LEU 4 3HD2 LEU 4 -0.906 1.806 10.352 45 HD22 LEU 4 1HD2 LEU 4 0.602 1.427 9.521 46 HD23 LEU 4 2HD2 LEU 4 -0.916 0.730 8.953 47 H ILE 5 H ILE 5 2.290 0.345 5.651 48 HA ILE 5 HA ILE 5 3.078 1.977 3.295 49 HB ILE 5 HB ILE 5 3.961 -0.890 3.891 50 HG12 ILE 5 2HG1 ILE 5 4.848 0.666 5.663 51 HG13 ILE 5 3HG1 ILE 5 6.116 -0.074 4.697 52 HG21 ILE 5 1HG2 ILE 5 5.710 -0.441 2.177 53 HG22 ILE 5 2HG2 ILE 5 5.009 1.154 1.891 54 HG23 ILE 5 3HG2 ILE 5 4.077 -0.299 1.521 55 HD11 ILE 5 3HD1 ILE 5 6.589 2.249 5.184 56 HD12 ILE 5 1HD1 ILE 5 5.085 2.744 4.409 57 HD13 ILE 5 2HD1 ILE 5 6.377 2.013 3.449 58 H LEU 6 H LEU 6 1.302 2.013 1.981 59 HA LEU 6 HA LEU 6 -0.524 -0.280 1.822 60 HB2 LEU 6 2HB LEU 6 -1.065 2.387 1.870 61 HB3 LEU 6 3HB LEU 6 -0.893 2.211 0.144 62 HG LEU 6 HG LEU 6 -3.223 2.072 0.590 63 HD11 LEU 6 1HD1 LEU 6 -3.944 -0.163 -0.086 64 HD12 LEU 6 2HD1 LEU 6 -2.335 -0.808 0.259 65 HD13 LEU 6 3HD1 LEU 6 -2.556 0.380 -1.028 66 HD21 LEU 6 3HD2 LEU 6 -2.667 0.054 2.782 67 HD22 LEU 6 1HD2 LEU 6 -4.257 0.628 2.271 68 HD23 LEU 6 2HD2 LEU 6 -3.115 1.748 3.001 69 H ILE 7 H ILE 7 0.068 -1.809 0.396 70 HA ILE 7 HA ILE 7 1.323 -1.026 -2.180 71 HB ILE 7 HB ILE 7 1.613 -3.670 -0.668 72 HG12 ILE 7 2HG1 ILE 7 3.655 -1.458 -1.197 73 HG13 ILE 7 3HG1 ILE 7 2.895 -1.799 0.353 74 HG21 ILE 7 1HG2 ILE 7 2.879 -2.821 -3.304 75 HG22 ILE 7 2HG2 ILE 7 1.615 -4.038 -3.112 76 HG23 ILE 7 3HG2 ILE 7 3.220 -4.318 -2.433 77 HD11 ILE 7 3HD1 ILE 7 3.975 -3.981 0.402 78 HD12 ILE 7 1HD1 ILE 7 5.132 -2.658 0.283 79 HD13 ILE 7 2HD1 ILE 7 4.760 -3.628 -1.141 80 H ASN 8 H ASN 8 0.236 -1.514 -3.945 81 HA ASN 8 HA ASN 8 -1.980 -3.475 -3.904 82 HB2 ASN 8 2HB ASN 8 -2.929 -1.237 -3.946 83 HB3 ASN 8 3HB ASN 8 -1.847 -0.741 -5.231 84 HD21 ASN 8 1HD2 ASN 8 -3.512 -3.871 -5.392 85 HD22 ASN 8 2HD2 ASN 8 -4.608 -3.399 -6.634 86 H THR 9 H THR 9 -1.232 -5.110 -5.045 87 HA THR 9 HA THR 9 -0.168 -4.582 -7.751 88 HB THR 9 HB THR 9 1.684 -5.527 -6.494 89 HG1 THR 9 HG1 THR 9 2.137 -6.832 -8.081 90 HG21 THR 9 3HG2 THR 9 1.599 -7.711 -5.361 91 HG22 THR 9 1HG2 THR 9 -0.130 -7.835 -5.704 92 HG23 THR 9 2HG2 THR 9 0.468 -6.578 -4.620 93 H ASN 10 H ASN 10 -1.141 -5.712 -9.372 94 HA ASN 10 HA ASN 10 -3.662 -7.082 -8.827 95 HB2 ASN 10 2HB ASN 10 -2.299 -6.568 -11.506 96 HB3 ASN 10 3HB ASN 10 -3.976 -7.038 -11.254 97 HD21 ASN 10 1HD2 ASN 10 -2.803 -4.707 -12.625 98 HD22 ASN 10 2HD2 ASN 10 -3.534 -3.323 -11.891 99 H ASN 11 H ASN 11 -0.405 -7.787 -9.215 100 HA ASN 11 HA ASN 11 -0.633 -10.432 -10.410 101 HB2 ASN 11 2HB ASN 11 1.820 -8.927 -9.378 102 HB3 ASN 11 3HB ASN 11 1.847 -10.437 -10.287 103 HD21 ASN 11 1HD2 ASN 11 3.105 -9.499 -11.944 104 HD22 ASN 11 2HD2 ASN 11 2.442 -8.362 -13.065 105 H ASP 12 H ASP 12 -1.140 -12.106 -9.174 106 HA ASP 12 HA ASP 12 -1.270 -12.168 -6.373 107 HB2 ASP 12 2HB ASP 12 -2.649 -13.650 -7.706 108 HB3 ASP 12 3HB ASP 12 -1.235 -14.407 -8.431 109 H GLU 13 H GLU 13 1.220 -13.305 -8.617 110 HA GLU 13 HA GLU 13 2.807 -14.687 -6.706 111 HB2 GLU 13 2HB GLU 13 3.525 -13.565 -9.448 112 HB3 GLU 13 3HB GLU 13 4.593 -14.592 -8.487 113 HG2 GLU 13 2HG GLU 13 2.901 -16.406 -8.540 114 HG3 GLU 13 3HG GLU 13 1.841 -15.379 -9.503 115 H LEU 14 H LEU 14 2.658 -11.304 -7.708 116 HA LEU 14 HA LEU 14 5.056 -10.527 -6.337 117 HB2 LEU 14 2HB LEU 14 2.825 -9.020 -7.671 118 HB3 LEU 14 3HB LEU 14 3.787 -8.150 -6.489 119 HG LEU 14 HG LEU 14 4.619 -7.826 -8.803 120 HD11 LEU 14 1HD1 LEU 14 6.170 -7.556 -6.936 121 HD12 LEU 14 2HD1 LEU 14 6.998 -8.223 -8.338 122 HD13 LEU 14 3HD1 LEU 14 6.577 -9.275 -6.984 123 HD21 LEU 14 3HD2 LEU 14 5.315 -10.784 -8.757 124 HD22 LEU 14 1HD2 LEU 14 5.712 -9.627 -10.030 125 HD23 LEU 14 2HD2 LEU 14 4.033 -10.046 -9.720 126 H ILE 15 H ILE 15 1.721 -10.955 -5.311 127 HA ILE 15 HA ILE 15 1.942 -9.661 -2.799 128 HB ILE 15 HB ILE 15 0.269 -12.137 -3.452 129 HG12 ILE 15 2HG1 ILE 15 -0.498 -9.181 -3.554 130 HG13 ILE 15 3HG1 ILE 15 -0.254 -10.222 -4.949 131 HG21 ILE 15 1HG2 ILE 15 -0.009 -10.158 -1.150 132 HG22 ILE 15 2HG2 ILE 15 0.519 -11.837 -1.019 133 HG23 ILE 15 3HG2 ILE 15 -1.133 -11.470 -1.510 134 HD11 ILE 15 3HD1 ILE 15 -2.179 -11.576 -4.262 135 HD12 ILE 15 1HD1 ILE 15 -2.600 -9.884 -4.527 136 HD13 ILE 15 2HD1 ILE 15 -2.432 -10.500 -2.884 137 H LYS 16 H LYS 16 2.450 -13.138 -3.678 138 HA LYS 16 HA LYS 16 3.276 -13.957 -1.098 139 HB2 LYS 16 2HB LYS 16 3.992 -16.067 -2.133 140 HB3 LYS 16 3HB LYS 16 2.426 -15.565 -2.760 141 HG2 LYS 16 2HG LYS 16 3.541 -14.695 -4.796 142 HG3 LYS 16 3HG LYS 16 5.090 -15.264 -4.182 143 HD2 LYS 16 2HD LYS 16 2.703 -17.035 -4.852 144 HD3 LYS 16 3HD LYS 16 4.106 -16.780 -5.888 145 HE2 LYS 16 2HE LYS 16 5.543 -17.750 -4.049 146 HE3 LYS 16 3HE LYS 16 4.059 -18.155 -3.181 147 HZ1 LYS 16 3HZ LYS 16 4.869 -19.165 -5.860 148 HZ2 LYS 16 1HZ LYS 16 3.383 -19.489 -5.124 149 HZ3 LYS 16 2HZ LYS 16 4.811 -20.057 -4.425 150 H LYS 17 H LYS 17 5.150 -12.678 -3.816 151 HA LYS 17 HA LYS 17 7.750 -13.090 -2.746 152 HB2 LYS 17 2HB LYS 17 6.694 -11.018 -4.709 153 HB3 LYS 17 3HB LYS 17 8.404 -11.204 -4.327 154 HG2 LYS 17 2HG LYS 17 8.462 -13.427 -5.279 155 HG3 LYS 17 3HG LYS 17 6.706 -13.456 -5.450 156 HD2 LYS 17 2HD LYS 17 7.758 -13.061 -7.625 157 HD3 LYS 17 3HD LYS 17 6.830 -11.645 -7.129 158 HE2 LYS 17 2HE LYS 17 8.986 -11.008 -8.123 159 HE3 LYS 17 3HE LYS 17 8.911 -10.525 -6.426 160 HZ1 LYS 17 3HZ LYS 17 10.324 -12.888 -7.545 161 HZ2 LYS 17 1HZ LYS 17 10.168 -12.572 -5.891 162 HZ3 LYS 17 2HZ LYS 17 11.030 -11.510 -6.875 163 H ILE 18 H ILE 18 5.719 -10.131 -2.767 164 HA ILE 18 HA ILE 18 7.439 -8.489 -1.261 165 HB ILE 18 HB ILE 18 4.447 -8.290 -1.828 166 HG12 ILE 18 2HG1 ILE 18 6.800 -6.642 -2.882 167 HG13 ILE 18 3HG1 ILE 18 6.058 -7.984 -3.741 168 HG21 ILE 18 1HG2 ILE 18 6.124 -6.187 -0.419 169 HG22 ILE 18 2HG2 ILE 18 4.804 -7.116 0.297 170 HG23 ILE 18 3HG2 ILE 18 4.471 -5.964 -0.996 171 HD11 ILE 18 3HD1 ILE 18 5.294 -5.894 -4.646 172 HD12 ILE 18 1HD1 ILE 18 4.741 -5.356 -3.058 173 HD13 ILE 18 2HD1 ILE 18 3.949 -6.716 -3.859 174 H LYS 19 H LYS 19 4.879 -10.727 -0.208 175 HA LYS 19 HA LYS 19 4.615 -9.961 2.473 176 HB2 LYS 19 2HB LYS 19 4.318 -12.732 1.227 177 HB3 LYS 19 3HB LYS 19 3.923 -12.379 2.907 178 HG2 LYS 19 2HG LYS 19 2.293 -10.621 2.016 179 HG3 LYS 19 3HG LYS 19 2.547 -11.320 0.424 180 HD2 LYS 19 2HD LYS 19 1.463 -12.800 2.854 181 HD3 LYS 19 3HD LYS 19 0.495 -12.201 1.507 182 HE2 LYS 19 2HE LYS 19 1.735 -13.740 -0.019 183 HE3 LYS 19 3HE LYS 19 2.617 -14.368 1.376 184 HZ1 LYS 19 3HZ LYS 19 0.741 -15.792 0.809 185 HZ2 LYS 19 1HZ LYS 19 -0.334 -14.497 0.995 186 HZ3 LYS 19 2HZ LYS 19 0.511 -15.095 2.331 187 H LYS 20 H LYS 20 6.969 -12.144 0.934 188 HA LYS 20 HA LYS 20 8.231 -13.001 3.355 189 HB2 LYS 20 2HB LYS 20 9.269 -13.004 0.483 190 HB3 LYS 20 3HB LYS 20 10.022 -13.856 1.825 191 HG2 LYS 20 2HG LYS 20 7.275 -14.419 0.669 192 HG3 LYS 20 3HG LYS 20 8.726 -15.379 0.404 193 HD2 LYS 20 2HD LYS 20 7.316 -14.999 3.076 194 HD3 LYS 20 3HD LYS 20 7.210 -16.428 2.047 195 HE2 LYS 20 2HE LYS 20 9.748 -15.404 3.357 196 HE3 LYS 20 3HE LYS 20 8.776 -16.747 3.935 197 HZ1 LYS 20 3HZ LYS 20 10.093 -16.690 1.274 198 HZ2 LYS 20 1HZ LYS 20 9.320 -18.005 2.002 199 HZ3 LYS 20 2HZ LYS 20 10.759 -17.406 2.650 200 H GLU 21 H GLU 21 9.173 -10.711 0.807 201 HA GLU 21 HA GLU 21 11.569 -9.740 1.683 202 HB2 GLU 21 2HB GLU 21 9.411 -7.925 0.530 203 HB3 GLU 21 3HB GLU 21 11.149 -7.685 0.426 204 HG2 GLU 21 2HG GLU 21 9.461 -9.733 -1.002 205 HG3 GLU 21 3HG GLU 21 10.392 -8.421 -1.710 206 H VAL 22 H VAL 22 8.399 -8.434 2.634 207 HA VAL 22 HA VAL 22 9.640 -6.293 4.168 208 HB VAL 22 HB VAL 22 7.451 -5.308 4.328 209 HG11 VAL 22 1HG1 VAL 22 7.871 -6.513 1.562 210 HG12 VAL 22 2HG1 VAL 22 8.614 -5.039 2.187 211 HG13 VAL 22 3HG1 VAL 22 6.872 -5.100 1.923 212 HG21 VAL 22 3HG2 VAL 22 6.325 -7.920 3.245 213 HG22 VAL 22 1HG2 VAL 22 5.402 -6.427 3.441 214 HG23 VAL 22 2HG2 VAL 22 6.068 -7.244 4.854 215 H GLU 23 H GLU 23 8.010 -9.326 4.824 216 HA GLU 23 HA GLU 23 7.489 -8.981 7.599 217 HB2 GLU 23 2HB GLU 23 6.716 -10.852 5.935 218 HB3 GLU 23 3HB GLU 23 8.239 -11.633 6.300 219 HG2 GLU 23 2HG GLU 23 6.172 -10.942 8.408 220 HG3 GLU 23 3HG GLU 23 6.187 -12.468 7.537 221 H ASN 24 H ASN 24 10.296 -9.977 5.720 222 HA ASN 24 HA ASN 24 12.047 -10.611 7.878 223 HB2 ASN 24 2HB ASN 24 12.391 -11.464 5.573 224 HB3 ASN 24 3HB ASN 24 12.686 -9.828 4.996 225 HD21 ASN 24 1HD2 ASN 24 13.959 -12.436 6.964 226 HD22 ASN 24 2HD2 ASN 24 15.599 -11.889 6.966 227 H GLN 25 H GLN 25 11.130 -7.601 6.301 228 HA GLN 25 HA GLN 25 13.337 -6.052 7.417 229 HB2 GLN 25 2HB GLN 25 10.857 -5.024 5.980 230 HB3 GLN 25 3HB GLN 25 12.325 -4.118 6.314 231 HG2 GLN 25 2HG GLN 25 11.995 -6.403 4.365 232 HG3 GLN 25 3HG GLN 25 12.271 -4.713 3.984 233 HE21 GLN 25 1HE2 GLN 25 13.717 -7.696 4.947 234 HE22 GLN 25 2HE2 GLN 25 15.362 -7.184 4.838 235 H GLY 26 H GLY 26 10.626 -7.298 8.861 236 HA2 GLY 26 2HA GLY 26 9.897 -6.873 11.030 237 HA3 GLY 26 3HA GLY 26 10.654 -5.293 10.984 238 H TYR 27 H TYR 27 8.744 -5.651 8.233 239 HA TYR 27 HA TYR 27 6.673 -3.918 9.385 240 HB2 TYR 27 2HB TYR 27 7.429 -4.522 6.490 241 HB3 TYR 27 3HB TYR 27 6.012 -3.571 6.933 242 HD1 TYR 27 HD2 TYR 27 9.740 -3.664 7.198 243 HD2 TYR 27 HD1 TYR 27 6.235 -1.231 7.496 244 HE1 TYR 27 HE2 TYR 27 11.148 -1.657 7.391 245 HE2 TYR 27 HE1 TYR 27 7.648 0.778 7.697 246 HH TYR 27 HH TYR 27 11.004 0.767 7.052 247 H GLN 28 H GLN 28 4.634 -4.566 9.718 248 HA GLN 28 HA GLN 28 4.168 -7.401 9.797 249 HB2 GLN 28 2HB GLN 28 2.279 -5.153 10.606 250 HB3 GLN 28 3HB GLN 28 2.146 -6.847 11.068 251 HG2 GLN 28 2HG GLN 28 4.266 -4.874 11.939 252 HG3 GLN 28 3HG GLN 28 3.003 -5.587 12.934 253 HE21 GLN 28 1HE2 GLN 28 6.126 -6.027 11.534 254 HE22 GLN 28 2HE2 GLN 28 6.499 -7.528 12.298 255 H VAL 29 H VAL 29 3.438 -8.487 8.132 256 HA VAL 29 HA VAL 29 2.190 -7.323 5.840 257 HB VAL 29 HB VAL 29 2.432 -10.295 6.510 258 HG11 VAL 29 1HG1 VAL 29 2.038 -8.905 3.831 259 HG12 VAL 29 2HG1 VAL 29 0.807 -9.812 4.712 260 HG13 VAL 29 3HG1 VAL 29 2.227 -10.643 4.080 261 HG21 VAL 29 3HG2 VAL 29 4.492 -10.284 5.143 262 HG22 VAL 29 1HG2 VAL 29 4.648 -9.242 6.562 263 HG23 VAL 29 2HG2 VAL 29 4.368 -8.532 4.973 264 H ARG 30 H ARG 30 0.125 -6.766 5.754 265 HA ARG 30 HA ARG 30 -1.993 -8.564 6.788 266 HB2 ARG 30 2HB ARG 30 -2.007 -5.529 6.380 267 HB3 ARG 30 3HB ARG 30 -3.456 -6.469 6.716 268 HG2 ARG 30 2HG ARG 30 -1.068 -6.376 8.581 269 HG3 ARG 30 3HG ARG 30 -2.448 -5.282 8.702 270 HD2 ARG 30 2HD ARG 30 -2.562 -8.308 8.924 271 HD3 ARG 30 3HD ARG 30 -2.665 -7.161 10.265 272 HE ARG 30 HE ARG 30 -4.669 -6.393 8.558 273 HH11 ARG 30 1HH1 ARG 30 -3.931 -9.423 10.236 274 HH12 ARG 30 2HH1 ARG 30 -5.606 -9.886 10.336 275 HH21 ARG 30 1HH2 ARG 30 -6.837 -7.018 8.733 276 HH22 ARG 30 2HH2 ARG 30 -7.244 -8.532 9.492 277 H ASP 31 H ASP 31 -3.599 -9.138 5.320 278 HA ASP 31 HA ASP 31 -3.456 -8.059 2.552 279 HB2 ASP 31 2HB ASP 31 -2.494 -10.355 2.622 280 HB3 ASP 31 3HB ASP 31 -3.934 -10.961 3.420 281 H VAL 32 H VAL 32 -5.328 -7.066 2.073 282 HA VAL 32 HA VAL 32 -7.814 -7.796 3.535 283 HB VAL 32 HB VAL 32 -7.136 -5.087 2.279 284 HG11 VAL 32 1HG1 VAL 32 -9.141 -4.257 3.451 285 HG12 VAL 32 2HG1 VAL 32 -9.479 -5.880 4.057 286 HG13 VAL 32 3HG1 VAL 32 -9.560 -5.549 2.324 287 HG21 VAL 32 3HG2 VAL 32 -5.698 -5.486 4.230 288 HG22 VAL 32 1HG2 VAL 32 -7.112 -5.856 5.221 289 HG23 VAL 32 2HG2 VAL 32 -6.886 -4.228 4.581 290 H ASN 33 H ASN 33 -9.105 -8.938 2.249 291 HA ASN 33 HA ASN 33 -9.460 -8.163 -0.592 292 HB2 ASN 33 2HB ASN 33 -9.792 -10.583 -1.100 293 HB3 ASN 33 3HB ASN 33 -8.169 -10.241 -0.510 294 HD21 ASN 33 1HD2 ASN 33 -7.596 -10.958 1.606 295 HD22 ASN 33 2HD2 ASN 33 -8.489 -12.204 2.407 296 H ASP 34 H ASP 34 -10.918 -7.804 2.175 297 HA ASP 34 HA ASP 34 -13.629 -8.041 1.092 298 HB2 ASP 34 2HB ASP 34 -13.427 -10.167 2.221 299 HB3 ASP 34 3HB ASP 34 -12.666 -9.433 3.624 300 H SER 35 H SER 35 -15.077 -6.570 1.928 301 HA SER 35 HA SER 35 -14.122 -4.128 2.863 302 HB2 SER 35 2HB SER 35 -16.992 -5.142 2.891 303 HB3 SER 35 3HB SER 35 -16.482 -3.452 2.946 304 HG SER 35 HG SER 35 -15.399 -4.825 0.832 305 H ASP 36 H ASP 36 -15.785 -6.736 4.673 306 HA ASP 36 HA ASP 36 -16.028 -5.272 7.111 307 HB2 ASP 36 2HB ASP 36 -16.280 -8.217 6.440 308 HB3 ASP 36 3HB ASP 36 -16.241 -7.721 8.127 309 H GLU 37 H GLU 37 -13.475 -7.307 5.785 310 HA GLU 37 HA GLU 37 -11.827 -7.466 8.104 311 HB2 GLU 37 2HB GLU 37 -11.054 -7.490 5.148 312 HB3 GLU 37 3HB GLU 37 -9.965 -7.897 6.467 313 HG2 GLU 37 2HG GLU 37 -12.479 -9.393 5.703 314 HG3 GLU 37 3HG GLU 37 -10.831 -9.898 5.358 315 H LEU 38 H LEU 38 -12.022 -5.182 5.393 316 HA LEU 38 HA LEU 38 -9.989 -3.393 6.031 317 HB2 LEU 38 2HB LEU 38 -11.077 -3.428 3.882 318 HB3 LEU 38 3HB LEU 38 -12.631 -3.040 4.577 319 HG LEU 38 HG LEU 38 -10.461 -0.960 4.894 320 HD11 LEU 38 1HD1 LEU 38 -11.872 -1.421 2.252 321 HD12 LEU 38 2HD1 LEU 38 -10.151 -1.666 2.569 322 HD13 LEU 38 3HD1 LEU 38 -10.838 -0.048 2.667 323 HD21 LEU 38 3HD2 LEU 38 -12.728 -0.519 5.796 324 HD22 LEU 38 1HD2 LEU 38 -13.415 -0.727 4.182 325 HD23 LEU 38 2HD2 LEU 38 -12.320 0.619 4.514 326 H LYS 39 H LYS 39 -13.476 -3.073 6.737 327 HA LYS 39 HA LYS 39 -13.411 -0.671 8.132 328 HB2 LYS 39 2HB LYS 39 -15.393 -2.980 8.235 329 HB3 LYS 39 3HB LYS 39 -15.673 -1.452 9.067 330 HG2 LYS 39 2HG LYS 39 -15.676 -0.238 6.946 331 HG3 LYS 39 3HG LYS 39 -15.248 -1.705 6.064 332 HD2 LYS 39 2HD LYS 39 -17.846 -1.315 7.623 333 HD3 LYS 39 3HD LYS 39 -17.683 -1.127 5.877 334 HE2 LYS 39 2HE LYS 39 -17.034 -3.498 5.672 335 HE3 LYS 39 3HE LYS 39 -17.164 -3.696 7.420 336 HZ1 LYS 39 3HZ LYS 39 -19.532 -3.235 7.257 337 HZ2 LYS 39 1HZ LYS 39 -19.118 -4.536 6.254 338 HZ3 LYS 39 2HZ LYS 39 -19.403 -3.008 5.590 339 H LYS 40 H LYS 40 -13.075 -3.991 9.343 340 HA LYS 40 HA LYS 40 -13.118 -3.427 12.113 341 HB2 LYS 40 2HB LYS 40 -12.043 -5.753 10.503 342 HB3 LYS 40 3HB LYS 40 -11.722 -5.666 12.225 343 HG2 LYS 40 2HG LYS 40 -14.249 -5.471 12.563 344 HG3 LYS 40 3HG LYS 40 -14.419 -5.907 10.862 345 HD2 LYS 40 2HD LYS 40 -13.053 -7.595 13.000 346 HD3 LYS 40 3HD LYS 40 -14.673 -7.865 12.363 347 HE2 LYS 40 2HE LYS 40 -12.136 -7.983 10.693 348 HE3 LYS 40 3HE LYS 40 -12.951 -9.388 11.381 349 HZ1 LYS 40 3HZ LYS 40 -14.221 -7.490 9.493 350 HZ2 LYS 40 1HZ LYS 40 -14.871 -8.943 10.067 351 HZ3 LYS 40 2HZ LYS 40 -13.522 -8.964 9.044 352 H GLU 41 H GLU 41 -10.337 -3.695 9.820 353 HA GLU 41 HA GLU 41 -8.488 -3.323 12.034 354 HB2 GLU 41 2HB GLU 41 -6.697 -3.717 10.454 355 HB3 GLU 41 3HB GLU 41 -7.942 -4.944 10.308 356 HG2 GLU 41 2HG GLU 41 -8.808 -3.587 8.291 357 HG3 GLU 41 3HG GLU 41 -7.270 -2.719 8.390 358 H MET 42 H MET 42 -10.052 -1.259 9.721 359 HA MET 42 HA MET 42 -8.351 1.023 9.936 360 HB2 MET 42 2HB MET 42 -11.353 0.855 9.426 361 HB3 MET 42 3HB MET 42 -10.421 2.342 9.316 362 HG2 MET 42 2HG MET 42 -9.954 -0.091 7.582 363 HG3 MET 42 3HG MET 42 -10.935 1.291 7.125 364 HE1 MET 42 3HE MET 42 -7.257 0.453 8.470 365 HE2 MET 42 1HE MET 42 -6.376 1.021 7.055 366 HE3 MET 42 2HE MET 42 -7.532 -0.302 6.899 367 H LYS 43 H LYS 43 -11.158 -0.130 11.785 368 HA LYS 43 HA LYS 43 -11.329 1.950 13.684 369 HB2 LYS 43 2HB LYS 43 -12.079 -0.987 13.963 370 HB3 LYS 43 3HB LYS 43 -12.521 0.256 15.126 371 HG2 LYS 43 2HG LYS 43 -13.385 0.229 12.224 372 HG3 LYS 43 3HG LYS 43 -14.358 -0.367 13.570 373 HD2 LYS 43 2HD LYS 43 -14.470 1.869 14.542 374 HD3 LYS 43 3HD LYS 43 -13.371 2.502 13.310 375 HE2 LYS 43 2HE LYS 43 -15.747 3.061 12.845 376 HE3 LYS 43 3HE LYS 43 -15.035 2.075 11.564 377 HZ1 LYS 43 3HZ LYS 43 -16.096 0.117 12.588 378 HZ2 LYS 43 1HZ LYS 43 -17.225 1.276 12.097 379 HZ3 LYS 43 2HZ LYS 43 -16.835 1.115 13.735 380 H LYS 44 H LYS 44 -9.483 -1.063 13.616 381 HA LYS 44 HA LYS 44 -8.537 -1.085 16.253 382 HB2 LYS 44 2HB LYS 44 -7.363 -2.348 13.749 383 HB3 LYS 44 3HB LYS 44 -6.717 -2.633 15.360 384 HG2 LYS 44 2HG LYS 44 -9.520 -3.340 14.433 385 HG3 LYS 44 3HG LYS 44 -8.183 -4.469 14.624 386 HD2 LYS 44 2HD LYS 44 -9.465 -2.866 16.872 387 HD3 LYS 44 3HD LYS 44 -9.783 -4.564 16.517 388 HE2 LYS 44 2HE LYS 44 -7.098 -3.417 17.358 389 HE3 LYS 44 3HE LYS 44 -8.203 -4.312 18.397 390 HZ1 LYS 44 3HZ LYS 44 -6.422 -5.708 17.565 391 HZ2 LYS 44 1HZ LYS 44 -6.878 -5.392 15.970 392 HZ3 LYS 44 2HZ LYS 44 -7.916 -6.247 16.990 393 H LEU 45 H LEU 45 -7.120 0.416 13.332 394 HA LEU 45 HA LEU 45 -4.574 1.079 14.204 395 HB2 LEU 45 2HB LEU 45 -6.421 2.820 12.521 396 HB3 LEU 45 3HB LEU 45 -4.681 3.033 12.646 397 HG LEU 45 HG LEU 45 -6.101 0.661 11.375 398 HD11 LEU 45 1HD1 LEU 45 -6.276 2.672 10.021 399 HD12 LEU 45 2HD1 LEU 45 -5.174 1.526 9.263 400 HD13 LEU 45 3HD1 LEU 45 -4.532 2.931 10.120 401 HD21 LEU 45 3HD2 LEU 45 -3.123 1.209 11.584 402 HD22 LEU 45 1HD2 LEU 45 -3.872 -0.087 10.649 403 HD23 LEU 45 2HD2 LEU 45 -4.012 -0.079 12.404 404 H ALA 46 H ALA 46 -7.615 2.786 14.786 405 HA ALA 46 HA ALA 46 -6.451 5.031 16.184 406 HB1 ALA 46 3HB ALA 46 -8.784 5.775 16.431 407 HB2 ALA 46 1HB ALA 46 -9.354 4.207 15.839 408 HB3 ALA 46 2HB ALA 46 -8.450 5.281 14.772 409 H GLU 47 H GLU 47 -7.568 1.882 17.116 410 HA GLU 47 HA GLU 47 -8.273 2.578 19.872 411 HB2 GLU 47 2HB GLU 47 -8.184 -0.112 18.428 412 HB3 GLU 47 3HB GLU 47 -8.761 0.129 20.076 413 HG2 GLU 47 2HG GLU 47 -10.581 1.583 19.219 414 HG3 GLU 47 3HG GLU 47 -9.998 1.319 17.578 415 H GLU 48 H GLU 48 -5.899 0.524 18.207 416 HA GLU 48 HA GLU 48 -4.247 0.428 20.655 417 HB2 GLU 48 2HB GLU 48 -3.020 -1.509 19.440 418 HB3 GLU 48 3HB GLU 48 -4.579 -1.820 20.175 419 HG2 GLU 48 2HG GLU 48 -4.741 -2.991 18.191 420 HG3 GLU 48 3HG GLU 48 -5.532 -1.478 17.777 421 H LYS 49 H LYS 49 -3.287 2.290 20.555 422 HA LYS 49 HA LYS 49 -2.299 3.543 18.140 423 HB2 LYS 49 2HB LYS 49 -2.249 4.425 21.056 424 HB3 LYS 49 3HB LYS 49 -1.832 5.445 19.682 425 HG2 LYS 49 2HG LYS 49 -4.109 5.407 18.864 426 HG3 LYS 49 3HG LYS 49 -4.561 4.182 20.053 427 HD2 LYS 49 2HD LYS 49 -5.373 6.394 20.739 428 HD3 LYS 49 3HD LYS 49 -4.180 5.781 21.883 429 HE2 LYS 49 2HE LYS 49 -2.462 7.232 20.820 430 HE3 LYS 49 3HE LYS 49 -3.697 7.866 19.731 431 HZ1 LYS 49 3HZ LYS 49 -3.357 9.342 21.607 432 HZ2 LYS 49 1HZ LYS 49 -3.719 8.103 22.702 433 HZ3 LYS 49 2HZ LYS 49 -4.914 8.692 21.658 434 H ASN 50 H ASN 50 -0.932 1.078 19.124 435 HA ASN 50 HA ASN 50 1.602 1.701 20.208 436 HB2 ASN 50 2HB ASN 50 2.226 -0.633 19.413 437 HB3 ASN 50 3HB ASN 50 0.810 -0.551 20.452 438 HD21 ASN 50 1HD2 ASN 50 -0.031 -2.502 19.727 439 HD22 ASN 50 2HD2 ASN 50 -0.684 -2.717 18.140 440 H PHE 51 H PHE 51 3.646 1.206 19.037 441 HA PHE 51 HA PHE 51 3.787 3.038 16.759 442 HB2 PHE 51 2HB PHE 51 5.140 3.025 19.089 443 HB3 PHE 51 3HB PHE 51 6.212 1.949 18.210 444 HD1 PHE 51 HD2 PHE 51 4.393 5.162 17.471 445 HD2 PHE 51 HD1 PHE 51 8.121 3.062 17.441 446 HE1 PHE 51 HE2 PHE 51 5.506 7.144 16.546 447 HE2 PHE 51 HE1 PHE 51 9.224 5.056 16.523 448 HZ PHE 51 HZ PHE 51 7.923 7.094 16.068 449 H GLU 52 H GLU 52 2.835 0.295 16.354 450 HA GLU 52 HA GLU 52 4.990 -1.177 15.034 451 HB2 GLU 52 2HB GLU 52 2.043 -1.916 15.311 452 HB3 GLU 52 3HB GLU 52 3.333 -2.978 14.761 453 HG2 GLU 52 2HG GLU 52 2.961 -1.850 17.548 454 HG3 GLU 52 3HG GLU 52 2.746 -3.525 17.046 455 H LYS 53 H LYS 53 5.390 -1.026 12.908 456 HA LYS 53 HA LYS 53 3.709 0.578 11.168 457 HB2 LYS 53 2HB LYS 53 6.443 -0.690 10.780 458 HB3 LYS 53 3HB LYS 53 5.563 0.029 9.434 459 HG2 LYS 53 2HG LYS 53 7.131 1.656 10.285 460 HG3 LYS 53 3HG LYS 53 5.488 2.185 10.645 461 HD2 LYS 53 2HD LYS 53 5.869 1.123 12.990 462 HD3 LYS 53 3HD LYS 53 7.577 1.095 12.552 463 HE2 LYS 53 2HE LYS 53 7.502 3.549 12.204 464 HE3 LYS 53 3HE LYS 53 5.800 3.549 12.686 465 HZ1 LYS 53 3HZ LYS 53 8.022 2.586 14.403 466 HZ2 LYS 53 1HZ LYS 53 6.407 2.801 14.854 467 HZ3 LYS 53 2HZ LYS 53 7.368 4.142 14.481 468 H ILE 54 H ILE 54 2.132 -0.219 9.998 469 HA ILE 54 HA ILE 54 1.910 -3.141 9.635 470 HB ILE 54 HB ILE 54 -0.294 -1.031 9.676 471 HG12 ILE 54 2HG1 ILE 54 0.720 -1.260 11.925 472 HG13 ILE 54 3HG1 ILE 54 -0.917 -1.888 11.907 473 HG21 ILE 54 1HG2 ILE 54 -0.917 -2.956 8.313 474 HG22 ILE 54 2HG2 ILE 54 -1.858 -2.936 9.804 475 HG23 ILE 54 3HG2 ILE 54 -0.506 -4.057 9.632 476 HD11 ILE 54 3HD1 ILE 54 1.623 -3.509 11.901 477 HD12 ILE 54 1HD1 ILE 54 -0.007 -4.184 11.820 478 HD13 ILE 54 2HD1 ILE 54 0.507 -3.283 13.246 479 H LEU 55 H LEU 55 2.444 -3.707 7.630 480 HA LEU 55 HA LEU 55 2.043 -1.949 5.325 481 HB2 LEU 55 2HB LEU 55 4.175 -3.176 5.699 482 HB3 LEU 55 3HB LEU 55 3.334 -4.706 5.540 483 HG LEU 55 HG LEU 55 3.084 -2.797 3.219 484 HD11 LEU 55 1HD1 LEU 55 5.429 -2.513 3.756 485 HD12 LEU 55 2HD1 LEU 55 5.256 -3.448 2.275 486 HD13 LEU 55 3HD1 LEU 55 5.668 -4.259 3.785 487 HD21 LEU 55 3HD2 LEU 55 3.560 -5.794 3.331 488 HD22 LEU 55 1HD2 LEU 55 3.258 -4.842 1.875 489 HD23 LEU 55 2HD2 LEU 55 2.000 -4.999 3.098 490 H ILE 56 H ILE 56 0.248 -2.118 4.109 491 HA ILE 56 HA ILE 56 -1.546 -4.451 4.398 492 HB ILE 56 HB ILE 56 -2.134 -1.748 3.087 493 HG12 ILE 56 2HG1 ILE 56 -1.741 -1.463 5.542 494 HG13 ILE 56 3HG1 ILE 56 -3.397 -1.100 5.081 495 HG21 ILE 56 1HG2 ILE 56 -4.510 -2.441 3.211 496 HG22 ILE 56 2HG2 ILE 56 -4.020 -4.006 3.859 497 HG23 ILE 56 3HG2 ILE 56 -3.553 -3.545 2.221 498 HD11 ILE 56 3HD1 ILE 56 -3.288 -2.285 7.187 499 HD12 ILE 56 1HD1 ILE 56 -2.446 -3.628 6.420 500 HD13 ILE 56 2HD1 ILE 56 -4.118 -3.263 5.977 501 H ILE 57 H ILE 57 -1.902 -5.763 2.629 502 HA ILE 57 HA ILE 57 -1.094 -4.850 -0.069 503 HB ILE 57 HB ILE 57 -1.171 -7.735 0.957 504 HG12 ILE 57 2HG1 ILE 57 1.206 -6.024 0.083 505 HG13 ILE 57 3HG1 ILE 57 0.836 -6.490 1.736 506 HG21 ILE 57 1HG2 ILE 57 -0.493 -6.700 -1.823 507 HG22 ILE 57 2HG2 ILE 57 -1.935 -7.617 -1.380 508 HG23 ILE 57 3HG2 ILE 57 -0.345 -8.376 -1.292 509 HD11 ILE 57 3HD1 ILE 57 1.634 -8.366 -0.493 510 HD12 ILE 57 1HD1 ILE 57 1.255 -8.831 1.169 511 HD13 ILE 57 2HD1 ILE 57 2.648 -7.807 0.837 512 H SER 58 H SER 58 -2.807 -4.465 -1.299 513 HA SER 58 HA SER 58 -5.242 -6.116 -1.061 514 HB2 SER 58 2HB SER 58 -5.668 -3.848 -0.011 515 HB3 SER 58 3HB SER 58 -5.277 -3.100 -1.559 516 HG SER 58 HG SER 58 -7.467 -4.781 -0.913 517 H ASN 59 H ASN 59 -5.981 -6.787 -2.982 518 HA ASN 59 HA ASN 59 -4.519 -6.188 -5.445 519 HB2 ASN 59 2HB ASN 59 -5.038 -8.548 -4.882 520 HB3 ASN 59 3HB ASN 59 -6.757 -8.185 -4.821 521 HD21 ASN 59 1HD2 ASN 59 -7.893 -7.935 -6.760 522 HD22 ASN 59 2HD2 ASN 59 -7.248 -8.402 -8.292 523 H ASP 60 H ASP 60 -7.397 -5.279 -3.789 524 HA ASP 60 HA ASP 60 -8.946 -4.733 -6.229 525 HB2 ASP 60 2HB ASP 60 -10.040 -6.097 -4.469 526 HB3 ASP 60 3HB ASP 60 -9.824 -4.795 -3.308 527 H LYS 61 H LYS 61 -9.495 -2.727 -6.820 528 HA LYS 61 HA LYS 61 -7.915 -0.542 -5.879 529 HB2 LYS 61 2HB LYS 61 -10.186 -0.539 -7.909 530 HB3 LYS 61 3HB LYS 61 -8.958 0.705 -7.727 531 HG2 LYS 61 2HG LYS 61 -8.447 -2.156 -8.609 532 HG3 LYS 61 3HG LYS 61 -8.529 -0.751 -9.673 533 HD2 LYS 61 2HD LYS 61 -6.531 0.207 -8.632 534 HD3 LYS 61 3HD LYS 61 -6.481 -1.099 -7.445 535 HE2 LYS 61 2HE LYS 61 -6.014 -2.728 -9.208 536 HE3 LYS 61 3HE LYS 61 -6.161 -1.480 -10.444 537 HZ1 LYS 61 3HZ LYS 61 -3.854 -1.906 -9.967 538 HZ2 LYS 61 1HZ LYS 61 -4.085 -1.606 -8.324 539 HZ3 LYS 61 2HZ LYS 61 -4.240 -0.350 -9.439 540 H GLN 62 H GLN 62 -11.305 -1.478 -5.566 541 HA GLN 62 HA GLN 62 -12.371 0.993 -4.656 542 HB2 GLN 62 2HB GLN 62 -13.773 -0.767 -5.642 543 HB3 GLN 62 3HB GLN 62 -13.381 -1.865 -4.326 544 HG2 GLN 62 2HG GLN 62 -14.619 -0.466 -2.749 545 HG3 GLN 62 3HG GLN 62 -14.922 0.728 -4.014 546 HE21 GLN 62 1HE2 GLN 62 -16.441 0.236 -5.649 547 HE22 GLN 62 2HE2 GLN 62 -17.576 -1.058 -5.493 548 H LEU 63 H LEU 63 -11.234 -1.948 -2.954 549 HA LEU 63 HA LEU 63 -11.777 -1.152 -0.311 550 HB2 LEU 63 2HB LEU 63 -9.735 -3.089 -1.471 551 HB3 LEU 63 3HB LEU 63 -9.906 -2.846 0.261 552 HG LEU 63 HG LEU 63 -12.069 -3.930 -1.586 553 HD11 LEU 63 1HD1 LEU 63 -10.264 -5.546 -1.242 554 HD12 LEU 63 2HD1 LEU 63 -11.719 -6.059 -0.393 555 HD13 LEU 63 3HD1 LEU 63 -10.380 -5.342 0.508 556 HD21 LEU 63 3HD2 LEU 63 -12.094 -3.533 1.425 557 HD22 LEU 63 1HD2 LEU 63 -13.341 -4.355 0.481 558 HD23 LEU 63 2HD2 LEU 63 -13.050 -2.635 0.240 559 H LEU 64 H LEU 64 -8.832 -0.885 -2.291 560 HA LEU 64 HA LEU 64 -7.090 0.302 -0.508 561 HB2 LEU 64 2HB LEU 64 -6.425 -0.507 -2.683 562 HB3 LEU 64 3HB LEU 64 -7.409 0.689 -3.502 563 HG LEU 64 HG LEU 64 -5.132 1.649 -1.735 564 HD11 LEU 64 1HD1 LEU 64 -3.587 1.519 -3.622 565 HD12 LEU 64 2HD1 LEU 64 -4.797 0.646 -4.566 566 HD13 LEU 64 3HD1 LEU 64 -4.118 -0.078 -3.105 567 HD21 LEU 64 3HD2 LEU 64 -4.987 3.468 -3.404 568 HD22 LEU 64 1HD2 LEU 64 -6.597 3.368 -2.692 569 HD23 LEU 64 2HD2 LEU 64 -6.315 2.739 -4.312 570 H LYS 65 H LYS 65 -9.454 1.901 -2.633 571 HA LYS 65 HA LYS 65 -8.909 4.579 -2.028 572 HB2 LYS 65 2HB LYS 65 -11.440 3.181 -2.956 573 HB3 LYS 65 3HB LYS 65 -11.326 4.934 -2.825 574 HG2 LYS 65 2HG LYS 65 -9.609 5.025 -4.532 575 HG3 LYS 65 3HG LYS 65 -9.464 3.265 -4.550 576 HD2 LYS 65 2HD LYS 65 -10.758 4.188 -6.493 577 HD3 LYS 65 3HD LYS 65 -11.655 3.011 -5.532 578 HE2 LYS 65 2HE LYS 65 -12.998 5.007 -6.239 579 HE3 LYS 65 3HE LYS 65 -12.957 4.757 -4.494 580 HZ1 LYS 65 3HZ LYS 65 -11.261 6.473 -4.330 581 HZ2 LYS 65 1HZ LYS 65 -12.656 7.077 -5.071 582 HZ3 LYS 65 2HZ LYS 65 -11.300 6.700 -6.005 583 H GLU 66 H GLU 66 -11.419 2.436 -0.657 584 HA GLU 66 HA GLU 66 -12.560 4.266 1.136 585 HB2 GLU 66 2HB GLU 66 -12.440 1.226 1.345 586 HB3 GLU 66 3HB GLU 66 -13.543 2.264 2.241 587 HG2 GLU 66 2HG GLU 66 -13.502 1.828 -0.754 588 HG3 GLU 66 3HG GLU 66 -14.697 1.220 0.385 589 H MET 67 H MET 67 -10.001 1.898 1.518 590 HA MET 67 HA MET 67 -9.469 1.991 4.232 591 HB2 MET 67 2HB MET 67 -8.582 0.323 2.634 592 HB3 MET 67 3HB MET 67 -7.563 1.545 1.894 593 HG2 MET 67 2HG MET 67 -6.194 1.685 3.856 594 HG3 MET 67 3HG MET 67 -7.317 0.682 4.776 595 HE1 MET 67 3HE MET 67 -6.898 -2.793 2.964 596 HE2 MET 67 1HE MET 67 -8.055 -1.546 2.496 597 HE3 MET 67 2HE MET 67 -7.780 -1.904 4.203 598 H LEU 68 H LEU 68 -7.907 3.824 1.587 599 HA LEU 68 HA LEU 68 -6.087 5.225 3.232 600 HB2 LEU 68 2HB LEU 68 -7.063 5.692 0.395 601 HB3 LEU 68 3HB LEU 68 -5.844 6.712 1.144 602 HG LEU 68 HG LEU 68 -5.561 3.718 0.671 603 HD11 LEU 68 1HD1 LEU 68 -4.200 6.029 -0.742 604 HD12 LEU 68 2HD1 LEU 68 -5.493 5.028 -1.410 605 HD13 LEU 68 3HD1 LEU 68 -3.930 4.308 -1.035 606 HD21 LEU 68 3HD2 LEU 68 -4.335 4.391 2.666 607 HD22 LEU 68 1HD2 LEU 68 -3.568 5.720 1.789 608 HD23 LEU 68 2HD2 LEU 68 -3.209 4.045 1.359 609 H GLU 69 H GLU 69 -9.330 6.090 2.043 610 HA GLU 69 HA GLU 69 -9.232 8.809 2.951 611 HB2 GLU 69 2HB GLU 69 -11.662 7.091 2.308 612 HB3 GLU 69 3HB GLU 69 -11.677 8.837 2.555 613 HG2 GLU 69 2HG GLU 69 -10.042 9.030 0.619 614 HG3 GLU 69 3HG GLU 69 -10.325 7.319 0.306 615 H LEU 70 H LEU 70 -10.308 5.772 4.419 616 HA LEU 70 HA LEU 70 -11.367 6.884 6.822 617 HB2 LEU 70 2HB LEU 70 -10.359 4.118 6.075 618 HB3 LEU 70 3HB LEU 70 -10.924 4.457 7.703 619 HG LEU 70 HG LEU 70 -12.596 4.750 5.167 620 HD11 LEU 70 1HD1 LEU 70 -12.123 2.399 5.679 621 HD12 LEU 70 2HD1 LEU 70 -13.829 2.787 5.894 622 HD13 LEU 70 3HD1 LEU 70 -12.779 2.614 7.306 623 HD21 LEU 70 3HD2 LEU 70 -13.297 6.349 6.884 624 HD22 LEU 70 1HD2 LEU 70 -13.449 5.045 8.066 625 HD23 LEU 70 2HD2 LEU 70 -14.514 5.096 6.658 626 H ILE 71 H ILE 71 -8.155 5.730 5.890 627 HA ILE 71 HA ILE 71 -6.843 6.057 8.405 628 HB ILE 71 HB ILE 71 -5.702 5.996 5.565 629 HG12 ILE 71 2HG1 ILE 71 -5.737 3.781 7.669 630 HG13 ILE 71 3HG1 ILE 71 -6.855 3.884 6.317 631 HG21 ILE 71 1HG2 ILE 71 -4.209 5.801 8.193 632 HG22 ILE 71 2HG2 ILE 71 -4.107 7.124 7.035 633 HG23 ILE 71 3HG2 ILE 71 -3.507 5.525 6.605 634 HD11 ILE 71 3HD1 ILE 71 -5.092 2.283 5.878 635 HD12 ILE 71 1HD1 ILE 71 -3.862 3.529 6.097 636 HD13 ILE 71 2HD1 ILE 71 -4.997 3.631 4.747 637 H SER 72 H SER 72 -7.600 8.219 5.733 638 HA SER 72 HA SER 72 -5.843 10.357 6.332 639 HB2 SER 72 2HB SER 72 -6.954 10.106 4.133 640 HB3 SER 72 3HB SER 72 -8.529 10.398 4.872 641 HG SER 72 HG SER 72 -6.437 12.281 5.129 642 H LYS 73 H LYS 73 -9.129 9.518 7.407 643 HA LYS 73 HA LYS 73 -9.524 11.964 8.890 644 HB2 LYS 73 2HB LYS 73 -11.125 9.402 9.248 645 HB3 LYS 73 3HB LYS 73 -11.638 11.048 9.584 646 HG2 LYS 73 2HG LYS 73 -11.304 9.703 6.903 647 HG3 LYS 73 3HG LYS 73 -12.782 10.327 7.619 648 HD2 LYS 73 2HD LYS 73 -10.445 12.034 6.681 649 HD3 LYS 73 3HD LYS 73 -11.902 11.718 5.745 650 HE2 LYS 73 2HE LYS 73 -13.268 12.901 7.369 651 HE3 LYS 73 3HE LYS 73 -11.877 13.115 8.441 652 HZ1 LYS 73 3HZ LYS 73 -12.133 14.250 5.700 653 HZ2 LYS 73 1HZ LYS 73 -10.818 14.466 6.737 654 HZ3 LYS 73 2HZ LYS 73 -12.325 15.116 7.139 655 H LEU 74 H LEU 74 -7.827 9.082 9.471 656 HA LEU 74 HA LEU 74 -7.853 9.283 12.394 657 HB2 LEU 74 2HB LEU 74 -6.376 7.378 10.530 658 HB3 LEU 74 3HB LEU 74 -6.389 7.264 12.284 659 HG LEU 74 HG LEU 74 -8.790 6.891 10.457 660 HD11 LEU 74 1HD1 LEU 74 -8.734 4.537 11.173 661 HD12 LEU 74 2HD1 LEU 74 -7.252 4.846 12.083 662 HD13 LEU 74 3HD1 LEU 74 -7.259 5.006 10.326 663 HD21 LEU 74 3HD2 LEU 74 -9.484 7.923 12.556 664 HD22 LEU 74 1HD2 LEU 74 -8.649 6.670 13.478 665 HD23 LEU 74 2HD2 LEU 74 -10.041 6.255 12.472 666 H GLY 75 H GLY 75 -5.757 9.916 9.638 667 HA2 GLY 75 2HA GLY 75 -3.964 11.332 9.415 668 HA3 GLY 75 3HA GLY 75 -4.029 11.679 11.132 669 H TYR 76 H TYR 76 -2.936 9.311 8.732 670 HA TYR 76 HA TYR 76 -0.542 8.774 10.397 671 HB2 TYR 76 2HB TYR 76 -2.021 6.655 8.765 672 HB3 TYR 76 3HB TYR 76 -0.485 6.409 9.593 673 HD1 TYR 76 HD1 TYR 76 -0.599 7.103 12.236 674 HD2 TYR 76 HD2 TYR 76 -3.909 5.817 9.864 675 HE1 TYR 76 HE1 TYR 76 -1.818 6.445 14.266 676 HE2 TYR 76 HE2 TYR 76 -5.114 5.166 11.884 677 HH TYR 76 HH TYR 76 -4.139 6.126 14.974 678 H LYS 77 H LYS 77 1.374 8.367 9.246 679 HA LYS 77 HA LYS 77 1.566 9.481 6.585 680 HB2 LYS 77 2HB LYS 77 3.363 9.904 8.237 681 HB3 LYS 77 3HB LYS 77 3.690 8.178 8.352 682 HG2 LYS 77 2HG LYS 77 5.373 9.274 6.959 683 HG3 LYS 77 3HG LYS 77 4.421 8.152 5.986 684 HD2 LYS 77 2HD LYS 77 3.064 10.096 5.156 685 HD3 LYS 77 3HD LYS 77 4.109 11.181 6.078 686 HE2 LYS 77 2HE LYS 77 6.054 10.415 4.736 687 HE3 LYS 77 3HE LYS 77 4.984 9.363 3.808 688 HZ1 LYS 77 3HZ LYS 77 3.778 11.332 3.059 689 HZ2 LYS 77 1HZ LYS 77 5.410 11.413 2.631 690 HZ3 LYS 77 2HZ LYS 77 4.830 12.331 3.926 691 H VAL 78 H VAL 78 0.746 8.218 5.003 692 HA VAL 78 HA VAL 78 1.488 5.352 4.911 693 HB VAL 78 HB VAL 78 -0.896 6.613 3.497 694 HG11 VAL 78 1HG1 VAL 78 -0.183 3.696 3.967 695 HG12 VAL 78 2HG1 VAL 78 -0.094 4.551 2.425 696 HG13 VAL 78 3HG1 VAL 78 -1.658 4.283 3.195 697 HG21 VAL 78 3HG2 VAL 78 -0.861 5.071 6.107 698 HG22 VAL 78 1HG2 VAL 78 -2.309 5.577 5.234 699 HG23 VAL 78 2HG2 VAL 78 -1.219 6.787 5.915 700 H PHE 79 H PHE 79 2.674 4.659 3.307 701 HA PHE 79 HA PHE 79 3.307 6.362 0.986 702 HB2 PHE 79 2HB PHE 79 4.642 3.856 2.115 703 HB3 PHE 79 3HB PHE 79 5.190 4.726 0.691 704 HD1 PHE 79 HD1 PHE 79 6.326 6.900 0.909 705 HD2 PHE 79 HD2 PHE 79 5.065 4.745 4.377 706 HE1 PHE 79 HE1 PHE 79 7.774 8.302 2.315 707 HE2 PHE 79 HE2 PHE 79 6.519 6.160 5.772 708 HZ PHE 79 HZ PHE 79 7.869 7.934 4.746 709 H LEU 80 H LEU 80 2.082 5.887 -0.809 710 HA LEU 80 HA LEU 80 0.835 3.219 -1.033 711 HB2 LEU 80 2HB LEU 80 -0.714 5.119 -1.168 712 HB3 LEU 80 3HB LEU 80 0.190 5.804 -2.510 713 HG LEU 80 HG LEU 80 -0.447 3.882 -3.951 714 HD11 LEU 80 1HD1 LEU 80 -2.057 2.862 -1.599 715 HD12 LEU 80 2HD1 LEU 80 -0.598 2.123 -2.269 716 HD13 LEU 80 3HD1 LEU 80 -2.065 2.205 -3.239 717 HD21 LEU 80 3HD2 LEU 80 -2.850 5.165 -2.630 718 HD22 LEU 80 1HD2 LEU 80 -2.844 4.350 -4.196 719 HD23 LEU 80 2HD2 LEU 80 -1.913 5.826 -3.967 720 H LEU 81 H LEU 81 1.395 1.807 -2.537 721 HA LEU 81 HA LEU 81 2.954 2.649 -4.910 722 HB2 LEU 81 2HB LEU 81 4.260 1.179 -3.328 723 HB3 LEU 81 3HB LEU 81 3.058 -0.078 -3.535 724 HG LEU 81 HG LEU 81 3.632 -0.299 -5.924 725 HD11 LEU 81 1HD1 LEU 81 5.637 1.925 -5.469 726 HD12 LEU 81 2HD1 LEU 81 4.191 1.985 -6.481 727 HD13 LEU 81 3HD1 LEU 81 5.527 0.928 -6.924 728 HD21 LEU 81 3HD2 LEU 81 4.911 -1.657 -4.332 729 HD22 LEU 81 1HD2 LEU 81 6.122 -0.381 -4.190 730 HD23 LEU 81 2HD2 LEU 81 5.897 -1.224 -5.727 731 H LEU 82 H LEU 82 1.818 2.407 -6.716 732 HA LEU 82 HA LEU 82 -0.257 0.303 -6.910 733 HB2 LEU 82 2HB LEU 82 0.172 2.806 -8.602 734 HB3 LEU 82 3HB LEU 82 -1.112 1.631 -8.841 735 HG LEU 82 HG LEU 82 -0.799 3.450 -6.415 736 HD11 LEU 82 1HD1 LEU 82 -2.811 4.577 -7.236 737 HD12 LEU 82 2HD1 LEU 82 -2.830 3.541 -8.666 738 HD13 LEU 82 3HD1 LEU 82 -1.501 4.674 -8.411 739 HD21 LEU 82 3HD2 LEU 82 -1.787 1.315 -5.761 740 HD22 LEU 82 1HD2 LEU 82 -2.994 1.451 -7.043 741 HD23 LEU 82 2HD2 LEU 82 -2.990 2.599 -5.700 742 H GLN 83 H GLN 83 0.562 -1.493 -7.852 743 HA GLN 83 HA GLN 83 2.489 -1.284 -10.061 744 HB2 GLN 83 2HB GLN 83 3.012 -2.941 -8.226 745 HB3 GLN 83 3HB GLN 83 1.552 -3.827 -8.654 746 HG2 GLN 83 2HG GLN 83 2.481 -4.130 -10.969 747 HG3 GLN 83 3HG GLN 83 3.977 -3.374 -10.433 748 HE21 GLN 83 1HE2 GLN 83 3.632 -5.972 -11.570 749 HE22 GLN 83 2HE2 GLN 83 4.200 -7.114 -10.404 750 H ASP 84 H ASP 84 1.392 -0.807 -11.809 751 HA ASP 84 HA ASP 84 -0.673 -2.658 -12.791 752 HB2 ASP 84 2HB ASP 84 -0.782 0.389 -12.960 753 HB3 ASP 84 3HB ASP 84 -1.853 -0.686 -13.840 754 H GLN 85 H GLN 85 0.115 -3.494 -14.627 755 HA GLN 85 HA GLN 85 2.552 -2.546 -15.794 756 HB2 GLN 85 2HB GLN 85 1.972 -4.936 -15.567 757 HB3 GLN 85 3HB GLN 85 0.628 -4.732 -16.683 758 HG2 GLN 85 2HG GLN 85 2.220 -4.221 -18.495 759 HG3 GLN 85 3HG GLN 85 3.563 -4.394 -17.363 760 HE21 GLN 85 1HE2 GLN 85 4.169 -6.483 -16.685 761 HE22 GLN 85 2HE2 GLN 85 3.588 -7.912 -17.466 762 H ASP 86 H ASP 86 -0.797 -1.930 -16.341 763 HA ASP 86 HA ASP 86 -0.362 -0.614 -18.947 764 HB2 ASP 86 2HB ASP 86 -2.919 -0.920 -17.285 765 HB3 ASP 86 3HB ASP 86 -2.820 -0.194 -18.885 766 H GLU 87 H GLU 87 0.450 1.432 -18.794 767 HA GLU 87 HA GLU 87 0.307 2.971 -16.376 768 HB2 GLU 87 2HB GLU 87 1.401 3.809 -19.083 769 HB3 GLU 87 3HB GLU 87 1.607 4.682 -17.568 770 HG2 GLU 87 2HG GLU 87 2.742 2.554 -16.665 771 HG3 GLU 87 3HG GLU 87 2.783 2.001 -18.337 772 H ASN 88 H ASN 88 -1.841 2.637 -18.962 773 HA ASN 88 HA ASN 88 -3.161 5.169 -18.823 774 HB2 ASN 88 2HB ASN 88 -4.310 2.427 -19.546 775 HB3 ASN 88 3HB ASN 88 -5.137 3.963 -19.789 776 HD21 ASN 88 1HD2 ASN 88 -4.475 1.972 -21.747 777 HD22 ASN 88 2HD2 ASN 88 -3.450 2.728 -22.916 778 H GLU 89 H GLU 89 -3.626 2.051 -17.203 779 HA GLU 89 HA GLU 89 -5.777 2.908 -15.506 780 HB2 GLU 89 2HB GLU 89 -4.018 0.437 -15.227 781 HB3 GLU 89 3HB GLU 89 -5.622 0.674 -14.539 782 HG2 GLU 89 2HG GLU 89 -4.926 0.385 -17.471 783 HG3 GLU 89 3HG GLU 89 -5.754 -0.799 -16.462 784 H LEU 90 H LEU 90 -2.323 2.490 -15.208 785 HA LEU 90 HA LEU 90 -1.971 2.759 -12.441 786 HB2 LEU 90 2HB LEU 90 -0.327 1.811 -14.028 787 HB3 LEU 90 3HB LEU 90 -0.114 3.385 -14.759 788 HG LEU 90 HG LEU 90 1.071 4.223 -12.834 789 HD11 LEU 90 1HD1 LEU 90 1.466 2.881 -10.815 790 HD12 LEU 90 2HD1 LEU 90 0.350 1.650 -11.416 791 HD13 LEU 90 3HD1 LEU 90 -0.236 3.276 -11.044 792 HD21 LEU 90 3HD2 LEU 90 2.040 1.417 -13.497 793 HD22 LEU 90 1HD2 LEU 90 3.008 2.692 -12.748 794 HD23 LEU 90 2HD2 LEU 90 2.413 2.893 -14.393 795 H GLU 91 H GLU 91 -1.594 5.187 -15.083 796 HA GLU 91 HA GLU 91 -0.871 7.346 -13.433 797 HB2 GLU 91 2HB GLU 91 -0.374 7.265 -15.827 798 HB3 GLU 91 3HB GLU 91 -2.086 7.305 -16.219 799 HG2 GLU 91 2HG GLU 91 -0.958 9.469 -16.610 800 HG3 GLU 91 3HG GLU 91 -2.274 9.587 -15.440 801 H GLU 92 H GLU 92 -4.045 6.600 -14.955 802 HA GLU 92 HA GLU 92 -5.500 8.767 -14.027 803 HB2 GLU 92 2HB GLU 92 -6.378 5.919 -14.598 804 HB3 GLU 92 3HB GLU 92 -7.528 7.177 -14.156 805 HG2 GLU 92 2HG GLU 92 -5.683 7.265 -16.553 806 HG3 GLU 92 3HG GLU 92 -7.383 6.810 -16.595 807 H PHE 93 H PHE 93 -5.142 5.601 -12.434 808 HA PHE 93 HA PHE 93 -6.770 6.266 -10.186 809 HB2 PHE 93 2HB PHE 93 -6.382 3.954 -11.161 810 HB3 PHE 93 3HB PHE 93 -4.775 3.977 -10.449 811 HD1 PHE 93 HD1 PHE 93 -8.349 4.545 -9.422 812 HD2 PHE 93 HD2 PHE 93 -4.556 2.872 -8.378 813 HE1 PHE 93 HE1 PHE 93 -9.306 3.633 -7.356 814 HE2 PHE 93 HE2 PHE 93 -5.523 1.973 -6.309 815 HZ PHE 93 HZ PHE 93 -7.900 2.352 -5.795 816 H LYS 94 H LYS 94 -3.327 6.476 -10.890 817 HA LYS 94 HA LYS 94 -2.288 6.855 -8.297 818 HB2 LYS 94 2HB LYS 94 -0.862 6.405 -10.298 819 HB3 LYS 94 3HB LYS 94 -1.264 7.993 -10.935 820 HG2 LYS 94 2HG LYS 94 -0.227 8.844 -8.636 821 HG3 LYS 94 3HG LYS 94 0.546 7.259 -8.640 822 HD2 LYS 94 2HD LYS 94 2.075 8.848 -9.632 823 HD3 LYS 94 3HD LYS 94 1.484 7.790 -10.917 824 HE2 LYS 94 2HE LYS 94 -0.143 9.533 -11.589 825 HE3 LYS 94 3HE LYS 94 0.466 10.588 -10.311 826 HZ1 LYS 94 3HZ LYS 94 2.649 10.536 -11.406 827 HZ2 LYS 94 1HZ LYS 94 1.447 11.177 -12.407 828 HZ3 LYS 94 2HZ LYS 94 1.999 9.606 -12.660 829 H ARG 95 H ARG 95 -3.131 9.243 -10.799 830 HA ARG 95 HA ARG 95 -2.392 11.519 -9.316 831 HB2 ARG 95 2HB ARG 95 -3.311 12.809 -11.175 832 HB3 ARG 95 3HB ARG 95 -2.371 11.442 -11.759 833 HG2 ARG 95 2HG ARG 95 -4.582 10.212 -12.070 834 HG3 ARG 95 3HG ARG 95 -5.380 11.756 -11.770 835 HD2 ARG 95 2HD ARG 95 -3.420 11.149 -14.011 836 HD3 ARG 95 3HD ARG 95 -5.166 11.338 -14.174 837 HE ARG 95 HE ARG 95 -4.847 13.697 -13.475 838 HH11 ARG 95 1HH1 ARG 95 -2.096 11.984 -14.864 839 HH12 ARG 95 2HH1 ARG 95 -1.326 13.434 -15.431 840 HH21 ARG 95 1HH2 ARG 95 -3.853 15.579 -14.241 841 HH22 ARG 95 2HH2 ARG 95 -2.333 15.487 -15.073 842 H LYS 96 H LYS 96 -5.405 9.790 -9.463 843 HA LYS 96 HA LYS 96 -7.183 11.632 -8.305 844 HB2 LYS 96 2HB LYS 96 -7.001 8.606 -7.925 845 HB3 LYS 96 3HB LYS 96 -8.384 9.582 -7.440 846 HG2 LYS 96 2HG LYS 96 -8.909 10.119 -9.728 847 HG3 LYS 96 3HG LYS 96 -7.405 9.397 -10.299 848 HD2 LYS 96 2HD LYS 96 -8.263 7.160 -9.444 849 HD3 LYS 96 3HD LYS 96 -9.809 7.950 -9.114 850 HE2 LYS 96 2HE LYS 96 -8.475 7.683 -11.831 851 HE3 LYS 96 3HE LYS 96 -9.884 6.784 -11.273 852 HZ1 LYS 96 3HZ LYS 96 -10.549 8.592 -12.689 853 HZ2 LYS 96 1HZ LYS 96 -9.739 9.713 -11.723 854 HZ3 LYS 96 2HZ LYS 96 -11.089 8.896 -11.121 855 H ILE 97 H ILE 97 -5.050 9.256 -6.752 856 HA ILE 97 HA ILE 97 -5.784 10.072 -4.048 857 HB ILE 97 HB ILE 97 -3.824 7.912 -4.969 858 HG12 ILE 97 2HG1 ILE 97 -6.781 7.502 -4.302 859 HG13 ILE 97 3HG1 ILE 97 -6.202 7.723 -5.947 860 HG21 ILE 97 1HG2 ILE 97 -4.272 6.871 -2.779 861 HG22 ILE 97 2HG2 ILE 97 -5.334 8.210 -2.347 862 HG23 ILE 97 3HG2 ILE 97 -3.608 8.495 -2.582 863 HD11 ILE 97 3HD1 ILE 97 -5.452 5.464 -4.102 864 HD12 ILE 97 1HD1 ILE 97 -4.850 5.703 -5.746 865 HD13 ILE 97 2HD1 ILE 97 -6.564 5.399 -5.471 866 H GLU 98 H GLU 98 -3.328 10.733 -6.338 867 HA GLU 98 HA GLU 98 -1.079 11.457 -4.835 868 HB2 GLU 98 2HB GLU 98 -1.100 11.275 -7.296 869 HB3 GLU 98 3HB GLU 98 -2.220 12.625 -7.410 870 HG2 GLU 98 2HG GLU 98 -0.024 13.374 -8.054 871 HG3 GLU 98 3HG GLU 98 -0.467 14.137 -6.533 872 H SER 99 H SER 99 -4.063 13.171 -5.581 873 HA SER 99 HA SER 99 -3.322 15.716 -4.508 874 HB2 SER 99 2HB SER 99 -5.063 15.425 -6.265 875 HB3 SER 99 3HB SER 99 -6.089 14.589 -5.099 876 HG SER 99 HG SER 99 -6.774 16.643 -4.996 877 H GLN 100 H GLN 100 -4.610 12.757 -3.153 878 HA GLN 100 HA GLN 100 -5.839 13.911 -0.813 879 HB2 GLN 100 2HB GLN 100 -5.140 11.013 -1.459 880 HB3 GLN 100 3HB GLN 100 -6.067 11.526 -0.051 881 HG2 GLN 100 2HG GLN 100 -7.789 12.490 -1.577 882 HG3 GLN 100 3HG GLN 100 -6.893 11.843 -2.951 883 HE21 GLN 100 1HE2 GLN 100 -9.627 11.262 -2.014 884 HE22 GLN 100 2HE2 GLN 100 -9.694 9.554 -1.769 885 H GLY 101 H GLY 101 -2.658 13.868 -1.486 886 HA2 GLY 101 2HA GLY 101 -1.009 14.660 -0.035 887 HA3 GLY 101 3HA GLY 101 -1.983 14.174 1.339 888 H TYR 102 H TYR 102 -2.041 11.532 -0.499 889 HA TYR 102 HA TYR 102 0.035 10.173 0.999 890 HB2 TYR 102 2HB TYR 102 -2.099 9.205 -0.959 891 HB3 TYR 102 3HB TYR 102 -0.922 8.122 -0.210 892 HD1 TYR 102 HD1 TYR 102 -0.698 8.840 2.503 893 HD2 TYR 102 HD2 TYR 102 -4.228 8.957 0.091 894 HE1 TYR 102 HE1 TYR 102 -2.071 8.608 4.515 895 HE2 TYR 102 HE2 TYR 102 -5.604 8.718 2.126 896 HH TYR 102 HH TYR 102 -4.282 9.063 5.274 897 H GLU 103 H GLU 103 1.983 9.543 0.217 898 HA GLU 103 HA GLU 103 2.904 10.465 -2.324 899 HB2 GLU 103 2HB GLU 103 4.454 10.284 -0.419 900 HB3 GLU 103 3HB GLU 103 4.229 8.537 -0.364 901 HG2 GLU 103 2HG GLU 103 5.225 8.346 -2.630 902 HG3 GLU 103 3HG GLU 103 5.458 10.084 -2.684 903 H VAL 104 H VAL 104 1.795 9.563 -4.033 904 HA VAL 104 HA VAL 104 1.379 6.644 -4.146 905 HB VAL 104 HB VAL 104 0.184 8.757 -6.001 906 HG11 VAL 104 1HG1 VAL 104 -0.607 5.877 -5.436 907 HG12 VAL 104 2HG1 VAL 104 0.194 6.467 -6.893 908 HG13 VAL 104 3HG1 VAL 104 -1.451 6.981 -6.523 909 HG21 VAL 104 3HG2 VAL 104 -1.892 8.601 -4.661 910 HG22 VAL 104 1HG2 VAL 104 -0.554 9.261 -3.721 911 HG23 VAL 104 2HG2 VAL 104 -1.055 7.587 -3.482 912 H ARG 105 H ARG 105 3.001 5.614 -5.134 913 HA ARG 105 HA ARG 105 4.484 6.932 -7.328 914 HB2 ARG 105 2HB ARG 105 5.751 6.294 -5.245 915 HB3 ARG 105 3HB ARG 105 5.369 4.609 -5.571 916 HG2 ARG 105 2HG ARG 105 7.641 5.099 -6.280 917 HG3 ARG 105 3HG ARG 105 6.647 4.743 -7.694 918 HD2 ARG 105 2HD ARG 105 6.412 7.228 -8.065 919 HD3 ARG 105 3HD ARG 105 7.557 7.484 -6.739 920 HE ARG 105 HE ARG 105 8.846 5.762 -8.415 921 HH11 ARG 105 1HH1 ARG 105 7.461 8.980 -8.884 922 HH12 ARG 105 2HH1 ARG 105 8.582 9.389 -10.146 923 HH21 ARG 105 1HH2 ARG 105 10.254 6.325 -10.069 924 HH22 ARG 105 2HH2 ARG 105 10.155 7.891 -10.814 925 H LYS 106 H LYS 106 5.076 5.689 -9.139 926 HA LYS 106 HA LYS 106 3.131 3.680 -9.999 927 HB2 LYS 106 2HB LYS 106 5.278 5.287 -11.451 928 HB3 LYS 106 3HB LYS 106 4.259 4.095 -12.247 929 HG2 LYS 106 2HG LYS 106 2.269 5.449 -11.824 930 HG3 LYS 106 3HG LYS 106 3.221 6.610 -10.893 931 HD2 LYS 106 2HD LYS 106 2.759 7.400 -13.229 932 HD3 LYS 106 3HD LYS 106 4.482 7.260 -12.879 933 HE2 LYS 106 2HE LYS 106 4.395 4.971 -14.016 934 HE3 LYS 106 3HE LYS 106 2.774 5.397 -14.556 935 HZ1 LYS 106 3HZ LYS 106 4.450 5.874 -16.232 936 HZ2 LYS 106 1HZ LYS 106 5.246 6.929 -15.173 937 HZ3 LYS 106 2HZ LYS 106 3.691 7.295 -15.720 938 H VAL 107 H VAL 107 3.754 1.667 -10.868 939 HA VAL 107 HA VAL 107 6.394 1.174 -11.765 940 HB VAL 107 HB VAL 107 6.767 0.643 -9.354 941 HG11 VAL 107 1HG1 VAL 107 5.804 -1.347 -8.299 942 HG12 VAL 107 2HG1 VAL 107 4.781 -1.616 -9.712 943 HG13 VAL 107 3HG1 VAL 107 4.554 -0.174 -8.721 944 HG21 VAL 107 3HG2 VAL 107 7.917 -1.506 -9.698 945 HG22 VAL 107 1HG2 VAL 107 8.152 -0.422 -11.071 946 HG23 VAL 107 2HG2 VAL 107 7.010 -1.763 -11.191 947 H THR 108 H THR 108 6.384 -0.354 -13.349 948 HA THR 108 HA THR 108 3.873 -1.830 -13.919 949 HB THR 108 HB THR 108 4.854 -2.002 -16.279 950 HG1 THR 108 HG1 THR 108 6.663 -0.871 -16.770 951 HG21 THR 108 3HG2 THR 108 4.334 0.336 -16.935 952 HG22 THR 108 1HG2 THR 108 4.341 0.809 -15.234 953 HG23 THR 108 2HG2 THR 108 3.120 -0.316 -15.833 954 H ASP 109 H ASP 109 7.333 -2.104 -13.409 955 HA ASP 109 HA ASP 109 7.536 -4.851 -14.303 956 HB2 ASP 109 2HB ASP 109 9.578 -3.006 -13.006 957 HB3 ASP 109 3HB ASP 109 9.933 -4.618 -13.613 958 H ASP 110 H ASP 110 8.046 -6.606 -13.081 959 HA ASP 110 HA ASP 110 6.735 -6.836 -10.564 960 HB2 ASP 110 2HB ASP 110 8.541 -8.843 -11.990 961 HB3 ASP 110 3HB ASP 110 7.358 -9.211 -10.740 962 H GLU 111 H GLU 111 10.119 -7.158 -11.597 963 HA GLU 111 HA GLU 111 11.178 -7.697 -9.004 964 HB2 GLU 111 2HB GLU 111 12.595 -6.814 -11.552 965 HB3 GLU 111 3HB GLU 111 13.399 -7.416 -10.103 966 HG2 GLU 111 2HG GLU 111 12.265 -9.605 -10.382 967 HG3 GLU 111 3HG GLU 111 11.464 -9.000 -11.830 968 H GLU 112 H GLU 112 10.736 -4.751 -10.937 969 HA GLU 112 HA GLU 112 12.273 -3.076 -9.192 970 HB2 GLU 112 2HB GLU 112 11.905 -2.470 -11.587 971 HB3 GLU 112 3HB GLU 112 10.206 -2.156 -11.229 972 HG2 GLU 112 2HG GLU 112 10.836 -0.358 -9.668 973 HG3 GLU 112 3HG GLU 112 12.544 -0.707 -9.918 974 H ALA 113 H ALA 113 8.851 -4.023 -9.344 975 HA ALA 113 HA ALA 113 7.659 -2.207 -7.639 976 HB1 ALA 113 3HB ALA 113 6.071 -3.975 -7.020 977 HB2 ALA 113 1HB ALA 113 7.170 -5.203 -7.670 978 HB3 ALA 113 2HB ALA 113 6.426 -4.020 -8.746 979 H LEU 114 H LEU 114 9.585 -5.036 -6.795 980 HA LEU 114 HA LEU 114 9.427 -4.959 -3.981 981 HB2 LEU 114 2HB LEU 114 11.782 -5.925 -5.654 982 HB3 LEU 114 3HB LEU 114 11.386 -6.429 -4.017 983 HG LEU 114 HG LEU 114 9.657 -7.034 -6.453 984 HD11 LEU 114 1HD1 LEU 114 10.510 -9.315 -6.335 985 HD12 LEU 114 2HD1 LEU 114 11.591 -8.870 -5.014 986 HD13 LEU 114 3HD1 LEU 114 11.823 -8.172 -6.619 987 HD21 LEU 114 3HD2 LEU 114 8.507 -8.630 -4.983 988 HD22 LEU 114 1HD2 LEU 114 8.378 -6.983 -4.367 989 HD23 LEU 114 2HD2 LEU 114 9.508 -8.114 -3.622 990 H LYS 115 H LYS 115 11.664 -3.441 -6.268 991 HA LYS 115 HA LYS 115 13.552 -2.387 -4.420 992 HB2 LYS 115 2HB LYS 115 12.947 -1.374 -7.236 993 HB3 LYS 115 3HB LYS 115 14.440 -1.123 -6.334 994 HG2 LYS 115 2HG LYS 115 14.943 -3.529 -6.466 995 HG3 LYS 115 3HG LYS 115 13.415 -3.811 -7.306 996 HD2 LYS 115 2HD LYS 115 14.252 -2.221 -9.123 997 HD3 LYS 115 3HD LYS 115 15.828 -2.261 -8.328 998 HE2 LYS 115 2HE LYS 115 14.353 -4.653 -9.486 999 HE3 LYS 115 3HE LYS 115 15.733 -3.835 -10.217 1000 HZ1 LYS 115 3HZ LYS 115 16.427 -5.839 -9.094 1001 HZ2 LYS 115 1HZ LYS 115 15.747 -5.311 -7.638 1002 HZ3 LYS 115 2HZ LYS 115 17.071 -4.496 -8.294 1003 H ILE 116 H ILE 116 10.501 -1.154 -5.727 1004 HA ILE 116 HA ILE 116 10.899 1.556 -4.798 1005 HB ILE 116 HB ILE 116 8.223 0.323 -5.607 1006 HG12 ILE 116 2HG1 ILE 116 9.780 -0.064 -7.470 1007 HG13 ILE 116 3HG1 ILE 116 8.629 1.182 -7.913 1008 HG21 ILE 116 1HG2 ILE 116 8.053 2.493 -4.482 1009 HG22 ILE 116 2HG2 ILE 116 7.619 2.652 -6.183 1010 HG23 ILE 116 3HG2 ILE 116 9.199 3.204 -5.622 1011 HD11 ILE 116 3HD1 ILE 116 10.347 2.893 -7.535 1012 HD12 ILE 116 1HD1 ILE 116 10.848 1.691 -8.722 1013 HD13 ILE 116 2HD1 ILE 116 11.501 1.630 -7.086 1014 H VAL 117 H VAL 117 9.166 -1.356 -3.657 1015 HA VAL 117 HA VAL 117 7.981 -0.365 -1.313 1016 HB VAL 117 HB VAL 117 9.238 -3.132 -1.704 1017 HG11 VAL 117 1HG1 VAL 117 7.172 -2.229 0.342 1018 HG12 VAL 117 2HG1 VAL 117 8.845 -2.676 0.679 1019 HG13 VAL 117 3HG1 VAL 117 7.711 -3.893 0.094 1020 HG21 VAL 117 3HG2 VAL 117 7.505 -2.660 -3.395 1021 HG22 VAL 117 1HG2 VAL 117 6.351 -2.282 -2.120 1022 HG23 VAL 117 2HG2 VAL 117 6.984 -3.923 -2.284 1023 H ARG 118 H ARG 118 11.265 -1.539 -1.949 1024 HA ARG 118 HA ARG 118 12.410 -1.372 0.592 1025 HB2 ARG 118 2HB ARG 118 13.587 -1.111 -2.187 1026 HB3 ARG 118 3HB ARG 118 14.598 -1.022 -0.751 1027 HG2 ARG 118 2HG ARG 118 13.974 -3.293 -0.115 1028 HG3 ARG 118 3HG ARG 118 12.856 -3.397 -1.482 1029 HD2 ARG 118 2HD ARG 118 15.097 -4.526 -1.829 1030 HD3 ARG 118 3HD ARG 118 14.648 -3.354 -3.068 1031 HE ARG 118 HE ARG 118 16.149 -1.843 -1.432 1032 HH11 ARG 118 1HH1 ARG 118 16.827 -5.035 -2.808 1033 HH12 ARG 118 2HH1 ARG 118 18.548 -4.776 -2.841 1034 HH21 ARG 118 1HH2 ARG 118 18.379 -1.511 -1.532 1035 HH22 ARG 118 2HH2 ARG 118 19.429 -2.769 -2.113 1036 H GLU 119 H GLU 119 12.024 1.133 -1.918 1037 HA GLU 119 HA GLU 119 13.460 3.192 -0.639 1038 HB2 GLU 119 2HB GLU 119 11.133 3.377 -2.604 1039 HB3 GLU 119 3HB GLU 119 12.086 4.760 -2.083 1040 HG2 GLU 119 2HG GLU 119 13.112 2.364 -3.622 1041 HG3 GLU 119 3HG GLU 119 12.811 3.969 -4.281 1042 H PHE 120 H PHE 120 9.974 2.370 -0.547 1043 HA PHE 120 HA PHE 120 9.095 4.428 1.146 1044 HB2 PHE 120 2HB PHE 120 7.959 1.616 0.846 1045 HB3 PHE 120 3HB PHE 120 7.122 2.964 1.617 1046 HD1 PHE 120 HD2 PHE 120 7.606 5.225 -0.181 1047 HD2 PHE 120 HD1 PHE 120 6.780 1.132 -1.116 1048 HE1 PHE 120 HE2 PHE 120 6.648 5.902 -2.345 1049 HE2 PHE 120 HE1 PHE 120 5.846 1.827 -3.270 1050 HZ PHE 120 HZ PHE 120 5.764 4.196 -3.878 1051 H MET 121 H MET 121 10.221 1.154 1.969 1052 HA MET 121 HA MET 121 9.836 1.366 4.779 1053 HB2 MET 121 2HB MET 121 11.602 -0.517 3.153 1054 HB3 MET 121 3HB MET 121 11.276 -0.697 4.873 1055 HG2 MET 121 2HG MET 121 8.851 -0.950 4.360 1056 HG3 MET 121 3HG MET 121 9.232 -0.867 2.640 1057 HE1 MET 121 3HE MET 121 11.315 -4.180 2.130 1058 HE2 MET 121 1HE MET 121 11.974 -2.579 2.463 1059 HE3 MET 121 2HE MET 121 10.630 -2.764 1.332 1060 H GLN 122 H GLN 122 12.461 2.246 2.636 1061 HA GLN 122 HA GLN 122 14.419 2.833 4.646 1062 HB2 GLN 122 2HB GLN 122 15.007 2.323 2.289 1063 HB3 GLN 122 3HB GLN 122 14.186 3.787 1.757 1064 HG2 GLN 122 2HG GLN 122 15.834 5.167 2.927 1065 HG3 GLN 122 3HG GLN 122 16.616 3.724 3.568 1066 HE21 GLN 122 1HE2 GLN 122 16.002 5.584 0.657 1067 HE22 GLN 122 2HE2 GLN 122 17.275 4.891 -0.283 1068 H LYS 123 H LYS 123 11.895 4.701 2.999 1069 HA LYS 123 HA LYS 123 12.616 7.281 4.046 1070 HB2 LYS 123 2HB LYS 123 9.980 6.281 2.863 1071 HB3 LYS 123 3HB LYS 123 10.314 7.965 3.254 1072 HG2 LYS 123 2HG LYS 123 12.037 8.081 1.549 1073 HG3 LYS 123 3HG LYS 123 11.888 6.353 1.225 1074 HD2 LYS 123 2HD LYS 123 9.477 6.780 0.534 1075 HD3 LYS 123 3HD LYS 123 9.808 8.509 0.679 1076 HE2 LYS 123 2HE LYS 123 11.597 8.269 -1.037 1077 HE3 LYS 123 3HE LYS 123 11.167 6.564 -1.209 1078 HZ1 LYS 123 3HZ LYS 123 9.471 8.920 -1.845 1079 HZ2 LYS 123 1HZ LYS 123 8.894 7.327 -1.829 1080 HZ3 LYS 123 2HZ LYS 123 10.097 7.782 -2.926 1081 H ALA 124 H ALA 124 10.281 4.758 4.923 1082 HA ALA 124 HA ALA 124 9.158 5.953 7.223 1083 HB1 ALA 124 3HB ALA 124 8.421 3.670 7.796 1084 HB2 ALA 124 1HB ALA 124 9.506 3.000 6.567 1085 HB3 ALA 124 2HB ALA 124 8.143 4.015 6.090 1086 H GLY 125 H GLY 125 12.018 3.952 6.654 1087 HA2 GLY 125 2HA GLY 125 12.861 3.605 9.349 1088 HA3 GLY 125 3HA GLY 125 13.853 3.412 7.910 1089 H SER 126 H SER 126 13.302 6.190 7.006 1090 HA SER 126 HA SER 126 15.327 7.620 8.461 1091 HB2 SER 126 2HB SER 126 13.422 8.546 6.262 1092 HB3 SER 126 3HB SER 126 14.804 9.469 6.868 1093 HG SER 126 HG SER 126 14.730 7.359 5.119 1094 H LEU 127 H LEU 127 11.797 7.645 8.246 1095 HA LEU 127 HA LEU 127 11.374 9.905 10.002 1096 HB2 LEU 127 2HB LEU 127 9.433 7.764 9.025 1097 HB3 LEU 127 3HB LEU 127 8.968 9.222 9.886 1098 HG LEU 127 HG LEU 127 10.226 9.159 7.112 1099 HD11 LEU 127 1HD1 LEU 127 8.020 9.802 6.257 1100 HD12 LEU 127 2HD1 LEU 127 7.337 9.677 7.880 1101 HD13 LEU 127 3HD1 LEU 127 7.963 8.239 7.071 1102 HD21 LEU 127 3HD2 LEU 127 10.812 11.213 8.282 1103 HD22 LEU 127 1HD2 LEU 127 9.116 11.508 8.677 1104 HD23 LEU 127 2HD2 LEU 127 9.658 11.553 6.996 1105 H GLU 128 H GLU 128 12.116 6.598 10.426 1106 HA GLU 128 HA GLU 128 11.177 6.387 13.157 1107 HB2 GLU 128 2HB GLU 128 12.919 4.658 11.362 1108 HB3 GLU 128 3HB GLU 128 12.792 4.314 13.083 1109 HG2 GLU 128 2HG GLU 128 10.397 4.487 11.241 1110 HG3 GLU 128 3HG GLU 128 11.253 2.989 11.589 1111 H HIS 129 H HIS 129 14.204 7.147 11.496 1112 HA HIS 129 HA HIS 129 15.728 7.139 13.995 1113 HB2 HIS 129 2HB HIS 129 16.440 6.171 11.626 1114 HB3 HIS 129 3HB HIS 129 16.897 7.832 11.281 1115 HD1 HIS 129 HD1 HIS 129 19.337 6.714 11.066 1116 HD2 HIS 129 HD2 HIS 129 17.739 6.793 14.901 1117 HE1 HIS 129 HE1 HIS 129 21.234 6.160 12.610 1118 HE2 HIS 129 HE2 HIS 129 20.186 5.998 14.874 1119 H HIS 130 H HIS 130 14.011 9.068 14.382 1120 HA HIS 130 HA HIS 130 14.645 11.698 13.554 1121 HB2 HIS 130 2HB HIS 130 13.445 10.710 16.184 1122 HB3 HIS 130 3HB HIS 130 13.531 12.406 15.723 1123 HD1 HIS 130 HD1 HIS 130 12.028 13.145 13.680 1124 HD2 HIS 130 HD2 HIS 130 11.284 9.333 15.149 1125 HE1 HIS 130 HE1 HIS 130 9.780 12.502 12.773 1126 HE2 HIS 130 HE2 HIS 130 9.478 10.115 13.475 1127 H HIS 131 H HIS 131 15.737 9.730 16.256 1128 HA HIS 131 HA HIS 131 17.827 11.632 16.996 1129 HB2 HIS 131 2HB HIS 131 16.889 9.014 18.258 1130 HB3 HIS 131 3HB HIS 131 18.191 10.023 18.896 1131 HD1 HIS 131 HD1 HIS 131 14.571 9.577 19.083 1132 HD2 HIS 131 HD2 HIS 131 17.239 12.713 19.682 1133 HE1 HIS 131 HE1 HIS 131 13.288 11.343 20.326 1134 HE2 HIS 131 HE2 HIS 131 14.909 13.223 20.652 1135 H HIS 132 H HIS 132 18.298 10.909 14.531 1136 HA HIS 132 HA HIS 132 20.141 8.807 14.160 1137 HB2 HIS 132 2HB HIS 132 21.039 10.421 12.281 1138 HB3 HIS 132 3HB HIS 132 19.436 9.723 12.129 1139 HD1 HIS 132 HD1 HIS 132 17.543 11.327 11.766 1140 HD2 HIS 132 HD2 HIS 132 20.968 13.258 13.104 1141 HE1 HIS 132 HE1 HIS 132 17.013 13.775 11.688 1142 HE2 HIS 132 HE2 HIS 132 19.181 14.909 12.240 1143 H HIS 133 H HIS 133 22.105 8.521 14.990 1144 HA HIS 133 HA HIS 133 23.764 8.661 16.485 1145 HB2 HIS 133 2HB HIS 133 24.863 10.346 15.151 1146 HB3 HIS 133 3HB HIS 133 23.768 11.610 15.699 1147 HD1 HIS 133 HD1 HIS 133 24.586 13.011 17.582 1148 HD2 HIS 133 HD2 HIS 133 26.632 9.398 17.361 1149 HE1 HIS 133 HE1 HIS 133 26.360 13.126 19.355 1150 HE2 HIS 133 HE2 HIS 133 27.410 10.848 19.353 1151 H HIS 134 H HIS 134 22.376 7.942 18.106 1152 HA HIS 134 HA HIS 134 21.585 9.955 20.128 1153 HB2 HIS 134 2HB HIS 134 19.928 8.309 21.008 1154 HB3 HIS 134 3HB HIS 134 19.586 8.813 19.359 1155 HD1 HIS 134 HD1 HIS 134 20.660 5.816 21.372 1156 HD2 HIS 134 HD2 HIS 134 19.584 6.740 17.462 1157 HE1 HIS 134 HE1 HIS 134 20.302 3.610 20.227 1158 HE2 HIS 134 HE2 HIS 134 19.746 4.193 17.848 Start of MODEL 14 1 H1 MET 1 1H MET 1 3.105 6.353 17.029 2 H2 MET 1 2H MET 1 1.827 7.064 16.188 3 H3 MET 1 3H MET 1 3.005 8.035 16.912 4 HA MET 1 HA MET 1 3.314 7.940 14.556 5 HB2 MET 1 2HB MET 1 5.277 7.717 16.455 6 HB3 MET 1 3HB MET 1 5.615 6.259 15.534 7 HG2 MET 1 2HG MET 1 5.587 9.101 14.497 8 HG3 MET 1 3HG MET 1 6.999 8.070 14.739 9 HE1 MET 1 3HE MET 1 6.715 8.495 10.824 10 HE2 MET 1 1HE MET 1 7.697 8.828 12.251 11 HE3 MET 1 2HE MET 1 6.184 9.702 11.995 12 H LYS 2 H LYS 2 1.743 6.614 13.490 13 HA LYS 2 HA LYS 2 2.643 3.852 12.870 14 HB2 LYS 2 2HB LYS 2 -0.143 5.065 12.809 15 HB3 LYS 2 3HB LYS 2 0.241 3.573 11.961 16 HG2 LYS 2 2HG LYS 2 0.824 2.491 14.094 17 HG3 LYS 2 3HG LYS 2 0.470 3.994 14.962 18 HD2 LYS 2 2HD LYS 2 -1.881 3.874 14.370 19 HD3 LYS 2 3HD LYS 2 -1.590 2.554 13.235 20 HE2 LYS 2 2HE LYS 2 -1.180 2.338 16.234 21 HE3 LYS 2 3HE LYS 2 -2.647 1.832 15.390 22 HZ1 LYS 2 3HZ LYS 2 -1.223 -0.045 15.737 23 HZ2 LYS 2 1HZ LYS 2 0.084 0.726 15.000 24 HZ3 LYS 2 2HZ LYS 2 -1.270 0.288 14.085 25 H ILE 3 H ILE 3 3.684 3.779 10.989 26 HA ILE 3 HA ILE 3 2.916 5.562 8.747 27 HB ILE 3 HB ILE 3 5.374 3.759 8.996 28 HG12 ILE 3 2HG1 ILE 3 5.239 6.793 9.343 29 HG13 ILE 3 3HG1 ILE 3 5.320 5.652 10.680 30 HG21 ILE 3 1HG2 ILE 3 6.233 5.071 7.055 31 HG22 ILE 3 2HG2 ILE 3 4.695 5.929 6.966 32 HG23 ILE 3 3HG2 ILE 3 4.756 4.193 6.657 33 HD11 ILE 3 3HD1 ILE 3 7.479 6.612 10.251 34 HD12 ILE 3 1HD1 ILE 3 7.435 6.076 8.573 35 HD13 ILE 3 2HD1 ILE 3 7.513 4.891 9.880 36 H LEU 4 H LEU 4 1.668 4.662 7.176 37 HA LEU 4 HA LEU 4 1.339 1.717 7.134 38 HB2 LEU 4 2HB LEU 4 -0.572 3.857 6.113 39 HB3 