NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
592104 | 2mvo | 25277 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 HIS -5 HT1 HIS -5 82.547 14.885 14.722 2 H2 HIS -5 HT2 HIS -5 83.095 16.156 15.706 3 H3 HIS -5 HT3 HIS -5 84.042 15.621 14.402 4 HA HIS -5 HA HIS -5 81.535 17.178 14.349 5 HB2 HIS -5 HB2 HIS -5 84.268 17.464 13.086 6 HB3 HIS -5 HB3 HIS -5 82.916 18.531 12.757 7 HD1 HIS -5 HD1 HIS -5 85.470 17.683 15.358 8 HD2 HIS -5 HD2 HIS -5 82.319 20.367 14.863 9 HE1 HIS -5 HE1 HIS -5 85.683 19.386 17.217 10 H HIS -4 H HIS -4 80.032 16.198 13.134 11 HA HIS -4 HA HIS -4 80.865 15.020 10.542 12 HB2 HIS -4 HB2 HIS -4 80.119 13.305 12.156 13 HB3 HIS -4 HB3 HIS -4 78.590 14.145 12.329 14 HD1 HIS -4 HD1 HIS -4 80.652 12.660 9.473 15 HD2 HIS -4 HD2 HIS -4 76.677 13.098 10.654 16 HE1 HIS -4 HE1 HIS -4 79.253 11.467 7.734 17 H HIS -3 H HIS -3 79.886 15.814 8.784 18 HA HIS -3 HA HIS -3 77.460 17.478 9.136 19 HB2 HIS -3 HB2 HIS -3 79.812 18.016 7.319 20 HB3 HIS -3 HB3 HIS -3 78.327 18.946 7.359 21 HD1 HIS -3 HD1 HIS -3 77.826 20.070 9.838 22 HD2 HIS -3 HD2 HIS -3 81.764 18.988 8.994 23 HE1 HIS -3 HE1 HIS -3 79.282 21.333 11.480 24 H HIS -2 H HIS -2 75.969 17.437 7.447 25 HA HIS -2 HA HIS -2 76.305 15.193 5.541 26 HB2 HIS -2 HB2 HIS -2 73.784 16.433 6.655 27 HB3 HIS -2 HB3 HIS -2 73.841 15.133 5.480 28 HD1 HIS -2 HD1 HIS -2 75.052 12.857 6.396 29 HD2 HIS -2 HD2 HIS -2 73.793 15.591 9.281 30 HE1 HIS -2 HE1 HIS -2 74.966 11.594 8.589 31 H HIS -1 H HIS -1 76.093 15.568 3.396 32 HA HIS -1 HA HIS -1 75.433 18.332 2.546 33 HB2 HIS -1 HB2 HIS -1 77.312 16.343 1.268 34 HB3 HIS -1 HB3 HIS -1 76.916 17.924 0.623 35 HD1 HIS -1 HD1 HIS -1 77.569 19.986 2.350 36 HD2 HIS -1 HD2 HIS -1 79.522 16.345 2.905 37 HE1 HIS -1 HE1 HIS -1 79.627 20.482 3.737 38 H HIS 0 H HIS 0 73.829 18.581 1.122 39 HA HIS 0 HA HIS 0 72.070 16.488 0.464 40 HB2 HIS 0 HB2 HIS 0 71.493 18.910 0.527 41 HB3 HIS 0 HB3 HIS 0 72.401 19.132 -0.957 42 HD1 HIS 0 HD1 HIS 0 71.300 18.364 -3.149 43 HD2 HIS 0 HD2 HIS 0 69.003 17.521 0.225 44 HE1 HIS 0 HE1 HIS 0 69.017 17.671 -3.994 45 H SER 1 H SER 1 74.722 17.973 -1.348 46 HA SER 1 HA SER 1 74.219 16.807 -3.851 47 HB2 SER 1 HB2 SER 1 76.897 17.520 -2.633 48 HB3 SER 1 HB3 SER 1 76.567 17.278 -4.345 49 HG SER 1 HG SER 1 76.414 19.482 -3.220 50 H SER 2 H SER 2 75.296 15.047 -4.906 51 HA SER 2 HA SER 2 75.233 12.634 -3.444 52 HB2 SER 2 HB2 SER 2 76.513 13.204 -6.128 53 HB3 SER 2 HB3 SER 2 76.137 11.608 -5.485 54 HG SER 2 HG SER 2 74.345 13.663 -6.081 55 H GLY 3 H GLY 3 77.029 11.097 -3.210 56 HA2 GLY 3 HA2 GLY 3 79.270 12.337 -1.901 57 HA3 GLY 3 HA3 GLY 3 78.992 10.608 -2.085 58 H LEU 4 H LEU 4 81.370 10.640 -2.487 59 HA LEU 4 HA LEU 4 82.345 11.839 -4.918 60 HB2 LEU 4 HB2 LEU 4 83.641 9.731 -3.173 61 HB3 LEU 4 HB3 LEU 4 84.443 10.718 -4.393 62 HG LEU 4 HG LEU 4 83.070 11.796 -1.911 63 HD11 LEU 4 HD11 LEU 4 85.330 12.246 -1.100 64 HD12 LEU 4 HD12 LEU 4 86.021 11.587 -2.583 65 HD13 LEU 4 HD13 LEU 4 85.172 10.526 -1.459 66 HD21 LEU 4 HD21 LEU 4 84.398 13.878 -2.629 67 HD22 LEU 4 HD22 LEU 4 82.984 13.477 -3.604 68 HD23 LEU 4 HD23 LEU 4 84.600 13.078 -4.187 69 H VAL 5 H VAL 5 82.911 10.824 -6.826 70 HA VAL 5 HA VAL 5 81.901 8.064 -7.207 71 HB VAL 5 HB VAL 5 81.183 8.747 -9.472 72 HG11 VAL 5 HG11 VAL 5 80.044 10.461 -7.243 73 HG12 VAL 5 HG12 VAL 5 79.582 8.794 -7.590 74 HG13 VAL 5 HG13 VAL 5 79.229 10.069 -8.757 75 HG21 VAL 5 HG21 VAL 5 82.822 10.680 -9.605 76 HG22 VAL 5 HG22 VAL 5 81.738 11.578 -8.544 77 HG23 VAL 5 HG23 VAL 5 81.186 11.064 -10.138 78 HA PRO 6 HA PRO 6 85.764 7.011 -9.013 79 HB2 PRO 6 HB2 PRO 6 84.516 6.116 -11.554 80 HB3 PRO 6 HB3 PRO 6 85.498 5.206 -10.391 81 HG2 PRO 6 HG2 PRO 6 82.877 4.818 -10.599 82 HG3 PRO 6 HG3 PRO 6 83.707 4.742 -9.034 83 HD2 PRO 6 HD2 PRO 6 82.009 6.944 -10.154 84 HD3 PRO 6 HD3 PRO 6 82.121 6.346 -8.481 85 H ARG 7 H ARG 7 83.676 9.088 -10.877 86 HA ARG 7 HA ARG 7 85.311 9.790 -13.023 87 HB2 ARG 7 HB2 ARG 7 83.410 11.529 -11.433 88 HB3 ARG 7 HB3 ARG 7 84.082 11.946 -13.011 89 HG2 ARG 7 HG2 ARG 7 83.062 9.915 -13.981 90 HG3 ARG 7 HG3 ARG 7 82.370 9.517 -12.408 91 HD2 ARG 7 HD2 ARG 7 80.654 10.629 -13.679 92 HD3 ARG 7 HD3 ARG 7 81.208 11.753 -12.443 93 HE ARG 7 HE ARG 7 82.585 12.002 -14.979 94 HH11 ARG 7 HH11 ARG 7 79.830 13.095 -13.097 95 HH12 ARG 7 HH12 ARG 7 79.660 14.556 -14.010 96 HH21 ARG 7 HH21 ARG 7 82.316 13.900 -16.119 97 HH22 ARG 7 HH22 ARG 7 81.051 15.006 -15.699 98 H GLY 8 H GLY 8 85.400 10.892 -9.664 99 HA2 GLY 8 HA2 GLY 8 87.324 11.688 -8.561 100 HA3 GLY 8 HA3 GLY 8 88.071 11.994 -10.127 101 H SER 9 H SER 9 88.445 13.990 -8.508 102 HA SER 9 HA SER 9 86.412 15.884 -8.123 103 HB2 SER 9 HB2 SER 9 88.672 15.947 -7.054 104 HB3 SER 9 HB3 SER 9 89.347 16.445 -8.601 105 HG SER 9 HG SER 9 88.666 18.351 -8.112 106 H GLY 10 H GLY 10 88.612 15.374 -10.855 107 HA2 GLY 10 HA2 GLY 10 88.323 15.957 -13.082 108 HA3 GLY 10 HA3 GLY 10 86.777 16.687 -12.654 109 H MET 11 H MET 11 87.811 18.249 -14.321 110 HA MET 11 HA MET 11 89.063 20.425 -12.771 111 HB2 MET 11 HB2 MET 11 89.916 19.491 -15.521 112 HB3 MET 11 HB3 MET 11 90.476 20.971 -14.743 113 HG2 MET 11 HG2 MET 11 91.285 19.567 -12.815 114 HG3 MET 11 HG3 MET 11 90.891 18.134 -13.763 115 HE1 MET 11 HE1 MET 11 91.684 17.679 -16.057 116 HE2 MET 11 HE2 MET 11 93.129 18.322 -16.832 117 HE3 MET 11 HE3 MET 11 91.656 19.286 -16.793 118 H LYS 12 H LYS 12 88.608 22.531 -13.552 119 HA LYS 12 HA LYS 12 86.134 22.669 -15.142 120 HB2 LYS 12 HB2 LYS 12 87.464 24.813 -13.464 121 HB3 LYS 12 HB3 LYS 12 85.876 24.913 -14.221 122 HG2 LYS 12 HG2 LYS 12 86.662 22.871 -12.121 123 HG3 LYS 12 HG3 LYS 12 85.738 24.338 -11.802 124 HD2 LYS 12 HD2 LYS 12 84.034 23.543 -13.478 125 HD3 LYS 12 HD3 LYS 12 84.914 22.017 -13.568 126 HE2 LYS 12 HE2 LYS 12 84.090 23.084 -10.886 127 HE3 LYS 12 HE3 LYS 12 82.906 22.250 -11.891 128 HZ1 LYS 12 HZ1 LYS 12 84.232 20.837 -10.296 129 HZ2 LYS 12 HZ2 LYS 12 85.570 21.102 -11.309 130 HZ3 LYS 12 HZ3 LYS 12 84.191 20.310 -11.908 131 H GLU 13 H GLU 13 85.937 24.129 -16.886 132 HA GLU 13 HA GLU 13 88.090 24.203 -18.665 133 HB2 GLU 13 HB2 GLU 13 85.680 24.472 -19.276 134 HB3 GLU 13 HB3 GLU 13 85.742 26.111 -18.627 135 HG2 GLU 13 HG2 GLU 13 87.600 26.630 -20.202 136 HG3 GLU 13 HG3 GLU 13 87.437 25.020 -20.890 137 H THR 14 H THR 14 86.969 26.633 -16.344 138 HA THR 14 HA THR 14 89.497 28.112 -16.787 139 HB THR 14 HB THR 14 86.807 29.357 -16.174 140 HG1 THR 14 HG1 THR 14 86.696 29.719 -18.255 141 HG21 THR 14 HG21 THR 14 89.578 30.441 -16.701 142 HG22 THR 14 HG22 THR 14 88.549 30.726 -15.297 143 HG23 THR 14 HG23 THR 14 88.130 31.438 -16.855 144 H ALA 15 H ALA 15 90.601 28.648 -14.980 145 HA ALA 15 HA ALA 15 89.846 27.518 -12.468 146 HB1 ALA 15 HB1 ALA 15 91.980 29.594 -13.016 147 HB2 ALA 15 HB2 ALA 15 92.211 27.857 -13.219 148 HB3 ALA 15 HB3 ALA 15 91.879 28.522 -11.619 149 H ALA 16 H ALA 16 89.114 28.526 -10.602 150 HA ALA 16 HA ALA 16 87.443 30.815 -10.977 151 HB1 ALA 16 HB1 ALA 16 87.324 30.621 -8.379 152 HB2 ALA 16 HB2 ALA 16 88.214 29.119 -8.621 153 HB3 ALA 16 HB3 ALA 16 86.630 29.333 -9.365 154 H ALA 17 H ALA 17 87.893 32.907 -10.717 155 HA ALA 17 HA ALA 17 90.543 33.819 -10.296 156 HB1 ALA 17 HB1 ALA 17 88.132 35.573 -9.939 157 HB2 ALA 17 HB2 ALA 17 88.565 34.958 -11.534 158 HB3 ALA 17 HB3 ALA 17 89.700 35.970 -10.642 159 H LYS 18 H LYS 18 87.766 33.485 -8.146 160 HA LYS 18 HA LYS 18 89.474 34.352 -5.885 161 HB2 LYS 18 HB2 LYS 18 87.712 36.027 -6.459 162 HB3 LYS 18 HB3 LYS 18 86.491 34.792 -6.148 163 HG2 LYS 18 HG2 LYS 18 87.378 34.536 -3.837 164 HG3 LYS 18 HG3 LYS 18 88.520 35.843 -4.154 165 HD2 LYS 18 HD2 LYS 18 86.577 37.335 -4.689 166 HD3 LYS 18 HD3 LYS 18 85.496 36.037 -4.183 167 HE2 LYS 18 HE2 LYS 18 87.684 36.928 -2.330 168 HE3 LYS 18 HE3 LYS 18 86.207 37.885 -2.450 169 HZ1 LYS 18 HZ1 LYS 18 86.278 36.033 -0.727 170 HZ2 LYS 18 HZ2 LYS 18 86.117 34.962 -2.036 171 HZ3 LYS 18 HZ3 LYS 18 84.909 36.116 -1.725 172 H PHE 19 H PHE 19 89.502 33.058 -4.131 173 HA PHE 19 HA PHE 19 87.571 30.827 -3.984 174 HB2 PHE 19 HB2 PHE 19 89.355 29.292 -3.399 175 HB3 PHE 19 HB3 PHE 19 89.661 29.997 -4.974 176 HD1 PHE 19 HD2 PHE 19 91.431 31.734 -5.244 177 HD2 PHE 19 HD1 PHE 19 90.820 29.652 -1.537 178 HE1 PHE 19 HE2 PHE 19 93.671 32.461 -4.467 179 HE2 PHE 19 HE1 PHE 19 93.060 30.378 -0.760 180 HZ PHE 19 HZ PHE 19 94.485 31.784 -2.224 181 H GLU 20 H GLU 20 87.507 29.829 -1.816 182 HA GLU 20 HA GLU 20 87.783 31.905 0.240 183 HB2 GLU 20 HB2 GLU 20 86.256 30.540 1.571 184 HB3 GLU 20 HB3 GLU 20 85.575 30.844 -0.025 185 HG2 GLU 20 HG2 GLU 20 86.421 28.610 -0.765 186 HG3 GLU 20 HG3 GLU 20 86.972 28.310 0.876 187 H ARG 21 H ARG 21 89.029 31.687 2.038 188 HA ARG 21 HA ARG 21 91.231 29.871 1.928 189 HB2 ARG 21 HB2 ARG 21 90.304 31.609 4.228 190 HB3 ARG 21 HB3 ARG 21 91.894 30.870 4.057 191 HG2 ARG 21 HG2 ARG 21 90.725 32.851 2.086 192 HG3 ARG 21 HG3 ARG 21 91.837 33.286 3.382 193 HD2 ARG 21 HD2 ARG 21 93.487 31.653 2.438 194 HD3 ARG 21 HD3 ARG 21 92.392 31.391 1.083 195 HE ARG 21 HE ARG 21 93.077 33.412 0.206 196 HH11 ARG 21 HH11 ARG 21 93.985 33.346 3.597 197 HH12 ARG 21 HH12 ARG 21 94.870 34.832 3.491 198 HH21 ARG 21 HH21 ARG 21 94.230 35.319 0.131 199 HH22 ARG 21 HH22 ARG 21 95.006 35.934 1.553 200 H GLN 22 H GLN 22 91.649 28.046 3.098 201 HA GLN 22 HA GLN 22 89.473 27.018 4.832 202 HB2 GLN 22 HB2 GLN 22 91.277 25.484 2.944 203 HB3 GLN 22 HB3 GLN 22 90.145 24.748 4.080 204 HG2 GLN 22 HG2 GLN 22 88.268 25.872 2.991 205 HG3 GLN 22 HG3 GLN 22 89.371 26.702 1.896 206 HE21 GLN 22 HE21 GLN 22 87.293 25.002 0.908 207 HE22 GLN 22 HE22 GLN 22 88.012 23.643 0.189 208 H HIS 23 H HIS 23 90.059 26.138 6.768 209 HA HIS 23 HA HIS 23 92.936 25.886 7.374 210 HB2 HIS 23 HB2 HIS 23 90.897 27.336 9.067 211 HB3 HIS 23 HB3 HIS 23 92.537 26.961 9.564 212 HD1 HIS 23 HD1 HIS 23 94.446 28.065 7.891 213 HD2 HIS 23 HD2 HIS 23 90.651 29.790 7.853 214 HE1 HIS 23 HE1 HIS 23 94.717 30.367 6.875 215 H MET 24 H MET 24 93.424 24.464 9.101 216 HA MET 24 HA MET 24 91.200 22.688 9.935 217 HB2 MET 24 HB2 MET 24 94.072 21.912 9.354 218 HB3 MET 24 HB3 MET 24 92.795 20.824 9.890 219 HG2 MET 24 HG2 MET 24 92.836 22.377 7.284 220 HG3 MET 24 HG3 MET 24 93.106 20.647 7.461 221 HE1 MET 24 HE1 MET 24 89.813 19.172 8.533 222 HE2 MET 24 HE2 MET 24 90.824 19.913 9.771 223 HE3 MET 24 HE3 MET 24 91.574 19.051 8.430 224 H ASP 25 H ASP 25 91.228 21.964 12.055 225 HA ASP 25 HA ASP 25 92.889 23.579 13.854 226 HB2 ASP 25 HB2 ASP 25 91.318 22.845 15.602 227 HB3 ASP 25 HB3 ASP 25 90.472 23.587 14.245 228 H SER 26 H SER 26 94.757 22.714 14.467 229 HA SER 26 HA SER 26 94.829 19.833 