NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
479084 | 2kt4 | 16682 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 -28.781 3.806 -5.518 2 H2 MET 1 H2 MET 1 -28.328 3.820 -3.949 3 H3 MET 1 H3 MET 1 -28.318 5.205 -4.814 4 HA MET 1 HA MET 1 -26.453 2.993 -4.815 5 HB2 MET 1 HB2 MET 1 -27.013 4.785 -7.225 6 HB3 MET 1 HB3 MET 1 -25.559 3.797 -7.037 7 HG2 MET 1 HG2 MET 1 -26.995 2.546 -8.442 8 HG3 MET 1 HG3 MET 1 -27.086 1.758 -6.861 9 HE1 MET 1 HE1 MET 1 -30.724 1.512 -8.578 10 HE2 MET 1 HE2 MET 1 -29.170 1.650 -9.468 11 HE3 MET 1 HE3 MET 1 -29.294 0.571 -8.037 12 H THR 2 H THR 2 -24.240 3.788 -4.548 13 HA THR 2 HA THR 2 -22.713 5.132 -3.683 14 HB THR 2 HB THR 2 -24.027 7.514 -5.046 15 HG1 THR 2 HG1 THR 2 -23.040 6.723 -7.050 16 HG21 THR 2 HG21 THR 2 -21.669 8.051 -5.593 17 HG22 THR 2 HG22 THR 2 -21.902 7.832 -3.826 18 HG23 THR 2 HG23 THR 2 -21.140 6.530 -4.799 19 H VAL 3 H VAL 3 -24.947 4.687 -1.925 20 HA VAL 3 HA VAL 3 -25.749 7.219 -0.864 21 HB VAL 3 HB VAL 3 -26.800 5.836 0.936 22 HG11 VAL 3 HG11 VAL 3 -28.443 4.694 -0.522 23 HG12 VAL 3 HG12 VAL 3 -28.029 6.333 -1.128 24 HG13 VAL 3 HG13 VAL 3 -27.326 4.880 -1.916 25 HG21 VAL 3 HG21 VAL 3 -26.788 3.373 0.737 26 HG22 VAL 3 HG22 VAL 3 -25.594 3.491 -0.599 27 HG23 VAL 3 HG23 VAL 3 -25.148 4.032 1.055 28 HA PRO 4 HA PRO 4 -22.399 7.653 2.061 29 HB2 PRO 4 HB2 PRO 4 -23.607 9.305 3.911 30 HB3 PRO 4 HB3 PRO 4 -23.311 9.907 2.275 31 HG2 PRO 4 HG2 PRO 4 -25.871 8.811 3.473 32 HG3 PRO 4 HG3 PRO 4 -25.644 10.229 2.440 33 HD2 PRO 4 HD2 PRO 4 -26.517 7.795 1.470 34 HD3 PRO 4 HD3 PRO 4 -25.632 8.960 0.476 35 H ASP 5 H ASP 5 -23.282 5.110 2.338 36 HA ASP 5 HA ASP 5 -23.927 4.875 5.202 37 HB2 ASP 5 HB2 ASP 5 -24.489 3.202 2.772 38 HB3 ASP 5 HB3 ASP 5 -24.191 2.355 4.295 39 H ARG 6 H ARG 6 -22.609 1.956 3.912 40 HA ARG 6 HA ARG 6 -20.486 1.962 5.681 41 HB2 ARG 6 HB2 ARG 6 -21.225 0.309 3.293 42 HB3 ARG 6 HB3 ARG 6 -19.610 0.130 3.991 43 HG2 ARG 6 HG2 ARG 6 -20.861 -1.511 5.108 44 HG3 ARG 6 HG3 ARG 6 -20.820 -0.180 6.273 45 HD2 ARG 6 HD2 ARG 6 -23.093 -0.979 6.201 46 HD3 ARG 6 HD3 ARG 6 -23.073 0.590 5.385 47 HE ARG 6 HE ARG 6 -22.679 -1.342 3.377 48 HH11 ARG 6 HH11 ARG 6 -25.170 -0.535 5.723 49 HH12 ARG 6 HH12 ARG 6 -26.463 -1.120 4.730 50 HH21 ARG 6 HH21 ARG 6 -24.384 -2.115 2.094 51 HH22 ARG 6 HH22 ARG 6 -26.016 -2.019 2.666 52 H SER 7 H SER 7 -20.740 3.573 2.572 53 HA SER 7 HA SER 7 -18.206 3.519 1.559 54 HB2 SER 7 HB2 SER 7 -19.740 6.144 1.830 55 HB3 SER 7 HB3 SER 7 -18.864 5.514 0.429 56 HG SER 7 HG SER 7 -21.452 5.360 0.789 57 H GLU 8 H GLU 8 -19.298 5.215 4.560 58 HA GLU 8 HA GLU 8 -17.154 6.967 4.804 59 HB2 GLU 8 HB2 GLU 8 -18.682 5.552 7.029 60 HB3 GLU 8 HB3 GLU 8 -17.721 7.029 7.187 61 HG2 GLU 8 HG2 GLU 8 -19.379 7.929 5.297 62 HG3 GLU 8 HG3 GLU 8 -20.420 6.627 5.888 63 H ILE 9 H ILE 9 -17.303 3.457 5.297 64 HA ILE 9 HA ILE 9 -14.870 3.407 6.813 65 HB ILE 9 HB ILE 9 -16.392 1.031 5.767 66 HG12 ILE 9 HG12 ILE 9 -16.704 2.475 8.445 67 HG13 ILE 9 HG13 ILE 9 -17.837 2.627 7.095 68 HG21 ILE 9 HG21 ILE 9 -15.320 -0.088 7.694 69 HG22 ILE 9 HG22 ILE 9 -14.112 0.579 6.545 70 HG23 ILE 9 HG23 ILE 9 -14.451 1.433 8.088 71 HD11 ILE 9 HD11 ILE 9 -18.648 1.008 8.754 72 HD12 ILE 9 HD12 ILE 9 -18.298 0.193 7.192 73 HD13 ILE 9 HD13 ILE 9 -17.148 0.040 8.562 74 H ALA 10 H ALA 10 -15.390 3.953 3.567 75 HA ALA 10 HA ALA 10 -12.873 2.579 2.885 76 HB1 ALA 10 HB1 ALA 10 -13.874 2.074 0.665 77 HB2 ALA 10 HB2 ALA 10 -14.769 1.263 1.995 78 HB3 ALA 10 HB3 ALA 10 -15.444 2.741 1.229 79 H GLY 11 H GLY 11 -12.103 3.510 0.577 80 HA2 GLY 11 HA2 GLY 11 -12.793 5.890 -0.450 81 HA3 GLY 11 HA3 GLY 11 -11.943 6.369 1.025 82 H LYS 12 H LYS 12 -10.212 7.352 -0.151 83 HA LYS 12 HA LYS 12 -8.486 5.441 -1.583 84 HB2 LYS 12 HB2 LYS 12 -7.636 7.452 -2.782 85 HB3 LYS 12 HB3 LYS 12 -9.351 7.146 -3.084 86 HG2 LYS 12 HG2 LYS 12 -9.916 8.883 -1.329 87 HG3 LYS 12 HG3 LYS 12 -8.190 9.238 -1.179 88 HD2 LYS 12 HD2 LYS 12 -8.047 9.984 -3.482 89 HD3 LYS 12 HD3 LYS 12 -9.658 9.358 -3.856 90 HE2 LYS 12 HE2 LYS 12 -9.926 11.719 -3.573 91 HE3 LYS 12 HE3 LYS 12 -10.597 10.977 -2.115 92 HZ1 LYS 12 HZ1 LYS 12 -9.000 12.939 -1.900 93 HZ2 LYS 12 HZ2 LYS 12 -8.816 11.683 -0.873 94 HZ3 LYS 12 HZ3 LYS 12 -7.805 11.854 -2.144 95 H TRP 13 H TRP 13 -6.243 5.447 -1.153 96 HA TRP 13 HA TRP 13 -5.400 7.127 1.125 97 HB2 TRP 13 HB2 TRP 13 -4.571 4.230 0.651 98 HB3 TRP 13 HB3 TRP 13 -4.195 5.251 2.046 99 HD1 TRP 13 HD1 TRP 13 -6.484 2.552 1.077 100 HE1 TRP 13 HE1 TRP 13 -8.517 2.413 2.670 101 HE3 TRP 13 HE3 TRP 13 -6.009 7.117 3.390 102 HZ2 TRP 13 HZ2 TRP 13 -9.759 4.003 4.632 103 HZ3 TRP 13 HZ3 TRP 13 -7.670 7.744 5.125 104 HH2 TRP 13 HH2 TRP 13 -9.515 6.207 5.737 105 H TYR 14 H TYR 14 -3.262 7.978 0.878 106 HA TYR 14 HA TYR 14 -2.065 7.439 -1.761 107 HB2 TYR 14 HB2 TYR 14 -1.607 9.757 0.173 108 HB3 TYR 14 HB3 TYR 14 -0.957 9.602 -1.464 109 HD1 TYR 14 HD1 TYR 14 -4.188 9.850 0.438 110 HD2 TYR 14 HD2 TYR 14 -2.201 10.385 -3.332 111 HE1 TYR 14 HE1 TYR 14 -6.210 10.951 -0.468 112 HE2 TYR 14 HE2 TYR 14 -4.224 11.487 -4.242 113 HH TYR 14 HH TYR 14 -6.527 11.724 -3.892 114 H VAL 15 H VAL 15 -0.252 6.099 -1.870 115 HA VAL 15 HA VAL 15 1.063 5.569 0.740 116 HB VAL 15 HB VAL 15 0.436 3.714 -0.813 117 HG11 VAL 15 HG11 VAL 15 1.640 3.325 -2.924 118 HG12 VAL 15 HG12 VAL 15 0.609 4.795 -2.970 119 HG13 VAL 15 HG13 VAL 15 2.388 4.952 -2.785 120 HG21 VAL 15 HG21 VAL 15 2.655 2.576 -0.848 121 HG22 VAL 15 HG22 VAL 15 3.448 4.155 -0.526 122 HG23 VAL 15 HG23 VAL 15 2.350 3.435 0.699 123 H VAL 16 H VAL 16 2.524 6.957 1.391 124 HA VAL 16 HA VAL 16 4.154 8.356 -0.605 125 HB VAL 16 HB VAL 16 4.622 10.007 1.178 126 HG11 VAL 16 HG11 VAL 16 2.383 11.050 1.257 127 HG12 VAL 16 HG12 VAL 16 2.775 10.410 -0.374 128 HG13 VAL 16 HG13 VAL 16 1.652 9.508 0.699 129 HG21 VAL 16 HG21 VAL 16 3.302 9.983 3.273 130 HG22 VAL 16 HG22 VAL 16 2.623 8.384 2.818 131 HG23 VAL 16 HG23 VAL 16 4.382 8.554 3.138 132 H ALA 17 H ALA 17 4.296 5.577 1.195 133 HA ALA 17 HA ALA 17 7.191 5.851 1.560 134 HB1 ALA 17 HB1 ALA 17 7.039 4.683 3.730 135 HB2 ALA 17 HB2 ALA 17 6.220 6.280 3.769 136 HB3 ALA 17 HB3 ALA 17 5.247 4.775 3.650 137 H LEU 18 H LEU 18 8.309 3.758 1.468 138 HA LEU 18 HA LEU 18 6.710 1.439 0.817 139 HB2 LEU 18 HB2 LEU 18 8.668 2.682 -1.179 140 HB3 LEU 18 HB3 LEU 18 7.865 1.117 -1.362 141 HG LEU 18 HG LEU 18 6.182 3.605 -1.046 142 HD11 LEU 18 HD11 LEU 18 6.234 3.928 -3.498 143 HD12 LEU 18 HD12 LEU 18 7.845 4.198 -2.752 144 HD13 LEU 18 HD13 LEU 18 7.508 2.669 -3.632 145 HD21 LEU 18 HD21 LEU 18 4.653 2.319 -2.505 146 HD22 LEU 18 HD22 LEU 18 5.864 0.996 -2.600 147 HD23 LEU 18 HD23 LEU 18 5.099 1.401 -1.026 148 H ALA 19 H ALA 19 7.909 -0.546 0.954 149 HA ALA 19 HA ALA 19 10.800 -0.338 1.515 150 HB1 ALA 19 HB1 ALA 19 10.529 -1.733 3.529 151 HB2 ALA 19 HB2 ALA 19 9.690 -0.157 3.721 152 HB3 ALA 19 HB3 ALA 19 8.743 -1.641 3.367 153 H SER 20 H SER 20 11.854 -2.067 0.489 154 HA SER 20 HA SER 20 10.132 -4.349 -0.267 155 HB2 SER 20 HB2 SER 20 12.208 -2.944 -2.052 156 HB3 SER 20 HB3 SER 20 11.266 -4.376 -2.487 157 HG SER 20 HG SER 20 10.556 -1.919 -2.972 158 H ASN 21 H ASN 21 11.122 -6.382 -0.279 159 HA ASN 21 HA ASN 21 13.552 -6.520 1.309 160 HB2 ASN 21 HB2 ASN 21 11.315 -7.950 1.453 161 HB3 ASN 21 HB3 ASN 21 12.038 -8.872 0.128 162 HD21 ASN 21 HD21 ASN 21 14.823 -8.685 1.021 163 HD22 ASN 21 HD22 ASN 21 14.954 -9.682 2.431 164 H THR 22 H THR 22 12.555 -6.816 -2.131 165 HA THR 22 HA THR 22 15.134 -8.095 -2.741 166 HB THR 22 HB THR 22 13.846 -7.764 -5.133 167 HG1 THR 22 HG1 THR 22 11.539 -8.447 -4.445 168 HG21 THR 22 HG21 THR 22 13.063 -10.099 -4.849 169 HG22 THR 22 HG22 THR 22 14.724 -9.879 -4.201 170 HG23 THR 22 HG23 THR 22 13.326 -9.970 -3.077 171 H GLU 23 H GLU 23 16.857 -7.135 -3.622 172 HA GLU 23 HA GLU 23 17.260 -4.445 -3.440 173 HB2 GLU 23 HB2 GLU 23 18.609 -5.679 -5.797 174 HB3 GLU 23 HB3 GLU 23 19.321 -4.950 -4.352 175 HG2 GLU 23 HG2 GLU 23 18.128 -7.753 -4.355 176 HG3 GLU 23 HG3 GLU 23 19.811 -7.429 -4.790 177 H PHE 24 H PHE 24 16.162 -6.307 -6.419 178 HA PHE 24 HA PHE 24 16.258 -4.233 -8.211 179 HB2 PHE 24 HB2 PHE 24 14.312 -6.586 -7.916 180 HB3 PHE 24 HB3 PHE 24 14.285 -5.509 -9.318 181 HD1 PHE 24 HD1 PHE 24 16.414 -5.295 -10.724 182 HD2 PHE 24 HD2 PHE 24 15.833 -8.385 -7.799 183 HE1 PHE 24 HE1 PHE 24 18.188 -6.647 -11.803 184 HE2 PHE 24 HE2 PHE 24 17.604 -9.740 -8.876 185 HZ PHE 24 HZ PHE 24 18.784 -8.873 -10.880 186 H PHE 25 H PHE 25 13.366 -5.147 -6.127 187 HA PHE 25 HA PHE 25 11.703 -3.157 -7.106 188 HB2 PHE 25 HB2 PHE 25 11.869 -4.741 -4.547 189 HB3 PHE 25 HB3 PHE 25 10.760 -3.366 -4.623 190 HD1 PHE 25 HD1 PHE 25 9.056 -3.293 -6.542 191 HD2 PHE 25 HD2 PHE 25 11.288 -6.811 -5.512 192 HE1 PHE 25 HE1 PHE 25 7.393 -4.691 -7.727 193 HE2 PHE 25 HE2 PHE 25 9.625 -8.216 -6.694 194 HZ PHE 25 HZ PHE 25 7.672 -7.156 -7.801 195 H LEU 26 H LEU 26 14.102 -3.016 -4.370 196 HA LEU 26 HA LEU 26 13.441 -0.437 -3.492 197 HB2 LEU 26 HB2 LEU 26 16.180 -1.792 -3.581 198 HB3 LEU 26 HB3 LEU 26 15.685 -0.477 -2.507 199 HG LEU 26 HG LEU 26 14.513 -3.292 -2.477 200 HD11 LEU 26 HD11 LEU 26 15.778 -3.570 -0.376 201 HD12 LEU 26 HD12 LEU 26 16.862 -3.292 -1.781 202 HD13 LEU 26 HD13 LEU 26 16.534 -1.960 -0.622 203 HD21 LEU 26 HD21 LEU 26 13.521 -2.578 -0.328 204 HD22 LEU 26 HD22 LEU 26 14.180 -0.926 -0.579 205 HD23 LEU 26 HD23 LEU 26 12.939 -1.578 -1.702 206 H ARG 27 H ARG 27 15.874 -1.637 -5.913 207 HA ARG 27 HA ARG 27 16.962 0.851 -6.539 208 HB2 ARG 27 HB2 ARG 27 17.613 -1.652 -7.166 209 HB3 ARG 27 HB3 ARG 27 16.631 -1.337 -8.602 210 HG2 ARG 27 HG2 ARG 27 18.117 0.885 -8.732 211 HG3 ARG 27 HG3 ARG 27 19.236 -0.066 -7.747 212 HD2 ARG 27 HD2 ARG 27 19.854 -0.469 -10.026 213 HD3 ARG 27 HD3 ARG 27 19.036 -1.937 -9.473 214 HE ARG 27 HE ARG 27 16.954 -0.869 -10.596 215 HH11 ARG 27 HH11 ARG 27 20.251 -0.391 -11.732 216 HH12 ARG 27 HH12 ARG 27 19.768 -0.146 -13.377 217 HH21 ARG 27 HH21 ARG 27 16.339 -0.547 -12.729 218 HH22 ARG 27 HH22 ARG 27 17.532 -0.235 -13.947 219 H GLU 28 H GLU 28 14.197 -0.984 -8.089 220 HA GLU 28 HA GLU 28 13.773 1.018 -10.042 221 HB2 GLU 28 HB2 GLU 28 11.863 -1.120 -8.990 222 HB3 GLU 28 HB3 GLU 28 11.678 -0.201 -10.489 223 HG2 GLU 28 HG2 GLU 28 13.784 -2.300 -9.829 224 HG3 GLU 28 HG3 GLU 28 12.519 -2.378 -11.063 225 H LYS 29 H LYS 29 11.951 0.198 -6.947 226 HA LYS 29 HA LYS 29 10.128 2.273 -7.256 227 HB2 LYS 29 HB2 LYS 29 11.118 0.766 -4.809 228 HB3 LYS 29 HB3 LYS 29 9.868 2.014 -4.712 229 HG2 LYS 29 HG2 LYS 29 9.094 0.276 -6.849 230 HG3 LYS 29 HG3 LYS 29 9.635 -0.771 -5.530 231 HD2 LYS 29 HD2 LYS 29 7.291 -0.384 -5.169 232 HD3 LYS 29 HD3 LYS 29 8.147 0.572 -3.952 233 HE2 LYS 29 HE2 LYS 29 6.411 1.977 -4.852 234 HE3 LYS 29 HE3 LYS 29 7.947 2.591 -5.478 235 HZ1 LYS 29 HZ1 LYS 29 6.329 2.465 -7.214 236 HZ2 LYS 29 HZ2 LYS 29 7.493 1.364 -7.530 237 HZ3 LYS 29 HZ3 LYS 29 6.046 0.879 -6.949 238 H ASP 30 H ASP 30 13.343 2.295 -5.499 239 HA ASP 30 HA ASP 30 13.047 4.809 -4.373 240 HB2 ASP 30 HB2 ASP 30 14.905 3.512 -3.674 241 HB3 ASP 30 HB3 ASP 30 15.443 3.201 -5.330 242 H LYS 31 H LYS 31 13.765 3.872 -7.776 243 HA LYS 31 HA LYS 31 14.455 6.617 -8.403 244 HB2 LYS 31 HB2 LYS 31 14.452 3.996 -9.907 245 HB3 LYS 31 HB3 LYS 31 14.483 5.524 -10.796 246 HG2 LYS 31 HG2 LYS 31 16.494 4.708 -8.638 247 HG3 LYS 31 HG3 LYS 31 16.763 4.576 -10.381 248 HD2 LYS 31 HD2 LYS 31 17.466 6.721 -10.429 249 HD3 LYS 31 HD3 LYS 31 15.858 7.253 -9.920 250 HE2 LYS 31 HE2 LYS 31 17.932 6.264 -7.911 251 HE3 LYS 31 HE3 LYS 31 17.901 7.944 -8.462 252 HZ1 LYS 31 HZ1 LYS 31 16.589 7.998 -6.617 253 HZ2 LYS 31 HZ2 LYS 31 15.437 7.783 -7.754 254 HZ3 LYS 31 HZ3 LYS 31 15.933 6.520 -6.846 255 H MET 32 H MET 32 11.356 4.737 -8.112 256 HA MET 32 HA MET 32 10.467 6.536 -10.304 257 HB2 MET 32 HB2 MET 32 9.184 4.350 -8.318 258 HB3 MET 32 HB3 MET 32 8.206 5.103 -9.585 259 HG2 MET 32 HG2 MET 32 10.737 3.501 -10.199 260 HG3 MET 32 HG3 MET 32 9.143 2.746 -10.068 261 HE1 MET 32 HE1 MET 32 10.278 3.135 -13.978 262 HE2 MET 32 HE2 MET 32 11.425 3.163 -12.596 263 HE3 MET 32 HE3 MET 32 10.099 1.953 -12.638 264 H LYS 33 H LYS 33 7.637 6.326 -8.525 265 HA LYS 33 HA LYS 33 8.304 8.750 -6.976 266 HB2 LYS 33 HB2 LYS 33 6.194 8.791 -9.153 267 HB3 LYS 33 HB3 LYS 33 6.353 9.996 -7.868 268 HG2 LYS 33 HG2 LYS 33 8.356 10.858 -8.723 269 HG3 LYS 33 HG3 LYS 33 8.769 9.364 -9.574 270 HD2 LYS 33 HD2 LYS 33 6.781 9.794 -11.123 271 HD3 LYS 33 HD3 LYS 33 6.583 11.367 -10.341 272 HE2 LYS 33 HE2 LYS 33 8.819 12.075 -11.027 273 HE3 LYS 33 HE3 LYS 33 9.216 10.451 -11.604 274 HZ1 LYS 33 HZ1 LYS 33 8.610 11.906 -13.401 275 HZ2 LYS 33 HZ2 LYS 33 7.508 10.706 -13.285 276 HZ3 LYS 33 HZ3 LYS 33 7.142 12.205 -12.752 277 H MET 34 H MET 34 5.804 9.437 -6.000 278 HA MET 34 HA MET 34 5.245 7.248 -4.263 279 HB2 MET 34 HB2 MET 34 4.943 9.573 -3.522 280 HB3 MET 34 HB3 MET 34 3.937 9.961 -4.924 281 HG2 MET 34 HG2 MET 34 2.189 8.353 -4.024 282 HG3 MET 34 HG3 MET 34 3.178 8.170 -2.570 283 HE1 MET 34 HE1 MET 34 0.911 11.967 -3.922 284 HE2 MET 34 HE2 MET 34 2.555 11.721 -4.602 285 HE3 MET 34 HE3 MET 34 1.269 10.503 -4.898 286 H ALA 35 H ALA 35 3.255 6.030 -4.121 287 HA ALA 35 HA ALA 35 1.914 5.706 -6.701 288 HB1 ALA 35 HB1 ALA 35 1.415 3.411 -5.965 289 HB2 ALA 35 HB2 ALA 35 3.177 3.745 -6.059 290 HB3 ALA 35 HB3 ALA 35 2.355 3.702 -4.463 291 H MET 36 H MET 36 -0.382 4.466 -6.206 292 HA MET 36 HA MET 36 -1.704 6.059 -4.113 293 HB2 MET 36 HB2 MET 36 -2.701 5.321 -6.932 294 HB3 MET 36 HB3 MET 36 -3.667 6.150 -5.705 295 HG2 MET 36 HG2 MET 36 -1.027 7.326 -6.624 296 HG3 MET 36 HG3 MET 36 -2.484 7.524 -7.606 297 HE1 MET 36 HE1 MET 36 -1.439 10.790 -5.270 298 HE2 MET 36 HE2 MET 36 -0.432 9.516 -6.038 299 HE3 MET 36 HE3 MET 36 -1.682 10.374 -7.000 300 H ALA 37 H ALA 37 -3.878 5.088 -3.436 301 HA ALA 37 HA ALA 37 -4.413 2.314 -4.150 302 HB1 ALA 37 HB1 ALA 37 -3.981 1.494 -1.822 303 HB2 ALA 37 HB2 ALA 37 -2.463 2.106 -2.562 304 HB3 ALA 37 HB3 ALA 37 -3.348 3.111 -1.365 305 H ARG 38 H ARG 38 -6.538 2.188 -4.210 306 HA ARG 38 HA ARG 38 -8.108 3.691 -2.189 307 HB2 ARG 38 HB2 ARG 38 -8.414 4.908 -4.196 308 HB3 ARG 38 HB3 ARG 38 -8.558 3.440 -5.172 309 HG2 ARG 38 HG2 ARG 38 -10.561 3.794 -2.957 310 HG3 ARG 38 HG3 ARG 38 -10.689 4.894 -4.336 311 HD2 ARG 38 HD2 ARG 38 -10.533 2.768 -5.834 312 HD3 ARG 38 HD3 ARG 38 -10.808 1.842 -4.353 313 HE ARG 38 HE ARG 38 -13.041 2.392 -4.521 314 HH11 ARG 38 HH11 ARG 38 -11.198 4.769 -6.344 315 HH12 ARG 38 HH12 ARG 38 -12.596 5.686 -6.797 316 HH21 ARG 38 HH21 ARG 38 -14.862 3.633 -5.092 317 HH22 ARG 38 HH22 ARG 38 -14.676 5.040 -6.086 318 H ILE 39 H ILE 39 -9.536 2.250 -1.096 319 HA ILE 39 HA ILE 39 -9.707 -0.420 -2.281 320 HB ILE 39 HB ILE 39 -10.048 0.192 0.678 321 HG12 ILE 39 HG12 ILE 39 -7.859 1.057 0.148 322 HG13 ILE 39 HG13 ILE 39 -7.689 -0.466 1.030 323 HG21 ILE 39 HG21 ILE 39 -9.418 -2.192 0.925 324 HG22 ILE 39 HG22 ILE 39 -10.869 -1.977 -0.112 325 HG23 ILE 39 HG23 ILE 39 -9.275 -2.329 -0.860 326 HD11 ILE 39 HD11 ILE 39 -6.066 -0.319 -0.803 327 HD12 ILE 39 HD12 ILE 39 -7.227 -1.658 -1.093 328 HD13 ILE 39 HD13 ILE 39 -7.400 -0.111 -1.988 329 H SER 40 H SER 40 -11.767 -1.506 -2.226 330 HA SER 40 HA SER 40 -14.012 0.028 -1.114 331 HB2 SER 40 HB2 SER 40 -13.871 -1.091 -3.957 332 HB3 SER 40 HB3 SER 40 -15.295 -0.369 -3.197 333 HG SER 40 HG SER 40 -14.523 1.496 -3.904 334 H PHE 41 H PHE 41 -15.541 -1.219 -0.087 335 HA PHE 41 HA PHE 41 -14.843 -3.957 0.342 336 HB2 PHE 41 HB2 PHE 41 -16.975 -3.954 1.700 337 HB3 PHE 41 HB3 PHE 41 -15.748 -2.780 2.195 338 HD1 PHE 41 HD1 PHE 41 -16.111 -0.376 1.906 339 HD2 PHE 41 HD2 PHE 41 -19.098 -3.230 0.732 340 HE1 PHE 41 HE1 PHE 41 -17.793 1.436 1.790 341 HE2 PHE 41 HE2 PHE 41 -20.782 -1.421 0.615 342 HZ PHE 41 HZ PHE 41 -20.134 0.918 1.143 343 H LEU 42 H LEU 42 -15.114 -5.480 -1.189 344 HA LEU 42 HA LEU 42 -17.132 -5.279 -3.196 345 HB2 LEU 42 HB2 LEU 42 -14.782 -6.474 -3.165 346 HB3 LEU 42 HB3 LEU 42 -15.663 -7.811 -2.414 347 HG LEU 42 HG LEU 42 -15.393 -8.155 -4.814 348 HD11 LEU 42 HD11 LEU 42 -17.750 -8.583 -5.418 349 HD12 LEU 42 HD12 LEU 42 -17.380 -9.086 -3.734 350 HD13 LEU 42 HD13 LEU 42 -18.282 -7.563 -4.038 351 HD21 LEU 42 HD21 LEU 42 -16.549 -6.706 -6.453 352 HD22 LEU 42 HD22 LEU 42 -17.014 -5.588 -5.125 353 HD23 LEU 42 HD23 LEU 42 -15.282 -5.818 -5.541 354 H GLY 43 H GLY 43 -16.746 -7.075 -0.087 355 HA2 GLY 43 HA2 GLY 43 -19.578 -7.522 0.105 356 HA3 GLY 43 HA3 GLY 43 -18.661 -8.986 -0.273 357 H GLU 44 H GLU 44 -19.773 -9.331 2.072 358 HA GLU 44 HA GLU 44 -18.557 -8.109 4.283 359 HB2 GLU 44 HB2 GLU 44 -19.744 -10.919 4.056 360 HB3 GLU 44 HB3 GLU 44 -19.497 -10.004 5.549 361 HG2 GLU 44 HG2 GLU 44 -21.095 -8.257 4.706 362 HG3 GLU 44 HG3 GLU 44 -21.379 -9.242 3.265 363 H ASP 45 H ASP 45 -17.551 -10.910 2.258 364 HA ASP 45 HA ASP 45 -15.157 -11.157 3.966 365 HB2 ASP 45 HB2 ASP 45 -16.534 -13.188 4.036 366 HB3 ASP 45 HB3 ASP 45 -16.696 -13.201 2.275 367 H GLU 46 H GLU 46 -16.142 -9.739 1.069 368 HA GLU 46 HA GLU 46 -13.507 -10.331 -0.108 369 HB2 GLU 46 HB2 GLU 46 -15.265 -11.463 -1.404 370 HB3 GLU 46 HB3 GLU 46 -16.176 -9.954 -1.543 371 HG2 GLU 46 HG2 GLU 46 -14.653 -9.006 -3.060 372 HG3 GLU 46 HG3 GLU 46 -13.325 -10.059 -2.554 373 H LEU 47 H LEU 47 -12.509 -8.592 -1.290 374 HA LEU 47 HA LEU 47 -13.693 -5.984 -0.950 375 HB2 LEU 47 HB2 LEU 47 -11.702 -5.026 0.063 376 HB3 LEU 47 HB3 LEU 47 -12.469 -6.229 1.109 377 HG LEU 47 HG LEU 47 -10.146 -7.020 -0.668 378 HD11 LEU 47 HD11 LEU 47 -8.613 -6.481 1.194 379 HD12 LEU 47 HD12 LEU 47 -9.410 -5.011 0.538 380 HD13 LEU 47 HD13 LEU 47 -9.972 -5.722 2.089 381 HD21 LEU 47 HD21 LEU 47 -9.776 -8.656 1.150 382 HD22 LEU 47 HD22 LEU 47 -11.178 -7.976 2.043 383 HD23 LEU 47 HD23 LEU 47 -11.429 -8.787 0.460 384 H LYS 48 H LYS 48 -12.685 -4.343 -2.320 385 HA LYS 48 HA LYS 48 -10.959 -5.482 -4.398 386 HB2 LYS 48 HB2 LYS 48 -13.375 -5.081 -5.056 387 HB3 LYS 48 HB3 LYS 48 -13.082 -3.356 -4.796 388 HG2 LYS 48 HG2 LYS 48 -11.371 -3.321 -6.545 389 HG3 LYS 48 HG3 LYS 48 -11.457 -5.078 -6.728 390 HD2 LYS 48 HD2 LYS 48 -13.864 -3.237 -7.155 391 HD3 LYS 48 HD3 LYS 48 -12.758 -3.693 -8.457 392 HE2 LYS 48 HE2 LYS 48 -14.224 -5.734 -6.711 393 HE3 LYS 48 HE3 LYS 48 -14.878 -5.115 -8.233 394 HZ1 LYS 48 HZ1 LYS 48 -13.779 -6.938 -8.949 395 HZ2 LYS 48 HZ2 LYS 48 -12.541 -5.881 -9.084 396 HZ3 LYS 48 HZ3 LYS 48 -12.619 -6.888 -7.801 397 H VAL 49 H VAL 49 -9.230 -4.107 -5.154 398 HA VAL 49 HA VAL 49 -9.079 -1.508 -3.803 399 HB VAL 49 HB VAL 49 -6.699 -1.886 -3.340 400 HG11 VAL 49 HG11 VAL 49 -6.883 -3.640 -1.601 401 HG12 VAL 49 HG12 VAL 49 -8.309 -2.549 -1.609 402 HG13 VAL 49 HG13 VAL 49 -8.430 -4.190 -2.329 403 HG21 VAL 49 HG21 VAL 49 -5.646 -4.095 -3.681 404 HG22 VAL 49 HG22 VAL 49 -7.135 -4.672 -4.503 405 HG23 VAL 49 HG23 VAL 49 -6.163 -3.348 -5.230 406 H SER 50 H SER 50 -8.204 0.177 -5.072 407 HA SER 50 HA SER 50 -7.427 -0.618 -7.824 408 HB2 SER 50 HB2 SER 50 -8.189 1.692 -8.421 409 HB3 SER 50 HB3 SER 50 -9.496 0.673 -7.805 410 HG SER 50 HG SER 50 -8.937 3.050 -6.930 411 H TYR 51 H TYR 51 -5.318 -0.294 -8.326 412 HA TYR 51 HA TYR 51 -3.724 1.341 -6.503 413 HB2 TYR 51 HB2 TYR 51 -3.182 -0.823 -8.601 414 HB3 TYR 51 HB3 TYR 51 -1.872 0.220 -8.033 415 HD1 TYR 51 HD1 TYR 51 -1.926 0.402 -5.251 416 HD2 TYR 51 HD2 TYR 51 -3.230 -2.902 -7.662 417 HE1 TYR 51 HE1 TYR 51 -1.447 -1.149 -3.383 418 HE2 TYR 51 HE2 TYR 51 -2.803 -4.445 -5.781 419 HH TYR 51 HH TYR 51 -0.852 -4.063 -3.554 420 H ALA 52 H ALA 52 -2.466 3.126 -7.309 421 HA ALA 52 HA ALA 52 -2.638 3.633 -10.220 422 HB1 ALA 52 HB1 ALA 52 -3.062 6.012 -9.736 423 HB2 ALA 52 HB2 ALA 52 -4.398 4.971 -9.138 424 HB3 ALA 52 HB3 ALA 52 -3.193 5.637 -7.985 425 H VAL 53 H VAL 53 -0.507 3.605 -10.902 426 HA VAL 53 HA VAL 53 1.386 4.988 -9.154 427 HB VAL 53 HB VAL 53 3.131 3.309 -9.802 428 HG11 VAL 53 HG11 VAL 53 2.364 1.528 -8.261 429 HG12 VAL 53 HG12 VAL 53 2.008 3.169 -7.624 430 HG13 VAL 53 HG13 VAL 53 0.694 2.182 -8.347 431 HG21 VAL 53 HG21 VAL 53 2.416 1.111 -10.684 432 HG22 VAL 53 HG22 VAL 53 0.747 1.742 -10.887 433 HG23 VAL 53 HG23 VAL 53 2.094 2.441 -11.847 434 HA PRO 54 HA PRO 54 2.397 6.939 -13.058 435 HB2 PRO 54 HB2 PRO 54 4.561 8.403 -12.176 436 HB3 PRO 54 HB3 PRO 54 2.940 8.816 -11.603 437 HG2 PRO 54 HG2 PRO 54 5.111 7.224 -10.217 438 HG3 PRO 54 HG3 PRO 54 4.020 8.442 -9.544 439 HD2 PRO 54 HD2 PRO 54 3.607 5.713 -9.275 440 HD3 PRO 54 HD3 PRO 54 2.300 6.903 -9.212 441 H LYS 55 H LYS 55 3.025 5.325 -14.407 442 HA LYS 55 HA LYS 55 5.704 4.262 -14.145 443 HB2 LYS 55 HB2 LYS 55 3.648 2.774 -14.407 444 HB3 LYS 55 HB3 LYS 55 3.538 3.373 -16.067 445 HG2 LYS 55 HG2 LYS 55 5.925 2.541 -16.432 446 HG3 LYS 55 HG3 LYS 55 5.838 1.784 -14.835 447 HD2 LYS 55 HD2 LYS 55 3.784 0.520 -15.576 448 HD3 LYS 55 HD3 LYS 55 3.946 1.238 -17.185 449 HE2 LYS 55 HE2 LYS 55 4.998 -0.872 -17.396 450 HE3 LYS 55 HE3 LYS 55 6.345 0.260 -17.220 451 HZ1 LYS 55 HZ1 LYS 55 6.616 -1.660 -15.817 452 HZ2 LYS 55 HZ2 LYS 55 6.449 -0.331 -14.883 453 HZ3 LYS 55 HZ3 LYS 55 5.205 -1.377 -15.046 454 HA PRO 56 HA PRO 56 7.456 6.741 -17.424 455 HB2 PRO 56 HB2 PRO 56 8.110 4.022 -18.709 456 HB3 PRO 56 HB3 PRO 56 9.205 5.386 -18.447 457 HG2 PRO 56 HG2 PRO 56 9.335 3.258 -16.837 458 HG3 PRO 56 HG3 PRO 56 9.513 4.883 -16.161 459 HD2 PRO 56 HD2 PRO 56 7.151 3.003 -16.006 460 HD3 PRO 56 HD3 PRO 56 7.729 4.172 -14.811 461 H ASN 57 H ASN 57 5.242 4.028 -18.226 462 HA ASN 57 HA ASN 57 4.784 5.156 -20.853 463 HB2 ASN 57 HB2 ASN 57 3.212 2.939 -19.448 464 HB3 ASN 57 HB3 ASN 57 3.335 3.245 -21.186 465 HD21 ASN 57 HD21 ASN 57 5.215 2.592 -22.323 466 HD22 ASN 57 HD22 ASN 57 6.368 1.495 -21.638 467 H GLY 58 H GLY 58 3.784 6.071 -17.739 468 HA2 GLY 58 HA2 GLY 58 2.206 7.980 -17.888 469 HA3 GLY 58 HA3 GLY 58 1.120 6.880 -18.749 470 H CYS 59 H CYS 59 -0.232 7.753 -16.709 471 HA CYS 59 HA CYS 59 0.382 6.652 -14.175 472 HB2 CYS 59 HB2 CYS 59 -2.255 7.610 -15.369 473 HB3 CYS 59 HB3 CYS 59 -1.988 7.229 -13.663 474 H ARG 60 H ARG 60 0.574 4.438 -13.837 475 HA ARG 60 HA ARG 60 -1.265 2.690 -15.355 476 HB2 ARG 60 HB2 ARG 60 1.230 2.278 -15.308 477 HB3 ARG 60 HB3 ARG 60 1.154 2.124 -13.548 478 HG2 ARG 60 HG2 ARG 60 1.225 -0.084 -14.639 479 HG3 ARG 60 HG3 ARG 60 -0.282 0.135 -13.740 480 HD2 ARG 60 HD2 ARG 60 -0.415 1.034 -16.580 481 HD3 ARG 60 HD3 ARG 60 -0.094 -0.694 -16.383 482 HE ARG 60 HE ARG 60 -2.198 -0.208 -14.648 483 HH11 ARG 60 HH11 ARG 60 -1.670 0.355 -18.085 484 HH12 ARG 60 HH12 ARG 60 -3.345 0.176 -18.489 485 HH21 ARG 60 HH21 ARG 60 -4.372 -0.450 -15.196 486 HH22 ARG 60 HH22 ARG 60 -4.883 -0.282 -16.843 487 H LYS 61 H LYS 61 -3.102 1.995 -14.423 488 HA LYS 61 HA LYS 61 -3.175 1.923 -11.476 489 HB2 LYS 61 HB2 LYS 61 -5.379 2.702 -11.468 490 HB3 LYS 61 HB3 LYS 61 -4.591 3.729 -12.674 491 HG2 LYS 61 HG2 LYS 61 -5.608 2.536 -14.505 492 HG3 LYS 61 HG3 LYS 61 -6.136 1.216 -13.452 493 HD2 LYS 61 HD2 LYS 61 -7.586 2.896 -12.195 494 HD3 LYS 61 HD3 LYS 61 -7.148 4.106 -13.408 495 HE2 LYS 61 HE2 LYS 61 -9.222 3.228 -14.164 496 HE3 LYS 61 HE3 LYS 61 -8.009 2.449 -15.189 497 HZ1 LYS 61 HZ1 LYS 61 -9.734 0.965 -14.238 498 HZ2 LYS 61 HZ2 LYS 61 -8.204 0.480 -13.943 499 HZ3 LYS 61 HZ3 LYS 61 -9.081 1.182 -12.758 500 H TRP 62 H TRP 62 -4.685 0.210 -10.611 501 HA TRP 62 HA TRP 62 -5.683 -1.779 -12.437 502 HB2 TRP 62 HB2 TRP 62 -3.157 -2.241 -12.260 503 HB3 TRP 62 HB3 TRP 62 -3.452 -2.650 -10.565 504 HD1 TRP 62 HD1 TRP 62 -3.329 -5.251 -10.485 505 HE1 TRP 62 HE1 TRP 62 -4.457 -7.188 -11.774 506 HE3 TRP 62 HE3 TRP 62 -5.795 -2.507 -14.062 507 HZ2 TRP 62 HZ2 TRP 62 -6.168 -7.521 -13.987 508 HZ3 TRP 62 HZ3 TRP 62 -7.170 -3.712 -15.742 509 HH2 TRP 62 HH2 TRP 62 -7.352 -6.183 -15.700 510 H GLU 63 H GLU 63 -7.207 -3.174 -11.374 511 HA GLU 63 HA GLU 63 -7.581 -2.462 -8.513 512 HB2 GLU 63 HB2 GLU 63 -10.112 -3.083 -9.304 513 HB3 GLU 63 HB3 GLU 63 -9.485 -1.430 -9.260 514 HG2 GLU 63 HG2 GLU 63 -9.425 -3.158 -11.774 515 HG3 GLU 63 HG3 GLU 63 -10.792 -2.120 -11.348 516 H THR 64 H THR 64 -7.570 -4.257 -7.247 517 HA THR 64 HA THR 64 -8.047 -6.849 -8.540 518 HB THR 64 HB THR 64 -6.257 -6.489 -6.103 519 HG1 THR 64 HG1 THR 64 -5.094 -5.212 -7.462 520 HG21 THR 64 HG21 THR 64 -5.203 -8.550 -7.008 521 HG22 THR 64 HG22 THR 64 -6.967 -8.766 -6.750 522 HG23 THR 64 HG23 THR 64 -6.327 -8.504 -8.408 523 H THR 65 H THR 65 -9.032 -8.506 -7.142 524 HA THR 65 HA THR 65 -10.524 -7.345 -4.890 525 HB THR 65 HB THR 65 -11.241 -9.922 -6.272 526 HG1 THR 65 HG1 THR 65 -12.459 -8.688 -7.813 527 HG21 THR 65 HG21 THR 65 -13.520 -9.206 -5.626 528 HG22 THR 65 HG22 THR 65 -12.418 -9.275 -4.209 529 HG23 THR 65 HG23 THR 65 -12.845 -7.690 -4.938 530 H PHE 66 H PHE 66 -10.302 -8.215 -2.818 531 HA PHE 66 HA PHE 66 -8.634 -10.638 -2.656 532 HB2 PHE 66 HB2 PHE 66 -8.667 -8.324 -0.659 533 HB3 PHE 66 HB3 PHE 66 -7.587 -9.726 -0.660 534 HD1 PHE 66 HD1 PHE 66 -6.885 -9.771 -3.621 535 HD2 PHE 66 HD2 PHE 66 -7.133 -6.555 -0.791 536 HE1 PHE 66 HE1 PHE 66 -5.226 -8.491 -4.937 537 HE2 PHE 66 HE2 PHE 66 -5.474 -5.270 -2.101 538 HZ PHE 66 HZ PHE 66 -4.514 -6.235 -4.179 539 H LYS 67 H LYS 67 -8.861 -11.609 -0.276 540 HA LYS 67 HA LYS 67 -11.742 -11.591 0.364 541 HB2 LYS 67 HB2 LYS 67 -9.659 -13.737 0.116 542 HB3 LYS 67 HB3 LYS 67 -10.803 -13.899 1.454 543 HG2 LYS 67 HG2 LYS 67 -11.644 -15.137 -0.453 544 HG3 LYS 67 HG3 LYS 67 -12.704 -13.752 -0.162 545 HD2 LYS 67 HD2 LYS 67 -11.680 -12.495 -2.003 546 HD3 LYS 67 HD3 LYS 67 -10.434 -13.732 -2.218 547 HE2 LYS 67 HE2 LYS 67 -12.124 -15.397 -2.878 548 HE3 LYS 67 HE3 LYS 67 -13.435 -14.266 -2.515 549 HZ1 LYS 67 HZ1 LYS 67 -12.989 -14.310 -4.843 550 HZ2 LYS 67 HZ2 LYS 67 -12.564 -12.839 -4.276 551 HZ3 LYS 67 HZ3 LYS 67 -11.413 -13.940 -4.634 552 H LYS 68 H LYS 68 -12.364 -11.530 2.578 553 HA LYS 68 HA LYS 68 -10.707 -10.024 4.249 554 HB2 LYS 68 HB2 LYS 68 -13.173 -10.023 4.383 555 HB3 LYS 68 HB3 LYS 68 -13.181 -11.734 4.830 556 HG2 LYS 68 HG2 LYS 68 -13.388 -10.843 6.931 557 HG3 LYS 68 HG3 LYS 68 -11.622 -10.851 6.837 558 HD2 LYS 68 HD2 LYS 68 -12.177 -8.665 7.604 559 HD3 LYS 68 HD3 LYS 68 -11.786 -8.453 5.892 560 HE2 LYS 68 HE2 LYS 68 -14.095 -8.288 5.264 561 HE3 LYS 68 HE3 LYS 68 -14.651 -8.944 6.809 562 HZ1 LYS 68 HZ1 LYS 68 -14.918 -6.568 6.710 563 HZ2 LYS 68 HZ2 LYS 68 -13.838 -6.940 7.876 564 HZ3 LYS 68 HZ3 LYS 68 -13.324 -6.333 6.450 565 H THR 69 H THR 69 -9.129 -10.561 5.766 566 HA THR 69 HA THR 69 -9.161 -13.330 6.819 567 HB THR 69 HB THR 69 -6.543 -12.052 5.915 568 HG1 THR 69 HG1 THR 69 -8.059 -13.769 4.142 569 HG21 THR 69 HG21 THR 69 -5.904 -14.441 5.649 570 HG22 THR 69 HG22 THR 69 -6.556 -14.115 7.290 571 HG23 THR 69 HG23 THR 69 -7.582 -14.931 6.062 572 H SER 70 H SER 70 -9.882 -12.317 8.797 573 HA SER 70 HA SER 70 -8.502 -10.092 9.934 574 HB2 SER 70 HB2 SER 70 -10.219 -12.110 11.439 575 HB3 SER 70 HB3 SER 70 -9.988 -10.390 11.777 576 HG SER 70 HG SER 70 -12.039 -10.822 10.740 577 H ASP 71 H ASP 71 -6.280 -11.342 9.414 578 HA ASP 71 HA ASP 71 -5.534 -13.446 11.155 579 HB2 ASP 71 HB2 ASP 71 -4.442 -12.678 8.940 580 HB3 ASP 71 HB3 ASP 71 -3.759 -11.314 9.835 581 H ASP 72 H ASP 72 -4.395 -9.964 11.179 582 HA ASP 72 HA ASP 72 -4.098 -10.229 14.101 583 HB2 ASP 72 HB2 ASP 72 -2.246 -9.466 12.141 584 HB3 ASP 72 HB3 ASP 72 -2.856 -7.911 12.722 585 H GLY 73 H GLY 73 -6.542 -9.672 12.693 586 HA2 GLY 73 HA2 GLY 73 -8.322 -8.722 13.656 587 HA3 GLY 73 HA3 GLY 73 -7.426 -7.212 13.869 588 H GLU 74 H GLU 74 -6.759 -6.252 11.236 589 HA GLU 74 HA GLU 74 -9.217 -6.938 9.685 590 HB2 GLU 74 HB2 GLU 74 -8.103 -4.166 10.161 591 HB3 GLU 74 HB3 GLU 74 -9.150 -4.572 8.795 592 HG2 GLU 74 HG2 GLU 74 -10.862 -5.441 10.456 593 HG3 GLU 74 HG3 GLU 74 -9.830 -4.838 11.760 594 H VAL 75 H VAL 75 -7.092 -8.479 9.221 595 HA VAL 75 HA VAL 75 -5.273 -7.168 7.331 596 HB VAL 75 HB VAL 75 -5.379 -9.967 8.573 597 HG11 VAL 75 HG11 VAL 75 -3.181 -10.371 7.527 598 HG12 VAL 75 HG12 VAL 75 -4.480 -10.132 6.309 599 HG13 VAL 75 HG13 VAL 75 -3.316 -8.808 6.653 600 HG21 VAL 75 HG21 VAL 75 -3.281 -9.236 9.696 601 HG22 VAL 75 HG22 VAL 75 -3.445 -7.622 8.926 602 HG23 VAL 75 HG23 VAL 75 -4.671 -8.179 10.115 603 H TYR 76 H TYR 76 -4.922 -8.403 5.170 604 HA TYR 76 HA TYR 76 -7.320 -9.878 4.341 605 HB2 TYR 76 HB2 TYR 76 -6.080 -7.522 2.839 606 HB3 TYR 76 HB3 TYR 76 -7.382 -8.558 2.241 607 HD1 TYR 76 HD1 TYR 76 -9.620 -8.557 3.450 608 HD2 TYR 76 HD2 TYR 76 -6.531 -5.714 4.356 609 HE1 TYR 76 HE1 TYR 76 -11.284 -7.111 4.572 610 HE2 TYR 76 HE2 TYR 76 -8.195 -4.261 5.475 611 HH TYR 76 HH TYR 76 -10.312 -3.983 6.064 612 H TYR 77 H TYR 77 -7.025 -11.369 2.634 613 HA TYR 77 HA TYR 77 -4.222 -11.785 1.852 614 HB2 TYR 77 HB2 TYR 77 -6.245 -13.746 3.013 615 HB3 TYR 77 HB3 TYR 77 -4.946 -14.308 1.953 616 HD1 TYR 77 HD1 TYR 77 -5.156 -11.920 4.895 617 HD2 TYR 77 HD2 TYR 77 -3.209 -15.302 3.099 618 HE1 TYR 77 HE1 TYR 77 -3.632 -12.077 6.842 619 HE2 TYR 77 HE2 TYR 77 -1.689 -15.464 5.045 620 HH TYR 77 HH TYR 77 -2.231 -14.197 7.934 621 H SER 78 H SER 78 -3.983 -12.076 -0.402 622 HA SER 78 HA SER 78 -6.529 -12.672 -1.851 623 HB2 SER 78 HB2 SER 78 -5.363 -11.519 -3.778 624 HB3 SER 78 HB3 SER 78 -5.735 -10.447 -2.421 625 HG SER 78 HG SER 78 -3.521 -10.622 -1.726 626 H GLU 79 H GLU 79 -6.244 -14.975 -1.560 627 HA GLU 79 HA GLU 79 -3.894 -16.390 -2.105 628 HB2 GLU 79 HB2 GLU 79 -6.275 -17.060 -1.112 629 HB3 GLU 79 HB3 GLU 79 -6.718 -17.346 -2.800 630 HG2 GLU 79 HG2 GLU 79 -4.478 -18.733 -1.260 631 HG3 GLU 79 HG3 GLU 79 -6.046 -19.429 -1.690 632 H GLU 80 H GLU 80 -6.602 -15.338 -4.295 633 HA GLU 80 HA GLU 80 -5.733 -16.703 -6.571 634 HB2 GLU 80 HB2 GLU 80 -7.205 -14.024 -6.373 635 HB3 GLU 80 HB3 GLU 80 -7.200 -15.118 -7.763 636 HG2 GLU 80 HG2 GLU 80 -8.451 -16.802 -6.552 637 HG3 GLU 80 HG3 GLU 80 -8.260 -15.936 -5.022 638 H ALA 81 H ALA 81 -4.495 -13.693 -5.080 639 HA ALA 81 HA ALA 81 -2.857 -13.317 -7.484 640 HB1 ALA 81 HB1 ALA 81 -2.558 -10.987 -6.616 641 HB2 ALA 81 HB2 ALA 81 -4.282 -11.392 -6.914 642 HB3 ALA 81 HB3 ALA 81 -3.637 -11.387 -5.238 643 H LYS 82 H LYS 82 -2.644 -14.447 -4.223 644 HA LYS 82 HA LYS 82 -0.898 -15.166 -3.035 645 HB2 LYS 82 HB2 LYS 82 0.780 -14.331 -5.463 646 HB3 LYS 82 HB3 LYS 82 1.359 -15.297 -4.099 647 HG2 LYS 82 HG2 LYS 82 -0.932 -16.160 -5.928 648 HG3 LYS 82 HG3 LYS 82 0.758 -16.604 -6.196 649 HD2 LYS 82 HD2 LYS 82 0.843 -17.705 -3.965 650 HD3 LYS 82 HD3 LYS 82 -0.830 -17.225 -3.649 651 HE2 LYS 82 HE2 LYS 82 -0.056 -18.886 -6.092 652 HE3 LYS 82 HE3 LYS 82 -0.410 -19.631 -4.528 653 HZ1 LYS 82 HZ1 LYS 82 -2.243 -19.092 -6.355 654 HZ2 LYS 82 HZ2 LYS 82 -2.576 -19.204 -4.761 655 HZ3 LYS 82 HZ3 LYS 82 -2.374 -17.739 -5.451 656 H LYS 83 H LYS 83 -1.940 -12.587 -2.556 657 HA LYS 83 HA LYS 83 0.490 -11.233 -1.642 658 HB2 LYS 83 HB2 LYS 83 -1.871 -10.042 -3.167 659 HB3 LYS 83 HB3 LYS 83 -0.862 -9.049 -2.108 660 HG2 LYS 83 HG2 LYS 83 0.415 -8.687 -3.931 661 HG3 LYS 83 HG3 LYS 83 1.050 -10.316 -3.661 662 HD2 LYS 83 HD2 LYS 83 0.361 -10.185 -5.973 663 HD3 LYS 83 HD3 LYS 83 -0.795 -11.230 -5.136 664 HE2 LYS 83 HE2 LYS 83 -2.538 -9.814 -5.513 665 HE3 LYS 83 HE3 LYS 83 -1.599 -8.385 -5.060 666 HZ1 LYS 83 HZ1 LYS 83 -2.364 -8.669 -7.472 667 HZ2 LYS 83 HZ2 LYS 83 -0.843 -8.137 -7.207 668 HZ3 LYS 83 HZ3 LYS 83 -1.102 -9.691 -7.637 669 H LYS 84 H LYS 84 0.393 -10.608 0.493 670 HA LYS 84 HA LYS 84 -2.272 -10.648 1.765 671 HB2 LYS 84 HB2 LYS 84 -0.923 -12.535 2.528 672 HB3 LYS 84 HB3 LYS 84 0.477 -11.491 2.804 673 HG2 LYS 84 HG2 LYS 84 -1.149 -10.210 4.462 674 HG3 LYS 84 HG3 LYS 84 -2.086 -11.709 4.407 675 HD2 LYS 84 HD2 LYS 84 -0.212 -13.019 5.225 676 HD3 LYS 84 HD3 LYS 84 0.912 -11.670 5.007 677 HE2 LYS 84 HE2 LYS 84 -0.352 -10.346 6.718 678 HE3 LYS 84 HE3 LYS 84 -1.467 -11.702 6.940 679 HZ1 LYS 84 HZ1 LYS 84 0.688 -11.358 8.397 680 HZ2 LYS 84 HZ2 LYS 84 0.060 -12.836 8.102 681 HZ3 LYS 84 HZ3 LYS 84 1.342 -12.307 7.240 682 H VAL 85 H VAL 85 -2.769 -8.882 3.180 683 HA VAL 85 HA VAL 85 -0.600 -6.892 3.524 684 HB VAL 85 HB VAL 85 -2.389 -5.120 3.192 685 HG11 VAL 85 HG11 VAL 85 -2.318 -5.203 0.706 686 HG12 VAL 85 HG12 VAL 85 -0.731 -5.612 1.439 687 HG13 VAL 85 HG13 VAL 85 -1.782 -6.915 0.790 688 HG21 VAL 85 HG21 VAL 85 -4.410 -5.690 1.891 689 HG22 VAL 85 HG22 VAL 85 -3.993 -7.433 2.018 690 HG23 VAL 85 HG23 VAL 85 -4.387 -6.493 3.497 691 H GLU 86 H GLU 86 -0.489 -6.143 5.640 692 HA GLU 86 HA GLU 86 -2.834 -6.640 7.357 693 HB2 GLU 86 HB2 GLU 86 -1.162 -7.281 9.166 694 HB3 GLU 86 HB3 GLU 86 -1.445 -8.480 7.896 695 HG2 GLU 86 HG2 GLU 86 0.713 -7.123 6.850 696 HG3 GLU 86 HG3 GLU 86 1.027 -6.961 8.583 697 H VAL 87 H VAL 87 -3.518 -4.775 8.221 698 HA VAL 87 HA VAL 87 -1.939 -2.415 8.064 699 HB VAL 87 HB VAL 87 -4.353 -2.273 7.936 700 HG11 VAL 87 HG11 VAL 87 -5.846 -2.837 9.829 701 HG12 VAL 87 HG12 VAL 87 -4.971 -4.273 9.198 702 HG13 VAL 87 HG13 VAL 87 -4.440 -3.499 10.729 703 HG21 VAL 87 HG21 VAL 87 -4.844 -0.608 9.712 704 HG22 VAL 87 HG22 VAL 87 -3.372 -1.134 10.596 705 HG23 VAL 87 HG23 VAL 87 -3.222 -0.364 8.980 706 H LEU 88 H LEU 88 -0.136 -2.130 9.377 707 HA LEU 88 HA LEU 88 0.087 -3.542 11.867 708 HB2 LEU 88 HB2 LEU 88 1.778 -1.320 10.596 709 HB3 LEU 88 HB3 LEU 88 2.242 -2.261 12.020 710 HG LEU 88 HG LEU 88 1.850 -3.337 9.195 711 HD11 LEU 88 HD11 LEU 88 4.291 -3.728 9.280 712 HD12 LEU 88 HD12 LEU 88 3.881 -1.987 9.448 713 HD13 LEU 88 HD13 LEU 88 4.355 -2.942 10.894 714 HD21 LEU 88 HD21 LEU 88 2.745 -5.459 10.098 715 HD22 LEU 88 HD22 LEU 88 2.736 -4.753 11.749 716 HD23 LEU 88 HD23 LEU 88 1.189 -5.001 10.870 717 H ASP 89 H ASP 89 -0.143 0.014 10.937 718 HA ASP 89 HA ASP 89 -1.653 0.483 13.355 719 HB2 ASP 89 HB2 ASP 89 0.964 0.636 13.816 720 HB3 ASP 89 HB3 ASP 89 0.824 2.185 12.974 721 H THR 90 H THR 90 -2.859 2.494 13.200 722 HA THR 90 HA THR 90 -2.340 4.226 10.952 723 HB THR 90 HB THR 90 -3.672 2.266 10.048 724 HG1 THR 90 HG1 THR 90 -4.640 3.637 8.680 725 HG21 THR 90 HG21 THR 90 -6.100 2.211 10.571 726 HG22 THR 90 HG22 THR 90 -5.091 1.841 12.010 727 HG23 THR 90 HG23 THR 90 -5.846 3.461 11.835 728 H ASP 91 H ASP 91 -3.166 6.317 11.285 729 HA ASP 91 HA ASP 91 -4.451 6.695 13.901 730 HB2 ASP 91 HB2 ASP 91 -2.278 7.889 13.276 731 HB3 ASP 91 HB3 ASP 91 -3.191 8.764 12.040 732 H TYR 92 H TYR 92 -6.528 7.622 14.059 733 HA TYR 92 HA TYR 92 -8.203 7.461 11.815 734 HB2 TYR 92 HB2 TYR 92 -8.458 8.644 14.595 735 HB3 TYR 92 HB3 TYR 92 -9.742 8.864 13.399 736 HD1 TYR 92 HD1 TYR 92 -11.010 6.907 12.536 737 HD2 TYR 92 HD2 TYR 92 -8.040 6.461 15.607 738 HE1 TYR 92 HE1 TYR 92 -11.916 4.670 13.084 739 HE2 TYR 92 HE2 TYR 92 -8.946 4.223 16.160 740 HH TYR 92 HH TYR 92 -11.759 2.875 14.362 741 H LYS 93 H LYS 93 -6.258 10.181 13.128 742 HA LYS 93 HA LYS 93 -7.164 11.750 10.822 743 HB2 LYS 93 HB2 LYS 93 -6.766 12.689 13.689 744 HB3 LYS 93 HB3 LYS 93 -6.966 13.766 12.300 745 HG2 LYS 93 HG2 LYS 93 -9.218 12.717 11.861 746 HG3 LYS 93 HG3 LYS 93 -9.015 11.738 13.320 747 HD2 LYS 93 HD2 LYS 93 -8.803 13.810 14.695 748 HD3 LYS 93 HD3 LYS 93 -8.968 14.802 13.241 749 HE2 LYS 93 HE2 LYS 93 -11.072 12.819 14.253 750 HE3 LYS 93 HE3 LYS 93 -11.109 14.563 14.543 751 HZ1 LYS 93 HZ1 LYS 93 -12.443 14.147 12.686 752 HZ2 LYS 93 HZ2 LYS 93 -11.077 14.791 12.065 753 HZ3 LYS 93 HZ3 LYS 93 -11.345 13.184 11.956 754 H SER 94 H SER 94 -4.715 9.996 11.143 755 HA SER 94 HA SER 94 -2.885 12.135 10.369 756 HB2 SER 94 HB2 SER 94 -2.617 11.810 12.894 757 HB3 SER 94 HB3 SER 94 -2.322 10.087 12.629 758 HG SER 94 HG SER 94 -0.279 10.605 12.353 759 H TYR 95 H TYR 95 -0.589 10.160 10.663 760 HA TYR 95 HA TYR 95 -0.887 9.048 8.034 761 HB2 TYR 95 HB2 TYR 95 1.471 8.174 8.604 762 HB3 TYR 95 HB3 TYR 95 1.271 9.931 8.581 763 HD1 TYR 95 HD1 TYR 95 1.496 6.965 10.862 764 HD2 TYR 95 HD2 TYR 95 1.672 11.244 10.538 765 HE1 TYR 95 HE1 TYR 95 2.336 7.107 13.189 766 HE2 TYR 95 HE2 TYR 95 2.523 11.387 12.855 767 HH TYR 95 HH TYR 95 3.088 10.299 14.683 768 H ALA 96 H ALA 96 -0.123 6.687 7.654 769 HA ALA 96 HA ALA 96 -0.773 4.862 9.828 770 HB1 ALA 96 HB1 ALA 96 -2.384 3.643 8.422 771 HB2 ALA 96 HB2 ALA 96 -2.942 5.307 8.802 772 HB3 ALA 96 HB3 ALA 96 -2.268 4.935 7.180 773 H VAL 97 H VAL 97 0.134 2.760 9.572 774 HA VAL 97 HA VAL 97 1.836 2.511 7.188 775 HB VAL 97 HB VAL 97 3.488 1.308 8.654 776 HG11 VAL 97 HG11 VAL 97 4.471 3.372 9.613 777 HG12 VAL 97 HG12 VAL 97 3.853 3.634 7.947 778 HG13 VAL 97 HG13 VAL 97 2.911 4.225 9.357 779 HG21 VAL 97 HG21 VAL 97 3.415 1.713 11.092 780 HG22 VAL 97 HG22 VAL 97 1.808 2.494 10.909 781 HG23 VAL 97 HG23 VAL 97 2.009 0.750 10.527 782 H ILE 98 H ILE 98 1.452 0.614 6.052 783 HA ILE 98 HA ILE 98 0.125 -1.544 7.552 784 HB ILE 98 HB ILE 98 -0.197 -0.958 4.575 785 HG12 ILE 98 HG12 ILE 98 -1.063 0.985 5.734 786 HG13 ILE 98 HG13 ILE 98 -2.408 0.021 5.109 787 HG21 ILE 98 HG21 ILE 98 -2.196 -2.402 4.807 788 HG22 ILE 98 HG22 ILE 98 -0.686 -3.257 5.270 789 HG23 ILE 98 HG23 ILE 98 -1.802 -2.654 6.541 790 HD11 ILE 98 HD11 ILE 98 -2.892 0.858 7.364 791 HD12 ILE 98 HD12 ILE 98 -2.788 -0.935 7.364 792 HD13 ILE 98 HD13 ILE 98 -1.422 0.044 7.998 793 H TYR 99 H TYR 99 0.930 -3.667 7.186 794 HA TYR 99 HA TYR 99 3.467 -3.752 5.713 795 HB2 TYR 99 HB2 TYR 99 3.355 -4.454 8.140 796 HB3 TYR 99 HB3 TYR 99 2.246 -5.751 7.673 797 HD1 TYR 99 HD1 TYR 99 5.680 -4.411 6.896 798 HD2 TYR 99 HD2 TYR 99 3.109 -7.846 7.050 799 HE1 TYR 99 HE1 TYR 99 7.611 -5.875 6.394 800 HE2 TYR 99 HE2 TYR 99 5.036 -9.313 6.543 801 HH TYR 99 HH TYR 99 7.173 -9.380 5.840 802 H ALA 100 H ALA 100 3.758 -5.246 3.977 803 HA ALA 100 HA ALA 100 1.443 -6.924 3.336 804 HB1 ALA 100 HB1 ALA 100 1.653 -6.251 0.960 805 HB2 ALA 100 HB2 ALA 100 1.199 -4.873 2.020 806 HB3 ALA 100 HB3 ALA 100 2.887 -5.032 1.427 807 H THR 101 H THR 101 1.890 -8.845 2.218 808 HA THR 101 HA THR 101 4.684 -9.371 1.571 809 HB THR 101 HB THR 101 2.984 -11.065 3.472 810 HG1 THR 101 HG1 THR 101 5.612 -9.943 3.957 811 HG21 THR 101 HG21 THR 101 4.963 -12.556 3.586 812 HG22 THR 101 HG22 THR 101 4.285 -12.477 1.924 813 HG23 THR 101 HG23 THR 101 5.777 -11.563 2.329 814 H ARG 102 H ARG 102 4.886 -10.915 -0.136 815 HA ARG 102 HA ARG 102 2.384 -12.179 -1.064 816 HB2 ARG 102 HB2 ARG 102 2.562 -11.338 -3.176 817 HB3 ARG 102 HB3 ARG 102 3.210 -9.958 -2.279 818 HG2 ARG 102 HG2 ARG 102 5.531 -10.731 -2.752 819 HG3 ARG 102 HG3 ARG 102 4.893 -12.125 -3.634 820 HD2 ARG 102 HD2 ARG 102 4.712 -9.176 -4.366 821 HD3 ARG 102 HD3 ARG 102 5.418 -10.500 -5.302 822 HE ARG 102 HE ARG 102 2.471 -10.308 -4.803 823 HH11 ARG 102 HH11 ARG 102 5.154 -10.266 -7.048 824 HH12 ARG 102 HH12 ARG 102 4.223 -10.851 -8.386 825 HH21 ARG 102 HH21 ARG 102 1.284 -11.301 -6.543 826 HH22 ARG 102 HH22 ARG 102 2.027 -11.438 -8.101 827 H VAL 103 H VAL 103 2.751 -14.392 -1.593 828 HA VAL 103 HA VAL 103 5.597 -15.113 -1.685 829 HB VAL 103 HB VAL 103 3.248 -16.842 -0.748 830 HG11 VAL 103 HG11 VAL 103 5.018 -18.347 0.102 831 HG12 VAL 103 HG12 VAL 103 5.111 -18.133 -1.679 832 HG13 VAL 103 HG13 VAL 103 6.267 -17.270 -0.609 833 HG21 VAL 103 HG21 VAL 103 4.158 -16.541 1.533 834 HG22 VAL 103 HG22 VAL 103 5.365 -15.376 0.890 835 HG23 VAL 103 HG23 VAL 103 3.613 -14.988 0.814 836 H LYS 104 H LYS 104 6.309 -16.216 -3.456 837 HA LYS 104 HA LYS 104 4.294 -17.126 -5.418 838 HB2 LYS 104 HB2 LYS 104 5.876 -15.214 -6.008 839 HB3 LYS 104 HB3 LYS 104 7.206 -16.370 -5.859 840 HG2 LYS 104 HG2 LYS 104 4.865 -16.952 -7.708 841 HG3 LYS 104 HG3 LYS 104 6.169 -15.872 -8.219 842 HD2 LYS 104 HD2 LYS 104 7.824 -17.725 -7.605 843 HD3 LYS 104 HD3 LYS 104 6.437 -18.791 -7.342 844 HE2 LYS 104 HE2 LYS 104 7.130 -17.358 -9.958 845 HE3 LYS 104 HE3 LYS 104 7.390 -19.073 -9.616 846 HZ1 LYS 104 HZ1 LYS 104 5.402 -19.142 -10.656 847 HZ2 LYS 104 HZ2 LYS 104 4.837 -18.954 -9.136 848 HZ3 LYS 104 HZ3 LYS 104 4.903 -17.674 -10.147 849 H ASP 105 H ASP 105 4.865 -19.197 -6.526 850 HA ASP 105 HA ASP 105 5.388 -21.275 -4.955 851 HB2 ASP 105 HB2 ASP 105 6.548 -21.202 -7.777 852 HB3 ASP 105 HB3 ASP 105 5.826 -22.572 -6.923 853 H GLY 106 H GLY 106 7.038 -21.271 -3.354 854 HA2 GLY 106 HA2 GLY 106 9.152 -21.991 -2.812 855 HA3 GLY 106 HA3 GLY 106 9.685 -21.720 -4.476 856 H ARG 107 H ARG 107 8.116 -18.809 -3.541 857 HA ARG 107 HA ARG 107 10.517 -17.783 -2.227 858 HB2 ARG 107 HB2 ARG 107 10.935 -17.477 -4.643 859 HB3 ARG 107 HB3 ARG 107 9.334 -16.760 -4.867 860 HG2 ARG 107 HG2 ARG 107 9.946 -14.725 -3.893 861 HG3 ARG 107 HG3 ARG 107 11.229 -15.447 -2.913 862 HD2 ARG 107 HD2 ARG 107 11.417 -15.437 -5.954 863 HD3 ARG 107 HD3 ARG 107 11.871 -14.005 -5.021 864 HE ARG 107 HE ARG 107 13.627 -15.301 -3.954 865 HH11 ARG 107 HH11 ARG 107 12.027 -16.933 -6.629 866 HH12 ARG 107 HH12 ARG 107 13.327 -18.049 -6.882 867 HH21 ARG 107 HH21 ARG 107 15.326 -16.766 -4.304 868 HH22 ARG 107 HH22 ARG 107 15.205 -17.955 -5.559 869 H THR 108 H THR 108 10.115 -16.231 -0.713 870 HA THR 108 HA THR 108 7.356 -15.229 -0.562 871 HB THR 108 HB THR 108 9.296 -15.197 1.743 872 HG1 THR 108 HG1 THR 108 8.585 -17.404 2.245 873 HG21 THR 108 HG21 THR 108 7.229 -15.597 3.035 874 HG22 THR 108 HG22 THR 108 7.089 -14.149 1.981 875 HG23 THR 108 HG23 THR 108 6.293 -15.688 1.505 876 H LEU 109 H LEU 109 7.031 -13.008 -0.848 877 HA LEU 109 HA LEU 109 9.450 -11.346 -0.496 878 HB2 LEU 109 HB2 LEU 109 8.799 -11.550 -2.858 879 HB3 LEU 109 HB3 LEU 109 7.138 -11.081 -2.470 880 HG LEU 109 HG LEU 109 7.952 -8.837 -1.756 881 HD11 LEU 109 HD11 LEU 109 10.245 -8.139 -2.357 882 HD12 LEU 109 HD12 LEU 109 10.238 -9.436 -1.114 883 HD13 LEU 109 HD13 LEU 109 10.632 -9.830 -2.821 884 HD21 LEU 109 HD21 LEU 109 8.450 -8.006 -4.034 885 HD22 LEU 109 HD22 LEU 109 8.748 -9.692 -4.577 886 HD23 LEU 109 HD23 LEU 109 7.109 -9.201 -4.031 887 H HIS 110 H HIS 110 9.244 -9.436 0.703 888 HA HIS 110 HA HIS 110 6.575 -9.031 1.917 889 HB2 HIS 110 HB2 HIS 110 9.360 -8.512 3.075 890 HB3 HIS 110 HB3 HIS 110 7.837 -8.051 3.845 891 HD2 HIS 110 HD2 HIS 110 10.244 -10.998 3.751 892 HE1 HIS 110 HE1 HIS 110 6.596 -12.498 5.404 893 H MET 111 H MET 111 5.927 -6.735 2.097 894 HA MET 111 HA MET 111 7.788 -4.722 0.997 895 HB2 MET 111 HB2 MET 111 5.213 -5.738 -0.259 896 HB3 MET 111 HB3 MET 111 5.571 -4.008 -0.339 897 HG2 MET 111 HG2 MET 111 7.788 -4.568 -1.408 898 HG3 MET 111 HG3 MET 111 7.312 -6.271 -1.421 899 HE1 MET 111 HE1 MET 111 7.533 -4.583 -4.858 900 HE2 MET 111 HE2 MET 111 8.271 -5.658 -3.622 901 HE3 MET 111 HE3 MET 111 7.040 -6.307 -4.758 902 H MET 112 H MET 112 7.752 -3.157 2.564 903 HA MET 112 HA MET 112 5.349 -3.008 4.282 904 HB2 MET 112 HB2 MET 112 7.619 -3.072 5.348 905 HB3 MET 112 HB3 MET 112 8.118 -1.662 4.405 906 HG2 MET 112 HG2 MET 112 7.549 -0.973 6.675 907 HG3 MET 112 HG3 MET 112 6.388 -0.279 5.535 908 HE1 MET 112 HE1 MET 112 3.728 -0.679 8.087 909 HE2 MET 112 HE2 MET 112 5.370 -0.469 8.784 910 HE3 MET 112 HE3 MET 112 4.931 0.364 7.255 911 H ARG 113 H ARG 113 4.200 -0.901 4.392 912 HA ARG 113 HA ARG 113 5.057 1.183 2.568 913 HB2 ARG 113 HB2 ARG 113 2.961 -0.770 1.935 914 HB3 ARG 113 HB3 ARG 113 2.266 0.852 2.060 915 HG2 ARG 113 HG2 ARG 113 3.015 1.342 0.002 916 HG3 ARG 113 HG3 ARG 113 4.683 1.108 0.538 917 HD2 ARG 113 HD2 ARG 113 4.115 -0.345 -1.402 918 HD3 ARG 113 HD3 ARG 113 4.579 -1.289 0.019 919 HE ARG 113 HE ARG 113 1.694 -0.836 -0.629 920 HH11 ARG 113 HH11 ARG 113 4.410 -2.991 -0.119 921 HH12 ARG 113 HH12 ARG 113 3.429 -4.415 -0.024 922 HH21 ARG 113 HH21 ARG 113 0.392 -2.695 -0.385 923 HH22 ARG 113 HH22 ARG 113 1.131 -4.247 -0.176 924 H LEU 114 H LEU 114 3.983 3.222 2.888 925 HA LEU 114 HA LEU 114 2.352 3.365 5.346 926 HB2 LEU 114 HB2 LEU 114 4.719 3.953 5.827 927 HB3 LEU 114 HB3 LEU 114 4.658 5.190 4.564 928 HG LEU 114 HG LEU 114 2.787 5.217 6.960 929 HD11 LEU 114 HD11 LEU 114 4.349 6.850 7.981 930 HD12 LEU 114 HD12 LEU 114 5.106 5.235 7.779 931 HD13 LEU 114 HD13 LEU 114 5.511 6.565 6.642 932 HD21 LEU 114 HD21 LEU 114 2.617 7.625 6.415 933 HD22 LEU 114 HD22 LEU 114 3.712 7.379 5.012 934 HD23 LEU 114 HD23 LEU 114 2.100 6.587 5.043 935 H TYR 115 H TYR 115 0.554 4.751 5.109 936 HA TYR 115 HA TYR 115 0.509 6.308 2.607 937 HB2 TYR 115 HB2 TYR 115 -1.782 5.782 2.274 938 HB3 TYR 115 HB3 TYR 115 -0.888 4.266 2.452 939 HD1 TYR 115 HD1 TYR 115 -1.121 2.914 4.560 940 HD2 TYR 115 HD2 TYR 115 -3.519 6.402 3.825 941 HE1 TYR 115 HE1 TYR 115 -2.718 2.184 6.308 942 HE2 TYR 115 HE2 TYR 115 -5.120 5.672 5.566 943 HH TYR 115 HH TYR 115 -4.905 2.481 7.054 944 H SER 116 H SER 116 -0.683 8.310 2.635 945 HA SER 116 HA SER 116 -0.893 9.362 5.405 946 HB2 SER 116 HB2 SER 116 -0.330 10.773 2.715 947 HB3 SER 116 HB3 SER 116 -0.538 11.602 4.263 948 HG SER 116 HG SER 116 1.588 11.342 4.369 949 H ARG 117 H ARG 117 -2.811 10.882 5.683 950 HA ARG 117 HA ARG 117 -5.145 9.802 4.583 951 HB2 ARG 117 HB2 ARG 117 -4.419 11.716 6.582 952 HB3 ARG 117 HB3 ARG 117 -5.464 12.591 5.455 953 HG2 ARG 117 HG2 ARG 117 -7.189 10.782 5.676 954 HG3 ARG 117 HG3 ARG 117 -6.147 9.946 6.834 955 HD2 ARG 117 HD2 ARG 117 -7.621 11.146 8.220 956 HD3 ARG 117 HD3 ARG 117 -6.177 12.167 8.197 957 HE ARG 117 HE ARG 117 -7.314 13.714 6.749 958 HH11 ARG 117 HH11 ARG 117 -9.361 11.043 7.787 959 HH12 ARG 117 HH12 ARG 117 -10.835 11.871 7.410 960 HH21 ARG 117 HH21 ARG 117 -9.262 14.788 6.277 961 HH22 ARG 117 HH22 ARG 117 -10.778 13.998 6.552 962 H SER 118 H SER 118 -2.867 12.187 3.276 963 HA SER 118 HA SER 118 -4.621 12.537 0.940 964 HB2 SER 118 HB2 SER 118 -3.139 14.849 2.263 965 HB3 SER 118 HB3 SER 118 -4.260 14.910 0.897 966 HG SER 118 HG SER 118 -5.267 15.563 2.900 967 HA PRO 119 HA PRO 119 -0.609 11.982 -1.016 968 HB2 PRO 119 HB2 PRO 119 -0.577 13.852 -3.069 969 HB3 PRO 119 HB3 PRO 119 -1.685 12.475 -3.134 970 HG2 PRO 119 HG2 PRO 119 -2.232 15.328 -2.275 971 HG3 PRO 119 HG3 PRO 119 -3.212 14.264 -3.293 972 HD2 PRO 119 HD2 PRO 119 -3.775 14.669 -0.637 973 HD3 PRO 119 HD3 PRO 119 -4.152 13.147 -1.454 974 H GLU 120 H GLU 120 0.028 13.053 1.289 975 HA GLU 120 HA GLU 120 2.203 14.837 0.587 976 HB2 GLU 120 HB2 GLU 120 1.469 16.396 2.515 977 HB3 GLU 120 HB3 GLU 120 0.732 16.602 0.920 978 HG2 GLU 120 HG2 GLU 120 -1.224 15.194 1.720 979 HG3 GLU 120 HG3 GLU 120 -0.502 15.197 3.334 980 H VAL 121 H VAL 121 3.959 13.963 1.560 981 HA VAL 121 HA VAL 121 3.547 12.027 3.639 982 HB VAL 121 HB VAL 121 6.132 13.430 2.606 983 HG11 VAL 121 HG11 VAL 121 7.326 11.429 3.459 984 HG12 VAL 121 HG12 VAL 121 6.456 12.298 4.768 985 HG13 VAL 121 HG13 VAL 121 5.775 10.781 4.092 986 HG21 VAL 121 HG21 VAL 121 6.440 11.306 1.249 987 HG22 VAL 121 HG22 VAL 121 4.730 10.913 1.634 988 HG23 VAL 121 HG23 VAL 121 5.122 12.402 0.709 989 H SER 122 H SER 122 3.939 12.353 5.834 990 HA SER 122 HA SER 122 4.634 15.057 6.740 991 HB2 SER 122 HB2 SER 122 3.396 14.346 8.823 992 HB3 SER 122 HB3 SER 122 2.395 14.487 7.372 993 HG SER 122 HG SER 122 1.991 12.500 8.539 994 HA PRO 123 HA PRO 123 8.386 13.731 8.616 995 HB2 PRO 123 HB2 PRO 123 8.184 15.307 10.982 996 HB3 PRO 123 HB3 PRO 123 8.823 15.923 9.452 997 HG2 PRO 123 HG2 PRO 123 6.059 16.222 10.628 998 HG3 PRO 123 HG3 PRO 123 7.024 17.397 9.725 999 HD2 PRO 123 HD2 PRO 123 4.985 16.086 8.523 1000 HD3 PRO 123 HD3 PRO 123 6.465 16.447 7.625 1001 H ALA 124 H ALA 124 5.487 13.986 10.812 1002 HA ALA 124 HA ALA 124 6.451 12.273 12.782 1003 HB1 ALA 124 HB1 ALA 124 4.065 11.974 13.356 1004 HB2 ALA 124 HB2 ALA 124 4.470 13.696 13.042 1005 HB3 ALA 124 HB3 ALA 124 3.600 12.736 11.797 1006 H ALA 125 H ALA 125 4.520 11.503 9.768 1007 HA ALA 125 HA ALA 125 4.336 8.742 10.306 1008 HB1 ALA 125 HB1 ALA 125 3.792 8.587 7.897 1009 HB2 ALA 125 HB2 ALA 125 2.904 9.930 8.692 1010 HB3 ALA 125 HB3 ALA 125 4.336 10.283 7.667 1011 H THR 126 H THR 126 6.825 10.803 8.702 1012 HA THR 126 HA THR 126 8.273 8.717 7.532 1013 HB THR 126 HB THR 126 9.293 11.406 8.573 1014 HG1 THR 126 HG1 THR 126 7.595 11.827 7.131 1015 HG21 THR 126 HG21 THR 126 10.998 11.136 6.784 1016 HG22 THR 126 HG22 THR 126 11.079 9.801 7.983 1017 HG23 THR 126 HG23 THR 126 10.313 9.525 6.382 1018 H ALA 127 H ALA 127 8.712 10.486 10.721 1019 HA ALA 127 HA ALA 127 10.953 8.998 11.523 1020 HB1 ALA 127 HB1 ALA 127 10.415 9.893 13.770 1021 HB2 ALA 127 HB2 ALA 127 10.334 11.162 12.502 1022 HB3 ALA 127 HB3 ALA 127 8.821 10.451 13.157 1023 H ILE 128 H ILE 128 7.394 8.448 11.972 1024 HA ILE 128 HA ILE 128 7.689 6.360 13.825 1025 HB ILE 128 HB ILE 128 5.482 7.115 11.873 1026 HG12 ILE 128 HG12 ILE 128 5.863 8.665 13.736 1027 HG13 ILE 128 HG13 ILE 128 4.320 7.823 13.928 1028 HG21 ILE 128 HG21 ILE 128 4.024 5.515 13.065 1029 HG22 ILE 128 HG22 ILE 128 5.369 4.692 12.206 1030 HG23 ILE 128 HG23 ILE 128 5.444 4.915 13.986 1031 HD11 ILE 128 HD11 ILE 128 5.506 7.995 16.073 1032 HD12 ILE 128 HD12 ILE 128 5.351 6.277 15.571 1033 HD13 ILE 128 HD13 ILE 128 6.919 7.132 15.377 1034 H PHE 129 H PHE 129 7.130 6.314 10.205 1035 HA PHE 129 HA PHE 129 7.184 3.552 9.895 1036 HB2 PHE 129 HB2 PHE 129 6.493 5.332 8.222 1037 HB3 PHE 129 HB3 PHE 129 8.205 5.698 7.971 1038 HD1 PHE 129 HD1 PHE 129 5.539 3.187 7.464 1039 HD2 PHE 129 HD2 PHE 129 9.637 4.215 6.703 1040 HE1 PHE 129 HE1 PHE 129 5.657 1.421 5.735 1041 HE2 PHE 129 HE2 PHE 129 9.764 2.444 4.976 1042 HZ PHE 129 HZ PHE 129 7.771 1.043 4.486 1043 H ARG 130 H ARG 130 9.908 5.949 10.063 1044 HA ARG 130 HA ARG 130 11.850 4.024 9.296 1045 HB2 ARG 130 HB2 ARG 130 11.866 6.677 9.269 1046 HB3 ARG 130 HB3 ARG 130 12.505 6.489 10.907 1047 HG2 ARG 130 HG2 ARG 130 14.179 4.776 9.741 1048 HG3 ARG 130 HG3 ARG 130 13.733 5.648 8.268 1049 HD2 ARG 130 HD2 ARG 130 14.941 6.833 10.815 1050 HD3 ARG 130 HD3 ARG 130 15.730 6.665 9.242 1051 HE ARG 130 HE ARG 130 13.542 8.218 8.654 1052 HH11 ARG 130 HH11 ARG 130 16.114 8.448 11.040 1053 HH12 ARG 130 HH12 ARG 130 16.051 10.177 11.118 1054 HH21 ARG 130 HH21 ARG 130 13.469 10.486 8.771 1055 HH22 ARG 130 HH22 ARG 130 14.546 11.336 9.827 1056 H LYS 131 H LYS 131 10.691 5.311 12.505 1057 HA LYS 131 HA LYS 131 12.629 4.199 14.110 1058 HB2 LYS 131 HB2 LYS 131 9.662 4.739 14.470 1059 HB3 LYS 131 HB3 LYS 131 10.588 3.955 15.757 1060 HG2 LYS 131 HG2 LYS 131 12.191 5.907 15.731 1061 HG3 LYS 131 HG3 LYS 131 11.159 6.698 14.533 1062 HD2 LYS 131 HD2 LYS 131 9.296 6.822 16.075 1063 HD3 LYS 131 HD3 LYS 131 10.082 5.730 17.224 1064 HE2 LYS 131 HE2 LYS 131 11.949 7.467 17.458 1065 HE3 LYS 131 HE3 LYS 131 10.965 8.565 16.481 1066 HZ1 LYS 131 HZ1 LYS 131 10.613 8.909 18.823 1067 HZ2 LYS 131 HZ2 LYS 131 9.227 8.377 18.143 1068 HZ3 LYS 131 HZ3 LYS 131 10.136 7.363 19.044 1069 H LEU 132 H LEU 132 9.579 2.619 12.835 1070 HA LEU 132 HA LEU 132 10.087 0.153 14.151 1071 HB2 LEU 132 HB2 LEU 132 8.444 0.812 11.668 1072 HB3 LEU 132 HB3 LEU 132 8.387 -0.711 12.565 1073 HG LEU 132 HG LEU 132 7.603 2.019 13.677 1074 HD11 LEU 132 HD11 LEU 132 5.293 1.144 13.567 1075 HD12 LEU 132 HD12 LEU 132 6.052 1.246 11.942 1076 HD13 LEU 132 HD13 LEU 132 5.901 -0.343 12.764 1077 HD21 LEU 132 HD21 LEU 132 6.672 0.722 15.564 1078 HD22 LEU 132 HD22 LEU 132 7.339 -0.785 14.850 1079 HD23 LEU 132 HD23 LEU 132 8.449 0.509 15.413 1080 H ALA 133 H ALA 133 10.802 1.486 10.839 1081 HA ALA 133 HA ALA 133 11.761 -0.849 9.691 1082 HB1 ALA 133 HB1 ALA 133 12.967 0.682 8.160 1083 HB2 ALA 133 HB2 ALA 133 11.272 1.207 8.439 1084 HB3 ALA 133 HB3 ALA 133 12.623 2.051 9.269 1085 H GLY 134 H GLY 134 13.480 1.574 11.822 1086 HA2 GLY 134 HA2 GLY 134 16.040 0.402 11.398 1087 HA3 GLY 134 HA3 GLY 134 15.566 1.535 12.670 1088 H GLU 135 H GLU 135 13.301 -0.220 13.656 1089 HA GLU 135 HA GLU 135 14.745 -1.670 15.590 1090 HB2 GLU 135 HB2 GLU 135 12.421 -0.734 15.803 1091 HB3 GLU 135 HB3 GLU 135 11.850 -1.948 14.651 1092 HG2 GLU 135 HG2 GLU 135 12.675 -3.743 16.242 1093 HG3 GLU 135 HG3 GLU 135 13.044 -2.467 17.409 1094 H ARG 136 H ARG 136 13.654 -2.454 12.285 1095 HA ARG 136 HA ARG 136 14.129 -5.303 12.779 1096 HB2 ARG 136 HB2 ARG 136 13.237 -4.059 10.159 1097 HB3 ARG 136 HB3 ARG 136 12.960 -5.697 10.765 1098 HG2 ARG 136 HG2 ARG 136 11.541 -4.530 12.640 1099 HG3 ARG 136 HG3 ARG 136 11.572 -3.117 11.578 1100 HD2 ARG 136 HD2 ARG 136 9.614 -4.189 10.882 1101 HD3 ARG 136 HD3 ARG 136 10.789 -4.785 9.703 1102 HE ARG 136 HE ARG 136 10.712 -6.923 10.708 1103 HH11 ARG 136 HH11 ARG 136 8.814 -4.610 12.558 1104 HH12 ARG 136 HH12 ARG 136 7.978 -5.831 13.457 1105 HH21 ARG 136 HH21 ARG 136 9.604 -8.513 11.899 1106 HH22 ARG 136 HH22 ARG 136 8.427 -8.050 13.082 1107 H ASN 137 H ASN 137 16.260 -2.963 12.546 1108 HA ASN 137 HA ASN 137 18.291 -2.698 11.710 1109 HB2 ASN 137 HB2 ASN 137 18.096 -5.611 10.783 1110 HB3 ASN 137 HB3 ASN 137 19.571 -4.689 11.100 1111 HD21 ASN 137 HD21 ASN 137 19.270 -3.543 13.514 1112 HD22 ASN 137 HD22 ASN 137 18.966 -4.720 14.748 1113 H TYR 138 H TYR 138 16.083 -1.906 9.964 1114 HA TYR 138 HA TYR 138 16.480 -2.942 7.350 1115 HB2 TYR 138 HB2 TYR 138 14.800 -1.373 6.794 1116 HB3 TYR 138 HB3 TYR 138 14.530 -1.461 8.539 1117 HD1 TYR 138 HD1 TYR 138 16.152 0.282 9.922 1118 HD2 TYR 138 HD2 TYR 138 14.842 0.759 5.861 1119 HE1 TYR 138 HE1 TYR 138 16.520 2.723 10.093 1120 HE2 TYR 138 HE2 TYR 138 15.206 3.201 6.030 1121 HH TYR 138 HH TYR 138 15.853 4.889 7.293 1122 H THR 139 H THR 139 17.150 -1.445 5.463 1123 HA THR 139 HA THR 139 19.433 0.287 6.234 1124 HB THR 139 HB THR 139 20.236 -0.585 3.854 1125 HG1 THR 139 HG1 THR 139 19.645 -2.865 3.611 1126 HG21 THR 139 HG21 THR 139 21.544 -2.362 4.996 1127 HG22 THR 139 HG22 THR 139 21.466 -0.864 5.984 1128 HG23 THR 139 HG23 THR 139 20.432 -2.272 6.403 1129 H ASP 140 H ASP 140 19.791 2.127 4.741 1130 HA ASP 140 HA ASP 140 17.476 3.468 4.150 1131 HB2 ASP 140 HB2 ASP 140 19.492 4.800 4.051 1132 HB3 ASP 140 HB3 ASP 140 20.417 3.502 3.285 1133 H GLU 141 H GLU 141 19.467 1.674 1.594 1134 HA GLU 141 HA GLU 141 17.694 2.253 -0.460 1135 HB2 GLU 141 HB2 GLU 141 19.654 -0.038 0.001 1136 HB3 GLU 141 HB3 GLU 141 18.706 0.087 -1.486 1137 HG2 GLU 141 HG2 GLU 141 19.760 2.613 -1.371 1138 HG3 GLU 141 HG3 GLU 141 21.036 1.702 -0.553 1139 H MET 142 H MET 142 17.047 0.164 2.279 1140 HA MET 142 HA MET 142 15.386 -1.652 0.766 1141 HB2 MET 142 HB2 MET 142 16.575 -2.361 2.833 1142 HB3 MET 142 HB3 MET 142 15.737 -1.117 3.769 1143 HG2 MET 142 HG2 MET 142 13.544 -2.259 3.178 1144 HG3 MET 142 HG3 MET 142 14.483 -3.560 2.435 1145 HE1 MET 142 HE1 MET 142 16.154 -5.458 5.059 1146 HE2 MET 142 HE2 MET 142 16.438 -4.566 3.527 1147 HE3 MET 142 HE3 MET 142 17.049 -3.901 5.079 1148 H VAL 143 H VAL 143 15.026 1.495 2.344 1149 HA VAL 143 HA VAL 143 12.130 1.239 2.198 1150 HB VAL 143 HB VAL 143 13.854 3.262 3.681 1151 HG11 VAL 143 HG11 VAL 143 11.726 4.032 4.684 1152 HG12 VAL 143 HG12 VAL 143 11.763 4.280 2.906 1153 HG13 VAL 143 HG13 VAL 143 10.821 2.919 3.603 1154 HG21 VAL 143 HG21 VAL 143 12.940 2.166 5.709 1155 HG22 VAL 143 HG22 VAL 143 12.100 0.965 4.670 1156 HG23 VAL 143 HG23 VAL 143 13.894 1.027 4.700 1157 H ALA 144 H ALA 144 10.891 3.035 1.222 1158 HA ALA 144 HA ALA 144 12.488 4.843 -0.438 1159 HB1 ALA 144 HB1 ALA 144 10.919 4.377 -2.331 1160 HB2 ALA 144 HB2 ALA 144 11.837 2.909 -1.852 1161 HB3 ALA 144 HB3 ALA 144 10.127 3.105 -1.341 1162 H MET 145 H MET 145 11.755 6.875 -0.321 1163 HA MET 145 HA MET 145 9.013 7.377 0.461 1164 HB2 MET 145 HB2 MET 145 11.494 8.670 1.535 1165 HB3 MET 145 HB3 MET 145 9.887 9.398 1.660 1166 HG2 MET 145 HG2 MET 145 9.084 7.369 2.884 1167 HG3 MET 145 HG3 MET 145 10.712 6.686 2.792 1168 HE1 MET 145 HE1 MET 145 10.055 10.841 4.594 1169 HE2 MET 145 HE2 MET 145 9.232 10.103 3.178 1170 HE3 MET 145 HE3 MET 145 8.631 9.775 4.838 1171 H LEU 146 H LEU 146 7.899 9.212 -0.406 1172 HA LEU 146 HA LEU 146 9.460 10.527 -2.528 1173 HB2 LEU 146 HB2 LEU 146 6.545 9.675 -2.486 1174 HB3 LEU 146 HB3 LEU 146 7.278 10.694 -3.731 1175 HG LEU 146 HG LEU 146 7.117 8.492 -4.607 1176 HD11 LEU 146 HD11 LEU 146 9.472 7.892 -5.056 1177 HD12 LEU 146 HD12 LEU 146 9.182 9.660 -5.182 1178 HD13 LEU 146 HD13 LEU 146 9.994 8.984 -3.730 1179 HD21 LEU 146 HD21 LEU 146 8.131 6.507 -3.541 1180 HD22 LEU 146 HD22 LEU 146 8.567 7.507 -2.114 1181 HD23 LEU 146 HD23 LEU 146 6.840 7.241 -2.530 1182 HA PRO 147 HA PRO 147 8.329 14.159 -0.145 1183 HB2 PRO 147 HB2 PRO 147 9.845 15.917 -1.681 1184 HB3 PRO 147 HB3 PRO 147 10.626 14.858 -0.500 1185 HG2 PRO 147 HG2 PRO 147 10.344 14.497 -3.496 1186 HG3 PRO 147 HG3 PRO 147 11.760 14.229 -2.472 1187 HD2 PRO 147 HD2 PRO 147 10.182 12.160 -3.306 1188 HD3 PRO 147 HD3 PRO 147 11.003 12.123 -1.740 1189 H ARG 148 H ARG 148 7.995 16.654 -1.310 1190 HA ARG 148 HA ARG 148 5.472 16.382 -2.404 1191 HB2 ARG 148 HB2 ARG 148 5.362 18.720 -2.509 1192 HB3 ARG 148 HB3 ARG 148 6.369 18.344 -1.105 1193 HG2 ARG 148 HG2 ARG 148 7.480 19.130 -3.842 1194 HG3 ARG 148 HG3 ARG 148 7.184 20.273 -2.525 1195 HD2 ARG 148 HD2 ARG 148 8.962 17.809 -2.205 1196 HD3 ARG 148 HD3 ARG 148 9.582 19.367 -2.763 1197 HE ARG 148 HE ARG 148 8.101 19.360 -0.200 1198 HH11 ARG 148 HH11 ARG 148 11.199 19.440 -1.867 1199 HH12 ARG 148 HH12 ARG 148 12.065 20.019 -0.483 1200 HH21 ARG 148 HH21 ARG 148 9.253 20.126 1.601 1201 HH22 ARG 148 HH22 ARG 148 10.958 20.409 1.488 1202 H GLN 149 H GLN 149 6.414 14.730 -4.097 1203 HA GLN 149 HA GLN 149 6.858 16.096 -6.607 1204 HB2 GLN 149 HB2 GLN 149 8.683 14.673 -5.760 1205 HB3 GLN 149 HB3 GLN 149 7.632 13.283 -6.060 1206 HG2 GLN 149 HG2 GLN 149 7.395 14.206 -8.475 1207 HG3 GLN 149 HG3 GLN 149 8.757 15.261 -8.076 1208 HE21 GLN 149 HE21 GLN 149 10.065 13.266 -6.290 1209 HE22 GLN 149 HE22 GLN 149 10.749 12.069 -7.338 1210 H GLU 150 H GLU 150 4.176 15.656 -5.320 1211 HA GLU 150 HA GLU 150 3.057 13.516 -6.887 1212 HB2 GLU 150 HB2 GLU 150 0.973 14.121 -5.769 1213 HB3 GLU 150 HB3 GLU 150 2.288 13.989 -4.594 1214 HG2 GLU 150 HG2 GLU 150 1.211 15.903 -3.863 1215 HG3 GLU 150 HG3 GLU 150 2.491 16.591 -4.872 1216 H GLU 151 H GLU 151 1.357 13.662 -8.429 1217 HA GLU 151 HA GLU 151 0.675 16.177 -9.586 1218 HB2 GLU 151 HB2 GLU 151 3.112 15.485 -10.409 1219 HB3 GLU 151 HB3 GLU 151 2.254 14.278 -11.376 1220 HG2 GLU 151 HG2 GLU 151 0.958 16.063 -12.495 1221 HG3 GLU 151 HG3 GLU 151 1.751 17.287 -11.496 1222 H CYS 152 H CYS 152 1.050 12.562 -10.172 1223 HA CYS 152 HA CYS 152 -1.519 12.692 -11.656 1224 HB2 CYS 152 HB2 CYS 152 0.311 11.372 -12.726 1225 HB3 CYS 152 HB3 CYS 152 0.646 10.517 -11.215 1226 H THR 153 H THR 153 -3.348 11.832 -10.603 1227 HA THR 153 HA THR 153 -2.975 10.355 -8.105 1228 HB THR 153 HB THR 153 -5.329 11.986 -7.876 1229 HG1 THR 153 HG1 THR 153 -4.303 14.117 -7.934 1230 HG21 THR 153 HG21 THR 153 -4.136 12.892 -5.893 1231 HG22 THR 153 HG22 THR 153 -3.971 11.108 -6.010 1232 HG23 THR 153 HG23 THR 153 -2.605 12.170 -6.492 1233 H VAL 154 H VAL 154 -4.937 9.085 -7.461 1234 HA VAL 154 HA VAL 154 -6.386 8.239 -9.859 1235 HB VAL 154 HB VAL 154 -5.149 6.524 -8.570 1236 HG11 VAL 154 HG11 VAL 154 -5.940 5.836 -6.330 1237 HG12 VAL 154 HG12 VAL 154 -5.285 7.508 -6.335 1238 HG13 VAL 154 HG13 VAL 154 -7.061 7.240 -6.303 1239 HG21 VAL 154 HG21 VAL 154 -7.007 4.905 -8.341 1240 HG22 VAL 154 HG22 VAL 154 -8.185 6.258 -8.430 1241 HG23 VAL 154 HG23 VAL 154 -7.141 5.883 -9.842 1242 H ASP 155 H ASP 155 -8.665 8.346 -9.971 1243 HA ASP 155 HA ASP 155 -9.908 10.241 -8.266 1244 HB2 ASP 155 HB2 ASP 155 -10.529 10.126 -10.602 1245 HB3 ASP 155 HB3 ASP 155 -10.950 8.413 -10.472 1246 H GLU 156 H GLU 156 -11.958 9.894 -7.046 1247 HA GLU 156 HA GLU 156 -11.872 7.272 -5.726 1248 HB2 GLU 156 HB2 GLU 156 -12.872 8.423 -3.789 1249 HB3 GLU 156 HB3 GLU 156 -11.298 9.096 -4.232 1250 HG2 GLU 156 HG2 GLU 156 -12.589 10.924 -5.510 1251 HG3 GLU 156 HG3 GLU 156 -14.049 10.315 -4.718 1252 H VAL 157 H VAL 157 -14.099 9.726 -7.228 1253 HA VAL 157 HA VAL 157 -15.916 7.617 -7.802 1254 HB VAL 157 HB VAL 157 -16.601 7.920 -5.499 1255 HG11 VAL 157 HG11 VAL 157 -17.453 10.078 -4.641 1256 HG12 VAL 157 HG12 VAL 157 -15.713 10.158 -5.081 1257 HG13 VAL 157 HG13 VAL 157 -16.949 10.875 -6.169 1258 HG21 VAL 157 HG21 VAL 157 -18.972 8.554 -5.821 1259 HG22 VAL 157 HG22 VAL 157 -18.557 9.256 -7.422 1260 HG23 VAL 157 HG23 VAL 157 -18.367 7.493 -7.138 1261 HN1 EB4 158 HN1 EB4 158 3.500 -6.094 -7.023 1262 H8 EB4 158 H8 EB4 158 -2.442 -6.784 -4.308 1263 HN2 EB4 158 HN2 EB4 158 0.981 -4.983 -8.446 1264 H9 EB4 158 H9 EB4 158 0.279 -0.661 -2.946 1265 H10 EB4 158 H10 EB4 158 4.522 -7.637 -1.439 1266 HN3 EB4 158 HN3 EB4 158 3.404 -2.885 -7.258 1267 H7 EB4 158 H7 EB4 158 2.863 -5.791 -1.311 1268 H11 EB4 158 H11 EB4 158 -3.889 -7.270 -6.250 1269 H12 EB4 158 H12 EB4 158 1.727 1.269 -3.442 1270 H15 EB4 158 H15 EB4 158 3.528 1.084 -5.148 1271 H14 EB4 158 H14 EB4 158 -3.096 -6.742 -8.543 1272 H13 EB4 158 H13 EB4 158 5.380 -8.350 -3.644 1273 H22 EB4 158 H22 EB4 158 4.364 -6.829 -7.472 1274 H30 EB4 158 H30 EB4 158 5.999 -3.414 -9.847 1275 H30A EB4 158 H30A EB4 158 6.278 -3.009 -8.080 1276 H24 EB4 158 H24 EB4 158 3.982 -2.087 -8.000 1277 H28 EB4 158 H28 EB4 158 3.329 -8.443 -9.141 1278 H28A EB4 158 H28A EB4 158 4.179 -7.484 -10.451 1279 H23 EB4 158 H23 EB4 158 0.664 -5.153 -9.630 1280 H29 EB4 158 H29 EB4 158 0.518 -3.008 -10.656 1281 H29A EB4 158 H29A EB4 158 1.951 -3.490 -11.753 Start of MODEL 2 1 H1 MET 1 H1 MET 1 -29.553 4.681 -4.347 2 H2 MET 1 H2 MET 1 -28.876 6.101 -3.912 3 H3 MET 1 H3 MET 1 -29.323 5.851 -5.462 4 HA MET 1 HA MET 1 -27.481 3.930 -4.384 5 HB2 MET 1 HB2 MET 1 -27.369 5.513 -6.987 6 HB3 MET 1 HB3 MET 1 -26.512 4.017 -6.594 7 HG2 MET 1 HG2 MET 1 -28.751 2.850 -6.424 8 HG3 MET 1 HG3 MET 1 -29.523 4.342 -6.976 9 HE1 MET 1 HE1 MET 1 -29.962 2.745 -10.383 10 HE2 MET 1 HE2 MET 1 -30.469 2.265 -8.728 11 HE3 MET 1 HE3 MET 1 -30.533 3.991 -9.222 12 H THR 2 H THR 2 -25.013 4.471 -4.686 13 HA THR 2 HA THR 2 -23.283 5.630 -3.904 14 HB THR 2 HB THR 2 -24.594 8.114 -5.095 15 HG1 THR 2 HG1 THR 2 -23.692 7.336 -7.144 16 HG21 THR 2 HG21 THR 2 -22.254 8.638 -5.714 17 HG22 THR 2 HG22 THR 2 -22.427 8.393 -3.943 18 HG23 THR 2 HG23 THR 2 -21.712 7.099 -4.964 19 H VAL 3 H VAL 3 -25.235 5.234 -1.898 20 HA VAL 3 HA VAL 3 -25.702 7.782 -0.625 21 HB VAL 3 HB VAL 3 -26.698 6.327 1.198 22 HG11 VAL 3 HG11 VAL 3 -28.701 5.733 -0.133 23 HG12 VAL 3 HG12 VAL 3 -28.071 7.361 -0.556 24 HG13 VAL 3 HG13 VAL 3 -27.757 5.967 -1.643 25 HG21 VAL 3 HG21 VAL 3 -27.175 3.966 0.648 26 HG22 VAL 3 HG22 VAL 3 -26.165 4.111 -0.830 27 HG23 VAL 3 HG23 VAL 3 -25.413 4.282 0.792 28 HA PRO 4 HA PRO 4 -21.895 7.513 1.720 29 HB2 PRO 4 HB2 PRO 4 -22.426 9.591 3.484 30 HB3 PRO 4 HB3 PRO 4 -22.092 9.937 1.783 31 HG2 PRO 4 HG2 PRO 4 -24.761 9.741 3.204 32 HG3 PRO 4 HG3 PRO 4 -24.213 10.941 2.027 33 HD2 PRO 4 HD2 PRO 4 -25.825 8.834 1.323 34 HD3 PRO 4 HD3 PRO 4 -24.669 9.550 0.193 35 H ASP 5 H ASP 5 -23.451 5.374 2.365 36 HA ASP 5 HA ASP 5 -23.933 5.535 5.243 37 HB2 ASP 5 HB2 ASP 5 -24.496 3.489 3.064 38 HB3 ASP 5 HB3 ASP 5 -24.584 3.048 4.774 39 H ARG 6 H ARG 6 -22.488 2.851 3.279 40 HA ARG 6 HA ARG 6 -20.602 2.331 5.359 41 HB2 ARG 6 HB2 ARG 6 -21.329 1.004 2.772 42 HB3 ARG 6 HB3 ARG 6 -19.797 0.613 3.566 43 HG2 ARG 6 HG2 ARG 6 -21.402 -0.996 4.331 44 HG3 ARG 6 HG3 ARG 6 -21.101 0.101 5.685 45 HD2 ARG 6 HD2 ARG 6 -23.451 -0.109 5.667 46 HD3 ARG 6 HD3 ARG 6 -23.171 1.436 4.853 47 HE ARG 6 HE ARG 6 -23.249 -0.590 2.862 48 HH11 ARG 6 HH11 ARG 6 -25.381 0.990 5.168 49 HH12 ARG 6 HH12 ARG 6 -26.808 0.711 4.227 50 HH21 ARG 6 HH21 ARG 6 -25.136 -0.964 1.644 51 HH22 ARG 6 HH22 ARG 6 -26.668 -0.400 2.222 52 H SER 7 H SER 7 -20.637 4.414 2.574 53 HA SER 7 HA SER 7 -18.116 4.233 1.543 54 HB2 SER 7 HB2 SER 7 -19.161 7.002 2.150 55 HB3 SER 7 HB3 SER 7 -18.652 6.315 0.602 56 HG SER 7 HG SER 7 -20.776 6.239 0.256 57 H GLU 8 H GLU 8 -19.072 5.765 4.693 58 HA GLU 8 HA GLU 8 -16.701 7.148 5.151 59 HB2 GLU 8 HB2 GLU 8 -18.563 5.839 7.176 60 HB3 GLU 8 HB3 GLU 8 -17.352 7.080 7.525 61 HG2 GLU 8 HG2 GLU 8 -18.605 8.564 5.814 62 HG3 GLU 8 HG3 GLU 8 -19.900 7.361 5.880 63 H ILE 9 H ILE 9 -17.362 3.659 5.250 64 HA ILE 9 HA ILE 9 -15.095 3.116 6.920 65 HB ILE 9 HB ILE 9 -16.711 1.146 5.235 66 HG12 ILE 9 HG12 ILE 9 -17.236 2.059 8.106 67 HG13 ILE 9 HG13 ILE 9 -18.155 2.618 6.702 68 HG21 ILE 9 HG21 ILE 9 -16.014 -0.457 6.985 69 HG22 ILE 9 HG22 ILE 9 -14.602 0.283 6.158 70 HG23 ILE 9 HG23 ILE 9 -15.077 0.842 7.797 71 HD11 ILE 9 HD11 ILE 9 -19.346 0.821 7.880 72 HD12 ILE 9 HD12 ILE 9 -18.874 0.292 6.229 73 HD13 ILE 9 HD13 ILE 9 -17.941 -0.275 7.655 74 H ALA 10 H ALA 10 -15.332 4.064 3.647 75 HA ALA 10 HA ALA 10 -12.762 2.745 3.089 76 HB1 ALA 10 HB1 ALA 10 -13.534 2.349 0.763 77 HB2 ALA 10 HB2 ALA 10 -14.519 1.437 1.956 78 HB3 ALA 10 HB3 ALA 10 -15.171 2.936 1.213 79 H GLY 11 H GLY 11 -12.147 3.836 0.628 80 HA2 GLY 11 HA2 GLY 11 -12.781 6.325 -0.087 81 HA3 GLY 11 HA3 GLY 11 -11.825 6.626 1.370 82 H LYS 12 H LYS 12 -10.176 7.702 0.104 83 HA LYS 12 HA LYS 12 -8.572 5.865 -1.557 84 HB2 LYS 12 HB2 LYS 12 -7.759 7.925 -2.674 85 HB3 LYS 12 HB3 LYS 12 -9.496 7.667 -2.887 86 HG2 LYS 12 HG2 LYS 12 -9.940 9.320 -1.047 87 HG3 LYS 12 HG3 LYS 12 -8.201 9.609 -0.911 88 HD2 LYS 12 HD2 LYS 12 -8.093 10.436 -3.219 89 HD3 LYS 12 HD3 LYS 12 -9.778 9.983 -3.508 90 HE2 LYS 12 HE2 LYS 12 -9.780 12.345 -3.083 91 HE3 LYS 12 HE3 LYS 12 -10.453 11.579 -1.638 92 HZ1 LYS 12 HZ1 LYS 12 -8.807 13.286 -1.148 93 HZ2 LYS 12 HZ2 LYS 12 -8.348 11.835 -0.558 94 HZ3 LYS 12 HZ3 LYS 12 -7.642 12.429 -1.905 95 H TRP 13 H TRP 13 -6.307 5.742 -1.170 96 HA TRP 13 HA TRP 13 -5.351 7.340 1.116 97 HB2 TRP 13 HB2 TRP 13 -4.668 4.417 0.564 98 HB3 TRP 13 HB3 TRP 13 -4.139 5.398 1.937 99 HD1 TRP 13 HD1 TRP 13 -6.559 2.792 1.198 100 HE1 TRP 13 HE1 TRP 13 -8.515 2.771 2.891 101 HE3 TRP 13 HE3 TRP 13 -5.859 7.433 3.286 102 HZ2 TRP 13 HZ2 TRP 13 -9.620 4.477 4.838 103 HZ3 TRP 13 HZ3 TRP 13 -7.416 8.176 5.071 104 HH2 TRP 13 HH2 TRP 13 -9.268 6.717 5.836 105 H TYR 14 H TYR 14 -3.176 8.105 0.894 106 HA TYR 14 HA TYR 14 -2.016 7.595 -1.776 107 HB2 TYR 14 HB2 TYR 14 -1.483 9.877 0.187 108 HB3 TYR 14 HB3 TYR 14 -0.884 9.740 -1.471 109 HD1 TYR 14 HD1 TYR 14 -4.077 9.967 0.507 110 HD2 TYR 14 HD2 TYR 14 -2.133 10.654 -3.261 111 HE1 TYR 14 HE1 TYR 14 -6.092 11.145 -0.314 112 HE2 TYR 14 HE2 TYR 14 -4.149 11.834 -4.086 113 HH TYR 14 HH TYR 14 -6.439 12.092 -3.689 114 H VAL 15 H VAL 15 -0.260 6.129 -1.803 115 HA VAL 15 HA VAL 15 1.033 5.665 0.804 116 HB VAL 15 HB VAL 15 0.411 3.814 -0.734 117 HG11 VAL 15 HG11 VAL 15 1.684 3.369 -2.828 118 HG12 VAL 15 HG12 VAL 15 0.664 4.845 -2.923 119 HG13 VAL 15 HG13 VAL 15 2.438 4.993 -2.688 120 HG21 VAL 15 HG21 VAL 15 2.582 2.607 -0.737 121 HG22 VAL 15 HG22 VAL 15 3.415 4.156 -0.377 122 HG23 VAL 15 HG23 VAL 15 2.255 3.465 0.807 123 H VAL 16 H VAL 16 2.489 7.060 1.432 124 HA VAL 16 HA VAL 16 4.139 8.455 -0.552 125 HB VAL 16 HB VAL 16 4.559 10.091 1.215 126 HG11 VAL 16 HG11 VAL 16 2.331 11.095 1.449 127 HG12 VAL 16 HG12 VAL 16 2.644 10.494 -0.215 128 HG13 VAL 16 HG13 VAL 16 1.605 9.546 0.902 129 HG21 VAL 16 HG21 VAL 16 3.380 10.024 3.383 130 HG22 VAL 16 HG22 VAL 16 2.731 8.407 2.947 131 HG23 VAL 16 HG23 VAL 16 4.498 8.634 3.171 132 H ALA 17 H ALA 17 4.250 5.680 1.256 133 HA ALA 17 HA ALA 17 7.152 5.870 1.499 134 HB1 ALA 17 HB1 ALA 17 7.078 4.849 3.750 135 HB2 ALA 17 HB2 ALA 17 6.327 6.481 3.726 136 HB3 ALA 17 HB3 ALA 17 5.289 5.015 3.759 137 H LEU 18 H LEU 18 8.192 3.746 1.513 138 HA LEU 18 HA LEU 18 6.512 1.436 1.150 139 HB2 LEU 18 HB2 LEU 18 8.135 2.662 -1.114 140 HB3 LEU 18 HB3 LEU 18 7.694 0.950 -1.081 141 HG LEU 18 HG LEU 18 5.674 3.234 -1.006 142 HD11 LEU 18 HD11 LEU 18 5.259 2.684 -3.386 143 HD12 LEU 18 HD12 LEU 18 6.938 3.262 -3.116 144 HD13 LEU 18 HD13 LEU 18 6.618 1.510 -3.346 145 HD21 LEU 18 HD21 LEU 18 4.060 1.461 -1.612 146 HD22 LEU 18 HD22 LEU 18 5.370 0.238 -1.506 147 HD23 LEU 18 HD23 LEU 18 4.856 1.132 -0.036 148 H ALA 19 H ALA 19 7.735 -0.590 1.240 149 HA ALA 19 HA ALA 19 10.651 -0.290 1.675 150 HB1 ALA 19 HB1 ALA 19 10.454 -1.768 3.640 151 HB2 ALA 19 HB2 ALA 19 9.548 -0.240 3.904 152 HB3 ALA 19 HB3 ALA 19 8.665 -1.749 3.493 153 H SER 20 H SER 20 11.719 -1.923 0.520 154 HA SER 20 HA SER 20 10.071 -4.251 -0.264 155 HB2 SER 20 HB2 SER 20 12.106 -2.826 -2.074 156 HB3 SER 20 HB3 SER 20 10.987 -4.119 -2.524 157 HG SER 20 HG SER 20 10.323 -1.893 -3.143 158 H ASN 21 H ASN 21 11.160 -6.233 -0.385 159 HA ASN 21 HA ASN 21 13.734 -6.228 1.012 160 HB2 ASN 21 HB2 ASN 21 11.565 -7.675 1.555 161 HB3 ASN 21 HB3 ASN 21 12.134 -8.687 0.221 162 HD21 ASN 21 HD21 ASN 21 15.018 -8.333 0.750 163 HD22 ASN 21 HD22 ASN 21 15.357 -9.231 2.192 164 H THR 22 H THR 22 12.367 -6.609 -2.254 165 HA THR 22 HA THR 22 14.670 -8.198 -3.093 166 HB THR 22 HB THR 22 13.284 -7.427 -5.378 167 HG1 THR 22 HG1 THR 22 11.309 -6.746 -4.822 168 HG21 THR 22 HG21 THR 22 12.164 -9.640 -5.214 169 HG22 THR 22 HG22 THR 22 13.882 -9.740 -4.702 170 HG23 THR 22 HG23 THR 22 12.577 -9.719 -3.468 171 H GLU 23 H GLU 23 16.478 -7.413 -4.071 172 HA GLU 23 HA GLU 23 17.283 -4.813 -3.854 173 HB2 GLU 23 HB2 GLU 23 18.092 -6.602 -6.187 174 HB3 GLU 23 HB3 GLU 23 19.081 -5.420 -5.322 175 HG2 GLU 23 HG2 GLU 23 18.016 -7.915 -3.949 176 HG3 GLU 23 HG3 GLU 23 19.503 -7.942 -4.906 177 H PHE 24 H PHE 24 15.921 -6.426 -6.840 178 HA PHE 24 HA PHE 24 16.067 -4.252 -8.518 179 HB2 PHE 24 HB2 PHE 24 13.982 -6.483 -8.360 180 HB3 PHE 24 HB3 PHE 24 14.132 -5.362 -9.719 181 HD1 PHE 24 HD1 PHE 24 16.269 -5.345 -11.074 182 HD2 PHE 24 HD2 PHE 24 15.409 -8.370 -8.151 183 HE1 PHE 24 HE1 PHE 24 17.966 -6.820 -12.107 184 HE2 PHE 24 HE2 PHE 24 17.107 -9.849 -9.179 185 HZ PHE 24 HZ PHE 24 18.391 -9.078 -11.159 186 H PHE 25 H PHE 25 13.261 -5.188 -6.353 187 HA PHE 25 HA PHE 25 11.547 -3.175 -7.128 188 HB2 PHE 25 HB2 PHE 25 11.985 -4.665 -4.519 189 HB3 PHE 25 HB3 PHE 25 10.759 -3.396 -4.640 190 HD1 PHE 25 HD1 PHE 25 11.859 -6.147 -6.978 191 HD2 PHE 25 HD2 PHE 25 8.653 -4.321 -4.782 192 HE1 PHE 25 HE1 PHE 25 10.268 -7.772 -7.955 193 HE2 PHE 25 HE2 PHE 25 7.058 -5.944 -5.757 194 HZ PHE 25 HZ PHE 25 7.862 -7.673 -7.349 195 H LEU 26 H LEU 26 14.081 -3.055 -4.494 196 HA LEU 26 HA LEU 26 13.508 -0.439 -3.670 197 HB2 LEU 26 HB2 LEU 26 16.186 -1.903 -3.742 198 HB3 LEU 26 HB3 LEU 26 15.793 -0.491 -2.752 199 HG LEU 26 HG LEU 26 14.549 -3.263 -2.502 200 HD11 LEU 26 HD11 LEU 26 15.742 -3.329 -0.341 201 HD12 LEU 26 HD12 LEU 26 16.873 -3.176 -1.728 202 HD13 LEU 26 HD13 LEU 26 16.497 -1.743 -0.713 203 HD21 LEU 26 HD21 LEU 26 13.476 -2.361 -0.466 204 HD22 LEU 26 HD22 LEU 26 14.131 -0.733 -0.848 205 HD23 LEU 26 HD23 LEU 26 12.936 -1.500 -1.947 206 H ARG 27 H ARG 27 15.807 -1.748 -6.171 207 HA ARG 27 HA ARG 27 17.002 0.667 -6.849 208 HB2 ARG 27 HB2 ARG 27 17.565 -1.774 -7.542 209 HB3 ARG 27 HB3 ARG 27 16.349 -1.572 -8.810 210 HG2 ARG 27 HG2 ARG 27 17.703 0.606 -9.426 211 HG3 ARG 27 HG3 ARG 27 18.998 -0.127 -8.470 212 HD2 ARG 27 HD2 ARG 27 19.474 -0.940 -10.612 213 HD3 ARG 27 HD3 ARG 27 18.548 -2.278 -9.920 214 HE ARG 27 HE ARG 27 16.551 -0.973 -11.100 215 HH11 ARG 27 HH11 ARG 27 19.797 -1.537 -12.335 216 HH12 ARG 27 HH12 ARG 27 19.296 -1.507 -13.992 217 HH21 ARG 27 HH21 ARG 27 15.917 -0.929 -13.256 218 HH22 ARG 27 HH22 ARG 27 17.082 -1.160 -14.517 219 H GLU 28 H GLU 28 14.041 -0.976 -8.239 220 HA GLU 28 HA GLU 28 13.589 1.101 -10.116 221 HB2 GLU 28 HB2 GLU 28 11.763 -1.085 -8.999 222 HB3 GLU 28 HB3 GLU 28 11.357 -0.037 -10.365 223 HG2 GLU 28 HG2 GLU 28 13.589 -2.109 -10.217 224 HG3 GLU 28 HG3 GLU 28 12.132 -2.164 -11.219 225 H LYS 29 H LYS 29 11.860 0.234 -6.982 226 HA LYS 29 HA LYS 29 10.110 2.371 -7.136 227 HB2 LYS 29 HB2 LYS 29 11.073 0.526 -4.986 228 HB3 LYS 29 HB3 LYS 29 10.302 2.025 -4.452 229 HG2 LYS 29 HG2 LYS 29 9.038 0.071 -6.437 230 HG3 LYS 29 HG3 LYS 29 8.743 0.039 -4.694 231 HD2 LYS 29 HD2 LYS 29 6.947 1.341 -5.428 232 HD3 LYS 29 HD3 LYS 29 8.120 2.593 -5.000 233 HE2 LYS 29 HE2 LYS 29 7.565 3.362 -7.101 234 HE3 LYS 29 HE3 LYS 29 8.873 2.268 -7.568 235 HZ1 LYS 29 HZ1 LYS 29 6.625 2.108 -8.747 236 HZ2 LYS 29 HZ2 LYS 29 7.373 0.718 -8.330 237 HZ3 LYS 29 HZ3 LYS 29 6.122 1.270 -7.439 238 H ASP 30 H ASP 30 13.380 2.276 -5.484 239 HA ASP 30 HA ASP 30 13.202 4.778 -4.308 240 HB2 ASP 30 HB2 ASP 30 15.029 3.191 -3.860 241 HB3 ASP 30 HB3 ASP 30 15.601 3.316 -5.529 242 H LYS 31 H LYS 31 13.979 3.857 -7.733 243 HA LYS 31 HA LYS 31 14.621 6.598 -8.322 244 HB2 LYS 31 HB2 LYS 31 14.874 3.970 -9.669 245 HB3 LYS 31 HB3 LYS 31 14.415 5.289 -10.754 246 HG2 LYS 31 HG2 LYS 31 16.850 5.248 -8.900 247 HG3 LYS 31 HG3 LYS 31 16.870 5.020 -10.653 248 HD2 LYS 31 HD2 LYS 31 17.478 7.316 -10.257 249 HD3 LYS 31 HD3 LYS 31 15.829 7.338 -10.895 250 HE2 LYS 31 HE2 LYS 31 15.650 7.080 -8.023 251 HE3 LYS 31 HE3 LYS 31 16.811 8.367 -8.373 252 HZ1 LYS 31 HZ1 LYS 31 14.464 9.079 -8.241 253 HZ2 LYS 31 HZ2 LYS 31 15.184 9.490 -9.648 254 HZ3 LYS 31 HZ3 LYS 31 14.135 8.239 -9.602 255 H MET 32 H MET 32 11.500 4.716 -8.164 256 HA MET 32 HA MET 32 10.727 6.409 -10.455 257 HB2 MET 32 HB2 MET 32 9.357 4.441 -8.320 258 HB3 MET 32 HB3 MET 32 8.405 5.112 -9.652 259 HG2 MET 32 HG2 MET 32 10.888 3.452 -10.248 260 HG3 MET 32 HG3 MET 32 9.371 2.652 -9.814 261 HE1 MET 32 HE1 MET 32 9.903 2.482 -13.843 262 HE2 MET 32 HE2 MET 32 11.231 2.696 -12.653 263 HE3 MET 32 HE3 MET 32 9.921 1.509 -12.334 264 H LYS 33 H LYS 33 7.875 6.230 -8.480 265 HA LYS 33 HA LYS 33 8.507 8.794 -7.148 266 HB2 LYS 33 HB2 LYS 33 6.235 8.577 -9.216 267 HB3 LYS 33 HB3 LYS 33 6.467 9.932 -8.103 268 HG2 LYS 33 HG2 LYS 33 8.659 10.434 -9.185 269 HG3 LYS 33 HG3 LYS 33 8.408 9.089 -10.306 270 HD2 LYS 33 HD2 LYS 33 6.316 10.171 -11.146 271 HD3 LYS 33 HD3 LYS 33 6.549 11.510 -10.014 272 HE2 LYS 33 HE2 LYS 33 8.760 12.020 -11.097 273 HE3 LYS 33 HE3 LYS 33 8.488 10.704 -12.247 274 HZ1 LYS 33 HZ1 LYS 33 7.833 12.820 -13.154 275 HZ2 LYS 33 HZ2 LYS 33 6.516 11.867 -13.007 276 HZ3 LYS 33 HZ3 LYS 33 6.767 13.082 -11.945 277 H MET 34 H MET 34 6.040 9.503 -6.156 278 HA MET 34 HA MET 34 5.514 7.336 -4.353 279 HB2 MET 34 HB2 MET 34 5.457 9.690 -3.643 280 HB3 MET 34 HB3 MET 34 4.230 10.071 -4.859 281 HG2 MET 34 HG2 MET 34 2.640 8.510 -3.680 282 HG3 MET 34 HG3 MET 34 3.865 8.256 -2.430 283 HE1 MET 34 HE1 MET 34 1.868 12.376 -3.287 284 HE2 MET 34 HE2 MET 34 3.046 11.603 -4.401 285 HE3 MET 34 HE3 MET 34 1.432 10.858 -4.142 286 H ALA 35 H ALA 35 3.500 6.232 -4.081 287 HA ALA 35 HA ALA 35 1.878 6.042 -6.497 288 HB1 ALA 35 HB1 ALA 35 1.413 3.729 -5.860 289 HB2 ALA 35 HB2 ALA 35 3.148 4.045 -6.198 290 HB3 ALA 35 HB3 ALA 35 2.577 3.888 -4.502 291 H MET 36 H MET 36 -0.319 4.843 -5.865 292 HA MET 36 HA MET 36 -1.430 6.084 -3.498 293 HB2 MET 36 HB2 MET 36 -2.579 6.361 -6.271 294 HB3 MET 36 HB3 MET 36 -3.433 6.755 -4.773 295 HG2 MET 36 HG2 MET 36 -1.538 8.369 -4.232 296 HG3 MET 36 HG3 MET 36 -0.915 8.075 -5.861 297 HE1 MET 36 HE1 MET 36 -2.326 11.479 -6.698 298 HE2 MET 36 HE2 MET 36 -1.849 11.211 -4.988 299 HE3 MET 36 HE3 MET 36 -0.907 10.448 -6.313 300 H ALA 37 H ALA 37 -3.885 5.329 -3.256 301 HA ALA 37 HA ALA 37 -4.485 2.791 -4.424 302 HB1 ALA 37 HB1 ALA 37 -4.379 1.487 -2.343 303 HB2 ALA 37 HB2 ALA 37 -2.758 2.044 -2.880 304 HB3 ALA 37 HB3 ALA 37 -3.588 2.874 -1.521 305 H ARG 38 H ARG 38 -6.699 2.538 -4.437 306 HA ARG 38 HA ARG 38 -8.251 3.994 -2.355 307 HB2 ARG 38 HB2 ARG 38 -8.588 5.223 -4.341 308 HB3 ARG 38 HB3 ARG 38 -8.632 3.772 -5.350 309 HG2 ARG 38 HG2 ARG 38 -10.740 3.984 -3.221 310 HG3 ARG 38 HG3 ARG 38 -10.851 5.128 -4.565 311 HD2 ARG 38 HD2 ARG 38 -10.580 3.112 -6.148 312 HD3 ARG 38 HD3 ARG 38 -10.776 2.074 -4.729 313 HE ARG 38 HE ARG 38 -13.045 2.468 -4.831 314 HH11 ARG 38 HH11 ARG 38 -11.417 5.101 -6.517 315 HH12 ARG 38 HH12 ARG 38 -12.896 5.851 -7.018 316 HH21 ARG 38 HH21 ARG 38 -14.968 3.476 -5.496 317 HH22 ARG 38 HH22 ARG 38 -14.909 4.928 -6.438 318 H ILE 39 H ILE 39 -9.537 2.528 -1.188 319 HA ILE 39 HA ILE 39 -9.731 -0.146 -2.340 320 HB ILE 39 HB ILE 39 -10.153 0.523 0.594 321 HG12 ILE 39 HG12 ILE 39 -7.989 1.442 0.137 322 HG13 ILE 39 HG13 ILE 39 -7.793 -0.076 1.024 323 HG21 ILE 39 HG21 ILE 39 -9.464 -1.844 0.897 324 HG22 ILE 39 HG22 ILE 39 -10.891 -1.688 -0.181 325 HG23 ILE 39 HG23 ILE 39 -9.268 -2.004 -0.881 326 HD11 ILE 39 HD11 ILE 39 -6.121 0.129 -0.757 327 HD12 ILE 39 HD12 ILE 39 -7.225 -1.250 -1.082 328 HD13 ILE 39 HD13 ILE 39 -7.423 0.291 -1.982 329 H SER 40 H SER 40 -11.776 -1.289 -2.244 330 HA SER 40 HA SER 40 -14.058 0.249 -1.224 331 HB2 SER 40 HB2 SER 40 -13.890 -0.947 -4.027 332 HB3 SER 40 HB3 SER 40 -15.306 -0.178 -3.298 333 HG SER 40 HG SER 40 -14.501 1.652 -4.062 334 H PHE 41 H PHE 41 -15.503 -0.999 -0.094 335 HA PHE 41 HA PHE 41 -14.826 -3.731 0.352 336 HB2 PHE 41 HB2 PHE 41 -17.005 -3.688 1.677 337 HB3 PHE 41 HB3 PHE 41 -15.743 -2.562 2.194 338 HD1 PHE 41 HD1 PHE 41 -19.071 -2.873 0.631 339 HD2 PHE 41 HD2 PHE 41 -16.024 -0.148 1.943 340 HE1 PHE 41 HE1 PHE 41 -20.683 -1.000 0.478 341 HE2 PHE 41 HE2 PHE 41 -17.632 1.728 1.790 342 HZ PHE 41 HZ PHE 41 -19.965 1.305 1.053 343 H LEU 42 H LEU 42 -15.114 -5.263 -1.196 344 HA LEU 42 HA LEU 42 -17.133 -5.021 -3.188 345 HB2 LEU 42 HB2 LEU 42 -14.802 -6.231 -3.214 346 HB3 LEU 42 HB3 LEU 42 -15.667 -7.573 -2.454 347 HG LEU 42 HG LEU 42 -15.463 -7.904 -4.862 348 HD11 LEU 42 HD11 LEU 42 -17.838 -8.299 -5.416 349 HD12 LEU 42 HD12 LEU 42 -17.439 -8.818 -3.743 350 HD13 LEU 42 HD13 LEU 42 -18.327 -7.281 -4.019 351 HD21 LEU 42 HD21 LEU 42 -16.642 -6.425 -6.461 352 HD22 LEU 42 HD22 LEU 42 -17.067 -5.318 -5.112 353 HD23 LEU 42 HD23 LEU 42 -15.347 -5.557 -5.569 354 H GLY 43 H GLY 43 -16.763 -7.000 -0.155 355 HA2 GLY 43 HA2 GLY 43 -19.622 -7.236 0.031 356 HA3 GLY 43 HA3 GLY 43 -18.827 -8.744 -0.441 357 H GLU 44 H GLU 44 -20.134 -8.848 1.957 358 HA GLU 44 HA GLU 44 -18.895 -7.938 4.214 359 HB2 GLU 44 HB2 GLU 44 -20.237 -10.645 3.734 360 HB3 GLU 44 HB3 GLU 44 -19.886 -9.961 5.327 361 HG2 GLU 44 HG2 GLU 44 -21.326 -7.958 4.686 362 HG3 GLU 44 HG3 GLU 44 -21.788 -8.837 3.223 363 H ASP 45 H ASP 45 -17.766 -10.577 2.042 364 HA ASP 45 HA ASP 45 -15.499 -10.931 3.899 365 HB2 ASP 45 HB2 ASP 45 -17.124 -12.889 3.809 366 HB3 ASP 45 HB3 ASP 45 -16.803 -13.027 2.076 367 H GLU 46 H GLU 46 -16.261 -9.446 1.024 368 HA GLU 46 HA GLU 46 -13.624 -10.164 -0.063 369 HB2 GLU 46 HB2 GLU 46 -15.273 -11.246 -1.474 370 HB3 GLU 46 HB3 GLU 46 -16.224 -9.760 -1.598 371 HG2 GLU 46 HG2 GLU 46 -14.607 -8.687 -2.973 372 HG3 GLU 46 HG3 GLU 46 -13.334 -9.834 -2.534 373 H LEU 47 H LEU 47 -12.543 -8.484 -1.274 374 HA LEU 47 HA LEU 47 -13.581 -5.812 -0.934 375 HB2 LEU 47 HB2 LEU 47 -11.500 -4.987 0.062 376 HB3 LEU 47 HB3 LEU 47 -12.435 -6.049 1.124 377 HG LEU 47 HG LEU 47 -10.155 -7.165 -0.525 378 HD11 LEU 47 HD11 LEU 47 -8.644 -6.723 1.379 379 HD12 LEU 47 HD12 LEU 47 -9.247 -5.202 0.637 380 HD13 LEU 47 HD13 LEU 47 -9.943 -5.782 2.188 381 HD21 LEU 47 HD21 LEU 47 -10.046 -8.756 1.366 382 HD22 LEU 47 HD22 LEU 47 -11.394 -7.885 2.173 383 HD23 LEU 47 HD23 LEU 47 -11.676 -8.728 0.612 384 H LYS 48 H LYS 48 -12.525 -4.227 -2.275 385 HA LYS 48 HA LYS 48 -10.766 -5.352 -4.323 386 HB2 LYS 48 HB2 LYS 48 -13.278 -5.065 -4.934 387 HB3 LYS 48 HB3 LYS 48 -12.859 -3.351 -5.054 388 HG2 LYS 48 HG2 LYS 48 -11.228 -3.767 -6.782 389 HG3 LYS 48 HG3 LYS 48 -11.262 -5.512 -6.501 390 HD2 LYS 48 HD2 LYS 48 -13.640 -3.845 -7.488 391 HD3 LYS 48 HD3 LYS 48 -12.584 -4.814 -8.525 392 HE2 LYS 48 HE2 LYS 48 -13.911 -6.142 -6.144 393 HE3 LYS 48 HE3 LYS 48 -14.887 -5.794 -7.577 394 HZ1 LYS 48 HZ1 LYS 48 -13.950 -7.964 -7.731 395 HZ2 LYS 48 HZ2 LYS 48 -13.240 -7.037 -8.873 396 HZ3 LYS 48 HZ3 LYS 48 -12.427 -7.418 -7.510 397 H VAL 49 H VAL 49 -9.165 -3.873 -5.168 398 HA VAL 49 HA VAL 49 -9.211 -1.247 -3.909 399 HB VAL 49 HB VAL 49 -6.846 -1.385 -3.335 400 HG11 VAL 49 HG11 VAL 49 -6.958 -3.094 -1.551 401 HG12 VAL 49 HG12 VAL 49 -8.482 -2.150 -1.665 402 HG13 VAL 49 HG13 VAL 49 -8.404 -3.814 -2.335 403 HG21 VAL 49 HG21 VAL 49 -5.584 -3.489 -3.576 404 HG22 VAL 49 HG22 VAL 49 -6.980 -4.228 -4.430 405 HG23 VAL 49 HG23 VAL 49 -6.110 -2.840 -5.165 406 H SER 50 H SER 50 -8.229 0.457 -5.150 407 HA SER 50 HA SER 50 -7.542 -0.310 -7.922 408 HB2 SER 50 HB2 SER 50 -9.387 1.226 -7.824 409 HB3 SER 50 HB3 SER 50 -8.596 2.227 -6.600 410 HG SER 50 HG SER 50 -8.376 3.245 -8.618 411 H TYR 51 H TYR 51 -5.358 -0.207 -8.487 412 HA TYR 51 HA TYR 51 -3.515 0.949 -6.502 413 HB2 TYR 51 HB2 TYR 51 -3.617 -1.046 -8.764 414 HB3 TYR 51 HB3 TYR 51 -2.205 0.013 -8.876 415 HD1 TYR 51 HD1 TYR 51 -0.995 0.306 -6.429 416 HD2 TYR 51 HD2 TYR 51 -3.231 -3.101 -7.780 417 HE1 TYR 51 HE1 TYR 51 0.242 -1.132 -4.845 418 HE2 TYR 51 HE2 TYR 51 -1.999 -4.543 -6.187 419 HH TYR 51 HH TYR 51 -0.584 -3.751 -3.657 420 H ALA 52 H ALA 52 -2.453 2.953 -6.978 421 HA ALA 52 HA ALA 52 -2.721 3.940 -9.769 422 HB1 ALA 52 HB1 ALA 52 -2.991 6.208 -8.816 423 HB2 ALA 52 HB2 ALA 52 -4.327 5.126 -8.297 424 HB3 ALA 52 HB3 ALA 52 -2.996 5.519 -7.157 425 H VAL 53 H VAL 53 -0.644 3.879 -10.574 426 HA VAL 53 HA VAL 53 1.412 5.043 -8.880 427 HB VAL 53 HB VAL 53 3.037 3.269 -9.567 428 HG11 VAL 53 HG11 VAL 53 2.251 1.543 -7.980 429 HG12 VAL 53 HG12 VAL 53 2.005 3.206 -7.348 430 HG13 VAL 53 HG13 VAL 53 0.613 2.279 -8.002 431 HG21 VAL 53 HG21 VAL 53 2.183 1.099 -10.393 432 HG22 VAL 53 HG22 VAL 53 0.542 1.811 -10.545 433 HG23 VAL 53 HG23 VAL 53 1.887 2.431 -11.560 434 HA PRO 54 HA PRO 54 2.364 6.892 -12.852 435 HB2 PRO 54 HB2 PRO 54 4.636 8.240 -12.078 436 HB3 PRO 54 HB3 PRO 54 3.065 8.749 -11.445 437 HG2 PRO 54 HG2 PRO 54 5.198 7.051 -10.129 438 HG3 PRO 54 HG3 PRO 54 4.210 8.340 -9.429 439 HD2 PRO 54 HD2 PRO 54 3.652 5.644 -9.098 440 HD3 PRO 54 HD3 PRO 54 2.418 6.907 -9.003 441 H LYS 55 H LYS 55 3.000 5.617 -14.435 442 HA LYS 55 HA LYS 55 5.582 4.271 -14.215 443 HB2 LYS 55 HB2 LYS 55 3.571 2.783 -14.266 444 HB3 LYS 55 HB3 LYS 55 3.172 3.433 -15.862 445 HG2 LYS 55 HG2 LYS 55 5.370 2.596 -16.739 446 HG3 LYS 55 HG3 LYS 55 5.740 1.923 -15.146 447 HD2 LYS 55 HD2 LYS 55 3.686 0.503 -15.260 448 HD3 LYS 55 HD3 LYS 55 3.293 1.188 -16.843 449 HE2 LYS 55 HE2 LYS 55 4.365 -0.950 -17.210 450 HE3 LYS 55 HE3 LYS 55 5.489 0.313 -17.727 451 HZ1 LYS 55 HZ1 LYS 55 6.517 -1.425 -16.376 452 HZ2 LYS 55 HZ2 LYS 55 6.685 0.049 -15.693 453 HZ3 LYS 55 HZ3 LYS 55 5.596 -1.010 -15.093 454 HA PRO 56 HA PRO 56 7.224 6.691 -17.581 455 HB2 PRO 56 HB2 PRO 56 7.772 3.937 -18.841 456 HB3 PRO 56 HB3 PRO 56 8.902 5.284 -18.653 457 HG2 PRO 56 HG2 PRO 56 9.068 3.180 -17.017 458 HG3 PRO 56 HG3 PRO 56 9.308 4.811 -16.378 459 HD2 PRO 56 HD2 PRO 56 6.930 2.977 -16.072 460 HD3 PRO 56 HD3 PRO 56 7.583 4.161 -14.931 461 H ASN 57 H ASN 57 4.927 3.989 -18.177 462 HA ASN 57 HA ASN 57 4.341 4.981 -20.830 463 HB2 ASN 57 HB2 ASN 57 2.780 2.929 -19.178 464 HB3 ASN 57 HB3 ASN 57 2.816 3.100 -20.938 465 HD21 ASN 57 HD21 ASN 57 4.464 2.133 -22.119 466 HD22 ASN 57 HD22 ASN 57 5.669 1.108 -21.413 467 H GLY 58 H GLY 58 3.559 6.131 -17.727 468 HA2 GLY 58 HA2 GLY 58 2.069 8.077 -17.839 469 HA3 GLY 58 HA3 GLY 58 0.905 7.041 -18.675 470 H CYS 59 H CYS 59 -0.523 7.800 -16.768 471 HA CYS 59 HA CYS 59 0.069 6.843 -14.160 472 HB2 CYS 59 HB2 CYS 59 -2.538 7.712 -15.474 473 HB3 CYS 59 HB3 CYS 59 -2.343 7.362 -13.751 474 H ARG 60 H ARG 60 0.378 4.610 -13.853 475 HA ARG 60 HA ARG 60 -1.496 2.843 -15.283 476 HB2 ARG 60 HB2 ARG 60 0.959 2.406 -15.413 477 HB3 ARG 60 HB3 ARG 60 1.055 2.347 -13.648 478 HG2 ARG 60 HG2 ARG 60 1.081 0.085 -14.527 479 HG3 ARG 60 HG3 ARG 60 -0.426 0.340 -13.638 480 HD2 ARG 60 HD2 ARG 60 -0.631 1.062 -16.510 481 HD3 ARG 60 HD3 ARG 60 -0.198 -0.633 -16.251 482 HE ARG 60 HE ARG 60 -2.332 -0.121 -14.504 483 HH11 ARG 60 HH11 ARG 60 -1.783 -0.022 -17.978 484 HH12 ARG 60 HH12 ARG 60 -3.430 -0.392 -18.368 485 HH21 ARG 60 HH21 ARG 60 -4.479 -0.602 -15.032 486 HH22 ARG 60 HH22 ARG 60 -4.964 -0.722 -16.690 487 H LYS 61 H LYS 61 -3.240 2.023 -14.272 488 HA LYS 61 HA LYS 61 -3.161 1.906 -11.326 489 HB2 LYS 61 HB2 LYS 61 -5.496 2.406 -11.233 490 HB3 LYS 61 HB3 LYS 61 -4.675 3.691 -12.129 491 HG2 LYS 61 HG2 LYS 61 -5.460 2.656 -14.278 492 HG3 LYS 61 HG3 LYS 61 -6.331 1.430 -13.348 493 HD2 LYS 61 HD2 LYS 61 -6.869 4.249 -12.508 494 HD3 LYS 61 HD3 LYS 61 -7.389 3.859 -14.152 495 HE2 LYS 61 HE2 LYS 61 -9.235 3.413 -12.639 496 HE3 LYS 61 HE3 LYS 61 -8.642 1.870 -13.267 497 HZ1 LYS 61 HZ1 LYS 61 -9.049 1.834 -10.888 498 HZ2 LYS 61 HZ2 LYS 61 -7.479 1.524 -11.213 499 HZ3 LYS 61 HZ3 LYS 61 -7.919 2.986 -10.635 500 H TRP 62 H TRP 62 -4.227 0.019 -10.386 501 HA TRP 62 HA TRP 62 -5.102 -2.014 -12.319 502 HB2 TRP 62 HB2 TRP 62 -2.558 -2.192 -11.713 503 HB3 TRP 62 HB3 TRP 62 -3.126 -2.695 -10.115 504 HD1 TRP 62 HD1 TRP 62 -2.929 -5.266 -9.979 505 HE1 TRP 62 HE1 TRP 62 -3.523 -7.255 -11.519 506 HE3 TRP 62 HE3 TRP 62 -4.505 -2.644 -14.108 507 HZ2 TRP 62 HZ2 TRP 62 -4.526 -7.673 -14.116 508 HZ3 TRP 62 HZ3 TRP 62 -5.280 -3.917 -16.094 509 HH2 TRP 62 HH2 TRP 62 -5.290 -6.395 -16.095 510 H GLU 63 H GLU 63 -6.694 -3.440 -11.351 511 HA GLU 63 HA GLU 63 -7.528 -2.413 -8.669 512 HB2 GLU 63 HB2 GLU 63 -9.402 -3.989 -10.493 513 HB3 GLU 63 HB3 GLU 63 -9.788 -2.654 -9.399 514 HG2 GLU 63 HG2 GLU 63 -8.551 -2.404 -12.180 515 HG3 GLU 63 HG3 GLU 63 -10.230 -2.062 -11.743 516 H THR 64 H THR 64 -7.446 -3.952 -7.120 517 HA THR 64 HA THR 64 -7.150 -6.750 -7.946 518 HB THR 64 HB THR 64 -5.958 -5.384 -5.467 519 HG1 THR 64 HG1 THR 64 -3.946 -5.433 -6.566 520 HG21 THR 64 HG21 THR 64 -4.598 -7.478 -5.330 521 HG22 THR 64 HG22 THR 64 -6.358 -7.824 -5.241 522 HG23 THR 64 HG23 THR 64 -5.461 -8.119 -6.769 523 H THR 65 H THR 65 -8.239 -8.335 -6.735 524 HA THR 65 HA THR 65 -10.176 -7.308 -4.781 525 HB THR 65 HB THR 65 -10.431 -9.884 -6.342 526 HG1 THR 65 HG1 THR 65 -11.357 -8.715 -7.994 527 HG21 THR 65 HG21 THR 65 -12.818 -9.545 -5.840 528 HG22 THR 65 HG22 THR 65 -11.831 -9.612 -4.341 529 HG23 THR 65 HG23 THR 65 -12.419 -8.032 -4.958 530 H PHE 66 H PHE 66 -10.321 -8.271 -2.694 531 HA PHE 66 HA PHE 66 -8.523 -10.565 -2.289 532 HB2 PHE 66 HB2 PHE 66 -8.857 -8.270 -0.305 533 HB3 PHE 66 HB3 PHE 66 -7.703 -9.609 -0.229 534 HD1 PHE 66 HD1 PHE 66 -8.495 -6.377 -1.812 535 HD2 PHE 66 HD2 PHE 66 -5.671 -9.601 -1.570 536 HE1 PHE 66 HE1 PHE 66 -6.803 -4.976 -2.954 537 HE2 PHE 66 HE2 PHE 66 -3.974 -8.204 -2.713 538 HZ PHE 66 HZ PHE 66 -4.540 -5.888 -3.410 539 H LYS 67 H LYS 67 -8.993 -11.541 0.024 540 HA LYS 67 HA LYS 67 -11.919 -11.497 0.481 541 HB2 LYS 67 HB2 LYS 67 -9.942 -13.696 0.108 542 HB3 LYS 67 HB3 LYS 67 -11.042 -13.890 1.479 543 HG2 LYS 67 HG2 LYS 67 -12.041 -14.996 -0.402 544 HG3 LYS 67 HG3 LYS 67 -12.988 -13.534 -0.093 545 HD2 LYS 67 HD2 LYS 67 -11.933 -12.360 -1.950 546 HD3 LYS 67 HD3 LYS 67 -10.736 -13.644 -2.163 547 HE2 LYS 67 HE2 LYS 67 -12.494 -15.243 -2.822 548 HE3 LYS 67 HE3 LYS 67 -13.757 -14.056 -2.470 549 HZ1 LYS 67 HZ1 LYS 67 -13.179 -14.230 -4.827 550 HZ2 LYS 67 HZ2 LYS 67 -12.972 -12.715 -4.255 551 HZ3 LYS 67 HZ3 LYS 67 -11.676 -13.672 -4.521 552 H LYS 68 H LYS 68 -12.554 -11.608 2.766 553 HA LYS 68 HA LYS 68 -10.785 -10.215 4.426 554 HB2 LYS 68 HB2 LYS 68 -13.196 -9.994 4.675 555 HB3 LYS 68 HB3 LYS 68 -13.376 -11.722 5.007 556 HG2 LYS 68 HG2 LYS 68 -12.721 -11.519 7.198 557 HG3 LYS 68 HG3 LYS 68 -11.515 -10.274 6.845 558 HD2 LYS 68 HD2 LYS 68 -13.402 -9.378 8.197 559 HD3 LYS 68 HD3 LYS 68 -13.267 -8.560 6.635 560 HE2 LYS 68 HE2 LYS 68 -15.025 -10.196 5.738 561 HE3 LYS 68 HE3 LYS 68 -15.248 -10.760 7.400 562 HZ1 LYS 68 HZ1 LYS 68 -16.481 -8.638 6.256 563 HZ2 LYS 68 HZ2 LYS 68 -16.444 -8.972 7.854 564 HZ3 LYS 68 HZ3 LYS 68 -15.364 -7.929 7.213 565 H THR 69 H THR 69 -9.138 -10.861 5.755 566 HA THR 69 HA THR 69 -9.302 -13.602 6.884 567 HB THR 69 HB THR 69 -6.617 -12.593 6.052 568 HG1 THR 69 HG1 THR 69 -8.169 -13.791 3.929 569 HG21 THR 69 HG21 THR 69 -6.325 -14.952 5.336 570 HG22 THR 69 HG22 THR 69 -6.971 -14.835 7.008 571 HG23 THR 69 HG23 THR 69 -8.068 -15.253 5.648 572 H SER 70 H SER 70 -9.937 -12.413 8.828 573 HA SER 70 HA SER 70 -8.371 -10.251 9.828 574 HB2 SER 70 HB2 SER 70 -9.768 -11.128 11.996 575 HB3 SER 70 HB3 SER 70 -10.453 -10.079 10.749 576 HG SER 70 HG SER 70 -11.804 -11.935 11.185 577 H ASP 71 H ASP 71 -6.257 -11.556 9.399 578 HA ASP 71 HA ASP 71 -5.577 -13.670 11.150 579 HB2 ASP 71 HB2 ASP 71 -4.434 -12.936 8.969 580 HB3 ASP 71 HB3 ASP 71 -3.810 -11.523 9.830 581 H ASP 72 H ASP 72 -4.339 -10.225 11.185 582 HA ASP 72 HA ASP 72 -4.200 -10.442 14.136 583 HB2 ASP 72 HB2 ASP 72 -2.085 -10.110 12.487 584 HB3 ASP 72 HB3 ASP 72 -2.619 -8.424 12.542 585 H GLY 73 H GLY 73 -6.552 -9.904 13.615 586 HA2 GLY 73 HA2 GLY 73 -8.260 -8.711 14.103 587 HA3 GLY 73 HA3 GLY 73 -7.225 -7.296 14.338 588 H GLU 74 H GLU 74 -6.324 -6.539 11.646 589 HA GLU 74 HA GLU 74 -8.830 -6.876 10.069 590 HB2 GLU 74 HB2 GLU 74 -7.275 -4.267 10.478 591 HB3 GLU 74 HB3 GLU 74 -8.533 -4.504 9.258 592 HG2 GLU 74 HG2 GLU 74 -10.252 -4.704 10.898 593 HG3 GLU 74 HG3 GLU 74 -9.093 -4.952 12.211 594 H VAL 75 H VAL 75 -6.853 -8.620 9.612 595 HA VAL 75 HA VAL 75 -5.057 -7.457 7.605 596 HB VAL 75 HB VAL 75 -5.180 -10.187 8.969 597 HG11 VAL 75 HG11 VAL 75 -3.075 -10.719 7.782 598 HG12 VAL 75 HG12 VAL 75 -4.449 -10.487 6.649 599 HG13 VAL 75 HG13 VAL 75 -3.222 -9.191 6.849 600 HG21 VAL 75 HG21 VAL 75 -2.980 -9.491 9.897 601 HG22 VAL 75 HG22 VAL 75 -3.140 -7.909 9.061 602 HG23 VAL 75 HG23 VAL 75 -4.294 -8.358 10.362 603 H TYR 76 H TYR 76 -4.828 -8.698 5.476 604 HA TYR 76 HA TYR 76 -7.268 -10.152 4.732 605 HB2 TYR 76 HB2 TYR 76 -6.115 -7.750 3.233 606 HB3 TYR 76 HB3 TYR 76 -7.404 -8.805 2.641 607 HD1 TYR 76 HD1 TYR 76 -6.521 -6.203 5.131 608 HD2 TYR 76 HD2 TYR 76 -9.669 -8.670 3.563 609 HE1 TYR 76 HE1 TYR 76 -8.194 -4.818 6.318 610 HE2 TYR 76 HE2 TYR 76 -11.344 -7.295 4.758 611 HH TYR 76 HH TYR 76 -10.337 -4.492 6.779 612 H TYR 77 H TYR 77 -6.993 -11.567 2.875 613 HA TYR 77 HA TYR 77 -4.194 -11.887 2.051 614 HB2 TYR 77 HB2 TYR 77 -6.082 -13.980 3.230 615 HB3 TYR 77 HB3 TYR 77 -4.734 -14.438 2.181 616 HD1 TYR 77 HD1 TYR 77 -5.383 -12.367 5.279 617 HD2 TYR 77 HD2 TYR 77 -2.699 -14.977 3.173 618 HE1 TYR 77 HE1 TYR 77 -3.859 -12.373 7.231 619 HE2 TYR 77 HE2 TYR 77 -1.176 -14.986 5.124 620 HH TYR 77 HH TYR 77 -2.068 -13.992 8.183 621 H SER 78 H SER 78 -3.965 -12.220 -0.191 622 HA SER 78 HA SER 78 -6.515 -12.807 -1.603 623 HB2 SER 78 HB2 SER 78 -5.077 -11.809 -3.569 624 HB3 SER 78 HB3 SER 78 -5.822 -10.705 -2.405 625 HG SER 78 HG SER 78 -3.191 -11.644 -1.807 626 H GLU 79 H GLU 79 -6.305 -15.112 -1.302 627 HA GLU 79 HA GLU 79 -3.995 -16.595 -1.871 628 HB2 GLU 79 HB2 GLU 79 -6.464 -17.115 -0.850 629 HB3 GLU 79 HB3 GLU 79 -6.710 -17.709 -2.498 630 HG2 GLU 79 HG2 GLU 79 -4.583 -18.635 -0.514 631 HG3 GLU 79 HG3 GLU 79 -6.006 -19.539 -1.049 632 H GLU 80 H GLU 80 -6.669 -15.349 -3.956 633 HA GLU 80 HA GLU 80 -5.956 -16.802 -6.263 634 HB2 GLU 80 HB2 GLU 80 -7.274 -14.052 -6.134 635 HB3 GLU 80 HB3 GLU 80 -7.446 -15.278 -7.397 636 HG2 GLU 80 HG2 GLU 80 -8.559 -16.802 -5.745 637 HG3 GLU 80 HG3 GLU 80 -8.417 -15.545 -4.508 638 H ALA 81 H ALA 81 -4.426 -14.017 -4.704 639 HA ALA 81 HA ALA 81 -2.882 -13.569 -7.154 640 HB1 ALA 81 HB1 ALA 81 -2.297 -11.388 -6.132 641 HB2 ALA 81 HB2 ALA 81 -4.065 -11.591 -6.372 642 HB3 ALA 81 HB3 ALA 81 -3.354 -11.781 -4.734 643 H LYS 82 H LYS 82 -2.659 -15.076 -4.049 644 HA LYS 82 HA LYS 82 -0.956 -16.074 -3.003 645 HB2 LYS 82 HB2 LYS 82 0.856 -15.163 -5.280 646 HB3 LYS 82 HB3 LYS 82 1.153 -16.467 -4.122 647 HG2 LYS 82 HG2 LYS 82 -0.893 -16.410 -6.385 648 HG3 LYS 82 HG3 LYS 82 0.507 -17.477 -6.213 649 HD2 LYS 82 HD2 LYS 82 -0.498 -18.597 -4.280 650 HD3 LYS 82 HD3 LYS 82 -1.824 -17.428 -4.229 651 HE2 LYS 82 HE2 LYS 82 -2.205 -18.228 -6.755 652 HE3 LYS 82 HE3 LYS 82 -1.310 -19.655 -6.217 653 HZ1 LYS 82 HZ1 LYS 82 -3.553 -20.075 -5.809 654 HZ2 LYS 82 HZ2 LYS 82 -2.944 -19.729 -4.334 655 HZ3 LYS 82 HZ3 LYS 82 -3.836 -18.617 -5.131 656 H LYS 83 H LYS 83 -1.717 -13.536 -2.149 657 HA LYS 83 HA LYS 83 0.776 -12.531 -1.103 658 HB2 LYS 83 HB2 LYS 83 -1.137 -10.556 -2.405 659 HB3 LYS 83 HB3 LYS 83 0.531 -10.293 -1.879 660 HG2 LYS 83 HG2 LYS 83 1.438 -11.407 -3.770 661 HG3 LYS 83 HG3 LYS 83 -0.087 -12.221 -4.145 662 HD2 LYS 83 HD2 LYS 83 -1.088 -9.852 -4.496 663 HD3 LYS 83 HD3 LYS 83 0.577 -9.256 -4.453 664 HE2 LYS 83 HE2 LYS 83 1.199 -10.584 -6.385 665 HE3 LYS 83 HE3 LYS 83 -0.314 -11.497 -6.329 666 HZ1 LYS 83 HZ1 LYS 83 -0.248 -9.680 -7.987 667 HZ2 LYS 83 HZ2 LYS 83 -1.506 -9.563 -6.953 668 HZ3 LYS 83 HZ3 LYS 83 -0.212 -8.584 -6.777 669 H LYS 84 H LYS 84 0.506 -11.351 0.835 670 HA LYS 84 HA LYS 84 -2.239 -11.109 1.808 671 HB2 LYS 84 HB2 LYS 84 -1.357 -11.736 4.073 672 HB3 LYS 84 HB3 LYS 84 -1.463 -13.051 2.896 673 HG2 LYS 84 HG2 LYS 84 0.868 -13.200 2.640 674 HG3 LYS 84 HG3 LYS 84 1.146 -11.549 3.209 675 HD2 LYS 84 HD2 LYS 84 0.107 -13.833 4.964 676 HD3 LYS 84 HD3 LYS 84 1.800 -13.328 4.877 677 HE2 LYS 84 HE2 LYS 84 1.218 -11.070 5.674 678 HE3 LYS 84 HE3 LYS 84 -0.506 -11.461 5.632 679 HZ1 LYS 84 HZ1 LYS 84 0.601 -11.624 7.832 680 HZ2 LYS 84 HZ2 LYS 84 -0.227 -12.960 7.392 681 HZ3 LYS 84 HZ3 LYS 84 1.403 -12.944 7.303 682 H VAL 85 H VAL 85 -2.588 -9.376 3.386 683 HA VAL 85 HA VAL 85 -0.293 -7.589 3.753 684 HB VAL 85 HB VAL 85 -1.831 -5.639 3.257 685 HG11 VAL 85 HG11 VAL 85 -1.607 -5.823 0.792 686 HG12 VAL 85 HG12 VAL 85 -0.130 -6.393 1.640 687 HG13 VAL 85 HG13 VAL 85 -1.290 -7.583 0.958 688 HG21 VAL 85 HG21 VAL 85 -3.827 -6.049 1.852 689 HG22 VAL 85 HG22 VAL 85 -3.598 -7.819 2.050 690 HG23 VAL 85 HG23 VAL 85 -3.985 -6.799 3.476 691 H GLU 86 H GLU 86 -0.302 -6.592 5.806 692 HA GLU 86 HA GLU 86 -2.748 -6.917 7.394 693 HB2 GLU 86 HB2 GLU 86 -1.193 -7.366 9.366 694 HB3 GLU 86 HB3 GLU 86 -1.421 -8.686 8.212 695 HG2 GLU 86 HG2 GLU 86 0.887 -6.959 7.544 696 HG3 GLU 86 HG3 GLU 86 1.018 -7.700 9.144 697 H VAL 87 H VAL 87 -3.460 -4.985 8.155 698 HA VAL 87 HA VAL 87 -1.891 -2.644 7.834 699 HB VAL 87 HB VAL 87 -4.301 -2.532 7.722 700 HG11 VAL 87 HG11 VAL 87 -5.764 -2.935 9.692 701 HG12 VAL 87 HG12 VAL 87 -4.898 -4.419 9.170 702 HG13 VAL 87 HG13 VAL 87 -4.339 -3.515 10.617 703 HG21 VAL 87 HG21 VAL 87 -4.781 -0.727 9.355 704 HG22 VAL 87 HG22 VAL 87 -3.291 -1.165 10.257 705 HG23 VAL 87 HG23 VAL 87 -3.172 -0.538 8.578 706 H LEU 88 H LEU 88 -0.043 -2.342 9.102 707 HA LEU 88 HA LEU 88 0.229 -3.616 11.649 708 HB2 LEU 88 HB2 LEU 88 1.828 -1.402 10.245 709 HB3 LEU 88 HB3 LEU 88 2.349 -2.251 11.706 710 HG LEU 88 HG LEU 88 1.931 -3.527 8.970 711 HD11 LEU 88 HD11 LEU 88 4.388 -3.734 8.936 712 HD12 LEU 88 HD12 LEU 88 3.856 -2.020 8.993 713 HD13 LEU 88 HD13 LEU 88 4.483 -2.815 10.476 714 HD21 LEU 88 HD21 LEU 88 3.031 -5.498 9.994 715 HD22 LEU 88 HD22 LEU 88 3.054 -4.653 11.579 716 HD23 LEU 88 HD23 LEU 88 1.487 -5.089 10.816 717 H ASP 89 H ASP 89 -0.041 -0.099 10.572 718 HA ASP 89 HA ASP 89 -1.534 0.432 13.003 719 HB2 ASP 89 HB2 ASP 89 0.754 0.747 13.799 720 HB3 ASP 89 HB3 ASP 89 1.149 1.758 12.403 721 H THR 90 H THR 90 -2.956 2.193 12.738 722 HA THR 90 HA THR 90 -2.571 3.974 10.494 723 HB THR 90 HB THR 90 -3.695 1.929 9.551 724 HG1 THR 90 HG1 THR 90 -4.900 3.199 8.255 725 HG21 THR 90 HG21 THR 90 -6.081 1.555 10.103 726 HG22 THR 90 HG22 THR 90 -5.009 1.275 11.517 727 HG23 THR 90 HG23 THR 90 -5.966 2.791 11.401 728 H ASP 91 H ASP 91 -3.741 5.956 10.742 729 HA ASP 91 HA ASP 91 -5.157 6.153 13.323 730 HB2 ASP 91 HB2 ASP 91 -3.006 7.482 12.998 731 HB3 ASP 91 HB3 ASP 91 -3.844 8.398 11.739 732 H TYR 92 H TYR 92 -7.145 7.471 13.356 733 HA TYR 92 HA TYR 92 -8.635 7.157 10.930 734 HB2 TYR 92 HB2 TYR 92 -9.279 8.355 13.662 735 HB3 TYR 92 HB3 TYR 92 -10.443 8.294 12.331 736 HD1 TYR 92 HD1 TYR 92 -10.837 5.910 11.252 737 HD2 TYR 92 HD2 TYR 92 -9.128 6.529 15.145 738 HE1 TYR 92 HE1 TYR 92 -11.455 3.600 11.889 739 HE2 TYR 92 HE2 TYR 92 -9.738 4.216 15.781 740 HH TYR 92 HH TYR 92 -11.433 2.048 13.456 741 H LYS 93 H LYS 93 -6.872 9.838 12.509 742 HA LYS 93 HA LYS 93 -7.747 11.536 10.282 743 HB2 LYS 93 HB2 LYS 93 -7.308 12.321 13.181 744 HB3 LYS 93 HB3 LYS 93 -7.501 13.464 11.845 745 HG2 LYS 93 HG2 LYS 93 -9.761 12.486 11.356 746 HG3 LYS 93 HG3 LYS 93 -9.568 11.384 12.726 747 HD2 LYS 93 HD2 LYS 93 -9.308 13.354 14.260 748 HD3 LYS 93 HD3 LYS 93 -9.534 14.444 12.885 749 HE2 LYS 93 HE2 LYS 93 -11.577 12.360 13.814 750 HE3 LYS 93 HE3 LYS 93 -11.624 14.076 14.239 751 HZ1 LYS 93 HZ1 LYS 93 -13.026 13.719 12.394 752 HZ2 LYS 93 HZ2 LYS 93 -11.729 14.528 11.821 753 HZ3 LYS 93 HZ3 LYS 93 -11.883 12.927 11.540 754 H SER 94 H SER 94 -5.313 9.690 10.547 755 HA SER 94 HA SER 94 -3.445 11.832 9.822 756 HB2 SER 94 HB2 SER 94 -3.175 11.266 12.334 757 HB3 SER 94 HB3 SER 94 -2.832 9.593 11.872 758 HG SER 94 HG SER 94 -0.887 10.841 12.188 759 H TYR 95 H TYR 95 -1.206 9.750 9.910 760 HA TYR 95 HA TYR 95 -1.833 8.587 7.303 761 HB2 TYR 95 HB2 TYR 95 0.614 8.133 7.256 762 HB3 TYR 95 HB3 TYR 95 0.276 9.842 7.562 763 HD1 TYR 95 HD1 TYR 95 1.439 6.662 9.102 764 HD2 TYR 95 HD2 TYR 95 0.809 10.869 9.700 765 HE1 TYR 95 HE1 TYR 95 2.769 6.564 11.188 766 HE2 TYR 95 HE2 TYR 95 2.146 10.776 11.778 767 HH TYR 95 HH TYR 95 3.315 9.525 13.162 768 H ALA 96 H ALA 96 -0.530 6.308 7.055 769 HA ALA 96 HA ALA 96 -0.815 4.674 9.415 770 HB1 ALA 96 HB1 ALA 96 -2.310 3.071 8.320 771 HB2 ALA 96 HB2 ALA 96 -3.082 4.669 8.598 772 HB3 ALA 96 HB3 ALA 96 -2.518 4.218 6.954 773 H VAL 97 H VAL 97 0.089 2.470 9.168 774 HA VAL 97 HA VAL 97 1.844 2.289 6.812 775 HB VAL 97 HB VAL 97 3.513 1.153 8.290 776 HG11 VAL 97 HG11 VAL 97 4.405 3.248 9.264 777 HG12 VAL 97 HG12 VAL 97 3.794 3.490 7.592 778 HG13 VAL 97 HG13 VAL 97 2.816 4.042 8.994 779 HG21 VAL 97 HG21 VAL 97 3.402 1.545 10.728 780 HG22 VAL 97 HG22 VAL 97 1.768 2.264 10.533 781 HG23 VAL 97 HG23 VAL 97 2.039 0.531 10.145 782 H ILE 98 H ILE 98 1.447 0.370 5.674 783 HA ILE 98 HA ILE 98 0.124 -1.765 7.199 784 HB ILE 98 HB ILE 98 -0.047 -1.284 4.185 785 HG12 ILE 98 HG12 ILE 98 -1.002 0.672 5.259 786 HG13 ILE 98 HG13 ILE 98 -2.293 -0.325 4.575 787 HG21 ILE 98 HG21 ILE 98 -2.031 -2.759 4.352 788 HG22 ILE 98 HG22 ILE 98 -0.535 -3.574 4.920 789 HG23 ILE 98 HG23 ILE 98 -1.727 -2.955 6.112 790 HD11 ILE 98 HD11 ILE 98 -2.922 0.544 6.782 791 HD12 ILE 98 HD12 ILE 98 -2.790 -1.247 6.821 792 HD13 ILE 98 HD13 ILE 98 -1.479 -0.234 7.515 793 H TYR 99 H TYR 99 0.925 -3.895 6.984 794 HA TYR 99 HA TYR 99 3.549 -4.103 5.660 795 HB2 TYR 99 HB2 TYR 99 3.370 -4.653 8.084 796 HB3 TYR 99 HB3 TYR 99 2.102 -5.835 7.732 797 HD1 TYR 99 HD1 TYR 99 5.540 -5.084 6.339 798 HD2 TYR 99 HD2 TYR 99 2.824 -8.030 7.880 799 HE1 TYR 99 HE1 TYR 99 7.261 -6.835 6.024 800 HE2 TYR 99 HE2 TYR 99 4.542 -9.782 7.567 801 HH TYR 99 HH TYR 99 7.197 -9.431 5.634 802 H ALA 100 H ALA 100 3.889 -5.628 3.981 803 HA ALA 100 HA ALA 100 1.607 -7.342 3.336 804 HB1 ALA 100 HB1 ALA 100 1.869 -6.756 0.935 805 HB2 ALA 100 HB2 ALA 100 1.370 -5.348 1.932 806 HB3 ALA 100 HB3 ALA 100 3.075 -5.504 1.387 807 H THR 101 H THR 101 2.072 -9.333 2.414 808 HA THR 101 HA THR 101 4.838 -9.874 1.700 809 HB THR 101 HB THR 101 3.303 -11.465 3.812 810 HG1 THR 101 HG1 THR 101 5.844 -10.531 4.461 811 HG21 THR 101 HG21 THR 101 5.374 -12.814 3.971 812 HG22 THR 101 HG22 THR 101 4.641 -12.917 2.335 813 HG23 THR 101 HG23 THR 101 6.083 -11.882 2.609 814 H ARG 102 H ARG 102 5.025 -11.533 0.104 815 HA ARG 102 HA ARG 102 2.618 -13.084 -0.516 816 HB2 ARG 102 HB2 ARG 102 2.971 -12.633 -2.956 817 HB3 ARG 102 HB3 ARG 102 2.306 -11.286 -2.021 818 HG2 ARG 102 HG2 ARG 102 5.297 -11.426 -2.466 819 HG3 ARG 102 HG3 ARG 102 4.250 -10.909 -3.794 820 HD2 ARG 102 HD2 ARG 102 4.326 -9.681 -0.989 821 HD3 ARG 102 HD3 ARG 102 5.041 -8.976 -2.445 822 HE ARG 102 HE ARG 102 2.720 -8.754 -3.353 823 HH11 ARG 102 HH11 ARG 102 3.314 -8.808 0.083 824 HH12 ARG 102 HH12 ARG 102 1.705 -8.331 0.511 825 HH21 ARG 102 HH21 ARG 102 0.513 -8.286 -2.766 826 HH22 ARG 102 HH22 ARG 102 0.121 -8.036 -1.097 827 H VAL 103 H VAL 103 3.184 -15.168 -1.520 828 HA VAL 103 HA VAL 103 6.087 -15.561 -1.666 829 HB VAL 103 HB VAL 103 4.006 -17.560 -0.635 830 HG11 VAL 103 HG11 VAL 103 5.974 -18.914 0.017 831 HG12 VAL 103 HG12 VAL 103 5.899 -18.644 -1.757 832 HG13 VAL 103 HG13 VAL 103 7.054 -17.703 -0.753 833 HG21 VAL 103 HG21 VAL 103 5.067 -17.239 1.575 834 HG22 VAL 103 HG22 VAL 103 6.105 -15.948 0.882 835 HG23 VAL 103 HG23 VAL 103 4.325 -15.725 0.956 836 H LYS 104 H LYS 104 6.879 -16.655 -3.356 837 HA LYS 104 HA LYS 104 5.058 -17.838 -5.336 838 HB2 LYS 104 HB2 LYS 104 6.400 -15.504 -5.702 839 HB3 LYS 104 HB3 LYS 104 7.623 -16.664 -6.237 840 HG2 LYS 104 HG2 LYS 104 4.817 -17.011 -7.285 841 HG3 LYS 104 HG3 LYS 104 5.760 -15.644 -7.892 842 HD2 LYS 104 HD2 LYS 104 7.599 -17.190 -8.557 843 HD3 LYS 104 HD3 LYS 104 6.689 -18.564 -7.916 844 HE2 LYS 104 HE2 LYS 104 4.775 -17.840 -9.515 845 HE3 LYS 104 HE3 LYS 104 5.961 -16.774 -10.279 846 HZ1 LYS 104 HZ1 LYS 104 5.680 -19.082 -11.215 847 HZ2 LYS 104 HZ2 LYS 104 7.215 -18.590 -10.954 848 HZ3 LYS 104 HZ3 LYS 104 6.506 -19.637 -9.921 849 H ASP 105 H ASP 105 6.345 -19.487 -6.768 850 HA ASP 105 HA ASP 105 7.242 -21.587 -5.575 851 HB2 ASP 105 HB2 ASP 105 8.669 -20.218 -7.953 852 HB3 ASP 105 HB3 ASP 105 8.977 -21.897 -7.490 853 H GLY 106 H GLY 106 8.306 -21.440 -3.515 854 HA2 GLY 106 HA2 GLY 106 10.218 -21.632 -2.331 855 HA3 GLY 106 HA3 GLY 106 11.133 -21.476 -3.837 856 H ARG 107 H ARG 107 9.068 -18.697 -3.571 857 HA ARG 107 HA ARG 107 11.272 -17.237 -2.235 858 HB2 ARG 107 HB2 ARG 107 10.546 -17.289 -5.042 859 HB3 ARG 107 HB3 ARG 107 9.936 -15.754 -4.411 860 HG2 ARG 107 HG2 ARG 107 12.133 -15.344 -5.274 861 HG3 ARG 107 HG3 ARG 107 12.248 -15.269 -3.511 862 HD2 ARG 107 HD2 ARG 107 13.135 -17.571 -3.425 863 HD3 ARG 107 HD3 ARG 107 12.906 -17.759 -5.168 864 HE ARG 107 HE ARG 107 14.826 -15.806 -3.952 865 HH11 ARG 107 HH11 ARG 107 13.961 -18.132 -6.444 866 HH12 ARG 107 HH12 ARG 107 15.432 -17.909 -7.331 867 HH21 ARG 107 HH21 ARG 107 16.743 -15.514 -5.141 868 HH22 ARG 107 HH22 ARG 107 17.011 -16.422 -6.591 869 H THR 108 H THR 108 10.610 -15.856 -0.701 870 HA THR 108 HA THR 108 7.761 -15.142 -0.643 871 HB THR 108 HB THR 108 9.722 -15.080 1.673 872 HG1 THR 108 HG1 THR 108 8.729 -17.158 2.248 873 HG21 THR 108 HG21 THR 108 7.646 -15.165 3.014 874 HG22 THR 108 HG22 THR 108 7.680 -13.737 1.926 875 HG23 THR 108 HG23 THR 108 6.675 -15.163 1.503 876 H LEU 109 H LEU 109 7.249 -12.936 -1.004 877 HA LEU 109 HA LEU 109 9.554 -11.122 -0.739 878 HB2 LEU 109 HB2 LEU 109 8.689 -11.413 -3.043 879 HB3 LEU 109 HB3 LEU 109 7.082 -10.908 -2.503 880 HG LEU 109 HG LEU 109 7.861 -8.668 -2.025 881 HD11 LEU 109 HD11 LEU 109 10.192 -7.971 -2.484 882 HD12 LEU 109 HD12 LEU 109 10.104 -9.203 -1.181 883 HD13 LEU 109 HD13 LEU 109 10.628 -9.678 -2.831 884 HD21 LEU 109 HD21 LEU 109 8.527 -7.949 -4.297 885 HD22 LEU 109 HD22 LEU 109 8.889 -9.655 -4.724 886 HD23 LEU 109 HD23 LEU 109 7.206 -9.165 -4.336 887 H HIS 110 H HIS 110 9.393 -9.413 0.652 888 HA HIS 110 HA HIS 110 6.767 -9.033 1.977 889 HB2 HIS 110 HB2 HIS 110 9.616 -8.572 3.008 890 HB3 HIS 110 HB3 HIS 110 8.133 -8.180 3.888 891 HD2 HIS 110 HD2 HIS 110 10.460 -11.198 3.211 892 HE1 HIS 110 HE1 HIS 110 7.105 -12.639 5.435 893 H MET 111 H MET 111 6.097 -6.794 2.115 894 HA MET 111 HA MET 111 7.948 -4.710 1.262 895 HB2 MET 111 HB2 MET 111 6.540 -6.058 -0.697 896 HB3 MET 111 HB3 MET 111 5.371 -4.810 -0.242 897 HG2 MET 111 HG2 MET 111 7.282 -3.110 -0.586 898 HG3 MET 111 HG3 MET 111 8.179 -4.431 -1.346 899 HE1 MET 111 HE1 MET 111 7.257 -2.730 -4.632 900 HE2 MET 111 HE2 MET 111 7.717 -1.871 -3.124 901 HE3 MET 111 HE3 MET 111 8.510 -3.424 -3.550 902 H MET 112 H MET 112 7.600 -3.178 2.786 903 HA MET 112 HA MET 112 4.935 -3.003 4.009 904 HB2 MET 112 HB2 MET 112 7.657 -1.871 4.810 905 HB3 MET 112 HB3 MET 112 6.146 -1.545 5.670 906 HG2 MET 112 HG2 MET 112 5.912 -3.987 6.137 907 HG3 MET 112 HG3 MET 112 7.457 -4.274 5.326 908 HE1 MET 112 HE1 MET 112 10.058 -2.544 7.633 909 HE2 MET 112 HE2 MET 112 9.659 -3.152 5.991 910 HE3 MET 112 HE3 MET 112 9.151 -1.502 6.485 911 H ARG 113 H ARG 113 4.066 -0.745 4.367 912 HA ARG 113 HA ARG 113 5.237 1.324 2.760 913 HB2 ARG 113 HB2 ARG 113 3.179 1.684 1.406 914 HB3 ARG 113 HB3 ARG 113 4.050 0.199 1.001 915 HG2 ARG 113 HG2 ARG 113 2.381 -0.993 2.616 916 HG3 ARG 113 HG3 ARG 113 1.428 0.494 2.516 917 HD2 ARG 113 HD2 ARG 113 0.856 -1.371 0.823 918 HD3 ARG 113 HD3 ARG 113 1.067 0.260 0.171 919 HE ARG 113 HE ARG 113 2.901 -0.503 -1.028 920 HH11 ARG 113 HH11 ARG 113 2.178 -2.820 1.512 921 HH12 ARG 113 HH12 ARG 113 3.411 -3.932 1.019 922 HH21 ARG 113 HH21 ARG 113 4.596 -1.915 -1.588 923 HH22 ARG 113 HH22 ARG 113 4.786 -3.416 -0.745 924 H LEU 114 H LEU 114 4.007 3.406 2.915 925 HA LEU 114 HA LEU 114 2.321 3.510 5.333 926 HB2 LEU 114 HB2 LEU 114 4.717 4.111 5.820 927 HB3 LEU 114 HB3 LEU 114 4.585 5.416 4.634 928 HG LEU 114 HG LEU 114 2.758 5.218 7.057 929 HD11 LEU 114 HD11 LEU 114 4.253 6.870 8.140 930 HD12 LEU 114 HD12 LEU 114 5.087 5.309 7.835 931 HD13 LEU 114 HD13 LEU 114 5.403 6.719 6.769 932 HD21 LEU 114 HD21 LEU 114 2.456 7.639 6.647 933 HD22 LEU 114 HD22 LEU 114 3.533 7.524 5.214 934 HD23 LEU 114 HD23 LEU 114 1.964 6.651 5.230 935 H TYR 115 H TYR 115 0.495 4.810 5.011 936 HA TYR 115 HA TYR 115 0.544 6.419 2.542 937 HB2 TYR 115 HB2 TYR 115 -1.709 5.921 2.106 938 HB3 TYR 115 HB3 TYR 115 -0.850 4.391 2.327 939 HD1 TYR 115 HD1 TYR 115 -3.294 6.733 3.862 940 HD2 TYR 115 HD2 TYR 115 -1.467 2.851 4.084 941 HE1 TYR 115 HE1 TYR 115 -5.028 6.011 5.473 942 HE2 TYR 115 HE2 TYR 115 -3.191 2.131 5.709 943 HH TYR 115 HH TYR 115 -5.328 2.646 6.480 944 H SER 116 H SER 116 -0.653 8.420 2.568 945 HA SER 116 HA SER 116 -0.879 9.480 5.328 946 HB2 SER 116 HB2 SER 116 -0.326 10.908 2.650 947 HB3 SER 116 HB3 SER 116 -0.434 11.694 4.230 948 HG SER 116 HG SER 116 1.614 11.258 4.511 949 H ARG 117 H ARG 117 -2.722 11.042 5.586 950 HA ARG 117 HA ARG 117 -5.081 9.991 4.507 951 HB2 ARG 117 HB2 ARG 117 -4.251 12.357 6.184 952 HB3 ARG 117 HB3 ARG 117 -5.827 12.480 5.391 953 HG2 ARG 117 HG2 ARG 117 -6.391 10.194 6.418 954 HG3 ARG 117 HG3 ARG 117 -4.910 10.350 7.372 955 HD2 ARG 117 HD2 ARG 117 -7.004 11.126 8.559 956 HD3 ARG 117 HD3 ARG 117 -5.715 12.334 8.486 957 HE ARG 117 HE ARG 117 -7.039 13.652 7.086 958 HH11 ARG 117 HH11 ARG 117 -8.551 10.504 7.528 959 HH12 ARG 117 HH12 ARG 117 -10.020 10.969 6.736 960 HH21 ARG 117 HH21 ARG 117 -8.950 14.233 6.029 961 HH22 ARG 117 HH22 ARG 117 -10.247 13.093 5.883 962 H SER 118 H SER 118 -2.815 12.363 3.196 963 HA SER 118 HA SER 118 -4.585 12.736 0.889 964 HB2 SER 118 HB2 SER 118 -3.222 15.058 2.312 965 HB3 SER 118 HB3 SER 118 -4.227 15.127 0.858 966 HG SER 118 HG SER 118 -5.409 15.709 2.780 967 HA PRO 119 HA PRO 119 -0.575 12.382 -1.118 968 HB2 PRO 119 HB2 PRO 119 -0.520 14.430 -2.995 969 HB3 PRO 119 HB3 PRO 119 -1.623 13.063 -3.198 970 HG2 PRO 119 HG2 PRO 119 -2.189 15.827 -2.090 971 HG3 PRO 119 HG3 PRO 119 -3.151 14.862 -3.218 972 HD2 PRO 119 HD2 PRO 119 -3.764 15.012 -0.550 973 HD3 PRO 119 HD3 PRO 119 -4.107 13.564 -1.506 974 H GLU 120 H GLU 120 0.046 13.259 1.280 975 HA GLU 120 HA GLU 120 2.205 15.119 0.749 976 HB2 GLU 120 HB2 GLU 120 1.497 16.534 2.738 977 HB3 GLU 120 HB3 GLU 120 0.571 16.770 1.250 978 HG2 GLU 120 HG2 GLU 120 -1.208 15.234 2.160 979 HG3 GLU 120 HG3 GLU 120 -0.294 15.114 3.669 980 H VAL 121 H VAL 121 3.940 14.022 1.572 981 HA VAL 121 HA VAL 121 3.509 11.930 3.484 982 HB VAL 121 HB VAL 121 6.034 13.480 2.583 983 HG11 VAL 121 HG11 VAL 121 7.351 11.487 3.298 984 HG12 VAL 121 HG12 VAL 121 6.475 12.260 4.662 985 HG13 VAL 121 HG13 VAL 121 5.845 10.743 3.934 986 HG21 VAL 121 HG21 VAL 121 6.433 11.294 1.203 987 HG22 VAL 121 HG22 VAL 121 4.683 11.088 1.397 988 HG23 VAL 121 HG23 VAL 121 5.297 12.544 0.595 989 H SER 122 H SER 122 3.705 12.099 5.711 990 HA SER 122 HA SER 122 4.158 14.765 6.815 991 HB2 SER 122 HB2 SER 122 3.109 13.592 8.886 992 HB3 SER 122 HB3 SER 122 2.044 13.884 7.504 993 HG SER 122 HG SER 122 2.218 11.618 8.617 994 HA PRO 123 HA PRO 123 8.127 13.705 8.457 995 HB2 PRO 123 HB2 PRO 123 7.929 15.324 10.780 996 HB3 PRO 123 HB3 PRO 123 8.423 15.950 9.201 997 HG2 PRO 123 HG2 PRO 123 5.711 16.042 10.531 998 HG3 PRO 123 HG3 PRO 123 6.525 17.281 9.566 999 HD2 PRO 123 HD2 PRO 123 4.546 15.789 8.488 1000 HD3 PRO 123 HD3 PRO 123 5.943 16.256 7.510 1001 H ALA 124 H ALA 124 5.291 13.802 10.741 1002 HA ALA 124 HA ALA 124 6.435 12.215 12.723 1003 HB1 ALA 124 HB1 ALA 124 4.094 11.757 13.375 1004 HB2 ALA 124 HB2 ALA 124 4.359 13.495 13.009 1005 HB3 ALA 124 HB3 ALA 124 3.529 12.442 11.814 1006 H ALA 125 H ALA 125 4.551 11.277 9.735 1007 HA ALA 125 HA ALA 125 4.497 8.516 10.319 1008 HB1 ALA 125 HB1 ALA 125 3.981 8.295 7.914 1009 HB2 ALA 125 HB2 ALA 125 3.020 9.606 8.678 1010 HB3 ALA 125 HB3 ALA 125 4.441 10.013 7.657 1011 H THR 126 H THR 126 6.849 10.687 8.650 1012 HA THR 126 HA THR 126 8.459 8.705 7.529 1013 HB THR 126 HB THR 126 9.231 11.471 8.594 1014 HG1 THR 126 HG1 THR 126 7.505 11.649 7.081 1015 HG21 THR 126 HG21 THR 126 11.011 11.364 6.869 1016 HG22 THR 126 HG22 THR 126 11.174 10.044 8.075 1017 HG23 THR 126 HG23 THR 126 10.496 9.695 6.449 1018 H ALA 127 H ALA 127 8.711 10.477 10.733 1019 HA ALA 127 HA ALA 127 11.034 9.077 11.538 1020 HB1 ALA 127 HB1 ALA 127 10.503 10.036 13.763 1021 HB2 ALA 127 HB2 ALA 127 10.399 11.264 12.457 1022 HB3 ALA 127 HB3 ALA 127 8.899 10.557 13.146 1023 H ILE 128 H ILE 128 7.486 8.491 12.043 1024 HA ILE 128 HA ILE 128 7.865 6.455 13.948 1025 HB ILE 128 HB ILE 128 5.559 7.101 12.069 1026 HG12 ILE 128 HG12 ILE 128 6.000 8.786 13.784 1027 HG13 ILE 128 HG13 ILE 128 4.502 7.919 14.150 1028 HG21 ILE 128 HG21 ILE 128 4.195 5.569 13.444 1029 HG22 ILE 128 HG22 ILE 128 5.507 4.704 12.573 1030 HG23 ILE 128 HG23 ILE 128 5.672 5.053 14.327 1031 HD11 ILE 128 HD11 ILE 128 5.828 8.292 16.183 1032 HD12 ILE 128 HD12 ILE 128 5.696 6.537 15.827 1033 HD13 ILE 128 HD13 ILE 128 7.217 7.417 15.455 1034 H PHE 129 H PHE 129 7.297 6.352 10.328 1035 HA PHE 129 HA PHE 129 7.314 3.585 10.066 1036 HB2 PHE 129 HB2 PHE 129 6.692 5.385 8.358 1037 HB3 PHE 129 HB3 PHE 129 8.423 5.620 8.082 1038 HD1 PHE 129 HD1 PHE 129 5.578 3.299 7.675 1039 HD2 PHE 129 HD2 PHE 129 9.744 3.972 6.889 1040 HE1 PHE 129 HE1 PHE 129 5.562 1.452 6.028 1041 HE2 PHE 129 HE2 PHE 129 9.735 2.125 5.241 1042 HZ PHE 129 HZ PHE 129 7.642 0.859 4.806 1043 H ARG 130 H ARG 130 10.060 5.945 10.305 1044 HA ARG 130 HA ARG 130 12.019 4.058 9.517 1045 HB2 ARG 130 HB2 ARG 130 12.382 6.490 9.381 1046 HB3 ARG 130 HB3 ARG 130 12.218 6.641 11.136 1047 HG2 ARG 130 HG2 ARG 130 14.212 4.916 11.232 1048 HG3 ARG 130 HG3 ARG 130 14.470 5.364 9.540 1049 HD2 ARG 130 HD2 ARG 130 14.279 7.405 11.811 1050 HD3 ARG 130 HD3 ARG 130 15.806 6.698 11.266 1051 HE ARG 130 HE ARG 130 14.901 7.652 8.931 1052 HH11 ARG 130 HH11 ARG 130 14.812 9.141 12.113 1053 HH12 ARG 130 HH12 ARG 130 14.914 10.756 11.496 1054 HH21 ARG 130 HH21 ARG 130 15.059 9.776 8.134 1055 HH22 ARG 130 HH22 ARG 130 15.054 11.117 9.230 1056 H LYS 131 H LYS 131 10.752 5.201 12.747 1057 HA LYS 131 HA LYS 131 12.581 3.983 14.392 1058 HB2 LYS 131 HB2 LYS 131 9.564 4.410 14.637 1059 HB3 LYS 131 HB3 LYS 131 10.534 3.756 15.964 1060 HG2 LYS 131 HG2 LYS 131 11.909 5.815 16.005 1061 HG3 LYS 131 HG3 LYS 131 11.004 6.467 14.633 1062 HD2 LYS 131 HD2 LYS 131 8.937 6.539 15.928 1063 HD3 LYS 131 HD3 LYS 131 9.672 5.637 17.259 1064 HE2 LYS 131 HE2 LYS 131 11.317 7.524 17.586 1065 HE3 LYS 131 HE3 LYS 131 10.495 8.431 16.309 1066 HZ1 LYS 131 HZ1 LYS 131 9.705 9.048 18.482 1067 HZ2 LYS 131 HZ2 LYS 131 8.488 8.355 17.643 1068 HZ3 LYS 131 HZ3 LYS 131 9.247 7.518 18.821 1069 H LEU 132 H LEU 132 9.512 2.507 13.010 1070 HA LEU 132 HA LEU 132 9.992 -0.011 14.229 1071 HB2 LEU 132 HB2 LEU 132 8.338 0.766 11.786 1072 HB3 LEU 132 HB3 LEU 132 8.263 -0.791 12.621 1073 HG LEU 132 HG LEU 132 7.537 1.904 13.851 1074 HD11 LEU 132 HD11 LEU 132 5.209 1.077 13.723 1075 HD12 LEU 132 HD12 LEU 132 5.956 1.233 12.097 1076 HD13 LEU 132 HD13 LEU 132 5.783 -0.387 12.854 1077 HD21 LEU 132 HD21 LEU 132 6.597 0.545 15.690 1078 HD22 LEU 132 HD22 LEU 132 7.230 -0.943 14.907 1079 HD23 LEU 132 HD23 LEU 132 8.369 0.306 15.515 1080 H ALA 133 H ALA 133 10.657 1.364 10.919 1081 HA ALA 133 HA ALA 133 11.580 -0.988 9.766 1082 HB1 ALA 133 HB1 ALA 133 12.706 0.536 8.161 1083 HB2 ALA 133 HB2 ALA 133 11.015 1.040 8.498 1084 HB3 ALA 133 HB3 ALA 133 12.383 1.918 9.262 1085 H GLY 134 H GLY 134 13.370 1.475 11.787 1086 HA2 GLY 134 HA2 GLY 134 15.914 0.323 11.235 1087 HA3 GLY 134 HA3 GLY 134 15.500 1.477 12.509 1088 H GLU 135 H GLU 135 13.332 -0.289 13.684 1089 HA GLU 135 HA GLU 135 14.975 -1.709 15.502 1090 HB2 GLU 135 HB2 GLU 135 12.733 -0.718 15.992 1091 HB3 GLU 135 HB3 GLU 135 11.985 -1.918 14.929 1092 HG2 GLU 135 HG2 GLU 135 12.554 -3.729 16.386 1093 HG3 GLU 135 HG3 GLU 135 13.703 -2.744 17.301 1094 H ARG 136 H ARG 136 13.561 -2.510 12.341 1095 HA ARG 136 HA ARG 136 13.946 -5.372 12.821 1096 HB2 ARG 136 HB2 ARG 136 12.927 -3.957 10.315 1097 HB3 ARG 136 HB3 ARG 136 12.750 -5.664 10.742 1098 HG2 ARG 136 HG2 ARG 136 11.273 -5.045 12.647 1099 HG3 ARG 136 HG3 ARG 136 11.465 -3.333 12.249 1100 HD2 ARG 136 HD2 ARG 136 9.489 -3.755 11.127 1101 HD3 ARG 136 HD3 ARG 136 10.636 -4.124 9.832 1102 HE ARG 136 HE ARG 136 10.204 -6.447 10.118 1103 HH11 ARG 136 HH11 ARG 136 8.386 -4.493 12.413 1104 HH12 ARG 136 HH12 ARG 136 7.286 -5.770 12.811 1105 HH21 ARG 136 HH21 ARG 136 8.742 -8.108 10.650 1106 HH22 ARG 136 HH22 ARG 136 7.488 -7.822 11.810 1107 H ASN 137 H ASN 137 16.202 -3.186 12.505 1108 HA ASN 137 HA ASN 137 18.189 -3.013 11.566 1109 HB2 ASN 137 HB2 ASN 137 17.717 -5.952 10.825 1110 HB3 ASN 137 HB3 ASN 137 19.281 -5.128 10.770 1111 HD21 ASN 137 HD21 ASN 137 20.277 -4.455 12.765 1112 HD22 ASN 137 HD22 ASN 137 19.838 -5.188 14.272 1113 H TYR 138 H TYR 138 15.916 -2.178 9.885 1114 HA TYR 138 HA TYR 138 16.343 -3.168 7.253 1115 HB2 TYR 138 HB2 TYR 138 14.609 -1.691 6.690 1116 HB3 TYR 138 HB3 TYR 138 14.307 -1.851 8.425 1117 HD1 TYR 138 HD1 TYR 138 16.218 -0.057 9.708 1118 HD2 TYR 138 HD2 TYR 138 14.095 0.486 6.014 1119 HE1 TYR 138 HE1 TYR 138 16.410 2.396 9.963 1120 HE2 TYR 138 HE2 TYR 138 14.288 2.941 6.267 1121 HH TYR 138 HH TYR 138 15.029 4.621 7.492 1122 H THR 139 H THR 139 16.886 -1.561 5.381 1123 HA THR 139 HA THR 139 19.137 0.199 6.206 1124 HB THR 139 HB THR 139 19.976 -0.460 3.823 1125 HG1 THR 139 HG1 THR 139 19.322 -2.660 3.222 1126 HG21 THR 139 HG21 THR 139 21.167 -2.450 4.743 1127 HG22 THR 139 HG22 THR 139 21.102 -1.114 5.941 1128 HG23 THR 139 HG23 THR 139 19.993 -2.518 6.100 1129 H ASP 140 H ASP 140 19.259 2.199 4.921 1130 HA ASP 140 HA ASP 140 16.866 3.393 4.384 1131 HB2 ASP 140 HB2 ASP 140 18.776 4.815 4.500 1132 HB3 ASP 140 HB3 ASP 140 19.750 3.761 3.467 1133 H GLU 141 H GLU 141 19.015 1.972 1.768 1134 HA GLU 141 HA GLU 141 17.256 2.553 -0.296 1135 HB2 GLU 141 HB2 GLU 141 19.727 1.708 -0.286 1136 HB3 GLU 141 HB3 GLU 141 19.022 0.087 -0.240 1137 HG2 GLU 141 HG2 GLU 141 18.061 0.290 -2.379 1138 HG3 GLU 141 HG3 GLU 141 18.103 2.058 -2.347 1139 H MET 142 H MET 142 16.741 0.224 2.261 1140 HA MET 142 HA MET 142 15.206 -1.592 0.624 1141 HB2 MET 142 HB2 MET 142 16.297 -2.414 2.658 1142 HB3 MET 142 HB3 MET 142 15.574 -1.132 3.639 1143 HG2 MET 142 HG2 MET 142 13.288 -2.144 3.111 1144 HG3 MET 142 HG3 MET 142 14.135 -3.500 2.354 1145 HE1 MET 142 HE1 MET 142 15.886 -5.312 5.286 1146 HE2 MET 142 HE2 MET 142 15.521 -5.248 3.528 1147 HE3 MET 142 HE3 MET 142 16.676 -4.077 4.248 1148 H VAL 143 H VAL 143 14.697 1.500 2.203 1149 HA VAL 143 HA VAL 143 11.803 1.204 2.035 1150 HB VAL 143 HB VAL 143 13.452 3.204 3.617 1151 HG11 VAL 143 HG11 VAL 143 11.278 3.890 4.579 1152 HG12 VAL 143 HG12 VAL 143 11.356 4.191 2.810 1153 HG13 VAL 143 HG13 VAL 143 10.433 2.786 3.442 1154 HG21 VAL 143 HG21 VAL 143 12.528 2.027 5.579 1155 HG22 VAL 143 HG22 VAL 143 11.744 0.836 4.487 1156 HG23 VAL 143 HG23 VAL 143 13.535 0.947 4.556 1157 H ALA 144 H ALA 144 10.577 3.077 1.089 1158 HA ALA 144 HA ALA 144 12.266 4.851 -0.550 1159 HB1 ALA 144 HB1 ALA 144 10.658 4.527 -2.404 1160 HB2 ALA 144 HB2 ALA 144 11.487 2.997 -1.962 1161 HB3 ALA 144 HB3 ALA 144 9.798 3.289 -1.427 1162 H MET 145 H MET 145 11.744 6.930 -0.265 1163 HA MET 145 HA MET 145 9.060 7.604 0.647 1164 HB2 MET 145 HB2 MET 145 11.674 8.899 1.370 1165 HB3 MET 145 HB3 MET 145 10.086 9.606 1.695 1166 HG2 MET 145 HG2 MET 145 9.517 7.454 2.967 1167 HG3 MET 145 HG3 MET 145 11.221 7.008 2.811 1168 HE1 MET 145 HE1 MET 145 9.852 11.004 4.632 1169 HE2 MET 145 HE2 MET 145 9.121 10.093 3.267 1170 HE3 MET 145 HE3 MET 145 8.753 9.622 4.960 1171 H LEU 146 H LEU 146 7.917 9.362 -0.347 1172 HA LEU 146 HA LEU 146 9.445 10.610 -2.525 1173 HB2 LEU 146 HB2 LEU 146 6.560 9.723 -2.505 1174 HB3 LEU 146 HB3 LEU 146 7.288 10.758 -3.741 1175 HG LEU 146 HG LEU 146 7.212 8.534 -4.589 1176 HD11 LEU 146 HD11 LEU 146 9.596 8.025 -5.014 1177 HD12 LEU 146 HD12 LEU 146 9.228 9.776 -5.171 1178 HD13 LEU 146 HD13 LEU 146 10.060 9.162 -3.704 1179 HD21 LEU 146 HD21 LEU 146 8.308 6.606 -3.499 1180 HD22 LEU 146 HD22 LEU 146 8.681 7.636 -2.076 1181 HD23 LEU 146 HD23 LEU 146 6.973 7.288 -2.510 1182 HA PRO 147 HA PRO 147 8.220 14.289 -0.164 1183 HB2 PRO 147 HB2 PRO 147 9.755 16.054 -1.678 1184 HB3 PRO 147 HB3 PRO 147 10.513 15.030 -0.452 1185 HG2 PRO 147 HG2 PRO 147 10.339 14.608 -3.450 1186 HG3 PRO 147 HG3 PRO 147 11.727 14.390 -2.376 1187 HD2 PRO 147 HD2 PRO 147 10.234 12.270 -3.215 1188 HD3 PRO 147 HD3 PRO 147 10.982 12.290 -1.613 1189 H ARG 148 H ARG 148 7.942 16.791 -1.459 1190 HA ARG 148 HA ARG 148 5.411 16.434 -2.634 1191 HB2 ARG 148 HB2 ARG 148 5.264 18.762 -2.735 1192 HB3 ARG 148 HB3 ARG 148 6.255 18.430 -1.309 1193 HG2 ARG 148 HG2 ARG 148 7.341 19.262 -4.041 1194 HG3 ARG 148 HG3 ARG 148 7.078 20.353 -2.674 1195 HD2 ARG 148 HD2 ARG 148 8.915 17.906 -2.608 1196 HD3 ARG 148 HD3 ARG 148 9.461 19.559 -2.919 1197 HE ARG 148 HE ARG 148 7.993 19.548 -0.477 1198 HH11 ARG 148 HH11 ARG 148 11.020 18.333 -1.799 1199 HH12 ARG 148 HH12 ARG 148 11.835 18.356 -0.271 1200 HH21 ARG 148 HH21 ARG 148 9.078 19.582 1.516 1201 HH22 ARG 148 HH22 ARG 148 10.729 19.068 1.616 1202 H GLN 149 H GLN 149 6.567 14.758 -4.201 1203 HA GLN 149 HA GLN 149 7.093 16.093 -6.703 1204 HB2 GLN 149 HB2 GLN 149 9.009 14.844 -5.728 1205 HB3 GLN 149 HB3 GLN 149 8.097 13.352 -5.991 1206 HG2 GLN 149 HG2 GLN 149 7.908 14.623 -8.468 1207 HG3 GLN 149 HG3 GLN 149 9.532 15.068 -7.927 1208 HE21 GLN 149 HE21 GLN 149 9.823 12.568 -6.271 1209 HE22 GLN 149 HE22 GLN 149 10.123 11.297 -7.409 1210 H GLU 150 H GLU 150 4.400 15.569 -5.693 1211 HA GLU 150 HA GLU 150 3.590 13.329 -7.377 1212 HB2 GLU 150 HB2 GLU 150 1.421 13.565 -6.201 1213 HB3 GLU 150 HB3 GLU 150 2.776 13.306 -5.094 1214 HG2 GLU 150 HG2 GLU 150 1.413 14.976 -4.085 1215 HG3 GLU 150 HG3 GLU 150 2.836 15.822 -4.708 1216 H GLU 151 H GLU 151 1.403 13.532 -8.554 1217 HA GLU 151 HA GLU 151 0.607 16.090 -9.445 1218 HB2 GLU 151 HB2 GLU 151 2.724 15.998 -10.696 1219 HB3 GLU 151 HB3 GLU 151 2.350 14.372 -11.283 1220 HG2 GLU 151 HG2 GLU 151 0.418 15.267 -12.567 1221 HG3 GLU 151 HG3 GLU 151 0.757 16.893 -11.960 1222 H CYS 152 H CYS 152 0.866 12.542 -10.350 1223 HA CYS 152 HA CYS 152 -1.743 12.861 -11.709 1224 HB2 CYS 152 HB2 CYS 152 0.056 11.376 -12.724 1225 HB3 CYS 152 HB3 CYS 152 0.243 10.509 -11.194 1226 H THR 153 H THR 153 -3.598 12.155 -10.663 1227 HA THR 153 HA THR 153 -3.288 10.895 -8.025 1228 HB THR 153 HB THR 153 -5.574 12.802 -8.716 1229 HG1 THR 153 HG1 THR 153 -4.270 14.570 -7.847 1230 HG21 THR 153 HG21 THR 153 -5.484 13.249 -6.266 1231 HG22 THR 153 HG22 THR 153 -5.655 11.495 -6.614 1232 HG23 THR 153 HG23 THR 153 -4.060 12.162 -6.128 1233 H VAL 154 H VAL 154 -4.982 9.381 -7.422 1234 HA VAL 154 HA VAL 154 -6.353 8.303 -9.762 1235 HB VAL 154 HB VAL 154 -5.095 6.809 -8.243 1236 HG11 VAL 154 HG11 VAL 154 -5.929 6.313 -5.965 1237 HG12 VAL 154 HG12 VAL 154 -5.353 8.006 -6.132 1238 HG13 VAL 154 HG13 VAL 154 -7.114 7.654 -6.119 1239 HG21 VAL 154 HG21 VAL 154 -6.870 5.119 -7.878 1240 HG22 VAL 154 HG22 VAL 154 -8.114 6.382 -8.167 1241 HG23 VAL 154 HG23 VAL 154 -6.994 5.906 -9.488 1242 H ASP 155 H ASP 155 -8.579 8.435 -10.080 1243 HA ASP 155 HA ASP 155 -10.013 10.392 -8.634 1244 HB2 ASP 155 HB2 ASP 155 -10.377 9.806 -11.044 1245 HB3 ASP 155 HB3 ASP 155 -11.008 8.228 -10.556 1246 H GLU 156 H GLU 156 -11.901 10.158 -7.263 1247 HA GLU 156 HA GLU 156 -11.871 7.573 -5.876 1248 HB2 GLU 156 HB2 GLU 156 -12.744 8.792 -3.922 1249 HB3 GLU 156 HB3 GLU 156 -11.159 9.380 -4.440 1250 HG2 GLU 156 HG2 GLU 156 -12.399 11.259 -5.681 1251 HG3 GLU 156 HG3 GLU 156 -13.863 10.728 -4.843 1252 H VAL 157 H VAL 157 -14.188 10.194 -6.988 1253 HA VAL 157 HA VAL 157 -16.005 8.256 -7.880 1254 HB VAL 157 HB VAL 157 -16.390 7.845 -5.488 1255 HG11 VAL 157 HG11 VAL 157 -17.359 9.583 -4.025 1256 HG12 VAL 157 HG12 VAL 157 -15.697 9.995 -4.569 1257 HG13 VAL 157 HG13 VAL 157 -17.114 10.800 -5.324 1258 HG21 VAL 157 HG21 VAL 157 -18.834 8.222 -5.431 1259 HG22 VAL 157 HG22 VAL 157 -18.683 9.348 -6.822 1260 HG23 VAL 157 HG23 VAL 157 -18.275 7.610 -7.024 1261 HN1 EB4 158 HN1 EB4 158 4.013 -5.846 -6.596 1262 H8 EB4 158 H8 EB4 158 -1.680 -7.684 -4.018 1263 HN2 EB4 158 HN2 EB4 158 1.408 -5.460 -8.143 1264 H9 EB4 158 H9 EB4 158 1.102 -0.095 -2.434 1265 H10 EB4 158 H10 EB4 158 4.983 -7.318 -0.919 1266 HN3 EB4 158 HN3 EB4 158 3.636 -2.725 -7.035 1267 H7 EB4 158 H7 EB4 158 3.229 -5.554 -0.802 1268 H11 EB4 158 H11 EB4 158 -3.145 -8.273 -5.933 1269 H12 EB4 158 H12 EB4 158 2.230 1.842 -3.468 1270 H15 EB4 158 H15 EB4 158 3.652 1.524 -5.477 1271 H14 EB4 158 H14 EB4 158 -2.530 -7.544 -8.219 1272 H13 EB4 158 H13 EB4 158 5.922 -7.964 -3.112 1273 H22 EB4 158 H22 EB4 158 4.900 -6.597 -6.991 1274 H30 EB4 158 H30 EB4 158 6.217 -3.271 -9.646 1275 H30A EB4 158 H30A EB4 158 6.474 -2.656 -7.934 1276 H24 EB4 158 H24 EB4 158 4.115 -1.970 -7.878 1277 H28 EB4 158 H28 EB4 158 4.059 -8.452 -8.521 1278 H28A EB4 158 H28A EB4 158 4.816 -7.511 -9.901 1279 H23 EB4 158 H23 EB4 158 1.068 -5.573 -9.323 1280 H29 EB4 158 H29 EB4 158 0.732 -3.505 -10.407 1281 H29A EB4 158 H29A EB4 158 2.225 -3.870 -11.495 Start of MODEL 3 1 H1 MET 1 H1 MET 1 -29.098 3.899 -3.792 2 H2 MET 1 H2 MET 1 -28.787 5.468 -4.120 3 H3 MET 1 H3 MET 1 -29.529 4.533 -5.233 4 HA MET 1 HA MET 1 -27.249 3.191 -4.646 5 HB2 MET 1 HB2 MET 1 -28.090 4.933 -7.003 6 HB3 MET 1 HB3 MET 1 -26.563 4.041 -6.996 7 HG2 MET 1 HG2 MET 1 -27.886 1.913 -6.605 8 HG3 MET 1 HG3 MET 1 -29.370 2.856 -6.800 9 HE1 MET 1 HE1 MET 1 -29.343 3.948 -10.506 10 HE2 MET 1 HE2 MET 1 -29.991 4.195 -8.849 11 HE3 MET 1 HE3 MET 1 -28.432 4.949 -9.325 12 H THR 2 H THR 2 -24.968 3.763 -4.668 13 HA THR 2 HA THR 2 -23.261 4.943 -3.891 14 HB THR 2 HB THR 2 -24.324 7.312 -5.491 15 HG1 THR 2 HG1 THR 2 -23.449 6.182 -7.382 16 HG21 THR 2 HG21 THR 2 -21.933 7.541 -6.086 17 HG22 THR 2 HG22 THR 2 -22.170 7.554 -4.306 18 HG23 THR 2 HG23 THR 2 -21.551 6.077 -5.118 19 H VAL 3 H VAL 3 -25.395 4.978 -1.998 20 HA VAL 3 HA VAL 3 -25.733 7.715 -1.163 21 HB VAL 3 HB VAL 3 -26.998 6.715 0.732 22 HG11 VAL 3 HG11 VAL 3 -28.859 5.790 -0.616 23 HG12 VAL 3 HG12 VAL 3 -28.149 7.261 -1.365 24 HG13 VAL 3 HG13 VAL 3 -27.754 5.637 -2.023 25 HG21 VAL 3 HG21 VAL 3 -27.471 4.291 0.754 26 HG22 VAL 3 HG22 VAL 3 -26.297 4.056 -0.585 27 HG23 VAL 3 HG23 VAL 3 -25.729 4.644 1.014 28 HA PRO 4 HA PRO 4 -22.205 7.716 1.586 29 HB2 PRO 4 HB2 PRO 4 -23.051 9.654 3.386 30 HB3 PRO 4 HB3 PRO 4 -22.598 10.100 1.735 31 HG2 PRO 4 HG2 PRO 4 -25.358 9.642 2.900 32 HG3 PRO 4 HG3 PRO 4 -24.805 10.930 1.822 33 HD2 PRO 4 HD2 PRO 4 -26.183 8.758 0.888 34 HD3 PRO 4 HD3 PRO 4 -24.965 9.579 -0.096 35 H ASP 5 H ASP 5 -23.290 5.400 2.055 36 HA ASP 5 HA ASP 5 -24.137 5.373 4.887 37 HB2 ASP 5 HB2 ASP 5 -25.476 4.267 2.941 38 HB3 ASP 5 HB3 ASP 5 -24.183 3.060 2.917 39 H ARG 6 H ARG 6 -22.701 2.484 3.436 40 HA ARG 6 HA ARG 6 -20.779 2.325 5.448 41 HB2 ARG 6 HB2 ARG 6 -21.366 0.734 2.990 42 HB3 ARG 6 HB3 ARG 6 -19.805 0.519 3.793 43 HG2 ARG 6 HG2 ARG 6 -21.101 -1.093 4.864 44 HG3 ARG 6 HG3 ARG 6 -21.237 0.263 5.991 45 HD2 ARG 6 HD2 ARG 6 -23.449 -0.716 5.609 46 HD3 ARG 6 HD3 ARG 6 -23.402 0.925 4.950 47 HE ARG 6 HE ARG 6 -22.772 -0.528 2.748 48 HH11 ARG 6 HH11 ARG 6 -25.292 -0.947 5.157 49 HH12 ARG 6 HH12 ARG 6 -26.388 -1.712 4.055 50 HH21 ARG 6 HH21 ARG 6 -24.222 -1.536 1.310 51 HH22 ARG 6 HH22 ARG 6 -25.779 -2.048 1.868 52 H SER 7 H SER 7 -20.768 4.201 2.532 53 HA SER 7 HA SER 7 -18.263 4.004 1.504 54 HB2 SER 7 HB2 SER 7 -19.339 6.781 2.081 55 HB3 SER 7 HB3 SER 7 -18.784 6.100 0.547 56 HG SER 7 HG SER 7 -20.997 6.244 0.332 57 H GLU 8 H GLU 8 -19.151 5.571 4.659 58 HA GLU 8 HA GLU 8 -16.744 6.926 5.036 59 HB2 GLU 8 HB2 GLU 8 -18.625 5.755 7.116 60 HB3 GLU 8 HB3 GLU 8 -17.338 6.927 7.428 61 HG2 GLU 8 HG2 GLU 8 -18.565 8.384 5.601 62 HG3 GLU 8 HG3 GLU 8 -19.937 7.311 5.909 63 H ILE 9 H ILE 9 -17.457 3.467 5.216 64 HA ILE 9 HA ILE 9 -15.199 2.908 6.889 65 HB ILE 9 HB ILE 9 -16.896 0.951 5.272 66 HG12 ILE 9 HG12 ILE 9 -17.285 1.924 8.149 67 HG13 ILE 9 HG13 ILE 9 -18.248 2.478 6.773 68 HG21 ILE 9 HG21 ILE 9 -16.176 -0.649 7.016 69 HG22 ILE 9 HG22 ILE 9 -14.775 0.045 6.131 70 HG23 ILE 9 HG23 ILE 9 -15.178 0.635 7.779 71 HD11 ILE 9 HD11 ILE 9 -19.428 0.733 8.034 72 HD12 ILE 9 HD12 ILE 9 -19.037 0.162 6.376 73 HD13 ILE 9 HD13 ILE 9 -18.059 -0.400 7.774 74 H ALA 10 H ALA 10 -15.398 3.822 3.618 75 HA ALA 10 HA ALA 10 -12.852 2.448 3.081 76 HB1 ALA 10 HB1 ALA 10 -13.627 2.028 0.763 77 HB2 ALA 10 HB2 ALA 10 -14.629 1.150 1.966 78 HB3 ALA 10 HB3 ALA 10 -15.255 2.648 1.199 79 H GLY 11 H GLY 11 -12.167 3.504 0.645 80 HA2 GLY 11 HA2 GLY 11 -12.777 5.980 -0.131 81 HA3 GLY 11 HA3 GLY 11 -11.867 6.305 1.350 82 H LYS 12 H LYS 12 -10.219 7.384 0.064 83 HA LYS 12 HA LYS 12 -8.515 5.501 -1.428 84 HB2 LYS 12 HB2 LYS 12 -7.763 7.449 -2.726 85 HB3 LYS 12 HB3 LYS 12 -9.499 7.163 -2.908 86 HG2 LYS 12 HG2 LYS 12 -9.960 8.971 -1.242 87 HG3 LYS 12 HG3 LYS 12 -8.222 9.267 -1.094 88 HD2 LYS 12 HD2 LYS 12 -8.074 9.865 -3.483 89 HD3 LYS 12 HD3 LYS 12 -9.773 9.441 -3.729 90 HE2 LYS 12 HE2 LYS 12 -9.723 11.824 -3.508 91 HE3 LYS 12 HE3 LYS 12 -10.376 11.212 -1.983 92 HZ1 LYS 12 HZ1 LYS 12 -8.632 12.937 -1.776 93 HZ2 LYS 12 HZ2 LYS 12 -8.304 11.573 -0.941 94 HZ3 LYS 12 HZ3 LYS 12 -7.529 11.877 -2.346 95 H TRP 13 H TRP 13 -6.254 5.519 -1.017 96 HA TRP 13 HA TRP 13 -5.397 7.309 1.165 97 HB2 TRP 13 HB2 TRP 13 -4.586 4.390 0.805 98 HB3 TRP 13 HB3 TRP 13 -4.090 5.484 2.103 99 HD1 TRP 13 HD1 TRP 13 -6.347 2.709 1.611 100 HE1 TRP 13 HE1 TRP 13 -8.297 2.713 3.307 101 HE3 TRP 13 HE3 TRP 13 -5.950 7.553 3.278 102 HZ2 TRP 13 HZ2 TRP 13 -9.515 4.509 5.102 103 HZ3 TRP 13 HZ3 TRP 13 -7.558 8.350 4.996 104 HH2 TRP 13 HH2 TRP 13 -9.309 6.846 5.895 105 H TYR 14 H TYR 14 -3.167 8.040 0.945 106 HA TYR 14 HA TYR 14 -2.056 7.481 -1.731 107 HB2 TYR 14 HB2 TYR 14 -1.579 9.819 0.181 108 HB3 TYR 14 HB3 TYR 14 -0.854 9.627 -1.420 109 HD1 TYR 14 HD1 TYR 14 -4.217 9.802 0.268 110 HD2 TYR 14 HD2 TYR 14 -1.945 10.525 -3.303 111 HE1 TYR 14 HE1 TYR 14 -6.182 10.901 -0.753 112 HE2 TYR 14 HE2 TYR 14 -3.913 11.620 -4.334 113 HH TYR 14 HH TYR 14 -6.239 11.791 -4.162 114 H VAL 15 H VAL 15 -0.243 6.102 -1.837 115 HA VAL 15 HA VAL 15 1.080 5.629 0.757 116 HB VAL 15 HB VAL 15 0.489 3.768 -0.757 117 HG11 VAL 15 HG11 VAL 15 1.642 3.398 -2.944 118 HG12 VAL 15 HG12 VAL 15 0.561 4.832 -2.948 119 HG13 VAL 15 HG13 VAL 15 2.340 5.049 -2.826 120 HG21 VAL 15 HG21 VAL 15 2.692 2.632 -0.938 121 HG22 VAL 15 HG22 VAL 15 3.498 4.201 -0.601 122 HG23 VAL 15 HG23 VAL 15 2.442 3.449 0.642 123 H VAL 16 H VAL 16 2.472 7.096 1.362 124 HA VAL 16 HA VAL 16 4.129 8.455 -0.638 125 HB VAL 16 HB VAL 16 4.523 10.169 1.082 126 HG11 VAL 16 HG11 VAL 16 2.253 11.142 1.231 127 HG12 VAL 16 HG12 VAL 16 2.614 10.492 -0.404 128 HG13 VAL 16 HG13 VAL 16 1.556 9.570 0.715 129 HG21 VAL 16 HG21 VAL 16 3.264 10.149 3.222 130 HG22 VAL 16 HG22 VAL 16 2.643 8.511 2.827 131 HG23 VAL 16 HG23 VAL 16 4.401 8.766 3.088 132 H ALA 17 H ALA 17 4.271 5.735 1.209 133 HA ALA 17 HA ALA 17 7.163 6.028 1.555 134 HB1 ALA 17 HB1 ALA 17 7.068 5.002 3.771 135 HB2 ALA 17 HB2 ALA 17 6.157 6.550 3.750 136 HB3 ALA 17 HB3 ALA 17 5.297 5.001 3.698 137 H LEU 18 H LEU 18 8.290 3.958 1.496 138 HA LEU 18 HA LEU 18 6.691 1.605 0.979 139 HB2 LEU 18 HB2 LEU 18 8.560 2.821 -1.118 140 HB3 LEU 18 HB3 LEU 18 7.825 1.215 -1.217 141 HG LEU 18 HG LEU 18 6.029 3.624 -0.936 142 HD11 LEU 18 HD11 LEU 18 6.004 3.886 -3.394 143 HD12 LEU 18 HD12 LEU 18 7.615 4.262 -2.695 144 HD13 LEU 18 HD13 LEU 18 7.341 2.695 -3.529 145 HD21 LEU 18 HD21 LEU 18 4.536 2.224 -2.324 146 HD22 LEU 18 HD22 LEU 18 5.812 0.963 -2.415 147 HD23 LEU 18 HD23 LEU 18 5.063 1.370 -0.834 148 H ALA 19 H ALA 19 7.930 -0.372 1.103 149 HA ALA 19 HA ALA 19 10.821 -0.100 1.603 150 HB1 ALA 19 HB1 ALA 19 10.611 -1.479 3.634 151 HB2 ALA 19 HB2 ALA 19 9.744 0.081 3.827 152 HB3 ALA 19 HB3 ALA 19 8.821 -1.424 3.501 153 H SER 20 H SER 20 11.870 -1.883 0.593 154 HA SER 20 HA SER 20 10.100 -4.144 -0.110 155 HB2 SER 20 HB2 SER 20 12.237 -2.840 -1.906 156 HB3 SER 20 HB3 SER 20 11.222 -4.225 -2.331 157 HG SER 20 HG SER 20 10.645 -1.738 -2.849 158 H ASN 21 H ASN 21 11.036 -6.200 -0.101 159 HA ASN 21 HA ASN 21 13.533 -6.333 1.413 160 HB2 ASN 21 HB2 ASN 21 11.222 -7.629 1.803 161 HB3 ASN 21 HB3 ASN 21 11.842 -8.705 0.543 162 HD21 ASN 21 HD21 ASN 21 14.572 -8.838 1.139 163 HD22 ASN 21 HD22 ASN 21 14.779 -9.591 2.686 164 H THR 22 H THR 22 12.466 -6.514 -1.925 165 HA THR 22 HA THR 22 14.825 -8.112 -2.580 166 HB THR 22 HB THR 22 13.638 -7.880 -4.961 167 HG1 THR 22 HG1 THR 22 11.466 -7.422 -4.798 168 HG21 THR 22 HG21 THR 22 12.381 -9.952 -4.412 169 HG22 THR 22 HG22 THR 22 14.012 -9.977 -3.661 170 HG23 THR 22 HG23 THR 22 12.568 -9.607 -2.659 171 H GLU 23 H GLU 23 16.617 -7.378 -3.678 172 HA GLU 23 HA GLU 23 17.343 -4.756 -3.599 173 HB2 GLU 23 HB2 GLU 23 18.113 -6.534 -5.960 174 HB3 GLU 23 HB3 GLU 23 19.131 -5.403 -5.060 175 HG2 GLU 23 HG2 GLU 23 18.061 -8.001 -3.875 176 HG3 GLU 23 HG3 GLU 23 19.613 -7.877 -4.714 177 H PHE 24 H PHE 24 15.905 -6.516 -6.479 178 HA PHE 24 HA PHE 24 16.001 -4.424 -8.258 179 HB2 PHE 24 HB2 PHE 24 13.965 -6.682 -7.912 180 HB3 PHE 24 HB3 PHE 24 13.987 -5.607 -9.315 181 HD1 PHE 24 HD1 PHE 24 15.935 -5.624 -10.874 182 HD2 PHE 24 HD2 PHE 24 15.551 -8.464 -7.676 183 HE1 PHE 24 HE1 PHE 24 17.615 -7.078 -11.967 184 HE2 PHE 24 HE2 PHE 24 17.234 -9.919 -8.764 185 HZ PHE 24 HZ PHE 24 18.270 -9.229 -10.915 186 H PHE 25 H PHE 25 13.185 -5.264 -6.042 187 HA PHE 25 HA PHE 25 11.540 -3.221 -6.918 188 HB2 PHE 25 HB2 PHE 25 11.800 -4.780 -4.346 189 HB3 PHE 25 HB3 PHE 25 10.701 -3.395 -4.411 190 HD1 PHE 25 HD1 PHE 25 11.560 -6.518 -6.321 191 HD2 PHE 25 HD2 PHE 25 8.531 -3.693 -5.196 192 HE1 PHE 25 HE1 PHE 25 9.845 -7.929 -7.414 193 HE2 PHE 25 HE2 PHE 25 6.812 -5.098 -6.291 194 HZ PHE 25 HZ PHE 25 7.464 -7.222 -7.398 195 H LEU 26 H LEU 26 14.078 -3.119 -4.299 196 HA LEU 26 HA LEU 26 13.521 -0.494 -3.466 197 HB2 LEU 26 HB2 LEU 26 16.193 -1.972 -3.575 198 HB3 LEU 26 HB3 LEU 26 15.811 -0.569 -2.568 199 HG LEU 26 HG LEU 26 14.536 -3.328 -2.325 200 HD11 LEU 26 HD11 LEU 26 15.802 -3.470 -0.211 201 HD12 LEU 26 HD12 LEU 26 16.886 -3.319 -1.635 202 HD13 LEU 26 HD13 LEU 26 16.587 -1.897 -0.580 203 HD21 LEU 26 HD21 LEU 26 13.562 -2.438 -0.235 204 HD22 LEU 26 HD22 LEU 26 14.249 -0.821 -0.609 205 HD23 LEU 26 HD23 LEU 26 12.994 -1.533 -1.678 206 H ARG 27 H ARG 27 15.754 -1.848 -5.993 207 HA ARG 27 HA ARG 27 16.937 0.581 -6.704 208 HB2 ARG 27 HB2 ARG 27 17.552 -1.890 -7.295 209 HB3 ARG 27 HB3 ARG 27 16.414 -1.701 -8.635 210 HG2 ARG 27 HG2 ARG 27 17.803 0.497 -9.154 211 HG3 ARG 27 HG3 ARG 27 19.042 -0.266 -8.150 212 HD2 ARG 27 HD2 ARG 27 19.539 -0.951 -10.377 213 HD3 ARG 27 HD3 ARG 27 18.787 -2.360 -9.618 214 HE ARG 27 HE ARG 27 16.627 -1.210 -10.749 215 HH11 ARG 27 HH11 ARG 27 19.836 -1.747 -12.080 216 HH12 ARG 27 HH12 ARG 27 19.259 -1.913 -13.704 217 HH21 ARG 27 HH21 ARG 27 15.888 -1.429 -12.862 218 HH22 ARG 27 HH22 ARG 27 17.006 -1.731 -14.150 219 H GLU 28 H GLU 28 14.021 -1.170 -8.059 220 HA GLU 28 HA GLU 28 13.584 0.816 -10.037 221 HB2 GLU 28 HB2 GLU 28 11.569 -1.178 -8.914 222 HB3 GLU 28 HB3 GLU 28 11.523 -0.370 -10.487 223 HG2 GLU 28 HG2 GLU 28 13.427 -2.559 -9.561 224 HG3 GLU 28 HG3 GLU 28 12.218 -2.640 -10.849 225 H LYS 29 H LYS 29 11.843 0.066 -6.875 226 HA LYS 29 HA LYS 29 10.030 2.120 -7.079 227 HB2 LYS 29 HB2 LYS 29 11.157 0.453 -4.887 228 HB3 LYS 29 HB3 LYS 29 10.453 1.992 -4.375 229 HG2 LYS 29 HG2 LYS 29 8.943 0.096 -6.221 230 HG3 LYS 29 HG3 LYS 29 8.922 -0.114 -4.465 231 HD2 LYS 29 HD2 LYS 29 6.992 1.206 -4.978 232 HD3 LYS 29 HD3 LYS 29 8.164 2.329 -4.276 233 HE2 LYS 29 HE2 LYS 29 7.823 3.620 -6.103 234 HE3 LYS 29 HE3 LYS 29 8.795 2.440 -6.992 235 HZ1 LYS 29 HZ1 LYS 29 6.982 2.128 -8.196 236 HZ2 LYS 29 HZ2 LYS 29 6.295 1.363 -6.928 237 HZ3 LYS 29 HZ3 LYS 29 6.015 2.953 -7.172 238 H ASP 30 H ASP 30 13.364 2.298 -5.548 239 HA ASP 30 HA ASP 30 13.112 4.920 -4.672 240 HB2 ASP 30 HB2 ASP 30 14.995 3.716 -3.913 241 HB3 ASP 30 HB3 ASP 30 15.467 3.219 -5.543 242 H LYS 31 H LYS 31 13.716 3.606 -7.974 243 HA LYS 31 HA LYS 31 14.451 6.186 -8.961 244 HB2 LYS 31 HB2 LYS 31 13.946 3.488 -10.242 245 HB3 LYS 31 HB3 LYS 31 14.142 4.951 -11.216 246 HG2 LYS 31 HG2 LYS 31 16.175 3.823 -9.227 247 HG3 LYS 31 HG3 LYS 31 16.277 3.735 -10.991 248 HD2 LYS 31 HD2 LYS 31 17.596 5.605 -10.652 249 HD3 LYS 31 HD3 LYS 31 16.026 6.404 -10.810 250 HE2 LYS 31 HE2 LYS 31 16.737 5.481 -8.046 251 HE3 LYS 31 HE3 LYS 31 17.752 6.773 -8.703 252 HZ1 LYS 31 HZ1 LYS 31 16.138 8.161 -8.190 253 HZ2 LYS 31 HZ2 LYS 31 15.121 7.442 -9.247 254 HZ3 LYS 31 HZ3 LYS 31 15.156 6.956 -7.688 255 H MET 32 H MET 32 11.199 4.450 -8.418 256 HA MET 32 HA MET 32 10.368 6.367 -10.546 257 HB2 MET 32 HB2 MET 32 8.961 4.307 -8.534 258 HB3 MET 32 HB3 MET 32 8.104 5.014 -9.910 259 HG2 MET 32 HG2 MET 32 10.488 3.090 -10.145 260 HG3 MET 32 HG3 MET 32 8.791 2.612 -10.273 261 HE1 MET 32 HE1 MET 32 10.934 3.005 -13.889 262 HE2 MET 32 HE2 MET 32 11.749 3.085 -12.290 263 HE3 MET 32 HE3 MET 32 10.555 1.786 -12.625 264 H LYS 33 H LYS 33 7.602 6.104 -8.520 265 HA LYS 33 HA LYS 33 8.436 8.323 -6.785 266 HB2 LYS 33 HB2 LYS 33 6.351 8.816 -8.993 267 HB3 LYS 33 HB3 LYS 33 6.645 9.899 -7.626 268 HG2 LYS 33 HG2 LYS 33 8.775 10.553 -8.429 269 HG3 LYS 33 HG3 LYS 33 8.919 9.145 -9.491 270 HD2 LYS 33 HD2 LYS 33 6.925 10.075 -10.820 271 HD3 LYS 33 HD3 LYS 33 7.060 11.549 -9.852 272 HE2 LYS 33 HE2 LYS 33 9.292 11.999 -10.660 273 HE3 LYS 33 HE3 LYS 33 9.449 10.381 -11.356 274 HZ1 LYS 33 HZ1 LYS 33 8.958 12.019 -13.027 275 HZ2 LYS 33 HZ2 LYS 33 7.716 10.963 -12.927 276 HZ3 LYS 33 HZ3 LYS 33 7.572 12.458 -12.284 277 H MET 34 H MET 34 6.000 9.260 -5.853 278 HA MET 34 HA MET 34 5.212 7.063 -4.240 279 HB2 MET 34 HB2 MET 34 5.056 9.385 -3.447 280 HB3 MET 34 HB3 MET 34 4.125 9.878 -4.867 281 HG2 MET 34 HG2 MET 34 2.222 8.424 -4.060 282 HG3 MET 34 HG3 MET 34 3.153 8.079 -2.597 283 HE1 MET 34 HE1 MET 34 1.362 12.191 -3.773 284 HE2 MET 34 HE2 MET 34 2.939 11.706 -4.481 285 HE3 MET 34 HE3 MET 34 1.468 10.729 -4.809 286 H ALA 35 H ALA 35 3.160 6.035 -4.140 287 HA ALA 35 HA ALA 35 1.768 5.831 -6.699 288 HB1 ALA 35 HB1 ALA 35 1.238 3.516 -6.085 289 HB2 ALA 35 HB2 ALA 35 2.999 3.823 -6.257 290 HB3 ALA 35 HB3 ALA 35 2.266 3.687 -4.623 291 H MET 36 H MET 36 -0.514 4.591 -6.210 292 HA MET 36 HA MET 36 -1.775 6.215 -4.092 293 HB2 MET 36 HB2 MET 36 -2.789 5.453 -6.896 294 HB3 MET 36 HB3 MET 36 -3.788 6.225 -5.658 295 HG2 MET 36 HG2 MET 36 -1.206 7.560 -6.446 296 HG3 MET 36 HG3 MET 36 -2.561 7.615 -7.581 297 HE1 MET 36 HE1 MET 36 -2.224 11.108 -5.495 298 HE2 MET 36 HE2 MET 36 -0.919 9.938 -5.890 299 HE3 MET 36 HE3 MET 36 -2.111 10.413 -7.148 300 H ALA 37 H ALA 37 -4.011 5.229 -3.453 301 HA ALA 37 HA ALA 37 -4.404 2.420 -4.077 302 HB1 ALA 37 HB1 ALA 37 -4.156 1.740 -1.678 303 HB2 ALA 37 HB2 ALA 37 -2.596 2.353 -2.323 304 HB3 ALA 37 HB3 ALA 37 -3.601 3.397 -1.261 305 H ARG 38 H ARG 38 -6.560 2.219 -4.209 306 HA ARG 38 HA ARG 38 -8.309 3.783 -2.386 307 HB2 ARG 38 HB2 ARG 38 -8.373 4.858 -4.573 308 HB3 ARG 38 HB3 ARG 38 -8.525 3.300 -5.396 309 HG2 ARG 38 HG2 ARG 38 -10.770 2.969 -4.343 310 HG3 ARG 38 HG3 ARG 38 -10.618 4.536 -3.536 311 HD2 ARG 38 HD2 ARG 38 -10.512 5.710 -5.677 312 HD3 ARG 38 HD3 ARG 38 -10.409 4.186 -6.568 313 HE ARG 38 HE ARG 38 -12.808 4.067 -5.115 314 HH11 ARG 38 HH11 ARG 38 -11.386 6.158 -7.555 315 HH12 ARG 38 HH12 ARG 38 -12.908 6.560 -8.276 316 HH21 ARG 38 HH21 ARG 38 -14.801 4.599 -6.070 317 HH22 ARG 38 HH22 ARG 38 -14.855 5.671 -7.429 318 H ILE 39 H ILE 39 -9.605 2.332 -1.246 319 HA ILE 39 HA ILE 39 -9.718 -0.370 -2.337 320 HB ILE 39 HB ILE 39 -10.144 0.419 0.578 321 HG12 ILE 39 HG12 ILE 39 -7.902 1.099 -0.001 322 HG13 ILE 39 HG13 ILE 39 -7.846 -0.353 1.006 323 HG21 ILE 39 HG21 ILE 39 -9.686 -1.985 0.982 324 HG22 ILE 39 HG22 ILE 39 -11.106 -1.742 -0.090 325 HG23 ILE 39 HG23 ILE 39 -9.530 -2.245 -0.788 326 HD11 ILE 39 HD11 ILE 39 -6.199 -0.471 -0.808 327 HD12 ILE 39 HD12 ILE 39 -7.448 -1.748 -1.002 328 HD13 ILE 39 HD13 ILE 39 -7.505 -0.273 -2.025 329 H SER 40 H SER 40 -11.717 -1.583 -2.261 330 HA SER 40 HA SER 40 -14.088 -0.028 -1.475 331 HB2 SER 40 HB2 SER 40 -13.793 -1.594 -4.084 332 HB3 SER 40 HB3 SER 40 -15.215 -0.692 -3.543 333 HG SER 40 HG SER 40 -13.906 0.536 -5.044 334 H PHE 41 H PHE 41 -15.578 -1.235 -0.303 335 HA PHE 41 HA PHE 41 -14.832 -3.948 0.307 336 HB2 PHE 41 HB2 PHE 41 -16.903 -3.838 1.758 337 HB3 PHE 41 HB3 PHE 41 -15.621 -2.682 2.142 338 HD1 PHE 41 HD1 PHE 41 -19.045 -3.088 0.838 339 HD2 PHE 41 HD2 PHE 41 -15.935 -0.282 1.785 340 HE1 PHE 41 HE1 PHE 41 -20.681 -1.235 0.714 341 HE2 PHE 41 HE2 PHE 41 -17.568 1.575 1.659 342 HZ PHE 41 HZ PHE 41 -19.947 1.102 1.126 343 H LEU 42 H LEU 42 -15.255 -5.570 -1.131 344 HA LEU 42 HA LEU 42 -17.388 -5.345 -3.020 345 HB2 LEU 42 HB2 LEU 42 -15.080 -6.599 -3.160 346 HB3 LEU 42 HB3 LEU 42 -15.884 -7.881 -2.244 347 HG LEU 42 HG LEU 42 -15.861 -8.401 -4.616 348 HD11 LEU 42 HD11 LEU 42 -18.272 -8.796 -4.987 349 HD12 LEU 42 HD12 LEU 42 -17.771 -9.188 -3.307 350 HD13 LEU 42 HD13 LEU 42 -18.656 -7.663 -3.647 351 HD21 LEU 42 HD21 LEU 42 -17.115 -7.039 -6.258 352 HD22 LEU 42 HD22 LEU 42 -17.435 -5.813 -4.985 353 HD23 LEU 42 HD23 LEU 42 -15.751 -6.129 -5.525 354 H GLY 43 H GLY 43 -16.791 -7.178 0.028 355 HA2 GLY 43 HA2 GLY 43 -19.612 -7.592 0.461 356 HA3 GLY 43 HA3 GLY 43 -18.704 -9.053 0.053 357 H GLU 44 H GLU 44 -19.634 -9.305 2.519 358 HA GLU 44 HA GLU 44 -18.197 -7.971 4.549 359 HB2 GLU 44 HB2 GLU 44 -19.585 -10.691 4.494 360 HB3 GLU 44 HB3 GLU 44 -18.972 -9.914 5.959 361 HG2 GLU 44 HG2 GLU 44 -20.454 -7.905 5.384 362 HG3 GLU 44 HG3 GLU 44 -21.175 -8.896 4.110 363 H ASP 45 H ASP 45 -17.437 -10.918 2.566 364 HA ASP 45 HA ASP 45 -14.902 -11.125 4.068 365 HB2 ASP 45 HB2 ASP 45 -16.417 -13.095 4.319 366 HB3 ASP 45 HB3 ASP 45 -16.489 -13.270 2.560 367 H GLU 46 H GLU 46 -16.117 -9.825 1.222 368 HA GLU 46 HA GLU 46 -13.605 -10.472 -0.193 369 HB2 GLU 46 HB2 GLU 46 -15.542 -11.630 -1.217 370 HB3 GLU 46 HB3 GLU 46 -16.365 -10.077 -1.411 371 HG2 GLU 46 HG2 GLU 46 -14.787 -9.306 -3.028 372 HG3 GLU 46 HG3 GLU 46 -13.613 -10.561 -2.611 373 H LEU 47 H LEU 47 -12.676 -8.744 -1.417 374 HA LEU 47 HA LEU 47 -13.861 -6.159 -1.154 375 HB2 LEU 47 HB2 LEU 47 -11.939 -5.107 -0.104 376 HB3 LEU 47 HB3 LEU 47 -12.765 -6.261 0.952 377 HG LEU 47 HG LEU 47 -10.314 -7.058 -0.647 378 HD11 LEU 47 HD11 LEU 47 -8.969 -6.534 1.352 379 HD12 LEU 47 HD12 LEU 47 -9.723 -5.063 0.651 380 HD13 LEU 47 HD13 LEU 47 -10.414 -5.808 2.132 381 HD21 LEU 47 HD21 LEU 47 -10.100 -8.724 1.164 382 HD22 LEU 47 HD22 LEU 47 -11.584 -8.072 1.936 383 HD23 LEU 47 HD23 LEU 47 -11.682 -8.854 0.323 384 H LYS 48 H LYS 48 -12.859 -4.462 -2.421 385 HA LYS 48 HA LYS 48 -11.161 -5.562 -4.558 386 HB2 LYS 48 HB2 LYS 48 -13.354 -5.071 -5.406 387 HB3 LYS 48 HB3 LYS 48 -13.355 -3.475 -4.644 388 HG2 LYS 48 HG2 LYS 48 -11.272 -2.954 -6.105 389 HG3 LYS 48 HG3 LYS 48 -11.669 -4.427 -7.000 390 HD2 LYS 48 HD2 LYS 48 -13.843 -2.369 -6.490 391 HD3 LYS 48 HD3 LYS 48 -12.646 -2.064 -7.757 392 HE2 LYS 48 HE2 LYS 48 -14.251 -4.662 -7.578 393 HE3 LYS 48 HE3 LYS 48 -14.810 -3.250 -8.483 394 HZ1 LYS 48 HZ1 LYS 48 -13.624 -4.108 -10.130 395 HZ2 LYS 48 HZ2 LYS 48 -12.276 -3.608 -9.357 396 HZ3 LYS 48 HZ3 LYS 48 -12.800 -5.143 -9.174 397 H VAL 49 H VAL 49 -9.279 -4.301 -5.131 398 HA VAL 49 HA VAL 49 -8.996 -1.788 -3.628 399 HB VAL 49 HB VAL 49 -6.601 -2.287 -3.319 400 HG11 VAL 49 HG11 VAL 49 -6.873 -3.999 -1.547 401 HG12 VAL 49 HG12 VAL 49 -8.205 -2.794 -1.523 402 HG13 VAL 49 HG13 VAL 49 -8.484 -4.427 -2.216 403 HG21 VAL 49 HG21 VAL 49 -5.749 -4.577 -3.664 404 HG22 VAL 49 HG22 VAL 49 -7.311 -5.041 -4.420 405 HG23 VAL 49 HG23 VAL 49 -6.263 -3.811 -5.205 406 H SER 50 H SER 50 -8.229 -0.042 -4.892 407 HA SER 50 HA SER 50 -7.470 -0.724 -7.678 408 HB2 SER 50 HB2 SER 50 -9.613 0.636 -7.186 409 HB3 SER 50 HB3 SER 50 -8.561 1.903 -6.542 410 HG SER 50 HG SER 50 -9.084 2.242 -8.786 411 H TYR 51 H TYR 51 -5.358 -0.417 -8.138 412 HA TYR 51 HA TYR 51 -3.782 1.269 -6.333 413 HB2 TYR 51 HB2 TYR 51 -3.270 -1.127 -8.124 414 HB3 TYR 51 HB3 TYR 51 -1.941 0.006 -7.845 415 HD1 TYR 51 HD1 TYR 51 -1.947 0.709 -5.093 416 HD2 TYR 51 HD2 TYR 51 -3.074 -3.037 -6.860 417 HE1 TYR 51 HE1 TYR 51 -1.347 -0.462 -2.995 418 HE2 TYR 51 HE2 TYR 51 -2.505 -4.203 -4.758 419 HH TYR 51 HH TYR 51 -1.717 -4.036 -2.719 420 H ALA 52 H ALA 52 -2.480 2.954 -7.173 421 HA ALA 52 HA ALA 52 -2.651 3.410 -10.083 422 HB1 ALA 52 HB1 ALA 52 -2.986 5.806 -9.642 423 HB2 ALA 52 HB2 ALA 52 -4.353 4.818 -9.026 424 HB3 ALA 52 HB3 ALA 52 -3.127 5.466 -7.885 425 H VAL 53 H VAL 53 -0.554 3.509 -10.862 426 HA VAL 53 HA VAL 53 1.402 4.762 -9.094 427 HB VAL 53 HB VAL 53 3.101 3.060 -9.846 428 HG11 VAL 53 HG11 VAL 53 2.338 1.265 -8.318 429 HG12 VAL 53 HG12 VAL 53 2.044 2.900 -7.635 430 HG13 VAL 53 HG13 VAL 53 0.683 1.962 -8.336 431 HG21 VAL 53 HG21 VAL 53 2.303 0.903 -10.752 432 HG22 VAL 53 HG22 VAL 53 0.644 1.579 -10.884 433 HG23 VAL 53 HG23 VAL 53 1.976 2.268 -11.873 434 HA PRO 54 HA PRO 54 2.428 6.795 -12.953 435 HB2 PRO 54 HB2 PRO 54 4.550 8.268 -12.012 436 HB3 PRO 54 HB3 PRO 54 2.920 8.639 -11.434 437 HG2 PRO 54 HG2 PRO 54 5.112 7.048 -10.085 438 HG3 PRO 54 HG3 PRO 54 3.994 8.225 -9.383 439 HD2 PRO 54 HD2 PRO 54 3.640 5.471 -9.209 440 HD3 PRO 54 HD3 PRO 54 2.316 6.637 -9.081 441 H LYS 55 H LYS 55 3.075 5.236 -14.335 442 HA LYS 55 HA LYS 55 5.773 4.176 -14.084 443 HB2 LYS 55 HB2 LYS 55 3.717 2.674 -14.334 444 HB3 LYS 55 HB3 LYS 55 3.616 3.261 -15.999 445 HG2 LYS 55 HG2 LYS 55 6.010 2.468 -16.350 446 HG3 LYS 55 HG3 LYS 55 5.956 1.749 -14.736 447 HD2 LYS 55 HD2 LYS 55 3.930 0.413 -15.426 448 HD3 LYS 55 HD3 LYS 55 4.056 1.097 -17.052 449 HE2 LYS 55 HE2 LYS 55 5.171 -0.966 -17.262 450 HE3 LYS 55 HE3 LYS 55 6.500 0.182 -17.053 451 HZ1 LYS 55 HZ1 LYS 55 6.764 -1.741 -15.653 452 HZ2 LYS 55 HZ2 LYS 55 6.561 -0.419 -14.717 453 HZ3 LYS 55 HZ3 LYS 55 5.334 -1.478 -14.910 454 HA PRO 56 HA PRO 56 7.510 6.778 -17.257 455 HB2 PRO 56 HB2 PRO 56 8.266 4.086 -18.545 456 HB3 PRO 56 HB3 PRO 56 9.316 5.479 -18.256 457 HG2 PRO 56 HG2 PRO 56 9.478 3.344 -16.660 458 HG3 PRO 56 HG3 PRO 56 9.605 4.969 -15.972 459 HD2 PRO 56 HD2 PRO 56 7.306 3.020 -15.839 460 HD3 PRO 56 HD3 PRO 56 7.821 4.224 -14.650 461 H ASN 57 H ASN 57 5.492 3.905 -18.147 462 HA ASN 57 HA ASN 57 4.985 5.011 -20.768 463 HB2 ASN 57 HB2 ASN 57 3.421 2.746 -19.469 464 HB3 ASN 57 HB3 ASN 57 3.807 2.989 -21.177 465 HD21 ASN 57 HD21 ASN 57 5.805 2.278 -21.994 466 HD22 ASN 57 HD22 ASN 57 6.893 1.290 -21.077 467 H GLY 58 H GLY 58 3.934 6.030 -17.753 468 HA2 GLY 58 HA2 GLY 58 2.243 7.789 -17.924 469 HA3 GLY 58 HA3 GLY 58 1.238 6.640 -18.818 470 H CYS 59 H CYS 59 -0.080 7.638 -16.711 471 HA CYS 59 HA CYS 59 0.448 6.472 -14.212 472 HB2 CYS 59 HB2 CYS 59 -2.123 7.513 -15.485 473 HB3 CYS 59 HB3 CYS 59 -1.989 7.021 -13.792 474 H ARG 60 H ARG 60 0.378 4.315 -13.632 475 HA ARG 60 HA ARG 60 -1.368 2.578 -15.270 476 HB2 ARG 60 HB2 ARG 60 1.114 2.099 -15.095 477 HB3 ARG 60 HB3 ARG 60 0.934 1.949 -13.342 478 HG2 ARG 60 HG2 ARG 60 0.952 -0.274 -14.158 479 HG3 ARG 60 HG3 ARG 60 -0.744 0.062 -13.787 480 HD2 ARG 60 HD2 ARG 60 0.473 0.379 -16.577 481 HD3 ARG 60 HD3 ARG 60 -0.315 -1.102 -16.017 482 HE ARG 60 HE ARG 60 -1.627 1.462 -16.665 483 HH11 ARG 60 HH11 ARG 60 -1.926 -1.789 -15.360 484 HH12 ARG 60 HH12 ARG 60 -3.651 -1.824 -15.513 485 HH21 ARG 60 HH21 ARG 60 -3.896 1.400 -16.863 486 HH22 ARG 60 HH22 ARG 60 -4.772 -0.010 -16.367 487 H LYS 61 H LYS 61 -3.240 1.855 -14.373 488 HA LYS 61 HA LYS 61 -3.420 1.876 -11.428 489 HB2 LYS 61 HB2 LYS 61 -5.645 2.647 -11.537 490 HB3 LYS 61 HB3 LYS 61 -4.777 3.674 -12.685 491 HG2 LYS 61 HG2 LYS 61 -5.843 2.772 -14.534 492 HG3 LYS 61 HG3 LYS 61 -6.049 1.182 -13.789 493 HD2 LYS 61 HD2 LYS 61 -7.727 2.328 -12.171 494 HD3 LYS 61 HD3 LYS 61 -7.665 3.720 -13.260 495 HE2 LYS 61 HE2 LYS 61 -9.546 2.394 -13.954 496 HE3 LYS 61 HE3 LYS 61 -8.289 2.161 -15.176 497 HZ1 LYS 61 HZ1 LYS 61 -9.360 0.100 -14.464 498 HZ2 LYS 61 HZ2 LYS 61 -7.750 0.068 -14.190 499 HZ3 LYS 61 HZ3 LYS 61 -8.785 0.294 -12.948 500 H TRP 62 H TRP 62 -4.546 0.055 -10.497 501 HA TRP 62 HA TRP 62 -5.699 -1.903 -12.304 502 HB2 TRP 62 HB2 TRP 62 -3.093 -2.242 -12.133 503 HB3 TRP 62 HB3 TRP 62 -3.421 -2.774 -10.479 504 HD1 TRP 62 HD1 TRP 62 -3.510 -5.351 -10.368 505 HE1 TRP 62 HE1 TRP 62 -4.391 -7.249 -11.887 506 HE3 TRP 62 HE3 TRP 62 -5.206 -2.514 -14.301 507 HZ2 TRP 62 HZ2 TRP 62 -5.630 -7.523 -14.398 508 HZ3 TRP 62 HZ3 TRP 62 -6.238 -3.671 -16.238 509 HH2 TRP 62 HH2 TRP 62 -6.446 -6.141 -16.283 510 H GLU 63 H GLU 63 -7.161 -3.283 -11.180 511 HA GLU 63 HA GLU 63 -7.299 -2.847 -8.271 512 HB2 GLU 63 HB2 GLU 63 -9.815 -2.801 -8.523 513 HB3 GLU 63 HB3 GLU 63 -8.981 -1.365 -9.131 514 HG2 GLU 63 HG2 GLU 63 -9.770 -3.635 -10.996 515 HG3 GLU 63 HG3 GLU 63 -10.929 -2.384 -10.528 516 H THR 64 H THR 64 -7.536 -4.695 -7.146 517 HA THR 64 HA THR 64 -8.323 -7.083 -8.649 518 HB THR 64 HB THR 64 -6.767 -8.248 -6.866 519 HG1 THR 64 HG1 THR 64 -6.046 -6.615 -5.578 520 HG21 THR 64 HG21 THR 64 -4.834 -8.045 -8.397 521 HG22 THR 64 HG22 THR 64 -6.372 -8.265 -9.297 522 HG23 THR 64 HG23 THR 64 -5.617 -6.639 -9.195 523 H THR 65 H THR 65 -9.274 -8.850 -7.270 524 HA THR 65 HA THR 65 -10.840 -7.634 -5.100 525 HB THR 65 HB THR 65 -11.233 -10.397 -6.314 526 HG1 THR 65 HG1 THR 65 -12.679 -9.309 -7.857 527 HG21 THR 65 HG21 THR 65 -13.595 -9.941 -5.729 528 HG22 THR 65 HG22 THR 65 -12.521 -9.790 -4.298 529 HG23 THR 65 HG23 THR 65 -13.130 -8.316 -5.123 530 H PHE 66 H PHE 66 -10.326 -8.150 -2.973 531 HA PHE 66 HA PHE 66 -8.462 -10.406 -2.583 532 HB2 PHE 66 HB2 PHE 66 -8.983 -7.828 -1.005 533 HB3 PHE 66 HB3 PHE 66 -8.005 -9.162 -0.380 534 HD1 PHE 66 HD1 PHE 66 -7.450 -9.110 -3.838 535 HD2 PHE 66 HD2 PHE 66 -6.501 -6.928 -0.264 536 HE1 PHE 66 HE1 PHE 66 -5.451 -8.167 -4.949 537 HE2 PHE 66 HE2 PHE 66 -4.497 -5.983 -1.372 538 HZ PHE 66 HZ PHE 66 -3.969 -6.600 -3.719 539 H LYS 67 H LYS 67 -8.698 -11.316 -0.201 540 HA LYS 67 HA LYS 67 -11.582 -11.670 0.304 541 HB2 LYS 67 HB2 LYS 67 -9.264 -13.593 0.147 542 HB3 LYS 67 HB3 LYS 67 -10.507 -13.904 1.366 543 HG2 LYS 67 HG2 LYS 67 -10.991 -15.140 -0.699 544 HG3 LYS 67 HG3 LYS 67 -12.255 -13.943 -0.385 545 HD2 LYS 67 HD2 LYS 67 -10.797 -12.362 -1.925 546 HD3 LYS 67 HD3 LYS 67 -10.036 -13.865 -2.465 547 HE2 LYS 67 HE2 LYS 67 -12.136 -14.765 -3.253 548 HE3 LYS 67 HE3 LYS 67 -13.069 -13.507 -2.431 549 HZ1 LYS 67 HZ1 LYS 67 -12.981 -12.693 -4.526 550 HZ2 LYS 67 HZ2 LYS 67 -11.627 -11.982 -3.954 551 HZ3 LYS 67 HZ3 LYS 67 -11.517 -13.322 -4.881 552 H LYS 68 H LYS 68 -12.276 -11.749 2.492 553 HA LYS 68 HA LYS 68 -10.802 -10.125 4.235 554 HB2 LYS 68 HB2 LYS 68 -13.210 -10.198 4.397 555 HB3 LYS 68 HB3 LYS 68 -13.224 -11.959 4.560 556 HG2 LYS 68 HG2 LYS 68 -13.678 -11.080 6.736 557 HG3 LYS 68 HG3 LYS 68 -12.018 -11.687 6.787 558 HD2 LYS 68 HD2 LYS 68 -11.654 -9.626 7.754 559 HD3 LYS 68 HD3 LYS 68 -11.442 -9.159 6.061 560 HE2 LYS 68 HE2 LYS 68 -13.762 -8.371 5.922 561 HE3 LYS 68 HE3 LYS 68 -14.118 -8.995 7.538 562 HZ1 LYS 68 HZ1 LYS 68 -13.693 -6.727 7.772 563 HZ2 LYS 68 HZ2 LYS 68 -12.330 -7.439 8.319 564 HZ3 LYS 68 HZ3 LYS 68 -12.353 -6.750 6.839 565 H THR 69 H THR 69 -9.033 -10.628 5.495 566 HA THR 69 HA THR 69 -9.053 -13.267 6.851 567 HB THR 69 HB THR 69 -6.576 -12.032 5.558 568 HG1 THR 69 HG1 THR 69 -7.649 -14.231 4.153 569 HG21 THR 69 HG21 THR 69 -5.727 -14.357 5.604 570 HG22 THR 69 HG22 THR 69 -6.221 -13.781 7.232 571 HG23 THR 69 HG23 THR 69 -7.284 -14.900 6.314 572 H SER 70 H SER 70 -9.778 -11.767 8.576 573 HA SER 70 HA SER 70 -8.141 -9.550 9.369 574 HB2 SER 70 HB2 SER 70 -10.138 -10.991 11.150 575 HB3 SER 70 HB3 SER 70 -9.743 -9.268 11.081 576 HG SER 70 HG SER 70 -11.140 -8.974 9.464 577 H ASP 71 H ASP 71 -6.046 -10.913 9.240 578 HA ASP 71 HA ASP 71 -5.663 -12.934 11.214 579 HB2 ASP 71 HB2 ASP 71 -4.361 -12.219 8.965 580 HB3 ASP 71 HB3 ASP 71 -3.510 -11.089 10.025 581 H ASP 72 H ASP 72 -3.912 -9.699 11.058 582 HA ASP 72 HA ASP 72 -4.009 -9.675 14.016 583 HB2 ASP 72 HB2 ASP 72 -1.860 -9.416 12.307 584 HB3 ASP 72 HB3 ASP 72 -2.308 -7.723 12.554 585 H GLY 73 H GLY 73 -6.266 -9.103 13.472 586 HA2 GLY 73 HA2 GLY 73 -7.997 -7.955 13.850 587 HA3 GLY 73 HA3 GLY 73 -7.018 -6.488 13.985 588 H GLU 74 H GLU 74 -6.262 -5.663 11.274 589 HA GLU 74 HA GLU 74 -8.761 -6.339 9.802 590 HB2 GLU 74 HB2 GLU 74 -7.362 -3.639 9.719 591 HB3 GLU 74 HB3 GLU 74 -8.771 -4.130 8.769 592 HG2 GLU 74 HG2 GLU 74 -9.834 -4.595 11.170 593 HG3 GLU 74 HG3 GLU 74 -8.575 -3.478 11.712 594 H VAL 75 H VAL 75 -6.846 -8.079 9.398 595 HA VAL 75 HA VAL 75 -4.977 -7.096 7.363 596 HB VAL 75 HB VAL 75 -5.237 -9.600 9.070 597 HG11 VAL 75 HG11 VAL 75 -3.323 -10.600 7.867 598 HG12 VAL 75 HG12 VAL 75 -4.772 -10.426 6.820 599 HG13 VAL 75 HG13 VAL 75 -3.402 -9.276 6.657 600 HG21 VAL 75 HG21 VAL 75 -2.894 -9.021 9.678 601 HG22 VAL 75 HG22 VAL 75 -2.970 -7.607 8.573 602 HG23 VAL 75 HG23 VAL 75 -4.033 -7.675 10.019 603 H TYR 76 H TYR 76 -4.727 -8.492 5.335 604 HA TYR 76 HA TYR 76 -7.119 -9.997 4.646 605 HB2 TYR 76 HB2 TYR 76 -6.207 -7.460 3.219 606 HB3 TYR 76 HB3 TYR 76 -7.217 -8.682 2.435 607 HD1 TYR 76 HD1 TYR 76 -9.512 -9.166 3.320 608 HD2 TYR 76 HD2 TYR 76 -7.126 -5.959 4.889 609 HE1 TYR 76 HE1 TYR 76 -11.527 -8.183 4.370 610 HE2 TYR 76 HE2 TYR 76 -9.141 -4.966 5.931 611 HH TYR 76 HH TYR 76 -11.321 -5.141 6.282 612 H TYR 77 H TYR 77 -6.887 -11.311 2.692 613 HA TYR 77 HA TYR 77 -4.105 -11.630 1.810 614 HB2 TYR 77 HB2 TYR 77 -5.929 -13.731 3.057 615 HB3 TYR 77 HB3 TYR 77 -4.635 -14.181 1.938 616 HD1 TYR 77 HD1 TYR 77 -5.015 -11.939 4.971 617 HD2 TYR 77 HD2 TYR 77 -2.661 -14.894 2.929 618 HE1 TYR 77 HE1 TYR 77 -3.393 -11.932 6.839 619 HE2 TYR 77 HE2 TYR 77 -1.036 -14.889 4.796 620 HH TYR 77 HH TYR 77 -1.698 -13.399 7.833 621 H SER 78 H SER 78 -3.936 -12.110 -0.425 622 HA SER 78 HA SER 78 -6.537 -12.536 -1.789 623 HB2 SER 78 HB2 SER 78 -4.055 -11.561 -3.216 624 HB3 SER 78 HB3 SER 78 -5.748 -11.124 -3.485 625 HG SER 78 HG SER 78 -5.145 -9.325 -2.458 626 H GLU 79 H GLU 79 -6.448 -14.870 -1.583 627 HA GLU 79 HA GLU 79 -4.210 -16.440 -2.158 628 HB2 GLU 79 HB2 GLU 79 -6.778 -16.843 -1.281 629 HB3 GLU 79 HB3 GLU 79 -6.951 -17.382 -2.957 630 HG2 GLU 79 HG2 GLU 79 -4.980 -18.474 -0.897 631 HG3 GLU 79 HG3 GLU 79 -6.455 -19.267 -1.467 632 H GLU 80 H GLU 80 -6.792 -15.082 -4.319 633 HA GLU 80 HA GLU 80 -6.060 -16.505 -6.607 634 HB2 GLU 80 HB2 GLU 80 -7.295 -13.707 -6.335 635 HB3 GLU 80 HB3 GLU 80 -7.314 -14.700 -7.798 636 HG2 GLU 80 HG2 GLU 80 -8.688 -16.412 -6.665 637 HG3 GLU 80 HG3 GLU 80 -8.602 -15.514 -5.144 638 H ALA 81 H ALA 81 -4.585 -13.601 -5.120 639 HA ALA 81 HA ALA 81 -2.732 -13.557 -7.365 640 HB1 ALA 81 HB1 ALA 81 -2.393 -11.155 -6.921 641 HB2 ALA 81 HB2 ALA 81 -4.060 -11.574 -7.442 642 HB3 ALA 81 HB3 ALA 81 -3.721 -11.224 -5.713 643 H LYS 82 H LYS 82 -2.616 -15.034 -4.616 644 HA LYS 82 HA LYS 82 -1.174 -15.346 -2.972 645 HB2 LYS 82 HB2 LYS 82 1.029 -14.834 -4.961 646 HB3 LYS 82 HB3 LYS 82 0.996 -15.955 -3.594 647 HG2 LYS 82 HG2 LYS 82 -0.518 -16.187 -6.228 648 HG3 LYS 82 HG3 LYS 82 0.771 -17.236 -5.624 649 HD2 LYS 82 HD2 LYS 82 -0.681 -18.032 -3.790 650 HD3 LYS 82 HD3 LYS 82 -1.957 -16.906 -4.270 651 HE2 LYS 82 HE2 LYS 82 -1.790 -18.080 -6.625 652 