LEU 4 3HB LEU 4 -0.889 2.127 6.207 40 HG LEU 4 HG LEU 4 -0.518 4.006 8.585 41 HD11 LEU 4 1HD1 LEU 4 -2.869 3.612 9.061 42 HD12 LEU 4 2HD1 LEU 4 -3.021 2.621 7.607 43 HD13 LEU 4 3HD1 LEU 4 -2.657 4.345 7.473 44 HD21 LEU 4 3HD2 LEU 4 -1.163 1.036 8.591 45 HD22 LEU 4 1HD2 LEU 4 -1.142 2.098 10.005 46 HD23 LEU 4 2HD2 LEU 4 0.347 1.780 9.124 47 H ILE 5 H ILE 5 2.698 0.938 5.592 48 HA ILE 5 HA ILE 5 3.142 2.320 3.061 49 HB ILE 5 HB ILE 5 4.027 -0.512 3.798 50 HG12 ILE 5 2HG1 ILE 5 4.947 1.070 5.476 51 HG13 ILE 5 3HG1 ILE 5 6.220 0.410 4.459 52 HG21 ILE 5 1HG2 ILE 5 4.108 -0.047 1.387 53 HG22 ILE 5 2HG2 ILE 5 5.746 -0.182 2.029 54 HG23 ILE 5 3HG2 ILE 5 5.067 1.409 1.675 55 HD11 ILE 5 3HD1 ILE 5 6.582 2.746 4.911 56 HD12 ILE 5 1HD1 ILE 5 5.009 3.161 4.237 57 HD13 ILE 5 2HD1 ILE 5 6.275 2.511 3.192 58 H LEU 6 H LEU 6 1.406 2.277 1.720 59 HA LEU 6 HA LEU 6 -0.454 -0.011 1.717 60 HB2 LEU 6 2HB LEU 6 -1.032 2.618 1.807 61 HB3 LEU 6 3HB LEU 6 -0.863 2.498 0.074 62 HG LEU 6 HG LEU 6 -3.209 2.354 0.637 63 HD11 LEU 6 1HD1 LEU 6 -2.580 0.911 -1.220 64 HD12 LEU 6 2HD1 LEU 6 -3.925 0.230 -0.309 65 HD13 LEU 6 3HD1 LEU 6 -2.300 -0.433 -0.108 66 HD21 LEU 6 3HD2 LEU 6 -2.505 0.094 2.513 67 HD22 LEU 6 1HD2 LEU 6 -4.135 0.635 2.113 68 HD23 LEU 6 2HD2 LEU 6 -3.036 1.718 2.959 69 H ILE 7 H ILE 7 -0.431 -1.437 -0.009 70 HA ILE 7 HA ILE 7 0.884 -0.631 -2.546 71 HB ILE 7 HB ILE 7 1.293 -3.340 -1.177 72 HG12 ILE 7 2HG1 ILE 7 3.324 -1.108 -1.684 73 HG13 ILE 7 3HG1 ILE 7 2.616 -1.489 -0.120 74 HG21 ILE 7 1HG2 ILE 7 2.841 -3.840 -3.058 75 HG22 ILE 7 2HG2 ILE 7 2.416 -2.303 -3.814 76 HG23 ILE 7 3HG2 ILE 7 1.195 -3.564 -3.632 77 HD11 ILE 7 3HD1 ILE 7 4.436 -3.264 -1.733 78 HD12 ILE 7 1HD1 ILE 7 3.694 -3.688 -0.186 79 HD13 ILE 7 2HD1 ILE 7 4.844 -2.354 -0.277 80 H ASN 8 H ASN 8 -0.524 -0.883 -4.208 81 HA ASN 8 HA ASN 8 -2.576 -3.031 -4.084 82 HB2 ASN 8 2HB ASN 8 -3.596 -0.847 -4.481 83 HB3 ASN 8 3HB ASN 8 -2.471 -0.494 -5.782 84 HD21 ASN 8 1HD2 ASN 8 -4.261 -3.556 -5.261 85 HD22 ASN 8 2HD2 ASN 8 -5.181 -3.456 -6.718 86 H THR 9 H THR 9 -1.682 -4.790 -4.950 87 HA THR 9 HA THR 9 -0.818 -4.594 -7.767 88 HB THR 9 HB THR 9 1.170 -5.246 -6.498 89 HG1 THR 9 HG1 THR 9 1.666 -6.813 -7.851 90 HG21 THR 9 3HG2 THR 9 -0.464 -7.550 -5.380 91 HG22 THR 9 1HG2 THR 9 0.136 -6.166 -4.461 92 HG23 THR 9 2HG2 THR 9 1.273 -7.324 -5.158 93 H ASN 10 H ASN 10 -1.930 -5.941 -9.147 94 HA ASN 10 HA ASN 10 -4.219 -7.443 -8.073 95 HB2 ASN 10 2HB ASN 10 -3.402 -7.033 -10.983 96 HB3 ASN 10 3HB ASN 10 -4.941 -7.663 -10.405 97 HD21 ASN 10 1HD2 ASN 10 -4.674 -5.528 -12.170 98 HD22 ASN 10 2HD2 ASN 10 -5.256 -4.093 -11.410 99 H ASN 11 H ASN 11 -1.009 -7.985 -8.752 100 HA ASN 11 HA ASN 11 -1.198 -10.682 -9.853 101 HB2 ASN 11 2HB ASN 11 1.302 -9.147 -9.004 102 HB3 ASN 11 3HB ASN 11 1.225 -10.567 -10.045 103 HD21 ASN 11 1HD2 ASN 11 0.818 -7.123 -9.855 104 HD22 ASN 11 2HD2 ASN 11 0.641 -6.838 -11.550 105 H ASP 12 H ASP 12 -1.631 -12.281 -8.494 106 HA ASP 12 HA ASP 12 -1.577 -12.269 -5.702 107 HB2 ASP 12 2HB ASP 12 -1.360 -14.702 -7.529 108 HB3 ASP 12 3HB ASP 12 -1.822 -14.732 -5.829 109 H GLU 13 H GLU 13 0.905 -13.213 -8.020 110 HA GLU 13 HA GLU 13 2.697 -14.500 -6.266 111 HB2 GLU 13 2HB GLU 13 3.303 -12.981 -8.834 112 HB3 GLU 13 3HB GLU 13 4.407 -14.097 -8.022 113 HG2 GLU 13 2HG GLU 13 1.757 -14.781 -9.365 114 HG3 GLU 13 3HG GLU 13 3.379 -15.207 -9.916 115 H LEU 14 H LEU 14 2.491 -11.075 -7.336 116 HA LEU 14 HA LEU 14 4.731 -10.221 -5.803 117 HB2 LEU 14 2HB LEU 14 2.488 -8.737 -7.174 118 HB3 LEU 14 3HB LEU 14 3.581 -7.870 -6.111 119 HG LEU 14 HG LEU 14 4.325 -7.602 -8.398 120 HD11 LEU 14 1HD1 LEU 14 6.639 -8.337 -8.227 121 HD12 LEU 14 2HD1 LEU 14 6.220 -9.446 -6.919 122 HD13 LEU 14 3HD1 LEU 14 6.061 -7.702 -6.689 123 HD21 LEU 14 3HD2 LEU 14 5.040 -9.465 -9.815 124 HD22 LEU 14 1HD2 LEU 14 3.333 -9.588 -9.409 125 HD23 LEU 14 2HD2 LEU 14 4.506 -10.621 -8.594 126 H ILE 15 H ILE 15 1.308 -10.602 -5.012 127 HA ILE 15 HA ILE 15 1.264 -9.198 -2.567 128 HB ILE 15 HB ILE 15 -0.285 -11.720 -3.318 129 HG12 ILE 15 2HG1 ILE 15 -1.121 -8.785 -3.518 130 HG13 ILE 15 3HG1 ILE 15 -0.652 -9.797 -4.877 131 HG21 ILE 15 1HG2 ILE 15 -1.908 -11.041 -1.564 132 HG22 ILE 15 2HG2 ILE 15 -0.837 -9.720 -1.092 133 HG23 ILE 15 3HG2 ILE 15 -0.318 -11.395 -0.889 134 HD11 ILE 15 3HD1 ILE 15 -3.071 -10.193 -3.121 135 HD12 ILE 15 1HD1 ILE 15 -2.593 -11.240 -4.462 136 HD13 ILE 15 2HD1 ILE 15 -3.045 -9.564 -4.767 137 H LYS 16 H LYS 16 1.797 -12.712 -3.132 138 HA LYS 16 HA LYS 16 2.369 -13.365 -0.440 139 HB2 LYS 16 2HB LYS 16 3.048 -15.579 -1.283 140 HB3 LYS 16 3HB LYS 16 1.546 -15.051 -2.027 141 HG2 LYS 16 2HG LYS 16 2.733 -14.481 -4.096 142 HG3 LYS 16 3HG LYS 16 4.275 -14.904 -3.355 143 HD2 LYS 16 2HD LYS 16 3.508 -16.696 -4.842 144 HD3 LYS 16 3HD LYS 16 3.557 -17.263 -3.171 145 HE2 LYS 16 2HE LYS 16 1.538 -18.065 -4.336 146 HE3 LYS 16 3HE LYS 16 1.100 -16.991 -3.010 147 HZ1 LYS 16 3HZ LYS 16 -0.151 -16.586 -5.066 148 HZ2 LYS 16 1HZ LYS 16 1.280 -16.158 -5.852 149 HZ3 LYS 16 2HZ LYS 16 0.710 -15.228 -4.556 150 H LYS 17 H LYS 17 4.482 -12.457 -3.128 151 HA LYS 17 HA LYS 17 6.977 -13.092 -1.918 152 HB2 LYS 17 2HB LYS 17 6.250 -11.206 -4.188 153 HB3 LYS 17 3HB LYS 17 7.915 -11.533 -3.704 154 HG2 LYS 17 2HG LYS 17 7.719 -13.867 -4.325 155 HG3 LYS 17 3HG LYS 17 5.982 -13.703 -4.595 156 HD2 LYS 17 2HD LYS 17 7.104 -13.725 -6.744 157 HD3 LYS 17 3HD LYS 17 6.438 -12.114 -6.465 158 HE2 LYS 17 2HE LYS 17 8.662 -11.914 -7.417 159 HE3 LYS 17 3HE LYS 17 8.717 -11.352 -5.747 160 HZ1 LYS 17 3HZ LYS 17 9.624 -13.986 -6.770 161 HZ2 LYS 17 1HZ LYS 17 9.563 -13.570 -5.132 162 HZ3 LYS 17 2HZ LYS 17 10.590 -12.735 -6.179 163 H ILE 18 H ILE 18 5.224 -9.978 -2.283 164 HA ILE 18 HA ILE 18 7.035 -8.328 -0.925 165 HB ILE 18 HB ILE 18 4.046 -8.049 -1.380 166 HG12 ILE 18 2HG1 ILE 18 6.424 -6.475 -2.493 167 HG13 ILE 18 3HG1 ILE 18 5.592 -7.781 -3.327 168 HG21 ILE 18 1HG2 ILE 18 5.781 -5.968 0.003 169 HG22 ILE 18 2HG2 ILE 18 4.460 -6.875 0.739 170 HG23 ILE 18 3HG2 ILE 18 4.120 -5.717 -0.545 171 HD11 ILE 18 3HD1 ILE 18 3.547 -6.435 -3.410 172 HD12 ILE 18 1HD1 ILE 18 4.910 -5.622 -4.181 173 HD13 ILE 18 2HD1 ILE 18 4.380 -5.119 -2.577 174 H LYS 19 H LYS 19 4.367 -10.335 0.353 175 HA LYS 19 HA LYS 19 4.319 -9.562 3.016 176 HB2 LYS 19 2HB LYS 19 4.022 -12.383 1.882 177 HB3 LYS 19 3HB LYS 19 3.654 -11.949 3.550 178 HG2 LYS 19 2HG LYS 19 1.969 -10.284 2.626 179 HG3 LYS 19 3HG LYS 19 2.233 -11.021 1.046 180 HD2 LYS 19 2HD LYS 19 1.470 -13.206 1.934 181 HD3 LYS 19 3HD LYS 19 1.228 -12.474 3.527 182 HE2 LYS 19 2HE LYS 19 -0.449 -10.923 2.489 183 HE3 LYS 19 3HE LYS 19 -0.266 -11.806 0.969 184 HZ1 LYS 19 3HZ LYS 19 -0.970 -13.826 2.214 185 HZ2 LYS 19 1HZ LYS 19 -2.165 -12.635 2.089 186 HZ3 LYS 19 2HZ LYS 19 -1.326 -12.842 3.539 187 H LYS 20 H LYS 20 6.579 -11.773 1.412 188 HA LYS 20 HA LYS 20 7.882 -12.542 3.881 189 HB2 LYS 20 2HB LYS 20 8.689 -13.202 1.029 190 HB3 LYS 20 3HB LYS 20 9.237 -14.011 2.495 191 HG2 LYS 20 2HG LYS 20 6.487 -14.109 1.223 192 HG3 LYS 20 3HG LYS 20 7.635 -15.433 1.421 193 HD2 LYS 20 2HD LYS 20 6.058 -14.038 3.627 194 HD3 LYS 20 3HD LYS 20 5.774 -15.658 2.992 195 HE2 LYS 20 2HE LYS 20 8.229 -14.760 4.550 196 HE3 LYS 20 3HE LYS 20 6.903 -15.744 5.165 197 HZ1 LYS 20 3HZ LYS 20 8.716 -16.549 2.954 198 HZ2 LYS 20 1HZ LYS 20 7.502 -17.495 3.654 199 HZ3 LYS 20 2HZ LYS 20 8.859 -17.051 4.560 200 H GLU 21 H GLU 21 8.855 -10.738 0.958 201 HA GLU 21 HA GLU 21 11.428 -10.004 1.566 202 HB2 GLU 21 2HB GLU 21 9.387 -8.171 0.218 203 HB3 GLU 21 3HB GLU 21 11.141 -8.025 0.101 204 HG2 GLU 21 2HG GLU 21 9.361 -10.178 -1.074 205 HG3 GLU 21 3HG GLU 21 10.347 -9.007 -1.939 206 H VAL 22 H VAL 22 8.482 -8.317 2.619 207 HA VAL 22 HA VAL 22 10.006 -6.093 3.710 208 HB VAL 22 HB VAL 22 7.927 -4.951 4.018 209 HG11 VAL 22 1HG1 VAL 22 8.695 -5.092 1.696 210 HG12 VAL 22 2HG1 VAL 22 6.933 -5.084 1.742 211 HG13 VAL 22 3HG1 VAL 22 7.801 -6.595 1.458 212 HG21 VAL 22 3HG2 VAL 22 5.703 -6.031 3.680 213 HG22 VAL 22 1HG2 VAL 22 6.563 -6.678 5.081 214 HG23 VAL 22 2HG2 VAL 22 6.502 -7.603 3.580 215 H GLU 23 H GLU 23 8.607 -9.011 5.013 216 HA GLU 23 HA GLU 23 8.410 -8.047 7.718 217 HB2 GLU 23 2HB GLU 23 7.876 -10.318 8.353 218 HB3 GLU 23 3HB GLU 23 6.981 -9.876 6.915 219 HG2 GLU 23 2HG GLU 23 7.581 -12.034 6.386 220 HG3 GLU 23 3HG GLU 23 8.905 -11.147 5.652 221 H ASN 24 H ASN 24 11.019 -9.167 5.752 222 HA ASN 24 HA ASN 24 12.934 -9.852 7.718 223 HB2 ASN 24 2HB ASN 24 13.251 -8.578 4.971 224 HB3 ASN 24 3HB ASN 24 14.636 -8.970 5.981 225 HD21 ASN 24 1HD2 ASN 24 11.714 -10.978 5.565 226 HD22 ASN 24 2HD2 ASN 24 12.547 -12.261 4.773 227 H GLN 25 H GLN 25 11.633 -6.803 6.630 228 HA GLN 25 HA GLN 25 13.705 -5.163 7.910 229 HB2 GLN 25 2HB GLN 25 11.260 -4.312 6.292 230 HB3 GLN 25 3HB GLN 25 12.610 -3.280 6.766 231 HG2 GLN 25 2HG GLN 25 12.750 -5.635 4.857 232 HG3 GLN 25 3HG GLN 25 12.721 -3.935 4.400 233 HE21 GLN 25 1HE2 GLN 25 14.664 -6.522 5.670 234 HE22 GLN 25 2HE2 GLN 25 16.179 -5.702 5.581 235 H GLY 26 H GLY 26 11.130 -6.733 9.138 236 HA2 GLY 26 2HA GLY 26 9.885 -6.505 11.032 237 HA3 GLY 26 3HA GLY 26 10.784 -5.045 11.403 238 H TYR 27 H TYR 27 8.758 -5.656 8.552 239 HA TYR 27 HA TYR 27 6.834 -3.581 9.434 240 HB2 TYR 27 2HB TYR 27 7.708 -4.480 6.651 241 HB3 TYR 27 3HB TYR 27 6.195 -3.599 6.893 242 HD1 TYR 27 HD2 TYR 27 9.775 -3.324 8.034 243 HD2 TYR 27 HD1 TYR 27 6.347 -1.247 6.550 244 HE1 TYR 27 HE2 TYR 27 11.006 -1.225 8.165 245 HE2 TYR 27 HE1 TYR 27 7.598 0.870 6.681 246 HH TYR 27 HH TYR 27 10.982 0.975 7.318 247 H GLN 28 H GLN 28 5.052 -4.353 10.254 248 HA GLN 28 HA GLN 28 4.323 -7.110 10.152 249 HB2 GLN 28 2HB GLN 28 2.852 -4.693 11.280 250 HB3 GLN 28 3HB GLN 28 2.252 -6.338 11.422 251 HG2 GLN 28 2HG GLN 28 3.304 -5.745 13.499 252 HG3 GLN 28 3HG GLN 28 4.308 -6.952 12.701 253 HE21 GLN 28 1HE2 GLN 28 4.026 -3.562 13.521 254 HE22 GLN 28 2HE2 GLN 28 5.694 -3.179 13.348 255 H VAL 29 H VAL 29 3.448 -8.012 8.432 256 HA VAL 29 HA VAL 29 2.175 -6.438 6.358 257 HB VAL 29 HB VAL 29 2.470 -9.466 6.326 258 HG11 VAL 29 1HG1 VAL 29 2.365 -7.389 4.099 259 HG12 VAL 29 2HG1 VAL 29 1.078 -8.514 4.546 260 HG13 VAL 29 3HG1 VAL 29 2.585 -9.125 3.867 261 HG21 VAL 29 3HG2 VAL 29 4.682 -8.589 6.903 262 HG22 VAL 29 1HG2 VAL 29 4.610 -7.460 5.548 263 HG23 VAL 29 2HG2 VAL 29 4.676 -9.198 5.246 264 H ARG 30 H ARG 30 0.085 -6.106 6.311 265 HA ARG 30 HA ARG 30 -1.854 -8.099 7.302 266 HB2 ARG 30 2HB ARG 30 -1.986 -5.056 7.563 267 HB3 ARG 30 3HB ARG 30 -3.311 -6.148 7.961 268 HG2 ARG 30 2HG ARG 30 -0.607 -6.349 9.338 269 HG3 ARG 30 3HG ARG 30 -1.854 -5.239 9.899 270 HD2 ARG 30 2HD ARG 30 -1.809 -7.389 11.164 271 HD3 ARG 30 3HD ARG 30 -3.362 -7.067 10.398 272 HE ARG 30 HE ARG 30 -1.361 -9.015 9.391 273 HH11 ARG 30 1HH1 ARG 30 -4.733 -8.055 9.809 274 HH12 ARG 30 2HH1 ARG 30 -5.355 -9.505 9.099 275 HH21 ARG 30 1HH2 ARG 30 -2.223 -10.886 8.403 276 HH22 ARG 30 2HH2 ARG 30 -3.936 -11.112 8.302 277 H ASP 31 H ASP 31 -2.969 -8.855 5.623 278 HA ASP 31 HA ASP 31 -3.114 -7.248 3.123 279 HB2 ASP 31 2HB ASP 31 -3.297 -9.330 1.864 280 HB3 ASP 31 3HB ASP 31 -1.866 -9.387 2.881 281 H VAL 32 H VAL 32 -5.039 -6.874 2.211 282 HA VAL 32 HA VAL 32 -7.512 -7.837 3.528 283 HB VAL 32 HB VAL 32 -7.000 -5.095 2.252 284 HG11 VAL 32 1HG1 VAL 32 -9.291 -4.514 2.986 285 HG12 VAL 32 2HG1 VAL 32 -9.532 -6.163 3.567 286 HG13 VAL 32 3HG1 VAL 32 -9.314 -5.857 1.843 287 HG21 VAL 32 3HG2 VAL 32 -7.341 -4.185 4.542 288 HG22 VAL 32 1HG2 VAL 32 -5.946 -5.266 4.473 289 HG23 VAL 32 2HG2 VAL 32 -7.464 -5.829 5.177 290 H ASN 33 H ASN 33 -8.495 -9.191 2.188 291 HA ASN 33 HA ASN 33 -8.182 -8.990 -0.742 292 HB2 ASN 33 2HB ASN 33 -9.466 -11.301 0.791 293 HB3 ASN 33 3HB ASN 33 -8.807 -11.305 -0.846 294 HD21 ASN 33 1HD2 ASN 33 -8.057 -11.368 2.560 295 HD22 ASN 33 2HD2 ASN 33 -6.413 -11.873 2.405 296 H ASP 34 H ASP 34 -10.418 -8.362 1.817 297 HA ASP 34 HA ASP 34 -12.614 -7.845 -0.053 298 HB2 ASP 34 2HB ASP 34 -12.832 -10.271 0.686 299 HB3 ASP 34 3HB ASP 34 -12.991 -9.707 2.350 300 H SER 35 H SER 35 -14.281 -6.545 0.826 301 HA SER 35 HA SER 35 -13.560 -4.368 2.355 302 HB2 SER 35 2HB SER 35 -16.361 -5.444 1.823 303 HB3 SER 35 3HB SER 35 -15.964 -3.783 2.293 304 HG SER 35 HG SER 35 -15.182 -3.407 0.341 305 H ASP 36 H ASP 36 -15.050 -7.389 3.440 306 HA ASP 36 HA ASP 36 -15.939 -6.674 6.000 307 HB2 ASP 36 2HB ASP 36 -16.447 -8.849 4.885 308 HB3 ASP 36 3HB ASP 36 -14.762 -9.334 5.054 309 H GLU 37 H GLU 37 -12.817 -7.866 4.869 310 HA GLU 37 HA GLU 37 -11.461 -7.986 7.362 311 HB2 GLU 37 2HB GLU 37 -10.361 -7.766 4.526 312 HB3 GLU 37 3HB GLU 37 -9.409 -8.186 5.953 313 HG2 GLU 37 2HG GLU 37 -10.695 -10.242 6.252 314 HG3 GLU 37 3HG GLU 37 -11.745 -9.812 4.895 315 H LEU 38 H LEU 38 -11.669 -5.531 4.777 316 HA LEU 38 HA LEU 38 -9.783 -3.669 5.624 317 HB2 LEU 38 2HB LEU 38 -10.874 -3.524 3.475 318 HB3 LEU 38 3HB LEU 38 -12.446 -3.323 4.211 319 HG LEU 38 HG LEU 38 -10.398 -1.168 4.753 320 HD11 LEU 38 1HD1 LEU 38 -11.874 -1.360 2.118 321 HD12 LEU 38 2HD1 LEU 38 -10.134 -1.551 2.349 322 HD13 LEU 38 3HD1 LEU 38 -10.897 0.003 2.678 323 HD21 LEU 38 3HD2 LEU 38 -12.374 0.321 4.621 324 HD22 LEU 38 1HD2 LEU 38 -12.623 -0.971 5.793 325 HD23 LEU 38 2HD2 LEU 38 -13.395 -1.059 4.209 326 H LYS 39 H LYS 39 -13.200 -3.964 6.577 327 HA LYS 39 HA LYS 39 -13.370 -1.671 8.227 328 HB2 LYS 39 2HB LYS 39 -14.994 -4.247 8.419 329 HB3 LYS 39 3HB LYS 39 -15.445 -2.682 9.104 330 HG2 LYS 39 2HG LYS 39 -15.609 -1.737 6.817 331 HG3 LYS 39 3HG LYS 39 -15.153 -3.297 6.141 332 HD2 LYS 39 2HD LYS 39 -17.546 -3.093 5.963 333 HD3 LYS 39 3HD LYS 39 -17.199 -4.305 7.199 334 HE2 LYS 39 2HE LYS 39 -19.016 -2.864 7.948 335 HE3 LYS 39 3HE LYS 39 -17.602 -2.563 8.956 336 HZ1 LYS 39 3HZ LYS 39 -18.625 -0.499 8.340 337 HZ2 LYS 39 1HZ LYS 39 -18.551 -0.880 6.695 338 HZ3 LYS 39 2HZ LYS 39 -17.130 -0.604 7.566 339 H LYS 40 H LYS 40 -12.584 -5.078 8.944 340 HA LYS 40 HA LYS 40 -12.495 -4.944 11.761 341 HB2 LYS 40 2HB LYS 40 -10.916 -6.806 9.930 342 HB3 LYS 40 3HB LYS 40 -11.173 -7.052 11.656 343 HG2 LYS 40 2HG LYS 40 -13.291 -7.122 9.481 344 HG3 LYS 40 3HG LYS 40 -12.609 -8.513 10.328 345 HD2 LYS 40 2HD LYS 40 -13.577 -7.561 12.474 346 HD3 LYS 40 3HD LYS 40 -14.373 -6.320 11.497 347 HE2 LYS 40 2HE LYS 40 -14.836 -9.325 11.342 348 HE3 LYS 40 3HE LYS 40 -15.957 -8.116 11.973 349 HZ1 LYS 40 3HZ LYS 40 -16.632 -8.708 9.783 350 HZ2 LYS 40 1HZ LYS 40 -15.083 -8.459 9.149 351 HZ3 LYS 40 2HZ LYS 40 -15.993 -7.147 9.698 352 H GLU 41 H GLU 41 -9.944 -4.578 9.309 353 HA GLU 41 HA GLU 41 -7.716 -4.358 11.045 354 HB2 GLU 41 2HB GLU 41 -8.079 -3.386 8.171 355 HB3 GLU 41 3HB GLU 41 -6.526 -3.464 9.011 356 HG2 GLU 41 2HG GLU 41 -8.310 -5.819 8.287 357 HG3 GLU 41 3HG GLU 41 -6.812 -5.362 7.486 358 H MET 42 H MET 42 -9.867 -1.955 9.559 359 HA MET 42 HA MET 42 -8.354 0.348 10.196 360 HB2 MET 42 2HB MET 42 -11.138 -0.172 9.184 361 HB3 MET 42 3HB MET 42 -10.816 1.427 9.846 362 HG2 MET 42 2HG MET 42 -9.252 0.105 7.627 363 HG3 MET 42 3HG MET 42 -10.457 1.391 7.436 364 HE1 MET 42 3HE MET 42 -6.869 3.051 6.862 365 HE2 MET 42 1HE MET 42 -8.393 2.650 6.081 366 HE3 MET 42 2HE MET 42 -7.268 1.370 6.537 367 H LYS 43 H LYS 43 -10.871 -1.378 11.973 368 HA LYS 43 HA LYS 43 -11.201 0.554 14.028 369 HB2 LYS 43 2HB LYS 43 -11.566 -2.467 14.260 370 HB3 LYS 43 3HB LYS 43 -12.192 -1.255 15.381 371 HG2 LYS 43 2HG LYS 43 -12.996 -1.617 12.480 372 HG3 LYS 43 3HG LYS 43 -13.960 -2.045 13.894 373 HD2 LYS 43 2HD LYS 43 -14.360 0.243 14.453 374 HD3 LYS 43 3HD LYS 43 -13.063 0.823 13.407 375 HE2 LYS 43 2HE LYS 43 -15.277 1.287 12.432 376 HE3 LYS 43 3HE LYS 43 -14.345 0.191 11.415 377 HZ1 LYS 43 3HZ LYS 43 -15.610 -1.659 12.320 378 HZ2 LYS 43 1HZ LYS 43 -16.634 -0.519 11.608 379 HZ3 LYS 43 2HZ LYS 43 -16.503 -0.608 13.290 380 H LYS 44 H LYS 44 -8.899 -2.078 13.567 381 HA LYS 44 HA LYS 44 -7.693 -2.014 16.159 382 HB2 LYS 44 2HB LYS 44 -6.541 -3.023 13.519 383 HB3 LYS 44 3HB LYS 44 -5.935 -3.424 15.123 384 HG2 LYS 44 2HG LYS 44 -8.780 -4.136 14.345 385 HG3 LYS 44 3HG LYS 44 -7.439 -5.132 13.795 386 HD2 LYS 44 2HD LYS 44 -8.255 -6.192 15.748 387 HD3 LYS 44 3HD LYS 44 -6.765 -5.395 16.244 388 HE2 LYS 44 2HE LYS 44 -8.453 -5.124 17.962 389 HE3 LYS 44 3HE LYS 44 -8.133 -3.553 17.237 390 HZ1 LYS 44 3HZ LYS 44 -10.159 -3.870 15.879 391 HZ2 LYS 44 1HZ LYS 44 -10.470 -3.838 17.542 392 HZ3 LYS 44 2HZ LYS 44 -10.471 -5.310 16.715 393 H LEU 45 H LEU 45 -7.111 -0.302 13.121 394 HA LEU 45 HA LEU 45 -4.637 0.964 13.914 395 HB2 LEU 45 2HB LEU 45 -6.535 1.563 11.606 396 HB3 LEU 45 3HB LEU 45 -4.942 2.284 11.804 397 HG LEU 45 HG LEU 45 -5.508 -0.673 11.309 398 HD11 LEU 45 1HD1 LEU 45 -5.953 0.685 9.327 399 HD12 LEU 45 2HD1 LEU 45 -4.536 -0.334 9.098 400 HD13 LEU 45 3HD1 LEU 45 -4.335 1.392 9.424 401 HD21 LEU 45 3HD2 LEU 45 -2.830 0.752 11.528 402 HD22 LEU 45 1HD2 LEU 45 -3.073 -0.934 11.052 403 HD23 LEU 45 2HD2 LEU 45 -3.497 -0.412 12.678 404 H ALA 46 H ALA 46 -8.068 1.790 13.883 405 HA ALA 46 HA ALA 46 -7.834 4.548 14.635 406 HB1 ALA 46 3HB ALA 46 -10.272 4.436 14.948 407 HB2 ALA 46 1HB ALA 46 -10.218 2.673 14.849 408 HB3 ALA 46 2HB ALA 46 -9.806 3.651 13.438 409 H GLU 47 H GLU 47 -8.026 1.526 16.354 410 HA GLU 47 HA GLU 47 -8.384 2.602 19.008 411 HB2 GLU 47 2HB GLU 47 -7.611 -0.134 17.929 412 HB3 GLU 47 3HB GLU 47 -7.640 0.201 19.661 413 HG2 GLU 47 2HG GLU 47 -10.001 0.613 19.634 414 HG3 GLU 47 3HG GLU 47 -10.043 0.640 17.869 415 H GLU 48 H GLU 48 -5.822 2.626 16.865 416 HA GLU 48 HA GLU 48 -3.649 3.126 16.916 417 HB2 GLU 48 2HB GLU 48 -4.312 4.279 19.647 418 HB3 GLU 48 3HB GLU 48 -2.877 4.675 18.698 419 HG2 GLU 48 2HG GLU 48 -4.363 5.612 16.920 420 HG3 GLU 48 3HG GLU 48 -5.764 5.286 17.934 421 H LYS 49 H LYS 49 -4.272 0.508 17.680 422 HA LYS 49 HA LYS 49 -2.912 -0.410 19.992 423 HB2 LYS 49 2HB LYS 49 -4.649 -1.750 18.856 424 HB3 LYS 49 3HB LYS 49 -3.625 -1.901 17.427 425 HG2 LYS 49 2HG LYS 49 -1.939 -3.134 18.838 426 HG3 LYS 49 3HG LYS 49 -3.078 -3.069 20.185 427 HD2 LYS 49 2HD LYS 49 -3.178 -5.246 19.062 428 HD3 LYS 49 3HD LYS 49 -4.710 -4.388 18.884 429 HE2 LYS 49 2HE LYS 49 -4.093 -3.750 16.578 430 HE3 LYS 49 3HE LYS 49 -2.529 -4.546 16.766 431 HZ1 LYS 49 3HZ LYS 49 -4.084 -5.931 15.574 432 HZ2 LYS 49 1HZ LYS 49 -5.176 -5.879 16.864 433 HZ3 LYS 49 2HZ LYS 49 -3.686 -6.652 17.053 434 H ASN 50 H ASN 50 -0.852 0.372 20.139 435 HA ASN 50 HA ASN 50 1.394 0.339 20.063 436 HB2 ASN 50 2HB ASN 50 1.049 -1.983 18.133 437 HB3 ASN 50 3HB ASN 50 2.586 -1.517 18.852 438 HD21 ASN 50 1HD2 ASN 50 0.982 -3.997 19.034 439 HD22 ASN 50 2HD2 ASN 50 0.775 -4.293 20.723 440 H PHE 51 H PHE 51 2.518 1.986 19.191 441 HA PHE 51 HA PHE 51 1.988 2.992 16.564 442 HB2 PHE 51 2HB PHE 51 3.705 4.692 17.052 443 HB3 PHE 51 3HB PHE 51 2.576 4.539 18.381 444 HD1 PHE 51 HD1 PHE 51 3.376 3.048 20.420 445 HD2 PHE 51 HD2 PHE 51 6.030 4.709 17.502 446 HE1 PHE 51 HE1 PHE 51 5.247 2.843 21.997 447 HE2 PHE 51 HE2 PHE 51 7.890 4.494 19.086 448 HZ PHE 51 HZ PHE 51 7.508 3.561 21.334 449 H GLU 52 H GLU 52 2.606 1.889 14.824 450 HA GLU 52 HA GLU 52 5.240 0.558 14.655 451 HB2 GLU 52 2HB GLU 52 2.548 -0.762 14.072 452 HB3 GLU 52 3HB GLU 52 4.119 -1.478 13.705 453 HG2 GLU 52 2HG GLU 52 4.634 -1.663 16.066 454 HG3 GLU 52 3HG GLU 52 3.160 -0.802 16.502 455 H LYS 53 H LYS 53 5.862 0.007 12.510 456 HA LYS 53 HA LYS 53 4.622 1.547 10.335 457 HB2 LYS 53 2HB LYS 53 7.185 -0.124 10.393 458 HB3 LYS 53 3HB LYS 53 6.574 0.696 8.970 459 HG2 LYS 53 2HG LYS 53 8.363 2.014 9.868 460 HG3 LYS 53 3HG LYS 53 6.853 2.884 10.134 461 HD2 LYS 53 2HD LYS 53 8.360 3.021 12.088 462 HD3 LYS 53 3HD LYS 53 6.841 2.218 12.491 463 HE2 LYS 53 2HE LYS 53 8.728 1.051 13.528 464 HE3 LYS 53 3HE LYS 53 7.978 0.011 12.315 465 HZ1 LYS 53 3HZ LYS 53 10.443 1.619 11.939 466 HZ2 LYS 53 1HZ LYS 53 9.741 0.612 10.779 467 HZ3 LYS 53 2HZ LYS 53 10.383 -0.049 12.194 468 H ILE 54 H ILE 54 2.766 0.491 9.782 469 HA ILE 54 HA ILE 54 2.696 -2.449 9.498 470 HB ILE 54 HB ILE 54 0.370 -0.458 9.375 471 HG12 ILE 54 2HG1 ILE 54 1.424 -0.394 11.627 472 HG13 ILE 54 3HG1 ILE 54 -0.179 -1.120 11.702 473 HG21 ILE 54 1HG2 ILE 54 -0.111 -2.585 8.236 474 HG22 ILE 54 2HG2 ILE 54 -1.072 -2.448 9.710 475 HG23 ILE 54 3HG2 ILE 54 0.356 -3.488 9.680 476 HD11 ILE 54 3HD1 ILE 54 0.877 -3.353 11.783 477 HD12 ILE 54 1HD1 ILE 54 1.354 -2.304 13.118 478 HD13 ILE 54 2HD1 ILE 54 2.463 -2.572 11.775 479 H LEU 55 H LEU 55 2.612 -3.349 7.483 480 HA LEU 55 HA LEU 55 2.300 -1.577 5.134 481 HB2 LEU 55 2HB LEU 55 4.435 -2.917 5.422 482 HB3 LEU 55 3HB LEU 55 3.487 -4.376 5.199 483 HG LEU 55 HG LEU 55 3.380 -2.238 3.058 484 HD11 LEU 55 1HD1 LEU 55 5.323 -3.130 1.911 485 HD12 LEU 55 2HD1 LEU 55 5.635 -4.231 3.254 486 HD13 LEU 55 3HD1 LEU 55 5.767 -2.488 3.493 487 HD21 LEU 55 3HD2 LEU 55 1.882 -4.163 2.821 488 HD22 LEU 55 1HD2 LEU 55 3.258 -5.269 2.889 489 HD23 LEU 55 2HD2 LEU 55 3.085 -4.147 1.534 490 H ILE 56 H ILE 56 0.366 -1.635 4.205 491 HA ILE 56 HA ILE 56 -1.443 -3.930 4.640 492 HB ILE 56 HB ILE 56 -2.143 -1.114 3.688 493 HG12 ILE 56 2HG1 ILE 56 -1.412 -1.130 6.096 494 HG13 ILE 56 3HG1 ILE 56 -3.097 -0.668 5.901 495 HG21 ILE 56 1HG2 ILE 56 -4.510 -1.796 4.074 496 HG22 ILE 56 2HG2 ILE 56 -3.963 -3.431 4.456 497 HG23 ILE 56 3HG2 ILE 56 -3.727 -2.779 2.833 498 HD11 ILE 56 3HD1 ILE 56 -2.772 -2.107 7.815 499 HD12 ILE 56 1HD1 ILE 56 -2.099 -3.371 6.788 500 HD13 ILE 56 2HD1 ILE 56 -3.793 -2.898 6.615 501 H ILE 57 H ILE 57 -1.274 -5.347 2.965 502 HA ILE 57 HA ILE 57 -0.954 -4.403 0.192 503 HB ILE 57 HB ILE 57 -1.313 -7.277 1.186 504 HG12 ILE 57 2HG1 ILE 57 1.245 -5.832 0.326 505 HG13 ILE 57 3HG1 ILE 57 0.825 -6.258 1.983 506 HG21 ILE 57 1HG2 ILE 57 -0.570 -7.935 -1.096 507 HG22 ILE 57 2HG2 ILE 57 -0.498 -6.234 -1.567 508 HG23 ILE 57 3HG2 ILE 57 -2.048 -6.975 -1.161 509 HD11 ILE 57 3HD1 ILE 57 2.449 -7.794 1.071 510 HD12 ILE 57 1HD1 ILE 57 1.368 -8.204 -0.263 511 HD13 ILE 57 2HD1 ILE 57 0.934 -8.632 1.395 512 H SER 58 H SER 58 -2.656 -4.196 -1.171 513 HA SER 58 HA SER 58 -5.296 -5.330 -0.497 514 HB2 SER 58 2HB SER 58 -5.267 -2.926 0.162 515 HB3 SER 58 3HB SER 58 -4.762 -2.469 -1.463 516 HG SER 58 HG SER 58 -6.742 -2.714 -2.134 517 H ASN 59 H ASN 59 -5.866 -6.619 -2.148 518 HA ASN 59 HA ASN 59 -4.494 -6.484 -4.713 519 HB2 ASN 59 2HB ASN 59 -5.840 -8.596 -5.195 520 HB3 ASN 59 3HB ASN 59 -4.741 -8.669 -3.828 521 HD21 ASN 59 1HD2 ASN 59 -5.869 -10.420 -2.980 522 HD22 ASN 59 2HD2 ASN 59 -7.389 -10.240 -2.189 523 H ASP 60 H ASP 60 -7.496 -5.412 -3.422 524 HA ASP 60 HA ASP 60 -8.654 -4.922 -6.099 525 HB2 ASP 60 2HB ASP 60 -10.144 -6.204 -4.677 526 HB3 ASP 60 3HB ASP 60 -9.905 -5.095 -3.328 527 H LYS 61 H LYS 61 -9.244 -2.860 -6.688 528 HA LYS 61 HA LYS 61 -7.529 -0.796 -5.634 529 HB2 LYS 61 2HB LYS 61 -9.536 -0.746 -7.924 530 HB3 LYS 61 3HB LYS 61 -8.361 0.526 -7.574 531 HG2 LYS 61 2HG LYS 61 -6.522 -1.105 -7.949 532 HG3 LYS 61 3HG LYS 61 -7.722 -2.339 -8.362 533 HD2 LYS 61 2HD LYS 61 -8.470 -0.957 -10.281 534 HD3 LYS 61 3HD LYS 61 -7.280 0.281 -9.856 535 HE2 LYS 61 2HE LYS 61 -6.646 -2.573 -10.680 536 HE3 LYS 61 3HE LYS 61 -6.484 -1.144 -11.703 537 HZ1 LYS 61 3HZ LYS 61 -4.816 -0.285 -10.193 538 HZ2 LYS 61 1HZ LYS 61 -4.370 -1.818 -10.747 539 HZ3 LYS 61 2HZ LYS 61 -4.979 -1.628 -9.178 540 H GLN 62 H GLN 62 -10.968 -1.537 -5.517 541 HA GLN 62 HA GLN 62 -11.856 1.045 -4.626 542 HB2 GLN 62 2HB GLN 62 -13.413 -0.569 -5.694 543 HB3 GLN 62 3HB GLN 62 -13.196 -1.683 -4.353 544 HG2 GLN 62 2HG GLN 62 -15.331 -0.522 -4.146 545 HG3 GLN 62 3HG GLN 62 -14.263 -0.065 -2.819 546 HE21 GLN 62 1HE2 GLN 62 -15.413 1.844 -2.441 547 HE22 GLN 62 2HE2 GLN 62 -15.328 3.210 -3.494 548 H LEU 63 H LEU 63 -10.795 -1.976 -3.040 549 HA LEU 63 HA LEU 63 -11.211 -1.315 -0.352 550 HB2 LEU 63 2HB LEU 63 -9.061 -3.008 -1.678 551 HB3 LEU 63 3HB LEU 63 -9.203 -2.869 0.070 552 HG LEU 63 HG LEU 63 -11.320 -4.036 -1.774 553 HD11 LEU 63 1HD1 LEU 63 -9.354 -5.482 -1.630 554 HD12 LEU 63 2HD1 LEU 63 -10.726 -6.196 -0.788 555 HD13 LEU 63 3HD1 LEU 63 -9.427 -5.436 0.134 556 HD21 LEU 63 3HD2 LEU 63 -12.317 -2.973 0.196 557 HD22 LEU 63 1HD2 LEU 63 -11.238 -3.887 1.256 558 HD23 LEU 63 2HD2 LEU 63 -12.454 -4.725 0.288 559 H LEU 64 H LEU 64 -8.488 -0.582 -2.521 560 HA LEU 64 HA LEU 64 -6.791 0.672 -0.659 561 HB2 LEU 64 2HB LEU 64 -5.980 -0.037 -2.827 562 HB3 LEU 64 3HB LEU 64 -7.084 1.038 -3.658 563 HG LEU 64 HG LEU 64 -4.984 2.253 -1.837 564 HD11 LEU 64 1HD1 LEU 64 -4.422 1.349 -4.663 565 HD12 LEU 64 2HD1 LEU 64 -3.716 0.682 -3.188 566 HD13 LEU 64 3HD1 LEU 64 -3.366 2.343 -3.654 567 HD21 LEU 64 3HD2 LEU 64 -6.243 3.220 -4.432 568 HD22 LEU 64 1HD2 LEU 64 -5.035 4.102 -3.496 569 HD23 LEU 64 2HD2 LEU 64 -6.626 3.792 -2.812 570 H LYS 65 H LYS 65 -9.323 2.012 -2.784 571 HA LYS 65 HA LYS 65 -8.910 4.736 -2.193 572 HB2 LYS 65 2HB LYS 65 -11.411 3.298 -3.163 573 HB3 LYS 65 3HB LYS 65 -11.229 5.054 -3.121 574 HG2 LYS 65 2HG LYS 65 -9.368 4.934 -4.708 575 HG3 LYS 65 3HG LYS 65 -9.461 3.171 -4.719 576 HD2 LYS 65 2HD LYS 65 -10.543 4.065 -6.715 577 HD3 LYS 65 3HD LYS 65 -11.743 3.295 -5.678 578 HE2 LYS 65 2HE LYS 65 -12.484 5.509 -4.871 579 HE3 LYS 65 3HE LYS 65 -11.245 6.293 -5.854 580 HZ1 LYS 65 3HZ LYS 65 -13.442 4.624 -6.952 581 HZ2 LYS 65 1HZ LYS 65 -12.322 5.532 -7.831 582 HZ3 LYS 65 2HZ LYS 65 -13.470 6.312 -6.871 583 H GLU 66 H GLU 66 -11.363 2.482 -0.899 584 HA GLU 66 HA GLU 66 -12.563 4.032 1.056 585 HB2 GLU 66 2HB GLU 66 -11.912 1.056 1.184 586 HB3 GLU 66 3HB GLU 66 -13.080 1.877 2.218 587 HG2 GLU 66 2HG GLU 66 -13.293 1.591 -0.797 588 HG3 GLU 66 3HG GLU 66 -14.110 0.568 0.379 589 H MET 67 H MET 67 -9.668 1.992 1.268 590 HA MET 67 HA MET 67 -9.023 2.171 3.958 591 HB2 MET 67 2HB MET 67 -7.962 0.723 2.091 592 HB3 MET 67 3HB MET 67 -6.944 2.105 1.729 593 HG2 MET 67 2HG MET 67 -5.615 0.756 3.106 594 HG3 MET 67 3HG MET 67 -6.235 1.972 4.219 595 HE1 MET 67 3HE MET 67 -8.079 -1.222 2.676 596 HE2 MET 67 1HE MET 67 -7.757 -2.389 3.956 597 HE3 MET 67 2HE MET 67 -6.424 -1.745 2.998 598 H LEU 68 H LEU 68 -7.797 4.208 1.268 599 HA LEU 68 HA LEU 68 -6.065 5.790 2.844 600 HB2 LEU 68 2HB LEU 68 -7.217 6.304 0.087 601 HB3 LEU 68 3HB LEU 68 -5.968 7.298 0.827 602 HG LEU 68 HG LEU 68 -5.712 4.374 0.011 603 HD11 LEU 68 1HD1 LEU 68 -4.354 6.860 -1.053 604 HD12 LEU 68 2HD1 LEU 68 -5.622 5.931 -1.858 605 HD13 LEU 68 3HD1 LEU 68 -4.048 5.198 -1.571 606 HD21 LEU 68 3HD2 LEU 68 -4.451 4.736 2.085 607 HD22 LEU 68 1HD2 LEU 68 -3.639 6.135 1.374 608 HD23 LEU 68 2HD2 LEU 68 -3.359 4.516 0.723 609 H GLU 69 H GLU 69 -9.430 6.267 1.817 610 HA GLU 69 HA GLU 69 -9.715 8.961 2.715 611 HB2 GLU 69 2HB GLU 69 -11.801 6.767 2.318 612 HB3 GLU 69 3HB GLU 69 -12.186 8.467 2.613 613 HG2 GLU 69 2HG GLU 69 -11.058 9.109 0.531 614 HG3 GLU 69 3HG GLU 69 -10.588 7.435 0.246 615 H LEU 70 H LEU 70 -10.247 5.809 4.264 616 HA LEU 70 HA LEU 70 -11.212 6.791 6.761 617 HB2 LEU 70 2HB LEU 70 -9.962 4.140 5.958 618 HB3 LEU 70 3HB LEU 70 -10.599 4.446 7.571 619 HG LEU 70 HG LEU 70 -12.300 4.641 5.046 620 HD11 LEU 70 1HD1 LEU 70 -11.499 2.345 5.275 621 HD12 LEU 70 2HD1 LEU 70 -13.226 2.454 5.604 622 HD13 LEU 70 3HD1 LEU 70 -12.082 2.289 6.943 623 HD21 LEU 70 3HD2 LEU 70 -13.102 4.451 7.969 624 HD22 LEU 70 1HD2 LEU 70 -14.197 4.550 6.585 625 HD23 LEU 70 2HD2 LEU 70 -13.156 5.914 6.978 626 H ILE 71 H ILE 71 -7.964 6.158 5.492 627 HA ILE 71 HA ILE 71 -6.528 6.542 7.933 628 HB ILE 71 HB ILE 71 -5.528 6.905 5.067 629 HG12 ILE 71 2HG1 ILE 71 -5.158 4.497 6.913 630 HG13 ILE 71 3HG1 ILE 71 -6.387 4.589 5.663 631 HG21 ILE 71 1HG2 ILE 71 -3.246 6.606 6.070 632 HG22 ILE 71 2HG2 ILE 71 -3.966 6.675 7.674 633 HG23 ILE 71 3HG2 ILE 71 -4.044 8.077 6.609 634 HD11 ILE 71 3HD1 ILE 71 -4.507 3.274 4.929 635 HD12 ILE 71 1HD1 ILE 71 -3.408 4.622 5.209 636 HD13 ILE 71 2HD1 ILE 71 -4.642 4.733 3.950 637 H SER 72 H SER 72 -7.611 8.712 5.314 638 HA SER 72 HA SER 72 -6.320 11.072 6.138 639 HB2 SER 72 2HB SER 72 -8.974 10.739 4.664 640 HB3 SER 72 3HB SER 72 -8.045 12.238 4.765 641 HG SER 72 HG SER 72 -6.317 10.578 3.870 642 H LYS 73 H LYS 73 -9.332 9.509 7.167 643 HA LYS 73 HA LYS 73 -10.307 11.577 8.865 644 HB2 LYS 73 2HB LYS 73 -10.824 8.575 9.024 645 HB3 LYS 73 3HB LYS 73 -11.763 9.818 9.854 646 HG2 LYS 73 2HG LYS 73 -11.542 9.466 6.843 647 HG3 LYS 73 3HG LYS 73 -12.910 8.964 7.841 648 HD2 LYS 73 2HD LYS 73 -13.366 11.320 8.428 649 HD3 LYS 73 3HD LYS 73 -11.956 11.844 7.503 650 HE2 LYS 73 2HE LYS 73 -13.011 11.018 5.427 651 HE3 LYS 73 3HE LYS 73 -14.415 10.478 6.352 652 HZ1 LYS 73 3HZ LYS 73 -14.892 12.734 6.941 653 HZ2 LYS 73 1HZ LYS 73 -14.745 12.634 5.261 654 HZ3 LYS 73 2HZ LYS 73 -13.491 13.295 6.183 655 H LEU 74 H LEU 74 -8.174 8.779 9.399 656 HA LEU 74 HA LEU 74 -7.890 9.196 12.239 657 HB2 LEU 74 2HB LEU 74 -6.235 7.497 10.327 658 HB3 LEU 74 3HB LEU 74 -6.143 7.429 12.083 659 HG LEU 74 HG LEU 74 -8.550 6.637 10.386 660 HD11 LEU 74 1HD1 LEU 74 -6.752 5.001 10.228 661 HD12 LEU 74 2HD1 LEU 74 -8.115 4.349 11.134 662 HD13 LEU 74 3HD1 LEU 74 -6.667 4.889 11.990 663 HD21 LEU 74 3HD2 LEU 74 -9.587 5.860 12.478 664 HD22 LEU 74 1HD2 LEU 74 -9.308 7.599 12.499 665 HD23 LEU 74 2HD2 LEU 74 -8.237 6.525 13.404 666 H GLY 75 H GLY 75 -5.220 9.135 9.842 667 HA2 GLY 75 2HA GLY 75 -4.174 11.326 9.242 668 HA3 GLY 75 3HA GLY 75 -4.131 11.665 10.967 669 H TYR 76 H TYR 76 -3.023 9.286 8.566 670 HA TYR 76 HA TYR 76 -0.515 8.898 10.131 671 HB2 TYR 76 2HB TYR 76 -2.171 6.721 8.781 672 HB3 TYR 76 3HB TYR 76 -0.546 6.472 9.412 673 HD1 TYR 76 HD1 TYR 76 -0.508 7.814 11.979 674 HD2 TYR 76 HD2 TYR 76 -3.684 5.552 10.211 675 HE1 TYR 76 HE1 TYR 76 -1.390 7.316 14.206 676 HE2 TYR 76 HE2 TYR 76 -4.570 5.054 12.455 677 HH TYR 76 HH TYR 76 -3.421 6.666 15.278 678 H LYS 77 H LYS 77 1.372 8.485 8.997 679 HA LYS 77 HA LYS 77 1.613 9.664 6.396 680 HB2 LYS 77 2HB LYS 77 3.616 8.276 8.223 681 HB3 LYS 77 3HB LYS 77 4.067 8.908 6.641 682 HG2 LYS 77 2HG LYS 77 2.947 10.561 8.938 683 HG3 LYS 77 3HG LYS 77 4.654 10.453 8.481 684 HD2 LYS 77 2HD LYS 77 2.419 11.538 6.697 685 HD3 LYS 77 3HD LYS 77 3.559 12.526 7.615 686 HE2 LYS 77 2HE LYS 77 5.430 11.645 6.280 687 HE3 LYS 77 3HE LYS 77 4.332 10.581 5.400 688 HZ1 LYS 77 3HZ LYS 77 4.856 12.577 4.150 689 HZ2 LYS 77 1HZ LYS 77 4.230 13.546 5.385 690 HZ3 LYS 77 2HZ LYS 77 3.208 12.519 4.520 691 H VAL 78 H VAL 78 0.809 8.569 4.710 692 HA VAL 78 HA VAL 78 1.314 5.676 4.423 693 HB VAL 78 HB VAL 78 -0.610 7.451 2.859 694 HG11 VAL 78 1HG1 VAL 78 0.180 5.575 1.454 695 HG12 VAL 78 2HG1 VAL 78 -1.503 5.324 1.916 696 HG13 VAL 78 3HG1 VAL 78 -0.222 4.426 2.735 697 HG21 VAL 78 3HG2 VAL 78 -2.369 6.236 4.094 698 HG22 VAL 78 1HG2 VAL 78 -1.303 7.119 5.189 699 HG23 VAL 78 2HG2 VAL 78 -1.132 5.370 5.009 700 H PHE 79 H PHE 79 2.802 4.980 3.097 701 HA PHE 79 HA PHE 79 3.639 6.625 0.773 702 HB2 PHE 79 2HB PHE 79 5.224 4.437 2.206 703 HB3 PHE 79 3HB PHE 79 5.783 5.411 0.853 704 HD1 PHE 79 HD1 PHE 79 4.754 8.131 1.830 705 HD2 PHE 79 HD2 PHE 79 6.901 5.013 3.829 706 HE1 PHE 79 HE1 PHE 79 5.724 9.778 3.365 707 HE2 PHE 79 HE2 PHE 79 7.856 6.672 5.366 708 HZ PHE 79 HZ PHE 79 7.265 9.052 5.133 709 H LEU 80 H LEU 80 2.798 5.818 -1.051 710 HA LEU 80 HA LEU 80 1.543 3.149 -1.008 711 HB2 LEU 80 2HB LEU 80 -0.069 4.926 -1.139 712 HB3 LEU 80 3HB LEU 80 0.818 5.728 -2.425 713 HG LEU 80 HG LEU 80 0.221 3.900 -4.006 714 HD11 LEU 80 1HD1 LEU 80 -1.382 2.163 -3.428 715 HD12 LEU 80 2HD1 LEU 80 -1.403 2.705 -1.748 716 HD13 LEU 80 3HD1 LEU 80 0.072 2.027 -2.443 717 HD21 LEU 80 3HD2 LEU 80 -1.233 5.839 -3.865 718 HD22 LEU 80 1HD2 LEU 80 -2.180 5.069 -2.588 719 HD23 LEU 80 2HD2 LEU 80 -2.162 4.385 -4.217 720 H LEU 81 H LEU 81 2.228 1.647 -2.405 721 HA LEU 81 HA LEU 81 3.569 2.418 -4.909 722 HB2 LEU 81 2HB LEU 81 4.763 0.767 -3.435 723 HB3 LEU 81 3HB LEU 81 3.417 -0.337 -3.622 724 HG LEU 81 HG LEU 81 3.848 -0.474 -6.075 725 HD11 LEU 81 1HD1 LEU 81 6.190 1.369 -5.516 726 HD12 LEU 81 2HD1 LEU 81 4.761 1.731 -6.489 727 HD13 LEU 81 3HD1 LEU 81 5.906 0.512 -7.035 728 HD21 LEU 81 3HD2 LEU 81 5.928 -1.753 -6.001 729 HD22 LEU 81 1HD2 LEU 81 4.914 -2.111 -4.603 730 HD23 LEU 81 2HD2 LEU 81 6.321 -1.056 -4.426 731 H LEU 82 H LEU 82 2.283 2.409 -6.628 732 HA LEU 82 HA LEU 82 -0.044 0.617 -6.802 733 HB2 LEU 82 2HB LEU 82 0.716 3.114 -8.362 734 HB3 LEU 82 3HB LEU 82 -0.662 2.092 -8.736 735 HG LEU 82 HG LEU 82 -0.306 3.681 -6.169 736 HD11 LEU 82 1HD1 LEU 82 -0.782 5.122 -8.095 737 HD12 LEU 82 2HD1 LEU 82 -2.141 5.067 -6.977 738 HD13 LEU 82 3HD1 LEU 82 -2.207 4.149 -8.484 739 HD21 LEU 82 3HD2 LEU 82 -1.530 1.610 -5.752 740 HD22 LEU 82 1HD2 LEU 82 -2.626 1.956 -7.094 741 HD23 LEU 82 2HD2 LEU 82 -2.617 2.991 -5.664 742 H GLN 83 H GLN 83 0.468 -1.246 -7.760 743 HA GLN 83 HA GLN 83 2.258 -1.267 -10.112 744 HB2 GLN 83 2HB GLN 83 3.105 -2.659 -8.256 745 HB3 GLN 83 3HB GLN 83 1.584 -3.558 -8.214 746 HG2 GLN 83 2HG GLN 83 2.014 -4.423 -10.489 747 HG3 GLN 83 3HG GLN 83 3.493 -3.465 -10.587 748 HE21 GLN 83 1HE2 GLN 83 4.694 -5.358 -10.983 749 HE22 GLN 83 2HE2 GLN 83 5.079 -6.457 -9.708 750 H ASP 84 H ASP 84 1.087 -1.220 -11.884 751 HA ASP 84 HA ASP 84 -0.857 -3.297 -12.422 752 HB2 ASP 84 2HB ASP 84 -2.163 -1.300 -11.391 753 HB3 ASP 84 3HB ASP 84 -1.754 -0.396 -12.844 754 H GLN 85 H GLN 85 -1.044 -3.678 -14.644 755 HA GLN 85 HA GLN 85 1.283 -2.995 -16.165 756 HB2 GLN 85 2HB GLN 85 0.317 -5.249 -16.162 757 HB3 GLN 85 3HB GLN 85 -1.185 -4.639 -16.845 758 HG2 GLN 85 2HG GLN 85 -0.041 -4.085 -18.934 759 HG3 GLN 85 3HG GLN 85 1.503 -4.581 -18.249 760 HE21 GLN 85 1HE2 GLN 85 1.817 -6.121 -19.886 761 HE22 GLN 85 2HE2 GLN 85 0.920 -7.595 -19.956 762 H ASP 86 H ASP 86 -2.079 -1.952 -16.184 763 HA ASP 86 HA ASP 86 -1.946 -0.616 -18.760 764 HB2 ASP 86 2HB ASP 86 -4.099 -0.448 -16.608 765 HB3 ASP 86 3HB ASP 86 -4.251 0.108 -18.273 766 H GLU 87 H GLU 87 -0.510 1.091 -18.722 767 HA GLU 87 HA GLU 87 0.087 2.618 -16.396 768 HB2 GLU 87 2HB GLU 87 0.764 3.411 -19.258 769 HB3 GLU 87 3HB GLU 87 1.570 3.943 -17.787 770 HG2 GLU 87 2HG GLU 87 3.102 2.384 -18.436 771 HG3 GLU 87 3HG GLU 87 2.039 1.299 -17.548 772 H ASN 88 H ASN 88 -1.934 3.181 -19.246 773 HA ASN 88 HA ASN 88 -2.541 5.922 -18.847 774 HB2 ASN 88 2HB ASN 88 -4.101 3.749 -20.301 775 HB3 ASN 88 3HB ASN 88 -4.504 5.461 -20.381 776 HD21 ASN 88 1HD2 ASN 88 -3.751 3.648 -22.539 777 HD22 ASN 88 2HD2 ASN 88 -2.357 4.344 -23.288 778 H GLU 89 H GLU 89 -4.293 2.959 -17.941 779 HA GLU 89 HA GLU 89 -6.494 4.254 -16.670 780 HB2 GLU 89 2HB GLU 89 -5.472 1.421 -16.187 781 HB3 GLU 89 3HB GLU 89 -7.096 2.033 -15.861 782 HG2 GLU 89 2HG GLU 89 -5.812 1.668 -18.589 783 HG3 GLU 89 3HG GLU 89 -7.040 0.630 -17.876 784 H LEU 90 H LEU 90 -3.349 3.102 -15.606 785 HA LEU 90 HA LEU 90 -3.741 3.319 -12.793 786 HB2 LEU 90 2HB LEU 90 -2.038 1.835 -13.784 787 HB3 LEU 90 3HB LEU 90 -1.177 3.220 -14.431 788 HG LEU 90 HG LEU 90 -0.525 3.950 -12.195 789 HD11 LEU 90 1HD1 LEU 90 -1.160 2.789 -10.186 790 HD12 LEU 90 2HD1 LEU 90 -2.145 1.643 -11.091 791 HD13 LEU 90 3HD1 LEU 90 -2.592 3.355 -11.023 792 HD21 LEU 90 3HD2 LEU 90 0.903 2.253 -13.256 793 HD22 LEU 90 1HD2 LEU 90 -0.038 0.965 -12.495 794 HD23 LEU 90 2HD2 LEU 90 0.906 2.082 -11.502 795 H GLU 91 H GLU 91 -2.634 5.492 -15.305 796 HA GLU 91 HA GLU 91 -1.498 7.562 -13.834 797 HB2 GLU 91 2HB GLU 91 -1.457 7.384 -16.316 798 HB3 GLU 91 3HB GLU 91 -3.181 7.724 -16.371 799 HG2 GLU 91 2HG GLU 91 -1.941 9.717 -16.949 800 HG3 GLU 91 3HG GLU 91 -2.786 9.953 -15.417 801 H GLU 92 H GLU 92 -4.881 7.122 -14.886 802 HA GLU 92 HA GLU 92 -6.097 9.364 -13.760 803 HB2 GLU 92 2HB GLU 92 -7.265 6.574 -14.138 804 HB3 GLU 92 3HB GLU 92 -8.211 8.036 -13.847 805 HG2 GLU 92 2HG GLU 92 -7.483 8.967 -15.989 806 HG3 GLU 92 3HG GLU 92 -6.452 7.552 -16.273 807 H PHE 93 H PHE 93 -5.931 6.059 -12.453 808 HA PHE 93 HA PHE 93 -7.198 6.369 -10.002 809 HB2 PHE 93 2HB PHE 93 -6.526 4.210 -11.146 810 HB3 PHE 93 3HB PHE 93 -4.860 4.508 -10.665 811 HD1 PHE 93 HD1 PHE 93 -8.190 4.601 -8.898 812 HD2 PHE 93 HD2 PHE 93 -4.200 3.037 -8.947 813 HE1 PHE 93 HE1 PHE 93 -8.644 3.344 -6.844 814 HE2 PHE 93 HE2 PHE 93 -4.678 1.794 -6.884 815 HZ PHE 93 HZ PHE 93 -6.898 1.948 -5.834 816 H LYS 94 H LYS 94 -3.759 6.743 -10.791 817 HA LYS 94 HA LYS 94 -2.780 7.251 -8.195 818 HB2 LYS 94 2HB LYS 94 -1.474 6.469 -10.211 819 HB3 LYS 94 3HB LYS 94 -1.586 8.091 -10.873 820 HG2 LYS 94 2HG LYS 94 -0.323 7.603 -8.175 821 HG3 LYS 94 3HG LYS 94 0.590 7.313 -9.647 822 HD2 LYS 94 2HD LYS 94 -0.588 9.976 -8.743 823 HD3 LYS 94 3HD LYS 94 1.121 9.521 -8.747 824 HE2 LYS 94 2HE LYS 94 1.019 9.315 -11.233 825 HE3 LYS 94 3HE LYS 94 -0.658 9.869 -11.190 826 HZ1 LYS 94 3HZ LYS 94 0.133 11.927 -10.166 827 HZ2 LYS 94 1HZ LYS 94 0.812 11.675 -11.693 828 HZ3 LYS 94 2HZ LYS 94 1.727 11.392 -10.301 829 H ARG 95 H ARG 95 -3.953 9.403 -10.789 830 HA ARG 95 HA ARG 95 -3.078 11.855 -9.711 831 HB2 ARG 95 2HB ARG 95 -5.367 11.251 -11.614 832 HB3 ARG 95 3HB ARG 95 -4.896 12.888 -11.165 833 HG2 ARG 95 2HG ARG 95 -2.571 12.311 -12.075 834 HG3 ARG 95 3HG ARG 95 -3.311 10.875 -12.779 835 HD2 ARG 95 2HD ARG 95 -3.209 12.699 -14.419 836 HD3 ARG 95 3HD ARG 95 -4.885 12.294 -14.036 837 HE ARG 95 HE ARG 95 -4.793 14.255 -12.451 838 HH11 ARG 95 1HH1 ARG 95 -2.809 14.254 -15.370 839 HH12 ARG 95 2HH1 ARG 95 -2.748 15.981 -15.454 840 HH21 ARG 95 1HH2 ARG 95 -4.631 16.496 -12.545 841 HH22 ARG 95 2HH2 ARG 95 -3.779 17.256 -13.852 842 H LYS 96 H LYS 96 -6.096 10.039 -9.206 843 HA LYS 96 HA LYS 96 -7.513 11.903 -7.642 844 HB2 LYS 96 2HB LYS 96 -7.561 8.877 -7.819 845 HB3 LYS 96 3HB LYS 96 -8.458 9.655 -6.536 846 HG2 LYS 96 2HG LYS 96 -10.031 9.278 -8.238 847 HG3 LYS 96 3HG LYS 96 -9.670 11.004 -8.310 848 HD2 LYS 96 2HD LYS 96 -8.173 10.609 -10.245 849 HD3 LYS 96 3HD LYS 96 -8.504 8.878 -10.156 850 HE2 LYS 96 2HE LYS 96 -10.927 9.383 -10.595 851 HE3 LYS 96 3HE LYS 96 -10.489 11.080 -10.819 852 HZ1 LYS 96 3HZ LYS 96 -9.564 8.777 -12.450 853 HZ2 LYS 96 1HZ LYS 96 -9.019 10.365 -12.635 854 HZ3 LYS 96 2HZ LYS 96 -10.635 9.996 -12.928 855 H ILE 97 H ILE 97 -5.285 9.333 -6.697 856 HA ILE 97 HA ILE 97 -5.325 9.769 -3.880 857 HB ILE 97 HB ILE 97 -3.239 8.349 -5.598 858 HG12 ILE 97 2HG1 ILE 97 -5.590 7.037 -4.150 859 HG13 ILE 97 3HG1 ILE 97 -5.709 7.577 -5.820 860 HG21 ILE 97 1HG2 ILE 97 -2.382 8.790 -3.353 861 HG22 ILE 97 2HG2 ILE 97 -2.723 7.073 -3.523 862 HG23 ILE 97 3HG2 ILE 97 -3.835 8.102 -2.626 863 HD11 ILE 97 3HD1 ILE 97 -3.868 6.049 -6.420 864 HD12 ILE 97 1HD1 ILE 97 -5.278 5.227 -5.748 865 HD13 ILE 97 2HD1 ILE 97 -3.846 5.467 -4.753 866 H GLU 98 H GLU 98 -3.520 11.162 -6.483 867 HA GLU 98 HA GLU 98 -1.185 12.068 -5.174 868 HB2 GLU 98 2HB GLU 98 -1.587 11.846 -7.682 869 HB3 GLU 98 3HB GLU 98 -2.566 13.300 -7.599 870 HG2 GLU 98 2HG GLU 98 -0.499 14.055 -8.374 871 HG3 GLU 98 3HG GLU 98 -0.485 14.474 -6.666 872 H SER 99 H SER 99 -4.445 13.377 -5.398 873 HA SER 99 HA SER 99 -3.897 16.008 -4.429 874 HB2 SER 99 2HB SER 99 -5.898 15.463 -5.796 875 HB3 SER 99 3HB SER 99 -6.515 14.447 -4.503 876 HG SER 99 HG SER 99 -5.880 16.987 -3.677 877 H GLN 100 H GLN 100 -4.351 12.919 -2.869 878 HA GLN 100 HA GLN 100 -5.267 13.929 -0.326 879 HB2 GLN 100 2HB GLN 100 -4.233 11.171 -1.107 880 HB3 GLN 100 3HB GLN 100 -4.946 11.570 0.456 881 HG2 GLN 100 2HG GLN 100 -7.077 12.173 -0.736 882 HG3 GLN 100 3HG GLN 100 -6.346 11.607 -2.240 883 HE21 GLN 100 1HE2 GLN 100 -7.577 10.624 0.904 884 HE22 GLN 100 2HE2 GLN 100 -7.717 8.942 0.537 885 H GLY 101 H GLY 101 -2.154 13.616 -1.781 886 HA2 GLY 101 2HA GLY 101 -0.152 14.475 -1.022 887 HA3 GLY 101 3HA GLY 101 -0.891 14.798 0.538 888 H TYR 102 H TYR 102 -0.113 11.944 -1.431 889 HA TYR 102 HA TYR 102 1.299 10.691 0.876 890 HB2 TYR 102 2HB TYR 102 -0.322 9.241 -1.269 891 HB3 TYR 102 3HB TYR 102 0.584 8.465 0.022 892 HD1 TYR 102 HD1 TYR 102 -0.226 10.139 2.395 893 HD2 TYR 102 HD2 TYR 102 -2.572 8.604 -0.836 894 HE1 TYR 102 HE1 TYR 102 -2.220 10.140 3.833 895 HE2 TYR 102 HE2 TYR 102 -4.561 8.611 0.601 896 HH TYR 102 HH TYR 102 -5.152 8.586 2.964 897 H GLU 103 H GLU 103 3.134 9.271 0.243 898 HA GLU 103 HA GLU 103 4.512 10.231 -2.155 899 HB2 GLU 103 2HB GLU 103 5.547 9.615 0.242 900 HB3 GLU 103 3HB GLU 103 5.627 7.994 -0.430 901 HG2 GLU 103 2HG GLU 103 6.953 10.476 -1.593 902 HG3 GLU 103 3HG GLU 103 7.757 9.237 -0.632 903 H VAL 104 H VAL 104 3.450 9.432 -3.907 904 HA VAL 104 HA VAL 104 2.580 6.600 -3.961 905 HB VAL 104 HB VAL 104 1.587 8.913 -5.701 906 HG11 VAL 104 1HG1 VAL 104 0.421 6.136 -5.250 907 HG12 VAL 104 2HG1 VAL 104 1.259 6.678 -6.706 908 HG13 VAL 104 3HG1 VAL 104 -0.287 7.406 -6.262 909 HG21 VAL 104 3HG2 VAL 104 0.274 7.746 -3.216 910 HG22 VAL 104 1HG2 VAL 104 -0.441 8.956 -4.287 911 HG23 VAL 104 2HG2 VAL 104 0.998 9.351 -3.345 912 H ARG 105 H ARG 105 4.020 5.375 -5.065 913 HA ARG 105 HA ARG 105 5.309 6.446 -7.504 914 HB2 ARG 105 2HB ARG 105 6.112 4.094 -5.742 915 HB3 ARG 105 3HB ARG 105 6.934 4.550 -7.232 916 HG2 ARG 105 2HG ARG 105 6.733 6.321 -4.759 917 HG3 ARG 105 3HG ARG 105 8.104 5.277 -5.139 918 HD2 ARG 105 2HD ARG 105 8.702 7.494 -5.816 919 HD3 ARG 105 3HD ARG 105 8.387 6.577 -7.290 920 HE ARG 105 HE ARG 105 6.251 8.252 -6.162 921 HH11 ARG 105 1HH1 ARG 105 8.601 7.758 -8.730 922 HH12 ARG 105 2HH1 ARG 105 7.877 8.921 -9.775 923 HH21 ARG 105 1HH2 ARG 105 5.255 9.702 -7.596 924 HH22 ARG 105 2HH2 ARG 105 5.976 10.029 -9.135 925 H LYS 106 H LYS 106 4.905 5.504 -9.414 926 HA LYS 106 HA LYS 106 2.968 3.284 -9.606 927 HB2 LYS 106 2HB LYS 106 4.061 5.186 -11.733 928 HB3 LYS 106 3HB LYS 106 2.870 3.923 -12.030 929 HG2 LYS 106 2HG LYS 106 1.225 5.048 -10.694 930 HG3 LYS 106 3HG LYS 106 2.405 6.215 -10.100 931 HD2 LYS 106 2HD LYS 106 1.005 7.283 -11.768 932 HD3 LYS 106 3HD LYS 106 2.635 7.130 -12.408 933 HE2 LYS 106 2HE LYS 106 0.457 5.140 -13.084 934 HE3 LYS 106 3HE LYS 106 0.678 6.626 -13.999 935 HZ1 LYS 106 3HZ LYS 106 2.620 4.402 -13.705 936 HZ2 LYS 106 1HZ LYS 106 2.987 5.884 -14.426 937 HZ3 LYS 106 2HZ LYS 106 1.814 4.888 -15.110 938 H VAL 107 H VAL 107 3.471 1.403 -10.786 939 HA VAL 107 HA VAL 107 5.991 1.035 -12.138 940 HB VAL 107 HB VAL 107 6.643 0.658 -9.743 941 HG11 VAL 107 1HG1 VAL 107 4.527 -0.227 -8.871 942 HG12 VAL 107 2HG1 VAL 107 5.866 -1.315 -8.503 943 HG13 VAL 107 3HG1 VAL 107 4.743 -1.710 -9.807 944 HG21 VAL 107 3HG2 VAL 107 7.918 -0.464 -11.517 945 HG22 VAL 107 1HG2 VAL 107 6.820 -1.846 -11.464 946 HG23 VAL 107 2HG2 VAL 107 7.848 -1.478 -10.074 947 H THR 108 H THR 108 6.028 -0.907 -13.377 948 HA THR 108 HA THR 108 3.437 -2.323 -13.682 949 HB THR 108 HB THR 108 4.253 -2.703 -16.103 950 HG1 THR 108 HG1 THR 108 5.935 -1.472 -16.828 951 HG21 THR 108 3HG2 THR 108 3.698 0.171 -15.270 952 HG22 THR 108 1HG2 THR 108 2.477 -1.052 -15.635 953 HG23 THR 108 2HG2 THR 108 3.550 -0.467 -16.907 954 H ASP 109 H ASP 109 6.932 -2.631 -13.323 955 HA ASP 109 HA ASP 109 6.952 -5.466 -14.036 956 HB2 ASP 109 2HB ASP 109 9.100 -3.398 -13.551 957 HB3 ASP 109 3HB ASP 109 9.525 -5.097 -13.415 958 H ASP 110 H ASP 110 7.857 -7.080 -12.760 959 HA ASP 110 HA ASP 110 6.717 -7.247 -10.164 960 HB2 ASP 110 2HB ASP 110 8.590 -9.161 -11.647 961 HB3 ASP 110 3HB ASP 110 7.687 -9.554 -10.181 962 H GLU 111 H GLU 111 10.083 -7.448 -11.332 963 HA GLU 111 HA GLU 111 11.302 -7.758 -8.779 964 HB2 GLU 111 2HB GLU 111 12.558 -6.816 -11.403 965 HB3 GLU 111 3HB GLU 111 13.446 -7.357 -9.974 966 HG2 GLU 111 2HG GLU 111 12.490 -9.625 -10.241 967 HG3 GLU 111 3HG GLU 111 11.588 -9.083 -11.660 968 H GLU 112 H GLU 112 10.785 -5.028 -10.977 969 HA GLU 112 HA GLU 112 12.172 -3.046 -9.556 970 HB2 GLU 112 2HB GLU 112 9.771 -2.720 -11.388 971 HB3 GLU 112 3HB GLU 112 10.845 -1.428 -10.882 972 HG2 GLU 112 2HG GLU 112 11.381 -3.710 -12.769 973 HG3 GLU 112 3HG GLU 112 11.536 -1.985 -13.074 974 H ALA 113 H ALA 113 8.749 -4.046 -9.436 975 HA ALA 113 HA ALA 113 7.669 -2.227 -7.667 976 HB1 ALA 113 3HB ALA 113 7.080 -5.210 -7.769 977 HB2 ALA 113 1HB ALA 113 6.348 -3.969 -8.794 978 HB3 ALA 113 2HB ALA 113 6.038 -3.974 -7.057 979 H LEU 114 H LEU 114 9.308 -5.296 -6.839 980 HA LEU 114 HA LEU 114 9.158 -5.124 -4.027 981 HB2 LEU 114 2HB LEU 114 11.356 -6.473 -5.650 982 HB3 LEU 114 3HB LEU 114 10.928 -6.819 -3.978 983 HG LEU 114 HG LEU 114 9.126 -7.367 -6.377 984 HD11 LEU 114 1HD1 LEU 114 11.109 -8.804 -6.416 985 HD12 LEU 114 2HD1 LEU 114 9.655 -9.725 -6.050 986 HD13 LEU 114 3HD1 LEU 114 10.788 -9.321 -4.756 987 HD21 LEU 114 3HD2 LEU 114 8.808 -8.168 -3.459 988 HD22 LEU 114 1HD2 LEU 114 7.766 -8.680 -4.794 989 HD23 LEU 114 2HD2 LEU 114 7.833 -6.983 -4.334 990 H LYS 115 H LYS 115 11.498 -3.846 -6.343 991 HA LYS 115 HA LYS 115 13.477 -2.959 -4.487 992 HB2 LYS 115 2HB LYS 115 12.919 -2.063 -7.340 993 HB3 LYS 115 3HB LYS 115 14.355 -1.623 -6.415 994 HG2 LYS 115 2HG LYS 115 15.094 -3.940 -6.372 995 HG3 LYS 115 3HG LYS 115 13.595 -4.466 -7.154 996 HD2 LYS 115 2HD LYS 115 14.207 -3.041 -9.148 997 HD3 LYS 115 3HD LYS 115 15.752 -2.684 -8.365 998 HE2 LYS 115 2HE LYS 115 16.318 -5.086 -8.413 999 HE3 LYS 115 3HE LYS 115 14.773 -5.437 -9.195 1000 HZ1 LYS 115 3HZ LYS 115 16.586 -5.302 -10.785 1001 HZ2 LYS 115 1HZ LYS 115 16.916 -3.711 -10.317 1002 HZ3 LYS 115 2HZ LYS 115 15.447 -4.089 -11.062 1003 H ILE 116 H ILE 116 10.511 -1.465 -5.776 1004 HA ILE 116 HA ILE 116 11.187 1.184 -4.818 1005 HB ILE 116 HB ILE 116 8.365 0.238 -5.486 1006 HG12 ILE 116 2HG1 ILE 116 9.755 -0.266 -7.466 1007 HG13 ILE 116 3HG1 ILE 116 8.668 1.065 -7.804 1008 HG21 ILE 116 1HG2 ILE 116 7.973 2.638 -5.995 1009 HG22 ILE 116 2HG2 ILE 116 9.635 3.000 -5.522 1010 HG23 ILE 116 3HG2 ILE 116 8.492 2.390 -4.326 1011 HD11 ILE 116 3HD1 ILE 116 10.868 1.370 -8.791 1012 HD12 ILE 116 1HD1 ILE 116 11.612 1.320 -7.195 1013 HD13 ILE 116 2HD1 ILE 116 10.515 2.640 -7.614 1014 H VAL 117 H VAL 117 9.442 -1.654 -3.602 1015 HA VAL 117 HA VAL 117 8.141 -0.493 -1.379 1016 HB VAL 117 HB VAL 117 9.151 -3.378 -1.462 1017 HG11 VAL 117 1HG1 VAL 117 6.870 -2.087 0.095 1018 HG12 VAL 117 2HG1 VAL 117 8.402 -2.654 0.767 1019 HG13 VAL 117 3HG1 VAL 117 7.254 -3.811 0.091 1020 HG21 VAL 117 3HG2 VAL 117 6.929 -4.018 -2.356 1021 HG22 VAL 117 1HG2 VAL 117 7.804 -2.976 -3.476 1022 HG23 VAL 117 2HG2 VAL 117 6.494 -2.313 -2.503 1023 H ARG 118 H ARG 118 11.371 -1.969 -1.717 1024 HA ARG 118 HA ARG 118 12.088 -1.826 1.019 1025 HB2 ARG 118 2HB ARG 118 14.305 -2.441 0.377 1026 HB3 ARG 118 3HB ARG 118 13.220 -3.280 -0.732 1027 HG2 ARG 118 2HG ARG 118 13.665 -1.587 -2.458 1028 HG3 ARG 118 3HG ARG 118 14.728 -0.720 -1.354 1029 HD2 ARG 118 2HD ARG 118 16.176 -2.799 -1.282 1030 HD3 ARG 118 3HD ARG 118 15.175 -3.456 -2.587 1031 HE ARG 118 HE ARG 118 15.992 -0.925 -3.394 1032 HH11 ARG 118 1HH1 ARG 118 17.591 -3.970 -2.652 1033 HH12 ARG 118 2HH1 ARG 118 18.918 -3.664 -3.718 1034 HH21 ARG 118 1HH2 ARG 118 17.772 -0.523 -4.736 1035 HH22 ARG 118 2HH2 ARG 118 19.024 -1.712 -4.900 1036 H GLU 119 H GLU 119 12.117 0.564 -1.539 1037 HA GLU 119 HA GLU 119 13.765 2.501 -0.218 1038 HB2 GLU 119 2HB GLU 119 11.615 3.015 -2.319 1039 HB3 GLU 119 3HB GLU 119 12.933 4.099 -1.869 1040 HG2 GLU 119 2HG GLU 119 13.138 1.457 -3.336 1041 HG3 GLU 119 3HG GLU 119 13.433 3.061 -3.993 1042 H PHE 120 H PHE 120 10.225 1.935 -0.427 1043 HA PHE 120 HA PHE 120 9.330 4.058 1.187 1044 HB2 PHE 120 2HB PHE 120 8.148 1.282 0.795 1045 HB3 PHE 120 3HB PHE 120 7.312 2.580 1.643 1046 HD1 PHE 120 HD2 PHE 120 7.669 4.939 0.059 1047 HD2 PHE 120 HD1 PHE 120 7.103 0.916 -1.273 1048 HE1 PHE 120 HE2 PHE 120 6.700 5.757 -2.036 1049 HE2 PHE 120 HE1 PHE 120 6.161 1.759 -3.361 1050 HZ PHE 120 HZ PHE 120 5.940 4.165 -3.742 1051 H MET 121 H MET 121 10.284 0.751 2.085 1052 HA MET 121 HA MET 121 9.904 1.023 4.882 1053 HB2 MET 121 2HB MET 121 11.613 -0.939 3.297 1054 HB3 MET 121 3HB MET 121 11.264 -1.085 5.018 1055 HG2 MET 121 2HG MET 121 8.829 -1.218 4.460 1056 HG3 MET 121 3HG MET 121 9.260 -1.232 2.748 1057 HE1 MET 121 3HE MET 121 11.835 -3.096 2.583 1058 HE2 MET 121 1HE MET 121 10.428 -3.261 1.526 1059 HE3 MET 121 2HE MET 121 11.072 -4.671 2.369 1060 H GLN 122 H GLN 122 12.563 1.835 2.760 1061 HA GLN 122 HA GLN 122 14.524 2.334 4.772 1062 HB2 GLN 122 2HB GLN 122 15.046 1.959 2.373 1063 HB3 GLN 122 3HB GLN 122 14.257 3.476 1.961 1064 HG2 GLN 122 2HG GLN 122 15.968 4.742 3.139 1065 HG3 GLN 122 3HG GLN 122 16.702 3.251 3.730 1066 HE21 GLN 122 1HE2 GLN 122 16.145 5.217 0.876 1067 HE22 GLN 122 2HE2 GLN 122 17.404 4.518 -0.077 1068 H LYS 123 H LYS 123 12.055 4.356 3.184 1069 HA LYS 123 HA LYS 123 12.722 6.881 4.339 1070 HB2 LYS 123 2HB LYS 123 10.024 5.875 3.317 1071 HB3 LYS 123 3HB LYS 123 10.407 7.563 3.664 1072 HG2 LYS 123 2HG LYS 123 11.926 7.698 1.819 1073 HG3 LYS 123 3HG LYS 123 11.916 5.943 1.593 1074 HD2 LYS 123 2HD LYS 123 9.461 6.100 0.999 1075 HD3 LYS 123 3HD LYS 123 9.606 7.861 1.082 1076 HE2 LYS 123 2HE LYS 123 11.193 6.075 -0.795 1077 HE3 LYS 123 3HE LYS 123 9.743 6.973 -1.237 1078 HZ1 LYS 123 3HZ LYS 123 12.268 8.197 -0.275 1079 HZ2 LYS 123 1HZ LYS 123 10.882 9.029 -0.765 1080 HZ3 LYS 123 2HZ LYS 123 11.764 8.125 -1.885 1081 H ALA 124 H ALA 124 10.293 4.437 5.131 1082 HA ALA 124 HA ALA 124 9.133 5.737 7.370 1083 HB1 ALA 124 3HB ALA 124 7.926 3.600 7.658 1084 HB2 ALA 124 1HB ALA 124 8.991 2.841 6.472 1085 HB3 ALA 124 2HB ALA 124 7.897 4.134 5.976 1086 H GLY 125 H GLY 125 11.636 3.287 6.938 1087 HA2 GLY 125 2HA GLY 125 12.155 2.562 9.585 1088 HA3 GLY 125 3HA GLY 125 13.319 2.547 8.273 1089 H SER 126 H SER 126 13.324 5.328 7.698 1090 HA SER 126 HA SER 126 15.113 6.307 9.707 1091 HB2 SER 126 2HB SER 126 13.934 7.660 7.249 1092 HB3 SER 126 3HB SER 126 15.231 8.330 8.242 1093 HG SER 126 HG SER 126 15.260 5.998 6.644 1094 H LEU 127 H LEU 127 11.707 6.844 8.948 1095 HA LEU 127 HA LEU 127 11.416 9.224 10.579 1096 HB2 LEU 127 2HB LEU 127 9.362 7.441 9.229 1097 HB3 LEU 127 3HB LEU 127 8.957 8.916 10.097 1098 HG LEU 127 HG LEU 127 10.669 8.772 7.579 1099 HD11 LEU 127 1HD1 LEU 127 7.817 9.738 7.925 1100 HD12 LEU 127 2HD1 LEU 127 8.326 8.252 7.119 1101 HD13 LEU 127 3HD1 LEU 127 8.776 9.814 6.441 1102 HD21 LEU 127 3HD2 LEU 127 10.527 11.228 7.564 1103 HD22 LEU 127 1HD2 LEU 127 11.338 10.652 9.017 1104 HD23 LEU 127 2HD2 LEU 127 9.663 11.207 9.106 1105 H GLU 128 H GLU 128 11.393 5.843 11.215 1106 HA GLU 128 HA GLU 128 9.586 5.693 13.386 1107 HB2 GLU 128 2HB GLU 128 10.418 3.726 12.160 1108 HB3 GLU 128 3HB GLU 128 12.042 3.998 12.773 1109 HG2 GLU 128 2HG GLU 128 9.895 3.662 14.833 1110 HG3 GLU 128 3HG GLU 128 10.262 2.242 13.872 1111 H HIS 129 H HIS 129 13.209 5.791 13.555 1112 HA HIS 129 HA HIS 129 13.068 7.032 16.213 1113 HB2 HIS 129 2HB HIS 129 15.392 5.979 14.565 1114 HB3 HIS 129 3HB HIS 129 15.664 6.977 15.985 1115 HD1 HIS 129 HD1 HIS 129 15.813 3.614 15.147 1116 HD2 HIS 129 HD2 HIS 129 13.986 5.655 18.268 1117 HE1 HIS 129 HE1 HIS 129 15.525 1.929 16.980 1118 HE2 HIS 129 HE2 HIS 129 14.229 3.139 18.756 1119 H HIS 130 H HIS 130 11.824 8.651 14.616 1120 HA HIS 130 HA HIS 130 13.321 10.776 13.491 1121 HB2 HIS 130 2HB HIS 130 11.186 12.102 13.694 1122 HB3 HIS 130 3HB HIS 130 10.979 10.554 12.896 1123 HD1 HIS 130 HD1 HIS 130 8.602 12.127 14.176 1124 HD2 HIS 130 HD2 HIS 130 10.633 9.012 16.040 1125 HE1 HIS 130 HE1 HIS 130 7.022 11.195 15.884 1126 HE2 HIS 130 HE2 HIS 130 8.332 9.432 17.093 1127 H HIS 131 H HIS 131 14.996 11.228 14.884 1128 HA HIS 131 HA HIS 131 14.949 11.903 17.593 1129 HB2 HIS 131 2HB HIS 131 17.019 11.455 16.309 1130 HB3 HIS 131 3HB HIS 131 16.784 12.930 15.378 1131 HD1 HIS 131 HD1 HIS 131 17.995 11.671 18.681 1132 HD2 HIS 131 HD2 HIS 131 17.521 15.311 16.735 1133 HE1 HIS 131 HE1 HIS 131 19.306 13.340 20.025 1134 HE2 HIS 131 HE2 HIS 131 19.149 15.484 18.716 1135 H HIS 132 H HIS 132 14.739 13.998 14.736 1136 HA HIS 132 HA HIS 132 13.832 16.326 16.235 1137 HB2 HIS 132 2HB HIS 132 15.276 16.510 14.168 1138 HB3 HIS 132 3HB HIS 132 13.946 15.866 13.217 1139 HD1 HIS 132 HD1 HIS 132 12.165 17.504 12.467 1140 HD2 HIS 132 HD2 HIS 132 14.820 19.151 15.206 1141 HE1 HIS 132 HE1 HIS 132 11.655 19.958 12.509 1142 HE2 HIS 132 HE2 HIS 132 13.225 20.924 14.226 1143 H HIS 133 H HIS 133 11.714 16.788 16.595 1144 HA HIS 133 HA HIS 133 9.714 14.803 16.126 1145 HB2 HIS 133 2HB HIS 133 9.590 17.595 17.343 1146 HB3 HIS 133 3HB HIS 133 8.159 16.579 17.176 1147 HD1 HIS 133 HD1 HIS 133 11.614 16.372 18.784 1148 HD2 HIS 133 HD2 HIS 133 7.754 14.938 19.305 1149 HE1 HIS 133 HE1 HIS 133 11.656 15.109 20.948 1150 HE2 HIS 133 HE2 HIS 133 9.313 14.220 21.222 1151 H HIS 134 H HIS 134 8.671 14.511 14.306 1152 HA HIS 134 HA HIS 134 7.240 16.535 12.922 1153 HB2 HIS 134 2HB HIS 134 8.303 16.337 10.689 1154 HB3 HIS 134 3HB HIS 134 9.438 16.971 11.865 1155 HD1 HIS 134 HD1 HIS 134 10.677 15.962 9.405 1156 HD2 HIS 134 HD2 HIS 134 9.870 13.407 12.574 1157 HE1 HIS 134 HE1 HIS 134 12.213 14.017 9.113 1158 HE2 HIS 134 HE2 HIS 134 11.811 12.560 11.119 Start of MODEL 15 1 H1 MET 1 1H MET 1 1.965 8.421 16.572 2 H2 MET 1 2H MET 1 0.624 8.374 15.552 3 H3 MET 1 3H MET 1 1.262 9.859 16.033 4 HA MET 1 HA MET 1 1.860 9.366 13.782 5 HB2 MET 1 2HB MET 1 4.297 9.108 15.602 6 HB3 MET 1 3HB MET 1 4.260 9.791 13.977 7 HG2 MET 1 2HG MET 1 2.972 10.961 16.457 8 HG3 MET 1 3HG MET 1 4.404 11.571 15.621 9 HE1 MET 1 3HE MET 1 1.522 14.252 14.973 10 HE2 MET 1 1HE MET 1 3.098 13.994 15.722 11 HE3 MET 1 2HE MET 1 1.656 13.239 16.411 12 H LYS 2 H LYS 2 1.134 7.399 12.925 13 HA LYS 2 HA LYS 2 2.967 5.071 13.150 14 HB2 LYS 2 2HB LYS 2 0.020 5.095 12.356 15 HB3 LYS 2 3HB LYS 2 1.060 3.673 12.335 16 HG2 LYS 2 2HG LYS 2 1.337 3.831 14.782 17 HG3 LYS 2 3HG LYS 2 0.313 5.270 14.802 18 HD2 LYS 2 2HD LYS 2 -0.941 3.257 15.491 19 HD3 LYS 2 3HD LYS 2 -1.610 3.959 14.016 20 HE2 LYS 2 2HE LYS 2 -1.488 1.459 13.982 21 HE3 LYS 2 3HE LYS 2 -0.586 2.214 12.666 22 HZ1 LYS 2 3HZ LYS 2 0.547 0.345 13.877 23 HZ2 LYS 2 1HZ LYS 2 0.683 1.378 15.207 24 HZ3 LYS 2 2HZ LYS 2 1.442 1.770 13.749 25 H ILE 3 H ILE 3 3.602 4.053 11.260 26 HA ILE 3 HA ILE 3 3.203 5.529 8.726 27 HB ILE 3 HB ILE 3 5.493 3.670 9.535 28 HG12 ILE 3 2HG1 ILE 3 5.537 6.695 9.101 29 HG13 ILE 3 3HG1 ILE 3 5.507 5.916 10.678 30 HG21 ILE 3 1HG2 ILE 3 5.097 5.255 6.969 31 HG22 ILE 3 2HG2 ILE 3 5.051 3.497 7.128 32 HG23 ILE 3 3HG2 ILE 3 6.560 4.369 7.398 33 HD11 ILE 3 3HD1 ILE 3 7.731 