15.167 230 HB2 SER 26 HB2 SER 26 96.872 21.551 13.777 231 HB3 SER 26 HB3 SER 26 97.315 20.060 14.597 232 HG SER 26 HG SER 26 96.751 19.777 12.397 233 HA PRO 27 HA PRO 27 96.239 22.125 18.888 234 HB2 PRO 27 HB2 PRO 27 95.000 20.672 20.791 235 HB3 PRO 27 HB3 PRO 27 94.125 21.869 19.815 236 HG2 PRO 27 HG2 PRO 27 94.109 18.919 19.640 237 HG3 PRO 27 HG3 PRO 27 92.822 20.085 19.293 238 HD2 PRO 27 HD2 PRO 27 94.477 18.821 17.387 239 HD3 PRO 27 HD3 PRO 27 93.394 20.197 17.095 240 H ASP 28 H ASP 28 98.263 21.747 19.570 241 HA ASP 28 HA ASP 28 99.592 19.273 19.374 242 HB2 ASP 28 HB2 ASP 28 101.397 20.342 20.613 243 HB3 ASP 28 HB3 ASP 28 100.747 21.450 19.410 244 H LEU 29 H LEU 29 97.823 20.758 22.039 245 HA LEU 29 HA LEU 29 98.665 18.659 23.891 246 HB2 LEU 29 HB2 LEU 29 98.453 21.083 24.563 247 HB3 LEU 29 HB3 LEU 29 96.708 20.914 24.375 248 HG LEU 29 HG LEU 29 98.170 18.910 26.064 249 HD11 LEU 29 HD11 LEU 29 97.299 21.648 27.037 250 HD12 LEU 29 HD12 LEU 29 98.975 21.147 26.812 251 HD13 LEU 29 HD13 LEU 29 97.972 20.353 28.027 252 HD21 LEU 29 HD21 LEU 29 95.924 19.330 27.363 253 HD22 LEU 29 HD22 LEU 29 95.894 18.392 25.870 254 HD23 LEU 29 HD23 LEU 29 95.409 20.087 25.854 255 H GLY 30 H GLY 30 97.524 16.874 24.263 256 HA2 GLY 30 HA2 GLY 30 94.636 16.841 24.121 257 HA3 GLY 30 HA3 GLY 30 95.419 15.896 22.856 258 H THR 31 H THR 31 93.785 14.636 24.669 259 HA THR 31 HA THR 31 95.722 13.050 26.252 260 HB THR 31 HB THR 31 94.044 12.777 28.001 261 HG1 THR 31 HG1 THR 31 92.502 14.609 26.595 262 HG21 THR 31 HG21 THR 31 94.368 15.709 27.307 263 HG22 THR 31 HG22 THR 31 95.615 14.724 28.073 264 HG23 THR 31 HG23 THR 31 94.093 15.028 28.911 265 H ASP 32 H ASP 32 94.993 10.850 26.697 266 HA ASP 32 HA ASP 32 93.003 9.823 24.768 267 HB2 ASP 32 HB2 ASP 32 94.464 7.898 24.323 268 HB3 ASP 32 HB3 ASP 32 95.239 9.410 23.853 269 H ASP 33 H ASP 33 94.755 9.369 27.802 270 HA ASP 33 HA ASP 33 93.585 6.993 28.685 271 HB2 ASP 33 HB2 ASP 33 94.483 9.411 30.264 272 HB3 ASP 33 HB3 ASP 33 94.077 7.852 30.977 273 H ASP 34 H ASP 34 92.336 10.295 28.750 274 HA ASP 34 HA ASP 34 90.242 9.994 30.565 275 HB2 ASP 34 HB2 ASP 34 90.379 11.685 28.060 276 HB3 ASP 34 HB3 ASP 34 89.159 11.860 29.319 277 H ASP 35 H ASP 35 88.042 9.523 30.328 278 HA ASP 35 HA ASP 35 87.390 7.239 28.898 279 HB2 ASP 35 HB2 ASP 35 86.140 8.208 30.851 280 HB3 ASP 35 HB3 ASP 35 85.428 9.377 29.742 281 H LYS 36 H LYS 36 87.038 10.625 27.950 282 HA LYS 36 HA LYS 36 85.552 10.000 25.555 283 HB2 LYS 36 HB2 LYS 36 86.912 12.536 26.488 284 HB3 LYS 36 HB3 LYS 36 85.926 12.414 25.032 285 HG2 LYS 36 HG2 LYS 36 83.983 11.758 26.343 286 HG3 LYS 36 HG3 LYS 36 84.950 11.725 27.818 287 HD2 LYS 36 HD2 LYS 36 83.753 13.827 27.767 288 HD3 LYS 36 HD3 LYS 36 85.456 14.166 27.453 289 HE2 LYS 36 HE2 LYS 36 85.059 14.348 25.081 290 HE3 LYS 36 HE3 LYS 36 83.403 13.771 25.262 291 HZ1 LYS 36 HZ1 LYS 36 84.454 16.402 25.615 292 HZ2 LYS 36 HZ2 LYS 36 83.581 15.886 26.978 293 HZ3 LYS 36 HZ3 LYS 36 82.843 15.897 25.449 294 H THR 37 H THR 37 86.288 10.159 23.427 295 HA THR 37 HA THR 37 89.200 9.743 23.106 296 HB THR 37 HB THR 37 87.006 8.903 21.202 297 HG1 THR 37 HG1 THR 37 86.665 7.592 22.814 298 HG21 THR 37 HG21 THR 37 88.746 7.458 20.288 299 HG22 THR 37 HG22 THR 37 89.876 7.988 21.534 300 HG23 THR 37 HG23 THR 37 89.323 9.125 20.306 301 H GLY 38 H GLY 38 90.282 10.776 21.396 302 HA2 GLY 38 HA2 GLY 38 89.462 13.441 20.905 303 HA3 GLY 38 HA3 GLY 38 90.810 12.622 20.126 304 H GLY 39 H GLY 39 89.315 10.498 18.931 305 HA2 GLY 39 HA2 GLY 39 88.247 11.908 16.635 306 HA3 GLY 39 HA3 GLY 39 88.449 10.165 16.792 307 H GLY 40 H GLY 40 86.162 10.994 15.646 308 HA2 GLY 40 HA2 GLY 40 84.076 11.168 17.691 309 HA3 GLY 40 HA3 GLY 40 83.846 11.325 15.952 310 H ARG 41 H ARG 41 82.039 9.804 17.096 311 HA ARG 41 HA ARG 41 82.610 7.088 17.518 312 HB2 ARG 41 HB2 ARG 41 80.096 8.393 16.454 313 HB3 ARG 41 HB3 ARG 41 80.205 6.723 17.013 314 HG2 ARG 41 HG2 ARG 41 80.981 7.553 19.233 315 HG3 ARG 41 HG3 ARG 41 80.741 9.207 18.668 316 HD2 ARG 41 HD2 ARG 41 78.342 8.611 18.183 317 HD3 ARG 41 HD3 ARG 41 78.626 7.061 18.970 318 HE ARG 41 HE ARG 41 79.417 9.227 20.653 319 HH11 ARG 41 HH11 ARG 41 76.556 7.533 19.524 320 HH12 ARG 41 HH12 ARG 41 75.635 7.946 20.931 321 HH21 ARG 41 HH21 ARG 41 78.180 9.727 22.441 322 HH22 ARG 41 HH22 ARG 41 76.543 9.173 22.561 323 H ALA 42 H ALA 42 82.077 8.891 14.533 324 HA ALA 42 HA ALA 42 81.569 6.790 12.771 325 HB1 ALA 42 HB1 ALA 42 82.782 8.360 11.090 326 HB2 ALA 42 HB2 ALA 42 82.866 9.481 12.450 327 HB3 ALA 42 HB3 ALA 42 81.300 8.925 11.860 328 H ASP 43 H ASP 43 82.841 5.447 11.538 329 HA ASP 43 HA ASP 43 85.273 4.574 12.709 330 HB2 ASP 43 HB2 ASP 43 83.738 3.055 11.546 331 HB3 ASP 43 HB3 ASP 43 84.029 3.904 10.030 332 HA PRO 44 HA PRO 44 87.989 7.300 10.358 333 HB2 PRO 44 HB2 PRO 44 90.349 5.923 10.486 334 HB3 PRO 44 HB3 PRO 44 89.696 6.861 11.844 335 HG2 PRO 44 HG2 PRO 44 89.625 3.930 11.366 336 HG3 PRO 44 HG3 PRO 44 89.867 4.826 12.877 337 HD2 PRO 44 HD2 PRO 44 87.481 3.683 12.205 338 HD3 PRO 44 HD3 PRO 44 87.608 5.128 13.226 339 H ALA 45 H ALA 45 89.991 6.741 8.641 340 HA ALA 45 HA ALA 45 88.674 5.928 6.297 341 HB1 ALA 45 HB1 ALA 45 91.154 5.683 5.470 342 HB2 ALA 45 HB2 ALA 45 91.542 6.398 7.034 343 HB3 ALA 45 HB3 ALA 45 90.523 7.275 5.892 344 H HIS 46 H HIS 46 88.348 4.006 5.363 345 HA HIS 46 HA HIS 46 88.709 1.593 6.752 346 HB2 HIS 46 HB2 HIS 46 88.240 2.078 3.811 347 HB3 HIS 46 HB3 HIS 46 88.113 0.517 4.598 348 HD1 HIS 46 HD1 HIS 46 86.275 0.531 6.688 349 HD2 HIS 46 HD2 HIS 46 85.858 3.444 3.735 350 HE1 HIS 46 HE1 HIS 46 83.904 1.398 6.868 351 H ARG 47 H ARG 47 90.697 3.175 4.296 352 HA ARG 47 HA ARG 47 92.542 0.880 4.289 353 HB2 ARG 47 HB2 ARG 47 92.416 3.335 2.520 354 HB3 ARG 47 HB3 ARG 47 93.566 2.008 2.342 355 HG2 ARG 47 HG2 ARG 47 91.658 0.433 2.061 356 HG3 ARG 47 HG3 ARG 47 90.548 1.802 2.138 357 HD2 ARG 47 HD2 ARG 47 91.796 2.816 0.194 358 HD3 ARG 47 HD3 ARG 47 92.689 1.305 0.057 359 HE ARG 47 HE ARG 47 89.850 0.885 0.068 360 HH11 ARG 47 HH11 ARG 47 92.524 1.796 -2.018 361 HH12 ARG 47 HH12 ARG 47 91.712 1.271 -3.454 362 HH21 ARG 47 HH21 ARG 47 88.854 0.229 -1.816 363 HH22 ARG 47 HH22 ARG 47 89.660 0.396 -3.342 364 H SER 48 H SER 48 94.563 0.987 5.116 365 HA SER 48 HA SER 48 95.183 3.169 6.865 366 HB2 SER 48 HB2 SER 48 96.592 0.608 6.182 367 HB3 SER 48 HB3 SER 48 97.368 1.844 7.165 368 HG SER 48 HG SER 48 95.753 1.588 8.616 369 HA PRO 49 HA PRO 49 98.840 3.872 3.601 370 HB2 PRO 49 HB2 PRO 49 97.139 3.338 1.204 371 HB3 PRO 49 HB3 PRO 49 98.878 3.076 1.439 372 HG2 PRO 49 HG2 PRO 49 97.080 1.080 1.467 373 HG3 PRO 49 HG3 PRO 49 98.582 1.046 2.403 374 HD2 PRO 49 HD2 PRO 49 95.810 1.341 3.358 375 HD3 PRO 49 HD3 PRO 49 97.268 0.838 4.235 376 H VAL 50 H VAL 50 98.942 6.054 3.468 377 HA VAL 50 HA VAL 50 96.470 7.563 3.180 378 HB VAL 50 HB VAL 50 99.287 8.535 3.721 379 HG11 VAL 50 HG11 VAL 50 96.578 9.891 3.850 380 HG12 VAL 50 HG12 VAL 50 97.932 10.318 2.803 381 HG13 VAL 50 HG13 VAL 50 98.049 10.572 4.544 382 HG21 VAL 50 HG21 VAL 50 98.261 7.013 5.470 383 HG22 VAL 50 HG22 VAL 50 96.974 8.204 5.651 384 HG23 VAL 50 HG23 VAL 50 98.637 8.638 6.044 385 HA PRO 51 HA PRO 51 97.170 8.079 -1.231 386 HB2 PRO 51 HB2 PRO 51 96.085 10.837 -0.900 387 HB3 PRO 51 HB3 PRO 51 95.584 9.553 -2.017 388 HG2 PRO 51 HG2 PRO 51 94.131 10.189 0.120 389 HG3 PRO 51 HG3 PRO 51 94.266 8.518 -0.457 390 HD2 PRO 51 HD2 PRO 51 95.540 9.787 1.925 391 HD3 PRO 51 HD3 PRO 51 95.009 8.109 1.684 392 H LEU 52 H LEU 52 98.570 9.250 -2.673 393 HA LEU 52 HA LEU 52 100.945 10.182 -1.462 394 HB2 LEU 52 HB2 LEU 52 99.955 10.426 -4.313 395 HB3 LEU 52 HB3 LEU 52 101.592 10.826 -3.792 396 HG LEU 52 HG LEU 52 100.326 8.119 -3.311 397 HD11 LEU 52 HD11 LEU 52 100.444 8.150 -5.646 398 HD12 LEU 52 HD12 LEU 52 102.034 7.522 -5.216 399 HD13 LEU 52 HD13 LEU 52 101.847 9.218 -5.659 400 HD21 LEU 52 HD21 LEU 52 102.160 8.491 -1.831 401 HD22 LEU 52 HD22 LEU 52 103.113 9.274 -3.090 402 HD23 LEU 52 HD23 LEU 52 102.823 7.536 -3.157 403 HA PRO 53 HA PRO 53 99.908 14.465 -0.914 404 HB2 PRO 53 HB2 PRO 53 102.337 15.688 -1.059 405 HB3 PRO 53 HB3 PRO 53 101.838 14.706 0.333 406 HG2 PRO 53 HG2 PRO 53 103.638 14.009 -1.921 407 HG3 PRO 53 HG3 PRO 53 103.743 13.569 -0.207 408 HD2 PRO 53 HD2 PRO 53 102.809 11.871 -2.166 409 HD3 PRO 53 HD3 PRO 53 102.363 11.750 -0.451 410 H SER 54 H SER 54 99.800 16.534 -2.028 411 HA SER 54 HA SER 54 99.207 16.303 -4.723 412 HB2 SER 54 HB2 SER 54 100.051 18.896 -3.438 413 HB3 SER 54 HB3 SER 54 98.887 18.652 -4.736 414 HG SER 54 HG SER 54 97.615 17.581 -3.207 415 HA PRO 55 HA PRO 55 103.499 16.191 -5.966 416 HB2 PRO 55 HB2 PRO 55 103.274 15.693 -8.605 417 HB3 PRO 55 HB3 PRO 55 102.835 14.484 -7.382 418 HG2 PRO 55 HG2 PRO 55 101.090 16.223 -9.026 419 HG3 PRO 55 HG3 PRO 55 100.836 14.557 -8.478 420 HD2 PRO 55 HD2 PRO 55 99.719 16.825 -7.289 421 HD3 PRO 55 HD3 PRO 55 99.855 15.226 -6.529 422 H THR 56 H THR 56 104.673 18.047 -5.957 423 HA THR 56 HA THR 56 104.200 20.193 -7.837 424 HB THR 56 HB THR 56 106.321 21.094 -7.032 425 HG1 THR 56 HG1 THR 56 107.642 19.489 -6.700 426 HG21 THR 56 HG21 THR 56 104.643 19.868 -4.826 427 HG22 THR 56 HG22 THR 56 104.410 21.451 -5.570 428 HG23 THR 56 HG23 THR 56 105.837 21.143 -4.580 429 H SER 57 H SER 57 105.841 20.709 -9.575 430 HA SER 57 HA SER 57 105.923 18.543 -11.346 431 HB2 SER 57 HB2 SER 57 106.014 20.918 -12.049 432 HB3 SER 57 HB3 SER 57 107.652 21.026 -11.413 433 HG SER 57 HG SER 57 106.724 19.806 -13.660 434 H ASN 58 H ASN 58 107.167 16.830 -11.444 435 HA ASN 58 HA ASN 58 108.992 15.464 -11.432 436 HB2 ASN 58 HB2 ASN 58 110.511 18.067 -11.206 437 HB3 ASN 58 HB3 ASN 58 111.221 16.499 -11.581 438 HD21 ASN 58 HD21 ASN 58 111.268 18.803 -13.380 439 HD22 ASN 58 HD22 ASN 58 110.389 18.368 -14.765 440 H LYS 59 H LYS 59 107.724 16.390 -8.785 441 HA LYS 59 HA LYS 59 109.736 15.151 -7.103 442 HB2 LYS 59 HB2 LYS 59 110.443 17.531 -7.192 443 HB3 LYS 59 HB3 LYS 59 108.881 17.990 -6.516 444 HG2 LYS 59 HG2 LYS 59 109.349 16.558 -4.533 445 HG3 LYS 59 HG3 LYS 59 110.945 16.203 -5.196 446 HD2 LYS 59 HD2 LYS 59 111.429 18.659 -5.215 447 HD3 LYS 59 HD3 LYS 59 109.886 18.930 -4.402 448 HE2 LYS 59 HE2 LYS 59 111.890 16.998 -3.254 449 HE3 LYS 59 HE3 LYS 59 112.037 18.728 -2.944 450 HZ1 LYS 59 HZ1 LYS 59 109.698 17.007 -2.331 451 HZ2 LYS 59 HZ2 LYS 59 109.716 18.697 -2.157 452 HZ3 LYS 59 HZ3 LYS 59 110.747 17.730 -1.212 453 H GLN 60 H GLN 60 108.891 14.171 -5.336 454 HA GLN 60 HA GLN 60 106.378 15.115 -4.194 455 HB2 GLN 60 HB2 GLN 60 106.733 12.274 -5.165 456 HB3 GLN 60 HB3 GLN 60 105.465 12.787 -4.055 457 HG2 GLN 