HE3 LYS 82 HE3 LYS 82 -0.934 -19.360 -5.755 653 HZ1 LYS 82 HZ1 LYS 82 -3.244 -19.843 -5.822 654 HZ2 LYS 82 HZ2 LYS 82 -2.869 -19.492 -4.272 655 HZ3 LYS 82 HZ3 LYS 82 -3.661 -18.397 -5.189 656 H LYS 83 H LYS 83 -2.093 -12.761 -2.580 657 HA LYS 83 HA LYS 83 0.365 -11.397 -1.722 658 HB2 LYS 83 HB2 LYS 83 -2.085 -10.072 -2.998 659 HB3 LYS 83 HB3 LYS 83 -0.660 -9.234 -2.367 660 HG2 LYS 83 HG2 LYS 83 0.744 -10.096 -4.129 661 HG3 LYS 83 HG3 LYS 83 -0.493 -11.248 -4.649 662 HD2 LYS 83 HD2 LYS 83 -1.978 -9.033 -4.921 663 HD3 LYS 83 HD3 LYS 83 -0.399 -8.244 -5.014 664 HE2 LYS 83 HE2 LYS 83 0.260 -9.833 -6.853 665 HE3 LYS 83 HE3 LYS 83 -1.352 -10.557 -6.781 666 HZ1 LYS 83 HZ1 LYS 83 -1.155 -8.842 -8.480 667 HZ2 LYS 83 HZ2 LYS 83 -2.289 -8.440 -7.376 668 HZ3 LYS 83 HZ3 LYS 83 -0.830 -7.708 -7.352 669 H LYS 84 H LYS 84 0.251 -10.827 0.430 670 HA LYS 84 HA LYS 84 -2.427 -10.571 1.604 671 HB2 LYS 84 HB2 LYS 84 -1.622 -11.617 3.652 672 HB3 LYS 84 HB3 LYS 84 -1.634 -12.722 2.271 673 HG2 LYS 84 HG2 LYS 84 0.387 -13.219 3.335 674 HG3 LYS 84 HG3 LYS 84 0.886 -12.151 2.017 675 HD2 LYS 84 HD2 LYS 84 1.681 -10.596 3.461 676 HD3 LYS 84 HD3 LYS 84 0.168 -10.573 4.377 677 HE2 LYS 84 HE2 LYS 84 0.850 -12.434 5.754 678 HE3 LYS 84 HE3 LYS 84 2.200 -12.832 4.683 679 HZ1 LYS 84 HZ1 LYS 84 2.817 -11.609 6.710 680 HZ2 LYS 84 HZ2 LYS 84 3.300 -10.858 5.343 681 HZ3 LYS 84 HZ3 LYS 84 2.008 -10.297 6.170 682 H VAL 85 H VAL 85 -2.599 -9.052 3.391 683 HA VAL 85 HA VAL 85 -0.265 -7.297 3.634 684 HB VAL 85 HB VAL 85 -1.837 -5.337 3.689 685 HG11 VAL 85 HG11 VAL 85 -2.213 -5.206 1.262 686 HG12 VAL 85 HG12 VAL 85 -0.583 -5.844 1.664 687 HG13 VAL 85 HG13 VAL 85 -1.876 -6.965 1.120 688 HG21 VAL 85 HG21 VAL 85 -4.117 -5.604 2.768 689 HG22 VAL 85 HG22 VAL 85 -3.880 -7.383 2.716 690 HG23 VAL 85 HG23 VAL 85 -3.892 -6.525 4.293 691 H GLU 86 H GLU 86 -0.550 -5.745 5.617 692 HA GLU 86 HA GLU 86 -2.413 -6.714 7.611 693 HB2 GLU 86 HB2 GLU 86 -0.563 -7.133 9.254 694 HB3 GLU 86 HB3 GLU 86 -0.692 -8.336 7.964 695 HG2 GLU 86 HG2 GLU 86 1.102 -6.343 6.999 696 HG3 GLU 86 HG3 GLU 86 1.551 -6.626 8.687 697 H VAL 87 H VAL 87 -3.307 -4.833 8.414 698 HA VAL 87 HA VAL 87 -1.868 -2.357 8.234 699 HB VAL 87 HB VAL 87 -4.279 -2.386 8.109 700 HG11 VAL 87 HG11 VAL 87 -5.727 -3.052 10.023 701 HG12 VAL 87 HG12 VAL 87 -4.768 -4.427 9.378 702 HG13 VAL 87 HG13 VAL 87 -4.271 -3.624 10.905 703 HG21 VAL 87 HG21 VAL 87 -4.897 -0.769 9.881 704 HG22 VAL 87 HG22 VAL 87 -3.382 -1.174 10.758 705 HG23 VAL 87 HG23 VAL 87 -3.303 -0.403 9.138 706 H LEU 88 H LEU 88 0.036 -2.241 9.468 707 HA LEU 88 HA LEU 88 0.256 -3.623 11.971 708 HB2 LEU 88 HB2 LEU 88 1.971 -1.433 10.675 709 HB3 LEU 88 HB3 LEU 88 2.449 -2.431 12.054 710 HG LEU 88 HG LEU 88 1.937 -3.430 9.220 711 HD11 LEU 88 HD11 LEU 88 4.376 -3.827 9.167 712 HD12 LEU 88 HD12 LEU 88 3.980 -2.088 9.382 713 HD13 LEU 88 HD13 LEU 88 4.530 -3.065 10.786 714 HD21 LEU 88 HD21 LEU 88 2.876 -5.567 10.048 715 HD22 LEU 88 HD22 LEU 88 2.952 -4.882 11.707 716 HD23 LEU 88 HD23 LEU 88 1.362 -5.120 10.905 717 H ASP 89 H ASP 89 0.109 -0.080 10.978 718 HA ASP 89 HA ASP 89 -1.311 0.453 13.455 719 HB2 ASP 89 HB2 ASP 89 1.309 0.650 13.770 720 HB3 ASP 89 HB3 ASP 89 1.118 2.159 12.868 721 H THR 90 H THR 90 -2.623 2.343 13.287 722 HA THR 90 HA THR 90 -2.264 4.079 11.000 723 HB THR 90 HB THR 90 -3.578 2.074 10.180 724 HG1 THR 90 HG1 THR 90 -4.690 3.397 8.880 725 HG21 THR 90 HG21 THR 90 -5.956 1.914 10.855 726 HG22 THR 90 HG22 THR 90 -4.842 1.592 12.226 727 HG23 THR 90 HG23 THR 90 -5.679 3.176 12.102 728 H ASP 91 H ASP 91 -3.162 6.160 11.361 729 HA ASP 91 HA ASP 91 -4.360 6.469 14.033 730 HB2 ASP 91 HB2 ASP 91 -2.209 7.700 13.430 731 HB3 ASP 91 HB3 ASP 91 -3.135 8.599 12.221 732 H TYR 92 H TYR 92 -6.438 7.331 14.251 733 HA TYR 92 HA TYR 92 -8.153 7.218 12.044 734 HB2 TYR 92 HB2 TYR 92 -8.470 8.568 14.774 735 HB3 TYR 92 HB3 TYR 92 -9.786 8.308 13.622 736 HD1 TYR 92 HD1 TYR 92 -7.439 6.652 15.967 737 HD2 TYR 92 HD2 TYR 92 -10.718 6.070 13.254 738 HE1 TYR 92 HE1 TYR 92 -7.800 4.386 16.894 739 HE2 TYR 92 HE2 TYR 92 -11.082 3.802 14.182 740 HH TYR 92 HH TYR 92 -10.428 2.273 15.635 741 H LYS 93 H LYS 93 -6.221 9.931 13.384 742 HA LYS 93 HA LYS 93 -7.243 11.551 11.174 743 HB2 LYS 93 HB2 LYS 93 -6.835 12.380 14.054 744 HB3 LYS 93 HB3 LYS 93 -6.902 13.538 12.720 745 HG2 LYS 93 HG2 LYS 93 -9.176 12.616 12.095 746 HG3 LYS 93 HG3 LYS 93 -9.106 11.573 13.522 747 HD2 LYS 93 HD2 LYS 93 -8.890 13.562 14.997 748 HD3 LYS 93 HD3 LYS 93 -8.878 14.629 13.587 749 HE2 LYS 93 HE2 LYS 93 -11.180 12.744 14.304 750 HE3 LYS 93 HE3 LYS 93 -11.120 14.455 14.746 751 HZ1 LYS 93 HZ1 LYS 93 -12.340 14.266 12.765 752 HZ2 LYS 93 HZ2 LYS 93 -10.905 14.907 12.321 753 HZ3 LYS 93 HZ3 LYS 93 -11.222 13.332 12.027 754 H SER 94 H SER 94 -4.793 9.832 11.213 755 HA SER 94 HA SER 94 -2.965 12.006 10.516 756 HB2 SER 94 HB2 SER 94 -2.646 11.420 13.016 757 HB3 SER 94 HB3 SER 94 -2.237 9.772 12.520 758 HG SER 94 HG SER 94 -0.343 11.102 12.822 759 H TYR 95 H TYR 95 -0.712 9.891 10.575 760 HA TYR 95 HA TYR 95 -1.264 8.887 7.914 761 HB2 TYR 95 HB2 TYR 95 1.105 8.307 7.942 762 HB3 TYR 95 HB3 TYR 95 0.944 9.919 8.653 763 HD1 TYR 95 HD1 TYR 95 1.164 10.231 11.124 764 HD2 TYR 95 HD2 TYR 95 1.827 6.405 9.286 765 HE1 TYR 95 HE1 TYR 95 2.288 9.440 13.181 766 HE2 TYR 95 HE2 TYR 95 2.939 5.608 11.347 767 HH TYR 95 HH TYR 95 2.701 6.362 13.973 768 H ALA 96 H ALA 96 -0.381 6.517 7.469 769 HA ALA 96 HA ALA 96 -0.931 4.719 9.691 770 HB1 ALA 96 HB1 ALA 96 -2.490 3.394 8.327 771 HB2 ALA 96 HB2 ALA 96 -3.121 5.039 8.675 772 HB3 ALA 96 HB3 ALA 96 -2.444 4.661 7.055 773 H VAL 97 H VAL 97 0.130 2.676 9.497 774 HA VAL 97 HA VAL 97 1.810 2.456 7.091 775 HB VAL 97 HB VAL 97 3.498 1.311 8.553 776 HG11 VAL 97 HG11 VAL 97 4.397 3.403 9.532 777 HG12 VAL 97 HG12 VAL 97 3.773 3.655 7.866 778 HG13 VAL 97 HG13 VAL 97 2.806 4.197 9.279 779 HG21 VAL 97 HG21 VAL 97 3.406 1.690 10.994 780 HG22 VAL 97 HG22 VAL 97 1.770 2.410 10.815 781 HG23 VAL 97 HG23 VAL 97 2.038 0.679 10.416 782 H ILE 98 H ILE 98 1.350 0.610 5.917 783 HA ILE 98 HA ILE 98 0.220 -1.648 7.424 784 HB ILE 98 HB ILE 98 -0.378 -0.980 4.506 785 HG12 ILE 98 HG12 ILE 98 -1.200 0.900 5.797 786 HG13 ILE 98 HG13 ILE 98 -2.563 -0.089 5.256 787 HG21 ILE 98 HG21 ILE 98 -2.302 -2.498 4.863 788 HG22 ILE 98 HG22 ILE 98 -0.732 -3.313 5.171 789 HG23 ILE 98 HG23 ILE 98 -1.754 -2.784 6.549 790 HD11 ILE 98 HD11 ILE 98 -2.882 0.667 7.568 791 HD12 ILE 98 HD12 ILE 98 -2.724 -1.121 7.503 792 HD13 ILE 98 HD13 ILE 98 -1.340 -0.117 8.053 793 H TYR 99 H TYR 99 1.058 -3.689 6.919 794 HA TYR 99 HA TYR 99 3.440 -3.707 5.240 795 HB2 TYR 99 HB2 TYR 99 3.603 -4.407 7.638 796 HB3 TYR 99 HB3 TYR 99 2.533 -5.767 7.272 797 HD1 TYR 99 HD1 TYR 99 5.826 -4.226 6.371 798 HD2 TYR 99 HD2 TYR 99 3.391 -7.760 6.270 799 HE1 TYR 99 HE1 TYR 99 7.781 -5.551 5.630 800 HE2 TYR 99 HE2 TYR 99 5.342 -9.086 5.529 801 HH TYR 99 HH TYR 99 7.589 -9.102 5.318 802 H ALA 100 H ALA 100 3.787 -5.396 3.644 803 HA ALA 100 HA ALA 100 1.407 -7.001 3.060 804 HB1 ALA 100 HB1 ALA 100 1.645 -6.452 0.663 805 HB2 ALA 100 HB2 ALA 100 1.240 -5.011 1.655 806 HB3 ALA 100 HB3 ALA 100 2.921 -5.258 1.074 807 H THR 101 H THR 101 1.828 -9.003 1.924 808 HA THR 101 HA THR 101 4.644 -9.574 1.429 809 HB THR 101 HB THR 101 2.826 -11.481 2.967 810 HG1 THR 101 HG1 THR 101 4.597 -9.422 3.865 811 HG21 THR 101 HG21 THR 101 4.967 -12.664 3.439 812 HG22 THR 101 HG22 THR 101 4.643 -12.545 1.677 813 HG23 THR 101 HG23 THR 101 5.844 -11.452 2.446 814 H ARG 102 H ARG 102 4.938 -11.007 -0.359 815 HA ARG 102 HA ARG 102 2.500 -12.267 -1.456 816 HB2 ARG 102 HB2 ARG 102 2.800 -11.363 -3.544 817 HB3 ARG 102 HB3 ARG 102 3.334 -9.998 -2.553 818 HG2 ARG 102 HG2 ARG 102 5.720 -10.745 -2.869 819 HG3 ARG 102 HG3 ARG 102 5.149 -12.042 -3.927 820 HD2 ARG 102 HD2 ARG 102 5.069 -9.039 -4.382 821 HD3 ARG 102 HD3 ARG 102 5.775 -10.296 -5.407 822 HE ARG 102 HE ARG 102 2.820 -9.965 -5.045 823 HH11 ARG 102 HH11 ARG 102 5.619 -10.044 -7.138 824 HH12 ARG 102 HH12 ARG 102 4.727 -10.533 -8.540 825 HH21 ARG 102 HH21 ARG 102 1.668 -10.826 -6.864 826 HH22 ARG 102 HH22 ARG 102 2.483 -10.978 -8.385 827 H VAL 103 H VAL 103 2.901 -14.461 -1.921 828 HA VAL 103 HA VAL 103 5.746 -15.196 -2.064 829 HB VAL 103 HB VAL 103 5.083 -17.416 -1.166 830 HG11 VAL 103 HG11 VAL 103 4.723 -16.701 1.173 831 HG12 VAL 103 HG12 VAL 103 5.966 -15.704 0.345 832 HG13 VAL 103 HG13 VAL 103 4.312 -15.050 0.598 833 HG21 VAL 103 HG21 VAL 103 2.866 -17.693 -0.095 834 HG22 VAL 103 HG22 VAL 103 2.365 -16.091 -0.736 835 HG23 VAL 103 HG23 VAL 103 2.732 -17.436 -1.868 836 H LYS 104 H LYS 104 6.387 -16.336 -3.775 837 HA LYS 104 HA LYS 104 4.464 -17.242 -5.760 838 HB2 LYS 104 HB2 LYS 104 6.036 -15.192 -6.225 839 HB3 LYS 104 HB3 LYS 104 7.199 -16.472 -6.594 840 HG2 LYS 104 HG2 LYS 104 5.107 -17.454 -7.999 841 HG3 LYS 104 HG3 LYS 104 4.629 -15.751 -8.003 842 HD2 LYS 104 HD2 LYS 104 6.983 -15.173 -8.812 843 HD3 LYS 104 HD3 LYS 104 7.298 -16.906 -8.966 844 HE2 LYS 104 HE2 LYS 104 4.965 -15.500 -10.353 845 HE3 LYS 104 HE3 LYS 104 6.557 -15.696 -11.099 846 HZ1 LYS 104 HZ1 LYS 104 5.932 -17.704 -11.703 847 HZ2 LYS 104 HZ2 LYS 104 5.748 -18.179 -10.152 848 HZ3 LYS 104 HZ3 LYS 104 4.483 -17.545 -10.967 849 H ASP 105 H ASP 105 5.646 -18.906 -7.323 850 HA ASP 105 HA ASP 105 6.060 -21.230 -6.054 851 HB2 ASP 105 HB2 ASP 105 7.836 -20.477 -8.436 852 HB3 ASP 105 HB3 ASP 105 7.069 -22.034 -8.094 853 H GLY 106 H GLY 106 7.323 -21.260 -4.087 854 HA2 GLY 106 HA2 GLY 106 9.291 -21.769 -3.078 855 HA3 GLY 106 HA3 GLY 106 10.119 -21.602 -4.632 856 H ARG 107 H ARG 107 8.360 -18.665 -4.121 857 HA ARG 107 HA ARG 107 10.727 -17.508 -2.787 858 HB2 ARG 107 HB2 ARG 107 10.020 -17.337 -5.558 859 HB3 ARG 107 HB3 ARG 107 9.471 -15.807 -4.861 860 HG2 ARG 107 HG2 ARG 107 11.688 -15.428 -5.651 861 HG3 ARG 107 HG3 ARG 107 11.801 -15.505 -3.887 862 HD2 ARG 107 HD2 ARG 107 12.485 -17.921 -4.057 863 HD3 ARG 107 HD3 ARG 107 12.421 -17.800 -5.820 864 HE ARG 107 HE ARG 107 14.386 -16.433 -4.046 865 HH11 ARG 107 HH11 ARG 107 13.330 -17.344 -7.279 866 HH12 ARG 107 HH12 ARG 107 14.831 -16.902 -8.022 867 HH21 ARG 107 HH21 ARG 107 16.344 -15.866 -5.036 868 HH22 ARG 107 HH22 ARG 107 16.546 -16.061 -6.745 869 H THR 108 H THR 108 10.306 -16.072 -1.211 870 HA THR 108 HA THR 108 7.527 -15.162 -0.943 871 HB THR 108 HB THR 108 9.626 -15.223 1.253 872 HG1 THR 108 HG1 THR 108 8.676 -17.322 1.811 873 HG21 THR 108 HG21 THR 108 7.627 -15.348 2.698 874 HG22 THR 108 HG22 THR 108 7.594 -13.894 1.644 875 HG23 THR 108 HG23 THR 108 6.575 -15.318 1.244 876 H LEU 109 H LEU 109 7.153 -12.947 -1.331 877 HA LEU 109 HA LEU 109 9.549 -11.244 -1.183 878 HB2 LEU 109 HB2 LEU 109 8.416 -11.369 -3.371 879 HB3 LEU 109 HB3 LEU 109 6.899 -10.849 -2.626 880 HG LEU 109 HG LEU 109 7.760 -8.654 -2.169 881 HD11 LEU 109 HD11 LEU 109 10.074 -7.985 -2.741 882 HD12 LEU 109 HD12 LEU 109 10.036 -9.266 -1.482 883 HD13 LEU 109 HD13 LEU 109 10.451 -9.685 -3.178 884 HD21 LEU 109 HD21 LEU 109 8.310 -7.865 -4.452 885 HD22 LEU 109 HD22 LEU 109 8.613 -9.562 -4.959 886 HD23 LEU 109 HD23 LEU 109 6.964 -9.054 -4.459 887 H HIS 110 H HIS 110 9.638 -9.528 0.239 888 HA HIS 110 HA HIS 110 7.232 -9.063 1.897 889 HB2 HIS 110 HB2 HIS 110 10.210 -9.099 2.579 890 HB3 HIS 110 HB3 HIS 110 8.994 -8.378 3.641 891 HD2 HIS 110 HD2 HIS 110 10.167 -11.935 2.443 892 HE1 HIS 110 HE1 HIS 110 7.456 -12.392 5.722 893 H MET 111 H MET 111 6.697 -6.884 2.311 894 HA MET 111 HA MET 111 8.540 -4.793 1.783 895 HB2 MET 111 HB2 MET 111 7.338 -3.705 -0.027 896 HB3 MET 111 HB3 MET 111 8.148 -5.206 -0.495 897 HG2 MET 111 HG2 MET 111 6.067 -6.423 -0.528 898 HG3 MET 111 HG3 MET 111 5.198 -5.086 0.237 899 HE1 MET 111 HE1 MET 111 7.066 -4.796 -4.003 900 HE2 MET 111 HE2 MET 111 7.931 -4.146 -2.570 901 HE3 MET 111 HE3 MET 111 7.584 -5.904 -2.689 902 H MET 112 H MET 112 7.919 -2.840 2.827 903 HA MET 112 HA MET 112 5.279 -3.014 4.148 904 HB2 MET 112 HB2 MET 112 7.359 -2.947 5.570 905 HB3 MET 112 HB3 MET 112 7.723 -1.357 4.886 906 HG2 MET 112 HG2 MET 112 5.762 -0.372 5.876 907 HG3 MET 112 HG3 MET 112 5.093 -1.952 6.303 908 HE1 MET 112 HE1 MET 112 5.519 -0.825 9.741 909 HE2 MET 112 HE2 MET 112 5.998 0.671 8.869 910 HE3 MET 112 HE3 MET 112 4.684 -0.366 8.219 911 H ARG 113 H ARG 113 4.014 -0.957 4.290 912 HA ARG 113 HA ARG 113 4.871 1.101 2.401 913 HB2 ARG 113 HB2 ARG 113 2.835 -0.883 1.867 914 HB3 ARG 113 HB3 ARG 113 2.034 0.676 2.099 915 HG2 ARG 113 HG2 ARG 113 2.568 1.235 -0.009 916 HG3 ARG 113 HG3 ARG 113 4.280 1.220 0.436 917 HD2 ARG 113 HD2 ARG 113 3.944 -0.277 -1.461 918 HD3 ARG 113 HD3 ARG 113 4.378 -1.238 -0.041 919 HE ARG 113 HE ARG 113 1.505 -0.922 -0.799 920 HH11 ARG 113 HH11 ARG 113 4.333 -2.955 -0.367 921 HH12 ARG 113 HH12 ARG 113 3.437 -4.436 -0.420 922 HH21 ARG 113 HH21 ARG 113 0.314 -2.872 -0.779 923 HH22 ARG 113 HH22 ARG 113 1.139 -4.389 -0.655 924 H LEU 114 H LEU 114 3.908 3.180 2.784 925 HA LEU 114 HA LEU 114 2.342 3.368 5.283 926 HB2 LEU 114 HB2 LEU 114 4.766 3.932 5.617 927 HB3 LEU 114 HB3 LEU 114 4.584 5.192 4.425 928 HG LEU 114 HG LEU 114 2.933 5.106 6.950 929 HD11 LEU 114 HD11 LEU 114 4.499 6.802 7.852 930 HD12 LEU 114 HD12 LEU 114 5.314 5.231 7.544 931 HD13 LEU 114 HD13 LEU 114 5.541 6.600 6.403 932 HD21 LEU 114 HD21 LEU 114 2.590 7.511 6.477 933 HD22 LEU 114 HD22 LEU 114 3.550 7.345 4.968 934 HD23 LEU 114 HD23 LEU 114 1.992 6.470 5.141 935 H TYR 115 H TYR 115 0.487 4.625 5.018 936 HA TYR 115 HA TYR 115 0.432 6.244 2.562 937 HB2 TYR 115 HB2 TYR 115 -1.860 5.694 2.217 938 HB3 TYR 115 HB3 TYR 115 -0.937 4.192 2.353 939 HD1 TYR 115 HD1 TYR 115 -1.223 2.711 4.330 940 HD2 TYR 115 HD2 TYR 115 -3.552 6.288 3.858 941 HE1 TYR 115 HE1 TYR 115 -2.822 1.896 6.036 942 HE2 TYR 115 HE2 TYR 115 -5.152 5.477 5.561 943 HH TYR 115 HH TYR 115 -4.679 2.289 7.174 944 H SER 116 H SER 116 -0.815 8.198 2.611 945 HA SER 116 HA SER 116 -1.119 9.235 5.376 946 HB2 SER 116 HB2 SER 116 -0.504 10.713 2.748 947 HB3 SER 116 HB3 SER 116 -0.656 11.456 4.346 948 HG SER 116 HG SER 116 1.496 11.180 4.220 949 H ARG 117 H ARG 117 -3.003 10.734 5.620 950 HA ARG 117 HA ARG 117 -5.304 9.668 4.436 951 HB2 ARG 117 HB2 ARG 117 -4.588 11.591 6.465 952 HB3 ARG 117 HB3 ARG 117 -5.715 12.399 5.368 953 HG2 ARG 117 HG2 ARG 117 -7.069 10.080 5.674 954 HG3 ARG 117 HG3 ARG 117 -6.161 10.046 7.191 955 HD2 ARG 117 HD2 ARG 117 -8.257 11.155 7.632 956 HD3 ARG 117 HD3 ARG 117 -6.988 12.386 7.685 957 HE ARG 117 HE ARG 117 -7.751 13.232 5.558 958 HH11 ARG 117 HH11 ARG 117 -9.781 10.664 6.850 959 HH12 ARG 117 HH12 ARG 117 -11.137 11.072 5.853 960 HH21 ARG 117 HH21 ARG 117 -9.542 13.759 4.268 961 HH22 ARG 117 HH22 ARG 117 -11.001 12.832 4.385 962 H SER 118 H SER 118 -3.015 12.052 3.212 963 HA SER 118 HA SER 118 -4.717 12.459 0.873 964 HB2 SER 118 HB2 SER 118 -3.461 14.820 2.326 965 HB3 SER 118 HB3 SER 118 -4.560 14.843 0.940 966 HG SER 118 HG SER 118 -5.649 15.335 2.943 967 HA PRO 119 HA PRO 119 -0.626 12.321 -0.976 968 HB2 PRO 119 HB2 PRO 119 -0.657 14.332 -2.892 969 HB3 PRO 119 HB3 PRO 119 -1.675 12.900 -3.092 970 HG2 PRO 119 HG2 PRO 119 -2.424 15.644 -2.040 971 HG3 PRO 119 HG3 PRO 119 -3.303 14.609 -3.174 972 HD2 PRO 119 HD2 PRO 119 -3.980 14.760 -0.519 973 HD3 PRO 119 HD3 PRO 119 -4.223 13.284 -1.463 974 H GLU 120 H GLU 120 -0.206 13.328 1.445 975 HA GLU 120 HA GLU 120 1.848 15.324 0.919 976 HB2 GLU 120 HB2 GLU 120 1.039 16.648 2.928 977 HB3 GLU 120 HB3 GLU 120 0.117 16.842 1.432 978 HG2 GLU 120 HG2 GLU 120 -1.420 14.943 2.445 979 HG3 GLU 120 HG3 GLU 120 -0.660 15.394 3.978 980 H VAL 121 H VAL 121 3.641 14.228 1.641 981 HA VAL 121 HA VAL 121 3.346 12.183 3.638 982 HB VAL 121 HB VAL 121 5.810 13.694 2.549 983 HG11 VAL 121 HG11 VAL 121 7.133 11.674 3.174 984 HG12 VAL 121 HG12 VAL 121 6.357 12.460 4.591 985 HG13 VAL 121 HG13 VAL 121 5.655 10.957 3.901 986 HG21 VAL 121 HG21 VAL 121 6.162 11.829 0.971 987 HG22 VAL 121 HG22 VAL 121 4.605 11.109 1.502 988 HG23 VAL 121 HG23 VAL 121 4.622 12.709 0.686 989 H SER 122 H SER 122 3.594 12.441 5.817 990 HA SER 122 HA SER 122 4.339 15.089 6.821 991 HB2 SER 122 HB2 SER 122 3.176 14.075 8.947 992 HB3 SER 122 HB3 SER 122 2.175 14.626 7.598 993 HG SER 122 HG SER 122 1.561 12.500 8.346 994 HA PRO 123 HA PRO 123 8.084 13.643 8.628 995 HB2 PRO 123 HB2 PRO 123 8.045 15.235 10.965 996 HB3 PRO 123 HB3 PRO 123 8.552 15.864 9.391 997 HG2 PRO 123 HG2 PRO 123 5.871 16.104 10.772 998 HG3 PRO 123 HG3 PRO 123 6.765 17.320 9.849 999 HD2 PRO 123 HD2 PRO 123 4.672 16.005 8.737 1000 HD3 PRO 123 HD3 PRO 123 6.083 16.436 7.761 1001 H ALA 124 H ALA 124 5.208 13.901 10.849 1002 HA ALA 124 HA ALA 124 6.200 12.271 12.860 1003 HB1 ALA 124 HB1 ALA 124 3.819 11.870 13.406 1004 HB2 ALA 124 HB2 ALA 124 4.149 13.601 13.057 1005 HB3 ALA 124 HB3 ALA 124 3.345 12.573 11.823 1006 H ALA 125 H ALA 125 4.403 11.350 9.815 1007 HA ALA 125 HA ALA 125 4.314 8.585 10.441 1008 HB1 ALA 125 HB1 ALA 125 3.769 8.355 8.041 1009 HB2 ALA 125 HB2 ALA 125 2.822 9.675 8.809 1010 HB3 ALA 125 HB3 ALA 125 4.234 10.069 7.771 1011 H THR 126 H THR 126 6.620 10.722 8.654 1012 HA THR 126 HA THR 126 8.204 8.685 7.590 1013 HB THR 126 HB THR 126 9.040 11.501 8.463 1014 HG1 THR 126 HG1 THR 126 7.245 11.708 7.078 1015 HG21 THR 126 HG21 THR 126 10.686 11.296 6.614 1016 HG22 THR 126 HG22 THR 126 10.923 10.024 7.860 1017 HG23 THR 126 HG23 THR 126 10.120 9.619 6.305 1018 H ALA 127 H ALA 127 8.515 10.614 10.690 1019 HA ALA 127 HA ALA 127 10.926 9.375 11.457 1020 HB1 ALA 127 HB1 ALA 127 10.413 10.379 13.675 1021 HB2 ALA 127 HB2 ALA 127 10.195 11.551 12.331 1022 HB3 ALA 127 HB3 ALA 127 8.762 10.784 13.095 1023 H ILE 128 H ILE 128 7.447 8.572 12.188 1024 HA ILE 128 HA ILE 128 8.171 6.623 14.104 1025 HB ILE 128 HB ILE 128 5.592 6.999 12.523 1026 HG12 ILE 128 HG12 ILE 128 6.137 8.919 13.933 1027 HG13 ILE 128 HG13 ILE 128 4.772 8.026 14.615 1028 HG21 ILE 128 HG21 ILE 128 4.562 5.580 14.270 1029 HG22 ILE 128 HG22 ILE 128 5.805 4.687 13.329 1030 HG23 ILE 128 HG23 ILE 128 6.184 5.283 14.980 1031 HD11 ILE 128 HD11 ILE 128 6.326 8.741 16.373 1032 HD12 ILE 128 HD12 ILE 128 6.280 6.949 16.260 1033 HD13 ILE 128 HD13 ILE 128 7.666 7.857 15.568 1034 H PHE 129 H PHE 129 7.276 6.445 10.562 1035 HA PHE 129 HA PHE 129 7.265 3.671 10.339 1036 HB2 PHE 129 HB2 PHE 129 6.512 5.371 8.629 1037 HB3 PHE 129 HB3 PHE 129 8.208 5.749 8.302 1038 HD1 PHE 129 HD1 PHE 129 9.651 4.159 7.123 1039 HD2 PHE 129 HD2 PHE 129 5.520 3.272 7.885 1040 HE1 PHE 129 HE1 PHE 129 9.740 2.330 5.456 1041 HE2 PHE 129 HE2 PHE 129 5.601 1.444 6.220 1042 HZ PHE 129 HZ PHE 129 7.712 0.968 4.999 1043 H ARG 130 H ARG 130 10.011 6.046 10.327 1044 HA ARG 130 HA ARG 130 11.944 4.163 9.475 1045 HB2 ARG 130 HB2 ARG 130 12.221 6.620 9.298 1046 HB3 ARG 130 HB3 ARG 130 12.228 6.757 11.062 1047 HG2 ARG 130 HG2 ARG 130 14.257 5.164 11.043 1048 HG3 ARG 130 HG3 ARG 130 14.306 5.396 9.291 1049 HD2 ARG 130 HD2 ARG 130 14.403 7.666 11.341 1050 HD3 ARG 130 HD3 ARG 130 15.829 6.939 10.589 1051 HE ARG 130 HE ARG 130 14.341 7.682 8.412 1052 HH11 ARG 130 HH11 ARG 130 15.341 9.399 11.313 1053 HH12 ARG 130 HH12 ARG 130 15.397 10.942 10.528 1054 HH21 ARG 130 HH21 ARG 130 14.437 9.710 7.391 1055 HH22 ARG 130 HH22 ARG 130 14.882 11.119 8.296 1056 H LYS 131 H LYS 131 10.845 5.347 12.758 1057 HA LYS 131 HA LYS 131 12.758 4.083 14.293 1058 HB2 LYS 131 HB2 LYS 131 9.787 4.462 14.883 1059 HB3 LYS 131 HB3 LYS 131 11.033 4.086 16.081 1060 HG2 LYS 131 HG2 LYS 131 12.210 6.255 15.352 1061 HG3 LYS 131 HG3 LYS 131 10.747 6.637 14.434 1062 HD2 LYS 131 HD2 LYS 131 9.417 6.313 16.601 1063 HD3 LYS 131 HD3 LYS 131 10.962 6.188 17.453 1064 HE2 LYS 131 HE2 LYS 131 11.557 8.458 16.281 1065 HE3 LYS 131 HE3 LYS 131 9.826 8.575 15.937 1066 HZ1 LYS 131 HZ1 LYS 131 10.395 9.658 17.991 1067 HZ2 LYS 131 HZ2 LYS 131 9.413 8.391 18.303 1068 HZ3 LYS 131 HZ3 LYS 131 11.011 8.283 18.621 1069 H LEU 132 H LEU 132 9.595 2.748 13.027 1070 HA LEU 132 HA LEU 132 9.912 0.219 14.255 1071 HB2 LEU 132 HB2 LEU 132 8.403 1.027 11.734 1072 HB3 LEU 132 HB3 LEU 132 8.204 -0.491 12.619 1073 HG LEU 132 HG LEU 132 7.567 2.293 13.687 1074 HD11 LEU 132 HD11 LEU 132 5.216 1.539 13.560 1075 HD12 LEU 132 HD12 LEU 132 6.004 1.563 11.945 1076 HD13 LEU 132 HD13 LEU 132 5.756 0.003 12.800 1077 HD21 LEU 132 HD21 LEU 132 6.540 1.090 15.589 1078 HD22 LEU 132 HD22 LEU 132 7.139 -0.466 14.921 1079 HD23 LEU 132 HD23 LEU 132 8.306 0.783 15.474 1080 H ALA 133 H ALA 133 10.761 1.555 10.970 1081 HA ALA 133 HA ALA 133 11.651 -0.816 9.833 1082 HB1 ALA 133 HB1 ALA 133 12.929 0.675 8.322 1083 HB2 ALA 133 HB2 ALA 133 11.250 1.258 8.579 1084 HB3 ALA 133 HB3 ALA 133 12.617 2.054 9.429 1085 H GLY 134 H GLY 134 13.408 1.530 12.022 1086 HA2 GLY 134 HA2 GLY 134 15.936 0.277 11.621 1087 HA3 GLY 134 HA3 GLY 134 15.483 1.416 12.895 1088 H GLU 135 H GLU 135 13.150 -0.254 13.855 1089 HA GLU 135 HA GLU 135 14.499 -1.801 15.785 1090 HB2 GLU 135 HB2 GLU 135 12.245 -0.811 16.054 1091 HB3 GLU 135 HB3 GLU 135 11.619 -1.836 14.756 1092 HG2 GLU 135 HG2 GLU 135 12.142 -3.863 16.132 1093 HG3 GLU 135 HG3 GLU 135 12.706 -2.811 17.438 1094 H ARG 136 H ARG 136 13.451 -2.457 12.443 1095 HA ARG 136 HA ARG 136 13.818 -5.337 12.853 1096 HB2 ARG 136 HB2 ARG 136 13.027 -4.081 10.221 1097 HB3 ARG 136 HB3 ARG 136 12.522 -5.621 10.929 1098 HG2 ARG 136 HG2 ARG 136 11.132 -4.352 12.608 1099 HG3 ARG 136 HG3 ARG 136 11.587 -2.843 11.805 1100 HD2 ARG 136 HD2 ARG 136 9.479 -3.402 10.869 1101 HD3 ARG 136 HD3 ARG 136 10.651 -3.870 9.630 1102 HE ARG 136 HE ARG 136 9.988 -6.074 9.893 1103 HH11 ARG 136 HH11 ARG 136 9.034 -4.286 12.775 1104 HH12 ARG 136 HH12 ARG 136 8.139 -5.609 13.446 1105 HH21 ARG 136 HH21 ARG 136 8.808 -7.797 10.790 1106 HH22 ARG 136 HH22 ARG 136 8.011 -7.607 12.316 1107 H ASN 137 H ASN 137 16.038 -3.050 12.647 1108 HA ASN 137 HA ASN 137 18.058 -2.836 11.772 1109 HB2 ASN 137 HB2 ASN 137 17.610 -5.795 11.115 1110 HB3 ASN 137 HB3 ASN 137 19.159 -4.970 10.897 1111 HD21 ASN 137 HD21 ASN 137 19.286 -3.366 13.194 1112 HD22 ASN 137 HD22 ASN 137 19.393 -4.388 14.589 1113 H TYR 138 H TYR 138 15.883 -1.964 10.045 1114 HA TYR 138 HA TYR 138 16.190 -3.036 7.438 1115 HB2 TYR 138 HB2 TYR 138 14.633 -1.353 6.849 1116 HB3 TYR 138 HB3 TYR 138 14.294 -1.537 8.575 1117 HD1 TYR 138 HD1 TYR 138 16.153 0.059 10.032 1118 HD2 TYR 138 HD2 TYR 138 14.522 0.867 6.141 1119 HE1 TYR 138 HE1 TYR 138 16.561 2.477 10.364 1120 HE2 TYR 138 HE2 TYR 138 14.931 3.286 6.470 1121 HH TYR 138 HH TYR 138 15.926 4.834 7.740 1122 H THR 139 H THR 139 16.807 -1.469 5.537 1123 HA THR 139 HA THR 139 19.304 -0.058 6.244 1124 HB THR 139 HB THR 139 19.880 -0.827 3.766 1125 HG1 THR 139 HG1 THR 139 18.999 -2.990 3.388 1126 HG21 THR 139 HG21 THR 139 21.017 -2.828 4.692 1127 HG22 THR 139 HG22 THR 139 21.168 -1.417 5.793 1128 HG23 THR 139 HG23 THR 139 19.994 -2.725 6.164 1129 H ASP 140 H ASP 140 19.835 1.770 4.713 1130 HA ASP 140 HA ASP 140 17.677 3.450 4.365 1131 HB2 ASP 140 HB2 ASP 140 20.275 3.863 4.234 1132 HB3 ASP 140 HB3 ASP 140 20.230 3.191 2.599 1133 H GLU 141 H GLU 141 19.363 1.660 1.631 1134 HA GLU 141 HA GLU 141 17.489 2.415 -0.274 1135 HB2 GLU 141 HB2 GLU 141 19.216 -0.084 -0.361 1136 HB3 GLU 141 HB3 GLU 141 18.516 0.793 -1.729 1137 HG2 GLU 141 HG2 GLU 141 19.904 2.823 -0.972 1138 HG3 GLU 141 HG3 GLU 141 20.733 1.728 0.142 1139 H MET 142 H MET 142 16.929 0.253 2.349 1140 HA MET 142 HA MET 142 15.283 -1.578 0.841 1141 HB2 MET 142 HB2 MET 142 16.472 -2.226 2.943 1142 HB3 MET 142 HB3 MET 142 15.601 -0.977 3.842 1143 HG2 MET 142 HG2 MET 142 13.436 -2.165 3.291 1144 HG3 MET 142 HG3 MET 142 14.380 -3.452 2.529 1145 HE1 MET 142 HE1 MET 142 16.069 -5.382 4.984 1146 HE2 MET 142 HE2 MET 142 16.460 -4.277 3.624 1147 HE3 MET 142 HE3 MET 142 16.945 -3.846 5.299 1148 H VAL 143 H VAL 143 14.927 1.593 2.347 1149 HA VAL 143 HA VAL 143 12.024 1.386 2.195 1150 HB VAL 143 HB VAL 143 13.700 3.420 3.709 1151 HG11 VAL 143 HG11 VAL 143 11.535 4.060 4.724 1152 HG12 VAL 143 HG12 VAL 143 11.547 4.322 2.947 1153 HG13 VAL 143 HG13 VAL 143 10.691 2.904 3.640 1154 HG21 VAL 143 HG21 VAL 143 12.881 2.257 5.724 1155 HG22 VAL 143 HG22 VAL 143 12.096 1.020 4.685 1156 HG23 VAL 143 HG23 VAL 143 13.885 1.185 4.689 1157 H ALA 144 H ALA 144 10.831 3.240 1.233 1158 HA ALA 144 HA ALA 144 12.505 4.968 -0.474 1159 HB1 ALA 144 HB1 ALA 144 10.852 4.651 -2.276 1160 HB2 ALA 144 HB2 ALA 144 11.669 3.113 -1.839 1161 HB3 ALA 144 HB3 ALA 144 9.997 3.434 -1.270 1162 H MET 145 H MET 145 11.984 7.093 -0.223 1163 HA MET 145 HA MET 145 9.375 7.736 0.945 1164 HB2 MET 145 HB2 MET 145 12.062 9.111 1.216 1165 HB3 MET 145 HB3 MET 145 10.532 9.858 1.694 1166 HG2 MET 145 HG2 MET 145 10.114 8.068 3.324 1167 HG3 MET 145 HG3 MET 145 11.557 7.197 2.788 1168 HE1 MET 145 HE1 MET 145 11.670 11.351 4.886 1169 HE2 MET 145 HE2 MET 145 11.372 11.197 3.121 1170 HE3 MET 145 HE3 MET 145 10.188 10.528 4.294 1171 H LEU 146 H LEU 146 8.045 9.342 -0.054 1172 HA LEU 146 HA LEU 146 9.242 10.466 -2.507 1173 HB2 LEU 146 HB2 LEU 146 6.369 9.641 -1.941 1174 HB3 LEU 146 HB3 LEU 146 6.917 10.491 -3.392 1175 HG LEU 146 HG LEU 146 6.666 8.194 -3.958 1176 HD11 LEU 146 HD11 LEU 146 8.953 7.529 -4.633 1177 HD12 LEU 146 HD12 LEU 146 8.630 9.269 -4.939 1178 HD13 LEU 146 HD13 LEU 146 9.630 8.775 -3.531 1179 HD21 LEU 146 HD21 LEU 146 7.832 6.351 -2.798 1180 HD22 LEU 146 HD22 LEU 146 8.441 7.517 -1.575 1181 HD23 LEU 146 HD23 LEU 146 6.677 7.212 -1.726 1182 HA PRO 147 HA PRO 147 8.299 14.252 -0.138 1183 HB2 PRO 147 HB2 PRO 147 9.988 15.858 -1.652 1184 HB3 PRO 147 HB3 PRO 147 10.645 14.806 -0.390 1185 HG2 PRO 147 HG2 PRO 147 10.502 14.339 -3.383 1186 HG3 PRO 147 HG3 PRO 147 11.846 14.039 -2.273 1187 HD2 PRO 147 HD2 PRO 147 10.205 12.024 -3.114 1188 HD3 PRO 147 HD3 PRO 147 10.937 12.009 -1.504 1189 H ARG 148 H ARG 148 8.246 16.721 -1.529 1190 HA ARG 148 HA ARG 148 5.714 16.580 -2.693 1191 HB2 ARG 148 HB2 ARG 148 5.806 18.882 -2.944 1192 HB3 ARG 148 HB3 ARG 148 6.812 18.549 -1.528 1193 HG2 ARG 148 HG2 ARG 148 7.889 19.047 -4.342 1194 HG3 ARG 148 HG3 ARG 148 7.757 20.279 -3.080 1195 HD2 ARG 148 HD2 ARG 148 9.340 17.681 -2.756 1196 HD3 ARG 148 HD3 ARG 148 10.052 19.199 -3.319 1197 HE ARG 148 HE ARG 148 8.624 19.451 -0.780 1198 HH11 ARG 148 HH11 ARG 148 11.693 18.666 -2.306 1199 HH12 ARG 148 HH12 ARG 148 12.627 19.031 -0.894 1200 HH21 ARG 148 HH21 ARG 148 9.863 19.941 1.058 1201 HH22 ARG 148 HH22 ARG 148 11.585 19.757 1.020 1202 H GLN 149 H GLN 149 6.584 14.678 -4.135 1203 HA GLN 149 HA GLN 149 7.151 15.727 -6.775 1204 HB2 GLN 149 HB2 GLN 149 9.006 14.462 -5.923 1205 HB3 GLN 149 HB3 GLN 149 7.968 13.045 -5.708 1206 HG2 GLN 149 HG2 GLN 149 7.447 13.169 -8.204 1207 HG3 GLN 149 HG3 GLN 149 8.692 14.419 -8.333 1208 HE21 GLN 149 HE21 GLN 149 8.934 11.700 -6.042 1209 HE22 GLN 149 HE22 GLN 149 10.228 10.881 -6.852 1210 H GLU 150 H GLU 150 4.449 15.546 -5.547 1211 HA GLU 150 HA GLU 150 3.314 13.272 -6.931 1212 HB2 GLU 150 HB2 GLU 150 1.267 13.874 -5.811 1213 HB3 GLU 150 HB3 GLU 150 2.593 13.931 -4.641 1214 HG2 GLU 150 HG2 GLU 150 1.409 15.854 -4.105 1215 HG3 GLU 150 HG3 GLU 150 2.663 16.496 -5.174 1216 H GLU 151 H GLU 151 1.529 13.385 -8.447 1217 HA GLU 151 HA GLU 151 0.884 15.843 -9.723 1218 HB2 GLU 151 HB2 GLU 151 3.231 15.338 -10.593 1219 HB3 GLU 151 HB3 GLU 151 2.594 13.836 -11.277 1220 HG2 GLU 151 HG2 GLU 151 0.906 15.287 -12.564 1221 HG3 GLU 151 HG3 GLU 151 1.843 16.691 -12.037 1222 H CYS 152 H CYS 152 1.184 12.210 -10.171 1223 HA CYS 152 HA CYS 152 -1.308 12.360 -11.767 1224 HB2 CYS 152 HB2 CYS 152 0.600 10.844 -12.485 1225 HB3 CYS 152 HB3 CYS 152 0.645 10.103 -10.880 1226 H THR 153 H THR 153 -3.225 11.931 -10.774 1227 HA THR 153 HA THR 153 -3.162 10.767 -8.074 1228 HB THR 153 HB THR 153 -5.468 12.408 -8.273 1229 HG1 THR 153 HG1 THR 153 -4.556 14.502 -8.879 1230 HG21 THR 153 HG21 THR 153 -4.313 13.842 -6.601 1231 HG22 THR 153 HG22 THR 153 -4.072 12.094 -6.263 1232 HG23 THR 153 HG23 THR 153 -2.753 13.053 -7.016 1233 H VAL 154 H VAL 154 -4.933 9.396 -7.519 1234 HA VAL 154 HA VAL 154 -6.324 8.349 -9.853 1235 HB VAL 154 HB VAL 154 -5.065 6.804 -8.362 1236 HG11 VAL 154 HG11 VAL 154 -5.947 6.264 -6.117 1237 HG12 VAL 154 HG12 VAL 154 -5.363 7.959 -6.228 1238 HG13 VAL 154 HG13 VAL 154 -7.125 7.612 -6.264 1239 HG21 VAL 154 HG21 VAL 154 -6.864 5.125 -8.093 1240 HG22 VAL 154 HG22 VAL 154 -8.091 6.410 -8.354 1241 HG23 VAL 154 HG23 VAL 154 -6.957 5.970 -9.675 1242 H ASP 155 H ASP 155 -8.604 8.247 -10.015 1243 HA ASP 155 HA ASP 155 -10.032 10.305 -8.744 1244 HB2 ASP 155 HB2 ASP 155 -10.898 9.718 -10.830 1245 HB3 ASP 155 HB3 ASP 155 -10.650 7.985 -10.577 1246 H GLU 156 H GLU 156 -11.951 10.128 -7.331 1247 HA GLU 156 HA GLU 156 -11.666 7.853 -5.498 1248 HB2 GLU 156 HB2 GLU 156 -12.614 9.387 -3.768 1249 HB3 GLU 156 HB3 GLU 156 -11.047 9.909 -4.399 1250 HG2 GLU 156 HG2 GLU 156 -12.423 11.423 -6.017 1251 HG3 GLU 156 HG3 GLU 156 -13.792 11.091 -4.947 1252 H VAL 157 H VAL 157 -13.900 9.437 -7.735 1253 HA VAL 157 HA VAL 157 -15.710 7.397 -7.615 1254 HB VAL 157 HB VAL 157 -16.302 7.942 -5.357 1255 HG11 VAL 157 HG11 VAL 157 -17.168 10.153 -4.678 1256 HG12 VAL 157 HG12 VAL 157 -15.462 10.228 -5.234 1257 HG13 VAL 157 HG13 VAL 157 -16.783 10.795 -6.310 1258 HG21 VAL 157 HG21 VAL 157 -18.707 8.470 -5.584 1259 HG22 VAL 157 HG22 VAL 157 -18.422 8.998 -7.277 1260 HG23 VAL 157 HG23 VAL 157 -18.149 7.285 -6.813 1261 HN1 EB4 158 HN1 EB4 158 4.064 -5.691 -7.361 1262 H8 EB4 158 H8 EB4 158 -2.542 -6.091 -5.101 1263 HN2 EB4 158 HN2 EB4 158 1.467 -4.871 -8.973 1264 H9 EB4 158 H9 EB4 158 0.638 -0.578 -3.205 1265 H10 EB4 158 H10 EB4 158 4.454 -7.619 -1.802 1266 HN3 EB4 158 HN3 EB4 158 3.849 -2.662 -7.635 1267 H7 EB4 158 H7 EB4 158 2.717 -5.850 -1.741 1268 H11 EB4 158 H11 EB4 158 -3.750 -6.738 -7.169 1269 H12 EB4 158 H12 EB4 158 2.096 1.377 -3.643 1270 H15 EB4 158 H15 EB4 158 3.768 1.290 -5.466 1271 H14 EB4 158 H14 EB4 158 -2.662 -6.472 -9.377 1272 H13 EB4 158 H13 EB4 158 5.630 -8.064 -3.945 1273 H22 EB4 158 H22 EB4 158 4.823 -6.531 -7.810 1274 H30 EB4 158 H30 EB4 158 6.522 -3.092 -10.089 1275 H30A EB4 158 H30A EB4 158 6.716 -2.682 -8.311 1276 H24 EB4 158 H24 EB4 158 4.392 -1.825 -8.344 1277 H28 EB4 158 H28 EB4 158 3.921 -8.179 -9.515 1278 H28A EB4 158 H28A EB4 158 4.772 -7.158 -10.783 1279 H23 EB4 158 H23 EB4 158 1.194 -4.920 -10.176 1280 H29 EB4 158 H29 EB4 158 1.103 -2.799 -11.205 1281 H29A EB4 158 H29A EB4 158 2.594 -3.272 -12.234 Start of MODEL 4 1 H1 MET 1 H1 MET 1 -28.875 4.246 -5.271 2 H2 MET 1 H2 MET 1 -28.168 3.866 -3.850 3 H3 MET 1 H3 MET 1 -28.200 5.418 -4.356 4 HA MET 1 HA MET 1 -26.423 3.292 -5.031 5 HB2 MET 1 HB2 MET 1 -27.687 5.063 -7.155 6 HB3 MET 1 HB3 MET 1 -26.052 4.418 -7.351 7 HG2 MET 1 HG2 MET 1 -26.869 2.125 -7.239 8 HG3 MET 1 HG3 MET 1 -28.495 2.671 -6.810 9 HE1 MET 1 HE1 MET 1 -28.827 1.225 -10.507 10 HE2 MET 1 HE2 MET 1 -27.686 0.655 -9.243 11 HE3 MET 1 HE3 MET 1 -29.377 1.072 -8.805 12 H THR 2 H THR 2 -24.287 4.008 -4.783 13 HA THR 2 HA THR 2 -22.679 5.310 -3.979 14 HB THR 2 HB THR 2 -23.818 7.517 -5.752 15 HG1 THR 2 HG1 THR 2 -22.647 6.404 -7.486 16 HG21 THR 2 HG21 THR 2 -21.415 7.974 -6.144 17 HG22 THR 2 HG22 THR 2 -21.820 8.045 -4.395 18 HG23 THR 2 HG23 THR 2 -20.979 6.606 -5.065 19 H VAL 3 H VAL 3 -24.592 5.204 -2.062 20 HA VAL 3 HA VAL 3 -25.233 7.957 -1.335 21 HB VAL 3 HB VAL 3 -26.560 6.784 0.516 22 HG11 VAL 3 HG11 VAL 3 -28.401 6.138 -1.003 23 HG12 VAL 3 HG12 VAL 3 -27.619 7.672 -1.513 24 HG13 VAL 3 HG13 VAL 3 -27.256 6.145 -2.386 25 HG21 VAL 3 HG21 VAL 3 -27.094 4.394 0.154 26 HG22 VAL 3 HG22 VAL 3 -25.898 4.335 -1.185 27 HG23 VAL 3 HG23 VAL 3 -25.349 4.645 0.497 28 HA PRO 4 HA PRO 4 -22.138 7.983 1.866 29 HB2 PRO 4 HB2 PRO 4 -23.306 9.663 3.728 30 HB3 PRO 4 HB3 PRO 4 -22.857 10.301 2.141 31 HG2 PRO 4 HG2 PRO 4 -25.572 9.384 3.133 32 HG3 PRO 4 HG3 PRO 4 -25.161 10.823 2.190 33 HD2 PRO 4 HD2 PRO 4 -26.179 8.534 1.039 34 HD3 PRO 4 HD3 PRO 4 -25.115 9.645 0.165 35 H ASP 5 H ASP 5 -23.199 5.517 2.011 36 HA ASP 5 HA ASP 5 -23.986 5.220 4.842 37 HB2 ASP 5 HB2 ASP 5 -24.373 3.492 2.380 38 HB3 ASP 5 HB3 ASP 5 -24.484 2.817 4.011 39 H ARG 6 H ARG 6 -22.793 2.265 3.544 40 HA ARG 6 HA ARG 6 -20.690 2.111 5.325 41 HB2 ARG 6 HB2 ARG 6 -21.467 0.617 2.821 42 HB3 ARG 6 HB3 ARG 6 -19.878 0.312 3.535 43 HG2 ARG 6 HG2 ARG 6 -21.324 -1.332 4.463 44 HG3 ARG 6 HG3 ARG 6 -21.070 -0.147 5.751 45 HD2 ARG 6 HD2 ARG 6 -23.417 -0.627 5.742 46 HD3 ARG 6 HD3 ARG 6 -23.240 0.983 5.032 47 HE ARG 6 HE ARG 6 -23.280 -0.435 2.783 48 HH11 ARG 6 HH11 ARG 6 -25.205 -0.929 5.682 49 HH12 ARG 6 HH12 ARG 6 -26.540 -1.625 4.826 50 HH21 ARG 6 HH21 ARG 6 -25.042 -1.353 1.669 51 HH22 ARG 6 HH22 ARG 6 -26.447 -1.867 2.542 52 H SER 7 H SER 7 -20.834 3.762 2.206 53 HA SER 7 HA SER 7 -18.273 3.629 1.249 54 HB2 SER 7 HB2 SER 7 -19.695 6.310 1.433 55 HB3 SER 7 HB3 SER 7 -18.911 5.560 0.036 56 HG SER 7 HG SER 7 -21.498 5.593 0.511 57 H GLU 8 H GLU 8 -19.410 5.440 4.156 58 HA GLU 8 HA GLU 8 -17.170 7.079 4.430 59 HB2 GLU 8 HB2 GLU 8 -19.033 5.986 6.563 60 HB3 GLU 8 HB3 GLU 8 -17.866 7.296 6.787 61 HG2 GLU 8 HG2 GLU 8 -19.045 8.571 4.934 62 HG3 GLU 8 HG3 GLU 8 -20.269 7.296 4.899 63 H ILE 9 H ILE 9 -17.547 3.606 5.074 64 HA ILE 9 HA ILE 9 -15.365 3.502 6.908 65 HB ILE 9 HB ILE 9 -16.681 1.260 5.279 66 HG12 ILE 9 HG12 ILE 9 -17.323 2.219 8.110 67 HG13 ILE 9 HG13 ILE 9 -18.273 2.640 6.679 68 HG21 ILE 9 HG21 ILE 9 -15.854 -0.205 7.096 69 HG22 ILE 9 HG22 ILE 9 -14.510 0.631 6.247 70 HG23 ILE 9 HG23 ILE 9 -15.048 1.206 7.861 71 HD11 ILE 9 HD11 ILE 9 -19.306 0.785 7.912 72 HD12 ILE 9 HD12 ILE 9 -18.768 0.243 6.286 73 HD13 ILE 9 HD13 ILE 9 -17.803 -0.184 7.740 74 H ALA 10 H ALA 10 -15.655 3.493 3.360 75 HA ALA 10 HA ALA 10 -12.880 2.505 3.162 76 HB1 ALA 10 HB1 ALA 10 -13.447 2.119 0.783 77 HB2 ALA 10 HB2 ALA 10 -14.544 1.219 1.884 78 HB3 ALA 10 HB3 ALA 10 -15.111 2.724 1.086 79 H GLY 11 H GLY 11 -12.158 3.621 0.675 80 HA2 GLY 11 HA2 GLY 11 -12.702 6.155 0.041 81 HA3 GLY 11 HA3 GLY 11 -11.760 6.370 1.522 82 H LYS 12 H LYS 12 -10.127 7.478 0.237 83 HA LYS 12 HA LYS 12 -8.493 5.639 -1.384 84 HB2 LYS 12 HB2 LYS 12 -7.702 7.675 -2.550 85 HB3 LYS 12 HB3 LYS 12 -9.442 7.424 -2.744 86 HG2 LYS 12 HG2 LYS 12 -9.856 9.091 -0.909 87 HG3 LYS 12 HG3 LYS 12 -8.114 9.375 -0.803 88 HD2 LYS 12 HD2 LYS 12 -8.053 10.153 -3.143 89 HD3 LYS 12 HD3 LYS 12 -9.763 9.754 -3.354 90 HE2 LYS 12 HE2 LYS 12 -9.643 12.125 -2.937 91 HE3 LYS 12 HE3 LYS 12 -10.315 11.378 -1.482 92 HZ1 LYS 12 HZ1 LYS 12 -8.592 13.005 -1.006 93 HZ2 LYS 12 HZ2 LYS 12 -8.164 11.528 -0.457 94 HZ3 LYS 12 HZ3 LYS 12 -7.480 12.124 -1.814 95 H TRP 13 H TRP 13 -6.205 5.613 -1.020 96 HA TRP 13 HA TRP 13 -5.279 7.266 1.239 97 HB2 TRP 13 HB2 TRP 13 -4.470 4.368 0.780 98 HB3 TRP 13 HB3 TRP 13 -4.097 5.399 2.168 99 HD1 TRP 13 HD1 TRP 13 -6.374 2.687 1.216 100 HE1 TRP 13 HE1 TRP 13 -8.405 2.548 2.811 101 HE3 TRP 13 HE3 TRP 13 -5.922 7.268 3.499 102 HZ2 TRP 13 HZ2 TRP 13 -9.658 4.146 4.758 103 HZ3 TRP 13 HZ3 TRP 13 -7.589 7.900 5.227 104 HH2 TRP 13 HH2 TRP 13 -9.428 6.359 5.846 105 H TYR 14 H TYR 14 -3.131 8.086 0.945 106 HA TYR 14 HA TYR 14 -2.037 7.564 -1.740 107 HB2 TYR 14 HB2 TYR 14 -1.439 9.794 0.267 108 HB3 TYR 14 HB3 TYR 14 -0.808 9.672 -1.380 109 HD1 TYR 14 HD1 TYR 14 -4.031 9.908 0.540 110 HD2 TYR 14 HD2 TYR 14 -2.017 10.611 -3.186 111 HE1 TYR 14 HE1 TYR 14 -6.026 11.100 -0.307 112 HE2 TYR 14 HE2 TYR 14 -4.015 11.802 -4.041 113 HH TYR 14 HH TYR 14 -6.311 12.066 -3.683 114 H VAL 15 H VAL 15 -0.213 6.173 -1.947 115 HA VAL 15 HA VAL 15 1.087 5.610 0.647 116 HB VAL 15 HB VAL 15 0.467 3.803 -0.938 117 HG11 VAL 15 HG11 VAL 15 1.623 3.474 -3.132 118 HG12 VAL 15 HG12 VAL 15 0.561 4.922 -3.091 119 HG13 VAL 15 HG13 VAL 15 2.342 5.111 -2.962 120 HG21 VAL 15 HG21 VAL 15 2.644 2.611 -1.173 121 HG22 VAL 15 HG22 VAL 15 3.489 4.141 -0.757 122 HG23 VAL 15 HG23 VAL 15 2.405 3.360 0.443 123 H VAL 16 H VAL 16 2.533 6.946 1.295 124 HA VAL 16 HA VAL 16 4.246 8.342 -0.645 125 HB VAL 16 HB VAL 16 4.630 10.014 1.098 126 HG11 VAL 16 HG11 VAL 16 2.373 11.023 1.263 127 HG12 VAL 16 HG12 VAL 16 2.729 10.400 -0.383 128 HG13 VAL 16 HG13 VAL 16 1.652 9.472 0.714 129 HG21 VAL 16 HG21 VAL 16 3.366 9.991 3.235 130 HG22 VAL 16 HG22 VAL 16 2.726 8.364 2.822 131 HG23 VAL 16 HG23 VAL 16 4.487 8.596 3.087 132 H ALA 17 H ALA 17 4.210 5.621 1.271 133 HA ALA 17 HA ALA 17 7.103 5.826 1.721 134 HB1 ALA 17 HB1 ALA 17 6.818 4.635 3.861 135 HB2 ALA 17 HB2 ALA 17 6.024 6.246 3.877 136 HB3 ALA 17 HB3 ALA 17 5.035 4.759 3.688 137 H LEU 18 H LEU 18 8.223 3.805 1.506 138 HA LEU 18 HA LEU 18 6.644 1.466 0.837 139 HB2 LEU 18 HB2 LEU 18 8.655 2.721 -1.104 140 HB3 LEU 18 HB3 LEU 18 7.828 1.173 -1.324 141 HG LEU 18 HG LEU 18 6.339 3.818 -1.125 142 HD11 LEU 18 HD11 LEU 18 6.220 3.771 -3.596 143 HD12 LEU 18 HD12 LEU 18 7.909 3.937 -3.008 144 HD13 LEU 18 HD13 LEU 18 7.321 2.353 -3.616 145 HD21 LEU 18 HD21 LEU 18 4.549 2.547 -2.267 146 HD22 LEU 18 HD22 LEU 18 5.579 1.076 -2.233 147 HD23 LEU 18 HD23 LEU 18 5.002 1.805 -0.696 148 H ALA 19 H ALA 19 7.881 -0.504 1.038 149 HA ALA 19 HA ALA 19 10.756 -0.226 1.569 150 HB1 ALA 19 HB1 ALA 19 10.535 -1.580 3.619 151 HB2 ALA 19 HB2 ALA 19 9.672 -0.013 3.784 152 HB3 ALA 19 HB3 ALA 19 8.746 -1.521 3.476 153 H SER 20 H SER 20 11.832 -2.017 0.663 154 HA SER 20 HA SER 20 10.171 -4.353 0.009 155 HB2 SER 20 HB2 SER 20 12.154 -3.077 -1.952 156 HB3 SER 20 HB3 SER 20 11.016 -4.393 -2.272 157 HG SER 20 HG SER 20 10.435 -2.096 -2.970 158 H ASN 21 H ASN 21 11.324 -6.349 -0.122 159 HA ASN 21 HA ASN 21 13.883 -6.222 1.288 160 HB2 ASN 21 HB2 ASN 21 11.734 -7.749 1.794 161 HB3 ASN 21 HB3 ASN 21 12.426 -8.773 0.528 162 HD21 ASN 21 HD21 ASN 21 15.200 -8.474 1.064 163 HD22 ASN 21 HD22 ASN 21 15.540 -9.211 2.595 164 H THR 22 H THR 22 12.681 -6.526 -2.017 165 HA THR 22 HA THR 22 15.168 -7.916 -2.744 166 HB THR 22 HB THR 22 13.816 -7.658 -5.087 167 HG1 THR 22 HG1 THR 22 11.476 -7.949 -4.430 168 HG21 THR 22 HG21 THR 22 12.811 -9.882 -4.591 169 HG22 THR 22 HG22 THR 22 14.483 -9.782 -3.942 170 HG23 THR 22 HG23 THR 22 13.078 -9.616 -2.835 171 H GLU 23 H GLU 23 16.905 -6.922 -3.691 172 HA GLU 23 HA GLU 23 17.239 -4.220 -3.620 173 HB2 GLU 23 HB2 GLU 23 18.601 -5.503 -5.932 174 HB3 GLU 23 HB3 GLU 23 19.296 -4.681 -4.529 175 HG2 GLU 23 HG2 GLU 23 18.261 -7.551 -4.513 176 HG3 GLU 23 HG3 GLU 23 19.951 -7.091 -4.755 177 H PHE 24 H PHE 24 16.147 -6.242 -6.470 178 HA PHE 24 HA PHE 24 16.177 -4.274 -8.383 179 HB2 PHE 24 HB2 PHE 24 14.257 -6.622 -7.906 180 HB3 PHE 24 HB3 PHE 24 14.234 -5.651 -9.384 181 HD1 PHE 24 HD1 PHE 24 16.260 -5.612 -10.873 182 HD2 PHE 24 HD2 PHE 24 15.880 -8.337 -7.576 183 HE1 PHE 24 HE1 PHE 24 18.033 -7.036 -11.851 184 HE2 PHE 24 HE2 PHE 24 17.658 -9.763 -8.547 185 HZ PHE 24 HZ PHE 24 18.738 -9.114 -10.688 186 H PHE 25 H PHE 25 13.342 -5.131 -6.183 187 HA PHE 25 HA PHE 25 11.660 -3.170 -7.243 188 HB2 PHE 25 HB2 PHE 25 11.782 -4.674 -4.621 189 HB3 PHE 25 HB3 PHE 25 10.610 -3.369 -4.844 190 HD1 PHE 25 HD1 PHE 25 11.693 -6.702 -6.052 191 HD2 PHE 25 HD2 PHE 25 8.719 -3.618 -6.318 192 HE1 PHE 25 HE1 PHE 25 10.193 -8.258 -7.259 193 HE2 PHE 25 HE2 PHE 25 7.216 -5.167 -7.531 194 HZ PHE 25 HZ PHE 25 7.951 -7.493 -8.003 195 H LEU 26 H LEU 26 14.044 -2.992 -4.499 196 HA LEU 26 HA LEU 26 13.354 -0.400 -3.658 197 HB2 LEU 26 HB2 LEU 26 16.095 -1.744 -3.683 198 HB3 LEU 26 HB3 LEU 26 15.584 -0.402 -2.651 199 HG LEU 26 HG LEU 26 14.433 -3.224 -2.559 200 HD11 LEU 26 HD11 LEU 26 15.652 -3.414 -0.420 201 HD12 LEU 26 HD12 LEU 26 16.765 -3.165 -1.807 202 HD13 LEU 26 HD13 LEU 26 16.390 -1.801 -0.701 203 HD21 LEU 26 HD21 LEU 26 13.379 -2.457 -0.460 204 HD22 LEU 26 HD22 LEU 26 14.019 -0.804 -0.748 205 HD23 LEU 26 HD23 LEU 26 12.816 -1.510 -1.879 206 H ARG 27 H ARG 27 15.762 -1.662 -6.071 207 HA ARG 27 HA ARG 27 16.931 0.770 -6.742 208 HB2 ARG 27 HB2 ARG 27 17.668 -1.592 -7.364 209 HB3 ARG 27 HB3 ARG 27 16.357 -1.639 -8.550 210 HG2 ARG 27 HG2 ARG 27 17.417 0.497 -9.570 211 HG3 ARG 27 HG3 ARG 27 18.821 0.154 -8.552 212 HD2 ARG 27 HD2 ARG 27 19.376 -0.928 -10.562 213 HD3 ARG 27 HD3 ARG 27 18.736 -2.251 -9.578 214 HE ARG 27 HE ARG 27 16.581 -1.130 -11.057 215 HH11 ARG 27 HH11 ARG 27 19.507 -3.008 -11.559 216 HH12 ARG 27 HH12 ARG 27 18.924 -3.757 -13.008 217 HH21 ARG 27 HH21 ARG 27 15.829 -2.108 -12.963 218 HH22 ARG 27 HH22 ARG 27 16.828 -3.243 -13.808 219 H GLU 28 H GLU 28 14.058 -0.956 -8.225 220 HA GLU 28 HA GLU 28 13.674 1.097 -10.152 221 HB2 GLU 28 HB2 GLU 28 11.614 -0.932 -9.208 222 HB3 GLU 28 HB3 GLU 28 11.699 -0.109 -10.771 223 HG2 GLU 28 HG2 GLU 28 13.596 -2.252 -9.713 224 HG3 GLU 28 HG3 GLU 28 12.417 -2.419 -11.021 225 H LYS 29 H LYS 29 11.831 0.225 -7.083 226 HA LYS 29 HA LYS 29 10.027 2.312 -7.329 227 HB2 LYS 29 HB2 LYS 29 10.988 0.564 -5.098 228 HB3 LYS 29 HB3 LYS 29 10.140 2.049 -4.646 229 HG2 LYS 29 HG2 LYS 29 9.013 0.033 -6.644 230 HG3 LYS 29 HG3 LYS 29 8.704 -0.055 -4.905 231 HD2 LYS 29 HD2 LYS 29 6.837 1.114 -5.873 232 HD3 LYS 29 HD3 LYS 29 7.799 2.325 -5.015 233 HE2 LYS 29 HE2 LYS 29 8.180 3.498 -6.914 234 HE3 LYS 29 HE3 LYS 29 8.752 2.059 -7.769 235 HZ1 LYS 29 HZ1 LYS 29 6.891 2.520 -8.936 236 HZ2 LYS 29 HZ2 LYS 29 6.189 1.571 -7.809 237 HZ3 LYS 29 HZ3 LYS 29 6.083 3.196 -7.689 238 H ASP 30 H ASP 30 13.278 2.311 -5.644 239 HA ASP 30 HA ASP 30 13.034 4.866 -4.571 240 HB2 ASP 30 HB2 ASP 30 14.819 3.477 -3.832 241 HB3 ASP 30 HB3 ASP 30 15.412 3.205 -5.475 242 H LYS 31 H LYS 31 13.691 3.804 -7.940 243 HA LYS 31 HA LYS 31 14.493 6.461 -8.635 244 HB2 LYS 31 HB2 LYS 31 14.191 3.859 -10.167 245 HB3 LYS 31 HB3 LYS 31 14.344 5.397 -11.026 246 HG2 LYS 31 HG2 LYS 31 16.367 4.017 -9.226 247 HG3 LYS 31 HG3 LYS 31 16.555 4.547 -10.903 248 HD2 LYS 31 HD2 LYS 31 17.722 6.231 -9.775 249 HD3 LYS 31 HD3 LYS 31 16.123 6.972 -9.916 250 HE2 LYS 31 HE2 LYS 31 16.014 5.399 -7.547 251 HE3 LYS 31 HE3 LYS 31 17.603 6.173 -7.515 252 HZ1 LYS 31 HZ1 LYS 31 16.602 8.011 -6.889 253 HZ2 LYS 31 HZ2 LYS 31 15.740 8.085 -8.274 254 HZ3 LYS 31 HZ3 LYS 31 15.128 7.313 -6.972 255 H MET 32 H MET 32 11.199 4.735 -8.328 256 HA MET 32 HA MET 32 10.578 6.673 -10.559 257 HB2 MET 32 HB2 MET 32 9.110 4.605 -8.601 258 HB3 MET 32 HB3 MET 32 8.224 5.385 -9.918 259 HG2 MET 32 HG2 MET 32 9.971 4.166 -11.480 260 HG3 MET 32 HG3 MET 32 10.282 3.157 -10.061 261 HE1 MET 32 HE1 MET 32 6.272 4.024 -11.793 262 HE2 MET 32 HE2 MET 32 7.850 4.675 -12.351 263 HE3 MET 32 HE3 MET 32 7.151 3.218 -13.135 264 H LYS 33 H LYS 33 7.655 6.442 -8.760 265 HA LYS 33 HA LYS 33 8.390 8.756 -7.070 266 HB2 LYS 33 HB2 LYS 33 6.194 8.902 -9.217 267 HB3 LYS 33 HB3 LYS 33 6.481 10.119 -7.967 268 HG2 LYS 33 HG2 LYS 33 8.682 10.667 -8.947 269 HG3 LYS 33 HG3 LYS 33 8.505 9.375 -10.142 270 HD2 LYS 33 HD2 LYS 33 6.478 10.543 -11.078 271 HD3 LYS 33 HD3 LYS 33 6.703 11.848 -9.906 272 HE2 LYS 33 HE2 LYS 33 8.963 12.324 -10.841 273 HE3 LYS 33 HE3 LYS 33 8.786 10.987 -11.985 274 HZ1 LYS 33 HZ1 LYS 33 8.249 13.089 -12.992 275 HZ2 LYS 33 HZ2 LYS 33 6.911 12.154 -12.954 276 HZ3 LYS 33 HZ3 LYS 33 7.074 13.388 -11.898 277 H MET 34 H MET 34 5.946 9.529 -6.071 278 HA MET 34 HA MET 34 5.325 7.266 -4.452 279 HB2 MET 34 HB2 MET 34 5.159 9.580 -3.616 280 HB3 MET 34 HB3 MET 34 4.086 10.043 -4.943 281 HG2 MET 34 HG2 MET 34 2.345 8.463 -4.008 282 HG3 MET 34 HG3 MET 34 3.413 8.168 -2.630 283 HE1 MET 34 HE1 MET 34 1.341 12.210 -3.604 284 HE2 MET 34 HE2 MET 34 2.822 11.725 -4.496 285 HE3 MET 34 HE3 MET 34 1.329 10.737 -4.631 286 H ALA 35 H ALA 35 3.281 6.225 -4.241 287 HA ALA 35 HA ALA 35 1.828 5.947 -6.761 288 HB1 ALA 35 HB1 ALA 35 1.344 3.640 -6.098 289 HB2 ALA 35 HB2 ALA 35 3.095 3.970 -6.322 290 HB3 ALA 35 HB3 ALA 35 2.408 3.847 -4.667 291 H MET 36 H MET 36 -0.429 4.748 -6.253 292 HA MET 36 HA MET 36 -1.683 6.319 -4.100 293 HB2 MET 36 HB2 MET 36 -2.697 5.725 -6.938 294 HB3 MET 36 HB3 MET 36 -3.678 6.461 -5.663 295 HG2 MET 36 HG2 MET 36 -1.062 7.734 -6.488 296 HG3 MET 36 HG3 MET 36 -2.510 7.952 -7.480 297 HE1 MET 36 HE1 MET 36 -1.789 11.239 -5.190 298 HE2 MET 36 HE2 MET 36 -0.631 10.064 -5.901 299 HE3 MET 36 HE3 MET 36 -1.979 10.711 -6.896 300 H ALA 37 H ALA 37 -3.915 5.360 -3.483 301 HA ALA 37 HA ALA 37 -4.437 2.657 -4.282 302 HB1 ALA 37 HB1 ALA 37 -4.106 1.728 -1.973 303 HB2 ALA 37 HB2 ALA 37 -2.554 2.311 -2.665 304 HB3 ALA 37 HB3 ALA 37 -3.421 3.302 -1.444 305 H ARG 38 H ARG 38 -6.604 2.389 -4.199 306 HA ARG 38 HA ARG 38 -8.152 3.844 -2.136 307 HB2 ARG 38 HB2 ARG 38 -8.398 5.143 -4.151 308 HB3 ARG 38 HB3 ARG 38 -8.702 3.694 -5.119 309 HG2 ARG 38 HG2 ARG 38 -10.546 4.233 -2.793 310 HG3 ARG 38 HG3 ARG 38 -10.682 5.278 -4.213 311 HD2 ARG 38 HD2 ARG 38 -10.821 3.152 -5.644 312 HD3 ARG 38 HD3 ARG 38 -10.927 2.229 -4.139 313 HE ARG 38 HE ARG 38 -13.146 2.852 -3.982 314 HH11 ARG 38 HH11 ARG 38 -11.523 5.123 -6.127 315 HH12 ARG 38 HH12 ARG 38 -12.967 6.016 -6.469 316 HH21 ARG 38 HH21 ARG 38 -15.028 4.062 -4.435 317 HH22 ARG 38 HH22 ARG 38 -14.948 5.416 -5.513 318 H ILE 39 H ILE 39 -9.652 2.439 -1.143 319 HA ILE 39 HA ILE 39 -9.777 -0.221 -2.348 320 HB ILE 39 HB ILE 39 -10.250 0.363 0.603 321 HG12 ILE 39 HG12 ILE 39 -8.060 1.272 0.183 322 HG13 ILE 39 HG13 ILE 39 -7.903 -0.259 1.055 323 HG21 ILE 39 HG21 ILE 39 -9.598 -2.016 0.846 324 HG22 ILE 39 HG22 ILE 39 -11.003 -1.810 -0.255 325 HG23 ILE 39 HG23 ILE 39 -9.370 -2.127 -0.932 326 HD11 ILE 39 HD11 ILE 39 -6.199 -0.059 -0.697 327 HD12 ILE 39 HD12 ILE 39 -7.319 -1.416 -1.056 328 HD13 ILE 39 HD13 ILE 39 -7.479 0.138 -1.941 329 H SER 40 H SER 40 -11.780 -1.343 -2.422 330 HA SER 40 HA SER 40 -14.134 0.197 -1.537 331 HB2 SER 40 HB2 SER 40 -13.742 -1.267 -4.193 332 HB3 SER 40 HB3 SER 40 -15.275 -0.600 -3.616 333 HG SER 40 HG SER 40 -14.148 0.871 -5.039 334 H PHE 41 H PHE 41 -15.674 -1.047 -0.420 335 HA PHE 41 HA PHE 41 -14.883 -3.731 0.224 336 HB2 PHE 41 HB2 PHE 41 -17.074 -3.666 1.547 337 HB3 PHE 41 HB3 PHE 41 -15.806 -2.531 2.028 338 HD1 PHE 41 HD1 PHE 41 -19.138 -2.868 0.466 339 HD2 PHE 41 HD2 PHE 41 -16.087 -0.123 1.732 340 HE1 PHE 41 HE1 PHE 41 -20.743 -0.994 0.271 341 HE2 PHE 41 HE2 PHE 41 -17.690 1.752 1.539 342 HZ PHE 41 HZ PHE 41 -20.022 1.322 0.806 343 H LEU 42 H LEU 42 -15.176 -5.376 -1.204 344 HA LEU 42 HA LEU 42 -17.229 -5.247 -3.194 345 HB2 LEU 42 HB2 LEU 42 -14.897 -6.348 -3.333 346 HB3 LEU 42 HB3 LEU 42 -15.548 -7.642 -2.319 347 HG LEU 42 HG LEU 42 -15.496 -8.239 -4.706 348 HD11 LEU 42 HD11 LEU 42 -17.822 -9.049 -4.909 349 HD12 LEU 42 HD12 LEU 42 -17.163 -9.288 -3.255 350 HD13 LEU 42 HD13 LEU 42 -18.314 -7.948 -3.578 351 HD21 LEU 42 HD21 LEU 42 -17.062 -7.170 -6.297 352 HD22 LEU 42 HD22 LEU 42 -17.510 -5.970 -5.039 353 HD23 LEU 42 HD23 LEU 42 -15.833 -6.016 -5.680 354 H GLY 43 H GLY 43 -16.681 -7.081 -0.118 355 HA2 GLY 43 HA2 GLY 43 -19.499 -7.504 0.223 356 HA3 GLY 43 HA3 GLY 43 -18.622 -8.966 -0.249 357 H GLU 44 H GLU 44 -19.712 -9.200 2.204 358 HA GLU 44 HA GLU 44 -18.390 -8.087 4.376 359 HB2 GLU 44 HB2 GLU 44 -19.424 -10.958 4.148 360 HB3 GLU 44 HB3 GLU 44 -19.270 -9.992 5.622 361 HG2 GLU 44 HG2 GLU 44 -21.017 -8.445 4.832 362 HG3 GLU 44 HG3 GLU 44 -21.132 -9.319 3.298 363 H ASP 45 H ASP 45 -17.495 -10.931 2.278 364 HA ASP 45 HA ASP 45 -15.020 -11.180 3.857 365 HB2 ASP 45 HB2 ASP 45 -16.508 -13.193 3.843 366 HB3 ASP 45 HB3 ASP 45 -16.495 -13.200 2.074 367 H GLU 46 H GLU 46 -16.069 -9.692 1.015 368 HA GLU 46 HA GLU 46 -13.449 -10.253 -0.194 369 HB2 GLU 46 HB2 GLU 46 -15.140 -11.387 -1.528 370 HB3 GLU 46 HB3 GLU 46 -16.089 -9.901 -1.661 371 HG2 GLU 46 HG2 GLU 46 -14.614 -8.910 -3.162 372 HG3 GLU 46 HG3 GLU 46 -13.216 -9.816 -2.568 373 H LEU 47 H LEU 47 -12.415 -8.524 -1.274 374 HA LEU 47 HA LEU 47 -13.560 -5.880 -0.924 375 HB2 LEU 47 HB2 LEU 47 -11.514 -5.011 0.098 376 HB3 LEU 47 HB3 LEU 47 -12.409 -6.128 1.137 377 HG LEU 47 HG LEU 47 -10.094 -7.136 -0.531 378 HD11 LEU 47 HD11 LEU 47 -8.598 -6.660 1.369 379 HD12 LEU 47 HD12 LEU 47 -9.259 -5.153 0.650 380 HD13 LEU 47 HD13 LEU 47 -9.927 -5.780 2.195 381 HD21 LEU 47 HD21 LEU 47 -9.934 -8.745 1.336 382 HD22 LEU 47 HD22 LEU 47 -11.305 -7.926 2.157 383 HD23 LEU 47 HD23 LEU 47 -11.566 -8.758 0.587 384 H LYS 48 H LYS 48 -12.638 -4.279 -2.296 385 HA LYS 48 HA LYS 48 -10.896 -5.365 -4.395 386 HB2 LYS 48 HB2 LYS 48 -13.375 -5.042 -4.973 387 HB3 LYS 48 HB3 LYS 48 -13.032 -3.308 -4.905 388 HG2 LYS 48 HG2 LYS 48 -11.363 -3.486 -6.666 389 HG3 LYS 48 HG3 LYS 48 -11.417 -5.254 -6.620 390 HD2 LYS 48 HD2 LYS 48 -13.823 -3.487 -7.303 391 HD3 LYS 48 HD3 LYS 48 -12.746 -4.196 -8.513 392 HE2 LYS 48 HE2 LYS 48 -14.181 -5.888 -6.411 393 HE3 LYS 48 HE3 LYS 48 -14.922 -5.484 -7.965 394 HZ1 LYS 48 HZ1 LYS 48 -13.842 -7.563 -8.146 395 HZ2 LYS 48 HZ2 LYS 48 -12.955 -6.507 -9.020 396 HZ3 LYS 48 HZ3 LYS 48 -12.429 -6.998 -7.555 397 H VAL 49 H VAL 49 -9.202 -3.975 -5.135 398 HA VAL 49 HA VAL 49 -9.145 -1.368 -3.800 399 HB VAL 49 HB VAL 49 -6.736 -1.641 -3.362 400 HG11 VAL 49 HG11 VAL 49 -6.882 -3.344 -1.574 401 HG12 VAL 49 HG12 VAL 49 -8.339 -2.296 -1.616 402 HG13 VAL 49 HG13 VAL 49 -8.410 -3.959 -2.289 403 HG21 VAL 49 HG21 VAL 49 -5.631 -3.828 -3.655 404 HG22 VAL 49 HG22 VAL 49 -7.112 -4.468 -4.444 405 HG23 VAL 49 HG23 VAL 49 -6.183 -3.142 -5.221 406 H SER 50 H SER 50 -8.331 0.350 -5.091 407 HA SER 50 HA SER 50 -7.638 -0.413 -7.865 408 HB2 SER 50 HB2 SER 50 -8.182 2.054 -8.258 409 HB3 SER 50 HB3 SER 50 -9.553 1.018 -7.839 410 HG SER 50 HG SER 50 -8.659 1.838 -5.492 411 H TYR 51 H TYR 51 -5.502 -0.194 -8.430 412 HA TYR 51 HA TYR 51 -3.746 1.255 -6.573 413 HB2 TYR 51 HB2 TYR 51 -3.619 -1.035 -8.543 414 HB3 TYR 51 HB3 TYR 51 -2.192 0.009 -8.512 415 HD1 TYR 51 HD1 TYR 51 -1.408 0.570 -5.943 416 HD2 TYR 51 HD2 TYR 51 -3.502 -2.943 -7.252 417 HE1 TYR 51 HE1 TYR 51 -0.470 -0.697 -4.039 418 HE2 TYR 51 HE2 TYR 51 -2.597 -4.200 -5.325 419 HH TYR 51 HH TYR 51 0.016 -3.454 -3.746 420 H ALA 52 H ALA 52 -2.496 3.021 -7.293 421 HA ALA 52 HA ALA 52 -2.671 3.671 -10.166 422 HB1 ALA 52 HB1 ALA 52 -2.983 6.041 -9.574 423 HB2 ALA 52 HB2 ALA 52 -4.359 5.029 -9.019 424 HB3 ALA 52 HB3 ALA 52 -3.124 5.590 -7.841 425 H VAL 53 H VAL 53 -0.588 3.792 -10.949 426 HA VAL 53 HA VAL 53 1.390 4.979 -9.164 427 HB VAL 53 HB VAL 53 3.072 3.263 -9.914 428 HG11 VAL 53 HG11 VAL 53 2.304 1.473 -8.387 429 HG12 VAL 53 HG12 VAL 53 2.025 3.111 -7.703 430 HG13 VAL 53 HG13 VAL 53 0.654 2.182 -8.399 431 HG21 VAL 53 HG21 VAL 53 2.258 1.108 -10.818 432 HG22 VAL 53 HG22 VAL 53 0.605 1.796 -10.951 433 HG23 VAL 53 HG23 VAL 53 1.941 2.474 -11.940 434 HA PRO 54 HA PRO 54 2.445 6.945 -13.059 435 HB2 PRO 54 HB2 PRO 54 4.650 8.335 -12.187 436 HB3 PRO 54 HB3 PRO 54 3.058 8.769 -11.554 437 HG2 PRO 54 HG2 PRO 54 5.234 7.101 -10.276 438 HG3 PRO 54 HG3 PRO 54 4.179 8.313 -9.538 439 HD2 PRO 54 HD2 PRO 54 3.744 5.565 -9.367 440 HD3 PRO 54 HD3 PRO 54 2.471 6.776 -9.168 441 H LYS 55 H LYS 55 2.961 5.300 -14.417 442 HA LYS 55 HA LYS 55 5.603 4.098 -14.232 443 HB2 LYS 55 HB2 LYS 55 3.471 2.720 -14.476 444 HB3 LYS 55 HB3 LYS 55 3.370 3.337 -16.130 445 HG2 LYS 55 HG2 LYS 55 5.766 2.456 -16.475 446 HG3 LYS 55 HG3 LYS 55 5.602 1.642 -14.914 447 HD2 LYS 55 HD2 LYS 55 3.488 0.530 -15.787 448 HD3 LYS 55 HD3 LYS 55 3.814 1.251 -17.368 449 HE2 LYS 55 HE2 LYS 55 4.748 -0.910 -17.546 450 HE3 LYS 55 HE3 LYS 55 6.149 0.121 -17.224 451 HZ1 LYS 55 HZ1 LYS 55 6.159 -1.841 -15.851 452 HZ2 LYS 55 HZ2 LYS 55 6.001 -0.521 -14.902 453 HZ3 LYS 55 HZ3 LYS 55 4.708 -1.472 -15.200 454 HA PRO 56 HA PRO 56 7.475 6.648 -17.346 455 HB2 PRO 56 HB2 PRO 56 8.204 3.940 -18.611 456 HB3 PRO 56 HB3 PRO 56 9.283 5.298 -18.265 457 HG2 PRO 56 HG2 PRO 56 9.312 3.148 -16.684 458 HG3 PRO 56 HG3 PRO 56 9.456 4.763 -15.977 459 HD2 PRO 56 HD2 PRO 56 7.089 2.887 -15.975 460 HD3 PRO 56 HD3 PRO 56 7.595 4.050 -14.742 461 H ASN 57 H ASN 57 5.363 3.860 -18.297 462 HA ASN 57 HA ASN 57 5.012 4.999 -20.941 463 HB2 ASN 57 HB2 ASN 57 3.403 2.744 -19.648 464 HB3 ASN 57 HB3 ASN 57 3.665 3.047 -21.371 465 HD21 ASN 57 HD21 ASN 57 5.639 2.422 -22.346 466 HD22 ASN 57 HD22 ASN 57 6.761 1.362 -21.560 467 H GLY 58 H GLY 58 3.948 6.081 -17.993 468 HA2 GLY 58 HA2 GLY 58 2.327 7.866 -18.114 469 HA3 GLY 58 HA3 GLY 58 1.301 6.806 -19.090 470 H CYS 59 H CYS 59 0.245 7.944 -16.755 471 HA CYS 59 HA CYS 59 0.509 6.668 -14.387 472 HB2 CYS 59 HB2 CYS 59 -2.019 7.701 -15.713 473 HB3 CYS 59 HB3 CYS 59 -1.931 7.189 -14.023 474 H ARG 60 H ARG 60 0.255 4.584 -13.625 475 HA ARG 60 HA ARG 60 -1.374 2.818 -15.319 476 HB2 ARG 60 HB2 ARG 60 0.913 2.271 -13.376 477 HB3 ARG 60 HB3 ARG 60 -0.091 1.003 -14.091 478 HG2 ARG 60 HG2 ARG 60 1.633 3.002 -15.636 479 HG3 ARG 60 HG3 ARG 60 2.034 1.307 -15.329 480 HD2 ARG 60 HD2 ARG 60 0.993 0.834 -17.283 481 HD3 ARG 60 HD3 ARG 60 -0.528 1.127 -16.430 482 HE ARG 60 HE ARG 60 -0.146 3.590 -17.197 483 HH11 ARG 60 HH11 ARG 60 0.798 0.734 -19.017 484 HH12 ARG 60 HH12 ARG 60 0.694 1.528 -20.552 485 HH21 ARG 60 HH21 ARG 60 -0.271 4.619 -19.226 486 HH22 ARG 60 HH22 ARG 60 0.087 3.734 -20.671 487 H LYS 61 H LYS 61 -3.295 2.018 -14.538 488 HA LYS 61 HA LYS 61 -3.669 2.128 -11.604 489 HB2 LYS 61 HB2 LYS 61 -5.872 2.890 -11.880 490 HB3 LYS 61 HB3 LYS 61 -4.932 3.891 -12.994 491 HG2 LYS 61 HG2 LYS 61 -6.649 3.365 -14.414 492 HG3 LYS 61 HG3 LYS 61 -5.637 1.951 -14.737 493 HD2 LYS 61 HD2 LYS 61 -6.955 0.911 -12.656 494 HD3 LYS 61 HD3 LYS 61 -8.145 2.161 -13.042 495 HE2 LYS 61 HE2 LYS 61 -8.930 0.439 -14.383 496 HE3 LYS 61 HE3 LYS 61 -7.860 1.254 -15.532 497 HZ1 LYS 61 HZ1 LYS 61 -7.272 -0.955 -15.663 498 HZ2 LYS 61 HZ2 LYS 61 -6.122 -0.375 -14.659 499 HZ3 LYS 61 HZ3 LYS 61 -7.375 -1.231 -14.057 500 H TRP 62 H TRP 62 -4.729 0.287 -10.707 501 HA TRP 62 HA TRP 62 -5.678 -1.756 -12.561 502 HB2 TRP 62 HB2 TRP 62 -3.152 -2.082 -12.173 503 HB3 TRP 62 HB3 TRP 62 -3.539 -2.392 -10.476 504 HD1 TRP 62 HD1 TRP 62 -3.410 -4.954 -10.103 505 HE1 TRP 62 HE1 TRP 62 -4.268 -7.053 -11.345 506 HE3 TRP 62 HE3 TRP 62 -5.407 -2.676 -14.253 507 HZ2 TRP 62 HZ2 TRP 62 -5.606 -7.674 -13.741 508 HZ3 TRP 62 HZ3 TRP 62 -6.469 -4.096 -15.989 509 HH2 TRP 62 HH2 TRP 62 -6.565 -6.559 -15.735 510 H GLU 63 H GLU 63 -7.012 -3.410 -11.390 511 HA GLU 63 HA GLU 63 -7.739 -2.423 -8.678 512 HB2 GLU 63 HB2 GLU 63 -10.079 -3.453 -9.496 513 HB3 GLU 63 HB3 GLU 63 -9.655 -1.773 -9.849 514 HG2 GLU 63 HG2 GLU 63 -9.233 -4.053 -11.846 515 HG3 GLU 63 HG3 GLU 63 -10.724 -3.106 -11.756 516 H THR 64 H THR 64 -7.645 -3.973 -7.179 517 HA THR 64 HA THR 64 -7.479 -6.756 -8.084 518 HB THR 64 HB THR 64 -6.175 -5.756 -5.527 519 HG1 THR 64 HG1 THR 64 -4.580 -4.778 -6.545 520 HG21 THR 64 HG21 THR 64 -4.625 -7.656 -6.003 521 HG22 THR 64 HG22 THR 64 -6.339 -8.189 -5.944 522 HG23 THR 64 HG23 THR 64 -5.517 -7.982 -7.528 523 H THR 65 H THR 65 -8.426 -8.354 -6.714 524 HA THR 65 HA THR 65 -10.219 -7.299 -4.653 525 HB THR 65 HB THR 65 -10.702 -9.852 -6.199 526 HG1 THR 65 HG1 THR 65 -11.536 -8.605 -7.806 527 HG21 THR 65 HG21 THR 65 -13.011 -9.400 -5.487 528 HG22 THR 65 HG22 THR 65 -11.908 -9.507 -4.074 529 HG23 THR 65 HG23 THR 65 -12.472 -7.903 -4.654 530 H PHE 66 H PHE 66 -10.230 -8.220 -2.543 531 HA PHE 66 HA PHE 66 -8.434 -10.532 -2.245 532 HB2 PHE 66 HB2 PHE 66 -8.657 -8.285 -0.211 533 HB3 PHE 66 HB3 PHE 66 -7.497 -9.620 -0.245 534 HD1 PHE 66 HD1 PHE 66 -6.236 -9.634 -2.706 535 HD2 PHE 66 HD2 PHE 66 -7.748 -6.240 -0.685 536 HE1 PHE 66 HE1 PHE 66 -4.616 -8.256 -3.957 537 HE2 PHE 66 HE2 PHE 66 -6.145 -4.802 -1.905 538 HZ PHE 66 HZ PHE 66 -4.575 -5.808 -3.547 539 H LYS 67 H LYS 67 -8.802 -11.521 0.121 540 HA LYS 67 HA LYS 67 -11.718 -11.576 0.548 541 HB2 LYS 67 HB2 LYS 67 -9.587 -13.677 0.430 542 HB3 LYS 67 HB3 LYS 67 -10.785 -13.863 1.718 543 HG2 LYS 67 HG2 LYS 67 -11.505 -15.123 -0.230 544 HG3 LYS 67 HG3 LYS 67 -12.616 -13.771 0.023 545 HD2 LYS 67 HD2 LYS 67 -11.562 -12.475 -1.762 546 HD3 LYS 67 HD3 LYS 67 -10.251 -13.652 -1.918 547 HE2 LYS 67 HE2 LYS 67 -11.840 -15.387 -2.672 548 HE3 LYS 67 HE3 LYS 67 -13.207 -14.298 -2.401 549 HZ1 LYS 67 HZ1 LYS 67 -12.345 -14.469 -4.727 550 HZ2 LYS 67 HZ2 LYS 67 -12.514 -12.948 -4.158 551 HZ3 LYS 67 HZ3 LYS 67 -11.031 -13.622 -4.257 552 H LYS 68 H LYS 68 -12.441 -11.917 2.800 553 HA LYS 68 HA LYS 68 -11.090 -10.212 4.577 554 HB2 LYS 68 HB2 LYS 68 -13.529 -10.532 4.621 555 HB3 LYS 68 HB3 LYS 68 -13.340 -12.261 4.944 556 HG2 LYS 68 HG2 LYS 68 -13.902 -11.332 7.043 557 HG3 LYS 68 HG3 LYS 68 -12.154 -11.580 7.137 558 HD2 LYS 68 HD2 LYS 68 -12.566 -9.384 8.015 559 HD3 LYS 68 HD3 LYS 68 -11.851 -9.148 6.415 560 HE2 LYS 68 HE2 LYS 68 -14.063 -8.741 5.422 561 HE3 LYS 68 HE3 LYS 68 -14.868 -9.152 6.942 562 HZ1 LYS 68 HZ1 LYS 68 -14.744 -6.842 6.868 563 HZ2 LYS 68 HZ2 LYS 68 -13.556 -7.254 7.910 564 HZ3 LYS 68 HZ3 LYS 68 -13.185 -6.808 6.383 565 H THR 69 H THR 69 -9.178 -10.660 5.683 566 HA THR 69 HA THR 69 -9.131 -13.295 7.038 567 HB THR 69 HB THR 69 -6.630 -12.051 5.843 568 HG1 THR 69 HG1 THR 69 -7.909 -13.999 4.195 569 HG21 THR 69 HG21 THR 69 -5.895 -14.408 5.607 570 HG22 THR 69 HG22 THR 69 -6.397 -14.013 7.285 571 HG23 THR 69 HG23 THR 69 -7.493 -14.954 6.218 572 H SER 70 H SER 70 -9.770 -11.915 8.856 573 HA SER 70 HA SER 70 -8.141 -9.684 9.656 574 HB2 SER 70 HB2 SER 70 -10.055 -11.208 11.455 575 HB3 SER 70 HB3 SER 70 -9.672 -9.482 11.440 576 HG SER 70 HG SER 70 -11.768 -9.932 10.502 577 H ASP 71 H ASP 71 -6.122 -11.221 9.317 578 HA ASP 71 HA ASP 71 -5.561 -13.277 11.117 579 HB2 ASP 71 HB2 ASP 71 -4.342 -12.373 8.955 580 HB3 ASP 71 HB3 ASP 71 -3.565 -11.210 10.038 581 H ASP 72 H ASP 72 -4.212 -9.879 11.285 582 HA ASP 72 HA ASP 72 -4.291 -10.114 14.234 583 HB2 ASP 72 HB2 ASP 72 -1.994 -10.285 13.119 584 HB3 ASP 72 HB3 ASP 72 -2.208 -8.599 12.631 585 H GLY 73 H GLY 73 -6.390 -9.331 13.350 586 HA2 GLY 73 HA2 GLY 73 -8.094 -8.188 13.897 587 HA3 GLY 73 HA3 GLY 73 -7.104 -6.754 14.199 588 H GLU 74 H GLU 74 -6.238 -5.760 11.413 589 HA GLU 74 HA GLU 74 -8.817 -6.297 10.038 590 HB2 GLU 74 HB2 GLU 74 -7.345 -3.654 10.162 591 HB3 GLU 74 HB3 GLU 74 -8.611 -4.042 8.990 592 HG2 GLU 74 HG2 GLU 74 -9.823 -2.902 10.599 593 HG3 GLU 74 HG3 GLU 74 -10.079 -4.576 11.109 594 H VAL 75 H VAL 75 -6.905 -8.071 9.537 595 HA VAL 75 HA VAL 75 -5.060 -7.030 7.510 596 HB VAL 75 HB VAL 75 -5.331 -9.688 9.005 597 HG11 VAL 75 HG11 VAL 75 -3.235 -10.398 7.900 598 HG12 VAL 75 HG12 VAL 75 -4.578 -10.163 6.731 599 HG13 VAL 75 HG13 VAL 75 -3.287 -8.923 6.877 600 HG21 VAL 75 HG21 VAL 75 -3.109 -9.075 9.943 601 HG22 VAL 75 HG22 VAL 75 -3.168 -7.525 9.038 602 HG23 VAL 75 HG23 VAL 75 -4.369 -7.856 10.332 603 H TYR 76 H TYR 76 -4.863 -8.329 5.437 604 HA TYR 76 HA TYR 76 -7.265 -9.846 4.761 605 HB2 TYR 76 HB2 TYR 76 -6.378 -7.272 3.408 606 HB3 TYR 76 HB3 TYR 76 -7.338 -8.493 2.563 607 HD1 TYR 76 HD1 TYR 76 -9.622 -9.122 3.474 608 HD2 TYR 76 HD2 TYR 76 -7.396 -5.787 5.013 609 HE1 TYR 76 HE1 TYR 76 -11.687 -8.222 4.499 610 HE2 TYR 76 HE2 TYR 76 -9.463 -4.879 6.036 611 HH TYR 76 HH TYR 76 -11.645 -5.147 6.372 612 H TYR 77 H TYR 77 -7.034 -11.201 2.862 613 HA TYR 77 HA TYR 77 -4.253 -11.504 1.972 614 HB2 TYR 77 HB2 TYR 77 -6.131 -13.585 3.198 615 HB3 TYR 77 HB3 TYR 77 -4.836 -14.067 2.093 616 HD1 TYR 77 HD1 TYR 77 -5.125 -11.786 5.113 617 HD2 TYR 77 HD2 TYR 77 -2.974 -14.931 3.134 618 HE1 TYR 77 HE1 TYR 77 -3.538 -11.897 7.015 619 HE2 TYR 77 HE2 TYR 77 -1.394 -15.053 5.033 620 HH TYR 77 HH TYR 77 -1.939 -13.985 7.970 621 H SER 78 H SER 78 -4.058 -12.045 -0.256 622 HA SER 78 HA SER 78 -6.640 -12.560 -1.618 623 HB2 SER 78 HB2 SER 78 -5.548 -11.608 -3.632 624 HB3 SER 78 HB3 SER 78 -5.727 -10.451 -2.327 625 HG SER 78 HG SER 78 -3.487 -10.762 -1.773 626 H GLU 79 H GLU 79 -6.595 -14.871 -1.414 627 HA GLU 79 HA GLU 79 -4.285 -16.437 -1.777 628 HB2 GLU 79 HB2 GLU 79 -6.677 -16.930 -0.783 629 HB3 GLU 79 HB3 GLU 79 -7.178 -17.190 -2.458 630 HG2 GLU 79 HG2 GLU 79 -4.985 -18.744 -1.014 631 HG3 GLU 79 HG3 GLU 79 -6.647 -19.298 -1.250 632 H GLU 80 H GLU 80 -6.830 -15.361 -4.150 633 HA GLU 80 HA GLU 80 -5.872 -16.935 -6.265 634 HB2 GLU 80 HB2 GLU 80 -7.298 -14.227 -6.346 635 HB3 GLU 80 HB3 GLU 80 -7.197 -15.392 -7.672 636 HG2 GLU 80 HG2 GLU 80 -8.890 -16.658 -6.860 637 HG3 GLU 80 HG3 GLU 80 -8.285 -16.584 -5.200 638 H ALA 81 H ALA 81 -4.838 -13.701 -5.016 639 HA ALA 81 HA ALA 81 -3.111 -13.406 -7.344 640 HB1 ALA 81 HB1 ALA 81 -2.659 -11.156 -6.335 641 HB2 ALA 81 HB2 ALA 81 -4.415 -11.449 -6.572 642 HB3 ALA 81 HB3 ALA 81 -3.692 -11.597 -4.934 643 H LYS 82 H LYS 82 -2.890 -14.727 -4.116 644 HA LYS 82 HA LYS 82 -1.158 -15.576 -2.992 645 HB2 LYS 82 HB2 LYS 82 0.431 -14.900 -5.511 646 HB3 LYS 82 HB3 LYS 82 1.054 -15.830 -4.141 647 HG2 LYS 82 HG2 LYS 82 -1.375 -16.640 -5.815 648 HG3 LYS 82 HG3 LYS 82 0.269 -17.235 -6.082 649 HD2 LYS 82 HD2 LYS 82 0.328 -18.214 -3.812 650 HD3 LYS 82 HD3 LYS 82 -1.260 -17.528 -3.442 651 HE2 LYS 82 HE2 LYS 82 -0.853 -19.397 -5.816 652 HE3 LYS 82 HE3 LYS 82 -1.125 -20.027 -4.186 653 HZ1 LYS 82 HZ1 LYS 82 -3.259 -19.422 -4.261 654 HZ2 LYS 82 HZ2 LYS 82 -2.991 -18.005 -5.026 655 HZ3 LYS 82 HZ3 LYS 82 -3.063 -19.393 -5.882 656 H LYS 83 H LYS 83 -1.971 -12.989 -2.379 657 HA LYS 83 HA LYS 83 0.531 -11.824 -1.429 658 HB2 LYS 83 HB2 LYS 83 -1.584 -10.356 -3.088 659 HB3 LYS 83 HB3 LYS 83 -0.359 -9.536 -2.111 660 HG2 LYS 83 HG2 LYS 83 1.146 -9.702 -3.767 661 HG3 LYS 83 HG3 LYS 83 0.975 -11.462 -3.806 662 HD2 LYS 83 HD2 LYS 83 0.436 -10.555 -6.012 663 HD3 LYS 83 HD3 LYS 83 -1.028 -11.236 -5.291 664 HE2 LYS 83 HE2 LYS 83 -2.059 -9.188 -5.082 665 HE3 LYS 83 HE3 LYS 83 -0.554 -8.342 -4.697 666 HZ1 LYS 83 HZ1 LYS 83 -0.353 -7.759 -6.810 667 HZ2 LYS 83 HZ2 LYS 83 -0.536 -9.282 -7.369 668 HZ3 LYS 83 HZ3 LYS 83 -1.848 -8.348 -7.102 669 H LYS 84 H LYS 84 0.274 -10.893 0.630 670 HA LYS 84 HA LYS 84 -2.474 -10.565 1.586 671 HB2 LYS 84 HB2 LYS 84 -2.028 -11.686 3.642 672 HB3 LYS 84 HB3 LYS 84 -1.648 -12.789 2.312 673 HG2 LYS 84 HG2 LYS 84 0.361 -13.146 3.242 674 HG3 LYS 84 HG3 LYS 84 0.794 -11.468 2.887 675 HD2 LYS 84 HD2 LYS 84 0.319 -10.729 5.045 676 HD3 LYS 84 HD3 LYS 84 -0.928 -11.954 5.314 677 HE2 LYS 84 HE2 LYS 84 0.986 -13.701 5.298 678 HE3 LYS 84 HE3 LYS 84 2.103 -12.332 5.376 679 HZ1 LYS 84 HZ1 LYS 84 1.664 -13.030 7.560 680 HZ2 LYS 84 HZ2 LYS 84 0.844 -11.629 7.386 681 HZ3 LYS 84 HZ3 LYS 84 0.045 -13.052 7.352 682 H VAL 85 H VAL 85 -2.729 -8.949 3.279 683 HA VAL 85 HA VAL 85 -0.273 -7.403 3.767 684 HB VAL 85 HB VAL 85 -1.709 -5.323 3.594 685 HG11 VAL 85 HG11 VAL 85 -1.687 -5.220 1.114 686 HG12 VAL 85 HG12 VAL 85 -0.189 -5.958 1.774 687 HG13 VAL 85 HG13 VAL 85 -1.461 -7.000 1.053 688 HG21 VAL 85 HG21 VAL 85 -3.821 -5.431 2.298 689 HG22 VAL 85 HG22 VAL 85 -3.715 -7.224 2.292 690 HG23 VAL 85 HG23 VAL 85 -3.925 -6.342 3.842 691 H GLU 86 H GLU 86 -0.114 -6.603 5.895 692 HA GLU 86 HA GLU 86 -2.464 -7.082 7.620 693 HB2 GLU 86 HB2 GLU 86 -0.728 -7.637 9.405 694 HB3 GLU 86 HB3 GLU 86 -0.960 -8.856 8.144 695 HG2 GLU 86 HG2 GLU 86 1.100 -7.515 7.014 696 HG3 GLU 86 HG3 GLU 86 1.417 -7.095 8.702 697 H VAL 87 H VAL 87 -3.199 -5.228 8.496 698 HA VAL 87 HA VAL 87 -1.689 -2.817 8.282 699 HB VAL 87 HB VAL 87 -4.118 -2.777 8.204 700 HG11 VAL 87 HG11 VAL 87 -5.540 -3.359 10.149 701 HG12 VAL 87 HG12 VAL 87 -4.630 -4.774 9.519 702 HG13 VAL 87 HG13 VAL 87 -4.086 -3.952 11.021 703 HG21 VAL 87 HG21 VAL 87 -4.629 -1.102 9.970 704 HG22 VAL 87 HG22 VAL 87 -3.114 -1.557 10.821 705 HG23 VAL 87 HG23 VAL 87 -3.038 -0.806 9.191 706 H LEU 88 H LEU 88 0.140 -2.508 9.547 707 HA LEU 88 HA LEU 88 0.383 -3.898 12.059 708 HB2 LEU 88 HB2 LEU 88 2.088 -1.738 10.698 709 HB3 LEU 88 HB3 LEU 88 2.568 -2.648 12.136 710 HG LEU 88 HG LEU 88 2.123 -3.782 9.342 711 HD11 LEU 88 HD11 LEU 88 4.556 -4.217 9.414 712 HD12 LEU 88 HD12 LEU 88 4.182 -2.466 9.551 713 HD13 LEU 88 HD13 LEU 88 4.650 -3.402 11.011 714 HD21 LEU 88 HD21 LEU 88 2.983 -5.900 10.283 715 HD22 LEU 88 HD22 LEU 88 3.004 -5.159 11.919 716 HD23 LEU 88 HD23 LEU 88 1.444 -5.396 11.060 717 H ASP 89 H ASP 89 0.252 -0.345 11.079 718 HA ASP 89 HA ASP 89 -1.154 0.145 13.567 719 HB2 ASP 89 HB2 ASP 89 1.321 0.333 14.098 720 HB3 ASP 89 HB3 ASP 89 1.413 1.666 12.940 721 H THR 90 H THR 90 -2.554 1.914 13.424 722 HA THR 90 HA THR 90 -2.231 3.771 11.232 723 HB THR 90 HB THR 90 -3.421 1.824 10.224 724 HG1 THR 90 HG1 THR 90 -4.715 3.159 9.103 725 HG21 THR 90 HG21 THR 90 -5.760 1.365 10.907 726 HG22 THR 90 HG22 THR 90 -4.591 1.006 12.222 727 HG23 THR 90 HG23 THR 90 -5.574 2.507 12.280 728 H ASP 91 H ASP 91 -3.296 5.782 11.659 729 HA ASP 91 HA ASP 91 -4.630 5.850 14.284 730 HB2 ASP 91 HB2 ASP 91 -2.484 7.114 14.121 731 HB3 ASP 91 HB3 ASP 91 -3.200 8.118 12.853 732 H TYR 92 H TYR 92 -6.777 6.478 14.324 733 HA TYR 92 HA TYR 92 -8.232 6.613 11.982 734 HB2 TYR 92 HB2 TYR 92 -8.850 7.603 14.805 735 HB3 TYR 92 HB3 TYR 92 -10.044 7.584 13.500 736 HD1 TYR 92 HD1 TYR 92 -10.777 5.397 12.502 737 HD2 TYR 92 HD2 TYR 92 -8.171 5.546 15.913 738 HE1 TYR 92 HE1 TYR 92 -11.264 3.018 12.977 739 HE2 TYR 92 HE2 TYR 92 -8.650 3.162 16.385 740 HH TYR 92 HH TYR 92 -10.892 1.279 14.283 741 H LYS 93 H LYS 93 -6.477 9.265 13.601 742 HA LYS 93 HA LYS 93 -7.534 11.008 11.497 743 HB2 LYS 93 HB2 LYS 93 -6.942 11.731 14.392 744 HB3 LYS 93 HB3 LYS 93 -7.279 12.899 13.108 745 HG2 LYS 93 HG2 LYS 93 -9.532 12.079 12.817 746 HG3 LYS 93 HG3 LYS 93 -9.215 10.644 13.801 747 HD2 LYS 93 HD2 LYS 93 -8.749 12.187 15.774 748 HD3 LYS 93 HD3 LYS 93 -9.263 13.548 14.768 749 HE2 LYS 93 HE2 LYS 93 -11.071 11.126 15.079 750 HE3 LYS 93 HE3 LYS 93 -10.994 12.338 16.365 751 HZ1 LYS 93 HZ1 LYS 93 -12.734 12.819 14.799 752 HZ2 LYS 93 HZ2 LYS 93 -11.613 14.004 14.738 753 HZ3 LYS 93 HZ3 LYS 93 -11.684 12.885 13.551 754 H SER 94 H SER 94 -4.980 9.265 11.564 755 HA SER 94 HA SER 94 -3.267 11.533 10.847 756 HB2 SER 94 HB2 SER 94 -2.912 10.936 13.346 757 HB3 SER 94 HB3 SER 94 -2.469 9.300 12.842 758 HG SER 94 HG SER 94 -0.606 10.661 13.169 759 H TYR 95 H TYR 95 -0.892 9.609 10.886 760 HA TYR 95 HA TYR 95 -1.304 8.586 8.227 761 HB2 TYR 95 HB2 TYR 95 1.077 8.108 8.350 762 HB3 TYR 95 HB3 TYR 95 0.829 9.680 9.123 763 HD1 TYR 95 HD1 TYR 95 0.723 9.793 11.672 764 HD2 TYR 95 HD2 TYR 95 1.970 6.251 9.589 765 HE1 TYR 95 HE1 TYR 95 1.739 8.931 13.754 766 HE2 TYR 95 HE2 TYR 95 2.969 5.375 11.678 767 HH TYR 95 HH TYR 95 2.290 6.693 14.735 768 H ALA 96 H ALA 96 -0.430 6.253 7.739 769 HA ALA 96 HA ALA 96 -0.863 4.423 9.941 770 HB1 ALA 96 HB1 ALA 96 -2.445 3.065 8.639 771 HB2 ALA 96 HB2 ALA 96 -3.102 4.686 9.047 772 HB3 ALA 96 HB3 ALA 96 -2.504 4.351 7.387 773 H VAL 97 H VAL 97 0.191 2.367 9.660 774 HA VAL 97 HA VAL 97 1.778 2.210 7.189 775 HB VAL 97 HB VAL 97 3.534 1.050 8.564 776 HG11 VAL 97 HG11 VAL 97 4.473 3.138 9.505 777 HG12 VAL 97 HG12 VAL 97 3.775 3.393 7.870 778 HG13 VAL 97 HG13 VAL 97 2.872 3.932 9.327 779 HG21 VAL 97 HG21 VAL 97 3.544 1.419 11.007 780 HG22 VAL 97 HG22 VAL 97 1.902 2.139 10.901 781 HG23 VAL 97 HG23 VAL 97 2.154 0.410 10.484 782 H ILE 98 H ILE 98 1.422 0.308 6.037 783 HA ILE 98 HA ILE 98 0.220 -1.906 7.553 784 HB ILE 98 HB ILE 98 -0.204 -1.308 4.589 785 HG12 ILE 98 HG12 ILE 98 -1.111 0.591 5.791 786 HG13 ILE 98 HG13 ILE 98 -2.441 -0.421 5.211 787 HG21 ILE 98 HG21 ILE 98 -2.146 -2.824 4.859 788 HG22 ILE 98 HG22 ILE 98 -0.596 -3.631 5.273 789 HG23 ILE 98 HG23 ILE 98 -1.697 -3.079 6.580 790 HD11 ILE 98 HD11 ILE 98 -2.870 0.382 7.489 791 HD12 ILE 98 HD12 ILE 98 -2.696 -1.405 7.470 792 HD13 ILE 98 HD13 ILE 98 -1.346 -0.378 8.059 793 H TYR 99 H TYR 99 1.036 -4.021 7.112 794 HA TYR 99 HA TYR 99 3.589 -4.038 5.642 795 HB2 TYR 99 HB2 TYR 99 3.440 -4.818 8.047 796 HB3 TYR 99 HB3 TYR 99 2.316 -6.082 7.532 797 HD1 TYR 99 HD1 TYR 99 5.720 -4.764 6.560 798 HD2 TYR 99 HD2 TYR 99 3.215 -8.203 7.145 799 HE1 TYR 99 HE1 TYR 99 7.636 -6.243 6.049 800 HE2 TYR 99 HE2 TYR 99 5.132 -9.685 6.640 801 HH TYR 99 HH TYR 99 7.215 -9.769 5.758 802 H ALA 100 H ALA 100 3.892 -5.412 3.836 803 HA ALA 100 HA ALA 100 1.526 -6.975 3.038 804 HB1 ALA 100 HB1 ALA 100 1.989 -6.278 0.695 805 HB2 ALA 100 HB2 ALA 100 1.579 -4.880 1.745 806 HB3 ALA 100 HB3 ALA 100 3.288 -5.189 1.287 807 H THR 101 H THR 101 1.908 -8.987 2.115 808 HA THR 101 HA THR 101 4.658 -9.670 1.474 809 HB THR 101 HB THR 101 2.961 -11.136 3.554 810 HG1 THR 101 HG1 THR 101 5.693 -10.206 3.794 811 HG21 THR 101 HG21 THR 101 4.820 -12.765 3.663 812 HG22 THR 101 HG22 THR 101 4.045 -12.751 2.043 813 HG23 THR 101 HG23 THR 101 5.626 -11.935 2.289 814 H ARG 102 H ARG 102 4.821 -11.326 -0.104 815 HA ARG 102 HA ARG 102 2.372 -12.733 -0.894 816 HB2 ARG 102 HB2 ARG 102 2.837 -12.119 -3.279 817 HB3 ARG 102 HB3 ARG 102 2.267 -10.770 -2.287 818 HG2 ARG 102 HG2 ARG 102 4.894 -10.360 -1.942 819 HG3 ARG 102 HG3 ARG 102 5.004 -11.267 -3.455 820 HD2 ARG 102 HD2 ARG 102 2.941 -9.080 -3.296 821 HD3 ARG 102 HD3 ARG 102 4.639 -8.592 -3.372 822 HE ARG 102 HE ARG 102 3.071 -9.539 -5.545 823 HH11 ARG 102 HH11 ARG 102 6.313 -9.926 -4.210 824 HH12 ARG 102 HH12 ARG 102 7.025 -10.302 -5.744 825 HH21 ARG 102 HH21 ARG 102 4.027 -10.105 -7.527 826 HH22 ARG 102 HH22 ARG 102 5.731 -10.403 -7.621 827 H VAL 103 H VAL 103 2.872 -14.795 -1.783 828 HA VAL 103 HA VAL 103 5.736 -15.348 -2.042 829 HB VAL 103 HB VAL 103 3.627 -17.213 -0.845 830 HG11 VAL 103 HG11 VAL 103 5.573 -18.621 -0.258 831 HG12 VAL 103 HG12 VAL 103 5.418 -18.395 -2.033 832 HG13 VAL 103 HG13 VAL 103 6.656 -17.473 -1.115 833 HG21 VAL 103 HG21 VAL 103 4.799 -16.868 1.295 834 HG22 VAL 103 HG22 VAL 103 5.851 -15.638 0.517 835 HG23 VAL 103 HG23 VAL 103 4.085 -15.346 0.663 836 H LYS 104 H LYS 104 6.368 -16.688 -3.662 837 HA LYS 104 HA LYS 104 4.379 -17.753 -5.511 838 HB2 LYS 104 HB2 LYS 104 5.348 -15.541 -6.263 839 HB3 LYS 104 HB3 LYS 104 6.843 -16.440 -6.551 840 HG2 LYS 104 HG2 LYS 104 5.483 -18.088 -7.952 841 HG3 LYS 104 HG3 LYS 104 4.099 -17.001 -7.780 842 HD2 LYS 104 HD2 LYS 104 5.311 -15.172 -8.861 843 HD3 LYS 104 HD3 LYS 104 6.815 -16.103 -8.863 844 HE2 LYS 104 HE2 LYS 104 4.272 -16.969 -10.328 845 HE3 LYS 104 HE3 LYS 104 5.577 -16.046 -11.083 846 HZ1 LYS 104 HZ1 LYS 104 5.917 -18.325 -11.521 847 HZ2 LYS 104 HZ2 LYS 104 7.067 -17.899 -10.443 848 HZ3 LYS 104 HZ3 LYS 104 5.769 -18.759 -9.954 849 H ASP 105 H ASP 105 5.462 -19.414 -7.061 850 HA ASP 105 HA ASP 105 6.220 -21.592 -5.964 851 HB2 ASP 105 HB2 ASP 105 7.894 -20.385 -8.275 852 HB3 ASP 105 HB3 ASP 105 7.651 -22.111 -7.973 853 H GLY 106 H GLY 106 7.363 -21.465 -3.879 854 HA2 GLY 106 HA2 GLY 106 9.365 -21.968 -2.881 855 HA3 GLY 106 HA3 GLY 106 10.180 -21.757 -4.436 856 H ARG 107 H ARG 107 8.394 -18.840 -3.953 857 HA ARG 107 HA ARG 107 10.718 -17.650 -2.571 858 HB2 ARG 107 HB2 ARG 107 10.922 -17.541 -5.114 859 HB3 ARG 107 HB3 ARG 107 9.343 -16.748 -5.187 860 HG2 ARG 107 HG2 ARG 107 10.166 -14.714 -4.524 861 HG3 ARG 107 HG3 ARG 107 11.361 -15.421 -3.428 862 HD2 ARG 107 HD2 ARG 107 11.562 -15.450 -6.484 863 HD3 ARG 107 HD3 ARG 107 12.376 -14.284 -5.432 864 HE ARG 107 HE ARG 107 13.146 -16.789 -4.468 865 HH11 ARG 107 HH11 ARG 107 13.378 -15.076 -7.530 866 HH12 ARG 107 HH12 ARG 107 14.841 -15.876 -8.002 867 HH21 ARG 107 HH21 ARG 107 15.060 -17.829 -5.105 868 HH22 ARG 107 HH22 ARG 107 15.795 -17.440 -6.624 869 H THR 108 H THR 108 10.274 -16.190 -1.078 870 HA THR 108 HA THR 108 7.536 -15.186 -0.958 871 HB THR 108 HB THR 108 9.494 -15.385 1.366 872 HG1 THR 108 HG1 THR 108 8.323 -17.384 1.871 873 HG21 THR 108 HG21 THR 108 7.411 -15.319 2.703 874 HG22 THR 108 HG22 THR 108 7.569 -13.871 1.652 875 HG23 THR 108 HG23 THR 108 6.447 -15.196 1.192 876 H LEU 109 H LEU 109 7.178 -12.935 -1.115 877 HA LEU 109 HA LEU 109 9.607 -11.312 -0.696 878 HB2 LEU 109 HB2 LEU 109 8.891 -11.420 -3.066 879 HB3 LEU 109 HB3 LEU 109 7.304 -10.791 -2.607 880 HG LEU 109 HG LEU 109 8.262 -8.670 -1.917 881 HD11 LEU 109 HD11 LEU 109 10.672 -8.179 -2.196 882 HD12 LEU 109 HD12 LEU 109 10.384 -9.477 -0.987 883 HD13 LEU 109 HD13 LEU 109 10.965 -9.896 -2.634 884 HD21 LEU 109 HD21 LEU 109 9.140 -7.879 -4.094 885 HD22 LEU 109 HD22 LEU 109 9.362 -9.583 -4.616 886 HD23 LEU 109 HD23 LEU 109 7.713 -8.950 -4.294 887 H HIS 110 H HIS 110 9.411 -9.536 0.704 888 HA HIS 110 HA HIS 110 6.733 -9.159 1.911 889 HB2 HIS 110 HB2 HIS 110 9.536 -8.927 3.113 890 HB3 HIS 110 HB3 HIS 110 8.058 -8.391 3.923 891 HD2 HIS 110 HD2 HIS 110 10.239 -11.468 3.728 892 HE1 HIS 110 HE1 HIS 110 6.433 -12.824 5.127 893 H MET 111 H MET 111 6.283 -6.879 2.501 894 HA MET 111 HA MET 111 8.144 -4.867 1.619 895 HB2 MET 111 HB2 MET 111 5.818 -5.732 -0.005 896 HB3 MET 111 HB3 MET 111 5.846 -3.998 0.340 897 HG2 MET 111 HG2 MET 111 8.216 -3.918 -0.547 898 HG3 MET 111 HG3 MET 111 8.059 -5.619 -1.004 899 HE1 MET 111 HE1 MET 111 8.360 -2.983 -3.637 900 HE2 MET 111 HE2 MET 111 9.011 -4.519 -2.972 901 HE3 MET 111 HE3 MET 111 7.949 -4.546 -4.420 902 H MET 112 H MET 112 7.777 -2.854 2.641 903 HA MET 112 HA MET 112 5.502 -2.858 4.532 904 HB2 MET 112 HB2 MET 112 7.802 -2.828 5.509 905 HB3 MET 112 HB3 MET 112 8.142 -1.337 4.619 906 HG2 MET 112 HG2 MET 112 7.572 -0.718 6.864 907 HG3 MET 112 HG3 MET 112 6.225 -0.232 5.826 908 HE1 MET 112 HE1 MET 112 5.550 -0.843 9.330 909 HE2 MET 112 HE2 MET 112 5.192 0.209 7.919 910 HE3 MET 112 HE3 MET 112 3.939 -0.919 8.540 911 H ARG 113 H ARG 113 4.163 -0.906 4.601 912 HA ARG 113 HA ARG 113 4.883 1.187 2.723 913 HB2 ARG 113 HB2 ARG 113 3.011 -0.892 2.071 914 HB3 ARG 113 HB3 ARG 113 2.061 0.564 2.395 915 HG2 ARG 113 HG2 ARG 113 3.166 1.806 0.669 916 HG3 ARG 113 HG3 ARG 113 4.471 0.621 0.533 917 HD2 ARG 113 HD2 ARG 113 1.538 0.221 -0.248 918 HD3 ARG 113 HD3 ARG 113 2.920 0.347 -1.345 919 HE ARG 113 HE ARG 113 2.129 -1.997 0.231 920 HH11 ARG 113 HH11 ARG 113 4.661 -0.467 -1.675 921 HH12 ARG 113 HH12 ARG 113 5.519 -1.947 -1.945 922 HH21 ARG 113 HH21 ARG 113 3.327 -3.902 -0.037 923 HH22 ARG 113 HH22 ARG 113 4.759 -3.901 -1.011 924 H LEU 114 H LEU 114 3.813 3.185 3.055 925 HA LEU 114 HA LEU 114 2.174 3.340 5.510 926 HB2 LEU 114 HB2 LEU 114 4.583 3.972 5.900 927 HB3 LEU 114 HB3 LEU 114 4.393 5.252 4.695 928 HG LEU 114 HG LEU 114 2.674 5.062 7.198 929 HD11 LEU 114 HD11 LEU 114 4.162 6.799 8.158 930 HD12 LEU 114 HD12 LEU 114 5.036 5.261 7.853 931 HD13 LEU 114 HD13 LEU 114 5.244 6.649 6.734 932 HD21 LEU 114 HD21 LEU 114 2.262 7.459 6.745 933 HD22 LEU 114 HD22 LEU 114 3.264 7.344 5.259 934 HD23 LEU 114 HD23 LEU 114 1.732 6.415 5.383 935 H TYR 115 H TYR 115 0.284 4.509 5.127 936 HA TYR 115 HA TYR 115 0.262 6.019 2.603 937 HB2 TYR 115 HB2 TYR 115 -2.068 5.545 2.378 938 HB3 TYR 115 HB3 TYR 115 -1.189 4.024 2.581 939 HD1 TYR 115 HD1 TYR 115 -3.588 6.368 4.136 940 HD2 TYR 115 HD2 TYR 115 -1.561 2.604 4.545 941 HE1 TYR 115 HE1 TYR 115 -5.161 5.721 5.931 942 HE2 TYR 115 HE2 TYR 115 -3.131 1.953 6.347 943 HH TYR 115 HH TYR 115 -5.233 2.447 7.244 944 H SER 116 H SER 116 -0.806 8.076 2.539 945 HA SER 116 HA SER 116 -1.051 9.258 5.260 946 HB2 SER 116 HB2 SER 116 -0.302 10.494 2.528 947 HB3 SER 116 HB3 SER 116 -0.497 11.411 4.028 948 HG SER 116 HG SER 116 1.568 11.018 4.344 949 H ARG 117 H ARG 117 -2.810 10.845 5.451 950 HA ARG 117 HA ARG 117 -5.187 9.904 4.293 951 HB2 ARG 117 HB2 ARG 117 -5.102 10.999 6.494 952 HB3 ARG 117 HB3 ARG 117 -4.453 12.483 5.784 953 HG2 ARG 117 HG2 ARG 117 -6.562 12.911 4.609 954 HG3 ARG 117 HG3 ARG 117 -7.216 11.353 5.129 955 HD2 ARG 117 HD2 ARG 117 -7.272 12.040 7.450 956 HD3 ARG 117 HD3 ARG 117 -6.298 13.479 7.122 957 HE ARG 117 HE ARG 117 -8.190 14.527 6.125 958 HH11 ARG 117 HH11 ARG 117 -8.947 11.301 7.310 959 HH12 ARG 117 HH12 ARG 117 -10.660 11.547 7.230 960 HH21 ARG 117 HH21 ARG 117 -10.431 14.826 6.020 961 HH22 ARG 117 HH22 ARG 117 -11.503 13.552 6.497 962 H SER 118 H SER 118 -2.824 12.283 3.137 963 HA SER 118 HA SER 118 -4.553 12.736 0.804 964 HB2 SER 118 HB2 SER 118 -3.067 14.998 2.198 965 HB3 SER 118 HB3 SER 118 -4.230 15.102 0.869 966 HG SER 118 HG SER 118 -5.180 15.667 2.924 967 HA PRO 119 HA PRO 119 -0.572 12.264 -1.202 968 HB2 PRO 119 HB2 PRO 119 -0.553 14.235 -3.160 969 HB3 PRO 119 HB3 PRO 119 -1.667 12.867 -3.282 970 HG2 PRO 119 HG2 PRO 119 -2.194 15.674 -2.269 971 HG3 PRO 119 HG3 PRO 119 -3.186 14.671 -3.335 972 HD2 PRO 119 HD2 PRO 119 -3.732 14.930 -0.662 973 HD3 PRO 119 HD3 PRO 119 -4.107 13.449 -1.554 974 H GLU 120 H GLU 120 0.046 13.268 1.163 975 HA GLU 120 HA GLU 120 2.263 14.999 0.518 976 HB2 GLU 120 HB2 GLU 120 1.559 16.572 2.439 977 HB3 GLU 120 HB3 GLU 120 0.820 16.806 0.849 978 HG2 GLU 120 HG2 GLU 120 -1.198 15.542 1.613 979 HG3 GLU 120 HG3 GLU 120 -0.459 15.339 3.207 980 H VAL 121 H VAL 121 3.987 14.093 1.602 981 HA VAL 121 HA VAL 121 3.388 12.083 3.593 982 HB VAL 121 HB VAL 121 5.994 13.478 2.694 983 HG11 VAL 121 HG11 VAL 121 7.203 11.471 3.528 984 HG12 VAL 121 HG12 VAL 121 6.323 12.349 4.824 985 HG13 VAL 121 HG13 VAL 121 5.650 10.824 4.155 986 HG21 VAL 121 HG21 VAL 121 6.460 11.539 1.245 987 HG22 VAL 121 HG22 VAL 121 4.836 10.880 1.636 988 HG23 VAL 121 HG23 VAL 121 4.985 12.444 0.766 989 H SER 122 H SER 122 3.653 12.314 5.781 990 HA SER 122 HA SER 122 4.203 15.000 6.811 991 HB2 SER 122 HB2 SER 122 3.021 14.021 8.872 992 HB3 SER 122 HB3 SER 122 2.013 14.247 7.437 993 HG SER 122 HG SER 122 1.706 12.147 8.414 994 HA PRO 123 HA PRO 123 8.088 13.750 8.512 995 HB2 PRO 123 HB2 PRO 123 7.927 15.394 10.837 996 HB3 PRO 123 HB3 PRO 123 8.538 15.957 9.276 997 HG2 PRO 123 HG2 PRO 123 5.800 16.304 10.494 998 HG3 PRO 123 HG3 PRO 123 6.742 17.437 9.516 999 HD2 PRO 123 HD2 PRO 123 4.672 16.074 8.428 1000 HD3 PRO 123 HD3 PRO 123 6.126 16.399 7.475 1001 H ALA 124 H ALA 124 5.244 14.020 10.775 1002 HA ALA 124 HA ALA 124 6.282 12.420 12.789 1003 HB1 ALA 124 HB1 ALA 124 3.904 12.055 13.401 1004 HB2 ALA 124 HB2 ALA 124 4.242 13.775 13.009 1005 HB3 ALA 124 HB3 ALA 124 3.401 12.730 11.815 1006 H ALA 125 H ALA 125 4.369 11.432 9.833 1007 HA ALA 125 HA ALA 125 4.336 8.679 10.546 1008 HB1 ALA 125 HB1 ALA 125 3.628 8.370 8.201 1009 HB2 ALA 125 HB2 ALA 125 2.717 9.695 9.000 1010 HB3 ALA 125 HB3 ALA 125 4.041 10.082 7.851 1011 H THR 126 H THR 126 6.530 10.789 8.594 1012 HA THR 126 HA THR 126 8.057 8.765 7.437 1013 HB THR 126 HB THR 126 8.961 11.550 8.327 1014 HG1 THR 126 HG1 THR 126 7.120 11.817 7.028 1015 HG21 THR 126 HG21 THR 126 10.515 11.356 6.404 1016 HG22 THR 126 HG22 THR 126 10.793 10.056 7.612 1017 HG23 THR 126 HG23 THR 126 9.913 9.694 6.089 1018 H ALA 127 H ALA 127 8.523 10.627 10.559 1019 HA ALA 127 HA ALA 127 10.911 9.299 11.255 1020 HB1 ALA 127 HB1 ALA 127 10.464 10.251 13.502 1021 HB2 ALA 127 HB2 ALA 127 10.245 11.468 12.199 1022 HB3 ALA 127 HB3 ALA 127 8.811 10.710 12.970 1023 H ILE 128 H ILE 128 7.415 8.573 11.915 1024 HA ILE 128 HA ILE 128 7.944 6.582 13.830 1025 HB ILE 128 HB ILE 128 5.564 7.112 12.005 1026 HG12 ILE 128 HG12 ILE 128 6.027 8.787 13.759 1027 HG13 ILE 128 HG13 ILE 128 4.509 7.925 14.045 1028 HG21 ILE 128 HG21 ILE 128 4.307 5.498 13.395 1029 HG22 ILE 128 HG22 ILE 128 5.643 4.708 12.491 1030 HG23 ILE 128 HG23 ILE 128 5.827 5.054 14.244 1031 HD11 ILE 128 HD11 ILE 128 5.756 8.235 16.135 1032 HD12 ILE 128 HD12 ILE 128 5.624 6.491 15.730 1033 HD13 ILE 128 HD13 ILE 128 7.166 7.366 15.440 1034 H PHE 129 H PHE 129 7.265 6.422 10.237 1035 HA PHE 129 HA PHE 129 7.352 3.661 9.963 1036 HB2 PHE 129 HB2 PHE 129 6.670 5.446 8.271 1037 HB3 PHE 129 HB3 PHE 129 8.389 5.771 8.008 1038 HD1 PHE 129 HD1 PHE 129 9.819 4.142 6.866 1039 HD2 PHE 129 HD2 PHE 129 5.628 3.409 7.444 1040 HE1 PHE 129 HE1 PHE 129 9.902 2.342 5.165 1041 HE2 PHE 129 HE2 PHE 129 5.706 1.608 5.745 1042 HZ PHE 129 HZ PHE 129 7.844 1.073 4.602 1043 H ARG 130 H ARG 130 10.036 6.098 10.126 1044 HA ARG 130 HA ARG 130 12.048 4.240 9.382 1045 HB2 ARG 130 HB2 ARG 130 12.148 6.779 9.223 1046 HB3 ARG 130 HB3 ARG 130 12.326 6.823 10.982 1047 HG2 ARG 130 HG2 ARG 130 14.339 5.149 10.542 1048 HG3 ARG 130 HG3 ARG 130 14.261 5.785 8.893 1049 HD2 ARG 130 HD2 ARG 130 14.611 7.433 11.450 1050 HD3 ARG 130 HD3 ARG 130 15.875 7.059 10.270 1051 HE ARG 130 HE ARG 130 13.882 8.323 8.791 1052 HH11 ARG 130 HH11 ARG 130 15.849 9.133 11.593 1053 HH12 ARG 130 HH12 ARG 130 15.820 10.835 11.274 1054 HH21 ARG 130 HH21 ARG 130 13.852 10.563 8.389 1055 HH22 ARG 130 HH22 ARG 130 14.684 11.647 9.452 1056 H LYS 131 H LYS 131 10.850 5.531 12.586 1057 HA LYS 131 HA LYS 131 12.750 4.377 14.208 1058 HB2 LYS 131 HB2 LYS 131 9.752 4.778 14.678 1059 HB3 LYS 131 HB3 LYS 131 10.918 4.383 15.948 1060 HG2 LYS 131 HG2 LYS 131 12.174 6.507 15.388 1061 HG3 LYS 131 HG3 LYS 131 10.904 6.910 14.225 1062 HD2 LYS 131 HD2 LYS 131 9.209 6.767 16.118 1063 HD3 LYS 131 HD3 LYS 131 10.551 6.525 17.245 1064 HE2 LYS 131 HE2 LYS 131 11.552 8.718 16.256 1065 HE3 LYS 131 HE3 LYS 131 9.967 8.973 15.516 1066 HZ1 LYS 131 HZ1 LYS 131 10.136 10.059 17.640 1067 HZ2 LYS 131 HZ2 LYS 131 8.999 8.890 17.723 1068 HZ3 LYS 131 HZ3 LYS 131 10.463 8.654 18.406 1069 H LEU 132 H LEU 132 9.621 2.886 13.009 1070 HA LEU 132 HA LEU 132 10.055 0.436 14.363 1071 HB2 LEU 132 HB2 LEU 132 8.431 1.089 11.863 1072 HB3 LEU 132 HB3 LEU 132 8.322 -0.410 12.795 1073 HG LEU 132 HG LEU 132 7.646 2.367 13.860 1074 HD11 LEU 132 HD11 LEU 132 5.298 1.596 13.743 1075 HD12 LEU 132 HD12 LEU 132 6.069 1.647 12.122 1076 HD13 LEU 132 HD13 LEU 132 5.842 0.074 12.959 1077 HD21 LEU 132 HD21 LEU 132 6.647 1.128 15.753 1078 HD22 LEU 132 HD22 LEU 132 7.248 -0.414 15.056 1079 HD23 LEU 132 HD23 LEU 132 8.413 0.833 15.615 1080 H ALA 133 H ALA 133 10.700 1.558 10.947 1081 HA ALA 133 HA ALA 133 11.618 -0.856 9.951 1082 HB1 ALA 133 HB1 ALA 133 12.789 0.551 8.277 1083 HB2 ALA 133 HB2 ALA 133 11.108 1.112 8.569 1084 HB3 ALA 133 HB3 ALA 133 12.489 1.999 9.296 1085 H GLY 134 H GLY 134 13.353 1.604 11.989 1086 HA2 GLY 134 HA2 GLY 134 15.927 0.503 11.489 1087 HA3 GLY 134 HA3 GLY 134 15.458 1.614 12.782 1088 H GLU 135 H GLU 135 13.310 -0.187 13.922 1089 HA GLU 135 HA GLU 135 15.005 -1.659 15.655 1090 HB2 GLU 135 HB2 GLU 135 13.170 -1.928 16.917 1091 HB3 GLU 135 HB3 GLU 135 12.526 -0.645 15.884 1092 HG2 GLU 135 HG2 GLU 135 11.022 -2.025 14.856 1093 HG3 GLU 135 HG3 GLU 135 12.125 -3.408 14.838 1094 H ARG 136 H ARG 136 13.569 -2.338 12.507 1095 HA ARG 136 HA ARG 136 13.908 -5.229 12.877 1096 HB2 ARG 136 HB2 ARG 136 12.886 -3.712 10.438 1097 HB3 ARG 136 HB3 ARG 136 12.671 -5.424 10.826 1098 HG2 ARG 136 HG2 ARG 136 11.194 -4.867 12.710 1099 HG3 ARG 136 HG3 ARG 136 11.502 -3.139 12.491 1100 HD2 ARG 136 HD2 ARG 136 9.474 -3.364 11.375 1101 HD3 ARG 136 HD3 ARG 136 10.613 -3.551 10.034 1102 HE ARG 136 HE ARG 136 10.055 -5.828 9.881 1103 HH11 ARG 136 HH11 ARG 136 8.589 -4.422 12.755 1104 HH12 ARG 136 HH12 ARG 136 7.509 -5.753 13.002 1105 HH21 ARG 136 HH21 ARG 136 8.621 -7.562 10.218 1106 HH22 ARG 136 HH22 ARG 136 7.528 -7.537 11.561 1107 H ASN 137 H ASN 137 16.126 -2.943 12.569 1108 HA ASN 137 HA ASN 137 18.091 -2.713 11.619 1109 HB2 ASN 137 HB2 ASN 137 17.679 -5.689 11.037 1110 HB3 ASN 137 HB3 ASN 137 19.203 -4.841 10.742 1111 HD21 ASN 137 HD21 ASN 137 19.205 -3.129 13.058 1112 HD22 ASN 137 HD22 ASN 137 19.442 -4.131 14.450 1113 H TYR 138 H TYR 138 15.828 -1.926 9.938 1114 HA TYR 138 HA TYR 138 16.188 -2.993 7.326 1115 HB2 TYR 138 HB2 TYR 138 14.466 -1.490 6.784 1116 HB3 TYR 138 HB3 TYR 138 14.228 -1.567 8.535 1117 HD1 TYR 138 HD1 TYR 138 15.922 0.247 9.834 1118 HD2 TYR 138 HD2 TYR 138 14.316 0.653 5.869 1119 HE1 TYR 138 HE1 TYR 138 16.210 2.702 9.968 1120 HE2 TYR 138 HE2 TYR 138 14.601 3.107 6.006 1121 HH TYR 138 HH TYR 138 15.054 4.843 7.339 1122 H THR 139 H THR 139 16.866 -1.631 5.397 1123 HA THR 139 HA THR 139 19.195 0.056 6.139 1124 HB THR 139 HB THR 139 19.882 -0.635 3.718 1125 HG1 THR 139 HG1 THR 139 19.002 -2.750 3.103 1126 HG21 THR 139 HG21 THR 139 20.917 -2.747 4.545 1127 HG22 THR 139 HG22 THR 139 21.024 -1.439 5.771 1128 HG23 THR 139 HG23 THR 139 19.797 -2.739 5.949 1129 H ASP 140 H ASP 140 19.506 2.023 4.736 1130 HA ASP 140 HA ASP 140 17.123 3.386 4.328 1131 HB2 ASP 140 HB2 ASP 140 19.170 4.671 4.442 1132 HB3 ASP 140 HB3 ASP 140 20.018 3.591 3.328 1133 H GLU 141 H GLU 141 19.166 1.819 1.706 1134 HA GLU 141 HA GLU 141 17.396 2.490 -0.325 1135 HB2 GLU 141 HB2 GLU 141 19.378 0.182 -0.116 1136 HB3 GLU 141 HB3 GLU 141 18.515 0.617 -1.597 1137 HG2 GLU 141 HG2 GLU 141 19.537 2.956 -1.377 1138 HG3 GLU 141 HG3 GLU 141 20.542 2.312 -0.072 1139 H MET 142 H MET 142 16.838 0.243 2.266 1140 HA MET 142 HA MET 142 15.280 -1.622 0.685 1141 HB2 MET 142 HB2 MET 142 16.446 -2.320 2.753 1142 HB3 MET 142 HB3 MET 142 15.605 -1.077 3.690 1143 HG2 MET 142 HG2 MET 142 13.414 -2.249 3.096 1144 HG3 MET 142 HG3 MET 142 14.381 -3.556 2.399 1145 HE1 MET 142 HE1 MET 142 16.061 -5.333 5.162 1146 HE2 MET 142 HE2 MET 142 16.305 -4.566 3.556 1147 HE3 MET 142 HE3 MET 142 16.917 -3.759 5.038 1148 H VAL 143 H VAL 143 14.820 1.501 2.238 1149 HA VAL 143 HA VAL 143 11.920 1.235 2.074 1150 HB VAL 143 HB VAL 143 13.602 3.180 3.686 1151 HG11 VAL 143 HG11 VAL 143 11.432 3.990 4.552 1152 HG12 VAL 143 HG12 VAL 143 11.593 4.277 2.786 1153 HG13 VAL 143 HG13 VAL 143 10.573 2.927 3.387 1154 HG21 VAL 143 HG21 VAL 143 12.536 2.041 5.601 1155 HG22 VAL 143 HG22 VAL 143 11.715 0.913 4.470 1156 HG23 VAL 143 HG23 VAL 143 13.506 0.904 4.604 1157 H ALA 144 H ALA 144 10.698 3.023 1.068 1158 HA ALA 144 HA ALA 144 12.343 4.817 -0.600 1159 HB1 ALA 144 HB1 ALA 144 10.720 4.460 -2.424 1160 HB2 ALA 144 HB2 ALA 144 11.577 2.945 -1.982 1161 HB3 ALA 144 HB3 ALA 144 9.889 3.215 -1.432 1162 H MET 145 H MET 145 11.828 6.903 -0.260 1163 HA MET 145 HA MET 145 9.155 7.531 0.730 1164 HB2 MET 145 HB2 MET 145 11.772 8.867 1.403 1165 HB3 MET 145 HB3 MET 145 10.181 9.542 1.777 1166 HG2 MET 145 HG2 MET 145 9.620 7.535 3.115 1167 HG3 MET 145 HG3 MET 145 11.179 6.807 2.705 1168 HE1 MET 145 HE1 MET 145 11.577 7.817 6.517 1169 HE2 MET 145 HE2 MET 145 10.076 7.264 5.701 1170 HE3 MET 145 HE3 MET 145 11.646 6.479 5.320 1171 H LEU 146 H LEU 146 7.930 9.206 -0.257 1172 HA LEU 146 HA LEU 146 9.309 10.435 -2.538 1173 HB2 LEU 146 HB2 LEU 146 6.410 9.585 -2.325 1174 HB3 LEU 146 HB3 LEU 146 7.106 10.520 -3.655 1175 HG LEU 146 HG LEU 146 6.929 8.257 -4.361 1176 HD11 LEU 146 HD11 LEU 146 9.277 7.644 -4.853 1177 HD12 LEU 146 HD12 LEU 146 8.961 9.395 -5.099 1178 HD13 LEU 146 HD13 LEU 146 9.833 8.838 -3.631 1179 HD21 LEU 146 HD21 LEU 146 8.014 6.364 -3.193 1180 HD22 LEU 146 HD22 LEU 146 8.484 7.470 -1.859 1181 HD23 LEU 146 HD23 LEU 146 6.748 7.152 -2.191 1182 HA PRO 147 HA PRO 147 8.187 14.136 -0.143 1183 HB2 PRO 147 HB2 PRO 147 9.787 15.860 -1.629 1184 HB3 PRO 147 HB3 PRO 147 10.501 14.814 -0.394 1185 HG2 PRO 147 HG2 PRO 147 10.365 14.409 -3.395 1186 HG3 PRO 147 HG3 PRO 147 11.727 14.146 -2.298 1187 HD2 PRO 147 HD2 PRO 147 10.180 12.076 -3.180 1188 HD3 PRO 147 HD3 PRO 147 10.918 12.058 -1.573 1189 H ARG 148 H ARG 148 8.007 16.630 -1.450 1190 HA ARG 148 HA ARG 148 5.481 16.454 -2.619 1191 HB2 ARG 148 HB2 ARG 148 5.519 18.770 -2.797 1192 HB3 ARG 148 HB3 ARG 148 6.514 18.406 -1.382 1193 HG2 ARG 148 HG2 ARG 148 7.542 19.122 -4.168 1194 HG3 ARG 148 HG3 ARG 148 7.513 20.189 -2.757 1195 HD2 ARG 148 HD2 ARG 148 9.036 17.535 -2.873 1196 HD3 ARG 148 HD3 ARG 148 9.760 19.110 -3.223 1197 HE ARG 148 HE ARG 148 8.433 18.979 -0.620 1198 HH11 ARG 148 HH11 ARG 148 11.430 18.399 -2.368 1199 HH12 ARG 148 HH12 ARG 148 12.421 18.538 -0.954 1200 HH21 ARG 148 HH21 ARG 148 9.750 19.186 1.219 1201 HH22 ARG 148 HH22 ARG 148 11.465 18.986 1.085 1202 H GLN 149 H GLN 149 6.442 14.645 -4.133 1203 HA GLN 149 HA GLN 149 6.989 15.785 -6.735 1204 HB2 GLN 149 HB2 GLN 149 8.768 14.365 -5.659 1205 HB3 GLN 149 HB3 GLN 149 7.749 12.997 -6.126 1206 HG2 GLN 149 HG2 GLN 149 7.705 14.054 -8.497 1207 HG3 GLN 149 HG3 GLN 149 9.019 15.095 -7.933 1208 HE21 GLN 149 HE21 GLN 149 10.154 13.026 -6.118 1209 HE22 GLN 149 HE22 GLN 149 10.943 11.874 -7.143 1210 H GLU 150 H GLU 150 4.249 15.465 -5.539 1211 HA GLU 150 HA GLU 150 3.230 13.266 -7.113 1212 HB2 GLU 150 HB2 GLU 150 1.120 13.724 -5.971 1213 HB3 GLU 150 HB3 GLU 150 2.443 13.604 -4.804 1214 HG2 GLU 150 HG2 GLU 150 1.319 15.448 -3.989 1215 HG3 GLU 150 HG3 GLU 150 2.528 16.232 -5.014 1216 H GLU 151 H GLU 151 1.315 13.451 -8.525 1217 HA GLU 151 HA GLU 151 0.578 15.941 -9.631 1218 HB2 GLU 151 HB2 GLU 151 2.907 15.746 -10.551 1219 HB3 GLU 151 HB3 GLU 151 2.469 14.196 -11.283 1220 HG2 GLU 151 HG2 GLU 151 1.037 15.193 -12.867 1221 HG3 GLU 151 HG3 GLU 151 0.850 16.675 -11.921 1222 H CYS 152 H CYS 152 0.957 12.340 -10.106 1223 HA CYS 152 HA CYS 152 -1.543 12.445 -11.719 1224 HB2 CYS 152 HB2 CYS 152 0.428 11.141 -12.599 1225 HB3 CYS 152 HB3 CYS 152 0.560 10.270 -11.066 1226 H THR 153 H THR 153 -3.383 11.829 -10.731 1227 HA THR 153 HA THR 153 -3.182 10.462 -8.138 1228 HB THR 153 HB THR 153 -5.423 11.944 -7.785 1229 HG1 THR 153 HG1 THR 153 -5.045 14.098 -8.695 1230 HG21 THR 153 HG21 THR 153 -4.054 13.626 -6.576 1231 HG22 THR 153 HG22 THR 153 -3.456 11.956 -6.295 1232 HG23 THR 153 HG23 THR 153 -2.588 13.041 -7.434 1233 H VAL 154 H VAL 154 -5.049 9.150 -7.553 1234 HA VAL 154 HA VAL 154 -6.393 8.129 -9.934 1235 HB VAL 154 HB VAL 154 -5.222 6.556 -8.421 1236 HG11 VAL 154 HG11 VAL 154 -6.150 6.051 -6.187 1237 HG12 VAL 154 HG12 VAL 154 -5.508 7.725 -6.295 1238 HG13 VAL 154 HG13 VAL 154 -7.280 7.437 -6.351 1239 HG21 VAL 154 HG21 VAL 154 -7.080 4.938 -8.167 1240 HG22 VAL 154 HG22 VAL 154 -8.260 6.261 -8.451 1241 HG23 VAL 154 HG23 VAL 154 -7.124 5.776 -9.754 1242 H ASP 155 H ASP 155 -8.672 8.219 -10.193 1243 HA ASP 155 HA ASP 155 -9.986 10.287 -8.818 1244 HB2 ASP 155 HB2 ASP 155 -10.528 9.664 -11.141 1245 HB3 ASP 155 HB3 ASP 155 -11.077 8.067 -10.615 1246 H GLU 156 H GLU 156 -11.949 10.185 -7.519 1247 HA GLU 156 HA GLU 156 -11.895 7.856 -5.733 1248 HB2 GLU 156 HB2 GLU 156 -13.286 9.565 -4.297 1249 HB3 GLU 156 HB3 GLU 156 -11.521 9.653 -4.353 1250 HG2 GLU 156 HG2 GLU 156 -11.585 11.505 -5.925 1251 HG3 GLU 156 HG3 GLU 156 -13.331 11.330 -6.147 1252 H VAL 157 H VAL 157 -14.204 10.188 -7.361 1253 HA VAL 157 HA VAL 157 -15.897 8.205 -8.278 1254 HB VAL 157 HB VAL 157 -16.293 7.832 -5.807 1255 HG11 VAL 157 HG11 VAL 157 -17.722 9.441 -4.597 1256 HG12 VAL 157 HG12 VAL 157 -16.121 10.135 -5.022 1257 HG13 VAL 157 HG13 VAL 157 -17.577 10.591 -5.970 1258 HG21 VAL 157 HG21 VAL 157 -18.756 7.722 -6.013 1259 HG22 VAL 157 HG22 VAL 157 -18.671 8.760 -7.476 1260 HG23 VAL 157 HG23 VAL 157 -17.922 7.128 -7.488 1261 HN1 EB4 158 HN1 EB4 158 4.100 -5.444 -7.280 1262 H8 EB4 158 H8 EB4 158 -1.702 -6.319 -3.989 1263 HN2 EB4 158 HN2 EB4 158 1.270 -4.496 -8.476 1264 H9 EB4 158 H9 EB4 158 0.909 -0.220 -2.977 1265 H10 EB4 158 H10 EB4 158 5.502 -7.265 -1.817 1266 HN3 EB4 158 HN3 EB4 158 3.660 -2.317 -7.613 1267 H7 EB4 158 H7 EB4 158 3.701 -5.600 -1.471 1268 H11 EB4 158 H11 EB4 158 -3.286 -6.938 -5.796 1269 H12 EB4 158 H12 EB4 158 2.122 1.804 -3.683 1270 H15 EB4 158 H15 EB4 158 3.801 1.679 -5.501 1271 H14 EB4 158 H14 EB4 158 -2.710 -6.469 -8.164 1272 H13 EB4 158 H13 EB4 158 6.217 -7.855 -4.111 1273 H22 EB4 158 H22 EB4 158 4.901 -6.194 -7.818 1274 H30 EB4 158 H30 EB4 158 6.080 -2.753 -10.383 1275 H30A EB4 158 H30A EB4 158 6.530 -2.277 -8.665 1276 H24 EB4 158 H24 EB4 158 4.208 -1.505 -8.349 1277 H28 EB4 158 H28 EB4 158 3.790 -7.897 -9.348 1278 H28A EB4 158 H28A EB4 158 4.434 -6.905 -10.743 1279 H23 EB4 158 H23 EB4 158 0.881 -4.762 -9.611 1280 H29 EB4 158 H29 EB4 158 0.541 -2.657 -10.618 1281 H29A EB4 158 H29A EB4 158 1.875 -3.061 -11.866 Start of MODEL 5 1 H1 MET 1 H1 MET 1 -29.231 4.890 -4.290 2 H2 MET 1 H2 MET 1 -28.420 6.298 -4.446 3 H3 MET 1 H3 MET 1 -29.077 5.585 -5.759 4 HA MET 1 HA MET 1 -27.387 3.756 -4.493 5 HB2 MET 1 HB2 MET 1 -27.241 5.159 -7.200 6 HB3 MET 1 HB3 MET 1 -26.250 3.775 -6.719 7 HG2 MET 1 HG2 MET 1 -28.293 2.391 -6.450 8 HG3 MET 1 HG3 MET 1 -29.299 3.775 -6.897 9 HE1 MET 1 HE1 MET 1 -29.725 1.684 -10.138 10 HE2 MET 1 HE2 MET 1 -29.752 1.145 -8.425 11 HE3 MET 1 HE3 MET 1 -30.525 2.698 -8.890 12 H THR 2 H THR 2 -24.892 3.902 -4.627 13 HA THR 2 HA THR 2 -23.059 4.848 -3.795 14 HB THR 2 HB THR 2 -23.805 7.347 -5.370 15 HG1 THR 2 HG1 THR 2 -22.913 6.180 -7.228 16 HG21 THR 2 HG21 THR 2 -21.366 7.366 -5.821 17 HG22 THR 2 HG22 THR 2 -21.708 7.375 -4.058 18 HG23 THR 2 HG23 THR 2 -21.179 5.859 -4.862 19 H VAL 3 H VAL 3 -25.004 4.975 -1.862 20 HA VAL 3 HA VAL 3 -25.342 7.702 -1.013 21 HB VAL 3 HB VAL 3 -26.553 6.678 0.918 22 HG11 VAL 3 HG11 VAL 3 -28.427 5.724 -0.386 23 HG12 VAL 3 HG12 VAL 3 -27.760 7.206 -1.151 24 HG13 VAL 3 HG13 VAL 3 -27.353 5.590 -1.820 25 HG21 VAL 3 HG21 VAL 3 -26.973 4.243 0.943 26 HG22 VAL 3 HG22 VAL 3 -25.834 4.037 -0.430 27 HG23 VAL 3 HG23 VAL 3 -25.232 4.628 1.155 28 HA PRO 4 HA PRO 4 -21.925 7.704 1.843 29 HB2 PRO 4 HB2 PRO 4 -22.790 9.603 3.642 30 HB3 PRO 4 HB3 PRO 4 -22.503 10.080 1.964 31 HG2 PRO 4 HG2 PRO 4 -25.117 9.439 3.350 32 HG3 PRO 4 HG3 PRO 4 -24.754 10.732 2.200 33 HD2 PRO 4 HD2 PRO 4 -26.004 8.349 1.496 34 HD3 PRO 4 HD3 PRO 4 -25.106 9.357 0.354 35 H ASP 5 H ASP 5 -22.897 5.330 2.309 36 HA ASP 5 HA ASP 5 -23.473 5.308 5.210 37 HB2 ASP 5 HB2 ASP 5 -24.425 3.619 2.918 38 HB3 ASP 5 HB3 ASP 5 -24.123 2.812 4.462 39 H ARG 6 H ARG 6 -22.591 2.246 3.722 40 HA ARG 6 HA ARG 6 -20.464 1.789 5.389 41 HB2 ARG 6 HB2 ARG 6 -21.437 0.690 2.772 42 HB3 ARG 6 HB3 ARG 6 -19.760 0.317 3.194 43 HG2 ARG 6 HG2 ARG 6 -21.015 -1.503 4.029 44 HG3 ARG 6 HG3 ARG 6 -20.643 -0.525 5.454 45 HD2 ARG 6 HD2 ARG 6 -22.956 -1.114 5.638 46 HD3 ARG 6 HD3 ARG 6 -22.917 0.595 5.184 47 HE ARG 6 HE ARG 6 -23.115 -0.685 2.753 48 HH11 ARG 6 HH11 ARG 6 -24.932 -0.921 5.754 49 HH12 ARG 6 HH12 ARG 6 -26.424 -1.309 4.964 50 HH21 ARG 6 HH21 ARG 6 -25.085 -1.196 1.729 51 HH22 ARG 6 HH22 ARG 6 -26.510 -1.466 2.676 52 H SER 7 H SER 7 -20.569 3.686 2.366 53 HA SER 7 HA SER 7 -17.983 3.633 1.496 54 HB2 SER 7 HB2 SER 7 -19.437 6.292 1.754 55 HB3 SER 7 HB3 SER 7 -18.613 5.607 0.346 56 HG SER 7 HG SER 7 -21.201 5.611 0.726 57 H GLU 8 H GLU 8 -19.235 5.292 4.461 58 HA GLU 8 HA GLU 8 -17.087 7.022 4.836 59 HB2 GLU 8 HB2 GLU 8 -18.760 5.587 6.950 60 HB3 GLU 8 HB3 GLU 8 -17.790 7.045 7.199 61 HG2 GLU 8 HG2 GLU 8 -19.288 8.068 5.287 62 HG3 GLU 8 HG3 GLU 8 -20.375 6.721 5.648 63 H ILE 9 H ILE 9 -17.312 3.494 5.331 64 HA ILE 9 HA ILE 9 -14.965 3.439 6.976 65 HB ILE 9 HB ILE 9 -16.412 1.080 5.717 66 HG12 ILE 9 HG12 ILE 9 -16.891 2.390 8.440 67 HG13 ILE 9 HG13 ILE 9 -17.939 2.611 7.032 68 HG21 ILE 9 HG21 ILE 9 -15.454 -0.139 7.643 69 HG22 ILE 9 HG22 ILE 9 -14.177 0.596 6.616 70 HG23 ILE 9 HG23 ILE 9 -14.626 1.362 8.177 71 HD11 ILE 9 HD11 ILE 9 -18.853 0.916 8.557 72 HD12 ILE 9 HD12 ILE 9 -18.408 0.176 6.982 73 HD13 ILE 9 HD13 ILE 9 -17.344 -0.048 8.411 74 H ALA 10 H ALA 10 -15.331 3.974 3.670 75 HA ALA 10 HA ALA 10 -12.724 2.690 3.145 76 HB1 ALA 10 HB1 ALA 10 -13.555 2.217 0.850 77 HB2 ALA 10 HB2 ALA 10 -14.523 1.358 2.095 78 HB3 ALA 10 HB3 ALA 10 -15.174 2.838 1.315 79 H GLY 11 H GLY 11 -12.168 3.692 0.622 80 HA2 GLY 11 HA2 GLY 11 -12.760 6.119 -0.215 81 HA3 GLY 11 HA3 GLY 11 -11.886 6.528 1.267 82 H LYS 12 H LYS 12 -10.233 7.601 -0.032 83 HA LYS 12 HA LYS 12 -8.513 5.708 -1.495 84 HB2 LYS 12 HB2 LYS 12 -7.688 7.686 -2.721 85 HB3 LYS 12 HB3 LYS 12 -9.422 7.430 -2.956 86 HG2 LYS 12 HG2 LYS 12 -9.896 9.216 -1.258 87 HG3 LYS 12 HG3 LYS 12 -8.158 9.490 -1.080 88 HD2 LYS 12 HD2 LYS 12 -7.949 10.173 -3.417 89 HD3 LYS 12 HD3 LYS 12 -9.610 9.678 -3.768 90 HE2 LYS 12 HE2 LYS 12 -9.791 12.013 -3.516 91 HE3 LYS 12 HE3 LYS 12 -10.326 11.396 -1.947 92 HZ1 LYS 12 HZ1 LYS 12 -8.662 13.270 -1.968 93 HZ2 LYS 12 HZ2 LYS 12 -8.325 12.016 -0.979 94 HZ3 LYS 12 HZ3 LYS 12 -7.530 12.174 -2.396 95 H TRP 13 H TRP 13 -6.277 5.670 -1.044 96 HA TRP 13 HA TRP 13 -5.391 7.366 1.203 97 HB2 TRP 13 HB2 TRP 13 -4.652 4.438 0.783 98 HB3 TRP 13 HB3 TRP 13 -4.218 5.476 2.147 99 HD1 TRP 13 HD1 TRP 13 -6.591 2.819 1.307 100 HE1 TRP 13 HE1 TRP 13 -8.608 2.790 2.927 101 HE3 TRP 13 HE3 TRP 13 -5.979 7.455 3.439 102 HZ2 TRP 13 HZ2 TRP 13 -9.790 4.486 4.835 103 HZ3 TRP 13 HZ3 TRP 13 -7.605 8.189 5.164 104 HH2 TRP 13 HH2 TRP 13 -9.481 6.723 5.852 105 H TYR 14 H TYR 14 -3.226 8.154 0.944 106 HA TYR 14 HA TYR 14 -2.057 7.532 -1.687 107 HB2 TYR 14 HB2 TYR 14 -1.609 9.908 0.180 108 HB3 TYR 14 HB3 TYR 14 -0.871 9.683 -1.411 109 HD1 TYR 14 HD1 TYR 14 -4.193 10.038 0.304 110 HD2 TYR 14 HD2 TYR 14 -2.010 10.383 -3.379 111 HE1 TYR 14 HE1 TYR 14 -6.157 11.106 -0.757 112 HE2 TYR 14 HE2 TYR 14 -3.977 11.443 -4.446 113 HH TYR 14 HH TYR 14 -6.289 11.699 -4.228 114 H VAL 15 H VAL 15 -0.269 6.174 -1.787 115 HA VAL 15 HA VAL 15 1.054 5.646 0.806 116 HB VAL 15 HB VAL 15 0.428 3.800 -0.723 117 HG11 VAL 15 HG11 VAL 15 1.584 3.418 -2.880 118 HG12 VAL 15 HG12 VAL 15 0.537 4.877 -2.896 119 HG13 VAL 15 HG13 VAL 15 2.319 5.053 -2.758 120 HG21 VAL 15 HG21 VAL 15 2.638 2.663 -0.843 121 HG22 VAL 15 HG22 VAL 15 3.441 4.238 -0.527 122 HG23 VAL 15 HG23 VAL 15 2.376 3.506 0.720 123 H VAL 16 H VAL 16 2.495 7.068 1.439 124 HA VAL 16 HA VAL 16 4.122 8.469 -0.557 125 HB VAL 16 HB VAL 16 4.570 10.088 1.243 126 HG11 VAL 16 HG11 VAL 16 2.356 11.136 1.386 127 HG12 VAL 16 HG12 VAL 16 2.720 10.528 -0.264 128 HG13 VAL 16 HG13 VAL 16 1.620 9.602 0.812 129 HG21 VAL 16 HG21 VAL 16 3.312 10.043 3.362 130 HG22 VAL 16 HG22 VAL 16 2.641 8.443 2.898 131 HG23 VAL 16 HG23 VAL 16 4.404 8.627 3.188 132 H ALA 17 H ALA 17 4.269 5.683 1.235 133 HA ALA 17 HA ALA 17 7.174 5.927 1.513 134 HB1 ALA 17 HB1 ALA 17 7.081 4.808 3.714 135 HB2 ALA 17 HB2 ALA 17 6.287 6.419 3.746 136 HB3 ALA 17 HB3 ALA 17 5.314 4.938 3.684 137 H LEU 18 H LEU 18 8.261 3.819 1.453 138 HA LEU 18 HA LEU 18 6.619 1.508 0.891 139 HB2 LEU 18 HB2 LEU 18 8.503 2.726 -1.189 140 HB3 LEU 18 HB3 LEU 18 7.745 1.133 -1.311 141 HG LEU 18 HG LEU 18 6.019 3.598 -1.012 142 HD11 LEU 18 HD11 LEU 18 5.948 3.799 -3.478 143 HD12 LEU 18 HD12 LEU 18 7.588 4.128 -2.825 144 HD13 LEU 18 HD13 LEU 18 7.234 2.553 -3.611 145 HD21 LEU 18 HD21 LEU 18 4.442 2.224 -2.333 146 HD22 LEU 18 HD22 LEU 18 5.665 0.912 -2.419 147 HD23 LEU 18 HD23 LEU 18 4.968 1.388 -0.833 148 H ALA 19 H ALA 19 7.797 -0.488 1.026 149 HA ALA 19 HA ALA 19 10.697 -0.313 1.520 150 HB1 ALA 19 HB1 ALA 19 10.451 -1.659 3.568 151 HB2 ALA 19 HB2 ALA 19 9.642 -0.066 3.745 152 HB3 ALA 19 HB3 ALA 19 8.663 -1.541 3.445 153 H SER 20 H SER 20 11.692 -2.121 0.543 154 HA SER 20 HA SER 20 9.926 -4.390 -0.068 155 HB2 SER 20 HB2 SER 20 11.860 -3.071 -2.059 156 HB3 SER 20 HB3 SER 20 10.839 -4.481 -2.369 157 HG SER 20 HG SER 20 10.125 -2.127 -2.979 158 H ASN 21 H ASN 21 10.940 -6.433 -0.225 159 HA ASN 21 HA ASN 21 13.495 -6.536 1.174 160 HB2 ASN 21 HB2 ASN 21 11.275 -7.972 1.538 161 HB3 ASN 21 HB3 ASN 21 11.886 -8.913 0.170 162 HD21 ASN 21 HD21 ASN 21 14.768 -8.542 0.942 163 HD22 ASN 21 HD22 ASN 21 15.006 -9.588 2.302 164 H THR 22 H THR 22 12.276 -6.649 -2.158 165 HA THR 22 HA THR 22 14.588 -8.236 -3.016 166 HB THR 22 HB THR 22 13.249 -7.314 -5.281 167 HG1 THR 22 HG1 THR 22 11.184 -6.853 -4.777 168 HG21 THR 22 HG21 THR 22 12.172 -9.550 -5.302 169 HG22 THR 22 HG22 THR 22 13.884 -9.654 -4.768 170 HG23 THR 22 HG23 THR 22 12.558 -9.751 -3.560 171 H GLU 23 H GLU 23 16.438 -7.433 -3.812 172 HA GLU 23 HA GLU 23 17.230 -4.826 -3.464 173 HB2 GLU 23 HB2 GLU 23 18.161 -6.708 -5.698 174 HB3 GLU 23 HB3 GLU 23 19.103 -5.427 -4.924 175 HG2 GLU 23 HG2 GLU 23 18.081 -7.881 -3.428 176 HG3 GLU 23 HG3 GLU 23 19.654 -7.821 -4.234 177 H PHE 24 H PHE 24 16.105 -6.387 -6.583 178 HA PHE 24 HA PHE 24 16.378 -4.157 -8.182 179 HB2 PHE 24 HB2 PHE 24 14.353 -6.445 -8.265 180 HB3 PHE 24 HB3 PHE 24 14.544 -5.261 -9.564 181 HD1 PHE 24 HD1 PHE 24 16.773 -5.095 -10.763 182 HD2 PHE 24 HD2 PHE 24 15.824 -8.295 -8.062 183 HE1 PHE 24 HE1 PHE 24 18.592 -6.461 -11.744 184 HE2 PHE 24 HE2 PHE 24 17.641 -9.663 -9.038 185 HZ PHE 24 HZ PHE 24 19.027 -8.749 -10.887 186 H PHE 25 H PHE 25 13.449 -5.180 -6.238 187 HA PHE 25 HA PHE 25 11.735 -3.219 -7.127 188 HB2 PHE 25 HB2 PHE 25 12.044 -4.725 -4.512 189 HB3 PHE 25 HB3 PHE 25 10.813 -3.464 -4.670 190 HD1 PHE 25 HD1 PHE 25 12.073 -6.266 -6.868 191 HD2 PHE 25 HD2 PHE 25 8.709 -4.297 -5.072 192 HE1 PHE 25 HE1 PHE 25 10.548 -7.887 -7.953 193 HE2 PHE 25 HE2 PHE 25 7.181 -5.913 -6.153 194 HZ PHE 25 HZ PHE 25 8.097 -7.715 -7.594 195 H LEU 26 H LEU 26 14.094 -3.023 -4.342 196 HA LEU 26 HA LEU 26 13.371 -0.441 -3.529 197 HB2 LEU 26 HB2 LEU 26 16.150 -1.706 -3.496 198 HB3 LEU 26 HB3 LEU 26 15.541 -0.435 -2.428 199 HG LEU 26 HG LEU 26 14.556 -3.320 -2.496 200 HD11 LEU 26 HD11 LEU 26 15.660 -3.500 -0.295 201 HD12 LEU 26 HD12 LEU 26 16.831 -3.126 -1.604 202 HD13 LEU 26 HD13 LEU 26 16.296 -1.831 -0.481 203 HD21 LEU 26 HD21 LEU 26 13.330 -2.703 -0.443 204 HD22 LEU 26 HD22 LEU 26 13.866 -1.000 -0.639 205 HD23 LEU 26 HD23 LEU 26 12.784 -1.748 -1.862 206 H ARG 27 H ARG 27 15.940 -1.617 -5.825 207 HA ARG 27 HA ARG 27 17.019 0.869 -6.416 208 HB2 ARG 27 HB2 ARG 27 17.805 -1.544 -7.015 209 HB3 ARG 27 HB3 ARG 27 16.755 -1.391 -8.430 210 HG2 ARG 27 HG2 ARG 27 18.018 0.816 -8.935 211 HG3 ARG 27 HG3 ARG 27 19.186 0.303 -7.710 212 HD2 ARG 27 HD2 ARG 27 20.062 -0.463 -9.796 213 HD3 ARG 27 HD3 ARG 27 19.419 -1.900 -8.991 214 HE ARG 27 HE ARG 27 17.308 -0.989 -10.544 215 HH11 ARG 27 HH11 ARG 27 20.645 -1.897 -11.185 216 HH12 ARG 27 HH12 ARG 27 20.307 -2.447 -12.792 217 HH21 ARG 27 HH21 ARG 27 16.878 -1.698 -12.631 218 HH22 ARG 27 HH22 ARG 27 18.152 -2.333 -13.620 219 H GLU 28 H GLU 28 14.325 -0.967 -8.091 220 HA GLU 28 HA GLU 28 13.958 1.093 -10.012 221 HB2 GLU 28 HB2 GLU 28 12.081 -1.151 -9.147 222 HB3 GLU 28 HB3 GLU 28 11.922 -0.164 -10.605 223 HG2 GLU 28 HG2 GLU 28 14.042 -2.247 -9.959 224 HG3 GLU 28 HG3 GLU 28 12.878 -2.240 -11.290 225 H LYS 29 H LYS 29 12.009 0.113 -7.042 226 HA LYS 29 HA LYS 29 10.117 2.106 -7.338 227 HB2 LYS 29 HB2 LYS 29 10.932 0.179 -5.316 228 HB3 LYS 29 HB3 LYS 29 10.519 1.720 -4.552 229 HG2 LYS 29 HG2 LYS 29 8.694 0.332 -6.571 230 HG3 LYS 29 HG3 LYS 29 8.613 0.028 -4.831 231 HD2 LYS 29 HD2 LYS 29 7.031 1.720 -5.026 232 HD3 LYS 29 HD3 LYS 29 8.471 2.678 -4.654 233 HE2 LYS 29 HE2 LYS 29 7.666 3.847 -6.491 234 HE3 LYS 29 HE3 LYS 29 8.775 2.730 -7.296 235 HZ1 LYS 29 HZ1 LYS 29 7.056 1.974 -8.429 236 HZ2 LYS 29 HZ2 LYS 29 6.309 1.466 -7.070 237 HZ3 LYS 29 HZ3 LYS 29 6.022 2.966 -7.647 238 H ASP 30 H ASP 30 13.293 2.269 -5.508 239 HA ASP 30 HA ASP 30 12.884 4.781 -4.409 240 HB2 ASP 30 HB2 ASP 30 14.788 3.671 -3.622 241 HB3 ASP 30 HB3 ASP 30 15.304 3.165 -5.236 242 H LYS 31 H LYS 31 13.801 3.825 -7.766 243 HA LYS 31 HA LYS 31 14.423 6.553 -8.472 244 HB2 LYS 31 HB2 LYS 31 14.334 3.896 -9.912 245 HB3 LYS 31 HB3 LYS 31 14.383 5.407 -10.830 246 HG2 LYS 31 HG2 LYS 31 16.418 4.625 -8.681 247 HG3 LYS 31 HG3 LYS 31 16.648 4.373 -10.416 248 HD2 LYS 31 HD2 LYS 31 17.421 6.486 -10.606 249 HD3 LYS 31 HD3 LYS 31 15.829 7.095 -10.133 250 HE2 LYS 31 HE2 LYS 31 17.956 6.234 -8.112 251 HE3 LYS 31 HE3 LYS 31 17.817 7.889 -8.720 252 HZ1 LYS 31 HZ1 LYS 31 16.583 7.890 -6.801 253 HZ2 LYS 31 HZ2 LYS 31 15.414 7.683 -7.921 254 HZ3 LYS 31 HZ3 LYS 31 15.933 6.412 -7.038 255 H MET 32 H MET 32 11.291 4.652 -8.122 256 HA MET 32 HA MET 32 10.452 6.464 -10.334 257 HB2 MET 32 HB2 MET 32 9.145 4.286 -8.332 258 HB3 MET 32 HB3 MET 32 8.179 5.016 -9.621 259 HG2 MET 32 HG2 MET 32 10.738 3.540 -10.351 260 HG3 MET 32 HG3 MET 32 9.296 2.604 -9.934 261 HE1 MET 32 HE1 MET 32 9.770 2.762 -13.984 262 HE2 MET 32 HE2 MET 32 11.098 3.026 -12.805 263 HE3 MET 32 HE3 MET 32 9.923 1.692 -12.551 264 H LYS 33 H LYS 33 7.569 6.342 -8.748 265 HA LYS 33 HA LYS 33 8.281 8.728 -7.088 266 HB2 LYS 33 HB2 LYS 33 6.055 8.740 -9.195 267 HB3 LYS 33 HB3 LYS 33 6.323 9.997 -7.981 268 HG2 LYS 33 HG2 LYS 33 8.455 10.610 -8.972 269 HG3 LYS 33 HG3 LYS 33 8.415 9.216 -10.060 270 HD2 LYS 33 HD2 LYS 33 6.377 10.132 -11.175 271 HD3 LYS 33 HD3 LYS 33 6.391 11.518 -10.075 272 HE2 LYS 33 HE2 LYS 33 8.594 12.232 -10.925 273 HE3 LYS 33 HE3 LYS 33 8.715 10.783 -11.931 274 HZ1 LYS 33 HZ1 LYS 33 7.975 12.676 -13.191 275 HZ2 LYS 33 HZ2 LYS 33 6.788 11.556 -13.156 276 HZ3 LYS 33 HZ3 LYS 33 6.676 12.893 -12.226 277 H MET 34 H MET 34 5.861 9.413 -6.028 278 HA MET 34 HA MET 34 5.317 7.200 -4.319 279 HB2 MET 34 HB2 MET 34 5.082 9.496 -3.517 280 HB3 MET 34 HB3 MET 34 4.054 9.946 -4.884 281 HG2 MET 34 HG2 MET 34 2.256 8.437 -3.998 282 HG3 MET 34 HG3 MET 34 3.282 8.060 -2.608 283 HE1 MET 34 HE1 MET 34 1.240 12.099 -3.539 284 HE2 MET 34 HE2 MET 34 2.869 11.849 -4.252 285 HE3 MET 34 HE3 MET 34 1.527 10.731 -4.667 286 H ALA 35 H ALA 35 3.223 6.104 -4.094 287 HA ALA 35 HA ALA 35 1.845 5.806 -6.655 288 HB1 ALA 35 HB1 ALA 35 1.316 3.511 -5.933 289 HB2 ALA 35 HB2 ALA 35 3.080 3.814 -6.081 290 HB3 ALA 35 HB3 ALA 35 2.311 3.763 -4.459 291 H MET 36 H MET 36 -0.455 4.612 -6.167 292 HA MET 36 HA MET 36 -1.734 6.279 -4.092 293 HB2 MET 36 HB2 MET 36 -2.700 5.448 -6.899 294 HB3 MET 36 HB3 MET 36 -3.744 6.207 -5.690 295 HG2 MET 36 HG2 MET 36 -1.195 7.641 -6.342 296 HG3 MET 36 HG3 MET 36 -2.414 7.575 -7.622 297 HE1 MET 36 HE1 MET 36 -2.692 11.198 -5.945 298 HE2 MET 36 HE2 MET 36 -1.199 10.213 -5.780 299 HE3 MET 36 HE3 MET 36 -2.077 10.258 -7.346 300 H ALA 37 H ALA 37 -3.931 5.307 -3.385 301 HA ALA 37 HA ALA 37 -4.370 2.475 -3.958 302 HB1 ALA 37 HB1 ALA 37 -4.030 1.835 -1.555 303 HB2 ALA 37 HB2 ALA 37 -2.495 2.442 -2.261 304 HB3 ALA 37 HB3 ALA 37 -3.468 3.500 -1.184 305 H ARG 38 H ARG 38 -6.506 2.315 -4.096 306 HA ARG 38 HA ARG 38 -8.192 3.845 -2.200 307 HB2 ARG 38 HB2 ARG 38 -8.215 4.984 -4.399 308 HB3 ARG 38 HB3 ARG 38 -8.664 3.468 -5.191 309 HG2 ARG 38 HG2 ARG 38 -10.435 4.325 -2.932 310 HG3 ARG 38 HG3 ARG 38 -10.452 5.366 -4.361 311 HD2 ARG 38 HD2 ARG 38 -10.844 3.295 -5.786 312 HD3 ARG 38 HD3 ARG 38 -10.982 2.352 -4.296 313 HE ARG 38 HE ARG 38 -13.112 3.209 -3.986 314 HH11 ARG 38 HH11 ARG 38 -11.446 5.188 -6.372 315 HH12 ARG 38 HH12 ARG 38 -12.842 6.151 -6.721 316 HH21 ARG 38 HH21 ARG 38 -14.921 4.512 -4.437 317 HH22 ARG 38 HH22 ARG 38 -14.811 5.768 -5.624 318 H ILE 39 H ILE 39 -9.566 2.371 -1.127 319 HA ILE 39 HA ILE 39 -9.761 -0.265 -2.385 320 HB ILE 39 HB ILE 39 -10.022 0.343 0.595 321 HG12 ILE 39 HG12 ILE 39 -7.786 1.006 -0.031 322 HG13 ILE 39 HG13 ILE 39 -7.714 -0.525 0.852 323 HG21 ILE 39 HG21 ILE 39 -9.595 -2.084 0.839 324 HG22 ILE 39 HG22 ILE 39 -11.061 -1.750 -0.144 325 HG23 ILE 39 HG23 ILE 39 -9.534 -2.245 -0.949 326 HD11 ILE 39 HD11 ILE 39 -6.167 -0.529 -1.052 327 HD12 ILE 39 HD12 ILE 39 -7.455 -1.759 -1.282 328 HD13 ILE 39 HD13 ILE 39 -7.528 -0.204 -2.178 329 H SER 40 H SER 40 -11.801 -1.358 -2.381 330 HA SER 40 HA SER 40 -14.072 0.235 -1.383 331 HB2 SER 40 HB2 SER 40 -13.877 -1.261 -4.047 332 HB3 SER 40 HB3 SER 40 -15.318 -0.450 -3.418 333 HG SER 40 HG SER 40 -14.126 0.895 -4.913 334 H PHE 41 H PHE 41 -15.550 -0.933 -0.158 335 HA PHE 41 HA PHE 41 -14.870 -3.628 0.519 336 HB2 PHE 41 HB2 PHE 41 -17.083 -3.474 1.782 337 HB3 PHE 41 HB3 PHE 41 -15.831 -2.313 2.242 338 HD1 PHE 41 HD1 PHE 41 -19.126 -2.740 0.638 339 HD2 PHE 41 HD2 PHE 41 -16.091 0.074 1.785 340 HE1 PHE 41 HE1 PHE 41 -20.723 -0.881 0.297 341 HE2 PHE 41 HE2 PHE 41 -17.684 1.935 1.442 342 HZ PHE 41 HZ PHE 41 -20.007 1.463 0.701 343 H LEU 42 H LEU 42 -15.100 -5.229 -0.999 344 HA LEU 42 HA LEU 42 -17.115 -5.126 -3.012 345 HB2 LEU 42 HB2 LEU 42 -14.738 -6.341 -2.848 346 HB3 LEU 42 HB3 LEU 42 -15.707 -7.661 -2.181 347 HG LEU 42 HG LEU 42 -15.347 -8.009 -4.547 348 HD11 LEU 42 HD11 LEU 42 -17.682 -8.214 -5.332 349 HD12 LEU 42 HD12 LEU 42 -17.491 -8.756 -3.630 350 HD13 LEU 42 HD13 LEU 42 -18.221 -7.154 -3.986 351 HD21 LEU 42 HD21 LEU 42 -16.235 -6.447 -6.250 352 HD22 LEU 42 HD22 LEU 42 -16.699 -5.301 -4.947 353 HD23 LEU 42 HD23 LEU 42 -14.968 -5.684 -5.232 354 H GLY 43 H GLY 43 -16.699 -6.844 0.151 355 HA2 GLY 43 HA2 GLY 43 -19.482 -7.149 0.529 356 HA3 GLY 43 HA3 GLY 43 -18.792 -8.649 -0.105 357 H GLU 44 H GLU 44 -19.764 -9.019 2.345 358 HA GLU 44 HA GLU 44 -18.255 -8.240 4.525 359 HB2 GLU 44 HB2 GLU 44 -19.509 -11.004 4.236 360 HB3 GLU 44 HB3 GLU 44 -19.315 -10.039 5.705 361 HG2 GLU 44 HG2 GLU 44 -21.547 -9.675 5.333 362 HG3 GLU 44 HG3 GLU 44 -20.895 -8.324 4.396 363 H ASP 45 H ASP 45 -17.600 -10.793 2.064 364 HA ASP 45 HA ASP 45 -15.205 -11.527 3.608 365 HB2 ASP 45 HB2 ASP 45 -16.638 -13.459 3.355 366 HB3 ASP 45 HB3 ASP 45 -17.020 -13.058 1.676 367 H GLU 46 H GLU 46 -16.187 -9.744 0.796 368 HA GLU 46 HA GLU 46 -13.493 -10.224 -0.279 369 HB2 GLU 46 HB2 GLU 46 -15.299 -11.276 -1.686 370 HB3 GLU 46 HB3 GLU 46 -16.022 -9.678 -1.909 371 HG2 GLU 46 HG2 GLU 46 -14.148 -8.879 -3.165 372 HG3 GLU 46 HG3 GLU 46 -13.125 -10.230 -2.661 373 H LEU 47 H LEU 47 -12.422 -8.468 -1.303 374 HA LEU 47 HA LEU 47 -13.623 -5.852 -0.868 375 HB2 LEU 47 HB2 LEU 47 -11.504 -5.008 0.082 376 HB3 LEU 47 HB3 LEU 47 -12.353 -6.152 1.129 377 HG LEU 47 HG LEU 47 -10.122 -7.123 -0.670 378 HD11 LEU 47 HD11 LEU 47 -8.523 -6.694 1.168 379 HD12 LEU 47 HD12 LEU 47 -9.212 -5.170 0.513 380 HD13 LEU 47 HD13 LEU 47 -9.806 -5.825 2.076 381 HD21 LEU 47 HD21 LEU 47 -9.854 -8.770 1.158 382 HD22 LEU 47 HD22 LEU 47 -11.185 -7.975 2.065 383 HD23 LEU 47 HD23 LEU 47 -11.523 -8.776 0.493 384 H LYS 48 H LYS 48 -12.849 -4.213 -2.285 385 HA LYS 48 HA LYS 48 -11.284 -5.260 -4.558 386 HB2 LYS 48 HB2 LYS 48 -13.774 -3.830 -4.322 387 HB3 LYS 48 HB3 LYS 48 -12.589 -2.740 -5.054 388 HG2 LYS 48 HG2 LYS 48 -12.097 -4.427 -6.808 389 HG3 LYS 48 HG3 LYS 48 -13.241 -5.552 -6.064 390 HD2 LYS 48 HD2 LYS 48 -15.092 -3.912 -6.412 391 HD3 LYS 48 HD3 LYS 48 -13.952 -2.769 -7.135 392 HE2 LYS 48 HE2 LYS 48 -14.557 -5.573 -8.213 393 HE3 LYS 48 HE3 LYS 48 -15.253 -4.072 -8.839 394 HZ1 LYS 48 HZ1 LYS 48 -13.486 -4.254 -10.191 395 HZ2 LYS 48 HZ2 LYS 48 -12.695 -3.486 -8.987 396 HZ3 LYS 48 HZ3 LYS 48 -12.570 -5.107 -9.143 397 H VAL 49 H VAL 49 -9.340 -4.148 -5.093 398 HA VAL 49 HA VAL 49 -8.843 -1.708 -3.532 399 HB VAL 49 HB VAL 49 -6.476 -2.387 -3.327 400 HG11 VAL 49 HG11 VAL 49 -6.793 -4.144 -1.608 401 HG12 VAL 49 HG12 VAL 49 -8.033 -2.851 -1.485 402 HG13 VAL 49 HG13 VAL 49 -8.456 -4.434 -2.221 403 HG21 VAL 49 HG21 VAL 49 -5.794 -4.717 -3.782 404 HG22 VAL 49 HG22 VAL 49 -7.408 -5.043 -4.500 405 HG23 VAL 49 HG23 VAL 49 -6.303 -3.858 -5.275 406 H SER 50 H SER 50 -8.216 0.037 -4.806 407 HA SER 50 HA SER 50 -7.466 -0.587 -7.616 408 HB2 SER 50 HB2 SER 50 -9.541 0.768 -7.263 409 HB3 SER 50 HB3 SER 50 -8.645 1.901 -6.243 410 HG SER 50 HG SER 50 -7.308 2.428 -8.080 411 H TYR 51 H TYR 51 -5.327 -0.405 -8.016 412 HA TYR 51 HA TYR 51 -3.702 1.255 -6.212 413 HB2 TYR 51 HB2 TYR 51 -3.317 -1.250 -7.826 414 HB3 TYR 51 HB3 TYR 51 -1.953 -0.125 -7.814 415 HD1 TYR 51 HD1 TYR 51 -2.266 0.924 -4.945 416 HD2 TYR 51 HD2 TYR 51 -2.417 -3.040 -6.593 417 HE1 TYR 51 HE1 TYR 51 -1.472 -0.004 -2.789 418 HE2 TYR 51 HE2 TYR 51 -1.656 -3.971 -4.432 419 HH TYR 51 HH TYR 51 -1.004 -3.559 -2.376 420 H ALA 52 H ALA 52 -2.411 2.939 -7.111 421 HA ALA 52 HA ALA 52 -2.545 3.271 -10.036 422 HB1 ALA 52 HB1 ALA 52 -2.950 5.682 -9.712 423 HB2 ALA 52 HB2 ALA 52 -4.307 4.687 -9.082 424 HB3 ALA 52 HB3 ALA 52 -3.123 5.414 -7.944 425 H VAL 53 H VAL 53 -0.518 3.699 -10.883 426 HA VAL 53 HA VAL 53 1.420 4.930 -9.091 427 HB VAL 53 HB VAL 53 3.182 3.321 -9.903 428 HG11 VAL 53 HG11 VAL 53 2.538 1.473 -8.385 429 HG12 VAL 53 HG12 VAL 53 2.186 3.084 -7.673 430 HG13 VAL 53 HG13 VAL 53 0.853 2.093 -8.356 431 HG21 VAL 53 HG21 VAL 53 2.465 1.141 -10.823 432 HG22 VAL 53 HG22 VAL 53 0.775 1.742 -10.914 433 HG23 VAL 53 HG23 VAL 53 2.054 2.504 -11.918 434 HA PRO 54 HA PRO 54 2.381 6.938 -12.995 435 HB2 PRO 54 HB2 PRO 54 4.506 8.450 -12.113 436 HB3 PRO 54 HB3 PRO 54 2.905 8.764 -11.429 437 HG2 PRO 54 HG2 PRO 54 5.233 7.260 -10.238 438 HG3 PRO 54 HG3 PRO 54 4.053 8.308 -9.441 439 HD2 PRO 54 HD2 PRO 54 3.966 5.484 -9.479 440 HD3 PRO 54 HD3 PRO 54 2.618 6.541 -9.037 441 H LYS 55 H LYS 55 2.977 5.253 -14.330 442 HA LYS 55 HA LYS 55 5.747 4.357 -14.210 443 HB2 LYS 55 HB2 LYS 55 3.923 2.668 -14.339 444 HB3 LYS 55 HB3 LYS 55 3.409 3.357 -15.885 445 HG2 LYS 55 HG2 LYS 55 5.621 2.776 -16.887 446 HG3 LYS 55 HG3 LYS 55 6.150 2.102 -15.340 447 HD2 LYS 55 HD2 LYS 55 4.441 0.366 -15.413 448 HD3 LYS 55 HD3 LYS 55 3.631 1.132 -16.785 449 HE2 LYS 55 HE2 LYS 55 4.837 -0.296 -18.074 450 HE3 LYS 55 HE3 LYS 55 6.190 0.807 -17.792 451 HZ1 LYS 55 HZ1 LYS 55 6.771 -1.456 -17.277 452 HZ2 LYS 55 HZ2 LYS 55 6.825 -0.563 -15.912 453 HZ3 LYS 55 HZ3 LYS 55 5.576 -1.581 -16.172 454 HA PRO 56 HA PRO 56 7.147 7.129 -17.432 455 HB2 PRO 56 HB2 PRO 56 8.123 4.494 -18.693 456 HB3 PRO 56 HB3 PRO 56 9.037 5.992 -18.472 457 HG2 PRO 56 HG2 PRO 56 9.449 3.929 -16.824 458 HG3 PRO 56 HG3 PRO 56 9.436 5.578 -16.185 459 HD2 PRO 56 HD2 PRO 56 7.353 3.418 -15.911 460 HD3 PRO 56 HD3 PRO 56 7.758 4.728 -14.794 461 H ASN 57 H ASN 57 5.477 4.054 -18.349 462 HA ASN 57 HA ASN 57 4.839 5.039 -20.952 463 HB2 ASN 57 HB2 ASN 57 3.494 2.785 -19.364 464 HB3 ASN 57 HB3 ASN 57 3.511 2.989 -21.121 465 HD21 ASN 57 HD21 ASN 57 5.249 2.222 -22.308 466 HD22 ASN 57 HD22 ASN 57 6.587 1.373 -21.611 467 H GLY 58 H GLY 58 3.736 6.167 -17.975 468 HA2 GLY 58 HA2 GLY 58 2.030 7.895 -18.217 469 HA3 GLY 58 HA3 GLY 58 1.058 6.720 -19.112 470 H CYS 59 H CYS 59 -0.042 7.978 -16.839 471 HA CYS 59 HA CYS 59 0.338 6.782 -14.403 472 HB2 CYS 59 HB2 CYS 59 -2.164 7.855 -15.767 473 HB3 CYS 59 HB3 CYS 59 -2.173 7.281 -14.094 474 H ARG 60 H ARG 60 0.177 4.687 -13.683 475 HA ARG 60 HA ARG 60 -1.601 2.937 -15.225 476 HB2 ARG 60 HB2 ARG 60 1.052 2.639 -14.961 477 HB3 ARG 60 HB3 ARG 60 0.551 1.830 -13.471 478 HG2 ARG 60 HG2 ARG 60 0.741 0.161 -15.205 479 HG3 ARG 60 HG3 ARG 60 -0.974 0.354 -14.817 480 HD2 ARG 60 HD2 ARG 60 0.519 1.505 -17.227 481 HD3 ARG 60 HD3 ARG 60 -0.722 0.245 -17.241 482 HE ARG 60 HE ARG 60 -1.152 3.148 -16.910 483 HH11 ARG 60 HH11 ARG 60 -2.543 -0.085 -16.953 484 HH12 ARG 60 HH12 ARG 60 -4.170 0.492 -17.105 485 HH21 ARG 60 HH21 ARG 60 -3.280 3.885 -17.064 486 HH22 ARG 60 HH22 ARG 60 -4.589 2.755 -17.168 487 H LYS 61 H LYS 61 -3.298 1.932 -14.312 488 HA LYS 61 HA LYS 61 -3.402 1.959 -11.363 489 HB2 LYS 61 HB2 LYS 61 -5.005 3.568 -11.880 490 HB3 LYS 61 HB3 LYS 61 -5.424 2.826 -13.429 491 HG2 LYS 61 HG2 LYS 61 -6.643 1.017 -12.290 492 HG3 LYS 61 HG3 LYS 61 -6.127 1.617 -10.708 493 HD2 LYS 61 HD2 LYS 61 -7.518 3.523 -10.819 494 HD3 LYS 61 HD3 LYS 61 -7.617 3.480 -12.584 495 HE2 LYS 61 HE2 LYS 61 -9.745 2.759 -11.473 496 HE3 LYS 61 HE3 LYS 61 -9.068 1.516 -12.534 497 HZ1 LYS 61 HZ1 LYS 61 -9.806 0.648 -10.403 498 HZ2 LYS 61 HZ2 LYS 61 -8.206 0.397 -10.609 499 HZ3 LYS 61 HZ3 LYS 61 -8.724 1.574 -9.604 500 H TRP 62 H TRP 62 -4.474 0.088 -10.430 501 HA TRP 62 HA TRP 62 -5.318 -2.020 -12.266 502 HB2 TRP 62 HB2 TRP 62 -2.743 -2.127 -11.675 503 HB3 TRP 62 HB3 TRP 62 -3.324 -2.710 -10.109 504 HD1 TRP 62 HD1 TRP 62 -3.520 -5.286 -9.995 505 HE1 TRP 62 HE1 TRP 62 -3.914 -7.198 -11.694 506 HE3 TRP 62 HE3 TRP 62 -4.127 -2.471 -14.251 507 HZ2 TRP 62 HZ2 TRP 62 -4.427 -7.486 -14.446 508 HZ3 TRP 62 HZ3 TRP 62 -4.576 -3.643 -16.394 509 HH2 TRP 62 HH2 TRP 62 -4.720 -6.115 -16.487 510 H GLU 63 H GLU 63 -6.793 -3.512 -11.181 511 HA GLU 63 HA GLU 63 -7.429 -2.654 -8.422 512 HB2 GLU 63 HB2 GLU 63 -9.028 -2.140 -10.654 513 HB3 GLU 63 HB3 GLU 63 -9.671 -3.693 -10.105 514 HG2 GLU 63 HG2 GLU 63 -10.208 -2.818 -7.927 515 HG3 GLU 63 HG3 GLU 63 -9.268 -1.346 -8.203 516 H THR 64 H THR 64 -7.551 -4.318 -7.008 517 HA THR 64 HA THR 64 -7.697 -7.025 -8.129 518 HB THR 64 HB THR 64 -6.258 -6.500 -5.526 519 HG1 THR 64 HG1 THR 64 -4.838 -5.213 -6.474 520 HG21 THR 64 HG21 THR 64 -4.850 -8.380 -6.366 521 HG22 THR 64 HG22 THR 64 -6.596 -8.802 -6.377 522 HG23 THR 64 HG23 THR 64 -5.768 -8.365 -7.910 523 H THR 65 H THR 65 -8.948 -8.564 -6.897 524 HA THR 65 HA THR 65 -10.491 -7.361 -4.675 525 HB THR 65 HB THR 65 -11.355 -9.808 -6.203 526 HG1 THR 65 HG1 THR 65 -12.387 -8.299 -7.739 527 HG21 THR 65 HG21 THR 65 -13.579 -8.851 -5.722 528 HG22 THR 65 HG22 THR 65 -12.607 -9.035 -4.223 529 HG23 THR 65 HG23 THR 65 -12.802 -7.415 -4.974 530 H PHE 66 H PHE 66 -10.052 -8.097 -2.659 531 HA PHE 66 HA PHE 66 -8.727 -10.720 -2.483 532 HB2 PHE 66 HB2 PHE 66 -8.595 -8.448 -0.455 533 HB3 PHE 66 HB3 PHE 66 -7.637 -9.934 -0.475 534 HD1 PHE 66 HD1 PHE 66 -6.907 -9.980 -3.425 535 HD2 PHE 66 HD2 PHE 66 -6.920 -6.812 -0.531 536 HE1 PHE 66 HE1 PHE 66 -5.129 -8.819 -4.695 537 HE2 PHE 66 HE2 PHE 66 -5.147 -5.641 -1.799 538 HZ PHE 66 HZ PHE 66 -4.247 -6.640 -3.888 539 H LYS 67 H LYS 67 -9.056 -11.600 -0.040 540 HA LYS 67 HA LYS 67 -11.945 -11.357 0.534 541 HB2 LYS 67 HB2 LYS 67 -10.034 -13.716 0.495 542 HB3 LYS 67 HB3 LYS 67 -11.466 -13.739 1.533 543 HG2 LYS 67 HG2 LYS 67 -11.934 -14.879 -0.580 544 HG3 LYS 67 HG3 LYS 67 -12.930 -13.425 -0.442 545 HD2 LYS 67 HD2 LYS 67 -11.439 -12.183 -1.944 546 HD3 LYS 67 HD3 LYS 67 -10.276 -13.515 -1.967 547 HE2 LYS 67 HE2 LYS 67 -11.803 -14.961 -3.159 548 HE3 LYS 67 HE3 LYS 67 -13.169 -13.873 -2.879 549 HZ1 LYS 67 HZ1 LYS 67 -12.603 -12.697 -4.648 550 HZ2 LYS 67 HZ2 LYS 67 -11.031 -12.574 -4.225 551 HZ3 LYS 67 HZ3 LYS 67 -11.554 -13.881 -5.052 552 H LYS 68 H LYS 68 -12.555 -11.447 2.817 553 HA LYS 68 HA LYS 68 -10.768 -10.052 4.468 554 HB2 LYS 68 HB2 LYS 68 -13.228 -9.907 4.668 555 HB3 LYS 68 HB3 LYS 68 -13.312 -11.610 5.138 556 HG2 LYS 68 HG2 LYS 68 -13.498 -10.385 7.168 557 HG3 LYS 68 HG3 LYS 68 -11.846 -11.018 7.158 558 HD2 LYS 68 HD2 LYS 68 -11.058 -8.914 7.408 559 HD3 LYS 68 HD3 LYS 68 -11.715 -8.492 5.822 560 HE2 LYS 68 HE2 LYS 68 -13.906 -7.929 6.854 561 HE3 LYS 68 HE3 LYS 68 -13.299 -8.410 8.444 562 HZ1 LYS 68 HZ1 LYS 68 -13.240 -5.979 7.883 563 HZ2 LYS 68 HZ2 LYS 68 -11.848 -6.599 8.471 564 HZ3 LYS 68 HZ3 LYS 68 -11.995 -6.292 6.874 565 H THR 69 H THR 69 -9.065 -10.759 5.725 566 HA THR 69 HA THR 69 -9.268 -13.492 6.892 567 HB THR 69 HB THR 69 -6.678 -12.399 5.702 568 HG1 THR 69 HG1 THR 69 -8.103 -14.239 4.071 569 HG21 THR 69 HG21 THR 69 -6.154 -14.815 5.482 570 HG22 THR 69 HG22 THR 69 -6.618 -14.385 7.163 571 HG23 THR 69 HG23 THR 69 -7.794 -15.219 6.093 572 H SER 70 H SER 70 -9.815 -12.194 8.793 573 HA SER 70 HA SER 70 -8.115 -10.100 9.720 574 HB2 SER 70 HB2 SER 70 -10.127 -11.784 11.301 575 HB3 SER 70 HB3 SER 70 -9.562 -10.151 11.677 576 HG SER 70 HG SER 70 -11.656 -10.146 10.640 577 H ASP 71 H ASP 71 -6.136 -11.736 9.222 578 HA ASP 71 HA ASP 71 -5.554 -13.740 11.103 579 HB2 ASP 71 HB2 ASP 71 -4.449 -13.146 8.819 580 HB3 ASP 71 HB3 ASP 71 -3.546 -11.911 9.706 581 H ASP 72 H ASP 72 -4.142 -10.369 10.876 582 HA ASP 72 HA ASP 72 -3.693 -10.466 13.792 583 HB2 ASP 72 HB2 ASP 72 -2.150 -9.636 11.463 584 HB3 ASP 72 HB3 ASP 72 -2.485 -8.204 12.445 585 H GLY 73 H GLY 73 -6.241 -10.068 13.260 586 HA2 GLY 73 HA2 GLY 73 -7.905 -8.920 14.047 587 HA3 GLY 73 HA3 GLY 73 -6.909 -7.460 14.129 588 H GLU 74 H GLU 74 -6.330 -6.706 11.412 589 HA GLU 74 HA GLU 74 -8.901 -7.210 9.994 590 HB2 GLU 74 HB2 GLU 74 -7.591 -4.481 10.383 591 HB3 GLU 74 HB3 GLU 74 -8.849 -4.828 9.188 592 HG2 GLU 74 HG2 GLU 74 -9.376 -5.512 12.079 593 HG3 GLU 74 HG3 GLU 74 -9.412 -3.813 11.589 594 H VAL 75 H VAL 75 -6.823 -8.786 9.417 595 HA VAL 75 HA VAL 75 -5.121 -7.469 7.430 596 HB VAL 75 HB VAL 75 -5.145 -10.227 8.745 597 HG11 VAL 75 HG11 VAL 75 -3.092 -10.758 7.471 598 HG12 VAL 75 HG12 VAL 75 -4.519 -10.547 6.402 599 HG13 VAL 75 HG13 VAL 75 -3.292 -9.242 6.530 600 HG21 VAL 75 HG21 VAL 75 -2.906 -9.508 9.565 601 HG22 VAL 75 HG22 VAL 75 -3.120 -7.933 8.730 602 HG23 VAL 75 HG23 VAL 75 -4.206 -8.385 10.087 603 H TYR 76 H TYR 76 -4.863 -8.654 5.259 604 HA TYR 76 HA TYR 76 -7.295 -10.115 4.499 605 HB2 TYR 76 HB2 TYR 76 -6.112 -7.675 3.101 606 HB3 TYR 76 HB3 TYR 76 -7.271 -8.777 2.346 607 HD1 TYR 76 HD1 TYR 76 -9.585 -9.011 3.318 608 HD2 TYR 76 HD2 TYR 76 -6.827 -6.036 4.730 609 HE1 TYR 76 HE1 TYR 76 -11.451 -7.792 4.390 610 HE2 TYR 76 HE2 TYR 76 -8.695 -4.809 5.794 611 HH TYR 76 HH TYR 76 -10.871 -4.741 6.206 612 H TYR 77 H TYR 77 -7.042 -11.638 2.812 613 HA TYR 77 HA TYR 77 -4.252 -12.045 1.973 614 HB2 TYR 77 HB2 TYR 77 -6.261 -13.973 3.205 615 HB3 TYR 77 HB3 TYR 77 -5.047 -14.577 2.070 616 HD1 TYR 77 HD1 TYR 77 -5.193 -12.368 5.144 617 HD2 TYR 77 HD2 TYR 77 -3.081 -15.408 2.964 618 HE1 TYR 77 HE1 TYR 77 -3.547 -12.546 6.987 619 HE2 TYR 77 HE2 TYR 77 -1.437 -15.589 4.805 620 HH TYR 77 HH TYR 77 -1.917 -13.945 7.886 621 H SER 78 H SER 78 -4.021 -12.279 -0.262 622 HA SER 78 HA SER 78 -6.548 -12.827 -1.741 623 HB2 SER 78 HB2 SER 78 -5.316 -11.754 -3.653 624 HB3 SER 78 HB3 SER 78 -5.628 -10.651 -2.306 625 HG SER 78 HG SER 78 -3.412 -11.029 -1.584 626 H GLU 79 H GLU 79 -6.388 -15.153 -1.472 627 HA GLU 79 HA GLU 79 -4.058 -16.638 -1.923 628 HB2 GLU 79 HB2 GLU 79 -6.367 -17.311 -0.917 629 HB3 GLU 79 HB3 GLU 79 -6.939 -17.460 -2.584 630 HG2 GLU 79 HG2 GLU 79 -4.563 -19.016 -1.467 631 HG3 GLU 79 HG3 GLU 79 -6.225 -19.622 -1.461 632 H GLU 80 H GLU 80 -6.688 -15.577 -4.214 633 HA GLU 80 HA GLU 80 -5.719 -17.006 -6.426 634 HB2 GLU 80 HB2 GLU 80 -7.248 -14.358 -6.406 635 HB3 GLU 80 HB3 GLU 80 -7.191 -15.546 -7.714 636 HG2 GLU 80 HG2 GLU 80 -8.341 -17.211 -6.260 637 HG3 GLU 80 HG3 GLU 80 -8.386 -16.034 -4.941 638 H ALA 81 H ALA 81 -4.552 -13.981 -4.921 639 HA ALA 81 HA ALA 81 -2.894 -13.552 -7.306 640 HB1 ALA 81 HB1 ALA 81 -2.544 -11.270 -6.323 641 HB2 ALA 81 HB2 ALA 81 -4.281 -11.627 -6.608 642 HB3 ALA 81 HB3 ALA 81 -3.606 -11.723 -4.947 643 H LYS 82 H LYS 82 -2.705 -14.783 -4.041 644 HA LYS 82 HA LYS 82 -0.976 -15.563 -2.867 645 HB2 LYS 82 HB2 LYS 82 0.721 -14.841 -5.303 646 HB3 LYS 82 HB3 LYS 82 1.237 -15.838 -3.936 647 HG2 LYS 82 HG2 LYS 82 -1.053 -16.531 -5.841 648 HG3 LYS 82 HG3 LYS 82 0.593 -17.170 -5.954 649 HD2 LYS 82 HD2 LYS 82 0.381 -18.198 -3.707 650 HD3 LYS 82 HD3 LYS 82 -1.230 -17.496 -3.512 651 HE2 LYS 82 HE2 LYS 82 -0.524 -19.349 -5.836 652 HE3 LYS 82 HE3 LYS 82 -1.099 -19.962 -4.280 653 HZ1 LYS 82 HZ1 LYS 82 -3.136 -19.526 -4.948 654 HZ2 LYS 82 HZ2 LYS 82 -2.815 -17.933 -5.101 655 HZ3 LYS 82 HZ3 LYS 82 -2.603 -18.934 -6.373 656 H LYS 83 H LYS 83 -1.865 -13.015 -2.242 657 HA LYS 83 HA LYS 83 0.621 -11.748 -1.365 658 HB2 LYS 83 HB2 LYS 83 -1.667 -10.121 -2.563 659 HB3 LYS 83 HB3 LYS 83 -0.031 -9.581 -2.163 660 HG2 LYS 83 HG2 LYS 83 0.924 -10.732 -4.049 661 HG3 LYS 83 HG3 LYS 83 -0.554 -11.662 -4.331 662 HD2 LYS 83 HD2 LYS 83 -1.756 -9.443 -4.772 663 HD3 LYS 83 HD3 LYS 83 -0.178 -8.647 -4.700 664 HE2 LYS 83 HE2 LYS 83 0.633 -10.199 -6.534 665 HE3 LYS 83 HE3 LYS 83 -1.002 -10.864 -6.647 666 HZ1 LYS 83 HZ1 LYS 83 -0.476 -9.055 -8.239 667 HZ2 LYS 83 HZ2 LYS 83 -1.812 -8.771 -7.345 668 HZ3 LYS 83 HZ3 LYS 83 -0.418 -7.995 -6.999 669 H LYS 84 H LYS 84 0.453 -10.937 0.740 670 HA LYS 84 HA LYS 84 -2.278 -10.852 1.851 671 HB2 LYS 84 HB2 LYS 84 -1.400 -11.673 3.964 672 HB3 LYS 84 HB3 LYS 84 -1.068 -12.836 2.674 673 HG2 LYS 84 HG2 LYS 84 1.136 -12.786 3.114 674 HG3 LYS 84 HG3 LYS 84 1.192 -11.031 2.905 675 HD2 LYS 84 HD2 LYS 84 1.913 -11.401 5.146 676 HD3 LYS 84 HD3 LYS 84 0.244 -10.836 5.296 677 HE2 LYS 84 HE2 LYS 84 -0.022 -12.662 6.630 678 HE3 LYS 84 HE3 LYS 84 -0.188 -13.539 5.103 679 HZ1 LYS 84 HZ1 LYS 84 1.412 -14.574 6.547 680 HZ2 LYS 84 HZ2 LYS 84 2.170 -14.031 5.207 681 HZ3 LYS 84 HZ3 LYS 84 2.324 -13.222 6.617 682 H VAL 85 H VAL 85 -2.748 -9.112 3.322 683 HA VAL 85 HA VAL 85 -0.532 -7.191 3.680 684 HB VAL 85 HB VAL 85 -2.256 -5.356 3.342 685 HG11 VAL 85 HG11 VAL 85 -2.186 -5.439 0.857 686 HG12 VAL 85 HG12 VAL 85 -0.614 -5.902 1.593 687 HG13 VAL 85 HG13 VAL 85 -1.708 -7.168 0.940 688 HG21 VAL 85 HG21 VAL 85 -4.295 -5.855 2.035 689 HG22 VAL 85 HG22 VAL 85 -3.941 -7.611 2.166 690 HG23 VAL 85 HG23 VAL 85 -4.305 -6.656 3.643 691 H GLU 86 H GLU 86 -0.440 -6.353 5.766 692 HA GLU 86 HA GLU 86 -2.750 -6.882 7.525 693 HB2 GLU 86 HB2 GLU 86 -0.984 -7.318 9.325 694 HB3 GLU 86 HB3 GLU 86 -1.204 -8.593 8.120 695 HG2 GLU 86 HG2 GLU 86 0.804 -7.715 6.879 696 HG3 GLU 86 HG3 GLU 86 1.042 -6.521 8.162 697 H VAL 87 H VAL 87 -3.543 -4.988 8.290 698 HA VAL 87 HA VAL 87 -2.084 -2.559 8.018 699 HB VAL 87 HB VAL 87 -4.499 -2.553 7.925 700 HG11 VAL 87 HG11 VAL 87 -5.930 -3.097 9.877 701 HG12 VAL 87 HG12 VAL 87 -4.997 -4.518 9.297 702 HG13 VAL 87 HG13 VAL 87 -4.475 -3.645 10.777 703 HG21 VAL 87 HG21 VAL 87 -5.047 -0.834 9.628 704 HG22 VAL 87 HG22 VAL 87 -3.534 -1.239 10.507 705 HG23 VAL 87 HG23 VAL 87 -3.453 -0.543 8.853 706 H LEU 88 H LEU 88 -0.215 -2.284 9.244 707 HA LEU 88 HA LEU 88 0.102 -3.561 11.783 708 HB2 LEU 88 HB2 LEU 88 1.696 -1.363 10.357 709 HB3 LEU 88 HB3 LEU 88 2.223 -2.203 11.822 710 HG LEU 88 HG LEU 88 1.776 -3.485 9.094 711 HD11 LEU 88 HD11 LEU 88 4.234 -3.744 9.074 712 HD12 LEU 88 HD12 LEU 88 3.738 -2.018 9.130 713 HD13 LEU 88 HD13 LEU 88 4.337 -2.829 10.617 714 HD21 LEU 88 HD21 LEU 88 2.831 -5.481 10.111 715 HD22 LEU 88 HD22 LEU 88 2.864 -4.646 11.700 716 HD23 LEU 88 HD23 LEU 88 1.293 -5.044 10.927 717 H ASP 89 H ASP 89 -0.201 -0.037 10.725 718 HA ASP 89 HA ASP 89 -1.674 0.473 13.158 719 HB2 ASP 89 HB2 ASP 89 0.604 0.728 14.003 720 HB3 ASP 89 HB3 ASP 89 1.056 1.741 12.625 721 H THR 90 H THR 90 -2.914 2.420 13.050 722 HA THR 90 HA THR 90 -2.554 4.185 10.802 723 HB THR 90 HB THR 90 -3.831 2.215 9.896 724 HG1 THR 90 HG1 THR 90 -4.844 3.597 8.601 725 HG21 THR 90 HG21 THR 90 -6.227 2.017 10.520 726 HG22 THR 90 HG22 THR 90 -5.137 1.653 11.900 727 HG23 THR 90 HG23 THR 90 -5.980 3.237 11.815 728 H ASP 91 H ASP 91 -3.541 6.240 11.163 729 HA ASP 91 HA ASP 91 -4.718 6.500 13.851 730 HB2 ASP 91 HB2 ASP 91 -2.599 7.781 13.231 731 HB3 ASP 91 HB3 ASP 91 -3.558 8.667 12.038 732 H TYR 92 H TYR 92 -6.724 7.633 14.115 733 HA TYR 92 HA TYR 92 -8.535 7.362 11.977 734 HB2 TYR 92 HB2 TYR 92 -8.701 8.929 14.601 735 HB3 TYR 92 HB3 TYR 92 -10.068 8.650 13.515 736 HD1 TYR 92 HD1 TYR 92 -10.470 6.056 12.903 737 HD2 TYR 92 HD2 TYR 92 -8.413 7.478 16.393 738 HE1 TYR 92 HE1 TYR 92 -10.956 3.921 14.057 739 HE2 TYR 92 HE2 TYR 92 -8.904 5.347 17.554 740 HH TYR 92 HH TYR 92 -10.750 2.732 15.909 741 H LYS 93 H LYS 93 -6.606 10.153 13.235 742 HA LYS 93 HA LYS 93 -7.658 11.734 10.981 743 HB2 LYS 93 HB2 LYS 93 -6.727 12.805 13.677 744 HB3 LYS 93 HB3 LYS 93 -7.499 13.705 12.365 745 HG2 LYS 93 HG2 LYS 93 -9.622 12.552 12.731 746 HG3 LYS 93 HG3 LYS 93 -8.879 11.447 13.895 747 HD2 LYS 93 HD2 LYS 93 -8.235 13.548 15.266 748 HD3 LYS 93 HD3 LYS 93 -9.303 14.459 14.191 749 HE2 LYS 93 HE2 LYS 93 -10.205 11.991 15.756 750 HE3 LYS 93 HE3 LYS 93 -10.347 13.639 16.381 751 HZ1 LYS 93 HZ1 LYS 93 -12.364 12.921 15.316 752 HZ2 LYS 93 HZ2 LYS 93 -11.728 14.170 14.477 753 HZ3 LYS 93 HZ3 LYS 93 -11.598 12.648 13.900 754 H SER 94 H SER 94 -5.212 9.890 11.103 755 HA SER 94 HA SER 94 -3.374 12.001 10.218 756 HB2 SER 94 HB2 SER 94 -2.903 11.474 12.687 757 HB3 SER 94 HB3 SER 94 -2.711 9.767 12.264 758 HG SER 94 HG SER 94 -0.668 10.882 12.396 759 H TYR 95 H TYR 95 -1.175 9.924 10.123 760 HA TYR 95 HA TYR 95 -1.980 8.775 7.565 761 HB2 TYR 95 HB2 TYR 95 0.486 8.215 7.453 762 HB3 TYR 95 HB3 TYR 95 0.132 9.944 7.565 763 HD1 TYR 95 HD1 TYR 95 1.294 6.972 9.511 764 HD2 TYR 95 HD2 TYR 95 0.854 11.245 9.449 765 HE1 TYR 95 HE1 TYR 95 2.716 7.148 11.530 766 HE2 TYR 95 HE2 TYR 95 2.281 11.423 11.461 767 HH TYR 95 HH TYR 95 2.802 9.254 13.542 768 H ALA 96 H ALA 96 -0.610 6.482 7.282 769 HA ALA 96 HA ALA 96 -0.833 4.851 9.656 770 HB1 ALA 96 HB1 ALA 96 -2.361 3.247 8.599 771 HB2 ALA 96 HB2 ALA 96 -3.124 4.848 8.886 772 HB3 ALA 96 HB3 ALA 96 -2.593 4.389 7.233 773 H VAL 97 H VAL 97 0.035 2.638 9.385 774 HA VAL 97 HA VAL 97 1.754 2.451 7.005 775 HB VAL 97 HB VAL 97 3.431 1.293 8.468 776 HG11 VAL 97 HG11 VAL 97 4.365 3.386 9.410 777 HG12 VAL 97 HG12 VAL 97 3.735 3.620 7.744 778 HG13 VAL 97 HG13 VAL 97 2.784 4.198 9.154 779 HG21 VAL 97 HG21 VAL 97 3.358 1.709 10.905 780 HG22 VAL 97 HG22 VAL 97 1.731 2.448 10.725 781 HG23 VAL 97 HG23 VAL 97 1.974 0.709 10.351 782 H ILE 98 H ILE 98 1.327 0.546 5.868 783 HA ILE 98 HA ILE 98 0.027 -1.596 7.405 784 HB ILE 98 HB ILE 98 -0.232 -1.051 4.406 785 HG12 ILE 98 HG12 ILE 98 -1.198 0.846 5.577 786 HG13 ILE 98 HG13 ILE 98 -2.489 -0.158 4.903 787 HG21 ILE 98 HG21 ILE 98 -2.174 -2.577 4.580 788 HG22 ILE 98 HG22 ILE 98 -0.644 -3.375 5.076 789 HG23 ILE 98 HG23 ILE 98 -1.815 -2.826 6.322 790 HD11 ILE 98 HD11 ILE 98 -3.062 0.620 7.159 791 HD12 ILE 98 HD12 ILE 98 -2.888 -1.167 7.132 792 HD13 ILE 98 HD13 ILE 98 -1.578 -0.148 7.817 793 H TYR 99 H TYR 99 0.780 -3.748 7.093 794 HA TYR 99 HA TYR 99 3.409 -3.912 5.775 795 HB2 TYR 99 HB2 TYR 99 3.086 -4.599 8.196 796 HB3 TYR 99 HB3 TYR 99 1.934 -5.829 7.659 797 HD1 TYR 99 HD1 TYR 99 2.709 -7.841 6.445 798 HD2 TYR 99 HD2 TYR 99 5.490 -4.873 7.827 799 HE1 TYR 99 HE1 TYR 99 4.572 -9.440 6.126 800 HE2 TYR 99 HE2 TYR 99 7.351 -6.470 7.516 801 HH TYR 99 HH TYR 99 7.125 -9.243 5.684 802 H ALA 100 H ALA 100 3.697 -5.248 3.960 803 HA ALA 100 HA ALA 100 1.473 -7.010 3.240 804 HB1 ALA 100 HB1 ALA 100 1.640 -6.235 0.894 805 HB2 ALA 100 HB2 ALA 100 1.109 -4.929 2.007 806 HB3 ALA 100 HB3 ALA 100 2.803 -4.967 1.409 807 H THR 101 H THR 101 2.042 -8.863 2.038 808 HA THR 101 HA THR 101 4.806 -9.156 1.235 809 HB THR 101 HB THR 101 4.321 -9.835 3.778 810 HG1 THR 101 HG1 THR 101 6.006 -11.031 1.763 811 HG21 THR 101 HG21 THR 101 4.033 -12.288 3.944 812 HG22 THR 101 HG22 THR 101 2.584 -11.477 3.261 813 HG23 THR 101 HG23 THR 101 3.713 -12.359 2.178 814 H ARG 102 H ARG 102 5.110 -10.750 -0.381 815 HA ARG 102 HA ARG 102 2.654 -12.180 -1.224 816 HB2 ARG 102 HB2 ARG 102 2.996 -11.550 -3.447 817 HB3 ARG 102 HB3 ARG 102 3.371 -10.054 -2.581 818 HG2 ARG 102 HG2 ARG 102 5.852 -10.816 -2.661 819 HG3 ARG 102 HG3 ARG 102 5.325 -12.039 -3.826 820 HD2 ARG 102 HD2 ARG 102 5.160 -9.004 -4.094 821 HD3 ARG 102 HD3 ARG 102 6.100 -10.131 -5.082 822 HE ARG 102 HE ARG 102 3.109 -10.009 -5.108 823 HH11 ARG 102 HH11 ARG 102 6.184 -10.050 -6.806 824 HH12 ARG 102 HH12 ARG 102 5.485 -10.503 -8.324 825 HH21 ARG 102 HH21 ARG 102 2.232 -10.792 -7.096 826 HH22 ARG 102 HH22 ARG 102 3.254 -10.922 -8.488 827 H VAL 103 H VAL 103 3.079 -14.424 -1.616 828 HA VAL 103 HA VAL 103 5.941 -15.113 -1.576 829 HB VAL 103 HB VAL 103 4.710 -15.936 0.395 830 HG11 VAL 103 HG11 VAL 103 2.943 -17.647 0.164 831 HG12 VAL 103 HG12 VAL 103 2.459 -16.070 -0.546 832 HG13 VAL 103 HG13 VAL 103 2.965 -17.420 -1.617 833 HG21 VAL 103 HG21 VAL 103 5.300 -18.331 0.201 834 HG22 VAL 103 HG22 VAL 103 5.460 -18.139 -1.578 835 HG23 VAL 103 HG23 VAL 103 6.574 -17.262 -0.476 836 H LYS 104 H LYS 104 6.722 -15.958 -3.386 837 HA LYS 104 HA LYS 104 4.971 -16.823 -5.508 838 HB2 LYS 104 HB2 LYS 104 7.633 -15.596 -5.357 839 HB3 LYS 104 HB3 LYS 104 7.492 -16.908 -6.534 840 HG2 LYS 104 HG2 LYS 104 5.421 -14.695 -6.461 841 HG3 LYS 104 HG3 LYS 104 6.983 -14.434 -7.247 842 HD2 LYS 104 HD2 LYS 104 5.613 -15.205 -9.008 843 HD3 LYS 104 HD3 LYS 104 6.513 -16.652 -8.534 844 HE2 LYS 104 HE2 LYS 104 4.566 -17.326 -7.062 845 HE3 LYS 104 HE3 LYS 104 3.666 -15.928 -7.665 846 HZ1 LYS 104 HZ1 LYS 104 3.125 -17.887 -8.903 847 HZ2 LYS 104 HZ2 LYS 104 3.900 -16.848 -9.895 848 HZ3 LYS 104 HZ3 LYS 104 4.683 -18.155 -9.309 849 H ASP 105 H ASP 105 6.027 -18.718 -6.907 850 HA ASP 105 HA ASP 105 5.967 -21.032 -5.426 851 HB2 ASP 105 HB2 ASP 105 7.666 -20.736 -7.946 852 HB3 ASP 105 HB3 ASP 105 6.717 -22.132 -7.420 853 H GLY 106 H GLY 106 7.250 -21.074 -3.487 854 HA2 GLY 106 HA2 GLY 106 9.178 -21.918 -2.566 855 HA3 GLY 106 HA3 GLY 106 10.003 -21.751 -4.121 856 H ARG 107 H ARG 107 8.427 -18.750 -3.308 857 HA ARG 107 HA ARG 107 10.824 -17.779 -1.927 858 HB2 ARG 107 HB2 ARG 107 11.364 -17.492 -4.292 859 HB3 ARG 107 HB3 ARG 107 9.752 -16.854 -4.643 860 HG2 ARG 107 HG2 ARG 107 10.213 -14.761 -3.671 861 HG3 ARG 107 HG3 ARG 107 11.531 -15.391 -2.674 862 HD2 ARG 107 HD2 ARG 107 11.687 -15.378 -5.724 863 HD3 ARG 107 HD3 ARG 107 12.155 -13.969 -4.763 864 HE ARG 107 HE ARG 107 13.732 -15.654 -3.569 865 HH11 ARG 107 HH11 ARG 107 12.866 -15.798 -6.979 866 HH12 ARG 107 HH12 ARG 107 14.314 -16.633 -7.432 867 HH21 ARG 107 HH21 ARG 107 15.614 -16.751 -4.180 868 HH22 ARG 107 HH22 ARG 107 15.877 -17.175 -5.838 869 H THR 108 H THR 108 10.422 -16.100 -0.497 870 HA THR 108 HA THR 108 7.659 -15.102 -0.478 871 HB THR 108 HB THR 108 9.377 -14.855 1.945 872 HG1 THR 108 HG1 THR 108 8.915 -17.121 2.477 873 HG21 THR 108 HG21 THR 108 7.257 -15.475 3.048 874 HG22 THR 108 HG22 THR 108 7.036 -14.105 1.908 875 HG23 THR 108 HG23 THR 108 6.504 -15.755 1.442 876 H LEU 109 H LEU 109 7.318 -12.897 -0.841 877 HA LEU 109 HA LEU 109 9.733 -11.211 -0.568 878 HB2 LEU 109 HB2 LEU 109 8.990 -11.483 -2.894 879 HB3 LEU 109 HB3 LEU 109 7.354 -10.978 -2.453 880 HG LEU 109 HG LEU 109 8.141 -8.729 -1.905 881 HD11 LEU 109 HD11 LEU 109 10.474 -8.052 -2.359 882 HD12 LEU 109 HD12 LEU 109 10.373 -9.288 -1.060 883 HD13 LEU 109 HD13 LEU 109 10.897 -9.761 -2.712 884 HD21 LEU 109 HD21 LEU 109 8.810 -8.007 -4.173 885 HD22 LEU 109 HD22 LEU 109 9.155 -9.714 -4.610 886 HD23 LEU 109 HD23 LEU 109 7.477 -9.209 -4.216 887 H HIS 110 H HIS 110 9.535 -9.324 0.673 888 HA HIS 110 HA HIS 110 6.895 -8.976 1.976 889 HB2 HIS 110 HB2 HIS 110 9.711 -8.295 2.999 890 HB3 HIS 110 HB3 HIS 110 8.199 -7.999 3.868 891 HD2 HIS 110 HD2 HIS 110 10.118 -11.231 2.519 892 HE1 HIS 110 HE1 HIS 110 8.032 -12.185 6.126 893 H MET 111 H MET 111 6.150 -6.736 2.086 894 HA MET 111 HA MET 111 7.908 -4.600 1.111 895 HB2 MET 111 HB2 MET 111 6.992 -5.647 -0.956 896 HB3 MET 111 HB3 MET 111 5.352 -5.510 -0.309 897 HG2 MET 111 HG2 MET 111 5.541 -3.042 -0.321 898 HG3 MET 111 HG3 MET 111 7.195 -3.163 -0.934 899 HE1 MET 111 HE1 MET 111 7.295 -3.437 -4.289 900 HE2 MET 111 HE2 MET 111 7.913 -4.230 -2.801 901 HE3 MET 111 HE3 MET 111 6.927 -5.166 -3.973 902 H MET 112 H MET 112 7.620 -3.113 2.709 903 HA MET 112 HA MET 112 5.031 -3.104 4.134 904 HB2 MET 112 HB2 MET 112 7.397 -3.100 5.259 905 HB3 MET 112 HB3 MET 112 7.543 -1.435 4.682 906 HG2 MET 112 HG2 MET 112 5.818 -0.649 6.089 907 HG3 MET 112 HG3 MET 112 5.112 -2.257 6.300 908 HE1 MET 112 HE1 MET 112 9.252 -1.159 8.039 909 HE2 MET 112 HE2 MET 112 8.625 -0.796 6.395 910 HE3 MET 112 HE3 MET 112 8.105 0.202 7.795 911 H ARG 113 H ARG 113 3.825 -1.043 4.261 912 HA ARG 113 HA ARG 113 4.701 1.023 2.388 913 HB2 ARG 113 HB2 ARG 113 2.678 -0.926 1.817 914 HB3 ARG 113 HB3 ARG 113 1.815 0.567 2.210 915 HG2 ARG 113 HG2 ARG 113 2.173 1.239 0.094 916 HG3 ARG 113 HG3 ARG 113 3.885 1.415 0.497 917 HD2 ARG 113 HD2 ARG 113 3.727 -0.002 -1.461 918 HD3 ARG 113 HD3 ARG 113 4.244 -1.009 -0.102 919 HE ARG 113 HE ARG 113 1.419 -0.937 -1.107 920 HH11 ARG 113 HH11 ARG 113 4.183 -2.644 0.206 921 HH12 ARG 113 HH12 ARG 113 3.396 -4.187 0.206 922 HH21 ARG 113 HH21 ARG 113 0.355 -2.960 -1.043 923 HH22 ARG 113 HH22 ARG 113 1.208 -4.369 -0.507 924 H LEU 114 H LEU 114 3.875 3.118 2.809 925 HA LEU 114 HA LEU 114 2.319 3.366 5.313 926 HB2 LEU 114 HB2 LEU 114 4.749 3.822 5.663 927 HB3 LEU 114 HB3 LEU 114 4.657 5.062 4.439 928 HG LEU 114 HG LEU 114 2.966 5.140 6.937 929 HD11 LEU 114 HD11 LEU 114 4.626 6.744 7.839 930 HD12 LEU 114 HD12 LEU 114 5.337 5.115 7.581 931 HD13 LEU 114 HD13 LEU 114 5.682 6.440 6.418 932 HD21 LEU 114 HD21 LEU 114 2.800 7.553 6.412 933 HD22 LEU 114 HD22 LEU 114 3.775 7.290 4.927 934 HD23 LEU 114 HD23 LEU 114 2.157 6.528 5.085 935 H TYR 115 H TYR 115 0.546 4.764 5.099 936 HA TYR 115 HA TYR 115 0.539 6.393 2.649 937 HB2 TYR 115 HB2 TYR 115 -1.720 5.883 2.218 938 HB3 TYR 115 HB3 TYR 115 -0.898 4.338 2.473 939 HD1 TYR 115 HD1 TYR 115 -3.328 6.749 3.891 940 HD2 TYR 115 HD2 TYR 115 -1.466 2.907 4.368 941 HE1 TYR 115 HE1 TYR 115 -5.047 6.127 5.560 942 HE2 TYR 115 HE2 TYR 115 -3.178 2.283 6.044 943 HH TYR 115 HH TYR 115 -5.321 2.834 6.794 944 H SER 116 H SER 116 -0.692 8.376 2.714 945 HA SER 116 HA SER 116 -0.945 9.381 5.486 946 HB2 SER 116 HB2 SER 116 -0.262 10.840 2.860 947 HB3 SER 116 HB3 SER 116 -0.508 11.632 4.422 948 HG SER 116 HG SER 116 1.712 11.330 4.136 949 H ARG 117 H ARG 117 -2.805 10.965 5.734 950 HA ARG 117 HA ARG 117 -5.123 9.982 4.505 951 HB2 ARG 117 HB2 ARG 117 -4.435 12.318 6.295 952 HB3 ARG 117 HB3 ARG 117 -6.006 12.327 5.483 953 HG2 ARG 117 HG2 ARG 117 -6.347 9.946 6.428 954 HG3 ARG 117 HG3 ARG 117 -4.926 10.251 7.437 955 HD2 ARG 117 HD2 ARG 117 -6.902 10.800 8.731 956 HD3 ARG 117 HD3 ARG 117 -6.053 12.306 8.358 957 HE ARG 117 HE ARG 117 -7.745 12.731 6.606 958 HH11 ARG 117 HH11 ARG 117 -8.514 10.262 9.000 959 HH12 ARG 117 HH12 ARG 117 -10.223 10.383 8.745 960 HH21 ARG 117 HH21 ARG 117 -9.988 12.877 6.297 961 HH22 ARG 117 HH22 ARG 117 -11.060 11.868 7.210 962 H SER 118 H SER 118 -2.755 12.326 3.336 963 HA SER 118 HA SER 118 -4.535 12.877 1.052 964 HB2 SER 118 HB2 SER 118 -2.810 15.023 2.353 965 HB3 SER 118 HB3 SER 118 -4.056 15.211 1.112 966 HG SER 118 HG SER 118 -4.813 15.838 3.231 967 HA PRO 119 HA PRO 119 -0.700 12.057 -1.087 968 HB2 PRO 119 HB2 PRO 119 -0.643 13.973 -3.118 969 HB3 PRO 119 HB3 PRO 119 -1.834 12.666 -3.147 970 HG2 PRO 119 HG2 PRO 119 -2.161 15.527 -2.199 971 HG3 PRO 119 HG3 PRO 119 -3.254 14.552 -3.190 972 HD2 PRO 119 HD2 PRO 119 -3.676 14.912 -0.510 973 HD3 PRO 119 HD3 PRO 119 -4.151 13.420 -1.333 974 H GLU 120 H GLU 120 0.196 13.032 1.178 975 HA GLU 120 HA GLU 120 2.517 14.480 0.317 976 HB2 GLU 120 HB2 GLU 120 2.254 16.382 1.837 977 HB3 GLU 120 HB3 GLU 120 1.068 16.392 0.526 978 HG2 GLU 120 HG2 GLU 120 -0.593 15.344 2.169 979 HG3 GLU 120 HG3 GLU 120 0.596 15.647 3.443 980 H VAL 121 H VAL 121 4.253 13.728 1.446 981 HA VAL 121 HA VAL 121 3.726 11.785 3.481 982 HB VAL 121 HB VAL 121 6.304 13.263 2.562 983 HG11 VAL 121 HG11 VAL 121 7.582 11.385 3.583 984 HG12 VAL 121 HG12 VAL 121 6.620 12.291 4.800 985 HG13 VAL 121 HG13 VAL 121 6.047 10.696 4.208 986 HG21 VAL 121 HG21 VAL 121 6.829 11.298 1.217 987 HG22 VAL 121 HG22 VAL 121 5.347 10.506 1.779 988 HG23 VAL 121 HG23 VAL 121 5.219 11.953 0.764 989 H SER 122 H SER 122 3.912 12.065 5.693 990 HA SER 122 HA SER 122 4.300 14.789 6.697 991 HB2 SER 122 HB2 SER 122 3.191 13.686 8.774 992 HB3 SER 122 HB3 SER 122 2.174 13.977 7.356 993 HG SER 122 HG SER 122 2.276 11.721 8.511 994 HA PRO 123 HA PRO 123 8.221 13.791 8.502 995 HB2 PRO 123 HB2 PRO 123 7.919 15.400 10.830 996 HB3 PRO 123 HB3 PRO 123 8.483 16.029 9.277 997 HG2 PRO 123 HG2 PRO 123 5.719 16.125 10.487 998 HG3 PRO 123 HG3 PRO 123 6.571 17.355 9.544 999 HD2 PRO 123 HD2 PRO 123 4.633 15.851 8.404 1000 HD3 PRO 123 HD3 PRO 123 6.065 16.314 7.475 1001 H ALA 124 H ALA 124 5.293 13.795 10.665 1002 HA ALA 124 HA ALA 124 6.438 12.228 12.680 1003 HB1 ALA 124 HB1 ALA 124 4.089 11.744 13.290 1004 HB2 ALA 124 HB2 ALA 124 4.346 13.488 12.943 1005 HB3 ALA 124 HB3 ALA 124 3.544 12.438 11.726 1006 H ALA 125 H ALA 125 4.584 11.276 9.673 1007 HA ALA 125 HA ALA 125 4.561 8.514 10.255 1008 HB1 ALA 125 HB1 ALA 125 4.054 8.282 7.852 1009 HB2 ALA 125 HB2 ALA 125 3.075 9.581 8.614 1010 HB3 ALA 125 HB3 ALA 125 4.491 10.005 7.593 1011 H THR 126 H THR 126 6.892 10.699 8.571 1012 HA THR 126 HA THR 126 8.534 8.743 7.464 1013 HB THR 126 HB THR 126 9.282 11.495 8.578 1014 HG1 THR 126 HG1 THR 126 7.583 11.700 7.046 1015 HG21 THR 126 HG21 THR 126 11.083 11.414 6.878 1016 HG22 THR 126 HG22 THR 126 11.234 10.078 8.069 1017 HG23 THR 126 HG23 THR 126 10.579 9.750 6.429 1018 H ALA 127 H ALA 127 8.702 10.440 10.710 1019 HA ALA 127 HA ALA 127 11.015 9.023 11.539 1020 HB1 ALA 127 HB1 ALA 127 10.436 9.942 13.765 1021 HB2 ALA 127 HB2 ALA 127 10.365 11.196 12.481 1022 HB3 ALA 127 HB3 ALA 127 8.848 10.481 13.122 1023 H ILE 128 H ILE 128 7.447 8.451 11.930 1024 HA ILE 128 HA ILE 128 7.712 6.402 13.826 1025 HB ILE 128 HB ILE 128 5.558 7.076 11.781 1026 HG12 ILE 128 HG12 ILE 128 5.871 8.688 13.610 1027 HG13 ILE 128 HG13 ILE 128 4.319 7.852 13.753 1028 HG21 ILE 128 HG21 ILE 128 4.080 5.496 12.980 1029 HG22 ILE 128 HG22 ILE 128 5.462 4.662 12.193 1030 HG23 ILE 128 HG23 ILE 128 5.477 4.946 13.966 1031 HD11 ILE 128 HD11 ILE 128 5.399 8.093 15.944 1032 HD12 ILE 128 HD12 ILE 128 5.267 6.360 15.490 1033 HD13 ILE 128 HD13 ILE 128 6.843 7.209 15.345 1034 H PHE 129 H PHE 129 7.233 6.257 10.192 1035 HA PHE 129 HA PHE 129 7.371 3.480 9.970 1036 HB2 PHE 129 HB2 PHE 129 6.647 5.240 8.250 1037 HB3 PHE 129 HB3 PHE 129 8.362 5.569 7.968 1038 HD1 PHE 129 HD1 PHE 129 5.640 3.110 7.553 1039 HD2 PHE 129 HD2 PHE 129 9.769 3.993 6.773 1040 HE1 PHE 129 HE1 PHE 129 5.714 1.278 5.889 1041 HE2 PHE 129 HE2 PHE 129 9.849 2.158 5.110 1042 HZ PHE 129 HZ PHE 129 7.820 0.798 4.664 1043 H ARG 130 H ARG 130 9.986 5.988 10.114 1044 HA ARG 130 HA ARG 130 12.044 4.207 9.332 1045 HB2 ARG 130 HB2 ARG 130 12.149 6.711 9.199 1046 HB3 ARG 130 HB3 ARG 130 12.175 6.788 10.965 1047 HG2 ARG 130 HG2 ARG 130 14.285 5.301 10.859 1048 HG3 ARG 130 HG3 ARG 130 14.297 5.611 9.118 1049 HD2 ARG 130 HD2 ARG 130 14.296 7.795 11.261 1050 HD3 ARG 130 HD3 ARG 130 15.752 7.176 10.470 1051 HE ARG 130 HE ARG 130 14.076 7.955 8.381 1052 HH11 ARG 130 HH11 ARG 130 15.474 9.518 11.202 1053 HH12 ARG 130 HH12 ARG 130 15.574 11.073 10.445 1054 HH21 ARG 130 HH21 ARG 130 14.232 9.998 7.389 1055 HH22 ARG 130 HH22 ARG 130 14.866 11.345 8.273 1056 H LYS 131 H LYS 131 10.872 5.401 12.597 1057 HA LYS 131 HA LYS 131 12.786 4.152 14.141 1058 HB2 LYS 131 HB2 LYS 131 9.831 4.660 14.701 1059 HB3 LYS 131 HB3 LYS 131 10.999 4.138 15.923 1060 HG2 LYS 131 HG2 LYS 131 12.360 6.208 15.455 1061 HG3 LYS 131 HG3 LYS 131 11.117 6.736 14.314 1062 HD2 LYS 131 HD2 LYS 131 9.423 6.534 16.245 1063 HD3 LYS 131 HD3 LYS 131 10.804 6.299 17.325 1064 HE2 LYS 131 HE2 LYS 131 11.771 8.490 16.450 1065 HE3 LYS 131 HE3 LYS 131 10.273 8.732 15.541 1066 HZ1 LYS 131 HZ1 LYS 131 10.216 9.852 17.655 1067 HZ2 LYS 131 HZ2 LYS 131 9.076 8.683 17.634 1068 HZ3 LYS 131 HZ3 LYS 131 10.458 8.460 18.473 1069 H LEU 132 H LEU 132 9.627 2.782 12.903 1070 HA LEU 132 HA LEU 132 9.930 0.285 14.184 1071 HB2 LEU 132 HB2 LEU 132 8.487 1.037 11.605 1072 HB3 LEU 132 HB3 LEU 132 8.277 -0.473 12.502 1073 HG LEU 132 HG LEU 132 7.611 2.307 13.562 1074 HD11 LEU 132 HD11 LEU 132 5.256 1.596 13.297 1075 HD12 LEU 132 HD12 LEU 132 6.124 1.644 11.726 1076 HD13 LEU 132 HD13 LEU 132 5.809 0.070 12.529 1077 HD21 LEU 132 HD21 LEU 132 6.468 1.080 15.379 1078 HD22 LEU 132 HD22 LEU 132 7.074 -0.471 14.705 1079 HD23 LEU 132 HD23 LEU 132 8.232 0.743 15.345 1080 H ALA 133 H ALA 133 10.802 1.499 10.855 1081 HA ALA 133 HA ALA 133 11.739 -0.882 9.806 1082 HB1 ALA 133 HB1 ALA 133 13.059 0.575 8.300 1083 HB2 ALA 133 HB2 ALA 133 11.379 1.176 8.505 1084 HB3 ALA 133 HB3 ALA 133 12.731 1.976 9.375 1085 H GLY 134 H GLY 134 13.364 1.442 12.087 1086 HA2 GLY 134 HA2 GLY 134 15.951 0.330 11.783 1087 HA3 GLY 134 HA3 GLY 134 15.358 1.332 13.115 1088 H GLU 135 H GLU 135 13.064 -0.554 13.774 1089 HA GLU 135 HA GLU 135 14.457 -2.183 15.620 1090 HB2 GLU 135 HB2 GLU 135 12.314 -1.541 16.286 1091 HB3 GLU 135 HB3 GLU 135 11.601 -1.848 14.697 1092 HG2 GLU 135 HG2 GLU 135 11.445 -4.163 15.053 1093 HG3 GLU 135 HG3 GLU 135 12.711 -4.171 16.288 1094 H ARG 136 H ARG 136 13.433 -2.605 12.233 1095 HA ARG 136 HA ARG 136 13.935 -5.490 12.435 1096 HB2 ARG 136 HB2 ARG 136 12.860 -3.854 10.092 1097 HB3 ARG 136 HB3 ARG 136 12.899 -5.617 10.233 1098 HG2 ARG 136 HG2 ARG 136 11.386 -5.346 12.310 1099 HG3 ARG 136 HG3 ARG 136 11.188 -3.656 11.826 1100 HD2 ARG 136 HD2 ARG 136 9.561 -4.284 10.396 1101 HD3 ARG 136 HD3 ARG 136 10.762 -5.178 9.454 1102 HE ARG 136 HE ARG 136 10.276 -7.087 11.138 1103 HH11 ARG 136 HH11 ARG 136 7.875 -4.712 10.138 1104 HH12 ARG 136 HH12 ARG 136 6.536 -5.776 10.415 1105 HH21 ARG 136 HH21 ARG 136 8.507 -8.460 11.500 1106 HH22 ARG 136 HH22 ARG 136 6.896 -7.906 11.189 1107 H ASN 137 H ASN 137 16.017 -3.082 12.435 1108 HA ASN 137 HA ASN 137 18.005 -2.624 11.549 1109 HB2 ASN 137 HB2 ASN 137 17.833 -5.587 10.825 1110 HB3 ASN 137 HB3 ASN 137 19.296 -4.613 10.632 1111 HD21 ASN 137 HD21 ASN 137 19.050 -3.010 13.025 1112 HD22 ASN 137 HD22 ASN 137 19.326 -4.055 14.378 1113 H TYR 138 H TYR 138 15.852 -1.774 9.903 1114 HA TYR 138 HA TYR 138 16.017 -2.792 7.279 1115 HB2 TYR 138 HB2 TYR 138 14.549 -0.934 6.780 1116 HB3 TYR 138 HB3 TYR 138 14.216 -1.249 8.488 1117 HD1 TYR 138 HD1 TYR 138 16.115 0.131 10.071 1118 HD2 TYR 138 HD2 TYR 138 14.579 1.334 6.245 1119 HE1 TYR 138 HE1 TYR 138 16.631 2.491 10.608 1120 HE2 TYR 138 HE2 TYR 138 15.100 3.695 6.776 1121 HH TYR 138 HH TYR 138 16.147 5.085 8.179 1122 H THR 139 H THR 139 16.823 -1.642 5.337 1123 HA THR 139 HA THR 139 19.333 -0.157 5.930 1124 HB THR 139 HB THR 139 19.306 -1.005 3.251 1125 HG1 THR 139 HG1 THR 139 18.808 -3.319 3.447 1126 HG21 THR 139 HG21 THR 139 21.036 -2.628 3.999 1127 HG22 THR 139 HG22 THR 139 21.233 -1.034 4.803 1128 HG23 THR 139 HG23 THR 139 20.500 -2.407 5.698 1129 H ASP 140 H ASP 140 19.687 1.825 4.668 1130 HA ASP 140 HA ASP 140 17.414 3.378 4.344 1131 HB2 ASP 140 HB2 ASP 140 19.557 4.498 4.444 1132 HB3 ASP 140 HB3 ASP 140 20.289 3.401 3.266 1133 H GLU 141 H GLU 141 19.378 1.894 1.610 1134 HA GLU 141 HA GLU 141 17.575 2.604 -0.393 1135 HB2 GLU 141 HB2 GLU 141 20.031 1.669 -0.431 1136 HB3 GLU 141 HB3 GLU 141 19.248 0.084 -0.474 1137 HG2 GLU 141 HG2 GLU 141 18.341 0.424 -2.600 1138 HG3 GLU 141 HG3 GLU 141 18.369 2.187 -2.456 1139 H MET 142 H MET 142 17.010 0.287 2.148 1140 HA MET 142 HA MET 142 15.387 -1.457 0.515 1141 HB2 MET 142 HB2 MET 142 16.506 -2.372 2.478 1142 HB3 MET 142 HB3 MET 142 15.862 -1.098 3.521 1143 HG2 MET 142 HG2 MET 142 13.524 -2.013 3.023 1144 HG3 MET 142 HG3 MET 142 14.308 -3.379 2.220 1145 HE1 MET 142 HE1 MET 142 15.578 -5.631 4.324 1146 HE2 MET 142 HE2 MET 142 16.307 -4.435 3.200 1147 HE3 MET 142 HE3 MET 142 16.785 -4.447 4.931 1148 H VAL 143 H VAL 143 14.975 1.615 2.180 1149 HA VAL 143 HA VAL 143 12.077 1.316 2.112 1150 HB VAL 143 HB VAL 143 13.764 3.446 3.486 1151 HG11 VAL 143 HG11 VAL 143 11.651 4.023 4.637 1152 HG12 VAL 143 HG12 VAL 143 11.535 4.246 2.859 1153 HG13 VAL 143 HG13 VAL 143 10.782 2.812 3.635 1154 HG21 VAL 143 HG21 VAL 143 13.130 2.302 5.583 1155 HG22 VAL 143 HG22 VAL 143 12.339 1.004 4.627 1156 HG23 VAL 143 HG23 VAL 143 14.114 1.250 4.509 1157 H ALA 144 H ALA 144 10.798 3.101 1.127 1158 HA ALA 144 HA ALA 144 12.378 4.874 -0.606 1159 HB1 ALA 144 HB1 ALA 144 10.720 4.437 -2.414 1160 HB2 ALA 144 HB2 ALA 144 11.616 2.950 -1.954 1161 HB3 ALA 144 HB3 ALA 144 9.934 3.201 -1.375 1162 H MET 145 H MET 145 11.817 6.933 -0.276 1163 HA MET 145 HA MET 145 9.100 7.545 0.576 1164 HB2 MET 145 HB2 MET 145 11.678 8.847 1.424 1165 HB3 MET 145 HB3 MET 145 10.073 9.528 1.719 1166 HG2 MET 145 HG2 MET 145 9.470 7.414 2.967 1167 HG3 MET 145 HG3 MET 145 11.139 6.867 2.765 1168 HE1 MET 145 HE1 MET 145 10.196 10.941 4.668 1169 HE2 MET 145 HE2 MET 145 9.395 10.158 3.263 1170 HE3 MET 145 HE3 MET 145 8.910 9.715 4.935 1171 H LEU 146 H LEU 146 7.982 9.331 -0.354 1172 HA LEU 146 HA LEU 146 9.516 10.673 -2.477 1173 HB2 LEU 146 HB2 LEU 146 6.640 9.725 -2.498 1174 HB3 LEU 146 HB3 LEU 146 7.358 10.791 -3.713 1175 HG LEU 146 HG LEU 146 7.302 8.592 -4.615 1176 HD11 LEU 146 HD11 LEU 146 9.686 8.096 -5.035 1177 HD12 LEU 146 HD12 LEU 146 9.320 9.850 -5.149 1178 HD13 LEU 146 HD13 LEU 146 10.141 9.197 -3.691 1179 HD21 LEU 146 HD21 LEU 146 8.389 6.639 -3.559 1180 HD22 LEU 146 HD22 LEU 146 8.754 7.638 -2.112 1181 HD23 LEU 146 HD23 LEU 146 7.049 7.300 -2.563 1182 HA PRO 147 HA PRO 147 8.176 14.243 -0.022 1183 HB2 PRO 147 HB2 PRO 147 9.653 16.093 -1.498 1184 HB3 PRO 147 HB3 PRO 147 10.438 15.070 -0.288 1185 HG2 PRO 147 HG2 PRO 147 10.294 14.704 -3.295 1186 HG3 PRO 147 HG3 PRO 147 11.681 14.508 -2.216 1187 HD2 PRO 147 HD2 PRO 147 10.266 12.358 -3.108 1188 HD3 PRO 147 HD3 PRO 147 10.995 12.370 -1.497 1189 H ARG 148 H ARG 148 7.850 16.772 -1.269 1190 HA ARG 148 HA ARG 148 5.314 16.424 -2.370 1191 HB2 ARG 148 HB2 ARG 148 5.190 18.764 -2.524 1192 HB3 ARG 148 HB3 ARG 148 6.210 18.440 -1.116 1193 HG2 ARG 148 HG2 ARG 148 7.193 19.266 -3.889 1194 HG3 ARG 148 HG3 ARG 148 7.077 20.315 -2.470 1195 HD2 ARG 148 HD2 ARG 148 8.820 17.804 -2.667 1196 HD3 ARG 148 HD3 ARG 148 9.399 19.463 -2.874 1197 HE ARG 148 HE ARG 148 8.098 19.372 -0.376 1198 HH11 ARG 148 HH11 ARG 148 10.901 17.905 -1.911 1199 HH12 ARG 148 HH12 ARG 148 11.761 17.707 -0.421 1200 HH21 ARG 148 HH21 ARG 148 9.243 19.113 1.566 1201 HH22 ARG 148 HH22 ARG 148 10.819 18.394 1.556 1202 H GLN 149 H GLN 149 6.376 14.714 -3.999 1203 HA GLN 149 HA GLN 149 6.840 16.072 -6.532 1204 HB2 GLN 149 HB2 GLN 149 8.668 14.622 -5.561 1205 HB3 GLN 149 HB3 GLN 149 7.618 13.239 -5.893 1206 HG2 GLN 149 HG2 GLN 149 7.495 14.283 -8.329 1207 HG3 GLN 149 HG3 GLN 149 8.974 15.118 -7.835 1208 HE21 GLN 149 HE21 GLN 149 9.879 12.896 -6.056 1209 HE22 GLN 149 HE22 GLN 149 10.437 11.645 -7.116 1210 H GLU 150 H GLU 150 4.149 15.464 -5.199 1211 HA GLU 150 HA GLU 150 3.139 13.300 -6.785 1212 HB2 GLU 150 HB2 GLU 150 0.965 13.898 -5.773 1213 HB3 GLU 150 HB3 GLU 150 2.242 13.612 -4.584 1214 HG2 GLU 150 HG2 GLU 150 1.136 15.481 -3.731 1215 HG3 GLU 150 HG3 GLU 150 2.542 16.187 -4.539 1216 H GLU 151 H GLU 151 1.560 13.329 -8.418 1217 HA GLU 151 HA GLU 151 0.830 15.840 -9.609 1218 HB2 GLU 151 HB2 GLU 151 3.170 15.397 -10.472 1219 HB3 GLU 151 HB3 GLU 151 2.632 13.820 -11.065 1220 HG2 GLU 151 HG2 GLU 151 0.951 15.044 -12.538 1221 HG3 GLU 151 HG3 GLU 151 1.715 16.560 -12.043 1222 H CYS 152 H CYS 152 1.187 12.221 -10.291 1223 HA CYS 152 HA CYS 152 -1.259 12.436 -11.943 1224 HB2 CYS 152 HB2 CYS 152 0.674 10.803 -12.478 1225 HB3 CYS 152 HB3 CYS 152 0.558 10.117 -10.852 1226 H THR 153 H THR 153 -3.256 12.006 -10.987 1227 HA THR 153 HA THR 153 -3.273 10.998 -8.231 1228 HB THR 153 HB THR 153 -5.610 12.639 -8.859 1229 HG1 THR 153 HG1 THR 153 -4.493 14.705 -9.106 1230 HG21 THR 153 HG21 THR 153 -4.831 13.927 -6.875 1231 HG22 THR 153 HG22 THR 153 -4.756 12.156 -6.591 1232 HG23 THR 153 HG23 THR 153 -3.254 13.072 -6.950 1233 H VAL 154 H VAL 154 -4.973 9.544 -7.673 1234 HA VAL 154 HA VAL 154 -6.310 8.377 -9.994 1235 HB VAL 154 HB VAL 154 -5.039 6.921 -8.435 1236 HG11 VAL 154 HG11 VAL 154 -5.925 6.440 -6.181 1237 HG12 VAL 154 HG12 VAL 154 -5.370 8.140 -6.347 1238 HG13 VAL 154 HG13 VAL 154 -7.126 7.761 -6.379 1239 HG21 VAL 154 HG21 VAL 154 -6.807 5.218 -8.115 1240 HG22 VAL 154 HG22 VAL 154 -8.056 6.468 -8.438 1241 HG23 VAL 154 HG23 VAL 154 -6.900 5.999 -9.730 1242 H ASP 155 H ASP 155 -8.570 8.416 -10.258 1243 HA ASP 155 HA ASP 155 -9.977 10.439 -8.883 1244 HB2 ASP 155 HB2 ASP 155 -10.473 9.877 -11.209 1245 HB3 ASP 155 HB3 ASP 155 -10.887 8.215 -10.770 1246 H GLU 156 H GLU 156 -11.917 10.263 -7.586 1247 HA GLU 156 HA GLU 156 -11.873 7.838 -5.919 1248 HB2 GLU 156 HB2 GLU 156 -12.777 9.273 -4.140 1249 HB3 GLU 156 HB3 GLU 156 -11.216 9.867 -4.720 1250 HG2 GLU 156 HG2 GLU 156 -12.554 11.484 -6.224 1251 HG3 GLU 156 HG3 GLU 156 -13.981 11.013 -5.291 1252 H VAL 157 H VAL 157 -14.081 10.331 -7.431 1253 HA VAL 157 HA VAL 157 -15.927 8.505 -8.328 1254 HB VAL 157 HB VAL 157 -16.276 8.003 -5.890 1255 HG11 VAL 157 HG11 VAL 157 -17.469 9.647 -4.482 1256 HG12 VAL 157 HG12 VAL 157 -15.831 10.214 -4.954 1257 HG13 VAL 157 HG13 VAL 157 -17.283 10.878 -5.777 1258 HG21 VAL 157 HG21 VAL 157 -18.744 8.147 -5.949 1259 HG22 VAL 157 HG22 VAL 157 -18.636 9.283 -7.336 1260 HG23 VAL 157 HG23 VAL 157 -18.057 7.592 -7.513 1261 HN1 EB4 158 HN1 EB4 158 4.134 -5.959 -7.116 1262 H8 EB4 158 H8 EB4 158 -2.007 -6.608 -4.597 1263 HN2 EB4 158 HN2 EB4 158 1.700 -5.154 -8.643 1264 H9 EB4 158 H9 EB4 158 0.793 -0.522 -3.196 1265 H10 EB4 158 H10 EB4 158 4.935 -7.429 -1.447 1266 HN3 EB4 158 HN3 EB4 158 4.030 -2.790 -7.492 1267 H7 EB4 158 H7 EB4 158 3.233 -5.626 -1.421 1268 H11 EB4 158 H11 EB4 158 -3.312 -7.229 -6.600 1269 H12 EB4 158 H12 EB4 158 2.271 1.414 -3.688 1270 H15 EB4 158 H15 EB4 158 3.999 1.233 -5.454 1271 H14 EB4 158 H14 EB4 158 -2.423 -6.746 -8.866 1272 H13 EB4 158 H13 EB4 158 5.982 -8.067 -3.607 1273 H22 EB4 158 H22 EB4 158 5.049 -6.679 -7.516 1274 H30 EB4 158 H30 EB4 158 6.664 -3.331 -9.982 1275 H30A EB4 158 H30A EB4 158 6.893 -2.806 -8.242 1276 H24 EB4 158 H24 EB4 158 4.579 -1.988 -8.224 1277 H28 EB4 158 H28 EB4 158 4.119 -8.397 -9.158 1278 H28A EB4 158 H28A EB4 158 4.968 -7.450 -10.480 1279 H23 EB4 158 H23 EB4 158 1.358 -5.177 -9.831 1280 H29 EB4 158 H29 EB4 158 1.192 -3.067 -10.915 