6.652 10.118 34 HD12 ILE 3 1HD1 ILE 3 7.715 5.696 8.636 35 HD13 ILE 3 2HD1 ILE 3 7.677 4.892 10.209 36 H LEU 4 H LEU 4 1.812 4.534 7.392 37 HA LEU 4 HA LEU 4 1.547 1.582 7.417 38 HB2 LEU 4 2HB LEU 4 -0.291 3.615 6.079 39 HB3 LEU 4 3HB LEU 4 -0.578 1.891 6.242 40 HG LEU 4 HG LEU 4 -0.609 3.951 8.484 41 HD11 LEU 4 1HD1 LEU 4 -2.865 2.336 7.256 42 HD12 LEU 4 2HD1 LEU 4 -2.579 4.068 7.059 43 HD13 LEU 4 3HD1 LEU 4 -3.003 3.422 8.642 44 HD21 LEU 4 3HD2 LEU 4 -1.329 2.139 9.983 45 HD22 LEU 4 1HD2 LEU 4 0.293 1.851 9.354 46 HD23 LEU 4 2HD2 LEU 4 -1.080 0.958 8.693 47 H ILE 5 H ILE 5 2.053 0.452 5.546 48 HA ILE 5 HA ILE 5 2.932 2.013 3.166 49 HB ILE 5 HB ILE 5 3.751 -0.863 3.817 50 HG12 ILE 5 2HG1 ILE 5 4.705 0.661 5.563 51 HG13 ILE 5 3HG1 ILE 5 5.952 -0.068 4.563 52 HG21 ILE 5 1HG2 ILE 5 4.857 1.114 1.780 53 HG22 ILE 5 2HG2 ILE 5 3.859 -0.301 1.431 54 HG23 ILE 5 3HG2 ILE 5 5.487 -0.510 2.078 55 HD11 ILE 5 3HD1 ILE 5 6.437 2.248 5.058 56 HD12 ILE 5 1HD1 ILE 5 4.920 2.754 4.319 57 HD13 ILE 5 2HD1 ILE 5 6.188 2.027 3.328 58 H LEU 6 H LEU 6 1.159 2.063 1.859 59 HA LEU 6 HA LEU 6 -0.759 -0.174 1.793 60 HB2 LEU 6 2HB LEU 6 -1.244 2.486 1.950 61 HB3 LEU 6 3HB LEU 6 -1.089 2.404 0.214 62 HG LEU 6 HG LEU 6 -3.430 2.331 0.754 63 HD11 LEU 6 1HD1 LEU 6 -2.627 -0.496 0.008 64 HD12 LEU 6 2HD1 LEU 6 -2.856 0.857 -1.099 65 HD13 LEU 6 3HD1 LEU 6 -4.229 0.224 -0.199 66 HD21 LEU 6 3HD2 LEU 6 -4.430 0.611 2.232 67 HD22 LEU 6 1HD2 LEU 6 -3.336 1.702 3.077 68 HD23 LEU 6 2HD2 LEU 6 -2.814 0.066 2.668 69 H ILE 7 H ILE 7 -0.655 -1.589 0.063 70 HA ILE 7 HA ILE 7 0.726 -0.778 -2.430 71 HB ILE 7 HB ILE 7 1.191 -3.426 -0.958 72 HG12 ILE 7 2HG1 ILE 7 3.142 -1.136 -1.513 73 HG13 ILE 7 3HG1 ILE 7 2.418 -1.492 0.049 74 HG21 ILE 7 1HG2 ILE 7 2.797 -3.956 -2.772 75 HG22 ILE 7 2HG2 ILE 7 2.329 -2.482 -3.619 76 HG23 ILE 7 3HG2 ILE 7 1.154 -3.780 -3.393 77 HD11 ILE 7 3HD1 ILE 7 4.336 -3.264 -1.455 78 HD12 ILE 7 1HD1 ILE 7 3.590 -3.628 0.106 79 HD13 ILE 7 2HD1 ILE 7 4.691 -2.261 -0.048 80 H ASN 8 H ASN 8 -0.521 -1.169 -4.155 81 HA ASN 8 HA ASN 8 -2.518 -3.354 -4.129 82 HB2 ASN 8 2HB ASN 8 -3.636 -1.192 -4.398 83 HB3 ASN 8 3HB ASN 8 -2.522 -0.722 -5.675 84 HD21 ASN 8 1HD2 ASN 8 -5.214 -2.821 -4.855 85 HD22 ASN 8 2HD2 ASN 8 -5.689 -3.167 -6.481 86 H THR 9 H THR 9 -1.711 -5.030 -5.239 87 HA THR 9 HA THR 9 -0.394 -4.512 -7.841 88 HB THR 9 HB THR 9 1.368 -5.356 -6.455 89 HG1 THR 9 HG1 THR 9 1.414 -6.308 -8.460 90 HG21 THR 9 3HG2 THR 9 1.256 -7.484 -5.208 91 HG22 THR 9 1HG2 THR 9 -0.453 -7.646 -5.635 92 HG23 THR 9 2HG2 THR 9 0.077 -6.323 -4.597 93 H ASN 10 H ASN 10 -1.019 -5.794 -9.537 94 HA ASN 10 HA ASN 10 -3.643 -6.948 -9.479 95 HB2 ASN 10 2HB ASN 10 -2.782 -5.687 -11.438 96 HB3 ASN 10 3HB ASN 10 -1.517 -6.889 -11.677 97 HD21 ASN 10 1HD2 ASN 10 -2.087 -8.921 -12.575 98 HD22 ASN 10 2HD2 ASN 10 -3.606 -9.181 -13.362 99 H ASN 11 H ASN 11 -0.451 -8.122 -9.053 100 HA ASN 11 HA ASN 11 -1.108 -10.908 -9.805 101 HB2 ASN 11 2HB ASN 11 1.610 -9.555 -9.539 102 HB3 ASN 11 3HB ASN 11 1.334 -11.220 -10.057 103 HD21 ASN 11 1HD2 ASN 11 2.546 -8.892 -11.449 104 HD22 ASN 11 2HD2 ASN 11 1.690 -8.764 -12.940 105 H ASP 12 H ASP 12 -1.273 -12.382 -8.315 106 HA ASP 12 HA ASP 12 -0.915 -12.005 -5.532 107 HB2 ASP 12 2HB ASP 12 -1.270 -14.600 -7.097 108 HB3 ASP 12 3HB ASP 12 -1.410 -14.454 -5.346 109 H GLU 13 H GLU 13 1.275 -13.029 -8.005 110 HA GLU 13 HA GLU 13 3.304 -14.269 -6.501 111 HB2 GLU 13 2HB GLU 13 3.463 -12.544 -9.013 112 HB3 GLU 13 3HB GLU 13 4.844 -13.423 -8.353 113 HG2 GLU 13 2HG GLU 13 3.777 -15.547 -8.739 114 HG3 GLU 13 3HG GLU 13 2.258 -14.764 -9.172 115 H LEU 14 H LEU 14 2.800 -10.817 -7.343 116 HA LEU 14 HA LEU 14 5.049 -9.840 -5.919 117 HB2 LEU 14 2HB LEU 14 2.600 -8.504 -7.093 118 HB3 LEU 14 3HB LEU 14 3.635 -7.586 -6.018 119 HG LEU 14 HG LEU 14 4.291 -7.063 -8.269 120 HD11 LEU 14 1HD1 LEU 14 6.377 -8.934 -7.096 121 HD12 LEU 14 2HD1 LEU 14 6.117 -7.247 -6.637 122 HD13 LEU 14 3HD1 LEU 14 6.649 -7.639 -8.266 123 HD21 LEU 14 3HD2 LEU 14 3.375 -8.989 -9.466 124 HD22 LEU 14 1HD2 LEU 14 4.630 -10.039 -8.800 125 HD23 LEU 14 2HD2 LEU 14 5.060 -8.735 -9.912 126 H ILE 15 H ILE 15 1.666 -10.337 -4.980 127 HA ILE 15 HA ILE 15 1.571 -9.088 -2.498 128 HB ILE 15 HB ILE 15 0.283 -11.735 -3.339 129 HG12 ILE 15 2HG1 ILE 15 -0.798 -8.876 -3.347 130 HG13 ILE 15 3HG1 ILE 15 -0.420 -9.854 -4.757 131 HG21 ILE 15 1HG2 ILE 15 -0.452 -10.015 -0.936 132 HG22 ILE 15 2HG2 ILE 15 0.314 -11.603 -0.877 133 HG23 ILE 15 3HG2 ILE 15 -1.330 -11.443 -1.491 134 HD11 ILE 15 3HD1 ILE 15 -2.653 -10.347 -2.787 135 HD12 ILE 15 1HD1 ILE 15 -2.257 -11.385 -4.162 136 HD13 ILE 15 2HD1 ILE 15 -2.799 -9.729 -4.431 137 H LYS 16 H LYS 16 2.516 -12.490 -3.128 138 HA LYS 16 HA LYS 16 3.109 -13.039 -0.388 139 HB2 LYS 16 2HB LYS 16 3.799 -15.259 -1.176 140 HB3 LYS 16 3HB LYS 16 2.269 -14.775 -1.898 141 HG2 LYS 16 2HG LYS 16 3.447 -14.181 -3.998 142 HG3 LYS 16 3HG LYS 16 4.976 -14.681 -3.272 143 HD2 LYS 16 2HD LYS 16 4.098 -16.433 -4.751 144 HD3 LYS 16 3HD LYS 16 4.150 -17.000 -3.083 145 HE2 LYS 16 2HE LYS 16 1.730 -16.656 -2.874 146 HE3 LYS 16 3HE LYS 16 1.665 -15.976 -4.502 147 HZ1 LYS 16 3HZ LYS 16 0.968 -18.291 -4.481 148 HZ2 LYS 16 1HZ LYS 16 2.452 -18.770 -3.829 149 HZ3 LYS 16 2HZ LYS 16 2.382 -18.117 -5.386 150 H LYS 17 H LYS 17 5.097 -12.083 -3.147 151 HA LYS 17 HA LYS 17 7.636 -12.693 -1.957 152 HB2 LYS 17 2HB LYS 17 6.854 -11.001 -4.364 153 HB3 LYS 17 3HB LYS 17 8.527 -11.333 -3.910 154 HG2 LYS 17 2HG LYS 17 8.230 -13.713 -4.254 155 HG3 LYS 17 3HG LYS 17 6.493 -13.510 -4.494 156 HD2 LYS 17 2HD LYS 17 7.605 -13.852 -6.648 157 HD3 LYS 17 3HD LYS 17 6.927 -12.226 -6.567 158 HE2 LYS 17 2HE LYS 17 9.109 -11.265 -6.191 159 HE3 LYS 17 3HE LYS 17 9.835 -12.861 -5.983 160 HZ1 LYS 17 3HZ LYS 17 8.657 -11.807 -8.500 161 HZ2 LYS 17 1HZ LYS 17 9.318 -13.351 -8.297 162 HZ3 LYS 17 2HZ LYS 17 10.301 -11.988 -8.162 163 H ILE 18 H ILE 18 5.702 -9.717 -2.227 164 HA ILE 18 HA ILE 18 7.506 -7.923 -0.980 165 HB ILE 18 HB ILE 18 4.470 -7.902 -1.253 166 HG12 ILE 18 2HG1 ILE 18 6.602 -6.115 -2.523 167 HG13 ILE 18 3HG1 ILE 18 5.909 -7.538 -3.290 168 HG21 ILE 18 1HG2 ILE 18 4.924 -6.687 0.830 169 HG22 ILE 18 2HG2 ILE 18 4.418 -5.565 -0.432 170 HG23 ILE 18 3HG2 ILE 18 6.122 -5.685 0.008 171 HD11 ILE 18 3HD1 ILE 18 3.706 -6.475 -3.273 172 HD12 ILE 18 1HD1 ILE 18 4.905 -5.534 -4.158 173 HD13 ILE 18 2HD1 ILE 18 4.414 -5.031 -2.540 174 H LYS 19 H LYS 19 5.036 -10.151 0.342 175 HA LYS 19 HA LYS 19 5.122 -9.481 3.046 176 HB2 LYS 19 2HB LYS 19 4.873 -12.267 1.826 177 HB3 LYS 19 3HB LYS 19 4.547 -11.893 3.518 178 HG2 LYS 19 2HG LYS 19 2.758 -10.319 2.778 179 HG3 LYS 19 3HG LYS 19 3.039 -10.833 1.114 180 HD2 LYS 19 2HD LYS 19 2.372 -13.127 1.668 181 HD3 LYS 19 3HD LYS 19 2.217 -12.701 3.375 182 HE2 LYS 19 2HE LYS 19 0.374 -11.151 2.816 183 HE3 LYS 19 3HE LYS 19 0.532 -11.583 1.112 184 HZ1 LYS 19 3HZ LYS 19 -0.140 -13.807 1.600 185 HZ2 LYS 19 1HZ LYS 19 -1.276 -12.762 2.292 186 HZ3 LYS 19 2HZ LYS 19 -0.123 -13.523 3.263 187 H LYS 20 H LYS 20 7.308 -11.673 1.236 188 HA LYS 20 HA LYS 20 8.800 -12.568 3.490 189 HB2 LYS 20 2HB LYS 20 9.695 -12.522 0.574 190 HB3 LYS 20 3HB LYS 20 10.403 -13.492 1.855 191 HG2 LYS 20 2HG LYS 20 7.599 -13.807 0.739 192 HG3 LYS 20 3HG LYS 20 8.981 -14.810 0.329 193 HD2 LYS 20 2HD LYS 20 7.949 -16.181 1.882 194 HD3 LYS 20 3HD LYS 20 9.013 -15.286 2.966 195 HE2 LYS 20 2HE LYS 20 7.080 -13.754 3.471 196 HE3 LYS 20 3HE LYS 20 6.060 -14.783 2.467 197 HZ1 LYS 20 3HZ LYS 20 7.510 -15.682 4.902 198 HZ2 LYS 20 1HZ LYS 20 6.448 -16.616 3.968 199 HZ3 LYS 20 2HZ LYS 20 5.872 -15.282 4.838 200 H GLU 21 H GLU 21 9.603 -10.214 0.940 201 HA GLU 21 HA GLU 21 11.920 -9.044 1.718 202 HB2 GLU 21 2HB GLU 21 9.412 -7.652 0.698 203 HB3 GLU 21 3HB GLU 21 10.962 -6.828 0.830 204 HG2 GLU 21 2HG GLU 21 10.479 -9.293 -0.875 205 HG3 GLU 21 3HG GLU 21 10.394 -7.636 -1.474 206 H VAL 22 H VAL 22 8.731 -8.203 3.100 207 HA VAL 22 HA VAL 22 9.935 -6.123 4.766 208 HB VAL 22 HB VAL 22 7.707 -5.321 5.198 209 HG11 VAL 22 1HG1 VAL 22 8.021 -6.151 2.287 210 HG12 VAL 22 2HG1 VAL 22 8.695 -4.712 3.046 211 HG13 VAL 22 3HG1 VAL 22 6.955 -4.875 2.873 212 HG21 VAL 22 3HG2 VAL 22 6.484 -7.402 5.554 213 HG22 VAL 22 1HG2 VAL 22 6.660 -7.842 3.850 214 HG23 VAL 22 2HG2 VAL 22 5.669 -6.452 4.312 215 H GLU 23 H GLU 23 8.674 -9.370 5.222 216 HA GLU 23 HA GLU 23 8.463 -9.376 8.059 217 HB2 GLU 23 2HB GLU 23 9.154 -11.575 6.078 218 HB3 GLU 23 3HB GLU 23 9.061 -11.889 7.806 219 HG2 GLU 23 2HG GLU 23 6.712 -11.386 7.860 220 HG3 GLU 23 3HG GLU 23 6.743 -10.760 6.211 221 H ASN 24 H ASN 24 11.175 -9.687 5.846 222 HA ASN 24 HA ASN 24 13.237 -10.288 7.732 223 HB2 ASN 24 2HB ASN 24 13.396 -9.044 4.947 224 HB3 ASN 24 3HB ASN 24 14.781 -9.638 5.864 225 HD21 ASN 24 1HD2 ASN 24 13.725 -10.473 3.252 226 HD22 ASN 24 2HD2 ASN 24 13.441 -12.174 3.383 227 H GLN 25 H GLN 25 11.498 -7.444 7.113 228 HA GLN 25 HA GLN 25 13.588 -5.620 8.155 229 HB2 GLN 25 2HB GLN 25 11.086 -5.027 6.501 230 HB3 GLN 25 3HB GLN 25 12.267 -3.831 7.030 231 HG2 GLN 25 2HG GLN 25 12.975 -6.164 5.226 232 HG3 GLN 25 3HG GLN 25 12.458 -4.595 4.622 233 HE21 GLN 25 1HE2 GLN 25 15.009 -6.297 6.335 234 HE22 GLN 25 2HE2 GLN 25 16.220 -5.090 6.098 235 H GLY 26 H GLY 26 11.166 -7.381 9.400 236 HA2 GLY 26 2HA GLY 26 9.797 -7.271 11.218 237 HA3 GLY 26 3HA GLY 26 10.743 -5.888 11.729 238 H TYR 27 H TYR 27 8.711 -6.133 8.834 239 HA TYR 27 HA TYR 27 6.908 -4.027 9.833 240 HB2 TYR 27 2HB TYR 27 7.561 -5.038 7.044 241 HB3 TYR 27 3HB TYR 27 6.070 -4.147 7.334 242 HD1 TYR 27 HD2 TYR 27 9.679 -3.742 8.367 243 HD2 TYR 27 HD1 TYR 27 6.218 -1.900 6.664 244 HE1 TYR 27 HE2 TYR 27 10.893 -1.618 8.208 245 HE2 TYR 27 HE1 TYR 27 7.438 0.232 6.507 246 HH TYR 27 HH TYR 27 9.379 1.323 7.638 247 H GLN 28 H GLN 28 4.843 -4.426 10.288 248 HA GLN 28 HA GLN 28 3.975 -7.147 10.692 249 HB2 GLN 28 2HB GLN 28 2.600 -4.479 11.276 250 HB3 GLN 28 3HB GLN 28 1.966 -6.050 11.743 251 HG2 GLN 28 2HG GLN 28 2.966 -5.019 13.673 252 HG3 GLN 28 3HG GLN 28 3.944 -6.400 13.206 253 HE21 GLN 28 1HE2 GLN 28 6.058 -6.054 12.548 254 HE22 GLN 28 2HE2 GLN 28 6.853 -4.526 12.669 255 H VAL 29 H VAL 29 3.172 -8.237 9.005 256 HA VAL 29 HA VAL 29 2.251 -6.884 6.611 257 HB VAL 29 HB VAL 29 2.421 -9.905 7.062 258 HG11 VAL 29 1HG1 VAL 29 1.118 -9.252 5.076 259 HG12 VAL 29 2HG1 VAL 29 2.630 -10.028 4.604 260 HG13 VAL 29 3HG1 VAL 29 2.469 -8.274 4.494 261 HG21 VAL 29 3HG2 VAL 29 4.675 -9.828 6.043 262 HG22 VAL 29 1HG2 VAL 29 4.615 -8.938 7.569 263 HG23 VAL 29 2HG2 VAL 29 4.608 -8.064 6.037 264 H ARG 30 H ARG 30 0.167 -6.556 6.073 265 HA ARG 30 HA ARG 30 -1.901 -8.538 6.831 266 HB2 ARG 30 2HB ARG 30 -2.247 -5.522 6.448 267 HB3 ARG 30 3HB ARG 30 -3.597 -6.654 6.496 268 HG2 ARG 30 2HG ARG 30 -2.895 -7.303 8.813 269 HG3 ARG 30 3HG ARG 30 -1.665 -6.038 8.747 270 HD2 ARG 30 2HD ARG 30 -3.485 -4.365 8.356 271 HD3 ARG 30 3HD ARG 30 -4.673 -5.654 8.568 272 HE ARG 30 HE ARG 30 -3.201 -5.777 10.847 273 HH11 ARG 30 1HH1 ARG 30 -4.876 -3.137 9.226 274 HH12 ARG 30 2HH1 ARG 30 -5.223 -2.296 10.704 275 HH21 ARG 30 1HH2 ARG 30 -3.683 -4.684 12.780 276 HH22 ARG 30 2HH2 ARG 30 -4.542 -3.178 12.724 277 H ASP 31 H ASP 31 -3.395 -9.060 5.223 278 HA ASP 31 HA ASP 31 -3.299 -7.656 2.651 279 HB2 ASP 31 2HB ASP 31 -3.486 -9.781 1.367 280 HB3 ASP 31 3HB ASP 31 -1.956 -9.664 2.220 281 H VAL 32 H VAL 32 -5.274 -7.079 2.053 282 HA VAL 32 HA VAL 32 -7.629 -8.042 3.564 283 HB VAL 32 HB VAL 32 -7.294 -5.430 1.992 284 HG11 VAL 32 1HG1 VAL 32 -9.641 -6.200 2.042 285 HG12 VAL 32 2HG1 VAL 32 -9.431 -4.749 3.021 286 HG13 VAL 32 3HG1 VAL 32 -9.574 -6.325 3.803 287 HG21 VAL 32 3HG2 VAL 32 -7.258 -5.891 4.998 288 HG22 VAL 32 1HG2 VAL 32 -7.248 -4.316 4.201 289 HG23 VAL 32 2HG2 VAL 32 -5.884 -5.415 3.993 290 H ASN 33 H ASN 33 -8.737 -9.526 2.431 291 HA ASN 33 HA ASN 33 -8.994 -9.286 -0.507 292 HB2 ASN 33 2HB ASN 33 -9.697 -11.659 -0.442 293 HB3 ASN 33 3HB ASN 33 -8.111 -11.451 0.290 294 HD21 ASN 33 1HD2 ASN 33 -7.906 -11.709 2.563 295 HD22 ASN 33 2HD2 ASN 33 -9.122 -12.487 3.509 296 H ASP 34 H ASP 34 -10.706 -8.530 2.348 297 HA ASP 34 HA ASP 34 -13.220 -8.314 0.841 298 HB2 ASP 34 2HB ASP 34 -13.080 -10.567 2.154 299 HB3 ASP 34 3HB ASP 34 -13.257 -9.598 3.614 300 H SER 35 H SER 35 -14.606 -6.731 1.526 301 HA SER 35 HA SER 35 -13.643 -4.425 2.718 302 HB2 SER 35 2HB SER 35 -16.568 -5.243 2.447 303 HB3 SER 35 3HB SER 35 -15.940 -3.594 2.557 304 HG SER 35 HG SER 35 -15.781 -3.683 0.474 305 H ASP 36 H ASP 36 -15.310 -7.158 4.205 306 HA ASP 36 HA ASP 36 -16.097 -6.066 6.662 307 HB2 ASP 36 2HB ASP 36 -16.838 -8.277 5.989 308 HB3 ASP 36 3HB ASP 36 -15.188 -8.881 5.921 309 H GLU 37 H GLU 37 -13.006 -7.474 5.650 310 HA GLU 37 HA GLU 37 -11.683 -7.364 8.206 311 HB2 GLU 37 2HB GLU 37 -10.413 -7.524 5.427 312 HB3 GLU 37 3HB GLU 37 -9.678 -8.010 6.954 313 HG2 GLU 37 2HG GLU 37 -11.212 -9.883 7.167 314 HG3 GLU 37 3HG GLU 37 -12.133 -9.348 5.760 315 H LEU 38 H LEU 38 -11.798 -5.371 5.292 316 HA LEU 38 HA LEU 38 -9.831 -3.459 5.779 317 HB2 LEU 38 2HB LEU 38 -10.848 -3.773 3.639 318 HB3 LEU 38 3HB LEU 38 -12.452 -3.463 4.253 319 HG LEU 38 HG LEU 38 -10.500 -1.163 4.335 320 HD11 LEU 38 1HD1 LEU 38 -11.816 -2.104 1.772 321 HD12 LEU 38 2HD1 LEU 38 -10.085 -2.109 2.123 322 HD13 LEU 38 3HD1 LEU 38 -10.950 -0.580 2.003 323 HD21 LEU 38 3HD2 LEU 38 -12.499 0.169 3.766 324 HD22 LEU 38 1HD2 LEU 38 -12.805 -0.835 5.185 325 HD23 LEU 38 2HD2 LEU 38 -13.458 -1.307 3.617 326 H LYS 39 H LYS 39 -13.291 -3.360 6.628 327 HA LYS 39 HA LYS 39 -13.279 -0.687 7.651 328 HB2 LYS 39 2HB LYS 39 -15.298 -2.949 7.910 329 HB3 LYS 39 3HB LYS 39 -15.604 -1.295 8.443 330 HG2 LYS 39 2HG LYS 39 -15.485 -0.454 6.184 331 HG3 LYS 39 3HG LYS 39 -14.886 -2.004 5.580 332 HD2 LYS 39 2HD LYS 39 -17.269 -1.693 5.025 333 HD3 LYS 39 3HD LYS 39 -17.035 -3.074 6.097 334 HE2 LYS 39 2HE LYS 39 -17.740 -1.665 8.023 335 HE3 LYS 39 3HE LYS 39 -18.014 -0.317 6.915 336 HZ1 LYS 39 3HZ LYS 39 -19.691 -1.628 5.786 337 HZ2 LYS 39 1HZ LYS 39 -20.058 -1.492 7.429 338 HZ3 LYS 39 2HZ LYS 39 -19.419 -2.934 6.823 339 H LYS 40 H LYS 40 -12.902 -3.872 9.096 340 HA LYS 40 HA LYS 40 -13.133 -3.101 11.838 341 HB2 LYS 40 2HB LYS 40 -11.875 -5.533 10.497 342 HB3 LYS 40 3HB LYS 40 -11.944 -5.351 12.242 343 HG2 LYS 40 2HG LYS 40 -14.346 -5.459 10.403 344 HG3 LYS 40 3HG LYS 40 -13.723 -6.816 11.334 345 HD2 LYS 40 2HD LYS 40 -14.845 -4.245 12.523 346 HD3 LYS 40 3HD LYS 40 -15.717 -5.771 12.371 347 HE2 LYS 40 2HE LYS 40 -14.015 -6.853 13.837 348 HE3 LYS 40 3HE LYS 40 -13.239 -5.279 14.050 349 HZ1 LYS 40 3HZ LYS 40 -15.325 -4.451 14.987 350 HZ2 LYS 40 1HZ LYS 40 -14.707 -5.746 15.882 351 HZ3 LYS 40 2HZ LYS 40 -16.014 -5.986 14.835 352 H GLU 41 H GLU 41 -10.346 -3.629 9.652 353 HA GLU 41 HA GLU 41 -8.491 -3.732 11.811 354 HB2 GLU 41 2HB GLU 41 -6.801 -4.024 10.125 355 HB3 GLU 41 3HB GLU 41 -8.201 -5.020 9.754 356 HG2 GLU 41 2HG GLU 41 -8.873 -3.572 7.961 357 HG3 GLU 41 3HG GLU 41 -7.704 -2.335 8.431 358 H MET 42 H MET 42 -9.489 -1.186 9.609 359 HA MET 42 HA MET 42 -7.370 0.633 10.159 360 HB2 MET 42 2HB MET 42 -10.058 0.865 8.798 361 HB3 MET 42 3HB MET 42 -9.235 2.352 9.267 362 HG2 MET 42 2HG MET 42 -8.045 0.198 7.496 363 HG3 MET 42 3HG MET 42 -8.732 1.734 6.943 364 HE1 MET 42 3HE MET 42 -4.734 2.065 6.612 365 HE2 MET 42 1HE MET 42 -6.240 1.945 5.703 366 HE3 MET 42 2HE MET 42 -5.597 0.528 6.538 367 H LYS 43 H LYS 43 -10.547 0.125 11.629 368 HA LYS 43 HA LYS 43 -10.392 2.319 13.476 369 HB2 LYS 43 2HB LYS 43 -12.038 -0.238 13.642 370 HB3 LYS 43 3HB LYS 43 -12.258 1.185 14.666 371 HG2 LYS 43 2HG LYS 43 -12.842 2.518 12.664 372 HG3 LYS 43 3HG LYS 43 -12.652 1.079 11.654 373 HD2 LYS 43 2HD LYS 43 -14.493 -0.028 12.888 374 HD3 LYS 43 3HD LYS 43 -14.672 1.399 13.916 375 HE2 LYS 43 2HE LYS 43 -15.316 2.740 11.959 376 HE3 LYS 43 3HE LYS 43 -15.094 1.337 10.907 377 HZ1 LYS 43 3HZ LYS 43 -17.066 1.532 13.121 378 HZ2 LYS 43 1HZ LYS 43 -16.865 0.209 12.085 379 HZ3 LYS 43 2HZ LYS 43 -17.412 1.685 11.478 380 H LYS 44 H LYS 44 -9.383 -1.054 13.488 381 HA LYS 44 HA LYS 44 -8.637 -1.291 16.206 382 HB2 LYS 44 2HB LYS 44 -7.452 -2.751 13.799 383 HB3 LYS 44 3HB LYS 44 -7.257 -3.227 15.482 384 HG2 LYS 44 2HG LYS 44 -9.854 -3.210 13.918 385 HG3 LYS 44 3HG LYS 44 -8.918 -4.635 14.357 386 HD2 LYS 44 2HD LYS 44 -10.284 -2.744 16.312 387 HD3 LYS 44 3HD LYS 44 -10.907 -4.311 15.797 388 HE2 LYS 44 2HE LYS 44 -8.310 -3.877 17.313 389 HE3 LYS 44 3HE LYS 44 -9.831 -4.417 18.019 390 HZ1 LYS 44 3HZ LYS 44 -8.273 -6.230 17.553 391 HZ2 LYS 44 1HZ LYS 44 -8.357 -5.881 15.905 392 HZ3 LYS 44 2HZ LYS 44 -9.734 -6.412 16.728 393 H LEU 45 H LEU 45 -6.884 -0.086 13.331 394 HA LEU 45 HA LEU 45 -4.307 0.191 14.400 395 HB2 LEU 45 2HB LEU 45 -5.717 1.883 12.297 396 HB3 LEU 45 3HB LEU 45 -4.002 2.036 12.664 397 HG LEU 45 HG LEU 45 -5.373 -0.432 11.532 398 HD11 LEU 45 1HD1 LEU 45 -4.078 0.005 9.511 399 HD12 LEU 45 2HD1 LEU 45 -3.417 1.478 10.230 400 HD13 LEU 45 3HD1 LEU 45 -5.146 1.355 9.891 401 HD21 LEU 45 3HD2 LEU 45 -3.580 -1.122 13.020 402 HD22 LEU 45 1HD2 LEU 45 -2.448 -0.021 12.224 403 HD23 LEU 45 2HD2 LEU 45 -3.116 -1.400 11.345 404 H ALA 46 H ALA 46 -7.076 2.348 14.622 405 HA ALA 46 HA ALA 46 -5.853 4.532 15.946 406 HB1 ALA 46 3HB ALA 46 -8.039 4.690 14.821 407 HB2 ALA 46 1HB ALA 46 -8.161 5.205 16.505 408 HB3 ALA 46 2HB ALA 46 -8.746 3.610 16.024 409 H GLU 47 H GLU 47 -6.902 1.410 17.063 410 HA GLU 47 HA GLU 47 -6.864 2.126 19.910 411 HB2 GLU 47 2HB GLU 47 -7.526 -0.534 18.565 412 HB3 GLU 47 3HB GLU 47 -7.787 -0.130 20.262 413 HG2 GLU 47 2HG GLU 47 -9.431 1.603 19.582 414 HG3 GLU 47 3HG GLU 47 -9.179 1.167 17.894 415 H GLU 48 H GLU 48 -4.961 0.451 17.486 416 HA GLU 48 HA GLU 48 -3.214 -1.011 19.188 417 HB2 GLU 48 2HB GLU 48 -2.847 -0.033 16.310 418 HB3 GLU 48 3HB GLU 48 -1.740 -1.125 17.125 419 HG2 GLU 48 2HG GLU 48 -4.649 -1.759 16.574 420 HG3 GLU 48 3HG GLU 48 -3.323 -2.223 15.520 421 H LYS 49 H LYS 49 -3.036 2.172 17.620 422 HA LYS 49 HA LYS 49 -2.269 4.152 18.302 423 HB2 LYS 49 2HB LYS 49 -3.020 3.624 20.569 424 HB3 LYS 49 3HB LYS 49 -1.510 2.775 20.903 425 HG2 LYS 49 2HG LYS 49 -0.265 4.921 20.612 426 HG3 LYS 49 3HG LYS 49 -1.794 5.757 20.348 427 HD2 LYS 49 2HD LYS 49 -1.029 4.285 22.897 428 HD3 LYS 49 3HD LYS 49 -0.896 6.029 22.661 429 HE2 LYS 49 2HE LYS 49 -3.469 4.416 22.606 430 HE3 LYS 49 3HE LYS 49 -2.925 5.465 23.912 431 HZ1 LYS 49 3HZ LYS 49 -3.630 6.333 21.161 432 HZ2 LYS 49 1HZ LYS 49 -3.050 7.349 22.379 433 HZ3 LYS 49 2HZ LYS 49 -4.544 6.582 22.556 434 H ASN 50 H ASN 50 0.222 1.874 19.559 435 HA ASN 50 HA ASN 50 2.320 3.745 19.392 436 HB2 ASN 50 2HB ASN 50 2.104 1.665 20.889 437 HB3 ASN 50 3HB ASN 50 2.644 0.712 19.517 438 HD21 ASN 50 1HD2 ASN 50 3.577 3.112 21.891 439 HD22 ASN 50 2HD2 ASN 50 5.285 2.931 21.696 440 H PHE 51 H PHE 51 4.540 2.754 18.183 441 HA PHE 51 HA PHE 51 4.029 3.933 15.614 442 HB2 PHE 51 2HB PHE 51 6.681 2.964 16.799 443 HB3 PHE 51 3HB PHE 51 6.485 4.073 15.446 444 HD1 PHE 51 HD1 PHE 51 5.804 6.420 15.827 445 HD2 PHE 51 HD2 PHE 51 6.338 3.728 19.111 446 HE1 PHE 51 HE1 PHE 51 5.841 8.312 17.392 447 HE2 PHE 51 HE2 PHE 51 6.371 5.629 20.664 448 HZ PHE 51 HZ PHE 51 6.121 7.924 19.807 449 H GLU 52 H GLU 52 3.453 0.841 16.198 450 HA GLU 52 HA GLU 52 4.991 -0.793 14.609 451 HB2 GLU 52 2HB GLU 52 2.005 -0.886 15.172 452 HB3 GLU 52 3HB GLU 52 2.794 -2.119 14.203 453 HG2 GLU 52 2HG GLU 52 2.576 -3.001 16.388 454 HG3 GLU 52 3HG GLU 52 4.276 -2.628 16.153 455 H LYS 53 H LYS 53 5.463 -0.869 12.520 456 HA LYS 53 HA LYS 53 4.091 0.734 10.518 457 HB2 LYS 53 2HB LYS 53 6.567 -1.019 10.422 458 HB3 LYS 53 3HB LYS 53 5.814 -0.457 8.937 459 HG2 LYS 53 2HG LYS 53 7.690 0.979 9.528 460 HG3 LYS 53 3HG LYS 53 6.176 1.880 9.605 461 HD2 LYS 53 2HD LYS 53 7.655 2.457 11.481 462 HD3 LYS 53 3HD LYS 53 6.168 1.701 12.051 463 HE2 LYS 53 2HE LYS 53 7.489 -0.494 12.164 464 HE3 LYS 53 3HE LYS 53 8.941 0.480 11.908 465 HZ1 LYS 53 3HZ LYS 53 8.331 1.770 13.887 466 HZ2 LYS 53 1HZ LYS 53 8.588 0.136 14.242 467 HZ3 LYS 53 2HZ LYS 53 7.015 0.747 14.151 468 H ILE 54 H ILE 54 2.189 -0.044 9.869 469 HA ILE 54 HA ILE 54 1.783 -2.959 9.629 470 HB ILE 54 HB ILE 54 -0.345 -0.760 9.629 471 HG12 ILE 54 2HG1 ILE 54 0.903 -0.731 11.809 472 HG13 ILE 54 3HG1 ILE 54 -0.773 -1.216 12.006 473 HG21 ILE 54 1HG2 ILE 54 -1.907 -2.604 10.139 474 HG22 ILE 54 2HG2 ILE 54 -0.576 -3.762 10.065 475 HG23 ILE 54 3HG2 ILE 54 -1.059 -2.878 8.616 476 HD11 ILE 54 3HD1 ILE 54 0.685 -2.514 13.413 477 HD12 ILE 54 1HD1 ILE 54 1.623 -3.039 12.017 478 HD13 ILE 54 2HD1 ILE 54 -0.057 -3.556 12.199 479 H LEU 55 H LEU 55 2.150 -3.621 7.590 480 HA LEU 55 HA LEU 55 1.799 -1.831 5.289 481 HB2 LEU 55 2HB LEU 55 3.899 -3.175 5.631 482 HB3 LEU 55 3HB LEU 55 2.976 -4.648 5.405 483 HG LEU 55 HG LEU 55 2.984 -2.544 3.210 484 HD11 LEU 55 1HD1 LEU 55 4.953 -3.534 2.179 485 HD12 LEU 55 2HD1 LEU 55 5.171 -4.600 3.569 486 HD13 LEU 55 3HD1 LEU 55 5.340 -2.853 3.758 487 HD21 LEU 55 3HD2 LEU 55 2.795 -5.572 3.084 488 HD22 LEU 55 1HD2 LEU 55 2.717 -4.465 1.709 489 HD23 LEU 55 2HD2 LEU 55 1.450 -4.437 2.932 490 H ILE 56 H ILE 56 0.044 -1.998 4.000 491 HA ILE 56 HA ILE 56 -1.845 -4.241 4.412 492 HB ILE 56 HB ILE 56 -2.557 -1.510 3.241 493 HG12 ILE 56 2HG1 ILE 56 -1.745 -1.048 5.525 494 HG13 ILE 56 3HG1 ILE 56 -3.490 -0.833 5.454 495 HG21 ILE 56 1HG2 ILE 56 -4.120 -3.329 2.734 496 HG22 ILE 56 2HG2 ILE 56 -4.872 -2.152 3.810 497 HG23 ILE 56 3HG2 ILE 56 -4.297 -3.691 4.456 498 HD11 ILE 56 3HD1 ILE 56 -2.870 -1.903 7.497 499 HD12 ILE 56 1HD1 ILE 56 -2.003 -3.170 6.629 500 HD13 ILE 56 2HD1 ILE 56 -3.761 -3.055 6.501 501 H ILE 57 H ILE 57 -1.537 -5.664 2.743 502 HA ILE 57 HA ILE 57 -1.166 -4.698 -0.018 503 HB ILE 57 HB ILE 57 -1.427 -7.600 0.935 504 HG12 ILE 57 2HG1 ILE 57 1.117 -6.060 0.230 505 HG13 ILE 57 3HG1 ILE 57 0.614 -6.475 1.864 506 HG21 ILE 57 1HG2 ILE 57 -0.522 -8.172 -1.305 507 HG22 ILE 57 2HG2 ILE 57 -0.511 -6.464 -1.740 508 HG23 ILE 57 3HG2 ILE 57 -2.043 -7.285 -1.438 509 HD11 ILE 57 3HD1 ILE 57 0.833 -8.849 1.328 510 HD12 ILE 57 1HD1 ILE 57 2.337 -7.966 1.078 511 HD13 ILE 57 2HD1 ILE 57 1.352 -8.434 -0.309 512 H SER 58 H SER 58 -2.912 -4.379 -1.313 513 HA SER 58 HA SER 58 -5.354 -5.986 -0.944 514 HB2 SER 58 2HB SER 58 -5.803 -3.743 0.069 515 HB3 SER 58 3HB SER 58 -5.341 -2.960 -1.440 516 HG SER 58 HG SER 58 -7.328 -3.261 -2.057 517 H ASN 59 H ASN 59 -5.589 -7.077 -2.766 518 HA ASN 59 HA ASN 59 -4.153 -6.521 -5.182 519 HB2 ASN 59 2HB ASN 59 -4.550 -8.826 -4.517 520 HB3 ASN 59 3HB ASN 59 -6.291 -8.586 -4.495 521 HD21 ASN 59 1HD2 ASN 59 -3.483 -9.031 -6.540 522 HD22 ASN 59 2HD2 ASN 59 -4.355 -9.417 -7.979 523 H ASP 60 H ASP 60 -7.162 -5.492 -3.949 524 HA ASP 60 HA ASP 60 -8.313 -4.885 -6.602 525 HB2 ASP 60 2HB ASP 60 -9.751 -6.333 -5.277 526 HB3 ASP 60 3HB ASP 60 -9.609 -5.278 -3.876 527 H LYS 61 H LYS 61 -8.721 -2.816 -7.152 528 HA LYS 61 HA LYS 61 -7.551 -0.688 -5.592 529 HB2 LYS 61 2HB LYS 61 -8.916 -0.677 -8.311 530 HB3 LYS 61 3HB LYS 61 -8.257 0.775 -7.556 531 HG2 LYS 61 2HG LYS 61 -6.014 -0.309 -7.493 532 HG3 LYS 61 3HG LYS 61 -6.689 -1.706 -8.341 533 HD2 LYS 61 2HD LYS 61 -7.239 -0.262 -10.279 534 HD3 LYS 61 3HD LYS 61 -6.585 1.143 -9.426 535 HE2 LYS 61 2HE LYS 61 -4.985 0.205 -11.080 536 HE3 LYS 61 3HE LYS 61 -4.351 0.142 -9.433 537 HZ1 LYS 61 3HZ LYS 61 -3.976 -1.902 -10.729 538 HZ2 LYS 61 1HZ LYS 61 -5.646 -2.150 -10.811 539 HZ3 LYS 61 2HZ LYS 61 -4.851 -2.177 -9.314 540 H GLN 62 H GLN 62 -10.808 -1.885 -6.098 541 HA GLN 62 HA GLN 62 -12.233 0.473 -5.350 542 HB2 GLN 62 2HB GLN 62 -13.365 -1.397 -6.492 543 HB3 GLN 62 3HB GLN 62 -13.049 -2.461 -5.127 544 HG2 GLN 62 2HG GLN 62 -14.495 -0.952 -3.711 545 HG3 GLN 62 3HG GLN 62 -14.885 -0.054 -5.173 546 HE21 GLN 62 1HE2 GLN 62 -16.181 -1.064 -6.780 547 HE22 GLN 62 2HE2 GLN 62 -17.141 -2.454 -6.417 548 H LEU 63 H LEU 63 -11.158 -2.418 -3.512 549 HA LEU 63 HA LEU 63 -11.831 -1.611 -0.918 550 HB2 LEU 63 2HB LEU 63 -9.543 -3.351 -1.926 551 HB3 LEU 63 3HB LEU 63 -9.846 -3.102 -0.212 552 HG LEU 63 HG LEU 63 -11.748 -4.443 -2.172 553 HD11 LEU 63 1HD1 LEU 63 -9.812 -5.840 -1.651 554 HD12 LEU 63 2HD1 LEU 63 -11.274 -6.500 -0.921 555 HD13 LEU 63 3HD1 LEU 63 -10.101 -5.636 0.080 556 HD21 LEU 63 3HD2 LEU 63 -13.128 -4.975 -0.196 557 HD22 LEU 63 1HD2 LEU 63 -13.017 -3.237 -0.469 558 HD23 LEU 63 2HD2 LEU 63 -12.069 -3.990 0.818 559 H LEU 64 H LEU 64 -8.935 -0.920 -2.857 560 HA LEU 64 HA LEU 64 -7.398 0.385 -0.909 561 HB2 LEU 64 2HB LEU 64 -6.433 -0.367 -2.977 562 HB3 LEU 64 3HB LEU 64 -7.487 0.652 -3.928 563 HG LEU 64 HG LEU 64 -5.612 2.080 -2.043 564 HD11 LEU 64 1HD1 LEU 64 -4.613 0.801 -4.599 565 HD12 LEU 64 2HD1 LEU 64 -4.138 0.357 -2.957 566 HD13 LEU 64 3HD1 LEU 64 -3.728 1.949 -3.589 567 HD21 LEU 64 3HD2 LEU 64 -7.135 3.379 -3.484 568 HD22 LEU 64 1HD2 LEU 64 -6.427 2.636 -4.921 569 HD23 LEU 64 2HD2 LEU 64 -5.451 3.694 -3.897 570 H LYS 65 H LYS 65 -9.960 1.658 -3.040 571 HA LYS 65 HA LYS 65 -9.647 4.421 -2.417 572 HB2 LYS 65 2HB LYS 65 -12.105 2.907 -3.395 573 HB3 LYS 65 3HB LYS 65 -11.963 4.665 -3.351 574 HG2 LYS 65 2HG LYS 65 -10.150 4.608 -4.981 575 HG3 LYS 65 3HG LYS 65 -10.144 2.843 -4.953 576 HD2 LYS 65 2HD LYS 65 -11.313 3.563 -6.948 577 HD3 LYS 65 3HD LYS 65 -12.495 2.864 -5.841 578 HE2 LYS 65 2HE LYS 65 -13.120 5.180 -5.121 579 HE3 LYS 65 3HE LYS 65 -11.998 5.824 -6.323 580 HZ1 LYS 65 3HZ LYS 65 -13.298 4.905 -8.070 581 HZ2 LYS 65 1HZ LYS 65 -14.352 5.743 -7.052 582 HZ3 LYS 65 2HZ LYS 65 -14.289 4.052 -6.999 583 H GLU 66 H GLU 66 -11.904 1.932 -1.158 584 HA GLU 66 HA GLU 66 -13.270 3.419 0.771 585 HB2 GLU 66 2HB GLU 66 -12.383 0.529 1.178 586 HB3 GLU 66 3HB GLU 66 -13.795 1.308 1.877 587 HG2 GLU 66 2HG GLU 66 -13.384 0.621 -1.039 588 HG3 GLU 66 3HG GLU 66 -14.384 -0.276 0.095 589 H MET 67 H MET 67 -10.237 1.675 0.965 590 HA MET 67 HA MET 67 -9.585 1.894 3.662 591 HB2 MET 67 2HB MET 67 -8.556 0.357 1.921 592 HB3 MET 67 3HB MET 67 -7.646 1.732 1.308 593 HG2 MET 67 2HG MET 67 -6.151 0.582 2.707 594 HG3 MET 67 3HG MET 67 -6.695 1.942 3.688 595 HE1 MET 67 3HE MET 67 -7.841 -2.480 4.279 596 HE2 MET 67 1HE MET 67 -6.589 -1.881 3.192 597 HE3 MET 67 2HE MET 67 -8.291 -1.624 2.805 598 H LEU 68 H LEU 68 -8.644 3.976 0.885 599 HA LEU 68 HA LEU 68 -6.866 5.681 2.321 600 HB2 LEU 68 2HB LEU 68 -8.337 6.116 -0.307 601 HB3 LEU 68 3HB LEU 68 -7.133 7.231 0.325 602 HG LEU 68 HG LEU 68 -6.581 4.338 -0.439 603 HD11 LEU 68 1HD1 LEU 68 -7.133 5.693 -2.386 604 HD12 LEU 68 2HD1 LEU 68 -5.426 5.263 -2.382 605 HD13 LEU 68 3HD1 LEU 68 -5.922 6.895 -1.922 606 HD21 LEU 68 3HD2 LEU 68 -5.050 5.112 1.318 607 HD22 LEU 68 1HD2 LEU 68 -4.638 6.540 0.360 608 HD23 LEU 68 2HD2 LEU 68 -4.202 4.928 -0.214 609 H GLU 69 H GLU 69 -10.306 5.856 1.550 610 HA GLU 69 HA GLU 69 -10.797 8.467 2.566 611 HB2 GLU 69 2HB GLU 69 -12.658 6.099 2.094 612 HB3 GLU 69 3HB GLU 69 -13.224 7.697 2.588 613 HG2 GLU 69 2HG GLU 69 -12.314 8.697 0.554 614 HG3 GLU 69 3HG GLU 69 -11.621 7.151 0.071 615 H LEU 70 H LEU 70 -10.787 5.233 4.066 616 HA LEU 70 HA LEU 70 -11.570 6.083 6.672 617 HB2 LEU 70 2HB LEU 70 -9.958 3.661 5.787 618 HB3 LEU 70 3HB LEU 70 -10.468 3.921 7.445 619 HG LEU 70 HG LEU 70 -12.278 3.443 5.041 620 HD11 LEU 70 1HD1 LEU 70 -12.910 1.382 6.197 621 HD12 LEU 70 2HD1 LEU 70 -11.785 1.748 7.508 622 HD13 LEU 70 3HD1 LEU 70 -11.176 1.425 5.882 623 HD21 LEU 70 3HD2 LEU 70 -13.107 4.005 7.912 624 HD22 LEU 70 1HD2 LEU 70 -14.182 3.522 6.597 625 HD23 LEU 70 2HD2 LEU 70 -13.351 5.074 6.527 626 H ILE 71 H ILE 71 -8.430 5.885 5.041 627 HA ILE 71 HA ILE 71 -6.762 6.512 7.266 628 HB ILE 71 HB ILE 71 -6.285 6.889 4.266 629 HG12 ILE 71 2HG1 ILE 71 -5.217 4.723 6.142 630 HG13 ILE 71 3HG1 ILE 71 -6.602 4.517 5.082 631 HG21 ILE 71 1HG2 ILE 71 -4.812 8.420 5.504 632 HG22 ILE 71 2HG2 ILE 71 -3.877 7.113 4.781 633 HG23 ILE 71 3HG2 ILE 71 -4.238 7.086 6.509 634 HD11 ILE 71 3HD1 ILE 71 -4.644 3.489 4.128 635 HD12 ILE 71 1HD1 ILE 71 -3.758 5.013 4.205 636 HD13 ILE 71 2HD1 ILE 71 -5.150 4.850 3.131 637 H SER 72 H SER 72 -8.583 8.475 4.946 638 HA SER 72 HA SER 72 -7.581 11.027 5.656 639 HB2 SER 72 2HB SER 72 -8.766 10.645 3.554 640 HB3 SER 72 3HB SER 72 -10.225 10.155 4.412 641 HG SER 72 HG SER 72 -10.718 12.186 4.727 642 H LYS 73 H LYS 73 -9.890 8.896 7.165 643 HA LYS 73 HA LYS 73 -11.006 10.876 8.974 644 HB2 LYS 73 2HB LYS 73 -11.185 7.835 9.112 645 HB3 LYS 73 3HB LYS 73 -12.189 8.976 9.999 646 HG2 LYS 73 2HG LYS 73 -12.176 8.613 6.985 647 HG3 LYS 73 3HG LYS 73 -13.375 7.945 8.087 648 HD2 LYS 73 2HD LYS 73 -12.865 10.918 7.673 649 HD3 LYS 73 3HD LYS 73 -14.153 9.997 6.894 650 HE2 LYS 73 2HE LYS 73 -13.852 10.450 9.885 651 HE3 LYS 73 3HE LYS 73 -15.014 11.240 8.824 652 HZ1 LYS 73 3HZ LYS 73 -14.915 8.322 9.366 653 HZ2 LYS 73 1HZ LYS 73 -16.049 9.116 8.404 654 HZ3 LYS 73 2HZ LYS 73 -15.998 9.412 10.065 655 H LEU 74 H LEU 74 -8.308 8.619 8.977 656 HA LEU 74 HA LEU 74 -8.029 8.627 11.908 657 HB2 LEU 74 2HB LEU 74 -6.495 7.058 9.786 658 HB3 LEU 74 3HB LEU 74 -6.367 6.830 11.525 659 HG LEU 74 HG LEU 74 -8.885 6.300 9.900 660 HD11 LEU 74 1HD1 LEU 74 -6.869 4.316 10.984 661 HD12 LEU 74 2HD1 LEU 74 -7.129 4.729 9.287 662 HD13 LEU 74 3HD1 LEU 74 -8.400 3.917 10.195 663 HD21 LEU 74 3HD2 LEU 74 -9.728 5.177 11.922 664 HD22 LEU 74 1HD2 LEU 74 -9.405 6.885 12.218 665 HD23 LEU 74 2HD2 LEU 74 -8.278 5.660 12.807 666 H GLY 75 H GLY 75 -5.834 8.954 9.103 667 HA2 GLY 75 2HA GLY 75 -4.419 10.766 8.617 668 HA3 GLY 75 3HA GLY 75 -4.515 11.302 10.289 669 H TYR 76 H TYR 76 -3.061 9.009 8.080 670 HA TYR 76 HA TYR 76 -0.829 8.536 9.978 671 HB2 TYR 76 2HB TYR 76 -2.249 6.415 8.300 672 HB3 TYR 76 3HB TYR 76 -0.703 6.148 9.102 673 HD1 TYR 76 HD1 TYR 76 -1.024 7.317 11.745 674 HD2 TYR 76 HD2 TYR 76 -3.880 5.111 9.455 675 HE1 TYR 76 HE1 TYR 76 -2.162 6.647 13.808 676 HE2 TYR 76 HE2 TYR 76 -5.018 4.441 11.533 677 HH TYR 76 HH TYR 76 -4.364 5.900 14.538 678 H LYS 77 H LYS 77 1.213 8.127 9.037 679 HA LYS 77 HA LYS 77 1.733 9.425 6.507 680 HB2 LYS 77 2HB LYS 77 3.319 9.646 8.407 681 HB3 LYS 77 3HB LYS 77 3.606 7.912 8.396 682 HG2 LYS 77 2HG LYS 77 5.477 9.086 7.359 683 HG3 LYS 77 3HG LYS 77 4.647 8.094 6.157 684 HD2 LYS 77 2HD LYS 77 3.474 10.131 5.316 685 HD3 LYS 77 3HD LYS 77 4.334 11.106 6.510 686 HE2 LYS 77 2HE LYS 77 6.481 10.531 5.448 687 HE3 LYS 77 3HE LYS 77 5.642 9.511 4.279 688 HZ1 LYS 77 3HZ LYS 77 6.209 11.714 3.400 689 HZ2 LYS 77 1HZ LYS 77 5.225 12.441 4.564 690 HZ3 LYS 77 2HZ LYS 77 4.544 11.439 3.384 691 H VAL 78 H VAL 78 0.834 8.254 4.885 692 HA VAL 78 HA VAL 78 1.341 5.362 4.643 693 HB VAL 78 HB VAL 78 -0.727 7.126 3.257 694 HG11 VAL 78 1HG1 VAL 78 -0.390 4.108 3.098 695 HG12 VAL 78 2HG1 VAL 78 -0.088 5.254 1.790 696 HG13 VAL 78 3HG1 VAL 78 -1.728 5.030 2.406 697 HG21 VAL 78 3HG2 VAL 78 -2.367 5.950 4.680 698 HG22 VAL 78 1HG2 VAL 78 -1.174 6.813 5.655 699 HG23 VAL 78 2HG2 VAL 78 -1.058 5.066 5.460 700 H PHE 79 H PHE 79 2.783 4.667 3.238 701 HA PHE 79 HA PHE 79 3.545 6.247 0.860 702 HB2 PHE 79 2HB PHE 79 4.815 3.784 2.155 703 HB3 PHE 79 3HB PHE 79 5.409 4.574 0.702 704 HD1 PHE 79 HD2 PHE 79 4.974 4.984 4.384 705 HD2 PHE 79 HD1 PHE 79 6.810 6.521 0.837 706 HE1 PHE 79 HE2 PHE 79 6.429 6.424 5.750 707 HE2 PHE 79 HE1 PHE 79 8.253 7.951 2.215 708 HZ PHE 79 HZ PHE 79 8.064 7.903 4.664 709 H LEU 80 H LEU 80 2.337 5.697 -0.883 710 HA LEU 80 HA LEU 80 1.039 3.061 -1.041 711 HB2 LEU 80 2HB LEU 80 -0.480 4.947 -1.125 712 HB3 LEU 80 3HB LEU 80 0.433 5.697 -2.423 713 HG LEU 80 HG LEU 80 -0.267 3.921 -3.993 714 HD11 LEU 80 1HD1 LEU 80 -0.401 2.020 -2.479 715 HD12 LEU 80 2HD1 LEU 80 -1.900 2.205 -3.384 716 HD13 LEU 80 3HD1 LEU 80 -1.822 2.712 -1.694 717 HD21 LEU 80 3HD2 LEU 80 -1.698 5.889 -3.794 718 HD22 LEU 80 1HD2 LEU 80 -2.625 5.117 -2.504 719 HD23 LEU 80 2HD2 LEU 80 -2.661 4.454 -4.143 720 H LEU 81 H LEU 81 1.910 1.578 -2.351 721 HA LEU 81 HA LEU 81 3.249 2.381 -4.857 722 HB2 LEU 81 2HB LEU 81 4.559 0.831 -3.434 723 HB3 LEU 81 3HB LEU 81 3.232 -0.320 -3.428 724 HG LEU 81 HG LEU 81 3.512 -0.691 -5.866 725 HD11 LEU 81 1HD1 LEU 81 5.776 1.309 -5.689 726 HD12 LEU 81 2HD1 LEU 81 4.272 1.474 -6.596 727 HD13 LEU 81 3HD1 LEU 81 5.455 0.262 -7.071 728 HD21 LEU 81 3HD2 LEU 81 5.653 -1.875 -5.825 729 HD22 LEU 81 1HD2 LEU 81 4.761 -2.127 -4.325 730 HD23 LEU 81 2HD2 LEU 81 6.126 -1.008 -4.362 731 H LEU 82 H LEU 82 1.984 2.329 -6.578 732 HA LEU 82 HA LEU 82 -0.257 0.440 -6.817 733 HB2 LEU 82 2HB LEU 82 0.406 3.029 -8.283 734 HB3 LEU 82 3HB LEU 82 -0.893 1.955 -8.764 735 HG LEU 82 HG LEU 82 -0.736 3.437 -6.108 736 HD11 LEU 82 1HD1 LEU 82 -2.555 3.962 -8.482 737 HD12 LEU 82 2HD1 LEU 82 -1.183 4.957 -7.987 738 HD13 LEU 82 3HD1 LEU 82 -2.584 4.807 -6.931 739 HD21 LEU 82 3HD2 LEU 82 -1.896 1.305 -5.853 740 HD22 LEU 82 1HD2 LEU 82 -2.958 1.689 -7.213 741 HD23 LEU 82 2HD2 LEU 82 -3.029 2.645 -5.729 742 H GLN 83 H GLN 83 0.410 -1.363 -7.759 743 HA GLN 83 HA GLN 83 2.131 -1.350 -10.145 744 HB2 GLN 83 2HB GLN 83 2.856 -2.814 -8.167 745 HB3 GLN 83 3HB GLN 83 1.404 -3.769 -8.408 746 HG2 GLN 83 2HG GLN 83 3.486 -3.392 -10.583 747 HG3 GLN 83 3HG GLN 83 3.592 -4.689 -9.402 748 HE21 GLN 83 1HE2 GLN 83 3.163 -4.591 -12.405 749 HE22 GLN 83 2HE2 GLN 83 1.813 -5.631 -12.674 750 H ASP 84 H ASP 84 0.956 -1.399 -11.969 751 HA ASP 84 HA ASP 84 -1.200 -3.316 -12.315 752 HB2 ASP 84 2HB ASP 84 -2.321 -1.236 -11.392 753 HB3 ASP 84 3HB ASP 84 -1.744 -0.352 -12.795 754 H GLN 85 H GLN 85 -1.770 -3.569 -14.583 755 HA GLN 85 HA GLN 85 0.649 -3.357 -16.200 756 HB2 GLN 85 2HB GLN 85 -1.940 -4.881 -16.719 757 HB3 GLN 85 3HB GLN 85 -0.410 -5.109 -17.564 758 HG2 GLN 85 2HG GLN 85 0.629 -5.981 -15.525 759 HG3 GLN 85 3HG GLN 85 -0.832 -5.644 -14.599 760 HE21 GLN 85 1HE2 GLN 85 -2.668 -6.978 -14.910 761 HE22 GLN 85 2HE2 GLN 85 -2.538 -8.544 -15.638 762 H ASP 86 H ASP 86 -2.480 -1.889 -15.997 763 HA ASP 86 HA ASP 86 -2.198 -0.586 -18.650 764 HB2 ASP 86 2HB ASP 86 -4.686 -0.846 -16.881 765 HB3 ASP 86 3HB ASP 86 -4.626 -0.056 -18.455 766 H GLU 87 H GLU 87 -0.709 0.979 -17.991 767 HA GLU 87 HA GLU 87 -1.007 2.349 -15.463 768 HB2 GLU 87 2HB GLU 87 1.139 2.450 -17.584 769 HB3 GLU 87 3HB GLU 87 1.158 3.494 -16.163 770 HG2 GLU 87 2HG GLU 87 0.926 1.266 -14.813 771 HG3 GLU 87 3HG GLU 87 1.473 0.495 -16.302 772 H ASN 88 H ASN 88 -2.096 3.101 -18.624 773 HA ASN 88 HA ASN 88 -1.977 5.977 -18.424 774 HB2 ASN 88 2HB ASN 88 -3.874 4.277 -20.113 775 HB3 ASN 88 3HB ASN 88 -3.574 6.002 -20.321 776 HD21 ASN 88 1HD2 ASN 88 -1.523 6.673 -21.135 777 HD22 ASN 88 2HD2 ASN 88 -0.521 5.586 -22.029 778 H GLU 89 H GLU 89 -4.398 3.495 -17.764 779 HA GLU 89 HA GLU 89 -6.419 5.211 -16.701 780 HB2 GLU 89 2HB GLU 89 -6.083 2.256 -16.034 781 HB3 GLU 89 3HB GLU 89 -7.571 3.199 -16.037 782 HG2 GLU 89 2HG GLU 89 -5.964 2.253 -18.415 783 HG3 GLU 89 3HG GLU 89 -7.591 1.761 -17.960 784 H LEU 90 H LEU 90 -3.747 3.340 -15.354 785 HA LEU 90 HA LEU 90 -4.309 3.604 -12.619 786 HB2 LEU 90 2HB LEU 90 -2.725 1.934 -13.528 787 HB3 LEU 90 3HB LEU 90 -1.627 3.222 -13.998 788 HG LEU 90 HG LEU 90 -1.312 3.818 -11.584 789 HD11 LEU 90 1HD1 LEU 90 -2.941 1.343 -10.967 790 HD12 LEU 90 2HD1 LEU 90 -3.496 3.009 -10.781 791 HD13 LEU 90 3HD1 LEU 90 -2.152 2.427 -9.822 792 HD21 LEU 90 3HD2 LEU 90 0.117 1.936 -10.975 793 HD22 LEU 90 1HD2 LEU 90 0.295 2.313 -12.689 794 HD23 LEU 90 2HD2 LEU 90 -0.656 0.916 -12.186 795 H GLU 91 H GLU 91 -2.537 5.743 -14.840 796 HA GLU 91 HA GLU 91 -1.357 7.369 -12.796 797 HB2 GLU 91 2HB GLU 91 -0.330 7.122 -15.012 798 HB3 GLU 91 3HB GLU 91 -1.695 7.928 -15.776 799 HG2 GLU 91 2HG GLU 91 -1.031 10.033 -15.078 800 HG3 GLU 91 3HG GLU 91 -0.285 9.437 -13.598 801 H GLU 92 H GLU 92 -4.264 7.624 -14.793 802 HA GLU 92 HA GLU 92 -5.115 10.184 -13.955 803 HB2 GLU 92 2HB GLU 92 -6.753 7.806 -14.901 804 HB3 GLU 92 3HB GLU 92 -7.379 9.446 -14.736 805 HG2 GLU 92 2HG GLU 92 -5.156 8.574 -16.612 806 HG3 GLU 92 3HG GLU 92 -6.826 8.909 -17.067 807 H PHE 93 H PHE 93 -5.447 7.026 -12.531 808 HA PHE 93 HA PHE 93 -7.243 7.784 -10.401 809 HB2 PHE 93 2HB PHE 93 -7.207 5.512 -11.370 810 HB3 PHE 93 3HB PHE 93 -5.525 5.308 -10.906 811 HD1 PHE 93 HD1 PHE 93 -8.700 6.355 -9.163 812 HD2 PHE 93 HD2 PHE 93 -5.269 3.790 -9.155 813 HE1 PHE 93 HE1 PHE 93 -9.468 5.318 -7.070 814 HE2 PHE 93 HE2 PHE 93 -6.045 2.767 -7.063 815 HZ PHE 93 HZ PHE 93 -8.141 3.528 -6.022 816 H LYS 94 H LYS 94 -3.736 7.396 -10.820 817 HA LYS 94 HA LYS 94 -2.884 7.470 -8.142 818 HB2 LYS 94 2HB LYS 94 -1.290 6.748 -9.788 819 HB3 LYS 94 3HB LYS 94 -1.492 8.214 -10.745 820 HG2 LYS 94 2HG LYS 94 -0.416 9.527 -8.881 821 HG3 LYS 94 3HG LYS 94 -0.156 8.013 -8.021 822 HD2 LYS 94 2HD LYS 94 1.887 8.698 -9.125 823 HD3 LYS 94 3HD LYS 94 1.277 7.218 -9.868 824 HE2 LYS 94 2HE LYS 94 2.049 8.694 -11.616 825 HE3 LYS 94 3HE LYS 94 0.290 8.612 -11.710 826 HZ1 LYS 94 3HZ LYS 94 1.117 10.873 -11.988 827 HZ2 LYS 94 1HZ LYS 94 1.877 10.811 -10.480 828 HZ3 LYS 94 2HZ LYS 94 0.196 10.760 -10.573 829 H ARG 95 H ARG 95 -3.074 10.083 -10.567 830 HA ARG 95 HA ARG 95 -1.844 12.094 -9.068 831 HB2 ARG 95 2HB ARG 95 -2.746 13.660 -10.765 832 HB3 ARG 95 3HB ARG 95 -2.047 12.214 -11.488 833 HG2 ARG 95 2HG ARG 95 -4.359 11.275 -11.736 834 HG3 ARG 95 3HG ARG 95 -5.005 12.810 -11.144 835 HD2 ARG 95 2HD ARG 95 -3.940 13.981 -13.060 836 HD3 ARG 95 3HD ARG 95 -3.313 12.437 -13.642 837 HE ARG 95 HE ARG 95 -5.480 11.787 -14.266 838 HH11 ARG 95 1HH1 ARG 95 -5.477 15.047 -12.970 839 HH12 ARG 95 2HH1 ARG 95 -7.036 15.436 -13.625 840 HH21 ARG 95 1HH2 ARG 95 -7.502 12.318 -15.153 841 HH22 ARG 95 2HH2 ARG 95 -8.181 13.893 -14.861 842 H LYS 96 H LYS 96 -5.120 10.983 -8.967 843 HA LYS 96 HA LYS 96 -6.356 13.142 -7.591 844 HB2 LYS 96 2HB LYS 96 -7.036 10.170 -7.686 845 HB3 LYS 96 3HB LYS 96 -8.112 11.417 -7.076 846 HG2 LYS 96 2HG LYS 96 -8.173 12.467 -9.318 847 HG3 LYS 96 3HG LYS 96 -7.106 11.194 -9.932 848 HD2 LYS 96 2HD LYS 96 -8.819 9.491 -9.394 849 HD3 LYS 96 3HD LYS 96 -9.874 10.748 -8.739 850 HE2 LYS 96 2HE LYS 96 -9.936 11.802 -11.006 851 HE3 LYS 96 3HE LYS 96 -8.984 10.448 -11.624 852 HZ1 LYS 96 3HZ LYS 96 -11.665 10.235 -10.355 853 HZ2 LYS 96 1HZ LYS 96 -10.756 8.947 -10.970 854 HZ3 LYS 96 2HZ LYS 96 -11.348 10.138 -12.013 855 H ILE 97 H ILE 97 -5.021 10.042 -6.508 856 HA ILE 97 HA ILE 97 -5.376 10.343 -3.702 857 HB ILE 97 HB ILE 97 -3.355 8.591 -5.193 858 HG12 ILE 97 2HG1 ILE 97 -6.187 7.787 -4.365 859 HG13 ILE 97 3HG1 ILE 97 -5.770 8.325 -5.988 860 HG21 ILE 97 1HG2 ILE 97 -4.562 8.270 -2.424 861 HG22 ILE 97 2HG2 ILE 97 -2.891 8.705 -2.791 862 HG23 ILE 97 3HG2 ILE 97 -3.501 7.106 -3.215 863 HD11 ILE 97 3HD1 ILE 97 -5.882 5.925 -5.908 864 HD12 ILE 97 1HD1 ILE 97 -4.698 5.869 -4.599 865 HD13 ILE 97 2HD1 ILE 97 -4.220 6.430 -6.204 866 H GLU 98 H GLU 98 -2.777 11.030 -5.920 867 HA GLU 98 HA GLU 98 -0.642 11.494 -4.100 868 HB2 GLU 98 2HB GLU 98 -0.234 10.739 -6.356 869 HB3 GLU 98 3HB GLU 98 -1.109 12.100 -7.044 870 HG2 GLU 98 2HG GLU 98 0.671 13.630 -6.330 871 HG3 GLU 98 3HG GLU 98 1.526 12.291 -5.560 872 H SER 99 H SER 99 -3.152 13.482 -5.526 873 HA SER 99 HA SER 99 -2.043 16.043 -4.841 874 HB2 SER 99 2HB SER 99 -3.669 15.694 -6.708 875 HB3 SER 99 3HB SER 99 -4.915 15.287 -5.531 876 HG SER 99 HG SER 99 -3.855 17.750 -6.239 877 H GLN 100 H GLN 100 -3.764 13.590 -3.110 878 HA GLN 100 HA GLN 100 -4.780 15.306 -0.977 879 HB2 GLN 100 2HB GLN 100 -4.736 12.261 -1.204 880 HB3 GLN 100 3HB GLN 100 -5.624 13.189 0.005 881 HG2 GLN 100 2HG GLN 100 -7.088 14.113 -1.689 882 HG3 GLN 100 3HG GLN 100 -6.123 13.390 -2.977 883 HE21 GLN 100 1HE2 GLN 100 -7.838 12.246 -3.831 884 HE22 GLN 100 2HE2 GLN 100 -8.558 10.890 -3.037 885 H GLY 101 H GLY 101 -1.743 14.203 -1.691 886 HA2 GLY 101 2HA GLY 101 0.184 14.528 -0.448 887 HA3 GLY 101 3HA GLY 101 -0.780 14.740 1.004 888 H TYR 102 H TYR 102 -0.409 12.072 -1.344 889 HA TYR 102 HA TYR 102 0.681 10.320 0.798 890 HB2 TYR 102 2HB TYR 102 -1.078 9.542 -1.584 891 HB3 TYR 102 3HB TYR 102 -0.281 8.383 -0.528 892 HD1 TYR 102 HD1 TYR 102 -0.950 8.385 1.978 893 HD2 TYR 102 HD2 TYR 102 -3.253 10.354 -1.026 894 HE1 TYR 102 HE1 TYR 102 -2.906 8.362 3.459 895 HE2 TYR 102 HE2 TYR 102 -5.212 10.340 0.454 896 HH TYR 102 HH TYR 102 -5.011 9.550 3.773 897 H GLU 103 H GLU 103 2.586 9.193 0.252 898 HA GLU 103 HA GLU 103 4.040 9.989 -2.131 899 HB2 GLU 103 2HB GLU 103 5.309 9.681 -0.065 900 HB3 GLU 103 3HB GLU 103 4.717 8.038 0.119 901 HG2 GLU 103 2HG GLU 103 7.021 7.964 -0.600 902 HG3 GLU 103 3HG GLU 103 6.007 7.370 -1.908 903 H VAL 104 H VAL 104 2.954 9.194 -3.909 904 HA VAL 104 HA VAL 104 2.245 6.328 -4.028 905 HB VAL 104 HB VAL 104 1.210 8.544 -5.857 906 HG11 VAL 104 1HG1 VAL 104 1.050 6.256 -6.779 907 HG12 VAL 104 2HG1 VAL 104 -0.549 6.914 -6.432 908 HG13 VAL 104 3HG1 VAL 104 0.169 5.727 -5.341 909 HG21 VAL 104 3HG2 VAL 104 -0.859 8.576 -4.532 910 HG22 VAL 104 1HG2 VAL 104 0.525 9.040 -3.538 911 HG23 VAL 104 2HG2 VAL 104 -0.164 7.423 -3.388 912 H ARG 105 H ARG 105 3.282 5.047 -5.454 913 HA ARG 105 HA ARG 105 4.899 6.215 -7.665 914 HB2 ARG 105 2HB ARG 105 5.627 3.858 -5.859 915 HB3 ARG 105 3HB ARG 105 6.566 4.388 -7.250 916 HG2 ARG 105 2HG ARG 105 6.031 6.082 -4.784 917 HG3 ARG 105 3HG ARG 105 7.501 5.146 -5.055 918 HD2 ARG 105 2HD ARG 105 8.081 6.509 -6.968 919 HD3 ARG 105 3HD ARG 105 6.532 7.352 -6.901 920 HE ARG 105 HE ARG 105 7.647 7.840 -4.466 921 HH11 ARG 105 1HH1 ARG 105 8.721 8.381 -7.781 922 HH12 ARG 105 2HH1 ARG 105 9.665 9.780 -7.375 923 HH21 ARG 105 1HH2 ARG 105 8.809 9.710 -3.956 924 HH22 ARG 105 2HH2 ARG 105 9.713 10.538 -5.191 925 H LYS 106 H LYS 106 4.958 4.988 -9.606 926 HA LYS 106 HA LYS 106 2.921 2.838 -9.887 927 HB2 LYS 106 2HB LYS 106 3.910 4.935 -11.855 928 HB3 LYS 106 3HB LYS 106 3.012 3.516 -12.379 929 HG2 LYS 106 2HG LYS 106 1.078 4.209 -11.058 930 HG3 LYS 106 3HG LYS 106 1.972 5.594 -10.431 931 HD2 LYS 106 2HD LYS 106 0.418 6.255 -12.227 932 HD3 LYS 106 3HD LYS 106 2.089 6.583 -12.666 933 HE2 LYS 106 2HE LYS 106 0.652 4.090 -13.597 934 HE3 LYS 106 3HE LYS 106 0.546 5.612 -14.472 935 HZ1 LYS 106 3HZ LYS 106 2.256 4.409 -15.477 936 HZ2 LYS 106 1HZ LYS 106 2.951 3.950 -14.005 937 HZ3 LYS 106 2HZ LYS 106 3.050 5.551 -14.527 938 H VAL 107 H VAL 107 3.422 1.014 -11.154 939 HA VAL 107 HA VAL 107 5.999 0.609 -12.357 940 HB VAL 107 HB VAL 107 6.651 0.339 -10.010 941 HG11 VAL 107 1HG1 VAL 107 4.576 -1.861 -9.794 942 HG12 VAL 107 2HG1 VAL 107 4.480 -0.269 -9.044 943 HG13 VAL 107 3HG1 VAL 107 5.739 -1.400 -8.545 944 HG21 VAL 107 3HG2 VAL 107 7.795 -1.073 -11.649 945 HG22 VAL 107 1HG2 VAL 107 6.591 -2.345 -11.429 946 HG23 VAL 107 2HG2 VAL 107 7.668 -1.904 -10.099 947 H THR 108 H THR 108 6.022 -1.118 -13.742 948 HA THR 108 HA THR 108 3.657 -2.895 -13.932 949 HB THR 108 HB THR 108 4.683 -3.476 -16.238 950 HG1 THR 108 HG1 THR 108 6.758 -2.590 -15.878 951 HG21 THR 108 3HG2 THR 108 3.734 -0.623 -15.837 952 HG22 THR 108 1HG2 THR 108 2.689 -2.034 -16.055 953 HG23 THR 108 2HG2 THR 108 3.751 -1.506 -17.362 954 H ASP 109 H ASP 109 7.157 -2.819 -13.476 955 HA ASP 109 HA ASP 109 7.593 -5.593 -14.209 956 HB2 ASP 109 2HB ASP 109 9.555 -3.612 -12.961 957 HB3 ASP 109 3HB ASP 109 9.959 -5.128 -13.766 958 H ASP 110 H ASP 110 8.122 -7.274 -12.814 959 HA ASP 110 HA ASP 110 6.945 -7.189 -10.223 960 HB2 ASP 110 2HB ASP 110 7.482 -9.558 -10.075 961 HB3 ASP 110 3HB ASP 110 6.836 -9.199 -11.664 962 H GLU 111 H GLU 111 10.318 -7.327 -11.368 963 HA GLU 111 HA GLU 111 11.586 -7.516 -8.834 964 HB2 GLU 111 2HB GLU 111 12.531 -6.507 -11.539 965 HB3 GLU 111 3HB GLU 111 13.579 -6.425 -10.128 966 HG2 GLU 111 2HG GLU 111 12.358 -8.982 -11.198 967 HG3 GLU 111 3HG GLU 111 13.976 -8.406 -11.600 968 H GLU 112 H GLU 112 10.751 -4.751 -10.908 969 HA GLU 112 HA GLU 112 11.986 -2.766 -9.338 970 HB2 GLU 112 2HB GLU 112 11.381 -2.561 -11.764 971 HB3 GLU 112 3HB GLU 112 9.693 -2.419 -11.300 972 HG2 GLU 112 2HG GLU 112 10.656 -0.228 -11.808 973 HG3 GLU 112 3HG GLU 112 10.181 -0.319 -10.109 974 H ALA 113 H ALA 113 8.700 -4.103 -9.301 975 HA ALA 113 HA ALA 113 7.404 -2.301 -7.605 976 HB1 ALA 113 3HB ALA 113 5.878 -4.165 -7.061 977 HB2 ALA 113 1HB ALA 113 7.024 -5.312 -7.777 978 HB3 ALA 113 2HB ALA 113 6.227 -4.109 -8.789 979 H LEU 114 H LEU 114 9.303 -5.213 -6.823 980 HA LEU 114 HA LEU 114 9.101 -5.151 -4.009 981 HB2 LEU 114 2HB LEU 114 11.407 -6.225 -5.688 982 HB3 LEU 114 3HB LEU 114 11.082 -6.638 -4.008 983 HG LEU 114 HG LEU 114 9.239 -7.318 -6.334 984 HD11 LEU 114 1HD1 LEU 114 11.343 -8.535 -6.526 985 HD12 LEU 114 2HD1 LEU 114 10.028 -9.622 -6.085 986 HD13 LEU 114 3HD1 LEU 114 11.192 -9.106 -4.860 987 HD21 LEU 114 3HD2 LEU 114 9.151 -8.198 -3.430 988 HD22 LEU 114 1HD2 LEU 114 8.108 -8.800 -4.722 989 HD23 LEU 114 2HD2 LEU 114 8.016 -7.110 -4.236 990 H LYS 115 H LYS 115 11.339 -3.580 -6.267 991 HA LYS 115 HA LYS 115 13.294 -2.680 -4.424 992 HB2 LYS 115 2HB LYS 115 12.558 -1.358 -7.079 993 HB3 LYS 115 3HB LYS 115 14.068 -1.155 -6.194 994 HG2 LYS 115 2HG LYS 115 13.081 -3.657 -7.575 995 HG3 LYS 115 3HG LYS 115 14.424 -2.633 -8.076 996 HD2 LYS 115 2HD LYS 115 15.707 -3.309 -6.075 997 HD3 LYS 115 3HD LYS 115 14.342 -4.277 -5.504 998 HE2 LYS 115 2HE LYS 115 16.023 -5.719 -6.549 999 HE3 LYS 115 3HE LYS 115 14.549 -5.727 -7.516 1000 HZ1 LYS 115 3HZ LYS 115 17.001 -4.152 -8.092 1001 HZ2 LYS 115 1HZ LYS 115 15.590 -4.133 -9.016 1002 HZ3 LYS 115 2HZ LYS 115 16.507 -5.547 -8.906 1003 H ILE 116 H ILE 116 10.335 -1.157 -5.695 1004 HA ILE 116 HA ILE 116 10.703 1.359 -4.399 1005 HB ILE 116 HB ILE 116 8.085 0.170 -5.426 1006 HG12 ILE 116 2HG1 ILE 116 9.734 0.226 -7.251 1007 HG13 ILE 116 3HG1 ILE 116 8.520 1.463 -7.524 1008 HG21 ILE 116 1HG2 ILE 116 7.714 2.080 -3.931 1009 HG22 ILE 116 2HG2 ILE 116 7.315 2.506 -5.593 1010 HG23 ILE 116 3HG2 ILE 116 8.828 3.069 -4.882 1011 HD11 ILE 116 3HD1 ILE 116 10.747 2.227 -8.108 1012 HD12 ILE 116 1HD1 ILE 116 11.315 1.930 -6.465 1013 HD13 ILE 116 2HD1 ILE 116 10.102 3.180 -6.772 1014 H VAL 117 H VAL 117 9.149 -1.674 -3.424 1015 HA VAL 117 HA VAL 117 7.925 -0.797 -1.016 1016 HB VAL 117 HB VAL 117 9.146 -3.553 -1.568 1017 HG11 VAL 117 1HG1 VAL 117 7.022 -2.737 0.455 1018 HG12 VAL 117 2HG1 VAL 117 8.683 -3.204 0.827 1019 HG13 VAL 117 3HG1 VAL 117 7.567 -4.388 0.145 1020 HG21 VAL 117 3HG2 VAL 117 6.302 -2.597 -2.053 1021 HG22 VAL 117 1HG2 VAL 117 6.887 -4.250 -2.269 1022 HG23 VAL 117 2HG2 VAL 117 7.500 -2.955 -3.294 1023 H ARG 118 H ARG 118 11.194 -2.000 -1.761 1024 HA ARG 118 HA ARG 118 12.303 -1.865 0.849 1025 HB2 ARG 118 2HB ARG 118 13.716 -1.720 -1.847 1026 HB3 ARG 118 3HB ARG 118 14.521 -1.983 -0.300 1027 HG2 ARG 118 2HG ARG 118 13.346 -4.114 -0.018 1028 HG3 ARG 118 3HG ARG 118 12.451 -3.841 -1.515 1029 HD2 ARG 118 2HD ARG 118 14.244 -5.386 -1.985 1030 HD3 ARG 118 3HD ARG 118 14.640 -3.849 -2.751 1031 HE ARG 118 HE ARG 118 16.364 -3.523 -1.218 1032 HH11 ARG 118 1HH1 ARG 118 14.698 -6.546 -0.491 1033 HH12 ARG 118 2HH1 ARG 118 15.971 -7.122 0.548 1034 HH21 ARG 118 1HH2 ARG 118 18.002 -4.299 0.138 1035 HH22 ARG 118 2HH2 ARG 118 17.833 -5.848 0.900 1036 H GLU 119 H GLU 119 11.922 0.522 -1.713 1037 HA GLU 119 HA GLU 119 13.521 2.591 -0.611 1038 HB2 GLU 119 2HB GLU 119 11.141 2.669 -2.516 1039 HB3 GLU 119 3HB GLU 119 12.053 4.109 -2.074 1040 HG2 GLU 119 2HG GLU 119 13.200 1.671 -3.473 1041 HG3 GLU 119 3HG GLU 119 12.738 3.176 -4.266 1042 H PHE 120 H PHE 120 10.027 1.867 -0.394 1043 HA PHE 120 HA PHE 120 9.275 3.992 1.280 1044 HB2 PHE 120 2HB PHE 120 8.025 1.246 0.860 1045 HB3 PHE 120 3HB PHE 120 7.268 2.506 1.835 1046 HD1 PHE 120 HD2 PHE 120 8.525 4.660 -0.393 1047 HD2 PHE 120 HD1 PHE 120 5.846 1.310 -0.412 1048 HE1 PHE 120 HE2 PHE 120 7.376 5.581 -2.362 1049 HE2 PHE 120 HE1 PHE 120 4.720 2.253 -2.372 1050 HZ PHE 120 HZ PHE 120 5.465 4.376 -3.345 1051 H MET 121 H MET 121 10.413 0.729 2.087 1052 HA MET 121 HA MET 121 10.148 0.945 4.894 1053 HB2 MET 121 2HB MET 121 11.910 -0.870 3.191 1054 HB3 MET 121 3HB MET 121 11.750 -1.025 4.937 1055 HG2 MET 121 2HG MET 121 9.276 -1.353 4.611 1056 HG3 MET 121 3HG MET 121 9.565 -1.398 2.873 1057 HE1 MET 121 3HE MET 121 11.483 -4.754 2.387 1058 HE2 MET 121 1HE MET 121 12.151 -3.121 2.402 1059 HE3 MET 121 2HE MET 121 10.616 -3.441 1.589 1060 H GLN 122 H GLN 122 12.755 1.868 2.689 1061 HA GLN 122 HA GLN 122 14.750 2.516 4.601 1062 HB2 GLN 122 2HB GLN 122 15.012 2.214 2.064 1063 HB3 GLN 122 3HB GLN 122 14.369 3.832 1.874 1064 HG2 GLN 122 2HG GLN 122 16.890 3.179 3.424 1065 HG3 GLN 122 3HG GLN 122 16.881 3.624 1.728 1066 HE21 GLN 122 1HE2 GLN 122 16.278 5.784 1.184 1067 HE22 GLN 122 2HE2 GLN 122 16.467 7.069 2.323 1068 H LYS 123 H LYS 123 12.305 4.476 2.937 1069 HA LYS 123 HA LYS 123 12.948 6.999 3.998 1070 HB2 LYS 123 2HB LYS 123 10.238 5.979 3.021 1071 HB3 LYS 123 3HB LYS 123 10.667 7.676 3.239 1072 HG2 LYS 123 2HG LYS 123 12.225 7.613 1.421 1073 HG3 LYS 123 3HG LYS 123 12.139 5.852 1.322 1074 HD2 LYS 123 2HD LYS 123 9.712 6.069 0.669 1075 HD3 LYS 123 3HD LYS 123 9.922 7.821 0.633 1076 HE2 LYS 123 2HE LYS 123 11.313 5.782 -1.130 1077 HE3 LYS 123 3HE LYS 123 10.085 6.950 -1.621 1078 HZ1 LYS 123 3HZ LYS 123 12.843 7.539 -0.713 1079 HZ2 LYS 123 1HZ LYS 123 11.669 8.720 -0.982 1080 HZ3 LYS 123 2HZ LYS 123 12.208 7.761 -2.261 1081 H ALA 124 H ALA 124 10.519 4.583 4.931 1082 HA ALA 124 HA ALA 124 9.379 5.868 7.150 1083 HB1 ALA 124 3HB ALA 124 8.333 3.954 6.008 1084 HB2 ALA 124 1HB ALA 124 8.508 3.636 7.735 1085 HB3 ALA 124 2HB ALA 124 9.619 2.888 6.582 1086 H GLY 125 H GLY 125 12.183 3.687 6.845 1087 HA2 GLY 125 2HA GLY 125 12.740 3.326 9.617 1088 HA3 GLY 125 3HA GLY 125 13.855 3.048 8.288 1089 H SER 126 H SER 126 13.471 5.916 7.384 1090 HA SER 126 HA SER 126 15.471 7.193 9.048 1091 HB2 SER 126 2HB SER 126 13.933 8.262 6.640 1092 HB3 SER 126 3HB SER 126 15.351 9.017 7.381 1093 HG SER 126 HG SER 126 15.216 6.485 6.105 1094 H LEU 127 H LEU 127 11.996 7.364 8.514 1095 HA LEU 127 HA LEU 127 11.522 9.753 10.083 1096 HB2 LEU 127 2HB LEU 127 9.541 7.634 9.154 1097 HB3 LEU 127 3HB LEU 127 9.131 9.228 9.770 1098 HG LEU 127 HG LEU 127 10.568 8.649 7.149 1099 HD11 LEU 127 1HD1 LEU 127 7.738 9.605 7.645 1100 HD12 LEU 127 2HD1 LEU 127 8.224 8.009 7.067 1101 HD13 LEU 127 3HD1 LEU 127 8.514 9.430 6.067 1102 HD21 LEU 127 3HD2 LEU 127 11.355 10.767 8.069 1103 HD22 LEU 127 1HD2 LEU 127 9.693 11.325 8.286 1104 HD23 LEU 127 2HD2 LEU 127 10.334 11.051 6.663 1105 H GLU 128 H GLU 128 11.988 6.438 10.699 1106 HA GLU 128 HA GLU 128 10.678 6.163 13.219 1107 HB2 GLU 128 2HB GLU 128 12.715 4.555 11.643 1108 HB3 GLU 128 3HB GLU 128 12.353 4.116 13.307 1109 HG2 GLU 128 2HG GLU 128 10.278 4.303 11.112 1110 HG3 GLU 128 3HG GLU 128 11.072 2.812 11.625 1111 H HIS 129 H HIS 129 13.417 7.955 12.397 1112 HA HIS 129 HA HIS 129 15.129 7.357 14.614 1113 HB2 HIS 129 2HB HIS 129 16.022 8.328 12.513 1114 HB3 HIS 129 3HB HIS 129 15.126 9.816 12.797 1115 HD1 HIS 129 HD1 HIS 129 16.189 11.538 14.299 1116 HD2 HIS 129 HD2 HIS 129 18.203 7.906 14.377 1117 HE1 HIS 129 HE1 HIS 129 18.281 11.958 15.623 1118 HE2 HIS 129 HE2 HIS 129 19.466 9.741 15.675 1119 H HIS 130 H HIS 130 13.603 7.402 16.275 1120 HA HIS 130 HA HIS 130 13.878 9.286 18.174 1121 HB2 HIS 130 2HB HIS 130 12.382 10.806 16.740 1122 HB3 HIS 130 3HB HIS 130 11.058 9.684 17.027 1123 HD1 HIS 130 HD1 HIS 130 9.825 9.907 19.265 1124 HD2 HIS 130 HD2 HIS 130 13.295 12.189 19.090 1125 HE1 HIS 130 HE1 HIS 130 9.832 11.301 21.353 1126 HE2 HIS 130 HE2 HIS 130 11.880 12.749 21.167 1127 H HIS 131 H HIS 131 11.503 7.146 16.674 1128 HA HIS 131 HA HIS 131 10.498 5.851 18.961 1129 HB2 HIS 131 2HB HIS 131 9.328 5.418 16.927 1130 HB3 HIS 131 3HB HIS 131 10.801 4.996 16.059 1131 HD1 HIS 131 HD1 HIS 131 11.356 2.579 15.903 1132 HD2 HIS 131 HD2 HIS 131 8.541 3.310 18.865 1133 HE1 HIS 131 HE1 HIS 131 10.682 0.325 16.762 1134 HE2 HIS 131 HE2 HIS 131 9.134 0.805 18.676 1135 H HIS 132 H HIS 132 11.411 4.447 20.299 1136 HA HIS 132 HA HIS 132 14.209 3.749 20.052 1137 HB2 HIS 132 2HB HIS 132 12.177 3.233 22.267 1138 HB3 HIS 132 3HB HIS 132 13.889 2.836 22.368 1139 HD1 HIS 132 HD1 HIS 132 12.511 4.802 24.341 1140 HD2 HIS 132 HD2 HIS 132 14.615 5.952 20.952 1141 HE1 HIS 132 HE1 HIS 132 13.259 7.165 24.775 1142 HE2 HIS 132 HE2 HIS 132 14.722 7.726 22.807 1143 H HIS 133 H HIS 133 14.577 2.159 18.684 1144 HA HIS 133 HA HIS 133 13.187 -0.462 18.911 1145 HB2 HIS 133 2HB HIS 133 12.898 0.627 16.686 1146 HB3 HIS 133 3HB HIS 133 14.636 0.785 16.516 1147 HD1 HIS 133 HD1 HIS 133 15.974 -1.386 15.949 1148 HD2 HIS 133 HD2 HIS 133 11.848 -1.884 16.034 1149 HE1 HIS 133 HE1 HIS 133 15.529 -3.555 14.764 1150 HE2 HIS 133 HE2 HIS 133 13.049 -3.894 14.959 1151 H HIS 134 H HIS 134 14.546 -2.280 19.213 1152 HA HIS 134 HA HIS 134 17.390 -1.752 19.744 1153 HB2 HIS 134 2HB HIS 134 15.967 -3.058 21.424 1154 HB3 HIS 134 3HB HIS 134 15.908 -4.375 20.249 1155 HD1 HIS 134 HD1 HIS 134 18.234 -2.579 22.586 1156 HD2 HIS 134 HD2 HIS 134 18.330 -5.846 20.018 1157 HE1 HIS 134 HE1 HIS 134 20.411 -3.736 23.046 1158 HE2 HIS 134 HE2 HIS 134 20.535 -5.563 21.331 Start of MODEL 16 1 H1 MET 1 1H MET 1 -0.479 7.100 14.835 2 H2 MET 1 2H MET 1 -0.924 8.168 13.612 3 H3 MET 1 3H MET 1 -0.764 8.720 15.198 4 HA MET 1 HA MET 1 1.088 9.364 13.832 5 HB2 MET 1 2HB MET 1 1.470 9.110 16.231 6 HB3 MET 1 3HB MET 1 1.656 7.374 16.064 7 HG2 MET 1 2HG MET 1 3.603 9.312 14.811 8 HG3 MET 1 3HG MET 1 3.785 8.714 16.458 9 HE1 MET 1 3HE MET 1 6.056 8.358 14.152 10 HE2 MET 1 1HE MET 1 6.539 6.690 14.446 11 HE3 MET 1 2HE MET 1 6.255 7.779 15.808 12 H LYS 2 H LYS 2 0.534 5.907 13.917 13 HA LYS 2 HA LYS 2 2.983 4.969 13.051 14 HB2 LYS 2 2HB LYS 2 1.796 2.842 12.533 15 HB3 LYS 2 3HB LYS 2 1.431 3.495 14.124 16 HG2 LYS 2 2HG LYS 2 -0.737 4.339 13.308 17 HG3 LYS 2 3HG LYS 2 -0.381 3.722 11.693 18 HD2 LYS 2 2HD LYS 2 -0.605 2.011 14.201 19 HD3 LYS 2 3HD LYS 2 -1.884 2.214 13.003 20 HE2 LYS 2 2HE LYS 2 -0.690 1.038 11.348 21 HE3 LYS 2 3HE LYS 2 0.848 1.196 12.196 22 HZ1 LYS 2 3HZ LYS 2 -1.445 -0.479 13.061 23 HZ2 LYS 2 1HZ LYS 2 0.011 -0.302 13.889 24 HZ3 LYS 2 2HZ LYS 2 0.001 -1.021 12.380 25 H ILE 3 H ILE 3 3.767 4.118 11.198 26 HA ILE 3 HA ILE 3 2.923 5.366 8.694 27 HB ILE 3 HB ILE 3 5.489 3.894 9.459 28 HG12 ILE 3 2HG1 ILE 3 4.947 6.868 