60 HG2 GLN 60 104.738 14.466 -5.790 458 HG3 GLN 60 HG3 GLN 60 105.897 13.724 -6.896 459 HE21 GLN 60 HE21 GLN 60 102.747 13.288 -5.352 460 HE22 GLN 60 HE22 GLN 60 102.374 11.837 -6.149 461 H ASP 61 H ASP 61 106.069 14.494 -2.028 462 HA ASP 61 HA ASP 61 108.445 13.387 -0.692 463 HB2 ASP 61 HB2 ASP 61 105.950 14.683 0.438 464 HB3 ASP 61 HB3 ASP 61 107.330 14.135 1.386 465 H ILE 62 H ILE 62 108.458 11.319 0.074 466 HA ILE 62 HA ILE 62 105.854 9.921 0.315 467 HB ILE 62 HB ILE 62 106.953 9.283 -1.802 468 HG12 ILE 62 HG12 ILE 62 107.205 6.952 0.079 469 HG13 ILE 62 HG13 ILE 62 105.635 7.701 -0.188 470 HG21 ILE 62 HG21 ILE 62 109.130 8.039 -0.115 471 HG22 ILE 62 HG22 ILE 62 109.309 9.633 -0.850 472 HG23 ILE 62 HG23 ILE 62 109.075 8.213 -1.869 473 HD11 ILE 62 HD11 ILE 62 107.183 7.088 -2.651 474 HD12 ILE 62 HD12 ILE 62 105.463 6.896 -2.312 475 HD13 ILE 62 HD13 ILE 62 106.616 5.698 -1.730 476 H SER 63 H SER 63 105.793 8.172 1.811 477 HA SER 63 HA SER 63 108.028 7.921 3.664 478 HB2 SER 63 HB2 SER 63 106.806 8.645 5.610 479 HB3 SER 63 HB3 SER 63 106.746 9.935 4.414 480 HG SER 63 HG SER 63 104.769 8.020 4.888 481 H GLU 64 H GLU 64 107.544 6.353 5.420 482 HA GLU 64 HA GLU 64 106.590 3.921 4.482 483 HB2 GLU 64 HB2 GLU 64 106.587 3.214 6.856 484 HB3 GLU 64 HB3 GLU 64 108.053 4.091 6.423 485 HG2 GLU 64 HG2 GLU 64 107.048 6.168 7.337 486 HG3 GLU 64 HG3 GLU 64 105.648 5.239 7.858 487 H ALA 65 H ALA 65 104.850 6.520 6.140 488 HA ALA 65 HA ALA 65 102.520 5.104 6.814 489 HB1 ALA 65 HB1 ALA 65 101.471 7.493 6.458 490 HB2 ALA 65 HB2 ALA 65 103.158 7.983 6.298 491 HB3 ALA 65 HB3 ALA 65 102.601 7.206 7.781 492 H ASN 66 H ASN 66 103.467 6.728 3.808 493 HA ASN 66 HA ASN 66 100.956 6.489 2.507 494 HB2 ASN 66 HB2 ASN 66 103.721 6.647 1.277 495 HB3 ASN 66 HB3 ASN 66 102.193 6.961 0.455 496 HD21 ASN 66 HD21 ASN 66 100.823 8.772 1.515 497 HD22 ASN 66 HD22 ASN 66 101.667 10.103 2.146 498 H LEU 67 H LEU 67 103.878 4.474 2.441 499 HA LEU 67 HA LEU 67 102.628 2.630 0.574 500 HB2 LEU 67 HB2 LEU 67 105.368 3.059 1.660 501 HB3 LEU 67 HB3 LEU 67 104.975 1.459 1.040 502 HG LEU 67 HG LEU 67 104.311 2.432 -1.115 503 HD11 LEU 67 HD11 LEU 67 103.498 4.620 -0.321 504 HD12 LEU 67 HD12 LEU 67 104.715 4.824 -1.577 505 HD13 LEU 67 HD13 LEU 67 105.144 5.080 0.114 506 HD21 LEU 67 HD21 LEU 67 106.777 1.934 -0.402 507 HD22 LEU 67 HD22 LEU 67 106.959 3.688 -0.445 508 HD23 LEU 67 HD23 LEU 67 106.483 2.815 -1.902 509 H ALA 68 H ALA 68 102.710 2.812 3.975 510 HA ALA 68 HA ALA 68 101.986 1.357 5.587 511 HB1 ALA 68 HB1 ALA 68 101.121 -0.753 3.706 512 HB2 ALA 68 HB2 ALA 68 100.401 0.832 3.429 513 HB3 ALA 68 HB3 ALA 68 100.224 0.045 4.997 514 H TYR 69 H TYR 69 102.079 -1.635 5.304 515 HA TYR 69 HA TYR 69 104.669 -2.030 6.299 516 HB2 TYR 69 HB2 TYR 69 102.780 -4.028 5.059 517 HB3 TYR 69 HB3 TYR 69 104.198 -4.434 6.007 518 HD1 TYR 69 HD1 TYR 69 104.290 -3.730 8.442 519 HD2 TYR 69 HD2 TYR 69 100.714 -3.476 6.075 520 HE1 TYR 69 HE1 TYR 69 102.931 -3.581 10.511 521 HE2 TYR 69 HE2 TYR 69 99.355 -3.328 8.144 522 HH TYR 69 HH TYR 69 99.558 -2.888 10.424 523 H LEU 70 H LEU 70 103.598 -1.841 3.012 524 HA LEU 70 HA LEU 70 105.523 -3.430 1.712 525 HB2 LEU 70 HB2 LEU 70 104.249 -0.870 0.728 526 HB3 LEU 70 HB3 LEU 70 105.035 -2.091 -0.271 527 HG LEU 70 HG LEU 70 102.602 -2.584 1.471 528 HD11 LEU 70 HD11 LEU 70 102.914 -2.180 -1.518 529 HD12 LEU 70 HD12 LEU 70 101.997 -1.168 -0.402 530 HD13 LEU 70 HD13 LEU 70 101.451 -2.808 -0.757 531 HD21 LEU 70 HD21 LEU 70 104.213 -4.297 -0.429 532 HD22 LEU 70 HD22 LEU 70 102.544 -4.688 -0.017 533 HD23 LEU 70 HD23 LEU 70 103.776 -4.642 1.244 534 H TRP 71 H TRP 71 105.934 -0.439 3.380 535 HA TRP 71 HA TRP 71 107.934 0.841 1.949 536 HB2 TRP 71 HB2 TRP 71 106.684 1.639 3.981 537 HB3 TRP 71 HB3 TRP 71 107.761 0.652 4.947 538 HD1 TRP 71 HD1 TRP 71 109.749 1.882 5.872 539 HE1 TRP 71 HE1 TRP 71 111.035 4.031 5.280 540 HE3 TRP 71 HE3 TRP 71 107.353 3.188 1.555 541 HZ2 TRP 71 HZ2 TRP 71 111.072 6.034 3.225 542 HZ3 TRP 71 HZ3 TRP 71 108.036 5.210 0.302 543 HH2 TRP 71 HH2 TRP 71 109.887 6.633 1.128 544 HA PRO 72 HA PRO 72 110.935 -2.485 2.819 545 HB2 PRO 72 HB2 PRO 72 112.580 -2.187 0.728 546 HB3 PRO 72 HB3 PRO 72 110.924 -2.794 0.517 547 HG2 PRO 72 HG2 PRO 72 112.042 -0.122 -0.085 548 HG3 PRO 72 HG3 PRO 72 110.767 -1.031 -0.912 549 HD2 PRO 72 HD2 PRO 72 110.389 1.040 0.978 550 HD3 PRO 72 HD3 PRO 72 109.143 -0.055 0.345 551 H LEU 73 H LEU 73 111.617 0.893 2.826 552 HA LEU 73 HA LEU 73 114.475 0.566 3.317 553 HB2 LEU 73 HB2 LEU 73 112.787 3.074 3.378 554 HB3 LEU 73 HB3 LEU 73 114.546 2.992 3.382 555 HG LEU 73 HG LEU 73 112.766 1.964 1.154 556 HD11 LEU 73 HD11 LEU 73 112.853 4.465 1.464 557 HD12 LEU 73 HD12 LEU 73 113.505 3.913 -0.082 558 HD13 LEU 73 HD13 LEU 73 114.599 4.376 1.223 559 HD21 LEU 73 HD21 LEU 73 114.839 0.705 1.253 560 HD22 LEU 73 HD22 LEU 73 115.777 2.180 1.478 561 HD23 LEU 73 HD23 LEU 73 114.980 1.869 -0.065 562 H THR 74 H THR 74 115.506 0.887 5.207 563 HA THR 74 HA THR 74 114.141 0.598 7.674 564 HB THR 74 HB THR 74 116.341 0.941 8.695 565 HG1 THR 74 HG1 THR 74 117.368 1.411 6.178 566 HG21 THR 74 HG21 THR 74 117.586 -0.822 7.404 567 HG22 THR 74 HG22 THR 74 116.343 -0.715 6.158 568 HG23 THR 74 HG23 THR 74 115.919 -1.259 7.781 569 H VAL 75 H VAL 75 115.484 3.419 5.958 570 HA VAL 75 HA VAL 75 114.952 5.268 8.073 571 HB VAL 75 HB VAL 75 115.145 7.015 6.338 572 HG11 VAL 75 HG11 VAL 75 117.164 4.778 6.429 573 HG12 VAL 75 HG12 VAL 75 117.230 6.353 7.219 574 HG13 VAL 75 HG13 VAL 75 117.461 6.232 5.474 575 HG21 VAL 75 HG21 VAL 75 115.262 4.638 4.459 576 HG22 VAL 75 HG22 VAL 75 115.699 6.281 4.005 577 HG23 VAL 75 HG23 VAL 75 114.041 5.910 4.471 578 H ASP 76 H ASP 76 113.067 6.274 8.614 579 HA ASP 76 HA ASP 76 110.727 4.859 7.946 580 HB2 ASP 76 HB2 ASP 76 111.066 7.525 9.337 581 HB3 ASP 76 HB3 ASP 76 109.551 6.632 9.254 582 H HIS 77 H HIS 77 112.059 7.856 6.638 583 HA HIS 77 HA HIS 77 110.042 7.700 4.531 584 HB2 HIS 77 HB2 HIS 77 109.546 10.129 4.721 585 HB3 HIS 77 HB3 HIS 77 108.936 9.166 6.052 586 HD1 HIS 77 HD1 HIS 77 110.964 9.085 8.112 587 HD2 HIS 77 HD2 HIS 77 110.623 12.449 5.672 588 HE1 HIS 77 HE1 HIS 77 112.050 10.995 9.369 589 H GLY 78 H GLY 78 110.506 9.445 2.843 590 HA2 GLY 78 HA2 GLY 78 113.063 10.690 2.745 591 HA3 GLY 78 HA3 GLY 78 113.020 9.238 1.749 592 H THR 79 H THR 79 113.385 11.769 0.648 593 HA THR 79 HA THR 79 110.790 12.341 -0.664 594 HB THR 79 HB THR 79 113.209 14.148 -0.685 595 HG1 THR 79 HG1 THR 79 111.076 14.191 1.107 596 HG21 THR 79 HG21 THR 79 110.264 14.337 -1.305 597 HG22 THR 79 HG22 THR 79 111.634 14.819 -2.307 598 HG23 THR 79 HG23 THR 79 111.185 15.787 -0.903 599 H ILE 80 H ILE 80 110.647 12.298 -2.883 600 HA ILE 80 HA ILE 80 112.993 11.184 -4.306 601 HB ILE 80 HB ILE 80 111.336 10.251 -5.903 602 HG12 ILE 80 HG12 ILE 80 109.270 11.119 -3.855 603 HG13 ILE 80 HG13 ILE 80 109.531 11.948 -5.387 604 HG21 ILE 80 HG21 ILE 80 110.976 9.534 -2.979 605 HG22 ILE 80 HG22 ILE 80 112.175 8.866 -4.087 606 HG23 ILE 80 HG23 ILE 80 110.462 8.518 -4.326 607 HD11 ILE 80 HD11 ILE 80 107.831 10.501 -5.987 608 HD12 ILE 80 HD12 ILE 80 108.375 9.236 -4.880 609 HD13 ILE 80 HD13 ILE 80 109.241 9.518 -6.391 610 H GLU 81 H GLU 81 113.737 12.191 -6.117 611 HA GLU 81 HA GLU 81 112.183 14.395 -7.249 612 HB2 GLU 81 HB2 GLU 81 113.500 15.355 -5.361 613 HB3 GLU 81 HB3 GLU 81 114.975 14.837 -6.178 614 HG2 GLU 81 HG2 GLU 81 114.314 16.184 -8.163 615 HG3 GLU 81 HG3 GLU 81 112.902 16.751 -7.284 616 H CYS 82 H CYS 82 112.596 14.837 -9.320 617 HA CYS 82 HA CYS 82 114.760 13.353 -10.673 618 HB2 CYS 82 HB2 CYS 82 112.171 14.563 -11.648 619 HB3 CYS 82 HB3 CYS 82 113.455 14.086 -12.758 620 H LEU 83 H LEU 83 116.540 14.484 -11.157 621 HA LEU 83 HA LEU 83 116.558 17.365 -10.826 622 HB2 LEU 83 HB2 LEU 83 118.759 15.439 -11.604 623 HB3 LEU 83 HB3 LEU 83 118.986 17.149 -11.237 624 HG LEU 83 HG LEU 83 117.672 15.254 -9.286 625 HD11 LEU 83 HD11 LEU 83 119.940 15.270 -8.147 626 HD12 LEU 83 HD12 LEU 83 120.600 15.942 -9.638 627 HD13 LEU 83 HD13 LEU 83 119.867 14.337 -9.643 628 HD21 LEU 83 HD21 LEU 83 117.275 17.609 -8.856 629 HD22 LEU 83 HD22 LEU 83 118.984 17.981 -9.079 630 HD23 LEU 83 HD23 LEU 83 118.462 17.034 -7.686 631 HA PRO 84 HA PRO 84 116.162 18.712 -15.042 632 HB2 PRO 84 HB2 PRO 84 118.819 20.047 -14.757 633 HB3 PRO 84 HB3 PRO 84 117.276 20.711 -15.330 634 HG2 PRO 84 HG2 PRO 84 118.202 21.272 -12.906 635 HG3 PRO 84 HG3 PRO 84 116.470 21.040 -13.208 636 HD2 PRO 84 HD2 PRO 84 118.395 19.221 -11.843 637 HD3 PRO 84 HD3 PRO 84 116.651 19.428 -11.575 638 H SER 85 H SER 85 119.001 17.019 -13.980 639 HA SER 85 HA SER 85 120.144 16.639 -16.604 640 HB2 SER 85 HB2 SER 85 120.752 15.379 -13.928 641 HB3 SER 85 HB3 SER 85 121.665 15.070 -15.401 642 HG SER 85 HG SER 85 121.777 17.471 -15.407 643 H ASP 86 H ASP 86 117.379 15.373 -15.413 644 HA ASP 86 HA ASP 86 116.104 13.537 -15.818 645 HB2 ASP 86 HB2 ASP 86 118.160 12.956 -17.966 646 HB3 ASP 86 HB3 ASP 86 116.601 12.163 -17.795 647 H ASN 87 H ASN 87 118.046 13.447 -13.770 648 HA ASN 87 HA ASN 87 118.628 10.541 -13.689 649 HB2 ASN 87 HB2 ASN 87 119.893 12.804 -12.117 650 HB3 ASN 87 HB3 ASN 87 120.284 11.094 -11.947 651 HD21 ASN 87 HD21 ASN 87 121.901 13.521 -13.004 652 HD22 ASN 87 HD22 ASN 87 122.497 12.976 -14.497 653 H ALA 88 H ALA 88 117.421 9.385 -12.303 654 HA ALA 88 HA ALA 88 115.647 10.823 -10.458 655 HB1 ALA 88 HB1 ALA 88 115.673 8.077 -11.663 656 HB2 ALA 88 HB2 ALA 88 114.373 9.267 -11.626 657 HB3 ALA 88 HB3 ALA 88 114.780 8.360 -10.168 658 H VAL 89 H VAL 89 116.188 11.024 -8.377 659 HA VAL 89 HA VAL 89 117.889 8.935 -7.148 660 HB VAL 89 HB VAL 89 119.096 10.708 -5.916 661 HG11 VAL 89 HG11 VAL 89 119.124 10.640 -8.927 662 HG12 VAL 89 HG12 VAL 89 120.285 9.950 -7.793 663 HG13 VAL 89 HG13 VAL 89 120.230 11.695 -8.046 664 HG21 VAL 89 HG21 VAL 89 117.236 12.406 -6.147 665 HG22 VAL 89 HG22 VAL 89 117.728 12.623 -7.828 666 HG23 VAL 89 HG23 VAL 89 118.842 13.032 -6.523 667 H PHE 90 H PHE 90 117.750 8.787 -4.889 668 HA PHE 90 HA PHE 90 115.211 9.744 -3.716 669 HB2 PHE 90 HB2 PHE 90 115.287 7.330 -4.006 670 HB3 PHE 90 HB3 PHE 90 116.842 7.251 -3.211 671 HD1 PHE 90 HD1 PHE 90 113.261 8.144 -2.646 672 HD2 PHE 90 HD2 PHE 90 116.977 6.902 -0.893 673 HE1 PHE 90 HE1 PHE 90 112.109 7.765 -0.474 674 HE2 PHE 90 HE2 PHE 90 115.828 6.512 1.270 675 HZ PHE 90 HZ PHE 90 113.393 6.947 1.478 676 H VAL 91 H VAL 91 115.397 11.067 -1.996 677 HA VAL 91 HA VAL 91 118.038 11.332 -0.687 678 HB VAL 91 HB VAL 91 115.722 13.280 -0.825 679 HG11 VAL 91 HG11 VAL 91 117.672 13.205 1.135 680 HG12 VAL 91 HG12 VAL 91 116.783 14.635 0.630 