1281 H29A EB4 158 H29A EB4 158 2.668 -3.559 -11.961 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -28.708 3.411 -4.249 2 H2 MET 1 H2 MET 1 -28.258 4.917 -3.808 3 H3 MET 1 H3 MET 1 -29.047 4.681 -5.218 4 HA MET 1 HA MET 1 -26.705 3.104 -5.046 5 HB2 MET 1 HB2 MET 1 -27.783 5.153 -7.029 6 HB3 MET 1 HB3 MET 1 -26.261 4.282 -7.262 7 HG2 MET 1 HG2 MET 1 -27.432 2.130 -7.272 8 HG3 MET 1 HG3 MET 1 -28.963 2.918 -6.870 9 HE1 MET 1 HE1 MET 1 -29.646 1.803 -10.545 10 HE2 MET 1 HE2 MET 1 -28.755 0.917 -9.262 11 HE3 MET 1 HE3 MET 1 -30.244 1.833 -8.852 12 H THR 2 H THR 2 -24.613 3.715 -4.482 13 HA THR 2 HA THR 2 -22.941 4.950 -3.729 14 HB THR 2 HB THR 2 -24.206 7.426 -4.979 15 HG1 THR 2 HG1 THR 2 -23.170 6.693 -6.982 16 HG21 THR 2 HG21 THR 2 -21.839 7.980 -5.453 17 HG22 THR 2 HG22 THR 2 -22.114 7.708 -3.699 18 HG23 THR 2 HG23 THR 2 -21.327 6.436 -4.693 19 H VAL 3 H VAL 3 -25.289 4.583 -1.995 20 HA VAL 3 HA VAL 3 -25.971 7.029 -0.775 21 HB VAL 3 HB VAL 3 -26.843 5.583 1.074 22 HG11 VAL 3 HG11 VAL 3 -28.579 4.462 -0.290 23 HG12 VAL 3 HG12 VAL 3 -28.238 6.127 -0.870 24 HG13 VAL 3 HG13 VAL 3 -27.577 4.713 -1.759 25 HG21 VAL 3 HG21 VAL 3 -26.819 3.128 0.792 26 HG22 VAL 3 HG22 VAL 3 -25.731 3.307 -0.626 27 HG23 VAL 3 HG23 VAL 3 -25.168 3.799 1.007 28 HA PRO 4 HA PRO 4 -22.241 7.549 1.661 29 HB2 PRO 4 HB2 PRO 4 -23.199 9.604 3.270 30 HB3 PRO 4 HB3 PRO 4 -22.799 9.902 1.573 31 HG2 PRO 4 HG2 PRO 4 -25.505 9.381 2.835 32 HG3 PRO 4 HG3 PRO 4 -25.060 10.579 1.613 33 HD2 PRO 4 HD2 PRO 4 -26.290 8.230 0.947 34 HD3 PRO 4 HD3 PRO 4 -25.144 9.021 -0.143 35 H ASP 5 H ASP 5 -23.130 5.232 2.395 36 HA ASP 5 HA ASP 5 -23.712 5.475 5.284 37 HB2 ASP 5 HB2 ASP 5 -24.367 3.324 3.224 38 HB3 ASP 5 HB3 ASP 5 -24.413 3.013 4.965 39 H ARG 6 H ARG 6 -22.478 2.633 3.419 40 HA ARG 6 HA ARG 6 -20.469 2.128 5.304 41 HB2 ARG 6 HB2 ARG 6 -21.240 1.019 2.632 42 HB3 ARG 6 HB3 ARG 6 -19.620 0.663 3.243 43 HG2 ARG 6 HG2 ARG 6 -21.001 -1.137 3.973 44 HG3 ARG 6 HG3 ARG 6 -20.711 -0.144 5.407 45 HD2 ARG 6 HD2 ARG 6 -23.015 -0.520 5.547 46 HD3 ARG 6 HD3 ARG 6 -22.956 1.061 4.755 47 HE ARG 6 HE ARG 6 -23.054 -0.508 2.587 48 HH11 ARG 6 HH11 ARG 6 -24.867 -0.749 5.592 49 HH12 ARG 6 HH12 ARG 6 -26.230 -1.519 4.849 50 HH21 ARG 6 HH21 ARG 6 -24.841 -1.535 1.633 51 HH22 ARG 6 HH22 ARG 6 -26.215 -1.966 2.596 52 H SER 7 H SER 7 -20.576 4.382 2.626 53 HA SER 7 HA SER 7 -17.997 4.420 1.696 54 HB2 SER 7 HB2 SER 7 -19.106 7.112 2.232 55 HB3 SER 7 HB3 SER 7 -18.739 6.335 0.686 56 HG SER 7 HG SER 7 -20.783 5.674 0.490 57 H GLU 8 H GLU 8 -19.204 5.568 4.897 58 HA GLU 8 HA GLU 8 -16.977 7.120 5.538 59 HB2 GLU 8 HB2 GLU 8 -18.884 5.633 7.380 60 HB3 GLU 8 HB3 GLU 8 -17.721 6.868 7.881 61 HG2 GLU 8 HG2 GLU 8 -18.901 8.428 6.165 62 HG3 GLU 8 HG3 GLU 8 -20.181 7.209 6.116 63 H ILE 9 H ILE 9 -17.301 3.620 5.313 64 HA ILE 9 HA ILE 9 -15.065 3.215 7.109 65 HB ILE 9 HB ILE 9 -16.641 1.206 5.401 66 HG12 ILE 9 HG12 ILE 9 -16.972 1.924 8.356 67 HG13 ILE 9 HG13 ILE 9 -18.029 2.506 7.063 68 HG21 ILE 9 HG21 ILE 9 -15.740 -0.470 6.974 69 HG22 ILE 9 HG22 ILE 9 -14.433 0.386 6.089 70 HG23 ILE 9 HG23 ILE 9 -14.791 0.814 7.796 71 HD11 ILE 9 HD11 ILE 9 -19.030 0.590 8.228 72 HD12 ILE 9 HD12 ILE 9 -18.671 0.174 6.518 73 HD13 ILE 9 HD13 ILE 9 -17.597 -0.417 7.831 74 H ALA 10 H ALA 10 -15.716 3.344 3.569 75 HA ALA 10 HA ALA 10 -12.966 2.392 3.105 76 HB1 ALA 10 HB1 ALA 10 -13.743 2.050 0.771 77 HB2 ALA 10 HB2 ALA 10 -14.730 1.121 1.950 78 HB3 ALA 10 HB3 ALA 10 -15.375 2.638 1.237 79 H GLY 11 H GLY 11 -12.168 3.491 0.800 80 HA2 GLY 11 HA2 GLY 11 -12.801 6.007 0.060 81 HA3 GLY 11 HA3 GLY 11 -11.865 6.268 1.538 82 H LYS 12 H LYS 12 -10.247 7.374 0.181 83 HA LYS 12 HA LYS 12 -8.603 5.488 -1.382 84 HB2 LYS 12 HB2 LYS 12 -7.808 7.490 -2.591 85 HB3 LYS 12 HB3 LYS 12 -9.551 7.254 -2.770 86 HG2 LYS 12 HG2 LYS 12 -9.951 8.984 -1.002 87 HG3 LYS 12 HG3 LYS 12 -8.205 9.237 -0.871 88 HD2 LYS 12 HD2 LYS 12 -8.073 9.996 -3.194 89 HD3 LYS 12 HD3 LYS 12 -9.760 9.556 -3.487 90 HE2 LYS 12 HE2 LYS 12 -9.763 11.920 -3.132 91 HE3 LYS 12 HE3 LYS 12 -10.415 11.212 -1.648 92 HZ1 LYS 12 HZ1 LYS 12 -8.719 12.956 -1.320 93 HZ2 LYS 12 HZ2 LYS 12 -8.349 11.550 -0.577 94 HZ3 LYS 12 HZ3 LYS 12 -7.585 11.971 -1.958 95 H TRP 13 H TRP 13 -6.311 5.486 -1.019 96 HA TRP 13 HA TRP 13 -5.411 7.150 1.242 97 HB2 TRP 13 HB2 TRP 13 -4.641 4.236 0.769 98 HB3 TRP 13 HB3 TRP 13 -4.165 5.265 2.126 99 HD1 TRP 13 HD1 TRP 13 -6.524 2.590 1.355 100 HE1 TRP 13 HE1 TRP 13 -8.479 2.518 3.044 101 HE3 TRP 13 HE3 TRP 13 -5.909 7.224 3.486 102 HZ2 TRP 13 HZ2 TRP 13 -9.621 4.188 5.005 103 HZ3 TRP 13 HZ3 TRP 13 -7.484 7.925 5.275 104 HH2 TRP 13 HH2 TRP 13 -9.311 6.426 6.022 105 H TYR 14 H TYR 14 -3.292 8.005 0.962 106 HA TYR 14 HA TYR 14 -2.135 7.473 -1.691 107 HB2 TYR 14 HB2 TYR 14 -1.628 9.741 0.293 108 HB3 TYR 14 HB3 TYR 14 -0.941 9.602 -1.331 109 HD1 TYR 14 HD1 TYR 14 -4.177 9.949 0.525 110 HD2 TYR 14 HD2 TYR 14 -2.149 10.377 -3.235 111 HE1 TYR 14 HE1 TYR 14 -6.154 11.113 -0.405 112 HE2 TYR 14 HE2 TYR 14 -4.124 11.541 -4.171 113 HH TYR 14 HH TYR 14 -6.417 11.863 -3.836 114 H VAL 15 H VAL 15 -0.297 6.137 -1.839 115 HA VAL 15 HA VAL 15 1.023 5.567 0.738 116 HB VAL 15 HB VAL 15 0.410 3.745 -0.794 117 HG11 VAL 15 HG11 VAL 15 1.579 3.388 -2.971 118 HG12 VAL 15 HG12 VAL 15 0.514 4.835 -2.973 119 HG13 VAL 15 HG13 VAL 15 2.294 5.030 -2.830 120 HG21 VAL 15 HG21 VAL 15 2.601 2.597 -0.952 121 HG22 VAL 15 HG22 VAL 15 3.416 4.157 -0.598 122 HG23 VAL 15 HG23 VAL 15 2.340 3.408 0.628 123 H VAL 16 H VAL 16 2.481 6.979 1.374 124 HA VAL 16 HA VAL 16 4.095 8.390 -0.626 125 HB VAL 16 HB VAL 16 4.538 10.050 1.169 126 HG11 VAL 16 HG11 VAL 16 2.300 11.089 1.265 127 HG12 VAL 16 HG12 VAL 16 2.699 10.471 -0.374 128 HG13 VAL 16 HG13 VAL 16 1.573 9.554 0.682 129 HG21 VAL 16 HG21 VAL 16 3.208 10.010 3.263 130 HG22 VAL 16 HG22 VAL 16 2.550 8.404 2.801 131 HG23 VAL 16 HG23 VAL 16 4.306 8.596 3.127 132 H ALA 17 H ALA 17 4.278 5.612 1.075 133 HA ALA 17 HA ALA 17 7.166 5.871 1.380 134 HB1 ALA 17 HB1 ALA 17 7.188 4.943 3.597 135 HB2 ALA 17 HB2 ALA 17 6.143 6.405 3.610 136 HB3 ALA 17 HB3 ALA 17 5.423 4.785 3.590 137 H LEU 18 H LEU 18 8.239 3.740 1.402 138 HA LEU 18 HA LEU 18 6.584 1.435 0.905 139 HB2 LEU 18 HB2 LEU 18 8.361 2.670 -1.248 140 HB3 LEU 18 HB3 LEU 18 7.788 0.997 -1.293 141 HG LEU 18 HG LEU 18 5.910 3.393 -1.185 142 HD11 LEU 18 HD11 LEU 18 5.627 3.077 -3.624 143 HD12 LEU 18 HD12 LEU 18 7.308 3.545 -3.201 144 HD13 LEU 18 HD13 LEU 18 6.927 1.838 -3.609 145 HD21 LEU 18 HD21 LEU 18 4.262 1.764 -2.046 146 HD22 LEU 18 HD22 LEU 18 5.507 0.472 -1.972 147 HD23 LEU 18 HD23 LEU 18 4.939 1.259 -0.461 148 H ALA 19 H ALA 19 7.827 -0.597 0.937 149 HA ALA 19 HA ALA 19 10.720 -0.305 1.484 150 HB1 ALA 19 HB1 ALA 19 10.478 -1.816 3.418 151 HB2 ALA 19 HB2 ALA 19 9.569 -0.291 3.687 152 HB3 ALA 19 HB3 ALA 19 8.692 -1.791 3.233 153 H SER 20 H SER 20 11.823 -1.932 0.327 154 HA SER 20 HA SER 20 10.150 -4.207 -0.565 155 HB2 SER 20 HB2 SER 20 12.302 -2.694 -2.174 156 HB3 SER 20 HB3 SER 20 11.387 -4.099 -2.735 157 HG SER 20 HG SER 20 10.662 -1.718 -3.241 158 H ASN 21 H ASN 21 11.133 -6.223 -0.592 159 HA ASN 21 HA ASN 21 13.593 -6.370 0.978 160 HB2 ASN 21 HB2 ASN 21 11.308 -7.728 1.270 161 HB3 ASN 21 HB3 ASN 21 11.962 -8.729 -0.034 162 HD21 ASN 21 HD21 ASN 21 14.776 -8.572 0.759 163 HD22 ASN 21 HD22 ASN 21 14.933 -9.515 2.203 164 H THR 22 H THR 22 12.403 -6.774 -2.380 165 HA THR 22 HA THR 22 14.844 -8.222 -3.058 166 HB THR 22 HB THR 22 13.466 -7.735 -5.427 167 HG1 THR 22 HG1 THR 22 11.319 -7.548 -5.004 168 HG21 THR 22 HG21 THR 22 12.614 -10.052 -5.147 169 HG22 THR 22 HG22 THR 22 14.314 -9.917 -4.585 170 HG23 THR 22 HG23 THR 22 12.974 -9.974 -3.390 171 H GLU 23 H GLU 23 16.595 -7.400 -4.082 172 HA GLU 23 HA GLU 23 17.285 -4.792 -3.983 173 HB2 GLU 23 HB2 GLU 23 18.178 -6.292 -6.435 174 HB3 GLU 23 HB3 GLU 23 19.141 -5.408 -5.243 175 HG2 GLU 23 HG2 GLU 23 17.881 -8.135 -4.706 176 HG3 GLU 23 HG3 GLU 23 19.519 -7.915 -5.335 177 H PHE 24 H PHE 24 15.847 -6.487 -6.891 178 HA PHE 24 HA PHE 24 15.923 -4.374 -8.640 179 HB2 PHE 24 HB2 PHE 24 13.855 -6.599 -8.302 180 HB3 PHE 24 HB3 PHE 24 13.898 -5.508 -9.693 181 HD1 PHE 24 HD1 PHE 24 15.876 -5.533 -11.235 182 HD2 PHE 24 HD2 PHE 24 15.375 -8.434 -8.109 183 HE1 PHE 24 HE1 PHE 24 17.518 -7.013 -12.349 184 HE2 PHE 24 HE2 PHE 24 17.019 -9.916 -9.217 185 HZ PHE 24 HZ PHE 24 18.096 -9.208 -11.341 186 H PHE 25 H PHE 25 13.181 -5.198 -6.343 187 HA PHE 25 HA PHE 25 11.506 -3.145 -7.136 188 HB2 PHE 25 HB2 PHE 25 11.912 -4.599 -4.496 189 HB3 PHE 25 HB3 PHE 25 10.681 -3.343 -4.685 190 HD1 PHE 25 HD1 PHE 25 11.888 -6.374 -6.582 191 HD2 PHE 25 HD2 PHE 25 8.550 -4.067 -5.181 192 HE1 PHE 25 HE1 PHE 25 10.334 -8.042 -7.547 193 HE2 PHE 25 HE2 PHE 25 6.992 -5.732 -6.143 194 HZ PHE 25 HZ PHE 25 7.880 -7.726 -7.329 195 H LEU 26 H LEU 26 14.103 -3.090 -4.566 196 HA LEU 26 HA LEU 26 13.604 -0.473 -3.704 197 HB2 LEU 26 HB2 LEU 26 16.257 -1.980 -3.888 198 HB3 LEU 26 HB3 LEU 26 15.924 -0.574 -2.867 199 HG LEU 26 HG LEU 26 14.634 -3.325 -2.599 200 HD11 LEU 26 HD11 LEU 26 15.926 -3.457 -0.501 201 HD12 LEU 26 HD12 LEU 26 16.993 -3.310 -1.938 202 HD13 LEU 26 HD13 LEU 26 16.704 -1.885 -0.884 203 HD21 LEU 26 HD21 LEU 26 13.685 -2.426 -0.502 204 HD22 LEU 26 HD22 LEU 26 14.367 -0.811 -0.891 205 HD23 LEU 26 HD23 LEU 26 13.099 -1.527 -1.943 206 H ARG 27 H ARG 27 15.794 -1.799 -6.289 207 HA ARG 27 HA ARG 27 16.994 0.620 -6.980 208 HB2 ARG 27 HB2 ARG 27 17.439 -1.898 -7.684 209 HB3 ARG 27 HB3 ARG 27 16.346 -1.517 -9.022 210 HG2 ARG 27 HG2 ARG 27 17.940 0.622 -9.280 211 HG3 ARG 27 HG3 ARG 27 19.090 -0.405 -8.413 212 HD2 ARG 27 HD2 ARG 27 19.505 -0.865 -10.704 213 HD3 ARG 27 HD3 ARG 27 18.549 -2.244 -10.147 214 HE ARG 27 HE ARG 27 16.550 -1.010 -11.145 215 HH11 ARG 27 HH11 ARG 27 19.814 -0.492 -12.362 216 HH12 ARG 27 HH12 ARG 27 19.275 -0.034 -13.943 217 HH21 ARG 27 HH21 ARG 27 15.865 -0.404 -13.198 218 HH22 ARG 27 HH22 ARG 27 17.020 0.016 -14.419 219 H GLU 28 H GLU 28 14.006 -1.030 -8.298 220 HA GLU 28 HA GLU 28 13.525 1.035 -10.181 221 HB2 GLU 28 HB2 GLU 28 11.723 -1.148 -9.032 222 HB3 GLU 28 HB3 GLU 28 11.284 -0.091 -10.381 223 HG2 GLU 28 HG2 GLU 28 13.527 -2.156 -10.301 224 HG3 GLU 28 HG3 GLU 28 12.043 -2.218 -11.260 225 H LYS 29 H LYS 29 11.812 0.178 -7.030 226 HA LYS 29 HA LYS 29 10.079 2.311 -7.124 227 HB2 LYS 29 HB2 LYS 29 11.210 0.591 -4.923 228 HB3 LYS 29 HB3 LYS 29 10.289 2.034 -4.479 229 HG2 LYS 29 HG2 LYS 29 9.243 -0.146 -6.350 230 HG3 LYS 29 HG3 LYS 29 8.938 -0.107 -4.609 231 HD2 LYS 29 HD2 LYS 29 7.020 0.929 -5.530 232 HD3 LYS 29 HD3 LYS 29 8.006 2.292 -4.986 233 HE2 LYS 29 HE2 LYS 29 7.576 3.070 -7.102 234 HE3 LYS 29 HE3 LYS 29 8.985 2.081 -7.507 235 HZ1 LYS 29 HZ1 LYS 29 6.763 1.811 -8.783 236 HZ2 LYS 29 HZ2 LYS 29 7.673 0.496 -8.453 237 HZ3 LYS 29 HZ3 LYS 29 6.353 0.823 -7.549 238 H ASP 30 H ASP 30 13.386 2.261 -5.530 239 HA ASP 30 HA ASP 30 13.223 4.829 -4.488 240 HB2 ASP 30 HB2 ASP 30 15.028 3.417 -3.817 241 HB3 ASP 30 HB3 ASP 30 15.544 3.129 -5.484 242 H LYS 31 H LYS 31 13.752 3.739 -7.875 243 HA LYS 31 HA LYS 31 14.523 6.427 -8.641 244 HB2 LYS 31 HB2 LYS 31 14.286 3.760 -10.075 245 HB3 LYS 31 HB3 LYS 31 14.436 5.272 -10.979 246 HG2 LYS 31 HG2 LYS 31 16.415 4.322 -8.849 247 HG3 LYS 31 HG3 LYS 31 16.624 4.094 -10.590 248 HD2 LYS 31 HD2 LYS 31 17.508 6.163 -10.764 249 HD3 LYS 31 HD3 LYS 31 15.988 6.867 -10.196 250 HE2 LYS 31 HE2 LYS 31 18.042 5.725 -8.252 251 HE3 LYS 31 HE3 LYS 31 18.172 7.379 -8.865 252 HZ1 LYS 31 HZ1 LYS 31 16.942 7.704 -7.017 253 HZ2 LYS 31 HZ2 LYS 31 15.703 7.449 -8.050 254 HZ3 LYS 31 HZ3 LYS 31 16.200 6.250 -7.059 255 H MET 32 H MET 32 11.346 4.625 -8.257 256 HA MET 32 HA MET 32 10.545 6.353 -10.530 257 HB2 MET 32 HB2 MET 32 9.104 4.416 -8.416 258 HB3 MET 32 HB3 MET 32 8.267 5.015 -9.855 259 HG2 MET 32 HG2 MET 32 10.759 3.249 -10.062 260 HG3 MET 32 HG3 MET 32 9.139 2.562 -9.889 261 HE1 MET 32 HE1 MET 32 10.417 2.324 -13.770 262 HE2 MET 32 HE2 MET 32 11.517 2.517 -12.363 263 HE3 MET 32 HE3 MET 32 10.145 1.361 -12.279 264 H LYS 33 H LYS 33 7.706 6.156 -8.577 265 HA LYS 33 HA LYS 33 8.397 8.580 -7.034 266 HB2 LYS 33 HB2 LYS 33 6.263 8.713 -9.256 267 HB3 LYS 33 HB3 LYS 33 6.524 9.954 -8.023 268 HG2 LYS 33 HG2 LYS 33 8.735 10.469 -8.905 269 HG3 LYS 33 HG3 LYS 33 8.675 9.090 -10.011 270 HD2 LYS 33 HD2 LYS 33 6.640 10.172 -11.118 271 HD3 LYS 33 HD3 LYS 33 6.920 11.597 -10.108 272 HE2 LYS 33 HE2 LYS 33 9.287 11.713 -11.023 273 HE3 LYS 33 HE3 LYS 33 8.895 10.374 -12.109 274 HZ1 LYS 33 HZ1 LYS 33 8.631 12.491 -13.184 275 HZ2 LYS 33 HZ2 LYS 33 7.177 11.756 -13.081 276 HZ3 LYS 33 HZ3 LYS 33 7.540 12.992 -12.078 277 H MET 34 H MET 34 5.927 9.394 -6.114 278 HA MET 34 HA MET 34 5.308 7.213 -4.392 279 HB2 MET 34 HB2 MET 34 5.126 9.548 -3.647 280 HB3 MET 34 HB3 MET 34 4.074 9.965 -5.006 281 HG2 MET 34 HG2 MET 34 2.303 8.444 -4.041 282 HG3 MET 34 HG3 MET 34 3.351 8.164 -2.645 283 HE1 MET 34 HE1 MET 34 1.274 12.144 -3.768 284 HE2 MET 34 HE2 MET 34 2.889 11.830 -4.489 285 HE3 MET 34 HE3 MET 34 1.524 10.712 -4.822 286 H ALA 35 H ALA 35 3.270 6.131 -4.151 287 HA ALA 35 HA ALA 35 1.814 5.816 -6.660 288 HB1 ALA 35 HB1 ALA 35 1.321 3.517 -5.916 289 HB2 ALA 35 HB2 ALA 35 3.076 3.831 -6.135 290 HB3 ALA 35 HB3 ALA 35 2.372 3.777 -4.483 291 H MET 36 H MET 36 -0.435 4.609 -6.122 292 HA MET 36 HA MET 36 -1.719 6.226 -4.019 293 HB2 MET 36 HB2 MET 36 -2.750 5.528 -6.824 294 HB3 MET 36 HB3 MET 36 -3.689 6.360 -5.578 295 HG2 MET 36 HG2 MET 36 -1.048 7.563 -6.341 296 HG3 MET 36 HG3 MET 36 -2.352 7.643 -7.533 297 HE1 MET 36 HE1 MET 36 -1.793 11.085 -5.348 298 HE2 MET 36 HE2 MET 36 -0.681 9.851 -6.030 299 HE3 MET 36 HE3 MET 36 -1.944 10.594 -7.069 300 H ALA 37 H ALA 37 -4.018 5.270 -3.489 301 HA ALA 37 HA ALA 37 -4.404 2.487 -4.159 302 HB1 ALA 37 HB1 ALA 37 -4.194 1.716 -1.791 303 HB2 ALA 37 HB2 ALA 37 -2.623 2.324 -2.413 304 HB3 ALA 37 HB3 ALA 37 -3.610 3.345 -1.313 305 H ARG 38 H ARG 38 -6.562 2.213 -4.283 306 HA ARG 38 HA ARG 38 -8.305 3.742 -2.434 307 HB2 ARG 38 HB2 ARG 38 -8.458 4.781 -4.646 308 HB3 ARG 38 HB3 ARG 38 -8.656 3.205 -5.423 309 HG2 ARG 38 HG2 ARG 38 -10.774 2.969 -3.866 310 HG3 ARG 38 HG3 ARG 38 -10.626 4.721 -3.674 311 HD2 ARG 38 HD2 ARG 38 -10.680 4.992 -6.163 312 HD3 ARG 38 HD3 ARG 38 -10.847 3.241 -6.345 313 HE ARG 38 HE ARG 38 -12.988 3.601 -4.890 314 HH11 ARG 38 HH11 ARG 38 -11.736 5.865 -7.276 315 HH12 ARG 38 HH12 ARG 38 -13.289 6.556 -7.609 316 HH21 ARG 38 HH21 ARG 38 -15.013 4.538 -5.332 317 HH22 ARG 38 HH22 ARG 38 -15.146 5.804 -6.507 318 H ILE 39 H ILE 39 -9.660 2.306 -1.323 319 HA ILE 39 HA ILE 39 -9.730 -0.425 -2.347 320 HB ILE 39 HB ILE 39 -10.194 0.364 0.549 321 HG12 ILE 39 HG12 ILE 39 -8.002 1.191 0.037 322 HG13 ILE 39 HG13 ILE 39 -7.868 -0.271 1.023 323 HG21 ILE 39 HG21 ILE 39 -9.591 -2.010 0.955 324 HG22 ILE 39 HG22 ILE 39 -11.007 -1.850 -0.138 325 HG23 ILE 39 HG23 ILE 39 -9.393 -2.252 -0.814 326 HD11 ILE 39 HD11 ILE 39 -6.174 -0.242 -0.750 327 HD12 ILE 39 HD12 ILE 39 -7.324 -1.599 -0.996 328 HD13 ILE 39 HD13 ILE 39 -7.460 -0.115 -1.997 329 H SER 40 H SER 40 -11.774 -1.630 -2.180 330 HA SER 40 HA SER 40 -14.081 -0.066 -1.292 331 HB2 SER 40 HB2 SER 40 -13.832 -1.336 -4.055 332 HB3 SER 40 HB3 SER 40 -15.299 -0.619 -3.374 333 HG SER 40 HG SER 40 -13.317 1.199 -3.060 334 H PHE 41 H PHE 41 -15.672 -1.322 -0.287 335 HA PHE 41 HA PHE 41 -14.943 -4.037 0.274 336 HB2 PHE 41 HB2 PHE 41 -17.189 -3.997 1.490 337 HB3 PHE 41 HB3 PHE 41 -15.957 -2.862 2.058 338 HD1 PHE 41 HD1 PHE 41 -19.204 -3.197 0.332 339 HD2 PHE 41 HD2 PHE 41 -16.237 -0.452 1.785 340 HE1 PHE 41 HE1 PHE 41 -20.811 -1.331 0.087 341 HE2 PHE 41 HE2 PHE 41 -17.841 1.416 1.537 342 HZ PHE 41 HZ PHE 41 -20.133 0.981 0.689 343 H LEU 42 H LEU 42 -15.140 -5.582 -1.288 344 HA LEU 42 HA LEU 42 -17.092 -5.398 -3.361 345 HB2 LEU 42 HB2 LEU 42 -14.722 -6.597 -3.206 346 HB3 LEU 42 HB3 LEU 42 -15.672 -7.945 -2.567 347 HG LEU 42 HG LEU 42 -15.299 -8.271 -4.922 348 HD11 LEU 42 HD11 LEU 42 -17.618 -8.460 -5.753 349 HD12 LEU 42 HD12 LEU 42 -17.459 -9.020 -4.054 350 HD13 LEU 42 HD13 LEU 42 -18.179 -7.413 -4.406 351 HD21 LEU 42 HD21 LEU 42 -16.151 -6.695 -6.630 352 HD22 LEU 42 HD22 LEU 42 -16.628 -5.554 -5.328 353 HD23 LEU 42 HD23 LEU 42 -14.895 -5.948 -5.586 354 H GLY 43 H GLY 43 -16.716 -7.325 -0.313 355 HA2 GLY 43 HA2 GLY 43 -19.559 -7.632 -0.077 356 HA3 GLY 43 HA3 GLY 43 -18.735 -9.122 -0.555 357 H GLU 44 H GLU 44 -19.935 -9.281 1.900 358 HA GLU 44 HA GLU 44 -18.607 -8.282 4.100 359 HB2 GLU 44 HB2 GLU 44 -19.862 -11.052 3.775 360 HB3 GLU 44 HB3 GLU 44 -19.566 -10.213 5.303 361 HG2 GLU 44 HG2 GLU 44 -21.139 -8.407 4.620 362 HG3 GLU 44 HG3 GLU 44 -21.431 -9.239 3.087 363 H ASP 45 H ASP 45 -17.713 -11.089 1.989 364 HA ASP 45 HA ASP 45 -15.338 -11.480 3.688 365 HB2 ASP 45 HB2 ASP 45 -16.942 -13.424 3.457 366 HB3 ASP 45 HB3 ASP 45 -16.740 -13.365 1.701 367 H GLU 46 H GLU 46 -16.230 -9.949 0.758 368 HA GLU 46 HA GLU 46 -13.522 -10.484 -0.277 369 HB2 GLU 46 HB2 GLU 46 -15.256 -11.624 -1.658 370 HB3 GLU 46 HB3 GLU 46 -16.056 -10.070 -1.927 371 HG2 GLU 46 HG2 GLU 46 -14.172 -9.208 -3.167 372 HG3 GLU 46 HG3 GLU 46 -13.147 -10.567 -2.687 373 H LEU 47 H LEU 47 -12.484 -8.715 -1.411 374 HA LEU 47 HA LEU 47 -13.730 -6.122 -1.066 375 HB2 LEU 47 HB2 LEU 47 -11.810 -5.163 0.042 376 HB3 LEU 47 HB3 LEU 47 -12.495 -6.473 1.013 377 HG LEU 47 HG LEU 47 -10.211 -7.126 -0.834 378 HD11 LEU 47 HD11 LEU 47 -8.588 -6.440 0.894 379 HD12 LEU 47 HD12 LEU 47 -9.493 -5.037 0.233 380 HD13 LEU 47 HD13 LEU 47 -9.918 -5.701 1.847 381 HD21 LEU 47 HD21 LEU 47 -9.653 -8.665 1.020 382 HD22 LEU 47 HD22 LEU 47 -11.026 -8.008 1.974 383 HD23 LEU 47 HD23 LEU 47 -11.339 -8.896 0.445 384 H LYS 48 H LYS 48 -12.850 -4.466 -2.430 385 HA LYS 48 HA LYS 48 -11.088 -5.524 -4.535 386 HB2 LYS 48 HB2 LYS 48 -13.355 -5.155 -5.342 387 HB3 LYS 48 HB3 LYS 48 -13.332 -3.494 -4.736 388 HG2 LYS 48 HG2 LYS 48 -11.419 -2.974 -6.278 389 HG3 LYS 48 HG3 LYS 48 -11.487 -4.628 -6.902 390 HD2 LYS 48 HD2 LYS 48 -13.882 -2.722 -6.953 391 HD3 LYS 48 HD3 LYS 48 -12.722 -2.851 -8.282 392 HE2 LYS 48 HE2 LYS 48 -14.353 -5.185 -7.151 393 HE3 LYS 48 HE3 LYS 48 -14.781 -4.264 -8.599 394 HZ1 LYS 48 HZ1 LYS 48 -13.596 -5.874 -9.570 395 HZ2 LYS 48 HZ2 LYS 48 -12.295 -4.970 -9.172 396 HZ3 LYS 48 HZ3 LYS 48 -12.720 -6.244 -8.243 397 H VAL 49 H VAL 49 -9.295 -4.198 -5.166 398 HA VAL 49 HA VAL 49 -9.149 -1.606 -3.806 399 HB VAL 49 HB VAL 49 -6.781 -2.006 -3.262 400 HG11 VAL 49 HG11 VAL 49 -7.138 -3.617 -1.407 401 HG12 VAL 49 HG12 VAL 49 -8.510 -2.470 -1.567 402 HG13 VAL 49 HG13 VAL 49 -8.670 -4.153 -2.175 403 HG21 VAL 49 HG21 VAL 49 -5.826 -4.277 -3.388 404 HG22 VAL 49 HG22 VAL 49 -7.307 -4.849 -4.227 405 HG23 VAL 49 HG23 VAL 49 -6.243 -3.633 -5.011 406 H SER 50 H SER 50 -8.239 0.047 -5.124 407 HA SER 50 HA SER 50 -7.241 -0.883 -7.757 408 HB2 SER 50 HB2 SER 50 -9.438 0.432 -7.690 409 HB3 SER 50 HB3 SER 50 -8.520 1.803 -7.052 410 HG SER 50 HG SER 50 -8.102 2.260 -9.092 411 H TYR 51 H TYR 51 -5.082 -0.571 -8.000 412 HA TYR 51 HA TYR 51 -3.714 1.291 -6.198 413 HB2 TYR 51 HB2 TYR 51 -3.035 -1.185 -7.781 414 HB3 TYR 51 HB3 TYR 51 -1.761 0.029 -7.611 415 HD1 TYR 51 HD1 TYR 51 -2.241 0.989 -4.804 416 HD2 TYR 51 HD2 TYR 51 -2.308 -2.969 -6.468 417 HE1 TYR 51 HE1 TYR 51 -1.601 0.052 -2.601 418 HE2 TYR 51 HE2 TYR 51 -1.690 -3.910 -4.268 419 HH TYR 51 HH TYR 51 -1.860 -3.253 -1.847 420 H ALA 52 H ALA 52 -2.415 2.997 -7.081 421 HA ALA 52 HA ALA 52 -2.509 3.314 -10.014 422 HB1 ALA 52 HB1 ALA 52 -2.968 5.713 -9.691 423 HB2 ALA 52 HB2 ALA 52 -4.308 4.691 -9.070 424 HB3 ALA 52 HB3 ALA 52 -3.146 5.441 -7.924 425 H VAL 53 H VAL 53 -0.470 3.781 -10.824 426 HA VAL 53 HA VAL 53 1.403 5.063 -9.016 427 HB VAL 53 HB VAL 53 3.211 3.465 -9.686 428 HG11 VAL 53 HG11 VAL 53 2.516 1.635 -8.176 429 HG12 VAL 53 HG12 VAL 53 2.095 3.250 -7.513 430 HG13 VAL 53 HG13 VAL 53 0.821 2.222 -8.252 431 HG21 VAL 53 HG21 VAL 53 2.576 1.264 -10.613 432 HG22 VAL 53 HG22 VAL 53 0.884 1.836 -10.799 433 HG23 VAL 53 HG23 VAL 53 2.202 2.605 -11.747 434 HA PRO 54 HA PRO 54 2.494 7.051 -12.880 435 HB2 PRO 54 HB2 PRO 54 4.773 8.348 -12.051 436 HB3 PRO 54 HB3 PRO 54 3.216 8.816 -11.354 437 HG2 PRO 54 HG2 PRO 54 5.380 7.056 -10.190 438 HG3 PRO 54 HG3 PRO 54 4.378 8.271 -9.387 439 HD2 PRO 54 HD2 PRO 54 3.885 5.523 -9.290 440 HD3 PRO 54 HD3 PRO 54 2.656 6.760 -8.993 441 H LYS 55 H LYS 55 2.966 5.520 -14.372 442 HA LYS 55 HA LYS 55 5.582 4.243 -14.262 443 HB2 LYS 55 HB2 LYS 55 3.595 2.796 -14.494 444 HB3 LYS 55 HB3 LYS 55 3.147 3.641 -15.982 445 HG2 LYS 55 HG2 LYS 55 5.257 2.886 -17.066 446 HG3 LYS 55 HG3 LYS 55 5.749 2.077 -15.573 447 HD2 LYS 55 HD2 LYS 55 3.845 0.544 -15.685 448 HD3 LYS 55 HD3 LYS 55 3.129 1.446 -17.027 449 HE2 LYS 55 HE2 LYS 55 4.183 -0.478 -17.998 450 HE3 LYS 55 HE3 LYS 55 5.206 0.906 -18.403 451 HZ1 LYS 55 HZ1 LYS 55 6.498 -0.952 -17.634 452 HZ2 LYS 55 HZ2 LYS 55 6.653 0.285 -16.579 453 HZ3 LYS 55 HZ3 LYS 55 5.709 -0.994 -16.205 454 HA PRO 56 HA PRO 56 7.436 6.915 -17.287 455 HB2 PRO 56 HB2 PRO 56 8.119 4.238 -18.657 456 HB3 PRO 56 HB3 PRO 56 9.215 5.580 -18.303 457 HG2 PRO 56 HG2 PRO 56 9.267 3.395 -16.770 458 HG3 PRO 56 HG3 PRO 56 9.428 4.992 -16.027 459 HD2 PRO 56 HD2 PRO 56 7.060 3.122 -16.023 460 HD3 PRO 56 HD3 PRO 56 7.590 4.257 -14.775 461 H ASN 57 H ASN 57 5.204 4.276 -18.267 462 HA ASN 57 HA ASN 57 4.869 5.507 -20.878 463 HB2 ASN 57 HB2 ASN 57 3.257 3.218 -19.647 464 HB3 ASN 57 HB3 ASN 57 3.471 3.596 -21.361 465 HD21 ASN 57 HD21 ASN 57 5.285 2.833 -22.455 466 HD22 ASN 57 HD22 ASN 57 6.455 1.777 -21.737 467 H GLY 58 H GLY 58 3.803 6.398 -17.823 468 HA2 GLY 58 HA2 GLY 58 2.214 8.263 -17.946 469 HA3 GLY 58 HA3 GLY 58 1.164 7.204 -18.897 470 H CYS 59 H CYS 59 -0.157 8.144 -16.783 471 HA CYS 59 HA CYS 59 0.270 6.969 -14.296 472 HB2 CYS 59 HB2 CYS 59 -2.307 7.847 -15.685 473 HB3 CYS 59 HB3 CYS 59 -2.194 7.426 -13.971 474 H ARG 60 H ARG 60 0.297 4.844 -13.717 475 HA ARG 60 HA ARG 60 -1.399 3.007 -15.266 476 HB2 ARG 60 HB2 ARG 60 1.180 2.792 -15.192 477 HB3 ARG 60 HB3 ARG 60 0.962 2.271 -13.516 478 HG2 ARG 60 HG2 ARG 60 1.025 0.249 -14.691 479 HG3 ARG 60 HG3 ARG 60 -0.709 0.519 -14.470 480 HD2 ARG 60 HD2 ARG 60 0.818 1.374 -16.979 481 HD3 ARG 60 HD3 ARG 60 0.026 -0.199 -16.815 482 HE ARG 60 HE ARG 60 -1.345 2.442 -16.946 483 HH11 ARG 60 HH11 ARG 60 -1.531 -1.068 -16.832 484 HH12 ARG 60 HH12 ARG 60 -3.163 -1.124 -17.408 485 HH21 ARG 60 HH21 ARG 60 -3.483 2.349 -17.739 486 HH22 ARG 60 HH22 ARG 60 -4.273 0.818 -17.923 487 H LYS 61 H LYS 61 -2.985 1.790 -14.242 488 HA LYS 61 HA LYS 61 -2.878 1.693 -11.321 489 HB2 LYS 61 HB2 LYS 61 -4.825 2.715 -10.923 490 HB3 LYS 61 HB3 LYS 61 -4.387 3.605 -12.388 491 HG2 LYS 61 HG2 LYS 61 -5.870 2.253 -13.750 492 HG3 LYS 61 HG3 LYS 61 -6.164 1.126 -12.419 493 HD2 LYS 61 HD2 LYS 61 -7.036 3.201 -11.094 494 HD3 LYS 61 HD3 LYS 61 -7.054 4.036 -12.653 495 HE2 LYS 61 HE2 LYS 61 -9.265 3.128 -12.292 496 HE3 LYS 61 HE3 LYS 61 -8.507 2.183 -13.581 497 HZ1 LYS 61 HZ1 LYS 61 -9.641 0.868 -11.846 498 HZ2 LYS 61 HZ2 LYS 61 -8.078 0.445 -12.056 499 HZ3 LYS 61 HZ3 LYS 61 -8.516 1.334 -10.759 500 H TRP 62 H TRP 62 -4.464 0.020 -10.432 501 HA TRP 62 HA TRP 62 -5.476 -1.901 -12.333 502 HB2 TRP 62 HB2 TRP 62 -2.866 -2.284 -11.824 503 HB3 TRP 62 HB3 TRP 62 -3.500 -3.002 -10.337 504 HD1 TRP 62 HD1 TRP 62 -3.995 -5.530 -10.517 505 HE1 TRP 62 HE1 TRP 62 -4.502 -7.191 -12.433 506 HE3 TRP 62 HE3 TRP 62 -4.145 -2.212 -14.438 507 HZ2 TRP 62 HZ2 TRP 62 -4.926 -7.118 -15.218 508 HZ3 TRP 62 HZ3 TRP 62 -4.617 -3.085 -16.714 509 HH2 TRP 62 HH2 TRP 62 -4.998 -5.503 -17.095 510 H GLU 63 H GLU 63 -7.006 -3.374 -11.263 511 HA GLU 63 HA GLU 63 -7.403 -2.711 -8.412 512 HB2 GLU 63 HB2 GLU 63 -9.922 -3.070 -8.994 513 HB3 GLU 63 HB3 GLU 63 -9.189 -1.527 -9.454 514 HG2 GLU 63 HG2 GLU 63 -9.133 -3.683 -11.543 515 HG3 GLU 63 HG3 GLU 63 -10.729 -3.049 -11.120 516 H THR 64 H THR 64 -7.524 -4.480 -7.143 517 HA THR 64 HA THR 64 -8.100 -7.042 -8.442 518 HB THR 64 HB THR 64 -6.507 -7.829 -6.391 519 HG1 THR 64 HG1 THR 64 -5.308 -6.221 -5.670 520 HG21 THR 64 HG21 THR 64 -4.698 -8.066 -8.080 521 HG22 THR 64 HG22 THR 64 -6.303 -8.502 -8.756 522 HG23 THR 64 HG23 THR 64 -5.562 -6.916 -9.155 523 H THR 65 H THR 65 -9.310 -8.584 -7.173 524 HA THR 65 HA THR 65 -10.582 -7.346 -4.814 525 HB THR 65 HB THR 65 -11.561 -9.784 -6.339 526 HG1 THR 65 HG1 THR 65 -12.831 -8.206 -7.625 527 HG21 THR 65 HG21 THR 65 -13.757 -8.979 -5.552 528 HG22 THR 65 HG22 THR 65 -12.620 -9.241 -4.187 529 HG23 THR 65 HG23 THR 65 -12.960 -7.575 -4.765 530 H PHE 66 H PHE 66 -9.944 -8.070 -2.854 531 HA PHE 66 HA PHE 66 -8.580 -10.673 -2.711 532 HB2 PHE 66 HB2 PHE 66 -8.529 -8.376 -0.693 533 HB3 PHE 66 HB3 PHE 66 -7.508 -9.820 -0.697 534 HD1 PHE 66 HD1 PHE 66 -7.107 -9.590 -3.863 535 HD2 PHE 66 HD2 PHE 66 -6.580 -6.934 -0.531 536 HE1 PHE 66 HE1 PHE 66 -5.376 -8.353 -5.126 537 HE2 PHE 66 HE2 PHE 66 -4.845 -5.696 -1.791 538 HZ PHE 66 HZ PHE 66 -4.243 -6.399 -4.095 539 H LYS 67 H LYS 67 -8.818 -11.519 -0.216 540 HA LYS 67 HA LYS 67 -11.725 -11.506 0.270 541 HB2 LYS 67 HB2 LYS 67 -9.570 -13.635 0.466 542 HB3 LYS 67 HB3 LYS 67 -11.019 -13.753 1.472 543 HG2 LYS 67 HG2 LYS 67 -11.268 -15.062 -0.598 544 HG3 LYS 67 HG3 LYS 67 -12.457 -13.755 -0.531 545 HD2 LYS 67 HD2 LYS 67 -10.775 -12.352 -1.922 546 HD3 LYS 67 HD3 LYS 67 -9.886 -13.860 -2.179 547 HE2 LYS 67 HE2 LYS 67 -11.742 -14.888 -3.317 548 HE3 LYS 67 HE3 LYS 67 -12.872 -13.644 -2.769 549 HZ1 LYS 67 HZ1 LYS 67 -12.415 -12.582 -4.629 550 HZ2 LYS 67 HZ2 LYS 67 -10.874 -12.339 -4.146 551 HZ3 LYS 67 HZ3 LYS 67 -11.249 -13.644 -5.053 552 H LYS 68 H LYS 68 -12.498 -11.458 2.451 553 HA LYS 68 HA LYS 68 -11.062 -9.780 4.165 554 HB2 LYS 68 HB2 LYS 68 -13.565 -10.103 4.081 555 HB3 LYS 68 HB3 LYS 68 -13.360 -11.715 4.777 556 HG2 LYS 68 HG2 LYS 68 -13.961 -10.365 6.613 557 HG3 LYS 68 HG3 LYS 68 -12.210 -10.553 6.776 558 HD2 LYS 68 HD2 LYS 68 -12.600 -8.236 7.144 559 HD3 LYS 68 HD3 LYS 68 -11.977 -8.326 5.491 560 HE2 LYS 68 HE2 LYS 68 -13.871 -6.821 5.482 561 HE3 LYS 68 HE3 LYS 68 -14.352 -8.296 4.633 562 HZ1 LYS 68 HZ1 LYS 68 -15.934 -8.630 6.119 563 HZ2 LYS 68 HZ2 LYS 68 -14.936 -8.461 7.400 564 HZ3 LYS 68 HZ3 LYS 68 -15.641 -7.147 6.734 565 H THR 69 H THR 69 -9.272 -10.258 5.450 566 HA THR 69 HA THR 69 -9.280 -12.909 6.765 567 HB THR 69 HB THR 69 -6.761 -11.644 5.597 568 HG1 THR 69 HG1 THR 69 -7.974 -13.786 4.137 569 HG21 THR 69 HG21 THR 69 -5.938 -13.981 5.610 570 HG22 THR 69 HG22 THR 69 -6.491 -13.451 7.235 571 HG23 THR 69 HG23 THR 69 -7.528 -14.528 6.240 572 H SER 70 H SER 70 -9.939 -11.682 8.645 573 HA SER 70 HA SER 70 -8.444 -9.418 9.562 574 HB2 SER 70 HB2 SER 70 -10.127 -11.075 11.428 575 HB3 SER 70 HB3 SER 70 -10.065 -9.320 11.217 576 HG SER 70 HG SER 70 -12.063 -10.239 10.421 577 H ASP 71 H ASP 71 -6.353 -10.908 9.092 578 HA ASP 71 HA ASP 71 -5.624 -12.920 10.868 579 HB2 ASP 71 HB2 ASP 71 -4.512 -11.911 8.682 580 HB3 ASP 71 HB3 ASP 71 -3.691 -10.823 9.809 581 H ASP 72 H ASP 72 -4.579 -9.424 10.995 582 HA ASP 72 HA ASP 72 -4.654 -9.597 13.939 583 HB2 ASP 72 HB2 ASP 72 -2.304 -9.690 12.633 584 HB3 ASP 72 HB3 ASP 72 -2.580 -7.952 12.459 585 H GLY 73 H GLY 73 -6.694 -8.732 13.329 586 HA2 GLY 73 HA2 GLY 73 -8.317 -7.485 13.647 587 HA3 GLY 73 HA3 GLY 73 -7.254 -6.075 13.742 588 H GLU 74 H GLU 74 -6.625 -5.135 11.077 589 HA GLU 74 HA GLU 74 -9.111 -5.956 9.594 590 HB2 GLU 74 HB2 GLU 74 -7.966 -3.232 10.080 591 HB3 GLU 74 HB3 GLU 74 -8.451 -3.567 8.413 592 HG2 GLU 74 HG2 GLU 74 -10.509 -2.904 9.039 593 HG3 GLU 74 HG3 GLU 74 -10.655 -4.481 9.825 594 H VAL 75 H VAL 75 -7.252 -7.702 9.201 595 HA VAL 75 HA VAL 75 -5.319 -6.732 7.222 596 HB VAL 75 HB VAL 75 -5.675 -9.321 8.807 597 HG11 VAL 75 HG11 VAL 75 -3.636 -10.195 7.708 598 HG12 VAL 75 HG12 VAL 75 -4.988 -9.968 6.548 599 HG13 VAL 75 HG13 VAL 75 -3.640 -8.784 6.597 600 HG21 VAL 75 HG21 VAL 75 -3.412 -8.744 9.662 601 HG22 VAL 75 HG22 VAL 75 -3.423 -7.258 8.653 602 HG23 VAL 75 HG23 VAL 75 -4.609 -7.445 9.989 603 H TYR 76 H TYR 76 -5.027 -8.038 5.178 604 HA TYR 76 HA TYR 76 -7.457 -9.450 4.344 605 HB2 TYR 76 HB2 TYR 76 -6.156 -7.131 2.833 606 HB3 TYR 76 HB3 TYR 76 -7.437 -8.172 2.201 607 HD1 TYR 76 HD1 TYR 76 -9.722 -8.131 3.283 608 HD2 TYR 76 HD2 TYR 76 -6.654 -5.316 4.336 609 HE1 TYR 76 HE1 TYR 76 -11.428 -6.658 4.305 610 HE2 TYR 76 HE2 TYR 76 -8.358 -3.839 5.358 611 HH TYR 76 HH TYR 76 -10.501 -3.530 5.826 612 H TYR 77 H TYR 77 -7.138 -10.957 2.607 613 HA TYR 77 HA TYR 77 -4.315 -11.389 1.930 614 HB2 TYR 77 HB2 TYR 77 -6.355 -13.258 3.175 615 HB3 TYR 77 HB3 TYR 77 -5.218 -13.936 2.002 616 HD1 TYR 77 HD1 TYR 77 -4.920 -11.457 4.854 617 HD2 TYR 77 HD2 TYR 77 -3.482 -15.060 3.012 618 HE1 TYR 77 HE1 TYR 77 -3.206 -11.679 6.629 619 HE2 TYR 77 HE2 TYR 77 -1.774 -15.286 4.785 620 HH TYR 77 HH TYR 77 -1.640 -13.004 7.538 621 H SER 78 H SER 78 -3.944 -11.750 -0.273 622 HA SER 78 HA SER 78 -6.385 -12.295 -1.880 623 HB2 SER 78 HB2 SER 78 -5.066 -11.268 -3.738 624 HB3 SER 78 HB3 SER 78 -5.385 -10.133 -2.420 625 HG SER 78 HG SER 78 -3.173 -10.684 -1.613 626 H GLU 79 H GLU 79 -6.273 -14.620 -1.541 627 HA GLU 79 HA GLU 79 -3.931 -16.125 -1.843 628 HB2 GLU 79 HB2 GLU 79 -6.563 -16.574 -1.130 629 HB3 GLU 79 HB3 GLU 79 -6.561 -17.259 -2.760 630 HG2 GLU 79 HG2 GLU 79 -4.936 -18.123 -0.344 631 HG3 GLU 79 HG3 GLU 79 -6.095 -19.066 -1.290 632 H GLU 80 H GLU 80 -6.488 -15.119 -4.231 633 HA GLU 80 HA GLU 80 -5.484 -16.607 -6.388 634 HB2 GLU 80 HB2 GLU 80 -6.994 -13.942 -6.396 635 HB3 GLU 80 HB3 GLU 80 -6.856 -15.066 -7.755 636 HG2 GLU 80 HG2 GLU 80 -8.117 -16.783 -6.504 637 HG3 GLU 80 HG3 GLU 80 -8.196 -15.725 -5.088 638 H ALA 81 H ALA 81 -4.252 -13.651 -4.852 639 HA ALA 81 HA ALA 81 -2.598 -13.164 -7.226 640 HB1 ALA 81 HB1 ALA 81 -2.194 -10.940 -6.170 641 HB2 ALA 81 HB2 ALA 81 -3.939 -11.248 -6.464 642 HB3 ALA 81 HB3 ALA 81 -3.265 -11.413 -4.808 643 H LYS 82 H LYS 82 -2.432 -14.562 -4.033 644 HA LYS 82 HA LYS 82 -0.711 -15.456 -2.910 645 HB2 LYS 82 HB2 LYS 82 0.926 -14.603 -5.343 646 HB3 LYS 82 HB3 LYS 82 1.538 -15.588 -4.008 647 HG2 LYS 82 HG2 LYS 82 -0.921 -16.452 -5.577 648 HG3 LYS 82 HG3 LYS 82 0.707 -16.765 -6.194 649 HD2 LYS 82 HD2 LYS 82 1.260 -18.209 -4.410 650 HD3 LYS 82 HD3 LYS 82 0.049 -17.511 -3.327 651 HE2 LYS 82 HE2 LYS 82 -0.756 -18.995 -5.867 652 HE3 LYS 82 HE3 LYS 82 -0.420 -19.860 -4.362 653 HZ1 LYS 82 HZ1 LYS 82 -2.722 -19.370 -4.490 654 HZ2 LYS 82 HZ2 LYS 82 -2.104 -18.429 -3.307 655 HZ3 LYS 82 HZ3 LYS 82 -2.469 -17.780 -4.760 656 H LYS 83 H LYS 83 -1.606 -12.887 -2.212 657 HA LYS 83 HA LYS 83 0.854 -11.743 -1.151 658 HB2 LYS 83 HB2 LYS 83 -1.239 -9.928 -2.411 659 HB3 LYS 83 HB3 LYS 83 0.430 -9.549 -1.964 660 HG2 LYS 83 HG2 LYS 83 1.326 -10.535 -3.894 661 HG3 LYS 83 HG3 LYS 83 -0.060 -11.608 -4.127 662 HD2 LYS 83 HD2 LYS 83 -1.417 -9.356 -4.468 663 HD3 LYS 83 HD3 LYS 83 0.176 -8.640 -4.744 664 HE2 LYS 83 HE2 LYS 83 0.632 -10.280 -6.550 665 HE3 LYS 83 HE3 LYS 83 -0.916 -11.079 -6.244 666 HZ1 LYS 83 HZ1 LYS 83 -1.005 -9.505 -8.081 667 HZ2 LYS 83 HZ2 LYS 83 -2.038 -9.071 -6.892 668 HZ3 LYS 83 HZ3 LYS 83 -0.631 -8.264 -7.088 669 H LYS 84 H LYS 84 0.576 -10.934 0.924 670 HA LYS 84 HA LYS 84 -2.208 -10.766 1.887 671 HB2 LYS 84 HB2 LYS 84 -1.403 -11.597 4.052 672 HB3 LYS 84 HB3 LYS 84 -1.131 -12.785 2.771 673 HG2 LYS 84 HG2 LYS 84 1.230 -12.386 2.743 674 HG3 LYS 84 HG3 LYS 84 1.075 -10.883 3.662 675 HD2 LYS 84 HD2 LYS 84 1.847 -12.472 5.254 676 HD3 LYS 84 HD3 LYS 84 0.117 -12.317 5.590 677 HE2 LYS 84 HE2 LYS 84 -0.226 -14.356 4.031 678 HE3 LYS 84 HE3 LYS 84 1.530 -14.566 4.078 679 HZ1 LYS 84 HZ1 LYS 84 0.420 -15.878 5.755 680 HZ2 LYS 84 HZ2 LYS 84 1.381 -14.770 6.472 681 HZ3 LYS 84 HZ3 LYS 84 -0.237 -14.552 6.443 682 H VAL 85 H VAL 85 -2.684 -8.970 3.300 683 HA VAL 85 HA VAL 85 -0.388 -7.159 3.745 684 HB VAL 85 HB VAL 85 -2.043 -5.258 3.374 685 HG11 VAL 85 HG11 VAL 85 -1.937 -5.332 0.884 686 HG12 VAL 85 HG12 VAL 85 -0.394 -5.850 1.644 687 HG13 VAL 85 HG13 VAL 85 -1.519 -7.077 0.969 688 HG21 VAL 85 HG21 VAL 85 -4.078 -5.674 2.010 689 HG22 VAL 85 HG22 VAL 85 -3.793 -7.442 2.142 690 HG23 VAL 85 HG23 VAL 85 -4.156 -6.479 3.614 691 H GLU 86 H GLU 86 -0.322 -6.361 5.837 692 HA GLU 86 HA GLU 86 -2.699 -6.771 7.521 693 HB2 GLU 86 HB2 GLU 86 -1.021 -7.391 9.361 694 HB3 GLU 86 HB3 GLU 86 -1.318 -8.618 8.122 695 HG2 GLU 86 HG2 GLU 86 0.795 -7.860 6.947 696 HG3 GLU 86 HG3 GLU 86 1.104 -6.764 8.301 697 H VAL 87 H VAL 87 -3.354 -4.872 8.328 698 HA VAL 87 HA VAL 87 -1.724 -2.558 8.174 699 HB VAL 87 HB VAL 87 -4.121 -2.354 8.007 700 HG11 VAL 87 HG11 VAL 87 -5.653 -2.866 9.895 701 HG12 VAL 87 HG12 VAL 87 -4.802 -4.330 9.295 702 HG13 VAL 87 HG13 VAL 87 -4.270 -3.543 10.820 703 HG21 VAL 87 HG21 VAL 87 -4.604 -0.659 9.753 704 HG22 VAL 87 HG22 VAL 87 -3.161 -1.209 10.670 705 HG23 VAL 87 HG23 VAL 87 -2.963 -0.462 9.049 706 H LEU 88 H LEU 88 0.068 -2.288 9.498 707 HA LEU 88 HA LEU 88 0.297 -3.704 11.982 708 HB2 LEU 88 HB2 LEU 88 1.931 -1.417 10.768 709 HB3 LEU 88 HB3 LEU 88 2.409 -2.389 12.166 710 HG LEU 88 HG LEU 88 2.043 -3.421 9.322 711 HD11 LEU 88 HD11 LEU 88 4.498 -3.682 9.346 712 HD12 LEU 88 HD12 LEU 88 3.999 -1.967 9.538 713 HD13 LEU 88 HD13 LEU 88 4.560 -2.905 10.964 714 HD21 LEU 88 HD21 LEU 88 3.070 -5.499 10.190 715 HD22 LEU 88 HD22 LEU 88 3.058 -4.806 11.847 716 HD23 LEU 88 HD23 LEU 88 1.509 -5.132 10.998 717 H ASP 89 H ASP 89 -0.138 -0.189 11.019 718 HA ASP 89 HA ASP 89 -1.685 0.236 13.412 719 HB2 ASP 89 HB2 ASP 89 0.772 0.465 14.122 720 HB3 ASP 89 HB3 ASP 89 0.843 1.889 13.076 721 H THR 90 H THR 90 -2.986 2.160 13.206 722 HA THR 90 HA THR 90 -2.477 3.902 10.955 723 HB THR 90 HB THR 90 -3.733 1.912 10.040 724 HG1 THR 90 HG1 THR 90 -4.702 3.262 8.668 725 HG21 THR 90 HG21 THR 90 -6.153 1.745 10.555 726 HG22 THR 90 HG22 THR 90 -5.131 1.411 11.993 727 HG23 THR 90 HG23 THR 90 -5.959 2.996 11.828 728 H ASP 91 H ASP 91 -3.392 5.969 11.242 729 HA ASP 91 HA ASP 91 -4.747 6.324 13.833 730 HB2 ASP 91 HB2 ASP 91 -2.592 7.559 13.353 731 HB3 ASP 91 HB3 ASP 91 -3.417 8.394 12.031 732 H TYR 92 H TYR 92 -6.849 7.202 13.897 733 HA TYR 92 HA TYR 92 -8.403 6.977 11.580 734 HB2 TYR 92 HB2 TYR 92 -8.909 8.328 14.273 735 HB3 TYR 92 HB3 TYR 92 -10.143 8.160 13.018 736 HD1 TYR 92 HD1 TYR 92 -10.811 5.813 12.256 737 HD2 TYR 92 HD2 TYR 92 -8.374 6.494 15.726 738 HE1 TYR 92 HE1 TYR 92 -11.343 3.538 13.074 739 HE2 TYR 92 HE2 TYR 92 -8.903 4.218 16.548 740 HH TYR 92 HH TYR 92 -11.054 2.029 14.659 741 H LYS 93 H LYS 93 -6.628 9.784 12.952 742 HA LYS 93 HA LYS 93 -7.571 11.308 10.633 743 HB2 LYS 93 HB2 LYS 93 -7.067 12.408 13.423 744 HB3 LYS 93 HB3 LYS 93 -7.584 13.324 12.002 745 HG2 LYS 93 HG2 LYS 93 -9.723 12.107 11.931 746 HG3 LYS 93 HG3 LYS 93 -9.204 11.043 13.244 747 HD2 LYS 93 HD2 LYS 93 -8.951 13.086 14.730 748 HD3 LYS 93 HD3 LYS 93 -9.611 14.074 13.420 749 HE2 LYS 93 HE2 LYS 93 -11.065 11.686 14.667 750 HE3 LYS 93 HE3 LYS 93 -11.301 13.364 15.175 751 HZ1 LYS 93 HZ1 LYS 93 -12.949 12.682 13.583 752 HZ2 LYS 93 HZ2 LYS 93 -12.033 13.868 12.935 753 HZ3 LYS 93 HZ3 LYS 93 -11.815 12.320 12.466 754 H SER 94 H SER 94 -4.989 9.629 11.182 755 HA SER 94 HA SER 94 -3.233 11.849 10.367 756 HB2 SER 94 HB2 SER 94 -2.977 11.447 12.873 757 HB3 SER 94 HB3 SER 94 -2.641 9.740 12.553 758 HG SER 94 HG SER 94 -0.610 10.279 12.252 759 H TYR 95 H TYR 95 -0.904 9.844 10.648 760 HA TYR 95 HA TYR 95 -1.205 8.759 7.985 761 HB2 TYR 95 HB2 TYR 95 1.173 8.194 8.261 762 HB3 TYR 95 HB3 TYR 95 0.906 9.856 8.804 763 HD1 TYR 95 HD1 TYR 95 1.621 6.383 9.911 764 HD2 TYR 95 HD2 TYR 95 1.104 10.458 11.170 765 HE1 TYR 95 HE1 TYR 95 2.565 5.816 12.127 766 HE2 TYR 95 HE2 TYR 95 2.062 9.896 13.383 767 HH TYR 95 HH TYR 95 2.279 7.855 14.826 768 H ALA 96 H ALA 96 -0.324 6.412 7.622 769 HA ALA 96 HA ALA 96 -0.885 4.627 9.844 770 HB1 ALA 96 HB1 ALA 96 -2.437 3.284 8.496 771 HB2 ALA 96 HB2 ALA 96 -3.076 4.928 8.838 772 HB3 ALA 96 HB3 ALA 96 -2.405 4.544 7.216 773 H VAL 97 H VAL 97 0.066 2.499 9.592 774 HA VAL 97 HA VAL 97 1.800 2.310 7.221 775 HB VAL 97 HB VAL 97 3.456 1.120 8.701 776 HG11 VAL 97 HG11 VAL 97 4.397 3.200 9.660 777 HG12 VAL 97 HG12 VAL 97 3.790 3.446 7.988 778 HG13 VAL 97 HG13 VAL 97 2.827 4.029 9.387 779 HG21 VAL 97 HG21 VAL 97 3.353 1.527 11.136 780 HG22 VAL 97 HG22 VAL 97 1.736 2.282 10.937 781 HG23 VAL 97 HG23 VAL 97 1.967 0.542 10.558 782 H ILE 98 H ILE 98 1.378 0.445 6.040 783 HA ILE 98 HA ILE 98 0.080 -1.745 7.516 784 HB ILE 98 HB ILE 98 -0.131 -1.196 4.519 785 HG12 ILE 98 HG12 ILE 98 -1.041 0.765 5.618 786 HG13 ILE 98 HG13 ILE 98 -2.361 -0.210 4.956 787 HG21 ILE 98 HG21 ILE 98 -2.136 -2.641 4.702 788 HG22 ILE 98 HG22 ILE 98 -0.645 -3.486 5.240 789 HG23 ILE 98 HG23 ILE 98 -1.810 -2.859 6.455 790 HD11 ILE 98 HD11 ILE 98 -2.932 0.660 7.178 791 HD12 ILE 98 HD12 ILE 98 -2.827 -1.132 7.209 792 HD13 ILE 98 HD13 ILE 98 -1.487 -0.143 7.880 793 H TYR 99 H TYR 99 0.909 -3.866 7.204 794 HA TYR 99 HA TYR 99 3.530 -3.944 5.871 795 HB2 TYR 99 HB2 TYR 99 3.178 -4.708 8.288 796 HB3 TYR 99 HB3 TYR 99 2.154 -6.007 7.662 797 HD1 TYR 99 HD1 TYR 99 5.620 -4.585 7.428 798 HD2 TYR 99 HD2 TYR 99 3.125 -8.042 6.914 799 HE1 TYR 99 HE1 TYR 99 7.631 -5.976 7.054 800 HE2 TYR 99 HE2 TYR 99 5.135 -9.436 6.540 801 HH TYR 99 HH TYR 99 7.335 -9.447 6.191 802 H ALA 100 H ALA 100 3.878 -5.323 4.072 803 HA ALA 100 HA ALA 100 1.572 -6.937 3.227 804 HB1 ALA 100 HB1 ALA 100 1.995 -6.207 0.895 805 HB2 ALA 100 HB2 ALA 100 1.512 -4.840 1.955 806 HB3 ALA 100 HB3 ALA 100 3.234 -5.052 1.491 807 H THR 101 H THR 101 2.058 -8.906 2.264 808 HA THR 101 HA THR 101 4.857 -9.461 1.696 809 HB THR 101 HB THR 101 3.124 -11.106 3.618 810 HG1 THR 101 HG1 THR 101 5.716 -9.946 4.157 811 HG21 THR 101 HG21 THR 101 5.121 -12.552 3.848 812 HG22 THR 101 HG22 THR 101 4.498 -12.545 2.163 813 HG23 THR 101 HG23 THR 101 5.960 -11.590 2.585 814 H ARG 102 H ARG 102 5.135 -11.101 0.113 815 HA ARG 102 HA ARG 102 2.687 -12.416 -0.870 816 HB2 ARG 102 HB2 ARG 102 3.530 -11.996 -3.187 817 HB3 ARG 102 HB3 ARG 102 2.981 -10.540 -2.346 818 HG2 ARG 102 HG2 ARG 102 5.143 -9.664 -2.139 819 HG3 ARG 102 HG3 ARG 102 5.918 -11.250 -2.233 820 HD2 ARG 102 HD2 ARG 102 5.844 -9.477 -4.306 821 HD3 ARG 102 HD3 ARG 102 6.006 -11.226 -4.515 822 HE ARG 102 HE ARG 102 3.242 -10.173 -4.466 823 HH11 ARG 102 HH11 ARG 102 6.016 -10.638 -6.536 824 HH12 ARG 102 HH12 ARG 102 5.087 -11.186 -7.891 825 HH21 ARG 102 HH21 ARG 102 2.020 -11.116 -6.201 826 HH22 ARG 102 HH22 ARG 102 2.816 -11.458 -7.701 827 H VAL 103 H VAL 103 3.095 -14.640 -1.307 828 HA VAL 103 HA VAL 103 5.946 -15.353 -1.256 829 HB VAL 103 HB VAL 103 3.560 -17.025 -0.315 830 HG11 VAL 103 HG11 VAL 103 5.289 -18.516 0.640 831 HG12 VAL 103 HG12 VAL 103 5.426 -18.380 -1.146 832 HG13 VAL 103 HG13 VAL 103 6.568 -17.486 -0.087 833 HG21 VAL 103 HG21 VAL 103 4.535 -16.666 1.979 834 HG22 VAL 103 HG22 VAL 103 5.583 -15.431 1.261 835 HG23 VAL 103 HG23 VAL 103 3.827 -15.198 1.226 836 H LYS 104 H LYS 104 6.718 -16.586 -2.897 837 HA LYS 104 HA LYS 104 4.814 -17.629 -4.883 838 HB2 LYS 104 HB2 LYS 104 6.267 -15.664 -5.564 839 HB3 LYS 104 HB3 LYS 104 7.673 -16.713 -5.341 840 HG2 LYS 104 HG2 LYS 104 6.990 -16.619 -7.711 841 HG3 LYS 104 HG3 LYS 104 6.849 -18.262 -7.070 842 HD2 LYS 104 HD2 LYS 104 4.429 -18.037 -6.817 843 HD3 LYS 104 HD3 LYS 104 4.494 -16.310 -7.191 844 HE2 LYS 104 HE2 LYS 104 3.728 -17.636 -9.144 845 HE3 LYS 104 HE3 LYS 104 5.237 -16.781 -9.490 846 HZ1 LYS 104 HZ1 LYS 104 5.040 -19.217 -10.126 847 HZ2 LYS 104 HZ2 LYS 104 6.423 -18.740 -9.402 848 HZ3 LYS 104 HZ3 LYS 104 5.293 -19.555 -8.549 849 H ASP 105 H ASP 105 5.637 -19.639 -6.020 850 HA ASP 105 HA ASP 105 6.145 -21.687 -4.417 851 HB2 ASP 105 HB2 ASP 105 7.426 -21.355 -7.190 852 HB3 ASP 105 HB3 ASP 105 7.073 -22.889 -6.383 853 H GLY 106 H GLY 106 7.612 -21.533 -2.664 854 HA2 GLY 106 HA2 GLY 106 9.658 -22.096 -1.835 855 HA3 GLY 106 HA3 GLY 106 10.359 -21.978 -3.454 856 H ARG 107 H ARG 107 8.664 -19.022 -2.957 857 HA ARG 107 HA ARG 107 10.969 -17.827 -1.582 858 HB2 ARG 107 HB2 ARG 107 11.438 -17.765 -4.035 859 HB3 ARG 107 HB3 ARG 107 9.871 -16.999 -4.325 860 HG2 ARG 107 HG2 ARG 107 10.548 -14.939 -3.449 861 HG3 ARG 107 HG3 ARG 107 11.796 -15.656 -2.421 862 HD2 ARG 107 HD2 ARG 107 11.983 -15.775 -5.462 863 HD3 ARG 107 HD3 ARG 107 12.540 -14.358 -4.562 864 HE ARG 107 HE ARG 107 13.922 -16.200 -3.253 865 HH11 ARG 107 HH11 ARG 107 13.235 -16.160 -6.703 866 HH12 ARG 107 HH12 ARG 107 14.705 -16.971 -7.127 867 HH21 ARG 107 HH21 ARG 107 15.850 -17.248 -3.825 868 HH22 ARG 107 HH22 ARG 107 16.194 -17.590 -5.488 869 H THR 108 H THR 108 10.441 -16.218 -0.198 870 HA THR 108 HA THR 108 7.680 -15.225 -0.319 871 HB THR 108 HB THR 108 9.453 -15.231 2.138 872 HG1 THR 108 HG1 THR 108 8.358 -17.282 2.641 873 HG21 THR 108 HG21 THR 108 7.353 -15.122 3.320 874 HG22 THR 108 HG22 THR 108 7.378 -13.838 2.064 875 HG23 THR 108 HG23 THR 108 6.454 -15.328 1.807 876 H LEU 109 H LEU 109 7.339 -12.973 -0.591 877 HA LEU 109 HA LEU 109 9.773 -11.339 -0.209 878 HB2 LEU 109 HB2 LEU 109 9.176 -11.571 -2.583 879 HB3 LEU 109 HB3 LEU 109 7.519 -11.056 -2.241 880 HG LEU 109 HG LEU 109 8.363 -8.822 -1.547 881 HD11 LEU 109 HD11 LEU 109 10.692 -8.189 -2.074 882 HD12 LEU 109 HD12 LEU 109 10.609 -9.464 -0.812 883 HD13 LEU 109 HD13 LEU 109 11.055 -9.897 -2.497 884 HD21 LEU 109 HD21 LEU 109 8.960 -8.045 -3.820 885 HD22 LEU 109 HD22 LEU 109 9.238 -9.746 -4.322 886 HD23 LEU 109 HD23 LEU 109 7.592 -9.209 -3.844 887 H HIS 110 H HIS 110 9.529 -9.438 1.012 888 HA HIS 110 HA HIS 110 6.811 -9.002 2.116 889 HB2 HIS 110 HB2 HIS 110 9.579 -8.555 3.349 890 HB3 HIS 110 HB3 HIS 110 8.063 -7.995 4.068 891 HD2 HIS 110 HD2 HIS 110 10.333 -11.031 4.189 892 HE1 HIS 110 HE1 HIS 110 6.532 -12.357 5.631 893 H MET 111 H MET 111 6.182 -6.735 2.255 894 HA MET 111 HA MET 111 8.033 -4.708 1.277 895 HB2 MET 111 HB2 MET 111 7.179 -5.607 -0.814 896 HB3 MET 111 HB3 MET 111 5.522 -5.629 -0.195 897 HG2 MET 111 HG2 MET 111 5.515 -3.150 -0.124 898 HG3 MET 111 HG3 MET 111 7.172 -3.127 -0.741 899 HE1 MET 111 HE1 MET 111 7.152 -3.514 -4.262 900 HE2 MET 111 HE2 MET 111 7.982 -3.848 -2.704 901 HE3 MET 111 HE3 MET 111 7.162 -5.179 -3.588 902 H MET 112 H MET 112 7.754 -3.085 2.776 903 HA MET 112 HA MET 112 5.207 -3.062 4.241 904 HB2 MET 112 HB2 MET 112 7.868 -1.534 4.507 905 HB3 MET 112 HB3 MET 112 6.459 -1.197 5.521 906 HG2 MET 112 HG2 MET 112 6.555 -3.660 6.238 907 HG3 MET 112 HG3 MET 112 8.128 -3.736 5.432 908 HE1 MET 112 HE1 MET 112 10.155 -1.001 7.520 909 HE2 MET 112 HE2 MET 112 10.277 -2.230 6.216 910 HE3 MET 112 HE3 MET 112 9.235 -0.785 5.992 911 H ARG 113 H ARG 113 3.775 -1.250 4.162 912 HA ARG 113 HA ARG 113 4.447 0.805 2.148 913 HB2 ARG 113 HB2 ARG 113 2.648 -1.320 1.759 914 HB3 ARG 113 HB3 ARG 113 1.592 -0.039 2.369 915 HG2 ARG 113 HG2 ARG 113 1.497 0.768 0.272 916 HG3 ARG 113 HG3 ARG 113 3.183 1.271 0.453 917 HD2 ARG 113 HD2 ARG 113 3.196 -0.034 -1.522 918 HD3 ARG 113 HD3 ARG 113 3.821 -1.136 -0.288 919 HE ARG 113 HE ARG 113 0.978 -1.185 -1.246 920 HH11 ARG 113 HH11 ARG 113 3.908 -2.808 -0.196 921 HH12 ARG 113 HH12 ARG 113 3.229 -4.396 -0.327 922 HH21 ARG 113 HH21 ARG 113 0.057 -3.269 -1.323 923 HH22 ARG 113 HH22 ARG 113 1.027 -4.660 -0.971 924 H LEU 114 H LEU 114 3.848 2.877 2.690 925 HA LEU 114 HA LEU 114 2.336 3.173 5.210 926 HB2 LEU 114 HB2 LEU 114 4.796 3.614 5.452 927 HB3 LEU 114 HB3 LEU 114 4.642 4.870 4.251 928 HG LEU 114 HG LEU 114 3.093 4.899 6.843 929 HD11 LEU 114 HD11 LEU 114 4.774 6.535 7.647 930 HD12 LEU 114 HD12 LEU 114 5.503 4.925 7.327 931 HD13 LEU 114 HD13 LEU 114 5.738 6.265 6.156 932 HD21 LEU 114 HD21 LEU 114 2.836 7.310 6.351 933 HD22 LEU 114 HD22 LEU 114 3.716 7.081 4.802 934 HD23 LEU 114 HD23 LEU 114 2.130 6.279 5.061 935 H TYR 115 H TYR 115 0.513 4.435 5.008 936 HA TYR 115 HA TYR 115 0.412 6.145 2.613 937 HB2 TYR 115 HB2 TYR 115 -1.884 5.637 2.305 938 HB3 TYR 115 HB3 TYR 115 -1.011 4.104 2.422 939 HD1 TYR 115 HD1 TYR 115 -1.267 2.660 4.448 940 HD2 TYR 115 HD2 TYR 115 -3.557 6.260 3.942 941 HE1 TYR 115 HE1 TYR 115 -2.854 1.894 6.186 942 HE2 TYR 115 HE2 TYR 115 -5.150 5.492 5.673 943 HH TYR 115 HH TYR 115 -5.021 2.220 6.987 944 H SER 116 H SER 116 -0.857 8.107 2.792 945 HA SER 116 HA SER 116 -1.149 8.993 5.593 946 HB2 SER 116 HB2 SER 116 -0.097 10.540 3.174 947 HB3 SER 116 HB3 SER 116 -0.523 11.277 4.724 948 HG SER 116 HG SER 116 1.707 10.833 4.724 949 H ARG 117 H ARG 117 -2.859 10.686 5.888 950 HA ARG 117 HA ARG 117 -5.222 9.869 4.671 951 HB2 ARG 117 HB2 ARG 117 -4.301 12.200 6.378 952 HB3 ARG 117 HB3 ARG 117 -5.869 12.361 5.576 953 HG2 ARG 117 HG2 ARG 117 -6.376 10.001 6.628 954 HG3 ARG 117 HG3 ARG 117 -5.011 10.365 7.691 955 HD2 ARG 117 HD2 ARG 117 -7.117 11.058 8.746 956 HD3 ARG 117 HD3 ARG 117 -6.105 12.470 8.417 957 HE ARG 117 HE ARG 117 -7.602 13.130 6.679 958 HH11 ARG 117 HH11 ARG 117 -8.657 10.186 8.294 959 HH12 ARG 117 HH12 ARG 117 -10.274 10.287 7.680 960 HH21 ARG 117 HH21 ARG 117 -9.729 13.252 5.894 961 HH22 ARG 117 HH22 ARG 117 -10.883 12.031 6.314 962 H SER 118 H SER 118 -2.787 12.241 3.526 963 HA SER 118 HA SER 118 -4.522 12.694 1.186 964 HB2 SER 118 HB2 SER 118 -2.926 14.920 2.516 965 HB3 SER 118 HB3 SER 118 -4.117 15.047 1.215 966 HG SER 118 HG SER 118 -4.996 15.677 3.284 967 HA PRO 119 HA PRO 119 -0.576 12.039 -0.830 968 HB2 PRO 119 HB2 PRO 119 -0.586 13.891 -2.902 969 HB3 PRO 119 HB3 PRO 119 -1.670 12.493 -2.929 970 HG2 PRO 119 HG2 PRO 119 -2.256 15.354 -2.146 971 HG3 PRO 119 HG3 PRO 119 -3.248 14.226 -3.080 972 HD2 PRO 119 HD2 PRO 119 -3.705 14.749 -0.413 973 HD3 PRO 119 HD3 PRO 119 -4.125 13.204 -1.165 974 H GLU 120 H GLU 120 0.390 12.891 1.284 975 HA GLU 120 HA GLU 120 2.506 14.634 0.554 976 HB2 GLU 120 HB2 GLU 120 2.047 16.414 2.210 977 HB3 GLU 120 HB3 GLU 120 0.950 16.429 0.823 978 HG2 GLU 120 HG2 GLU 120 -0.716 15.135 2.303 979 HG3 GLU 120 HG3 GLU 120 0.355 15.502 3.662 980 H VAL 121 H VAL 121 4.231 13.738 1.610 981 HA VAL 121 HA VAL 121 3.710 11.827 3.676 982 HB VAL 121 HB VAL 121 6.270 13.220 2.656 983 HG11 VAL 121 HG11 VAL 121 7.553 11.324 3.659 984 HG12 VAL 121 HG12 VAL 121 6.668 12.286 4.891 985 HG13 VAL 121 HG13 VAL 121 6.028 10.692 4.366 986 HG21 VAL 121 HG21 VAL 121 6.747 11.155 1.392 987 HG22 VAL 121 HG22 VAL 121 5.162 10.490 1.911 988 HG23 VAL 121 HG23 VAL 121 5.225 11.956 0.876 989 H SER 122 H SER 122 3.919 12.115 5.865 990 HA SER 122 HA SER 122 4.500 14.819 6.833 991 HB2 SER 122 HB2 SER 122 3.266 13.936 8.891 992 HB3 SER 122 HB3 SER 122 2.287 14.135 7.432 993 HG SER 122 HG SER 122 1.919 12.078 8.471 994 HA PRO 123 HA PRO 123 8.316 13.520 8.676 995 HB2 PRO 123 HB2 PRO 123 8.089 15.139 11.015 996 HB3 PRO 123 HB3 PRO 123 8.760 15.715 9.484 997 HG2 PRO 123 HG2 PRO 123 5.983 16.072 10.609 998 HG3 PRO 123 HG3 PRO 123 6.969 17.208 9.680 999 HD2 PRO 123 HD2 PRO 123 4.930 15.882 8.498 1000 HD3 PRO 123 HD3 PRO 123 6.424 16.197 7.605 1001 H ALA 124 H ALA 124 5.347 13.726 10.759 1002 HA ALA 124 HA ALA 124 6.305 12.106 12.818 1003 HB1 ALA 124 HB1 ALA 124 3.907 11.747 13.321 1004 HB2 ALA 124 HB2 ALA 124 4.272 13.472 12.980 1005 HB3 ALA 124 HB3 ALA 124 3.473 12.460 11.731 1006 H ALA 125 H ALA 125 4.484 11.197 9.770 1007 HA ALA 125 HA ALA 125 4.385 8.442 10.412 1008 HB1 ALA 125 HB1 ALA 125 3.836 8.181 8.019 1009 HB2 ALA 125 HB2 ALA 125 2.895 9.511 8.775 1010 HB3 ALA 125 HB3 ALA 125 4.302 9.891 7.726 1011 H THR 126 H THR 126 6.755 10.545 8.677 1012 HA THR 126 HA THR 126 8.318 8.513 7.580 1013 HB THR 126 HB THR 126 9.178 11.272 8.601 1014 HG1 THR 126 HG1 THR 126 7.492 11.619 7.146 1015 HG21 THR 126 HG21 THR 126 10.905 11.112 6.829 1016 HG22 THR 126 HG22 THR 126 11.066 9.792 8.037 1017 HG23 THR 126 HG23 THR 126 10.336 9.456 6.431 1018 H ALA 127 H ALA 127 8.779 10.416 10.693 1019 HA ALA 127 HA ALA 127 11.042 8.975 11.505 1020 HB1 ALA 127 HB1 ALA 127 10.551 9.964 13.729 1021 HB2 ALA 127 HB2 ALA 127 10.429 11.177 12.409 1022 HB3 ALA 127 HB3 ALA 127 8.938 10.482 13.131 1023 H ILE 128 H ILE 128 7.510 8.351 11.986 1024 HA ILE 128 HA ILE 128 7.918 6.354 13.948 1025 HB ILE 128 HB ILE 128 5.583 6.948 12.084 1026 HG12 ILE 128 HG12 ILE 128 6.058 8.712 13.711 1027 HG13 ILE 128 HG13 ILE 128 4.562 7.870 14.137 1028 HG21 ILE 128 HG21 ILE 128 4.246 5.482 13.557 1029 HG22 ILE 128 HG22 ILE 128 5.544 4.577 12.708 1030 HG23 ILE 128 HG23 ILE 128 5.738 5.013 14.439 1031 HD11 ILE 128 HD11 ILE 128 5.915 8.334 16.133 1032 HD12 ILE 128 HD12 ILE 128 5.774 6.564 15.862 1033 HD13 ILE 128 HD13 ILE 128 7.292 7.420 15.430 1034 H PHE 129 H PHE 129 7.315 6.213 10.335 1035 HA PHE 129 HA PHE 129 7.314 3.441 10.120 1036 HB2 PHE 129 HB2 PHE 129 6.668 5.173 8.377 1037 HB3 PHE 129 HB3 PHE 129 8.390 5.468 8.106 1038 HD1 PHE 129 HD1 PHE 129 5.664 2.974 7.787 1039 HD2 PHE 129 HD2 PHE 129 9.748 3.920 6.861 1040 HE1 PHE 129 HE1 PHE 129 5.723 1.108 6.163 1041 HE2 PHE 129 HE2 PHE 129 9.815 2.052 5.236 1042 HZ PHE 129 HZ PHE 129 7.801 0.643 4.881 1043 H ARG 130 H ARG 130 10.079 5.793 10.272 1044 HA ARG 130 HA ARG 130 12.009 3.875 9.504 1045 HB2 ARG 130 HB2 ARG 130 12.306 6.365 9.391 1046 HB3 ARG 130 HB3 ARG 130 12.377 6.412 11.157 1047 HG2 ARG 130 HG2 ARG 130 14.308 4.637 10.894 1048 HG3 ARG 130 HG3 ARG 130 14.357 5.173 9.209 1049 HD2 ARG 130 HD2 ARG 130 14.657 6.978 11.663 1050 HD3 ARG 130 HD3 ARG 130 15.981 6.405 10.639 1051 HE ARG 130 HE ARG 130 14.833 7.675 8.760 1052 HH11 ARG 130 HH11 ARG 130 14.405 8.579 12.129 1053 HH12 ARG 130 HH12 ARG 130 14.023 10.229 11.765 1054 HH21 ARG 130 HH21 ARG 130 14.334 9.841 8.295 1055 HH22 ARG 130 HH22 ARG 130 13.983 10.947 9.581 1056 H LYS 131 H LYS 131 10.699 4.997 12.716 1057 HA LYS 131 HA LYS 131 12.536 3.812 14.388 1058 HB2 LYS 131 HB2 LYS 131 9.513 4.152 14.631 1059 HB3 LYS 131 HB3 LYS 131 10.527 3.564 15.955 1060 HG2 LYS 131 HG2 LYS 131 11.855 5.691 15.853 1061 HG3 LYS 131 HG3 LYS 131 10.788 6.278 14.571 1062 HD2 LYS 131 HD2 LYS 131 8.838 6.173 16.083 1063 HD3 LYS 131 HD3 LYS 131 9.825 5.446 17.358 1064 HE2 LYS 131 HE2 LYS 131 11.304 7.522 17.301 1065 HE3 LYS 131 HE3 LYS 131 10.161 8.246 16.161 1066 HZ1 LYS 131 HZ1 LYS 131 9.702 8.907 18.414 1067 HZ2 LYS 131 HZ2 LYS 131 8.449 8.029 17.846 1068 HZ3 LYS 131 HZ3 LYS 131 9.504 7.361 18.898 1069 H LEU 132 H LEU 132 9.607 2.294 12.801 1070 HA LEU 132 HA LEU 132 10.082 -0.251 14.010 1071 HB2 LEU 132 HB2 LEU 132 8.478 0.571 11.550 1072 HB3 LEU 132 HB3 LEU 132 8.430 -1.022 12.317 1073 HG LEU 132 HG LEU 132 7.582 1.596 13.631 1074 HD11 LEU 132 HD11 LEU 132 5.289 0.692 13.414 1075 HD12 LEU 132 HD12 LEU 132 6.069 0.936 11.815 1076 HD13 LEU 132 HD13 LEU 132 5.936 -0.716 12.507 1077 HD21 LEU 132 HD21 LEU 132 6.647 0.139 15.395 1078 HD22 LEU 132 HD22 LEU 132 7.353 -1.296 14.577 1079 HD23 LEU 132 HD23 LEU 132 8.430 -0.031 15.258 1080 H ALA 133 H ALA 133 10.826 1.281 10.783 1081 HA ALA 133 HA ALA 133 11.841 -0.953 9.501 1082 HB1 ALA 133 HB1 ALA 133 13.089 0.690 8.134 1083 HB2 ALA 133 HB2 ALA 133 11.390 1.204 8.408 1084 HB3 ALA 133 HB3 ALA 133 12.722 1.968 9.341 1085 H GLY 134 H GLY 134 13.489 1.339 11.826 1086 HA2 GLY 134 HA2 GLY 134 16.064 0.216 11.479 1087 HA3 GLY 134 HA3 GLY 134 15.498 1.219 12.821 1088 H GLU 135 H GLU 135 13.194 -0.668 13.462 1089 HA GLU 135 HA GLU 135 14.531 -2.253 15.369 1090 HB2 GLU 135 HB2 GLU 135 12.123 -1.322 15.342 1091 HB3 GLU 135 HB3 GLU 135 11.725 -2.648 14.240 1092 HG2 GLU 135 HG2 GLU 135 12.588 -4.260 16.018 1093 HG3 GLU 135 HG3 GLU 135 12.720 -2.877 17.113 1094 H ARG 136 H ARG 136 13.682 -2.784 11.934 1095 HA ARG 136 HA ARG 136 14.237 -5.644 12.264 1096 HB2 ARG 136 HB2 ARG 136 12.951 -3.956 10.072 1097 HB3 ARG 136 HB3 ARG 136 13.489 -5.613 9.768 1098 HG2 ARG 136 HG2 ARG 136 11.490 -6.325 10.504 1099 HG3 ARG 136 HG3 ARG 136 11.956 -5.808 12.130 1100 HD2 ARG 136 HD2 ARG 136 10.938 -3.639 11.847 1101 HD3 ARG 136 HD3 ARG 136 10.772 -3.859 10.100 1102 HE ARG 136 HE ARG 136 8.988 -5.459 10.506 1103 HH11 ARG 136 HH11 ARG 136 10.102 -3.747 13.365 1104 HH12 ARG 136 HH12 ARG 136 8.662 -4.071 14.270 1105 HH21 ARG 136 HH21 ARG 136 7.106 -5.883 11.704 1106 HH22 ARG 136 HH22 ARG 136 6.954 -5.289 13.323 1107 H ASN 137 H ASN 137 16.262 -3.149 12.145 1108 HA ASN 137 HA ASN 137 18.298 -2.784 11.343 1109 HB2 ASN 137 HB2 ASN 137 18.098 -5.700 10.415 1110 HB3 ASN 137 HB3 ASN 137 19.586 -4.744 10.433 1111 HD21 ASN 137 HD21 ASN 137 19.243 -3.390 12.936 1112 HD22 ASN 137 HD22 ASN 137 19.372 -4.571 14.196 1113 H TYR 138 H TYR 138 16.099 -1.939 9.663 1114 HA TYR 138 HA TYR 138 16.440 -2.833 6.994 1115 HB2 TYR 138 HB2 TYR 138 14.778 -1.207 6.534 1116 HB3 TYR 138 HB3 TYR 138 14.495 -1.473 8.260 1117 HD1 TYR 138 HD1 TYR 138 16.152 0.128 9.812 1118 HD2 TYR 138 HD2 TYR 138 14.780 1.029 5.842 1119 HE1 TYR 138 HE1 TYR 138 16.521 2.538 10.232 1120 HE2 TYR 138 HE2 TYR 138 15.146 3.438 6.261 1121 HH TYR 138 HH TYR 138 15.811 4.985 7.684 1122 H THR 139 H THR 139 17.028 -1.223 5.169 1123 HA THR 139 HA THR 139 19.349 0.418 5.962 1124 HB THR 139 HB THR 139 20.232 -0.264 3.632 1125 HG1 THR 139 HG1 THR 139 19.474 -2.408 2.971 1126 HG21 THR 139 HG21 THR 139 21.278 -2.326 4.552 1127 HG22 THR 139 HG22 THR 139 21.239 -1.009 5.772 1128 HG23 THR 139 HG23 THR 139 20.055 -2.355 5.867 1129 H ASP 140 H ASP 140 19.707 2.325 4.501 1130 HA ASP 140 HA ASP 140 17.423 3.747 4.002 1131 HB2 ASP 140 HB2 ASP 140 19.575 4.870 3.993 1132 HB3 ASP 140 HB3 ASP 140 20.263 3.723 2.836 1133 H GLU 141 H GLU 141 19.331 2.053 1.356 1134 HA GLU 141 HA GLU 141 17.418 2.644 -0.599 1135 HB2 GLU 141 HB2 GLU 141 19.937 1.876 -0.753 1136 HB3 GLU 141 HB3 GLU 141 19.233 0.256 -0.833 1137 HG2 GLU 141 HG2 GLU 141 17.992 0.796 -2.838 1138 HG3 GLU 141 HG3 GLU 141 18.362 2.519 -2.686 1139 H MET 142 H MET 142 17.016 0.478 2.027 1140 HA MET 142 HA MET 142 15.511 -1.479 0.515 1141 HB2 MET 142 HB2 MET 142 16.767 -2.097 2.562 1142 HB3 MET 142 HB3 MET 142 15.863 -0.909 3.511 1143 HG2 MET 142 HG2 MET 142 13.739 -2.215 2.917 1144 HG3 MET 142 HG3 MET 142 14.790 -3.466 2.240 1145 HE1 MET 142 HE1 MET 142 16.592 -5.068 5.066 1146 HE2 MET 142 HE2 MET 142 16.741 -4.396 3.407 1147 HE3 MET 142 HE3 MET 142 17.344 -3.457 4.814 1148 H VAL 143 H VAL 143 14.932 1.591 2.178 1149 HA VAL 143 HA VAL 143 12.051 1.198 2.023 1150 HB VAL 143 HB VAL 143 13.622 3.316 3.533 1151 HG11 VAL 143 HG11 VAL 143 11.442 3.800 4.606 1152 HG12 VAL 143 HG12 VAL 143 11.398 4.086 2.833 1153 HG13 VAL 143 HG13 VAL 143 10.651 2.605 3.522 1154 HG21 VAL 143 HG21 VAL 143 12.928 2.085 5.552 1155 HG22 VAL 143 HG22 VAL 143 12.207 0.806 4.517 1156 HG23 VAL 143 HG23 VAL 143 13.979 1.095 4.483 1157 H ALA 144 H ALA 144 10.730 3.006 1.110 1158 HA ALA 144 HA ALA 144 12.285 4.857 -0.576 1159 HB1 ALA 144 HB1 ALA 144 10.659 4.439 -2.394 1160 HB2 ALA 144 HB2 ALA 144 11.581 2.959 -1.964 1161 HB3 ALA 144 HB3 ALA 144 9.889 3.161 -1.395 1162 H MET 145 H MET 145 11.647 6.891 -0.332 1163 HA MET 145 HA MET 145 8.955 7.447 0.579 1164 HB2 MET 145 HB2 MET 145 11.462 8.769 1.509 1165 HB3 MET 145 HB3 MET 145 9.842 9.443 1.731 1166 HG2 MET 145 HG2 MET 145 9.168 7.332 2.925 1167 HG3 MET 145 HG3 MET 145 10.829 6.745 2.768 1168 HE1 MET 145 HE1 MET 145 9.920 10.800 4.775 1169 HE2 MET 145 HE2 MET 145 9.267 10.161 3.229 1170 HE3 MET 145 HE3 MET 145 8.573 9.613 4.792 1171 H LEU 146 H LEU 146 7.763 9.264 -0.299 1172 HA LEU 146 HA LEU 146 9.270 10.529 -2.491 1173 HB2 LEU 146 HB2 LEU 146 6.349 9.767 -2.388 1174 HB3 LEU 146 HB3 LEU 146 7.094 10.764 -3.644 1175 HG LEU 146 HG LEU 146 6.893 8.544 -4.486 1176 HD11 LEU 146 HD11 LEU 146 9.239 7.920 -4.964 1177 HD12 LEU 146 HD12 LEU 146 8.954 9.686 -5.116 1178 HD13 LEU 146 HD13 LEU 146 9.787 9.033 -3.666 1179 HD21 LEU 146 HD21 LEU 146 7.918 6.566 -3.416 1180 HD22 LEU 146 HD22 LEU 146 8.373 7.579 -2.004 1181 HD23 LEU 146 HD23 LEU 146 6.641 7.314 -2.399 1182 HA PRO 147 HA PRO 147 8.217 14.214 -0.050 1183 HB2 PRO 147 HB2 PRO 147 9.713 15.973 -1.606 1184 HB3 PRO 147 HB3 PRO 147 10.511 14.906 -0.443 1185 HG2 PRO 147 HG2 PRO 147 10.174 14.559 -3.436 1186 HG3 PRO 147 HG3 PRO 147 11.607 14.278 -2.438 1187 HD2 PRO 147 HD2 PRO 147 10.000 12.223 -3.255 1188 HD3 PRO 147 HD3 PRO 147 10.853 12.173 -1.706 1189 H ARG 148 H ARG 148 7.852 16.709 -1.135 1190 HA ARG 148 HA ARG 148 5.308 16.466 -2.246 1191 HB2 ARG 148 HB2 ARG 148 5.186 18.803 -2.180 1192 HB3 ARG 148 HB3 ARG 148 6.252 18.366 -0.838 1193 HG2 ARG 148 HG2 ARG 148 7.120 19.451 -3.557 1194 HG3 ARG 148 HG3 ARG 148 7.090 20.343 -2.031 1195 HD2 ARG 148 HD2 ARG 148 8.774 17.839 -2.542 1196 HD3 ARG 148 HD3 ARG 148 9.374 19.496 -2.689 1197 HE ARG 148 HE ARG 148 8.176 18.803 -0.086 1198 HH11 ARG 148 HH11 ARG 148 11.112 19.140 -1.998 1199 HH12 ARG 148 HH12 ARG 148 12.148 19.216 -0.612 1200 HH21 ARG 148 HH21 ARG 148 9.552 18.887 1.717 1201 HH22 ARG 148 HH22 ARG 148 11.261 19.072 1.500 1202 H GLN 149 H GLN 149 6.230 14.879 -3.986 1203 HA GLN 149 HA GLN 149 6.618 16.385 -6.408 1204 HB2 GLN 149 HB2 GLN 149 8.547 14.966 -5.744 1205 HB3 GLN 149 HB3 GLN 149 7.539 13.545 -6.052 1206 HG2 GLN 149 HG2 GLN 149 7.113 14.642 -8.406 1207 HG3 GLN 149 HG3 GLN 149 8.526 15.636 -8.025 1208 HE21 GLN 149 HE21 GLN 149 9.845 13.494 -6.411 1209 HE22 GLN 149 HE22 GLN 149 10.439 12.335 -7.552 1210 H GLU 150 H GLU 150 3.984 16.020 -5.301 1211 HA GLU 150 HA GLU 150 2.835 13.807 -6.710 1212 HB2 GLU 150 HB2 GLU 150 0.728 14.611 -5.784 1213 HB3 GLU 150 HB3 GLU 150 1.976 14.622 -4.531 1214 HG2 GLU 150 HG2 GLU 150 0.859 16.642 -4.174 1215 HG3 GLU 150 HG3 GLU 150 2.280 17.140 -5.102 1216 H GLU 151 H GLU 151 1.242 13.822 -8.381 1217 HA GLU 151 HA GLU 151 0.697 16.235 -9.823 1218 HB2 GLU 151 HB2 GLU 151 3.096 15.493 -10.491 1219 HB3 GLU 151 HB3 GLU 151 2.336 14.081 -11.235 1220 HG2 GLU 151 HG2 GLU 151 0.891 15.723 -12.584 1221 HG3 GLU 151 HG3 GLU 151 1.943 17.010 -11.980 1222 H CYS 152 H CYS 152 0.994 12.597 -10.310 1223 HA CYS 152 HA CYS 152 -1.615 12.769 -11.694 1224 HB2 CYS 152 HB2 CYS 152 0.215 11.433 -12.781 1225 HB3 CYS 152 HB3 CYS 152 0.517 10.552 -11.277 1226 H THR 153 H THR 153 -3.422 11.941 -10.696 1227 HA THR 153 HA THR 153 -3.102 10.525 -8.152 1228 HB THR 153 HB THR 153 -5.349 11.961 -7.659 1229 HG1 THR 153 HG1 THR 153 -5.017 14.152 -8.483 1230 HG21 THR 153 HG21 THR 153 -3.957 13.591 -6.409 1231 HG22 THR 153 HG22 THR 153 -3.342 11.913 -6.227 1232 HG23 THR 153 HG23 THR 153 -2.512 13.059 -7.334 1233 H VAL 154 H VAL 154 -5.121 9.328 -7.469 1234 HA VAL 154 HA VAL 154 -6.424 8.285 -9.873 1235 HB VAL 154 HB VAL 154 -5.298 6.691 -8.354 1236 HG11 VAL 154 HG11 VAL 154 -6.231 6.212 -6.114 1237 HG12 VAL 154 HG12 VAL 154 -5.555 7.872 -6.230 1238 HG13 VAL 154 HG13 VAL 154 -7.333 7.621 -6.281 1239 HG21 VAL 154 HG21 VAL 154 -7.179 5.107 -8.085 1240 HG22 VAL 154 HG22 VAL 154 -8.337 6.449 -8.379 1241 HG23 VAL 154 HG23 VAL 154 -7.208 5.936 -9.678 1242 H ASP 155 H ASP 155 -8.661 8.433 -10.200 1243 HA ASP 155 HA ASP 155 -10.027 10.476 -8.790 1244 HB2 ASP 155 HB2 ASP 155 -10.625 10.267 -11.058 1245 HB3 ASP 155 HB3 ASP 155 -10.684 8.500 -10.995 1246 H GLU 156 H GLU 156 -12.084 10.309 -7.643 1247 HA GLU 156 HA GLU 156 -12.322 7.745 -6.210 1248 HB2 GLU 156 HB2 GLU 156 -13.088 9.070 -4.274 1249 HB3 GLU 156 HB3 GLU 156 -11.419 9.434 -4.729 1250 HG2 GLU 156 HG2 GLU 156 -12.554 11.402 -6.121 1251 HG3 GLU 156 HG3 GLU 156 -13.894 11.147 -4.996 1252 H VAL 157 H VAL 157 -14.165 10.730 -7.271 1253 HA VAL 157 HA VAL 157 -16.258 9.129 -8.295 1254 HB VAL 157 HB VAL 157 -16.831 8.827 -5.933 1255 HG11 VAL 157 HG11 VAL 157 -17.474 10.737 -4.507 1256 HG12 VAL 157 HG12 VAL 157 -15.743 10.794 -4.980 1257 HG13 VAL 157 HG13 VAL 157 -16.931 11.869 -5.790 1258 HG21 VAL 157 HG21 VAL 157 -19.144 9.711 -5.990 1259 HG22 VAL 157 HG22 VAL 157 -18.693 10.780 -7.361 1260 HG23 VAL 157 HG23 VAL 157 -18.653 8.996 -7.563 1261 HN1 EB4 158 HN1 EB4 158 4.226 -6.333 -7.269 1262 H8 EB4 158 H8 EB4 158 -2.412 -6.387 -5.110 1263 HN2 EB4 158 HN2 EB4 158 1.807 -5.891 -8.988 1264 H9 EB4 158 H9 EB4 158 0.761 -0.855 -3.653 1265 H10 EB4 158 H10 EB4 158 4.733 -7.641 -1.538 1266 HN3 EB4 158 HN3 EB4 158 3.815 -3.170 -7.981 1267 H7 EB4 158 H7 EB4 158 2.972 -5.888 -1.642 1268 H11 EB4 158 H11 EB4 158 -3.540 -7.305 -7.122 1269 H12 EB4 158 H12 EB4 158 2.282 1.045 -4.126 1270 H15 EB4 158 H15 EB4 158 3.895 0.893 -5.996 1271 H14 EB4 158 H14 EB4 158 -2.386 -7.260 -9.317 1272 H13 EB4 158 H13 EB4 158 5.918 -8.282 -3.619 1273 H22 EB4 158 H22 EB4 158 5.111 -7.109 -7.615 1274 H30 EB4 158 H30 EB4 158 6.742 -3.875 -10.194 1275 H30A EB4 158 H30A EB4 158 6.894 -3.298 -8.461 1276 H24 EB4 158 H24 EB4 158 4.585 -2.455 -8.617 1277 H28 EB4 158 H28 EB4 158 4.274 -8.923 -9.229 1278 H28A EB4 158 H28A EB4 158 5.117 -7.954 -10.534 1279 H23 EB4 158 H23 EB4 158 1.470 -5.790 -10.166 1280 H29 EB4 158 H29 EB4 158 1.338 -3.788 -11.432 1281 H29A EB4 158 H29A EB4 158 2.897 -4.298 -12.333 Start of MODEL 7 1 H1 MET 1 H1 MET 1 -29.375 4.794 -4.528 2 H2 MET 1 H2 MET 1 -28.634 6.207 -4.179 3 H3 MET 1 H3 MET 1 -29.063 5.869 -5.718 4 HA MET 1 HA MET 1 -27.375 3.893 -4.536 5 HB2 MET 1 HB2 MET 1 -27.131 5.486 -7.129 6 HB3 MET 1 HB3 MET 1 -26.233 4.023 -6.702 7 HG2 MET 1 HG2 MET 1 -28.291 2.690 -6.727 8 HG3 MET 1 HG3 MET 1 -29.272 4.138 -6.986 9 HE1 MET 1 HE1 MET 1 -29.706 2.533 -10.489 10 HE2 MET 1 HE2 MET 1 -29.762 1.763 -8.867 11 HE3 MET 1 HE3 MET 1 -30.496 3.383 -9.118 12 H THR 2 H THR 2 -24.915 4.228 -4.513 13 HA THR 2 HA THR 2 -23.164 5.266 -3.639 14 HB THR 2 HB THR 2 -24.127 7.844 -4.944 15 HG1 THR 2 HG1 THR 2 -23.179 6.968 -6.931 16 HG21 THR 2 HG21 THR 2 -21.706 8.103 -5.418 17 HG22 THR 2 HG22 THR 2 -22.016 7.896 -3.661 18 HG23 THR 2 HG23 THR 2 -21.385 6.522 -4.630 19 H VAL 3 H VAL 3 -25.297 5.091 -1.787 20 HA VAL 3 HA VAL 3 -25.911 7.623 -0.684 21 HB VAL 3 HB VAL 3 -26.762 6.309 1.258 22 HG11 VAL 3 HG11 VAL 3 -28.528 5.093 0.018 23 HG12 VAL 3 HG12 VAL 3 -28.195 6.708 -0.693 24 HG13 VAL 3 HG13 VAL 3 -27.555 5.229 -1.486 25 HG21 VAL 3 HG21 VAL 3 -26.745 3.839 1.164 26 HG22 VAL 3 HG22 VAL 3 -25.685 3.907 -0.285 27 HG23 VAL 3 HG23 VAL 3 -25.089 4.522 1.294 28 HA PRO 4 HA PRO 4 -22.155 8.196 1.688 29 HB2 PRO 4 HB2 PRO 4 -23.066 10.224 3.341 30 HB3 PRO 4 HB3 PRO 4 -22.814 10.538 1.619 31 HG2 PRO 4 HG2 PRO 4 -25.391 9.907 3.089 32 HG3 PRO 4 HG3 PRO 4 -25.088 11.134 1.850 33 HD2 PRO 4 HD2 PRO 4 -26.269 8.726 1.262 34 HD3 PRO 4 HD3 PRO 4 -25.270 9.592 0.087 35 H ASP 5 H ASP 5 -23.178 5.834 2.442 36 HA ASP 5 HA ASP 5 -23.502 6.116 5.361 37 HB2 ASP 5 HB2 ASP 5 -24.648 4.214 3.325 38 HB3 ASP 5 HB3 ASP 5 -24.296 3.596 4.944 39 H ARG 6 H ARG 6 -22.725 2.981 3.843 40 HA ARG 6 HA ARG 6 -20.589 2.537 5.539 41 HB2 ARG 6 HB2 ARG 6 -21.572 1.327 2.958 42 HB3 ARG 6 HB3 ARG 6 -19.958 0.876 3.523 43 HG2 ARG 6 HG2 ARG 6 -21.424 -0.782 4.392 44 HG3 ARG 6 HG3 ARG 6 -21.026 0.258 5.766 45 HD2 ARG 6 HD2 ARG 6 -23.385 -0.090 5.893 46 HD3 ARG 6 HD3 ARG 6 -23.181 1.558 5.283 47 HE ARG 6 HE ARG 6 -23.436 0.277 2.952 48 HH11 ARG 6 HH11 ARG 6 -25.202 -0.272 5.943 49 HH12 ARG 6 HH12 ARG 6 -26.641 -0.804 5.139 50 HH21 ARG 6 HH21 ARG 6 -25.334 -0.428 1.911 51 HH22 ARG 6 HH22 ARG 6 -26.716 -0.893 2.846 52 H SER 7 H SER 7 -20.703 4.363 2.491 53 HA SER 7 HA SER 7 -18.129 4.182 1.574 54 HB2 SER 7 HB2 SER 7 -19.506 6.887 1.759 55 HB3 SER 7 HB3 SER 7 -18.681 6.150 0.380 56 HG SER 7 HG SER 7 -21.339 6.078 1.024 57 H GLU 8 H GLU 8 -19.278 5.930 4.517 58 HA GLU 8 HA GLU 8 -17.086 7.606 4.850 59 HB2 GLU 8 HB2 GLU 8 -18.828 6.256 6.947 60 HB3 GLU 8 HB3 GLU 8 -17.722 7.603 7.247 61 HG2 GLU 8 HG2 GLU 8 -19.068 8.892 5.444 62 HG3 GLU 8 HG3 GLU 8 -20.269 7.601 5.582 63 H ILE 9 H ILE 9 -17.365 4.104 5.306 64 HA ILE 9 HA ILE 9 -15.002 3.955 6.918 65 HB ILE 9 HB ILE 9 -16.538 1.649 5.752 66 HG12 ILE 9 HG12 ILE 9 -16.924 3.037 8.451 67 HG13 ILE 9 HG13 ILE 9 -17.992 3.262 7.059 68 HG21 ILE 9 HG21 ILE 9 -15.582 0.457 7.696 69 HG22 ILE 9 HG22 ILE 9 -14.307 1.115 6.615 70 HG23 ILE 9 HG23 ILE 9 -14.689 1.945 8.162 71 HD11 ILE 9 HD11 ILE 9 -18.928 1.629 8.637 72 HD12 ILE 9 HD12 ILE 9 -18.537 0.843 7.070 73 HD13 ILE 9 HD13 ILE 9 -17.453 0.615 8.483 74 H ALA 10 H ALA 10 -15.377 4.582 3.660 75 HA ALA 10 HA ALA 10 -12.835 3.221 3.063 76 HB1 ALA 10 HB1 ALA 10 -13.757 2.659 0.819 77 HB2 ALA 10 HB2 ALA 10 -14.675 1.849 2.132 78 HB3 ALA 10 HB3 ALA 10 -15.357 3.300 1.324 79 H GLY 11 H GLY 11 -12.142 4.118 0.657 80 HA2 GLY 11 HA2 GLY 11 -12.829 6.500 -0.350 81 HA3 GLY 11 HA3 GLY 11 -11.940 6.979 1.102 82 H LYS 12 H LYS 12 -10.247 7.962 -0.204 83 HA LYS 12 HA LYS 12 -8.613 5.988 -1.659 84 HB2 LYS 12 HB2 LYS 12 -7.901 7.678 -3.103 85 HB3 LYS 12 HB3 LYS 12 -9.628 8.000 -2.904 86 HG2 LYS 12 HG2 LYS 12 -7.488 9.446 -1.276 87 HG3 LYS 12 HG3 LYS 12 -8.050 10.026 -2.849 88 HD2 LYS 12 HD2 LYS 12 -10.377 10.161 -1.999 89 HD3 LYS 12 HD3 LYS 12 -9.866 9.505 -0.438 90 HE2 LYS 12 HE2 LYS 12 -10.037 11.929 -0.248 91 HE3 LYS 12 HE3 LYS 12 -8.334 11.468 -0.126 92 HZ1 LYS 12 HZ1 LYS 12 -8.768 13.368 -1.595 93 HZ2 LYS 12 HZ2 LYS 12 -7.999 12.149 -2.363 94 HZ3 LYS 12 HZ3 LYS 12 -9.591 12.402 -2.623 95 H TRP 13 H TRP 13 -6.365 5.870 -1.225 96 HA TRP 13 HA TRP 13 -5.427 7.478 1.069 97 HB2 TRP 13 HB2 TRP 13 -4.757 4.553 0.520 98 HB3 TRP 13 HB3 TRP 13 -4.270 5.525 1.915 99 HD1 TRP 13 HD1 TRP 13 -6.723 2.964 1.026 100 HE1 TRP 13 HE1 TRP 13 -8.716 2.930 2.674 101 HE3 TRP 13 HE3 TRP 13 -5.960 7.509 3.296 102 HZ2 TRP 13 HZ2 TRP 13 -9.826 4.593 4.659 103 HZ3 TRP 13 HZ3 TRP 13 -7.540 8.227 5.072 104 HH2 TRP 13 HH2 TRP 13 -9.440 6.785 5.744 105 H TYR 14 H TYR 14 -3.245 8.222 0.850 106 HA TYR 14 HA TYR 14 -2.064 7.666 -1.799 107 HB2 TYR 14 HB2 TYR 14 -1.566 10.011 0.095 108 HB3 TYR 14 HB3 TYR 14 -0.961 9.828 -1.557 109 HD1 TYR 14 HD1 TYR 14 -4.135 10.137 0.431 110 HD2 TYR 14 HD2 TYR 14 -2.256 10.588 -3.405 111 HE1 TYR 14 HE1 TYR 14 -6.175 11.239 -0.435 112 HE2 TYR 14 HE2 TYR 14 -4.298 11.685 -4.276 113 HH TYR 14 HH TYR 14 -6.586 11.937 -3.866 114 H VAL 15 H VAL 15 -0.313 6.253 -1.860 115 HA VAL 15 HA VAL 15 0.993 5.754 0.764 116 HB VAL 15 HB VAL 15 0.337 3.896 -0.790 117 HG11 VAL 15 HG11 VAL 15 1.571 3.455 -2.872 118 HG12 VAL 15 HG12 VAL 15 0.572 4.946 -2.953 119 HG13 VAL 15 HG13 VAL 15 2.351 5.067 -2.738 120 HG21 VAL 15 HG21 VAL 15 2.536 2.711 -0.774 121 HG22 VAL 15 HG22 VAL 15 3.355 4.276 -0.453 122 HG23 VAL 15 HG23 VAL 15 2.222 3.590 0.760 123 H VAL 16 H VAL 16 2.434 7.155 1.399 124 HA VAL 16 HA VAL 16 4.105 8.518 -0.589 125 HB VAL 16 HB VAL 16 4.528 10.169 1.162 126 HG11 VAL 16 HG11 VAL 16 2.309 11.206 1.291 127 HG12 VAL 16 HG12 VAL 16 2.666 10.559 -0.345 128 HG13 VAL 16 HG13 VAL 16 1.580 9.653 0.761 129 HG21 VAL 16 HG21 VAL 16 3.288 10.163 3.289 130 HG22 VAL 16 HG22 VAL 16 2.618 8.552 2.863 131 HG23 VAL 16 HG23 VAL 16 4.382 8.747 3.137 132 H ALA 17 H ALA 17 4.178 5.755 1.269 133 HA ALA 17 HA ALA 17 7.074 6.018 1.715 134 HB1 ALA 17 HB1 ALA 17 6.833 4.793 3.842 135 HB2 ALA 17 HB2 ALA 17 6.001 6.384 3.887 136 HB3 ALA 17 HB3 ALA 17 5.046 4.877 3.685 137 H LEU 18 H LEU 18 8.228 3.984 1.508 138 HA LEU 18 HA LEU 18 6.646 1.675 0.732 139 HB2 LEU 18 HB2 LEU 18 8.743 2.973 -1.090 140 HB3 LEU 18 HB3 LEU 18 7.948 1.421 -1.384 141 HG LEU 18 HG LEU 18 6.372 4.008 -1.153 142 HD11 LEU 18 HD11 LEU 18 6.428 4.129 -3.625 143 HD12 LEU 18 HD12 LEU 18 8.063 4.320 -2.908 144 HD13 LEU 18 HD13 LEU 18 7.590 2.760 -3.660 145 HD21 LEU 18 HD21 LEU 18 4.724 2.749 -2.501 146 HD22 LEU 18 HD22 LEU 18 5.815 1.322 -2.492 147 HD23 LEU 18 HD23 LEU 18 5.103 1.917 -0.954 148 H ALA 19 H ALA 19 7.717 -0.297 1.091 149 HA ALA 19 HA ALA 19 10.618 -0.195 1.744 150 HB1 ALA 19 HB1 ALA 19 10.165 -1.569 3.741 151 HB2 ALA 19 HB2 ALA 19 9.356 0.028 3.881 152 HB3 ALA 19 HB3 ALA 19 8.397 -1.431 3.458 153 H SER 20 H SER 20 11.625 -1.894 0.639 154 HA SER 20 HA SER 20 9.841 -4.124 -0.164 155 HB2 SER 20 HB2 SER 20 12.048 -2.828 -1.876 156 HB3 SER 20 HB3 SER 20 10.973 -4.145 -2.362 157 HG SER 20 HG SER 20 10.421 -1.830 -3.020 158 H ASN 21 H ASN 21 10.726 -6.180 -0.081 159 HA ASN 21 HA ASN 21 13.212 -6.373 1.446 160 HB2 ASN 21 HB2 ASN 21 10.892 -7.635 1.807 161 HB3 ASN 21 HB3 ASN 21 11.525 -8.717 0.559 162 HD21 ASN 21 HD21 ASN 21 14.318 -8.660 1.272 163 HD22 ASN 21 HD22 ASN 21 14.483 -9.477 2.789 164 H THR 22 H THR 22 12.030 -6.607 -1.909 165 HA THR 22 HA THR 22 14.333 -8.295 -2.664 166 HB THR 22 HB THR 22 12.293 -7.013 -4.526 167 HG1 THR 22 HG1 THR 22 10.925 -8.901 -4.098 168 HG21 THR 22 HG21 THR 22 12.636 -9.127 -5.772 169 HG22 THR 22 HG22 THR 22 14.191 -8.279 -5.474 170 HG23 THR 22 HG23 THR 22 13.741 -9.707 -4.481 171 H GLU 23 H GLU 23 16.203 -7.520 -3.465 172 HA GLU 23 HA GLU 23 16.954 -4.883 -3.208 173 HB2 GLU 23 HB2 GLU 23 18.000 -6.743 -5.412 174 HB3 GLU 23 HB3 GLU 23 18.908 -5.543 -4.482 175 HG2 GLU 23 HG2 GLU 23 17.708 -8.051 -3.229 176 HG3 GLU 23 HG3 GLU 23 19.334 -8.002 -3.925 177 H PHE 24 H PHE 24 15.881 -6.597 -6.283 178 HA PHE 24 HA PHE 24 16.187 -4.467 -7.995 179 HB2 PHE 24 HB2 PHE 24 14.081 -6.683 -7.961 180 HB3 PHE 24 HB3 PHE 24 14.344 -5.591 -9.327 181 HD1 PHE 24 HD1 PHE 24 16.556 -5.624 -10.535 182 HD2 PHE 24 HD2 PHE 24 15.520 -8.548 -7.566 183 HE1 PHE 24 HE1 PHE 24 18.331 -7.120 -11.392 184 HE2 PHE 24 HE2 PHE 24 17.290 -10.051 -8.423 185 HZ PHE 24 HZ PHE 24 18.702 -9.339 -10.341 186 H PHE 25 H PHE 25 13.274 -5.275 -5.938 187 HA PHE 25 HA PHE 25 11.601 -3.302 -6.925 188 HB2 PHE 25 HB2 PHE 25 11.887 -4.639 -4.208 189 HB3 PHE 25 HB3 PHE 25 10.642 -3.420 -4.511 190 HD1 PHE 25 HD1 PHE 25 11.999 -6.557 -6.098 191 HD2 PHE 25 HD2 PHE 25 8.564 -4.147 -5.199 192 HE1 PHE 25 HE1 PHE 25 10.531 -8.294 -7.074 193 HE2 PHE 25 HE2 PHE 25 7.091 -5.880 -6.173 194 HZ PHE 25 HZ PHE 25 8.069 -7.960 -7.113 195 H LEU 26 H LEU 26 14.082 -3.086 -4.262 196 HA LEU 26 HA LEU 26 13.476 -0.469 -3.469 197 HB2 LEU 26 HB2 LEU 26 16.212 -1.821 -3.567 198 HB3 LEU 26 HB3 LEU 26 15.721 -0.486 -2.516 199 HG LEU 26 HG LEU 26 14.639 -3.334 -2.405 200 HD11 LEU 26 HD11 LEU 26 15.859 -3.459 -0.262 201 HD12 LEU 26 HD12 LEU 26 16.964 -3.178 -1.649 202 HD13 LEU 26 HD13 LEU 26 16.533 -1.821 -0.555 203 HD21 LEU 26 HD21 LEU 26 13.550 -2.600 -0.312 204 HD22 LEU 26 HD22 LEU 26 14.119 -0.923 -0.610 205 HD23 LEU 26 HD23 LEU 26 12.949 -1.688 -1.738 206 H ARG 27 H ARG 27 15.652 -1.796 -6.051 207 HA ARG 27 HA ARG 27 16.829 0.649 -6.749 208 HB2 ARG 27 HB2 ARG 27 17.517 -1.754 -7.372 209 HB3 ARG 27 HB3 ARG 27 16.275 -1.677 -8.628 210 HG2 ARG 27 HG2 ARG 27 17.457 0.523 -9.393 211 HG3 ARG 27 HG3 ARG 27 18.801 0.001 -8.368 212 HD2 ARG 27 HD2 ARG 27 19.355 -0.880 -10.483 213 HD3 ARG 27 HD3 ARG 27 18.666 -2.267 -9.630 214 HE ARG 27 HE ARG 27 16.467 -1.484 -10.852 215 HH11 ARG 27 HH11 ARG 27 19.720 -1.300 -12.167 216 HH12 ARG 27 HH12 ARG 27 19.196 -1.508 -13.805 217 HH21 ARG 27 HH21 ARG 27 15.796 -1.752 -12.982 218 HH22 ARG 27 HH22 ARG 27 16.954 -1.766 -14.269 219 H GLU 28 H GLU 28 13.900 -1.104 -8.059 220 HA GLU 28 HA GLU 28 13.398 0.868 -10.026 221 HB2 GLU 28 HB2 GLU 28 11.511 -1.172 -8.757 222 HB3 GLU 28 HB3 GLU 28 11.220 -0.276 -10.254 223 HG2 GLU 28 HG2 GLU 28 13.304 -2.436 -9.741 224 HG3 GLU 28 HG3 GLU 28 11.930 -2.490 -10.854 225 H LYS 29 H LYS 29 11.707 0.134 -6.836 226 HA LYS 29 HA LYS 29 9.958 2.260 -6.998 227 HB2 LYS 29 HB2 LYS 29 11.082 0.595 -4.755 228 HB3 LYS 29 HB3 LYS 29 10.173 2.055 -4.344 229 HG2 LYS 29 HG2 LYS 29 9.048 -0.036 -6.255 230 HG3 LYS 29 HG3 LYS 29 8.889 -0.202 -4.501 231 HD2 LYS 29 HD2 LYS 29 6.880 0.874 -5.239 232 HD3 LYS 29 HD3 LYS 29 7.846 2.137 -4.464 233 HE2 LYS 29 HE2 LYS 29 7.776 3.363 -6.354 234 HE3 LYS 29 HE3 LYS 29 8.632 2.083 -7.225 235 HZ1 LYS 29 HZ1 LYS 29 6.770 1.749 -8.337 236 HZ2 LYS 29 HZ2 LYS 29 6.002 1.266 -6.979 237 HZ3 LYS 29 HZ3 LYS 29 5.941 2.832 -7.439 238 H ASP 30 H ASP 30 13.301 2.248 -5.497 239 HA ASP 30 HA ASP 30 13.142 4.815 -4.457 240 HB2 ASP 30 HB2 ASP 30 14.967 3.351 -3.856 241 HB3 ASP 30 HB3 ASP 30 15.490 3.193 -5.538 242 H LYS 31 H LYS 31 13.668 3.722 -7.853 243 HA LYS 31 HA LYS 31 14.415 6.412 -8.605 244 HB2 LYS 31 HB2 LYS 31 14.302 3.737 -9.980 245 HB3 LYS 31 HB3 LYS 31 14.201 5.196 -10.974 246 HG2 LYS 31 HG2 LYS 31 16.481 4.261 -9.198 247 HG3 LYS 31 HG3 LYS 31 16.511 4.671 -10.918 248 HD2 LYS 31 HD2 LYS 31 17.367 6.664 -10.180 249 HD3 LYS 31 HD3 LYS 31 15.670 7.072 -9.891 250 HE2 LYS 31 HE2 LYS 31 16.575 5.562 -7.615 251 HE3 LYS 31 HE3 LYS 31 17.829 6.757 -7.973 252 HZ1 LYS 31 HZ1 LYS 31 16.539 8.206 -6.957 253 HZ2 LYS 31 HZ2 LYS 31 15.439 8.093 -8.159 254 HZ3 LYS 31 HZ3 LYS 31 15.293 7.158 -6.828 255 H MET 32 H MET 32 11.274 4.518 -8.269 256 HA MET 32 HA MET 32 10.349 6.305 -10.445 257 HB2 MET 32 HB2 MET 32 9.003 4.321 -8.284 258 HB3 MET 32 HB3 MET 32 8.100 4.938 -9.674 259 HG2 MET 32 HG2 MET 32 10.614 3.237 -10.008 260 HG3 MET 32 HG3 MET 32 9.015 2.512 -9.801 261 HE1 MET 32 HE1 MET 32 10.106 2.271 -13.697 262 HE2 MET 32 HE2 MET 32 11.255 2.422 -12.325 263 HE3 MET 32 HE3 MET 32 9.843 1.319 -12.196 264 H LYS 33 H LYS 33 7.591 6.245 -8.544 265 HA LYS 33 HA LYS 33 8.374 8.712 -7.119 266 HB2 LYS 33 HB2 LYS 33 6.151 8.756 -9.178 267 HB3 LYS 33 HB3 LYS 33 6.507 10.022 -7.996 268 HG2 LYS 33 HG2 LYS 33 8.579 10.578 -9.029 269 HG3 LYS 33 HG3 LYS 33 8.639 9.063 -9.940 270 HD2 LYS 33 HD2 LYS 33 6.570 9.821 -11.213 271 HD3 LYS 33 HD3 LYS 33 6.682 11.376 -10.379 272 HE2 LYS 33 HE2 LYS 33 8.969 11.726 -11.290 273 HE3 LYS 33 HE3 LYS 33 8.915 10.144 -12.077 274 HZ1 LYS 33 HZ1 LYS 33 8.362 11.906 -13.595 275 HZ2 LYS 33 HZ2 LYS 33 7.061 10.939 -13.396 276 HZ3 LYS 33 HZ3 LYS 33 7.111 12.400 -12.669 277 H MET 34 H MET 34 5.913 9.479 -6.093 278 HA MET 34 HA MET 34 5.333 7.327 -4.309 279 HB2 MET 34 HB2 MET 34 5.143 9.673 -3.594 280 HB3 MET 34 HB3 MET 34 4.074 10.066 -4.947 281 HG2 MET 34 HG2 MET 34 2.310 8.588 -3.960 282 HG3 MET 34 HG3 MET 34 3.377 8.251 -2.590 283 HE1 MET 34 HE1 MET 34 1.556 12.420 -3.560 284 HE2 MET 34 HE2 MET 34 3.016 11.834 -4.427 285 HE3 MET 34 HE3 MET 34 1.456 10.963 -4.605 286 H ALA 35 H ALA 35 3.311 6.175 -4.107 287 HA ALA 35 HA ALA 35 1.871 5.907 -6.638 288 HB1 ALA 35 HB1 ALA 35 1.338 3.623 -5.914 289 HB2 ALA 35 HB2 ALA 35 3.103 3.911 -6.081 290 HB3 ALA 35 HB3 ALA 35 2.350 3.865 -4.451 291 H MET 36 H MET 36 -0.423 4.721 -6.061 292 HA MET 36 HA MET 36 -1.628 6.263 -3.877 293 HB2 MET 36 HB2 MET 36 -2.760 5.741 -6.649 294 HB3 MET 36 HB3 MET 36 -3.623 6.537 -5.358 295 HG2 MET 36 HG2 MET 36 -1.015 7.788 -5.915 296 HG3 MET 36 HG3 MET 36 -2.050 7.739 -7.348 297 HE1 MET 36 HE1 MET 36 -2.037 11.295 -5.360 298 HE2 MET 36 HE2 MET 36 -0.855 10.116 -6.022 299 HE3 MET 36 HE3 MET 36 -2.129 10.804 -7.085 300 H ALA 37 H ALA 37 -3.869 5.350 -3.254 301 HA ALA 37 HA ALA 37 -4.429 2.587 -4.029 302 HB1 ALA 37 HB1 ALA 37 -4.074 1.744 -1.699 303 HB2 ALA 37 HB2 ALA 37 -2.528 2.347 -2.387 304 HB3 ALA 37 HB3 ALA 37 -3.438 3.351 -1.208 305 H ARG 38 H ARG 38 -6.555 2.469 -4.131 306 HA ARG 38 HA ARG 38 -8.165 3.978 -2.147 307 HB2 ARG 38 HB2 ARG 38 -8.200 5.149 -4.320 308 HB3 ARG 38 HB3 ARG 38 -8.736 3.662 -5.114 309 HG2 ARG 38 HG2 ARG 38 -10.350 4.707 -2.783 310 HG3 ARG 38 HG3 ARG 38 -10.461 5.549 -4.334 311 HD2 ARG 38 HD2 ARG 38 -10.955 3.295 -5.431 312 HD3 ARG 38 HD3 ARG 38 -11.027 2.586 -3.812 313 HE ARG 38 HE ARG 38 -13.121 3.537 -3.524 314 HH11 ARG 38 HH11 ARG 38 -11.529 5.132 -6.228 315 HH12 ARG 38 HH12 ARG 38 -12.922 6.072 -6.649 316 HH21 ARG 38 HH21 ARG 38 -14.929 4.795 -4.079 317 HH22 ARG 38 HH22 ARG 38 -14.853 5.879 -5.428 318 H ILE 39 H ILE 39 -9.625 2.521 -1.126 319 HA ILE 39 HA ILE 39 -9.821 -0.100 -2.399 320 HB ILE 39 HB ILE 39 -10.155 0.438 0.581 321 HG12 ILE 39 HG12 ILE 39 -7.925 1.204 0.056 322 HG13 ILE 39 HG13 ILE 39 -7.824 -0.347 0.899 323 HG21 ILE 39 HG21 ILE 39 -9.639 -1.977 0.775 324 HG22 ILE 39 HG22 ILE 39 -11.085 -1.671 -0.247 325 HG23 ILE 39 HG23 ILE 39 -9.514 -2.084 -1.013 326 HD11 ILE 39 HD11 ILE 39 -6.212 -0.237 -0.947 327 HD12 ILE 39 HD12 ILE 39 -7.442 -1.508 -1.257 328 HD13 ILE 39 HD13 ILE 39 -7.544 0.068 -2.112 329 H SER 40 H SER 40 -11.866 -1.193 -2.389 330 HA SER 40 HA SER 40 -14.145 0.403 -1.409 331 HB2 SER 40 HB2 SER 40 -13.922 -1.130 -4.053 332 HB3 SER 40 HB3 SER 40 -15.376 -0.328 -3.446 333 HG SER 40 HG SER 40 -14.194 1.006 -4.957 334 H PHE 41 H PHE 41 -15.634 -0.765 -0.189 335 HA PHE 41 HA PHE 41 -14.924 -3.457 0.491 336 HB2 PHE 41 HB2 PHE 41 -17.073 -3.333 1.825 337 HB3 PHE 41 HB3 PHE 41 -15.831 -2.143 2.235 338 HD1 PHE 41 HD1 PHE 41 -19.175 -2.654 0.769 339 HD2 PHE 41 HD2 PHE 41 -16.164 0.234 1.784 340 HE1 PHE 41 HE1 PHE 41 -20.834 -0.835 0.507 341 HE2 PHE 41 HE2 PHE 41 -17.819 2.056 1.520 342 HZ PHE 41 HZ PHE 41 -20.158 1.526 0.883 343 H LEU 42 H LEU 42 -15.198 -5.097 -0.944 344 HA LEU 42 HA LEU 42 -17.219 -5.019 -2.965 345 HB2 LEU 42 HB2 LEU 42 -14.851 -6.202 -2.839 346 HB3 LEU 42 HB3 LEU 42 -15.762 -7.511 -2.075 347 HG LEU 42 HG LEU 42 -15.495 -7.982 -4.420 348 HD11 LEU 42 HD11 LEU 42 -17.848 -8.230 -5.127 349 HD12 LEU 42 HD12 LEU 42 -17.607 -8.681 -3.406 350 HD13 LEU 42 HD13 LEU 42 -18.352 -7.102 -3.824 351 HD21 LEU 42 HD21 LEU 42 -16.433 -6.517 -6.179 352 HD22 LEU 42 HD22 LEU 42 -16.859 -5.300 -4.929 353 HD23 LEU 42 HD23 LEU 42 -15.137 -5.701 -5.241 354 H GLY 43 H GLY 43 -16.746 -6.787 0.177 355 HA2 GLY 43 HA2 GLY 43 -19.584 -7.030 0.515 356 HA3 GLY 43 HA3 GLY 43 -18.806 -8.560 0.086 357 H GLU 44 H GLU 44 -19.937 -8.582 2.570 358 HA GLU 44 HA GLU 44 -18.517 -7.508 4.669 359 HB2 GLU 44 HB2 GLU 44 -19.900 -10.230 4.508 360 HB3 GLU 44 HB3 GLU 44 -19.462 -9.386 5.999 361 HG2 GLU 44 HG2 GLU 44 -21.050 -7.630 5.595 362 HG3 GLU 44 HG3 GLU 44 -21.303 -8.138 3.920 363 H ASP 45 H ASP 45 -17.659 -10.318 2.589 364 HA ASP 45 HA ASP 45 -15.273 -10.651 4.287 365 HB2 ASP 45 HB2 ASP 45 -16.854 -12.606 4.337 366 HB3 ASP 45 HB3 ASP 45 -16.760 -12.723 2.575 367 H GLU 46 H GLU 46 -16.227 -9.321 1.318 368 HA GLU 46 HA GLU 46 -13.599 -10.041 0.205 369 HB2 GLU 46 HB2 GLU 46 -15.330 -11.175 -1.097 370 HB3 GLU 46 HB3 GLU 46 -16.224 -9.663 -1.301 371 HG2 GLU 46 HG2 GLU 46 -14.564 -8.732 -2.738 372 HG3 GLU 46 HG3 GLU 46 -13.351 -9.929 -2.262 373 H LEU 47 H LEU 47 -12.556 -8.367 -1.096 374 HA LEU 47 HA LEU 47 -13.680 -5.725 -0.781 375 HB2 LEU 47 HB2 LEU 47 -11.527 -4.830 0.064 376 HB3 LEU 47 HB3 LEU 47 -12.386 -5.869 1.209 377 HG LEU 47 HG LEU 47 -10.148 -6.948 -0.536 378 HD11 LEU 47 HD11 LEU 47 -8.608 -6.528 1.355 379 HD12 LEU 47 HD12 LEU 47 -9.256 -5.001 0.668 380 HD13 LEU 47 HD13 LEU 47 -9.912 -5.640 2.213 381 HD21 LEU 47 HD21 LEU 47 -9.953 -8.590 1.305 382 HD22 LEU 47 HD22 LEU 47 -11.309 -7.782 2.162 383 HD23 LEU 47 HD23 LEU 47 -11.597 -8.586 0.582 384 H LYS 48 H LYS 48 -12.817 -4.133 -2.223 385 HA LYS 48 HA LYS 48 -11.234 -5.265 -4.435 386 HB2 LYS 48 HB2 LYS 48 -13.569 -4.805 -5.048 387 HB3 LYS 48 HB3 LYS 48 -13.418 -3.147 -4.452 388 HG2 LYS 48 HG2 LYS 48 -12.400 -2.426 -6.347 389 HG3 LYS 48 HG3 LYS 48 -11.326 -3.829 -6.425 390 HD2 LYS 48 HD2 LYS 48 -14.284 -3.861 -7.230 391 HD3 LYS 48 HD3 LYS 48 -12.940 -3.666 -8.363 392 HE2 LYS 48 HE2 LYS 48 -13.373 -6.073 -6.518 393 HE3 LYS 48 HE3 LYS 48 -13.751 -6.025 -8.245 394 HZ1 LYS 48 HZ1 LYS 48 -11.525 -6.975 -7.491 395 HZ2 LYS 48 HZ2 LYS 48 -11.526 -5.974 -8.781 396 HZ3 LYS 48 HZ3 LYS 48 -11.035 -5.427 -7.323 397 H VAL 49 H VAL 49 -9.418 -3.988 -5.133 398 HA VAL 49 HA VAL 49 -9.110 -1.440 -3.709 399 HB VAL 49 HB VAL 49 -6.718 -1.951 -3.363 400 HG11 VAL 49 HG11 VAL 49 -6.960 -3.670 -1.595 401 HG12 VAL 49 HG12 VAL 49 -8.303 -2.477 -1.561 402 HG13 VAL 49 HG13 VAL 49 -8.571 -4.112 -2.254 403 HG21 VAL 49 HG21 VAL 49 -5.844 -4.239 -3.715 404 HG22 VAL 49 HG22 VAL 49 -7.403 -4.712 -4.472 405 HG23 VAL 49 HG23 VAL 49 -6.364 -3.473 -5.254 406 H SER 50 H SER 50 -8.204 0.234 -4.943 407 HA SER 50 HA SER 50 -7.557 -0.481 -7.738 408 HB2 SER 50 HB2 SER 50 -8.032 2.074 -8.017 409 HB3 SER 50 HB3 SER 50 -9.379 0.932 -7.920 410 HG SER 50 HG SER 50 -8.526 1.879 -5.420 411 H TYR 51 H TYR 51 -5.478 -0.233 -8.404 412 HA TYR 51 HA TYR 51 -3.593 1.037 -6.529 413 HB2 TYR 51 HB2 TYR 51 -3.693 -1.039 -8.736 414 HB3 TYR 51 HB3 TYR 51 -2.283 0.022 -8.845 415 HD1 TYR 51 HD1 TYR 51 -0.881 0.293 -6.637 416 HD2 TYR 51 HD2 TYR 51 -3.588 -2.948 -7.409 417 HE1 TYR 51 HE1 TYR 51 0.338 -1.107 -5.006 418 HE2 TYR 51 HE2 TYR 51 -2.382 -4.345 -5.760 419 HH TYR 51 HH TYR 51 -0.719 -3.545 -3.486 420 H ALA 52 H ALA 52 -2.507 2.988 -7.123 421 HA ALA 52 HA ALA 52 -2.790 3.835 -9.960 422 HB1 ALA 52 HB1 ALA 52 -3.025 6.177 -9.059 423 HB2 ALA 52 HB2 ALA 52 -4.443 5.114 -8.762 424 HB3 ALA 52 HB3 ALA 52 -3.291 5.459 -7.459 425 H VAL 53 H VAL 53 -0.682 3.778 -10.726 426 HA VAL 53 HA VAL 53 1.309 5.009 -8.986 427 HB VAL 53 HB VAL 53 2.988 3.284 -9.684 428 HG11 VAL 53 HG11 VAL 53 2.214 1.523 -8.131 429 HG12 VAL 53 HG12 VAL 53 1.924 3.172 -7.481 430 HG13 VAL 53 HG13 VAL 53 0.562 2.225 -8.168 431 HG21 VAL 53 HG21 VAL 53 2.187 1.113 -10.557 432 HG22 VAL 53 HG22 VAL 53 0.533 1.795 -10.716 433 HG23 VAL 53 HG23 VAL 53 1.876 2.459 -11.705 434 HA PRO 54 HA PRO 54 2.363 6.908 -12.899 435 HB2 PRO 54 HB2 PRO 54 4.654 8.204 -12.096 436 HB3 PRO 54 HB3 PRO 54 3.097 8.708 -11.428 437 HG2 PRO 54 HG2 PRO 54 5.230 6.954 -10.194 438 HG3 PRO 54 HG3 PRO 54 4.242 8.209 -9.436 439 HD2 PRO 54 HD2 PRO 54 3.702 5.482 -9.242 440 HD3 PRO 54 HD3 PRO 54 2.481 6.743 -9.024 441 H LYS 55 H LYS 55 2.837 5.339 -14.362 442 HA LYS 55 HA LYS 55 5.444 4.057 -14.202 443 HB2 LYS 55 HB2 LYS 55 3.460 2.616 -14.439 444 HB3 LYS 55 HB3 LYS 55 3.008 3.462 -15.925 445 HG2 LYS 55 HG2 LYS 55 5.061 2.659 -17.046 446 HG3 LYS 55 HG3 LYS 55 5.599 1.879 -15.552 447 HD2 LYS 55 HD2 LYS 55 3.711 0.337 -15.577 448 HD3 LYS 55 HD3 LYS 55 2.924 1.225 -16.888 449 HE2 LYS 55 HE2 LYS 55 3.932 -0.695 -17.905 450 HE3 LYS 55 HE3 LYS 55 4.942 0.685 -18.356 451 HZ1 LYS 55 HZ1 LYS 55 6.258 -1.180 -17.643 452 HZ2 LYS 55 HZ2 LYS 55 6.466 0.057 -16.597 453 HZ3 LYS 55 HZ3 LYS 55 5.533 -1.216 -16.180 454 HA PRO 56 HA PRO 56 7.306 6.701 -17.287 455 HB2 PRO 56 HB2 PRO 56 7.987 4.004 -18.605 456 HB3 PRO 56 HB3 PRO 56 9.077 5.361 -18.289 457 HG2 PRO 56 HG2 PRO 56 9.147 3.205 -16.710 458 HG3 PRO 56 HG3 PRO 56 9.321 4.819 -16.007 459 HD2 PRO 56 HD2 PRO 56 6.960 2.946 -15.910 460 HD3 PRO 56 HD3 PRO 56 7.492 4.137 -14.715 461 H ASN 57 H ASN 57 5.321 3.878 -18.386 462 HA ASN 57 HA ASN 57 4.872 5.142 -20.932 463 HB2 ASN 57 HB2 ASN 57 3.311 2.810 -19.722 464 HB3 ASN 57 HB3 ASN 57 3.564 3.184 -21.432 465 HD21 ASN 57 HD21 ASN 57 5.477 2.527 -22.456 466 HD22 ASN 57 HD22 ASN 57 6.639 1.487 -21.702 467 H GLY 58 H GLY 58 3.776 6.072 -17.927 468 HA2 GLY 58 HA2 GLY 58 2.109 7.862 -18.079 469 HA3 GLY 58 HA3 GLY 58 1.096 6.739 -18.996 470 H CYS 59 H CYS 59 0.009 7.872 -16.691 471 HA CYS 59 HA CYS 59 0.434 6.625 -14.300 472 HB2 CYS 59 HB2 CYS 59 -2.191 7.556 -15.537 473 HB3 CYS 59 HB3 CYS 59 -1.975 7.139 -13.832 474 H ARG 60 H ARG 60 0.291 4.516 -13.592 475 HA ARG 60 HA ARG 60 -1.396 2.728 -15.215 476 HB2 ARG 60 HB2 ARG 60 1.232 2.486 -14.811 477 HB3 ARG 60 HB3 ARG 60 0.710 1.790 -13.271 478 HG2 ARG 60 HG2 ARG 60 0.991 -0.035 -14.795 479 HG3 ARG 60 HG3 ARG 60 -0.751 0.173 -14.573 480 HD2 ARG 60 HD2 ARG 60 0.894 1.241 -16.927 481 HD3 ARG 60 HD3 ARG 60 -0.156 -0.182 -16.963 482 HE ARG 60 HE ARG 60 -1.012 2.648 -16.900 483 HH11 ARG 60 HH11 ARG 60 -1.927 -0.749 -16.827 484 HH12 ARG 60 HH12 ARG 60 -3.583 -0.436 -17.226 485 HH21 ARG 60 HH21 ARG 60 -3.185 3.044 -17.418 486 HH22 ARG 60 HH22 ARG 60 -4.300 1.726 -17.562 487 H LYS 61 H LYS 61 -3.172 1.805 -14.377 488 HA LYS 61 HA LYS 61 -3.457 1.945 -11.444 489 HB2 LYS 61 HB2 LYS 61 -5.808 2.316 -11.742 490 HB3 LYS 61 HB3 LYS 61 -4.971 3.492 -12.764 491 HG2 LYS 61 HG2 LYS 61 -5.593 2.415 -14.761 492 HG3 LYS 61 HG3 LYS 61 -5.850 0.855 -13.970 493 HD2 LYS 61 HD2 LYS 61 -7.797 1.984 -12.689 494 HD3 LYS 61 HD3 LYS 61 -7.617 3.343 -13.807 495 HE2 LYS 61 HE2 LYS 61 -9.329 1.896 -14.706 496 HE3 LYS 61 HE3 LYS 61 -7.903 1.730 -15.739 497 HZ1 LYS 61 HZ1 LYS 61 -9.027 -0.372 -15.049 498 HZ2 LYS 61 HZ2 LYS 61 -7.418 -0.335 -14.776 499 HZ3 LYS 61 HZ3 LYS 61 -8.462 -0.138 -13.536 500 H TRP 62 H TRP 62 -4.570 0.083 -10.448 501 HA TRP 62 HA TRP 62 -5.321 -2.169 -12.206 502 HB2 TRP 62 HB2 TRP 62 -2.708 -2.099 -11.576 503 HB3 TRP 62 HB3 TRP 62 -3.292 -2.632 -9.994 504 HD1 TRP 62 HD1 TRP 62 -3.540 -5.199 -9.729 505 HE1 TRP 62 HE1 TRP 62 -3.725 -7.214 -11.339 506 HE3 TRP 62 HE3 TRP 62 -3.751 -2.652 -14.185 507 HZ2 TRP 62 HZ2 TRP 62 -3.951 -7.676 -14.106 508 HZ3 TRP 62 HZ3 TRP 62 -3.953 -3.958 -16.288 509 HH2 TRP 62 HH2 TRP 62 -4.053 -6.433 -16.244 510 H GLU 63 H GLU 63 -6.992 -3.349 -11.222 511 HA GLU 63 HA GLU 63 -7.544 -2.443 -8.418 512 HB2 GLU 63 HB2 GLU 63 -9.994 -2.969 -9.019 513 HB3 GLU 63 HB3 GLU 63 -9.313 -1.452 -9.622 514 HG2 GLU 63 HG2 GLU 63 -9.555 -3.967 -11.330 515 HG3 GLU 63 HG3 GLU 63 -10.823 -2.739 -11.218 516 H THR 64 H THR 64 -7.500 -4.171 -7.074 517 HA THR 64 HA THR 64 -7.572 -6.861 -8.229 518 HB THR 64 HB THR 64 -6.296 -6.224 -5.545 519 HG1 THR 64 HG1 THR 64 -4.350 -5.682 -6.527 520 HG21 THR 64 HG21 THR 64 -4.877 -8.182 -6.163 521 HG22 THR 64 HG22 THR 64 -6.626 -8.588 -6.216 522 HG23 THR 64 HG23 THR 64 -5.727 -8.288 -7.742 523 H THR 65 H THR 65 -8.464 -8.554 -6.693 524 HA THR 65 HA THR 65 -10.369 -7.464 -4.717 525 HB THR 65 HB THR 65 -10.720 -10.088 -6.114 526 HG1 THR 65 HG1 THR 65 -12.166 -8.343 -7.487 527 HG21 THR 65 HG21 THR 65 -13.102 -9.521 -5.811 528 HG22 THR 65 HG22 THR 65 -12.203 -9.486 -4.257 529 HG23 THR 65 HG23 THR 65 -12.632 -7.949 -5.080 530 H PHE 66 H PHE 66 -10.341 -8.278 -2.596 531 HA PHE 66 HA PHE 66 -8.620 -10.644 -2.263 532 HB2 PHE 66 HB2 PHE 66 -8.740 -8.282 -0.330 533 HB3 PHE 66 HB3 PHE 66 -7.655 -9.677 -0.259 534 HD1 PHE 66 HD1 PHE 66 -6.627 -9.888 -3.004 535 HD2 PHE 66 HD2 PHE 66 -7.428 -6.401 -0.632 536 HE1 PHE 66 HE1 PHE 66 -4.930 -8.627 -4.290 537 HE2 PHE 66 HE2 PHE 66 -5.729 -5.137 -1.910 538 HZ PHE 66 HZ PHE 66 -4.477 -6.246 -3.747 539 H LYS 67 H LYS 67 -8.982 -11.677 -0.015 540 HA LYS 67 HA LYS 67 -11.862 -11.535 0.638 541 HB2 LYS 67 HB2 LYS 67 -9.861 -13.802 0.453 542 HB3 LYS 67 HB3 LYS 67 -11.215 -13.920 1.584 543 HG2 LYS 67 HG2 LYS 67 -11.728 -15.023 -0.561 544 HG3 LYS 67 HG3 LYS 67 -12.831 -13.676 -0.250 545 HD2 LYS 67 HD2 LYS 67 -11.597 -12.221 -1.783 546 HD3 LYS 67 HD3 LYS 67 -10.317 -13.426 -1.976 547 HE2 LYS 67 HE2 LYS 67 -11.799 -14.954 -3.135 548 HE3 LYS 67 HE3 LYS 67 -13.229 -14.008 -2.700 549 HZ1 LYS 67 HZ1 LYS 67 -11.837 -13.755 -4.979 550 HZ2 LYS 67 HZ2 LYS 67 -12.867 -12.635 -4.387 551 HZ3 LYS 67 HZ3 LYS 67 -11.263 -12.494 -4.115 552 H LYS 68 H LYS 68 -12.393 -11.447 2.896 553 HA LYS 68 HA LYS 68 -10.435 -10.254 4.504 554 HB2 LYS 68 HB2 LYS 68 -12.826 -9.740 4.722 555 HB3 LYS 68 HB3 LYS 68 -13.163 -11.399 5.232 556 HG2 LYS 68 HG2 LYS 68 -12.415 -11.044 7.369 557 HG3 LYS 68 HG3 LYS 68 -11.069 -10.022 6.849 558 HD2 LYS 68 HD2 LYS 68 -12.687 -8.686 8.127 559 HD3 LYS 68 HD3 LYS 68 -12.642 -8.131 6.449 560 HE2 LYS 68 HE2 LYS 68 -14.646 -9.658 5.991 561 HE3 LYS 68 HE3 LYS 68 -14.740 -9.946 7.734 562 HZ1 LYS 68 HZ1 LYS 68 -16.013 -7.993 6.543 563 HZ2 LYS 68 HZ2 LYS 68 -15.506 -7.880 8.091 564 HZ3 LYS 68 HZ3 LYS 68 -14.643 -7.179 6.895 565 H THR 69 H THR 69 -9.114 -11.033 6.152 566 HA THR 69 HA THR 69 -9.553 -13.783 7.089 567 HB THR 69 HB THR 69 -6.839 -12.830 6.063 568 HG1 THR 69 HG1 THR 69 -7.939 -14.824 4.522 569 HG21 THR 69 HG21 THR 69 -6.327 -15.259 6.144 570 HG22 THR 69 HG22 THR 69 -6.847 -14.637 7.747 571 HG23 THR 69 HG23 THR 69 -7.991 -15.584 6.737 572 H SER 70 H SER 70 -10.060 -12.879 9.166 573 HA SER 70 HA SER 70 -8.497 -10.827 10.352 574 HB2 SER 70 HB2 SER 70 -10.328 -12.899 11.662 575 HB3 SER 70 HB3 SER 70 -9.776 -11.378 12.377 576 HG SER 70 HG SER 70 -11.917 -11.200 11.457 577 H ASP 71 H ASP 71 -6.430 -12.191 9.536 578 HA ASP 71 HA ASP 71 -5.558 -14.387 11.105 579 HB2 ASP 71 HB2 ASP 71 -4.569 -14.043 8.974 580 HB3 ASP 71 HB3 ASP 71 -4.306 -12.319 9.263 581 H ASP 72 H ASP 72 -4.467 -10.898 11.136 582 HA ASP 72 HA ASP 72 -3.948 -11.263 14.027 583 HB2 ASP 72 HB2 ASP 72 -2.043 -10.823 12.099 584 HB3 ASP 72 HB3 ASP 72 -2.497 -9.156 12.476 585 H GLY 73 H GLY 73 -6.314 -10.599 13.682 586 HA2 GLY 73 HA2 GLY 73 -7.911 -9.440 14.390 587 HA3 GLY 73 HA3 GLY 73 -6.869 -8.017 14.519 588 H GLU 74 H GLU 74 -6.390 -7.000 11.921 589 HA GLU 74 HA GLU 74 -8.997 -7.439 10.517 590 HB2 GLU 74 HB2 GLU 74 -7.628 -4.737 10.635 591 HB3 GLU 74 HB3 GLU 74 -9.196 -5.148 9.928 592 HG2 GLU 74 HG2 GLU 74 -9.776 -5.934 12.399 593 HG3 GLU 74 HG3 GLU 74 -8.419 -4.890 12.842 594 H VAL 75 H VAL 75 -7.007 -9.074 9.826 595 HA VAL 75 HA VAL 75 -5.300 -7.772 7.835 596 HB VAL 75 HB VAL 75 -5.343 -10.558 9.095 597 HG11 VAL 75 HG11 VAL 75 -3.270 -11.046 7.848 598 HG12 VAL 75 HG12 VAL 75 -4.679 -10.802 6.761 599 HG13 VAL 75 HG13 VAL 75 -3.455 -9.501 6.951 600 HG21 VAL 75 HG21 VAL 75 -3.116 -9.863 9.980 601 HG22 VAL 75 HG22 VAL 75 -3.322 -8.259 9.198 602 HG23 VAL 75 HG23 VAL 75 -4.429 -8.762 10.520 603 H TYR 76 H TYR 76 -5.045 -8.998 5.672 604 HA TYR 76 HA TYR 76 -7.493 -10.422 4.883 605 HB2 TYR 76 HB2 TYR 76 -6.278 -7.963 3.543 606 HB3 TYR 76 HB3 TYR 76 -7.410 -9.055 2.734 607 HD1 TYR 76 HD1 TYR 76 -7.034 -6.494 5.379 608 HD2 TYR 76 HD2 TYR 76 -9.778 -9.127 3.384 609 HE1 TYR 76 HE1 TYR 76 -8.936 -5.253 6.362 610 HE2 TYR 76 HE2 TYR 76 -11.681 -7.893 4.367 611 HH TYR 76 HH TYR 76 -11.139 -5.073 6.536 612 H TYR 77 H TYR 77 -7.177 -11.780 2.925 613 HA TYR 77 HA TYR 77 -4.340 -12.143 2.248 614 HB2 TYR 77 HB2 TYR 77 -6.329 -14.172 3.312 615 HB3 TYR 77 HB3 TYR 77 -5.096 -14.693 2.156 616 HD1 TYR 77 HD1 TYR 77 -5.358 -12.707 5.367 617 HD2 TYR 77 HD2 TYR 77 -3.061 -15.447 2.987 618 HE1 TYR 77 HE1 TYR 77 -3.705 -12.909 7.198 619 HE2 TYR 77 HE2 TYR 77 -1.402 -15.644 4.811 620 HH TYR 77 HH TYR 77 -1.936 -14.091 7.980 621 H SER 78 H SER 78 -3.994 -12.152 0.046 622 HA SER 78 HA SER 78 -6.395 -12.394 -1.652 623 HB2 SER 78 HB2 SER 78 -3.687 -11.792 -2.797 624 HB3 SER 78 HB3 SER 78 -5.248 -11.030 -3.130 625 HG SER 78 HG SER 78 -4.589 -9.444 -1.870 626 H GLU 79 H GLU 79 -6.730 -14.721 -1.656 627 HA GLU 79 HA GLU 79 -4.553 -16.507 -1.994 628 HB2 GLU 79 HB2 GLU 79 -7.046 -16.864 -1.131 629 HB3 GLU 79 HB3 GLU 79 -7.487 -16.942 -2.842 630 HG2 GLU 79 HG2 GLU 79 -5.604 -18.823 -1.348 631 HG3 GLU 79 HG3 GLU 79 -7.230 -19.193 -1.938 632 H GLU 80 H GLU 80 -7.004 -15.091 -4.326 633 HA GLU 80 HA GLU 80 -6.130 -16.534 -6.559 634 HB2 GLU 80 HB2 GLU 80 -7.355 -13.735 -6.413 635 HB3 GLU 80 HB3 GLU 80 -7.315 -14.782 -7.837 636 HG2 GLU 80 HG2 GLU 80 -9.192 -15.840 -7.200 637 HG3 GLU 80 HG3 GLU 80 -8.500 -16.240 -5.623 638 H ALA 81 H ALA 81 -4.543 -13.908 -4.825 639 HA ALA 81 HA ALA 81 -2.795 -13.516 -7.146 640 HB1 ALA 81 HB1 ALA 81 -2.160 -11.384 -6.030 641 HB2 ALA 81 HB2 ALA 81 -3.913 -11.474 -6.409 642 HB3 ALA 81 HB3 ALA 81 -3.344 -11.740 -4.727 643 H LYS 82 H LYS 82 -2.860 -15.073 -4.055 644 HA LYS 82 HA LYS 82 -1.252 -16.145 -2.906 645 HB2 LYS 82 HB2 LYS 82 0.788 -15.455 -5.032 646 HB3 LYS 82 HB3 LYS 82 0.720 -16.861 -3.961 647 HG2 LYS 82 HG2 LYS 82 -1.183 -16.295 -6.287 648 HG3 LYS 82 HG3 LYS 82 0.160 -17.445 -6.302 649 HD2 LYS 82 HD2 LYS 82 -0.900 -18.838 -4.612 650 HD3 LYS 82 HD3 LYS 82 -2.132 -17.613 -4.283 651 HE2 LYS 82 HE2 LYS 82 -3.063 -17.871 -6.552 652 HE3 LYS 82 HE3 LYS 82 -1.766 -18.988 -6.995 653 HZ1 LYS 82 HZ1 LYS 82 -3.870 -20.056 -6.346 654 HZ2 LYS 82 HZ2 LYS 82 -2.600 -20.562 -5.453 655 HZ3 LYS 82 HZ3 LYS 82 -3.679 -19.514 -4.817 656 H LYS 83 H LYS 83 -1.861 -13.594 -2.074 657 HA LYS 83 HA LYS 83 0.742 -12.581 -1.214 658 HB2 LYS 83 HB2 LYS 83 -1.464 -10.753 -2.287 659 HB3 LYS 83 HB3 LYS 83 0.189 -10.309 -1.843 660 HG2 LYS 83 HG2 LYS 83 1.112 -11.432 -3.772 661 HG3 LYS 83 HG3 LYS 83 -0.423 -12.234 -4.130 662 HD2 LYS 83 HD2 LYS 83 -1.472 -9.975 -4.527 663 HD3 LYS 83 HD3 LYS 83 0.104 -9.221 -4.253 664 HE2 LYS 83 HE2 LYS 83 1.071 -10.523 -6.146 665 HE3 LYS 83 HE3 LYS 83 -0.489 -11.314 -6.410 666 HZ1 LYS 83 HZ1 LYS 83 0.021 -9.325 -7.820 667 HZ2 LYS 83 HZ2 LYS 83 -1.431 -9.293 -7.073 668 HZ3 LYS 83 HZ3 LYS 83 -0.198 -8.387 -6.502 669 H LYS 84 H LYS 84 0.748 -11.691 0.858 670 HA LYS 84 HA LYS 84 -1.850 -11.871 2.271 671 HB2 LYS 84 HB2 LYS 84 0.123 -13.400 2.944 672 HB3 LYS 84 HB3 LYS 84 1.001 -11.936 3.406 673 HG2 LYS 84 HG2 LYS 84 -1.744 -12.496 4.575 674 HG3 LYS 84 HG3 LYS 84 -0.317 -13.318 5.219 675 HD2 LYS 84 HD2 LYS 84 0.772 -11.106 5.635 676 HD3 LYS 84 HD3 LYS 84 -0.653 -10.282 4.987 677 HE2 LYS 84 HE2 LYS 84 -0.962 -10.237 7.342 678 HE3 LYS 84 HE3 LYS 84 -2.032 -11.527 6.780 679 HZ1 LYS 84 HZ1 LYS 84 -0.677 -12.091 8.738 680 HZ2 LYS 84 HZ2 LYS 84 -0.465 -13.134 7.500 681 HZ3 LYS 84 HZ3 LYS 84 0.678 -12.016 7.830 682 H VAL 85 H VAL 85 -2.477 -10.021 3.599 683 HA VAL 85 HA VAL 85 -0.549 -7.762 3.648 684 HB VAL 85 HB VAL 85 -2.593 -6.268 3.190 685 HG11 VAL 85 HG11 VAL 85 -2.428 -6.520 0.715 686 HG12 VAL 85 HG12 VAL 85 -0.822 -6.628 1.512 687 HG13 VAL 85 HG13 VAL 85 -1.645 -8.120 0.943 688 HG21 VAL 85 HG21 VAL 85 -4.461 -7.216 1.886 689 HG22 VAL 85 HG22 VAL 85 -3.801 -8.865 2.153 690 HG23 VAL 85 HG23 VAL 85 -4.376 -7.892 3.548 691 H GLU 86 H GLU 86 -0.405 -6.941 5.698 692 HA GLU 86 HA GLU 86 -2.736 -7.311 7.473 693 HB2 GLU 86 HB2 GLU 86 -1.203 -7.906 9.325 694 HB3 GLU 86 HB3 GLU 86 -1.311 -9.142 8.065 695 HG2 GLU 86 HG2 GLU 86 0.884 -7.706 7.207 696 HG3 GLU 86 HG3 GLU 86 1.017 -7.517 8.960 697 H VAL 87 H VAL 87 -3.378 -5.338 8.123 698 HA VAL 87 HA VAL 87 -1.729 -3.049 7.755 699 HB VAL 87 HB VAL 87 -4.139 -2.856 7.592 700 HG11 VAL 87 HG11 VAL 87 -5.650 -3.179 9.526 701 HG12 VAL 87 HG12 VAL 87 -4.816 -4.697 9.051 702 HG13 VAL 87 HG13 VAL 87 -4.264 -3.784 10.496 703 HG21 VAL 87 HG21 VAL 87 -4.583 -1.005 9.186 704 HG22 VAL 87 HG22 VAL 87 -3.130 -1.482 10.128 705 HG23 VAL 87 HG23 VAL 87 -2.952 -0.885 8.443 706 H LEU 88 H LEU 88 -0.050 -2.439 9.116 707 HA LEU 88 HA LEU 88 0.329 -3.775 11.629 708 HB2 LEU 88 HB2 LEU 88 1.689 -1.312 10.406 709 HB3 LEU 88 HB3 LEU 88 2.284 -2.243 11.787 710 HG LEU 88 HG LEU 88 1.990 -3.300 8.943 711 HD11 LEU 88 HD11 LEU 88 4.460 -3.238 8.898 712 HD12 LEU 88 HD12 LEU 88 3.748 -1.602 9.105 713 HD13 LEU 88 HD13 LEU 88 4.465 -2.454 10.514 714 HD21 LEU 88 HD21 LEU 88 3.304 -5.224 9.779 715 HD22 LEU 88 HD22 LEU 88 3.249 -4.534 11.436 716 HD23 LEU 88 HD23 LEU 88 1.732 -5.060 10.632 717 H ASP 89 H ASP 89 -0.414 -0.332 10.583 718 HA ASP 89 HA ASP 89 -2.157 0.026 12.817 719 HB2 ASP 89 HB2 ASP 89 0.314 0.352 13.689 720 HB3 ASP 89 HB3 ASP 89 0.226 1.890 12.820 721 H THR 90 H THR 90 -3.349 2.076 12.590 722 HA THR 90 HA THR 90 -2.718 3.729 10.302 723 HB THR 90 HB THR 90 -4.012 1.798 9.370 724 HG1 THR 90 HG1 THR 90 -5.230 3.131 8.083 725 HG21 THR 90 HG21 THR 90 -6.432 1.625 9.894 726 HG22 THR 90 HG22 THR 90 -5.406 1.279 11.327 727 HG23 THR 90 HG23 THR 90 -6.234 2.866 11.177 728 H ASP 91 H ASP 91 -3.514 5.848 10.570 729 HA ASP 91 HA ASP 91 -4.871 6.276 13.130 730 HB2 ASP 91 HB2 ASP 91 -2.686 7.468 12.491 731 HB3 ASP 91 HB3 ASP 91 -3.631 8.365 11.295 732 H TYR 92 H TYR 92 -6.897 7.296 13.271 733 HA TYR 92 HA TYR 92 -8.563 7.097 10.977 734 HB2 TYR 92 HB2 TYR 92 -9.051 8.462 13.666 735 HB3 TYR 92 HB3 TYR 92 -10.284 8.028 12.474 736 HD1 TYR 92 HD1 TYR 92 -7.948 6.727 15.030 737 HD2 TYR 92 HD2 TYR 92 -10.963 5.682 12.154 738 HE1 TYR 92 HE1 TYR 92 -8.149 4.487 16.060 739 HE2 TYR 92 HE2 TYR 92 -11.170 3.442 13.187 740 HH TYR 92 HH TYR 92 -10.468 2.056 14.765 741 H LYS 93 H LYS 93 -6.612 9.734 12.389 742 HA LYS 93 HA LYS 93 -7.652 11.489 10.269 743 HB2 LYS 93 HB2 LYS 93 -6.727 12.355 13.037 744 HB3 LYS 93 HB3 LYS 93 -7.445 13.366 11.776 745 HG2 LYS 93 HG2 LYS 93 -9.596 12.139 11.999 746 HG3 LYS 93 HG3 LYS 93 -8.882 11.092 13.232 747 HD2 LYS 93 HD2 LYS 93 -8.330 13.253 14.549 748 HD3 LYS 93 HD3 LYS 93 -9.367 14.106 13.398 749 HE2 LYS 93 HE2 LYS 93 -10.229 11.735 15.136 750 HE3 LYS 93 HE3 LYS 93 -10.578 13.434 15.483 751 HZ1 LYS 93 HZ1 LYS 93 -12.433 12.472 14.409 752 HZ2 LYS 93 HZ2 LYS 93 -11.757 13.495 13.331 753 HZ3 LYS 93 HZ3 LYS 93 -11.544 11.884 13.172 754 H SER 94 H SER 94 -5.181 9.565 10.485 755 HA SER 94 HA SER 94 -3.383 11.638 9.481 756 HB2 SER 94 HB2 SER 94 -2.946 11.308 12.018 757 HB3 SER 94 HB3 SER 94 -2.631 9.597 11.701 758 HG SER 94 HG SER 94 -0.639 10.145 11.201 759 H TYR 95 H TYR 95 -1.108 9.657 9.588 760 HA TYR 95 HA TYR 95 -1.769 8.368 7.084 761 HB2 TYR 95 HB2 TYR 95 0.642 7.839 7.058 762 HB3 TYR 95 HB3 TYR 95 0.398 9.554 7.414 763 HD1 TYR 95 HD1 TYR 95 0.779 10.429 9.712 764 HD2 TYR 95 HD2 TYR 95 1.566 6.322 8.735 765 HE1 TYR 95 HE1 TYR 95 2.101 10.191 11.791 766 HE2 TYR 95 HE2 TYR 95 2.885 6.079 10.816 767 HH TYR 95 HH TYR 95 2.680 8.022 13.362 768 H ALA 96 H ALA 96 -0.554 6.021 6.936 769 HA ALA 96 HA ALA 96 -0.868 4.434 9.336 770 HB1 ALA 96 HB1 ALA 96 -2.444 2.893 8.277 771 HB2 ALA 96 HB2 ALA 96 -3.145 4.529 8.521 772 HB3 ALA 96 HB3 ALA 96 -2.601 4.019 6.887 773 H VAL 97 H VAL 97 -0.070 2.186 9.068 774 HA VAL 97 HA VAL 97 1.657 1.965 6.704 775 HB VAL 97 HB VAL 97 3.329 0.798 8.177 776 HG11 VAL 97 HG11 VAL 97 4.273 2.879 9.131 777 HG12 VAL 97 HG12 VAL 97 3.653 3.124 7.464 778 HG13 VAL 97 HG13 VAL 97 2.699 3.704 8.871 779 HG21 VAL 97 HG21 VAL 97 3.242 1.208 10.615 780 HG22 VAL 97 HG22 VAL 97 1.623 1.962 10.425 781 HG23 VAL 97 HG23 VAL 97 1.853 0.221 10.048 782 H ILE 98 H ILE 98 1.271 0.069 5.566 783 HA ILE 98 HA ILE 98 -0.075 -2.079 7.060 784 HB ILE 98 HB ILE 98 -0.210 -1.622 4.049 785 HG12 ILE 98 HG12 ILE 98 -1.105 0.397 5.027 786 HG13 ILE 98 HG13 ILE 98 -2.434 -0.584 4.396 787 HG21 ILE 98 HG21 ILE 98 -2.250 -3.018 4.242 788 HG22 ILE 98 HG22 ILE 98 -0.789 -3.871 4.845 789 HG23 ILE 98 HG23 ILE 98 -1.967 -3.173 6.009 790 HD11 ILE 98 HD11 ILE 98 -3.017 0.405 6.565 791 HD12 ILE 98 HD12 ILE 98 -2.947 -1.386 6.684 792 HD13 ILE 98 HD13 ILE 98 -1.597 -0.389 7.325 793 H TYR 99 H TYR 99 0.776 -4.207 6.852 794 HA TYR 99 HA TYR 99 3.399 -4.304 5.542 795 HB2 TYR 99 HB2 TYR 99 3.105 -4.974 7.983 796 HB3 TYR 99 HB3 TYR 99 2.034 -6.279 7.456 797 HD1 TYR 99 HD1 TYR 99 2.946 -8.220 6.176 798 HD2 TYR 99 HD2 TYR 99 5.513 -5.122 7.680 799 HE1 TYR 99 HE1 TYR 99 4.912 -9.686 5.838 800 HE2 TYR 99 HE2 TYR 99 7.481 -6.583 7.335 801 HH TYR 99 HH TYR 99 7.371 -9.414 5.449 802 H ALA 100 H ALA 100 3.804 -5.741 3.821 803 HA ALA 100 HA ALA 100 1.737 -7.666 3.145 804 HB1 ALA 100 HB1 ALA 100 1.761 -6.921 0.783 805 HB2 ALA 100 HB2 ALA 100 1.114 -5.670 1.897 806 HB3 ALA 100 HB3 ALA 100 2.785 -5.523 1.255 807 H THR 101 H THR 101 2.386 -9.364 1.721 808 HA THR 101 HA THR 101 5.123 -9.526 0.885 809 HB THR 101 HB THR 101 4.108 -11.181 3.181 810 HG1 THR 101 HG1 THR 101 5.531 -9.037 3.167 811 HG21 THR 101 HG21 THR 101 6.129 -12.588 2.900 812 HG22 THR 101 HG22 THR 101 5.008 -12.732 1.504 813 HG23 THR 101 HG23 THR 101 6.497 -11.737 1.361 814 H ARG 102 H ARG 102 5.454 -11.248 -0.701 815 HA ARG 102 HA ARG 102 2.990 -12.737 -1.387 816 HB2 ARG 102 HB2 ARG 102 4.940 -11.231 -3.185 817 HB3 ARG 102 HB3 ARG 102 3.880 -12.509 -3.792 818 HG2 ARG 102 HG2 ARG 102 2.825 -10.392 -4.241 819 HG3 ARG 102 HG3 ARG 102 1.893 -11.202 -2.975 820 HD2 ARG 102 HD2 ARG 102 3.168 -9.872 -1.246 821 HD3 ARG 102 HD3 ARG 102 3.986 -9.010 -2.556 822 HE ARG 102 HE ARG 102 1.887 -7.963 -3.146 823 HH11 ARG 102 HH11 ARG 102 1.734 -9.969 -0.262 824 HH12 ARG 102 HH12 ARG 102 0.268 -9.253 0.318 825 HH21 ARG 102 HH21 ARG 102 -0.124 -7.097 -2.388 826 HH22 ARG 102 HH22 ARG 102 -0.780 -7.635 -0.878 827 H VAL 103 H VAL 103 3.426 -14.990 -1.908 828 HA VAL 103 HA VAL 103 6.282 -15.644 -1.720 829 HB VAL 103 HB VAL 103 3.888 -17.423 -1.029 830 HG11 VAL 103 HG11 VAL 103 5.591 -18.892 0.002 831 HG12 VAL 103 HG12 VAL 103 5.859 -18.683 -1.762 832 HG13 VAL 103 HG13 VAL 103 6.885 -17.794 -0.586 833 HG21 VAL 103 HG21 VAL 103 4.557 -17.098 1.331 834 HG22 VAL 103 HG22 VAL 103 5.801 -15.913 0.808 835 HG23 VAL 103 HG23 VAL 103 4.059 -15.558 0.553 836 H LYS 104 H LYS 104 7.214 -16.472 -3.548 837 HA LYS 104 HA LYS 104 5.435 -17.818 -5.493 838 HB2 LYS 104 HB2 LYS 104 6.404 -15.503 -6.105 839 HB3 LYS 104 HB3 LYS 104 7.988 -16.291 -6.123 840 HG2 LYS 104 HG2 LYS 104 5.689 -17.412 -7.765 841 HG3 LYS 104 HG3 LYS 104 6.636 -16.040 -8.357 842 HD2 LYS 104 HD2 LYS 104 7.932 -18.644 -7.412 843 HD3 LYS 104 HD3 LYS 104 7.407 -18.397 -9.082 844 HE2 LYS 104 HE2 LYS 104 9.341 -16.538 -7.608 845 HE3 LYS 104 HE3 LYS 104 9.856 -17.880 -8.638 846 HZ1 LYS 104 HZ1 LYS 104 9.855 -15.990 -9.974 847 HZ2 LYS 104 HZ2 LYS 104 8.489 -16.768 -10.416 848 HZ3 LYS 104 HZ3 LYS 104 8.404 -15.456 -9.447 849 H ASP 105 H ASP 105 6.418 -19.672 -6.586 850 HA ASP 105 HA ASP 105 7.612 -21.480 -5.092 851 HB2 ASP 105 HB2 ASP 105 7.813 -20.910 -8.070 852 HB3 ASP 105 HB3 ASP 105 8.754 -22.245 -7.391 853 H GLY 106 H GLY 106 9.293 -21.218 -3.678 854 HA2 GLY 106 HA2 GLY 106 11.506 -21.427 -3.228 855 HA3 GLY 106 HA3 GLY 106 11.907 -20.952 -4.884 856 H ARG 107 H ARG 107 9.844 -18.446 -4.016 857 HA ARG 107 HA ARG 107 11.767 -17.085 -2.348 858 HB2 ARG 107 HB2 ARG 107 12.614 -16.774 -4.684 859 HB3 ARG 107 HB3 ARG 107 11.050 -16.099 -5.158 860 HG2 ARG 107 HG2 ARG 107 11.374 -14.122 -3.861 861 HG3 ARG 107 HG3 ARG 107 12.685 -14.844 -2.919 862 HD2 ARG 107 HD2 ARG 107 12.818 -14.307 -5.932 863 HD3 ARG 107 HD3 ARG 107 13.452 -13.210 -4.697 864 HE ARG 107 HE ARG 107 14.873 -15.278 -3.997 865 HH11 ARG 107 HH11 ARG 107 13.893 -14.570 -7.305 866 HH12 ARG 107 HH12 ARG 107 15.256 -15.378 -8.005 867 HH21 ARG 107 HH21 ARG 107 16.643 -16.331 -4.930 868 HH22 ARG 107 HH22 ARG 107 16.821 -16.380 -6.652 869 H THR 108 H THR 108 10.931 -15.499 -1.064 870 HA THR 108 HA THR 108 8.097 -14.835 -1.493 871 HB THR 108 HB THR 108 9.587 -14.564 1.111 872 HG1 THR 108 HG1 THR 108 8.805 -16.744 1.605 873 HG21 THR 108 HG21 THR 108 7.323 -14.927 2.042 874 HG22 THR 108 HG22 THR 108 7.367 -13.533 0.911 875 HG23 THR 108 HG23 THR 108 6.673 -15.101 0.377 876 H LEU 109 H LEU 109 7.455 -12.602 -1.539 877 HA LEU 109 HA LEU 109 9.763 -10.737 -1.383 878 HB2 LEU 109 HB2 LEU 109 7.148 -10.612 -2.949 879 HB3 LEU 109 HB3 LEU 109 8.336 -9.306 -2.845 880 HG LEU 109 HG LEU 109 10.036 -10.894 -3.879 881 HD11 LEU 109 HD11 LEU 109 9.149 -12.820 -5.148 882 HD12 LEU 109 HD12 LEU 109 8.913 -13.012 -3.378 883 HD13 LEU 109 HD13 LEU 109 7.529 -12.545 -4.423 884 HD21 LEU 109 HD21 LEU 109 9.154 -10.581 -6.170 885 HD22 LEU 109 HD22 LEU 109 7.537 -10.198 -5.488 886 HD23 LEU 109 HD23 LEU 109 8.931 -9.115 -5.157 887 H HIS 110 H HIS 110 9.667 -9.164 0.175 888 HA HIS 110 HA HIS 110 7.119 -9.029 1.706 889 HB2 HIS 110 HB2 HIS 110 10.033 -8.480 2.497 890 HB3 HIS 110 HB3 HIS 110 8.647 -8.015 3.492 891 HD2 HIS 110 HD2 HIS 110 10.058 -11.446 1.996 892 HE1 HIS 110 HE1 HIS 110 8.149 -12.184 5.753 893 H MET 111 H MET 111 6.259 -6.835 1.904 894 HA MET 111 HA MET 111 7.874 -4.568 1.000 895 HB2 MET 111 HB2 MET 111 6.998 -5.655 -1.100 896 HB3 MET 111 HB3 MET 111 5.354 -5.537 -0.459 897 HG2 MET 111 HG2 MET 111 5.675 -3.011 -0.355 898 HG3 MET 111 HG3 MET 111 7.207 -3.235 -1.210 899 HE1 MET 111 HE1 MET 111 6.381 -4.075 -4.754 900 HE2 MET 111 HE2 MET 111 7.575 -3.916 -3.422 901 HE3 MET 111 HE3 MET 111 6.636 -5.435 -3.610 902 H MET 112 H MET 112 7.513 -3.120 2.537 903 HA MET 112 HA MET 112 4.865 -3.055 3.820 904 HB2 MET 112 HB2 MET 112 7.575 -1.969 4.698 905 HB3 MET 112 HB3 MET 112 6.053 -1.701 5.558 906 HG2 MET 112 HG2 MET 112 5.811 -4.155 5.893 907 HG3 MET 112 HG3 MET 112 7.335 -4.421 5.037 908 HE1 MET 112 HE1 MET 112 10.037 -2.980 7.367 909 HE2 MET 112 HE2 MET 112 9.540 -3.374 5.687 910 HE3 MET 112 HE3 MET 112 9.151 -1.766 6.385 911 H ARG 113 H ARG 113 3.997 -0.781 4.206 912 HA ARG 113 HA ARG 113 5.232 1.337 2.721 913 HB2 ARG 113 HB2 ARG 113 2.629 0.073 1.812 914 HB3 ARG 113 HB3 ARG 113 3.060 1.745 1.426 915 HG2 ARG 113 HG2 ARG 113 4.968 1.065 0.130 916 HG3 ARG 113 HG3 ARG 113 4.899 -0.590 0.750 917 HD2 ARG 113 HD2 ARG 113 2.941 0.782 -1.150 918 HD3 ARG 113 HD3 ARG 113 3.968 -0.620 -1.478 919 HE ARG 113 HE ARG 113 1.351 -0.675 -0.322 920 HH11 ARG 113 HH11 ARG 113 4.487 -2.242 -0.057 921 HH12 ARG 113 HH12 ARG 113 3.833 -3.714 0.580 922 HH21 ARG 113 HH21 ARG 113 0.523 -2.577 0.621 923 HH22 ARG 113 HH22 ARG 113 1.581 -3.904 0.966 924 H LEU 114 H LEU 114 3.880 3.407 2.859 925 HA LEU 114 HA LEU 114 2.125 3.406 5.225 926 HB2 LEU 114 HB2 LEU 114 4.470 3.991 5.885 927 HB3 LEU 114 HB3 LEU 114 4.448 5.309 4.706 928 HG LEU 114 HG LEU 114 2.445 5.139 6.985 929 HD11 LEU 114 HD11 LEU 114 3.913 6.718 8.212 930 HD12 LEU 114 HD12 LEU 114 4.711 5.132 7.945 931 HD13 LEU 114 HD13 LEU 114 5.159 6.545 6.930 932 HD21 LEU 114 HD21 LEU 114 2.265 7.575 6.600 933 HD22 LEU 114 HD22 LEU 114 3.445 7.444 5.253 934 HD23 LEU 114 HD23 LEU 114 1.849 6.630 5.131 935 H TYR 115 H TYR 115 0.350 4.794 4.953 936 HA TYR 115 HA TYR 115 0.438 6.459 2.519 937 HB2 TYR 115 HB2 TYR 115 -1.867 6.038 2.118 938 HB3 TYR 115 HB3 TYR 115 -0.958 4.521 2.135 939 HD1 TYR 115 HD1 TYR 115 -1.288 2.870 3.952 940 HD2 TYR 115 HD2 TYR 115 -3.576 6.503 3.797 941 HE1 TYR 115 HE1 TYR 115 -2.921 1.908 5.545 942 HE2 TYR 115 HE2 TYR 115 -5.214 5.542 5.385 943 HH TYR 115 HH TYR 115 -4.937 2.143 6.494 944 H SER 116 H SER 116 -0.755 8.469 2.592 945 HA SER 116 HA SER 116 -0.976 9.435 5.379 946 HB2 SER 116 HB2 SER 116 -0.375 10.990 2.788 947 HB3 SER 116 HB3 SER 116 -0.460 11.679 4.414 948 HG SER 116 HG SER 116 1.646 11.274 4.391 949 H ARG 117 H ARG 117 -2.780 11.137 5.625 950 HA ARG 117 HA ARG 117 -5.158 10.193 4.501 951 HB2 ARG 117 HB2 ARG 117 -4.296 12.327 6.351 952 HB3 ARG 117 HB3 ARG 117 -5.651 12.846 5.341 953 HG2 ARG 117 HG2 ARG 117 -6.634 10.439 6.026 954 HG3 ARG 117 HG3 ARG 117 -5.525 10.630 7.390 955 HD2 ARG 117 HD2 ARG 117 -7.677 11.524 8.050 956 HD3 ARG 117 HD3 ARG 117 -6.556 12.880 7.874 957 HE ARG 117 HE ARG 117 -7.630 13.390 5.710 958 HH11 ARG 117 HH11 ARG 117 -9.341 11.138 7.811 959 HH12 ARG 117 HH12 ARG 117 -10.884 11.456 7.092 960 HH21 ARG 117 HH21 ARG 117 -9.671 13.802 4.793 961 HH22 ARG 117 HH22 ARG 117 -11.072 12.968 5.379 962 H SER 118 H SER 118 -2.766 12.494 3.237 963 HA SER 118 HA SER 118 -4.495 12.906 0.892 964 HB2 SER 118 HB2 SER 118 -2.945 15.173 2.219 965 HB3 SER 118 HB3 SER 118 -4.095 15.270 0.879 966 HG SER 118 HG SER 118 -5.040 15.933 2.908 967 HA PRO 119 HA PRO 119 -0.515 12.224 -1.066 968 HB2 PRO 119 HB2 PRO 119 -0.452 14.114 -3.113 969 HB3 PRO 119 HB3 PRO 119 -1.545 12.726 -3.191 970 HG2 PRO 119 HG2 PRO 119 -2.131 15.574 -2.347 971 HG3 PRO 119 HG3 PRO 119 -3.096 14.490 -3.358 972 HD2 PRO 119 HD2 PRO 119 -3.682 14.911 -0.717 973 HD3 PRO 119 HD3 PRO 119 -4.019 13.368 -1.512 974 H GLU 120 H GLU 120 0.230 13.204 1.202 975 HA GLU 120 HA GLU 120 2.441 14.924 0.524 976 HB2 GLU 120 HB2 GLU 120 1.813 16.606 2.309 977 HB3 GLU 120 HB3 GLU 120 0.944 16.722 0.773 978 HG2 GLU 120 HG2 GLU 120 -0.968 15.441 1.813 979 HG3 GLU 120 HG3 GLU 120 -0.104 15.473 3.356 980 H VAL 121 H VAL 121 4.145 13.998 1.580 981 HA VAL 121 HA VAL 121 3.573 12.071 3.640 982 HB VAL 121 HB VAL 121 6.229 13.425 2.700 983 HG11 VAL 121 HG11 VAL 121 7.374 11.440 3.652 984 HG12 VAL 121 HG12 VAL 121 6.461 12.349 4.903 985 HG13 VAL 121 HG13 VAL 121 5.795 10.819 4.240 986 HG21 VAL 121 HG21 VAL 121 6.594 11.413 1.315 987 HG22 VAL 121 HG22 VAL 121 5.002 10.810 1.805 988 HG23 VAL 121 HG23 VAL 121 5.103 12.293 0.840 989 H SER 122 H SER 122 3.823 12.406 5.857 990 HA SER 122 HA SER 122 4.436 15.119 6.782 991 HB2 SER 122 HB2 SER 122 3.247 14.262 8.875 992 HB3 SER 122 HB3 SER 122 2.238 14.440 7.433 993 HG SER 122 HG SER 122 1.898 12.390 8.504 994 HA PRO 123 HA PRO 123 8.258 13.899 8.635 995 HB2 PRO 123 HB2 PRO 123 8.051 15.498 10.976 996 HB3 PRO 123 HB3 PRO 123 8.635 16.119 9.427 997 HG2 PRO 123 HG2 PRO 123 5.883 16.328 10.655 998 HG3 PRO 123 HG3 PRO 123 6.792 17.536 9.737 999 HD2 PRO 123 HD2 PRO 123 4.783 16.153 8.565 1000 HD3 PRO 123 HD3 PRO 123 6.237 16.563 7.645 1001 H ALA 124 H ALA 124 5.335 14.067 10.795 1002 HA ALA 124 HA ALA 124 6.346 12.428 12.805 1003 HB1 ALA 124 HB1 ALA 124 3.960 12.036 13.349 1004 HB2 ALA 124 HB2 ALA 124 4.298 13.768 13.017 1005 HB3 ALA 124 HB3 ALA 124 3.489 12.756 11.773 1006 H ALA 125 H ALA 125 4.539 11.547 9.752 1007 HA ALA 125 HA ALA 125 4.429 8.780 10.343 1008 HB1 ALA 125 HB1 ALA 125 3.918 8.573 7.932 1009 HB2 ALA 125 HB2 ALA 125 2.971 9.893 8.697 1010 HB3 ALA 125 HB3 ALA 125 4.401 10.285 7.683 1011 H THR 126 H THR 126 6.806 10.907 8.651 1012 HA THR 126 HA THR 126 8.388 8.868 7.576 1013 HB THR 126 HB THR 126 9.197 11.667 8.524 1014 HG1 THR 126 HG1 THR 126 7.461 11.807 7.024 1015 HG21 THR 126 HG21 THR 126 10.957 11.472 6.793 1016 HG22 THR 126 HG22 THR 126 11.118 10.199 8.049 1017 HG23 THR 126 HG23 THR 126 10.423 9.793 6.443 1018 H ALA 127 H ALA 127 8.635 10.713 10.734 1019 HA ALA 127 HA ALA 127 10.977 9.363 11.561 1020 HB1 ALA 127 HB1 ALA 127 10.426 10.344 13.774 1021 HB2 ALA 127 HB2 ALA 127 10.303 11.552 12.451 1022 HB3 ALA 127 HB3 ALA 127 8.814 10.829 13.148 1023 H ILE 128 H ILE 128 7.439 8.712 12.070 1024 HA ILE 128 HA ILE 128 7.893 6.699 14.000 1025 HB ILE 128 HB ILE 128 5.525 7.324 12.196 1026 HG12 ILE 128 HG12 ILE 128 6.036 9.014 13.903 1027 HG13 ILE 128 HG13 ILE 128 4.530 8.170 14.284 1028 HG21 ILE 128 HG21 ILE 128 4.214 5.789 13.625 1029 HG22 ILE 128 HG22 ILE 128 5.500 4.927 12.716 1030 HG23 ILE 128 HG23 ILE 128 5.722 5.287 14.462 1031 HD11 ILE 128 HD11 ILE 128 5.883 8.518 16.304 1032 HD12 ILE 128 HD12 ILE 128 5.720 6.766 15.946 1033 HD13 ILE 128 HD13 ILE 128 7.250 7.623 15.559 1034 H PHE 129 H PHE 129 7.212 6.569 10.401 1035 HA PHE 129 HA PHE 129 7.195 3.813 10.131 1036 HB2 PHE 129 HB2 PHE 129 6.604 5.589 8.416 1037 HB3 PHE 129 HB3 PHE 129 8.335 5.852 8.167 1038 HD1 PHE 129 HD1 PHE 129 5.541 3.468 7.729 1039 HD2 PHE 129 HD2 PHE 129 9.691 4.254 6.957 1040 HE1 PHE 129 HE1 PHE 129 5.576 1.629 6.072 1041 HE2 PHE 129 HE2 PHE 129 9.734 2.412 5.301 1042 HZ PHE 129 HZ PHE 129 7.674 1.098 4.851 1043 H ARG 130 H ARG 130 10.000 6.103 10.360 1044 HA ARG 130 HA ARG 130 11.898 4.123 9.642 1045 HB2 ARG 130 HB2 ARG 130 12.238 6.602 9.438 1046 HB3 ARG 130 HB3 ARG 130 12.295 6.713 11.202 1047 HG2 ARG 130 HG2 ARG 130 14.187 4.829 10.922 1048 HG3 ARG 130 HG3 ARG 130 14.301 5.504 9.292 1049 HD2 ARG 130 HD2 ARG 130 14.493 7.130 11.877 1050 HD3 ARG 130 HD3 ARG 130 15.877 6.571 10.930 1051 HE ARG 130 HE ARG 130 14.561 7.950 9.041 1052 HH11 ARG 130 HH11 ARG 130 15.157 8.781 12.403 1053 HH12 ARG 130 HH12 ARG 130 15.181 10.487 12.104 1054 HH21 ARG 130 HH21 ARG 130 14.602 10.186 8.659 1055 HH22 ARG 130 HH22 ARG 130 14.864 11.287 9.970 1056 H LYS 131 H LYS 131 10.590 5.383 12.797 1057 HA LYS 131 HA LYS 131 12.404 4.259 14.527 1058 HB2 LYS 131 HB2 LYS 131 9.361 4.546 14.739 1059 HB3 LYS 131 HB3 LYS 131 10.398 4.095 16.099 1060 HG2 LYS 131 HG2 LYS 131 11.651 6.270 15.805 1061 HG3 LYS 131 HG3 LYS 131 10.502 6.721 14.538 1062 HD2 LYS 131 HD2 LYS 131 8.617 6.445 16.197 1063 HD3 LYS 131 HD3 LYS 131 9.808 6.092 17.455 1064 HE2 LYS 131 HE2 LYS 131 10.899 8.348 16.929 1065 HE3 LYS 131 HE3 LYS 131 9.528 8.691 15.865 1066 HZ1 LYS 131 HZ1 LYS 131 9.188 9.585 18.061 1067 HZ2 LYS 131 HZ2 LYS 131 8.071 8.430 17.771 1068 HZ3 LYS 131 HZ3 LYS 131 9.336 8.114 18.754 1069 H LEU 132 H LEU 132 9.421 2.696 13.064 1070 HA LEU 132 HA LEU 132 9.908 0.201 14.351 1071 HB2 LEU 132 HB2 LEU 132 8.271 0.930 11.884 1072 HB3 LEU 132 HB3 LEU 132 8.224 -0.628 12.719 1073 HG LEU 132 HG LEU 132 7.403 2.054 13.916 1074 HD11 LEU 132 HD11 LEU 132 5.111 1.129 13.806 1075 HD12 LEU 132 HD12 LEU 132 5.852 1.283 12.177 1076 HD13 LEU 132 HD13 LEU 132 5.745 -0.327 12.967 1077 HD21 LEU 132 HD21 LEU 132 6.518 0.696 15.783 1078 HD22 LEU 132 HD22 LEU 132 7.213 -0.780 15.032 1079 HD23 LEU 132 HD23 LEU 132 8.298 0.527 15.614 1080 H ALA 133 H ALA 133 10.630 1.593 11.062 1081 HA ALA 133 HA ALA 133 11.580 -0.712 9.869 1082 HB1 ALA 133 HB1 ALA 133 12.829 0.846 8.394 1083 HB2 ALA 133 HB2 ALA 133 11.141 1.392 8.673 1084 HB3 ALA 133 HB3 ALA 133 12.497 2.186 9.542 1085 H GLY 134 H GLY 134 13.325 1.618 12.084 1086 HA2 GLY 134 HA2 GLY 134 15.869 0.430 11.644 1087 HA3 GLY 134 HA3 GLY 134 15.395 1.516 12.957 1088 H GLU 135 H GLU 135 13.112 -0.271 13.869 1089 HA GLU 135 HA GLU 135 14.562 -1.801 15.740 1090 HB2 GLU 135 HB2 GLU 135 12.345 -0.968 16.238 1091 HB3 GLU 135 HB3 GLU 135 11.655 -1.754 14.812 1092 HG2 GLU 135 HG2 GLU 135 12.332 -3.995 15.876 1093 HG3 GLU 135 HG3 GLU 135 12.691 -3.085 17.350 1094 H ARG 136 H ARG 136 13.417 -2.444 12.426 1095 HA ARG 136 HA ARG 136 13.853 -5.324 12.794 1096 HB2 ARG 136 HB2 ARG 136 12.904 -3.917 10.269 1097 HB3 ARG 136 HB3 ARG 136 12.626 -5.588 10.777 1098 HG2 ARG 136 HG2 ARG 136 11.121 -4.807 12.592 1099 HG3 ARG 136 HG3 ARG 136 11.430 -3.125 12.143 1100 HD2 ARG 136 HD2 ARG 136 9.469 -3.462 10.972 1101 HD3 ARG 136 HD3 ARG 136 10.628 -3.954 9.729 1102 HE ARG 136 HE ARG 136 9.918 -6.168 9.955 1103 HH11 ARG 136 HH11 ARG 136 8.612 -4.250 12.605 1104 HH12 ARG 136 HH12 ARG 136 7.528 -5.496 13.129 1105 HH21 ARG 136 HH21 ARG 136 8.488 -7.783 10.654 1106 HH22 ARG 136 HH22 ARG 136 7.459 -7.506 12.019 1107 H ASN 137 H ASN 137 16.001 -2.978 12.590 1108 HA ASN 137 HA ASN 137 17.986 -2.659 11.673 1109 HB2 ASN 137 HB2 ASN 137 17.631 -5.650 11.233 1110 HB3 ASN 137 HB3 ASN 137 19.093 -4.816 10.689 1111 HD21 ASN 137 HD21 ASN 137 19.758 -3.074 12.632 1112 HD22 ASN 137 HD22 ASN 137 20.006 -3.872 14.149 1113 H TYR 138 H TYR 138 15.771 -1.869 9.989 1114 HA TYR 138 HA TYR 138 16.067 -2.942 7.377 1115 HB2 TYR 138 HB2 TYR 138 14.427 -1.314 6.832 1116 HB3 TYR 138 HB3 TYR 138 14.159 -1.453 8.575 1117 HD1 TYR 138 HD1 TYR 138 15.860 0.225 9.987 1118 HD2 TYR 138 HD2 TYR 138 14.424 0.852 5.988 1119 HE1 TYR 138 HE1 TYR 138 16.242 2.658 10.233 1120 HE2 TYR 138 HE2 TYR 138 14.802 3.286 6.232 1121 HH TYR 138 HH TYR 138 15.291 4.947 7.645 1122 H THR 139 H THR 139 16.892 -1.722 5.455 1123 HA THR 139 HA THR 139 19.248 -0.063 6.174 1124 HB THR 139 HB THR 139 19.858 -0.803 3.725 1125 HG1 THR 139 HG1 THR 139 18.458 -2.159 2.829 1126 HG21 THR 139 HG21 THR 139 20.903 -2.889 4.583 1127 HG22 THR 139 HG22 THR 139 21.063 -1.541 5.760 1128 HG23 THR 139 HG23 THR 139 19.836 -2.825 6.026 1129 H ASP 140 H ASP 140 19.618 1.876 4.807 1130 HA ASP 140 HA ASP 140 17.319 3.348 4.436 1131 HB2 ASP 140 HB2 ASP 140 19.529 4.464 4.489 1132 HB3 ASP 140 HB3 ASP 140 20.189 3.383 3.254 1133 H GLU 141 H GLU 141 19.261 1.744 1.736 1134 HA GLU 141 HA GLU 141 17.478 2.485 -0.272 1135 HB2 GLU 141 HB2 GLU 141 19.292 0.035 -0.141 1136 HB3 GLU 141 HB3 GLU 141 18.572 0.718 -1.605 1137 HG2 GLU 141 HG2 GLU 141 19.815 2.913 -0.978 1138 HG3 GLU 141 HG3 GLU 141 20.724 1.925 0.174 1139 H MET 142 H MET 142 16.860 0.233 2.312 1140 HA MET 142 HA MET 142 15.242 -1.554 0.721 1141 HB2 MET 142 HB2 MET 142 16.372 -2.296 2.807 1142 HB3 MET 142 HB3 MET 142 15.533 -1.051 3.741 1143 HG2 MET 142 HG2 MET 142 13.335 -2.180 3.064 1144 HG3 MET 142 HG3 MET 142 14.306 -3.502 2.403 1145 HE1 MET 142 HE1 MET 142 15.849 -5.336 5.094 1146 HE2 MET 142 HE2 MET 142 16.259 -4.397 3.619 1147 HE3 MET 142 HE3 MET 142 16.736 -3.781 5.237 1148 H VAL 143 H VAL 143 14.828 1.573 2.298 1149 HA VAL 143 HA VAL 143 11.935 1.337 2.092 1150 HB VAL 143 HB VAL 143 13.605 3.324 3.669 1151 HG11 VAL 143 HG11 VAL 143 11.450 4.015 4.666 1152 HG12 VAL 143 HG12 VAL 143 11.509 4.321 2.897 1153 HG13 VAL 143 HG13 VAL 143 10.584 2.920 3.535 1154 HG21 VAL 143 HG21 VAL 143 12.686 2.149 5.650 1155 HG22 VAL 143 HG22 VAL 143 11.895 0.957 4.564 1156 HG23 VAL 143 HG23 VAL 143 13.687 1.065 4.625 1157 H ALA 144 H ALA 144 10.754 3.247 1.171 1158 HA ALA 144 HA ALA 144 12.463 5.023 -0.433 1159 HB1 ALA 144 HB1 ALA 144 10.855 4.714 -2.314 1160 HB2 ALA 144 HB2 ALA 144 11.674 3.174 -1.885 1161 HB3 ALA 144 HB3 ALA 144 9.984 3.471 -1.353 1162 H MET 145 H MET 145 11.874 7.127 -0.266 1163 HA MET 145 HA MET 145 9.241 7.714 0.852 1164 HB2 MET 145 HB2 MET 145 11.907 9.110 1.185 1165 HB3 MET 145 HB3 MET 145 10.365 9.867 1.605 1166 HG2 MET 145 HG2 MET 145 9.931 7.885 3.157 1167 HG3 MET 145 HG3 MET 145 11.594 7.370 2.847 1168 HE1 MET 145 HE1 MET 145 10.530 11.496 4.711 1169 HE2 MET 145 HE2 MET 145 9.974 10.891 3.114 1170 HE3 MET 145 HE3 MET 145 9.311 10.180 4.625 1171 H LEU 146 H LEU 146 7.916 9.318 -0.136 1172 HA LEU 146 HA LEU 146 9.120 10.496 -2.573 1173 HB2 LEU 146 HB2 LEU 146 6.260 9.601 -2.006 1174 HB3 LEU 146 HB3 LEU 146 6.785 10.467 -3.456 1175 HG LEU 146 HG LEU 146 6.578 8.179 -4.049 1176 HD11 LEU 146 HD11 LEU 146 8.874 7.539 -4.704 1177 HD12 LEU 146 HD12 LEU 146 8.544 9.280 -4.997 1178 HD13 LEU 146 HD13 LEU 146 9.531 8.779 -3.583 1179 HD21 LEU 146 HD21 LEU 146 7.744 6.339 -2.881 1180 HD22 LEU 146 HD22 LEU 146 8.332 7.506 -1.648 1181 HD23 LEU 146 HD23 LEU 146 6.573 7.188 -1.816 1182 HA PRO 147 HA PRO 147 8.143 14.211 -0.178 1183 HB2 PRO 147 HB2 PRO 147 9.911 15.824 -1.574 1184 HB3 PRO 147 HB3 PRO 147 10.523 14.693 -0.360 1185 HG2 PRO 147 HG2 PRO 147 10.388 14.366 -3.374 1186 HG3 PRO 147 HG3 PRO 147 11.728 14.005 -2.278 1187 HD2 PRO 147 HD2 PRO 147 10.058 12.046 -3.193 1188 HD3 PRO 147 HD3 PRO 147 10.791 11.959 -1.586 1189 H ARG 148 H ARG 148 8.212 16.713 -1.509 1190 HA ARG 148 HA ARG 148 5.700 16.647 -2.721 1191 HB2 ARG 148 HB2 ARG 148 5.944 19.010 -2.979 1192 HB3 ARG 148 HB3 ARG 148 6.782 18.583 -1.481 1193 HG2 ARG 148 HG2 ARG 148 8.212 18.984 -4.151 1194 HG3 ARG 148 HG3 ARG 148 7.955 20.280 -2.975 1195 HD2 ARG 148 HD2 ARG 148 9.352 17.655 -2.263 1196 HD3 ARG 148 HD3 ARG 148 10.223 19.062 -2.886 1197 HE ARG 148 HE ARG 148 8.700 19.990 -0.713 1198 HH11 ARG 148 HH11 ARG 148 11.295 17.672 -1.253 1199 HH12 ARG 148 HH12 ARG 148 11.949 17.849 0.341 1200 HH21 ARG 148 HH21 ARG 148 9.588 20.218 1.376 1201 HH22 ARG 148 HH22 ARG 148 10.980 19.294 1.832 1202 H GLN 149 H GLN 149 6.689 14.818 -4.243 1203 HA GLN 149 HA GLN 149 7.251 15.965 -6.776 1204 HB2 GLN 149 HB2 GLN 149 9.117 14.763 -5.830 1205 HB3 GLN 149 HB3 GLN 149 8.194 13.272 -6.062 1206 HG2 GLN 149 HG2 GLN 149 7.982 14.437 -8.556 1207 HG3 GLN 149 HG3 GLN 149 9.581 14.991 -8.042 1208 HE21 GLN 149 HE21 GLN 149 10.043 12.563 -6.323 1209 HE22 GLN 149 HE22 GLN 149 10.406 11.283 -7.431 1210 H GLU 150 H GLU 150 4.523 15.736 -5.921 1211 HA GLU 150 HA GLU 150 3.673 13.399 -7.477 1212 HB2 GLU 150 HB2 GLU 150 1.440 13.954 -6.350 1213 HB3 GLU 150 HB3 GLU 150 2.741 13.461 -5.259 1214 HG2 GLU 150 HG2 GLU 150 1.780 15.267 -4.136 1215 HG3 GLU 150 HG3 GLU 150 3.180 16.003 -4.926 1216 H GLU 151 H GLU 151 1.583 13.538 -8.720 1217 HA GLU 151 HA GLU 151 0.833 16.019 -9.799 1218 HB2 GLU 151 HB2 GLU 151 2.970 14.425 -11.176 1219 HB3 GLU 151 HB3 GLU 151 1.618 14.876 -12.224 1220 HG2 GLU 151 HG2 GLU 151 1.950 17.278 -11.558 1221 HG3 GLU 151 HG3 GLU 151 3.357 16.791 -10.603 1222 H CYS 152 H CYS 152 1.080 12.386 -10.319 1223 HA CYS 152 HA CYS 152 -1.461 12.571 -11.858 1224 HB2 CYS 152 HB2 CYS 152 0.449 11.038 -12.651 1225 HB3 CYS 152 HB3 CYS 152 0.461 10.234 -11.076 1226 H THR 153 H THR 153 -3.361 12.029 -10.762 1227 HA THR 153 HA THR 153 -3.143 10.808 -8.101 1228 HB THR 153 HB THR 153 -5.436 12.282 -7.892 1229 HG1 THR 153 HG1 THR 153 -4.956 14.405 -8.812 1230 HG21 THR 153 HG21 THR 153 -4.094 13.945 -6.629 1231 HG22 THR 153 HG22 THR 153 -3.554 12.265 -6.293 1232 HG23 THR 153 HG23 THR 153 -2.599 13.313 -7.396 1233 H VAL 154 H VAL 154 -4.899 9.395 -7.472 1234 HA VAL 154 HA VAL 154 -6.239 8.229 -9.764 1235 HB VAL 154 HB VAL 154 -5.055 6.806 -8.100 1236 HG11 VAL 154 HG11 VAL 154 -6.047 6.435 -5.869 1237 HG12 VAL 154 HG12 VAL 154 -5.454 8.118 -6.079 1238 HG13 VAL 154 HG13 VAL 154 -7.213 7.767 -6.174 1239 HG21 VAL 154 HG21 VAL 154 -6.867 5.149 -7.794 1240 HG22 VAL 154 HG22 VAL 154 -8.077 6.407 -8.214 1241 HG23 VAL 154 HG23 VAL 154 -6.878 5.870 -9.438 1242 H ASP 155 H ASP 155 -8.556 8.006 -9.917 1243 HA ASP 155 HA ASP 155 -9.975 10.196 -8.774 1244 HB2 ASP 155 HB2 ASP 155 -10.463 9.442 -11.054 1245 HB3 ASP 155 HB3 ASP 155 -10.838 7.810 -10.487 1246 H GLU 156 H GLU 156 -11.918 10.088 -7.445 1247 HA GLU 156 HA GLU 156 -11.969 7.668 -5.768 1248 HB2 GLU 156 HB2 GLU 156 -12.796 9.228 -3.956 1249 HB3 GLU 156 HB3 GLU 156 -11.087 9.357 -4.393 1250 HG2 GLU 156 HG2 GLU 156 -11.761 11.328 -5.909 1251 HG3 GLU 156 HG3 GLU 156 -13.347 11.265 -5.128 1252 H VAL 157 H VAL 157 -14.004 10.492 -6.911 1253 HA VAL 157 HA VAL 157 -16.094 8.704 -7.636 1254 HB VAL 157 HB VAL 157 -16.522 8.684 -5.237 1255 HG11 VAL 157 HG11 VAL 157 -17.083 10.747 -3.996 1256 HG12 VAL 157 HG12 VAL 157 -15.389 10.750 -4.591 1257 HG13 VAL 157 HG13 VAL 157 -16.639 11.725 -5.436 1258 HG21 VAL 157 HG21 VAL 157 -18.840 9.554 -5.229 1259 HG22 VAL 157 HG22 VAL 157 -18.496 10.460 -6.742 1260 HG23 VAL 157 HG23 VAL 157 -18.454 8.664 -6.741 1261 HN1 EB4 158 HN1 EB4 158 3.821 -5.784 -6.323 1262 H8 EB4 158 H8 EB4 158 -1.796 -7.548 -3.913 1263 HN2 EB4 158 HN2 EB4 158 1.306 -5.436 -8.003 1264 H9 EB4 158 H9 EB4 158 0.945 0.053 -2.342 1265 H10 EB4 158 H10 EB4 158 4.539 -7.346 -0.649 1266 HN3 EB4 158 HN3 EB4 158 3.596 -2.669 -6.800 1267 H7 EB4 158 H7 EB4 158 2.915 -5.458 -0.583 1268 H11 EB4 158 H11 EB4 158 -3.242 -8.174 -5.842 1269 H12 EB4 158 H12 EB4 158 2.087 1.977 -3.406 1270 H15 EB4 158 H15 EB4 158 3.656 1.595 -5.285 1271 H14 EB4 158 H14 EB4 158 -2.668 -7.380 -8.117 1272 H13 EB4 158 H13 EB4 158 5.436 -8.111 -2.835 1273 H22 EB4 158 H22 EB4 158 4.639 -6.618 -6.713 1274 H30 EB4 158 H30 EB4 158 6.199 -3.361 -9.322 1275 H30A EB4 158 H30A EB4 158 6.420 -2.743 -7.613 1276 H24 EB4 158 H24 EB4 158 4.099 -1.941 -7.647 1277 H28 EB4 158 H28 EB4 158 3.799 -8.427 -8.260 1278 H28A EB4 158 H28A EB4 158 4.655 -7.558 -9.630 1279 H23 EB4 158 H23 EB4 158 0.950 -5.429 -9.174 1280 H29 EB4 158 H29 EB4 158 0.722 -3.345 -10.239 1281 H29A EB4 158 H29A EB4 158 2.212 -3.764 -11.313 Start of MODEL 8 1 H1 MET 1 H1 MET 1 -29.027 4.562 -4.178 2 H2 MET 1 H2 MET 1 -28.333 5.976 -4.607 3 H3 MET 1 H3 MET 1 -29.197 5.126 -5.701 4 HA MET 1 HA MET 1 -27.386 3.329 -4.874 5 HB2 MET 1 HB2 MET 1 -27.414 5.166 -7.310 6 HB3 MET 1 HB3 MET 1 -26.265 3.835 -7.120 7 HG2 MET 1 HG2 MET 1 -28.190 2.236 -6.942 8 HG3 MET 1 HG3 MET 1 -29.306 3.580 -7.212 9 HE1 MET 1 HE1 MET 1 -29.481 1.677 -10.645 10 HE2 MET 1 HE2 MET 1 -29.330 0.967 -9.002 11 HE3 MET 1 HE3 MET 1 -30.411 2.375 -9.276 12 H THR 2 H THR 2 -25.087 3.301 -4.506 13 HA THR 2 HA THR 2 -23.271 4.063 -3.481 14 HB THR 2 HB THR 2 -23.426 6.380 -5.463 15 HG1 THR 2 HG1 THR 2 -22.402 4.836 -6.947 16 HG21 THR 2 HG21 THR 2 -20.964 6.096 -5.489 17 HG22 THR 2 HG22 THR 2 -21.570 6.428 -3.831 18 HG23 THR 2 HG23 THR 2 -21.107 4.758 -4.300 19 H VAL 3 H VAL 3 -25.069 4.630 -1.676 20 HA VAL 3 HA VAL 3 -25.134 7.501 -1.199 21 HB VAL 3 HB VAL 3 -26.627 6.910 0.693 22 HG11 VAL 3 HG11 VAL 3 -28.536 6.113 -0.668 23 HG12 VAL 3 HG12 VAL 3 -27.578 7.369 -1.523 24 HG13 VAL 3 HG13 VAL 3 -27.399 5.640 -1.975 25 HG21 VAL 3 HG21 VAL 3 -27.456 4.596 0.942 26 HG22 VAL 3 HG22 VAL 3 -26.270 4.044 -0.290 27 HG23 VAL 3 HG23 VAL 3 -25.695 4.721 1.271 28 HA PRO 4 HA PRO 4 -21.772 7.277 1.722 29 HB2 PRO 4 HB2 PRO 4 -22.486 9.373 3.424 30 HB3 PRO 4 HB3 PRO 4 -21.900 9.695 1.787 31 HG2 PRO 4 HG2 PRO 4 -24.754 9.582 2.805 32 HG3 PRO 4 HG3 PRO 4 -24.006 10.762 1.720 33 HD2 PRO 4 HD2 PRO 4 -25.554 8.731 0.760 34 HD3 PRO 4 HD3 PRO 4 -24.173 9.345 -0.158 35 H ASP 5 H ASP 5 -23.336 5.143 2.229 36 HA ASP 5 HA ASP 5 -24.125 5.331 5.048 37 HB2 ASP 5 HB2 ASP 5 -24.950 3.787 2.728 38 HB3 ASP 5 HB3 ASP 5 -24.414 2.689 4.007 39 H ARG 6 H ARG 6 -22.385 2.841 3.060 40 HA ARG 6 HA ARG 6 -20.736 2.144 5.300 41 HB2 ARG 6 HB2 ARG 6 -21.249 0.946 2.651 42 HB3 ARG 6 HB3 ARG 6 -19.746 0.573 3.504 43 HG2 ARG 6 HG2 ARG 6 -21.217 -1.123 4.198 44 HG3 ARG 6 HG3 ARG 6 -21.232 0.015 5.552 45 HD2 ARG 6 HD2 ARG 6 -23.518 -0.458 5.211 46 HD3 ARG 6 HD3 ARG 6 -23.297 1.100 4.404 47 HE ARG 6 HE ARG 6 -23.147 -0.191 2.250 48 HH11 ARG 6 HH11 ARG 6 -24.689 -1.647 5.050 49 HH12 ARG 6 HH12 ARG 6 -25.659 -2.729 4.107 50 HH21 ARG 6 HH21 ARG 6 -24.416 -1.626 1.021 51 HH22 ARG 6 HH22 ARG 6 -25.503 -2.717 1.812 52 H SER 7 H SER 7 -20.569 4.452 2.726 53 HA SER 7 HA SER 7 -18.025 4.351 1.800 54 HB2 SER 7 HB2 SER 7 -19.134 7.031 2.729 55 HB3 SER 7 HB3 SER 7 -18.415 6.608 1.169 56 HG SER 7 HG SER 7 -20.426 6.411 0.481 57 H GLU 8 H GLU 8 -19.024 5.407 5.112 58 HA GLU 8 HA GLU 8 -16.692 6.735 5.828 59 HB2 GLU 8 HB2 GLU 8 -18.611 5.052 7.486 60 HB3 GLU 8 HB3 GLU 8 -17.335 6.071 8.165 61 HG2 GLU 8 HG2 GLU 8 -18.409 8.050 6.956 62 HG3 GLU 8 HG3 GLU 8 -19.757 6.980 6.548 63 H ILE 9 H ILE 9 -17.297 3.289 5.379 64 HA ILE 9 HA ILE 9 -14.936 2.504 6.774 65 HB ILE 9 HB ILE 9 -16.694 0.626 5.319 66 HG12 ILE 9 HG12 ILE 9 -17.012 1.530 8.216 67 HG13 ILE 9 HG13 ILE 9 -17.968 2.213 6.894 68 HG21 ILE 9 HG21 ILE 9 -15.881 -0.911 7.075 69 HG22 ILE 9 HG22 ILE 9 -14.544 -0.229 6.089 70 HG23 ILE 9 HG23 ILE 9 -14.857 0.406 7.740 71 HD11 ILE 9 HD11 ILE 9 -19.199 0.427 8.045 72 HD12 ILE 9 HD12 ILE 9 -18.846 -0.039 6.347 73 HD13 ILE 9 HD13 ILE 9 -17.875 -0.733 7.689 74 H ALA 10 H ALA 10 -15.199 3.952 3.843 75 HA ALA 10 HA ALA 10 -12.906 2.459 2.821 76 HB1 ALA 10 HB1 ALA 10 -14.021 2.263 0.587 77 HB2 ALA 10 HB2 ALA 10 -14.904 1.336 1.846 78 HB3 ALA 10 HB3 ALA 10 -15.532 2.926 1.295 79 H GLY 11 H GLY 11 -12.288 3.587 0.524 80 HA2 GLY 11 HA2 GLY 11 -12.820 6.080 -0.207 81 HA3 GLY 11 HA3 GLY 11 -11.912 6.374 1.281 82 H LYS 12 H LYS 12 -10.207 7.398 0.028 83 HA LYS 12 HA LYS 12 -8.537 5.470 -1.450 84 HB2 LYS 12 HB2 LYS 12 -7.708 7.440 -2.702 85 HB3 LYS 12 HB3 LYS 12 -9.428 7.123 -2.965 86 HG2 LYS 12 HG2 LYS 12 -9.992 8.918 -1.300 87 HG3 LYS 12 HG3 LYS 12 -8.267 9.253 -1.099 88 HD2 LYS 12 HD2 LYS 12 -8.042 9.929 -3.429 89 HD3 LYS 12 HD3 LYS 12 -9.669 9.353 -3.816 90 HE2 LYS 12 HE2 LYS 12 -9.833 11.736 -3.591 91 HE3 LYS 12 HE3 LYS 12 -10.587 11.045 -2.148 92 HZ1 LYS 12 HZ1 LYS 12 -8.947 12.938 -1.863 93 HZ2 LYS 12 HZ2 LYS 12 -8.788 11.661 -0.858 94 HZ3 LYS 12 HZ3 LYS 12 -7.764 11.842 -2.118 95 H TRP 13 H TRP 13 -6.273 5.488 -1.077 96 HA TRP 13 HA TRP 13 -5.404 7.193 1.168 97 HB2 TRP 13 HB2 TRP 13 -4.616 4.276 0.752 98 HB3 TRP 13 HB3 TRP 13 -4.189 5.327 2.109 99 HD1 TRP 13 HD1 TRP 13 -6.572 2.666 1.238 100 HE1 TRP 13 HE1 TRP 13 -8.560 2.598 2.891 101 HE3 TRP 13 HE3 TRP 13 -5.903 7.240 3.478 102 HZ2 TRP 13 HZ2 TRP 13 -9.702 4.252 4.869 103 HZ3 TRP 13 HZ3 TRP 13 -7.495 7.937 5.252 104 HH2 TRP 13 HH2 TRP 13 -9.363 6.459 5.937 105 H TYR 14 H TYR 14 -3.234 7.971 0.935 106 HA TYR 14 HA TYR 14 -2.068 7.415 -1.715 107 HB2 TYR 14 HB2 TYR 14 -1.594 9.753 0.192 108 HB3 TYR 14 HB3 TYR 14 -0.944 9.577 -1.443 109 HD1 TYR 14 HD1 TYR 14 -4.183 9.829 0.447 110 HD2 TYR 14 HD2 TYR 14 -2.174 10.367 -3.310 111 HE1 TYR 14 HE1 TYR 14 -6.203 10.924 -0.470 112 HE2 TYR 14 HE2 TYR 14 -4.196 11.459 -4.234 113 HH TYR 14 HH TYR 14 -6.497 11.685 -3.899 114 H VAL 15 H VAL 15 -0.281 6.035 -1.826 115 HA VAL 15 HA VAL 15 1.039 5.491 0.794 116 HB VAL 15 HB VAL 15 0.428 3.676 -0.848 117 HG11 VAL 15 HG11 VAL 15 1.679 3.337 -2.927 118 HG12 VAL 15 HG12 VAL 15 0.645 4.805 -2.960 119 HG13 VAL 15 HG13 VAL 15 2.420 4.962 -2.735 120 HG21 VAL 15 HG21 VAL 15 2.664 2.550 -0.852 121 HG22 VAL 15 HG22 VAL 15 3.434 4.126 -0.465 122 HG23 VAL 15 HG23 VAL 15 2.312 3.362 0.711 123 H VAL 16 H VAL 16 2.400 6.979 1.458 124 HA VAL 16 HA VAL 16 4.013 8.443 -0.507 125 HB VAL 16 HB VAL 16 4.400 10.045 1.315 126 HG11 VAL 16 HG11 VAL 16 2.150 11.034 1.411 127 HG12 VAL 16 HG12 VAL 16 2.567 10.445 -0.234 128 HG13 VAL 16 HG13 VAL 16 1.471 9.482 0.814 129 HG21 VAL 16 HG21 VAL 16 3.098 9.957 3.402 130 HG22 VAL 16 HG22 VAL 16 2.472 8.346 2.912 131 HG23 VAL 16 HG23 VAL 16 4.223 8.566 3.242 132 H ALA 17 H ALA 17 4.226 5.628 1.246 133 HA ALA 17 HA ALA 17 7.112 5.949 1.592 134 HB1 ALA 17 HB1 ALA 17 7.008 4.816 3.787 135 HB2 ALA 17 HB2 ALA 17 6.170 6.404 3.815 136 HB3 ALA 17 HB3 ALA 17 5.214 4.886 3.734 137 H LEU 18 H LEU 18 8.241 3.848 1.519 138 HA LEU 18 HA LEU 18 6.670 1.490 1.022 139 HB2 LEU 18 HB2 LEU 18 8.232 2.902 -1.175 140 HB3 LEU 18 HB3 LEU 18 7.853 1.176 -1.233 141 HG LEU 18 HG LEU 18 5.685 3.282 -0.938 142 HD11 LEU 18 HD11 LEU 18 5.372 3.145 -3.387 143 HD12 LEU 18 HD12 LEU 18 6.976 3.827 -2.951 144 HD13 LEU 18 HD13 LEU 18 6.846 2.126 -3.513 145 HD21 LEU 18 HD21 LEU 18 4.274 1.501 -1.919 146 HD22 LEU 18 HD22 LEU 18 5.701 0.413 -1.982 147 HD23 LEU 18 HD23 LEU 18 5.064 0.969 -0.397 148 H ALA 19 H ALA 19 7.901 -0.460 1.074 149 HA ALA 19 HA ALA 19 10.812 -0.195 1.465 150 HB1 ALA 19 HB1 ALA 19 10.672 -1.604 3.483 151 HB2 ALA 19 HB2 ALA 19 9.815 -0.044 3.725 152 HB3 ALA 19 HB3 ALA 19 8.879 -1.544 3.412 153 H SER 20 H SER 20 11.861 -1.936 0.439 154 HA SER 20 HA SER 20 10.116 -4.209 -0.299 155 HB2 SER 20 HB2 SER 20 12.205 -2.833 -2.086 156 HB3 SER 20 HB3 SER 20 11.223 -4.238 -2.521 157 HG SER 20 HG SER 20 10.534 -1.867 -3.104 158 H ASN 21 H ASN 21 11.080 -6.256 -0.315 159 HA ASN 21 HA ASN 21 13.567 -6.388 1.209 160 HB2 ASN 21 HB2 ASN 21 11.285 -7.749 1.512 161 HB3 ASN 21 HB3 ASN 21 11.975 -8.776 0.249 162 HD21 ASN 21 HD21 ASN 21 14.778 -8.514 1.072 163 HD22 ASN 21 HD22 ASN 21 14.939 -9.413 2.543 164 H THR 22 H THR 22 12.501 -6.530 -2.150 165 HA THR 22 HA THR 22 14.873 -8.104 -2.892 166 HB THR 22 HB THR 22 13.570 -7.540 -5.220 167 HG1 THR 22 HG1 THR 22 11.628 -6.719 -4.753 168 HG21 THR 22 HG21 THR 22 12.466 -9.738 -4.981 169 HG22 THR 22 HG22 THR 22 14.158 -9.780 -4.380 170 HG23 THR 22 HG23 THR 22 12.793 -9.710 -3.215 171 H GLU 23 H GLU 23 16.667 -7.346 -3.867 172 HA GLU 23 HA GLU 23 17.391 -4.708 -3.604 173 HB2 GLU 23 HB2 GLU 23 18.283 -6.546 -5.909 174 HB3 GLU 23 HB3 GLU 23 19.245 -5.303 -5.098 175 HG2 GLU 23 HG2 GLU 23 18.373 -7.995 -3.961 176 HG3 GLU 23 HG3 GLU 23 20.012 -7.494 -4.396 177 H PHE 24 H PHE 24 16.144 -6.371 -6.642 178 HA PHE 24 HA PHE 24 16.299 -4.183 -8.304 179 HB2 PHE 24 HB2 PHE 24 14.341 -6.524 -8.209 180 HB3 PHE 24 HB3 PHE 24 14.355 -5.343 -9.524 181 HD1 PHE 24 HD1 PHE 24 16.391 -5.120 -10.977 182 HD2 PHE 24 HD2 PHE 24 15.978 -8.260 -8.078 183 HE1 PHE 24 HE1 PHE 24 18.177 -6.400 -12.113 184 HE2 PHE 24 HE2 PHE 24 17.768 -9.543 -9.210 185 HZ PHE 24 HZ PHE 24 18.869 -8.614 -11.233 186 H PHE 25 H PHE 25 13.434 -5.184 -6.244 187 HA PHE 25 HA PHE 25 11.720 -3.198 -7.080 188 HB2 PHE 25 HB2 PHE 25 12.076 -4.665 -4.444 189 HB3 PHE 25 HB3 PHE 25 10.820 -3.435 -4.642 190 HD1 PHE 25 HD1 PHE 25 12.143 -6.273 -6.756 191 HD2 PHE 25 HD2 PHE 25 8.736 -4.321 -5.024 192 HE1 PHE 25 HE1 PHE 25 10.652 -7.952 -7.802 193 HE2 PHE 25 HE2 PHE 25 7.242 -5.997 -6.066 194 HZ PHE 25 HZ PHE 25 8.198 -7.816 -7.459 195 H LEU 26 H LEU 26 14.225 -3.026 -4.428 196 HA LEU 26 HA LEU 26 13.567 -0.436 -3.566 197 HB2 LEU 26 HB2 LEU 26 16.306 -1.783 -3.678 198 HB3 LEU 26 HB3 LEU 26 15.829 -0.446 -2.623 199 HG LEU 26 HG LEU 26 14.731 -3.287 -2.514 200 HD11 LEU 26 HD11 LEU 26 15.944 -3.416 -0.368 201 HD12 LEU 26 HD12 LEU 26 17.054 -3.139 -1.753 202 HD13 LEU 26 HD13 LEU 26 16.625 -1.780 -0.660 203 HD21 LEU 26 HD21 LEU 26 13.641 -2.543 -0.422 204 HD22 LEU 26 HD22 LEU 26 14.221 -0.870 -0.722 205 HD23 LEU 26 HD23 LEU 26 13.048 -1.629 -1.850 206 H ARG 27 H ARG 27 15.862 -1.667 -6.097 207 HA ARG 27 HA ARG 27 16.992 0.796 -6.755 208 HB2 ARG 27 HB2 ARG 27 17.777 -1.525 -7.428 209 HB3 ARG 27 HB3 ARG 27 16.451 -1.584 -8.597 210 HG2 ARG 27 HG2 ARG 27 17.426 0.615 -9.571 211 HG3 ARG 27 HG3 ARG 27 18.856 0.289 -8.582 212 HD2 ARG 27 HD2 ARG 27 19.369 -0.681 -10.682 213 HD3 ARG 27 HD3 ARG 27 18.906 -2.055 -9.670 214 HE ARG 27 HE ARG 27 16.572 -1.131 -10.991 215 HH11 ARG 27 HH11 ARG 27 19.645 -2.656 -11.767 216 HH12 ARG 27 HH12 ARG 27 19.028 -3.454 -13.175 217 HH21 ARG 27 HH21 ARG 27 15.778 -2.186 -12.834 218 HH22 ARG 27 HH22 ARG 27 16.828 -3.186 -13.782 219 H GLU 28 H GLU 28 14.102 -0.962 -8.135 220 HA GLU 28 HA GLU 28 13.606 1.077 -10.053 221 HB2 GLU 28 HB2 GLU 28 11.548 -0.909 -9.043 222 HB3 GLU 28 HB3 GLU 28 11.707 -0.194 -10.653 223 HG2 GLU 28 HG2 GLU 28 13.531 -2.295 -9.399 224 HG3 GLU 28 HG3 GLU 28 12.353 -2.551 -10.693 225 H LYS 29 H LYS 29 11.838 0.137 -6.957 226 HA LYS 29 HA LYS 29 10.009 2.190 -7.100 227 HB2 LYS 29 HB2 LYS 29 11.090 0.398 -4.973 228 HB3 LYS 29 HB3 LYS 29 10.328 1.887 -4.399 229 HG2 LYS 29 HG2 LYS 29 8.920 0.117 -6.432 230 HG3 LYS 29 HG3 LYS 29 8.875 -0.277 -4.709 231 HD2 LYS 29 HD2 LYS 29 6.915 1.038 -5.130 232 HD3 LYS 29 HD3 LYS 29 8.038 2.104 -4.275 233 HE2 LYS 29 HE2 LYS 29 7.779 3.589 -5.957 234 HE3 LYS 29 HE3 LYS 29 8.702 2.486 -6.986 235 HZ1 LYS 29 HZ1 LYS 29 6.865 2.321 -8.179 236 HZ2 LYS 29 HZ2 LYS 29 6.155 1.491 -6.965 237 HZ3 LYS 29 HZ3 LYS 29 5.949 3.106 -7.079 238 H ASP 30 H ASP 30 13.297 2.277 -5.460 239 HA ASP 30 HA ASP 30 12.976 4.812 -4.388 240 HB2 ASP 30 HB2 ASP 30 14.850 3.383 -3.771 241 HB3 ASP 30 HB3 ASP 30 15.474 3.392 -5.426 242 H LYS 31 H LYS 31 13.694 3.790 -7.765 243 HA LYS 31 HA LYS 31 14.404 6.487 -8.498 244 HB2 LYS 31 HB2 LYS 31 14.114 3.872 -10.010 245 HB3 LYS 31 HB3 LYS 31 14.333 5.413 -10.850 246 HG2 LYS 31 HG2 LYS 31 16.246 4.139 -8.837 247 HG3 LYS 31 HG3 LYS 31 16.491 4.300 -10.581 248 HD2 LYS 31 HD2 LYS 31 17.645 6.188 -9.994 249 HD3 LYS 31 HD3 LYS 31 16.038 6.924 -9.952 250 HE2 LYS 31 HE2 LYS 31 16.780 5.524 -7.433 251 HE3 LYS 31 HE3 LYS 31 17.858 6.865 -7.844 252 HZ1 LYS 31 HZ1 LYS 31 16.311 8.157 -6.983 253 HZ2 LYS 31 HZ2 LYS 31 15.330 7.823 -8.244 254 HZ3 LYS 31 HZ3 LYS 31 15.213 6.954 -6.866 255 H MET 32 H MET 32 11.240 4.586 -8.152 256 HA MET 32 HA MET 32 10.325 6.532 -10.237 257 HB2 MET 32 HB2 MET 32 9.025 4.268 -8.341 258 HB3 MET 32 HB3 MET 32 8.084 5.056 -9.615 259 HG2 MET 32 HG2 MET 32 10.473 4.020 -10.845 260 HG3 MET 32 HG3 MET 32 9.836 2.746 -9.796 261 HE1 MET 32 HE1 MET 32 8.707 2.139 -13.661 262 HE2 MET 32 HE2 MET 32 10.108 3.150 -13.171 263 HE3 MET 32 HE3 MET 32 9.818 1.569 -12.371 264 H LYS 33 H LYS 33 7.513 6.397 -8.599 265 HA LYS 33 HA LYS 33 8.287 8.732 -6.935 266 HB2 LYS 33 HB2 LYS 33 6.083 8.882 -8.991 267 HB3 LYS 33 HB3 LYS 33 6.416 10.068 -7.723 268 HG2 LYS 33 HG2 LYS 33 8.498 10.705 -8.695 269 HG3 LYS 33 HG3 LYS 33 8.567 9.263 -9.717 270 HD2 LYS 33 HD2 LYS 33 6.474 10.114 -10.913 271 HD3 LYS 33 HD3 LYS 33 6.628 11.614 -9.988 272 HE2 LYS 33 HE2 LYS 33 8.859 12.036 -10.929 273 HE3 LYS 33 HE3 LYS 33 8.866 10.460 -11.731 274 HZ1 LYS 33 HZ1 LYS 33 8.277 12.217 -13.239 275 HZ2 LYS 33 HZ2 LYS 33 7.006 11.207 -13.066 276 HZ3 LYS 33 HZ3 LYS 33 6.999 12.662 -12.325 277 H MET 34 H MET 34 5.812 9.417 -5.884 278 HA MET 34 HA MET 34 5.246 7.196 -4.187 279 HB2 MET 34 HB2 MET 34 4.955 9.510 -3.395 280 HB3 MET 34 HB3 MET 34 3.972 9.942 -4.800 281 HG2 MET 34 HG2 MET 34 2.191 8.335 -3.944 282 HG3 MET 34 HG3 MET 34 3.160 8.133 -2.478 283 HE1 MET 34 HE1 MET 34 1.045 12.037 -3.823 284 HE2 MET 34 HE2 MET 34 2.650 11.641 -4.525 285 HE3 MET 34 HE3 MET 34 1.256 10.539 -4.791 286 H ALA 35 H ALA 35 3.211 6.027 -4.048 287 HA ALA 35 HA ALA 35 1.861 5.759 -6.629 288 HB1 ALA 35 HB1 ALA 35 1.335 3.465 -5.943 289 HB2 ALA 35 HB2 ALA 35 3.100 3.778 -6.048 290 HB3 ALA 35 HB3 ALA 35 2.294 3.707 -4.444 291 H MET 36 H MET 36 -0.443 4.525 -6.122 292 HA MET 36 HA MET 36 -1.739 6.106 -4.008 293 HB2 MET 36 HB2 MET 36 -2.739 5.414 -6.831 294 HB3 MET 36 HB3 MET 36 -3.722 6.188 -5.581 295 HG2 MET 36 HG2 MET 36 -1.114 7.508 -6.264 296 HG3 MET 36 HG3 MET 36 -2.383 7.556 -7.496 297 HE1 MET 36 HE1 MET 36 -1.653 10.744 -5.101 298 HE2 MET 36 HE2 MET 36 -1.009 9.775 -6.469 299 HE3 MET 36 HE3 MET 36 -2.443 10.829 -6.711 300 H ALA 37 H ALA 37 -3.936 5.143 -3.347 301 HA ALA 37 HA ALA 37 -4.420 2.340 -4.038 302 HB1 ALA 37 HB1 ALA 37 -4.066 1.595 -1.665 303 HB2 ALA 37 HB2 ALA 37 -2.530 2.218 -2.357 304 HB3 ALA 37 HB3 ALA 37 -3.487 3.239 -1.230 305 H ARG 38 H ARG 38 -6.528 2.167 -4.183 306 HA ARG 38 HA ARG 38 -8.217 3.697 -2.286 307 HB2 ARG 38 HB2 ARG 38 -8.378 4.811 -4.422 308 HB3 ARG 38 HB3 ARG 38 -8.603 3.276 -5.272 309 HG2 ARG 38 HG2 ARG 38 -10.742 2.944 -3.909 310 HG3 ARG 38 HG3 ARG 38 -10.536 4.594 -3.306 311 HD2 ARG 38 HD2 ARG 38 -10.658 5.511 -5.569 312 HD3 ARG 38 HD3 ARG 38 -10.628 3.893 -6.282 313 HE ARG 38 HE ARG 38 -12.837 3.793 -4.656 314 HH11 ARG 38 HH11 ARG 38 -11.786 6.041 -7.152 315 HH12 ARG 38 HH12 ARG 38 -13.400 6.473 -7.608 316 HH21 ARG 38 HH21 ARG 38 -14.942 4.381 -5.257 317 HH22 ARG 38 HH22 ARG 38 -15.194 5.529 -6.530 318 H ILE 39 H ILE 39 -9.601 2.208 -1.181 319 HA ILE 39 HA ILE 39 -9.663 -0.477 -2.327 320 HB ILE 39 HB ILE 39 -10.209 0.281 0.575 321 HG12 ILE 39 HG12 ILE 39 -7.940 0.982 0.103 322 HG13 ILE 39 HG13 ILE 39 -7.907 -0.490 1.083 323 HG21 ILE 39 HG21 ILE 39 -9.734 -2.115 0.993 324 HG22 ILE 39 HG22 ILE 39 -11.115 -1.885 -0.132 325 HG23 ILE 39 HG23 ILE 39 -9.508 -2.369 -0.770 326 HD11 ILE 39 HD11 ILE 39 -6.199 -0.560 -0.677 327 HD12 ILE 39 HD12 ILE 39 -7.430 -1.841 -0.939 328 HD13 ILE 39 HD13 ILE 39 -7.464 -0.346 -1.934 329 H SER 40 H SER 40 -11.678 -1.644 -2.390 330 HA SER 40 HA SER 40 -14.076 -0.065 -1.710 331 HB2 SER 40 HB2 SER 40 -13.844 -1.895 -4.143 332 HB3 SER 40 HB3 SER 40 -15.076 -0.674 -3.800 333 HG SER 40 HG SER 40 -13.522 0.057 -5.384 334 H PHE 41 H PHE 41 -15.541 -1.199 -0.434 335 HA PHE 41 HA PHE 41 -14.831 -3.889 0.314 336 HB2 PHE 41 HB2 PHE 41 -17.057 -3.689 1.593 337 HB3 PHE 41 HB3 PHE 41 -15.709 -2.652 2.079 338 HD1 PHE 41 HD1 PHE 41 -18.987 -2.723 0.329 339 HD2 PHE 41 HD2 PHE 41 -15.849 -0.268 1.929 340 HE1 PHE 41 HE1 PHE 41 -20.441 -0.731 0.118 341 HE2 PHE 41 HE2 PHE 41 -17.298 1.729 1.717 342 HZ PHE 41 HZ PHE 41 -19.598 1.501 0.811 343 H LEU 42 H LEU 42 -15.129 -5.527 -1.128 344 HA LEU 42 HA LEU 42 -17.210 -5.429 -3.102 345 HB2 LEU 42 HB2 LEU 42 -14.779 -6.636 -2.930 346 HB3 LEU 42 HB3 LEU 42 -15.804 -7.978 -2.406 347 HG LEU 42 HG LEU 42 -15.322 -8.093 -4.801 348 HD11 LEU 42 HD11 LEU 42 -17.632 -8.313 -5.645 349 HD12 LEU 42 HD12 LEU 42 -17.447 -9.005 -3.997 350 HD13 LEU 42 HD13 LEU 42 -18.235 -7.406 -4.217 351 HD21 LEU 42 HD21 LEU 42 -16.244 -6.411 -6.365 352 HD22 LEU 42 HD22 LEU 42 -16.775 -5.414 -4.969 353 HD23 LEU 42 HD23 LEU 42 -15.025 -5.700 -5.254 354 H GLY 43 H GLY 43 -16.612 -7.224 -0.002 355 HA2 GLY 43 HA2 GLY 43 -19.403 -7.529 0.465 356 HA3 GLY 43 HA3 GLY 43 -18.680 -9.030 -0.127 357 H GLU 44 H GLU 44 -19.614 -9.308 2.388 358 HA GLU 44 HA GLU 44 -18.092 -8.397 4.489 359 HB2 GLU 44 HB2 GLU 44 -19.417 -11.132 4.130 360 HB3 GLU 44 HB3 GLU 44 -18.890 -10.448 5.674 361 HG2 GLU 44 HG2 GLU 44 -20.472 -8.483 5.215 362 HG3 GLU 44 HG3 GLU 44 -21.103 -9.411 3.848 363 H ASP 45 H ASP 45 -17.416 -11.172 2.253 364 HA ASP 45 HA ASP 45 -14.887 -11.549 3.712 365 HB2 ASP 45 HB2 ASP 45 -16.469 -13.514 3.625 366 HB3 ASP 45 HB3 ASP 45 -16.435 -13.449 1.858 367 H GLU 46 H GLU 46 -16.024 -9.953 0.930 368 HA GLU 46 HA GLU 46 -13.434 -10.484 -0.365 369 HB2 GLU 46 HB2 GLU 46 -15.187 -11.571 -1.677 370 HB3 GLU 46 HB3 GLU 46 -16.170 -10.101 -1.668 371 HG2 GLU 46 HG2 GLU 46 -15.034 -9.176 -3.395 372 HG3 GLU 46 HG3 GLU 46 -13.458 -9.639 -2.739 373 H LEU 47 H LEU 47 -12.426 -8.712 -1.449 374 HA LEU 47 HA LEU 47 -13.639 -6.125 -1.057 375 HB2 LEU 47 HB2 LEU 47 -11.641 -5.169 -0.030 376 HB3 LEU 47 HB3 LEU 47 -12.422 -6.379 0.997 377 HG LEU 47 HG LEU 47 -10.079 -7.148 -0.763 378 HD11 LEU 47 HD11 LEU 47 -8.573 -6.650 1.133 379 HD12 LEU 47 HD12 LEU 47 -9.357 -5.166 0.495 380 HD13 LEU 47 HD13 LEU 47 -9.944 -5.906 2.022 381 HD21 LEU 47 HD21 LEU 47 -9.741 -8.821 1.029 382 HD22 LEU 47 HD22 LEU 47 -11.156 -8.154 1.912 383 HD23 LEU 47 HD23 LEU 47 -11.383 -8.934 0.311 384 H LYS 48 H LYS 48 -12.701 -4.450 -2.397 385 HA LYS 48 HA LYS 48 -11.032 -5.510 -4.569 386 HB2 LYS 48 HB2 LYS 48 -13.284 -5.004 -5.328 387 HB3 LYS 48 HB3 LYS 48 -13.241 -3.415 -4.552 388 HG2 LYS 48 HG2 LYS 48 -11.260 -2.859 -6.107 389 HG3 LYS 48 HG3 LYS 48 -11.649 -4.346 -6.981 390 HD2 LYS 48 HD2 LYS 48 -13.724 -2.168 -6.429 391 HD3 LYS 48 HD3 LYS 48 -12.700 -2.163 -7.871 392 HE2 LYS 48 HE2 LYS 48 -14.494 -4.508 -7.064 393 HE3 LYS 48 HE3 LYS 48 -14.992 -3.227 -8.176 394 HZ1 LYS 48 HZ1 LYS 48 -14.175 -4.937 -9.494 395 HZ2 LYS 48 HZ2 LYS 48 -12.945 -3.864 -9.479 396 HZ3 LYS 48 HZ3 LYS 48 -12.863 -5.212 -8.563 397 H VAL 49 H VAL 49 -9.212 -4.212 -5.223 398 HA VAL 49 HA VAL 49 -8.896 -1.708 -3.722 399 HB VAL 49 HB VAL 49 -6.499 -2.241 -3.415 400 HG11 VAL 49 HG11 VAL 49 -6.745 -3.982 -1.672 401 HG12 VAL 49 HG12 VAL 49 -8.072 -2.774 -1.608 402 HG13 VAL 49 HG13 VAL 49 -8.367 -4.395 -2.322 403 HG21 VAL 49 HG21 VAL 49 -5.653 -4.530 -3.807 404 HG22 VAL 49 HG22 VAL 49 -7.222 -4.975 -4.561 405 HG23 VAL 49 HG23 VAL 49 -6.176 -3.734 -5.330 406 H SER 50 H SER 50 -8.149 0.021 -4.977 407 HA SER 50 HA SER 50 -7.392 -0.661 -7.766 408 HB2 SER 50 HB2 SER 50 -9.502 0.668 -7.464 409 HB3 SER 50 HB3 SER 50 -8.596 1.894 -6.567 410 HG SER 50 HG SER 50 -8.628 2.641 -8.666 411 H TYR 51 H TYR 51 -5.291 -0.369 -8.254 412 HA TYR 51 HA TYR 51 -3.647 1.212 -6.412 413 HB2 TYR 51 HB2 TYR 51 -3.231 -1.004 -8.461 414 HB3 TYR 51 HB3 TYR 51 -1.878 0.074 -8.092 415 HD1 TYR 51 HD1 TYR 51 -1.709 0.443 -5.313 416 HD2 TYR 51 HD2 TYR 51 -3.118 -3.030 -7.405 417 HE1 TYR 51 HE1 TYR 51 -1.046 -0.979 -3.399 418 HE2 TYR 51 HE2 TYR 51 -2.498 -4.445 -5.479 419 HH TYR 51 HH TYR 51 -0.437 -3.973 -3.481 420 H ALA 52 H ALA 52 -2.450 3.016 -7.196 421 HA ALA 52 HA ALA 52 -2.646 3.575 -10.086 422 HB1 ALA 52 HB1 ALA 52 -3.045 5.947 -9.562 423 HB2 ALA 52 HB2 ALA 52 -4.383 4.901 -8.980 424 HB3 ALA 52 HB3 ALA 52 -3.174 5.541 -7.817 425 H VAL 53 H VAL 53 -0.540 3.646 -10.837 426 HA VAL 53 HA VAL 53 1.388 4.938 -9.054 427 HB VAL 53 HB VAL 53 3.120 3.300 -9.857 428 HG11 VAL 53 HG11 VAL 53 2.410 1.452 -8.369 429 HG12 VAL 53 HG12 VAL 53 2.080 3.062 -7.645 430 HG13 VAL 53 HG13 VAL 53 0.738 2.108 -8.362 431 HG21 VAL 53 HG21 VAL 53 2.370 1.147 -10.812 432 HG22 VAL 53 HG22 VAL 53 0.695 1.784 -10.920 433 HG23 VAL 53 HG23 VAL 53 2.004 2.530 -11.898 434 HA PRO 54 HA PRO 54 2.300 7.120 -12.871 435 HB2 PRO 54 HB2 PRO 54 4.505 8.513 -11.952 436 HB3 PRO 54 HB3 PRO 54 2.908 8.901 -11.300 437 HG2 PRO 54 HG2 PRO 54 5.105 7.205 -10.091 438 HG3 PRO 54 HG3 PRO 54 4.053 8.391 -9.308 439 HD2 PRO 54 HD2 PRO 54 3.613 5.659 -9.185 440 HD3 PRO 54 HD3 PRO 54 2.319 6.853 -9.021 441 H LYS 55 H LYS 55 2.829 5.441 -14.237 442 HA LYS 55 HA LYS 55 5.530 4.370 -14.112 443 HB2 LYS 55 HB2 LYS 55 3.628 2.801 -14.323 444 HB3 LYS 55 HB3 LYS 55 3.132 3.597 -15.823 445 HG2 LYS 55 HG2 LYS 55 5.246 2.907 -16.918 446 HG3 LYS 55 HG3 LYS 55 5.808 2.169 -15.413 447 HD2 LYS 55 HD2 LYS 55 4.036 0.511 -15.451 448 HD3 LYS 55 HD3 LYS 55 3.174 1.361 -16.740 449 HE2 LYS 55 HE2 LYS 55 4.250 -0.421 -17.862 450 HE3 LYS 55 HE3 LYS 55 5.280 0.976 -18.201 451 HZ1 LYS 55 HZ1 LYS 55 6.565 -0.933 -17.545 452 HZ2 LYS 55 HZ2 LYS 55 6.740 0.243 -16.426 453 HZ3 LYS 55 HZ3 LYS 55 5.789 -1.047 -16.113 454 HA PRO 56 HA PRO 56 7.121 7.095 -17.305 455 HB2 PRO 56 HB2 PRO 56 7.897 4.444 -18.657 456 HB3 PRO 56 HB3 PRO 56 8.921 5.858 -18.375 457 HG2 PRO 56 HG2 PRO 56 9.172 3.705 -16.813 458 HG3 PRO 56 HG3 PRO 56 9.282 5.323 -16.108 459 HD2 PRO 56 HD2 PRO 56 7.028 3.323 -15.939 460 HD3 PRO 56 HD3 PRO 56 7.545 4.527 -14.751 461 H ASN 57 H ASN 57 5.231 4.180 -18.300 462 HA ASN 57 HA ASN 57 4.630 5.321 -20.857 463 HB2 ASN 57 HB2 ASN 57 3.160 3.073 -19.380 464 HB3 ASN 57 HB3 ASN 57 3.214 3.355 -21.126 465 HD21 ASN 57 HD21 ASN 57 4.839 2.428 -22.322 466 HD22 ASN 57 HD22 ASN 57 6.135 1.497 -21.650 467 H GLY 58 H GLY 58 3.578 6.235 -17.749 468 HA2 GLY 58 HA2 GLY 58 1.952 8.100 -17.930 469 HA3 GLY 58 HA3 GLY 58 0.906 6.966 -18.795 470 H CYS 59 H CYS 59 -0.427 7.905 -16.723 471 HA CYS 59 HA CYS 59 0.143 6.850 -14.190 472 HB2 CYS 59 HB2 CYS 59 -2.439 7.746 -15.530 473 HB3 CYS 59 HB3 CYS 59 -2.360 7.226 -13.842 474 H ARG 60 H ARG 60 0.363 4.681 -13.662 475 HA ARG 60 HA ARG 60 -1.273 2.766 -15.242 476 HB2 ARG 60 HB2 ARG 60 1.178 2.371 -15.038 477 HB3 ARG 60 HB3 ARG 60 1.098 2.550 -13.280 478 HG2 ARG 60 HG2 ARG 60 1.261 0.195 -13.792 479 HG3 ARG 60 HG3 ARG 60 -0.363 0.507 -13.166 480 HD2 ARG 60 HD2 ARG 60 -0.248 0.846 -16.090 481 HD3 ARG 60 HD3 ARG 60 0.313 -0.758 -15.602 482 HE ARG 60 HE ARG 60 -2.235 0.162 -14.419 483 HH11 ARG 60 HH11 ARG 60 -0.577 -1.851 -16.777 484 HH12 ARG 60 HH12 ARG 60 -1.981 -2.802 -17.129 485 HH21 ARG 60 HH21 ARG 60 -4.061 -1.087 -14.893 486 HH22 ARG 60 HH22 ARG 60 -3.964 -2.367 -16.056 487 H LYS 61 H LYS 61 -3.188 2.176 -14.441 488 HA LYS 61 HA LYS 61 -3.490 2.124 -11.505 489 HB2 LYS 61 HB2 LYS 61 -4.923 3.842 -12.135 490 HB3 LYS 61 HB3 LYS 61 -5.356 3.080 -13.671 491 HG2 LYS 61 HG2 LYS 61 -6.782 1.471 -12.594 492 HG3 LYS 61 HG3 LYS 61 -6.138 1.854 -10.992 493 HD2 LYS 61 HD2 LYS 61 -7.326 3.865 -10.830 494 HD3 LYS 61 HD3 LYS 61 -7.416 4.085 -12.583 495 HE2 LYS 61 HE2 LYS 61 -9.599 3.422 -11.388 496 HE3 LYS 61 HE3 LYS 61 -9.166 2.490 -12.827 497 HZ1 LYS 61 HZ1 LYS 61 -9.881 1.142 -10.921 498 HZ2 LYS 61 HZ2 LYS 61 -8.388 0.738 -11.445 499 HZ3 LYS 61 HZ3 LYS 61 -8.565 1.612 -10.078 500 H TRP 62 H TRP 62 -4.661 0.266 -10.667 501 HA TRP 62 HA TRP 62 -5.674 -1.737 -12.502 502 HB2 TRP 62 HB2 TRP 62 -3.164 -2.081 -12.485 503 HB3 TRP 62 HB3 TRP 62 -3.258 -2.348 -10.739 504 HD1 TRP 62 HD1 TRP 62 -3.477 -4.822 -10.047 505 HE1 TRP 62 HE1 TRP 62 -4.253 -7.007 -11.190 506 HE3 TRP 62 HE3 TRP 62 -5.067 -2.865 -14.520 507 HZ2 TRP 62 HZ2 TRP 62 -5.389 -7.805 -13.642 508 HZ3 TRP 62 HZ3 TRP 62 -5.991 -4.409 -16.229 509 HH2 TRP 62 HH2 TRP 62 -6.151 -6.843 -15.793 510 H GLU 63 H GLU 63 -7.021 -3.303 -11.343 511 HA GLU 63 HA GLU 63 -7.269 -2.603 -8.497 512 HB2 GLU 63 HB2 GLU 63 -9.798 -3.316 -8.937 513 HB3 GLU 63 HB3 GLU 63 -9.247 -1.648 -9.143 514 HG2 GLU 63 HG2 GLU 63 -9.113 -3.404 -11.569 515 HG3 GLU 63 HG3 GLU 63 -10.728 -2.992 -10.976 516 H THR 64 H THR 64 -7.422 -4.377 -7.126 517 HA THR 64 HA THR 64 -7.670 -7.015 -8.403 518 HB THR 64 HB THR 64 -5.970 -6.447 -5.937 519 HG1 THR 64 HG1 THR 64 -5.340 -6.088 -8.726 520 HG21 THR 64 HG21 THR 64 -4.838 -8.542 -6.656 521 HG22 THR 64 HG22 THR 64 -6.599 -8.792 -6.411 522 HG23 THR 64 HG23 THR 64 -5.936 -8.642 -8.074 523 H THR 65 H THR 65 -8.769 -8.640 -7.107 524 HA THR 65 HA THR 65 -10.365 -7.481 -4.930 525 HB THR 65 HB THR 65 -10.896 -10.090 -6.385 526 HG1 THR 65 HG1 THR 65 -12.325 -8.775 -7.751 527 HG21 THR 65 HG21 THR 65 -13.221 -9.597 -5.683 528 HG22 THR 65 HG22 THR 65 -12.109 -9.663 -4.275 529 HG23 THR 65 HG23 THR 65 -12.663 -8.076 -4.909 530 H PHE 66 H PHE 66 -10.083 -8.200 -2.830 531 HA PHE 66 HA PHE 66 -8.359 -10.569 -2.516 532 HB2 PHE 66 HB2 PHE 66 -8.657 -8.158 -0.655 533 HB3 PHE 66 HB3 PHE 66 -7.579 -9.539 -0.412 534 HD1 PHE 66 HD1 PHE 66 -6.844 -9.620 -3.523 535 HD2 PHE 66 HD2 PHE 66 -6.813 -6.582 -0.489 536 HE1 PHE 66 HE1 PHE 66 -5.048 -8.428 -4.739 537 HE2 PHE 66 HE2 PHE 66 -5.015 -5.388 -1.701 538 HZ PHE 66 HZ PHE 66 -4.127 -6.309 -3.829 539 H LYS 67 H LYS 67 -8.653 -11.505 -0.129 540 HA LYS 67 HA LYS 67 -11.558 -11.711 0.313 541 HB2 LYS 67 HB2 LYS 67 -9.253 -13.669 0.421 542 HB3 LYS 67 HB3 LYS 67 -10.615 -13.908 1.524 543 HG2 LYS 67 HG2 LYS 67 -10.847 -15.225 -0.568 544 HG3 LYS 67 HG3 LYS 67 -12.181 -14.085 -0.342 545 HD2 LYS 67 HD2 LYS 67 -11.125 -12.486 -1.911 546 HD3 LYS 67 HD3 LYS 67 -9.722 -13.548 -2.087 547 HE2 LYS 67 HE2 LYS 67 -11.033 -15.268 -3.167 548 HE3 LYS 67 HE3 LYS 67 -12.557 -14.486 -2.725 549 HZ1 LYS 67 HZ1 LYS 67 -11.400 -14.168 -5.057 550 HZ2 LYS 67 HZ2 LYS 67 -12.348 -13.019 -4.388 551 HZ3 LYS 67 HZ3 LYS 67 -10.723 -12.896 -4.289 552 H LYS 68 H LYS 68 -12.335 -11.801 2.504 553 HA LYS 68 HA LYS 68 -10.987 -10.066 4.259 554 HB2 LYS 68 HB2 LYS 68 -13.420 -10.278 4.246 555 HB3 LYS 68 HB3 LYS 68 -13.323 -12.002 4.630 556 HG2 LYS 68 HG2 LYS 68 -13.902 -10.958 6.673 557 HG3 LYS 68 HG3 LYS 68 -12.179 -11.322 6.831 558 HD2 LYS 68 HD2 LYS 68 -12.342 -9.098 7.616 559 HD3 LYS 68 HD3 LYS 68 -11.758 -8.903 5.959 560 HE2 LYS 68 HE2 LYS 68 -13.979 -8.336 5.148 561 HE3 LYS 68 HE3 LYS 68 -14.728 -8.807 6.679 562 HZ1 LYS 68 HZ1 LYS 68 -14.493 -6.442 6.539 563 HZ2 LYS 68 HZ2 LYS 68 -13.521 -6.987 7.732 564 HZ3 LYS 68 HZ3 LYS 68 -12.881 -6.539 6.298 565 H THR 69 H THR 69 -9.217 -10.479 5.572 566 HA THR 69 HA THR 69 -9.192 -13.137 6.928 567 HB THR 69 HB THR 69 -6.671 -11.831 5.723 568 HG1 THR 69 HG1 THR 69 -7.958 -13.984 4.328 569 HG21 THR 69 HG21 THR 69 -5.840 -14.177 5.823 570 HG22 THR 69 HG22 THR 69 -6.442 -13.628 7.424 571 HG23 THR 69 HG23 THR 69 -7.449 -14.717 6.411 572 H SER 70 H SER 70 -9.961 -11.820 8.723 573 HA SER 70 HA SER 70 -8.524 -9.520 9.639 574 HB2 SER 70 HB2 SER 70 -10.214 -11.162 11.501 575 HB3 SER 70 HB3 SER 70 -10.175 -9.412 11.249 576 HG SER 70 HG SER 70 -12.133 -10.383 10.415 577 H ASP 71 H ASP 71 -6.364 -10.949 9.286 578 HA ASP 71 HA ASP 71 -5.720 -12.939 11.153 579 HB2 ASP 71 HB2 ASP 71 -4.565 -12.067 8.914 580 HB3 ASP 71 HB3 ASP 71 -3.742 -10.924 9.983 581 H ASP 72 H ASP 72 -4.533 -9.468 11.106 582 HA ASP 72 HA ASP 72 -4.375 -9.638 14.057 583 HB2 ASP 72 HB2 ASP 72 -2.239 -9.389 12.503 584 HB3 ASP 72 HB3 ASP 72 -2.801 -7.727 12.286 585 H GLY 73 H GLY 73 -6.711 -8.988 12.783 586 HA2 GLY 73 HA2 GLY 73 -8.387 -7.862 13.610 587 HA3 GLY 73 HA3 GLY 73 -7.399 -6.399 13.731 588 H GLU 74 H GLU 74 -6.784 -5.497 11.107 589 HA GLU 74 HA GLU 74 -9.342 -6.038 9.624 590 HB2 GLU 74 HB2 GLU 74 -7.728 -3.464 9.781 591 HB3 GLU 74 HB3 GLU 74 -8.988 -3.787 8.583 592 HG2 GLU 74 HG2 GLU 74 -9.528 -3.936 11.574 593 HG3 GLU 74 HG3 GLU 74 -9.618 -2.415 10.677 594 H VAL 75 H VAL 75 -7.370 -7.890 9.261 595 HA VAL 75 HA VAL 75 -5.476 -6.885 7.254 596 HB VAL 75 HB VAL 75 -5.681 -9.449 8.901 597 HG11 VAL 75 HG11 VAL 75 -3.617 -10.236 7.803 598 HG12 VAL 75 HG12 VAL 75 -4.993 -10.109 6.655 599 HG13 VAL 75 HG13 VAL 75 -3.707 -8.855 6.658 600 HG21 VAL 75 HG21 VAL 75 -3.441 -8.715 9.715 601 HG22 VAL 75 HG22 VAL 75 -3.551 -7.261 8.667 602 HG23 VAL 75 HG23 VAL 75 -4.706 -7.479 10.025 603 H TYR 76 H TYR 76 -5.155 -8.280 5.245 604 HA TYR 76 HA TYR 76 -7.490 -9.867 4.521 605 HB2 TYR 76 HB2 TYR 76 -6.560 -7.372 3.034 606 HB3 TYR 76 HB3 TYR 76 -7.588 -8.615 2.308 607 HD1 TYR 76 HD1 TYR 76 -9.878 -9.049 3.252 608 HD2 TYR 76 HD2 TYR 76 -7.452 -5.779 4.615 609 HE1 TYR 76 HE1 TYR 76 -11.874 -7.992 4.260 610 HE2 TYR 76 HE2 TYR 76 -9.449 -4.715 5.619 611 HH TYR 76 HH TYR 76 -11.632 -4.850 5.993 612 H TYR 77 H TYR 77 -7.145 -11.233 2.619 613 HA TYR 77 HA TYR 77 -4.320 -11.483 1.854 614 HB2 TYR 77 HB2 TYR 77 -6.154 -13.593 3.067 615 HB3 TYR 77 HB3 TYR 77 -4.827 -14.051 1.991 616 HD1 TYR 77 HD1 TYR 77 -5.190 -11.612 4.870 617 HD2 TYR 77 HD2 TYR 77 -2.995 -14.875 3.145 618 HE1 TYR 77 HE1 TYR 77 -3.615 -11.556 6.776 619 HE2 TYR 77 HE2 TYR 77 -1.417 -14.821 5.053 620 HH TYR 77 HH TYR 77 -2.042 -12.969 7.925 621 H SER 78 H SER 78 -4.027 -12.013 -0.338 622 HA SER 78 HA SER 78 -6.525 -12.482 -1.831 623 HB2 SER 78 HB2 SER 78 -5.274 -11.529 -3.782 624 HB3 SER 78 HB3 SER 78 -5.576 -10.373 -2.478 625 HG SER 78 HG SER 78 -3.376 -10.786 -1.719 626 H GLU 79 H GLU 79 -6.660 -14.757 -1.908 627 HA GLU 79 HA GLU 79 -4.377 -16.382 -2.120 628 HB2 GLU 79 HB2 GLU 79 -6.992 -16.829 -1.529 629 HB3 GLU 79 HB3 GLU 79 -7.131 -17.120 -3.268 630 HG2 GLU 79 HG2 GLU 79 -5.679 -18.724 -1.163 631 HG3 GLU 79 HG3 GLU 79 -6.794 -19.269 -2.423 632 H GLU 80 H GLU 80 -6.704 -15.132 -4.670 633 HA GLU 80 HA GLU 80 -5.514 -16.593 -6.760 634 HB2 GLU 80 HB2 GLU 80 -7.057 -13.956 -6.865 635 HB3 GLU 80 HB3 GLU 80 -6.762 -15.047 -8.225 636 HG2 GLU 80 HG2 GLU 80 -8.735 -16.006 -7.740 637 HG3 GLU 80 HG3 GLU 80 -7.942 -16.728 -6.334 638 H ALA 81 H ALA 81 -4.461 -13.653 -5.056 639 HA ALA 81 HA ALA 81 -2.648 -13.104 -7.300 640 HB1 ALA 81 HB1 ALA 81 -2.314 -10.902 -6.113 641 HB2 ALA 81 HB2 ALA 81 -4.042 -11.194 -6.506 642 HB3 ALA 81 HB3 ALA 81 -3.448 -11.444 -4.830 643 H LYS 82 H LYS 82 -2.697 -14.543 -4.100 644 HA LYS 82 HA LYS 82 -1.071 -15.415 -2.843 645 HB2 LYS 82 HB2 LYS 82 0.664 -14.828 -5.272 646 HB3 LYS 82 HB3 LYS 82 1.217 -15.700 -3.836 647 HG2 LYS 82 HG2 LYS 82 -1.067 -16.559 -5.683 648 HG3 LYS 82 HG3 LYS 82 0.561 -17.250 -5.655 649 HD2 LYS 82 HD2 LYS 82 0.244 -18.044 -3.345 650 HD3 LYS 82 HD3 LYS 82 -1.319 -17.224 -3.235 651 HE2 LYS 82 HE2 LYS 82 -0.652 -19.469 -5.210 652 HE3 LYS 82 HE3 LYS 82 -1.516 -19.689 -3.682 653 HZ1 LYS 82 HZ1 LYS 82 -3.330 -19.245 -4.832 654 HZ2 LYS 82 HZ2 LYS 82 -2.850 -17.691 -4.984 655 HZ3 LYS 82 HZ3 LYS 82 -2.507 -18.771 -6.160 656 H LYS 83 H LYS 83 -1.866 -12.880 -2.187 657 HA LYS 83 HA LYS 83 0.606 -11.717 -1.168 658 HB2 LYS 83 HB2 LYS 83 -1.522 -9.925 -2.406 659 HB3 LYS 83 HB3 LYS 83 0.157 -9.538 -2.008 660 HG2 LYS 83 HG2 LYS 83 1.003 -10.694 -3.916 661 HG3 LYS 83 HG3 LYS 83 -0.515 -11.564 -4.175 662 HD2 LYS 83 HD2 LYS 83 -1.626 -9.289 -4.604 663 HD3 LYS 83 HD3 LYS 83 -0.009 -8.573 -4.575 664 HE2 LYS 83 HE2 LYS 83 0.699 -10.133 -6.411 665 HE3 LYS 83 HE3 LYS 83 -0.934 -10.809 -6.454 666 HZ1 LYS 83 HZ1 LYS 83 -0.486 -9.050 -8.104 667 HZ2 LYS 83 HZ2 LYS 83 -1.778 -8.732 -7.158 668 HZ3 LYS 83 HZ3 LYS 83 -0.366 -7.954 -6.900 669 H LYS 84 H LYS 84 0.326 -10.996 0.940 670 HA LYS 84 HA LYS 84 -2.463 -10.788 1.909 671 HB2 LYS 84 HB2 LYS 84 -1.732 -11.677 4.016 672 HB3 LYS 84 HB3 LYS 84 -1.339 -12.822 2.726 673 HG2 LYS 84 HG2 LYS 84 1.042 -11.850 2.754 674 HG3 LYS 84 HG3 LYS 84 0.581 -10.985 4.226 675 HD2 LYS 84 HD2 LYS 84 -0.306 -13.615 4.708 676 HD3 LYS 84 HD3 LYS 84 1.216 -13.848 3.838 677 HE2 LYS 84 HE2 LYS 84 1.694 -13.740 6.224 678 HE3 LYS 84 HE3 LYS 84 2.358 -12.295 5.450 679 HZ1 LYS 84 HZ1 LYS 84 1.195 -11.719 7.436 680 HZ2 LYS 84 HZ2 LYS 84 0.365 -11.109 6.170 681 HZ3 LYS 84 HZ3 LYS 84 -0.181 -12.442 6.939 682 H VAL 85 H VAL 85 -2.939 -8.994 3.328 683 HA VAL 85 HA VAL 85 -0.629 -7.128 3.601 684 HB VAL 85 HB VAL 85 -2.402 -5.286 3.426 685 HG11 VAL 85 HG11 VAL 85 -2.506 -5.352 0.932 686 HG12 VAL 85 HG12 VAL 85 -0.884 -5.811 1.552 687 HG13 VAL 85 HG13 VAL 85 -2.016 -7.079 0.972 688 HG21 VAL 85 HG21 VAL 85 -4.520 -5.757 2.263 689 HG22 VAL 85 HG22 VAL 85 -4.168 -7.516 2.347 690 HG23 VAL 85 HG23 VAL 85 -4.415 -6.577 3.857 691 H GLU 86 H GLU 86 -0.329 -6.445 5.714 692 HA GLU 86 HA GLU 86 -2.547 -6.967 7.628 693 HB2 GLU 86 HB2 GLU 86 -0.561 -7.360 9.260 694 HB3 GLU 86 HB3 GLU 86 -1.026 -8.667 8.162 695 HG2 GLU 86 HG2 GLU 86 0.991 -7.010 6.882 696 HG3 GLU 86 HG3 GLU 86 1.542 -7.462 8.500 697 H VAL 87 H VAL 87 -3.315 -5.064 8.338 698 HA VAL 87 HA VAL 87 -1.835 -2.640 8.064 699 HB VAL 87 HB VAL 87 -4.253 -2.601 7.943 700 HG11 VAL 87 HG11 VAL 87 -5.709 -3.141 9.870 701 HG12 VAL 87 HG12 VAL 87 -4.783 -4.568 9.295 702 HG13 VAL 87 HG13 VAL 87 -4.273 -3.707 10.786 703 HG21 VAL 87 HG21 VAL 87 -4.792 -0.881 9.652 704 HG22 VAL 87 HG22 VAL 87 -3.297 -1.316 10.546 705 HG23 VAL 87 HG23 VAL 87 -3.185 -0.608 8.900 706 H LEU 88 H LEU 88 -0.059 -2.199 9.389 707 HA LEU 88 HA LEU 88 0.204 -3.557 11.910 708 HB2 LEU 88 HB2 LEU 88 1.827 -1.271 10.638 709 HB3 LEU 88 HB3 LEU 88 2.338 -2.247 12.021 710 HG LEU 88 HG LEU 88 1.893 -3.288 9.190 711 HD11 LEU 88 HD11 LEU 88 4.354 -3.515 9.129 712 HD12 LEU 88 HD12 LEU 88 3.840 -1.807 9.332 713 HD13 LEU 88 HD13 LEU 88 4.461 -2.731 10.741 714 HD21 LEU 88 HD21 LEU 88 2.978 -5.350 10.027 715 HD22 LEU 88 HD22 LEU 88 3.018 -4.651 11.680 716 HD23 LEU 88 HD23 LEU 88 1.444 -4.999 10.891 717 H ASP 89 H ASP 89 -0.082 -0.021 10.924 718 HA ASP 89 HA ASP 89 -1.617 0.454 13.336 719 HB2 ASP 89 HB2 ASP 89 0.900 0.670 13.916 720 HB3 ASP 89 HB3 ASP 89 0.909 2.088 12.859 721 H THR 90 H THR 90 -2.931 2.359 13.099 722 HA THR 90 HA THR 90 -2.458 4.075 10.818 723 HB THR 90 HB THR 90 -3.717 2.058 9.950 724 HG1 THR 90 HG1 THR 90 -4.856 3.356 8.604 725 HG21 THR 90 HG21 THR 90 -6.132 1.885 10.497 726 HG22 THR 90 HG22 THR 90 -5.091 1.580 11.929 727 HG23 THR 90 HG23 THR 90 -5.930 3.158 11.748 728 H ASP 91 H ASP 91 -3.258 6.150 11.167 729 HA ASP 91 HA ASP 91 -4.610 6.518 13.746 730 HB2 ASP 91 HB2 ASP 91 -2.431 7.726 13.172 731 HB3 ASP 91 HB3 ASP 91 -3.333 8.616 11.937 732 H TYR 92 H TYR 92 -6.620 7.619 13.888 733 HA TYR 92 HA TYR 92 -8.310 7.344 11.645 734 HB2 TYR 92 HB2 TYR 92 -8.701 8.872 14.258 735 HB3 TYR 92 HB3 TYR 92 -9.975 8.489 13.093 736 HD1 TYR 92 HD1 TYR 92 -9.995 5.836 12.412 737 HD2 TYR 92 HD2 TYR 92 -8.524 7.465 16.102 738 HE1 TYR 92 HE1 TYR 92 -10.340 3.647 13.513 739 HE2 TYR 92 HE2 TYR 92 -8.867 5.276 17.208 740 HH TYR 92 HH TYR 92 -10.184 2.469 15.378 741 H LYS 93 H LYS 93 -6.360 10.101 12.864 742 HA LYS 93 HA LYS 93 -7.304 11.603 10.527 743 HB2 LYS 93 HB2 LYS 93 -6.813 12.653 13.346 744 HB3 LYS 93 HB3 LYS 93 -7.146 13.655 11.927 745 HG2 LYS 93 HG2 LYS 93 -9.385 12.633 11.694 746 HG3 LYS 93 HG3 LYS 93 -9.056 11.548 13.050 747 HD2 LYS 93 HD2 LYS 93 -8.758 13.525 14.558 748 HD3 LYS 93 HD3 LYS 93 -9.094 14.609 13.201 749 HE2 LYS 93 HE2 LYS 93 -11.026 12.472 14.241 750 HE3 LYS 93 HE3 LYS 93 -11.088 14.183 14.686 751 HZ1 LYS 93 HZ1 LYS 93 -12.583 13.826 12.920 752 HZ2 LYS 93 HZ2 LYS 93 -11.327 14.645 12.271 753 HZ3 LYS 93 HZ3 LYS 93 -11.485 13.043 11.999 754 H SER 94 H SER 94 -4.793 9.873 11.050 755 HA SER 94 HA SER 94 -3.000 12.014 10.157 756 HB2 SER 94 HB2 SER 94 -2.804 11.586 12.731 757 HB3 SER 94 HB3 SER 94 -2.268 9.947 12.336 758 HG SER 94 HG SER 94 -0.324 10.756 12.044 759 H TYR 95 H TYR 95 -0.707 10.001 10.469 760 HA TYR 95 HA TYR 95 -1.053 8.873 7.843 761 HB2 TYR 95 HB2 TYR 95 1.326 8.068 8.312 762 HB3 TYR 95 HB3 TYR 95 1.109 9.821 8.392 763 HD1 TYR 95 HD1 TYR 95 1.578 6.737 10.436 764 HD2 TYR 95 HD2 TYR 95 1.413 11.031 10.468 765 HE1 TYR 95 HE1 TYR 95 2.492 6.756 12.737 766 HE2 TYR 95 HE2 TYR 95 2.336 11.051 12.761 767 HH TYR 95 HH TYR 95 3.054 9.861 14.472 768 H ALA 96 H ALA 96 -0.197 6.504 7.526 769 HA ALA 96 HA ALA 96 -0.758 4.709 9.737 770 HB1 ALA 96 HB1 ALA 96 -2.418 3.442 8.445 771 HB2 ALA 96 HB2 ALA 96 -2.980 5.103 8.832 772 HB3 ALA 96 HB3 ALA 96 -2.394 4.716 7.179 773 H VAL 97 H VAL 97 0.144 2.600 9.471 774 HA VAL 97 HA VAL 97 1.765 2.356 7.031 775 HB VAL 97 HB VAL 97 3.464 1.149 8.439 776 HG11 VAL 97 HG11 VAL 97 4.453 3.197 9.418 777 HG12 VAL 97 HG12 VAL 97 3.794 3.489 7.773 778 HG13 VAL 97 HG13 VAL 97 2.882 4.044 9.217 779 HG21 VAL 97 HG21 VAL 97 3.442 1.496 10.886 780 HG22 VAL 97 HG22 VAL 97 1.825 2.267 10.757 781 HG23 VAL 97 HG23 VAL 97 2.030 0.535 10.329 782 H ILE 98 H ILE 98 1.466 0.424 5.916 783 HA ILE 98 HA ILE 98 0.094 -1.713 7.404 784 HB ILE 98 HB ILE 98 -0.167 -1.126 4.420 785 HG12 ILE 98 HG12 ILE 98 -1.090 0.782 5.608 786 HG13 ILE 98 HG13 ILE 98 -2.395 -0.185 4.909 787 HG21 ILE 98 HG21 ILE 98 -2.142 -2.612 4.592 788 HG22 ILE 98 HG22 ILE 98 -0.625 -3.444 5.075 789 HG23 ILE 98 HG23 ILE 98 -1.779 -2.880 6.330 790 HD11 ILE 98 HD11 ILE 98 -2.973 0.582 7.167 791 HD12 ILE 98 HD12 ILE 98 -2.839 -1.209 7.122 792 HD13 ILE 98 HD13 ILE 98 -1.514 -0.226 7.831 793 H TYR 99 H TYR 99 0.852 -3.863 7.038 794 HA TYR 99 HA TYR 99 3.484 -3.985 5.723 795 HB2 TYR 99 HB2 TYR 99 3.070 -4.742 8.147 796 HB3 TYR 99 HB3 TYR 99 2.037 -6.022 7.497 797 HD1 TYR 99 HD1 TYR 99 3.052 -7.808 6.013 798 HD2 TYR 99 HD2 TYR 99 5.458 -4.931 8.107 799 HE1 TYR 99 HE1 TYR 99 5.041 -9.253 5.715 800 HE2 TYR 99 HE2 TYR 99 7.446 -6.375 7.812 801 HH TYR 99 HH TYR 99 7.331 -9.284 5.782 802 H ALA 100 H ALA 100 3.814 -5.391 3.920 803 HA ALA 100 HA ALA 100 1.434 -6.895 3.061 804 HB1 ALA 100 HB1 ALA 100 2.038 -6.320 0.728 805 HB2 ALA 100 HB2 ALA 100 1.631 -4.867 1.702 806 HB3 ALA 100 HB3 ALA 100 3.347 -5.255 1.341 807 H THR 101 H THR 101 1.775 -9.014 2.754 808 HA THR 101 HA THR 101 4.564 -9.885 2.360 809 HB THR 101 HB THR 101 2.311 -11.522 3.611 810 HG1 THR 101 HG1 THR 101 2.490 -10.117 5.248 811 HG21 THR 101 HG21 THR 101 4.214 -12.800 4.558 812 HG22 THR 101 HG22 THR 101 4.281 -12.748 2.764 813 HG23 THR 101 HG23 THR 101 5.363 -11.693 3.735 814 H ARG 102 H ARG 102 4.922 -10.962 0.401 815 HA ARG 102 HA ARG 102 2.558 -12.229 -0.898 816 HB2 ARG 102 HB2 ARG 102 3.386 -9.886 -1.778 817 HB3 ARG 102 HB3 ARG 102 4.839 -10.747 -2.301 818 HG2 ARG 102 HG2 ARG 102 3.607 -12.110 -3.843 819 HG3 ARG 102 HG3 ARG 102 2.053 -11.639 -3.141 820 HD2 ARG 102 HD2 ARG 102 2.097 -10.219 -4.971 821 HD3 ARG 102 HD3 ARG 102 2.856 -9.174 -3.763 822 HE ARG 102 HE ARG 102 4.951 -9.464 -4.834 823 HH11 ARG 102 HH11 ARG 102 2.499 -11.517 -6.293 824 HH12 ARG 102 HH12 ARG 102 3.403 -11.780 -7.747 825 HH21 ARG 102 HH21 ARG 102 6.143 -9.863 -6.755 826 HH22 ARG 102 HH22 ARG 102 5.459 -10.846 -8.007 827 H VAL 103 H VAL 103 2.984 -14.398 -1.352 828 HA VAL 103 HA VAL 103 5.831 -15.090 -1.500 829 HB VAL 103 HB VAL 103 3.594 -16.823 -0.348 830 HG11 VAL 103 HG11 VAL 103 5.450 -18.282 0.400 831 HG12 VAL 103 HG12 VAL 103 5.396 -18.121 -1.388 832 HG13 VAL 103 HG13 VAL 103 6.621 -17.211 -0.441 833 HG21 VAL 103 HG21 VAL 103 4.675 -16.448 1.843 834 HG22 VAL 103 HG22 VAL 103 5.808 -15.285 1.077 835 HG23 VAL 103 HG23 VAL 103 4.049 -14.924 1.127 836 H LYS 104 H LYS 104 6.420 -16.546 -3.129 837 HA LYS 104 HA LYS 104 4.309 -17.469 -4.927 838 HB2 LYS 104 HB2 LYS 104 7.029 -16.338 -5.643 839 HB3 LYS 104 HB3 LYS 104 5.941 -17.154 -6.774 840 HG2 LYS 104 HG2 LYS 104 4.286 -15.416 -6.595 841 HG3 LYS 104 HG3 LYS 104 5.082 -14.697 -5.189 842 HD2 LYS 104 HD2 LYS 104 5.675 -13.312 -7.048 843 HD3 LYS 104 HD3 LYS 104 7.119 -14.263 -6.678 844 HE2 LYS 104 HE2 LYS 104 5.083 -15.088 -8.805 845 HE3 LYS 104 HE3 LYS 104 6.484 -14.068 -9.159 846 HZ1 LYS 104 HZ1 LYS 104 7.539 -15.974 -9.443 847 HZ2 LYS 104 HZ2 LYS 104 7.528 -16.179 -7.823 848 HZ3 LYS 104 HZ3 LYS 104 6.371 -16.874 -8.741 849 H ASP 105 H ASP 105 5.150 -19.359 -6.368 850 HA ASP 105 HA ASP 105 5.766 -21.511 -4.971 851 HB2 ASP 105 HB2 ASP 105 6.277 -20.683 -7.816 852 HB3 ASP 105 HB3 ASP 105 7.151 -22.121 -7.272 853 H GLY 106 H GLY 106 7.224 -21.474 -3.228 854 HA2 GLY 106 HA2 GLY 106 9.288 -22.108 -2.477 855 HA3 GLY 106 HA3 GLY 106 9.933 -21.962 -4.117 856 H ARG 107 H ARG 107 8.358 -18.971 -3.486 857 HA ARG 107 HA ARG 107 10.790 -17.874 -2.240 858 HB2 ARG 107 HB2 ARG 107 10.931 -17.761 -4.771 859 HB3 ARG 107 HB3 ARG 107 9.417 -16.847 -4.788 860 HG2 ARG 107 HG2 ARG 107 10.403 -14.905 -3.988 861 HG3 ARG 107 HG3 ARG 107 11.654 -15.770 -3.085 862 HD2 ARG 107 HD2 ARG 107 11.586 -15.841 -6.132 863 HD3 ARG 107 HD3 ARG 107 12.325 -14.484 -5.271 864 HE ARG 107 HE ARG 107 13.594 -16.541 -4.084 865 HH11 ARG 107 HH11 ARG 107 12.881 -16.042 -7.494 866 HH12 ARG 107 HH12 ARG 107 14.291 -16.893 -8.032 867 HH21 ARG 107 HH21 ARG 107 15.437 -17.631 -4.805 868 HH22 ARG 107 HH22 ARG 107 15.745 -17.797 -6.501 869 H THR 108 H THR 108 10.410 -16.319 -0.729 870 HA THR 108 HA THR 108 7.647 -15.337 -0.525 871 HB THR 108 HB THR 108 9.737 -15.345 1.676 872 HG1 THR 108 HG1 THR 108 8.784 -17.415 2.324 873 HG21 THR 108 HG21 THR 108 7.733 -15.425 3.130 874 HG22 THR 108 HG22 THR 108 7.704 -14.005 2.031 875 HG23 THR 108 HG23 THR 108 6.683 -15.438 1.673 876 H LEU 109 H LEU 109 7.254 -13.128 -0.807 877 HA LEU 109 HA LEU 109 9.656 -11.421 -0.676 878 HB2 LEU 109 HB2 LEU 109 8.747 -11.730 -2.969 879 HB3 LEU 109 HB3 LEU 109 7.165 -11.161 -2.419 880 HG LEU 109 HG LEU 109 8.104 -8.937 -1.927 881 HD11 LEU 109 HD11 LEU 109 10.405 -8.372 -2.646 882 HD12 LEU 109 HD12 LEU 109 10.394 -9.607 -1.342 883 HD13 LEU 109 HD13 LEU 109 10.699 -10.098 -3.043 884 HD21 LEU 109 HD21 LEU 109 8.544 -8.241 -4.258 885 HD22 LEU 109 HD22 LEU 109 8.759 -9.962 -4.726 886 HD23 LEU 109 HD23 LEU 109 7.161 -9.382 -4.147 887 H HIS 110 H HIS 110 9.506 -9.454 0.427 888 HA HIS 110 HA HIS 110 6.962 -9.025 1.874 889 HB2 HIS 110 HB2 HIS 110 9.845 -8.603 2.802 890 HB3 HIS 110 HB3 HIS 110 8.414 -8.052 3.682 891 HD2 HIS 110 HD2 HIS 110 9.588 -11.630 2.311 892 HE1 HIS 110 HE1 HIS 110 7.774 -12.064 6.160 893 H MET 111 H MET 111 6.207 -6.836 1.915 894 HA MET 111 HA MET 111 7.989 -4.704 0.922 895 HB2 MET 111 HB2 MET 111 7.052 -5.698 -1.147 896 HB3 MET 111 HB3 MET 111 5.421 -5.666 -0.463 897 HG2 MET 111 HG2 MET 111 5.512 -3.172 -0.384 898 HG3 MET 111 HG3 MET 111 7.133 -3.214 -1.090 899 HE1 MET 111 HE1 MET 111 6.757 -3.857 -4.718 900 HE2 MET 111 HE2 MET 111 7.780 -3.678 -3.253 901 HE3 MET 111 HE3 MET 111 7.066 -5.275 -3.660 902 H MET 112 H MET 112 7.745 -3.217 2.481 903 HA MET 112 HA MET 112 5.142 -3.045 3.830 904 HB2 MET 112 HB2 MET 112 7.923 -2.056 4.610 905 HB3 MET 112 HB3 MET 112 6.449 -1.657 5.501 906 HG2 MET 112 HG2 MET 112 6.057 -4.054 5.968 907 HG3 MET 112 HG3 MET 112 7.492 -4.487 5.030 908 HE1 MET 112 HE1 MET 112 10.460 -3.247 7.118 909 HE2 MET 112 HE2 MET 112 9.806 -3.625 5.489 910 HE3 MET 112 HE3 MET 112 9.631 -1.970 6.165 911 H ARG 113 H ARG 113 4.361 -0.746 4.256 912 HA ARG 113 HA ARG 113 5.581 1.400 2.876 913 HB2 ARG 113 HB2 ARG 113 3.555 1.836 1.407 914 HB3 ARG 113 HB3 ARG 113 4.801 0.700 0.873 915 HG2 ARG 113 HG2 ARG 113 3.276 -1.152 1.918 916 HG3 ARG 113 HG3 ARG 113 2.015 0.087 1.932 917 HD2 ARG 113 HD2 ARG 113 2.294 0.443 -0.508 918 HD3 ARG 113 HD3 ARG 113 3.624 -0.722 -0.548 919 HE ARG 113 HE ARG 113 0.754 -1.326 -0.375 920 HH11 ARG 113 HH11 ARG 113 4.032 -2.537 -0.026 921 HH12 ARG 113 HH12 ARG 113 3.572 -4.198 -0.197 922 HH21 ARG 113 HH21 ARG 113 0.139 -3.509 -0.512 923 HH22 ARG 113 HH22 ARG 113 1.341 -4.755 -0.475 924 H LEU 114 H LEU 114 4.091 3.429 2.897 925 HA LEU 114 HA LEU 114 2.307 3.313 5.243 926 HB2 LEU 114 HB2 LEU 114 4.597 4.084 5.907 927 HB3 LEU 114 HB3 LEU 114 4.501 5.366 4.692 928 HG LEU 114 HG LEU 114 2.471 5.153 6.939 929 HD11 LEU 114 HD11 LEU 114 3.857 6.784 8.190 930 HD12 LEU 114 HD12 LEU 114 4.709 5.219 7.963 931 HD13 LEU 114 HD13 LEU 114 5.145 6.635 6.947 932 HD21 LEU 114 HD21 LEU 114 2.234 7.577 6.517 933 HD22 LEU 114 HD22 LEU 114 3.461 7.465 5.210 934 HD23 LEU 114 HD23 LEU 114 1.893 6.604 5.046 935 H TYR 115 H TYR 115 0.491 4.691 5.088 936 HA TYR 115 HA TYR 115 0.366 6.251 2.585 937 HB2 TYR 115 HB2 TYR 115 -1.883 5.663 2.264 938 HB3 TYR 115 HB3 TYR 115 -0.969 4.165 2.482 939 HD1 TYR 115 HD1 TYR 115 -1.299 2.765 4.493 940 HD2 TYR 115 HD2 TYR 115 -3.549 6.378 3.907 941 HE1 TYR 115 HE1 TYR 115 -2.909 2.044 6.232 942 HE2 TYR 115 HE2 TYR 115 -5.162 5.657 5.643 943 HH TYR 115 HH TYR 115 -5.074 2.409 7.017 944 H SER 116 H SER 116 -0.737 8.282 2.648 945 HA SER 116 HA SER 116 -0.972 9.275 5.437 946 HB2 SER 116 HB2 SER 116 -0.362 10.701 2.759 947 HB3 SER 116 HB3 SER 116 -0.643 11.547 4.286 948 HG SER 116 HG SER 116 1.574 11.311 4.124 949 H ARG 117 H ARG 117 -2.875 10.803 5.734 950 HA ARG 117 HA ARG 117 -5.221 9.771 4.614 951 HB2 ARG 117 HB2 ARG 117 -4.417 12.056 6.382 952 HB3 ARG 117 HB3 ARG 117 -5.919 12.320 5.487 953 HG2 ARG 117 HG2 ARG 117 -6.475 9.844 6.367 954 HG3 ARG 117 HG3 ARG 117 -5.285 10.263 7.606 955 HD2 ARG 117 HD2 ARG 117 -7.550 10.855 8.363 956 HD3 ARG 117 HD3 ARG 117 -6.564 12.311 8.180 957 HE ARG 117 HE ARG 117 -7.730 12.658 5.980 958 HH11 ARG 117 HH11 ARG 117 -9.239 10.616 8.420 959 HH12 ARG 117 HH12 ARG 117 -10.842 10.876 7.816 960 HH21 ARG 117 HH21 ARG 117 -9.834 12.992 5.209 961 HH22 ARG 117 HH22 ARG 117 -11.179 12.229 5.988 962 H SER 118 H SER 118 -2.931 12.212 3.383 963 HA SER 118 HA SER 118 -4.682 12.596 1.045 964 HB2 SER 118 HB2 SER 118 -3.189 14.879 2.407 965 HB3 SER 118 HB3 SER 118 -4.331 14.970 1.060 966 HG SER 118 HG SER 118 -5.309 15.574 3.093 967 HA PRO 119 HA PRO 119 -0.704 12.019 -0.932 968 HB2 PRO 119 HB2 PRO 119 -0.693 13.928 -2.966 969 HB3 PRO 119 HB3 PRO 119 -1.722 12.493 -3.057 970 HG2 PRO 119 HG2 PRO 119 -2.439 15.313 -2.250 971 HG3 PRO 119 HG3 PRO 119 -3.362 14.159 -3.221 972 HD2 PRO 119 HD2 PRO 119 -3.918 14.636 -0.570 973 HD3 PRO 119 HD3 PRO 119 -4.245 13.078 -1.341 974 H GLU 120 H GLU 120 0.221 12.839 1.226 975 HA GLU 120 HA GLU 120 2.327 14.638 0.566 976 HB2 GLU 120 HB2 GLU 120 1.720 16.290 2.417 977 HB3 GLU 120 HB3 GLU 120 0.916 16.460 0.851 978 HG2 GLU 120 HG2 GLU 120 -1.044 15.140 1.834 979 HG3 GLU 120 HG3 GLU 120 -0.249 15.274 3.407 980 H VAL 121 H VAL 121 4.075 13.786 1.594 981 HA VAL 121 HA VAL 121 3.589 11.837 3.657 982 HB VAL 121 HB VAL 121 6.204 13.222 2.638 983 HG11 VAL 121 HG11 VAL 121 7.396 11.262 3.574 984 HG12 VAL 121 HG12 VAL 121 6.504 12.167 4.843 985 HG13 VAL 121 HG13 VAL 121 5.842 10.623 4.207 986 HG21 VAL 121 HG21 VAL 121 6.532 11.358 1.155 987 HG22 VAL 121 HG22 VAL 121 5.134 10.511 1.841 988 HG23 VAL 121 HG23 VAL 121 4.871 11.983 0.890 989 H SER 122 H SER 122 3.881 12.169 5.861 990 HA SER 122 HA SER 122 4.581 14.861 6.802 991 HB2 SER 122 HB2 SER 122 3.341 14.036 8.881 992 HB3 SER 122 HB3 SER 122 2.357 14.308 7.437 993 HG SER 122 HG SER 122 1.890 12.252 8.455 994 HA PRO 123 HA PRO 123 8.357 13.486 8.618 995 HB2 PRO 123 HB2 PRO 123 8.177 15.093 10.973 996 HB3 PRO 123 HB3 PRO 123 8.852 15.666 9.442 997 HG2 PRO 123 HG2 PRO 123 6.089 16.071 10.584 998 HG3 PRO 123 HG3 PRO 123 7.094 17.194 9.657 999 HD2 PRO 123 HD2 PRO 123 5.022 15.918 8.476 1000 HD3 PRO 123 HD3 PRO 123 6.517 16.206 7.578 1001 H ALA 124 H ALA 124 5.456 13.779 10.806 1002 HA ALA 124 HA ALA 124 6.401 12.100 12.805 1003 HB1 ALA 124 HB1 ALA 124 4.006 11.769 13.337 1004 HB2 ALA 124 HB2 ALA 124 4.389 13.493 13.006 1005 HB3 ALA 124 HB3 ALA 124 3.561 12.501 11.759 1006 H ALA 125 H ALA 125 4.507 11.258 9.786 1007 HA ALA 125 HA ALA 125 4.394 8.491 10.364 1008 HB1 ALA 125 HB1 ALA 125 3.802 8.301 7.972 1009 HB2 ALA 125 HB2 ALA 125 2.893 9.626 8.774 1010 HB3 ALA 125 HB3 ALA 125 4.292 10.009 7.715 1011 H THR 126 H THR 126 6.734 10.610 8.606 1012 HA THR 126 HA THR 126 8.260 8.584 7.444 1013 HB THR 126 HB THR 126 9.173 11.327 8.442 1014 HG1 THR 126 HG1 THR 126 7.420 11.659 7.045 1015 HG21 THR 126 HG21 THR 126 10.832 11.139 6.607 1016 HG22 THR 126 HG22 THR 126 11.018 9.815 7.806 1017 HG23 THR 126 HG23 THR 126 10.221 9.493 6.229 1018 H ALA 127 H ALA 127 8.684 10.390 10.612 1019 HA ALA 127 HA ALA 127 10.990 8.959 11.370 1020 HB1 ALA 127 HB1 ALA 127 10.510 9.904 13.611 1021 HB2 ALA 127 HB2 ALA 127 10.381 11.142 12.317 1022 HB3 ALA 127 HB3 ALA 127 8.894 10.434 13.033 1023 H ILE 128 H ILE 128 7.448 8.374 11.911 1024 HA ILE 128 HA ILE 128 7.804 6.355 13.826 1025 HB ILE 128 HB ILE 128 5.555 6.998 11.877 1026 HG12 ILE 128 HG12 ILE 128 5.952 8.615 13.688 1027 HG13 ILE 128 HG13 ILE 128 4.411 7.775 13.905 1028 HG21 ILE 128 HG21 ILE 128 4.145 5.413 13.143 1029 HG22 ILE 128 HG22 ILE 128 5.496 4.586 12.296 1030 HG23 ILE 128 HG23 ILE 128 5.588 4.874 14.066 1031 HD11 ILE 128 HD11 ILE 128 5.593 8.021 16.041 1032 HD12 ILE 128 HD12 ILE 128 5.445 6.288 15.596 1033 HD13 ILE 128 HD13 ILE 128 7.010 7.141 15.375 1034 H PHE 129 H PHE 129 7.198 6.152 10.213 1035 HA PHE 129 HA PHE 129 7.328 3.378 10.029 1036 HB2 PHE 129 HB2 PHE 129 6.554 5.070 8.294 1037 HB3 PHE 129 HB3 PHE 129 8.255 5.424 7.964 1038 HD1 PHE 129 HD1 PHE 129 5.587 2.876 7.709 1039 HD2 PHE 129 HD2 PHE 129 9.651 3.867 6.747 1040 HE1 PHE 129 HE1 PHE 129 5.661 0.994 6.103 1041 HE2 PHE 129 HE2 PHE 129 9.731 1.984 5.139 1042 HZ PHE 129 HZ PHE 129 7.736 0.542 4.815 1043 H ARG 130 H ARG 130 9.967 5.867 10.098 1044 HA ARG 130 HA ARG 130 11.982 4.030 9.310 1045 HB2 ARG 130 HB2 ARG 130 11.951 6.643 9.263 1046 HB3 ARG 130 HB3 ARG 130 12.451 6.532 10.955 1047 HG2 ARG 130 HG2 ARG 130 14.337 4.940 10.080 1048 HG3 ARG 130 HG3 ARG 130 13.936 5.574 8.479 1049 HD2 ARG 130 HD2 ARG 130 14.807 7.208 10.916 1050 HD3 ARG 130 HD3 ARG 130 15.784 6.856 9.484 1051 HE ARG 130 HE ARG 130 13.780 8.133 8.290 1052 HH11 ARG 130 HH11 ARG 130 15.341 8.903 11.345 1053 HH12 ARG 130 HH12 ARG 130 14.998 10.597 11.233 1054 HH21 ARG 130 HH21 ARG 130 13.337 10.360 8.156 1055 HH22 ARG 130 HH22 ARG 130 13.858 11.426 9.418 1056 H LYS 131 H LYS 131 10.812 5.277 12.543 1057 HA LYS 131 HA LYS 131 12.756 4.142 14.131 1058 HB2 LYS 131 HB2 LYS 131 9.769 4.537 14.625 1059 HB3 LYS 131 HB3 LYS 131 10.917 4.059 15.882 1060 HG2 LYS 131 HG2 LYS 131 12.209 6.161 15.503 1061 HG3 LYS 131 HG3 LYS 131 11.061 6.640 14.246 1062 HD2 LYS 131 HD2 LYS 131 9.204 6.471 16.008 1063 HD3 LYS 131 HD3 LYS 131 10.469 6.237 17.223 1064 HE2 LYS 131 HE2 LYS 131 11.529 8.417 16.448 1065 HE3 LYS 131 HE3 LYS 131 10.143 8.660 15.377 1066 HZ1 LYS 131 HZ1 LYS 131 9.862 9.800 17.460 1067 HZ2 LYS 131 HZ2 LYS 131 8.722 8.639 17.324 1068 HZ3 LYS 131 HZ3 LYS 131 10.002 8.414 18.313 1069 H LEU 132 H LEU 132 9.668 2.607 12.897 1070 HA LEU 132 HA LEU 132 10.132 0.139 14.218 1071 HB2 LEU 132 HB2 LEU 132 8.509 0.826 11.732 1072 HB3 LEU 132 HB3 LEU 132 8.435 -0.706 12.612 1073 HG LEU 132 HG LEU 132 7.680 2.020 13.752 1074 HD11 LEU 132 HD11 LEU 132 5.359 1.172 13.632 1075 HD12 LEU 132 HD12 LEU 132 6.118 1.283 12.008 1076 HD13 LEU 132 HD13 LEU 132 5.950 -0.314 12.814 1077 HD21 LEU 132 HD21 LEU 132 6.733 0.714 15.625 1078 HD22 LEU 132 HD22 LEU 132 7.385 -0.793 14.897 1079 HD23 LEU 132 HD23 LEU 132 8.508 0.484 15.474 1080 H ALA 133 H ALA 133 10.843 1.421 10.881 1081 HA ALA 133 HA ALA 133 11.798 -0.923 9.762 1082 HB1 ALA 133 HB1 ALA 133 13.018 0.584 8.221 1083 HB2 ALA 133 HB2 ALA 133 11.327 1.126 8.494 1084 HB3 ALA 133 HB3 ALA 133 12.683 1.965 9.319 1085 H GLY 134 H GLY 134 13.508 1.485 11.903 1086 HA2 GLY 134 HA2 GLY 134 16.079 0.364 11.505 1087 HA3 GLY 134 HA3 GLY 134 15.558 1.431 12.816 1088 H GLU 135 H GLU 135 13.304 -0.420 13.659 1089 HA GLU 135 HA GLU 135 14.742 -1.934 15.556 1090 HB2 GLU 135 HB2 GLU 135 12.459 -1.054 15.898 1091 HB3 GLU 135 HB3 GLU 135 11.851 -2.041 14.562 1092 HG2 GLU 135 HG2 GLU 135 12.786 -4.066 15.978 1093 HG3 GLU 135 HG3 GLU 135 12.754 -2.914 17.318 1094 H ARG 136 H ARG 136 13.644 -2.591 12.222 1095 HA ARG 136 HA ARG 136 14.161 -5.452 12.619 1096 HB2 ARG 136 HB2 ARG 136 13.232 -4.359 9.988 1097 HB3 ARG 136 HB3 ARG 136 12.768 -5.844 10.829 1098 HG2 ARG 136 HG2 ARG 136 11.511 -4.304 12.503 1099 HG3 ARG 136 HG3 ARG 136 11.751 -3.014 11.317 1100 HD2 ARG 136 HD2 ARG 136 9.648 -3.868 10.717 1101 HD3 ARG 136 HD3 ARG 136 10.730 -4.688 9.583 1102 HE ARG 136 HE ARG 136 10.193 -6.710 10.584 1103 HH11 ARG 136 HH11 ARG 136 9.327 -4.113 12.792 1104 HH12 ARG 136 HH12 ARG 136 8.516 -5.164 13.905 1105 HH21 ARG 136 HH21 ARG 136 9.128 -8.079 12.058 1106 HH22 ARG 136 HH22 ARG 136 8.404 -7.421 13.487 1107 H ASN 137 H ASN 137 16.271 -3.121 12.413 1108 HA ASN 137 HA ASN 137 18.247 -2.773 11.468 1109 HB2 ASN 137 HB2 ASN 137 17.864 -5.697 10.648 1110 HB3 ASN 137 HB3 ASN 137 19.364 -4.801 10.375 1111 HD21 ASN 137 HD21 ASN 137 19.393 -3.285 12.839 1112 HD22 ASN 137 HD22 ASN 137 19.715 -4.400 14.125 1113 H TYR 138 H TYR 138 15.953 -1.844 9.915 1114 HA TYR 138 HA TYR 138 16.028 -2.845 7.263 1115 HB2 TYR 138 HB2 TYR 138 14.476 -1.063 6.872 1116 HB3 TYR 138 HB3 TYR 138 14.319 -1.234 8.625 1117 HD1 TYR 138 HD1 TYR 138 16.159 0.300 9.980 1118 HD2 TYR 138 HD2 TYR 138 14.615 1.099 6.053 1119 HE1 TYR 138 HE1 TYR 138 16.704 2.698 10.257 1120 HE2 TYR 138 HE2 TYR 138 15.161 3.497 6.325 1121 HH TYR 138 HH TYR 138 16.001 5.062 7.631 1122 H THR 139 H THR 139 16.864 -1.744 5.322 1123 HA THR 139 HA THR 139 19.378 -0.256 5.901 1124 HB THR 139 HB THR 139 18.813 -1.415 3.193 1125 HG1 THR 139 HG1 THR 139 19.312 -3.601 3.950 1126 HG21 THR 139 HG21 THR 139 21.169 -2.161 3.449 1127 HG22 THR 139 HG22 THR 139 20.986 -0.419 3.844 1128 HG23 THR 139 HG23 THR 139 21.148 -1.626 5.163 1129 H ASP 140 H ASP 140 19.812 1.687 4.610 1130 HA ASP 140 HA ASP 140 17.576 3.308 4.336 1131 HB2 ASP 140 HB2 ASP 140 19.828 4.340 4.382 1132 HB3 ASP 140 HB3 ASP 140 20.470 3.185 3.206 1133 H GLU 141 H GLU 141 19.415 1.751 1.526 1134 HA GLU 141 HA GLU 141 17.582 2.590 -0.395 1135 HB2 GLU 141 HB2 GLU 141 19.448 0.190 -0.383 1136 HB3 GLU 141 HB3 GLU 141 18.576 0.784 -1.802 1137 HG2 GLU 141 HG2 GLU 141 19.750 3.047 -1.391 1138 HG3 GLU 141 HG3 GLU 141 20.779 2.187 -0.238 1139 H MET 142 H MET 142 17.003 0.282 2.141 1140 HA MET 142 HA MET 142 15.371 -1.482 0.540 1141 HB2 MET 142 HB2 MET 142 16.520 -2.295 2.567 1142 HB3 MET 142 HB3 MET 142 15.749 -1.048 3.556 1143 HG2 MET 142 HG2 MET 142 13.501 -2.103 2.977 1144 HG3 MET 142 HG3 MET 142 14.389 -3.422 2.203 1145 HE1 MET 142 HE1 MET 142 15.866 -5.509 4.312 1146 HE2 MET 142 HE2 MET 142 16.562 -4.162 3.350 1147 HE3 MET 142 HE3 MET 142 16.842 -4.239 5.122 1148 H VAL 143 H VAL 143 14.974 1.610 2.194 1149 HA VAL 143 HA VAL 143 12.078 1.353 2.041 1150 HB VAL 143 HB VAL 143 13.759 3.401 3.530 1151 HG11 VAL 143 HG11 VAL 143 11.628 4.019 4.620 1152 HG12 VAL 143 HG12 VAL 143 11.592 4.301 2.846 1153 HG13 VAL 143 HG13 VAL 143 10.756 2.873 3.546 1154 HG21 VAL 143 HG21 VAL 143 12.991 2.224 5.571 1155 HG22 VAL 143 HG22 VAL 143 12.201 0.981 4.544 1156 HG23 VAL 143 HG23 VAL 143 13.986 1.168 4.514 1157 H ALA 144 H ALA 144 10.854 3.189 1.097 1158 HA ALA 144 HA ALA 144 12.480 4.999 -0.549 1159 HB1 ALA 144 HB1 ALA 144 10.843 4.632 -2.399 1160 HB2 ALA 144 HB2 ALA 144 11.713 3.119 -1.976 1161 HB3 ALA 144 HB3 ALA 144 10.027 3.372 -1.412 1162 H MET 145 H MET 145 11.847 7.073 -0.292 1163 HA MET 145 HA MET 145 9.152 7.616 0.668 1164 HB2 MET 145 HB2 MET 145 11.734 9.029 1.370 1165 HB3 MET 145 HB3 MET 145 10.116 9.579 1.825 1166 HG2 MET 145 HG2 MET 145 9.754 7.640 3.220 1167 HG3 MET 145 HG3 MET 145 11.206 6.842 2.602 1168 HE1 MET 145 HE1 MET 145 12.177 7.616 6.335 1169 HE2 MET 145 HE2 MET 145 10.562 7.150 5.701 1170 HE3 MET 145 HE3 MET 145 12.042 6.360 5.058 1171 H LEU 146 H LEU 146 7.958 9.356 -0.217 1172 HA LEU 146 HA LEU 146 9.363 10.729 -2.407 1173 HB2 LEU 146 HB2 LEU 146 6.495 9.725 -2.257 1174 HB3 LEU 146 HB3 LEU 146 7.136 10.754 -3.544 1175 HG LEU 146 HG LEU 146 7.039 8.534 -4.379 1176 HD11 LEU 146 HD11 LEU 146 9.402 8.028 -4.907 1177 HD12 LEU 146 HD12 LEU 146 9.031 9.780 -5.047 1178 HD13 LEU 146 HD13 LEU 146 9.924 9.162 -3.616 1179 HD21 LEU 146 HD21 LEU 146 8.178 6.614 -3.323 1180 HD22 LEU 146 HD22 LEU 146 8.624 7.656 -1.929 1181 HD23 LEU 146 HD23 LEU 146 6.896 7.308 -2.274 1182 HA PRO 147 HA PRO 147 8.110 14.292 0.028 1183 HB2 PRO 147 HB2 PRO 147 9.616 16.095 -1.463 1184 HB3 PRO 147 HB3 PRO 147 10.392 15.055 -0.261 1185 HG2 PRO 147 HG2 PRO 147 10.204 14.690 -3.266 1186 HG3 PRO 147 HG3 PRO 147 11.600 14.466 -2.203 1187 HD2 PRO 147 HD2 PRO 147 10.118 12.346 -3.076 1188 HD3 PRO 147 HD3 PRO 147 10.882 12.340 -1.481 1189 H ARG 148 H ARG 148 7.785 16.797 -1.195 1190 HA ARG 148 HA ARG 148 5.266 16.470 -2.325 1191 HB2 ARG 148 HB2 ARG 148 5.138 18.807 -2.465 1192 HB3 ARG 148 HB3 ARG 148 6.116 18.460 -1.032 1193 HG2 ARG 148 HG2 ARG 148 7.231 19.277 -3.760 1194 HG3 ARG 148 HG3 ARG 148 6.984 20.370 -2.392 1195 HD2 ARG 148 HD2 ARG 148 8.772 17.887 -2.306 1196 HD3 ARG 148 HD3 ARG 148 9.357 19.520 -2.651 1197 HE ARG 148 HE ARG 148 7.916 18.981 -0.096 1198 HH11 ARG 148 HH11 ARG 148 10.851 19.916 -1.801 1199 HH12 ARG 148 HH12 ARG 148 11.648 20.472 -0.367 1200 HH21 ARG 148 HH21 ARG 148 8.978 19.718 1.770 1201 HH22 ARG 148 HH22 ARG 148 10.583 20.359 1.663 1202 H GLN 149 H GLN 149 6.358 14.820 -3.964 1203 HA GLN 149 HA GLN 149 6.887 16.124 -6.483 1204 HB2 GLN 149 HB2 GLN 149 8.677 14.778 -5.481 1205 HB3 GLN 149 HB3 GLN 149 7.682 13.358 -5.828 1206 HG2 GLN 149 HG2 GLN 149 7.601 14.512 -8.270 1207 HG3 GLN 149 HG3 GLN 149 9.130 15.196 -7.703 1208 HE21 GLN 149 HE21 GLN 149 9.711 12.782 -5.976 1209 HE22 GLN 149 HE22 GLN 149 10.222 11.551 -7.082 1210 H GLU 150 H GLU 150 4.131 15.630 -5.319 1211 HA GLU 150 HA GLU 150 3.204 13.415 -6.909 1212 HB2 GLU 150 HB2 GLU 150 1.023 13.947 -5.907 1213 HB3 GLU 150 HB3 GLU 150 2.286 13.805 -4.678 1214 HG2 GLU 150 HG2 GLU 150 1.127 15.673 -3.944 1215 HG3 GLU 150 HG3 GLU 150 2.447 16.414 -4.858 1216 H GLU 151 H GLU 151 1.494 13.459 -8.470 1217 HA GLU 151 HA GLU 151 0.824 15.931 -9.736 1218 HB2 GLU 151 HB2 GLU 151 3.250 15.265 -10.508 1219 HB3 GLU 151 HB3 GLU 151 2.487 13.890 -11.316 1220 HG2 GLU 151 HG2 GLU 151 1.205 15.364 -12.769 1221 HG3 GLU 151 HG3 GLU 151 1.730 16.793 -11.869 1222 H CYS 152 H CYS 152 1.160 12.280 -10.129 1223 HA CYS 152 HA CYS 152 -1.333 12.389 -11.759 1224 HB2 CYS 152 HB2 CYS 152 0.541 10.901 -12.568 1225 HB3 CYS 152 HB3 CYS 152 0.721 10.184 -10.961 1226 H THR 153 H THR 153 -3.250 11.835 -10.684 1227 HA THR 153 HA THR 153 -3.089 10.522 -8.061 1228 HB THR 153 HB THR 153 -5.192 12.625 -8.693 1229 HG1 THR 153 HG1 THR 153 -3.743 14.213 -7.703 1230 HG21 THR 153 HG21 THR 153 -5.123 12.928 -6.229 1231 HG22 THR 153 HG22 THR 153 -5.437 11.218 -6.677 1232 HG23 THR 153 HG23 THR 153 -3.803 11.715 -6.121 1233 H VAL 154 H VAL 154 -5.054 9.274 -7.472 1234 HA VAL 154 HA VAL 154 -6.432 8.328 -9.874 1235 HB VAL 154 HB VAL 154 -5.290 6.669 -8.428 1236 HG11 VAL 154 HG11 VAL 154 -6.192 6.137 -6.189 1237 HG12 VAL 154 HG12 VAL 154 -5.499 7.792 -6.266 1238 HG13 VAL 154 HG13 VAL 154 -7.280 7.562 -6.296 1239 HG21 VAL 154 HG21 VAL 154 -7.198 5.108 -8.183 1240 HG22 VAL 154 HG22 VAL 154 -8.337 6.479 -8.404 1241 HG23 VAL 154 HG23 VAL 154 -7.245 5.994 -9.745 1242 H ASP 155 H ASP 155 -8.704 8.486 -10.111 1243 HA ASP 155 HA ASP 155 -9.946 10.539 -8.624 1244 HB2 ASP 155 HB2 ASP 155 -10.510 10.167 -10.971 1245 HB3 ASP 155 HB3 ASP 155 -11.023 8.507 -10.641 1246 H GLU 156 H GLU 156 -11.903 10.454 -7.332 1247 HA GLU 156 HA GLU 156 -12.028 7.967 -5.777 1248 HB2 GLU 156 HB2 GLU 156 -12.944 9.381 -3.972 1249 HB3 GLU 156 HB3 GLU 156 -11.321 9.880 -4.466 1250 HG2 GLU 156 HG2 GLU 156 -12.461 11.663 -5.934 1251 HG3 GLU 156 HG3 GLU 156 -13.966 11.254 -5.100 1252 H VAL 157 H VAL 157 -13.976 10.257 -7.756 1253 HA VAL 157 HA VAL 157 -15.898 8.400 -8.323 1254 HB VAL 157 HB VAL 157 -16.522 8.424 -5.944 1255 HG11 VAL 157 HG11 VAL 157 -17.550 10.421 -4.919 1256 HG12 VAL 157 HG12 VAL 157 -15.824 10.682 -5.342 1257 HG13 VAL 157 HG13 VAL 157 -17.117 11.381 -6.374 1258 HG21 VAL 157 HG21 VAL 157 -18.938 8.878 -6.227 1259 HG22 VAL 157 HG22 VAL 157 -18.588 9.738 -7.764 1260 HG23 VAL 157 HG23 VAL 157 -18.247 7.980 -7.620 1261 HN1 EB4 158 HN1 EB4 158 4.335 -5.679 -6.839 1262 H8 EB4 158 H8 EB4 158 -2.049 -6.555 -4.562 1263 HN2 EB4 158 HN2 EB4 158 1.766 -5.146 -8.511 1264 H9 EB4 158 H9 EB4 158 0.607 -0.595 -2.968 1265 H10 EB4 158 H10 EB4 158 4.660 -7.745 -1.327 1266 HN3 EB4 158 HN3 EB4 158 3.830 -2.654 -7.364 1267 H7 EB4 158 H7 EB4 158 2.970 -5.940 -1.238 1268 H11 EB4 158 H11 EB4 158 -3.317 -7.190 -6.595 1269 H12 EB4 158 H12 EB4 158 1.930 1.402 -3.458 1270 H15 EB4 158 H15 EB4 158 3.746 1.320 -5.174 1271 H14 EB4 158 H14 EB4 158 -2.347 -6.769 -8.838 1272 H13 EB4 158 H13 EB4 158 5.800 -8.263 -3.472 1273 H22 EB4 158 H22 EB4 158 5.123 -6.498 -7.290 1274 H30 EB4 158 H30 EB4 158 6.695 -3.071 -9.662 1275 H30A EB4 158 H30A EB4 158 6.853 -2.571 -7.902 1276 H24 EB4 158 H24 EB4 158 4.520 -1.844 -7.974 1277 H28 EB4 158 H28 EB4 158 4.262 -8.198 -8.955 1278 H28A EB4 158 H28A EB4 158 5.081 -7.211 -10.265 1279 H23 EB4 158 H23 EB4 158 1.437 -5.075 -9.700 1280 H29 EB4 158 H29 EB4 158 1.240 -2.992 -10.759 1281 H29A EB4 158 H29A EB4 158 2.747 -3.395 -11.810 Start of MODEL 9 1 H1 MET 1 H1 MET 1 -29.078 4.459 -5.735 2 H2 MET 1 H2 MET 1 -28.405 3.942 -4.340 3 H3 MET 1 H3 MET 1 -28.580 5.542 -4.618 4 HA MET 1 HA MET 1 -26.633 3.673 -5.666 5 HB2 MET 1 HB2 MET 1 -27.744 6.091 -7.157 6 HB3 MET 1 HB3 MET 1 -26.133 5.437 -7.480 7 HG2 MET 1 HG2 MET 1 -27.508 4.458 -9.123 8 HG3 MET 1 HG3 MET 1 -27.279 3.179 -7.924 9 HE1 MET 1 HE1 MET 1 -30.986 2.636 -9.235 10 HE2 MET 1 HE2 MET 1 -29.592 3.254 -10.186 11 HE3 MET 1 HE3 MET 1 -29.362 1.897 -9.032 12 H THR 2 H THR 2 -24.555 4.274 -4.966 13 HA THR 2 HA THR 2 -23.140 5.235 -3.557 14 HB THR 2 HB THR 2 -23.906 7.730 -5.158 15 HG1 THR 2 HG1 THR 2 -22.200 6.934 -6.598 16 HG21 THR 2 HG21 THR 2 -21.539 8.363 -4.786 17 HG22 THR 2 HG22 THR 2 -22.422 8.176 -3.234 18 HG23 THR 2 HG23 THR 2 -21.302 6.887 -3.790 19 H VAL 3 H VAL 3 -24.495 4.930 -1.598 20 HA VAL 3 HA VAL 3 -25.748 7.413 -0.683 21 HB VAL 3 HB VAL 3 -26.718 5.976 1.117 22 HG11 VAL 3 HG11 VAL 3 -28.317 4.768 -0.339 23 HG12 VAL 3 HG12 VAL 3 -27.982 6.428 -0.938 24 HG13 VAL 3 HG13 VAL 3 -27.218 5.013 -1.738 25 HG21 VAL 3 HG21 VAL 3 -26.597 3.516 0.901 26 HG22 VAL 3 HG22 VAL 3 -25.418 3.697 -0.441 27 HG23 VAL 3 HG23 VAL 3 -24.986 4.245 1.213 28 HA PRO 4 HA PRO 4 -22.309 7.986 2.132 29 HB2 PRO 4 HB2 PRO 4 -23.504 9.735 3.912 30 HB3 PRO 4 HB3 PRO 4 -23.183 10.260 2.254 31 HG2 PRO 4 HG2 PRO 4 -25.770 9.253 3.472 32 HG3 PRO 4 HG3 PRO 4 -25.511 10.627 2.389 33 HD2 PRO 4 HD2 PRO 4 -26.423 8.189 1.490 34 HD3 PRO 4 HD3 PRO 4 -25.476 9.279 0.470 35 H ASP 5 H ASP 5 -23.319 5.470 2.524 36 HA ASP 5 HA ASP 5 -23.841 5.399 5.421 37 HB2 ASP 5 HB2 ASP 5 -24.523 3.545 3.110 38 HB3 ASP 5 HB3 ASP 5 -24.433 2.919 4.761 39 H ARG 6 H ARG 6 -22.688 2.531 3.668 40 HA ARG 6 HA ARG 6 -20.619 2.145 5.509 41 HB2 ARG 6 HB2 ARG 6 -21.389 0.853 2.890 42 HB3 ARG 6 HB3 ARG 6 -19.888 0.406 3.711 43 HG2 ARG 6 HG2 ARG 6 -21.567 -1.171 4.389 44 HG3 ARG 6 HG3 ARG 6 -21.241 -0.129 5.781 45 HD2 ARG 6 HD2 ARG 6 -23.607 -0.288 5.703 46 HD3 ARG 6 HD3 ARG 6 -23.249 1.302 5.016 47 HE ARG 6 HE ARG 6 -23.714 0.402 2.799 48 HH11 ARG 6 HH11 ARG 6 -24.488 -1.762 5.460 49 HH12 ARG 6 HH12 ARG 6 -25.608 -2.702 4.531 50 HH21 ARG 6 HH21 ARG 6 -25.197 -0.834 1.596 51 HH22 ARG 6 HH22 ARG 6 -26.011 -2.173 2.333 52 H SER 7 H SER 7 -20.726 4.102 2.598 53 HA SER 7 HA SER 7 -18.191 3.922 1.598 54 HB2 SER 7 HB2 SER 7 -19.507 6.635 2.078 55 HB3 SER 7 HB3 SER 7 -18.675 6.050 0.631 56 HG SER 7 HG SER 7 -21.324 5.969 1.183 57 H GLU 8 H GLU 8 -19.171 5.478 4.715 58 HA GLU 8 HA GLU 8 -16.885 7.026 5.077 59 HB2 GLU 8 HB2 GLU 8 -18.700 5.606 7.077 60 HB3 GLU 8 HB3 GLU 8 -17.434 6.750 7.541 61 HG2 GLU 8 HG2 GLU 8 -18.662 8.377 5.850 62 HG3 GLU 8 HG3 GLU 8 -20.024 7.269 6.060 63 H ILE 9 H ILE 9 -17.354 3.504 5.354 64 HA ILE 9 HA ILE 9 -14.967 3.124 6.871 65 HB ILE 9 HB ILE 9 -16.604 0.995 5.471 66 HG12 ILE 9 HG12 ILE 9 -16.895 2.103 8.309 67 HG13 ILE 9 HG13 ILE 9 -17.975 2.510 6.969 68 HG21 ILE 9 HG21 ILE 9 -15.662 -0.439 7.254 69 HG22 ILE 9 HG22 ILE 9 -14.375 0.298 6.241 70 HG23 ILE 9 HG23 ILE 9 -14.720 0.958 7.875 71 HD11 ILE 9 HD11 ILE 9 -18.946 0.753 8.385 72 HD12 ILE 9 HD12 ILE 9 -18.608 0.124 6.737 73 HD13 ILE 9 HD13 ILE 9 -17.511 -0.289 8.098 74 H ALA 10 H ALA 10 -15.327 4.067 3.686 75 HA ALA 10 HA ALA 10 -12.828 2.685 2.955 76 HB1 ALA 10 HB1 ALA 10 -13.743 2.442 0.659 77 HB2 ALA 10 HB2 ALA 10 -14.715 1.524 1.858 78 HB3 ALA 10 HB3 ALA 10 -15.320 3.092 1.224 79 H GLY 11 H GLY 11 -12.182 3.858 0.588 80 HA2 GLY 11 HA2 GLY 11 -12.763 6.396 -0.024 81 HA3 GLY 11 HA3 GLY 11 -11.772 6.605 1.426 82 H LYS 12 H LYS 12 -10.151 7.705 0.143 83 HA LYS 12 HA LYS 12 -8.600 5.904 -1.607 84 HB2 LYS 12 HB2 LYS 12 -7.806 7.988 -2.686 85 HB3 LYS 12 HB3 LYS 12 -9.557 7.784 -2.834 86 HG2 LYS 12 HG2 LYS 12 -9.856 9.359 -0.877 87 HG3 LYS 12 HG3 LYS 12 -8.107 9.621 -0.866 88 HD2 LYS 12 HD2 LYS 12 -8.193 10.484 -3.191 89 HD3 LYS 12 HD3 LYS 12 -9.928 10.153 -3.271 90 HE2 LYS 12 HE2 LYS 12 -9.655 12.508 -2.782 91 HE3 LYS 12 HE3 LYS 12 -10.279 11.727 -1.323 92 HZ1 LYS 12 HZ1 LYS 12 -8.374 13.303 -1.034 93 HZ2 LYS 12 HZ2 LYS 12 -8.178 11.841 -0.333 94 HZ3 LYS 12 HZ3 LYS 12 -7.402 12.189 -1.726 95 H TRP 13 H TRP 13 -6.320 5.779 -1.286 96 HA TRP 13 HA TRP 13 -5.300 7.305 1.019 97 HB2 TRP 13 HB2 TRP 13 -4.658 4.381 0.436 98 HB3 TRP 13 HB3 TRP 13 -4.144 5.341 1.830 99 HD1 TRP 13 HD1 TRP 13 -6.634 2.809 0.939 100 HE1 TRP 13 HE1 TRP 13 -8.592 2.755 2.627 101 HE3 TRP 13 HE3 TRP 13 -5.781 7.293 3.295 102 HZ2 TRP 13 HZ2 TRP 13 -9.643 4.379 4.673 103 HZ3 TRP 13 HZ3 TRP 13 -7.318 7.984 5.119 104 HH2 TRP 13 HH2 TRP 13 -9.217 6.544 5.798 105 H TYR 14 H TYR 14 -3.023 7.851 0.859 106 HA TYR 14 HA TYR 14 -1.918 7.382 -1.843 107 HB2 TYR 14 HB2 TYR 14 -1.343 9.696 0.070 108 HB3 TYR 14 HB3 TYR 14 -0.788 9.528 -1.601 109 HD1 TYR 14 HD1 TYR 14 -3.872 9.921 0.495 110 HD2 TYR 14 HD2 TYR 14 -2.129 10.298 -3.413 111 HE1 TYR 14 HE1 TYR 14 -5.904 11.086 -0.296 112 HE2 TYR 14 HE2 TYR 14 -4.165 11.459 -4.208 113 HH TYR 14 HH TYR 14 -6.421 11.792 -3.709 114 H VAL 15 H VAL 15 -0.007 6.113 -1.943 115 HA VAL 15 HA VAL 15 1.212 5.584 0.715 116 HB VAL 15 HB VAL 15 0.606 3.763 -0.922 117 HG11 VAL 15 HG11 VAL 15 2.042 3.313 -2.888 118 HG12 VAL 15 HG12 VAL 15 1.064 4.810 -3.055 119 HG13 VAL 15 HG13 VAL 15 2.814 4.919 -2.669 120 HG21 VAL 15 HG21 VAL 15 2.762 2.528 -0.732 121 HG22 VAL 15 HG22 VAL 15 3.575 4.066 -0.289 122 HG23 VAL 15 HG23 VAL 15 2.308 3.379 0.783 123 H VAL 16 H VAL 16 2.602 7.003 1.391 124 HA VAL 16 HA VAL 16 4.266 8.464 -0.532 125 HB VAL 16 HB VAL 16 4.632 10.060 1.290 126 HG11 VAL 16 HG11 VAL 16 2.387 11.034 1.469 127 HG12 VAL 16 HG12 VAL 16 2.760 10.472 -0.196 128 HG13 VAL 16 HG13 VAL 16 1.697 9.489 0.867 129 HG21 VAL 16 HG21 VAL 16 3.386 9.929 3.416 130 HG22 VAL 16 HG22 VAL 16 2.765 8.318 2.919 131 HG23 VAL 16 HG23 VAL 16 4.522 8.554 3.207 132 H ALA 17 H ALA 17 4.393 5.645 1.193 133 HA ALA 17 HA ALA 17 7.288 5.880 1.545 134 HB1 ALA 17 HB1 ALA 17 7.152 4.764 3.741 135 HB2 ALA 17 HB2 ALA 17 6.364 6.378 3.761 136 HB3 ALA 17 HB3 ALA 17 5.361 4.890 3.691 137 H LEU 18 H LEU 18 8.346 3.749 1.489 138 HA LEU 18 HA LEU 18 6.671 1.466 0.937 139 HB2 LEU 18 HB2 LEU 18 8.485 2.716 -1.176 140 HB3 LEU 18 HB3 LEU 18 7.848 1.069 -1.265 141 HG LEU 18 HG LEU 18 6.014 3.482 -1.040 142 HD11 LEU 18 HD11 LEU 18 5.793 3.407 -3.503 143 HD12 LEU 18 HD12 LEU 18 7.461 3.834 -2.991 144 HD13 LEU 18 HD13 LEU 18 7.098 2.176 -3.577 145 HD21 LEU 18 HD21 LEU 18 4.391 1.946 -2.101 146 HD22 LEU 18 HD22 LEU 18 5.636 0.651 -2.117 147 HD23 LEU 18 HD23 LEU 18 5.025 1.290 -0.554 148 H ALA 19 H ALA 19 7.776 -0.546 1.180 149 HA ALA 19 HA ALA 19 10.704 -0.341 1.719 150 HB1 ALA 19 HB1 ALA 19 10.340 -1.869 3.639 151 HB2 ALA 19 HB2 ALA 19 9.442 -0.335 3.893 152 HB3 ALA 19 HB3 ALA 19 8.565 -1.813 3.371 153 H SER 20 H SER 20 11.746 -1.919 0.479 154 HA SER 20 HA SER 20 10.034 -4.153 -0.481 155 HB2 SER 20 HB2 SER 20 12.301 -2.750 -2.022 156 HB3 SER 20 HB3 SER 20 11.215 -4.005 -2.634 157 HG SER 20 HG SER 20 10.560 -1.861 -3.306 158 H ASN 21 H ASN 21 10.920 -6.182 -0.452 159 HA ASN 21 HA ASN 21 13.304 -6.454 1.204 160 HB2 ASN 21 HB2 ASN 21 10.948 -7.736 1.302 161 HB3 ASN 21 HB3 ASN 21 11.682 -8.745 0.048 162 HD21 ASN 21 HD21 ASN 21 14.376 -8.839 0.949 163 HD22 ASN 21 HD22 ASN 21 14.413 -9.725 2.437 164 H THR 22 H THR 22 12.514 -6.367 -2.196 165 HA THR 22 HA THR 22 15.039 -7.765 -2.783 166 HB THR 22 HB THR 22 13.908 -7.755 -5.160 167 HG1 THR 22 HG1 THR 22 11.691 -7.479 -5.074 168 HG21 THR 22 HG21 THR 22 12.833 -9.913 -4.599 169 HG22 THR 22 HG22 THR 22 14.429 -9.764 -3.789 170 HG23 THR 22 HG23 THR 22 12.918 -9.512 -2.851 171 H GLU 23 H GLU 23 16.793 -6.871 -3.735 172 HA GLU 23 HA GLU 23 17.121 -4.160 -3.710 173 HB2 GLU 23 HB2 GLU 23 18.619 -5.207 -5.953 174 HB3 GLU 23 HB3 GLU 23 19.200 -4.721 -4.354 175 HG2 GLU 23 HG2 GLU 23 18.060 -7.483 -4.968 176 HG3 GLU 23 HG3 GLU 23 19.779 -7.082 -5.074 177 H PHE 24 H PHE 24 16.066 -6.230 -6.552 178 HA PHE 24 HA PHE 24 16.085 -4.293 -8.491 179 HB2 PHE 24 HB2 PHE 24 14.137 -6.605 -7.950 180 HB3 PHE 24 HB3 PHE 24 14.097 -5.655 -9.441 181 HD1 PHE 24 HD1 PHE 24 16.064 -5.690 -10.993 182 HD2 PHE 24 HD2 PHE 24 15.776 -8.311 -7.605 183 HE1 PHE 24 HE1 PHE 24 17.805 -7.151 -11.978 184 HE2 PHE 24 HE2 PHE 24 17.516 -9.774 -8.585 185 HZ PHE 24 HZ PHE 24 18.536 -9.196 -10.774 186 H PHE 25 H PHE 25 13.223 -5.123 -6.308 187 HA PHE 25 HA PHE 25 11.547 -3.147 -7.325 188 HB2 PHE 25 HB2 PHE 25 11.762 -4.542 -4.628 189 HB3 PHE 25 HB3 PHE 25 10.513 -3.331 -4.950 190 HD1 PHE 25 HD1 PHE 25 11.960 -6.430 -6.536 191 HD2 PHE 25 HD2 PHE 25 8.469 -4.063 -5.740 192 HE1 PHE 25 HE1 PHE 25 10.546 -8.169 -7.588 193 HE2 PHE 25 HE2 PHE 25 7.051 -5.798 -6.790 194 HZ PHE 25 HZ PHE 25 8.086 -7.856 -7.717 195 H LEU 26 H LEU 26 13.959 -3.002 -4.598 196 HA LEU 26 HA LEU 26 13.335 -0.428 -3.713 197 HB2 LEU 26 HB2 LEU 26 16.069 -1.786 -3.864 198 HB3 LEU 26 HB3 LEU 26 15.605 -0.467 -2.781 199 HG LEU 26 HG LEU 26 14.366 -3.252 -2.714 200 HD11 LEU 26 HD11 LEU 26 15.745 -3.614 -0.696 201 HD12 LEU 26 HD12 LEU 26 16.752 -3.363 -2.162 202 HD13 LEU 26 HD13 LEU 26 16.554 -2.034 -0.971 203 HD21 LEU 26 HD21 LEU 26 13.540 -2.528 -0.498 204 HD22 LEU 26 HD22 LEU 26 14.255 -0.903 -0.769 205 HD23 LEU 26 HD23 LEU 26 12.920 -1.482 -1.820 206 H ARG 27 H ARG 27 15.650 -1.595 -6.262 207 HA ARG 27 HA ARG 27 16.730 0.912 -6.854 208 HB2 ARG 27 HB2 ARG 27 17.534 -1.449 -7.528 209 HB3 ARG 27 HB3 ARG 27 16.351 -1.361 -8.840 210 HG2 ARG 27 HG2 ARG 27 17.508 0.938 -9.411 211 HG3 ARG 27 HG3 ARG 27 18.831 0.339 -8.401 212 HD2 ARG 27 HD2 ARG 27 19.435 -0.373 -10.568 213 HD3 ARG 27 HD3 ARG 27 18.731 -1.824 -9.843 214 HE ARG 27 HE ARG 27 16.555 -0.913 -11.040 215 HH11 ARG 27 HH11 ARG 27 19.844 -0.833 -12.302 216 HH12 ARG 27 HH12 ARG 27 19.328 -0.898 -13.954 217 HH21 ARG 27 HH21 ARG 27 15.910 -0.989 -13.181 218 HH22 ARG 27 HH22 ARG 27 17.084 -0.987 -14.454 219 H GLU 28 H GLU 28 13.872 -0.881 -8.247 220 HA GLU 28 HA GLU 28 13.400 1.126 -10.205 221 HB2 GLU 28 HB2 GLU 28 11.549 -1.041 -9.089 222 HB3 GLU 28 HB3 GLU 28 11.286 -0.116 -10.573 223 HG2 GLU 28 HG2 GLU 28 13.500 -2.144 -10.033 224 HG3 GLU 28 HG3 GLU 28 12.126 -2.326 -11.131 225 H LYS 29 H LYS 29 11.551 0.202 -7.154 226 HA LYS 29 HA LYS 29 9.737 2.257 -7.364 227 HB2 LYS 29 HB2 LYS 29 10.745 0.489 -5.161 228 HB3 LYS 29 HB3 LYS 29 9.866 1.943 -4.669 229 HG2 LYS 29 HG2 LYS 29 8.663 0.186 -6.818 230 HG3 LYS 29 HG3 LYS 29 8.608 -0.368 -5.140 231 HD2 LYS 29 HD2 LYS 29 6.566 0.853 -5.545 232 HD3 LYS 29 HD3 LYS 29 7.571 1.861 -4.495 233 HE2 LYS 29 HE2 LYS 29 7.057 3.492 -6.013 234 HE3 LYS 29 HE3 LYS 29 8.413 2.797 -6.912 235 HZ1 LYS 29 HZ1 LYS 29 6.058 3.103 -7.978 236 HZ2 LYS 29 HZ2 LYS 29 7.017 1.851 -8.401 237 HZ3 LYS 29 HZ3 LYS 29 5.790 1.621 -7.348 238 H ASP 30 H ASP 30 12.889 2.364 -5.473 239 HA ASP 30 HA ASP 30 12.468 4.886 -4.426 240 HB2 ASP 30 HB2 ASP 30 14.323 3.608 -3.623 241 HB3 ASP 30 HB3 ASP 30 14.980 3.367 -5.247 242 H LYS 31 H LYS 31 13.758 3.917 -7.690 243 HA LYS 31 HA LYS 31 14.443 6.580 -8.373 244 HB2 LYS 31 HB2 LYS 31 14.608 3.914 -9.533 245 HB3 LYS 31 HB3 LYS 31 13.960 5.046 -10.728 246 HG2 LYS 31 HG2 LYS 31 16.588 5.336 -9.192 247 HG3 LYS 31 HG3 LYS 31 16.407 4.911 -10.899 248 HD2 LYS 31 HD2 LYS 31 16.892 7.225 -10.959 249 HD3 LYS 31 HD3 LYS 31 15.136 7.171 -11.155 250 HE2 LYS 31 HE2 LYS 31 15.550 7.219 -8.347 251 HE3 LYS 31 HE3 LYS 31 16.741 8.353 -8.997 252 HZ1 LYS 31 HZ1 LYS 31 14.467 9.245 -8.498 253 HZ2 LYS 31 HZ2 LYS 31 15.056 9.609 -9.976 254 HZ3 LYS 31 HZ3 LYS 31 13.919 8.449 -9.813 255 H MET 32 H MET 32 11.157 4.813 -8.329 256 HA MET 32 HA MET 32 10.598 6.811 -10.463 257 HB2 MET 32 HB2 MET 32 8.978 4.625 -8.702 258 HB3 MET 32 HB3 MET 32 8.203 5.437 -10.069 259 HG2 MET 32 HG2 MET 32 10.626 3.562 -10.298 260 HG3 MET 32 HG3 MET 32 8.949 3.083 -10.590 261 HE1 MET 32 HE1 MET 32 10.713 3.303 -14.189 262 HE2 MET 32 HE2 MET 32 11.535 2.909 -12.642 263 HE3 MET 32 HE3 MET 32 9.920 2.211 -13.003 264 H LYS 33 H LYS 33 7.559 6.594 -8.982 265 HA LYS 33 HA LYS 33 8.207 9.067 -7.410 266 HB2 LYS 33 HB2 LYS 33 5.883 8.727 -9.394 267 HB3 LYS 33 HB3 LYS 33 5.999 10.046 -8.221 268 HG2 LYS 33 HG2 LYS 33 7.965 10.956 -9.326 269 HG3 LYS 33 HG3 LYS 33 8.094 9.545 -10.385 270 HD2 LYS 33 HD2 LYS 33 5.878 10.091 -11.402 271 HD3 LYS 33 HD3 LYS 33 5.720 11.487 -10.327 272 HE2 LYS 33 HE2 LYS 33 7.549 12.643 -11.367 273 HE3 LYS 33 HE3 LYS 33 8.129 11.180 -12.172 274 HZ1 LYS 33 HZ1 LYS 33 7.003 12.393 -13.783 275 HZ2 LYS 33 HZ2 LYS 33 5.928 11.233 -13.378 276 HZ3 LYS 33 HZ3 LYS 33 5.736 12.756 -12.820 277 H MET 34 H MET 34 5.880 9.637 -6.187 278 HA MET 34 HA MET 34 5.505 7.415 -4.420 279 HB2 MET 34 HB2 MET 34 5.409 9.746 -3.637 280 HB3 MET 34 HB3 MET 34 4.153 10.145 -4.816 281 HG2 MET 34 HG2 MET 34 2.634 8.479 -3.621 282 HG3 MET 34 HG3 MET 34 3.877 8.343 -2.371 283 HE1 MET 34 HE1 MET 34 1.263 12.023 -3.325 284 HE2 MET 34 HE2 MET 34 2.793 11.890 -4.255 285 HE3 MET 34 HE3 MET 34 1.562 10.587 -4.362 286 H ALA 35 H ALA 35 3.562 6.188 -4.119 287 HA ALA 35 HA ALA 35 1.841 6.075 -6.480 288 HB1 ALA 35 HB1 ALA 35 1.439 3.723 -5.897 289 HB2 ALA 35 HB2 ALA 35 3.163 4.077 -6.256 290 HB3 ALA 35 HB3 ALA 35 2.624 3.870 -4.556 291 H MET 36 H MET 36 -0.326 4.821 -5.811 292 HA MET 36 HA MET 36 -1.381 5.945 -3.362 293 HB2 MET 36 HB2 MET 36 -2.625 6.330 -6.092 294 HB3 MET 36 HB3 MET 36 -3.395 6.715 -4.547 295 HG2 MET 36 HG2 MET 36 -1.538 8.328 -4.059 296 HG3 MET 36 HG3 MET 36 -0.846 7.978 -5.649 297 HE1 MET 36 HE1 MET 36 -1.863 11.150 -6.895 298 HE2 MET 36 HE2 MET 36 -2.011 11.377 -5.119 299 HE3 MET 36 HE3 MET 36 -0.725 10.315 -5.784 300 H ALA 37 H ALA 37 -3.836 5.183 -3.117 301 HA ALA 37 HA ALA 37 -4.491 2.718 -4.431 302 HB1 ALA 37 HB1 ALA 37 -4.321 1.299 -2.432 303 HB2 ALA 37 HB2 ALA 37 -2.713 1.894 -2.968 304 HB3 ALA 37 HB3 ALA 37 -3.520 2.642 -1.548 305 H ARG 38 H ARG 38 -6.698 2.496 -4.415 306 HA ARG 38 HA ARG 38 -8.187 3.848 -2.222 307 HB2 ARG 38 HB2 ARG 38 -8.596 5.188 -4.108 308 HB3 ARG 38 HB3 ARG 38 -8.624 3.809 -5.215 309 HG2 ARG 38 HG2 ARG 38 -10.713 3.874 -3.045 310 HG3 ARG 38 HG3 ARG 38 -10.865 5.051 -4.356 311 HD2 ARG 38 HD2 ARG 38 -10.730 3.203 -6.036 312 HD3 ARG 38 HD3 ARG 38 -10.567 2.023 -4.729 313 HE ARG 38 HE ARG 38 -12.860 2.071 -4.510 314 HH11 ARG 38 HH11 ARG 38 -11.863 5.127 -5.944 315 HH12 ARG 38 HH12 ARG 38 -13.484 5.720 -6.094 316 HH21 ARG 38 HH21 ARG 38 -14.972 2.869 -4.709 317 HH22 ARG 38 HH22 ARG 38 -15.251 4.436 -5.392 318 H ILE 39 H ILE 39 -9.455 2.326 -1.111 319 HA ILE 39 HA ILE 39 -9.698 -0.282 -2.385 320 HB ILE 39 HB ILE 39 -10.068 0.247 0.582 321 HG12 ILE 39 HG12 ILE 39 -7.900 1.156 0.142 322 HG13 ILE 39 HG13 ILE 39 -7.707 -0.413 0.935 323 HG21 ILE 39 HG21 ILE 39 -9.408 -2.138 0.764 324 HG22 ILE 39 HG22 ILE 39 -10.852 -1.911 -0.279 325 HG23 ILE 39 HG23 ILE 39 -9.246 -2.219 -1.023 326 HD11 ILE 39 HD11 ILE 39 -6.067 -0.125 -0.865 327 HD12 ILE 39 HD12 ILE 39 -7.196 -1.469 -1.247 328 HD13 ILE 39 HD13 ILE 39 -7.391 0.125 -2.052 329 H SER 40 H SER 40 -11.761 -1.433 -2.241 330 HA SER 40 HA SER 40 -14.000 0.100 -1.126 331 HB2 SER 40 HB2 SER 40 -13.856 -0.980 -3.980 332 HB3 SER 40 HB3 SER 40 -15.300 -0.318 -3.203 333 HG SER 40 HG SER 40 -14.371 1.724 -3.115 334 H PHE 41 H PHE 41 -15.465 -1.142 -0.045 335 HA PHE 41 HA PHE 41 -14.821 -3.898 0.312 336 HB2 PHE 41 HB2 PHE 41 -16.867 -3.860 1.788 337 HB3 PHE 41 HB3 PHE 41 -15.603 -2.701 2.220 338 HD1 PHE 41 HD1 PHE 41 -15.949 -0.295 1.948 339 HD2 PHE 41 HD2 PHE 41 -19.022 -3.107 0.907 340 HE1 PHE 41 HE1 PHE 41 -17.607 1.542 1.891 341 HE2 PHE 41 HE2 PHE 41 -20.683 -1.273 0.848 342 HZ PHE 41 HZ PHE 41 -19.979 1.057 1.340 343 H LEU 42 H LEU 42 -15.282 -5.454 -1.159 344 HA LEU 42 HA LEU 42 -17.422 -5.113 -3.044 345 HB2 LEU 42 HB2 LEU 42 -15.179 -6.291 -3.402 346 HB3 LEU 42 HB3 LEU 42 -15.794 -7.605 -2.391 347 HG LEU 42 HG LEU 42 -15.948 -8.072 -4.812 348 HD11 LEU 42 HD11 LEU 42 -18.293 -8.852 -4.834 349 HD12 LEU 42 HD12 LEU 42 -17.480 -9.187 -3.268 350 HD13 LEU 42 HD13 LEU 42 -18.641 -7.823 -3.404 351 HD21 LEU 42 HD21 LEU 42 -17.645 -6.909 -6.189 352 HD22 LEU 42 HD22 LEU 42 -17.953 -5.772 -4.833 353 HD23 LEU 42 HD23 LEU 42 -16.346 -5.799 -5.635 354 H GLY 43 H GLY 43 -16.776 -7.312 -0.201 355 HA2 GLY 43 HA2 GLY 43 -19.622 -7.450 0.314 356 HA3 GLY 43 HA3 GLY 43 -18.894 -8.956 -0.261 357 H GLU 44 H GLU 44 -19.942 -9.085 2.269 358 HA GLU 44 HA GLU 44 -18.430 -8.208 4.379 359 HB2 GLU 44 HB2 GLU 44 -19.796 -10.933 4.148 360 HB3 GLU 44 HB3 GLU 44 -19.428 -10.056 5.640 361 HG2 GLU 44 HG2 GLU 44 -20.973 -8.203 4.850 362 HG3 GLU 44 HG3 GLU 44 -21.418 -9.224 3.476 363 H ASP 45 H ASP 45 -17.651 -10.860 2.079 364 HA ASP 45 HA ASP 45 -15.252 -11.366 3.713 365 HB2 ASP 45 HB2 ASP 45 -16.863 -13.293 3.643 366 HB3 ASP 45 HB3 ASP 45 -16.804 -13.277 1.876 367 H GLU 46 H GLU 46 -16.176 -9.734 0.925 368 HA GLU 46 HA GLU 46 -13.571 -10.363 -0.268 369 HB2 GLU 46 HB2 GLU 46 -15.201 -11.494 -1.653 370 HB3 GLU 46 HB3 GLU 46 -16.201 -10.039 -1.760 371 HG2 GLU 46 HG2 GLU 46 -14.642 -8.909 -3.149 372 HG3 GLU 46 HG3 GLU 46 -13.315 -9.992 -2.708 373 H LEU 47 H LEU 47 -12.660 -8.618 -1.581 374 HA LEU 47 HA LEU 47 -13.748 -6.014 -1.183 375 HB2 LEU 47 HB2 LEU 47 -11.798 -5.062 -0.144 376 HB3 LEU 47 HB3 LEU 47 -12.634 -6.229 0.889 377 HG LEU 47 HG LEU 47 -10.295 -7.145 -0.787 378 HD11 LEU 47 HD11 LEU 47 -8.772 -6.549 1.061 379 HD12 LEU 47 HD12 LEU 47 -9.515 -5.096 0.313 380 HD13 LEU 47 HD13 LEU 47 -10.118 -5.699 1.893 381 HD21 LEU 47 HD21 LEU 47 -10.008 -8.690 1.122 382 HD22 LEU 47 HD22 LEU 47 -11.399 -7.916 1.954 383 HD23 LEU 47 HD23 LEU 47 -11.655 -8.803 0.414 384 H LYS 48 H LYS 48 -12.605 -4.334 -2.417 385 HA LYS 48 HA LYS 48 -10.859 -5.432 -4.482 386 HB2 LYS 48 HB2 LYS 48 -13.319 -5.088 -5.150 387 HB3 LYS 48 HB3 LYS 48 -12.925 -3.364 -5.124 388 HG2 LYS 48 HG2 LYS 48 -11.267 -3.607 -6.850 389 HG3 LYS 48 HG3 LYS 48 -11.254 -5.370 -6.701 390 HD2 LYS 48 HD2 LYS 48 -13.726 -3.769 -7.539 391 HD3 LYS 48 HD3 LYS 48 -12.564 -4.435 -8.693 392 HE2 LYS 48 HE2 LYS 48 -13.919 -6.182 -6.588 393 HE3 LYS 48 HE3 LYS 48 -14.685 -5.839 -8.145 394 HZ1 LYS 48 HZ1 LYS 48 -13.538 -7.658 -8.720 395 HZ2 LYS 48 HZ2 LYS 48 -12.294 -6.625 -8.943 396 HZ3 LYS 48 HZ3 LYS 48 -12.395 -7.495 -7.565 397 H VAL 49 H VAL 49 -9.214 -3.968 -5.281 398 HA VAL 49 HA VAL 49 -9.169 -1.390 -3.901 399 HB VAL 49 HB VAL 49 -6.758 -1.666 -3.464 400 HG11 VAL 49 HG11 VAL 49 -6.914 -3.380 -1.683 401 HG12 VAL 49 HG12 VAL 49 -8.366 -2.324 -1.721 402 HG13 VAL 49 HG13 VAL 49 -8.444 -3.983 -2.403 403 HG21 VAL 49 HG21 VAL 49 -5.665 -3.860 -3.762 404 HG22 VAL 49 HG22 VAL 49 -7.148 -4.489 -4.556 405 HG23 VAL 49 HG23 VAL 49 -6.208 -3.166 -5.327 406 H SER 50 H SER 50 -8.230 0.341 -5.084 407 HA SER 50 HA SER 50 -7.609 -0.290 -7.908 408 HB2 SER 50 HB2 SER 50 -9.420 1.221 -7.823 409 HB3 SER 50 HB3 SER 50 -8.768 2.094 -6.431 410 HG SER 50 HG SER 50 -8.508 3.281 -8.422 411 H TYR 51 H TYR 51 -5.461 -0.155 -8.513 412 HA TYR 51 HA TYR 51 -3.575 0.938 -6.527 413 HB2 TYR 51 HB2 TYR 51 -3.702 -1.020 -8.807 414 HB3 TYR 51 HB3 TYR 51 -2.304 0.055 -8.940 415 HD1 TYR 51 HD1 TYR 51 -1.317 0.407 -6.263 416 HD2 TYR 51 HD2 TYR 51 -3.033 -3.094 -8.056 417 HE1 TYR 51 HE1 TYR 51 -0.053 -1.019 -4.686 418 HE2 TYR 51 HE2 TYR 51 -1.779 -4.520 -6.476 419 HH TYR 51 HH TYR 51 -0.683 -3.818 -3.788 420 H ALA 52 H ALA 52 -2.471 2.919 -6.973 421 HA ALA 52 HA ALA 52 -2.816 4.018 -9.709 422 HB1 ALA 52 HB1 ALA 52 -3.041 6.254 -8.668 423 HB2 ALA 52 HB2 ALA 52 -4.373 5.161 -8.161 424 HB3 ALA 52 HB3 ALA 52 -3.014 5.503 -7.037 425 H VAL 53 H VAL 53 -0.777 4.002 -10.581 426 HA VAL 53 HA VAL 53 1.346 5.120 -8.956 427 HB VAL 53 HB VAL 53 2.934 3.346 -9.681 428 HG11 VAL 53 HG11 VAL 53 2.189 1.634 -8.061 429 HG12 VAL 53 HG12 VAL 53 1.964 3.301 -7.431 430 HG13 VAL 53 HG13 VAL 53 0.552 2.373 -8.040 431 HG21 VAL 53 HG21 VAL 53 2.035 1.181 -10.477 432 HG22 VAL 53 HG22 VAL 53 0.394 1.904 -10.570 433 HG23 VAL 53 HG23 VAL 53 1.706 2.513 -11.635 434 HA PRO 54 HA PRO 54 2.274 6.769 -13.029 435 HB2 PRO 54 HB2 PRO 54 4.567 8.135 -12.372 436 HB3 PRO 54 HB3 PRO 54 3.043 8.634 -11.626 437 HG2 PRO 54 HG2 PRO 54 5.301 7.013 -10.462 438 HG3 PRO 54 HG3 PRO 54 4.254 8.201 -9.675 439 HD2 PRO 54 HD2 PRO 54 3.941 5.387 -9.543 440 HD3 PRO 54 HD3 PRO 54 2.723 6.578 -9.069 441 H LYS 55 H LYS 55 2.839 5.478 -14.626 442 HA LYS 55 HA LYS 55 5.368 4.051 -14.458 443 HB2 LYS 55 HB2 LYS 55 3.419 2.617 -14.736 444 HB3 LYS 55 HB3 LYS 55 2.927 3.515 -16.178 445 HG2 LYS 55 HG2 LYS 55 5.073 2.819 -17.307 446 HG3 LYS 55 HG3 LYS 55 5.490 1.865 -15.877 447 HD2 LYS 55 HD2 LYS 55 3.573 0.407 -16.171 448 HD3 LYS 55 HD3 LYS 55 2.858 1.476 -17.385 449 HE2 LYS 55 HE2 LYS 55 3.814 -0.261 -18.671 450 HE3 LYS 55 HE3 LYS 55 4.995 1.050 -18.796 451 HZ1 LYS 55 HZ1 LYS 55 6.047 -1.045 -18.325 452 HZ2 LYS 55 HZ2 LYS 55 6.279 -0.032 -17.066 453 HZ3 LYS 55 HZ3 LYS 55 5.189 -1.242 -16.950 454 HA PRO 56 HA PRO 56 7.334 6.657 -17.498 455 HB2 PRO 56 HB2 PRO 56 7.809 3.989 -18.965 456 HB3 PRO 56 HB3 PRO 56 8.997 5.249 -18.604 457 HG2 PRO 56 HG2 PRO 56 8.956 3.019 -17.140 458 HG3 PRO 56 HG3 PRO 56 9.234 4.578 -16.353 459 HD2 PRO 56 HD2 PRO 56 6.751 2.858 -16.346 460 HD3 PRO 56 HD3 PRO 56 7.388 3.906 -15.071 461 H ASN 57 H ASN 57 4.928 4.188 -18.518 462 HA ASN 57 HA ASN 57 4.584 5.609 -21.041 463 HB2 ASN 57 HB2 ASN 57 3.042 3.203 -19.930 464 HB3 ASN 57 HB3 ASN 57 3.087 3.760 -21.608 465 HD21 ASN 57 HD21 ASN 57 4.773 3.130 -22.944 466 HD22 ASN 57 HD22 ASN 57 6.025 2.037 -22.454 467 H GLY 58 H GLY 58 3.715 6.516 -18.035 468 HA2 GLY 58 HA2 GLY 58 2.110 8.308 -17.944 469 HA3 GLY 58 HA3 GLY 58 1.016 7.328 -18.929 470 H CYS 59 H CYS 59 -0.066 8.276 -16.621 471 HA CYS 59 HA CYS 59 0.329 6.875 -14.288 472 HB2 CYS 59 HB2 CYS 59 -2.230 8.018 -15.505 473 HB3 CYS 59 HB3 CYS 59 -2.091 7.470 -13.829 474 H ARG 60 H ARG 60 0.071 4.754 -13.712 475 HA ARG 60 HA ARG 60 -1.859 3.202 -15.288 476 HB2 ARG 60 HB2 ARG 60 0.771 2.781 -15.289 477 HB3 ARG 60 HB3 ARG 60 0.371 1.875 -13.824 478 HG2 ARG 60 HG2 ARG 60 0.291 0.303 -15.606 479 HG3 ARG 60 HG3 ARG 60 -1.393 0.632 -15.180 480 HD2 ARG 60 HD2 ARG 60 0.177 1.681 -17.579 481 HD3 ARG 60 HD3 ARG 60 -1.260 0.650 -17.586 482 HE ARG 60 HE ARG 60 -1.190 3.568 -17.047 483 HH11 ARG 60 HH11 ARG 60 -3.070 0.629 -17.493 484 HH12 ARG 60 HH12 ARG 60 -4.571 1.477 -17.666 485 HH21 ARG 60 HH21 ARG 60 -3.158 4.658 -17.244 486 HH22 ARG 60 HH22 ARG 60 -4.621 3.773 -17.524 487 H LYS 61 H LYS 61 -3.478 2.028 -14.317 488 HA LYS 61 HA LYS 61 -3.284 1.790 -11.399 489 HB2 LYS 61 HB2 LYS 61 -5.521 2.501 -11.058 490 HB3 LYS 61 HB3 LYS 61 -4.692 3.768 -11.972 491 HG2 LYS 61 HG2 LYS 61 -5.805 3.099 -14.039 492 HG3 LYS 61 HG3 LYS 61 -6.499 1.670 -13.262 493 HD2 LYS 61 HD2 LYS 61 -7.058 4.312 -11.933 494 HD3 LYS 61 HD3 LYS 61 -7.819 4.054 -13.509 495 HE2 LYS 61 HE2 LYS 61 -9.324 3.307 -11.722 496 HE3 LYS 61 HE3 LYS 61 -8.816 1.925 -12.702 497 HZ1 LYS 61 HZ1 LYS 61 -8.690 1.373 -10.411 498 HZ2 LYS 61 HZ2 LYS 61 -7.158 1.451 -10.972 499 HZ3 LYS 61 HZ3 LYS 61 -7.754 2.663 -10.054 500 H TRP 62 H TRP 62 -4.660 0.026 -10.527 501 HA TRP 62 HA TRP 62 -5.767 -1.834 -12.496 502 HB2 TRP 62 HB2 TRP 62 -3.344 -2.408 -12.337 503 HB3 TRP 62 HB3 TRP 62 -3.504 -2.573 -10.584 504 HD1 TRP 62 HD1 TRP 62 -3.637 -5.045 -9.897 505 HE1 TRP 62 HE1 TRP 62 -4.646 -7.207 -10.892 506 HE3 TRP 62 HE3 TRP 62 -5.620 -3.092 -14.216 507 HZ2 TRP 62 HZ2 TRP 62 -6.088 -7.992 -13.178 508 HZ3 TRP 62 HZ3 TRP 62 -6.809 -4.621 -15.770 509 HH2 TRP 62 HH2 TRP 62 -7.041 -7.033 -15.253 510 H GLU 63 H GLU 63 -7.182 -3.485 -11.383 511 HA GLU 63 HA GLU 63 -7.881 -2.440 -8.672 512 HB2 GLU 63 HB2 GLU 63 -9.931 -4.018 -10.213 513 HB3 GLU 63 HB3 GLU 63 -10.148 -2.585 -9.198 514 HG2 GLU 63 HG2 GLU 63 -9.348 -2.686 -12.135 515 HG3 GLU 63 HG3 GLU 63 -10.837 -2.036 -11.434 516 H THR 64 H THR 64 -7.603 -4.055 -7.154 517 HA THR 64 HA THR 64 -7.357 -6.819 -8.116 518 HB THR 64 HB THR 64 -6.060 -5.555 -5.632 519 HG1 THR 64 HG1 THR 64 -4.156 -5.392 -6.800 520 HG21 THR 64 HG21 THR 64 -4.690 -7.645 -5.648 521 HG22 THR 64 HG22 THR 64 -6.443 -8.005 -5.498 522 HG23 THR 64 HG23 THR 64 -5.613 -8.227 -7.075 523 H THR 65 H THR 65 -8.341 -8.468 -6.820 524 HA THR 65 HA THR 65 -10.306 -7.481 -4.864 525 HB THR 65 HB THR 65 -10.336 -10.161 -6.276 526 HG1 THR 65 HG1 THR 65 -11.520 -9.184 -7.942 527 HG21 THR 65 HG21 THR 65 -12.754 -9.994 -5.803 528 HG22 THR 65 HG22 THR 65 -11.777 -9.885 -4.300 529 HG23 THR 65 HG23 THR 65 -12.490 -8.401 -5.018 530 H PHE 66 H PHE 66 -10.323 -8.355 -2.722 531 HA PHE 66 HA PHE 66 -8.258 -10.403 -2.263 532 HB2 PHE 66 HB2 PHE 66 -8.967 -8.059 -0.426 533 HB3 PHE 66 HB3 PHE 66 -7.761 -9.311 -0.100 534 HD1 PHE 66 HD1 PHE 66 -6.356 -9.519 -2.703 535 HD2 PHE 66 HD2 PHE 66 -7.778 -6.070 -0.580 536 HE1 PHE 66 HE1 PHE 66 -4.620 -8.135 -3.795 537 HE2 PHE 66 HE2 PHE 66 -6.042 -4.682 -1.669 538 HZ PHE 66 HZ PHE 66 -4.459 -5.712 -3.283 539 H LYS 67 H LYS 67 -8.580 -11.422 0.050 540 HA LYS 67 HA LYS 67 -11.459 -11.987 0.373 541 HB2 LYS 67 HB2 LYS 67 -8.922 -13.636 0.543 542 HB3 LYS 67 HB3 LYS 67 -10.288 -14.071 1.578 543 HG2 LYS 67 HG2 LYS 67 -10.198 -15.341 -0.583 544 HG3 LYS 67 HG3 LYS 67 -11.720 -14.479 -0.323 545 HD2 LYS 67 HD2 LYS 67 -10.101 -12.592 -1.654 546 HD3 LYS 67 HD3 LYS 67 -9.690 -14.124 -2.436 547 HE2 LYS 67 HE2 LYS 67 -12.003 -14.571 -2.995 548 HE3 LYS 67 HE3 LYS 67 -12.582 -13.270 -1.947 549 HZ1 LYS 67 HZ1 LYS 67 -12.614 -12.376 -4.049 550 HZ2 LYS 67 HZ2 LYS 67 -11.203 -11.792 -3.471 551 HZ3 LYS 67 HZ3 LYS 67 -11.200 -13.046 -4.516 552 H LYS 68 H LYS 68 -12.270 -12.145 2.572 553 HA LYS 68 HA LYS 68 -11.014 -10.344 4.358 554 HB2 LYS 68 HB2 LYS 68 -13.491 -10.725 4.177 555 HB3 LYS 68 HB3 LYS 68 -13.276 -12.362 4.811 556 HG2 LYS 68 HG2 LYS 68 -13.944 -11.154 6.706 557 HG3 LYS 68 HG3 LYS 68 -12.186 -11.213 6.886 558 HD2 LYS 68 HD2 LYS 68 -12.858 -8.942 7.341 559 HD3 LYS 68 HD3 LYS 68 -12.057 -8.932 5.764 560 HE2 LYS 68 HE2 LYS 68 -14.152 -8.810 4.579 561 HE3 LYS 68 HE3 LYS 68 -15.083 -9.232 6.022 562 HZ1 LYS 68 HZ1 LYS 68 -15.182 -6.889 5.560 563 HZ2 LYS 68 HZ2 LYS 68 -14.419 -7.124 6.984 564 HZ3 LYS 68 HZ3 LYS 68 -13.559 -6.735 5.652 565 H THR 69 H THR 69 -9.287 -10.763 5.738 566 HA THR 69 HA THR 69 -9.313 -13.360 7.150 567 HB THR 69 HB THR 69 -6.844 -12.205 5.738 568 HG1 THR 69 HG1 THR 69 -7.413 -14.494 4.544 569 HG21 THR 69 HG21 THR 69 -5.887 -14.446 6.187 570 HG22 THR 69 HG22 THR 69 -6.395 -13.622 7.700 571 HG23 THR 69 HG23 THR 69 -7.413 -14.928 7.004 572 H SER 70 H SER 70 -9.962 -12.051 8.966 573 HA SER 70 HA SER 70 -8.435 -9.766 9.786 574 HB2 SER 70 HB2 SER 70 -10.138 -11.341 11.708 575 HB3 SER 70 HB3 SER 70 -10.035 -9.594 11.459 576 HG SER 70 HG SER 70 -12.054 -10.481 10.681 577 H ASP 71 H ASP 71 -6.257 -11.036 9.510 578 HA ASP 71 HA ASP 71 -5.638 -13.148 11.236 579 HB2 ASP 71 HB2 ASP 71 -4.395 -11.762 9.172 580 HB3 ASP 71 HB3 ASP 71 -3.513 -11.107 10.557 581 H ASP 72 H ASP 72 -4.421 -9.707 11.596 582 HA ASP 72 HA ASP 72 -4.596 -10.119 14.496 583 HB2 ASP 72 HB2 ASP 72 -2.265 -9.801 13.140 584 HB3 ASP 72 HB3 ASP 72 -2.700 -8.097 13.327 585 H GLY 73 H GLY 73 -6.624 -9.229 12.898 586 HA2 GLY 73 HA2 GLY 73 -8.386 -8.142 13.727 587 HA3 GLY 73 HA3 GLY 73 -7.411 -6.679 13.919 588 H GLU 74 H GLU 74 -6.751 -5.673 11.230 589 HA GLU 74 HA GLU 74 -9.263 -6.515 9.785 590 HB2 GLU 74 HB2 GLU 74 -7.937 -3.780 9.598 591 HB3 GLU 74 HB3 GLU 74 -9.385 -4.327 8.743 592 HG2 GLU 74 HG2 GLU 74 -10.297 -3.061 10.457 593 HG3 GLU 74 HG3 GLU 74 -10.395 -4.695 11.128 594 H VAL 75 H VAL 75 -7.361 -8.230 9.288 595 HA VAL 75 HA VAL 75 -5.414 -7.120 7.399 596 HB VAL 75 HB VAL 75 -5.753 -9.889 8.681 597 HG11 VAL 75 HG11 VAL 75 -3.542 -10.438 7.717 598 HG12 VAL 75 HG12 VAL 75 -4.773 -10.120 6.449 599 HG13 VAL 75 HG13 VAL 75 -3.543 -8.871 6.839 600 HG21 VAL 75 HG21 VAL 75 -3.662 -9.303 9.886 601 HG22 VAL 75 HG22 VAL 75 -3.682 -7.682 9.112 602 HG23 VAL 75 HG23 VAL 75 -4.992 -8.152 10.247 603 H TYR 76 H TYR 76 -5.094 -8.308 5.281 604 HA TYR 76 HA TYR 76 -7.510 -9.688 4.351 605 HB2 TYR 76 HB2 TYR 76 -6.158 -7.322 2.962 606 HB3 TYR 76 HB3 TYR 76 -7.445 -8.319 2.271 607 HD1 TYR 76 HD1 TYR 76 -9.749 -8.256 3.267 608 HD2 TYR 76 HD2 TYR 76 -6.646 -5.599 4.594 609 HE1 TYR 76 HE1 TYR 76 -11.448 -6.804 4.330 610 HE2 TYR 76 HE2 TYR 76 -8.344 -4.144 5.657 611 HH TYR 76 HH TYR 76 -10.493 -3.811 6.081 612 H TYR 77 H TYR 77 -7.158 -11.069 2.490 613 HA TYR 77 HA TYR 77 -4.325 -11.495 1.854 614 HB2 TYR 77 HB2 TYR 77 -6.382 -13.457 2.942 615 HB3 TYR 77 HB3 TYR 77 -5.124 -14.034 1.842 616 HD1 TYR 77 HD1 TYR 77 -5.378 -11.872 4.938 617 HD2 TYR 77 HD2 TYR 77 -3.215 -14.907 2.806 618 HE1 TYR 77 HE1 TYR 77 -3.805 -12.084 6.839 619 HE2 TYR 77 HE2 TYR 77 -1.648 -15.127 4.705 620 HH TYR 77 HH TYR 77 -2.265 -13.989 7.756 621 H SER 78 H SER 78 -3.958 -11.821 -0.362 622 HA SER 78 HA SER 78 -6.412 -12.120 -2.002 623 HB2 SER 78 HB2 SER 78 -4.088 -11.574 -3.583 624 HB3 SER 78 HB3 SER 78 -5.469 -10.514 -3.275 625 HG SER 78 HG SER 78 -4.181 -9.288 -2.105 626 H GLU 79 H GLU 79 -6.649 -14.431 -1.788 627 HA GLU 79 HA GLU 79 -4.523 -16.260 -1.982 628 HB2 GLU 79 HB2 GLU 79 -7.108 -16.430 -1.276 629 HB3 GLU 79 HB3 GLU 79 -7.348 -16.798 -2.989 630 HG2 GLU 79 HG2 GLU 79 -5.647 -18.361 -0.997 631 HG3 GLU 79 HG3 GLU 79 -7.186 -18.862 -1.710 632 H GLU 80 H GLU 80 -6.767 -14.834 -4.464 633 HA GLU 80 HA GLU 80 -5.842 -16.415 -6.599 634 HB2 GLU 80 HB2 GLU 80 -6.938 -13.578 -6.811 635 HB3 GLU 80 HB3 GLU 80 -7.071 -14.891 -7.988 636 HG2 GLU 80 HG2 GLU 80 -9.183 -15.020 -7.127 637 HG3 GLU 80 HG3 GLU 80 -8.382 -16.086 -5.965 638 H ALA 81 H ALA 81 -4.466 -13.570 -4.958 639 HA ALA 81 HA ALA 81 -2.664 -13.158 -7.230 640 HB1 ALA 81 HB1 ALA 81 -2.081 -11.048 -6.016 641 HB2 ALA 81 HB2 ALA 81 -3.840 -11.166 -6.361 642 HB3 ALA 81 HB3 ALA 81 -3.223 -11.506 -4.708 643 H LYS 82 H LYS 82 -2.724 -14.765 -4.128 644 HA LYS 82 HA LYS 82 -1.145 -15.855 -3.005 645 HB2 LYS 82 HB2 LYS 82 0.799 -15.198 -5.252 646 HB3 LYS 82 HB3 LYS 82 0.927 -16.495 -4.057 647 HG2 LYS 82 HG2 LYS 82 -1.044 -16.278 -6.374 648 HG3 LYS 82 HG3 LYS 82 0.225 -17.486 -6.136 649 HD2 LYS 82 HD2 LYS 82 -0.958 -18.384 -4.149 650 HD3 LYS 82 HD3 LYS 82 -2.198 -17.132 -4.294 651 HE2 LYS 82 HE2 LYS 82 -2.413 -18.103 -6.789 652 HE3 LYS 82 HE3 LYS 82 -1.690 -19.541 -6.057 653 HZ1 LYS 82 HZ1 LYS 82 -4.030 -19.693 -5.903 654 HZ2 LYS 82 HZ2 LYS 82 -3.485 -19.431 -4.386 655 HZ3 LYS 82 HZ3 LYS 82 -4.185 -18.217 -5.223 656 H LYS 83 H LYS 83 -1.657 -13.359 -2.072 657 HA LYS 83 HA LYS 83 0.873 -12.575 -0.949 658 HB2 LYS 83 HB2 LYS 83 0.619 -10.193 -1.618 659 HB3 LYS 83 HB3 LYS 83 0.970 -11.263 -2.982 660 HG2 LYS 83 HG2 LYS 83 -1.604 -11.329 -3.361 661 HG3 LYS 83 HG3 LYS 83 -1.679 -9.956 -2.249 662 HD2 LYS 83 HD2 LYS 83 -1.485 -8.840 -4.277 663 HD3 LYS 83 HD3 LYS 83 0.217 -8.942 -3.808 664 HE2 LYS 83 HE2 LYS 83 0.680 -10.686 -5.335 665 HE3 LYS 83 HE3 LYS 83 -1.015 -11.179 -5.448 666 HZ1 LYS 83 HZ1 LYS 83 0.027 -9.833 -7.342 667 HZ2 LYS 83 HZ2 LYS 83 -1.481 -9.436 -6.860 668 HZ3 LYS 83 HZ3 LYS 83 -0.209 -8.524 -6.396 669 H LYS 84 H LYS 84 0.631 -11.381 1.010 670 HA LYS 84 HA LYS 84 -2.164 -11.154 1.878 671 HB2 LYS 84 HB2 LYS 84 -1.414 -11.718 4.126 672 HB3 LYS 84 HB3 LYS 84 -0.905 -12.989 3.006 673 HG2 LYS 84 HG2 LYS 84 1.375 -12.333 3.094 674 HG3 LYS 84 HG3 LYS 84 0.993 -10.728 3.731 675 HD2 LYS 84 HD2 LYS 84 1.835 -11.964 5.593 676 HD3 LYS 84 HD3 LYS 84 0.084 -11.890 5.831 677 HE2 LYS 84 HE2 LYS 84 0.005 -14.184 4.584 678 HE3 LYS 84 HE3 LYS 84 1.754 -14.242 4.842 679 HZ1 LYS 84 HZ1 LYS 84 0.741 -15.318 6.640 680 HZ2 LYS 84 HZ2 LYS 84 1.237 -13.883 7.241 681 HZ3 LYS 84 HZ3 LYS 84 -0.342 -14.124 6.901 682 H VAL 85 H VAL 85 -2.771 -9.308 3.220 683 HA VAL 85 HA VAL 85 -0.597 -7.260 3.461 684 HB VAL 85 HB VAL 85 -2.515 -5.600 3.113 685 HG11 VAL 85 HG11 VAL 85 -2.500 -5.789 0.613 686 HG12 VAL 85 HG12 VAL 85 -0.873 -6.074 1.319 687 HG13 VAL 85 HG13 VAL 85 -1.865 -7.463 0.761 688 HG21 VAL 85 HG21 VAL 85 -4.532 -6.317 1.860 689 HG22 VAL 85 HG22 VAL 85 -4.025 -8.030 2.040 690 HG23 VAL 85 HG23 VAL 85 -4.442 -7.060 3.493 691 H GLU 86 H GLU 86 -0.367 -6.714 5.589 692 HA GLU 86 HA GLU 86 -2.663 -7.194 7.403 693 HB2 GLU 86 HB2 GLU 86 -0.262 -7.517 8.889 694 HB3 GLU 86 HB3 GLU 86 -1.446 -8.766 8.479 695 HG2 GLU 86 HG2 GLU 86 -0.122 -9.007 6.237 696 HG3 GLU 86 HG3 GLU 86 1.149 -8.078 7.043 697 H VAL 87 H VAL 87 -3.329 -5.272 8.124 698 HA VAL 87 HA VAL 87 -1.661 -2.966 8.014 699 HB VAL 87 HB VAL 87 -4.041 -2.741 7.659 700 HG11 VAL 87 HG11 VAL 87 -5.695 -3.133 9.460 701 HG12 VAL 87 HG12 VAL 87 -4.845 -4.641 8.982 702 HG13 VAL 87 HG13 VAL 87 -4.392 -3.798 10.502 703 HG21 VAL 87 HG21 VAL 87 -4.571 -0.956 9.294 704 HG22 VAL 87 HG22 VAL 87 -3.206 -1.505 10.324 705 HG23 VAL 87 HG23 VAL 87 -2.885 -0.839 8.687 706 H LEU 88 H LEU 88 -0.002 -2.604 9.476 707 HA LEU 88 HA LEU 88 0.063 -4.017 11.976 708 HB2 LEU 88 HB2 LEU 88 1.740 -1.712 10.856 709 HB3 LEU 88 HB3 LEU 88 2.111 -2.607 12.335 710 HG LEU 88 HG LEU 88 2.069 -3.728 9.502 711 HD11 LEU 88 HD11 LEU 88 4.499 -4.010 9.852 712 HD12 LEU 88 HD12 LEU 88 3.998 -2.288 9.954 713 HD13 LEU 88 HD13 LEU 88 4.356 -3.210 11.453 714 HD21 LEU 88 HD21 LEU 88 2.955 -5.802 10.523 715 HD22 LEU 88 HD22 LEU 88 2.735 -5.085 12.155 716 HD23 LEU 88 HD23 LEU 88 1.306 -5.411 11.117 717 H ASP 89 H ASP 89 -0.325 -0.494 10.985 718 HA ASP 89 HA ASP 89 -2.150 -0.087 13.155 719 HB2 ASP 89 HB2 ASP 89 0.327 0.085 14.091 720 HB3 ASP 89 HB3 ASP 89 0.305 1.665 13.297 721 H THR 90 H THR 90 -3.237 2.017 12.946 722 HA THR 90 HA THR 90 -2.433 3.712 10.745 723 HB THR 90 HB THR 90 -3.747 1.872 9.681 724 HG1 THR 90 HG1 THR 90 -4.904 3.277 8.412 725 HG21 THR 90 HG21 THR 90 -6.189 1.744 10.105 726 HG22 THR 90 HG22 THR 90 -5.229 1.315 11.561 727 HG23 THR 90 HG23 THR 90 -6.009 2.928 11.444 728 H ASP 91 H ASP 91 -3.218 5.850 10.990 729 HA ASP 91 HA ASP 91 -4.596 6.324 13.535 730 HB2 ASP 91 HB2 ASP 91 -2.445 7.524 12.867 731 HB3 ASP 91 HB3 ASP 91 -3.370 8.327 11.592 732 H TYR 92 H TYR 92 -6.640 7.402 13.612 733 HA TYR 92 HA TYR 92 -8.273 7.028 11.309 734 HB2 TYR 92 HB2 TYR 92 -8.792 8.430 13.972 735 HB3 TYR 92 HB3 TYR 92 -10.021 8.087 12.747 736 HD1 TYR 92 HD1 TYR 92 -10.276 5.568 12.022 737 HD2 TYR 92 HD2 TYR 92 -8.320 6.822 15.635 738 HE1 TYR 92 HE1 TYR 92 -10.605 3.311 12.981 739 HE2 TYR 92 HE2 TYR 92 -8.644 4.563 16.594 740 HH TYR 92 HH TYR 92 -10.300 1.977 14.709 741 H LYS 93 H LYS 93 -6.414 9.774 12.625 742 HA LYS 93 HA LYS 93 -7.333 11.347 10.329 743 HB2 LYS 93 HB2 LYS 93 -6.866 12.363 13.153 744 HB3 LYS 93 HB3 LYS 93 -7.285 13.343 11.741 745 HG2 LYS 93 HG2 LYS 93 -9.483 12.335 11.578 746 HG3 LYS 93 HG3 LYS 93 -9.068 11.076 12.749 747 HD2 LYS 93 HD2 LYS 93 -8.766 12.834 14.516 748 HD3 LYS 93 HD3 LYS 93 -9.211 14.080 13.342 749 HE2 LYS 93 HE2 LYS 93 -11.005 11.729 14.135 750 HE3 LYS 93 HE3 LYS 93 -11.108 13.346 14.842 751 HZ1 LYS 93 HZ1 LYS 93 -12.678 13.167 13.100 752 HZ2 LYS 93 HZ2 LYS 93 -11.509 14.173 12.564 753 HZ3 LYS 93 HZ3 LYS 93 -11.574 12.635 12.021 754 H SER 94 H SER 94 -4.826 9.598 10.815 755 HA SER 94 HA SER 94 -3.004 11.740 9.987 756 HB2 SER 94 HB2 SER 94 -2.832 11.461 12.536 757 HB3 SER 94 HB3 SER 94 -2.466 9.747 12.297 758 HG SER 94 HG SER 94 -0.541 11.034 12.578 759 H TYR 95 H TYR 95 -0.716 9.729 10.443 760 HA TYR 95 HA TYR 95 -0.900 8.578 7.823 761 HB2 TYR 95 HB2 TYR 95 1.420 7.859 8.326 762 HB3 TYR 95 HB3 TYR 95 1.210 9.545 8.820 763 HD1 TYR 95 HD1 TYR 95 1.568 6.054 10.037 764 HD2 TYR 95 HD2 TYR 95 1.242 10.180 11.183 765 HE1 TYR 95 HE1 TYR 95 2.251 5.466 12.341 766 HE2 TYR 95 HE2 TYR 95 1.944 9.598 13.484 767 HH TYR 95 HH TYR 95 2.322 6.204 14.488 768 H ALA 96 H ALA 96 -0.160 6.211 7.499 769 HA ALA 96 HA ALA 96 -0.933 4.413 9.654 770 HB1 ALA 96 HB1 ALA 96 -2.462 3.179 8.187 771 HB2 ALA 96 HB2 ALA 96 -3.039 4.847 8.521 772 HB3 ALA 96 HB3 ALA 96 -2.287 4.457 6.937 773 H VAL 97 H VAL 97 0.080 2.342 9.510 774 HA VAL 97 HA VAL 97 1.901 2.121 7.211 775 HB VAL 97 HB VAL 97 3.416 0.833 8.769 776 HG11 VAL 97 HG11 VAL 97 4.364 2.861 9.832 777 HG12 VAL 97 HG12 VAL 97 3.881 3.157 8.128 778 HG13 VAL 97 HG13 VAL 97 2.846 3.750 9.471 779 HG21 VAL 97 HG21 VAL 97 3.172 1.202 11.200 780 HG22 VAL 97 HG22 VAL 97 1.597 2.016 10.913 781 HG23 VAL 97 HG23 VAL 97 1.794 0.275 10.516 782 H ILE 98 H ILE 98 1.386 0.380 5.914 783 HA ILE 98 HA ILE 98 -0.006 -1.849 7.226 784 HB ILE 98 HB ILE 98 -0.008 -1.158 4.250 785 HG12 ILE 98 HG12 ILE 98 -0.979 0.741 5.414 786 HG13 ILE 98 HG13 ILE 98 -2.248 -0.174 4.588 787 HG21 ILE 98 HG21 ILE 98 -2.025 -2.597 4.217 788 HG22 ILE 98 HG22 ILE 98 -0.576 -3.481 4.802 789 HG23 ILE 98 HG23 ILE 98 -1.816 -2.917 5.972 790 HD11 ILE 98 HD11 ILE 98 -2.985 0.549 6.814 791 HD12 ILE 98 HD12 ILE 98 -2.890 -1.242 6.729 792 HD13 ILE 98 HD13 ILE 98 -1.602 -0.314 7.568 793 H TYR 99 H TYR 99 0.845 -3.936 7.017 794 HA TYR 99 HA TYR 99 3.471 -4.119 5.703 795 HB2 TYR 99 HB2 TYR 99 3.300 -4.721 8.110 796 HB3 TYR 99 HB3 TYR 99 2.023 -5.888 7.741 797 HD1 TYR 99 HD1 TYR 99 5.650 -5.176 7.461 798 HD2 TYR 99 HD2 TYR 99 2.545 -8.052 6.729 799 HE1 TYR 99 HE1 TYR 99 7.360 -6.931 7.111 800 HE2 TYR 99 HE2 TYR 99 4.253 -9.809 6.380 801 HH TYR 99 HH TYR 99 6.762 -9.814 5.604 802 H ALA 100 H ALA 100 3.825 -5.627 4.010 803 HA ALA 100 HA ALA 100 1.592 -7.389 3.345 804 HB1 ALA 100 HB1 ALA 100 1.781 -6.767 0.966 805 HB2 ALA 100 HB2 ALA 100 1.235 -5.401 1.997 806 HB3 ALA 100 HB3 ALA 100 2.932 -5.463 1.413 807 H THR 101 H THR 101 2.142 -9.272 2.152 808 HA THR 101 HA THR 101 4.912 -9.664 1.444 809 HB THR 101 HB THR 101 3.592 -11.170 3.701 810 HG1 THR 101 HG1 THR 101 6.323 -10.518 3.785 811 HG21 THR 101 HG21 THR 101 5.474 -12.767 3.584 812 HG22 THR 101 HG22 THR 101 4.443 -12.836 2.115 813 HG23 THR 101 HG23 THR 101 6.028 -11.994 2.060 814 H ARG 102 H ARG 102 5.187 -11.328 -0.134 815 HA ARG 102 HA ARG 102 2.707 -12.732 -0.942 816 HB2 ARG 102 HB2 ARG 102 3.349 -12.326 -3.274 817 HB3 ARG 102 HB3 ARG 102 3.088 -10.795 -2.429 818 HG2 ARG 102 HG2 ARG 102 5.769 -11.065 -2.016 819 HG3 ARG 102 HG3 ARG 102 5.622 -11.977 -3.525 820 HD2 ARG 102 HD2 ARG 102 4.779 -9.084 -3.018 821 HD3 ARG 102 HD3 ARG 102 6.084 -9.652 -4.067 822 HE ARG 102 HE ARG 102 3.185 -9.767 -4.641 823 HH11 ARG 102 HH11 ARG 102 6.500 -10.091 -5.718 824 HH12 ARG 102 HH12 ARG 102 6.073 -10.604 -7.317 825 HH21 ARG 102 HH21 ARG 102 2.631 -10.631 -6.721 826 HH22 ARG 102 HH22 ARG 102 3.884 -10.909 -7.885 827 H VAL 103 H VAL 103 3.093 -14.963 -1.400 828 HA VAL 103 HA VAL 103 5.935 -15.701 -1.300 829 HB VAL 103 HB VAL 103 4.723 -16.456 0.699 830 HG11 VAL 103 HG11 VAL 103 2.896 -18.111 0.541 831 HG12 VAL 103 HG12 VAL 103 2.453 -16.539 -0.207 832 HG13 VAL 103 HG13 VAL 103 2.898 -17.934 -1.246 833 HG21 VAL 103 HG21 VAL 103 5.234 -18.874 0.557 834 HG22 VAL 103 HG22 VAL 103 5.365 -18.734 -1.229 835 HG23 VAL 103 HG23 VAL 103 6.529 -17.866 -0.172 836 H LYS 104 H LYS 104 6.756 -16.784 -2.957 837 HA LYS 104 HA LYS 104 4.997 -17.990 -4.953 838 HB2 LYS 104 HB2 LYS 104 6.695 -15.764 -5.285 839 HB3 LYS 104 HB3 LYS 104 7.505 -17.132 -6.061 840 HG2 LYS 104 HG2 LYS 104 4.563 -16.648 -6.600 841 HG3 LYS 104 HG3 LYS 104 5.774 -15.636 -7.397 842 HD2 LYS 104 HD2 LYS 104 6.674 -17.414 -8.621 843 HD3 LYS 104 HD3 LYS 104 6.195 -18.628 -7.428 844 HE2 LYS 104 HE2 LYS 104 3.777 -18.241 -8.076 845 HE3 LYS 104 HE3 LYS 104 4.327 -17.134 -9.340 846 HZ1 LYS 104 HZ1 LYS 104 3.944 -19.492 -10.017 847 HZ2 LYS 104 HZ2 LYS 104 5.400 -18.886 -10.439 848 HZ3 LYS 104 HZ3 LYS 104 5.278 -19.914 -9.176 849 H ASP 105 H ASP 105 6.326 -19.646 -6.356 850 HA ASP 105 HA ASP 105 7.068 -21.768 -5.020 851 HB2 ASP 105 HB2 ASP 105 8.609 -20.651 -7.458 852 HB3 ASP 105 HB3 ASP 105 8.630 -22.345 -6.951 853 H GLY 106 H GLY 106 8.121 -21.548 -2.986 854 HA2 GLY 106 HA2 GLY 106 10.021 -21.828 -1.785 855 HA3 GLY 106 HA3 GLY 106 10.960 -21.743 -3.281 856 H ARG 107 H ARG 107 9.024 -18.887 -3.192 857 HA ARG 107 HA ARG 107 11.162 -17.454 -1.739 858 HB2 ARG 107 HB2 ARG 107 11.630 -17.513 -4.235 859 HB3 ARG 107 HB3 ARG 107 10.017 -16.858 -4.546 860 HG2 ARG 107 HG2 ARG 107 10.597 -14.714 -3.894 861 HG3 ARG 107 HG3 ARG 107 11.799 -15.266 -2.721 862 HD2 ARG 107 HD2 ARG 107 12.112 -15.392 -5.767 863 HD3 ARG 107 HD3 ARG 107 12.835 -14.165 -4.718 864 HE ARG 107 HE ARG 107 13.714 -16.553 -3.634 865 HH11 ARG 107 HH11 ARG 107 13.861 -15.118 -6.845 866 HH12 ARG 107 HH12 ARG 107 15.342 -15.914 -7.259 867 HH21 ARG 107 HH21 ARG 107 15.640 -17.591 -4.193 868 HH22 ARG 107 HH22 ARG 107 16.356 -17.323 -5.747 869 H THR 108 H THR 108 10.433 -15.921 -0.393 870 HA THR 108 HA THR 108 7.657 -15.035 -0.732 871 HB THR 108 HB THR 108 9.221 -14.996 1.851 872 HG1 THR 108 HG1 THR 108 8.051 -17.009 2.310 873 HG21 THR 108 HG21 THR 108 6.946 -14.949 2.822 874 HG22 THR 108 HG22 THR 108 7.224 -13.565 1.712 875 HG23 THR 108 HG23 THR 108 6.244 -14.968 1.169 876 H LEU 109 H LEU 109 7.271 -12.797 -1.023 877 HA LEU 109 HA LEU 109 9.680 -11.120 -0.673 878 HB2 LEU 109 HB2 LEU 109 8.879 -11.315 -2.988 879 HB3 LEU 109 HB3 LEU 109 7.265 -10.790 -2.490 880 HG LEU 109 HG LEU 109 8.134 -8.580 -1.872 881 HD11 LEU 109 HD11 LEU 109 10.459 -7.942 -2.420 882 HD12 LEU 109 HD12 LEU 109 10.391 -9.225 -1.165 883 HD13 LEU 109 HD13 LEU 109 10.818 -9.647 -2.857 884 HD21 LEU 109 HD21 LEU 109 8.709 -7.788 -4.145 885 HD22 LEU 109 HD22 LEU 109 8.986 -9.486 -4.660 886 HD23 LEU 109 HD23 LEU 109 7.344 -8.954 -4.165 887 H HIS 110 H HIS 110 9.548 -9.377 0.732 888 HA HIS 110 HA HIS 110 6.930 -9.062 2.095 889 HB2 HIS 110 HB2 HIS 110 9.798 -8.430 3.022 890 HB3 HIS 110 HB3 HIS 110 8.333 -8.100 3.956 891 HD2 HIS 110 HD2 HIS 110 10.967 -10.760 3.764 892 HE1 HIS 110 HE1 HIS 110 7.480 -12.754 5.236 893 H MET 111 H MET 111 6.136 -6.865 2.165 894 HA MET 111 HA MET 111 7.885 -4.660 1.357 895 HB2 MET 111 HB2 MET 111 6.900 -5.993 -0.715 896 HB3 MET 111 HB3 MET 111 5.362 -5.264 -0.233 897 HG2 MET 111 HG2 MET 111 6.417 -2.995 -0.436 898 HG3 MET 111 HG3 MET 111 7.901 -3.766 -1.010 899 HE1 MET 111 HE1 MET 111 6.989 -5.268 -4.424 900 HE2 MET 111 HE2 MET 111 8.281 -4.274 -3.671 901 HE3 MET 111 HE3 MET 111 7.664 -5.735 -2.827 902 H MET 112 H MET 112 7.450 -3.248 2.924 903 HA MET 112 HA MET 112 4.698 -3.070 3.971 904 HB2 MET 112 HB2 MET 112 6.557 -3.575 5.571 905 HB3 MET 112 HB3 MET 112 7.331 -2.050 5.121 906 HG2 MET 112 HG2 MET 112 5.396 -0.775 5.969 907 HG3 MET 112 HG3 MET 112 4.532 -2.275 6.331 908 HE1 MET 112 HE1 MET 112 5.368 -0.951 9.909 909 HE2 MET 112 HE2 MET 112 5.378 0.236 8.562 910 HE3 MET 112 HE3 MET 112 4.151 -1.075 8.594 911 H ARG 113 H ARG 113 3.886 -0.789 4.352 912 HA ARG 113 HA ARG 113 5.320 1.279 2.959 913 HB2 ARG 113 HB2 ARG 113 3.393 1.821 1.469 914 HB3 ARG 113 HB3 ARG 113 4.226 0.317 1.055 915 HG2 ARG 113 HG2 ARG 113 2.381 -0.875 2.459 916 HG3 ARG 113 HG3 ARG 113 1.508 0.661 2.381 917 HD2 ARG 113 HD2 ARG 113 0.871 -0.941 0.549 918 HD3 ARG 113 HD3 ARG 113 1.465 0.612 -0.053 919 HE ARG 113 HE ARG 113 3.254 -0.495 -1.038 920 HH11 ARG 113 HH11 ARG 113 1.844 -2.609 1.397 921 HH12 ARG 113 HH12 ARG 113 2.838 -3.962 0.971 922 HH21 ARG 113 HH21 ARG 113 4.607 -2.264 -1.513 923 HH22 ARG 113 HH22 ARG 113 4.400 -3.765 -0.674 924 H LEU 114 H LEU 114 4.179 3.423 3.085 925 HA LEU 114 HA LEU 114 2.449 3.552 5.484 926 HB2 LEU 114 HB2 LEU 114 4.679 4.268 6.091 927 HB3 LEU 114 HB3 LEU 114 4.823 5.258 4.632 928 HG LEU 114 HG LEU 114 2.830 6.619 5.578 929 HD11 LEU 114 HD11 LEU 114 2.642 6.605 8.039 930 HD12 LEU 114 HD12 LEU 114 2.145 5.039 7.314 931 HD13 LEU 114 HD13 LEU 114 3.748 5.191 8.110 932 HD21 LEU 114 HD21 LEU 114 4.359 7.994 6.952 933 HD22 LEU 114 HD22 LEU 114 5.548 6.649 6.965 934 HD23 LEU 114 HD23 LEU 114 5.126 7.461 5.419 935 H TYR 115 H TYR 115 0.507 4.623 5.047 936 HA TYR 115 HA TYR 115 0.495 6.215 2.568 937 HB2 TYR 115 HB2 TYR 115 -1.724 5.621 2.152 938 HB3 TYR 115 HB3 TYR 115 -0.840 4.124 2.474 939 HD1 TYR 115 HD1 TYR 115 -3.300 6.536 3.892 940 HD2 TYR 115 HD2 TYR 115 -1.479 2.663 4.274 941 HE1 TYR 115 HE1 TYR 115 -5.026 5.891 5.544 942 HE2 TYR 115 HE2 TYR 115 -3.202 2.017 5.932 943 HH TYR 115 HH TYR 115 -5.334 2.572 6.698 944 H SER 116 H SER 116 -0.689 8.206 2.525 945 HA SER 116 HA SER 116 -0.943 9.322 5.272 946 HB2 SER 116 HB2 SER 116 -0.375 10.670 2.539 947 HB3 SER 116 HB3 SER 116 -0.573 11.540 4.066 948 HG SER 116 HG SER 116 1.516 11.261 4.306 949 H ARG 117 H ARG 117 -2.858 10.732 5.555 950 HA ARG 117 HA ARG 117 -5.151 9.712 4.302 951 HB2 ARG 117 HB2 ARG 117 -4.468 11.575 6.447 952 HB3 ARG 117 HB3 ARG 117 -5.778 12.237 5.460 953 HG2 ARG 117 HG2 ARG 117 -6.729 9.718 5.732 954 HG3 ARG 117 HG3 ARG 117 -5.734 9.776 7.193 955 HD2 ARG 117 HD2 ARG 117 -8.035 10.516 7.679 956 HD3 ARG 117 HD3 ARG 117 -6.887 11.837 7.937 957 HE ARG 117 HE ARG 117 -7.755 12.961 6.042 958 HH11 ARG 117 HH11 ARG 117 -9.277 9.810 6.435 959 HH12 ARG 117 HH12 ARG 117 -10.582 10.176 5.356 960 HH21 ARG 117 HH21 ARG 117 -9.474 13.421 4.639 961 HH22 ARG 117 HH22 ARG 117 -10.694 12.229 4.336 962 H SER 118 H SER 118 -2.880 12.163 3.240 963 HA SER 118 HA SER 118 -4.702 12.840 1.033 964 HB2 SER 118 HB2 SER 118 -3.100 14.978 2.488 965 HB3 SER 118 HB3 SER 118 -4.402 15.179 1.307 966 HG SER 118 HG SER 118 -5.122 15.574 3.495 967 HA PRO 119 HA PRO 119 -0.833 12.437 -1.168 968 HB2 PRO 119 HB2 PRO 119 -0.919 14.497 -3.038 969 HB3 PRO 119 HB3 PRO 119 -2.034 13.130 -3.161 970 HG2 PRO 119 HG2 PRO 119 -2.512 15.886 -1.991 971 HG3 PRO 119 HG3 PRO 119 -3.557 14.931 -3.051 972 HD2 PRO 119 HD2 PRO 119 -3.968 15.057 -0.346 973 HD3 PRO 119 HD3 PRO 119 -4.376 13.613 -1.284 974 H GLU 120 H GLU 120 -0.068 13.336 1.201 975 HA GLU 120 HA GLU 120 2.168 15.008 0.496 976 HB2 GLU 120 HB2 GLU 120 1.647 16.637 2.381 977 HB3 GLU 120 HB3 GLU 120 0.809 16.861 0.840 978 HG2 GLU 120 HG2 GLU 120 -1.214 15.759 1.769 979 HG3 GLU 120 HG3 GLU 120 -0.378 15.501 3.306 980 H VAL 121 H VAL 121 3.898 14.095 1.509 981 HA VAL 121 HA VAL 121 3.382 12.046 3.455 982 HB VAL 121 HB VAL 121 5.986 13.531 2.623 983 HG11 VAL 121 HG11 VAL 121 7.193 11.492 3.379 984 HG12 VAL 121 HG12 VAL 121 6.275 12.272 4.710 985 HG13 VAL 121 HG13 VAL 121 5.635 10.788 3.928 986 HG21 VAL 121 HG21 VAL 121 6.407 11.508 1.148 987 HG22 VAL 121 HG22 VAL 121 4.708 11.082 1.419 988 HG23 VAL 121 HG23 VAL 121 5.095 12.615 0.620 989 H SER 122 H SER 122 3.624 12.228 5.678 990 HA SER 122 HA SER 122 4.109 14.902 6.773 991 HB2 SER 122 HB2 SER 122 3.005 13.781 8.828 992 HB3 SER 122 HB3 SER 122 1.969 14.108 7.432 993 HG SER 122 HG SER 122 1.683 11.942 8.260 994 HA PRO 123 HA PRO 123 8.078 13.751 8.347 995 HB2 PRO 123 HB2 PRO 123 7.883 15.343 10.720 996 HB3 PRO 123 HB3 PRO 123 8.478 15.948 9.169 997 HG2 PRO 123 HG2 PRO 123 5.735 16.206 10.395 998 HG3 PRO 123 HG3 PRO 123 6.642 17.373 9.423 999 HD2 PRO 123 HD2 PRO 123 4.606 15.973 8.326 1000 HD3 PRO 123 HD3 PRO 123 6.053 16.329 7.373 1001 H ALA 124 H ALA 124 5.365 13.926 10.786 1002 HA ALA 124 HA ALA 124 6.561 12.222 12.632 1003 HB1 ALA 124 HB1 ALA 124 4.247 11.876 13.452 1004 HB2 ALA 124 HB2 ALA 124 4.589 13.606 13.111 1005 HB3 ALA 124 HB3 ALA 124 3.611 12.639 11.956 1006 H ALA 125 H ALA 125 4.440 11.440 9.770 1007 HA ALA 125 HA ALA 125 4.275 8.673 10.352 1008 HB1 ALA 125 HB1 ALA 125 3.512 8.504 8.013 1009 HB2 ALA 125 HB2 ALA 125 2.696 9.846 8.886 1010 HB3 ALA 125 HB3 ALA 125 4.021 10.203 7.726 1011 H THR 126 H THR 126 6.635 10.736 8.600 1012 HA THR 126 HA THR 126 7.976 8.671 7.261 1013 HB THR 126 HB THR 126 9.052 11.348 8.283 1014 HG1 THR 126 HG1 THR 126 7.183 11.677 6.966 1015 HG21 THR 126 HG21 THR 126 10.621 11.151 6.370 1016 HG22 THR 126 HG22 THR 126 10.810 9.791 7.528 1017 HG23 THR 126 HG23 THR 126 9.934 9.538 5.981 1018 H ALA 127 H ALA 127 8.585 10.313 10.478 1019 HA ALA 127 HA ALA 127 10.869 8.684 11.008 1020 HB1 ALA 127 HB1 ALA 127 10.742 9.759 13.250 1021 HB2 ALA 127 HB2 ALA 127 10.643 10.960 11.918 1022 HB3 ALA 127 HB3 ALA 127 9.157 10.476 12.803 1023 H ILE 128 H ILE 128 7.352 8.553 11.918 1024 HA ILE 128 HA ILE 128 7.531 6.749 13.994 1025 HB ILE 128 HB ILE 128 5.439 7.144 11.812 1026 HG12 ILE 128 HG12 ILE 128 5.687 8.992 13.386 1027 HG13 ILE 128 HG13 ILE 128 4.151 8.162 13.666 1028 HG21 ILE 128 HG21 ILE 128 3.896 5.762 13.166 1029 HG22 ILE 128 HG22 ILE 128 5.285 4.808 12.543 1030 HG23 ILE 128 HG23 ILE 128 5.253 5.330 14.261 1031 HD11 ILE 128 HD11 ILE 128 5.243 8.740 15.788 1032 HD12 ILE 128 HD12 ILE 128 5.138 6.957 15.595 1033 HD13 ILE 128 HD13 ILE 128 6.698 7.801 15.311 1034 H PHE 129 H PHE 129 7.155 6.038 10.378 1035 HA PHE 129 HA PHE 129 7.328 3.238 10.725 1036 HB2 PHE 129 HB2 PHE 129 6.503 4.545 8.681 1037 HB3 PHE 129 HB3 PHE 129 8.172 5.042 8.369 1038 HD1 PHE 129 HD1 PHE 129 9.916 3.064 8.091 1039 HD2 PHE 129 HD2 PHE 129 5.665 2.651 7.646 1040 HE1 PHE 129 HE1 PHE 129 10.259 1.019 6.738 1041 HE2 PHE 129 HE2 PHE 129 6.003 0.607 6.292 1042 HZ PHE 129 HZ PHE 129 8.302 -0.215 5.836 1043 H ARG 130 H ARG 130 9.829 5.561 9.320 1044 HA ARG 130 HA ARG 130 11.970 3.924 9.133 1045 HB2 ARG 130 HB2 ARG 130 11.483 6.668 9.103 1046 HB3 ARG 130 HB3 ARG 130 12.356 6.557 10.637 1047 HG2 ARG 130 HG2 ARG 130 13.866 5.072 8.703 1048 HG3 ARG 130 HG3 ARG 130 13.395 6.596 7.939 1049 HD2 ARG 130 HD2 ARG 130 14.649 6.446 10.721 1050 HD3 ARG 130 HD3 ARG 130 15.603 6.609 9.241 1051 HE ARG 130 HE ARG 130 14.187 8.735 8.855 1052 HH11 ARG 130 HH11 ARG 130 14.917 7.474 12.051 1053 HH12 ARG 130 HH12 ARG 130 14.850 9.028 12.814 1054 HH21 ARG 130 HH21 ARG 130 14.131 10.775 9.865 1055 HH22 ARG 130 HH22 ARG 130 14.403 10.905 11.570 1056 H LYS 131 H LYS 131 10.767 5.335 12.333 1057 HA LYS 131 HA LYS 131 12.959 4.494 13.831 1058 HB2 LYS 131 HB2 LYS 131 9.955 4.759 14.437 1059 HB3 LYS 131 HB3 LYS 131 11.114 4.315 15.696 1060 HG2 LYS 131 HG2 LYS 131 12.362 6.471 15.216 1061 HG3 LYS 131 HG3 LYS 131 11.067 6.917 14.097 1062 HD2 LYS 131 HD2 LYS 131 9.400 6.720 15.962 1063 HD3 LYS 131 HD3 LYS 131 10.706 6.299 17.077 1064 HE2 LYS 131 HE2 LYS 131 11.824 8.512 16.490 1065 HE3 LYS 131 HE3 LYS 131 10.391 8.929 15.542 1066 HZ1 LYS 131 HZ1 LYS 131 10.270 9.814 17.763 1067 HZ2 LYS 131 HZ2 LYS 131 9.081 8.715 17.557 1068 HZ3 LYS 131 HZ3 LYS 131 10.404 8.330 18.432 1069 H LEU 132 H LEU 132 9.741 2.701 13.440 1070 HA LEU 132 HA LEU 132 10.620 0.381 14.748 1071 HB2 LEU 132 HB2 LEU 132 8.546 0.748 12.543 1072 HB3 LEU 132 HB3 LEU 132 8.730 -0.700 13.541 1073 HG LEU 132 HG LEU 132 7.974 2.074 14.557 1074 HD11 LEU 132 HD11 LEU 132 5.754 1.059 14.955 1075 HD12 LEU 132 HD12 LEU 132 6.198 1.044 13.215 1076 HD13 LEU 132 HD13 LEU 132 6.317 -0.462 14.185 1077 HD21 LEU 132 HD21 LEU 132 7.497 0.920 16.690 1078 HD22 LEU 132 HD22 LEU 132 8.138 -0.609 16.000 1079 HD23 LEU 132 HD23 LEU 132 9.229 0.798 16.231 1080 H ALA 133 H ALA 133 10.867 1.524 11.331 1081 HA ALA 133 HA ALA 133 11.592 -0.845 10.105 1082 HB1 ALA 133 HB1 ALA 133 12.711 0.626 8.456 1083 HB2 ALA 133 HB2 ALA 133 11.094 1.255 8.918 1084 HB3 ALA 133 HB3 ALA 133 12.578 2.004 9.599 1085 H GLY 134 H GLY 134 13.579 1.399 12.184 1086 HA2 GLY 134 HA2 GLY 134 16.050 0.157 11.464 1087 HA3 GLY 134 HA3 GLY 134 15.743 1.262 12.811 1088 H GLU 135 H GLU 135 13.508 -0.409 13.980 1089 HA GLU 135 HA GLU 135 15.067 -1.992 15.690 1090 HB2 GLU 135 HB2 GLU 135 12.763 -0.977 16.107 1091 HB3 GLU 135 HB3 GLU 135 12.085 -2.263 15.100 1092 HG2 GLU 135 HG2 GLU 135 13.273 -3.923 16.687 1093 HG3 GLU 135 HG3 GLU 135 13.552 -2.541 17.755 1094 H ARG 136 H ARG 136 13.712 -2.607 12.466 1095 HA ARG 136 HA ARG 136 14.113 -5.498 12.822 1096 HB2 ARG 136 HB2 ARG 136 12.745 -3.837 10.647 1097 HB3 ARG 136 HB3 ARG 136 12.948 -5.593 10.584 1098 HG2 ARG 136 HG2 ARG 136 11.486 -5.945 12.447 1099 HG3 ARG 136 HG3 ARG 136 11.546 -4.245 12.928 1100 HD2 ARG 136 HD2 ARG 136 9.745 -3.808 11.647 1101 HD3 ARG 136 HD3 ARG 136 10.644 -4.295 10.204 1102 HE ARG 136 HE ARG 136 9.678 -6.463 10.339 1103 HH11 ARG 136 HH11 ARG 136 8.649 -4.439 13.025 1104 HH12 ARG 136 HH12 ARG 136 7.287 -5.437 13.412 1105 HH21 ARG 136 HH21 ARG 136 7.874 -7.749 10.850 1106 HH22 ARG 136 HH22 ARG 136 6.848 -7.317 12.176 1107 H ASN 137 H ASN 137 16.308 -3.287 12.510 1108 HA ASN 137 HA ASN 137 18.228 -3.025 11.489 1109 HB2 ASN 137 HB2 ASN 137 17.668 -5.949 10.843 1110 HB3 ASN 137 HB3 ASN 137 19.131 -5.158 10.242 1111 HD21 ASN 137 HD21 ASN 137 19.464 -3.426 12.634 1112 HD22 ASN 137 HD22 ASN 137 20.029 -4.471 13.894 1113 H TYR 138 H TYR 138 15.911 -2.061 9.973 1114 HA TYR 138 HA TYR 138 16.143 -2.906 7.269 1115 HB2 TYR 138 HB2 TYR 138 14.501 -1.262 6.874 1116 HB3 TYR 138 HB3 TYR 138 14.242 -1.569 8.597 1117 HD1 TYR 138 HD1 TYR 138 16.326 -0.029 9.953 1118 HD2 TYR 138 HD2 TYR 138 14.077 1.002 6.443 1119 HE1 TYR 138 HE1 TYR 138 16.688 2.370 10.430 1120 HE2 TYR 138 HE2 TYR 138 14.434 3.405 6.923 1121 HH TYR 138 HH TYR 138 16.119 4.811 8.148 1122 H THR 139 H THR 139 16.871 -1.456 5.463 1123 HA THR 139 HA THR 139 19.065 0.350 6.249 1124 HB THR 139 HB THR 139 20.199 -0.498 4.134 1125 HG1 THR 139 HG1 THR 139 19.526 -2.673 3.505 1126 HG21 THR 139 HG21 THR 139 21.139 -2.487 5.282 1127 HG22 THR 139 HG22 THR 139 20.946 -1.108 6.416 1128 HG23 THR 139 HG23 THR 139 19.769 -2.464 6.443 1129 H ASP 140 H ASP 140 19.484 2.095 4.600 1130 HA ASP 140 HA ASP 140 17.187 3.355 3.805 1131 HB2 ASP 140 HB2 ASP 140 19.648 4.205 3.904 1132 HB3 ASP 140 HB3 ASP 140 19.868 3.484 2.304 1133 H GLU 141 H GLU 141 19.331 1.244 1.684 1134 HA GLU 141 HA GLU 141 18.012 1.618 -0.690 1135 HB2 GLU 141 HB2 GLU 141 19.046 -1.043 0.526 1136 HB3 GLU 141 HB3 GLU 141 18.833 -0.740 -1.204 1137 HG2 GLU 141 HG2 GLU 141 20.782 0.839 0.520 1138 HG3 GLU 141 HG3 GLU 141 21.217 -0.671 -0.290 1139 H MET 142 H MET 142 16.851 -0.244 2.188 1140 HA MET 142 HA MET 142 14.952 -1.725 0.604 1141 HB2 MET 142 HB2 MET 142 15.964 -2.678 2.672 1142 HB3 MET 142 HB3 MET 142 15.369 -1.314 3.628 1143 HG2 MET 142 HG2 MET 142 12.995 -2.052 2.981 1144 HG3 MET 142 HG3 MET 142 13.722 -3.521 2.318 1145 HE1 MET 142 HE1 MET 142 15.299 -5.235 5.465 1146 HE2 MET 142 HE2 MET 142 15.238 -5.131 3.673 1147 HE3 MET 142 HE3 MET 142 16.206 -3.942 4.609 1148 H VAL 143 H VAL 143 14.994 1.457 2.157 1149 HA VAL 143 HA VAL 143 12.075 1.441 2.159 1150 HB VAL 143 HB VAL 143 14.062 3.461 3.344 1151 HG11 VAL 143 HG11 VAL 143 12.083 4.418 4.490 1152 HG12 VAL 143 HG12 VAL 143 11.941 4.523 2.703 1153 HG13 VAL 143 HG13 VAL 143 11.023 3.270 3.604 1154 HG21 VAL 143 HG21 VAL 143 13.331 2.575 5.535 1155 HG22 VAL 143 HG22 VAL 143 12.328 1.345 4.695 1156 HG23 VAL 143 HG23 VAL 143 14.115 1.313 4.525 1157 H ALA 144 H ALA 144 10.873 3.083 1.051 1158 HA ALA 144 HA ALA 144 12.441 4.734 -0.858 1159 HB1 ALA 144 HB1 ALA 144 10.629 4.283 -2.486 1160 HB2 ALA 144 HB2 ALA 144 11.444 2.760 -1.993 1161 HB3 ALA 144 HB3 ALA 144 9.837 3.181 -1.309 1162 H MET 145 H MET 145 12.085 6.838 -0.338 1163 HA MET 145 HA MET 145 9.503 7.551 0.874 1164 HB2 MET 145 HB2 MET 145 12.250 8.845 1.058 1165 HB3 MET 145 HB3 MET 145 10.762 9.590 1.657 1166 HG2 MET 145 HG2 MET 145 10.426 7.761 3.252 1167 HG3 MET 145 HG3 MET 145 11.807 6.877 2.588 1168 HE1 MET 145 HE1 MET 145 12.000 10.815 5.014 1169 HE2 MET 145 HE2 MET 145 11.933 10.957 3.224 1170 HE3 MET 145 HE3 MET 145 10.591 10.161 4.113 1171 H LEU 146 H LEU 146 8.216 9.154 -0.106 1172 HA LEU 146 HA LEU 146 9.343 10.206 -2.617 1173 HB2 LEU 146 HB2 LEU 146 6.466 9.533 -1.881 1174 HB3 LEU 146 HB3 LEU 146 6.970 10.332 -3.376 1175 HG LEU 146 HG LEU 146 6.566 8.051 -3.893 1176 HD11 LEU 146 HD11 LEU 146 8.769 7.243 -4.674 1177 HD12 LEU 146 HD12 LEU 146 8.535 8.995 -4.991 1178 HD13 LEU 146 HD13 LEU 146 9.577 8.460 -3.629 1179 HD21 LEU 146 HD21 LEU 146 7.686 6.162 -2.759 1180 HD22 LEU 146 HD22 LEU 146 8.427 7.311 -1.594 1181 HD23 LEU 146 HD23 LEU 146 6.643 7.106 -1.642 1182 HA PRO 147 HA PRO 147 8.808 14.069 -0.323 1183 HB2 PRO 147 HB2 PRO 147 10.189 15.605 -2.201 1184 HB3 PRO 147 HB3 PRO 147 11.064 14.602 -1.037 1185 HG2 PRO 147 HG2 PRO 147 10.369 14.008 -3.928 1186 HG3 PRO 147 HG3 PRO 147 11.892 13.735 -3.071 1187 HD2 PRO 147 HD2 PRO 147 10.118 11.707 -3.503 1188 HD3 PRO 147 HD3 PRO 147 11.121 11.757 -2.048 1189 H ARG 148 H ARG 148 8.233 16.424 -1.243 1190 HA ARG 148 HA ARG 148 5.673 16.173 -2.249 1191 HB2 ARG 148 HB2 ARG 148 5.443 18.475 -2.060 1192 HB3 ARG 148 HB3 ARG 148 6.566 18.010 -0.775 1193 HG2 ARG 148 HG2 ARG 148 7.363 19.225 -3.462 1194 HG3 ARG 148 HG3 ARG 148 7.229 20.108 -1.936 1195 HD2 ARG 148 HD2 ARG 148 9.039 17.670 -2.215 1196 HD3 ARG 148 HD3 ARG 148 9.584 19.285 -2.689 1197 HE ARG 148 HE ARG 148 8.490 19.044 0.044 1198 HH11 ARG 148 HH11 ARG 148 11.339 19.122 -2.022 1199 HH12 ARG 148 HH12 ARG 148 12.419 19.513 -0.725 1200 HH21 ARG 148 HH21 ARG 148 9.926 19.566 1.734 1201 HH22 ARG 148 HH22 ARG 148 11.615 19.765 1.409 1202 H GLN 149 H GLN 149 6.476 14.736 -4.144 1203 HA GLN 149 HA GLN 149 6.922 16.365 -6.514 1204 HB2 GLN 149 HB2 GLN 149 8.608 14.618 -5.841 1205 HB3 GLN 149 HB3 GLN 149 7.397 13.418 -6.311 1206 HG2 GLN 149 HG2 GLN 149 7.298 14.823 -8.561 1207 HG3 GLN 149 HG3 GLN 149 8.879 15.415 -8.034 1208 HE21 GLN 149 HE21 GLN 149 9.610 12.876 -6.648 1209 HE22 GLN 149 HE22 GLN 149 9.980 11.741 -7.903 1210 H GLU 150 H GLU 150 4.201 15.922 -5.137 1211 HA GLU 150 HA GLU 150 2.886 13.819 -6.483 1212 HB2 GLU 150 HB2 GLU 150 0.850 14.948 -5.623 1213 HB3 GLU 150 HB3 GLU 150 2.102 15.036 -4.377 1214 HG2 GLU 150 HG2 GLU 150 1.269 17.186 -4.262 1215 HG3 GLU 150 HG3 GLU 150 2.583 17.433 -5.420 1216 H GLU 151 H GLU 151 1.621 13.760 -8.306 1217 HA GLU 151 HA GLU 151 1.263 16.092 -9.980 1218 HB2 GLU 151 HB2 GLU 151 3.589 15.381 -10.520 1219 HB3 GLU 151 HB3 GLU 151 3.067 13.699 -10.683 1220 HG2 GLU 151 HG2 GLU 151 1.740 14.282 -12.690 1221 HG3 GLU 151 HG3 GLU 151 2.191 15.983 -12.514 1222 H CYS 152 H CYS 152 1.254 12.411 -10.002 1223 HA CYS 152 HA CYS 152 -1.206 12.653 -11.651 1224 HB2 CYS 152 HB2 CYS 152 0.651 11.067 -12.390 1225 HB3 CYS 152 HB3 CYS 152 0.615 10.275 -10.809 1226 H THR 153 H THR 153 -3.164 12.111 -10.674 1227 HA THR 153 HA THR 153 -3.088 10.939 -7.988 1228 HB THR 153 HB THR 153 -5.353 12.508 -7.930 1229 HG1 THR 153 HG1 THR 153 -4.682 14.616 -8.761 1230 HG21 THR 153 HG21 THR 153 -4.037 14.072 -6.520 1231 HG22 THR 153 HG22 THR 153 -3.626 12.358 -6.174 1232 HG23 THR 153 HG23 THR 153 -2.517 13.365 -7.165 1233 H VAL 154 H VAL 154 -4.742 9.441 -7.485 1234 HA VAL 154 HA VAL 154 -6.150 8.437 -9.806 1235 HB VAL 154 HB VAL 154 -4.936 6.894 -8.284 1236 HG11 VAL 154 HG11 VAL 154 -5.846 6.389 -6.041 1237 HG12 VAL 154 HG12 VAL 154 -5.247 8.078 -6.167 1238 HG13 VAL 154 HG13 VAL 154 -7.011 7.745 -6.217 1239 HG21 VAL 154 HG21 VAL 154 -6.750 5.234 -8.013 1240 HG22 VAL 154 HG22 VAL 154 -7.964 6.525 -8.304 1241 HG23 VAL 154 HG23 VAL 154 -6.819 6.060 -9.607 1242 H ASP 155 H ASP 155 -8.396 8.420 -10.064 1243 HA ASP 155 HA ASP 155 -9.857 10.422 -8.739 1244 HB2 ASP 155 HB2 ASP 155 -10.411 9.912 -11.009 1245 HB3 ASP 155 HB3 ASP 155 -10.590 8.185 -10.669 1246 H GLU 156 H GLU 156 -11.937 10.158 -7.568 1247 HA GLU 156 HA GLU 156 -11.767 7.857 -5.743 1248 HB2 GLU 156 HB2 GLU 156 -13.299 9.499 -4.360 1249 HB3 GLU 156 HB3 GLU 156 -11.542 9.695 -4.367 1250 HG2 GLU 156 HG2 GLU 156 -11.745 11.453 -6.122 1251 HG3 GLU 156 HG3 GLU 156 -13.503 11.257 -6.114 1252 H VAL 157 H VAL 157 -14.154 9.997 -7.509 1253 HA VAL 157 HA VAL 157 -15.695 7.888 -8.393 1254 HB VAL 157 HB VAL 157 -16.275 7.412 -6.082 1255 HG11 VAL 157 HG11 VAL 157 -17.504 9.032 -4.681 1256 HG12 VAL 157 HG12 VAL 157 -15.843 9.592 -5.072 1257 HG13 VAL 157 HG13 VAL 157 -17.254 10.294 -5.934 1258 HG21 VAL 157 HG21 VAL 157 -18.739 7.594 -6.237 1259 HG22 VAL 157 HG22 VAL 157 -18.558 8.765 -7.586 1260 HG23 VAL 157 HG23 VAL 157 -17.997 7.071 -7.787 1261 HN1 EB4 158 HN1 EB4 158 3.909 -5.847 -6.714 1262 H8 EB4 158 H8 EB4 158 -2.026 -7.340 -3.929 1263 HN2 EB4 158 HN2 EB4 158 1.304 -5.661 -8.172 1264 H9 EB4 158 H9 EB4 158 1.144 -0.113 -2.428 1265 H10 EB4 158 H10 EB4 158 4.847 -7.301 -1.022 1266 HN3 EB4 158 HN3 EB4 158 3.423 -2.715 -7.182 1267 H7 EB4 158 H7 EB4 158 3.042 -5.590 -0.933 1268 H11 EB4 158 H11 EB4 158 -3.297 -8.230 -5.850 1269 H12 EB4 158 H12 EB4 158 2.228 1.841 -3.486 1270 H15 EB4 158 H15 EB4 158 3.518 1.558 -5.581 1271 H14 EB4 158 H14 EB4 158 -2.621 -7.640 -8.171 1272 H13 EB4 158 H13 EB4 158 5.928 -7.802 -3.202 1273 H22 EB4 158 H22 EB4 158 4.819 -6.562 -7.104 1274 H30 EB4 158 H30 EB4 158 6.040 -3.221 -9.802 1275 H30A EB4 158 H30A EB4 158 6.300 -2.620 -8.089 1276 H24 EB4 158 H24 EB4 158 3.943 -1.964 -7.999 1277 H28 EB4 158 H28 EB4 158 3.992 -8.450 -8.627 1278 H28A EB4 158 H28A EB4 158 4.726 -7.491 -10.010 1279 H23 EB4 158 H23 EB4 158 0.902 -5.600 -9.340 1280 H29 EB4 158 H29 EB4 158 0.507 -3.533 -10.432 1281 H29A EB4 158 H29A EB4 158 1.987 -3.878 -11.540 Start of MODEL 10 1 H1 MET 1 H1 MET 1 -28.898 3.305 -4.357 2 H2 MET 1 H2 MET 1 -27.934 3.977 -3.224 3 H3 MET 1 H3 MET 1 -28.733 4.928 -4.283 4 HA MET 1 HA MET 1 -26.648 2.988 -4.987 5 HB2 MET 1 HB2 MET 1 -28.167 5.045 -6.649 6 HB3 MET 1 HB3 MET 1 -26.687 4.246 -7.196 7 HG2 MET 1 HG2 MET 1 -27.805 2.030 -6.980 8 HG3 MET 1 HG3 MET 1 -29.285 2.830 -6.437 9 HE1 MET 1 HE1 MET 1 -30.441 1.779 -9.994 10 HE2 MET 1 HE2 MET 1 -29.495 0.844 -8.787 11 HE3 MET 1 HE3 MET 1 -30.858 1.882 -8.250 12 H THR 2 H THR 2 -24.589 3.663 -4.463 13 HA THR 2 HA THR 2 -22.929 4.954 -3.782 14 HB THR 2 HB THR 2 -24.075 7.160 -5.546 15 HG1 THR 2 HG1 THR 2 -22.954 6.028 -7.300 16 HG21 THR 2 HG21 THR 2 -21.673 7.584 -5.997 17 HG22 THR 2 HG22 THR 2 -22.041 7.680 -4.241 18 HG23 THR 2 HG23 THR 2 -21.232 6.223 -4.911 19 H VAL 3 H VAL 3 -24.636 4.921 -1.740 20 HA VAL 3 HA VAL 3 -25.194 7.721 -1.071 21 HB VAL 3 HB VAL 3 -26.612 6.743 0.758 22 HG11 VAL 3 HG11 VAL 3 -28.455 6.024 -0.729 23 HG12 VAL 3 HG12 VAL 3 -27.603 7.472 -1.365 24 HG13 VAL 3 HG13 VAL 3 -27.288 5.857 -2.084 25 HG21 VAL 3 HG21 VAL 3 -27.246 4.359 0.628 26 HG22 VAL 3 HG22 VAL 3 -26.026 4.110 -0.666 27 HG23 VAL 3 HG23 VAL 3 -25.500 4.573 0.988 28 HA PRO 4 HA PRO 4 -21.821 7.550 1.852 29 HB2 PRO 4 HB2 PRO 4 -22.697 9.531 3.618 30 HB3 PRO 4 HB3 PRO 4 -22.079 9.951 2.014 31 HG2 PRO 4 HG2 PRO 4 -24.953 9.651 2.935 32 HG3 PRO 4 HG3 PRO 4 -24.235 10.911 1.922 33 HD2 PRO 4 HD2 PRO 4 -25.647 8.852 0.829 34 HD3 PRO 4 HD3 PRO 4 -24.264 9.563 -0.015 35 H ASP 5 H ASP 5 -23.334 5.325 2.223 36 HA ASP 5 HA ASP 5 -24.193 5.363 5.020 37 HB2 ASP 5 HB2 ASP 5 -24.745 3.744 2.603 38 HB3 ASP 5 HB3 ASP 5 -24.438 2.764 4.043 39 H ARG 6 H ARG 6 -22.259 3.060 2.956 40 HA ARG 6 HA ARG 6 -20.614 2.481 5.264 41 HB2 ARG 6 HB2 ARG 6 -21.216 1.107 2.679 42 HB3 ARG 6 HB3 ARG 6 -19.645 0.807 3.434 43 HG2 ARG 6 HG2 ARG 6 -21.194 -0.891 4.196 44 HG3 ARG 6 HG3 ARG 6 -20.815 0.166 5.563 45 HD2 ARG 6 HD2 ARG 6 -23.144 -0.050 5.726 46 HD3 ARG 6 HD3 ARG 6 -22.966 1.492 4.878 47 HE ARG 6 HE ARG 6 -23.418 0.220 2.755 48 HH11 ARG 6 HH11 ARG 6 -24.395 -1.153 5.837 49 HH12 ARG 6 HH12 ARG 6 -25.656 -2.120 5.149 50 HH21 ARG 6 HH21 ARG 6 -25.081 -1.056 1.862 51 HH22 ARG 6 HH22 ARG 6 -26.047 -2.065 2.887 52 H SER 7 H SER 7 -20.476 4.481 2.424 53 HA SER 7 HA SER 7 -17.875 4.334 1.612 54 HB2 SER 7 HB2 SER 7 -18.993 7.098 1.992 55 HB3 SER 7 HB3 SER 7 -18.410 6.319 0.515 56 HG SER 7 HG SER 7 -20.614 6.481 0.234 57 H GLU 8 H GLU 8 -19.140 5.996 4.573 58 HA GLU 8 HA GLU 8 -16.841 7.441 5.169 59 HB2 GLU 8 HB2 GLU 8 -18.857 6.267 7.115 60 HB3 GLU 8 HB3 GLU 8 -17.723 7.586 7.433 61 HG2 GLU 8 HG2 GLU 8 -18.876 8.787 5.411 62 HG3 GLU 8 HG3 GLU 8 -20.154 7.581 5.605 63 H ILE 9 H ILE 9 -17.383 3.965 5.328 64 HA ILE 9 HA ILE 9 -15.268 3.594 7.249 65 HB ILE 9 HB ILE 9 -16.702 1.423 5.665 66 HG12 ILE 9 HG12 ILE 9 -17.585 2.583 8.348 67 HG13 ILE 9 HG13 ILE 9 -18.281 3.102 6.807 68 HG21 ILE 9 HG21 ILE 9 -16.200 0.079 7.678 69 HG22 ILE 9 HG22 ILE 9 -14.708 0.749 6.935 70 HG23 ILE 9 HG23 ILE 9 -15.386 1.498 8.420 71 HD11 ILE 9 HD11 ILE 9 -19.681 1.390 7.877 72 HD12 ILE 9 HD12 ILE 9 -19.000 0.777 6.332 73 HD13 ILE 9 HD13 ILE 9 -18.293 0.250 7.897 74 H ALA 10 H ALA 10 -15.229 4.325 3.943 75 HA ALA 10 HA ALA 10 -12.608 3.058 3.677 76 HB1 ALA 10 HB1 ALA 10 -13.215 2.212 1.418 77 HB2 ALA 10 HB2 ALA 10 -14.192 1.428 2.705 78 HB3 ALA 10 HB3 ALA 10 -14.915 2.722 1.691 79 H GLY 11 H GLY 11 -11.920 3.770 1.112 80 HA2 GLY 11 HA2 GLY 11 -12.738 6.069 -0.016 81 HA3 GLY 11 HA3 GLY 11 -11.824 6.651 1.381 82 H LYS 12 H LYS 12 -10.168 7.606 0.075 83 HA LYS 12 HA LYS 12 -8.514 5.670 -1.415 84 HB2 LYS 12 HB2 LYS 12 -7.694 7.669 -2.647 85 HB3 LYS 12 HB3 LYS 12 -9.432 7.416 -2.853 86 HG2 LYS 12 HG2 LYS 12 -9.860 9.168 -1.091 87 HG3 LYS 12 HG3 LYS 12 -8.118 9.455 -0.990 88 HD2 LYS 12 HD2 LYS 12 -8.023 10.180 -3.317 89 HD3 LYS 12 HD3 LYS 12 -9.691 9.669 -3.604 90 HE2 LYS 12 HE2 LYS 12 -9.794 12.035 -3.306 91 HE3 LYS 12 HE3 LYS 12 -10.413 11.341 -1.801 92 HZ1 LYS 12 HZ1 LYS 12 -8.798 13.158 -1.512 93 HZ2 LYS 12 HZ2 LYS 12 -8.348 11.783 -0.753 94 HZ3 LYS 12 HZ3 LYS 12 -7.621 12.221 -2.148 95 H TRP 13 H TRP 13 -6.241 5.663 -1.047 96 HA TRP 13 HA TRP 13 -5.319 7.336 1.202 97 HB2 TRP 13 HB2 TRP 13 -4.522 4.431 0.739 98 HB3 TRP 13 HB3 TRP 13 -4.140 5.456 2.128 99 HD1 TRP 13 HD1 TRP 13 -6.415 2.744 1.202 100 HE1 TRP 13 HE1 TRP 13 -8.455 2.622 2.787 101 HE3 TRP 13 HE3 TRP 13 -5.979 7.354 3.431 102 HZ2 TRP 13 HZ2 TRP 13 -9.720 4.244 4.709 103 HZ3 TRP 13 HZ3 TRP 13 -7.658 8.005 5.141 104 HH2 TRP 13 HH2 TRP 13 -9.494 6.469 5.773 105 H TYR 14 H TYR 14 -3.149 8.104 0.950 106 HA TYR 14 HA TYR 14 -2.017 7.561 -1.719 107 HB2 TYR 14 HB2 TYR 14 -1.530 9.891 0.198 108 HB3 TYR 14 HB3 TYR 14 -0.860 9.714 -1.430 109 HD1 TYR 14 HD1 TYR 14 -4.177 9.826 0.361 110 HD2 TYR 14 HD2 TYR 14 -2.012 10.661 -3.253 111 HE1 TYR 14 HE1 TYR 14 -6.182 10.927 -0.579 112 HE2 TYR 14 HE2 TYR 14 -4.019 11.758 -4.201 113 HH TYR 14 HH TYR 14 -6.341 11.902 -3.962 114 H VAL 15 H VAL 15 -0.163 6.277 -1.858 115 HA VAL 15 HA VAL 15 1.159 5.759 0.731 116 HB VAL 15 HB VAL 15 0.496 3.876 -0.738 117 HG11 VAL 15 HG11 VAL 15 1.656 3.413 -2.879 118 HG12 VAL 15 HG12 VAL 15 0.632 4.887 -2.942 119 HG13 VAL 15 HG13 VAL 15 2.416 5.039 -2.800 120 HG21 VAL 15 HG21 VAL 15 2.680 2.693 -0.813 121 HG22 VAL 15 HG22 VAL 15 3.515 4.259 -0.538 122 HG23 VAL 15 HG23 VAL 15 2.427 3.588 0.723 123 H VAL 16 H VAL 16 2.728 7.045 1.333 124 HA VAL 16 HA VAL 16 4.409 8.302 -0.721 125 HB VAL 16 HB VAL 16 4.894 10.081 0.926 126 HG11 VAL 16 HG11 VAL 16 2.701 11.217 0.834 127 HG12 VAL 16 HG12 VAL 16 3.115 10.418 -0.720 128 HG13 VAL 16 HG13 VAL 16 1.921 9.662 0.388 129 HG21 VAL 16 HG21 VAL 16 3.514 10.302 2.966 130 HG22 VAL 16 HG22 VAL 16 2.781 8.696 2.636 131 HG23 VAL 16 HG23 VAL 16 4.536 8.825 2.996 132 H ALA 17 H ALA 17 4.365 5.683 1.272 133 HA ALA 17 HA ALA 17 7.256 5.911 1.827 134 HB1 ALA 17 HB1 ALA 17 6.878 4.657 3.911 135 HB2 ALA 17 HB2 ALA 17 6.039 6.245 3.934 136 HB3 ALA 17 HB3 ALA 17 5.104 4.740 3.643 137 H LEU 18 H LEU 18 8.402 3.915 1.483 138 HA LEU 18 HA LEU 18 6.840 1.599 0.721 139 HB2 LEU 18 HB2 LEU 18 8.761 3.030 -1.186 140 HB3 LEU 18 HB3 LEU 18 8.099 1.411 -1.452 141 HG LEU 18 HG LEU 18 6.332 3.868 -1.156 142 HD11 LEU 18 HD11 LEU 18 6.217 3.922 -3.626 143 HD12 LEU 18 HD12 LEU 18 7.876 4.252 -3.023 144 HD13 LEU 18 HD13 LEU 18 7.473 2.641 -3.707 145 HD21 LEU 18 HD21 LEU 18 4.698 2.453 -2.365 146 HD22 LEU 18 HD22 LEU 18 5.890 1.110 -2.392 147 HD23 LEU 18 HD23 LEU 18 5.232 1.696 -0.827 148 H ALA 19 H ALA 19 7.999 -0.354 0.870 149 HA ALA 19 HA ALA 19 10.892 -0.249 1.340 150 HB1 ALA 19 HB1 ALA 19 10.657 -1.562 3.410 151 HB2 ALA 19 HB2 ALA 19 9.901 0.058 3.585 152 HB3 ALA 19 HB3 ALA 19 8.871 -1.391 3.329 153 H SER 20 H SER 20 11.814 -2.120 0.396 154 HA SER 20 HA SER 20 9.976 -4.361 -0.125 155 HB2 SER 20 HB2 SER 20 11.874 -3.197 -2.241 156 HB3 SER 20 HB3 SER 20 10.646 -4.450 -2.467 157 HG SER 20 HG SER 20 10.293 -1.914 -2.944 158 H ASN 21 H ASN 21 10.986 -6.413 -0.200 159 HA ASN 21 HA ASN 21 13.709 -6.338 0.908 160 HB2 ASN 21 HB2 ASN 21 11.746 -7.554 2.076 161 HB3 ASN 21 HB3 ASN 21 11.739 -8.695 0.725 162 HD21 ASN 21 HD21 ASN 21 13.706 -9.983 0.341 163 HD22 ASN 21 HD22 ASN 21 14.771 -10.343 1.658 164 H THR 22 H THR 22 13.242 -5.843 -1.928 165 HA THR 22 HA THR 22 15.037 -7.926 -2.971 166 HB THR 22 HB THR 22 13.621 -7.601 -5.134 167 HG1 THR 22 HG1 THR 22 11.508 -7.045 -4.552 168 HG21 THR 22 HG21 THR 22 12.467 -9.676 -4.542 169 HG22 THR 22 HG22 THR 22 14.181 -9.733 -4.010 170 HG23 THR 22 HG23 THR 22 12.878 -9.438 -2.810 171 H GLU 23 H GLU 23 16.948 -7.214 -4.002 172 HA GLU 23 HA GLU 23 17.559 -4.537 -4.053 173 HB2 GLU 23 HB2 GLU 23 18.349 -6.226 -6.437 174 HB3 GLU 23 HB3 GLU 23 19.346 -5.151 -5.448 175 HG2 GLU 23 HG2 GLU 23 18.410 -7.967 -4.748 176 HG3 GLU 23 HG3 GLU 23 20.059 -7.441 -5.110 177 H PHE 24 H PHE 24 15.995 -6.452 -6.771 178 HA PHE 24 HA PHE 24 15.894 -4.433 -8.635 179 HB2 PHE 24 HB2 PHE 24 13.856 -6.649 -8.018 180 HB3 PHE 24 HB3 PHE 24 13.873 -5.701 -9.512 181 HD1 PHE 24 HD1 PHE 24 15.820 -5.896 -11.084 182 HD2 PHE 24 HD2 PHE 24 15.339 -8.492 -7.698 183 HE1 PHE 24 HE1 PHE 24 17.416 -7.499 -12.090 184 HE2 PHE 24 HE2 PHE 24 16.938 -10.096 -8.697 185 HZ PHE 24 HZ PHE 24 17.977 -9.605 -10.898 186 H PHE 25 H PHE 25 13.247 -5.283 -6.212 187 HA PHE 25 HA PHE 25 11.495 -3.291 -6.974 188 HB2 PHE 25 HB2 PHE 25 12.046 -4.736 -4.366 189 HB3 PHE 25 HB3 PHE 25 10.845 -3.439 -4.428 190 HD1 PHE 25 HD1 PHE 25 11.787 -6.472 -6.469 191 HD2 PHE 25 HD2 PHE 25 8.658 -4.084 -4.751 192 HE1 PHE 25 HE1 PHE 25 10.101 -8.069 -7.327 193 HE2 PHE 25 HE2 PHE 25 6.969 -5.679 -5.606 194 HZ PHE 25 HZ PHE 25 7.687 -7.678 -6.894 195 H LEU 26 H LEU 26 14.167 -3.115 -4.485 196 HA LEU 26 HA LEU 26 13.615 -0.483 -3.691 197 HB2 LEU 26 HB2 LEU 26 16.302 -1.926 -3.818 198 HB3 LEU 26 HB3 LEU 26 15.911 -0.515 -2.826 199 HG LEU 26 HG LEU 26 14.750 -3.316 -2.526 200 HD11 LEU 26 HD11 LEU 26 15.965 -3.307 -0.376 201 HD12 LEU 26 HD12 LEU 26 17.074 -3.131 -1.778 202 HD13 LEU 26 HD13 LEU 26 16.656 -1.699 -0.778 203 HD21 LEU 26 HD21 LEU 26 13.664 -2.432 -0.489 204 HD22 LEU 26 HD22 LEU 26 14.249 -0.784 -0.898 205 HD23 LEU 26 HD23 LEU 26 13.074 -1.614 -1.974 206 H ARG 27 H ARG 27 15.809 -1.837 -6.261 207 HA ARG 27 HA ARG 27 16.983 0.570 -7.012 208 HB2 ARG 27 HB2 ARG 27 17.493 -1.901 -7.694 209 HB3 ARG 27 HB3 ARG 27 16.275 -1.659 -8.953 210 HG2 ARG 27 HG2 ARG 27 17.687 0.507 -9.529 211 HG3 ARG 27 HG3 ARG 27 18.968 -0.305 -8.620 212 HD2 ARG 27 HD2 ARG 27 19.359 -1.036 -10.818 213 HD3 ARG 27 HD3 ARG 27 18.451 -2.384 -10.120 214 HE ARG 27 HE ARG 27 16.429 -0.983 -11.191 215 HH11 ARG 27 HH11 ARG 27 19.579 -1.745 -12.565 216 HH12 ARG 27 HH12 ARG 27 18.999 -1.721 -14.197 217 HH21 ARG 27 HH21 ARG 27 15.694 -0.944 -13.313 218 HH22 ARG 27 HH22 ARG 27 16.781 -1.264 -14.623 219 H GLU 28 H GLU 28 13.970 -1.088 -8.260 220 HA GLU 28 HA GLU 28 13.459 0.983 -10.136 221 HB2 GLU 28 HB2 GLU 28 11.652 -1.200 -8.997 222 HB3 GLU 28 HB3 GLU 28 11.258 -0.166 -10.376 223 HG2 GLU 28 HG2 GLU 28 13.445 -2.279 -10.188 224 HG3 GLU 28 HG3 GLU 28 12.022 -2.277 -11.239 225 H LYS 29 H LYS 29 11.798 0.079 -6.974 226 HA LYS 29 HA LYS 29 10.019 2.166 -7.029 227 HB2 LYS 29 HB2 LYS 29 11.201 0.428 -4.893 228 HB3 LYS 29 HB3 LYS 29 10.369 1.896 -4.366 229 HG2 LYS 29 HG2 LYS 29 9.109 -0.155 -6.249 230 HG3 LYS 29 HG3 LYS 29 8.945 -0.222 -4.490 231 HD2 LYS 29 HD2 LYS 29 6.997 0.930 -5.229 232 HD3 LYS 29 HD3 LYS 29 8.056 2.201 -4.606 233 HE2 LYS 29 HE2 LYS 29 7.480 3.178 -6.617 234 HE3 LYS 29 HE3 LYS 29 8.907 2.280 -7.152 235 HZ1 LYS 29 HZ1 LYS 29 6.784 2.047 -8.482 236 HZ2 LYS 29 HZ2 LYS 29 7.577 0.666 -8.123 237 HZ3 LYS 29 HZ3 LYS 29 6.233 1.075 -7.292 238 H ASP 30 H ASP 30 13.362 2.220 -5.504 239 HA ASP 30 HA ASP 30 13.144 4.772 -4.449 240 HB2 ASP 30 HB2 ASP 30 15.035 3.372 -3.901 241 HB3 ASP 30 HB3 ASP 30 15.517 3.230 -5.597 242 H LYS 31 H LYS 31 13.828 3.688 -7.839 243 HA LYS 31 HA LYS 31 14.451 6.369 -8.621 244 HB2 LYS 31 HB2 LYS 31 14.400 3.677 -9.928 245 HB3 LYS 31 HB3 LYS 31 14.126 5.073 -10.978 246 HG2 LYS 31 HG2 LYS 31 16.543 4.606 -9.162 247 HG3 LYS 31 HG3 LYS 31 16.512 4.496 -10.927 248 HD2 LYS 31 HD2 LYS 31 17.441 6.652 -10.414 249 HD3 LYS 31 HD3 LYS 31 15.795 6.953 -10.985 250 HE2 LYS 31 HE2 LYS 31 15.776 6.501 -8.096 251 HE3 LYS 31 HE3 LYS 31 16.964 7.748 -8.500 252 HZ1 LYS 31 HZ1 LYS 31 14.503 8.368 -8.145 253 HZ2 LYS 31 HZ2 LYS 31 15.342 9.103 -9.337 254 HZ3 LYS 31 HZ3 LYS 31 14.301 7.897 -9.695 255 H MET 32 H MET 32 11.279 4.514 -8.265 256 HA MET 32 HA MET 32 10.437 6.277 -10.490 257 HB2 MET 32 HB2 MET 32 9.005 4.380 -8.311 258 HB3 MET 32 HB3 MET 32 8.161 4.951 -9.756 259 HG2 MET 32 HG2 MET 32 10.638 3.151 -9.910 260 HG3 MET 32 HG3 MET 32 8.999 2.500 -9.774 261 HE1 MET 32 HE1 MET 32 10.322 2.146 -13.612 262 HE2 MET 32 HE2 MET 32 11.398 2.301 -12.182 263 HE3 MET 32 HE3 MET 32 9.962 1.226 -12.113 264 H LYS 33 H LYS 33 7.626 6.233 -8.626 265 HA LYS 33 HA LYS 33 8.395 8.665 -7.102 266 HB2 LYS 33 HB2 LYS 33 6.181 8.734 -9.230 267 HB3 LYS 33 HB3 LYS 33 6.475 9.993 -8.023 268 HG2 LYS 33 HG2 LYS 33 8.712 10.433 -9.004 269 HG3 LYS 33 HG3 LYS 33 8.458 9.146 -10.190 270 HD2 LYS 33 HD2 LYS 33 6.429 10.382 -11.050 271 HD3 LYS 33 HD3 LYS 33 6.767 11.688 -9.907 272 HE2 LYS 33 HE2 LYS 33 9.040 11.983 -10.950 273 HE3 LYS 33 HE3 LYS 33 8.650 10.715 -12.120 274 HZ1 LYS 33 HZ1 LYS 33 8.238 12.896 -13.011 275 HZ2 LYS 33 HZ2 LYS 33 6.825 12.086 -12.897 276 HZ3 LYS 33 HZ3 LYS 33 7.185 13.257 -11.817 277 H MET 34 H MET 34 5.910 9.451 -6.126 278 HA MET 34 HA MET 34 5.326 7.283 -4.372 279 HB2 MET 34 HB2 MET 34 5.083 9.606 -3.635 280 HB3 MET 34 HB3 MET 34 4.084 10.020 -5.034 281 HG2 MET 34 HG2 MET 34 2.333 8.370 -4.087 282 HG3 MET 34 HG3 MET 34 3.302 8.350 -2.607 283 HE1 MET 34 HE1 MET 34 1.046 12.023 -4.321 284 HE2 MET 34 HE2 MET 34 2.640 11.572 -5.015 285 HE3 MET 34 HE3 MET 34 1.259 10.428 -5.120 286 H ALA 35 H ALA 35 3.326 6.115 -4.175 287 HA ALA 35 HA ALA 35 1.894 5.793 -6.704 288 HB1 ALA 35 HB1 ALA 35 1.402 3.501 -5.943 289 HB2 ALA 35 HB2 ALA 35 3.162 3.818 -6.114 290 HB3 ALA 35 HB3 ALA 35 2.409 3.786 -4.483 291 H MET 36 H MET 36 -0.388 4.594 -6.149 292 HA MET 36 HA MET 36 -1.628 6.201 -4.014 293 HB2 MET 36 HB2 MET 36 -2.650 5.565 -6.844 294 HB3 MET 36 HB3 MET 36 -3.638 6.307 -5.580 295 HG2 MET 36 HG2 MET 36 -1.030 7.641 -6.234 296 HG3 MET 36 HG3 MET 36 -2.307 7.723 -7.455 297 HE1 MET 36 HE1 MET 36 -1.951 11.095 -5.150 298 HE2 MET 36 HE2 MET 36 -0.788 9.947 -5.894 299 HE3 MET 36 HE3 MET 36 -2.098 10.669 -6.888 300 H ALA 37 H ALA 37 -3.858 5.273 -3.366 301 HA ALA 37 HA ALA 37 -4.370 2.506 -4.061 302 HB1 ALA 37 HB1 ALA 37 -4.044 1.710 -1.706 303 HB2 ALA 37 HB2 ALA 37 -2.494 2.290 -2.403 304 HB3 ALA 37 HB3 ALA 37 -3.402 3.324 -1.249 305 H ARG 38 H ARG 38 -6.510 2.308 -4.102 306 HA ARG 38 HA ARG 38 -8.152 3.803 -2.135 307 HB2 ARG 38 HB2 ARG 38 -8.395 5.064 -4.147 308 HB3 ARG 38 HB3 ARG 38 -8.473 3.611 -5.152 309 HG2 ARG 38 HG2 ARG 38 -10.648 3.021 -3.883 310 HG3 ARG 38 HG3 ARG 38 -10.591 4.661 -3.223 311 HD2 ARG 38 HD2 ARG 38 -10.666 5.642 -5.459 312 HD3 ARG 38 HD3 ARG 38 -10.475 4.057 -6.219 313 HE ARG 38 HE ARG 38 -12.765 3.774 -4.700 314 HH11 ARG 38 HH11 ARG 38 -11.725 6.082 -7.147 315 HH12 ARG 38 HH12 ARG 38 -13.331 6.374 -7.726 316 HH21 ARG 38 HH21 ARG 38 -14.863 4.170 -5.465 317 HH22 ARG 38 HH22 ARG 38 -15.119 5.284 -6.767 318 H ILE 39 H ILE 39 -9.633 2.367 -1.143 319 HA ILE 39 HA ILE 39 -9.702 -0.303 -2.313 320 HB ILE 39 HB ILE 39 -10.269 0.386 0.604 321 HG12 ILE 39 HG12 ILE 39 -8.012 1.127 0.165 322 HG13 ILE 39 HG13 ILE 39 -7.979 -0.357 1.127 323 HG21 ILE 39 HG21 ILE 39 -9.782 -2.018 0.956 324 HG22 ILE 39 HG22 ILE 39 -11.150 -1.767 -0.180 325 HG23 ILE 39 HG23 ILE 39 -9.531 -2.219 -0.811 326 HD11 ILE 39 HD11 ILE 39 -6.238 -0.384 -0.601 327 HD12 ILE 39 HD12 ILE 39 -7.449 -1.676 -0.902 328 HD13 ILE 39 HD13 ILE 39 -7.482 -0.169 -1.879 329 H SER 40 H SER 40 -11.705 -1.493 -2.375 330 HA SER 40 HA SER 40 -14.106 0.101 -1.736 331 HB2 SER 40 HB2 SER 40 -13.900 -1.792 -4.113 332 HB3 SER 40 HB3 SER 40 -15.085 -0.512 -3.818 333 HG SER 40 HG SER 40 -13.490 0.106 -5.410 334 H PHE 41 H PHE 41 -15.607 -1.040 -0.452 335 HA PHE 41 HA PHE 41 -14.898 -3.732 0.319 336 HB2 PHE 41 HB2 PHE 41 -17.102 -3.529 1.599 337 HB3 PHE 41 HB3 PHE 41 -15.789 -2.438 2.059 338 HD1 PHE 41 HD1 PHE 41 -19.114 -2.676 0.465 339 HD2 PHE 41 HD2 PHE 41 -15.963 -0.034 1.702 340 HE1 PHE 41 HE1 PHE 41 -20.635 -0.741 0.199 341 HE2 PHE 41 HE2 PHE 41 -17.479 1.904 1.440 342 HZ PHE 41 HZ PHE 41 -19.821 1.556 0.685 343 H LEU 42 H LEU 42 -15.187 -5.341 -1.191 344 HA LEU 42 HA LEU 42 -17.222 -5.179 -3.182 345 HB2 LEU 42 HB2 LEU 42 -14.876 -6.386 -3.157 346 HB3 LEU 42 HB3 LEU 42 -15.759 -7.707 -2.380 347 HG LEU 42 HG LEU 42 -15.554 -8.121 -4.755 348 HD11 LEU 42 HD11 LEU 42 -17.929 -8.430 -5.361 349 HD12 LEU 42 HD12 LEU 42 -17.594 -8.911 -3.663 350 HD13 LEU 42 HD13 LEU 42 -18.408 -7.347 -4.010 351 HD21 LEU 42 HD21 LEU 42 -16.619 -6.650 -6.438 352 HD22 LEU 42 HD22 LEU 42 -17.023 -5.473 -5.142 353 HD23 LEU 42 HD23 LEU 42 -15.306 -5.813 -5.543 354 H GLY 43 H GLY 43 -16.743 -7.181 -0.183 355 HA2 GLY 43 HA2 GLY 43 -19.612 -7.385 0.113 356 HA3 GLY 43 HA3 GLY 43 -18.793 -8.896 -0.303 357 H GLU 44 H GLU 44 -20.029 -8.933 2.121 358 HA GLU 44 HA GLU 44 -18.685 -7.877 4.294 359 HB2 GLU 44 HB2 GLU 44 -20.011 -10.623 4.180 360 HB3 GLU 44 HB3 GLU 44 -19.823 -9.574 5.591 361 HG2 GLU 44 HG2 GLU 44 -21.282 -7.854 4.417 362 HG3 GLU 44 HG3 GLU 44 -21.565 -9.043 3.138 363 H ASP 45 H ASP 45 -17.742 -10.621 2.186 364 HA ASP 45 HA ASP 45 -15.431 -11.038 3.976 365 HB2 ASP 45 HB2 ASP 45 -16.931 -12.978 4.060 366 HB3 ASP 45 HB3 ASP 45 -17.053 -13.022 2.296 367 H GLU 46 H GLU 46 -16.284 -9.632 1.014 368 HA GLU 46 HA GLU 46 -13.617 -10.312 -0.034 369 HB2 GLU 46 HB2 GLU 46 -15.540 -11.394 -1.310 370 HB3 GLU 46 HB3 GLU 46 -16.062 -9.766 -1.764 371 HG2 GLU 46 HG2 GLU 46 -13.886 -9.347 -2.863 372 HG3 GLU 46 HG3 GLU 46 -13.303 -10.938 -2.358 373 H LEU 47 H LEU 47 -12.537 -8.614 -1.255 374 HA LEU 47 HA LEU 47 -13.690 -5.976 -0.954 375 HB2 LEU 47 HB2 LEU 47 -11.685 -5.049 0.060 376 HB3 LEU 47 HB3 LEU 47 -12.446 -6.259 1.102 377 HG LEU 47 HG LEU 47 -10.146 -7.029 -0.713 378 HD11 LEU 47 HD11 LEU 47 -8.599 -6.544 1.151 379 HD12 LEU 47 HD12 LEU 47 -9.393 -5.055 0.536 380 HD13 LEU 47 HD13 LEU 47 -9.948 -5.800 2.073 381 HD21 LEU 47 HD21 LEU 47 -9.773 -8.711 1.060 382 HD22 LEU 47 HD22 LEU 47 -11.167 -8.048 1.978 383 HD23 LEU 47 HD23 LEU 47 -11.430 -8.817 0.376 384 H LYS 48 H LYS 48 -12.775 -4.365 -2.339 385 HA LYS 48 HA LYS 48 -11.109 -5.473 -4.505 386 HB2 LYS 48 HB2 LYS 48 -13.674 -4.739 -4.781 387 HB3 LYS 48 HB3 LYS 48 -12.936 -3.137 -4.913 388 HG2 LYS 48 HG2 LYS 48 -11.557 -3.870 -6.808 389 HG3 LYS 48 HG3 LYS 48 -12.119 -5.537 -6.624 390 HD2 LYS 48 HD2 LYS 48 -14.502 -4.697 -6.990 391 HD3 LYS 48 HD3 LYS 48 -13.830 -3.100 -7.347 392 HE2 LYS 48 HE2 LYS 48 -13.133 -5.672 -8.858 393 HE3 LYS 48 HE3 LYS 48 -14.307 -4.466 -9.402 394 HZ1 LYS 48 HZ1 LYS 48 -12.551 -3.579 -10.401 395 HZ2 LYS 48 HZ2 LYS 48 -12.112 -2.992 -8.942 396 HZ3 LYS 48 HZ3 LYS 48 -11.453 -4.379 -9.496 397 H VAL 49 H VAL 49 -9.310 -4.141 -5.179 398 HA VAL 49 HA VAL 49 -9.101 -1.591 -3.742 399 HB VAL 49 HB VAL 49 -6.694 -2.016 -3.387 400 HG11 VAL 49 HG11 VAL 49 -6.904 -3.739 -1.617 401 HG12 VAL 49 HG12 VAL 49 -8.284 -2.590 -1.601 402 HG13 VAL 49 HG13 VAL 49 -8.492 -4.233 -2.295 403 HG21 VAL 49 HG21 VAL 49 -5.745 -4.272 -3.728 404 HG22 VAL 49 HG22 VAL 49 -7.282 -4.798 -4.495 405 HG23 VAL 49 HG23 VAL 49 -6.279 -3.527 -5.272 406 H SER 50 H SER 50 -8.237 0.131 -4.968 407 HA SER 50 HA SER 50 -7.537 -0.562 -7.757 408 HB2 SER 50 HB2 SER 50 -8.118 1.956 -8.066 409 HB3 SER 50 HB3 SER 50 -9.445 0.801 -7.883 410 HG SER 50 HG SER 50 -8.705 1.599 -5.395 411 H TYR 51 H TYR 51 -5.440 -0.290 -8.326 412 HA TYR 51 HA TYR 51 -3.714 1.201 -6.489 413 HB2 TYR 51 HB2 TYR 51 -3.440 -0.961 -8.632 414 HB3 TYR 51 HB3 TYR 51 -2.035 0.054 -8.282 415 HD1 TYR 51 HD1 TYR 51 -1.950 0.340 -5.415 416 HD2 TYR 51 HD2 TYR 51 -3.141 -3.059 -7.754 417 HE1 TYR 51 HE1 TYR 51 -1.258 -1.168 -3.579 418 HE2 TYR 51 HE2 TYR 51 -2.489 -4.562 -5.905 419 HH TYR 51 HH TYR 51 -0.442 -3.978 -3.745 420 H ALA 52 H ALA 52 -2.523 3.026 -7.205 421 HA ALA 52 HA ALA 52 -2.719 3.670 -10.091 422 HB1 ALA 52 HB1 ALA 52 -3.052 6.032 -9.481 423 HB2 ALA 52 HB2 ALA 52 -4.409 5.007 -8.901 424 HB3 ALA 52 HB3 ALA 52 -3.156 5.576 -7.747 425 H VAL 53 H VAL 53 -0.594 3.597 -10.803 426 HA VAL 53 HA VAL 53 1.368 4.855 -9.041 427 HB VAL 53 HB VAL 53 3.043 3.112 -9.725 428 HG11 VAL 53 HG11 VAL 53 2.227 1.350 -8.191 429 HG12 VAL 53 HG12 VAL 53 1.946 2.998 -7.537 430 HG13 VAL 53 HG13 VAL 53 0.583 2.070 -8.249 431 HG21 VAL 53 HG21 VAL 53 2.234 0.952 -10.618 432 HG22 VAL 53 HG22 VAL 53 0.590 1.650 -10.799 433 HG23 VAL 53 HG23 VAL 53 1.955 2.305 -11.765 434 HA PRO 54 HA PRO 54 2.540 6.755 -12.913 435 HB2 PRO 54 HB2 PRO 54 4.872 7.959 -12.079 436 HB3 PRO 54 HB3 PRO 54 3.333 8.500 -11.396 437 HG2 PRO 54 HG2 PRO 54 5.406 6.646 -10.208 438 HG3 PRO 54 HG3 PRO 54 4.465 7.919 -9.420 439 HD2 PRO 54 HD2 PRO 54 3.826 5.208 -9.289 440 HD3 PRO 54 HD3 PRO 54 2.654 6.507 -9.035 441 H LYS 55 H LYS 55 2.950 5.219 -14.409 442 HA LYS 55 HA LYS 55 5.522 3.847 -14.305 443 HB2 LYS 55 HB2 LYS 55 3.426 2.507 -14.515 444 HB3 LYS 55 HB3 LYS 55 3.102 3.306 -16.059 445 HG2 LYS 55 HG2 LYS 55 5.213 2.377 -16.999 446 HG3 LYS 55 HG3 LYS 55 5.577 1.607 -15.449 447 HD2 LYS 55 HD2 LYS 55 3.596 0.188 -15.596 448 HD3 LYS 55 HD3 LYS 55 2.985 1.083 -16.993 449 HE2 LYS 55 HE2 LYS 55 3.922 -0.825 -17.987 450 HE3 LYS 55 HE3 LYS 55 5.208 0.374 -18.177 451 HZ1 LYS 55 HZ1 LYS 55 6.055 -1.709 -17.364 452 HZ2 LYS 55 HZ2 LYS 55 6.274 -0.560 -16.226 453 HZ3 LYS 55 HZ3 LYS 55 5.087 -1.667 -16.050 454 HA PRO 56 HA PRO 56 7.401 6.479 -17.375 455 HB2 PRO 56 HB2 PRO 56 7.932 3.789 -18.784 456 HB3 PRO 56 HB3 PRO 56 9.088 5.091 -18.471 457 HG2 PRO 56 HG2 PRO 56 9.117 2.898 -16.945 458 HG3 PRO 56 HG3 PRO 56 9.375 4.485 -16.210 459 HD2 PRO 56 HD2 PRO 56 6.945 2.704 -16.085 460 HD3 PRO 56 HD3 PRO 56 7.560 3.843 -14.880 461 H ASN 57 H ASN 57 5.101 3.894 -18.374 462 HA ASN 57 HA ASN 57 4.724 5.207 -20.928 463 HB2 ASN 57 HB2 ASN 57 2.956 2.999 -19.806 464 HB3 ASN 57 HB3 ASN 57 3.383 3.332 -21.490 465 HD21 ASN 57 HD21 ASN 57 5.364 2.558 -22.329 466 HD22 ASN 57 HD22 ASN 57 6.341 1.404 -21.483 467 H GLY 58 H GLY 58 3.752 6.074 -17.845 468 HA2 GLY 58 HA2 GLY 58 2.217 7.982 -17.871 469 HA3 GLY 58 HA3 GLY 58 1.116 6.990 -18.837 470 H CYS 59 H CYS 59 -0.018 7.985 -16.572 471 HA CYS 59 HA CYS 59 0.376 6.704 -14.175 472 HB2 CYS 59 HB2 CYS 59 -2.215 7.660 -15.480 473 HB3 CYS 59 HB3 CYS 59 -2.066 7.197 -13.780 474 H ARG 60 H ARG 60 0.320 4.562 -13.577 475 HA ARG 60 HA ARG 60 -1.326 2.790 -15.275 476 HB2 ARG 60 HB2 ARG 60 1.257 2.509 -14.857 477 HB3 ARG 60 HB3 ARG 60 0.782 1.964 -13.243 478 HG2 ARG 60 HG2 ARG 60 1.038 -0.001 -14.585 479 HG3 ARG 60 HG3 ARG 60 -0.700 0.219 -14.342 480 HD2 ARG 60 HD2 ARG 60 0.916 0.960 -16.834 481 HD3 ARG 60 HD3 ARG 60 -0.264 -0.349 -16.686 482 HE ARG 60 HE ARG 60 -0.836 2.524 -16.976 483 HH11 ARG 60 HH11 ARG 60 -2.105 -0.683 -16.280 484 HH12 ARG 60 HH12 ARG 60 -3.745 -0.235 -16.610 485 HH21 ARG 60 HH21 ARG 60 -2.990 3.098 -17.385 486 HH22 ARG 60 HH22 ARG 60 -4.248 1.917 -17.238 487 H LYS 61 H LYS 61 -3.195 2.011 -14.450 488 HA LYS 61 HA LYS 61 -3.469 2.006 -11.517 489 HB2 LYS 61 HB2 LYS 61 -5.692 2.748 -11.680 490 HB3 LYS 61 HB3 LYS 61 -4.832 3.773 -12.837 491 HG2 LYS 61 HG2 LYS 61 -5.865 2.823 -14.679 492 HG3 LYS 61 HG3 LYS 61 -6.029 1.235 -13.918 493 HD2 LYS 61 HD2 LYS 61 -7.781 2.261 -12.359 494 HD3 LYS 61 HD3 LYS 61 -7.698 3.735 -13.333 495 HE2 LYS 61 HE2 LYS 61 -9.549 2.478 -14.192 496 HE3 LYS 61 HE3 LYS 61 -8.252 2.316 -15.383 497 HZ1 LYS 61 HZ1 LYS 61 -9.365 0.223 -14.851 498 HZ2 LYS 61 HZ2 LYS 61 -7.767 0.154 -14.525 499 HZ3 LYS 61 HZ3 LYS 61 -8.842 0.306 -13.306 500 H TRP 62 H TRP 62 -4.615 0.182 -10.639 501 HA TRP 62 HA TRP 62 -5.642 -1.818 -12.478 502 HB2 TRP 62 HB2 TRP 62 -3.207 -2.324 -12.393 503 HB3 TRP 62 HB3 TRP 62 -3.280 -2.395 -10.627 504 HD1 TRP 62 HD1 TRP 62 -3.044 -4.900 -10.001 505 HE1 TRP 62 HE1 TRP 62 -4.172 -7.104 -10.749 506 HE3 TRP 62 HE3 TRP 62 -5.920 -3.067 -13.841 507 HZ2 TRP 62 HZ2 TRP 62 -6.027 -7.960 -12.687 508 HZ3 TRP 62 HZ3 TRP 62 -7.359 -4.647 -15.106 509 HH2 TRP 62 HH2 TRP 62 -7.412 -7.056 -14.531 510 H GLU 63 H GLU 63 -7.172 -3.213 -11.372 511 HA GLU 63 HA GLU 63 -7.508 -2.475 -8.516 512 HB2 GLU 63 HB2 GLU 63 -10.024 -2.937 -9.025 513 HB3 GLU 63 HB3 GLU 63 -9.352 -1.386 -9.544 514 HG2 GLU 63 HG2 GLU 63 -9.633 -3.763 -11.441 515 HG3 GLU 63 HG3 GLU 63 -10.936 -2.597 -11.173 516 H THR 64 H THR 64 -7.433 -4.208 -7.212 517 HA THR 64 HA THR 64 -7.821 -6.856 -8.420 518 HB THR 64 HB THR 64 -6.079 -6.312 -5.982 519 HG1 THR 64 HG1 THR 64 -4.577 -5.431 -7.214 520 HG21 THR 64 HG21 THR 64 -4.976 -8.422 -6.736 521 HG22 THR 64 HG22 THR 64 -6.737 -8.650 -6.471 522 HG23 THR 64 HG23 THR 64 -6.093 -8.492 -8.140 523 H THR 65 H THR 65 -8.927 -8.437 -7.096 524 HA THR 65 HA THR 65 -10.361 -7.262 -4.819 525 HB THR 65 HB THR 65 -11.165 -9.684 -6.465 526 HG1 THR 65 HG1 THR 65 -12.632 -8.117 -7.489 527 HG21 THR 65 HG21 THR 65 -13.378 -9.216 -5.481 528 HG22 THR 65 HG22 THR 65 -12.144 -9.524 -4.212 529 HG23 THR 65 HG23 THR 65 -12.678 -7.844 -4.557 530 H PHE 66 H PHE 66 -10.190 -8.166 -2.777 531 HA PHE 66 HA PHE 66 -8.622 -10.653 -2.610 532 HB2 PHE 66 HB2 PHE 66 -8.618 -8.403 -0.559 533 HB3 PHE 66 HB3 PHE 66 -7.568 -9.825 -0.613 534 HD1 PHE 66 HD1 PHE 66 -6.875 -9.766 -3.584 535 HD2 PHE 66 HD2 PHE 66 -7.044 -6.670 -0.613 536 HE1 PHE 66 HE1 PHE 66 -5.190 -8.464 -4.847 537 HE2 PHE 66 HE2 PHE 66 -5.361 -5.366 -1.873 538 HZ PHE 66 HZ PHE 66 -4.431 -6.259 -3.997 539 H LYS 67 H LYS 67 -8.922 -11.574 -0.169 540 HA LYS 67 HA LYS 67 -11.827 -11.495 0.355 541 HB2 LYS 67 HB2 LYS 67 -9.787 -13.723 0.260 542 HB3 LYS 67 HB3 LYS 67 -11.122 -13.848 1.413 543 HG2 LYS 67 HG2 LYS 67 -11.688 -15.016 -0.658 544 HG3 LYS 67 HG3 LYS 67 -12.764 -13.631 -0.433 545 HD2 LYS 67 HD2 LYS 67 -11.293 -12.283 -1.987 546 HD3 LYS 67 HD3 LYS 67 -10.304 -13.723 -2.259 547 HE2 LYS 67 HE2 LYS 67 -12.164 -14.925 -3.251 548 HE3 LYS 67 HE3 LYS 67 -13.321 -13.691 -2.738 549 HZ1 LYS 67 HZ1 LYS 67 -12.984 -12.853 -4.743 550 HZ2 LYS 67 HZ2 LYS 67 -11.533 -12.314 -4.223 551 HZ3 LYS 67 HZ3 LYS 67 -11.637 -13.731 -5.029 552 H LYS 68 H LYS 68 -12.510 -11.645 2.596 553 HA LYS 68 HA LYS 68 -10.945 -10.110 4.325 554 HB2 LYS 68 HB2 LYS 68 -13.403 -10.221 4.469 555 HB3 LYS 68 HB3 LYS 68 -13.346 -11.956 4.809 556 HG2 LYS 68 HG2 LYS 68 -13.393 -11.429 6.998 557 HG3 LYS 68 HG3 LYS 68 -11.730 -10.853 6.823 558 HD2 LYS 68 HD2 LYS 68 -12.793 -8.973 7.733 559 HD3 LYS 68 HD3 LYS 68 -12.830 -8.605 6.003 560 HE2 LYS 68 HE2 LYS 68 -15.148 -9.429 5.828 561 HE3 LYS 68 HE3 LYS 68 -15.123 -9.959 7.515 562 HZ1 LYS 68 HZ1 LYS 68 -16.196 -7.833 7.272 563 HZ2 LYS 68 HZ2 LYS 68 -14.840 -7.652 8.164 564 HZ3 LYS 68 HZ3 LYS 68 -14.863 -7.164 6.606 565 H THR 69 H THR 69 -9.177 -10.661 5.592 566 HA THR 69 HA THR 69 -9.194 -13.375 6.807 567 HB THR 69 HB THR 69 -6.650 -12.154 5.681 568 HG1 THR 69 HG1 THR 69 -8.027 -14.009 3.987 569 HG21 THR 69 HG21 THR 69 -6.017 -14.540 5.415 570 HG22 THR 69 HG22 THR 69 -6.544 -14.171 7.092 571 HG23 THR 69 HG23 THR 69 -7.655 -15.027 5.970 572 H SER 70 H SER 70 -9.874 -12.050 8.660 573 HA SER 70 HA SER 70 -8.266 -9.873 9.599 574 HB2 SER 70 HB2 SER 70 -9.865 -11.013 11.692 575 HB3 SER 70 HB3 SER 70 -10.168 -9.536 10.768 576 HG SER 70 HG SER 70 -11.041 -12.231 10.174 577 H ASP 71 H ASP 71 -6.215 -11.391 9.227 578 HA ASP 71 HA ASP 71 -5.704 -13.431 11.111 579 HB2 ASP 71 HB2 ASP 71 -4.476 -12.881 8.909 580 HB3 ASP 71 HB3 ASP 71 -3.779 -11.466 9.709 581 H ASP 72 H ASP 72 -4.121 -10.132 11.007 582 HA ASP 72 HA ASP 72 -4.089 -10.193 13.964 583 HB2 ASP 72 HB2 ASP 72 -1.932 -10.098 12.296 584 HB3 ASP 72 HB3 ASP 72 -2.318 -8.373 12.338 585 H GLY 73 H GLY 73 -6.312 -9.478 13.321 586 HA2 GLY 73 HA2 GLY 73 -7.940 -8.262 13.832 587 HA3 GLY 73 HA3 GLY 73 -6.913 -6.822 13.866 588 H GLU 74 H GLU 74 -6.425 -5.897 11.218 589 HA GLU 74 HA GLU 74 -8.924 -6.731 9.795 590 HB2 GLU 74 HB2 GLU 74 -7.814 -3.956 10.178 591 HB3 GLU 74 HB3 GLU 74 -8.607 -4.362 8.651 592 HG2 GLU 74 HG2 GLU 74 -10.454 -3.627 9.761 593 HG3 GLU 74 HG3 GLU 74 -10.502 -5.302 10.326 594 H VAL 75 H VAL 75 -6.947 -8.367 9.307 595 HA VAL 75 HA VAL 75 -5.124 -7.222 7.322 596 HB VAL 75 HB VAL 75 -5.323 -9.956 8.696 597 HG11 VAL 75 HG11 VAL 75 -3.165 -10.507 7.623 598 HG12 VAL 75 HG12 VAL 75 -4.477 -10.266 6.421 599 HG13 VAL 75 HG13 VAL 75 -3.250 -8.980 6.682 600 HG21 VAL 75 HG21 VAL 75 -3.170 -9.278 9.740 601 HG22 VAL 75 HG22 VAL 75 -3.275 -7.694 8.901 602 HG23 VAL 75 HG23 VAL 75 -4.499 -8.138 10.138 603 H TYR 76 H TYR 76 -4.838 -8.488 5.223 604 HA TYR 76 HA TYR 76 -7.268 -9.924 4.431 605 HB2 TYR 76 HB2 TYR 76 -6.003 -7.546 2.992 606 HB3 TYR 76 HB3 TYR 76 -7.163 -8.649 2.240 607 HD1 TYR 76 HD1 TYR 76 -9.486 -8.899 3.358 608 HD2 TYR 76 HD2 TYR 76 -6.758 -5.720 4.307 609 HE1 TYR 76 HE1 TYR 76 -11.359 -7.573 4.286 610 HE2 TYR 76 HE2 TYR 76 -8.628 -4.393 5.239 611 HH TYR 76 HH TYR 76 -10.796 -4.299 5.669 612 H TYR 77 H TYR 77 -6.964 -11.460 2.715 613 HA TYR 77 HA TYR 77 -4.131 -11.872 2.004 614 HB2 TYR 77 HB2 TYR 77 -6.189 -13.813 3.131 615 HB3 TYR 77 HB3 TYR 77 -4.908 -14.399 2.061 616 HD1 TYR 77 HD1 TYR 77 -5.148 -12.092 5.065 617 HD2 TYR 77 HD2 TYR 77 -3.073 -15.319 3.132 618 HE1 TYR 77 HE1 TYR 77 -3.606 -12.256 6.995 619 HE2 TYR 77 HE2 TYR 77 -1.536 -15.488 5.061 620 HH TYR 77 HH TYR 77 -2.150 -14.123 8.052 621 H SER 78 H SER 78 -3.835 -11.925 -0.210 622 HA SER 78 HA SER 78 -6.261 -12.397 -1.871 623 HB2 SER 78 HB2 SER 78 -3.603 -11.574 -3.021 624 HB3 SER 78 HB3 SER 78 -5.227 -10.998 -3.416 625 HG SER 78 HG SER 78 -4.696 -9.270 -2.276 626 H GLU 79 H GLU 79 -6.202 -14.758 -1.479 627 HA GLU 79 HA GLU 79 -3.872 -16.310 -1.870 628 HB2 GLU 79 HB2 GLU 79 -6.274 -16.762 -0.761 629 HB3 GLU 79 HB3 GLU 79 -6.684 -17.315 -2.390 630 HG2 GLU 79 HG2 GLU 79 -4.406 -18.402 -0.671 631 HG3 GLU 79 HG3 GLU 79 -5.985 -19.167 -0.891 632 H GLU 80 H GLU 80 -6.572 -15.288 -4.083 633 HA GLU 80 HA GLU 80 -5.906 -16.925 -6.226 634 HB2 GLU 80 HB2 GLU 80 -7.027 -14.073 -6.256 635 HB3 GLU 80 HB3 GLU 80 -7.129 -15.240 -7.581 636 HG2 GLU 80 HG2 GLU 80 -8.460 -16.769 -6.095 637 HG3 GLU 80 HG3 GLU 80 -8.402 -15.547 -4.818 638 H ALA 81 H ALA 81 -4.253 -13.959 -5.061 639 HA ALA 81 HA ALA 81 -2.545 -14.131 -7.441 640 HB1 ALA 81 HB1 ALA 81 -1.914 -11.795 -6.911 641 HB2 ALA 81 HB2 ALA 81 -3.672 -11.988 -7.228 642 HB3 ALA 81 HB3 ALA 81 -3.077 -11.813 -5.542 643 H LYS 82 H LYS 82 -2.564 -15.028 -4.151 644 HA LYS 82 HA LYS 82 -0.974 -15.808 -2.807 645 HB2 LYS 82 HB2 LYS 82 1.152 -15.359 -4.911 646 HB3 LYS 82 HB3 LYS 82 1.096 -16.563 -3.616 647 HG2 LYS 82 HG2 LYS 82 -0.559 -16.523 -6.180 648 HG3 LYS 82 HG3 LYS 82 0.703 -17.677 -5.730 649 HD2 LYS 82 HD2 LYS 82 -0.670 -18.532 -3.872 650 HD3 LYS 82 HD3 LYS 82 -1.901 -17.296 -4.166 651 HE2 LYS 82 HE2 LYS 82 -1.953 -18.304 -6.618 652 HE3 LYS 82 HE3 LYS 82 -1.172 -19.705 -5.872 653 HZ1 LYS 82 HZ1 LYS 82 -3.553 -19.914 -5.872 654 HZ2 LYS 82 HZ2 LYS 82 -3.020 -19.827 -4.331 655 HZ3 LYS 82 HZ3 LYS 82 -3.740 -18.534 -5.020 656 H LYS 83 H LYS 83 -1.721 -13.260 -2.306 657 HA LYS 83 HA LYS 83 0.764 -11.999 -1.446 658 HB2 LYS 83 HB2 LYS 83 -0.206 -9.766 -2.253 659 HB3 LYS 83 HB3 LYS 83 0.513 -10.819 -3.479 660 HG2 LYS 83 HG2 LYS 83 -1.826 -11.648 -4.037 661 HG3 LYS 83 HG3 LYS 83 -2.467 -10.433 -2.923 662 HD2 LYS 83 HD2 LYS 83 -2.580 -9.374 -5.034 663 HD3 LYS 83 HD3 LYS 83 -1.128 -8.686 -4.297 664 HE2 LYS 83 HE2 LYS 83 0.318 -10.193 -5.583 665 HE3 LYS 83 HE3 LYS 83 -1.079 -11.083 -6.201 666 HZ1 LYS 83 HZ1 LYS 83 -0.307 -9.512 -7.819 667 HZ2 LYS 83 HZ2 LYS 83 -1.780 -9.026 -7.309 668 HZ3 LYS 83 HZ3 LYS 83 -0.439 -8.256 -6.784 669 H LYS 84 H LYS 84 0.541 -10.990 0.540 670 HA LYS 84 HA LYS 84 -2.175 -10.883 1.620 671 HB2 LYS 84 HB2 LYS 84 -1.116 -11.378 3.857 672 HB3 LYS 84 HB3 LYS 84 -1.097 -12.719 2.705 673 HG2 LYS 84 HG2 LYS 84 1.170 -12.788 2.625 674 HG3 LYS 84 HG3 LYS 84 1.323 -11.029 2.531 675 HD2 LYS 84 HD2 LYS 84 2.321 -11.914 4.623 676 HD3 LYS 84 HD3 LYS 84 0.973 -10.821 4.963 677 HE2 LYS 84 HE2 LYS 84 -0.470 -13.060 4.934 678 HE3 LYS 84 HE3 LYS 84 1.092 -13.842 5.207 679 HZ1 LYS 84 HZ1 LYS 84 -0.359 -12.992 7.168 680 HZ2 LYS 84 HZ2 LYS 84 1.269 -12.908 7.246 681 HZ3 LYS 84 HZ3 LYS 84 0.400 -11.574 6.887 682 H VAL 85 H VAL 85 -2.638 -9.200 3.241 683 HA VAL 85 HA VAL 85 -0.520 -7.153 3.488 684 HB VAL 85 HB VAL 85 -3.439 -6.680 2.663 685 HG11 VAL 85 HG11 VAL 85 -2.801 -4.305 2.491 686 HG12 VAL 85 HG12 VAL 85 -2.627 -4.934 4.164 687 HG13 VAL 85 HG13 VAL 85 -1.173 -4.701 3.136 688 HG21 VAL 85 HG21 VAL 85 -2.468 -5.779 0.558 689 HG22 VAL 85 HG22 VAL 85 -0.830 -6.257 1.120 690 HG23 VAL 85 HG23 VAL 85 -2.070 -7.515 0.792 691 H GLU 86 H GLU 86 -0.432 -6.389 5.610 692 HA GLU 86 HA GLU 86 -2.789 -6.858 7.298 693 HB2 GLU 86 HB2 GLU 86 -0.943 -7.285 9.144 694 HB3 GLU 86 HB3 GLU 86 -1.539 -8.603 8.126 695 HG2 GLU 86 HG2 GLU 86 0.951 -7.042 7.349 696 HG3 GLU 86 HG3 GLU 86 1.033 -8.350 8.537 697 H VAL 87 H VAL 87 -3.484 -4.968 8.145 698 HA VAL 87 HA VAL 87 -1.930 -2.610 7.915 699 HB VAL 87 HB VAL 87 -4.347 -2.499 7.853 700 HG11 VAL 87 HG11 VAL 87 -5.772 -3.026 9.816 701 HG12 VAL 87 HG12 VAL 87 -4.901 -4.471 9.200 702 HG13 VAL 87 HG13 VAL 87 -4.327 -3.641 10.687 703 HG21 VAL 87 HG21 VAL 87 -4.802 -0.788 9.595 704 HG22 VAL 87 HG22 VAL 87 -3.298 -1.274 10.448 705 HG23 VAL 87 HG23 VAL 87 -3.206 -0.548 8.808 706 H LEU 88 H LEU 88 -0.140 -2.195 9.192 707 HA LEU 88 HA LEU 88 0.263 -3.601 11.660 708 HB2 LEU 88 HB2 LEU 88 1.737 -1.247 10.379 709 HB3 LEU 88 HB3 LEU 88 2.306 -2.175 11.773 710 HG LEU 88 HG LEU 88 1.885 -3.278 8.964 711 HD11 LEU 88 HD11 LEU 88 4.352 -3.398 8.887 712 HD12 LEU 88 HD12 LEU 88 3.763 -1.711 9.068 713 HD13 LEU 88 HD13 LEU 88 4.435 -2.584 10.486 714 HD21 LEU 88 HD21 LEU 88 3.070 -5.276 9.823 715 HD22 LEU 88 HD22 LEU 88 3.091 -4.549 11.466 716 HD23 LEU 88 HD23 LEU 88 1.527 -4.982 10.694 717 H ASP 89 H ASP 89 -0.299 -0.087 10.743 718 HA ASP 89 HA ASP 89 -1.805 0.271 13.175 719 HB2 ASP 89 HB2 ASP 89 0.742 0.578 13.710 720 HB3 ASP 89 HB3 ASP 89 0.607 2.072 12.774 721 H THR 90 H THR 90 -3.107 2.218 13.066 722 HA THR 90 HA THR 90 -2.741 3.977 10.809 723 HB THR 90 HB THR 90 -3.994 1.974 9.915 724 HG1 THR 90 HG1 THR 90 -5.016 3.338 8.600 725 HG21 THR 90 HG21 THR 90 -6.386 1.755 10.524 726 HG22 THR 90 HG22 THR 90 -5.304 1.424 11.918 727 HG23 THR 90 HG23 THR 90 -6.166 2.996 11.804 728 H ASP 91 H ASP 91 -3.719 6.021 11.146 729 HA ASP 91 HA ASP 91 -4.845 6.354 13.834 730 HB2 ASP 91 HB2 ASP 91 -2.886 7.745 12.990 731 HB3 ASP 91 HB3 ASP 91 -3.984 8.463 11.805 732 H TYR 92 H TYR 92 -6.764 7.912 14.004 733 HA TYR 92 HA TYR 92 -8.727 7.125 12.023 734 HB2 TYR 92 HB2 TYR 92 -8.957 8.755 14.596 735 HB3 TYR 92 HB3 TYR 92 -10.312 8.234 13.586 736 HD1 TYR 92 HD1 TYR 92 -7.555 7.031 15.792 737 HD2 TYR 92 HD2 TYR 92 -11.139 5.962 13.680 738 HE1 TYR 92 HE1 TYR 92 -7.612 4.868 16.989 739 HE2 TYR 92 HE2 TYR 92 -11.203 3.798 14.884 740 HH TYR 92 HH TYR 92 -10.228 2.475 16.376 741 H LYS 93 H LYS 93 -6.823 10.034 12.882 742 HA LYS 93 HA LYS 93 -8.088 11.347 10.593 743 HB2 LYS 93 HB2 LYS 93 -7.387 12.566 13.285 744 HB3 LYS 93 HB3 LYS 93 -7.773 13.507 11.838 745 HG2 LYS 93 HG2 LYS 93 -10.023 12.364 11.741 746 HG3 LYS 93 HG3 LYS 93 -9.631 11.523 13.246 747 HD2 LYS 93 HD2 LYS 93 -9.258 13.776 14.352 748 HD3 LYS 93 HD3 LYS 93 -9.783 14.560 12.856 749 HE2 LYS 93 HE2 LYS 93 -11.484 12.562 14.429 750 HE3 LYS 93 HE3 LYS 93 -11.585 14.316 14.627 751 HZ1 LYS 93 HZ1 LYS 93 -13.234 13.503 13.099 752 HZ2 LYS 93 HZ2 LYS 93 -12.194 14.476 12.300 753 HZ3 LYS 93 HZ3 LYS 93 -12.101 12.856 12.117 754 H SER 94 H SER 94 -5.350 9.792 11.213 755 HA SER 94 HA SER 94 -3.755 11.940 9.944 756 HB2 SER 94 HB2 SER 94 -3.219 11.603 12.435 757 HB3 SER 94 HB3 SER 94 -2.850 9.908 12.093 758 HG SER 94 HG SER 94 -0.936 11.245 12.107 759 H TYR 95 H TYR 95 -1.416 9.930 10.013 760 HA TYR 95 HA TYR 95 -2.156 8.640 7.505 761 HB2 TYR 95 HB2 TYR 95 0.272 8.259 7.309 762 HB3 TYR 95 HB3 TYR 95 -0.047 9.958 7.679 763 HD1 TYR 95 HD1 TYR 95 1.204 6.741 9.065 764 HD2 TYR 95 HD2 TYR 95 0.653 10.939 9.793 765 HE1 TYR 95 HE1 TYR 95 2.685 6.592 11.043 766 HE2 TYR 95 HE2 TYR 95 2.139 10.794 11.765 767 HH TYR 95 HH TYR 95 3.400 9.503 13.036 768 H ALA 96 H ALA 96 -0.820 6.367 7.270 769 HA ALA 96 HA ALA 96 -0.962 4.800 9.691 770 HB1 ALA 96 HB1 ALA 96 -2.486 3.150 8.712 771 HB2 ALA 96 HB2 ALA 96 -3.266 4.746 8.976 772 HB3 ALA 96 HB3 ALA 96 -2.768 4.253 7.323 773 H VAL 97 H VAL 97 -0.126 2.538 9.398 774 HA VAL 97 HA VAL 97 1.601 2.398 7.023 775 HB VAL 97 HB VAL 97 3.267 1.194 8.471 776 HG11 VAL 97 HG11 VAL 97 4.198 3.257 9.478 777 HG12 VAL 97 HG12 VAL 97 3.584 3.539 7.814 778 HG13 VAL 97 HG13 VAL 97 2.622 4.081 9.230 779 HG21 VAL 97 HG21 VAL 97 3.172 1.544 10.916 780 HG22 VAL 97 HG22 VAL 97 1.550 2.293 10.740 781 HG23 VAL 97 HG23 VAL 97 1.790 0.564 10.321 782 H ILE 98 H ILE 98 1.132 0.548 5.817 783 HA ILE 98 HA ILE 98 -0.120 -1.667 7.290 784 HB ILE 98 HB ILE 98 -0.414 -1.093 4.309 785 HG12 ILE 98 HG12 ILE 98 -1.283 0.867 5.445 786 HG13 ILE 98 HG13 ILE 98 -2.623 -0.097 4.810 787 HG21 ILE 98 HG21 ILE 98 -2.418 -2.531 4.546 788 HG22 ILE 98 HG22 ILE 98 -0.916 -3.384 5.040 789 HG23 ILE 98 HG23 ILE 98 -2.043 -2.754 6.288 790 HD11 ILE 98 HD11 ILE 98 -3.134 0.761 7.050 791 HD12 ILE 98 HD12 ILE 98 -3.037 -1.032 7.066 792 HD13 ILE 98 HD13 ILE 98 -1.677 -0.054 7.711 793 H TYR 99 H TYR 99 0.698 -3.764 6.933 794 HA TYR 99 HA TYR 99 3.271 -3.865 5.542 795 HB2 TYR 99 HB2 TYR 99 3.010 -4.581 7.976 796 HB3 TYR 99 HB3 TYR 99 1.969 -5.896 7.416 797 HD1 TYR 99 HD1 TYR 99 5.407 -4.457 7.000 798 HD2 TYR 99 HD2 TYR 99 2.922 -7.943 6.684 799 HE1 TYR 99 HE1 TYR 99 7.414 -5.846 6.586 800 HE2 TYR 99 HE2 TYR 99 4.926 -9.336 6.274 801 HH TYR 99 HH TYR 99 7.109 -9.366 5.925 802 H ALA 100 H ALA 100 3.686 -5.435 3.887 803 HA ALA 100 HA ALA 100 1.418 -7.114 3.120 804 HB1 ALA 100 HB1 ALA 100 1.722 -6.450 0.758 805 HB2 ALA 100 HB2 ALA 100 1.194 -5.080 1.792 806 HB3 ALA 100 HB3 ALA 100 2.910 -5.206 1.274 807 H THR 101 H THR 101 1.957 -9.045 1.983 808 HA THR 101 HA THR 101 4.771 -9.490 1.425 809 HB THR 101 HB THR 101 3.134 -11.278 3.289 810 HG1 THR 101 HG1 THR 101 5.603 -9.841 3.828 811 HG21 THR 101 HG21 THR 101 5.221 -12.589 3.502 812 HG22 THR 101 HG22 THR 101 4.609 -12.577 1.813 813 HG23 THR 101 HG23 THR 101 6.001 -11.539 2.271 814 H ARG 102 H ARG 102 5.124 -11.134 -0.200 815 HA ARG 102 HA ARG 102 2.677 -12.418 -1.222 816 HB2 ARG 102 HB2 ARG 102 4.810 -10.826 -2.677 817 HB3 ARG 102 HB3 ARG 102 4.044 -12.191 -3.500 818 HG2 ARG 102 HG2 ARG 102 2.696 -10.447 -4.190 819 HG3 ARG 102 HG3 ARG 102 1.791 -11.025 -2.784 820 HD2 ARG 102 HD2 ARG 102 3.087 -9.318 -1.381 821 HD3 ARG 102 HD3 ARG 102 3.722 -8.662 -2.895 822 HE ARG 102 HE ARG 102 1.412 -8.075 -3.528 823 HH11 ARG 102 HH11 ARG 102 2.249 -8.539 -0.184 824 HH12 ARG 102 HH12 ARG 102 0.728 -7.989 0.434 825 HH21 ARG 102 HH21 ARG 102 -0.735 -7.540 -2.708 826 HH22 ARG 102 HH22 ARG 102 -0.966 -7.421 -0.995 827 H VAL 103 H VAL 103 3.021 -14.697 -1.499 828 HA VAL 103 HA VAL 103 5.849 -15.538 -1.418 829 HB VAL 103 HB VAL 103 4.588 -16.283 0.538 830 HG11 VAL 103 HG11 VAL 103 2.677 -17.834 0.320 831 HG12 VAL 103 HG12 VAL 103 2.321 -16.220 -0.382 832 HG13 VAL 103 HG13 VAL 103 2.701 -17.604 -1.461 833 HG21 VAL 103 HG21 VAL 103 4.970 -18.721 0.318 834 HG22 VAL 103 HG22 VAL 103 5.114 -18.531 -1.462 835 HG23 VAL 103 HG23 VAL 103 6.320 -17.761 -0.376 836 H LYS 104 H LYS 104 6.580 -16.540 -3.193 837 HA LYS 104 HA LYS 104 4.716 -17.547 -5.190 838 HB2 LYS 104 HB2 LYS 104 7.292 -16.031 -5.571 839 HB3 LYS 104 HB3 LYS 104 6.537 -17.001 -6.842 840 HG2 LYS 104 HG2 LYS 104 4.813 -14.977 -5.435 841 HG3 LYS 104 HG3 LYS 104 6.061 -14.371 -6.533 842 HD2 LYS 104 HD2 LYS 104 5.119 -15.434 -8.419 843 HD3 LYS 104 HD3 LYS 104 4.262 -16.637 -7.447 844 HE2 LYS 104 HE2 LYS 104 3.566 -13.678 -7.238 845 HE3 LYS 104 HE3 LYS 104 2.901 -14.677 -8.537 846 HZ1 LYS 104 HZ1 LYS 104 1.437 -14.656 -6.668 847 HZ2 LYS 104 HZ2 LYS 104 2.037 -16.166 -6.823 848 HZ3 LYS 104 HZ3 LYS 104 2.599 -15.182 -5.648 849 H ASP 105 H ASP 105 5.921 -19.158 -6.738 850 HA ASP 105 HA ASP 105 6.486 -21.443 -5.574 851 HB2 ASP 105 HB2 ASP 105 8.050 -20.251 -7.953 852 HB3 ASP 105 HB3 ASP 105 7.989 -21.975 -7.563 853 H GLY 106 H GLY 106 7.560 -21.535 -3.561 854 HA2 GLY 106 HA2 GLY 106 9.443 -22.056 -2.428 855 HA3 GLY 106 HA3 GLY 106 10.378 -21.837 -3.912 856 H ARG 107 H ARG 107 8.543 -18.933 -3.212 857 HA ARG 107 HA ARG 107 10.713 -17.828 -1.612 858 HB2 ARG 107 HB2 ARG 107 11.421 -17.756 -4.058 859 HB3 ARG 107 HB3 ARG 107 9.981 -16.790 -4.407 860 HG2 ARG 107 HG2 ARG 107 10.871 -14.873 -3.519 861 HG3 ARG 107 HG3 ARG 107 11.726 -15.727 -2.228 862 HD2 ARG 107 HD2 ARG 107 12.555 -15.793 -5.176 863 HD3 ARG 107 HD3 ARG 107 13.235 -14.682 -3.980 864 HE ARG 107 HE ARG 107 13.821 -16.910 -2.722 865 HH11 ARG 107 HH11 ARG 107 13.833 -16.476 -6.213 866 HH12 ARG 107 HH12 ARG 107 15.054 -17.677 -6.477 867 HH21 ARG 107 HH21 ARG 107 15.420 -18.474 -3.084 868 HH22 ARG 107 HH22 ARG 107 15.957 -18.814 -4.696 869 H THR 108 H THR 108 10.163 -16.038 -0.411 870 HA THR 108 HA THR 108 7.480 -14.971 -0.855 871 HB THR 108 HB THR 108 8.801 -15.026 1.838 872 HG1 THR 108 HG1 THR 108 7.589 -17.050 2.143 873 HG21 THR 108 HG21 THR 108 6.456 -14.985 2.590 874 HG22 THR 108 HG22 THR 108 6.838 -13.591 1.524 875 HG23 THR 108 HG23 THR 108 5.908 -14.985 0.880 876 H LEU 109 H LEU 109 7.111 -12.673 -0.761 877 HA LEU 109 HA LEU 109 9.592 -11.136 -0.283 878 HB2 LEU 109 HB2 LEU 109 9.127 -11.218 -2.673 879 HB3 LEU 109 HB3 LEU 109 7.445 -10.743 -2.400 880 HG LEU 109 HG LEU 109 8.212 -8.536 -1.551 881 HD11 LEU 109 HD11 LEU 109 10.556 -7.846 -1.912 882 HD12 LEU 109 HD12 LEU 109 10.423 -9.184 -0.721 883 HD13 LEU 109 HD13 LEU 109 10.969 -9.525 -2.398 884 HD21 LEU 109 HD21 LEU 109 8.922 -7.638 -3.742 885 HD22 LEU 109 HD22 LEU 109 9.257 -9.309 -4.311 886 HD23 LEU 109 HD23 LEU 109 7.578 -8.819 -3.902 887 H HIS 110 H HIS 110 9.311 -9.207 0.940 888 HA HIS 110 HA HIS 110 6.572 -8.864 2.025 889 HB2 HIS 110 HB2 HIS 110 9.308 -8.258 3.283 890 HB3 HIS 110 HB3 HIS 110 7.742 -7.900 4.022 891 HD2 HIS 110 HD2 HIS 110 10.325 -10.669 4.031 892 HE1 HIS 110 HE1 HIS 110 6.676 -12.489 5.323 893 H MET 111 H MET 111 5.898 -6.566 2.256 894 HA MET 111 HA MET 111 7.750 -4.561 1.125 895 HB2 MET 111 HB2 MET 111 6.077 -5.746 -0.608 896 HB3 MET 111 HB3 MET 111 4.848 -4.771 0.208 897 HG2 MET 111 HG2 MET 111 6.131 -2.710 -0.334 898 HG3 MET 111 HG3 MET 111 7.347 -3.690 -1.163 899 HE1 MET 111 HE1 MET 111 6.460 -3.214 -4.522 900 HE2 MET 111 HE2 MET 111 6.354 -1.695 -3.571 901 HE3 MET 111 HE3 MET 111 7.543 -2.960 -3.112 902 H MET 112 H MET 112 7.863 -3.164 2.808 903 HA MET 112 HA MET 112 5.505 -2.828 4.553 904 HB2 MET 112 HB2 MET 112 8.416 -1.873 4.688 905 HB3 MET 112 HB3 MET 112 7.171 -1.383 5.844 906 HG2 MET 112 HG2 MET 112 6.854 -3.778 6.484 907 HG3 MET 112 HG3 MET 112 8.147 -4.231 5.365 908 HE1 MET 112 HE1 MET 112 11.357 -2.803 6.961 909 HE2 MET 112 HE2 MET 112 10.537 -3.438 5.495 910 HE3 MET 112 HE3 MET 112 10.364 -1.707 5.942 911 H ARG 113 H ARG 113 4.430 -0.760 4.601 912 HA ARG 113 HA ARG 113 5.533 1.406 3.083 913 HB2 ARG 113 HB2 ARG 113 3.160 -0.190 2.091 914 HB3 ARG 113 HB3 ARG 113 3.267 1.546 1.768 915 HG2 ARG 113 HG2 ARG 113 4.423 0.945 -0.083 916 HG3 ARG 113 HG3 ARG 113 5.792 0.716 1.013 917 HD2 ARG 113 HD2 ARG 113 5.769 -1.352 -0.049 918 HD3 ARG 113 HD3 ARG 113 4.754 -1.711 1.353 919 HE ARG 113 HE ARG 113 3.759 -1.203 -1.419 920 HH11 ARG 113 HH11 ARG 113 3.339 -2.542 1.795 921 HH12 ARG 113 HH12 ARG 113 1.781 -3.217 1.451 922 HH21 ARG 113 HH21 ARG 113 1.650 -2.003 -1.826 923 HH22 ARG 113 HH22 ARG 113 0.824 -2.910 -0.604 924 H LEU 114 H LEU 114 4.056 3.377 3.111 925 HA LEU 114 HA LEU 114 2.253 3.355 5.441 926 HB2 LEU 114 HB2 LEU 114 4.563 4.073 6.122 927 HB3 LEU 114 HB3 LEU 114 4.485 5.365 4.917 928 HG LEU 114 HG LEU 114 2.450 5.142 7.160 929 HD11 LEU 114 HD11 LEU 114 3.831 6.781 8.408 930 HD12 LEU 114 HD12 LEU 114 4.690 5.221 8.177 931 HD13 LEU 114 HD13 LEU 114 5.115 6.639 7.161 932 HD21 LEU 114 HD21 LEU 114 2.199 7.566 6.744 933 HD22 LEU 114 HD22 LEU 114 3.421 7.462 5.431 934 HD23 LEU 114 HD23 LEU 114 1.857 6.593 5.274 935 H TYR 115 H TYR 115 0.472 4.800 5.179 936 HA TYR 115 HA TYR 115 0.527 6.307 2.647 937 HB2 TYR 115 HB2 TYR 115 -1.737 5.781 2.219 938 HB3 TYR 115 HB3 TYR 115 -0.861 4.266 2.472 939 HD1 TYR 115 HD1 TYR 115 -3.429 6.546 3.825 940 HD2 TYR 115 HD2 TYR 115 -1.348 2.835 4.413 941 HE1 TYR 115 HE1 TYR 115 -5.146 5.848 5.464 942 HE2 TYR 115 HE2 TYR 115 -3.059 2.137 6.061 943 HH TYR 115 HH TYR 115 -5.246 2.564 6.748 944 H SER 116 H SER 116 -0.655 8.307 2.583 945 HA SER 116 HA SER 116 -0.896 9.480 5.296 946 HB2 SER 116 HB2 SER 116 -0.598 10.904 2.577 947 HB3 SER 116 HB3 SER 116 -0.418 11.619 4.185 948 HG SER 116 HG SER 116 1.595 11.064 2.933 949 H ARG 117 H ARG 117 -2.802 11.017 5.485 950 HA ARG 117 HA ARG 117 -5.133 9.836 4.464 951 HB2 ARG 117 HB2 ARG 117 -4.369 12.101 6.220 952 HB3 ARG 117 HB3 ARG 117 -5.827 12.441 5.278 953 HG2 ARG 117 HG2 ARG 117 -6.850 10.315 6.108 954 HG3 ARG 117 HG3 ARG 117 -5.396 9.994 7.062 955 HD2 ARG 117 HD2 ARG 117 -7.182 11.000 8.449 956 HD3 ARG 117 HD3 ARG 117 -5.751 12.037 8.386 957 HE ARG 117 HE ARG 117 -6.979 13.649 7.226 958 HH11 ARG 117 HH11 ARG 117 -8.837 10.663 7.377 959 HH12 ARG 117 HH12 ARG 117 -10.292 11.401 6.794 960 HH21 ARG 117 HH21 ARG 117 -8.892 14.595 6.470 961 HH22 ARG 117 HH22 ARG 117 -10.323 13.637 6.278 962 H SER 118 H SER 118 -2.971 12.229 3.042 963 HA SER 118 HA SER 118 -4.737 12.433 0.739 964 HB2 SER 118 HB2 SER 118 -3.759 14.863 2.299 965 HB3 SER 118 HB3 SER 118 -4.423 14.913 0.661 966 HG SER 118 HG SER 118 -6.037 15.348 2.285 967 HA PRO 119 HA PRO 119 -0.759 12.500 -1.345 968 HB2 PRO 119 HB2 PRO 119 -0.819 14.744 -2.999 969 HB3 PRO 119 HB3 PRO 119 -1.759 13.295 -3.378 970 HG2 PRO 119 HG2 PRO 119 -2.660 15.870 -2.071 971 HG3 PRO 119 HG3 PRO 119 -3.481 14.893 -3.296 972 HD2 PRO 119 HD2 PRO 119 -4.188 14.772 -0.657 973 HD3 PRO 119 HD3 PRO 119 -4.313 13.358 -1.713 974 H GLU 120 H GLU 120 0.157 12.930 0.867 975 HA GLU 120 HA GLU 120 1.935 15.188 0.688 976 HB2 GLU 120 HB2 GLU 120 1.293 15.976 3.007 977 HB3 GLU 120 HB3 GLU 120 0.094 16.330 1.756 978 HG2 GLU 120 HG2 GLU 120 -1.003 14.054 2.516 979 HG3 GLU 120 HG3 GLU 120 -0.020 14.260 3.972 980 H VAL 121 H VAL 121 3.302 15.193 2.898 981 HA VAL 121 HA VAL 121 3.682 12.428 3.776 982 HB VAL 121 HB VAL 121 5.907 14.290 2.915 983 HG11 VAL 121 HG11 VAL 121 7.333 12.315 3.226 984 HG12 VAL 121 HG12 VAL 121 6.541 12.826 4.755 985 HG13 VAL 121 HG13 VAL 121 5.922 11.399 3.857 986 HG21 VAL 121 HG21 VAL 121 6.214 12.665 1.059 987 HG22 VAL 121 HG22 VAL 121 4.744 11.785 1.597 988 HG23 VAL 121 HG23 VAL 121 4.609 13.468 0.986 989 H SER 122 H SER 122 3.437 12.384 6.024 990 HA SER 122 HA SER 122 3.993 14.887 7.439 991 HB2 SER 122 HB2 SER 122 3.097 13.181 9.344 992 HB3 SER 122 HB3 SER 122 2.000 14.083 8.290 993 HG SER 122 HG SER 122 1.976 11.513 8.554 994 HA PRO 123 HA PRO 123 8.142 13.526 8.459 995 HB2 PRO 123 HB2 PRO 123 8.199 15.188 10.808 996 HB3 PRO 123 HB3 PRO 123 8.748 15.699 9.206 997 HG2 PRO 123 HG2 PRO 123 6.108 16.196 10.570 998 HG3 PRO 123 HG3 PRO 123 7.028 17.252 9.490 999 HD2 PRO 123 HD2 PRO 123 4.840 15.969 8.578 1000 HD3 PRO 123 HD3 PRO 123 6.253 16.148 7.531 1001 H ALA 124 H ALA 124 5.423 13.667 10.835 1002 HA ALA 124 HA ALA 124 6.654 12.122 12.823 1003 HB1 ALA 124 HB1 ALA 124 4.340 11.683 13.560 1004 HB2 ALA 124 HB2 ALA 124 4.595 13.416 13.164 1005 HB3 ALA 124 HB3 ALA 124 3.720 12.351 12.013 1006 H ALA 125 H ALA 125 4.726 11.195 9.872 1007 HA ALA 125 HA ALA 125 4.655 8.431 10.475 1008 HB1 ALA 125 HB1 ALA 125 4.047 8.214 8.091 1009 HB2 ALA 125 HB2 ALA 125 3.121 9.528 8.893 1010 HB3 ALA 125 HB3 ALA 125 4.502 9.930 7.818 1011 H THR 126 H THR 126 6.943 10.568 8.654 1012 HA THR 126 HA THR 126 8.498 8.545 7.526 1013 HB THR 126 HB THR 126 9.687 11.159 8.500 1014 HG1 THR 126 HG1 THR 126 8.653 12.182 6.632 1015 HG21 THR 126 HG21 THR 126 10.757 11.085 6.266 1016 HG22 THR 126 HG22 THR 126 11.072 9.583 7.199 1017 HG23 THR 126 HG23 THR 126 9.850 9.583 5.884 1018 H ALA 127 H ALA 127 8.798 10.353 10.697 1019 HA ALA 127 HA ALA 127 11.154 8.973 11.477 1020 HB1 ALA 127 HB1 ALA 127 10.674 9.987 13.688 1021 HB2 ALA 127 HB2 ALA 127 10.552 11.186 12.356 1022 HB3 ALA 127 HB3 ALA 127 9.061 10.505 13.091 1023 H ILE 128 H ILE 128 7.607 8.433 12.061 1024 HA ILE 128 HA ILE 128 7.968 6.446 14.011 1025 HB ILE 128 HB ILE 128 5.689 7.050 12.092 1026 HG12 ILE 128 HG12 ILE 128 6.091 8.757 13.787 1027 HG13 ILE 128 HG13 ILE 128 4.596 7.884 14.151 1028 HG21 ILE 128 HG21 ILE 128 4.304 5.533 13.468 1029 HG22 ILE 128 HG22 ILE 128 5.626 4.658 12.624 1030 HG23 ILE 128 HG23 ILE 128 5.768 5.027 14.376 1031 HD11 ILE 128 HD11 ILE 128 5.898 8.298 16.192 1032 HD12 ILE 128 HD12 ILE 128 5.783 6.537 15.861 1033 HD13 ILE 128 HD13 ILE 128 7.301 7.423 15.492 1034 H PHE 129 H PHE 129 7.344 6.196 10.403 1035 HA PHE 129 HA PHE 129 7.445 3.414 10.248 1036 HB2 PHE 129 HB2 PHE 129 6.698 5.102 8.494 1037 HB3 PHE 129 HB3 PHE 129 8.405 5.433 8.171 1038 HD1 PHE 129 HD1 PHE 129 5.696 2.941 7.893 1039 HD2 PHE 129 HD2 PHE 129 9.804 3.823 7.009 1040 HE1 PHE 129 HE1 PHE 129 5.757 1.047 6.298 1041 HE2 PHE 129 HE2 PHE 129 9.872 1.925 5.419 1042 HZ PHE 129 HZ PHE 129 7.846 0.533 5.059 1043 H ARG 130 H ARG 130 10.079 5.895 10.314 1044 HA ARG 130 HA ARG 130 12.142 4.134 9.532 1045 HB2 ARG 130 HB2 ARG 130 12.290 6.610 9.438 1046 HB3 ARG 130 HB3 ARG 130 12.185 6.697 11.201 1047 HG2 ARG 130 HG2 ARG 130 14.317 5.192 11.214 1048 HG3 ARG 130 HG3 ARG 130 14.460 5.602 9.500 1049 HD2 ARG 130 HD2 ARG 130 14.275 7.640 11.778 1050 HD3 ARG 130 HD3 ARG 130 15.780 7.119 11.009 1051 HE ARG 130 HE ARG 130 14.195 8.004 8.902 1052 HH11 ARG 130 HH11 ARG 130 15.338 9.408 11.915 1053 HH12 ARG 130 HH12 ARG 130 15.404 11.019 11.282 1054 HH21 ARG 130 HH21 ARG 130 14.301 10.126 8.080 1055 HH22 ARG 130 HH22 ARG 130 14.815 11.427 9.101 1056 H LYS 131 H LYS 131 10.902 5.224 12.799 1057 HA LYS 131 HA LYS 131 12.800 3.991 14.374 1058 HB2 LYS 131 HB2 LYS 131 9.804 4.373 14.832 1059 HB3 LYS 131 HB3 LYS 131 10.950 3.884 16.088 1060 HG2 LYS 131 HG2 LYS 131 12.206 6.011 15.786 1061 HG3 LYS 131 HG3 LYS 131 11.088 6.499 14.506 1062 HD2 LYS 131 HD2 LYS 131 9.185 6.332 16.174 1063 HD3 LYS 131 HD3 LYS 131 10.371 5.983 17.438 1064 HE2 LYS 131 HE2 LYS 131 11.524 8.161 16.933 1065 HE3 LYS 131 HE3 LYS 131 10.297 8.512 15.709 1066 HZ1 LYS 131 HZ1 LYS 131 9.785 9.556 17.799 1067 HZ2 LYS 131 HZ2 LYS 131 8.635 8.450 17.455 1068 HZ3 LYS 131 HZ3 LYS 131 9.768 8.125 18.585 1069 H LEU 132 H LEU 132 9.740 2.563 12.970 1070 HA LEU 132 HA LEU 132 10.132 0.032 14.199 1071 HB2 LEU 132 HB2 LEU 132 8.594 0.834 11.691 1072 HB3 LEU 132 HB3 LEU 132 8.459 -0.717 12.530 1073 HG LEU 132 HG LEU 132 7.729 1.994 13.721 1074 HD11 LEU 132 HD11 LEU 132 5.393 1.214 13.491 1075 HD12 LEU 132 HD12 LEU 132 6.215 1.355 11.900 1076 HD13 LEU 132 HD13 LEU 132 5.975 -0.261 12.646 1077 HD21 LEU 132 HD21 LEU 132 6.682 0.654 15.515 1078 HD22 LEU 132 HD22 LEU 132 7.319 -0.845 14.760 1079 HD23 LEU 132 HD23 LEU 132 8.454 0.380 15.419 1080 H ALA 133 H ALA 133 10.885 1.408 10.900 1081 HA ALA 133 HA ALA 133 11.845 -0.905 9.731 1082 HB1 ALA 133 HB1 ALA 133 13.095 0.648 8.250 1083 HB2 ALA 133 HB2 ALA 133 11.407 1.198 8.525 1084 HB3 ALA 133 HB3 ALA 133 12.764 1.993 9.393 1085 H GLY 134 H GLY 134 13.574 1.427 11.951 1086 HA2 GLY 134 HA2 GLY 134 16.127 0.250 11.538 1087 HA3 GLY 134 HA3 GLY 134 15.632 1.323 12.854 1088 H GLU 135 H GLU 135 13.333 -0.484 13.686 1089 HA GLU 135 HA GLU 135 14.718 -2.014 15.606 1090 HB2 GLU 135 HB2 GLU 135 12.508 -1.270 16.098 1091 HB3 GLU 135 HB3 GLU 135 11.868 -1.842 14.552 1092 HG2 GLU 135 HG2 GLU 135 12.409 -4.231 15.396 1093 HG3 GLU 135 HG3 GLU 135 12.644 -3.494 16.987 1094 H ARG 136 H ARG 136 13.669 -2.664 12.257 1095 HA ARG 136 HA ARG 136 14.178 -5.532 12.635 1096 HB2 ARG 136 HB2 ARG 136 13.234 -4.305 10.045 1097 HB3 ARG 136 HB3 ARG 136 12.835 -5.872 10.761 1098 HG2 ARG 136 HG2 ARG 136 11.516 -4.581 12.555 1099 HG3 ARG 136 HG3 ARG 136 11.750 -3.133 11.566 1100 HD2 ARG 136 HD2 ARG 136 9.636 -3.959 10.897 1101 HD3 ARG 136 HD3 ARG 136 10.731 -4.476 9.608 1102 HE ARG 136 HE ARG 136 10.384 -6.694 10.221 1103 HH11 ARG 136 HH11 ARG 136 9.222 -4.618 12.821 1104 HH12 ARG 136 HH12 ARG 136 8.421 -5.910 13.651 1105 HH21 ARG 136 HH21 ARG 136 9.331 -8.366 11.326 1106 HH22 ARG 136 HH22 ARG 136 8.484 -8.039 12.801 1107 H ASN 137 H ASN 137 16.257 -3.118 12.380 1108 HA ASN 137 HA ASN 137 18.252 -2.810 11.491 1109 HB2 ASN 137 HB2 ASN 137 17.915 -5.776 10.821 1110 HB3 ASN 137 HB3 ASN 137 19.402 -4.886 10.467 1111 HD21 ASN 137 HD21 ASN 137 17.459 -6.398 12.927 1112 HD22 ASN 137 HD22 ASN 137 18.559 -6.170 14.246 1113 H TYR 138 H TYR 138 16.025 -1.968 9.840 1114 HA TYR 138 HA TYR 138 16.345 -2.934 7.193 1115 HB2 TYR 138 HB2 TYR 138 14.665 -1.356 6.699 1116 HB3 TYR 138 HB3 TYR 138 14.410 -1.531 8.440 1117 HD1 TYR 138 HD1 TYR 138 16.100 0.172 9.864 1118 HD2 TYR 138 HD2 TYR 138 14.576 0.832 5.904 1119 HE1 TYR 138 HE1 TYR 138 16.416 2.610 10.150 1120 HE2 TYR 138 HE2 TYR 138 14.893 3.270 6.186 1121 HH TYR 138 HH TYR 138 15.553 4.906 7.511 1122 H THR 139 H THR 139 16.986 -1.467 5.307 1123 HA THR 139 HA THR 139 19.353 0.162 6.055 1124 HB THR 139 HB THR 139 19.983 -0.495 3.593 1125 HG1 THR 139 HG1 THR 139 18.659 -1.912 2.659 1126 HG21 THR 139 HG21 THR 139 21.093 -2.574 4.388 1127 HG22 THR 139 HG22 THR 139 21.214 -1.258 5.603 1128 HG23 THR 139 HG23 THR 139 20.027 -2.586 5.833 1129 H ASP 140 H ASP 140 19.625 2.160 4.739 1130 HA ASP 140 HA ASP 140 17.270 3.543 4.371 1131 HB2 ASP 140 HB2 ASP 140 19.616 4.516 4.500 1132 HB3 ASP 140 HB3 ASP 140 19.977 3.850 2.901 1133 H GLU 141 H GLU 141 19.317 2.090 1.685 1134 HA GLU 141 HA GLU 141 17.531 2.730 -0.350 1135 HB2 GLU 141 HB2 GLU 141 20.005 1.887 -0.383 1136 HB3 GLU 141 HB3 GLU 141 19.292 0.268 -0.386 1137 HG2 GLU 141 HG2 GLU 141 18.201 0.634 -2.488 1138 HG3 GLU 141 HG3 GLU 141 18.481 2.379 -2.424 1139 H MET 142 H MET 142 17.021 0.396 2.190 1140 HA MET 142 HA MET 142 15.499 -1.425 0.555 1141 HB2 MET 142 HB2 MET 142 16.588 -2.204 2.621 1142 HB3 MET 142 HB3 MET 142 15.793 -0.945 3.576 1143 HG2 MET 142 HG2 MET 142 13.556 -2.050 2.895 1144 HG3 MET 142 HG3 MET 142 14.525 -3.403 2.296 1145 HE1 MET 142 HE1 MET 142 16.024 -5.097 5.255 1146 HE2 MET 142 HE2 MET 142 16.272 -4.541 3.566 1147 HE3 MET 142 HE3 MET 142 16.950 -3.593 4.932 1148 H VAL 143 H VAL 143 14.973 1.670 2.131 1149 HA VAL 143 HA VAL 143 12.083 1.364 1.919 1150 HB VAL 143 HB VAL 143 13.689 3.403 3.506 1151 HG11 VAL 143 HG11 VAL 143 11.504 3.997 4.502 1152 HG12 VAL 143 HG12 VAL 143 11.544 4.300 2.733 1153 HG13 VAL 143 HG13 VAL 143 10.689 2.859 3.377 1154 HG21 VAL 143 HG21 VAL 143 12.848 2.191 5.486 1155 HG22 VAL 143 HG22 VAL 143 12.104 0.962 4.409 1156 HG23 VAL 143 HG23 VAL 143 13.888 1.156 4.452 1157 H ALA 144 H ALA 144 10.863 3.221 0.981 1158 HA ALA 144 HA ALA 144 12.542 4.992 -0.686 1159 HB1 ALA 144 HB1 ALA 144 10.854 4.731 -2.460 1160 HB2 ALA 144 HB2 ALA 144 11.647 3.168 -2.066 1161 HB3 ALA 144 HB3 ALA 144 9.992 3.513 -1.460 1162 H MET 145 H MET 145 12.110 7.111 -0.188 1163 HA MET 145 HA MET 145 9.512 7.709 1.060 1164 HB2 MET 145 HB2 MET 145 12.185 9.172 1.149 1165 HB3 MET 145 HB3 MET 145 10.681 9.771 1.862 1166 HG2 MET 145 HG2 MET 145 12.019 7.137 2.631 1167 HG3 MET 145 HG3 MET 145 12.258 8.665 3.487 1168 HE1 MET 145 HE1 MET 145 10.045 5.959 5.447 1169 HE2 MET 145 HE2 MET 145 11.699 6.298 4.835 1170 HE3 MET 145 HE3 MET 145 10.958 7.376 6.066 1171 H LEU 146 H LEU 146 8.150 9.287 0.117 1172 HA LEU 146 HA LEU 146 9.171 10.366 -2.423 1173 HB2 LEU 146 HB2 LEU 146 6.342 9.592 -1.593 1174 HB3 LEU 146 HB3 LEU 146 6.754 10.431 -3.094 1175 HG LEU 146 HG LEU 146 6.414 8.146 -3.634 1176 HD11 LEU 146 HD11 LEU 146 8.612 7.436 -4.514 1177 HD12 LEU 146 HD12 LEU 146 8.302 9.184 -4.789 1178 HD13 LEU 146 HD13 LEU 146 9.415 8.664 -3.478 1179 HD21 LEU 146 HD21 LEU 146 7.644 6.284 -2.573 1180 HD22 LEU 146 HD22 LEU 146 8.391 7.443 -1.422 1181 HD23 LEU 146 HD23 LEU 146 6.615 7.174 -1.401 1182 HA PRO 147 HA PRO 147 8.499 14.247 -0.167 1183 HB2 PRO 147 HB2 PRO 147 9.892 15.799 -1.989 1184 HB3 PRO 147 HB3 PRO 147 10.772 14.779 -0.843 1185 HG2 PRO 147 HG2 PRO 147 10.092 14.239 -3.748 1186 HG3 PRO 147 HG3 PRO 147 11.618 13.973 -2.896 1187 HD2 PRO 147 HD2 PRO 147 9.853 11.933 -3.373 1188 HD3 PRO 147 HD3 PRO 147 10.890 11.951 -1.941 1189 H ARG 148 H ARG 148 7.890 16.604 -1.252 1190 HA ARG 148 HA ARG 148 5.357 16.142 -2.352 1191 HB2 ARG 148 HB2 ARG 148 4.906 18.347 -2.111 1192 HB3 ARG 148 HB3 ARG 148 6.159 18.094 -0.888 1193 HG2 ARG 148 HG2 ARG 148 6.662 19.256 -3.666 1194 HG3 ARG 148 HG3 ARG 148 6.408 20.216 -2.202 1195 HD2 ARG 148 HD2 ARG 148 8.606 18.108 -2.463 1196 HD3 ARG 148 HD3 ARG 148 8.844 19.811 -2.876 1197 HE ARG 148 HE ARG 148 7.760 19.575 -0.220 1198 HH11 ARG 148 HH11 ARG 148 10.726 19.150 -2.054 1199 HH12 ARG 148 HH12 ARG 148 11.756 19.429 -0.690 1200 HH21 ARG 148 HH21 ARG 148 9.127 19.956 1.564 1201 HH22 ARG 148 HH22 ARG 148 10.846 19.888 1.367 1202 H GLN 149 H GLN 149 6.411 14.705 -4.107 1203 HA GLN 149 HA GLN 149 6.791 16.267 -6.503 1204 HB2 GLN 149 HB2 GLN 149 8.751 14.951 -5.750 1205 HB3 GLN 149 HB3 GLN 149 7.831 13.485 -6.115 1206 HG2 GLN 149 HG2 GLN 149 7.470 14.692 -8.475 1207 HG3 GLN 149 HG3 GLN 149 8.921 15.583 -7.996 1208 HE21 GLN 149 HE21 GLN 149 10.039 13.314 -6.406 1209 HE22 GLN 149 HE22 GLN 149 10.618 12.165 -7.566 1210 H GLU 150 H GLU 150 4.147 15.664 -5.420 1211 HA GLU 150 HA GLU 150 3.232 13.457 -7.043 1212 HB2 GLU 150 HB2 GLU 150 0.993 14.126 -6.021 1213 HB3 GLU 150 HB3 GLU 150 2.247 13.602 -4.889 1214 HG2 GLU 150 HG2 GLU 150 1.404 15.457 -3.789 1215 HG3 GLU 150 HG3 GLU 150 2.770 16.173 -4.655 1216 H GLU 151 H GLU 151 1.295 13.575 -8.436 1217 HA GLU 151 HA GLU 151 0.577 16.049 -9.623 1218 HB2 GLU 151 HB2 GLU 151 2.867 15.704 -10.618 1219 HB3 GLU 151 HB3 GLU 151 2.354 14.121 -11.216 1220 HG2 GLU 151 HG2 GLU 151 0.556 15.289 -12.571 1221 HG3 GLU 151 HG3 GLU 151 1.240 16.837 -12.058 1222 H CYS 152 H CYS 152 0.910 12.429 -10.102 1223 HA CYS 152 HA CYS 152 -1.645 12.537 -11.605 1224 HB2 CYS 152 HB2 CYS 152 0.299 11.132 -12.469 1225 HB3 CYS 152 HB3 CYS 152 0.379 10.280 -10.921 1226 H THR 153 H THR 153 -3.506 11.925 -10.519 1227 HA THR 153 HA THR 153 -3.219 10.629 -7.908 1228 HB THR 153 HB THR 153 -5.486 12.105 -7.549 1229 HG1 THR 153 HG1 THR 153 -5.055 14.258 -8.423 1230 HG21 THR 153 HG21 THR 153 -4.093 13.736 -6.299 1231 HG22 THR 153 HG22 THR 153 -3.534 12.049 -6.039 1232 HG23 THR 153 HG23 THR 153 -2.632 13.132 -7.151 1233 H VAL 154 H VAL 154 -4.922 9.192 -7.283 1234 HA VAL 154 HA VAL 154 -6.291 8.055 -9.543 1235 HB VAL 154 HB VAL 154 -5.162 6.644 -7.837 1236 HG11 VAL 154 HG11 VAL 154 -6.190 6.338 -5.610 1237 HG12 VAL 154 HG12 VAL 154 -5.568 8.006 -5.846 1238 HG13 VAL 154 HG13 VAL 154 -7.331 7.680 -5.959 1239 HG21 VAL 154 HG21 VAL 154 -7.005 5.024 -7.521 1240 HG22 VAL 154 HG22 VAL 154 -8.189 6.294 -7.980 1241 HG23 VAL 154 HG23 VAL 154 -6.985 5.713 -9.179 1242 H ASP 155 H ASP 155 -8.566 7.906 -9.802 1243 HA ASP 155 HA ASP 155 -10.049 10.101 -8.798 1244 HB2 ASP 155 HB2 ASP 155 -10.537 9.245 -11.002 1245 HB3 ASP 155 HB3 ASP 155 -10.722 7.591 -10.404 1246 H GLU 156 H GLU 156 -11.923 10.116 -7.399 1247 HA GLU 156 HA GLU 156 -11.951 7.803 -5.584 1248 HB2 GLU 156 HB2 GLU 156 -12.619 9.324 -3.813 1249 HB3 GLU 156 HB3 GLU 156 -11.114 9.888 -4.552 1250 HG2 GLU 156 HG2 GLU 156 -12.401 11.565 -5.878 1251 HG3 GLU 156 HG3 GLU 156 -13.899 11.006 -5.123 1252 H VAL 157 H VAL 157 -14.029 10.130 -7.445 1253 HA VAL 157 HA VAL 157 -16.039 8.207 -7.698 1254 HB VAL 157 HB VAL 157 -16.496 8.603 -5.332 1255 HG11 VAL 157 HG11 VAL 157 -17.244 10.806 -4.503 1256 HG12 VAL 157 HG12 VAL 157 -15.544 10.836 -5.081 1257 HG13 VAL 157 HG13 VAL 157 -16.851 11.531 -6.098 1258 HG21 VAL 157 HG21 VAL 157 -18.876 9.267 -5.495 1259 HG22 VAL 157 HG22 VAL 157 -18.578 9.893 -7.152 1260 HG23 VAL 157 HG23 VAL 157 -18.393 8.140 -6.808 1261 HN1 EB4 158 HN1 EB4 158 3.855 -6.040 -6.585 1262 H8 EB4 158 H8 EB4 158 -2.120 -6.955 -4.334 1263 HN2 EB4 158 HN2 EB4 158 1.459 -5.437 -8.327 1264 H9 EB4 158 H9 EB4 158 0.576 -0.489 -2.924 1265 H10 EB4 158 H10 EB4 158 4.545 -7.220 -0.817 1266 HN3 EB4 158 HN3 EB4 158 3.735 -2.949 -7.175 1267 H7 EB4 158 H7 EB4 158 2.909 -5.337 -0.898 1268 H11 EB4 158 H11 EB4 158 -3.447 -7.643 -6.316 1269 H12 EB4 158 H12 EB4 158 1.981 1.433 -3.579 1270 H15 EB4 158 H15 EB4 158 3.678 1.179 -5.371 1271 H14 EB4 158 H14 EB4 158 -2.609 -7.142 -8.597 1272 H13 EB4 158 H13 EB4 158 5.441 -8.151 -2.911 1273 H22 EB4 158 H22 EB4 158 4.747 -6.820 -6.902 1274 H30 EB4 158 H30 EB4 158 6.512 -3.664 -9.454 1275 H30A EB4 158 H30A EB4 158 6.617 -3.042 -7.731 1276 H24 EB4 158 H24 EB4 158 4.331 -2.193 -7.927 1277 H28 EB4 158 H28 EB4 158 3.847 -8.599 -8.471 1278 H28A EB4 158 H28A EB4 158 4.778 -7.755 -9.809 1279 H23 EB4 158 H23 EB4 158 1.183 -5.490 -9.525 1280 H29 EB4 158 H29 EB4 158 1.063 -3.480 -10.740 1281 H29A EB4 158 H29A