9.016 29 HG13 ILE 3 3HG1 ILE 3 5.231 6.095 10.568 30 HG21 ILE 3 1HG2 ILE 3 4.844 5.309 6.844 31 HG22 ILE 3 2HG2 ILE 3 5.056 3.571 7.062 32 HG23 ILE 3 3HG2 ILE 3 6.423 4.662 7.293 33 HD11 ILE 3 3HD1 ILE 3 7.521 5.563 9.867 34 HD12 ILE 3 1HD1 ILE 3 7.178 7.292 9.845 35 HD13 ILE 3 2HD1 ILE 3 7.229 6.389 8.333 36 H LEU 4 H LEU 4 1.691 4.205 7.310 37 HA LEU 4 HA LEU 4 1.879 1.253 7.264 38 HB2 LEU 4 2HB LEU 4 -0.201 2.986 5.858 39 HB3 LEU 4 3HB LEU 4 -0.199 1.232 5.979 40 HG LEU 4 HG LEU 4 -0.680 3.175 8.270 41 HD11 LEU 4 1HD1 LEU 4 -2.564 3.057 6.701 42 HD12 LEU 4 2HD1 LEU 4 -2.978 2.306 8.239 43 HD13 LEU 4 3HD1 LEU 4 -2.596 1.294 6.842 44 HD21 LEU 4 3HD2 LEU 4 -0.686 0.142 8.275 45 HD22 LEU 4 1HD2 LEU 4 -1.221 1.174 9.604 46 HD23 LEU 4 2HD2 LEU 4 0.466 1.199 9.099 47 H ILE 5 H ILE 5 2.512 0.217 5.401 48 HA ILE 5 HA ILE 5 3.313 1.855 3.068 49 HB ILE 5 HB ILE 5 4.017 -1.072 3.601 50 HG12 ILE 5 2HG1 ILE 5 5.055 0.261 5.392 51 HG13 ILE 5 3HG1 ILE 5 6.296 -0.308 4.288 52 HG21 ILE 5 1HG2 ILE 5 5.747 -0.732 1.859 53 HG22 ILE 5 2HG2 ILE 5 5.170 0.917 1.612 54 HG23 ILE 5 3HG2 ILE 5 4.118 -0.451 1.237 55 HD11 ILE 5 3HD1 ILE 5 5.159 2.483 4.434 56 HD12 ILE 5 1HD1 ILE 5 6.358 1.939 3.258 57 HD13 ILE 5 2HD1 ILE 5 6.748 1.948 4.976 58 H LEU 6 H LEU 6 1.583 2.025 1.763 59 HA LEU 6 HA LEU 6 -0.524 -0.019 1.717 60 HB2 LEU 6 2HB LEU 6 -0.735 2.688 1.924 61 HB3 LEU 6 3HB LEU 6 -0.704 2.598 0.181 62 HG LEU 6 HG LEU 6 -3.002 2.730 0.888 63 HD11 LEU 6 1HD1 LEU 6 -2.678 1.215 -0.998 64 HD12 LEU 6 2HD1 LEU 6 -4.038 0.701 -0.006 65 HD13 LEU 6 3HD1 LEU 6 -2.495 -0.157 0.098 66 HD21 LEU 6 3HD2 LEU 6 -4.039 1.161 2.465 67 HD22 LEU 6 1HD2 LEU 6 -2.720 2.059 3.210 68 HD23 LEU 6 2HD2 LEU 6 -2.481 0.379 2.729 69 H ILE 7 H ILE 7 -0.307 -1.518 0.129 70 HA ILE 7 HA ILE 7 0.820 -0.732 -2.494 71 HB ILE 7 HB ILE 7 1.276 -3.392 -1.051 72 HG12 ILE 7 2HG1 ILE 7 3.248 -1.159 -1.738 73 HG13 ILE 7 3HG1 ILE 7 2.625 -1.508 -0.130 74 HG21 ILE 7 1HG2 ILE 7 2.277 -2.501 -3.787 75 HG22 ILE 7 2HG2 ILE 7 1.059 -3.741 -3.486 76 HG23 ILE 7 3HG2 ILE 7 2.725 -4.000 -2.969 77 HD11 ILE 7 3HD1 ILE 7 4.850 -2.343 -0.385 78 HD12 ILE 7 1HD1 ILE 7 4.375 -3.307 -1.783 79 HD13 ILE 7 2HD1 ILE 7 3.722 -3.681 -0.185 80 H ASN 8 H ASN 8 -0.671 -0.917 -4.007 81 HA ASN 8 HA ASN 8 -2.626 -3.134 -3.931 82 HB2 ASN 8 2HB ASN 8 -3.675 -0.875 -3.958 83 HB3 ASN 8 3HB ASN 8 -2.786 -0.469 -5.419 84 HD21 ASN 8 1HD2 ASN 8 -3.319 -1.651 -7.374 85 HD22 ASN 8 2HD2 ASN 8 -4.886 -2.344 -7.569 86 H THR 9 H THR 9 -1.808 -4.718 -5.140 87 HA THR 9 HA THR 9 -0.699 -4.069 -7.807 88 HB THR 9 HB THR 9 1.163 -4.809 -6.371 89 HG1 THR 9 HG1 THR 9 1.914 -5.826 -8.046 90 HG21 THR 9 3HG2 THR 9 1.296 -7.093 -5.458 91 HG22 THR 9 1HG2 THR 9 -0.366 -7.408 -5.970 92 HG23 THR 9 2HG2 THR 9 -0.038 -6.201 -4.724 93 H ASN 10 H ASN 10 -1.430 -5.343 -9.482 94 HA ASN 10 HA ASN 10 -3.771 -7.015 -9.079 95 HB2 ASN 10 2HB ASN 10 -3.616 -5.504 -11.043 96 HB3 ASN 10 3HB ASN 10 -2.161 -6.329 -11.587 97 HD21 ASN 10 1HD2 ASN 10 -2.366 -8.414 -12.530 98 HD22 ASN 10 2HD2 ASN 10 -3.882 -9.008 -13.103 99 H ASN 11 H ASN 11 -0.381 -7.325 -9.270 100 HA ASN 11 HA ASN 11 -0.222 -9.960 -10.419 101 HB2 ASN 11 2HB ASN 11 1.903 -8.144 -9.206 102 HB3 ASN 11 3HB ASN 11 2.237 -9.680 -10.002 103 HD21 ASN 11 1HD2 ASN 11 3.511 -8.678 -11.564 104 HD22 ASN 11 2HD2 ASN 11 2.840 -7.730 -12.842 105 H ASP 12 H ASP 12 -0.656 -11.711 -9.300 106 HA ASP 12 HA ASP 12 -0.935 -12.057 -6.542 107 HB2 ASP 12 2HB ASP 12 -0.305 -14.187 -8.645 108 HB3 ASP 12 3HB ASP 12 -0.941 -14.506 -7.033 109 H GLU 13 H GLU 13 1.822 -12.598 -8.655 110 HA GLU 13 HA GLU 13 3.568 -13.914 -6.895 111 HB2 GLU 13 2HB GLU 13 4.189 -12.085 -9.253 112 HB3 GLU 13 3HB GLU 13 5.386 -13.085 -8.432 113 HG2 GLU 13 2HG GLU 13 4.197 -15.118 -9.118 114 HG3 GLU 13 3HG GLU 13 2.941 -14.138 -9.873 115 H LEU 14 H LEU 14 3.059 -10.435 -7.538 116 HA LEU 14 HA LEU 14 5.273 -9.533 -6.007 117 HB2 LEU 14 2HB LEU 14 2.920 -8.154 -7.273 118 HB3 LEU 14 3HB LEU 14 3.772 -7.283 -6.008 119 HG LEU 14 HG LEU 14 4.639 -6.647 -8.202 120 HD11 LEU 14 1HD1 LEU 14 6.704 -8.276 -6.664 121 HD12 LEU 14 2HD1 LEU 14 6.199 -6.626 -6.286 122 HD13 LEU 14 3HD1 LEU 14 7.028 -6.963 -7.801 123 HD21 LEU 14 3HD2 LEU 14 5.766 -8.205 -9.689 124 HD22 LEU 14 1HD2 LEU 14 4.115 -8.742 -9.414 125 HD23 LEU 14 2HD2 LEU 14 5.450 -9.549 -8.591 126 H ILE 15 H ILE 15 1.918 -10.171 -5.171 127 HA ILE 15 HA ILE 15 1.758 -9.016 -2.641 128 HB ILE 15 HB ILE 15 0.617 -11.715 -3.514 129 HG12 ILE 15 2HG1 ILE 15 -0.699 -8.957 -3.611 130 HG13 ILE 15 3HG1 ILE 15 -0.055 -9.822 -5.004 131 HG21 ILE 15 1HG2 ILE 15 -1.079 -11.416 -1.742 132 HG22 ILE 15 2HG2 ILE 15 -0.280 -9.935 -1.215 133 HG23 ILE 15 3HG2 ILE 15 0.552 -11.483 -1.065 134 HD11 ILE 15 3HD1 ILE 15 -2.448 -10.018 -4.903 135 HD12 ILE 15 1HD1 ILE 15 -2.364 -10.703 -3.282 136 HD13 ILE 15 2HD1 ILE 15 -1.706 -11.597 -4.656 137 H LYS 16 H LYS 16 2.610 -12.419 -3.335 138 HA LYS 16 HA LYS 16 3.314 -13.069 -0.682 139 HB2 LYS 16 2HB LYS 16 4.071 -15.230 -1.631 140 HB3 LYS 16 3HB LYS 16 2.489 -14.746 -2.227 141 HG2 LYS 16 2HG LYS 16 3.654 -13.885 -4.325 142 HG3 LYS 16 3HG LYS 16 5.122 -14.662 -3.725 143 HD2 LYS 16 2HD LYS 16 4.011 -16.126 -5.337 144 HD3 LYS 16 3HD LYS 16 3.939 -16.861 -3.732 145 HE2 LYS 16 2HE LYS 16 1.612 -16.068 -3.487 146 HE3 LYS 16 3HE LYS 16 1.693 -15.329 -5.087 147 HZ1 LYS 16 3HZ LYS 16 0.599 -17.461 -5.168 148 HZ2 LYS 16 1HZ LYS 16 1.941 -18.234 -4.501 149 HZ3 LYS 16 2HZ LYS 16 2.041 -17.532 -6.036 150 H LYS 17 H LYS 17 5.297 -12.015 -3.416 151 HA LYS 17 HA LYS 17 7.852 -12.603 -2.313 152 HB2 LYS 17 2HB LYS 17 6.979 -10.638 -4.470 153 HB3 LYS 17 3HB LYS 17 8.671 -10.887 -4.038 154 HG2 LYS 17 2HG LYS 17 8.597 -13.202 -4.745 155 HG3 LYS 17 3HG LYS 17 6.846 -13.130 -4.964 156 HD2 LYS 17 2HD LYS 17 7.987 -13.046 -7.138 157 HD3 LYS 17 3HD LYS 17 7.133 -11.534 -6.832 158 HE2 LYS 17 2HE LYS 17 9.232 -10.429 -6.250 159 HE3 LYS 17 3HE LYS 17 10.113 -11.951 -6.411 160 HZ1 LYS 17 3HZ LYS 17 10.321 -10.494 -8.369 161 HZ2 LYS 17 1HZ LYS 17 8.656 -10.616 -8.634 162 HZ3 LYS 17 2HZ LYS 17 9.632 -11.991 -8.746 163 H ILE 18 H ILE 18 5.955 -9.569 -2.408 164 HA ILE 18 HA ILE 18 7.763 -7.937 -0.946 165 HB ILE 18 HB ILE 18 4.753 -7.676 -1.428 166 HG12 ILE 18 2HG1 ILE 18 7.085 -6.103 -2.632 167 HG13 ILE 18 3HG1 ILE 18 6.278 -7.452 -3.420 168 HG21 ILE 18 1HG2 ILE 18 6.548 -5.592 -0.140 169 HG22 ILE 18 2HG2 ILE 18 5.253 -6.487 0.661 170 HG23 ILE 18 3HG2 ILE 18 4.871 -5.351 -0.630 171 HD11 ILE 18 3HD1 ILE 18 5.517 -5.349 -4.324 172 HD12 ILE 18 1HD1 ILE 18 5.011 -4.799 -2.725 173 HD13 ILE 18 2HD1 ILE 18 4.194 -6.163 -3.492 174 H LYS 19 H LYS 19 5.138 -10.116 0.071 175 HA LYS 19 HA LYS 19 4.812 -9.379 2.742 176 HB2 LYS 19 2HB LYS 19 4.612 -12.160 1.495 177 HB3 LYS 19 3HB LYS 19 4.100 -11.789 3.141 178 HG2 LYS 19 2HG LYS 19 2.434 -10.204 2.279 179 HG3 LYS 19 3HG LYS 19 2.960 -10.538 0.640 180 HD2 LYS 19 2HD LYS 19 0.973 -11.810 0.962 181 HD3 LYS 19 3HD LYS 19 2.301 -12.965 1.023 182 HE2 LYS 19 2HE LYS 19 2.175 -13.017 3.468 183 HE3 LYS 19 3HE LYS 19 0.917 -11.779 3.450 184 HZ1 LYS 19 3HZ LYS 19 0.652 -14.470 2.211 185 HZ2 LYS 19 1HZ LYS 19 -0.548 -13.289 2.309 186 HZ3 LYS 19 2HZ LYS 19 0.013 -14.027 3.717 187 H LYS 20 H LYS 20 7.188 -11.618 1.321 188 HA LYS 20 HA LYS 20 8.315 -12.404 3.859 189 HB2 LYS 20 2HB LYS 20 9.515 -12.808 1.089 190 HB3 LYS 20 3HB LYS 20 9.877 -13.727 2.544 191 HG2 LYS 20 2HG LYS 20 7.275 -13.743 0.993 192 HG3 LYS 20 3HG LYS 20 8.471 -15.029 1.029 193 HD2 LYS 20 2HD LYS 20 6.849 -14.105 3.435 194 HD3 LYS 20 3HD LYS 20 6.444 -15.488 2.418 195 HE2 LYS 20 2HE LYS 20 8.959 -15.192 4.088 196 HE3 LYS 20 3HE LYS 20 7.576 -16.213 4.467 197 HZ1 LYS 20 3HZ LYS 20 9.299 -17.542 3.505 198 HZ2 LYS 20 1HZ LYS 20 9.424 -16.530 2.157 199 HZ3 LYS 20 2HZ LYS 20 8.031 -17.451 2.395 200 H GLU 21 H GLU 21 9.334 -10.326 1.176 201 HA GLU 21 HA GLU 21 11.748 -9.292 1.907 202 HB2 GLU 21 2HB GLU 21 9.350 -7.813 0.766 203 HB3 GLU 21 3HB GLU 21 10.939 -7.075 0.883 204 HG2 GLU 21 2HG GLU 21 10.340 -9.581 -0.707 205 HG3 GLU 21 3HG GLU 21 10.352 -7.954 -1.380 206 H VAL 22 H VAL 22 8.612 -8.083 3.037 207 HA VAL 22 HA VAL 22 9.837 -6.024 4.691 208 HB VAL 22 HB VAL 22 7.618 -5.123 4.982 209 HG11 VAL 22 1HG1 VAL 22 7.975 -6.116 2.127 210 HG12 VAL 22 2HG1 VAL 22 8.730 -4.689 2.835 211 HG13 VAL 22 3HG1 VAL 22 6.989 -4.744 2.628 212 HG21 VAL 22 3HG2 VAL 22 5.573 -6.223 4.100 213 HG22 VAL 22 1HG2 VAL 22 6.324 -7.163 5.392 214 HG23 VAL 22 2HG2 VAL 22 6.519 -7.664 3.713 215 H GLU 23 H GLU 23 8.372 -9.152 5.116 216 HA GLU 23 HA GLU 23 7.806 -9.182 7.863 217 HB2 GLU 23 2HB GLU 23 7.167 -10.990 6.308 218 HB3 GLU 23 3HB GLU 23 8.856 -11.411 6.060 219 HG2 GLU 23 2HG GLU 23 9.011 -12.107 8.436 220 HG3 GLU 23 3HG GLU 23 7.310 -11.700 8.656 221 H ASN 24 H ASN 24 10.807 -9.741 6.086 222 HA ASN 24 HA ASN 24 12.514 -10.327 8.296 223 HB2 ASN 24 2HB ASN 24 13.152 -9.328 5.476 224 HB3 ASN 24 3HB ASN 24 14.373 -9.846 6.640 225 HD21 ASN 24 1HD2 ASN 24 13.655 -10.939 3.987 226 HD22 ASN 24 2HD2 ASN 24 13.323 -12.612 4.255 227 H GLN 25 H GLN 25 11.392 -7.351 6.845 228 HA GLN 25 HA GLN 25 13.363 -5.654 8.180 229 HB2 GLN 25 2HB GLN 25 11.019 -4.963 6.350 230 HB3 GLN 25 3HB GLN 25 12.203 -3.808 6.953 231 HG2 GLN 25 2HG GLN 25 12.809 -6.160 5.145 232 HG3 GLN 25 3HG GLN 25 12.645 -4.487 4.630 233 HE21 GLN 25 1HE2 GLN 25 14.122 -3.373 6.893 234 HE22 GLN 25 2HE2 GLN 25 15.776 -3.781 6.634 235 H GLY 26 H GLY 26 10.632 -7.139 9.313 236 HA2 GLY 26 2HA GLY 26 9.549 -6.825 11.331 237 HA3 GLY 26 3HA GLY 26 10.372 -5.291 11.520 238 H TYR 27 H TYR 27 8.618 -5.700 8.594 239 HA TYR 27 HA TYR 27 6.455 -3.932 9.527 240 HB2 TYR 27 2HB TYR 27 7.480 -4.555 6.717 241 HB3 TYR 27 3HB TYR 27 5.994 -3.658 7.014 242 HD1 TYR 27 HD2 TYR 27 9.641 -3.583 7.939 243 HD2 TYR 27 HD1 TYR 27 6.133 -1.282 7.111 244 HE1 TYR 27 HE2 TYR 27 10.945 -1.519 8.162 245 HE2 TYR 27 HE1 TYR 27 7.446 0.792 7.337 246 HH TYR 27 HH TYR 27 10.831 0.843 7.408 247 H GLN 28 H GLN 28 5.017 -5.251 10.451 248 HA GLN 28 HA GLN 28 4.407 -7.902 9.746 249 HB2 GLN 28 2HB GLN 28 2.909 -5.857 11.426 250 HB3 GLN 28 3HB GLN 28 2.307 -7.493 11.199 251 HG2 GLN 28 2HG GLN 28 3.407 -7.420 13.307 252 HG3 GLN 28 3HG GLN 28 4.427 -8.357 12.224 253 HE21 GLN 28 1HE2 GLN 28 4.235 -4.801 12.370 254 HE22 GLN 28 2HE2 GLN 28 5.856 -4.581 12.922 255 H VAL 29 H VAL 29 3.295 -8.652 8.102 256 HA VAL 29 HA VAL 29 1.991 -6.976 6.177 257 HB VAL 29 HB VAL 29 2.052 -10.034 6.275 258 HG11 VAL 29 1HG1 VAL 29 1.664 -8.178 3.895 259 HG12 VAL 29 2HG1 VAL 29 0.377 -9.068 4.713 260 HG13 VAL 29 3HG1 VAL 29 1.653 -9.944 3.872 261 HG21 VAL 29 3HG2 VAL 29 4.052 -8.182 4.935 262 HG22 VAL 29 1HG2 VAL 29 4.044 -9.946 4.843 263 HG23 VAL 29 2HG2 VAL 29 4.345 -9.141 6.385 264 H ARG 30 H ARG 30 -0.121 -6.491 6.132 265 HA ARG 30 HA ARG 30 -2.153 -8.443 7.037 266 HB2 ARG 30 2HB ARG 30 -2.364 -5.383 7.073 267 HB3 ARG 30 3HB ARG 30 -3.661 -6.494 7.498 268 HG2 ARG 30 2HG ARG 30 -1.044 -6.192 8.995 269 HG3 ARG 30 3HG ARG 30 -2.583 -5.479 9.474 270 HD2 ARG 30 2HD ARG 30 -3.534 -7.756 9.754 271 HD3 ARG 30 3HD ARG 30 -1.980 -8.452 9.286 272 HE ARG 30 HE ARG 30 -1.137 -7.969 11.365 273 HH11 ARG 30 1HH1 ARG 30 -4.234 -6.309 11.062 274 HH12 ARG 30 2HH1 ARG 30 -4.284 -5.889 12.744 275 HH21 ARG 30 1HH2 ARG 30 -1.248 -7.393 13.553 276 HH22 ARG 30 2HH2 ARG 30 -2.604 -6.502 14.138 277 H ASP 31 H ASP 31 -3.474 -9.039 5.381 278 HA ASP 31 HA ASP 31 -3.545 -7.393 2.901 279 HB2 ASP 31 2HB ASP 31 -3.556 -9.374 1.517 280 HB3 ASP 31 3HB ASP 31 -2.178 -9.493 2.597 281 H VAL 32 H VAL 32 -5.528 -7.103 2.006 282 HA VAL 32 HA VAL 32 -7.909 -8.138 3.427 283 HB VAL 32 HB VAL 32 -7.383 -5.249 2.556 284 HG11 VAL 32 1HG1 VAL 32 -9.609 -4.714 3.452 285 HG12 VAL 32 2HG1 VAL 32 -9.915 -6.424 3.756 286 HG13 VAL 32 3HG1 VAL 32 -9.712 -5.841 2.101 287 HG21 VAL 32 3HG2 VAL 32 -7.616 -4.664 4.950 288 HG22 VAL 32 1HG2 VAL 32 -6.272 -5.778 4.683 289 HG23 VAL 32 2HG2 VAL 32 -7.789 -6.373 5.358 290 H ASN 33 H ASN 33 -9.133 -9.193 2.010 291 HA ASN 33 HA ASN 33 -9.240 -8.355 -0.843 292 HB2 ASN 33 2HB ASN 33 -9.430 -11.173 0.312 293 HB3 ASN 33 3HB ASN 33 -9.645 -10.768 -1.387 294 HD21 ASN 33 1HD2 ASN 33 -7.345 -11.085 1.213 295 HD22 ASN 33 2HD2 ASN 33 -5.919 -11.040 0.243 296 H ASP 34 H ASP 34 -10.949 -8.124 1.879 297 HA ASP 34 HA ASP 34 -13.528 -8.123 0.471 298 HB2 ASP 34 2HB ASP 34 -13.390 -10.348 1.538 299 HB3 ASP 34 3HB ASP 34 -13.043 -9.605 3.093 300 H SER 35 H SER 35 -14.954 -6.562 1.165 301 HA SER 35 HA SER 35 -14.018 -4.224 2.290 302 HB2 SER 35 2HB SER 35 -16.927 -5.115 2.137 303 HB3 SER 35 3HB SER 35 -16.351 -3.448 2.232 304 HG SER 35 HG SER 35 -16.901 -4.420 0.069 305 H ASP 36 H ASP 36 -15.927 -6.788 3.900 306 HA ASP 36 HA ASP 36 -16.330 -5.455 6.350 307 HB2 ASP 36 2HB ASP 36 -16.134 -8.460 5.864 308 HB3 ASP 36 3HB ASP 36 -16.752 -7.711 7.334 309 H GLU 37 H GLU 37 -13.681 -7.523 5.217 310 HA GLU 37 HA GLU 37 -12.195 -7.752 7.626 311 HB2 GLU 37 2HB GLU 37 -11.083 -7.715 4.783 312 HB3 GLU 37 3HB GLU 37 -10.260 -8.320 6.217 313 HG2 GLU 37 2HG GLU 37 -12.015 -10.084 6.424 314 HG3 GLU 37 3HG GLU 37 -12.701 -9.524 4.895 315 H LEU 38 H LEU 38 -12.208 -5.378 5.021 316 HA LEU 38 HA LEU 38 -9.978 -3.820 5.667 317 HB2 LEU 38 2HB LEU 38 -11.161 -3.638 3.564 318 HB3 LEU 38 3HB LEU 38 -12.623 -3.096 4.353 319 HG LEU 38 HG LEU 38 -10.172 -1.347 4.638 320 HD11 LEU 38 1HD1 LEU 38 -10.140 -1.954 2.277 321 HD12 LEU 38 2HD1 LEU 38 -10.578 -0.264 2.500 322 HD13 LEU 38 3HD1 LEU 38 -11.824 -1.453 2.109 323 HD21 LEU 38 3HD2 LEU 38 -12.261 -0.637 5.759 324 HD22 LEU 38 1HD2 LEU 38 -13.112 -0.658 4.212 325 HD23 LEU 38 2HD2 LEU 38 -11.805 0.498 4.492 326 H LYS 39 H LYS 39 -13.375 -3.421 6.601 327 HA LYS 39 HA LYS 39 -12.935 -1.022 8.093 328 HB2 LYS 39 2HB LYS 39 -15.357 -2.871 8.257 329 HB3 LYS 39 3HB LYS 39 -15.302 -1.155 8.665 330 HG2 LYS 39 2HG LYS 39 -14.776 -0.653 6.247 331 HG3 LYS 39 3HG LYS 39 -14.969 -2.367 5.900 332 HD2 LYS 39 2HD LYS 39 -17.047 -1.528 5.274 333 HD3 LYS 39 3HD LYS 39 -17.372 -2.056 6.925 334 HE2 LYS 39 2HE LYS 39 -18.361 0.143 6.489 335 HE3 LYS 39 3HE LYS 39 -17.089 0.282 7.706 336 HZ1 LYS 39 3HZ LYS 39 -16.787 0.920 4.812 337 HZ2 LYS 39 1HZ LYS 39 -15.585 1.074 5.989 338 HZ3 LYS 39 2HZ LYS 39 -16.959 2.051 6.057 339 H LYS 40 H LYS 40 -13.186 -4.469 8.960 340 HA LYS 40 HA LYS 40 -13.066 -4.252 11.781 341 HB2 LYS 40 2HB LYS 40 -12.004 -6.468 9.961 342 HB3 LYS 40 3HB LYS 40 -12.141 -6.606 11.709 343 HG2 LYS 40 2HG LYS 40 -14.464 -6.187 9.812 344 HG3 LYS 40 3HG LYS 40 -13.986 -7.734 10.508 345 HD2 LYS 40 2HD LYS 40 -14.521 -6.948 12.753 346 HD3 LYS 40 3HD LYS 40 -14.849 -5.318 12.151 347 HE2 LYS 40 2HE LYS 40 -16.938 -6.522 12.582 348 HE3 LYS 40 3HE LYS 40 -16.771 -6.196 10.857 349 HZ1 LYS 40 3HZ LYS 40 -17.556 -8.455 11.326 350 HZ2 LYS 40 1HZ LYS 40 -16.130 -8.786 12.168 351 HZ3 LYS 40 2HZ LYS 40 -16.076 -8.463 10.513 352 H GLU 41 H GLU 41 -10.515 -4.454 9.319 353 HA GLU 41 HA GLU 41 -8.248 -4.646 10.966 354 HB2 GLU 41 2HB GLU 41 -8.216 -5.168 8.549 355 HB3 GLU 41 3HB GLU 41 -8.571 -3.492 8.156 356 HG2 GLU 41 2HG GLU 41 -6.217 -4.065 7.747 357 HG3 GLU 41 3HG GLU 41 -6.381 -2.795 8.960 358 H MET 42 H MET 42 -9.827 -1.841 9.460 359 HA MET 42 HA MET 42 -8.034 0.099 10.550 360 HB2 MET 42 2HB MET 42 -10.566 0.218 8.918 361 HB3 MET 42 3HB MET 42 -10.047 1.683 9.745 362 HG2 MET 42 2HG MET 42 -8.322 0.112 7.813 363 HG3 MET 42 3HG MET 42 -9.232 1.578 7.421 364 HE1 MET 42 3HE MET 42 -5.506 2.891 7.572 365 HE2 MET 42 1HE MET 42 -6.963 2.797 6.583 366 HE3 MET 42 2HE MET 42 -6.052 1.332 6.957 367 H LYS 43 H LYS 43 -10.993 -1.362 11.765 368 HA LYS 43 HA LYS 43 -11.474 0.494 13.879 369 HB2 LYS 43 2HB LYS 43 -12.106 -2.476 13.648 370 HB3 LYS 43 3HB LYS 43 -12.548 -1.534 15.064 371 HG2 LYS 43 2HG LYS 43 -13.526 -1.012 12.241 372 HG3 LYS 43 3HG LYS 43 -14.434 -1.853 13.490 373 HD2 LYS 43 2HD LYS 43 -13.550 1.056 13.572 374 HD3 LYS 43 3HD LYS 43 -15.182 0.477 13.237 375 HE2 LYS 43 2HE LYS 43 -13.674 0.163 15.853 376 HE3 LYS 43 3HE LYS 43 -15.021 1.253 15.542 377 HZ1 LYS 43 3HZ LYS 43 -15.656 -0.798 16.722 378 HZ2 LYS 43 1HZ LYS 43 -15.214 -1.709 15.374 379 HZ3 LYS 43 2HZ LYS 43 -16.484 -0.598 15.269 380 H LYS 44 H LYS 44 -9.428 -2.400 13.581 381 HA LYS 44 HA LYS 44 -8.522 -2.415 16.299 382 HB2 LYS 44 2HB LYS 44 -7.235 -3.759 13.881 383 HB3 LYS 44 3HB LYS 44 -6.910 -4.130 15.569 384 HG2 LYS 44 2HG LYS 44 -9.469 -4.663 14.047 385 HG3 LYS 44 3HG LYS 44 -8.321 -5.853 14.648 386 HD2 LYS 44 2HD LYS 44 -10.043 -4.032 16.361 387 HD3 LYS 44 3HD LYS 44 -10.365 -5.733 16.032 388 HE2 LYS 44 2HE LYS 44 -8.366 -6.401 17.246 389 HE3 LYS 44 3HE LYS 44 -7.884 -4.713 17.459 390 HZ1 LYS 44 3HZ LYS 44 -8.936 -5.572 19.453 391 HZ2 LYS 44 1HZ LYS 44 -10.328 -5.972 18.590 392 HZ3 LYS 44 2HZ LYS 44 -9.889 -4.351 18.777 393 H LEU 45 H LEU 45 -7.305 -1.019 13.288 394 HA LEU 45 HA LEU 45 -4.795 -0.075 14.265 395 HB2 LEU 45 2HB LEU 45 -6.528 0.884 11.947 396 HB3 LEU 45 3HB LEU 45 -4.906 1.485 12.257 397 HG LEU 45 HG LEU 45 -5.625 -1.382 11.513 398 HD11 LEU 45 1HD1 LEU 45 -4.240 0.751 9.856 399 HD12 LEU 45 2HD1 LEU 45 -5.877 0.132 9.616 400 HD13 LEU 45 3HD1 LEU 45 -4.494 -0.933 9.384 401 HD21 LEU 45 3HD2 LEU 45 -2.890 -0.159 11.988 402 HD22 LEU 45 1HD2 LEU 45 -3.201 -1.777 11.349 403 HD23 LEU 45 2HD2 LEU 45 -3.696 -1.372 12.990 404 H ALA 46 H ALA 46 -8.059 1.294 14.081 405 HA ALA 46 HA ALA 46 -7.518 3.891 15.073 406 HB1 ALA 46 3HB ALA 46 -9.610 3.326 13.902 407 HB2 ALA 46 1HB ALA 46 -9.942 4.039 15.481 408 HB3 ALA 46 2HB ALA 46 -10.098 2.293 15.247 409 H GLU 47 H GLU 47 -8.230 0.819 16.658 410 HA GLU 47 HA GLU 47 -8.376 1.801 19.348 411 HB2 GLU 47 2HB GLU 47 -7.854 -0.986 18.234 412 HB3 GLU 47 3HB GLU 47 -8.025 -0.647 19.953 413 HG2 GLU 47 2HG GLU 47 -10.333 0.052 19.645 414 HG3 GLU 47 3HG GLU 47 -10.183 -0.107 17.895 415 H GLU 48 H GLU 48 -5.786 0.807 17.224 416 HA GLU 48 HA GLU 48 -3.905 -0.000 19.225 417 HB2 GLU 48 2HB GLU 48 -3.868 -0.866 16.885 418 HB3 GLU 48 3HB GLU 48 -3.440 0.740 16.300 419 HG2 GLU 48 2HG GLU 48 -1.367 0.552 17.843 420 HG3 GLU 48 3HG GLU 48 -1.760 -1.163 17.959 421 H LYS 49 H LYS 49 -3.304 1.586 20.654 422 HA LYS 49 HA LYS 49 -2.468 4.247 19.757 423 HB2 LYS 49 2HB LYS 49 -2.195 4.693 22.204 424 HB3 LYS 49 3HB LYS 49 -3.809 4.153 21.770 425 HG2 LYS 49 2HG LYS 49 -3.285 1.889 22.609 426 HG3 LYS 49 3HG LYS 49 -1.670 2.424 23.068 427 HD2 LYS 49 2HD LYS 49 -4.251 3.582 24.203 428 HD3 LYS 49 3HD LYS 49 -3.327 2.291 24.967 429 HE2 LYS 49 2HE LYS 49 -2.735 4.311 26.090 430 HE3 LYS 49 3HE LYS 49 -1.357 3.904 25.068 431 HZ1 LYS 49 3HZ LYS 49 -3.462 5.889 24.380 432 HZ2 LYS 49 1HZ LYS 49 -2.067 5.576 23.490 433 HZ3 LYS 49 2HZ LYS 49 -1.951 6.281 25.017 434 H ASN 50 H ASN 50 -0.914 2.721 18.452 435 HA ASN 50 HA ASN 50 1.758 2.875 19.628 436 HB2 ASN 50 2HB ASN 50 0.948 0.592 20.249 437 HB3 ASN 50 3HB ASN 50 0.618 0.236 18.558 438 HD21 ASN 50 1HD2 ASN 50 2.035 -1.466 18.361 439 HD22 ASN 50 2HD2 ASN 50 3.747 -1.340 18.549 440 H PHE 51 H PHE 51 3.419 2.494 18.001 441 HA PHE 51 HA PHE 51 2.654 3.384 15.308 442 HB2 PHE 51 2HB PHE 51 5.063 4.078 15.131 443 HB3 PHE 51 3HB PHE 51 4.201 4.880 16.431 444 HD1 PHE 51 HD1 PHE 51 4.711 4.331 18.808 445 HD2 PHE 51 HD2 PHE 51 6.960 2.589 15.614 446 HE1 PHE 51 HE1 PHE 51 6.456 3.645 20.404 447 HE2 PHE 51 HE2 PHE 51 8.700 1.903 17.217 448 HZ PHE 51 HZ PHE 51 8.446 2.427 19.613 449 H GLU 52 H GLU 52 2.379 0.522 16.103 450 HA GLU 52 HA GLU 52 4.560 -1.059 15.226 451 HB2 GLU 52 2HB GLU 52 2.657 -2.010 16.533 452 HB3 GLU 52 3HB GLU 52 1.599 -1.813 15.138 453 HG2 GLU 52 2HG GLU 52 3.085 -3.391 13.858 454 HG3 GLU 52 3HG GLU 52 4.024 -3.652 15.324 455 H LYS 53 H LYS 53 5.204 -1.768 13.235 456 HA LYS 53 HA LYS 53 4.290 -0.237 10.969 457 HB2 LYS 53 2HB LYS 53 6.458 -2.369 11.209 458 HB3 LYS 53 3HB LYS 53 6.132 -1.442 9.746 459 HG2 LYS 53 2HG LYS 53 7.038 -0.321 12.412 460 HG3 LYS 53 3HG LYS 53 8.019 -0.475 10.952 461 HD2 LYS 53 2HD LYS 53 6.709 1.200 9.799 462 HD3 LYS 53 3HD LYS 53 5.495 1.224 11.084 463 HE2 LYS 53 2HE LYS 53 8.374 2.140 11.350 464 HE3 LYS 53 3HE LYS 53 6.955 3.180 11.221 465 HZ1 LYS 53 3HZ LYS 53 6.141 2.298 13.306 466 HZ2 LYS 53 1HZ LYS 53 7.687 2.921 13.517 467 HZ3 LYS 53 2HZ LYS 53 7.462 1.253 13.429 468 H ILE 54 H ILE 54 2.686 -0.781 9.743 469 HA ILE 54 HA ILE 54 1.996 -3.621 9.265 470 HB ILE 54 HB ILE 54 0.099 -1.298 9.862 471 HG12 ILE 54 2HG1 ILE 54 0.954 -2.584 11.836 472 HG13 ILE 54 3HG1 ILE 54 -0.785 -2.756 11.649 473 HG21 ILE 54 1HG2 ILE 54 -1.808 -2.796 9.318 474 HG22 ILE 54 2HG2 ILE 54 -0.676 -3.987 8.673 475 HG23 ILE 54 3HG2 ILE 54 -0.826 -2.407 7.904 476 HD11 ILE 54 3HD1 ILE 54 -0.435 -4.985 10.664 477 HD12 ILE 54 1HD1 ILE 54 0.229 -4.843 12.292 478 HD13 ILE 54 2HD1 ILE 54 1.305 -4.795 10.897 479 H LEU 55 H LEU 55 2.435 -4.006 7.226 480 HA LEU 55 HA LEU 55 2.022 -2.023 5.107 481 HB2 LEU 55 2HB LEU 55 4.007 -3.584 5.174 482 HB3 LEU 55 3HB LEU 55 2.927 -4.935 4.881 483 HG LEU 55 HG LEU 55 3.021 -2.617 2.917 484 HD11 LEU 55 1HD1 LEU 55 5.344 -3.268 3.248 485 HD12 LEU 55 2HD1 LEU 55 4.770 -3.685 1.638 486 HD13 LEU 55 3HD1 LEU 55 4.941 -4.943 2.866 487 HD21 LEU 55 3HD2 LEU 55 1.250 -4.277 2.567 488 HD22 LEU 55 1HD2 LEU 55 2.459 -5.563 2.476 489 HD23 LEU 55 2HD2 LEU 55 2.418 -4.291 1.250 490 H ILE 56 H ILE 56 0.149 -1.935 3.971 491 HA ILE 56 HA ILE 56 -1.901 -4.028 4.376 492 HB ILE 56 HB ILE 56 -2.213 -1.121 3.486 493 HG12 ILE 56 2HG1 ILE 56 -1.773 -1.445 5.954 494 HG13 ILE 56 3HG1 ILE 56 -3.329 -0.701 5.614 495 HG21 ILE 56 1HG2 ILE 56 -4.663 -1.518 3.538 496 HG22 ILE 56 2HG2 ILE 56 -4.372 -3.234 3.835 497 HG23 ILE 56 3HG2 ILE 56 -3.854 -2.502 2.316 498 HD11 ILE 56 3HD1 ILE 56 -4.442 -2.851 6.027 499 HD12 ILE 56 1HD1 ILE 56 -3.485 -2.318 7.411 500 HD13 ILE 56 2HD1 ILE 56 -2.872 -3.592 6.358 501 H ILE 57 H ILE 57 -1.751 -5.466 2.746 502 HA ILE 57 HA ILE 57 -1.458 -4.637 -0.053 503 HB ILE 57 HB ILE 57 -1.890 -7.432 1.126 504 HG12 ILE 57 2HG1 ILE 57 0.662 -6.150 0.057 505 HG13 ILE 57 3HG1 ILE 57 0.305 -6.444 1.751 506 HG21 ILE 57 1HG2 ILE 57 -1.298 -8.293 -1.123 507 HG22 ILE 57 2HG2 ILE 57 -1.203 -6.641 -1.734 508 HG23 ILE 57 3HG2 ILE 57 -2.750 -7.288 -1.186 509 HD11 ILE 57 3HD1 ILE 57 1.837 -8.086 0.916 510 HD12 ILE 57 1HD1 ILE 57 0.718 -8.542 -0.370 511 HD13 ILE 57 2HD1 ILE 57 0.303 -8.855 1.318 512 H SER 58 H SER 58 -3.196 -4.238 -1.269 513 HA SER 58 HA SER 58 -5.713 -5.690 -0.872 514 HB2 SER 58 2HB SER 58 -6.048 -3.487 0.277 515 HB3 SER 58 3HB SER 58 -5.585 -2.646 -1.199 516 HG SER 58 HG SER 58 -7.883 -4.223 -0.714 517 H ASN 59 H ASN 59 -6.402 -6.425 -2.822 518 HA ASN 59 HA ASN 59 -4.929 -5.636 -5.256 519 HB2 ASN 59 2HB ASN 59 -6.901 -7.924 -4.828 520 HB3 ASN 59 3HB ASN 59 -5.901 -7.674 -6.257 521 HD21 ASN 59 1HD2 ASN 59 -6.041 -9.951 -4.410 522 HD22 ASN 59 2HD2 ASN 59 -4.428 -10.192 -3.844 523 H ASP 60 H ASP 60 -7.650 -4.695 -3.688 524 HA ASP 60 HA ASP 60 -9.283 -4.167 -6.097 525 HB2 ASP 60 2HB ASP 60 -10.205 -4.207 -3.186 526 HB3 ASP 60 3HB ASP 60 -11.225 -4.079 -4.617 527 H LYS 61 H LYS 61 -9.085 -2.136 -6.748 528 HA LYS 61 HA LYS 61 -7.830 -0.110 -5.175 529 HB2 LYS 61 2HB LYS 61 -8.940 -0.248 -7.991 530 HB3 LYS 61 3HB LYS 61 -8.416 1.301 -7.321 531 HG2 LYS 61 2HG LYS 61 -6.171 0.500 -6.984 532 HG3 LYS 61 3HG LYS 61 -6.632 -1.160 -7.343 533 HD2 LYS 61 2HD LYS 61 -6.753 1.081 -9.392 534 HD3 LYS 61 3HD LYS 61 -5.340 0.051 -9.162 535 HE2 LYS 61 2HE LYS 61 -6.804 -1.943 -9.637 536 HE3 LYS 61 3HE LYS 61 -8.107 -0.821 -10.048 537 HZ1 LYS 61 3HZ LYS 61 -6.948 -1.500 -12.024 538 HZ2 LYS 61 1HZ LYS 61 -5.465 -1.012 -11.379 539 HZ3 LYS 61 2HZ LYS 61 -6.639 0.134 -11.749 540 H GLN 62 H GLN 62 -11.128 -1.033 -5.601 541 HA GLN 62 HA GLN 62 -12.368 1.392 -4.698 542 HB2 GLN 62 2HB GLN 62 -13.658 -0.339 -5.882 543 HB3 GLN 62 3HB GLN 62 -13.315 -1.511 -4.617 544 HG2 GLN 62 2HG GLN 62 -15.613 -0.672 -4.461 545 HG3 GLN 62 3HG GLN 62 -14.681 -0.235 -3.029 546 HE21 GLN 62 1HE2 GLN 62 -16.141 1.433 -2.536 547 HE22 GLN 62 2HE2 GLN 62 -16.197 2.908 -3.429 548 H LEU 63 H LEU 63 -11.186 -1.584 -3.112 549 HA LEU 63 HA LEU 63 -11.854 -0.852 -0.447 550 HB2 LEU 63 2HB LEU 63 -9.746 -2.794 -1.486 551 HB3 LEU 63 3HB LEU 63 -10.134 -2.596 0.214 552 HG LEU 63 HG LEU 63 -11.915 -3.755 -1.957 553 HD11 LEU 63 1HD1 LEU 63 -11.886 -5.778 -0.550 554 HD12 LEU 63 2HD1 LEU 63 -10.813 -4.978 0.600 555 HD13 LEU 63 3HD1 LEU 63 -10.258 -5.311 -1.042 556 HD21 LEU 63 3HD2 LEU 63 -13.666 -4.019 -0.244 557 HD22 LEU 63 1HD2 LEU 63 -13.318 -2.324 -0.576 558 HD23 LEU 63 2HD2 LEU 63 -12.701 -3.077 0.896 559 H LEU 64 H LEU 64 -9.007 -0.328 -2.491 560 HA LEU 64 HA LEU 64 -7.319 0.821 -0.565 561 HB2 LEU 64 2HB LEU 64 -6.544 0.121 -2.766 562 HB3 LEU 64 3HB LEU 64 -7.504 1.359 -3.551 563 HG LEU 64 HG LEU 64 -5.435 2.282 -1.549 564 HD11 LEU 64 1HD1 LEU 64 -3.660 2.269 -3.236 565 HD12 LEU 64 2HD1 LEU 64 -4.710 1.390 -4.350 566 HD13 LEU 64 3HD1 LEU 64 -4.186 0.633 -2.844 567 HD21 LEU 64 3HD2 LEU 64 -6.849 3.955 -2.594 568 HD22 LEU 64 1HD2 LEU 64 -6.360 3.409 -4.194 569 HD23 LEU 64 2HD2 LEU 64 -5.180 4.155 -3.118 570 H LYS 65 H LYS 65 -9.770 2.341 -2.679 571 HA LYS 65 HA LYS 65 -9.482 5.014 -1.939 572 HB2 LYS 65 2HB LYS 65 -11.951 3.448 -2.780 573 HB3 LYS 65 3HB LYS 65 -11.970 5.197 -2.569 574 HG2 LYS 65 2HG LYS 65 -10.489 5.547 -4.402 575 HG3 LYS 65 3HG LYS 65 -10.039 3.838 -4.463 576 HD2 LYS 65 2HD LYS 65 -11.574 4.424 -6.312 577 HD3 LYS 65 3HD LYS 65 -12.296 3.237 -5.227 578 HE2 LYS 65 2HE LYS 65 -13.595 5.070 -4.139 579 HE3 LYS 65 3HE LYS 65 -12.908 6.215 -5.293 580 HZ1 LYS 65 3HZ LYS 65 -15.102 5.478 -5.981 581 HZ2 LYS 65 1HZ LYS 65 -14.593 3.864 -5.989 582 HZ3 LYS 65 2HZ LYS 65 -13.935 4.960 -7.089 583 H GLU 66 H GLU 66 -11.709 2.576 -0.544 584 HA GLU 66 HA GLU 66 -12.806 3.918 1.607 585 HB2 GLU 66 2HB GLU 66 -12.007 1.031 1.165 586 HB3 GLU 66 3HB GLU 66 -12.630 1.508 2.735 587 HG2 GLU 66 2HG GLU 66 -14.138 1.949 0.153 588 HG3 GLU 66 3HG GLU 66 -14.296 0.498 1.139 589 H MET 67 H MET 67 -9.781 2.091 1.507 590 HA MET 67 HA MET 67 -8.978 2.268 4.158 591 HB2 MET 67 2HB MET 67 -8.079 0.737 2.303 592 HB3 MET 67 3HB MET 67 -7.104 2.093 1.753 593 HG2 MET 67 2HG MET 67 -5.688 0.731 3.079 594 HG3 MET 67 3HG MET 67 -6.070 2.132 4.077 595 HE1 MET 67 3HE MET 67 -7.762 -2.126 4.713 596 HE2 MET 67 1HE MET 67 -6.529 -1.710 3.523 597 HE3 MET 67 2HE MET 67 -8.194 -1.177 3.291 598 H LEU 68 H LEU 68 -8.254 4.428 1.400 599 HA LEU 68 HA LEU 68 -6.355 6.092 2.742 600 HB2 LEU 68 2HB LEU 68 -8.005 6.621 0.238 601 HB3 LEU 68 3HB LEU 68 -6.733 7.687 0.816 602 HG LEU 68 HG LEU 68 -6.368 4.844 -0.198 603 HD11 LEU 68 1HD1 LEU 68 -5.533 7.513 -1.379 604 HD12 LEU 68 2HD1 LEU 68 -6.834 6.466 -1.956 605 HD13 LEU 68 3HD1 LEU 68 -5.163 5.917 -2.044 606 HD21 LEU 68 3HD2 LEU 68 -3.945 5.213 0.044 607 HD22 LEU 68 1HD2 LEU 68 -4.761 5.269 1.605 608 HD23 LEU 68 2HD2 LEU 68 -4.245 6.766 0.827 609 H GLU 69 H GLU 69 -9.861 6.408 2.156 610 HA GLU 69 HA GLU 69 -10.291 8.977 3.196 611 HB2 GLU 69 2HB GLU 69 -12.104 6.527 3.306 612 HB3 GLU 69 3HB GLU 69 -12.627 8.152 3.731 613 HG2 GLU 69 2HG GLU 69 -11.660 7.248 1.017 614 HG3 GLU 69 3HG GLU 69 -13.335 7.549 1.474 615 H LEU 70 H LEU 70 -10.256 5.823 4.809 616 HA LEU 70 HA LEU 70 -10.680 6.736 7.463 617 HB2 LEU 70 2HB LEU 70 -9.403 4.175 6.427 618 HB3 LEU 70 3HB LEU 70 -9.929 4.426 8.086 619 HG LEU 70 HG LEU 70 -11.807 4.528 5.688 620 HD11 LEU 70 1HD1 LEU 70 -11.383 2.214 7.593 621 HD12 LEU 70 2HD1 LEU 70 -10.893 2.270 5.898 622 HD13 LEU 70 3HD1 LEU 70 -12.603 2.309 6.321 623 HD21 LEU 70 3HD2 LEU 70 -12.407 4.422 8.661 624 HD22 LEU 70 1HD2 LEU 70 -13.600 4.381 7.361 625 HD23 LEU 70 2HD2 LEU 70 -12.612 5.820 7.599 626 H ILE 71 H ILE 71 -7.720 6.087 5.599 627 HA ILE 71 HA ILE 71 -5.751 6.326 7.602 628 HB ILE 71 HB ILE 71 -5.712 6.698 4.582 629 HG12 ILE 71 2HG1 ILE 71 -4.227 4.696 6.338 630 HG13 ILE 71 3HG1 ILE 71 -5.773 4.390 5.564 631 HG21 ILE 71 1HG2 ILE 71 -3.276 7.170 6.326 632 HG22 ILE 71 2HG2 ILE 71 -4.084 8.358 5.301 633 HG23 ILE 71 3HG2 ILE 71 -3.251 6.986 4.572 634 HD11 ILE 71 3HD1 ILE 71 -3.162 4.906 4.143 635 HD12 ILE 71 1HD1 ILE 71 -4.723 4.623 3.366 636 HD13 ILE 71 2HD1 ILE 71 -3.976 3.355 4.336 637 H SER 72 H SER 72 -7.308 8.756 5.540 638 HA SER 72 HA SER 72 -5.646 10.951 6.172 639 HB2 SER 72 2HB SER 72 -7.110 10.860 4.173 640 HB3 SER 72 3HB SER 72 -8.536 10.934 5.208 641 HG SER 72 HG SER 72 -6.946 12.949 4.322 642 H LYS 73 H LYS 73 -8.698 9.765 7.583 643 HA LYS 73 HA LYS 73 -9.009 11.957 9.427 644 HB2 LYS 73 2HB LYS 73 -10.392 9.244 9.260 645 HB3 LYS 73 3HB LYS 73 -10.877 10.548 10.347 646 HG2 LYS 73 2HG LYS 73 -11.401 11.997 8.434 647 HG3 LYS 73 3HG LYS 73 -10.842 10.755 7.313 648 HD2 LYS 73 2HD LYS 73 -13.217 10.468 9.200 649 HD3 LYS 73 3HD LYS 73 -13.326 10.841 7.482 650 HE2 LYS 73 2HE LYS 73 -12.189 8.644 7.005 651 HE3 LYS 73 3HE LYS 73 -12.299 8.272 8.729 652 HZ1 LYS 73 3HZ LYS 73 -14.138 7.307 7.457 653 HZ2 LYS 73 1HZ LYS 73 -14.609 8.844 6.946 654 HZ3 LYS 73 2HZ LYS 73 -14.702 8.432 8.581 655 H LEU 74 H LEU 74 -7.671 8.692 9.590 656 HA LEU 74 HA LEU 74 -7.144 8.729 12.434 657 HB2 LEU 74 2HB LEU 74 -6.189 6.871 10.212 658 HB3 LEU 74 3HB LEU 74 -5.845 6.614 11.915 659 HG LEU 74 HG LEU 74 -8.642 6.632 10.700 660 HD11 LEU 74 1HD1 LEU 74 -7.001 4.242 11.602 661 HD12 LEU 74 2HD1 LEU 74 -7.363 4.684 9.933 662 HD13 LEU 74 3HD1 LEU 74 -8.669 4.209 11.014 663 HD21 LEU 74 3HD2 LEU 74 -8.692 7.357 13.017 664 HD22 LEU 74 1HD2 LEU 74 -7.743 5.954 13.516 665 HD23 LEU 74 2HD2 LEU 74 -9.376 5.740 12.880 666 H GLY 75 H GLY 75 -5.600 9.988 9.647 667 HA2 GLY 75 2HA GLY 75 -3.830 11.407 9.407 668 HA3 GLY 75 3HA GLY 75 -3.671 11.433 11.154 669 H TYR 76 H TYR 76 -3.404 8.647 8.970 670 HA TYR 76 HA TYR 76 -0.879 7.895 10.188 671 HB2 TYR 76 2HB TYR 76 -2.560 6.562 8.032 672 HB3 TYR 76 3HB TYR 76 -1.049 5.887 8.641 673 HD1 TYR 76 HD1 TYR 76 -1.882 7.032 11.597 674 HD2 TYR 76 HD2 TYR 76 -3.617 4.391 8.716 675 HE1 TYR 76 HE1 TYR 76 -3.063 5.879 13.386 676 HE2 TYR 76 HE2 TYR 76 -4.817 3.229 10.508 677 HH TYR 76 HH TYR 76 -5.134 4.485 13.610 678 H LYS 77 H LYS 77 1.119 7.939 9.316 679 HA LYS 77 HA LYS 77 1.588 9.579 6.944 680 HB2 LYS 77 2HB LYS 77 2.910 9.595 9.245 681 HB3 LYS 77 3HB LYS 77 3.750 8.196 8.598 682 HG2 LYS 77 2HG LYS 77 3.657 10.894 7.214 683 HG3 LYS 77 3HG LYS 77 4.931 10.413 8.330 684 HD2 LYS 77 2HD LYS 77 5.629 8.616 6.835 685 HD3 LYS 77 3HD LYS 77 4.272 8.943 5.752 686 HE2 LYS 77 2HE LYS 77 6.556 10.860 6.343 687 HE3 LYS 77 3HE LYS 77 6.367 9.897 4.876 688 HZ1 LYS 77 3HZ LYS 77 4.289 11.081 4.433 689 HZ2 LYS 77 1HZ LYS 77 5.600 12.139 4.523 690 HZ3 LYS 77 2HZ LYS 77 4.522 12.028 5.813 691 H VAL 78 H VAL 78 0.994 8.366 5.180 692 HA VAL 78 HA VAL 78 1.870 5.527 4.999 693 HB VAL 78 HB VAL 78 -0.665 6.827 3.887 694 HG11 VAL 78 1HG1 VAL 78 0.251 3.938 3.665 695 HG12 VAL 78 2HG1 VAL 78 0.107 5.091 2.337 696 HG13 VAL 78 3HG1 VAL 78 -1.337 4.548 3.193 697 HG21 VAL 78 3HG2 VAL 78 -0.263 4.798 6.106 698 HG22 VAL 78 1HG2 VAL 78 -1.824 5.340 5.488 699 HG23 VAL 78 2HG2 VAL 78 -0.754 6.482 6.301 700 H PHE 79 H PHE 79 3.036 4.917 3.339 701 HA PHE 79 HA PHE 79 3.455 6.644 0.977 702 HB2 PHE 79 2HB PHE 79 4.914 4.108 1.884 703 HB3 PHE 79 3HB PHE 79 5.378 5.140 0.538 704 HD1 PHE 79 HD1 PHE 79 6.191 7.514 1.023 705 HD2 PHE 79 HD2 PHE 79 5.667 4.604 4.117 706 HE1 PHE 79 HE1 PHE 79 7.622 8.836 2.525 707 HE2 PHE 79 HE2 PHE 79 7.101 5.939 5.611 708 HZ PHE 79 HZ PHE 79 8.075 8.054 4.816 709 H LEU 80 H LEU 80 3.171 5.608 -1.171 710 HA LEU 80 HA LEU 80 1.356 3.263 -1.151 711 HB2 LEU 80 2HB LEU 80 -0.077 5.242 -1.257 712 HB3 LEU 80 3HB LEU 80 0.848 5.892 -2.602 713 HG LEU 80 HG LEU 80 0.075 3.993 -4.039 714 HD11 LEU 80 1HD1 LEU 80 -0.302 2.285 -2.343 715 HD12 LEU 80 2HD1 LEU 80 -1.742 2.527 -3.327 716 HD13 LEU 80 3HD1 LEU 80 -1.669 3.199 -1.695 717 HD21 LEU 80 3HD2 LEU 80 -2.232 4.739 -4.340 718 HD22 LEU 80 1HD2 LEU 80 -1.141 6.101 -4.093 719 HD23 LEU 80 2HD2 LEU 80 -2.185 5.560 -2.777 720 H LEU 81 H LEU 81 1.803 1.780 -2.610 721 HA LEU 81 HA LEU 81 3.222 2.448 -5.110 722 HB2 LEU 81 2HB LEU 81 4.704 1.090 -3.707 723 HB3 LEU 81 3HB LEU 81 3.431 -0.090 -3.425 724 HG LEU 81 HG LEU 81 3.494 -0.757 -5.813 725 HD11 LEU 81 1HD1 LEU 81 5.292 0.055 -7.307 726 HD12 LEU 81 2HD1 LEU 81 5.704 1.285 -6.118 727 HD13 LEU 81 3HD1 LEU 81 4.119 1.299 -6.889 728 HD21 LEU 81 3HD2 LEU 81 5.666 -1.893 -5.817 729 HD22 LEU 81 1HD2 LEU 81 4.904 -1.972 -4.229 730 HD23 LEU 81 2HD2 LEU 81 6.234 -0.846 -4.514 731 H LEU 82 H LEU 82 1.729 2.406 -6.655 732 HA LEU 82 HA LEU 82 -0.392 0.365 -6.743 733 HB2 LEU 82 2HB LEU 82 0.091 2.867 -8.423 734 HB3 LEU 82 3HB LEU 82 -1.254 1.765 -8.653 735 HG LEU 82 HG LEU 82 -0.801 3.460 -6.165 736 HD11 LEU 82 1HD1 LEU 82 -2.820 3.846 -8.405 737 HD12 LEU 82 2HD1 LEU 82 -1.388 4.839 -8.114 738 HD13 LEU 82 3HD1 LEU 82 -2.692 4.812 -6.930 739 HD21 LEU 82 3HD2 LEU 82 -3.058 2.771 -5.510 740 HD22 LEU 82 1HD2 LEU 82 -1.980 1.382 -5.645 741 HD23 LEU 82 2HD2 LEU 82 -3.161 1.708 -6.916 742 H GLN 83 H GLN 83 -0.308 -1.274 -8.259 743 HA GLN 83 HA GLN 83 1.536 -1.119 -10.534 744 HB2 GLN 83 2HB GLN 83 2.748 -2.344 -8.713 745 HB3 GLN 83 3HB GLN 83 1.447 -3.529 -8.657 746 HG2 GLN 83 2HG GLN 83 1.926 -4.192 -10.978 747 HG3 GLN 83 3HG GLN 83 3.197 -2.978 -11.083 748 HE21 GLN 83 1HE2 GLN 83 3.452 -5.788 -11.527 749 HE22 GLN 83 2HE2 GLN 83 4.598 -6.375 -10.379 750 H ASP 84 H ASP 84 0.272 -1.347 -12.205 751 HA ASP 84 HA ASP 84 -1.543 -3.665 -12.409 752 HB2 ASP 84 2HB ASP 84 -2.140 -0.862 -13.462 753 HB3 ASP 84 3HB ASP 84 -3.107 -2.290 -13.808 754 H GLN 85 H GLN 85 -1.526 -4.645 -14.447 755 HA GLN 85 HA GLN 85 0.643 -4.213 -16.244 756 HB2 GLN 85 2HB GLN 85 -1.923 -5.834 -16.438 757 HB3 GLN 85 3HB GLN 85 -0.733 -5.815 -17.730 758 HG2 GLN 85 2HG GLN 85 -0.117 -6.704 -14.896 759 HG3 GLN 85 3HG GLN 85 -0.608 -7.797 -16.191 760 HE21 GLN 85 1HE2 GLN 85 0.825 -8.185 -17.919 761 HE22 GLN 85 2HE2 GLN 85 2.508 -7.798 -17.813 762 H ASP 86 H ASP 86 -2.665 -3.110 -16.023 763 HA ASP 86 HA ASP 86 -2.613 -1.789 -18.642 764 HB2 ASP 86 2HB ASP 86 -4.780 -2.142 -16.524 765 HB3 ASP 86 3HB ASP 86 -4.989 -1.112 -17.938 766 H GLU 87 H GLU 87 -1.244 -0.123 -18.501 767 HA GLU 87 HA GLU 87 -0.810 1.407 -16.127 768 HB2 GLU 87 2HB GLU 87 0.227 1.940 -18.935 769 HB3 GLU 87 3HB GLU 87 0.877 2.584 -17.426 770 HG2 GLU 87 2HG GLU 87 1.474 0.268 -16.717 771 HG3 GLU 87 3HG GLU 87 0.874 -0.333 -18.265 772 H ASN 88 H ASN 88 -3.032 1.702 -18.697 773 HA ASN 88 HA ASN 88 -3.414 4.522 -18.755 774 HB2 ASN 88 2HB ASN 88 -5.179 2.178 -19.585 775 HB3 ASN 88 3HB ASN 88 -5.723 3.846 -19.740 776 HD21 ASN 88 1HD2 ASN 88 -5.298 1.900 -21.832 777 HD22 ASN 88 2HD2 ASN 88 -4.140 2.594 -22.913 778 H GLU 89 H GLU 89 -5.328 1.937 -17.148 779 HA GLU 89 HA GLU 89 -6.958 3.712 -15.607 780 HB2 GLU 89 2HB GLU 89 -7.662 1.679 -14.373 781 HB3 GLU 89 3HB GLU 89 -7.717 1.440 -16.115 782 HG2 GLU 89 2HG GLU 89 -5.521 0.248 -15.980 783 HG3 GLU 89 3HG GLU 89 -5.584 0.409 -14.224 784 H LEU 90 H LEU 90 -3.925 2.044 -15.039 785 HA LEU 90 HA LEU 90 -3.499 2.569 -12.318 786 HB2 LEU 90 2HB LEU 90 -2.152 0.941 -13.430 787 HB3 LEU 90 3HB LEU 90 -1.677 2.065 -14.683 788 HG LEU 90 HG LEU 90 -0.178 3.235 -13.136 789 HD11 LEU 90 1HD1 LEU 90 -1.357 3.057 -11.060 790 HD12 LEU 90 2HD1 LEU 90 0.264 2.396 -10.871 791 HD13 LEU 90 3HD1 LEU 90 -1.119 1.303 -11.014 792 HD21 LEU 90 3HD2 LEU 90 0.744 1.333 -14.374 793 HD22 LEU 90 1HD2 LEU 90 0.293 0.236 -13.064 794 HD23 LEU 90 2HD2 LEU 90 1.510 1.489 -12.795 795 H GLU 91 H GLU 91 -2.740 4.512 -15.233 796 HA GLU 91 HA GLU 91 -1.263 6.563 -13.952 797 HB2 GLU 91 2HB GLU 91 -1.105 6.171 -16.378 798 HB3 GLU 91 3HB GLU 91 -2.806 6.566 -16.592 799 HG2 GLU 91 2HG GLU 91 -1.297 8.382 -17.331 800 HG3 GLU 91 3HG GLU 91 -2.386 8.899 -16.044 801 H GLU 92 H GLU 92 -4.638 6.472 -15.138 802 HA GLU 92 HA GLU 92 -5.581 8.903 -14.267 803 HB2 GLU 92 2HB GLU 92 -7.027 6.220 -14.361 804 HB3 GLU 92 3HB GLU 92 -7.851 7.757 -14.130 805 HG2 GLU 92 2HG GLU 92 -6.162 7.113 -16.561 806 HG3 GLU 92 3HG GLU 92 -7.897 6.836 -16.474 807 H PHE 93 H PHE 93 -5.789 5.843 -12.457 808 HA PHE 93 HA PHE 93 -7.035 6.841 -10.147 809 HB2 PHE 93 2HB PHE 93 -6.959 4.442 -10.941 810 HB3 PHE 93 3HB PHE 93 -5.293 4.349 -10.383 811 HD1 PHE 93 HD1 PHE 93 -8.699 5.297 -9.130 812 HD2 PHE 93 HD2 PHE 93 -4.935 3.482 -8.219 813 HE1 PHE 93 HE1 PHE 93 -9.537 4.673 -6.908 814 HE2 PHE 93 HE2 PHE 93 -5.783 2.864 -6.000 815 HZ PHE 93 HZ PHE 93 -8.084 3.457 -5.342 816 H LYS 94 H LYS 94 -3.641 6.508 -11.016 817 HA LYS 94 HA LYS 94 -2.385 7.004 -8.547 818 HB2 LYS 94 2HB LYS 94 -1.281 6.102 -10.602 819 HB3 LYS 94 3HB LYS 94 -1.453 7.652 -11.386 820 HG2 LYS 94 2HG LYS 94 0.250 7.238 -8.908 821 HG3 LYS 94 3HG LYS 94 0.874 7.026 -10.533 822 HD2 LYS 94 2HD LYS 94 -0.132 9.603 -9.270 823 HD3 LYS 94 3HD LYS 94 1.525 9.212 -9.731 824 HE2 LYS 94 2HE LYS 94 -0.779 9.472 -11.684 825 HE3 LYS 94 3HE LYS 94 0.380 10.753 -11.330 826 HZ1 LYS 94 3HZ LYS 94 2.137 9.270 -12.148 827 HZ2 LYS 94 1HZ LYS 94 0.989 9.624 -13.332 828 HZ3 LYS 94 2HZ LYS 94 0.968 8.129 -12.556 829 H ARG 95 H ARG 95 -3.466 9.212 -11.167 830 HA ARG 95 HA ARG 95 -2.307 11.593 -10.194 831 HB2 ARG 95 2HB ARG 95 -4.779 11.353 -11.970 832 HB3 ARG 95 3HB ARG 95 -3.762 12.785 -11.798 833 HG2 ARG 95 2HG ARG 95 -1.847 11.489 -12.739 834 HG3 ARG 95 3HG ARG 95 -2.929 10.127 -12.979 835 HD2 ARG 95 2HD ARG 95 -2.800 11.134 -15.098 836 HD3 ARG 95 3HD ARG 95 -4.327 11.734 -14.451 837 HE ARG 95 HE ARG 95 -3.437 13.854 -14.320 838 HH11 ARG 95 1HH1 ARG 95 -0.813 11.621 -15.111 839 HH12 ARG 95 2HH1 ARG 95 0.303 12.891 -15.492 840 HH21 ARG 95 1HH2 ARG 95 -1.943 15.484 -14.809 841 HH22 ARG 95 2HH2 ARG 95 -0.336 15.071 -15.319 842 H LYS 96 H LYS 96 -5.432 10.115 -9.456 843 HA LYS 96 HA LYS 96 -6.687 12.325 -8.176 844 HB2 LYS 96 2HB LYS 96 -7.094 9.315 -7.986 845 HB3 LYS 96 3HB LYS 96 -7.981 10.390 -6.919 846 HG2 LYS 96 2HG LYS 96 -9.380 9.788 -8.795 847 HG3 LYS 96 3HG LYS 96 -8.988 11.506 -8.893 848 HD2 LYS 96 2HD LYS 96 -7.314 11.060 -10.618 849 HD3 LYS 96 3HD LYS 96 -7.578 9.320 -10.463 850 HE2 LYS 96 2HE LYS 96 -8.712 10.210 -12.445 851 HE3 LYS 96 3HE LYS 96 -9.886 9.596 -11.281 852 HZ1 LYS 96 3HZ LYS 96 -10.477 11.758 -12.294 853 HZ2 LYS 96 1HZ LYS 96 -9.143 12.456 -11.532 854 HZ3 LYS 96 2HZ LYS 96 -10.395 11.811 -10.609 855 H ILE 97 H ILE 97 -4.785 9.607 -6.930 856 HA ILE 97 HA ILE 97 -5.020 10.323 -4.163 857 HB ILE 97 HB ILE 97 -3.079 8.332 -5.422 858 HG12 ILE 97 2HG1 ILE 97 -5.884 7.731 -4.356 859 HG13 ILE 97 3HG1 ILE 97 -5.519 7.952 -6.064 860 HG21 ILE 97 1HG2 ILE 97 -3.171 7.236 -3.176 861 HG22 ILE 97 2HG2 ILE 97 -4.165 8.565 -2.587 862 HG23 ILE 97 3HG2 ILE 97 -2.507 8.870 -3.106 863 HD11 ILE 97 3HD1 ILE 97 -4.397 5.796 -4.287 864 HD12 ILE 97 1HD1 ILE 97 -4.013 6.034 -5.994 865 HD13 ILE 97 2HD1 ILE 97 -5.655 5.617 -5.509 866 H GLU 98 H GLU 98 -2.692 10.893 -6.705 867 HA GLU 98 HA GLU 98 -0.490 11.818 -5.156 868 HB2 GLU 98 2HB GLU 98 -0.347 11.055 -7.539 869 HB3 GLU 98 3HB GLU 98 -1.259 12.461 -8.048 870 HG2 GLU 98 2HG GLU 98 1.341 12.851 -6.569 871 HG3 GLU 98 3HG GLU 98 1.383 12.387 -8.265 872 H SER 99 H SER 99 -3.376 13.316 -6.556 873 HA SER 99 HA SER 99 -2.748 16.025 -5.860 874 HB2 SER 99 2HB SER 99 -4.260 15.459 -7.744 875 HB3 SER 99 3HB SER 99 -5.417 14.748 -6.618 876 HG SER 99 HG SER 99 -4.843 17.248 -5.815 877 H GLN 100 H GLN 100 -4.207 13.319 -4.172 878 HA GLN 100 HA GLN 100 -5.509 14.802 -2.074 879 HB2 GLN 100 2HB GLN 100 -4.588 11.893 -2.081 880 HB3 GLN 100 3HB GLN 100 -5.671 12.615 -0.895 881 HG2 GLN 100 2HG GLN 100 -7.358 12.987 -2.626 882 HG3 GLN 100 3HG GLN 100 -6.276 12.337 -3.849 883 HE21 GLN 100 1HE2 GLN 100 -8.917 11.404 -3.214 884 HE22 GLN 100 2HE2 GLN 100 -8.769 9.757 -2.707 885 H GLY 101 H GLY 101 -2.241 14.230 -2.757 886 HA2 GLY 101 2HA GLY 101 -0.406 15.132 -1.636 887 HA3 GLY 101 3HA GLY 101 -1.379 15.330 -0.182 888 H TYR 102 H TYR 102 -0.463 12.617 -2.290 889 HA TYR 102 HA TYR 102 0.647 11.151 0.034 890 HB2 TYR 102 2HB TYR 102 -1.161 10.093 -2.173 891 HB3 TYR 102 3HB TYR 102 -0.089 9.014 -1.293 892 HD1 TYR 102 HD2 TYR 102 -3.051 11.250 -0.936 893 HD2 TYR 102 HD1 TYR 102 -0.645 8.255 0.947 894 HE1 TYR 102 HE2 TYR 102 -4.767 10.965 0.807 895 HE2 TYR 102 HE1 TYR 102 -2.363 7.973 2.687 896 HH TYR 102 HH TYR 102 -5.498 9.198 2.428 897 H GLU 103 H GLU 103 2.510 10.001 -0.312 898 HA GLU 103 HA GLU 103 4.134 10.390 -2.651 899 HB2 GLU 103 2HB GLU 103 5.221 10.113 -0.464 900 HB3 GLU 103 3HB GLU 103 4.432 8.560 -0.215 901 HG2 GLU 103 2HG GLU 103 6.782 8.229 -0.774 902 HG3 GLU 103 3HG GLU 103 5.759 7.594 -2.063 903 H VAL 104 H VAL 104 3.035 9.554 -4.422 904 HA VAL 104 HA VAL 104 2.130 6.729 -4.336 905 HB VAL 104 HB VAL 104 1.249 8.846 -6.367 906 HG11 VAL 104 1HG1 VAL 104 0.091 6.112 -5.689 907 HG12 VAL 104 2HG1 VAL 104 1.032 6.509 -7.129 908 HG13 VAL 104 3HG1 VAL 104 -0.553 7.242 -6.884 909 HG21 VAL 104 3HG2 VAL 104 0.505 9.539 -4.129 910 HG22 VAL 104 1HG2 VAL 104 -0.233 7.957 -3.870 911 HG23 VAL 104 2HG2 VAL 104 -0.862 9.033 -5.122 912 H ARG 105 H ARG 105 3.482 5.403 -5.312 913 HA ARG 105 HA ARG 105 5.062 6.231 -7.682 914 HB2 ARG 105 2HB ARG 105 5.480 3.924 -5.714 915 HB3 ARG 105 3HB ARG 105 6.500 4.259 -7.105 916 HG2 ARG 105 2HG ARG 105 6.148 6.198 -4.802 917 HG3 ARG 105 3HG ARG 105 7.412 4.973 -4.854 918 HD2 ARG 105 2HD ARG 105 8.129 6.043 -7.086 919 HD3 ARG 105 3HD ARG 105 7.062 7.380 -6.650 920 HE ARG 105 HE ARG 105 8.547 8.040 -5.002 921 HH11 ARG 105 1HH1 ARG 105 9.615 4.941 -6.312 922 HH12 ARG 105 2HH1 ARG 105 11.170 5.009 -5.547 923 HH21 ARG 105 1HH2 ARG 105 10.617 8.126 -4.053 924 HH22 ARG 105 2HH2 ARG 105 11.734 6.817 -4.270 925 H LYS 106 H LYS 106 4.516 5.248 -9.568 926 HA LYS 106 HA LYS 106 2.726 2.870 -9.533 927 HB2 LYS 106 2HB LYS 106 2.031 3.549 -11.826 928 HB3 LYS 106 3HB LYS 106 1.629 4.749 -10.608 929 HG2 LYS 106 2HG LYS 106 3.537 6.137 -11.318 930 HG3 LYS 106 3HG LYS 106 3.986 4.927 -12.523 931 HD2 LYS 106 2HD LYS 106 1.339 6.430 -12.479 932 HD3 LYS 106 3HD LYS 106 2.726 6.880 -13.470 933 HE2 LYS 106 2HE LYS 106 1.256 4.230 -13.662 934 HE3 LYS 106 3HE LYS 106 0.989 5.612 -14.722 935 HZ1 LYS 106 3HZ LYS 106 3.313 5.460 -15.412 936 HZ2 LYS 106 1HZ LYS 106 2.466 4.041 -15.754 937 HZ3 LYS 106 2HZ LYS 106 3.529 4.092 -14.443 938 H VAL 107 H VAL 107 3.211 1.144 -10.931 939 HA VAL 107 HA VAL 107 5.691 1.070 -12.439 940 HB VAL 107 HB VAL 107 6.399 0.737 -10.027 941 HG11 VAL 107 1HG1 VAL 107 4.889 -1.884 -10.199 942 HG12 VAL 107 2HG1 VAL 107 4.448 -0.491 -9.211 943 HG13 VAL 107 3HG1 VAL 107 5.942 -1.366 -8.876 944 HG21 VAL 107 3HG2 VAL 107 7.806 -0.094 -11.845 945 HG22 VAL 107 1HG2 VAL 107 6.937 -1.628 -11.847 946 HG23 VAL 107 2HG2 VAL 107 7.906 -1.161 -10.444 947 H THR 108 H THR 108 5.963 -0.923 -13.613 948 HA THR 108 HA THR 108 3.798 -2.907 -13.649 949 HB THR 108 HB THR 108 4.825 -1.575 -16.210 950 HG1 THR 108 HG1 THR 108 2.289 -1.189 -14.957 951 HG21 THR 108 3HG2 THR 108 3.923 -3.861 -16.583 952 HG22 THR 108 1HG2 THR 108 2.862 -2.640 -17.287 953 HG23 THR 108 2HG2 THR 108 2.426 -3.410 -15.761 954 H ASP 109 H ASP 109 6.167 -3.140 -12.428 955 HA ASP 109 HA ASP 109 7.654 -5.218 -13.848 956 HB2 ASP 109 2HB ASP 109 8.706 -3.045 -14.589 957 HB3 ASP 109 3HB ASP 109 9.059 -2.679 -12.908 958 H ASP 110 H ASP 110 8.521 -6.683 -12.404 959 HA ASP 110 HA ASP 110 7.413 -6.559 -9.780 960 HB2 ASP 110 2HB ASP 110 8.085 -8.850 -9.465 961 HB3 ASP 110 3HB ASP 110 7.443 -8.667 -11.082 962 H GLU 111 H GLU 111 10.802 -6.535 -10.938 963 HA GLU 111 HA GLU 111 11.894 -6.628 -8.265 964 HB2 GLU 111 2HB GLU 111 14.116 -6.172 -9.374 965 HB3 GLU 111 3HB GLU 111 13.299 -7.626 -9.904 966 HG2 GLU 111 2HG GLU 111 12.894 -5.164 -11.561 967 HG3 GLU 111 3HG GLU 111 14.485 -5.910 -11.606 968 H GLU 112 H GLU 112 11.200 -4.114 -10.657 969 HA GLU 112 HA GLU 112 12.324 -1.924 -9.265 970 HB2 GLU 112 2HB GLU 112 11.530 -1.852 -11.656 971 HB3 GLU 112 3HB GLU 112 9.872 -1.921 -11.081 972 HG2 GLU 112 2HG GLU 112 10.394 0.357 -11.662 973 HG3 GLU 112 3HG GLU 112 10.219 0.256 -9.912 974 H ALA 113 H ALA 113 9.123 -3.501 -9.135 975 HA ALA 113 HA ALA 113 7.841 -1.776 -7.318 976 HB1 ALA 113 3HB ALA 113 6.305 -3.635 -6.881 977 HB2 ALA 113 1HB ALA 113 7.420 -4.763 -7.669 978 HB3 ALA 113 2HB ALA 113 6.640 -3.485 -8.603 979 H LEU 114 H LEU 114 9.695 -4.782 -6.677 980 HA LEU 114 HA LEU 114 9.540 -4.844 -3.872 981 HB2 LEU 114 2HB LEU 114 11.854 -5.766 -5.630 982 HB3 LEU 114 3HB LEU 114 11.644 -6.206 -3.941 983 HG LEU 114 HG LEU 114 9.816 -7.023 -6.233 984 HD11 LEU 114 1HD1 LEU 114 10.670 -9.291 -5.847 985 HD12 LEU 114 2HD1 LEU 114 11.781 -8.681 -4.619 986 HD13 LEU 114 3HD1 LEU 114 11.965 -8.186 -6.304 987 HD21 LEU 114 3HD2 LEU 114 8.676 -8.462 -4.596 988 HD22 LEU 114 1HD2 LEU 114 8.533 -6.757 -4.169 989 HD23 LEU 114 2HD2 LEU 114 9.668 -7.791 -3.299 990 H LYS 115 H LYS 115 11.751 -3.171 -6.038 991 HA LYS 115 HA LYS 115 13.550 -2.075 -4.177 992 HB2 LYS 115 2HB LYS 115 14.136 -2.118 -6.503 993 HB3 LYS 115 3HB LYS 115 12.669 -1.268 -6.968 994 HG2 LYS 115 2HG LYS 115 13.543 0.766 -5.786 995 HG3 LYS 115 3HG LYS 115 15.063 -0.098 -5.521 996 HD2 LYS 115 2HD LYS 115 15.491 -0.235 -7.897 997 HD3 LYS 115 3HD LYS 115 13.856 0.319 -8.279 998 HE2 LYS 115 2HE LYS 115 14.459 2.511 -7.138 999 HE3 LYS 115 3HE LYS 115 16.130 1.936 -7.109 1000 HZ1 LYS 115 3HZ LYS 115 14.468 2.233 -9.555 1001 HZ2 LYS 115 1HZ LYS 115 16.094 1.764 -9.506 1002 HZ3 LYS 115 2HZ LYS 115 15.650 3.330 -9.045 1003 H ILE 116 H ILE 116 10.503 -0.775 -5.585 1004 HA ILE 116 HA ILE 116 10.526 1.774 -4.423 1005 HB ILE 116 HB ILE 116 8.035 0.092 -5.013 1006 HG12 ILE 116 2HG1 ILE 116 9.370 0.297 -7.067 1007 HG13 ILE 116 3HG1 ILE 116 7.907 1.244 -7.205 1008 HG21 ILE 116 1HG2 ILE 116 6.870 2.267 -5.226 1009 HG22 ILE 116 2HG2 ILE 116 8.336 3.099 -4.714 1010 HG23 ILE 116 3HG2 ILE 116 7.508 2.006 -3.603 1011 HD11 ILE 116 3HD1 ILE 116 9.784 2.381 -8.193 1012 HD12 ILE 116 1HD1 ILE 116 10.677 2.313 -6.675 1013 HD13 ILE 116 2HD1 ILE 116 9.205 3.284 -6.794 1014 H VAL 117 H VAL 117 9.244 -1.298 -3.195 1015 HA VAL 117 HA VAL 117 8.039 -0.330 -0.816 1016 HB VAL 117 HB VAL 117 9.187 -3.128 -1.250 1017 HG11 VAL 117 1HG1 VAL 117 6.936 -2.175 0.561 1018 HG12 VAL 117 2HG1 VAL 117 8.546 -2.687 1.078 1019 HG13 VAL 117 3HG1 VAL 117 7.444 -3.852 0.344 1020 HG21 VAL 117 3HG2 VAL 117 7.731 -2.565 -3.132 1021 HG22 VAL 117 1HG2 VAL 117 6.436 -2.110 -2.028 1022 HG23 VAL 117 2HG2 VAL 117 6.978 -3.789 -2.114 1023 H ARG 118 H ARG 118 11.280 -1.622 -1.539 1024 HA ARG 118 HA ARG 118 12.296 -1.534 1.120 1025 HB2 ARG 118 2HB ARG 118 13.720 -1.662 -1.569 1026 HB3 ARG 118 3HB ARG 118 14.582 -1.695 -0.031 1027 HG2 ARG 118 2HG ARG 118 13.370 -3.749 0.612 1028 HG3 ARG 118 3HG ARG 118 12.506 -3.722 -0.924 1029 HD2 ARG 118 2HD ARG 118 15.517 -3.986 -0.637 1030 HD3 ARG 118 3HD ARG 118 14.408 -5.334 -0.884 1031 HE ARG 118 HE ARG 118 14.831 -3.144 -2.839 1032 HH11 ARG 118 1HH1 ARG 118 14.229 -6.559 -2.190 1033 HH12 ARG 118 2HH1 ARG 118 14.216 -6.984 -3.870 1034 HH21 ARG 118 1HH2 ARG 118 14.774 -3.734 -5.012 1035 HH22 ARG 118 2HH2 ARG 118 14.524 -5.389 -5.458 1036 H GLU 119 H GLU 119 12.115 0.857 -1.458 1037 HA GLU 119 HA GLU 119 13.740 2.875 -0.269 1038 HB2 GLU 119 2HB GLU 119 11.398 3.112 -2.221 1039 HB3 GLU 119 3HB GLU 119 12.432 4.460 -1.756 1040 HG2 GLU 119 2HG GLU 119 14.393 3.277 -2.713 1041 HG3 GLU 119 3HG GLU 119 13.338 1.953 -3.205 1042 H PHE 120 H PHE 120 10.248 2.175 -0.172 1043 HA PHE 120 HA PHE 120 9.385 4.253 1.493 1044 HB2 PHE 120 2HB PHE 120 8.259 1.460 1.044 1045 HB3 PHE 120 3HB PHE 120 7.435 2.668 2.023 1046 HD1 PHE 120 HD2 PHE 120 8.619 4.874 -0.197 1047 HD2 PHE 120 HD1 PHE 120 6.063 1.434 -0.202 1048 HE1 PHE 120 HE2 PHE 120 7.419 5.760 -2.152 1049 HE2 PHE 120 HE1 PHE 120 4.875 2.337 -2.149 1050 HZ PHE 120 HZ PHE 120 5.543 4.494 -3.120 1051 H MET 121 H MET 121 10.380 0.961 2.375 1052 HA MET 121 HA MET 121 10.039 1.217 5.166 1053 HB2 MET 121 2HB MET 121 11.765 -0.696 3.539 1054 HB3 MET 121 3HB MET 121 11.497 -0.847 5.271 1055 HG2 MET 121 2HG MET 121 9.049 -1.080 4.824 1056 HG3 MET 121 3HG MET 121 9.402 -1.074 3.097 1057 HE1 MET 121 3HE MET 121 10.575 -3.079 1.802 1058 HE2 MET 121 1HE MET 121 11.349 -4.440 2.615 1059 HE3 MET 121 2HE MET 121 12.028 -2.819 2.771 1060 H GLN 122 H GLN 122 12.714 2.001 3.023 1061 HA GLN 122 HA GLN 122 14.661 2.615 5.013 1062 HB2 GLN 122 2HB GLN 122 15.224 2.158 2.634 1063 HB3 GLN 122 3HB GLN 122 14.401 3.635 2.150 1064 HG2 GLN 122 2HG GLN 122 16.068 4.926 3.523 1065 HG3 GLN 122 3HG GLN 122 16.924 3.415 3.813 1066 HE21 GLN 122 1HE2 GLN 122 15.408 4.359 0.727 1067 HE22 GLN 122 2HE2 GLN 122 16.893 4.504 -0.142 1068 H LYS 123 H LYS 123 12.150 4.519 3.382 1069 HA LYS 123 HA LYS 123 12.835 7.112 4.347 1070 HB2 LYS 123 2HB LYS 123 10.161 5.968 3.412 1071 HB3 LYS 123 3HB LYS 123 10.438 7.679 3.721 1072 HG2 LYS 123 2HG LYS 123 11.976 7.846 1.884 1073 HG3 LYS 123 3HG LYS 123 12.006 6.096 1.673 1074 HD2 LYS 123 2HD LYS 123 9.578 6.167 1.039 1075 HD3 LYS 123 3HD LYS 123 9.627 7.930 1.161 1076 HE2 LYS 123 2HE LYS 123 11.244 6.224 -0.762 1077 HE3 LYS 123 3HE LYS 123 9.847 7.223 -1.173 1078 HZ1 LYS 123 3HZ LYS 123 12.440 8.214 -0.116 1079 HZ2 LYS 123 1HZ LYS 123 11.102 9.184 -0.486 1080 HZ3 LYS 123 2HZ LYS 123 11.908 8.347 -1.712 1081 H ALA 124 H ALA 124 10.448 4.700 5.395 1082 HA ALA 124 HA ALA 124 9.516 5.979 7.729 1083 HB1 ALA 124 3HB ALA 124 8.630 3.744 8.328 1084 HB2 ALA 124 1HB ALA 124 9.598 3.015 7.035 1085 HB3 ALA 124 2HB ALA 124 8.296 4.140 6.643 1086 H GLY 125 H GLY 125 12.175 3.742 7.061 1087 HA2 GLY 125 2HA GLY 125 13.085 3.253 9.683 1088 HA3 GLY 125 3HA GLY 125 14.032 3.098 8.214 1089 H SER 126 H SER 126 13.810 5.866 7.402 1090 HA SER 126 HA SER 126 16.000 7.009 8.823 1091 HB2 SER 126 2HB SER 126 14.064 8.315 6.860 1092 HB3 SER 126 3HB SER 126 15.599 9.007 7.389 1093 HG SER 126 HG SER 126 15.716 6.439 6.331 1094 H LEU 127 H LEU 127 12.524 7.267 9.056 1095 HA LEU 127 HA LEU 127 12.485 9.610 10.759 1096 HB2 LEU 127 2HB LEU 127 10.265 7.698 9.919 1097 HB3 LEU 127 3HB LEU 127 10.015 9.195 10.804 1098 HG LEU 127 HG LEU 127 11.083 8.970 7.961 1099 HD11 LEU 127 1HD1 LEU 127 8.390 9.964 8.945 1100 HD12 LEU 127 2HD1 LEU 127 8.702 8.448 8.096 1101 HD13 LEU 127 3HD1 LEU 127 8.956 9.983 7.271 1102 HD21 LEU 127 3HD2 LEU 127 10.530 11.477 9.589 1103 HD22 LEU 127 1HD2 LEU 127 10.933 11.436 7.870 1104 HD23 LEU 127 2HD2 LEU 127 12.109 10.891 9.062 1105 H GLU 128 H GLU 128 12.153 6.091 11.143 1106 HA GLU 128 HA GLU 128 11.375 6.079 13.890 1107 HB2 GLU 128 2HB GLU 128 12.705 3.907 12.204 1108 HB3 GLU 128 3HB GLU 128 12.092 3.654 13.836 1109 HG2 GLU 128 2HG GLU 128 10.484 4.352 11.379 1110 HG3 GLU 128 3HG GLU 128 10.486 2.822 12.251 1111 H HIS 129 H HIS 129 14.496 5.637 12.257 1112 HA HIS 129 HA HIS 129 15.972 5.357 14.737 1113 HB2 HIS 129 2HB HIS 129 16.958 5.572 11.855 1114 HB3 HIS 129 3HB HIS 129 17.971 5.197 13.248 1115 HD1 HIS 129 HD1 HIS 129 16.564 3.031 14.678 1116 HD2 HIS 129 HD2 HIS 129 16.561 3.227 10.529 1117 HE1 HIS 129 HE1 HIS 129 16.016 0.709 13.900 1118 HE2 HIS 129 HE2 HIS 129 15.862 0.903 11.399 1119 H HIS 130 H HIS 130 17.957 6.701 15.042 1120 HA HIS 130 HA HIS 130 17.252 9.341 15.617 1121 HB2 HIS 130 2HB HIS 130 19.596 9.677 16.307 1122 HB3 HIS 130 3HB HIS 130 18.997 8.131 16.890 1123 HD1 HIS 130 HD1 HIS 130 21.985 9.441 15.781 1124 HD2 HIS 130 HD2 HIS 130 19.865 6.055 14.638 1125 HE1 HIS 130 HE1 HIS 130 23.663 7.933 14.692 1126 HE2 HIS 130 HE2 HIS 130 22.383 5.849 14.119 1127 H HIS 131 H HIS 131 17.021 10.996 14.333 1128 HA HIS 131 HA HIS 131 17.766 11.117 11.583 1129 HB2 HIS 131 2HB HIS 131 16.954 13.498 13.311 1130 HB3 HIS 131 3HB HIS 131 16.737 13.308 11.571 1131 HD1 HIS 131 HD1 HIS 131 14.932 13.098 14.644 1132 HD2 HIS 131 HD2 HIS 131 14.788 11.023 11.044 1133 HE1 HIS 131 HE1 HIS 131 12.691 11.973 14.607 1134 HE2 HIS 131 HE2 HIS 131 12.713 10.579 12.522 1135 H HIS 132 H HIS 132 19.077 12.395 14.561 1136 HA HIS 132 HA HIS 132 21.242 13.917 13.414 1137 HB2 HIS 132 2HB HIS 132 20.658 12.984 16.264 1138 HB3 HIS 132 3HB HIS 132 22.017 14.018 15.836 1139 HD1 HIS 132 HD1 HIS 132 21.524 16.397 16.391 1140 HD2 HIS 132 HD2 HIS 132 18.082 14.361 15.246 1141 HE1 HIS 132 HE1 HIS 132 19.661 18.078 16.523 1142 HE2 HIS 132 HE2 HIS 132 17.618 16.852 15.716 1143 H HIS 133 H HIS 133 22.364 12.477 12.093 1144 HA HIS 133 HA HIS 133 23.465 9.983 13.191 1145 HB2 HIS 133 2HB HIS 133 24.072 9.472 10.849 1146 HB3 HIS 133 3HB HIS 133 22.372 9.884 10.984 1147 HD1 HIS 133 HD1 HIS 133 21.548 11.971 9.701 1148 HD2 HIS 133 HD2 HIS 133 25.642 11.311 9.335 1149 HE1 HIS 133 HE1 HIS 133 22.311 13.431 7.808 1150 HE2 HIS 133 HE2 HIS 133 24.750 12.908 7.520 1151 H HIS 134 H HIS 134 24.388 12.605 14.112 1152 HA HIS 134 HA HIS 134 27.113 12.909 13.152 1153 HB2 HIS 134 2HB HIS 134 25.893 14.951 13.616 1154 HB3 HIS 134 3HB HIS 134 25.482 14.412 15.241 1155 HD1 HIS 134 HD1 HIS 134 27.262 14.664 17.052 1156 HD2 HIS 134 HD2 HIS 134 28.560 15.926 13.315 1157 HE1 HIS 134 HE1 HIS 134 29.384 15.924 17.476 1158 HE2 HIS 134 HE2 HIS 134 30.074 16.801 15.218 Start of MODEL 17 1 H1 MET 1 1H MET 1 1.552 8.342 16.671 2 H2 MET 1 2H MET 1 0.042 7.898 16.063 3 H3 MET 1 3H MET 1 0.480 9.528 16.125 4 HA MET 1 HA MET 1 0.619 8.666 13.898 5 HB2 MET 1 2HB MET 1 2.170 10.483 14.548 6 HB3 MET 1 3HB MET 1 3.324 9.313 15.171 7 HG2 MET 1 2HG MET 1 3.633 8.431 12.869 8 HG3 MET 1 3HG MET 1 2.519 9.659 12.270 9 HE1 MET 1 3HE MET 1 6.042 10.871 10.974 10 HE2 MET 1 1HE MET 1 4.381 10.521 10.492 11 HE3 MET 1 2HE MET 1 5.425 9.224 11.082 12 H LYS 2 H LYS 2 1.194 7.051 12.503 13 HA LYS 2 HA LYS 2 3.362 5.227 12.995 14 HB2 LYS 2 2HB LYS 2 2.055 3.144 12.874 15 HB3 LYS 2 3HB LYS 2 1.608 4.090 14.286 16 HG2 LYS 2 2HG LYS 2 -0.383 4.944 12.889 17 HG3 LYS 2 3HG LYS 2 0.005 3.650 11.754 18 HD2 LYS 2 2HD LYS 2 -0.712 3.307 14.693 19 HD3 LYS 2 3HD LYS 2 -1.764 2.953 13.324 20 HE2 LYS 2 2HE LYS 2 -0.275 1.137 12.613 21 HE3 LYS 2 3HE LYS 2 0.860 1.531 13.910 22 HZ1 LYS 2 3HZ LYS 2 -0.561 -0.334 14.496 23 HZ2 LYS 2 1HZ LYS 2 -1.940 0.622 14.300 24 HZ3 LYS 2 2HZ LYS 2 -0.835 0.976 15.527 25 H ILE 3 H ILE 3 3.647 3.757 11.106 26 HA ILE 3 HA ILE 3 2.987 5.235 8.626 27 HB ILE 3 HB ILE 3 5.372 3.407 9.208 28 HG12 ILE 3 2HG1 ILE 3 5.297 6.461 8.968 29 HG13 ILE 3 3HG1 ILE 3 5.388 5.588 10.492 30 HG21 ILE 3 1HG2 ILE 3 6.287 4.246 7.059 31 HG22 ILE 3 2HG2 ILE 3 4.802 5.152 6.776 32 HG23 ILE 3 3HG2 ILE 3 4.763 3.389 6.815 33 HD11 ILE 3 3HD1 ILE 3 7.544 6.440 9.874 34 HD12 ILE 3 1HD1 ILE 3 7.476 5.608 8.320 35 HD13 ILE 3 2HD1 ILE 3 7.567 4.678 9.818 36 H LEU 4 H LEU 4 1.713 4.241 7.188 37 HA LEU 4 HA LEU 4 1.350 1.304 7.253 38 HB2 LEU 4 2HB LEU 4 -0.670 3.420 6.370 39 HB3 LEU 4 3HB LEU 4 -0.944 1.685 6.447 40 HG LEU 4 HG LEU 4 -0.501 3.520 8.840 41 HD11 LEU 4 1HD1 LEU 4 -2.690 3.853 7.805 42 HD12 LEU 4 2HD1 LEU 4 -2.849 3.078 9.379 43 HD13 LEU 4 3HD1 LEU 4 -3.023 2.119 7.906 44 HD21 LEU 4 3HD2 LEU 4 -1.088 0.538 8.811 45 HD22 LEU 4 1HD2 LEU 4 -1.052 1.568 10.246 46 HD23 LEU 4 2HD2 LEU 4 0.421 1.303 9.315 47 H ILE 5 H ILE 5 2.541 0.523 5.573 48 HA ILE 5 HA ILE 5 2.778 1.961 3.037 49 HB ILE 5 HB ILE 5 3.720 -0.878 3.699 50 HG12 ILE 5 2HG1 ILE 5 4.786 0.771 5.228 51 HG13 ILE 5 3HG1 ILE 5 5.953 0.051 4.130 52 HG21 ILE 5 1HG2 ILE 5 4.530 0.993 1.428 53 HG22 ILE 5 2HG2 ILE 5 3.563 -0.478 1.282 54 HG23 ILE 5 3HG2 ILE 5 5.255 -0.581 1.764 55 HD11 ILE 5 3HD1 ILE 5 4.757 2.806 3.895 56 HD12 ILE 5 1HD1 ILE 5 5.927 2.095 2.780 57 HD13 ILE 5 2HD1 ILE 5 6.378 2.402 4.457 58 H LEU 6 H LEU 6 0.998 1.926 1.757 59 HA LEU 6 HA LEU 6 -0.852 -0.378 1.797 60 HB2 LEU 6 2HB LEU 6 -1.467 2.228 1.971 61 HB3 LEU 6 3HB LEU 6 -1.300 2.194 0.231 62 HG LEU 6 HG LEU 6 -3.636 1.987 0.707 63 HD11 LEU 6 1HD1 LEU 6 -2.723 -0.831 0.058 64 HD12 LEU 6 2HD1 LEU 6 -2.948 0.485 -1.095 65 HD13 LEU 6 3HD1 LEU 6 -4.335 -0.156 -0.222 66 HD21 LEU 6 3HD2 LEU 6 -4.625 0.347 2.220 67 HD22 LEU 6 1HD2 LEU 6 -3.482 1.388 3.067 68 HD23 LEU 6 2HD2 LEU 6 -3.022 -0.263 2.639 69 H ILE 7 H ILE 7 -0.662 -1.857 0.146 70 HA ILE 7 HA ILE 7 0.564 -1.036 -2.425 71 HB ILE 7 HB ILE 7 1.101 -3.662 -0.945 72 HG12 ILE 7 2HG1 ILE 7 2.962 -1.315 -1.570 73 HG13 ILE 7 3HG1 ILE 7 2.346 -1.741 0.020 74 HG21 ILE 7 1HG2 ILE 7 0.987 -4.045 -3.384 75 HG22 ILE 7 2HG2 ILE 7 2.643 -4.220 -2.805 76 HG23 ILE 7 3HG2 ILE 7 2.159 -2.751 -3.653 77 HD11 ILE 7 3HD1 ILE 7 3.611 -3.834 -0.063 78 HD12 ILE 7 1HD1 ILE 7 4.636 -2.409 -0.219 79 HD13 ILE 7 2HD1 ILE 7 4.254 -3.373 -1.644 80 H ASN 8 H ASN 8 -0.680 -1.445 -4.113 81 HA ASN 8 HA ASN 8 -2.614 -3.695 -4.111 82 HB2 ASN 8 2HB ASN 8 -3.845 -1.581 -4.242 83 HB3 ASN 8 3HB ASN 8 -2.796 -0.986 -5.517 84 HD21 ASN 8 1HD2 ASN 8 -5.477 -3.093 -4.764 85 HD22 ASN 8 2HD2 ASN 8 -5.939 -3.427 -6.393 86 H THR 9 H THR 9 -1.688 -5.257 -5.282 87 HA THR 9 HA THR 9 -0.596 -4.582 -7.954 88 HB THR 9 HB THR 9 1.307 -5.356 -6.682 89 HG1 THR 9 HG1 THR 9 1.942 -6.743 -8.163 90 HG21 THR 9 3HG2 THR 9 0.180 -6.502 -4.814 91 HG22 THR 9 1HG2 THR 9 1.416 -7.533 -5.538 92 HG23 THR 9 2HG2 THR 9 -0.288 -7.818 -5.895 93 H ASN 10 H ASN 10 -1.346 -5.847 -9.654 94 HA ASN 10 HA ASN 10 -3.799 -7.321 -9.295 95 HB2 ASN 10 2HB ASN 10 -2.039 -7.345 -11.786 96 HB3 ASN 10 3HB ASN 10 -3.756 -7.701 -11.691 97 HD21 ASN 10 1HD2 ASN 10 -4.260 -5.254 -9.975 98 HD22 ASN 10 2HD2 ASN 10 -4.148 -3.934 -11.084 99 H ASN 11 H ASN 11 -0.438 -8.003 -9.293 100 HA ASN 11 HA ASN 11 -0.682 -10.845 -10.010 101 HB2 ASN 11 2HB ASN 11 1.814 -9.133 -9.639 102 HB3 ASN 11 3HB ASN 11 1.769 -10.779 -10.265 103 HD21 ASN 11 1HD2 ASN 11 2.872 -8.461 -11.565 104 HD22 ASN 11 2HD2 ASN 11 1.998 -8.247 -13.040 105 H ASP 12 H ASP 12 -1.049 -12.150 -8.313 106 HA ASP 12 HA ASP 12 -0.537 -11.640 -5.596 107 HB2 ASP 12 2HB ASP 12 -0.894 -14.325 -6.989 108 HB3 ASP 12 3HB ASP 12 -0.936 -14.093 -5.241 109 H GLU 13 H GLU 13 1.571 -12.779 -8.066 110 HA GLU 13 HA GLU 13 3.573 -14.125 -6.704 111 HB2 GLU 13 2HB GLU 13 3.872 -12.187 -9.043 112 HB3 GLU 13 3HB GLU 13 5.059 -13.400 -8.561 113 HG2 GLU 13 2HG GLU 13 3.371 -15.186 -9.028 114 HG3 GLU 13 3HG GLU 13 2.257 -13.946 -9.594 115 H LEU 14 H LEU 14 3.244 -10.624 -7.271 116 HA LEU 14 HA LEU 14 5.535 -9.880 -5.763 117 HB2 LEU 14 2HB LEU 14 3.185 -8.240 -6.769 118 HB3 LEU 14 3HB LEU 14 4.427 -7.531 -5.749 119 HG LEU 14 HG LEU 14 5.034 -6.976 -7.976 120 HD11 LEU 14 1HD1 LEU 14 6.798 -9.320 -7.195 121 HD12 LEU 14 2HD1 LEU 14 6.930 -7.668 -6.581 122 HD13 LEU 14 3HD1 LEU 14 7.211 -7.995 -8.285 123 HD21 LEU 14 3HD2 LEU 14 4.706 -9.888 -8.764 124 HD22 LEU 14 1HD2 LEU 14 5.282 -8.586 -9.812 125 HD23 LEU 14 2HD2 LEU 14 3.633 -8.554 -9.196 126 H ILE 15 H ILE 15 2.173 -10.428 -4.825 127 HA ILE 15 HA ILE 15 2.124 -9.089 -2.365 128 HB ILE 15 HB ILE 15 0.733 -11.706 -3.122 129 HG12 ILE 15 2HG1 ILE 15 -0.259 -8.814 -3.108 130 HG13 ILE 15 3HG1 ILE 15 0.056 -9.801 -4.531 131 HG21 ILE 15 1HG2 ILE 15 0.841 -11.535 -0.661 132 HG22 ILE 15 2HG2 ILE 15 -0.812 -11.318 -1.227 133 HG23 ILE 15 3HG2 ILE 15 0.138 -9.918 -0.727 134 HD11 ILE 15 3HD1 ILE 15 -1.787 -11.302 -3.860 135 HD12 ILE 15 1HD1 ILE 15 -2.305 -9.641 -4.142 136 HD13 ILE 15 2HD1 ILE 15 -2.124 -10.235 -2.492 137 H LYS 16 H LYS 16 2.970 -12.548 -2.931 138 HA LYS 16 HA LYS 16 3.761 -13.046 -0.246 139 HB2 LYS 16 2HB LYS 16 4.592 -15.213 -1.047 140 HB3 LYS 16 3HB LYS 16 3.002 -14.857 -1.707 141 HG2 LYS 16 2HG LYS 16 4.020 -14.229 -3.873 142 HG3 LYS 16 3HG LYS 16 5.626 -14.551 -3.212 143 HD2 LYS 16 2HD LYS 16 4.904 -16.441 -4.578 144 HD3 LYS 16 3HD LYS 16 5.007 -16.936 -2.888 145 HE2 LYS 16 2HE LYS 16 2.993 -17.863 -3.949 146 HE3 LYS 16 3HE LYS 16 2.545 -16.708 -2.690 147 HZ1 LYS 16 3HZ LYS 16 2.139 -15.049 -4.375 148 HZ2 LYS 16 1HZ LYS 16 1.247 -16.438 -4.718 149 HZ3 LYS 16 2HZ LYS 16 2.644 -16.103 -5.599 150 H LYS 17 H LYS 17 5.618 -12.059 -3.131 151 HA LYS 17 HA LYS 17 8.205 -12.536 -1.984 152 HB2 LYS 17 2HB LYS 17 7.342 -10.832 -4.349 153 HB3 LYS 17 3HB LYS 17 9.025 -11.151 -3.925 154 HG2 LYS 17 2HG LYS 17 8.626 -13.594 -4.215 155 HG3 LYS 17 3HG LYS 17 6.959 -13.249 -4.684 156 HD2 LYS 17 2HD LYS 17 8.370 -13.650 -6.657 157 HD3 LYS 17 3HD LYS 17 7.748 -11.997 -6.648 158 HE2 LYS 17 2HE LYS 17 10.128 -12.102 -7.324 159 HE3 LYS 17 3HE LYS 17 9.908 -11.166 -5.846 160 HZ1 LYS 17 3HZ LYS 17 10.867 -13.966 -6.029 161 HZ2 LYS 17 1HZ LYS 17 10.583 -13.139 -4.584 162 HZ3 LYS 17 2HZ LYS 17 11.790 -12.613 -5.633 163 H ILE 18 H ILE 18 6.169 -9.638 -2.192 164 HA ILE 18 HA ILE 18 7.974 -7.789 -0.999 165 HB ILE 18 HB ILE 18 4.931 -7.775 -1.270 166 HG12 ILE 18 2HG1 ILE 18 7.061 -6.071 -2.667 167 HG13 ILE 18 3HG1 ILE 18 6.319 -7.507 -3.362 168 HG21 ILE 18 1HG2 ILE 18 5.459 -6.476 0.749 169 HG22 ILE 18 2HG2 ILE 18 4.915 -5.414 -0.546 170 HG23 ILE 18 3HG2 ILE 18 6.632 -5.516 -0.155 171 HD11 ILE 18 3HD1 ILE 18 4.136 -6.394 -3.337 172 HD12 ILE 18 1HD1 ILE 18 5.333 -5.503 -4.275 173 HD13 ILE 18 2HD1 ILE 18 4.886 -4.944 -2.664 174 H LYS 19 H LYS 19 5.553 -10.050 0.312 175 HA LYS 19 HA LYS 19 5.544 -9.315 3.004 176 HB2 LYS 19 2HB LYS 19 5.269 -12.066 1.735 177 HB3 LYS 19 3HB LYS 19 5.038 -11.787 3.459 178 HG2 LYS 19 2HG LYS 19 3.223 -10.167 2.908 179 HG3 LYS 19 3HG LYS 19 3.403 -10.591 1.209 180 HD2 LYS 19 2HD LYS 19 2.769 -12.923 1.705 181 HD3 LYS 19 3HD LYS 19 2.657 -12.538 3.428 182 HE2 LYS 19 2HE LYS 19 0.859 -10.883 2.880 183 HE3 LYS 19 3HE LYS 19 0.924 -11.423 1.206 184 HZ1 LYS 19 3HZ LYS 19 -0.854 -12.497 2.341 185 HZ2 LYS 19 1HZ LYS 19 0.175 -13.050 3.563 186 HZ3 LYS 19 2HZ LYS 19 0.329 -13.654 1.993 187 H LYS 20 H LYS 20 7.878 -11.270 1.223 188 HA LYS 20 HA LYS 20 9.494 -12.059 3.442 189 HB2 LYS 20 2HB LYS 20 10.229 -11.821 0.491 190 HB3 LYS 20 3HB LYS 20 11.128 -12.725 1.705 191 HG2 LYS 20 2HG LYS 20 8.309 -13.353 0.762 192 HG3 LYS 20 3HG LYS 20 9.770 -14.198 0.259 193 HD2 LYS 20 2HD LYS 20 8.612 -14.140 3.076 194 HD3 LYS 20 3HD LYS 20 8.546 -15.497 1.948 195 HE2 LYS 20 2HE LYS 20 11.034 -14.332 3.245 196 HE3 LYS 20 3HE LYS 20 10.308 -15.906 3.565 197 HZ1 LYS 20 3HZ LYS 20 11.560 -15.047 1.012 198 HZ2 LYS 20 1HZ LYS 20 10.835 -16.549 1.283 199 HZ3 LYS 20 2HZ LYS 20 12.224 -16.113 2.140 200 H GLU 21 H GLU 21 9.877 -9.559 0.937 201 HA GLU 21 HA GLU 21 12.205 -8.300 1.707 202 HB2 GLU 21 2HB GLU 21 9.719 -6.896 0.643 203 HB3 GLU 21 3HB GLU 21 11.350 -6.232 0.609 204 HG2 GLU 21 2HG GLU 21 10.324 -8.637 -0.921 205 HG3 GLU 21 3HG GLU 21 10.757 -7.065 -1.585 206 H VAL 22 H VAL 22 9.004 -7.844 3.117 207 HA VAL 22 HA VAL 22 9.963 -5.677 4.880 208 HB VAL 22 HB VAL 22 7.652 -5.108 5.238 209 HG11 VAL 22 1HG1 VAL 22 8.639 -4.307 3.138 210 HG12 VAL 22 2HG1 VAL 22 6.924 -4.611 2.928 211 HG13 VAL 22 3HG1 VAL 22 8.100 -5.760 2.298 212 HG21 VAL 22 3HG2 VAL 22 5.768 -6.404 4.229 213 HG22 VAL 22 1HG2 VAL 22 6.645 -7.322 5.459 214 HG23 VAL 22 2HG2 VAL 22 6.914 -7.657 3.749 215 H GLU 23 H GLU 23 9.431 -9.013 4.984 216 HA GLU 23 HA GLU 23 8.474 -9.541 7.573 217 HB2 GLU 23 2HB GLU 23 8.810 -11.239 5.752 218 HB3 GLU 23 3HB GLU 23 10.548 -11.111 5.977 219 HG2 GLU 23 2HG GLU 23 10.163 -11.900 8.376 220 HG3 GLU 23 3HG GLU 23 8.502 -12.258 7.898 221 H ASN 24 H ASN 24 11.745 -9.041 6.346 222 HA ASN 24 HA ASN 24 13.041 -9.228 8.949 223 HB2 ASN 24 2HB ASN 24 14.218 -8.444 6.248 224 HB3 ASN 24 3HB ASN 24 15.129 -8.886 7.691 225 HD21 ASN 24 1HD2 ASN 24 15.079 -10.085 4.996 226 HD22 ASN 24 2HD2 ASN 24 14.689 -11.751 5.241 227 H GLN 25 H GLN 25 11.246 -6.842 7.605 228 HA GLN 25 HA GLN 25 12.791 -4.635 8.837 229 HB2 GLN 25 2HB GLN 25 10.633 -4.556 6.679 230 HB3 GLN 25 3HB GLN 25 11.382 -3.137 7.395 231 HG2 GLN 25 2HG GLN 25 12.827 -5.244 5.766 232 HG3 GLN 25 3HG GLN 25 12.302 -3.672 5.175 233 HE21 GLN 25 1HE2 GLN 25 14.610 -5.349 7.180 234 HE22 GLN 25 2HE2 GLN 25 15.696 -4.024 7.378 235 H GLY 26 H GLY 26 10.296 -6.728 9.475 236 HA2 GLY 26 2HA GLY 26 8.754 -6.841 11.147 237 HA3 GLY 26 3HA GLY 26 9.404 -5.337 11.770 238 H TYR 27 H TYR 27 7.727 -6.056 8.693 239 HA TYR 27 HA TYR 27 5.529 -4.208 9.460 240 HB2 TYR 27 2HB TYR 27 6.452 -5.185 6.721 241 HB3 TYR 27 3HB TYR 27 4.954 -4.301 6.970 242 HD1 TYR 27 HD2 TYR 27 8.669 -3.992 7.434 243 HD2 TYR 27 HD1 TYR 27 4.964 -1.937 6.888 244 HE1 TYR 27 HE2 TYR 27 9.884 -1.877 7.141 245 HE2 TYR 27 HE1 TYR 27 6.185 0.171 6.601 246 HH TYR 27 HH TYR 27 9.555 0.319 6.142 247 H GLN 28 H GLN 28 3.742 -5.244 10.179 248 HA GLN 28 HA GLN 28 3.109 -7.987 9.584 249 HB2 GLN 28 2HB GLN 28 1.371 -5.768 10.754 250 HB3 GLN 28 3HB GLN 28 0.878 -7.452 10.627 251 HG2 GLN 28 2HG GLN 28 2.858 -8.021 12.126 252 HG3 GLN 28 3HG GLN 28 3.046 -6.284 12.389 253 HE21 GLN 28 1HE2 GLN 28 2.519 -6.346 14.582 254 HE22 GLN 28 2HE2 GLN 28 0.937 -6.724 15.170 255 H VAL 29 H VAL 29 2.638 -8.485 7.454 256 HA VAL 29 HA VAL 29 1.249 -6.617 5.724 257 HB VAL 29 HB VAL 29 1.906 -9.544 5.156 258 HG11 VAL 29 1HG1 VAL 29 0.117 -8.669 3.695 259 HG12 VAL 29 2HG1 VAL 29 1.601 -8.902 2.771 260 HG13 VAL 29 3HG1 VAL 29 1.120 -7.279 3.267 261 HG21 VAL 29 3HG2 VAL 29 3.470 -7.035 4.439 262 HG22 VAL 29 1HG2 VAL 29 3.856 -8.674 3.907 263 HG23 VAL 29 2HG2 VAL 29 3.950 -8.258 5.619 264 H ARG 30 H ARG 30 -0.870 -6.461 5.495 265 HA ARG 30 HA ARG 30 -2.686 -8.469 6.710 266 HB2 ARG 30 2HB ARG 30 -2.910 -5.431 6.491 267 HB3 ARG 30 3HB ARG 30 -4.184 -6.473 7.095 268 HG2 ARG 30 2HG ARG 30 -1.453 -6.154 8.373 269 HG3 ARG 30 3HG ARG 30 -2.934 -5.354 8.907 270 HD2 ARG 30 2HD ARG 30 -2.417 -8.347 8.884 271 HD3 ARG 30 3HD ARG 30 -2.458 -7.302 10.306 272 HE ARG 30 HE ARG 30 -4.906 -6.978 9.052 273 HH11 ARG 30 1HH1 ARG 30 -3.206 -9.688 10.536 274 HH12 ARG 30 2HH1 ARG 30 -4.671 -10.499 10.991 275 HH21 ARG 30 1HH2 ARG 30 -6.801 -8.057 9.650 276 HH22 ARG 30 2HH2 ARG 30 -6.702 -9.574 10.493 277 H ASP 31 H ASP 31 -3.997 -9.430 5.265 278 HA ASP 31 HA ASP 31 -4.106 -8.427 2.479 279 HB2 ASP 31 2HB ASP 31 -4.691 -11.189 3.649 280 HB3 ASP 31 3HB ASP 31 -4.824 -10.781 1.940 281 H VAL 32 H VAL 32 -5.902 -7.462 1.807 282 HA VAL 32 HA VAL 32 -8.480 -7.862 3.224 283 HB VAL 32 HB VAL 32 -7.521 -5.272 1.898 284 HG11 VAL 32 1HG1 VAL 32 -9.972 -5.506 1.922 285 HG12 VAL 32 2HG1 VAL 32 -9.465 -4.242 3.043 286 HG13 VAL 32 3HG1 VAL 32 -9.946 -5.824 3.660 287 HG21 VAL 32 3HG2 VAL 32 -7.208 -4.381 4.192 288 HG22 VAL 32 1HG2 VAL 32 -6.129 -5.740 3.864 289 HG23 VAL 32 2HG2 VAL 32 -7.569 -5.975 4.859 290 H ASN 33 H ASN 33 -9.855 -8.896 1.925 291 HA ASN 33 HA ASN 33 -10.098 -8.164 -0.940 292 HB2 ASN 33 2HB ASN 33 -10.336 -10.964 0.268 293 HB3 ASN 33 3HB ASN 33 -10.632 -10.562 -1.417 294 HD21 ASN 33 1HD2 ASN 33 -8.167 -10.946 1.048 295 HD22 ASN 33 2HD2 ASN 33 -6.820 -11.016 -0.035 296 H ASP 34 H ASP 34 -11.535 -7.815 1.921 297 HA ASP 34 HA ASP 34 -14.292 -8.012 0.911 298 HB2 ASP 34 2HB ASP 34 -13.858 -10.124 2.128 299 HB3 ASP 34 3HB ASP 34 -13.304 -9.226 3.533 300 H SER 35 H SER 35 -15.695 -6.468 1.802 301 HA SER 35 HA SER 35 -14.528 -4.027 2.629 302 HB2 SER 35 2HB SER 35 -17.472 -4.809 2.551 303 HB3 SER 35 3HB SER 35 -16.827 -3.165 2.552 304 HG SER 35 HG SER 35 -16.026 -3.465 0.533 305 H ASP 36 H ASP 36 -16.395 -6.470 4.418 306 HA ASP 36 HA ASP 36 -16.596 -4.972 6.856 307 HB2 ASP 36 2HB ASP 36 -18.160 -6.839 6.264 308 HB3 ASP 36 3HB ASP 36 -16.843 -7.989 6.454 309 H GLU 37 H GLU 37 -14.290 -7.287 5.514 310 HA GLU 37 HA GLU 37 -12.615 -7.505 7.823 311 HB2 GLU 37 2HB GLU 37 -11.998 -8.026 4.886 312 HB3 GLU 37 3HB GLU 37 -10.887 -8.381 6.207 313 HG2 GLU 37 2HG GLU 37 -13.598 -9.639 5.728 314 HG3 GLU 37 3HG GLU 37 -12.025 -10.412 5.544 315 H LEU 38 H LEU 38 -12.731 -5.298 5.072 316 HA LEU 38 HA LEU 38 -10.438 -3.769 5.562 317 HB2 LEU 38 2HB LEU 38 -11.630 -3.453 3.530 318 HB3 LEU 38 3HB LEU 38 -13.137 -3.110 4.346 319 HG LEU 38 HG LEU 38 -10.919 -1.126 4.834 320 HD11 LEU 38 1HD1 LEU 38 -11.278 0.057 2.736 321 HD12 LEU 38 2HD1 LEU 38 -12.335 -1.233 2.160 322 HD13 LEU 38 3HD1 LEU 38 -10.622 -1.553 2.444 323 HD21 LEU 38 3HD2 LEU 38 -13.160 -0.753 5.810 324 HD22 LEU 38 1HD2 LEU 38 -13.877 -0.756 4.195 325 HD23 LEU 38 2HD2 LEU 38 -12.748 0.519 4.663 326 H LYS 39 H LYS 39 -13.743 -3.452 6.886 327 HA LYS 39 HA LYS 39 -13.226 -1.204 8.545 328 HB2 LYS 39 2HB LYS 39 -15.382 -3.336 8.823 329 HB3 LYS 39 3HB LYS 39 -15.359 -1.809 9.700 330 HG2 LYS 39 2HG LYS 39 -15.431 -0.620 7.467 331 HG3 LYS 39 3HG LYS 39 -15.664 -2.189 6.702 332 HD2 LYS 39 2HD LYS 39 -17.540 -0.965 8.766 333 HD3 LYS 39 3HD LYS 39 -17.784 -0.895 7.025 334 HE2 LYS 39 2HE LYS 39 -19.182 -2.649 7.736 335 HE3 LYS 39 3HE LYS 39 -17.769 -3.479 7.094 336 HZ1 LYS 39 3HZ LYS 39 -18.333 -2.961 9.966 337 HZ2 LYS 39 1HZ LYS 39 -16.977 -3.771 9.368 338 HZ3 LYS 39 2HZ LYS 39 -18.516 -4.436 9.176 339 H LYS 40 H LYS 40 -12.694 -4.659 9.038 340 HA LYS 40 HA LYS 40 -12.166 -4.678 11.824 341 HB2 LYS 40 2HB LYS 40 -10.817 -6.361 9.664 342 HB3 LYS 40 3HB LYS 40 -10.760 -6.689 11.386 343 HG2 LYS 40 2HG LYS 40 -13.240 -6.796 9.657 344 HG3 LYS 40 3HG LYS 40 -12.277 -8.181 10.167 345 HD2 LYS 40 2HD LYS 40 -12.829 -7.150 12.612 346 HD3 LYS 40 3HD LYS 40 -14.226 -6.518 11.735 347 HE2 LYS 40 2HE LYS 40 -13.404 -9.426 12.003 348 HE3 LYS 40 3HE LYS 40 -14.804 -8.652 12.739 349 HZ1 LYS 40 3HZ LYS 40 -15.753 -8.337 10.561 350 HZ2 LYS 40 1HZ LYS 40 -15.378 -9.967 10.785 351 HZ3 LYS 40 2HZ LYS 40 -14.388 -9.000 9.818 352 H GLU 41 H GLU 41 -10.080 -4.143 8.983 353 HA GLU 41 HA GLU 41 -7.606 -3.954 10.313 354 HB2 GLU 41 2HB GLU 41 -8.286 -2.538 7.699 355 HB3 GLU 41 3HB GLU 41 -6.697 -3.076 8.238 356 HG2 GLU 41 2HG GLU 41 -9.013 -4.857 7.463 357 HG3 GLU 41 3HG GLU 41 -7.615 -4.496 6.468 358 H MET 42 H MET 42 -9.837 -1.401 9.201 359 HA MET 42 HA MET 42 -8.190 0.797 9.813 360 HB2 MET 42 2HB MET 42 -11.232 0.818 9.673 361 HB3 MET 42 3HB MET 42 -10.161 2.202 9.481 362 HG2 MET 42 2HG MET 42 -10.639 -0.085 7.581 363 HG3 MET 42 3HG MET 42 -10.785 1.643 7.282 364 HE1 MET 42 3HE MET 42 -6.913 2.611 7.288 365 HE2 MET 42 1HE MET 42 -8.066 2.675 8.616 366 HE3 MET 42 2HE MET 42 -8.527 3.272 7.019 367 H LYS 43 H LYS 43 -10.437 -1.030 11.772 368 HA LYS 43 HA LYS 43 -10.441 0.688 14.046 369 HB2 LYS 43 2HB LYS 43 -11.054 -2.271 13.707 370 HB3 LYS 43 3HB LYS 43 -11.156 -1.469 15.271 371 HG2 LYS 43 2HG LYS 43 -12.781 -0.764 12.805 372 HG3 LYS 43 3HG LYS 43 -13.366 -1.662 14.204 373 HD2 LYS 43 2HD LYS 43 -12.445 1.243 14.203 374 HD3 LYS 43 3HD LYS 43 -14.115 0.680 14.279 375 HE2 LYS 43 2HE LYS 43 -13.661 -0.390 16.461 376 HE3 LYS 43 3HE LYS 43 -11.986 0.157 16.386 377 HZ1 LYS 43 3HZ LYS 43 -12.719 2.421 16.469 378 HZ2 LYS 43 1HZ LYS 43 -13.407 1.580 17.764 379 HZ3 LYS 43 2HZ LYS 43 -14.343 1.959 16.410 380 H LYS 44 H LYS 44 -8.621 -2.332 13.321 381 HA LYS 44 HA LYS 44 -7.291 -2.421 15.826 382 HB2 LYS 44 2HB LYS 44 -6.588 -3.833 13.210 383 HB3 LYS 44 3HB LYS 44 -5.918 -4.238 14.789 384 HG2 LYS 44 2HG LYS 44 -8.848 -4.409 14.064 385 HG3 LYS 44 3HG LYS 44 -7.727 -5.773 14.123 386 HD2 LYS 44 2HD LYS 44 -7.413 -5.507 16.515 387 HD3 LYS 44 3HD LYS 44 -8.308 -3.984 16.520 388 HE2 LYS 44 2HE LYS 44 -9.460 -6.715 15.910 389 HE3 LYS 44 3HE LYS 44 -9.665 -5.811 17.411 390 HZ1 LYS 44 3HZ LYS 44 -10.651 -5.031 14.725 391 HZ2 LYS 44 1HZ LYS 44 -10.743 -4.041 16.098 392 HZ3 LYS 44 2HZ LYS 44 -11.587 -5.508 16.049 393 H LEU 45 H LEU 45 -6.272 -1.129 12.694 394 HA LEU 45 HA LEU 45 -3.602 -0.475 13.251 395 HB2 LEU 45 2HB LEU 45 -5.580 1.020 11.483 396 HB3 LEU 45 3HB LEU 45 -3.835 1.235 11.439 397 HG LEU 45 HG LEU 45 -5.316 -1.324 10.708 398 HD11 LEU 45 1HD1 LEU 45 -4.666 -0.863 8.400 399 HD12 LEU 45 2HD1 LEU 45 -3.932 0.664 8.889 400 HD13 LEU 45 3HD1 LEU 45 -5.676 0.431 9.046 401 HD21 LEU 45 3HD2 LEU 45 -3.144 -2.169 9.924 402 HD22 LEU 45 1HD2 LEU 45 -3.129 -1.845 11.658 403 HD23 LEU 45 2HD2 LEU 45 -2.346 -0.722 10.542 404 H ALA 46 H ALA 46 -6.599 1.224 13.967 405 HA ALA 46 HA ALA 46 -5.298 3.583 15.034 406 HB1 ALA 46 3HB ALA 46 -8.232 2.805 15.012 407 HB2 ALA 46 1HB ALA 46 -7.402 3.762 13.783 408 HB3 ALA 46 2HB ALA 46 -7.576 4.394 15.421 409 H GLU 47 H GLU 47 -6.716 0.613 16.331 410 HA GLU 47 HA GLU 47 -7.036 1.575 19.049 411 HB2 GLU 47 2HB GLU 47 -7.232 -1.231 17.857 412 HB3 GLU 47 3HB GLU 47 -7.610 -0.835 19.533 413 HG2 GLU 47 2HG GLU 47 -9.456 0.615 18.816 414 HG3 GLU 47 3HG GLU 47 -9.049 0.334 17.126 415 H GLU 48 H GLU 48 -4.572 -0.003 17.182 416 HA GLU 48 HA GLU 48 -2.904 -0.610 19.523 417 HB2 GLU 48 2HB GLU 48 -2.439 -1.043 16.534 418 HB3 GLU 48 3HB GLU 48 -1.273 -1.458 17.783 419 HG2 GLU 48 2HG GLU 48 -4.056 -2.639 17.591 420 HG3 GLU 48 3HG GLU 48 -2.611 -3.395 16.927 421 H LYS 49 H LYS 49 -2.926 1.656 20.141 422 HA LYS 49 HA LYS 49 -1.732 3.696 18.562 423 HB2 LYS 49 2HB LYS 49 -1.669 5.092 20.609 424 HB3 LYS 49 3HB LYS 49 -3.245 4.394 20.320 425 HG2 LYS 49 2HG LYS 49 -1.334 3.154 22.308 426 HG3 LYS 49 3HG LYS 49 -2.361 4.516 22.753 427 HD2 LYS 49 2HD LYS 49 -4.376 3.219 22.267 428 HD3 LYS 49 3HD LYS 49 -3.403 1.872 21.660 429 HE2 LYS 49 2HE LYS 49 -3.367 2.909 24.517 430 HE3 LYS 49 3HE LYS 49 -4.237 1.480 23.960 431 HZ1 LYS 49 3HZ LYS 49 -2.131 0.484 23.329 432 HZ2 LYS 49 1HZ LYS 49 -2.126 0.901 24.968 433 HZ3 LYS 49 2HZ LYS 49 -1.295 1.856 23.851 434 H ASN 50 H ASN 50 0.204 3.271 17.800 435 HA ASN 50 HA ASN 50 2.578 3.231 19.377 436 HB2 ASN 50 2HB ASN 50 1.791 0.872 19.769 437 HB3 ASN 50 3HB ASN 50 1.752 0.588 18.034 438 HD21 ASN 50 1HD2 ASN 50 3.175 -1.178 18.369 439 HD22 ASN 50 2HD2 ASN 50 4.861 -0.934 18.658 440 H PHE 51 H PHE 51 4.442 3.427 18.019 441 HA PHE 51 HA PHE 51 3.940 4.521 15.399 442 HB2 PHE 51 2HB PHE 51 6.486 4.077 17.013 443 HB3 PHE 51 3HB PHE 51 6.522 4.723 15.376 444 HD1 PHE 51 HD2 PHE 51 5.292 5.405 18.839 445 HD2 PHE 51 HD1 PHE 51 6.026 7.019 14.941 446 HE1 PHE 51 HE2 PHE 51 4.925 7.682 19.703 447 HE2 PHE 51 HE1 PHE 51 5.657 9.287 15.816 448 HZ PHE 51 HZ PHE 51 5.105 9.620 18.192 449 H GLU 52 H GLU 52 3.917 1.393 16.207 450 HA GLU 52 HA GLU 52 5.773 0.036 14.658 451 HB2 GLU 52 2HB GLU 52 4.346 -0.997 16.415 452 HB3 GLU 52 3HB GLU 52 2.955 -0.870 15.345 453 HG2 GLU 52 2HG GLU 52 4.008 -2.417 13.756 454 HG3 GLU 52 3HG GLU 52 5.452 -2.502 14.765 455 H LYS 53 H LYS 53 6.000 -0.180 12.566 456 HA LYS 53 HA LYS 53 4.135 1.107 10.762 457 HB2 LYS 53 2HB LYS 53 5.898 0.814 9.033 458 HB3 LYS 53 3HB LYS 53 6.432 1.728 10.429 459 HG2 LYS 53 2HG LYS 53 7.052 -1.217 10.301 460 HG3 LYS 53 3HG LYS 53 7.984 -0.097 9.312 461 HD2 LYS 53 2HD LYS 53 8.675 1.139 11.310 462 HD3 LYS 53 3HD LYS 53 7.701 0.077 12.331 463 HE2 LYS 53 2HE LYS 53 10.067 -0.778 10.631 464 HE3 LYS 53 3HE LYS 53 10.080 -0.549 12.380 465 HZ1 LYS 53 3HZ LYS 53 9.858 -2.875 11.719 466 HZ2 LYS 53 1HZ LYS 53 8.396 -2.528 10.949 467 HZ3 LYS 53 2HZ LYS 53 8.533 -2.350 12.622 468 H ILE 54 H ILE 54 2.551 0.009 9.917 469 HA ILE 54 HA ILE 54 2.667 -2.930 9.588 470 HB ILE 54 HB ILE 54 0.207 -1.101 9.622 471 HG12 ILE 54 2HG1 ILE 54 1.321 -1.047 11.843 472 HG13 ILE 54 3HG1 ILE 54 -0.226 -1.876 11.932 473 HG21 ILE 54 1HG2 ILE 54 -0.206 -3.211 8.435 474 HG22 ILE 54 2HG2 ILE 54 -1.094 -3.181 9.958 475 HG23 ILE 54 3HG2 ILE 54 0.385 -4.135 9.820 476 HD11 ILE 54 3HD1 ILE 54 0.954 -4.041 11.941 477 HD12 ILE 54 1HD1 ILE 54 1.436 -2.997 13.278 478 HD13 ILE 54 2HD1 ILE 54 2.497 -3.181 11.885 479 H LEU 55 H LEU 55 1.971 -3.820 7.594 480 HA LEU 55 HA LEU 55 1.829 -1.958 5.280 481 HB2 LEU 55 2HB LEU 55 3.885 -3.420 5.447 482 HB3 LEU 55 3HB LEU 55 2.863 -4.835 5.277 483 HG LEU 55 HG LEU 55 2.805 -2.692 3.118 484 HD11 LEU 55 1HD1 LEU 55 5.178 -3.140 3.457 485 HD12 LEU 55 2HD1 LEU 55 4.624 -3.781 1.914 486 HD13 LEU 55 3HD1 LEU 55 4.898 -4.873 3.276 487 HD21 LEU 55 3HD2 LEU 55 2.445 -5.702 2.982 488 HD22 LEU 55 1HD2 LEU 55 2.311 -4.577 1.628 489 HD23 LEU 55 2HD2 LEU 55 1.155 -4.497 2.955 490 H ILE 56 H ILE 56 -0.056 -2.031 4.168 491 HA ILE 56 HA ILE 56 -1.936 -4.280 4.640 492 HB ILE 56 HB ILE 56 -2.749 -1.462 3.774 493 HG12 ILE 56 2HG1 ILE 56 -1.726 -1.302 6.054 494 HG13 ILE 56 3HG1 ILE 56 -3.445 -0.930 6.066 495 HG21 ILE 56 1HG2 ILE 56 -5.012 -2.197 4.500 496 HG22 ILE 56 2HG2 ILE 56 -4.366 -3.793 4.882 497 HG23 ILE 56 3HG2 ILE 56 -4.360 -3.213 3.214 498 HD11 ILE 56 3HD1 ILE 56 -2.798 -2.232 7.994 499 HD12 ILE 56 1HD1 ILE 56 -2.184 -3.520 6.959 500 HD13 ILE 56 2HD1 ILE 56 -3.911 -3.152 6.983 501 H ILE 57 H ILE 57 -2.193 -5.504 2.861 502 HA ILE 57 HA ILE 57 -2.005 -4.324 0.149 503 HB ILE 57 HB ILE 57 -1.773 -7.253 1.007 504 HG12 ILE 57 2HG1 ILE 57 0.218 -5.345 -0.308 505 HG13 ILE 57 3HG1 ILE 57 0.276 -5.921 1.350 506 HG21 ILE 57 1HG2 ILE 57 -1.452 -7.827 -1.389 507 HG22 ILE 57 2HG2 ILE 57 -1.803 -6.158 -1.840 508 HG23 ILE 57 3HG2 ILE 57 -3.060 -7.153 -1.104 509 HD11 ILE 57 3HD1 ILE 57 0.679 -8.200 0.522 510 HD12 ILE 57 1HD1 ILE 57 1.911 -7.050 0.010 511 HD13 ILE 57 2HD1 ILE 57 0.679 -7.581 -1.133 512 H SER 58 H SER 58 -3.802 -4.126 -1.012 513 HA SER 58 HA SER 58 -6.175 -5.798 -0.426 514 HB2 SER 58 2HB SER 58 -6.581 -3.474 0.456 515 HB3 SER 58 3HB SER 58 -6.264 -2.822 -1.153 516 HG SER 58 HG SER 58 -8.346 -3.114 -1.382 517 H ASN 59 H ASN 59 -6.557 -6.992 -2.180 518 HA ASN 59 HA ASN 59 -5.328 -6.549 -4.740 519 HB2 ASN 59 2HB ASN 59 -7.467 -8.512 -3.800 520 HB3 ASN 59 3HB ASN 59 -6.891 -8.475 -5.465 521 HD21 ASN 59 1HD2 ASN 59 -4.810 -9.235 -5.929 522 HD22 ASN 59 2HD2 ASN 59 -3.898 -10.152 -4.789 523 H ASP 60 H ASP 60 -8.238 -5.483 -3.270 524 HA ASP 60 HA ASP 60 -9.511 -4.836 -5.849 525 HB2 ASP 60 2HB ASP 60 -10.858 -6.187 -4.220 526 HB3 ASP 60 3HB ASP 60 -10.722 -4.881 -3.044 527 H LYS 61 H LYS 61 -9.212 -2.810 -6.500 528 HA LYS 61 HA LYS 61 -7.936 -0.883 -4.774 529 HB2 LYS 61 2HB LYS 61 -7.904 0.550 -6.925 530 HB3 LYS 61 3HB LYS 61 -6.937 -0.914 -6.863 531 HG2 LYS 61 2HG LYS 61 -8.775 -2.101 -8.124 532 HG3 LYS 61 3HG LYS 61 -9.561 -0.532 -8.336 533 HD2 LYS 61 2HD LYS 61 -7.681 0.321 -9.619 534 HD3 LYS 61 3HD LYS 61 -6.700 -1.096 -9.230 535 HE2 LYS 61 2HE LYS 61 -8.256 -2.515 -10.549 536 HE3 LYS 61 3HE LYS 61 -9.197 -1.078 -10.965 537 HZ1 LYS 61 3HZ LYS 61 -6.341 -1.534 -11.663 538 HZ2 LYS 61 1HZ LYS 61 -7.250 -0.166 -12.073 539 HZ3 LYS 61 2HZ LYS 61 -7.651 -1.675 -12.717 540 H GLN 62 H GLN 62 -11.233 -1.453 -5.605 541 HA GLN 62 HA GLN 62 -12.244 1.166 -4.997 542 HB2 GLN 62 2HB GLN 62 -13.729 -0.461 -6.058 543 HB3 GLN 62 3HB GLN 62 -13.545 -1.581 -4.715 544 HG2 GLN 62 2HG GLN 62 -14.714 0.056 -3.229 545 HG3 GLN 62 3HG GLN 62 -14.945 1.113 -4.626 546 HE21 GLN 62 1HE2 GLN 62 -16.387 0.428 -6.289 547 HE22 GLN 62 2HE2 GLN 62 -17.587 -0.780 -6.000 548 H LEU 63 H LEU 63 -11.603 -1.779 -3.069 549 HA LEU 63 HA LEU 63 -12.252 -0.751 -0.518 550 HB2 LEU 63 2HB LEU 63 -10.339 -2.966 -1.348 551 HB3 LEU 63 3HB LEU 63 -10.690 -2.592 0.334 552 HG LEU 63 HG LEU 63 -12.693 -3.603 -1.723 553 HD11 LEU 63 1HD1 LEU 63 -11.510 -4.977 0.717 554 HD12 LEU 63 2HD1 LEU 63 -11.130 -5.338 -0.968 555 HD13 LEU 63 3HD1 LEU 63 -12.751 -5.641 -0.351 556 HD21 LEU 63 3HD2 LEU 63 -14.300 -3.701 0.138 557 HD22 LEU 63 1HD2 LEU 63 -13.780 -2.046 -0.176 558 HD23 LEU 63 2HD2 LEU 63 -13.128 -2.928 1.208 559 H LEU 64 H LEU 64 -9.269 -0.693 -2.423 560 HA LEU 64 HA LEU 64 -7.507 0.391 -0.543 561 HB2 LEU 64 2HB LEU 64 -6.734 -0.478 -2.645 562 HB3 LEU 64 3HB LEU 64 -7.675 0.676 -3.561 563 HG LEU 64 HG LEU 64 -5.484 1.747 -1.759 564 HD11 LEU 64 1HD1 LEU 64 -4.967 0.560 -4.497 565 HD12 LEU 64 2HD1 LEU 64 -4.398 -0.089 -2.955 566 HD13 LEU 64 3HD1 LEU 64 -3.816 1.475 -3.516 567 HD21 LEU 64 3HD2 LEU 64 -6.536 2.636 -4.473 568 HD22 LEU 64 1HD2 LEU 64 -5.268 3.449 -3.547 569 HD23 LEU 64 2HD2 LEU 64 -6.910 3.374 -2.917 570 H LYS 65 H LYS 65 -9.738 2.051 -2.798 571 HA LYS 65 HA LYS 65 -9.175 4.715 -2.094 572 HB2 LYS 65 2HB LYS 65 -11.761 3.460 -3.086 573 HB3 LYS 65 3HB LYS 65 -11.491 5.199 -2.982 574 HG2 LYS 65 2HG LYS 65 -9.719 5.086 -4.640 575 HG3 LYS 65 3HG LYS 65 -9.783 3.321 -4.644 576 HD2 LYS 65 2HD LYS 65 -10.931 4.208 -6.621 577 HD3 LYS 65 3HD LYS 65 -12.086 3.402 -5.558 578 HE2 LYS 65 2HE LYS 65 -12.784 5.626 -4.676 579 HE3 LYS 65 3HE LYS 65 -11.658 6.404 -5.793 580 HZ1 LYS 65 3HZ LYS 65 -12.886 5.499 -7.637 581 HZ2 LYS 65 1HZ LYS 65 -13.925 6.370 -6.631 582 HZ3 LYS 65 2HZ LYS 65 -13.941 4.685 -6.596 583 H GLU 66 H GLU 66 -11.812 2.584 -0.879 584 HA GLU 66 HA GLU 66 -12.999 4.240 0.988 585 HB2 GLU 66 2HB GLU 66 -12.543 1.247 1.379 586 HB3 GLU 66 3HB GLU 66 -13.790 2.212 2.154 587 HG2 GLU 66 2HG GLU 66 -13.604 1.529 -0.787 588 HG3 GLU 66 3HG GLU 66 -14.719 0.826 0.379 589 H MET 67 H MET 67 -10.272 2.052 1.389 590 HA MET 67 HA MET 67 -9.830 2.271 4.142 591 HB2 MET 67 2HB MET 67 -8.994 0.424 2.741 592 HB3 MET 67 3HB MET 67 -7.897 1.513 1.909 593 HG2 MET 67 2HG MET 67 -6.567 1.797 3.899 594 HG3 MET 67 3HG MET 67 -7.755 0.933 4.876 595 HE1 MET 67 3HE MET 67 -8.242 -1.703 4.641 596 HE2 MET 67 1HE MET 67 -7.423 -2.724 3.463 597 HE3 MET 67 2HE MET 67 -8.560 -1.494 2.917 598 H LEU 68 H LEU 68 -8.217 3.947 1.404 599 HA LEU 68 HA LEU 68 -6.331 5.360 3.017 600 HB2 LEU 68 2HB LEU 68 -7.291 5.813 0.165 601 HB3 LEU 68 3HB LEU 68 -6.018 6.772 0.908 602 HG LEU 68 HG LEU 68 -5.886 3.761 0.455 603 HD11 LEU 68 1HD1 LEU 68 -4.255 4.255 -1.281 604 HD12 LEU 68 2HD1 LEU 68 -4.444 5.988 -1.006 605 HD13 LEU 68 3HD1 LEU 68 -5.790 5.042 -1.642 606 HD21 LEU 68 3HD2 LEU 68 -3.772 5.673 1.509 607 HD22 LEU 68 1HD2 LEU 68 -3.511 3.976 1.097 608 HD23 LEU 68 2HD2 LEU 68 -4.591 4.401 2.420 609 H GLU 69 H GLU 69 -9.583 6.106 1.918 610 HA GLU 69 HA GLU 69 -9.626 8.851 2.746 611 HB2 GLU 69 2HB GLU 69 -11.897 6.863 2.324 612 HB3 GLU 69 3HB GLU 69 -12.121 8.593 2.584 613 HG2 GLU 69 2HG GLU 69 -10.932 9.100 0.509 614 HG3 GLU 69 3HG GLU 69 -10.593 7.389 0.251 615 H LEU 70 H LEU 70 -10.355 5.758 4.316 616 HA LEU 70 HA LEU 70 -11.224 6.894 6.810 617 HB2 LEU 70 2HB LEU 70 -10.306 4.081 6.085 618 HB3 LEU 70 3HB LEU 70 -10.939 4.521 7.665 619 HG LEU 70 HG LEU 70 -12.510 4.742 5.058 620 HD11 LEU 70 1HD1 LEU 70 -12.764 2.647 7.237 621 HD12 LEU 70 2HD1 LEU 70 -12.105 2.393 5.621 622 HD13 LEU 70 3HD1 LEU 70 -13.804 2.808 5.818 623 HD21 LEU 70 3HD2 LEU 70 -13.242 6.386 6.720 624 HD22 LEU 70 1HD2 LEU 70 -13.441 5.109 7.925 625 HD23 LEU 70 2HD2 LEU 70 -14.468 5.145 6.488 626 H ILE 71 H ILE 71 -8.069 5.901 5.498 627 HA ILE 71 HA ILE 71 -6.589 6.225 7.947 628 HB ILE 71 HB ILE 71 -5.463 6.411 5.096 629 HG12 ILE 71 2HG1 ILE 71 -5.499 3.978 6.945 630 HG13 ILE 71 3HG1 ILE 71 -6.536 4.183 5.546 631 HG21 ILE 71 1HG2 ILE 71 -3.957 7.414 6.742 632 HG22 ILE 71 2HG2 ILE 71 -3.288 5.873 6.227 633 HG23 ILE 71 3HG2 ILE 71 -4.089 5.998 7.787 634 HD11 ILE 71 3HD1 ILE 71 -4.699 2.694 5.057 635 HD12 ILE 71 1HD1 ILE 71 -3.532 3.945 5.490 636 HD13 ILE 71 2HD1 ILE 71 -4.577 4.158 4.084 637 H SER 72 H SER 72 -7.645 8.332 5.338 638 HA SER 72 HA SER 72 -6.113 10.635 5.953 639 HB2 SER 72 2HB SER 72 -7.250 10.386 3.801 640 HB3 SER 72 3HB SER 72 -8.825 10.315 4.587 641 HG SER 72 HG SER 72 -8.342 12.374 3.700 642 H LYS 73 H LYS 73 -9.074 9.275 7.286 643 HA LYS 73 HA LYS 73 -9.722 11.521 8.999 644 HB2 LYS 73 2HB LYS 73 -10.710 8.632 8.996 645 HB3 LYS 73 3HB LYS 73 -11.425 9.951 9.921 646 HG2 LYS 73 2HG LYS 73 -12.108 11.096 7.882 647 HG3 LYS 73 3HG LYS 73 -11.241 9.920 6.892 648 HD2 LYS 73 2HD LYS 73 -13.601 9.390 6.801 649 HD3 LYS 73 3HD LYS 73 -12.791 8.130 7.733 650 HE2 LYS 73 2HE LYS 73 -13.568 9.184 9.832 651 HE3 LYS 73 3HE LYS 73 -14.358 10.461 8.898 652 HZ1 LYS 73 3HZ LYS 73 -15.933 8.779 9.552 653 HZ2 LYS 73 1HZ LYS 73 -15.028 7.563 8.804 654 HZ3 LYS 73 2HZ LYS 73 -15.765 8.771 7.875 655 H LEU 74 H LEU 74 -7.655 8.749 9.166 656 HA LEU 74 HA LEU 74 -7.258 8.848 12.066 657 HB2 LEU 74 2HB LEU 74 -5.995 7.118 9.898 658 HB3 LEU 74 3HB LEU 74 -5.671 6.950 11.615 659 HG LEU 74 HG LEU 74 -8.388 6.508 10.310 660 HD11 LEU 74 1HD1 LEU 74 -6.781 4.757 9.669 661 HD12 LEU 74 2HD1 LEU 74 -8.051 4.121 10.710 662 HD13 LEU 74 3HD1 LEU 74 -6.443 4.430 11.370 663 HD21 LEU 74 3HD2 LEU 74 -9.095 5.624 12.483 664 HD22 LEU 74 1HD2 LEU 74 -8.594 7.308 12.620 665 HD23 LEU 74 2HD2 LEU 74 -7.523 6.021 13.178 666 H GLY 75 H GLY 75 -5.846 10.127 9.185 667 HA2 GLY 75 2HA GLY 75 -4.106 11.516 8.738 668 HA3 GLY 75 3HA GLY 75 -4.012 11.841 10.458 669 H TYR 76 H TYR 76 -3.551 8.570 9.203 670 HA TYR 76 HA TYR 76 -0.870 8.493 10.332 671 HB2 TYR 76 2HB TYR 76 -2.466 6.313 8.927 672 HB3 TYR 76 3HB TYR 76 -0.885 6.064 9.668 673 HD1 TYR 76 HD1 TYR 76 -1.557 7.961 12.126 674 HD2 TYR 76 HD2 TYR 76 -3.554 4.617 10.354 675 HE1 TYR 76 HE1 TYR 76 -2.637 7.463 14.270 676 HE2 TYR 76 HE2 TYR 76 -4.633 4.129 12.505 677 HH TYR 76 HH TYR 76 -4.705 6.326 15.049 678 H LYS 77 H LYS 77 1.037 7.951 9.247 679 HA LYS 77 HA LYS 77 1.368 9.300 6.729 680 HB2 LYS 77 2HB LYS 77 3.044 9.507 8.533 681 HB3 LYS 77 3HB LYS 77 3.359 7.775 8.476 682 HG2 LYS 77 2HG LYS 77 5.136 9.017 7.337 683 HG3 LYS 77 3HG LYS 77 4.256 8.003 6.187 684 HD2 LYS 77 2HD LYS 77 2.902 10.050 5.544 685 HD3 LYS 77 3HD LYS 77 3.968 11.009 6.575 686 HE2 LYS 77 2HE LYS 77 5.896 10.332 5.182 687 HE3 LYS 77 3HE LYS 77 4.813 9.395 4.148 688 HZ1 LYS 77 3HZ LYS 77 5.233 11.506 3.159 689 HZ2 LYS 77 1HZ LYS 77 4.760 12.331 4.555 690 HZ3 LYS 77 2HZ LYS 77 3.621 11.467 3.654 691 H VAL 78 H VAL 78 1.029 8.332 4.796 692 HA VAL 78 HA VAL 78 1.407 5.393 4.557 693 HB VAL 78 HB VAL 78 -0.706 7.126 3.192 694 HG11 VAL 78 1HG1 VAL 78 0.033 5.398 1.605 695 HG12 VAL 78 2HG1 VAL 78 -1.586 5.024 2.194 696 HG13 VAL 78 3HG1 VAL 78 -0.192 4.145 2.827 697 HG21 VAL 78 3HG2 VAL 78 -2.311 5.735 4.462 698 HG22 VAL 78 1HG2 VAL 78 -1.223 6.626 5.530 699 HG23 VAL 78 2HG2 VAL 78 -0.965 4.902 5.243 700 H PHE 79 H PHE 79 2.689 4.670 3.064 701 HA PHE 79 HA PHE 79 3.424 6.287 0.692 702 HB2 PHE 79 2HB PHE 79 4.823 3.879 1.945 703 HB3 PHE 79 3HB PHE 79 5.344 4.708 0.484 704 HD1 PHE 79 HD2 PHE 79 5.117 4.944 4.174 705 HD2 PHE 79 HD1 PHE 79 6.510 6.849 0.605 706 HE1 PHE 79 HE2 PHE 79 6.518 6.451 5.520 707 HE2 PHE 79 HE1 PHE 79 7.902 8.347 1.963 708 HZ PHE 79 HZ PHE 79 7.910 8.149 4.409 709 H LEU 80 H LEU 80 2.326 5.637 -1.100 710 HA LEU 80 HA LEU 80 0.948 3.013 -1.059 711 HB2 LEU 80 2HB LEU 80 -0.554 4.934 -1.180 712 HB3 LEU 80 3HB LEU 80 0.311 5.580 -2.566 713 HG LEU 80 HG LEU 80 -0.461 3.662 -3.955 714 HD11 LEU 80 1HD1 LEU 80 -2.163 2.101 -3.155 715 HD12 LEU 80 2HD1 LEU 80 -2.029 2.770 -1.528 716 HD13 LEU 80 3HD1 LEU 80 -0.656 1.934 -2.256 717 HD21 LEU 80 3HD2 LEU 80 -2.841 4.275 -4.112 718 HD22 LEU 80 1HD2 LEU 80 -1.803 5.692 -3.955 719 HD23 LEU 80 2HD2 LEU 80 -2.725 5.121 -2.566 720 H LEU 81 H LEU 81 1.824 1.473 -2.303 721 HA LEU 81 HA LEU 81 3.150 2.179 -4.849 722 HB2 LEU 81 2HB LEU 81 4.479 0.775 -3.259 723 HB3 LEU 81 3HB LEU 81 3.226 -0.458 -3.309 724 HG LEU 81 HG LEU 81 3.659 -0.808 -5.739 725 HD11 LEU 81 1HD1 LEU 81 4.397 1.400 -6.402 726 HD12 LEU 81 2HD1 LEU 81 5.635 0.220 -6.822 727 HD13 LEU 81 3HD1 LEU 81 5.853 1.258 -5.413 728 HD21 LEU 81 3HD2 LEU 81 4.849 -2.211 -4.122 729 HD22 LEU 81 1HD2 LEU 81 6.170 -1.040 -4.051 730 HD23 LEU 81 2HD2 LEU 81 5.840 -1.918 -5.550 731 H LEU 82 H LEU 82 1.759 2.134 -6.474 732 HA LEU 82 HA LEU 82 -0.425 0.160 -6.609 733 HB2 LEU 82 2HB LEU 82 0.147 2.707 -8.188 734 HB3 LEU 82 3HB LEU 82 -1.175 1.610 -8.546 735 HG LEU 82 HG LEU 82 -0.876 3.198 -5.971 736 HD11 LEU 82 1HD1 LEU 82 -2.789 4.510 -6.767 737 HD12 LEU 82 2HD1 LEU 82 -2.810 3.602 -8.281 738 HD13 LEU 82 3HD1 LEU 82 -1.434 4.635 -7.888 739 HD21 LEU 82 3HD2 LEU 82 -3.138 1.392 -6.888 740 HD22 LEU 82 1HD2 LEU 82 -3.135 2.396 -5.435 741 HD23 LEU 82 2HD2 LEU 82 -2.000 1.057 -5.579 742 H GLN 83 H GLN 83 -0.389 -1.424 -8.125 743 HA GLN 83 HA GLN 83 1.543 -1.374 -10.336 744 HB2 GLN 83 2HB GLN 83 2.654 -2.705 -8.618 745 HB3 GLN 83 3HB GLN 83 1.218 -3.692 -8.380 746 HG2 GLN 83 2HG GLN 83 1.476 -4.758 -10.517 747 HG3 GLN 83 3HG GLN 83 2.672 -3.573 -11.039 748 HE21 GLN 83 1HE2 GLN 83 4.044 -5.319 -11.561 749 HE22 GLN 83 2HE2 GLN 83 4.938 -6.155 -10.341 750 H ASP 84 H ASP 84 0.242 -1.320 -11.990 751 HA ASP 84 HA ASP 84 -1.882 -3.308 -12.339 752 HB2 ASP 84 2HB ASP 84 -2.879 -1.170 -11.400 753 HB3 ASP 84 3HB ASP 84 -2.281 -0.312 -12.812 754 H GLN 85 H GLN 85 -2.320 -3.746 -14.563 755 HA GLN 85 HA GLN 85 -0.036 -3.745 -16.209 756 HB2 GLN 85 2HB GLN 85 -1.726 -5.521 -16.282 757 HB3 GLN 85 3HB GLN 85 -2.945 -4.385 -16.846 758 HG2 GLN 85 2HG GLN 85 -1.758 -4.116 -18.972 759 HG3 GLN 85 3HG GLN 85 -0.463 -5.175 -18.414 760 HE21 GLN 85 1HE2 GLN 85 -2.238 -5.429 -20.745 761 HE22 GLN 85 2HE2 GLN 85 -3.013 -6.962 -20.580 762 H ASP 86 H ASP 86 -2.908 -1.674 -16.201 763 HA ASP 86 HA ASP 86 -2.189 -0.439 -18.772 764 HB2 ASP 86 2HB ASP 86 -4.641 -0.108 -16.985 765 HB3 ASP 86 3HB ASP 86 -4.407 0.708 -18.528 766 H GLU 87 H GLU 87 -0.435 0.869 -18.298 767 HA GLU 87 HA GLU 87 0.062 2.468 -16.093 768 HB2 GLU 87 2HB GLU 87 0.947 2.605 -18.994 769 HB3 GLU 87 3HB GLU 87 1.523 3.797 -17.834 770 HG2 GLU 87 2HG GLU 87 1.853 0.831 -17.324 771 HG3 GLU 87 3HG GLU 87 2.998 1.729 -18.313 772 H ASN 88 H ASN 88 -1.887 3.179 -18.918 773 HA ASN 88 HA ASN 88 -2.115 5.962 -18.757 774 HB2 ASN 88 2HB ASN 88 -4.143 3.930 -19.798 775 HB3 ASN 88 3HB ASN 88 -4.235 5.668 -20.075 776 HD21 ASN 88 1HD2 ASN 88 -4.202 5.156 -22.352 777 HD22 ASN 88 2HD2 ASN 88 -2.714 4.782 -23.145 778 H GLU 89 H GLU 89 -4.392 3.488 -17.458 779 HA GLU 89 HA GLU 89 -5.889 5.517 -15.991 780 HB2 GLU 89 2HB GLU 89 -7.422 3.695 -15.371 781 HB3 GLU 89 3HB GLU 89 -7.165 3.774 -17.109 782 HG2 GLU 89 2HG GLU 89 -5.552 1.874 -16.903 783 HG3 GLU 89 3HG GLU 89 -5.969 1.751 -15.197 784 H LEU 90 H LEU 90 -3.290 3.370 -15.380 785 HA LEU 90 HA LEU 90 -3.509 3.171 -12.549 786 HB2 LEU 90 2HB LEU 90 -2.125 1.625 -13.852 787 HB3 LEU 90 3HB LEU 90 -1.098 2.939 -14.399 788 HG LEU 90 HG LEU 90 -0.195 3.233 -12.144 789 HD11 LEU 90 1HD1 LEU 90 -0.785 1.669 -10.318 790 HD12 LEU 90 2HD1 LEU 90 -2.160 1.123 -11.277 791 HD13 LEU 90 3HD1 LEU 90 -2.054 2.808 -10.752 792 HD21 LEU 90 3HD2 LEU 90 1.014 1.125 -11.868 793 HD22 LEU 90 1HD2 LEU 90 0.907 1.574 -13.570 794 HD23 LEU 90 2HD2 LEU 90 -0.138 0.306 -12.926 795 H GLU 91 H GLU 91 -1.967 5.508 -14.751 796 HA GLU 91 HA GLU 91 -0.865 7.139 -12.638 797 HB2 GLU 91 2HB GLU 91 0.150 7.035 -14.925 798 HB3 GLU 91 3HB GLU 91 -1.264 7.867 -15.575 799 HG2 GLU 91 2HG GLU 91 -0.761 9.849 -14.217 800 HG3 GLU 91 3HG GLU 91 0.595 9.019 -13.457 801 H GLU 92 H GLU 92 -3.753 7.267 -14.715 802 HA GLU 92 HA GLU 92 -4.988 9.592 -13.839 803 HB2 GLU 92 2HB GLU 92 -6.167 6.881 -14.539 804 HB3 GLU 92 3HB GLU 92 -7.180 8.272 -14.187 805 HG2 GLU 92 2HG GLU 92 -5.133 8.175 -16.416 806 HG3 GLU 92 3HG GLU 92 -6.850 7.830 -16.616 807 H PHE 93 H PHE 93 -5.005 6.397 -12.336 808 HA PHE 93 HA PHE 93 -6.682 7.067 -10.114 809 HB2 PHE 93 2HB PHE 93 -6.430 4.779 -11.175 810 HB3 PHE 93 3HB PHE 93 -4.815 4.674 -10.488 811 HD1 PHE 93 HD1 PHE 93 -8.260 5.576 -9.245 812 HD2 PHE 93 HD2 PHE 93 -4.718 3.255 -8.617 813 HE1 PHE 93 HE1 PHE 93 -9.258 4.576 -7.239 814 HE2 PHE 93 HE2 PHE 93 -5.730 2.265 -6.609 815 HZ PHE 93 HZ PHE 93 -8.000 2.923 -5.920 816 H LYS 94 H LYS 94 -3.180 6.879 -10.675 817 HA LYS 94 HA LYS 94 -2.240 7.046 -8.040 818 HB2 LYS 94 2HB LYS 94 -0.683 6.447 -9.802 819 HB3 LYS 94 3HB LYS 94 -0.959 7.971 -10.643 820 HG2 LYS 94 2HG LYS 94 0.136 9.210 -8.796 821 HG3 LYS 94 3HG LYS 94 0.355 7.704 -7.917 822 HD2 LYS 94 2HD LYS 94 2.459 8.280 -8.925 823 HD3 LYS 94 3HD LYS 94 1.812 6.878 -9.779 824 HE2 LYS 94 2HE LYS 94 2.726 8.429 -11.398 825 HE3 LYS 94 3HE LYS 94 0.968 8.425 -11.566 826 HZ1 LYS 94 3HZ LYS 94 2.626 10.465 -10.176 827 HZ2 LYS 94 1HZ LYS 94 0.936 10.466 -10.186 828 HZ3 LYS 94 2HZ LYS 94 1.793 10.664 -11.630 829 H ARG 95 H ARG 95 -2.712 9.643 -10.461 830 HA ARG 95 HA ARG 95 -1.635 11.724 -8.912 831 HB2 ARG 95 2HB ARG 95 -2.540 13.260 -10.594 832 HB3 ARG 95 3HB ARG 95 -1.799 11.858 -11.349 833 HG2 ARG 95 2HG ARG 95 -4.003 10.896 -11.819 834 HG3 ARG 95 3HG ARG 95 -4.793 12.240 -10.991 835 HD2 ARG 95 2HD ARG 95 -3.914 13.812 -12.671 836 HD3 ARG 95 3HD ARG 95 -3.065 12.492 -13.482 837 HE ARG 95 HE ARG 95 -5.377 11.511 -13.845 838 HH11 ARG 95 1HH1 ARG 95 -4.884 14.996 -13.673 839 HH12 ARG 95 2HH1 ARG 95 -6.264 15.352 -14.667 840 HH21 ARG 95 1HH2 ARG 95 -7.169 12.007 -15.145 841 HH22 ARG 95 2HH2 ARG 95 -7.554 13.662 -15.496 842 H LYS 96 H LYS 96 -4.835 10.382 -8.894 843 HA LYS 96 HA LYS 96 -6.258 12.514 -7.668 844 HB2 LYS 96 2HB LYS 96 -6.742 9.505 -7.652 845 HB3 LYS 96 3HB LYS 96 -7.901 10.691 -7.055 846 HG2 LYS 96 2HG LYS 96 -8.089 11.678 -9.286 847 HG3 LYS 96 3HG LYS 96 -6.872 10.556 -9.905 848 HD2 LYS 96 2HD LYS 96 -8.368 8.651 -9.449 849 HD3 LYS 96 3HD LYS 96 -9.578 9.742 -8.759 850 HE2 LYS 96 2HE LYS 96 -8.613 9.758 -11.640 851 HE3 LYS 96 3HE LYS 96 -10.151 9.110 -11.067 852 HZ1 LYS 96 3HZ LYS 96 -9.288 11.945 -10.951 853 HZ2 LYS 96 1HZ LYS 96 -10.736 11.354 -10.310 854 HZ3 LYS 96 2HZ LYS 96 -10.458 11.294 -11.976 855 H ILE 97 H ILE 97 -4.697 9.620 -6.379 856 HA ILE 97 HA ILE 97 -5.275 10.193 -3.608 857 HB ILE 97 HB ILE 97 -3.423 8.097 -4.839 858 HG12 ILE 97 2HG1 ILE 97 -6.348 7.748 -4.001 859 HG13 ILE 97 3HG1 ILE 97 -5.841 8.019 -5.664 860 HG21 ILE 97 1HG2 ILE 97 -4.703 8.223 -2.080 861 HG22 ILE 97 2HG2 ILE 97 -2.990 8.445 -2.442 862 HG23 ILE 97 3HG2 ILE 97 -3.750 6.877 -2.702 863 HD11 ILE 97 3HD1 ILE 97 -5.128 5.645 -3.955 864 HD12 ILE 97 1HD1 ILE 97 -4.565 5.927 -5.605 865 HD13 ILE 97 2HD1 ILE 97 -6.282 5.692 -5.286 866 H GLU 98 H GLU 98 -2.656 10.671 -5.827 867 HA GLU 98 HA GLU 98 -0.583 11.294 -3.942 868 HB2 GLU 98 2HB GLU 98 -0.126 10.399 -6.200 869 HB3 GLU 98 3HB GLU 98 -0.831 11.834 -6.937 870 HG2 GLU 98 2HG GLU 98 0.975 13.214 -5.992 871 HG3 GLU 98 3HG GLU 98 1.666 11.790 -5.209 872 H SER 99 H SER 99 -3.105 13.072 -5.664 873 HA SER 99 HA SER 99 -2.170 15.720 -5.008 874 HB2 SER 99 2HB SER 99 -3.638 15.311 -6.964 875 HB3 SER 99 3HB SER 99 -4.937 14.781 -5.896 876 HG SER 99 HG SER 99 -5.066 17.000 -6.614 877 H GLN 100 H GLN 100 -3.929 13.238 -3.319 878 HA GLN 100 HA GLN 100 -5.153 14.922 -1.327 879 HB2 GLN 100 2HB GLN 100 -4.479 11.950 -1.087 880 HB3 GLN 100 3HB GLN 100 -5.621 12.852 -0.098 881 HG2 GLN 100 2HG GLN 100 -5.908 12.191 -3.037 882 HG3 GLN 100 3HG GLN 100 -6.804 11.467 -1.707 883 HE21 GLN 100 1HE2 GLN 100 -7.701 12.950 -4.122 884 HE22 GLN 100 2HE2 GLN 100 -8.711 14.219 -3.519 885 H GLY 101 H GLY 101 -1.969 13.630 -1.843 886 HA2 GLY 101 2HA GLY 101 -0.082 14.637 -0.763 887 HA3 GLY 101 3HA GLY 101 -1.017 14.809 0.714 888 H TYR 102 H TYR 102 -0.529 12.035 -1.451 889 HA TYR 102 HA TYR 102 0.976 10.571 0.657 890 HB2 TYR 102 2HB TYR 102 -1.007 9.363 -1.346 891 HB3 TYR 102 3HB TYR 102 -0.041 8.448 -0.190 892 HD1 TYR 102 HD1 TYR 102 -0.388 9.195 2.371 893 HD2 TYR 102 HD2 TYR 102 -3.239 9.847 -0.748 894 HE1 TYR 102 HE1 TYR 102 -2.179 9.376 4.043 895 HE2 TYR 102 HE2 TYR 102 -5.029 10.034 0.929 896 HH TYR 102 HH TYR 102 -4.406 10.382 4.249 897 H GLU 103 H GLU 103 2.889 9.647 -0.057 898 HA GLU 103 HA GLU 103 3.842 10.236 -2.710 899 HB2 GLU 103 2HB GLU 103 5.126 8.510 -0.544 900 HB3 GLU 103 3HB GLU 103 5.894 8.982 -2.056 901 HG2 GLU 103 2HG GLU 103 6.808 10.576 -0.690 902 HG3 GLU 103 3HG GLU 103 5.362 11.442 -1.187 903 H VAL 104 H VAL 104 2.616 9.221 -4.186 904 HA VAL 104 HA VAL 104 2.192 6.311 -4.025 905 HB VAL 104 HB VAL 104 0.839 8.276 -5.935 906 HG11 VAL 104 1HG1 VAL 104 -0.804 6.443 -6.236 907 HG12 VAL 104 2HG1 VAL 104 0.150 5.411 -5.169 908 HG13 VAL 104 3HG1 VAL 104 0.824 5.950 -6.709 909 HG21 VAL 104 3HG2 VAL 104 -1.150 8.197 -4.472 910 HG22 VAL 104 1HG2 VAL 104 0.233 8.905 -3.634 911 HG23 VAL 104 2HG2 VAL 104 -0.253 7.245 -3.286 912 H ARG 105 H ARG 105 3.624 5.154 -5.134 913 HA ARG 105 HA ARG 105 4.772 6.171 -7.670 914 HB2 ARG 105 2HB ARG 105 5.800 4.091 -5.691 915 HB3 ARG 105 3HB ARG 105 6.480 4.295 -7.300 916 HG2 ARG 105 2HG ARG 105 6.469 6.387 -5.104 917 HG3 ARG 105 3HG ARG 105 7.845 5.409 -5.611 918 HD2 ARG 105 2HD ARG 105 7.399 6.480 -7.979 919 HD3 ARG 105 3HD ARG 105 6.509 7.692 -7.056 920 HE ARG 105 HE ARG 105 8.500 8.405 -6.050 921 HH11 ARG 105 1HH1 ARG 105 9.111 5.757 -8.293 922 HH12 ARG 105 2HH1 ARG 105 10.823 6.049 -8.356 923 HH21 ARG 105 1HH2 ARG 105 10.751 8.746 -6.125 924 HH22 ARG 105 2HH2 ARG 105 11.746 7.739 -7.130 925 H LYS 106 H LYS 106 4.617 4.899 -9.487 926 HA LYS 106 HA LYS 106 2.792 2.575 -9.416 927 HB2 LYS 106 2HB LYS 106 3.966 3.992 -11.846 928 HB3 LYS 106 3HB LYS 106 2.696 2.773 -11.854 929 HG2 LYS 106 2HG LYS 106 1.240 4.376 -10.590 930 HG3 LYS 106 3HG LYS 106 2.506 5.592 -10.764 931 HD2 LYS 106 2HD LYS 106 1.017 4.243 -13.051 932 HD3 LYS 106 3HD LYS 106 0.695 5.859 -12.438 933 HE2 LYS 106 2HE LYS 106 1.948 6.090 -14.453 934 HE3 LYS 106 3HE LYS 106 3.029 6.498 -13.126 935 HZ1 LYS 106 3HZ LYS 106 2.983 3.795 -14.329 936 HZ2 LYS 106 1HZ LYS 106 4.195 4.502 -13.390 937 HZ3 LYS 106 2HZ LYS 106 3.930 5.034 -14.972 938 H VAL 107 H VAL 107 3.383 0.662 -10.566 939 HA VAL 107 HA VAL 107 5.980 0.307 -11.728 940 HB VAL 107 HB VAL 107 6.538 -0.062 -9.323 941 HG11 VAL 107 1HG1 VAL 107 5.691 -1.990 -8.066 942 HG12 VAL 107 2HG1 VAL 107 4.602 -2.400 -9.393 943 HG13 VAL 107 3HG1 VAL 107 4.377 -0.893 -8.502 944 HG21 VAL 107 3HG2 VAL 107 7.722 -2.194 -9.586 945 HG22 VAL 107 1HG2 VAL 107 7.818 -1.233 -11.063 946 HG23 VAL 107 2HG2 VAL 107 6.710 -2.606 -10.973 947 H THR 108 H THR 108 6.068 -1.621 -12.968 948 HA THR 108 HA THR 108 3.617 -3.279 -13.169 949 HB THR 108 HB THR 108 4.095 -3.450 -15.659 950 HG1 THR 108 HG1 THR 108 6.363 -2.419 -15.133 951 HG21 THR 108 3HG2 THR 108 3.156 -1.251 -16.291 952 HG22 THR 108 1HG2 THR 108 3.539 -0.613 -14.691 953 HG23 THR 108 2HG2 THR 108 2.330 -1.887 -14.867 954 H ASP 109 H ASP 109 7.100 -3.070 -13.065 955 HA ASP 109 HA ASP 109 7.549 -5.838 -13.909 956 HB2 ASP 109 2HB ASP 109 9.466 -3.565 -13.215 957 HB3 ASP 109 3HB ASP 109 9.987 -5.180 -13.685 958 H ASP 110 H ASP 110 8.657 -7.375 -12.637 959 HA ASP 110 HA ASP 110 7.639 -7.662 -10.024 960 HB2 ASP 110 2HB ASP 110 9.766 -9.252 -11.525 961 HB3 ASP 110 3HB ASP 110 9.138 -9.735 -9.953 962 H GLU 111 H GLU 111 11.043 -7.267 -11.081 963 HA GLU 111 HA GLU 111 12.093 -7.339 -8.429 964 HB2 GLU 111 2HB GLU 111 13.443 -6.307 -10.965 965 HB3 GLU 111 3HB GLU 111 14.249 -6.661 -9.440 966 HG2 GLU 111 2HG GLU 111 13.523 -9.060 -9.691 967 HG3 GLU 111 3HG GLU 111 12.921 -8.649 -11.297 968 H GLU 112 H GLU 112 11.203 -4.744 -10.679 969 HA GLU 112 HA GLU 112 12.239 -2.572 -9.210 970 HB2 GLU 112 2HB GLU 112 11.583 -2.440 -11.616 971 HB3 GLU 112 3HB GLU 112 9.886 -2.556 -11.149 972 HG2 GLU 112 2HG GLU 112 10.126 -0.447 -9.839 973 HG3 GLU 112 3HG GLU 112 11.801 -0.326 -10.369 974 H ALA 113 H ALA 113 9.093 -4.255 -9.080 975 HA ALA 113 HA ALA 113 7.707 -2.539 -7.353 976 HB1 ALA 113 3HB ALA 113 6.338 -4.483 -6.743 977 HB2 ALA 113 1HB ALA 113 7.543 -5.569 -7.456 978 HB3 ALA 113 2HB ALA 113 6.643 -4.448 -8.479 979 H LEU 114 H LEU 114 9.858 -5.263 -6.606 980 HA LEU 114 HA LEU 114 9.757 -5.097 -3.777 981 HB2 LEU 114 2HB LEU 114 12.074 -6.166 -5.438 982 HB3 LEU 114 3HB LEU 114 11.679 -6.584 -3.775 983 HG LEU 114 HG LEU 114 10.004 -7.318 -6.212 984 HD11 LEU 114 1HD1 LEU 114 12.124 -8.550 -6.132 985 HD12 LEU 114 2HD1 LEU 114 10.747 -9.604 -5.845 986 HD13 LEU 114 3HD1 LEU 114 11.758 -9.094 -4.491 987 HD21 LEU 114 3HD2 LEU 114 8.590 -7.025 -4.230 988 HD22 LEU 114 1HD2 LEU 114 9.620 -8.126 -3.310 989 HD23 LEU 114 2HD2 LEU 114 8.686 -8.722 -4.687 990 H LYS 115 H LYS 115 11.810 -3.526 -6.192 991 HA LYS 115 HA LYS 115 13.775 -2.384 -4.510 992 HB2 LYS 115 2HB LYS 115 12.725 -1.495 -7.233 993 HB3 LYS 115 3HB LYS 115 14.084 -0.715 -6.430 994 HG2 LYS 115 2HG LYS 115 15.346 -2.839 -6.497 995 HG3 LYS 115 3HG LYS 115 13.989 -3.619 -7.313 996 HD2 LYS 115 2HD LYS 115 14.250 -2.150 -9.254 997 HD3 LYS 115 3HD LYS 115 15.494 -1.214 -8.418 998 HE2 LYS 115 2HE LYS 115 16.549 -2.708 -10.017 999 HE3 LYS 115 3HE LYS 115 16.948 -3.245 -8.385 1000 HZ1 LYS 115 3HZ LYS 115 15.171 -4.917 -8.596 1001 HZ2 LYS 115 1HZ LYS 115 16.402 -5.114 -9.736 1002 HZ3 LYS 115 2HZ LYS 115 14.926 -4.442 -10.202 1003 H ILE 116 H ILE 116 10.676 -1.088 -5.742 1004 HA ILE 116 HA ILE 116 10.976 1.481 -4.509 1005 HB ILE 116 HB ILE 116 8.460 0.202 -5.688 1006 HG12 ILE 116 2HG1 ILE 116 10.251 0.385 -7.383 1007 HG13 ILE 116 3HG1 ILE 116 8.968 1.532 -7.734 1008 HG21 ILE 116 1HG2 ILE 116 9.022 3.128 -5.046 1009 HG22 ILE 116 2HG2 ILE 116 7.879 2.076 -4.207 1010 HG23 ILE 116 3HG2 ILE 116 7.597 2.519 -5.889 1011 HD11 ILE 116 3HD1 ILE 116 10.346 3.356 -6.852 1012 HD12 ILE 116 1HD1 ILE 116 11.172 2.475 -8.136 1013 HD13 ILE 116 2HD1 ILE 116 11.628 2.205 -6.456 1014 H VAL 117 H VAL 117 9.474 -1.576 -3.536 1015 HA VAL 117 HA VAL 117 8.143 -0.697 -1.199 1016 HB VAL 117 HB VAL 117 9.473 -3.386 -1.812 1017 HG11 VAL 117 1HG1 VAL 117 7.662 -2.725 0.549 1018 HG12 VAL 117 2HG1 VAL 117 9.376 -3.136 0.637 1019 HG13 VAL 117 3HG1 VAL 117 8.209 -4.342 0.097 1020 HG21 VAL 117 3HG2 VAL 117 6.543 -2.578 -1.796 1021 HG22 VAL 117 1HG2 VAL 117 7.172 -4.188 -2.156 1022 HG23 VAL 117 2HG2 VAL 117 7.534 -2.839 -3.229 1023 H ARG 118 H ARG 118 11.512 -1.766 -1.762 1024 HA ARG 118 HA ARG 118 12.394 -1.431 0.928 1025 HB2 ARG 118 2HB ARG 118 13.977 -1.609 -1.665 1026 HB3 ARG 118 3HB ARG 118 14.715 -1.580 -0.064 1027 HG2 ARG 118 2HG ARG 118 13.456 -3.667 0.511 1028 HG3 ARG 118 3HG ARG 118 12.842 -3.716 -1.143 1029 HD2 ARG 118 2HD ARG 118 15.756 -3.889 -0.310 1030 HD3 ARG 118 3HD ARG 118 14.753 -5.229 -0.866 1031 HE ARG 118 HE ARG 118 15.687 -2.962 -2.522 1032 HH11 ARG 118 1HH1 ARG 118 14.447 -6.234 -2.334 1033 HH12 ARG 118 2HH1 ARG 118 14.689 -6.549 -4.020 1034 HH21 ARG 118 1HH2 ARG 118 16.057 -3.393 -4.707 1035 HH22 ARG 118 2HH2 ARG 118 15.602 -4.935 -5.365 1036 H GLU 119 H GLU 119 12.220 0.746 -1.857 1037 HA GLU 119 HA GLU 119 13.693 2.908 -0.761 1038 HB2 GLU 119 2HB GLU 119 11.456 2.826 -2.833 1039 HB3 GLU 119 3HB GLU 119 12.268 4.316 -2.374 1040 HG2 GLU 119 2HG GLU 119 13.622 1.901 -3.601 1041 HG3 GLU 119 3HG GLU 119 13.144 3.355 -4.474 1042 H PHE 120 H PHE 120 10.198 2.131 -0.738 1043 HA PHE 120 HA PHE 120 9.317 4.257 0.869 1044 HB2 PHE 120 2HB PHE 120 8.171 1.488 0.343 1045 HB3 PHE 120 3HB PHE 120 7.347 2.633 1.396 1046 HD1 PHE 120 HD2 PHE 120 8.193 5.141 -0.379 1047 HD2 PHE 120 HD1 PHE 120 6.292 1.394 -1.232 1048 HE1 PHE 120 HE2 PHE 120 7.019 6.161 -2.281 1049 HE2 PHE 120 HE1 PHE 120 5.129 2.440 -3.130 1050 HZ PHE 120 HZ PHE 120 5.482 4.813 -3.650 1051 H MET 121 H MET 121 10.536 1.053 1.798 1052 HA MET 121 HA MET 121 10.114 1.375 4.611 1053 HB2 MET 121 2HB MET 121 11.925 -0.550 3.084 1054 HB3 MET 121 3HB MET 121 11.642 -0.622 4.821 1055 HG2 MET 121 2HG MET 121 9.184 -0.920 4.323 1056 HG3 MET 121 3HG MET 121 9.617 -1.082 2.622 1057 HE1 MET 121 3HE MET 121 11.013 -3.149 1.630 1058 HE2 MET 121 1HE MET 121 11.709 -4.418 2.640 1059 HE3 MET 121 2HE MET 121 12.357 -2.780 2.715 1060 H GLN 122 H GLN 122 12.716 2.241 2.432 1061 HA GLN 122 HA GLN 122 14.687 2.963 4.365 1062 HB2 GLN 122 2HB GLN 122 15.252 2.599 1.994 1063 HB3 GLN 122 3HB GLN 122 14.211 3.930 1.509 1064 HG2 GLN 122 2HG GLN 122 15.724 5.489 2.775 1065 HG3 GLN 122 3HG GLN 122 16.801 4.127 3.073 1066 HE21 GLN 122 1HE2 GLN 122 16.391 2.980 0.362 1067 HE22 GLN 122 2HE2 GLN 122 17.250 4.019 -0.718 1068 H LYS 123 H LYS 123 12.100 4.747 2.709 1069 HA LYS 123 HA LYS 123 12.637 7.332 3.787 1070 HB2 LYS 123 2HB LYS 123 10.020 6.207 2.689 1071 HB3 LYS 123 3HB LYS 123 10.370 7.914 2.944 1072 HG2 LYS 123 2HG LYS 123 12.067 7.875 1.190 1073 HG3 LYS 123 3HG LYS 123 11.870 6.134 1.004 1074 HD2 LYS 123 2HD LYS 123 9.423 6.601 0.382 1075 HD3 LYS 123 3HD LYS 123 9.868 8.308 0.295 1076 HE2 LYS 123 2HE LYS 123 11.008 6.052 -1.390 1077 HE3 LYS 123 3HE LYS 123 9.915 7.323 -1.936 1078 HZ1 LYS 123 3HZ LYS 123 11.686 8.935 -1.364 1079 HZ2 LYS 123 1HZ LYS 123 12.112 7.870 -2.603 1080 HZ3 LYS 123 2HZ LYS 123 12.722 7.643 -1.046 1081 H ALA 124 H ALA 124 10.334 4.757 4.619 1082 HA ALA 124 HA ALA 124 9.125 5.935 6.891 1083 HB1 ALA 124 3HB ALA 124 8.322 3.641 7.355 1084 HB2 ALA 124 1HB ALA 124 9.450 2.992 6.155 1085 HB3 ALA 124 2HB ALA 124 8.133 4.051 5.653 1086 H GLY 125 H GLY 125 11.982 3.924 6.410 1087 HA2 GLY 125 2HA GLY 125 12.667 3.466 9.125 1088 HA3 GLY 125 3HA GLY 125 13.737 3.322 7.736 1089 H SER 126 H SER 126 13.206 6.176 6.953 1090 HA SER 126 HA SER 126 15.138 7.492 8.678 1091 HB2 SER 126 2HB SER 126 15.244 7.747 6.211 1092 HB3 SER 126 3HB SER 126 13.659 8.530 6.211 1093 HG SER 126 HG SER 126 14.543 10.247 7.337 1094 H LEU 127 H LEU 127 11.664 7.520 8.108 1095 HA LEU 127 HA LEU 127 11.093 9.882 9.703 1096 HB2 LEU 127 2HB LEU 127 9.258 7.697 8.633 1097 HB3 LEU 127 3HB LEU 127 8.698 9.145 9.461 1098 HG LEU 127 HG LEU 127 10.149 9.085 6.790 1099 HD11 LEU 127 1HD1 LEU 127 7.245 9.686 7.409 1100 HD12 LEU 127 2HD1 LEU 127 7.869 8.233 6.624 1101 HD13 LEU 127 3HD1 LEU 127 8.019 9.795 5.825 1102 HD21 LEU 127 3HD2 LEU 127 10.731 11.119 8.012 1103 HD22 LEU 127 1HD2 LEU 127 9.023 11.465 8.305 1104 HD23 LEU 127 2HD2 LEU 127 9.669 11.500 6.661 1105 H GLU 128 H GLU 128 11.594 6.538 10.241 1106 HA GLU 128 HA GLU 128 10.164 6.001 12.583 1107 HB2 GLU 128 2HB GLU 128 11.259 4.278 11.183 1108 HB3 GLU 128 3HB GLU 128 12.842 4.915 11.601 1109 HG2 GLU 128 2HG GLU 128 12.550 2.938 12.883 1110 HG3 GLU 128 3HG GLU 128 12.367 4.280 14.007 1111 H HIS 129 H HIS 129 12.915 8.015 12.094 1112 HA HIS 129 HA HIS 129 14.670 7.684 14.078 1113 HB2 HIS 129 2HB HIS 129 15.366 9.997 13.810 1114 HB3 HIS 129 3HB HIS 129 14.850 9.371 12.249 1115 HD1 HIS 129 HD1 HIS 129 14.087 11.975 14.784 1116 HD2 HIS 129 HD2 HIS 129 12.394 10.555 11.266 1117 HE1 HIS 129 HE1 HIS 129 12.383 13.686 14.122 1118 HE2 HIS 129 HE2 HIS 129 11.348 12.784 12.023 1119 H HIS 130 H HIS 130 14.290 7.265 16.170 1120 HA HIS 130 HA HIS 130 12.477 8.748 17.844 1121 HB2 HIS 130 2HB HIS 130 13.413 7.497 19.709 1122 HB3 HIS 130 3HB HIS 130 13.143 6.401 18.366 1123 HD1 HIS 130 HD1 HIS 130 15.476 6.903 20.910 1124 HD2 HIS 130 HD2 HIS 130 15.867 6.197 16.833 1125 HE1 HIS 130 HE1 HIS 130 17.766 5.931 20.602 1126 HE2 HIS 130 HE2 HIS 130 17.940 5.420 18.155 1127 H HIS 131 H HIS 131 15.808 9.030 16.857 1128 HA HIS 131 HA HIS 131 15.771 11.851 17.717 1129 HB2 HIS 131 2HB HIS 131 18.155 9.958 17.971 1130 HB3 HIS 131 3HB HIS 131 18.302 11.709 18.050 1131 HD1 HIS 131 HD1 HIS 131 17.664 12.850 20.245 1132 HD2 HIS 131 HD2 HIS 131 16.949 8.759 20.248 1133 HE1 HIS 131 HE1 HIS 131 17.193 12.242 22.637 1134 HE2 HIS 131 HE2 HIS 131 16.656 9.788 22.588 1135 H HIS 132 H HIS 132 16.108 13.133 15.947 1136 HA HIS 132 HA HIS 132 16.693 12.052 13.355 1137 HB2 HIS 132 2HB HIS 132 15.285 14.020 13.483 1138 HB3 HIS 132 3HB HIS 132 16.511 14.921 14.365 1139 HD1 HIS 132 HD1 HIS 132 17.674 16.583 12.933 1140 HD2 HIS 132 HD2 HIS 132 16.415 13.294 10.716 1141 HE1 HIS 132 HE1 HIS 132 18.341 17.064 10.563 1142 HE2 HIS 132 HE2 HIS 132 17.407 15.155 9.230 1143 H HIS 133 H HIS 133 18.629 11.765 12.402 1144 HA HIS 133 HA HIS 133 21.102 12.598 13.818 1145 HB2 HIS 133 2HB HIS 133 20.653 10.250 11.904 1146 HB3 HIS 133 3HB HIS 133 22.165 10.638 12.724 1147 HD1 HIS 133 HD1 HIS 133 19.409 8.422 13.040 1148 HD2 HIS 133 HD2 HIS 133 21.649 10.629 15.751 1149 HE1 HIS 133 HE1 HIS 133 19.030 7.334 15.270 1150 HE2 HIS 133 HE2 HIS 133 20.564 8.563 16.833 1151 H HIS 134 H HIS 134 22.884 13.312 12.569 1152 HA HIS 134 HA HIS 134 22.258 14.442 9.915 1153 HB2 HIS 134 2HB HIS 134 24.397 15.178 11.960 1154 HB3 HIS 134 3HB HIS 134 24.463 15.742 10.294 1155 HD1 HIS 134 HD1 HIS 134 22.807 16.390 13.529 1156 HD2 HIS 134 HD2 HIS 134 22.361 17.577 9.578 1157 HE1 HIS 134 HE1 HIS 134 21.270 18.361 13.592 1158 HE2 HIS 134 HE2 HIS 134 21.219 19.202 11.230 Start of MODEL 18 1 H1 MET 1 1H MET 1 1.686 8.263 15.977 2 H2 MET 1 2H MET 1 0.209 7.527 16.305 3 H3 MET 1 3H MET 1 0.261 9.162 15.888 4 HA MET 1 HA MET 1 -0.502 7.842 14.036 5 HB2 MET 1 2HB MET 1 2.323 8.931 13.635 6 HB3 MET 1 3HB MET 1 1.206 8.556 12.329 7 HG2 MET 1 2HG MET 1 -0.326 10.287 13.139 8 HG3 MET 1 3HG MET 1 0.787 10.672 14.451 9 HE1 MET 1 3HE MET 1 3.237 11.786 14.042 10 HE2 MET 1 1HE MET 1 3.880 12.113 12.434 11 HE3 MET 1 2HE MET 1 3.659 10.448 12.970 12 H LYS 2 H LYS 2 0.623 6.575 12.108 13 HA LYS 2 HA LYS 2 2.430 4.430 13.014 14 HB2 LYS 2 2HB LYS 2 -0.238 4.022 11.567 15 HB3 LYS 2 3HB LYS 2 1.026 2.796 11.596 16 HG2 LYS 2 2HG LYS 2 0.833 2.651 14.053 17 HG3 LYS 2 3HG LYS 2 -0.439 