681 HG13 VAL 91 HG13 VAL 91 118.379 14.309 -0.039 682 HG21 VAL 91 HG21 VAL 91 116.928 12.893 -2.981 683 HG22 VAL 91 HG22 VAL 91 118.424 13.393 -2.192 684 HG23 VAL 91 HG23 VAL 91 117.099 14.542 -2.377 685 H ALA 92 H ALA 92 118.209 10.753 1.406 686 HA ALA 92 HA ALA 92 115.722 10.044 2.843 687 HB1 ALA 92 HB1 ALA 92 117.385 8.961 4.457 688 HB2 ALA 92 HB2 ALA 92 118.622 9.295 3.245 689 HB3 ALA 92 HB3 ALA 92 117.266 8.236 2.854 690 HA PRO 93 HA PRO 93 115.770 13.485 5.612 691 HB2 PRO 93 HB2 PRO 93 115.952 11.583 7.905 692 HB3 PRO 93 HB3 PRO 93 114.798 12.898 7.617 693 HG2 PRO 93 HG2 PRO 93 114.155 10.322 7.279 694 HG3 PRO 93 HG3 PRO 93 113.461 11.621 6.296 695 HD2 PRO 93 HD2 PRO 93 115.434 9.555 5.519 696 HD3 PRO 93 HD3 PRO 93 114.313 10.491 4.513 697 H ASP 94 H ASP 94 118.176 10.978 6.002 698 HA ASP 94 HA ASP 94 119.831 12.279 7.893 699 HB2 ASP 94 HB2 ASP 94 121.586 10.707 7.061 700 HB3 ASP 94 HB3 ASP 94 120.082 9.930 7.533 701 H GLY 95 H GLY 95 119.256 13.086 4.622 702 HA2 GLY 95 HA2 GLY 95 120.132 14.975 3.517 703 HA3 GLY 95 HA3 GLY 95 121.475 14.992 4.655 704 H THR 96 H THR 96 120.921 11.878 3.420 705 HA THR 96 HA THR 96 123.262 12.088 1.658 706 HB THR 96 HB THR 96 121.843 9.656 2.779 707 HG1 THR 96 HG1 THR 96 123.305 9.752 4.323 708 HG21 THR 96 HG21 THR 96 124.212 10.063 0.999 709 HG22 THR 96 HG22 THR 96 122.991 8.790 0.976 710 HG23 THR 96 HG23 THR 96 124.276 8.756 2.183 711 H THR 97 H THR 97 123.105 11.636 -0.505 712 HA THR 97 HA THR 97 120.384 11.128 -1.550 713 HB THR 97 HB THR 97 122.826 12.169 -3.018 714 HG1 THR 97 HG1 THR 97 122.243 13.791 -1.783 715 HG21 THR 97 HG21 THR 97 121.187 11.075 -4.469 716 HG22 THR 97 HG22 THR 97 121.126 12.821 -4.710 717 HG23 THR 97 HG23 THR 97 119.886 12.020 -3.745 718 H TYR 98 H TYR 98 119.945 9.301 -2.529 719 HA TYR 98 HA TYR 98 122.130 7.432 -3.216 720 HB2 TYR 98 HB2 TYR 98 119.282 6.826 -2.412 721 HB3 TYR 98 HB3 TYR 98 120.516 5.638 -2.780 722 HD1 TYR 98 HD2 TYR 98 122.425 5.298 -1.198 723 HD2 TYR 98 HD1 TYR 98 119.140 7.910 -0.278 724 HE1 TYR 98 HE2 TYR 98 123.074 5.276 1.195 725 HE2 TYR 98 HE1 TYR 98 119.799 7.899 2.110 726 HH TYR 98 HH TYR 98 121.425 7.255 3.562 727 H ALA 99 H ALA 99 121.919 6.313 -5.204 728 HA ALA 99 HA ALA 99 120.341 7.744 -7.191 729 HB1 ALA 99 HB1 ALA 99 121.599 5.923 -8.671 730 HB2 ALA 99 HB2 ALA 99 122.618 5.808 -7.237 731 HB3 ALA 99 HB3 ALA 99 122.443 7.351 -8.071 732 H LEU 100 H LEU 100 118.445 7.065 -7.981 733 HA LEU 100 HA LEU 100 117.374 4.506 -7.090 734 HB2 LEU 100 HB2 LEU 100 116.194 6.857 -8.571 735 HB3 LEU 100 HB3 LEU 100 115.324 5.340 -8.377 736 HG LEU 100 HG LEU 100 116.487 6.815 -6.012 737 HD11 LEU 100 HD11 LEU 100 114.112 7.656 -5.711 738 HD12 LEU 100 HD12 LEU 100 113.787 7.104 -7.353 739 HD13 LEU 100 HD13 LEU 100 114.971 8.377 -7.072 740 HD21 LEU 100 HD21 LEU 100 115.876 4.481 -5.626 741 HD22 LEU 100 HD22 LEU 100 114.311 4.733 -6.397 742 HD23 LEU 100 HD23 LEU 100 114.672 5.513 -4.859 743 H ASN 101 H ASN 101 117.969 6.203 -10.164 744 HA ASN 101 HA ASN 101 117.475 3.650 -11.579 745 HB2 ASN 101 HB2 ASN 101 116.993 4.919 -13.535 746 HB3 ASN 101 HB3 ASN 101 116.108 5.635 -12.197 747 HD21 ASN 101 HD21 ASN 101 116.332 7.376 -14.187 748 HD22 ASN 101 HD22 ASN 101 117.580 8.501 -13.947 749 H ASP 102 H ASP 102 118.727 3.373 -13.644 750 HA ASP 102 HA ASP 102 121.317 2.706 -12.899 751 HB2 ASP 102 HB2 ASP 102 120.022 1.699 -14.777 752 HB3 ASP 102 HB3 ASP 102 120.342 3.150 -15.724 753 H ARG 103 H ARG 103 120.196 5.598 -14.649 754 HA ARG 103 HA ARG 103 122.772 6.415 -15.495 755 HB2 ARG 103 HB2 ARG 103 120.204 7.960 -15.128 756 HB3 ARG 103 HB3 ARG 103 121.665 8.643 -15.850 757 HG2 ARG 103 HG2 ARG 103 121.667 6.782 -17.514 758 HG3 ARG 103 HG3 ARG 103 120.137 6.219 -16.843 759 HD2 ARG 103 HD2 ARG 103 120.634 8.933 -18.096 760 HD3 ARG 103 HD3 ARG 103 119.743 7.604 -18.830 761 HE ARG 103 HE ARG 103 118.761 9.437 -16.852 762 HH11 ARG 103 HH11 ARG 103 118.413 6.141 -18.011 763 HH12 ARG 103 HH12 ARG 103 116.795 6.001 -17.407 764 HH21 ARG 103 HH21 ARG 103 116.710 9.206 -16.108 765 HH22 ARG 103 HH22 ARG 103 115.834 7.726 -16.335 766 H ALA 104 H ALA 104 120.838 7.329 -12.640 767 HA ALA 104 HA ALA 104 122.650 9.163 -11.543 768 HB1 ALA 104 HB1 ALA 104 120.808 7.254 -10.085 769 HB2 ALA 104 HB2 ALA 104 120.361 8.844 -10.699 770 HB3 ALA 104 HB3 ALA 104 121.546 8.702 -9.401 771 H GLU 105 H GLU 105 122.524 5.622 -11.283 772 HA GLU 105 HA GLU 105 124.674 5.322 -9.479 773 HB2 GLU 105 HB2 GLU 105 123.723 3.476 -11.684 774 HB3 GLU 105 HB3 GLU 105 124.856 3.025 -10.409 775 HG2 GLU 105 HG2 GLU 105 123.140 3.629 -8.711 776 HG3 GLU 105 HG3 GLU 105 122.007 3.980 -10.010 777 H LYS 106 H LYS 106 124.598 5.521 -13.026 778 HA LYS 106 HA LYS 106 127.328 5.148 -13.525 779 HB2 LYS 106 HB2 LYS 106 125.544 5.252 -15.267 780 HB3 LYS 106 HB3 LYS 106 125.461 6.997 -15.024 781 HG2 LYS 106 HG2 LYS 106 127.878 7.165 -15.589 782 HG3 LYS 106 HG3 LYS 106 127.902 5.432 -15.912 783 HD2 LYS 106 HD2 LYS 106 126.103 5.784 -17.623 784 HD3 LYS 106 HD3 LYS 106 126.266 7.523 -17.374 785 HE2 LYS 106 HE2 LYS 106 128.571 5.724 -18.164 786 HE3 LYS 106 HE3 LYS 106 127.600 6.632 -19.322 787 HZ1 LYS 106 HZ1 LYS 106 129.798 7.575 -18.103 788 HZ2 LYS 106 HZ2 LYS 106 128.576 8.185 -17.094 789 HZ3 LYS 106 HZ3 LYS 106 128.571 8.549 -18.754 790 H ALA 107 H ALA 107 125.571 8.004 -12.472 791 HA ALA 107 HA ALA 107 127.726 9.852 -12.755 792 HB1 ALA 107 HB1 ALA 107 126.335 11.348 -11.407 793 HB2 ALA 107 HB2 ALA 107 125.268 10.003 -11.002 794 HB3 ALA 107 HB3 ALA 107 125.382 10.568 -12.669 795 H GLY 108 H GLY 108 127.641 7.258 -10.741 796 HA2 GLY 108 HA2 GLY 108 129.006 6.667 -9.021 797 HA3 GLY 108 HA3 GLY 108 129.727 8.262 -9.089 798 H HIS 109 H HIS 109 126.254 8.035 -8.611 799 HA HIS 109 HA HIS 109 126.537 8.896 -5.853 800 HB2 HIS 109 HB2 HIS 109 124.203 8.428 -7.688 801 HB3 HIS 109 HB3 HIS 109 123.962 8.683 -5.970 802 HD1 HIS 109 HD1 HIS 109 125.697 10.978 -5.270 803 HD2 HIS 109 HD2 HIS 109 123.718 10.813 -8.936 804 HE1 HIS 109 HE1 HIS 109 125.547 13.361 -6.110 805 HA PRO 110 HA PRO 110 126.421 4.714 -4.387 806 HB2 PRO 110 HB2 PRO 110 125.557 5.014 -1.813 807 HB3 PRO 110 HB3 PRO 110 127.189 5.467 -2.344 808 HG2 PRO 110 HG2 PRO 110 124.818 7.185 -1.852 809 HG3 PRO 110 HG3 PRO 110 126.529 7.492 -1.511 810 HD2 PRO 110 HD2 PRO 110 125.203 8.546 -3.677 811 HD3 PRO 110 HD3 PRO 110 126.957 8.263 -3.635 812 HA PRO 111 HA PRO 111 122.110 3.573 -4.856 813 HB2 PRO 111 HB2 PRO 111 122.184 0.915 -4.266 814 HB3 PRO 111 HB3 PRO 111 122.813 1.589 -5.782 815 HG2 PRO 111 HG2 PRO 111 124.267 0.639 -3.395 816 HG3 PRO 111 HG3 PRO 111 124.739 0.607 -5.099 817 HD2 PRO 111 HD2 PRO 111 125.652 2.451 -3.209 818 HD3 PRO 111 HD3 PRO 111 125.758 2.640 -4.971 819 H ILE 112 H ILE 112 120.212 2.889 -3.662 820 HA ILE 112 HA ILE 112 120.165 3.782 -0.996 821 HB ILE 112 HB ILE 112 118.140 2.103 -2.499 822 HG12 ILE 112 HG12 ILE 112 118.238 5.077 -1.943 823 HG13 ILE 112 HG13 ILE 112 118.781 4.352 -3.454 824 HG21 ILE 112 HG21 ILE 112 116.530 3.072 -0.813 825 HG22 ILE 112 HG22 ILE 112 117.918 3.680 0.085 826 HG23 ILE 112 HG23 ILE 112 117.686 1.945 -0.110 827 HD11 ILE 112 HD11 ILE 112 116.431 5.222 -3.555 828 HD12 ILE 112 HD12 ILE 112 115.981 4.048 -2.321 829 HD13 ILE 112 HD13 ILE 112 116.547 3.496 -3.899 830 H THR 113 H THR 113 121.363 0.800 -2.112 831 HA THR 113 HA THR 113 120.258 -1.100 -0.530 832 HB THR 113 HB THR 113 122.014 -1.396 -2.313 833 HG1 THR 113 HG1 THR 113 122.605 -3.330 -1.287 834 HG21 THR 113 HG21 THR 113 123.899 -0.166 -1.502 835 HG22 THR 113 HG22 THR 113 124.315 -1.870 -1.365 836 HG23 THR 113 HG23 THR 113 123.840 -0.965 0.068 837 HA PRO 114 HA PRO 114 123.335 -0.334 3.121 838 HB2 PRO 114 HB2 PRO 114 123.146 2.610 3.435 839 HB3 PRO 114 HB3 PRO 114 124.553 1.542 3.609 840 HG2 PRO 114 HG2 PRO 114 124.307 3.151 1.517 841 HG3 PRO 114 HG3 PRO 114 124.989 1.521 1.351 842 HD2 PRO 114 HD2 PRO 114 122.230 2.482 0.660 843 HD3 PRO 114 HD3 PRO 114 123.289 1.385 -0.248 844 H ILE 115 H ILE 115 120.557 1.746 2.484 845 HA ILE 115 HA ILE 115 119.540 1.258 5.200 846 HB ILE 115 HB ILE 115 117.749 2.890 4.560 847 HG12 ILE 115 HG12 ILE 115 119.550 3.468 2.192 848 HG13 ILE 115 HG13 ILE 115 118.058 2.540 2.069 849 HG21 ILE 115 HG21 ILE 115 119.056 4.683 5.189 850 HG22 ILE 115 HG22 ILE 115 120.402 4.214 4.148 851 HG23 ILE 115 HG23 ILE 115 120.108 3.349 5.658 852 HD11 ILE 115 HD11 ILE 115 118.129 5.205 1.696 853 HD12 ILE 115 HD12 ILE 115 117.868 5.185 3.438 854 HD13 ILE 115 HD13 ILE 115 116.723 4.383 2.367 855 H ARG 116 H ARG 116 119.370 -0.384 2.348 856 HA ARG 116 HA ARG 116 116.531 -0.864 2.215 857 HB2 ARG 116 HB2 ARG 116 118.054 -0.955 0.246 858 HB3 ARG 116 HB3 ARG 116 118.813 -2.387 0.939 859 HG2 ARG 116 HG2 ARG 116 116.718 -3.612 0.838 860 HG3 ARG 116 HG3 ARG 116 115.858 -2.167 0.300 861 HD2 ARG 116 HD2 ARG 116 116.325 -3.511 -1.654 862 HD3 ARG 116 HD3 ARG 116 117.369 -2.097 -1.705 863 HE ARG 116 HE ARG 116 118.865 -4.004 -0.422 864 HH11 ARG 116 HH11 ARG 116 117.237 -3.884 -3.530 865 HH12 ARG 116 HH12 ARG 116 118.378 -4.948 -4.280 866 HH21 ARG 116 HH21 ARG 116 120.302 -5.368 -1.443 867 HH22 ARG 116 HH22 ARG 116 120.092 -5.777 -3.113 868 H ALA 117 H ALA 117 115.392 -2.539 3.120 869 HA ALA 117 HA ALA 117 116.630 -3.986 5.271 870 HB1 ALA 117 HB1 ALA 117 114.291 -3.120 5.337 871 HB2 ALA 117 HB2 ALA 117 114.404 -4.843 5.693 872 HB3 ALA 117 HB3 ALA 117 113.858 -4.306 4.105 873 H LYS 118 H LYS 118 117.311 -6.045 5.338 874 HA LYS 118 HA LYS 118 117.158 -7.657 2.891 875 HB2 LYS 118 HB2 LYS 118 119.343 -7.381 4.076 876 HB3 LYS 118 HB3 LYS 118 118.652 -8.220 5.466 877 HG2 LYS 118 HG2 LYS 118 118.243 -10.209 4.108 878 HG3 LYS 118 HG3 LYS 118 118.833 -9.377 2.669 879 HD2 LYS 118 HD2 LYS 118 120.635 -10.748 3.512 880 HD3 LYS 118 HD3 LYS 118 121.038 -9.064 3.847 881 HE2 LYS 118 HE2 LYS 118 120.358 -9.275 6.146 882 HE3 LYS 118 HE3 LYS 118 119.671 -10.872 5.854 883 HZ1 LYS 118 HZ1 LYS 118 121.682 -11.478 6.663 884 HZ2 LYS 118 HZ2 LYS 118 122.464 -10.067 6.128 885 HZ3 LYS 118 HZ3 LYS 118 122.120 -11.319 5.031 886 H GLY 119 H GLY 119 116.093 -9.622 2.787 887 HA2 GLY 119 HA2 GLY 119 114.167 -10.095 4.967 888 HA3 GLY 119 HA3 GLY 119 113.980 -10.631 3.311 889 H SER 120 H SER 120 113.605 -12.410 5.386 890 HA SER 120 HA SER 120 115.824 -13.933 6.162 891 HB2 SER 120 HB2 SER 120 113.032 -14.941 5.565 892 HB3 SER 120 HB3 SER 120 114.241 -15.738 6.567 893 HG SER 120 HG SER 120 113.613 -14.467 8.093 894 H GLY 121 H GLY 121 113.858 -14.062 3.217 895 HA2 GLY 121 HA2 GLY 121 116.013 -15.596 1.929 896 HA3 GLY 121 HA3 GLY 121 114.360 -16.195 1.816 897 H GLY 122 H