EB4 158 2.607 -3.992 -11.681 Start of MODEL 11 1 H1 MET 1 H1 MET 1 -29.013 3.631 -4.174 2 H2 MET 1 H2 MET 1 -27.919 4.142 -3.075 3 H3 MET 1 H3 MET 1 -28.716 5.227 -3.998 4 HA MET 1 HA MET 1 -26.802 3.221 -4.947 5 HB2 MET 1 HB2 MET 1 -28.369 5.369 -6.443 6 HB3 MET 1 HB3 MET 1 -26.969 4.529 -7.121 7 HG2 MET 1 HG2 MET 1 -28.205 2.336 -6.733 8 HG3 MET 1 HG3 MET 1 -29.625 3.286 -6.277 9 HE1 MET 1 HE1 MET 1 -30.628 2.025 -9.857 10 HE2 MET 1 HE2 MET 1 -29.718 1.133 -8.592 11 HE3 MET 1 HE3 MET 1 -31.114 2.166 -8.134 12 H THR 2 H THR 2 -24.711 3.813 -4.460 13 HA THR 2 HA THR 2 -22.970 5.049 -3.862 14 HB THR 2 HB THR 2 -24.095 7.235 -5.671 15 HG1 THR 2 HG1 THR 2 -23.063 5.988 -7.406 16 HG21 THR 2 HG21 THR 2 -21.698 7.564 -6.206 17 HG22 THR 2 HG22 THR 2 -22.008 7.736 -4.445 18 HG23 THR 2 HG23 THR 2 -21.265 6.231 -5.083 19 H VAL 3 H VAL 3 -25.140 5.215 -1.991 20 HA VAL 3 HA VAL 3 -25.331 8.029 -1.294 21 HB VAL 3 HB VAL 3 -26.795 7.177 0.561 22 HG11 VAL 3 HG11 VAL 3 -28.681 6.537 -0.911 23 HG12 VAL 3 HG12 VAL 3 -27.747 7.918 -1.578 24 HG13 VAL 3 HG13 VAL 3 -27.529 6.272 -2.263 25 HG21 VAL 3 HG21 VAL 3 -27.573 4.833 0.478 26 HG22 VAL 3 HG22 VAL 3 -26.372 4.485 -0.811 27 HG23 VAL 3 HG23 VAL 3 -25.816 4.948 0.833 28 HA PRO 4 HA PRO 4 -22.053 7.785 1.714 29 HB2 PRO 4 HB2 PRO 4 -22.931 9.693 3.547 30 HB3 PRO 4 HB3 PRO 4 -22.353 10.180 1.948 31 HG2 PRO 4 HG2 PRO 4 -25.201 9.793 2.913 32 HG3 PRO 4 HG3 PRO 4 -24.527 11.101 1.931 33 HD2 PRO 4 HD2 PRO 4 -25.923 9.039 0.806 34 HD3 PRO 4 HD3 PRO 4 -24.597 9.832 -0.052 35 H ASP 5 H ASP 5 -23.398 5.511 2.022 36 HA ASP 5 HA ASP 5 -24.374 5.436 4.775 37 HB2 ASP 5 HB2 ASP 5 -24.653 3.792 2.313 38 HB3 ASP 5 HB3 ASP 5 -24.407 2.842 3.784 39 H ARG 6 H ARG 6 -22.449 3.000 2.958 40 HA ARG 6 HA ARG 6 -20.752 2.613 5.252 41 HB2 ARG 6 HB2 ARG 6 -21.218 1.044 2.758 42 HB3 ARG 6 HB3 ARG 6 -19.848 0.737 3.833 43 HG2 ARG 6 HG2 ARG 6 -21.692 -0.755 4.401 44 HG3 ARG 6 HG3 ARG 6 -21.407 0.371 5.735 45 HD2 ARG 6 HD2 ARG 6 -23.784 0.260 5.453 46 HD3 ARG 6 HD3 ARG 6 -23.284 1.828 4.806 47 HE ARG 6 HE ARG 6 -24.000 1.159 2.701 48 HH11 ARG 6 HH11 ARG 6 -23.722 -1.686 4.751 49 HH12 ARG 6 HH12 ARG 6 -24.424 -2.748 3.577 50 HH21 ARG 6 HH21 ARG 6 -24.937 -0.246 1.179 51 HH22 ARG 6 HH22 ARG 6 -25.115 -1.929 1.546 52 H SER 7 H SER 7 -20.679 4.586 2.454 53 HA SER 7 HA SER 7 -18.162 4.335 1.453 54 HB2 SER 7 HB2 SER 7 -19.073 7.155 1.995 55 HB3 SER 7 HB3 SER 7 -18.681 6.388 0.451 56 HG SER 7 HG SER 7 -20.821 6.427 0.208 57 H GLU 8 H GLU 8 -19.081 6.148 4.489 58 HA GLU 8 HA GLU 8 -16.629 7.381 4.913 59 HB2 GLU 8 HB2 GLU 8 -18.626 6.330 6.964 60 HB3 GLU 8 HB3 GLU 8 -17.334 7.494 7.284 61 HG2 GLU 8 HG2 GLU 8 -18.485 8.883 5.339 62 HG3 GLU 8 HG3 GLU 8 -19.884 7.860 5.692 63 H ILE 9 H ILE 9 -17.520 3.937 5.279 64 HA ILE 9 HA ILE 9 -15.459 3.331 7.117 65 HB ILE 9 HB ILE 9 -16.892 1.516 5.103 66 HG12 ILE 9 HG12 ILE 9 -17.569 2.108 8.026 67 HG13 ILE 9 HG13 ILE 9 -18.412 2.813 6.640 68 HG21 ILE 9 HG21 ILE 9 -16.311 -0.296 6.687 69 HG22 ILE 9 HG22 ILE 9 -14.848 0.509 6.026 70 HG23 ILE 9 HG23 ILE 9 -15.402 0.881 7.694 71 HD11 ILE 9 HD11 ILE 9 -19.664 0.915 7.565 72 HD12 ILE 9 HD12 ILE 9 -19.108 0.553 5.896 73 HD13 ILE 9 HD13 ILE 9 -18.252 -0.163 7.304 74 H ALA 10 H ALA 10 -15.468 3.884 3.604 75 HA ALA 10 HA ALA 10 -12.667 2.953 3.553 76 HB1 ALA 10 HB1 ALA 10 -13.069 2.217 1.219 77 HB2 ALA 10 HB2 ALA 10 -14.088 1.311 2.387 78 HB3 ALA 10 HB3 ALA 10 -14.809 2.623 1.396 79 H GLY 11 H GLY 11 -12.071 3.840 0.904 80 HA2 GLY 11 HA2 GLY 11 -12.906 6.220 0.009 81 HA3 GLY 11 HA3 GLY 11 -11.960 6.692 1.427 82 H LYS 12 H LYS 12 -10.370 7.779 0.092 83 HA LYS 12 HA LYS 12 -8.743 5.956 -1.558 84 HB2 LYS 12 HB2 LYS 12 -7.936 8.020 -2.660 85 HB3 LYS 12 HB3 LYS 12 -9.683 7.803 -2.834 86 HG2 LYS 12 HG2 LYS 12 -10.040 9.452 -0.961 87 HG3 LYS 12 HG3 LYS 12 -8.292 9.707 -0.883 88 HD2 LYS 12 HD2 LYS 12 -8.224 10.600 -3.136 89 HD3 LYS 12 HD3 LYS 12 -9.878 10.070 -3.471 90 HE2 LYS 12 HE2 LYS 12 -10.274 12.303 -3.003 91 HE3 LYS 12 HE3 LYS 12 -10.483 11.617 -1.386 92 HZ1 LYS 12 HZ1 LYS 12 -8.936 13.638 -1.796 93 HZ2 LYS 12 HZ2 LYS 12 -8.529 12.505 -0.693 94 HZ3 LYS 12 HZ3 LYS 12 -7.821 12.503 -2.165 95 H TRP 13 H TRP 13 -6.485 5.825 -1.184 96 HA TRP 13 HA TRP 13 -5.488 7.366 1.125 97 HB2 TRP 13 HB2 TRP 13 -4.799 4.458 0.523 98 HB3 TRP 13 HB3 TRP 13 -4.359 5.405 1.950 99 HD1 TRP 13 HD1 TRP 13 -6.753 2.827 0.942 100 HE1 TRP 13 HE1 TRP 13 -8.776 2.717 2.550 101 HE3 TRP 13 HE3 TRP 13 -6.102 7.312 3.363 102 HZ2 TRP 13 HZ2 TRP 13 -9.945 4.299 4.564 103 HZ3 TRP 13 HZ3 TRP 13 -7.725 7.953 5.128 104 HH2 TRP 13 HH2 TRP 13 -9.617 6.465 5.720 105 H TYR 14 H TYR 14 -3.378 8.197 0.828 106 HA TYR 14 HA TYR 14 -2.222 7.663 -1.829 107 HB2 TYR 14 HB2 TYR 14 -1.705 9.955 0.125 108 HB3 TYR 14 HB3 TYR 14 -1.070 9.808 -1.519 109 HD1 TYR 14 HD1 TYR 14 -4.326 9.992 0.366 110 HD2 TYR 14 HD2 TYR 14 -2.256 10.765 -3.317 111 HE1 TYR 14 HE1 TYR 14 -6.323 11.166 -0.506 112 HE2 TYR 14 HE2 TYR 14 -4.250 11.943 -4.191 113 HH TYR 14 HH TYR 14 -6.556 12.180 -3.872 114 H VAL 15 H VAL 15 -0.435 6.256 -1.936 115 HA VAL 15 HA VAL 15 0.890 5.708 0.665 116 HB VAL 15 HB VAL 15 0.303 3.862 -0.872 117 HG11 VAL 15 HG11 VAL 15 1.394 3.539 -3.063 118 HG12 VAL 15 HG12 VAL 15 0.312 4.972 -3.025 119 HG13 VAL 15 HG13 VAL 15 2.093 5.189 -2.943 120 HG21 VAL 15 HG21 VAL 15 2.550 2.799 -1.071 121 HG22 VAL 15 HG22 VAL 15 3.310 4.398 -0.770 122 HG23 VAL 15 HG23 VAL 15 2.316 3.621 0.508 123 H VAL 16 H VAL 16 2.314 7.146 1.326 124 HA VAL 16 HA VAL 16 3.894 8.616 -0.657 125 HB VAL 16 HB VAL 16 4.355 10.179 1.200 126 HG11 VAL 16 HG11 VAL 16 2.129 11.193 1.394 127 HG12 VAL 16 HG12 VAL 16 2.488 10.646 -0.279 128 HG13 VAL 16 HG13 VAL 16 1.409 9.669 0.773 129 HG21 VAL 16 HG21 VAL 16 3.118 10.044 3.325 130 HG22 VAL 16 HG22 VAL 16 2.459 8.455 2.811 131 HG23 VAL 16 HG23 VAL 16 4.222 8.647 3.091 132 H ALA 17 H ALA 17 4.146 5.766 1.001 133 HA ALA 17 HA ALA 17 7.042 6.049 1.210 134 HB1 ALA 17 HB1 ALA 17 7.201 5.251 3.419 135 HB2 ALA 17 HB2 ALA 17 5.916 6.504 3.490 136 HB3 ALA 17 HB3 ALA 17 5.493 4.783 3.457 137 H LEU 18 H LEU 18 8.136 3.901 1.246 138 HA LEU 18 HA LEU 18 6.462 1.621 0.639 139 HB2 LEU 18 HB2 LEU 18 8.481 2.768 -1.357 140 HB3 LEU 18 HB3 LEU 18 7.670 1.204 -1.510 141 HG LEU 18 HG LEU 18 6.117 3.812 -1.382 142 HD11 LEU 18 HD11 LEU 18 6.051 3.756 -3.855 143 HD12 LEU 18 HD12 LEU 18 7.721 3.984 -3.234 144 HD13 LEU 18 HD13 LEU 18 7.203 2.378 -3.849 145 HD21 LEU 18 HD21 LEU 18 4.401 2.475 -2.553 146 HD22 LEU 18 HD22 LEU 18 5.484 1.044 -2.496 147 HD23 LEU 18 HD23 LEU 18 4.851 1.752 -0.972 148 H ALA 19 H ALA 19 7.581 -0.399 0.892 149 HA ALA 19 HA ALA 19 10.478 -0.252 1.494 150 HB1 ALA 19 HB1 ALA 19 10.103 -1.619 3.515 151 HB2 ALA 19 HB2 ALA 19 9.286 -0.027 3.664 152 HB3 ALA 19 HB3 ALA 19 8.326 -1.497 3.284 153 H SER 20 H SER 20 11.508 -1.981 0.462 154 HA SER 20 HA SER 20 9.757 -4.254 -0.296 155 HB2 SER 20 HB2 SER 20 11.920 -2.933 -2.040 156 HB3 SER 20 HB3 SER 20 10.928 -4.329 -2.482 157 HG SER 20 HG SER 20 10.175 -2.202 -3.307 158 H ASN 21 H ASN 21 10.694 -6.297 -0.170 159 HA ASN 21 HA ASN 21 13.044 -6.426 1.515 160 HB2 ASN 21 HB2 ASN 21 10.783 -7.848 1.513 161 HB3 ASN 21 HB3 ASN 21 11.652 -8.823 0.320 162 HD21 ASN 21 HD21 ASN 21 14.311 -8.620 1.397 163 HD22 ASN 21 HD22 ASN 21 14.334 -9.491 2.893 164 H THR 22 H THR 22 12.268 -6.741 -1.983 165 HA THR 22 HA THR 22 14.961 -7.906 -2.395 166 HB THR 22 HB THR 22 13.965 -7.978 -4.817 167 HG1 THR 22 HG1 THR 22 11.965 -7.182 -4.939 168 HG21 THR 22 HG21 THR 22 12.827 -10.128 -4.304 169 HG22 THR 22 HG22 THR 22 14.362 -9.965 -3.385 170 HG23 THR 22 HG23 THR 22 12.790 -9.691 -2.562 171 H GLU 23 H GLU 23 16.670 -6.795 -3.085 172 HA GLU 23 HA GLU 23 16.651 -4.030 -3.148 173 HB2 GLU 23 HB2 GLU 23 18.799 -4.498 -4.680 174 HB3 GLU 23 HB3 GLU 23 18.784 -4.712 -2.925 175 HG2 GLU 23 HG2 GLU 23 18.139 -7.038 -4.768 176 HG3 GLU 23 HG3 GLU 23 19.816 -6.570 -4.456 177 H PHE 24 H PHE 24 16.111 -6.403 -5.850 178 HA PHE 24 HA PHE 24 16.311 -4.688 -7.996 179 HB2 PHE 24 HB2 PHE 24 14.428 -7.022 -7.414 180 HB3 PHE 24 HB3 PHE 24 14.461 -6.199 -8.979 181 HD1 PHE 24 HD1 PHE 24 16.368 -8.344 -6.645 182 HD2 PHE 24 HD2 PHE 24 16.297 -6.499 -10.521 183 HE1 PHE 24 HE1 PHE 24 18.242 -9.793 -7.366 184 HE2 PHE 24 HE2 PHE 24 18.170 -7.946 -11.248 185 HZ PHE 24 HZ PHE 24 19.146 -9.598 -9.671 186 H PHE 25 H PHE 25 13.337 -5.378 -5.954 187 HA PHE 25 HA PHE 25 11.674 -3.577 -7.311 188 HB2 PHE 25 HB2 PHE 25 11.686 -4.810 -4.532 189 HB3 PHE 25 HB3 PHE 25 10.457 -3.626 -4.995 190 HD1 PHE 25 HD1 PHE 25 12.061 -6.611 -6.662 191 HD2 PHE 25 HD2 PHE 25 8.443 -4.579 -5.561 192 HE1 PHE 25 HE1 PHE 25 10.730 -8.408 -7.727 193 HE2 PHE 25 HE2 PHE 25 7.108 -6.370 -6.623 194 HZ PHE 25 HZ PHE 25 8.247 -8.290 -7.713 195 H LEU 26 H LEU 26 13.828 -3.180 -4.404 196 HA LEU 26 HA LEU 26 13.064 -0.583 -3.728 197 HB2 LEU 26 HB2 LEU 26 15.838 -1.868 -3.587 198 HB3 LEU 26 HB3 LEU 26 15.261 -0.505 -2.620 199 HG LEU 26 HG LEU 26 14.062 -3.303 -2.491 200 HD11 LEU 26 HD11 LEU 26 15.311 -3.554 -0.378 201 HD12 LEU 26 HD12 LEU 26 16.407 -3.367 -1.788 202 HD13 LEU 26 HD13 LEU 26 16.128 -1.983 -0.678 203 HD21 LEU 26 HD21 LEU 26 13.094 -2.471 -0.372 204 HD22 LEU 26 HD22 LEU 26 13.819 -0.857 -0.680 205 HD23 LEU 26 HD23 LEU 26 12.554 -1.498 -1.782 206 H ARG 27 H ARG 27 15.676 -1.805 -5.951 207 HA ARG 27 HA ARG 27 16.776 0.660 -6.598 208 HB2 ARG 27 HB2 ARG 27 17.526 -1.781 -7.153 209 HB3 ARG 27 HB3 ARG 27 16.462 -1.646 -8.560 210 HG2 ARG 27 HG2 ARG 27 17.767 0.564 -9.079 211 HG3 ARG 27 HG3 ARG 27 18.961 -0.033 -7.918 212 HD2 ARG 27 HD2 ARG 27 19.731 -0.818 -10.023 213 HD3 ARG 27 HD3 ARG 27 18.985 -2.232 -9.266 214 HE ARG 27 HE ARG 27 16.912 -1.170 -10.713 215 HH11 ARG 27 HH11 ARG 27 20.221 -2.021 -11.553 216 HH12 ARG 27 HH12 ARG 27 19.828 -2.392 -13.198 217 HH21 ARG 27 HH21 ARG 27 16.420 -1.636 -12.849 218 HH22 ARG 27 HH22 ARG 27 17.657 -2.172 -13.938 219 H GLU 28 H GLU 28 14.062 -1.206 -8.219 220 HA GLU 28 HA GLU 28 13.670 0.790 -10.198 221 HB2 GLU 28 HB2 GLU 28 11.790 -1.389 -9.189 222 HB3 GLU 28 HB3 GLU 28 11.588 -0.445 -10.671 223 HG2 GLU 28 HG2 GLU 28 13.776 -2.473 -10.043 224 HG3 GLU 28 HG3 GLU 28 12.494 -2.608 -11.254 225 H LYS 29 H LYS 29 11.837 -0.036 -7.111 226 HA LYS 29 HA LYS 29 9.959 1.974 -7.383 227 HB2 LYS 29 HB2 LYS 29 11.040 0.311 -5.158 228 HB3 LYS 29 HB3 LYS 29 10.249 1.817 -4.674 229 HG2 LYS 29 HG2 LYS 29 8.947 -0.205 -6.557 230 HG3 LYS 29 HG3 LYS 29 8.768 -0.273 -4.798 231 HD2 LYS 29 HD2 LYS 29 6.864 0.945 -5.540 232 HD3 LYS 29 HD3 LYS 29 7.963 2.182 -4.916 233 HE2 LYS 29 HE2 LYS 29 7.475 3.191 -6.922 234 HE3 LYS 29 HE3 LYS 29 8.813 2.181 -7.486 235 HZ1 LYS 29 HZ1 LYS 29 6.301 2.161 -8.473 236 HZ2 LYS 29 HZ2 LYS 29 7.422 1.001 -8.726 237 HZ3 LYS 29 HZ3 LYS 29 6.309 0.817 -7.546 238 H ASP 30 H ASP 30 13.249 2.146 -5.786 239 HA ASP 30 HA ASP 30 12.999 4.718 -4.783 240 HB2 ASP 30 HB2 ASP 30 14.902 3.479 -4.117 241 HB3 ASP 30 HB3 ASP 30 15.324 3.030 -5.775 242 H LYS 31 H LYS 31 13.481 3.590 -8.163 243 HA LYS 31 HA LYS 31 14.227 6.231 -9.028 244 HB2 LYS 31 HB2 LYS 31 13.755 3.574 -10.393 245 HB3 LYS 31 HB3 LYS 31 13.852 5.066 -11.338 246 HG2 LYS 31 HG2 LYS 31 16.001 3.843 -9.552 247 HG3 LYS 31 HG3 LYS 31 16.053 4.085 -11.303 248 HD2 LYS 31 HD2 LYS 31 17.347 5.886 -10.524 249 HD3 LYS 31 HD3 LYS 31 15.763 6.642 -10.742 250 HE2 LYS 31 HE2 LYS 31 16.003 5.426 -8.073 251 HE3 LYS 31 HE3 LYS 31 17.319 6.569 -8.374 252 HZ1 LYS 31 HZ1 LYS 31 15.910 8.231 -8.127 253 HZ2 LYS 31 HZ2 LYS 31 14.850 7.643 -9.221 254 HZ3 LYS 31 HZ3 LYS 31 14.754 7.176 -7.659 255 H MET 32 H MET 32 10.987 4.496 -8.448 256 HA MET 32 HA MET 32 10.099 6.465 -10.508 257 HB2 MET 32 HB2 MET 32 8.788 4.305 -8.480 258 HB3 MET 32 HB3 MET 32 7.790 5.134 -9.682 259 HG2 MET 32 HG2 MET 32 10.169 3.381 -10.475 260 HG3 MET 32 HG3 MET 32 8.551 2.714 -10.223 261 HE1 MET 32 HE1 MET 32 10.227 5.182 -13.621 262 HE2 MET 32 HE2 MET 32 9.525 6.309 -12.411 263 HE3 MET 32 HE3 MET 32 10.785 5.129 -11.915 264 H LYS 33 H LYS 33 7.357 6.424 -8.674 265 HA LYS 33 HA LYS 33 8.266 8.729 -7.031 266 HB2 LYS 33 HB2 LYS 33 6.130 8.980 -9.173 267 HB3 LYS 33 HB3 LYS 33 6.271 10.083 -7.799 268 HG2 LYS 33 HG2 LYS 33 8.334 10.966 -8.549 269 HG3 LYS 33 HG3 LYS 33 8.658 9.587 -9.607 270 HD2 LYS 33 HD2 LYS 33 6.864 10.250 -11.137 271 HD3 LYS 33 HD3 LYS 33 6.313 11.511 -10.026 272 HE2 LYS 33 HE2 LYS 33 8.310 12.822 -10.356 273 HE3 LYS 33 HE3 LYS 33 9.151 11.484 -11.151 274 HZ1 LYS 33 HZ1 LYS 33 8.345 13.086 -12.734 275 HZ2 LYS 33 HZ2 LYS 33 7.577 11.664 -12.968 276 HZ3 LYS 33 HZ3 LYS 33 6.801 12.899 -12.235 277 H MET 34 H MET 34 5.793 9.521 -5.970 278 HA MET 34 HA MET 34 5.148 7.302 -4.306 279 HB2 MET 34 HB2 MET 34 4.940 9.616 -3.499 280 HB3 MET 34 HB3 MET 34 3.955 10.086 -4.891 281 HG2 MET 34 HG2 MET 34 2.112 8.601 -4.051 282 HG3 MET 34 HG3 MET 34 3.096 8.216 -2.633 283 HE1 MET 34 HE1 MET 34 1.308 12.394 -3.596 284 HE2 MET 34 HE2 MET 34 2.810 11.849 -4.417 285 HE3 MET 34 HE3 MET 34 1.272 10.955 -4.670 286 H ALA 35 H ALA 35 3.087 6.202 -4.186 287 HA ALA 35 HA ALA 35 1.711 5.993 -6.754 288 HB1 ALA 35 HB1 ALA 35 1.159 3.693 -6.109 289 HB2 ALA 35 HB2 ALA 35 2.926 3.984 -6.243 290 HB3 ALA 35 HB3 ALA 35 2.152 3.887 -4.625 291 H MET 36 H MET 36 -0.593 4.765 -6.242 292 HA MET 36 HA MET 36 -1.854 6.349 -4.105 293 HB2 MET 36 HB2 MET 36 -2.880 5.688 -6.898 294 HB3 MET 36 HB3 MET 36 -3.858 6.437 -5.662 295 HG2 MET 36 HG2 MET 36 -1.243 7.712 -6.483 296 HG3 MET 36 HG3 MET 36 -2.652 7.870 -7.541 297 HE1 MET 36 HE1 MET 36 -1.902 11.166 -5.161 298 HE2 MET 36 HE2 MET 36 -0.777 9.942 -5.840 299 HE3 MET 36 HE3 MET 36 -2.008 10.713 -6.895 300 H ALA 37 H ALA 37 -4.086 5.389 -3.465 301 HA ALA 37 HA ALA 37 -4.569 2.591 -4.161 302 HB1 ALA 37 HB1 ALA 37 -4.251 1.840 -1.794 303 HB2 ALA 37 HB2 ALA 37 -2.703 2.453 -2.468 304 HB3 ALA 37 HB3 ALA 37 -3.663 3.477 -1.347 305 H ARG 38 H ARG 38 -6.705 2.414 -4.283 306 HA ARG 38 HA ARG 38 -8.386 3.955 -2.382 307 HB2 ARG 38 HB2 ARG 38 -8.459 5.099 -4.536 308 HB3 ARG 38 HB3 ARG 38 -8.791 3.578 -5.376 309 HG2 ARG 38 HG2 ARG 38 -10.716 4.139 -3.194 310 HG3 ARG 38 HG3 ARG 38 -10.693 5.393 -4.441 311 HD2 ARG 38 HD2 ARG 38 -10.812 3.448 -6.167 312 HD3 ARG 38 HD3 ARG 38 -11.211 2.404 -4.796 313 HE ARG 38 HE ARG 38 -13.338 3.327 -4.757 314 HH11 ARG 38 HH11 ARG 38 -11.243 5.397 -6.683 315 HH12 ARG 38 HH12 ARG 38 -12.523 6.469 -7.143 316 HH21 ARG 38 HH21 ARG 38 -14.999 4.762 -5.346 317 HH22 ARG 38 HH22 ARG 38 -14.657 6.107 -6.383 318 H ILE 39 H ILE 39 -9.749 2.483 -1.316 319 HA ILE 39 HA ILE 39 -9.842 -0.194 -2.429 320 HB ILE 39 HB ILE 39 -10.472 0.509 0.452 321 HG12 ILE 39 HG12 ILE 39 -8.252 1.378 0.089 322 HG13 ILE 39 HG13 ILE 39 -8.152 -0.109 1.041 323 HG21 ILE 39 HG21 ILE 39 -9.844 -1.857 0.845 324 HG22 ILE 39 HG22 ILE 39 -11.201 -1.698 -0.320 325 HG23 ILE 39 HG23 ILE 39 -9.546 -2.060 -0.915 326 HD11 ILE 39 HD11 ILE 39 -6.370 -0.015 -0.642 327 HD12 ILE 39 HD12 ILE 39 -7.491 -1.376 -0.983 328 HD13 ILE 39 HD13 ILE 39 -7.592 0.134 -1.950 329 H SER 40 H SER 40 -11.909 -1.437 -2.232 330 HA SER 40 HA SER 40 -14.258 0.140 -1.469 331 HB2 SER 40 HB2 SER 40 -13.871 -1.229 -4.181 332 HB3 SER 40 HB3 SER 40 -15.380 -0.514 -3.599 333 HG SER 40 HG SER 40 -13.424 1.343 -3.280 334 H PHE 41 H PHE 41 -15.868 -1.085 -0.475 335 HA PHE 41 HA PHE 41 -15.128 -3.831 0.083 336 HB2 PHE 41 HB2 PHE 41 -17.170 -3.762 1.533 337 HB3 PHE 41 HB3 PHE 41 -15.954 -2.539 1.924 338 HD1 PHE 41 HD1 PHE 41 -16.372 -0.151 1.456 339 HD2 PHE 41 HD2 PHE 41 -19.362 -3.141 0.713 340 HE1 PHE 41 HE1 PHE 41 -18.104 1.616 1.324 341 HE2 PHE 41 HE2 PHE 41 -21.097 -1.380 0.585 342 HZ PHE 41 HZ PHE 41 -20.470 1.003 0.890 343 H LEU 42 H LEU 42 -15.473 -5.340 -1.458 344 HA LEU 42 HA LEU 42 -17.599 -5.110 -3.364 345 HB2 LEU 42 HB2 LEU 42 -15.301 -6.220 -3.648 346 HB3 LEU 42 HB3 LEU 42 -15.917 -7.550 -2.659 347 HG LEU 42 HG LEU 42 -15.976 -8.011 -5.090 348 HD11 LEU 42 HD11 LEU 42 -18.294 -8.862 -5.184 349 HD12 LEU 42 HD12 LEU 42 -17.519 -9.178 -3.595 350 HD13 LEU 42 HD13 LEU 42 -18.716 -7.850 -3.762 351 HD21 LEU 42 HD21 LEU 42 -17.665 -6.895 -6.513 352 HD22 LEU 42 HD22 LEU 42 -18.049 -5.773 -5.163 353 HD23 LEU 42 HD23 LEU 42 -16.418 -5.748 -5.915 354 H GLY 43 H GLY 43 -17.010 -6.927 -0.298 355 HA2 GLY 43 HA2 GLY 43 -19.820 -7.382 0.059 356 HA3 GLY 43 HA3 GLY 43 -18.933 -8.844 -0.393 357 H GLU 44 H GLU 44 -19.973 -9.098 2.052 358 HA GLU 44 HA GLU 44 -18.628 -7.936 4.193 359 HB2 GLU 44 HB2 GLU 44 -19.767 -10.764 4.016 360 HB3 GLU 44 HB3 GLU 44 -19.499 -9.819 5.486 361 HG2 GLU 44 HG2 GLU 44 -21.177 -8.154 4.756 362 HG3 GLU 44 HG3 GLU 44 -21.408 -9.024 3.233 363 H ASP 45 H ASP 45 -17.714 -10.806 2.173 364 HA ASP 45 HA ASP 45 -15.178 -10.893 3.688 365 HB2 ASP 45 HB2 ASP 45 -16.471 -12.964 3.950 366 HB3 ASP 45 HB3 ASP 45 -16.768 -13.058 2.209 367 H GLU 46 H GLU 46 -16.434 -9.583 0.885 368 HA GLU 46 HA GLU 46 -14.043 -10.360 -0.695 369 HB2 GLU 46 HB2 GLU 46 -16.465 -10.979 -1.513 370 HB3 GLU 46 HB3 GLU 46 -16.699 -9.241 -1.742 371 HG2 GLU 46 HG2 GLU 46 -16.078 -10.091 -3.870 372 HG3 GLU 46 HG3 GLU 46 -14.645 -9.256 -3.255 373 H LEU 47 H LEU 47 -12.781 -8.622 -1.450 374 HA LEU 47 HA LEU 47 -13.806 -5.936 -1.056 375 HB2 LEU 47 HB2 LEU 47 -11.595 -5.263 -0.054 376 HB3 LEU 47 HB3 LEU 47 -12.700 -6.171 0.987 377 HG LEU 47 HG LEU 47 -10.606 -7.721 -0.513 378 HD11 LEU 47 HD11 LEU 47 -8.948 -7.260 1.261 379 HD12 LEU 47 HD12 LEU 47 -9.358 -5.780 0.330 380 HD13 LEU 47 HD13 LEU 47 -10.051 -6.031 1.968 381 HD21 LEU 47 HD21 LEU 47 -10.632 -9.036 1.586 382 HD22 LEU 47 HD22 LEU 47 -11.793 -7.866 2.299 383 HD23 LEU 47 HD23 LEU 47 -12.278 -8.864 0.887 384 H LYS 48 H LYS 48 -12.795 -4.322 -2.360 385 HA LYS 48 HA LYS 48 -11.055 -5.403 -4.450 386 HB2 LYS 48 HB2 LYS 48 -13.303 -5.102 -5.332 387 HB3 LYS 48 HB3 LYS 48 -13.361 -3.444 -4.719 388 HG2 LYS 48 HG2 LYS 48 -11.425 -2.859 -6.227 389 HG3 LYS 48 HG3 LYS 48 -11.476 -4.501 -6.884 390 HD2 LYS 48 HD2 LYS 48 -13.926 -2.675 -6.881 391 HD3 LYS 48 HD3 LYS 48 -12.738 -2.651 -8.191 392 HE2 LYS 48 HE2 LYS 48 -14.156 -5.198 -7.263 393 HE3 LYS 48 HE3 LYS 48 -14.779 -4.158 -8.551 394 HZ1 LYS 48 HZ1 LYS 48 -13.513 -5.824 -9.563 395 HZ2 LYS 48 HZ2 LYS 48 -12.567 -4.496 -9.641 396 HZ3 LYS 48 HZ3 LYS 48 -12.251 -5.661 -8.541 397 H VAL 49 H VAL 49 -9.320 -4.018 -5.143 398 HA VAL 49 HA VAL 49 -9.222 -1.417 -3.792 399 HB VAL 49 HB VAL 49 -6.832 -1.764 -3.307 400 HG11 VAL 49 HG11 VAL 49 -7.071 -3.424 -1.482 401 HG12 VAL 49 HG12 VAL 49 -8.483 -2.317 -1.572 402 HG13 VAL 49 HG13 VAL 49 -8.612 -3.991 -2.209 403 HG21 VAL 49 HG21 VAL 49 -5.806 -4.000 -3.516 404 HG22 VAL 49 HG22 VAL 49 -7.290 -4.600 -4.331 405 HG23 VAL 49 HG23 VAL 49 -6.288 -3.329 -5.110 406 H SER 50 H SER 50 -8.292 0.262 -5.027 407 HA SER 50 HA SER 50 -7.572 -0.490 -7.793 408 HB2 SER 50 HB2 SER 50 -9.615 1.051 -7.200 409 HB3 SER 50 HB3 SER 50 -8.394 2.269 -6.806 410 HG SER 50 HG SER 50 -9.095 2.403 -9.027 411 H TYR 51 H TYR 51 -5.475 -0.237 -8.380 412 HA TYR 51 HA TYR 51 -3.687 1.182 -6.533 413 HB2 TYR 51 HB2 TYR 51 -3.572 -0.982 -8.675 414 HB3 TYR 51 HB3 TYR 51 -2.135 0.035 -8.500 415 HD1 TYR 51 HD1 TYR 51 -1.663 0.385 -5.718 416 HD2 TYR 51 HD2 TYR 51 -3.279 -3.046 -7.729 417 HE1 TYR 51 HE1 TYR 51 -0.780 -1.078 -3.931 418 HE2 TYR 51 HE2 TYR 51 -2.439 -4.506 -5.919 419 HH TYR 51 HH TYR 51 -0.089 -3.904 -4.059 420 H ALA 52 H ALA 52 -2.501 3.024 -7.261 421 HA ALA 52 HA ALA 52 -2.758 3.686 -10.131 422 HB1 ALA 52 HB1 ALA 52 -3.252 5.969 -9.637 423 HB2 ALA 52 HB2 ALA 52 -4.436 4.964 -8.734 424 HB3 ALA 52 HB3 ALA 52 -3.054 5.691 -7.898 425 H VAL 53 H VAL 53 -0.657 3.690 -10.910 426 HA VAL 53 HA VAL 53 1.323 4.940 -9.162 427 HB VAL 53 HB VAL 53 3.015 3.259 -9.955 428 HG11 VAL 53 HG11 VAL 53 2.289 1.446 -8.433 429 HG12 VAL 53 HG12 VAL 53 1.998 3.073 -7.731 430 HG13 VAL 53 HG13 VAL 53 0.630 2.133 -8.417 431 HG21 VAL 53 HG21 VAL 53 2.221 1.103 -10.867 432 HG22 VAL 53 HG22 VAL 53 0.556 1.768 -10.974 433 HG23 VAL 53 HG23 VAL 53 1.871 2.475 -11.973 434 HA PRO 54 HA PRO 54 2.175 7.029 -13.053 435 HB2 PRO 54 HB2 PRO 54 4.238 8.605 -12.123 436 HB3 PRO 54 HB3 PRO 54 2.595 8.910 -11.545 437 HG2 PRO 54 HG2 PRO 54 4.856 7.427 -10.184 438 HG3 PRO 54 HG3 PRO 54 3.692 8.564 -9.491 439 HD2 PRO 54 HD2 PRO 54 3.451 5.807 -9.279 440 HD3 PRO 54 HD3 PRO 54 2.076 6.915 -9.183 441 H LYS 55 H LYS 55 2.876 5.352 -14.340 442 HA LYS 55 HA LYS 55 5.613 4.456 -14.026 443 HB2 LYS 55 HB2 LYS 55 3.706 2.821 -14.351 444 HB3 LYS 55 HB3 LYS 55 3.504 3.468 -15.984 445 HG2 LYS 55 HG2 LYS 55 5.885 2.815 -16.503 446 HG3 LYS 55 HG3 LYS 55 6.016 2.100 -14.891 447 HD2 LYS 55 HD2 LYS 55 4.144 0.544 -15.404 448 HD3 LYS 55 HD3 LYS 55 3.943 1.285 -16.997 449 HE2 LYS 55 HE2 LYS 55 5.245 -0.635 -17.445 450 HE3 LYS 55 HE3 LYS 55 6.434 0.674 -17.420 451 HZ1 LYS 55 HZ1 LYS 55 7.172 -1.216 -16.154 452 HZ2 LYS 55 HZ2 LYS 55 6.965 0.056 -15.151 453 HZ3 LYS 55 HZ3 LYS 55 5.867 -1.153 -15.174 454 HA PRO 56 HA PRO 56 7.297 7.119 -17.183 455 HB2 PRO 56 HB2 PRO 56 8.315 4.474 -18.387 456 HB3 PRO 56 HB3 PRO 56 9.245 5.942 -18.060 457 HG2 PRO 56 HG2 PRO 56 9.469 3.854 -16.417 458 HG3 PRO 56 HG3 PRO 56 9.412 5.489 -15.747 459 HD2 PRO 56 HD2 PRO 56 7.257 3.368 -15.780 460 HD3 PRO 56 HD3 PRO 56 7.614 4.577 -14.540 461 H ASN 57 H ASN 57 5.370 4.247 -18.127 462 HA ASN 57 HA ASN 57 5.025 5.411 -20.777 463 HB2 ASN 57 HB2 ASN 57 3.866 2.863 -19.526 464 HB3 ASN 57 HB3 ASN 57 3.731 3.335 -21.225 465 HD21 ASN 57 HD21 ASN 57 5.552 3.149 -22.601 466 HD22 ASN 57 HD22 ASN 57 6.966 2.259 -22.146 467 H GLY 58 H GLY 58 3.790 6.342 -17.884 468 HA2 GLY 58 HA2 GLY 58 1.951 7.934 -18.141 469 HA3 GLY 58 HA3 GLY 58 1.067 6.667 -19.002 470 H CYS 59 H CYS 59 -0.126 7.869 -16.753 471 HA CYS 59 HA CYS 59 0.412 6.629 -14.308 472 HB2 CYS 59 HB2 CYS 59 -2.139 7.785 -15.511 473 HB3 CYS 59 HB3 CYS 59 -2.020 7.218 -13.840 474 H ARG 60 H ARG 60 0.391 4.438 -13.863 475 HA ARG 60 HA ARG 60 -1.514 2.805 -15.429 476 HB2 ARG 60 HB2 ARG 60 0.923 2.238 -15.535 477 HB3 ARG 60 HB3 ARG 60 0.964 2.080 -13.774 478 HG2 ARG 60 HG2 ARG 60 0.839 -0.129 -14.826 479 HG3 ARG 60 HG3 ARG 60 -0.624 0.181 -13.882 480 HD2 ARG 60 HD2 ARG 60 -0.869 1.116 -16.679 481 HD3 ARG 60 HD3 ARG 60 -0.507 -0.613 -16.577 482 HE ARG 60 HE ARG 60 -2.542 -0.209 -14.717 483 HH11 ARG 60 HH11 ARG 60 -2.158 0.342 -18.175 484 HH12 ARG 60 HH12 ARG 60 -3.843 0.127 -18.514 485 HH21 ARG 60 HH21 ARG 60 -4.735 -0.490 -15.180 486 HH22 ARG 60 HH22 ARG 60 -5.311 -0.347 -16.808 487 H LYS 61 H LYS 61 -3.308 2.047 -14.446 488 HA LYS 61 HA LYS 61 -3.304 1.989 -11.494 489 HB2 LYS 61 HB2 LYS 61 -5.510 2.696 -11.447 490 HB3 LYS 61 HB3 LYS 61 -4.796 3.716 -12.703 491 HG2 LYS 61 HG2 LYS 61 -5.738 2.195 -14.455 492 HG3 LYS 61 HG3 LYS 61 -6.476 1.207 -13.186 493 HD2 LYS 61 HD2 LYS 61 -7.586 3.428 -12.364 494 HD3 LYS 61 HD3 LYS 61 -7.103 4.099 -13.927 495 HE2 LYS 61 HE2 LYS 61 -9.285 3.312 -14.339 496 HE3 LYS 61 HE3 LYS 61 -8.264 2.019 -14.983 497 HZ1 LYS 61 HZ1 LYS 61 -10.137 1.314 -13.527 498 HZ2 LYS 61 HZ2 LYS 61 -8.680 0.722 -13.087 499 HZ3 LYS 61 HZ3 LYS 61 -9.348 1.953 -12.248 500 H TRP 62 H TRP 62 -4.662 0.203 -10.563 501 HA TRP 62 HA TRP 62 -5.456 -1.917 -12.387 502 HB2 TRP 62 HB2 TRP 62 -2.879 -2.061 -11.827 503 HB3 TRP 62 HB3 TRP 62 -3.432 -2.585 -10.231 504 HD1 TRP 62 HD1 TRP 62 -3.449 -5.155 -10.056 505 HE1 TRP 62 HE1 TRP 62 -3.935 -7.129 -11.656 506 HE3 TRP 62 HE3 TRP 62 -4.551 -2.491 -14.309 507 HZ2 TRP 62 HZ2 TRP 62 -4.691 -7.519 -14.341 508 HZ3 TRP 62 HZ3 TRP 62 -5.150 -3.742 -16.370 509 HH2 TRP 62 HH2 TRP 62 -5.221 -6.217 -16.380 510 H GLU 63 H GLU 63 -6.926 -3.424 -11.337 511 HA GLU 63 HA GLU 63 -7.595 -2.541 -8.588 512 HB2 GLU 63 HB2 GLU 63 -9.995 -3.479 -9.488 513 HB3 GLU 63 HB3 GLU 63 -9.536 -1.772 -9.546 514 HG2 GLU 63 HG2 GLU 63 -8.703 -3.305 -11.946 515 HG3 GLU 63 HG3 GLU 63 -10.451 -3.293 -11.681 516 H THR 64 H THR 64 -7.623 -4.227 -7.156 517 HA THR 64 HA THR 64 -7.810 -6.922 -8.265 518 HB THR 64 HB THR 64 -6.276 -7.195 -5.935 519 HG1 THR 64 HG1 THR 64 -5.042 -5.472 -5.732 520 HG21 THR 64 HG21 THR 64 -4.470 -7.836 -7.531 521 HG22 THR 64 HG22 THR 64 -6.065 -8.497 -8.026 522 HG23 THR 64 HG23 THR 64 -5.388 -7.060 -8.865 523 H THR 65 H THR 65 -8.744 -8.541 -6.831 524 HA THR 65 HA THR 65 -10.376 -7.379 -4.677 525 HB THR 65 HB THR 65 -10.898 -10.044 -5.975 526 HG1 THR 65 HG1 THR 65 -12.210 -8.849 -7.561 527 HG21 THR 65 HG21 THR 65 -13.239 -9.419 -5.478 528 HG22 THR 65 HG22 THR 65 -12.210 -9.360 -4.008 529 HG23 THR 65 HG23 THR 65 -12.678 -7.838 -4.837 530 H PHE 66 H PHE 66 -10.299 -8.271 -2.573 531 HA PHE 66 HA PHE 66 -8.505 -10.585 -2.278 532 HB2 PHE 66 HB2 PHE 66 -8.612 -8.206 -0.370 533 HB3 PHE 66 HB3 PHE 66 -7.503 -9.582 -0.314 534 HD1 PHE 66 HD1 PHE 66 -6.621 -9.786 -3.143 535 HD2 PHE 66 HD2 PHE 66 -7.266 -6.338 -0.670 536 HE1 PHE 66 HE1 PHE 66 -4.982 -8.516 -4.495 537 HE2 PHE 66 HE2 PHE 66 -5.629 -5.061 -2.018 538 HZ PHE 66 HZ PHE 66 -4.480 -6.148 -3.934 539 H LYS 67 H LYS 67 -8.752 -11.460 0.150 540 HA LYS 67 HA LYS 67 -11.640 -11.453 0.731 541 HB2 LYS 67 HB2 LYS 67 -9.532 -13.616 0.657 542 HB3 LYS 67 HB3 LYS 67 -10.815 -13.746 1.867 543 HG2 LYS 67 HG2 LYS 67 -11.404 -15.008 -0.148 544 HG3 LYS 67 HG3 LYS 67 -12.535 -13.670 0.091 545 HD2 LYS 67 HD2 LYS 67 -11.364 -12.312 -1.597 546 HD3 LYS 67 HD3 LYS 67 -10.105 -13.543 -1.767 547 HE2 LYS 67 HE2 LYS 67 -11.657 -15.141 -2.713 548 HE3 LYS 67 HE3 LYS 67 -13.056 -14.155 -2.267 549 HZ1 LYS 67 HZ1 LYS 67 -12.494 -13.924 -4.584 550 HZ2 LYS 67 HZ2 LYS 67 -12.305 -12.490 -3.826 551 HZ3 LYS 67 HZ3 LYS 67 -10.996 -13.380 -4.227 552 H LYS 68 H LYS 68 -12.299 -11.500 2.962 553 HA LYS 68 HA LYS 68 -10.740 -9.905 4.650 554 HB2 LYS 68 HB2 LYS 68 -13.195 -10.040 4.786 555 HB3 LYS 68 HB3 LYS 68 -13.118 -11.762 5.185 556 HG2 LYS 68 HG2 LYS 68 -13.516 -10.698 7.255 557 HG3 LYS 68 HG3 LYS 68 -11.788 -11.074 7.289 558 HD2 LYS 68 HD2 LYS 68 -11.941 -8.827 8.066 559 HD3 LYS 68 HD3 LYS 68 -11.373 -8.692 6.396 560 HE2 LYS 68 HE2 LYS 68 -13.648 -8.177 5.607 561 HE3 LYS 68 HE3 LYS 68 -14.314 -8.467 7.219 562 HZ1 LYS 68 HZ1 LYS 68 -14.035 -6.160 6.941 563 HZ2 LYS 68 HZ2 LYS 68 -12.866 -6.619 7.984 564 HZ3 LYS 68 HZ3 LYS 68 -12.491 -6.294 6.428 565 H THR 69 H THR 69 -8.945 -10.400 5.928 566 HA THR 69 HA THR 69 -8.930 -13.133 7.157 567 HB THR 69 HB THR 69 -6.424 -11.718 6.036 568 HG1 THR 69 HG1 THR 69 -7.648 -13.751 4.429 569 HG21 THR 69 HG21 THR 69 -5.567 -14.049 5.896 570 HG22 THR 69 HG22 THR 69 -6.157 -13.660 7.547 571 HG23 THR 69 HG23 THR 69 -7.163 -14.662 6.447 572 H SER 70 H SER 70 -9.711 -11.810 8.996 573 HA SER 70 HA SER 70 -8.127 -9.629 9.992 574 HB2 SER 70 HB2 SER 70 -10.195 -11.252 11.532 575 HB3 SER 70 HB3 SER 70 -9.717 -9.566 11.773 576 HG SER 70 HG SER 70 -11.751 -9.756 10.634 577 H ASP 71 H ASP 71 -6.126 -11.324 9.657 578 HA ASP 71 HA ASP 71 -5.717 -13.324 11.572 579 HB2 ASP 71 HB2 ASP 71 -4.418 -12.820 9.407 580 HB3 ASP 71 HB3 ASP 71 -3.597 -11.531 10.299 581 H ASP 72 H ASP 72 -4.345 -9.931 11.483 582 HA ASP 72 HA ASP 72 -4.403 -9.976 14.441 583 HB2 ASP 72 HB2 ASP 72 -2.088 -10.141 13.149 584 HB3 ASP 72 HB3 ASP 72 -2.365 -8.430 12.798 585 H GLY 73 H GLY 73 -6.419 -8.982 14.134 586 HA2 GLY 73 HA2 GLY 73 -7.881 -7.527 14.440 587 HA3 GLY 73 HA3 GLY 73 -6.673 -6.250 14.244 588 H GLU 74 H GLU 74 -6.118 -5.852 11.502 589 HA GLU 74 HA GLU 74 -8.672 -6.518 10.130 590 HB2 GLU 74 HB2 GLU 74 -7.486 -3.734 10.028 591 HB3 GLU 74 HB3 GLU 74 -8.812 -4.350 9.032 592 HG2 GLU 74 HG2 GLU 74 -10.018 -4.877 11.266 593 HG3 GLU 74 HG3 GLU 74 -8.782 -3.872 12.035 594 H VAL 75 H VAL 75 -6.756 -8.198 9.652 595 HA VAL 75 HA VAL 75 -4.866 -7.131 7.678 596 HB VAL 75 HB VAL 75 -5.176 -9.828 9.105 597 HG11 VAL 75 HG11 VAL 75 -3.066 -10.521 8.026 598 HG12 VAL 75 HG12 VAL 75 -4.381 -10.251 6.834 599 HG13 VAL 75 HG13 VAL 75 -3.087 -9.023 7.036 600 HG21 VAL 75 HG21 VAL 75 -2.977 -9.224 10.101 601 HG22 VAL 75 HG22 VAL 75 -3.017 -7.663 9.214 602 HG23 VAL 75 HG23 VAL 75 -4.244 -8.008 10.480 603 H TYR 76 H TYR 76 -4.606 -8.455 5.584 604 HA TYR 76 HA TYR 76 -7.028 -9.896 4.810 605 HB2 TYR 76 HB2 TYR 76 -5.918 -7.398 3.459 606 HB3 TYR 76 HB3 TYR 76 -6.926 -8.568 2.598 607 HD1 TYR 76 HD1 TYR 76 -9.296 -8.929 3.283 608 HD2 TYR 76 HD2 TYR 76 -6.869 -5.900 5.120 609 HE1 TYR 76 HE1 TYR 76 -11.331 -7.852 4.187 610 HE2 TYR 76 HE2 TYR 76 -8.904 -4.818 6.026 611 HH TYR 76 HH TYR 76 -11.115 -4.872 6.190 612 H TYR 77 H TYR 77 -6.743 -11.301 2.941 613 HA TYR 77 HA TYR 77 -3.932 -11.660 2.174 614 HB2 TYR 77 HB2 TYR 77 -5.827 -13.630 3.470 615 HB3 TYR 77 HB3 TYR 77 -4.721 -14.228 2.226 616 HD1 TYR 77 HD1 TYR 77 -4.468 -11.876 5.184 617 HD2 TYR 77 HD2 TYR 77 -2.800 -15.212 3.058 618 HE1 TYR 77 HE1 TYR 77 -2.656 -12.036 6.863 619 HE2 TYR 77 HE2 TYR 77 -0.987 -15.379 4.735 620 HH TYR 77 HH TYR 77 -0.247 -14.685 6.740 621 H SER 78 H SER 78 -3.652 -11.965 -0.021 622 HA SER 78 HA SER 78 -6.118 -12.291 -1.614 623 HB2 SER 78 HB2 SER 78 -3.457 -11.663 -2.857 624 HB3 SER 78 HB3 SER 78 -5.065 -11.039 -3.247 625 HG SER 78 HG SER 78 -4.507 -9.306 -2.138 626 H GLU 79 H GLU 79 -6.398 -14.616 -1.544 627 HA GLU 79 HA GLU 79 -4.202 -16.375 -1.730 628 HB2 GLU 79 HB2 GLU 79 -6.966 -16.505 -1.216 629 HB3 GLU 79 HB3 GLU 79 -6.894 -17.195 -2.843 630 HG2 GLU 79 HG2 GLU 79 -5.604 -18.228 -0.294 631 HG3 GLU 79 HG3 GLU 79 -6.785 -19.032 -1.337 632 H GLU 80 H GLU 80 -6.579 -15.136 -4.216 633 HA GLU 80 HA GLU 80 -5.645 -16.694 -6.334 634 HB2 GLU 80 HB2 GLU 80 -6.807 -13.866 -6.459 635 HB3 GLU 80 HB3 GLU 80 -6.824 -15.080 -7.744 636 HG2 GLU 80 HG2 GLU 80 -8.960 -15.375 -6.986 637 HG3 GLU 80 HG3 GLU 80 -8.150 -16.509 -5.898 638 H ALA 81 H ALA 81 -4.421 -13.610 -4.921 639 HA ALA 81 HA ALA 81 -2.565 -13.370 -7.158 640 HB1 ALA 81 HB1 ALA 81 -2.026 -11.173 -6.094 641 HB2 ALA 81 HB2 ALA 81 -3.779 -11.348 -6.442 642 HB3 ALA 81 HB3 ALA 81 -3.171 -11.557 -4.765 643 H LYS 82 H LYS 82 -2.598 -14.815 -3.984 644 HA LYS 82 HA LYS 82 -0.960 -15.769 -2.779 645 HB2 LYS 82 HB2 LYS 82 0.723 -15.149 -5.247 646 HB3 LYS 82 HB3 LYS 82 1.300 -16.073 -3.854 647 HG2 LYS 82 HG2 LYS 82 -1.209 -16.901 -5.366 648 HG3 LYS 82 HG3 LYS 82 0.402 -17.362 -5.933 649 HD2 LYS 82 HD2 LYS 82 0.854 -18.674 -4.011 650 HD3 LYS 82 HD3 LYS 82 -0.367 -17.849 -3.033 651 HE2 LYS 82 HE2 LYS 82 -1.144 -19.477 -5.493 652 HE3 LYS 82 HE3 LYS 82 -0.894 -20.250 -3.922 653 HZ1 LYS 82 HZ1 LYS 82 -3.196 -19.595 -4.339 654 HZ2 LYS 82 HZ2 LYS 82 -2.597 -18.877 -3.000 655 HZ3 LYS 82 HZ3 LYS 82 -2.767 -18.020 -4.379 656 H LYS 83 H LYS 83 -1.659 -13.210 -2.060 657 HA LYS 83 HA LYS 83 0.909 -12.072 -1.242 658 HB2 LYS 83 HB2 LYS 83 -1.397 -10.373 -2.319 659 HB3 LYS 83 HB3 LYS 83 0.249 -9.849 -1.940 660 HG2 LYS 83 HG2 LYS 83 1.157 -10.982 -3.872 661 HG3 LYS 83 HG3 LYS 83 -0.355 -11.854 -4.160 662 HD2 LYS 83 HD2 LYS 83 -1.484 -9.567 -4.484 663 HD3 LYS 83 HD3 LYS 83 0.132 -8.849 -4.448 664 HE2 LYS 83 HE2 LYS 83 0.832 -10.131 -6.404 665 HE3 LYS 83 HE3 LYS 83 -0.643 -11.106 -6.364 666 HZ1 LYS 83 HZ1 LYS 83 -0.704 -9.298 -7.992 667 HZ2 LYS 83 HZ2 LYS 83 -1.911 -9.167 -6.901 668 HZ3 LYS 83 HZ3 LYS 83 -0.609 -8.187 -6.799 669 H LYS 84 H LYS 84 0.892 -11.251 0.846 670 HA LYS 84 HA LYS 84 -1.735 -11.270 2.193 671 HB2 LYS 84 HB2 LYS 84 -0.392 -11.722 4.271 672 HB3 LYS 84 HB3 LYS 84 -0.360 -13.035 3.087 673 HG2 LYS 84 HG2 LYS 84 1.887 -12.992 3.071 674 HG3 LYS 84 HG3 LYS 84 1.872 -11.318 2.502 675 HD2 LYS 84 HD2 LYS 84 3.135 -11.419 4.583 676 HD3 LYS 84 HD3 LYS 84 1.635 -10.530 4.877 677 HE2 LYS 84 HE2 LYS 84 1.084 -13.325 5.324 678 HE3 LYS 84 HE3 LYS 84 2.598 -12.945 6.155 679 HZ1 LYS 84 HZ1 LYS 84 0.314 -12.522 7.270 680 HZ2 LYS 84 HZ2 LYS 84 1.552 -11.488 7.519 681 HZ3 LYS 84 HZ3 LYS 84 0.367 -11.104 6.463 682 H VAL 85 H VAL 85 -2.239 -9.480 3.618 683 HA VAL 85 HA VAL 85 -0.166 -7.379 3.776 684 HB VAL 85 HB VAL 85 -2.044 -5.697 3.378 685 HG11 VAL 85 HG11 VAL 85 -1.933 -5.880 0.898 686 HG12 VAL 85 HG12 VAL 85 -0.338 -6.177 1.666 687 HG13 VAL 85 HG13 VAL 85 -1.313 -7.558 1.061 688 HG21 VAL 85 HG21 VAL 85 -4.017 -6.421 2.079 689 HG22 VAL 85 HG22 VAL 85 -3.514 -8.134 2.283 690 HG23 VAL 85 HG23 VAL 85 -3.974 -7.156 3.717 691 H GLU 86 H GLU 86 -0.029 -6.527 5.831 692 HA GLU 86 HA GLU 86 -2.327 -6.976 7.623 693 HB2 GLU 86 HB2 GLU 86 -0.543 -7.437 9.428 694 HB3 GLU 86 HB3 GLU 86 -0.877 -8.739 8.279 695 HG2 GLU 86 HG2 GLU 86 1.333 -6.907 7.472 696 HG3 GLU 86 HG3 GLU 86 1.632 -7.816 8.959 697 H VAL 87 H VAL 87 -3.019 -5.024 8.322 698 HA VAL 87 HA VAL 87 -1.381 -2.690 8.112 699 HB VAL 87 HB VAL 87 -3.754 -2.498 7.828 700 HG11 VAL 87 HG11 VAL 87 -5.366 -2.902 9.665 701 HG12 VAL 87 HG12 VAL 87 -4.514 -4.401 9.163 702 HG13 VAL 87 HG13 VAL 87 -4.035 -3.559 10.676 703 HG21 VAL 87 HG21 VAL 87 -4.275 -0.719 9.472 704 HG22 VAL 87 HG22 VAL 87 -2.876 -1.244 10.468 705 HG23 VAL 87 HG23 VAL 87 -2.607 -0.578 8.821 706 H LEU 88 H LEU 88 0.387 -2.441 9.504 707 HA LEU 88 HA LEU 88 0.595 -3.913 11.946 708 HB2 LEU 88 HB2 LEU 88 2.038 -1.379 10.922 709 HB3 LEU 88 HB3 LEU 88 2.582 -2.372 12.281 710 HG LEU 88 HG LEU 88 2.415 -3.270 9.373 711 HD11 LEU 88 HD11 LEU 88 4.880 -3.271 9.466 712 HD12 LEU 88 HD12 LEU 88 4.194 -1.633 9.735 713 HD13 LEU 88 HD13 LEU 88 4.813 -2.586 11.125 714 HD21 LEU 88 HD21 LEU 88 3.637 -5.276 10.166 715 HD22 LEU 88 HD22 LEU 88 3.501 -4.683 11.856 716 HD23 LEU 88 HD23 LEU 88 2.022 -5.125 10.937 717 H ASP 89 H ASP 89 -0.079 -0.369 11.133 718 HA ASP 89 HA ASP 89 -1.842 -0.178 13.347 719 HB2 ASP 89 HB2 ASP 89 0.486 -0.024 14.430 720 HB3 ASP 89 HB3 ASP 89 0.646 1.535 13.612 721 H THR 90 H THR 90 -2.935 1.975 13.388 722 HA THR 90 HA THR 90 -2.225 3.787 11.255 723 HB THR 90 HB THR 90 -3.611 2.022 10.153 724 HG1 THR 90 HG1 THR 90 -5.141 3.554 9.221 725 HG21 THR 90 HG21 THR 90 -6.034 1.899 10.686 726 HG22 THR 90 HG22 THR 90 -5.015 1.381 12.071 727 HG23 THR 90 HG23 THR 90 -5.776 3.008 12.074 728 H ASP 91 H ASP 91 -3.106 5.893 11.537 729 HA ASP 91 HA ASP 91 -4.237 6.333 14.204 730 HB2 ASP 91 HB2 ASP 91 -2.239 7.621 13.311 731 HB3 ASP 91 HB3 ASP 91 -3.308 8.327 12.092 732 H TYR 92 H TYR 92 -6.386 7.080 14.482 733 HA TYR 92 HA TYR 92 -8.203 6.613 12.399 734 HB2 TYR 92 HB2 TYR 92 -8.442 8.041 15.071 735 HB3 TYR 92 HB3 TYR 92 -9.809 7.826 13.970 736 HD1 TYR 92 HD1 TYR 92 -10.425 5.432 13.252 737 HD2 TYR 92 HD2 TYR 92 -7.742 6.262 16.501 738 HE1 TYR 92 HE1 TYR 92 -10.776 3.143 14.124 739 HE2 TYR 92 HE2 TYR 92 -8.081 3.969 17.369 740 HH TYR 92 HH TYR 92 -10.272 1.661 15.682 741 H LYS 93 H LYS 93 -6.384 9.557 13.261 742 HA LYS 93 HA LYS 93 -7.556 10.816 10.893 743 HB2 LYS 93 HB2 LYS 93 -7.176 12.139 13.591 744 HB3 LYS 93 HB3 LYS 93 -7.682 12.936 12.096 745 HG2 LYS 93 HG2 LYS 93 -9.727 11.511 12.020 746 HG3 LYS 93 HG3 LYS 93 -9.220 10.695 13.505 747 HD2 LYS 93 HD2 LYS 93 -9.265 12.890 14.717 748 HD3 LYS 93 HD3 LYS 93 -9.795 13.693 13.233 749 HE2 LYS 93 HE2 LYS 93 -11.299 11.428 14.647 750 HE3 LYS 93 HE3 LYS 93 -11.693 13.147 14.780 751 HZ1 LYS 93 HZ1 LYS 93 -13.077 12.249 13.143 752 HZ2 LYS 93 HZ2 LYS 93 -11.955 13.089 12.305 753 HZ3 LYS 93 HZ3 LYS 93 -11.870 11.460 12.377 754 H SER 94 H SER 94 -4.995 9.363 11.105 755 HA SER 94 HA SER 94 -3.396 11.615 10.170 756 HB2 SER 94 HB2 SER 94 -3.023 11.377 12.721 757 HB3 SER 94 HB3 SER 94 -2.479 9.718 12.442 758 HG SER 94 HG SER 94 -0.559 10.512 12.003 759 H TYR 95 H TYR 95 -0.927 9.805 10.465 760 HA TYR 95 HA TYR 95 -1.195 8.619 7.881 761 HB2 TYR 95 HB2 TYR 95 1.185 7.939 8.330 762 HB3 TYR 95 HB3 TYR 95 0.921 9.656 8.661 763 HD1 TYR 95 HD1 TYR 95 1.433 6.316 10.224 764 HD2 TYR 95 HD2 TYR 95 1.093 10.541 10.918 765 HE1 TYR 95 HE1 TYR 95 2.249 6.002 12.540 766 HE2 TYR 95 HE2 TYR 95 1.928 10.231 13.227 767 HH TYR 95 HH TYR 95 2.967 8.783 14.637 768 H ALA 96 H ALA 96 -0.452 6.306 7.451 769 HA ALA 96 HA ALA 96 -1.021 4.434 9.622 770 HB1 ALA 96 HB1 ALA 96 -2.570 3.166 8.186 771 HB2 ALA 96 HB2 ALA 96 -3.197 4.804 8.571 772 HB3 ALA 96 HB3 ALA 96 -2.489 4.470 6.955 773 H VAL 97 H VAL 97 0.102 2.437 9.396 774 HA VAL 97 HA VAL 97 1.773 2.288 6.976 775 HB VAL 97 HB VAL 97 3.492 1.157 8.415 776 HG11 VAL 97 HG11 VAL 97 4.331 3.238 9.471 777 HG12 VAL 97 HG12 VAL 97 3.708 3.529 7.812 778 HG13 VAL 97 HG13 VAL 97 2.721 3.997 9.238 779 HG21 VAL 97 HG21 VAL 97 3.384 1.450 10.867 780 HG22 VAL 97 HG22 VAL 97 1.729 2.129 10.707 781 HG23 VAL 97 HG23 VAL 97 2.047 0.422 10.250 782 H ILE 98 H ILE 98 1.427 0.412 5.782 783 HA ILE 98 HA ILE 98 0.184 -1.815 7.244 784 HB ILE 98 HB ILE 98 -0.008 -1.309 4.239 785 HG12 ILE 98 HG12 ILE 98 -0.931 0.672 5.304 786 HG13 ILE 98 HG13 ILE 98 -2.227 -0.307 4.605 787 HG21 ILE 98 HG21 ILE 98 -2.007 -2.763 4.436 788 HG22 ILE 98 HG22 ILE 98 -0.517 -3.585 5.010 789 HG23 ILE 98 HG23 ILE 98 -1.698 -2.936 6.197 790 HD11 ILE 98 HD11 ILE 98 -2.874 0.581 6.798 791 HD12 ILE 98 HD12 ILE 98 -2.771 -1.211 6.846 792 HD13 ILE 98 HD13 ILE 98 -1.455 -0.217 7.556 793 H TYR 99 H TYR 99 1.056 -3.911 6.958 794 HA TYR 99 HA TYR 99 3.674 -3.988 5.611 795 HB2 TYR 99 HB2 TYR 99 3.361 -4.677 8.055 796 HB3 TYR 99 HB3 TYR 99 2.310 -5.985 7.496 797 HD1 TYR 99 HD1 TYR 99 3.284 -7.808 6.016 798 HD2 TYR 99 HD2 TYR 99 5.742 -4.885 7.977 799 HE1 TYR 99 HE1 TYR 99 5.263 -9.260 5.700 800 HE2 TYR 99 HE2 TYR 99 7.725 -6.335 7.658 801 HH TYR 99 HH TYR 99 7.416 -9.545 6.051 802 H ALA 100 H ALA 100 4.025 -5.434 3.844 803 HA ALA 100 HA ALA 100 1.804 -7.208 3.150 804 HB1 ALA 100 HB1 ALA 100 1.986 -6.493 0.782 805 HB2 ALA 100 HB2 ALA 100 1.446 -5.161 1.860 806 HB3 ALA 100 HB3 ALA 100 3.143 -5.210 1.274 807 H THR 101 H THR 101 2.354 -9.041 1.878 808 HA THR 101 HA THR 101 5.141 -9.425 1.232 809 HB THR 101 HB THR 101 3.658 -11.324 3.100 810 HG1 THR 101 HG1 THR 101 6.067 -9.917 3.783 811 HG21 THR 101 HG21 THR 101 5.845 -12.468 3.267 812 HG22 THR 101 HG22 THR 101 5.217 -12.468 1.584 813 HG23 THR 101 HG23 THR 101 6.527 -11.333 2.054 814 H ARG 102 H ARG 102 5.483 -11.114 -0.370 815 HA ARG 102 HA ARG 102 3.030 -12.444 -1.332 816 HB2 ARG 102 HB2 ARG 102 5.087 -10.822 -2.874 817 HB3 ARG 102 HB3 ARG 102 4.232 -12.158 -3.656 818 HG2 ARG 102 HG2 ARG 102 3.050 -10.134 -4.177 819 HG3 ARG 102 HG3 ARG 102 2.048 -11.053 -3.045 820 HD2 ARG 102 HD2 ARG 102 2.954 -9.694 -1.153 821 HD3 ARG 102 HD3 ARG 102 3.935 -8.767 -2.296 822 HE ARG 102 HE ARG 102 1.792 -7.960 -3.305 823 HH11 ARG 102 HH11 ARG 102 1.792 -9.344 -0.081 824 HH12 ARG 102 HH12 ARG 102 0.326 -8.560 0.407 825 HH21 ARG 102 HH21 ARG 102 -0.244 -7.018 -2.664 826 HH22 ARG 102 HH22 ARG 102 -0.821 -7.249 -1.048 827 H VAL 103 H VAL 103 3.448 -14.709 -1.678 828 HA VAL 103 HA VAL 103 6.307 -15.422 -1.638 829 HB VAL 103 HB VAL 103 5.193 -16.176 0.395 830 HG11 VAL 103 HG11 VAL 103 3.318 -17.785 0.329 831 HG12 VAL 103 HG12 VAL 103 2.877 -16.202 -0.397 832 HG13 VAL 103 HG13 VAL 103 3.236 -17.607 -1.457 833 HG21 VAL 103 HG21 VAL 103 5.636 -18.605 0.220 834 HG22 VAL 103 HG22 VAL 103 5.672 -18.463 -1.570 835 HG23 VAL 103 HG23 VAL 103 6.914 -17.628 -0.578 836 H LYS 104 H LYS 104 7.043 -16.627 -3.309 837 HA LYS 104 HA LYS 104 5.174 -17.782 -5.197 838 HB2 LYS 104 HB2 LYS 104 6.311 -15.490 -5.828 839 HB3 LYS 104 HB3 LYS 104 7.636 -16.566 -6.291 840 HG2 LYS 104 HG2 LYS 104 5.918 -17.916 -7.642 841 HG3 LYS 104 HG3 LYS 104 4.764 -16.613 -7.328 842 HD2 LYS 104 HD2 LYS 104 6.325 -14.967 -8.377 843 HD3 LYS 104 HD3 LYS 104 7.497 -16.258 -8.673 844 HE2 LYS 104 HE2 LYS 104 4.633 -16.331 -9.743 845 HE3 LYS 104 HE3 LYS 104 5.978 -15.619 -10.645 846 HZ1 LYS 104 HZ1 LYS 104 5.269 -18.200 -10.721 847 HZ2 LYS 104 HZ2 LYS 104 6.732 -17.630 -11.166 848 HZ3 LYS 104 HZ3 LYS 104 6.520 -18.257 -9.674 849 H ASP 105 H ASP 105 6.587 -19.201 -6.865 850 HA ASP 105 HA ASP 105 7.394 -21.434 -5.829 851 HB2 ASP 105 HB2 ASP 105 9.177 -20.058 -7.949 852 HB3 ASP 105 HB3 ASP 105 8.839 -21.789 -7.811 853 H GLY 106 H GLY 106 8.307 -21.397 -3.693 854 HA2 GLY 106 HA2 GLY 106 10.184 -21.858 -2.488 855 HA3 GLY 106 HA3 GLY 106 11.150 -21.646 -3.954 856 H ARG 107 H ARG 107 9.248 -18.768 -3.463 857 HA ARG 107 HA ARG 107 11.384 -17.538 -1.883 858 HB2 ARG 107 HB2 ARG 107 12.080 -17.463 -4.306 859 HB3 ARG 107 HB3 ARG 107 10.541 -16.696 -4.720 860 HG2 ARG 107 HG2 ARG 107 11.121 -14.662 -3.618 861 HG3 ARG 107 HG3 ARG 107 12.444 -15.418 -2.721 862 HD2 ARG 107 HD2 ARG 107 12.415 -15.239 -5.773 863 HD3 ARG 107 HD3 ARG 107 13.095 -13.965 -4.752 864 HE ARG 107 HE ARG 107 14.458 -16.067 -3.798 865 HH11 ARG 107 HH11 ARG 107 13.662 -15.311 -7.140 866 HH12 ARG 107 HH12 ARG 107 15.089 -16.058 -7.775 867 HH21 ARG 107 HH21 ARG 107 16.329 -17.034 -4.649 868 HH22 ARG 107 HH22 ARG 107 16.605 -17.038 -6.359 869 H THR 108 H THR 108 10.700 -15.855 -0.625 870 HA THR 108 HA THR 108 7.972 -14.880 -1.083 871 HB THR 108 HB THR 108 9.331 -14.868 1.594 872 HG1 THR 108 HG1 THR 108 8.297 -16.981 1.941 873 HG21 THR 108 HG21 THR 108 6.998 -15.032 2.389 874 HG22 THR 108 HG22 THR 108 7.245 -13.609 1.321 875 HG23 THR 108 HG23 THR 108 6.426 -15.076 0.687 876 H LEU 109 H LEU 109 7.522 -12.620 -1.018 877 HA LEU 109 HA LEU 109 9.942 -10.978 -0.579 878 HB2 LEU 109 HB2 LEU 109 9.457 -11.005 -2.933 879 HB3 LEU 109 HB3 LEU 109 7.729 -10.756 -2.650 880 HG LEU 109 HG LEU 109 8.170 -8.479 -1.815 881 HD11 LEU 109 HD11 LEU 109 10.413 -7.476 -2.061 882 HD12 LEU 109 HD12 LEU 109 10.405 -8.827 -0.877 883 HD13 LEU 109 HD13 LEU 109 11.075 -9.080 -2.524 884 HD21 LEU 109 HD21 LEU 109 8.858 -7.480 -3.971 885 HD22 LEU 109 HD22 LEU 109 9.443 -9.086 -4.521 886 HD23 LEU 109 HD23 LEU 109 7.696 -8.831 -4.196 887 H HIS 110 H HIS 110 9.688 -9.173 0.743 888 HA HIS 110 HA HIS 110 6.994 -8.919 1.961 889 HB2 HIS 110 HB2 HIS 110 9.813 -8.320 3.033 890 HB3 HIS 110 HB3 HIS 110 8.330 -7.798 3.843 891 HD2 HIS 110 HD2 HIS 110 10.721 -10.672 4.044 892 HE1 HIS 110 HE1 HIS 110 6.977 -12.276 5.349 893 H MET 111 H MET 111 6.183 -6.687 2.040 894 HA MET 111 HA MET 111 7.917 -4.481 1.136 895 HB2 MET 111 HB2 MET 111 7.137 -5.578 -0.968 896 HB3 MET 111 HB3 MET 111 5.467 -5.529 -0.389 897 HG2 MET 111 HG2 MET 111 5.560 -3.036 -0.377 898 HG3 MET 111 HG3 MET 111 7.215 -3.106 -0.996 899 HE1 MET 111 HE1 MET 111 7.399 -3.479 -4.266 900 HE2 MET 111 HE2 MET 111 7.905 -4.417 -2.820 901 HE3 MET 111 HE3 MET 111 6.890 -5.192 -4.084 902 H MET 112 H MET 112 7.537 -3.034 2.723 903 HA MET 112 HA MET 112 4.895 -3.099 4.036 904 HB2 MET 112 HB2 MET 112 7.646 -1.934 4.644 905 HB3 MET 112 HB3 MET 112 6.226 -1.159 5.359 906 HG2 MET 112 HG2 MET 112 5.562 -3.348 6.368 907 HG3 MET 112 HG3 MET 112 7.017 -4.088 5.686 908 HE1 MET 112 HE1 MET 112 6.500 -1.147 9.082 909 HE2 MET 112 HE2 MET 112 7.266 -0.268 7.716 910 HE3 MET 112 HE3 MET 112 5.698 -1.111 7.475 911 H ARG 113 H ARG 113 3.754 -0.922 4.226 912 HA ARG 113 HA ARG 113 4.635 1.081 2.295 913 HB2 ARG 113 HB2 ARG 113 2.768 -0.832 1.567 914 HB3 ARG 113 HB3 ARG 113 1.717 0.411 2.258 915 HG2 ARG 113 HG2 ARG 113 1.813 1.530 0.315 916 HG3 ARG 113 HG3 ARG 113 3.537 1.816 0.586 917 HD2 ARG 113 HD2 ARG 113 3.096 0.714 -1.612 918 HD3 ARG 113 HD3 ARG 113 4.133 -0.266 -0.567 919 HE ARG 113 HE ARG 113 1.260 -0.807 -1.168 920 HH11 ARG 113 HH11 ARG 113 4.384 -1.844 0.062 921 HH12 ARG 113 HH12 ARG 113 3.894 -3.492 0.272 922 HH21 ARG 113 HH21 ARG 113 0.587 -2.952 -0.762 923 HH22 ARG 113 HH22 ARG 113 1.732 -4.123 -0.197 924 H LEU 114 H LEU 114 4.008 3.182 2.774 925 HA LEU 114 HA LEU 114 2.416 3.521 5.247 926 HB2 LEU 114 HB2 LEU 114 4.688 3.982 5.804 927 HB3 LEU 114 HB3 LEU 114 4.941 4.866 4.321 928 HG LEU 114 HG LEU 114 3.376 6.641 5.101 929 HD11 LEU 114 HD11 LEU 114 2.789 6.705 7.499 930 HD12 LEU 114 HD12 LEU 114 2.051 5.300 6.659 931 HD13 LEU 114 HD13 LEU 114 3.489 5.065 7.708 932 HD21 LEU 114 HD21 LEU 114 4.944 7.619 6.747 933 HD22 LEU 114 HD22 LEU 114 5.753 6.025 6.913 934 HD23 LEU 114 HD23 LEU 114 5.802 6.897 5.344 935 H TYR 115 H TYR 115 0.605 4.833 4.917 936 HA TYR 115 HA TYR 115 0.700 6.527 2.513 937 HB2 TYR 115 HB2 TYR 115 -1.528 5.989 1.946 938 HB3 TYR 115 HB3 TYR 115 -0.655 4.465 2.151 939 HD1 TYR 115 HD1 TYR 115 -1.150 2.975 4.072 940 HD2 TYR 115 HD2 TYR 115 -3.335 6.622 3.452 941 HE1 TYR 115 HE1 TYR 115 -2.906 2.189 5.632 942 HE2 TYR 115 HE2 TYR 115 -5.095 5.833 5.003 943 HH TYR 115 HH TYR 115 -4.838 2.624 6.613 944 H SER 116 H SER 116 -0.695 8.434 2.541 945 HA SER 116 HA SER 116 -1.003 9.405 5.324 946 HB2 SER 116 HB2 SER 116 -0.466 10.910 2.684 947 HB3 SER 116 HB3 SER 116 -0.747 11.686 4.248 948 HG SER 116 HG SER 116 1.469 11.564 4.008 949 H ARG 117 H ARG 117 -2.999 10.829 5.581 950 HA ARG 117 HA ARG 117 -5.231 9.694 4.320 951 HB2 ARG 117 HB2 ARG 117 -4.874 11.105 6.592 952 HB3 ARG 117 HB3 ARG 117 -5.380 12.445 5.554 953 HG2 ARG 117 HG2 ARG 117 -7.434 11.106 4.917 954 HG3 ARG 117 HG3 ARG 117 -6.942 9.867 6.078 955 HD2 ARG 117 HD2 ARG 117 -8.481 11.197 7.285 956 HD3 ARG 117 HD3 ARG 117 -6.901 11.754 7.853 957 HE ARG 117 HE ARG 117 -7.197 13.791 6.670 958 HH11 ARG 117 HH11 ARG 117 -9.918 11.610 6.187 959 HH12 ARG 117 HH12 ARG 117 -10.949 12.847 5.551 960 HH21 ARG 117 HH21 ARG 117 -8.560 15.396 5.829 961 HH22 ARG 117 HH22 ARG 117 -10.176 15.001 5.347 962 H SER 118 H SER 118 -2.995 12.140 3.181 963 HA SER 118 HA SER 118 -4.747 12.671 0.889 964 HB2 SER 118 HB2 SER 118 -3.330 14.884 2.433 965 HB3 SER 118 HB3 SER 118 -4.370 15.052 1.013 966 HG SER 118 HG SER 118 -5.501 15.525 3.001 967 HA PRO 119 HA PRO 119 -0.771 12.303 -1.124 968 HB2 PRO 119 HB2 PRO 119 -0.746 14.340 -3.020 969 HB3 PRO 119 HB3 PRO 119 -1.872 12.986 -3.184 970 HG2 PRO 119 HG2 PRO 119 -2.370 15.761 -2.071 971 HG3 PRO 119 HG3 PRO 119 -3.376 14.804 -3.166 972 HD2 PRO 119 HD2 PRO 119 -3.900 14.973 -0.477 973 HD3 PRO 119 HD3 PRO 119 -4.306 13.535 -1.423 974 H GLU 120 H GLU 120 0.058 13.072 1.183 975 HA GLU 120 HA GLU 120 2.241 14.813 0.556 976 HB2 GLU 120 HB2 GLU 120 1.744 16.461 2.373 977 HB3 GLU 120 HB3 GLU 120 0.741 16.608 0.923 978 HG2 GLU 120 HG2 GLU 120 -1.156 15.584 2.029 979 HG3 GLU 120 HG3 GLU 120 -0.172 15.121 3.424 980 H VAL 121 H VAL 121 3.984 13.891 1.524 981 HA VAL 121 HA VAL 121 3.506 11.884 3.534 982 HB VAL 121 HB VAL 121 6.105 13.306 2.564 983 HG11 VAL 121 HG11 VAL 121 7.308 11.307 3.410 984 HG12 VAL 121 HG12 VAL 121 6.427 12.164 4.719 985 HG13 VAL 121 HG13 VAL 121 5.758 10.646 4.031 986 HG21 VAL 121 HG21 VAL 121 6.421 11.635 0.935 987 HG22 VAL 121 HG22 VAL 121 5.191 10.585 1.662 988 HG23 VAL 121 HG23 VAL 121 4.679 12.056 0.817 989 H SER 122 H SER 122 3.621 12.222 5.744 990 HA SER 122 HA SER 122 4.318 14.896 6.718 991 HB2 SER 122 HB2 SER 122 3.075 14.012 8.795 992 HB3 SER 122 HB3 SER 122 2.106 14.350 7.355 993 HG SER 122 HG SER 122 1.595 12.273 8.301 994 HA PRO 123 HA PRO 123 8.095 13.522 8.547 995 HB2 PRO 123 HB2 PRO 123 7.912 15.122 10.907 996 HB3 PRO 123 HB3 PRO 123 8.559 15.716 9.372 997 HG2 PRO 123 HG2 PRO 123 5.788 16.045 10.532 998 HG3 PRO 123 HG3 PRO 123 6.768 17.210 9.633 999 HD2 PRO 123 HD2 PRO 123 4.737 15.923 8.410 1000 HD3 PRO 123 HD3 PRO 123 6.239 16.237 7.530 1001 H ALA 124 H ALA 124 5.233 13.817 10.786 1002 HA ALA 124 HA ALA 124 6.211 12.133 12.761 1003 HB1 ALA 124 HB1 ALA 124 3.820 11.812 13.343 1004 HB2 ALA 124 HB2 ALA 124 4.203 13.533 13.001 1005 HB3 ALA 124 HB3 ALA 124 3.347 12.542 11.772 1006 H ALA 125 H ALA 125 4.250 11.271 9.789 1007 HA ALA 125 HA ALA 125 4.134 8.513 10.415 1008 HB1 ALA 125 HB1 ALA 125 3.478 8.292 8.037 1009 HB2 ALA 125 HB2 ALA 125 2.599 9.635 8.843 1010 HB3 ALA 125 HB3 ALA 125 3.973 9.993 7.744 1011 H THR 126 H THR 126 6.468 10.589 8.611 1012 HA THR 126 HA THR 126 7.923 8.515 7.428 1013 HB THR 126 HB THR 126 8.924 11.261 8.336 1014 HG1 THR 126 HG1 THR 126 7.111 11.632 7.037 1015 HG21 THR 126 HG21 THR 126 10.470 11.017 6.413 1016 HG22 THR 126 HG22 THR 126 10.693 9.699 7.612 1017 HG23 THR 126 HG23 THR 126 9.801 9.383 6.087 1018 H ALA 127 H ALA 127 8.497 10.390 10.537 1019 HA ALA 127 HA ALA 127 10.815 8.959 11.234 1020 HB1 ALA 127 HB1 ALA 127 10.410 9.924 13.484 1021 HB2 ALA 127 HB2 ALA 127 10.231 11.150 12.184 1022 HB3 ALA 127 HB3 ALA 127 8.773 10.442 12.959 1023 H ILE 128 H ILE 128 7.301 8.354 11.899 1024 HA ILE 128 HA ILE 128 7.773 6.335 13.807 1025 HB ILE 128 HB ILE 128 5.386 6.914 12.000 1026 HG12 ILE 128 HG12 ILE 128 5.879 8.699 13.594 1027 HG13 ILE 128 HG13 ILE 128 4.401 7.849 14.064 1028 HG21 ILE 128 HG21 ILE 128 4.089 5.456 13.519 1029 HG22 ILE 128 HG22 ILE 128 5.369 4.550 12.644 1030 HG23 ILE 128 HG23 ILE 128 5.606 5.000 14.367 1031 HD11 ILE 128 HD11 ILE 128 5.796 8.347 16.022 1032 HD12 ILE 128 HD12 ILE 128 5.663 6.573 15.774 1033 HD13 ILE 128 HD13 ILE 128 7.164 7.436 15.297 1034 H PHE 129 H PHE 129 6.991 6.200 10.229 1035 HA PHE 129 HA PHE 129 7.007 3.429 9.999 1036 HB2 PHE 129 HB2 PHE 129 6.204 5.123 8.312 1037 HB3 PHE 129 HB3 PHE 129 7.889 5.522 7.953 1038 HD1 PHE 129 HD1 PHE 129 5.280 2.902 7.707 1039 HD2 PHE 129 HD2 PHE 129 9.266 4.064 6.615 1040 HE1 PHE 129 HE1 PHE 129 5.349 1.082 6.029 1041 HE2 PHE 129 HE2 PHE 129 9.343 2.242 4.939 1042 HZ PHE 129 HZ PHE 129 7.381 0.745 4.645 1043 H ARG 130 H ARG 130 9.758 5.794 9.995 1044 HA ARG 130 HA ARG 130 11.639 3.882 9.071 1045 HB2 ARG 130 HB2 ARG 130 11.758 6.481 9.060 1046 HB3 ARG 130 HB3 ARG 130 12.285 6.335 10.742 1047 HG2 ARG 130 HG2 ARG 130 13.931 4.490 9.471 1048 HG3 ARG 130 HG3 ARG 130 13.748 5.731 8.225 1049 HD2 ARG 130 HD2 ARG 130 14.589 6.262 11.120 1050 HD3 ARG 130 HD3 ARG 130 15.700 6.132 9.750 1051 HE ARG 130 HE ARG 130 14.606 8.159 8.802 1052 HH11 ARG 130 HH11 ARG 130 14.031 7.437 12.192 1053 HH12 ARG 130 HH12 ARG 130 13.715 9.086 12.617 1054 HH21 ARG 130 HH21 ARG 130 14.211 10.325 9.380 1055 HH22 ARG 130 HH22 ARG 130 13.818 10.728 11.018 1056 H LYS 131 H LYS 131 10.677 5.081 12.388 1057 HA LYS 131 HA LYS 131 12.656 3.844 13.845 1058 HB2 LYS 131 HB2 LYS 131 9.713 4.358 14.463 1059 HB3 LYS 131 HB3 LYS 131 10.848 3.727 15.663 1060 HG2 LYS 131 HG2 LYS 131 12.304 5.778 15.238 1061 HG3 LYS 131 HG3 LYS 131 11.001 6.418 14.226 1062 HD2 LYS 131 HD2 LYS 131 9.428 6.311 16.148 1063 HD3 LYS 131 HD3 LYS 131 10.693 5.609 17.165 1064 HE2 LYS 131 HE2 LYS 131 12.102 7.682 16.728 1065 HE3 LYS 131 HE3 LYS 131 10.723 8.383 15.871 1066 HZ1 LYS 131 HZ1 LYS 131 10.788 9.077 18.157 1067 HZ2 LYS 131 HZ2 LYS 131 9.445 8.184 17.904 1068 HZ3 LYS 131 HZ3 LYS 131 10.718 7.537 18.695 1069 H LEU 132 H LEU 132 9.478 2.422 12.708 1070 HA LEU 132 HA LEU 132 9.873 -0.071 13.976 1071 HB2 LEU 132 HB2 LEU 132 8.310 0.688 11.474 1072 HB3 LEU 132 HB3 LEU 132 8.188 -0.859 12.322 1073 HG LEU 132 HG LEU 132 7.471 1.861 13.500 1074 HD11 LEU 132 HD11 LEU 132 5.137 1.059 13.331 1075 HD12 LEU 132 HD12 LEU 132 5.923 1.183 11.721 1076 HD13 LEU 132 HD13 LEU 132 5.712 -0.423 12.497 1077 HD21 LEU 132 HD21 LEU 132 6.470 0.541 15.336 1078 HD22 LEU 132 HD22 LEU 132 7.103 -0.966 14.591 1079 HD23 LEU 132 HD23 LEU 132 8.242 0.279 15.208 1080 H ALA 133 H ALA 133 10.643 1.199 10.648 1081 HA ALA 133 HA ALA 133 11.573 -1.170 9.554 1082 HB1 ALA 133 HB1 ALA 133 12.804 0.312 7.995 1083 HB2 ALA 133 HB2 ALA 133 11.117 0.868 8.260 1084 HB3 ALA 133 HB3 ALA 133 12.478 1.708 9.077 1085 H GLY 134 H GLY 134 13.284 1.220 11.718 1086 HA2 GLY 134 HA2 GLY 134 15.841 0.027 11.289 1087 HA3 GLY 134 HA3 GLY 134 15.378 1.173 12.554 1088 H GLU 135 H GLU 135 13.091 -0.538 13.557 1089 HA GLU 135 HA GLU 135 14.483 -1.995 15.510 1090 HB2 GLU 135 HB2 GLU 135 12.115 -1.052 15.585 1091 HB3 GLU 135 HB3 GLU 135 11.616 -2.367 14.513 1092 HG2 GLU 135 HG2 GLU 135 12.692 -3.922 16.361 1093 HG3 GLU 135 HG3 GLU 135 12.528 -2.498 17.397 1094 H ARG 136 H ARG 136 13.430 -2.793 12.196 1095 HA ARG 136 HA ARG 136 13.898 -5.649 12.677 1096 HB2 ARG 136 HB2 ARG 136 13.075 -4.410 10.034 1097 HB3 ARG 136 HB3 ARG 136 12.698 -6.011 10.684 1098 HG2 ARG 136 HG2 ARG 136 11.147 -4.991 12.336 1099 HG3 ARG 136 HG3 ARG 136 11.544 -3.379 11.729 1100 HD2 ARG 136 HD2 ARG 136 9.657 -3.746 10.466 1101 HD3 ARG 136 HD3 ARG 136 10.836 -4.486 9.374 1102 HE ARG 136 HE ARG 136 9.967 -6.599 9.880 1103 HH11 ARG 136 HH11 ARG 136 8.664 -4.221 12.122 1104 HH12 ARG 136 HH12 ARG 136 7.449 -5.290 12.741 1105 HH21 ARG 136 HH21 ARG 136 8.359 -7.989 10.705 1106 HH22 ARG 136 HH22 ARG 136 7.277 -7.428 11.936 1107 H ASN 137 H ASN 137 16.045 -3.323 12.495 1108 HA ASN 137 HA ASN 137 18.034 -2.978 11.616 1109 HB2 ASN 137 HB2 ASN 137 17.845 -5.987 11.124 1110 HB3 ASN 137 HB3 ASN 137 19.327 -5.046 10.910 1111 HD21 ASN 137 HD21 ASN 137 20.278 -4.003 12.780 1112 HD22 ASN 137 HD22 ASN 137 19.966 -4.603 14.375 1113 H TYR 138 H TYR 138 15.866 -2.334 9.812 1114 HA TYR 138 HA TYR 138 16.439 -3.406 7.236 1115 HB2 TYR 138 HB2 TYR 138 14.615 -2.123 6.602 1116 HB3 TYR 138 HB3 TYR 138 14.331 -2.062 8.347 1117 HD1 TYR 138 HD1 TYR 138 15.733 -0.045 9.565 1118 HD2 TYR 138 HD2 TYR 138 14.509 -0.097 5.449 1119 HE1 TYR 138 HE1 TYR 138 15.880 2.423 9.493 1120 HE2 TYR 138 HE2 TYR 138 14.647 2.374 5.377 1121 HH TYR 138 HH TYR 138 15.102 4.228 6.474 1122 H THR 139 H THR 139 17.096 -1.928 5.352 1123 HA THR 139 HA THR 139 19.227 -0.052 6.211 1124 HB THR 139 HB THR 139 20.032 -0.729 3.763 1125 HG1 THR 139 HG1 THR 139 19.577 -3.023 3.406 1126 HG21 THR 139 HG21 THR 139 21.469 -2.481 4.779 1127 HG22 THR 139 HG22 THR 139 21.321 -1.047 5.850 1128 HG23 THR 139 HG23 THR 139 20.385 -2.537 6.209 1129 H ASP 140 H ASP 140 19.439 1.879 4.772 1130 HA ASP 140 HA ASP 140 17.085 3.145 4.253 1131 HB2 ASP 140 HB2 ASP 140 19.710 3.839 4.121 1132 HB3 ASP 140 HB3 ASP 140 19.497 3.526 2.394 1133 H GLU 141 H GLU 141 19.116 1.340 1.778 1134 HA GLU 141 HA GLU 141 17.565 1.885 -0.431 1135 HB2 GLU 141 HB2 GLU 141 18.904 -0.809 0.321 1136 HB3 GLU 141 HB3 GLU 141 18.591 -0.241 -1.325 1137 HG2 GLU 141 HG2 GLU 141 20.437 1.267 0.563 1138 HG3 GLU 141 HG3 GLU 141 21.005 -0.101 -0.404 1139 H MET 142 H MET 142 16.623 -0.149 2.342 1140 HA MET 142 HA MET 142 14.873 -1.797 0.743 1141 HB2 MET 142 HB2 MET 142 15.941 -2.635 2.838 1142 HB3 MET 142 HB3 MET 142 15.169 -1.347 3.772 1143 HG2 MET 142 HG2 MET 142 12.937 -2.295 3.278 1144 HG3 MET 142 HG3 MET 142 13.675 -3.555 2.280 1145 HE1 MET 142 HE1 MET 142 15.429 -5.904 4.708 1146 HE2 MET 142 HE2 MET 142 15.322 -5.227 3.047 1147 HE3 MET 142 HE3 MET 142 16.367 -4.435 4.275 1148 H VAL 143 H VAL 143 14.664 1.373 2.260 1149 HA VAL 143 HA VAL 143 11.763 1.263 2.033 1150 HB VAL 143 HB VAL 143 13.533 3.064 3.719 1151 HG11 VAL 143 HG11 VAL 143 11.436 4.072 4.557 1152 HG12 VAL 143 HG12 VAL 143 11.680 4.378 2.805 1153 HG13 VAL 143 HG13 VAL 143 10.506 3.131 3.343 1154 HG21 VAL 143 HG21 VAL 143 12.289 2.021 5.596 1155 HG22 VAL 143 HG22 VAL 143 11.410 0.982 4.424 1156 HG23 VAL 143 HG23 VAL 143 13.186 0.806 4.625 1157 H ALA 144 H ALA 144 10.644 3.146 1.087 1158 HA ALA 144 HA ALA 144 12.388 4.894 -0.516 1159 HB1 ALA 144 HB1 ALA 144 10.794 4.613 -2.391 1160 HB2 ALA 144 HB2 ALA 144 11.586 3.061 -1.957 1161 HB3 ALA 144 HB3 ALA 144 9.897 3.383 -1.438 1162 H MET 145 H MET 145 11.858 7.004 -0.213 1163 HA MET 145 HA MET 145 9.210 7.610 0.869 1164 HB2 MET 145 HB2 MET 145 11.842 9.087 1.204 1165 HB3 MET 145 HB3 MET 145 10.272 9.664 1.781 1166 HG2 MET 145 HG2 MET 145 10.074 7.655 3.241 1167 HG3 MET 145 HG3 MET 145 11.647 7.086 2.669 1168 HE1 MET 145 HE1 MET 145 12.593 8.220 6.288 1169 HE2 MET 145 HE2 MET 145 11.112 7.368 5.734 1170 HE3 MET 145 HE3 MET 145 12.711 6.930 5.043 1171 H LEU 146 H LEU 146 7.927 9.257 -0.112 1172 HA LEU 146 HA LEU 146 9.155 10.393 -2.555 1173 HB2 LEU 146 HB2 LEU 146 6.258 9.656 -1.957 1174 HB3 LEU 146 HB3 LEU 146 6.829 10.458 -3.427 1175 HG LEU 146 HG LEU 146 6.477 8.175 -3.970 1176 HD11 LEU 146 HD11 LEU 146 8.730 7.383 -4.620 1177 HD12 LEU 146 HD12 LEU 146 8.506 9.134 -4.946 1178 HD13 LEU 146 HD13 LEU 146 9.465 8.601 -3.524 1179 HD21 LEU 146 HD21 LEU 146 7.536 6.292 -2.772 1180 HD22 LEU 146 HD22 LEU 146 8.204 7.444 -1.567 1181 HD23 LEU 146 HD23 LEU 146 6.427 7.231 -1.717 1182 HA PRO 147 HA PRO 147 8.462 14.151 -0.097 1183 HB2 PRO 147 HB2 PRO 147 9.937 15.753 -1.863 1184 HB3 PRO 147 HB3 PRO 147 10.730 14.777 -0.619 1185 HG2 PRO 147 HG2 PRO 147 10.321 14.160 -3.558 1186 HG3 PRO 147 HG3 PRO 147 11.763 13.925 -2.561 1187 HD2 PRO 147 HD2 PRO 147 10.124 11.843 -3.147 1188 HD3 PRO 147 HD3 PRO 147 10.926 11.945 -1.574 1189 H ARG 148 H ARG 148 8.036 16.596 -1.168 1190 HA ARG 148 HA ARG 148 5.465 16.310 -2.238 1191 HB2 ARG 148 HB2 ARG 148 5.291 18.635 -2.128 1192 HB3 ARG 148 HB3 ARG 148 6.392 18.211 -0.810 1193 HG2 ARG 148 HG2 ARG 148 7.239 19.294 -3.540 1194 HG3 ARG 148 HG3 ARG 148 7.107 20.244 -2.054 1195 HD2 ARG 148 HD2 ARG 148 8.836 17.752 -2.076 1196 HD3 ARG 148 HD3 ARG 148 9.443 19.233 -2.828 1197 HE ARG 148 HE ARG 148 8.423 19.442 -0.053 1198 HH11 ARG 148 HH11 ARG 148 11.181 19.258 -2.228 1199 HH12 ARG 148 HH12 ARG 148 12.298 19.881 -1.060 1200 HH21 ARG 148 HH21 ARG 148 9.903 20.276 1.462 1201 HH22 ARG 148 HH22 ARG 148 11.572 20.459 1.036 1202 H GLN 149 H GLN 149 6.529 14.800 -3.996 1203 HA GLN 149 HA GLN 149 6.894 16.296 -6.413 1204 HB2 GLN 149 HB2 GLN 149 8.893 15.162 -5.692 1205 HB3 GLN 149 HB3 GLN 149 8.058 13.613 -5.869 1206 HG2 GLN 149 HG2 GLN 149 7.635 14.223 -8.304 1207 HG3 GLN 149 HG3 GLN 149 8.684 15.627 -8.067 1208 HE21 GLN 149 HE21 GLN 149 10.491 14.215 -6.159 1209 HE22 GLN 149 HE22 GLN 149 11.451 13.146 -7.127 1210 H GLU 150 H GLU 150 4.247 15.652 -5.358 1211 HA GLU 150 HA GLU 150 3.439 13.406 -6.997 1212 HB2 GLU 150 HB2 GLU 150 1.175 13.951 -6.032 1213 HB3 GLU 150 HB3 GLU 150 2.425 13.559 -4.844 1214 HG2 GLU 150 HG2 GLU 150 1.312 15.379 -3.884 1215 HG3 GLU 150 HG3 GLU 150 2.760 16.111 -4.588 1216 H GLU 151 H GLU 151 1.581 13.460 -8.478 1217 HA GLU 151 HA GLU 151 0.900 15.936 -9.717 1218 HB2 GLU 151 HB2 GLU 151 3.320 15.216 -10.535 1219 HB3 GLU 151 HB3 GLU 151 2.480 13.919 -11.396 1220 HG2 GLU 151 HG2 GLU 151 1.096 15.677 -12.573 1221 HG3 GLU 151 HG3 GLU 151 2.084 16.918 -11.792 1222 H CYS 152 H CYS 152 1.190 12.294 -10.006 1223 HA CYS 152 HA CYS 152 -1.276 12.369 -11.667 1224 HB2 CYS 152 HB2 CYS 152 0.690 10.881 -12.358 1225 HB3 CYS 152 HB3 CYS 152 0.662 10.101 -10.771 1226 H THR 153 H THR 153 -3.192 11.946 -10.568 1227 HA THR 153 HA THR 153 -3.072 10.651 -7.939 1228 HB THR 153 HB THR 153 -5.204 12.213 -7.566 1229 HG1 THR 153 HG1 THR 153 -4.840 14.305 -8.604 1230 HG21 THR 153 HG21 THR 153 -3.741 13.917 -6.515 1231 HG22 THR 153 HG22 THR 153 -3.157 12.250 -6.191 1232 HG23 THR 153 HG23 THR 153 -2.336 13.265 -7.425 1233 H VAL 154 H VAL 154 -4.912 9.310 -7.388 1234 HA VAL 154 HA VAL 154 -6.281 8.324 -9.749 1235 HB VAL 154 HB VAL 154 -5.222 6.751 -8.154 1236 HG11 VAL 154 HG11 VAL 154 -6.233 6.356 -5.934 1237 HG12 VAL 154 HG12 VAL 154 -5.523 8.000 -6.075 1238 HG13 VAL 154 HG13 VAL 154 -7.303 7.779 -6.177 1239 HG21 VAL 154 HG21 VAL 154 -7.149 5.216 -7.908 1240 HG22 VAL 154 HG22 VAL 154 -8.267 6.575 -8.267 1241 HG23 VAL 154 HG23 VAL 154 -7.113 6.006 -9.521 1242 H ASP 155 H ASP 155 -8.528 8.470 -10.096 1243 HA ASP 155 HA ASP 155 -9.862 10.579 -8.707 1244 HB2 ASP 155 HB2 ASP 155 -10.499 10.536 -10.926 1245 HB3 ASP 155 HB3 ASP 155 -10.385 8.775 -11.051 1246 H GLU 156 H GLU 156 -11.786 10.477 -7.431 1247 HA GLU 156 HA GLU 156 -12.079 7.887 -6.081 1248 HB2 GLU 156 HB2 GLU 156 -13.104 9.211 -4.256 1249 HB3 GLU 156 HB3 GLU 156 -11.419 9.639 -4.581 1250 HG2 GLU 156 HG2 GLU 156 -12.481 11.535 -6.096 1251 HG3 GLU 156 HG3 GLU 156 -13.934 11.231 -5.135 1252 H VAL 157 H VAL 157 -13.953 10.532 -7.725 1253 HA VAL 157 HA VAL 157 -15.867 8.733 -8.647 1254 HB VAL 157 HB VAL 157 -16.636 8.545 -6.347 1255 HG11 VAL 157 HG11 VAL 157 -17.525 10.484 -5.102 1256 HG12 VAL 157 HG12 VAL 157 -15.766 10.634 -5.432 1257 HG13 VAL 157 HG13 VAL 157 -16.945 11.576 -6.404 1258 HG21 VAL 157 HG21 VAL 157 -18.988 9.261 -6.646 1259 HG22 VAL 157 HG22 VAL 157 -18.492 10.276 -8.043 1260 HG23 VAL 157 HG23 VAL 157 -18.319 8.490 -8.124 1261 HN1 EB4 158 HN1 EB4 158 3.736 -6.376 -6.823 1262 H8 EB4 158 H8 EB4 158 -1.930 -6.939 -4.210 1263 HN2 EB4 158 HN2 EB4 158 1.370 -5.530 -8.454 1264 H9 EB4 158 H9 EB4 158 0.972 -0.394 -3.330 1265 H10 EB4 158 H10 EB4 158 4.792 -7.239 -1.063 1266 HN3 EB4 158 HN3 EB4 158 3.893 -3.240 -7.459 1267 H7 EB4 158 H7 EB4 158 3.266 -5.277 -1.123 1268 H11 EB4 158 H11 EB4 158 -3.471 -7.520 -6.068 1269 H12 EB4 158 H12 EB4 158 2.400 1.449 -4.186 1270 H15 EB4 158 H15 EB4 158 4.128 0.992 -5.900 1271 H14 EB4 158 H14 EB4 158 -2.788 -7.073 -8.422 1272 H13 EB4 158 H13 EB4 158 5.434 -8.368 -3.170 1273 H22 EB4 158 H22 EB4 158 4.637 -7.158 -7.157 1274 H30 EB4 158 H30 EB4 158 6.469 -4.130 -9.931 1275 H30A EB4 158 H30A EB4 158 6.740 -3.495 -8.225 1276 H24 EB4 158 H24 EB4 158 4.474 -2.541 -8.296 1277 H28 EB4 158 H28 EB4 158 3.521 -8.930 -8.624 1278 H28A EB4 158 H28A EB4 158 4.435 -8.189 -10.025 1279 H23 EB4 158 H23 EB4 158 1.030 -5.645 -9.642 1280 H29 EB4 158 H29 EB4 158 0.995 -3.653 -10.895 1281 H29A EB4 158 H29A EB4 158 2.429 -4.311 -11.914 Start of MODEL 12 1 H1 MET 1 H1 MET 1 -29.039 3.134 -4.346 2 H2 MET 1 H2 MET 1 -27.956 3.635 -3.232 3 H3 MET 1 H3 MET 1 -28.922 4.720 -3.977 4 HA MET 1 HA MET 1 -26.837 3.097 -5.245 5 HB2 MET 1 HB2 MET 1 -29.054 4.797 -6.306 6 HB3 MET 1 HB3 MET 1 -27.470 5.112 -7.027 7 HG2 MET 1 HG2 MET 1 -27.257 2.685 -7.584 8 HG3 MET 1 HG3 MET 1 -28.860 2.397 -6.896 9 HE1 MET 1 HE1 MET 1 -29.286 2.096 -10.856 10 HE2 MET 1 HE2 MET 1 -27.797 1.716 -9.925 11 HE3 MET 1 HE3 MET 1 -29.404 1.227 -9.288 12 H THR 2 H THR 2 -24.810 3.864 -4.796 13 HA THR 2 HA THR 2 -23.187 5.201 -4.116 14 HB THR 2 HB THR 2 -24.572 7.463 -5.626 15 HG1 THR 2 HG1 THR 2 -23.645 6.474 -7.570 16 HG21 THR 2 HG21 THR 2 -22.246 7.971 -6.316 17 HG22 THR 2 HG22 THR 2 -22.410 7.940 -4.528 18 HG23 THR 2 HG23 THR 2 -21.661 6.551 -5.386 19 H VAL 3 H VAL 3 -25.079 4.988 -2.056 20 HA VAL 3 HA VAL 3 -25.534 7.728 -1.169 21 HB VAL 3 HB VAL 3 -26.817 6.642 0.695 22 HG11 VAL 3 HG11 VAL 3 -28.735 5.967 -0.722 23 HG12 VAL 3 HG12 VAL 3 -27.941 7.459 -1.331 24 HG13 VAL 3 HG13 VAL 3 -27.645 5.886 -2.147 25 HG21 VAL 3 HG21 VAL 3 -27.432 4.261 0.484 26 HG22 VAL 3 HG22 VAL 3 -26.284 4.090 -0.886 27 HG23 VAL 3 HG23 VAL 3 -25.671 4.482 0.756 28 HA PRO 4 HA PRO 4 -21.947 7.474 1.493 29 HB2 PRO 4 HB2 PRO 4 -22.580 9.609 3.170 30 HB3 PRO 4 HB3 PRO 4 -22.067 9.898 1.502 31 HG2 PRO 4 HG2 PRO 4 -24.873 9.813 2.649 32 HG3 PRO 4 HG3 PRO 4 -24.172 10.972 1.512 33 HD2 PRO 4 HD2 PRO 4 -25.766 8.925 0.662 34 HD3 PRO 4 HD3 PRO 4 -24.436 9.531 -0.333 35 H ASP 5 H ASP 5 -23.468 5.362 2.081 36 HA ASP 5 HA ASP 5 -24.214 5.604 4.918 37 HB2 ASP 5 HB2 ASP 5 -25.705 4.531 3.104 38 HB3 ASP 5 HB3 ASP 5 -24.514 3.225 3.032 39 H ARG 6 H ARG 6 -22.595 3.018 2.932 40 HA ARG 6 HA ARG 6 -20.918 2.359 5.176 41 HB2 ARG 6 HB2 ARG 6 -21.653 1.071 2.629 42 HB3 ARG 6 HB3 ARG 6 -20.037 0.734 3.264 43 HG2 ARG 6 HG2 ARG 6 -21.450 -0.966 4.147 44 HG3 ARG 6 HG3 ARG 6 -21.136 0.139 5.492 45 HD2 ARG 6 HD2 ARG 6 -23.510 -0.442 5.466 46 HD3 ARG 6 HD3 ARG 6 -23.325 1.272 5.074 47 HE ARG 6 HE ARG 6 -24.096 0.855 2.904 48 HH11 ARG 6 HH11 ARG 6 -23.567 -2.185 4.591 49 HH12 ARG 6 HH12 ARG 6 -24.346 -3.137 3.371 50 HH21 ARG 6 HH21 ARG 6 -25.120 -0.405 1.314 51 HH22 ARG 6 HH22 ARG 6 -25.230 -2.123 1.505 52 H SER 7 H SER 7 -20.727 4.493 2.428 53 HA SER 7 HA SER 7 -18.149 4.293 1.568 54 HB2 SER 7 HB2 SER 7 -19.196 7.061 2.188 55 HB3 SER 7 HB3 SER 7 -18.549 6.424 0.670 56 HG SER 7 HG SER 7 -20.677 6.506 0.196 57 H GLU 8 H GLU 8 -19.288 5.637 4.704 58 HA GLU 8 HA GLU 8 -17.025 7.057 5.445 59 HB2 GLU 8 HB2 GLU 8 -19.168 5.551 6.971 60 HB3 GLU 8 HB3 GLU 8 -17.841 6.361 7.812 61 HG2 GLU 8 HG2 GLU 8 -19.616 7.814 5.808 62 HG3 GLU 8 HG3 GLU 8 -20.049 7.661 7.515 63 H ILE 9 H ILE 9 -17.466 3.559 5.154 64 HA ILE 9 HA ILE 9 -15.209 3.008 6.841 65 HB ILE 9 HB ILE 9 -16.727 0.980 5.208 66 HG12 ILE 9 HG12 ILE 9 -17.435 1.884 8.034 67 HG13 ILE 9 HG13 ILE 9 -18.245 2.522 6.597 68 HG21 ILE 9 HG21 ILE 9 -16.062 -0.511 7.066 69 HG22 ILE 9 HG22 ILE 9 -14.642 0.235 6.257 70 HG23 ILE 9 HG23 ILE 9 -15.200 0.857 7.847 71 HD11 ILE 9 HD11 ILE 9 -19.539 0.690 7.601 72 HD12 ILE 9 HD12 ILE 9 -18.957 0.232 5.965 73 HD13 ILE 9 HD13 ILE 9 -18.135 -0.416 7.424 74 H ALA 10 H ALA 10 -15.381 4.141 3.691 75 HA ALA 10 HA ALA 10 -12.843 2.823 3.072 76 HB1 ALA 10 HB1 ALA 10 -13.650 2.370 0.752 77 HB2 ALA 10 HB2 ALA 10 -14.591 1.451 1.975 78 HB3 ALA 10 HB3 ALA 10 -15.291 2.926 1.227 79 H GLY 11 H GLY 11 -12.054 3.845 0.768 80 HA2 GLY 11 HA2 GLY 11 -12.790 6.324 -0.071 81 HA3 GLY 11 HA3 GLY 11 -11.818 6.650 1.370 82 H LYS 12 H LYS 12 -10.227 7.719 -0.050 83 HA LYS 12 HA LYS 12 -8.654 5.798 -1.644 84 HB2 LYS 12 HB2 LYS 12 -7.811 7.793 -2.842 85 HB3 LYS 12 HB3 LYS 12 -9.560 7.590 -3.009 86 HG2 LYS 12 HG2 LYS 12 -9.882 9.329 -1.195 87 HG3 LYS 12 HG3 LYS 12 -8.132 9.584 -1.182 88 HD2 LYS 12 HD2 LYS 12 -8.142 10.304 -3.516 89 HD3 LYS 12 HD3 LYS 12 -9.835 9.831 -3.712 90 HE2 LYS 12 HE2 LYS 12 -10.046 12.130 -3.385 91 HE3 LYS 12 HE3 LYS 12 -10.289 11.526 -1.741 92 HZ1 LYS 12 HZ1 LYS 12 -8.578 13.414 -2.312 93 HZ2 LYS 12 HZ2 LYS 12 -8.328 12.374 -1.079 94 HZ3 LYS 12 HZ3 LYS 12 -7.565 12.148 -2.505 95 H TRP 13 H TRP 13 -6.364 5.717 -1.324 96 HA TRP 13 HA TRP 13 -5.360 7.303 0.951 97 HB2 TRP 13 HB2 TRP 13 -4.676 4.376 0.431 98 HB3 TRP 13 HB3 TRP 13 -4.243 5.361 1.835 99 HD1 TRP 13 HD1 TRP 13 -6.631 2.756 0.876 100 HE1 TRP 13 HE1 TRP 13 -8.658 2.680 2.481 101 HE3 TRP 13 HE3 TRP 13 -5.993 7.298 3.192 102 HZ2 TRP 13 HZ2 TRP 13 -9.836 4.309 4.451 103 HZ3 TRP 13 HZ3 TRP 13 -7.621 7.977 4.940 104 HH2 TRP 13 HH2 TRP 13 -9.513 6.501 5.558 105 H TYR 14 H TYR 14 -3.133 7.941 0.741 106 HA TYR 14 HA TYR 14 -2.000 7.370 -1.935 107 HB2 TYR 14 HB2 TYR 14 -1.523 9.754 -0.084 108 HB3 TYR 14 HB3 TYR 14 -0.857 9.528 -1.707 109 HD1 TYR 14 HD1 TYR 14 -4.098 9.903 0.151 110 HD2 TYR 14 HD2 TYR 14 -2.071 10.241 -3.619 111 HE1 TYR 14 HE1 TYR 14 -6.096 10.995 -0.821 112 HE2 TYR 14 HE2 TYR 14 -4.071 11.326 -4.598 113 HH TYR 14 HH TYR 14 -6.368 11.608 -4.280 114 H VAL 15 H VAL 15 -0.250 5.924 -1.955 115 HA VAL 15 HA VAL 15 1.019 5.453 0.698 116 HB VAL 15 HB VAL 15 0.426 3.606 -0.905 117 HG11 VAL 15 HG11 VAL 15 1.745 3.181 -2.935 118 HG12 VAL 15 HG12 VAL 15 0.730 4.659 -3.050 119 HG13 VAL 15 HG13 VAL 15 2.498 4.804 -2.771 120 HG21 VAL 15 HG21 VAL 15 2.643 2.448 -0.813 121 HG22 VAL 15 HG22 VAL 15 3.424 4.022 -0.445 122 HG23 VAL 15 HG23 VAL 15 2.254 3.307 0.715 123 H VAL 16 H VAL 16 2.327 6.976 1.343 124 HA VAL 16 HA VAL 16 3.968 8.439 -0.598 125 HB VAL 16 HB VAL 16 4.345 10.013 1.263 126 HG11 VAL 16 HG11 VAL 16 2.090 10.984 1.399 127 HG12 VAL 16 HG12 VAL 16 2.500 10.438 -0.263 128 HG13 VAL 16 HG13 VAL 16 1.418 9.442 0.768 129 HG21 VAL 16 HG21 VAL 16 3.057 9.869 3.358 130 HG22 VAL 16 HG22 VAL 16 2.441 8.264 2.837 131 HG23 VAL 16 HG23 VAL 16 4.193 8.492 3.160 132 H ALA 17 H ALA 17 4.182 5.596 1.106 133 HA ALA 17 HA ALA 17 7.063 5.938 1.500 134 HB1 ALA 17 HB1 ALA 17 6.942 4.727 3.648 135 HB2 ALA 17 HB2 ALA 17 6.085 6.304 3.716 136 HB3 ALA 17 HB3 ALA 17 5.148 4.779 3.571 137 H LEU 18 H LEU 18 8.236 3.885 1.363 138 HA LEU 18 HA LEU 18 6.694 1.535 0.682 139 HB2 LEU 18 HB2 LEU 18 8.553 2.937 -1.297 140 HB3 LEU 18 HB3 LEU 18 7.981 1.274 -1.479 141 HG LEU 18 HG LEU 18 6.136 3.695 -1.346 142 HD11 LEU 18 HD11 LEU 18 5.933 3.450 -3.801 143 HD12 LEU 18 HD12 LEU 18 7.608 3.865 -3.304 144 HD13 LEU 18 HD13 LEU 18 7.202 2.180 -3.774 145 HD21 LEU 18 HD21 LEU 18 4.478 2.134 -2.312 146 HD22 LEU 18 HD22 LEU 18 5.683 0.805 -2.221 147 HD23 LEU 18 HD23 LEU 18 5.078 1.573 -0.714 148 H ALA 19 H ALA 19 7.917 -0.415 0.853 149 HA ALA 19 HA ALA 19 10.797 -0.187 1.375 150 HB1 ALA 19 HB1 ALA 19 10.581 -1.480 3.457 151 HB2 ALA 19 HB2 ALA 19 9.761 0.112 3.590 152 HB3 ALA 19 HB3 ALA 19 8.792 -1.379 3.344 153 H SER 20 H SER 20 11.849 -2.007 0.534 154 HA SER 20 HA SER 20 10.161 -4.327 -0.096 155 HB2 SER 20 HB2 SER 20 12.174 -3.103 -2.057 156 HB3 SER 20 HB3 SER 20 11.051 -4.435 -2.360 157 HG SER 20 HG SER 20 10.373 -2.284 -3.181 158 H ASN 21 H ASN 21 11.293 -6.351 -0.198 159 HA ASN 21 HA ASN 21 13.855 -6.268 1.227 160 HB2 ASN 21 HB2 ASN 21 11.683 -7.706 1.783 161 HB3 ASN 21 HB3 ASN 21 12.300 -8.768 0.511 162 HD21 ASN 21 HD21 ASN 21 15.118 -8.549 0.997 163 HD22 ASN 21 HD22 ASN 21 15.447 -9.305 2.520 164 H THR 22 H THR 22 12.707 -6.441 -2.051 165 HA THR 22 HA THR 22 15.102 -7.978 -2.864 166 HB THR 22 HB THR 22 13.707 -7.641 -5.132 167 HG1 THR 22 HG1 THR 22 11.560 -7.229 -4.777 168 HG21 THR 22 HG21 THR 22 12.573 -9.790 -4.670 169 HG22 THR 22 HG22 THR 22 14.272 -9.806 -4.087 170 HG23 THR 22 HG23 THR 22 12.924 -9.600 -2.919 171 H GLU 23 H GLU 23 16.844 -7.135 -3.830 172 HA GLU 23 HA GLU 23 17.360 -4.437 -3.725 173 HB2 GLU 23 HB2 GLU 23 18.552 -5.956 -6.035 174 HB3 GLU 23 HB3 GLU 23 19.355 -4.987 -4.792 175 HG2 GLU 23 HG2 GLU 23 18.235 -7.784 -4.313 176 HG3 GLU 23 HG3 GLU 23 19.909 -7.451 -4.776 177 H PHE 24 H PHE 24 16.239 -6.420 -6.612 178 HA PHE 24 HA PHE 24 16.286 -4.418 -8.487 179 HB2 PHE 24 HB2 PHE 24 14.324 -6.752 -8.086 180 HB3 PHE 24 HB3 PHE 24 14.381 -5.775 -9.559 181 HD1 PHE 24 HD1 PHE 24 16.407 -5.827 -11.018 182 HD2 PHE 24 HD2 PHE 24 15.964 -8.452 -7.648 183 HE1 PHE 24 HE1 PHE 24 18.184 -7.291 -11.927 184 HE2 PHE 24 HE2 PHE 24 17.742 -9.918 -8.553 185 HZ PHE 24 HZ PHE 24 18.856 -9.341 -10.696 186 H PHE 25 H PHE 25 13.431 -5.319 -6.347 187 HA PHE 25 HA PHE 25 11.729 -3.370 -7.373 188 HB2 PHE 25 HB2 PHE 25 11.908 -4.747 -4.661 189 HB3 PHE 25 HB3 PHE 25 10.612 -3.616 -5.071 190 HD1 PHE 25 HD1 PHE 25 12.310 -6.678 -6.458 191 HD2 PHE 25 HD2 PHE 25 8.671 -4.446 -6.024 192 HE1 PHE 25 HE1 PHE 25 11.061 -8.504 -7.568 193 HE2 PHE 25 HE2 PHE 25 7.420 -6.267 -7.132 194 HZ PHE 25 HZ PHE 25 8.612 -8.301 -7.909 195 H LEU 26 H LEU 26 14.087 -3.167 -4.597 196 HA LEU 26 HA LEU 26 13.371 -0.593 -3.763 197 HB2 LEU 26 HB2 LEU 26 16.121 -1.920 -3.800 198 HB3 LEU 26 HB3 LEU 26 15.635 -0.545 -2.798 199 HG LEU 26 HG LEU 26 14.461 -3.353 -2.613 200 HD11 LEU 26 HD11 LEU 26 15.711 -3.501 -0.489 201 HD12 LEU 26 HD12 LEU 26 16.804 -3.301 -1.900 202 HD13 LEU 26 HD13 LEU 26 16.461 -1.904 -0.824 203 HD21 LEU 26 HD21 LEU 26 13.449 -2.518 -0.515 204 HD22 LEU 26 HD22 LEU 26 14.103 -0.881 -0.858 205 HD23 LEU 26 HD23 LEU 26 12.872 -1.602 -1.948 206 H ARG 27 H ARG 27 15.771 -1.789 -6.217 207 HA ARG 27 HA ARG 27 16.905 0.660 -6.884 208 HB2 ARG 27 HB2 ARG 27 17.512 -1.794 -7.558 209 HB3 ARG 27 HB3 ARG 27 16.341 -1.580 -8.867 210 HG2 ARG 27 HG2 ARG 27 17.719 0.627 -9.375 211 HG3 ARG 27 HG3 ARG 27 18.983 -0.160 -8.420 212 HD2 ARG 27 HD2 ARG 27 19.449 -0.844 -10.634 213 HD3 ARG 27 HD3 ARG 27 18.617 -2.237 -9.931 214 HE ARG 27 HE ARG 27 16.533 -0.919 -11.040 215 HH11 ARG 27 HH11 ARG 27 19.694 -1.740 -12.358 216 HH12 ARG 27 HH12 ARG 27 19.125 -1.789 -13.993 217 HH21 ARG 27 HH21 ARG 27 15.813 -0.976 -13.164 218 HH22 ARG 27 HH22 ARG 27 16.908 -1.353 -14.452 219 H GLU 28 H GLU 28 13.965 -1.048 -8.240 220 HA GLU 28 HA GLU 28 13.498 1.005 -10.151 221 HB2 GLU 28 HB2 GLU 28 11.644 -1.170 -9.060 222 HB3 GLU 28 HB3 GLU 28 11.349 -0.189 -10.502 223 HG2 GLU 28 HG2 GLU 28 13.563 -2.249 -10.093 224 HG3 GLU 28 HG3 GLU 28 12.165 -2.377 -11.169 225 H LYS 29 H LYS 29 11.717 0.084 -7.060 226 HA LYS 29 HA LYS 29 9.928 2.186 -7.220 227 HB2 LYS 29 HB2 LYS 29 10.997 0.530 -4.921 228 HB3 LYS 29 HB3 LYS 29 9.888 1.874 -4.619 229 HG2 LYS 29 HG2 LYS 29 9.231 -0.329 -6.620 230 HG3 LYS 29 HG3 LYS 29 8.887 -0.502 -4.894 231 HD2 LYS 29 HD2 LYS 29 6.879 0.323 -5.979 232 HD3 LYS 29 HD3 LYS 29 7.534 1.626 -4.978 233 HE2 LYS 29 HE2 LYS 29 8.099 2.939 -6.791 234 HE3 LYS 29 HE3 LYS 29 8.519 1.556 -7.810 235 HZ1 LYS 29 HZ1 LYS 29 6.581 2.033 -8.772 236 HZ2 LYS 29 HZ2 LYS 29 5.876 1.259 -7.519 237 HZ3 LYS 29 HZ3 LYS 29 5.996 2.887 -7.510 238 H ASP 30 H ASP 30 13.164 2.139 -5.500 239 HA ASP 30 HA ASP 30 12.923 4.649 -4.349 240 HB2 ASP 30 HB2 ASP 30 14.743 3.168 -3.748 241 HB3 ASP 30 HB3 ASP 30 15.332 3.098 -5.414 242 H LYS 31 H LYS 31 13.846 3.703 -7.725 243 HA LYS 31 HA LYS 31 14.576 6.397 -8.391 244 HB2 LYS 31 HB2 LYS 31 15.000 3.811 -9.449 245 HB3 LYS 31 HB3 LYS 31 13.940 4.593 -10.628 246 HG2 LYS 31 HG2 LYS 31 16.624 5.667 -9.632 247 HG3 LYS 31 HG3 LYS 31 16.318 4.913 -11.203 248 HD2 LYS 31 HD2 LYS 31 16.165 7.161 -11.782 249 HD3 LYS 31 HD3 LYS 31 14.466 6.804 -11.444 250 HE2 LYS 31 HE2 LYS 31 15.321 7.490 -8.924 251 HE3 LYS 31 HE3 LYS 31 16.421 8.473 -9.900 252 HZ1 LYS 31 HZ1 LYS 31 14.420 9.666 -9.441 253 HZ2 LYS 31 HZ2 LYS 31 14.467 9.356 -11.044 254 HZ3 LYS 31 HZ3 LYS 31 13.477 8.493 -10.074 255 H MET 32 H MET 32 11.378 4.518 -8.250 256 HA MET 32 HA MET 32 10.549 6.454 -10.330 257 HB2 MET 32 HB2 MET 32 9.324 4.133 -8.477 258 HB3 MET 32 HB3 MET 32 8.218 5.065 -9.494 259 HG2 MET 32 HG2 MET 32 10.455 4.032 -11.082 260 HG3 MET 32 HG3 MET 32 9.665 2.722 -10.195 261 HE1 MET 32 HE1 MET 32 7.461 5.578 -13.133 262 HE2 MET 32 HE2 MET 32 8.314 6.113 -11.646 263 HE3 MET 32 HE3 MET 32 9.251 5.473 -13.038 264 H LYS 33 H LYS 33 7.690 6.227 -8.573 265 HA LYS 33 HA LYS 33 8.384 8.621 -6.980 266 HB2 LYS 33 HB2 LYS 33 6.228 8.677 -9.116 267 HB3 LYS 33 HB3 LYS 33 6.406 9.867 -7.819 268 HG2 LYS 33 HG2 LYS 33 8.626 10.517 -8.657 269 HG3 LYS 33 HG3 LYS 33 8.570 9.247 -9.887 270 HD2 LYS 33 HD2 LYS 33 6.616 10.322 -10.963 271 HD3 LYS 33 HD3 LYS 33 6.557 11.549 -9.690 272 HE2 LYS 33 HE2 LYS 33 8.848 12.322 -10.324 273 HE3 LYS 33 HE3 LYS 33 8.917 11.090 -11.590 274 HZ1 LYS 33 HZ1 LYS 33 8.259 13.218 -12.462 275 HZ2 LYS 33 HZ2 LYS 33 7.028 12.160 -12.639 276 HZ3 LYS 33 HZ3 LYS 33 6.965 13.298 -11.470 277 H MET 34 H MET 34 5.950 9.273 -5.906 278 HA MET 34 HA MET 34 5.393 7.026 -4.235 279 HB2 MET 34 HB2 MET 34 5.148 9.283 -3.346 280 HB3 MET 34 HB3 MET 34 4.204 9.820 -4.741 281 HG2 MET 34 HG2 MET 34 2.319 8.325 -3.992 282 HG3 MET 34 HG3 MET 34 3.263 7.903 -2.557 283 HE1 MET 34 HE1 MET 34 1.462 12.052 -3.534 284 HE2 MET 34 HE2 MET 34 3.124 11.721 -4.130 285 HE3 MET 34 HE3 MET 34 1.754 10.695 -4.674 286 H ALA 35 H ALA 35 3.389 5.843 -4.081 287 HA ALA 35 HA ALA 35 1.957 5.646 -6.627 288 HB1 ALA 35 HB1 ALA 35 1.418 3.345 -5.957 289 HB2 ALA 35 HB2 ALA 35 3.186 3.634 -6.089 290 HB3 ALA 35 HB3 ALA 35 2.407 3.558 -4.473 291 H MET 36 H MET 36 -0.358 4.460 -6.079 292 HA MET 36 HA MET 36 -1.541 5.908 -3.828 293 HB2 MET 36 HB2 MET 36 -2.785 5.590 -6.602 294 HB3 MET 36 HB3 MET 36 -3.455 6.491 -5.235 295 HG2 MET 36 HG2 MET 36 -0.852 7.559 -5.665 296 HG3 MET 36 HG3 MET 36 -1.558 7.348 -7.273 297 HE1 MET 36 HE1 MET 36 -1.278 10.704 -5.339 298 HE2 MET 36 HE2 MET 36 -0.638 9.729 -6.705 299 HE3 MET 36 HE3 MET 36 -1.930 10.942 -6.996 300 H ALA 37 H ALA 37 -3.852 5.088 -3.309 301 HA ALA 37 HA ALA 37 -4.511 2.416 -4.235 302 HB1 ALA 37 HB1 ALA 37 -4.207 1.394 -1.973 303 HB2 ALA 37 HB2 ALA 37 -2.635 1.963 -2.630 304 HB3 ALA 37 HB3 ALA 37 -3.486 2.927 -1.376 305 H ARG 38 H ARG 38 -6.644 2.302 -4.291 306 HA ARG 38 HA ARG 38 -8.204 3.784 -2.244 307 HB2 ARG 38 HB2 ARG 38 -8.416 5.051 -4.255 308 HB3 ARG 38 HB3 ARG 38 -8.636 3.599 -5.240 309 HG2 ARG 38 HG2 ARG 38 -10.625 3.940 -3.040 310 HG3 ARG 38 HG3 ARG 38 -10.674 5.183 -4.297 311 HD2 ARG 38 HD2 ARG 38 -10.605 3.183 -5.994 312 HD3 ARG 38 HD3 ARG 38 -11.018 2.169 -4.605 313 HE ARG 38 HE ARG 38 -13.187 2.942 -4.770 314 HH11 ARG 38 HH11 ARG 38 -11.079 5.243 -6.395 315 HH12 ARG 38 HH12 ARG 38 -12.379 6.286 -6.868 316 HH21 ARG 38 HH21 ARG 38 -14.880 4.335 -5.387 317 HH22 ARG 38 HH22 ARG 38 -14.536 5.769 -6.295 318 H ILE 39 H ILE 39 -9.626 2.325 -1.213 319 HA ILE 39 HA ILE 39 -9.829 -0.303 -2.423 320 HB ILE 39 HB ILE 39 -10.252 0.258 0.520 321 HG12 ILE 39 HG12 ILE 39 -8.044 1.117 0.072 322 HG13 ILE 39 HG13 ILE 39 -7.909 -0.423 0.931 323 HG21 ILE 39 HG21 ILE 39 -9.635 -2.131 0.753 324 HG22 ILE 39 HG22 ILE 39 -11.062 -1.894 -0.311 325 HG23 ILE 39 HG23 ILE 39 -9.455 -2.247 -1.030 326 HD11 ILE 39 HD11 ILE 39 -6.230 -0.252 -0.849 327 HD12 ILE 39 HD12 ILE 39 -7.388 -1.579 -1.198 328 HD13 ILE 39 HD13 ILE 39 -7.526 -0.015 -2.070 329 H SER 40 H SER 40 -11.899 -1.498 -2.164 330 HA SER 40 HA SER 40 -14.160 0.048 -1.129 331 HB2 SER 40 HB2 SER 40 -13.968 -1.067 -3.973 332 HB3 SER 40 HB3 SER 40 -15.437 -0.428 -3.224 333 HG SER 40 HG SER 40 -13.447 1.406 -2.879 334 H PHE 41 H PHE 41 -15.705 -1.256 -0.133 335 HA PHE 41 HA PHE 41 -14.929 -3.948 0.360 336 HB2 PHE 41 HB2 PHE 41 -17.164 -4.041 1.551 337 HB3 PHE 41 HB3 PHE 41 -16.033 -2.807 2.122 338 HD1 PHE 41 HD1 PHE 41 -19.226 -3.418 0.381 339 HD2 PHE 41 HD2 PHE 41 -16.490 -0.434 1.809 340 HE1 PHE 41 HE1 PHE 41 -20.978 -1.689 0.118 341 HE2 PHE 41 HE2 PHE 41 -18.237 1.299 1.543 342 HZ PHE 41 HZ PHE 41 -20.488 0.675 0.696 343 H LEU 42 H LEU 42 -15.048 -5.538 -1.140 344 HA LEU 42 HA LEU 42 -16.959 -5.441 -3.283 345 HB2 LEU 42 HB2 LEU 42 -14.503 -6.483 -3.054 346 HB3 LEU 42 HB3 LEU 42 -15.400 -7.902 -2.498 347 HG LEU 42 HG LEU 42 -14.854 -8.049 -4.874 348 HD11 LEU 42 HD11 LEU 42 -17.107 -8.542 -5.757 349 HD12 LEU 42 HD12 LEU 42 -16.885 -9.155 -4.084 350 HD13 LEU 42 HD13 LEU 42 -17.835 -7.658 -4.373 351 HD21 LEU 42 HD21 LEU 42 -15.911 -6.539 -6.524 352 HD22 LEU 42 HD22 LEU 42 -16.568 -5.544 -5.181 353 HD23 LEU 42 HD23 LEU 42 -14.793 -5.664 -5.424 354 H GLY 43 H GLY 43 -16.681 -7.025 -0.072 355 HA2 GLY 43 HA2 GLY 43 -19.443 -7.642 0.012 356 HA3 GLY 43 HA3 GLY 43 -18.507 -9.088 -0.388 357 H GLU 44 H GLU 44 -19.748 -9.313 2.021 358 HA GLU 44 HA GLU 44 -18.521 -8.138 4.208 359 HB2 GLU 44 HB2 GLU 44 -19.782 -10.899 3.901 360 HB3 GLU 44 HB3 GLU 44 -19.332 -10.177 5.451 361 HG2 GLU 44 HG2 GLU 44 -20.855 -8.188 4.783 362 HG3 GLU 44 HG3 GLU 44 -21.461 -9.231 3.489 363 H ASP 45 H ASP 45 -17.529 -11.071 2.308 364 HA ASP 45 HA ASP 45 -15.121 -11.198 4.011 365 HB2 ASP 45 HB2 ASP 45 -16.730 -13.202 3.923 366 HB3 ASP 45 HB3 ASP 45 -16.332 -13.362 2.207 367 H GLU 46 H GLU 46 -15.992 -9.735 1.160 368 HA GLU 46 HA GLU 46 -13.349 -10.334 0.018 369 HB2 GLU 46 HB2 GLU 46 -15.075 -11.556 -1.273 370 HB3 GLU 46 HB3 GLU 46 -15.975 -10.054 -1.517 371 HG2 GLU 46 HG2 GLU 46 -14.421 -9.192 -3.035 372 HG3 GLU 46 HG3 GLU 46 -13.087 -10.160 -2.395 373 H LEU 47 H LEU 47 -12.496 -8.585 -1.389 374 HA LEU 47 HA LEU 47 -13.746 -6.040 -1.025 375 HB2 LEU 47 HB2 LEU 47 -11.685 -4.978 -0.143 376 HB3 LEU 47 HB3 LEU 47 -12.551 -6.026 0.989 377 HG LEU 47 HG LEU 47 -10.183 -7.059 -0.600 378 HD11 LEU 47 HD11 LEU 47 -8.748 -6.476 1.328 379 HD12 LEU 47 HD12 LEU 47 -9.435 -5.015 0.540 380 HD13 LEU 47 HD13 LEU 47 -10.127 -5.611 2.087 381 HD21 LEU 47 HD21 LEU 47 -10.002 -8.598 1.330 382 HD22 LEU 47 HD22 LEU 47 -11.426 -7.809 2.088 383 HD23 LEU 47 HD23 LEU 47 -11.612 -8.703 0.541 384 H LYS 48 H LYS 48 -12.856 -4.333 -2.356 385 HA LYS 48 HA LYS 48 -11.221 -5.352 -4.574 386 HB2 LYS 48 HB2 LYS 48 -13.475 -4.980 -5.342 387 HB3 LYS 48 HB3 LYS 48 -13.574 -3.423 -4.511 388 HG2 LYS 48 HG2 LYS 48 -11.632 -2.654 -6.047 389 HG3 LYS 48 HG3 LYS 48 -11.933 -4.124 -6.983 390 HD2 LYS 48 HD2 LYS 48 -14.271 -2.320 -6.299 391 HD3 LYS 48 HD3 LYS 48 -13.157 -1.824 -7.580 392 HE2 LYS 48 HE2 LYS 48 -14.487 -4.577 -7.501 393 HE3 LYS 48 HE3 LYS 48 -15.206 -3.183 -8.318 394 HZ1 LYS 48 HZ1 LYS 48 -13.995 -4.331 -9.921 395 HZ2 LYS 48 HZ2 LYS 48 -13.039 -3.057 -9.562 396 HZ3 LYS 48 HZ3 LYS 48 -12.682 -4.537 -8.973 397 H VAL 49 H VAL 49 -9.472 -3.980 -5.253 398 HA VAL 49 HA VAL 49 -9.306 -1.392 -3.900 399 HB VAL 49 HB VAL 49 -7.002 -1.739 -3.302 400 HG11 VAL 49 HG11 VAL 49 -7.196 -3.557 -1.629 401 HG12 VAL 49 HG12 VAL 49 -8.665 -2.525 -1.677 402 HG13 VAL 49 HG13 VAL 49 -8.680 -4.146 -2.451 403 HG21 VAL 49 HG21 VAL 49 -5.838 -3.891 -3.650 404 HG22 VAL 49 HG22 VAL 49 -7.253 -4.500 -4.573 405 HG23 VAL 49 HG23 VAL 49 -6.300 -3.113 -5.201 406 H SER 50 H SER 50 -8.352 0.257 -5.166 407 HA SER 50 HA SER 50 -7.567 -0.589 -7.906 408 HB2 SER 50 HB2 SER 50 -8.211 1.773 -8.488 409 HB3 SER 50 HB3 SER 50 -9.566 0.763 -7.968 410 HG SER 50 HG SER 50 -8.836 1.765 -5.707 411 H TYR 51 H TYR 51 -5.423 -0.359 -8.344 412 HA TYR 51 HA TYR 51 -3.806 1.192 -6.450 413 HB2 TYR 51 HB2 TYR 51 -3.333 -0.967 -8.556 414 HB3 TYR 51 HB3 TYR 51 -1.989 0.074 -8.069 415 HD1 TYR 51 HD1 TYR 51 -1.458 0.192 -5.514 416 HD2 TYR 51 HD2 TYR 51 -3.830 -2.894 -7.326 417 HE1 TYR 51 HE1 TYR 51 -0.948 -1.314 -3.618 418 HE2 TYR 51 HE2 TYR 51 -3.355 -4.385 -5.410 419 HH TYR 51 HH TYR 51 -1.180 -4.479 -3.684 420 H ALA 52 H ALA 52 -2.542 2.989 -7.196 421 HA ALA 52 HA ALA 52 -2.774 3.651 -10.062 422 HB1 ALA 52 HB1 ALA 52 -3.092 6.016 -9.427 423 HB2 ALA 52 HB2 ALA 52 -4.443 4.984 -8.849 424 HB3 ALA 52 HB3 ALA 52 -3.182 5.539 -7.698 425 H VAL 53 H VAL 53 -0.722 3.883 -10.921 426 HA VAL 53 HA VAL 53 1.297 5.039 -9.163 427 HB VAL 53 HB VAL 53 2.981 3.380 -10.036 428 HG11 VAL 53 HG11 VAL 53 2.314 1.543 -8.519 429 HG12 VAL 53 HG12 VAL 53 2.036 3.159 -7.785 430 HG13 VAL 53 HG13 VAL 53 0.652 2.221 -8.440 431 HG21 VAL 53 HG21 VAL 53 2.167 1.234 -10.956 432 HG22 VAL 53 HG22 VAL 53 0.497 1.893 -10.999 433 HG23 VAL 53 HG23 VAL 53 1.776 2.620 -12.028 434 HA PRO 54 HA PRO 54 2.121 7.118 -13.080 435 HB2 PRO 54 HB2 PRO 54 4.184 8.707 -12.173 436 HB3 PRO 54 HB3 PRO 54 2.559 8.982 -11.530 437 HG2 PRO 54 HG2 PRO 54 4.895 7.538 -10.272 438 HG3 PRO 54 HG3 PRO 54 3.701 8.601 -9.517 439 HD2 PRO 54 HD2 PRO 54 3.612 5.802 -9.435 440 HD3 PRO 54 HD3 PRO 54 2.222 6.856 -9.143 441 H LYS 55 H LYS 55 2.798 5.412 -14.358 442 HA LYS 55 HA LYS 55 5.541 4.514 -14.092 443 HB2 LYS 55 HB2 LYS 55 3.588 2.911 -14.438 444 HB3 LYS 55 HB3 LYS 55 3.418 3.579 -16.066 445 HG2 LYS 55 HG2 LYS 55 5.896 2.936 -16.436 446 HG3 LYS 55 HG3 LYS 55 5.782 2.023 -14.926 447 HD2 LYS 55 HD2 LYS 55 3.849 0.728 -15.859 448 HD3 LYS 55 HD3 LYS 55 3.975 1.635 -17.372 449 HE2 LYS 55 HE2 LYS 55 5.249 -0.198 -17.958 450 HE3 LYS 55 HE3 LYS 55 6.528 0.807 -17.264 451 HZ1 LYS 55 HZ1 LYS 55 6.587 -1.423 -16.398 452 HZ2 LYS 55 HZ2 LYS 55 6.243 -0.384 -15.186 453 HZ3 LYS 55 HZ3 LYS 55 5.062 -1.312 -15.826 454 HA PRO 56 HA PRO 56 7.160 7.239 -17.278 455 HB2 PRO 56 HB2 PRO 56 8.051 4.610 -18.604 456 HB3 PRO 56 HB3 PRO 56 9.026 6.053 -18.294 457 HG2 PRO 56 HG2 PRO 56 9.295 3.911 -16.720 458 HG3 PRO 56 HG3 PRO 56 9.329 5.531 -16.013 459 HD2 PRO 56 HD2 PRO 56 7.132 3.462 -15.926 460 HD3 PRO 56 HD3 PRO 56 7.581 4.667 -14.711 461 H ASN 57 H ASN 57 5.332 4.295 -18.289 462 HA ASN 57 HA ASN 57 4.801 5.428 -20.872 463 HB2 ASN 57 HB2 ASN 57 3.333 3.120 -19.501 464 HB3 ASN 57 HB3 ASN 57 3.503 3.417 -21.236 465 HD21 ASN 57 HD21 ASN 57 5.383 2.763 -22.310 466 HD22 ASN 57 HD22 ASN 57 6.613 1.803 -21.558 467 H GLY 58 H GLY 58 3.717 6.504 -17.916 468 HA2 GLY 58 HA2 GLY 58 2.033 8.234 -18.075 469 HA3 GLY 58 HA3 GLY 58 1.056 7.130 -19.052 470 H CYS 59 H CYS 59 -0.132 8.258 -16.807 471 HA CYS 59 HA CYS 59 0.170 6.979 -14.400 472 HB2 CYS 59 HB2 CYS 59 -2.379 7.963 -15.781 473 HB3 CYS 59 HB3 CYS 59 -2.262 7.561 -14.062 474 H ARG 60 H ARG 60 0.012 4.831 -13.831 475 HA ARG 60 HA ARG 60 -1.880 3.193 -15.372 476 HB2 ARG 60 HB2 ARG 60 0.818 2.887 -15.248 477 HB3 ARG 60 HB3 ARG 60 0.322 1.895 -13.871 478 HG2 ARG 60 HG2 ARG 60 0.349 0.363 -15.638 479 HG3 ARG 60 HG3 ARG 60 -1.364 0.782 -15.511 480 HD2 ARG 60 HD2 ARG 60 0.660 1.848 -17.540 481 HD3 ARG 60 HD3 ARG 60 -0.731 0.804 -17.861 482 HE ARG 60 HE ARG 60 -0.896 3.681 -17.070 483 HH11 ARG 60 HH11 ARG 60 -2.295 0.836 -18.591 484 HH12 ARG 60 HH12 ARG 60 -3.674 1.693 -19.195 485 HH21 ARG 60 HH21 ARG 60 -2.708 4.778 -17.849 486 HH22 ARG 60 HH22 ARG 60 -3.909 3.938 -18.772 487 H LYS 61 H LYS 61 -3.396 1.916 -14.381 488 HA LYS 61 HA LYS 61 -3.303 1.932 -11.436 489 HB2 LYS 61 HB2 LYS 61 -5.748 2.176 -11.409 490 HB3 LYS 61 HB3 LYS 61 -4.955 3.586 -12.125 491 HG2 LYS 61 HG2 LYS 61 -5.703 3.073 -14.305 492 HG3 LYS 61 HG3 LYS 61 -5.990 1.370 -13.921 493 HD2 LYS 61 HD2 LYS 61 -7.566 3.618 -12.580 494 HD3 LYS 61 HD3 LYS 61 -8.063 2.920 -14.127 495 HE2 LYS 61 HE2 LYS 61 -8.168 0.660 -13.099 496 HE3 LYS 61 HE3 LYS 61 -7.605 1.317 -11.557 497 HZ1 LYS 61 HZ1 LYS 61 -10.152 1.046 -12.177 498 HZ2 LYS 61 HZ2 LYS 61 -9.618 2.182 -11.133 499 HZ3 LYS 61 HZ3 LYS 61 -9.946 2.586 -12.680 500 H TRP 62 H TRP 62 -4.467 0.041 -10.458 501 HA TRP 62 HA TRP 62 -5.090 -2.133 -12.355 502 HB2 TRP 62 HB2 TRP 62 -2.584 -2.059 -11.446 503 HB3 TRP 62 HB3 TRP 62 -3.334 -2.722 -9.988 504 HD1 TRP 62 HD1 TRP 62 -3.561 -5.302 -9.957 505 HE1 TRP 62 HE1 TRP 62 -3.533 -7.183 -11.733 506 HE3 TRP 62 HE3 TRP 62 -3.349 -2.407 -14.197 507 HZ2 TRP 62 HZ2 TRP 62 -3.451 -7.424 -14.534 508 HZ3 TRP 62 HZ3 TRP 62 -3.306 -3.541 -16.405 509 HH2 TRP 62 HH2 TRP 62 -3.359 -6.014 -16.568 510 H GLU 63 H GLU 63 -6.563 -3.728 -11.438 511 HA GLU 63 HA GLU 63 -7.894 -2.537 -9.020 512 HB2 GLU 63 HB2 GLU 63 -9.136 -4.569 -10.985 513 HB3 GLU 63 HB3 GLU 63 -9.975 -3.447 -9.906 514 HG2 GLU 63 HG2 GLU 63 -8.398 -2.595 -12.376 515 HG3 GLU 63 HG3 GLU 63 -10.141 -2.897 -12.362 516 H THR 64 H THR 64 -7.792 -3.982 -7.263 517 HA THR 64 HA THR 64 -7.060 -6.762 -7.814 518 HB THR 64 HB THR 64 -6.190 -5.143 -5.361 519 HG1 THR 64 HG1 THR 64 -4.602 -4.314 -6.533 520 HG21 THR 64 HG21 THR 64 -4.520 -6.969 -5.122 521 HG22 THR 64 HG22 THR 64 -6.201 -7.600 -5.101 522 HG23 THR 64 HG23 THR 64 -5.197 -7.769 -6.581 523 H THR 65 H THR 65 -8.200 -8.346 -6.682 524 HA THR 65 HA THR 65 -10.249 -7.386 -4.805 525 HB THR 65 HB THR 65 -10.175 -10.045 -6.252 526 HG1 THR 65 HG1 THR 65 -11.688 -8.989 -7.742 527 HG21 THR 65 HG21 THR 65 -12.605 -9.994 -5.777 528 HG22 THR 65 HG22 THR 65 -11.631 -9.899 -4.272 529 HG23 THR 65 HG23 THR 65 -12.403 -8.420 -4.936 530 H PHE 66 H PHE 66 -10.218 -8.135 -2.650 531 HA PHE 66 HA PHE 66 -8.228 -10.235 -2.112 532 HB2 PHE 66 HB2 PHE 66 -8.875 -7.716 -0.492 533 HB3 PHE 66 HB3 PHE 66 -7.882 -9.050 0.108 534 HD1 PHE 66 HD1 PHE 66 -5.664 -9.520 -0.908 535 HD2 PHE 66 HD2 PHE 66 -8.011 -6.112 -2.060 536 HE1 PHE 66 HE1 PHE 66 -3.658 -8.484 -1.921 537 HE2 PHE 66 HE2 PHE 66 -6.004 -5.069 -3.064 538 HZ PHE 66 HZ PHE 66 -3.822 -6.254 -3.001 539 H LYS 67 H LYS 67 -8.617 -11.356 0.053 540 HA LYS 67 HA LYS 67 -11.521 -11.674 0.449 541 HB2 LYS 67 HB2 LYS 67 -9.179 -13.533 0.312 542 HB3 LYS 67 HB3 LYS 67 -10.339 -13.864 1.606 543 HG2 LYS 67 HG2 LYS 67 -10.911 -15.175 -0.364 544 HG3 LYS 67 HG3 LYS 67 -12.179 -13.980 -0.061 545 HD2 LYS 67 HD2 LYS 67 -11.365 -12.536 -1.842 546 HD3 LYS 67 HD3 LYS 67 -9.890 -13.493 -2.029 547 HE2 LYS 67 HE2 LYS 67 -11.139 -15.410 -2.863 548 HE3 LYS 67 HE3 LYS 67 -12.685 -14.660 -2.445 549 HZ1 LYS 67 HZ1 LYS 67 -12.214 -14.438 -4.769 550 HZ2 LYS 67 HZ2 LYS 67 -12.215 -12.955 -4.087 551 HZ3 LYS 67 HZ3 LYS 67 -10.802 -13.670 -4.483 552 H LYS 68 H LYS 68 -12.293 -11.865 2.661 553 HA LYS 68 HA LYS 68 -11.017 -10.165 4.476 554 HB2 LYS 68 HB2 LYS 68 -13.465 -10.696 4.409 555 HB3 LYS 68 HB3 LYS 68 -13.117 -12.348 4.934 556 HG2 LYS 68 HG2 LYS 68 -13.809 -11.228 6.898 557 HG3 LYS 68 HG3 LYS 68 -12.048 -11.319 7.038 558 HD2 LYS 68 HD2 LYS 68 -12.836 -9.066 7.652 559 HD3 LYS 68 HD3 LYS 68 -11.839 -8.987 6.194 560 HE2 LYS 68 HE2 LYS 68 -13.819 -8.845 4.762 561 HE3 LYS 68 HE3 LYS 68 -14.894 -9.156 6.132 562 HZ1 LYS 68 HZ1 LYS 68 -14.836 -6.842 5.688 563 HZ2 LYS 68 HZ2 LYS 68 -14.057 -7.069 7.104 564 HZ3 LYS 68 HZ3 LYS 68 -13.206 -6.771 5.743 565 H THR 69 H THR 69 -9.183 -10.521 5.753 566 HA THR 69 HA THR 69 -8.966 -13.247 6.962 567 HB THR 69 HB THR 69 -6.580 -11.675 5.759 568 HG1 THR 69 HG1 THR 69 -7.536 -13.900 4.280 569 HG21 THR 69 HG21 THR 69 -5.527 -13.929 5.751 570 HG22 THR 69 HG22 THR 69 -6.129 -13.494 7.386 571 HG23 THR 69 HG23 THR 69 -7.058 -14.642 6.363 572 H SER 70 H SER 70 -9.827 -11.978 8.801 573 HA SER 70 HA SER 70 -8.350 -9.727 9.821 574 HB2 SER 70 HB2 SER 70 -10.259 -11.441 11.437 575 HB3 SER 70 HB3 SER 70 -9.966 -9.699 11.528 576 HG SER 70 HG SER 70 -11.987 -10.203 10.467 577 H ASP 71 H ASP 71 -6.249 -11.246 9.479 578 HA ASP 71 HA ASP 71 -5.719 -13.333 11.254 579 HB2 ASP 71 HB2 ASP 71 -4.427 -12.041 9.164 580 HB3 ASP 71 HB3 ASP 71 -3.478 -11.485 10.549 581 H ASP 72 H ASP 72 -4.545 -9.881 11.485 582 HA ASP 72 HA ASP 72 -4.774 -10.118 14.411 583 HB2 ASP 72 HB2 ASP 72 -2.383 -10.422 13.581 584 HB3 ASP 72 HB3 ASP 72 -2.474 -8.802 12.879 585 H GLY 73 H GLY 73 -6.726 -9.081 13.356 586 HA2 GLY 73 HA2 GLY 73 -8.139 -7.617 13.994 587 HA3 GLY 73 HA3 GLY 73 -6.939 -6.324 13.873 588 H GLU 74 H GLU 74 -6.475 -5.568 11.256 589 HA GLU 74 HA GLU 74 -9.045 -6.235 9.860 590 HB2 GLU 74 HB2 GLU 74 -7.618 -3.570 9.894 591 HB3 GLU 74 HB3 GLU 74 -8.785 -4.043 8.653 592 HG2 GLU 74 HG2 GLU 74 -9.927 -2.705 10.297 593 HG3 GLU 74 HG3 GLU 74 -10.518 -4.366 10.430 594 H VAL 75 H VAL 75 -7.158 -8.065 9.434 595 HA VAL 75 HA VAL 75 -5.210 -7.084 7.473 596 HB VAL 75 HB VAL 75 -5.575 -9.782 8.891 597 HG11 VAL 75 HG11 VAL 75 -3.386 -10.403 7.930 598 HG12 VAL 75 HG12 VAL 75 -4.625 -10.124 6.660 599 HG13 VAL 75 HG13 VAL 75 -3.374 -8.877 6.983 600 HG21 VAL 75 HG21 VAL 75 -3.463 -9.153 10.044 601 HG22 VAL 75 HG22 VAL 75 -3.474 -7.576 9.184 602 HG23 VAL 75 HG23 VAL 75 -4.775 -7.968 10.359 603 H TYR 76 H TYR 76 -4.942 -8.380 5.406 604 HA TYR 76 HA TYR 76 -7.302 -9.888 4.607 605 HB2 TYR 76 HB2 TYR 76 -6.367 -7.300 3.306 606 HB3 TYR 76 HB3 TYR 76 -7.305 -8.513 2.425 607 HD1 TYR 76 HD1 TYR 76 -9.606 -9.174 3.337 608 HD2 TYR 76 HD2 TYR 76 -7.438 -5.765 4.789 609 HE1 TYR 76 HE1 TYR 76 -11.700 -8.246 4.272 610 HE2 TYR 76 HE2 TYR 76 -9.531 -4.830 5.725 611 HH TYR 76 HH TYR 76 -11.716 -5.096 6.016 612 H TYR 77 H TYR 77 -6.978 -11.163 2.641 613 HA TYR 77 HA TYR 77 -4.168 -11.411 1.838 614 HB2 TYR 77 HB2 TYR 77 -5.999 -13.581 2.958 615 HB3 TYR 77 HB3 TYR 77 -4.639 -13.970 1.897 616 HD1 TYR 77 HD1 TYR 77 -5.049 -11.624 4.841 617 HD2 TYR 77 HD2 TYR 77 -2.891 -14.901 3.099 618 HE1 TYR 77 HE1 TYR 77 -3.541 -11.665 6.798 619 HE2 TYR 77 HE2 TYR 77 -1.386 -14.956 5.065 620 HH TYR 77 HH TYR 77 -1.918 -13.962 7.828 621 H SER 78 H SER 78 -3.926 -11.965 -0.375 622 HA SER 78 HA SER 78 -6.468 -12.283 -1.838 623 HB2 SER 78 HB2 SER 78 -5.115 -11.474 -3.811 624 HB3 SER 78 HB3 SER 78 -5.421 -10.274 -2.549 625 HG SER 78 HG SER 78 -3.125 -11.509 -1.879 626 H GLU 79 H GLU 79 -6.777 -14.530 -1.910 627 HA GLU 79 HA GLU 79 -4.623 -16.316 -2.074 628 HB2 GLU 79 HB2 GLU 79 -7.522 -16.370 -1.901 629 HB3 GLU 79 HB3 GLU 79 -7.073 -17.393 -3.271 630 HG2 GLU 79 HG2 GLU 79 -6.165 -17.668 -0.372 631 HG3 GLU 79 HG3 GLU 79 -7.195 -18.775 -1.288 632 H GLU 80 H GLU 80 -6.787 -14.964 -4.707 633 HA GLU 80 HA GLU 80 -5.581 -16.591 -6.693 634 HB2 GLU 80 HB2 GLU 80 -6.999 -13.928 -7.116 635 HB3 GLU 80 HB3 GLU 80 -6.815 -15.255 -8.271 636 HG2 GLU 80 HG2 GLU 80 -8.919 -15.797 -7.636 637 HG3 GLU 80 HG3 GLU 80 -8.121 -16.567 -6.259 638 H ALA 81 H ALA 81 -4.604 -13.571 -5.082 639 HA ALA 81 HA ALA 81 -2.776 -13.013 -7.300 640 HB1 ALA 81 HB1 ALA 81 -2.394 -10.869 -6.012 641 HB2 ALA 81 HB2 ALA 81 -4.135 -11.127 -6.370 642 HB3 ALA 81 HB3 ALA 81 -3.496 -11.469 -4.727 643 H LYS 82 H LYS 82 -2.764 -14.561 -4.129 644 HA LYS 82 HA LYS 82 -1.103 -15.510 -2.969 645 HB2 LYS 82 HB2 LYS 82 0.595 -14.758 -5.395 646 HB3 LYS 82 HB3 LYS 82 1.139 -15.778 -4.056 647 HG2 LYS 82 HG2 LYS 82 -1.391 -16.556 -5.520 648 HG3 LYS 82 HG3 LYS 82 0.164 -16.818 -6.321 649 HD2 LYS 82 HD2 LYS 82 -0.297 -18.848 -5.147 650 HD3 LYS 82 HD3 LYS 82 0.944 -18.023 -4.194 651 HE2 LYS 82 HE2 LYS 82 -0.611 -18.727 -2.567 652 HE3 LYS 82 HE3 LYS 82 -1.016 -17.023 -2.809 653 HZ1 LYS 82 HZ1 LYS 82 -2.863 -18.764 -2.830 654 HZ2 LYS 82 HZ2 LYS 82 -2.909 -17.581 -3.954 655 HZ3 LYS 82 HZ3 LYS 82 -2.401 -19.078 -4.364 656 H LYS 83 H LYS 83 -1.855 -12.942 -2.227 657 HA LYS 83 HA LYS 83 0.670 -11.891 -1.215 658 HB2 LYS 83 HB2 LYS 83 -1.401 -9.986 -2.368 659 HB3 LYS 83 HB3 LYS 83 0.301 -9.681 -1.996 660 HG2 LYS 83 HG2 LYS 83 1.063 -10.695 -3.979 661 HG3 LYS 83 HG3 LYS 83 -0.404 -11.662 -4.179 662 HD2 LYS 83 HD2 LYS 83 -1.656 -9.400 -4.478 663 HD3 LYS 83 HD3 LYS 83 -0.055 -8.664 -4.639 664 HE2 LYS 83 HE2 LYS 83 0.476 -10.168 -6.542 665 HE3 LYS 83 HE3 LYS 83 -1.081 -10.987 -6.356 666 HZ1 LYS 83 HZ1 LYS 83 -1.118 -9.290 -8.073 667 HZ2 LYS 83 HZ2 LYS 83 -2.178 -8.925 -6.887 668 HZ3 LYS 83 HZ3 LYS 83 -0.761 -8.121 -6.991 669 H LYS 84 H LYS 84 0.460 -11.062 0.874 670 HA LYS 84 HA LYS 84 -2.292 -10.839 1.908 671 HB2 LYS 84 HB2 LYS 84 -1.375 -11.637 4.080 672 HB3 LYS 84 HB3 LYS 84 -1.344 -12.862 2.804 673 HG2 LYS 84 HG2 LYS 84 0.994 -12.823 2.622 674 HG3 LYS 84 HG3 LYS 84 1.131 -11.185 3.273 675 HD2 LYS 84 HD2 LYS 84 0.132 -13.532 4.961 676 HD3 LYS 84 HD3 LYS 84 1.850 -13.137 4.819 677 HE2 LYS 84 HE2 LYS 84 1.497 -10.908 5.742 678 HE3 LYS 84 HE3 LYS 84 -0.260 -11.095 5.671 679 HZ1 LYS 84 HZ1 LYS 84 0.728 -11.464 7.879 680 HZ2 LYS 84 HZ2 LYS 84 -0.149 -12.738 7.357 681 HZ3 LYS 84 HZ3 LYS 84 1.482 -12.802 7.325 682 H VAL 85 H VAL 85 -2.692 -9.071 3.377 683 HA VAL 85 HA VAL 85 -0.363 -7.279 3.737 684 HB VAL 85 HB VAL 85 -2.015 -5.360 3.455 685 HG11 VAL 85 HG11 VAL 85 -1.981 -5.423 0.967 686 HG12 VAL 85 HG12 VAL 85 -0.422 -5.964 1.676 687 HG13 VAL 85 HG13 VAL 85 -1.582 -7.173 1.028 688 HG21 VAL 85 HG21 VAL 85 -4.089 -5.744 2.177 689 HG22 VAL 85 HG22 VAL 85 -3.818 -7.516 2.280 690 HG23 VAL 85 HG23 VAL 85 -4.111 -6.564 3.774 691 H GLU 86 H GLU 86 -0.190 -6.486 5.842 692 HA GLU 86 HA GLU 86 -2.517 -6.928 7.621 693 HB2 GLU 86 HB2 GLU 86 -0.806 -7.514 9.395 694 HB3 GLU 86 HB3 GLU 86 -1.036 -8.731 8.133 695 HG2 GLU 86 HG2 GLU 86 1.028 -7.724 6.969 696 HG3 GLU 86 HG3 GLU 86 1.297 -6.796 8.450 697 H VAL 87 H VAL 87 -3.211 -5.019 8.401 698 HA VAL 87 HA VAL 87 -1.658 -2.650 8.134 699 HB VAL 87 HB VAL 87 -4.082 -2.542 8.092 700 HG11 VAL 87 HG11 VAL 87 -5.496 -3.070 10.053 701 HG12 VAL 87 HG12 VAL 87 -4.628 -4.513 9.427 702 HG13 VAL 87 HG13 VAL 87 -4.050 -3.692 10.917 703 HG21 VAL 87 HG21 VAL 87 -4.527 -0.836 9.840 704 HG22 VAL 87 HG22 VAL 87 -3.015 -1.321 10.680 705 HG23 VAL 87 HG23 VAL 87 -2.937 -0.593 9.040 706 H LEU 88 H LEU 88 0.105 -2.160 9.460 707 HA LEU 88 HA LEU 88 0.557 -3.647 11.876 708 HB2 LEU 88 HB2 LEU 88 1.923 -1.158 10.707 709 HB3 LEU 88 HB3 LEU 88 2.553 -2.149 12.029 710 HG LEU 88 HG LEU 88 2.123 -3.106 9.165 711 HD11 LEU 88 HD11 LEU 88 4.590 -3.081 9.019 712 HD12 LEU 88 HD12 LEU 88 3.916 -1.441 9.309 713 HD13 LEU 88 HD13 LEU 88 4.675 -2.352 10.658 714 HD21 LEU 88 HD21 LEU 88 3.436 -5.077 9.885 715 HD22 LEU 88 HD22 LEU 88 3.466 -4.437 11.563 716 HD23 LEU 88 HD23 LEU 88 1.906 -4.914 10.812 717 H ASP 89 H ASP 89 -0.128 -0.120 11.089 718 HA ASP 89 HA ASP 89 -1.712 0.111 13.468 719 HB2 ASP 89 HB2 ASP 89 0.867 0.409 14.086 720 HB3 ASP 89 HB3 ASP 89 0.641 2.008 13.365 721 H THR 90 H THR 90 -2.921 2.177 13.438 722 HA THR 90 HA THR 90 -2.410 4.007 11.283 723 HB THR 90 HB THR 90 -3.629 2.108 10.190 724 HG1 THR 90 HG1 THR 90 -5.256 3.501 9.218 725 HG21 THR 90 HG21 THR 90 -6.042 1.810 10.702 726 HG22 THR 90 HG22 THR 90 -5.001 1.391 12.104 727 HG23 THR 90 HG23 THR 90 -5.882 2.956 12.076 728 H ASP 91 H ASP 91 -3.457 6.029 11.568 729 HA ASP 91 HA ASP 91 -4.789 6.294 14.186 730 HB2 ASP 91 HB2 ASP 91 -2.706 7.636 13.692 731 HB3 ASP 91 HB3 ASP 91 -3.578 8.428 12.373 732 H TYR 92 H TYR 92 -6.961 6.972 14.248 733 HA TYR 92 HA TYR 92 -8.531 6.709 11.956 734 HB2 TYR 92 HB2 TYR 92 -9.104 8.112 14.601 735 HB3 TYR 92 HB3 TYR 92 -10.317 7.737 13.369 736 HD1 TYR 92 HD1 TYR 92 -11.025 5.406 12.962 737 HD2 TYR 92 HD2 TYR 92 -8.089 6.325 15.959 738 HE1 TYR 92 HE1 TYR 92 -11.313 3.148 13.935 739 HE2 TYR 92 HE2 TYR 92 -8.373 4.067 16.930 740 HH TYR 92 HH TYR 92 -10.700 1.719 15.508 741 H LYS 93 H LYS 93 -6.804 9.559 13.256 742 HA LYS 93 HA LYS 93 -7.738 11.046 10.903 743 HB2 LYS 93 HB2 LYS 93 -7.429 12.101 13.735 744 HB3 LYS 93 HB3 LYS 93 -7.793 13.069 12.300 745 HG2 LYS 93 HG2 LYS 93 -9.942 11.903 12.003 746 HG3 LYS 93 HG3 LYS 93 -9.570 10.804 13.338 747 HD2 LYS 93 HD2 LYS 93 -9.409 12.836 14.871 748 HD3 LYS 93 HD3 LYS 93 -9.966 13.836 13.523 749 HE2 LYS 93 HE2 LYS 93 -11.516 11.417 14.576 750 HE3 LYS 93 HE3 LYS 93 -11.773 13.065 15.165 751 HZ1 LYS 93 HZ1 LYS 93 -13.315 12.497 13.428 752 HZ2 LYS 93 HZ2 LYS 93 -12.348 13.708 12.914 753 HZ3 LYS 93 HZ3 LYS 93 -12.111 12.187 12.370 754 H SER 94 H SER 94 -5.264 9.428 11.154 755 HA SER 94 HA SER 94 -3.491 11.639 10.477 756 HB2 SER 94 HB2 SER 94 -3.245 11.259 13.006 757 HB3 SER 94 HB3 SER 94 -2.868 9.559 12.694 758 HG SER 94 HG SER 94 -0.849 10.143 12.389 759 H TYR 95 H TYR 95 -1.123 9.737 10.733 760 HA TYR 95 HA TYR 95 -1.362 8.691 8.073 761 HB2 TYR 95 HB2 TYR 95 0.998 7.962 8.513 762 HB3 TYR 95 HB3 TYR 95 0.748 9.675 8.877 763 HD1 TYR 95 HD1 TYR 95 1.081 6.288 10.433 764 HD2 TYR 95 HD2 TYR 95 1.094 10.532 11.094 765 HE1 TYR 95 HE1 TYR 95 1.914 5.924 12.734 766 HE2 TYR 95 HE2 TYR 95 1.942 10.172 13.394 767 HH TYR 95 HH TYR 95 2.310 6.865 14.723 768 H ALA 96 H ALA 96 -0.590 6.360 7.599 769 HA ALA 96 HA ALA 96 -1.280 4.455 9.706 770 HB1 ALA 96 HB1 ALA 96 -2.753 3.227 8.149 771 HB2 ALA 96 HB2 ALA 96 -3.390 4.864 8.521 772 HB3 ALA 96 HB3 ALA 96 -2.581 4.551 6.949 773 H VAL 97 H VAL 97 -0.180 2.449 9.500 774 HA VAL 97 HA VAL 97 1.597 2.286 7.160 775 HB VAL 97 HB VAL 97 3.273 1.183 8.675 776 HG11 VAL 97 HG11 VAL 97 4.100 3.292 9.673 777 HG12 VAL 97 HG12 VAL 97 3.520 3.526 7.989 778 HG13 VAL 97 HG13 VAL 97 2.502 4.054 9.371 779 HG21 VAL 97 HG21 VAL 97 3.099 1.563 11.112 780 HG22 VAL 97 HG22 VAL 97 1.453 2.245 10.883 781 HG23 VAL 97 HG23 VAL 97 1.772 0.520 10.496 782 H ILE 98 H ILE 98 1.394 0.348 6.023 783 HA ILE 98 HA ILE 98 0.112 -1.856 7.489 784 HB ILE 98 HB ILE 98 -0.130 -1.343 4.492 785 HG12 ILE 98 HG12 ILE 98 -1.077 0.610 5.589 786 HG13 ILE 98 HG13 ILE 98 -2.359 -0.386 4.887 787 HG21 ILE 98 HG21 ILE 98 -2.101 -2.831 4.699 788 HG22 ILE 98 HG22 ILE 98 -0.587 -3.632 5.240 789 HG23 ILE 98 HG23 ILE 98 -1.762 -3.020 6.453 790 HD11 ILE 98 HD11 ILE 98 -3.008 0.464 7.093 791 HD12 ILE 98 HD12 ILE 98 -2.871 -1.326 7.120 792 HD13 ILE 98 HD13 ILE 98 -1.569 -0.315 7.833 793 H TYR 99 H TYR 99 0.988 -3.955 7.167 794 HA TYR 99 HA TYR 99 3.617 -3.973 5.843 795 HB2 TYR 99 HB2 TYR 99 3.314 -4.748 8.244 796 HB3 TYR 99 HB3 TYR 99 2.260 -6.037 7.648 797 HD1 TYR 99 HD1 TYR 99 5.750 -4.734 7.616 798 HD2 TYR 99 HD2 TYR 99 3.169 -8.017 6.616 799 HE1 TYR 99 HE1 TYR 99 7.729 -6.171 7.228 800 HE2 TYR 99 HE2 TYR 99 5.145 -9.454 6.227 801 HH TYR 99 HH TYR 99 7.375 -9.657 6.555 802 H ALA 100 H ALA 100 3.988 -5.389 4.044 803 HA ALA 100 HA ALA 100 1.638 -6.926 3.163 804 HB1 ALA 100 HB1 ALA 100 2.227 -6.284 0.835 805 HB2 ALA 100 HB2 ALA 100 1.793 -4.860 1.841 806 HB3 ALA 100 HB3 ALA 100 3.516 -5.207 1.471 807 H THR 101 H THR 101 2.003 -8.950 2.301 808 HA THR 101 HA THR 101 4.775 -9.732 1.850 809 HB THR 101 HB THR 101 2.798 -11.149 3.718 810 HG1 THR 101 HG1 THR 101 5.486 -10.131 4.191 811 HG21 THR 101 HG21 THR 101 4.574 -12.858 4.014 812 HG22 THR 101 HG22 THR 101 3.991 -12.789 2.316 813 HG23 THR 101 HG23 THR 101 5.563 -12.039 2.758 814 H ARG 102 H ARG 102 4.948 -11.227 0.124 815 HA ARG 102 HA ARG 102 2.557 -12.700 -0.684 816 HB2 ARG 102 HB2 ARG 102 2.043 -11.626 -2.493 817 HB3 ARG 102 HB3 ARG 102 3.039 -10.288 -1.906 818 HG2 ARG 102 HG2 ARG 102 4.729 -12.244 -3.241 819 HG3 ARG 102 HG3 ARG 102 3.369 -11.815 -4.287 820 HD2 ARG 102 HD2 ARG 102 3.845 -9.385 -3.881 821 HD3 ARG 102 HD3 ARG 102 5.228 -9.836 -2.876 822 HE ARG 102 HE ARG 102 5.190 -9.681 -5.723 823 HH11 ARG 102 HH11 ARG 102 6.452 -11.705 -3.132 824 HH12 ARG 102 HH12 ARG 102 7.818 -12.244 -4.051 825 HH21 ARG 102 HH21 ARG 102 6.993 -10.410 -6.919 826 HH22 ARG 102 HH22 ARG 102 8.125 -11.508 -6.202 827 H VAL 103 H VAL 103 3.102 -14.696 -1.601 828 HA VAL 103 HA VAL 103 5.974 -15.123 -1.838 829 HB VAL 103 HB VAL 103 3.903 -17.058 -0.666 830 HG11 VAL 103 HG11 VAL 103 5.846 -18.458 -0.054 831 HG12 VAL 103 HG12 VAL 103 5.696 -18.244 -1.830 832 HG13 VAL 103 HG13 VAL 103 6.931 -17.315 -0.915 833 HG21 VAL 103 HG21 VAL 103 5.076 -16.710 1.484 834 HG22 VAL 103 HG22 VAL 103 6.114 -15.468 0.706 835 HG23 VAL 103 HG23 VAL 103 4.345 -15.194 0.856 836 H LYS 104 H LYS 104 6.750 -16.477 -3.444 837 HA LYS 104 HA LYS 104 4.730 -17.590 -5.309 838 HB2 LYS 104 HB2 LYS 104 6.160 -15.520 -6.002 839 HB3 LYS 104 HB3 LYS 104 7.524 -16.646 -6.028 840 HG2 LYS 104 HG2 LYS 104 4.973 -17.213 -7.591 841 HG3 LYS 104 HG3 LYS 104 6.249 -16.179 -8.247 842 HD2 LYS 104 HD2 LYS 104 7.905 -18.033 -7.944 843 HD3 LYS 104 HD3 LYS 104 6.625 -19.067 -7.294 844 HE2 LYS 104 HE2 LYS 104 6.655 -17.832 -10.098 845 HE3 LYS 104 HE3 LYS 104 7.079 -19.506 -9.713 846 HZ1 LYS 104 HZ1 LYS 104 4.910 -19.738 -10.233 847 HZ2 LYS 104 HZ2 LYS 104 4.701 -19.426 -8.644 848 HZ3 LYS 104 HZ3 LYS 104 4.467 -18.244 -9.746 849 H ASP 105 H ASP 105 5.382 -19.670 -6.259 850 HA ASP 105 HA ASP 105 6.186 -21.592 -4.691 851 HB2 ASP 105 HB2 ASP 105 7.240 -21.432 -7.569 852 HB3 ASP 105 HB3 ASP 105 6.824 -22.894 -6.664 853 H GLY 106 H GLY 106 7.822 -21.460 -3.141 854 HA2 GLY 106 HA2 GLY 106 9.950 -22.011 -2.535 855 HA3 GLY 106 HA3 GLY 106 10.504 -21.772 -4.197 856 H ARG 107 H ARG 107 8.818 -18.897 -3.548 857 HA ARG 107 HA ARG 107 11.105 -17.736 -2.133 858 HB2 ARG 107 HB2 ARG 107 11.622 -17.379 -4.490 859 HB3 ARG 107 HB3 ARG 107 9.968 -16.861 -4.839 860 HG2 ARG 107 HG2 ARG 107 10.284 -14.738 -3.954 861 HG3 ARG 107 HG3 ARG 107 11.490 -15.278 -2.778 862 HD2 ARG 107 HD2 ARG 107 11.989 -15.182 -5.796 863 HD3 ARG 107 HD3 ARG 107 12.391 -13.857 -4.696 864 HE ARG 107 HE ARG 107 13.733 -15.817 -3.484 865 HH11 ARG 107 HH11 ARG 107 13.464 -15.146 -6.930 866 HH12 ARG 107 HH12 ARG 107 14.995 -15.861 -7.309 867 HH21 ARG 107 HH21 ARG 107 15.733 -16.749 -4.002 868 HH22 ARG 107 HH22 ARG 107 16.285 -16.773 -5.643 869 H THR 108 H THR 108 10.556 -16.303 -0.596 870 HA THR 108 HA THR 108 7.785 -15.311 -0.563 871 HB THR 108 HB THR 108 9.717 -15.708 1.749 872 HG1 THR 108 HG1 THR 108 8.349 -17.590 2.211 873 HG21 THR 108 HG21 THR 108 7.670 -15.497 3.127 874 HG22 THR 108 HG22 THR 108 7.975 -14.023 2.148 875 HG23 THR 108 HG23 THR 108 6.709 -15.191 1.641 876 H LEU 109 H LEU 109 7.442 -13.064 -0.607 877 HA LEU 109 HA LEU 109 9.839 -11.449 -0.041 878 HB2 LEU 109 HB2 LEU 109 9.507 -11.591 -2.468 879 HB3 LEU 109 HB3 LEU 109 7.826 -11.070 -2.290 880 HG LEU 109 HG LEU 109 8.618 -8.878 -1.399 881 HD11 LEU 109 HD11 LEU 109 10.994 -8.255 -1.684 882 HD12 LEU 109 HD12 LEU 109 10.783 -9.585 -0.495 883 HD13 LEU 109 HD13 LEU 109 11.376 -9.947 -2.151 884 HD21 LEU 109 HD21 LEU 109 9.431 -8.002 -3.565 885 HD22 LEU 109 HD22 LEU 109 9.735 -9.682 -4.123 886 HD23 LEU 109 HD23 LEU 109 8.059 -9.142 -3.771 887 H HIS 110 H HIS 110 9.510 -9.632 1.213 888 HA HIS 110 HA HIS 110 6.716 -9.178 2.076 889 HB2 HIS 110 HB2 HIS 110 9.345 -8.808 3.606 890 HB3 HIS 110 HB3 HIS 110 7.743 -8.362 4.208 891 HD2 HIS 110 HD2 HIS 110 10.066 -11.432 4.035 892 HE1 HIS 110 HE1 HIS 110 6.280 -12.802 5.471 893 H MET 111 H MET 111 6.277 -6.831 2.607 894 HA MET 111 HA MET 111 8.225 -4.894 1.699 895 HB2 MET 111 HB2 MET 111 5.840 -5.734 0.107 896 HB3 MET 111 HB3 MET 111 6.058 -3.990 0.307 897 HG2 MET 111 HG2 MET 111 8.402 -4.215 -0.577 898 HG3 MET 111 HG3 MET 111 8.110 -5.939 -0.845 899 HE1 MET 111 HE1 MET 111 8.502 -3.488 -3.820 900 HE2 MET 111 HE2 MET 111 9.252 -4.772 -2.812 901 HE3 MET 111 HE3 MET 111 8.290 -5.216 -4.262 902 H MET 112 H MET 112 7.878 -2.850 2.651 903 HA MET 112 HA MET 112 5.636 -2.803 4.573 904 HB2 MET 112 HB2 MET 112 8.311 -1.356 4.448 905 HB3 MET 112 HB3 MET 112 7.008 -0.886 5.548 906 HG2 MET 112 HG2 MET 112 7.033 -3.212 6.512 907 HG3 MET 112 HG3 MET 112 8.400 -3.605 5.462 908 HE1 MET 112 HE1 MET 112 11.393 -1.858 6.838 909 HE2 MET 112 HE2 MET 112 10.529 -2.481 5.392 910 HE3 MET 112 HE3 MET 112 10.405 -0.744 5.832 911 H ARG 113 H ARG 113 4.004 -1.221 4.338 912 HA ARG 113 HA ARG 113 4.528 0.865 2.293 913 HB2 ARG 113 HB2 ARG 113 3.024 -1.335 1.746 914 HB3 ARG 113 HB3 ARG 113 1.798 -0.414 2.628 915 HG2 ARG 113 HG2 ARG 113 1.558 1.147 0.962 916 HG3 ARG 113 HG3 ARG 113 3.271 1.114 0.522 917 HD2 ARG 113 HD2 ARG 113 1.371 -1.210 -0.075 918 HD3 ARG 113 HD3 ARG 113 1.608 0.137 -1.196 919 HE ARG 113 HE ARG 113 3.986 -0.521 -1.363 920 HH11 ARG 113 HH11 ARG 113 1.771 -2.870 0.027 921 HH12 ARG 113 HH12 ARG 113 2.806 -4.221 -0.294 922 HH21 ARG 113 HH21 ARG 113 5.359 -2.284 -1.722 923 HH22 ARG 113 HH22 ARG 113 4.856 -3.885 -1.294 924 H LEU 114 H LEU 114 3.881 2.883 2.814 925 HA LEU 114 HA LEU 114 2.208 3.205 5.227 926 HB2 LEU 114 HB2 LEU 114 4.635 3.545 5.731 927 HB3 LEU 114 HB3 LEU 114 4.679 4.825 4.511 928 HG LEU 114 HG LEU 114 2.817 4.908 6.915 929 HD11 LEU 114 HD11 LEU 114 4.486 6.415 7.964 930 HD12 LEU 114 HD12 LEU 114 5.141 4.762 7.711 931 HD13 LEU 114 HD13 LEU 114 5.617 6.095 6.606 932 HD21 LEU 114 HD21 LEU 114 2.791 7.334 6.436 933 HD22 LEU 114 HD22 LEU 114 3.855 7.060 5.015 934 HD23 LEU 114 HD23 LEU 114 2.198 6.367 5.044 935 H TYR 115 H TYR 115 0.552 4.733 4.918 936 HA TYR 115 HA TYR 115 0.780 6.381 2.487 937 HB2 TYR 115 HB2 TYR 115 -1.490 5.960 1.901 938 HB3 TYR 115 HB3 TYR 115 -0.645 4.413 2.036 939 HD1 TYR 115 HD1 TYR 115 -1.110 2.892 3.972 940 HD2 TYR 115 HD2 TYR 115 -3.327 6.519 3.363 941 HE1 TYR 115 HE1 TYR 115 -2.873 2.072 5.505 942 HE2 TYR 115 HE2 TYR 115 -5.093 5.701 4.889 943 HH TYR 115 HH TYR 115 -4.823 2.478 6.470 944 H SER 116 H SER 116 -0.528 8.369 2.492 945 HA SER 116 HA SER 116 -0.778 9.329 5.294 946 HB2 SER 116 HB2 SER 116 -0.228 10.743 2.596 947 HB3 SER 116 HB3 SER 116 -0.632 11.624 4.075 948 HG SER 116 HG SER 116 1.568 11.577 4.094 949 H ARG 117 H ARG 117 -2.772 10.713 5.633 950 HA ARG 117 HA ARG 117 -5.049 9.626 4.404 951 HB2 ARG 117 HB2 ARG 117 -4.461 11.271 6.628 952 HB3 ARG 117 HB3 ARG 117 -5.479 12.277 5.588 953 HG2 ARG 117 HG2 ARG 117 -7.060 10.208 5.444 954 HG3 ARG 117 HG3 ARG 117 -6.132 9.561 6.804 955 HD2 ARG 117 HD2 ARG 117 -8.041 10.705 7.728 956 HD3 ARG 117 HD3 ARG 117 -6.619 11.695 8.082 957 HE ARG 117 HE ARG 117 -7.373 13.328 6.548 958 HH11 ARG 117 HH11 ARG 117 -9.494 10.517 6.518 959 HH12 ARG 117 HH12 ARG 117 -10.767 11.338 5.678 960 HH21 ARG 117 HH21 ARG 117 -9.054 14.388 5.453 961 HH22 ARG 117 HH22 ARG 117 -10.515 13.540 5.073 962 H SER 118 H SER 118 -2.833 12.131 3.328 963 HA SER 118 HA SER 118 -4.670 12.771 1.108 964 HB2 SER 118 HB2 SER 118 -2.935 14.877 2.445 965 HB3 SER 118 HB3 SER 118 -4.288 15.095 1.327 966 HG SER 118 HG SER 118 -4.876 15.581 3.534 967 HA PRO 119 HA PRO 119 -0.822 12.144 -1.111 968 HB2 PRO 119 HB2 PRO 119 -0.833 14.150 -3.039 969 HB3 PRO 119 HB3 PRO 119 -2.002 12.825 -3.119 970 HG2 PRO 119 HG2 PRO 119 -2.367 15.633 -2.036 971 HG3 PRO 119 HG3 PRO 119 -3.454 14.685 -3.060 972 HD2 PRO 119 HD2 PRO 119 -3.843 14.917 -0.357 973 HD3 PRO 119 HD3 PRO 119 -4.318 13.465 -1.247 974 H GLU 120 H GLU 120 0.017 13.054 1.225 975 HA GLU 120 HA GLU 120 2.275 14.657 0.448 976 HB2 GLU 120 HB2 GLU 120 1.890 16.417 2.149 977 HB3 GLU 120 HB3 GLU 120 0.743 16.480 0.804 978 HG2 GLU 120 HG2 GLU 120 -1.034 15.564 2.144 979 HG3 GLU 120 HG3 GLU 120 0.079 15.103 3.439 980 H VAL 121 H VAL 121 4.040 13.832 1.479 981 HA VAL 121 HA VAL 121 3.558 11.872 3.542 982 HB VAL 121 HB VAL 121 6.172 13.223 2.514 983 HG11 VAL 121 HG11 VAL 121 7.329 11.218 3.406 984 HG12 VAL 121 HG12 VAL 121 6.467 12.121 4.697 985 HG13 VAL 121 HG13 VAL 121 5.765 10.604 4.040 986 HG21 VAL 121 HG21 VAL 121 6.451 11.461 0.950 987 HG22 VAL 121 HG22 VAL 121 5.134 10.521 1.673 988 HG23 VAL 121 HG23 VAL 121 4.746 12.001 0.779 989 H SER 122 H SER 122 3.783 12.248 5.743 990 HA SER 122 HA SER 122 4.548 14.935 6.645 991 HB2 SER 122 HB2 SER 122 3.291 14.078 8.755 992 HB3 SER 122 HB3 SER 122 2.351 14.562 7.338 993 HG SER 122 HG SER 122 1.666 12.496 8.192 994 HA PRO 123 HA PRO 123 8.303 13.491 8.440 995 HB2 PRO 123 HB2 PRO 123 8.141 15.167 10.771 996 HB3 PRO 123 HB3 PRO 123 8.897 15.648 9.246 997 HG2 PRO 123 HG2 PRO 123 6.140 16.261 10.289 998 HG3 PRO 123 HG3 PRO 123 7.220 17.267 9.314 999 HD2 PRO 123 HD2 PRO 123 5.090 16.044 8.179 1000 HD3 PRO 123 HD3 PRO 123 6.609 16.198 7.287 1001 H ALA 124 H ALA 124 5.490 13.962 10.723 1002 HA ALA 124 HA ALA 124 6.442 12.292 12.715 1003 HB1 ALA 124 HB1 ALA 124 4.035 12.054 13.328 1004 HB2 ALA 124 HB2 ALA 124 4.456 13.754 12.930 1005 HB3 ALA 124 HB3 ALA 124 3.571 12.745 11.737 1006 H ALA 125 H ALA 125 4.381 11.402 9.812 1007 HA ALA 125 HA ALA 125 4.246 8.654 10.510 1008 HB1 ALA 125 HB1 ALA 125 3.449 8.381 8.196 1009 HB2 ALA 125 HB2 ALA 125 2.627 9.742 9.032 1010 HB3 ALA 125 HB3 ALA 125 3.923 10.075 7.834 1011 H THR 126 H THR 126 6.552 10.671 8.642 1012 HA THR 126 HA THR 126 7.915 8.599 7.353 1013 HB THR 126 HB THR 126 8.921 11.317 8.345 1014 HG1 THR 126 HG1 THR 126 7.204 11.689 6.939 1015 HG21 THR 126 HG21 THR 126 10.592 11.106 6.532 1016 HG22 THR 126 HG22 THR 126 10.759 9.794 7.747 1017 HG23 THR 126 HG23 THR 126 9.980 9.458 6.164 1018 H ALA 127 H ALA 127 8.595 10.337 10.509 1019 HA ALA 127 HA ALA 127 10.846 8.698 11.090 1020 HB1 ALA 127 HB1 ALA 127 10.708 9.806 13.310 1021 HB2 ALA 127 HB2 ALA 127 10.609 10.987 11.960 1022 HB3 ALA 127 HB3 ALA 127 9.122 10.511 12.848 1023 H ILE 128 H ILE 128 7.322 8.595 11.996 1024 HA ILE 128 HA ILE 128 7.508 6.781 14.075 1025 HB ILE 128 HB ILE 128 5.381 7.239 11.935 1026 HG12 ILE 128 HG12 ILE 128 5.714 9.066 13.531 1027 HG13 ILE 128 HG13 ILE 128 4.156 8.279 13.818 1028 HG21 ILE 128 HG21 ILE 128 3.834 5.883 13.306 1029 HG22 ILE 128 HG22 ILE 128 5.189 4.903 12.650 1030 HG23 ILE 128 HG23 ILE 128 5.200 5.412 14.373 1031 HD11 ILE 128 HD11 ILE 128 5.289 8.797 15.934 1032 HD12 ILE 128 HD12 ILE 128 5.128 7.021 15.722 1033 HD13 ILE 128 HD13 ILE 128 6.709 7.821 15.430 1034 H PHE 129 H PHE 129 7.031 6.112 10.456 1035 HA PHE 129 HA PHE 129 7.138 3.316 10.820 1036 HB2 PHE 129 HB2 PHE 129 6.269 4.563 8.764 1037 HB3 PHE 129 HB3 PHE 129 7.903 5.157 8.438 1038 HD1 PHE 129 HD1 PHE 129 5.701 2.186 8.408 1039 HD2 PHE 129 HD2 PHE 129 9.571 3.747 7.401 1040 HE1 PHE 129 HE1 PHE 129 6.138 0.191 7.010 1041 HE2 PHE 129 HE2 PHE 129 10.016 1.751 6.005 1042 HZ PHE 129 HZ PHE 129 8.299 -0.031 5.806 1043 H ARG 130 H ARG 130 9.690 5.539 9.308 1044 HA ARG 130 HA ARG 130 11.759 3.778 9.080 1045 HB2 ARG 130 HB2 ARG 130 11.534 6.448 8.763 1046 HB3 ARG 130 HB3 ARG 130 12.003 6.558 10.465 1047 HG2 ARG 130 HG2 ARG 130 13.879 4.842 9.046 1048 HG3 ARG 130 HG3 ARG 130 13.697 6.372 8.177 1049 HD2 ARG 130 HD2 ARG 130 14.209 6.215 11.187 1050 HD3 ARG 130 HD3 ARG 130 15.509 6.302 9.991 1051 HE ARG 130 HE ARG 130 14.271 8.475 9.241 1052 HH11 ARG 130 HH11 ARG 130 14.416 7.290 12.546 1053 HH12 ARG 130 HH12 ARG 130 14.288 8.869 13.246 1054 HH21 ARG 130 HH21 ARG 130 14.125 10.542 10.172 1055 HH22 ARG 130 HH22 ARG 130 14.123 10.721 11.895 1056 H LYS 131 H LYS 131 10.682 5.305 12.277 1057 HA LYS 131 HA LYS 131 12.822 4.445 13.798 1058 HB2 LYS 131 HB2 LYS 131 9.863 4.890 14.317 1059 HB3 LYS 131 HB3 LYS 131 10.854 4.166 15.590 1060 HG2 LYS 131 HG2 LYS 131 12.450 6.190 15.262 1061 HG3 LYS 131 HG3 LYS 131 11.140 6.920 14.326 1062 HD2 LYS 131 HD2 LYS 131 9.607 6.779 16.235 1063 HD3 LYS 131 HD3 LYS 131 10.781 5.844 17.170 1064 HE2 LYS 131 HE2 LYS 131 12.385 7.849 16.918 1065 HE3 LYS 131 HE3 LYS 131 11.009 8.757 16.279 1066 HZ1 LYS 131 HZ1 LYS 131 11.262 9.076 18.636 1067 HZ2 LYS 131 HZ2 LYS 131 9.847 8.316 18.345 1068 HZ3 LYS 131 HZ3 LYS 131 11.117 7.478 18.934 1069 H LEU 132 H LEU 132 9.670 2.624 13.208 1070 HA LEU 132 HA LEU 132 10.568 0.295 14.539 1071 HB2 LEU 132 HB2 LEU 132 8.451 0.712 12.386 1072 HB3 LEU 132 HB3 LEU 132 8.672 -0.777 13.313 1073 HG LEU 132 HG LEU 132 7.932 1.938 14.489 1074 HD11 LEU 132 HD11 LEU 132 5.709 0.915 14.856 1075 HD12 LEU 132 HD12 LEU 132 6.129 1.003 13.112 1076 HD13 LEU 132 HD13 LEU 132 6.251 -0.560 13.988 1077 HD21 LEU 132 HD21 LEU 132 7.476 0.658 16.554 1078 HD22 LEU 132 HD22 LEU 132 8.094 -0.831 15.762 1079 HD23 LEU 132 HD23 LEU 132 9.200 0.552 16.064 1080 H ALA 133 H ALA 133 10.736 1.486 11.123 1081 HA ALA 133 HA ALA 133 11.479 -0.863 9.865 1082 HB1 ALA 133 HB1 ALA 133 12.537 0.635 8.198 1083 HB2 ALA 133 HB2 ALA 133 10.919 1.232 8.698 1084 HB3 ALA 133 HB3 ALA 133 12.402 2.006 9.351 1085 H GLY 134 H GLY 134 13.491 1.466 11.823 1086 HA2 GLY 134 HA2 GLY 134 15.968 0.249 11.110 1087 HA3 GLY 134 HA3 GLY 134 15.656 1.371 12.441 1088 H GLU 135 H GLU 135 13.443 -0.348 13.611 1089 HA GLU 135 HA GLU 135 15.032 -1.859 15.370 1090 HB2 GLU 135 HB2 GLU 135 12.844 -0.924 15.964 1091 HB3 GLU 135 HB3 GLU 135 12.048 -1.912 14.732 1092 HG2 GLU 135 HG2 GLU 135 12.627 -3.969 15.933 1093 HG3 GLU 135 HG3 GLU 135 13.581 -3.058 17.110 1094 H ARG 136 H ARG 136 13.674 -2.570 12.166 1095 HA ARG 136 HA ARG 136 14.027 -5.448 12.593 1096 HB2 ARG 136 HB2 ARG 136 13.032 -3.970 10.118 1097 HB3 ARG 136 HB3 ARG 136 12.885 -5.695 10.477 1098 HG2 ARG 136 HG2 ARG 136 11.408 -5.120 12.440 1099 HG3 ARG 136 HG3 ARG 136 11.499 -3.416 11.972 1100 HD2 ARG 136 HD2 ARG 136 9.553 -3.993 10.869 1101 HD3 ARG 136 HD3 ARG 136 10.719 -4.360 9.590 1102 HE ARG 136 HE ARG 136 10.610 -6.766 10.680 1103 HH11 ARG 136 HH11 ARG 136 7.933 -4.521 10.238 1104 HH12 ARG 136 HH12 ARG 136 6.743 -5.776 10.139 1105 HH21 ARG 136 HH21 ARG 136 9.026 -8.392 10.561 1106 HH22 ARG 136 HH22 ARG 136 7.364 -7.969 10.322 1107 H ASN 137 H ASN 137 16.279 -3.239 12.360 1108 HA ASN 137 HA ASN 137 18.259 -2.993 11.428 1109 HB2 ASN 137 HB2 ASN 137 17.834 -5.964 10.844 1110 HB3 ASN 137 HB3 ASN 137 19.364 -5.129 10.543 1111 HD21 ASN 137 HD21 ASN 137 19.288 -3.389 12.890 1112 HD22 ASN 137 HD22 ASN 137 19.561 -4.402 14.268 1113 H TYR 138 H TYR 138 15.978 -2.259 9.704 1114 HA TYR 138 HA TYR 138 16.457 -3.282 7.088 1115 HB2 TYR 138 HB2 TYR 138 14.692 -1.879 6.485 1116 HB3 TYR 138 HB3 TYR 138 14.369 -2.030 8.217 1117 HD1 TYR 138 HD1 TYR 138 16.179 -0.146 9.506 1118 HD2 TYR 138 HD2 TYR 138 14.097 0.253 5.771 1119 HE1 TYR 138 HE1 TYR 138 16.264 2.318 9.724 1120 HE2 TYR 138 HE2 TYR 138 14.177 2.716 5.989 1121 HH TYR 138 HH TYR 138 15.716 4.267 8.846 1122 H THR 139 H THR 139 17.058 -1.748 5.219 1123 HA THR 139 HA THR 139 19.294 -0.005 6.050 1124 HB THR 139 HB THR 139 20.024 -0.617 3.574 1125 HG1 THR 139 HG1 THR 139 19.398 -2.846 3.088 1126 HG21 THR 139 HG21 THR 139 21.345 -2.520 4.453 1127 HG22 THR 139 HG22 THR 139 21.312 -1.148 5.611 1128 HG23 THR 139 HG23 THR 139 20.280 -2.590 5.897 1129 H ASP 140 H ASP 140 19.637 1.924 4.569 1130 HA ASP 140 HA ASP 140 17.295 3.296 4.153 1131 HB2 ASP 140 HB2 ASP 140 19.923 3.961 4.070 1132 HB3 ASP 140 HB3 ASP 140 19.755 3.669 2.334 1133 H GLU 141 H GLU 141 19.276 1.552 1.585 1134 HA GLU 141 HA GLU 141 17.636 2.187 -0.556 1135 HB2 GLU 141 HB2 GLU 141 19.190 -0.420 0.009 1136 HB3 GLU 141 HB3 GLU 141 18.651 0.112 -1.590 1137 HG2 GLU 141 HG2 GLU 141 20.442 1.945 -0.003 1138 HG3 GLU 141 HG3 GLU 141 21.149 0.491 -0.720 1139 H MET 142 H MET 142 16.824 0.099 2.182 1140 HA MET 142 HA MET 142 15.142 -1.659 0.627 1141 HB2 MET 142 HB2 MET 142 16.214 -2.409 2.740 1142 HB3 MET 142 HB3 MET 142 15.445 -1.092 3.636 1143 HG2 MET 142 HG2 MET 142 13.195 -2.093 3.078 1144 HG3 MET 142 HG3 MET 142 14.028 -3.451 2.311 1145 HE1 MET 142 HE1 MET 142 15.771 -5.294 5.215 1146 HE2 MET 142 HE2 MET 142 15.680 -4.974 3.450 1147 HE3 MET 142 HE3 MET 142 16.616 -3.872 4.515 1148 H VAL 143 H VAL 143 14.827 1.526 2.129 1149 HA VAL 143 HA VAL 143 11.931 1.357 1.862 1150 HB VAL 143 HB VAL 143 13.636 3.232 3.533 1151 HG11 VAL 143 HG11 VAL 143 11.495 4.126 4.391 1152 HG12 VAL 143 HG12 VAL 143 11.705 4.435 2.634 1153 HG13 VAL 143 HG13 VAL 143 10.606 3.128 3.192 1154 HG21 VAL 143 HG21 VAL 143 12.472 2.138 5.433 1155 HG22 VAL 143 HG22 VAL 143 11.643 1.039 4.280 1156 HG23 VAL 143 HG23 VAL 143 13.428 0.967 4.464 1157 H ALA 144 H ALA 144 10.801 3.244 0.902 1158 HA ALA 144 HA ALA 144 12.559 4.990 -0.695 1159 HB1 ALA 144 HB1 ALA 144 10.957 4.713 -2.573 1160 HB2 ALA 144 HB2 ALA 144 11.736 3.155 -2.135 1161 HB3 ALA 144 HB3 ALA 144 10.051 3.495 -1.614 1162 H MET 145 H MET 145 12.037 7.105 -0.409 1163 HA MET 145 HA MET 145 9.390 7.710 0.654 1164 HB2 MET 145 HB2 MET 145 12.050 9.099 1.087 1165 HB3 MET 145 HB3 MET 145 10.491 9.790 1.557 1166 HG2 MET 145 HG2 MET 145 10.265 7.381 2.781 1167 HG3 MET 145 HG3 MET 145 12.028 7.516 2.765 1168 HE1 MET 145 HE1 MET 145 9.364 10.947 4.133 1169 HE2 MET 145 HE2 MET 145 8.975 9.641 2.962 1170 HE3 MET 145 HE3 MET 145 8.705 9.382 4.719 1171 H LEU 146 H LEU 146 8.128 9.366 -0.281 1172 HA LEU 146 HA LEU 146 9.367 10.636 -2.632 1173 HB2 LEU 146 HB2 LEU 146 6.492 9.739 -2.213 1174 HB3 LEU 146 HB3 LEU 146 7.107 10.612 -3.622 1175 HG LEU 146 HG LEU 146 6.878 8.336 -4.246 1176 HD11 LEU 146 HD11 LEU 146 9.188 7.661 -4.811 1177 HD12 LEU 146 HD12 LEU 146 8.900 9.410 -5.099 1178 HD13 LEU 146 HD13 LEU 146 9.818 8.877 -3.650 1179 HD21 LEU 146 HD21 LEU 146 7.965 6.463 -3.058 1180 HD22 LEU 146 HD22 LEU 146 8.520 7.603 -1.786 1181 HD23 LEU 146 HD23 LEU 146 6.764 7.317 -2.031 1182 HA PRO 147 HA PRO 147 8.308 14.271 -0.164 1183 HB2 PRO 147 HB2 PRO 147 9.873 16.003 -1.671 1184 HB3 PRO 147 HB3 PRO 147 10.623 14.928 -0.484 1185 HG2 PRO 147 HG2 PRO 147 10.373 14.580 -3.485 1186 HG3 PRO 147 HG3 PRO 147 11.774 14.293 -2.445 1187 HD2 PRO 147 HD2 PRO 147 10.176 12.245 -3.302 1188 HD3 PRO 147 HD3 PRO 147 10.985 12.193 -1.731 1189 H ARG 148 H ARG 148 8.059 16.771 -1.385 1190 HA ARG 148 HA ARG 148 5.536 16.549 -2.505 1191 HB2 ARG 148 HB2 ARG 148 5.468 18.867 -2.620 1192 HB3 ARG 148 HB3 ARG 148 6.500 18.507 -1.229 1193 HG2 ARG 148 HG2 ARG 148 7.478 19.326 -4.007 1194 HG3 ARG 148 HG3 ARG 148 7.370 20.386 -2.595 1195 HD2 ARG 148 HD2 ARG 148 8.959 17.807 -2.419 1196 HD3 ARG 148 HD3 ARG 148 9.660 19.211 -3.234 1197 HE ARG 148 HE ARG 148 8.614 19.925 -0.632 1198 HH11 ARG 148 HH11 ARG 148 11.326 18.345 -2.223 1199 HH12 ARG 148 HH12 ARG 148 12.446 18.719 -0.955 1200 HH21 ARG 148 HH21 ARG 148 10.107 20.418 1.021 1201 HH22 ARG 148 HH22 ARG 148 11.753 19.896 0.887 1202 H GLN 149 H GLN 149 6.445 14.839 -4.126 1203 HA GLN 149 HA GLN 149 7.021 16.065 -6.674 1204 HB2 GLN 149 HB2 GLN 149 8.792 14.710 -5.790 1205 HB3 GLN 149 HB3 GLN 149 7.719 13.305 -5.842 1206 HG2 GLN 149 HG2 GLN 149 7.503 13.511 -8.281 1207 HG3 GLN 149 HG3 GLN 149 8.471 14.991 -8.271 1208 HE21 GLN 149 HE21 GLN 149 10.374 14.049 -6.216 1209 HE22 GLN 149 HE22 GLN 149 11.386 12.881 -6.998 1210 H GLU 150 H GLU 150 4.285 15.855 -5.515 1211 HA GLU 150 HA GLU 150 3.146 13.660 -6.988 1212 HB2 GLU 150 HB2 GLU 150 0.988 14.659 -6.070 1213 HB3 GLU 150 HB3 GLU 150 2.162 14.102 -4.870 1214 HG2 GLU 150 HG2 GLU 150 1.364 16.151 -4.019 1215 HG3 GLU 150 HG3 GLU 150 2.954 16.538 -4.690 1216 H GLU 151 H GLU 151 1.503 13.739 -8.582 1217 HA GLU 151 HA GLU 151 0.978 16.213 -9.929 1218 HB2 GLU 151 HB2 GLU 151 3.309 15.429 -10.737 1219 HB3 GLU 151 HB3 GLU 151 2.517 13.986 -11.384 1220 HG2 GLU 151 HG2 GLU 151 1.000 15.663 -12.699 1221 HG3 GLU 151 HG3 GLU 151 2.227 16.870 -12.290 1222 H CYS 152 H CYS 152 1.103 12.555 -10.438 1223 HA CYS 152 HA CYS 152 -1.526 12.849 -11.796 1224 HB2 CYS 152 HB2 CYS 152 0.287 11.403 -12.862 1225 HB3 CYS 152 HB3 CYS 152 0.441 10.474 -11.365 1226 H THR 153 H THR 153 -3.355 12.099 -10.659 1227 HA THR 153 HA THR 153 -2.951 10.655 -8.144 1228 HB THR 153 HB THR 153 -5.163 12.159 -7.575 1229 HG1 THR 153 HG1 THR 153 -4.669 14.364 -8.277 1230 HG21 THR 153 HG21 THR 153 -3.669 13.618 -6.234 1231 HG22 THR 153 HG22 THR 153 -3.176 11.893 -6.138 1232 HG23 THR 153 HG23 THR 153 -2.258 13.033 -7.179 1233 H VAL 154 H VAL 154 -4.775 9.297 -7.462 1234 HA VAL 154 HA VAL 154 -6.296 8.378 -9.770 1235 HB VAL 154 HB VAL 154 -5.124 6.757 -8.311 1236 HG11 VAL 154 HG11 VAL 154 -5.955 6.287 -6.032 1237 HG12 VAL 154 HG12 VAL 154 -5.255 7.934 -6.176 1238 HG13 VAL 154 HG13 VAL 154 -7.037 7.716 -6.140 1239 HG21 VAL 154 HG21 VAL 154 -7.028 5.212 -7.960 1240 HG22 VAL 154 HG22 VAL 154 -8.168 6.581 -8.188 1241 HG23 VAL 154 HG23 VAL 154 -7.118 6.051 -9.545 1242 H ASP 155 H ASP 155 -8.541 8.614 -9.988 1243 HA ASP 155 HA ASP 155 -9.754 10.628 -8.354 1244 HB2 ASP 155 HB2 ASP 155 -10.264 10.641 -10.697 1245 HB3 ASP 155 HB3 ASP 155 -10.684 8.923 -10.701 1246 H GLU 156 H GLU 156 -11.804 10.412 -7.198 1247 HA GLU 156 HA GLU 156 -11.959 7.791 -5.889 1248 HB2 GLU 156 HB2 GLU 156 -13.139 9.065 -4.090 1249 HB3 GLU 156 HB3 GLU 156 -11.457 9.551 -4.343 1250 HG2 GLU 156 HG2 GLU 156 -12.594 11.382 -5.942 1251 HG3 GLU 156 HG3 GLU 156 -14.000 11.064 -4.917 1252 H VAL 157 H VAL 157 -14.021 10.381 -7.425 1253 HA VAL 157 HA VAL 157 -15.743 8.595 -8.597 1254 HB VAL 157 HB VAL 157 -16.447 7.887 -6.366 1255 HG11 VAL 157 HG11 VAL 157 -17.585 9.434 -4.813 1256 HG12 VAL 157 HG12 VAL 157 -15.867 9.882 -5.084 1257 HG13 VAL 157 HG13 VAL 157 -17.175 10.809 -5.894 1258 HG21 VAL 157 HG21 VAL 157 -18.878 8.312 -6.573 1259 HG22 VAL 157 HG22 VAL 157 -18.540 9.616 -7.761 1260 HG23 VAL 157 HG23 VAL 157 -18.121 7.914 -8.152 1261 HN1 EB4 158 HN1 EB4 158 4.561 -6.060 -7.258 1262 H8 EB4 158 H8 EB4 158 -2.852 -6.057 -5.660 1263 HN2 EB4 158 HN2 EB4 158 1.468 -4.919 -9.200 1264 H9 EB4 158 H9 EB4 158 0.600 -0.995 -3.336 1265 H10 EB4 158 H10 EB4 158 5.588 -7.482 -1.616 1266 HN3 EB4 158 HN3 EB4 158 3.701 -2.987 -7.910 1267 H7 EB4 158 H7 EB4 158 3.868 -5.687 -1.560 1268 H11 EB4 158 H11 EB4 158 -3.669 -7.158 -7.735 1269 H12 EB4 158 H12 EB4 158 1.993 0.999 -3.809 1270 H15 EB4 158 H15 EB4 158 3.603 0.956 -5.691 1271 H14 EB4 158 H14 EB4 158 -2.140 -7.403 -9.668 1272 H13 EB4 158 H13 EB4 158 6.473 -8.255 -3.798 1273 H22 EB4 158 H22 EB4 158 5.480 -6.748 -7.676 1274 H30 EB4 158 H30 EB4 158 6.740 -3.272 -10.121 1275 H30A EB4 158 H30A EB4 158 6.876 -2.765 -8.370 1276 H24 EB4 158 H24 EB4 158 4.463 -2.187 -8.430 1277 H28 EB4 158 H28 EB4 158 4.614 -8.528 -9.282 1278 H28A EB4 158 H28A EB4 158 5.395 -7.521 -10.603 1279 H23 EB4 158 H23 EB4 158 1.592 -5.609 -10.199 1280 H29 EB4 158 H29 EB4 158 1.353 -3.593 -11.355 1281 H29A EB4 158 H29A EB4 158 2.944 -3.944 -12.289 Start of MODEL 13 1 H1 MET 1 H1 MET 1 -28.746 3.579 -4.567 2 H2 MET 1 H2 MET 1 -27.572 3.021 -3.580 3 H3 MET 1 H3 MET 1 -28.053 4.577 -3.477 4 HA MET 1 HA MET 1 -26.233 3.319 -5.300 5 HB2 MET 1 HB2 MET 1 -28.259 5.423 -6.203 6 HB3 MET 1 HB3 MET 1 -26.764 5.058 -7.076 7 HG2 MET 1 HG2 MET 1 -27.501 2.753 -7.477 8 HG3 MET 1 HG3 MET 1 -28.940 3.000 -6.479 9 HE1 MET 1 HE1 MET 1 -30.454 2.765 -10.111 10 HE2 MET 1 HE2 MET 1 -29.055 1.853 -9.451 11 HE3 MET 1 HE3 MET 1 -30.507 2.131 -8.431 12 H THR 2 H THR 2 -24.260 4.260 -4.818 13 HA THR 2 HA THR 2 -22.792 5.611 -3.845 14 HB THR 2 HB THR 2 -24.406 7.914 -5.031 15 HG1 THR 2 HG1 THR 2 -23.276 7.373 -7.045 16 HG21 THR 2 HG21 THR 2 -22.146 8.819 -5.493 17 HG22 THR 2 HG22 THR 2 -22.374 8.481 -3.744 18 HG23 THR 2 HG23 THR 2 -21.411 7.355 -4.759 19 H VAL 3 H VAL 3 -24.756 4.853 -1.953 20 HA VAL 3 HA VAL 3 -25.840 7.141 -0.679 21 HB VAL 3 HB VAL 3 -26.342 5.552 1.189 22 HG11 VAL 3 HG11 VAL 3 -27.910 4.131 -0.097 23 HG12 VAL 3 HG12 VAL 3 -27.910 5.830 -0.678 24 HG13 VAL 3 HG13 VAL 3 -27.047 4.563 -1.612 25 HG21 VAL 3 HG21 VAL 3 -25.879 3.144 0.883 26 HG22 VAL 3 HG22 VAL 3 -24.917 3.521 -0.586 27 HG23 VAL 3 HG23 VAL 3 -24.371 4.109 1.021 28 HA PRO 4 HA PRO 4 -22.206 8.158 1.740 29 HB2 PRO 4 HB2 PRO 4 -23.363 10.074 3.345 30 HB3 PRO 4 HB3 PRO 4 -23.239 10.381 1.607 31 HG2 PRO 4 HG2 PRO 4 -25.623 9.437 3.217 32 HG3 PRO 4 HG3 PRO 4 -25.562 10.620 1.904 33 HD2 PRO 4 HD2 PRO 4 -26.344 7.968 1.566 34 HD3 PRO 4 HD3 PRO 4 -25.720 8.982 0.259 35 H ASP 5 H ASP 5 -23.300 5.659 2.510 36 HA ASP 5 HA ASP 5 -23.282 5.990 5.443 37 HB2 ASP 5 HB2 ASP 5 -24.478 3.710 3.803 38 HB3 ASP 5 HB3 ASP 5 -24.507 3.868 5.564 39 H ARG 6 H ARG 6 -22.879 2.843 3.753 40 HA ARG 6 HA ARG 6 -20.692 2.116 5.239 41 HB2 ARG 6 HB2 ARG 6 -21.970 1.223 2.686 42 HB3 ARG 6 HB3 ARG 6 -20.291 0.713 2.909 43 HG2 ARG 6 HG2 ARG 6 -21.535 -1.059 3.826 44 HG3 ARG 6 HG3 ARG 6 -21.029 -0.134 5.247 45 HD2 ARG 6 HD2 ARG 6 -23.344 -0.606 5.588 46 HD3 ARG 6 HD3 ARG 6 -23.274 1.098 5.119 47 HE ARG 6 HE ARG 6 -23.913 0.327 2.798 48 HH11 ARG 6 HH11 ARG 6 -24.605 -1.722 5.571 49 HH12 ARG 6 HH12 ARG 6 -25.948 -2.508 4.810 50 HH21 ARG 6 HH21 ARG 6 -25.679 -0.719 1.811 51 HH22 ARG 6 HH22 ARG 6 -26.558 -1.938 2.672 52 H SER 7 H SER 7 -20.782 4.083 2.235 53 HA SER 7 HA SER 7 -18.210 3.821 1.325 54 HB2 SER 7 HB2 SER 7 -19.593 6.534 1.561 55 HB3 SER 7 HB3 SER 7 -18.629 5.902 0.220 56 HG SER 7 HG SER 7 -21.278 5.823 0.451 57 H GLU 8 H GLU 8 -19.294 5.591 4.270 58 HA GLU 8 HA GLU 8 -17.001 7.125 4.648 59 HB2 GLU 8 HB2 GLU 8 -18.806 5.947 6.783 60 HB3 GLU 8 HB3 GLU 8 -17.700 7.315 6.960 61 HG2 GLU 8 HG2 GLU 8 -19.024 8.543 5.188 62 HG3 GLU 8 HG3 GLU 8 -20.173 7.199 5.169 63 H ILE 9 H ILE 9 -17.513 3.633 5.046 64 HA ILE 9 HA ILE 9 -15.316 3.327 6.853 65 HB ILE 9 HB ILE 9 -16.727 1.201 5.153 66 HG12 ILE 9 HG12 ILE 9 -17.451 2.114 7.978 67 HG13 ILE 9 HG13 ILE 9 -18.294 2.669 6.526 68 HG21 ILE 9 HG21 ILE 9 -16.052 -0.319 6.985 69 HG22 ILE 9 HG22 ILE 9 -14.634 0.463 6.207 70 HG23 ILE 9 HG23 ILE 9 -15.218 1.045 7.803 71 HD11 ILE 9 HD11 ILE 9 -19.515 0.837 7.612 72 HD12 ILE 9 HD12 ILE 9 -18.933 0.335 5.989 73 HD13 ILE 9 HD13 ILE 9 -18.076 -0.228 7.463 74 H ALA 10 H ALA 10 -15.444 3.961 3.461 75 HA ALA 10 HA ALA 10 -12.729 2.859 3.185 76 HB1 ALA 10 HB1 ALA 10 -13.299 2.155 0.876 77 HB2 ALA 10 HB2 ALA 10 -14.267 1.268 2.102 78 HB3 ALA 10 HB3 ALA 10 -15.012 2.607 1.167 79 H GLY 11 H GLY 11 -11.980 3.783 0.731 80 HA2 GLY 11 HA2 GLY 11 -12.880 6.135 -0.253 81 HA3 GLY 11 HA3 GLY 11 -11.984 6.632 1.189 82 H LYS 12 H LYS 12 -10.338 7.723 -0.003 83 HA LYS 12 HA LYS 12 -8.658 5.969 -1.677 84 HB2 LYS 12 HB2 LYS 12 -7.869 8.087 -2.706 85 HB3 LYS 12 HB3 LYS 12 -9.613 7.870 -2.903 86 HG2 LYS 12 HG2 LYS 12 -10.011 9.434 -0.985 87 HG3 LYS 12 HG3 LYS 12 -8.265 9.667 -0.825 88 HD2 LYS 12 HD2 LYS 12 -8.132 10.611 -3.098 89 HD3 LYS 12 HD3 LYS 12 -9.841 10.256 -3.385 90 HE2 LYS 12 HE2 LYS 12 -9.726 12.586 -2.819 91 HE3 LYS 12 HE3 LYS 12 -10.408 11.766 -1.407 92 HZ1 LYS 12 HZ1 LYS 12 -8.560 13.430 -1.042 93 HZ2 LYS 12 HZ2 LYS 12 -8.425 12.003 -0.262 94 HZ3 LYS 12 HZ3 LYS 12 -7.527 12.293 -1.594 95 H TRP 13 H TRP 13 -6.452 5.773 -1.206 96 HA TRP 13 HA TRP 13 -5.472 7.323 1.107 97 HB2 TRP 13 HB2 TRP 13 -4.961 4.376 0.474 98 HB3 TRP 13 HB3 TRP 13 -4.225 5.296 1.793 99 HD1 TRP 13 HD1 TRP 13 -6.733 2.785 1.452 100 HE1 TRP 13 HE1 TRP 13 -8.563 2.928 3.274 101 HE3 TRP 13 HE3 TRP 13 -5.872 7.581 3.086 102 HZ2 TRP 13 HZ2 TRP 13 -9.528 4.802 5.137 103 HZ3 TRP 13 HZ3 TRP 13 -7.303 8.488 4.902 104 HH2 TRP 13 HH2 TRP 13 -9.101 7.115 5.911 105 H TYR 14 H TYR 14 -3.306 8.091 0.866 106 HA TYR 14 HA TYR 14 -2.174 7.600 -1.813 107 HB2 TYR 14 HB2 TYR 14 -1.568 9.816 0.209 108 HB3 TYR 14 HB3 TYR 14 -0.965 9.708 -1.450 109 HD1 TYR 14 HD1 TYR 14 -4.099 10.074 0.573 110 HD2 TYR 14 HD2 TYR 14 -2.247 10.570 -3.270 111 HE1 TYR 14 HE1 TYR 14 -6.089 11.311 -0.223 112 HE2 TYR 14 HE2 TYR 14 -4.238 11.800 -4.072 113 HH TYR 14 HH TYR 14 -6.504 12.158 -3.618 114 H VAL 15 H VAL 15 -0.348 6.187 -1.969 115 HA VAL 15 HA VAL 15 0.936 5.660 0.654 116 HB VAL 15 HB VAL 15 0.314 3.828 -0.903 117 HG11 VAL 15 HG11 VAL 15 1.527 3.429 -3.049 118 HG12 VAL 15 HG12 VAL 15 0.477 4.885 -3.082 119 HG13 VAL 15 HG13 VAL 15 2.256 5.064 -2.908 120 HG21 VAL 15 HG21 VAL 15 2.495 2.630 -1.030 121 HG22 VAL 15 HG22 VAL 15 3.329 4.173 -0.645 122 HG23 VAL 15 HG23 VAL 15 2.213 3.433 0.551 123 H VAL 16 H VAL 16 2.251 7.147 1.260 124 HA VAL 16 HA VAL 16 3.953 8.537 -0.681 125 HB VAL 16 HB VAL 16 4.276 10.190 1.105 126 HG11 VAL 16 HG11 VAL 16 2.036 11.205 1.150 127 HG12 VAL 16 HG12 VAL 16 2.484 10.592 -0.477 128 HG13 VAL 16 HG13 VAL 16 1.352 9.655 0.555 129 HG21 VAL 16 HG21 VAL 16 2.918 10.158 3.169 130 HG22 VAL 16 HG22 VAL 16 2.308 8.534 2.704 131 HG23 VAL 16 HG23 VAL 16 4.050 8.768 3.071 132 H ALA 17 H ALA 17 4.129 5.749 0.953 133 HA ALA 17 HA ALA 17 6.983 6.112 1.471 134 HB1 ALA 17 HB1 ALA 17 6.798 4.892 3.604 135 HB2 ALA 17 HB2 ALA 17 5.930 6.463 3.652 136 HB3 ALA 17 HB3 ALA 17 5.008 4.933 3.470 137 H LEU 18 H LEU 18 8.154 4.030 1.437 138 HA LEU 18 HA LEU 18 6.614 1.735 0.580 139 HB2 LEU 18 HB2 LEU 18 8.687 3.135 -1.180 140 HB3 LEU 18 HB3 LEU 18 8.142 1.474 -1.444 141 HG LEU 18 HG LEU 18 6.302 3.903 -1.482 142 HD11 LEU 18 HD11 LEU 18 6.332 3.648 -3.944 143 HD12 LEU 18 HD12 LEU 18 7.957 4.047 -3.291 144 HD13 LEU 18 HD13 LEU 18 7.579 2.364 -3.790 145 HD21 LEU 18 HD21 LEU 18 4.728 2.355 -2.595 146 HD22 LEU 18 HD22 LEU 18 5.906 1.015 -2.385 147 HD23 LEU 18 HD23 LEU 18 5.167 1.796 -0.946 148 H ALA 19 H ALA 19 7.765 -0.258 0.789 149 HA ALA 19 HA ALA 19 10.581 -0.124 1.608 150 HB1 ALA 19 HB1 ALA 19 10.104 -1.513 3.588 151 HB2 ALA 19 HB2 ALA 19 9.299 0.088 3.714 152 HB3 ALA 19 HB3 ALA 19 8.341 -1.368 3.277 153 H SER 20 H SER 20 11.654 -1.903 0.747 154 HA SER 20 HA SER 20 10.078 -4.237 -0.003 155 HB2 SER 20 HB2 SER 20 11.782 -2.626 -1.984 156 HB3 SER 20 HB3 SER 20 11.088 -4.220 -2.306 157 HG SER 20 HG SER 20 9.463 -3.015 -3.056 158 H ASN 21 H ASN 21 11.414 -6.139 -0.499 159 HA ASN 21 HA ASN 21 14.089 -5.887 0.743 160 HB2 ASN 21 HB2 ASN 21 12.010 -7.282 1.765 161 HB3 ASN 21 HB3 ASN 21 12.522 -8.481 0.570 162 HD21 ASN 21 HD21 ASN 21 15.282 -8.329 0.619 163 HD22 ASN 21 HD22 ASN 21 15.864 -8.777 2.187 164 H THR 22 H THR 22 12.634 -6.115 -2.278 165 HA THR 22 HA THR 22 14.530 -8.088 -3.241 166 HB THR 22 HB THR 22 12.840 -6.948 -5.327 167 HG1 THR 22 HG1 THR 22 11.047 -6.623 -4.155 168 HG21 THR 22 HG21 THR 22 12.093 -9.300 -5.507 169 HG22 THR 22 HG22 THR 22 13.878 -9.197 -5.340 170 HG23 THR 22 HG23 THR 22 12.871 -9.672 -3.931 171 H GLU 23 H GLU 23 16.208 -7.769 -4.631 172 HA GLU 23 HA GLU 23 17.553 -5.374 -4.697 173 HB2 GLU 23 HB2 GLU 23 17.618 -7.308 -7.035 174 HB3 GLU 23 HB3 GLU 23 18.940 -6.361 -6.340 175 HG2 GLU 23 HG2 GLU 23 17.637 -8.872 -5.218 176 HG3 GLU 23 HG3 GLU 23 19.311 -8.649 -5.743 177 H PHE 24 H PHE 24 15.310 -6.686 -7.205 178 HA PHE 24 HA PHE 24 15.398 -4.446 -8.890 179 HB2 PHE 24 HB2 PHE 24 13.485 -6.688 -9.055 180 HB3 PHE 24 HB3 PHE 24 13.736 -5.381 -10.219 181 HD1 PHE 24 HD1 PHE 24 15.966 -5.173 -11.406 182 HD2 PHE 24 HD2 PHE 24 15.019 -8.517 -8.881 183 HE1 PHE 24 HE1 PHE 24 17.794 -6.479 -12.449 184 HE2 PHE 24 HE2 PHE 24 16.831 -9.829 -9.934 185 HZ PHE 24 HZ PHE 24 18.223 -8.815 -11.723 186 H PHE 25 H PHE 25 13.904 -4.823 -5.918 187 HA PHE 25 HA PHE 25 11.747 -3.024 -6.558 188 HB2 PHE 25 HB2 PHE 25 12.300 -4.921 -4.405 189 HB3 PHE 25 HB3 PHE 25 11.495 -3.426 -3.911 190 HD1 PHE 25 HD1 PHE 25 11.226 -6.453 -6.036 191 HD2 PHE 25 HD2 PHE 25 9.301 -2.836 -4.753 192 HE1 PHE 25 HE1 PHE 25 9.071 -7.279 -6.941 193 HE2 PHE 25 HE2 PHE 25 7.147 -3.659 -5.646 194 HZ PHE 25 HZ PHE 25 7.025 -5.885 -6.742 195 H LEU 26 H LEU 26 14.310 -2.945 -4.077 196 HA LEU 26 HA LEU 26 14.042 -0.303 -3.319 197 HB2 LEU 26 HB2 LEU 26 16.703 -1.674 -3.724 198 HB3 LEU 26 HB3 LEU 26 16.250 -0.451 -2.530 199 HG LEU 26 HG LEU 26 15.432 -3.383 -2.584 200 HD11 LEU 26 HD11 LEU 26 16.606 -3.444 -0.410 201 HD12 LEU 26 HD12 LEU 26 17.691 -2.937 -1.749 202 HD13 LEU 26 HD13 LEU 26 17.044 -1.713 -0.605 203 HD21 LEU 26 HD21 LEU 26 14.200 -2.941 -0.493 204 HD22 LEU 26 HD22 LEU 26 14.512 -1.183 -0.687 205 HD23 LEU 26 HD23 LEU 26 13.503 -2.053 -1.890 206 H ARG 27 H ARG 27 15.382 -1.890 -6.257 207 HA ARG 27 HA ARG 27 16.755 0.413 -7.189 208 HB2 ARG 27 HB2 ARG 27 16.552 -2.354 -7.809 209 HB3 ARG 27 HB3 ARG 27 15.833 -1.558 -9.215 210 HG2 ARG 27 HG2 ARG 27 18.019 -0.043 -9.103 211 HG3 ARG 27 HG3 ARG 27 18.667 -1.397 -8.168 212 HD2 ARG 27 HD2 ARG 27 19.248 -1.790 -10.475 213 HD3 ARG 27 HD3 ARG 27 17.985 -2.954 -10.053 214 HE ARG 27 HE ARG 27 16.439 -1.071 -11.098 215 HH11 ARG 27 HH11 ARG 27 19.577 -2.155 -12.267 216 HH12 ARG 27 HH12 ARG 27 19.235 -1.736 -13.913 217 HH21 ARG 27 HH21 ARG 27 16.010 -0.520 -13.236 218 HH22 ARG 27 HH22 ARG 27 17.197 -0.802 -14.466 219 H GLU 28 H GLU 28 13.500 -1.100 -8.202 220 HA GLU 28 HA GLU 28 13.165 1.245 -9.903 221 HB2 GLU 28 HB2 GLU 28 11.255 -1.080 -9.581 222 HB3 GLU 28 HB3 GLU 28 11.286 0.143 -10.858 223 HG2 GLU 28 HG2 GLU 28 13.263 -2.125 -10.373 224 HG3 GLU 28 HG3 GLU 28 12.234 -1.854 -11.786 225 H LYS 29 H LYS 29 12.617 0.557 -6.632 226 HA LYS 29 HA LYS 29 10.142 2.001 -6.449 227 HB2 LYS 29 HB2 LYS 29 11.907 0.706 -4.414 228 HB3 LYS 29 HB3 LYS 29 10.590 1.797 -3.964 229 HG2 LYS 29 HG2 LYS 29 10.193 -0.616 -5.799 230 HG3 LYS 29 HG3 LYS 29 10.030 -0.708 -4.040 231 HD2 LYS 29 HD2 LYS 29 7.822 -0.387 -5.079 232 HD3 LYS 29 HD3 LYS 29 8.241 1.020 -4.092 233 HE2 LYS 29 HE2 LYS 29 7.297 1.834 -6.165 234 HE3 LYS 29 HE3 LYS 29 9.026 2.206 -6.180 235 HZ1 LYS 29 HZ1 LYS 29 9.197 1.059 -8.038 236 HZ2 LYS 29 HZ2 LYS 29 8.637 -0.306 -7.339 237 HZ3 LYS 29 HZ3 LYS 29 7.596 0.739 -8.039 238 H ASP 30 H ASP 30 13.487 2.574 -5.231 239 HA ASP 30 HA ASP 30 13.003 5.244 -4.461 240 HB2 ASP 30 HB2 ASP 30 14.900 4.287 -3.502 241 HB3 ASP 30 HB3 ASP 30 15.419 3.514 -5.006 242 H LYS 31 H LYS 31 13.581 3.593 -7.592 243 HA LYS 31 HA LYS 31 14.416 6.019 -8.826 244 HB2 LYS 31 HB2 LYS 31 13.787 3.188 -9.739 245 HB3 LYS 31 HB3 LYS 31 13.894 4.477 -10.945 246 HG2 LYS 31 HG2 LYS 31 16.096 3.703 -8.971 247 HG3 LYS 31 HG3 LYS 31 16.036 3.251 -10.679 248 HD2 LYS 31 HD2 LYS 31 17.047 5.196 -11.219 249 HD3 LYS 31 HD3 LYS 31 15.647 6.084 -10.603 250 HE2 LYS 31 HE2 LYS 31 17.753 5.054 -8.670 251 HE3 LYS 31 HE3 LYS 31 18.062 6.525 -9.602 252 HZ1 LYS 31 HZ1 LYS 31 17.047 7.396 -7.808 253 HZ2 LYS 31 HZ2 LYS 31 15.689 7.103 -8.665 254 HZ3 LYS 31 HZ3 LYS 31 16.142 6.078 -7.478 255 H MET 32 H MET 32 10.960 4.390 -8.450 256 HA MET 32 HA MET 32 10.517 6.439 -10.595 257 HB2 MET 32 HB2 MET 32 8.862 4.309 -8.867 258 HB3 MET 32 HB3 MET 32 8.039 5.281 -10.094 259 HG2 MET 32 HG2 MET 32 10.266 3.260 -10.696 260 HG3 MET 32 HG3 MET 32 8.536 2.915 -10.819 261 HE1 MET 32 HE1 MET 32 10.974 3.632 -14.024 262 HE2 MET 32 HE2 MET 32 10.525 2.405 -12.792 263 HE3 MET 32 HE3 MET 32 9.450 2.698 -14.200 264 H LYS 33 H LYS 33 7.508 6.289 -8.867 265 HA LYS 33 HA LYS 33 8.339 8.575 -7.184 266 HB2 LYS 33 HB2 LYS 33 6.110 8.788 -9.296 267 HB3 LYS 33 HB3 LYS 33 6.409 9.983 -8.028 268 HG2 LYS 33 HG2 LYS 33 8.596 10.543 -8.997 269 HG3 LYS 33 HG3 LYS 33 8.439 9.250 -10.194 270 HD2 LYS 33 HD2 LYS 33 6.428 10.375 -11.161 271 HD3 LYS 33 HD3 LYS 33 6.555 11.658 -9.950 272 HE2 LYS 33 HE2 LYS 33 8.782 12.306 -10.813 273 HE3 LYS 33 HE3 LYS 33 8.757 10.962 -11.963 274 HZ1 LYS 33 HZ1 LYS 33 8.101 13.020 -12.993 275 HZ2 LYS 33 HZ2 LYS 33 6.840 11.984 -13.010 276 HZ3 LYS 33 HZ3 LYS 33 6.863 13.224 -11.949 277 H MET 34 H MET 34 5.923 9.466 -6.189 278 HA MET 34 HA MET 34 5.309 7.339 -4.408 279 HB2 MET 34 HB2 MET 34 5.133 9.729 -3.770 280 HB3 MET 34 HB3 MET 34 4.042 10.065 -5.121 281 HG2 MET 34 HG2 MET 34 2.317 8.573 -4.026 282 HG3 MET 34 HG3 MET 34 3.404 8.399 -2.642 283 HE1 MET 34 HE1 MET 34 1.172 12.224 -3.959 284 HE2 MET 34 HE2 MET 34 2.802 11.978 -4.671 285 HE3 MET 34 HE3 MET 34 1.511 10.760 -4.942 286 H ALA 35 H ALA 35 3.339 6.178 -4.168 287 HA ALA 35 HA ALA 35 1.872 5.804 -6.678 288 HB1 ALA 35 HB1 ALA 35 1.381 3.530 -5.846 289 HB2 ALA 35 HB2 ALA 35 3.141 3.841 -6.024 290 HB3 ALA 35 HB3 ALA 35 2.386 3.860 -4.395 291 H MET 36 H MET 36 -0.387 4.652 -6.135 292 HA MET 36 HA MET 36 -1.704 6.312 -4.091 293 HB2 MET 36 HB2 MET 36 -2.614 5.668 -6.949 294 HB3 MET 36 HB3 MET 36 -3.633 6.446 -5.731 295 HG2 MET 36 HG2 MET 36 -0.966 7.674 -6.431 296 HG3 MET 36 HG3 MET 36 -2.328 7.861 -7.544 297 HE1 MET 36 HE1 MET 36 -1.288 10.916 -5.065 298 HE2 MET 36 HE2 MET 36 -0.707 9.928 -6.448 299 HE3 MET 36 HE3 MET 36 -2.111 11.029 -6.658 300 H ALA 37 H ALA 37 -4.018 5.414 -3.595 301 HA ALA 37 HA ALA 37 -4.525 2.678 -4.329 302 HB1 ALA 37 HB1 ALA 37 -4.302 1.807 -2.001 303 HB2 ALA 37 HB2 ALA 37 -2.717 2.366 -2.634 304 HB3 ALA 37 HB3 ALA 37 -3.631 3.387 -1.473 305 H ARG 38 H ARG 38 -6.712 2.519 -4.414 306 HA ARG 38 HA ARG 38 -8.316 4.133 -2.505 307 HB2 ARG 38 HB2 ARG 38 -8.591 5.184 -4.631 308 HB3 ARG 38 HB3 ARG 38 -8.708 3.636 -5.478 309 HG2 ARG 38 HG2 ARG 38 -10.772 3.897 -3.386 310 HG3 ARG 38 HG3 ARG 38 -10.842 5.224 -4.552 311 HD2 ARG 38 HD2 ARG 38 -10.951 3.631 -6.433 312 HD3 ARG 38 HD3 ARG 38 -10.731 2.264 -5.332 313 HE ARG 38 HE ARG 38 -12.982 2.370 -4.796 314 HH11 ARG 38 HH11 ARG 38 -12.070 5.405 -6.333 315 HH12 ARG 38 HH12 ARG 38 -13.698 5.994 -6.400 316 HH21 ARG 38 HH21 ARG 38 -15.103 3.167 -4.892 317 HH22 ARG 38 HH22 ARG 38 -15.418 4.724 -5.583 318 H ILE 39 H ILE 39 -9.614 2.729 -1.254 319 HA ILE 39 HA ILE 39 -9.805 -0.011 -2.268 320 HB ILE 39 HB ILE 39 -10.168 0.878 0.625 321 HG12 ILE 39 HG12 ILE 39 -7.940 1.570 0.009 322 HG13 ILE 39 HG13 ILE 39 -7.849 0.136 1.040 323 HG21 ILE 39 HG21 ILE 39 -9.671 -1.506 1.092 324 HG22 ILE 39 HG22 ILE 39 -11.107 -1.314 0.032 325 HG23 ILE 39 HG23 ILE 39 -9.533 -1.816 -0.672 326 HD11 ILE 39 HD11 ILE 39 -6.228 0.009 -0.796 327 HD12 ILE 39 HD12 ILE 39 -7.461 -1.287 -0.950 328 HD13 ILE 39 HD13 ILE 39 -7.554 0.169 -1.997 329 H SER 40 H SER 40 -11.858 -1.098 -2.216 330 HA SER 40 HA SER 40 -14.133 0.469 -1.241 331 HB2 SER 40 HB2 SER 40 -13.909 -0.683 -4.062 332 HB3 SER 40 HB3 SER 40 -15.364 0.022 -3.346 333 HG SER 40 HG SER 40 -14.405 2.052 -3.288 334 H PHE 41 H PHE 41 -15.724 -0.750 -0.285 335 HA PHE 41 HA PHE 41 -15.056 -3.456 0.283 336 HB2 PHE 41 HB2 PHE 41 -17.231 -3.431 1.530 337 HB3 PHE 41 HB3 PHE 41 -16.091 -2.168 2.010 338 HD1 PHE 41 HD1 PHE 41 -19.292 -2.871 0.301 339 HD2 PHE 41 HD2 PHE 41 -16.562 0.180 1.601 340 HE1 PHE 41 HE1 PHE 41 -21.041 -1.155 -0.056 341 HE2 PHE 41 HE2 PHE 41 -18.311 1.898 1.248 342 HZ PHE 41 HZ PHE 41 -20.554 1.232 0.417 343 H LEU 42 H LEU 42 -15.535 -5.271 -0.839 344 HA LEU 42 HA LEU 42 -17.448 -5.049 -3.037 345 HB2 LEU 42 HB2 LEU 42 -15.086 -6.079 -3.179 346 HB3 LEU 42 HB3 LEU 42 -15.715 -7.414 -2.205 347 HG LEU 42 HG LEU 42 -15.638 -7.951 -4.597 348 HD11 LEU 42 HD11 LEU 42 -17.952 -8.785 -4.847 349 HD12 LEU 42 HD12 LEU 42 -17.306 -9.056 -3.193 350 HD13 LEU 42 HD13 LEU 42 -18.472 -7.724 -3.494 351 HD21 LEU 42 HD21 LEU 42 -17.200 -6.868 -6.184 352 HD22 LEU 42 HD22 LEU 42 -17.675 -5.700 -4.905 353 HD23 LEU 42 HD23 LEU 42 -15.991 -5.713 -5.528 354 H GLY 43 H GLY 43 -16.832 -6.982 -0.010 355 HA2 GLY 43 HA2 GLY 43 -19.650 -7.378 0.378 356 HA3 GLY 43 HA3 GLY 43 -18.815 -8.837 -0.171 357 H GLU 44 H GLU 44 -19.883 -9.076 2.336 358 HA GLU 44 HA GLU 44 -18.397 -8.079 4.457 359 HB2 GLU 44 HB2 GLU 44 -19.720 -10.827 4.246 360 HB3 GLU 44 HB3 GLU 44 -19.319 -9.964 5.737 361 HG2 GLU 44 HG2 GLU 44 -21.226 -8.767 5.677 362 HG3 GLU 44 HG3 GLU 44 -20.975 -8.297 3.990 363 H ASP 45 H ASP 45 -17.700 -10.848 2.229 364 HA ASP 45 HA ASP 45 -15.242 -11.332 3.787 365 HB2 ASP 45 HB2 ASP 45 -16.781 -13.268 3.742 366 HB3 ASP 45 HB3 ASP 45 -16.919 -13.162 1.982 367 H GLU 46 H GLU 46 -16.128 -9.539 1.140 368 HA GLU 46 HA GLU 46 -13.555 -10.130 -0.128 369 HB2 GLU 46 HB2 GLU 46 -15.291 -11.316 -1.426 370 HB3 GLU 46 HB3 GLU 46 -16.188 -9.804 -1.623 371 HG2 GLU 46 HG2 GLU 46 -14.600 -8.884 -3.088 372 HG3 GLU 46 HG3 GLU 46 -13.298 -9.933 -2.511 373 H LEU 47 H LEU 47 -12.719 -8.368 -1.455 374 HA LEU 47 HA LEU 47 -13.909 -5.802 -1.066 375 HB2 LEU 47 HB2 LEU 47 -11.900 -4.785 -0.093 376 HB3 LEU 47 HB3 LEU 47 -12.807 -5.856 0.983 377 HG LEU 47 HG LEU 47 -10.405 -6.872 -0.558 378 HD11 LEU 47 HD11 LEU 47 -9.026 -6.328 1.413 379 HD12 LEU 47 HD12 LEU 47 -9.685 -4.851 0.633 380 HD13 LEU 47 HD13 LEU 47 -10.421 -5.469 2.150 381 HD21 LEU 47 HD21 LEU 47 -10.299 -8.448 1.339 382 HD22 LEU 47 HD22 LEU 47 -11.735 -7.659 2.073 383 HD23 LEU 47 HD23 LEU 47 -11.887 -8.517 0.503 384 H LYS 48 H LYS 48 -12.993 -4.089 -2.375 385 HA LYS 48 HA LYS 48 -11.332 -5.162 -4.561 386 HB2 LYS 48 HB2 LYS 48 -13.924 -4.145 -4.671 387 HB3 LYS 48 HB3 LYS 48 -12.917 -2.767 -5.133 388 HG2 LYS 48 HG2 LYS 48 -11.776 -4.252 -6.842 389 HG3 LYS 48 HG3 LYS 48 -12.927 -5.531 -6.435 390 HD2 LYS 48 HD2 LYS 48 -14.807 -3.851 -6.941 391 HD3 LYS 48 HD3 LYS 48 -13.565 -2.763 -7.572 392 HE2 LYS 48 HE2 LYS 48 -14.192 -5.581 -8.588 393 HE3 LYS 48 HE3 LYS 48 -14.605 -4.063 -9.395 394 HZ1 LYS 48 HZ1 LYS 48 -12.637 -4.963 -10.339 395 HZ2 LYS 48 HZ2 LYS 48 -12.209 -3.612 -9.528 396 HZ3 LYS 48 HZ3 LYS 48 -11.886 -5.082 -8.895 397 H VAL 49 H VAL 49 -9.481 -3.892 -5.146 398 HA VAL 49 HA VAL 49 -9.264 -1.328 -3.751 399 HB VAL 49 HB VAL 49 -6.876 -1.768 -3.304 400 HG11 VAL 49 HG11 VAL 49 -7.210 -3.368 -1.443 401 HG12 VAL 49 HG12 VAL 49 -8.556 -2.184 -1.557 402 HG13 VAL 49 HG13 VAL 49 -8.782 -3.861 -2.157 403 HG21 VAL 49 HG21 VAL 49 -5.981 -4.062 -3.466 404 HG22 VAL 49 HG22 VAL 49 -7.501 -4.594 -4.261 405 HG23 VAL 49 HG23 VAL 49 -6.433 -3.401 -5.073 406 H SER 50 H SER 50 -8.351 0.352 -4.984 407 HA SER 50 HA SER 50 -7.594 -0.393 -7.758 408 HB2 SER 50 HB2 SER 50 -9.560 1.088 -7.571 409 HB3 SER 50 HB3 SER 50 -8.728 2.128 -6.408 410 HG SER 50 HG SER 50 -7.206 2.698 -8.094 411 H TYR 51 H TYR 51 -5.408 -0.332 -8.116 412 HA TYR 51 HA TYR 51 -3.740 1.244 -6.268 413 HB2 TYR 51 HB2 TYR 51 -3.526 -1.296 -7.806 414 HB3 TYR 51 HB3 TYR 51 -2.126 -0.238 -8.019 415 HD1 TYR 51 HD1 TYR 51 -2.175 0.989 -5.162 416 HD2 TYR 51 HD2 TYR 51 -2.454 -3.050 -6.601 417 HE1 TYR 51 HE1 TYR 51 -1.193 0.166 -3.042 418 HE2 TYR 51 HE2 TYR 51 -1.492 -3.876 -4.477 419 HH TYR 51 HH TYR 51 -1.080 -3.288 -2.274 420 H ALA 52 H ALA 52 -2.406 2.919 -7.130 421 HA ALA 52 HA ALA 52 -2.484 3.279 -10.050 422 HB1 ALA 52 HB1 ALA 52 -2.904 5.691 -9.735 423 HB2 ALA 52 HB2 ALA 52 -4.276 4.691 -9.149 424 HB3 ALA 52 HB3 ALA 52 -3.129 5.420 -7.974 425 H VAL 53 H VAL 53 -0.434 3.689 -10.840 426 HA VAL 53 HA VAL 53 1.449 4.931 -8.992 427 HB VAL 53 HB VAL 53 3.235 3.336 -9.755 428 HG11 VAL 53 HG11 VAL 53 2.545 1.469 -8.288 429 HG12 VAL 53 HG12 VAL 53 2.160 3.069 -7.568 430 HG13 VAL 53 HG13 VAL 53 0.857 2.081 -8.312 431 HG21 VAL 53 HG21 VAL 53 2.561 1.168 -10.731 432 HG22 VAL 53 HG22 VAL 53 0.873 1.764 -10.875 433 HG23 VAL 53 HG23 VAL 53 2.184 2.544 -11.821 434 HA PRO 54 HA PRO 54 2.481 7.041 -12.810 435 HB2 PRO 54 HB2 PRO 54 4.754 8.339 -11.944 436 HB3 PRO 54 HB3 PRO 54 3.204 8.766 -11.208 437 HG2 PRO 54 HG2 PRO 54 5.401 6.979 -10.140 438 HG3 PRO 54 HG3 PRO 54 4.405 8.159 -9.277 439 HD2 PRO 54 HD2 PRO 54 3.930 5.410 -9.273 440 HD3 PRO 54 HD3 PRO 54 2.697 6.628 -8.918 441 H LYS 55 H LYS 55 2.886 5.334 -14.186 442 HA LYS 55 HA LYS 55 5.544 4.130 -14.176 443 HB2 LYS 55 HB2 LYS 55 3.515 2.694 -14.379 444 HB3 LYS 55 HB3 LYS 55 3.073 3.545 -15.865 445 HG2 LYS 55 HG2 LYS 55 5.292 2.797 -16.872 446 HG3 LYS 55 HG3 LYS 55 5.570 1.829 -15.419 447 HD2 LYS 55 HD2 LYS 55 3.506 0.536 -15.829 448 HD3 LYS 55 HD3 LYS 55 3.097 1.564 -17.209 449 HE2 LYS 55 HE2 LYS 55 4.075 -0.243 -18.296 450 HE3 LYS 55 HE3 LYS 55 5.470 0.830 -18.128 451 HZ1 LYS 55 HZ1 LYS 55 5.988 -1.407 -17.456 452 HZ2 LYS 55 HZ2 LYS 55 6.105 -0.417 -16.163 453 HZ3 LYS 55 HZ3 LYS 55 4.817 -1.408 -16.319 454 HA PRO 56 HA PRO 56 7.242 6.914 -17.225 455 HB2 PRO 56 HB2 PRO 56 7.827 4.275 -18.707 456 HB3 PRO 56 HB3 PRO 56 8.942 5.614 -18.404 457 HG2 PRO 56 HG2 PRO 56 9.096 3.392 -16.926 458 HG3 PRO 56 HG3 PRO 56 9.329 4.974 -16.170 459 HD2 PRO 56 HD2 PRO 56 6.976 3.104 -15.976 460 HD3 PRO 56 HD3 PRO 56 7.578 4.270 -14.790 461 H ASN 57 H ASN 57 5.142 4.160 -18.322 462 HA ASN 57 HA ASN 57 4.622 5.392 -20.839 463 HB2 ASN 57 HB2 ASN 57 3.015 3.288 -19.279 464 HB3 ASN 57 HB3 ASN 57 2.862 3.643 -21.005 465 HD21 ASN 57 HD21 ASN 57 4.385 2.829 -22.462 466 HD22 ASN 57 HD22 ASN 57 5.610 1.691 -22.007 467 H GLY 58 H GLY 58 3.455 6.008 -17.577 468 HA2 GLY 58 HA2 GLY 58 2.183 8.207 -17.705 469 HA3 GLY 58 HA3 GLY 58 1.021 7.275 -18.658 470 H CYS 59 H CYS 59 -0.357 8.117 -16.678 471 HA CYS 59 HA CYS 59 0.033 7.005 -14.136 472 HB2 CYS 59 HB2 CYS 59 -2.516 7.901 -15.567 473 HB3 CYS 59 HB3 CYS 59 -2.392 7.560 -13.836 474 H ARG 60 H ARG 60 0.226 4.775 -13.775 475 HA ARG 60 HA ARG 60 -1.605 3.082 -15.347 476 HB2 ARG 60 HB2 ARG 60 0.836 2.562 -15.389 477 HB3 ARG 60 HB3 ARG 60 0.849 2.437 -13.625 478 HG2 ARG 60 HG2 ARG 60 0.808 0.207 -14.647 479 HG3 ARG 60 HG3 ARG 60 -0.673 0.488 -13.723 480 HD2 ARG 60 HD2 ARG 60 -1.072 1.431 -16.445 481 HD3 ARG 60 HD3 ARG 60 -0.407 -0.208 -16.501 482 HE ARG 60 HE ARG 60 -2.628 0.128 -14.614 483 HH11 ARG 60 HH11 ARG 60 -1.679 -0.737 -17.894 484 HH12 ARG 60 HH12 ARG 60 -3.158 -1.577 -18.224 485 HH21 ARG 60 HH21 ARG 60 -4.555 -0.961 -15.070 486 HH22 ARG 60 HH22 ARG 60 -4.793 -1.704 -16.616 487 H LYS 61 H LYS 61 -3.385 2.262 -14.436 488 HA LYS 61 HA LYS 61 -3.565 2.279 -11.485 489 HB2 LYS 61 HB2 LYS 61 -5.206 3.784 -12.286 490 HB3 LYS 61 HB3 LYS 61 -5.575 2.793 -13.704 491 HG2 LYS 61 HG2 LYS 61 -6.581 1.053 -12.198 492 HG3 LYS 61 HG3 LYS 61 -6.256 2.094 -10.805 493 HD2 LYS 61 HD2 LYS 61 -7.820 3.752 -11.523 494 HD3 LYS 61 HD3 LYS 61 -7.875 3.119 -13.173 495 HE2 LYS 61 HE2 LYS 61 -9.884 2.571 -11.640 496 HE3 LYS 61 HE3 LYS 61 -9.179 1.230 -12.551 497 HZ1 LYS 61 HZ1 LYS 61 -9.590 0.734 -10.200 498 HZ2 LYS 61 HZ2 LYS 61 -8.020 0.538 -10.603 499 HZ3 LYS 61 HZ3 LYS 61 -8.486 1.851 -9.752 500 H TRP 62 H TRP 62 -4.520 0.359 -10.505 501 HA TRP 62 HA TRP 62 -4.963 -1.875 -12.361 502 HB2 TRP 62 HB2 TRP 62 -2.528 -1.768 -11.345 503 HB3 TRP 62 HB3 TRP 62 -3.307 -2.221 -9.824 504 HD1 TRP 62 HD1 TRP 62 -4.178 -4.743 -9.575 505 HE1 TRP 62 HE1 TRP 62 -3.867 -6.870 -11.013 506 HE3 TRP 62 HE3 TRP 62 -2.308 -2.566 -13.836 507 HZ2 TRP 62 HZ2 TRP 62 -2.959 -7.546 -13.589 508 HZ3 TRP 62 HZ3 TRP 62 -1.740 -4.025 -15.762 509 HH2 TRP 62 HH2 TRP 62 -2.065 -6.480 -15.638 510 H GLU 63 H GLU 63 -6.223 -3.653 -11.290 511 HA GLU 63 HA GLU 63 -7.784 -2.564 -8.990 512 HB2 GLU 63 HB2 GLU 63 -8.536 -4.028 -11.585 513 HB3 GLU 63 HB3 GLU 63 -9.533 -4.269 -10.144 514 HG2 GLU 63 HG2 GLU 63 -8.972 -1.544 -11.390 515 HG3 GLU 63 HG3 GLU 63 -10.381 -2.541 -11.774 516 H THR 64 H THR 64 -7.849 -3.968 -7.274 517 HA THR 64 HA THR 64 -6.996 -6.732 -7.752 518 HB THR 64 HB THR 64 -6.193 -5.091 -5.293 519 HG1 THR 64 HG1 THR 64 -4.234 -4.597 -6.280 520 HG21 THR 64 HG21 THR 64 -4.463 -6.870 -5.070 521 HG22 THR 64 HG22 THR 64 -6.123 -7.556 -5.083 522 HG23 THR 64 HG23 THR 64 -5.097 -7.659 -6.553 523 H THR 65 H THR 65 -8.206 -8.280 -6.682 524 HA THR 65 HA THR 65 -10.301 -7.281 -4.876 525 HB THR 65 HB THR 65 -10.159 -9.973 -6.291 526 HG1 THR 65 HG1 THR 65 -11.669 -8.929 -7.798 527 HG21 THR 65 HG21 THR 65 -12.587 -9.977 -5.824 528 HG22 THR 65 HG22 THR 65 -11.627 -9.846 -4.311 529 HG23 THR 65 HG23 THR 65 -12.431 -8.392 -4.993 530 H PHE 66 H PHE 66 -10.134 -7.800 -2.676 531 HA PHE 66 HA PHE 66 -8.132 -9.865 -2.031 532 HB2 PHE 66 HB2 PHE 66 -9.105 -7.435 -0.437 533 HB3 PHE 66 HB3 PHE 66 -8.018 -8.676 0.201 534 HD1 PHE 66 HD1 PHE 66 -6.321 -9.087 -2.307 535 HD2 PHE 66 HD2 PHE 66 -7.710 -5.542 -0.325 536 HE1 PHE 66 HE1 PHE 66 -4.377 -7.836 -3.188 537 HE2 PHE 66 HE2 PHE 66 -5.764 -4.287 -1.202 538 HZ PHE 66 HZ PHE 66 -4.092 -5.432 -2.637 539 H LYS 67 H LYS 67 -8.583 -11.168 -0.046 540 HA LYS 67 HA LYS 67 -11.476 -11.657 0.183 541 HB2 LYS 67 HB2 LYS 67 -9.095 -13.349 -0.079 542 HB3 LYS 67 HB3 LYS 67 -10.022 -13.763 1.368 543 HG2 LYS 67 HG2 LYS 67 -10.763 -15.120 -0.529 544 HG3 LYS 67 HG3 LYS 67 -12.070 -14.053 0.002 545 HD2 LYS 67 HD2 LYS 67 -11.538 -12.458 -1.840 546 HD3 LYS 67 HD3 LYS 67 -10.193 -13.485 -2.357 547 HE2 LYS 67 HE2 LYS 67 -11.778 -15.364 -2.780 548 HE3 LYS 67 HE3 LYS 67 -13.128 -14.358 -2.237 549 HZ1 LYS 67 HZ1 LYS 67 -12.819 -14.449 -4.663 550 HZ2 LYS 67 HZ2 LYS 67 -12.793 -12.925 -4.078 551 HZ3 LYS 67 HZ3 LYS 67 -11.400 -13.653 -4.518 552 H LYS 68 H LYS 68 -12.440 -11.858 2.245 553 HA LYS 68 HA LYS 68 -11.315 -10.205 4.205 554 HB2 LYS 68 HB2 LYS 68 -13.749 -10.491 3.887 555 HB3 LYS 68 HB3 LYS 68 -13.632 -12.203 4.317 556 HG2 LYS 68 HG2 LYS 68 -14.482 -11.029 6.237 557 HG3 LYS 68 HG3 LYS 68 -12.827 -11.526 6.613 558 HD2 LYS 68 HD2 LYS 68 -13.091 -9.237 7.357 559 HD3 LYS 68 HD3 LYS 68 -12.028 -9.219 5.943 560 HE2 LYS 68 HE2 LYS 68 -13.805 -8.460 4.491 561 HE3 LYS 68 HE3 LYS 68 -15.043 -8.790 5.710 562 HZ1 LYS 68 HZ1 LYS 68 -14.706 -6.550 5.888 563 HZ2 LYS 68 HZ2 LYS 68 -13.719 -7.085 7.073 564 HZ3 LYS 68 HZ3 LYS 68 -13.094 -6.616 5.640 565 H THR 69 H THR 69 -9.338 -10.828 5.161 566 HA THR 69 HA THR 69 -9.623 -13.232 6.895 567 HB THR 69 HB THR 69 -7.083 -12.463 5.365 568 HG1 THR 69 HG1 THR 69 -7.860 -14.566 4.074 569 HG21 THR 69 HG21 THR 69 -6.443 -14.823 5.763 570 HG22 THR 69 HG22 THR 69 -6.803 -13.950 7.291 571 HG23 THR 69 HG23 THR 69 -8.006 -15.093 6.606 572 H SER 70 H SER 70 -10.115 -11.478 8.413 573 HA SER 70 HA SER 70 -8.156 -9.418 8.925 574 HB2 SER 70 HB2 SER 70 -9.942 -9.618 11.100 575 HB3 SER 70 HB3 SER 70 -10.038 -8.488 9.743 576 HG SER 70 HG SER 70 -11.997 -9.740 9.994 577 H ASP 71 H ASP 71 -6.174 -10.788 9.265 578 HA ASP 71 HA ASP 71 -6.356 -12.771 11.349 579 HB2 ASP 71 HB2 ASP 71 -4.655 -12.604 9.361 580 HB3 ASP 71 HB3 ASP 71 -3.986 -11.147 10.108 581 H ASP 72 H ASP 72 -3.953 -9.947 11.457 582 HA ASP 72 HA ASP 72 -4.560 -9.752 14.345 583 HB2 ASP 72 HB2 ASP 72 -2.181 -9.965 13.243 584 HB3 ASP 72 HB3 ASP 72 -2.392 -8.255 12.845 585 H GLY 73 H GLY 73 -6.525 -8.886 13.893 586 HA2 GLY 73 HA2 GLY 73 -8.156 -7.637 14.169 587 HA3 GLY 73 HA3 GLY 73 -7.092 -6.224 14.173 588 H GLU 74 H GLU 74 -6.477 -5.448 11.401 589 HA GLU 74 HA GLU 74 -8.973 -6.333 10.030 590 HB2 GLU 74 HB2 GLU 74 -7.877 -3.536 10.162 591 HB3 GLU 74 HB3 GLU 74 -8.781 -4.095 8.749 592 HG2 GLU 74 HG2 GLU 74 -10.567 -3.302 9.907 593 HG3 GLU 74 HG3 GLU 74 -10.509 -4.887 10.689 594 H VAL 75 H VAL 75 -7.173 -8.009 9.518 595 HA VAL 75 HA VAL 75 -5.171 -7.069 7.603 596 HB VAL 75 HB VAL 75 -5.601 -9.775 8.944 597 HG11 VAL 75 HG11 VAL 75 -3.321 -10.304 8.155 598 HG12 VAL 75 HG12 VAL 75 -4.462 -10.009 6.800 599 HG13 VAL 75 HG13 VAL 75 -3.276 -8.744 7.267 600 HG21 VAL 75 HG21 VAL 75 -3.610 -9.172 10.298 601 HG22 VAL 75 HG22 VAL 75 -3.598 -7.546 9.534 602 HG23 VAL 75 HG23 VAL 75 -4.982 -8.043 10.566 603 H TYR 76 H TYR 76 -4.870 -8.579 5.599 604 HA TYR 76 HA TYR 76 -7.329 -9.898 4.774 605 HB2 TYR 76 HB2 TYR 76 -6.194 -7.408 3.461 606 HB3 TYR 76 HB3 TYR 76 -7.126 -8.594 2.537 607 HD1 TYR 76 HD1 TYR 76 -9.502 -9.156 3.318 608 HD2 TYR 76 HD2 TYR 76 -7.293 -5.809 4.853 609 HE1 TYR 76 HE1 TYR 76 -11.610 -8.133 4.110 610 HE2 TYR 76 HE2 TYR 76 -9.401 -4.779 5.646 611 HH TYR 76 HH TYR 76 -11.609 -4.956 5.806 612 H TYR 77 H TYR 77 -6.976 -10.930 2.450 613 HA TYR 77 HA TYR 77 -4.179 -11.474 1.916 614 HB2 TYR 77 HB2 TYR 77 -6.155 -13.546 2.959 615 HB3 TYR 77 HB3 TYR 77 -4.809 -14.018 1.914 616 HD1 TYR 77 HD1 TYR 77 -5.751 -12.730 5.247 617 HD2 TYR 77 HD2 TYR 77 -2.493 -13.913 2.714 618 HE1 TYR 77 HE1 TYR 77 -4.252 -12.811 7.217 619 HE2 TYR 77 HE2 TYR 77 -0.992 -13.993 4.679 620 HH TYR 77 HH TYR 77 -2.207 -13.199 7.973 621 H SER 78 H SER 78 -3.793 -12.237 -0.260 622 HA SER 78 HA SER 78 -6.272 -12.425 -1.902 623 HB2 SER 78 HB2 SER 78 -3.589 -11.715 -3.077 624 HB3 SER 78 HB3 SER 78 -5.194 -11.098 -3.489 625 HG SER 78 HG SER 78 -4.564 -9.364 -2.385 626 H GLU 79 H GLU 79 -6.320 -14.792 -1.486 627 HA GLU 79 HA GLU 79 -4.107 -16.454 -1.849 628 HB2 GLU 79 HB2 GLU 79 -6.735 -16.733 -1.076 629 HB3 GLU 79 HB3 GLU 79 -6.822 -17.405 -2.710 630 HG2 GLU 79 HG2 GLU 79 -5.268 -18.408 -0.313 631 HG3 GLU 79 HG3 GLU 79 -6.410 -19.276 -1.346 632 H GLU 80 H GLU 80 -6.526 -15.137 -4.187 633 HA GLU 80 HA GLU 80 -5.959 -16.795 -6.344 634 HB2 GLU 80 HB2 GLU 80 -6.691 -13.806 -6.205 635 HB3 GLU 80 HB3 GLU 80 -6.759 -14.777 -7.681 636 HG2 GLU 80 HG2 GLU 80 -8.525 -16.172 -6.796 637 HG3 GLU 80 HG3 GLU 80 -8.326 -15.512 -5.168 638 H ALA 81 H ALA 81 -4.151 -13.978 -5.055 639 HA ALA 81 HA ALA 81 -2.086 -14.512 -6.997 640 HB1 ALA 81 HB1 ALA 81 -1.450 -12.175 -6.992 641 HB2 ALA 81 HB2 ALA 81 -3.049 -12.546 -7.722 642 HB3 ALA 81 HB3 ALA 81 -2.957 -11.812 -6.085 643 H LYS 82 H LYS 82 -2.405 -15.590 -4.155 644 HA LYS 82 HA LYS 82 -1.196 -15.845 -2.347 645 HB2 LYS 82 HB2 LYS 82 0.895 -15.937 -4.467 646 HB3 LYS 82 HB3 LYS 82 1.356 -16.020 -2.762 647 HG2 LYS 82 HG2 LYS 82 1.055 -18.259 -3.095 648 HG3 LYS 82 HG3 LYS 82 -0.628 -17.862 -2.725 649 HD2 LYS 82 HD2 LYS 82 0.019 -17.406 -5.572 650 HD3 LYS 82 HD3 LYS 82 0.335 -19.075 -5.078 651 HE2 LYS 82 HE2 LYS 82 -2.287 -17.565 -4.606 652 HE3 LYS 82 HE3 LYS 82 -2.002 -18.723 -5.912 653 HZ1 LYS 82 HZ1 LYS 82 -3.043 -19.877 -4.185 654 HZ2 LYS 82 HZ2 LYS 82 -1.484 -20.354 -4.104 655 HZ3 LYS 82 HZ3 LYS 82 -2.064 -19.276 -3.024 656 H LYS 83 H LYS 83 -2.024 -13.140 -2.401 657 HA LYS 83 HA LYS 83 0.467 -11.703 -1.684 658 HB2 LYS 83 HB2 LYS 83 -2.263 -10.684 -2.640 659 HB3 LYS 83 HB3 LYS 83 -0.919 -9.656 -2.125 660 HG2 LYS 83 HG2 LYS 83 0.453 -10.329 -3.982 661 HG3 LYS 83 HG3 LYS 83 -0.599 -11.697 -4.370 662 HD2 LYS 83 HD2 LYS 83 -2.453 -9.942 -4.823 663 HD3 LYS 83 HD3 LYS 83 -1.169 -8.727 -4.760 664 HE2 LYS 83 HE2 LYS 83 0.079 -10.299 -6.475 665 HE3 LYS 83 HE3 LYS 83 -1.513 -11.027 -6.725 666 HZ1 LYS 83 HZ1 LYS 83 -1.021 -9.195 -8.240 667 HZ2 LYS 83 HZ2 LYS 83 -2.360 -8.902 -7.353 668 HZ3 LYS 83 HZ3 LYS 83 -0.959 -8.145 -6.991 669 H LYS 84 H LYS 84 0.798 -11.367 0.411 670 HA LYS 84 HA LYS 84 -1.527 -11.602 2.241 671 HB2 LYS 84 HB2 LYS 84 0.173 -13.274 2.703 672 HB3 LYS 84 HB3 LYS 84 1.489 -12.117 2.463 673 HG2 LYS 84 HG2 LYS 84 1.051 -11.019 4.561 674 HG3 LYS 84 HG3 LYS 84 -0.520 -11.810 4.741 675 HD2 LYS 84 HD2 LYS 84 0.482 -13.957 5.166 676 HD3 LYS 84 HD3 LYS 84 2.065 -13.427 4.583 677 HE2 LYS 84 HE2 LYS 84 1.941 -13.578 7.080 678 HE3 LYS 84 HE3 LYS 84 2.374 -11.963 6.505 679 HZ1 LYS 84 HZ1 LYS 84 0.640 -12.101 8.280 680 HZ2 LYS 84 HZ2 LYS 84 0.238 -11.190 6.986 681 HZ3 LYS 84 HZ3 LYS 84 -0.398 -12.683 7.163 682 H VAL 85 H VAL 85 -2.083 -9.790 3.376 683 HA VAL 85 HA VAL 85 -0.156 -7.582 3.454 684 HB VAL 85 HB VAL 85 -2.063 -5.996 3.072 685 HG11 VAL 85 HG11 VAL 85 -2.175 -6.294 0.618 686 HG12 VAL 85 HG12 VAL 85 -0.512 -6.527 1.255 687 HG13 VAL 85 HG13 VAL 85 -1.506 -7.951 0.798 688 HG21 VAL 85 HG21 VAL 85 -4.132 -6.827 1.997 689 HG22 VAL 85 HG22 VAL 85 -3.577 -8.516 2.253 690 HG23 VAL 85 HG23 VAL 85 -3.931 -7.463 3.665 691 H GLU 86 H GLU 86 -0.429 -6.188 5.323 692 HA GLU 86 HA GLU 86 -2.498 -6.920 7.198 693 HB2 GLU 86 HB2 GLU 86 -0.608 -7.024 9.013 694 HB3 GLU 86 HB3 GLU 86 -1.036 -8.462 8.077 695 HG2 GLU 86 HG2 GLU 86 0.984 -7.063 6.596 696 HG3 GLU 86 HG3 GLU 86 1.511 -7.107 8.283 697 H VAL 87 H VAL 87 -2.867 -5.389 8.878 698 HA VAL 87 HA VAL 87 -1.764 -2.767 8.209 699 HB VAL 87 HB VAL 87 -4.167 -2.911 8.154 700 HG11 VAL 87 HG11 VAL 87 -5.480 -3.367 10.187 701 HG12 VAL 87 HG12 VAL 87 -4.513 -4.789 9.668 702 HG13 VAL 87 HG13 VAL 87 -3.969 -3.793 11.060 703 HG21 VAL 87 HG21 VAL 87 -4.691 -1.084 9.720 704 HG22 VAL 87 HG22 VAL 87 -3.133 -1.370 10.567 705 HG23 VAL 87 HG23 VAL 87 -3.139 -0.817 8.858 706 H LEU 88 H LEU 88 0.061 -2.159 9.467 707 HA LEU 88 HA LEU 88 0.471 -3.521 11.985 708 HB2 LEU 88 HB2 LEU 88 1.892 -1.145 10.673 709 HB3 LEU 88 HB3 LEU 88 2.482 -2.057 12.068 710 HG LEU 88 HG LEU 88 2.102 -3.180 9.260 711 HD11 LEU 88 HD11 LEU 88 4.572 -3.205 9.178 712 HD12 LEU 88 HD12 LEU 88 3.922 -1.541 9.354 713 HD13 LEU 88 HD13 LEU 88 4.629 -2.383 10.773 714 HD21 LEU 88 HD21 LEU 88 3.357 -5.125 10.130 715 HD22 LEU 88 HD22 LEU 88 3.356 -4.387 11.767 716 HD23 LEU 88 HD23 LEU 88 1.807 -4.881 11.003 717 H ASP 89 H ASP 89 -0.007 -0.033 10.953 718 HA ASP 89 HA ASP 89 -1.641 0.387 13.305 719 HB2 ASP 89 HB2 ASP 89 0.676 0.758 14.152 720 HB3 ASP 89 HB3 ASP 89 0.932 1.978 12.897 721 H THR 90 H THR 90 -3.048 2.198 13.035 722 HA THR 90 HA THR 90 -2.636 3.891 10.713 723 HB THR 90 HB THR 90 -3.846 1.844 9.891 724 HG1 THR 90 HG1 THR 90 -4.945 3.118 8.543 725 HG21 THR 90 HG21 THR 90 -6.231 1.549 10.519 726 HG22 THR 90 HG22 THR 90 -5.128 1.298 11.914 727 HG23 THR 90 HG23 THR 90 -6.051 2.831 11.764 728 H ASP 91 H ASP 91 -3.391 5.975 11.137 729 HA ASP 91 HA ASP 91 -4.706 6.334 13.718 730 HB2 ASP 91 HB2 ASP 91 -2.667 7.668 13.019 731 HB3 ASP 91 HB3 ASP 91 -3.655 8.420 11.759 732 H TYR 92 H TYR 92 -6.881 6.865 13.902 733 HA TYR 92 HA TYR 92 -8.540 6.605 11.665 734 HB2 TYR 92 HB2 TYR 92 -9.050 7.782 14.440 735 HB3 TYR 92 HB3 TYR 92 -10.317 7.470 13.245 736 HD1 TYR 92 HD1 TYR 92 -10.441 5.004 12.303 737 HD2 TYR 92 HD2 TYR 92 -8.427 6.071 15.945 738 HE1 TYR 92 HE1 TYR 92 -10.593 2.657 13.072 739 HE2 TYR 92 HE2 TYR 92 -8.568 3.720 16.712 740 HH TYR 92 HH TYR 92 -10.133 1.199 14.671 741 H LYS 93 H LYS 93 -6.829 9.459 12.904 742 HA LYS 93 HA LYS 93 -8.205 11.005 10.824 743 HB2 LYS 93 HB2 LYS 93 -7.311 12.037 13.540 744 HB3 LYS 93 HB3 LYS 93 -8.064 12.980 12.247 745 HG2 LYS 93 HG2 LYS 93 -10.127 11.580 12.429 746 HG3 LYS 93 HG3 LYS 93 -9.374 10.638 13.722 747 HD2 LYS 93 HD2 LYS 93 -9.051 12.849 14.996 748 HD3 LYS 93 HD3 LYS 93 -10.057 13.620 13.762 749 HE2 LYS 93 HE2 LYS 93 -10.919 11.236 15.483 750 HE3 LYS 93 HE3 LYS 93 -11.337 12.922 15.815 751 HZ1 LYS 93 HZ1 LYS 93 -13.091 11.827 14.638 752 HZ2 LYS 93 HZ2 LYS 93 -12.459 12.978 13.668 753 HZ3 LYS 93 HZ3 LYS 93 -12.106 11.406 13.405 754 H SER 94 H SER 94 -5.535 9.415 10.841 755 HA SER 94 HA SER 94 -4.008 11.667 9.766 756 HB2 SER 94 HB2 SER 94 -3.383 11.478 12.222 757 HB3 SER 94 HB3 SER 94 -2.999 9.768 11.988 758 HG SER 94 HG SER 94 -1.054 10.402 11.414 759 H TYR 95 H TYR 95 -1.559 9.767 9.898 760 HA TYR 95 HA TYR 95 -2.161 8.438 7.384 761 HB2 TYR 95 HB2 TYR 95 0.310 8.036 7.403 762 HB3 TYR 95 HB3 TYR 95 -0.089 9.748 7.592 763 HD1 TYR 95 HD1 TYR 95 0.973 6.683 9.460 764 HD2 TYR 95 HD2 TYR 95 0.525 10.951 9.571 765 HE1 TYR 95 HE1 TYR 95 2.264 6.761 11.571 766 HE2 TYR 95 HE2 TYR 95 1.820 11.036 11.676 767 HH TYR 95 HH TYR 95 2.415 9.617 13.531 768 H ALA 96 H ALA 96 -0.791 6.201 7.194 769 HA ALA 96 HA ALA 96 -1.006 4.618 9.590 770 HB1 ALA 96 HB1 ALA 96 -2.458 2.939 8.542 771 HB2 ALA 96 HB2 ALA 96 -3.281 4.517 8.789 772 HB3 ALA 96 HB3 ALA 96 -2.713 4.047 7.152 773 H VAL 97 H VAL 97 -0.047 2.414 9.370 774 HA VAL 97 HA VAL 97 1.778 2.343 7.061 775 HB VAL 97 HB VAL 97 3.325 1.030 8.549 776 HG11 VAL 97 HG11 VAL 97 4.231 3.045 9.673 777 HG12 VAL 97 HG12 VAL 97 3.721 3.390 7.986 778 HG13 VAL 97 HG13 VAL 97 2.686 3.906 9.360 779 HG21 VAL 97 HG21 VAL 97 3.093 1.302 10.991 780 HG22 VAL 97 HG22 VAL 97 1.497 2.090 10.748 781 HG23 VAL 97 HG23 VAL 97 1.730 0.371 10.284 782 H ILE 98 H ILE 98 1.477 0.547 5.746 783 HA ILE 98 HA ILE 98 0.020 -1.713 6.937 784 HB ILE 98 HB ILE 98 0.051 -0.732 4.040 785 HG12 ILE 98 HG12 ILE 98 -1.235 0.782 5.463 786 HG13 ILE 98 HG13 ILE 98 -2.324 -0.151 4.428 787 HG21 ILE 98 HG21 ILE 98 -1.719 -2.421 3.673 788 HG22 ILE 98 HG22 ILE 98 -0.166 -3.168 4.178 789 HG23 ILE 98 HG23 ILE 98 -1.508 -2.999 5.360 790 HD11 ILE 98 HD11 ILE 98 -3.222 0.047 6.704 791 HD12 ILE 98 HD12 ILE 98 -2.846 -1.667 6.319 792 HD13 ILE 98 HD13 ILE 98 -1.741 -0.719 7.370 793 H TYR 99 H TYR 99 0.911 -3.740 6.734 794 HA TYR 99 HA TYR 99 3.599 -3.880 5.595 795 HB2 TYR 99 HB2 TYR 99 3.046 -4.601 7.990 796 HB3 TYR 99 HB3 TYR 99 2.127 -5.940 7.290 797 HD1 TYR 99 HD1 TYR 99 5.544 -4.382 7.286 798 HD2 TYR 99 HD2 TYR 99 3.236 -7.953 6.685 799 HE1 TYR 99 HE1 TYR 99 7.630 -5.700 7.124 800 HE2 TYR 99 HE2 TYR 99 5.322 -9.274 6.517 801 HH TYR 99 HH TYR 99 7.595 -9.108 6.161 802 H ALA 100 H ALA 100 4.165 -5.522 4.029 803 HA ALA 100 HA ALA 100 1.881 -6.986 2.908 804 HB1 ALA 100 HB1 ALA 100 2.709 -6.407 0.631 805 HB2 ALA 100 HB2 ALA 100 2.193 -4.955 1.554 806 HB3 ALA 100 HB3 ALA 100 3.940 -5.328 1.370 807 H THR 101 H THR 101 2.352 -8.980 1.906 808 HA THR 101 HA THR 101 5.119 -9.832 1.805 809 HB THR 101 HB THR 101 3.030 -11.337 3.446 810 HG1 THR 101 HG1 THR 101 4.499 -10.768 5.217 811 HG21 THR 101 HG21 THR 101 4.932 -12.805 4.033 812 HG22 THR 101 HG22 THR 101 4.612 -12.810 2.265 813 HG23 THR 101 HG23 THR 101 5.993 -11.870 2.925 814 H ARG 102 H ARG 102 5.443 -11.486 0.194 815 HA ARG 102 HA ARG 102 3.000 -12.639 -0.961 816 HB2 ARG 102 HB2 ARG 102 3.436 -11.985 -3.120 817 HB3 ARG 102 HB3 ARG 102 3.829 -10.524 -2.204 818 HG2 ARG 102 HG2 ARG 102 6.268 -11.183 -2.301 819 HG3 ARG 102 HG3 ARG 102 5.820 -12.548 -3.332 820 HD2 ARG 102 HD2 ARG 102 5.756 -9.584 -3.934 821 HD3 ARG 102 HD3 ARG 102 6.380 -10.915 -4.917 822 HE ARG 102 HE ARG 102 3.455 -10.374 -4.534 823 HH11 ARG 102 HH11 ARG 102 6.193 -10.889 -6.645 824 HH12 ARG 102 HH12 ARG 102 5.235 -11.426 -7.983 825 HH21 ARG 102 HH21 ARG 102 2.195 -11.276 -6.251 826 HH22 ARG 102 HH22 ARG 102 2.961 -11.646 -7.760 827 H VAL 103 H VAL 103 3.288 -14.800 -1.682 828 HA VAL 103 HA VAL 103 6.010 -15.796 -1.238 829 HB VAL 103 HB VAL 103 4.412 -16.611 0.456 830 HG11 VAL 103 HG11 VAL 103 2.555 -18.112 -0.173 831 HG12 VAL 103 HG12 VAL 103 2.340 -16.455 -0.830 832 HG13 VAL 103 HG13 VAL 103 2.886 -17.785 -1.908 833 HG21 VAL 103 HG21 VAL 103 4.810 -19.036 0.174 834 HG22 VAL 103 HG22 VAL 103 5.266 -18.755 -1.540 835 HG23 VAL 103 HG23 VAL 103 6.266 -18.061 -0.219 836 H LYS 104 H LYS 104 7.044 -16.511 -2.971 837 HA LYS 104 HA LYS 104 5.527 -17.447 -5.326 838 HB2 LYS 104 HB2 LYS 104 7.042 -15.316 -5.368 839 HB3 LYS 104 HB3 LYS 104 8.382 -16.470 -5.328 840 HG2 LYS 104 HG2 LYS 104 6.188 -16.846 -7.380 841 HG3 LYS 104 HG3 LYS 104 7.389 -15.572 -7.630 842 HD2 LYS 104 HD2 LYS 104 9.205 -17.342 -7.262 843 HD3 LYS 104 HD3 LYS 104 7.924 -18.562 -7.271 844 HE2 LYS 104 HE2 LYS 104 7.216 -17.406 -9.558 845 HE3 LYS 104 HE3 LYS 104 8.865 -16.766 -9.534 846 HZ1 LYS 104 HZ1 LYS 104 8.760 -18.850 -10.693 847 HZ2 LYS 104 HZ2 LYS 104 9.663 -19.040 -9.347 848 HZ3 LYS 104 HZ3 LYS 104 8.138 -19.621 -9.396 849 H ASP 105 H ASP 105 6.669 -19.297 -6.520 850 HA ASP 105 HA ASP 105 7.030 -21.490 -5.149 851 HB2 ASP 105 HB2 ASP 105 8.940 -20.675 -7.423 852 HB3 ASP 105 HB3 ASP 105 8.561 -22.333 -6.941 853 H GLY 106 H GLY 106 8.024 -21.419 -3.035 854 HA2 GLY 106 HA2 GLY 106 9.840 -21.929 -1.770 855 HA3 GLY 106 HA3 GLY 106 10.864 -21.823 -3.209 856 H ARG 107 H ARG 107 9.193 -18.831 -3.170 857 HA ARG 107 HA ARG 107 11.283 -17.678 -1.409 858 HB2 ARG 107 HB2 ARG 107 11.890 -17.568 -3.879 859 HB3 ARG 107 HB3 ARG 107 10.354 -16.754 -4.205 860 HG2 ARG 107 HG2 ARG 107 11.085 -14.730 -3.404 861 HG3 ARG 107 HG3 ARG 107 12.083 -15.457 -2.137 862 HD2 ARG 107 HD2 ARG 107 12.760 -15.430 -5.126 863 HD3 ARG 107 HD3 ARG 107 13.444 -14.338 -3.915 864 HE ARG 107 HE ARG 107 14.214 -16.591 -2.801 865 HH11 ARG 107 HH11 ARG 107 14.078 -15.906 -6.248 866 HH12 ARG 107 HH12 ARG 107 15.329 -17.037 -6.644 867 HH21 ARG 107 HH21 ARG 107 15.841 -18.078 -3.333 868 HH22 ARG 107 HH22 ARG 107 16.334 -18.274 -4.982 869 H THR 108 H THR 108 10.546 -16.289 0.055 870 HA THR 108 HA THR 108 7.785 -15.342 -0.252 871 HB THR 108 HB THR 108 9.391 -15.226 2.312 872 HG1 THR 108 HG1 THR 108 8.502 -17.371 2.782 873 HG21 THR 108 HG21 THR 108 7.131 -15.472 3.304 874 HG22 THR 108 HG22 THR 108 7.214 -14.067 2.187 875 HG23 THR 108 HG23 THR 108 6.425 -15.591 1.658 876 H LEU 109 H LEU 109 7.518 -13.179 -0.808 877 HA LEU 109 HA LEU 109 9.861 -11.452 -0.426 878 HB2 LEU 109 HB2 LEU 109 8.794 -11.761 -2.700 879 HB3 LEU 109 HB3 LEU 109 7.335 -10.995 -2.059 880 HG LEU 109 HG LEU 109 8.531 -8.904 -1.673 881 HD11 LEU 109 HD11 LEU 109 10.876 -8.618 -2.407 882 HD12 LEU 109 HD12 LEU 109 10.731 -9.818 -1.079 883 HD13 LEU 109 HD13 LEU 109 10.972 -10.374 -2.770 884 HD21 LEU 109 HD21 LEU 109 9.040 -8.316 -4.023 885 HD22 LEU 109 HD22 LEU 109 9.060 -10.060 -4.450 886 HD23 LEU 109 HD23 LEU 109 7.538 -9.290 -3.887 887 H HIS 110 H HIS 110 9.804 -9.664 0.907 888 HA HIS 110 HA HIS 110 7.274 -9.258 2.399 889 HB2 HIS 110 HB2 HIS 110 10.204 -9.198 3.218 890 HB3 HIS 110 HB3 HIS 110 8.995 -8.281 4.125 891 HD2 HIS 110 HD2 HIS 110 9.480 -12.109 3.092 892 HE1 HIS 110 HE1 HIS 110 7.512 -11.858 6.882 893 H MET 111 H MET 111 6.674 -7.095 2.797 894 HA MET 111 HA MET 111 8.246 -4.971 1.741 895 HB2 MET 111 HB2 MET 111 5.662 -5.804 0.410 896 HB3 MET 111 HB3 MET 111 6.289 -4.153 0.313 897 HG2 MET 111 HG2 MET 111 8.370 -4.981 -0.727 898 HG3 MET 111 HG3 MET 111 7.798 -6.648 -0.583 899 HE1 MET 111 HE1 MET 111 7.328 -6.585 -4.277 900 HE2 MET 111 HE2 MET 111 8.565 -5.432 -3.674 901 HE3 MET 111 HE3 MET 111 8.334 -7.012 -2.852 902 H MET 112 H MET 112 7.437 -2.811 2.321 903 HA MET 112 HA MET 112 5.162 -2.912 4.204 904 HB2 MET 112 HB2 MET 112 7.496 -2.913 5.288 905 HB3 MET 112 HB3 MET 112 7.658 -1.269 4.657 906 HG2 MET 112 HG2 MET 112 6.032 -0.402 6.072 907 HG3 MET 112 HG3 MET 112 5.171 -1.940 6.218 908 HE1 MET 112 HE1 MET 112 9.388 -1.503 8.008 909 HE2 MET 112 HE2 MET 112 8.818 -0.974 6.389 910 HE3 MET 112 HE3 MET 112 8.516 0.057 7.829 911 H ARG 113 H ARG 113 3.766 -1.067 4.036 912 HA ARG 113 HA ARG 113 4.669 1.050 2.210 913 HB2 ARG 113 HB2 ARG 113 2.618 -0.946 1.686 914 HB3 ARG 113 HB3 ARG 113 1.872 0.653 1.810 915 HG2 ARG 113 HG2 ARG 113 2.449 0.946 -0.351 916 HG3 ARG 113 HG3 ARG 113 4.107 1.168 0.224 917 HD2 ARG 113 HD2 ARG 113 4.324 -0.504 -1.429 918 HD3 ARG 113 HD3 ARG 113 4.329 -1.421 0.082 919 HE ARG 113 HE ARG 113 1.734 -1.099 -1.332 920 HH11 ARG 113 HH11 ARG 113 4.483 -3.142 -0.551 921 HH12 ARG 113 HH12 ARG 113 3.647 -4.620 -0.893 922 HH21 ARG 113 HH21 ARG 113 0.610 -3.045 -1.718 923 HH22 ARG 113 HH22 ARG 113 1.428 -4.564 -1.562 924 H LEU 114 H LEU 114 3.883 3.131 2.723 925 HA LEU 114 HA LEU 114 2.216 3.259 5.164 926 HB2 LEU 114 HB2 LEU 114 4.672 3.811 5.474 927 HB3 LEU 114 HB3 LEU 114 4.441 5.167 4.362 928 HG LEU 114 HG LEU 114 2.848 4.839 6.935 929 HD11 LEU 114 HD11 LEU 114 4.403 6.501 7.915 930 HD12 LEU 114 HD12 LEU 114 5.244 4.978 7.471 931 HD13 LEU 114 HD13 LEU 114 5.407 6.430 6.427 932 HD21 LEU 114 HD21 LEU 114 2.435 7.259 6.645 933 HD22 LEU 114 HD22 LEU 114 3.358 7.227 5.104 934 HD23 LEU 114 HD23 LEU 114 1.826 6.302 5.253 935 H TYR 115 H TYR 115 0.334 4.434 4.882 936 HA TYR 115 HA TYR 115 0.278 6.151 2.496 937 HB2 TYR 115 HB2 TYR 115 -1.981 5.566 2.106 938 HB3 TYR 115 HB3 TYR 115 -1.098 4.051 2.332 939 HD1 TYR 115 HD1 TYR 115 -3.633 6.325 3.762 940 HD2 TYR 115 HD2 TYR 115 -1.529 2.617 4.284 941 HE1 TYR 115 HE1 TYR 115 -5.292 5.626 5.460 942 HE2 TYR 115 HE2 TYR 115 -3.184 1.918 5.988 943 HH TYR 115 HH TYR 115 -5.348 2.345 6.750 944 H SER 116 H SER 116 -0.929 8.120 2.596 945 HA SER 116 HA SER 116 -1.376 9.027 5.383 946 HB2 SER 116 HB2 SER 116 -0.419 10.594 2.910 947 HB3 SER 116 HB3 SER 116 -0.749 11.296 4.500 948 HG SER 116 HG SER 116 1.440 10.941 4.484 949 H ARG 117 H ARG 117 -3.217 10.512 5.618 950 HA ARG 117 HA ARG 117 -5.435 9.749 4.070 951 HB2 ARG 117 HB2 ARG 117 -4.810 11.809 6.200 952 HB3 ARG 117 HB3 ARG 117 -6.311 11.996 5.284 953 HG2 ARG 117 HG2 ARG 117 -6.976 9.666 5.948 954 HG3 ARG 117 HG3 ARG 117 -5.499 9.538 6.912 955 HD2 ARG 117 HD2 ARG 117 -7.642 10.225 8.168 956 HD3 ARG 117 HD3 ARG 117 -6.204 11.214 8.454 957 HE ARG 117 HE ARG 117 -7.246 13.015 7.401 958 HH11 ARG 117 HH11 ARG 117 -9.125 10.094 6.834 959 HH12 ARG 117 HH12 ARG 117 -10.454 10.945 6.120 960 HH21 ARG 117 HH21 ARG 117 -8.986 14.112 6.446 961 HH22 ARG 117 HH22 ARG 117 -10.374 13.232 5.899 962 H SER 118 H SER 118 -2.921 12.129 3.468 963 HA SER 118 HA SER 118 -4.495 13.126 1.181 964 HB2 SER 118 HB2 SER 118 -2.724 14.882 2.941 965 HB3 SER 118 HB3 SER 118 -3.799 15.385 1.630 966 HG SER 118 HG SER 118 -4.746 15.741 3.738 967 HA PRO 119 HA PRO 119 -0.651 12.229 -0.895 968 HB2 PRO 119 HB2 PRO 119 -0.588 14.205 -2.855 969 HB3 PRO 119 HB3 PRO 119 -1.791 12.911 -2.930 970 HG2 PRO 119 HG2 PRO 119 -2.092 15.740 -1.886 971 HG3 PRO 119 HG3 PRO 119 -3.189 14.813 -2.917 972 HD2 PRO 119 HD2 PRO 119 -3.619 15.080 -0.227 973 HD3 PRO 119 HD3 PRO 119 -4.108 13.625 -1.106 974 H GLU 120 H GLU 120 0.123 13.200 1.448 975 HA GLU 120 HA GLU 120 2.445 14.736 0.688 976 HB2 GLU 120 HB2 GLU 120 2.035 16.441 2.490 977 HB3 GLU 120 HB3 GLU 120 1.037 16.614 1.041 978 HG2 GLU 120 HG2 GLU 120 -0.842 15.443 2.250 979 HG3 GLU 120 HG3 GLU 120 0.161 15.409 3.707 980 H VAL 121 H VAL 121 4.164 13.820 1.757 981 HA VAL 121 HA VAL 121 3.553 11.834 3.761 982 HB VAL 121 HB VAL 121 6.206 13.124 2.842 983 HG11 VAL 121 HG11 VAL 121 7.311 11.049 3.666 984 HG12 VAL 121 HG12 VAL 121 6.473 11.951 4.974 985 HG13 VAL 121 HG13 VAL 121 5.726 10.472 4.282 986 HG21 VAL 121 HG21 VAL 121 6.544 11.162 1.379 987 HG22 VAL 121 HG22 VAL 121 4.917 10.603 1.803 988 HG23 VAL 121 HG23 VAL 121 5.102 12.131 0.925 989 H SER 122 H SER 122 3.448 12.266 5.934 990 HA SER 122 HA SER 122 4.227 14.912 6.885 991 HB2 SER 122 HB2 SER 122 3.057 13.875 9.020 992 HB3 SER 122 HB3 SER 122 2.077 14.423 7.654 993 HG SER 122 HG SER 122 1.993 12.038 8.729 994 HA PRO 123 HA PRO 123 8.024 13.670 8.727 995 HB2 PRO 123 HB2 PRO 123 7.695 15.115 11.186 996 HB3 PRO 123 HB3 PRO 123 8.389 15.808 9.714 997 HG2 PRO 123 HG2 PRO 123 5.582 16.024 10.788 998 HG3 PRO 123 HG3 PRO 123 6.550 17.232 9.934 999 HD2 PRO 123 HD2 PRO 123 4.570 15.908 8.652 1000 HD3 PRO 123 HD3 PRO 123 6.068 16.310 7.803 1001 H ALA 124 H ALA 124 5.012 13.551 10.811 1002 HA ALA 124 HA ALA 124 6.188 11.966 12.788 1003 HB1 ALA 124 HB1 ALA 124 3.738 11.327 13.204 1004 HB2 ALA 124 HB2 ALA 124 3.895 13.086 12.875 1005 HB3 ALA 124 HB3 ALA 124 3.319 11.979 11.584 1006 H ALA 125 H ALA 125 4.063 10.718 9.991 1007 HA ALA 125 HA ALA 125 4.502 8.032 10.559 1008 HB1 ALA 125 HB1 ALA 125 3.911 7.675 8.182 1009 HB2 ALA 125 HB2 ALA 125 2.820 8.867 8.966 1010 HB3 ALA 125 HB3 ALA 125 4.125 9.430 7.868 1011 H THR 126 H THR 126 6.415 10.331 8.505 1012 HA THR 126 HA THR 126 8.209 8.542 7.446 1013 HB THR 126 HB THR 126 8.834 11.364 8.457 1014 HG1 THR 126 HG1 THR 126 7.099 11.710 7.133 1015 HG21 THR 126 HG21 THR 126 10.410 11.392 6.543 1016 HG22 THR 126 HG22 THR 126 10.793 10.068 7.695 1017 HG23 THR 126 HG23 THR 126 9.957 9.699 6.149 1018 H ALA 127 H ALA 127 8.452 10.385 10.616 1019 HA ALA 127 HA ALA 127 10.911 9.188 11.319 1020 HB1 ALA 127 HB1 ALA 127 10.399 10.136 13.560 1021 HB2 ALA 127 HB2 ALA 127 10.134 11.333 12.248 1022 HB3 ALA 127 HB3 ALA 127 8.731 10.510 13.010 1023 H ILE 128 H ILE 128 7.433 8.266 11.961 1024 HA ILE 128 HA ILE 128 8.119 6.371 13.928 1025 HB ILE 128 HB ILE 128 5.745 6.548 11.973 1026 HG12 ILE 128 HG12 ILE 128 5.933 8.508 13.424 1027 HG13 ILE 128 HG13 ILE 128 4.505 7.546 13.831 1028 HG21 ILE 128 HG21 ILE 128 4.525 5.079 13.551 1029 HG22 ILE 128 HG22 ILE 128 5.955 4.263 12.832 1030 HG23 ILE 128 HG23 ILE 128 6.027 4.883 14.516 1031 HD11 ILE 128 HD11 ILE 128 5.645 8.338 15.857 1032 HD12 ILE 128 HD12 ILE 128 5.710 6.546 15.753 1033 HD13 ILE 128 HD13 ILE 128 7.160 7.522 15.340 1034 H PHE 129 H PHE 129 7.173 5.913 10.392 1035 HA PHE 129 HA PHE 129 7.488 3.208 10.187 1036 HB2 PHE 129 HB2 PHE 129 6.779 4.980 8.438 1037 HB3 PHE 129 HB3 PHE 129 8.494 5.340 8.203 1038 HD1 PHE 129 HD1 PHE 129 10.000 3.658 7.164 1039 HD2 PHE 129 HD2 PHE 129 5.765 3.029 7.487 1040 HE1 PHE 129 HE1 PHE 129 10.136 1.870 5.454 1041 HE2 PHE 129 HE2 PHE 129 5.896 1.243 5.778 1042 HZ PHE 129 HZ PHE 129 8.084 0.658 4.759 1043 H ARG 130 H ARG 130 10.161 5.709 10.114 1044 HA ARG 130 HA ARG 130 12.150 3.868 9.397 1045 HB2 ARG 130 HB2 ARG 130 12.377 6.348 9.266 1046 HB3 ARG 130 HB3 ARG 130 12.368 6.443 11.032 1047 HG2 ARG 130 HG2 ARG 130 14.389 4.654 10.727 1048 HG3 ARG 130 HG3 ARG 130 14.526 5.482 9.170 1049 HD2 ARG 130 HD2 ARG 130 14.382 6.980 11.829 1050 HD3 ARG 130 HD3 ARG 130 15.909 6.437 11.122 1051 HE ARG 130 HE ARG 130 15.057 7.829 9.058 1052 HH11 ARG 130 HH11 ARG 130 14.520 8.620 12.440 1053 HH12 ARG 130 HH12 ARG 130 14.480 10.329 12.161 1054 HH21 ARG 130 HH21 ARG 130 15.027 10.077 8.708 1055 HH22 ARG 130 HH22 ARG 130 14.769 11.159 10.036 1056 H LYS 131 H LYS 131 10.925 4.974 12.655 1057 HA LYS 131 HA LYS 131 12.850 3.778 14.227 1058 HB2 LYS 131 HB2 LYS 131 9.862 4.099 14.758 1059 HB3 LYS 131 HB3 LYS 131 11.083 3.732 15.984 1060 HG2 LYS 131 HG2 LYS 131 12.254 5.907 15.355 1061 HG3 LYS 131 HG3 LYS 131 10.881 6.278 14.304 1062 HD2 LYS 131 HD2 LYS 131 9.336 6.144 16.263 1063 HD3 LYS 131 HD3 LYS 131 10.702 5.754 17.318 1064 HE2 LYS 131 HE2 LYS 131 11.789 7.946 16.608 1065 HE3 LYS 131 HE3 LYS 131 10.311 8.337 15.718 1066 HZ1 LYS 131 HZ1 LYS 131 10.306 9.302 17.908 1067 HZ2 LYS 131 HZ2 LYS 131 9.102 8.204 17.801 1068 HZ3 LYS 131 HZ3 LYS 131 10.466 7.843 18.623 1069 H LEU 132 H LEU 132 9.672 2.296 13.133 1070 HA LEU 132 HA LEU 132 10.233 -0.210 14.310 1071 HB2 LEU 132 HB2 LEU 132 8.453 0.538 11.947 1072 HB3 LEU 132 HB3 LEU 132 8.423 -1.010 12.803 1073 HG LEU 132 HG LEU 132 7.762 1.698 14.040 1074 HD11 LEU 132 HD11 LEU 132 5.429 0.872 14.041 1075 HD12 LEU 132 HD12 LEU 132 6.092 1.011 12.378 1076 HD13 LEU 132 HD13 LEU 132 5.957 -0.600 13.158 1077 HD21 LEU 132 HD21 LEU 132 6.915 0.359 15.938 1078 HD22 LEU 132 HD22 LEU 132 7.506 -1.137 15.139 1079 HD23 LEU 132 HD23 LEU 132 8.675 0.116 15.676 1080 H ALA 133 H ALA 133 10.732 1.144 10.964 1081 HA ALA 133 HA ALA 133 11.604 -1.199 9.757 1082 HB1 ALA 133 HB1 ALA 133 12.693 0.324 8.137 1083 HB2 ALA 133 HB2 ALA 133 11.022 0.850 8.535 1084 HB3 ALA 133 HB3 ALA 133 12.428 1.700 9.261 1085 H GLY 134 H GLY 134 13.405 1.188 11.839 1086 HA2 GLY 134 HA2 GLY 134 15.960 0.156 11.208 1087 HA3 GLY 134 HA3 GLY 134 15.511 1.154 12.597 1088 H GLU 135 H GLU 135 13.427 -0.751 13.686 1089 HA GLU 135 HA GLU 135 15.056 -2.194 15.384 1090 HB2 GLU 135 HB2 GLU 135 12.741 -1.943 15.980 1091 HB3 GLU 135 HB3 GLU 135 12.175 -2.512 14.405 1092 HG2 GLU 135 HG2 GLU 135 12.847 -4.807 14.919 1093 HG3 GLU 135 HG3 GLU 135 13.629 -4.291 16.420 1094 H ARG 136 H ARG 136 13.430 -3.252 12.255 1095 HA ARG 136 HA ARG 136 14.626 -5.857 12.506 1096 HB2 ARG 136 HB2 ARG 136 13.080 -4.397 10.291 1097 HB3 ARG 136 HB3 ARG 136 13.708 -6.037 10.083 1098 HG2 ARG 136 HG2 ARG 136 12.322 -6.848 11.948 1099 HG3 ARG 136 HG3 ARG 136 11.757 -5.205 12.280 1100 HD2 ARG 136 HD2 ARG 136 10.802 -5.125 9.923 1101 HD3 ARG 136 HD3 ARG 136 11.252 -6.825 9.731 1102 HE ARG 136 HE ARG 136 9.461 -7.433 11.089 1103 HH11 ARG 136 HH11 ARG 136 9.993 -3.967 11.362 1104 HH12 ARG 136 HH12 ARG 136 8.566 -3.700 12.306 1105 HH21 ARG 136 HH21 ARG 136 7.604 -7.068 12.348 1106 HH22 ARG 136 HH22 ARG 136 7.208 -5.464 12.867 1107 H ASN 137 H ASN 137 16.375 -3.185 12.195 1108 HA ASN 137 HA ASN 137 18.296 -2.641 11.228 1109 HB2 ASN 137 HB2 ASN 137 18.292 -5.659 10.725 1110 HB3 ASN 137 HB3 ASN 137 19.654 -4.627 10.267 1111 HD21 ASN 137 HD21 ASN 137 17.751 -5.875 12.991 1112 HD22 ASN 137 HD22 ASN 137 18.934 -5.552 14.215 1113 H TYR 138 H TYR 138 16.015 -2.053 9.635 1114 HA TYR 138 HA TYR 138 16.192 -3.192 7.039 1115 HB2 TYR 138 HB2 TYR 138 14.512 -1.586 6.527 1116 HB3 TYR 138 HB3 TYR 138 14.307 -1.757 8.276 1117 HD1 TYR 138 HD1 TYR 138 15.936 -0.013 9.680 1118 HD2 TYR 138 HD2 TYR 138 14.466 0.595 5.690 1119 HE1 TYR 138 HE1 TYR 138 16.235 2.429 9.943 1120 HE2 TYR 138 HE2 TYR 138 14.769 3.036 5.951 1121 HH TYR 138 HH TYR 138 15.402 4.688 7.263 1122 H THR 139 H THR 139 16.965 -2.099 5.044 1123 HA THR 139 HA THR 139 19.383 -0.518 5.624 1124 HB THR 139 HB THR 139 19.602 -1.029 3.022 1125 HG1 THR 139 HG1 THR 139 18.530 -3.085 2.496 1126 HG21 THR 139 HG21 THR 139 20.676 -3.217 3.551 1127 HG22 THR 139 HG22 THR 139 21.068 -1.976 4.788 1128 HG23 THR 139 HG23 THR 139 19.838 -3.237 5.139 1129 H ASP 140 H ASP 140 19.762 1.509 4.488 1130 HA ASP 140 HA ASP 140 17.595 3.230 4.385 1131 HB2 ASP 140 HB2 ASP 140 19.770 4.179 4.519 1132 HB3 ASP 140 HB3 ASP 140 20.402 3.172 3.209 1133 H GLU 141 H GLU 141 19.180 1.523 1.613 1134 HA GLU 141 HA GLU 141 17.394 2.550 -0.283 1135 HB2 GLU 141 HB2 GLU 141 19.273 0.185 -0.443 1136 HB3 GLU 141 HB3 GLU 141 18.343 0.835 -1.800 1137 HG2 GLU 141 HG2 GLU 141 19.481 3.035 -1.530 1138 HG3 GLU 141 HG3 GLU 141 20.406 2.391 -0.167 1139 H MET 142 H MET 142 16.727 0.274 2.178 1140 HA MET 142 HA MET 142 15.134 -1.506 0.549 1141 HB2 MET 142 HB2 MET 142 16.162 -2.385 2.567 1142 HB3 MET 142 HB3 MET 142 15.580 -1.030 3.544 1143 HG2 MET 142 HG2 MET 142 13.208 -1.850 3.129 1144 HG3 MET 142 HG3 MET 142 13.896 -3.276 2.341 1145 HE1 MET 142 HE1 MET 142 15.422 -5.378 5.074 1146 HE2 MET 142 HE2 MET 142 15.296 -4.972 3.329 1147 HE3 MET 142 HE3 MET 142 16.491 -4.121 4.365 1148 H VAL 143 H VAL 143 14.702 1.523 2.341 1149 HA VAL 143 HA VAL 143 11.809 1.342 2.070 1150 HB VAL 143 HB VAL 143 13.518 3.238 3.719 1151 HG11 VAL 143 HG11 VAL 143 11.360 4.000 4.671 1152 HG12 VAL 143 HG12 VAL 143 11.477 4.340 2.911 1153 HG13 VAL 143 HG13 VAL 143 10.483 2.963 3.495 1154 HG21 VAL 143 HG21 VAL 143 12.515 2.061 5.641 1155 HG22 VAL 143 HG22 VAL 143 11.689 0.934 4.512 1156 HG23 VAL 143 HG23 VAL 143 13.482 0.959 4.604 1157 H ALA 144 H ALA 144 10.643 3.255 1.193 1158 HA ALA 144 HA ALA 144 12.343 5.020 -0.442 1159 HB1 ALA 144 HB1 ALA 144 10.667 4.805 -2.250 1160 HB2 ALA 144 HB2 ALA 144 11.456 3.235 -1.876 1161 HB3 ALA 144 HB3 ALA 144 9.794 3.569 -1.281 1162 H MET 145 H MET 145 11.820 7.169 -0.260 1163 HA MET 145 HA MET 145 9.256 7.813 1.012 1164 HB2 MET 145 HB2 MET 145 11.935 9.231 1.164 1165 HB3 MET 145 HB3 MET 145 10.414 9.910 1.757 1166 HG2 MET 145 HG2 MET 145 10.164 7.929 3.287 1167 HG3 MET 145 HG3 MET 145 11.734 7.333 2.733 1168 HE1 MET 145 HE1 MET 145 12.639 8.631 6.322 1169 HE2 MET 145 HE2 MET 145 11.165 7.759 5.780 1170 HE3 MET 145 HE3 MET 145 12.776 7.279 5.146 1171 H LEU 146 H LEU 146 7.850 9.335 0.001 1172 HA LEU 146 HA LEU 146 8.982 10.467 -2.492 1173 HB2 LEU 146 HB2 LEU 146 6.130 9.627 -1.802 1174 HB3 LEU 146 HB3 LEU 146 6.611 10.462 -3.285 1175 HG LEU 146 HG LEU 146 6.345 8.161 -3.820 1176 HD11 LEU 146 HD11 LEU 146 8.610 7.494 -4.572 1177 HD12 LEU 146 HD12 LEU 146 8.277 9.232 -4.879 1178 HD13 LEU 146 HD13 LEU 146 9.324 8.748 -3.503 1179 HD21 LEU 146 HD21 LEU 146 7.555 6.330 -2.688 1180 HD22 LEU 146 HD22 LEU 146 8.212 7.508 -1.502 1181 HD23 LEU 146 HD23 LEU 146 6.444 7.201 -1.578 1182 HA PRO 147 HA PRO 147 8.071 14.222 -0.070 1183 HB2 PRO 147 HB2 PRO 147 9.890 15.792 -1.469 1184 HB3 PRO 147 HB3 PRO 147 10.454 14.685 -0.211 1185 HG2 PRO 147 HG2 PRO 147 10.420 14.300 -3.218 1186 HG3 PRO 147 HG3 PRO 147 11.702 13.917 -2.062 1187 HD2 PRO 147 HD2 PRO 147 10.007 11.998 -3.026 1188 HD3 PRO 147 HD3 PRO 147 10.690 11.904 -1.397 1189 H ARG 148 H ARG 148 8.066 16.686 -1.283 1190 HA ARG 148 HA ARG 148 5.655 16.704 -2.597 1191 HB2 ARG 148 HB2 ARG 148 5.825 19.006 -2.803 1192 HB3 ARG 148 HB3 ARG 148 6.664 18.571 -1.307 1193 HG2 ARG 148 HG2 ARG 148 8.057 19.125 -3.965 1194 HG3 ARG 148 HG3 ARG 148 7.822 20.325 -2.687 1195 HD2 ARG 148 HD2 ARG 148 9.381 17.703 -2.445 1196 HD3 ARG 148 HD3 ARG 148 10.074 19.326 -2.552 1197 HE ARG 148 HE ARG 148 8.395 19.461 -0.351 1198 HH11 ARG 148 HH11 ARG 148 11.101 17.430 -1.301 1199 HH12 ARG 148 HH12 ARG 148 11.587 17.105 0.330 1200 HH21 ARG 148 HH21 ARG 148 9.044 19.021 1.786 1201 HH22 ARG 148 HH22 ARG 148 10.418 18.010 2.084 1202 H GLN 149 H GLN 149 6.280 14.904 -4.122 1203 HA GLN 149 HA GLN 149 6.955 16.007 -6.685 1204 HB2 GLN 149 HB2 GLN 149 8.713 14.556 -5.649 1205 HB3 GLN 149 HB3 GLN 149 7.648 13.199 -6.037 1206 HG2 GLN 149 HG2 GLN 149 7.598 14.148 -8.450 1207 HG3 GLN 149 HG3 GLN 149 8.955 15.167 -7.951 1208 HE21 GLN 149 HE21 GLN 149 10.031 13.137 -6.039 1209 HE22 GLN 149 HE22 GLN 149 10.768 11.909 -7.013 1210 H GLU 150 H GLU 150 4.232 15.915 -5.629 1211 HA GLU 150 HA GLU 150 3.093 13.693 -7.028 1212 HB2 GLU 150 HB2 GLU 150 0.911 14.969 -6.340 1213 HB3 GLU 150 HB3 GLU 150 1.889 14.148 -5.116 1214 HG2 GLU 150 HG2 GLU 150 1.335 16.229 -4.150 1215 HG3 GLU 150 HG3 GLU 150 3.016 16.408 -4.667 1216 H GLU 151 H GLU 151 1.173 13.946 -8.530 1217 HA GLU 151 HA GLU 151 0.936 16.257 -10.125 1218 HB2 GLU 151 HB2 GLU 151 3.271 15.450 -10.770 1219 HB3 GLU 151 HB3 GLU 151 2.527 13.961 -11.368 1220 HG2 GLU 151 HG2 GLU 151 1.443 15.058 -13.153 1221 HG3 GLU 151 HG3 GLU 151 1.571 16.648 -12.391 1222 H CYS 152 H CYS 152 0.843 12.601 -10.157 1223 HA CYS 152 HA CYS 152 -1.751 12.856 -11.576 1224 HB2 CYS 152 HB2 CYS 152 0.043 11.498 -12.701 1225 HB3 CYS 152 HB3 CYS 152 0.208 10.505 -11.247 1226 H THR 153 H THR 153 -3.567 11.823 -10.614 1227 HA THR 153 HA THR 153 -3.108 10.593 -7.998 1228 HB THR 153 HB THR 153 -5.545 12.318 -8.254 1229 HG1 THR 153 HG1 THR 153 -4.296 14.279 -7.830 1230 HG21 THR 153 HG21 THR 153 -4.895 12.946 -5.938 1231 HG22 THR 153 HG22 THR 153 -4.915 11.164 -6.159 1232 HG23 THR 153 HG23 THR 153 -3.352 12.048 -6.134 1233 H VAL 154 H VAL 154 -5.045 9.293 -7.215 1234 HA VAL 154 HA VAL 154 -6.402 8.143 -9.564 1235 HB VAL 154 HB VAL 154 -5.184 6.639 -8.039 1236 HG11 VAL 154 HG11 VAL 154 -5.984 6.219 -5.731 1237 HG12 VAL 154 HG12 VAL 154 -5.335 7.880 -5.945 1238 HG13 VAL 154 HG13 VAL 154 -7.109 7.611 -5.882 1239 HG21 VAL 154 HG21 VAL 154 -7.013 5.029 -7.586 1240 HG22 VAL 154 HG22 VAL 154 -8.213 6.331 -7.885 1241 HG23 VAL 154 HG23 VAL 154 -7.140 5.776 -9.214 1242 H ASP 155 H ASP 155 -8.619 8.451 -9.863 1243 HA ASP 155 HA ASP 155 -9.871 10.442 -8.268 1244 HB2 ASP 155 HB2 ASP 155 -10.287 10.300 -10.686 1245 HB3 ASP 155 HB3 ASP 155 -10.924 8.658 -10.520 1246 H GLU 156 H GLU 156 -11.940 10.264 -7.151 1247 HA GLU 156 HA GLU 156 -12.160 7.652 -5.820 1248 HB2 GLU 156 HB2 GLU 156 -13.324 8.931 -4.041 1249 HB3 GLU 156 HB3 GLU 156 -11.651 9.447 -4.292 1250 HG2 GLU 156 HG2 GLU 156 -12.452 11.399 -5.617 1251 HG3 GLU 156 HG3 GLU 156 -14.125 10.884 -5.365 1252 H VAL 157 H VAL 157 -14.124 10.348 -7.309 1253 HA VAL 157 HA VAL 157 -15.915 8.552 -8.490 1254 HB VAL 157 HB VAL 157 -16.753 8.134 -6.247 1255 HG11 VAL 157 HG11 VAL 157 -17.695 9.934 -4.839 1256 HG12 VAL 157 HG12 VAL 157 -15.932 10.140 -5.117 1257 HG13 VAL 157 HG13 VAL 157 -17.108 11.154 -6.020 1258 HG21 VAL 157 HG21 VAL 157 -19.106 8.838 -6.526 1259 HG22 VAL 157 HG22 VAL 157 -18.601 9.992 -7.806 1260 HG23 VAL 157 HG23 VAL 157 -18.394 8.226 -8.057 1261 HN1 EB4 158 HN1 EB4 158 4.580 -6.548 -7.400 1262 H8 EB4 158 H8 EB4 158 -2.475 -5.908 -5.633 1263 HN2 EB4 158 HN2 EB4 158 2.046 -5.991 -9.211 1264 H9 EB4 158 H9 EB4 158 1.121 -0.894 -3.987 1265 H10 EB4 158 H10 EB4 158 4.669 -7.957 -1.664 1266 HN3 EB4 158 HN3 EB4 158 4.118 -3.443 -8.278 1267 H7 EB4 158 H7 EB4 158 2.881 -6.243 -1.868 1268 H11 EB4 158 H11 EB4 158 -3.544 -6.842 -7.672 1269 H12 EB4 158 H12 EB4 158 2.644 0.963 -4.588 1270 H15 EB4 158 H15 EB4 158 4.315 0.659 -6.391 1271 H14 EB4 158 H14 EB4 158 -2.172 -7.304 -9.683 1272 H13 EB4 158 H13 EB4 158 6.058 -8.485 -3.653 1273 H22 EB4 158 H22 EB4 158 5.405 -7.385 -7.718 1274 H30 EB4 158 H30 EB4 158 7.141 -4.261 -10.351 1275 H30A EB4 158 H30A EB4 158 7.250 -3.621 -8.637 1276 H24 EB4 158 H24 EB4 158 4.953 -2.777 -8.859 1277 H28 EB4 158 H28 EB4 158 4.476 -9.184 -9.233 1278 H28A EB4 158 H28A EB4 158 5.388 -8.363 -10.591 1279 H23 EB4 158 H23 EB4 158 1.782 -6.031 -10.418 1280 H29 EB4 158 H29 EB4 158 1.774 -4.062 -11.762 1281 H29A EB4 158 H29A EB4 158 3.335 -4.685 -12.581 Start of MODEL 14 1 H1 MET 1 H1 MET 1 -29.259 4.299 -4.972 2 H2 MET 1 H2 MET 1 -28.431 3.700 -3.699 3 H3 MET 1 H3 MET 1 -28.537 5.315 -3.918 4 HA MET 1 HA MET 1 -26.736 3.430 -5.045 5 HB2 MET 1 HB2 MET 1 -28.204 5.413 -6.835 6 HB3 MET 1 HB3 MET 1 -26.625 4.729 -7.243 7 HG2 MET 1 HG2 MET 1 -27.553 2.456 -7.234 8 HG3 MET 1 HG3 MET 1 -29.120 3.061 -6.678 9 HE1 MET 1 HE1 MET 1 -29.811 1.945 -10.411 10 HE2 MET 1 HE2 MET 1 -28.670 1.182 -9.253 11 HE3 MET 1 HE3 MET 1 -30.280 1.743 -8.690 12 H THR 2 H THR 2 -24.621 4.293 -4.909 13 HA THR 2 HA THR 2 -23.032 5.639 -4.145 14 HB THR 2 HB THR 2 -24.614 7.997 -5.258 15 HG1 THR 2 HG1 THR 2 -23.711 7.355 -7.356 16 HG21 THR 2 HG21 THR 2 -22.355 8.750 -5.940 17 HG22 THR 2 HG22 THR 2 -22.442 8.450 -4.172 18 HG23 THR 2 HG23 THR 2 -21.647 7.252 -5.248 19 H VAL 3 H VAL 3 -25.129 5.043 -2.204 20 HA VAL 3 HA VAL 3 -25.788 7.511 -0.912 21 HB VAL 3 HB VAL 3 -26.706 5.984 0.886 22 HG11 VAL 3 HG11 VAL 3 -28.581 5.165 -0.507 23 HG12 VAL 3 HG12 VAL 3 -28.105 6.842 -0.941 24 HG13 VAL 3 HG13 VAL 3 -27.607 5.468 -1.985 25 HG21 VAL 3 HG21 VAL 3 -26.912 3.578 0.369 26 HG22 VAL 3 HG22 VAL 3 -25.868 3.804 -1.075 27 HG23 VAL 3 HG23 VAL 3 -25.199 4.080 0.569 28 HA PRO 4 HA PRO 4 -22.130 7.649 1.639 29 HB2 PRO 4 HB2 PRO 4 -23.010 9.560 3.435 30 HB3 PRO 4 HB3 PRO 4 -22.678 10.014 1.758 31 HG2 PRO 4 HG2 PRO 4 -25.332 9.401 3.082 32 HG3 PRO 4 HG3 PRO 4 -24.926 10.697 1.949 33 HD2 PRO 4 HD2 PRO 4 -26.199 8.385 1.166 34 HD3 PRO 4 HD3 PRO 4 -25.163 9.316 0.077 35 H ASP 5 H ASP 5 -23.036 5.281 2.156 36 HA ASP 5 HA ASP 5 -23.658 5.273 5.042 37 HB2 ASP 5 HB2 ASP 5 -24.280 3.336 2.788 38 HB3 ASP 5 HB3 ASP 5 -24.232 2.790 4.470 39 H ARG 6 H ARG 6 -22.471 2.356 3.374 40 HA ARG 6 HA ARG 6 -20.395 2.003 5.196 41 HB2 ARG 6 HB2 ARG 6 -21.066 0.800 2.497 42 HB3 ARG 6 HB3 ARG 6 -19.560 0.374 3.320 43 HG2 ARG 6 HG2 ARG 6 -21.095 -1.311 3.954 44 HG3 ARG 6 HG3 ARG 6 -20.995 -0.245 5.362 45 HD2 ARG 6 HD2 ARG 6 -23.313 -0.576 5.115 46 HD3 ARG 6 HD3 ARG 6 -23.051 0.996 4.348 47 HE ARG 6 HE ARG 6 -22.981 -0.339 2.152 48 HH11 ARG 6 HH11 ARG 6 -24.803 -1.371 4.972 49 HH12 ARG 6 HH12 ARG 6 -25.951 -2.285 4.051 50 HH21 ARG 6 HH21 ARG 6 -24.494 -1.557 0.951 51 HH22 ARG 6 HH22 ARG 6 -25.775 -2.390 1.766 52 H SER 7 H SER 7 -20.560 3.952 2.242 53 HA SER 7 HA SER 7 -17.971 3.969 1.337 54 HB2 SER 7 HB2 SER 7 -19.384 6.612 1.644 55 HB3 SER 7 HB3 SER 7 -18.671 5.880 0.201 56 HG SER 7 HG SER 7 -21.210 6.003 0.647 57 H GLU 8 H GLU 8 -19.275 5.503 4.329 58 HA GLU 8 HA GLU 8 -17.118 7.199 4.826 59 HB2 GLU 8 HB2 GLU 8 -18.937 5.787 6.831 60 HB3 GLU 8 HB3 GLU 8 -17.915 7.192 7.162 61 HG2 GLU 8 HG2 GLU 8 -19.227 8.429 5.331 62 HG3 GLU 8 HG3 GLU 8 -20.342 7.057 5.317 63 H ILE 9 H ILE 9 -17.401 3.686 5.148 64 HA ILE 9 HA ILE 9 -15.122 3.542 6.907 65 HB ILE 9 HB ILE 9 -16.635 1.245 5.567 66 HG12 ILE 9 HG12 ILE 9 -17.089 2.510 8.316 67 HG13 ILE 9 HG13 ILE 9 -18.107 2.822 6.904 68 HG21 ILE 9 HG21 ILE 9 -15.744 -0.046 7.487 69 HG22 ILE 9 HG22 ILE 9 -14.422 0.673 6.507 70 HG23 ILE 9 HG23 ILE 9 -14.887 1.419 8.073 71 HD11 ILE 9 HD11 ILE 9 -19.125 1.146 8.375 72 HD12 ILE 9 HD12 ILE 9 -18.702 0.422 6.786 73 HD13 ILE 9 HD13 ILE 9 -17.669 0.105 8.220 74 H ALA 10 H ALA 10 -15.458 4.004 3.542 75 HA ALA 10 HA ALA 10 -12.840 2.714 3.113 76 HB1 ALA 10 HB1 ALA 10 -13.618 2.118 0.827 77 HB2 ALA 10 HB2 ALA 10 -14.594 1.306 2.098 78 HB3 ALA 10 HB3 ALA 10 -15.256 2.734 1.233 79 H GLY 11 H GLY 11 -12.204 3.576 0.588 80 HA2 GLY 11 HA2 GLY 11 -12.799 5.935 -0.433 81 HA3 GLY 11 HA3 GLY 11 -11.976 6.450 1.044 82 H LYS 12 H LYS 12 -10.392 7.457 -0.522 83 HA LYS 12 HA LYS 12 -8.579 5.433 -1.654 84 HB2 LYS 12 HB2 LYS 12 -7.727 7.266 -3.068 85 HB3 LYS 12 HB3 LYS 12 -9.447 6.949 -3.330 86 HG2 LYS 12 HG2 LYS 12 -10.102 8.950 -2.167 87 HG3 LYS 12 HG3 LYS 12 -8.487 9.179 -1.484 88 HD2 LYS 12 HD2 LYS 12 -7.545 9.802 -3.590 89 HD3 LYS 12 HD3 LYS 12 -8.897 9.117 -4.503 90 HE2 LYS 12 HE2 LYS 12 -9.134 11.521 -4.539 91 HE3 LYS 12 HE3 LYS 12 -10.413 10.870 -3.504 92 HZ1 LYS 12 HZ1 LYS 12 -9.249 12.808 -2.583 93 HZ2 LYS 12 HZ2 LYS 12 -9.179 11.511 -1.594 94 HZ3 LYS 12 HZ3 LYS 12 -7.869 11.942 -2.469 95 H TRP 13 H TRP 13 -6.299 5.617 -1.268 96 HA TRP 13 HA TRP 13 -5.535 7.470 0.896 97 HB2 TRP 13 HB2 TRP 13 -4.549 4.603 0.683 98 HB3 TRP 13 HB3 TRP 13 -4.368 5.734 2.030 99 HD1 TRP 13 HD1 TRP 13 -6.565 2.952 0.807 100 HE1 TRP 13 HE1 TRP 13 -8.635 2.702 2.337 101 HE3 TRP 13 HE3 TRP 13 -6.148 7.339 3.449 102 HZ2 TRP 13 HZ2 TRP 13 -9.925 4.151 4.376 103 HZ3 TRP 13 HZ3 TRP 13 -7.852 7.845 5.183 104 HH2 TRP 13 HH2 TRP 13 -9.711 6.270 5.639 105 H TYR 14 H TYR 14 -3.259 8.136 0.749 106 HA TYR 14 HA TYR 14 -2.147 7.575 -1.930 107 HB2 TYR 14 HB2 TYR 14 -1.578 9.876 0.013 108 HB3 TYR 14 HB3 TYR 14 -0.942 9.708 -1.628 109 HD1 TYR 14 HD1 TYR 14 -4.151 10.052 0.295 110 HD2 TYR 14 HD2 TYR 14 -2.175 10.545 -3.486 111 HE1 TYR 14 HE1 TYR 14 -6.145 11.219 -0.591 112 HE2 TYR 14 HE2 TYR 14 -4.168 11.713 -4.376 113 HH TYR 14 HH TYR 14 -6.461 12.022 -4.008 114 H VAL 15 H VAL 15 -0.317 6.135 -2.009 115 HA VAL 15 HA VAL 15 0.910 5.753 0.630 116 HB VAL 15 HB VAL 15 0.374 3.894 -0.865 117 HG11 VAL 15 HG11 VAL 15 1.610 3.463 -3.008 118 HG12 VAL 15 HG12 VAL 15 0.513 4.883 -3.069 119 HG13 VAL 15 HG13 VAL 15 2.285 5.124 -2.901 120 HG21 VAL 15 HG21 VAL 15 2.548 2.674 -1.017 121 HG22 VAL 15 HG22 VAL 15 3.388 4.206 -0.603 122 HG23 VAL 15 HG23 VAL 15 2.249 3.462 0.570 123 H VAL 16 H VAL 16 2.425 7.040 1.257 124 HA VAL 16 HA VAL 16 4.079 8.429 -0.720 125 HB VAL 16 HB VAL 16 4.452 10.121 1.030 126 HG11 VAL 16 HG11 VAL 16 2.174 11.122 1.129 127 HG12 VAL 16 HG12 VAL 16 2.576 10.488 -0.503 128 HG13 VAL 16 HG13 VAL 16 1.481 9.560 0.576 129 HG21 VAL 16 HG21 VAL 16 3.131 10.128 3.131 130 HG22 VAL 16 HG22 VAL 16 2.509 8.492 2.727 131 HG23 VAL 16 HG23 VAL 16 4.262 8.736 3.031 132 H ALA 17 H ALA 17 4.200 5.709 1.081 133 HA ALA 17 HA ALA 17 7.074 6.006 1.519 134 HB1 ALA 17 HB1 ALA 17 6.948 4.997 3.713 135 HB2 ALA 17 HB2 ALA 17 5.973 6.505 3.682 136 HB3 ALA 17 HB3 ALA 17 5.180 4.923 3.598 137 H LEU 18 H LEU 18 8.206 3.957 1.449 138 HA LEU 18 HA LEU 18 6.625 1.606 0.848 139 HB2 LEU 18 HB2 LEU 18 8.612 2.833 -1.130 140 HB3 LEU 18 HB3 LEU 18 7.874 1.233 -1.286 141 HG LEU 18 HG LEU 18 6.165 3.734 -1.136 142 HD11 LEU 18 HD11 LEU 18 6.161 3.782 -3.609 143 HD12 LEU 18 HD12 LEU 18 7.792 4.108 -2.933 144 HD13 LEU 18 HD13 LEU 18 7.414 2.496 -3.630 145 HD21 LEU 18 HD21 LEU 18 4.580 2.325 -2.410 146 HD22 LEU 18 HD22 LEU 18 5.764 0.975 -2.380 147 HD23 LEU 18 HD23 LEU 18 5.042 1.571 -0.847 148 H ALA 19 H ALA 19 7.852 -0.369 1.038 149 HA ALA 19 HA ALA 19 10.704 -0.118 1.667 150 HB1 ALA 19 HB1 ALA 19 10.431 -1.450 3.711 151 HB2 ALA 19 HB2 ALA 19 9.590 0.132 3.843 152 HB3 ALA 19 HB3 ALA 19 8.645 -1.365 3.537 153 H SER 20 H SER 20 11.787 -2.008 0.862 154 HA SER 20 HA SER 20 10.106 -4.317 0.278 155 HB2 SER 20 HB2 SER 20 11.754 -2.775 -1.800 156 HB3 SER 20 HB3 SER 20 11.180 -4.429 -2.049 157 HG SER 20 HG SER 20 9.114 -2.840 -1.157 158 H ASN 21 H ASN 21 11.272 -6.311 -0.017 159 HA ASN 21 HA ASN 21 13.912 -6.176 1.248 160 HB2 ASN 21 HB2 ASN 21 11.804 -7.673 1.955 161 HB3 ASN 21 HB3 ASN 21 12.397 -8.730 0.667 162 HD21 ASN 21 HD21 ASN 21 15.219 -8.375 0.998 163 HD22 ASN 21 HD22 ASN 21 15.669 -9.093 2.509 164 H THR 22 H THR 22 12.426 -6.523 -1.966 165 HA THR 22 HA THR 22 14.668 -8.187 -2.824 166 HB THR 22 HB THR 22 13.296 -7.351 -5.081 167 HG1 THR 22 HG1 THR 22 11.216 -6.765 -4.585 168 HG21 THR 22 HG21 THR 22 11.965 -9.447 -4.901 169 HG22 THR 22 HG22 THR 22 13.669 -9.707 -4.395 170 HG23 THR 22 HG23 THR 22 12.378 -9.554 -3.156 171 H GLU 23 H GLU 23 16.504 -7.425 -3.782 172 HA GLU 23 HA GLU 23 17.294 -4.809 -3.595 173 HB2 GLU 23 HB2 GLU 23 18.189 -6.746 -5.793 174 HB3 GLU 23 HB3 GLU 23 19.139 -5.457 -5.043 175 HG2 GLU 23 HG2 GLU 23 18.138 -7.929 -3.558 176 HG3 GLU 23 HG3 GLU 23 19.734 -7.801 -4.311 177 H PHE 24 H PHE 24 16.009 -6.502 -6.569 178 HA PHE 24 HA PHE 24 16.249 -4.373 -8.293 179 HB2 PHE 24 HB2 PHE 24 14.133 -6.581 -8.092 180 HB3 PHE 24 HB3 PHE 24 14.278 -5.494 -9.480 181 HD1 PHE 24 HD1 PHE 24 16.328 -5.557 -10.905 182 HD2 PHE 24 HD2 PHE 24 15.616 -8.436 -7.800 183 HE1 PHE 24 HE1 PHE 24 18.007 -7.066 -11.922 184 HE2 PHE 24 HE2 PHE 24 17.295 -9.949 -8.813 185 HZ PHE 24 HZ PHE 24 18.496 -9.265 -10.878 186 H PHE 25 H PHE 25 13.328 -5.224 -6.233 187 HA PHE 25 HA PHE 25 11.759 -3.118 -7.122 188 HB2 PHE 25 HB2 PHE 25 11.849 -4.740 -4.568 189 HB3 PHE 25 HB3 PHE 25 10.726 -3.384 -4.729 190 HD1 PHE 25 HD1 PHE 25 11.826 -6.505 -6.508 191 HD2 PHE 25 HD2 PHE 25 8.660 -3.702 -5.765 192 HE1 PHE 25 HE1 PHE 25 10.259 -7.949 -7.765 193 HE2 PHE 25 HE2 PHE 25 7.089 -5.140 -7.028 194 HZ PHE 25 HZ PHE 25 7.885 -7.268 -8.030 195 H LEU 26 H LEU 26 14.182 -3.184 -4.412 196 HA LEU 26 HA LEU 26 13.636 -0.620 -3.429 197 HB2 LEU 26 HB2 LEU 26 16.287 -2.126 -3.584 198 HB3 LEU 26 HB3 LEU 26 15.933 -0.752 -2.528 199 HG LEU 26 HG LEU 26 14.654 -3.517 -2.398 200 HD11 LEU 26 HD11 LEU 26 15.800 -3.657 -0.218 201 HD12 LEU 26 HD12 LEU 26 16.958 -3.455 -1.575 202 HD13 LEU 26 HD13 LEU 26 16.560 -2.058 -0.519 203 HD21 LEU 26 HD21 LEU 26 13.536 -2.688 -0.356 204 HD22 LEU 26 HD22 LEU 26 14.194 -1.046 -0.668 205 HD23 LEU 26 HD23 LEU 26 13.025 -1.779 -1.818 206 H ARG 27 H ARG 27 15.532 -1.780 -6.257 207 HA ARG 27 HA ARG 27 16.783 0.757 -6.703 208 HB2 ARG 27 HB2 ARG 27 17.700 -1.509 -7.383 209 HB3 ARG 27 HB3 ARG 27 16.424 -1.603 -8.603 210 HG2 ARG 27 HG2 ARG 27 17.344 0.706 -9.438 211 HG3 ARG 27 HG3 ARG 27 18.770 0.327 -8.464 212 HD2 ARG 27 HD2 ARG 27 19.267 -0.493 -10.645 213 HD3 ARG 27 HD3 ARG 27 18.876 -1.927 -9.687 214 HE ARG 27 HE ARG 27 16.456 -1.190 -10.828 215 HH11 ARG 27 HH11 ARG 27 19.655 -1.926 -12.078 216 HH12 ARG 27 HH12 ARG 27 19.054 -2.567 -13.571 217 HH21 ARG 27 HH21 ARG 27 15.678 -2.030 -12.779 218 HH22 ARG 27 HH22 ARG 27 16.784 -2.626 -13.971 219 H GLU 28 H GLU 28 13.932 -1.063 -8.063 220 HA GLU 28 HA GLU 28 13.445 0.889 -10.063 221 HB2 GLU 28 HB2 GLU 28 11.359 -1.016 -8.952 222 HB3 GLU 28 HB3 GLU 28 11.531 -0.397 -10.600 223 HG2 GLU 28 HG2 GLU 28 13.307 -2.464 -9.226 224 HG3 GLU 28 HG3 GLU 28 12.135 -2.759 -10.517 225 H LYS 29 H LYS 29 11.625 0.096 -6.952 226 HA LYS 29 HA LYS 29 9.894 2.254 -7.257 227 HB2 LYS 29 HB2 LYS 29 10.613 0.335 -5.098 228 HB3 LYS 29 HB3 LYS 29 9.930 1.870 -4.547 229 HG2 LYS 29 HG2 LYS 29 8.596 0.200 -6.724 230 HG3 LYS 29 HG3 LYS 29 8.297 -0.088 -5.005 231 HD2 LYS 29 HD2 LYS 29 6.552 1.385 -5.680 232 HD3 LYS 29 HD3 LYS 29 7.699 2.417 -4.815 233 HE2 LYS 29 HE2 LYS 29 7.582 3.759 -6.648 234 HE3 LYS 29 HE3 LYS 29 8.689 2.596 -7.388 235 HZ1 LYS 29 HZ1 LYS 29 7.107 2.231 -8.865 236 HZ2 LYS 29 HZ2 LYS 29 6.157 1.565 -7.716 237 HZ3 LYS 29 HZ3 LYS 29 6.020 3.153 -8.070 238 H ASP 30 H ASP 30 13.030 2.087 -5.375 239 HA ASP 30 HA ASP 30 12.803 4.605 -4.223 240 HB2 ASP 30 HB2 ASP 30 14.548 3.313 -3.388 241 HB3 ASP 30 HB3 ASP 30 15.088 2.789 -4.989 242 H LYS 31 H LYS 31 13.676 3.670 -7.582 243 HA LYS 31 HA LYS 31 14.456 6.368 -8.043 244 HB2 LYS 31 HB2 LYS 31 14.522 3.844 -9.689 245 HB3 LYS 31 HB3 LYS 31 14.560 5.413 -10.505 246 HG2 LYS 31 HG2 LYS 31 16.506 4.562 -8.301 247 HG3 LYS 31 HG3 LYS 31 16.837 4.440 -10.034 248 HD2 LYS 31 HD2 LYS 31 17.473 6.605 -10.099 249 HD3 LYS 31 HD3 LYS 31 15.881 7.115 -9.522 250 HE2 LYS 31 HE2 LYS 31 18.106 6.140 -7.665 251 HE3 LYS 31 HE3 LYS 31 17.880 7.840 -8.098 252 HZ1 LYS 31 HZ1 LYS 31 16.759 7.484 -6.096 253 HZ2 LYS 31 HZ2 LYS 31 15.571 7.567 -7.213 254 HZ3 LYS 31 HZ3 LYS 31 16.020 6.120 -6.605 255 H MET 32 H MET 32 11.106 4.701 -8.056 256 HA MET 32 HA MET 32 10.841 6.710 -10.314 257 HB2 MET 32 HB2 MET 32 9.184 4.682 -8.590 258 HB3 MET 32 HB3 MET 32 8.457 5.505 -9.975 259 HG2 MET 32 HG2 MET 32 10.586 3.968 -11.065 260 HG3 MET 32 HG3 MET 32 9.838 2.935 -9.841 261 HE1 MET 32 HE1 MET 32 7.408 4.893 -13.321 262 HE2 MET 32 HE2 MET 32 7.918 5.784 -11.848 263 HE3 MET 32 HE3 MET 32 9.151 5.197 -13.015 264 H LYS 33 H LYS 33 7.713 6.318 -8.685 265 HA LYS 33 HA LYS 33 8.330 8.662 -7.023 266 HB2 LYS 33 HB2 LYS 33 6.307 8.608 -9.320 267 HB3 LYS 33 HB3 LYS 33 6.245 9.801 -8.015 268 HG2 LYS 33 HG2 LYS 33 8.135 10.974 -8.791 269 HG3 LYS 33 HG3 LYS 33 8.822 9.564 -9.609 270 HD2 LYS 33 HD2 LYS 33 7.022 9.713 -11.367 271 HD3 LYS 33 HD3 LYS 33 6.348 11.131 -10.552 272 HE2 LYS 33 HE2 LYS 33 8.279 12.474 -11.033 273 HE3 LYS 33 HE3 LYS 33 9.270 11.064 -11.431 274 HZ1 LYS 33 HZ1 LYS 33 8.549 12.221 -13.396 275 HZ2 LYS 33 HZ2 LYS 33 7.889 10.728 -13.378 276 HZ3 LYS 33 HZ3 LYS 33 6.974 12.030 -13.011 277 H MET 34 H MET 34 5.871 9.426 -6.084 278 HA MET 34 HA MET 34 5.212 7.197 -4.441 279 HB2 MET 34 HB2 MET 34 5.050 9.438 -3.566 280 HB3 MET 34 HB3 MET 34 4.111 10.000 -4.955 281 HG2 MET 34 HG2 MET 34 2.229 8.460 -4.186 282 HG3 MET 34 HG3 MET 34 3.166 8.158 -2.717 283 HE1 MET 34 HE1 MET 34 1.147 12.119 -3.972 284 HE2 MET 34 HE2 MET 34 2.838 11.899 -4.536 285 HE3 MET 34 HE3 MET 34 1.570 10.723 -5.019 286 H ALA 35 H ALA 35 3.222 6.180 -4.243 287 HA ALA 35 HA ALA 35 1.781 5.784 -6.749 288 HB1 ALA 35 HB1 ALA 35 1.369 3.481 -6.062 289 HB2 ALA 35 HB2 ALA 35 3.103 3.868 -6.326 290 HB3 ALA 35 HB3 ALA 35 2.459 3.726 -4.656 291 H MET 36 H MET 36 -0.442 4.549 -6.227 292 HA MET 36 HA MET 36 -1.719 6.209 -4.141 293 HB2 MET 36 HB2 MET 36 -2.739 5.320 -6.916 294 HB3 MET 36 HB3 MET 36 -3.711 6.190 -5.722 295 HG2 MET 36 HG2 MET 36 -1.159 7.361 -6.874 296 HG3 MET 36 HG3 MET 36 -2.719 7.514 -7.692 297 HE1 MET 36 HE1 MET 36 -1.476 10.852 -5.548 298 HE2 MET 36 HE2 MET 36 -0.365 9.445 -5.655 299 HE3 MET 36 HE3 MET 36 -1.235 10.016 -7.119 300 H ALA 37 H ALA 37 -3.841 5.184 -3.381 301 HA ALA 37 HA ALA 37 -4.335 2.451 -4.138 302 HB1 ALA 37 HB1 ALA 37 -3.972 1.644 -1.774 303 HB2 ALA 37 HB2 ALA 37 -2.434 2.257 -2.471 304 HB3 ALA 37 HB3 ALA 37 -3.363 3.270 -1.315 305 H ARG 38 H ARG 38 -6.487 2.233 -4.053 306 HA ARG 38 HA ARG 38 -8.034 3.782 -2.053 307 HB2 ARG 38 HB2 ARG 38 -8.308 4.912 -4.167 308 HB3 ARG 38 HB3 ARG 38 -8.526 3.384 -5.030 309 HG2 ARG 38 HG2 ARG 38 -10.628 3.034 -3.552 310 HG3 ARG 38 HG3 ARG 38 -10.449 4.731 -3.089 311 HD2 ARG 38 HD2 ARG 38 -10.608 5.435 -5.452 312 HD3 ARG 38 HD3 ARG 38 -10.668 3.748 -5.980 313 HE ARG 38 HE ARG 38 -12.795 3.905 -4.250 314 HH11 ARG 38 HH11 ARG 38 -11.790 5.884 -6.979 315 HH12 ARG 38 HH12 ARG 38 -13.409 6.317 -7.415 316 HH21 ARG 38 HH21 ARG 38 -14.910 4.481 -4.835 317 HH22 ARG 38 HH22 ARG 38 -15.182 5.519 -6.195 318 H ILE 39 H ILE 39 -9.571 2.438 -0.994 319 HA ILE 39 HA ILE 39 -9.657 -0.300 -2.039 320 HB ILE 39 HB ILE 39 -10.165 0.527 0.852 321 HG12 ILE 39 HG12 ILE 39 -7.911 1.262 0.352 322 HG13 ILE 39 HG13 ILE 39 -7.855 -0.183 1.371 323 HG21 ILE 39 HG21 ILE 39 -9.658 -1.859 1.289 324 HG22 ILE 39 HG22 ILE 39 -11.040 -1.662 0.159 325 HG23 ILE 39 HG23 ILE 39 -9.423 -2.124 -0.472 326 HD11 ILE 39 HD11 ILE 39 -6.144 -0.273 -0.385 327 HD12 ILE 39 HD12 ILE 39 -7.354 -1.581 -0.613 328 HD13 ILE 39 HD13 ILE 39 -7.410 -0.114 -1.648 329 H SER 40 H SER 40 -11.677 -1.370 -2.180 330 HA SER 40 HA SER 40 -14.029 0.233 -1.418 331 HB2 SER 40 HB2 SER 40 -13.705 -1.352 -4.015 332 HB3 SER 40 HB3 SER 40 -15.103 -0.387 -3.525 333 HG SER 40 HG SER 40 -13.692 0.776 -4.983 334 H PHE 41 H PHE 41 -15.629 -0.934 -0.339 335 HA PHE 41 HA PHE 41 -14.936 -3.616 0.388 336 HB2 PHE 41 HB2 PHE 41 -17.173 -3.489 1.590 337 HB3 PHE 41 HB3 PHE 41 -15.968 -2.289 2.074 338 HD1 PHE 41 HD1 PHE 41 -16.266 0.105 1.500 339 HD2 PHE 41 HD2 PHE 41 -19.234 -2.825 0.464 340 HE1 PHE 41 HE1 PHE 41 -17.909 1.914 1.090 341 HE2 PHE 41 HE2 PHE 41 -20.875 -1.019 0.052 342 HZ PHE 41 HZ PHE 41 -20.218 1.354 0.363 343 H LEU 42 H LEU 42 -15.180 -5.276 -1.046 344 HA LEU 42 HA LEU 42 -17.120 -5.140 -3.149 345 HB2 LEU 42 HB2 LEU 42 -14.816 -6.279 -3.158 346 HB3 LEU 42 HB3 LEU 42 -15.524 -7.534 -2.132 347 HG LEU 42 HG LEU 42 -15.376 -8.222 -4.481 348 HD11 LEU 42 HD11 LEU 42 -17.707 -8.990 -4.782 349 HD12 LEU 42 HD12 LEU 42 -17.143 -9.180 -3.087 350 HD13 LEU 42 HD13 LEU 42 -18.244 -7.829 -3.521 351 HD21 LEU 42 HD21 LEU 42 -16.828 -7.185 -6.196 352 HD22 LEU 42 HD22 LEU 42 -17.313 -5.924 -5.012 353 HD23 LEU 42 HD23 LEU 42 -15.606 -6.034 -5.558 354 H GLY 43 H GLY 43 -16.700 -7.069 -0.110 355 HA2 GLY 43 HA2 GLY 43 -19.556 -7.367 0.165 356 HA3 GLY 43 HA3 GLY 43 -18.696 -8.853 -0.259 357 H GLU 44 H GLU 44 -19.929 -8.936 2.174 358 HA GLU 44 HA GLU 44 -18.603 -7.877 4.372 359 HB2 GLU 44 HB2 GLU 44 -19.851 -10.659 4.137 360 HB3 GLU 44 HB3 GLU 44 -19.666 -9.694 5.607 361 HG2 GLU 44 HG2 GLU 44 -21.285 -8.064 4.842 362 HG3 GLU 44 HG3 GLU 44 -21.330 -8.776 3.224 363 H ASP 45 H ASP 45 -17.736 -10.702 2.262 364 HA ASP 45 HA ASP 45 -15.364 -11.104 3.976 365 HB2 ASP 45 HB2 ASP 45 -16.787 -13.077 3.999 366 HB3 ASP 45 HB3 ASP 45 -17.026 -13.008 2.248 367 H GLU 46 H GLU 46 -16.254 -9.600 1.078 368 HA GLU 46 HA GLU 46 -13.595 -10.210 -0.027 369 HB2 GLU 46 HB2 GLU 46 -15.491 -11.292 -1.307 370 HB3 GLU 46 HB3 GLU 46 -16.098 -9.671 -1.672 371 HG2 GLU 46 HG2 GLU 46 -14.242 -9.132 -3.027 372 HG3 GLU 46 HG3 GLU 46 -13.222 -10.386 -2.310 373 H LEU 47 H LEU 47 -12.515 -8.520 -1.146 374 HA LEU 47 HA LEU 47 -13.602 -5.842 -0.805 375 HB2 LEU 47 HB2 LEU 47 -11.588 -5.005 0.257 376 HB3 LEU 47 HB3 LEU 47 -12.451 -6.172 1.268 377 HG LEU 47 HG LEU 47 -10.171 -7.134 -0.459 378 HD11 LEU 47 HD11 LEU 47 -8.607 -6.608 1.366 379 HD12 LEU 47 HD12 LEU 47 -9.316 -5.121 0.652 380 HD13 LEU 47 HD13 LEU 47 -9.911 -5.730 2.233 381 HD21 LEU 47 HD21 LEU 47 -9.929 -8.712 1.418 382 HD22 LEU 47 HD22 LEU 47 -11.271 -7.890 2.283 383 HD23 LEU 47 HD23 LEU 47 -11.590 -8.745 0.736 384 H LYS 48 H LYS 48 -12.729 -4.276 -2.184 385 HA LYS 48 HA LYS 48 -11.022 -5.350 -4.323 386 HB2 LYS 48 HB2 LYS 48 -13.391 -5.019 -5.004 387 HB3 LYS 48 HB3 LYS 48 -13.214 -3.294 -4.656 388 HG2 LYS 48 HG2 LYS 48 -11.394 -3.107 -6.310 389 HG3 LYS 48 HG3 LYS 48 -11.447 -4.850 -6.607 390 HD2 LYS 48 HD2 LYS 48 -13.825 -2.975 -7.022 391 HD3 LYS 48 HD3 LYS 48 -12.698 -3.437 -8.304 392 HE2 LYS 48 HE2 LYS 48 -14.347 -5.413 -6.639 393 HE3 LYS 48 HE3 LYS 48 -14.801 -4.831 -8.247 394 HZ1 LYS 48 HZ1 LYS 48 -13.678 -6.666 -8.835 395 HZ2 LYS 48 HZ2 LYS 48 -12.363 -5.704 -8.732 396 HZ3 LYS 48 HZ3 LYS 48 -12.737 -6.709 -7.501 397 H VAL 49 H VAL 49 -9.248 -4.029 -5.000 398 HA VAL 49 HA VAL 49 -9.092 -1.465 -3.588 399 HB VAL 49 HB VAL 49 -6.663 -1.833 -3.225 400 HG11 VAL 49 HG11 VAL 49 -6.849 -3.539 -1.452 401 HG12 VAL 49 HG12 VAL 49 -8.256 -2.422 -1.451 402 HG13 VAL 49 HG13 VAL 49 -8.422 -4.075 -2.134 403 HG21 VAL 49 HG21 VAL 49 -5.677 -4.067 -3.572 404 HG22 VAL 49 HG22 VAL 49 -7.209 -4.625 -4.325 405 HG23 VAL 49 HG23 VAL 49 -6.237 -3.339 -5.116 406 H SER 50 H SER 50 -8.226 0.276 -4.826 407 HA SER 50 HA SER 50 -7.551 -0.438 -7.618 408 HB2 SER 50 HB2 SER 50 -7.949 2.308 -7.487 409 HB3 SER 50 HB3 SER 50 -9.144 1.122 -8.029 410 HG SER 50 HG SER 50 -10.321 1.510 -6.285 411 H TYR 51 H TYR 51 -5.400 -0.221 -8.139 412 HA TYR 51 HA TYR 51 -3.696 1.355 -6.320 413 HB2 TYR 51 HB2 TYR 51 -3.493 -1.224 -7.804 414 HB3 TYR 51 HB3 TYR 51 -2.088 -0.172 -8.024 415 HD1 TYR 51 HD1 TYR 51 -2.058 1.093 -5.215 416 HD2 TYR 51 HD2 TYR 51 -2.515 -2.968 -6.542 417 HE1 TYR 51 HE1 TYR 51 -1.086 0.286 -3.085 418 HE2 TYR 51 HE2 TYR 51 -1.561 -3.776 -4.408 419 HH TYR 51 HH TYR 51 -1.307 -2.944 -2.048 420 H ALA 52 H ALA 52 -2.330 2.958 -7.222 421 HA ALA 52 HA ALA 52 -2.403 3.260 -10.146 422 HB1 ALA 52 HB1 ALA 52 -2.762 5.689 -9.868 423 HB2 ALA 52 HB2 ALA 52 -4.157 4.735 -9.260 424 HB3 ALA 52 HB3 ALA 52 -2.986 5.452 -8.102 425 H VAL 53 H VAL 53 -0.362 3.690 -10.972 426 HA VAL 53 HA VAL 53 1.560 4.864 -9.123 427 HB VAL 53 HB VAL 53 3.311 3.237 -9.957 428 HG11 VAL 53 HG11 VAL 53 2.616 1.381 -8.469 429 HG12 VAL 53 HG12 VAL 53 2.287 2.988 -7.738 430 HG13 VAL 53 HG13 VAL 53 0.943 2.033 -8.449 431 HG21 VAL 53 HG21 VAL 53 2.564 1.083 -10.914 432 HG22 VAL 53 HG22 VAL 53 0.884 1.712 -11.007 433 HG23 VAL 53 HG23 VAL 53 2.182 2.468 -11.992 434 HA PRO 54 HA PRO 54 2.430 6.982 -12.950 435 HB2 PRO 54 HB2 PRO 54 4.600 8.456 -12.094 436 HB3 PRO 54 HB3 PRO 54 3.000 8.827 -11.439 437 HG2 PRO 54 HG2 PRO 54 5.241 7.205 -10.200 438 HG3 PRO 54 HG3 PRO 54 4.190 8.410 -9.445 439 HD2 PRO 54 HD2 PRO 54 3.756 5.684 -9.224 440 HD3 PRO 54 HD3 PRO 54 2.454 6.875 -9.110 441 H LYS 55 H LYS 55 2.978 5.261 -14.207 442 HA LYS 55 HA LYS 55 5.701 4.205 -14.122 443 HB2 LYS 55 HB2 LYS 55 3.688 2.692 -14.214 444 HB3 LYS 55 HB3 LYS 55 3.361 3.320 -15.835 445 HG2 LYS 55 HG2 LYS 55 5.722 2.597 -16.495 446 HG3 LYS 55 HG3 LYS 55 5.855 1.808 -14.918 447 HD2 LYS 55 HD2 LYS 55 3.852 0.411 -15.439 448 HD3 LYS 55 HD3 LYS 55 3.695 1.211 -17.009 449 HE2 LYS 55 HE2 LYS 55 4.892 -0.647 -17.678 450 HE3 LYS 55 HE3 LYS 55 6.246 0.424 -17.295 451 HZ1 LYS 55 HZ1 LYS 55 6.520 -1.737 -16.305 452 HZ2 LYS 55 HZ2 LYS 55 6.369 -0.620 -15.124 453 HZ3 LYS 55 HZ3 LYS 55 5.119 -1.609 -15.478 454 HA PRO 56 HA PRO 56 7.306 6.933 -17.198 455 HB2 PRO 56 HB2 PRO 56 8.076 4.283 -18.554 456 HB3 PRO 56 HB3 PRO 56 9.107 5.689 -18.258 457 HG2 PRO 56 HG2 PRO 56 9.297 3.503 -16.707 458 HG3 PRO 56 HG3 PRO 56 9.487 5.119 -16.015 459 HD2 PRO 56 HD2 PRO 56 7.211 3.192 -15.718 460 HD3 PRO 56 HD3 PRO 56 7.721 4.494 -14.635 461 H ASN 57 H ASN 57 5.399 4.014 -18.220 462 HA ASN 57 HA ASN 57 4.873 5.157 -20.791 463 HB2 ASN 57 HB2 ASN 57 3.306 2.917 -19.423 464 HB3 ASN 57 HB3 ASN 57 3.517 3.196 -21.156 465 HD21 ASN 57 HD21 ASN 57 5.546 2.669 -22.151 466 HD22 ASN 57 HD22 ASN 57 6.667 1.590 -21.390 467 H GLY 58 H GLY 58 3.787 6.170 -17.769 468 HA2 GLY 58 HA2 GLY 58 2.176 8.000 -17.952 469 HA3 GLY 58 HA3 GLY 58 1.155 6.912 -18.902 470 H CYS 59 H CYS 59 -0.102 7.983 -16.745 471 HA CYS 59 HA CYS 59 0.255 6.838 -14.268 472 HB2 CYS 59 HB2 CYS 59 -2.308 7.671 -15.711 473 HB3 CYS 59 HB3 CYS 59 -2.217 7.286 -13.987 474 H ARG 60 H ARG 60 0.453 4.654 -13.786 475 HA ARG 60 HA ARG 60 -1.191 2.803 -15.374 476 HB2 ARG 60 HB2 ARG 60 1.323 2.507 -15.009 477 HB3 ARG 60 HB3 ARG 60 0.988 2.299 -13.285 478 HG2 ARG 60 HG2 ARG 60 1.113 0.093 -13.982 479 HG3 ARG 60 HG3 ARG 60 -0.630 0.374 -14.086 480 HD2 ARG 60 HD2 ARG 60 1.301 0.687 -16.441 481 HD3 ARG 60 HD3 ARG 60 0.384 -0.788 -16.102 482 HE ARG 60 HE ARG 60 -0.780 1.829 -16.936 483 HH11 ARG 60 HH11 ARG 60 -1.145 -1.619 -16.342 484 HH12 ARG 60 HH12 ARG 60 -2.664 -1.726 -17.167 485 HH21 ARG 60 HH21 ARG 60 -2.762 1.666 -18.046 486 HH22 ARG 60 HH22 ARG 60 -3.585 0.144 -18.137 487 H LYS 61 H LYS 61 -3.025 1.924 -14.499 488 HA LYS 61 HA LYS 61 -3.318 2.045 -11.570 489 HB2 LYS 61 HB2 LYS 61 -5.727 2.529 -11.943 490 HB3 LYS 61 HB3 LYS 61 -4.678 3.831 -12.518 491 HG2 LYS 61 HG2 LYS 61 -5.013 3.207 -14.833 492 HG3 LYS 61 HG3 LYS 61 -5.786 1.681 -14.383 493 HD2 LYS 61 HD2 LYS 61 -7.043 4.177 -13.274 494 HD3 LYS 61 HD3 LYS 61 -7.167 3.955 -15.024 495 HE2 LYS 61 HE2 LYS 61 -9.112 2.973 -13.816 496 HE3 LYS 61 HE3 LYS 61 -8.216 1.756 -14.735 497 HZ1 LYS 61 HZ1 LYS 61 -8.879 1.273 -12.331 498 HZ2 LYS 61 HZ2 LYS 61 -7.379 0.848 -12.814 499 HZ3 LYS 61 HZ3 LYS 61 -7.595 2.188 -11.907 500 H TRP 62 H TRP 62 -4.600 0.319 -10.659 501 HA TRP 62 HA TRP 62 -5.602 -1.728 -12.438 502 HB2 TRP 62 HB2 TRP 62 -3.142 -2.232 -12.264 503 HB3 TRP 62 HB3 TRP 62 -3.305 -2.316 -10.505 504 HD1 TRP 62 HD1 TRP 62 -3.415 -4.771 -9.708 505 HE1 TRP 62 HE1 TRP 62 -4.425 -6.977 -10.599 506 HE3 TRP 62 HE3 TRP 62 -5.395 -3.026 -14.116 507 HZ2 TRP 62 HZ2 TRP 62 -5.860 -7.870 -12.850 508 HZ3 TRP 62 HZ3 TRP 62 -6.580 -4.627 -15.598 509 HH2 TRP 62 HH2 TRP 62 -6.807 -7.013 -14.972 510 H GLU 63 H GLU 63 -6.983 -3.262 -11.243 511 HA GLU 63 HA GLU 63 -7.461 -2.459 -8.445 512 HB2 GLU 63 HB2 GLU 63 -9.954 -3.107 -9.212 513 HB3 GLU 63 HB3 GLU 63 -9.333 -1.452 -9.254 514 HG2 GLU 63 HG2 GLU 63 -9.106 -3.219 -11.715 515 HG3 GLU 63 HG3 GLU 63 -10.643 -2.438 -11.320 516 H THR 64 H THR 64 -7.660 -4.171 -7.081 517 HA THR 64 HA THR 64 -8.012 -6.822 -8.283 518 HB THR 64 HB THR 64 -6.117 -6.217 -5.963 519 HG1 THR 64 HG1 THR 64 -5.554 -6.368 -8.816 520 HG21 THR 64 HG21 THR 64 -5.162 -8.425 -6.586 521 HG22 THR 64 HG22 THR 64 -6.909 -8.544 -6.187 522 HG23 THR 64 HG23 THR 64 -6.375 -8.570 -7.902 523 H THR 65 H THR 65 -8.999 -8.406 -6.924 524 HA THR 65 HA THR 65 -10.485 -7.244 -4.679 525 HB THR 65 HB THR 65 -11.199 -9.818 -6.130 526 HG1 THR 65 HG1 THR 65 -12.480 -8.502 -7.520 527 HG21 THR 65 HG21 THR 65 -13.449 -9.215 -5.286 528 HG22 THR 65 HG22 THR 65 -12.264 -9.327 -3.942 529 HG23 THR 65 HG23 THR 65 -12.778 -7.719 -4.554 530 H PHE 66 H PHE 66 -10.343 -8.168 -2.569 531 HA PHE 66 HA PHE 66 -8.625 -10.559 -2.404 532 HB2 PHE 66 HB2 PHE 66 -8.704 -8.280 -0.379 533 HB3 PHE 66 HB3 PHE 66 -7.619 -9.677 -0.385 534 HD1 PHE 66 HD1 PHE 66 -6.846 -9.723 -3.304 535 HD2 PHE 66 HD2 PHE 66 -7.228 -6.478 -0.520 536 HE1 PHE 66 HE1 PHE 66 -5.185 -8.422 -4.598 537 HE2 PHE 66 HE2 PHE 66 -5.565 -5.175 -1.807 538 HZ PHE 66 HZ PHE 66 -4.542 -6.142 -3.852 539 H LYS 67 H LYS 67 -8.887 -11.596 -0.053 540 HA LYS 67 HA LYS 67 -11.782 -11.658 0.503 541 HB2 LYS 67 HB2 LYS 67 -9.650 -13.719 0.213 542 HB3 LYS 67 HB3 LYS 67 -10.669 -13.930 1.643 543 HG2 LYS 67 HG2 LYS 67 -11.648 -15.226 -0.116 544 HG3 LYS 67 HG3 LYS 67 -12.702 -13.830 0.141 545 HD2 LYS 67 HD2 LYS 67 -11.896 -12.717 -1.837 546 HD3 LYS 67 HD3 LYS 67 -10.511 -13.807 -1.984 547 HE2 LYS 67 HE2 LYS 67 -11.920 -15.678 -2.595 548 HE3 LYS 67 HE3 LYS 67 -13.391 -14.817 -2.125 549 HZ1 LYS 67 HZ1 LYS 67 -13.067 -14.818 -4.497 550 HZ2 LYS 67 HZ2 LYS 67 -13.002 -13.286 -3.935 551 HZ3 LYS 67 HZ3 LYS 67 -11.628 -14.058 -4.361 552 H LYS 68 H LYS 68 -12.486 -11.716 2.702 553 HA LYS 68 HA LYS 68 -10.956 -10.161 4.462 554 HB2 LYS 68 HB2 LYS 68 -13.477 -10.360 4.413 555 HB3 LYS 68 HB3 LYS 68 -13.340 -12.018 5.014 556 HG2 LYS 68 HG2 LYS 68 -13.765 -10.881 6.990 557 HG3 LYS 68 HG3 LYS 68 -11.997 -10.899 7.008 558 HD2 LYS 68 HD2 LYS 68 -12.499 -8.645 7.485 559 HD3 LYS 68 HD3 LYS 68 -12.149 -8.608 5.751 560 HE2 LYS 68 HE2 LYS 68 -14.155 -7.342 6.013 561 HE3 LYS 68 HE3 LYS 68 -14.668 -8.896 5.343 562 HZ1 LYS 68 HZ1 LYS 68 -16.039 -8.963 7.062 563 HZ2 LYS 68 HZ2 LYS 68 -14.761 -9.260 8.033 564 HZ3 LYS 68 HZ3 LYS 68 -15.309 -7.733 7.850 565 H THR 69 H THR 69 -9.139 -10.780 5.658 566 HA THR 69 HA THR 69 -9.384 -13.371 7.038 567 HB THR 69 HB THR 69 -6.835 -12.447 5.649 568 HG1 THR 69 HG1 THR 69 -8.089 -14.545 4.329 569 HG21 THR 69 HG21 THR 69 -6.215 -14.841 5.726 570 HG22 THR 69 HG22 THR 69 -6.565 -14.170 7.355 571 HG23 THR 69 HG23 THR 69 -7.777 -15.209 6.532 572 H SER 70 H SER 70 -9.765 -12.073 8.935 573 HA SER 70 HA SER 70 -7.884 -10.008 9.632 574 HB2 SER 70 HB2 SER 70 -9.971 -11.266 11.452 575 HB3 SER 70 HB3 SER 70 -9.290 -9.635 11.512 576 HG SER 70 HG SER 70 -11.435 -9.666 10.573 577 H ASP 71 H ASP 71 -5.940 -11.467 9.409 578 HA ASP 71 HA ASP 71 -5.491 -13.584 11.180 579 HB2 ASP 71 HB2 ASP 71 -4.159 -12.670 9.088 580 HB3 ASP 71 HB3 ASP 71 -3.348 -11.629 10.266 581 H ASP 72 H ASP 72 -4.157 -10.043 11.507 582 HA ASP 72 HA ASP 72 -4.027 -10.481 14.492 583 HB2 ASP 72 HB2 ASP 72 -2.025 -9.855 13.135 584 HB3 ASP 72 HB3 ASP 72 -2.858 -8.373 12.647 585 H GLY 73 H GLY 73 -5.568 -9.020 12.072 586 HA2 GLY 73 HA2 GLY 73 -7.873 -9.191 12.580 587 HA3 GLY 73 HA3 GLY 73 -7.584 -8.015 13.869 588 H GLU 74 H GLU 74 -6.110 -5.464 11.591 589 HA GLU 74 HA GLU 74 -8.717 -6.041 10.322 590 HB2 GLU 74 HB2 GLU 74 -7.276 -3.563 10.009 591 HB3 GLU 74 HB3 GLU 74 -8.390 -4.150 8.768 592 HG2 GLU 74 HG2 GLU 74 -9.636 -2.777 10.273 593 HG3 GLU 74 HG3 GLU 74 -10.137 -4.452 10.540 594 H VAL 75 H VAL 75 -7.055 -8.199 9.519 595 HA VAL 75 HA VAL 75 -5.132 -7.351 7.462 596 HB VAL 75 HB VAL 75 -5.603 -9.941 9.036 597 HG11 VAL 75 HG11 VAL 75 -3.534 -10.834 8.014 598 HG12 VAL 75 HG12 VAL 75 -4.835 -10.547 6.809 599 HG13 VAL 75 HG13 VAL 75 -3.463 -9.396 6.940 600 HG21 VAL 75 HG21 VAL 75 -3.363 -9.493 10.020 601 HG22 VAL 75 HG22 VAL 75 -3.286 -7.952 9.100 602 HG23 VAL 75 HG23 VAL 75 -4.541 -8.182 10.364 603 H TYR 76 H TYR 76 -4.937 -8.652 5.466 604 HA TYR 76 HA TYR 76 -7.433 -9.986 4.691 605 HB2 TYR 76 HB2 TYR 76 -6.060 -7.817 3.022 606 HB3 TYR 76 HB3 TYR 76 -7.554 -8.679 2.631 607 HD1 TYR 76 HD1 TYR 76 -9.638 -8.239 3.987 608 HD2 TYR 76 HD2 TYR 76 -6.072 -5.899 4.479 609 HE1 TYR 76 HE1 TYR 76 -10.951 -6.484 5.139 610 HE2 TYR 76 HE2 TYR 76 -7.381 -4.141 5.631 611 HH TYR 76 HH TYR 76 -9.365 -3.494 6.362 612 H TYR 77 H TYR 77 -7.139 -11.517 2.928 613 HA TYR 77 HA TYR 77 -4.303 -11.916 2.238 614 HB2 TYR 77 HB2 TYR 77 -6.389 -13.859 3.301 615 HB3 TYR 77 HB3 TYR 77 -5.121 -14.441 2.214 616 HD1 TYR 77 HD1 TYR 77 -5.313 -12.200 5.270 617 HD2 TYR 77 HD2 TYR 77 -3.295 -15.417 3.259 618 HE1 TYR 77 HE1 TYR 77 -3.752 -12.413 7.180 619 HE2 TYR 77 HE2 TYR 77 -1.731 -15.628 5.165 620 HH TYR 77 HH TYR 77 -2.285 -14.119 8.197 621 H SER 78 H SER 78 -3.968 -11.924 0.024 622 HA SER 78 HA SER 78 -6.378 -12.318 -1.641 623 HB2 SER 78 HB2 SER 78 -3.646 -11.606 -2.711 624 HB3 SER 78 HB3 SER 78 -5.237 -11.015 -3.208 625 HG SER 78 HG SER 78 -4.804 -9.282 -2.051 626 H GLU 79 H GLU 79 -6.496 -14.684 -1.445 627 HA GLU 79 HA GLU 79 -4.174 -16.330 -1.761 628 HB2 GLU 79 HB2 GLU 79 -6.597 -16.670 -0.697 629 HB3 GLU 79 HB3 GLU 79 -7.071 -17.069 -2.353 630 HG2 GLU 79 HG2 GLU 79 -4.818 -18.495 -0.890 631 HG3 GLU 79 HG3 GLU 79 -6.506 -19.014 -0.802 632 H GLU 80 H GLU 80 -6.823 -15.239 -4.000 633 HA GLU 80 HA GLU 80 -6.013 -16.846 -6.141 634 HB2 GLU 80 HB2 GLU 80 -7.378 -14.103 -6.155 635 HB3 GLU 80 HB3 GLU 80 -7.350 -15.253 -7.499 636 HG2 GLU 80 HG2 GLU 80 -8.709 -16.840 -6.298 637 HG3 GLU 80 HG3 GLU 80 -8.518 -15.961 -4.776 638 H ALA 81 H ALA 81 -4.650 -13.803 -4.864 639 HA ALA 81 HA ALA 81 -3.003 -13.609 -7.287 640 HB1 ALA 81 HB1 ALA 81 -2.470 -11.325 -6.437 641 HB2 ALA 81 HB2 ALA 81 -4.234 -11.567 -6.673 642 HB3 ALA 81 HB3 ALA 81 -3.533 -11.621 -5.020 643 H LYS 82 H LYS 82 -2.862 -14.872 -4.067 644 HA LYS 82 HA LYS 82 -1.176 -15.742 -2.885 645 HB2 LYS 82 HB2 LYS 82 0.511 -15.117 -5.341 646 HB3 LYS 82 HB3 LYS 82 1.047 -16.064 -3.946 647 HG2 LYS 82 HG2 LYS 82 -1.286 -16.782 -5.791 648 HG3 LYS 82 HG3 LYS 82 0.330 -17.499 -5.846 649 HD2 LYS 82 HD2 LYS 82 0.056 -18.380 -3.546 650 HD3 LYS 82 HD3 LYS 82 -1.518 -17.586 -3.402 651 HE2 LYS 82 HE2 LYS 82 -0.906 -19.615 -5.603 652 HE3 LYS 82 HE3 LYS 82 -1.511 -20.100 -4.013 653 HZ1 LYS 82 HZ1 LYS 82 -3.534 -19.482 -4.599 654 HZ2 LYS 82 HZ2 LYS 82 -3.065 -18.005 -5.114 655 HZ3 LYS 82 HZ3 LYS 82 -3.007 -19.281 -6.131 656 H LYS 83 H LYS 83 -1.971 -13.147 -2.295 657 HA LYS 83 HA LYS 83 0.561 -11.933 -1.454 658 HB2 LYS 83 HB2 LYS 83 -1.795 -10.318 -2.539 659 HB3 LYS 83 HB3 LYS 83 -0.169 -9.741 -2.149 660 HG2 LYS 83 HG2 LYS 83 0.785 -10.883 -4.072 661 HG3 LYS 83 HG3 LYS 83 -0.727 -11.744 -4.388 662 HD2 LYS 83 HD2 LYS 83 -1.859 -9.497 -4.759 663 HD3 LYS 83 HD3 LYS 83 -0.279 -8.720 -4.587 664 HE2 LYS 83 HE2 LYS 83 0.587 -10.130 -6.494 665 HE3 LYS 83 HE3 LYS 83 -1.029 -10.820 -6.690 666 HZ1 LYS 83 HZ1 LYS 83 -0.621 -8.961 -8.181 667 HZ2 LYS 83 HZ2 LYS 83 -1.861 -8.621 -7.174 668 HZ3 LYS 83 HZ3 LYS 83 -0.397 -7.942 -6.925 669 H LYS 84 H LYS 84 0.495 -11.198 0.659 670 HA LYS 84 HA LYS 84 -2.161 -11.157 1.926 671 HB2 LYS 84 HB2 LYS 84 -1.225 -12.009 3.943 672 HB3 LYS 84 HB3 LYS 84 -0.770 -13.099 2.626 673 HG2 LYS 84 HG2 LYS 84 1.412 -12.867 3.108 674 HG3 LYS 84 HG3 LYS 84 1.316 -11.108 2.955 675 HD2 LYS 84 HD2 LYS 84 2.068 -11.705 5.218 676 HD3 LYS 84 HD3 LYS 84 0.477 -10.938 5.300 677 HE2 LYS 84 HE2 LYS 84 -0.557 -13.274 5.322 678 HE3 LYS 84 HE3 LYS 84 1.078 -13.934 5.452 679 HZ1 LYS 84 HZ1 LYS 84 -0.377 -13.347 7.539 680 HZ2 LYS 84 HZ2 LYS 84 1.251 -13.237 7.570 681 HZ3 LYS 84 HZ3 LYS 84 0.346 -11.893 7.372 682 H VAL 85 H VAL 85 -2.532 -9.495 3.549 683 HA VAL 85 HA VAL 85 -0.452 -7.414 3.542 684 HB VAL 85 HB VAL 85 -2.312 -5.730 3.561 685 HG11 VAL 85 HG11 VAL 85 -2.881 -5.832 1.151 686 HG12 VAL 85 HG12 VAL 85 -1.144 -6.162 1.467 687 HG13 VAL 85 HG13 VAL 85 -2.262 -7.517 1.091 688 HG21 VAL 85 HG21 VAL 85 -4.583 -6.376 2.800 689 HG22 VAL 85 HG22 VAL 85 -4.100 -8.104 2.874 690 HG23 VAL 85 HG23 VAL 85 -4.144 -7.120 4.375 691 H GLU 86 H GLU 86 -0.447 -6.116 5.536 692 HA GLU 86 HA GLU 86 -2.338 -6.891 7.587 693 HB2 GLU 86 HB2 GLU 86 0.140 -7.013 8.916 694 HB3 GLU 86 HB3 GLU 86 -0.916 -8.381 8.541 695 HG2 GLU 86 HG2 GLU 86 0.456 -8.068 6.151 696 HG3 GLU 86 HG3 GLU 86 1.681 -7.576 7.328 697 H VAL 87 H VAL 87 -3.076 -4.984 8.360 698 HA VAL 87 HA VAL 87 -1.515 -2.592 8.096 699 HB VAL 87 HB VAL 87 -3.903 -2.467 7.909 700 HG11 VAL 87 HG11 VAL 87 -5.430 -2.960 9.792 701 HG12 VAL 87 HG12 VAL 87 -4.549 -4.418 9.221 702 HG13 VAL 87 HG13 VAL 87 -4.041 -3.597 10.736 703 HG21 VAL 87 HG21 VAL 87 -4.437 -0.742 9.605 704 HG22 VAL 87 HG22 VAL 87 -2.978 -1.222 10.536 705 HG23 VAL 87 HG23 VAL 87 -2.803 -0.521 8.892 706 H LEU 88 H LEU 88 0.253 -2.222 9.461 707 HA LEU 88 HA LEU 88 0.478 -3.663 11.932 708 HB2 LEU 88 HB2 LEU 88 2.077 -1.346 10.740 709 HB3 LEU 88 HB3 LEU 88 2.551 -2.300 12.152 710 HG LEU 88 HG LEU 88 2.276 -3.346 9.300 711 HD11 LEU 88 HD11 LEU 88 4.742 -3.554 9.400 712 HD12 LEU 88 HD12 LEU 88 4.205 -1.850 9.585 713 HD13 LEU 88 HD13 LEU 88 4.736 -2.785 11.024 714 HD21 LEU 88 HD21 LEU 88 3.318 -5.402 10.193 715 HD22 LEU 88 HD22 LEU 88 3.249 -4.711 11.850 716 HD23 LEU 88 HD23 LEU 88 1.730 -5.066 10.961 717 H ASP 89 H ASP 89 -0.004 -0.162 10.954 718 HA ASP 89 HA ASP 89 -1.619 0.234 13.286 719 HB2 ASP 89 HB2 ASP 89 0.641 0.471 14.276 720 HB3 ASP 89 HB3 ASP 89 1.021 1.741 13.106 721 H THR 90 H THR 90 -2.867 2.210 13.128 722 HA THR 90 HA THR 90 -2.327 3.932 10.868 723 HB THR 90 HB THR 90 -3.667 1.999 9.955 724 HG1 THR 90 HG1 THR 90 -4.750 3.378 8.654 725 HG21 THR 90 HG21 THR 90 -6.074 1.880 10.521 726 HG22 THR 90 HG22 THR 90 -5.029 1.505 11.933 727 HG23 THR 90 HG23 THR 90 -5.825 3.109 11.806 728 H ASP 91 H ASP 91 -3.111 6.055 11.225 729 HA ASP 91 HA ASP 91 -4.321 6.458 13.859 730 HB2 ASP 91 HB2 ASP 91 -2.279 7.740 13.090 731 HB3 ASP 91 HB3 ASP 91 -3.286 8.504 11.853 732 H TYR 92 H TYR 92 -6.458 7.172 14.109 733 HA TYR 92 HA TYR 92 -8.232 6.825 11.990 734 HB2 TYR 92 HB2 TYR 92 -8.467 8.322 14.647 735 HB3 TYR 92 HB3 TYR 92 -9.833 8.073 13.551 736 HD1 TYR 92 HD1 TYR 92 -10.771 5.802 13.198 737 HD2 TYR 92 HD2 TYR 92 -7.518 6.435 15.935 738 HE1 TYR 92 HE1 TYR 92 -11.156 3.559 14.171 739 HE2 TYR 92 HE2 TYR 92 -7.890 4.181 16.895 740 HH TYR 92 HH TYR 92 -10.512 2.048 15.653 741 H LYS 93 H LYS 93 -6.438 9.751 13.030 742 HA LYS 93 HA LYS 93 -7.565 11.071 10.692 743 HB2 LYS 93 HB2 LYS 93 -7.173 12.358 13.407 744 HB3 LYS 93 HB3 LYS 93 -7.486 13.243 11.908 745 HG2 LYS 93 HG2 LYS 93 -9.633 12.092 11.615 746 HG3 LYS 93 HG3 LYS 93 -9.308 11.050 13.006 747 HD2 LYS 93 HD2 LYS 93 -9.200 13.064 14.480 748 HD3 LYS 93 HD3 LYS 93 -9.544 14.097 13.086 749 HE2 LYS 93 HE2 LYS 93 -11.399 11.844 13.983 750 HE3 LYS 93 HE3 LYS 93 -11.532 13.499 14.593 751 HZ1 LYS 93 HZ1 LYS 93 -12.982 13.124 12.730 752 HZ2 LYS 93 HZ2 LYS 93 -11.859 14.236 12.322 753 HZ3 LYS 93 HZ3 LYS 93 -11.737 12.708 11.759 754 H SER 94 H SER 94 -4.881 9.557 11.041 755 HA SER 94 HA SER 94 -3.317 11.816 9.987 756 HB2 SER 94 HB2 SER 94 -2.992 11.722 12.538 757 HB3 SER 94 HB3 SER 94 -2.508 10.027 12.391 758 HG SER 94 HG SER 94 -1.087 11.893 10.786 759 H TYR 95 H TYR 95 -0.821 10.049 10.504 760 HA TYR 95 HA TYR 95 -0.904 8.771 7.972 761 HB2 TYR 95 HB2 TYR 95 1.424 8.197 8.499 762 HB3 TYR 95 HB3 TYR 95 1.122 9.862 9.013 763 HD1 TYR 95 HD1 TYR 95 0.734 10.355 11.461 764 HD2 TYR 95 HD2 TYR 95 2.005 6.486 10.096 765 HE1 TYR 95 HE1 TYR 95 1.438 9.780 13.762 766 HE2 TYR 95 HE2 TYR 95 2.696 5.900 12.403 767 HH TYR 95 HH TYR 95 2.303 8.258 15.103 768 H ALA 96 H ALA 96 -0.247 6.477 7.563 769 HA ALA 96 HA ALA 96 -0.873 4.648 9.732 770 HB1 ALA 96 HB1 ALA 96 -2.425 3.361 8.314 771 HB2 ALA 96 HB2 ALA 96 -3.043 5.005 8.689 772 HB3 ALA 96 HB3 ALA 96 -2.348 4.654 7.070 773 H VAL 97 H VAL 97 0.148 2.549 9.484 774 HA VAL 97 HA VAL 97 1.839 2.384 7.082 775 HB VAL 97 HB VAL 97 3.529 1.183 8.510 776 HG11 VAL 97 HG11 VAL 97 4.456 3.249 9.509 777 HG12 VAL 97 HG12 VAL 97 3.820 3.533 7.854 778 HG13 VAL 97 HG13 VAL 97 2.871 4.063 9.283 779 HG21 VAL 97 HG21 VAL 97 3.447 1.520 10.956 780 HG22 VAL 97 HG22 VAL 97 1.821 2.267 10.794 781 HG23 VAL 97 HG23 VAL 97 2.062 0.540 10.366 782 H ILE 98 H ILE 98 1.484 0.512 5.885 783 HA ILE 98 HA ILE 98 0.202 -1.704 7.330 784 HB ILE 98 HB ILE 98 -0.076 -1.124 4.349 785 HG12 ILE 98 HG12 ILE 98 -0.952 0.834 5.494 786 HG13 ILE 98 HG13 ILE 98 -2.279 -0.118 4.816 787 HG21 ILE 98 HG21 ILE 98 -2.088 -2.559 4.562 788 HG22 ILE 98 HG22 ILE 98 -0.590 -3.415 5.062 789 HG23 ILE 98 HG23 ILE 98 -1.726 -2.791 6.306 790 HD11 ILE 98 HD11 ILE 98 -2.843 0.717 7.054 791 HD12 ILE 98 HD12 ILE 98 -2.752 -1.077 7.052 792 HD13 ILE 98 HD13 ILE 98 -1.404 -0.110 7.741 793 H TYR 99 H TYR 99 1.004 -3.821 6.916 794 HA TYR 99 HA TYR 99 3.597 -3.911 5.525 795 HB2 TYR 99 HB2 TYR 99 3.447 -4.614 7.922 796 HB3 TYR 99 HB3 TYR 99 2.277 -5.860 7.465 797 HD1 TYR 99 HD1 TYR 99 5.721 -4.681 6.449 798 HD2 TYR 99 HD2 TYR 99 3.092 -8.015 7.092 799 HE1 TYR 99 HE1 TYR 99 7.583 -6.239 5.969 800 HE2 TYR 99 HE2 TYR 99 4.952 -9.577 6.610 801 HH TYR 99 HH TYR 99 7.045 -9.694 5.573 802 H ALA 100 H ALA 100 3.922 -5.349 3.768 803 HA ALA 100 HA ALA 100 1.601 -6.971 2.984 804 HB1 ALA 100 HB1 ALA 100 1.942 -6.258 0.634 805 HB2 ALA 100 HB2 ALA 100 1.470 -4.890 1.698 806 HB3 ALA 100 HB3 ALA 100 3.180 -5.078 1.182 807 H THR 101 H THR 101 2.041 -8.939 2.042 808 HA THR 101 HA THR 101 4.778 -9.529 1.331 809 HB THR 101 HB THR 101 3.270 -11.026 3.539 810 HG1 THR 101 HG1 THR 101 5.735 -10.503 4.276 811 HG21 THR 101 HG21 THR 101 5.195 -12.578 3.533 812 HG22 THR 101 HG22 THR 101 4.323 -12.616 1.964 813 HG23 THR 101 HG23 THR 101 5.879 -11.730 2.105 814 H ARG 102 H ARG 102 4.976 -11.313 -0.174 815 HA ARG 102 HA ARG 102 2.537 -12.801 -0.771 816 HB2 ARG 102 HB2 ARG 102 4.009 -11.375 -2.994 817 HB3 ARG 102 HB3 ARG 102 2.531 -12.340 -3.095 818 HG2 ARG 102 HG2 ARG 102 1.337 -10.454 -2.853 819 HG3 ARG 102 HG3 ARG 102 1.947 -10.315 -1.199 820 HD2 ARG 102 HD2 ARG 102 2.399 -8.264 -2.541 821 HD3 ARG 102 HD3 ARG 102 3.887 -9.020 -1.957 822 HE ARG 102 HE ARG 102 3.025 -8.765 -4.740 823 HH11 ARG 102 HH11 ARG 102 5.241 -10.302 -2.478 824 HH12 ARG 102 HH12 ARG 102 6.267 -10.944 -3.718 825 HH21 ARG 102 HH21 ARG 102 4.355 -9.703 -6.368 826 HH22 ARG 102 HH22 ARG 102 5.765 -10.604 -5.920 827 H VAL 103 H VAL 103 3.044 -14.887 -1.721 828 HA VAL 103 HA VAL 103 5.925 -15.408 -1.904 829 HB VAL 103 HB VAL 103 5.038 -16.345 0.198 830 HG11 VAL 103 HG11 VAL 103 3.376 -18.164 0.129 831 HG12 VAL 103 HG12 VAL 103 2.700 -16.623 -0.498 832 HG13 VAL 103 HG13 VAL 103 3.183 -17.921 -1.640 833 HG21 VAL 103 HG21 VAL 103 5.799 -18.663 -0.140 834 HG22 VAL 103 HG22 VAL 103 5.687 -18.442 -1.918 835 HG23 VAL 103 HG23 VAL 103 6.871 -17.483 -0.968 836 H LYS 104 H LYS 104 6.675 -16.658 -3.470 837 HA LYS 104 HA LYS 104 4.883 -17.702 -5.522 838 HB2 LYS 104 HB2 LYS 104 5.910 -15.430 -6.085 839 HB3 LYS 104 HB3 LYS 104 7.406 -16.339 -6.336 840 HG2 LYS 104 HG2 LYS 104 6.025 -17.935 -7.833 841 HG3 LYS 104 HG3 LYS 104 4.725 -16.738 -7.746 842 HD2 LYS 104 HD2 LYS 104 6.227 -14.992 -8.637 843 HD3 LYS 104 HD3 LYS 104 7.583 -16.126 -8.642 844 HE2 LYS 104 HE2 LYS 104 5.008 -16.537 -10.235 845 HE3 LYS 104 HE3 LYS 104 6.464 -15.774 -10.889 846 HZ1 LYS 104 HZ1 LYS 104 6.534 -18.029 -11.458 847 HZ2 LYS 104 HZ2 LYS 104 7.634 -17.868 -10.262 848 HZ3 LYS 104 HZ3 LYS 104 6.182 -18.546 -9.951 849 H ASP 105 H ASP 105 6.021 -19.299 -7.005 850 HA ASP 105 HA ASP 105 6.660 -21.529 -5.880 851 HB2 ASP 105 HB2 ASP 105 8.473 -20.368 -8.094 852 HB3 ASP 105 HB3 ASP 105 8.061 -22.072 -7.860 853 H GLY 106 H GLY 106 7.842 -21.541 -3.810 854 HA2 GLY 106 HA2 GLY 106 9.816 -21.970 -2.782 855 HA3 GLY 106 HA3 GLY 106 10.655 -21.720 -4.318 856 H ARG 107 H ARG 107 8.805 -18.861 -3.761 857 HA ARG 107 HA ARG 107 11.010 -17.672 -2.211 858 HB2 ARG 107 HB2 ARG 107 11.558 -17.550 -4.670 859 HB3 ARG 107 HB3 ARG 107 9.973 -16.834 -4.992 860 HG2 ARG 107 HG2 ARG 107 10.573 -14.754 -4.136 861 HG3 ARG 107 HG3 ARG 107 11.814 -15.421 -3.067 862 HD2 ARG 107 HD2 ARG 107 12.067 -15.530 -6.110 863 HD3 ARG 107 HD3 ARG 107 12.610 -14.131 -5.174 864 HE ARG 107 HE ARG 107 13.975 -15.980 -3.875 865 HH11 ARG 107 HH11 ARG 107 13.306 -15.958 -7.331 866 HH12 ARG 107 HH12 ARG 107 14.776 -16.779 -7.740 867 HH21 ARG 107 HH21 ARG 107 15.896 -17.049 -4.429 868 HH22 ARG 107 HH22 ARG 107 16.249 -17.400 -6.088 869 H THR 108 H THR 108 10.451 -16.183 -0.810 870 HA THR 108 HA THR 108 7.705 -15.207 -0.955 871 HB THR 108 HB THR 108 9.363 -15.123 1.585 872 HG1 THR 108 HG1 THR 108 8.489 -17.281 2.019 873 HG21 THR 108 HG21 THR 108 7.097 -15.364 2.576 874 HG22 THR 108 HG22 THR 108 7.160 -13.967 1.448 875 HG23 THR 108 HG23 THR 108 6.389 -15.505 0.931 876 H LEU 109 H LEU 109 7.303 -12.979 -1.248 877 HA LEU 109 HA LEU 109 9.686 -11.279 -0.827 878 HB2 LEU 109 HB2 LEU 109 9.073 -11.435 -3.176 879 HB3 LEU 109 HB3 LEU 109 7.400 -10.999 -2.806 880 HG LEU 109 HG LEU 109 8.044 -8.750 -2.172 881 HD11 LEU 109 HD11 LEU 109 10.382 -7.968 -2.326 882 HD12 LEU 109 HD12 LEU 109 10.183 -9.249 -1.083 883 HD13 LEU 109 HD13 LEU 109 10.917 -9.647 -2.673 884 HD21 LEU 109 HD21 LEU 109 8.949 -7.947 -4.334 885 HD22 LEU 109 HD22 LEU 109 9.421 -9.628 -4.755 886 HD23 LEU 109 HD23 LEU 109 7.686 -9.203 -4.563 887 H HIS 110 H HIS 110 9.516 -9.512 0.537 888 HA HIS 110 HA HIS 110 6.848 -8.988 1.687 889 HB2 HIS 110 HB2 HIS 110 9.584 -8.760 3.035 890 HB3 HIS 110 HB3 HIS 110 8.024 -8.378 3.775 891 HD2 HIS 110 HD2 HIS 110 10.321 -11.410 3.107 892 HE1 HIS 110 HE1 HIS 110 6.767 -12.838 5.004 893 H MET 111 H MET 111 6.339 -6.779 1.979 894 HA MET 111 HA MET 111 8.348 -4.807 1.661 895 HB2 MET 111 HB2 MET 111 7.361 -3.594 -0.199 896 HB3 MET 111 HB3 MET 111 8.187 -5.100 -0.620 897 HG2 MET 111 HG2 MET 111 6.164 -6.233 -1.056 898 HG3 MET 111 HG3 MET 111 5.194 -5.026 -0.201 899 HE1 MET 111 HE1 MET 111 7.809 -3.419 -3.426 900 HE2 MET 111 HE2 MET 111 8.152 -4.835 -2.375 901 HE3 MET 111 HE3 MET 111 7.410 -5.076 -3.993 902 H MET 112 H MET 112 7.794 -3.014 3.045 903 HA MET 112 HA MET 112 4.988 -3.131 4.004 904 HB2 MET 112 HB2 MET 112 6.867 -3.144 5.648 905 HB3 MET 112 HB3 MET 112 7.509 -1.655 4.941 906 HG2 MET 112 HG2 MET 112 5.541 -0.393 5.683 907 HG3 MET 112 HG3 MET 112 4.768 -1.872 6.269 908 HE1 MET 112 HE1 MET 112 5.330 -0.323 9.638 909 HE2 MET 112 HE2 MET 112 5.628 0.958 8.415 910 HE3 MET 112 HE3 MET 112 4.345 -0.268 8.138 911 H ARG 113 H ARG 113 3.782 -1.058 4.107 912 HA ARG 113 HA ARG 113 4.799 1.033 2.332 913 HB2 ARG 113 HB2 ARG 113 2.698 -0.907 1.722 914 HB3 ARG 113 HB3 ARG 113 1.997 0.713 1.831 915 HG2 ARG 113 HG2 ARG 113 2.646 1.021 -0.300 916 HG3 ARG 113 HG3 ARG 113 4.305 1.133 0.304 917 HD2 ARG 113 HD2 ARG 113 4.397 -0.522 -1.401 918 HD3 ARG 113 HD3 ARG 113 4.419 -1.436 0.113 919 HE ARG 113 HE ARG 113 1.820 -1.026 -1.298 920 HH11 ARG 113 HH11 ARG 113 4.379 -3.160 -0.201 921 HH12 ARG 113 HH12 ARG 113 3.469 -4.606 -0.479 922 HH21 ARG 113 HH21 ARG 113 0.591 -2.928 -1.587 923 HH22 ARG 113 HH22 ARG 113 1.303 -4.475 -1.271 924 H LEU 114 H LEU 114 3.835 3.120 2.674 925 HA LEU 114 HA LEU 114 2.187 3.282 5.118 926 HB2 LEU 114 HB2 LEU 114 4.599 3.844 5.529 927 HB3 LEU 114 HB3 LEU 114 4.467 5.099 4.325 928 HG LEU 114 HG LEU 114 2.725 5.060 6.786 929 HD11 LEU 114 HD11 LEU 114 4.304 6.701 7.764 930 HD12 LEU 114 HD12 LEU 114 5.079 5.104 7.489 931 HD13 LEU 114 HD13 LEU 114 5.404 6.465 6.364 932 HD21 LEU 114 HD21 LEU 114 2.486 7.476 6.304 933 HD22 LEU 114 HD22 LEU 114 3.509 7.278 4.841 934 HD23 LEU 114 HD23 LEU 114 1.915 6.457 4.939 935 H TYR 115 H TYR 115 0.385 4.593 4.895 936 HA TYR 115 HA TYR 115 0.317 6.195 2.428 937 HB2 TYR 115 HB2 TYR 115 -2.009 5.736 2.190 938 HB3 TYR 115 HB3 TYR 115 -1.152 4.195 2.328 939 HD1 TYR 115 HD1 TYR 115 -1.422 2.779 4.375 940 HD2 TYR 115 HD2 TYR 115 -3.632 6.426 3.854 941 HE1 TYR 115 HE1 TYR 115 -2.996 2.082 6.159 942 HE2 TYR 115 HE2 TYR 115 -5.202 5.735 5.633 943 HH TYR 115 HH TYR 115 -5.128 2.491 7.018 944 H SER 116 H SER 116 -0.859 8.223 2.540 945 HA SER 116 HA SER 116 -1.014 9.230 5.330 946 HB2 SER 116 HB2 SER 116 -0.214 10.599 2.698 947 HB3 SER 116 HB3 SER 116 -0.515 11.465 4.210 948 HG SER 116 HG SER 116 1.592 11.157 4.478 949 H ARG 117 H ARG 117 -2.766 10.880 5.611 950 HA ARG 117 HA ARG 117 -5.147 9.972 4.468 951 HB2 ARG 117 HB2 ARG 117 -4.207 12.214 6.232 952 HB3 ARG 117 HB3 ARG 117 -5.738 12.501 5.394 953 HG2 ARG 117 HG2 ARG 117 -6.469 10.181 6.363 954 HG3 ARG 117 HG3 ARG 117 -5.078 10.350 7.442 955 HD2 ARG 117 HD2 ARG 117 -7.180 11.218 8.477 956 HD3 ARG 117 HD3 ARG 117 -5.942 12.473 8.331 957 HE ARG 117 HE ARG 117 -7.229 13.549 6.661 958 HH11 ARG 117 HH11 ARG 117 -8.765 10.561 7.710 959 HH12 ARG 117 HH12 ARG 117 -10.291 10.955 6.992 960 HH21 ARG 117 HH21 ARG 117 -9.233 14.047 5.728 961 HH22 ARG 117 HH22 ARG 117 -10.556 12.938 5.865 962 H SER 118 H SER 118 -2.774 12.332 3.289 963 HA SER 118 HA SER 118 -4.527 12.772 0.973 964 HB2 SER 118 HB2 SER 118 -2.979 15.058 2.233 965 HB3 SER 118 HB3 SER 118 -4.263 15.118 1.019 966 HG SER 118 HG SER 118 -5.023 15.725 3.141 967 HA PRO 119 HA PRO 119 -0.586 12.190 -1.068 968 HB2 PRO 119 HB2 PRO 119 -0.603 14.097 -3.098 969 HB3 PRO 119 HB3 PRO 119 -1.661 12.681 -3.166 970 HG2 PRO 119 HG2 PRO 119 -2.302 15.508 -2.300 971 HG3 PRO 119 HG3 PRO 119 -3.263 14.398 -3.286 972 HD2 PRO 119 HD2 PRO 119 -3.786 14.810 -0.625 973 HD3 PRO 119 HD3 PRO 119 -4.121 13.265 -1.419 974 H GLU 120 H GLU 120 0.239 13.097 1.135 975 HA GLU 120 HA GLU 120 2.417 14.778 0.446 976 HB2 GLU 120 HB2 GLU 120 1.833 16.517 2.236 977 HB3 GLU 120 HB3 GLU 120 1.042 16.663 0.661 978 HG2 GLU 120 HG2 GLU 120 -0.927 15.334 1.755 979 HG3 GLU 120 HG3 GLU 120 -0.148 15.720 3.296 980 H VAL 121 H VAL 121 4.126 14.011 1.669 981 HA VAL 121 HA VAL 121 3.479 12.105 3.745 982 HB VAL 121 HB VAL 121 6.120 13.302 2.744 983 HG11 VAL 121 HG11 VAL 121 7.230 11.319 3.716 984 HG12 VAL 121 HG12 VAL 121 6.416 12.350 4.941 985 HG13 VAL 121 HG13 VAL 121 5.656 10.810 4.415 986 HG21 VAL 121 HG21 VAL 121 6.483 11.258 1.437 987 HG22 VAL 121 HG22 VAL 121 4.823 10.717 1.858 988 HG23 VAL 121 HG23 VAL 121 5.063 12.215 0.897 989 H SER 122 H SER 122 3.772 12.428 5.893 990 HA SER 122 HA SER 122 4.529 15.097 6.809 991 HB2 SER 122 HB2 SER 122 3.293 14.288 8.920 992 HB3 SER 122 HB3 SER 122 2.299 14.580 7.487 993 HG SER 122 HG SER 122 1.800 12.541 8.511 994 HA PRO 123 HA PRO 123 8.240 13.711 8.754 995 HB2 PRO 123 HB2 PRO 123 8.027 15.259 11.130 996 HB3 PRO 123 HB3 PRO 123 8.686 15.892 9.616 997 HG2 PRO 123 HG2 PRO 123 5.913 16.199 10.771 998 HG3 PRO 123 HG3 PRO 123 6.898 17.379 9.896 999 HD2 PRO 123 HD2 PRO 123 4.854 16.101 8.660 1000 HD3 PRO 123 HD3 PRO 123 6.339 16.479 7.777 1001 H ALA 124 H ALA 124 5.265 13.969 10.856 1002 HA ALA 124 HA ALA 124 6.125 12.291 12.889 1003 HB1 ALA 124 HB1 ALA 124 3.699 11.950 13.301 1004 HB2 ALA 124 HB2 ALA 124 4.086 13.674 12.980 1005 HB3 ALA 124 HB3 ALA 124 3.332 12.669 11.697 1006 H ALA 125 H ALA 125 4.378 11.414 9.791 1007 HA ALA 125 HA ALA 125 4.256 8.650 10.410 1008 HB1 ALA 125 HB1 ALA 125 3.745 8.414 8.006 1009 HB2 ALA 125 HB2 ALA 125 2.797 9.742 8.758 1010 HB3 ALA 125 HB3 ALA 125 4.224 10.124 7.737 1011 H THR 126 H THR 126 6.655 10.767 8.734 1012 HA THR 126 HA THR 126 8.232 8.738 7.647 1013 HB THR 126 HB THR 126 9.045 11.513 8.662 1014 HG1 THR 126 HG1 THR 126 7.363 11.753 7.148 1015 HG21 THR 126 HG21 THR 126 10.828 11.349 6.948 1016 HG22 THR 126 HG22 THR 126 10.968 10.050 8.180 1017 HG23 THR 126 HG23 THR 126 10.293 9.680 6.558 1018 H ALA 127 H ALA 127 8.588 10.597 10.793 1019 HA ALA 127 HA ALA 127 10.871 9.191 11.629 1020 HB1 ALA 127 HB1 ALA 127 10.314 10.137 13.854 1021 HB2 ALA 127 HB2 ALA 127 10.199 11.367 12.551 1022 HB3 ALA 127 HB3 ALA 127 8.706 10.636 13.230 1023 H ILE 128 H ILE 128 7.333 8.523 12.057 1024 HA ILE 128 HA ILE 128 7.712 6.504 13.985 1025 HB ILE 128 HB ILE 128 5.438 7.047 12.027 1026 HG12 ILE 128 HG12 ILE 128 5.787 8.832 13.656 1027 HG13 ILE 128 HG13 ILE 128 4.306 7.944 14.037 1028 HG21 ILE 128 HG21 ILE 128 4.077 5.556 13.452 1029 HG22 ILE 128 HG22 ILE 128 5.430 4.679 12.660 1030 HG23 ILE 128 HG23 ILE 128 5.543 5.127 14.396 1031 HD11 ILE 128 HD11 ILE 128 5.572 8.467 16.075 1032 HD12 ILE 128 HD12 ILE 128 5.498 6.691 15.814 1033 HD13 ILE 128 HD13 ILE 128 7.002 7.593 15.427 1034 H PHE 129 H PHE 129 7.193 6.392 10.360 1035 HA PHE 129 HA PHE 129 7.277 3.621 10.108 1036 HB2 PHE 129 HB2 PHE 129 6.595 5.393 8.393 1037 HB3 PHE 129 HB3 PHE 129 8.315 5.702 8.124 1038 HD1 PHE 129 HD1 PHE 129 9.745 4.024 7.033 1039 HD2 PHE 129 HD2 PHE 129 5.538 3.363 7.587 1040 HE1 PHE 129 HE1 PHE 129 9.817 2.186 5.372 1041 HE2 PHE 129 HE2 PHE 129 5.604 1.529 5.924 1042 HZ PHE 129 HZ PHE 129 7.744 0.936 4.814 1043 H ARG 130 H ARG 130 9.972 6.060 10.261 1044 HA ARG 130 HA ARG 130 11.968 4.221 9.474 1045 HB2 ARG 130 HB2 ARG 130 12.154 6.733 9.409 1046 HB3 ARG 130 HB3 ARG 130 12.239 6.743 11.175 1047 HG2 ARG 130 HG2 ARG 130 14.232 4.997 10.752 1048 HG3 ARG 130 HG3 ARG 130 14.273 5.771 9.163 1049 HD2 ARG 130 HD2 ARG 130 14.342 7.332 11.791 1050 HD3 ARG 130 HD3 ARG 130 15.799 6.787 10.949 1051 HE ARG 130 HE ARG 130 14.425 8.166 8.998 1052 HH11 ARG 130 HH11 ARG 130 15.426 8.958 12.276 1053 HH12 ARG 130 HH12 ARG 130 15.614 10.646 11.940 1054 HH21 ARG 130 HH21 ARG 130 14.695 10.385 8.570 1055 HH22 ARG 130 HH22 ARG 130 15.199 11.457 9.834 1056 H LYS 131 H LYS 131 10.709 5.321 12.726 1057 HA LYS 131 HA LYS 131 12.584 4.086 14.316 1058 HB2 LYS 131 HB2 LYS 131 9.594 4.545 14.692 1059 HB3 LYS 131 HB3 LYS 131 10.626 3.888 15.969 1060 HG2 LYS 131 HG2 LYS 131 12.086 5.975 15.730 1061 HG3 LYS 131 HG3 LYS 131 10.852 6.632 14.646 1062 HD2 LYS 131 HD2 LYS 131 9.133 6.373 16.455 1063 HD3 LYS 131 HD3 LYS 131 10.376 5.733 17.538 1064 HE2 LYS 131 HE2 LYS 131 11.676 7.889 17.238 1065 HE3 LYS 131 HE3 LYS 131 10.335 8.521 16.273 1066 HZ1 LYS 131 HZ1 LYS 131 10.172 9.197 18.563 1067 HZ2 LYS 131 HZ2 LYS 131 8.906 8.234 18.195 1068 HZ3 LYS 131 HZ3 LYS 131 10.144 7.650 19.085 1069 H LEU 132 H LEU 132 9.556 2.640 12.856 1070 HA LEU 132 HA LEU 132 9.946 0.112 14.096 1071 HB2 LEU 132 HB2 LEU 132 8.429 0.913 11.576 1072 HB3 LEU 132 HB3 LEU 132 8.305 -0.650 12.395 1073 HG LEU 132 HG LEU 132 7.524 2.038 13.603 1074 HD11 LEU 132 HD11 LEU 132 5.204 1.215 13.348 1075 HD12 LEU 132 HD12 LEU 132 6.036 1.379 11.765 1076 HD13 LEU 132 HD13 LEU 132 5.821 -0.244 12.501 1077 HD21 LEU 132 HD21 LEU 132 6.488 0.670 15.382 1078 HD22 LEU 132 HD22 LEU 132 7.157 -0.815 14.624 1079 HD23 LEU 132 HD23 LEU 132 8.265 0.428 15.298 1080 H ALA 133 H ALA 133 10.776 1.518 10.832 1081 HA ALA 133 HA ALA 133 11.736 -0.788 9.642 1082 HB1 ALA 133 HB1 ALA 133 13.040 0.776 8.229 1083 HB2 ALA 133 HB2 ALA 133 11.355 1.348 8.475 1084 HB3 ALA 133 HB3 ALA 133 12.702 2.102 9.393 1085 H GLY 134 H GLY 134 13.418 1.496 11.941 1086 HA2 GLY 134 HA2 GLY 134 15.974 0.321 11.610 1087 HA3 GLY 134 HA3 GLY 134 15.425 1.354 12.936 1088 H GLU 135 H GLU 135 13.102 -0.471 13.633 1089 HA GLU 135 HA GLU 135 14.422 -2.066 15.544 1090 HB2 GLU 135 HB2 GLU 135 12.214 -1.324 16.019 1091 HB3 GLU 135 HB3 GLU 135 11.598 -1.828 14.440 1092 HG2 GLU 135 HG2 GLU 135 12.190 -4.260 15.261 1093 HG3 GLU 135 HG3 GLU 135 12.220 -3.528 16.871 1094 H ARG 136 H ARG 136 13.500 -2.626 12.144 1095 HA ARG 136 HA ARG 136 13.970 -5.501 12.505 1096 HB2 ARG 136 HB2 ARG 136 13.143 -4.283 9.878 1097 HB3 ARG 136 HB3 ARG 136 12.678 -5.827 10.604 1098 HG2 ARG 136 HG2 ARG 136 11.309 -4.473 12.313 1099 HG3 ARG 136 HG3 ARG 136 11.616 -3.052 11.306 1100 HD2 ARG 136 HD2 ARG 136 9.559 -3.804 10.481 1101 HD3 ARG 136 HD3 ARG 136 10.701 -4.510 9.331 1102 HE ARG 136 HE ARG 136 10.112 -6.628 10.082 1103 HH11 ARG 136 HH11 ARG 136 9.111 -4.279 12.506 1104 HH12 ARG 136 HH12 ARG 136 8.168 -5.424 13.401 1105 HH21 ARG 136 HH21 ARG 136 8.858 -8.113 11.265 1106 HH22 ARG 136 HH22 ARG 136 8.025 -7.603 12.695 1107 H ASN 137 H ASN 137 16.097 -3.149 12.382 1108 HA ASN 137 HA ASN 137 18.097 -2.818 11.500 1109 HB2 ASN 137 HB2 ASN 137 17.788 -5.769 10.749 1110 HB3 ASN 137 HB3 ASN 137 19.294 -4.861 10.565 1111 HD21 ASN 137 HD21 ASN 137 19.093 -3.306 13.018 1112 HD22 ASN 137 HD22 ASN 137 19.357 -4.409 14.327 1113 H TYR 138 H TYR 138 15.910 -1.959 9.798 1114 HA TYR 138 HA TYR 138 16.200 -3.052 7.188 1115 HB2 TYR 138 HB2 TYR 138 14.572 -1.412 6.642 1116 HB3 TYR 138 HB3 TYR 138 14.285 -1.602 8.377 1117 HD1 TYR 138 HD1 TYR 138 15.999 0.074 9.847 1118 HD2 TYR 138 HD2 TYR 138 14.530 0.807 5.872 1119 HE1 TYR 138 HE1 TYR 138 16.361 2.505 10.159 1120 HE2 TYR 138 HE2 TYR 138 14.888 3.238 6.190 1121 HH TYR 138 HH TYR 138 15.572 4.847 7.537 1122 H THR 139 H THR 139 16.952 -1.791 5.252 1123 HA THR 139 HA THR 139 19.349 -0.211 5.969 1124 HB THR 139 HB THR 139 19.936 -0.840 3.521 1125 HG1 THR 139 HG1 THR 139 18.882 -2.846 2.811 1126 HG21 THR 139 HG21 THR 139 20.814 -3.068 4.198 1127 HG22 THR 139 HG22 THR 139 21.049 -1.845 5.492 1128 HG23 THR 139 HG23 THR 139 19.729 -3.055 5.629 1129 H ASP 140 H ASP 140 19.739 1.776 4.581 1130 HA ASP 140 HA ASP 140 17.448 3.331 4.310 1131 HB2 ASP 140 HB2 ASP 140 19.462 4.545 4.327 1132 HB3 ASP 140 HB3 ASP 140 20.320 3.334 3.366 1133 H GLU 141 H GLU 141 19.229 1.636 1.619 1134 HA GLU 141 HA GLU 141 17.394 2.437 -0.322 1135 HB2 GLU 141 HB2 GLU 141 19.289 0.067 -0.376 1136 HB3 GLU 141 HB3 GLU 141 18.405 0.713 -1.765 1137 HG2 GLU 141 HG2 GLU 141 19.559 2.933 -1.399 1138 HG3 GLU 141 HG3 GLU 141 20.513 2.182 -0.113 1139 H MET 142 H MET 142 16.826 0.226 2.246 1140 HA MET 142 HA MET 142 15.193 -1.599 0.689 1141 HB2 MET 142 HB2 MET 142 16.407 -2.333 2.716 1142 HB3 MET 142 HB3 MET 142 15.632 -1.071 3.683 1143 HG2 MET 142 HG2 MET 142 13.398 -2.178 3.202 1144 HG3 MET 142 HG3 MET 142 14.278 -3.495 2.415 1145 HE1 MET 142 HE1 MET 142 16.013 -5.429 5.081 1146 HE2 MET 142 HE2 MET 142 16.107 -4.757 3.418 1147 HE3 MET 142 HE3 MET 142 16.944 -3.924 4.771 1148 H VAL 143 H VAL 143 14.836 1.494 2.325 1149 HA VAL 143 HA VAL 143 11.925 1.328 2.162 1150 HB VAL 143 HB VAL 143 13.600 3.217 3.862 1151 HG11 VAL 143 HG11 VAL 143 11.393 3.882 4.759 1152 HG12 VAL 143 HG12 VAL 143 11.515 4.232 3.002 1153 HG13 VAL 143 HG13 VAL 143 10.583 2.806 3.570 1154 HG21 VAL 143 HG21 VAL 143 12.624 1.930 5.726 1155 HG22 VAL 143 HG22 VAL 143 11.821 0.832 4.553 1156 HG23 VAL 143 HG23 VAL 143 13.613 0.881 4.654 1157 H ALA 144 H ALA 144 10.737 3.140 1.186 1158 HA ALA 144 HA ALA 144 12.407 5.011 -0.363 1159 HB1 ALA 144 HB1 ALA 144 10.889 4.697 -2.289 1160 HB2 ALA 144 HB2 ALA 144 11.775 3.192 -1.871 1161 HB3 ALA 144 HB3 ALA 144 10.051 3.379 -1.403 1162 H MET 145 H MET 145 11.834 7.084 -0.140 1163 HA MET 145 HA MET 145 9.168 7.678 0.883 1164 HB2 MET 145 HB2 MET 145 11.771 9.090 1.491 1165 HB3 MET 145 HB3 MET 145 10.179 9.783 1.831 1166 HG2 MET 145 HG2 MET 145 9.631 7.691 3.159 1167 HG3 MET 145 HG3 MET 145 11.305 7.167 2.927 1168 HE1 MET 145 HE1 MET 145 10.208 11.205 4.902 1169 HE2 MET 145 HE2 MET 145 9.655 10.598 3.305 1170 HE3 MET 145 HE3 MET 145 8.965 9.912 4.815 1171 H LEU 146 H LEU 146 7.851 9.287 -0.116 1172 HA LEU 146 HA LEU 146 9.151 10.470 -2.474 1173 HB2 LEU 146 HB2 LEU 146 6.244 9.670 -2.125 1174 HB3 LEU 146 HB3 LEU 146 6.881 10.598 -3.489 1175 HG LEU 146 HG LEU 146 6.672 8.328 -4.177 1176 HD11 LEU 146 HD11 LEU 146 8.998 7.721 -4.765 1177 HD12 LEU 146 HD12 LEU 146 8.672 9.471 -5.003 1178 HD13 LEU 146 HD13 LEU 146 9.604 8.918 -3.571 1179 HD21 LEU 146 HD21 LEU 146 7.811 6.450 -3.031 1180 HD22 LEU 146 HD22 LEU 146 8.344 7.575 -1.737 1181 HD23 LEU 146 HD23 LEU 146 6.595 7.249 -1.979 1182 HA PRO 147 HA PRO 147 8.205 14.263 -0.117 1183 HB2 PRO 147 HB2 PRO 147 9.690 15.952 -1.761 1184 HB3 PRO 147 HB3 PRO 147 10.498 14.934 -0.562 1185 HG2 PRO 147 HG2 PRO 147 10.129 14.459 -3.533 1186 HG3 PRO 147 HG3 PRO 147 11.573 14.223 -2.540 1187 HD2 PRO 147 HD2 PRO 147 9.969 12.129 -3.251 1188 HD3 PRO 147 HD3 PRO 147 10.827 12.150 -1.705 1189 H ARG 148 H ARG 148 7.760 16.705 -1.278 1190 HA ARG 148 HA ARG 148 5.228 16.378 -2.462 1191 HB2 ARG 148 HB2 ARG 148 4.960 18.656 -2.325 1192 HB3 ARG 148 HB3 ARG 148 6.067 18.293 -0.995 1193 HG2 ARG 148 HG2 ARG 148 6.901 19.372 -3.723 1194 HG3 ARG 148 HG3 ARG 148 6.678 20.347 -2.265 1195 HD2 ARG 148 HD2 ARG 148 8.633 18.004 -2.490 1196 HD3 ARG 148 HD3 ARG 148 9.077 19.698 -2.736 1197 HE ARG 148 HE ARG 148 7.760 19.285 -0.181 1198 HH11 ARG 148 HH11 ARG 148 10.829 19.012 -1.870 1199 HH12 ARG 148 HH12 ARG 148 11.776 19.144 -0.425 1200 HH21 ARG 148 HH21 ARG 148 9.016 19.454 1.707 1201 HH22 ARG 148 HH22 ARG 148 10.744 19.396 1.609 1202 H GLN 149 H GLN 149 6.371 14.856 -4.062 1203 HA GLN 149 HA GLN 149 6.876 16.201 -6.554 1204 HB2 GLN 149 HB2 GLN 149 8.756 14.864 -5.674 1205 HB3 GLN 149 HB3 GLN 149 7.826 13.423 -6.109 1206 HG2 GLN 149 HG2 GLN 149 7.543 14.770 -8.432 1207 HG3 GLN 149 HG3 GLN 149 9.043 15.531 -7.885 1208 HE21 GLN 149 HE21 GLN 149 9.868 13.119 -6.346 1209 HE22 GLN 149 HE22 GLN 149 10.409 11.970 -7.524 1210 H GLU 150 H GLU 150 4.124 15.786 -5.584 1211 HA GLU 150 HA GLU 150 3.224 13.586 -7.212 1212 HB2 GLU 150 HB2 GLU 150 0.922 14.410 -6.318 1213 HB3 GLU 150 HB3 GLU 150 2.070 13.725 -5.159 1214 HG2 GLU 150 HG2 GLU 150 1.277 15.614 -4.044 1215 HG3 GLU 150 HG3 GLU 150 2.810 16.180 -4.721 1216 H GLU 151 H GLU 151 1.405 13.643 -8.711 1217 HA GLU 151 HA GLU 151 0.809 16.094 -10.069 1218 HB2 GLU 151 HB2 GLU 151 2.858 14.164 -11.158 1219 HB3 GLU 151 HB3 GLU 151 1.702 14.876 -12.292 1220 HG2 GLU 151 HG2 GLU 151 2.401 17.162 -11.480 1221 HG3 GLU 151 HG3 GLU 151 3.637 16.386 -10.482 1222 H CYS 152 H CYS 152 0.963 12.433 -10.280 1223 HA CYS 152 HA CYS 152 -1.704 12.560 -11.594 1224 HB2 CYS 152 HB2 CYS 152 0.084 11.395 -12.839 1225 HB3 CYS 152 HB3 CYS 152 0.503 10.443 -11.409 1226 H THR 153 H THR 153 -3.384 11.682 -10.626 1227 HA THR 153 HA THR 153 -3.034 10.166 -8.162 1228 HB THR 153 HB THR 153 -5.106 11.694 -7.397 1229 HG1 THR 153 HG1 THR 153 -4.732 13.917 -8.113 1230 HG21 THR 153 HG21 THR 153 -3.525 13.166 -6.181 1231 HG22 THR 153 HG22 THR 153 -2.988 11.453 -6.160 1232 HG23 THR 153 HG23 THR 153 -2.197 12.629 -7.264 1233 H VAL 154 H VAL 154 -5.157 9.129 -7.463 1234 HA VAL 154 HA VAL 154 -6.581 8.322 -9.876 1235 HB VAL 154 HB VAL 154 -5.552 6.576 -8.427 1236 HG11 VAL 154 HG11 VAL 154 -6.539 6.068 -6.219 1237 HG12 VAL 154 HG12 VAL 154 -5.756 7.684 -6.256 1238 HG13 VAL 154 HG13 VAL 154 -7.545 7.551 -6.334 1239 HG21 VAL 154 HG21 VAL 154 -7.542 5.118 -8.254 1240 HG22 VAL 154 HG22 VAL 154 -8.601 6.550 -8.485 1241 HG23 VAL 154 HG23 VAL 154 -7.499 6.026 -9.803 1242 H ASP 155 H ASP 155 -8.861 8.444 -10.082 1243 HA ASP 155 HA ASP 155 -10.082 10.571 -8.639 1244 HB2 ASP 155 HB2 ASP 155 -10.666 10.340 -10.944 1245 HB3 ASP 155 HB3 ASP 155 -11.021 8.615 -10.776 1246 H GLU 156 H GLU 156 -12.156 10.452 -7.449 1247 HA GLU 156 HA GLU 156 -12.281 7.952 -5.912 1248 HB2 GLU 156 HB2 GLU 156 -13.389 9.399 -4.164 1249 HB3 GLU 156 HB3 GLU 156 -11.682 9.744 -4.468 1250 HG2 GLU 156 HG2 GLU 156 -12.579 11.587 -6.107 1251 HG3 GLU 156 HG3 GLU 156 -14.118 11.372 -5.262 1252 H VAL 157 H VAL 157 -14.290 10.332 -7.779 1253 HA VAL 157 HA VAL 157 -16.147 8.370 -8.407 1254 HB VAL 157 HB VAL 157 -16.867 8.393 -6.102 1255 HG11 VAL 157 HG11 VAL 157 -17.769 10.415 -5.006 1256 HG12 VAL 157 HG12 VAL 157 -16.025 10.574 -5.406 1257 HG13 VAL 157 HG13 VAL 157 -17.257 11.399 -6.419 1258 HG21 VAL 157 HG21 VAL 157 -19.245 9.020 -6.381 1259 HG22 VAL 157 HG22 VAL 157 -18.824 9.910 -7.883 1260 HG23 VAL 157 HG23 VAL 157 -18.604 8.129 -7.802 1261 HN1 EB4 158 HN1 EB4 158 4.436 -5.665 -7.694 1262 H8 EB4 158 H8 EB4 158 -2.070 -6.164 -4.885 1263 HN2 EB4 158 HN2 EB4 158 1.575 -4.884 -9.128 1264 H9 EB4 158 H9 EB4 158 1.163 -0.577 -3.421 1265 H10 EB4 158 H10 EB4 158 5.309 -7.462 -2.157 1266 HN3 EB4 158 HN3 EB4 158 3.965 -2.639 -8.115 1267 H7 EB4 158 H7 EB4 158 3.335 -5.975 -2.022 1268 H11 EB4 158 H11 EB4 158 -3.387 -6.969 -6.829 1269 H12 EB4 158 H12 EB4 158 2.497 1.410 -4.026 1270 H15 EB4 158 H15 EB4 158 3.989 1.361 -6.007 1271 H14 EB4 158 H14 EB4 158 -2.428 -6.830 -9.111 1272 H13 EB4 158 H13 EB4 158 6.297 -8.003 -4.363 1273 H22 EB4 158 H22 EB4 158 5.199 -6.477 -8.213 1274 H30 EB4 158 H30 EB4 158 6.441 -3.068 -10.762 1275 H30A EB4 158 H30A EB4 158 6.773 -2.550 -9.031 1276 H24 EB4 158 H24 EB4 158 4.443 -1.804 -8.873 1277 H28 EB4 158 H28 EB4 158 4.191 -8.216 -9.774 1278 H28A EB4 158 H28A EB4 158 4.875 -7.226 -11.154 1279 H23 EB4 158 H23 EB4 158 1.245 -5.128 -10.289 1280 H29 EB4 158 H29 EB4 158 0.931 -3.061 -11.363 1281 H29A EB4 158 H29A EB4 158 2.365 -3.452 -12.511 Start of MODEL 15 1 H1 MET 1 H1 MET 1 -29.091 4.303 -4.237 2 H2 MET 1 H2 MET 1 -28.608 5.860 -4.335 3 H3 MET 1 H3 MET 1 -29.226 5.112 -5.649 4 HA MET 1 HA MET 1 -27.113 3.575 -4.731 5 HB2 MET 1 HB2 MET 1 -27.699 5.197 -7.230 6 HB3 MET 1 HB3 MET 1 -26.145 4.379 -7.020 7 HG2 MET 1 HG2 MET 1 -27.321 2.204 -6.743 8 HG3 MET 1 HG3 MET 1 -28.879 3.018 -6.941 9 HE1 MET 1 HE1 MET 1 -28.273 0.919 -10.291 10 HE2 MET 1 HE2 MET 1 -27.647 0.498 -8.661 11 HE3 MET 1 HE3 MET 1 -29.322 1.120 -8.847 12 H THR 2 H THR 2 -24.749 4.154 -4.768 13 HA THR 2 HA THR 2 -23.078 5.326 -3.897 14 HB THR 2 HB THR 2 -24.248 7.786 -5.269 15 HG1 THR 2 HG1 THR 2 -23.263 6.905 -7.238 16 HG21 THR 2 HG21 THR 2 -21.863 8.212 -5.787 17 HG22 THR 2 HG22 THR 2 -22.133 8.041 -4.020 18 HG23 THR 2 HG23 THR 2 -21.411 6.687 -4.953 19 H VAL 3 H VAL 3 -25.290 5.095 -2.063 20 HA VAL 3 HA VAL 3 -25.868 7.664 -0.988 21 HB VAL 3 HB VAL 3 -26.885 6.383 0.893 22 HG11 VAL 3 HG11 VAL 3 -28.650 5.277 -0.445 23 HG12 VAL 3 HG12 VAL 3 -28.194 6.877 -1.122 24 HG13 VAL 3 HG13 VAL 3 -27.598 5.371 -1.897 25 HG21 VAL 3 HG21 VAL 3 -26.997 3.917 0.773 26 HG22 VAL 3 HG22 VAL 3 -25.866 3.938 -0.621 27 HG23 VAL 3 HG23 VAL 3 -25.315 4.506 0.991 28 HA PRO 4 HA PRO 4 -22.218 7.981 1.582 29 HB2 PRO 4 HB2 PRO 4 -23.076 10.061 3.192 30 HB3 PRO 4 HB3 PRO 4 -22.698 10.358 1.490 31 HG2 PRO 4 HG2 PRO 4 -25.393 9.948 2.807 32 HG3 PRO 4 HG3 PRO 4 -24.927 11.115 1.562 33 HD2 PRO 4 HD2 PRO 4 -26.261 8.772 0.983 34 HD3 PRO 4 HD3 PRO 4 -25.183 9.566 -0.173 35 H ASP 5 H ASP 5 -22.803 5.738 2.389 36 HA ASP 5 HA ASP 5 -23.519 5.999 5.243 37 HB2 ASP 5 HB2 ASP 5 -24.542 4.064 3.158 38 HB3 ASP 5 HB3 ASP 5 -24.344 3.514 4.828 39 H ARG 6 H ARG 6 -22.742 2.843 3.814 40 HA ARG 6 HA ARG 6 -20.613 2.418 5.539 41 HB2 ARG 6 HB2 ARG 6 -21.519 1.070 2.998 42 HB3 ARG 6 HB3 ARG 6 -20.017 0.582 3.793 43 HG2 ARG 6 HG2 ARG 6 -21.514 -0.877 4.793 44 HG3 ARG 6 HG3 ARG 6 -21.530 0.445 5.967 45 HD2 ARG 6 HD2 ARG 6 -23.824 -0.023 5.620 46 HD3 ARG 6 HD3 ARG 6 -23.534 1.408 4.622 47 HE ARG 6 HE ARG 6 -23.426 -0.097 2.650 48 HH11 ARG 6 HH11 ARG 6 -24.836 -1.372 5.604 49 HH12 ARG 6 HH12 ARG 6 -25.734 -2.609 4.788 50 HH21 ARG 6 HH21 ARG 6 -24.607 -1.741 1.592 51 HH22 ARG 6 HH22 ARG 6 -25.604 -2.819 2.510 52 H SER 7 H SER 7 -20.728 4.233 2.527 53 HA SER 7 HA SER 7 -18.210 3.972 1.487 54 HB2 SER 7 HB2 SER 7 -19.124 6.782 1.658 55 HB3 SER 7 HB3 SER 7 -18.966 5.748 0.232 56 HG SER 7 HG SER 7 -21.176 6.258 0.516 57 H GLU 8 H GLU 8 -19.184 5.774 4.464 58 HA GLU 8 HA GLU 8 -16.858 7.274 4.764 59 HB2 GLU 8 HB2 GLU 8 -18.700 6.120 6.894 60 HB3 GLU 8 HB3 GLU 8 -17.490 7.383 7.155 61 HG2 GLU 8 HG2 GLU 8 -18.692 8.825 5.470 62 HG3 GLU 8 HG3 GLU 8 -19.936 7.575 5.332 63 H ILE 9 H ILE 9 -17.434 3.793 5.291 64 HA ILE 9 HA ILE 9 -15.160 3.486 6.994 65 HB ILE 9 HB ILE 9 -16.710 1.360 5.419 66 HG12 ILE 9 HG12 ILE 9 -17.187 2.390 8.260 67 HG13 ILE 9 HG13 ILE 9 -18.167 2.836 6.857 68 HG21 ILE 9 HG21 ILE 9 -15.925 -0.152 7.214 69 HG22 ILE 9 HG22 ILE 9 -14.555 0.592 6.323 70 HG23 ILE 9 HG23 ILE 9 -15.007 1.204 7.950 71 HD11 ILE 9 HD11 ILE 9 -19.255 1.072 8.171 72 HD12 ILE 9 HD12 ILE 9 -18.815 0.466 6.539 73 HD13 ILE 9 HD13 ILE 9 -17.819 0.013 7.964 74 H ALA 10 H ALA 10 -15.409 4.071 3.603 75 HA ALA 10 HA ALA 10 -12.761 2.824 3.222 76 HB1 ALA 10 HB1 ALA 10 -13.443 2.313 0.895 77 HB2 ALA 10 HB2 ALA 10 -14.458 1.442 2.093 78 HB3 ALA 10 HB3 ALA 10 -15.102 2.896 1.258 79 H GLY 11 H GLY 11 -12.011 3.837 0.784 80 HA2 GLY 11 HA2 GLY 11 -12.724 6.302 -0.034 81 HA3 GLY 11 HA3 GLY 11 -11.785 6.650 1.424 82 H LYS 12 H LYS 12 -10.326 7.802 -0.120 83 HA LYS 12 HA LYS 12 -8.620 5.963 -1.666 84 HB2 LYS 12 HB2 LYS 12 -7.915 8.020 -2.849 85 HB3 LYS 12 HB3 LYS 12 -9.666 7.795 -2.951 86 HG2 LYS 12 HG2 LYS 12 -9.935 9.432 -1.037 87 HG3 LYS 12 HG3 LYS 12 -8.191 9.717 -1.084 88 HD2 LYS 12 HD2 LYS 12 -8.355 10.496 -3.436 89 HD3 LYS 12 HD3 LYS 12 -10.089 10.149 -3.449 90 HE2 LYS 12 HE2 LYS 12 -9.868 12.509 -3.033 91 HE3 LYS 12 HE3 LYS 12 -10.361 11.770 -1.503 92 HZ1 LYS 12 HZ1 LYS 12 -8.522 13.380 -1.327 93 HZ2 LYS 12 HZ2 LYS 12 -8.139 11.911 -0.724 94 HZ3 LYS 12 HZ3 LYS 12 -7.555 12.375 -2.177 95 H TRP 13 H TRP 13 -6.424 5.769 -1.150 96 HA TRP 13 HA TRP 13 -5.403 7.583 0.941 97 HB2 TRP 13 HB2 TRP 13 -5.073 4.552 0.788 98 HB3 TRP 13 HB3 TRP 13 -4.213 5.618 1.907 99 HD1 TRP 13 HD1 TRP 13 -7.493 3.765 1.492 100 HE1 TRP 13 HE1 TRP 13 -9.035 4.251 3.512 101 HE3 TRP 13 HE3 TRP 13 -4.858 7.635 3.607 102 HZ2 TRP 13 HZ2 TRP 13 -9.139 6.024 5.694 103 HZ3 TRP 13 HZ3 TRP 13 -5.750 8.687 5.671 104 HH2 TRP 13 HH2 TRP 13 -7.859 7.890 6.697 105 H TYR 14 H TYR 14 -3.201 8.200 0.679 106 HA TYR 14 HA TYR 14 -2.097 7.389 -1.939 107 HB2 TYR 14 HB2 TYR 14 -1.387 9.790 -0.172 108 HB3 TYR 14 HB3 TYR 14 -0.878 9.508 -1.842 109 HD1 TYR 14 HD1 TYR 14 -3.932 10.068 0.275 110 HD2 TYR 14 HD2 TYR 14 -2.196 10.313 -3.646 111 HE1 TYR 14 HE1 TYR 14 -5.940 11.263 -0.535 112 HE2 TYR 14 HE2 TYR 14 -4.209 11.504 -4.462 113 HH TYR 14 HH TYR 14 -6.458 11.908 -3.959 114 H VAL 15 H VAL 15 -0.066 6.188 -1.986 115 HA VAL 15 HA VAL 15 1.001 5.789 0.743 116 HB VAL 15 HB VAL 15 0.496 3.867 -0.671 117 HG11 VAL 15 HG11 VAL 15 1.750 3.382 -2.777 118 HG12 VAL 15 HG12 VAL 15 0.674 4.814 -2.899 119 HG13 VAL 15 HG13 VAL 15 2.445 5.036 -2.706 120 HG21 VAL 15 HG21 VAL 15 2.662 2.667 -0.700 121 HG22 VAL 15 HG22 VAL 15 3.495 4.222 -0.367 122 HG23 VAL 15 HG23 VAL 15 2.341 3.548 0.831 123 H VAL 16 H VAL 16 2.542 7.070 1.401 124 HA VAL 16 HA VAL 16 4.252 8.377 -0.576 125 HB VAL 16 HB VAL 16 4.737 10.037 1.178 126 HG11 VAL 16 HG11 VAL 16 2.523 11.144 1.234 127 HG12 VAL 16 HG12 VAL 16 2.907 10.471 -0.386 128 HG13 VAL 16 HG13 VAL 16 1.755 9.614 0.692 129 HG21 VAL 16 HG21 VAL 16 3.415 10.109 3.264 130 HG22 VAL 16 HG22 VAL 16 2.700 8.513 2.855 131 HG23 VAL 16 HG23 VAL 16 4.463 8.653 3.168 132 H ALA 17 H ALA 17 4.281 5.618 1.257 133 HA ALA 17 HA ALA 17 7.172 5.888 1.690 134 HB1 ALA 17 HB1 ALA 17 6.910 4.625 3.811 135 HB2 ALA 17 HB2 ALA 17 6.064 6.208 3.873 136 HB3 ALA 17 HB3 ALA 17 5.125 4.697 3.628 137 H LEU 18 H LEU 18 8.349 3.964 1.327 138 HA LEU 18 HA LEU 18 6.792 1.592 0.655 139 HB2 LEU 18 HB2 LEU 18 8.797 2.989 -1.210 140 HB3 LEU 18 HB3 LEU 18 8.149 1.366 -1.477 141 HG LEU 18 HG LEU 18 6.470 3.903 -1.391 142 HD11 LEU 18 HD11 LEU 18 6.311 3.670 -3.850 143 HD12 LEU 18 HD12 LEU 18 7.997 3.965 -3.305 144 HD13 LEU 18 HD13 LEU 18 7.486 2.313 -3.790 145 HD21 LEU 18 HD21 LEU 18 4.730 2.462 -2.419 146 HD22 LEU 18 HD22 LEU 18 5.830 1.049 -2.276 147 HD23 LEU 18 HD23 LEU 18 5.225 1.870 -0.797 148 H ALA 19 H ALA 19 7.930 -0.346 1.075 149 HA ALA 19 HA ALA 19 10.829 -0.123 1.544 150 HB1 ALA 19 HB1 ALA 19 10.559 -1.394 3.642 151 HB2 ALA 19 HB2 ALA 19 9.727 0.194 3.741 152 HB3 ALA 19 HB3 ALA 19 8.773 -1.304 3.475 153 H SER 20 H SER 20 11.851 -1.952 0.702 154 HA SER 20 HA SER 20 10.152 -4.284 0.110 155 HB2 SER 20 HB2 SER 20 12.200 -3.045 -1.806 156 HB3 SER 20 HB3 SER 20 11.169 -4.448 -2.118 157 HG SER 20 HG SER 20 10.313 -2.492 -3.066 158 H ASN 21 H ASN 21 11.417 -6.327 -0.099 159 HA ASN 21 HA ASN 21 13.878 -6.149 1.534 160 HB2 ASN 21 HB2 ASN 21 11.678 -7.637 1.914 161 HB3 ASN 21 HB3 ASN 21 12.378 -8.662 0.654 162 HD21 ASN 21 HD21 ASN 21 14.699 -9.332 1.047 163 HD22 ASN 21 HD22 ASN 21 15.126 -9.782 2.664 164 H THR 22 H THR 22 13.064 -6.176 -1.706 165 HA THR 22 HA THR 22 15.670 -7.297 -2.351 166 HB THR 22 HB THR 22 14.477 -7.748 -4.745 167 HG1 THR 22 HG1 THR 22 12.308 -7.931 -4.333 168 HG21 THR 22 HG21 THR 22 14.256 -10.018 -3.850 169 HG22 THR 22 HG22 THR 22 15.752 -9.269 -3.197 170 HG23 THR 22 HG23 THR 22 14.286 -9.391 -2.167 171 H GLU 23 H GLU 23 17.393 -6.679 -3.832 172 HA GLU 23 HA GLU 23 17.494 -3.859 -3.735 173 HB2 GLU 23 HB2 GLU 23 18.730 -5.013 -6.207 174 HB3 GLU 23 HB3 GLU 23 19.551 -4.270 -4.827 175 HG2 GLU 23 HG2 GLU 23 18.560 -7.152 -4.865 176 HG3 GLU 23 HG3 GLU 23 20.199 -6.660 -5.311 177 H PHE 24 H PHE 24 16.745 -5.992 -6.770 178 HA PHE 24 HA PHE 24 16.162 -3.941 -8.529 179 HB2 PHE 24 HB2 PHE 24 14.782 -6.669 -8.212 180 HB3 PHE 24 HB3 PHE 24 14.648 -5.638 -9.642 181 HD1 PHE 24 HD1 PHE 24 16.821 -5.041 -10.891 182 HD2 PHE 24 HD2 PHE 24 16.558 -8.224 -8.017 183 HE1 PHE 24 HE1 PHE 24 18.854 -6.070 -11.851 184 HE2 PHE 24 HE2 PHE 24 18.601 -9.257 -8.977 185 HZ PHE 24 HZ PHE 24 19.751 -8.180 -10.897 186 H PHE 25 H PHE 25 14.197 -5.246 -5.825 187 HA PHE 25 HA PHE 25 11.783 -3.957 -6.636 188 HB2 PHE 25 HB2 PHE 25 12.714 -5.468 -4.259 189 HB3 PHE 25 HB3 PHE 25 11.397 -4.311 -4.024 190 HD1 PHE 25 HD1 PHE 25 12.468 -7.336 -5.881 191 HD2 PHE 25 HD2 PHE 25 9.223 -4.663 -5.014 192 HE1 PHE 25 HE1 PHE 25 10.881 -8.943 -6.892 193 HE2 PHE 25 HE2 PHE 25 7.631 -6.262 -6.036 194 HZ PHE 25 HZ PHE 25 8.458 -8.408 -6.977 195 H LEU 26 H LEU 26 14.294 -3.233 -4.067 196 HA LEU 26 HA LEU 26 13.215 -0.741 -3.361 197 HB2 LEU 26 HB2 LEU 26 16.135 -1.714 -3.325 198 HB3 LEU 26 HB3 LEU 26 15.468 -0.405 -2.341 199 HG LEU 26 HG LEU 26 14.620 -3.324 -2.100 200 HD11 LEU 26 HD11 LEU 26 16.000 -3.334 -0.055 201 HD12 LEU 26 HD12 LEU 26 16.992 -3.035 -1.521 202 HD13 LEU 26 HD13 LEU 26 16.569 -1.673 -0.430 203 HD21 LEU 26 HD21 LEU 26 13.644 -2.552 0.030 204 HD22 LEU 26 HD22 LEU 26 14.152 -0.871 -0.346 205 HD23 LEU 26 HD23 LEU 26 12.930 -1.691 -1.375 206 H ARG 27 H ARG 27 16.044 -1.610 -5.537 207 HA ARG 27 HA ARG 27 16.776 0.975 -6.145 208 HB2 ARG 27 HB2 ARG 27 17.968 -1.229 -6.701 209 HB3 ARG 27 HB3 ARG 27 16.725 -1.570 -7.912 210 HG2 ARG 27 HG2 ARG 27 17.470 0.622 -9.073 211 HG3 ARG 27 HG3 ARG 27 18.868 0.595 -7.990 212 HD2 ARG 27 HD2 ARG 27 19.771 -0.599 -9.754 213 HD3 ARG 27 HD3 ARG 27 19.066 -1.946 -8.851 214 HE ARG 27 HE ARG 27 17.061 -1.057 -10.606 215 HH11 ARG 27 HH11 ARG 27 20.293 -2.433 -10.869 216 HH12 ARG 27 HH12 ARG 27 19.981 -3.162 -12.409 217 HH21 ARG 27 HH21 ARG 27 16.677 -2.003 -12.610 218 HH22 ARG 27 HH22 ARG 27 17.918 -2.916 -13.402 219 H GLU 28 H GLU 28 13.944 -0.902 -7.599 220 HA GLU 28 HA GLU 28 13.866 1.140 -9.680 221 HB2 GLU 28 HB2 GLU 28 11.943 -1.112 -8.973 222 HB3 GLU 28 HB3 GLU 28 11.794 -0.036 -10.368 223 HG2 GLU 28 HG2 GLU 28 13.969 -2.096 -9.826 224 HG3 GLU 28 HG3 GLU 28 12.757 -2.112 -11.114 225 H LYS 29 H LYS 29 12.770 0.691 -6.348 226 HA LYS 29 HA LYS 29 10.345 2.156 -6.489 227 HB2 LYS 29 HB2 LYS 29 12.268 1.681 -4.180 228 HB3 LYS 29 HB3 LYS 29 10.660 2.402 -4.038 229 HG2 LYS 29 HG2 LYS 29 11.322 -0.447 -4.910 230 HG3 LYS 29 HG3 LYS 29 10.573 0.057 -3.389 231 HD2 LYS 29 HD2 LYS 29 8.757 -0.694 -4.727 232 HD3 LYS 29 HD3 LYS 29 8.669 1.070 -4.812 233 HE2 LYS 29 HE2 LYS 29 8.355 0.156 -7.050 234 HE3 LYS 29 HE3 LYS 29 9.897 1.020 -6.995 235 HZ1 LYS 29 HZ1 LYS 29 10.037 -1.137 -8.092 236 HZ2 LYS 29 HZ2 LYS 29 11.026 -1.068 -6.794 237 HZ3 LYS 29 HZ3 LYS 29 9.626 -1.904 -6.710 238 H ASP 30 H ASP 30 13.868 2.970 -6.063 239 HA ASP 30 HA ASP 30 13.517 5.677 -5.324 240 HB2 ASP 30 HB2 ASP 30 15.652 4.456 -5.114 241 HB3 ASP 30 HB3 ASP 30 15.729 4.227 -6.866 242 H LYS 31 H LYS 31 14.043 3.993 -8.553 243 HA LYS 31 HA LYS 31 13.705 6.404 -9.943 244 HB2 LYS 31 HB2 LYS 31 13.447 3.476 -10.736 245 HB3 LYS 31 HB3 LYS 31 13.176 4.802 -11.874 246 HG2 LYS 31 HG2 LYS 31 15.773 4.200 -10.389 247 HG3 LYS 31 HG3 LYS 31 15.441 3.891 -12.099 248 HD2 LYS 31 HD2 LYS 31 16.253 5.959 -12.529 249 HD3 LYS 31 HD3 LYS 31 14.779 6.606 -11.796 250 HE2 LYS 31 HE2 LYS 31 16.912 5.772 -9.866 251 HE3 LYS 31 HE3 LYS 31 17.330 7.139 -10.907 252 HZ1 LYS 31 HZ1 LYS 31 16.182 8.357 -9.492 253 HZ2 LYS 31 HZ2 LYS 31 14.801 7.659 -10.013 254 HZ3 LYS 31 HZ3 LYS 31 15.572 7.065 -8.702 255 H MET 32 H MET 32 11.214 4.262 -8.123 256 HA MET 32 HA MET 32 9.531 4.979 -10.433 257 HB2 MET 32 HB2 MET 32 9.484 3.998 -7.492 258 HB3 MET 32 HB3 MET 32 7.943 4.259 -8.319 259 HG2 MET 32 HG2 MET 32 9.840 2.214 -9.433 260 HG3 MET 32 HG3 MET 32 8.948 1.852 -7.949 261 HE1 MET 32 HE1 MET 32 6.860 3.435 -11.747 262 HE2 MET 32 HE2 MET 32 7.327 4.481 -10.363 263 HE3 MET 32 HE3 MET 32 8.593 3.644 -11.323 264 H LYS 33 H LYS 33 7.545 5.427 -7.586 265 HA LYS 33 HA LYS 33 8.226 8.046 -6.860 266 HB2 LYS 33 HB2 LYS 33 6.473 7.881 -9.346 267 HB3 LYS 33 HB3 LYS 33 6.400 9.256 -8.236 268 HG2 LYS 33 HG2 LYS 33 8.794 9.764 -8.665 269 HG3 LYS 33 HG3 LYS 33 8.927 8.349 -9.717 270 HD2 LYS 33 HD2 LYS 33 7.295 9.396 -11.327 271 HD3 LYS 33 HD3 LYS 33 7.170 10.813 -10.276 272 HE2 LYS 33 HE2 LYS 33 9.598 11.281 -10.547 273 HE3 LYS 33 HE3 LYS 33 9.809 9.802 -11.493 274 HZ1 LYS 33 HZ1 LYS 33 9.620 11.729 -12.896 275 HZ2 LYS 33 HZ2 LYS 33 8.347 10.742 -13.163 276 HZ3 LYS 33 HZ3 LYS 33 8.152 12.108 -12.290 277 H MET 34 H MET 34 6.063 9.225 -5.929 278 HA MET 34 HA MET 34 4.986 7.310 -4.135 279 HB2 MET 34 HB2 MET 34 5.209 9.735 -3.714 280 HB3 MET 34 HB3 MET 34 4.164 10.104 -5.092 281 HG2 MET 34 HG2 MET 34 2.219 9.177 -3.935 282 HG3 MET 34 HG3 MET 34 3.231 8.622 -2.595 283 HE1 MET 34 HE1 MET 34 3.329 12.786 -4.090 284 HE2 MET 34 HE2 MET 34 2.282 11.505 -4.788 285 HE3 MET 34 HE3 MET 34 1.596 12.694 -3.630 286 H ALA 35 H ALA 35 3.195 6.247 -4.097 287 HA ALA 35 HA ALA 35 1.752 5.845 -6.600 288 HB1 ALA 35 HB1 ALA 35 1.429 3.531 -5.814 289 HB2 ALA 35 HB2 ALA 35 3.162 3.960 -6.012 290 HB3 ALA 35 HB3 ALA 35 2.435 3.891 -4.371 291 H MET 36 H MET 36 -0.423 4.609 -6.104 292 HA MET 36 HA MET 36 -1.774 6.198 -4.021 293 HB2 MET 36 HB2 MET 36 -2.743 5.493 -6.865 294 HB3 MET 36 HB3 MET 36 -3.640 6.442 -5.672 295 HG2 MET 36 HG2 MET 36 -0.932 7.424 -6.591 296 HG3 MET 36 HG3 MET 36 -2.326 7.605 -7.664 297 HE1 MET 36 HE1 MET 36 -1.670 11.127 -6.182 298 HE2 MET 36 HE2 MET 36 -0.431 10.049 -5.453 299 HE3 MET 36 HE3 MET 36 -0.895 9.847 -7.176 300 H ALA 37 H ALA 37 -3.917 5.213 -3.417 301 HA ALA 37 HA ALA 37 -4.457 2.535 -4.342 302 HB1 ALA 37 HB1 ALA 37 -4.213 1.548 -2.080 303 HB2 ALA 37 HB2 ALA 37 -2.633 2.144 -2.693 304 HB3 ALA 37 HB3 ALA 37 -3.541 3.099 -1.472 305 H ARG 38 H ARG 38 -6.692 2.358 -4.252 306 HA ARG 38 HA ARG 38 -8.105 4.045 -2.254 307 HB2 ARG 38 HB2 ARG 38 -8.520 5.082 -4.320 308 HB3 ARG 38 HB3 ARG 38 -8.619 3.545 -5.189 309 HG2 ARG 38 HG2 ARG 38 -10.660 3.927 -3.039 310 HG3 ARG 38 HG3 ARG 38 -10.779 5.039 -4.409 311 HD2 ARG 38 HD2 ARG 38 -10.596 2.956 -5.938 312 HD3 ARG 38 HD3 ARG 38 -10.822 1.982 -4.479 313 HE ARG 38 HE ARG 38 -13.075 2.481 -4.566 314 HH11 ARG 38 HH11 ARG 38 -11.345 4.883 -6.465 315 HH12 ARG 38 HH12 ARG 38 -12.785 5.713 -6.952 316 HH21 ARG 38 HH21 ARG 38 -14.957 3.607 -5.196 317 HH22 ARG 38 HH22 ARG 38 -14.832 4.990 -6.232 318 H ILE 39 H ILE 39 -9.457 2.810 -0.931 319 HA ILE 39 HA ILE 39 -9.641 -0.019 -1.700 320 HB ILE 39 HB ILE 39 -10.112 1.258 1.036 321 HG12 ILE 39 HG12 ILE 39 -7.830 1.780 0.436 322 HG13 ILE 39 HG13 ILE 39 -7.848 0.531 1.687 323 HG21 ILE 39 HG21 ILE 39 -9.715 -1.036 1.884 324 HG22 ILE 39 HG22 ILE 39 -11.108 -0.955 0.753 325 HG23 ILE 39 HG23 ILE 39 -9.535 -1.616 0.194 326 HD11 ILE 39 HD11 ILE 39 -6.146 0.056 -0.011 327 HD12 ILE 39 HD12 ILE 39 -7.421 -1.207 -0.023 328 HD13 ILE 39 HD13 ILE 39 -7.403 0.062 -1.294 329 H SER 40 H SER 40 -11.676 -1.002 -1.792 330 HA SER 40 HA SER 40 -14.009 0.551 -0.959 331 HB2 SER 40 HB2 SER 40 -13.583 -0.579 -3.774 332 HB3 SER 40 HB3 SER 40 -15.100 0.089 -3.156 333 HG SER 40 HG SER 40 -14.363 2.075 -3.476 334 H PHE 41 H PHE 41 -15.551 -0.700 -0.020 335 HA PHE 41 HA PHE 41 -14.926 -3.418 0.470 336 HB2 PHE 41 HB2 PHE 41 -17.140 -3.428 1.632 337 HB3 PHE 41 HB3 PHE 41 -16.027 -2.171 2.187 338 HD1 PHE 41 HD1 PHE 41 -19.119 -2.832 0.245 339 HD2 PHE 41 HD2 PHE 41 -16.532 0.164 1.911 340 HE1 PHE 41 HE1 PHE 41 -20.864 -1.116 -0.133 341 HE2 PHE 41 HE2 PHE 41 -18.271 1.883 1.529 342 HZ PHE 41 HZ PHE 41 -20.445 1.247 0.509 343 H LEU 42 H LEU 42 -15.611 -5.280 -0.527 344 HA LEU 42 HA LEU 42 -17.366 -4.891 -2.848 345 HB2 LEU 42 HB2 LEU 42 -14.992 -5.962 -2.934 346 HB3 LEU 42 HB3 LEU 42 -15.725 -7.351 -2.121 347 HG LEU 42 HG LEU 42 -15.528 -7.710 -4.529 348 HD11 LEU 42 HD11 LEU 42 -17.861 -8.368 -5.012 349 HD12 LEU 42 HD12 LEU 42 -17.364 -8.806 -3.342 350 HD13 LEU 42 HD13 LEU 42 -18.420 -7.380 -3.621 351 HD21 LEU 42 HD21 LEU 42 -16.898 -6.407 -6.130 352 HD22 LEU 42 HD22 LEU 42 -17.401 -5.313 -4.797 353 HD23 LEU 42 HD23 LEU 42 -15.678 -5.386 -5.297 354 H GLY 43 H GLY 43 -16.843 -6.975 0.068 355 HA2 GLY 43 HA2 GLY 43 -19.678 -7.568 0.213 356 HA3 GLY 43 HA3 GLY 43 -18.625 -8.935 -0.174 357 H GLU 44 H GLU 44 -19.991 -9.207 2.171 358 HA GLU 44 HA GLU 44 -18.817 -8.079 4.452 359 HB2 GLU 44 HB2 GLU 44 -19.963 -10.892 4.229 360 HB3 GLU 44 HB3 GLU 44 -19.924 -9.839 5.649 361 HG2 GLU 44 HG2 GLU 44 -21.383 -8.208 4.197 362 HG3 GLU 44 HG3 GLU 44 -21.665 -9.621 3.171 363 H ASP 45 H ASP 45 -17.775 -10.813 2.320 364 HA ASP 45 HA ASP 45 -15.402 -11.119 4.068 365 HB2 ASP 45 HB2 ASP 45 -16.890 -13.121 4.104 366 HB3 ASP 45 HB3 ASP 45 -16.874 -13.185 2.337 367 H GLU 46 H GLU 46 -15.981 -9.252 1.651 368 HA GLU 46 HA GLU 46 -13.595 -10.026 0.194 369 HB2 GLU 46 HB2 GLU 46 -15.346 -11.076 -1.113 370 HB3 GLU 46 HB3 GLU 46 -16.236 -9.551 -1.213 371 HG2 GLU 46 HG2 GLU 46 -14.715 -8.585 -2.691 372 HG3 GLU 46 HG3 GLU 46 -13.370 -9.597 -2.149 373 H LEU 47 H LEU 47 -12.671 -8.319 -1.102 374 HA LEU 47 HA LEU 47 -13.557 -5.640 -0.575 375 HB2 LEU 47 HB2 LEU 47 -11.538 -4.844 0.414 376 HB3 LEU 47 HB3 LEU 47 -12.337 -6.048 1.434 377 HG LEU 47 HG LEU 47 -10.086 -6.851 -0.433 378 HD11 LEU 47 HD11 LEU 47 -8.557 -6.496 1.436 379 HD12 LEU 47 HD12 LEU 47 -9.302 -4.954 0.895 380 HD13 LEU 47 HD13 LEU 47 -9.884 -5.755 2.393 381 HD21 LEU 47 HD21 LEU 47 -9.859 -8.636 1.229 382 HD22 LEU 47 HD22 LEU 47 -11.211 -7.933 2.180 383 HD23 LEU 47 HD23 LEU 47 -11.516 -8.592 0.537 384 H LYS 48 H LYS 48 -12.588 -4.019 -1.912 385 HA LYS 48 HA LYS 48 -10.981 -5.101 -4.098 386 HB2 LYS 48 HB2 LYS 48 -13.469 -4.868 -4.658 387 HB3 LYS 48 HB3 LYS 48 -13.160 -3.127 -4.680 388 HG2 LYS 48 HG2 LYS 48 -11.372 -3.435 -6.359 389 HG3 LYS 48 HG3 LYS 48 -11.586 -5.189 -6.296 390 HD2 LYS 48 HD2 LYS 48 -13.820 -3.238 -7.018 391 HD3 LYS 48 HD3 LYS 48 -12.772 -4.012 -8.215 392 HE2 LYS 48 HE2 LYS 48 -14.297 -5.652 -6.145 393 HE3 LYS 48 HE3 LYS 48 -15.063 -5.135 -7.653 394 HZ1 LYS 48 HZ1 LYS 48 -14.179 -7.165 -8.175 395 HZ2 LYS 48 HZ2 LYS 48 -12.987 -6.185 -8.710 396 HZ3 LYS 48 HZ3 LYS 48 -12.820 -6.973 -7.290 397 H VAL 49 H VAL 49 -9.334 -3.749 -4.936 398 HA VAL 49 HA VAL 49 -9.196 -1.099 -3.710 399 HB VAL 49 HB VAL 49 -6.760 -1.347 -3.357 400 HG11 VAL 49 HG11 VAL 49 -6.866 -2.891 -1.429 401 HG12 VAL 49 HG12 VAL 49 -8.307 -1.822 -1.510 402 HG13 VAL 49 HG13 VAL 49 -8.428 -3.535 -2.036 403 HG21 VAL 49 HG21 VAL 49 -5.691 -3.562 -3.506 404 HG22 VAL 49 HG22 VAL 49 -7.202 -4.243 -4.198 405 HG23 VAL 49 HG23 VAL 49 -6.283 -2.993 -5.103 406 H SER 50 H SER 50 -8.209 0.569 -5.073 407 HA SER 50 HA SER 50 -7.563 -0.440 -7.796 408 HB2 SER 50 HB2 SER 50 -8.192 1.880 -8.499 409 HB3 SER 50 HB3 SER 50 -9.547 0.985 -7.797 410 HG SER 50 HG SER 50 -8.201 3.275 -6.849 411 H TYR 51 H TYR 51 -5.378 -0.266 -8.276 412 HA TYR 51 HA TYR 51 -3.771 1.384 -6.476 413 HB2 TYR 51 HB2 TYR 51 -3.351 -0.849 -8.532 414 HB3 TYR 51 HB3 TYR 51 -1.981 0.173 -8.079 415 HD1 TYR 51 HD1 TYR 51 -1.978 0.449 -5.265 416 HD2 TYR 51 HD2 TYR 51 -3.243 -2.950 -7.568 417 HE1 TYR 51 HE1 TYR 51 -1.409 -1.043 -3.378 418 HE2 TYR 51 HE2 TYR 51 -2.715 -4.439 -5.658 419 HH TYR 51 HH TYR 51 -0.771 -4.015 -3.527 420 H ALA 52 H ALA 52 -2.563 3.150 -7.271 421 HA ALA 52 HA ALA 52 -2.657 3.635 -10.186 422 HB1 ALA 52 HB1 ALA 52 -2.987 6.021 -9.683 423 HB2 ALA 52 HB2 ALA 52 -4.363 5.030 -9.092 424 HB3 ALA 52 HB3 ALA 52 -3.131 5.638 -7.935 425 H VAL 53 H VAL 53 -0.531 3.577 -10.858 426 HA VAL 53 HA VAL 53 1.391 4.803 -9.029 427 HB VAL 53 HB VAL 53 3.076 3.091 -9.771 428 HG11 VAL 53 HG11 VAL 53 2.192 1.238 -8.375 429 HG12 VAL 53 HG12 VAL 53 1.891 2.844 -7.628 430 HG13 VAL 53 HG13 VAL 53 0.554 1.972 -8.452 431 HG21 VAL 53 HG21 VAL 53 2.300 0.997 -10.824 432 HG22 VAL 53 HG22 VAL 53 0.660 1.704 -11.014 433 HG23 VAL 53 HG23 VAL 53 2.054 2.420 -11.891 434 HA PRO 54 HA PRO 54 2.593 6.755 -12.833 435 HB2 PRO 54 HB2 PRO 54 4.849 8.052 -11.953 436 HB3 PRO 54 HB3 PRO 54 3.299 8.503 -11.232 437 HG2 PRO 54 HG2 PRO 54 5.466 6.698 -10.131 438 HG3 PRO 54 HG3 PRO 54 4.500 7.920 -9.293 439 HD2 PRO 54 HD2 PRO 54 3.942 5.179 -9.243 440 HD3 PRO 54 HD3 PRO 54 2.744 6.437 -8.911 441 H LYS 55 H LYS 55 2.977 4.936 -14.041 442 HA LYS 55 HA LYS 55 5.646 3.738 -13.979 443 HB2 LYS 55 HB2 LYS 55 3.647 2.270 -14.018 444 HB3 LYS 55 HB3 LYS 55 3.132 3.012 -15.539 445 HG2 LYS 55 HG2 LYS 55 5.231 2.207 -16.636 446 HG3 LYS 55 HG3 LYS 55 5.733 1.456 -15.116 447 HD2 LYS 55 HD2 LYS 55 3.813 -0.062 -15.145 448 HD3 LYS 55 HD3 LYS 55 3.095 0.787 -16.521 449 HE2 LYS 55 HE2 LYS 55 4.088 -1.050 -17.575 450 HE3 LYS 55 HE3 LYS 55 5.335 0.189 -17.773 451 HZ1 LYS 55 HZ1 LYS 55 6.258 -1.881 -17.005 452 HZ2 LYS 55 HZ2 LYS 55 6.466 -0.741 -15.855 453 HZ3 LYS 55 HZ3 LYS 55 5.315 -1.884 -15.672 454 HA PRO 56 HA PRO 56 7.306 6.447 -17.055 455 HB2 PRO 56 HB2 PRO 56 7.875 3.752 -18.450 456 HB3 PRO 56 HB3 PRO 56 8.990 5.106 -18.225 457 HG2 PRO 56 HG2 PRO 56 9.105 2.922 -16.640 458 HG3 PRO 56 HG3 PRO 56 9.467 4.534 -16.009 459 HD2 PRO 56 HD2 PRO 56 7.117 2.792 -15.455 460 HD3 PRO 56 HD3 PRO 56 7.727 4.167 -14.524 461 H ASN 57 H ASN 57 5.235 3.669 -18.221 462 HA ASN 57 HA ASN 57 4.907 4.907 -20.762 463 HB2 ASN 57 HB2 ASN 57 2.966 3.056 -19.206 464 HB3 ASN 57 HB3 ASN 57 3.085 3.207 -20.964 465 HD21 ASN 57 HD21 ASN 57 4.553 1.997 -22.080 466 HD22 ASN 57 HD22 ASN 57 5.544 0.777 -21.352 467 H GLY 58 H GLY 58 3.526 5.506 -17.545 468 HA2 GLY 58 HA2 GLY 58 2.415 7.804 -17.717 469 HA3 GLY 58 HA3 GLY 58 1.253 6.950 -18.742 470 H CYS 59 H CYS 59 0.312 8.155 -16.351 471 HA CYS 59 HA CYS 59 0.373 6.792 -14.013 472 HB2 CYS 59 HB2 CYS 59 -2.081 7.959 -15.403 473 HB3 CYS 59 HB3 CYS 59 -1.993 7.525 -13.691 474 H ARG 60 H ARG 60 0.360 4.577 -13.724 475 HA ARG 60 HA ARG 60 -1.561 3.051 -15.335 476 HB2 ARG 60 HB2 ARG 60 0.970 2.552 -15.364 477 HB3 ARG 60 HB3 ARG 60 0.771 1.974 -13.704 478 HG2 ARG 60 HG2 ARG 60 0.642 0.040 -15.089 479 HG3 ARG 60 HG3 ARG 60 -1.017 0.371 -14.573 480 HD2 ARG 60 HD2 ARG 60 0.162 1.312 -17.238 481 HD3 ARG 60 HD3 ARG 60 -0.746 -0.193 -17.040 482 HE ARG 60 HE ARG 60 -1.850 2.561 -16.795 483 HH11 ARG 60 HH11 ARG 60 -2.358 -0.916 -16.982 484 HH12 ARG 60 HH12 ARG 60 -4.068 -0.774 -17.222 485 HH21 ARG 60 HH21 ARG 60 -4.095 2.727 -17.115 486 HH22 ARG 60 HH22 ARG 60 -5.055 1.297 -17.298 487 H LYS 61 H LYS 61 -3.226 1.916 -14.372 488 HA LYS 61 HA LYS 61 -3.180 1.901 -11.435 489 HB2 LYS 61 HB2 LYS 61 -5.625 2.224 -11.484 490 HB3 LYS 61 HB3 LYS 61 -4.774 3.593 -12.211 491 HG2 LYS 61 HG2 LYS 61 -5.297 2.687 -14.491 492 HG3 LYS 61 HG3 LYS 61 -6.179 1.348 -13.745 493 HD2 LYS 61 HD2 LYS 61 -6.898 4.206 -12.997 494 HD3 LYS 61 HD3 LYS 61 -7.459 3.548 -14.540 495 HE2 LYS 61 HE2 LYS 61 -9.198 3.165 -12.902 496 HE3 LYS 61 HE3 LYS 61 -8.478 1.599 -13.299 497 HZ1 LYS 61 HZ1 LYS 61 -8.851 2.159 -10.879 498 HZ2 LYS 61 HZ2 LYS 61 -7.393 1.537 -11.271 499 HZ3 LYS 61 HZ3 LYS 61 -7.547 3.137 -10.981 500 H TRP 62 H TRP 62 -4.129 0.041 -10.430 501 HA TRP 62 HA TRP 62 -5.047 -2.099 -12.239 502 HB2 TRP 62 HB2 TRP 62 -2.506 -2.215 -11.689 503 HB3 TRP 62 HB3 TRP 62 -3.014 -2.558 -10.030 504 HD1 TRP 62 HD1 TRP 62 -4.983 -4.744 -9.984 505 HE1 TRP 62 HE1 TRP 62 -4.758 -7.022 -11.166 506 HE3 TRP 62 HE3 TRP 62 -1.387 -3.510 -13.461 507 HZ2 TRP 62 HZ2 TRP 62 -3.254 -8.179 -13.238 508 HZ3 TRP 62 HZ3 TRP 62 -0.589 -5.288 -15.006 509 HH2 TRP 62 HH2 TRP 62 -1.515 -7.585 -14.895 510 H GLU 63 H GLU 63 -6.560 -3.492 -11.094 511 HA GLU 63 HA GLU 63 -7.279 -2.412 -8.433 512 HB2 GLU 63 HB2 GLU 63 -9.387 -3.720 -10.105 513 HB3 GLU 63 HB3 GLU 63 -9.506 -2.341 -9.004 514 HG2 GLU 63 HG2 GLU 63 -8.375 -2.208 -11.835 515 HG3 GLU 63 HG3 GLU 63 -10.040 -1.811 -11.391 516 H THR 64 H THR 64 -7.960 -4.074 -6.979 517 HA THR 64 HA THR 64 -7.846 -6.806 -7.923 518 HB THR 64 HB THR 64 -6.149 -5.814 -5.567 519 HG1 THR 64 HG1 THR 64 -4.755 -5.171 -7.078 520 HG21 THR 64 HG21 THR 64 -5.080 -8.053 -5.781 521 HG22 THR 64 HG22 THR 64 -6.844 -8.189 -5.472 522 HG23 THR 64 HG23 THR 64 -6.199 -8.451 -7.128 523 H THR 65 H THR 65 -8.930 -8.325 -6.693 524 HA THR 65 HA THR 65 -10.567 -7.212 -4.521 525 HB THR 65 HB THR 65 -11.135 -9.818 -5.947 526 HG1 THR 65 HG1 THR 65 -12.176 -8.644 -7.563 527 HG21 THR 65 HG21 THR 65 -13.445 -9.195 -5.298 528 HG22 THR 65 HG22 THR 65 -12.360 -9.230 -3.866 529 HG23 THR 65 HG23 THR 65 -12.836 -7.659 -4.594 530 H PHE 66 H PHE 66 -10.557 -8.251 -2.410 531 HA PHE 66 HA PHE 66 -8.773 -10.588 -2.241 532 HB2 PHE 66 HB2 PHE 66 -8.821 -8.337 -0.186 533 HB3 PHE 66 HB3 PHE 66 -7.726 -9.724 -0.247 534 HD1 PHE 66 HD1 PHE 66 -6.209 -9.912 -2.378 535 HD2 PHE 66 HD2 PHE 66 -8.188 -6.316 -1.125 536 HE1 PHE 66 HE1 PHE 66 -4.590 -8.568 -3.686 537 HE2 PHE 66 HE2 PHE 66 -6.577 -4.968 -2.434 538 HZ PHE 66 HZ PHE 66 -4.772 -6.091 -3.717 539 H LYS 67 H LYS 67 -9.014 -11.635 0.089 540 HA LYS 67 HA LYS 67 -11.901 -11.760 0.630 541 HB2 LYS 67 HB2 LYS 67 -9.664 -13.766 0.612 542 HB3 LYS 67 HB3 LYS 67 -10.903 -13.965 1.858 543 HG2 LYS 67 HG2 LYS 67 -11.403 -15.261 -0.215 544 HG3 LYS 67 HG3 LYS 67 -12.672 -14.094 0.180 545 HD2 LYS 67 HD2 LYS 67 -11.673 -12.471 -1.455 546 HD3 LYS 67 HD3 LYS 67 -10.429 -13.660 -1.863 547 HE2 LYS 67 HE2 LYS 67 -12.159 -15.249 -2.648 548 HE3 LYS 67 HE3 LYS 67 -13.439 -14.130 -2.163 549 HZ1 LYS 67 HZ1 LYS 67 -12.738 -14.099 -4.556 550 HZ2 LYS 67 HZ2 LYS 67 -12.808 -12.641 -3.823 551 HZ3 LYS 67 HZ3 LYS 67 -11.363 -13.351 -4.090 552 H LYS 68 H LYS 68 -12.582 -12.131 2.973 553 HA LYS 68 HA LYS 68 -10.933 -10.366 4.615 554 HB2 LYS 68 HB2 LYS 68 -13.369 -10.071 4.547 555 HB3 LYS 68 HB3 LYS 68 -13.640 -11.789 4.868 556 HG2 LYS 68 HG2 LYS 68 -14.132 -10.775 6.919 557 HG3 LYS 68 HG3 LYS 68 -12.483 -11.366 7.157 558 HD2 LYS 68 HD2 LYS 68 -12.264 -9.200 7.962 559 HD3 LYS 68 HD3 LYS 68 -11.787 -8.958 6.276 560 HE2 LYS 68 HE2 LYS 68 -13.990 -8.103 5.688 561 HE3 LYS 68 HE3 LYS 68 -14.661 -8.578 7.254 562 HZ1 LYS 68 HZ1 LYS 68 -14.151 -6.261 7.251 563 HZ2 LYS 68 HZ2 LYS 68 -13.117 -6.993 8.280 564 HZ3 LYS 68 HZ3 LYS 68 -12.600 -6.513 6.808 565 H THR 69 H THR 69 -8.971 -11.667 5.087 566 HA THR 69 HA THR 69 -9.683 -13.989 6.845 567 HB THR 69 HB THR 69 -7.005 -13.291 5.628 568 HG1 THR 69 HG1 THR 69 -7.957 -15.174 4.029 569 HG21 THR 69 HG21 THR 69 -6.586 -15.722 5.692 570 HG22 THR 69 HG22 THR 69 -6.969 -15.027 7.303 571 HG23 THR 69 HG23 THR 69 -8.213 -15.965 6.411 572 H SER 70 H SER 70 -10.074 -12.445 8.552 573 HA SER 70 HA SER 70 -8.195 -10.416 9.261 574 HB2 SER 70 HB2 SER 70 -10.358 -11.599 11.049 575 HB3 SER 70 HB3 SER 70 -9.717 -9.951 11.031 576 HG SER 70 HG SER 70 -11.809 -10.098 9.994 577 H ASP 71 H ASP 71 -6.085 -11.667 9.435 578 HA ASP 71 HA ASP 71 -6.095 -13.781 11.423 579 HB2 ASP 71 HB2 ASP 71 -4.585 -13.668 9.384 580 HB3 ASP 71 HB3 ASP 71 -3.907 -12.144 9.972 581 H ASP 72 H ASP 72 -3.985 -10.723 11.380 582 HA ASP 72 HA ASP 72 -4.044 -10.815 14.317 583 HB2 ASP 72 HB2 ASP 72 -2.021 -10.319 12.584 584 HB3 ASP 72 HB3 ASP 72 -2.594 -8.664 12.830 585 H GLY 73 H GLY 73 -6.313 -10.469 14.111 586 HA2 GLY 73 HA2 GLY 73 -8.169 -9.470 14.653 587 HA3 GLY 73 HA3 GLY 73 -7.262 -7.982 14.952 588 H GLU 74 H GLU 74 -6.280 -7.338 12.195 589 HA GLU 74 HA GLU 74 -8.708 -7.571 10.582 590 HB2 GLU 74 HB2 GLU 74 -7.626 -4.891 11.394 591 HB3 GLU 74 HB3 GLU 74 -8.491 -5.136 9.872 592 HG2 GLU 74 HG2 GLU 74 -10.394 -6.167 11.244 593 HG3 GLU 74 HG3 GLU 74 -9.542 -5.624 12.695 594 H VAL 75 H VAL 75 -7.577 -8.956 9.199 595 HA VAL 75 HA VAL 75 -5.465 -7.679 7.610 596 HB VAL 75 HB VAL 75 -5.379 -10.488 8.805 597 HG11 VAL 75 HG11 VAL 75 -3.168 -10.656 7.718 598 HG12 VAL 75 HG12 VAL 75 -4.495 -10.451 6.525 599 HG13 VAL 75 HG13 VAL 75 -3.437 -9.060 6.939 600 HG21 VAL 75 HG21 VAL 75 -3.335 -9.674 9.961 601 HG22 VAL 75 HG22 VAL 75 -3.622 -8.032 9.293 602 HG23 VAL 75 HG23 VAL 75 -4.797 -8.749 10.447 603 H TYR 76 H TYR 76 -5.282 -8.654 5.462 604 HA TYR 76 HA TYR 76 -7.647 -10.174 4.664 605 HB2 TYR 76 HB2 TYR 76 -6.513 -7.776 3.242 606 HB3 TYR 76 HB3 TYR 76 -7.611 -8.944 2.495 607 HD1 TYR 76 HD1 TYR 76 -9.926 -9.314 3.563 608 HD2 TYR 76 HD2 TYR 76 -7.317 -6.111 4.723 609 HE1 TYR 76 HE1 TYR 76 -11.848 -8.113 4.565 610 HE2 TYR 76 HE2 TYR 76 -9.224 -4.912 5.731 611 HH TYR 76 HH TYR 76 -11.401 -4.911 6.154 612 H TYR 77 H TYR 77 -7.271 -11.035 2.205 613 HA TYR 77 HA TYR 77 -4.520 -11.890 1.939 614 HB2 TYR 77 HB2 TYR 77 -6.702 -13.594 3.046 615 HB3 TYR 77 HB3 TYR 77 -5.893 -14.322 1.652 616 HD1 TYR 77 HD1 TYR 77 -3.479 -14.863 1.736 617 HD2 TYR 77 HD2 TYR 77 -5.534 -13.255 5.144 618 HE1 TYR 77 HE1 TYR 77 -1.614 -15.581 3.197 619 HE2 TYR 77 HE2 TYR 77 -3.671 -13.962 6.608 620 HH TYR 77 HH TYR 77 -1.700 -14.955 6.740 621 H SER 78 H SER 78 -3.952 -12.524 -0.263 622 HA SER 78 HA SER 78 -6.339 -12.620 -2.057 623 HB2 SER 78 HB2 SER 78 -3.776 -12.004 -3.299 624 HB3 SER 78 HB3 SER 78 -5.255 -11.035 -3.286 625 HG SER 78 HG SER 78 -4.404 -9.757 -1.797 626 H GLU 79 H GLU 79 -6.434 -15.018 -1.574 627 HA GLU 79 HA GLU 79 -4.112 -16.636 -2.049 628 HB2 GLU 79 HB2 GLU 79 -6.308 -17.082 -0.709 629 HB3 GLU 79 HB3 GLU 79 -7.014 -17.478 -2.281 630 HG2 GLU 79 HG2 GLU 79 -4.569 -18.839 -1.064 631 HG3 GLU 79 HG3 GLU 79 -6.221 -19.468 -1.006 632 H GLU 80 H GLU 80 -6.828 -15.348 -3.999 633 HA GLU 80 HA GLU 80 -6.395 -17.009 -6.240 634 HB2 GLU 80 HB2 GLU 80 -7.611 -14.214 -5.962 635 HB3 GLU 80 HB3 GLU 80 -7.760 -15.253 -7.385 636 HG2 GLU 80 HG2 GLU 80 -9.304 -16.642 -6.400 637 HG3 GLU 80 HG3 GLU 80 -8.579 -16.504 -4.793 638 H ALA 81 H ALA 81 -4.754 -14.065 -5.061 639 HA ALA 81 HA ALA 81 -3.179 -14.079 -7.522 640 HB1 ALA 81 HB1 ALA 81 -2.618 -11.701 -7.055 641 HB2 ALA 81 HB2 ALA 81 -4.366 -11.990 -7.347 642 HB3 ALA 81 HB3 ALA 81 -3.765 -11.735 -5.674 643 H LYS 82 H LYS 82 -2.756 -15.604 -4.702 644 HA LYS 82 HA LYS 82 -1.001 -16.111 -3.361 645 HB2 LYS 82 HB2 LYS 82 0.745 -15.248 -5.690 646 HB3 LYS 82 HB3 LYS 82 1.147 -16.380 -4.392 647 HG2 LYS 82 HG2 LYS 82 -0.760 -16.772 -6.728 648 HG3 LYS 82 HG3 LYS 82 0.643 -17.747 -6.269 649 HD2 LYS 82 HD2 LYS 82 -0.500 -18.653 -4.330 650 HD3 LYS 82 HD3 LYS 82 -1.817 -17.481 -4.470 651 HE2 LYS 82 HE2 LYS 82 -1.861 -18.665 -6.982 652 HE3 LYS 82 HE3 LYS 82 -1.351 -20.019 -5.964 653 HZ1 LYS 82 HZ1 LYS 82 -3.791 -19.699 -6.220 654 HZ2 LYS 82 HZ2 LYS 82 -3.282 -19.798 -4.672 655 HZ3 LYS 82 HZ3 LYS 82 -3.683 -18.349 -5.308 656 H LYS 83 H LYS 83 -2.036 -13.826 -2.518 657 HA LYS 83 HA LYS 83 0.212 -12.172 -1.792 658 HB2 LYS 83 HB2 LYS 83 -2.287 -10.900 -2.970 659 HB3 LYS 83 HB3 LYS 83 -0.864 -10.065 -2.333 660 HG2 LYS 83 HG2 LYS 83 0.543 -10.947 -4.119 661 HG3 LYS 83 HG3 LYS 83 -0.750 -12.013 -4.684 662 HD2 LYS 83 HD2 LYS 83 -2.188 -9.947 -5.055 663 HD3 LYS 83 HD3 LYS 83 -0.776 -8.957 -4.662 664 HE2 LYS 83 HE2 LYS 83 0.486 -10.193 -6.507 665 HE3 LYS 83 HE3 LYS 83 -1.048 -10.946 -6.962 666 HZ1 LYS 83 HZ1 LYS 83 -0.590 -8.957 -8.238 667 HZ2 LYS 83 HZ2 LYS 83 -1.948 -8.754 -7.356 668 HZ3 LYS 83 HZ3 LYS 83 -0.558 -8.036 -6.891 669 H LYS 84 H LYS 84 -0.065 -10.904 0.108 670 HA LYS 84 HA LYS 84 -2.565 -11.212 1.543 671 HB2 LYS 84 HB2 LYS 84 -1.841 -12.278 3.397 672 HB3 LYS 84 HB3 LYS 84 -1.092 -13.196 2.084 673 HG2 LYS 84 HG2 LYS 84 1.056 -12.350 2.537 674 HG3 LYS 84 HG3 LYS 84 0.432 -10.951 3.421 675 HD2 LYS 84 HD2 LYS 84 -0.457 -12.476 5.190 676 HD3 LYS 84 HD3 LYS 84 0.190 -13.866 4.309 677 HE2 LYS 84 HE2 LYS 84 1.756 -13.232 6.060 678 HE3 LYS 84 HE3 LYS 84 2.484 -12.908 4.481 679 HZ1 LYS 84 HZ1 LYS 84 2.771 -10.849 5.162 680 HZ2 LYS 84 HZ2 LYS 84 1.157 -10.610 5.241 681 HZ3 LYS 84 HZ3 LYS 84 1.974 -11.112 6.562 682 H VAL 85 H VAL 85 -2.891 -9.533 3.237 683 HA VAL 85 HA VAL 85 -0.643 -7.715 3.511 684 HB VAL 85 HB VAL 85 -2.161 -5.710 3.164 685 HG11 VAL 85 HG11 VAL 85 -1.928 -5.752 0.708 686 HG12 VAL 85 HG12 VAL 85 -0.459 -6.379 1.531 687 HG13 VAL 85 HG13 VAL 85 -1.618 -7.520 0.770 688 HG21 VAL 85 HG21 VAL 85 -4.154 -6.036 1.752 689 HG22 VAL 85 HG22 VAL 85 -3.934 -7.816 1.857 690 HG23 VAL 85 HG23 VAL 85 -4.311 -6.869 3.336 691 H GLU 86 H GLU 86 -0.608 -6.608 5.534 692 HA GLU 86 HA GLU 86 -2.959 -7.029 7.229 693 HB2 GLU 86 HB2 GLU 86 -1.382 -7.514 9.141 694 HB3 GLU 86 HB3 GLU 86 -1.518 -8.795 7.929 695 HG2 GLU 86 HG2 GLU 86 0.677 -6.850 7.422 696 HG3 GLU 86 HG3 GLU 86 0.845 -7.771 8.923 697 H VAL 87 H VAL 87 -3.503 -5.246 8.502 698 HA VAL 87 HA VAL 87 -1.805 -2.889 8.117 699 HB VAL 87 HB VAL 87 -4.157 -2.631 7.650 700 HG11 VAL 87 HG11 VAL 87 -5.892 -2.851 9.400 701 HG12 VAL 87 HG12 VAL 87 -5.098 -4.415 9.018 702 HG13 VAL 87 HG13 VAL 87 -4.662 -3.530 10.518 703 HG21 VAL 87 HG21 VAL 87 -4.685 -0.741 9.168 704 HG22 VAL 87 HG22 VAL 87 -3.365 -1.270 10.265 705 HG23 VAL 87 HG23 VAL 87 -2.981 -0.710 8.602 706 H LEU 88 H LEU 88 -0.119 -2.792 9.652 707 HA LEU 88 HA LEU 88 -0.399 -4.128 12.178 708 HB2 LEU 88 HB2 LEU 88 1.677 -2.129 11.148 709 HB3 LEU 88 HB3 LEU 88 1.836 -3.138 12.592 710 HG LEU 88 HG LEU 88 1.667 -4.175 9.730 711 HD11 LEU 88 HD11 LEU 88 4.065 -4.717 10.029 712 HD12 LEU 88 HD12 LEU 88 3.756 -2.951 10.148 713 HD13 LEU 88 HD13 LEU 88 4.040 -3.915 11.636 714 HD21 LEU 88 HD21 LEU 88 2.345 -6.335 10.730 715 HD22 LEU 88 HD22 LEU 88 2.247 -5.602 12.367 716 HD23 LEU 88 HD23 LEU 88 0.764 -5.768 11.367 717 H ASP 89 H ASP 89 -0.126 -0.623 11.082 718 HA ASP 89 HA ASP 89 -1.818 0.049 13.340 719 HB2 ASP 89 HB2 ASP 89 0.518 0.170 14.229 720 HB3 ASP 89 HB3 ASP 89 0.926 1.335 12.963 721 H THR 90 H THR 90 -3.090 1.881 12.971 722 HA THR 90 HA THR 90 -2.431 3.578 10.708 723 HB THR 90 HB THR 90 -3.740 1.616 9.800 724 HG1 THR 90 HG1 THR 90 -4.635 2.987 8.380 725 HG21 THR 90 HG21 THR 90 -6.181 1.552 10.243 726 HG22 THR 90 HG22 THR 90 -5.218 1.205 11.718 727 HG23 THR 90 HG23 THR 90 -5.977 2.818 11.501 728 H ASP 91 H ASP 91 -3.080 5.707 11.138 729 HA ASP 91 HA ASP 91 -4.506 6.087 13.666 730 HB2 ASP 91 HB2 ASP 91 -2.308 7.260 13.092 731 HB3 ASP 91 HB3 ASP 91 -3.195 8.160 11.855 732 H TYR 92 H TYR 92 -6.620 6.904 13.749 733 HA TYR 92 HA TYR 92 -8.159 6.798 11.413 734 HB2 TYR 92 HB2 TYR 92 -8.625 7.929 14.194 735 HB3 TYR 92 HB3 TYR 92 -9.853 8.044 12.926 736 HD1 TYR 92 HD1 TYR 92 -10.474 5.782 11.716 737 HD2 TYR 92 HD2 TYR 92 -8.538 5.977 15.548 738 HE1 TYR 92 HE1 TYR 92 -11.212 3.472 12.202 739 HE2 TYR 92 HE2 TYR 92 -9.265 3.653 16.030 740 HH TYR 92 HH TYR 92 -11.202 1.788 13.626 741 H LYS 93 H LYS 93 -6.351 9.504 12.899 742 HA LYS 93 HA LYS 93 -7.182 11.099 10.601 743 HB2 LYS 93 HB2 LYS 93 -7.042 12.064 13.458 744 HB3 LYS 93 HB3 LYS 93 -7.038 13.140 12.054 745 HG2 LYS 93 HG2 LYS 93 -9.201 12.154 11.291 746 HG3 LYS 93 HG3 LYS 93 -9.205 11.076 12.693 747 HD2 LYS 93 HD2 LYS 93 -9.245 13.012 14.224 748 HD3 LYS 93 HD3 LYS 93 -9.133 14.128 12.856 749 HE2 LYS 93 HE2 LYS 93 -11.410 12.126 13.273 750 HE3 LYS 93 HE3 LYS 93 -11.473 13.824 13.761 751 HZ1 LYS 93 HZ1 LYS 93 -12.469 13.658 11.664 752 HZ2 LYS 93 HZ2 LYS 93 -11.016 14.346 11.379 753 HZ3 LYS 93 HZ3 LYS 93 -11.257 12.771 11.023 754 H SER 94 H SER 94 -4.741 9.402 10.726 755 HA SER 94 HA SER 94 -2.912 11.594 10.081 756 HB2 SER 94 HB2 SER 94 -2.692 11.219 12.598 757 HB3 SER 94 HB3 SER 94 -2.413 9.497 12.308 758 HG SER 94 HG SER 94 -0.358 10.003 12.170 759 H TYR 95 H TYR 95 -0.624 9.523 10.460 760 HA TYR 95 HA TYR 95 -0.916 8.423 7.822 761 HB2 TYR 95 HB2 TYR 95 1.415 7.675 8.182 762 HB3 TYR 95 HB3 TYR 95 1.229 9.386 8.588 763 HD1 TYR 95 HD1 TYR 95 1.737 5.985 9.961 764 HD2 TYR 95 HD2 TYR 95 1.434 10.167 10.887 765 HE1 TYR 95 HE1 TYR 95 2.641 5.547 12.224 766 HE2 TYR 95 HE2 TYR 95 2.346 9.737 13.145 767 HH TYR 95 HH TYR 95 2.648 6.531 14.429 768 H ALA 96 H ALA 96 -0.110 6.054 7.467 769 HA ALA 96 HA ALA 96 -0.899 4.274 9.623 770 HB1 ALA 96 HB1 ALA 96 -2.408 2.990 8.155 771 HB2 ALA 96 HB2 ALA 96 -3.007 4.652 8.479 772 HB3 ALA 96 HB3 ALA 96 -2.249 4.262 6.898 773 H VAL 97 H VAL 97 0.020 2.136 9.478 774 HA VAL 97 HA VAL 97 1.962 1.931 7.277 775 HB VAL 97 HB VAL 97 3.296 0.458 8.817 776 HG11 VAL 97 HG11 VAL 97 4.267 2.348 10.085 777 HG12 VAL 97 HG12 VAL 97 3.907 2.796 8.384 778 HG13 VAL 97 HG13 VAL 97 2.819 3.340 9.705 779 HG21 VAL 97 HG21 VAL 97 2.903 0.650 11.244 780 HG22 VAL 97 HG22 VAL 97 1.394 1.570 10.924 781 HG23 VAL 97 HG23 VAL 97 1.530 -0.143 10.400 782 H ILE 98 H ILE 98 1.667 0.176 5.903 783 HA ILE 98 HA ILE 98 -0.054 -1.987 6.917 784 HB ILE 98 HB ILE 98 0.201 -0.964 4.047 785 HG12 ILE 98 HG12 ILE 98 -0.961 0.683 5.422 786 HG13 ILE 98 HG13 ILE 98 -2.095 -0.112 4.323 787 HG21 ILE 98 HG21 ILE 98 -1.734 -2.448 3.602 788 HG22 ILE 98 HG22 ILE 98 -0.298 -3.364 4.173 789 HG23 ILE 98 HG23 ILE 98 -1.660 -3.039 5.297 790 HD11 ILE 98 HD11 ILE 98 -3.083 0.183 6.551 791 HD12 ILE 98 HD12 ILE 98 -2.891 -1.562 6.171 792 HD13 ILE 98 HD13 ILE 98 -1.738 -0.754 7.287 793 H TYR 99 H TYR 99 0.785 -4.090 6.729 794 HA TYR 99 HA TYR 99 3.444 -4.275 5.486 795 HB2 TYR 99 HB2 TYR 99 3.115 -4.902 7.914 796 HB3 TYR 99 HB3 TYR 99 2.009 -6.181 7.396 797 HD1 TYR 99 HD1 TYR 99 5.540 -5.051 7.403 798 HD2 TYR 99 HD2 TYR 99 2.847 -8.227 6.351 799 HE1 TYR 99 HE1 TYR 99 7.463 -6.572 7.077 800 HE2 TYR 99 HE2 TYR 99 4.771 -9.755 6.030 801 HH TYR 99 HH TYR 99 7.188 -9.594 5.492 802 H ALA 100 H ALA 100 3.757 -5.399 3.653 803 HA ALA 100 HA ALA 100 1.522 -7.022 2.649 804 HB1 ALA 100 HB1 ALA 100 2.391 -6.509 0.389 805 HB2 ALA 100 HB2 ALA 100 1.896 -5.035 1.287 806 HB3 ALA 100 HB3 ALA 100 3.637 -5.443 1.121 807 H THR 101 H THR 101 2.018 -8.893 1.394 808 HA THR 101 HA THR 101 4.635 -9.993 1.618 809 HB THR 101 HB THR 101 2.430 -11.597 2.930 810 HG1 THR 101 HG1 THR 101 4.598 -9.946 4.006 811 HG21 THR 101 HG21 THR 101 4.409 -12.940 3.634 812 HG22 THR 101 HG22 THR 101 4.317 -12.836 1.843 813 HG23 THR 101 HG23 THR 101 5.491 -11.818 2.742 814 H ARG 102 H ARG 102 5.012 -11.891 0.154 815 HA ARG 102 HA ARG 102 2.666 -12.711 -1.353 816 HB2 ARG 102 HB2 ARG 102 4.094 -12.422 -3.515 817 HB3 ARG 102 HB3 ARG 102 3.140 -11.076 -2.878 818 HG2 ARG 102 HG2 ARG 102 5.891 -11.188 -1.790 819 HG3 ARG 102 HG3 ARG 102 5.830 -10.994 -3.547 820 HD2 ARG 102 HD2 ARG 102 4.746 -9.185 -1.378 821 HD3 ARG 102 HD3 ARG 102 5.697 -8.771 -2.810 822 HE ARG 102 HE ARG 102 2.955 -8.490 -2.713 823 HH11 ARG 102 HH11 ARG 102 5.320 -9.875 -4.868 824 HH12 ARG 102 HH12 ARG 102 4.185 -10.203 -6.134 825 HH21 ARG 102 HH21 ARG 102 1.391 -9.155 -4.307 826 HH22 ARG 102 HH22 ARG 102 1.955 -9.795 -5.815 827 H VAL 103 H VAL 103 2.936 -14.835 -2.341 828 HA VAL 103 HA VAL 103 5.526 -16.054 -1.617 829 HB VAL 103 HB VAL 103 2.762 -17.363 -1.726 830 HG11 VAL 103 HG11 VAL 103 3.892 -19.315 -0.702 831 HG12 VAL 103 HG12 VAL 103 4.560 -18.916 -2.321 832 HG13 VAL 103 HG13 VAL 103 5.468 -18.464 -0.838 833 HG21 VAL 103 HG21 VAL 103 2.961 -17.560 0.732 834 HG22 VAL 103 HG22 VAL 103 4.482 -16.607 0.676 835 HG23 VAL 103 HG23 VAL 103 2.929 -15.849 0.188 836 H LYS 104 H LYS 104 6.669 -16.489 -3.487 837 HA LYS 104 HA LYS 104 5.118 -17.291 -5.881 838 HB2 LYS 104 HB2 LYS 104 6.692 -15.085 -5.663 839 HB3 LYS 104 HB3 LYS 104 7.921 -16.282 -6.094 840 HG2 LYS 104 HG2 LYS 104 5.351 -16.058 -7.704 841 HG3 LYS 104 HG3 LYS 104 6.695 -14.944 -7.988 842 HD2 LYS 104 HD2 LYS 104 8.212 -16.792 -8.507 843 HD3 LYS 104 HD3 LYS 104 7.008 -17.988 -8.010 844 HE2 LYS 104 HE2 LYS 104 6.489 -15.989 -10.264 845 HE3 LYS 104 HE3 LYS 104 7.269 -17.550 -10.550 846 HZ1 LYS 104 HZ1 LYS 104 4.963 -17.786 -10.904 847 HZ2 LYS 104 HZ2 LYS 104 5.285 -18.572 -9.511 848 HZ3 LYS 104 HZ3 LYS 104 4.563 -17.108 -9.474 849 H ASP 105 H ASP 105 6.153 -19.045 -7.143 850 HA ASP 105 HA ASP 105 6.817 -21.242 -5.808 851 HB2 ASP 105 HB2 ASP 105 8.170 -20.420 -8.436 852 HB3 ASP 105 HB3 ASP 105 7.850 -22.068 -7.881 853 H GLY 106 H GLY 106 8.164 -21.137 -3.985 854 HA2 GLY 106 HA2 GLY 106 10.198 -21.629 -3.102 855 HA3 GLY 106 HA3 GLY 106 10.976 -21.244 -4.643 856 H ARG 107 H ARG 107 9.306 -18.404 -4.420 857 HA ARG 107 HA ARG 107 11.136 -17.342 -2.340 858 HB2 ARG 107 HB2 ARG 107 12.067 -16.978 -4.632 859 HB3 ARG 107 HB3 ARG 107 10.505 -16.371 -5.197 860 HG2 ARG 107 HG2 ARG 107 10.744 -14.362 -3.764 861 HG3 ARG 107 HG3 ARG 107 12.279 -14.975 -3.134 862 HD2 ARG 107 HD2 ARG 107 11.774 -14.502 -6.122 863 HD3 ARG 107 HD3 ARG 107 12.435 -13.257 -5.054 864 HE ARG 107 HE ARG 107 14.318 -14.928 -4.600 865 HH11 ARG 107 HH11 ARG 107 12.478 -14.995 -7.593 866 HH12 ARG 107 HH12 ARG 107 13.765 -15.703 -8.511 867 HH21 ARG 107 HH21 ARG 107 15.998 -15.854 -5.814 868 HH22 ARG 107 HH22 ARG 107 15.769 -16.192 -7.498 869 H THR 108 H THR 108 10.117 -16.218 -0.849 870 HA THR 108 HA THR 108 7.437 -15.169 -1.427 871 HB THR 108 HB THR 108 7.647 -14.906 1.237 872 HG1 THR 108 HG1 THR 108 8.849 -16.765 2.067 873 HG21 THR 108 HG21 THR 108 6.543 -17.116 1.443 874 HG22 THR 108 HG22 THR 108 5.931 -16.202 0.023 875 HG23 THR 108 HG23 THR 108 7.099 -17.546 -0.210 876 H LEU 109 H LEU 109 7.173 -12.872 -1.475 877 HA LEU 109 HA LEU 109 9.621 -11.400 -0.824 878 HB2 LEU 109 HB2 LEU 109 8.619 -11.226 -3.123 879 HB3 LEU 109 HB3 LEU 109 7.155 -10.544 -2.403 880 HG LEU 109 HG LEU 109 8.498 -8.632 -1.528 881 HD11 LEU 109 HD11 LEU 109 10.774 -8.263 -2.421 882 HD12 LEU 109 HD12 LEU 109 10.685 -9.733 -1.393 883 HD13 LEU 109 HD13 LEU 109 10.733 -9.890 -3.181 884 HD21 LEU 109 HD21 LEU 109 8.813 -7.531 -3.718 885 HD22 LEU 109 HD22 LEU 109 8.685 -9.127 -4.532 886 HD23 LEU 109 HD23 LEU 109 7.275 -8.456 -3.645 887 H HIS 110 H HIS 110 9.527 -9.357 0.311 888 HA HIS 110 HA HIS 110 7.151 -9.095 2.063 889 HB2 HIS 110 HB2 HIS 110 10.119 -8.880 2.746 890 HB3 HIS 110 HB3 HIS 110 8.811 -8.330 3.801 891 HD2 HIS 110 HD2 HIS 110 9.982 -11.810 2.221 892 HE1 HIS 110 HE1 HIS 110 7.910 -12.510 5.898 893 H MET 111 H MET 111 6.400 -6.951 2.189 894 HA MET 111 HA MET 111 8.156 -4.784 1.412 895 HB2 MET 111 HB2 MET 111 7.248 -5.697 -0.746 896 HB3 MET 111 HB3 MET 111 5.608 -5.404 -0.150 897 HG2 MET 111 HG2 MET 111 6.105 -2.966 0.005 898 HG3 MET 111 HG3 MET 111 7.740 -3.264 -0.602 899 HE1 MET 111 HE1 MET 111 7.961 -3.346 -3.817 900 HE2 MET 111 HE2 MET 111 8.264 -4.536 -2.506 901 HE3 MET 111 HE3 MET 111 7.210 -4.975 -3.893 902 H MET 112 H MET 112 7.708 -3.000 2.679 903 HA MET 112 HA MET 112 5.065 -3.010 4.015 904 HB2 MET 112 HB2 MET 112 7.113 -3.315 5.458 905 HB3 MET 112 HB3 MET 112 7.687 -1.735 4.911 906 HG2 MET 112 HG2 MET 112 5.796 -0.606 5.938 907 HG3 MET 112 HG3 MET 112 5.000 -2.143 6.299 908 HE1 MET 112 HE1 MET 112 9.180 -1.285 7.818 909 HE2 MET 112 HE2 MET 112 8.375 -0.586 6.373 910 HE3 MET 112 HE3 MET 112 8.219 0.225 7.968 911 H ARG 113 H ARG 113 3.945 -0.918 4.171 912 HA ARG 113 HA ARG 113 5.157 1.293 2.725 913 HB2 ARG 113 HB2 ARG 113 2.544 -0.044 1.872 914 HB3 ARG 113 HB3 ARG 113 3.050 1.567 1.345 915 HG2 ARG 113 HG2 ARG 113 5.062 0.616 0.267 916 HG3 ARG 113 HG3 ARG 113 4.645 -0.998 0.859 917 HD2 ARG 113 HD2 ARG 113 2.928 0.687 -1.039 918 HD3 ARG 113 HD3 ARG 113 3.994 -0.636 -1.532 919 HE ARG 113 HE ARG 113 1.350 -0.875 -0.356 920 HH11 ARG 113 HH11 ARG 113 4.444 -2.500 -0.716 921 HH12 ARG 113 HH12 ARG 113 3.778 -4.083 -0.486 922 HH21 ARG 113 HH21 ARG 113 0.492 -2.941 0.005 923 HH22 ARG 113 HH22 ARG 113 1.515 -4.336 -0.073 924 H LEU 114 H LEU 114 4.032 3.345 3.065 925 HA LEU 114 HA LEU 114 2.143 3.287 5.341 926 HB2 LEU 114 HB2 LEU 114 4.482 3.867 6.037 927 HB3 LEU 114 HB3 LEU 114 4.458 5.217 4.894 928 HG LEU 114 HG LEU 114 2.455 4.950 7.168 929 HD11 LEU 114 HD11 LEU 114 3.873 6.561 8.410 930 HD12 LEU 114 HD12 LEU 114 4.723 5.007 8.115 931 HD13 LEU 114 HD13 LEU 114 5.118 6.449 7.120 932 HD21 LEU 114 HD21 LEU 114 2.190 7.387 6.822 933 HD22 LEU 114 HD22 LEU 114 3.362 7.316 5.463 934 HD23 LEU 114 HD23 LEU 114 1.793 6.450 5.342 935 H TYR 115 H TYR 115 0.277 4.462 4.877 936 HA TYR 115 HA TYR 115 0.460 6.221 2.526 937 HB2 TYR 115 HB2 TYR 115 -1.905 5.761 2.152 938 HB3 TYR 115 HB3 TYR 115 -0.989 4.249 2.199 939 HD1 TYR 115 HD1 TYR 115 -3.452 6.355 3.999 940 HD2 TYR 115 HD2 TYR 115 -1.368 2.600 3.971 941 HE1 TYR 115 HE1 TYR 115 -5.026 5.471 5.691 942 HE2 TYR 115 HE2 TYR 115 -2.940 1.713 5.666 943 HH TYR 115 HH TYR 115 -4.871 2.059 6.764 944 H SER 116 H SER 116 -0.950 8.139 2.496 945 HA SER 116 HA SER 116 -1.383 9.210 5.219 946 HB2 SER 116 HB2 SER 116 -0.564 10.784 2.725 947 HB3 SER 116 HB3 SER 116 -0.661 11.375 4.389 948 HG SER 116 HG SER 116 1.534 10.891 3.677 949 H ARG 117 H ARG 117 -3.241 10.782 5.311 950 HA ARG 117 HA ARG 117 -5.464 9.855 3.873 951 HB2 ARG 117 HB2 ARG 117 -4.794 12.160 5.708 952 HB3 ARG 117 HB3 ARG 117 -6.268 12.302 4.740 953 HG2 ARG 117 HG2 ARG 117 -7.098 10.149 5.697 954 HG3 ARG 117 HG3 ARG 117 -5.629 10.020 6.673 955 HD2 ARG 117 HD2 ARG 117 -7.446 10.952 8.035 956 HD3 ARG 117 HD3 ARG 117 -6.181 12.169 7.815 957 HE ARG 117 HE ARG 117 -7.625 13.380 6.326 958 HH11 ARG 117 HH11 ARG 117 -9.184 10.548 7.724 959 HH12 ARG 117 HH12 ARG 117 -10.784 11.107 7.369 960 HH21 ARG 117 HH21 ARG 117 -9.734 14.101 5.888 961 HH22 ARG 117 HH22 ARG 117 -11.096 13.126 6.326 962 H SER 118 H SER 118 -3.102 12.513 3.252 963 HA SER 118 HA SER 118 -4.562 13.037 0.730 964 HB2 SER 118 HB2 SER 118 -2.789 15.059 2.152 965 HB3 SER 118 HB3 SER 118 -4.027 15.341 0.921 966 HG SER 118 HG SER 118 -4.753 15.928 3.060 967 HA PRO 119 HA PRO 119 -0.664 12.091 -1.252 968 HB2 PRO 119 HB2 PRO 119 -0.598 13.927 -3.324 969 HB3 PRO 119 HB3 PRO 119 -1.781 12.612 -3.333 970 HG2 PRO 119 HG2 PRO 119 -2.141 15.501 -2.492 971 HG3 PRO 119 HG3 PRO 119 -3.207 14.487 -3.473 972 HD2 PRO 119 HD2 PRO 119 -3.685 14.936 -0.813 973 HD3 PRO 119 HD3 PRO 119 -4.144 13.420 -1.598 974 H GLU 120 H GLU 120 0.012 13.169 1.032 975 HA GLU 120 HA GLU 120 2.149 15.010 0.291 976 HB2 GLU 120 HB2 GLU 120 1.628 16.428 2.258 977 HB3 GLU 120 HB3 GLU 120 0.249 16.402 1.152 978 HG2 GLU 120 HG2 GLU 120 -0.807 14.612 2.588 979 HG3 GLU 120 HG3 GLU 120 0.538 14.777 3.724 980 H VAL 121 H VAL 121 3.636 15.349 2.092 981 HA VAL 121 HA VAL 121 4.397 12.886 3.268 982 HB VAL 121 HB VAL 121 6.452 15.055 3.460 983 HG11 VAL 121 HG11 VAL 121 7.833 13.016 3.063 984 HG12 VAL 121 HG12 VAL 121 6.689 12.739 4.420 985 HG13 VAL 121 HG13 VAL 121 6.344 12.047 2.799 986 HG21 VAL 121 HG21 VAL 121 7.119 14.564 1.130 987 HG22 VAL 121 HG22 VAL 121 5.662 13.538 0.912 988 HG23 VAL 121 HG23 VAL 121 5.485 15.307 1.172 989 H SER 122 H SER 122 4.850 12.491 5.423 990 HA SER 122 HA SER 122 4.310 14.856 7.062 991 HB2 SER 122 HB2 SER 122 3.504 13.066 8.834 992 HB3 SER 122 HB3 SER 122 2.441 13.835 7.648 993 HG SER 122 HG SER 122 2.233 11.559 7.535 994 HA PRO 123 HA PRO 123 8.403 14.239 8.826 995 HB2 PRO 123 HB2 PRO 123 7.962 15.730 11.252 996 HB3 PRO 123 HB3 PRO 123 8.687 16.407 9.787 997 HG2 PRO 123 HG2 PRO 123 5.839 16.559 10.758 998 HG3 PRO 123 HG3 PRO 123 6.799 17.775 9.906 999 HD2 PRO 123 HD2 PRO 123 4.878 16.380 8.576 1000 HD3 PRO 123 HD3 PRO 123 6.392 16.784 7.758 1001 H ALA 124 H ALA 124 5.546 14.329 11.169 1002 HA ALA 124 HA ALA 124 6.664 12.593 13.031 1003 HB1 ALA 124 HB1 ALA 124 4.272 12.229 13.703 1004 HB2 ALA 124 HB2 ALA 124 4.613 13.964 13.386 1005 HB3 ALA 124 HB3 ALA 124 3.739 12.982 12.161 1006 H ALA 125 H ALA 125 4.444 11.757 10.229 1007 HA ALA 125 HA ALA 125 4.404 9.015 10.737 1008 HB1 ALA 125 HB1 ALA 125 3.778 8.817 8.359 1009 HB2 ALA 125 HB2 ALA 125 2.886 10.144 9.176 1010 HB3 ALA 125 HB3 ALA 125 4.264 10.525 8.090 1011 H THR 126 H THR 126 6.659 11.031 8.690 1012 HA THR 126 HA THR 126 8.129 8.953 7.633 1013 HB THR 126 HB THR 126 9.055 11.739 8.546 1014 HG1 THR 126 HG1 THR 126 7.639 12.281 7.008 1015 HG21 THR 126 HG21 THR 126 10.806 11.503 6.813 1016 HG22 THR 126 HG22 THR 126 10.953 10.246 8.088 1017 HG23 THR 126 HG23 THR 126 10.253 9.825 6.489 1018 H ALA 127 H ALA 127 8.908 10.915 10.671 1019 HA ALA 127 HA ALA 127 11.155 9.416 11.342 1020 HB1 ALA 127 HB1 ALA 127 10.808 10.357 13.611 1021 HB2 ALA 127 HB2 ALA 127 10.617 11.601 12.329 1022 HB3 ALA 127 HB3 ALA 127 9.167 10.901 13.125 1023 H ILE 128 H ILE 128 7.653 8.935 12.281 1024 HA ILE 128 HA ILE 128 8.114 6.873 14.082 1025 HB ILE 128 HB ILE 128 5.786 7.480 12.208 1026 HG12 ILE 128 HG12 ILE 128 6.261 9.134 13.987 1027 HG13 ILE 128 HG13 ILE 128 4.703 8.328 14.218 1028 HG21 ILE 128 HG21 ILE 128 4.437 5.912 13.559 1029 HG22 ILE 128 HG22 ILE 128 5.764 5.079 12.681 1030 HG23 ILE 128 HG23 ILE 128 5.918 5.406 14.440 1031 HD11 ILE 128 HD11 ILE 128 5.897 8.574 16.350 1032 HD12 ILE 128 HD12 ILE 128 5.711 6.839 15.925 1033 HD13 ILE 128 HD13 ILE 128 7.293 7.657 15.691 1034 H PHE 129 H PHE 129 7.278 6.675 10.506 1035 HA PHE 129 HA PHE 129 7.417 3.924 10.266 1036 HB2 PHE 129 HB2 PHE 129 6.639 5.687 8.579 1037 HB3 PHE 129 HB3 PHE 129 8.344 5.969 8.199 1038 HD1 PHE 129 HD1 PHE 129 5.543 3.577 7.964 1039 HD2 PHE 129 HD2 PHE 129 9.653 4.328 6.971 1040 HE1 PHE 129 HE1 PHE 129 5.488 1.710 6.339 1041 HE2 PHE 129 HE2 PHE 129 9.606 2.455 5.352 1042 HZ PHE 129 HZ PHE 129 7.521 1.144 5.027 1043 H ARG 130 H ARG 130 10.099 6.402 10.032 1044 HA ARG 130 HA ARG 130 12.083 4.610 9.244 1045 HB2 ARG 130 HB2 ARG 130 12.297 7.078 9.181 1046 HB3 ARG 130 HB3 ARG 130 12.275 7.141 10.948 1047 HG2 ARG 130 HG2 ARG 130 14.361 5.637 10.911 1048 HG3 ARG 130 HG3 ARG 130 14.422 5.904 9.163 1049 HD2 ARG 130 HD2 ARG 130 14.406 8.144 11.246 1050 HD3 ARG 130 HD3 ARG 130 15.872 7.473 10.520 1051 HE ARG 130 HE ARG 130 14.412 8.191 8.318 1052 HH11 ARG 130 HH11 ARG 130 15.257 9.914 11.266 1053 HH12 ARG 130 HH12 ARG 130 15.290 11.465 10.495 1054 HH21 ARG 130 HH21 ARG 130 14.471 10.229 7.315 1055 HH22 ARG 130 HH22 ARG 130 14.842 11.643 8.243 1056 H LYS 131 H LYS 131 11.145 5.732 12.621 1057 HA LYS 131 HA LYS 131 13.046 4.300 14.032 1058 HB2 LYS 131 HB2 LYS 131 10.123 4.790 14.777 1059 HB3 LYS 131 HB3 LYS 131 11.437 4.402 15.895 1060 HG2 LYS 131 HG2 LYS 131 12.498 6.523 15.566 1061 HG3 LYS 131 HG3 LYS 131 11.548 6.872 14.116 1062 HD2 LYS 131 HD2 LYS 131 9.453 6.790 15.641 1063 HD3 LYS 131 HD3 LYS 131 10.570 6.789 17.012 1064 HE2 LYS 131 HE2 LYS 131 11.603 8.911 16.160 1065 HE3 LYS 131 HE3 LYS 131 10.464 8.915 14.808 1066 HZ1 LYS 131 HZ1 LYS 131 9.820 10.294 16.744 1067 HZ2 LYS 131 HZ2 LYS 131 8.678 9.214 16.302 1068 HZ3 LYS 131 HZ3 LYS 131 9.596 8.937 17.624 1069 H LEU 132 H LEU 132 9.665 3.276 13.108 1070 HA LEU 132 HA LEU 132 9.799 0.675 14.089 1071 HB2 LEU 132 HB2 LEU 132 8.368 1.728 11.613 1072 HB3 LEU 132 HB3 LEU 132 8.024 0.204 12.441 1073 HG LEU 132 HG LEU 132 7.697 2.975 13.672 1074 HD11 LEU 132 HD11 LEU 132 5.272 2.547 13.440 1075 HD12 LEU 132 HD12 LEU 132 6.101 2.593 11.848 1076 HD13 LEU 132 HD13 LEU 132 5.630 1.018 12.570 1077 HD21 LEU 132 HD21 LEU 132 6.472 1.774 15.450 1078 HD22 LEU 132 HD22 LEU 132 6.879 0.209 14.667 1079 HD23 LEU 132 HD23 LEU 132 8.184 1.244 15.339 1080 H ALA 133 H ALA 133 10.768 2.096 10.883 1081 HA ALA 133 HA ALA 133 11.406 -0.262 9.586 1082 HB1 ALA 133 HB1 ALA 133 12.823 1.187 8.159 1083 HB2 ALA 133 HB2 ALA 133 11.211 1.914 8.471 1084 HB3 ALA 133 HB3 ALA 133 12.653 2.516 9.355 1085 H GLY 134 H GLY 134 13.584 1.862 11.684 1086 HA2 GLY 134 HA2 GLY 134 15.849 0.223 11.227 1087 HA3 GLY 134 HA3 GLY 134 15.625 1.416 12.513 1088 H GLU 135 H GLU 135 13.116 0.086 13.603 1089 HA GLU 135 HA GLU 135 14.243 -1.478 15.578 1090 HB2 GLU 135 HB2 GLU 135 11.944 -0.526 15.579 1091 HB3 GLU 135 HB3 GLU 135 11.474 -1.620 14.272 1092 HG2 GLU 135 HG2 GLU 135 12.426 -3.394 16.179 1093 HG3 GLU 135 HG3 GLU 135 11.726 -2.121 17.186 1094 H ARG 136 H ARG 136 12.945 -2.447 12.302 1095 HA ARG 136 HA ARG 136 13.695 -5.188 12.881 1096 HB2 ARG 136 HB2 ARG 136 12.354 -3.831 10.496 1097 HB3 ARG 136 HB3 ARG 136 12.778 -5.548 10.520 1098 HG2 ARG 136 HG2 ARG 136 10.604 -5.716 11.229 1099 HG3 ARG 136 HG3 ARG 136 11.379 -5.514 12.806 1100 HD2 ARG 136 HD2 ARG 136 10.330 -3.537 13.165 1101 HD3 ARG 136 HD3 ARG 136 10.851 -2.898 11.600 1102 HE ARG 136 HE ARG 136 8.840 -3.719 10.603 1103 HH11 ARG 136 HH11 ARG 136 8.969 -4.290 14.071 1104 HH12 ARG 136 HH12 ARG 136 7.289 -4.692 14.189 1105 HH21 ARG 136 HH21 ARG 136 6.638 -4.268 10.777 1106 HH22 ARG 136 HH22 ARG 136 5.964 -4.680 12.319 1107 H ASN 137 H ASN 137 15.827 -2.900 12.497 1108 HA ASN 137 HA ASN 137 17.802 -2.686 11.568 1109 HB2 ASN 137 HB2 ASN 137 17.445 -5.677 11.121 1110 HB3 ASN 137 HB3 ASN 137 18.942 -4.823 10.725 1111 HD21 ASN 137 HD21 ASN 137 19.044 -2.973 12.913 1112 HD22 ASN 137 HD22 ASN 137 19.315 -3.875 14.367 1113 H TYR 138 H TYR 138 15.794 -1.708 9.883 1114 HA TYR 138 HA TYR 138 16.104 -2.801 7.263 1115 HB2 TYR 138 HB2 TYR 138 14.477 -1.274 6.666 1116 HB3 TYR 138 HB3 TYR 138 14.170 -1.347 8.407 1117 HD1 TYR 138 HD1 TYR 138 15.966 0.407 9.724 1118 HD2 TYR 138 HD2 TYR 138 14.295 0.867 5.793 1119 HE1 TYR 138 HE1 TYR 138 16.286 2.857 9.875 1120 HE2 TYR 138 HE2 TYR 138 14.613 3.317 5.943 1121 HH TYR 138 HH TYR 138 15.324 5.017 7.158 1122 H THR 139 H THR 139 16.830 -1.383 5.359 1123 HA THR 139 HA THR 139 19.282 0.053 6.138 1124 HB THR 139 HB THR 139 19.784 -0.550 3.580 1125 HG1 THR 139 HG1 THR 139 18.885 -2.690 3.111 1126 HG21 THR 139 HG21 THR 139 20.944 -2.602 4.344 1127 HG22 THR 139 HG22 THR 139 21.142 -1.255 5.516 1128 HG23 THR 139 HG23 THR 139 19.980 -2.581 5.859 1129 H ASP 140 H ASP 140 19.873 1.927 4.725 1130 HA ASP 140 HA ASP 140 17.827 3.736 4.405 1131 HB2 ASP 140 HB2 ASP 140 20.059 4.549 4.529 1132 HB3 ASP 140 HB3 ASP 140 20.623 3.489 3.231 1133 H GLU 141 H GLU 141 19.191 1.533 1.916 1134 HA GLU 141 HA GLU 141 17.500 2.586 -0.120 1135 HB2 GLU 141 HB2 GLU 141 19.428 0.300 -0.213 1136 HB3 GLU 141 HB3 GLU 141 18.402 0.809 -1.560 1137 HG2 GLU 141 HG2 GLU 141 19.378 3.188 -1.177 1138 HG3 GLU 141 HG3 GLU 141 20.586 2.399 -0.155 1139 H MET 142 H MET 142 16.807 0.500 2.470 1140 HA MET 142 HA MET 142 15.144 -1.322 0.983 1141 HB2 MET 142 HB2 MET 142 16.334 -1.983 3.058 1142 HB3 MET 142 HB3 MET 142 15.513 -0.706 3.965 1143 HG2 MET 142 HG2 MET 142 13.306 -1.857 3.411 1144 HG3 MET 142 HG3 MET 142 14.246 -3.192 2.732 1145 HE1 MET 142 HE1 MET 142 15.878 -4.965 5.567 1146 HE2 MET 142 HE2 MET 142 16.034 -4.380 3.877 1147 HE3 MET 142 HE3 MET 142 16.805 -3.467 5.218 1148 H VAL 143 H VAL 143 14.706 1.798 2.727 1149 HA VAL 143 HA VAL 143 11.834 1.528 2.122 1150 HB VAL 143 HB VAL 143 13.240 3.164 4.281 1151 HG11 VAL 143 HG11 VAL 143 10.963 3.822 4.991 1152 HG12 VAL 143 HG12 VAL 143 11.349 4.411 3.339 1153 HG13 VAL 143 HG13 VAL 143 10.280 2.985 3.557 1154 HG21 VAL 143 HG21 VAL 143 11.941 1.730 5.830 1155 HG22 VAL 143 HG22 VAL 143 11.306 0.804 4.429 1156 HG23 VAL 143 HG23 VAL 143 13.061 0.770 4.806 1157 H ALA 144 H ALA 144 10.967 3.033 0.679 1158 HA ALA 144 HA ALA 144 12.797 5.160 -0.239 1159 HB1 ALA 144 HB1 ALA 144 11.452 5.067 -2.315 1160 HB2 ALA 144 HB2 ALA 144 12.189 3.473 -1.937 1161 HB3 ALA 144 HB3 ALA 144 10.447 3.758 -1.606 1162 H MET 145 H MET 145 12.132 7.252 -0.210 1163 HA MET 145 HA MET 145 9.516 7.782 1.009 1164 HB2 MET 145 HB2 MET 145 12.116 9.361 1.125 1165 HB3 MET 145 HB3 MET 145 10.564 9.940 1.747 1166 HG2 MET 145 HG2 MET 145 10.477 7.868 3.224 1167 HG3 MET 145 HG3 MET 145 12.121 7.491 2.694 1168 HE1 MET 145 HE1 MET 145 10.990 11.378 4.969 1169 HE2 MET 145 HE2 MET 145 10.433 10.970 3.311 1170 HE3 MET 145 HE3 MET 145 9.834 10.027 4.718 1171 H LEU 146 H LEU 146 8.046 9.225 0.023 1172 HA LEU 146 HA LEU 146 9.031 10.285 -2.542 1173 HB2 LEU 146 HB2 LEU 146 6.195 9.566 -1.687 1174 HB3 LEU 146 HB3 LEU 146 6.664 10.245 -3.251 1175 HG LEU 146 HG LEU 146 6.311 7.934 -3.605 1176 HD11 LEU 146 HD11 LEU 146 8.537 7.088 -4.272 1177 HD12 LEU 146 HD12 LEU 146 8.307 8.811 -4.723 1178 HD13 LEU 146 HD13 LEU 146 9.314 8.382 -3.299 1179 HD21 LEU 146 HD21 LEU 146 7.404 6.152 -2.295 1180 HD22 LEU 146 HD22 LEU 146 8.123 7.394 -1.216 1181 HD23 LEU 146 HD23 LEU 146 6.341 7.184 -1.280 1182 HA PRO 147 HA PRO 147 8.123 14.181 -0.362 1183 HB2 PRO 147 HB2 PRO 147 9.858 15.704 -1.863 1184 HB3 PRO 147 HB3 PRO 147 10.522 14.592 -0.659 1185 HG2 PRO 147 HG2 PRO 147 10.283 14.242 -3.658 1186 HG3 PRO 147 HG3 PRO 147 11.631 13.825 -2.592 1187 HD2 PRO 147 HD2 PRO 147 9.762 11.978 -3.495 1188 HD3 PRO 147 HD3 PRO 147 10.697 11.771 -2.009 1189 H ARG 148 H ARG 148 7.940 16.520 -1.584 1190 HA ARG 148 HA ARG 148 5.463 16.634 -2.737 1191 HB2 ARG 148 HB2 ARG 148 5.647 18.936 -2.970 1192 HB3 ARG 148 HB3 ARG 148 6.557 18.486 -1.521 1193 HG2 ARG 148 HG2 ARG 148 7.874 18.912 -4.238 1194 HG3 ARG 148 HG3 ARG 148 7.647 20.212 -3.062 1195 HD2 ARG 148 HD2 ARG 148 9.125 17.587 -2.533 1196 HD3 ARG 148 HD3 ARG 148 9.896 19.139 -2.887 1197 HE ARG 148 HE ARG 148 8.104 18.836 -0.512 1198 HH11 ARG 148 HH11 ARG 148 11.208 19.674 -1.930 1199 HH12 ARG 148 HH12 ARG 148 11.853 20.303 -0.450 1200 HH21 ARG 148 HH21 ARG 148 8.962 19.667 1.423 1201 HH22 ARG 148 HH22 ARG 148 10.574 20.299 1.458 1202 H GLN 149 H GLN 149 5.941 14.818 -4.214 1203 HA GLN 149 HA GLN 149 6.341 15.916 -6.774 1204 HB2 GLN 149 HB2 GLN 149 8.218 14.384 -5.958 1205 HB3 GLN 149 HB3 GLN 149 7.142 13.089 -6.501 1206 HG2 GLN 149 HG2 GLN 149 7.044 14.285 -8.782 1207 HG3 GLN 149 HG3 GLN 149 8.342 15.332 -8.194 1208 HE21 GLN 149 HE21 GLN 149 9.485 13.301 -6.405 1209 HE22 GLN 149 HE22 GLN 149 10.269 12.115 -7.395 1210 H GLU 150 H GLU 150 3.437 15.608 -5.570 1211 HA GLU 150 HA GLU 150 2.994 13.459 -7.544 1212 HB2 GLU 150 HB2 GLU 150 0.611 14.477 -6.356 1213 HB3 GLU 150 HB3 GLU 150 1.542 13.141 -5.666 1214 HG2 GLU 150 HG2 GLU 150 0.956 14.783 -3.922 1215 HG3 GLU 150 HG3 GLU 150 2.710 14.687 -4.119 1216 H GLU 151 H GLU 151 2.668 13.714 -9.378 1217 HA GLU 151 HA GLU 151 1.354 16.193 -10.307 1218 HB2 GLU 151 HB2 GLU 151 3.747 15.786 -11.036 1219 HB3 GLU 151 HB3 GLU 151 3.188 14.331 -11.872 1220 HG2 GLU 151 HG2 GLU 151 1.502 15.911 -13.088 1221 HG3 GLU 151 HG3 GLU 151 2.496 17.236 -12.469 1222 H CYS 152 H CYS 152 1.161 12.769 -9.829 1223 HA CYS 152 HA CYS 152 -1.161 12.714 -11.648 1224 HB2 CYS 152 HB2 CYS 152 0.687 11.331 -12.496 1225 HB3 CYS 152 HB3 CYS 152 0.810 10.501 -10.939 1226 H THR 153 H THR 153 -3.057 11.703 -10.789 1227 HA THR 153 HA THR 153 -2.858 10.694 -8.065 1228 HB THR 153 HB THR 153 -5.106 12.096 -7.709 1229 HG1 THR 153 HG1 THR 153 -4.893 14.201 -8.759 1230 HG21 THR 153 HG21 THR 153 -3.776 13.896 -6.652 1231 HG22 THR 153 HG22 THR 153 -3.082 12.274 -6.318 1232 HG23 THR 153 HG23 THR 153 -2.320 13.341 -7.545 1233 H VAL 154 H VAL 154 -4.865 9.402 -7.435 1234 HA VAL 154 HA VAL 154 -6.129 8.383 -9.895 1235 HB VAL 154 HB VAL 154 -4.955 6.776 -8.446 1236 HG11 VAL 154 HG11 VAL 154 -5.802 6.223 -6.181 1237 HG12 VAL 154 HG12 VAL 154 -5.141 7.890 -6.286 1238 HG13 VAL 154 HG13 VAL 154 -6.918 7.627 -6.273 1239 HG21 VAL 154 HG21 VAL 154 -6.784 5.137 -8.120 1240 HG22 VAL 154 HG22 VAL 154 -7.984 6.449 -8.374 1241 HG23 VAL 154 HG23 VAL 154 -6.876 5.975 -9.706 1242 H ASP 155 H ASP 155 -8.347 8.630 -10.213 1243 HA ASP 155 HA ASP 155 -9.703 10.551 -8.639 1244 HB2 ASP 155 HB2 ASP 155 -10.073 10.215 -11.077 1245 HB3 ASP 155 HB3 ASP 155 -10.748 8.612 -10.757 1246 H GLU 156 H GLU 156 -11.675 10.288 -7.384 1247 HA GLU 156 HA GLU 156 -11.649 7.723 -5.987 1248 HB2 GLU 156 HB2 GLU 156 -13.058 9.006 -4.310 1249 HB3 GLU 156 HB3 GLU 156 -11.365 9.491 -4.469 1250 HG2 GLU 156 HG2 GLU 156 -12.290 11.296 -6.147 1251 HG3 GLU 156 HG3 GLU 156 -13.855 10.949 -5.400 1252 H VAL 157 H VAL 157 -14.099 10.070 -7.385 1253 HA VAL 157 HA VAL 157 -15.581 7.880 -8.415 1254 HB VAL 157 HB VAL 157 -16.261 7.679 -6.055 1255 HG11 VAL 157 HG11 VAL 157 -17.588 9.452 -4.963 1256 HG12 VAL 157 HG12 VAL 157 -15.906 9.976 -5.313 1257 HG13 VAL 157 HG13 VAL 157 -17.258 10.544 -6.351 1258 HG21 VAL 157 HG21 VAL 157 -18.709 7.804 -6.396 1259 HG22 VAL 157 HG22 VAL 157 -18.444 8.790 -7.874 1260 HG23 VAL 157 HG23 VAL 157 -17.860 7.092 -7.809 1261 HN1 EB4 158 HN1 EB4 158 3.818 -5.479 -7.270 1262 H8 EB4 158 H8 EB4 158 -2.144 -6.731 -4.494 1263 HN2 EB4 158 HN2 EB4 158 1.072 -4.658 -8.695 1264 H9 EB4 158 H9 EB4 158 0.306 -0.602 -2.865 1265 H10 EB4 158 H10 EB4 158 5.223 -7.167 -1.741 1266 HN3 EB4 158 HN3 EB4 158 3.309 -2.330 -7.548 1267 H7 EB4 158 H7 EB4 158 3.222 -5.729 -1.434 1268 H11 EB4 158 H11 EB4 158 -3.525 -7.419 -6.438 1269 H12 EB4 158 H12 EB4 158 1.582 1.472 -3.328 1270 H15 EB4 158 H15 EB4 158 3.077 1.585 -5.302 1271 H14 EB4 158 H14 EB4 158 -2.786 -6.867 -8.740 1272 H13 EB4 158 H13 EB4 158 6.038 -7.668 -4.026 1273 H22 EB4 158 H22 EB4 158 4.764 -6.082 -7.745 1274 H30 EB4 158 H30 EB4 158 5.896 -2.508 -10.152 1275 H30A EB4 158 H30A EB4 158 6.153 -2.046 -8.394 1276 H24 EB4 158 H24 EB4 158 3.779 -1.455 -8.261 1277 H28 EB4 158 H28 EB4 158 3.873 -7.812 -9.394 1278 H28A EB4 158 H28A EB4 158 4.553 -6.746 -10.718 1279 H23 EB4 158 H23 EB4 158 0.789 -4.890 -9.870 1280 H29 EB4 158 H29 EB4 158 0.393 -2.787 -10.862 1281 H29A EB4 158 H29A