3.881 14.019 18 HD2 LYS 2 2HD LYS 2 -1.864 2.392 12.654 19 HD3 LYS 2 3HD LYS 2 -0.592 1.164 12.638 20 HE2 LYS 2 2HE LYS 2 -2.008 2.179 15.127 21 HE3 LYS 2 3HE LYS 2 -2.383 0.675 14.284 22 HZ1 LYS 2 3HZ LYS 2 0.193 1.335 15.608 23 HZ2 LYS 2 1HZ LYS 2 -0.131 -0.099 14.765 24 HZ3 LYS 2 2HZ LYS 2 -0.983 0.264 16.180 25 H ILE 3 H ILE 3 3.547 3.448 11.258 26 HA ILE 3 HA ILE 3 3.680 4.953 8.735 27 HB ILE 3 HB ILE 3 5.418 2.635 9.738 28 HG12 ILE 3 2HG1 ILE 3 5.770 4.573 11.204 29 HG13 ILE 3 3HG1 ILE 3 7.182 4.356 10.179 30 HG21 ILE 3 1HG2 ILE 3 6.962 3.262 7.934 31 HG22 ILE 3 2HG2 ILE 3 5.846 4.513 7.384 32 HG23 ILE 3 3HG2 ILE 3 5.386 2.809 7.290 33 HD11 ILE 3 3HD1 ILE 3 6.633 6.700 10.441 34 HD12 ILE 3 1HD1 ILE 3 5.014 6.428 9.801 35 HD13 ILE 3 2HD1 ILE 3 6.424 6.215 8.759 36 H LEU 4 H LEU 4 2.162 4.248 7.281 37 HA LEU 4 HA LEU 4 1.553 1.352 7.128 38 HB2 LEU 4 2HB LEU 4 -0.210 3.671 6.246 39 HB3 LEU 4 3HB LEU 4 -0.626 1.969 6.166 40 HG LEU 4 HG LEU 4 -0.306 3.639 8.694 41 HD11 LEU 4 1HD1 LEU 4 -2.702 3.238 9.019 42 HD12 LEU 4 2HD1 LEU 4 -2.781 2.351 7.494 43 HD13 LEU 4 3HD1 LEU 4 -2.400 4.077 7.498 44 HD21 LEU 4 3HD2 LEU 4 0.516 1.370 9.115 45 HD22 LEU 4 1HD2 LEU 4 -0.984 0.687 8.479 46 HD23 LEU 4 2HD2 LEU 4 -1.004 1.654 9.958 47 H ILE 5 H ILE 5 2.818 0.573 5.503 48 HA ILE 5 HA ILE 5 3.206 2.124 3.040 49 HB ILE 5 HB ILE 5 4.157 -0.721 3.663 50 HG12 ILE 5 2HG1 ILE 5 5.142 0.876 5.296 51 HG13 ILE 5 3HG1 ILE 5 6.370 0.234 4.214 52 HG21 ILE 5 1HG2 ILE 5 5.048 1.218 1.484 53 HG22 ILE 5 2HG2 ILE 5 4.100 -0.253 1.254 54 HG23 ILE 5 3HG2 ILE 5 5.768 -0.364 1.809 55 HD11 ILE 5 3HD1 ILE 5 5.109 2.972 4.045 56 HD12 ILE 5 1HD1 ILE 5 6.335 2.336 2.944 57 HD13 ILE 5 2HD1 ILE 5 6.721 2.588 4.646 58 H LEU 6 H LEU 6 1.401 2.167 1.834 59 HA LEU 6 HA LEU 6 -0.514 -0.055 1.801 60 HB2 LEU 6 2HB LEU 6 -0.888 2.664 1.898 61 HB3 LEU 6 3HB LEU 6 -0.907 2.461 0.165 62 HG LEU 6 HG LEU 6 -3.180 2.446 0.800 63 HD11 LEU 6 1HD1 LEU 6 -4.080 0.226 0.320 64 HD12 LEU 6 2HD1 LEU 6 -2.499 -0.506 0.606 65 HD13 LEU 6 3HD1 LEU 6 -2.729 0.598 -0.751 66 HD21 LEU 6 3HD2 LEU 6 -4.126 1.127 2.665 67 HD22 LEU 6 1HD2 LEU 6 -2.907 2.280 3.206 68 HD23 LEU 6 2HD2 LEU 6 -2.506 0.567 3.080 69 H ILE 7 H ILE 7 -0.539 -1.461 0.047 70 HA ILE 7 HA ILE 7 0.775 -0.692 -2.492 71 HB ILE 7 HB ILE 7 1.301 -3.354 -1.052 72 HG12 ILE 7 2HG1 ILE 7 3.245 -1.063 -1.635 73 HG13 ILE 7 3HG1 ILE 7 2.538 -1.401 -0.062 74 HG21 ILE 7 1HG2 ILE 7 1.205 -3.661 -3.497 75 HG22 ILE 7 2HG2 ILE 7 2.860 -3.849 -2.920 76 HG23 ILE 7 3HG2 ILE 7 2.375 -2.357 -3.729 77 HD11 ILE 7 3HD1 ILE 7 4.800 -2.183 -0.191 78 HD12 ILE 7 1HD1 ILE 7 4.410 -3.198 -1.577 79 HD13 ILE 7 2HD1 ILE 7 3.693 -3.540 -0.001 80 H ASN 8 H ASN 8 -0.477 -1.172 -4.193 81 HA ASN 8 HA ASN 8 -2.574 -3.260 -3.980 82 HB2 ASN 8 2HB ASN 8 -3.554 -1.056 -4.329 83 HB3 ASN 8 3HB ASN 8 -2.453 -0.709 -5.647 84 HD21 ASN 8 1HD2 ASN 8 -5.265 -2.615 -4.689 85 HD22 ASN 8 2HD2 ASN 8 -5.834 -2.913 -6.295 86 H THR 9 H THR 9 -1.622 -5.031 -4.792 87 HA THR 9 HA THR 9 -0.862 -4.955 -7.641 88 HB THR 9 HB THR 9 1.213 -5.430 -6.488 89 HG1 THR 9 HG1 THR 9 1.607 -6.932 -7.895 90 HG21 THR 9 3HG2 THR 9 -0.197 -7.682 -5.006 91 HG22 THR 9 1HG2 THR 9 0.380 -6.174 -4.290 92 HG23 THR 9 2HG2 THR 9 1.533 -7.335 -4.950 93 H ASN 10 H ASN 10 -2.190 -6.179 -8.861 94 HA ASN 10 HA ASN 10 -4.380 -7.619 -7.636 95 HB2 ASN 10 2HB ASN 10 -4.808 -6.208 -9.591 96 HB3 ASN 10 3HB ASN 10 -3.647 -7.110 -10.552 97 HD21 ASN 10 1HD2 ASN 10 -4.283 -9.015 -11.501 98 HD22 ASN 10 2HD2 ASN 10 -5.901 -9.615 -11.469 99 H ASN 11 H ASN 11 -1.258 -8.386 -8.527 100 HA ASN 11 HA ASN 11 -1.764 -11.165 -9.337 101 HB2 ASN 11 2HB ASN 11 -0.174 -9.819 -10.693 102 HB3 ASN 11 3HB ASN 11 0.836 -9.573 -9.270 103 HD21 ASN 11 1HD2 ASN 11 2.540 -10.519 -10.476 104 HD22 ASN 11 2HD2 ASN 11 2.669 -12.233 -10.650 105 H ASP 12 H ASP 12 -1.787 -12.670 -7.848 106 HA ASP 12 HA ASP 12 -1.315 -12.402 -5.110 107 HB2 ASP 12 2HB ASP 12 -2.804 -14.108 -6.055 108 HB3 ASP 12 3HB ASP 12 -1.447 -14.918 -6.825 109 H GLU 13 H GLU 13 0.868 -13.359 -7.676 110 HA GLU 13 HA GLU 13 2.943 -14.596 -6.257 111 HB2 GLU 13 2HB GLU 13 3.128 -12.830 -8.741 112 HB3 GLU 13 3HB GLU 13 4.418 -13.881 -8.157 113 HG2 GLU 13 2HG GLU 13 2.981 -15.851 -8.523 114 HG3 GLU 13 3HG GLU 13 1.687 -14.802 -9.101 115 H LEU 14 H LEU 14 2.488 -11.132 -7.089 116 HA LEU 14 HA LEU 14 4.827 -10.264 -5.701 117 HB2 LEU 14 2HB LEU 14 2.518 -8.773 -6.958 118 HB3 LEU 14 3HB LEU 14 3.617 -7.915 -5.894 119 HG LEU 14 HG LEU 14 4.315 -7.541 -8.165 120 HD11 LEU 14 1HD1 LEU 14 6.645 -8.249 -8.106 121 HD12 LEU 14 2HD1 LEU 14 6.287 -9.452 -6.865 122 HD13 LEU 14 3HD1 LEU 14 6.116 -7.731 -6.507 123 HD21 LEU 14 3HD2 LEU 14 4.977 -9.312 -9.710 124 HD22 LEU 14 1HD2 LEU 14 3.289 -9.476 -9.238 125 HD23 LEU 14 2HD2 LEU 14 4.506 -10.544 -8.537 126 H ILE 15 H ILE 15 1.451 -10.620 -4.699 127 HA ILE 15 HA ILE 15 1.459 -9.109 -2.343 128 HB ILE 15 HB ILE 15 0.025 -11.777 -2.818 129 HG12 ILE 15 2HG1 ILE 15 -0.954 -8.903 -3.213 130 HG13 ILE 15 3HG1 ILE 15 -0.592 -10.057 -4.489 131 HG21 ILE 15 1HG2 ILE 15 0.112 -11.278 -0.402 132 HG22 ILE 15 2HG2 ILE 15 -1.535 -11.116 -1.007 133 HG23 ILE 15 3HG2 ILE 15 -0.568 -9.674 -0.688 134 HD11 ILE 15 3HD1 ILE 15 -2.467 -11.457 -3.746 135 HD12 ILE 15 1HD1 ILE 15 -2.977 -9.825 -4.177 136 HD13 ILE 15 2HD1 ILE 15 -2.836 -10.283 -2.480 137 H LYS 16 H LYS 16 2.330 -12.560 -2.747 138 HA LYS 16 HA LYS 16 3.145 -12.886 -0.004 139 HB2 LYS 16 2HB LYS 16 3.717 -15.189 -0.662 140 HB3 LYS 16 3HB LYS 16 2.118 -14.736 -1.242 141 HG2 LYS 16 2HG LYS 16 3.094 -14.315 -3.502 142 HG3 LYS 16 3HG LYS 16 4.654 -14.882 -2.907 143 HD2 LYS 16 2HD LYS 16 2.097 -16.524 -3.148 144 HD3 LYS 16 3HD LYS 16 3.534 -16.656 -4.162 145 HE2 LYS 16 2HE LYS 16 4.839 -17.380 -2.162 146 HE3 LYS 16 3HE LYS 16 3.355 -17.327 -1.205 147 HZ1 LYS 16 3HZ LYS 16 2.408 -18.989 -2.747 148 HZ2 LYS 16 1HZ LYS 16 3.761 -19.566 -1.916 149 HZ3 LYS 16 2HZ LYS 16 3.899 -19.097 -3.531 150 H LYS 17 H LYS 17 4.869 -12.230 -3.043 151 HA LYS 17 HA LYS 17 7.531 -12.719 -2.156 152 HB2 LYS 17 2HB LYS 17 6.410 -10.964 -4.375 153 HB3 LYS 17 3HB LYS 17 8.141 -11.045 -4.059 154 HG2 LYS 17 2HG LYS 17 8.206 -13.402 -4.598 155 HG3 LYS 17 3HG LYS 17 6.444 -13.479 -4.693 156 HD2 LYS 17 2HD LYS 17 7.416 -13.441 -6.947 157 HD3 LYS 17 3HD LYS 17 6.474 -11.978 -6.661 158 HE2 LYS 17 2HE LYS 17 8.583 -10.743 -6.190 159 HE3 LYS 17 3HE LYS 17 9.502 -12.210 -6.540 160 HZ1 LYS 17 3HZ LYS 17 8.656 -12.175 -8.794 161 HZ2 LYS 17 1HZ LYS 17 9.418 -10.710 -8.446 162 HZ3 LYS 17 2HZ LYS 17 7.731 -10.802 -8.473 163 H ILE 18 H ILE 18 5.641 -9.705 -2.340 164 HA ILE 18 HA ILE 18 7.505 -7.922 -1.213 165 HB ILE 18 HB ILE 18 4.453 -7.810 -1.336 166 HG12 ILE 18 2HG1 ILE 18 6.560 -6.269 -2.938 167 HG13 ILE 18 3HG1 ILE 18 5.715 -7.699 -3.514 168 HG21 ILE 18 1HG2 ILE 18 4.574 -5.410 -0.742 169 HG22 ILE 18 2HG2 ILE 18 6.301 -5.576 -0.423 170 HG23 ILE 18 3HG2 ILE 18 5.133 -6.439 0.579 171 HD11 ILE 18 3HD1 ILE 18 4.453 -5.040 -2.865 172 HD12 ILE 18 1HD1 ILE 18 3.593 -6.481 -3.416 173 HD13 ILE 18 2HD1 ILE 18 4.772 -5.699 -4.469 174 H LYS 19 H LYS 19 4.979 -9.974 0.295 175 HA LYS 19 HA LYS 19 5.127 -9.097 2.941 176 HB2 LYS 19 2HB LYS 19 4.567 -11.874 1.831 177 HB3 LYS 19 3HB LYS 19 4.502 -11.534 3.560 178 HG2 LYS 19 2HG LYS 19 2.770 -9.810 3.130 179 HG3 LYS 19 3HG LYS 19 2.783 -10.247 1.421 180 HD2 LYS 19 2HD LYS 19 2.035 -12.527 1.980 181 HD3 LYS 19 3HD LYS 19 2.096 -12.140 3.703 182 HE2 LYS 19 2HE LYS 19 0.351 -10.394 3.334 183 HE3 LYS 19 3HE LYS 19 0.249 -10.891 1.642 184 HZ1 LYS 19 3HZ LYS 19 -0.322 -12.632 3.985 185 HZ2 LYS 19 1HZ LYS 19 -0.461 -13.086 2.361 186 HZ3 LYS 19 2HZ LYS 19 -1.481 -11.904 3.001 187 H LYS 20 H LYS 20 7.251 -11.390 1.252 188 HA LYS 20 HA LYS 20 8.734 -12.131 3.625 189 HB2 LYS 20 2HB LYS 20 9.155 -12.765 0.675 190 HB3 LYS 20 3HB LYS 20 10.171 -13.412 1.961 191 HG2 LYS 20 2HG LYS 20 7.178 -13.855 1.698 192 HG3 LYS 20 3HG LYS 20 8.423 -15.022 1.241 193 HD2 LYS 20 2HD LYS 20 9.140 -15.258 3.545 194 HD3 LYS 20 3HD LYS 20 8.109 -13.925 4.064 195 HE2 LYS 20 2HE LYS 20 6.105 -15.262 3.550 196 HE3 LYS 20 3HE LYS 20 7.129 -16.595 2.995 197 HZ1 LYS 20 3HZ LYS 20 8.048 -16.808 5.185 198 HZ2 LYS 20 1HZ LYS 20 6.365 -16.859 5.310 199 HZ3 LYS 20 2HZ LYS 20 7.204 -15.454 5.739 200 H GLU 21 H GLU 21 9.471 -10.180 0.726 201 HA GLU 21 HA GLU 21 11.961 -9.164 1.239 202 HB2 GLU 21 2HB GLU 21 9.559 -7.567 0.241 203 HB3 GLU 21 3HB GLU 21 11.227 -7.026 0.111 204 HG2 GLU 21 2HG GLU 21 10.070 -9.487 -1.230 205 HG3 GLU 21 3HG GLU 21 10.311 -7.929 -2.010 206 H VAL 22 H VAL 22 8.926 -8.070 2.695 207 HA VAL 22 HA VAL 22 10.282 -6.001 4.289 208 HB VAL 22 HB VAL 22 8.129 -5.038 4.676 209 HG11 VAL 22 1HG1 VAL 22 7.306 -4.664 2.366 210 HG12 VAL 22 2HG1 VAL 22 8.255 -6.038 1.802 211 HG13 VAL 22 3HG1 VAL 22 9.063 -4.612 2.453 212 HG21 VAL 22 3HG2 VAL 22 6.817 -7.025 5.212 213 HG22 VAL 22 1HG2 VAL 22 6.883 -7.572 3.535 214 HG23 VAL 22 2HG2 VAL 22 5.991 -6.108 3.956 215 H GLU 23 H GLU 23 9.112 -9.204 4.669 216 HA GLU 23 HA GLU 23 8.388 -9.288 7.405 217 HB2 GLU 23 2HB GLU 23 7.902 -11.137 5.848 218 HB3 GLU 23 3HB GLU 23 9.616 -11.468 5.647 219 HG2 GLU 23 2HG GLU 23 9.758 -12.180 7.996 220 HG3 GLU 23 3HG GLU 23 8.050 -11.797 8.228 221 H ASN 24 H ASN 24 11.472 -9.711 5.744 222 HA ASN 24 HA ASN 24 13.123 -10.186 8.011 223 HB2 ASN 24 2HB ASN 24 13.834 -9.086 5.249 224 HB3 ASN 24 3HB ASN 24 15.018 -9.575 6.460 225 HD21 ASN 24 1HD2 ASN 24 15.914 -11.178 5.167 226 HD22 ASN 24 2HD2 ASN 24 15.088 -12.650 4.779 227 H GLN 25 H GLN 25 11.702 -7.312 6.709 228 HA GLN 25 HA GLN 25 13.473 -5.506 8.224 229 HB2 GLN 25 2HB GLN 25 11.392 -4.887 6.077 230 HB3 GLN 25 3HB GLN 25 12.447 -3.702 6.854 231 HG2 GLN 25 2HG GLN 25 13.344 -6.029 5.123 232 HG3 GLN 25 3HG GLN 25 13.320 -4.328 4.657 233 HE21 GLN 25 1HE2 GLN 25 15.436 -6.563 5.287 234 HE22 GLN 25 2HE2 GLN 25 16.655 -5.675 6.125 235 H GLY 26 H GLY 26 10.927 -7.254 8.993 236 HA2 GLY 26 2HA GLY 26 9.657 -7.251 10.866 237 HA3 GLY 26 3HA GLY 26 10.411 -5.738 11.319 238 H TYR 27 H TYR 27 8.587 -5.940 8.314 239 HA TYR 27 HA TYR 27 6.594 -4.069 9.394 240 HB2 TYR 27 2HB TYR 27 7.280 -4.954 6.562 241 HB3 TYR 27 3HB TYR 27 5.808 -4.052 6.909 242 HD1 TYR 27 HD2 TYR 27 9.527 -3.889 7.177 243 HD2 TYR 27 HD1 TYR 27 5.872 -1.675 7.124 244 HE1 TYR 27 HE2 TYR 27 10.800 -1.792 7.060 245 HE2 TYR 27 HE1 TYR 27 7.146 0.426 7.010 246 HH TYR 27 HH TYR 27 10.447 0.531 6.290 247 H GLN 28 H GLN 28 4.953 -5.005 10.423 248 HA GLN 28 HA GLN 28 4.021 -7.673 9.987 249 HB2 GLN 28 2HB GLN 28 2.613 -5.395 11.447 250 HB3 GLN 28 3HB GLN 28 2.252 -7.112 11.603 251 HG2 GLN 28 2HG GLN 28 4.502 -7.465 12.599 252 HG3 GLN 28 3HG GLN 28 4.808 -5.731 12.481 253 HE21 GLN 28 1HE2 GLN 28 3.067 -8.226 14.175 254 HE22 GLN 28 2HE2 GLN 28 2.493 -7.240 15.475 255 H VAL 29 H VAL 29 3.070 -8.168 8.082 256 HA VAL 29 HA VAL 29 1.692 -6.169 6.501 257 HB VAL 29 HB VAL 29 2.068 -9.128 5.837 258 HG11 VAL 29 1HG1 VAL 29 1.701 -8.395 3.494 259 HG12 VAL 29 2HG1 VAL 29 1.400 -6.749 4.053 260 HG13 VAL 29 3HG1 VAL 29 0.299 -8.051 4.508 261 HG21 VAL 29 3HG2 VAL 29 4.251 -8.061 6.209 262 HG22 VAL 29 1HG2 VAL 29 3.833 -6.767 5.081 263 HG23 VAL 29 2HG2 VAL 29 4.022 -8.423 4.497 264 H ARG 30 H ARG 30 -0.409 -5.938 6.288 265 HA ARG 30 HA ARG 30 -2.325 -8.003 7.156 266 HB2 ARG 30 2HB ARG 30 -2.505 -4.975 7.550 267 HB3 ARG 30 3HB ARG 30 -3.860 -6.072 7.797 268 HG2 ARG 30 2HG ARG 30 -1.270 -5.990 9.383 269 HG3 ARG 30 3HG ARG 30 -2.877 -5.518 9.946 270 HD2 ARG 30 2HD ARG 30 -3.614 -7.911 9.557 271 HD3 ARG 30 3HD ARG 30 -1.934 -8.305 9.215 272 HE ARG 30 HE ARG 30 -1.393 -7.759 11.508 273 HH11 ARG 30 1HH1 ARG 30 -4.828 -8.184 10.808 274 HH12 ARG 30 2HH1 ARG 30 -5.227 -8.575 12.453 275 HH21 ARG 30 1HH2 ARG 30 -1.925 -8.338 13.628 276 HH22 ARG 30 2HH2 ARG 30 -3.578 -8.661 14.053 277 H ASP 31 H ASP 31 -3.284 -8.719 5.403 278 HA ASP 31 HA ASP 31 -3.548 -6.998 2.997 279 HB2 ASP 31 2HB ASP 31 -3.391 -9.018 1.633 280 HB3 ASP 31 3HB ASP 31 -1.997 -8.921 2.697 281 H VAL 32 H VAL 32 -5.529 -6.844 2.025 282 HA VAL 32 HA VAL 32 -7.885 -7.993 3.395 283 HB VAL 32 HB VAL 32 -7.392 -5.024 2.825 284 HG11 VAL 32 1HG1 VAL 32 -9.940 -6.336 3.840 285 HG12 VAL 32 2HG1 VAL 32 -9.704 -5.567 2.268 286 HG13 VAL 32 3HG1 VAL 32 -9.642 -4.598 3.736 287 HG21 VAL 32 3HG2 VAL 32 -7.676 -4.695 5.263 288 HG22 VAL 32 1HG2 VAL 32 -6.311 -5.753 4.904 289 HG23 VAL 32 2HG2 VAL 32 -7.829 -6.440 5.489 290 H ASN 33 H ASN 33 -9.330 -8.726 1.956 291 HA ASN 33 HA ASN 33 -9.597 -7.510 -0.723 292 HB2 ASN 33 2HB ASN 33 -9.359 -10.503 -0.152 293 HB3 ASN 33 3HB ASN 33 -9.875 -9.835 -1.698 294 HD21 ASN 33 1HD2 ASN 33 -7.532 -11.503 -0.992 295 HD22 ASN 33 2HD2 ASN 33 -6.155 -10.630 -1.562 296 H ASP 34 H ASP 34 -11.099 -7.611 1.974 297 HA ASP 34 HA ASP 34 -13.781 -7.802 0.782 298 HB2 ASP 34 2HB ASP 34 -13.414 -9.995 1.870 299 HB3 ASP 34 3HB ASP 34 -12.970 -9.199 3.373 300 H SER 35 H SER 35 -15.290 -6.400 1.735 301 HA SER 35 HA SER 35 -14.339 -3.979 2.745 302 HB2 SER 35 2HB SER 35 -16.781 -3.402 2.957 303 HB3 SER 35 3HB SER 35 -16.354 -4.104 1.397 304 HG SER 35 HG SER 35 -17.636 -5.722 1.792 305 H ASP 36 H ASP 36 -16.026 -6.623 4.500 306 HA ASP 36 HA ASP 36 -16.142 -5.213 6.989 307 HB2 ASP 36 2HB ASP 36 -16.475 -8.156 6.320 308 HB3 ASP 36 3HB ASP 36 -16.567 -7.567 7.979 309 H GLU 37 H GLU 37 -13.763 -7.351 5.524 310 HA GLU 37 HA GLU 37 -12.067 -7.649 7.801 311 HB2 GLU 37 2HB GLU 37 -11.416 -7.800 4.833 312 HB3 GLU 37 3HB GLU 37 -10.312 -8.282 6.122 313 HG2 GLU 37 2HG GLU 37 -13.018 -9.525 5.563 314 HG3 GLU 37 3HG GLU 37 -11.465 -10.199 5.082 315 H LEU 38 H LEU 38 -12.250 -5.272 5.200 316 HA LEU 38 HA LEU 38 -10.034 -3.659 5.796 317 HB2 LEU 38 2HB LEU 38 -11.111 -3.310 3.737 318 HB3 LEU 38 3HB LEU 38 -12.701 -3.222 4.445 319 HG LEU 38 HG LEU 38 -10.868 -0.954 5.169 320 HD11 LEU 38 1HD1 LEU 38 -11.206 0.226 3.050 321 HD12 LEU 38 2HD1 LEU 38 -11.976 -1.203 2.352 322 HD13 LEU 38 3HD1 LEU 38 -10.270 -1.248 2.806 323 HD21 LEU 38 3HD2 LEU 38 -13.768 -1.059 4.243 324 HD22 LEU 38 1HD2 LEU 38 -12.917 0.383 4.808 325 HD23 LEU 38 2HD2 LEU 38 -13.213 -0.953 5.916 326 H LYS 39 H LYS 39 -13.338 -3.615 7.022 327 HA LYS 39 HA LYS 39 -13.118 -1.412 8.787 328 HB2 LYS 39 2HB LYS 39 -14.979 -3.824 8.767 329 HB3 LYS 39 3HB LYS 39 -15.191 -2.448 9.846 330 HG2 LYS 39 2HG LYS 39 -15.723 -0.973 8.042 331 HG3 LYS 39 3HG LYS 39 -15.118 -2.106 6.832 332 HD2 LYS 39 2HD LYS 39 -17.607 -2.013 6.875 333 HD3 LYS 39 3HD LYS 39 -16.990 -3.624 7.238 334 HE2 LYS 39 2HE LYS 39 -17.327 -3.143 9.676 335 HE3 LYS 39 3HE LYS 39 -18.057 -1.599 9.233 336 HZ1 LYS 39 3HZ LYS 39 -19.690 -3.371 9.669 337 HZ2 LYS 39 1HZ LYS 39 -19.079 -4.257 8.362 338 HZ3 LYS 39 2HZ LYS 39 -19.815 -2.755 8.102 339 H LYS 40 H LYS 40 -12.494 -4.916 9.230 340 HA LYS 40 HA LYS 40 -12.196 -4.944 12.047 341 HB2 LYS 40 2HB LYS 40 -10.933 -6.801 9.977 342 HB3 LYS 40 3HB LYS 40 -10.927 -7.102 11.711 343 HG2 LYS 40 2HG LYS 40 -13.330 -7.044 9.875 344 HG3 LYS 40 3HG LYS 40 -12.628 -8.457 10.658 345 HD2 LYS 40 2HD LYS 40 -13.273 -7.503 12.876 346 HD3 LYS 40 3HD LYS 40 -14.011 -6.129 12.049 347 HE2 LYS 40 2HE LYS 40 -15.548 -7.738 10.878 348 HE3 LYS 40 3HE LYS 40 -14.875 -9.034 11.874 349 HZ1 LYS 40 3HZ LYS 40 -16.272 -6.616 12.890 350 HZ2 LYS 40 1HZ LYS 40 -15.631 -7.851 13.851 351 HZ3 LYS 40 2HZ LYS 40 -16.927 -8.170 12.814 352 H GLU 41 H GLU 41 -9.771 -4.637 9.450 353 HA GLU 41 HA GLU 41 -7.498 -4.532 11.183 354 HB2 GLU 41 2HB GLU 41 -7.681 -3.619 8.279 355 HB3 GLU 41 3HB GLU 41 -6.207 -4.026 9.156 356 HG2 GLU 41 2HG GLU 41 -8.441 -5.969 8.504 357 HG3 GLU 41 3HG GLU 41 -6.967 -5.792 7.568 358 H MET 42 H MET 42 -9.542 -2.085 9.625 359 HA MET 42 HA MET 42 -8.081 0.219 10.387 360 HB2 MET 42 2HB MET 42 -10.904 -0.294 9.450 361 HB3 MET 42 3HB MET 42 -10.578 1.255 10.218 362 HG2 MET 42 2HG MET 42 -9.094 0.157 7.823 363 HG3 MET 42 3HG MET 42 -10.362 1.390 7.787 364 HE1 MET 42 3HE MET 42 -7.235 1.654 6.679 365 HE2 MET 42 1HE MET 42 -6.949 3.336 7.116 366 HE3 MET 42 2HE MET 42 -8.492 2.863 6.409 367 H LYS 43 H LYS 43 -10.542 -1.692 12.054 368 HA LYS 43 HA LYS 43 -10.897 -0.049 14.322 369 HB2 LYS 43 2HB LYS 43 -11.282 -3.022 13.843 370 HB3 LYS 43 3HB LYS 43 -11.459 -2.370 15.467 371 HG2 LYS 43 2HG LYS 43 -13.052 -1.450 13.057 372 HG3 LYS 43 3HG LYS 43 -13.619 -2.607 14.269 373 HD2 LYS 43 2HD LYS 43 -13.408 -0.866 16.024 374 HD3 LYS 43 3HD LYS 43 -12.830 0.286 14.816 375 HE2 LYS 43 2HE LYS 43 -14.989 0.183 13.656 376 HE3 LYS 43 3HE LYS 43 -15.569 -1.027 14.807 377 HZ1 LYS 43 3HZ LYS 43 -16.333 1.215 15.355 378 HZ2 LYS 43 1HZ LYS 43 -14.734 1.734 15.515 379 HZ3 LYS 43 2HZ LYS 43 -15.357 0.581 16.580 380 H LYS 44 H LYS 44 -8.473 -2.528 13.551 381 HA LYS 44 HA LYS 44 -7.282 -2.614 16.157 382 HB2 LYS 44 2HB LYS 44 -6.014 -3.425 13.502 383 HB3 LYS 44 3HB LYS 44 -5.503 -3.941 15.104 384 HG2 LYS 44 2HG LYS 44 -8.094 -4.684 13.717 385 HG3 LYS 44 3HG LYS 44 -6.687 -5.716 13.906 386 HD2 LYS 44 2HD LYS 44 -8.080 -6.533 15.583 387 HD3 LYS 44 3HD LYS 44 -7.117 -5.379 16.499 388 HE2 LYS 44 2HE LYS 44 -8.961 -3.727 16.289 389 HE3 LYS 44 3HE LYS 44 -9.907 -4.912 15.392 390 HZ1 LYS 44 3HZ LYS 44 -10.507 -4.754 17.757 391 HZ2 LYS 44 1HZ LYS 44 -8.960 -5.289 18.183 392 HZ3 LYS 44 2HZ LYS 44 -9.998 -6.300 17.320 393 H LEU 45 H LEU 45 -6.602 -0.764 13.200 394 HA LEU 45 HA LEU 45 -4.210 0.511 14.042 395 HB2 LEU 45 2HB LEU 45 -6.337 1.569 12.128 396 HB3 LEU 45 3HB LEU 45 -4.690 2.169 12.253 397 HG LEU 45 HG LEU 45 -5.534 -0.573 11.228 398 HD11 LEU 45 1HD1 LEU 45 -4.716 0.178 9.044 399 HD12 LEU 45 2HD1 LEU 45 -4.362 1.773 9.711 400 HD13 LEU 45 3HD1 LEU 45 -6.030 1.201 9.629 401 HD21 LEU 45 3HD2 LEU 45 -3.384 -0.756 12.405 402 HD22 LEU 45 1HD2 LEU 45 -2.718 0.541 11.409 403 HD23 LEU 45 2HD2 LEU 45 -3.188 -0.992 10.670 404 H ALA 46 H ALA 46 -7.627 1.256 14.464 405 HA ALA 46 HA ALA 46 -7.306 3.881 15.592 406 HB1 ALA 46 3HB ALA 46 -9.735 2.048 15.566 407 HB2 ALA 46 1HB ALA 46 -9.324 3.237 14.328 408 HB3 ALA 46 2HB ALA 46 -9.741 3.772 15.957 409 H GLU 47 H GLU 47 -7.930 0.648 16.930 410 HA GLU 47 HA GLU 47 -8.388 1.519 19.657 411 HB2 GLU 47 2HB GLU 47 -8.146 -1.222 18.348 412 HB3 GLU 47 3HB GLU 47 -8.411 -1.029 20.075 413 HG2 GLU 47 2HG GLU 47 -10.557 0.089 19.650 414 HG3 GLU 47 3HG GLU 47 -10.279 -0.004 17.910 415 H GLU 48 H GLU 48 -5.725 0.417 17.774 416 HA GLU 48 HA GLU 48 -3.940 0.330 20.138 417 HB2 GLU 48 2HB GLU 48 -4.497 -1.959 19.186 418 HB3 GLU 48 3HB GLU 48 -3.783 -1.455 17.660 419 HG2 GLU 48 2HG GLU 48 -1.590 -1.183 18.782 420 HG3 GLU 48 3HG GLU 48 -2.313 -1.706 20.306 421 H LYS 49 H LYS 49 -4.164 2.679 19.183 422 HA LYS 49 HA LYS 49 -2.478 3.236 16.888 423 HB2 LYS 49 2HB LYS 49 -4.512 4.616 17.430 424 HB3 LYS 49 3HB LYS 49 -3.706 5.181 18.892 425 HG2 LYS 49 2HG LYS 49 -1.858 6.090 17.349 426 HG3 LYS 49 3HG LYS 49 -2.956 5.766 16.004 427 HD2 LYS 49 2HD LYS 49 -3.472 7.634 18.355 428 HD3 LYS 49 3HD LYS 49 -3.106 8.115 16.698 429 HE2 LYS 49 2HE LYS 49 -5.586 6.592 17.567 430 HE3 LYS 49 3HE LYS 49 -5.510 8.320 17.219 431 HZ1 LYS 49 3HZ LYS 49 -4.791 7.738 14.946 432 HZ2 LYS 49 1HZ LYS 49 -6.346 7.186 15.315 433 HZ3 LYS 49 2HZ LYS 49 -5.047 6.106 15.301 434 H ASN 50 H ASN 50 -0.751 1.962 18.045 435 HA ASN 50 HA ASN 50 1.052 3.743 19.564 436 HB2 ASN 50 2HB ASN 50 2.498 1.737 19.835 437 HB3 ASN 50 3HB ASN 50 0.876 1.426 20.441 438 HD21 ASN 50 1HD2 ASN 50 2.986 -0.432 19.505 439 HD22 ASN 50 2HD2 ASN 50 2.243 -1.384 18.265 440 H PHE 51 H PHE 51 3.171 4.192 18.644 441 HA PHE 51 HA PHE 51 3.220 4.557 15.826 442 HB2 PHE 51 2HB PHE 51 4.532 5.993 17.404 443 HB3 PHE 51 3HB PHE 51 5.597 4.629 17.738 444 HD1 PHE 51 HD2 PHE 51 4.361 6.816 14.951 445 HD2 PHE 51 HD1 PHE 51 7.464 4.213 16.331 446 HE1 PHE 51 HE2 PHE 51 5.734 7.397 12.987 447 HE2 PHE 51 HE1 PHE 51 8.815 4.795 14.373 448 HZ PHE 51 HZ PHE 51 7.960 6.381 12.698 449 H GLU 52 H GLU 52 3.340 2.932 14.405 450 HA GLU 52 HA GLU 52 4.877 0.495 14.932 451 HB2 GLU 52 2HB GLU 52 2.722 0.253 16.151 452 HB3 GLU 52 3HB GLU 52 1.832 0.547 14.661 453 HG2 GLU 52 2HG GLU 52 2.650 -1.531 13.710 454 HG3 GLU 52 3HG GLU 52 3.695 -1.802 15.105 455 H LYS 53 H LYS 53 5.245 -0.711 13.076 456 HA LYS 53 HA LYS 53 4.751 0.693 10.531 457 HB2 LYS 53 2HB LYS 53 6.765 -0.516 9.669 458 HB3 LYS 53 3HB LYS 53 7.108 0.591 10.981 459 HG2 LYS 53 2HG LYS 53 6.839 -2.397 11.430 460 HG3 LYS 53 3HG LYS 53 8.360 -1.646 10.944 461 HD2 LYS 53 2HD LYS 53 8.191 -0.170 13.003 462 HD3 LYS 53 3HD LYS 53 6.810 -1.140 13.514 463 HE2 LYS 53 2HE LYS 53 9.639 -2.131 13.084 464 HE3 LYS 53 3HE LYS 53 8.846 -1.879 14.635 465 HZ1 LYS 53 3HZ LYS 53 7.341 -3.646 14.158 466 HZ2 LYS 53 1HZ LYS 53 8.907 -4.213 13.914 467 HZ3 LYS 53 2HZ LYS 53 7.935 -3.818 12.594 468 H ILE 54 H ILE 54 2.939 -0.099 9.759 469 HA ILE 54 HA ILE 54 2.548 -3.018 9.421 470 HB ILE 54 HB ILE 54 0.429 -0.805 9.451 471 HG12 ILE 54 2HG1 ILE 54 1.339 -1.126 11.715 472 HG13 ILE 54 3HG1 ILE 54 -0.306 -1.747 11.636 473 HG21 ILE 54 1HG2 ILE 54 -1.241 -2.633 9.503 474 HG22 ILE 54 2HG2 ILE 54 0.050 -3.822 9.319 475 HG23 ILE 54 3HG2 ILE 54 -0.277 -2.665 8.025 476 HD11 ILE 54 3HD1 ILE 54 0.588 -4.037 11.464 477 HD12 ILE 54 1HD1 ILE 54 1.108 -3.208 12.931 478 HD13 ILE 54 2HD1 ILE 54 2.227 -3.389 11.582 479 H LEU 55 H LEU 55 2.196 -3.752 7.364 480 HA LEU 55 HA LEU 55 2.193 -1.786 5.130 481 HB2 LEU 55 2HB LEU 55 4.253 -3.232 5.362 482 HB3 LEU 55 3HB LEU 55 3.265 -4.649 5.069 483 HG LEU 55 HG LEU 55 3.319 -2.416 3.010 484 HD11 LEU 55 1HD1 LEU 55 5.675 -2.885 3.501 485 HD12 LEU 55 2HD1 LEU 55 5.221 -3.394 1.878 486 HD13 LEU 55 3HD1 LEU 55 5.408 -4.596 3.158 487 HD21 LEU 55 3HD2 LEU 55 1.691 -4.204 2.649 488 HD22 LEU 55 1HD2 LEU 55 2.972 -5.418 2.720 489 HD23 LEU 55 2HD2 LEU 55 2.938 -4.236 1.407 490 H ILE 56 H ILE 56 0.257 -1.696 4.158 491 HA ILE 56 HA ILE 56 -1.679 -3.885 4.551 492 HB ILE 56 HB ILE 56 -2.186 -1.033 3.571 493 HG12 ILE 56 2HG1 ILE 56 -1.493 -1.101 5.988 494 HG13 ILE 56 3HG1 ILE 56 -3.131 -0.509 5.758 495 HG21 ILE 56 1HG2 ILE 56 -4.592 -1.532 3.910 496 HG22 ILE 56 2HG2 ILE 56 -4.191 -3.202 4.316 497 HG23 ILE 56 3HG2 ILE 56 -3.867 -2.586 2.693 498 HD11 ILE 56 3HD1 ILE 56 -4.014 -2.687 6.468 499 HD12 ILE 56 1HD1 ILE 56 -2.974 -1.957 7.691 500 HD13 ILE 56 2HD1 ILE 56 -2.364 -3.276 6.694 501 H ILE 57 H ILE 57 -1.852 -5.281 2.875 502 HA ILE 57 HA ILE 57 -1.424 -4.334 0.088 503 HB ILE 57 HB ILE 57 -1.568 -7.215 1.132 504 HG12 ILE 57 2HG1 ILE 57 0.837 -5.651 0.080 505 HG13 ILE 57 3HG1 ILE 57 0.527 -6.007 1.773 506 HG21 ILE 57 1HG2 ILE 57 -0.991 -6.236 -1.697 507 HG22 ILE 57 2HG2 ILE 57 -2.447 -7.080 -1.168 508 HG23 ILE 57 3HG2 ILE 57 -0.893 -7.913 -1.152 509 HD11 ILE 57 3HD1 ILE 57 1.092 -8.044 -0.377 510 HD12 ILE 57 1HD1 ILE 57 0.790 -8.386 1.331 511 HD13 ILE 57 2HD1 ILE 57 2.214 -7.465 0.854 512 H SER 58 H SER 58 -3.106 -4.381 -1.356 513 HA SER 58 HA SER 58 -5.496 -5.973 -0.895 514 HB2 SER 58 2HB SER 58 -6.077 -3.803 0.220 515 HB3 SER 58 3HB SER 58 -5.719 -2.939 -1.274 516 HG SER 58 HG SER 58 -7.806 -4.778 -0.759 517 H ASN 59 H ASN 59 -5.961 -6.917 -2.799 518 HA ASN 59 HA ASN 59 -4.668 -6.013 -5.261 519 HB2 ASN 59 2HB ASN 59 -5.591 -8.086 -6.286 520 HB3 ASN 59 3HB ASN 59 -4.670 -8.424 -4.826 521 HD21 ASN 59 1HD2 ASN 59 -5.652 -10.414 -4.559 522 HD22 ASN 59 2HD2 ASN 59 -7.290 -10.584 -4.032 523 H ASP 60 H ASP 60 -7.455 -5.248 -3.662 524 HA ASP 60 HA ASP 60 -9.061 -4.655 -6.070 525 HB2 ASP 60 2HB ASP 60 -10.113 -6.178 -4.389 526 HB3 ASP 60 3HB ASP 60 -9.931 -4.939 -3.153 527 H LYS 61 H LYS 61 -8.954 -2.568 -6.651 528 HA LYS 61 HA LYS 61 -7.658 -0.611 -5.008 529 HB2 LYS 61 2HB LYS 61 -7.901 0.918 -6.902 530 HB3 LYS 61 3HB LYS 61 -7.298 -0.650 -7.430 531 HG2 LYS 61 2HG LYS 61 -9.484 -1.256 -8.310 532 HG3 LYS 61 3HG LYS 61 -10.192 0.233 -7.673 533 HD2 LYS 61 2HD LYS 61 -8.771 1.574 -9.181 534 HD3 LYS 61 3HD LYS 61 -8.008 0.104 -9.796 535 HE2 LYS 61 2HE LYS 61 -10.160 -0.639 -10.722 536 HE3 LYS 61 3HE LYS 61 -10.954 0.798 -10.071 537 HZ1 LYS 61 3HZ LYS 61 -9.628 2.172 -11.506 538 HZ2 LYS 61 1HZ LYS 61 -10.391 0.987 -12.437 539 HZ3 LYS 61 2HZ LYS 61 -8.752 0.841 -12.063 540 H GLN 62 H GLN 62 -11.027 -1.428 -5.487 541 HA GLN 62 HA GLN 62 -12.205 1.083 -4.804 542 HB2 GLN 62 2HB GLN 62 -13.547 -0.669 -5.878 543 HB3 GLN 62 3HB GLN 62 -13.310 -1.750 -4.510 544 HG2 GLN 62 2HG GLN 62 -14.604 -0.189 -3.075 545 HG3 GLN 62 3HG GLN 62 -14.851 0.864 -4.469 546 HE21 GLN 62 1HE2 GLN 62 -16.270 0.184 -6.128 547 HE22 GLN 62 2HE2 GLN 62 -17.413 -1.089 -5.885 548 H LEU 63 H LEU 63 -11.280 -1.761 -2.920 549 HA LEU 63 HA LEU 63 -12.002 -0.804 -0.337 550 HB2 LEU 63 2HB LEU 63 -9.990 -2.921 -1.199 551 HB3 LEU 63 3HB LEU 63 -10.481 -2.651 0.471 552 HG LEU 63 HG LEU 63 -12.340 -3.540 -1.770 553 HD11 LEU 63 1HD1 LEU 63 -11.159 -5.163 0.503 554 HD12 LEU 63 2HD1 LEU 63 -10.729 -5.287 -1.206 555 HD13 LEU 63 3HD1 LEU 63 -12.349 -5.727 -0.675 556 HD21 LEU 63 3HD2 LEU 63 -12.872 -3.257 1.207 557 HD22 LEU 63 1HD2 LEU 63 -13.984 -3.940 0.017 558 HD23 LEU 63 2HD2 LEU 63 -13.533 -2.240 -0.078 559 H LEU 64 H LEU 64 -9.078 -0.595 -2.298 560 HA LEU 64 HA LEU 64 -7.360 0.569 -0.396 561 HB2 LEU 64 2HB LEU 64 -6.482 -0.329 -2.424 562 HB3 LEU 64 3HB LEU 64 -7.481 0.699 -3.422 563 HG LEU 64 HG LEU 64 -5.481 2.113 -1.663 564 HD11 LEU 64 1HD1 LEU 64 -3.641 1.736 -3.232 565 HD12 LEU 64 2HD1 LEU 64 -4.619 0.571 -4.124 566 HD13 LEU 64 3HD1 LEU 64 -4.142 0.235 -2.458 567 HD21 LEU 64 3HD2 LEU 64 -6.316 2.509 -4.564 568 HD22 LEU 64 1HD2 LEU 64 -5.232 3.560 -3.643 569 HD23 LEU 64 2HD2 LEU 64 -6.924 3.412 -3.174 570 H LYS 65 H LYS 65 -9.743 2.032 -2.594 571 HA LYS 65 HA LYS 65 -9.205 4.765 -2.029 572 HB2 LYS 65 2HB LYS 65 -11.730 3.379 -3.027 573 HB3 LYS 65 3HB LYS 65 -11.532 5.129 -2.983 574 HG2 LYS 65 2HG LYS 65 -9.912 5.121 -4.698 575 HG3 LYS 65 3HG LYS 65 -9.554 3.408 -4.482 576 HD2 LYS 65 2HD LYS 65 -10.793 3.710 -6.553 577 HD3 LYS 65 3HD LYS 65 -11.795 2.833 -5.399 578 HE2 LYS 65 2HE LYS 65 -13.018 4.929 -4.894 579 HE3 LYS 65 3HE LYS 65 -12.017 5.788 -6.070 580 HZ1 LYS 65 3HZ LYS 65 -13.886 3.550 -6.659 581 HZ2 LYS 65 1HZ LYS 65 -12.882 4.297 -7.793 582 HZ3 LYS 65 2HZ LYS 65 -14.117 5.176 -7.051 583 H GLU 66 H GLU 66 -11.705 2.533 -0.760 584 HA GLU 66 HA GLU 66 -12.895 4.119 1.193 585 HB2 GLU 66 2HB GLU 66 -12.345 1.117 1.214 586 HB3 GLU 66 3HB GLU 66 -13.407 1.918 2.367 587 HG2 GLU 66 2HG GLU 66 -13.838 1.904 -0.633 588 HG3 GLU 66 3HG GLU 66 -14.581 0.760 0.482 589 H MET 67 H MET 67 -10.025 2.069 1.398 590 HA MET 67 HA MET 67 -9.365 2.191 4.094 591 HB2 MET 67 2HB MET 67 -8.316 0.702 2.304 592 HB3 MET 67 3HB MET 67 -7.394 2.090 1.756 593 HG2 MET 67 2HG MET 67 -5.894 0.870 3.082 594 HG3 MET 67 3HG MET 67 -6.430 2.171 4.143 595 HE1 MET 67 3HE MET 67 -8.355 -1.199 3.160 596 HE2 MET 67 1HE MET 67 -7.835 -2.231 4.492 597 HE3 MET 67 2HE MET 67 -6.659 -1.663 3.306 598 H LEU 68 H LEU 68 -8.271 4.263 1.401 599 HA LEU 68 HA LEU 68 -6.549 5.946 2.903 600 HB2 LEU 68 2HB LEU 68 -7.893 6.435 0.220 601 HB3 LEU 68 3HB LEU 68 -6.584 7.410 0.871 602 HG LEU 68 HG LEU 68 -6.329 4.450 0.205 603 HD11 LEU 68 1HD1 LEU 68 -5.096 5.148 -1.796 604 HD12 LEU 68 2HD1 LEU 68 -5.471 6.836 -1.442 605 HD13 LEU 68 3HD1 LEU 68 -6.769 5.704 -1.826 606 HD21 LEU 68 3HD2 LEU 68 -4.174 6.492 0.848 607 HD22 LEU 68 1HD2 LEU 68 -3.906 4.814 0.365 608 HD23 LEU 68 2HD2 LEU 68 -4.704 5.172 1.894 609 H GLU 69 H GLU 69 -9.969 6.229 2.007 610 HA GLU 69 HA GLU 69 -10.430 8.899 2.859 611 HB2 GLU 69 2HB GLU 69 -12.328 6.525 2.587 612 HB3 GLU 69 3HB GLU 69 -12.868 8.171 2.920 613 HG2 GLU 69 2HG GLU 69 -11.917 8.940 0.796 614 HG3 GLU 69 3HG GLU 69 -11.300 7.323 0.468 615 H LEU 70 H LEU 70 -10.653 5.801 4.528 616 HA LEU 70 HA LEU 70 -11.469 6.779 7.082 617 HB2 LEU 70 2HB LEU 70 -10.056 4.214 6.260 618 HB3 LEU 70 3HB LEU 70 -10.712 4.497 7.867 619 HG LEU 70 HG LEU 70 -12.434 4.527 5.351 620 HD11 LEU 70 1HD1 LEU 70 -11.415 2.314 5.577 621 HD12 LEU 70 2HD1 LEU 70 -13.144 2.253 5.913 622 HD13 LEU 70 3HD1 LEU 70 -11.984 2.202 7.245 623 HD21 LEU 70 3HD2 LEU 70 -14.312 4.276 6.895 624 HD22 LEU 70 1HD2 LEU 70 -13.384 5.722 7.295 625 HD23 LEU 70 2HD2 LEU 70 -13.211 4.261 8.277 626 H ILE 71 H ILE 71 -8.313 6.221 5.584 627 HA ILE 71 HA ILE 71 -6.617 6.563 7.825 628 HB ILE 71 HB ILE 71 -6.122 6.961 4.838 629 HG12 ILE 71 2HG1 ILE 71 -5.045 4.812 6.725 630 HG13 ILE 71 3HG1 ILE 71 -6.487 4.617 5.743 631 HG21 ILE 71 1HG2 ILE 71 -4.586 8.483 6.007 632 HG22 ILE 71 2HG2 ILE 71 -3.702 7.138 5.292 633 HG23 ILE 71 3HG2 ILE 71 -4.021 7.159 7.028 634 HD11 ILE 71 3HD1 ILE 71 -4.632 3.494 4.725 635 HD12 ILE 71 1HD1 ILE 71 -3.675 4.975 4.730 636 HD13 ILE 71 2HD1 ILE 71 -5.112 4.857 3.715 637 H SER 72 H SER 72 -7.965 8.902 5.486 638 HA SER 72 HA SER 72 -6.419 11.157 6.198 639 HB2 SER 72 2HB SER 72 -9.223 11.078 5.007 640 HB3 SER 72 3HB SER 72 -8.109 12.449 4.950 641 HG SER 72 HG SER 72 -6.972 10.159 4.016 642 H LYS 73 H LYS 73 -9.309 9.770 7.601 643 HA LYS 73 HA LYS 73 -10.020 11.963 9.298 644 HB2 LYS 73 2HB LYS 73 -10.716 8.997 9.496 645 HB3 LYS 73 3HB LYS 73 -11.505 10.282 10.410 646 HG2 LYS 73 2HG LYS 73 -11.572 9.888 7.401 647 HG3 LYS 73 3HG LYS 73 -12.895 9.589 8.526 648 HD2 LYS 73 2HD LYS 73 -11.658 12.314 7.950 649 HD3 LYS 73 3HD LYS 73 -13.161 11.707 7.255 650 HE2 LYS 73 2HE LYS 73 -14.228 11.679 9.426 651 HE3 LYS 73 3HE LYS 73 -12.709 12.082 10.230 652 HZ1 LYS 73 3HZ LYS 73 -14.132 14.018 10.003 653 HZ2 LYS 73 1HZ LYS 73 -14.166 13.835 8.322 654 HZ3 LYS 73 2HZ LYS 73 -12.720 14.219 9.106 655 H LEU 74 H LEU 74 -7.997 9.086 9.665 656 HA LEU 74 HA LEU 74 -7.710 9.358 12.553 657 HB2 LEU 74 2HB LEU 74 -6.436 7.381 10.621 658 HB3 LEU 74 3HB LEU 74 -6.390 7.265 12.375 659 HG LEU 74 HG LEU 74 -8.897 7.057 10.655 660 HD11 LEU 74 1HD1 LEU 74 -7.447 5.094 10.414 661 HD12 LEU 74 2HD1 LEU 74 -8.931 4.691 11.268 662 HD13 LEU 74 3HD1 LEU 74 -7.423 4.876 12.167 663 HD21 LEU 74 3HD2 LEU 74 -9.438 8.050 12.817 664 HD22 LEU 74 1HD2 LEU 74 -8.597 6.746 13.662 665 HD23 LEU 74 2HD2 LEU 74 -10.061 6.405 12.734 666 H GLY 75 H GLY 75 -5.744 9.944 9.702 667 HA2 GLY 75 2HA GLY 75 -3.861 11.210 9.377 668 HA3 GLY 75 3HA GLY 75 -3.829 11.569 11.095 669 H TYR 76 H TYR 76 -2.941 9.174 8.644 670 HA TYR 76 HA TYR 76 -0.679 8.265 10.346 671 HB2 TYR 76 2HB TYR 76 -2.382 6.569 8.461 672 HB3 TYR 76 3HB TYR 76 -0.884 6.015 9.200 673 HD1 TYR 76 HD1 TYR 76 -1.031 6.825 11.957 674 HD2 TYR 76 HD2 TYR 76 -4.187 5.387 9.461 675 HE1 TYR 76 HE1 TYR 76 -2.234 6.037 13.938 676 HE2 TYR 76 HE2 TYR 76 -5.391 4.601 11.460 677 HH TYR 76 HH TYR 76 -4.937 3.993 13.775 678 H LYS 77 H LYS 77 1.288 7.956 9.307 679 HA LYS 77 HA LYS 77 1.731 9.316 6.803 680 HB2 LYS 77 2HB LYS 77 3.564 7.861 8.743 681 HB3 LYS 77 3HB LYS 77 4.158 8.444 7.191 682 HG2 LYS 77 2HG LYS 77 2.929 10.172 9.370 683 HG3 LYS 77 3HG LYS 77 4.653 10.027 9.019 684 HD2 LYS 77 2HD LYS 77 2.542 11.139 7.118 685 HD3 LYS 77 3HD LYS 77 3.686 12.095 8.048 686 HE2 LYS 77 2HE LYS 77 4.502 10.070 5.939 687 HE3 LYS 77 3HE LYS 77 4.336 11.802 5.646 688 HZ1 LYS 77 3HZ LYS 77 6.113 12.280 7.061 689 HZ2 LYS 77 1HZ LYS 77 6.632 10.966 6.138 690 HZ3 LYS 77 2HZ LYS 77 6.137 10.732 7.739 691 H VAL 78 H VAL 78 0.801 8.296 5.142 692 HA VAL 78 HA VAL 78 1.252 5.416 4.707 693 HB VAL 78 HB VAL 78 -0.926 7.243 3.589 694 HG11 VAL 78 1HG1 VAL 78 -1.985 5.189 2.705 695 HG12 VAL 78 2HG1 VAL 78 -0.594 4.235 3.232 696 HG13 VAL 78 3HG1 VAL 78 -0.401 5.455 1.970 697 HG21 VAL 78 3HG2 VAL 78 -1.167 6.785 5.988 698 HG22 VAL 78 1HG2 VAL 78 -1.056 5.053 5.683 699 HG23 VAL 78 2HG2 VAL 78 -2.426 5.966 5.065 700 H PHE 79 H PHE 79 2.507 4.794 3.148 701 HA PHE 79 HA PHE 79 3.199 6.576 0.877 702 HB2 PHE 79 2HB PHE 79 4.791 4.289 2.148 703 HB3 PHE 79 3HB PHE 79 5.302 5.238 0.760 704 HD1 PHE 79 HD2 PHE 79 4.855 5.256 4.430 705 HD2 PHE 79 HD1 PHE 79 6.132 7.537 1.040 706 HE1 PHE 79 HE2 PHE 79 5.945 6.872 5.922 707 HE2 PHE 79 HE1 PHE 79 7.213 9.152 2.547 708 HZ PHE 79 HZ PHE 79 7.120 8.819 4.983 709 H LEU 80 H LEU 80 2.142 5.910 -0.901 710 HA LEU 80 HA LEU 80 1.050 3.174 -1.005 711 HB2 LEU 80 2HB LEU 80 -0.641 4.918 -1.063 712 HB3 LEU 80 3HB LEU 80 0.172 5.741 -2.383 713 HG LEU 80 HG LEU 80 -0.402 3.910 -3.932 714 HD11 LEU 80 1HD1 LEU 80 -1.815 2.563 -1.618 715 HD12 LEU 80 2HD1 LEU 80 -0.338 2.003 -2.405 716 HD13 LEU 80 3HD1 LEU 80 -1.847 2.050 -3.308 717 HD21 LEU 80 3HD2 LEU 80 -2.843 4.210 -4.023 718 HD22 LEU 80 1HD2 LEU 80 -2.007 5.731 -3.708 719 HD23 LEU 80 2HD2 LEU 80 -2.826 4.888 -2.390 720 H LEU 81 H LEU 81 1.632 1.791 -2.522 721 HA LEU 81 HA LEU 81 3.001 2.709 -4.973 722 HB2 LEU 81 2HB LEU 81 4.468 1.308 -3.493 723 HB3 LEU 81 3HB LEU 81 3.292 0.006 -3.577 724 HG LEU 81 HG LEU 81 3.685 -0.260 -5.988 725 HD11 LEU 81 1HD1 LEU 81 5.465 1.026 -7.148 726 HD12 LEU 81 2HD1 LEU 81 5.596 2.079 -5.738 727 HD13 LEU 81 3HD1 LEU 81 4.092 2.018 -6.661 728 HD21 LEU 81 3HD2 LEU 81 6.323 -0.189 -4.477 729 HD22 LEU 81 1HD2 LEU 81 5.987 -1.098 -5.956 730 HD23 LEU 81 2HD2 LEU 81 5.156 -1.514 -4.459 731 H LEU 82 H LEU 82 1.515 2.683 -6.538 732 HA LEU 82 HA LEU 82 -0.488 0.531 -6.688 733 HB2 LEU 82 2HB LEU 82 -0.112 3.088 -8.309 734 HB3 LEU 82 3HB LEU 82 -1.354 1.892 -8.646 735 HG LEU 82 HG LEU 82 -1.155 3.535 -6.088 736 HD11 LEU 82 1HD1 LEU 82 -1.773 4.921 -8.014 737 HD12 LEU 82 2HD1 LEU 82 -3.119 4.744 -6.894 738 HD13 LEU 82 3HD1 LEU 82 -3.101 3.822 -8.401 739 HD21 LEU 82 3HD2 LEU 82 -2.179 1.351 -5.667 740 HD22 LEU 82 1HD2 LEU 82 -3.328 1.610 -6.984 741 HD23 LEU 82 2HD2 LEU 82 -3.376 2.636 -5.546 742 H GLN 83 H GLN 83 0.153 -1.260 -7.720 743 HA GLN 83 HA GLN 83 2.154 -1.142 -9.892 744 HB2 GLN 83 2HB GLN 83 2.611 -2.752 -7.998 745 HB3 GLN 83 3HB GLN 83 1.118 -3.600 -8.389 746 HG2 GLN 83 2HG GLN 83 2.045 -4.053 -10.680 747 HG3 GLN 83 3HG GLN 83 3.569 -3.329 -10.168 748 HE21 GLN 83 1HE2 GLN 83 3.061 -6.012 -11.116 749 HE22 GLN 83 2HE2 GLN 83 3.566 -7.086 -9.865 750 H ASP 84 H ASP 84 1.348 -1.178 -11.876 751 HA ASP 84 HA ASP 84 -0.770 -3.009 -12.634 752 HB2 ASP 84 2HB ASP 84 -1.925 -0.840 -11.917 753 HB3 ASP 84 3HB ASP 84 -1.088 -0.030 -13.231 754 H GLN 85 H GLN 85 -0.440 -3.694 -14.717 755 HA GLN 85 HA GLN 85 2.184 -3.221 -15.767 756 HB2 GLN 85 2HB GLN 85 0.967 -5.453 -15.652 757 HB3 GLN 85 3HB GLN 85 -0.037 -4.913 -16.991 758 HG2 GLN 85 2HG GLN 85 1.910 -4.804 -18.455 759 HG3 GLN 85 3HG GLN 85 2.984 -5.180 -17.105 760 HE21 GLN 85 1HE2 GLN 85 3.818 -7.049 -18.022 761 HE22 GLN 85 2HE2 GLN 85 2.890 -8.488 -18.261 762 H ASP 86 H ASP 86 -0.885 -1.863 -16.404 763 HA ASP 86 HA ASP 86 -0.070 -0.681 -18.995 764 HB2 ASP 86 2HB ASP 86 -2.240 -1.895 -18.999 765 HB3 ASP 86 3HB ASP 86 -2.831 -0.881 -17.690 766 H GLU 87 H GLU 87 0.979 1.179 -18.598 767 HA GLU 87 HA GLU 87 0.924 2.646 -16.202 768 HB2 GLU 87 2HB GLU 87 1.899 3.499 -18.951 769 HB3 GLU 87 3HB GLU 87 2.177 4.418 -17.474 770 HG2 GLU 87 2HG GLU 87 3.452 2.477 -16.556 771 HG3 GLU 87 3HG GLU 87 3.250 1.657 -18.107 772 H ASN 88 H ASN 88 -1.208 2.833 -18.906 773 HA ASN 88 HA ASN 88 -1.796 5.625 -18.850 774 HB2 ASN 88 2HB ASN 88 -3.557 3.385 -19.955 775 HB3 ASN 88 3HB ASN 88 -3.641 5.092 -20.367 776 HD21 ASN 88 1HD2 ASN 88 -1.881 2.121 -20.819 777 HD22 ASN 88 2HD2 ASN 88 -0.923 2.657 -22.155 778 H GLU 89 H GLU 89 -3.761 2.806 -17.800 779 HA GLU 89 HA GLU 89 -5.698 4.408 -16.374 780 HB2 GLU 89 2HB GLU 89 -6.622 2.205 -15.632 781 HB3 GLU 89 3HB GLU 89 -6.394 2.296 -17.376 782 HG2 GLU 89 2HG GLU 89 -4.217 1.058 -17.077 783 HG3 GLU 89 3HG GLU 89 -4.646 0.837 -15.380 784 H LEU 90 H LEU 90 -2.746 2.737 -15.560 785 HA LEU 90 HA LEU 90 -2.815 2.771 -12.761 786 HB2 LEU 90 2HB LEU 90 -1.101 1.575 -14.020 787 HB3 LEU 90 3HB LEU 90 -0.503 3.066 -14.714 788 HG LEU 90 HG LEU 90 0.384 3.774 -12.523 789 HD11 LEU 90 1HD1 LEU 90 0.363 2.276 -10.584 790 HD12 LEU 90 2HD1 LEU 90 -0.694 1.158 -11.447 791 HD13 LEU 90 3HD1 LEU 90 -1.262 2.779 -11.042 792 HD21 LEU 90 3HD2 LEU 90 1.862 2.467 -13.971 793 HD22 LEU 90 1HD2 LEU 90 1.257 0.960 -13.274 794 HD23 LEU 90 2HD2 LEU 90 2.176 2.092 -12.278 795 H GLU 91 H GLU 91 -1.592 5.236 -15.049 796 HA GLU 91 HA GLU 91 -0.580 6.993 -13.028 797 HB2 GLU 91 2HB GLU 91 0.411 6.840 -15.289 798 HB3 GLU 91 3HB GLU 91 -1.073 7.467 -16.000 799 HG2 GLU 91 2HG GLU 91 -0.738 9.623 -14.934 800 HG3 GLU 91 3HG GLU 91 0.667 9.014 -14.052 801 H GLU 92 H GLU 92 -3.453 7.014 -15.139 802 HA GLU 92 HA GLU 92 -4.668 9.390 -14.393 803 HB2 GLU 92 2HB GLU 92 -5.967 6.718 -15.065 804 HB3 GLU 92 3HB GLU 92 -6.859 8.236 -14.948 805 HG2 GLU 92 2HG GLU 92 -5.549 9.180 -16.781 806 HG3 GLU 92 3HG GLU 92 -4.593 7.702 -16.891 807 H PHE 93 H PHE 93 -4.843 6.249 -12.745 808 HA PHE 93 HA PHE 93 -6.650 7.133 -10.677 809 HB2 PHE 93 2HB PHE 93 -6.477 4.774 -11.546 810 HB3 PHE 93 3HB PHE 93 -4.898 4.635 -10.786 811 HD1 PHE 93 HD1 PHE 93 -8.311 5.843 -9.709 812 HD2 PHE 93 HD2 PHE 93 -4.975 3.301 -8.860 813 HE1 PHE 93 HE1 PHE 93 -9.432 5.038 -7.674 814 HE2 PHE 93 HE2 PHE 93 -6.102 2.508 -6.825 815 HZ PHE 93 HZ PHE 93 -8.329 3.372 -6.232 816 H LYS 94 H LYS 94 -3.194 6.809 -11.063 817 HA LYS 94 HA LYS 94 -2.275 6.883 -8.402 818 HB2 LYS 94 2HB LYS 94 -0.965 6.116 -10.390 819 HB3 LYS 94 3HB LYS 94 -0.877 7.760 -10.983 820 HG2 LYS 94 2HG LYS 94 0.327 6.984 -8.317 821 HG3 LYS 94 3HG LYS 94 1.196 6.698 -9.816 822 HD2 LYS 94 2HD LYS 94 0.318 9.402 -8.726 823 HD3 LYS 94 3HD LYS 94 1.962 8.761 -8.751 824 HE2 LYS 94 2HE LYS 94 1.859 8.729 -11.253 825 HE3 LYS 94 3HE LYS 94 0.274 9.504 -11.165 826 HZ1 LYS 94 3HZ LYS 94 2.802 10.642 -10.089 827 HZ2 LYS 94 1HZ LYS 94 1.297 11.401 -10.074 828 HZ3 LYS 94 2HZ LYS 94 2.077 11.100 -11.543 829 H ARG 95 H ARG 95 -2.625 9.439 -10.833 830 HA ARG 95 HA ARG 95 -1.547 11.562 -9.308 831 HB2 ARG 95 2HB ARG 95 -2.475 13.036 -11.087 832 HB3 ARG 95 3HB ARG 95 -1.579 11.667 -11.732 833 HG2 ARG 95 2HG ARG 95 -3.706 10.505 -12.221 834 HG3 ARG 95 3HG ARG 95 -4.604 11.883 -11.584 835 HD2 ARG 95 2HD ARG 95 -2.711 12.023 -13.961 836 HD3 ARG 95 3HD ARG 95 -4.462 11.818 -14.085 837 HE ARG 95 HE ARG 95 -4.190 14.047 -12.554 838 HH11 ARG 95 1HH1 ARG 95 -2.976 13.189 -15.751 839 HH12 ARG 95 2HH1 ARG 95 -2.965 14.836 -16.312 840 HH21 ARG 95 1HH2 ARG 95 -4.183 16.158 -13.281 841 HH22 ARG 95 2HH2 ARG 95 -3.657 16.535 -14.898 842 H LYS 96 H LYS 96 -4.813 10.295 -9.542 843 HA LYS 96 HA LYS 96 -6.240 12.455 -8.369 844 HB2 LYS 96 2HB LYS 96 -6.889 9.468 -8.330 845 HB3 LYS 96 3HB LYS 96 -8.027 10.759 -7.945 846 HG2 LYS 96 2HG LYS 96 -7.861 11.602 -10.264 847 HG3 LYS 96 3HG LYS 96 -6.703 10.326 -10.641 848 HD2 LYS 96 2HD LYS 96 -8.521 8.637 -10.050 849 HD3 LYS 96 3HD LYS 96 -9.648 9.993 -9.942 850 HE2 LYS 96 2HE LYS 96 -8.084 9.161 -12.410 851 HE3 LYS 96 3HE LYS 96 -9.796 8.872 -12.125 852 HZ1 LYS 96 3HZ LYS 96 -9.323 10.765 -13.598 853 HZ2 LYS 96 1HZ LYS 96 -8.573 11.561 -12.311 854 HZ3 LYS 96 2HZ LYS 96 -10.218 11.201 -12.235 855 H ILE 97 H ILE 97 -4.832 9.498 -7.014 856 HA ILE 97 HA ILE 97 -5.494 10.035 -4.278 857 HB ILE 97 HB ILE 97 -3.472 8.073 -5.452 858 HG12 ILE 97 2HG1 ILE 97 -6.375 7.580 -4.608 859 HG13 ILE 97 3HG1 ILE 97 -5.845 7.768 -6.277 860 HG21 ILE 97 1HG2 ILE 97 -4.734 8.184 -2.688 861 HG22 ILE 97 2HG2 ILE 97 -3.039 8.478 -3.077 862 HG23 ILE 97 3HG2 ILE 97 -3.725 6.871 -3.289 863 HD11 ILE 97 3HD1 ILE 97 -6.170 5.447 -5.718 864 HD12 ILE 97 1HD1 ILE 97 -5.012 5.570 -4.394 865 HD13 ILE 97 2HD1 ILE 97 -4.471 5.761 -6.066 866 H GLU 98 H GLU 98 -2.748 10.655 -6.331 867 HA GLU 98 HA GLU 98 -0.840 11.471 -4.379 868 HB2 GLU 98 2HB GLU 98 -0.258 10.727 -6.667 869 HB3 GLU 98 3HB GLU 98 -1.104 12.107 -7.354 870 HG2 GLU 98 2HG GLU 98 0.555 13.622 -6.346 871 HG3 GLU 98 3HG GLU 98 1.392 12.236 -5.636 872 H SER 99 H SER 99 -3.500 13.046 -6.069 873 HA SER 99 HA SER 99 -2.871 15.762 -5.291 874 HB2 SER 99 2HB SER 99 -4.115 15.220 -7.398 875 HB3 SER 99 3HB SER 99 -5.459 14.608 -6.437 876 HG SER 99 HG SER 99 -4.461 17.246 -6.141 877 H GLN 100 H GLN 100 -4.647 13.081 -3.929 878 HA GLN 100 HA GLN 100 -6.187 14.472 -1.966 879 HB2 GLN 100 2HB GLN 100 -5.100 11.623 -1.967 880 HB3 GLN 100 3HB GLN 100 -6.261 12.235 -0.795 881 HG2 GLN 100 2HG GLN 100 -7.940 12.522 -2.529 882 HG3 GLN 100 3HG GLN 100 -6.771 12.092 -3.780 883 HE21 GLN 100 1HE2 GLN 100 -8.064 10.368 -4.505 884 HE22 GLN 100 2HE2 GLN 100 -8.227 8.891 -3.617 885 H GLY 101 H GLY 101 -2.830 13.526 -2.167 886 HA2 GLY 101 2HA GLY 101 -1.196 14.756 -0.839 887 HA3 GLY 101 3HA GLY 101 -2.283 14.644 0.541 888 H TYR 102 H TYR 102 -1.493 12.055 -1.735 889 HA TYR 102 HA TYR 102 -0.058 10.572 0.407 890 HB2 TYR 102 2HB TYR 102 -1.800 9.501 -1.864 891 HB3 TYR 102 3HB TYR 102 -0.782 8.477 -0.853 892 HD1 TYR 102 HD1 TYR 102 -1.254 8.331 1.633 893 HD2 TYR 102 HD2 TYR 102 -3.964 10.233 -1.070 894 HE1 TYR 102 HE1 TYR 102 -3.028 8.218 3.328 895 HE2 TYR 102 HE2 TYR 102 -5.738 10.112 0.630 896 HH TYR 102 HH TYR 102 -6.284 8.816 2.631 897 H GLU 103 H GLU 103 1.954 9.873 -0.027 898 HA GLU 103 HA GLU 103 3.282 10.549 -2.487 899 HB2 GLU 103 2HB GLU 103 4.557 10.629 -0.402 900 HB3 GLU 103 3HB GLU 103 4.201 8.941 -0.056 901 HG2 GLU 103 2HG GLU 103 6.538 9.381 -0.875 902 HG3 GLU 103 3HG GLU 103 5.648 8.184 -1.815 903 H VAL 104 H VAL 104 2.416 9.464 -4.197 904 HA VAL 104 HA VAL 104 2.164 6.514 -4.075 905 HB VAL 104 HB VAL 104 0.716 8.302 -6.087 906 HG11 VAL 104 1HG1 VAL 104 -0.742 6.338 -6.373 907 HG12 VAL 104 2HG1 VAL 104 0.186 5.450 -5.160 908 HG13 VAL 104 3HG1 VAL 104 0.946 5.922 -6.683 909 HG21 VAL 104 3HG2 VAL 104 -0.027 9.008 -3.855 910 HG22 VAL 104 1HG2 VAL 104 -0.404 7.336 -3.428 911 HG23 VAL 104 2HG2 VAL 104 -1.316 8.152 -4.702 912 H ARG 105 H ARG 105 3.603 5.436 -5.282 913 HA ARG 105 HA ARG 105 4.853 6.711 -7.651 914 HB2 ARG 105 2HB ARG 105 5.895 4.936 -5.555 915 HB3 ARG 105 3HB ARG 105 6.144 4.206 -7.124 916 HG2 ARG 105 2HG ARG 105 8.107 5.448 -6.447 917 HG3 ARG 105 3HG ARG 105 7.389 6.192 -7.874 918 HD2 ARG 105 2HD ARG 105 6.430 7.975 -6.490 919 HD3 ARG 105 3HD ARG 105 7.037 7.193 -5.023 920 HE ARG 105 HE ARG 105 9.304 7.523 -6.411 921 HH11 ARG 105 1HH1 ARG 105 6.752 9.865 -5.732 922 HH12 ARG 105 2HH1 ARG 105 7.842 11.215 -5.770 923 HH21 ARG 105 1HH2 ARG 105 10.706 9.319 -6.382 924 HH22 ARG 105 2HH2 ARG 105 10.058 10.913 -6.132 925 H LYS 106 H LYS 106 4.981 5.540 -9.583 926 HA LYS 106 HA LYS 106 2.936 3.498 -10.122 927 HB2 LYS 106 2HB LYS 106 4.842 5.048 -11.940 928 HB3 LYS 106 3HB LYS 106 3.674 3.864 -12.517 929 HG2 LYS 106 2HG LYS 106 1.819 5.282 -11.881 930 HG3 LYS 106 3HG LYS 106 2.905 6.406 -11.052 931 HD2 LYS 106 2HD LYS 106 2.195 7.256 -13.288 932 HD3 LYS 106 3HD LYS 106 3.942 7.058 -13.161 933 HE2 LYS 106 2HE LYS 106 3.618 4.789 -14.326 934 HE3 LYS 106 3HE LYS 106 1.971 5.318 -14.672 935 HZ1 LYS 106 3HZ LYS 106 4.419 6.801 -15.479 936 HZ2 LYS 106 1HZ LYS 106 2.829 7.174 -15.914 937 HZ3 LYS 106 2HZ LYS 106 3.557 5.760 -16.495 938 H VAL 107 H VAL 107 3.524 1.487 -11.102 939 HA VAL 107 HA VAL 107 6.219 0.871 -11.849 940 HB VAL 107 HB VAL 107 6.503 0.483 -9.455 941 HG11 VAL 107 1HG1 VAL 107 4.220 -1.504 -9.587 942 HG12 VAL 107 2HG1 VAL 107 4.179 0.073 -8.798 943 HG13 VAL 107 3HG1 VAL 107 5.250 -1.190 -8.187 944 HG21 VAL 107 3HG2 VAL 107 7.682 -1.011 -11.008 945 HG22 VAL 107 1HG2 VAL 107 6.356 -2.170 -10.923 946 HG23 VAL 107 2HG2 VAL 107 7.322 -1.815 -9.490 947 H THR 108 H THR 108 6.331 -0.821 -13.258 948 HA THR 108 HA THR 108 3.837 -2.285 -13.936 949 HB THR 108 HB THR 108 4.992 -2.632 -16.210 950 HG1 THR 108 HG1 THR 108 6.892 -1.734 -16.548 951 HG21 THR 108 3HG2 THR 108 3.211 -0.922 -15.956 952 HG22 THR 108 1HG2 THR 108 4.461 -0.385 -17.081 953 HG23 THR 108 2HG2 THR 108 4.420 0.257 -15.437 954 H ASP 109 H ASP 109 7.393 -2.604 -13.507 955 HA ASP 109 HA ASP 109 7.408 -5.437 -14.176 956 HB2 ASP 109 2HB ASP 109 9.598 -3.539 -13.232 957 HB3 ASP 109 3HB ASP 109 9.888 -5.238 -13.591 958 H ASP 110 H ASP 110 8.052 -7.140 -12.763 959 HA ASP 110 HA ASP 110 6.862 -6.965 -10.148 960 HB2 ASP 110 2HB ASP 110 7.198 -9.358 -9.968 961 HB3 ASP 110 3HB ASP 110 6.647 -9.012 -11.602 962 H GLU 111 H GLU 111 10.211 -7.262 -11.367 963 HA GLU 111 HA GLU 111 11.441 -7.490 -8.788 964 HB2 GLU 111 2HB GLU 111 13.561 -6.975 -9.915 965 HB3 GLU 111 3HB GLU 111 12.641 -8.140 -10.860 966 HG2 GLU 111 2HG GLU 111 12.000 -6.442 -12.461 967 HG3 GLU 111 3HG GLU 111 12.684 -5.168 -11.462 968 H GLU 112 H GLU 112 10.553 -4.815 -10.888 969 HA GLU 112 HA GLU 112 11.838 -2.696 -9.508 970 HB2 GLU 112 2HB GLU 112 11.148 -2.617 -11.889 971 HB3 GLU 112 3HB GLU 112 9.457 -2.669 -11.413 972 HG2 GLU 112 2HG GLU 112 9.711 -0.470 -10.312 973 HG3 GLU 112 3HG GLU 112 11.409 -0.430 -10.797 974 H ALA 113 H ALA 113 8.655 -4.212 -9.300 975 HA ALA 113 HA ALA 113 7.301 -2.444 -7.624 976 HB1 ALA 113 3HB ALA 113 7.097 -5.475 -7.690 977 HB2 ALA 113 1HB ALA 113 6.206 -4.352 -8.718 978 HB3 ALA 113 2HB ALA 113 5.908 -4.376 -6.979 979 H LEU 114 H LEU 114 9.293 -5.243 -6.799 980 HA LEU 114 HA LEU 114 9.160 -5.127 -3.988 981 HB2 LEU 114 2HB LEU 114 11.460 -6.163 -5.694 982 HB3 LEU 114 3HB LEU 114 11.121 -6.616 -4.031 983 HG LEU 114 HG LEU 114 9.353 -7.290 -6.416 984 HD11 LEU 114 1HD1 LEU 114 10.177 -9.588 -6.171 985 HD12 LEU 114 2HD1 LEU 114 11.278 -9.075 -4.891 986 HD13 LEU 114 3HD1 LEU 114 11.493 -8.474 -6.538 987 HD21 LEU 114 3HD2 LEU 114 8.163 -8.792 -4.875 988 HD22 LEU 114 1HD2 LEU 114 8.057 -7.113 -4.346 989 HD23 LEU 114 2HD2 LEU 114 9.161 -8.224 -3.534 990 H LYS 115 H LYS 115 11.275 -3.539 -6.315 991 HA LYS 115 HA LYS 115 13.163 -2.529 -4.390 992 HB2 LYS 115 2HB LYS 115 12.843 -2.086 -7.372 993 HB3 LYS 115 3HB LYS 115 14.089 -1.269 -6.425 994 HG2 LYS 115 2HG LYS 115 15.011 -3.460 -5.744 995 HG3 LYS 115 3HG LYS 115 13.780 -4.281 -6.705 996 HD2 LYS 115 2HD LYS 115 15.881 -2.386 -7.831 997 HD3 LYS 115 3HD LYS 115 16.021 -4.145 -7.822 998 HE2 LYS 115 2HE LYS 115 13.988 -4.299 -9.234 999 HE3 LYS 115 3HE LYS 115 13.889 -2.535 -9.264 1000 HZ1 LYS 115 3HZ LYS 115 16.186 -4.121 -10.281 1001 HZ2 LYS 115 1HZ LYS 115 16.001 -2.445 -10.388 1002 HZ3 LYS 115 2HZ LYS 115 14.964 -3.466 -11.248 1003 H ILE 116 H ILE 116 10.253 -1.229 -5.912 1004 HA ILE 116 HA ILE 116 10.742 1.454 -4.889 1005 HB ILE 116 HB ILE 116 8.161 0.334 -6.092 1006 HG12 ILE 116 2HG1 ILE 116 10.004 0.279 -7.759 1007 HG13 ILE 116 3HG1 ILE 116 8.803 1.482 -8.196 1008 HG21 ILE 116 1HG2 ILE 116 8.994 3.216 -5.571 1009 HG22 ILE 116 2HG2 ILE 116 7.742 2.314 -4.713 1010 HG23 ILE 116 3HG2 ILE 116 7.531 2.708 -6.418 1011 HD11 ILE 116 3HD1 ILE 116 10.292 3.261 -7.414 1012 HD12 ILE 116 1HD1 ILE 116 11.068 2.250 -8.633 1013 HD13 ILE 116 2HD1 ILE 116 11.492 2.057 -6.932 1014 H VAL 117 H VAL 117 9.028 -1.479 -3.872 1015 HA VAL 117 HA VAL 117 7.644 -0.506 -1.606 1016 HB VAL 117 HB VAL 117 8.977 -3.241 -1.999 1017 HG11 VAL 117 1HG1 VAL 117 7.519 -4.074 -0.176 1018 HG12 VAL 117 2HG1 VAL 117 6.948 -2.430 0.124 1019 HG13 VAL 117 3HG1 VAL 117 8.642 -2.841 0.400 1020 HG21 VAL 117 3HG2 VAL 117 7.202 -2.808 -3.643 1021 HG22 VAL 117 1HG2 VAL 117 6.065 -2.445 -2.349 1022 HG23 VAL 117 2HG2 VAL 117 6.719 -4.076 -2.520 1023 H ARG 118 H ARG 118 10.954 -1.811 -1.955 1024 HA ARG 118 HA ARG 118 11.699 -1.293 0.756 1025 HB2 ARG 118 2HB ARG 118 13.824 -2.201 0.240 1026 HB3 ARG 118 3HB ARG 118 12.672 -3.112 -0.723 1027 HG2 ARG 118 2HG ARG 118 13.329 -1.478 -2.642 1028 HG3 ARG 118 3HG ARG 118 14.718 -1.088 -1.627 1029 HD2 ARG 118 2HD ARG 118 13.981 -3.810 -2.764 1030 HD3 ARG 118 3HD ARG 118 15.344 -2.799 -3.236 1031 HE ARG 118 HE ARG 118 16.271 -3.200 -0.972 1032 HH11 ARG 118 1HH1 ARG 118 13.947 -5.503 -2.285 1033 HH12 ARG 118 2HH1 ARG 118 14.517 -6.824 -1.316 1034 HH21 ARG 118 1HH2 ARG 118 17.008 -4.937 0.303 1035 HH22 ARG 118 2HH2 ARG 118 16.259 -6.496 0.158 1036 H GLU 119 H GLU 119 11.691 0.688 -2.120 1037 HA GLU 119 HA GLU 119 13.369 2.774 -1.179 1038 HB2 GLU 119 2HB GLU 119 11.925 2.268 -3.534 1039 HB3 GLU 119 3HB GLU 119 11.053 3.634 -2.857 1040 HG2 GLU 119 2HG GLU 119 14.012 3.530 -3.488 1041 HG3 GLU 119 3HG GLU 119 12.779 4.315 -4.462 1042 H PHE 120 H PHE 120 9.822 2.223 -0.977 1043 HA PHE 120 HA PHE 120 9.180 4.418 0.667 1044 HB2 PHE 120 2HB PHE 120 7.767 1.753 0.266 1045 HB3 PHE 120 3HB PHE 120 7.099 3.032 1.276 1046 HD1 PHE 120 HD2 PHE 120 7.488 5.489 -0.133 1047 HD2 PHE 120 HD1 PHE 120 6.540 1.655 -1.770 1048 HE1 PHE 120 HE2 PHE 120 6.453 6.576 -2.078 1049 HE2 PHE 120 HE1 PHE 120 5.509 2.762 -3.714 1050 HZ PHE 120 HZ PHE 120 5.457 5.215 -3.862 1051 H MET 121 H MET 121 10.242 1.150 1.538 1052 HA MET 121 HA MET 121 10.001 1.481 4.359 1053 HB2 MET 121 2HB MET 121 11.760 -0.453 2.796 1054 HB3 MET 121 3HB MET 121 11.470 -0.527 4.530 1055 HG2 MET 121 2HG MET 121 8.980 -0.758 3.933 1056 HG3 MET 121 3HG MET 121 9.533 -1.082 2.288 1057 HE1 MET 121 3HE MET 121 11.244 -3.163 1.710 1058 HE2 MET 121 1HE MET 121 11.756 -4.338 2.921 1059 HE3 MET 121 2HE MET 121 12.351 -2.680 2.997 1060 H GLN 122 H GLN 122 12.576 2.215 2.057 1061 HA GLN 122 HA GLN 122 14.645 2.905 3.872 1062 HB2 GLN 122 2HB GLN 122 15.028 2.543 1.449 1063 HB3 GLN 122 3HB GLN 122 14.057 3.954 1.064 1064 HG2 GLN 122 2HG GLN 122 16.411 4.474 0.808 1065 HG3 GLN 122 3HG GLN 122 15.739 5.409 2.142 1066 HE21 GLN 122 1HE2 GLN 122 17.762 5.753 3.070 1067 HE22 GLN 122 2HE2 GLN 122 18.658 4.500 3.858 1068 H LYS 123 H LYS 123 11.951 4.751 2.482 1069 HA LYS 123 HA LYS 123 12.528 7.306 3.614 1070 HB2 LYS 123 2HB LYS 123 9.791 6.151 2.895 1071 HB3 LYS 123 3HB LYS 123 10.179 7.860 3.081 1072 HG2 LYS 123 2HG LYS 123 11.591 7.786 1.078 1073 HG3 LYS 123 3HG LYS 123 11.323 6.047 0.936 1074 HD2 LYS 123 2HD LYS 123 8.846 6.528 0.674 1075 HD3 LYS 123 3HD LYS 123 9.247 8.248 0.609 1076 HE2 LYS 123 2HE LYS 123 10.190 6.112 -1.335 1077 HE3 LYS 123 3HE LYS 123 8.946 7.325 -1.638 1078 HZ1 LYS 123 3HZ LYS 123 10.601 9.045 -1.444 1079 HZ2 LYS 123 1HZ LYS 123 11.069 7.919 -2.615 1080 HZ3 LYS 123 2HZ LYS 123 11.802 7.906 -1.096 1081 H ALA 124 H ALA 124 10.582 4.557 4.628 1082 HA ALA 124 HA ALA 124 9.316 5.684 6.892 1083 HB1 ALA 124 3HB ALA 124 8.647 3.347 7.343 1084 HB2 ALA 124 1HB ALA 124 9.775 2.793 6.102 1085 HB3 ALA 124 2HB ALA 124 8.392 3.796 5.656 1086 H GLY 125 H GLY 125 12.321 3.818 6.502 1087 HA2 GLY 125 2HA GLY 125 12.899 3.204 9.172 1088 HA3 GLY 125 3HA GLY 125 14.096 3.423 7.910 1089 H SER 126 H SER 126 13.435 6.186 7.381 1090 HA SER 126 HA SER 126 15.060 7.573 9.250 1091 HB2 SER 126 2HB SER 126 13.062 8.783 7.299 1092 HB3 SER 126 3HB SER 126 14.547 9.525 7.912 1093 HG SER 126 HG SER 126 15.353 7.313 6.828 1094 H LEU 127 H LEU 127 11.636 6.994 8.988 1095 HA LEU 127 HA LEU 127 10.778 9.065 10.838 1096 HB2 LEU 127 2HB LEU 127 9.174 6.852 9.491 1097 HB3 LEU 127 3HB LEU 127 8.502 8.224 10.363 1098 HG LEU 127 HG LEU 127 10.071 8.379 7.754 1099 HD11 LEU 127 1HD1 LEU 127 7.938 9.053 6.739 1100 HD12 LEU 127 2HD1 LEU 127 7.112 8.788 8.277 1101 HD13 LEU 127 3HD1 LEU 127 7.851 7.431 7.422 1102 HD21 LEU 127 3HD2 LEU 127 10.487 10.375 9.091 1103 HD22 LEU 127 1HD2 LEU 127 8.755 10.605 9.346 1104 HD23 LEU 127 2HD2 LEU 127 9.443 10.771 7.730 1105 H GLU 128 H GLU 128 11.257 5.560 10.834 1106 HA GLU 128 HA GLU 128 10.001 4.857 13.247 1107 HB2 GLU 128 2HB GLU 128 12.469 3.594 11.982 1108 HB3 GLU 128 3HB GLU 128 11.507 2.870 13.270 1109 HG2 GLU 128 2HG GLU 128 9.542 2.858 11.721 1110 HG3 GLU 128 3HG GLU 128 10.604 3.437 10.437 1111 H HIS 129 H HIS 129 13.334 5.793 12.601 1112 HA HIS 129 HA HIS 129 14.151 6.120 15.328 1113 HB2 HIS 129 2HB HIS 129 15.695 5.788 13.343 1114 HB3 HIS 129 3HB HIS 129 15.270 7.398 12.781 1115 HD1 HIS 129 HD1 HIS 129 17.136 5.626 15.532 1116 HD2 HIS 129 HD2 HIS 129 16.703 9.453 13.971 1117 HE1 HIS 129 HE1 HIS 129 18.927 7.007 16.628 1118 HE2 HIS 129 HE2 HIS 129 18.735 9.277 15.554 1119 H HIS 130 H HIS 130 12.940 7.500 16.557 1120 HA HIS 130 HA HIS 130 11.271 9.532 15.490 1121 HB2 HIS 130 2HB HIS 130 10.752 8.213 17.581 1122 HB3 HIS 130 3HB HIS 130 11.993 9.130 18.426 1123 HD1 HIS 130 HD1 HIS 130 10.289 10.149 20.083 1124 HD2 HIS 130 HD2 HIS 130 9.432 10.996 16.106 1125 HE1 HIS 130 HE1 HIS 130 8.506 11.922 20.142 1126 HE2 HIS 130 HE2 HIS 130 8.063 12.457 17.725 1127 H HIS 131 H HIS 131 12.613 10.901 14.365 1128 HA HIS 131 HA HIS 131 13.450 13.284 15.589 1129 HB2 HIS 131 2HB HIS 131 15.445 11.904 16.276 1130 HB3 HIS 131 3HB HIS 131 15.758 11.519 14.591 1131 HD1 HIS 131 HD1 HIS 131 16.219 14.194 17.148 1132 HD2 HIS 131 HD2 HIS 131 16.880 13.680 13.080 1133 HE1 HIS 131 HE1 HIS 131 17.700 16.102 16.455 1134 HE2 HIS 131 HE2 HIS 131 18.049 15.794 13.982 1135 H HIS 132 H HIS 132 12.549 14.487 13.997 1136 HA HIS 132 HA HIS 132 12.645 14.000 11.202 1137 HB2 HIS 132 2HB HIS 132 10.996 15.556 12.252 1138 HB3 HIS 132 3HB HIS 132 12.299 16.638 12.720 1139 HD1 HIS 132 HD1 HIS 132 10.366 15.483 9.703 1140 HD2 HIS 132 HD2 HIS 132 13.159 18.381 10.721 1141 HE1 HIS 132 HE1 HIS 132 10.464 17.048 7.741 1142 HE2 HIS 132 HE2 HIS 132 12.371 18.599 8.277 1143 H HIS 133 H HIS 133 14.611 13.677 10.305 1144 HA HIS 133 HA HIS 133 17.065 14.445 11.471 1145 HB2 HIS 133 2HB HIS 133 16.515 13.338 8.686 1146 HB3 HIS 133 3HB HIS 133 18.120 13.500 9.387 1147 HD1 HIS 133 HD1 HIS 133 18.896 11.706 10.978 1148 HD2 HIS 133 HD2 HIS 133 14.898 11.296 9.916 1149 HE1 HIS 133 HE1 HIS 133 18.199 9.448 11.832 1150 HE2 HIS 133 HE2 HIS 133 15.841 9.146 10.995 1151 H HIS 134 H HIS 134 15.899 15.360 8.227 1152 HA HIS 134 HA HIS 134 17.310 17.955 8.432 1153 HB2 HIS 134 2HB HIS 134 16.415 16.402 5.953 1154 HB3 HIS 134 3HB HIS 134 17.191 17.984 5.930 1155 HD1 HIS 134 HD1 HIS 134 19.639 17.860 7.394 1156 HD2 HIS 134 HD2 HIS 134 18.237 14.438 5.503 1157 HE1 HIS 134 HE1 HIS 134 21.628 16.346 7.179 1158 HE2 HIS 134 HE2 HIS 134 20.789 14.364 5.884 Start of MODEL 19 1 H1 MET 1 1H MET 1 1.637 8.035 17.442 2 H2 MET 1 2H MET 1 0.138 7.446 16.954 3 H3 MET 1 3H MET 1 0.366 9.106 17.148 4 HA MET 1 HA MET 1 0.346 8.485 14.823 5 HB2 MET 1 2HB MET 1 1.689 10.435 15.534 6 HB3 MET 1 3HB MET 1 3.064 9.396 15.888 7 HG2 MET 1 2HG MET 1 3.277 10.659 13.744 8 HG3 MET 1 3HG MET 1 3.369 8.905 13.539 9 HE1 MET 1 3HE MET 1 1.557 10.193 10.263 10 HE2 MET 1 1HE MET 1 2.933 9.275 10.878 11 HE3 MET 1 2HE MET 1 2.829 11.014 11.169 12 H