GLY 122 115.745 -15.591 -0.481 898 HA2 GLY 122 HA2 GLY 122 115.291 -14.547 -2.496 899 HA3 GLY 122 HA3 GLY 122 114.008 -13.651 -1.695 900 H GLY 123 H GLY 123 117.330 -13.620 -0.535 901 HA2 GLY 123 HA2 GLY 123 118.924 -11.966 -0.455 902 HA3 GLY 123 HA3 GLY 123 118.250 -11.366 -1.966 903 H TYR 124 H TYR 124 117.676 -9.307 -1.830 904 HA TYR 124 HA TYR 124 116.761 -8.242 0.775 905 HB2 TYR 124 HB2 TYR 124 118.198 -6.982 -1.544 906 HB3 TYR 124 HB3 TYR 124 117.374 -6.017 -0.333 907 HD1 TYR 124 HD1 TYR 124 119.508 -9.104 -0.118 908 HD2 TYR 124 HD2 TYR 124 118.938 -5.012 1.059 909 HE1 TYR 124 HE1 TYR 124 121.508 -9.243 1.339 910 HE2 TYR 124 HE2 TYR 124 120.938 -5.152 2.516 911 HH TYR 124 HH TYR 124 123.149 -7.600 2.338 912 H ILE 125 H ILE 125 115.148 -6.550 0.718 913 HA ILE 125 HA ILE 125 112.902 -7.358 -0.868 914 HB ILE 125 HB ILE 125 113.307 -5.089 1.098 915 HG12 ILE 125 HG12 ILE 125 111.664 -7.562 1.568 916 HG13 ILE 125 HG13 ILE 125 113.413 -7.659 1.730 917 HG21 ILE 125 HG21 ILE 125 111.423 -4.684 -0.515 918 HG22 ILE 125 HG22 ILE 125 110.895 -4.865 1.158 919 HG23 ILE 125 HG23 ILE 125 110.699 -6.201 0.022 920 HD11 ILE 125 HD11 ILE 125 113.462 -6.299 3.579 921 HD12 ILE 125 HD12 ILE 125 111.854 -6.986 3.786 922 HD13 ILE 125 HD13 ILE 125 112.040 -5.378 3.087 923 H SER 126 H SER 126 112.172 -6.523 -2.716 924 HA SER 126 HA SER 126 113.871 -4.961 -4.333 925 HB2 SER 126 HB2 SER 126 110.932 -5.567 -4.689 926 HB3 SER 126 HB3 SER 126 112.021 -4.973 -5.939 927 HG SER 126 HG SER 126 111.691 -7.320 -5.718 928 H LEU 127 H LEU 127 114.013 -2.878 -4.784 929 HA LEU 127 HA LEU 127 112.178 -0.980 -3.502 930 HB2 LEU 127 HB2 LEU 127 114.678 -0.447 -5.122 931 HB3 LEU 127 HB3 LEU 127 113.771 0.731 -4.178 932 HG LEU 127 HG LEU 127 115.144 -1.724 -3.040 933 HD11 LEU 127 HD11 LEU 127 116.712 0.029 -3.866 934 HD12 LEU 127 HD12 LEU 127 116.757 -0.130 -2.111 935 HD13 LEU 127 HD13 LEU 127 115.888 1.212 -2.852 936 HD21 LEU 127 HD21 LEU 127 114.707 -0.366 -0.880 937 HD22 LEU 127 HD22 LEU 127 113.330 -1.197 -1.605 938 HD23 LEU 127 HD23 LEU 127 113.538 0.539 -1.843 939 H GLY 128 H GLY 128 111.778 -2.717 -6.153 940 HA2 GLY 128 HA2 GLY 128 111.766 -1.165 -8.412 941 HA3 GLY 128 HA3 GLY 128 110.587 -2.432 -8.106 942 H ALA 129 H ALA 129 109.214 -1.241 -5.919 943 HA ALA 129 HA ALA 129 107.306 0.267 -7.334 944 HB1 ALA 129 HB1 ALA 129 106.449 -0.775 -5.438 945 HB2 ALA 129 HB2 ALA 129 106.577 0.901 -4.902 946 HB3 ALA 129 HB3 ALA 129 107.804 -0.273 -4.425 947 H LEU 130 H LEU 130 109.797 1.315 -5.012 948 HA LEU 130 HA LEU 130 109.145 4.049 -5.019 949 HB2 LEU 130 HB2 LEU 130 110.665 2.946 -3.384 950 HB3 LEU 130 HB3 LEU 130 111.881 2.804 -4.653 951 HG LEU 130 HG LEU 130 111.743 5.310 -4.944 952 HD11 LEU 130 HD11 LEU 130 110.004 4.969 -2.493 953 HD12 LEU 130 HD12 LEU 130 109.617 5.823 -3.987 954 HD13 LEU 130 HD13 LEU 130 110.808 6.493 -2.872 955 HD21 LEU 130 HD21 LEU 130 112.469 4.677 -2.096 956 HD22 LEU 130 HD22 LEU 130 113.324 5.685 -3.262 957 HD23 LEU 130 HD23 LEU 130 113.374 3.929 -3.412 958 H LEU 131 H LEU 131 111.325 2.165 -7.083 959 HA LEU 131 HA LEU 131 112.465 4.313 -8.495 960 HB2 LEU 131 HB2 LEU 131 113.307 1.976 -8.574 961 HB3 LEU 131 HB3 LEU 131 111.887 1.516 -9.511 962 HG LEU 131 HG LEU 131 112.563 3.271 -11.212 963 HD11 LEU 131 HD11 LEU 131 114.913 3.383 -9.331 964 HD12 LEU 131 HD12 LEU 131 114.015 4.715 -10.058 965 HD13 LEU 131 HD13 LEU 131 115.117 3.754 -11.043 966 HD21 LEU 131 HD21 LEU 131 114.607 1.860 -11.982 967 HD22 LEU 131 HD22 LEU 131 113.048 1.048 -11.835 968 HD23 LEU 131 HD23 LEU 131 114.261 0.864 -10.568 969 H SER 132 H SER 132 109.526 2.421 -9.119 970 HA SER 132 HA SER 132 108.940 3.477 -11.651 971 HB2 SER 132 HB2 SER 132 106.962 2.562 -9.548 972 HB3 SER 132 HB3 SER 132 106.670 2.683 -11.279 973 HG SER 132 HG SER 132 107.288 0.589 -10.567 974 H THR 133 H THR 133 108.014 4.593 -8.409 975 HA THR 133 HA THR 133 106.264 6.641 -9.242 976 HB THR 133 HB THR 133 108.003 6.618 -6.763 977 HG1 THR 133 HG1 THR 133 106.809 4.810 -6.748 978 HG21 THR 133 HG21 THR 133 105.317 7.912 -7.299 979 HG22 THR 133 HG22 THR 133 106.857 8.769 -7.322 980 HG23 THR 133 HG23 THR 133 106.273 8.044 -5.824 981 H THR 134 H THR 134 109.746 6.725 -8.502 982 HA THR 134 HA THR 134 110.048 9.507 -8.893 983 HB THR 134 HB THR 134 112.169 7.393 -9.305 984 HG1 THR 134 HG1 THR 134 111.135 7.259 -7.296 985 HG21 THR 134 HG21 THR 134 112.281 10.322 -8.512 986 HG22 THR 134 HG22 THR 134 112.785 9.651 -10.063 987 HG23 THR 134 HG23 THR 134 113.669 9.235 -8.595 988 H LEU 135 H LEU 135 110.337 6.776 -11.146 989 HA LEU 135 HA LEU 135 111.346 8.216 -13.339 990 HB2 LEU 135 HB2 LEU 135 109.596 5.750 -13.248 991 HB3 LEU 135 HB3 LEU 135 110.354 6.370 -14.714 992 HG LEU 135 HG LEU 135 111.907 5.662 -12.213 993 HD11 LEU 135 HD11 LEU 135 111.497 4.036 -14.743 994 HD12 LEU 135 HD12 LEU 135 110.786 3.663 -13.173 995 HD13 LEU 135 HD13 LEU 135 112.535 3.595 -13.386 996 HD21 LEU 135 HD21 LEU 135 113.757 5.563 -14.004 997 HD22 LEU 135 HD22 LEU 135 113.164 7.163 -13.559 998 HD23 LEU 135 HD23 LEU 135 112.617 6.406 -15.054 999 H ASN 136 H ASN 136 108.014 7.655 -12.253 1000 HA ASN 136 HA ASN 136 106.680 8.775 -14.451 1001 HB2 ASN 136 HB2 ASN 136 105.915 8.781 -11.521 1002 HB3 ASN 136 HB3 ASN 136 104.827 9.202 -12.843 1003 HD21 ASN 136 HD21 ASN 136 104.395 6.951 -11.050 1004 HD22 ASN 136 HD22 ASN 136 104.481 5.538 -11.986 1005 H LEU 137 H LEU 137 107.936 10.287 -11.499 1006 HA LEU 137 HA LEU 137 107.129 12.929 -12.070 1007 HB2 LEU 137 HB2 LEU 137 109.575 12.016 -10.536 1008 HB3 LEU 137 HB3 LEU 137 108.828 13.610 -10.448 1009 HG LEU 137 HG LEU 137 107.447 11.010 -9.717 1010 HD11 LEU 137 HD11 LEU 137 108.976 11.338 -7.977 1011 HD12 LEU 137 HD12 LEU 137 107.570 12.229 -7.394 1012 HD13 LEU 137 HD13 LEU 137 108.921 13.094 -8.127 1013 HD21 LEU 137 HD21 LEU 137 105.793 12.640 -8.689 1014 HD22 LEU 137 HD22 LEU 137 105.827 12.641 -10.450 1015 HD23 LEU 137 HD23 LEU 137 106.633 13.928 -9.552 1016 H CYS 138 H CYS 138 110.064 11.148 -12.936 1017 HA CYS 138 HA CYS 138 111.516 13.239 -14.093 1018 HB2 CYS 138 HB2 CYS 138 111.467 10.270 -14.455 1019 HB3 CYS 138 HB3 CYS 138 112.429 11.250 -15.552 1020 H GLY 139 H GLY 139 108.742 11.503 -15.350 1021 HA2 GLY 139 HA2 GLY 139 107.421 12.075 -17.174 1022 HA3 GLY 139 HA3 GLY 139 108.582 13.327 -17.587 1023 H LYS 140 H LYS 140 109.745 10.065 -17.122 1024 HA LYS 140 HA LYS 140 110.803 9.974 -19.777 1025 HB2 LYS 140 HB2 LYS 140 111.874 8.893 -17.795 1026 HB3 LYS 140 HB3 LYS 140 110.558 7.718 -17.773 1027 HG2 LYS 140 HG2 LYS 140 111.131 7.074 -20.108 1028 HG3 LYS 140 HG3 LYS 140 112.498 8.187 -20.055 1029 HD2 LYS 140 HD2 LYS 140 113.370 6.934 -18.066 1030 HD3 LYS 140 HD3 LYS 140 112.073 5.760 -18.292 1031 HE2 LYS 140 HE2 LYS 140 112.921 5.453 -20.669 1032 HE3 LYS 140 HE3 LYS 140 114.333 6.398 -20.199 1033 HZ1 LYS 140 HZ1 LYS 140 113.644 3.683 -19.548 1034 HZ2 LYS 140 HZ2 LYS 140 114.123 4.598 -18.200 1035 HZ3 LYS 140 HZ3 LYS 140 115.157 4.450 -19.539 1036 H GLY 141 H GLY 141 110.012 9.039 -21.576 1037 HA2 GLY 141 HA2 GLY 141 108.582 6.946 -22.201 1038 HA3 GLY 141 HA3 GLY 141 107.309 7.889 -21.430 Start of MODEL 2 1 H1 HIS -5 HT1 HIS -5 84.965 -22.998 29.003 2 H2 HIS -5 HT2 HIS -5 86.503 -22.827 29.706 3 H3 HIS -5 HT3 HIS -5 86.114 -24.235 28.838 4 HA HIS -5 HA HIS -5 86.150 -21.545 27.601 5 HB2 HIS -5 HB2 HIS -5 88.376 -22.159 28.533 6 HB3 HIS -5 HB3 HIS -5 88.323 -23.650 27.612 7 HD1 HIS -5 HD1 HIS -5 88.058 -19.906 26.892 8 HD2 HIS -5 HD2 HIS -5 89.604 -23.385 25.192 9 HE1 HIS -5 HE1 HIS -5 89.245 -19.199 24.771 10 H HIS -4 H HIS -4 86.234 -21.735 25.260 11 HA HIS -4 HA HIS -4 85.169 -24.306 24.238 12 HB2 HIS -4 HB2 HIS -4 83.405 -22.587 24.419 13 HB3 HIS -4 HB3 HIS -4 84.357 -21.518 23.407 14 HD1 HIS -4 HD1 HIS -4 82.909 -25.047 23.165 15 HD2 HIS -4 HD2 HIS -4 83.621 -21.714 20.763 16 HE1 HIS -4 HE1 HIS -4 81.979 -25.602 20.877 17 H HIS -3 H HIS -3 86.092 -25.078 22.427 18 HA HIS -3 HA HIS -3 88.031 -23.347 20.998 19 HB2 HIS -3 HB2 HIS -3 89.138 -25.063 22.396 20 HB3 HIS -3 HB3 HIS -3 88.248 -26.311 21.544 21 HD1 HIS -3 HD1 HIS -3 90.615 -23.449 20.642 22 HD2 HIS -3 HD2 HIS -3 89.706 -27.339 19.450 23 HE1 HIS -3 HE1 HIS -3 92.254 -24.036 18.805 24 H HIS -2 H HIS -2 87.854 -23.277 18.833 25 HA HIS -2 HA HIS -2 85.987 -25.168 17.517 26 HB2 HIS -2 HB2 HIS -2 84.985 -22.939 17.753 27 HB3 HIS -2 HB3 HIS -2 86.370 -22.226 16.949 28 HD1 HIS -2 HD1 HIS -2 86.476 -22.397 14.390 29 HD2 HIS -2 HD2 HIS -2 83.200 -24.386 16.033 30 HE1 HIS -2 HE1 HIS -2 84.959 -22.998 12.454 31 H HIS -1 H HIS -1 86.693 -26.121 15.698 32 HA HIS -1 HA HIS -1 89.244 -25.178 14.517 33 HB2 HIS -1 HB2 HIS -1 89.560 -27.248 15.802 34 HB3 HIS -1 HB3 HIS -1 88.290 -28.022 14.873 35 HD1 HIS -1 HD1 HIS -1 88.884 -28.867 12.524 36 HD2 HIS -1 HD2 HIS -1 92.026 -26.856 14.386 37 HE1 HIS -1 HE1 HIS -1 90.942 -29.293 11.113 38 H HIS 0 H HIS 0 89.279 -24.937 12.354 39 HA HIS 0 HA HIS 0 86.915 -25.855 10.814 40 HB2 HIS 0 HB2 HIS 0 86.949 -23.409 11.158 41 HB3 HIS 0 HB3 HIS 0 88.537 -23.338 10.418 42 HD1 HIS 0 HD1 HIS 0 85.057 -24.600 9.468 43 HD2 HIS 0 HD2 HIS 0 88.376 -22.771 7.731 44 HE1 HIS 0 HE1 HIS 0 84.441 -24.144 7.056 45 H SER 1 H SER 1 87.335 -27.100 9.107 46 HA SER 1 HA SER 1 89.954 -28.004 8.514 47 HB2 SER 1 HB2 SER 1 87.436 -28.226 6.846 48 HB3 SER 1 HB3 SER 1 88.905 -29.169 6.627 49 HG SER 1 HG SER 1 86.990 -29.828 8.111 50 H SER 2 H SER 2 91.135 -27.759 6.524 51 HA SER 2 HA SER 2 91.470 -25.077 5.721 52 HB2 SER 2 HB2 SER 2 92.354 -27.598 4.294 53 HB3 SER 2 HB3 SER 2 92.976 -25.976 4.009 54 HG SER 2 HG SER 2 94.078 -27.431 5.573 55 H GLY 3 H GLY 3 91.062 -24.081 3.689 56 HA2 GLY 3 HA2 GLY 3 88.501 -24.860 2.546 57 HA3 GLY 3 HA3 GLY 3 89.391 -23.377 2.210 58 H LEU 4 H LEU 4 88.481 -24.262 0.007 59 HA LEU 4 HA LEU 4 90.307 -26.205 -1.211 60 HB2 LEU 4 HB2 LEU 4 87.898 -24.803 -2.394 61 HB3 LEU 4 HB3 LEU 4 88.796 -26.130 -3.128 62 HG LEU 4 HG LEU 4 87.335 -26.291 -0.474 63 HD11 LEU 4 HD11 LEU 4 86.605 -27.567 -3.123 64 HD12 LEU 4 HD12 LEU 4 85.883 -26.067 -2.540 65 HD13 LEU 4 HD13 LEU 4 85.654 -27.565 -1.638 66 HD21 LEU 4 HD21 LEU 4 89.127 -27.867 -0.456 67 HD22 LEU 4 HD22 LEU 4 88.880 -28.279 -2.153 68 HD23 LEU 4 HD23 LEU 4 87.706 -28.792 -0.942 69 H VAL 5 H VAL 5 91.708 -25.712 -2.874 70 HA VAL 5 HA VAL 5 92.814 -23.111 -2.909 71 HB VAL 5 HB VAL 5 94.179 -23.951 -4.797 72 HG11 VAL 5 HG11 VAL 5 95.238 -25.794 -3.560 73 HG12 VAL 5 HG12 VAL 5 93.799 -25.958 -2.554 74 HG13 VAL 5 HG13 VAL 5 94.781 -24.496 -2.457 75 HG21 VAL 5 HG21 VAL 5 92.308 -25.286 -5.833 76 HG22 VAL 5 HG22 VAL 5 92.502 -26.466 -4.536 77 HG23 VAL 5 HG23 VAL 5 93.818 -26.183 -5.676 78 HA PRO 6 HA PRO 6 90.215 -21.352 -6.054 79 HB2 PRO 6 HB2 PRO 6 91.576 -19.109 -6.667 80 HB3 PRO 6 HB3 PRO 6 90.852 -19.348 -5.065 81 HG2 PRO 6 HG2 PRO 6 93.679 -19.498 -5.895 82 HG3 PRO 6 HG3 PRO 6 92.976 -19.025 -4.341 83 HD2 PRO 6 HD2 PRO 6 94.088 -21.554 -4.991 84 HD3 PRO 6 HD3 PRO 6 93.182 -21.135 -3.522 85 H ARG 7 H ARG 7 90.198 -20.570 -8.343 86 HA ARG 7 HA ARG 7 92.363 -21.772 -9.973 87 HB2 ARG 7 HB2 ARG 7 89.384 -21.768 -10.519 88 HB3 ARG 7 HB3 ARG 7 90.619 -22.327 -11.649 89 HG2 ARG 7 HG2 ARG 7 91.369 -24.000 -9.981 90 HG3 ARG 7 HG3 ARG 7 90.092 -23.466 -8.888 91 HD2 ARG 7 HD2 ARG 7 89.270 -25.410 -10.048 92 HD3 ARG 7 HD3 ARG 7 88.426 -24.009 -10.701 93 HE ARG 7 HE ARG 7 90.807 -24.663 -12.179 94 HH11 ARG 7 HH11 ARG 7 87.407 -25.466 -11.830 95 HH12 ARG 7 HH12 ARG 7 87.281 -26.070 -13.448 96 HH21 ARG 7 HH21 ARG 7 90.583 -25.453 -14.252 97 HH22 ARG 7 HH22 ARG 7 89.058 -26.062 -14.802 98 H GLY 8 H GLY 8 92.832 -20.725 -11.949 99 HA2 GLY 8 HA2 GLY 8 92.867 -17.929 -11.874 100 HA3 GLY 8 HA3 GLY 8 93.166 -18.901 -13.313 101 H SER 9 H SER 9 91.572 -16.351 -12.689 102 HA SER 9 HA SER 9 89.165 -17.143 -14.204 103 HB2 SER 9 HB2 SER 9 88.568 -16.859 -11.805 104 HB3 SER 9 HB3 SER 9 89.191 -15.214 -11.870 105 HG SER 9 HG SER 9 87.323 -14.748 -12.663 106 H GLY 10 H GLY 10 88.380 -15.589 -15.636 107 HA2 GLY 10 HA2 GLY 10 90.344 -13.660 -16.539 108 HA3 GLY 10 HA3 GLY 10 88.798 -14.020 -17.305 109 H MET 11 H MET 11 89.151 -11.493 -17.378 110 HA MET 11 HA MET 11 88.166 -10.227 -14.916 111 HB2 MET 11 HB2 MET 11 89.224 -9.052 -17.496 112 HB3 MET 11 HB3 MET 11 88.674 -8.103 -16.114 113 HG2 MET 11 HG2 MET 11 90.355 -9.323 -14.694 114 HG3 MET 11 HG3 MET 11 90.979 -10.069 -16.165 115 HE1 MET 11 HE1 MET 11 91.236 -8.836 -18.185 116 HE2 MET 11 HE2 MET 11 92.500 -7.610 -18.248 117 HE3 MET 11 HE3 MET 11 90.807 -7.124 -18.292 118 H LYS 12 H LYS 12 86.136 -9.527 -14.696 119 HA LYS 12 HA LYS 12 84.433 -9.277 -17.102 120 HB2 LYS 12 HB2 LYS 12 83.693 -10.583 -14.472 121 HB3 LYS 12 HB3 LYS 12 82.563 -10.239 -15.783 122 HG2 LYS 12 HG2 LYS 12 83.959 -11.638 -17.305 123 HG3 LYS 12 HG3 LYS 12 84.987 -12.054 -15.933 124 HD2 LYS 12 HD2 LYS 12 82.978 -12.962 -14.757 125 HD3 LYS 12 HD3 LYS 12 82.029 -12.654 -16.212 126 HE2 LYS 12 HE2 LYS 12 83.705 -14.084 -17.476 127 HE3 LYS 12 HE3 LYS 12 84.369 -14.549 -15.909 128 HZ1 LYS 12 HZ1 LYS 12 82.382 -15.571 -15.290 129 HZ2 LYS 12 HZ2 LYS 12 82.593 -16.036 -16.911 130 HZ3 LYS 12 HZ3 LYS 12 81.487 -14.809 -16.514 131 H GLU 13 H GLU 13 82.857 -7.670 -17.016 132 HA GLU 13 HA GLU 13 83.289 -5.651 -14.917 133 HB2 GLU 13 HB2 GLU 13 83.500 -4.997 -17.326 134 HB3 GLU 13 HB3 GLU 13 81.789 -5.373 -17.530 135 HG2 GLU 13 HG2 GLU 13 81.248 -3.743 -15.728 136 HG3 GLU 13 HG3 GLU 13 82.952 -3.324 -15.625 137 H THR 14 H THR 14 81.754 -5.136 -13.472 138 HA THR 14 HA THR 14 79.026 -6.227 -13.852 139 HB THR 14 HB THR 14 78.926 -6.725 -11.466 140 HG1 THR 14 HG1 THR 14 80.299 -5.693 -10.316 141 HG21 THR 14 HG21 THR 14 80.568 -8.574 -11.398 142 HG22 THR 14 HG22 THR 14 81.399 -7.877 -12.788 143 HG23 THR 14 HG23 THR 14 79.754 -8.489 -12.960 144 H ALA 15 H ALA 15 77.377 -5.093 -12.577 145 HA ALA 15 HA ALA 15 77.537 -2.281 -12.878 146 HB1 ALA 15 HB1 ALA 15 75.444 -3.783 -12.801 147 HB2 ALA 15 HB2 ALA 15 75.348 -2.213 -12.002 148 HB3 ALA 15 HB3 ALA 15 75.592 -3.676 -11.047 149 H ALA 16 H ALA 16 77.722 -0.637 -11.342 150 HA ALA 16 HA ALA 16 79.588 -1.037 -9.278 151 HB1 ALA 16 HB1 ALA 16 78.687 1.269 -8.502 152 HB2 ALA 16 HB2 ALA 16 77.698 1.200 -9.960 153 HB3 ALA 16 HB3 ALA 16 79.457 1.160 -10.085 154 H ALA 17 H ALA 17 79.398 -1.264 -7.076 155 HA ALA 17 HA ALA 17 76.742 -1.358 -5.860 156 HB1 ALA 17 HB1 ALA 17 77.308 -3.614 -4.841 157 HB2 ALA 17 HB2 ALA 17 78.598 -3.736 -6.038 158 HB3 ALA 17 HB3 ALA 17 76.916 -3.634 -6.560 159 H LYS 18 H LYS 18 76.820 -1.400 -3.528 160 HA LYS 18 HA LYS 18 79.174 -0.022 -2.500 161 HB2 LYS 18 HB2 LYS 18 76.503 -0.687 -1.240 162 HB3 LYS 18 HB3 LYS 18 77.781 0.233 -0.445 163 HG2 LYS 18 HG2 LYS 18 77.682 1.952 -2.164 164 HG3 LYS 18 HG3 LYS 18 76.508 1.010 -3.084 165 HD2 LYS 18 HD2 LYS 18 75.287 2.689 -1.852 166 HD3 LYS 18 HD3 LYS 18 74.968 1.129 -1.091 167 HE2 LYS 18 HE2 LYS 18 76.545 1.579 0.673 168 HE3 LYS 18 HE3 LYS 18 77.132 3.026 -0.147 169 HZ1 LYS 18 HZ1 LYS 18 75.095 4.121 0.217 170 HZ2 LYS 18 HZ2 LYS 18 75.500 3.401 1.702 171 HZ3 LYS 18 HZ3 LYS 18 74.315 2.698 0.709 172 H PHE 19 H PHE 19 80.556 -0.801 -0.960 173 HA PHE 19 HA PHE 19 80.234 -3.649 -0.191 174 HB2 PHE 19 HB2 PHE 19 82.769 -2.099 -0.736 175 HB3 PHE 19 HB3 PHE 19 82.700 -3.749 -0.146 176 HD1 PHE 19 HD1 PHE 19 81.844 -5.569 -1.619 177 HD2 PHE 19 HD2 PHE 19 82.410 -1.556 -3.043 178 HE1 PHE 19 HE1 PHE 19 81.744 -6.385 -3.959 179 HE2 PHE 19 HE2 PHE 19 82.310 -2.372 -5.382 180 HZ PHE 19 HZ PHE 19 81.977 -4.786 -5.841 181 H GLU 20 H GLU 20 80.935 -4.251 1.884 182 HA GLU 20 HA GLU 20 80.993 -2.025 3.823 183 HB2 GLU 20 HB2 GLU 20 79.193 -3.756 4.039 184 HB3 GLU 20 HB3 GLU 20 80.450 -4.957 4.337 185 HG2 GLU 20 HG2 GLU 20 81.255 -3.592 6.258 186 HG3 GLU 20 HG3 GLU 20 79.928 -2.471 5.989 187 H ARG 21 H ARG 21 82.634 -1.828 5.300 188 HA ARG 21 HA ARG 21 85.172 -2.913 4.611 189 HB2 ARG 21 HB2 ARG 21 84.822 -0.706 5.734 190 HB3 ARG 21 HB3 ARG 21 84.370 -1.572 7.203 191 HG2 ARG 21 HG2 ARG 21 86.560 -2.660 7.275 192 HG3 ARG 21 HG3 ARG 21 87.020 -1.880 5.760 193 HD2 ARG 21 HD2 ARG 21 87.981 -0.588 7.552 194 HD3 ARG 21 HD3 ARG 21 86.645 0.344 6.884 195 HE ARG 21 HE ARG 21 85.948 -1.346 9.141 196 HH11 ARG 21 HH11 ARG 21 86.999 1.854 8.149 197 HH12 ARG 21 HH12 ARG 21 86.434 2.600 9.607 198 HH21 ARG 21 HH21 ARG 21 85.242 -0.329 10.996 199 HH22 ARG 21 HH22 ARG 21 85.452 1.378 11.198 200 H GLN 22 H GLN 22 86.348 -4.550 5.507 201 HA GLN 22 HA GLN 22 84.936 -6.298 7.441 202 HB2 GLN 22 HB2 GLN 22 86.914 -7.008 5.263 203 HB3 GLN 22 HB3 GLN 22 86.258 -8.147 6.439 204 HG2 GLN 22 HG2 GLN 22 83.989 -7.717 5.640 205 HG3 GLN 22 HG3 GLN 22 84.590 -6.501 4.517 206 HE21 GLN 22 HE21 GLN 22 83.131 -8.791 3.605 207 HE22 GLN 22 HE22 GLN 22 84.185 -9.768 2.703 208 H HIS 23 H HIS 23 86.167 -7.309 9.063 209 HA HIS 23 HA HIS 23 88.839 -6.123 9.559 210 HB2 HIS 23 HB2 HIS 23 87.139 -5.171 11.059 211 HB3 HIS 23 HB3 HIS 23 86.691 -6.785 11.578 212 HD1 HIS 23 HD1 HIS 23 88.203 -7.940 13.299 213 HD2 HIS 23 HD2 HIS 23 89.658 -4.232 12.068 214 HE1 HIS 23 HE1 HIS 23 90.095 -7.355 14.875 215 H MET 24 H MET 24 90.433 -7.509 10.098 216 HA MET 24 HA MET 24 89.713 -10.348 10.564 217 HB2 MET 24 HB2 MET 24 92.021 -9.243 8.945 218 HB3 MET 24 HB3 MET 24 91.771 -10.948 9.323 219 HG2 MET 24 HG2 MET 24 89.518 -10.791 8.214 220 HG3 MET 24 HG3 MET 24 89.943 -9.159 7.698 221 HE1 MET 24 HE1 MET 24 92.193 -12.555 7.884 222 HE2 MET 24 HE2 MET 24 91.598 -13.176 6.347 223 HE3 MET 24 HE3 MET 24 90.460 -12.800 7.637 224 H ASP 25 H ASP 25 91.194 -11.551 11.859 225 HA ASP 25 HA ASP 25 92.374 -9.958 13.978 226 HB2 ASP 25 HB2 ASP 25 91.074 -12.029 14.447 227 HB3 ASP 25 HB3 ASP 25 92.323 -12.964 13.627 228 H SER 26 H SER 26 94.401 -9.252 13.914 229 HA SER 26 HA SER 26 96.267 -10.001 11.925 230 HB2 SER 26 HB2 SER 26 97.886 -8.687 13.282 231 HB3 SER 26 HB3 SER 26 96.378 -7.823 13.002 232 HG SER 26 HG SER 26 96.916 -9.345 15.277 233 HA PRO 27 HA PRO 27 98.018 -13.564 13.894 234 HB2 PRO 27 HB2 PRO 27 100.399 -13.801 12.642 235 HB3 PRO 27 HB3 PRO 27 98.864 -14.051 11.788 236 HG2 PRO 27 HG2 PRO 27 100.699 -11.727 11.730 237 HG3 PRO 27 HG3 PRO 27 99.699 -12.415 10.440 238 HD2 PRO 27 HD2 PRO 27 99.050 -10.152 11.952 239 HD3 PRO 27 HD3 PRO 27 97.912 -11.101 10.974 240 H ASP 28 H ASP 28 100.347 -14.311 14.779 241 HA ASP 28 HA ASP 28 101.110 -12.264 16.744 242 HB2 ASP 28 HB2 ASP 28 102.120 -14.145 17.980 243 HB3 ASP 28 HB3 ASP 28 100.411 -14.406 17.659 244 H LEU 29 H LEU 29 103.452 -12.272 17.409 245 HA LEU 29 HA LEU 29 105.097 -12.109 14.988 246 HB2 LEU 29 HB2 LEU 29 105.690 -11.159 17.802 247 HB3 LEU 29 HB3 LEU 29 106.646 -10.812 16.362 248 HG LEU 29 HG LEU 29 103.748 -10.001 16.750 249 HD11 LEU 29 HD11 LEU 29 104.874 -7.672 16.749 250 HD12 LEU 29 HD12 LEU 29 106.366 -8.540 17.109 251 HD13 LEU 29 HD13 LEU 29 105.001 -8.634 18.222 252 HD21 LEU 29 HD21 LEU 29 104.133 -10.203 14.418 253 HD22 LEU 29 HD22 LEU 29 105.783 -9.595 14.553 254 HD23 LEU 29 HD23 LEU 29 104.419 -8.495 14.753 255 H GLY 30 H GLY 30 106.988 -13.240 14.699 256 HA2 GLY 30 HA2 GLY 30 107.238 -15.705 16.212 257 HA3 GLY 30 HA3 GLY 30 108.165 -15.253 14.784 258 H THR 31 H THR 31 109.766 -16.333 16.436 259 HA THR 31 HA THR 31 110.722 -14.690 18.576 260 HB THR 31 HB THR 31 111.044 -17.122 18.590 261 HG1 THR 31 HG1 THR 31 113.042 -16.953 19.354 262 HG21 THR 31 HG21 THR 31 111.527 -17.023 15.973 263 HG22 THR 31 HG22 THR 31 112.213 -18.297 16.978 264 HG23 THR 31 HG23 THR 31 113.197 -16.906 16.526 265 H ASP 32 H ASP 32 112.504 -13.358 18.664 266 HA ASP 32 HA ASP 32 113.946 -12.821 16.149 267 HB2 ASP 32 HB2 ASP 32 112.679 -10.725 17.929 268 HB3 ASP 32 HB3 ASP 32 113.753 -10.389 16.574 269 H ASP 33 H ASP 33 115.946 -11.576 16.505 270 HA ASP 33 HA ASP 33 117.333 -12.566 18.842 271 HB2 ASP 33 HB2 ASP 33 119.316 -11.523 17.807 272 HB3 ASP 33 HB3 ASP 33 118.466 -12.583 16.691 273 H ASP 34 H ASP 34 118.843 -11.021 20.018 274 HA ASP 34 HA ASP 34 117.264 -8.992 21.269 275 HB2 ASP 34 HB2 ASP 34 120.211 -9.641 21.505 276 HB3 ASP 34 HB3 ASP 34 119.342 -8.519 22.547 277 H ASP 35 H ASP 35 117.328 -6.802 21.060 278 HA ASP 35 HA ASP 35 119.266 -5.623 19.177 279 HB2 ASP 35 HB2 ASP 35 116.271 -5.186 19.117 280 HB3 ASP 35 HB3 ASP 35 117.445 -4.281 18.166 281 H LYS 36 H LYS 36 119.362 -3.246 19.359 282 HA LYS 36 HA LYS 36 118.475 -2.237 21.994 283 HB2 LYS 36 HB2 LYS 36 120.653 -1.093 22.234 284 HB3 LYS 36 HB3 LYS 36 120.832 -2.847 22.196 285 HG2 LYS 36 HG2 LYS 36 121.281 -2.642 19.707 286 HG3 LYS 36 HG3 LYS 36 121.365 -0.896 19.944 287 HD2 LYS 36 HD2 LYS 36 123.068 -2.899 21.451 288 HD3 LYS 36 HD3 LYS 36 123.609 -2.008 20.028 289 HE2 LYS 36 HE2 LYS 36 123.076 0.127 21.246 290 HE3 LYS 36 HE3 LYS 36 122.749 -0.836 22.686 291 HZ1 LYS 36 HZ1 LYS 36 125.315 -0.715 21.196 292 HZ2 LYS 36 HZ2 LYS 36 125.010 -1.729 22.525 293 HZ3 LYS 36 HZ3 LYS 36 125.006 -0.042 22.722 294 H THR 37 H THR 37 117.641 -0.233 21.974 295 HA THR 37 HA THR 37 118.116 1.500 19.650 296 HB THR 37 HB THR 37 116.046 0.247 19.188 297 HG1 THR 37 HG1 THR 37 115.657 2.100 18.357 298 HG21 THR 37 HG21 THR 37 115.027 1.541 21.732 299 HG22 THR 37 HG22 THR 37 115.371 -0.176 21.527 300 HG23 THR 37 HG23 THR 37 114.069 0.578 20.607 301 H GLY 38 