EB4 158 1.867 -3.074 -11.988 Start of MODEL 16 1 H1 MET 1 H1 MET 1 -28.975 3.964 -4.779 2 H2 MET 1 H2 MET 1 -28.153 3.241 -3.568 3 H3 MET 1 H3 MET 1 -28.174 4.870 -3.682 4 HA MET 1 HA MET 1 -26.479 2.982 -4.937 5 HB2 MET 1 HB2 MET 1 -27.926 5.076 -6.622 6 HB3 MET 1 HB3 MET 1 -26.386 4.348 -7.099 7 HG2 MET 1 HG2 MET 1 -27.400 2.118 -7.169 8 HG3 MET 1 HG3 MET 1 -28.923 2.748 -6.528 9 HE1 MET 1 HE1 MET 1 -29.886 1.908 -10.249 10 HE2 MET 1 HE2 MET 1 -28.779 0.994 -9.170 11 HE3 MET 1 HE3 MET 1 -30.301 1.689 -8.516 12 H THR 2 H THR 2 -24.375 3.729 -4.600 13 HA THR 2 HA THR 2 -22.756 5.016 -3.798 14 HB THR 2 HB THR 2 -24.092 7.363 -5.219 15 HG1 THR 2 HG1 THR 2 -23.050 6.496 -7.164 16 HG21 THR 2 HG21 THR 2 -21.744 7.941 -5.753 17 HG22 THR 2 HG22 THR 2 -21.999 7.799 -3.981 18 HG23 THR 2 HG23 THR 2 -21.185 6.474 -4.880 19 H VAL 3 H VAL 3 -24.851 4.675 -1.899 20 HA VAL 3 HA VAL 3 -25.555 7.244 -0.851 21 HB VAL 3 HB VAL 3 -26.489 5.907 1.055 22 HG11 VAL 3 HG11 VAL 3 -28.274 4.811 -0.268 23 HG12 VAL 3 HG12 VAL 3 -27.861 6.437 -0.911 24 HG13 VAL 3 HG13 VAL 3 -27.264 4.963 -1.745 25 HG21 VAL 3 HG21 VAL 3 -26.566 3.444 0.863 26 HG22 VAL 3 HG22 VAL 3 -25.477 3.526 -0.562 27 HG23 VAL 3 HG23 VAL 3 -24.888 4.054 1.050 28 HA PRO 4 HA PRO 4 -21.945 7.681 1.750 29 HB2 PRO 4 HB2 PRO 4 -22.917 9.604 3.482 30 HB3 PRO 4 HB3 PRO 4 -22.651 10.017 1.783 31 HG2 PRO 4 HG2 PRO 4 -25.232 9.267 3.186 32 HG3 PRO 4 HG3 PRO 4 -24.937 10.558 2.014 33 HD2 PRO 4 HD2 PRO 4 -26.060 8.142 1.309 34 HD3 PRO 4 HD3 PRO 4 -25.108 9.114 0.179 35 H ASP 5 H ASP 5 -23.123 5.267 2.331 36 HA ASP 5 HA ASP 5 -23.517 5.394 5.244 37 HB2 ASP 5 HB2 ASP 5 -24.305 3.353 3.125 38 HB3 ASP 5 HB3 ASP 5 -24.301 2.964 4.850 39 H ARG 6 H ARG 6 -22.532 2.393 3.567 40 HA ARG 6 HA ARG 6 -20.469 1.920 5.377 41 HB2 ARG 6 HB2 ARG 6 -21.524 0.738 2.853 42 HB3 ARG 6 HB3 ARG 6 -19.809 0.417 3.142 43 HG2 ARG 6 HG2 ARG 6 -21.157 -1.395 4.061 44 HG3 ARG 6 HG3 ARG 6 -20.349 -0.529 5.374 45 HD2 ARG 6 HD2 ARG 6 -22.610 -0.902 6.091 46 HD3 ARG 6 HD3 ARG 6 -22.479 0.819 5.708 47 HE ARG 6 HE ARG 6 -23.981 0.528 3.949 48 HH11 ARG 6 HH11 ARG 6 -22.879 -2.626 5.055 49 HH12 ARG 6 HH12 ARG 6 -24.046 -3.496 4.115 50 HH21 ARG 6 HH21 ARG 6 -25.517 -0.629 2.741 51 HH22 ARG 6 HH22 ARG 6 -25.546 -2.360 2.800 52 H SER 7 H SER 7 -20.496 3.881 2.421 53 HA SER 7 HA SER 7 -17.908 3.708 1.546 54 HB2 SER 7 HB2 SER 7 -19.320 6.394 1.865 55 HB3 SER 7 HB3 SER 7 -18.365 5.802 0.500 56 HG SER 7 HG SER 7 -21.058 5.604 0.915 57 H GLU 8 H GLU 8 -19.089 5.421 4.503 58 HA GLU 8 HA GLU 8 -16.807 6.945 4.945 59 HB2 GLU 8 HB2 GLU 8 -18.745 5.720 6.954 60 HB3 GLU 8 HB3 GLU 8 -17.558 6.978 7.322 61 HG2 GLU 8 HG2 GLU 8 -18.697 8.425 5.541 62 HG3 GLU 8 HG3 GLU 8 -19.967 7.197 5.459 63 H ILE 9 H ILE 9 -17.333 3.445 5.379 64 HA ILE 9 HA ILE 9 -15.185 3.160 7.239 65 HB ILE 9 HB ILE 9 -16.590 1.052 5.503 66 HG12 ILE 9 HG12 ILE 9 -17.224 1.950 8.354 67 HG13 ILE 9 HG13 ILE 9 -18.141 2.437 6.922 68 HG21 ILE 9 HG21 ILE 9 -15.860 -0.525 7.264 69 HG22 ILE 9 HG22 ILE 9 -14.466 0.279 6.468 70 HG23 ILE 9 HG23 ILE 9 -14.998 0.812 8.098 71 HD11 ILE 9 HD11 ILE 9 -19.258 0.599 8.104 72 HD12 ILE 9 HD12 ILE 9 -18.723 0.071 6.472 73 HD13 ILE 9 HD13 ILE 9 -17.792 -0.424 7.926 74 H ALA 10 H ALA 10 -15.327 3.534 3.743 75 HA ALA 10 HA ALA 10 -12.540 2.562 3.601 76 HB1 ALA 10 HB1 ALA 10 -13.040 1.792 1.299 77 HB2 ALA 10 HB2 ALA 10 -14.027 0.922 2.521 78 HB3 ALA 10 HB3 ALA 10 -14.767 2.227 1.533 79 H GLY 11 H GLY 11 -12.024 3.399 0.922 80 HA2 GLY 11 HA2 GLY 11 -12.842 5.732 -0.037 81 HA3 GLY 11 HA3 GLY 11 -11.949 6.275 1.390 82 H LYS 12 H LYS 12 -10.402 7.374 -0.010 83 HA LYS 12 HA LYS 12 -8.647 5.525 -1.488 84 HB2 LYS 12 HB2 LYS 12 -7.915 7.560 -2.711 85 HB3 LYS 12 HB3 LYS 12 -9.633 7.201 -2.933 86 HG2 LYS 12 HG2 LYS 12 -10.207 8.949 -1.233 87 HG3 LYS 12 HG3 LYS 12 -8.488 9.320 -1.046 88 HD2 LYS 12 HD2 LYS 12 -8.310 10.031 -3.376 89 HD3 LYS 12 HD3 LYS 12 -9.940 9.449 -3.736 90 HE2 LYS 12 HE2 LYS 12 -10.115 11.828 -3.463 91 HE3 LYS 12 HE3 LYS 12 -10.836 11.103 -2.020 92 HZ1 LYS 12 HZ1 LYS 12 -9.235 12.993 -1.692 93 HZ2 LYS 12 HZ2 LYS 12 -8.981 11.674 -0.764 94 HZ3 LYS 12 HZ3 LYS 12 -8.026 11.958 -2.058 95 H TRP 13 H TRP 13 -6.371 5.659 -1.177 96 HA TRP 13 HA TRP 13 -5.498 7.328 1.095 97 HB2 TRP 13 HB2 TRP 13 -4.630 4.452 0.562 98 HB3 TRP 13 HB3 TRP 13 -4.185 5.475 1.934 99 HD1 TRP 13 HD1 TRP 13 -6.443 2.711 1.157 100 HE1 TRP 13 HE1 TRP 13 -8.394 2.554 2.849 101 HE3 TRP 13 HE3 TRP 13 -6.013 7.355 3.315 102 HZ2 TRP 13 HZ2 TRP 13 -9.595 4.161 4.819 103 HZ3 TRP 13 HZ3 TRP 13 -7.610 7.978 5.110 104 HH2 TRP 13 HH2 TRP 13 -9.373 6.404 5.849 105 H TYR 14 H TYR 14 -3.248 8.025 0.913 106 HA TYR 14 HA TYR 14 -2.178 7.634 -1.816 107 HB2 TYR 14 HB2 TYR 14 -1.754 9.955 0.136 108 HB3 TYR 14 HB3 TYR 14 -1.126 9.842 -1.513 109 HD1 TYR 14 HD1 TYR 14 -4.350 9.916 0.424 110 HD2 TYR 14 HD2 TYR 14 -2.402 10.667 -3.330 111 HE1 TYR 14 HE1 TYR 14 -6.416 10.971 -0.433 112 HE2 TYR 14 HE2 TYR 14 -4.470 11.722 -4.192 113 HH TYR 14 HH TYR 14 -6.775 11.855 -3.825 114 H VAL 15 H VAL 15 -0.220 6.466 -1.938 115 HA VAL 15 HA VAL 15 1.064 6.075 0.660 116 HB VAL 15 HB VAL 15 1.196 4.039 -0.050 117 HG11 VAL 15 HG11 VAL 15 0.730 3.227 -2.358 118 HG12 VAL 15 HG12 VAL 15 -0.537 4.331 -1.724 119 HG13 VAL 15 HG13 VAL 15 0.664 4.933 -2.916 120 HG21 VAL 15 HG21 VAL 15 3.001 3.352 -1.614 121 HG22 VAL 15 HG22 VAL 15 3.205 5.071 -2.093 122 HG23 VAL 15 HG23 VAL 15 3.531 4.565 -0.401 123 H VAL 16 H VAL 16 2.827 7.099 1.261 124 HA VAL 16 HA VAL 16 4.379 8.546 -0.772 125 HB VAL 16 HB VAL 16 4.832 10.232 0.967 126 HG11 VAL 16 HG11 VAL 16 2.576 11.259 1.132 127 HG12 VAL 16 HG12 VAL 16 2.913 10.612 -0.509 128 HG13 VAL 16 HG13 VAL 16 1.844 9.704 0.612 129 HG21 VAL 16 HG21 VAL 16 3.584 10.249 3.112 130 HG22 VAL 16 HG22 VAL 16 2.913 8.630 2.720 131 HG23 VAL 16 HG23 VAL 16 4.680 8.833 2.970 132 H ALA 17 H ALA 17 4.466 5.807 1.071 133 HA ALA 17 HA ALA 17 7.357 5.992 1.412 134 HB1 ALA 17 HB1 ALA 17 7.206 5.010 3.673 135 HB2 ALA 17 HB2 ALA 17 6.465 6.645 3.602 136 HB3 ALA 17 HB3 ALA 17 5.420 5.185 3.627 137 H LEU 18 H LEU 18 8.383 3.883 1.433 138 HA LEU 18 HA LEU 18 6.678 1.583 1.053 139 HB2 LEU 18 HB2 LEU 18 8.575 2.601 -1.117 140 HB3 LEU 18 HB3 LEU 18 7.808 1.008 -1.112 141 HG LEU 18 HG LEU 18 5.776 3.051 -0.814 142 HD11 LEU 18 HD11 LEU 18 6.025 4.151 -3.011 143 HD12 LEU 18 HD12 LEU 18 7.372 4.558 -1.895 144 HD13 LEU 18 HD13 LEU 18 7.628 3.367 -3.216 145 HD21 LEU 18 HD21 LEU 18 4.885 1.978 -2.854 146 HD22 LEU 18 HD22 LEU 18 6.429 1.082 -3.049 147 HD23 LEU 18 HD23 LEU 18 5.386 0.773 -1.620 148 H ALA 19 H ALA 19 7.853 -0.458 1.214 149 HA ALA 19 HA ALA 19 10.736 -0.253 1.758 150 HB1 ALA 19 HB1 ALA 19 10.480 -1.611 3.784 151 HB2 ALA 19 HB2 ALA 19 9.656 -0.025 3.956 152 HB3 ALA 19 HB3 ALA 19 8.693 -1.508 3.640 153 H SER 20 H SER 20 11.765 -2.128 0.864 154 HA SER 20 HA SER 20 10.023 -4.401 0.226 155 HB2 SER 20 HB2 SER 20 11.912 -3.137 -1.833 156 HB3 SER 20 HB3 SER 20 10.749 -4.443 -2.098 157 HG SER 20 HG SER 20 10.290 -1.923 -2.549 158 H ASN 21 H ASN 21 11.175 -6.433 -0.032 159 HA ASN 21 HA ASN 21 13.881 -6.335 1.187 160 HB2 ASN 21 HB2 ASN 21 11.849 -7.642 2.162 161 HB3 ASN 21 HB3 ASN 21 11.975 -8.696 0.747 162 HD21 ASN 21 HD21 ASN 21 14.132 -9.725 0.384 163 HD22 ASN 21 HD22 ASN 21 15.029 -10.238 1.774 164 H THR 22 H THR 22 12.977 -5.877 -1.747 165 HA THR 22 HA THR 22 15.002 -7.725 -2.834 166 HB THR 22 HB THR 22 13.587 -7.232 -5.093 167 HG1 THR 22 HG1 THR 22 11.427 -7.032 -4.423 168 HG21 THR 22 HG21 THR 22 12.627 -9.437 -4.547 169 HG22 THR 22 HG22 THR 22 14.324 -9.375 -3.962 170 HG23 THR 22 HG23 THR 22 12.966 -9.184 -2.802 171 H GLU 23 H GLU 23 16.950 -7.144 -3.977 172 HA GLU 23 HA GLU 23 17.607 -4.408 -3.647 173 HB2 GLU 23 HB2 GLU 23 18.650 -5.779 -6.118 174 HB3 GLU 23 HB3 GLU 23 19.544 -4.952 -4.836 175 HG2 GLU 23 HG2 GLU 23 18.336 -7.738 -4.606 176 HG3 GLU 23 HG3 GLU 23 20.027 -7.388 -4.986 177 H PHE 24 H PHE 24 16.348 -6.216 -6.640 178 HA PHE 24 HA PHE 24 16.368 -4.078 -8.391 179 HB2 PHE 24 HB2 PHE 24 14.454 -6.473 -8.147 180 HB3 PHE 24 HB3 PHE 24 14.509 -5.407 -9.558 181 HD1 PHE 24 HD1 PHE 24 16.558 -5.322 -10.974 182 HD2 PHE 24 HD2 PHE 24 16.080 -8.201 -7.826 183 HE1 PHE 24 HE1 PHE 24 18.355 -6.701 -11.968 184 HE2 PHE 24 HE2 PHE 24 17.872 -9.590 -8.820 185 HZ PHE 24 HZ PHE 24 19.014 -8.841 -10.896 186 H PHE 25 H PHE 25 13.522 -5.217 -6.347 187 HA PHE 25 HA PHE 25 11.779 -3.251 -7.233 188 HB2 PHE 25 HB2 PHE 25 11.998 -4.813 -4.637 189 HB3 PHE 25 HB3 PHE 25 10.715 -3.623 -4.895 190 HD1 PHE 25 HD1 PHE 25 12.097 -6.873 -5.993 191 HD2 PHE 25 HD2 PHE 25 8.919 -4.027 -6.474 192 HE1 PHE 25 HE1 PHE 25 10.773 -8.565 -7.222 193 HE2 PHE 25 HE2 PHE 25 7.590 -5.716 -7.704 194 HZ PHE 25 HZ PHE 25 8.512 -7.990 -8.078 195 H LEU 26 H LEU 26 14.109 -3.128 -4.427 196 HA LEU 26 HA LEU 26 13.309 -0.593 -3.523 197 HB2 LEU 26 HB2 LEU 26 16.053 -1.937 -3.463 198 HB3 LEU 26 HB3 LEU 26 15.551 -0.566 -2.464 199 HG LEU 26 HG LEU 26 14.335 -3.363 -2.363 200 HD11 LEU 26 HD11 LEU 26 15.472 -3.532 -0.179 201 HD12 LEU 26 HD12 LEU 26 16.638 -3.327 -1.529 202 HD13 LEU 26 HD13 LEU 26 16.246 -1.937 -0.462 203 HD21 LEU 26 HD21 LEU 26 13.216 -2.541 -0.320 204 HD22 LEU 26 HD22 LEU 26 13.894 -0.904 -0.613 205 HD23 LEU 26 HD23 LEU 26 12.722 -1.612 -1.775 206 H ARG 27 H ARG 27 15.901 -1.639 -5.848 207 HA ARG 27 HA ARG 27 16.969 0.879 -6.342 208 HB2 ARG 27 HB2 ARG 27 17.773 -1.502 -7.019 209 HB3 ARG 27 HB3 ARG 27 16.685 -1.346 -8.405 210 HG2 ARG 27 HG2 ARG 27 17.934 0.909 -8.868 211 HG3 ARG 27 HG3 ARG 27 19.158 0.298 -7.747 212 HD2 ARG 27 HD2 ARG 27 19.916 -0.416 -9.878 213 HD3 ARG 27 HD3 ARG 27 19.185 -1.863 -9.170 214 HE ARG 27 HE ARG 27 17.108 -0.698 -10.577 215 HH11 ARG 27 HH11 ARG 27 20.351 -1.784 -11.395 216 HH12 ARG 27 HH12 ARG 27 19.947 -2.124 -13.044 217 HH21 ARG 27 HH21 ARG 27 16.595 -1.131 -12.732 218 HH22 ARG 27 HH22 ARG 27 17.803 -1.751 -13.807 219 H GLU 28 H GLU 28 14.249 -0.898 -8.032 220 HA GLU 28 HA GLU 28 13.885 1.229 -9.892 221 HB2 GLU 28 HB2 GLU 28 11.922 -0.978 -9.156 222 HB3 GLU 28 HB3 GLU 28 11.960 -0.018 -10.641 223 HG2 GLU 28 HG2 GLU 28 13.933 -2.161 -9.748 224 HG3 GLU 28 HG3 GLU 28 12.851 -2.194 -11.146 225 H LYS 29 H LYS 29 11.981 0.130 -6.931 226 HA LYS 29 HA LYS 29 10.000 1.999 -7.077 227 HB2 LYS 29 HB2 LYS 29 11.138 0.218 -5.090 228 HB3 LYS 29 HB3 LYS 29 10.765 1.768 -4.324 229 HG2 LYS 29 HG2 LYS 29 8.777 0.149 -5.989 230 HG3 LYS 29 HG3 LYS 29 8.901 0.071 -4.227 231 HD2 LYS 29 HD2 LYS 29 7.235 1.672 -4.420 232 HD3 LYS 29 HD3 LYS 29 8.652 2.730 -4.399 233 HE2 LYS 29 HE2 LYS 29 8.647 2.902 -6.841 234 HE3 LYS 29 HE3 LYS 29 7.386 1.670 -6.976 235 HZ1 LYS 29 HZ1 LYS 29 6.118 3.508 -7.056 236 HZ2 LYS 29 HZ2 LYS 29 6.162 3.407 -5.427 237 HZ3 LYS 29 HZ3 LYS 29 7.148 4.449 -6.207 238 H ASP 30 H ASP 30 13.208 2.440 -5.336 239 HA ASP 30 HA ASP 30 12.695 5.039 -4.487 240 HB2 ASP 30 HB2 ASP 30 14.571 3.951 -3.537 241 HB3 ASP 30 HB3 ASP 30 15.202 3.438 -5.107 242 H LYS 31 H LYS 31 14.122 3.785 -7.584 243 HA LYS 31 HA LYS 31 14.750 6.374 -8.479 244 HB2 LYS 31 HB2 LYS 31 15.234 3.705 -9.283 245 HB3 LYS 31 HB3 LYS 31 14.241 4.370 -10.587 246 HG2 LYS 31 HG2 LYS 31 16.958 5.345 -9.610 247 HG3 LYS 31 HG3 LYS 31 16.530 4.719 -11.208 248 HD2 LYS 31 HD2 LYS 31 16.639 7.060 -11.536 249 HD3 LYS 31 HD3 LYS 31 14.905 6.742 -11.388 250 HE2 LYS 31 HE2 LYS 31 15.599 7.136 -8.736 251 HE3 LYS 31 HE3 LYS 31 16.748 8.209 -9.546 252 HZ1 LYS 31 HZ1 LYS 31 14.711 9.346 -9.069 253 HZ2 LYS 31 HZ2 LYS 31 14.865 9.221 -10.690 254 HZ3 LYS 31 HZ3 LYS 31 13.819 8.254 -9.892 255 H MET 32 H MET 32 11.622 4.435 -8.635 256 HA MET 32 HA MET 32 10.839 6.195 -10.796 257 HB2 MET 32 HB2 MET 32 9.283 4.217 -8.990 258 HB3 MET 32 HB3 MET 32 8.628 4.951 -10.460 259 HG2 MET 32 HG2 MET 32 11.004 3.037 -10.350 260 HG3 MET 32 HG3 MET 32 9.348 2.596 -10.787 261 HE1 MET 32 HE1 MET 32 11.735 2.708 -14.101 262 HE2 MET 32 HE2 MET 32 12.355 2.516 -12.426 263 HE3 MET 32 HE3 MET 32 10.905 1.599 -12.957 264 H LYS 33 H LYS 33 8.570 5.642 -7.978 265 HA LYS 33 HA LYS 33 8.708 8.321 -7.077 266 HB2 LYS 33 HB2 LYS 33 6.426 7.767 -9.002 267 HB3 LYS 33 HB3 LYS 33 6.562 9.168 -7.932 268 HG2 LYS 33 HG2 LYS 33 8.807 9.683 -9.125 269 HG3 LYS 33 HG3 LYS 33 8.344 8.458 -10.314 270 HD2 LYS 33 HD2 LYS 33 6.280 9.743 -10.859 271 HD3 LYS 33 HD3 LYS 33 6.701 10.956 -9.643 272 HE2 LYS 33 HE2 LYS 33 8.915 11.304 -10.892 273 HE3 LYS 33 HE3 LYS 33 8.285 10.255 -12.169 274 HZ1 LYS 33 HZ1 LYS 33 7.890 12.564 -12.646 275 HZ2 LYS 33 HZ2 LYS 33 6.459 11.804 -12.445 276 HZ3 LYS 33 HZ3 LYS 33 7.042 12.772 -11.267 277 H MET 34 H MET 34 6.219 8.756 -6.311 278 HA MET 34 HA MET 34 5.761 7.313 -3.974 279 HB2 MET 34 HB2 MET 34 4.971 9.802 -4.933 280 HB3 MET 34 HB3 MET 34 3.500 8.893 -4.563 281 HG2 MET 34 HG2 MET 34 4.420 8.332 -2.293 282 HG3 MET 34 HG3 MET 34 5.866 9.247 -2.666 283 HE1 MET 34 HE1 MET 34 1.636 11.115 -2.504 284 HE2 MET 34 HE2 MET 34 2.159 9.804 -3.615 285 HE3 MET 34 HE3 MET 34 1.990 9.477 -1.857 286 H ALA 35 H ALA 35 3.025 6.951 -3.711 287 HA ALA 35 HA ALA 35 2.201 5.294 -5.998 288 HB1 ALA 35 HB1 ALA 35 1.835 3.316 -4.590 289 HB2 ALA 35 HB2 ALA 35 3.573 3.757 -4.701 290 HB3 ALA 35 HB3 ALA 35 2.640 4.146 -3.216 291 H MET 36 H MET 36 -0.150 4.515 -5.746 292 HA MET 36 HA MET 36 -1.545 6.196 -3.756 293 HB2 MET 36 HB2 MET 36 -2.462 5.652 -6.643 294 HB3 MET 36 HB3 MET 36 -3.366 6.563 -5.426 295 HG2 MET 36 HG2 MET 36 -0.647 7.392 -6.525 296 HG3 MET 36 HG3 MET 36 -2.198 7.967 -7.150 297 HE1 MET 36 HE1 MET 36 -0.512 10.955 -5.094 298 HE2 MET 36 HE2 MET 36 0.532 9.543 -5.473 299 HE3 MET 36 HE3 MET 36 -0.626 10.159 -6.700 300 H ALA 37 H ALA 37 -3.701 5.218 -3.087 301 HA ALA 37 HA ALA 37 -4.414 2.681 -4.239 302 HB1 ALA 37 HB1 ALA 37 -4.170 1.473 -2.054 303 HB2 ALA 37 HB2 ALA 37 -2.576 2.037 -2.660 304 HB3 ALA 37 HB3 ALA 37 -3.403 2.932 -1.341 305 H ARG 38 H ARG 38 -6.564 2.531 -4.166 306 HA ARG 38 HA ARG 38 -8.049 3.969 -2.023 307 HB2 ARG 38 HB2 ARG 38 -8.325 5.235 -4.016 308 HB3 ARG 38 HB3 ARG 38 -8.501 3.784 -5.012 309 HG2 ARG 38 HG2 ARG 38 -10.569 3.699 -3.014 310 HG3 ARG 38 HG3 ARG 38 -10.543 5.338 -3.679 311 HD2 ARG 38 HD2 ARG 38 -10.613 4.376 -6.005 312 HD3 ARG 38 HD3 ARG 38 -10.689 2.748 -5.316 313 HE ARG 38 HE ARG 38 -12.875 3.356 -4.334 314 HH11 ARG 38 HH11 ARG 38 -11.629 5.412 -6.903 315 HH12 ARG 38 HH12 ARG 38 -13.187 6.051 -7.308 316 HH21 ARG 38 HH21 ARG 38 -14.901 4.220 -4.865 317 HH22 ARG 38 HH22 ARG 38 -15.045 5.373 -6.150 318 H ILE 39 H ILE 39 -9.509 2.526 -0.989 319 HA ILE 39 HA ILE 39 -9.518 -0.168 -2.106 320 HB ILE 39 HB ILE 39 -10.183 0.630 0.768 321 HG12 ILE 39 HG12 ILE 39 -7.894 1.312 0.364 322 HG13 ILE 39 HG13 ILE 39 -7.920 -0.124 1.396 323 HG21 ILE 39 HG21 ILE 39 -9.746 -1.764 1.228 324 HG22 ILE 39 HG22 ILE 39 -11.083 -1.533 0.050 325 HG23 ILE 39 HG23 ILE 39 -9.457 -2.038 -0.524 326 HD11 ILE 39 HD11 ILE 39 -6.127 -0.263 -0.266 327 HD12 ILE 39 HD12 ILE 39 -7.350 -1.548 -0.546 328 HD13 ILE 39 HD13 ILE 39 -7.323 -0.090 -1.594 329 H SER 40 H SER 40 -11.343 -1.395 -2.213 330 HA SER 40 HA SER 40 -13.938 -0.059 -2.029 331 HB2 SER 40 HB2 SER 40 -13.403 -2.212 -4.102 332 HB3 SER 40 HB3 SER 40 -14.680 -0.990 -4.058 333 HG SER 40 HG SER 40 -13.256 -0.051 -5.428 334 H PHE 41 H PHE 41 -15.787 -1.461 -1.751 335 HA PHE 41 HA PHE 41 -15.008 -4.024 -0.606 336 HB2 PHE 41 HB2 PHE 41 -16.965 -3.814 0.961 337 HB3 PHE 41 HB3 PHE 41 -15.501 -2.880 1.294 338 HD1 PHE 41 HD1 PHE 41 -15.391 -0.471 0.351 339 HD2 PHE 41 HD2 PHE 41 -18.911 -2.866 0.711 340 HE1 PHE 41 HE1 PHE 41 -16.792 1.580 0.164 341 HE2 PHE 41 HE2 PHE 41 -20.316 -0.874 0.494 342 HZ PHE 41 HZ PHE 41 -19.274 1.356 0.220 343 H LEU 42 H LEU 42 -15.455 -5.984 -1.830 344 HA LEU 42 HA LEU 42 -17.875 -5.549 -3.423 345 HB2 LEU 42 HB2 LEU 42 -15.820 -7.731 -3.265 346 HB3 LEU 42 HB3 LEU 42 -17.422 -8.125 -3.900 347 HG LEU 42 HG LEU 42 -15.803 -7.611 -5.673 348 HD11 LEU 42 HD11 LEU 42 -17.178 -5.979 -6.915 349 HD12 LEU 42 HD12 LEU 42 -18.182 -7.200 -6.063 350 HD13 LEU 42 HD13 LEU 42 -18.023 -5.542 -5.392 351 HD21 LEU 42 HD21 LEU 42 -14.994 -5.305 -6.004 352 HD22 LEU 42 HD22 LEU 42 -15.726 -4.829 -4.434 353 HD23 LEU 42 HD23 LEU 42 -14.385 -6.023 -4.475 354 H GLY 43 H GLY 43 -16.807 -7.991 -0.958 355 HA2 GLY 43 HA2 GLY 43 -19.579 -7.994 0.048 356 HA3 GLY 43 HA3 GLY 43 -18.772 -9.513 -0.363 357 H GLU 44 H GLU 44 -19.636 -9.020 2.302 358 HA GLU 44 HA GLU 44 -17.889 -7.735 3.966 359 HB2 GLU 44 HB2 GLU 44 -19.223 -10.383 4.656 360 HB3 GLU 44 HB3 GLU 44 -18.788 -9.065 5.752 361 HG2 GLU 44 HG2 GLU 44 -21.000 -8.558 5.585 362 HG3 GLU 44 HG3 GLU 44 -20.484 -7.706 4.124 363 H ASP 45 H ASP 45 -17.438 -10.819 2.262 364 HA ASP 45 HA ASP 45 -15.003 -11.301 3.819 365 HB2 ASP 45 HB2 ASP 45 -16.582 -13.138 3.915 366 HB3 ASP 45 HB3 ASP 45 -16.745 -13.159 2.154 367 H GLU 46 H GLU 46 -15.856 -9.742 0.934 368 HA GLU 46 HA GLU 46 -13.073 -9.925 0.124 369 HB2 GLU 46 HB2 GLU 46 -14.117 -11.924 -0.948 370 HB3 GLU 46 HB3 GLU 46 -15.472 -10.943 -1.521 371 HG2 GLU 46 HG2 GLU 46 -13.817 -9.675 -3.006 372 HG3 GLU 46 HG3 GLU 46 -12.581 -10.847 -2.528 373 H LEU 47 H LEU 47 -12.463 -8.167 -0.166 374 HA LEU 47 HA LEU 47 -14.152 -5.914 -0.985 375 HB2 LEU 47 HB2 LEU 47 -13.139 -4.476 0.396 376 HB3 LEU 47 HB3 LEU 47 -13.160 -5.938 1.391 377 HG LEU 47 HG LEU 47 -10.821 -5.149 -0.361 378 HD11 LEU 47 HD11 LEU 47 -9.703 -4.333 1.620 379 HD12 LEU 47 HD12 LEU 47 -11.152 -3.362 1.194 380 HD13 LEU 47 HD13 LEU 47 -11.221 -4.526 2.560 381 HD21 LEU 47 HD21 LEU 47 -9.639 -6.742 1.122 382 HD22 LEU 47 HD22 LEU 47 -11.182 -7.071 1.982 383 HD23 LEU 47 HD23 LEU 47 -11.004 -7.521 0.252 384 H LYS 48 H LYS 48 -12.951 -4.287 -2.064 385 HA LYS 48 HA LYS 48 -11.087 -5.348 -4.003 386 HB2 LYS 48 HB2 LYS 48 -13.372 -5.007 -4.919 387 HB3 LYS 48 HB3 LYS 48 -13.249 -3.281 -4.551 388 HG2 LYS 48 HG2 LYS 48 -10.869 -3.661 -5.865 389 HG3 LYS 48 HG3 LYS 48 -11.857 -4.895 -6.657 390 HD2 LYS 48 HD2 LYS 48 -12.913 -2.080 -6.252 391 HD3 LYS 48 HD3 LYS 48 -11.847 -2.460 -7.611 392 HE2 LYS 48 HE2 LYS 48 -14.335 -4.123 -7.015 393 HE3 LYS 48 HE3 LYS 48 -14.419 -2.644 -7.981 394 HZ1 LYS 48 HZ1 LYS 48 -14.114 -4.498 -9.407 395 HZ2 LYS 48 HZ2 LYS 48 -12.722 -3.645 -9.438 396 HZ3 LYS 48 HZ3 LYS 48 -12.808 -5.037 -8.589 397 H VAL 49 H VAL 49 -9.331 -4.080 -4.845 398 HA VAL 49 HA VAL 49 -9.019 -1.550 -3.379 399 HB VAL 49 HB VAL 49 -6.590 -1.990 -3.106 400 HG11 VAL 49 HG11 VAL 49 -6.775 -3.673 -1.325 401 HG12 VAL 49 HG12 VAL 49 -8.139 -2.505 -1.284 402 HG13 VAL 49 HG13 VAL 49 -8.389 -4.155 -1.947 403 HG21 VAL 49 HG21 VAL 49 -5.705 -4.256 -3.486 404 HG22 VAL 49 HG22 VAL 49 -7.283 -4.756 -4.183 405 HG23 VAL 49 HG23 VAL 49 -6.291 -3.507 -5.009 406 H SER 50 H SER 50 -8.114 0.188 -4.601 407 HA SER 50 HA SER 50 -7.577 -0.477 -7.434 408 HB2 SER 50 HB2 SER 50 -9.597 0.992 -6.897 409 HB3 SER 50 HB3 SER 50 -8.480 2.190 -6.229 410 HG SER 50 HG SER 50 -8.996 2.613 -8.471 411 H TYR 51 H TYR 51 -5.501 -0.154 -8.111 412 HA TYR 51 HA TYR 51 -3.658 1.216 -6.291 413 HB2 TYR 51 HB2 TYR 51 -3.578 -0.904 -8.449 414 HB3 TYR 51 HB3 TYR 51 -2.168 0.158 -8.353 415 HD1 TYR 51 HD1 TYR 51 -1.539 0.514 -5.592 416 HD2 TYR 51 HD2 TYR 51 -3.173 -2.958 -7.520 417 HE1 TYR 51 HE1 TYR 51 -0.528 -0.931 -3.852 418 HE2 TYR 51 HE2 TYR 51 -2.193 -4.397 -5.767 419 HH TYR 51 HH TYR 51 0.157 -3.883 -4.098 420 H ALA 52 H ALA 52 -2.392 3.012 -7.049 421 HA ALA 52 HA ALA 52 -2.790 3.802 -9.856 422 HB1 ALA 52 HB1 ALA 52 -3.079 6.134 -9.128 423 HB2 ALA 52 HB2 ALA 52 -4.407 5.084 -8.529 424 HB3 ALA 52 HB3 ALA 52 -3.097 5.599 -7.414 425 H VAL 53 H VAL 53 -0.737 3.828 -10.722 426 HA VAL 53 HA VAL 53 1.322 5.046 -9.061 427 HB VAL 53 HB VAL 53 2.970 3.320 -9.892 428 HG11 VAL 53 HG11 VAL 53 2.292 1.550 -8.297 429 HG12 VAL 53 HG12 VAL 53 2.054 3.196 -7.620 430 HG13 VAL 53 HG13 VAL 53 0.644 2.261 -8.221 431 HG21 VAL 53 HG21 VAL 53 2.108 1.152 -10.715 432 HG22 VAL 53 HG22 VAL 53 0.448 1.838 -10.763 433 HG23 VAL 53 HG23 VAL 53 1.726 2.502 -11.837 434 HA PRO 54 HA PRO 54 2.307 6.939 -13.020 435 HB2 PRO 54 HB2 PRO 54 4.456 8.400 -12.177 436 HB3 PRO 54 HB3 PRO 54 2.865 8.768 -11.497 437 HG2 PRO 54 HG2 PRO 54 5.147 7.205 -10.288 438 HG3 PRO 54 HG3 PRO 54 4.023 8.327 -9.509 439 HD2 PRO 54 HD2 PRO 54 3.799 5.517 -9.454 440 HD3 PRO 54 HD3 PRO 54 2.492 6.645 -9.069 441 H LYS 55 H LYS 55 2.837 5.407 -14.415 442 HA LYS 55 HA LYS 55 5.486 4.206 -14.293 443 HB2 LYS 55 HB2 LYS 55 3.385 2.775 -14.459 444 HB3 LYS 55 HB3 LYS 55 3.219 3.372 -16.115 445 HG2 LYS 55 HG2 LYS 55 5.622 2.574 -16.527 446 HG3 LYS 55 HG3 LYS 55 5.549 1.785 -14.946 447 HD2 LYS 55 HD2 LYS 55 3.481 0.557 -15.689 448 HD3 LYS 55 HD3 LYS 55 3.639 1.301 -17.286 449 HE2 LYS 55 HE2 LYS 55 4.708 -0.726 -17.651 450 HE3 LYS 55 HE3 LYS 55 6.086 0.297 -17.223 451 HZ1 LYS 55 HZ1 LYS 55 6.118 -1.774 -16.027 452 HZ2 LYS 55 HZ2 LYS 55 5.925 -0.545 -14.970 453 HZ3 LYS 55 HZ3 LYS 55 4.653 -1.489 -15.364 454 HA PRO 56 HA PRO 56 7.253 6.856 -17.411 455 HB2 PRO 56 HB2 PRO 56 7.986 4.152 -18.678 456 HB3 PRO 56 HB3 PRO 56 9.044 5.543 -18.403 457 HG2 PRO 56 HG2 PRO 56 9.171 3.397 -16.796 458 HG3 PRO 56 HG3 PRO 56 9.375 5.025 -16.138 459 HD2 PRO 56 HD2 PRO 56 7.055 3.146 -15.848 460 HD3 PRO 56 HD3 PRO 56 7.576 4.451 -14.774 461 H ASN 57 H ASN 57 5.259 3.954 -18.309 462 HA ASN 57 HA ASN 57 4.753 5.015 -20.938 463 HB2 ASN 57 HB2 ASN 57 3.148 2.828 -19.528 464 HB3 ASN 57 HB3 ASN 57 3.441 3.028 -21.260 465 HD21 ASN 57 HD21 ASN 57 5.282 2.139 -22.186 466 HD22 ASN 57 HD22 ASN 57 6.416 1.167 -21.309 467 H GLY 58 H GLY 58 3.764 6.215 -18.000 468 HA2 GLY 58 HA2 GLY 58 2.114 7.970 -18.114 469 HA3 GLY 58 HA3 GLY 58 1.080 6.884 -19.052 470 H CYS 59 H CYS 59 -0.002 8.052 -16.753 471 HA CYS 59 HA CYS 59 0.335 6.779 -14.337 472 HB2 CYS 59 HB2 CYS 59 -2.281 7.778 -15.581 473 HB3 CYS 59 HB3 CYS 59 -2.004 7.482 -13.860 474 H ARG 60 H ARG 60 0.183 4.658 -13.763 475 HA ARG 60 HA ARG 60 -1.738 3.046 -15.256 476 HB2 ARG 60 HB2 ARG 60 0.886 2.553 -15.257 477 HB3 ARG 60 HB3 ARG 60 0.475 1.689 -13.770 478 HG2 ARG 60 HG2 ARG 60 0.253 0.062 -15.498 479 HG3 ARG 60 HG3 ARG 60 -1.406 0.528 -15.102 480 HD2 ARG 60 HD2 ARG 60 0.260 1.400 -17.513 481 HD3 ARG 60 HD3 ARG 60 -1.229 0.446 -17.515 482 HE ARG 60 HE ARG 60 -1.023 3.370 -17.023 483 HH11 ARG 60 HH11 ARG 60 -3.024 0.528 -17.625 484 HH12 ARG 60 HH12 ARG 60 -4.456 1.460 -17.908 485 HH21 ARG 60 HH21 ARG 60 -2.905 4.554 -17.368 486 HH22 ARG 60 HH22 ARG 60 -4.387 3.749 -17.762 487 H LYS 61 H LYS 61 -3.453 1.990 -14.223 488 HA LYS 61 HA LYS 61 -3.228 1.939 -11.275 489 HB2 LYS 61 HB2 LYS 61 -5.369 2.707 -10.966 490 HB3 LYS 61 HB3 LYS 61 -4.856 3.682 -12.349 491 HG2 LYS 61 HG2 LYS 61 -6.090 2.267 -13.899 492 HG3 LYS 61 HG3 LYS 61 -6.445 1.091 -12.627 493 HD2 LYS 61 HD2 LYS 61 -7.501 3.216 -11.393 494 HD3 LYS 61 HD3 LYS 61 -7.576 3.871 -13.034 495 HE2 LYS 61 HE2 LYS 61 -9.678 2.768 -12.612 496 HE3 LYS 61 HE3 LYS 61 -8.784 1.769 -13.765 497 HZ1 LYS 61 HZ1 LYS 61 -9.869 0.668 -11.755 498 HZ2 LYS 61 HZ2 LYS 61 -8.355 0.202 -12.151 499 HZ3 LYS 61 HZ3 LYS 61 -8.595 1.216 -10.894 500 H TRP 62 H TRP 62 -4.771 0.194 -10.312 501 HA TRP 62 HA TRP 62 -5.605 -1.909 -12.112 502 HB2 TRP 62 HB2 TRP 62 -2.985 -2.069 -11.504 503 HB3 TRP 62 HB3 TRP 62 -3.612 -2.718 -9.983 504 HD1 TRP 62 HD1 TRP 62 -3.763 -5.297 -10.005 505 HE1 TRP 62 HE1 TRP 62 -4.149 -7.124 -11.794 506 HE3 TRP 62 HE3 TRP 62 -4.381 -2.278 -14.113 507 HZ2 TRP 62 HZ2 TRP 62 -4.636 -7.280 -14.561 508 HZ3 TRP 62 HZ3 TRP 62 -4.803 -3.344 -16.315 509 HH2 TRP 62 HH2 TRP 62 -4.930 -5.809 -16.532 510 H GLU 63 H GLU 63 -6.772 -3.668 -10.801 511 HA GLU 63 HA GLU 63 -7.272 -2.886 -8.039 512 HB2 GLU 63 HB2 GLU 63 -9.763 -3.191 -8.450 513 HB3 GLU 63 HB3 GLU 63 -9.047 -1.688 -9.048 514 HG2 GLU 63 HG2 GLU 63 -9.102 -3.901 -11.038 515 HG3 GLU 63 HG3 GLU 63 -10.696 -3.364 -10.493 516 H THR 64 H THR 64 -7.382 -4.663 -6.731 517 HA THR 64 HA THR 64 -7.973 -7.224 -8.043 518 HB THR 64 HB THR 64 -6.309 -8.123 -6.206 519 HG1 THR 64 HG1 THR 64 -5.374 -6.496 -5.145 520 HG21 THR 64 HG21 THR 64 -4.444 -7.982 -7.845 521 HG22 THR 64 HG22 THR 64 -6.004 -8.374 -8.644 522 HG23 THR 64 HG23 THR 64 -5.338 -6.709 -8.742 523 H THR 65 H THR 65 -9.330 -8.614 -6.847 524 HA THR 65 HA THR 65 -10.707 -7.397 -4.633 525 HB THR 65 HB THR 65 -11.073 -10.292 -5.387 526 HG1 THR 65 HG1 THR 65 -12.285 -9.593 -7.304 527 HG21 THR 65 HG21 THR 65 -13.461 -9.646 -5.218 528 HG22 THR 65 HG22 THR 65 -12.545 -9.175 -3.746 529 HG23 THR 65 HG23 THR 65 -12.978 -7.934 -4.971 530 H PHE 66 H PHE 66 -10.559 -8.067 -2.390 531 HA PHE 66 HA PHE 66 -8.463 -10.110 -1.936 532 HB2 PHE 66 HB2 PHE 66 -9.155 -7.536 -0.420 533 HB3 PHE 66 HB3 PHE 66 -8.095 -8.795 0.227 534 HD1 PHE 66 HD1 PHE 66 -7.205 -9.133 -2.971 535 HD2 PHE 66 HD2 PHE 66 -7.040 -6.070 0.040 536 HE1 PHE 66 HE1 PHE 66 -5.261 -8.125 -4.113 537 HE2 PHE 66 HE2 PHE 66 -5.082 -5.059 -1.110 538 HZ PHE 66 HZ PHE 66 -4.195 -6.084 -3.194 539 H LYS 67 H LYS 67 -8.805 -11.535 -0.116 540 HA LYS 67 HA LYS 67 -11.679 -11.823 0.475 541 HB2 LYS 67 HB2 LYS 67 -9.300 -13.550 0.053 542 HB3 LYS 67 HB3 LYS 67 -10.146 -13.951 1.553 543 HG2 LYS 67 HG2 LYS 67 -11.082 -15.396 -0.049 544 HG3 LYS 67 HG3 LYS 67 -12.293 -14.120 0.138 545 HD2 LYS 67 HD2 LYS 67 -11.626 -13.047 -1.921 546 HD3 LYS 67 HD3 LYS 67 -10.154 -14.021 -2.038 547 HE2 LYS 67 HE2 LYS 67 -11.472 -16.067 -2.400 548 HE3 LYS 67 HE3 LYS 67 -12.982 -15.190 -2.120 549 HZ1 LYS 67 HZ1 LYS 67 -12.516 -15.460 -4.455 550 HZ2 LYS 67 HZ2 LYS 67 -12.509 -13.873 -4.074 551 HZ3 LYS 67 HZ3 LYS 67 -11.100 -14.659 -4.326 552 H LYS 68 H LYS 68 -12.327 -12.076 2.677 553 HA LYS 68 HA LYS 68 -10.947 -10.439 4.470 554 HB2 LYS 68 HB2 LYS 68 -13.356 -10.604 4.569 555 HB3 LYS 68 HB3 LYS 68 -13.306 -12.368 4.697 556 HG2 LYS 68 HG2 LYS 68 -13.783 -11.774 6.888 557 HG3 LYS 68 HG3 LYS 68 -12.022 -11.922 6.959 558 HD2 LYS 68 HD2 LYS 68 -12.587 -9.870 8.085 559 HD3 LYS 68 HD3 LYS 68 -11.862 -9.414 6.538 560 HE2 LYS 68 HE2 LYS 68 -13.998 -8.890 5.563 561 HE3 LYS 68 HE3 LYS 68 -14.882 -9.712 6.856 562 HZ1 LYS 68 HZ1 LYS 68 -14.914 -7.336 7.134 563 HZ2 LYS 68 HZ2 LYS 68 -14.100 -8.012 8.377 564 HZ3 LYS 68 HZ3 LYS 68 -13.285 -7.253 7.184 565 H THR 69 H THR 69 -9.107 -10.895 5.653 566 HA THR 69 HA THR 69 -9.175 -13.529 7.012 567 HB THR 69 HB THR 69 -6.722 -12.265 5.703 568 HG1 THR 69 HG1 THR 69 -7.687 -14.568 4.430 569 HG21 THR 69 HG21 THR 69 -5.741 -14.535 5.853 570 HG22 THR 69 HG22 THR 69 -6.223 -13.881 7.455 571 HG23 THR 69 HG23 THR 69 -7.243 -15.118 6.645 572 H SER 70 H SER 70 -9.817 -12.261 8.855 573 HA SER 70 HA SER 70 -8.220 -10.010 9.700 574 HB2 SER 70 HB2 SER 70 -9.828 -10.963 11.825 575 HB3 SER 70 HB3 SER 70 -10.167 -9.603 10.746 576 HG SER 70 HG SER 70 -11.891 -11.190 10.741 577 H ASP 71 H ASP 71 -6.082 -11.377 9.557 578 HA ASP 71 HA ASP 71 -5.768 -13.479 11.469 579 HB2 ASP 71 HB2 ASP 71 -4.377 -13.122 9.389 580 HB3 ASP 71 HB3 ASP 71 -3.780 -11.596 10.054 581 H ASP 72 H ASP 72 -4.101 -10.203 11.407 582 HA ASP 72 HA ASP 72 -4.182 -10.234 14.373 583 HB2 ASP 72 HB2 ASP 72 -1.974 -10.170 12.793 584 HB3 ASP 72 HB3 ASP 72 -2.299 -8.435 12.901 585 H GLY 73 H GLY 73 -6.270 -9.728 13.113 586 HA2 GLY 73 HA2 GLY 73 -8.215 -8.865 13.654 587 HA3 GLY 73 HA3 GLY 73 -7.467 -7.334 14.131 588 H GLU 74 H GLU 74 -6.364 -6.261 11.282 589 HA GLU 74 HA GLU 74 -8.926 -6.874 9.855 590 HB2 GLU 74 HB2 GLU 74 -7.884 -4.201 10.449 591 HB3 GLU 74 HB3 GLU 74 -8.412 -4.481 8.785 592 HG2 GLU 74 HG2 GLU 74 -10.198 -3.540 10.246 593 HG3 GLU 74 HG3 GLU 74 -10.646 -5.080 9.502 594 H VAL 75 H VAL 75 -7.133 -8.598 9.177 595 HA VAL 75 HA VAL 75 -5.218 -7.437 7.288 596 HB VAL 75 HB VAL 75 -5.537 -10.274 8.382 597 HG11 VAL 75 HG11 VAL 75 -3.237 -10.635 7.547 598 HG12 VAL 75 HG12 VAL 75 -4.396 -10.245 6.231 599 HG13 VAL 75 HG13 VAL 75 -3.256 -8.990 6.825 600 HG21 VAL 75 HG21 VAL 75 -3.564 -9.782 9.799 601 HG22 VAL 75 HG22 VAL 75 -3.606 -8.075 9.243 602 HG23 VAL 75 HG23 VAL 75 -4.973 -8.743 10.197 603 H TYR 76 H TYR 76 -4.950 -8.507 5.154 604 HA TYR 76 HA TYR 76 -7.425 -9.794 4.227 605 HB2 TYR 76 HB2 TYR 76 -5.881 -7.551 2.822 606 HB3 TYR 76 HB3 TYR 76 -7.262 -8.428 2.151 607 HD1 TYR 76 HD1 TYR 76 -9.532 -8.211 3.298 608 HD2 TYR 76 HD2 TYR 76 -6.201 -5.685 4.286 609 HE1 TYR 76 HE1 TYR 76 -11.079 -6.580 4.333 610 HE2 TYR 76 HE2 TYR 76 -7.745 -4.052 5.324 611 HH TYR 76 HH TYR 76 -9.842 -3.546 5.822 612 H TYR 77 H TYR 77 -7.152 -11.340 2.540 613 HA TYR 77 HA TYR 77 -4.366 -11.822 1.758 614 HB2 TYR 77 HB2 TYR 77 -6.319 -13.703 3.116 615 HB3 TYR 77 HB3 TYR 77 -5.180 -14.360 1.932 616 HD1 TYR 77 HD1 TYR 77 -5.115 -11.994 4.884 617 HD2 TYR 77 HD2 TYR 77 -3.173 -15.187 2.764 618 HE1 TYR 77 HE1 TYR 77 -3.345 -12.063 6.612 619 HE2 TYR 77 HE2 TYR 77 -1.400 -15.254 4.490 620 HH TYR 77 HH TYR 77 -1.472 -13.009 7.303 621 H SER 78 H SER 78 -4.104 -12.148 -0.444 622 HA SER 78 HA SER 78 -6.613 -12.601 -1.951 623 HB2 SER 78 HB2 SER 78 -4.046 -11.854 -3.309 624 HB3 SER 78 HB3 SER 78 -5.688 -11.263 -3.596 625 HG SER 78 HG SER 78 -5.069 -9.518 -2.545 626 H GLU 79 H GLU 79 -6.676 -14.936 -1.748 627 HA GLU 79 HA GLU 79 -4.419 -16.595 -2.043 628 HB2 GLU 79 HB2 GLU 79 -6.944 -16.927 -1.181 629 HB3 GLU 79 HB3 GLU 79 -7.250 -17.357 -2.869 630 HG2 GLU 79 HG2 GLU 79 -5.413 -18.758 -0.890 631 HG3 GLU 79 HG3 GLU 79 -6.891 -19.383 -1.633 632 H GLU 80 H GLU 80 -6.841 -15.373 -4.471 633 HA GLU 80 HA GLU 80 -5.820 -17.036 -6.533 634 HB2 GLU 80 HB2 GLU 80 -7.464 -14.459 -6.641 635 HB3 GLU 80 HB3 GLU 80 -7.190 -15.553 -8.002 636 HG2 GLU 80 HG2 GLU 80 -8.768 -17.023 -7.306 637 HG3 GLU 80 HG3 GLU 80 -8.244 -16.944 -5.619 638 H ALA 81 H ALA 81 -4.688 -13.996 -5.122 639 HA ALA 81 HA ALA 81 -3.021 -13.598 -7.509 640 HB1 ALA 81 HB1 ALA 81 -2.658 -11.316 -6.546 641 HB2 ALA 81 HB2 ALA 81 -4.398 -11.659 -6.829 642 HB3 ALA 81 HB3 ALA 81 -3.724 -11.747 -5.167 643 H LYS 82 H LYS 82 -2.873 -14.833 -4.247 644 HA LYS 82 HA LYS 82 -1.169 -15.606 -3.039 645 HB2 LYS 82 HB2 LYS 82 0.491 -14.972 -5.523 646 HB3 LYS 82 HB3 LYS 82 1.095 -15.833 -4.102 647 HG2 LYS 82 HG2 LYS 82 -1.266 -16.771 -5.800 648 HG3 LYS 82 HG3 LYS 82 0.400 -17.320 -6.021 649 HD2 LYS 82 HD2 LYS 82 0.455 -18.216 -3.717 650 HD3 LYS 82 HD3 LYS 82 -1.162 -17.574 -3.398 651 HE2 LYS 82 HE2 LYS 82 -0.676 -19.486 -5.718 652 HE3 LYS 82 HE3 LYS 82 -0.890 -20.099 -4.073 653 HZ1 LYS 82 HZ1 LYS 82 -2.884 -19.592 -5.745 654 HZ2 LYS 82 HZ2 LYS 82 -3.052 -19.602 -4.121 655 HZ3 LYS 82 HZ3 LYS 82 -2.867 -18.187 -4.915 656 H LYS 83 H LYS 83 -2.052 -12.972 -2.570 657 HA LYS 83 HA LYS 83 0.417 -11.758 -1.578 658 HB2 LYS 83 HB2 LYS 83 -1.754 -10.196 -3.063 659 HB3 LYS 83 HB3 LYS 83 -0.295 -9.528 -2.321 660 HG2 LYS 83 HG2 LYS 83 0.650 -9.686 -4.361 661 HG3 LYS 83 HG3 LYS 83 0.752 -11.428 -4.069 662 HD2 LYS 83 HD2 LYS 83 -0.378 -11.347 -6.119 663 HD3 LYS 83 HD3 LYS 83 -1.714 -11.506 -4.971 664 HE2 LYS 83 HE2 LYS 83 -2.571 -9.709 -6.089 665 HE3 LYS 83 HE3 LYS 83 -1.496 -8.778 -5.037 666 HZ1 LYS 83 HZ1 LYS 83 -0.271 -8.206 -6.782 667 HZ2 LYS 83 HZ2 LYS 83 -0.151 -9.728 -7.358 668 HZ3 LYS 83 HZ3 LYS 83 -1.440 -8.807 -7.751 669 H LYS 84 H LYS 84 0.133 -10.940 0.508 670 HA LYS 84 HA LYS 84 -2.620 -10.565 1.461 671 HB2 LYS 84 HB2 LYS 84 -2.186 -11.736 3.497 672 HB3 LYS 84 HB3 LYS 84 -1.850 -12.819 2.139 673 HG2 LYS 84 HG2 LYS 84 -0.055 -13.245 3.558 674 HG3 LYS 84 HG3 LYS 84 0.641 -12.068 2.437 675 HD2 LYS 84 HD2 LYS 84 0.162 -10.229 4.055 676 HD3 LYS 84 HD3 LYS 84 -0.565 -11.392 5.172 677 HE2 LYS 84 HE2 LYS 84 1.585 -12.607 5.358 678 HE3 LYS 84 HE3 LYS 84 2.324 -11.529 4.167 679 HZ1 LYS 84 HZ1 LYS 84 2.906 -10.737 6.268 680 HZ2 LYS 84 HZ2 LYS 84 1.759 -9.698 5.748 681 HZ3 LYS 84 HZ3 LYS 84 1.389 -10.832 6.862 682 H VAL 85 H VAL 85 -2.855 -8.971 3.148 683 HA VAL 85 HA VAL 85 -0.419 -7.550 3.862 684 HB VAL 85 HB VAL 85 -1.483 -5.348 3.318 685 HG11 VAL 85 HG11 VAL 85 -1.152 -5.456 0.871 686 HG12 VAL 85 HG12 VAL 85 0.125 -6.351 1.762 687 HG13 VAL 85 HG13 VAL 85 -1.200 -7.250 0.949 688 HG21 VAL 85 HG21 VAL 85 -3.431 -5.282 1.798 689 HG22 VAL 85 HG22 VAL 85 -3.577 -7.068 1.915 690 HG23 VAL 85 HG23 VAL 85 -3.833 -6.048 3.371 691 H GLU 86 H GLU 86 -0.592 -6.404 5.878 692 HA GLU 86 HA GLU 86 -3.220 -6.554 7.160 693 HB2 GLU 86 HB2 GLU 86 -2.113 -7.231 9.283 694 HB3 GLU 86 HB3 GLU 86 -2.053 -8.472 8.023 695 HG2 GLU 86 HG2 GLU 86 0.299 -6.608 8.240 696 HG3 GLU 86 HG3 GLU 86 0.077 -7.796 9.532 697 H VAL 87 H VAL 87 -3.817 -4.656 8.161 698 HA VAL 87 HA VAL 87 -2.090 -2.404 7.923 699 HB VAL 87 HB VAL 87 -4.484 -2.119 7.735 700 HG11 VAL 87 HG11 VAL 87 -6.031 -2.515 9.629 701 HG12 VAL 87 HG12 VAL 87 -5.230 -4.026 9.080 702 HG13 VAL 87 HG13 VAL 87 -4.675 -3.209 10.581 703 HG21 VAL 87 HG21 VAL 87 -4.896 -0.351 9.424 704 HG22 VAL 87 HG22 VAL 87 -3.478 -0.930 10.362 705 HG23 VAL 87 HG23 VAL 87 -3.248 -0.243 8.719 706 H LEU 88 H LEU 88 -0.325 -2.078 9.299 707 HA LEU 88 HA LEU 88 -0.239 -3.462 11.817 708 HB2 LEU 88 HB2 LEU 88 1.554 -1.287 10.601 709 HB3 LEU 88 HB3 LEU 88 1.963 -2.304 11.989 710 HG LEU 88 HG LEU 88 1.557 -3.297 9.133 711 HD11 LEU 88 HD11 LEU 88 4.009 -3.646 9.164 712 HD12 LEU 88 HD12 LEU 88 3.579 -1.915 9.372 713 HD13 LEU 88 HD13 LEU 88 4.093 -2.890 10.790 714 HD21 LEU 88 HD21 LEU 88 2.497 -5.414 10.002 715 HD22 LEU 88 HD22 LEU 88 2.527 -4.718 11.657 716 HD23 LEU 88 HD23 LEU 88 0.959 -4.981 10.822 717 H ASP 89 H ASP 89 -0.210 0.082 10.826 718 HA ASP 89 HA ASP 89 -1.751 0.660 13.223 719 HB2 ASP 89 HB2 ASP 89 0.607 0.794 14.006 720 HB3 ASP 89 HB3 ASP 89 0.974 1.950 12.719 721 H THR 90 H THR 90 -3.068 2.508 12.923 722 HA THR 90 HA THR 90 -2.474 4.275 10.714 723 HB THR 90 HB THR 90 -3.723 2.365 9.698 724 HG1 THR 90 HG1 THR 90 -4.861 3.732 8.426 725 HG21 THR 90 HG21 THR 90 -6.142 2.109 10.203 726 HG22 THR 90 HG22 THR 90 -5.110 1.721 11.621 727 HG23 THR 90 HG23 THR 90 -5.976 3.292 11.545 728 H ASP 91 H ASP 91 -3.345 6.380 11.041 729 HA ASP 91 HA ASP 91 -4.742 6.697 13.609 730 HB2 ASP 91 HB2 ASP 91 -2.616 7.977 13.179 731 HB3 ASP 91 HB3 ASP 91 -3.407 8.783 11.819 732 H TYR 92 H TYR 92 -6.925 7.278 13.607 733 HA TYR 92 HA TYR 92 -8.487 7.128 11.377 734 HB2 TYR 92 HB2 TYR 92 -8.872 8.737 13.952 735 HB3 TYR 92 HB3 TYR 92 -10.151 8.490 12.756 736 HD1 TYR 92 HD1 TYR 92 -10.300 5.808 12.031 737 HD2 TYR 92 HD2 TYR 92 -9.004 7.358 15.823 738 HE1 TYR 92 HE1 TYR 92 -10.906 3.666 13.112 739 HE2 TYR 92 HE2 TYR 92 -9.618 5.217 16.908 740 HH TYR 92 HH TYR 92 -11.005 2.502 14.985 741 H LYS 93 H LYS 93 -6.804 10.053 12.691 742 HA LYS 93 HA LYS 93 -7.656 11.423 10.245 743 HB2 LYS 93 HB2 LYS 93 -7.321 12.656 13.012 744 HB3 LYS 93 HB3 LYS 93 -7.687 13.536 11.522 745 HG2 LYS 93 HG2 LYS 93 -9.821 12.352 11.282 746 HG3 LYS 93 HG3 LYS 93 -9.444 11.310 12.661 747 HD2 LYS 93 HD2 LYS 93 -9.370 13.320 14.149 748 HD3 LYS 93 HD3 LYS 93 -9.767 14.351 12.769 749 HE2 LYS 93 HE2 LYS 93 -11.518 12.055 13.789 750 HE3 LYS 93 HE3 LYS 93 -11.756 13.759 14.199 751 HZ1 LYS 93 HZ1 LYS 93 -13.158 13.214 12.400 752 HZ2 LYS 93 HZ2 LYS 93 -11.981 14.162 11.780 753 HZ3 LYS 93 HZ3 LYS 93 -11.953 12.550 11.520 754 H SER 94 H SER 94 -5.093 9.809 10.697 755 HA SER 94 HA SER 94 -3.394 12.051 9.834 756 HB2 SER 94 HB2 SER 94 -3.202 11.674 12.410 757 HB3 SER 94 HB3 SER 94 -2.624 10.040 12.056 758 HG SER 94 HG SER 94 -0.878 11.545 12.387 759 H TYR 95 H TYR 95 -1.001 10.118 10.262 760 HA TYR 95 HA TYR 95 -1.214 8.919 7.659 761 HB2 TYR 95 HB2 TYR 95 1.146 8.334 8.054 762 HB3 TYR 95 HB3 TYR 95 0.870 10.017 8.521 763 HD1 TYR 95 HD1 TYR 95 0.854 10.681 10.889 764 HD2 TYR 95 HD2 TYR 95 1.607 6.613 9.739 765 HE1 TYR 95 HE1 TYR 95 1.697 10.199 13.162 766 HE2 TYR 95 HE2 TYR 95 2.437 6.122 12.019 767 HH TYR 95 HH TYR 95 1.909 8.197 14.657 768 H ALA 96 H ALA 96 -0.355 6.584 7.335 769 HA ALA 96 HA ALA 96 -0.968 4.824 9.552 770 HB1 ALA 96 HB1 ALA 96 -2.474 3.428 8.188 771 HB2 ALA 96 HB2 ALA 96 -3.141 5.064 8.509 772 HB3 ALA 96 HB3 ALA 96 -2.443 4.678 6.900 773 H VAL 97 H VAL 97 -0.036 2.677 9.371 774 HA VAL 97 HA VAL 97 1.793 2.463 7.077 775 HB VAL 97 HB VAL 97 3.334 1.173 8.596 776 HG11 VAL 97 HG11 VAL 97 4.308 3.204 9.611 777 HG12 VAL 97 HG12 VAL 97 3.775 3.491 7.920 778 HG13 VAL 97 HG13 VAL 97 2.781 4.093 9.290 779 HG21 VAL 97 HG21 VAL 97 3.136 1.546 11.023 780 HG22 VAL 97 HG22 VAL 97 1.562 2.372 10.766 781 HG23 VAL 97 HG23 VAL 97 1.737 0.629 10.370 782 H ILE 98 H ILE 98 1.367 0.617 5.833 783 HA ILE 98 HA ILE 98 -0.068 -1.554 7.202 784 HB ILE 98 HB ILE 98 -0.194 -0.881 4.225 785 HG12 ILE 98 HG12 ILE 98 -1.108 1.027 5.418 786 HG13 ILE 98 HG13 ILE 98 -2.416 0.112 4.656 787 HG21 ILE 98 HG21 ILE 98 -2.217 -2.312 4.282 788 HG22 ILE 98 HG22 ILE 98 -0.747 -3.200 4.807 789 HG23 ILE 98 HG23 ILE 98 -1.935 -2.629 6.027 790 HD11 ILE 98 HD11 ILE 98 -3.049 0.850 6.911 791 HD12 ILE 98 HD12 ILE 98 -2.964 -0.942 6.833 792 HD13 ILE 98 HD13 ILE 98 -1.636 -0.013 7.606 793 H TYR 99 H TYR 99 0.694 -3.689 6.866 794 HA TYR 99 HA TYR 99 3.296 -3.858 5.510 795 HB2 TYR 99 HB2 TYR 99 3.164 -4.511 7.908 796 HB3 TYR 99 HB3 TYR 99 1.953 -5.735 7.504 797 HD1 TYR 99 HD1 TYR 99 5.469 -4.681 6.680 798 HD2 TYR 99 HD2 TYR 99 2.634 -7.902 6.869 799 HE1 TYR 99 HE1 TYR 99 7.271 -6.296 6.165 800 HE2 TYR 99 HE2 TYR 99 4.436 -9.519 6.361 801 HH TYR 99 HH TYR 99 6.563 -9.699 5.502 802 H ALA 100 H ALA 100 3.637 -5.328 3.792 803 HA ALA 100 HA ALA 100 1.307 -6.926 2.995 804 HB1 ALA 100 HB1 ALA 100 1.745 -6.264 0.638 805 HB2 ALA 100 HB2 ALA 100 1.284 -4.860 1.658 806 HB3 ALA 100 HB3 ALA 100 3.003 -5.115 1.206 807 H THR 101 H THR 101 1.747 -8.917 2.051 808 HA THR 101 HA THR 101 4.492 -9.522 1.387 809 HB THR 101 HB THR 101 3.019 -10.918 3.658 810 HG1 THR 101 HG1 THR 101 5.769 -10.275 3.782 811 HG21 THR 101 HG21 THR 101 4.873 -12.569 3.618 812 HG22 THR 101 HG22 THR 101 3.921 -12.619 2.096 813 HG23 THR 101 HG23 THR 101 5.521 -11.805 2.127 814 H ARG 102 H ARG 102 4.708 -11.259 -0.144 815 HA ARG 102 HA ARG 102 2.269 -12.748 -0.757 816 HB2 ARG 102 HB2 ARG 102 3.711 -11.505 -3.074 817 HB3 ARG 102 HB3 ARG 102 2.065 -12.143 -2.965 818 HG2 ARG 102 HG2 ARG 102 1.465 -9.958 -2.904 819 HG3 ARG 102 HG3 ARG 102 1.890 -10.062 -1.190 820 HD2 ARG 102 HD2 ARG 102 2.984 -8.118 -2.275 821 HD3 ARG 102 HD3 ARG 102 4.178 -9.270 -1.663 822 HE ARG 102 HE ARG 102 3.617 -8.642 -4.480 823 HH11 ARG 102 HH11 ARG 102 5.254 -10.749 -2.182 824 HH12 ARG 102 HH12 ARG 102 6.286 -11.463 -3.375 825 HH21 ARG 102 HH21 ARG 102 4.970 -9.653 -6.054 826 HH22 ARG 102 HH22 ARG 102 6.126 -10.845 -5.563 827 H VAL 103 H VAL 103 2.768 -14.823 -1.714 828 HA VAL 103 HA VAL 103 5.653 -15.313 -1.854 829 HB VAL 103 HB VAL 103 3.479 -17.301 -1.009 830 HG11 VAL 103 HG11 VAL 103 5.390 -18.681 -0.262 831 HG12 VAL 103 HG12 VAL 103 5.447 -18.351 -2.026 832 HG13 VAL 103 HG13 VAL 103 6.526 -17.450 -0.908 833 HG21 VAL 103 HG21 VAL 103 4.374 -17.051 1.283 834 HG22 VAL 103 HG22 VAL 103 5.462 -15.742 0.709 835 HG23 VAL 103 HG23 VAL 103 3.681 -15.515 0.659 836 H LYS 104 H LYS 104 6.438 -16.201 -3.702 837 HA LYS 104 HA LYS 104 4.503 -17.126 -5.737 838 HB2 LYS 104 HB2 LYS 104 6.116 -15.118 -6.103 839 HB3 LYS 104 HB3 LYS 104 7.411 -16.324 -6.119 840 HG2 LYS 104 HG2 LYS 104 4.989 -16.471 -7.973 841 HG3 LYS 104 HG3 LYS 104 6.471 -15.603 -8.393 842 HD2 LYS 104 HD2 LYS 104 6.374 -18.565 -7.620 843 HD3 LYS 104 HD3 LYS 104 6.348 -17.972 -9.286 844 HE2 LYS 104 HE2 LYS 104 8.559 -16.976 -9.054 845 HE3 LYS 104 HE3 LYS 104 8.571 -17.265 -7.309 846 HZ1 LYS 104 HZ1 LYS 104 9.834 -18.902 -8.601 847 HZ2 LYS 104 HZ2 LYS 104 8.655 -19.600 -7.712 848 HZ3 LYS 104 HZ3 LYS 104 8.463 -19.417 -9.323 849 H ASP 105 H ASP 105 5.140 -19.135 -6.897 850 HA ASP 105 HA ASP 105 5.681 -21.284 -5.499 851 HB2 ASP 105 HB2 ASP 105 6.967 -20.732 -8.238 852 HB3 ASP 105 HB3 ASP 105 6.594 -22.326 -7.569 853 H GLY 106 H GLY 106 7.230 -21.406 -3.767 854 HA2 GLY 106 HA2 GLY 106 9.315 -22.008 -3.094 855 HA3 GLY 106 HA3 GLY 106 9.922 -21.750 -4.735 856 H ARG 107 H ARG 107 8.335 -18.800 -3.927 857 HA ARG 107 HA ARG 107 10.719 -17.790 -2.534 858 HB2 ARG 107 HB2 ARG 107 10.916 -17.605 -5.090 859 HB3 ARG 107 HB3 ARG 107 9.485 -16.567 -5.061 860 HG2 ARG 107 HG2 ARG 107 10.632 -14.759 -4.263 861 HG3 ARG 107 HG3 ARG 107 11.684 -15.734 -3.227 862 HD2 ARG 107 HD2 ARG 107 11.903 -15.600 -6.278 863 HD3 ARG 107 HD3 ARG 107 12.870 -14.623 -5.166 864 HE ARG 107 HE ARG 107 13.149 -17.377 -4.452 865 HH11 ARG 107 HH11 ARG 107 14.037 -15.155 -7.028 866 HH12 ARG 107 HH12 ARG 107 15.477 -16.021 -7.445 867 HH21 ARG 107 HH21 ARG 107 15.045 -18.500 -5.005 868 HH22 ARG 107 HH22 ARG 107 16.051 -17.926 -6.293 869 H THR 108 H THR 108 10.330 -16.332 -0.996 870 HA THR 108 HA THR 108 7.592 -15.314 -0.823 871 HB THR 108 HB THR 108 9.437 -15.122 1.540 872 HG1 THR 108 HG1 THR 108 9.082 -17.420 1.992 873 HG21 THR 108 HG21 THR 108 7.369 -15.853 2.700 874 HG22 THR 108 HG22 THR 108 7.045 -14.462 1.612 875 HG23 THR 108 HG23 THR 108 6.572 -16.121 1.113 876 H LEU 109 H LEU 109 7.222 -13.081 -1.153 877 HA LEU 109 HA LEU 109 9.610 -11.387 -0.700 878 HB2 LEU 109 HB2 LEU 109 9.018 -11.599 -3.084 879 HB3 LEU 109 HB3 LEU 109 7.390 -11.004 -2.732 880 HG LEU 109 HG LEU 109 8.248 -8.824 -2.091 881 HD11 LEU 109 HD11 LEU 109 10.651 -8.264 -2.275 882 HD12 LEU 109 HD12 LEU 109 10.346 -9.517 -1.024 883 HD13 LEU 109 HD13 LEU 109 11.020 -9.988 -2.621 884 HD21 LEU 109 HD21 LEU 109 9.208 -8.105 -4.263 885 HD22 LEU 109 HD22 LEU 109 9.511 -9.824 -4.689 886 HD23 LEU 109 HD23 LEU 109 7.828 -9.233 -4.481 887 H HIS 110 H HIS 110 9.356 -9.615 0.664 888 HA HIS 110 HA HIS 110 6.634 -9.222 1.756 889 HB2 HIS 110 HB2 HIS 110 9.373 -8.940 3.103 890 HB3 HIS 110 HB3 HIS 110 7.828 -8.501 3.843 891 HD2 HIS 110 HD2 HIS 110 9.974 -11.681 3.096 892 HE1 HIS 110 HE1 HIS 110 6.503 -12.880 5.285 893 H MET 111 H MET 111 6.126 -6.970 2.272 894 HA MET 111 HA MET 111 8.023 -4.932 1.525 895 HB2 MET 111 HB2 MET 111 5.778 -5.789 -0.228 896 HB3 MET 111 HB3 MET 111 5.816 -4.054 0.111 897 HG2 MET 111 HG2 MET 111 8.180 -3.955 -0.678 898 HG3 MET 111 HG3 MET 111 8.135 -5.688 -1.025 899 HE1 MET 111 HE1 MET 111 8.155 -4.651 -4.585 900 HE2 MET 111 HE2 MET 111 8.590 -3.189 -3.637 901 HE3 MET 111 HE3 MET 111 9.139 -4.810 -3.092 902 H MET 112 H MET 112 7.553 -2.882 2.489 903 HA MET 112 HA MET 112 5.120 -2.918 4.179 904 HB2 MET 112 HB2 MET 112 7.390 -3.004 5.343 905 HB3 MET 112 HB3 MET 112 7.681 -1.378 4.712 906 HG2 MET 112 HG2 MET 112 5.870 -0.443 5.966 907 HG3 MET 112 HG3 MET 112 5.186 -2.034 6.325 908 HE1 MET 112 HE1 MET 112 6.383 0.275 9.113 909 HE2 MET 112 HE2 MET 112 4.987 -0.561 8.353 910 HE3 MET 112 HE3 MET 112 5.827 -1.308 9.754 911 H ARG 113 H ARG 113 3.844 -0.927 4.190 912 HA ARG 113 HA ARG 113 4.803 1.151 2.365 913 HB2 ARG 113 HB2 ARG 113 2.739 -0.755 1.752 914 HB3 ARG 113 HB3 ARG 113 1.936 0.789 2.070 915 HG2 ARG 113 HG2 ARG 113 2.361 1.232 -0.110 916 HG3 ARG 113 HG3 ARG 113 3.997 1.616 0.439 917 HD2 ARG 113 HD2 ARG 113 3.998 0.043 -1.498 918 HD3 ARG 113 HD3 ARG 113 4.772 -0.655 -0.070 919 HE ARG 113 HE ARG 113 1.919 -1.306 -0.347 920 HH11 ARG 113 HH11 ARG 113 5.181 -2.241 -1.255 921 HH12 ARG 113 HH12 ARG 113 4.785 -3.918 -1.424 922 HH21 ARG 113 HH21 ARG 113 1.434 -3.520 -0.464 923 HH22 ARG 113 HH22 ARG 113 2.644 -4.649 -0.972 924 H LEU 114 H LEU 114 4.093 3.249 2.857 925 HA LEU 114 HA LEU 114 2.454 3.476 5.308 926 HB2 LEU 114 HB2 LEU 114 4.938 3.947 5.575 927 HB3 LEU 114 HB3 LEU 114 4.730 5.297 4.451 928 HG LEU 114 HG LEU 114 3.168 5.040 7.052 929 HD11 LEU 114 HD11 LEU 114 4.775 6.678 7.987 930 HD12 LEU 114 HD12 LEU 114 5.573 5.130 7.549 931 HD13 LEU 114 HD13 LEU 114 5.753 6.565 6.485 932 HD21 LEU 114 HD21 LEU 114 2.806 7.464 6.742 933 HD22 LEU 114 HD22 LEU 114 3.700 7.394 5.186 934 HD23 LEU 114 HD23 LEU 114 2.150 6.505 5.373 935 H TYR 115 H TYR 115 0.604 4.707 4.966 936 HA TYR 115 HA TYR 115 0.655 6.390 2.546 937 HB2 TYR 115 HB2 TYR 115 -1.580 5.873 2.093 938 HB3 TYR 115 HB3 TYR 115 -0.800 4.323 2.438 939 HD1 TYR 115 HD1 TYR 115 -3.126 6.897 3.808 940 HD2 TYR 115 HD2 TYR 115 -1.573 2.916 4.255 941 HE1 TYR 115 HE1 TYR 115 -4.905 6.391 5.446 942 HE2 TYR 115 HE2 TYR 115 -3.360 2.405 5.894 943 HH TYR 115 HH TYR 115 -5.453 3.125 6.647 944 H SER 116 H SER 116 -0.716 8.351 2.638 945 HA SER 116 HA SER 116 -0.808 9.362 5.426 946 HB2 SER 116 HB2 SER 116 -0.365 10.783 2.735 947 HB3 SER 116 HB3 SER 116 -0.542 11.602 4.292 948 HG SER 116 HG SER 116 1.645 11.478 3.990 949 H ARG 117 H ARG 117 -2.725 10.819 5.758 950 HA ARG 117 HA ARG 117 -5.039 9.718 4.633 951 HB2 ARG 117 HB2 ARG 117 -4.321 11.812 6.596 952 HB3 ARG 117 HB3 ARG 117 -5.810 12.163 5.709 953 HG2 ARG 117 HG2 ARG 117 -6.608 9.799 6.333 954 HG3 ARG 117 HG3 ARG 117 -5.204 9.693 7.404 955 HD2 ARG 117 HD2 ARG 117 -7.195 10.433 8.664 956 HD3 ARG 117 HD3 ARG 117 -5.964 11.703 8.651 957 HE ARG 117 HE ARG 117 -7.308 12.822 6.861 958 HH11 ARG 117 HH11 ARG 117 -8.893 10.443 8.925 959 HH12 ARG 117 HH12 ARG 117 -10.476 11.087 8.649 960 HH21 ARG 117 HH21 ARG 117 -9.394 13.642 6.510 961 HH22 ARG 117 HH22 ARG 117 -10.760 12.904 7.277 962 H SER 118 H SER 118 -2.870 12.150 3.407 963 HA SER 118 HA SER 118 -4.705 12.624 1.169 964 HB2 SER 118 HB2 SER 118 -3.270 14.908 2.580 965 HB3 SER 118 HB3 SER 118 -4.457 14.997 1.272 966 HG SER 118 HG SER 118 -5.391 15.490 3.351 967 HA PRO 119 HA PRO 119 -0.705 12.300 -0.874 968 HB2 PRO 119 HB2 PRO 119 -0.756 14.312 -2.795 969 HB3 PRO 119 HB3 PRO 119 -1.773 12.875 -2.959 970 HG2 PRO 119 HG2 PRO 119 -2.505 15.625 -1.919 971 HG3 PRO 119 HG3 PRO 119 -3.410 14.571 -3.014 972 HD2 PRO 119 HD2 PRO 119 -4.035 14.753 -0.359 973 HD3 PRO 119 HD3 PRO 119 -4.258 13.247 -1.259 974 H GLU 120 H GLU 120 -0.091 13.236 1.480 975 HA GLU 120 HA GLU 120 1.946 15.199 0.855 976 HB2 GLU 120 HB2 GLU 120 1.297 16.533 2.922 977 HB3 GLU 120 HB3 GLU 120 0.251 16.736 1.511 978 HG2 GLU 120 HG2 GLU 120 -1.427 15.213 2.494 979 HG3 GLU 120 HG3 GLU 120 -0.369 14.902 3.877 980 H VAL 121 H VAL 121 3.858 14.432 1.750 981 HA VAL 121 HA VAL 121 3.623 12.243 3.649 982 HB VAL 121 HB VAL 121 6.018 13.808 2.566 983 HG11 VAL 121 HG11 VAL 121 7.388 11.844 3.161 984 HG12 VAL 121 HG12 VAL 121 6.622 12.636 4.579 985 HG13 VAL 121 HG13 VAL 121 5.947 11.101 3.935 986 HG21 VAL 121 HG21 VAL 121 6.405 11.972 0.975 987 HG22 VAL 121 HG22 VAL 121 4.846 11.236 1.477 988 HG23 VAL 121 HG23 VAL 121 4.865 12.852 0.694 989 H SER 122 H SER 122 3.789 12.528 5.816 990 HA SER 122 HA SER 122 4.433 15.183 6.850 991 HB2 SER 122 HB2 SER 122 3.315 14.116 8.953 992 HB3 SER 122 HB3 SER 122 2.280 14.558 7.589 993 HG SER 122 HG SER 122 1.825 12.410 8.388 994 HA PRO 123 HA PRO 123 8.332 13.930 8.469 995 HB2 PRO 123 HB2 PRO 123 8.165 15.540 10.833 996 HB3 PRO 123 HB3 PRO 123 8.786 16.122 9.283 997 HG2 PRO 123 HG2 PRO 123 6.046 16.463 10.492 998 HG3 PRO 123 HG3 PRO 123 6.990 17.598 9.517 999 HD2 PRO 123 HD2 PRO 123 4.917 16.244 8.423 1000 HD3 PRO 123 HD3 PRO 123 6.374 16.565 7.472 1001 H ALA 124 H ALA 124 5.565 14.170 10.856 1002 HA ALA 124 HA ALA 124 6.680 12.468 12.757 1003 HB1 ALA 124 HB1 ALA 124 4.339 12.142 13.495 1004 HB2 ALA 124 HB2 ALA 124 4.700 13.867 13.149 1005 HB3 ALA 124 HB3 ALA 124 3.760 12.892 11.969 1006 H ALA 125 H ALA 125 4.552 11.684 9.914 1007 HA ALA 125 HA ALA 125 4.417 8.920 10.425 1008 HB1 ALA 125 HB1 ALA 125 3.669 8.750 8.090 1009 HB2 ALA 125 HB2 ALA 125 2.827 10.064 8.979 1010 HB3 ALA 125 HB3 ALA 125 4.138 10.462 7.817 1011 H THR 126 H THR 126 6.822 11.019 8.792 1012 HA THR 126 HA THR 126 8.174 9.008 7.390 1013 HB THR 126 HB THR 126 9.235 11.631 8.557 1014 HG1 THR 126 HG1 THR 126 7.506 12.211 7.254 1015 HG21 THR 126 HG21 THR 126 10.831 11.533 6.657 1016 HG22 THR 126 HG22 THR 126 11.004 10.117 7.748 1017 HG23 THR 126 HG23 THR 126 10.150 9.941 6.178 1018 H ALA 127 H ALA 127 8.746 10.467 10.710 1019 HA ALA 127 HA ALA 127 11.016 8.757 11.133 1020 HB1 ALA 127 HB1 ALA 127 10.986 9.784 13.399 1021 HB2 ALA 127 HB2 ALA 127 10.914 11.018 12.097 1022 HB3 ALA 127 HB3 ALA 127 9.427 10.582 13.004 1023 H ILE 128 H ILE 128 7.513 8.741 12.083 1024 HA ILE 128 HA ILE 128 7.650 6.880 14.113 1025 HB ILE 128 HB ILE 128 5.590 7.375 11.920 1026 HG12 ILE 128 HG12 ILE 128 5.884 9.208 13.502 1027 HG13 ILE 128 HG13 ILE 128 4.302 8.446 13.721 1028 HG21 ILE 128 HG21 ILE 128 3.973 6.055 13.245 1029 HG22 ILE 128 HG22 ILE 128 5.328 5.055 12.620 1030 HG23 ILE 128 HG23 ILE 128 5.301 5.553 14.345 1031 HD11 ILE 128 HD11 ILE 128 5.336 8.975 15.879 1032 HD12 ILE 128 HD12 ILE 128 5.159 7.199 15.679 1033 HD13 ILE 128 HD13 ILE 128 6.765 7.972 15.457 1034 H PHE 129 H PHE 129 7.409 6.350 10.445 1035 HA PHE 129 HA PHE 129 7.435 3.510 10.684 1036 HB2 PHE 129 HB2 PHE 129 6.670 4.886 8.698 1037 HB3 PHE 129 HB3 PHE 129 8.334 5.435 8.455 1038 HD1 PHE 129 HD1 PHE 129 10.134 3.608 7.963 1039 HD2 PHE 129 HD2 PHE 129 5.898 2.970 7.697 1040 HE1 PHE 129 HE1 PHE 129 10.522 1.645 6.495 1041 HE2 PHE 129 HE2 PHE 129 6.277 1.019 6.231 1042 HZ PHE 129 HZ PHE 129 8.589 0.347 5.625 1043 H ARG 130 H ARG 130 10.086 5.832 9.538 1044 HA ARG 130 HA ARG 130 12.103 4.026 9.318 1045 HB2 ARG 130 HB2 ARG 130 12.209 6.522 8.885 1046 HB3 ARG 130 HB3 ARG 130 12.159 6.825 10.627 1047 HG2 ARG 130 HG2 ARG 130 14.354 5.245 10.580 1048 HG3 ARG 130 HG3 ARG 130 14.434 5.835 8.915 1049 HD2 ARG 130 HD2 ARG 130 14.337 7.551 11.453 1050 HD3 ARG 130 HD3 ARG 130 15.744 7.294 10.414 1051 HE ARG 130 HE ARG 130 13.891 8.373 8.689 1052 HH11 ARG 130 HH11 ARG 130 15.250 9.359 11.781 1053 HH12 ARG 130 HH12 ARG 130 15.004 11.048 11.488 1054 HH21 ARG 130 HH21 ARG 130 13.554 10.594 8.330 1055 HH22 ARG 130 HH22 ARG 130 14.040 11.749 9.526 1056 H LYS 131 H LYS 131 10.955 5.511 12.510 1057 HA LYS 131 HA LYS 131 13.036 4.522 14.055 1058 HB2 LYS 131 HB2 LYS 131 10.047 4.898 14.569 1059 HB3 LYS 131 HB3 LYS 131 11.142 4.344 15.842 1060 HG2 LYS 131 HG2 LYS 131 12.514 6.435 15.504 1061 HG3 LYS 131 HG3 LYS 131 11.311 6.994 14.334 1062 HD2 LYS 131 HD2 LYS 131 9.553 7.005 16.035 1063 HD3 LYS 131 HD3 LYS 131 10.609 6.208 17.209 1064 HE2 LYS 131 HE2 LYS 131 12.182 8.200 17.054 1065 HE3 LYS 131 HE3 LYS 131 10.998 9.001 16.012 1066 HZ1 LYS 131 HZ1 LYS 131 10.752 9.656 18.298 1067 HZ2 LYS 131 HZ2 LYS 131 9.411 8.855 17.820 1068 HZ3 LYS 131 HZ3 LYS 131 10.505 8.116 18.781 1069 H LEU 132 H LEU 132 9.795 2.848 13.395 1070 HA LEU 132 HA LEU 132 10.555 0.445 14.651 1071 HB2 LEU 132 HB2 LEU 132 8.549 1.010 12.426 1072 HB3 LEU 132 HB3 LEU 132 8.688 -0.528 13.288 1073 HG LEU 132 HG LEU 132 7.971 2.152 14.555 1074 HD11 LEU 132 HD11 LEU 132 5.715 1.165 14.798 1075 HD12 LEU 132 HD12 LEU 132 6.202 1.312 13.075 1076 HD13 LEU 132 HD13 LEU 132 6.259 -0.287 13.891 1077 HD21 LEU 132 HD21 LEU 132 7.412 0.800 16.548 1078 HD22 LEU 132 HD22 LEU 132 8.027 -0.669 15.718 1079 HD23 LEU 132 HD23 LEU 132 9.151 0.674 16.117 1080 H ALA 133 H ALA 133 10.976 1.751 11.318 1081 HA ALA 133 HA ALA 133 11.690 -0.577 10.006 1082 HB1 ALA 133 HB1 ALA 133 12.884 0.937 8.455 1083 HB2 ALA 133 HB2 ALA 133 11.257 1.563 8.887 1084 HB3 ALA 133 HB3 ALA 133 12.723 2.273 9.644 1085 H GLY 134 H GLY 134 13.648 1.507 12.258 1086 HA2 GLY 134 HA2 GLY 134 16.119 0.248 11.540 1087 HA3 GLY 134 HA3 GLY 134 15.801 1.309 12.918 1088 H GLU 135 H GLU 135 13.483 -0.352 13.933 1089 HA GLU 135 HA GLU 135 14.886 -2.040 15.671 1090 HB2 GLU 135 HB2 GLU 135 12.717 -1.196 16.273 1091 HB3 GLU 135 HB3 GLU 135 11.976 -1.808 14.789 1092 HG2 GLU 135 HG2 GLU 135 12.557 -4.174 15.643 1093 HG3 GLU 135 HG3 GLU 135 12.940 -3.413 17.193 1094 H ARG 136 H ARG 136 13.643 -2.497 12.360 1095 HA ARG 136 HA ARG 136 14.022 -5.403 12.568 1096 HB2 ARG 136 HB2 ARG 136 13.082 -3.944 10.090 1097 HB3 ARG 136 HB3 ARG 136 12.630 -5.545 10.689 1098 HG2 ARG 136 HG2 ARG 136 11.273 -4.523 12.487 1099 HG3 ARG 136 HG3 ARG 136 11.775 -2.906 11.977 1100 HD2 ARG 136 HD2 ARG 136 9.715 -3.079 10.914 1101 HD3 ARG 136 HD3 ARG 136 10.799 -3.620 9.626 1102 HE ARG 136 HE ARG 136 9.756 -5.677 9.706 1103 HH11 ARG 136 HH11 ARG 136 9.333 -4.142 12.851 1104 HH12 ARG 136 HH12 ARG 136 8.312 -5.401 13.462 1105 HH21 ARG 136 HH21 ARG 136 8.407 -7.311 10.521 1106 HH22 ARG 136 HH22 ARG 136 7.786 -7.205 12.134 1107 H ASN 137 H ASN 137 16.271 -3.209 12.496 1108 HA ASN 137 HA ASN 137 18.192 -2.844 11.484 1109 HB2 ASN 137 HB2 ASN 137 17.846 -5.787 10.780 1110 HB3 ASN 137 HB3 ASN 137 19.336 -4.879 10.491 1111 HD21 ASN 137 HD21 ASN 137 20.505 -4.009 12.348 1112 HD22 ASN 137 HD22 ASN 137 20.310 -4.723 13.914 1113 H TYR 138 H TYR 138 16.017 -1.851 9.913 1114 HA TYR 138 HA TYR 138 16.170 -2.870 7.259 1115 HB2 TYR 138 HB2 TYR 138 14.533 -1.268 6.837 1116 HB3 TYR 138 HB3 TYR 138 14.372 -1.358 8.596 1117 HD1 TYR 138 HD1 TYR 138 15.912 0.390 9.961 1118 HD2 TYR 138 HD2 TYR 138 14.810 0.839 5.830 1119 HE1 TYR 138 HE1 TYR 138 16.369 2.821 10.101 1120 HE2 TYR 138 HE2 TYR 138 15.262 3.270 5.975 1121 HH TYR 138 HH TYR 138 15.921 4.960 7.234 1122 H THR 139 H THR 139 16.995 -1.641 5.365 1123 HA THR 139 HA THR 139 19.403 -0.073 6.085 1124 HB THR 139 HB THR 139 19.423 -1.005 3.371 1125 HG1 THR 139 HG1 THR 139 19.326 -3.336 3.801 1126 HG21 THR 139 HG21 THR 139 21.431 -2.239 4.144 1127 HG22 THR 139 HG22 THR 139 21.392 -0.567 4.797 1128 HG23 THR 139 HG23 THR 139 20.946 -1.952 5.849 1129 H ASP 140 H ASP 140 19.863 1.826 4.586 1130 HA ASP 140 HA ASP 140 17.628 3.428 4.262 1131 HB2 ASP 140 HB2 ASP 140 19.848 4.413 4.216 1132 HB3 ASP 140 HB3 ASP 140 20.441 3.231 3.041 1133 H GLU 141 H GLU 141 19.323 1.578 1.589 1134 HA GLU 141 HA GLU 141 17.444 2.383 -0.324 1135 HB2 GLU 141 HB2 GLU 141 19.245 -0.055 -0.445 1136 HB3 GLU 141 HB3 GLU 141 18.424 0.729 -1.801 1137 HG2 GLU 141 HG2 GLU 141 19.737 2.882 -0.961 1138 HG3 GLU 141 HG3 GLU 141 20.783 1.692 -0.177 1139 H MET 142 H MET 142 16.953 0.190 2.280 1140 HA MET 142 HA MET 142 15.267 -1.641 0.798 1141 HB2 MET 142 HB2 MET 142 16.514 -2.350 2.805 1142 HB3 MET 142 HB3 MET 142 15.794 -1.050 3.764 1143 HG2 MET 142 HG2 MET 142 13.527 -2.126 3.376 1144 HG3 MET 142 HG3 MET 142 14.363 -3.481 2.607 1145 HE1 MET 142 HE1 MET 142 15.962 -5.497 4.826 1146 HE2 MET 142 HE2 MET 142 16.534 -4.274 3.641 1147 HE3 MET 142 HE3 MET 142 16.993 -4.131 5.372 1148 H VAL 143 H VAL 143 14.957 1.499 2.375 1149 HA VAL 143 HA VAL 143 12.042 1.315 2.257 1150 HB VAL 143 HB VAL 143 13.757 3.276 3.840 1151 HG11 VAL 143 HG11 VAL 143 11.572 4.008 4.741 1152 HG12 VAL 143 HG12 VAL 143 11.666 4.275 2.968 1153 HG13 VAL 143 HG13 VAL 143 10.731 2.886 3.618 1154 HG21 VAL 143 HG21 VAL 143 12.788 2.079 5.777 1155 HG22 VAL 143 HG22 VAL 143 11.949 0.947 4.663 1156 HG23 VAL 143 HG23 VAL 143 13.743 0.968 4.738 1157 H ALA 144 H ALA 144 10.810 3.061 1.204 1158 HA ALA 144 HA ALA 144 12.397 4.883 -0.484 1159 HB1 ALA 144 HB1 ALA 144 10.907 4.399 -2.394 1160 HB2 ALA 144 HB2 ALA 144 11.864 2.963 -1.895 1161 HB3 ALA 144 HB3 ALA 144 10.129 3.086 -1.447 1162 H MET 145 H MET 145 11.859 6.899 -0.193 1163 HA MET 145 HA MET 145 9.125 7.554 0.510 1164 HB2 MET 145 HB2 MET 145 11.562 8.863 1.719 1165 HB3 MET 145 HB3 MET 145 9.918 9.504 1.839 1166 HG2 MET 145 HG2 MET 145 9.189 7.264 2.780 1167 HG3 MET 145 HG3 MET 145 10.889 6.776 2.800 1168 HE1 MET 145 HE1 MET 145 9.450 10.666 4.270 1169 HE2 MET 145 HE2 MET 145 8.462 9.427 3.425 1170 HE3 MET 145 HE3 MET 145 8.441 9.521 5.218 1171 H LEU 146 H LEU 146 7.930 9.238 -0.438 1172 HA LEU 146 HA LEU 146 9.574 10.660 -2.423 1173 HB2 LEU 146 HB2 LEU 146 6.732 9.784 -2.791 1174 HB3 LEU 146 HB3 LEU 146 7.552 10.928 -3.836 1175 HG LEU 146 HG LEU 146 7.629 8.744 -4.847 1176 HD11 LEU 146 HD11 LEU 146 10.063 8.388 -5.073 1177 HD12 LEU 146 HD12 LEU 146 9.627 10.129 -5.141 1178 HD13 LEU 146 HD13 LEU 146 10.346 9.441 -3.646 1179 HD21 LEU 146 HD21 LEU 146 8.716 6.811 -3.732 1180 HD22 LEU 146 HD22 LEU 146 8.923 7.796 -2.244 1181 HD23 LEU 146 HD23 LEU 146 7.275 7.384 -2.826 1182 HA PRO 147 HA PRO 147 8.135 14.224 0.013 1183 HB2 PRO 147 HB2 PRO 147 9.623 16.169 -1.300 1184 HB3 PRO 147 HB3 PRO 147 10.404 15.084 -0.142 1185 HG2 PRO 147 HG2 PRO 147 10.321 14.909 -3.167 1186 HG3 PRO 147 HG3 PRO 147 11.692 14.668 -2.076 1187 HD2 PRO 147 HD2 PRO 147 10.312 12.552 -3.146 1188 HD3 PRO 147 HD3 PRO 147 11.056 12.458 -1.545 1189 H ARG 148 H ARG 148 7.877 16.808 -1.258 1190 HA ARG 148 HA ARG 148 5.348 16.539 -2.465 1191 HB2 ARG 148 HB2 ARG 148 5.246 18.861 -2.507 1192 HB3 ARG 148 HB3 ARG 148 6.268 18.500 -1.110 1193 HG2 ARG 148 HG2 ARG 148 7.192 19.458 -3.855 1194 HG3 ARG 148 HG3 ARG 148 7.184 20.387 -2.350 1195 HD2 ARG 148 HD2 ARG 148 8.724 17.769 -2.576 1196 HD3 ARG 148 HD3 ARG 148 9.421 19.291 -3.145 1197 HE ARG 148 HE ARG 148 8.388 19.233 -0.369 1198 HH11 ARG 148 HH11 ARG 148 11.155 19.112 -2.534 1199 HH12 ARG 148 HH12 ARG 148 12.293 19.532 -1.298 1200 HH21 ARG 148 HH21 ARG 148 9.892 19.813 1.235 1201 HH22 ARG 148 HH22 ARG 148 11.575 19.931 0.845 1202 H GLN 149 H GLN 149 6.474 14.854 -3.983 1203 HA GLN 149 HA GLN 149 7.075 16.104 -6.513 1204 HB2 GLN 149 HB2 GLN 149 8.925 14.795 -5.614 1205 HB3 GLN 149 HB3 GLN 149 7.947 13.334 -5.801 1206 HG2 GLN 149 HG2 GLN 149 7.670 14.506 -8.297 1207 HG3 GLN 149 HG3 GLN 149 9.311 14.996 -7.856 1208 HE21 GLN 149 HE21 GLN 149 9.837 12.685 -6.151 1209 HE22 GLN 149 HE22 GLN 149 10.047 11.325 -7.203 1210 H GLU 150 H GLU 150 4.285 15.599 -5.453 1211 HA GLU 150 HA GLU 150 3.413 13.444 -7.176 1212 HB2 GLU 150 HB2 GLU 150 1.192 13.893 -6.141 1213 HB3 GLU 150 HB3 GLU 150 2.455 13.624 -4.932 1214 HG2 GLU 150 HG2 GLU 150 1.164 15.439 -4.114 1215 HG3 GLU 150 HG3 GLU 150 2.660 16.161 -4.721 1216 H GLU 151 H GLU 151 1.475 13.616 -8.574 1217 HA GLU 151 HA GLU 151 0.848 16.153 -9.761 1218 HB2 GLU 151 HB2 GLU 151 3.106 15.683 -10.755 1219 HB3 GLU 151 HB3 GLU 151 2.497 14.138 -11.365 1220 HG2 GLU 151 HG2 GLU 151 0.675 15.526 -12.575 1221 HG3 GLU 151 HG3 GLU 151 1.661 16.943 -12.187 1222 H CYS 152 H CYS 152 1.057 12.553 -10.356 1223 HA CYS 152 HA CYS 152 -1.780 12.550 -11.212 1224 HB2 CYS 152 HB2 CYS 152 -0.188 11.953 -12.950 1225 HB3 CYS 152 HB3 CYS 152 0.486 10.692 -11.910 1226 H THR 153 H THR 153 -2.915 11.431 -10.449 1227 HA THR 153 HA THR 153 -2.799 10.237 -7.984 1228 HB THR 153 HB THR 153 -4.281 10.653 -6.768 1229 HG1 THR 153 HG1 THR 153 -5.012 12.908 -7.067 1230 HG21 THR 153 HG21 THR 153 -2.998 12.498 -5.817 1231 HG22 THR 153 HG22 THR 153 -1.928 11.206 -6.459 1232 HG23 THR 153 HG23 THR 153 -2.147 12.731 -7.382 1233 H VAL 154 H VAL 154 -5.465 9.700 -7.516 1234 HA VAL 154 HA VAL 154 -6.280 8.411 -10.076 1235 HB VAL 154 HB VAL 154 -5.309 6.725 -8.555 1236 HG11 VAL 154 HG11 VAL 154 -6.415 6.331 -6.407 1237 HG12 VAL 154 HG12 VAL 154 -5.713 7.983 -6.463 1238 HG13 VAL 154 HG13 VAL 154 -7.481 7.752 -6.673 1239 HG21 VAL 154 HG21 VAL 154 -7.316 5.289 -8.610 1240 HG22 VAL 154 HG22 VAL 154 -8.361 6.731 -8.847 1241 HG23 VAL 154 HG23 VAL 154 -7.190 6.251 -10.122 1242 H ASP 155 H ASP 155 -8.764 8.248 -10.331 1243 HA ASP 155 HA ASP 155 -10.043 10.524 -9.053 1244 HB2 ASP 155 HB2 ASP 155 -10.578 9.998 -11.399 1245 HB3 ASP 155 HB3 ASP 155 -11.103 8.368 -10.959 1246 H GLU 156 H GLU 156 -12.082 10.280 -7.676 1247 HA GLU 156 HA GLU 156 -12.047 7.710 -6.239 1248 HB2 GLU 156 HB2 GLU 156 -12.903 8.963 -4.287 1249 HB3 GLU 156 HB3 GLU 156 -11.297 9.495 -4.802 1250 HG2 GLU 156 HG2 GLU 156 -12.376 11.442 -5.991 1251 HG3 GLU 156 HG3 GLU 156 -13.938 10.931 -5.337 1252 H VAL 157 H VAL 157 -14.314 10.392 -7.313 1253 HA VAL 157 HA VAL 157 -16.159 8.661 -8.374 1254 HB VAL 157 HB VAL 157 -16.446 7.779 -6.078 1255 HG11 VAL 157 HG11 VAL 157 -17.499 9.166 -4.324 1256 HG12 VAL 157 HG12 VAL 157 -15.872 9.770 -4.788 1257 HG13 VAL 157 HG13 VAL 157 -17.345 10.608 -5.384 1258 HG21 VAL 157 HG21 VAL 157 -18.905 7.987 -5.952 1259 HG22 VAL 157 HG22 VAL 157 -18.841 9.352 -7.118 1260 HG23 VAL 157 HG23 VAL 157 -18.329 7.708 -7.630 1261 HN1 EB4 158 HN1 EB4 158 4.367 -5.805 -7.641 1262 H8 EB4 158 H8 EB4 158 -1.697 -6.549 -4.440 1263 HN2 EB4 158 HN2 EB4 158 1.533 -5.162 -8.938 1264 H9 EB4 158 H9 EB4 158 1.272 -0.659 -3.288 1265 H10 EB4 158 H10 EB4 158 5.853 -7.393 -2.120 1266 HN3 EB4 158 HN3 EB4 158 3.862 -2.749 -8.083 1267 H7 EB4 158 H7 EB4 158 3.894 -5.898 -1.818 1268 H11 EB4 158 H11 EB4 158 -3.208 -7.282 -6.270 1269 H12 EB4 158 H12 EB4 158 2.511 1.352 -4.006 1270 H15 EB4 158 H15 EB4 158 3.874 1.297 -6.075 1271 H14 EB4 158 H14 EB4 158 -2.505 -7.021 -8.633 1272 H13 EB4 158 H13 EB4 158 6.541 -8.075 -4.400 1273 H22 EB4 158 H22 EB4 158 5.183 -6.557 -8.156 1274 H30 EB4 158 H30 EB4 158 6.249 -3.162 -10.828 1275 H30A EB4 158 H30A EB4 158 6.648 -2.602 -9.134 1276 H24 EB4 158 H24 EB4 158 4.289 -1.922 -8.876 1277 H28 EB4 158 H28 EB4 158 4.138 -8.342 -9.622 1278 H28A EB4 158 H28A EB4 158 4.725 -7.361 -11.060 1279 H23 EB4 158 H23 EB4 158 1.097 -5.328 -10.075 1280 H29 EB4 158 H29 EB4 158 0.701 -3.263 -11.172 1281 H29A EB4 158 H29A EB4 158 2.085 -3.679 -12.373 Start of MODEL 17 1 H1 MET 1 H1 MET 1 -28.900 3.592 -4.772 2 H2 MET 1 H2 MET 1 -27.917 3.695 -3.472 3 H3 MET 1 H3 MET 1 -28.536 5.052 -4.137 4 HA MET 1 HA MET 1 -26.472 3.274 -5.188 5 HB2 MET 1 HB2 MET 1 -27.921 5.474 -6.734 6 HB3 MET 1 HB3 MET 1 -26.539 4.531 -7.308 7 HG2 MET 1 HG2 MET 1 -28.099 2.450 -6.873 8 HG3 MET 1 HG3 MET 1 -29.405 3.642 -6.883 9 HE1 MET 1 HE1 MET 1 -30.074 2.473 -10.460 10 HE2 MET 1 HE2 MET 1 -29.889 1.562 -8.923 11 HE3 MET 1 HE3 MET 1 -30.764 3.131 -8.938 12 H THR 2 H THR 2 -24.419 4.155 -4.832 13 HA THR 2 HA THR 2 -22.887 5.527 -3.981 14 HB THR 2 HB THR 2 -24.408 7.822 -5.291 15 HG1 THR 2 HG1 THR 2 -23.325 7.122 -7.280 16 HG21 THR 2 HG21 THR 2 -22.114 8.592 -5.815 17 HG22 THR 2 HG22 THR 2 -22.341 8.355 -4.050 18 HG23 THR 2 HG23 THR 2 -21.442 7.134 -5.011 19 H VAL 3 H VAL 3 -24.793 4.928 -2.035 20 HA VAL 3 HA VAL 3 -25.706 7.423 -0.898 21 HB VAL 3 HB VAL 3 -26.690 5.968 0.870 22 HG11 VAL 3 HG11 VAL 3 -28.362 4.850 -0.573 23 HG12 VAL 3 HG12 VAL 3 -27.986 6.512 -1.139 24 HG13 VAL 3 HG13 VAL 3 -27.289 5.094 -1.993 25 HG21 VAL 3 HG21 VAL 3 -26.661 3.513 0.598 26 HG22 VAL 3 HG22 VAL 3 -25.503 3.683 -0.764 27 HG23 VAL 3 HG23 VAL 3 -25.020 4.181 0.892 28 HA PRO 4 HA PRO 4 -22.168 7.760 1.814 29 HB2 PRO 4 HB2 PRO 4 -23.234 9.533 3.653 30 HB3 PRO 4 HB3 PRO 4 -22.926 10.072 1.997 31 HG2 PRO 4 HG2 PRO 4 -25.531 9.163 3.255 32 HG3 PRO 4 HG3 PRO 4 -25.232 10.548 2.196 33 HD2 PRO 4 HD2 PRO 4 -26.277 8.181 1.265 34 HD3 PRO 4 HD3 PRO 4 -25.294 9.243 0.250 35 H ASP 5 H ASP 5 -23.298 5.288 2.190 36 HA ASP 5 HA ASP 5 -23.832 5.174 5.077 37 HB2 ASP 5 HB2 ASP 5 -24.471 3.409 2.717 38 HB3 ASP 5 HB3 ASP 5 -24.245 2.649 4.298 39 H ARG 6 H ARG 6 -22.496 2.369 3.312 40 HA ARG 6 HA ARG 6 -20.521 1.961 5.225 41 HB2 ARG 6 HB2 ARG 6 -21.123 0.896 2.468 42 HB3 ARG 6 HB3 ARG 6 -19.533 0.549 3.158 43 HG2 ARG 6 HG2 ARG 6 -20.905 -1.306 3.732 44 HG3 ARG 6 HG3 ARG 6 -20.730 -0.366 5.220 45 HD2 ARG 6 HD2 ARG 6 -23.047 -0.932 5.090 46 HD3 ARG 6 HD3 ARG 6 -22.951 0.777 4.644 47 HE ARG 6 HE ARG 6 -23.052 -0.036 2.231 48 HH11 ARG 6 HH11 ARG 6 -24.340 -1.985 4.857 49 HH12 ARG 6 HH12 ARG 6 -25.498 -2.793 3.854 50 HH21 ARG 6 HH21 ARG 6 -24.576 -1.113 0.924 51 HH22 ARG 6 HH22 ARG 6 -25.632 -2.297 1.618 52 H SER 7 H SER 7 -20.512 4.062 2.368 53 HA SER 7 HA SER 7 -17.858 4.190 1.702 54 HB2 SER 7 HB2 SER 7 -19.496 6.731 1.993 55 HB3 SER 7 HB3 SER 7 -18.446 6.225 0.663 56 HG SER 7 HG SER 7 -21.130 5.868 0.935 57 H GLU 8 H GLU 8 -19.401 5.463 4.686 58 HA GLU 8 HA GLU 8 -17.447 7.322 5.401 59 HB2 GLU 8 HB2 GLU 8 -19.400 5.533 6.903 60 HB3 GLU 8 HB3 GLU 8 -18.249 6.532 7.800 61 HG2 GLU 8 HG2 GLU 8 -20.194 7.653 5.731 62 HG3 GLU 8 HG3 GLU 8 -20.564 7.531 7.456 63 H ILE 9 H ILE 9 -17.409 3.790 5.480 64 HA ILE 9 HA ILE 9 -15.046 3.734 7.109 65 HB ILE 9 HB ILE 9 -16.454 1.260 6.085 66 HG12 ILE 9 HG12 ILE 9 -16.782 2.773 8.731 67 HG13 ILE 9 HG13 ILE 9 -17.920 2.929 7.387 68 HG21 ILE 9 HG21 ILE 9 -15.297 0.299 8.061 69 HG22 ILE 9 HG22 ILE 9 -14.117 1.042 6.930 70 HG23 ILE 9 HG23 ILE 9 -14.586 1.906 8.433 71 HD11 ILE 9 HD11 ILE 9 -18.738 1.337 9.057 72 HD12 ILE 9 HD12 ILE 9 -18.406 0.508 7.498 73 HD13 ILE 9 HD13 ILE 9 -17.250 0.350 8.864 74 H ALA 10 H ALA 10 -15.469 4.383 3.899 75 HA ALA 10 HA ALA 10 -12.977 2.971 3.196 76 HB1 ALA 10 HB1 ALA 10 -13.962 2.687 0.913 77 HB2 ALA 10 HB2 ALA 10 -14.932 1.834 2.161 78 HB3 ALA 10 HB3 ALA 10 -15.501 3.403 1.499 79 H GLY 11 H GLY 11 -12.507 4.024 0.670 80 HA2 GLY 11 HA2 GLY 11 -12.894 6.509 -0.051 81 HA3 GLY 11 HA3 GLY 11 -11.946 6.799 1.413 82 H LYS 12 H LYS 12 -10.277 7.780 0.078 83 HA LYS 12 HA LYS 12 -8.696 5.795 -1.422 84 HB2 LYS 12 HB2 LYS 12 -7.758 7.787 -2.619 85 HB3 LYS 12 HB3 LYS 12 -9.466 7.465 -2.943 86 HG2 LYS 12 HG2 LYS 12 -10.060 9.241 -1.234 87 HG3 LYS 12 HG3 LYS 12 -8.338 9.616 -1.092 88 HD2 LYS 12 HD2 LYS 12 -8.223 10.158 -3.506 89 HD3 LYS 12 HD3 LYS 12 -9.917 9.695 -3.715 90 HE2 LYS 12 HE2 LYS 12 -9.813 12.114 -3.533 91 HE3 LYS 12 HE3 LYS 12 -10.581 11.484 -2.070 92 HZ1 LYS 12 HZ1 LYS 12 -8.854 13.189 -1.695 93 HZ2 LYS 12 HZ2 LYS 12 -8.578 11.802 -0.879 94 HZ3 LYS 12 HZ3 LYS 12 -7.713 12.145 -2.220 95 H TRP 13 H TRP 13 -6.462 5.567 -0.924 96 HA TRP 13 HA TRP 13 -5.508 7.313 1.263 97 HB2 TRP 13 HB2 TRP 13 -4.860 4.356 0.877 98 HB3 TRP 13 HB3 TRP 13 -4.334 5.402 2.203 99 HD1 TRP 13 HD1 TRP 13 -6.558 2.678 1.827 100 HE1 TRP 13 HE1 TRP 13 -8.599 2.786 3.407 101 HE3 TRP 13 HE3 TRP 13 -6.338 7.655 3.088 102 HZ2 TRP 13 HZ2 TRP 13 -9.948 4.700 4.967 103 HZ3 TRP 13 HZ3 TRP 13 -8.054 8.556 4.640 104 HH2 TRP 13 HH2 TRP 13 -9.830 7.099 5.562 105 H TYR 14 H TYR 14 -3.389 8.146 0.898 106 HA TYR 14 HA TYR 14 -2.233 7.394 -1.701 107 HB2 TYR 14 HB2 TYR 14 -1.639 9.757 0.155 108 HB3 TYR 14 HB3 TYR 14 -0.992 9.514 -1.473 109 HD1 TYR 14 HD1 TYR 14 -4.169 10.069 0.434 110 HD2 TYR 14 HD2 TYR 14 -2.240 10.192 -3.401 111 HE1 TYR 14 HE1 TYR 14 -6.148 11.206 -0.520 112 HE2 TYR 14 HE2 TYR 14 -4.226 11.318 -4.364 113 HH TYR 14 HH TYR 14 -6.504 11.701 -3.992 114 H VAL 15 H VAL 15 -0.331 6.070 -1.772 115 HA VAL 15 HA VAL 15 0.864 5.659 0.892 116 HB VAL 15 HB VAL 15 0.291 3.758 -0.489 117 HG11 VAL 15 HG11 VAL 15 1.429 3.261 -2.666 118 HG12 VAL 15 HG12 VAL 15 0.345 4.691 -2.731 119 HG13 VAL 15 HG13 VAL 15 2.124 4.917 -2.639 120 HG21 VAL 15 HG21 VAL 15 2.447 2.545 -0.653 121 HG22 VAL 15 HG22 VAL 15 3.304 4.096 -0.358 122 HG23 VAL 15 HG23 VAL 15 2.215 3.418 0.899 123 H VAL 16 H VAL 16 2.474 6.951 1.461 124 HA VAL 16 HA VAL 16 3.903 8.382 -0.623 125 HB VAL 16 HB VAL 16 4.667 9.864 1.244 126 HG11 VAL 16 HG11 VAL 16 2.502 10.982 1.685 127 HG12 VAL 16 HG12 VAL 16 2.691 10.502 -0.035 128 HG13 VAL 16 HG13 VAL 16 1.641 9.537 1.056 129 HG21 VAL 16 HG21 VAL 16 3.568 9.705 3.468 130 HG22 VAL 16 HG22 VAL 16 2.790 8.169 2.958 131 HG23 VAL 16 HG23 VAL 16 4.578 8.267 3.099 132 H ALA 17 H ALA 17 4.321 5.691 1.536 133 HA ALA 17 HA ALA 17 7.196 5.841 0.943 134 HB1 ALA 17 HB1 ALA 17 7.668 4.955 3.210 135 HB2 ALA 17 HB2 ALA 17 6.905 6.580 3.271 136 HB3 ALA 17 HB3 ALA 17 5.929 5.115 3.627 137 H LEU 18 H LEU 18 8.231 3.749 0.720 138 HA LEU 18 HA LEU 18 6.512 1.402 0.942 139 HB2 LEU 18 HB2 LEU 18 7.981 2.170 -1.638 140 HB3 LEU 18 HB3 LEU 18 6.950 0.757 -1.383 141 HG LEU 18 HG LEU 18 5.812 3.553 -1.156 142 HD11 LEU 18 HD11 LEU 18 5.173 3.453 -3.545 143 HD12 LEU 18 HD12 LEU 18 6.954 3.509 -3.319 144 HD13 LEU 18 HD13 LEU 18 6.151 1.958 -3.736 145 HD21 LEU 18 HD21 LEU 18 3.739 2.389 -1.876 146 HD22 LEU 18 HD22 LEU 18 4.652 0.845 -1.968 147 HD23 LEU 18 HD23 LEU 18 4.436 1.668 -0.386 148 H ALA 19 H ALA 19 7.818 -0.469 1.390 149 HA ALA 19 HA ALA 19 10.720 -0.182 0.964 150 HB1 ALA 19 HB1 ALA 19 11.086 -1.097 3.242 151 HB2 ALA 19 HB2 ALA 19 10.240 0.486 3.308 152 HB3 ALA 19 HB3 ALA 19 9.318 -1.036 3.552 153 H SER 20 H SER 20 11.645 -2.162 0.281 154 HA SER 20 HA SER 20 10.002 -4.581 0.631 155 HB2 SER 20 HB2 SER 20 11.254 -3.708 -2.034 156 HB3 SER 20 HB3 SER 20 10.185 -5.088 -1.752 157 HG SER 20 HG SER 20 9.471 -2.628 -2.496 158 H ASN 21 H ASN 21 11.292 -6.523 0.679 159 HA ASN 21 HA ASN 21 14.110 -5.972 1.273 160 HB2 ASN 21 HB2 ASN 21 12.508 -7.396 2.705 161 HB3 ASN 21 HB3 ASN 21 12.531 -8.595 1.405 162 HD21 ASN 21 HD21 ASN 21 14.616 -9.544 0.815 163 HD22 ASN 21 HD22 ASN 21 15.860 -9.691 2.011 164 H THR 22 H THR 22 13.031 -5.805 -1.507 165 HA THR 22 HA THR 22 14.980 -7.703 -2.675 166 HB THR 22 HB THR 22 12.634 -6.697 -4.244 167 HG1 THR 22 HG1 THR 22 12.002 -9.047 -3.498 168 HG21 THR 22 HG21 THR 22 13.205 -8.707 -5.526 169 HG22 THR 22 HG22 THR 22 14.632 -7.624 -5.406 170 HG23 THR 22 HG23 THR 22 14.531 -9.093 -4.378 171 H GLU 23 H GLU 23 16.939 -6.964 -3.847 172 HA GLU 23 HA GLU 23 17.331 -4.165 -3.588 173 HB2 GLU 23 HB2 GLU 23 18.903 -4.959 -5.799 174 HB3 GLU 23 HB3 GLU 23 19.411 -4.836 -4.109 175 HG2 GLU 23 HG2 GLU 23 18.100 -7.350 -5.211 176 HG3 GLU 23 HG3 GLU 23 19.838 -7.059 -5.356 177 H PHE 24 H PHE 24 16.403 -6.150 -6.576 178 HA PHE 24 HA PHE 24 16.289 -4.081 -8.390 179 HB2 PHE 24 HB2 PHE 24 14.462 -6.527 -8.094 180 HB3 PHE 24 HB3 PHE 24 14.547 -5.516 -9.543 181 HD1 PHE 24 HD1 PHE 24 16.646 -5.438 -10.886 182 HD2 PHE 24 HD2 PHE 24 16.107 -8.204 -7.647 183 HE1 PHE 24 HE1 PHE 24 18.505 -6.815 -11.758 184 HE2 PHE 24 HE2 PHE 24 17.969 -9.587 -8.516 185 HZ PHE 24 HZ PHE 24 19.172 -8.894 -10.576 186 H PHE 25 H PHE 25 13.537 -5.327 -6.308 187 HA PHE 25 HA PHE 25 11.623 -3.542 -7.151 188 HB2 PHE 25 HB2 PHE 25 12.166 -5.022 -4.568 189 HB3 PHE 25 HB3 PHE 25 10.862 -3.828 -4.622 190 HD1 PHE 25 HD1 PHE 25 12.062 -7.063 -5.959 191 HD2 PHE 25 HD2 PHE 25 8.838 -4.231 -5.873 192 HE1 PHE 25 HE1 PHE 25 10.555 -8.753 -6.965 193 HE2 PHE 25 HE2 PHE 25 7.325 -5.916 -6.876 194 HZ PHE 25 HZ PHE 25 8.181 -8.180 -7.425 195 H LEU 26 H LEU 26 14.107 -3.140 -4.506 196 HA LEU 26 HA LEU 26 13.168 -0.630 -3.662 197 HB2 LEU 26 HB2 LEU 26 15.940 -1.926 -3.568 198 HB3 LEU 26 HB3 LEU 26 15.488 -0.469 -2.675 199 HG LEU 26 HG LEU 26 14.098 -3.155 -2.303 200 HD11 LEU 26 HD11 LEU 26 15.464 -3.397 -0.263 201 HD12 LEU 26 HD12 LEU 26 16.475 -3.382 -1.747 202 HD13 LEU 26 HD13 LEU 26 16.385 -1.921 -0.707 203 HD21 LEU 26 HD21 LEU 26 13.342 -2.120 -0.188 204 HD22 LEU 26 HD22 LEU 26 14.183 -0.597 -0.636 205 HD23 LEU 26 HD23 LEU 26 12.799 -1.182 -1.620 206 H ARG 27 H ARG 27 15.961 -1.497 -5.883 207 HA ARG 27 HA ARG 27 16.775 1.114 -6.340 208 HB2 ARG 27 HB2 ARG 27 17.825 -1.175 -7.011 209 HB3 ARG 27 HB3 ARG 27 16.757 -1.124 -8.420 210 HG2 ARG 27 HG2 ARG 27 17.801 1.234 -8.870 211 HG3 ARG 27 HG3 ARG 27 19.052 0.745 -7.719 212 HD2 ARG 27 HD2 ARG 27 19.951 0.075 -9.791 213 HD3 ARG 27 HD3 ARG 27 19.269 -1.426 -9.151 214 HE ARG 27 HE ARG 27 17.189 -0.622 -10.609 215 HH11 ARG 27 HH11 ARG 27 20.604 -0.448 -11.434 216 HH12 ARG 27 HH12 ARG 27 20.318 -0.573 -13.138 217 HH21 ARG 27 HH21 ARG 27 16.829 -0.777 -12.821 218 HH22 ARG 27 HH22 ARG 27 18.160 -0.761 -13.929 219 H GLU 28 H GLU 28 14.334 -0.902 -8.220 220 HA GLU 28 HA GLU 28 13.818 1.159 -10.084 221 HB2 GLU 28 HB2 GLU 28 11.989 -1.103 -9.171 222 HB3 GLU 28 HB3 GLU 28 11.847 -0.164 -10.663 223 HG2 GLU 28 HG2 GLU 28 14.106 -2.080 -9.923 224 HG3 GLU 28 HG3 GLU 28 12.831 -2.360 -11.116 225 H LYS 29 H LYS 29 12.153 0.167 -6.967 226 HA LYS 29 HA LYS 29 10.073 1.998 -7.151 227 HB2 LYS 29 HB2 LYS 29 11.272 0.273 -5.112 228 HB3 LYS 29 HB3 LYS 29 10.679 1.794 -4.430 229 HG2 LYS 29 HG2 LYS 29 8.999 -0.015 -6.235 230 HG3 LYS 29 HG3 LYS 29 9.003 -0.124 -4.470 231 HD2 LYS 29 HD2 LYS 29 7.138 1.264 -4.995 232 HD3 LYS 29 HD3 LYS 29 8.389 2.378 -4.430 233 HE2 LYS 29 HE2 LYS 29 7.654 3.474 -6.349 234 HE3 LYS 29 HE3 LYS 29 9.029 2.565 -6.988 235 HZ1 LYS 29 HZ1 LYS 29 7.557 1.803 -8.441 236 HZ2 LYS 29 HZ2 LYS 29 6.966 0.847 -7.257 237 HZ3 LYS 29 HZ3 LYS 29 6.255 2.281 -7.579 238 H ASP 30 H ASP 30 13.386 2.373 -5.650 239 HA ASP 30 HA ASP 30 12.988 4.973 -4.684 240 HB2 ASP 30 HB2 ASP 30 14.872 3.864 -3.865 241 HB3 ASP 30 HB3 ASP 30 15.370 3.285 -5.460 242 H LYS 31 H LYS 31 13.786 3.716 -7.966 243 HA LYS 31 HA LYS 31 14.293 6.366 -8.866 244 HB2 LYS 31 HB2 LYS 31 14.144 3.750 -10.377 245 HB3 LYS 31 HB3 LYS 31 14.488 5.326 -11.102 246 HG2 LYS 31 HG2 LYS 31 16.157 3.953 -8.938 247 HG3 LYS 31 HG3 LYS 31 16.555 4.031 -10.659 248 HD2 LYS 31 HD2 LYS 31 17.833 5.783 -9.708 249 HD3 LYS 31 HD3 LYS 31 16.440 6.615 -10.411 250 HE2 LYS 31 HE2 LYS 31 15.634 5.887 -7.778 251 HE3 LYS 31 HE3 LYS 31 17.299 6.460 -7.616 252 HZ1 LYS 31 HZ1 LYS 31 15.415 8.143 -7.539 253 HZ2 LYS 31 HZ2 LYS 31 16.721 8.519 -8.444 254 HZ3 LYS 31 HZ3 LYS 31 15.349 8.006 -9.164 255 H MET 32 H MET 32 11.061 4.732 -8.108 256 HA MET 32 HA MET 32 10.542 6.357 -10.589 257 HB2 MET 32 HB2 MET 32 9.022 4.498 -8.542 258 HB3 MET 32 HB3 MET 32 8.200 5.129 -9.975 259 HG2 MET 32 HG2 MET 32 9.865 3.693 -11.352 260 HG3 MET 32 HG3 MET 32 10.271 2.909 -9.820 261 HE1 MET 32 HE1 MET 32 6.118 2.639 -11.943 262 HE2 MET 32 HE2 MET 32 6.353 3.948 -10.736 263 HE3 MET 32 HE3 MET 32 7.379 3.890 -12.209 264 H LYS 33 H LYS 33 7.518 6.054 -8.768 265 HA LYS 33 HA LYS 33 8.144 8.602 -7.391 266 HB2 LYS 33 HB2 LYS 33 5.908 8.288 -9.482 267 HB3 LYS 33 HB3 LYS 33 6.047 9.654 -8.368 268 HG2 LYS 33 HG2 LYS 33 8.121 10.414 -9.465 269 HG3 LYS 33 HG3 LYS 33 8.162 8.971 -10.487 270 HD2 LYS 33 HD2 LYS 33 5.978 9.701 -11.563 271 HD3 LYS 33 HD3 LYS 33 6.001 11.167 -10.574 272 HE2 LYS 33 HE2 LYS 33 8.539 10.705 -12.072 273 HE3 LYS 33 HE3 LYS 33 7.128 10.895 -13.120 274 HZ1 LYS 33 HZ1 LYS 33 8.363 12.963 -12.426 275 HZ2 LYS 33 HZ2 LYS 33 6.737 13.007 -12.276 276 HZ3 LYS 33 HZ3 LYS 33 7.673 12.801 -10.955 277 H MET 34 H MET 34 5.729 9.306 -6.308 278 HA MET 34 HA MET 34 5.264 7.114 -4.547 279 HB2 MET 34 HB2 MET 34 5.055 9.421 -3.804 280 HB3 MET 34 HB3 MET 34 3.913 9.803 -5.099 281 HG2 MET 34 HG2 MET 34 2.177 8.441 -4.062 282 HG3 MET 34 HG3 MET 34 3.311 7.831 -2.850 283 HE1 MET 34 HE1 MET 34 1.958 12.296 -3.020 284 HE2 MET 34 HE2 MET 34 3.143 11.590 -4.170 285 HE3 MET 34 HE3 MET 34 1.430 11.052 -4.203 286 H ALA 35 H ALA 35 3.138 6.175 -4.127 287 HA ALA 35 HA ALA 35 1.778 5.538 -6.640 288 HB1 ALA 35 HB1 ALA 35 1.336 3.311 -5.667 289 HB2 ALA 35 HB2 ALA 35 3.088 3.655 -5.862 290 HB3 ALA 35 HB3 ALA 35 2.328 3.757 -4.237 291 H MET 36 H MET 36 -0.527 4.509 -6.179 292 HA MET 36 HA MET 36 -1.751 6.277 -4.141 293 HB2 MET 36 HB2 MET 36 -2.684 5.351 -6.949 294 HB3 MET 36 HB3 MET 36 -3.721 6.228 -5.816 295 HG2 MET 36 HG2 MET 36 -1.128 7.410 -6.872 296 HG3 MET 36 HG3 MET 36 -2.655 7.541 -7.754 297 HE1 MET 36 HE1 MET 36 -1.729 11.018 -5.870 298 HE2 MET 36 HE2 MET 36 -0.476 9.738 -5.733 299 HE3 MET 36 HE3 MET 36 -1.317 10.007 -7.297 300 H ALA 37 H ALA 37 -3.896 5.362 -3.364 301 HA ALA 37 HA ALA 37 -4.375 2.577 -4.045 302 HB1 ALA 37 HB1 ALA 37 -4.294 1.997 -1.596 303 HB2 ALA 37 HB2 ALA 37 -2.687 2.567 -2.160 304 HB3 ALA 37 HB3 ALA 37 -3.751 3.668 -1.223 305 H ARG 38 H ARG 38 -6.488 2.312 -4.188 306 HA ARG 38 HA ARG 38 -8.283 3.972 -2.515 307 HB2 ARG 38 HB2 ARG 38 -8.255 4.966 -4.726 308 HB3 ARG 38 HB3 ARG 38 -8.398 3.382 -5.500 309 HG2 ARG 38 HG2 ARG 38 -10.609 3.995 -3.608 310 HG3 ARG 38 HG3 ARG 38 -10.491 5.122 -4.966 311 HD2 ARG 38 HD2 ARG 38 -10.651 3.319 -6.593 312 HD3 ARG 38 HD3 ARG 38 -10.452 2.085 -5.343 313 HE ARG 38 HE ARG 38 -12.718 2.232 -4.897 314 HH11 ARG 38 HH11 ARG 38 -11.763 5.139 -6.641 315 HH12 ARG 38 HH12 ARG 38 -13.383 5.742 -6.755 316 HH21 ARG 38 HH21 ARG 38 -14.825 3.048 -5.048 317 HH22 ARG 38 HH22 ARG 38 -15.121 4.554 -5.850 318 H ILE 39 H ILE 39 -9.459 2.558 -1.321 319 HA ILE 39 HA ILE 39 -9.649 -0.189 -2.291 320 HB ILE 39 HB ILE 39 -10.091 0.744 0.576 321 HG12 ILE 39 HG12 ILE 39 -7.846 1.427 0.029 322 HG13 ILE 39 HG13 ILE 39 -7.794 0.005 1.081 323 HG21 ILE 39 HG21 ILE 39 -9.618 -1.642 1.072 324 HG22 ILE 39 HG22 ILE 39 -11.019 -1.452 -0.035 325 HG23 ILE 39 HG23 ILE 39 -9.424 -1.961 -0.684 326 HD11 ILE 39 HD11 ILE 39 -6.106 -0.143 -0.691 327 HD12 ILE 39 HD12 ILE 39 -7.333 -1.442 -0.875 328 HD13 ILE 39 HD13 ILE 39 -7.386 0.001 -1.943 329 H SER 40 H SER 40 -11.716 -1.256 -2.228 330 HA SER 40 HA SER 40 -13.985 0.355 -1.342 331 HB2 SER 40 HB2 SER 40 -13.726 -0.775 -4.166 332 HB3 SER 40 HB3 SER 40 -15.169 -0.023 -3.474 333 HG SER 40 HG SER 40 -14.140 1.973 -3.382 334 H PHE 41 H PHE 41 -15.562 -0.825 -0.363 335 HA PHE 41 HA PHE 41 -14.971 -3.526 0.248 336 HB2 PHE 41 HB2 PHE 41 -17.227 -3.478 1.330 337 HB3 PHE 41 HB3 PHE 41 -16.157 -2.169 1.847 338 HD1 PHE 41 HD1 PHE 41 -19.199 -3.004 -0.105 339 HD2 PHE 41 HD2 PHE 41 -16.660 0.149 1.335 340 HE1 PHE 41 HE1 PHE 41 -20.948 -1.341 -0.663 341 HE2 PHE 41 HE2 PHE 41 -18.406 1.813 0.775 342 HZ PHE 41 HZ PHE 41 -20.557 1.073 -0.221 343 H LEU 42 H LEU 42 -15.583 -5.404 -0.744 344 HA LEU 42 HA LEU 42 -17.269 -5.121 -3.131 345 HB2 LEU 42 HB2 LEU 42 -14.852 -6.124 -3.085 346 HB3 LEU 42 HB3 LEU 42 -15.574 -7.504 -2.247 347 HG LEU 42 HG LEU 42 -15.232 -7.920 -4.648 348 HD11 LEU 42 HD11 LEU 42 -17.492 -8.763 -5.173 349 HD12 LEU 42 HD12 LEU 42 -17.017 -9.108 -3.476 350 HD13 LEU 42 HD13 LEU 42 -18.166 -7.775 -3.834 351 HD21 LEU 42 HD21 LEU 42 -16.638 -6.771 -6.331 352 HD22 LEU 42 HD22 LEU 42 -17.262 -5.676 -5.051 353 HD23 LEU 42 HD23 LEU 42 -15.522 -5.639 -5.495 354 H GLY 43 H GLY 43 -16.717 -7.292 -0.292 355 HA2 GLY 43 HA2 GLY 43 -19.566 -7.923 -0.176 356 HA3 GLY 43 HA3 GLY 43 -18.429 -9.245 -0.472 357 H GLU 44 H GLU 44 -19.869 -9.514 1.833 358 HA GLU 44 HA GLU 44 -18.925 -8.225 4.100 359 HB2 GLU 44 HB2 GLU 44 -19.906 -11.089 3.680 360 HB3 GLU 44 HB3 GLU 44 -19.643 -10.358 5.269 361 HG2 GLU 44 HG2 GLU 44 -21.276 -8.491 4.460 362 HG3 GLU 44 HG3 GLU 44 -21.709 -9.620 3.168 363 H ASP 45 H ASP 45 -17.461 -10.948 2.182 364 HA ASP 45 HA ASP 45 -15.198 -10.856 4.057 365 HB2 ASP 45 HB2 ASP 45 -16.390 -13.017 4.213 366 HB3 ASP 45 HB3 ASP 45 -16.296 -13.230 2.459 367 H GLU 46 H GLU 46 -16.129 -9.891 0.948 368 HA GLU 46 HA GLU 46 -13.381 -10.371 -0.076 369 HB2 GLU 46 HB2 GLU 46 -15.155 -11.650 -1.279 370 HB3 GLU 46 HB3 GLU 46 -16.031 -10.143 -1.580 371 HG2 GLU 46 HG2 GLU 46 -14.495 -9.389 -3.161 372 HG3 GLU 46 HG3 GLU 46 -13.160 -10.333 -2.486 373 H LEU 47 H LEU 47 -12.435 -8.630 -1.193 374 HA LEU 47 HA LEU 47 -13.747 -6.050 -1.009 375 HB2 LEU 47 HB2 LEU 47 -11.911 -5.021 0.180 376 HB3 LEU 47 HB3 LEU 47 -12.551 -6.361 1.140 377 HG LEU 47 HG LEU 47 -10.275 -7.063 -0.650 378 HD11 LEU 47 HD11 LEU 47 -8.607 -6.078 0.860 379 HD12 LEU 47 HD12 LEU 47 -9.598 -4.820 0.048 380 HD13 LEU 47 HD13 LEU 47 -9.915 -5.244 1.764 381 HD21 LEU 47 HD21 LEU 47 -9.595 -8.300 1.369 382 HD22 LEU 47 HD22 LEU 47 -10.944 -7.547 2.285 383 HD23 LEU 47 HD23 LEU 47 -11.296 -8.652 0.915 384 H LYS 48 H LYS 48 -12.936 -4.424 -2.365 385 HA LYS 48 HA LYS 48 -11.099 -5.431 -4.425 386 HB2 LYS 48 HB2 LYS 48 -13.378 -5.101 -5.258 387 HB3 LYS 48 HB3 LYS 48 -13.378 -3.433 -4.670 388 HG2 LYS 48 HG2 LYS 48 -11.948 -2.684 -6.339 389 HG3 LYS 48 HG3 LYS 48 -11.127 -4.242 -6.498 390 HD2 LYS 48 HD2 LYS 48 -13.996 -3.668 -7.400 391 HD3 LYS 48 HD3 LYS 48 -12.584 -3.694 -8.464 392 HE2 LYS 48 HE2 LYS 48 -13.496 -6.058 -6.742 393 HE3 LYS 48 HE3 LYS 48 -13.910 -5.849 -8.448 394 HZ1 LYS 48 HZ1 LYS 48 -11.793 -7.171 -7.648 395 HZ2 LYS 48 HZ2 LYS 48 -11.829 -6.380 -9.076 396 HZ3 LYS 48 HZ3 LYS 48 -11.095 -5.702 -7.785 397 H VAL 49 H VAL 49 -9.282 -4.153 -5.000 398 HA VAL 49 HA VAL 49 -9.150 -1.546 -3.659 399 HB VAL 49 HB VAL 49 -6.745 -1.953 -3.165 400 HG11 VAL 49 HG11 VAL 49 -7.083 -3.525 -1.284 401 HG12 VAL 49 HG12 VAL 49 -8.440 -2.357 -1.433 402 HG13 VAL 49 HG13 VAL 49 -8.642 -4.047 -2.007 403 HG21 VAL 49 HG21 VAL 49 -5.827 -4.241 -3.283 404 HG22 VAL 49 HG22 VAL 49 -7.333 -4.801 -4.085 405 HG23 VAL 49 HG23 VAL 49 -6.268 -3.610 -4.906 406 H SER 50 H SER 50 -8.245 0.131 -4.972 407 HA SER 50 HA SER 50 -7.367 -0.774 -7.651 408 HB2 SER 50 HB2 SER 50 -9.280 1.153 -6.740 409 HB3 SER 50 HB3 SER 50 -7.879 2.094 -7.269 410 HG SER 50 HG SER 50 -9.683 1.354 -8.873 411 H TYR 51 H TYR 51 -5.169 -0.587 -7.984 412 HA TYR 51 HA TYR 51 -3.659 1.201 -6.184 413 HB2 TYR 51 HB2 TYR 51 -3.241 -1.436 -7.551 414 HB3 TYR 51 HB3 TYR 51 -1.866 -0.328 -7.656 415 HD1 TYR 51 HD1 TYR 51 -2.074 1.003 -4.940 416 HD2 TYR 51 HD2 TYR 51 -2.424 -3.121 -6.097 417 HE1 TYR 51 HE1 TYR 51 -1.286 0.308 -2.700 418 HE2 TYR 51 HE2 TYR 51 -1.656 -3.818 -3.846 419 HH TYR 51 HH TYR 51 -1.604 -2.862 -1.519 420 H ALA 52 H ALA 52 -2.382 2.863 -7.135 421 HA ALA 52 HA ALA 52 -2.349 2.953 -10.080 422 HB1 ALA 52 HB1 ALA 52 -2.804 5.382 -9.957 423 HB2 ALA 52 HB2 ALA 52 -4.176 4.414 -9.320 424 HB3 ALA 52 HB3 ALA 52 -3.058 5.242 -8.185 425 H VAL 53 H VAL 53 -0.351 3.459 -10.906 426 HA VAL 53 HA VAL 53 1.528 4.783 -9.126 427 HB VAL 53 HB VAL 53 3.331 3.170 -9.844 428 HG11 VAL 53 HG11 VAL 53 2.688 1.384 -8.257 429 HG12 VAL 53 HG12 VAL 53 2.299 3.018 -7.622 430 HG13 VAL 53 HG13 VAL 53 0.994 1.977 -8.284 431 HG21 VAL 53 HG21 VAL 53 2.656 0.943 -10.680 432 HG22 VAL 53 HG22 VAL 53 0.959 1.514 -10.817 433 HG23 VAL 53 HG23 VAL 53 2.239 2.251 -11.838 434 HA PRO 54 HA PRO 54 2.471 6.752 -13.059 435 HB2 PRO 54 HB2 PRO 54 4.498 8.371 -12.173 436 HB3 PRO 54 HB3 PRO 54 2.857 8.650 -11.577 437 HG2 PRO 54 HG2 PRO 54 5.163 7.223 -10.234 438 HG3 PRO 54 HG3 PRO 54 3.984 8.340 -9.534 439 HD2 PRO 54 HD2 PRO 54 3.813 5.563 -9.322 440 HD3 PRO 54 HD3 PRO 54 2.427 6.650 -9.160 441 H LYS 55 H LYS 55 3.147 5.278 -14.423 442 HA LYS 55 HA LYS 55 5.879 4.300 -14.273 443 HB2 LYS 55 HB2 LYS 55 3.918 2.678 -14.403 444 HB3 LYS 55 HB3 LYS 55 3.775 3.166 -16.097 445 HG2 LYS 55 HG2 LYS 55 6.278 2.620 -16.344 446 HG3 LYS 55 HG3 LYS 55 6.198 1.901 -14.731 447 HD2 LYS 55 HD2 LYS 55 4.388 0.374 -15.484 448 HD3 LYS 55 HD3 LYS 55 4.422 1.110 -17.092 449 HE2 LYS 55 HE2 LYS 55 5.751 -0.787 -17.403 450 HE3 LYS 55 HE3 LYS 55 6.964 0.464 -17.102 451 HZ1 LYS 55 HZ1 LYS 55 7.388 -1.506 -15.814 452 HZ2 LYS 55 HZ2 LYS 55 7.050 -0.267 -14.806 453 HZ3 LYS 55 HZ3 LYS 55 5.930 -1.422 -15.084 454 HA PRO 56 HA PRO 56 7.525 6.979 -17.399 455 HB2 PRO 56 HB2 PRO 56 8.114 4.286 -18.795 456 HB3 PRO 56 HB3 PRO 56 9.217 5.653 -18.591 457 HG2 PRO 56 HG2 PRO 56 9.417 3.480 -17.017 458 HG3 PRO 56 HG3 PRO 56 9.725 5.097 -16.370 459 HD2 PRO 56 HD2 PRO 56 7.420 3.271 -15.847 460 HD3 PRO 56 HD3 PRO 56 8.021 4.616 -14.869 461 H ASN 57 H ASN 57 5.377 4.198 -18.368 462 HA ASN 57 HA ASN 57 4.848 5.459 -20.907 463 HB2 ASN 57 HB2 ASN 57 3.346 3.156 -19.554 464 HB3 ASN 57 HB3 ASN 57 3.323 3.578 -21.271 465 HD21 ASN 57 HD21 ASN 57 5.145 3.082 -22.587 466 HD22 ASN 57 HD22 ASN 57 6.367 1.968 -22.071 467 H GLY 58 H GLY 58 3.733 6.054 -17.694 468 HA2 GLY 58 HA2 GLY 58 2.225 8.075 -17.827 469 HA3 GLY 58 HA3 GLY 58 1.129 7.004 -18.712 470 H CYS 59 H CYS 59 -0.233 7.813 -16.684 471 HA CYS 59 HA CYS 59 0.371 6.648 -14.166 472 HB2 CYS 59 HB2 CYS 59 -2.276 7.658 -15.304 473 HB3 CYS 59 HB3 CYS 59 -1.944 7.308 -13.602 474 H ARG 60 H ARG 60 0.498 4.441 -13.881 475 HA ARG 60 HA ARG 60 -1.428 2.762 -15.337 476 HB2 ARG 60 HB2 ARG 60 0.928 2.196 -15.647 477 HB3 ARG 60 HB3 ARG 60 1.196 2.163 -13.899 478 HG2 ARG 60 HG2 ARG 60 0.914 -0.079 -14.181 479 HG3 ARG 60 HG3 ARG 60 -0.801 0.333 -14.043 480 HD2 ARG 60 HD2 ARG 60 0.709 0.203 -16.701 481 HD3 ARG 60 HD3 ARG 60 -0.190 -1.157 -16.016 482 HE ARG 60 HE ARG 60 -1.384 1.400 -16.979 483 HH11 ARG 60 HH11 ARG 60 -1.757 -1.934 -15.920 484 HH12 ARG 60 HH12 ARG 60 -3.392 -2.055 -16.477 485 HH21 ARG 60 HH21 ARG 60 -3.522 1.213 -17.729 486 HH22 ARG 60 HH22 ARG 60 -4.395 -0.266 -17.505 487 H LYS 61 H LYS 61 -3.025 1.671 -14.273 488 HA LYS 61 HA LYS 61 -2.820 1.420 -11.390 489 HB2 LYS 61 HB2 LYS 61 -4.570 2.637 -10.801 490 HB3 LYS 61 HB3 LYS 61 -4.226 3.507 -12.303 491 HG2 LYS 61 HG2 LYS 61 -5.935 2.247 -13.497 492 HG3 LYS 61 HG3 LYS 61 -6.197 1.191 -12.103 493 HD2 LYS 61 HD2 LYS 61 -6.742 3.327 -10.759 494 HD3 LYS 61 HD3 LYS 61 -6.763 4.183 -12.306 495 HE2 LYS 61 HE2 LYS 61 -9.030 3.542 -11.824 496 HE3 LYS 61 HE3 LYS 61 -8.467 2.512 -13.146 497 HZ1 LYS 61 HZ1 LYS 61 -9.643 1.317 -11.380 498 HZ2 LYS 61 HZ2 LYS 61 -8.130 0.746 -11.605 499 HZ3 LYS 61 HZ3 LYS 61 -8.462 1.690 -10.315 500 H TRP 62 H TRP 62 -4.671 -0.020 -10.476 501 HA TRP 62 HA TRP 62 -5.905 -1.782 -12.362 502 HB2 TRP 62 HB2 TRP 62 -3.463 -2.579 -12.232 503 HB3 TRP 62 HB3 TRP 62 -3.773 -2.981 -10.538 504 HD1 TRP 62 HD1 TRP 62 -3.642 -5.605 -10.738 505 HE1 TRP 62 HE1 TRP 62 -5.082 -7.395 -11.923 506 HE3 TRP 62 HE3 TRP 62 -6.514 -2.516 -13.678 507 HZ2 TRP 62 HZ2 TRP 62 -7.134 -7.504 -13.842 508 HZ3 TRP 62 HZ3 TRP 62 -8.205 -3.545 -15.175 509 HH2 TRP 62 HH2 TRP 62 -8.508 -6.003 -15.256 510 H GLU 63 H GLU 63 -7.405 -3.340 -11.189 511 HA GLU 63 HA GLU 63 -7.620 -2.657 -8.318 512 HB2 GLU 63 HB2 GLU 63 -10.175 -3.005 -8.854 513 HB3 GLU 63 HB3 GLU 63 -9.425 -1.426 -9.123 514 HG2 GLU 63 HG2 GLU 63 -9.432 -3.279 -11.484 515 HG3 GLU 63 HG3 GLU 63 -11.019 -2.717 -10.941 516 H THR 64 H THR 64 -7.590 -4.509 -7.159 517 HA THR 64 HA THR 64 -8.255 -7.006 -8.549 518 HB THR 64 HB THR 64 -6.611 -7.882 -6.611 519 HG1 THR 64 HG1 THR 64 -5.324 -6.371 -5.788 520 HG21 THR 64 HG21 THR 64 -4.748 -7.875 -8.260 521 HG22 THR 64 HG22 THR 64 -6.316 -8.316 -9.016 522 HG23 THR 64 HG23 THR 64 -5.640 -6.668 -9.246 523 H THR 65 H THR 65 -9.205 -8.685 -7.219 524 HA THR 65 HA THR 65 -10.688 -7.559 -4.950 525 HB THR 65 HB THR 65 -11.235 -10.262 -6.175 526 HG1 THR 65 HG1 THR 65 -12.806 -8.587 -7.479 527 HG21 THR 65 HG21 THR 65 -13.563 -9.604 -5.618 528 HG22 THR 65 HG22 THR 65 -12.485 -9.480 -4.186 529 HG23 THR 65 HG23 THR 65 -12.975 -7.997 -5.073 530 H PHE 66 H PHE 66 -10.161 -8.269 -2.860 531 HA PHE 66 HA PHE 66 -8.507 -10.705 -2.720 532 HB2 PHE 66 HB2 PHE 66 -8.271 -8.152 -1.049 533 HB3 PHE 66 HB3 PHE 66 -7.341 -9.634 -0.793 534 HD1 PHE 66 HD1 PHE 66 -6.921 -10.221 -3.831 535 HD2 PHE 66 HD2 PHE 66 -6.396 -6.710 -1.415 536 HE1 PHE 66 HE1 PHE 66 -5.187 -9.408 -5.398 537 HE2 PHE 66 HE2 PHE 66 -4.656 -5.895 -2.976 538 HZ PHE 66 HZ PHE 66 -4.047 -7.243 -4.972 539 H LYS 67 H LYS 67 -8.504 -11.630 -0.391 540 HA LYS 67 HA LYS 67 -11.289 -11.633 0.555 541 HB2 LYS 67 HB2 LYS 67 -9.031 -13.637 0.457 542 HB3 LYS 67 HB3 LYS 67 -10.197 -13.750 1.782 543 HG2 LYS 67 HG2 LYS 67 -10.832 -15.224 -0.078 544 HG3 LYS 67 HG3 LYS 67 -12.055 -13.972 0.179 545 HD2 LYS 67 HD2 LYS 67 -11.167 -12.653 -1.710 546 HD3 LYS 67 HD3 LYS 67 -9.833 -13.795 -1.923 547 HE2 LYS 67 HE2 LYS 67 -11.382 -15.598 -2.508 548 HE3 LYS 67 HE3 LYS 67 -12.780 -14.594 -2.102 549 HZ1 LYS 67 HZ1 LYS 67 -12.336 -14.691 -4.473 550 HZ2 LYS 67 HZ2 LYS 67 -12.230 -13.157 -3.924 551 HZ3 LYS 67 HZ3 LYS 67 -10.873 -13.996 -4.269 552 H LYS 68 H LYS 68 -11.621 -11.791 2.897 553 HA LYS 68 HA LYS 68 -9.782 -10.042 4.249 554 HB2 LYS 68 HB2 LYS 68 -12.197 -9.534 4.298 555 HB3 LYS 68 HB3 LYS 68 -12.540 -11.108 5.030 556 HG2 LYS 68 HG2 LYS 68 -11.533 -10.502 7.103 557 HG3 LYS 68 HG3 LYS 68 -10.670 -9.132 6.393 558 HD2 LYS 68 HD2 LYS 68 -12.722 -8.515 7.763 559 HD3 LYS 68 HD3 LYS 68 -12.695 -7.858 6.121 560 HE2 LYS 68 HE2 LYS 68 -14.095 -9.854 5.376 561 HE3 LYS 68 HE3 LYS 68 -14.225 -10.333 7.074 562 HZ1 LYS 68 HZ1 LYS 68 -16.003 -8.829 5.994 563 HZ2 LYS 68 HZ2 LYS 68 -15.542 -8.549 7.535 564 HZ3 LYS 68 HZ3 LYS 68 -14.966 -7.613 6.328 565 H THR 69 H THR 69 -8.328 -10.542 5.881 566 HA THR 69 HA THR 69 -8.966 -12.982 7.447 567 HB THR 69 HB THR 69 -6.258 -12.296 6.247 568 HG1 THR 69 HG1 THR 69 -6.937 -14.504 5.071 569 HG21 THR 69 HG21 THR 69 -5.610 -14.582 6.869 570 HG22 THR 69 HG22 THR 69 -6.081 -13.581 8.284 571 HG23 THR 69 HG23 THR 69 -7.214 -14.817 7.641 572 H SER 70 H SER 70 -9.564 -11.326 9.100 573 HA SER 70 HA SER 70 -7.639 -9.298 9.746 574 HB2 SER 70 HB2 SER 70 -10.073 -10.150 11.381 575 HB3 SER 70 HB3 SER 70 -9.264 -8.577 11.369 576 HG SER 70 HG SER 70 -11.229 -8.572 10.096 577 H ASP 71 H ASP 71 -5.859 -11.045 9.991 578 HA ASP 71 HA ASP 71 -5.875 -12.700 12.267 579 HB2 ASP 71 HB2 ASP 71 -4.296 -12.619 10.179 580 HB3 ASP 71 HB3 ASP 71 -3.392 -11.411 11.100 581 H ASP 72 H ASP 72 -4.210 -9.458 11.752 582 HA ASP 72 HA ASP 72 -4.450 -8.943 14.663 583 HB2 ASP 72 HB2 ASP 72 -2.107 -9.313 13.479 584 HB3 ASP 72 HB3 ASP 72 -2.352 -7.652 12.922 585 H GLY 73 H GLY 73 -6.227 -8.039 14.608 586 HA2 GLY 73 HA2 GLY 73 -7.904 -6.693 14.782 587 HA3 GLY 73 HA3 GLY 73 -6.810 -5.353 14.413 588 H GLU 74 H GLU 74 -6.195 -5.565 11.565 589 HA GLU 74 HA GLU 74 -8.641 -6.517 10.266 590 HB2 GLU 74 HB2 GLU 74 -7.754 -3.660 9.947 591 HB3 GLU 74 HB3 GLU 74 -8.753 -4.523 8.770 592 HG2 GLU 74 HG2 GLU 74 -10.483 -3.674 9.961 593 HG3 GLU 74 HG3 GLU 74 -10.178 -5.036 11.047 594 H VAL 75 H VAL 75 -7.661 -7.966 8.740 595 HA VAL 75 HA VAL 75 -5.316 -6.928 7.319 596 HB VAL 75 HB VAL 75 -5.542 -9.494 8.938 597 HG11 VAL 75 HG11 VAL 75 -3.429 -10.265 7.940 598 HG12 VAL 75 HG12 VAL 75 -4.766 -10.174 6.745 599 HG13 VAL 75 HG13 VAL 75 -3.496 -8.904 6.770 600 HG21 VAL 75 HG21 VAL 75 -3.338 -8.746 9.840 601 HG22 VAL 75 HG22 VAL 75 -3.428 -7.283 8.802 602 HG23 VAL 75 HG23 VAL 75 -4.631 -7.531 10.112 603 H TYR 76 H TYR 76 -4.993 -7.854 5.191 604 HA TYR 76 HA TYR 76 -7.398 -9.309 4.282 605 HB2 TYR 76 HB2 TYR 76 -5.472 -7.499 2.724 606 HB3 TYR 76 HB3 TYR 76 -6.855 -8.359 2.036 607 HD1 TYR 76 HD1 TYR 76 -9.069 -7.894 3.790 608 HD2 TYR 76 HD2 TYR 76 -5.862 -5.224 2.780 609 HE1 TYR 76 HE1 TYR 76 -10.521 -5.963 4.306 610 HE2 TYR 76 HE2 TYR 76 -7.312 -3.285 3.287 611 HH TYR 76 HH TYR 76 -9.302 -2.597 3.970 612 H TYR 77 H TYR 77 -6.825 -10.638 2.187 613 HA TYR 77 HA TYR 77 -4.131 -11.644 2.063 614 HB2 TYR 77 HB2 TYR 77 -6.207 -12.849 3.833 615 HB3 TYR 77 HB3 TYR 77 -5.531 -13.990 2.664 616 HD1 TYR 77 HD1 TYR 77 -2.984 -14.276 2.596 617 HD2 TYR 77 HD2 TYR 77 -5.006 -12.332 5.850 618 HE1 TYR 77 HE1 TYR 77 -1.035 -14.693 4.055 619 HE2 TYR 77 HE2 TYR 77 -3.043 -12.737 7.311 620 HH TYR 77 HH TYR 77 -0.296 -14.723 6.185 621 H SER 78 H SER 78 -3.953 -12.034 -0.224 622 HA SER 78 HA SER 78 -6.421 -12.980 -1.526 623 HB2 SER 78 HB2 SER 78 -4.297 -12.388 -3.426 624 HB3 SER 78 HB3 SER 78 -5.874 -11.606 -3.250 625 HG SER 78 HG SER 78 -4.637 -9.947 -2.662 626 H GLU 79 H GLU 79 -6.596 -14.882 -2.590 627 HA GLU 79 HA GLU 79 -4.334 -16.666 -2.291 628 HB2 GLU 79 HB2 GLU 79 -6.994 -17.091 -1.903 629 HB3 GLU 79 HB3 GLU 79 -6.828 -17.684 -3.561 630 HG2 GLU 79 HG2 GLU 79 -5.222 -18.579 -1.119 631 HG3 GLU 79 HG3 GLU 79 -6.437 -19.519 -1.993 632 H GLU 80 H GLU 80 -6.393 -15.429 -4.822 633 HA GLU 80 HA GLU 80 -5.332 -16.851 -6.988 634 HB2 GLU 80 HB2 GLU 80 -6.752 -14.179 -7.247 635 HB3 GLU 80 HB3 GLU 80 -6.877 -15.614 -8.272 636 HG2 GLU 80 HG2 GLU 80 -8.939 -15.680 -7.229 637 HG3 GLU 80 HG3 GLU 80 -8.010 -16.710 -6.132 638 H ALA 81 H ALA 81 -4.651 -13.679 -5.518 639 HA ALA 81 HA ALA 81 -2.837 -13.099 -7.694 640 HB1 ALA 81 HB1 ALA 81 -2.625 -10.892 -6.537 641 HB2 ALA 81 HB2 ALA 81 -4.329 -11.314 -6.915 642 HB3 ALA 81 HB3 ALA 81 -3.710 -11.495 -5.239 643 H LYS 82 H LYS 82 -2.525 -14.714 -4.589 644 HA LYS 82 HA LYS 82 -0.674 -15.382 -3.462 645 HB2 LYS 82 HB2 LYS 82 0.870 -14.519 -5.945 646 HB3 LYS 82 HB3 LYS 82 1.435 -15.604 -4.667 647 HG2 LYS 82 HG2 LYS 82 -0.781 -16.118 -6.705 648 HG3 LYS 82 HG3 LYS 82 0.766 -16.960 -6.554 649 HD2 LYS 82 HD2 LYS 82 0.075 -17.862 -4.333 650 HD3 LYS 82 HD3 LYS 82 -1.461 -16.992 -4.446 651 HE2 LYS 82 HE2 LYS 82 -1.520 -18.316 -6.840 652 HE3 LYS 82 HE3 LYS 82 -0.533 -19.450 -5.909 653 HZ1 LYS 82 HZ1 LYS 82 -2.820 -19.987 -5.661 654 HZ2 LYS 82 HZ2 LYS 82 -2.297 -19.424 -4.220 655 HZ3 LYS 82 HZ3 LYS 82 -3.218 -18.478 -5.180 656 H LYS 83 H LYS 83 -1.542 -13.158 -2.401 657 HA LYS 83 HA LYS 83 0.792 -11.622 -1.698 658 HB2 LYS 83 HB2 LYS 83 -1.556 -10.040 -2.740 659 HB3 LYS 83 HB3 LYS 83 0.094 -9.505 -2.397 660 HG2 LYS 83 HG2 LYS 83 0.965 -10.549 -4.361 661 HG3 LYS 83 HG3 LYS 83 -0.485 -11.536 -4.586 662 HD2 LYS 83 HD2 LYS 83 -1.795 -9.338 -4.823 663 HD3 LYS 83 HD3 LYS 83 -0.233 -8.511 -4.884 664 HE2 LYS 83 HE2 LYS 83 0.424 -9.982 -6.827 665 HE3 LYS 83 HE3 LYS 83 -1.192 -10.700 -6.793 666 HZ1 LYS 83 HZ1 LYS 83 -0.998 -8.871 -8.368 667 HZ2 LYS 83 HZ2 LYS 83 -2.120 -8.540 -7.229 668 HZ3 LYS 83 HZ3 LYS 83 -0.655 -7.821 -7.166 669 H LYS 84 H LYS 84 0.503 -10.480 0.317 670 HA LYS 84 HA LYS 84 -2.106 -10.652 1.539 671 HB2 LYS 84 HB2 LYS 84 -1.254 -11.567 3.658 672 HB3 LYS 84 HB3 LYS 84 -1.420 -12.692 2.302 673 HG2 LYS 84 HG2 LYS 84 0.841 -12.997 2.081 674 HG3 LYS 84 HG3 LYS 84 1.220 -11.395 2.658 675 HD2 LYS 84 HD2 LYS 84 0.097 -13.578 4.430 676 HD3 LYS 84 HD3 LYS 84 1.825 -13.245 4.257 677 HE2 LYS 84 HE2 LYS 84 1.441 -10.897 5.057 678 HE3 LYS 84 HE3 LYS 84 -0.280 -11.255 5.255 679 HZ1 LYS 84 HZ1 LYS 84 0.935 -11.506 7.307 680 HZ2 LYS 84 HZ2 LYS 84 0.318 -12.948 6.853 681 HZ3 LYS 84 HZ3 LYS 84 1.910 -12.644 6.659 682 H VAL 85 H VAL 85 -2.454 -9.196 3.430 683 HA VAL 85 HA VAL 85 -0.208 -7.369 3.804 684 HB VAL 85 HB VAL 85 -1.818 -5.400 3.726 685 HG11 VAL 85 HG11 VAL 85 -1.740 -5.239 1.266 686 HG12 VAL 85 HG12 VAL 85 -0.202 -5.880 1.938 687 HG13 VAL 85 HG13 VAL 85 -1.377 -6.995 1.163 688 HG21 VAL 85 HG21 VAL 85 -3.889 -5.696 2.429 689 HG22 VAL 85 HG22 VAL 85 -3.593 -7.466 2.359 690 HG23 VAL 85 HG23 VAL 85 -3.905 -6.670 3.938 691 H GLU 86 H GLU 86 -0.071 -6.460 5.926 692 HA GLU 86 HA GLU 86 -2.274 -7.165 7.750 693 HB2 GLU 86 HB2 GLU 86 -0.381 -7.502 9.478 694 HB3 GLU 86 HB3 GLU 86 -0.766 -8.810 8.352 695 HG2 GLU 86 HG2 GLU 86 1.149 -7.820 6.873 696 HG3 GLU 86 HG3 GLU 86 1.623 -6.935 8.329 697 H VAL 87 H VAL 87 -2.944 -5.450 9.062 698 HA VAL 87 HA VAL 87 -1.684 -2.935 8.567 699 HB VAL 87 HB VAL 87 -4.119 -3.176 8.786 700 HG11 VAL 87 HG11 VAL 87 -5.175 -3.463 11.007 701 HG12 VAL 87 HG12 VAL 87 -4.260 -4.917 10.481 702 HG13 VAL 87 HG13 VAL 87 -3.561 -3.813 11.713 703 HG21 VAL 87 HG21 VAL 87 -4.521 -1.237 10.278 704 HG22 VAL 87 HG22 VAL 87 -2.853 -1.406 10.923 705 HG23 VAL 87 HG23 VAL 87 -3.110 -0.995 9.194 706 H LEU 88 H LEU 88 0.255 -2.427 9.559 707 HA LEU 88 HA LEU 88 1.008 -3.718 12.002 708 HB2 LEU 88 HB2 LEU 88 2.097 -1.334 10.425 709 HB3 LEU 88 HB3 LEU 88 2.893 -2.034 11.841 710 HG LEU 88 HG LEU 88 2.394 -3.505 9.221 711 HD11 LEU 88 HD11 LEU 88 4.829 -3.248 8.841 712 HD12 LEU 88 HD12 LEU 88 3.986 -1.663 8.901 713 HD13 LEU 88 HD13 LEU 88 4.945 -2.224 10.312 714 HD21 LEU 88 HD21 LEU 88 3.995 -5.152 10.160 715 HD22 LEU 88 HD22 LEU 88 4.060 -4.206 11.685 716 HD23 LEU 88 HD23 LEU 88 2.526 -4.989 11.179 717 H ASP 89 H ASP 89 -0.144 -0.396 10.990 718 HA ASP 89 HA ASP 89 -1.411 -0.006 13.478 719 HB2 ASP 89 HB2 ASP 89 0.986 0.327 14.179 720 HB3 ASP 89 HB3 ASP 89 1.019 1.760 13.144 721 H THR 90 H THR 90 -2.717 2.027 13.461 722 HA THR 90 HA THR 90 -2.409 3.655 11.102 723 HB THR 90 HB THR 90 -3.780 1.729 10.312 724 HG1 THR 90 HG1 THR 90 -4.809 3.128 9.056 725 HG21 THR 90 HG21 THR 90 -6.117 1.544 11.100 726 HG22 THR 90 HG22 THR 90 -4.939 1.207 12.413 727 HG23 THR 90 HG23 THR 90 -5.788 2.789 12.352 728 H ASP 91 H ASP 91 -3.608 5.720 11.233 729 HA ASP 91 HA ASP 91 -4.441 6.272 14.008 730 HB2 ASP 91 HB2 ASP 91 -2.597 7.639 12.887 731 HB3 ASP 91 HB3 ASP 91 -3.841 8.277 11.804 732 H TYR 92 H TYR 92 -6.534 7.422 14.307 733 HA TYR 92 HA TYR 92 -8.455 6.639 12.292 734 HB2 TYR 92 HB2 TYR 92 -8.625 7.943 15.043 735 HB3 TYR 92 HB3 TYR 92 -10.041 7.754 14.001 736 HD1 TYR 92 HD1 TYR 92 -7.512 5.943 16.039 737 HD2 TYR 92 HD2 TYR 92 -11.012 5.540 13.579 738 HE1 TYR 92 HE1 TYR 92 -7.798 3.612 16.830 739 HE2 TYR 92 HE2 TYR 92 -11.308 3.215 14.379 740 HH TYR 92 HH TYR 92 -10.537 1.580 15.656 741 H LYS 93 H LYS 93 -6.695 9.582 13.233 742 HA LYS 93 HA LYS 93 -8.168 11.004 11.138 743 HB2 LYS 93 HB2 LYS 93 -7.288 12.152 13.809 744 HB3 LYS 93 HB3 LYS 93 -7.946 13.083 12.457 745 HG2 LYS 93 HG2 LYS 93 -10.091 12.064 12.636 746 HG3 LYS 93 HG3 LYS 93 -9.475 10.715 13.599 747 HD2 LYS 93 HD2 LYS 93 -9.046 12.184 15.505 748 HD3 LYS 93 HD3 LYS 93 -9.429 13.620 14.547 749 HE2 LYS 93 HE2 LYS 93 -11.418 11.361 15.091 750 HE3 LYS 93 HE3 LYS 93 -11.289 12.817 16.087 751 HZ1 LYS 93 HZ1 LYS 93 -12.942 13.236 14.523 752 HZ2 LYS 93 HZ2 LYS 93 -11.656 14.062 13.948 753 HZ3 LYS 93 HZ3 LYS 93 -12.087 12.643 13.264 754 H SER 94 H SER 94 -5.444 9.480 11.103 755 HA SER 94 HA SER 94 -4.010 11.752 9.910 756 HB2 SER 94 HB2 SER 94 -3.331 11.584 12.365 757 HB3 SER 94 HB3 SER 94 -2.898 9.888 12.112 758 HG SER 94 HG SER 94 -1.049 11.301 12.000 759 H TYR 95 H TYR 95 -1.530 9.840 10.063 760 HA TYR 95 HA TYR 95 -2.212 8.458 7.574 761 HB2 TYR 95 HB2 TYR 95 0.279 8.232 7.417 762 HB3 TYR 95 HB3 TYR 95 -0.237 9.918 7.560 763 HD1 TYR 95 HD1 TYR 95 1.142 7.028 9.505 764 HD2 TYR 95 HD2 TYR 95 0.475 11.269 9.382 765 HE1 TYR 95 HE1 TYR 95 2.569 7.309 11.510 766 HE2 TYR 95 HE2 TYR 95 1.910 11.554 11.375 767 HH TYR 95 HH TYR 95 2.577 10.025 13.400 768 H ALA 96 H ALA 96 -0.987 6.232 7.293 769 HA ALA 96 HA ALA 96 -0.702 4.816 9.794 770 HB1 ALA 96 HB1 ALA 96 -2.214 3.000 9.113 771 HB2 ALA 96 HB2 ALA 96 -3.066 4.554 9.403 772 HB3 ALA 96 HB3 ALA 96 -2.760 3.997 7.723 773 H VAL 97 H VAL 97 0.319 2.689 9.593 774 HA VAL 97 HA VAL 97 1.876 2.485 7.110 775 HB VAL 97 HB VAL 97 3.575 1.238 8.402 776 HG11 VAL 97 HG11 VAL 97 4.494 3.212 9.548 777 HG12 VAL 97 HG12 VAL 97 3.811 3.633 7.941 778 HG13 VAL 97 HG13 VAL 97 2.895 4.023 9.436 779 HG21 VAL 97 HG21 VAL 97 3.519 1.326 10.857 780 HG22 VAL 97 HG22 VAL 97 1.885 2.069 10.796 781 HG23 VAL 97 HG23 VAL 97 2.134 0.396 10.192 782 H ILE 98 H ILE 98 2.010 0.308 6.139 783 HA ILE 98 HA ILE 98 0.327 -1.689 7.484 784 HB ILE 98 HB ILE 98 0.271 -0.974 4.513 785 HG12 ILE 98 HG12 ILE 98 -0.956 0.616 5.969 786 HG13 ILE 98 HG13 ILE 98 -2.042 -0.307 4.921 787 HG21 ILE 98 HG21 ILE 98 -1.489 -2.705 4.344 788 HG22 ILE 98 HG22 ILE 98 0.086 -3.398 4.858 789 HG23 ILE 98 HG23 ILE 98 -1.219 -3.143 6.065 790 HD11 ILE 98 HD11 ILE 98 -2.973 -0.085 7.184 791 HD12 ILE 98 HD12 ILE 98 -2.617 -1.805 6.813 792 HD13 ILE 98 HD13 ILE 98 -1.514 -0.869 7.877 793 H TYR 99 H TYR 99 1.098 -3.874 7.278 794 HA TYR 99 HA TYR 99 3.785 -4.082 6.073 795 HB2 TYR 99 HB2 TYR 99 3.418 -4.720 8.468 796 HB3 TYR 99 HB3 TYR 99 2.246 -5.935 7.941 797 HD1 TYR 99 HD1 TYR 99 3.047 -7.867 6.479 798 HD2 TYR 99 HD2 TYR 99 5.774 -5.188 8.438 799 HE1 TYR 99 HE1 TYR 99 4.868 -9.519 6.197 800 HE2 TYR 99 HE2 TYR 99 7.600 -6.838 8.150 801 HH TYR 99 HH TYR 99 7.190 -9.711 6.152 802 H ALA 100 H ALA 100 3.965 -5.064 4.181 803 HA ALA 100 HA ALA 100 1.656 -6.389 2.961 804 HB1 ALA 100 HB1 ALA 100 2.611 -5.862 0.804 805 HB2 ALA 100 HB2 ALA 100 2.194 -4.416 1.784 806 HB3 ALA 100 HB3 ALA 100 3.909 -4.922 1.614 807 H THR 101 H THR 101 2.129 -7.912 1.383 808 HA THR 101 HA THR 101 4.031 -9.879 1.999 809 HB THR 101 HB THR 101 2.282 -11.646 2.573 810 HG1 THR 101 HG1 THR 101 2.060 -9.693 4.578 811 HG21 THR 101 HG21 THR 101 3.660 -11.658 4.605 812 HG22 THR 101 HG22 THR 101 4.680 -11.404 3.149 813 HG23 THR 101 HG23 THR 101 4.261 -10.013 4.206 814 H ARG 102 H ARG 102 4.166 -11.796 0.788 815 HA ARG 102 HA ARG 102 2.746 -11.774 -1.617 816 HB2 ARG 102 HB2 ARG 102 5.099 -10.366 -1.982 817 HB3 ARG 102 HB3 ARG 102 4.851 -11.680 -3.103 818 HG2 ARG 102 HG2 ARG 102 2.297 -10.674 -2.916 819 HG3 ARG 102 HG3 ARG 102 3.241 -9.201 -2.655 820 HD2 ARG 102 HD2 ARG 102 3.287 -9.219 -4.958 821 HD3 ARG 102 HD3 ARG 102 4.714 -10.220 -4.660 822 HE ARG 102 HE ARG 102 2.172 -11.665 -4.842 823 HH11 ARG 102 HH11 ARG 102 5.113 -10.644 -6.493 824 HH12 ARG 102 HH12 ARG 102 4.914 -11.776 -7.789 825 HH21 ARG 102 HH21 ARG 102 1.929 -13.128 -6.546 826 HH22 ARG 102 HH22 ARG 102 3.103 -13.190 -7.818 827 H VAL 103 H VAL 103 3.219 -13.597 -3.168 828 HA VAL 103 HA VAL 103 4.811 -15.559 -1.841 829 HB VAL 103 HB VAL 103 2.632 -16.169 -1.007 830 HG11 VAL 103 HG11 VAL 103 1.131 -17.250 -2.598 831 HG12 VAL 103 HG12 VAL 103 1.391 -15.533 -3.055 832 HG13 VAL 103 HG13 VAL 103 2.236 -16.839 -3.952 833 HG21 VAL 103 HG21 VAL 103 3.088 -18.537 -1.470 834 HG22 VAL 103 HG22 VAL 103 4.122 -18.089 -2.868 835 HG23 VAL 103 HG23 VAL 103 4.627 -17.651 -1.201 836 H LYS 104 H LYS 104 6.203 -16.867 -3.222 837 HA LYS 104 HA LYS 104 5.378 -16.984 -6.020 838 HB2 LYS 104 HB2 LYS 104 7.159 -15.053 -5.487 839 HB3 LYS 104 HB3 LYS 104 8.245 -16.408 -5.824 840 HG2 LYS 104 HG2 LYS 104 5.891 -15.659 -7.637 841 HG3 LYS 104 HG3 LYS 104 7.524 -15.015 -7.856 842 HD2 LYS 104 HD2 LYS 104 8.440 -17.244 -8.226 843 HD3 LYS 104 HD3 LYS 104 6.920 -18.012 -7.748 844 HE2 LYS 104 HE2 LYS 104 5.793 -16.799 -9.692 845 HE3 LYS 104 HE3 LYS 104 7.395 -16.258 -10.209 846 HZ1 LYS 104 HZ1 LYS 104 6.904 -18.213 -11.369 847 HZ2 LYS 104 HZ2 LYS 104 8.003 -18.661 -10.248 848 HZ3 LYS 104 HZ3 LYS 104 6.426 -19.028 -10.037 849 H ASP 105 H ASP 105 6.263 -18.984 -7.168 850 HA ASP 105 HA ASP 105 6.511 -21.225 -5.636 851 HB2 ASP 105 HB2 ASP 105 8.095 -20.627 -8.211 852 HB3 ASP 105 HB3 ASP 105 7.663 -22.232 -7.606 853 H GLY 106 H GLY 106 8.041 -21.484 -3.834 854 HA2 GLY 106 HA2 GLY 106 10.154 -21.871 -3.081 855 HA3 GLY 106 HA3 GLY 106 10.786 -21.494 -4.689 856 H ARG 107 H ARG 107 8.820 -18.816 -3.901 857 HA ARG 107 HA ARG 107 10.723 -17.581 -2.083 858 HB2 ARG 107 HB2 ARG 107 11.734 -17.509 -4.415 859 HB3 ARG 107 HB3 ARG 107 10.236 -16.796 -5.027 860 HG2 ARG 107 HG2 ARG 107 10.669 -14.715 -3.796 861 HG3 ARG 107 HG3 ARG 107 12.102 -15.422 -3.037 862 HD2 ARG 107 HD2 ARG 107 11.723 -15.133 -6.076 863 HD3 ARG 107 HD3 ARG 107 12.603 -13.970 -5.074 864 HE ARG 107 HE ARG 107 13.990 -16.170 -4.466 865 HH11 ARG 107 HH11 ARG 107 12.740 -15.207 -7.612 866 HH12 ARG 107 HH12 ARG 107 14.006 -15.997 -8.491 867 HH21 ARG 107 HH21 ARG 107 15.646 -17.194 -5.632 868 HH22 ARG 107 HH22 ARG 107 15.661 -17.129 -7.363 869 H THR 108 H THR 108 9.615 -16.577 -0.717 870 HA THR 108 HA THR 108 7.030 -15.531 -1.249 871 HB THR 108 HB THR 108 7.703 -14.993 1.470 872 HG1 THR 108 HG1 THR 108 7.974 -17.245 2.036 873 HG21 THR 108 HG21 THR 108 5.713 -16.413 1.795 874 HG22 THR 108 HG22 THR 108 5.448 -15.212 0.486 875 HG23 THR 108 HG23 THR 108 5.790 -16.927 0.076 876 H LEU 109 H LEU 109 6.318 -13.320 -0.611 877 HA LEU 109 HA LEU 109 8.656 -11.533 -0.752 878 HB2 LEU 109 HB2 LEU 109 6.888 -11.791 -2.746 879 HB3 LEU 109 HB3 LEU 109 6.060 -10.598 -1.778 880 HG LEU 109 HG LEU 109 7.676 -8.954 -2.078 881 HD11 LEU 109 HD11 LEU 109 9.983 -9.398 -2.822 882 HD12 LEU 109 HD12 LEU 109 9.593 -10.279 -1.306 883 HD13 LEU 109 HD13 LEU 109 9.631 -11.159 -2.871 884 HD21 LEU 109 HD21 LEU 109 8.207 -8.984 -4.502 885 HD22 LEU 109 HD22 LEU 109 7.796 -10.732 -4.565 886 HD23 LEU 109 HD23 LEU 109 6.522 -9.522 -4.190 887 H HIS 110 H HIS 110 8.568 -9.521 0.434 888 HA HIS 110 HA HIS 110 6.346 -9.243 2.368 889 HB2 HIS 110 HB2 HIS 110 9.317 -9.426 3.002 890 HB3 HIS 110 HB3 HIS 110 8.153 -8.628 4.068 891 HD2 HIS 110 HD2 HIS 110 8.200 -12.262 2.380 892 HE1 HIS 110 HE1 HIS 110 6.959 -12.562 6.457 893 H MET 111 H MET 111 5.897 -6.926 2.602 894 HA MET 111 HA MET 111 7.928 -5.070 1.623 895 HB2 MET 111 HB2 MET 111 6.455 -5.943 -0.331 896 HB3 MET 111 HB3 MET 111 5.084 -5.169 0.475 897 HG2 MET 111 HG2 MET 111 6.074 -2.963 0.190 898 HG3 MET 111 HG3 MET 111 7.582 -3.661 -0.415 899 HE1 MET 111 HE1 MET 111 7.710 -3.994 -3.545 900 HE2 MET 111 HE2 MET 111 7.760 -5.186 -2.203 901 HE3 MET 111 HE3 MET 111 6.644 -5.438 -3.587 902 H MET 112 H MET 112 7.788 -3.042 2.575 903 HA MET 112 HA MET 112 5.686 -2.794 4.644 904 HB2 MET 112 HB2 MET 112 8.151 -2.712 5.237 905 HB3 MET 112 HB3 MET 112 8.297 -1.269 4.225 906 HG2 MET 112 HG2 MET 112 6.805 -0.009 5.664 907 HG3 MET 112 HG3 MET 112 6.363 -1.458 6.577 908 HE1 MET 112 HE1 MET 112 8.143 1.468 8.231 909 HE2 MET 112 HE2 MET 112 6.666 0.448 8.193 910 HE3 MET 112 HE3 MET 112 7.960 0.108 9.390 911 H ARG 113 H ARG 113 4.282 -0.968 4.556 912 HA ARG 113 HA ARG 113 4.731 0.919 2.361 913 HB2 ARG 113 HB2 ARG 113 3.021 -1.238 2.059 914 HB3 ARG 113 HB3 ARG 113 1.923 -0.038 2.753 915 HG2 ARG 113 HG2 ARG 113 1.646 0.777 0.675 916 HG3 ARG 113 HG3 ARG 113 3.296 1.405 0.770 917 HD2 ARG 113 HD2 ARG 113 3.425 0.130 -1.180 918 HD3 ARG 113 HD3 ARG 113 4.000 -1.036 0.019 919 HE ARG 113 HE ARG 113 1.159 -1.004 -0.940 920 HH11 ARG 113 HH11 ARG 113 4.147 -2.698 -0.245 921 HH12 ARG 113 HH12 ARG 113 3.472 -4.270 -0.516 922 HH21 ARG 113 HH21 ARG 113 0.244 -3.066 -1.215 923 HH22 ARG 113 HH22 ARG 113 1.231 -4.482 -1.073 924 H LEU 114 H LEU 114 3.769 2.961 2.645 925 HA LEU 114 HA LEU 114 2.575 3.432 5.319 926 HB2 LEU 114 HB2 LEU 114 5.017 4.153 5.008 927 HB3 LEU 114 HB3 LEU 114 4.429 5.308 3.805 928 HG LEU 114 HG LEU 114 3.521 5.248 6.712 929 HD11 LEU 114 HD11 LEU 114 4.973 7.234 7.001 930 HD12 LEU 114 HD12 LEU 114 5.916 5.770 6.561 931 HD13 LEU 114 HD13 LEU 114 5.578 7.026 5.323 932 HD21 LEU 114 HD21 LEU 114 2.660 7.514 6.216 933 HD22 LEU 114 HD22 LEU 114 3.163 7.324 4.502 934 HD23 LEU 114 HD23 LEU 114 1.888 6.261 5.187 935 H TYR 115 H TYR 115 0.599 4.554 5.212 936 HA TYR 115 HA TYR 115 0.055 5.893 2.667 937 HB2 TYR 115 HB2 TYR 115 -2.006 4.924 2.358 938 HB3 TYR 115 HB3 TYR 115 -1.012 3.564 2.897 939 HD1 TYR 115 HD1 TYR 115 -3.711 5.914 3.865 940 HD2 TYR 115 HD2 TYR 115 -1.449 2.449 5.012 941 HE1 TYR 115 HE1 TYR 115 -5.380 5.412 5.623 942 HE2 TYR 115 HE2 TYR 115 -3.109 1.950 6.780 943 HH TYR 115 HH TYR 115 -5.550 2.410 7.202 944 H SER 116 H SER 116 -1.578 7.550 2.691 945 HA SER 116 HA SER 116 -2.331 8.612 5.280 946 HB2 SER 116 HB2 SER 116 -0.598 10.210 3.326 947 HB3 SER 116 HB3 SER 116 -1.343 10.836 4.803 948 HG SER 116 HG SER 116 0.880 10.199 5.133 949 H ARG 117 H ARG 117 -4.023 10.304 5.118 950 HA ARG 117 HA ARG 117 -5.757 9.855 2.894 951 HB2 ARG 117 HB2 ARG 117 -5.765 11.850 5.210 952 HB3 ARG 117 HB3 ARG 117 -7.060 11.751 4.010 953 HG2 ARG 117 HG2 ARG 117 -7.487 9.387 4.657 954 HG3 ARG 117 HG3 ARG 117 -6.183 9.475 5.849 955 HD2 ARG 117 HD2 ARG 117 -8.444 9.815 6.861 956 HD3 ARG 117 HD3 ARG 117 -7.362 11.188 7.125 957 HE ARG 117 HE ARG 117 -8.629 12.474 5.547 958 HH11 ARG 117 HH11 ARG 117 -9.970 9.256 6.045 959 HH12 ARG 117 HH12 ARG 117 -11.525 9.678 5.409 960 HH21 ARG 117 HH21 ARG 117 -10.672 13.013 4.733 961 HH22 ARG 117 HH22 ARG 117 -11.925 11.820 4.661 962 H SER 118 H SER 118 -2.963 11.847 3.294 963 HA SER 118 HA SER 118 -3.824 13.561 1.046 964 HB2 SER 118 HB2 SER 118 -1.914 14.424 3.264 965 HB3 SER 118 HB3 SER 118 -2.713 15.431 2.049 966 HG SER 118 HG SER 118 -3.747 15.579 4.141 967 HA PRO 119 HA PRO 119 -0.126 11.690 -0.685 968 HB2 PRO 119 HB2 PRO 119 -0.029 13.228 -2.993 969 HB3 PRO 119 HB3 PRO 119 -1.264 11.976 -2.805 970 HG2 PRO 119 HG2 PRO 119 -1.487 14.964 -2.348 971 HG3 PRO 119 HG3 PRO 119 -2.613 13.877 -3.172 972 HD2 PRO 119 HD2 PRO 119 -3.019 14.689 -0.589 973 HD3 PRO 119 HD3 PRO 119 -3.552 13.102 -1.160 974 H GLU 120 H GLU 120 0.504 13.244 1.432 975 HA GLU 120 HA GLU 120 2.888 14.597 0.422 976 HB2 GLU 120 HB2 GLU 120 2.403 16.455 2.100 977 HB3 GLU 120 HB3 GLU 120 1.552 16.503 0.551 978 HG2 GLU 120 HG2 GLU 120 -0.376 15.259 1.859 979 HG3 GLU 120 HG3 GLU 120 0.462 15.841 3.304 980 H VAL 121 H VAL 121 4.609 13.809 1.689 981 HA VAL 121 HA VAL 121 3.835 11.984 3.789 982 HB VAL 121 HB VAL 121 6.463 13.135 2.745 983 HG11 VAL 121 HG11 VAL 121 7.694 11.304 3.884 984 HG12 VAL 121 HG12 VAL 121 6.892 12.458 5.002 985 HG13 VAL 121 HG13 VAL 121 6.167 10.842 4.708 986 HG21 VAL 121 HG21 VAL 121 6.937 10.970 1.679 987 HG22 VAL 121 HG22 VAL 121 5.285 10.428 2.128 988 HG23 VAL 121 HG23 VAL 121 5.502 11.829 1.026 989 H SER 122 H SER 122 4.013 12.320 5.924 990 HA SER 122 HA SER 122 4.628 15.026 6.842 991 HB2 SER 122 HB2 SER 122 3.362 14.114 8.914 992 HB3 SER 122 HB3 SER 122 2.406 14.375 7.449 993 HG SER 122 HG SER 122 2.243 12.224 8.710 994 HA PRO 123 HA PRO 123 8.340 13.896 8.859 995 HB2 PRO 123 HB2 PRO 123 7.885 15.288 11.314 996 HB3 PRO 123 HB3 PRO 123 8.580 16.036 9.871 997 HG2 PRO 123 HG2 PRO 123 5.743 16.105 10.881 998 HG3 PRO 123 HG3 PRO 123 6.679 17.374 10.081 999 HD2 PRO 123 HD2 PRO 123 4.788 15.989 8.723 1000 HD3 PRO 123 HD3 PRO 123 6.280 16.495 7.918 1001 H ALA 124 H ALA 124 5.420 13.819 11.082 1002 HA ALA 124 HA ALA 124 6.551 12.000 12.869 1003 HB1 ALA 124 HB1 ALA 124 4.174 11.544 13.475 1004 HB2 ALA 124 HB2 ALA 124 4.481 13.303 13.277 1005 HB3 ALA 124 HB3 ALA 124 3.641 12.386 11.981 1006 H ALA 125 H ALA 125 4.418 11.336 9.950 1007 HA ALA 125 HA ALA 125 4.382 8.567 10.249 1008 HB1 ALA 125 HB1 ALA 125 3.827 8.550 7.838 1009 HB2 ALA 125 HB2 ALA 125 2.906 9.810 8.727 1010 HB3 ALA 125 HB3 ALA 125 4.317 10.274 7.718 1011 H THR 126 H THR 126 6.834 10.769 8.787 1012 HA THR 126 HA THR 126 8.317 8.733 7.531 1013 HB THR 126 HB THR 126 9.333 11.403 8.610 1014 HG1 THR 126 HG1 THR 126 7.702 12.077 7.298 1015 HG21 THR 126 HG21 THR 126 10.908 11.219 6.689 1016 HG22 THR 126 HG22 THR 126 11.069 9.826 7.810 1017 HG23 THR 126 HG23 THR 126 10.186 9.632 6.258 1018 H ALA 127 H ALA 127 8.620 10.434 10.760 1019 HA ALA 127 HA ALA 127 10.941 9.048 11.547 1020 HB1 ALA 127 HB1 ALA 127 10.345 9.882 13.804 1021 HB2 ALA 127 HB2 ALA 127 10.220 11.168 12.556 1022 HB3 ALA 127 HB3 ALA 127 8.734 10.381 13.186 1023 H ILE 128 H ILE 128 7.398 8.440 12.258 1024 HA ILE 128 HA ILE 128 7.858 6.265 13.942 1025 HB ILE 128 HB ILE 128 5.500 6.836 12.081 1026 HG12 ILE 128 HG12 ILE 128 5.904 8.695 13.597 1027 HG13 ILE 128 HG13 ILE 128 4.441 7.825 14.079 1028 HG21 ILE 128 HG21 ILE 128 4.198 5.413 13.630 1029 HG22 ILE 128 HG22 ILE 128 5.514 4.500 12.818 1030 HG23 ILE 128 HG23 ILE 128 5.704 5.022 14.526 1031 HD11 ILE 128 HD11 ILE 128 5.779 8.456 16.037 1032 HD12 ILE 128 HD12 ILE 128 5.702 6.669 15.872 1033 HD13 ILE 128 HD13 ILE 128 7.187 7.552 15.383 1034 H PHE 129 H PHE 129 7.020 6.337 10.367 1035 HA PHE 129 HA PHE 129 7.096 3.608 9.924 1036 HB2 PHE 129 HB2 PHE 129 6.322 5.463 8.372 1037 HB3 PHE 129 HB3 PHE 129 8.020 5.835 8.045 1038 HD1 PHE 129 HD1 PHE 129 5.306 3.380 7.552 1039 HD2 PHE 129 HD2 PHE 129 9.380 4.392 6.651 1040 HE1 PHE 129 HE1 PHE 129 5.321 1.694 5.740 1041 HE2 PHE 129 HE2 PHE 129 9.400 2.706 4.837 1042 HZ PHE 129 HZ PHE 129 7.368 1.353 4.377 1043 H ARG 130 H ARG 130 9.822 6.011 10.048 1044 HA ARG 130 HA ARG 130 11.736 4.168 9.066 1045 HB2 ARG 130 HB2 ARG 130 11.715 6.841 9.371 1046 HB3 ARG 130 HB3 ARG 130 12.520 6.424 10.889 1047 HG2 ARG 130 HG2 ARG 130 13.996 4.870 9.258 1048 HG3 ARG 130 HG3 ARG 130 13.463 6.045 8.050 1049 HD2 ARG 130 HD2 ARG 130 14.883 6.696 10.681 1050 HD3 ARG 130 HD3 ARG 130 15.624 6.700 9.075 1051 HE ARG 130 HE ARG 130 14.051 8.576 8.503 1052 HH11 ARG 130 HH11 ARG 130 14.774 7.871 11.867 1053 HH12 ARG 130 HH12 ARG 130 14.401 9.473 12.411 1054 HH21 ARG 130 HH21 ARG 130 13.565 10.678 9.228 1055 HH22 ARG 130 HH22 ARG 130 13.712 11.071 10.909 1056 H LYS 131 H LYS 131 10.766 5.232 12.434 1057 HA LYS 131 HA LYS 131 12.711 3.874 13.846 1058 HB2 LYS 131 HB2 LYS 131 9.773 4.385 14.491 1059 HB3 LYS 131 HB3 LYS 131 10.941 3.747 15.657 1060 HG2 LYS 131 HG2 LYS 131 12.332 5.818 15.359 1061 HG3 LYS 131 HG3 LYS 131 11.111 6.457 14.250 1062 HD2 LYS 131 HD2 LYS 131 9.391 6.327 16.060 1063 HD3 LYS 131 HD3 LYS 131 10.603 5.674 17.170 1064 HE2 LYS 131 HE2 LYS 131 11.985 7.772 16.813 1065 HE3 LYS 131 HE3 LYS 131 10.671 8.425 15.825 1066 HZ1 LYS 131 HZ1 LYS 131 10.526 9.172 18.094 1067 HZ2 LYS 131 HZ2 LYS 131 9.226 8.246 17.748 1068 HZ3 LYS 131 HZ3 LYS 131 10.439 7.643 18.661 1069 H LEU 132 H LEU 132 9.402 2.639 12.828 1070 HA LEU 132 HA LEU 132 9.702 0.078 13.869 1071 HB2 LEU 132 HB2 LEU 132 8.229 1.015 11.366 1072 HB3 LEU 132 HB3 LEU 132 8.004 -0.553 12.153 1073 HG LEU 132 HG LEU 132 7.413 2.155 13.429 1074 HD11 LEU 132 HD11 LEU 132 5.041 1.509 13.158 1075 HD12 LEU 132 HD12 LEU 132 5.882 1.655 11.577 1076 HD13 LEU 132 HD13 LEU 132 5.550 0.032 12.271 1077 HD21 LEU 132 HD21 LEU 132 6.284 0.818 15.173 1078 HD22 LEU 132 HD22 LEU 132 6.844 -0.690 14.374 1079 HD23 LEU 132 HD23 LEU 132 8.039 0.451 15.077 1080 H ALA 133 H ALA 133 10.830 1.517 10.745 1081 HA ALA 133 HA ALA 133 11.597 -0.906 9.536 1082 HB1 ALA 133 HB1 ALA 133 12.945 0.568 8.076 1083 HB2 ALA 133 HB2 ALA 133 11.276 1.192 8.302 1084 HB3 ALA 133 HB3 ALA 133 12.643 1.942 9.192 1085 H GLY 134 H GLY 134 13.323 1.355 11.824 1086 HA2 GLY 134 HA2 GLY 134 15.851 0.086 11.509 1087 HA3 GLY 134 HA3 GLY 134 15.340 1.155 12.821 1088 H GLU 135 H GLU 135 12.936 -0.469 13.535 1089 HA GLU 135 HA GLU 135 13.953 -2.098 15.533 1090 HB2 GLU 135 HB2 GLU 135 11.607 -1.205 15.273 1091 HB3 GLU 135 HB3 GLU 135 11.346 -2.333 13.936 1092 HG2 GLU 135 HG2 GLU 135 10.385 -3.544 15.623 1093 HG3 GLU 135 HG3 GLU 135 12.040 -4.153 15.759 1094 H ARG 136 H ARG 136 13.011 -2.843 12.100 1095 HA ARG 136 HA ARG 136 13.808 -5.617 12.489 1096 HB2 ARG 136 HB2 ARG 136 12.516 -4.058 10.190 1097 HB3 ARG 136 HB3 ARG 136 12.985 -5.758 10.057 1098 HG2 ARG 136 HG2 ARG 136 11.323 -6.485 11.540 1099 HG3 ARG 136 HG3 ARG 136 11.202 -4.917 12.350 1100 HD2 ARG 136 HD2 ARG 136 10.073 -3.924 10.430 1101 HD3 ARG 136 HD3 ARG 136 10.381 -5.354 9.437 1102 HE ARG 136 HE ARG 136 8.565 -6.408 10.428 1103 HH11 ARG 136 HH11 ARG 136 9.437 -3.612 12.386 1104 HH12 ARG 136 HH12 ARG 136 8.035 -3.737 13.396 1105 HH21 ARG 136 HH21 ARG 136 6.741 -6.553 11.758 1106 HH22 ARG 136 HH22 ARG 136 6.502 -5.411 13.038 1107 H ASN 137 H ASN 137 15.793 -3.139 12.323 1108 HA ASN 137 HA ASN 137 17.810 -2.780 11.497 1109 HB2 ASN 137 HB2 ASN 137 17.696 -5.686 10.535 1110 HB3 ASN 137 HB3 ASN 137 19.153 -4.708 10.758 1111 HD21 ASN 137 HD21 ASN 137 19.886 -4.233 12.888 1112 HD22 ASN 137 HD22 ASN 137 19.339 -5.138 14.259 1113 H TYR 138 H TYR 138 15.682 -1.876 9.800 1114 HA TYR 138 HA TYR 138 15.988 -2.885 7.157 1115 HB2 TYR 138 HB2 TYR 138 14.367 -1.286 6.649 1116 HB3 TYR 138 HB3 TYR 138 14.104 -1.411 8.394 1117 HD1 TYR 138 HD1 TYR 138 15.842 0.285 9.792 1118 HD2 TYR 138 HD2 TYR 138 14.388 0.891 5.791 1119 HE1 TYR 138 HE1 TYR 138 16.262 2.717 10.005 1120 HE2 TYR 138 HE2 TYR 138 14.803 3.324 6.010 1121 HH TYR 138 HH TYR 138 15.529 4.967 7.288 1122 H THR 139 H THR 139 16.733 -1.398 5.296 1123 HA THR 139 HA THR 139 19.131 0.065 6.175 1124 HB THR 139 HB THR 139 20.024 -0.598 3.869 1125 HG1 THR 139 HG1 THR 139 18.986 -2.511 2.934 1126 HG21 THR 139 HG21 THR 139 20.677 -2.886 4.585 1127 HG22 THR 139 HG22 THR 139 20.778 -1.714 5.942 1128 HG23 THR 139 HG23 THR 139 19.394 -2.854 5.841 1129 H ASP 140 H ASP 140 19.782 1.882 4.782 1130 HA ASP 140 HA ASP 140 17.688 3.629 4.238 1131 HB2 ASP 140 HB2 ASP 140 20.204 4.063 4.655 1132 HB3 ASP 140 HB3 ASP 140 20.472 3.630 2.961 1133 H GLU 141 H GLU 141 19.159 1.145 2.153 1134 HA GLU 141 HA GLU 141 17.768 2.168 -0.148 1135 HB2 GLU 141 HB2 GLU 141 19.783 -0.045 0.232 1136 HB3 GLU 141 HB3 GLU 141 18.798 0.033 -1.236 1137 HG2 GLU 141 HG2 GLU 141 19.799 2.694 -0.632 1138 HG3 GLU 141 HG3 GLU 141 21.148 1.551 -0.581 1139 H MET 142 H MET 142 16.854 0.152 2.427 1140 HA MET 142 HA MET 142 15.152 -1.511 0.760 1141 HB2 MET 142 HB2 MET 142 16.478 -2.529 2.593 1142 HB3 MET 142 HB3 MET 142 15.726 -1.441 3.768 1143 HG2 MET 142 HG2 MET 142 13.515 -2.485 3.334 1144 HG3 MET 142 HG3 MET 142 14.251 -3.561 2.138 1145 HE1 MET 142 HE1 MET 142 16.329 -6.059 4.137 1146 HE2 MET 142 HE2 MET 142 15.925 -5.310 2.555 1147 HE3 MET 142 HE3 MET 142 17.111 -4.518 3.647 1148 H VAL 143 H VAL 143 14.873 1.571 2.200 1149 HA VAL 143 HA VAL 143 11.950 1.215 2.124 1150 HB VAL 143 HB VAL 143 13.589 2.725 4.214 1151 HG11 VAL 143 HG11 VAL 143 11.413 3.371 5.193 1152 HG12 VAL 143 HG12 VAL 143 11.640 4.049 3.545 1153 HG13 VAL 143 HG13 VAL 143 10.569 2.628 3.793 1154 HG21 VAL 143 HG21 VAL 143 12.430 1.220 5.812 1155 HG22 VAL 143 HG22 VAL 143 11.636 0.383 4.436 1156 HG23 VAL 143 HG23 VAL 143 13.420 0.305 4.626 1157 H ALA 144 H ALA 144 11.031 2.602 0.672 1158 HA ALA 144 HA ALA 144 12.493 5.056 -0.069 1159 HB1 ALA 144 HB1 ALA 144 11.519 4.791 -2.319 1160 HB2 ALA 144 HB2 ALA 144 12.595 3.425 -1.870 1161 HB3 ALA 144 HB3 ALA 144 10.812 3.218 -1.818 1162 H MET 145 H MET 145 11.573 6.854 -0.088 1163 HA MET 145 HA MET 145 8.779 7.110 0.474 1164 HB2 MET 145 HB2 MET 145 9.017 8.944 1.925 1165 HB3 MET 145 HB3 MET 145 9.883 7.521 2.519 1166 HG2 MET 145 HG2 MET 145 11.963 8.445 1.433 1167 HG3 MET 145 HG3 MET 145 11.053 9.923 1.090 1168 HE1 MET 145 HE1 MET 145 12.161 8.176 5.164 1169 HE2 MET 145 HE2 MET 145 10.498 7.788 4.608 1170 HE3 MET 145 HE3 MET 145 11.913 7.303 3.614 1171 H LEU 146 H LEU 146 7.461 8.925 -0.397 1172 HA LEU 146 HA LEU 146 9.078 10.246 -2.488 1173 HB2 LEU 146 HB2 LEU 146 6.120 9.581 -2.529 1174 HB3 LEU 146 HB3 LEU 146 6.927 10.615 -3.715 1175 HG LEU 146 HG LEU 146 6.740 8.412 -4.651 1176 HD11 LEU 146 HD11 LEU 146 9.106 7.828 -5.042 1177 HD12 LEU 146 HD12 LEU 146 8.834 9.601 -5.126 1178 HD13 LEU 146 HD13 LEU 146 9.591 8.877 -3.667 1179 HD21 LEU 146 HD21 LEU 146 7.708 6.422 -3.551 1180 HD22 LEU 146 HD22 LEU 146 8.136 7.423 -2.122 1181 HD23 LEU 146 HD23 LEU 146 6.412 7.169 -2.557 1182 HA PRO 147 HA PRO 147 7.974 13.980 -0.041 1183 HB2 PRO 147 HB2 PRO 147 9.746 15.683 -1.332 1184 HB3 PRO 147 HB3 PRO 147 10.365 14.504 -0.168 1185 HG2 PRO 147 HG2 PRO 147 10.303 14.346 -3.198 1186 HG3 PRO 147 HG3 PRO 147 11.615 13.924 -2.089 1187 HD2 PRO 147 HD2 PRO 147 9.953 12.024 -3.184 1188 HD3 PRO 147 HD3 PRO 147 10.701 11.815 -1.595 1189 H ARG 148 H ARG 148 8.105 16.468 -1.347 1190 HA ARG 148 HA ARG 148 5.671 16.792 -2.541 1191 HB2 ARG 148 HB2 ARG 148 5.854 18.990 -2.529 1192 HB3 ARG 148 HB3 ARG 148 7.012 18.519 -1.278 1193 HG2 ARG 148 HG2 ARG 148 7.745 19.097 -4.178 1194 HG3 ARG 148 HG3 ARG 148 7.874 20.265 -2.856 1195 HD2 ARG 148 HD2 ARG 148 9.212 17.514 -2.891 1196 HD3 ARG 148 HD3 ARG 148 10.020 19.030 -3.310 1197 HE ARG 148 HE ARG 148 8.777 19.273 -0.733 1198 HH11 ARG 148 HH11 ARG 148 11.486 17.675 -2.302 1199 HH12 ARG 148 HH12 ARG 148 12.464 17.671 -0.873 1200 HH21 ARG 148 HH21 ARG 148 10.076 19.284 1.122 1201 HH22 ARG 148 HH22 ARG 148 11.661 18.587 1.076 1202 H GLN 149 H GLN 149 5.710 15.047 -4.069 1203 HA GLN 149 HA GLN 149 6.400 16.098 -6.596 1204 HB2 GLN 149 HB2 GLN 149 8.035 14.400 -5.949 1205 HB3 GLN 149 HB3 GLN 149 6.788 13.198 -6.306 1206 HG2 GLN 149 HG2 GLN 149 6.562 14.272 -8.623 1207 HG3 GLN 149 HG3 GLN 149 7.993 15.236 -8.234 1208 HE21 GLN 149 HE21 GLN 149 9.276 13.285 -6.528 1209 HE22 GLN 149 HE22 GLN 149 9.820 11.974 -7.521 1210 H GLU 150 H GLU 150 3.597 16.528 -5.548 1211 HA GLU 150 HA GLU 150 2.337 14.281 -6.787 1212 HB2 GLU 150 HB2 GLU 150 1.190 17.114 -6.425 1213 HB3 GLU 150 HB3 GLU 150 0.346 15.573 -6.220 1214 HG2 GLU 150 HG2 GLU 150 0.454 16.320 -4.020 1215 HG3 GLU 150 HG3 GLU 150 1.873 15.267 -4.089 1216 H GLU 151 H GLU 151 1.787 13.831 -8.674 1217 HA GLU 151 HA GLU 151 1.740 15.928 -10.727 1218 HB2 GLU 151 HB2 GLU 151 4.005 14.702 -10.621 1219 HB3 GLU 151 HB3 GLU 151 3.139 13.213 -11.021 1220 HG2 GLU 151 HG2 GLU 151 2.757 13.841 -13.217 1221 HG3 GLU 151 HG3 GLU 151 2.731 15.570 -12.844 1222 H CYS 152 H CYS 152 1.109 12.401 -9.954 1223 HA CYS 152 HA CYS 152 -1.324 12.696 -11.620 1224 HB2 CYS 152 HB2 CYS 152 0.449 11.168 -12.538 1225 HB3 CYS 152 HB3 CYS 152 0.334 10.201 -11.062 1226 H THR 153 H THR 153 -3.213 11.387 -10.769 1227 HA THR 153 HA THR 153 -2.928 10.509 -8.026 1228 HB THR 153 HB THR 153 -5.330 12.046 -8.027 1229 HG1 THR 153 HG1 THR 153 -4.445 14.194 -8.469 1230 HG21 THR 153 HG21 THR 153 -4.174 13.329 -6.248 1231 HG22 THR 153 HG22 THR 153 -3.896 11.563 -6.081 1232 HG23 THR 153 HG23 THR 153 -2.607 12.615 -6.758 1233 H VAL 154 H VAL 154 -4.902 9.284 -7.263 1234 HA VAL 154 HA VAL 154 -6.209 8.053 -9.576 1235 HB VAL 154 HB VAL 154 -5.042 6.600 -7.952 1236 HG11 VAL 154 HG11 VAL 154 -5.949 6.276 -5.672 1237 HG12 VAL 154 HG12 VAL 154 -5.299 7.931 -5.922 1238 HG13 VAL 154 HG13 VAL 154 -7.073 7.652 -5.935 1239 HG21 VAL 154 HG21 VAL 154 -6.891 5.006 -7.538 1240 HG22 VAL 154 HG22 VAL 154 -8.077 6.297 -7.928 1241 HG23 VAL 154 HG23 VAL 154 -6.947 5.704 -9.192 1242 H ASP 155 H ASP 155 -8.474 8.150 -9.857 1243 HA ASP 155 HA ASP 155 -9.812 10.252 -8.450 1244 HB2 ASP 155 HB2 ASP 155 -10.245 10.001 -10.802 1245 HB3 ASP 155 HB3 ASP 155 -10.623 8.282 -10.629 1246 H GLU 156 H GLU 156 -11.900 10.056 -7.337 1247 HA GLU 156 HA GLU 156 -12.005 7.530 -5.831 1248 HB2 GLU 156 HB2 GLU 156 -13.108 8.858 -4.070 1249 HB3 GLU 156 HB3 GLU 156 -11.470 9.423 -4.428 1250 HG2 GLU 156 HG2 GLU 156 -12.632 11.172 -5.983 1251 HG3 GLU 156 HG3 GLU 156 -14.119 10.736 -5.131 1252 H VAL 157 H VAL 157 -14.076 10.066 -7.451 1253 HA VAL 157 HA VAL 157 -15.825 8.184 -8.496 1254 HB VAL 157 HB VAL 157 -16.583 7.712 -6.250 1255 HG11 VAL 157 HG11 VAL 157 -17.584 9.440 -4.794 1256 HG12 VAL 157 HG12 VAL 157 -15.843 9.744 -5.114 1257 HG13 VAL 157 HG13 VAL 157 -17.095 10.705 -5.972 1258 HG21 VAL 157 HG21 VAL 157 -18.980 8.293 -6.458 1259 HG22 VAL 157 HG22 VAL 157 -18.571 9.486 -7.737 1260 HG23 VAL 157 HG23 VAL 157 -18.278 7.735 -8.014 1261 HN1 EB4 158 HN1 EB4 158 4.051 -6.191 -7.353 1262 H8 EB4 158 H8 EB4 158 -2.236 -6.155 -4.873 1263 HN2 EB4 158 HN2 EB4 158 1.589 -4.948 -8.946 1264 H9 EB4 158 H9 EB4 158 1.038 -0.544 -3.483 1265 H10 EB4 158 H10 EB4 158 4.572 -7.762 -1.654 1266 HN3 EB4 158 HN3 EB4 158 4.027 -2.971 -7.814 1267 H7 EB4 158 H7 EB4 158 3.045 -5.814 -1.634 1268 H11 EB4 158 H11 EB4 158 -3.555 -6.787 -6.877 1269 H12 EB4 158 H12 EB4 158 2.512 1.352 -4.091 1270 H15 EB4 158 H15 EB4 158 4.303 1.052 -5.768 1271 H14 EB4 158 H14 EB4 158 -2.574 -6.515 -9.139 1272 H13 EB4 158 H13 EB4 158 5.474 -8.605 -3.800 1273 H22 EB4 158 H22 EB4 158 4.911 -6.972 -7.724 1274 H30 EB4 158 H30 EB4 158 6.793 -3.761 -10.162 1275 H30A EB4 158 H30A EB4 158 7.011 -3.267 -8.415 1276 H24 EB4 158 H24 EB4 158 4.772 -2.264 -8.471 1277 H28 EB4 158 H28 EB4 158 3.849 -8.612 -9.345 1278 H28A EB4 158 H28A EB4 158 4.750 -7.726 -10.670 1279 H23 EB4 158 H23 EB4 158 1.334 -5.212 -10.113 1280 H29 EB4 158 H29 EB4 158 1.372 -3.122 -11.220 1281 H29A EB4 158 H29A EB4 158 2.819 -3.729 -12.247 Start of MODEL 18 1 H1 MET 1 H1 MET 1 -28.824 3.859 -4.749 2 H2 MET 1 H2 MET 1 -28.054 4.670 -3.559 3 H3 MET 1 H3 MET 1 -28.528 5.456 -4.909 4 HA MET 1 HA MET 1 -26.499 3.341 -4.765 5 HB2 MET 1 HB2 MET 1 -27.591 4.997 -7.086 6 HB3 MET 1 HB3 MET 1 -26.033 4.165 -7.166 7 HG2 MET 1 HG2 MET 1 -27.146 1.990 -6.808 8 HG3 MET 1 HG3 MET 1 -28.711 2.797 -6.642 9 HE1 MET 1 HE1 MET 1 -28.917 0.975 -10.164 10 HE2 MET 1 HE2 MET 1 -28.029 0.401 -8.712 11 HE3 MET 1 HE3 MET 1 -29.656 1.141 -8.536 12 H THR 2 H THR 2 -24.319 4.057 -4.633 13 HA THR 2 HA THR 2 -22.713 5.410 -3.919 14 HB THR 2 HB THR 2 -23.761 7.471 -5.909 15 HG1 THR 2 HG1 THR 2 -22.729 6.123 -7.563 16 HG21 THR 2 HG21 THR 2 -21.345 7.712 -6.407 17 HG22 THR 2 HG22 THR 2 -21.686 7.975 -4.663 18 HG23 THR 2 HG23 THR 2 -20.971 6.423 -5.214 19 H VAL 3 H VAL 3 -24.912 5.632 -2.149 20 HA VAL 3 HA VAL 3 -25.177 8.510 -1.710 21 HB VAL 3 HB VAL 3 -26.944 7.883 -0.091 22 HG11 VAL 3 HG11 VAL 3 -28.588 7.001 -1.718 23 HG12 VAL 3 HG12 VAL 3 -27.547 8.276 -2.438 24 HG13 VAL 3 HG13 VAL 3 -27.245 6.547 -2.820 25 HG21 VAL 3 HG21 VAL 3 -27.726 5.544 0.070 26 HG22 VAL 3 HG22 VAL 3 -26.346 5.017 -0.952 27 HG23 VAL 3 HG23 VAL 3 -26.042 5.734 0.666 28 HA PRO 4 HA PRO 4 -22.443 8.506 1.815 29 HB2 PRO 4 HB2 PRO 4 -23.949 9.954 3.686 30 HB3 PRO 4 HB3 PRO 4 -23.106 10.739 2.344 31 HG2 PRO 4 HG2 PRO 4 -26.021 9.966 2.580 32 HG3 PRO 4 HG3 PRO 4 -25.307 11.434 1.899 33 HD2 PRO 4 HD2 PRO 4 -26.204 9.433 0.293 34 HD3 PRO 4 HD3 PRO 4 -24.788 10.394 -0.155 35 H ASP 5 H ASP 5 -22.452 6.256 2.217 36 HA ASP 5 HA ASP 5 -23.970 5.519 4.640 37 HB2 ASP 5 HB2 ASP 5 -25.039 4.820 2.299 38 HB3 ASP 5 HB3 ASP 5 -23.724 3.638 2.266 39 H ARG 6 H ARG 6 -22.837 2.639 3.859 40 HA ARG 6 HA ARG 6 -20.736 2.544 5.549 41 HB2 ARG 6 HB2 ARG 6 -21.731 0.964 3.212 42 HB3 ARG 6 HB3 ARG 6 -20.013 0.716 3.552 43 HG2 ARG 6 HG2 ARG 6 -21.137 -0.986 4.757 44 HG3 ARG 6 HG3 ARG 6 -20.680 0.211 5.976 45 HD2 ARG 6 HD2 ARG 6 -22.978 -0.503 6.375 46 HD3 ARG 6 HD3 ARG 6 -22.972 1.193 5.876 47 HE ARG 6 HE ARG 6 -23.555 0.281 3.547 48 HH11 ARG 6 HH11 ARG 6 -24.393 -1.441 6.493 49 HH12 ARG 6 HH12 ARG 6 -25.777 -2.212 5.792 50 HH21 ARG 6 HH21 ARG 6 -25.390 -0.713 2.650 51 HH22 ARG 6 HH22 ARG 6 -26.344 -1.798 3.606 52 H SER 7 H SER 7 -20.685 3.962 2.273 53 HA SER 7 HA SER 7 -18.093 3.662 1.479 54 HB2 SER 7 HB2 SER 7 -19.141 6.460 1.294 55 HB3 SER 7 HB3 SER 7 -18.718 5.341 -0.008 56 HG SER 7 HG SER 7 -21.139 6.029 0.586 57 H GLU 8 H GLU 8 -19.316 5.716 4.175 58 HA GLU 8 HA GLU 8 -17.110 7.372 4.469 59 HB2 GLU 8 HB2 GLU 8 -19.114 6.294 6.478 60 HB3 GLU 8 HB3 GLU 8 -17.861 7.468 6.904 61 HG2 GLU 8 HG2 GLU 8 -18.815 8.893 4.928 62 HG3 GLU 8 HG3 GLU 8 -20.215 7.816 5.013 63 H ILE 9 H ILE 9 -17.427 3.903 5.205 64 HA ILE 9 HA ILE 9 -15.248 3.941 7.068 65 HB ILE 9 HB ILE 9 -16.593 1.580 5.622 66 HG12 ILE 9 HG12 ILE 9 -17.236 2.795 8.353 67 HG13 ILE 9 HG13 ILE 9 -18.189 3.060 6.887 68 HG21 ILE 9 HG21 ILE 9 -15.785 0.255 7.548 69 HG22 ILE 9 HG22 ILE 9 -14.431 1.013 6.643 70 HG23 ILE 9 HG23 ILE 9 -14.970 1.714 8.206 71 HD11 ILE 9 HD11 ILE 9 -19.211 1.343 8.306 72 HD12 ILE 9 HD12 ILE 9 -18.673 0.637 6.745 73 HD13 ILE 9 HD13 ILE 9 -17.705 0.367 8.234 74 H ALA 10 H ALA 10 -15.339 4.090 3.593 75 HA ALA 10 HA ALA 10 -12.548 3.149 3.551 76 HB1 ALA 10 HB1 ALA 10 -12.989 2.060 1.362 77 HB2 ALA 10 HB2 ALA 10 -13.935 1.305 2.689 78 HB3 ALA 10 HB3 ALA 10 -14.737 2.428 1.540 79 H GLY 11 H GLY 11 -12.020 3.644 0.786 80 HA2 GLY 11 HA2 GLY 11 -12.904 5.762 -0.519 81 HA3 GLY 11 HA3 GLY 11 -12.128 6.567 0.851 82 H LYS 12 H LYS 12 -10.621 7.569 -0.708 83 HA LYS 12 HA LYS 12 -8.704 5.689 -1.896 84 HB2 LYS 12 HB2 LYS 12 -7.941 7.689 -3.174 85 HB3 LYS 12 HB3 LYS 12 -9.635 7.277 -3.469 86 HG2 LYS 12 HG2 LYS 12 -10.404 9.111 -2.060 87 HG3 LYS 12 HG3 LYS 12 -8.760 9.442 -1.498 88 HD2 LYS 12 HD2 LYS 12 -8.061 10.099 -3.768 89 HD3 LYS 12 HD3 LYS 12 -9.633 9.630 -4.428 90 HE2 LYS 12 HE2 LYS 12 -9.537 12.068 -4.125 91 HE3 LYS 12 HE3 LYS 12 -10.756 11.368 -3.052 92 HZ1 LYS 12 HZ1 LYS 12 -9.319 13.001 -1.973 93 HZ2 LYS 12 HZ2 LYS 12 -9.231 11.544 -1.242 94 HZ3 LYS 12 HZ3 LYS 12 -8.015 12.048 -2.207 95 H TRP 13 H TRP 13 -6.561 5.585 -1.203 96 HA TRP 13 HA TRP 13 -5.698 7.601 0.789 97 HB2 TRP 13 HB2 TRP 13 -5.129 4.607 0.949 98 HB3 TRP 13 HB3 TRP 13 -4.771 5.849 2.156 99 HD1 TRP 13 HD1 TRP 13 -8.163 5.012 0.360 100 HE1 TRP 13 HE1 TRP 13 -9.986 4.709 2.158 101 HE3 TRP 13 HE3 TRP 13 -5.230 5.494 4.549 102 HZ2 TRP 13 HZ2 TRP 13 -10.167 4.618 4.968 103 HZ3 TRP 13 HZ3 TRP 13 -6.305 5.256 6.773 104 HH2 TRP 13 HH2 TRP 13 -8.735 4.824 6.977 105 H TYR 14 H TYR 14 -3.647 8.342 0.464 106 HA TYR 14 HA TYR 14 -2.255 7.314 -1.878 107 HB2 TYR 14 HB2 TYR 14 -1.510 9.886 -0.486 108 HB3 TYR 14 HB3 TYR 14 -1.221 9.387 -2.158 109 HD1 TYR 14 HD1 TYR 14 -3.982 8.476 -2.999 110 HD2 TYR 14 HD2 TYR 14 -2.710 11.831 -0.648 111 HE1 TYR 14 HE1 TYR 14 -6.012 9.731 -3.682 112 HE2 TYR 14 HE2 TYR 14 -4.722 13.078 -1.314 113 HH TYR 14 HH TYR 14 -6.332 13.094 -3.227 114 H VAL 15 H VAL 15 -0.016 6.693 -1.838 115 HA VAL 15 HA VAL 15 0.953 6.270 0.900 116 HB VAL 15 HB VAL 15 0.476 4.177 -0.342 117 HG11 VAL 15 HG11 VAL 15 1.835 3.559 -2.306 118 HG12 VAL 15 HG12 VAL 15 0.812 5.000 -2.625 119 HG13 VAL 15 HG13 VAL 15 2.569 5.198 -2.310 120 HG21 VAL 15 HG21 VAL 15 2.691 3.112 -0.027 121 HG22 VAL 15 HG22 VAL 15 3.455 4.735 0.063 122 HG23 VAL 15 HG23 VAL 15 2.286 4.221 1.326 123 H VAL 16 H VAL 16 2.883 7.117 1.557 124 HA VAL 16 HA VAL 16 4.500 8.398 -0.532 125 HB VAL 16 HB VAL 16 5.211 10.066 1.177 126 HG11 VAL 16 HG11 VAL 16 3.131 11.388 1.071 127 HG12 VAL 16 HG12 VAL 16 3.489 10.579 -0.492 128 HG13 VAL 16 HG13 VAL 16 2.221 9.915 0.593 129 HG21 VAL 16 HG21 VAL 16 3.852 10.344 3.204 130 HG22 VAL 16 HG22 VAL 16 2.968 8.829 2.819 131 HG23 VAL 16 HG23 VAL 16 4.724 8.773 3.190 132 H ALA 17 H ALA 17 4.421 5.704 1.464 133 HA ALA 17 HA ALA 17 7.338 5.946 1.816 134 HB1 ALA 17 HB1 ALA 17 7.009 4.464 3.769 135 HB2 ALA 17 HB2 ALA 17 6.097 5.999 3.962 136 HB3 ALA 17 HB3 ALA 17 5.235 4.496 3.489 137 H LEU 18 H LEU 18 8.519 4.114 1.116 138 HA LEU 18 HA LEU 18 6.844 1.851 0.269 139 HB2 LEU 18 HB2 LEU 18 9.118 3.214 -1.259 140 HB3 LEU 18 HB3 LEU 18 8.185 1.811 -1.795 141 HG LEU 18 HG LEU 18 6.999 4.573 -1.394 142 HD11 LEU 18 HD11 LEU 18 7.037 4.890 -3.862 143 HD12 LEU 18 HD12 LEU 18 8.680 4.813 -3.141 144 HD13 LEU 18 HD13 LEU 18 8.020 3.395 -4.022 145 HD21 LEU 18 HD21 LEU 18 5.195 3.679 -2.890 146 HD22 LEU 18 HD22 LEU 18 6.043 2.097 -2.921 147 HD23 LEU 18 HD23 LEU 18 5.372 2.725 -1.379 148 H ALA 19 H ALA 19 7.756 -0.052 0.763 149 HA ALA 19 HA ALA 19 10.584 -0.120 1.509 150 HB1 ALA 19 HB1 ALA 19 9.998 -1.455 3.463 151 HB2 ALA 19 HB2 ALA 19 9.318 0.204 3.572 152 HB3 ALA 19 HB3 ALA 19 8.253 -1.176 3.140 153 H SER 20 H SER 20 11.489 -2.147 0.933 154 HA SER 20 HA SER 20 9.693 -4.206 -0.147 155 HB2 SER 20 HB2 SER 20 12.108 -3.025 -1.609 156 HB3 SER 20 HB3 SER 20 11.022 -4.292 -2.194 157 HG SER 20 HG SER 20 10.499 -2.196 -3.085 158 H ASN 21 H ASN 21 11.032 -6.281 -0.529 159 HA ASN 21 HA ASN 21 13.166 -6.383 1.536 160 HB2 ASN 21 HB2 ASN 21 10.843 -7.735 1.478 161 HB3 ASN 21 HB3 ASN 21 11.765 -8.781 0.390 162 HD21 ASN 21 HD21 ASN 21 13.833 -9.618 1.194 163 HD22 ASN 21 HD22 ASN 21 13.987 -9.989 2.879 164 H THR 22 H THR 22 12.614 -6.339 -1.838 165 HA THR 22 HA THR 22 15.300 -7.567 -2.274 166 HB THR 22 HB THR 22 14.405 -7.648 -4.706 167 HG1 THR 22 HG1 THR 22 12.306 -7.120 -4.837 168 HG21 THR 22 HG21 THR 22 13.432 -9.818 -4.106 169 HG22 THR 22 HG22 THR 22 14.912 -9.513 -3.134 170 HG23 THR 22 HG23 THR 22 13.290 -9.298 -2.393 171 H GLU 23 H GLU 23 17.176 -6.685 -3.167 172 HA GLU 23 HA GLU 23 17.188 -3.833 -3.107 173 HB2 GLU 23 HB2 GLU 23 19.286 -4.136 -4.608 174 HB3 GLU 23 HB3 GLU 23 19.324 -4.809 -2.973 175 HG2 GLU 23 HG2 GLU 23 18.410 -6.561 -5.261 176 HG3 GLU 23 HG3 GLU 23 20.136 -6.227 -5.067 177 H PHE 24 H PHE 24 16.644 -6.290 -5.737 178 HA PHE 24 HA PHE 24 16.681 -4.758 -8.007 179 HB2 PHE 24 HB2 PHE 24 14.678 -6.937 -7.184 180 HB3 PHE 24 HB3 PHE 24 14.910 -6.359 -8.840 181 HD1 PHE 24 HD1 PHE 24 17.080 -6.766 -10.005 182 HD2 PHE 24 HD2 PHE 24 16.170 -8.545 -6.204 183 HE1 PHE 24 HE1 PHE 24 18.861 -8.441 -10.367 184 HE2 PHE 24 HE2 PHE 24 17.953 -10.230 -6.565 185 HZ PHE 24 HZ PHE 24 19.302 -10.178 -8.650 186 H PHE 25 H PHE 25 13.908 -5.252 -5.676 187 HA PHE 25 HA PHE 25 12.189 -3.506 -7.099 188 HB2 PHE 25 HB2 PHE 25 12.141 -4.916 -4.444 189 HB3 PHE 25 HB3 PHE 25 11.010 -3.584 -4.715 190 HD1 PHE 25 HD1 PHE 25 12.252 -6.687 -6.439 191 HD2 PHE 25 HD2 PHE 25 8.936 -4.070 -5.655 192 HE1 PHE 25 HE1 PHE 25 10.755 -8.218 -7.680 193 HE2 PHE 25 HE2 PHE 25 7.438 -5.596 -6.908 194 HZ PHE 25 HZ PHE 25 8.345 -7.673 -7.923 195 H LEU 26 H LEU 26 14.573 -2.988 -4.398 196 HA LEU 26 HA LEU 26 13.557 -0.634 -3.405 197 HB2 LEU 26 HB2 LEU 26 16.542 -1.132 -3.939 198 HB3 LEU 26 HB3 LEU 26 15.817 -0.287 -2.565 199 HG LEU 26 HG LEU 26 15.649 -3.290 -3.078 200 HD11 LEU 26 HD11 LEU 26 17.189 -3.464 -1.152 201 HD12 LEU 26 HD12 LEU 26 17.926 -2.562 -2.519 202 HD13 LEU 26 HD13 LEU 26 17.305 -1.673 -1.088 203 HD21 LEU 26 HD21 LEU 26 14.743 -3.395 -0.784 204 HD22 LEU 26 HD22 LEU 26 14.755 -1.601 -0.700 205 HD23 LEU 26 HD23 LEU 26 13.689 -2.438 -1.879 206 H ARG 27 H ARG 27 16.177 -0.888 -6.016 207 HA ARG 27 HA ARG 27 16.105 1.895 -6.546 208 HB2 ARG 27 HB2 ARG 27 18.003 0.410 -7.111 209 HB3 ARG 27 HB3 ARG 27 17.000 -0.442 -8.292 210 HG2 ARG 27 HG2 ARG 27 16.687 2.116 -9.202 211 HG3 ARG 27 HG3 ARG 27 18.286 2.263 -8.463 212 HD2 ARG 27 HD2 ARG 27 18.625 1.610 -10.758 213 HD3 ARG 27 HD3 ARG 27 19.015 0.207 -9.754 214 HE ARG 27 HE ARG 27 16.253 0.121 -10.573 215 HH11 ARG 27 HH11 ARG 27 19.522 -0.398 -11.751 216 HH12 ARG 27 HH12 ARG 27 19.033 -1.528 -12.969 217 HH21 ARG 27 HH21 ARG 27 15.624 -1.355 -12.166 218 HH22 ARG 27 HH22 ARG 27 16.808 -2.074 -13.205 219 H GLU 28 H GLU 28 14.191 -0.890 -7.629 220 HA GLU 28 HA GLU 28 13.105 0.246 -9.962 221 HB2 GLU 28 HB2 GLU 28 12.155 -1.891 -8.042 222 HB3 GLU 28 HB3 GLU 28 11.196 -1.378 -9.437 223 HG2 GLU 28 HG2 GLU 28 13.982 -2.619 -9.469 224 HG3 GLU 28 HG3 GLU 28 12.473 -3.358 -10.020 225 H LYS 29 H LYS 29 11.789 -0.019 -6.551 226 HA LYS 29 HA LYS 29 9.656 1.710 -7.171 227 HB2 LYS 29 HB2 LYS 29 10.532 0.091 -4.913 228 HB3 LYS 29 HB3 LYS 29 9.999 1.683 -4.358 229 HG2 LYS 29 HG2 LYS 29 8.310 0.024 -6.275 230 HG3 LYS 29 HG3 LYS 29 8.242 -0.229 -4.526 231 HD2 LYS 29 HD2 LYS 29 6.465 1.304 -5.099 232 HD3 LYS 29 HD3 LYS 29 7.701 2.231 -4.239 233 HE2 LYS 29 HE2 LYS 29 7.209 3.639 -6.044 234 HE3 LYS 29 HE3 LYS 29 8.644 2.786 -6.627 235 HZ1 LYS 29 HZ1 LYS 29 6.468 2.964 -8.044 236 HZ2 LYS 29 HZ2 LYS 29 7.424 1.643 -8.131 237 HZ3 LYS 29 HZ3 LYS 29 6.059 1.605 -7.236 238 H ASP 30 H ASP 30 12.807 2.359 -5.376 239 HA ASP 30 HA ASP 30 12.069 4.925 -4.576 240 HB2 ASP 30 HB2 ASP 30 14.066 3.901 -3.663 241 HB3 ASP 30 HB3 ASP 30 14.736 3.580 -5.268 242 H LYS 31 H LYS 31 13.840 3.915 -7.638 243 HA LYS 31 HA LYS 31 14.017 6.603 -8.544 244 HB2 LYS 31 HB2 LYS 31 15.227 4.246 -9.186 245 HB3 LYS 31 HB3 LYS 31 14.032 4.332 -10.487 246 HG2 LYS 31 HG2 LYS 31 16.117 6.471 -9.833 247 HG3 LYS 31 HG3 LYS 31 16.212 5.299 -11.154 248 HD2 LYS 31 HD2 LYS 31 15.302 7.023 -12.363 249 HD3 LYS 31 HD3 LYS 31 13.783 6.368 -11.737 250 HE2 LYS 31 HE2 LYS 31 14.394 7.984 -9.650 251 HE3 LYS 31 HE3 LYS 31 15.294 8.845 -10.905 252 HZ1 LYS 31 HZ1 LYS 31 12.934 9.524 -10.589 253 HZ2 LYS 31 HZ2 LYS 31 13.328 9.153 -12.129 254 HZ3 LYS 31 HZ3 LYS 31 12.465 8.098 -11.231 255 H MET 32 H MET 32 11.358 4.353 -8.384 256 HA MET 32 HA MET 32 10.190 5.159 -10.796 257 HB2 MET 32 HB2 MET 32 9.407 3.604 -8.365 258 HB3 MET 32 HB3 MET 32 8.064 4.354 -9.238 259 HG2 MET 32 HG2 MET 32 9.707 3.070 -11.202 260 HG3 MET 32 HG3 MET 32 9.536 1.936 -9.856 261 HE1 MET 32 HE1 MET 32 6.086 3.677 -12.428 262 HE2 MET 32 HE2 MET 32 6.955 4.720 -11.253 263 HE3 MET 32 HE3 MET 32 7.842 3.992 -12.634 264 H LYS 33 H LYS 33 8.573 5.776 -7.548 265 HA LYS 33 HA LYS 33 8.449 8.440 -7.521 266 HB2 LYS 33 HB2 LYS 33 7.080 7.639 -9.937 267 HB3 LYS 33 HB3 LYS 33 6.006 8.510 -8.834 268 HG2 LYS 33 HG2 LYS 33 7.522 10.419 -8.732 269 HG3 LYS 33 HG3 LYS 33 8.796 9.532 -9.579 270 HD2 LYS 33 HD2 LYS 33 7.280 9.316 -11.576 271 HD3 LYS 33 HD3 LYS 33 6.059 10.273 -10.727 272 HE2 LYS 33 HE2 LYS 33 7.523 12.221 -10.667 273 HE3 LYS 33 HE3 LYS 33 8.886 11.281 -11.287 274 HZ1 LYS 33 HZ1 LYS 33 8.040 12.331 -13.136 275 HZ2 LYS 33 HZ2 LYS 33 7.338 10.863 -13.262 276 HZ3 LYS 33 HZ3 LYS 33 6.475 12.136 -12.715 277 H MET 34 H MET 34 5.872 9.166 -6.877 278 HA MET 34 HA MET 34 5.377 7.632 -4.507 279 HB2 MET 34 HB2 MET 34 5.078 10.162 -4.873 280 HB3 MET 34 HB3 MET 34 3.643 9.775 -5.831 281 HG2 MET 34 HG2 MET 34 2.574 8.713 -3.898 282 HG3 MET 34 HG3 MET 34 4.039 8.916 -2.929 283 HE1 MET 34 HE1 MET 34 0.982 12.053 -4.229 284 HE2 MET 34 HE2 MET 34 2.386 11.980 -5.347 285 HE3 MET 34 HE3 MET 34 1.402 10.508 -5.043 286 H ALA 35 H ALA 35 2.976 6.857 -4.045 287 HA ALA 35 HA ALA 35 1.809 5.714 -6.484 288 HB1 ALA 35 HB1 ALA 35 1.434 3.580 -5.280 289 HB2 ALA 35 HB2 ALA 35 3.177 3.957 -5.497 290 HB3 ALA 35 HB3 ALA 35 2.396 4.210 -3.900 291 H MET 36 H MET 36 -0.449 4.744 -6.044 292 HA MET 36 HA MET 36 -1.864 6.471 -4.112 293 HB2 MET 36 HB2 MET 36 -2.722 5.632 -6.949 294 HB3 MET 36 HB3 MET 36 -3.718 6.547 -5.809 295 HG2 MET 36 HG2 MET 36 -1.018 7.611 -6.689 296 HG3 MET 36 HG3 MET 36 -2.438 7.792 -7.727 297 HE1 MET 36 HE1 MET 36 -2.166 11.269 -6.654 298 HE2 MET 36 HE2 MET 36 -0.759 10.605 -5.757 299 HE3 MET 36 HE3 MET 36 -1.151 9.987 -7.397 300 H ALA 37 H ALA 37 -4.128 5.414 -3.600 301 HA ALA 37 HA ALA 37 -4.403 2.632 -4.270 302 HB1 ALA 37 HB1 ALA 37 -4.294 1.879 -1.913 303 HB2 ALA 37 HB2 ALA 37 -2.713 2.513 -2.481 304 HB3 ALA 37 HB3 ALA 37 -3.756 3.521 -1.422 305 H ARG 38 H ARG 38 -6.570 2.081 -4.198 306 HA ARG 38 HA ARG 38 -8.337 3.887 -2.653 307 HB2 ARG 38 HB2 ARG 38 -8.609 4.367 -5.006 308 HB3 ARG 38 HB3 ARG 38 -8.666 2.647 -5.415 309 HG2 ARG 38 HG2 ARG 38 -10.781 2.605 -3.830 310 HG3 ARG 38 HG3 ARG 38 -10.780 4.356 -4.073 311 HD2 ARG 38 HD2 ARG 38 -10.717 3.926 -6.593 312 HD3 ARG 38 HD3 ARG 38 -10.929 2.205 -6.249 313 HE ARG 38 HE ARG 38 -13.111 2.777 -5.207 314 HH11 ARG 38 HH11 ARG 38 -11.628 5.141 -7.351 315 HH12 ARG 38 HH12 ARG 38 -13.120 5.959 -7.675 316 HH21 ARG 38 HH21 ARG 38 -15.054 3.885 -5.627 317 HH22 ARG 38 HH22 ARG 38 -15.061 5.247 -6.698 318 H ILE 39 H ILE 39 -9.602 2.765 -1.152 319 HA ILE 39 HA ILE 39 -9.619 -0.156 -1.464 320 HB ILE 39 HB ILE 39 -10.036 1.515 1.069 321 HG12 ILE 39 HG12 ILE 39 -7.757 1.835 0.291 322 HG13 ILE 39 HG13 ILE 39 -7.767 0.810 1.732 323 HG21 ILE 39 HG21 ILE 39 -9.698 -0.639 2.238 324 HG22 ILE 39 HG22 ILE 39 -11.118 -0.683 1.140 325 HG23 ILE 39 HG23 ILE 39 -9.581 -1.474 0.652 326 HD11 ILE 39 HD11 ILE 39 -6.165 -0.020 0.069 327 HD12 ILE 39 HD12 ILE 39 -7.490 -1.206 0.317 328 HD13 ILE 39 HD13 ILE 39 -7.479 -0.165 -1.147 329 H SER 40 H SER 40 -11.560 -1.108 -1.929 330 HA SER 40 HA SER 40 -14.023 0.255 -1.049 331 HB2 SER 40 HB2 SER 40 -13.581 -1.070 -3.784 332 HB3 SER 40 HB3 SER 40 -15.050 -0.261 -3.222 333 HG SER 40 HG SER 40 -13.133 0.890 -4.566 334 H PHE 41 H PHE 41 -15.328 -1.109 0.097 335 HA PHE 41 HA PHE 41 -14.656 -3.951 0.021 336 HB2 PHE 41 HB2 PHE 41 -16.155 -4.084 2.039 337 HB3 PHE 41 HB3 PHE 41 -14.664 -3.152 2.228 338 HD1 PHE 41 HD1 PHE 41 -14.729 -0.691 2.357 339 HD2 PHE 41 HD2 PHE 41 -18.301 -3.057 2.179 340 HE1 PHE 41 HE1 PHE 41 -16.044 1.245 3.166 341 HE2 PHE 41 HE2 PHE 41 -19.622 -1.135 2.987 342 HZ PHE 41 HZ PHE 41 -18.500 1.021 3.481 343 H LEU 42 H LEU 42 -15.749 -5.293 -1.383 344 HA LEU 42 HA LEU 42 -18.326 -4.390 -2.357 345 HB2 LEU 42 HB2 LEU 42 -16.487 -5.565 -3.712 346 HB3 LEU 42 HB3 LEU 42 -16.834 -7.035 -2.791 347 HG LEU 42 HG LEU 42 -17.812 -6.945 -5.096 348 HD11 LEU 42 HD11 LEU 42 -20.017 -7.854 -4.454 349 HD12 LEU 42 HD12 LEU 42 -18.694 -8.482 -3.415 350 HD13 LEU 42 HD13 LEU 42 -19.794 -7.205 -2.795 351 HD21 LEU 42 HD21 LEU 42 -19.873 -5.614 -5.444 352 HD22 LEU 42 HD22 LEU 42 -19.631 -4.839 -3.842 353 HD23 LEU 42 HD23 LEU 42 -18.436 -4.576 -5.157 354 H GLY 43 H GLY 43 -17.086 -6.829 -0.022 355 HA2 GLY 43 HA2 GLY 43 -19.828 -7.356 0.839 356 HA3 GLY 43 HA3 GLY 43 -18.898 -8.724 0.215 357 H GLU 44 H GLU 44 -19.727 -9.011 2.811 358 HA GLU 44 HA GLU 44 -18.150 -7.909 4.797 359 HB2 GLU 44 HB2 GLU 44 -19.156 -10.802 4.651 360 HB3 GLU 44 HB3 GLU 44 -18.831 -9.861 6.113 361 HG2 GLU 44 HG2 GLU 44 -20.712 -8.317 5.511 362 HG3 GLU 44 HG3 GLU 44 -21.051 -9.310 4.088 363 H ASP 45 H ASP 45 -17.547 -10.839 2.689 364 HA ASP 45 HA ASP 45 -14.819 -10.921 3.828 365 HB2 ASP 45 HB2 ASP 45 -16.135 -12.972 4.239 366 HB3 ASP 45 HB3 ASP 45 -16.539 -13.096 2.522 367 H GLU 46 H GLU 46 -16.276 -9.437 1.310 368 HA GLU 46 HA GLU 46 -14.083 -10.120 -0.539 369 HB2 GLU 46 HB2 GLU 46 -16.354 -11.016 -1.242 370 HB3 GLU 46 HB3 GLU 46 -16.923 -9.344 -1.330 371 HG2 GLU 46 HG2 GLU 46 -16.266 -10.144 -3.547 372 HG3 GLU 46 HG3 GLU 46 -15.214 -8.819 -3.031 373 H LEU 47 H LEU 47 -12.953 -8.422 -1.363 374 HA LEU 47 HA LEU 47 -14.000 -5.758 -1.077 375 HB2 LEU 47 HB2 LEU 47 -11.893 -4.935 0.035 376 HB3 LEU 47 HB3 LEU 47 -13.081 -5.773 1.041 377 HG LEU 47 HG LEU 47 -10.823 -7.406 -0.102 378 HD11 LEU 47 HD11 LEU 47 -9.381 -6.710 1.762 379 HD12 LEU 47 HD12 LEU 47 -9.741 -5.334 0.664 380 HD13 LEU 47 HD13 LEU 47 -10.589 -5.470 2.241 381 HD21 LEU 47 HD21 LEU 47 -11.085 -8.526 2.069 382 HD22 LEU 47 HD22 LEU 47 -12.317 -7.313 2.554 383 HD23 LEU 47 HD23 LEU 47 -12.648 -8.431 1.188 384 H LYS 48 H LYS 48 -12.975 -4.151 -2.391 385 HA LYS 48 HA LYS 48 -11.083 -5.306 -4.340 386 HB2 LYS 48 HB2 LYS 48 -13.220 -4.961 -5.425 387 HB3 LYS 48 HB3 LYS 48 -13.425 -3.371 -4.676 388 HG2 LYS 48 HG2 LYS 48 -11.367 -2.587 -5.962 389 HG3 LYS 48 HG3 LYS 48 -11.369 -4.141 -6.806 390 HD2 LYS 48 HD2 LYS 48 -13.951 -2.575 -6.703 391 HD3 LYS 48 HD3 LYS 48 -12.666 -1.992 -7.770 392 HE2 LYS 48 HE2 LYS 48 -13.675 -4.881 -7.788 393 HE3 LYS 48 HE3 LYS 48 -14.349 -3.614 -8.822 394 HZ1 LYS 48 HZ1 LYS 48 -12.310 -5.128 -9.523 395 HZ2 LYS 48 HZ2 LYS 48 -12.524 -3.616 -10.103 396 HZ3 LYS 48 HZ3 LYS 48 -11.473 -3.881 -8.881 397 H VAL 49 H VAL 49 -9.171 -4.191 -4.663 398 HA VAL 49 HA VAL 49 -9.046 -1.486 -3.516 399 HB VAL 49 HB VAL 49 -6.724 -1.943 -2.782 400 HG11 VAL 49 HG11 VAL 49 -7.301 -3.310 -0.804 401 HG12 VAL 49 HG12 VAL 49 -8.574 -2.100 -1.181 402 HG13 VAL 49 HG13 VAL 49 -8.820 -3.826 -1.612 403 HG21 VAL 49 HG21 VAL 49 -5.918 -4.269 -2.604 404 HG22 VAL 49 HG22 VAL 49 -7.370 -4.836 -3.495 405 HG23 VAL 49 HG23 VAL 49 -6.175 -3.773 -4.311 406 H SER 50 H SER 50 -7.962 0.016 -4.899 407 HA SER 50 HA SER 50 -6.756 -1.194 -7.303 408 HB2 SER 50 HB2 SER 50 -7.495 0.931 -8.467 409 HB3 SER 50 HB3 SER 50 -8.818 -0.133 -7.971 410 HG SER 50 HG SER 50 -9.102 2.199 -7.470 411 H TYR 51 H TYR 51 -4.687 -0.447 -7.915 412 HA TYR 51 HA TYR 51 -3.636 1.679 -6.149 413 HB2 TYR 51 HB2 TYR 51 -2.425 -0.803 -7.446 414 HB3 TYR 51 HB3 TYR 51 -1.413 0.538 -6.894 415 HD1 TYR 51 HD1 TYR 51 -1.938 1.297 -4.365 416 HD2 TYR 51 HD2 TYR 51 -2.705 -2.613 -5.973 417 HE1 TYR 51 HE1 TYR 51 -1.833 0.345 -2.089 418 HE2 TYR 51 HE2 TYR 51 -2.613 -3.567 -3.680 419 HH TYR 51 HH TYR 51 -2.304 -3.176 -1.535 420 H ALA 52 H ALA 52 -2.629 3.447 -7.211 421 HA ALA 52 HA ALA 52 -2.354 3.185 -10.132 422 HB1 ALA 52 HB1 ALA 52 -3.099 5.536 -10.310 423 HB2 ALA 52 HB2 ALA 52 -4.380 4.478 -9.628 424 HB3 ALA 52 HB3 ALA 52 -3.436 5.558 -8.546 425 H VAL 53 H VAL 53 -0.222 3.399 -10.643 426 HA VAL 53 HA VAL 53 1.309 5.329 -9.058 427 HB VAL 53 HB VAL 53 3.299 3.841 -9.360 428 HG11 VAL 53 HG11 VAL 53 2.667 2.168 -7.646 429 HG12 VAL 53 HG12 VAL 53 2.044 3.806 -7.253 430 HG13 VAL 53 HG13 VAL 53 0.935 2.559 -7.916 431 HG21 VAL 53 HG21 VAL 53 2.965 1.469 -9.982 432 HG22 VAL 53 HG22 VAL 53 1.247 1.819 -10.369 433 HG23 VAL 53 HG23 VAL 53 2.558 2.584 -11.329 434 HA PRO 54 HA PRO 54 2.359 6.882 -13.120 435 HB2 PRO 54 HB2 PRO 54 4.480 8.487 -12.412 436 HB3 PRO 54 HB3 PRO 54 2.844 8.913 -11.891 437 HG2 PRO 54 HG2 PRO 54 5.042 7.523 -10.340 438 HG3 PRO 54 HG3 PRO 54 3.942 8.802 -9.809 439 HD2 PRO 54 HD2 PRO 54 3.539 6.142 -9.198 440 HD3 PRO 54 HD3 PRO 54 2.209 7.299 -9.340 441 H LYS 55 H LYS 55 2.977 5.269 -14.371 442 HA LYS 55 HA LYS 55 5.630 4.122 -14.040 443 HB2 LYS 55 HB2 LYS 55 3.724 2.559 -14.207 444 HB3 LYS 55 HB3 LYS 55 3.327 3.207 -15.804 445 HG2 LYS 55 HG2 LYS 55 5.600 2.522 -16.617 446 HG3 LYS 55 HG3 LYS 55 5.933 1.816 -15.030 447 HD2 LYS 55 HD2 LYS 55 4.073 0.243 -15.272 448 HD3 LYS 55 HD3 LYS 55 3.547 1.024 -16.769 449 HE2 LYS 55 HE2 LYS 55 4.746 -0.863 -17.525 450 HE3 LYS 55 HE3 LYS 55 5.905 0.462 -17.704 451 HZ1 LYS 55 HZ1 LYS 55 6.902 -1.452 -16.672 452 HZ2 LYS 55 HZ2 LYS 55 6.894 -0.212 -15.610 453 HZ3 LYS 55 HZ3 LYS 55 5.825 -1.435 -15.445 454 HA PRO 56 HA PRO 56 7.527 6.677 -17.185 455 HB2 PRO 56 HB2 PRO 56 8.331 3.916 -18.305 456 HB3 PRO 56 HB3 PRO 56 9.379 5.315 -18.032 457 HG2 PRO 56 HG2 PRO 56 9.400 3.223 -16.325 458 HG3 PRO 56 HG3 PRO 56 9.607 4.876 -15.732 459 HD2 PRO 56 HD2 PRO 56 7.260 3.048 -15.433 460 HD3 PRO 56 HD3 PRO 56 7.733 4.430 -14.436 461 H ASN 57 H ASN 57 5.674 3.835 -18.004 462 HA ASN 57 HA ASN 57 5.042 4.779 -20.638 463 HB2 ASN 57 HB2 ASN 57 4.139 2.086 -19.632 464 HB3 ASN 57 HB3 ASN 57 4.209 2.690 -21.292 465 HD21 ASN 57 HD21 ASN 57 6.287 2.827 -22.369 466 HD22 ASN 57 HD22 ASN 57 7.721 2.132 -21.691 467 H GLY 58 H GLY 58 3.927 6.352 -18.436 468 HA2 GLY 58 HA2 GLY 58 1.861 7.452 -18.492 469 HA3 GLY 58 HA3 GLY 58 1.109 6.023 -19.213 470 H CYS 59 H CYS 59 0.101 7.406 -16.838 471 HA CYS 59 HA CYS 59 0.865 6.257 -14.427 472 HB2 CYS 59 HB2 CYS 59 -1.888 7.249 -15.288 473 HB3 CYS 59 HB3 CYS 59 -1.372 6.950 -13.623 474 H ARG 60 H ARG 60 0.763 4.184 -13.645 475 HA ARG 60 HA ARG 60 -0.945 2.315 -15.104 476 HB2 ARG 60 HB2 ARG 60 1.458 1.768 -14.774 477 HB3 ARG 60 HB3 ARG 60 1.258 1.893 -13.021 478 HG2 ARG 60 HG2 ARG 60 1.228 -0.448 -13.611 479 HG3 ARG 60 HG3 ARG 60 -0.407 0.006 -13.109 480 HD2 ARG 60 HD2 ARG 60 -0.025 0.435 -15.995 481 HD3 ARG 60 HD3 ARG 60 0.361 -1.231 -15.542 482 HE ARG 60 HE ARG 60 -1.980 -1.011 -14.297 483 HH11 ARG 60 HH11 ARG 60 -1.096 0.197 -17.483 484 HH12 ARG 60 HH12 ARG 60 -2.712 0.097 -18.099 485 HH21 ARG 60 HH21 ARG 60 -4.086 -1.115 -15.110 486 HH22 ARG 60 HH22 ARG 60 -4.416 -0.651 -16.746 487 H LYS 61 H LYS 61 -2.701 1.264 -14.227 488 HA LYS 61 HA LYS 61 -3.184 1.661 -11.359 489 HB2 LYS 61 HB2 LYS 61 -5.210 2.642 -11.599 490 HB3 LYS 61 HB3 LYS 61 -4.486 3.247 -13.094 491 HG2 LYS 61 HG2 LYS 61 -5.640 1.633 -14.436 492 HG3 LYS 61 HG3 LYS 61 -6.092 0.662 -13.028 493 HD2 LYS 61 HD2 LYS 61 -7.471 2.584 -12.176 494 HD3 LYS 61 HD3 LYS 61 -7.054 3.505 -13.626 495 HE2 LYS 61 HE2 LYS 61 -9.079 2.581 -14.284 496 HE3 LYS 61 HE3 LYS 61 -7.952 1.374 -14.916 497 HZ1 LYS 61 HZ1 LYS 61 -9.631 0.239 -13.772 498 HZ2 LYS 61 HZ2 LYS 61 -8.331 0.158 -12.787 499 HZ3 LYS 61 HZ3 LYS 61 -9.547 1.195 -12.451 500 H TRP 62 H TRP 62 -4.745 0.033 -10.469 501 HA TRP 62 HA TRP 62 -5.684 -2.113 -12.075 502 HB2 TRP 62 HB2 TRP 62 -3.327 -2.722 -12.148 503 HB3 TRP 62 HB3 TRP 62 -3.223 -2.648 -10.384 504 HD1 TRP 62 HD1 TRP 62 -3.307 -4.919 -9.308 505 HE1 TRP 62 HE1 TRP 62 -4.342 -7.215 -9.815 506 HE3 TRP 62 HE3 TRP 62 -5.804 -3.725 -13.641 507 HZ2 TRP 62 HZ2 TRP 62 -6.011 -8.388 -11.756 508 HZ3 TRP 62 HZ3 TRP 62 -7.117 -5.508 -14.771 509 HH2 TRP 62 HH2 TRP 62 -7.217 -7.802 -13.840 510 H GLU 63 H GLU 63 -6.846 -3.766 -10.702 511 HA GLU 63 HA GLU 63 -7.209 -2.927 -7.928 512 HB2 GLU 63 HB2 GLU 63 -9.754 -3.218 -8.346 513 HB3 GLU 63 HB3 GLU 63 -8.974 -1.671 -8.698 514 HG2 GLU 63 HG2 GLU 63 -9.069 -3.606 -10.969 515 HG3 GLU 63 HG3 GLU 63 -10.636 -3.007 -10.412 516 H THR 64 H THR 64 -7.566 -4.723 -6.578 517 HA THR 64 HA THR 64 -8.168 -7.245 -7.951 518 HB THR 64 HB THR 64 -6.139 -6.959 -5.683 519 HG1 THR 64 HG1 THR 64 -5.827 -6.917 -8.557 520 HG21 THR 64 HG21 THR 64 -5.486 -9.254 -6.383 521 HG22 THR 64 HG22 THR 64 -7.213 -9.174 -5.895 522 HG23 THR 64 HG23 THR 64 -6.773 -9.231 -7.635 523 H THR 65 H THR 65 -9.141 -8.912 -6.514 524 HA THR 65 HA THR 65 -10.790 -7.672 -4.467 525 HB THR 65 HB THR 65 -11.603 -10.236 -4.490 526 HG1 THR 65 HG1 THR 65 -10.840 -11.363 -6.167 527 HG21 THR 65 HG21 THR 65 -13.216 -9.631 -6.269 528 HG22 THR 65 HG22 THR 65 -12.971 -8.278 -5.113 529 HG23 THR 65 HG23 THR 65 -12.185 -8.234 -6.727 530 H PHE 66 H PHE 66 -10.765 -8.321 -2.243 531 HA PHE 66 HA PHE 66 -8.561 -10.133 -1.482 532 HB2 PHE 66 HB2 PHE 66 -9.355 -7.422 -0.336 533 HB3 PHE 66 HB3 PHE 66 -8.421 -8.603 0.592 534 HD1 PHE 66 HD1 PHE 66 -8.181 -7.676 -3.053 535 HD2 PHE 66 HD2 PHE 66 -6.295 -7.706 0.804 536 HE1 PHE 66 HE1 PHE 66 -6.090 -6.832 -4.073 537 HE2 PHE 66 HE2 PHE 66 -4.203 -6.856 -0.210 538 HZ PHE 66 HZ PHE 66 -4.094 -6.421 -2.653 539 H LYS 67 H LYS 67 -8.935 -11.290 0.571 540 HA LYS 67 HA LYS 67 -11.822 -11.577 1.124 541 HB2 LYS 67 HB2 LYS 67 -9.474 -13.494 1.141 542 HB3 LYS 67 HB3 LYS 67 -10.882 -13.817 2.162 543 HG2 LYS 67 HG2 LYS 67 -11.024 -14.942 -0.063 544 HG3 LYS 67 HG3 LYS 67 -12.371 -13.834 0.227 545 HD2 LYS 67 HD2 LYS 67 -11.046 -12.046 -1.062 546 HD3 LYS 67 HD3 LYS 67 -9.892 -13.313 -1.497 547 HE2 LYS 67 HE2 LYS 67 -11.489 -14.515 -2.780 548 HE3 LYS 67 HE3 LYS 67 -12.863 -13.729 -1.990 549 HZ1 LYS 67 HZ1 LYS 67 -12.812 -12.531 -3.861 550 HZ2 LYS 67 HZ2 LYS 67 -11.678 -11.644 -3.090 551 HZ3 LYS 67 HZ3 LYS 67 -11.228 -12.785 -4.168 552 H LYS 68 H LYS 68 -12.404 -12.074 3.600 553 HA LYS 68 HA LYS 68 -10.863 -10.118 5.089 554 HB2 LYS 68 HB2 LYS 68 -13.363 -10.696 5.135 555 HB3 LYS 68 HB3 LYS 68 -12.924 -12.287 5.773 556 HG2 LYS 68 HG2 LYS 68 -13.736 -10.996 7.599 557 HG3 LYS 68 HG3 LYS 68 -11.987 -11.146 7.819 558 HD2 LYS 68 HD2 LYS 68 -12.776 -8.845 8.273 559 HD3 LYS 68 HD3 LYS 68 -11.629 -8.890 6.928 560 HE2 LYS 68 HE2 LYS 68 -13.452 -8.763 5.290 561 HE3 LYS 68 HE3 LYS 68 -14.667 -8.912 6.567 562 HZ1 LYS 68 HZ1 LYS 68 -14.375 -6.636 5.953 563 HZ2 LYS 68 HZ2 LYS 68 -13.826 -6.823 7.480 564 HZ3 LYS 68 HZ3 LYS 68 -12.769 -6.679 6.244 565 H THR 69 H THR 69 -8.677 -11.113 4.917 566 HA THR 69 HA THR 69 -8.562 -13.610 6.566 567 HB THR 69 HB THR 69 -6.293 -12.229 5.232 568 HG1 THR 69 HG1 THR 69 -7.804 -13.969 3.543 569 HG21 THR 69 HG21 THR 69 -5.512 -14.479 4.667 570 HG22 THR 69 HG22 THR 69 -5.784 -14.225 6.424 571 HG23 THR 69 HG23 THR 69 -6.972 -15.164 5.457 572 H SER 70 H SER 70 -9.168 -12.080 8.341 573 HA SER 70 HA SER 70 -7.245 -10.040 9.068 574 HB2 SER 70 HB2 SER 70 -9.172 -10.204 11.023 575 HB3 SER 70 HB3 SER 70 -9.080 -9.030 9.704 576 HG SER 70 HG SER 70 -11.157 -10.107 9.789 577 H ASP 71 H ASP 71 -5.497 -11.613 9.387 578 HA ASP 71 HA ASP 71 -5.816 -13.656 11.369 579 HB2 ASP 71 HB2 ASP 71 -4.199 -13.768 9.471 580 HB3 ASP 71 HB3 ASP 71 -3.307 -12.408 10.165 581 H ASP 72 H ASP 72 -4.073 -10.447 11.241 582 HA ASP 72 HA ASP 72 -4.230 -10.312 14.188 583 HB2 ASP 72 HB2 ASP 72 -1.916 -10.657 13.165 584 HB3 ASP 72 HB3 ASP 72 -2.097 -9.083 12.379 585 H GLY 73 H GLY 73 -6.068 -9.470 14.162 586 HA2 GLY 73 HA2 GLY 73 -7.662 -8.066 14.618 587 HA3 GLY 73 HA3 GLY 73 -6.495 -6.744 14.492 588 H GLU 74 H GLU 74 -5.935 -6.628 11.542 589 HA GLU 74 HA GLU 74 -8.580 -6.955 10.402 590 HB2 GLU 74 HB2 GLU 74 -7.339 -4.245 10.013 591 HB3 GLU 74 HB3 GLU 74 -8.921 -4.834 9.486 592 HG2 GLU 74 HG2 GLU 74 -9.866 -4.629 11.575 593 HG3 GLU 74 HG3 GLU 74 -8.336 -4.885 12.425 594 H VAL 75 H VAL 75 -6.546 -8.620 9.689 595 HA VAL 75 HA VAL 75 -4.850 -7.326 7.687 596 HB VAL 75 HB VAL 75 -5.088 -10.157 8.783 597 HG11 VAL 75 HG11 VAL 75 -2.977 -10.704 7.682 598 HG12 VAL 75 HG12 VAL 75 -4.327 -10.360 6.549 599 HG13 VAL 75 HG13 VAL 75 -3.047 -9.130 6.820 600 HG21 VAL 75 HG21 VAL 75 -2.918 -9.762 9.891 601 HG22 VAL 75 HG22 VAL 75 -2.986 -8.048 9.358 602 HG23 VAL 75 HG23 VAL 75 -4.236 -8.691 10.476 603 H TYR 76 H TYR 76 -4.661 -8.488 5.534 604 HA TYR 76 HA TYR 76 -7.106 -9.820 4.681 605 HB2 TYR 76 HB2 TYR 76 -6.012 -7.130 3.718 606 HB3 TYR 76 HB3 TYR 76 -6.987 -8.148 2.650 607 HD1 TYR 76 HD1 TYR 76 -9.340 -8.827 3.456 608 HD2 TYR 76 HD2 TYR 76 -7.070 -5.674 5.286 609 HE1 TYR 76 HE1 TYR 76 -11.414 -7.917 4.444 610 HE2 TYR 76 HE2 TYR 76 -9.149 -4.751 6.275 611 HH TYR 76 HH TYR 76 -11.348 -4.968 6.507 612 H TYR 77 H TYR 77 -6.927 -11.160 2.904 613 HA TYR 77 HA TYR 77 -4.211 -11.310 1.768 614 HB2 TYR 77 HB2 TYR 77 -5.994 -13.506 2.913 615 HB3 TYR 77 HB3 TYR 77 -4.788 -13.877 1.673 616 HD1 TYR 77 HD1 TYR 77 -4.353 -11.425 4.491 617 HD2 TYR 77 HD2 TYR 77 -3.350 -15.283 2.895 618 HE1 TYR 77 HE1 TYR 77 -2.627 -11.703 6.244 619 HE2 TYR 77 HE2 TYR 77 -1.632 -15.566 4.650 620 HH TYR 77 HH TYR 77 -1.059 -13.007 7.108 621 H SER 78 H SER 78 -4.124 -11.980 -0.468 622 HA SER 78 HA SER 78 -6.768 -12.055 -1.809 623 HB2 SER 78 HB2 SER 78 -4.199 -11.453 -3.262 624 HB3 SER 78 HB3 SER 78 -5.840 -10.873 -3.577 625 HG SER 78 HG SER 78 -5.325 -9.122 -2.489 626 H GLU 79 H GLU 79 -7.228 -14.282 -2.089 627 HA GLU 79 HA GLU 79 -5.186 -16.235 -2.281 628 HB2 GLU 79 HB2 GLU 79 -8.114 -15.975 -2.222 629 HB3 GLU 79 HB3 GLU 79 -7.664 -17.071 -3.535 630 HG2 GLU 79 HG2 GLU 79 -6.799 -17.363 -0.625 631 HG3 GLU 79 HG3 GLU 79 -8.136 -18.235 -1.387 632 H GLU 80 H GLU 80 -7.234 -14.500 -4.717 633 HA GLU 80 HA GLU 80 -6.580 -16.038 -6.918 634 HB2 GLU 80 HB2 GLU 80 -7.060 -13.009 -6.772 635 HB3 GLU 80 HB3 GLU 80 -7.251 -14.026 -8.206 636 HG2 GLU 80 HG2 GLU 80 -9.448 -13.868 -7.570 637 HG3 GLU 80 HG3 GLU 80 -9.000 -15.328 -6.679 638 H ALA 81 H ALA 81 -4.740 -13.316 -5.371 639 HA ALA 81 HA ALA 81 -2.670 -13.735 -7.418 640 HB1 ALA 81 HB1 ALA 81 -1.798 -11.514 -6.710 641 HB2 ALA 81 HB2 ALA 81 -3.486 -11.435 -7.317 642 HB3 ALA 81 HB3 ALA 81 -3.162 -11.368 -5.552 643 H LYS 82 H LYS 82 -3.305 -15.181 -4.573 644 HA LYS 82 HA LYS 82 -2.107 -16.009 -2.862 645 HB2 LYS 82 HB2 LYS 82 0.255 -15.948 -4.788 646 HB3 LYS 82 HB3 LYS 82 -0.049 -17.089 -3.472 647 HG2 LYS 82 HG2 LYS 82 -2.173 -17.001 -5.563 648 HG3 LYS 82 HG3 LYS 82 -0.592 -17.554 -6.131 649 HD2 LYS 82 HD2 LYS 82 -1.458 -19.573 -5.402 650 HD3 LYS 82 HD3 LYS 82 -0.663 -19.047 -3.913 651 HE2 LYS 82 HE2 LYS 82 -2.835 -19.741 -3.236 652 HE3 LYS 82 HE3 LYS 82 -2.898 -17.974 -3.232 653 HZ1 LYS 82 HZ1 LYS 82 -4.774 -19.214 -4.339 654 HZ2 LYS 82 HZ2 LYS 82 -4.129 -17.976 -5.185 655 HZ3 LYS 82 HZ3 LYS 82 -3.756 -19.515 -5.580 656 H LYS 83 H LYS 83 -2.323 -13.205 -2.552 657 HA LYS 83 HA LYS 83 0.372 -12.531 -1.567 658 HB2 LYS 83 HB2 LYS 83 -0.237 -10.130 -2.119 659 HB3 LYS 83 HB3 LYS 83 0.015 -11.167 -3.529 660 HG2 LYS 83 HG2 LYS 83 -2.414 -11.396 -3.854 661 HG3 LYS 83 HG3 LYS 83 -2.732 -10.491 -2.369 662 HD2 LYS 83 HD2 LYS 83 -3.010 -8.857 -4.035 663 HD3 LYS 83 HD3 LYS 83 -1.358 -8.560 -3.476 664 HE2 LYS 83 HE2 LYS 83 -0.397 -9.673 -5.390 665 HE3 LYS 83 HE3 LYS 83 -1.948 -10.384 -5.854 666 HZ1 LYS 83 HZ1 LYS 83 -1.369 -8.455 -7.189 667 HZ2 LYS 83 HZ2 LYS 83 -2.753 -8.184 -6.366 668 HZ3 LYS 83 HZ3 LYS 83 -1.360 -7.489 -5.872 669 H LYS 84 H LYS 84 0.505 -11.592 0.486 670 HA LYS 84 HA LYS 84 -2.093 -11.198 1.836 671 HB2 LYS 84 HB2 LYS 84 -0.985 -12.068 3.889 672 HB3 LYS 84 HB3 LYS 84 -1.032 -13.287 2.609 673 HG2 LYS 84 HG2 LYS 84 1.441 -12.132 2.145 674 HG3 LYS 84 HG3 LYS 84 1.308 -11.958 3.900 675 HD2 LYS 84 HD2 LYS 84 0.853 -14.594 2.403 676 HD3 LYS 84 HD3 LYS 84 2.398 -14.120 3.121 677 HE2 LYS 84 HE2 LYS 84 1.282 -13.943 5.365 678 HE3 LYS 84 HE3 LYS 84 -0.243 -14.460 4.635 679 HZ1 LYS 84 HZ1 LYS 84 0.920 -16.293 5.643 680 HZ2 LYS 84 HZ2 LYS 84 0.827 -16.536 4.031 681 HZ3 LYS 84 HZ3 LYS 84 2.236 -16.060 4.705 682 H VAL 85 H VAL 85 -2.241 -9.380 3.280 683 HA VAL 85 HA VAL 85 0.236 -7.865 3.745 684 HB VAL 85 HB VAL 85 -0.822 -5.799 3.009 685 HG11 VAL 85 HG11 VAL 85 -0.938 -6.138 0.552 686 HG12 VAL 85 HG12 VAL 85 0.455 -6.990 1.300 687 HG13 VAL 85 HG13 VAL 85 -1.008 -7.913 0.818 688 HG21 VAL 85 HG21 VAL 85 -2.981 -5.773 1.762 689 HG22 VAL 85 HG22 VAL 85 -3.182 -7.524 2.109 690 HG23 VAL 85 HG23 VAL 85 -3.174 -6.336 3.456 691 H GLU 86 H GLU 86 0.089 -7.029 5.926 692 HA GLU 86 HA GLU 86 -2.623 -6.990 7.013 693 HB2 GLU 86 HB2 GLU 86 -1.823 -7.933 9.100 694 HB3 GLU 86 HB3 GLU 86 -1.467 -9.042 7.769 695 HG2 GLU 86 HG2 GLU 86 0.657 -7.116 8.773 696 HG3 GLU 86 HG3 GLU 86 0.320 -8.617 9.646 697 H VAL 87 H VAL 87 -3.111 -5.284 8.398 698 HA VAL 87 HA VAL 87 -1.468 -2.995 8.170 699 HB VAL 87 HB VAL 87 -3.856 -2.717 8.381 700 HG11 VAL 87 HG11 VAL 87 -5.141 -3.566 10.327 701 HG12 VAL 87 HG12 VAL 87 -4.354 -4.895 9.411 702 HG13 VAL 87 HG13 VAL 87 -3.649 -4.336 10.965 703 HG21 VAL 87 HG21 VAL 87 -4.132 -1.337 10.407 704 HG22 VAL 87 HG22 VAL 87 -2.601 -2.007 11.066 705 HG23 VAL 87 HG23 VAL 87 -2.575 -1.010 9.573 706 H LEU 88 H LEU 88 0.221 -2.388 9.438 707 HA LEU 88 HA LEU 88 0.873 -3.996 11.769 708 HB2 LEU 88 HB2 LEU 88 2.320 -1.756 10.309 709 HB3 LEU 88 HB3 LEU 88 2.935 -2.568 11.754 710 HG LEU 88 HG LEU 88 2.525 -3.726 8.976 711 HD11 LEU 88 HD11 LEU 88 4.931 -4.273 9.202 712 HD12 LEU 88 HD12 LEU 88 4.623 -2.512 9.376 713 HD13 LEU 88 HD13 LEU 88 4.944 -3.516 10.830 714 HD21 LEU 88 HD21 LEU 88 3.232 -5.914 9.889 715 HD22 LEU 88 HD22 LEU 88 3.169 -5.234 11.550 716 HD23 LEU 88 HD23 LEU 88 1.665 -5.371 10.578 717 H ASP 89 H ASP 89 0.352 -0.471 10.914 718 HA ASP 89 HA ASP 89 -0.942 -0.111 13.468 719 HB2 ASP 89 HB2 ASP 89 1.694 0.275 13.639 720 HB3 ASP 89 HB3 ASP 89 1.282 1.834 12.914 721 H THR 90 H THR 90 -2.362 1.691 13.426 722 HA THR 90 HA THR 90 -2.272 3.478 11.140 723 HB THR 90 HB THR 90 -3.526 1.445 10.352 724 HG1 THR 90 HG1 THR 90 -4.727 2.813 9.199 725 HG21 THR 90 HG21 THR 90 -5.804 1.039 11.240 726 HG22 THR 90 HG22 THR 90 -4.538 0.753 12.481 727 HG23 THR 90 HG23 THR 90 -5.514 2.260 12.525 728 H ASP 91 H ASP 91 -3.569 5.440 11.524 729 HA ASP 91 HA ASP 91 -4.358 5.669 14.363 730 HB2 ASP 91 HB2 ASP 91 -2.516 7.166 13.442 731 HB3 ASP 91 HB3 ASP 91 -3.727 7.892 12.376 732 H TYR 92 H TYR 92 -6.537 6.240 14.820 733 HA TYR 92 HA TYR 92 -8.433 5.824 12.779 734 HB2 TYR 92 HB2 TYR 92 -8.636 7.054 15.559 735 HB3 TYR 92 HB3 TYR 92 -10.031 6.707 14.530 736 HD1 TYR 92 HD1 TYR 92 -10.494 4.306 13.842 737 HD2 TYR 92 HD2 TYR 92 -7.557 5.290 16.820 738 HE1 TYR 92 HE1 TYR 92 -10.509 1.959 14.628 739 HE2 TYR 92 HE2 TYR 92 -7.548 2.931 17.587 740 HH TYR 92 HH TYR 92 -9.666 0.471 16.024 741 H LYS 93 H LYS 93 -6.788 8.780 13.902 742 HA LYS 93 HA LYS 93 -8.250 10.198 11.802 743 HB2 LYS 93 HB2 LYS 93 -7.644 11.317 14.548 744 HB3 LYS 93 HB3 LYS 93 -8.183 12.269 13.158 745 HG2 LYS 93 HG2 LYS 93 -10.200 10.714 12.995 746 HG3 LYS 93 HG3 LYS 93 -9.687 9.995 14.527 747 HD2 LYS 93 HD2 LYS 93 -9.785 12.248 15.602 748 HD3 LYS 93 HD3 LYS 93 -10.332 12.944 14.071 749 HE2 LYS 93 HE2 LYS 93 -11.789 10.726 15.597 750 HE3 LYS 93 HE3 LYS 93 -12.196 12.445 15.688 751 HZ1 LYS 93 HZ1 LYS 93 -13.589 11.389 14.111 752 HZ2 LYS 93 HZ2 LYS 93 -12.576 12.357 13.272 753 HZ3 LYS 93 HZ3 LYS 93 -12.335 10.742 13.288 754 H SER 94 H SER 94 -5.591 8.813 11.508 755 HA SER 94 HA SER 94 -4.259 11.220 10.472 756 HB2 SER 94 HB2 SER 94 -3.538 10.901 12.935 757 HB3 SER 94 HB3 SER 94 -3.046 9.247 12.545 758 HG SER 94 HG SER 94 -1.249 10.722 12.575 759 H TYR 95 H TYR 95 -1.666 9.523 10.408 760 HA TYR 95 HA TYR 95 -2.405 8.183 7.939 761 HB2 TYR 95 HB2 TYR 95 0.044 8.109 7.570 762 HB3 TYR 95 HB3 TYR 95 -0.492 9.753 7.939 763 HD1 TYR 95 HD1 TYR 95 1.251 6.770 9.280 764 HD2 TYR 95 HD2 TYR 95 0.214 10.882 9.952 765 HE1 TYR 95 HE1 TYR 95 2.852 6.862 11.168 766 HE2 TYR 95 HE2 TYR 95 1.826 10.984 11.827 767 HH TYR 95 HH TYR 95 3.309 9.902 13.045 768 H ALA 96 H ALA 96 -1.204 6.045 7.442 769 HA ALA 96 HA ALA 96 -0.582 4.487 9.788 770 HB1 ALA 96 HB1 ALA 96 -2.099 2.627 9.164 771 HB2 ALA 96 HB2 ALA 96 -2.964 4.120 9.663 772 HB3 ALA 96 HB3 ALA 96 -2.845 3.690 7.923 773 H VAL 97 H VAL 97 0.442 2.311 9.328 774 HA VAL 97 HA VAL 97 1.463 2.244 6.574 775 HB VAL 97 HB VAL 97 3.633 1.376 7.511 776 HG11 VAL 97 HG11 VAL 97 4.490 3.594 8.175 777 HG12 VAL 97 HG12 VAL 97 3.398 3.696 6.753 778 HG13 VAL 97 HG13 VAL 97 2.805 4.180 8.377 779 HG21 VAL 97 HG21 VAL 97 4.159 1.846 9.879 780 HG22 VAL 97 HG22 VAL 97 2.461 2.366 10.149 781 HG23 VAL 97 HG23 VAL 97 2.820 0.661 9.713 782 H ILE 98 H ILE 98 0.771 0.304 5.645 783 HA ILE 98 HA ILE 98 0.487 -2.020 7.449 784 HB ILE 98 HB ILE 98 -0.831 -1.585 4.745 785 HG12 ILE 98 HG12 ILE 98 -1.726 0.245 5.886 786 HG13 ILE 98 HG13 ILE 98 -2.954 -1.017 6.057 787 HG21 ILE 98 HG21 ILE 98 -2.493 -3.241 5.559 788 HG22 ILE 98 HG22 ILE 98 -0.821 -3.894 5.510 789 HG23 ILE 98 HG23 ILE 98 -1.550 -3.411 7.078 790 HD11 ILE 98 HD11 ILE 98 -2.652 0.213 8.155 791 HD12 ILE 98 HD12 ILE 98 -2.156 -1.503 8.349 792 HD13 ILE 98 HD13 ILE 98 -0.909 -0.221 8.176 793 H TYR 99 H TYR 99 1.538 -3.928 6.874 794 HA TYR 99 HA TYR 99 3.508 -3.725 4.751 795 HB2 TYR 99 HB2 TYR 99 4.131 -4.345 7.191 796 HB3 TYR 99 HB3 TYR 99 3.226 -5.849 6.978 797 HD1 TYR 99 HD2 TYR 99 4.100 -7.655 5.507 798 HD2 TYR 99 HD1 TYR 99 6.245 -4.014 6.080 799 HE1 TYR 99 HE2 TYR 99 6.161 -8.708 4.589 800 HE2 TYR 99 HE1 TYR 99 8.298 -5.033 5.208 801 HH TYR 99 HH TYR 99 8.415 -8.501 4.404 802 H ALA 100 H ALA 100 3.893 -5.409 3.241 803 HA ALA 100 HA ALA 100 1.708 -7.385 2.915 804 HB1 ALA 100 HB1 ALA 100 1.682 -6.850 0.494 805 HB2 ALA 100 HB2 ALA 100 1.191 -5.440 1.492 806 HB3 ALA 100 HB3 ALA 100 2.839 -5.507 0.782 807 H THR 101 H THR 101 2.218 -9.317 1.923 808 HA THR 101 HA THR 101 4.992 -9.704 1.097 809 HB THR 101 HB THR 101 3.693 -11.401 3.286 810 HG1 THR 101 HG1 THR 101 6.079 -9.718 3.112 811 HG21 THR 101 HG21 THR 101 5.802 -12.694 3.191 812 HG22 THR 101 HG22 THR 101 4.923 -12.779 1.627 813 HG23 THR 101 HG23 THR 101 6.352 -11.704 1.797 814 H ARG 102 H ARG 102 5.177 -11.515 -0.491 815 HA ARG 102 HA ARG 102 2.651 -12.899 -1.050 816 HB2 ARG 102 HB2 ARG 102 3.619 -12.445 -3.598 817 HB3 ARG 102 HB3 ARG 102 2.239 -11.639 -2.839 818 HG2 ARG 102 HG2 ARG 102 5.104 -10.578 -2.759 819 HG3 ARG 102 HG3 ARG 102 3.890 -10.088 -3.947 820 HD2 ARG 102 HD2 ARG 102 3.179 -9.928 -1.011 821 HD3 ARG 102 HD3 ARG 102 4.284 -8.717 -1.674 822 HE ARG 102 HE ARG 102 2.430 -8.221 -3.363 823 HH11 ARG 102 HH11 ARG 102 1.748 -9.592 -0.192 824 HH12 ARG 102 HH12 ARG 102 0.123 -8.995 -0.143 825 HH21 ARG 102 HH21 ARG 102 0.235 -7.514 -3.299 826 HH22 ARG 102 HH22 ARG 102 -0.731 -7.823 -1.895 827 H VAL 103 H VAL 103 2.888 -15.055 -1.863 828 HA VAL 103 HA VAL 103 5.696 -15.923 -1.852 829 HB VAL 103 HB VAL 103 4.327 -16.871 -0.037 830 HG11 VAL 103 HG11 VAL 103 2.477 -18.425 -0.537 831 HG12 VAL 103 HG12 VAL 103 2.130 -16.754 -1.097 832 HG13 VAL 103 HG13 VAL 103 2.614 -18.016 -2.280 833 HG21 VAL 103 HG21 VAL 103 4.789 -19.258 -0.448 834 HG22 VAL 103 HG22 VAL 103 5.055 -18.900 -2.188 835 HG23 VAL 103 HG23 VAL 103 6.155 -18.205 -0.950 836 H LYS 104 H LYS 104 6.578 -16.380 -3.636 837 HA LYS 104 HA LYS 104 5.052 -17.344 -5.914 838 HB2 LYS 104 HB2 LYS 104 6.015 -15.006 -6.111 839 HB3 LYS 104 HB3 LYS 104 7.587 -15.798 -6.276 840 HG2 LYS 104 HG2 LYS 104 6.417 -17.283 -8.085 841 HG3 LYS 104 HG3 LYS 104 5.143 -16.056 -8.064 842 HD2 LYS 104 HD2 LYS 104 6.809 -14.289 -8.551 843 HD3 LYS 104 HD3 LYS 104 8.110 -15.486 -8.516 844 HE2 LYS 104 HE2 LYS 104 5.737 -15.592 -10.440 845 HE3 LYS 104 HE3 LYS 104 7.298 -14.859 -10.832 846 HZ1 LYS 104 HZ1 LYS 104 7.372 -17.025 -11.627 847 HZ2 LYS 104 HZ2 LYS 104 8.258 -17.093 -10.257 848 HZ3 LYS 104 HZ3 LYS 104 6.737 -17.686 -10.276 849 H ASP 105 H ASP 105 6.325 -18.739 -7.488 850 HA ASP 105 HA ASP 105 7.034 -21.044 -6.514 851 HB2 ASP 105 HB2 ASP 105 8.800 -19.679 -8.630 852 HB3 ASP 105 HB3 ASP 105 8.385 -21.396 -8.536 853 H GLY 106 H GLY 106 8.470 -21.264 -4.433 854 HA2 GLY 106 HA2 GLY 106 10.659 -21.486 -3.726 855 HA3 GLY 106 HA3 GLY 106 11.207 -20.920 -5.310 856 H ARG 107 H ARG 107 8.903 -18.570 -4.115 857 HA ARG 107 HA ARG 107 10.928 -17.185 -2.629 858 HB2 ARG 107 HB2 ARG 107 10.924 -16.953 -5.423 859 HB3 ARG 107 HB3 ARG 107 9.833 -15.632 -4.984 860 HG2 ARG 107 HG2 ARG 107 11.499 -14.406 -3.935 861 HG3 ARG 107 HG3 ARG 107 12.407 -15.840 -3.439 862 HD2 ARG 107 HD2 ARG 107 12.138 -14.812 -6.304 863 HD3 ARG 107 HD3 ARG 107 13.547 -14.579 -5.260 864 HE ARG 107 HE ARG 107 13.161 -17.332 -5.268 865 HH11 ARG 107 HH11 ARG 107 13.588 -14.898 -7.770 866 HH12 ARG 107 HH12 ARG 107 14.377 -15.986 -8.863 867 HH21 ARG 107 HH21 ARG 107 14.223 -18.740 -6.703 868 HH22 ARG 107 HH22 ARG 107 14.739 -18.171 -8.255 869 H THR 108 H THR 108 10.411 -15.350 -1.495 870 HA THR 108 HA THR 108 7.605 -14.671 -1.532 871 HB THR 108 HB THR 108 9.058 -14.609 1.115 872 HG1 THR 108 HG1 THR 108 8.012 -16.734 1.358 873 HG21 THR 108 HG21 THR 108 6.655 -14.703 1.856 874 HG22 THR 108 HG22 THR 108 6.900 -13.309 0.751 875 HG23 THR 108 HG23 THR 108 6.121 -14.810 0.145 876 H LEU 109 H LEU 109 6.754 -12.697 -1.942 877 HA LEU 109 HA LEU 109 8.770 -10.685 -2.213 878 HB2 LEU 109 HB2 LEU 109 6.910 -11.028 -3.995 879 HB3 LEU 109 HB3 LEU 109 6.057 -9.840 -3.001 880 HG LEU 109 HG LEU 109 7.395 -8.130 -3.644 881 HD11 LEU 109 HD11 LEU 109 9.841 -8.131 -3.938 882 HD12 LEU 109 HD12 LEU 109 9.339 -8.766 -2.335 883 HD13 LEU 109 HD13 LEU 109 9.875 -9.898 -3.622 884 HD21 LEU 109 HD21 LEU 109 8.432 -8.494 -5.898 885 HD22 LEU 109 HD22 LEU 109 8.310 -10.268 -5.640 886 HD23 LEU 109 HD23 LEU 109 6.819 -9.274 -5.767 887 H HIS 110 H HIS 110 8.025 -8.273 -1.394 888 HA HIS 110 HA HIS 110 6.522 -8.420 1.120 889 HB2 HIS 110 HB2 HIS 110 9.478 -7.698 1.080 890 HB3 HIS 110 HB3 HIS 110 8.368 -7.195 2.362 891 HD2 HIS 110 HD2 HIS 110 10.708 -9.945 1.732 892 HE1 HIS 110 HE1 HIS 110 7.751 -11.721 4.243 893 H MET 111 H MET 111 5.790 -6.243 1.808 894 HA MET 111 HA MET 111 7.072 -3.987 0.526 895 HB2 MET 111 HB2 MET 111 4.685 -5.045 -0.765 896 HB3 MET 111 HB3 MET 111 4.470 -3.374 -0.224 897 HG2 MET 111 HG2 MET 111 6.564 -2.703 -1.408 898 HG3 MET 111 HG3 MET 111 6.830 -4.376 -1.915 899 HE1 MET 111 HE1 MET 111 5.784 -2.778 -5.338 900 HE2 MET 111 HE2 MET 111 6.841 -2.087 -4.060 901 HE3 MET 111 HE3 MET 111 6.959 -3.830 -4.478 902 H MET 112 H MET 112 7.324 -2.605 2.506 903 HA MET 112 HA MET 112 4.689 -2.600 4.005 904 HB2 MET 112 HB2 MET 112 6.538 -3.366 5.326 905 HB3 MET 112 HB3 MET 112 7.584 -2.086 4.769 906 HG2 MET 112 HG2 MET 112 6.956 -1.533 6.995 907 HG3 MET 112 HG3 MET 112 6.046 -0.443 5.941 908 HE1 MET 112 HE1 MET 112 3.343 -0.707 8.549 909 HE2 MET 112 HE2 MET 112 4.980 -1.088 9.184 910 HE3 MET 112 HE3 MET 112 4.777 0.175 7.924 911 H ARG 113 H ARG 113 3.587 -0.666 3.608 912 HA ARG 113 HA ARG 113 5.249 1.597 2.766 913 HB2 ARG 113 HB2 ARG 113 2.567 0.751 1.587 914 HB3 ARG 113 HB3 ARG 113 3.386 2.283 1.252 915 HG2 ARG 113 HG2 ARG 113 4.193 1.106 -0.547 916 HG3 ARG 113 HG3 ARG 113 5.426 0.614 0.622 917 HD2 ARG 113 HD2 ARG 113 4.649 -1.389 -0.484 918 HD3 ARG 113 HD3 ARG 113 4.025 -1.428 1.170 919 HE ARG 113 HE ARG 113 2.215 -0.302 -0.882 920 HH11 ARG 113 HH11 ARG 113 3.146 -3.105 1.033 921 HH12 ARG 113 HH12 ARG 113 1.620 -3.900 0.831 922 HH21 ARG 113 HH21 ARG 113 0.169 -1.304 -1.021 923 HH22 ARG 113 HH22 ARG 113 -0.075 -2.877 -0.337 924 H LEU 114 H LEU 114 4.032 3.734 3.032 925 HA LEU 114 HA LEU 114 2.347 3.621 5.463 926 HB2 LEU 114 HB2 LEU 114 4.353 4.519 6.211 927 HB3 LEU 114 HB3 LEU 114 4.713 5.306 4.668 928 HG LEU 114 HG LEU 114 2.899 6.967 5.117 929 HD11 LEU 114 HD11 LEU 114 1.976 7.153 7.397 930 HD12 LEU 114 HD12 LEU 114 1.487 5.623 6.594 931 HD13 LEU 114 HD13 LEU 114 2.778 5.609 7.844 932 HD21 LEU 114 HD21 LEU 114 4.139 8.201 6.868 933 HD22 LEU 114 HD22 LEU 114 5.039 6.701 7.278 934 HD23 LEU 114 HD23 LEU 114 5.242 7.457 5.661 935 H TYR 115 H TYR 115 0.376 4.671 5.238 936 HA TYR 115 HA TYR 115 0.128 6.211 2.773 937 HB2 TYR 115 HB2 TYR 115 -2.265 5.622 2.722 938 HB3 TYR 115 HB3 TYR 115 -1.187 4.230 2.559 939 HD1 TYR 115 HD1 TYR 115 -3.245 6.062 5.129 940 HD2 TYR 115 HD2 TYR 115 -1.535 2.321 3.890 941 HE1 TYR 115 HE1 TYR 115 -4.495 4.900 6.917 942 HE2 TYR 115 HE2 TYR 115 -2.779 1.157 5.688 943 HH TYR 115 HH TYR 115 -4.397 1.326 7.226 944 H SER 116 H SER 116 -0.801 8.144 2.639 945 HA SER 116 HA SER 116 -1.527 9.452 5.198 946 HB2 SER 116 HB2 SER 116 -0.400 10.762 2.685 947 HB3 SER 116 HB3 SER 116 -0.596 11.469 4.294 948 HG SER 116 HG SER 116 1.636 10.779 3.656 949 H ARG 117 H ARG 117 -3.476 10.943 4.829 950 HA ARG 117 HA ARG 117 -5.209 9.920 2.797 951 HB2 ARG 117 HB2 ARG 117 -5.371 11.656 5.166 952 HB3 ARG 117 HB3 ARG 117 -6.368 12.230 3.823 953 HG2 ARG 117 HG2 ARG 117 -7.579 10.127 3.711 954 HG3 ARG 117 HG3 ARG 117 -6.454 9.347 4.830 955 HD2 ARG 117 HD2 ARG 117 -8.696 10.119 5.824 956 HD3 ARG 117 HD3 ARG 117 -7.241 10.607 6.702 957 HE ARG 117 HE ARG 117 -7.558 12.851 5.972 958 HH11 ARG 117 HH11 ARG 117 -10.081 10.716 4.768 959 HH12 ARG 117 HH12 ARG 117 -11.141 12.018 4.342 960 HH21 ARG 117 HH21 ARG 117 -8.958 14.538 5.408 961 HH22 ARG 117 HH22 ARG 117 -10.503 14.189 4.706 962 H SER 118 H SER 118 -3.355 12.990 3.322 963 HA SER 118 HA SER 118 -4.284 14.003 0.748 964 HB2 SER 118 HB2 SER 118 -2.238 15.181 2.687 965 HB3 SER 118 HB3 SER 118 -3.113 16.018 1.398 966 HG SER 118 HG SER 118 -4.056 16.400 3.502 967 HA PRO 119 HA PRO 119 -0.690 12.471 -1.378 968 HB2 PRO 119 HB2 PRO 119 -0.491 14.319 -3.424 969 HB3 PRO 119 HB3 PRO 119 -1.862 13.203 -3.370 970 HG2 PRO 119 HG2 PRO 119 -1.712 16.091 -2.461 971 HG3 PRO 119 HG3 PRO 119 -2.985 15.280 -3.381 972 HD2 PRO 119 HD2 PRO 119 -3.186 15.722 -0.674 973 HD3 PRO 119 HD3 PRO 119 -3.961 14.342 -1.462 974 H GLU 120 H GLU 120 0.397 13.202 0.790 975 HA GLU 120 HA GLU 120 2.770 14.553 -0.071 976 HB2 GLU 120 HB2 GLU 120 2.608 16.195 1.899 977 HB3 GLU 120 HB3 GLU 120 1.542 16.543 0.532 978 HG2 GLU 120 HG2 GLU 120 -0.192 15.081 2.024 979 HG3 GLU 120 HG3 GLU 120 0.857 15.649 3.330 980 H VAL 121 H VAL 121 4.176 14.961 1.839 981 HA VAL 121 HA VAL 121 4.616 12.533 3.162 982 HB VAL 121 HB VAL 121 6.839 14.594 3.584 983 HG11 VAL 121 HG11 VAL 121 8.115 12.430 3.383 984 HG12 VAL 121 HG12 VAL 121 6.795 12.250 4.587 985 HG13 VAL 121 HG13 VAL 121 6.602 11.572 2.935 986 HG21 VAL 121 HG21 VAL 121 7.750 13.987 1.329 987 HG22 VAL 121 HG22 VAL 121 6.278 13.020 0.976 988 HG23 VAL 121 HG23 VAL 121 6.162 14.805 1.145 989 H SER 122 H SER 122 5.002 12.137 5.327 990 HA SER 122 HA SER 122 4.181 14.571 6.939 991 HB2 SER 122 HB2 SER 122 3.536 12.446 8.568 992 HB3 SER 122 HB3 SER 122 2.407 13.312 7.518 993 HG SER 122 HG SER 122 2.181 11.188 6.959 994 HA PRO 123 HA PRO 123 8.264 14.257 8.778 995 HB2 PRO 123 HB2 PRO 123 7.532 15.680 11.245 996 HB3 PRO 123 HB3 PRO 123 8.441 16.371 9.894 997 HG2 PRO 123 HG2 PRO 123 5.518 16.552 10.516 998 HG3 PRO 123 HG3 PRO 123 6.566 17.713 9.690 999 HD2 PRO 123 HD2 PRO 123 4.742 16.251 8.260 1000 HD3 PRO 123 HD3 PRO 123 6.321 16.617 7.553 1001 H ALA 124 H ALA 124 5.576 14.154 11.290 1002 HA ALA 124 HA ALA 124 6.881 12.341 12.955 1003 HB1 ALA 124 HB1 ALA 124 4.572 11.890 13.812 1004 HB2 ALA 124 HB2 ALA 124 4.852 13.646 13.563 1005 HB3 ALA 124 HB3 ALA 124 3.887 12.712 12.370 1006 H ALA 125 H ALA 125 4.480 11.660 10.295 1007 HA ALA 125 HA ALA 125 4.379 8.912 10.609 1008 HB1 ALA 125 HB1 ALA 125 3.715 8.878 8.228 1009 HB2 ALA 125 HB2 ALA 125 2.892 10.194 9.132 1010 HB3 ALA 125 HB3 ALA 125 4.274 10.575 8.051 1011 H THR 126 H THR 126 6.688 10.931 8.630 1012 HA THR 126 HA THR 126 8.067 8.817 7.494 1013 HB THR 126 HB THR 126 9.175 11.536 8.371 1014 HG1 THR 126 HG1 THR 126 7.640 12.208 6.994 1015 HG21 THR 126 HG21 THR 126 10.718 11.231 6.453 1016 HG22 THR 126 HG22 THR 126 10.907 9.925 7.671 1017 HG23 THR 126 HG23 THR 126 10.010 9.609 6.147 1018 H ALA 127 H ALA 127 8.806 10.663 10.593 1019 HA ALA 127 HA ALA 127 11.086 9.116 11.186 1020 HB1 ALA 127 HB1 ALA 127 10.863 10.151 13.437 1021 HB2 ALA 127 HB2 ALA 127 10.700 11.359 12.118 1022 HB3 ALA 127 HB3 ALA 127 9.239 10.768 12.980 1023 H ILE 128 H ILE 128 7.633 8.882 12.371 1024 HA ILE 128 HA ILE 128 8.066 6.861 14.202 1025 HB ILE 128 HB ILE 128 5.652 7.426 12.421 1026 HG12 ILE 128 HG12 ILE 128 6.256 9.316 13.840 1027 HG13 ILE 128 HG13 ILE 128 4.749 8.577 14.399 1028 HG21 ILE 128 HG21 ILE 128 4.334 6.163 14.086 1029 HG22 ILE 128 HG22 ILE 128 5.547 5.132 13.255 1030 HG23 ILE 128 HG23 ILE 128 5.853 5.705 14.929 1031 HD11 ILE 128 HD11 ILE 128 6.189 9.187 16.289 1032 HD12 ILE 128 HD12 ILE 128 5.976 7.405 16.204 1033 HD13 ILE 128 HD13 ILE 128 7.506 8.155 15.637 1034 H PHE 129 H PHE 129 7.247 6.632 10.641 1035 HA PHE 129 HA PHE 129 7.130 3.838 10.553 1036 HB2 PHE 129 HB2 PHE 129 6.299 5.361 8.783 1037 HB3 PHE 129 HB3 PHE 129 7.954 5.873 8.428 1038 HD1 PHE 129 HD1 PHE 129 5.629 2.959 8.354 1039 HD2 PHE 129 HD2 PHE 129 9.371 4.586 7.018 1040 HE1 PHE 129 HE1 PHE 129 5.853 1.104 6.732 1041 HE2 PHE 129 HE2 PHE 129 9.601 2.729 5.397 1042 HZ PHE 129 HZ PHE 129 7.842 0.981 5.250 1043 H ARG 130 H ARG 130 9.909 6.161 10.099 1044 HA ARG 130 HA ARG 130 11.760 4.238 9.317 1045 HB2 ARG 130 HB2 ARG 130 11.928 6.810 9.258 1046 HB3 ARG 130 HB3 ARG 130 12.362 6.731 10.970 1047 HG2 ARG 130 HG2 ARG 130 14.174 4.964 10.088 1048 HG3 ARG 130 HG3 ARG 130 13.921 5.804 8.552 1049 HD2 ARG 130 HD2 ARG 130 14.749 7.082 11.207 1050 HD3 ARG 130 HD3 ARG 130 15.791 6.812 9.804 1051 HE ARG 130 HE ARG 130 14.187 8.404 8.586 1052 HH11 ARG 130 HH11 ARG 130 14.719 8.556 12.056 1053 HH12 ARG 130 HH12 ARG 130 14.356 10.246 12.160 1054 HH21 ARG 130 HH21 ARG 130 13.718 10.622 8.734 1055 HH22 ARG 130 HH22 ARG 130 13.786 11.422 10.269 1056 H LYS 131 H LYS 131 10.930 5.476 12.699 1057 HA LYS 131 HA LYS 131 12.972 4.183 14.017 1058 HB2 LYS 131 HB2 LYS 131 10.027 4.622 14.819 1059 HB3 LYS 131 HB3 LYS 131 11.285 4.121 15.957 1060 HG2 LYS 131 HG2 LYS 131 12.522 6.270 15.443 1061 HG3 LYS 131 HG3 LYS 131 11.149 6.772 14.447 1062 HD2 LYS 131 HD2 LYS 131 9.624 6.511 16.423 1063 HD3 LYS 131 HD3 LYS 131 11.000 6.016 17.417 1064 HE2 LYS 131 HE2 LYS 131 12.111 8.228 16.904 1065 HE3 LYS 131 HE3 LYS 131 10.660 8.717 16.020 1066 HZ1 LYS 131 HZ1 LYS 131 10.639 9.522 18.270 1067 HZ2 LYS 131 HZ2 LYS 131 9.412 8.464 18.066 1068 HZ3 LYS 131 HZ3 LYS 131 10.753 8.012 18.882 1069 H LEU 132 H LEU 132 9.553 2.875 13.511 1070 HA LEU 132 HA LEU 132 10.044 0.368 14.595 1071 HB2 LEU 132 HB2 LEU 132 8.229 1.149 12.280 1072 HB3 LEU 132 HB3 LEU 132 8.157 -0.377 13.171 1073 HG LEU 132 HG LEU 132 7.676 2.383 14.374 1074 HD11 LEU 132 HD11 LEU 132 5.304 1.672 14.464 1075 HD12 LEU 132 HD12 LEU 132 5.918 1.748 12.777 1076 HD13 LEU 132 HD13 LEU 132 5.731 0.160 13.594 1077 HD21 LEU 132 HD21 LEU 132 6.826 1.125 16.324 1078 HD22 LEU 132 HD22 LEU 132 7.312 -0.415 15.537 1079 HD23 LEU 132 HD23 LEU 132 8.561 0.786 16.009 1080 H ALA 133 H ALA 133 10.565 1.654 11.240 1081 HA ALA 133 HA ALA 133 11.255 -0.760 10.035 1082 HB1 ALA 133 HB1 ALA 133 12.376 0.687 8.367 1083 HB2 ALA 133 HB2 ALA 133 10.749 1.306 8.805 1084 HB3 ALA 133 HB3 ALA 133 12.218 2.086 9.482 1085 H GLY 134 H GLY 134 13.325 1.625 11.901 1086 HA2 GLY 134 HA2 GLY 134 15.756 0.334 11.252 1087 HA3 GLY 134 HA3 GLY 134 15.458 1.466 12.578 1088 H GLU 135 H GLU 135 13.470 0.031 14.101 1089 HA GLU 135 HA GLU 135 15.070 -1.605 15.655 1090 HB2 GLU 135 HB2 GLU 135 12.982 -0.610 16.446 1091 HB3 GLU 135 HB3 GLU 135 12.041 -1.557 15.286 1092 HG2 GLU 135 HG2 GLU 135 12.580 -3.634 16.422 1093 HG3 GLU 135 HG3 GLU 135 13.758 -2.825 17.464 1094 H ARG 136 H ARG 136 13.377 -2.333 12.607 1095 HA ARG 136 HA ARG 136 13.615 -5.199 13.031 1096 HB2 ARG 136 HB2 ARG 136 12.800 -3.692 10.502 1097 HB3 ARG 136 HB3 ARG 136 12.425 -5.365 10.935 1098 HG2 ARG 136 HG2 ARG 136 10.926 -4.615 12.734 1099 HG3 ARG 136 HG3 ARG 136 11.378 -2.928 12.456 1100 HD2 ARG 136 HD2 ARG 136 9.265 -3.293 11.347 1101 HD3 ARG 136 HD3 ARG 136 10.497 -3.134 10.088 1102 HE ARG 136 HE ARG 136 10.216 -5.395 9.531 1103 HH11 ARG 136 HH11 ARG 136 8.418 -4.632 12.458 1104 HH12 ARG 136 HH12 ARG 136 7.537 -6.123 12.449 1105 HH21 ARG 136 HH21 ARG 136 9.062 -7.348 9.541 1106 HH22 ARG 136 HH22 ARG 136 7.904 -7.668 10.788 1107 H ASN 137 H ASN 137 15.976 -2.979 12.498 1108 HA ASN 137 HA ASN 137 18.028 -3.146 11.701 1109 HB2 ASN 137 HB2 ASN 137 17.094 -5.947 10.980 1110 HB3 ASN 137 HB3 ASN 137 18.662 -5.350 10.422 1111 HD21 ASN 137 HD21 ASN 137 19.546 -3.843 12.583 1112 HD22 ASN 137 HD22 ASN 137 19.789 -4.882 13.948 1113 H TYR 138 H TYR 138 15.598 -2.142 10.079 1114 HA TYR 138 HA TYR 138 16.197 -2.835 7.379 1115 HB2 TYR 138 HB2 TYR 138 14.220 -1.824 7.001 1116 HB3 TYR 138 HB3 TYR 138 14.070 -1.653 8.755 1117 HD1 TYR 138 HD1 TYR 138 15.401 0.533 9.726 1118 HD2 TYR 138 HD2 TYR 138 13.914 0.094 5.718 1119 HE1 TYR 138 HE1 TYR 138 15.360 2.996 9.473 1120 HE2 TYR 138 HE2 TYR 138 13.872 2.560 5.466 1121 HH TYR 138 HH TYR 138 14.265 4.523 6.402 1122 H THR 139 H THR 139 17.157 -1.563 5.763 1123 HA THR 139 HA THR 139 18.983 0.564 6.738 1124 HB THR 139 HB THR 139 20.197 -0.092 4.554 1125 HG1 THR 139 HG1 THR 139 19.761 -2.333 3.932 1126 HG21 THR 139 HG21 THR 139 21.376 -1.958 5.681 1127 HG22 THR 139 HG22 THR 139 21.034 -0.618 6.826 1128 HG23 THR 139 HG23 THR 139 20.025 -2.103 6.856 1129 H ASP 140 H ASP 140 19.200 2.459 5.093 1130 HA ASP 140 HA ASP 140 16.741 3.445 4.357 1131 HB2 ASP 140 HB2 ASP 140 19.307 4.376 4.362 1132 HB3 ASP 140 HB3 ASP 140 19.240 3.942 2.648 1133 H GLU 141 H GLU 141 19.079 1.595 2.229 1134 HA GLU 141 HA GLU 141 17.634 1.890 -0.102 1135 HB2 GLU 141 HB2 GLU 141 19.122 -0.672 0.744 1136 HB3 GLU 141 HB3 GLU 141 18.996 -0.001 -0.887 1137 HG2 GLU 141 HG2 GLU 141 20.445 1.528 1.291 1138 HG3 GLU 141 HG3 GLU 141 21.240 0.191 0.450 1139 H MET 142 H MET 142 16.527 0.150 2.717 1140 HA MET 142 HA MET 142 15.121 -1.859 1.132 1141 HB2 MET 142 HB2 MET 142 16.006 -2.507 3.312 1142 HB3 MET 142 HB3 MET 142 15.208 -1.141 4.103 1143 HG2 MET 142 HG2 MET 142 12.976 -2.141 3.467 1144 HG3 MET 142 HG3 MET 142 13.831 -3.543 2.811 1145 HE1 MET 142 HE1 MET 142 15.365 -5.293 5.865 1146 HE2 MET 142 HE2 MET 142 15.376 -5.036 4.088 1147 HE3 MET 142 HE3 MET 142 16.289 -3.923 5.163 1148 H VAL 143 H VAL 143 14.584 1.429 2.392 1149 HA VAL 143 HA VAL 143 11.807 1.288 1.454 1150 HB VAL 143 HB VAL 143 12.718 2.593 4.069 1151 HG11 VAL 143 HG11 VAL 143 10.305 3.003 4.438 1152 HG12 VAL 143 HG12 VAL 143 10.918 3.833 2.968 1153 HG13 VAL 143 HG13 VAL 143 9.950 2.328 2.813 1154 HG21 VAL 143 HG21 VAL 143 11.310 0.899 5.197 1155 HG22 VAL 143 HG22 VAL 143 11.012 0.105 3.614 1156 HG23 VAL 143 HG23 VAL 143 12.673 0.156 4.294 1157 H ALA 144 H ALA 144 11.153 3.319 0.425 1158 HA ALA 144 HA ALA 144 13.193 5.454 0.513 1159 HB1 ALA 144 HB1 ALA 144 12.842 5.781 -1.909 1160 HB2 ALA 144 HB2 ALA 144 13.519 4.156 -1.551 1161 HB3 ALA 144 HB3 ALA 144 11.777 4.335 -1.950 1162 H MET 145 H MET 145 12.314 7.512 0.723 1163 HA MET 145 HA MET 145 9.366 7.642 0.769 1164 HB2 MET 145 HB2 MET 145 9.677 9.572 2.257 1165 HB3 MET 145 HB3 MET 145 10.433 8.116 2.918 1166 HG2 MET 145 HG2 MET 145 12.634 9.016 1.829 1167 HG3 MET 145 HG3 MET 145 11.771 10.554 1.694 1168 HE1 MET 145 HE1 MET 145 12.993 8.345 5.544 1169 HE2 MET 145 HE2 MET 145 11.316 8.012 4.993 1170 HE3 MET 145 HE3 MET 145 12.705 7.645 3.915 1171 H LEU 146 H LEU 146 8.284 9.078 -0.576 1172 HA LEU 146 HA LEU 146 10.022 10.558 -2.419 1173 HB2 LEU 146 HB2 LEU 146 7.147 9.555 -2.604 1174 HB3 LEU 146 HB3 LEU 146 7.850 10.678 -3.776 1175 HG LEU 146 HG LEU 146 7.885 8.451 -4.682 1176 HD11 LEU 146 HD11 LEU 146 10.297 8.167 -5.152 1177 HD12 LEU 146 HD12 LEU 146 9.786 9.886 -5.248 1178 HD13 LEU 146 HD13 LEU 146 10.684 9.295 -3.809 1179 HD21 LEU 146 HD21 LEU 146 9.152 6.605 -3.640 1180 HD22 LEU 146 HD22 LEU 146 9.477 7.644 -2.211 1181 HD23 LEU 146 HD23 LEU 146 7.793 7.163 -2.607 1182 HA PRO 147 HA PRO 147 8.578 14.361 -0.532 1183 HB2 PRO 147 HB2 PRO 147 9.509 16.064 -2.514 1184 HB3 PRO 147 HB3 PRO 147 10.639 15.287 -1.397 1185 HG2 PRO 147 HG2 PRO 147 9.890 14.482 -4.223 1186 HG3 PRO 147 HG3 PRO 147 11.491 14.553 -3.475 1187 HD2 PRO 147 HD2 PRO 147 10.146 12.191 -3.741 1188 HD3 PRO 147 HD3 PRO 147 11.216 12.491 -2.366 1189 H ARG 148 H ARG 148 7.594 16.605 -1.853 1190 HA ARG 148 HA ARG 148 5.023 15.704 -2.508 1191 HB2 ARG 148 HB2 ARG 148 4.374 17.942 -2.535 1192 HB3 ARG 148 HB3 ARG 148 5.732 17.923 -1.402 1193 HG2 ARG 148 HG2 ARG 148 5.773 18.891 -4.295 1194 HG3 ARG 148 HG3 ARG 148 5.878 19.884 -2.835 1195 HD2 ARG 148 HD2 ARG 148 7.915 17.754 -3.656 1196 HD3 ARG 148 HD3 ARG 148 8.098 19.490 -3.936 1197 HE ARG 148 HE ARG 148 7.612 18.895 -1.138 1198 HH11 ARG 148 HH11 ARG 148 10.088 19.045 -3.636 1199 HH12 ARG 148 HH12 ARG 148 11.388 19.222 -2.505 1200 HH21 ARG 148 HH21 ARG 148 9.332 19.119 0.329 1201 HH22 ARG 148 HH22 ARG 148 10.957 19.264 -0.252 1202 H GLN 149 H GLN 149 6.301 14.279 -4.153 1203 HA GLN 149 HA GLN 149 6.409 15.346 -6.721 1204 HB2 GLN 149 HB2 GLN 149 7.600 13.146 -5.640 1205 HB3 GLN 149 HB3 GLN 149 6.427 12.492 -6.791 1206 HG2 GLN 149 HG2 GLN 149 7.324 13.933 -8.588 1207 HG3 GLN 149 HG3 GLN 149 8.427 14.718 -7.451 1208 HE21 GLN 149 HE21 GLN 149 9.073 12.258 -6.020 1209 HE22 GLN 149 HE22 GLN 149 10.121 11.349 -7.056 1210 H GLU 150 H GLU 150 3.418 15.477 -5.278 1211 HA GLU 150 HA GLU 150 2.449 13.184 -6.768 1212 HB2 GLU 150 HB2 GLU 150 0.385 14.808 -6.293 1213 HB3 GLU 150 HB3 GLU 150 1.149 13.930 -4.961 1214 HG2 GLU 150 HG2 GLU 150 0.788 16.067 -4.093 1215 HG3 GLU 150 HG3 GLU 150 2.510 16.059 -4.498 1216 H GLU 151 H GLU 151 2.338 13.031 -8.743 1217 HA GLU 151 HA GLU 151 2.073 15.369 -10.539 1218 HB2 GLU 151 HB2 GLU 151 4.148 13.943 -10.565 1219 HB3 GLU 151 HB3 GLU 151 3.125 12.599 -11.088 1220 HG2 GLU 151 HG2 GLU 151 2.503 13.751 -13.110 1221 HG3 GLU 151 HG3 GLU 151 3.259 15.252 -12.560 1222 H CYS 152 H CYS 152 1.211 11.813 -10.257 1223 HA CYS 152 HA CYS 152 -1.181 12.563 -11.907 1224 HB2 CYS 152 HB2 CYS 152 0.644 10.798 -12.572 1225 HB3 CYS 152 HB3 CYS 152 0.048 9.844 -11.207 1226 H THR 153 H THR 153 -2.971 10.785 -11.088 1227 HA THR 153 HA THR 153 -2.998 10.639 -8.220 1228 HB THR 153 HB THR 153 -5.271 12.183 -9.479 1229 HG1 THR 153 HG1 THR 153 -4.096 14.202 -9.065 1230 HG21 THR 153 HG21 THR 153 -5.317 13.297 -7.253 1231 HG22 THR 153 HG22 THR 153 -5.410 11.508 -7.116 1232 HG23 THR 153 HG23 THR 153 -3.866 12.356 -6.767 1233 H VAL 154 H VAL 154 -5.129 9.635 -7.391 1234 HA VAL 154 HA VAL 154 -6.167 7.895 -9.538 1235 HB VAL 154 HB VAL 154 -4.980 6.756 -7.682 1236 HG11 VAL 154 HG11 VAL 154 -5.919 6.761 -5.394 1237 HG12 VAL 154 HG12 VAL 154 -5.341 8.385 -5.898 1238 HG13 VAL 154 HG13 VAL 154 -7.099 8.020 -5.891 1239 HG21 VAL 154 HG21 VAL 154 -6.766 5.161 -7.050 1240 HG22 VAL 154 HG22 VAL 154 -8.000 6.317 -7.654 1241 HG23 VAL 154 HG23 VAL 154 -6.819 5.587 -8.793 1242 H ASP 155 H ASP 155 -8.396 7.857 -9.942 1243 HA ASP 155 HA ASP 155 -9.911 10.021 -8.809 1244 HB2 ASP 155 HB2 ASP 155 -10.171 9.562 -11.168 1245 HB3 ASP 155 HB3 ASP 155 -10.475 7.844 -10.876 1246 H GLU 156 H GLU 156 -11.940 9.852 -7.668 1247 HA GLU 156 HA GLU 156 -12.215 7.283 -6.259 1248 HB2 GLU 156 HB2 GLU 156 -13.108 8.545 -4.371 1249 HB3 GLU 156 HB3 GLU 156 -11.455 9.037 -4.766 1250 HG2 GLU 156 HG2 GLU 156 -12.479 11.003 -6.061 1251 HG3 GLU 156 HG3 GLU 156 -14.033 10.557 -5.346 1252 H VAL 157 H VAL 157 -14.185 10.195 -7.327 1253 HA VAL 157 HA VAL 157 -16.100 8.471 -8.519 1254 HB VAL 157 HB VAL 157 -16.793 8.109 -6.204 1255 HG11 VAL 157 HG11 VAL 157 -17.622 9.962 -4.795 1256 HG12 VAL 157 HG12 VAL 157 -15.873 10.122 -5.169 1257 HG13 VAL 157 HG13 VAL 157 -17.073 11.140 -6.034 1258 HG21 VAL 157 HG21 VAL 157 -19.144 8.862 -6.379 1259 HG22 VAL 157 HG22 VAL 157 -18.680 9.973 -7.711 1260 HG23 VAL 157 HG23 VAL 157 -18.527 8.197 -7.929 1261 HN1 EB4 158 HN1 EB4 158 3.678 -5.643 -6.521 1262 H8 EB4 158 H8 EB4 158 -2.694 -5.621 -3.905 1263 HN2 EB4 158 HN2 EB4 158 1.166 -4.886 -8.061 1264 H9 EB4 158 H9 EB4 158 0.554 -0.028 -2.786 1265 H10 EB4 158 H10 EB4 158 4.245 -7.155 -0.841 1266 HN3 EB4 158 HN3 EB4 158 3.387 -2.447 -7.214 1267 H7 EB4 158 H7 EB4 158 2.656 -5.225 -0.830 1268 H11 EB4 158 H11 EB4 158 -4.063 -6.297 -5.856 1269 H12 EB4 158 H12 EB4 158 1.818 1.947 -3.608 1270 H15 EB4 158 H15 EB4 158 3.568 1.661 -5.341 1271 H14 EB4 158 H14 EB4 158 -3.033 -6.346 -8.110 1272 H13 EB4 158 H13 EB4 158 5.340 -7.829 -2.942 1273 H22 EB4 158 H22 EB4 158 4.542 -6.412 -6.914 1274 H30 EB4 158 H30 EB4 158 6.140 -3.247 -9.598 1275 H30A EB4 158 H30A EB4 158 6.404 -2.634 -7.890 1276 H24 EB4 158 H24 EB4 158 4.105 -1.752 -7.895 1277 H28 EB4 158 H28 EB4 158 3.515 -8.188 -8.418 1278 H28A EB4 158 H28A EB4 158 4.317 -7.331 -9.797 1279 H23 EB4 158 H23 EB4 158 0.787 -4.960 -9.248 1280 H29 EB4 158 H29 EB4 158 0.651 -2.940 -10.474 1281 H29A EB4 158 H29A EB4 158 2.110 -3.518 -11.524 Start of MODEL 19 1 H1 MET 1 H1 MET 1 -28.847 4.185 -3.986 2 H2 MET 1 H2 MET 1 -28.435 5.759 -4.125 3 H3 MET 1 H3 MET 1 -29.221 5.010 -5.344 4 HA MET 1 HA MET 1 -27.022 3.467 -4.919 5 HB2 MET 1 HB2 MET 1 -27.699 5.535 -7.053 6 HB3 MET 1 HB3 MET 1 -26.288 4.473 -7.147 7 HG2 MET 1 HG2 MET 1 -27.709 2.483 -7.161 8 HG3 MET 1 HG3 MET 1 -29.154 3.459 -6.867 9 HE1 MET 1 HE1 MET 1 -29.658 2.213 -10.568 10 HE2 MET 1 HE2 MET 1 -28.888 1.318 -9.214 11 HE3 MET 1 HE3 MET 1 -30.358 2.305 -8.917 12 H THR 2 H THR 2 -24.787 3.865 -4.535 13 HA THR 2 HA THR 2 -23.026 4.912 -3.693 14 HB THR 2 HB THR 2 -23.971 7.536 -4.905 15 HG1 THR 2 HG1 THR 2 -23.157 6.697 -6.968 16 HG21 THR 2 HG21 THR 2 -21.568 7.721 -5.484 17 HG22 THR 2 HG22 THR 2 -21.802 7.452 -3.724 18 HG23 THR 2 HG23 THR 2 -21.274 6.096 -4.777 19 H VAL 3 H VAL 3 -25.388 4.781 -1.964 20 HA VAL 3 HA VAL 3 -25.948 7.254 -0.788 21 HB VAL 3 HB VAL 3 -26.783 5.900 1.142 22 HG11 VAL 3 HG11 VAL 3 -28.552 4.717 -0.123 23 HG12 VAL 3 HG12 VAL 3 -28.221 6.351 -0.792 24 HG13 VAL 3 HG13 VAL 3 -27.585 4.893 -1.626 25 HG21 VAL 3 HG21 VAL 3 -26.766 3.433 0.981 26 HG22 VAL 3 HG22 VAL 3 -25.712 3.541 -0.470 27 HG23 VAL 3 HG23 VAL 3 -25.109 4.112 1.123 28 HA PRO 4 HA PRO 4 -22.169 7.879 1.526 29 HB2 PRO 4 HB2 PRO 4 -23.115 9.904 3.187 30 HB3 PRO 4 HB3 PRO 4 -22.808 10.219 1.474 31 HG2 PRO 4 HG2 PRO 4 -25.431 9.590 2.860 32 HG3 PRO 4 HG3 PRO 4 -25.087 10.821 1.637 33 HD2 PRO 4 HD2 PRO 4 -26.262 8.446 0.978 34 HD3 PRO 4 HD3 PRO 4 -25.174 9.277 -0.141 35 H ASP 5 H ASP 5 -23.053 5.521 2.310 36 HA ASP 5 HA ASP 5 -23.345 5.820 5.232 37 HB2 ASP 5 HB2 ASP 5 -24.477 3.791 3.284 38 HB3 ASP 5 HB3 ASP 5 -24.209 3.361 4.978 39 H ARG 6 H ARG 6 -22.561 2.800 3.396 40 HA ARG 6 HA ARG 6 -20.434 2.187 5.079 41 HB2 ARG 6 HB2 ARG 6 -21.508 1.188 2.476 42 HB3 ARG 6 HB3 ARG 6 -19.821 0.788 2.822 43 HG2 ARG 6 HG2 ARG 6 -21.052 -1.038 3.685 44 HG3 ARG 6 HG3 ARG 6 -20.633 -0.080 5.111 45 HD2 ARG 6 HD2 ARG 6 -22.939 -0.629 5.381 46 HD3 ARG 6 HD3 ARG 6 -22.921 1.067 4.882 47 HE ARG 6 HE ARG 6 -23.405 0.191 2.540 48 HH11 ARG 6 HH11 ARG 6 -24.286 -1.658 5.398 49 HH12 ARG 6 HH12 ARG 6 -25.581 -2.493 4.607 50 HH21 ARG 6 HH21 ARG 6 -25.101 -0.925 1.516 51 HH22 ARG 6 HH22 ARG 6 -26.044 -2.077 2.402 52 H SER 7 H SER 7 -20.571 4.352 2.264 53 HA SER 7 HA SER 7 -17.975 4.307 1.332 54 HB2 SER 7 HB2 SER 7 -19.000 7.038 1.597 55 HB3 SER 7 HB3 SER 7 -18.786 6.063 0.137 56 HG SER 7 HG SER 7 -20.966 6.250 0.194 57 H GLU 8 H GLU 8 -19.254 5.756 4.343 58 HA GLU 8 HA GLU 8 -17.038 7.313 4.994 59 HB2 GLU 8 HB2 GLU 8 -19.093 6.070 6.839 60 HB3 GLU 8 HB3 GLU 8 -17.916 7.311 7.288 61 HG2 GLU 8 HG2 GLU 8 -18.904 8.739 5.371 62 HG3 GLU 8 HG3 GLU 8 -20.212 7.551 5.294 63 H ILE 9 H ILE 9 -17.446 3.849 5.082 64 HA ILE 9 HA ILE 9 -15.316 3.493 6.986 65 HB ILE 9 HB ILE 9 -16.828 1.369 5.372 66 HG12 ILE 9 HG12 ILE 9 -17.384 2.462 8.182 67 HG13 ILE 9 HG13 ILE 9 -18.308 2.912 6.743 68 HG21 ILE 9 HG21 ILE 9 -16.123 -0.109 7.225 69 HG22 ILE 9 HG22 ILE 9 -14.708 0.620 6.392 70 HG23 ILE 9 HG23 ILE 9 -15.241 1.260 7.983 71 HD11 ILE 9 HD11 ILE 9 -19.480 1.199 8.046 72 HD12 ILE 9 HD12 ILE 9 -19.006 0.557 6.437 73 HD13 ILE 9 HD13 ILE 9 -18.067 0.100 7.899 74 H ALA 10 H ALA 10 -15.325 4.206 3.653 75 HA ALA 10 HA ALA 10 -12.672 2.966 3.407 76 HB1 ALA 10 HB1 ALA 10 -13.236 2.287 1.082 77 HB2 ALA 10 HB2 ALA 10 -14.260 1.440 2.290 78 HB3 ALA 10 HB3 ALA 10 -14.933 2.813 1.348 79 H GLY 11 H GLY 11 -11.934 3.841 0.873 80 HA2 GLY 11 HA2 GLY 11 -12.700 6.246 -0.073 81 HA3 GLY 11 HA3 GLY 11 -11.759 6.688 1.358 82 H LYS 12 H LYS 12 -10.196 7.750 -0.055 83 HA LYS 12 HA LYS 12 -8.553 5.878 -1.637 84 HB2 LYS 12 HB2 LYS 12 -7.761 7.946 -2.774 85 HB3 LYS 12 HB3 LYS 12 -9.508 7.727 -2.939 86 HG2 LYS 12 HG2 LYS 12 -9.855 9.369 -1.053 87 HG3 LYS 12 HG3 LYS 12 -8.107 9.631 -0.995 88 HD2 LYS 12 HD2 LYS 12 -8.131 10.412 -3.362 89 HD3 LYS 12 HD3 LYS 12 -9.872 10.114 -3.454 90 HE2 LYS 12 HE2 LYS 12 -9.568 12.474 -3.026 91 HE3 LYS 12 HE3 LYS 12 -10.205 11.747 -1.545 92 HZ1 LYS 12 HZ1 LYS 12 -8.252 13.307 -1.345 93 HZ2 LYS 12 HZ2 LYS 12 -8.133 11.892 -0.539 94 HZ3 LYS 12 HZ3 LYS 12 -7.317 12.107 -1.937 95 H TRP 13 H TRP 13 -6.419 5.499 -0.968 96 HA TRP 13 HA TRP 13 -5.424 7.314 1.144 97 HB2 TRP 13 HB2 TRP 13 -5.093 4.284 0.773 98 HB3 TRP 13 HB3 TRP 13 -4.175 5.244 1.941 99 HD1 TRP 13 HD1 TRP 13 -6.479 2.801 2.455 100 HE1 TRP 13 HE1 TRP 13 -8.282 3.304 4.243 101 HE3 TRP 13 HE3 TRP 13 -6.081 7.919 2.575 102 HZ2 TRP 13 HZ2 TRP 13 -9.383 5.554 5.539 103 HZ3 TRP 13 HZ3 TRP 13 -7.548 9.187 4.122 104 HH2 TRP 13 HH2 TRP 13 -9.171 8.020 5.583 105 H TYR 14 H TYR 14 -3.336 8.124 0.767 106 HA TYR 14 HA TYR 14 -2.085 7.268 -1.759 107 HB2 TYR 14 HB2 TYR 14 -1.455 9.651 0.058 108 HB3 TYR 14 HB3 TYR 14 -0.860 9.377 -1.584 109 HD1 TYR 14 HD1 TYR 14 -3.972 10.031 0.396 110 HD2 TYR 14 HD2 TYR 14 -2.117 10.121 -3.476 111 HE1 TYR 14 HE1 TYR 14 -5.924 11.252 -0.508 112 HE2 TYR 14 HE2 TYR 14 -4.073 11.339 -4.384 113 HH TYR 14 HH TYR 14 -6.325 11.805 -3.959 114 H VAL 15 H VAL 15 0.011 6.117 -1.661 115 HA VAL 15 HA VAL 15 0.822 5.667 1.131 116 HB VAL 15 HB VAL 15 0.559 3.821 -0.413 117 HG11 VAL 15 HG11 VAL 15 2.161 3.400 -2.273 118 HG12 VAL 15 HG12 VAL 15 1.069 4.799 -2.555 119 HG13 VAL 15 HG13 VAL 15 2.778 5.075 -2.074 120 HG21 VAL 15 HG21 VAL 15 2.732 2.673 -0.097 121 HG22 VAL 15 HG22 VAL 15 3.444 4.237 0.424 122 HG23 VAL 15 HG23 VAL 15 2.115 3.493 1.376 123 H VAL 16 H VAL 16 2.450 6.884 2.041 124 HA VAL 16 HA VAL 16 3.814 8.690 0.192 125 HB VAL 16 HB VAL 16 4.362 9.945 2.206 126 HG11 VAL 16 HG11 VAL 16 2.219 10.520 3.232 127 HG12 VAL 16 HG12 VAL 16 2.144 10.414 1.440 128 HG13 VAL 16 HG13 VAL 16 1.493 9.076 2.447 129 HG21 VAL 16 HG21 VAL 16 3.787 9.186 4.497 130 HG22 VAL 16 HG22 VAL 16 3.242 7.624 3.799 131 HG23 VAL 16 HG23 VAL 16 4.968 8.105 3.683 132 H ALA 17 H ALA 17 4.405 5.884 2.325 133 HA ALA 17 HA ALA 17 7.271 6.067 1.608 134 HB1 ALA 17 HB1 ALA 17 7.799 4.934 3.689 135 HB2 ALA 17 HB2 ALA 17 7.038 6.534 3.985 136 HB3 ALA 17 HB3 ALA 17 6.080 5.030 4.200 137 H LEU 18 H LEU 18 8.154 3.802 1.367 138 HA LEU 18 HA LEU 18 6.268 1.619 1.310 139 HB2 LEU 18 HB2 LEU 18 5.795 3.113 -0.743 140 HB3 LEU 18 HB3 LEU 18 7.389 2.607 -1.316 141 HG LEU 18 HG LEU 18 5.212 0.583 -0.628 142 HD11 LEU 18 HD11 LEU 18 4.697 0.561 -3.051 143 HD12 LEU 18 HD12 LEU 18 4.350 2.169 -2.331 144 HD13 LEU 18 HD13 LEU 18 5.836 1.925 -3.310 145 HD21 LEU 18 HD21 LEU 18 6.587 -0.815 -2.154 146 HD22 LEU 18 HD22 LEU 18 7.711 0.563 -2.403 147 HD23 LEU 18 HD23 LEU 18 7.570 -0.198 -0.783 148 H ALA 19 H ALA 19 7.814 -0.315 1.668 149 HA ALA 19 HA ALA 19 10.438 0.239 0.500 150 HB1 ALA 19 HB1 ALA 19 11.553 -0.689 2.447 151 HB2 ALA 19 HB2 ALA 19 10.675 0.831 2.824 152 HB3 ALA 19 HB3 ALA 19 9.985 -0.751 3.320 153 H SER 20 H SER 20 11.357 -1.364 -0.308 154 HA SER 20 HA SER 20 9.908 -3.772 -0.745 155 HB2 SER 20 HB2 SER 20 12.073 -2.925 -2.588 156 HB3 SER 20 HB3 SER 20 10.899 -4.238 -2.749 157 HG SER 20 HG SER 20 10.509 -1.988 -3.776 158 H ASN 21 H ASN 21 11.859 -5.460 -1.678 159 HA ASN 21 HA ASN 21 13.504 -5.747 0.756 160 HB2 ASN 21 HB2 ASN 21 11.593 -7.109 1.121 161 HB3 ASN 21 HB3 ASN 21 11.782 -7.890 -0.454 162 HD21 ASN 21 HD21 ASN 21 13.491 -9.244 -0.834 163 HD22 ASN 21 HD22 ASN 21 14.433 -9.953 0.434 164 H THR 22 H THR 22 12.923 -7.089 -2.440 165 HA THR 22 HA THR 22 15.567 -8.000 -2.846 166 HB THR 22 HB THR 22 13.614 -7.560 -5.110 167 HG1 THR 22 HG1 THR 22 12.017 -8.473 -3.953 168 HG21 THR 22 HG21 THR 22 14.309 -9.874 -5.684 169 HG22 THR 22 HG22 THR 22 15.725 -8.792 -5.464 170 HG23 THR 22 HG23 THR 22 15.273 -9.954 -4.171 171 H GLU 23 H GLU 23 17.148 -7.236 -4.323 172 HA GLU 23 HA GLU 23 17.659 -4.588 -4.231 173 HB2 GLU 23 HB2 GLU 23 18.514 -5.901 -6.775 174 HB3 GLU 23 HB3 GLU 23 19.484 -5.082 -5.543 175 HG2 GLU 23 HG2 GLU 23 18.397 -7.922 -5.305 176 HG3 GLU 23 HG3 GLU 23 20.033 -7.499 -5.826 177 H PHE 24 H PHE 24 16.056 -6.391 -7.004 178 HA PHE 24 HA PHE 24 15.874 -4.193 -8.703 179 HB2 PHE 24 HB2 PHE 24 14.026 -6.615 -8.334 180 HB3 PHE 24 HB3 PHE 24 13.964 -5.520 -9.721 181 HD1 PHE 24 HD1 PHE 24 15.909 -5.389 -11.286 182 HD2 PHE 24 HD2 PHE 24 15.656 -8.355 -8.195 183 HE1 PHE 24 HE1 PHE 24 17.620 -6.743 -12.453 184 HE2 PHE 24 HE2 PHE 24 17.371 -9.716 -9.357 185 HZ PHE 24 HZ PHE 24 18.356 -8.911 -11.491 186 H PHE 25 H PHE 25 13.332 -5.502 -6.385 187 HA PHE 25 HA PHE 25 11.399 -3.632 -6.950 188 HB2 PHE 25 HB2 PHE 25 12.140 -5.104 -4.388 189 HB3 PHE 25 HB3 PHE 25 10.743 -4.024 -4.473 190 HD1 PHE 25 HD1 PHE 25 8.863 -4.542 -6.057 191 HD2 PHE 25 HD2 PHE 25 12.075 -7.296 -5.331 192 HE1 PHE 25 HE1 PHE 25 7.492 -6.381 -6.989 193 HE2 PHE 25 HE2 PHE 25 10.709 -9.139 -6.260 194 HZ PHE 25 HZ PHE 25 8.412 -8.687 -7.090 195 H LEU 26 H LEU 26 14.255 -3.330 -4.696 196 HA LEU 26 HA LEU 26 13.385 -0.850 -3.634 197 HB2 LEU 26 HB2 LEU 26 16.239 -1.913 -3.961 198 HB3 LEU 26 HB3 LEU 26 15.670 -0.747 -2.759 199 HG LEU 26 HG LEU 26 14.929 -3.704 -2.868 200 HD11 LEU 26 HD11 LEU 26 16.292 -3.856 -0.812 201 HD12 LEU 26 HD12 LEU 26 17.267 -3.313 -2.220 202 HD13 LEU 26 HD13 LEU 26 16.737 -2.124 -0.982 203 HD21 LEU 26 HD21 LEU 26 13.888 -3.285 -0.669 204 HD22 LEU 26 HD22 LEU 26 14.240 -1.559 -0.849 205 HD23 LEU 26 HD23 LEU 26 13.105 -2.328 -1.971 206 H ARG 27 H ARG 27 15.968 -1.649 -6.142 207 HA ARG 27 HA ARG 27 16.670 0.983 -6.652 208 HB2 ARG 27 HB2 ARG 27 17.667 -1.328 -7.421 209 HB3 ARG 27 HB3 ARG 27 16.531 -1.203 -8.770 210 HG2 ARG 27 HG2 ARG 27 17.607 1.151 -9.182 211 HG3 ARG 27 HG3 ARG 27 18.904 0.583 -8.122 212 HD2 ARG 27 HD2 ARG 27 19.618 0.023 -10.335 213 HD3 ARG 27 HD3 ARG 27 19.072 -1.503 -9.625 214 HE ARG 27 HE ARG 27 16.830 -0.882 -10.847 215 HH11 ARG 27 HH11 ARG 27 20.083 -0.311 -12.059 216 HH12 ARG 27 HH12 ARG 27 19.596 -0.355 -13.721 217 HH21 ARG 27 HH21 ARG 27 16.202 -0.916 -13.008 218 HH22 ARG 27 HH22 ARG 27 17.377 -0.701 -14.263 219 H GLU 28 H GLU 28 14.060 -1.050 -8.249 220 HA GLU 28 HA GLU 28 13.418 1.014 -10.083 221 HB2 GLU 28 HB2 GLU 28 11.633 -1.239 -9.088 222 HB3 GLU 28 HB3 GLU 28 11.435 -0.295 -10.570 223 HG2 GLU 28 HG2 GLU 28 13.423 -2.476 -9.936 224 HG3 GLU 28 HG3 GLU 28 12.367 -2.289 -11.342 225 H LYS 29 H LYS 29 12.105 0.085 -6.796 226 HA LYS 29 HA LYS 29 10.001 1.958 -6.905 227 HB2 LYS 29 HB2 LYS 29 11.121 0.085 -4.953 228 HB3 LYS 29 HB3 LYS 29 10.569 1.591 -4.208 229 HG2 LYS 29 HG2 LYS 29 8.864 -0.094 -6.110 230 HG3 LYS 29 HG3 LYS 29 8.823 -0.246 -4.348 231 HD2 LYS 29 HD2 LYS 29 7.036 1.228 -4.781 232 HD3 LYS 29 HD3 LYS 29 8.345 2.328 -4.325 233 HE2 LYS 29 HE2 LYS 29 7.687 3.404 -6.247 234 HE3 LYS 29 HE3 LYS 29 8.823 2.267 -6.984 235 HZ1 LYS 29 HZ1 LYS 29 7.116 1.576 -8.184 236 HZ2 LYS 29 HZ2 LYS 29 6.429 0.934 -6.849 237 HZ3 LYS 29 HZ3 LYS 29 6.028 2.442 -7.329 238 H ASP 30 H ASP 30 13.408 2.168 -5.657 239 HA ASP 30 HA ASP 30 13.117 4.701 -4.454 240 HB2 ASP 30 HB2 ASP 30 15.133 3.960 -3.767 241 HB3 ASP 30 HB3 ASP 30 15.231 2.778 -5.079 242 H LYS 31 H LYS 31 13.226 3.754 -7.858 243 HA LYS 31 HA LYS 31 13.859 6.518 -8.564 244 HB2 LYS 31 HB2 LYS 31 13.950 3.902 -10.141 245 HB3 LYS 31 HB3 LYS 31 14.075 5.485 -10.921 246 HG2 LYS 31 HG2 LYS 31 15.957 4.404 -8.771 247 HG3 LYS 31 HG3 LYS 31 16.296 4.469 -10.505 248 HD2 LYS 31 HD2 LYS 31 16.891 6.657 -10.401 249 HD3 LYS 31 HD3 LYS 31 15.413 7.093 -9.532 250 HE2 LYS 31 HE2 LYS 31 17.407 5.556 -7.921 251 HE3 LYS 31 HE3 LYS 31 17.960 7.149 -8.456 252 HZ1 LYS 31 HZ1 LYS 31 16.635 6.898 -6.279 253 HZ2 LYS 31 HZ2 LYS 31 16.338 8.180 -7.246 254 HZ3 LYS 31 HZ3 LYS 31 15.315 6.907 -7.240 255 H MET 32 H MET 32 11.200 4.128 -8.566 256 HA MET 32 HA MET 32 9.902 5.242 -10.782 257 HB2 MET 32 HB2 MET 32 9.066 3.647 -8.324 258 HB3 MET 32 HB3 MET 32 7.846 4.227 -9.465 259 HG2 MET 32 HG2 MET 32 9.681 2.888 -11.103 260 HG3 MET 32 HG3 MET 32 9.641 1.907 -9.632 261 HE1 MET 32 HE1 MET 32 5.887 3.473 -11.640 262 HE2 MET 32 HE2 MET 32 7.566 4.091 -11.789 263 HE3 MET 32 HE3 MET 32 6.978 2.811 -12.903 264 H LYS 33 H LYS 33 8.461 5.461 -7.378 265 HA LYS 33 HA LYS 33 8.561 8.064 -6.930 266 HB2 LYS 33 HB2 LYS 33 6.842 7.826 -9.301 267 HB3 LYS 33 HB3 LYS 33 6.218 8.825 -7.981 268 HG2 LYS 33 HG2 LYS 33 8.132 10.287 -8.032 269 HG3 LYS 33 HG3 LYS 33 9.074 9.159 -9.016 270 HD2 LYS 33 HD2 LYS 33 7.084 9.438 -10.750 271 HD3 LYS 33 HD3 LYS 33 6.733 10.910 -9.833 272 HE2 LYS 33 HE2 LYS 33 9.021 11.752 -10.239 273 HE3 LYS 33 HE3 LYS 33 9.454 10.251 -11.069 274 HZ1 LYS 33 HZ1 LYS 33 8.845 11.974 -12.620 275 HZ2 LYS 33 HZ2 LYS 33 7.764 10.755 -12.719 276 HZ3 LYS 33 HZ3 LYS 33 7.364 12.141 -11.954 277 H MET 34 H MET 34 6.107 8.925 -5.972 278 HA MET 34 HA MET 34 5.531 7.028 -3.909 279 HB2 MET 34 HB2 MET 34 5.288 9.499 -3.690 280 HB3 MET 34 HB3 MET 34 4.117 9.527 -5.015 281 HG2 MET 34 HG2 MET 34 2.529 8.191 -3.624 282 HG3 MET 34 HG3 MET 34 3.697 8.199 -2.296 283 HE1 MET 34 HE1 MET 34 1.383 11.915 -3.869 284 HE2 MET 34 HE2 MET 34 2.863 11.385 -4.737 285 HE3 MET 34 HE3 MET 34 1.441 10.293 -4.638 286 H ALA 35 H ALA 35 3.114 6.284 -3.604 287 HA ALA 35 HA ALA 35 2.012 5.477 -6.204 288 HB1 ALA 35 HB1 ALA 35 1.468 3.273 -5.210 289 HB2 ALA 35 HB2 ALA 35 3.235 3.587 -5.291 290 HB3 ALA 35 HB3 ALA 35 2.365 3.743 -3.727 291 H MET 36 H MET 36 -0.332 4.521 -5.949 292 HA MET 36 HA MET 36 -1.727 6.276 -4.007 293 HB2 MET 36 HB2 MET 36 -2.344 5.469 -6.919 294 HB3 MET 36 HB3 MET 36 -3.536 6.235 -5.860 295 HG2 MET 36 HG2 MET 36 -0.929 7.665 -6.320 296 HG3 MET 36 HG3 MET 36 -2.098 7.605 -7.646 297 HE1 MET 36 HE1 MET 36 -2.347 11.203 -5.812 298 HE2 MET 36 HE2 MET 36 -0.899 10.144 -5.719 299 HE3 MET 36 HE3 MET 36 -1.765 10.346 -7.279 300 H ALA 37 H ALA 37 -3.979 5.361 -3.534 301 HA ALA 37 HA ALA 37 -4.461 2.622 -4.221 302 HB1 ALA 37 HB1 ALA 37 -4.374 1.870 -1.829 303 HB2 ALA 37 HB2 ALA 37 -2.758 2.397 -2.410 304 HB3 ALA 37 HB3 ALA 37 -3.733 3.480 -1.360 305 H ARG 38 H ARG 38 -6.590 2.201 -4.144 306 HA ARG 38 HA ARG 38 -8.304 4.015 -2.550 307 HB2 ARG 38 HB2 ARG 38 -8.560 4.668 -4.851 308 HB3 ARG 38 HB3 ARG 38 -8.550 2.990 -5.411 309 HG2 ARG 38 HG2 ARG 38 -10.735 2.907 -3.765 310 HG3 ARG 38 HG3 ARG 38 -10.784 4.611 -4.239 311 HD2 ARG 38 HD2 ARG 38 -10.833 4.025 -6.615 312 HD3 ARG 38 HD3 ARG 38 -10.530 2.320 -6.256 313 HE ARG 38 HE ARG 38 -12.774 2.115 -5.411 314 HH11 ARG 38 HH11 ARG 38 -12.084 5.304 -6.718 315 HH12 ARG 38 HH12 ARG 38 -13.754 5.727 -6.895 316 HH21 ARG 38 HH21 ARG 38 -14.964 2.680 -5.662 317 HH22 ARG 38 HH22 ARG 38 -15.391 4.235 -6.295 318 H ILE 39 H ILE 39 -9.613 2.766 -1.120 319 HA ILE 39 HA ILE 39 -9.606 -0.124 -1.689 320 HB ILE 39 HB ILE 39 -10.303 1.394 0.870 321 HG12 ILE 39 HG12 ILE 39 -7.974 1.817 0.411 322 HG13 ILE 39 HG13 ILE 39 -8.117 0.700 1.774 323 HG21 ILE 39 HG21 ILE 39 -10.016 -0.800 1.988 324 HG22 ILE 39 HG22 ILE 39 -11.329 -0.814 0.762 325 HG23 ILE 39 HG23 ILE 39 -9.740 -1.562 0.385 326 HD11 ILE 39 HD11 ILE 39 -6.301 0.031 0.270 327 HD12 ILE 39 HD12 ILE 39 -7.601 -1.208 0.284 328 HD13 ILE 39 HD13 ILE 39 -7.456 -0.073 -1.101 329 H SER 40 H SER 40 -11.579 -1.095 -2.136 330 HA SER 40 HA SER 40 -14.018 0.429 -1.524 331 HB2 SER 40 HB2 SER 40 -13.337 -1.000 -4.152 332 HB3 SER 40 HB3 SER 40 -14.888 -0.249 -3.757 333 HG SER 40 HG SER 40 -14.073 1.724 -4.114 334 H PHE 41 H PHE 41 -15.504 -0.755 -0.475 335 HA PHE 41 HA PHE 41 -14.913 -3.481 0.140 336 HB2 PHE 41 HB2 PHE 41 -17.033 -3.369 1.423 337 HB3 PHE 41 HB3 PHE 41 -15.882 -2.092 1.842 338 HD1 PHE 41 HD1 PHE 41 -16.337 0.247 1.296 339 HD2 PHE 41 HD2 PHE 41 -19.134 -2.850 0.285 340 HE1 PHE 41 HE1 PHE 41 -18.086 1.957 0.911 341 HE2 PHE 41 HE2 PHE 41 -20.885 -1.144 -0.108 342 HZ PHE 41 HZ PHE 41 -20.364 1.265 0.205 343 H LEU 42 H LEU 42 -15.528 -5.286 -0.981 344 HA LEU 42 HA LEU 42 -17.434 -4.880 -3.159 345 HB2 LEU 42 HB2 LEU 42 -15.150 -6.026 -3.416 346 HB3 LEU 42 HB3 LEU 42 -15.758 -7.326 -2.383 347 HG LEU 42 HG LEU 42 -15.794 -7.931 -4.759 348 HD11 LEU 42 HD11 LEU 42 -18.130 -8.720 -4.903 349 HD12 LEU 42 HD12 LEU 42 -17.431 -8.963 -3.267 350 HD13 LEU 42 HD13 LEU 42 -18.579 -7.614 -3.562 351 HD21 LEU 42 HD21 LEU 42 -17.392 -6.850 -6.313 352 HD22 LEU 42 HD22 LEU 42 -17.792 -5.641 -5.046 353 HD23 LEU 42 HD23 LEU 42 -16.134 -5.707 -5.732 354 H GLY 43 H GLY 43 -16.833 -7.004 -0.300 355 HA2 GLY 43 HA2 GLY 43 -19.681 -7.523 0.009 356 HA3 GLY 43 HA3 GLY 43 -18.648 -8.907 -0.374 357 H GLU 44 H GLU 44 -19.913 -9.069 2.060 358 HA GLU 44 HA GLU 44 -18.649 -7.853 4.219 359 HB2 GLU 44 HB2 GLU 44 -19.923 -10.615 3.909 360 HB3 GLU 44 HB3 GLU 44 -19.430 -9.925 5.462 361 HG2 GLU 44 HG2 GLU 44 -20.956 -7.924 4.883 362 HG3 GLU 44 HG3 GLU 44 -21.592 -8.923 3.570 363 H ASP 45 H ASP 45 -17.639 -10.706 2.182 364 HA ASP 45 HA ASP 45 -15.270 -10.939 3.898 365 HB2 ASP 45 HB2 ASP 45 -16.625 -13.003 3.821 366 HB3 ASP 45 HB3 ASP 45 -16.613 -12.988 2.052 367 H GLU 46 H GLU 46 -16.255 -9.806 0.746 368 HA GLU 46 HA GLU 46 -13.453 -10.173 -0.161 369 HB2 GLU 46 HB2 GLU 46 -15.054 -11.482 -1.515 370 HB3 GLU 46 HB3 GLU 46 -16.037 -10.037 -1.788 371 HG2 GLU 46 HG2 GLU 46 -14.218 -8.973 -3.042 372 HG3 GLU 46 HG3 GLU 46 -13.127 -10.315 -2.670 373 H LEU 47 H LEU 47 -12.509 -8.427 -1.203 374 HA LEU 47 HA LEU 47 -13.825 -5.846 -1.086 375 HB2 LEU 47 HB2 LEU 47 -12.124 -4.835 0.282 376 HB3 LEU 47 HB3 LEU 47 -12.844 -6.187 1.166 377 HG LEU 47 HG LEU 47 -10.259 -6.542 -0.381 378 HD11 LEU 47 HD11 LEU 47 -9.046 -6.032 1.699 379 HD12 LEU 47 HD12 LEU 47 -9.946 -4.604 1.086 380 HD13 LEU 47 HD13 LEU 47 -10.588 -5.539 2.478 381 HD21 LEU 47 HD21 LEU 47 -9.921 -8.319 1.296 382 HD22 LEU 47 HD22 LEU 47 -11.492 -7.899 2.058 383 HD23 LEU 47 HD23 LEU 47 -11.450 -8.549 0.384 384 H LYS 48 H LYS 48 -12.897 -4.246 -2.390 385 HA LYS 48 HA LYS 48 -10.878 -5.288 -4.257 386 HB2 LYS 48 HB2 LYS 48 -13.504 -4.451 -4.794 387 HB3 LYS 48 HB3 LYS 48 -12.484 -3.097 -5.298 388 HG2 LYS 48 HG2 LYS 48 -11.117 -4.609 -6.699 389 HG3 LYS 48 HG3 LYS 48 -12.054 -6.003 -6.146 390 HD2 LYS 48 HD2 LYS 48 -14.146 -4.826 -7.036 391 HD3 LYS 48 HD3 LYS 48 -13.076 -3.616 -7.757 392 HE2 LYS 48 HE2 LYS 48 -12.969 -6.622 -8.320 393 HE3 LYS 48 HE3 LYS 48 -13.744 -5.419 -9.359 394 HZ1 LYS 48 HZ1 LYS 48 -11.785 -5.108 -10.285 395 HZ2 LYS 48 HZ2 LYS 48 -11.162 -4.548 -8.883 396 HZ3 LYS 48 HZ3 LYS 48 -11.047 -6.135 -9.251 397 H VAL 49 H VAL 49 -9.053 -4.029 -4.705 398 HA VAL 49 HA VAL 49 -9.053 -1.361 -3.471 399 HB VAL 49 HB VAL 49 -6.684 -1.701 -2.825 400 HG11 VAL 49 HG11 VAL 49 -7.122 -3.173 -0.887 401 HG12 VAL 49 HG12 VAL 49 -8.478 -2.032 -1.182 402 HG13 VAL 49 HG13 VAL 49 -8.629 -3.753 -1.674 403 HG21 VAL 49 HG21 VAL 49 -5.744 -3.985 -2.767 404 HG22 VAL 49 HG22 VAL 49 -7.196 -4.600 -3.627 405 HG23 VAL 49 HG23 VAL 49 -6.090 -3.445 -4.445 406 H SER 50 H SER 50 -8.091 0.261 -4.781 407 HA SER 50 HA SER 50 -7.139 -0.706 -7.393 408 HB2 SER 50 HB2 SER 50 -7.965 2.150 -6.692 409 HB3 SER 50 HB3 SER 50 -7.924 1.375 -8.281 410 HG SER 50 HG SER 50 -10.023 1.120 -7.900 411 H TYR 51 H TYR 51 -5.006 -0.220 -8.044 412 HA TYR 51 HA TYR 51 -3.531 1.528 -6.163 413 HB2 TYR 51 HB2 TYR 51 -2.896 -0.924 -7.887 414 HB3 TYR 51 HB3 TYR 51 -1.604 0.200 -7.444 415 HD1 TYR 51 HD1 TYR 51 -2.218 0.820 -4.635 416 HD2 TYR 51 HD2 TYR 51 -2.437 -2.932 -6.719 417 HE1 TYR 51 HE1 TYR 51 -1.789 -0.377 -2.518 418 HE2 TYR 51 HE2 TYR 51 -2.039 -4.136 -4.584 419 HH TYR 51 HH TYR 51 -1.628 -3.974 -2.431 420 H ALA 52 H ALA 52 -2.493 3.332 -7.186 421 HA ALA 52 HA ALA 52 -2.462 3.330 -10.145 422 HB1 ALA 52 HB1 ALA 52 -2.915 5.748 -10.032 423 HB2 ALA 52 HB2 ALA 52 -4.262 4.791 -9.330 424 HB3 ALA 52 HB3 ALA 52 -3.100 5.633 -8.250 425 H VAL 53 H VAL 53 -0.398 3.523 -10.896 426 HA VAL 53 HA VAL 53 1.490 4.923 -9.169 427 HB VAL 53 HB VAL 53 3.248 3.252 -9.861 428 HG11 VAL 53 HG11 VAL 53 2.532 1.476 -8.291 429 HG12 VAL 53 HG12 VAL 53 2.186 3.119 -7.654 430 HG13 VAL 53 HG13 VAL 53 0.857 2.121 -8.336 431 HG21 VAL 53 HG21 VAL 53 2.527 1.046 -10.715 432 HG22 VAL 53 HG22 VAL 53 0.849 1.666 -10.881 433 HG23 VAL 53 HG23 VAL 53 2.169 2.370 -11.875 434 HA PRO 54 HA PRO 54 2.583 6.861 -13.016 435 HB2 PRO 54 HB2 PRO 54 4.923 8.072 -12.244 436 HB3 PRO 54 HB3 PRO 54 3.400 8.596 -11.514 437 HG2 PRO 54 HG2 PRO 54 5.512 6.735 -10.401 438 HG3 PRO 54 HG3 PRO 54 4.606 8.011 -9.578 439 HD2 PRO 54 HD2 PRO 54 3.948 5.314 -9.418 440 HD3 PRO 54 HD3 PRO 54 2.782 6.618 -9.160 441 H LYS 55 H LYS 55 2.898 5.250 -14.456 442 HA LYS 55 HA LYS 55 5.470 3.850 -14.486 443 HB2 LYS 55 HB2 LYS 55 3.443 2.479 -14.626 444 HB3 LYS 55 HB3 LYS 55 2.875 3.407 -16.020 445 HG2 LYS 55 HG2 LYS 55 4.880 2.652 -17.321 446 HG3 LYS 55 HG3 LYS 55 5.408 1.695 -15.931 447 HD2 LYS 55 HD2 LYS 55 3.423 0.291 -16.034 448 HD3 LYS 55 HD3 LYS 55 2.658 1.355 -17.222 449 HE2 LYS 55 HE2 LYS 55 3.460 -0.426 -18.537 450 HE3 LYS 55 HE3 LYS 55 4.692 0.824 -18.757 451 HZ1 LYS 55 HZ1 LYS 55 5.668 -1.312 -18.314 452 HZ2 LYS 55 HZ2 LYS 55 6.026 -0.294 -17.089 453 HZ3 LYS 55 HZ3 LYS 55 4.888 -1.447 -16.887 454 HA PRO 56 HA PRO 56 7.275 6.643 -17.458 455 HB2 PRO 56 HB2 PRO 56 7.901 3.983 -18.865 456 HB3 PRO 56 HB3 PRO 56 9.006 5.325 -18.539 457 HG2 PRO 56 HG2 PRO 56 9.073 3.102 -17.027 458 HG3 PRO 56 HG3 PRO 56 9.344 4.692 -16.303 459 HD2 PRO 56 HD2 PRO 56 6.967 2.884 -16.054 460 HD3 PRO 56 HD3 PRO 56 7.538 4.137 -14.944 461 H ASN 57 H ASN 57 5.304 3.814 -18.605 462 HA ASN 57 HA ASN 57 4.765 5.095 -21.110 463 HB2 ASN 57 HB2 ASN 57 3.281 2.771 -19.768 464 HB3 ASN 57 HB3 ASN 57 3.301 3.168 -21.491 465 HD21 ASN 57 HD21 ASN 57 5.093 2.585 -22.764 466 HD22 ASN 57 HD22 ASN 57 6.344 1.535 -22.189 467 H GLY 58 H GLY 58 3.697 5.923 -18.012 468 HA2 GLY 58 HA2 GLY 58 2.092 7.815 -18.177 469 HA3 GLY 58 HA3 GLY 58 1.028 6.691 -19.032 470 H CYS 59 H CYS 59 0.141 7.937 -16.627 471 HA CYS 59 HA CYS 59 0.660 6.589 -14.273 472 HB2 CYS 59 HB2 CYS 59 -1.925 7.829 -15.324 473 HB3 CYS 59 HB3 CYS 59 -1.691 7.289 -13.656 474 H ARG 60 H ARG 60 0.456 4.434 -13.747 475 HA ARG 60 HA ARG 60 -1.398 2.832 -15.363 476 HB2 ARG 60 HB2 ARG 60 1.149 2.326 -14.948 477 HB3 ARG 60 HB3 ARG 60 0.610 1.776 -13.356 478 HG2 ARG 60 HG2 ARG 60 -0.876 0.719 -15.754 479 HG3 ARG 60 HG3 ARG 60 0.776 0.141 -15.502 480 HD2 ARG 60 HD2 ARG 60 0.174 -1.150 -13.735 481 HD3 ARG 60 HD3 ARG 60 -0.746 0.160 -12.983 482 HE ARG 60 HE ARG 60 -2.701 -0.625 -14.010 483 HH11 ARG 60 HH11 ARG 60 0.075 -2.377 -15.277 484 HH12 ARG 60 HH12 ARG 60 -0.896 -3.588 -16.045 485 HH21 ARG 60 HH21 ARG 60 -3.949 -2.211 -15.006 486 HH22 ARG 60 HH22 ARG 60 -3.192 -3.493 -15.890 487 H LYS 61 H LYS 61 -3.118 1.682 -14.435 488 HA LYS 61 HA LYS 61 -3.473 2.069 -11.539 489 HB2 LYS 61 HB2 LYS 61 -5.751 2.671 -11.830 490 HB3 LYS 61 HB3 LYS 61 -4.858 3.671 -12.984 491 HG2 LYS 61 HG2 LYS 61 -5.907 2.755 -14.779 492 HG3 LYS 61 HG3 LYS 61 -5.746 1.106 -14.161 493 HD2 LYS 61 HD2 LYS 61 -7.621 1.721 -12.471 494 HD3 LYS 61 HD3 LYS 61 -7.881 3.173 -13.447 495 HE2 LYS 61 HE2 LYS 61 -9.429 1.517 -14.255 496 HE3 LYS 61 HE3 LYS 61 -8.166 1.670 -15.484 497 HZ1 LYS 61 HZ1 LYS 61 -8.806 -0.637 -14.850 498 HZ2 LYS 61 HZ2 LYS 61 -7.203 -0.335 -14.768 499 HZ3 LYS 61 HZ3 LYS 61 -8.091 -0.410 -13.400 500 H TRP 62 H TRP 62 -4.827 0.387 -10.528 501 HA TRP 62 HA TRP 62 -5.661 -1.835 -12.155 502 HB2 TRP 62 HB2 TRP 62 -3.046 -1.982 -11.566 503 HB3 TRP 62 HB3 TRP 62 -3.639 -2.444 -9.965 504 HD1 TRP 62 HD1 TRP 62 -2.889 -5.004 -10.083 505 HE1 TRP 62 HE1 TRP 62 -3.681 -7.025 -11.492 506 HE3 TRP 62 HE3 TRP 62 -5.747 -2.502 -13.541 507 HZ2 TRP 62 HZ2 TRP 62 -5.300 -7.506 -13.747 508 HZ3 TRP 62 HZ3 TRP 62 -6.895 -3.816 -15.306 509 HH2 TRP 62 HH2 TRP 62 -6.673 -6.281 -15.405 510 H GLU 63 H GLU 63 -7.150 -3.226 -10.920 511 HA GLU 63 HA GLU 63 -7.380 -2.441 -8.091 512 HB2 GLU 63 HB2 GLU 63 -9.853 -2.508 -8.399 513 HB3 GLU 63 HB3 GLU 63 -9.074 -1.148 -9.218 514 HG2 GLU 63 HG2 GLU 63 -10.195 -3.682 -10.508 515 HG3 GLU 63 HG3 GLU 63 -10.856 -2.045 -10.615 516 H THR 64 H THR 64 -7.316 -4.239 -6.876 517 HA THR 64 HA THR 64 -8.007 -6.761 -8.204 518 HB THR 64 HB THR 64 -6.381 -7.639 -6.285 519 HG1 THR 64 HG1 THR 64 -5.145 -6.143 -5.367 520 HG21 THR 64 HG21 THR 64 -4.474 -7.567 -7.875 521 HG22 THR 64 HG22 THR 64 -6.016 -8.000 -8.687 522 HG23 THR 64 HG23 THR 64 -5.349 -6.341 -8.852 523 H THR 65 H THR 65 -9.236 -8.269 -6.961 524 HA THR 65 HA THR 65 -10.426 -7.063 -4.541 525 HB THR 65 HB THR 65 -11.372 -9.559 -5.948 526 HG1 THR 65 HG1 THR 65 -12.209 -8.403 -7.670 527 HG21 THR 65 HG21 THR 65 -13.595 -8.669 -5.357 528 HG22 THR 65 HG22 THR 65 -12.523 -8.802 -3.923 529 HG23 THR 65 HG23 THR 65 -12.822 -7.199 -4.674 530 H PHE 66 H PHE 66 -9.753 -7.861 -2.600 531 HA PHE 66 HA PHE 66 -8.260 -10.398 -2.647 532 HB2 PHE 66 HB2 PHE 66 -8.241 -8.044 -0.677 533 HB3 PHE 66 HB3 PHE 66 -7.295 -9.527 -0.488 534 HD1 PHE 66 HD1 PHE 66 -6.366 -9.908 -3.327 535 HD2 PHE 66 HD2 PHE 66 -6.583 -6.394 -0.869 536 HE1 PHE 66 HE1 PHE 66 -4.515 -8.897 -4.613 537 HE2 PHE 66 HE2 PHE 66 -4.724 -5.377 -2.153 538 HZ PHE 66 HZ PHE 66 -3.686 -6.632 -4.029 539 H LYS 67 H LYS 67 -8.405 -11.458 -0.212 540 HA LYS 67 HA LYS 67 -11.298 -11.313 0.349 541 HB2 LYS 67 HB2 LYS 67 -9.191 -13.490 0.276 542 HB3 LYS 67 HB3 LYS 67 -10.501 -13.636 1.455 543 HG2 LYS 67 HG2 LYS 67 -10.960 -14.933 -0.589 544 HG3 LYS 67 HG3 LYS 67 -12.179 -13.678 -0.328 545 HD2 LYS 67 HD2 LYS 67 -10.789 -12.200 -1.943 546 HD3 LYS 67 HD3 LYS 67 -9.888 -13.667 -2.347 547 HE2 LYS 67 HE2 LYS 67 -11.984 -14.801 -3.043 548 HE3 LYS 67 HE3 LYS 67 -12.934 -13.389 -2.562 549 HZ1 LYS 67 HZ1 LYS 67 -12.601 -12.647 -4.598 550 HZ2 LYS 67 HZ2 LYS 67 -11.011 -12.452 -4.282 551 HZ3 LYS 67 HZ3 LYS 67 -11.543 -13.835 -4.966 552 H LYS 68 H LYS 68 -11.913 -10.739 2.326 553 HA LYS 68 HA LYS 68 -10.033 -9.731 4.112 554 HB2 LYS 68 HB2 LYS 68 -12.413 -8.943 3.845 555 HB3 LYS 68 HB3 LYS 68 -12.969 -10.444 4.597 556 HG2 LYS 68 HG2 LYS 68 -12.025 -9.859 6.729 557 HG3 LYS 68 HG3 LYS 68 -11.040 -8.565 6.033 558 HD2 LYS 68 HD2 LYS 68 -12.872 -7.466 7.121 559 HD3 LYS 68 HD3 LYS 68 -13.223 -7.375 5.391 560 HE2 LYS 68 HE2 LYS 68 -14.713 -9.386 5.605 561 HE3 LYS 68 HE3 LYS 68 -14.385 -9.428 7.342 562 HZ1 LYS 68 HZ1 LYS 68 -15.921 -7.891 7.638 563 HZ2 LYS 68 HZ2 LYS 68 -15.233 -6.855 6.580 564 HZ3 LYS 68 HZ3 LYS 68 -16.314 -7.960 6.055 565 H THR 69 H THR 69 -8.546 -11.009 5.158 566 HA THR 69 HA THR 69 -9.806 -13.138 6.836 567 HB THR 69 HB THR 69 -7.034 -13.072 5.664 568 HG1 THR 69 HG1 THR 69 -8.023 -14.700 3.953 569 HG21 THR 69 HG21 THR 69 -7.081 -15.555 5.729 570 HG22 THR 69 HG22 THR 69 -7.316 -14.765 7.325 571 HG23 THR 69 HG23 THR 69 -8.722 -15.466 6.454 572 H SER 70 H SER 70 -9.879 -11.317 8.296 573 HA SER 70 HA SER 70 -7.497 -9.849 8.915 574 HB2 SER 70 HB2 SER 70 -9.713 -9.675 10.840 575 HB3 SER 70 HB3 SER 70 -8.996 -8.409 9.834 576 HG SER 70 HG SER 70 -11.245 -8.794 9.304 577 H ASP 71 H ASP 71 -6.292 -12.018 9.284 578 HA ASP 71 HA ASP 71 -6.744 -13.600 11.496 579 HB2 ASP 71 HB2 ASP 71 -4.990 -13.985 9.797 580 HB3 ASP 71 HB3 ASP 71 -4.117 -12.546 10.339 581 H ASP 72 H ASP 72 -4.441 -10.757 11.395 582 HA ASP 72 HA ASP 72 -4.658 -10.499 14.302 583 HB2 ASP 72 HB2 ASP 72 -2.587 -10.233 12.550 584 HB3 ASP 72 HB3 ASP 72 -3.180 -8.568 12.499 585 H GLY 73 H GLY 73 -7.004 -9.939 12.474 586 HA2 GLY 73 HA2 GLY 73 -8.791 -8.593 12.489 587 HA3 GLY 73 HA3 GLY 73 -8.022 -7.610 13.742 588 H GLU 74 H GLU 74 -5.557 -6.817 12.242 589 HA GLU 74 HA GLU 74 -6.910 -5.207 10.143 590 HB2 GLU 74 HB2 GLU 74 -4.386 -4.733 11.825 591 HB3 GLU 74 HB3 GLU 74 -4.945 -3.669 10.527 592 HG2 GLU 74 HG2 GLU 74 -6.141 -4.108 13.272 593 HG3 GLU 74 HG3 GLU 74 -5.603 -2.602 12.517 594 H VAL 75 H VAL 75 -6.215 -7.801 9.521 595 HA VAL 75 HA VAL 75 -4.022 -7.385 7.665 596 HB VAL 75 HB VAL 75 -4.257 -9.765 9.538 597 HG11 VAL 75 HG11 VAL 75 -2.222 -10.613 8.418 598 HG12 VAL 75 HG12 VAL 75 -3.626 -10.505 7.302 599 HG13 VAL 75 HG13 VAL 75 -2.326 -9.267 7.233 600 HG21 VAL 75 HG21 VAL 75 -1.981 -9.066 10.287 601 HG22 VAL 75 HG22 VAL 75 -2.090 -7.623 9.223 602 HG23 VAL 75 HG23 VAL 75 -3.218 -7.804 10.608 603 H TYR 76 H TYR 76 -4.586 -8.069 5.681 604 HA TYR 76 HA TYR 76 -7.014 -9.681 5.357 605 HB2 TYR 76 HB2 TYR 76 -6.034 -7.504 3.544 606 HB3 TYR 76 HB3 TYR 76 -7.268 -8.698 3.121 607 HD1 TYR 76 HD1 TYR 76 -6.454 -6.272 5.862 608 HD2 TYR 76 HD2 TYR 76 -9.521 -8.127 3.501 609 HE1 TYR 76 HE1 TYR 76 -8.133 -4.787 6.889 610 HE2 TYR 76 HE2 TYR 76 -11.209 -6.612 4.500 611 HH TYR 76 HH TYR 76 -10.246 -4.166 6.964 612 H TYR 77 H TYR 77 -6.810 -10.627 2.824 613 HA TYR 77 HA TYR 77 -4.226 -11.826 2.585 614 HB2 TYR 77 HB2 TYR 77 -6.476 -13.415 3.651 615 HB3 TYR 77 HB3 TYR 77 -5.409 -14.184 2.469 616 HD1 TYR 77 HD1 TYR 77 -2.821 -14.115 2.942 617 HD2 TYR 77 HD2 TYR 77 -5.816 -13.113 5.846 618 HE1 TYR 77 HE1 TYR 77 -1.226 -14.636 4.773 619 HE2 TYR 77 HE2 TYR 77 -4.224 -13.568 7.664 620 HH TYR 77 HH TYR 77 -2.219 -14.270 8.222 621 H SER 78 H SER 78 -3.671 -13.088 0.768 622 HA SER 78 HA SER 78 -5.476 -12.612 -1.514 623 HB2 SER 78 HB2 SER 78 -2.525 -12.031 -1.559 624 HB3 SER 78 HB3 SER 78 -3.536 -12.198 -3.000 625 HG SER 78 HG SER 78 -4.593 -10.359 -2.526 626 H GLU 79 H GLU 79 -6.538 -14.821 -1.856 627 HA GLU 79 HA GLU 79 -4.423 -16.858 -1.904 628 HB2 GLU 79 HB2 GLU 79 -6.937 -17.083 -1.079 629 HB3 GLU 79 HB3 GLU 79 -7.355 -17.182 -2.795 630 HG2 GLU 79 HG2 GLU 79 -5.608 -19.087 -1.193 631 HG3 GLU 79 HG3 GLU 79 -7.186 -19.418 -1.920 632 H GLU 80 H GLU 80 -6.800 -15.650 -4.315 633 HA GLU 80 HA GLU 80 -5.763 -17.158 -6.505 634 HB2 GLU 80 HB2 GLU 80 -7.492 -14.660 -6.687 635 HB3 GLU 80 HB3 GLU 80 -7.400 -16.021 -7.813 636 HG2 GLU 80 HG2 GLU 80 -8.643 -17.461 -6.341 637 HG3 GLU 80 HG3 GLU 80 -8.466 -16.352 -4.975 638 H ALA 81 H ALA 81 -4.901 -14.263 -4.810 639 HA ALA 81 HA ALA 81 -3.470 -13.274 -7.144 640 HB1 ALA 81 HB1 ALA 81 -3.262 -11.184 -5.795 641 HB2 ALA 81 HB2 ALA 81 -4.973 -11.667 -6.053 642 HB3 ALA 81 HB3 ALA 81 -4.182 -11.972 -4.469 643 H LYS 82 H LYS 82 -2.750 -15.145 -4.172 644 HA LYS 82 HA LYS 82 -0.711 -15.765 -3.303 645 HB2 LYS 82 HB2 LYS 82 0.432 -14.749 -5.927 646 HB3 LYS 82 HB3 LYS 82 1.214 -15.836 -4.772 647 HG2 LYS 82 HG2 LYS 82 -1.245 -16.394 -6.500 648 HG3 LYS 82 HG3 LYS 82 0.323 -17.210 -6.549 649 HD2 LYS 82 HD2 LYS 82 -0.057 -18.228 -4.351 650 HD3 LYS 82 HD3 LYS 82 -1.520 -17.266 -4.100 651 HE2 LYS 82 HE2 LYS 82 -2.597 -18.374 -6.059 652 HE3 LYS 82 HE3 LYS 82 -1.130 -19.321 -6.339 653 HZ1 LYS 82 HZ1 LYS 82 -2.343 -20.744 -5.095 654 HZ2 LYS 82 HZ2 LYS 82 -1.559 -19.997 -3.873 655 HZ3 LYS 82 HZ3 LYS 82 -3.101 -19.591 -4.223 656 H LYS 83 H LYS 83 -1.550 -13.734 -1.975 657 HA LYS 83 HA LYS 83 0.682 -12.023 -1.527 658 HB2 LYS 83 HB2 LYS 83 -1.851 -10.665 -2.479 659 HB3 LYS 83 HB3 LYS 83 -0.396 -9.877 -1.857 660 HG2 LYS 83 HG2 LYS 83 0.894 -10.468 -3.745 661 HG3 LYS 83 HG3 LYS 83 -0.193 -11.784 -4.206 662 HD2 LYS 83 HD2 LYS 83 -2.010 -9.926 -4.440 663 HD3 LYS 83 HD3 LYS 83 -0.656 -8.789 -4.411 664 HE2 LYS 83 HE2 LYS 83 0.393 -10.206 -6.290 665 HE3 LYS 83 HE3 LYS 83 -1.167 -11.029 -6.410 666 HZ1 LYS 83 HZ1 LYS 83 -1.055 -9.192 -7.926 667 HZ2 LYS 83 HZ2 LYS 83 -2.185 -8.861 -6.795 668 HZ3 LYS 83 HZ3 LYS 83 -0.728 -8.129 -6.731 669 H LYS 84 H LYS 84 0.587 -10.809 0.535 670 HA LYS 84 HA LYS 84 -1.882 -11.291 2.061 671 HB2 LYS 84 HB2 LYS 84 -1.125 -12.749 3.453 672 HB3 LYS 84 HB3 LYS 84 0.345 -12.906 2.482 673 HG2 LYS 84 HG2 LYS 84 1.096 -12.465 4.681 674 HG3 LYS 84 HG3 LYS 84 1.300 -10.939 3.811 675 HD2 LYS 84 HD2 LYS 84 -0.578 -9.934 4.866 676 HD3 LYS 84 HD3 LYS 84 -1.268 -11.491 5.343 677 HE2 LYS 84 HE2 LYS 84 -0.155 -10.153 7.214 678 HE3 LYS 84 HE3 LYS 84 0.373 -11.833 7.051 679 HZ1 LYS 84 HZ1 LYS 84 2.421 -11.136 6.680 680 HZ2 LYS 84 HZ2 LYS 84 1.978 -10.124 5.478 681 HZ3 LYS 84 HZ3 LYS 84 1.959 -9.609 7.027 682 H VAL 85 H VAL 85 -2.334 -9.528 3.642 683 HA VAL 85 HA VAL 85 -0.241 -7.483 3.680 684 HB VAL 85 HB VAL 85 -2.005 -5.679 3.459 685 HG11 VAL 85 HG11 VAL 85 -2.191 -5.851 1.008 686 HG12 VAL 85 HG12 VAL 85 -0.545 -6.274 1.589 687 HG13 VAL 85 HG13 VAL 85 -1.683 -7.572 1.093 688 HG21 VAL 85 HG21 VAL 85 -4.166 -6.281 2.433 689 HG22 VAL 85 HG22 VAL 85 -3.751 -8.021 2.587 690 HG23 VAL 85 HG23 VAL 85 -3.967 -7.016 4.060 691 H GLU 86 H GLU 86 -0.231 -6.087 5.571 692 HA GLU 86 HA GLU 86 -2.210 -6.663 7.635 693 HB2 GLU 86 HB2 GLU 86 -0.568 -7.207 9.309 694 HB3 GLU 86 HB3 GLU 86 -0.361 -8.319 7.950 695 HG2 GLU 86 HG2 GLU 86 1.521 -6.852 7.114 696 HG3 GLU 86 HG3 GLU 86 1.358 -5.881 8.584 697 H VAL 87 H VAL 87 -2.758 -4.788 8.759 698 HA VAL 87 HA VAL 87 -0.987 -2.519 8.264 699 HB VAL 87 HB VAL 87 -3.187 -2.109 7.551 700 HG11 VAL 87 HG11 VAL 87 -5.126 -2.069 9.062 701 HG12 VAL 87 HG12 VAL 87 -4.435 -3.714 8.855 702 HG13 VAL 87 HG13 VAL 87 -4.114 -2.787 10.360 703 HG21 VAL 87 HG21 VAL 87 -3.723 -0.082 8.865 704 HG22 VAL 87 HG22 VAL 87 -2.582 -0.624 10.142 705 HG23 VAL 87 HG23 VAL 87 -1.971 -0.228 8.500 706 H LEU 88 H LEU 88 0.623 -2.208 9.837 707 HA LEU 88 HA LEU 88 0.194 -3.320 12.452 708 HB2 LEU 88 HB2 LEU 88 2.341 -1.440 11.343 709 HB3 LEU 88 HB3 LEU 88 2.407 -2.247 12.915 710 HG LEU 88 HG LEU 88 2.406 -3.676 10.221 711 HD11 LEU 88 HD11 LEU 88 4.800 -4.103 10.697 712 HD12 LEU 88 HD12 LEU 88 4.452 -2.348 10.544 713 HD13 LEU 88 HD13 LEU 88 4.686 -3.079 12.168 714 HD21 LEU 88 HD21 LEU 88 3.075 -5.644 11.561 715 HD22 LEU 88 HD22 LEU 88 2.894 -4.677 13.063 716 HD23 LEU 88 HD23 LEU 88 1.459 -5.026 12.041 717 H ASP 89 H ASP 89 -0.290 -0.144 10.871 718 HA ASP 89 HA ASP 89 -1.614 0.759 13.223 719 HB2 ASP 89 HB2 ASP 89 0.628 1.369 13.936 720 HB3 ASP 89 HB3 ASP 89 0.985 2.121 12.376 721 H THR 90 H THR 90 -3.187 2.297 12.746 722 HA THR 90 HA THR 90 -2.860 3.934 10.371 723 HB THR 90 HB THR 90 -3.670 1.918 9.350 724 HG1 THR 90 HG1 THR 90 -5.754 3.910 9.592 725 HG21 THR 90 HG21 THR 90 -5.873 0.959 9.940 726 HG22 THR 90 HG22 THR 90 -4.694 0.841 11.290 727 HG23 THR 90 HG23 THR 90 -5.982 2.092 11.329 728 H ASP 91 H ASP 91 -3.080 5.903 11.697 729 HA ASP 91 HA ASP 91 -5.083 5.922 13.725 730 HB2 ASP 91 HB2 ASP 91 -3.022 7.311 13.802 731 HB3 ASP 91 HB3 ASP 91 -3.619 8.259 12.433 732 H TYR 92 H TYR 92 -7.226 6.499 13.653 733 HA TYR 92 HA TYR 92 -8.563 6.510 11.246 734 HB2 TYR 92 HB2 TYR 92 -9.341 7.694 13.960 735 HB3 TYR 92 HB3 TYR 92 -10.470 7.481 12.616 736 HD1 TYR 92 HD1 TYR 92 -11.003 5.148 11.794 737 HD2 TYR 92 HD2 TYR 92 -8.711 5.825 15.365 738 HE1 TYR 92 HE1 TYR 92 -11.428 2.815 12.508 739 HE2 TYR 92 HE2 TYR 92 -9.126 3.488 16.076 740 HH TYR 92 HH TYR 92 -11.090 1.255 14.042 741 H LYS 93 H LYS 93 -6.963 9.260 12.877 742 HA LYS 93 HA LYS 93 -7.939 10.929 10.672 743 HB2 LYS 93 HB2 LYS 93 -7.346 11.961 13.466 744 HB3 LYS 93 HB3 LYS 93 -8.072 12.834 12.111 745 HG2 LYS 93 HG2 LYS 93 -10.078 11.424 12.203 746 HG3 LYS 93 HG3 LYS 93 -9.343 10.388 13.434 747 HD2 LYS 93 HD2 LYS 93 -9.062 12.694 14.754 748 HD3 LYS 93 HD3 LYS 93 -10.363 13.225 13.680 749 HE2 LYS 93 HE2 LYS 93 -10.517 10.663 15.343 750 HE3 LYS 93 HE3 LYS 93 -11.079 12.231 15.938 751 HZ1 LYS 93 HZ1 LYS 93 -12.858 10.964 14.966 752 HZ2 LYS 93 HZ2 LYS 93 -12.609 12.312 14.078 753 HZ3 LYS 93 HZ3 LYS 93 -12.090 10.864 13.529 754 H SER 94 H SER 94 -5.383 9.286 10.667 755 HA SER 94 HA SER 94 -3.661 11.600 10.075 756 HB2 SER 94 HB2 SER 94 -3.305 11.025 12.537 757 HB3 SER 94 HB3 SER 94 -3.034 9.333 12.100 758 HG SER 94 HG SER 94 -0.987 9.845 11.880 759 H TYR 95 H TYR 95 -1.295 9.600 10.206 760 HA TYR 95 HA TYR 95 -1.620 8.633 7.514 761 HB2 TYR 95 HB2 TYR 95 0.707 8.053 7.641 762 HB3 TYR 95 HB3 TYR 95 0.483 9.680 8.298 763 HD1 TYR 95 HD1 TYR 95 0.632 10.085 10.722 764 HD2 TYR 95 HD2 TYR 95 1.424 6.219 9.039 765 HE1 TYR 95 HE1 TYR 95 1.727 9.400 12.827 766 HE2 TYR 95 HE2 TYR 95 2.519 5.521 11.149 767 HH TYR 95 HH TYR 95 2.281 7.404 14.052 768 H ALA 96 H ALA 96 -0.486 6.248 7.217 769 HA ALA 96 HA ALA 96 -1.395 4.493 9.304 770 HB1 ALA 96 HB1 ALA 96 -2.810 3.091 7.912 771 HB2 ALA 96 HB2 ALA 96 -3.477 4.725 8.247 772 HB3 ALA 96 HB3 ALA 96 -2.768 4.356 6.638 773 H VAL 97 H VAL 97 0.121 2.757 9.582 774 HA VAL 97 HA VAL 97 1.916 2.473 7.294 775 HB VAL 97 HB VAL 97 3.291 1.042 8.801 776 HG11 VAL 97 HG11 VAL 97 4.057 2.897 10.240 777 HG12 VAL 97 HG12 VAL 97 3.723 3.446 8.563 778 HG13 VAL 97 HG13 VAL 97 2.548 3.799 9.875 779 HG21 VAL 97 HG21 VAL 97 2.781 1.015 11.211 780 HG22 VAL 97 HG22 VAL 97 1.222 1.847 10.889 781 HG23 VAL 97 HG23 VAL 97 1.507 0.194 10.248 782 H ILE 98 H ILE 98 2.038 0.551 6.032 783 HA ILE 98 HA ILE 98 0.233 -1.620 6.844 784 HB ILE 98 HB ILE 98 0.697 -0.590 4.000 785 HG12 ILE 98 HG12 ILE 98 -0.633 1.012 5.318 786 HG13 ILE 98 HG13 ILE 98 -1.584 0.252 4.035 787 HG21 ILE 98 HG21 ILE 98 -1.145 -2.134 3.395 788 HG22 ILE 98 HG22 ILE 98 0.265 -3.001 4.094 789 HG23 ILE 98 HG23 ILE 98 -1.201 -2.718 5.092 790 HD11 ILE 98 HD11 ILE 98 -2.885 0.438 6.107 791 HD12 ILE 98 HD12 ILE 98 -2.610 -1.286 5.686 792 HD13 ILE 98 HD13 ILE 98 -1.644 -0.514 6.989 793 H TYR 99 H TYR 99 1.304 -3.581 6.848 794 HA TYR 99 HA TYR 99 3.934 -3.682 5.523 795 HB2 TYR 99 HB2 TYR 99 3.959 -4.019 7.950 796 HB3 TYR 99 HB3 TYR 99 2.762 -5.313 7.806 797 HD1 TYR 99 HD1 TYR 99 3.380 -7.476 6.714 798 HD2 TYR 99 HD2 TYR 99 6.323 -4.437 7.475 799 HE1 TYR 99 HE1 TYR 99 5.177 -9.146 6.423 800 HE2 TYR 99 HE2 TYR 99 8.125 -6.112 7.169 801 HH TYR 99 HH TYR 99 7.752 -8.957 5.645 802 H ALA 100 H ALA 100 4.006 -4.753 3.657 803 HA ALA 100 HA ALA 100 1.762 -6.498 2.915 804 HB1 ALA 100 HB1 ALA 100 2.450 -6.086 0.601 805 HB2 ALA 100 HB2 ALA 100 2.026 -4.574 1.473 806 HB3 ALA 100 HB3 ALA 100 3.748 -4.988 1.180 807 H THR 101 H THR 101 2.179 -8.153 1.543 808 HA THR 101 HA THR 101 4.414 -9.810 2.104 809 HB THR 101 HB THR 101 2.040 -11.197 3.158 810 HG1 THR 101 HG1 THR 101 3.885 -9.434 4.608 811 HG21 THR 101 HG21 THR 101 3.998 -12.274 4.303 812 HG22 THR 101 HG22 THR 101 4.269 -12.256 2.528 813 HG23 THR 101 HG23 THR 101 5.103 -11.059 3.576 814 H ARG 102 H ARG 102 4.600 -11.796 0.891 815 HA ARG 102 HA ARG 102 2.664 -12.104 -1.129 816 HB2 ARG 102 HB2 ARG 102 4.395 -10.302 -1.995 817 HB3 ARG 102 HB3 ARG 102 4.997 -11.790 -2.737 818 HG2 ARG 102 HG2 ARG 102 2.989 -12.218 -3.857 819 HG3 ARG 102 HG3 ARG 102 2.009 -11.356 -2.663 820 HD2 ARG 102 HD2 ARG 102 2.047 -9.871 -4.473 821 HD3 ARG 102 HD3 ARG 102 3.306 -9.234 -3.406 822 HE ARG 102 HE ARG 102 4.912 -9.792 -5.003 823 HH11 ARG 102 HH11 ARG 102 1.991 -11.631 -5.625 824 HH12 ARG 102 HH12 ARG 102 2.461 -12.087 -7.229 825 HH21 ARG 102 HH21 ARG 102 5.520 -10.372 -7.131 826 HH22 ARG 102 HH22 ARG 102 4.473 -11.368 -8.086 827 H VAL 103 H VAL 103 2.947 -14.046 -2.664 828 HA VAL 103 HA VAL 103 4.725 -15.934 -1.323 829 HB VAL 103 HB VAL 103 1.904 -16.687 -2.226 830 HG11 VAL 103 HG11 VAL 103 2.572 -18.891 -1.281 831 HG12 VAL 103 HG12 VAL 103 3.656 -18.431 -2.637 832 HG13 VAL 103 HG13 VAL 103 4.216 -18.255 -0.939 833 HG21 VAL 103 HG21 VAL 103 1.575 -17.063 0.178 834 HG22 VAL 103 HG22 VAL 103 3.237 -16.470 0.511 835 HG23 VAL 103 HG23 VAL 103 1.999 -15.349 -0.150 836 H LYS 104 H LYS 104 6.231 -16.837 -2.772 837 HA LYS 104 HA LYS 104 5.268 -17.360 -5.468 838 HB2 LYS 104 HB2 LYS 104 7.488 -15.481 -4.898 839 HB3 LYS 104 HB3 LYS 104 7.709 -16.625 -6.228 840 HG2 LYS 104 HG2 LYS 104 5.338 -14.722 -5.876 841 HG3 LYS 104 HG3 LYS 104 6.684 -14.503 -7.002 842 HD2 LYS 104 HD2 LYS 104 5.143 -17.103 -7.149 843 HD3 LYS 104 HD3 LYS 104 4.342 -15.642 -7.743 844 HE2 LYS 104 HE2 LYS 104 5.432 -16.495 -9.659 845 HE3 LYS 104 HE3 LYS 104 6.503 -15.199 -9.112 846 HZ1 LYS 104 HZ1 LYS 104 7.523 -17.423 -9.687 847 HZ2 LYS 104 HZ2 LYS 104 8.010 -16.735 -8.289 848 HZ3 LYS 104 HZ3 LYS 104 6.946 -17.973 -8.262 849 H ASP 105 H ASP 105 6.436 -19.101 -6.615 850 HA ASP 105 HA ASP 105 7.017 -21.272 -5.096 851 HB2 ASP 105 HB2 ASP 105 8.681 -20.801 -7.602 852 HB3 ASP 105 HB3 ASP 105 7.793 -22.251 -7.117 853 H GLY 106 H GLY 106 8.752 -21.183 -3.301 854 HA2 GLY 106 HA2 GLY 106 11.009 -21.238 -2.877 855 HA3 GLY 106 HA3 GLY 106 11.321 -20.901 -4.585 856 H ARG 107 H ARG 107 9.094 -18.476 -3.591 857 HA ARG 107 HA ARG 107 11.202 -16.849 -2.381 858 HB2 ARG 107 HB2 ARG 107 10.746 -17.098 -5.180 859 HB3 ARG 107 HB3 ARG 107 9.663 -15.768 -4.750 860 HG2 ARG 107 HG2 ARG 107 11.342 -14.296 -4.922 861 HG3 ARG 107 HG3 ARG 107 12.281 -15.152 -3.691 862 HD2 ARG 107 HD2 ARG 107 12.229 -15.769 -6.704 863 HD3 ARG 107 HD3 ARG 107 13.564 -15.035 -5.807 864 HE ARG 107 HE ARG 107 12.779 -17.657 -4.781 865 HH11 ARG 107 HH11 ARG 107 14.827 -15.948 -7.083 866 HH12 ARG 107 HH12 ARG 107 15.935 -17.269 -7.252 867 HH21 ARG 107 HH21 ARG 107 14.223 -19.371 -5.023 868 HH22 ARG 107 HH22 ARG 107 15.590 -19.220 -6.076 869 H THR 108 H THR 108 10.367 -15.792 -0.831 870 HA THR 108 HA THR 108 7.593 -15.176 -0.690 871 HB THR 108 HB THR 108 9.224 -14.346 1.659 872 HG1 THR 108 HG1 THR 108 9.358 -16.600 2.298 873 HG21 THR 108 HG21 THR 108 7.255 -15.385 2.760 874 HG22 THR 108 HG22 THR 108 6.732 -14.212 1.504 875 HG23 THR 108 HG23 THR 108 6.666 -15.976 1.170 876 H LEU 109 H LEU 109 6.684 -13.053 -0.199 877 HA LEU 109 HA LEU 109 8.563 -10.955 -1.055 878 HB2 LEU 109 HB2 LEU 109 5.611 -11.234 -1.618 879 HB3 LEU 109 HB3 LEU 109 6.513 -9.727 -1.830 880 HG LEU 109 HG LEU 109 6.308 -10.792 -3.967 881 HD11 LEU 109 HD11 LEU 109 8.676 -11.104 -4.591 882 HD12 LEU 109 HD12 LEU 109 8.449 -9.687 -3.512 883 HD13 LEU 109 HD13 LEU 109 9.116 -11.219 -2.854 884 HD21 LEU 109 HD21 LEU 109 7.166 -13.058 -4.420 885 HD22 LEU 109 HD22 LEU 109 7.544 -13.261 -2.676 886 HD23 LEU 109 HD23 LEU 109 5.839 -13.072 -3.210 887 H HIS 110 H HIS 110 8.541 -8.928 0.045 888 HA HIS 110 HA HIS 110 6.763 -8.680 2.393 889 HB2 HIS 110 HB2 HIS 110 9.811 -8.476 2.409 890 HB3 HIS 110 HB3 HIS 110 8.762 -7.865 3.696 891 HD2 HIS 110 HD2 HIS 110 9.687 -11.392 2.105 892 HE1 HIS 110 HE1 HIS 110 8.335 -11.933 6.124 893 H MET 111 H MET 111 6.128 -6.418 2.531 894 HA MET 111 HA MET 111 7.860 -4.474 1.348 895 HB2 MET 111 HB2 MET 111 5.517 -5.503 -0.115 896 HB3 MET 111 HB3 MET 111 5.479 -3.748 0.104 897 HG2 MET 111 HG2 MET 111 7.758 -3.573 -0.887 898 HG3 MET 111 HG3 MET 111 7.802 -5.328 -1.102 899 HE1 MET 111 HE1 MET 111 7.472 -4.330 -4.751 900 HE2 MET 111 HE2 MET 111 7.886 -2.879 -3.778 901 HE3 MET 111 HE3 MET 111 8.583 -4.477 -3.348 902 H MET 112 H MET 112 7.665 -2.425 2.350 903 HA MET 112 HA MET 112 5.486 -2.389 4.333 904 HB2 MET 112 HB2 MET 112 8.155 -0.976 3.867 905 HB3 MET 112 HB3 MET 112 6.922 -0.161 4.838 906 HG2 MET 112 HG2 MET 112 8.585 -1.315 6.232 907 HG3 MET 112 HG3 MET 112 6.954 -1.948 6.491 908 HE1 MET 112 HE1 MET 112 10.485 -4.076 4.425 909 HE2 MET 112 HE2 MET 112 9.528 -2.963 3.391 910 HE3 MET 112 HE3 MET 112 10.355 -2.338 4.857 911 H ARG 113 H ARG 113 4.018 -0.435 4.297 912 HA ARG 113 HA ARG 113 4.596 1.443 2.075 913 HB2 ARG 113 HB2 ARG 113 2.811 -0.757 1.957 914 HB3 ARG 113 HB3 ARG 113 1.781 0.463 2.718 915 HG2 ARG 113 HG2 ARG 113 1.372 1.540 0.757 916 HG3 ARG 113 HG3 ARG 113 3.040 1.392 0.189 917 HD2 ARG 113 HD2 ARG 113 1.049 -0.956 0.200 918 HD3 ARG 113 HD3 ARG 113 1.279 0.113 -1.189 919 HE ARG 113 HE ARG 113 3.745 -0.653 -1.065 920 HH11 ARG 113 HH11 ARG 113 1.006 -2.664 -0.165 921 HH12 ARG 113 HH12 ARG 113 1.854 -4.152 -0.425 922 HH21 ARG 113 HH21 ARG 113 4.880 -2.595 -1.309 923 HH22 ARG 113 HH22 ARG 113 4.073 -4.111 -1.080 924 H LEU 114 H LEU 114 4.277 3.543 2.949 925 HA LEU 114 HA LEU 114 2.602 3.573 5.413 926 HB2 LEU 114 HB2 LEU 114 5.003 4.141 5.629 927 HB3 LEU 114 HB3 LEU 114 4.869 5.278 4.281 928 HG LEU 114 HG LEU 114 3.383 6.712 5.730 929 HD11 LEU 114 HD11 LEU 114 3.555 6.371 8.201 930 HD12 LEU 114 HD12 LEU 114 2.717 5.009 7.384 931 HD13 LEU 114 HD13 LEU 114 4.426 4.828 7.907 932 HD21 LEU 114 HD21 LEU 114 5.262 7.688 7.081 933 HD22 LEU 114 HD22 LEU 114 6.244 6.221 6.747 934 HD23 LEU 114 HD23 LEU 114 5.762 7.305 5.399 935 H TYR 115 H TYR 115 0.650 4.019 4.903 936 HA TYR 115 HA TYR 115 0.336 5.854 2.656 937 HB2 TYR 115 HB2 TYR 115 -1.602 4.899 2.077 938 HB3 TYR 115 HB3 TYR 115 -0.780 3.497 2.776 939 HD1 TYR 115 HD1 TYR 115 -3.132 6.286 3.821 940 HD2 TYR 115 HD2 TYR 115 -1.946 2.184 4.347 941 HE1 TYR 115 HE1 TYR 115 -5.034 5.936 5.383 942 HE2 TYR 115 HE2 TYR 115 -3.854 1.836 5.896 943 HH TYR 115 HH TYR 115 -5.281 3.186 7.415 944 H SER 116 H SER 116 -1.578 7.211 2.712 945 HA SER 116 HA SER 116 -2.041 8.468 5.240 946 HB2 SER 116 HB2 SER 116 -0.217 9.742 3.167 947 HB3 SER 116 HB3 SER 116 -1.145 10.716 4.315 948 HG SER 116 HG SER 116 0.244 8.492 5.416 949 H ARG 117 H ARG 117 -3.594 10.230 5.243 950 HA ARG 117 HA ARG 117 -5.713 9.653 3.432 951 HB2 ARG 117 HB2 ARG 117 -5.183 11.903 5.447 952 HB3 ARG 117 HB3 ARG 117 -6.695 11.760 4.540 953 HG2 ARG 117 HG2 ARG 117 -7.331 9.776 5.647 954 HG3 ARG 117 HG3 ARG 117 -5.680 9.412 6.165 955 HD2 ARG 117 HD2 ARG 117 -7.300 10.299 7.959 956 HD3 ARG 117 HD3 ARG 117 -5.707 11.062 7.867 957 HE ARG 117 HE ARG 117 -6.721 13.054 7.243 958 HH11 ARG 117 HH11 ARG 117 -9.063 10.447 6.879 959 HH12 ARG 117 HH12 ARG 117 -10.381 11.521 6.548 960 HH21 ARG 117 HH21 ARG 117 -8.458 14.439 6.811 961 HH22 ARG 117 HH22 ARG 117 -10.036 13.792 6.510 962 H SER 118 H SER 118 -3.057 12.121 3.468 963 HA SER 118 HA SER 118 -4.174 13.191 0.943 964 HB2 SER 118 HB2 SER 118 -2.390 14.739 2.879 965 HB3 SER 118 HB3 SER 118 -3.369 15.370 1.548 966 HG SER 118 HG SER 118 -4.368 15.727 3.629 967 HA PRO 119 HA PRO 119 -0.242 11.953 -0.765 968 HB2 PRO 119 HB2 PRO 119 -0.118 13.643 -2.953 969 HB3 PRO 119 HB3 PRO 119 -1.329 12.355 -2.901 970 HG2 PRO 119 HG2 PRO 119 -1.640 15.298 -2.243 971 HG3 PRO 119 HG3 PRO 119 -2.710 14.249 -3.182 972 HD2 PRO 119 HD2 PRO 119 -3.208 14.869 -0.553 973 HD3 PRO 119 HD3 PRO 119 -3.716 13.334 -1.269 974 H GLU 120 H GLU 120 0.275 13.319 1.479 975 HA GLU 120 HA GLU 120 2.635 14.795 0.662 976 HB2 GLU 120 HB2 GLU 120 2.009 16.537 2.480 977 HB3 GLU 120 HB3 GLU 120 1.403 16.718 0.829 978 HG2 GLU 120 HG2 GLU 120 -0.783 15.741 1.526 979 HG3 GLU 120 HG3 GLU 120 -0.176 15.565 3.178 980 H VAL 121 H VAL 121 4.235 13.728 1.824 981 HA VAL 121 HA VAL 121 3.385 12.062 4.031 982 HB VAL 121 HB VAL 121 6.139 12.910 3.054 983 HG11 VAL 121 HG11 VAL 121 7.019 10.758 3.895 984 HG12 VAL 121 HG12 VAL 121 6.369 11.854 5.160 985 HG13 VAL 121 HG13 VAL 121 5.409 10.434 4.623 986 HG21 VAL 121 HG21 VAL 121 6.153 10.598 1.821 987 HG22 VAL 121 HG22 VAL 121 4.407 10.897 1.786 988 HG23 VAL 121 HG23 VAL 121 5.501 12.095 1.076 989 H SER 122 H SER 122 3.698 12.547 6.151 990 HA SER 122 HA SER 122 4.696 15.210 6.805 991 HB2 SER 122 HB2 SER 122 3.429 14.673 8.989 992 HB3 SER 122 HB3 SER 122 2.431 14.881 7.544 993 HG SER 122 HG SER 122 1.818 12.995 8.780 994 HA PRO 123 HA PRO 123 8.294 13.860 8.847 995 HB2 PRO 123 HB2 PRO 123 7.970 15.308 11.303 996 HB3 PRO 123 HB3 PRO 123 8.708 15.989 9.846 997 HG2 PRO 123 HG2 PRO 123 5.883 16.267 10.866 998 HG3 PRO 123 HG3 PRO 123 6.907 17.464 10.061 999 HD2 PRO 123 HD2 PRO 123 4.933 16.225 8.695 1000 HD3 PRO 123 HD3 PRO 123 6.471 16.584 7.899 1001 H ALA 124 H ALA 124 5.439 13.998 11.171 1002 HA ALA 124 HA ALA 124 6.522 12.166 12.956 1003 HB1 ALA 124 HB1 ALA 124 4.133 11.814 13.603 1004 HB2 ALA 124 HB2 ALA 124 4.502 13.554 13.352 1005 HB3 ALA 124 HB3 ALA 124 3.616 12.633 12.090 1006 H ALA 125 H ALA 125 4.297 11.457 10.104 1007 HA ALA 125 HA ALA 125 4.223 8.696 10.542 1008 HB1 ALA 125 HB1 ALA 125 3.561 8.577 8.167 1009 HB2 ALA 125 HB2 ALA 125 2.696 9.888 9.038 1010 HB3 ALA 125 HB3 ALA 125 4.063 10.287 7.944 1011 H THR 126 H THR 126 6.610 10.798 8.846 1012 HA THR 126 HA THR 126 8.032 8.704 7.623 1013 HB THR 126 HB THR 126 9.068 11.429 8.547 1014 HG1 THR 126 HG1 THR 126 7.377 11.983 7.238 1015 HG21 THR 126 HG21 THR 126 10.603 11.180 6.612 1016 HG22 THR 126 HG22 THR 126 10.812 9.849 7.800 1017 HG23 THR 126 HG23 THR 126 9.908 9.558 6.275 1018 H ALA 127 H ALA 127 8.457 10.486 10.789 1019 HA ALA 127 HA ALA 127 10.827 9.175 11.526 1020 HB1 ALA 127 HB1 ALA 127 10.261 9.985 13.798 1021 HB2 ALA 127 HB2 ALA 127 10.052 11.265 12.556 1022 HB3 ALA 127 HB3 ALA 127 8.615 10.421 13.225 1023 H ILE 128 H ILE 128 7.331 8.441 12.354 1024 HA ILE 128 HA ILE 128 7.895 6.270 14.002 1025 HB ILE 128 HB ILE 128 5.495 6.862 12.209 1026 HG12 ILE 128 HG12 ILE 128 5.947 8.552 13.947 1027 HG13 ILE 128 HG13 ILE 128 4.441 7.676 14.250 1028 HG21 ILE 128 HG21 ILE 128 4.255 5.249 13.618 1029 HG22 ILE 128 HG22 ILE 128 5.586 4.462 12.706 1030 HG23 ILE 128 HG23 ILE 128 5.783 4.815 14.455 1031 HD11 ILE 128 HD11 ILE 128 5.701 8.012 16.330 1032 HD12 ILE 128 HD12 ILE 128 5.585 6.264 15.936 1033 HD13 ILE 128 HD13 ILE 128 7.115 7.154 15.629 1034 H PHE 129 H PHE 129 7.017 6.339 10.441 1035 HA PHE 129 HA PHE 129 7.130 3.658 9.912 1036 HB2 PHE 129 HB2 PHE 129 6.496 5.565 8.364 1037 HB3 PHE 129 HB3 PHE 129 8.218 5.908 8.153 1038 HD1 PHE 129 HD1 PHE 129 5.620 3.264 7.679 1039 HD2 PHE 129 HD2 PHE 129 9.512 4.711 6.584 1040 HE1 PHE 129 HE1 PHE 129 5.719 1.602 5.848 1041 HE2 PHE 129 HE2 PHE 129 9.617 3.044 4.754 1042 HZ PHE 129 HZ PHE 129 7.719 1.486 4.382 1043 H ARG 130 H ARG 130 9.910 5.998 10.205 1044 HA ARG 130 HA ARG 130 11.829 4.090 9.372 1045 HB2 ARG 130 HB2 ARG 130 12.140 6.580 9.309 1046 HB3 ARG 130 HB3 ARG 130 12.157 6.609 11.078 1047 HG2 ARG 130 HG2 ARG 130 14.123 4.852 10.827 1048 HG3 ARG 130 HG3 ARG 130 14.222 5.463 9.171 1049 HD2 ARG 130 HD2 ARG 130 14.374 7.180 11.702 1050 HD3 ARG 130 HD3 ARG 130 15.762 6.656 10.740 1051 HE ARG 130 HE ARG 130 14.023 7.981 8.968 1052 HH11 ARG 130 HH11 ARG 130 15.904 8.755 11.836 1053 HH12 ARG 130 HH12 ARG 130 16.116 10.416 11.396 1054 HH21 ARG 130 HH21 ARG 130 14.312 10.161 8.403 1055 HH22 ARG 130 HH22 ARG 130 15.210 11.217 9.442 1056 H LYS 131 H LYS 131 10.545 5.129 12.628 1057 HA LYS 131 HA LYS 131 12.427 3.932 14.234 1058 HB2 LYS 131 HB2 LYS 131 9.381 4.103 14.569 1059 HB3 LYS 131 HB3 LYS 131 10.506 3.696 15.872 1060 HG2 LYS 131 HG2 LYS 131 11.574 5.947 15.637 1061 HG3 LYS 131 HG3 LYS 131 10.418 6.352 14.361 1062 HD2 LYS 131 HD2 LYS 131 8.522 5.995 15.959 1063 HD3 LYS 131 HD3 LYS 131 9.673 5.576 17.235 1064 HE2 LYS 131 HE2 LYS 131 10.738 7.866 16.940 1065 HE3 LYS 131 HE3 LYS 131 9.452 8.268 15.794 1066 HZ1 LYS 131 HZ1 LYS 131 8.941 9.036 18.002 1067 HZ2 LYS 131 HZ2 LYS 131 7.854 7.900 17.563 1068 HZ3 LYS 131 HZ3 LYS 131 9.041 7.529 18.621 1069 H LEU 132 H LEU 132 9.291 2.410 13.026 1070 HA LEU 132 HA LEU 132 9.780 -0.094 14.157 1071 HB2 LEU 132 HB2 LEU 132 8.269 0.656 11.615 1072 HB3 LEU 132 HB3 LEU 132 8.170 -0.907 12.437 1073 HG LEU 132 HG LEU 132 7.330 1.765 13.640 1074 HD11 LEU 132 HD11 LEU 132 5.027 0.912 13.354 1075 HD12 LEU 132 HD12 LEU 132 5.874 1.097 11.781 1076 HD13 LEU 132 HD13 LEU 132 5.673 -0.534 12.506 1077 HD21 LEU 132 HD21 LEU 132 6.289 0.372 15.398 1078 HD22 LEU 132 HD22 LEU 132 6.989 -1.099 14.640 1079 HD23 LEU 132 HD23 LEU 132 8.071 0.155 15.336 1080 H ALA 133 H ALA 133 10.709 1.297 10.935 1081 HA ALA 133 HA ALA 133 11.713 -1.060 9.827 1082 HB1 ALA 133 HB1 ALA 133 12.954 0.475 8.331 1083 HB2 ALA 133 HB2 ALA 133 11.242 0.977 8.538 1084 HB3 ALA 133 HB3 ALA 133 12.546 1.849 9.413 1085 H GLY 134 H GLY 134 13.228 1.324 12.113 1086 HA2 GLY 134 HA2 GLY 134 15.869 0.401 11.779 1087 HA3 GLY 134 HA3 GLY 134 15.211 1.293 13.157 1088 H GLU 135 H GLU 135 13.123 -0.706 13.883 1089 HA GLU 135 HA GLU 135 14.680 -2.310 15.587 1090 HB2 GLU 135 HB2 GLU 135 12.512 -1.837 16.333 1091 HB3 GLU 135 HB3 GLU 135 11.769 -2.219 14.775 1092 HG2 GLU 135 HG2 GLU 135 11.872 -4.542 15.132 1093 HG3 GLU 135 HG3 GLU 135 13.169 -4.410 16.327 1094 H ARG 136 H ARG 136 13.229 -2.855 12.324 1095 HA ARG 136 HA ARG 136 13.960 -5.652 12.412 1096 HB2 ARG 136 HB2 ARG 136 12.973 -4.139 9.967 1097 HB3 ARG 136 HB3 ARG 136 12.754 -5.845 10.378 1098 HG2 ARG 136 HG2 ARG 136 11.355 -4.920 12.416 1099 HG3 ARG 136 HG3 ARG 136 11.295 -3.422 11.478 1100 HD2 ARG 136 HD2 ARG 136 9.354 -4.564 10.784 1101 HD3 ARG 136 HD3 ARG 136 10.506 -4.904 9.486 1102 HE ARG 136 HE ARG 136 10.666 -7.152 10.220 1103 HH11 ARG 136 HH11 ARG 136 8.607 -5.258 12.357 1104 HH12 ARG 136 HH12 ARG 136 7.916 -6.650 13.122 1105 HH21 ARG 136 HH21 ARG 136 9.752 -8.963 11.236 1106 HH22 ARG 136 HH22 ARG 136 8.568 -8.756 12.484 1107 H ASN 137 H ASN 137 15.941 -3.020 12.147 1108 HA ASN 137 HA ASN 137 17.967 -2.747 11.281 1109 HB2 ASN 137 HB2 ASN 137 17.730 -5.602 10.228 1110 HB3 ASN 137 HB3 ASN 137 19.212 -4.642 10.342 1111 HD21 ASN 137 HD21 ASN 137 18.881 -3.497 12.924 1112 HD22 ASN 137 HD22 ASN 137 18.982 -4.773 14.092 1113 H TYR 138 H TYR 138 15.782 -1.687 9.779 1114 HA TYR 138 HA TYR 138 15.672 -2.743 7.155 1115 HB2 TYR 138 HB2 TYR 138 14.192 -0.913 6.815 1116 HB3 TYR 138 HB3 TYR 138 14.078 -1.128 8.567 1117 HD1 TYR 138 HD1 TYR 138 15.435 0.496 10.102 1118 HD2 TYR 138 HD2 TYR 138 14.985 1.165 5.876 1119 HE1 TYR 138 HE1 TYR 138 16.080 2.876 10.405 1120 HE2 TYR 138 HE2 TYR 138 15.626 3.540 6.185 1121 HH TYR 138 HH TYR 138 16.237 5.130 7.590 1122 H THR 139 H THR 139 16.618 -1.918 5.180 1123 HA THR 139 HA THR 139 19.058 -0.372 5.751 1124 HB THR 139 HB THR 139 19.393 -1.159 3.251 1125 HG1 THR 139 HG1 THR 139 17.567 -3.282 4.076 1126 HG21 THR 139 HG21 THR 139 20.264 -3.388 3.959 1127 HG22 THR 139 HG22 THR 139 20.696 -2.096 5.129 1128 HG23 THR 139 HG23 THR 139 19.361 -3.237 5.504 1129 H ASP 140 H ASP 140 19.507 1.496 4.452 1130 HA ASP 140 HA ASP 140 17.267 3.106 3.870 1131 HB2 ASP 140 HB2 ASP 140 19.209 4.219 4.574 1132 HB3 ASP 140 HB3 ASP 140 20.262 3.298 3.492 1133 H GLU 141 H GLU 141 19.060 0.831 1.906 1134 HA GLU 141 HA GLU 141 18.160 1.939 -0.567 1135 HB2 GLU 141 HB2 GLU 141 19.676 -0.550 0.242 1136 HB3 GLU 141 HB3 GLU 141 19.024 -0.382 -1.394 1137 HG2 GLU 141 HG2 GLU 141 20.824 1.720 -0.106 1138 HG3 GLU 141 HG3 GLU 141 21.457 0.351 -1.029 1139 H MET 142 H MET 142 16.566 0.070 1.897 1140 HA MET 142 HA MET 142 14.835 -1.192 -0.072 1141 HB2 MET 142 HB2 MET 142 15.552 -2.731 1.603 1142 HB3 MET 142 HB3 MET 142 15.371 -1.527 2.886 1143 HG2 MET 142 HG2 MET 142 12.809 -1.596 2.035 1144 HG3 MET 142 HG3 MET 142 13.296 -3.219 1.531 1145 HE1 MET 142 HE1 MET 142 14.283 -4.967 4.857 1146 HE2 MET 142 HE2 MET 142 14.176 -5.057 3.067 1147 HE3 MET 142 HE3 MET 142 15.454 -4.060 3.842 1148 H VAL 143 H VAL 143 14.849 1.349 2.517 1149 HA VAL 143 HA VAL 143 11.916 1.387 2.290 1150 HB VAL 143 HB VAL 143 14.104 2.771 3.841 1151 HG11 VAL 143 HG11 VAL 143 12.447 4.094 5.152 1152 HG12 VAL 143 HG12 VAL 143 12.593 4.563 3.424 1153 HG13 VAL 143 HG13 VAL 143 11.189 3.586 3.975 1154 HG21 VAL 143 HG21 VAL 143 13.076 2.002 5.934 1155 HG22 VAL 143 HG22 VAL 143 11.925 1.033 4.953 1156 HG23 VAL 143 HG23 VAL 143 13.689 0.714 4.842 1157 H ALA 144 H ALA 144 10.864 2.801 1.171 1158 HA ALA 144 HA ALA 144 12.124 5.066 -0.235 1159 HB1 ALA 144 HB1 ALA 144 10.788 4.399 -2.221 1160 HB2 ALA 144 HB2 ALA 144 11.977 3.133 -1.763 1161 HB3 ALA 144 HB3 ALA 144 10.240 2.924 -1.355 1162 H MET 145 H MET 145 11.331 6.805 0.058 1163 HA MET 145 HA MET 145 8.534 7.059 0.606 1164 HB2 MET 145 HB2 MET 145 8.722 8.823 2.173 1165 HB3 MET 145 HB3 MET 145 9.402 7.287 2.724 1166 HG2 MET 145 HG2 MET 145 11.630 8.125 1.804 1167 HG3 MET 145 HG3 MET 145 10.857 9.710 1.674 1168 HE1 MET 145 HE1 MET 145 12.227 7.249 5.051 1169 HE2 MET 145 HE2 MET 145 10.443 7.043 5.084 1170 HE3 MET 145 HE3 MET 145 11.362 6.672 3.586 1171 H LEU 146 H LEU 146 7.221 8.945 -0.461 1172 HA LEU 146 HA LEU 146 9.235 10.420 -2.028 1173 HB2 LEU 146 HB2 LEU 146 6.466 9.703 -2.919 1174 HB3 LEU 146 HB3 LEU 146 7.337 11.072 -3.622 1175 HG LEU 146 HG LEU 146 7.643 9.075 -4.981 1176 HD11 LEU 146 HD11 LEU 146 10.104 9.004 -5.050 1177 HD12 LEU 146 HD12 LEU 146 9.490 10.682 -4.870 1178 HD13 LEU 146 HD13 LEU 146 10.173 9.818 -3.451 1179 HD21 LEU 146 HD21 LEU 146 8.837 7.103 -4.076 1180 HD22 LEU 146 HD22 LEU 146 8.851 7.862 -2.448 1181 HD23 LEU 146 HD23 LEU 146 7.292 7.397 -3.209 1182 HA PRO 147 HA PRO 147 7.624 14.036 0.324 1183 HB2 PRO 147 HB2 PRO 147 9.562 15.834 -0.411 1184 HB3 PRO 147 HB3 PRO 147 10.001 14.505 0.670 1185 HG2 PRO 147 HG2 PRO 147 10.443 14.767 -2.314 1186 HG3 PRO 147 HG3 PRO 147 11.546 14.156 -1.074 1187 HD2 PRO 147 HD2 PRO 147 10.030 12.507 -2.723 1188 HD3 PRO 147 HD3 PRO 147 10.623 12.010 -1.133 1189 H ARG 148 H ARG 148 8.465 16.612 -1.304 1190 HA ARG 148 HA ARG 148 5.957 17.035 -2.607 1191 HB2 ARG 148 HB2 ARG 148 6.530 19.238 -2.872 1192 HB3 ARG 148 HB3 ARG 148 7.373 18.765 -1.391 1193 HG2 ARG 148 HG2 ARG 148 8.728 18.802 -4.115 1194 HG3 ARG 148 HG3 ARG 148 8.669 20.213 -3.050 1195 HD2 ARG 148 HD2 ARG 148 9.807 17.472 -2.303 1196 HD3 ARG 148 HD3 ARG 148 10.763 18.888 -2.760 1197 HE ARG 148 HE ARG 148 9.167 19.769 -0.657 1198 HH11 ARG 148 HH11 ARG 148 11.567 17.246 -1.122 1199 HH12 ARG 148 HH12 ARG 148 12.047 17.230 0.542 1200 HH21 ARG 148 HH21 ARG 148 9.813 19.750 1.512 1201 HH22 ARG 148 HH22 ARG 148 11.047 18.657 2.043 1202 H GLN 149 H GLN 149 6.426 14.904 -3.791 1203 HA GLN 149 HA GLN 149 7.181 15.644 -6.403 1204 HB2 GLN 149 HB2 GLN 149 8.938 14.186 -5.268 1205 HB3 GLN 149 HB3 GLN 149 7.882 12.841 -5.720 1206 HG2 GLN 149 HG2 GLN 149 7.930 13.771 -8.122 1207 HG3 GLN 149 HG3 GLN 149 9.212 14.863 -7.581 1208 HE21 GLN 149 HE21 GLN 149 10.222 13.036 -5.527 1209 HE22 GLN 149 HE22 GLN 149 11.053 11.755 -6.345 1210 H GLU 150 H GLU 150 4.388 15.672 -5.522 1211 HA GLU 150 HA GLU 150 3.472 13.480 -7.227 1212 HB2 GLU 150 HB2 GLU 150 1.251 13.921 -6.188 1213 HB3 GLU 150 HB3 GLU 150 2.505 13.580 -4.988 1214 HG2 GLU 150 HG2 GLU 150 1.258 15.383 -4.093 1215 HG3 GLU 150 HG3 GLU 150 2.755 16.111 -4.690 1216 H GLU 151 H GLU 151 1.440 13.686 -8.531 1217 HA GLU 151 HA GLU 151 0.897 16.163 -9.720 1218 HB2 GLU 151 HB2 GLU 151 3.228 15.881 -10.588 1219 HB3 GLU 151 HB3 GLU 151 2.766 14.333 -11.307 1220 HG2 GLU 151 HG2 GLU 151 0.920 15.675 -12.556 1221 HG3 GLU 151 HG3 GLU 151 1.811 17.119 -12.059 1222 H CYS 152 H CYS 152 0.842 12.580 -9.801 1223 HA CYS 152 HA CYS 152 -1.522 12.740 -11.607 1224 HB2 CYS 152 HB2 CYS 152 0.446 11.401 -12.362 1225 HB3 CYS 152 HB3 CYS 152 0.372 10.467 -10.862 1226 H THR 153 H THR 153 -3.253 11.177 -10.898 1227 HA THR 153 HA THR 153 -3.215 10.501 -8.109 1228 HB THR 153 HB THR 153 -5.485 11.818 -7.869 1229 HG1 THR 153 HG1 THR 153 -5.467 13.814 -9.136 1230 HG21 THR 153 HG21 THR 153 -4.294 13.837 -7.058 1231 HG22 THR 153 HG22 THR 153 -3.466 12.323 -6.558 1232 HG23 THR 153 HG23 THR 153 -2.811 13.299 -7.917 1233 H VAL 154 H VAL 154 -5.309 9.382 -7.422 1234 HA VAL 154 HA VAL 154 -6.413 7.988 -9.773 1235 HB VAL 154 HB VAL 154 -5.244 6.600 -8.107 1236 HG11 VAL 154 HG11 VAL 154 -6.169 6.310 -5.825 1237 HG12 VAL 154 HG12 VAL 154 -5.557 7.975 -6.108 1238 HG13 VAL 154 HG13 VAL 154 -7.323 7.650 -6.134 1239 HG21 VAL 154 HG21 VAL 154 -7.054 4.971 -7.672 1240 HG22 VAL 154 HG22 VAL 154 -8.269 6.222 -8.104 1241 HG23 VAL 154 HG23 VAL 154 -7.112 5.629 -9.342 1242 H ASP 155 H ASP 155 -8.669 8.051 -10.134 1243 HA ASP 155 HA ASP 155 -10.110 10.145 -8.860 1244 HB2 ASP 155 HB2 ASP 155 -10.470 9.579 -11.216 1245 HB3 ASP 155 HB3 ASP 155 -10.931 7.924 -10.795 1246 H GLU 156 H GLU 156 -12.009 10.033 -7.542 1247 HA GLU 156 HA GLU 156 -12.128 7.533 -5.998 1248 HB2 GLU 156 HB2 GLU 156 -13.161 8.957 -4.231 1249 HB3 GLU 156 HB3 GLU 156 -11.480 9.357 -4.609 1250 HG2 GLU 156 HG2 GLU 156 -12.378 11.223 -6.116 1251 HG3 GLU 156 HG3 GLU 156 -13.980 10.890 -5.443 1252 H VAL 157 H VAL 157 -14.219 10.130 -7.492 1253 HA VAL 157 HA VAL 157 -16.107 8.192 -8.309 1254 HB VAL 157 HB VAL 157 -16.711 8.205 -5.922 1255 HG11 VAL 157 HG11 VAL 157 -17.656 10.231 -4.863 1256 HG12 VAL 157 HG12 VAL 157 -15.926 10.435 -5.300 1257 HG13 VAL 157 HG13 VAL 157 -17.202 11.190 -6.313 1258 HG21 VAL 157 HG21 VAL 157 -19.112 8.753 -6.179 1259 HG22 VAL 157 HG22 VAL 157 -18.741 9.622 -7.706 1260 HG23 VAL 157 HG23 VAL 157 -18.467 7.851 -7.591 1261 HN1 EB4 158 HN1 EB4 158 4.067 -6.055 -7.193 1262 H8 EB4 158 H8 EB4 158 -2.223 -6.494 -4.419 1263 HN2 EB4 158 HN2 EB4 158 1.292 -5.022 -8.703 1264 H9 EB4 158 H9 EB4 158 0.615 -0.635 -3.339 1265 H10 EB4 158 H10 EB4 158 4.824 -7.617 -1.539 1266 HN3 EB4 158 HN3 EB4 158 3.607 -2.960 -7.737 1267 H7 EB4 158 H7 EB4 158 3.169 -5.775 -1.482 1268 H11 EB4 158 H11 EB4 158 -3.590 -7.221 -6.353 1269 H12 EB4 158 H12 EB4 158 1.984 1.329 -4.007 1270 H15 EB4 158 H15 EB4 158 3.775 1.080 -5.683 1271 H14 EB4 158 H14 EB4 158 -2.725 -6.946 -8.657 1272 H13 EB4 158 H13 EB4 158 5.625 -8.497 -3.713 1273 H22 EB4 158 H22 EB4 158 4.828 -6.893 -7.631 1274 H30 EB4 158 H30 EB4 158 6.346 -3.589 -10.174 1275 H30A EB4 158 H30A EB4 158 6.636 -3.045 -8.460 1276 H24 EB4 158 H24 EB4 158 4.312 -2.209 -8.396 1277 H28 EB4 158 H28 EB4 158 3.768 -8.592 -9.181 1278 H28A EB4 158 H28A EB4 158 4.559 -7.680 -10.559 1279 H23 EB4 158 H23 EB4 158 1.017 -5.383 -9.846 1280 H29 EB4 158 H29 EB4 158 0.844 -3.306 -10.960 1281 H29A EB4 158 H29A EB4 158 2.278 -3.817 -12.062 Start of MODEL 20 1 H1 MET 1 H1 MET 1 -29.162 4.058 -4.241 2 H2 MET 1 H2 MET 1 -28.594 5.576 -4.047 3 H3 MET 1 H3 MET 1 -29.077 5.068 -5.521 4 HA MET 1 HA MET 1 -27.073 3.414 -4.351 5 HB2 MET 1 HB2 MET 1 -27.220 4.858 -7.040 6 HB3 MET 1 HB3 MET 1 -26.094 3.565 -6.604 7 HG2 MET 1 HG2 MET 1 -27.942 1.964 -6.390 8 HG3 MET 1 HG3 MET 1 -29.130 3.244 -6.671 9 HE1 MET 1 HE1 MET 1 -29.603 1.447 -10.049 10 HE2 MET 1 HE2 MET 1 -29.511 0.781 -8.383 11 HE3 MET 1 HE3 MET 1 -30.384 2.321 -8.688 12 H THR 2 H THR 2 -24.697 4.029 -4.440 13 HA THR 2 HA THR 2 -23.061 5.326 -3.689 14 HB THR 2 HB THR 2 -24.294 7.574 -5.345 15 HG1 THR 2 HG1 THR 2 -23.181 6.553 -7.172 16 HG21 THR 2 HG21 THR 2 -21.912 8.079 -5.827 17 HG22 THR 2 HG22 THR 2 -22.248 8.095 -4.063 18 HG23 THR 2 HG23 THR 2 -21.415 6.688 -4.806 19 H VAL 3 H VAL 3 -24.946 5.179 -1.702 20 HA VAL 3 HA VAL 3 -25.604 7.906 -0.940 21 HB VAL 3 HB VAL 3 -26.874 6.823 0.914 22 HG11 VAL 3 HG11 VAL 3 -28.621 5.775 -0.496 23 HG12 VAL 3 HG12 VAL 3 -27.984 7.288 -1.226 24 HG13 VAL 3 HG13 VAL 3 -27.459 5.693 -1.863 25 HG21 VAL 3 HG21 VAL 3 -27.185 4.372 0.927 26 HG22 VAL 3 HG22 VAL 3 -25.955 4.214 -0.372 27 HG23 VAL 3 HG23 VAL 3 -25.480 4.838 1.244 28 HA PRO 4 HA PRO 4 -22.333 8.150 2.081 29 HB2 PRO 4 HB2 PRO 4 -23.493 9.808 3.965 30 HB3 PRO 4 HB3 PRO 4 -23.135 10.435 2.351 31 HG2 PRO 4 HG2 PRO 4 -25.768 9.425 3.466 32 HG3 PRO 4 HG3 PRO 4 -25.453 10.866 2.490 33 HD2 PRO 4 HD2 PRO 4 -26.428 8.537 1.403 34 HD3 PRO 4 HD3 PRO 4 -25.425 9.663 0.479 35 H ASP 5 H ASP 5 -23.425 5.659 2.280 36 HA ASP 5 HA ASP 5 -24.106 5.300 5.136 37 HB2 ASP 5 HB2 ASP 5 -25.484 4.339 3.163 38 HB3 ASP 5 HB3 ASP 5 -24.113 3.259 2.874 39 H ARG 6 H ARG 6 -22.868 2.370 4.170 40 HA ARG 6 HA ARG 6 -20.694 2.390 5.797 41 HB2 ARG 6 HB2 ARG 6 -21.817 0.665 3.740 42 HB3 ARG 6 HB3 ARG 6 -20.051 0.639 3.645 43 HG2 ARG 6 HG2 ARG 6 -20.605 -1.118 5.133 44 HG3 ARG 6 HG3 ARG 6 -20.043 0.193 6.179 45 HD2 ARG 6 HD2 ARG 6 -22.133 -0.929 7.016 46 HD3 ARG 6 HD3 ARG 6 -22.319 0.813 6.771 47 HE ARG 6 HE ARG 6 -23.871 0.392 5.094 48 HH11 ARG 6 HH11 ARG 6 -22.194 -2.600 5.872 49 HH12 ARG 6 HH12 ARG 6 -23.205 -3.572 4.854 50 HH21 ARG 6 HH21 ARG 6 -25.166 -0.889 3.741 51 HH22 ARG 6 HH22 ARG 6 -24.896 -2.597 3.642 52 H SER 7 H SER 7 -20.905 3.863 2.597 53 HA SER 7 HA SER 7 -18.362 3.788 1.629 54 HB2 SER 7 HB2 SER 7 -19.928 6.396 1.744 55 HB3 SER 7 HB3 SER 7 -18.963 5.739 0.415 56 HG SER 7 HG SER 7 -21.588 5.526 0.713 57 H GLU 8 H GLU 8 -19.510 5.521 4.556 58 HA GLU 8 HA GLU 8 -17.476 7.405 4.828 59 HB2 GLU 8 HB2 GLU 8 -19.191 5.767 6.761 60 HB3 GLU 8 HB3 GLU 8 -17.993 6.916 7.371 61 HG2 GLU 8 HG2 GLU 8 -20.106 7.782 5.365 62 HG3 GLU 8 HG3 GLU 8 -20.475 7.681 7.092 63 H ILE 9 H ILE 9 -17.442 3.899 5.290 64 HA ILE 9 HA ILE 9 -14.953 3.940 6.681 65 HB ILE 9 HB ILE 9 -16.399 1.404 5.898 66 HG12 ILE 9 HG12 ILE 9 -16.501 3.088 8.464 67 HG13 ILE 9 HG13 ILE 9 -17.778 3.096 7.239 68 HG21 ILE 9 HG21 ILE 9 -15.053 0.553 7.810 69 HG22 ILE 9 HG22 ILE 9 -13.988 1.246 6.541 70 HG23 ILE 9 HG23 ILE 9 -14.332 2.183 8.034 71 HD11 ILE 9 HD11 ILE 9 -18.355 1.628 9.110 72 HD12 ILE 9 HD12 ILE 9 -18.155 0.680 7.598 73 HD13 ILE 9 HD13 ILE 9 -16.858 0.673 8.841 74 H ALA 10 H ALA 10 -15.523 4.492 3.498 75 HA ALA 10 HA ALA 10 -13.064 3.058 2.729 76 HB1 ALA 10 HB1 ALA 10 -14.146 2.688 0.494 77 HB2 ALA 10 HB2 ALA 10 -15.053 1.874 1.813 78 HB3 ALA 10 HB3 ALA 10 -15.662 3.417 1.124 79 H GLY 11 H GLY 11 -12.480 3.969 0.274 80 HA2 GLY 11 HA2 GLY 11 -12.913 6.346 -0.727 81 HA3 GLY 11 HA3 GLY 11 -12.103 6.837 0.767 82 H LYS 12 H LYS 12 -10.522 7.786 -0.918 83 HA LYS 12 HA LYS 12 -8.706 5.711 -1.946 84 HB2 LYS 12 HB2 LYS 12 -7.769 7.540 -3.330 85 HB3 LYS 12 HB3 LYS 12 -9.473 7.205 -3.665 86 HG2 LYS 12 HG2 LYS 12 -10.183 9.208 -2.492 87 HG3 LYS 12 HG3 LYS 12 -8.560 9.481 -1.845 88 HD2 LYS 12 HD2 LYS 12 -7.664 10.046 -3.996 89 HD3 LYS 12 HD3 LYS 12 -9.040 9.340 -4.855 90 HE2 LYS 12 HE2 LYS 12 -9.283 11.740 -4.940 91 HE3 LYS 12 HE3 LYS 12 -10.528 11.116 -3.850 92 HZ1 LYS 12 HZ1 LYS 12 -9.421 13.039 -2.946 93 HZ2 LYS 12 HZ2 LYS 12 -9.134 11.744 -1.995 94 HZ3 LYS 12 HZ3 LYS 12 -7.967 12.300 -2.992 95 H TRP 13 H TRP 13 -6.585 5.550 -1.157 96 HA TRP 13 HA TRP 13 -5.771 7.597 0.831 97 HB2 TRP 13 HB2 TRP 13 -5.071 4.634 0.973 98 HB3 TRP 13 HB3 TRP 13 -4.968 5.859 2.245 99 HD1 TRP 13 HD1 TRP 13 -8.120 5.088 0.071 100 HE1 TRP 13 HE1 TRP 13 -10.076 4.462 1.619 101 HE3 TRP 13 HE3 TRP 13 -5.580 4.956 4.529 102 HZ2 TRP 13 HZ2 TRP 13 -10.497 3.903 4.348 103 HZ3 TRP 13 HZ3 TRP 13 -6.833 4.333 6.579 104 HH2 TRP 13 HH2 TRP 13 -9.255 3.817 6.488 105 H TYR 14 H TYR 14 -3.717 8.365 0.555 106 HA TYR 14 HA TYR 14 -2.269 7.425 -1.785 107 HB2 TYR 14 HB2 TYR 14 -1.669 9.914 -0.153 108 HB3 TYR 14 HB3 TYR 14 -1.121 9.520 -1.788 109 HD1 TYR 14 HD1 TYR 14 -3.370 8.863 -3.384 110 HD2 TYR 14 HD2 TYR 14 -3.204 11.593 -0.075 111 HE1 TYR 14 HE1 TYR 14 -5.309 10.103 -4.308 112 HE2 TYR 14 HE2 TYR 14 -5.141 12.824 -0.983 113 HH TYR 14 HH TYR 14 -6.552 11.967 -4.160 114 H VAL 15 H VAL 15 -0.039 6.738 -1.752 115 HA VAL 15 HA VAL 15 0.852 6.237 1.012 116 HB VAL 15 HB VAL 15 0.357 4.202 -0.296 117 HG11 VAL 15 HG11 VAL 15 1.737 3.580 -2.250 118 HG12 VAL 15 HG12 VAL 15 0.734 5.039 -2.553 119 HG13 VAL 15 HG13 VAL 15 2.491 5.210 -2.222 120 HG21 VAL 15 HG21 VAL 15 2.523 3.044 0.000 121 HG22 VAL 15 HG22 VAL 15 3.335 4.634 0.192 122 HG23 VAL 15 HG23 VAL 15 2.112 4.100 1.394 123 H VAL 16 H VAL 16 2.707 7.178 1.698 124 HA VAL 16 HA VAL 16 4.423 8.444 -0.323 125 HB VAL 16 HB VAL 16 5.058 10.088 1.380 126 HG11 VAL 16 HG11 VAL 16 2.934 11.343 1.446 127 HG12 VAL 16 HG12 VAL 16 3.230 10.604 -0.164 128 HG13 VAL 16 HG13 VAL 16 2.046 9.859 0.962 129 HG21 VAL 16 HG21 VAL 16 3.796 10.260 3.491 130 HG22 VAL 16 HG22 VAL 16 2.951 8.722 3.106 131 HG23 VAL 16 HG23 VAL 16 4.726 8.727 3.384 132 H ALA 17 H ALA 17 4.252 5.668 1.440 133 HA ALA 17 HA ALA 17 7.159 5.823 1.947 134 HB1 ALA 17 HB1 ALA 17 6.743 4.239 3.805 135 HB2 ALA 17 HB2 ALA 17 5.861 5.781 4.069 136 HB3 ALA 17 HB3 ALA 17 4.977 4.329 3.491 137 H LEU 18 H LEU 18 8.292 4.032 1.139 138 HA LEU 18 HA LEU 18 6.660 1.851 0.011 139 HB2 LEU 18 HB2 LEU 18 8.984 3.346 -1.329 140 HB3 LEU 18 HB3 LEU 18 8.095 1.974 -2.004 141 HG LEU 18 HG LEU 18 6.854 4.694 -1.433 142 HD11 LEU 18 HD11 LEU 18 6.949 5.125 -3.870 143 HD12 LEU 18 HD12 LEU 18 8.580 4.992 -3.130 144 HD13 LEU 18 HD13 LEU 18 7.914 3.626 -4.087 145 HD21 LEU 18 HD21 LEU 18 5.064 3.881 -2.968 146 HD22 LEU 18 HD22 LEU 18 5.914 2.304 -3.095 147 HD23 LEU 18 HD23 LEU 18 5.243 2.838 -1.517 148 H ALA 19 H ALA 19 7.637 -0.117 0.264 149 HA ALA 19 HA ALA 19 10.419 -0.196 1.207 150 HB1 ALA 19 HB1 ALA 19 9.738 -1.749 2.991 151 HB2 ALA 19 HB2 ALA 19 9.000 -0.127 3.214 152 HB3 ALA 19 HB3 ALA 19 8.013 -1.482 2.569 153 H SER 20 H SER 20 11.469 -2.159 0.659 154 HA SER 20 HA SER 20 9.863 -4.092 -0.863 155 HB2 SER 20 HB2 SER 20 12.458 -2.787 -1.837 156 HB3 SER 20 HB3 SER 20 11.556 -4.066 -2.661 157 HG SER 20 HG SER 20 11.140 -1.829 -3.424 158 H ASN 21 H ASN 21 10.988 -6.218 -1.018 159 HA ASN 21 HA ASN 21 12.856 -6.511 1.262 160 HB2 ASN 21 HB2 ASN 21 10.541 -7.822 0.722 161 HB3 ASN 21 HB3 ASN 21 11.578 -8.764 -0.357 162 HD21 ASN 21 HD21 ASN 21 13.883 -9.106 1.005 163 HD22 ASN 21 HD22 ASN 21 13.610 -9.989 2.470 164 H THR 22 H THR 22 12.727 -6.413 -2.197 165 HA THR 22 HA THR 22 15.393 -7.515 -2.312 166 HB THR 22 HB THR 22 14.955 -7.958 -4.790 167 HG1 THR 22 HG1 THR 22 12.490 -8.139 -4.883 168 HG21 THR 22 HG21 THR 22 13.766 -10.002 -4.119 169 HG22 THR 22 HG22 THR 22 14.991 -9.595 -2.871 170 HG23 THR 22 HG23 THR 22 13.257 -9.235 -2.577 171 H GLU 23 H GLU 23 17.348 -6.651 -3.298 172 HA GLU 23 HA GLU 23 17.363 -3.814 -3.283 173 HB2 GLU 23 HB2 GLU 23 19.406 -4.084 -4.776 174 HB3 GLU 23 HB3 GLU 23 19.470 -4.929 -3.223 175 HG2 GLU 23 HG2 GLU 23 18.481 -6.435 -5.653 176 HG3 GLU 23 HG3 GLU 23 20.213 -6.110 -5.501 177 H PHE 24 H PHE 24 16.579 -6.334 -5.811 178 HA PHE 24 HA PHE 24 16.549 -4.865 -8.139 179 HB2 PHE 24 HB2 PHE 24 14.829 -7.158 -7.110 180 HB3 PHE 24 HB3 PHE 24 14.589 -6.479 -8.725 181 HD1 PHE 24 HD1 PHE 24 16.982 -8.269 -6.525 182 HD2 PHE 24 HD2 PHE 24 16.127 -6.918 -10.509 183 HE1 PHE 24 HE1 PHE 24 18.799 -9.706 -7.399 184 HE2 PHE 24 HE2 PHE 24 17.943 -8.352 -11.388 185 HZ PHE 24 HZ PHE 24 19.285 -9.748 -9.833 186 H PHE 25 H PHE 25 13.816 -5.361 -5.756 187 HA PHE 25 HA PHE 25 12.079 -3.645 -7.159 188 HB2 PHE 25 HB2 PHE 25 12.106 -5.021 -4.484 189 HB3 PHE 25 HB3 PHE 25 11.000 -3.657 -4.692 190 HD1 PHE 25 HD1 PHE 25 12.033 -6.871 -6.338 191 HD2 PHE 25 HD2 PHE 25 8.909 -3.997 -5.690 192 HE1 PHE 25 HE1 PHE 25 10.430 -8.354 -7.504 193 HE2 PHE 25 HE2 PHE 25 7.305 -5.475 -6.860 194 HZ PHE 25 HZ PHE 25 8.062 -7.659 -7.769 195 H LEU 26 H LEU 26 14.514 -3.071 -4.518 196 HA LEU 26 HA LEU 26 13.513 -0.632 -3.626 197 HB2 LEU 26 HB2 LEU 26 16.475 -1.295 -4.083 198 HB3 LEU 26 HB3 LEU 26 15.782 -0.310 -2.788 199 HG LEU 26 HG LEU 26 15.492 -3.330 -3.065 200 HD11 LEU 26 HD11 LEU 26 16.991 -3.432 -1.104 201 HD12 LEU 26 HD12 LEU 26 17.790 -2.677 -2.525 202 HD13 LEU 26 HD13 LEU 26 17.199 -1.649 -1.176 203 HD21 LEU 26 HD21 LEU 26 14.559 -3.208 -0.779 204 HD22 LEU 26 HD22 LEU 26 14.649 -1.415 -0.845 205 HD23 LEU 26 HD23 LEU 26 13.559 -2.301 -1.963 206 H ARG 27 H ARG 27 16.184 -1.120 -6.138 207 HA ARG 27 HA ARG 27 16.326 1.601 -6.830 208 HB2 ARG 27 HB2 ARG 27 18.049 -0.148 -7.307 209 HB3 ARG 27 HB3 ARG 27 16.970 -0.862 -8.513 210 HG2 ARG 27 HG2 ARG 27 16.998 1.653 -9.488 211 HG3 ARG 27 HG3 ARG 27 18.540 1.710 -8.625 212 HD2 ARG 27 HD2 ARG 27 19.101 0.938 -10.804 213 HD3 ARG 27 HD3 ARG 27 19.134 -0.512 -9.792 214 HE ARG 27 HE ARG 27 16.539 -0.432 -10.783 215 HH11 ARG 27 HH11 ARG 27 19.761 -0.503 -12.196 216 HH12 ARG 27 HH12 ARG 27 19.235 -1.286 -13.648 217 HH21 ARG 27 HH21 ARG 27 15.865 -1.441 -12.679 218 HH22 ARG 27 HH22 ARG 27 17.009 -1.821 -13.923 219 H GLU 28 H GLU 28 14.079 -0.976 -7.735 220 HA GLU 28 HA GLU 28 13.149 0.326 -10.109 221 HB2 GLU 28 HB2 GLU 28 12.003 -1.929 -8.424 222 HB3 GLU 28 HB3 GLU 28 11.314 -1.358 -9.949 223 HG2 GLU 28 HG2 GLU 28 14.017 -2.693 -9.504 224 HG3 GLU 28 HG3 GLU 28 12.637 -3.315 -10.418 225 H LYS 29 H LYS 29 11.829 -0.148 -6.726 226 HA LYS 29 HA LYS 29 9.626 1.527 -7.266 227 HB2 LYS 29 HB2 LYS 29 10.471 -0.219 -5.176 228 HB3 LYS 29 HB3 LYS 29 10.215 1.367 -4.436 229 HG2 LYS 29 HG2 LYS 29 8.141 0.095 -6.276 230 HG3 LYS 29 HG3 LYS 29 8.204 -0.265 -4.546 231 HD2 LYS 29 HD2 LYS 29 6.630 1.506 -4.728 232 HD3 LYS 29 HD3 LYS 29 8.106 2.284 -4.142 233 HE2 LYS 29 HE2 LYS 29 7.496 3.751 -5.840 234 HE3 LYS 29 HE3 LYS 29 8.606 2.687 -6.713 235 HZ1 LYS 29 HZ1 LYS 29 6.947 2.263 -8.079 236 HZ2 LYS 29 HZ2 LYS 29 6.097 1.544 -6.885 237 HZ3 LYS 29 HZ3 LYS 29 5.885 3.133 -7.194 238 H ASP 30 H ASP 30 12.822 2.179 -5.556 239 HA ASP 30 HA ASP 30 12.088 4.730 -4.672 240 HB2 ASP 30 HB2 ASP 30 14.101 3.958 -3.748 241 HB3 ASP 30 HB3 ASP 30 14.633 3.206 -5.258 242 H LYS 31 H LYS 31 13.822 3.742 -7.775 243 HA LYS 31 HA LYS 31 13.998 6.437 -8.629 244 HB2 LYS 31 HB2 LYS 31 14.765 3.782 -9.513 245 HB3 LYS 31 HB3 LYS 31 13.972 4.624 -10.851 246 HG2 LYS 31 HG2 LYS 31 16.401 5.604 -9.282 247 HG3 LYS 31 HG3 LYS 31 16.403 4.945 -10.923 248 HD2 LYS 31 HD2 LYS 31 16.394 7.221 -11.392 249 HD3 LYS 31 HD3 LYS 31 14.656 6.891 -11.408 250 HE2 LYS 31 HE2 LYS 31 15.685 7.497 -8.696 251 HE3 LYS 31 HE3 LYS 31 15.967 8.812 -9.843 252 HZ1 LYS 31 HZ1 LYS 31 13.845 9.334 -9.699 253 HZ2 LYS 31 HZ2 LYS 31 13.354 7.845 -10.156 254 HZ3 LYS 31 HZ3 LYS 31 13.606 8.172 -8.576 255 H MET 32 H MET 32 11.303 4.209 -8.492 256 HA MET 32 HA MET 32 10.096 5.135 -10.843 257 HB2 MET 32 HB2 MET 32 9.310 3.488 -8.449 258 HB3 MET 32 HB3 MET 32 7.982 4.251 -9.334 259 HG2 MET 32 HG2 MET 32 10.070 2.554 -10.748 260 HG3 MET 32 HG3 MET 32 8.665 1.831 -9.954 261 HE1 MET 32 HE1 MET 32 8.434 5.318 -12.654 262 HE2 MET 32 HE2 MET 32 9.947 4.501 -12.135 263 HE3 MET 32 HE3 MET 32 9.210 4.102 -13.723 264 H LYS 33 H LYS 33 8.548 5.628 -7.529 265 HA LYS 33 HA LYS 33 8.452 8.285 -7.385 266 HB2 LYS 33 HB2 LYS 33 7.054 7.596 -9.816 267 HB3 LYS 33 HB3 LYS 33 5.982 8.409 -8.668 268 HG2 LYS 33 HG2 LYS 33 7.285 10.379 -8.630 269 HG3 LYS 33 HG3 LYS 33 8.753 9.549 -9.164 270 HD2 LYS 33 HD2 LYS 33 7.732 9.143 -11.397 271 HD3 LYS 33 HD3 LYS 33 6.237 9.927 -10.868 272 HE2 LYS 33 HE2 LYS 33 7.304 12.071 -10.676 273 HE3 LYS 33 HE3 LYS 33 8.921 11.364 -10.797 274 HZ1 LYS 33 HZ1 LYS 33 8.226 12.342 -12.869 275 HZ2 LYS 33 HZ2 LYS 33 8.400 10.731 -13.066 276 HZ3 LYS 33 HZ3 LYS 33 6.908 11.384 -12.955 277 H MET 34 H MET 34 5.901 9.036 -6.712 278 HA MET 34 HA MET 34 5.386 7.492 -4.362 279 HB2 MET 34 HB2 MET 34 5.064 10.006 -4.697 280 HB3 MET 34 HB3 MET 34 3.670 9.631 -5.718 281 HG2 MET 34 HG2 MET 34 2.588 8.453 -3.807 282 HG3 MET 34 HG3 MET 34 3.982 8.832 -2.786 283 HE1 MET 34 HE1 MET 34 1.119 12.039 -4.563 284 HE2 MET 34 HE2 MET 34 2.289 11.114 -5.564 285 HE3 MET 34 HE3 MET 34 0.909 10.269 -4.785 286 H ALA 35 H ALA 35 2.969 6.726 -3.937 287 HA ALA 35 HA ALA 35 1.840 5.531 -6.363 288 HB1 ALA 35 HB1 ALA 35 1.429 3.431 -5.123 289 HB2 ALA 35 HB2 ALA 35 3.176 3.793 -5.329 290 HB3 ALA 35 HB3 ALA 35 2.380 4.079 -3.745 291 H MET 36 H MET 36 -0.431 4.557 -5.913 292 HA MET 36 HA MET 36 -1.876 6.373 -4.080 293 HB2 MET 36 HB2 MET 36 -2.732 5.393 -6.864 294 HB3 MET 36 HB3 MET 36 -3.691 6.415 -5.786 295 HG2 MET 36 HG2 MET 36 -0.997 7.249 -6.938 296 HG3 MET 36 HG3 MET 36 -2.546 7.591 -7.720 297 HE1 MET 36 HE1 MET 36 -0.982 10.905 -5.942 298 HE2 MET 36 HE2 MET 36 -0.121 9.487 -6.629 299 HE3 MET 36 HE3 MET 36 -1.471 10.244 -7.539 300 H ALA 37 H ALA 37 -4.131 5.372 -3.543 301 HA ALA 37 HA ALA 37 -4.394 2.543 -4.060 302 HB1 ALA 37 HB1 ALA 37 -4.372 1.972 -1.635 303 HB2 ALA 37 HB2 ALA 37 -2.771 2.580 -2.175 304 HB3 ALA 37 HB3 ALA 37 -3.873 3.653 -1.248 305 H ARG 38 H ARG 38 -6.569 2.036 -4.053 306 HA ARG 38 HA ARG 38 -8.387 3.913 -2.661 307 HB2 ARG 38 HB2 ARG 38 -8.561 4.406 -5.001 308 HB3 ARG 38 HB3 ARG 38 -8.541 2.695 -5.445 309 HG2 ARG 38 HG2 ARG 38 -10.764 2.461 -4.177 310 HG3 ARG 38 HG3 ARG 38 -10.790 4.226 -4.063 311 HD2 ARG 38 HD2 ARG 38 -10.688 4.412 -6.539 312 HD3 ARG 38 HD3 ARG 38 -10.587 2.653 -6.685 313 HE ARG 38 HE ARG 38 -12.878 2.522 -5.775 314 HH11 ARG 38 HH11 ARG 38 -11.784 5.695 -6.831 315 HH12 ARG 38 HH12 ARG 38 -13.389 6.300 -7.070 316 HH21 ARG 38 HH21 ARG 38 -14.974 3.331 -6.108 317 HH22 ARG 38 HH22 ARG 38 -15.199 4.958 -6.660 318 H ILE 39 H ILE 39 -9.761 2.863 -1.239 319 HA ILE 39 HA ILE 39 -9.754 -0.070 -1.440 320 HB ILE 39 HB ILE 39 -10.399 1.732 0.949 321 HG12 ILE 39 HG12 ILE 39 -8.052 1.991 0.401 322 HG13 ILE 39 HG13 ILE 39 -8.220 1.042 1.883 323 HG21 ILE 39 HG21 ILE 39 -10.196 -0.349 2.278 324 HG22 ILE 39 HG22 ILE 39 -11.512 -0.443 1.059 325 HG23 ILE 39 HG23 ILE 39 -9.951 -1.280 0.762 326 HD11 ILE 39 HD11 ILE 39 -6.472 0.115 0.434 327 HD12 ILE 39 HD12 ILE 39 -7.831 -1.045 0.608 328 HD13 ILE 39 HD13 ILE 39 -7.661 -0.082 -0.898 329 H SER 40 H SER 40 -11.650 -1.019 -2.057 330 HA SER 40 HA SER 40 -14.156 0.465 -1.543 331 HB2 SER 40 HB2 SER 40 -13.621 -1.363 -3.939 332 HB3 SER 40 HB3 SER 40 -14.941 -0.206 -3.720 333 HG SER 40 HG SER 40 -13.282 0.605 -5.158 334 H PHE 41 H PHE 41 -15.618 -0.734 -0.318 335 HA PHE 41 HA PHE 41 -14.928 -3.543 0.089 336 HB2 PHE 41 HB2 PHE 41 -16.696 -3.395 1.855 337 HB3 PHE 41 HB3 PHE 41 -15.305 -2.331 2.103 338 HD1 PHE 41 HD1 PHE 41 -15.540 0.150 1.708 339 HD2 PHE 41 HD2 PHE 41 -18.903 -2.519 1.565 340 HE1 PHE 41 HE1 PHE 41 -17.082 2.079 1.933 341 HE2 PHE 41 HE2 PHE 41 -20.442 -0.597 1.785 342 HZ PHE 41 HZ PHE 41 -19.539 1.709 1.969 343 H LEU 42 H LEU 42 -15.744 -4.924 -1.461 344 HA LEU 42 HA LEU 42 -18.173 -4.211 -2.820 345 HB2 LEU 42 HB2 LEU 42 -16.093 -5.473 -3.748 346 HB3 LEU 42 HB3 LEU 42 -16.602 -6.861 -2.778 347 HG LEU 42 HG LEU 42 -17.174 -7.067 -5.180 348 HD11 LEU 42 HD11 LEU 42 -19.521 -7.771 -4.879 349 HD12 LEU 42 HD12 LEU 42 -18.477 -8.290 -3.512 350 HD13 LEU 42 HD13 LEU 42 -19.580 -6.886 -3.317 351 HD21 LEU 42 HD21 LEU 42 -19.017 -5.710 -6.120 352 HD22 LEU 42 HD22 LEU 42 -19.044 -4.721 -4.621 353 HD23 LEU 42 HD23 LEU 42 -17.595 -4.705 -5.682 354 H GLY 43 H GLY 43 -17.179 -6.563 -0.308 355 HA2 GLY 43 HA2 GLY 43 -19.943 -7.186 0.343 356 HA3 GLY 43 HA3 GLY 43 -18.946 -8.503 -0.288 357 H GLU 44 H GLU 44 -19.867 -9.000 2.217 358 HA GLU 44 HA GLU 44 -18.456 -7.926 4.376 359 HB2 GLU 44 HB2 GLU 44 -19.201 -10.875 3.908 360 HB3 GLU 44 HB3 GLU 44 -19.123 -10.035 5.462 361 HG2 GLU 44 HG2 GLU 44 -21.049 -8.720 3.719 362 HG3 GLU 44 HG3 GLU 44 -21.391 -10.453 3.809 363 H ASP 45 H ASP 45 -17.642 -10.832 2.193 364 HA ASP 45 HA ASP 45 -14.931 -10.790 3.356 365 HB2 ASP 45 HB2 ASP 45 -15.909 -12.928 3.712 366 HB3 ASP 45 HB3 ASP 45 -16.567 -13.001 2.072 367 H GLU 46 H GLU 46 -16.447 -9.254 0.898 368 HA GLU 46 HA GLU 46 -14.262 -9.908 -1.012 369 HB2 GLU 46 HB2 GLU 46 -16.837 -10.378 -1.478 370 HB3 GLU 46 HB3 GLU 46 -16.988 -8.617 -1.540 371 HG2 GLU 46 HG2 GLU 46 -16.767 -9.082 -3.776 372 HG3 GLU 46 HG3 GLU 46 -15.071 -8.803 -3.361 373 H LEU 47 H LEU 47 -12.923 -8.277 -1.323 374 HA LEU 47 HA LEU 47 -13.832 -5.536 -0.855 375 HB2 LEU 47 HB2 LEU 47 -11.635 -5.082 0.254 376 HB3 LEU 47 HB3 LEU 47 -12.743 -6.084 1.199 377 HG LEU 47 HG LEU 47 -10.687 -7.511 -0.459 378 HD11 LEU 47 HD11 LEU 47 -8.977 -7.215 1.310 379 HD12 LEU 47 HD12 LEU 47 -9.388 -5.660 0.510 380 HD13 LEU 47 HD13 LEU 47 -10.047 -6.034 2.139 381 HD21 LEU 47 HD21 LEU 47 -10.669 -8.990 1.532 382 HD22 LEU 47 HD22 LEU 47 -11.799 -7.871 2.366 383 HD23 LEU 47 HD23 LEU 47 -12.330 -8.751 0.893 384 H LYS 48 H LYS 48 -12.945 -4.030 -2.264 385 HA LYS 48 HA LYS 48 -11.134 -5.168 -4.294 386 HB2 LYS 48 HB2 LYS 48 -13.352 -4.725 -5.219 387 HB3 LYS 48 HB3 LYS 48 -13.372 -3.101 -4.518 388 HG2 LYS 48 HG2 LYS 48 -11.319 -2.568 -5.955 389 HG3 LYS 48 HG3 LYS 48 -11.568 -4.123 -6.759 390 HD2 LYS 48 HD2 LYS 48 -13.787 -2.035 -6.545 391 HD3 LYS 48 HD3 LYS 48 -12.610 -2.022 -7.865 392 HE2 LYS 48 HE2 LYS 48 -14.370 -4.425 -7.154 393 HE3 LYS 48 HE3 LYS 48 -14.778 -3.229 -8.391 394 HZ1 LYS 48 HZ1 LYS 48 -13.564 -4.422 -9.771 395 HZ2 LYS 48 HZ2 LYS 48 -12.209 -4.071 -8.929 396 HZ3 LYS 48 HZ3 LYS 48 -13.052 -5.429 -8.592 397 H VAL 49 H VAL 49 -9.160 -4.187 -4.443 398 HA VAL 49 HA VAL 49 -8.966 -1.452 -3.377 399 HB VAL 49 HB VAL 49 -6.669 -2.019 -2.603 400 HG11 VAL 49 HG11 VAL 49 -7.371 -3.266 -0.582 401 HG12 VAL 49 HG12 VAL 49 -8.550 -1.987 -1.027 402 HG13 VAL 49 HG13 VAL 49 -8.909 -3.707 -1.397 403 HG21 VAL 49 HG21 VAL 49 -6.032 -4.390 -2.318 404 HG22 VAL 49 HG22 VAL 49 -7.509 -4.888 -3.210 405 HG23 VAL 49 HG23 VAL 49 -6.228 -3.948 -4.047 406 H SER 50 H SER 50 -7.877 -0.011 -4.775 407 HA SER 50 HA SER 50 -6.619 -1.302 -7.106 408 HB2 SER 50 HB2 SER 50 -7.283 0.815 -8.338 409 HB3 SER 50 HB3 SER 50 -8.645 -0.199 -7.845 410 HG SER 50 HG SER 50 -8.428 2.346 -7.358 411 H TYR 51 H TYR 51 -4.466 -0.744 -7.561 412 HA TYR 51 HA TYR 51 -3.420 1.465 -5.885 413 HB2 TYR 51 HB2 TYR 51 -2.370 -1.131 -7.115 414 HB3 TYR 51 HB3 TYR 51 -1.242 0.198 -6.816 415 HD1 TYR 51 HD1 TYR 51 -1.979 1.238 -4.218 416 HD2 TYR 51 HD2 TYR 51 -1.939 -2.851 -5.545 417 HE1 TYR 51 HE1 TYR 51 -1.591 0.492 -1.896 418 HE2 TYR 51 HE2 TYR 51 -1.580 -3.600 -3.204 419 HH TYR 51 HH TYR 51 -1.982 -2.723 -0.880 420 H ALA 52 H ALA 52 -2.495 3.234 -7.068 421 HA ALA 52 HA ALA 52 -2.160 2.816 -9.966 422 HB1 ALA 52 HB1 ALA 52 -3.072 5.099 -10.331 423 HB2 ALA 52 HB2 ALA 52 -4.293 3.995 -9.614 424 HB3 ALA 52 HB3 ALA 52 -3.467 5.211 -8.583 425 H VAL 53 H VAL 53 -0.112 3.265 -10.582 426 HA VAL 53 HA VAL 53 1.291 5.283 -8.997 427 HB VAL 53 HB VAL 53 3.403 3.988 -9.477 428 HG11 VAL 53 HG11 VAL 53 3.005 2.226 -7.779 429 HG12 VAL 53 HG12 VAL 53 2.274 3.796 -7.304 430 HG13 VAL 53 HG13 VAL 53 1.235 2.479 -7.944 431 HG21 VAL 53 HG21 VAL 53 3.230 1.613 -10.152 432 HG22 VAL 53 HG22 VAL 53 1.468 1.826 -10.428 433 HG23 VAL 53 HG23 VAL 53 2.650 2.724 -11.439 434 HA PRO 54 HA PRO 54 2.044 6.976 -13.010 435 HB2 PRO 54 HB2 PRO 54 4.111 8.694 -12.433 436 HB3 PRO 54 HB3 PRO 54 2.516 9.015 -11.740 437 HG2 PRO 54 HG2 PRO 54 4.922 7.685 -10.453 438 HG3 PRO 54 HG3 PRO 54 3.845 8.919 -9.784 439 HD2 PRO 54 HD2 PRO 54 3.558 6.235 -9.208 440 HD3 PRO 54 HD3 PRO 54 2.188 7.353 -9.214 441 H LYS 55 H LYS 55 2.669 5.192 -14.088 442 HA LYS 55 HA LYS 55 5.418 4.235 -13.935 443 HB2 LYS 55 HB2 LYS 55 3.456 2.668 -13.998 444 HB3 LYS 55 HB3 LYS 55 3.059 3.274 -15.611 445 HG2 LYS 55 HG2 LYS 55 5.537 2.626 -16.214 446 HG3 LYS 55 HG3 LYS 55 5.482 1.663 -14.731 447 HD2 LYS 55 HD2 LYS 55 3.450 0.466 -15.605 448 HD3 LYS 55 HD3 LYS 55 3.553 1.407 -17.099 449 HE2 LYS 55 HE2 LYS 55 4.707 -0.522 -17.727 450 HE3 LYS 55 HE3 LYS 55 6.047 0.500 -17.191 451 HZ1 LYS 55 HZ1 LYS 55 6.188 -1.703 -16.263 452 HZ2 LYS 55 HZ2 LYS 55 5.961 -0.625 -15.057 453 HZ3 LYS 55 HZ3 LYS 55 4.724 -1.569 -15.553 454 HA PRO 56 HA PRO 56 7.124 6.817 -17.063 455 HB2 PRO 56 HB2 PRO 56 7.825 4.109 -18.344 456 HB3 PRO 56 HB3 PRO 56 8.895 5.490 -18.067 457 HG2 PRO 56 HG2 PRO 56 8.988 3.335 -16.451 458 HG3 PRO 56 HG3 PRO 56 9.227 4.962 -15.801 459 HD2 PRO 56 HD2 PRO 56 6.891 3.123 -15.468 460 HD3 PRO 56 HD3 PRO 56 7.420 4.454 -14.431 461 H ASN 57 H ASN 57 5.522 3.884 -18.277 462 HA ASN 57 HA ASN 57 4.762 5.074 -20.698 463 HB2 ASN 57 HB2 ASN 57 3.838 2.350 -19.841 464 HB3 ASN 57 HB3 ASN 57 3.756 3.076 -21.451 465 HD21 ASN 57 HD21 ASN 57 5.677 3.215 -22.728 466 HD22 ASN 57 HD22 ASN 57 7.165 2.469 -22.248 467 H GLY 58 H GLY 58 3.706 6.657 -18.542 468 HA2 GLY 58 HA2 GLY 58 1.699 7.825 -18.500 469 HA3 GLY 58 HA3 GLY 58 0.891 6.493 -19.337 470 H CYS 59 H CYS 59 0.043 7.847 -16.822 471 HA CYS 59 HA CYS 59 0.620 6.582 -14.488 472 HB2 CYS 59 HB2 CYS 59 -2.129 7.505 -15.407 473 HB3 CYS 59 HB3 CYS 59 -1.626 7.223 -13.735 474 H ARG 60 H ARG 60 0.533 4.524 -13.691 475 HA ARG 60 HA ARG 60 -1.171 2.641 -15.165 476 HB2 ARG 60 HB2 ARG 60 1.451 2.404 -14.790 477 HB3 ARG 60 HB3 ARG 60 0.949 1.765 -13.220 478 HG2 ARG 60 HG2 ARG 60 1.116 -0.126 -14.655 479 HG3 ARG 60 HG3 ARG 60 -0.617 0.181 -14.478 480 HD2 ARG 60 HD2 ARG 60 1.097 1.171 -16.817 481 HD3 ARG 60 HD3 ARG 60 0.103 -0.292 -16.851 482 HE ARG 60 HE ARG 60 -0.872 2.505 -16.854 483 HH11 ARG 60 HH11 ARG 60 -1.625 -0.931 -16.806 484 HH12 ARG 60 HH12 ARG 60 -3.261 -0.703 -17.326 485 HH21 ARG 60 HH21 ARG 60 -3.017 2.786 -17.540 486 HH22 ARG 60 HH22 ARG 60 -4.053 1.413 -17.744 487 H LYS 61 H LYS 61 -2.643 1.288 -14.130 488 HA LYS 61 HA LYS 61 -2.921 1.599 -11.270 489 HB2 LYS 61 HB2 LYS 61 -5.089 2.294 -11.186 490 HB3 LYS 61 HB3 LYS 61 -4.391 3.298 -12.464 491 HG2 LYS 61 HG2 LYS 61 -5.429 2.022 -14.184 492 HG3 LYS 61 HG3 LYS 61 -5.823 0.698 -13.080 493 HD2 LYS 61 HD2 LYS 61 -7.095 2.617 -11.739 494 HD3 LYS 61 HD3 LYS 61 -7.073 3.436 -13.307 495 HE2 LYS 61 HE2 LYS 61 -9.125 2.109 -13.074 496 HE3 LYS 61 HE3 LYS 61 -8.121 1.464 -14.379 497 HZ1 LYS 61 HZ1 LYS 61 -9.111 0.050 -12.308 498 HZ2 LYS 61 HZ2 LYS 61 -7.906 -0.441 -13.294 499 HZ3 LYS 61 HZ3 LYS 61 -7.554 0.257 -11.860 500 H TRP 62 H TRP 62 -4.611 0.011 -10.320 501 HA TRP 62 HA TRP 62 -5.392 -2.198 -11.912 502 HB2 TRP 62 HB2 TRP 62 -3.036 -2.739 -11.864 503 HB3 TRP 62 HB3 TRP 62 -3.032 -2.679 -10.096 504 HD1 TRP 62 HD1 TRP 62 -3.727 -4.783 -8.822 505 HE1 TRP 62 HE1 TRP 62 -4.444 -7.160 -9.488 506 HE3 TRP 62 HE3 TRP 62 -4.635 -3.966 -13.810 507 HZ2 TRP 62 HZ2 TRP 62 -5.326 -8.522 -11.790 508 HZ3 TRP 62 HZ3 TRP 62 -5.439 -5.871 -15.188 509 HH2 TRP 62 HH2 TRP 62 -5.774 -8.113 -14.190 510 H GLU 63 H GLU 63 -6.522 -3.915 -10.474 511 HA GLU 63 HA GLU 63 -7.017 -2.983 -7.767 512 HB2 GLU 63 HB2 GLU 63 -9.485 -3.116 -8.063 513 HB3 GLU 63 HB3 GLU 63 -8.722 -1.733 -8.857 514 HG2 GLU 63 HG2 GLU 63 -9.132 -4.234 -10.481 515 HG3 GLU 63 HG3 GLU 63 -10.558 -3.272 -10.068 516 H THR 64 H THR 64 -7.761 -4.741 -6.387 517 HA THR 64 HA THR 64 -8.226 -7.264 -7.780 518 HB THR 64 HB THR 64 -6.208 -6.905 -5.497 519 HG1 THR 64 HG1 THR 64 -4.912 -7.954 -7.460 520 HG21 THR 64 HG21 THR 64 -5.724 -9.307 -5.850 521 HG22 THR 64 HG22 THR 64 -7.431 -9.043 -5.357 522 HG23 THR 64 HG23 THR 64 -7.036 -9.390 -7.074 523 H THR 65 H THR 65 -9.543 -8.823 -6.472 524 HA THR 65 HA THR 65 -10.819 -7.383 -4.227 525 HB THR 65 HB THR 65 -11.606 -10.062 -5.298 526 HG1 THR 65 HG1 THR 65 -12.784 -8.991 -7.116 527 HG21 THR 65 HG21 THR 65 -13.930 -9.180 -5.100 528 HG22 THR 65 HG22 THR 65 -13.002 -9.039 -3.569 529 HG23 THR 65 HG23 THR 65 -13.264 -7.590 -4.598 530 H PHE 66 H PHE 66 -9.995 -7.934 -2.230 531 HA PHE 66 HA PHE 66 -8.361 -10.389 -2.098 532 HB2 PHE 66 HB2 PHE 66 -8.747 -7.895 -0.320 533 HB3 PHE 66 HB3 PHE 66 -7.771 -9.284 0.177 534 HD1 PHE 66 HD1 PHE 66 -7.666 -7.948 -3.285 535 HD2 PHE 66 HD2 PHE 66 -5.771 -7.993 0.573 536 HE1 PHE 66 HE1 PHE 66 -5.651 -6.910 -4.257 537 HE2 PHE 66 HE2 PHE 66 -3.739 -6.954 -0.408 538 HZ PHE 66 HZ PHE 66 -3.683 -6.412 -2.835 539 H LYS 67 H LYS 67 -8.574 -11.346 0.320 540 HA LYS 67 HA LYS 67 -11.470 -11.685 0.746 541 HB2 LYS 67 HB2 LYS 67 -9.022 -13.442 0.837 542 HB3 LYS 67 HB3 LYS 67 -10.261 -13.762 2.058 543 HG2 LYS 67 HG2 LYS 67 -10.489 -15.176 0.010 544 HG3 LYS 67 HG3 LYS 67 -11.933 -14.220 0.367 545 HD2 LYS 67 HD2 LYS 67 -9.906 -12.956 -1.465 546 HD3 LYS 67 HD3 LYS 67 -10.791 -14.347 -2.104 547 HE2 LYS 67 HE2 LYS 67 -12.958 -13.212 -1.389 548 HE3 LYS 67 HE3 LYS 67 -12.009 -11.789 -0.939 549 HZ1 LYS 67 HZ1 LYS 67 -12.928 -11.669 -3.179 550 HZ2 LYS 67 HZ2 LYS 67 -11.298 -11.586 -3.203 551 HZ3 LYS 67 HZ3 LYS 67 -12.051 -12.965 -3.644 552 H LYS 68 H LYS 68 -12.256 -12.012 3.114 553 HA LYS 68 HA LYS 68 -10.778 -10.009 4.625 554 HB2 LYS 68 HB2 LYS 68 -13.297 -10.331 4.550 555 HB3 LYS 68 HB3 LYS 68 -13.095 -11.988 5.134 556 HG2 LYS 68 HG2 LYS 68 -13.974 -10.551 6.894 557 HG3 LYS 68 HG3 LYS 68 -12.371 -11.152 7.338 558 HD2 LYS 68 HD2 LYS 68 -12.003 -8.953 7.833 559 HD3 LYS 68 HD3 LYS 68 -11.609 -8.868 6.111 560 HE2 LYS 68 HE2 LYS 68 -13.791 -7.994 5.553 561 HE3 LYS 68 HE3 LYS 68 -14.436 -8.377 7.154 562 HZ1 LYS 68 HZ1 LYS 68 -13.895 -6.073 7.037 563 HZ2 LYS 68 HZ2 LYS 68 -12.831 -6.768 8.061 564 HZ3 LYS 68 HZ3 LYS 68 -12.364 -6.363 6.550 565 H THR 69 H THR 69 -8.674 -11.108 4.707 566 HA THR 69 HA THR 69 -8.769 -13.469 6.506 567 HB THR 69 HB THR 69 -6.397 -12.031 5.389 568 HG1 THR 69 HG1 THR 69 -7.596 -14.001 3.653 569 HG21 THR 69 HG21 THR 69 -5.376 -14.249 4.998 570 HG22 THR 69 HG22 THR 69 -5.834 -13.926 6.705 571 HG23 THR 69 HG23 THR 69 -6.849 -15.007 5.691 572 H SER 70 H SER 70 -9.563 -12.071 8.191 573 HA SER 70 HA SER 70 -7.865 -9.902 9.070 574 HB2 SER 70 HB2 SER 70 -10.120 -10.766 10.783 575 HB3 SER 70 HB3 SER 70 -9.683 -9.156 10.194 576 HG SER 70 HG SER 70 -11.754 -10.303 9.381 577 H ASP 71 H ASP 71 -6.130 -11.812 9.190 578 HA ASP 71 HA ASP 71 -6.323 -13.590 11.370 579 HB2 ASP 71 HB2 ASP 71 -4.755 -13.931 9.525 580 HB3 ASP 71 HB3 ASP 71 -3.930 -12.410 9.888 581 H ASP 72 H ASP 72 -4.303 -10.566 11.027 582 HA ASP 72 HA ASP 72 -4.301 -10.281 13.959 583 HB2 ASP 72 HB2 ASP 72 -2.195 -10.289 12.377 584 HB3 ASP 72 HB3 ASP 72 -2.693 -8.640 11.974 585 H GLY 73 H GLY 73 -6.532 -9.786 13.707 586 HA2 GLY 73 HA2 GLY 73 -8.264 -8.544 14.221 587 HA3 GLY 73 HA3 GLY 73 -7.213 -7.123 14.284 588 H GLU 74 H GLU 74 -6.384 -6.799 11.424 589 HA GLU 74 HA GLU 74 -8.850 -7.239 9.971 590 HB2 GLU 74 HB2 GLU 74 -7.729 -4.448 10.215 591 HB3 GLU 74 HB3 GLU 74 -8.927 -4.968 9.022 592 HG2 GLU 74 HG2 GLU 74 -10.522 -5.532 10.805 593 HG3 GLU 74 HG3 GLU 74 -9.318 -5.155 12.045 594 H VAL 75 H VAL 75 -6.798 -8.803 9.415 595 HA VAL 75 HA VAL 75 -4.954 -7.453 7.577 596 HB VAL 75 HB VAL 75 -5.292 -10.259 8.682 597 HG11 VAL 75 HG11 VAL 75 -3.149 -10.909 7.623 598 HG12 VAL 75 HG12 VAL 75 -4.464 -10.558 6.450 599 HG13 VAL 75 HG13 VAL 75 -3.159 -9.354 6.723 600 HG21 VAL 75 HG21 VAL 75 -3.092 -9.924 9.776 601 HG22 VAL 75 HG22 VAL 75 -3.089 -8.230 9.181 602 HG23 VAL 75 HG23 VAL 75 -4.360 -8.777 10.326 603 H TYR 76 H TYR 76 -4.574 -8.593 5.429 604 HA TYR 76 HA TYR 76 -6.991 -9.819 4.361 605 HB2 TYR 76 HB2 TYR 76 -5.779 -7.168 3.441 606 HB3 TYR 76 HB3 TYR 76 -6.801 -8.155 2.388 607 HD1 TYR 76 HD1 TYR 76 -9.144 -8.839 3.355 608 HD2 TYR 76 HD2 TYR 76 -6.792 -5.600 4.909 609 HE1 TYR 76 HE1 TYR 76 -11.171 -7.873 4.391 610 HE2 TYR 76 HE2 TYR 76 -8.824 -4.619 5.935 611 HH TYR 76 HH TYR 76 -11.008 -4.811 6.280 612 H TYR 77 H TYR 77 -6.768 -11.065 2.491 613 HA TYR 77 HA TYR 77 -3.990 -11.411 1.609 614 HB2 TYR 77 HB2 TYR 77 -5.922 -13.449 2.766 615 HB3 TYR 77 HB3 TYR 77 -4.814 -13.968 1.489 616 HD1 TYR 77 HD1 TYR 77 -4.442 -11.773 4.555 617 HD2 TYR 77 HD2 TYR 77 -3.044 -15.169 2.329 618 HE1 TYR 77 HE1 TYR 77 -2.673 -12.153 6.244 619 HE2 TYR 77 HE2 TYR 77 -1.284 -15.558 4.021 620 HH TYR 77 HH TYR 77 -0.972 -13.397 6.885 621 H SER 78 H SER 78 -3.713 -12.197 -0.545 622 HA SER 78 HA SER 78 -6.174 -12.150 -2.184 623 HB2 SER 78 HB2 SER 78 -3.312 -11.516 -3.045 624 HB3 SER 78 HB3 SER 78 -4.786 -11.329 -4.003 625 HG SER 78 HG SER 78 -5.356 -9.542 -2.885 626 H GLU 79 H GLU 79 -6.705 -14.379 -2.544 627 HA GLU 79 HA GLU 79 -4.668 -16.373 -2.501 628 HB2 GLU 79 HB2 GLU 79 -7.565 -16.151 -2.592 629 HB3 GLU 79 HB3 GLU 79 -7.051 -17.233 -3.893 630 HG2 GLU 79 HG2 GLU 79 -6.316 -17.539 -0.947 631 HG3 GLU 79 HG3 GLU 79 -7.597 -18.428 -1.783 632 H GLU 80 H GLU 80 -6.480 -14.646 -5.124 633 HA GLU 80 HA GLU 80 -5.684 -16.251 -7.240 634 HB2 GLU 80 HB2 GLU 80 -6.124 -13.215 -7.174 635 HB3 GLU 80 HB3 GLU 80 -6.179 -14.238 -8.616 636 HG2 GLU 80 HG2 GLU 80 -8.428 -14.101 -8.217 637 HG3 GLU 80 HG3 GLU 80 -8.077 -15.520 -7.221 638 H ALA 81 H ALA 81 -3.922 -13.472 -5.670 639 HA ALA 81 HA ALA 81 -1.690 -14.078 -7.486 640 HB1 ALA 81 HB1 ALA 81 -0.822 -11.847 -6.842 641 HB2 ALA 81 HB2 ALA 81 -2.447 -11.766 -7.601 642 HB3 ALA 81 HB3 ALA 81 -2.277 -11.594 -5.821 643 H LYS 82 H LYS 82 -2.665 -15.262 -4.619 644 HA LYS 82 HA LYS 82 -1.707 -15.996 -2.733 645 HB2 LYS 82 HB2 LYS 82 0.699 -16.331 -4.584 646 HB3 LYS 82 HB3 LYS 82 0.435 -17.175 -3.053 647 HG2 LYS 82 HG2 LYS 82 -1.437 -17.391 -5.459 648 HG3 LYS 82 HG3 LYS 82 -0.113 -18.517 -5.132 649 HD2 LYS 82 HD2 LYS 82 -1.131 -19.081 -2.920 650 HD3 LYS 82 HD3 LYS 82 -2.450 -17.944 -3.233 651 HE2 LYS 82 HE2 LYS 82 -1.818 -20.165 -5.219 652 HE3 LYS 82 HE3 LYS 82 -2.784 -20.502 -3.776 653 HZ1 LYS 82 HZ1 LYS 82 -4.517 -19.500 -4.687 654 HZ2 LYS 82 HZ2 LYS 82 -3.677 -18.181 -5.157 655 HZ3 LYS 82 HZ3 LYS 82 -3.714 -19.507 -6.108 656 H LYS 83 H LYS 83 -1.719 -13.191 -2.672 657 HA LYS 83 HA LYS 83 0.851 -12.630 -1.349 658 HB2 LYS 83 HB2 LYS 83 0.565 -10.252 -2.153 659 HB3 LYS 83 HB3 LYS 83 1.042 -11.437 -3.376 660 HG2 LYS 83 HG2 LYS 83 -1.208 -11.519 -4.287 661 HG3 LYS 83 HG3 LYS 83 -1.851 -10.563 -2.946 662 HD2 LYS 83 HD2 LYS 83 -1.329 -8.633 -3.995 663 HD3 LYS 83 HD3 LYS 83 0.365 -9.118 -4.145 664 HE2 LYS 83 HE2 LYS 83 0.104 -9.915 -6.298 665 HE3 LYS 83 HE3 LYS 83 -1.550 -10.473 -6.015 666 HZ1 LYS 83 HZ1 LYS 83 -1.448 -8.563 -7.485 667 HZ2 LYS 83 HZ2 LYS 83 -2.290 -8.199 -6.134 668 HZ3 LYS 83 HZ3 LYS 83 -0.765 -7.645 -6.320 669 H LYS 84 H LYS 84 0.731 -11.262 0.517 670 HA LYS 84 HA LYS 84 -1.970 -10.614 1.399 671 HB2 LYS 84 HB2 LYS 84 -1.611 -11.603 3.584 672 HB3 LYS 84 HB3 LYS 84 -1.350 -12.843 2.351 673 HG2 LYS 84 HG2 LYS 84 0.428 -13.217 3.815 674 HG3 LYS 84 HG3 LYS 84 1.184 -12.227 2.559 675 HD2 LYS 84 HD2 LYS 84 0.764 -10.176 3.984 676 HD3 LYS 84 HD3 LYS 84 0.125 -11.228 5.255 677 HE2 LYS 84 HE2 LYS 84 2.324 -12.482 5.261 678 HE3 LYS 84 HE3 LYS 84 2.931 -11.332 4.098 679 HZ1 LYS 84 HZ1 LYS 84 3.612 -10.575 6.162 680 HZ2 LYS 84 HZ2 LYS 84 2.377 -9.585 5.760 681 HZ3 LYS 84 HZ3 LYS 84 2.144 -10.782 6.846 682 H VAL 85 H VAL 85 -2.147 -8.890 2.948 683 HA VAL 85 HA VAL 85 0.374 -7.602 3.752 684 HB VAL 85 HB VAL 85 -0.446 -5.419 2.996 685 HG11 VAL 85 HG11 VAL 85 -0.226 -5.708 0.534 686 HG12 VAL 85 HG12 VAL 85 0.974 -6.695 1.436 687 HG13 VAL 85 HG13 VAL 85 -0.481 -7.475 0.730 688 HG21 VAL 85 HG21 VAL 85 -2.414 -5.210 1.495 689 HG22 VAL 85 HG22 VAL 85 -2.762 -6.957 1.722 690 HG23 VAL 85 HG23 VAL 85 -2.868 -5.831 3.117 691 H GLU 86 H GLU 86 0.007 -6.793 5.964 692 HA GLU 86 HA GLU 86 -2.828 -6.670 6.720 693 HB2 GLU 86 HB2 GLU 86 -2.187 -7.613 8.932 694 HB3 GLU 86 HB3 GLU 86 -1.948 -8.759 7.607 695 HG2 GLU 86 HG2 GLU 86 0.358 -7.083 8.669 696 HG3 GLU 86 HG3 GLU 86 -0.139 -8.576 9.476 697 H VAL 87 H VAL 87 -3.437 -4.963 8.016 698 HA VAL 87 HA VAL 87 -1.710 -2.715 8.025 699 HB VAL 87 HB VAL 87 -4.103 -2.384 7.935 700 HG11 VAL 87 HG11 VAL 87 -5.664 -3.205 9.701 701 HG12 VAL 87 HG12 VAL 87 -4.805 -4.553 8.882 702 HG13 VAL 87 HG13 VAL 87 -4.290 -4.022 10.518 703 HG21 VAL 87 HG21 VAL 87 -4.618 -1.015 9.942 704 HG22 VAL 87 HG22 VAL 87 -3.198 -1.728 10.779 705 HG23 VAL 87 HG23 VAL 87 -2.961 -0.709 9.320 706 H LEU 88 H LEU 88 -0.149 -2.181 9.517 707 HA LEU 88 HA LEU 88 0.172 -3.861 11.861 708 HB2 LEU 88 HB2 LEU 88 1.670 -1.370 10.902 709 HB3 LEU 88 HB3 LEU 88 2.207 -2.497 12.155 710 HG LEU 88 HG LEU 88 1.886 -3.181 9.199 711 HD11 LEU 88 HD11 LEU 88 4.364 -3.212 9.176 712 HD12 LEU 88 HD12 LEU 88 3.721 -1.587 9.587 713 HD13 LEU 88 HD13 LEU 88 4.383 -2.644 10.879 714 HD21 LEU 88 HD21 LEU 88 3.107 -5.244 9.805 715 HD22 LEU 88 HD22 LEU 88 3.079 -4.749 11.531 716 HD23 LEU 88 HD23 LEU 88 1.542 -5.114 10.676 717 H ASP 89 H ASP 89 -0.189 -0.280 11.149 718 HA ASP 89 HA ASP 89 -1.976 -0.009 13.388 719 HB2 ASP 89 HB2 ASP 89 0.376 0.117 14.385 720 HB3 ASP 89 HB3 ASP 89 0.572 1.629 13.488 721 H THR 90 H THR 90 -3.150 2.019 13.280 722 HA THR 90 HA THR 90 -2.485 3.838 11.124 723 HB THR 90 HB THR 90 -3.784 1.985 10.047 724 HG1 THR 90 HG1 THR 90 -4.861 3.421 8.826 725 HG21 THR 90 HG21 THR 90 -6.194 1.750 10.577 726 HG22 THR 90 HG22 THR 90 -5.151 1.302 11.968 727 HG23 THR 90 HG23 THR 90 -5.995 2.888 11.952 728 H ASP 91 H ASP 91 -3.700 5.907 11.330 729 HA ASP 91 HA ASP 91 -4.911 6.161 14.018 730 HB2 ASP 91 HB2 ASP 91 -2.826 7.503 13.486 731 HB3 ASP 91 HB3 ASP 91 -3.748 8.338 12.229 732 H TYR 92 H TYR 92 -7.000 7.267 14.138 733 HA TYR 92 HA TYR 92 -8.639 6.870 11.872 734 HB2 TYR 92 HB2 TYR 92 -8.973 8.281 14.553 735 HB3 TYR 92 HB3 TYR 92 -10.255 8.306 13.335 736 HD1 TYR 92 HD1 TYR 92 -7.928 5.714 14.823 737 HD2 TYR 92 HD2 TYR 92 -11.940 6.716 13.654 738 HE1 TYR 92 HE1 TYR 92 -8.700 3.485 15.569 739 HE2 TYR 92 HE2 TYR 92 -12.715 4.490 14.413 740 HH TYR 92 HH TYR 92 -12.162 2.538 15.298 741 H LYS 93 H LYS 93 -6.790 9.689 13.083 742 HA LYS 93 HA LYS 93 -7.687 11.100 10.699 743 HB2 LYS 93 HB2 LYS 93 -7.360 12.356 13.429 744 HB3 LYS 93 HB3 LYS 93 -7.575 13.242 11.914 745 HG2 LYS 93 HG2 LYS 93 -9.733 12.054 11.526 746 HG3 LYS 93 HG3 LYS 93 -9.518 11.169 13.042 747 HD2 LYS 93 HD2 LYS 93 -9.471 13.330 14.290 748 HD3 LYS 93 HD3 LYS 93 -9.702 14.207 12.773 749 HE2 LYS 93 HE2 LYS 93 -11.642 12.111 13.870 750 HE3 LYS 93 HE3 LYS 93 -11.820 13.855 14.103 751 HZ1 LYS 93 HZ1 LYS 93 -13.109 13.206 12.255 752 HZ2 LYS 93 HZ2 LYS 93 -11.841 14.037 11.648 753 HZ3 LYS 93 HZ3 LYS 93 -11.878 12.408 11.538 754 H SER 94 H SER 94 -5.172 9.396 11.031 755 HA SER 94 HA SER 94 -3.405 11.631 10.199 756 HB2 SER 94 HB2 SER 94 -3.144 11.112 12.732 757 HB3 SER 94 HB3 SER 94 -2.796 9.430 12.311 758 HG SER 94 HG SER 94 -0.860 10.664 12.703 759 H TYR 95 H TYR 95 -1.087 9.603 10.408 760 HA TYR 95 HA TYR 95 -1.636 8.378 7.828 761 HB2 TYR 95 HB2 TYR 95 0.759 8.131 7.695 762 HB3 TYR 95 HB3 TYR 95 0.475 9.731 8.391 763 HD1 TYR 95 HD1 TYR 95 0.697 10.045 10.897 764 HD2 TYR 95 HD2 TYR 95 1.921 6.434 8.926 765 HE1 TYR 95 HE1 TYR 95 2.039 9.424 12.878 766 HE2 TYR 95 HE2 TYR 95 3.251 5.796 10.915 767 HH TYR 95 HH TYR 95 2.890 7.311 13.932 768 H ALA 96 H ALA 96 -0.678 6.118 7.451 769 HA ALA 96 HA ALA 96 -0.702 4.469 9.835 770 HB1 ALA 96 HB1 ALA 96 -2.278 2.856 8.835 771 HB2 ALA 96 HB2 ALA 96 -3.035 4.446 9.185 772 HB3 ALA 96 HB3 ALA 96 -2.591 4.015 7.499 773 H VAL 97 H VAL 97 0.384 2.353 9.564 774 HA VAL 97 HA VAL 97 1.715 2.182 6.950 775 HB VAL 97 HB VAL 97 3.730 1.315 8.098 776 HG11 VAL 97 HG11 VAL 97 4.495 3.466 9.065 777 HG12 VAL 97 HG12 VAL 97 3.580 3.708 7.538 778 HG13 VAL 97 HG13 VAL 97 2.794 4.040 9.119 779 HG21 VAL 97 HG21 VAL 97 3.977 1.570 10.545 780 HG22 VAL 97 HG22 VAL 97 2.258 2.077 10.662 781 HG23 VAL 97 HG23 VAL 97 2.670 0.415 10.120 782 H ILE 98 H ILE 98 1.042 0.332 5.939 783 HA ILE 98 HA ILE 98 0.419 -2.012 7.619 784 HB ILE 98 HB ILE 98 -0.479 -1.436 4.769 785 HG12 ILE 98 HG12 ILE 98 -1.491 0.394 5.797 786 HG13 ILE 98 HG13 ILE 98 -2.763 -0.833 5.843 787 HG21 ILE 98 HG21 ILE 98 -2.317 -3.026 5.271 788 HG22 ILE 98 HG22 ILE 98 -0.687 -3.761 5.439 789 HG23 ILE 98 HG23 ILE 98 -1.615 -3.291 6.903 790 HD11 ILE 98 HD11 ILE 98 -2.640 0.392 7.964 791 HD12 ILE 98 HD12 ILE 98 -2.212 -1.336 8.205 792 HD13 ILE 98 HD13 ILE 98 -0.920 -0.089 8.159 793 H TYR 99 H TYR 99 1.497 -3.920 7.083 794 HA TYR 99 HA TYR 99 3.715 -3.750 5.201 795 HB2 TYR 99 HB2 TYR 99 3.979 -4.471 7.667 796 HB3 TYR 99 HB3 TYR 99 3.215 -5.993 7.188 797 HD1 TYR 99 HD1 TYR 99 6.107 -3.748 6.515 798 HD2 TYR 99 HD2 TYR 99 4.477 -7.689 5.993 799 HE1 TYR 99 HE1 TYR 99 8.315 -4.554 5.757 800 HE2 TYR 99 HE2 TYR 99 6.694 -8.497 5.212 801 HH TYR 99 HH TYR 99 9.104 -7.845 5.536 802 H ALA 100 H ALA 100 4.206 -5.400 3.678 803 HA ALA 100 HA ALA 100 1.891 -7.062 2.914 804 HB1 ALA 100 HB1 ALA 100 2.340 -6.438 0.548 805 HB2 ALA 100 HB2 ALA 100 1.870 -5.017 1.540 806 HB3 ALA 100 HB3 ALA 100 3.592 -5.276 1.102 807 H THR 101 H THR 101 2.339 -9.042 1.879 808 HA THR 101 HA THR 101 5.084 -9.682 1.346 809 HB THR 101 HB THR 101 3.626 -11.431 3.331 810 HG1 THR 101 HG1 THR 101 5.728 -10.458 4.508 811 HG21 THR 101 HG21 THR 101 5.845 -12.504 3.523 812 HG22 THR 101 HG22 THR 101 5.229 -12.589 1.838 813 HG23 THR 101 HG23 THR 101 6.480 -11.377 2.277 814 H ARG 102 H ARG 102 5.420 -11.515 -0.122 815 HA ARG 102 HA ARG 102 2.932 -12.773 -1.061 816 HB2 ARG 102 HB2 ARG 102 3.627 -12.483 -3.382 817 HB3 ARG 102 HB3 ARG 102 3.345 -10.927 -2.590 818 HG2 ARG 102 HG2 ARG 102 6.052 -11.295 -2.134 819 HG3 ARG 102 HG3 ARG 102 5.848 -12.074 -3.709 820 HD2 ARG 102 HD2 ARG 102 5.277 -9.198 -2.915 821 HD3 ARG 102 HD3 ARG 102 6.283 -9.805 -4.238 822 HE ARG 102 HE ARG 102 3.326 -9.587 -4.230 823 HH11 ARG 102 HH11 ARG 102 6.317 -10.041 -5.977 824 HH12 ARG 102 HH12 ARG 102 5.542 -10.388 -7.487 825 HH21 ARG 102 HH21 ARG 102 2.293 -10.249 -6.201 826 HH22 ARG 102 HH22 ARG 102 3.260 -10.506 -7.615 827 H VAL 103 H VAL 103 3.233 -14.996 -1.719 828 HA VAL 103 HA VAL 103 5.996 -15.952 -1.412 829 HB VAL 103 HB VAL 103 3.439 -17.412 -0.590 830 HG11 VAL 103 HG11 VAL 103 4.993 -19.063 0.396 831 HG12 VAL 103 HG12 VAL 103 5.198 -18.928 -1.383 832 HG13 VAL 103 HG13 VAL 103 6.384 -18.151 -0.280 833 HG21 VAL 103 HG21 VAL 103 4.260 -17.117 1.721 834 HG22 VAL 103 HG22 VAL 103 5.620 -16.118 1.106 835 HG23 VAL 103 HG23 VAL 103 3.929 -15.544 0.919 836 H LYS 104 H LYS 104 6.795 -16.769 -3.214 837 HA LYS 104 HA LYS 104 5.031 -18.007 -5.195 838 HB2 LYS 104 HB2 LYS 104 6.033 -15.769 -5.837 839 HB3 LYS 104 HB3 LYS 104 7.596 -16.594 -5.897 840 HG2 LYS 104 HG2 LYS 104 6.529 -16.498 -8.132 841 HG3 LYS 104 HG3 LYS 104 6.761 -18.167 -7.594 842 HD2 LYS 104 HD2 LYS 104 4.427 -18.439 -7.059 843 HD3 LYS 104 HD3 LYS 104 4.123 -16.698 -7.127 844 HE2 LYS 104 HE2 LYS 104 3.251 -17.828 -9.149 845 HE3 LYS 104 HE3 LYS 104 4.529 -16.679 -9.567 846 HZ1 LYS 104 HZ1 LYS 104 4.476 -19.179 -10.408 847 HZ2 LYS 104 HZ2 LYS 104 5.860 -18.329 -10.244 848 HZ3 LYS 104 HZ3 LYS 104 5.407 -19.384 -9.083 849 H ASP 105 H ASP 105 6.054 -19.727 -6.544 850 HA ASP 105 HA ASP 105 6.865 -21.835 -5.194 851 HB2 ASP 105 HB2 ASP 105 8.121 -20.983 -7.877 852 HB3 ASP 105 HB3 ASP 105 7.933 -22.643 -7.297 853 H GLY 106 H GLY 106 8.474 -21.778 -3.432 854 HA2 GLY 106 HA2 GLY 106 10.671 -22.015 -2.851 855 HA3 GLY 106 HA3 GLY 106 11.140 -21.697 -4.526 856 H ARG 107 H ARG 107 9.082 -19.094 -3.511 857 HA ARG 107 HA ARG 107 11.297 -17.569 -2.403 858 HB2 ARG 107 HB2 ARG 107 11.677 -17.444 -4.835 859 HB3 ARG 107 HB3 ARG 107 9.976 -17.050 -5.122 860 HG2 ARG 107 HG2 ARG 107 10.203 -14.863 -4.359 861 HG3 ARG 107 HG3 ARG 107 11.600 -15.241 -3.342 862 HD2 ARG 107 HD2 ARG 107 11.813 -15.629 -6.336 863 HD3 ARG 107 HD3 ARG 107 11.889 -13.989 -5.678 864 HE ARG 107 HE ARG 107 13.693 -15.334 -4.114 865 HH11 ARG 107 HH11 ARG 107 13.249 -15.202 -7.601 866 HH12 ARG 107 HH12 ARG 107 14.938 -15.368 -7.943 867 HH21 ARG 107 HH21 ARG 107 15.904 -15.519 -4.580 868 HH22 ARG 107 HH22 ARG 107 16.448 -15.549 -6.224 869 H THR 108 H THR 108 10.796 -16.040 -1.032 870 HA THR 108 HA THR 108 8.033 -15.171 -1.031 871 HB THR 108 HB THR 108 9.615 -15.496 1.527 872 HG1 THR 108 HG1 THR 108 8.198 -17.416 1.636 873 HG21 THR 108 HG21 THR 108 7.352 -15.230 2.481 874 HG22 THR 108 HG22 THR 108 7.789 -13.792 1.498 875 HG23 THR 108 HG23 THR 108 6.664 -15.025 0.835 876 H LEU 109 H LEU 109 7.534 -12.963 -1.471 877 HA LEU 109 HA LEU 109 9.842 -11.229 -0.781 878 HB2 LEU 109 HB2 LEU 109 9.426 -11.349 -3.175 879 HB3 LEU 109 HB3 LEU 109 7.741 -10.874 -2.926 880 HG LEU 109 HG LEU 109 8.571 -8.664 -2.009 881 HD11 LEU 109 HD11 LEU 109 10.870 -7.966 -2.578 882 HD12 LEU 109 HD12 LEU 109 10.848 -9.317 -1.395 883 HD13 LEU 109 HD13 LEU 109 11.240 -9.639 -3.117 884 HD21 LEU 109 HD21 LEU 109 9.098 -7.756 -4.275 885 HD22 LEU 109 HD22 LEU 109 9.376 -9.428 -4.870 886 HD23 LEU 109 HD23 LEU 109 7.739 -8.928 -4.327 887 H HIS 110 H HIS 110 9.470 -9.551 0.529 888 HA HIS 110 HA HIS 110 6.876 -9.359 1.899 889 HB2 HIS 110 HB2 HIS 110 9.587 -8.589 2.956 890 HB3 HIS 110 HB3 HIS 110 8.041 -8.205 3.723 891 HD2 HIS 110 HD2 HIS 110 10.671 -10.876 3.688 892 HE1 HIS 110 HE1 HIS 110 7.324 -12.559 5.728 893 H MET 111 H MET 111 6.606 -7.016 2.699 894 HA MET 111 HA MET 111 7.737 -4.987 1.139 895 HB2 MET 111 HB2 MET 111 6.528 -6.027 -0.655 896 HB3 MET 111 HB3 MET 111 5.016 -5.564 0.137 897 HG2 MET 111 HG2 MET 111 5.614 -3.195 0.046 898 HG3 MET 111 HG3 MET 111 7.242 -3.575 -0.529 899 HE1 MET 111 HE1 MET 111 6.904 -4.517 -4.164 900 HE2 MET 111 HE2 MET 111 7.918 -3.848 -2.841 901 HE3 MET 111 HE3 MET 111 7.306 -5.534 -2.739 902 H MET 112 H MET 112 7.248 -2.753 1.803 903 HA MET 112 HA MET 112 5.384 -2.875 4.074 904 HB2 MET 112 HB2 MET 112 7.736 -2.688 4.866 905 HB3 MET 112 HB3 MET 112 7.751 -1.052 4.195 906 HG2 MET 112 HG2 MET 112 5.957 -0.331 5.635 907 HG3 MET 112 HG3 MET 112 5.555 -1.990 6.096 908 HE1 MET 112 HE1 MET 112 7.073 0.420 8.860 909 HE2 MET 112 HE2 MET 112 5.587 -0.134 8.017 910 HE3 MET 112 HE3 MET 112 6.354 -1.175 9.263 911 H ARG 113 H ARG 113 4.166 -0.758 4.501 912 HA ARG 113 HA ARG 113 4.378 1.202 2.401 913 HB2 ARG 113 HB2 ARG 113 2.450 -0.897 2.142 914 HB3 ARG 113 HB3 ARG 113 1.552 0.552 2.611 915 HG2 ARG 113 HG2 ARG 113 1.602 1.141 0.431 916 HG3 ARG 113 HG3 ARG 113 3.311 1.529 0.669 917 HD2 ARG 113 HD2 ARG 113 3.212 0.047 -1.220 918 HD3 ARG 113 HD3 ARG 113 3.865 -0.900 0.123 919 HE ARG 113 HE ARG 113 0.952 -1.047 -0.547 920 HH11 ARG 113 HH11 ARG 113 4.086 -2.582 -0.206 921 HH12 ARG 113 HH12 ARG 113 3.454 -4.191 -0.305 922 HH21 ARG 113 HH21 ARG 113 0.102 -3.151 -0.568 923 HH22 ARG 113 HH22 ARG 113 1.162 -4.520 -0.512 924 H LEU 114 H LEU 114 3.635 3.256 3.001 925 HA LEU 114 HA LEU 114 2.248 3.431 5.610 926 HB2 LEU 114 HB2 LEU 114 4.619 3.960 5.922 927 HB3 LEU 114 HB3 LEU 114 4.521 5.185 4.650 928 HG LEU 114 HG LEU 114 2.880 5.267 7.217 929 HD11 LEU 114 HD11 LEU 114 4.491 6.999 7.969 930 HD12 LEU 114 HD12 LEU 114 5.281 5.403 7.733 931 HD13 LEU 114 HD13 LEU 114 5.486 6.697 6.505 932 HD21 LEU 114 HD21 LEU 114 2.548 7.644 6.618 933 HD22 LEU 114 HD22 LEU 114 3.459 7.380 5.093 934 HD23 LEU 114 HD23 LEU 114 1.898 6.535 5.364 935 H TYR 115 H TYR 115 0.304 4.527 5.228 936 HA TYR 115 HA TYR 115 0.309 6.155 2.812 937 HB2 TYR 115 HB2 TYR 115 -2.118 5.714 2.653 938 HB3 TYR 115 HB3 TYR 115 -1.146 4.241 2.533 939 HD1 TYR 115 HD1 TYR 115 -3.456 6.166 4.708 940 HD2 TYR 115 HD2 TYR 115 -1.408 2.429 4.157 941 HE1 TYR 115 HE1 TYR 115 -4.839 5.151 6.482 942 HE2 TYR 115 HE2 TYR 115 -2.806 1.404 5.933 943 HH TYR 115 HH TYR 115 -4.418 1.701 7.421 944 H SER 116 H SER 116 -0.577 8.125 2.714 945 HA SER 116 HA SER 116 -1.026 9.436 5.334 946 HB2 SER 116 HB2 SER 116 -0.395 10.712 2.638 947 HB3 SER 116 HB3 SER 116 -0.353 11.459 4.240 948 HG SER 116 HG SER 116 1.721 11.053 4.207 949 H ARG 117 H ARG 117 -2.918 10.926 5.111 950 HA ARG 117 HA ARG 117 -4.923 9.808 3.389 951 HB2 ARG 117 HB2 ARG 117 -5.107 10.354 5.982 952 HB3 ARG 117 HB3 ARG 117 -5.687 11.902 5.354 953 HG2 ARG 117 HG2 ARG 117 -7.321 10.621 3.881 954 HG3 ARG 117 HG3 ARG 117 -6.804 9.131 4.681 955 HD2 ARG 117 HD2 ARG 117 -8.782 9.852 5.820 956 HD3 ARG 117 HD3 ARG 117 -7.430 10.201 6.906 957 HE ARG 117 HE ARG 117 -7.596 12.567 6.241 958 HH11 ARG 117 HH11 ARG 117 -10.268 10.469 5.364 959 HH12 ARG 117 HH12 ARG 117 -11.397 11.770 5.184 960 HH21 ARG 117 HH21 ARG 117 -9.084 14.275 5.991 961 HH22 ARG 117 HH22 ARG 117 -10.722 13.938 5.541 962 H SER 118 H SER 118 -2.665 11.994 2.782 963 HA SER 118 HA SER 118 -4.322 13.406 0.842 964 HB2 SER 118 HB2 SER 118 -2.687 14.780 3.056 965 HB3 SER 118 HB3 SER 118 -3.458 15.603 1.693 966 HG SER 118 HG SER 118 -5.329 14.040 2.916 967 HA PRO 119 HA PRO 119 -0.454 13.212 -1.364 968 HB2 PRO 119 HB2 PRO 119 -0.385 15.622 -2.740 969 HB3 PRO 119 HB3 PRO 119 -1.586 14.393 -3.156 970 HG2 PRO 119 HG2 PRO 119 -1.898 16.857 -1.418 971 HG3 PRO 119 HG3 PRO 119 -2.989 16.226 -2.659 972 HD2 PRO 119 HD2 PRO 119 -3.426 15.792 0.011 973 HD3 PRO 119 HD3 PRO 119 -3.921 14.620 -1.218 974 H GLU 120 H GLU 120 0.461 13.397 1.028 975 HA GLU 120 HA GLU 120 2.682 15.167 0.755 976 HB2 GLU 120 HB2 GLU 120 2.206 16.235 3.073 977 HB3 GLU 120 HB3 GLU 120 1.325 16.883 1.683 978 HG2 GLU 120 HG2 GLU 120 -0.349 14.832 2.680 979 HG3 GLU 120 HG3 GLU 120 0.306 15.611 4.127 980 H VAL 121 H VAL 121 4.386 14.745 2.513 981 HA VAL 121 HA VAL 121 3.702 12.179 3.845 982 HB VAL 121 HB VAL 121 6.404 13.394 3.165 983 HG11 VAL 121 HG11 VAL 121 7.319 11.098 3.243 984 HG12 VAL 121 HG12 VAL 121 6.611 11.660 4.795 985 HG13 VAL 121 HG13 VAL 121 5.704 10.506 3.759 986 HG21 VAL 121 HG21 VAL 121 6.575 11.919 1.154 987 HG22 VAL 121 HG22 VAL 121 4.851 11.471 1.381 988 HG23 VAL 121 HG23 VAL 121 5.297 13.173 1.021 989 H SER 122 H SER 122 3.119 12.810 5.873 990 HA SER 122 HA SER 122 4.072 15.115 7.193 991 HB2 SER 122 HB2 SER 122 3.010 12.685 8.646 992 HB3 SER 122 HB3 SER 122 2.680 14.399 8.930 993 HG SER 122 HG SER 122 0.866 13.299 7.943 994 HA PRO 123 HA PRO 123 8.090 13.778 8.439 995 HB2 PRO 123 HB2 PRO 123 8.190 15.392 10.783 996 HB3 PRO 123 HB3 PRO 123 8.628 15.976 9.172 997 HG2 PRO 123 HG2 PRO 123 6.031 16.293 10.680 998 HG3 PRO 123 HG3 PRO 123 6.874 17.455 9.646 999 HD2 PRO 123 HD2 PRO 123 4.709 16.123 8.720 1000 HD3 PRO 123 HD3 PRO 123 6.071 16.462 7.644 1001 H ALA 124 H ALA 124 5.636 14.119 11.140 1002 HA ALA 124 HA ALA 124 6.913 12.375 12.878 1003 HB1 ALA 124 HB1 ALA 124 4.652 12.102 13.864 1004 HB2 ALA 124 HB2 ALA 124 4.998 13.819 13.465 1005 HB3 ALA 124 HB3 ALA 124 3.929 12.847 12.398 1006 H ALA 125 H ALA 125 4.377 11.629 10.341 1007 HA ALA 125 HA ALA 125 4.168 8.911 10.829 1008 HB1 ALA 125 HB1 ALA 125 3.426 8.800 8.466 1009 HB2 ALA 125 HB2 ALA 125 2.705 10.209 9.315 1010 HB3 ALA 125 HB3 ALA 125 4.080 10.449 8.185 1011 H THR 126 H THR 126 6.411 10.689 8.569 1012 HA THR 126 HA THR 126 7.702 8.446 7.578 1013 HB THR 126 HB THR 126 8.941 11.197 8.101 1014 HG1 THR 126 HG1 THR 126 7.006 11.608 7.009 1015 HG21 THR 126 HG21 THR 126 10.204 10.692 6.028 1016 HG22 THR 126 HG22 THR 126 10.495 9.454 7.296 1017 HG23 THR 126 HG23 THR 126 9.391 9.093 5.926 1018 H ALA 127 H ALA 127 8.563 10.565 10.449 1019 HA ALA 127 HA ALA 127 10.930 9.217 11.071 1020 HB1 ALA 127 HB1 ALA 127 10.651 10.279 13.298 1021 HB2 ALA 127 HB2 ALA 127 10.348 11.434 11.956 1022 HB3 ALA 127 HB3 ALA 127 8.968 10.728 12.862 1023 H ILE 128 H ILE 128 7.562 8.748 12.462 1024 HA ILE 128 HA ILE 128 8.291 6.735 14.217 1025 HB ILE 128 HB ILE 128 5.655 7.110 12.727 1026 HG12 ILE 128 HG12 ILE 128 6.287 9.117 13.959 1027 HG13 ILE 128 HG13 ILE 128 4.937 8.307 14.764 1028 HG21 ILE 128 HG21 ILE 128 4.666 5.856 14.620 1029 HG22 ILE 128 HG22 ILE 128 5.844 4.862 13.698 1030 HG23 ILE 128 HG23 ILE 128 6.311 5.570 15.282 1031 HD11 ILE 128 HD11 ILE 128 6.576 9.126 16.397 1032 HD12 ILE 128 HD12 ILE 128 6.495 7.332 16.428 1033 HD13 ILE 128 HD13 ILE 128 7.867 8.156 15.611 1034 H PHE 129 H PHE 129 7.120 6.512 10.754 1035 HA PHE 129 HA PHE 129 7.069 3.740 10.567 1036 HB2 PHE 129 HB2 PHE 129 6.152 5.300 8.883 1037 HB3 PHE 129 HB3 PHE 129 7.780 5.868 8.490 1038 HD1 PHE 129 HD1 PHE 129 9.443 4.206 7.495 1039 HD2 PHE 129 HD2 PHE 129 5.247 3.383 7.844 1040 HE1 PHE 129 HE1 PHE 129 9.652 2.433 5.782 1041 HE2 PHE 129 HE2 PHE 129 5.447 1.608 6.131 1042 HZ PHE 129 HZ PHE 129 7.654 1.131 5.092 1043 H ARG 130 H ARG 130 9.794 6.095 9.915 1044 HA ARG 130 HA ARG 130 11.627 4.167 9.094 1045 HB2 ARG 130 HB2 ARG 130 11.656 6.814 9.064 1046 HB3 ARG 130 HB3 ARG 130 12.444 6.639 10.637 1047 HG2 ARG 130 HG2 ARG 130 13.699 4.811 8.772 1048 HG3 ARG 130 HG3 ARG 130 13.601 6.407 8.017 1049 HD2 ARG 130 HD2 ARG 130 14.485 6.321 10.891 1050 HD3 ARG 130 HD3 ARG 130 15.609 5.668 9.692 1051 HE ARG 130 HE ARG 130 15.647 7.849 8.603 1052 HH11 ARG 130 HH11 ARG 130 14.023 7.774 11.722 1053 HH12 ARG 130 HH12 ARG 130 14.194 9.478 11.984 1054 HH21 ARG 130 HH21 ARG 130 15.868 10.077 8.964 1055 HH22 ARG 130 HH22 ARG 130 15.243 10.787 10.415 1056 H LYS 131 H LYS 131 10.835 5.416 12.443 1057 HA LYS 131 HA LYS 131 12.952 4.232 13.787 1058 HB2 LYS 131 HB2 LYS 131 10.034 4.683 14.581 1059 HB3 LYS 131 HB3 LYS 131 11.274 4.133 15.715 1060 HG2 LYS 131 HG2 LYS 131 12.582 6.224 15.269 1061 HG3 LYS 131 HG3 LYS 131 11.301 6.776 14.182 1062 HD2 LYS 131 HD2 LYS 131 9.658 6.734 16.042 1063 HD3 LYS 131 HD3 LYS 131 10.879 6.077 17.139 1064 HE2 LYS 131 HE2 LYS 131 12.277 8.130 16.804 1065 HE3 LYS 131 HE3 LYS 131 11.045 8.787 15.718 1066 HZ1 LYS 131 HZ1 LYS 131 10.808 9.638 17.940 1067 HZ2 LYS 131 HZ2 LYS 131 9.493 8.746 17.563 1068 HZ3 LYS 131 HZ3 LYS 131 10.630 8.140 18.565 1069 H LEU 132 H LEU 132 9.582 2.834 13.239 1070 HA LEU 132 HA LEU 132 10.098 0.344 14.344 1071 HB2 LEU 132 HB2 LEU 132 8.311 1.114 12.002 1072 HB3 LEU 132 HB3 LEU 132 8.252 -0.432 12.859 1073 HG LEU 132 HG LEU 132 7.693 2.291 14.112 1074 HD11 LEU 132 HD11 LEU 132 5.334 1.542 14.140 1075 HD12 LEU 132 HD12 LEU 132 5.978 1.669 12.468 1076 HD13 LEU 132 HD13 LEU 132 5.800 0.058 13.243 1077 HD21 LEU 132 HD21 LEU 132 6.828 0.968 16.014 1078 HD22 LEU 132 HD22 LEU 132 7.357 -0.542 15.197 1079 HD23 LEU 132 HD23 LEU 132 8.575 0.667 15.726 1080 H ALA 133 H ALA 133 10.700 1.612 10.993 1081 HA ALA 133 HA ALA 133 11.429 -0.821 9.834 1082 HB1 ALA 133 HB1 ALA 133 12.567 0.609 8.162 1083 HB2 ALA 133 HB2 ALA 133 10.923 1.216 8.555 1084 HB3 ALA 133 HB3 ALA 133 12.369 2.026 9.247 1085 H GLY 134 H GLY 134 13.424 1.650 11.659 1086 HA2 GLY 134 HA2 GLY 134 15.907 0.467 11.127 1087 HA3 GLY 134 HA3 GLY 134 15.499 1.515 12.492 1088 H GLU 135 H GLU 135 13.535 -0.044 13.866 1089 HA GLU 135 HA GLU 135 15.115 -1.707 15.402 1090 HB2 GLU 135 HB2 GLU 135 13.032 -0.863 16.248 1091 HB3 GLU 135 HB3 GLU 135 12.111 -1.558 14.907 1092 HG2 GLU 135 HG2 GLU 135 12.483 -3.820 15.733 1093 HG3 GLU 135 HG3 GLU 135 13.606 -3.239 16.969 1094 H ARG 136 H ARG 136 13.384 -2.414 12.323 1095 HA ARG 136 HA ARG 136 13.732 -5.260 12.708 1096 HB2 ARG 136 HB2 ARG 136 12.948 -3.774 10.158 1097 HB3 ARG 136 HB3 ARG 136 12.595 -5.453 10.588 1098 HG2 ARG 136 HG2 ARG 136 11.198 -4.499 12.547 1099 HG3 ARG 136 HG3 ARG 136 11.366 -2.923 11.763 1100 HD2 ARG 136 HD2 ARG 136 9.525 -3.492 10.564 1101 HD3 ARG 136 HD3 ARG 136 10.602 -4.537 9.629 1102 HE ARG 136 HE ARG 136 9.768 -6.424 10.777 1103 HH11 ARG 136 HH11 ARG 136 8.436 -3.460 12.115 1104 HH12 ARG 136 HH12 ARG 136 7.184 -4.274 12.993 1105 HH21 ARG 136 HH21 ARG 136 8.118 -7.479 11.940 1106 HH22 ARG 136 HH22 ARG 136 7.004 -6.557 12.893 1107 H ASN 137 H ASN 137 16.009 -2.906 12.127 1108 HA ASN 137 HA ASN 137 18.070 -3.002 11.360 1109 HB2 ASN 137 HB2 ASN 137 17.351 -5.907 10.792 1110 HB3 ASN 137 HB3 ASN 137 18.920 -5.227 10.340 1111 HD21 ASN 137 HD21 ASN 137 19.375 -3.526 12.585 1112 HD22 ASN 137 HD22 ASN 137 19.631 -4.536 13.968 1113 H TYR 138 H TYR 138 15.705 -2.177 9.635 1114 HA TYR 138 HA TYR 138 16.121 -3.235 7.031 1115 HB2 TYR 138 HB2 TYR 138 14.400 -1.720 6.471 1116 HB3 TYR 138 HB3 TYR 138 14.121 -1.865 8.212 1117 HD1 TYR 138 HD1 TYR 138 16.093 -0.079 9.460 1118 HD2 TYR 138 HD2 TYR 138 13.917 0.490 5.793 1119 HE1 TYR 138 HE1 TYR 138 16.363 2.375 9.678 1120 HE2 TYR 138 HE2 TYR 138 14.187 2.945 6.019 1121 HH TYR 138 HH TYR 138 15.234 4.598 7.109 1122 H THR 139 H THR 139 16.615 -1.617 5.152 1123 HA THR 139 HA THR 139 19.078 -0.187 5.876 1124 HB THR 139 HB THR 139 19.558 -0.639 3.338 1125 HG1 THR 139 HG1 THR 139 18.525 -2.644 2.614 1126 HG21 THR 139 HG21 THR 139 20.550 -2.853 3.867 1127 HG22 THR 139 HG22 THR 139 20.823 -1.671 5.192 1128 HG23 THR 139 HG23 THR 139 19.558 -2.935 5.362 1129 H ASP 140 H ASP 140 19.637 1.674 4.408 1130 HA ASP 140 HA ASP 140 17.529 3.514 4.372 1131 HB2 ASP 140 HB2 ASP 140 20.139 3.813 4.411 1132 HB3 ASP 140 HB3 ASP 140 20.025 3.735 2.648 1133 H GLU 141 H GLU 141 18.857 1.419 1.854 1134 HA GLU 141 HA GLU 141 17.106 2.459 -0.117 1135 HB2 GLU 141 HB2 GLU 141 19.418 0.658 -0.476 1136 HB3 GLU 141 HB3 GLU 141 18.150 0.769 -1.703 1137 HG2 GLU 141 HG2 GLU 141 18.421 3.215 -1.833 1138 HG3 GLU 141 HG3 GLU 141 19.582 3.194 -0.499 1139 H MET 142 H MET 142 16.455 0.417 2.333 1140 HA MET 142 HA MET 142 15.009 -1.566 0.758 1141 HB2 MET 142 HB2 MET 142 16.214 -2.129 2.869 1142 HB3 MET 142 HB3 MET 142 15.279 -0.916 3.752 1143 HG2 MET 142 HG2 MET 142 13.193 -2.232 3.279 1144 HG3 MET 142 HG3 MET 142 14.183 -3.468 2.491 1145 HE1 MET 142 HE1 MET 142 15.965 -5.349 5.103 1146 HE2 MET 142 HE2 MET 142 16.018 -4.649 3.450 1147 HE3 MET 142 HE3 MET 142 16.863 -3.823 4.803 1148 H VAL 143 H VAL 143 14.266 1.365 2.660 1149 HA VAL 143 HA VAL 143 11.514 1.224 1.597 1150 HB VAL 143 HB VAL 143 12.289 2.086 4.412 1151 HG11 VAL 143 HG11 VAL 143 9.836 2.218 4.739 1152 HG12 VAL 143 HG12 VAL 143 10.406 3.337 3.455 1153 HG13 VAL 143 HG13 VAL 143 9.590 1.800 3.010 1154 HG21 VAL 143 HG21 VAL 143 11.019 0.107 5.174 1155 HG22 VAL 143 HG22 VAL 143 10.825 -0.418 3.468 1156 HG23 VAL 143 HG23 VAL 143 12.461 -0.347 4.204 1157 H ALA 144 H ALA 144 11.001 3.375 0.705 1158 HA ALA 144 HA ALA 144 12.766 5.547 1.555 1159 HB1 ALA 144 HB1 ALA 144 13.142 6.197 -0.813 1160 HB2 ALA 144 HB2 ALA 144 13.854 4.594 -0.427 1161 HB3 ALA 144 HB3 ALA 144 12.313 4.695 -1.344 1162 H MET 145 H MET 145 11.888 7.583 1.462 1163 HA MET 145 HA MET 145 8.995 7.708 0.955 1164 HB2 MET 145 HB2 MET 145 8.950 9.548 2.468 1165 HB3 MET 145 HB3 MET 145 9.914 8.279 3.236 1166 HG2 MET 145 HG2 MET 145 11.851 9.725 1.876 1167 HG3 MET 145 HG3 MET 145 10.701 10.989 2.331 1168 HE1 MET 145 HE1 MET 145 13.077 8.196 5.102 1169 HE2 MET 145 HE2 MET 145 11.401 7.642 4.774 1170 HE3 MET 145 HE3 MET 145 12.547 7.889 3.414 1171 H LEU 146 H LEU 146 8.127 9.207 -0.569 1172 HA LEU 146 HA LEU 146 10.179 10.560 -2.178 1173 HB2 LEU 146 HB2 LEU 146 7.314 9.686 -2.758 1174 HB3 LEU 146 HB3 LEU 146 8.246 10.726 -3.842 1175 HG LEU 146 HG LEU 146 8.301 8.472 -4.669 1176 HD11 LEU 146 HD11 LEU 146 10.736 8.046 -4.735 1177 HD12 LEU 146 HD12 LEU 146 10.349 9.786 -4.956 1178 HD13 LEU 146 HD13 LEU 146 10.968 9.197 -3.376 1179 HD21 LEU 146 HD21 LEU 146 9.275 6.602 -3.380 1180 HD22 LEU 146 HD22 LEU 146 9.433 7.677 -1.951 1181 HD23 LEU 146 HD23 LEU 146 7.806 7.272 -2.593 1182 HA PRO 147 HA PRO 147 8.737 14.485 -0.584 1183 HB2 PRO 147 HB2 PRO 147 9.956 15.619 -3.104 1184 HB3 PRO 147 HB3 PRO 147 10.455 15.912 -1.432 1185 HG2 PRO 147 HG2 PRO 147 11.982 14.442 -3.096 1186 HG3 PRO 147 HG3 PRO 147 11.869 14.045 -1.376 1187 HD2 PRO 147 HD2 PRO 147 10.467 12.725 -3.732 1188 HD3 PRO 147 HD3 PRO 147 11.225 11.969 -2.324 1189 H ARG 148 H ARG 148 7.777 16.676 -1.809 1190 HA ARG 148 HA ARG 148 5.307 15.755 -2.950 1191 HB2 ARG 148 HB2 ARG 148 4.559 17.951 -2.601 1192 HB3 ARG 148 HB3 ARG 148 5.792 17.764 -1.347 1193 HG2 ARG 148 HG2 ARG 148 6.131 19.175 -4.034 1194 HG3 ARG 148 HG3 ARG 148 5.999 19.945 -2.447 1195 HD2 ARG 148 HD2 ARG 148 8.223 17.980 -3.200 1196 HD3 ARG 148 HD3 ARG 148 8.367 19.735 -3.370 1197 HE ARG 148 HE ARG 148 7.579 18.908 -0.685 1198 HH11 ARG 148 HH11 ARG 148 10.284 19.521 -2.849 1199 HH12 ARG 148 HH12 ARG 148 11.422 19.737 -1.561 1200 HH21 ARG 148 HH21 ARG 148 9.088 19.187 0.993 1201 HH22 ARG 148 HH22 ARG 148 10.741 19.546 0.624 1202 H GLN 149 H GLN 149 6.873 14.763 -4.440 1203 HA GLN 149 HA GLN 149 6.012 15.263 -6.670 1204 HB2 GLN 149 HB2 GLN 149 9.021 15.618 -6.575 1205 HB3 GLN 149 HB3 GLN 149 8.932 13.865 -6.356 1206 HG2 GLN 149 HG2 GLN 149 7.631 14.217 -8.771 1207 HG3 GLN 149 HG3 GLN 149 8.870 15.478 -8.827 1208 HE21 GLN 149 HE21 GLN 149 10.596 13.978 -6.948 1209 HE22 GLN 149 HE22 GLN 149 11.317 12.714 -7.887 1210 H GLU 150 H GLU 150 4.606 15.755 -6.769 1211 HA GLU 150 HA GLU 150 3.646 13.665 -8.429 1212 HB2 GLU 150 HB2 GLU 150 1.755 13.162 -6.955 1213 HB3 GLU 150 HB3 GLU 150 3.309 12.841 -6.175 1214 HG2 GLU 150 HG2 GLU 150 1.794 14.130 -4.694 1215 HG3 GLU 150 HG3 GLU 150 3.257 15.044 -5.085 1216 H GLU 151 H GLU 151 1.115 13.605 -8.523 1217 HA GLU 151 HA GLU 151 -0.105 15.791 -9.227 1218 HB2 GLU 151 HB2 GLU 151 1.223 16.772 -10.735 1219 HB3 GLU 151 HB3 GLU 151 1.833 15.247 -11.394 1220 HG2 GLU 151 HG2 GLU 151 -0.797 15.014 -12.067 1221 HG3 GLU 151 HG3 GLU 151 -0.644 16.776 -12.074 1222 H CYS 152 H CYS 152 0.557 12.566 -10.515 1223 HA CYS 152 HA CYS 152 -2.300 12.629 -11.289 1224 HB2 CYS 152 HB2 CYS 152 -0.391 11.971 -12.854 1225 HB3 CYS 152 HB3 CYS 152 0.018 10.678 -11.719 1226 H THR 153 H THR 153 -3.472 12.129 -9.992 1227 HA THR 153 HA THR 153 -2.796 10.566 -7.601 1228 HB THR 153 HB THR 153 -5.252 12.016 -7.380 1229 HG1 THR 153 HG1 THR 153 -4.424 14.222 -7.354 1230 HG21 THR 153 HG21 THR 153 -4.260 13.072 -5.371 1231 HG22 THR 153 HG22 THR 153 -4.097 11.284 -5.427 1232 HG23 THR 153 HG23 THR 153 -2.684 12.327 -5.802 1233 H VAL 154 H VAL 154 -5.026 9.622 -6.738 1234 HA VAL 154 HA VAL 154 -6.120 8.296 -9.099 1235 HB VAL 154 HB VAL 154 -5.049 6.958 -7.252 1236 HG11 VAL 154 HG11 VAL 154 -6.185 6.773 -5.063 1237 HG12 VAL 154 HG12 VAL 154 -5.585 8.437 -5.374 1238 HG13 VAL 154 HG13 VAL 154 -7.332 8.063 -5.557 1239 HG21 VAL 154 HG21 VAL 154 -6.865 5.318 -6.938 1240 HG22 VAL 154 HG22 VAL 154 -8.054 6.528 -7.527 1241 HG23 VAL 154 HG23 VAL 154 -6.777 5.913 -8.630 1242 H ASP 155 H ASP 155 -8.288 8.129 -9.636 1243 HA ASP 155 HA ASP 155 -9.908 10.270 -8.774 1244 HB2 ASP 155 HB2 ASP 155 -10.196 9.421 -11.012 1245 HB3 ASP 155 HB3 ASP 155 -10.397 7.758 -10.445 1246 H GLU 156 H GLU 156 -12.005 10.209 -7.693 1247 HA GLU 156 HA GLU 156 -12.187 7.964 -5.795 1248 HB2 GLU 156 HB2 GLU 156 -13.306 9.615 -4.276 1249 HB3 GLU 156 HB3 GLU 156 -11.576 9.864 -4.540 1250 HG2 GLU 156 HG2 GLU 156 -12.200 11.627 -6.284 1251 HG3 GLU 156 HG3 GLU 156 -13.876 11.464 -5.743 1252 H VAL 157 H VAL 157 -14.256 10.550 -7.394 1253 HA VAL 157 HA VAL 157 -16.046 8.601 -8.368 1254 HB VAL 157 HB VAL 157 -16.804 8.372 -6.093 1255 HG11 VAL 157 HG11 VAL 157 -17.674 10.275 -4.775 1256 HG12 VAL 157 HG12 VAL 157 -15.924 10.445 -5.142 1257 HG13 VAL 157 HG13 VAL 157 -17.132 11.404 -6.062 1258 HG21 VAL 157 HG21 VAL 157 -19.165 9.077 -6.315 1259 HG22 VAL 157 HG22 VAL 157 -18.712 10.132 -7.696 1260 HG23 VAL 157 HG23 VAL 157 -18.528 8.350 -7.828 1261 HN1 EB4 158 HN1 EB4 158 4.217 -5.624 -7.004 1262 H8 EB4 158 H8 EB4 158 -2.476 -5.588 -4.372 1263 HN2 EB4 158 HN2 EB4 158 1.538 -4.870 -8.461 1264 H9 EB4 158 H9 EB4 158 0.844 -0.405 -2.926 1265 H10 EB4 158 H10 EB4 158 4.874 -7.526 -1.431 1266 HN3 EB4 158 HN3 EB4 158 3.556 -2.402 -7.614 1267 H7 EB4 158 H7 EB4 158 3.022 -5.880 -1.322 1268 H11 EB4 158 H11 EB4 158 -3.720 -6.387 -6.359 1269 H12 EB4 158 H12 EB4 158 1.996 1.665 -3.675 1270 H15 EB4 158 H15 EB4 158 3.706 1.556 -5.465 1271 H14 EB4 158 H14 EB4 158 -2.538 -6.629 -8.530 1272 H13 EB4 158 H13 EB4 158 6.115 -7.814 -3.564 1273 H22 EB4 158 H22 EB4 158 5.070 -6.373 -7.458 1274 H30 EB4 158 H30 EB4 158 6.423 -2.968 -9.996 1275 H30A EB4 158 H30A EB4 158 6.699 -2.450 -8.264 1276 H24 EB4 158 H24 EB4 158 4.352 -1.685 -8.199 1277 H28 EB4 158 H28 EB4 158 4.089 -8.106 -9.040 1278 H28A EB4 158 H28A EB4 158 4.809 -7.124 -10.401 1279 H23 EB4 158 H23 EB4 158 1.175 -4.971 -9.633 1280 H29 EB4 158 H29 EB4 158 0.930 -2.905 -10.780 1281 H29A EB4 158 H29A EB4 158 2.377 -3.380 -11.873
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