LYS 2 H LYS 2 1.269 7.238 13.109 13 HA LYS 2 HA LYS 2 3.345 5.293 13.544 14 HB2 LYS 2 2HB LYS 2 1.964 3.267 13.273 15 HB3 LYS 2 3HB LYS 2 1.480 4.163 14.709 16 HG2 LYS 2 2HG LYS 2 -0.350 5.197 13.121 17 HG3 LYS 2 3HG LYS 2 -0.008 3.792 12.107 18 HD2 LYS 2 2HD LYS 2 -0.867 3.687 15.029 19 HD3 LYS 2 3HD LYS 2 -1.945 3.465 13.652 20 HE2 LYS 2 2HE LYS 2 -0.711 1.433 13.005 21 HE3 LYS 2 3HE LYS 2 0.404 1.668 14.359 22 HZ1 LYS 2 3HZ LYS 2 -1.338 1.329 15.901 23 HZ2 LYS 2 1HZ LYS 2 -1.450 0.073 14.780 24 HZ3 LYS 2 2HZ LYS 2 -2.527 1.372 14.709 25 H ILE 3 H ILE 3 3.424 3.769 11.546 26 HA ILE 3 HA ILE 3 2.970 5.403 9.107 27 HB ILE 3 HB ILE 3 5.097 3.261 9.603 28 HG12 ILE 3 2HG1 ILE 3 5.462 6.292 9.462 29 HG13 ILE 3 3HG1 ILE 3 5.432 5.364 10.957 30 HG21 ILE 3 1HG2 ILE 3 6.093 4.033 7.472 31 HG22 ILE 3 2HG2 ILE 3 4.754 5.158 7.243 32 HG23 ILE 3 3HG2 ILE 3 4.459 3.417 7.225 33 HD11 ILE 3 3HD1 ILE 3 7.433 4.148 10.226 34 HD12 ILE 3 1HD1 ILE 3 7.688 5.889 10.334 35 HD13 ILE 3 2HD1 ILE 3 7.477 5.130 8.758 36 H LEU 4 H LEU 4 1.798 4.506 7.486 37 HA LEU 4 HA LEU 4 1.149 1.616 7.542 38 HB2 LEU 4 2HB LEU 4 -0.648 3.874 6.553 39 HB3 LEU 4 3HB LEU 4 -1.044 2.160 6.545 40 HG LEU 4 HG LEU 4 -0.695 3.916 9.019 41 HD11 LEU 4 1HD1 LEU 4 -3.075 3.537 9.405 42 HD12 LEU 4 2HD1 LEU 4 -3.190 2.618 7.899 43 HD13 LEU 4 3HD1 LEU 4 -2.792 4.338 7.861 44 HD21 LEU 4 3HD2 LEU 4 0.112 1.661 9.509 45 HD22 LEU 4 1HD2 LEU 4 -1.389 0.961 8.900 46 HD23 LEU 4 2HD2 LEU 4 -1.402 1.973 10.348 47 H ILE 5 H ILE 5 1.352 0.525 5.602 48 HA ILE 5 HA ILE 5 2.356 2.013 3.227 49 HB ILE 5 HB ILE 5 3.182 -0.823 4.011 50 HG12 ILE 5 2HG1 ILE 5 4.110 0.806 5.660 51 HG13 ILE 5 3HG1 ILE 5 5.361 0.017 4.713 52 HG21 ILE 5 1HG2 ILE 5 4.280 1.034 1.865 53 HG22 ILE 5 2HG2 ILE 5 3.299 -0.410 1.599 54 HG23 ILE 5 3HG2 ILE 5 4.929 -0.563 2.262 55 HD11 ILE 5 3HD1 ILE 5 5.856 2.343 5.079 56 HD12 ILE 5 1HD1 ILE 5 4.343 2.821 4.314 57 HD13 ILE 5 2HD1 ILE 5 5.607 2.037 3.361 58 H LEU 6 H LEU 6 0.736 1.907 1.737 59 HA LEU 6 HA LEU 6 -1.091 -0.419 1.701 60 HB2 LEU 6 2HB LEU 6 -1.805 2.159 1.746 61 HB3 LEU 6 3HB LEU 6 -1.494 2.081 0.030 62 HG LEU 6 HG LEU 6 -3.881 1.804 0.450 63 HD11 LEU 6 1HD1 LEU 6 -4.400 -0.294 -0.676 64 HD12 LEU 6 2HD1 LEU 6 -2.756 -0.878 -0.396 65 HD13 LEU 6 3HD1 LEU 6 -3.033 0.513 -1.447 66 HD21 LEU 6 3HD2 LEU 6 -3.762 1.008 2.749 67 HD22 LEU 6 1HD2 LEU 6 -3.170 -0.563 2.196 68 HD23 LEU 6 2HD2 LEU 6 -4.800 -0.028 1.774 69 H ILE 7 H ILE 7 -0.824 -1.913 0.092 70 HA ILE 7 HA ILE 7 0.558 -1.115 -2.411 71 HB ILE 7 HB ILE 7 1.047 -3.727 -0.894 72 HG12 ILE 7 2HG1 ILE 7 2.930 -1.372 -1.416 73 HG13 ILE 7 3HG1 ILE 7 2.197 -1.772 0.132 74 HG21 ILE 7 1HG2 ILE 7 1.077 -4.103 -3.332 75 HG22 ILE 7 2HG2 ILE 7 2.703 -4.251 -2.666 76 HG23 ILE 7 3HG2 ILE 7 2.238 -2.788 -3.538 77 HD11 ILE 7 3HD1 ILE 7 4.507 -2.443 0.052 78 HD12 ILE 7 1HD1 ILE 7 4.199 -3.458 -1.359 79 HD13 ILE 7 2HD1 ILE 7 3.457 -3.851 0.196 80 H ASN 8 H ASN 8 -0.508 -1.627 -4.166 81 HA ASN 8 HA ASN 8 -2.509 -3.806 -4.230 82 HB2 ASN 8 2HB ASN 8 -3.745 -1.698 -4.268 83 HB3 ASN 8 3HB ASN 8 -2.672 -1.024 -5.488 84 HD21 ASN 8 1HD2 ASN 8 -5.327 -3.221 -4.905 85 HD22 ASN 8 2HD2 ASN 8 -5.762 -3.463 -6.559 86 H THR 9 H THR 9 -1.629 -5.334 -5.467 87 HA THR 9 HA THR 9 -0.370 -4.608 -8.045 88 HB THR 9 HB THR 9 1.434 -5.431 -6.644 89 HG1 THR 9 HG1 THR 9 2.165 -6.630 -8.213 90 HG21 THR 9 3HG2 THR 9 1.444 -7.663 -5.605 91 HG22 THR 9 1HG2 THR 9 -0.225 -7.924 -6.126 92 HG23 THR 9 2HG2 THR 9 0.145 -6.670 -4.941 93 H ASN 10 H ASN 10 -0.939 -5.902 -9.813 94 HA ASN 10 HA ASN 10 -3.498 -7.277 -9.615 95 HB2 ASN 10 2HB ASN 10 -1.712 -6.859 -12.052 96 HB3 ASN 10 3HB ASN 10 -3.380 -7.425 -12.076 97 HD21 ASN 10 1HD2 ASN 10 -2.256 -5.143 -13.423 98 HD22 ASN 10 2HD2 ASN 10 -3.095 -3.754 -12.849 99 H ASN 11 H ASN 11 -0.197 -8.070 -9.491 100 HA ASN 11 HA ASN 11 -0.558 -10.886 -10.317 101 HB2 ASN 11 2HB ASN 11 2.014 -9.294 -9.885 102 HB3 ASN 11 3HB ASN 11 1.935 -10.977 -10.405 103 HD21 ASN 11 1HD2 ASN 11 3.048 -8.605 -11.766 104 HD22 ASN 11 2HD2 ASN 11 2.258 -8.539 -13.298 105 H ASP 12 H ASP 12 -0.958 -12.268 -8.756 106 HA ASP 12 HA ASP 12 -0.841 -11.876 -5.982 107 HB2 ASP 12 2HB ASP 12 -0.792 -14.512 -7.514 108 HB3 ASP 12 3HB ASP 12 -1.145 -14.350 -5.794 109 H GLU 13 H GLU 13 1.566 -12.922 -8.221 110 HA GLU 13 HA GLU 13 3.455 -14.272 -6.715 111 HB2 GLU 13 2HB GLU 13 4.005 -12.194 -8.891 112 HB3 GLU 13 3HB GLU 13 5.102 -13.480 -8.377 113 HG2 GLU 13 2HG GLU 13 3.516 -15.174 -9.212 114 HG3 GLU 13 3HG GLU 13 2.399 -13.900 -9.697 115 H LEU 14 H LEU 14 3.079 -10.767 -7.214 116 HA LEU 14 HA LEU 14 5.331 -10.001 -5.669 117 HB2 LEU 14 2HB LEU 14 3.001 -8.464 -6.827 118 HB3 LEU 14 3HB LEU 14 4.122 -7.663 -5.741 119 HG LEU 14 HG LEU 14 4.794 -7.170 -7.991 120 HD11 LEU 14 1HD1 LEU 14 6.713 -9.203 -6.827 121 HD12 LEU 14 2HD1 LEU 14 6.587 -7.503 -6.364 122 HD13 LEU 14 3HD1 LEU 14 7.096 -7.933 -7.989 123 HD21 LEU 14 3HD2 LEU 14 4.912 -10.155 -8.545 124 HD22 LEU 14 1HD2 LEU 14 5.395 -8.868 -9.657 125 HD23 LEU 14 2HD2 LEU 14 3.709 -9.025 -9.173 126 H ILE 15 H ILE 15 2.007 -10.649 -4.763 127 HA ILE 15 HA ILE 15 1.875 -9.217 -2.331 128 HB ILE 15 HB ILE 15 0.513 -11.827 -3.124 129 HG12 ILE 15 2HG1 ILE 15 -0.448 -8.936 -3.320 130 HG13 ILE 15 3HG1 ILE 15 0.026 -9.963 -4.670 131 HG21 ILE 15 1HG2 ILE 15 -0.279 -9.934 -0.885 132 HG22 ILE 15 2HG2 ILE 15 0.428 -11.535 -0.675 133 HG23 ILE 15 3HG2 ILE 15 -1.172 -11.369 -1.395 134 HD11 ILE 15 3HD1 ILE 15 -2.359 -10.368 -2.870 135 HD12 ILE 15 1HD1 ILE 15 -1.870 -11.443 -4.185 136 HD13 ILE 15 2HD1 ILE 15 -2.362 -9.788 -4.534 137 H LYS 16 H LYS 16 2.818 -12.611 -2.952 138 HA LYS 16 HA LYS 16 3.583 -13.137 -0.226 139 HB2 LYS 16 2HB LYS 16 4.272 -15.347 -1.047 140 HB3 LYS 16 3HB LYS 16 2.669 -14.915 -1.631 141 HG2 LYS 16 2HG LYS 16 3.802 -14.197 -3.813 142 HG3 LYS 16 3HG LYS 16 5.266 -14.968 -3.199 143 HD2 LYS 16 2HD LYS 16 4.094 -16.502 -4.691 144 HD3 LYS 16 3HD LYS 16 4.033 -17.133 -3.042 145 HE2 LYS 16 2HE LYS 16 1.721 -16.320 -2.804 146 HE3 LYS 16 3HE LYS 16 1.789 -15.605 -4.416 147 HZ1 LYS 16 3HZ LYS 16 0.639 -17.739 -4.384 148 HZ2 LYS 16 1HZ LYS 16 2.037 -18.504 -3.825 149 HZ3 LYS 16 2HZ LYS 16 2.016 -17.796 -5.359 150 H LYS 17 H LYS 17 5.312 -12.189 -3.168 151 HA LYS 17 HA LYS 17 7.981 -12.638 -2.298 152 HB2 LYS 17 2HB LYS 17 6.818 -10.720 -4.356 153 HB3 LYS 17 3HB LYS 17 8.551 -10.905 -4.099 154 HG2 LYS 17 2HG LYS 17 8.532 -13.164 -4.889 155 HG3 LYS 17 3HG LYS 17 6.769 -13.242 -4.838 156 HD2 LYS 17 2HD LYS 17 7.547 -13.021 -7.151 157 HD3 LYS 17 3HD LYS 17 6.625 -11.594 -6.676 158 HE2 LYS 17 2HE LYS 17 8.568 -10.903 -7.951 159 HE3 LYS 17 3HE LYS 17 8.797 -10.397 -6.274 160 HZ1 LYS 17 3HZ LYS 17 10.803 -11.387 -7.167 161 HZ2 LYS 17 1HZ LYS 17 9.977 -12.810 -7.544 162 HZ3 LYS 17 2HZ LYS 17 10.185 -12.358 -5.936 163 H ILE 18 H ILE 18 5.905 -9.768 -2.218 164 HA ILE 18 HA ILE 18 7.706 -7.984 -0.965 165 HB ILE 18 HB ILE 18 4.680 -7.941 -1.269 166 HG12 ILE 18 2HG1 ILE 18 6.823 -6.133 -2.487 167 HG13 ILE 18 3HG1 ILE 18 6.151 -7.547 -3.287 168 HG21 ILE 18 1HG2 ILE 18 6.333 -5.745 0.026 169 HG22 ILE 18 2HG2 ILE 18 5.134 -6.754 0.836 170 HG23 ILE 18 3HG2 ILE 18 4.627 -5.619 -0.415 171 HD11 ILE 18 3HD1 ILE 18 5.151 -5.515 -4.128 172 HD12 ILE 18 1HD1 ILE 18 4.616 -5.068 -2.508 173 HD13 ILE 18 2HD1 ILE 18 3.941 -6.496 -3.302 174 H LYS 19 H LYS 19 5.288 -10.295 0.350 175 HA LYS 19 HA LYS 19 5.462 -9.650 3.068 176 HB2 LYS 19 2HB LYS 19 5.107 -12.330 1.699 177 HB3 LYS 19 3HB LYS 19 5.149 -12.205 3.459 178 HG2 LYS 19 2HG LYS 19 3.216 -10.639 3.363 179 HG3 LYS 19 3HG LYS 19 3.133 -10.886 1.611 180 HD2 LYS 19 2HD LYS 19 2.710 -13.276 1.932 181 HD3 LYS 19 3HD LYS 19 2.902 -13.110 3.682 182 HE2 LYS 19 2HE LYS 19 0.545 -13.249 3.065 183 HE3 LYS 19 3HE LYS 19 0.909 -11.668 3.757 184 HZ1 LYS 19 3HZ LYS 19 0.672 -12.278 0.867 185 HZ2 LYS 19 1HZ LYS 19 0.985 -10.753 1.532 186 HZ3 LYS 19 2HZ LYS 19 -0.499 -11.512 1.812 187 H LYS 20 H LYS 20 7.706 -11.591 1.111 188 HA LYS 20 HA LYS 20 9.355 -12.415 3.314 189 HB2 LYS 20 2HB LYS 20 10.066 -12.417 0.355 190 HB3 LYS 20 3HB LYS 20 10.831 -13.372 1.620 191 HG2 LYS 20 2HG LYS 20 8.009 -13.695 0.544 192 HG3 LYS 20 3HG LYS 20 9.374 -14.771 0.260 193 HD2 LYS 20 2HD LYS 20 7.938 -14.303 2.903 194 HD3 LYS 20 3HD LYS 20 7.847 -15.746 1.891 195 HE2 LYS 20 2HE LYS 20 10.283 -14.748 3.406 196 HE3 LYS 20 3HE LYS 20 9.304 -16.161 3.792 197 HZ1 LYS 20 3HZ LYS 20 10.918 -15.836 1.318 198 HZ2 LYS 20 1HZ LYS 20 10.029 -17.202 1.762 199 HZ3 LYS 20 2HZ LYS 20 11.371 -16.741 2.671 200 H GLU 21 H GLU 21 9.615 -9.909 0.815 201 HA GLU 21 HA GLU 21 12.023 -8.684 1.467 202 HB2 GLU 21 2HB GLU 21 9.420 -7.365 0.571 203 HB3 GLU 21 3HB GLU 21 10.980 -6.544 0.584 204 HG2 GLU 21 2HG GLU 21 10.236 -8.961 -1.094 205 HG3 GLU 21 3HG GLU 21 10.363 -7.300 -1.666 206 H VAL 22 H VAL 22 8.824 -7.978 2.831 207 HA VAL 22 HA VAL 22 9.829 -5.881 4.567 208 HB VAL 22 HB VAL 22 7.531 -5.424 5.124 209 HG11 VAL 22 1HG1 VAL 22 6.565 -5.042 2.860 210 HG12 VAL 22 2HG1 VAL 22 7.804 -6.088 2.174 211 HG13 VAL 22 3HG1 VAL 22 8.260 -4.580 2.961 212 HG21 VAL 22 3HG2 VAL 22 5.628 -6.818 4.328 213 HG22 VAL 22 1HG2 VAL 22 6.660 -7.692 5.461 214 HG23 VAL 22 2HG2 VAL 22 6.774 -8.021 3.733 215 H GLU 23 H GLU 23 9.356 -9.227 4.804 216 HA GLU 23 HA GLU 23 8.954 -9.796 7.488 217 HB2 GLU 23 2HB GLU 23 9.145 -11.501 5.728 218 HB3 GLU 23 3HB GLU 23 10.827 -11.073 5.452 219 HG2 GLU 23 2HG GLU 23 11.281 -11.841 7.845 220 HG3 GLU 23 3HG GLU 23 9.645 -12.496 7.845 221 H ASN 24 H ASN 24 11.887 -8.829 5.788 222 HA ASN 24 HA ASN 24 13.677 -9.066 8.035 223 HB2 ASN 24 2HB ASN 24 14.102 -7.698 5.332 224 HB3 ASN 24 3HB ASN 24 15.367 -8.145 6.482 225 HD21 ASN 24 1HD2 ASN 24 12.987 -9.358 4.227 226 HD22 ASN 24 2HD2 ASN 24 13.663 -10.936 4.058 227 H GLN 25 H GLN 25 11.628 -6.594 6.752 228 HA GLN 25 HA GLN 25 13.073 -4.398 8.089 229 HB2 GLN 25 2HB GLN 25 10.815 -4.356 6.045 230 HB3 GLN 25 3HB GLN 25 11.580 -2.924 6.730 231 HG2 GLN 25 2HG GLN 25 12.938 -5.014 4.996 232 HG3 GLN 25 3HG GLN 25 12.429 -3.407 4.493 233 HE21 GLN 25 1HE2 GLN 25 14.831 -5.242 6.188 234 HE22 GLN 25 2HE2 GLN 25 15.937 -3.946 6.439 235 H GLY 26 H GLY 26 10.557 -6.503 8.791 236 HA2 GLY 26 2HA GLY 26 9.049 -6.597 10.489 237 HA3 GLY 26 3HA GLY 26 9.818 -5.175 11.163 238 H TYR 27 H TYR 27 8.045 -5.502 8.072 239 HA TYR 27 HA TYR 27 6.045 -3.540 9.044 240 HB2 TYR 27 2HB TYR 27 6.862 -4.337 6.224 241 HB3 TYR 27 3HB TYR 27 5.423 -3.382 6.554 242 HD1 TYR 27 HD2 TYR 27 9.083 -3.354 7.474 243 HD2 TYR 27 HD1 TYR 27 5.677 -1.049 6.367 244 HE1 TYR 27 HE2 TYR 27 10.450 -1.322 7.524 245 HE2 TYR 27 HE1 TYR 27 7.045 0.993 6.416 246 HH TYR 27 HH TYR 27 10.474 0.922 6.691 247 H GLN 28 H GLN 28 4.432 -4.546 10.002 248 HA GLN 28 HA GLN 28 3.848 -7.313 9.690 249 HB2 GLN 28 2HB GLN 28 2.213 -5.171 11.117 250 HB3 GLN 28 3HB GLN 28 2.080 -6.909 11.353 251 HG2 GLN 28 2HG GLN 28 4.447 -5.167 12.091 252 HG3 GLN 28 3HG GLN 28 3.275 -5.871 13.203 253 HE21 GLN 28 1HE2 GLN 28 3.319 -8.141 13.544 254 HE22 GLN 28 2HE2 GLN 28 4.732 -9.072 13.207 255 H VAL 29 H VAL 29 2.629 -8.219 8.154 256 HA VAL 29 HA VAL 29 1.183 -6.570 6.228 257 HB VAL 29 HB VAL 29 1.791 -9.562 6.210 258 HG11 VAL 29 1HG1 VAL 29 0.688 -7.822 3.969 259 HG12 VAL 29 2HG1 VAL 29 -0.191 -9.088 4.830 260 HG13 VAL 29 3HG1 VAL 29 1.180 -9.511 3.801 261 HG21 VAL 29 3HG2 VAL 29 3.836 -8.194 6.089 262 HG22 VAL 29 1HG2 VAL 29 3.168 -7.288 4.728 263 HG23 VAL 29 2HG2 VAL 29 3.541 -9.006 4.549 264 H ARG 30 H ARG 30 -0.982 -6.334 6.198 265 HA ARG 30 HA ARG 30 -2.773 -8.429 7.296 266 HB2 ARG 30 2HB ARG 30 -3.332 -5.439 6.989 267 HB3 ARG 30 3HB ARG 30 -4.492 -6.636 7.559 268 HG2 ARG 30 2HG ARG 30 -1.936 -5.794 8.968 269 HG3 ARG 30 3HG ARG 30 -3.586 -5.352 9.420 270 HD2 ARG 30 2HD ARG 30 -4.088 -7.753 9.834 271 HD3 ARG 30 3HD ARG 30 -2.414 -8.158 9.445 272 HE ARG 30 HE ARG 30 -1.968 -6.469 11.382 273 HH11 ARG 30 1HH1 ARG 30 -4.534 -8.841 11.332 274 HH12 ARG 30 2HH1 ARG 30 -4.553 -9.021 13.057 275 HH21 ARG 30 1HH2 ARG 30 -1.984 -6.700 13.609 276 HH22 ARG 30 2HH2 ARG 30 -3.099 -7.798 14.353 277 H ASP 31 H ASP 31 -3.788 -9.506 5.725 278 HA ASP 31 HA ASP 31 -3.954 -8.412 2.992 279 HB2 ASP 31 2HB ASP 31 -4.446 -11.241 4.042 280 HB3 ASP 31 3HB ASP 31 -4.558 -10.760 2.349 281 H VAL 32 H VAL 32 -5.754 -7.498 2.381 282 HA VAL 32 HA VAL 32 -8.356 -8.135 3.647 283 HB VAL 32 HB VAL 32 -7.304 -5.384 2.814 284 HG11 VAL 32 1HG1 VAL 32 -10.080 -6.104 3.845 285 HG12 VAL 32 2HG1 VAL 32 -9.686 -5.573 2.207 286 HG13 VAL 32 3HG1 VAL 32 -9.482 -4.465 3.564 287 HG21 VAL 32 3HG2 VAL 32 -8.089 -6.424 5.569 288 HG22 VAL 32 1HG2 VAL 32 -7.562 -4.778 5.202 289 HG23 VAL 32 2HG2 VAL 32 -6.441 -6.129 5.007 290 H ASN 33 H ASN 33 -9.588 -9.040 2.167 291 HA ASN 33 HA ASN 33 -9.779 -7.970 -0.576 292 HB2 ASN 33 2HB ASN 33 -9.934 -10.910 0.221 293 HB3 ASN 33 3HB ASN 33 -10.293 -10.290 -1.384 294 HD21 ASN 33 1HD2 ASN 33 -8.053 -8.394 -1.446 295 HD22 ASN 33 2HD2 ASN 33 -6.628 -9.346 -1.603 296 H ASP 34 H ASP 34 -11.266 -8.068 2.258 297 HA ASP 34 HA ASP 34 -13.996 -8.116 1.137 298 HB2 ASP 34 2HB ASP 34 -13.101 -9.359 3.793 299 HB3 ASP 34 3HB ASP 34 -14.782 -9.107 3.342 300 H SER 35 H SER 35 -15.234 -6.402 1.821 301 HA SER 35 HA SER 35 -13.998 -4.125 2.932 302 HB2 SER 35 2HB SER 35 -16.320 -3.148 2.890 303 HB3 SER 35 3HB SER 35 -15.834 -3.884 1.362 304 HG SER 35 HG SER 35 -17.057 -5.720 1.936 305 H ASP 36 H ASP 36 -15.819 -6.737 4.420 306 HA ASP 36 HA ASP 36 -16.241 -5.519 6.951 307 HB2 ASP 36 2HB ASP 36 -16.116 -8.432 6.104 308 HB3 ASP 36 3HB ASP 36 -16.372 -7.971 7.783 309 H GLU 37 H GLU 37 -13.595 -7.481 5.648 310 HA GLU 37 HA GLU 37 -11.984 -7.576 7.999 311 HB2 GLU 37 2HB GLU 37 -11.363 -7.942 5.043 312 HB3 GLU 37 3HB GLU 37 -10.101 -8.054 6.269 313 HG2 GLU 37 2HG GLU 37 -12.597 -9.783 6.226 314 HG3 GLU 37 3HG GLU 37 -11.048 -10.262 5.540 315 H LEU 38 H LEU 38 -12.261 -5.314 5.304 316 HA LEU 38 HA LEU 38 -10.148 -3.567 5.802 317 HB2 LEU 38 2HB LEU 38 -11.374 -3.404 3.766 318 HB3 LEU 38 3HB LEU 38 -12.896 -3.183 4.590 319 HG LEU 38 HG LEU 38 -10.848 -1.009 4.975 320 HD11 LEU 38 1HD1 LEU 38 -11.408 0.089 2.873 321 HD12 LEU 38 2HD1 LEU 38 -12.381 -1.299 2.381 322 HD13 LEU 38 3HD1 LEU 38 -10.634 -1.468 2.583 323 HD21 LEU 38 3HD2 LEU 38 -13.053 -0.809 6.068 324 HD22 LEU 38 1HD2 LEU 38 -13.857 -0.916 4.499 325 HD23 LEU 38 2HD2 LEU 38 -12.824 0.468 4.875 326 H LYS 39 H LYS 39 -13.519 -3.415 7.002 327 HA LYS 39 HA LYS 39 -13.315 -1.161 8.642 328 HB2 LYS 39 2HB LYS 39 -15.043 -3.640 9.074 329 HB3 LYS 39 3HB LYS 39 -15.270 -2.101 9.907 330 HG2 LYS 39 2HG LYS 39 -15.700 -1.023 7.690 331 HG3 LYS 39 3HG LYS 39 -15.594 -2.615 6.931 332 HD2 LYS 39 2HD LYS 39 -17.633 -1.751 9.028 333 HD3 LYS 39 3HD LYS 39 -17.947 -1.967 7.306 334 HE2 LYS 39 2HE LYS 39 -17.451 -4.374 7.524 335 HE3 LYS 39 3HE LYS 39 -17.130 -4.165 9.245 336 HZ1 LYS 39 3HZ LYS 39 -19.350 -5.018 8.795 337 HZ2 LYS 39 1HZ LYS 39 -19.727 -3.626 7.908 338 HZ3 LYS 39 2HZ LYS 39 -19.409 -3.515 9.567 339 H LYS 40 H LYS 40 -12.985 -4.606 9.569 340 HA LYS 40 HA LYS 40 -12.602 -4.409 12.292 341 HB2 LYS 40 2HB LYS 40 -11.278 -6.435 10.431 342 HB3 LYS 40 3HB LYS 40 -11.461 -6.624 12.174 343 HG2 LYS 40 2HG LYS 40 -13.742 -6.451 10.189 344 HG3 LYS 40 3HG LYS 40 -13.094 -7.946 10.863 345 HD2 LYS 40 2HD LYS 40 -13.787 -7.230 13.125 346 HD3 LYS 40 3HD LYS 40 -14.397 -5.705 12.469 347 HE2 LYS 40 2HE LYS 40 -16.222 -7.325 12.868 348 HE3 LYS 40 3HE LYS 40 -16.081 -6.924 11.155 349 HZ1 LYS 40 3HZ LYS 40 -14.952 -8.989 10.772 350 HZ2 LYS 40 1HZ LYS 40 -16.406 -9.306 11.569 351 HZ3 LYS 40 2HZ LYS 40 -14.942 -9.359 12.414 352 H GLU 41 H GLU 41 -10.020 -4.567 9.815 353 HA GLU 41 HA GLU 41 -7.900 -4.519 11.723 354 HB2 GLU 41 2HB GLU 41 -7.772 -4.039 8.716 355 HB3 GLU 41 3HB GLU 41 -6.400 -4.414 9.760 356 HG2 GLU 41 2HG GLU 41 -8.766 -6.265 9.266 357 HG3 GLU 41 3HG GLU 41 -7.228 -6.356 8.411 358 H MET 42 H MET 42 -9.490 -2.014 9.773 359 HA MET 42 HA MET 42 -7.626 0.081 10.300 360 HB2 MET 42 2HB MET 42 -10.539 0.156 9.420 361 HB3 MET 42 3HB MET 42 -9.574 1.616 9.632 362 HG2 MET 42 2HG MET 42 -9.027 -0.633 7.682 363 HG3 MET 42 3HG MET 42 -9.578 1.000 7.296 364 HE1 MET 42 3HE MET 42 -7.805 2.793 9.251 365 HE2 MET 42 1HE MET 42 -8.012 3.184 7.543 366 HE3 MET 42 2HE MET 42 -6.396 3.126 8.246 367 H LYS 43 H LYS 43 -10.500 -1.066 12.029 368 HA LYS 43 HA LYS 43 -10.633 1.047 13.946 369 HB2 LYS 43 2HB LYS 43 -11.481 -1.841 14.434 370 HB3 LYS 43 3HB LYS 43 -12.030 -0.414 15.309 371 HG2 LYS 43 2HG LYS 43 -12.674 -1.179 12.457 372 HG3 LYS 43 3HG LYS 43 -13.773 -1.189 13.831 373 HD2 LYS 43 2HD LYS 43 -13.631 1.284 13.958 374 HD3 LYS 43 3HD LYS 43 -12.503 1.295 12.596 375 HE2 LYS 43 2HE LYS 43 -14.239 0.342 11.137 376 HE3 LYS 43 3HE LYS 43 -15.363 0.273 12.496 377 HZ1 LYS 43 3HZ LYS 43 -15.825 2.183 11.169 378 HZ2 LYS 43 1HZ LYS 43 -14.226 2.714 11.265 379 HZ3 LYS 43 2HZ LYS 43 -15.191 2.703 12.644 380 H LYS 44 H LYS 44 -8.932 -2.034 13.806 381 HA LYS 44 HA LYS 44 -7.805 -2.086 16.408 382 HB2 LYS 44 2HB LYS 44 -6.832 -3.387 13.826 383 HB3 LYS 44 3HB LYS 44 -6.252 -3.801 15.438 384 HG2 LYS 44 2HG LYS 44 -9.132 -4.115 14.519 385 HG3 LYS 44 3HG LYS 44 -7.934 -5.411 14.491 386 HD2 LYS 44 2HD LYS 44 -8.879 -3.936 16.985 387 HD3 LYS 44 3HD LYS 44 -9.443 -5.525 16.461 388 HE2 LYS 44 2HE LYS 44 -6.589 -4.834 17.245 389 HE3 LYS 44 3HE LYS 44 -7.754 -5.711 18.238 390 HZ1 LYS 44 3HZ LYS 44 -6.206 -7.191 17.111 391 HZ2 LYS 44 1HZ LYS 44 -6.727 -6.629 15.607 392 HZ3 LYS 44 2HZ LYS 44 -7.792 -7.474 16.607 393 H LEU 45 H LEU 45 -6.676 -0.721 13.329 394 HA LEU 45 HA LEU 45 -4.057 0.024 14.128 395 HB2 LEU 45 2HB LEU 45 -5.847 1.255 11.993 396 HB3 LEU 45 3HB LEU 45 -4.134 1.611 12.179 397 HG LEU 45 HG LEU 45 -5.365 -1.044 11.363 398 HD11 LEU 45 1HD1 LEU 45 -3.598 0.859 9.809 399 HD12 LEU 45 2HD1 LEU 45 -5.326 0.588 9.566 400 HD13 LEU 45 3HD1 LEU 45 -4.182 -0.713 9.249 401 HD21 LEU 45 3HD2 LEU 45 -3.070 -1.915 11.153 402 HD22 LEU 45 1HD2 LEU 45 -3.472 -1.508 12.820 403 HD23 LEU 45 2HD2 LEU 45 -2.438 -0.432 11.876 404 H ALA 46 H ALA 46 -7.182 1.573 14.504 405 HA ALA 46 HA ALA 46 -6.137 4.082 15.518 406 HB1 ALA 46 3HB ALA 46 -8.969 2.986 15.531 407 HB2 ALA 46 1HB ALA 46 -8.265 4.014 14.278 408 HB3 ALA 46 2HB ALA 46 -8.498 4.646 15.911 409 H GLU 47 H GLU 47 -7.152 0.991 16.851 410 HA GLU 47 HA GLU 47 -7.414 1.821 19.591 411 HB2 GLU 47 2HB GLU 47 -7.099 -0.913 18.290 412 HB3 GLU 47 3HB GLU 47 -7.284 -0.702 20.033 413 HG2 GLU 47 2HG GLU 47 -9.486 0.282 19.733 414 HG3 GLU 47 3HG GLU 47 -9.301 0.248 17.977 415 H GLU 48 H GLU 48 -4.726 1.155 17.554 416 HA GLU 48 HA GLU 48 -2.909 1.066 19.893 417 HB2 GLU 48 2HB GLU 48 -2.783 -1.003 18.524 418 HB3 GLU 48 3HB GLU 48 -2.395 -0.046 17.097 419 HG2 GLU 48 2HG GLU 48 -0.382 -1.091 18.106 420 HG3 GLU 48 3HG GLU 48 -0.283 0.671 18.087 421 H LYS 49 H LYS 49 -1.849 2.910 20.192 422 HA LYS 49 HA LYS 49 -1.765 4.923 18.028 423 HB2 LYS 49 2HB LYS 49 -1.301 5.367 21.007 424 HB3 LYS 49 3HB LYS 49 -1.475 6.603 19.771 425 HG2 LYS 49 2HG LYS 49 -3.563 6.658 20.785 426 HG3 LYS 49 3HG LYS 49 -3.864 5.596 19.417 427 HD2 LYS 49 2HD LYS 49 -4.958 4.569 21.268 428 HD3 LYS 49 3HD LYS 49 -3.489 3.628 21.020 429 HE2 LYS 49 2HE LYS 49 -3.741 5.831 23.101 430 HE3 LYS 49 3HE LYS 49 -4.052 4.131 23.434 431 HZ1 LYS 49 3HZ LYS 49 -1.738 3.652 22.813 432 HZ2 LYS 49 1HZ LYS 49 -1.839 4.724 24.112 433 HZ3 LYS 49 2HZ LYS 49 -1.456 5.299 22.575 434 H ASN 50 H ASN 50 0.223 2.615 19.311 435 HA ASN 50 HA ASN 50 2.694 3.955 19.707 436 HB2 ASN 50 2HB ASN 50 2.163 1.649 20.554 437 HB3 ASN 50 3HB ASN 50 2.250 1.041 18.908 438 HD21 ASN 50 1HD2 ASN 50 4.081 2.276 21.610 439 HD22 ASN 50 2HD2 ASN 50 5.638 1.801 21.029 440 H PHE 51 H PHE 51 4.507 4.100 18.349 441 HA PHE 51 HA PHE 51 3.956 4.715 15.606 442 HB2 PHE 51 2HB PHE 51 5.669 5.793 17.373 443 HB3 PHE 51 3HB PHE 51 6.773 4.596 16.723 444 HD1 PHE 51 HD1 PHE 51 7.183 4.630 14.135 445 HD2 PHE 51 HD2 PHE 51 5.347 7.857 16.279 446 HE1 PHE 51 HE1 PHE 51 7.731 6.175 12.304 447 HE2 PHE 51 HE2 PHE 51 5.895 9.383 14.439 448 HZ PHE 51 HZ PHE 51 7.085 8.550 12.449 449 H GLU 52 H GLU 52 3.246 2.618 14.908 450 HA GLU 52 HA GLU 52 5.379 0.605 14.481 451 HB2 GLU 52 2HB GLU 52 3.583 -0.140 16.065 452 HB3 GLU 52 3HB GLU 52 2.389 0.084 14.792 453 HG2 GLU 52 2HG GLU 52 3.004 -2.292 15.050 454 HG3 GLU 52 3HG GLU 52 3.422 -1.687 13.449 455 H LYS 53 H LYS 53 5.581 -0.295 12.536 456 HA LYS 53 HA LYS 53 4.441 1.114 10.231 457 HB2 LYS 53 2HB LYS 53 6.761 -0.847 10.453 458 HB3 LYS 53 3HB LYS 53 6.334 0.095 9.024 459 HG2 LYS 53 2HG LYS 53 6.914 2.167 10.106 460 HG3 LYS 53 3HG LYS 53 7.085 1.376 11.674 461 HD2 LYS 53 2HD LYS 53 8.879 0.994 9.255 462 HD3 LYS 53 3HD LYS 53 9.274 1.896 10.718 463 HE2 LYS 53 2HE LYS 53 8.840 -1.106 10.479 464 HE3 LYS 53 3HE LYS 53 10.356 -0.273 10.828 465 HZ1 LYS 53 3HZ LYS 53 9.232 0.569 12.888 466 HZ2 LYS 53 1HZ LYS 53 9.534 -1.091 12.859 467 HZ3 LYS 53 2HZ LYS 53 7.975 -0.511 12.578 468 H ILE 54 H ILE 54 2.494 0.228 9.805 469 HA ILE 54 HA ILE 54 2.139 -2.701 9.658 470 HB ILE 54 HB ILE 54 0.052 -0.481 9.822 471 HG12 ILE 54 2HG1 ILE 54 1.247 -0.744 11.968 472 HG13 ILE 54 3HG1 ILE 54 -0.416 -1.298 12.117 473 HG21 ILE 54 1HG2 ILE 54 -0.344 -3.489 9.800 474 HG22 ILE 54 2HG2 ILE 54 -0.831 -2.355 8.542 475 HG23 ILE 54 3HG2 ILE 54 -1.613 -2.305 10.121 476 HD11 ILE 54 3HD1 ILE 54 1.111 -2.739 13.305 477 HD12 ILE 54 1HD1 ILE 54 2.024 -3.048 11.830 478 HD13 ILE 54 2HD1 ILE 54 0.358 -3.618 11.978 479 H LEU 55 H LEU 55 1.992 -3.554 7.688 480 HA LEU 55 HA LEU 55 1.548 -1.875 5.312 481 HB2 LEU 55 2HB LEU 55 3.624 -3.332 5.596 482 HB3 LEU 55 3HB LEU 55 2.586 -4.733 5.434 483 HG LEU 55 HG LEU 55 2.644 -2.633 3.242 484 HD11 LEU 55 1HD1 LEU 55 4.980 -3.166 3.659 485 HD12 LEU 55 2HD1 LEU 55 4.452 -3.821 2.112 486 HD13 LEU 55 3HD1 LEU 55 4.638 -4.891 3.506 487 HD21 LEU 55 3HD2 LEU 55 2.097 -4.515 1.763 488 HD22 LEU 55 1HD2 LEU 55 0.919 -4.378 3.067 489 HD23 LEU 55 2HD2 LEU 55 2.160 -5.631 3.132 490 H ILE 56 H ILE 56 -0.370 -2.008 4.297 491 HA ILE 56 HA ILE 56 -2.207 -4.273 4.802 492 HB ILE 56 HB ILE 56 -2.954 -1.508 3.740 493 HG12 ILE 56 2HG1 ILE 56 -2.152 -1.308 6.107 494 HG13 ILE 56 3HG1 ILE 56 -3.856 -0.903 5.938 495 HG21 ILE 56 1HG2 ILE 56 -4.522 -3.265 3.067 496 HG22 ILE 56 2HG2 ILE 56 -5.288 -2.192 4.239 497 HG23 ILE 56 3HG2 ILE 56 -4.707 -3.781 4.746 498 HD11 ILE 56 3HD1 ILE 56 -3.428 -2.163 7.950 499 HD12 ILE 56 1HD1 ILE 56 -2.742 -3.491 7.017 500 HD13 ILE 56 2HD1 ILE 56 -4.457 -3.090 6.859 501 H ILE 57 H ILE 57 -2.244 -5.662 3.110 502 HA ILE 57 HA ILE 57 -1.808 -4.770 0.338 503 HB ILE 57 HB ILE 57 -2.106 -7.585 1.500 504 HG12 ILE 57 2HG1 ILE 57 0.342 -6.110 0.417 505 HG13 ILE 57 3HG1 ILE 57 0.032 -6.514 2.100 506 HG21 ILE 57 1HG2 ILE 57 -1.494 -8.442 -0.743 507 HG22 ILE 57 2HG2 ILE 57 -1.518 -6.797 -1.382 508 HG23 ILE 57 3HG2 ILE 57 -3.008 -7.537 -0.791 509 HD11 ILE 57 3HD1 ILE 57 0.208 -8.906 1.526 510 HD12 ILE 57 1HD1 ILE 57 1.677 -7.993 1.182 511 HD13 ILE 57 2HD1 ILE 57 0.603 -8.456 -0.137 512 H SER 58 H SER 58 -3.501 -4.407 -0.985 513 HA SER 58 HA SER 58 -6.076 -5.776 -0.583 514 HB2 SER 58 2HB SER 58 -6.335 -3.546 0.502 515 HB3 SER 58 3HB SER 58 -5.838 -2.748 -0.988 516 HG SER 58 HG SER 58 -7.822 -2.914 -1.640 517 H ASN 59 H ASN 59 -6.633 -6.695 -2.433 518 HA ASN 59 HA ASN 59 -5.296 -6.131 -4.949 519 HB2 ASN 59 2HB ASN 59 -7.430 -8.146 -4.139 520 HB3 ASN 59 3HB ASN 59 -6.837 -8.009 -5.791 521 HD21 ASN 59 1HD2 ASN 59 -4.659 -8.528 -6.235 522 HD22 ASN 59 2HD2 ASN 59 -3.768 -9.557 -5.179 523 H ASP 60 H ASP 60 -8.175 -5.135 -3.396 524 HA ASP 60 HA ASP 60 -9.547 -4.384 -5.890 525 HB2 ASP 60 2HB ASP 60 -10.511 -4.498 -2.990 526 HB3 ASP 60 3HB ASP 60 -11.458 -3.785 -4.294 527 H LYS 61 H LYS 61 -9.077 -2.434 -6.581 528 HA LYS 61 HA LYS 61 -7.822 -0.410 -5.005 529 HB2 LYS 61 2HB LYS 61 -8.043 0.984 -7.061 530 HB3 LYS 61 3HB LYS 61 -7.291 -0.583 -7.342 531 HG2 LYS 61 2HG LYS 61 -9.706 -1.343 -8.032 532 HG3 LYS 61 3HG LYS 61 -10.022 0.390 -8.190 533 HD2 LYS 61 2HD LYS 61 -8.193 0.593 -9.829 534 HD3 LYS 61 3HD LYS 61 -7.782 -1.112 -9.614 535 HE2 LYS 61 2HE LYS 61 -10.147 -1.644 -10.422 536 HE3 LYS 61 3HE LYS 61 -10.273 0.056 -10.888 537 HZ1 LYS 61 3HZ LYS 61 -8.218 -1.856 -11.859 538 HZ2 LYS 61 1HZ LYS 61 -8.371 -0.240 -12.326 539 HZ3 LYS 61 2HZ LYS 61 -9.580 -1.350 -12.726 540 H GLN 62 H GLN 62 -11.106 -1.309 -5.521 541 HA GLN 62 HA GLN 62 -12.462 1.042 -4.726 542 HB2 GLN 62 2HB GLN 62 -13.656 -0.925 -5.645 543 HB3 GLN 62 3HB GLN 62 -13.188 -1.890 -4.247 544 HG2 GLN 62 2HG GLN 62 -14.537 -0.376 -2.786 545 HG3 GLN 62 3HG GLN 62 -15.033 0.527 -4.213 546 HE21 GLN 62 1HE2 GLN 62 -16.514 -0.425 -5.661 547 HE22 GLN 62 2HE2 GLN 62 -17.442 -1.814 -5.234 548 H LEU 63 H LEU 63 -11.374 -1.798 -2.844 549 HA LEU 63 HA LEU 63 -11.988 -0.757 -0.270 550 HB2 LEU 63 2HB LEU 63 -10.086 -3.000 -1.071 551 HB3 LEU 63 3HB LEU 63 -10.601 -2.669 0.580 552 HG LEU 63 HG LEU 63 -12.360 -3.641 -1.709 553 HD11 LEU 63 1HD1 LEU 63 -10.933 -5.387 -0.774 554 HD12 LEU 63 2HD1 LEU 63 -12.621 -5.674 -0.364 555 HD13 LEU 63 3HD1 LEU 63 -11.518 -5.027 0.855 556 HD21 LEU 63 3HD2 LEU 63 -13.642 -2.085 -0.335 557 HD22 LEU 63 1HD2 LEU 63 -13.177 -2.948 1.136 558 HD23 LEU 63 2HD2 LEU 63 -14.201 -3.733 -0.073 559 H LEU 64 H LEU 64 -9.191 -0.550 -2.343 560 HA LEU 64 HA LEU 64 -7.275 0.463 -0.551 561 HB2 LEU 64 2HB LEU 64 -6.670 -0.372 -2.716 562 HB3 LEU 64 3HB LEU 64 -7.707 0.770 -3.530 563 HG LEU 64 HG LEU 64 -5.339 1.828 -1.969 564 HD11 LEU 64 1HD1 LEU 64 -4.416 0.009 -3.335 565 HD12 LEU 64 2HD1 LEU 64 -3.892 1.585 -3.922 566 HD13 LEU 64 3HD1 LEU 64 -5.160 0.703 -4.779 567 HD21 LEU 64 3HD2 LEU 64 -6.689 2.771 -4.529 568 HD22 LEU 64 1HD2 LEU 64 -5.345 3.574 -3.709 569 HD23 LEU 64 2HD2 LEU 64 -6.916 3.465 -2.924 570 H LYS 65 H LYS 65 -9.650 2.162 -2.653 571 HA LYS 65 HA LYS 65 -9.060 4.799 -1.866 572 HB2 LYS 65 2HB LYS 65 -11.631 3.566 -2.919 573 HB3 LYS 65 3HB LYS 65 -11.442 5.299 -2.653 574 HG2 LYS 65 2HG LYS 65 -9.640 5.399 -4.307 575 HG3 LYS 65 3HG LYS 65 -9.719 3.648 -4.536 576 HD2 LYS 65 2HD LYS 65 -10.902 4.814 -6.355 577 HD3 LYS 65 3HD LYS 65 -12.024 3.843 -5.398 578 HE2 LYS 65 2HE LYS 65 -12.646 5.967 -4.147 579 HE3 LYS 65 3HE LYS 65 -11.662 6.861 -5.308 580 HZ1 LYS 65 3HZ LYS 65 -13.972 6.891 -5.941 581 HZ2 LYS 65 1HZ LYS 65 -14.039 5.206 -5.935 582 HZ3 LYS 65 2HZ LYS 65 -13.093 6.005 -7.078 583 H GLU 66 H GLU 66 -11.539 2.541 -0.594 584 HA GLU 66 HA GLU 66 -12.728 4.188 1.329 585 HB2 GLU 66 2HB GLU 66 -12.282 1.185 1.602 586 HB3 GLU 66 3HB GLU 66 -13.511 2.139 2.429 587 HG2 GLU 66 2HG GLU 66 -13.365 1.488 -0.527 588 HG3 GLU 66 3HG GLU 66 -14.505 0.834 0.645 589 H MET 67 H MET 67 -9.989 1.974 1.575 590 HA MET 67 HA MET 67 -9.319 2.097 4.260 591 HB2 MET 67 2HB MET 67 -8.367 0.558 2.460 592 HB3 MET 67 3HB MET 67 -7.341 1.887 1.946 593 HG2 MET 67 2HG MET 67 -5.978 0.525 3.309 594 HG3 MET 67 3HG MET 67 -6.411 1.890 4.337 595 HE1 MET 67 3HE MET 67 -8.695 -1.238 3.354 596 HE2 MET 67 1HE MET 67 -8.319 -2.317 4.694 597 HE3 MET 67 2HE MET 67 -7.072 -1.911 3.514 598 H LEU 68 H LEU 68 -8.064 4.075 1.557 599 HA LEU 68 HA LEU 68 -6.196 5.612 3.010 600 HB2 LEU 68 2HB LEU 68 -7.635 6.208 0.401 601 HB3 LEU 68 3HB LEU 68 -6.289 7.164 1.015 602 HG LEU 68 HG LEU 68 -6.086 4.204 0.336 603 HD11 LEU 68 1HD1 LEU 68 -4.918 4.899 -1.703 604 HD12 LEU 68 2HD1 LEU 68 -5.289 6.588 -1.342 605 HD13 LEU 68 3HD1 LEU 68 -6.593 5.446 -1.678 606 HD21 LEU 68 3HD2 LEU 68 -3.919 6.259 0.925 607 HD22 LEU 68 1HD2 LEU 68 -3.652 4.584 0.428 608 HD23 LEU 68 2HD2 LEU 68 -4.413 4.927 1.977 609 H GLU 69 H GLU 69 -9.588 6.259 2.132 610 HA GLU 69 HA GLU 69 -9.712 8.919 3.123 611 HB2 GLU 69 2HB GLU 69 -11.921 6.878 2.643 612 HB3 GLU 69 3HB GLU 69 -12.204 8.584 3.005 613 HG2 GLU 69 2HG GLU 69 -11.034 9.241 0.948 614 HG3 GLU 69 3HG GLU 69 -10.676 7.551 0.591 615 H LEU 70 H LEU 70 -10.264 5.763 4.652 616 HA LEU 70 HA LEU 70 -11.098 6.739 7.198 617 HB2 LEU 70 2HB LEU 70 -9.744 4.133 6.410 618 HB3 LEU 70 3HB LEU 70 -10.344 4.460 8.032 619 HG LEU 70 HG LEU 70 -12.062 4.330 5.518 620 HD11 LEU 70 1HD1 LEU 70 -12.944 2.238 6.431 621 HD12 LEU 70 2HD1 LEU 70 -11.809 2.331 7.782 622 HD13 LEU 70 3HD1 LEU 70 -11.210 2.128 6.133 623 HD21 LEU 70 3HD2 LEU 70 -12.880 4.689 8.423 624 HD22 LEU 70 1HD2 LEU 70 -13.980 4.446 7.063 625 HD23 LEU 70 2HD2 LEU 70 -12.995 5.900 7.142 626 H ILE 71 H ILE 71 -7.884 6.006 5.812 627 HA ILE 71 HA ILE 71 -6.368 6.380 8.204 628 HB ILE 71 HB ILE 71 -5.342 6.721 5.341 629 HG12 ILE 71 2HG1 ILE 71 -5.234 4.189 7.048 630 HG13 ILE 71 3HG1 ILE 71 -6.406 4.460 5.771 631 HG21 ILE 71 1HG2 ILE 71 -3.872 6.209 7.960 632 HG22 ILE 71 2HG2 ILE 71 -3.791 7.666 6.969 633 HG23 ILE 71 3HG2 ILE 71 -3.121 6.155 6.369 634 HD11 ILE 71 3HD1 ILE 71 -4.610 3.033 5.014 635 HD12 ILE 71 1HD1 ILE 71 -3.417 4.271 5.407 636 HD13 ILE 71 2HD1 ILE 71 -4.596 4.553 4.122 637 H SER 72 H SER 72 -7.523 8.554 5.685 638 HA SER 72 HA SER 72 -5.979 10.837 6.150 639 HB2 SER 72 2HB SER 72 -7.455 10.566 4.174 640 HB3 SER 72 3HB SER 72 -8.879 10.643 5.212 641 HG SER 72 HG SER 72 -7.156 12.673 4.376 642 H LYS 73 H LYS 73 -8.949 9.674 7.648 643 HA LYS 73 HA LYS 73 -9.424 11.937 9.335 644 HB2 LYS 73 2HB LYS 73 -10.496 9.083 9.457 645 HB3 LYS 73 3HB LYS 73 -11.164 10.460 10.338 646 HG2 LYS 73 2HG LYS 73 -11.821 11.538 8.252 647 HG3 LYS 73 3HG LYS 73 -11.021 10.279 7.304 648 HD2 LYS 73 2HD LYS 73 -12.624 8.608 8.173 649 HD3 LYS 73 3HD LYS 73 -13.419 9.858 9.137 650 HE2 LYS 73 2HE LYS 73 -14.677 9.388 7.072 651 HE3 LYS 73 3HE LYS 73 -14.068 11.042 7.075 652 HZ1 LYS 73 3HZ LYS 73 -12.887 8.745 5.609 653 HZ2 LYS 73 1HZ LYS 73 -12.245 10.307 5.637 654 HZ3 LYS 73 2HZ LYS 73 -13.751 10.026 4.931 655 H LEU 74 H LEU 74 -7.574 8.978 9.609 656 HA LEU 74 HA LEU 74 -7.180 9.099 12.482 657 HB2 LEU 74 2HB LEU 74 -5.819 7.408 10.345 658 HB3 LEU 74 3HB LEU 74 -5.615 7.195 12.077 659 HG LEU 74 HG LEU 74 -8.186 6.738 10.508 660 HD11 LEU 74 1HD1 LEU 74 -6.519 4.997 10.120 661 HD12 LEU 74 2HD1 LEU 74 -7.873 4.371 11.057 662 HD13 LEU 74 3HD1 LEU 74 -6.342 4.741 11.860 663 HD21 LEU 74 3HD2 LEU 74 -9.154 5.899 12.604 664 HD22 LEU 74 1HD2 LEU 74 -8.714 7.600 12.742 665 HD23 LEU 74 2HD2 LEU 74 -7.696 6.363 13.486 666 H GLY 75 H GLY 75 -5.470 10.188 9.613 667 HA2 GLY 75 2HA GLY 75 -3.704 11.596 9.298 668 HA3 GLY 75 3HA GLY 75 -3.728 11.947 11.018 669 H TYR 76 H TYR 76 -2.935 9.177 8.899 670 HA TYR 76 HA TYR 76 -0.322 8.875 10.307 671 HB2 TYR 76 2HB TYR 76 -2.019 6.626 9.124 672 HB3 TYR 76 3HB TYR 76 -0.424 6.427 9.842 673 HD1 TYR 76 HD1 TYR 76 -0.748 8.225 12.286 674 HD2 TYR 76 HD2 TYR 76 -3.355 5.281 10.595 675 HE1 TYR 76 HE1 TYR 76 -1.762 7.857 14.487 676 HE2 TYR 76 HE2 TYR 76 -4.374 4.919 12.803 677 HH TYR 76 HH TYR 76 -3.928 7.020 15.405 678 H LYS 77 H LYS 77 1.484 8.258 9.050 679 HA LYS 77 HA LYS 77 1.499 9.423 6.405 680 HB2 LYS 77 2HB LYS 77 3.367 9.885 7.921 681 HB3 LYS 77 3HB LYS 77 3.723 8.168 8.068 682 HG2 LYS 77 2HG LYS 77 5.330 9.289 6.583 683 HG3 LYS 77 3HG LYS 77 4.395 8.068 5.712 684 HD2 LYS 77 2HD LYS 77 2.918 9.901 4.822 685 HD3 LYS 77 3HD LYS 77 3.951 11.088 5.628 686 HE2 LYS 77 2HE LYS 77 5.856 10.370 4.247 687 HE3 LYS 77 3HE LYS 77 4.847 9.144 3.474 688 HZ1 LYS 77 3HZ LYS 77 3.461 10.893 2.579 689 HZ2 LYS 77 1HZ LYS 77 5.068 11.125 2.114 690 HZ3 LYS 77 2HZ LYS 77 4.393 12.070 3.339 691 H VAL 78 H VAL 78 0.973 8.306 4.652 692 HA VAL 78 HA VAL 78 1.262 5.373 4.566 693 HB VAL 78 HB VAL 78 -0.549 7.112 2.836 694 HG11 VAL 78 1HG1 VAL 78 -0.442 4.078 3.136 695 HG12 VAL 78 2HG1 VAL 78 0.058 4.996 1.713 696 HG13 VAL 78 3HG1 VAL 78 -1.639 4.973 2.193 697 HG21 VAL 78 3HG2 VAL 78 -2.404 6.266 4.216 698 HG22 VAL 78 1HG2 VAL 78 -1.247 7.178 5.190 699 HG23 VAL 78 2HG2 VAL 78 -1.255 5.412 5.250 700 H PHE 79 H PHE 79 2.569 4.450 3.131 701 HA PHE 79 HA PHE 79 3.511 5.962 0.759 702 HB2 PHE 79 2HB PHE 79 4.795 3.620 2.230 703 HB3 PHE 79 3HB PHE 79 5.396 4.305 0.732 704 HD1 PHE 79 HD2 PHE 79 4.948 4.957 4.372 705 HD2 PHE 79 HD1 PHE 79 6.721 6.342 0.728 706 HE1 PHE 79 HE2 PHE 79 6.346 6.527 5.639 707 HE2 PHE 79 HE1 PHE 79 8.118 7.907 2.012 708 HZ PHE 79 HZ PHE 79 7.933 8.001 4.465 709 H LEU 80 H LEU 80 2.501 5.291 -1.026 710 HA LEU 80 HA LEU 80 1.041 2.734 -1.088 711 HB2 LEU 80 2HB LEU 80 -0.472 4.609 -1.080 712 HB3 LEU 80 3HB LEU 80 0.428 5.425 -2.345 713 HG LEU 80 HG LEU 80 -0.313 3.726 -4.004 714 HD11 LEU 80 1HD1 LEU 80 -1.937 2.486 -1.767 715 HD12 LEU 80 2HD1 LEU 80 -0.539 1.767 -2.573 716 HD13 LEU 80 3HD1 LEU 80 -2.020 2.057 -3.480 717 HD21 LEU 80 3HD2 LEU 80 -2.670 4.362 -4.139 718 HD22 LEU 80 1HD2 LEU 80 -1.651 5.738 -3.724 719 HD23 LEU 80 2HD2 LEU 80 -2.620 4.954 -2.475 720 H LEU 81 H LEU 81 1.616 1.278 -2.560 721 HA LEU 81 HA LEU 81 3.038 2.095 -5.022 722 HB2 LEU 81 2HB LEU 81 4.315 0.536 -3.529 723 HB3 LEU 81 3HB LEU 81 3.024 -0.642 -3.676 724 HG LEU 81 HG LEU 81 3.468 -0.858 -6.112 725 HD11 LEU 81 1HD1 LEU 81 5.469 0.207 -7.119 726 HD12 LEU 81 2HD1 LEU 81 5.675 1.167 -5.653 727 HD13 LEU 81 3HD1 LEU 81 4.229 1.365 -6.645 728 HD21 LEU 81 3HD2 LEU 81 5.985 -1.225 -4.453 729 HD22 LEU 81 1HD2 LEU 81 5.625 -2.013 -5.995 730 HD23 LEU 81 2HD2 LEU 81 4.642 -2.367 -4.575 731 H LEU 82 H LEU 82 1.799 2.034 -6.784 732 HA LEU 82 HA LEU 82 -0.419 0.088 -7.047 733 HB2 LEU 82 2HB LEU 82 0.129 2.682 -8.558 734 HB3 LEU 82 3HB LEU 82 -1.214 1.599 -8.887 735 HG LEU 82 HG LEU 82 -0.811 3.207 -6.327 736 HD11 LEU 82 1HD1 LEU 82 -1.437 4.621 -8.227 737 HD12 LEU 82 2HD1 LEU 82 -2.743 4.519 -7.050 738 HD13 LEU 82 3HD1 LEU 82 -2.839 3.594 -8.554 739 HD21 LEU 82 3HD2 LEU 82 -3.115 1.389 -7.113 740 HD22 LEU 82 1HD2 LEU 82 -3.052 2.427 -5.684 741 HD23 LEU 82 2HD2 LEU 82 -1.926 1.085 -5.843 742 H GLN 83 H GLN 83 0.154 -1.680 -8.219 743 HA GLN 83 HA GLN 83 2.098 -1.411 -10.437 744 HB2 GLN 83 2HB GLN 83 2.708 -3.070 -8.641 745 HB3 GLN 83 3HB GLN 83 1.253 -3.983 -9.034 746 HG2 GLN 83 2HG GLN 83 2.093 -4.404 -11.307 747 HG3 GLN 83 3HG GLN 83 3.519 -3.412 -10.991 748 HE21 GLN 83 1HE2 GLN 83 3.487 -6.161 -11.831 749 HE22 GLN 83 2HE2 GLN 83 4.294 -7.062 -10.601 750 H ASP 84 H ASP 84 1.102 -1.163 -12.309 751 HA ASP 84 HA ASP 84 -1.020 -3.004 -13.126 752 HB2 ASP 84 2HB ASP 84 -2.165 -0.944 -12.215 753 HB3 ASP 84 3HB ASP 84 -1.312 0.029 -13.404 754 H GLN 85 H GLN 85 -0.954 -3.439 -15.286 755 HA GLN 85 HA GLN 85 1.555 -2.959 -16.605 756 HB2 GLN 85 2HB GLN 85 0.816 -4.602 -18.251 757 HB3 GLN 85 3HB GLN 85 0.491 -5.202 -16.633 758 HG2 GLN 85 2HG GLN 85 -1.618 -3.933 -18.411 759 HG3 GLN 85 3HG GLN 85 -1.304 -5.665 -18.343 760 HE21 GLN 85 1HE2 GLN 85 -3.699 -4.020 -17.620 761 HE22 GLN 85 2HE2 GLN 85 -4.096 -4.490 -16.007 762 H ASP 86 H ASP 86 -1.579 -1.505 -16.773 763 HA ASP 86 HA ASP 86 -0.980 -0.242 -19.392 764 HB2 ASP 86 2HB ASP 86 -3.650 -0.669 -17.973 765 HB3 ASP 86 3HB ASP 86 -3.468 0.364 -19.386 766 H GLU 87 H GLU 87 0.356 1.355 -18.704 767 HA GLU 87 HA GLU 87 0.123 2.905 -16.376 768 HB2 GLU 87 2HB GLU 87 1.606 3.489 -18.955 769 HB3 GLU 87 3HB GLU 87 1.834 4.376 -17.447 770 HG2 GLU 87 2HG GLU 87 2.677 2.371 -16.341 771 HG3 GLU 87 3HG GLU 87 2.347 1.398 -17.776 772 H ASN 88 H ASN 88 -1.723 3.124 -19.227 773 HA ASN 88 HA ASN 88 -2.262 5.878 -19.464 774 HB2 ASN 88 2HB ASN 88 -4.032 3.465 -20.079 775 HB3 ASN 88 3HB ASN 88 -4.417 5.116 -20.558 776 HD21 ASN 88 1HD2 ASN 88 -4.455 4.449 -22.727 777 HD22 ASN 88 2HD2 ASN 88 -3.003 4.161 -23.618 778 H GLU 89 H GLU 89 -4.263 3.371 -17.832 779 HA GLU 89 HA GLU 89 -5.877 5.347 -16.456 780 HB2 GLU 89 2HB GLU 89 -7.055 3.415 -15.473 781 HB3 GLU 89 3HB GLU 89 -6.921 3.268 -17.222 782 HG2 GLU 89 2HG GLU 89 -5.098 1.649 -16.986 783 HG3 GLU 89 3HG GLU 89 -5.120 1.843 -15.233 784 H LEU 90 H LEU 90 -3.161 3.256 -15.715 785 HA LEU 90 HA LEU 90 -3.038 3.492 -12.918 786 HB2 LEU 90 2HB LEU 90 -1.707 1.844 -14.031 787 HB3 LEU 90 3HB LEU 90 -0.958 3.040 -15.061 788 HG LEU 90 HG LEU 90 0.361 3.907 -13.157 789 HD11 LEU 90 1HD1 LEU 90 -0.938 1.729 -11.499 790 HD12 LEU 90 2HD1 LEU 90 -1.150 3.475 -11.313 791 HD13 LEU 90 3HD1 LEU 90 0.421 2.746 -10.998 792 HD21 LEU 90 3HD2 LEU 90 1.315 2.142 -14.566 793 HD22 LEU 90 1HD2 LEU 90 0.643 0.904 -13.497 794 HD23 LEU 90 2HD2 LEU 90 1.886 2.012 -12.904 795 H GLU 91 H GLU 91 -1.888 5.684 -15.496 796 HA GLU 91 HA GLU 91 -0.457 7.536 -13.902 797 HB2 GLU 91 2HB GLU 91 -0.269 7.567 -16.349 798 HB3 GLU 91 3HB GLU 91 -1.982 7.944 -16.511 799 HG2 GLU 91 2HG GLU 91 -1.588 10.141 -15.407 800 HG3 GLU 91 3HG GLU 91 0.132 9.766 -15.302 801 H GLU 92 H GLU 92 -3.837 7.416 -14.958 802 HA GLU 92 HA GLU 92 -4.712 9.875 -13.904 803 HB2 GLU 92 2HB GLU 92 -6.322 7.348 -14.480 804 HB3 GLU 92 3HB GLU 92 -6.997 8.968 -14.266 805 HG2 GLU 92 2HG GLU 92 -5.755 9.737 -16.274 806 HG3 GLU 92 3HG GLU 92 -5.115 8.108 -16.494 807 H PHE 93 H PHE 93 -4.953 6.564 -12.617 808 HA PHE 93 HA PHE 93 -6.346 7.284 -10.225 809 HB2 PHE 93 2HB PHE 93 -6.486 5.042 -11.400 810 HB3 PHE 93 3HB PHE 93 -4.854 4.691 -10.845 811 HD1 PHE 93 HD1 PHE 93 -7.983 6.059 -9.243 812 HD2 PHE 93 HD2 PHE 93 -4.861 3.128 -9.081 813 HE1 PHE 93 HE1 PHE 93 -8.951 5.133 -7.183 814 HE2 PHE 93 HE2 PHE 93 -5.838 2.216 -7.020 815 HZ PHE 93 HZ PHE 93 -7.881 3.213 -6.072 816 H LYS 94 H LYS 94 -2.935 6.925 -11.074 817 HA LYS 94 HA LYS 94 -1.810 7.054 -8.482 818 HB2 LYS 94 2HB LYS 94 -0.537 6.379 -10.494 819 HB3 LYS 94 3HB LYS 94 -0.685 7.992 -11.160 820 HG2 LYS 94 2HG LYS 94 0.756 7.528 -8.539 821 HG3 LYS 94 3HG LYS 94 1.572 7.231 -10.070 822 HD2 LYS 94 2HD LYS 94 0.384 9.893 -9.173 823 HD3 LYS 94 3HD LYS 94 2.098 9.468 -9.158 824 HE2 LYS 94 2HE LYS 94 0.379 9.574 -11.666 825 HE3 LYS 94 3HE LYS 94 1.429 10.881 -11.111 826 HZ1 LYS 94 3HZ LYS 94 2.312 8.155 -11.897 827 HZ2 LYS 94 1HZ LYS 94 3.323 9.382 -11.323 828 HZ3 LYS 94 2HZ LYS 94 2.516 9.570 -12.796 829 H ARG 95 H ARG 95 -2.411 9.626 -10.907 830 HA ARG 95 HA ARG 95 -1.647 11.832 -9.299 831 HB2 ARG 95 2HB ARG 95 -3.488 11.721 -11.730 832 HB3 ARG 95 3HB ARG 95 -2.893 13.218 -11.010 833 HG2 ARG 95 2HG ARG 95 -0.562 12.508 -11.532 834 HG3 ARG 95 3HG ARG 95 -1.200 11.056 -12.311 835 HD2 ARG 95 2HD ARG 95 -1.686 13.933 -13.166 836 HD3 ARG 95 3HD ARG 95 -0.659 12.751 -13.985 837 HE ARG 95 HE ARG 95 -3.289 11.736 -13.799 838 HH11 ARG 95 1HH1 ARG 95 -1.499 14.230 -15.530 839 HH12 ARG 95 2HH1 ARG 95 -2.568 14.212 -16.892 840 HH21 ARG 95 1HH2 ARG 95 -4.704 11.758 -15.575 841 HH22 ARG 95 2HH2 ARG 95 -4.388 12.805 -16.918 842 H LYS 96 H LYS 96 -4.648 10.087 -9.619 843 HA LYS 96 HA LYS 96 -6.537 11.729 -8.429 844 HB2 LYS 96 2HB LYS 96 -7.083 9.583 -9.501 845 HB3 LYS 96 3HB LYS 96 -6.175 8.709 -8.287 846 HG2 LYS 96 2HG LYS 96 -8.406 8.324 -7.706 847 HG3 LYS 96 3HG LYS 96 -7.894 9.578 -6.578 848 HD2 LYS 96 2HD LYS 96 -9.339 10.250 -9.166 849 HD3 LYS 96 3HD LYS 96 -10.225 9.797 -7.714 850 HE2 LYS 96 2HE LYS 96 -9.188 11.717 -6.512 851 HE3 LYS 96 3HE LYS 96 -8.374 12.188 -8.006 852 HZ1 LYS 96 3HZ LYS 96 -11.311 12.012 -7.640 853 HZ2 LYS 96 1HZ LYS 96 -10.510 12.504 -9.045 854 HZ3 LYS 96 2HZ LYS 96 -10.406 13.438 -7.642 855 H ILE 97 H ILE 97 -4.497 9.285 -6.902 856 HA ILE 97 HA ILE 97 -5.359 9.950 -4.222 857 HB ILE 97 HB ILE 97 -3.254 7.961 -5.178 858 HG12 ILE 97 2HG1 ILE 97 -6.184 7.373 -4.519 859 HG13 ILE 97 3HG1 ILE 97 -5.602 7.640 -6.158 860 HG21 ILE 97 1HG2 ILE 97 -4.745 8.160 -2.536 861 HG22 ILE 97 2HG2 ILE 97 -3.028 8.471 -2.800 862 HG23 ILE 97 3HG2 ILE 97 -3.668 6.841 -2.997 863 HD11 ILE 97 3HD1 ILE 97 -5.829 5.290 -5.682 864 HD12 ILE 97 1HD1 ILE 97 -4.721 5.423 -4.319 865 HD13 ILE 97 2HD1 ILE 97 -4.140 5.701 -5.965 866 H GLU 98 H GLU 98 -2.695 10.704 -6.310 867 HA GLU 98 HA GLU 98 -0.829 11.605 -4.327 868 HB2 GLU 98 2HB GLU 98 -0.201 10.823 -6.628 869 HB3 GLU 98 3HB GLU 98 -0.981 12.238 -7.314 870 HG2 GLU 98 2HG GLU 98 1.239 12.627 -5.310 871 HG3 GLU 98 3HG GLU 98 1.657 12.124 -6.944 872 H SER 99 H SER 99 -3.518 13.019 -6.138 873 HA SER 99 HA SER 99 -3.172 15.728 -5.255 874 HB2 SER 99 2HB SER 99 -4.519 15.172 -7.271 875 HB3 SER 99 3HB SER 99 -5.685 14.310 -6.267 876 HG SER 99 HG SER 99 -5.092 16.992 -5.661 877 H GLN 100 H GLN 100 -4.699 12.834 -3.959 878 HA GLN 100 HA GLN 100 -6.057 14.111 -1.755 879 HB2 GLN 100 2HB GLN 100 -5.320 11.173 -2.145 880 HB3 GLN 100 3HB GLN 100 -6.462 11.798 -0.955 881 HG2 GLN 100 2HG GLN 100 -7.987 12.491 -2.726 882 HG3 GLN 100 3HG GLN 100 -6.819 12.027 -3.961 883 HE21 GLN 100 1HE2 GLN 100 -7.642 10.163 -1.042 884 HE22 GLN 100 2HE2 GLN 100 -8.335 8.828 -1.889 885 H GLY 101 H GLY 101 -2.819 13.825 -2.318 886 HA2 GLY 101 2HA GLY 101 -1.126 14.610 -0.968 887 HA3 GLY 101 3HA GLY 101 -2.202 14.552 0.419 888 H TYR 102 H TYR 102 -1.430 11.884 -1.760 889 HA TYR 102 HA TYR 102 -0.042 10.491 0.473 890 HB2 TYR 102 2HB TYR 102 -1.845 9.300 -1.676 891 HB3 TYR 102 3HB TYR 102 -0.843 8.330 -0.596 892 HD1 TYR 102 HD1 TYR 102 -1.175 8.720 1.969 893 HD2 TYR 102 HD2 TYR 102 -4.057 9.876 -0.967 894 HE1 TYR 102 HE1 TYR 102 -2.903 8.824 3.706 895 HE2 TYR 102 HE2 TYR 102 -5.790 9.977 0.775 896 HH TYR 102 HH TYR 102 -6.195 9.036 3.033 897 H GLU 103 H GLU 103 1.764 9.301 0.058 898 HA GLU 103 HA GLU 103 3.414 10.030 -2.180 899 HB2 GLU 103 2HB GLU 103 4.328 9.660 0.117 900 HB3 GLU 103 3HB GLU 103 3.834 7.975 0.046 901 HG2 GLU 103 2HG GLU 103 6.210 8.102 -0.345 902 HG3 GLU 103 3HG GLU 103 5.422 7.614 -1.846 903 H VAL 104 H VAL 104 2.513 9.207 -4.096 904 HA VAL 104 HA VAL 104 1.782 6.327 -4.202 905 HB VAL 104 HB VAL 104 0.766 8.515 -6.077 906 HG11 VAL 104 1HG1 VAL 104 -0.973 6.848 -6.667 907 HG12 VAL 104 2HG1 VAL 104 -0.232 5.686 -5.563 908 HG13 VAL 104 3HG1 VAL 104 0.650 6.231 -6.991 909 HG21 VAL 104 3HG2 VAL 104 -1.340 8.523 -4.805 910 HG22 VAL 104 1HG2 VAL 104 0.010 9.034 -3.790 911 HG23 VAL 104 2HG2 VAL 104 -0.648 7.405 -3.627 912 H ARG 105 H ARG 105 3.280 5.161 -5.258 913 HA ARG 105 HA ARG 105 4.599 6.307 -7.661 914 HB2 ARG 105 2HB ARG 105 5.750 4.274 -5.691 915 HB3 ARG 105 3HB ARG 105 6.530 4.779 -7.192 916 HG2 ARG 105 2HG ARG 105 5.893 6.577 -4.822 917 HG3 ARG 105 3HG ARG 105 7.486 5.945 -5.244 918 HD2 ARG 105 2HD ARG 105 7.698 7.357 -7.108 919 HD3 ARG 105 3HD ARG 105 5.956 7.591 -7.267 920 HE ARG 105 HE ARG 105 6.767 8.673 -4.815 921 HH11 ARG 105 1HH1 ARG 105 7.182 9.362 -8.247 922 HH12 ARG 105 2HH1 ARG 105 7.355 11.069 -8.001 923 HH21 ARG 105 1HH2 ARG 105 6.929 10.902 -4.525 924 HH22 ARG 105 2HH2 ARG 105 7.209 11.941 -5.887 925 H LYS 106 H LYS 106 4.836 4.998 -9.412 926 HA LYS 106 HA LYS 106 2.946 2.718 -9.610 927 HB2 LYS 106 2HB LYS 106 2.855 3.386 -12.081 928 HB3 LYS 106 3HB LYS 106 2.109 4.504 -10.949 929 HG2 LYS 106 2HG LYS 106 4.006 6.018 -11.098 930 HG3 LYS 106 3HG LYS 106 4.897 4.871 -12.099 931 HD2 LYS 106 2HD LYS 106 2.250 6.126 -12.932 932 HD3 LYS 106 3HD LYS 106 3.827 6.808 -13.340 933 HE2 LYS 106 2HE LYS 106 2.901 4.021 -14.126 934 HE3 LYS 106 3HE LYS 106 2.872 5.440 -15.179 935 HZ1 LYS 106 3HZ LYS 106 5.335 4.372 -13.911 936 HZ2 LYS 106 1HZ LYS 106 5.240 5.584 -15.087 937 HZ3 LYS 106 2HZ LYS 106 4.837 3.990 -15.477 938 H VAL 107 H VAL 107 3.575 0.891 -10.671 939 HA VAL 107 HA VAL 107 6.230 0.648 -11.877 940 HB VAL 107 HB VAL 107 6.553 0.198 -9.419 941 HG11 VAL 107 1HG1 VAL 107 4.353 -0.766 -8.894 942 HG12 VAL 107 2HG1 VAL 107 5.659 -1.835 -8.375 943 HG13 VAL 107 3HG1 VAL 107 4.746 -2.204 -9.841 944 HG21 VAL 107 3HG2 VAL 107 7.014 -2.214 -11.210 945 HG22 VAL 107 1HG2 VAL 107 7.838 -1.893 -9.680 946 HG23 VAL 107 2HG2 VAL 107 8.075 -0.811 -11.051 947 H THR 108 H THR 108 6.419 -1.221 -13.192 948 HA THR 108 HA THR 108 3.914 -2.683 -13.820 949 HB THR 108 HB THR 108 4.973 -2.930 -16.164 950 HG1 THR 108 HG1 THR 108 7.116 -2.217 -15.414 951 HG21 THR 108 3HG2 THR 108 4.243 -0.119 -15.259 952 HG22 THR 108 1HG2 THR 108 3.108 -1.357 -15.803 953 HG23 THR 108 2HG2 THR 108 4.278 -0.673 -16.935 954 H ASP 109 H ASP 109 7.378 -2.905 -13.196 955 HA ASP 109 HA ASP 109 7.529 -5.751 -13.906 956 HB2 ASP 109 2HB ASP 109 9.659 -3.745 -13.044 957 HB3 ASP 109 3HB ASP 109 9.999 -5.451 -13.336 958 H ASP 110 H ASP 110 8.140 -7.361 -12.499 959 HA ASP 110 HA ASP 110 7.242 -7.218 -9.791 960 HB2 ASP 110 2HB ASP 110 8.021 -9.580 -9.645 961 HB3 ASP 110 3HB ASP 110 7.023 -9.294 -11.064 962 H GLU 111 H GLU 111 10.401 -7.171 -11.347 963 HA GLU 111 HA GLU 111 12.020 -7.585 -9.054 964 HB2 GLU 111 2HB GLU 111 12.724 -6.229 -11.697 965 HB3 GLU 111 3HB GLU 111 13.890 -6.799 -10.498 966 HG2 GLU 111 2HG GLU 111 13.100 -9.121 -10.851 967 HG3 GLU 111 3HG GLU 111 11.954 -8.542 -12.063 968 H GLU 112 H GLU 112 10.897 -4.696 -10.768 969 HA GLU 112 HA GLU 112 12.276 -2.837 -9.067 970 HB2 GLU 112 2HB GLU 112 11.764 -2.307 -11.446 971 HB3 GLU 112 3HB GLU 112 10.044 -2.296 -11.065 972 HG2 GLU 112 2HG GLU 112 10.357 -0.387 -9.553 973 HG3 GLU 112 3HG GLU 112 12.096 -0.426 -9.827 974 H ALA 113 H ALA 113 9.009 -4.222 -9.197 975 HA ALA 113 HA ALA 113 7.580 -2.530 -7.519 976 HB1 ALA 113 3HB ALA 113 6.111 -4.453 -7.060 977 HB2 ALA 113 1HB ALA 113 7.340 -5.554 -7.694 978 HB3 ALA 113 2HB ALA 113 6.556 -4.392 -8.766 979 H LEU 114 H LEU 114 9.545 -5.363 -6.642 980 HA LEU 114 HA LEU 114 9.270 -5.267 -3.846 981 HB2 LEU 114 2HB LEU 114 11.722 -6.180 -5.405 982 HB3 LEU 114 3HB LEU 114 11.345 -6.591 -3.735 983 HG LEU 114 HG LEU 114 9.829 -7.510 -6.208 984 HD11 LEU 114 1HD1 LEU 114 10.626 -9.745 -5.603 985 HD12 LEU 114 2HD1 LEU 114 11.546 -9.066 -4.257 986 HD13 LEU 114 3HD1 LEU 114 11.964 -8.643 -5.921 987 HD21 LEU 114 3HD2 LEU 114 9.242 -8.143 -3.295 988 HD22 LEU 114 1HD2 LEU 114 8.455 -8.876 -4.697 989 HD23 LEU 114 2HD2 LEU 114 8.248 -7.159 -4.373 990 H LYS 115 H LYS 115 11.578 -3.666 -6.024 991 HA LYS 115 HA LYS 115 13.278 -2.585 -4.016 992 HB2 LYS 115 2HB LYS 115 12.917 -1.733 -6.917 993 HB3 LYS 115 3HB LYS 115 14.222 -1.187 -5.861 994 HG2 LYS 115 2HG LYS 115 15.004 -3.544 -5.656 995 HG3 LYS 115 3HG LYS 115 13.733 -4.044 -6.778 996 HD2 LYS 115 2HD LYS 115 14.737 -2.523 -8.510 997 HD3 LYS 115 3HD LYS 115 16.045 -2.153 -7.382 998 HE2 LYS 115 2HE LYS 115 16.810 -3.829 -8.963 999 HE3 LYS 115 3HE LYS 115 16.656 -4.585 -7.377 1000 HZ1 LYS 115 3HZ LYS 115 14.535 -5.509 -8.065 1001 HZ2 LYS 115 1HZ LYS 115 15.762 -5.977 -9.129 1002 HZ3 LYS 115 2HZ LYS 115 14.675 -4.766 -9.576 1003 H ILE 116 H ILE 116 10.342 -1.331 -5.588 1004 HA ILE 116 HA ILE 116 10.671 1.364 -4.619 1005 HB ILE 116 HB ILE 116 8.118 0.057 -5.664 1006 HG12 ILE 116 2HG1 ILE 116 9.862 -0.040 -7.398 1007 HG13 ILE 116 3HG1 ILE 116 8.656 1.153 -7.849 1008 HG21 ILE 116 1HG2 ILE 116 8.827 3.004 -5.341 1009 HG22 ILE 116 2HG2 ILE 116 7.653 2.102 -4.381 1010 HG23 ILE 116 3HG2 ILE 116 7.353 2.383 -6.096 1011 HD11 ILE 116 3HD1 ILE 116 10.896 1.900 -8.377 1012 HD12 ILE 116 1HD1 ILE 116 11.390 1.735 -6.694 1013 HD13 ILE 116 2HD1 ILE 116 10.185 2.945 -7.150 1014 H VAL 117 H VAL 117 8.989 -1.566 -3.506 1015 HA VAL 117 HA VAL 117 7.805 -0.513 -1.160 1016 HB VAL 117 HB VAL 117 8.968 -3.320 -1.537 1017 HG11 VAL 117 1HG1 VAL 117 8.555 -2.816 0.848 1018 HG12 VAL 117 2HG1 VAL 117 7.409 -4.021 0.258 1019 HG13 VAL 117 3HG1 VAL 117 6.894 -2.345 0.474 1020 HG21 VAL 117 3HG2 VAL 117 7.301 -2.796 -3.265 1021 HG22 VAL 117 1HG2 VAL 117 6.132 -2.337 -2.027 1022 HG23 VAL 117 2HG2 VAL 117 6.680 -4.012 -2.150 1023 H ARG 118 H ARG 118 11.083 -1.719 -1.849 1024 HA ARG 118 HA ARG 118 12.131 -1.497 0.788 1025 HB2 ARG 118 2HB ARG 118 13.579 -1.526 -1.890 1026 HB3 ARG 118 3HB ARG 118 14.370 -1.680 -0.320 1027 HG2 ARG 118 2HG ARG 118 13.186 -3.778 0.106 1028 HG3 ARG 118 3HG ARG 118 12.300 -3.611 -1.408 1029 HD2 ARG 118 2HD ARG 118 14.048 -5.189 -1.796 1030 HD3 ARG 118 3HD ARG 118 14.509 -3.703 -2.619 1031 HE ARG 118 HE ARG 118 16.015 -3.255 -0.722 1032 HH11 ARG 118 1HH1 ARG 118 14.988 -6.595 -1.219 1033 HH12 ARG 118 2HH1 ARG 118 16.370 -7.262 -0.411 1034 HH21 ARG 118 1HH2 ARG 118 17.799 -4.142 0.364 1035 HH22 ARG 118 2HH2 ARG 118 17.968 -5.863 0.492 1036 H GLU 119 H GLU 119 11.834 0.793 -1.892 1037 HA GLU 119 HA GLU 119 13.357 2.920 -0.798 1038 HB2 GLU 119 2HB GLU 119 10.977 2.894 -2.701 1039 HB3 GLU 119 3HB GLU 119 11.792 4.387 -2.238 1040 HG2 GLU 119 2HG GLU 119 13.104 2.038 -3.647 1041 HG3 GLU 119 3HG GLU 119 12.537 3.513 -4.432 1042 H PHE 120 H PHE 120 9.898 2.129 -0.646 1043 HA PHE 120 HA PHE 120 9.046 4.178 1.059 1044 HB2 PHE 120 2HB PHE 120 7.935 1.375 0.621 1045 HB3 PHE 120 3HB PHE 120 7.092 2.625 1.538 1046 HD1 PHE 120 HD2 PHE 120 8.051 4.927 -0.453 1047 HD2 PHE 120 HD1 PHE 120 6.086 1.152 -0.979 1048 HE1 PHE 120 HE2 PHE 120 6.965 5.770 -2.480 1049 HE2 PHE 120 HE1 PHE 120 5.010 2.028 -2.999 1050 HZ PHE 120 HZ PHE 120 5.439 4.318 -3.749 1051 H MET 121 H MET 121 10.298 0.938 1.832 1052 HA MET 121 HA MET 121 9.861 1.103 4.638 1053 HB2 MET 121 2HB MET 121 11.590 -0.786 2.993 1054 HB3 MET 121 3HB MET 121 11.338 -0.954 4.728 1055 HG2 MET 121 2HG MET 121 8.874 -1.155 4.282 1056 HG3 MET 121 3HG MET 121 9.236 -1.185 2.557 1057 HE1 MET 121 3HE MET 121 11.149 -4.590 2.171 1058 HE2 MET 121 1HE MET 121 11.902 -3.010 2.376 1059 HE3 MET 121 2HE MET 121 10.488 -3.184 1.331 1060 H GLN 122 H GLN 122 12.554 1.923 2.545 1061 HA GLN 122 HA GLN 122 14.549 2.425 4.484 1062 HB2 GLN 122 2HB GLN 122 15.069 2.226 2.102 1063 HB3 GLN 122 3HB GLN 122 14.064 3.621 1.725 1064 HG2 GLN 122 2HG GLN 122 15.657 5.047 3.046 1065 HG3 GLN 122 3HG GLN 122 16.694 3.634 3.244 1066 HE21 GLN 122 1HE2 GLN 122 17.828 2.842 1.436 1067 HE22 GLN 122 2HE2 GLN 122 18.017 3.774 -0.008 1068 H LYS 123 H LYS 123 12.084 4.479 3.022 1069 HA LYS 123 HA LYS 123 13.026 6.932 4.254 1070 HB2 LYS 123 2HB LYS 123 10.584 6.376 2.510 1071 HB3 LYS 123 3HB LYS 123 11.172 7.981 2.959 1072 HG2 LYS 123 2HG LYS 123 13.220 7.663 1.712 1073 HG3 LYS 123 3HG LYS 123 12.847 5.961 1.428 1074 HD2 LYS 123 2HD LYS 123 10.884 6.664 0.041 1075 HD3 LYS 123 3HD LYS 123 11.355 8.350 0.270 1076 HE2 LYS 123 2HE LYS 123 13.557 7.820 -0.815 1077 HE3 LYS 123 3HE LYS 123 12.971 6.184 -1.126 1078 HZ1 LYS 123 3HZ LYS 123 11.177 7.159 -2.453 1079 HZ2 LYS 123 1HZ LYS 123 12.705 7.556 -3.063 1080 HZ3 LYS 123 2HZ LYS 123 11.816 8.701 -2.193 1081 H ALA 124 H ALA 124 10.286 4.720 4.629 1082 HA ALA 124 HA ALA 124 9.038 6.029 6.833 1083 HB1 ALA 124 3HB ALA 124 7.830 4.343 5.516 1084 HB2 ALA 124 1HB ALA 124 7.905 3.863 7.217 1085 HB3 ALA 124 2HB ALA 124 8.971 3.102 6.031 1086 H GLY 125 H GLY 125 11.655 3.681 6.460 1087 HA2 GLY 125 2HA GLY 125 12.194 3.038 9.134 1088 HA3 GLY 125 3HA GLY 125 13.365 3.062 7.833 1089 H SER 126 H SER 126 13.149 5.860 7.204 1090 HA SER 126 HA SER 126 14.912 7.063 9.069 1091 HB2 SER 126 2HB SER 126 13.209 8.414 6.921 1092 HB3 SER 126 3HB SER 126 14.666 9.082 7.686 1093 HG SER 126 HG SER 126 15.643 7.002 6.834 1094 H LEU 127 H LEU 127 11.401 7.172 8.656 1095 HA LEU 127 HA LEU 127 10.905 9.315 10.552 1096 HB2 LEU 127 2HB LEU 127 9.009 7.271 9.325 1097 HB3 LEU 127 3HB LEU 127 8.513 8.695 10.234 1098 HG LEU 127 HG LEU 127 10.010 8.763 7.581 1099 HD11 LEU 127 1HD1 LEU 127 7.898 9.456 6.567 1100 HD12 LEU 127 2HD1 LEU 127 7.066 9.238 8.109 1101 HD13 LEU 127 3HD1 LEU 127 7.776 7.849 7.279 1102 HD21 LEU 127 3HD2 LEU 127 8.747 11.033 9.171 1103 HD22 LEU 127 1HD2 LEU 127 9.470 11.172 7.562 1104 HD23 LEU 127 2HD2 LEU 127 10.476 10.747 8.944 1105 H GLU 128 H GLU 128 11.043 5.846 10.497 1106 HA GLU 128 HA GLU 128 9.964 5.195 13.031 1107 HB2 GLU 128 2HB GLU 128 10.108 3.508 11.319 1108 HB3 GLU 128 3HB GLU 128 11.832 3.751 11.113 1109 HG2 GLU 128 2HG GLU 128 11.326 1.627 12.248 1110 HG3 GLU 128 3HG GLU 128 12.301 2.708 13.244 1111 H HIS 129 H HIS 129 13.186 6.172 11.938 1112 HA HIS 129 HA HIS 129 14.653 5.614 14.293 1113 HB2 HIS 129 2HB HIS 129 15.102 7.834 12.247 1114 HB3 HIS 129 3HB HIS 129 16.267 7.344 13.474 1115 HD1 HIS 129 HD1 HIS 129 16.658 7.222 10.320 1116 HD2 HIS 129 HD2 HIS 129 15.801 4.013 12.816 1117 HE1 HIS 129 HE1 HIS 129 17.438 5.184 9.084 1118 HE2 HIS 129 HE2 HIS 129 16.711 3.254 10.526 1119 H HIS 130 H HIS 130 15.005 6.793 16.163 1120 HA HIS 130 HA HIS 130 12.803 8.303 17.127 1121 HB2 HIS 130 2HB HIS 130 14.186 6.777 18.534 1122 HB3 HIS 130 3HB HIS 130 15.542 7.888 18.398 1123 HD1 HIS 130 HD1 HIS 130 15.756 9.458 20.316 1124 HD2 HIS 130 HD2 HIS 130 11.855 8.104 19.870 1125 HE1 HIS 130 HE1 HIS 130 14.497 10.353 22.293 1126 HE2 HIS 130 HE2 HIS 130 12.196 9.360 22.092 1127 H HIS 131 H HIS 131 12.596 10.095 15.856 1128 HA HIS 131 HA HIS 131 14.736 11.996 15.417 1129 HB2 HIS 131 2HB HIS 131 13.016 13.216 14.034 1130 HB3 HIS 131 3HB HIS 131 13.327 11.570 13.515 1131 HD1 HIS 131 HD1 HIS 131 11.394 9.764 14.165 1132 HD2 HIS 131 HD2 HIS 131 10.361 13.779 14.502 1133 HE1 HIS 131 HE1 HIS 131 8.882 9.824 14.176 1134 HE2 HIS 131 HE2 HIS 131 8.284 12.262 14.403 1135 H HIS 132 H HIS 132 14.822 14.079 16.215 1136 HA HIS 132 HA HIS 132 13.733 14.326 18.911 1137 HB2 HIS 132 2HB HIS 132 15.949 15.834 17.454 1138 HB3 HIS 132 3HB HIS 132 15.480 16.148 19.123 1139 HD1 HIS 132 HD1 HIS 132 17.108 15.090 20.672 1140 HD2 HIS 132 HD2 HIS 132 16.530 12.754 17.289 1141 HE1 HIS 132 HE1 HIS 132 18.562 13.075 20.987 1142 HE2 HIS 132 HE2 HIS 132 18.073 11.611 19.004 1143 H HIS 133 H HIS 133 11.687 14.667 17.442 1144 HA HIS 133 HA HIS 133 10.483 17.086 18.032 1145 HB2 HIS 133 2HB HIS 133 10.159 18.135 15.824 1146 HB3 HIS 133 3HB HIS 133 11.881 18.049 16.175 1147 HD1 HIS 133 HD1 HIS 133 9.268 16.722 13.862 1148 HD2 HIS 133 HD2 HIS 133 13.358 16.308 14.484 1149 HE1 HIS 133 HE1 HIS 133 10.147 15.564 11.828 1150 HE2 HIS 133 HE2 HIS 133 12.639 15.478 12.151 1151 H HIS 134 H HIS 134 8.256 17.158 16.689 1152 HA HIS 134 HA HIS 134 7.299 14.378 16.372 1153 HB2 HIS 134 2HB HIS 134 5.806 17.011 16.722 1154 HB3 HIS 134 3HB HIS 134 5.012 15.467 16.415 1155 HD1 HIS 134 HD1 HIS 134 6.345 17.535 19.139 1156 HD2 HIS 134 HD2 HIS 134 5.448 13.520 18.547 1157 HE1 HIS 134 HE1 HIS 134 6.216 16.522 21.436 1158 HE2 HIS 134 HE2 HIS 134 5.751 14.083 21.037 Start of MODEL 20 1 H1 MET 1 1H MET 1 3.593 7.064 17.005 2 H2 MET 1 2H MET 1 2.653 7.954 15.923 3 H3 MET 1 3H MET 1 3.953 8.687 16.712 4 HA MET 1 HA MET 1 4.456 8.177 14.422 5 HB2 MET 1 2HB MET 1 5.988 6.572 16.525 6 HB3 MET 1 3HB MET 1 6.570 6.787 14.876 7 HG2 