H GLY 38 117.480 3.743 20.027 302 HA2 GLY 38 HA2 GLY 38 118.112 4.558 22.739 303 HA3 GLY 38 HA3 GLY 38 117.891 5.619 21.351 304 H GLY 39 H GLY 39 116.739 6.706 23.345 305 HA2 GLY 39 HA2 GLY 39 114.067 5.704 23.872 306 HA3 GLY 39 HA3 GLY 39 114.773 7.188 24.506 307 H GLY 40 H GLY 40 112.279 7.507 23.770 308 HA2 GLY 40 HA2 GLY 40 112.143 9.578 22.014 309 HA3 GLY 40 HA3 GLY 40 111.967 8.167 20.975 310 H ARG 41 H ARG 41 109.853 9.472 20.695 311 HA ARG 41 HA ARG 41 107.875 9.197 22.768 312 HB2 ARG 41 HB2 ARG 41 107.834 11.026 21.080 313 HB3 ARG 41 HB3 ARG 41 107.521 9.829 19.826 314 HG2 ARG 41 HG2 ARG 41 105.382 10.676 20.396 315 HG3 ARG 41 HG3 ARG 41 105.482 9.131 21.236 316 HD2 ARG 41 HD2 ARG 41 106.193 10.325 23.298 317 HD3 ARG 41 HD3 ARG 41 106.020 11.857 22.447 318 HE ARG 41 HE ARG 41 103.665 10.134 22.492 319 HH11 ARG 41 HH11 ARG 41 105.312 12.871 23.951 320 HH12 ARG 41 HH12 ARG 41 103.863 13.484 24.672 321 HH21 ARG 41 HH21 ARG 41 101.833 10.973 23.446 322 HH22 ARG 41 HH22 ARG 41 101.919 12.423 24.390 323 H ALA 42 H ALA 42 106.262 7.682 22.947 324 HA ALA 42 HA ALA 42 106.679 5.084 21.984 325 HB1 ALA 42 HB1 ALA 42 105.135 6.046 23.912 326 HB2 ALA 42 HB2 ALA 42 104.757 4.513 23.127 327 HB3 ALA 42 HB3 ALA 42 103.907 5.982 22.648 328 H ASP 43 H ASP 43 105.664 3.870 20.357 329 HA ASP 43 HA ASP 43 105.341 5.174 17.905 330 HB2 ASP 43 HB2 ASP 43 104.444 2.995 17.097 331 HB3 ASP 43 HB3 ASP 43 105.941 2.826 18.013 332 HA PRO 44 HA PRO 44 101.024 6.281 18.320 333 HB2 PRO 44 HB2 PRO 44 100.531 7.283 15.882 334 HB3 PRO 44 HB3 PRO 44 101.704 8.060 16.966 335 HG2 PRO 44 HG2 PRO 44 102.171 6.386 14.574 336 HG3 PRO 44 HG3 PRO 44 103.120 7.735 15.218 337 HD2 PRO 44 HD2 PRO 44 103.653 4.970 15.585 338 HD3 PRO 44 HD3 PRO 44 104.454 6.330 16.401 339 H ALA 45 H ALA 45 98.867 6.017 17.078 340 HA ALA 45 HA ALA 45 98.354 3.266 16.591 341 HB1 ALA 45 HB1 ALA 45 96.116 3.903 16.235 342 HB2 ALA 45 HB2 ALA 45 96.571 5.505 15.654 343 HB3 ALA 45 HB3 ALA 45 96.721 5.113 17.367 344 H HIS 46 H HIS 46 97.714 2.252 14.619 345 HA HIS 46 HA HIS 46 99.082 3.397 12.273 346 HB2 HIS 46 HB2 HIS 46 98.128 0.587 12.838 347 HB3 HIS 46 HB3 HIS 46 98.933 1.099 11.367 348 HD1 HIS 46 HD1 HIS 46 101.429 2.254 11.900 349 HD2 HIS 46 HD2 HIS 46 99.871 -0.404 14.709 350 HE1 HIS 46 HE1 HIS 46 103.381 1.483 13.315 351 H ARG 47 H ARG 47 98.022 3.930 10.454 352 HA ARG 47 HA ARG 47 95.116 3.367 10.307 353 HB2 ARG 47 HB2 ARG 47 96.572 5.906 9.530 354 HB3 ARG 47 HB3 ARG 47 94.862 5.585 9.232 355 HG2 ARG 47 HG2 ARG 47 94.529 5.271 11.683 356 HG3 ARG 47 HG3 ARG 47 96.217 5.712 11.942 357 HD2 ARG 47 HD2 ARG 47 95.746 7.887 10.757 358 HD3 ARG 47 HD3 ARG 47 94.040 7.450 10.756 359 HE ARG 47 HE ARG 47 95.112 7.260 13.384 360 HH11 ARG 47 HH11 ARG 47 94.080 9.658 11.037 361 HH12 ARG 47 HH12 ARG 47 93.694 10.828 12.254 362 HH21 ARG 47 HH21 ARG 47 94.597 8.807 14.905 363 HH22 ARG 47 HH22 ARG 47 93.983 10.351 14.417 364 H SER 48 H SER 48 94.239 3.302 8.146 365 HA SER 48 HA SER 48 95.679 1.674 6.395 366 HB2 SER 48 HB2 SER 48 93.891 2.510 4.700 367 HB3 SER 48 HB3 SER 48 93.362 1.609 6.117 368 HG SER 48 HG SER 48 92.560 3.918 5.459 369 HA PRO 49 HA PRO 49 98.418 4.128 3.968 370 HB2 PRO 49 HB2 PRO 49 96.807 3.473 1.534 371 HB3 PRO 49 HB3 PRO 49 98.555 3.331 1.799 372 HG2 PRO 49 HG2 PRO 49 96.980 1.196 1.825 373 HG3 PRO 49 HG3 PRO 49 98.365 1.341 2.923 374 HD2 PRO 49 HD2 PRO 49 95.461 1.566 3.532 375 HD3 PRO 49 HD3 PRO 49 96.797 1.035 4.575 376 H VAL 50 H VAL 50 98.473 6.305 3.781 377 HA VAL 50 HA VAL 50 95.953 7.736 3.451 378 HB VAL 50 HB VAL 50 98.733 8.773 4.071 379 HG11 VAL 50 HG11 VAL 50 97.168 10.437 3.040 380 HG12 VAL 50 HG12 VAL 50 97.613 10.839 4.699 381 HG13 VAL 50 HG13 VAL 50 96.035 10.129 4.356 382 HG21 VAL 50 HG21 VAL 50 96.352 8.296 5.893 383 HG22 VAL 50 HG22 VAL 50 97.926 8.926 6.378 384 HG23 VAL 50 HG23 VAL 50 97.780 7.263 5.811 385 HA PRO 51 HA PRO 51 96.655 8.445 -0.917 386 HB2 PRO 51 HB2 PRO 51 95.734 11.245 -0.452 387 HB3 PRO 51 HB3 PRO 51 95.157 10.047 -1.626 388 HG2 PRO 51 HG2 PRO 51 93.754 10.661 0.552 389 HG3 PRO 51 HG3 PRO 51 93.786 9.017 -0.112 390 HD2 PRO 51 HD2 PRO 51 95.125 10.078 2.330 391 HD3 PRO 51 HD3 PRO 51 94.519 8.444 1.991 392 H LEU 52 H LEU 52 98.186 9.460 -2.283 393 HA LEU 52 HA LEU 52 100.573 10.291 -1.020 394 HB2 LEU 52 HB2 LEU 52 99.618 10.279 -3.873 395 HB3 LEU 52 HB3 LEU 52 101.166 11.007 -3.447 396 HG LEU 52 HG LEU 52 100.403 8.189 -2.648 397 HD11 LEU 52 HD11 LEU 52 100.437 8.083 -5.011 398 HD12 LEU 52 HD12 LEU 52 102.077 7.630 -4.545 399 HD13 LEU 52 HD13 LEU 52 101.745 9.261 -5.130 400 HD21 LEU 52 HD21 LEU 52 102.888 9.889 -2.563 401 HD22 LEU 52 HD22 LEU 52 103.025 8.133 -2.648 402 HD23 LEU 52 HD23 LEU 52 102.188 8.887 -1.291 403 HA PRO 53 HA PRO 53 99.806 14.668 -0.739 404 HB2 PRO 53 HB2 PRO 53 102.319 15.706 -0.797 405 HB3 PRO 53 HB3 PRO 53 101.681 14.826 0.606 406 HG2 PRO 53 HG2 PRO 53 103.554 13.915 -1.504 407 HG3 PRO 53 HG3 PRO 53 103.518 13.530 0.225 408 HD2 PRO 53 HD2 PRO 53 102.574 11.849 -1.763 409 HD3 PRO 53 HD3 PRO 53 102.067 11.781 -0.063 410 H SER 54 H SER 54 99.669 16.551 -2.026 411 HA SER 54 HA SER 54 99.449 16.147 -4.766 412 HB2 SER 54 HB2 SER 54 99.241 18.612 -4.933 413 HB3 SER 54 HB3 SER 54 98.280 17.952 -3.614 414 HG SER 54 HG SER 54 100.319 19.659 -3.525 415 HA PRO 55 HA PRO 55 103.685 16.292 -5.857 416 HB2 PRO 55 HB2 PRO 55 103.583 16.449 -8.552 417 HB3 PRO 55 HB3 PRO 55 103.026 15.014 -7.669 418 HG2 PRO 55 HG2 PRO 55 101.454 17.173 -8.943 419 HG3 PRO 55 HG3 PRO 55 101.087 15.448 -8.777 420 HD2 PRO 55 HD2 PRO 55 100.043 17.491 -7.167 421 HD3 PRO 55 HD3 PRO 55 100.020 15.757 -6.787 422 H THR 56 H THR 56 104.974 17.978 -5.367 423 HA THR 56 HA THR 56 104.681 20.569 -6.634 424 HB THR 56 HB THR 56 106.738 21.153 -5.461 425 HG1 THR 56 HG1 THR 56 106.887 18.565 -4.512 426 HG21 THR 56 HG21 THR 56 105.919 21.021 -3.268 427 HG22 THR 56 HG22 THR 56 105.233 19.416 -3.519 428 HG23 THR 56 HG23 THR 56 104.459 20.828 -4.239 429 H SER 57 H SER 57 106.597 21.455 -7.938 430 HA SER 57 HA SER 57 106.666 19.986 -10.301 431 HB2 SER 57 HB2 SER 57 108.149 21.634 -11.142 432 HB3 SER 57 HB3 SER 57 107.142 22.465 -9.962 433 HG SER 57 HG SER 57 109.785 21.948 -9.915 434 H ASN 58 H ASN 58 107.692 18.230 -10.876 435 HA ASN 58 HA ASN 58 109.361 16.738 -11.291 436 HB2 ASN 58 HB2 ASN 58 111.094 18.936 -10.162 437 HB3 ASN 58 HB3 ASN 58 111.697 17.499 -10.985 438 HD21 ASN 58 HD21 ASN 58 112.055 20.242 -11.949 439 HD22 ASN 58 HD22 ASN 58 111.249 20.349 -13.439 440 H LYS 59 H LYS 59 108.192 17.117 -8.325 441 HA LYS 59 HA LYS 59 109.735 14.916 -7.292 442 HB2 LYS 59 HB2 LYS 59 110.641 15.989 -5.341 443 HB3 LYS 59 HB3 LYS 59 111.177 16.863 -6.772 444 HG2 LYS 59 HG2 LYS 59 109.325 18.509 -6.398 445 HG3 LYS 59 HG3 LYS 59 108.938 17.669 -4.895 446 HD2 LYS 59 HD2 LYS 59 111.365 18.038 -4.211 447 HD3 LYS 59 HD3 LYS 59 111.491 19.136 -5.586 448 HE2 LYS 59 HE2 LYS 59 109.867 20.620 -4.690 449 HE3 LYS 59 HE3 LYS 59 109.314 19.429 -3.513 450 HZ1 LYS 59 HZ1 LYS 59 111.167 21.374 -3.071 451 HZ2 LYS 59 HZ2 LYS 59 112.113 19.980 -3.290 452 HZ3 LYS 59 HZ3 LYS 59 110.906 20.011 -2.095 453 H GLN 60 H GLN 60 108.976 14.079 -5.257 454 HA GLN 60 HA GLN 60 106.485 15.188 -4.183 455 HB2 GLN 60 HB2 GLN 60 106.791 12.322 -5.095 456 HB3 GLN 60 HB3 GLN 60 105.535 12.859 -3.982 457 HG2 GLN 60 HG2 GLN 60 104.810 14.526 -5.720 458 HG3 GLN 60 HG3 GLN 60 105.964 13.781 -6.828 459 HE21 GLN 60 HE21 GLN 60 102.845 13.300 -5.196 460 HE22 GLN 60 HE22 GLN 60 102.453 11.876 -6.032 461 H ASP 61 H ASP 61 106.105 14.641 -2.000 462 HA ASP 61 HA ASP 61 108.406 13.484 -0.581 463 HB2 ASP 61 HB2 ASP 61 105.928 14.884 0.461 464 HB3 ASP 61 HB3 ASP 61 107.266 14.314 1.453 465 H ILE 62 H ILE 62 108.348 11.391 0.075 466 HA ILE 62 HA ILE 62 105.696 10.100 0.371 467 HB ILE 62 HB ILE 62 106.662 9.505 -1.812 468 HG12 ILE 62 HG12 ILE 62 106.973 7.038 -0.140 469 HG13 ILE 62 HG13 ILE 62 105.421 7.864 -0.120 470 HG21 ILE 62 HG21 ILE 62 108.917 8.280 -0.201 471 HG22 ILE 62 HG22 ILE 62 109.051 9.765 -1.142 472 HG23 ILE 62 HG23 ILE 62 108.731 8.233 -1.954 473 HD11 ILE 62 HD11 ILE 62 104.885 7.101 -2.165 474 HD12 ILE 62 HD12 ILE 62 106.264 6.016 -2.018 475 HD13 ILE 62 HD13 ILE 62 106.445 7.554 -2.854 476 H SER 63 H SER 63 105.626 8.282 1.799 477 HA SER 63 HA SER 63 107.907 7.968 3.597 478 HB2 SER 63 HB2 SER 63 106.702 8.627 5.578 479 HB3 SER 63 HB3 SER 63 106.632 9.950 4.419 480 HG SER 63 HG SER 63 104.646 8.611 5.487 481 H GLU 64 H GLU 64 107.508 6.353 5.290 482 HA GLU 64 HA GLU 64 106.592 3.931 4.305 483 HB2 GLU 64 HB2 GLU 64 106.729 3.140 6.643 484 HB3 GLU 64 HB3 GLU 64 108.134 4.104 6.189 485 HG2 GLU 64 HG2 GLU 64 107.066 6.094 7.224 486 HG3 GLU 64 HG3 GLU 64 105.737 5.075 7.763 487 H ALA 65 H ALA 65 104.828 6.420 6.097 488 HA ALA 65 HA ALA 65 102.618 4.883 6.898 489 HB1 ALA 65 HB1 ALA 65 101.424 7.215 6.639 490 HB2 ALA 65 HB2 ALA 65 103.067 7.796 6.371 491 HB3 ALA 65 HB3 ALA 65 102.656 6.982 7.880 492 H ASN 66 H ASN 66 103.249 6.636 3.879 493 HA ASN 66 HA ASN 66 100.674 6.256 2.751 494 HB2 ASN 66 HB2 ASN 66 103.315 6.642 1.324 495 HB3 ASN 66 HB3 ASN 66 101.710 6.913 0.649 496 HD21 ASN 66 HD21 ASN 66 100.380 8.663 1.759 497 HD22 ASN 66 HD22 ASN 66 101.203 9.976 2.451 498 H LEU 67 H LEU 67 103.725 4.473 2.399 499 HA LEU 67 HA LEU 67 102.546 2.631 0.512 500 HB2 LEU 67 HB2 LEU 67 105.254 3.131 1.638 501 HB3 LEU 67 HB3 LEU 67 104.938 1.522 0.998 502 HG LEU 67 HG LEU 67 104.238 2.500 -1.151 503 HD11 LEU 67 HD11 LEU 67 105.022 5.158 0.086 504 HD12 LEU 67 HD12 LEU 67 103.373 4.663 -0.298 505 HD13 LEU 67 HD13 LEU 67 104.543 4.894 -1.590 506 HD21 LEU 67 HD21 LEU 67 106.396 2.908 -1.930 507 HD22 LEU 67 HD22 LEU 67 106.728 2.074 -0.412 508 HD23 LEU 67 HD23 LEU 67 106.850 3.832 -0.498 509 H ALA 68 H ALA 68 102.795 2.644 3.953 510 HA ALA 68 HA ALA 68 102.170 1.100 5.522 511 HB1 ALA 68 HB1 ALA 68 100.385 -0.261 4.999 512 HB2 ALA 68 HB2 ALA 68 101.078 -0.761 3.456 513 HB3 ALA 68 HB3 ALA 68 100.326 0.827 3.612 514 H TYR 69 H TYR 69 102.155 -1.918 4.858 515 HA TYR 69 HA TYR 69 104.766 -2.469 5.698 516 HB2 TYR 69 HB2 TYR 69 102.815 -4.239 4.230 517 HB3 TYR 69 HB3 TYR 69 104.273 -4.801 5.025 518 HD1 TYR 69 HD1 TYR 69 104.483 -4.583 7.525 519 HD2 TYR 69 HD2 TYR 69 100.815 -3.790 5.436 520 HE1 TYR 69 HE1 TYR 69 103.228 -4.781 9.654 521 HE2 TYR 69 HE2 TYR 69 99.559 -3.988 7.565 522 HH TYR 69 HH TYR 69 101.178 -4.314 10.606 523 H LEU 70 H LEU 70 103.609 -1.776 2.514 524 HA LEU 70 HA LEU 70 105.443 -3.147 0.902 525 HB2 LEU 70 HB2 LEU 70 103.454 -1.901 0.082 526 HB3 LEU 70 HB3 LEU 70 104.301 -0.390 0.412 527 HG