MET 1 2HG MET 1 7.658 8.329 16.438 8 HG3 MET 1 3HG MET 1 6.732 9.191 15.220 9 HE1 MET 1 3HE MET 1 7.779 10.688 17.801 10 HE2 MET 1 1HE MET 1 6.337 11.572 18.302 11 HE3 MET 1 2HE MET 1 6.752 11.465 16.592 12 H LYS 2 H LYS 2 3.115 7.098 13.078 13 HA LYS 2 HA LYS 2 3.285 4.198 12.917 14 HB2 LYS 2 2HB LYS 2 1.355 4.701 14.471 15 HB3 LYS 2 3HB LYS 2 0.584 5.590 13.166 16 HG2 LYS 2 2HG LYS 2 0.478 3.479 11.829 17 HG3 LYS 2 3HG LYS 2 1.195 2.612 13.190 18 HD2 LYS 2 2HD LYS 2 -1.484 4.061 13.184 19 HD3 LYS 2 3HD LYS 2 -1.252 2.311 13.172 20 HE2 LYS 2 2HE LYS 2 -0.370 2.337 15.419 21 HE3 LYS 2 3HE LYS 2 -0.258 4.096 15.424 22 HZ1 LYS 2 3HZ LYS 2 -2.658 4.226 15.326 23 HZ2 LYS 2 1HZ LYS 2 -2.155 3.336 16.674 24 HZ3 LYS 2 2HZ LYS 2 -2.777 2.540 15.320 25 H ILE 3 H ILE 3 4.412 4.677 11.027 26 HA ILE 3 HA ILE 3 2.955 5.870 8.779 27 HB ILE 3 HB ILE 3 5.824 4.888 9.090 28 HG12 ILE 3 2HG1 ILE 3 4.593 7.593 8.352 29 HG13 ILE 3 3HG1 ILE 3 5.333 7.172 9.892 30 HG21 ILE 3 1HG2 ILE 3 4.483 5.679 6.464 31 HG22 ILE 3 2HG2 ILE 3 5.128 4.088 6.872 32 HG23 ILE 3 3HG2 ILE 3 6.220 5.456 6.682 33 HD11 ILE 3 3HD1 ILE 3 6.792 8.561 8.579 34 HD12 ILE 3 1HD1 ILE 3 6.750 7.416 7.240 35 HD13 ILE 3 2HD1 ILE 3 7.503 6.961 8.773 36 H LEU 4 H LEU 4 2.006 4.735 7.279 37 HA LEU 4 HA LEU 4 1.965 1.786 7.454 38 HB2 LEU 4 2HB LEU 4 -0.161 3.592 6.241 39 HB3 LEU 4 3HB LEU 4 -0.319 1.895 6.679 40 HG LEU 4 HG LEU 4 0.034 4.172 8.682 41 HD11 LEU 4 1HD1 LEU 4 -2.502 2.705 7.940 42 HD12 LEU 4 2HD1 LEU 4 -2.106 4.381 7.554 43 HD13 LEU 4 3HD1 LEU 4 -2.323 3.897 9.233 44 HD21 LEU 4 3HD2 LEU 4 0.886 2.060 9.552 45 HD22 LEU 4 1HD2 LEU 4 -0.632 1.249 9.153 46 HD23 LEU 4 2HD2 LEU 4 -0.597 2.515 10.385 47 H ILE 5 H ILE 5 2.386 0.643 5.585 48 HA ILE 5 HA ILE 5 2.954 2.178 3.103 49 HB ILE 5 HB ILE 5 3.990 -0.610 3.777 50 HG12 ILE 5 2HG1 ILE 5 4.986 1.048 5.375 51 HG13 ILE 5 3HG1 ILE 5 6.191 0.346 4.308 52 HG21 ILE 5 1HG2 ILE 5 5.566 -0.226 1.891 53 HG22 ILE 5 2HG2 ILE 5 4.793 1.331 1.578 54 HG23 ILE 5 3HG2 ILE 5 3.878 -0.165 1.373 55 HD11 ILE 5 3HD1 ILE 5 6.577 2.701 4.661 56 HD12 ILE 5 1HD1 ILE 5 4.974 3.092 4.042 57 HD13 ILE 5 2HD1 ILE 5 6.192 2.395 2.969 58 H LEU 6 H LEU 6 1.124 2.101 1.925 59 HA LEU 6 HA LEU 6 -0.663 -0.232 1.965 60 HB2 LEU 6 2HB LEU 6 -1.221 2.471 1.969 61 HB3 LEU 6 3HB LEU 6 -1.283 2.165 0.253 62 HG LEU 6 HG LEU 6 -3.529 2.024 1.041 63 HD11 LEU 6 1HD1 LEU 6 -2.639 -0.861 0.773 64 HD12 LEU 6 2HD1 LEU 6 -3.006 0.235 -0.560 65 HD13 LEU 6 3HD1 LEU 6 -4.279 -0.233 0.563 66 HD21 LEU 6 3HD2 LEU 6 -3.051 1.851 3.429 67 HD22 LEU 6 1HD2 LEU 6 -2.605 0.152 3.239 68 HD23 LEU 6 2HD2 LEU 6 -4.262 0.675 2.937 69 H ILE 7 H ILE 7 -0.720 -1.622 0.215 70 HA ILE 7 HA ILE 7 0.771 -0.952 -2.258 71 HB ILE 7 HB ILE 7 1.099 -3.562 -0.688 72 HG12 ILE 7 2HG1 ILE 7 3.191 -1.385 -1.166 73 HG13 ILE 7 3HG1 ILE 7 2.272 -1.552 0.324 74 HG21 ILE 7 1HG2 ILE 7 1.239 -3.948 -3.118 75 HG22 ILE 7 2HG2 ILE 7 2.825 -4.155 -2.372 76 HG23 ILE 7 3HG2 ILE 7 2.455 -2.678 -3.267 77 HD11 ILE 7 3HD1 ILE 7 4.461 -2.474 0.575 78 HD12 ILE 7 1HD1 ILE 7 4.212 -3.553 -0.798 79 HD13 ILE 7 2HD1 ILE 7 3.255 -3.754 0.674 80 H ASN 8 H ASN 8 -0.198 -1.674 -4.076 81 HA ASN 8 HA ASN 8 -2.394 -3.656 -3.953 82 HB2 ASN 8 2HB ASN 8 -3.425 -1.448 -4.117 83 HB3 ASN 8 3HB ASN 8 -2.375 -1.001 -5.449 84 HD21 ASN 8 1HD2 ASN 8 -4.114 -4.104 -5.107 85 HD22 ASN 8 2HD2 ASN 8 -5.141 -3.858 -6.468 86 H THR 9 H THR 9 -1.644 -5.336 -5.057 87 HA THR 9 HA THR 9 -0.662 -4.894 -7.816 88 HB THR 9 HB THR 9 1.244 -5.769 -6.622 89 HG1 THR 9 HG1 THR 9 1.620 -7.152 -8.159 90 HG21 THR 9 3HG2 THR 9 0.152 -6.686 -4.619 91 HG22 THR 9 1HG2 THR 9 1.214 -7.893 -5.349 92 HG23 THR 9 2HG2 THR 9 -0.535 -8.001 -5.575 93 H ASN 10 H ASN 10 -1.701 -6.095 -9.372 94 HA ASN 10 HA ASN 10 -4.234 -7.343 -8.711 95 HB2 ASN 10 2HB ASN 10 -2.808 -7.102 -11.405 96 HB3 ASN 10 3HB ASN 10 -4.479 -7.602 -11.167 97 HD21 ASN 10 1HD2 ASN 10 -2.277 -4.886 -11.230 98 HD22 ASN 10 2HD2 ASN 10 -3.490 -3.655 -11.210 99 H ASN 11 H ASN 11 -1.021 -8.347 -8.966 100 HA ASN 11 HA ASN 11 -1.540 -11.037 -10.024 101 HB2 ASN 11 2HB ASN 11 1.091 -9.575 -9.522 102 HB3 ASN 11 3HB ASN 11 0.948 -11.186 -10.224 103 HD21 ASN 11 1HD2 ASN 11 1.641 -10.854 -12.260 104 HD22 ASN 11 2HD2 ASN 11 0.965 -9.722 -13.377 105 H ASP 12 H ASP 12 -1.696 -12.720 -8.757 106 HA ASP 12 HA ASP 12 -1.726 -12.693 -5.958 107 HB2 ASP 12 2HB ASP 12 -1.451 -15.114 -7.791 108 HB3 ASP 12 3HB ASP 12 -1.993 -15.150 -6.113 109 H GLU 13 H GLU 13 0.832 -13.483 -8.184 110 HA GLU 13 HA GLU 13 2.682 -14.796 -6.545 111 HB2 GLU 13 2HB GLU 13 3.263 -12.910 -8.877 112 HB3 GLU 13 3HB GLU 13 4.368 -14.121 -8.224 113 HG2 GLU 13 2HG GLU 13 2.885 -15.923 -8.948 114 HG3 GLU 13 3HG GLU 13 1.693 -14.751 -9.513 115 H LEU 14 H LEU 14 2.424 -11.317 -7.369 116 HA LEU 14 HA LEU 14 4.653 -10.521 -5.788 117 HB2 LEU 14 2HB LEU 14 2.459 -8.936 -7.153 118 HB3 LEU 14 3HB LEU 14 3.656 -8.142 -6.148 119 HG LEU 14 HG LEU 14 4.325 -7.914 -8.452 120 HD11 LEU 14 1HD1 LEU 14 6.141 -8.184 -6.852 121 HD12 LEU 14 2HD1 LEU 14 6.575 -8.858 -8.418 122 HD13 LEU 14 3HD1 LEU 14 6.132 -9.936 -7.094 123 HD21 LEU 14 3HD2 LEU 14 4.785 -9.793 -9.949 124 HD22 LEU 14 1HD2 LEU 14 3.101 -9.796 -9.431 125 HD23 LEU 14 2HD2 LEU 14 4.241 -10.937 -8.717 126 H ILE 15 H ILE 15 1.260 -10.929 -5.042 127 HA ILE 15 HA ILE 15 1.080 -9.417 -2.669 128 HB ILE 15 HB ILE 15 -0.301 -12.070 -3.305 129 HG12 ILE 15 2HG1 ILE 15 -1.307 -9.223 -3.762 130 HG13 ILE 15 3HG1 ILE 15 -0.666 -10.269 -5.022 131 HG21 ILE 15 1HG2 ILE 15 -1.089 -9.931 -1.285 132 HG22 ILE 15 2HG2 ILE 15 -0.460 -11.533 -0.901 133 HG23 ILE 15 3HG2 ILE 15 -2.035 -11.368 -1.676 134 HD11 ILE 15 3HD1 ILE 15 -2.522 -11.855 -4.567 135 HD12 ILE 15 1HD1 ILE 15 -3.036 -10.270 -5.144 136 HD13 ILE 15 2HD1 ILE 15 -3.191 -10.676 -3.437 137 H LYS 16 H LYS 16 1.842 -12.919 -3.063 138 HA LYS 16 HA LYS 16 2.491 -13.303 -0.307 139 HB2 LYS 16 2HB LYS 16 3.158 -15.575 -0.937 140 HB3 LYS 16 3HB LYS 16 1.613 -15.148 -1.655 141 HG2 LYS 16 2HG LYS 16 2.756 -14.730 -3.825 142 HG3 LYS 16 3HG LYS 16 4.286 -15.214 -3.097 143 HD2 LYS 16 2HD LYS 16 1.850 -17.026 -3.375 144 HD3 LYS 16 3HD LYS 16 3.205 -16.993 -4.500 145 HE2 LYS 16 2HE LYS 16 3.600 -18.858 -3.078 146 HE3 LYS 16 3HE LYS 16 4.703 -17.608 -2.512 147 HZ1 LYS 16 3HZ LYS 16 2.081 -18.258 -1.275 148 HZ2 LYS 16 1HZ LYS 16 3.211 -17.147 -0.687 149 HZ3 LYS 16 2HZ LYS 16 3.577 -18.795 -0.708 150 H LYS 17 H LYS 17 4.407 -12.489 -3.138 151 HA LYS 17 HA LYS 17 7.003 -12.989 -2.112 152 HB2 LYS 17 2HB LYS 17 6.019 -11.068 -4.257 153 HB3 LYS 17 3HB LYS 17 7.729 -11.295 -3.888 154 HG2 LYS 17 2HG LYS 17 7.605 -13.647 -4.539 155 HG3 LYS 17 3HG LYS 17 5.863 -13.515 -4.787 156 HD2 LYS 17 2HD LYS 17 7.051 -13.469 -6.929 157 HD3 LYS 17 3HD LYS 17 6.225 -11.936 -6.639 158 HE2 LYS 17 2HE LYS 17 8.442 -11.537 -7.575 159 HE3 LYS 17 3HE LYS 17 8.391 -10.940 -5.915 160 HZ1 LYS 17 3HZ LYS 17 9.502 -12.972 -5.205 161 HZ2 LYS 17 1HZ LYS 17 10.424 -12.148 -6.358 162 HZ3 LYS 17 2HZ LYS 17 9.552 -13.528 -6.799 163 H ILE 18 H ILE 18 5.134 -9.961 -2.343 164 HA ILE 18 HA ILE 18 6.988 -8.293 -1.016 165 HB ILE 18 HB ILE 18 4.012 -7.946 -1.556 166 HG12 ILE 18 2HG1 ILE 18 6.442 -6.602 -2.828 167 HG13 ILE 18 3HG1 ILE 18 5.574 -7.961 -3.526 168 HG21 ILE 18 1HG2 ILE 18 5.883 -5.847 -0.404 169 HG22 ILE 18 2HG2 ILE 18 4.523 -6.598 0.434 170 HG23 ILE 18 3HG2 ILE 18 4.233 -5.554 -0.958 171 HD11 ILE 18 3HD1 ILE 18 3.577 -6.562 -3.756 172 HD12 ILE 18 1HD1 ILE 18 4.969 -5.891 -4.607 173 HD13 ILE 18 2HD1 ILE 18 4.459 -5.193 -3.070 174 H LYS 19 H LYS 19 4.307 -10.299 0.219 175 HA LYS 19 HA LYS 19 4.164 -9.499 2.879 176 HB2 LYS 19 2HB LYS 19 3.997 -12.308 1.710 177 HB3 LYS 19 3HB LYS 19 3.682 -11.967 3.410 178 HG2 LYS 19 2HG LYS 19 1.815 -10.480 2.756 179 HG3 LYS 19 3HG LYS 19 2.112 -10.870 1.061 180 HD2 LYS 19 2HD LYS 19 1.593 -13.247 1.499 181 HD3 LYS 19 3HD LYS 19 1.351 -12.890 3.212 182 HE2 LYS 19 2HE LYS 19 -0.542 -11.390 2.593 183 HE3 LYS 19 3HE LYS 19 -0.322 -11.850 0.903 184 HZ1 LYS 19 3HZ LYS 19 -0.717 -14.184 1.619 185 HZ2 LYS 19 1HZ LYS 19 -2.056 -13.167 1.812 186 HZ3 LYS 19 2HZ LYS 19 -1.125 -13.608 3.152 187 H LYS 20 H LYS 20 6.566 -11.601 1.333 188 HA LYS 20 HA LYS 20 7.903 -12.290 3.807 189 HB2 LYS 20 2HB LYS 20 8.701 -12.842 0.919 190 HB3 LYS 20 3HB LYS 20 9.443 -13.569 2.342 191 HG2 LYS 20 2HG LYS 20 6.590 -13.969 1.376 192 HG3 LYS 20 3HG LYS 20 7.901 -15.146 1.303 193 HD2 LYS 20 2HD LYS 20 6.660 -14.051 3.864 194 HD3 LYS 20 3HD LYS 20 6.281 -15.610 3.132 195 HE2 LYS 20 2HE LYS 20 9.024 -14.804 4.164 196 HE3 LYS 20 3HE LYS 20 7.863 -15.795 5.041 197 HZ1 LYS 20 3HZ LYS 20 9.148 -16.497 2.456 198 HZ2 LYS 20 1HZ LYS 20 7.993 -17.436 3.261 199 HZ3 LYS 20 2HZ LYS 20 9.500 -17.164 3.969 200 H GLU 21 H GLU 21 8.729 -10.335 0.935 201 HA GLU 21 HA GLU 21 11.202 -9.355 1.538 202 HB2 GLU 21 2HB GLU 21 8.964 -7.602 0.423 203 HB3 GLU 21 3HB GLU 21 10.695 -7.343 0.215 204 HG2 GLU 21 2HG GLU 21 8.978 -9.518 -0.999 205 HG3 GLU 21 3HG GLU 21 9.822 -8.219 -1.834 206 H VAL 22 H VAL 22 8.146 -8.011 2.713 207 HA VAL 22 HA VAL 22 9.460 -5.836 4.155 208 HB VAL 22 HB VAL 22 7.277 -4.907 4.475 209 HG11 VAL 22 1HG1 VAL 22 6.425 -4.782 2.150 210 HG12 VAL 22 2HG1 VAL 22 7.396 -6.190 1.715 211 HG13 VAL 22 3HG1 VAL 22 8.186 -4.690 2.197 212 HG21 VAL 22 3HG2 VAL 22 5.997 -6.856 5.198 213 HG22 VAL 22 1HG2 VAL 22 6.111 -7.578 3.592 214 HG23 VAL 22 2HG2 VAL 22 5.173 -6.102 3.835 215 H GLU 23 H GLU 23 8.142 -8.958 4.847 216 HA GLU 23 HA GLU 23 7.691 -8.928 7.603 217 HB2 GLU 23 2HB GLU 23 7.139 -10.859 6.242 218 HB3 GLU 23 3HB GLU 23 8.816 -11.062 5.744 219 HG2 GLU 23 2HG GLU 23 9.405 -11.656 8.098 220 HG3 GLU 23 3HG GLU 23 7.699 -11.532 8.523 221 H ASN 24 H ASN 24 10.679 -9.428 5.758 222 HA ASN 24 HA ASN 24 12.392 -9.689 8.079 223 HB2 ASN 24 2HB ASN 24 12.947 -9.556 5.081 224 HB3 ASN 24 3HB ASN 24 14.232 -9.685 6.282 225 HD21 ASN 24 1HD2 ASN 24 11.496 -11.347 4.837 226 HD22 ASN 24 2HD2 ASN 24 11.925 -12.925 5.378 227 H GLN 25 H GLN 25 10.938 -7.006 6.833 228 HA GLN 25 HA GLN 25 13.191 -5.154 7.389 229 HB2 GLN 25 2HB GLN 25 10.585 -4.608 5.895 230 HB3 GLN 25 3HB GLN 25 11.898 -3.459 6.130 231 HG2 GLN 25 2HG GLN 25 12.097 -6.034 4.541 232 HG3 GLN 25 3HG GLN 25 11.850 -4.439 3.854 233 HE21 GLN 25 1HE2 GLN 25 14.151 -6.618 5.263 234 HE22 GLN 25 2HE2 GLN 25 15.556 -5.673 4.925 235 H GLY 26 H GLY 26 10.670 -6.508 9.023 236 HA2 GLY 26 2HA GLY 26 9.987 -6.031 11.172 237 HA3 GLY 26 3HA GLY 26 10.736 -4.450 11.067 238 H TYR 27 H TYR 27 8.530 -5.207 8.518 239 HA TYR 27 HA TYR 27 6.488 -3.411 9.678 240 HB2 TYR 27 2HB TYR 27 7.064 -4.215 6.792 241 HB3 TYR 27 3HB TYR 27 5.624 -3.312 7.264 242 HD1 TYR 27 HD2 TYR 27 9.370 -3.158 7.316 243 HD2 TYR 27 HD1 TYR 27 5.730 -0.917 7.522 244 HE1 TYR 27 HE2 TYR 27 10.655 -1.067 7.211 245 HE2 TYR 27 HE1 TYR 27 7.021 1.179 7.426 246 HH TYR 27 HH TYR 27 10.359 1.266 6.619 247 H GLN 28 H GLN 28 4.622 -4.193 10.349 248 HA GLN 28 HA GLN 28 4.126 -7.018 10.422 249 HB2 GLN 28 2HB GLN 28 2.611 -4.625 11.537 250 HB3 GLN 28 3HB GLN 28 1.995 -6.266 11.681 251 HG2 GLN 28 2HG GLN 28 3.089 -5.596 13.750 252 HG3 GLN 28 3HG GLN 28 3.962 -6.920 13.003 253 HE21 GLN 28 1HE2 GLN 28 6.056 -6.553 12.219 254 HE22 GLN 28 2HE2 GLN 28 6.943 -5.113 12.583 255 H VAL 29 H VAL 29 3.314 -8.029 8.721 256 HA VAL 29 HA VAL 29 2.001 -6.630 6.571 257 HB VAL 29 HB VAL 29 2.285 -9.658 6.690 258 HG11 VAL 29 1HG1 VAL 29 2.465 -9.459 4.232 259 HG12 VAL 29 2HG1 VAL 29 2.344 -7.704 4.359 260 HG13 VAL 29 3HG1 VAL 29 0.977 -8.716 4.828 261 HG21 VAL 29 3HG2 VAL 29 4.497 -8.818 7.316 262 HG22 VAL 29 1HG2 VAL 29 4.506 -7.736 5.923 263 HG23 VAL 29 2HG2 VAL 29 4.539 -9.484 5.681 264 H ARG 30 H ARG 30 -0.122 -6.479 6.274 265 HA ARG 30 HA ARG 30 -1.947 -8.653 7.124 266 HB2 ARG 30 2HB ARG 30 -2.495 -5.643 7.002 267 HB3 ARG 30 3HB ARG 30 -3.764 -6.853 7.154 268 HG2 ARG 30 2HG ARG 30 -1.563 -6.311 9.179 269 HG3 ARG 30 3HG ARG 30 -3.256 -5.816 9.314 270 HD2 ARG 30 2HD ARG 30 -3.878 -8.275 9.232 271 HD3 ARG 30 3HD ARG 30 -2.154 -8.651 9.338 272 HE ARG 30 HE ARG 30 -3.721 -7.223 11.411 273 HH11 ARG 30 1HH1 ARG 30 -1.082 -9.414 10.578 274 HH12 ARG 30 2HH1 ARG 30 -0.653 -9.707 12.233 275 HH21 ARG 30 1HH2 ARG 30 -3.162 -7.638 13.556 276 HH22 ARG 30 2HH2 ARG 30 -1.839 -8.695 13.928 277 H ASP 31 H ASP 31 -3.428 -9.265 5.517 278 HA ASP 31 HA ASP 31 -3.374 -7.777 2.953 279 HB2 ASP 31 2HB ASP 31 -3.816 -9.859 1.709 280 HB3 ASP 31 3HB ASP 31 -2.299 -9.970 2.592 281 H VAL 32 H VAL 32 -5.306 -7.370 2.022 282 HA VAL 32 HA VAL 32 -7.790 -8.025 3.498 283 HB VAL 32 HB VAL 32 -6.953 -5.393 2.174 284 HG11 VAL 32 1HG1 VAL 32 -9.195 -4.500 2.737 285 HG12 VAL 32 2HG1 VAL 32 -9.704 -6.106 3.263 286 HG13 VAL 32 3HG1 VAL 32 -9.296 -5.820 1.569 287 HG21 VAL 32 3HG2 VAL 32 -6.105 -5.689 4.474 288 HG22 VAL 32 1HG2 VAL 32 -7.745 -5.999 5.054 289 HG23 VAL 32 2HG2 VAL 32 -7.319 -4.409 4.417 290 H ASN 33 H ASN 33 -8.872 -9.414 2.261 291 HA ASN 33 HA ASN 33 -8.970 -9.127 -0.683 292 HB2 ASN 33 2HB ASN 33 -9.323 -11.535 1.155 293 HB3 ASN 33 3HB ASN 33 -9.826 -11.567 -0.530 294 HD21 ASN 33 1HD2 ASN 33 -7.061 -11.397 1.637 295 HD22 ASN 33 2HD2 ASN 33 -5.890 -11.871 0.462 296 H ASP 34 H ASP 34 -10.760 -8.309 2.010 297 HA ASP 34 HA ASP 34 -13.211 -8.097 0.419 298 HB2 ASP 34 2HB ASP 34 -13.283 -10.356 1.644 299 HB3 ASP 34 3HB ASP 34 -13.315 -9.459 3.162 300 H SER 35 H SER 35 -14.742 -6.609 1.288 301 HA SER 35 HA SER 35 -13.725 -4.295 2.464 302 HB2 SER 35 2HB SER 35 -16.185 -3.643 2.591 303 HB3 SER 35 3HB SER 35 -15.638 -4.188 1.006 304 HG SER 35 HG SER 35 -17.343 -5.444 2.837 305 H ASP 36 H ASP 36 -15.252 -7.100 3.962 306 HA ASP 36 HA ASP 36 -15.647 -6.120 6.572 307 HB2 ASP 36 2HB ASP 36 -16.516 -8.315 5.831 308 HB3 ASP 36 3HB ASP 36 -14.878 -8.942 5.678 309 H GLU 37 H GLU 37 -12.824 -7.703 5.068 310 HA GLU 37 HA GLU 37 -11.099 -7.794 7.316 311 HB2 GLU 37 2HB GLU 37 -10.432 -7.686 4.340 312 HB3 GLU 37 3HB GLU 37 -9.274 -8.095 5.604 313 HG2 GLU 37 2HG GLU 37 -11.784 -9.671 4.953 314 HG3 GLU 37 3HG GLU 37 -10.161 -10.074 4.397 315 H LEU 38 H LEU 38 -11.612 -5.401 4.793 316 HA LEU 38 HA LEU 38 -9.683 -3.483 5.320 317 HB2 LEU 38 2HB LEU 38 -11.018 -3.333 3.365 318 HB3 LEU 38 3HB LEU 38 -12.511 -3.362 4.267 319 HG LEU 38 HG LEU 38 -10.819 -0.959 4.830 320 HD11 LEU 38 1HD1 LEU 38 -11.371 0.200 2.770 321 HD12 LEU 38 2HD1 LEU 38 -12.099 -1.266 2.110 322 HD13 LEU 38 3HD1 LEU 38 -10.365 -1.207 2.438 323 HD21 LEU 38 3HD2 LEU 38 -12.956 0.238 4.656 324 HD22 LEU 38 1HD2 LEU 38 -13.134 -1.161 5.717 325 HD23 LEU 38 2HD2 LEU 38 -13.756 -1.221 4.063 326 H LYS 39 H LYS 39 -13.031 -3.628 6.588 327 HA LYS 39 HA LYS 39 -12.921 -1.457 8.356 328 HB2 LYS 39 2HB LYS 39 -14.593 -3.995 8.519 329 HB3 LYS 39 3HB LYS 39 -14.891 -2.551 9.485 330 HG2 LYS 39 2HG LYS 39 -15.462 -1.265 7.523 331 HG3 LYS 39 3HG LYS 39 -14.937 -2.568 6.451 332 HD2 LYS 39 2HD LYS 39 -17.384 -2.534 6.582 333 HD3 LYS 39 3HD LYS 39 -16.758 -4.014 7.305 334 HE2 LYS 39 2HE LYS 39 -17.068 -2.996 9.571 335 HE3 LYS 39 3HE LYS 39 -17.754 -1.561 8.806 336 HZ1 LYS 39 3HZ LYS 39 -19.524 -2.948 7.894 337 HZ2 LYS 39 1HZ LYS 39 -19.484 -3.048 9.581 338 HZ3 LYS 39 2HZ LYS 39 -18.871 -4.314 8.645 339 H LYS 40 H LYS 40 -12.019 -4.860 8.868 340 HA LYS 40 HA LYS 40 -11.805 -4.839 11.688 341 HB2 LYS 40 2HB LYS 40 -10.140 -6.614 9.849 342 HB3 LYS 40 3HB LYS 40 -10.591 -6.942 11.520 343 HG2 LYS 40 2HG LYS 40 -12.434 -6.900 9.125 344 HG3 LYS 40 3HG LYS 40 -11.850 -8.334 9.949 345 HD2 LYS 40 2HD LYS 40 -13.594 -6.235 11.301 346 HD3 LYS 40 3HD LYS 40 -14.250 -7.628 10.442 347 HE2 LYS 40 2HE LYS 40 -13.010 -9.134 11.980 348 HE3 LYS 40 3HE LYS 40 -12.434 -7.725 12.870 349 HZ1 LYS 40 3HZ LYS 40 -14.758 -7.157 13.331 350 HZ2 LYS 40 1HZ LYS 40 -14.336 -8.671 13.957 351 HZ3 LYS 40 2HZ LYS 40 -15.259 -8.567 12.545 352 H GLU 41 H GLU 41 -9.423 -4.219 9.104 353 HA GLU 41 HA GLU 41 -7.271 -3.840 11.024 354 HB2 GLU 41 2HB GLU 41 -7.228 -3.515 8.001 355 HB3 GLU 41 3HB GLU 41 -5.817 -3.497 9.060 356 HG2 GLU 41 2HG GLU 41 -7.616 -5.823 8.354 357 HG3 GLU 41 3HG GLU 41 -5.869 -5.693 8.165 358 H MET 42 H MET 42 -9.500 -1.709 9.348 359 HA MET 42 HA MET 42 -8.118 0.730 9.856 360 HB2 MET 42 2HB MET 42 -11.122 0.258 9.643 361 HB3 MET 42 3HB MET 42 -10.344 1.833 9.635 362 HG2 MET 42 2HG MET 42 -9.949 -0.306 7.537 363 HG3 MET 42 3HG MET 42 -11.020 1.073 7.391 364 HE1 MET 42 3HE MET 42 -6.492 1.026 6.743 365 HE2 MET 42 1HE MET 42 -7.620 -0.316 6.555 366 HE3 MET 42 2HE MET 42 -7.165 0.236 8.167 367 H LYS 43 H LYS 43 -10.308 -1.280 11.754 368 HA LYS 43 HA LYS 43 -10.626 0.272 14.057 369 HB2 LYS 43 2HB LYS 43 -10.431 -2.750 13.753 370 HB3 LYS 43 3HB LYS 43 -10.903 -1.958 15.256 371 HG2 LYS 43 2HG LYS 43 -12.896 -1.050 14.220 372 HG3 LYS 43 3HG LYS 43 -12.395 -1.651 12.635 373 HD2 LYS 43 2HD LYS 43 -12.591 -3.987 13.465 374 HD3 LYS 43 3HD LYS 43 -13.097 -3.379 15.044 375 HE2 LYS 43 2HE LYS 43 -14.595 -2.966 12.434 376 HE3 LYS 43 3HE LYS 43 -15.021 -4.128 13.691 377 HZ1 LYS 43 3HZ LYS 43 -14.930 -1.184 14.055 378 HZ2 LYS 43 1HZ LYS 43 -15.405 -2.319 15.217 379 HZ3 LYS 43 2HZ LYS 43 -16.334 -2.095 13.820 380 H LYS 44 H LYS 44 -8.015 -1.961 13.096 381 HA LYS 44 HA LYS 44 -6.608 -2.010 15.556 382 HB2 LYS 44 2HB LYS 44 -5.333 -2.403 12.808 383 HB3 LYS 44 3HB LYS 44 -4.733 -2.998 14.355 384 HG2 LYS 44 2HG LYS 44 -7.179 -3.952 12.851 385 HG3 LYS 44 3HG LYS 44 -5.667 -4.824 13.108 386 HD2 LYS 44 2HD LYS 44 -6.204 -4.734 15.624 387 HD3 LYS 44 3HD LYS 44 -7.807 -4.146 15.161 388 HE2 LYS 44 2HE LYS 44 -6.558 -6.823 14.464 389 HE3 LYS 44 3HE LYS 44 -7.958 -6.536 15.497 390 HZ1 LYS 44 3HZ LYS 44 -8.781 -7.261 13.433 391 HZ2 LYS 44 1HZ LYS 44 -7.772 -6.225 12.550 392 HZ3 LYS 44 2HZ LYS 44 -9.057 -5.597 13.454 393 H LEU 45 H LEU 45 -6.368 0.142 12.754 394 HA LEU 45 HA LEU 45 -3.971 1.473 13.516 395 HB2 LEU 45 2HB LEU 45 -6.209 2.452 11.710 396 HB3 LEU 45 3HB LEU 45 -4.588 3.132 11.793 397 HG LEU 45 HG LEU 45 -5.322 0.353 10.796 398 HD11 LEU 45 1HD1 LEU 45 -4.323 2.776 9.289 399 HD12 LEU 45 2HD1 LEU 45 -5.941 2.075 9.216 400 HD13 LEU 45 3HD1 LEU 45 -4.563 1.164 8.607 401 HD21 LEU 45 3HD2 LEU 45 -2.937 0.109 10.179 402 HD22 LEU 45 1HD2 LEU 45 -3.162 0.243 11.921 403 HD23 LEU 45 2HD2 LEU 45 -2.573 1.629 11.000 404 H ALA 46 H ALA 46 -7.255 1.829 14.580 405 HA ALA 46 HA ALA 46 -6.773 4.457 15.834 406 HB1 ALA 46 3HB ALA 46 -8.865 4.159 14.563 407 HB2 ALA 46 1HB ALA 46 -9.186 4.458 16.274 408 HB3 ALA 46 2HB ALA 46 -9.324 2.823 15.623 409 H GLU 47 H GLU 47 -7.273 1.037 16.665 410 HA GLU 47 HA GLU 47 -7.791 1.518 19.489 411 HB2 GLU 47 2HB GLU 47 -7.441 -1.040 17.869 412 HB3 GLU 47 3HB GLU 47 -7.788 -1.025 19.595 413 HG2 GLU 47 2HG GLU 47 -9.961 0.001 19.204 414 HG3 GLU 47 3HG GLU 47 -9.607 0.185 17.484 415 H GLU 48 H GLU 48 -5.181 0.222 17.473 416 HA GLU 48 HA GLU 48 -3.523 -0.625 19.664 417 HB2 GLU 48 2HB GLU 48 -2.801 -0.234 16.726 418 HB3 GLU 48 3HB GLU 48 -1.745 -0.966 17.931 419 HG2 GLU 48 2HG GLU 48 -4.426 -2.073 17.025 420 HG3 GLU 48 3HG GLU 48 -2.849 -2.636 16.474 421 H LYS 49 H LYS 49 -3.146 1.077 21.006 422 HA LYS 49 HA LYS 49 -2.207 3.656 20.263 423 HB2 LYS 49 2HB LYS 49 -1.838 2.210 22.924 424 HB3 LYS 49 3HB LYS 49 -1.667 3.944 22.646 425 HG2 LYS 49 2HG LYS 49 -4.094 4.038 22.015 426 HG3 LYS 49 3HG LYS 49 -4.232 2.327 22.429 427 HD2 LYS 49 2HD LYS 49 -5.042 3.634 24.306 428 HD3 LYS 49 3HD LYS 49 -3.515 2.885 24.776 429 HE2 LYS 49 2HE LYS 49 -2.353 5.046 24.311 430 HE3 LYS 49 3HE LYS 49 -3.910 5.772 23.905 431 HZ1 LYS 49 3HZ LYS 49 -3.275 6.291 26.161 432 HZ2 LYS 49 1HZ LYS 49 -3.151 4.649 26.548 433 HZ3 LYS 49 2HZ LYS 49 -4.657 5.316 26.164 434 H ASN 50 H ASN 50 -0.731 0.601 20.370 435 HA ASN 50 HA ASN 50 1.981 0.992 20.627 436 HB2 ASN 50 2HB ASN 50 0.638 -0.718 18.469 437 HB3 ASN 50 3HB ASN 50 2.270 -0.925 19.092 438 HD21 ASN 50 1HD2 ASN 50 2.003 -3.004 19.785 439 HD22 ASN 50 2HD2 ASN 50 0.939 -3.459 21.072 440 H PHE 51 H PHE 51 3.563 1.860 19.362 441 HA PHE 51 HA PHE 51 2.901 3.465 17.014 442 HB2 PHE 51 2HB PHE 51 5.267 4.207 17.127 443 HB3 PHE 51 3HB PHE 51 4.462 4.409 18.672 444 HD1 PHE 51 HD1 PHE 51 4.885 2.519 20.480 445 HD2 PHE 51 HD2 PHE 51 7.373 3.133 17.047 446 HE1 PHE 51 HE1 PHE 51 6.716 1.308 21.587 447 HE2 PHE 51 HE2 PHE 51 9.188 1.900 18.163 448 HZ PHE 51 HZ PHE 51 8.868 0.991 20.427 449 H GLU 52 H GLU 52 2.128 1.272 16.146 450 HA GLU 52 HA GLU 52 4.190 -0.677 15.450 451 HB2 GLU 52 2HB GLU 52 1.673 -0.999 16.512 452 HB3 GLU 52 3HB GLU 52 1.280 -1.165 14.810 453 HG2 GLU 52 2HG GLU 52 1.620 -3.359 15.729 454 HG3 GLU 52 3HG GLU 52 2.968 -3.006 14.645 455 H LYS 53 H LYS 53 5.051 -0.741 13.440 456 HA LYS 53 HA LYS 53 4.055 0.980 11.321 457 HB2 LYS 53 2HB LYS 53 6.318 -0.996 10.864 458 HB3 LYS 53 3HB LYS 53 6.091 0.607 10.176 459 HG2 LYS 53 2HG LYS 53 7.130 -0.134 12.916 460 HG3 LYS 53 3HG LYS 53 7.962 0.744 11.631 461 HD2 LYS 53 2HD LYS 53 6.576 2.708 12.001 462 HD3 LYS 53 3HD LYS 53 5.558 1.829 13.147 463 HE2 LYS 53 2HE LYS 53 7.568 1.542 14.625 464 HE3 LYS 53 3HE LYS 53 8.481 2.567 13.516 465 HZ1 LYS 53 3HZ LYS 53 6.971 4.376 13.976 466 HZ2 LYS 53 1HZ LYS 53 7.615 3.787 15.432 467 HZ3 LYS 53 2HZ LYS 53 6.027 3.389 14.975 468 H ILE 54 H ILE 54 2.179 0.203 10.444 469 HA ILE 54 HA ILE 54 1.839 -2.690 9.999 470 HB ILE 54 HB ILE 54 -0.277 -0.487 9.992 471 HG12 ILE 54 2HG1 ILE 54 0.655 -0.850 12.274 472 HG13 ILE 54 3HG1 ILE 54 -1.024 -1.366 12.182 473 HG21 ILE 54 1HG2 ILE 54 -0.940 -2.357 8.547 474 HG22 ILE 54 2HG2 ILE 54 -1.944 -2.332 10.000 475 HG23 ILE 54 3HG2 ILE 54 -0.632 -3.503 9.853 476 HD11 ILE 54 3HD1 ILE 54 0.283 -2.899 13.497 477 HD12 ILE 54 1HD1 ILE 54 1.405 -3.158 12.163 478 HD13 ILE 54 2HD1 ILE 54 -0.270 -3.711 12.033 479 H LEU 55 H LEU 55 1.721 -3.460 7.996 480 HA LEU 55 HA LEU 55 1.671 -1.632 5.665 481 HB2 LEU 55 2HB LEU 55 3.861 -2.719 6.102 482 HB3 LEU 55 3HB LEU 55 3.115 -4.301 5.991 483 HG LEU 55 HG LEU 55 2.864 -2.479 3.595 484 HD11 LEU 55 1HD1 LEU 55 5.195 -2.171 4.190 485 HD12 LEU 55 2HD1 LEU 55 5.054 -3.133 2.721 486 HD13 LEU 55 3HD1 LEU 55 5.435 -3.917 4.257 487 HD21 LEU 55 3HD2 LEU 55 3.072 -4.571 2.320 488 HD22 LEU 55 1HD2 LEU 55 1.794 -4.696 3.527 489 HD23 LEU 55 2HD2 LEU 55 3.353 -5.472 3.814 490 H ILE 56 H ILE 56 -0.004 -1.961 4.289 491 HA ILE 56 HA ILE 56 -1.667 -4.400 4.609 492 HB ILE 56 HB ILE 56 -2.614 -1.727 3.477 493 HG12 ILE 56 2HG1 ILE 56 -2.069 -1.466 5.924 494 HG13 ILE 56 3HG1 ILE 56 -3.776 -1.239 5.572 495 HG21 ILE 56 1HG2 ILE 56 -3.897 -3.644 2.661 496 HG22 ILE 56 2HG2 ILE 56 -4.892 -2.699 3.770 497 HG23 ILE 56 3HG2 ILE 56 -4.162 -4.210 4.311 498 HD11 ILE 56 3HD1 ILE 56 -4.257 -3.467 6.446 499 HD12 ILE 56 1HD1 ILE 56 -3.425 -2.459 7.629 500 HD13 ILE 56 2HD1 ILE 56 -2.536 -3.714 6.768 501 H ILE 57 H ILE 57 -1.693 -5.714 2.893 502 HA ILE 57 HA ILE 57 -1.157 -4.693 0.166 503 HB ILE 57 HB ILE 57 -1.059 -7.597 1.136 504 HG12 ILE 57 2HG1 ILE 57 1.271 -5.756 0.415 505 HG13 ILE 57 3HG1 ILE 57 0.821 -6.214 2.054 506 HG21 ILE 57 1HG2 ILE 57 -0.278 -6.412 -1.561 507 HG22 ILE 57 2HG2 ILE 57 -1.711 -7.392 -1.246 508 HG23 ILE 57 3HG2 ILE 57 -0.106 -8.108 -1.094 509 HD11 ILE 57 3HD1 ILE 57 2.723 -7.484 1.284 510 HD12 ILE 57 1HD1 ILE 57 1.807 -8.090 -0.097 511 HD13 ILE 57 2HD1 ILE 57 1.342 -8.546 1.546 512 H SER 58 H SER 58 -2.907 -4.578 -1.125 513 HA SER 58 HA SER 58 -5.206 -6.392 -0.714 514 HB2 SER 58 2HB SER 58 -5.838 -4.126 0.161 515 HB3 SER 58 3HB SER 58 -5.421 -3.408 -1.394 516 HG SER 58 HG SER 58 -7.517 -3.763 -1.665 517 H ASN 59 H ASN 59 -5.851 -7.336 -2.599 518 HA ASN 59 HA ASN 59 -4.374 -6.703 -5.056 519 HB2 ASN 59 2HB ASN 59 -5.365 -8.752 -5.983 520 HB3 ASN 59 3HB ASN 59 -4.582 -9.065 -4.446 521 HD21 ASN 59 1HD2 ASN 59 -6.728 -10.485 -5.940 522 HD22 ASN 59 2HD2 ASN 59 -7.991 -10.693 -4.785 523 H ASP 60 H ASP 60 -7.170 -5.663 -3.599 524 HA ASP 60 HA ASP 60 -8.576 -5.075 -6.137 525 HB2 ASP 60 2HB ASP 60 -9.797 -6.527 -4.469 526 HB3 ASP 60 3HB ASP 60 -9.713 -5.214 -3.302 527 H LYS 61 H LYS 61 -8.662 -2.998 -6.727 528 HA LYS 61 HA LYS 61 -7.215 -1.004 -5.238 529 HB2 LYS 61 2HB LYS 61 -7.608 0.460 -7.191 530 HB3 LYS 61 3HB LYS 61 -7.008 -1.125 -7.676 531 HG2 LYS 61 2HG LYS 61 -9.301 -1.812 -8.285 532 HG3 LYS 61 3HG LYS 61 -9.902 -0.218 -7.814 533 HD2 LYS 61 2HD LYS 61 -8.534 0.830 -9.588 534 HD3 LYS 61 3HD LYS 61 -7.883 -0.753 -10.033 535 HE2 LYS 61 2HE LYS 61 -10.798 0.091 -10.225 536 HE3 LYS 61 3HE LYS 61 -9.676 -0.081 -11.577 537 HZ1 LYS 61 3HZ LYS 61 -9.462 -2.457 -10.970 538 HZ2 LYS 61 1HZ LYS 61 -11.028 -2.025 -11.436 539 HZ3 LYS 61 2HZ LYS 61 -10.668 -2.249 -9.800 540 H GLN 62 H GLN 62 -10.630 -1.770 -5.630 541 HA GLN 62 HA GLN 62 -11.709 0.799 -4.928 542 HB2 GLN 62 2HB GLN 62 -13.142 -0.761 -6.112 543 HB3 GLN 62 3HB GLN 62 -12.899 -2.004 -4.896 544 HG2 GLN 62 2HG GLN 62 -15.123 -1.128 -4.636 545 HG3 GLN 62 3HG GLN 62 -14.172 -0.598 -3.255 546 HE21 GLN 62 1HE2 GLN 62 -13.685 1.626 -3.047 547 HE22 GLN 62 2HE2 GLN 62 -14.507 2.829 -3.972 548 H LEU 63 H LEU 63 -10.945 -2.175 -3.118 549 HA LEU 63 HA LEU 63 -11.739 -1.346 -0.541 550 HB2 LEU 63 2HB LEU 63 -9.507 -3.265 -1.334 551 HB3 LEU 63 3HB LEU 63 -10.153 -3.099 0.295 552 HG LEU 63 HG LEU 63 -11.660 -4.137 -2.136 553 HD11 LEU 63 1HD1 LEU 63 -10.733 -5.612 0.339 554 HD12 LEU 63 2HD1 LEU 63 -10.033 -5.741 -1.277 555 HD13 LEU 63 3HD1 LEU 63 -11.683 -6.288 -0.990 556 HD21 LEU 63 3HD2 LEU 63 -13.514 -4.628 -0.571 557 HD22 LEU 63 1HD2 LEU 63 -13.207 -2.901 -0.727 558 HD23 LEU 63 2HD2 LEU 63 -12.657 -3.766 0.713 559 H LEU 64 H LEU 64 -8.672 -1.082 -2.286 560 HA LEU 64 HA LEU 64 -7.064 0.137 -0.378 561 HB2 LEU 64 2HB LEU 64 -6.072 -0.687 -2.343 562 HB3 LEU 64 3HB LEU 64 -7.152 0.202 -3.388 563 HG LEU 64 HG LEU 64 -5.288 1.869 -1.718 564 HD11 LEU 64 1HD1 LEU 64 -3.438 1.576 -3.281 565 HD12 LEU 64 2HD1 LEU 64 -4.310 0.268 -4.075 566 HD13 LEU 64 3HD1 LEU 64 -3.792 0.096 -2.396 567 HD21 LEU 64 3HD2 LEU 64 -6.834 2.974 -3.303 568 HD22 LEU 64 1HD2 LEU 64 -6.135 2.059 -4.642 569 HD23 LEU 64 2HD2 LEU 64 -5.156 3.242 -3.771 570 H LYS 65 H LYS 65 -9.391 1.659 -2.620 571 HA LYS 65 HA LYS 65 -8.762 4.361 -2.033 572 HB2 LYS 65 2HB LYS 65 -11.353 3.159 -3.077 573 HB3 LYS 65 3HB LYS 65 -10.966 4.881 -3.085 574 HG2 LYS 65 2HG LYS 65 -9.100 4.491 -4.623 575 HG3 LYS 65 3HG LYS 65 -9.384 2.751 -4.556 576 HD2 LYS 65 2HD LYS 65 -10.368 3.551 -6.603 577 HD3 LYS 65 3HD LYS 65 -11.687 3.144 -5.504 578 HE2 LYS 65 2HE LYS 65 -11.807 5.614 -4.905 579 HE3 LYS 65 3HE LYS 65 -10.655 5.912 -6.208 580 HZ1 LYS 65 3HZ LYS 65 -12.949 6.248 -6.899 581 HZ2 LYS 65 1HZ LYS 65 -13.317 4.637 -6.538 582 HZ3 LYS 65 2HZ LYS 65 -12.222 4.999 -7.774 583 H GLU 66 H GLU 66 -11.482 2.306 -0.879 584 HA GLU 66 HA GLU 66 -12.664 4.070 0.930 585 HB2 GLU 66 2HB GLU 66 -12.445 1.048 1.261 586 HB3 GLU 66 3HB GLU 66 -13.630 2.087 2.043 587 HG2 GLU 66 2HG GLU 66 -13.431 1.433 -0.908 588 HG3 GLU 66 3HG GLU 66 -14.657 0.867 0.230 589 H MET 67 H MET 67 -10.040 1.803 1.366 590 HA MET 67 HA MET 67 -9.529 1.917 4.086 591 HB2 MET 67 2HB MET 67 -8.642 0.281 2.444 592 HB3 MET 67 3HB MET 67 -7.603 1.519 1.763 593 HG2 MET 67 2HG MET 67 -6.234 1.557 3.710 594 HG3 MET 67 3HG MET 67 -7.416 0.626 4.631 595 HE1 MET 67 3HE MET 67 -8.289 -1.613 2.446 596 HE2 MET 67 1HE MET 67 -7.993 -1.940 4.155 597 HE3 MET 67 2HE MET 67 -7.183 -2.902 2.920 598 H LEU 68 H LEU 68 -8.076 3.841 1.439 599 HA LEU 68 HA LEU 68 -6.377 5.387 3.162 600 HB2 LEU 68 2HB LEU 68 -7.138 5.704 0.237 601 HB3 LEU 68 3HB LEU 68 -5.942 6.713 1.043 602 HG LEU 68 HG LEU 68 -5.691 3.682 0.819 603 HD11 LEU 68 1HD1 LEU 68 -4.348 5.761 -0.917 604 HD12 LEU 68 2HD1 LEU 68 -5.654 4.684 -1.418 605 HD13 LEU 68 3HD1 LEU 68 -4.088 4.014 -0.964 606 HD21 LEU 68 3HD2 LEU 68 -3.656 5.795 1.607 607 HD22 LEU 68 1HD2 LEU 68 -3.336 4.069 1.412 608 HD23 LEU 68 2HD2 LEU 68 -4.422 4.621 2.684 609 H GLU 69 H GLU 69 -9.676 5.794 1.998 610 HA GLU 69 HA GLU 69 -10.034 8.538 2.670 611 HB2 GLU 69 2HB GLU 69 -12.070 6.269 2.861 612 HB3 GLU 69 3HB GLU 69 -12.457 7.987 2.893 613 HG2 GLU 69 2HG GLU 69 -11.195 6.540 0.552 614 HG3 GLU 69 3HG GLU 69 -12.914 6.872 0.714 615 H LEU 70 H LEU 70 -10.549 5.538 4.457 616 HA LEU 70 HA LEU 70 -11.344 6.629 6.934 617 HB2 LEU 70 2HB LEU 70 -10.215 3.909 6.171 618 HB3 LEU 70 3HB LEU 70 -10.908 4.255 7.749 619 HG LEU 70 HG LEU 70 -12.437 4.463 5.109 620 HD11 LEU 70 1HD1 LEU 70 -12.605 2.252 7.166 621 HD12 LEU 70 2HD1 LEU 70 -11.892 2.130 5.557 622 HD13 LEU 70 3HD1 LEU 70 -13.619 2.428 5.728 623 HD21 LEU 70 3HD2 LEU 70 -13.473 4.602 7.955 624 HD22 LEU 70 1HD2 LEU 70 -14.446 4.657 6.480 625 HD23 LEU 70 2HD2 LEU 70 -13.318 5.962 6.835 626 H ILE 71 H ILE 71 -8.159 5.705 5.675 627 HA ILE 71 HA ILE 71 -6.695 6.024 8.116 628 HB ILE 71 HB ILE 71 -5.729 5.974 5.220 629 HG12 ILE 71 2HG1 ILE 71 -5.580 3.821 7.385 630 HG13 ILE 71 3HG1 ILE 71 -6.727 3.832 6.054 631 HG21 ILE 71 1HG2 ILE 71 -4.053 5.918 7.757 632 HG22 ILE 71 2HG2 ILE 71 -4.088 7.209 6.555 633 HG23 ILE 71 3HG2 ILE 71 -3.440 5.627 6.127 634 HD11 ILE 71 3HD1 ILE 71 -4.925 2.288 5.621 635 HD12 ILE 71 1HD1 ILE 71 -3.729 3.571 5.807 636 HD13 ILE 71 2HD1 ILE 71 -4.872 3.614 4.460 637 H SER 72 H SER 72 -7.537 8.191 5.426 638 HA SER 72 HA SER 72 -5.834 10.356 6.110 639 HB2 SER 72 2HB SER 72 -6.870 10.161 3.887 640 HB3 SER 72 3HB SER 72 -8.476 10.337 4.591 641 HG SER 72 HG SER 72 -6.546 12.246 4.048 642 H LYS 73 H LYS 73 -9.031 9.345 7.216 643 HA LYS 73 HA LYS 73 -9.673 11.721 8.671 644 HB2 LYS 73 2HB LYS 73 -10.740 8.897 9.067 645 HB3 LYS 73 3HB LYS 73 -11.479 10.372 9.672 646 HG2 LYS 73 2HG LYS 73 -11.228 9.545 6.762 647 HG3 LYS 73 3HG LYS 73 -12.689 9.487 7.738 648 HD2 LYS 73 2HD LYS 73 -13.086 11.453 6.596 649 HD3 LYS 73 3HD LYS 73 -12.223 12.122 7.980 650 HE2 LYS 73 2HE LYS 73 -11.421 13.121 5.883 651 HE3 LYS 73 3HE LYS 73 -10.133 12.173 6.621 652 HZ1 LYS 73 3HZ LYS 73 -11.840 11.355 4.326 653 HZ2 LYS 73 1HZ LYS 73 -10.689 10.361 5.065 654 HZ3 LYS 73 2HZ LYS 73 -10.205 11.769 4.268 655 H LEU 74 H LEU 74 -7.977 8.725 9.411 656 HA LEU 74 HA LEU 74 -7.590 9.170 12.220 657 HB2 LEU 74 2HB LEU 74 -6.033 7.444 10.248 658 HB3 LEU 74 3HB LEU 74 -5.876 7.360 11.998 659 HG LEU 74 HG LEU 74 -8.441 6.717 10.479 660 HD11 LEU 74 1HD1 LEU 74 -6.702 5.099 9.908 661 HD12 LEU 74 2HD1 LEU 74 -7.959 4.359 10.895 662 HD13 LEU 74 3HD1 LEU 74 -6.405 4.784 11.620 663 HD21 LEU 74 3HD2 LEU 74 -8.865 7.451 12.778 664 HD22 LEU 74 1HD2 LEU 74 -7.718 6.257 13.396 665 HD23 LEU 74 2HD2 LEU 74 -9.205 5.733 12.601 666 H GLY 75 H GLY 75 -5.872 10.021 9.282 667 HA2 GLY 75 2HA GLY 75 -4.285 11.595 8.827 668 HA3 GLY 75 3HA GLY 75 -4.324 12.096 10.509 669 H TYR 76 H TYR 76 -2.980 9.756 8.246 670 HA TYR 76 HA TYR 76 -0.546 9.495 9.919 671 HB2 TYR 76 2HB TYR 76 -2.058 7.189 8.598 672 HB3 TYR 76 3HB TYR 76 -0.387 7.048 9.135 673 HD1 TYR 76 HD1 TYR 76 -0.206 8.195 11.726 674 HD2 TYR 76 HD2 TYR 76 -3.508 6.034 10.072 675 HE1 TYR 76 HE1 TYR 76 -0.901 7.561 13.983 676 HE2 TYR 76 HE2 TYR 76 -4.228 5.407 12.339 677 HH TYR 76 HH TYR 76 -3.060 6.886 15.114 678 H LYS 77 H LYS 77 1.388 9.272 8.777 679 HA LYS 77 HA LYS 77 1.404 10.195 6.025 680 HB2 LYS 77 2HB LYS 77 3.085 10.849 7.977 681 HB3 LYS 77 3HB LYS 77 3.904 9.355 7.550 682 HG2 LYS 77 2HG LYS 77 3.370 11.632 5.608 683 HG3 LYS 77 3HG LYS 77 4.876 11.425 6.501 684 HD2 LYS 77 2HD LYS 77 5.333 9.323 5.330 685 HD3 LYS 77 3HD LYS 77 3.762 9.385 4.527 686 HE2 LYS 77 2HE LYS 77 5.576 10.079 3.011 687 HE3 LYS 77 3HE LYS 77 4.447 11.402 3.302 688 HZ1 LYS 77 3HZ LYS 77 6.006 12.344 4.883 689 HZ2 LYS 77 1HZ LYS 77 6.751 12.137 3.381 690 HZ3 LYS 77 2HZ LYS 77 7.081 11.063 4.641 691 H VAL 78 H VAL 78 0.736 8.641 4.680 692 HA VAL 78 HA VAL 78 1.795 5.873 4.889 693 HB VAL 78 HB VAL 78 -0.751 6.857 3.531 694 HG11 VAL 78 1HG1 VAL 78 0.186 3.999 3.970 695 HG12 VAL 78 2HG1 VAL 78 0.097 4.830 2.417 696 HG13 VAL 78 3HG1 VAL 78 -1.383 4.475 3.309 697 HG21 VAL 78 3HG2 VAL 78 -1.929 5.719 5.398 698 HG22 VAL 78 1HG2 VAL 78 -0.930 7.069 5.946 699 HG23 VAL 78 2HG2 VAL 78 -0.372 5.409 6.164 700 H PHE 79 H PHE 79 2.947 5.044 3.271 701 HA PHE 79 HA PHE 79 3.372 6.532 0.760 702 HB2 PHE 79 2HB PHE 79 4.880 4.201 2.022 703 HB3 PHE 79 3HB PHE 79 5.289 4.937 0.485 704 HD1 PHE 79 HD2 PHE 79 5.354 5.399 4.164 705 HD2 PHE 79 HD1 PHE 79 6.512 7.055 0.392 706 HE1 PHE 79 HE2 PHE 79 6.915 6.917 5.302 707 HE2 PHE 79 HE1 PHE 79 8.077 8.561 1.543 708 HZ PHE 79 HZ PHE 79 8.279 8.497 3.997 709 H LEU 80 H LEU 80 2.443 5.678 -1.077 710 HA LEU 80 HA LEU 80 1.120 3.036 -0.932 711 HB2 LEU 80 2HB LEU 80 -0.526 4.803 -1.004 712 HB3 LEU 80 3HB LEU 80 0.279 5.586 -2.354 713 HG LEU 80 HG LEU 80 -0.349 3.708 -3.852 714 HD11 LEU 80 1HD1 LEU 80 -1.812 2.524 -1.484 715 HD12 LEU 80 2HD1 LEU 80 -0.334 1.891 -2.213 716 HD13 LEU 80 3HD1 LEU 80 -1.825 1.924 -3.146 717 HD21 LEU 80 3HD2 LEU 80 -2.788 4.085 -3.932 718 HD22 LEU 80 1HD2 LEU 80 -1.880 5.584 -3.734 719 HD23 LEU 80 2HD2 LEU 80 -2.709 4.870 -2.351 720 H LEU 81 H LEU 81 1.715 1.531 -2.397 721 HA LEU 81 HA LEU 81 2.981 2.382 -4.931 722 HB2 LEU 81 2HB LEU 81 4.399 0.890 -3.465 723 HB3 LEU 81 3HB LEU 81 3.191 -0.372 -3.636 724 HG LEU 81 HG LEU 81 3.603 -0.520 -6.058 725 HD11 LEU 81 1HD1 LEU 81 4.036 1.792 -6.599 726 HD12 LEU 81 2HD1 LEU 81 5.391 0.810 -7.151 727 HD13 LEU 81 3HD1 LEU 81 5.544 1.776 -5.682 728 HD21 LEU 81 3HD2 LEU 81 5.052 -1.871 -4.619 729 HD22 LEU 81 1HD2 LEU 81 6.228 -0.555 -4.537 730 HD23 LEU 81 2HD2 LEU 81 5.903 -1.361 -6.075 731 H LEU 82 H LEU 82 1.789 2.140 -6.675 732 HA LEU 82 HA LEU 82 -0.431 0.181 -6.762 733 HB2 LEU 82 2HB LEU 82 0.031 2.739 -8.345 734 HB3 LEU 82 3HB LEU 82 -1.299 1.627 -8.618 735 HG LEU 82 HG LEU 82 -0.880 3.203 -6.044 736 HD11 LEU 82 1HD1 LEU 82 -2.778 4.581 -6.775 737 HD12 LEU 82 2HD1 LEU 82 -2.828 3.718 -8.315 738 HD13 LEU 82 3HD1 LEU 82 -1.424 4.706 -7.899 739 HD21 LEU 82 3HD2 LEU 82 -3.219 1.484 -6.949 740 HD22 LEU 82 1HD2 LEU 82 -3.160 2.465 -5.478 741 HD23 LEU 82 2HD2 LEU 82 -2.070 1.094 -5.665 742 H GLN 83 H GLN 83 0.146 -1.610 -7.832 743 HA GLN 83 HA GLN 83 2.026 -1.524 -10.092 744 HB2 GLN 83 2HB GLN 83 2.466 -3.149 -8.160 745 HB3 GLN 83 3HB GLN 83 1.019 -4.022 -8.660 746 HG2 GLN 83 2HG GLN 83 2.056 -4.396 -10.907 747 HG3 GLN 83 3HG GLN 83 3.515 -3.578 -10.351 748 HE21 GLN 83 1HE2 GLN 83 3.332 -6.242 -11.365 749 HE22 GLN 83 2HE2 GLN 83 3.857 -7.305 -10.113 750 H ASP 84 H ASP 84 1.014 -1.259 -11.954 751 HA ASP 84 HA ASP 84 -1.026 -3.123 -12.832 752 HB2 ASP 84 2HB ASP 84 -2.321 -1.213 -11.786 753 HB3 ASP 84 3HB ASP 84 -1.561 -0.113 -12.927 754 H GLN 85 H GLN 85 -0.869 -3.444 -15.048 755 HA GLN 85 HA GLN 85 1.651 -2.726 -16.211 756 HB2 GLN 85 2HB GLN 85 -0.658 -4.316 -17.389 757 HB3 GLN 85 3HB GLN 85 0.972 -4.229 -18.053 758 HG2 GLN 85 2HG GLN 85 1.876 -5.354 -16.086 759 HG3 GLN 85 3HG GLN 85 0.282 -5.377 -15.327 760 HE21 GLN 85 1HE2 GLN 85 -1.344 -6.760 -16.230 761 HE22 GLN 85 2HE2 GLN 85 -0.913 -8.111 -17.223 762 H ASP 86 H ASP 86 -1.433 -1.273 -16.351 763 HA ASP 86 HA ASP 86 -0.854 0.091 -18.927 764 HB2 ASP 86 2HB ASP 86 -3.461 -0.512 -17.475 765 HB3 ASP 86 3HB ASP 86 -3.375 0.775 -18.668 766 H GLU 87 H GLU 87 0.632 1.456 -18.026 767 HA GLU 87 HA GLU 87 0.405 2.958 -15.667 768 HB2 GLU 87 2HB GLU 87 2.157 3.267 -18.125 769 HB3 GLU 87 3HB GLU 87 2.297 4.342 -16.738 770 HG2 GLU 87 2HG GLU 87 2.768 2.365 -15.289 771 HG3 GLU 87 3HG GLU 87 2.745 1.340 -16.725 772 H ASN 88 H ASN 88 -0.900 3.581 -18.833 773 HA ASN 88 HA ASN 88 -1.161 6.395 -18.742 774 HB2 ASN 88 2HB ASN 88 -2.767 4.263 -20.213 775 HB3 ASN 88 3HB ASN 88 -3.045 5.986 -20.431 776 HD21 ASN 88 1HD2 ASN 88 -2.534 5.712 -22.641 777 HD22 ASN 88 2HD2 ASN 88 -0.892 5.576 -23.173 778 H GLU 89 H GLU 89 -3.615 3.874 -17.991 779 HA GLU 89 HA GLU 89 -5.484 5.741 -16.830 780 HB2 GLU 89 2HB GLU 89 -6.838 3.762 -16.280 781 HB3 GLU 89 3HB GLU 89 -6.278 3.689 -17.948 782 HG2 GLU 89 2HG GLU 89 -4.428 2.152 -17.183 783 HG3 GLU 89 3HG GLU 89 -5.181 2.123 -15.589 784 H LEU 90 H LEU 90 -2.905 3.702 -15.668 785 HA LEU 90 HA LEU 90 -3.496 3.582 -12.911 786 HB2 LEU 90 2HB LEU 90 -1.905 2.065 -14.008 787 HB3 LEU 90 3HB LEU 90 -0.843 3.411 -14.383 788 HG LEU 90 HG LEU 90 -0.401 3.743 -11.952 789 HD11 LEU 90 1HD1 LEU 90 -2.444 2.963 -10.980 790 HD12 LEU 90 2HD1 LEU 90 -1.114 2.008 -10.342 791 HD13 LEU 90 3HD1 LEU 90 -2.171 1.320 -11.571 792 HD21 LEU 90 3HD2 LEU 90 1.139 2.362 -13.251 793 HD22 LEU 90 1HD2 LEU 90 0.170 0.922 -12.917 794 HD23 LEU 90 2HD2 LEU 90 1.002 1.757 -11.601 795 H GLU 91 H GLU 91 -1.690 5.932 -14.851 796 HA GLU 91 HA GLU 91 -0.681 7.469 -12.638 797 HB2 GLU 91 2HB GLU 91 0.435 7.405 -14.851 798 HB3 GLU 91 3HB GLU 91 -0.950 8.216 -15.577 799 HG2 GLU 91 2HG GLU 91 -0.515 10.236 -14.289 800 HG3 GLU 91 3HG GLU 91 0.774 9.432 -13.389 801 H GLU 92 H GLU 92 -3.424 7.757 -14.863 802 HA GLU 92 HA GLU 92 -4.588 10.120 -13.892 803 HB2 GLU 92 2HB GLU 92 -5.957 7.658 -15.036 804 HB3 GLU 92 3HB GLU 92 -6.733 9.226 -14.814 805 HG2 GLU 92 2HG GLU 92 -5.111 10.226 -16.428 806 HG3 GLU 92 3HG GLU 92 -4.412 8.623 -16.682 807 H PHE 93 H PHE 93 -4.695 6.820 -12.654 808 HA PHE 93 HA PHE 93 -6.670 7.334 -10.590 809 HB2 PHE 93 2HB PHE 93 -6.464 5.089 -11.621 810 HB3 PHE 93 3HB PHE 93 -4.799 4.968 -11.069 811 HD1 PHE 93 HD1 PHE 93 -8.183 5.674 -9.554 812 HD2 PHE 93 HD2 PHE 93 -4.470 3.566 -9.195 813 HE1 PHE 93 HE1 PHE 93 -8.972 4.603 -7.488 814 HE2 PHE 93 HE2 PHE 93 -5.278 2.511 -7.120 815 HZ PHE 93 HZ PHE 93 -7.530 3.023 -6.276 816 H LYS 94 H LYS 94 -3.145 7.194 -10.858 817 HA LYS 94 HA LYS 94 -2.428 7.160 -8.146 818 HB2 LYS 94 2HB LYS 94 -0.777 6.629 -9.850 819 HB3 LYS 94 3HB LYS 94 -0.920 8.229 -10.574 820 HG2 LYS 94 2HG LYS 94 0.121 9.264 -8.612 821 HG3 LYS 94 3HG LYS 94 0.118 7.720 -7.772 822 HD2 LYS 94 2HD LYS 94 2.350 8.082 -8.531 823 HD3 LYS 94 3HD LYS 94 1.657 6.819 -9.552 824 HE2 LYS 94 2HE LYS 94 2.851 8.292 -11.007 825 HE3 LYS 94 3HE LYS 94 1.141 8.644 -11.258 826 HZ1 LYS 94 3HZ LYS 94 3.057 10.214 -9.614 827 HZ2 LYS 94 1HZ LYS 94 1.402 10.537 -9.724 828 HZ3 LYS 94 2HZ LYS 94 2.382 10.672 -11.094 829 H ARG 95 H ARG 95 -2.800 9.878 -10.405 830 HA ARG 95 HA ARG 95 -1.899 11.936 -8.720 831 HB2 ARG 95 2HB ARG 95 -2.923 13.499 -10.335 832 HB3 ARG 95 3HB ARG 95 -1.997 12.235 -11.130 833 HG2 ARG 95 2HG ARG 95 -3.996 11.104 -11.848 834 HG3 ARG 95 3HG ARG 95 -5.017 12.149 -10.857 835 HD2 ARG 95 2HD ARG 95 -3.344 13.084 -13.221 836 HD3 ARG 95 3HD ARG 95 -5.078 12.747 -13.274 837 HE ARG 95 HE ARG 95 -4.286 14.674 -11.268 838 HH11 ARG 95 1HH1 ARG 95 -5.309 14.336 -14.621 839 HH12 ARG 95 2HH1 ARG 95 -5.860 15.977 -14.735 840 HH21 ARG 95 1HH2 ARG 95 -5.011 16.799 -11.428 841 HH22 ARG 95 2HH2 ARG 95 -5.690 17.383 -12.914 842 H LYS 96 H LYS 96 -5.021 10.397 -8.868 843 HA LYS 96 HA LYS 96 -6.655 12.314 -7.584 844 HB2 LYS 96 2HB LYS 96 -6.857 9.273 -7.336 845 HB3 LYS 96 3HB LYS 96 -8.153 10.436 -7.079 846 HG2 LYS 96 2HG LYS 96 -8.077 11.033 -9.487 847 HG3 LYS 96 3HG LYS 96 -6.805 9.827 -9.725 848 HD2 LYS 96 2HD LYS 96 -8.397 8.046 -8.956 849 HD3 LYS 96 3HD LYS 96 -9.660 9.274 -8.805 850 HE2 LYS 96 2HE LYS 96 -8.266 8.417 -11.365 851 HE3 LYS 96 3HE LYS 96 -9.935 8.074 -10.910 852 HZ1 LYS 96 3HZ LYS 96 -9.868 9.878 -12.459 853 HZ2 LYS 96 1HZ LYS 96 -8.770 10.738 -11.502 854 HZ3 LYS 96 2HZ LYS 96 -10.354 10.491 -10.957 855 H ILE 97 H ILE 97 -4.889 9.522 -6.310 856 HA ILE 97 HA ILE 97 -5.540 10.019 -3.542 857 HB ILE 97 HB ILE 97 -3.639 7.973 -4.781 858 HG12 ILE 97 2HG1 ILE 97 -6.573 7.589 -3.996 859 HG13 ILE 97 3HG1 ILE 97 -6.022 7.852 -5.647 860 HG21 ILE 97 1HG2 ILE 97 -4.947 8.010 -2.034 861 HG22 ILE 97 2HG2 ILE 97 -3.236 8.270 -2.373 862 HG23 ILE 97 3HG2 ILE 97 -3.964 6.695 -2.683 863 HD11 ILE 97 3HD1 ILE 97 -5.314 5.497 -3.900 864 HD12 ILE 97 1HD1 ILE 97 -4.751 5.767 -5.554 865 HD13 ILE 97 2HD1 ILE 97 -6.466 5.519 -5.236 866 H GLU 98 H GLU 98 -2.877 10.615 -5.685 867 HA GLU 98 HA GLU 98 -0.829 11.239 -3.805 868 HB2 GLU 98 2HB GLU 98 -0.467 10.580 -6.199 869 HB3 GLU 98 3HB GLU 98 -1.149 12.121 -6.705 870 HG2 GLU 98 2HG GLU 98 0.715 13.293 -5.532 871 HG3 GLU 98 3HG GLU 98 1.404 11.720 -5.109 872 H SER 99 H SER 99 -3.416 13.027 -5.403 873 HA SER 99 HA SER 99 -2.691 15.647 -4.452 874 HB2 SER 99 2HB SER 99 -3.995 15.345 -6.534 875 HB3 SER 99 3HB SER 99 -5.307 14.602 -5.621 876 HG SER 99 HG SER 99 -6.006 16.587 -5.557 877 H GLN 100 H GLN 100 -4.460 12.906 -3.189 878 HA GLN 100 HA GLN 100 -5.710 14.321 -0.987 879 HB2 GLN 100 2HB GLN 100 -5.293 11.341 -1.502 880 HB3 GLN 100 3HB GLN 100 -6.189 11.986 -0.128 881 HG2 GLN 100 2HG GLN 100 -7.829 13.009 -1.681 882 HG3 GLN 100 3HG GLN 100 -6.936 12.348 -3.053 883 HE21 GLN 100 1HE2 GLN 100 -9.721 11.860 -2.189 884 HE22 GLN 100 2HE2 GLN 100 -9.861 10.152 -1.962 885 H GLY 101 H GLY 101 -2.530 13.771 -1.608 886 HA2 GLY 101 2HA GLY 101 -0.785 14.450 -0.248 887 HA3 GLY 101 3HA GLY 101 -1.823 14.324 1.165 888 H TYR 102 H TYR 102 -1.152 11.857 -1.289 889 HA TYR 102 HA TYR 102 0.305 10.223 0.719 890 HB2 TYR 102 2HB TYR 102 -1.636 9.320 -1.458 891 HB3 TYR 102 3HB TYR 102 -0.578 8.209 -0.588 892 HD1 TYR 102 HD1 TYR 102 -0.800 8.089 1.965 893 HD2 TYR 102 HD2 TYR 102 -3.766 9.928 -0.500 894 HE1 TYR 102 HE1 TYR 102 -2.429 7.899 3.783 895 HE2 TYR 102 HE2 TYR 102 -5.404 9.734 1.329 896 HH TYR 102 HH TYR 102 -5.739 8.393 3.361 897 H GLU 103 H GLU 103 2.301 9.529 0.129 898 HA GLU 103 HA GLU 103 3.440 10.326 -2.392 899 HB2 GLU 103 2HB GLU 103 4.864 10.406 -0.429 900 HB3 GLU 103 3HB GLU 103 4.570 8.713 -0.066 901 HG2 GLU 103 2HG GLU 103 6.839 9.163 -1.025 902 HG3 GLU 103 3HG GLU 103 5.901 7.993 -1.946 903 H VAL 104 H VAL 104 2.447 9.283 -4.038 904 HA VAL 104 HA VAL 104 2.196 6.341 -3.976 905 HB VAL 104 HB VAL 104 0.712 8.224 -5.864 906 HG11 VAL 104 1HG1 VAL 104 0.187 5.339 -5.058 907 HG12 VAL 104 2HG1 VAL 104 0.884 5.872 -6.590 908 HG13 VAL 104 3HG1 VAL 104 -0.785 6.285 -6.189 909 HG21 VAL 104 3HG2 VAL 104 -0.330 7.136 -3.223 910 HG22 VAL 104 1HG2 VAL 104 -1.280 8.020 -4.421 911 HG23 VAL 104 2HG2 VAL 104 0.041 8.824 -3.571 912 H ARG 105 H ARG 105 3.430 5.205 -5.385 913 HA ARG 105 HA ARG 105 4.483 6.547 -7.827 914 HB2 ARG 105 2HB ARG 105 5.824 4.352 -6.175 915 HB3 ARG 105 3HB ARG 105 6.426 4.941 -7.725 916 HG2 ARG 105 2HG ARG 105 6.108 6.648 -5.228 917 HG3 ARG 105 3HG ARG 105 7.620 5.909 -5.756 918 HD2 ARG 105 2HD ARG 105 7.744 7.313 -7.687 919 HD3 ARG 105 3HD ARG 105 6.068 7.842 -7.508 920 HE ARG 105 HE ARG 105 7.308 8.622 -5.190 921 HH11 ARG 105 1HH1 ARG 105 7.846 9.324 -8.597 922 HH12 ARG 105 2HH1 ARG 105 8.467 10.911 -8.288 923 HH21 ARG 105 1HH2 ARG 105 7.989 10.742 -4.816 924 HH22 ARG 105 2HH2 ARG 105 8.550 11.721 -6.135 925 H LYS 106 H LYS 106 4.776 5.180 -9.642 926 HA LYS 106 HA LYS 106 2.745 3.081 -9.998 927 HB2 LYS 106 2HB LYS 106 4.503 4.612 -11.976 928 HB3 LYS 106 3HB LYS 106 3.333 3.384 -12.450 929 HG2 LYS 106 2HG LYS 106 1.488 4.750 -11.933 930 HG3 LYS 106 3HG LYS 106 2.436 5.804 -10.882 931 HD2 LYS 106 2HD LYS 106 1.889 6.971 -12.970 932 HD3 LYS 106 3HD LYS 106 3.628 6.718 -12.846 933 HE2 LYS 106 2HE LYS 106 3.371 4.734 -14.372 934 HE3 LYS 106 3HE LYS 106 1.671 5.170 -14.564 935 HZ1 LYS 106 3HZ LYS 106 2.374 7.312 -15.468 936 HZ2 LYS 106 1HZ LYS 106 2.996 6.021 -16.373 937 HZ3 LYS 106 2HZ LYS 106 3.998 6.862 -15.303 938 H VAL 107 H VAL 107 3.308 1.042 -10.837 939 HA VAL 107 HA VAL 107 5.949 0.479 -11.810 940 HB VAL 107 HB VAL 107 6.364 0.119 -9.409 941 HG11 VAL 107 1HG1 VAL 107 4.100 -0.427 -8.641 942 HG12 VAL 107 2HG1 VAL 107 5.262 -1.643 -8.108 943 HG13 VAL 107 3HG1 VAL 107 4.184 -1.986 -9.463 944 HG21 VAL 107 3HG2 VAL 107 6.306 -2.513 -10.922 945 HG22 VAL 107 1HG2 VAL 107 7.313 -2.141 -9.519 946 HG23 VAL 107 2HG2 VAL 107 7.562 -1.280 -11.038 947 H THR 108 H THR 108 6.044 -1.444 -13.002 948 HA THR 108 HA THR 108 3.485 -2.803 -13.628 949 HB THR 108 HB THR 108 4.496 -3.114 -15.947 950 HG1 THR 108 HG1 THR 108 6.620 -2.737 -15.829 951 HG21 THR 108 3HG2 THR 108 2.851 -1.302 -15.581 952 HG22 THR 108 1HG2 THR 108 4.083 -0.823 -16.754 953 HG23 THR 108 2HG2 THR 108 4.159 -0.220 -15.098 954 H ASP 109 H ASP 109 6.988 -3.082 -13.163 955 HA ASP 109 HA ASP 109 7.072 -5.906 -13.916 956 HB2 ASP 109 2HB ASP 109 9.341 -4.035 -13.092 957 HB3 ASP 109 3HB ASP 109 9.524 -5.641 -13.798 958 H ASP 110 H ASP 110 8.176 -7.469 -12.613 959 HA ASP 110 HA ASP 110 7.085 -7.696 -9.994 960 HB2 ASP 110 2HB ASP 110 9.157 -9.457 -11.393 961 HB3 ASP 110 3HB ASP 110 8.248 -9.896 -9.946 962 H GLU 111 H GLU 111 10.424 -7.423 -11.217 963 HA GLU 111 HA GLU 111 11.764 -7.589 -8.731 964 HB2 GLU 111 2HB GLU 111 13.730 -6.623 -9.958 965 HB3 GLU 111 3HB GLU 111 13.011 -7.998 -10.787 966 HG2 GLU 111 2HG GLU 111 12.039 -6.627 -12.477 967 HG3 GLU 111 3HG GLU 111 12.285 -5.156 -11.548 968 H GLU 112 H GLU 112 10.537 -4.941 -10.681 969 HA GLU 112 HA GLU 112 11.708 -2.798 -9.254 970 HB2 GLU 112 2HB GLU 112 10.935 -2.810 -11.679 971 HB3 GLU 112 3HB GLU 112 9.280 -2.757 -11.090 972 HG2 GLU 112 2HG GLU 112 9.913 -0.531 -11.722 973 HG3 GLU 112 3HG GLU 112 9.803 -0.573 -9.961 974 H ALA 113 H ALA 113 8.580 -4.474 -9.102 975 HA ALA 113 HA ALA 113 7.135 -2.792 -7.411 976 HB1 ALA 113 3HB ALA 113 5.791 -4.777 -6.847 977 HB2 ALA 113 1HB ALA 113 7.041 -5.829 -7.524 978 HB3 ALA 113 2HB ALA 113 6.147 -4.730 -8.576 979 H LEU 114 H LEU 114 9.290 -5.517 -6.586 980 HA LEU 114 HA LEU 114 9.012 -5.390 -3.773 981 HB2 LEU 114 2HB LEU 114 11.472 -6.390 -5.267 982 HB3 LEU 114 3HB LEU 114 10.977 -6.826 -3.638 983 HG LEU 114 HG LEU 114 9.691 -7.692 -6.257 984 HD11 LEU 114 1HD1 LEU 114 11.713 -8.920 -5.608 985 HD12 LEU 114 2HD1 LEU 114 10.285 -9.948 -5.551 986 HD13 LEU 114 3HD1 LEU 114 10.983 -9.326 -4.050 987 HD21 LEU 114 3HD2 LEU 114 7.873 -7.240 -4.688 988 HD22 LEU 114 1HD2 LEU 114 8.649 -8.241 -3.457 989 HD23 LEU 114 2HD2 LEU 114 8.047 -8.972 -4.948 990 H LYS 115 H LYS 115 11.239 -3.826 -6.026 991 HA LYS 115 HA LYS 115 13.074 -2.756 -4.137 992 HB2 LYS 115 2HB LYS 115 12.503 -1.980 -7.020 993 HB3 LYS 115 3HB LYS 115 13.845 -1.334 -6.078 994 HG2 LYS 115 2HG LYS 115 14.839 -3.553 -5.888 995 HG3 LYS 115 3HG LYS 115 13.452 -4.275 -6.715 996 HD2 LYS 115 2HD LYS 115 14.011 -2.899 -8.744 997 HD3 LYS 115 3HD LYS 115 15.452 -2.310 -7.910 998 HE2 LYS 115 2HE LYS 115 16.301 -4.633 -7.777 999 HE3 LYS 115 3HE LYS 115 14.866 -5.200 -8.633 1000 HZ1 LYS 115 3HZ LYS 115 16.891 -3.315 -9.708 1001 HZ2 LYS 115 1HZ LYS 115 15.516 -3.855 -10.532 1002 HZ3 LYS 115 2HZ LYS 115 16.742 -4.945 -10.123 1003 H ILE 116 H ILE 116 10.241 -1.273 -5.818 1004 HA ILE 116 HA ILE 116 10.665 1.352 -4.779 1005 HB ILE 116 HB ILE 116 8.055 0.204 -5.874 1006 HG12 ILE 116 2HG1 ILE 116 10.032 0.165 -7.511 1007 HG13 ILE 116 3HG1 ILE 116 8.625 1.065 -8.052 1008 HG21 ILE 116 1HG2 ILE 116 8.899 3.103 -5.456 1009 HG22 ILE 116 2HG2 ILE 116 7.637 2.238 -4.576 1010 HG23 ILE 116 3HG2 ILE 116 7.429 2.588 -6.292 1011 HD11 ILE 116 3HD1 ILE 116 10.747 2.148 -8.602 1012 HD12 ILE 116 1HD1 ILE 116 11.126 2.302 -6.889 1013 HD13 ILE 116 2HD1 ILE 116 9.740 3.163 -7.573 1014 H VAL 117 H VAL 117 8.804 -1.464 -3.598 1015 HA VAL 117 HA VAL 117 7.525 -0.234 -1.394 1016 HB VAL 117 HB VAL 117 8.607 -3.095 -1.498 1017 HG11 VAL 117 1HG1 VAL 117 8.133 -2.378 0.814 1018 HG12 VAL 117 2HG1 VAL 117 6.950 -3.575 0.290 1019 HG13 VAL 117 3HG1 VAL 117 6.510 -1.866 0.341 1020 HG21 VAL 117 3HG2 VAL 117 6.332 -3.788 -2.130 1021 HG22 VAL 117 1HG2 VAL 117 6.985 -2.658 -3.317 1022 HG23 VAL 117 2HG2 VAL 117 5.802 -2.103 -2.135 1023 H ARG 118 H ARG 118 10.749 -1.730 -1.720 1024 HA ARG 118 HA ARG 118 11.622 -1.257 0.949 1025 HB2 ARG 118 2HB ARG 118 13.249 -1.795 -1.566 1026 HB3 ARG 118 3HB ARG 118 13.909 -1.790 0.069 1027 HG2 ARG 118 2HG ARG 118 12.505 -3.702 0.678 1028 HG3 ARG 118 3HG ARG 118 11.740 -3.674 -0.912 1029 HD2 ARG 118 2HD ARG 118 13.372 -5.441 -0.914 1030 HD3 ARG 118 3HD ARG 118 13.989 -4.140 -1.931 1031 HE ARG 118 HE ARG 118 15.089 -3.647 0.522 1032 HH11 ARG 118 1HH1 ARG 118 15.147 -6.433 -1.642 1033 HH12 ARG 118 2HH1 ARG 118 16.705 -6.966 -1.097 1034 HH21 ARG 118 1HH2 ARG 118 17.120 -4.384 1.230 1035 HH22 ARG 118 2HH2 ARG 118 17.820 -5.810 0.523 1036 H GLU 119 H GLU 119 11.525 0.797 -1.895 1037 HA GLU 119 HA GLU 119 13.283 2.847 -0.956 1038 HB2 GLU 119 2HB GLU 119 10.977 2.918 -2.951 1039 HB3 GLU 119 3HB GLU 119 11.980 4.324 -2.601 1040 HG2 GLU 119 2HG GLU 119 12.981 1.693 -3.730 1041 HG3 GLU 119 3HG GLU 119 12.656 3.144 -4.675 1042 H PHE 120 H PHE 120 9.746 2.439 -0.884 1043 HA PHE 120 HA PHE 120 9.025 4.662 0.641 1044 HB2 PHE 120 2HB PHE 120 7.725 1.923 0.390 1045 HB3 PHE 120 3HB PHE 120 6.968 3.270 1.238 1046 HD1 PHE 120 HD2 PHE 120 7.788 5.519 -0.666 1047 HD2 PHE 120 HD1 PHE 120 6.150 1.626 -1.395 1048 HE1 PHE 120 HE2 PHE 120 6.747 6.337 -2.729 1049 HE2 PHE 120 HE1 PHE 120 5.127 2.479 -3.449 1050 HZ PHE 120 HZ PHE 120 5.410 4.811 -4.113 1051 H MET 121 H MET 121 9.942 1.407 1.685 1052 HA MET 121 HA MET 121 9.522 1.853 4.479 1053 HB2 MET 121 2HB MET 121 10.997 -0.354 2.991 1054 HB3 MET 121 3HB MET 121 10.724 -0.358 4.730 1055 HG2 MET 121 2HG MET 121 8.258 -0.309 4.290 1056 HG3 MET 121 3HG MET 121 8.601 -0.481 2.568 1057 HE1 MET 121 3HE MET 121 9.836 -2.652 1.529 1058 HE2 MET 121 1HE MET 121 10.317 -4.043 2.500 1059 HE3 MET 121 2HE MET 121 11.158 -2.506 2.688 1060 H GLN 122 H GLN 122 12.276 2.269 2.320 1061 HA GLN 122 HA GLN 122 14.307 2.626 4.289 1062 HB2 GLN 122 2HB GLN 122 14.825 2.200 1.909 1063 HB3 GLN 122 3HB GLN 122 14.109 3.737 1.457 1064 HG2 GLN 122 2HG GLN 122 16.479 4.001 1.385 1065 HG3 GLN 122 3HG GLN 122 15.895 4.902 2.777 1066 HE21 GLN 122 1HE2 GLN 122 18.569 3.883 2.181 1067 HE22 GLN 122 2HE2 GLN 122 19.013 2.880 3.519 1068 H LYS 123 H LYS 123 12.115 4.859 2.630 1069 HA LYS 123 HA LYS 123 13.057 7.277 3.832 1070 HB2 LYS 123 2HB LYS 123 10.374 6.641 2.520 1071 HB3 LYS 123 3HB LYS 123 10.925 8.260 2.954 1072 HG2 LYS 123 2HG LYS 123 12.769 8.108 1.370 1073 HG3 LYS 123 3HG LYS 123 12.348 6.435 0.990 1074 HD2 LYS 123 2HD LYS 123 10.186 7.205 0.038 1075 HD3 LYS 123 3HD LYS 123 10.614 8.878 0.419 1076 HE2 LYS 123 2HE LYS 123 12.542 8.732 -1.111 1077 HE3 LYS 123 3HE LYS 123 12.138 7.053 -1.473 1078 HZ1 LYS 123 3HZ LYS 123 9.998 7.863 -2.353 1079 HZ2 LYS 123 1HZ LYS 123 11.336 8.443 -3.208 1080 HZ3 LYS 123 2HZ LYS 123 10.524 9.454 -2.124 1081 H ALA 124 H ALA 124 10.382 5.049 4.502 1082 HA ALA 124 HA ALA 124 9.242 6.368 6.732 1083 HB1 ALA 124 3HB ALA 124 8.028 4.677 5.413 1084 HB2 ALA 124 1HB ALA 124 8.077 4.233 7.122 1085 HB3 ALA 124 2HB ALA 124 9.146 3.431 5.965 1086 H GLY 125 H GLY 125 11.860 4.031 6.344 1087 HA2 GLY 125 2HA GLY 125 12.243 3.227 9.007 1088 HA3 GLY 125 3HA GLY 125 13.456 3.208 7.742 1089 H SER 126 H SER 126 13.663 5.937 7.180 1090 HA SER 126 HA SER 126 15.414 6.840 9.226 1091 HB2 SER 126 2HB SER 126 15.718 7.436 6.841 1092 HB3 SER 126 3HB SER 126 14.226 8.375 6.875 1093 HG SER 126 HG SER 126 16.276 9.534 7.165 1094 H LEU 127 H LEU 127 12.039 7.402 8.549 1095 HA LEU 127 HA LEU 127 11.771 9.826 10.118 1096 HB2 LEU 127 2HB LEU 127 9.711 8.025 8.779 1097 HB3 LEU 127 3HB LEU 127 9.349 9.584 9.510 1098 HG LEU 127 HG LEU 127 11.238 9.217 7.148 1099 HD11 LEU 127 1HD1 LEU 127 8.995 8.572 6.466 1100 HD12 LEU 127 2HD1 LEU 127 9.463 10.093 5.711 1101 HD13 LEU 127 3HD1 LEU 127 8.342 10.095 7.076 1102 HD21 LEU 127 3HD2 LEU 127 10.033 11.743 8.322 1103 HD22 LEU 127 1HD2 LEU 127 11.049 11.649 6.878 1104 HD23 LEU 127 2HD2 LEU 127 11.717 11.226 8.451 1105 H GLU 128 H GLU 128 10.675 6.442 10.354 1106 HA GLU 128 HA GLU 128 9.352 6.781 12.883 1107 HB2 GLU 128 2HB GLU 128 10.006 4.299 11.257 1108 HB3 GLU 128 3HB GLU 128 9.049 4.278 12.737 1109 HG2 GLU 128 2HG GLU 128 8.329 5.822 10.229 1110 HG3 GLU 128 3HG GLU 128 7.683 4.234 10.645 1111 H HIS 129 H HIS 129 12.283 4.960 11.879 1112 HA HIS 129 HA HIS 129 13.154 4.532 14.592 1113 HB2 HIS 129 2HB HIS 129 13.846 2.980 12.776 1114 HB3 HIS 129 3HB HIS 129 14.691 4.284 11.956 1115 HD1 HIS 129 HD1 HIS 129 14.943 2.002 14.943 1116 HD2 HIS 129 HD2 HIS 129 17.269 4.815 12.957 1117 HE1 HIS 129 HE1 HIS 129 17.266 1.732 15.855 1118 HE2 HIS 129 HE2 HIS 129 18.594 3.581 14.785 1119 H HIS 130 H HIS 130 13.131 6.520 15.550 1120 HA HIS 130 HA HIS 130 14.152 8.940 14.489 1121 HB2 HIS 130 2HB HIS 130 12.368 8.777 16.252 1122 HB3 HIS 130 3HB HIS 130 13.577 8.229 17.402 1123 HD1 HIS 130 HD1 HIS 130 11.901 11.222 16.302 1124 HD2 HIS 130 HD2 HIS 130 15.665 10.351 17.825 1125 HE1 HIS 130 HE1 HIS 130 12.812 13.396 17.149 1126 HE2 HIS 130 HE2 HIS 130 15.114 12.855 17.996 1127 H HIS 131 H HIS 131 16.234 8.426 13.790 1128 HA HIS 131 HA HIS 131 18.340 7.612 15.579 1129 HB2 HIS 131 2HB HIS 131 19.856 8.172 13.609 1130 HB3 HIS 131 3HB HIS 131 18.636 6.945 13.310 1131 HD1 HIS 131 HD1 HIS 131 19.737 10.334 12.237 1132 HD2 HIS 131 HD2 HIS 131 16.587 7.728 11.480 1133 HE1 HIS 131 HE1 HIS 131 18.626 11.194 10.155 1134 HE2 HIS 131 HE2 HIS 131 16.858 9.495 9.627 1135 H HIS 132 H HIS 132 18.666 8.932 17.194 1136 HA HIS 132 HA HIS 132 17.994 11.587 17.466 1137 HB2 HIS 132 2HB HIS 132 19.231 11.539 19.581 1138 HB3 HIS 132 3HB HIS 132 18.398 10.009 19.353 1139 HD1 HIS 132 HD1 HIS 132 21.766 11.492 19.788 1140 HD2 HIS 132 HD2 HIS 132 20.160 7.798 18.791 1141 HE1 HIS 132 HE1 HIS 132 23.642 9.854 20.030 1142 HE2 HIS 132 HE2 HIS 132 22.681 7.662 19.245 1143 H HIS 133 H HIS 133 18.933 13.526 17.038 1144 HA HIS 133 HA HIS 133 21.812 13.747 16.625 1145 HB2 HIS 133 2HB HIS 133 21.580 15.059 14.530 1146 HB3 HIS 133 3HB HIS 133 21.084 13.387 14.346 1147 HD1 HIS 133 HD1 HIS 133 18.376 13.012 14.325 1148 HD2 HIS 133 HD2 HIS 133 19.748 16.866 13.596 1149 HE1 HIS 133 HE1 HIS 133 16.469 14.227 13.239 1150 HE2 HIS 133 HE2 HIS 133 17.291 16.575 12.914 1151 H HIS 134 H HIS 134 21.425 14.594 18.739 1152 HA HIS 134 HA HIS 134 21.258 17.551 18.553 1153 HB2 HIS 134 2HB HIS 134 20.566 15.874 21.022 1154 HB3 HIS 134 3HB HIS 134 20.579 17.630 20.944 1155 HD1 HIS 134 HD1 HIS 134 18.672 18.727 19.427 1156 HD2 HIS 134 HD2 HIS 134 18.176 14.697 20.301 1157 HE1 HIS 134 HE1 HIS 134 16.275 18.209 18.892 1158 HE2 HIS 134 HE2 HIS 134 15.955 15.845 19.674
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