LEU 70 HG LEU 70 106.159 -1.208 -1.098 528 HD11 LEU 70 HD11 LEU 70 104.137 -3.412 -1.468 529 HD12 LEU 70 HD12 LEU 70 105.876 -3.542 -1.200 530 HD13 LEU 70 HD13 LEU 70 105.262 -2.999 -2.762 531 HD21 LEU 70 HD21 LEU 70 104.577 0.404 -1.958 532 HD22 LEU 70 HD22 LEU 70 103.360 -0.849 -2.207 533 HD23 LEU 70 HD23 LEU 70 104.814 -0.820 -3.205 534 H TRP 71 H TRP 71 105.924 -0.358 2.939 535 HA TRP 71 HA TRP 71 108.004 0.961 1.663 536 HB2 TRP 71 HB2 TRP 71 106.700 1.602 3.750 537 HB3 TRP 71 HB3 TRP 71 107.811 0.577 4.636 538 HD1 TRP 71 HD1 TRP 71 109.799 1.791 5.602 539 HE1 TRP 71 HE1 TRP 71 111.044 3.988 5.103 540 HE3 TRP 71 HE3 TRP 71 107.299 3.294 1.413 541 HZ2 TRP 71 HZ2 TRP 71 111.009 6.102 3.164 542 HZ3 TRP 71 HZ3 TRP 71 107.926 5.390 0.259 543 HH2 TRP 71 HH2 TRP 71 109.774 6.796 1.125 544 HA PRO 72 HA PRO 72 110.916 -2.483 2.413 545 HB2 PRO 72 HB2 PRO 72 112.626 -2.095 0.394 546 HB3 PRO 72 HB3 PRO 72 110.966 -2.650 0.093 547 HG2 PRO 72 HG2 PRO 72 112.150 0.041 -0.278 548 HG3 PRO 72 HG3 PRO 72 110.919 -0.798 -1.237 549 HD2 PRO 72 HD2 PRO 72 110.432 1.147 0.743 550 HD3 PRO 72 HD3 PRO 72 109.225 0.070 0.010 551 H LEU 73 H LEU 73 111.625 0.880 2.633 552 HA LEU 73 HA LEU 73 114.469 0.482 3.193 553 HB2 LEU 73 HB2 LEU 73 112.838 3.028 3.233 554 HB3 LEU 73 HB3 LEU 73 114.594 2.903 3.294 555 HG LEU 73 HG LEU 73 112.865 1.948 0.994 556 HD11 LEU 73 HD11 LEU 73 113.746 3.895 -0.196 557 HD12 LEU 73 HD12 LEU 73 114.712 4.344 1.211 558 HD13 LEU 73 HD13 LEU 73 112.952 4.425 1.292 559 HD21 LEU 73 HD21 LEU 73 114.912 0.645 1.150 560 HD22 LEU 73 HD22 LEU 73 115.871 2.103 1.405 561 HD23 LEU 73 HD23 LEU 73 115.105 1.810 -0.157 562 H THR 74 H THR 74 115.455 0.814 5.113 563 HA THR 74 HA THR 74 113.996 0.507 7.536 564 HB THR 74 HB THR 74 116.165 0.797 8.633 565 HG1 THR 74 HG1 THR 74 117.154 2.319 7.493 566 HG21 THR 74 HG21 THR 74 116.358 -0.805 6.067 567 HG22 THR 74 HG22 THR 74 115.658 -1.374 7.582 568 HG23 THR 74 HG23 THR 74 117.382 -1.015 7.487 569 H VAL 75 H VAL 75 115.476 3.300 5.890 570 HA VAL 75 HA VAL 75 114.908 5.172 7.963 571 HB VAL 75 HB VAL 75 115.104 6.901 6.184 572 HG11 VAL 75 HG11 VAL 75 117.252 4.769 6.004 573 HG12 VAL 75 HG12 VAL 75 117.094 5.906 7.343 574 HG13 VAL 75 HG13 VAL 75 117.453 6.498 5.721 575 HG21 VAL 75 HG21 VAL 75 115.732 6.168 3.901 576 HG22 VAL 75 HG22 VAL 75 114.103 5.646 4.318 577 HG23 VAL 75 HG23 VAL 75 115.437 4.495 4.363 578 H ASP 76 H ASP 76 113.026 6.222 8.460 579 HA ASP 76 HA ASP 76 110.696 4.781 7.787 580 HB2 ASP 76 HB2 ASP 76 111.010 7.451 9.176 581 HB3 ASP 76 HB3 ASP 76 109.501 6.547 9.086 582 H HIS 77 H HIS 77 112.021 7.775 6.472 583 HA HIS 77 HA HIS 77 110.017 7.610 4.358 584 HB2 HIS 77 HB2 HIS 77 109.464 10.023 4.567 585 HB3 HIS 77 HB3 HIS 77 108.869 9.037 5.887 586 HD1 HIS 77 HD1 HIS 77 110.887 8.986 7.958 587 HD2 HIS 77 HD2 HIS 77 110.477 12.361 5.545 588 HE1 HIS 77 HE1 HIS 77 111.916 10.910 9.239 589 H GLY 78 H GLY 78 110.453 9.406 2.704 590 HA2 GLY 78 HA2 GLY 78 112.996 10.682 2.636 591 HA3 GLY 78 HA3 GLY 78 112.973 9.249 1.613 592 H THR 79 H THR 79 113.315 11.812 0.582 593 HA THR 79 HA THR 79 110.741 12.366 -0.772 594 HB THR 79 HB THR 79 113.164 14.162 -0.844 595 HG1 THR 79 HG1 THR 79 112.759 14.142 1.249 596 HG21 THR 79 HG21 THR 79 110.195 14.366 -1.335 597 HG22 THR 79 HG22 THR 79 111.521 14.816 -2.411 598 HG23 THR 79 HG23 THR 79 111.153 15.811 -1.000 599 H ILE 80 H ILE 80 110.623 12.279 -2.995 600 HA ILE 80 HA ILE 80 112.977 11.110 -4.363 601 HB ILE 80 HB ILE 80 111.341 10.160 -5.957 602 HG12 ILE 80 HG12 ILE 80 109.269 11.245 -4.017 603 HG13 ILE 80 HG13 ILE 80 109.578 11.902 -5.622 604 HG21 ILE 80 HG21 ILE 80 112.097 8.872 -3.992 605 HG22 ILE 80 HG22 ILE 80 110.430 8.473 -4.405 606 HG23 ILE 80 HG23 ILE 80 110.770 9.540 -3.042 607 HD11 ILE 80 HD11 ILE 80 108.406 9.231 -4.886 608 HD12 ILE 80 HD12 ILE 80 109.156 9.484 -6.461 609 HD13 ILE 80 HD13 ILE 80 107.763 10.459 -5.982 610 H GLU 81 H GLU 81 113.754 12.060 -6.198 611 HA GLU 81 HA GLU 81 112.286 14.329 -7.331 612 HB2 GLU 81 HB2 GLU 81 113.699 15.225 -5.484 613 HB3 GLU 81 HB3 GLU 81 115.123 14.603 -6.318 614 HG2 GLU 81 HG2 GLU 81 114.515 15.971 -8.308 615 HG3 GLU 81 HG3 GLU 81 113.163 16.642 -7.408 616 H CYS 82 H CYS 82 112.676 14.734 -9.416 617 HA CYS 82 HA CYS 82 114.738 13.128 -10.798 618 HB2 CYS 82 HB2 CYS 82 112.105 14.299 -11.661 619 HB3 CYS 82 HB3 CYS 82 113.351 13.933 -12.854 620 H LEU 83 H LEU 83 116.520 14.185 -11.407 621 HA LEU 83 HA LEU 83 116.645 17.072 -11.182 622 HB2 LEU 83 HB2 LEU 83 118.653 14.905 -11.752 623 HB3 LEU 83 HB3 LEU 83 119.066 16.607 -11.966 624 HG LEU 83 HG LEU 83 117.842 15.565 -9.408 625 HD11 LEU 83 HD11 LEU 83 119.967 14.364 -9.850 626 HD12 LEU 83 HD12 LEU 83 120.120 15.474 -8.488 627 HD13 LEU 83 HD13 LEU 83 120.785 15.912 -10.062 628 HD21 LEU 83 HD21 LEU 83 119.167 17.657 -8.608 629 HD22 LEU 83 HD22 LEU 83 117.671 17.917 -9.503 630 HD23 LEU 83 HD23 LEU 83 119.226 18.086 -10.317 631 HA PRO 84 HA PRO 84 115.997 18.273 -15.389 632 HB2 PRO 84 HB2 PRO 84 118.671 19.597 -15.362 633 HB3 PRO 84 HB3 PRO 84 117.086 20.258 -15.810 634 HG2 PRO 84 HG2 PRO 84 118.229 20.874 -13.496 635 HG3 PRO 84 HG3 PRO 84 116.476 20.643 -13.632 636 HD2 PRO 84 HD2 PRO 84 118.517 18.834 -12.420 637 HD3 PRO 84 HD3 PRO 84 116.814 19.078 -11.974 638 H SER 85 H SER 85 118.898 16.586 -14.495 639 HA SER 85 HA SER 85 119.839 16.164 -17.196 640 HB2 SER 85 HB2 SER 85 120.692 14.998 -14.545 641 HB3 SER 85 HB3 SER 85 121.479 14.646 -16.079 642 HG SER 85 HG SER 85 121.464 16.944 -14.599 643 H ASP 86 H ASP 86 117.206 14.868 -15.734 644 HA ASP 86 HA ASP 86 115.912 13.031 -16.129 645 HB2 ASP 86 HB2 ASP 86 116.881 13.350 -18.510 646 HB3 ASP 86 HB3 ASP 86 117.928 11.993 -18.103 647 H ASN 87 H ASN 87 117.941 13.067 -14.081 648 HA ASN 87 HA ASN 87 118.515 10.167 -13.855 649 HB2 ASN 87 HB2 ASN 87 119.819 12.536 -12.490 650 HB3 ASN 87 HB3 ASN 87 120.183 10.848 -12.138 651 HD21 ASN 87 HD21 ASN 87 122.128 12.747 -13.191 652 HD22 ASN 87 HD22 ASN 87 122.585 12.195 -14.729 653 H ALA 88 H ALA 88 117.366 9.070 -12.383 654 HA ALA 88 HA ALA 88 115.630 10.578 -10.559 655 HB1 ALA 88 HB1 ALA 88 114.324 8.975 -11.611 656 HB2 ALA 88 HB2 ALA 88 114.795 8.113 -10.146 657 HB3 ALA 88 HB3 ALA 88 115.633 7.795 -11.665 658 H VAL 89 H VAL 89 116.157 10.824 -8.479 659 HA VAL 89 HA VAL 89 117.879 8.787 -7.202 660 HB VAL 89 HB VAL 89 119.070 10.597 -6.006 661 HG11 VAL 89 HG11 VAL 89 120.587 10.981 -7.734 662 HG12 VAL 89 HG12 VAL 89 119.316 11.190 -8.940 663 HG13 VAL 89 HG13 VAL 89 119.709 9.578 -8.341 664 HG21 VAL 89 HG21 VAL 89 118.857 12.916 -6.947 665 HG22 VAL 89 HG22 VAL 89 117.399 12.360 -6.126 666 HG23 VAL 89 HG23 VAL 89 117.472 12.361 -7.888 667 H PHE 90 H PHE 90 117.753 8.723 -4.929 668 HA PHE 90 HA PHE 90 115.187 9.656 -3.795 669 HB2 PHE 90 HB2 PHE 90 115.335 7.234 -4.023 670 HB3 PHE 90 HB3 PHE 90 116.882 7.227 -3.208 671 HD1 PHE 90 HD1 PHE 90 113.256 7.972 -2.718 672 HD2 PHE 90 HD2 PHE 90 117.009 6.991 -0.875 673 HE1 PHE 90 HE1 PHE 90 112.098 7.612 -0.543 674 HE2 PHE 90 HE2 PHE 90 115.854 6.617 1.286 675 HZ PHE 90 HZ PHE 90 113.396 6.930 1.449 676 H VAL 91 H VAL 91 115.348 11.057 -2.126 677 HA VAL 91 HA VAL 91 117.967 11.390 -0.796 678 HB VAL 91 HB VAL 91 115.602 13.282 -0.946 679 HG11 VAL 91 HG11 VAL 91 117.326 13.368 1.069 680 HG12 VAL 91 HG12 VAL 91 116.830 14.843 0.250 681 HG13 VAL 91 HG13 VAL 91 118.378 14.098 -0.141 682 HG21 VAL 91 HG21 VAL 91 118.286 13.384 -2.355 683 HG22 VAL 91 HG22 VAL 91 116.994 14.577 -2.490 684 HG23 VAL 91 HG23 VAL 91 116.757 12.946 -3.117 685 H ALA 92 H ALA 92 118.143 10.863 1.315 686 HA ALA 92 HA ALA 92 115.672 10.073 2.737 687 HB1 ALA 92 HB1 ALA 92 117.288 8.328 2.778 688 HB2 ALA 92 HB2 ALA 92 117.365 9.073 4.375 689 HB3 ALA 92 HB3 ALA 92 118.596 9.444 3.168 690 HA PRO 93 HA PRO 93 115.558 13.530 5.485 691 HB2 PRO 93 HB2 PRO 93 115.826 11.655 7.792 692 HB3 PRO 93 HB3 PRO 93 114.611 12.911 7.493 693 HG2 PRO 93 HG2 PRO 93 114.098 10.300 7.173 694 HG3 PRO 93 HG3 PRO 93 113.332 11.559 6.191 695 HD2 PRO 93 HD2 PRO 93 115.393 9.588 5.405 696 HD3 PRO 93 HD3 PRO 93 114.232 10.479 4.402 697 H ASP 94 H ASP 94 118.073 11.134 5.897 698 HA ASP 94 HA ASP 94 119.665 12.529 7.776 699 HB2 ASP 94 HB2 ASP 94 121.483 11.014 6.980 700 HB3 ASP 94 HB3 ASP 94 120.006 10.186 7.451 701 H GLY 95 H GLY 95 119.059 13.281 4.503 702 HA2 GLY 95 HA2 GLY 95 119.861 15.198 3.387 703 HA3 GLY 95 HA3 GLY 95 121.207 15.268 4.520 704 H THR 96 H THR 96 120.788 12.127 3.318 705 HA THR 96 HA THR 96 123.111 12.431 1.546 706 HB THR 96 HB THR 96 121.823 9.941 2.696 707 HG1 THR 96 HG1 THR 96 122.764 11.028 4.318 708 HG21 THR 96 HG21 THR 96 124.294 9.159 2.120 709 HG22 THR 96 HG22 THR 96 124.190 10.466 0.939 710 HG23 THR 96 HG23 THR 96 123.028 9.139 0.893 711 H THR 97 H THR 97 122.990 11.890 -0.606 712 HA THR 97 HA THR 97 120.293 11.261 -1.646 713 HB THR 97 HB THR 97 122.703 12.339 -3.135 714 HG1 THR 97 HG1 THR 97 121.787 13.755 -1.586 715 HG21 THR 97 HG21 THR 97 119.774 12.068 -3.866 716 HG22 THR 97 HG22 THR 97 121.109 11.149 -4.559 717 HG23 THR 97 HG23 THR 97 120.988 12.884 -4.850 718 H TYR 98 H TYR 98 119.917 9.391 -2.574 719 HA TYR 98 HA TYR 98 122.166 7.582 -3.210 720 HB2 TYR 98 HB2 TYR 98 119.331 6.893 -2.420 721 HB3 TYR 98 HB3 TYR 98 120.606 5.744 -2.767 722 HD1 TYR 98 HD1 TYR 98 119.244 8.132 -0.327 723 HD2 TYR 98 HD2 TYR 98 122.401 5.334 -1.138 724 HE1 TYR 98 HE1 TYR 98 119.875 8.152 2.069 725 HE2 TYR 98 HE2 TYR 98 123.021 5.343 1.264 726 HH TYR 98 HH TYR 98 121.427 7.452 3.563 727 H ALA 99 H ALA 99 121.998 6.407 -5.173 728 HA ALA 99 HA ALA 99 120.384 7.733 -7.203 729 HB1 ALA 99 HB1 ALA 99 121.725 5.852 -8.590 730 HB2 ALA 99 HB2 ALA 99 122.756 5.938 -7.163 731 HB3 ALA 99 HB3 ALA 99 122.457 7.386 -8.120 732 H LEU 100 H LEU 100 118.533 6.954 -8.020 733 HA LEU 100 HA LEU 100 117.525 4.399 -7.041 734 HB2 LEU 100 HB2 LEU 100 116.304 6.655 -8.629 735 HB3 LEU 100 HB3 LEU 100 115.477 5.120 -8.395 736 HG LEU 100 HG LEU 100 116.575 6.639 -6.038 737 HD11 LEU 100 HD11 LEU 100 115.128 8.198 -7.287 738 HD12 LEU 100 HD12 LEU 100 114.324 7.667 -5.809 739 HD13 LEU 100 HD13 LEU 100 113.866 6.971 -7.363 740 HD21 LEU 100 HD21 LEU 100 114.210 4.765 -6.380 741 HD22 LEU 100 HD22 LEU 100 114.864 5.365 -4.857 742 HD23 LEU 100 HD23 LEU 100 115.809 4.250 -5.842 743 H ASN 101 H ASN 101 118.088 6.006 -10.168 744 HA ASN 101 HA ASN 101 117.769 3.378 -11.494 745 HB2 ASN 101 HB2 ASN 101 117.263 4.550 -13.509 746 HB3 ASN 101 HB3 ASN 101 116.297 5.246 -12.215 747 HD21 ASN 101 HD21 ASN 101 116.444 6.950 -14.229 748 HD22 ASN 101 HD22 ASN 101 117.617 8.156 -14.004 749 H ASP 102 H ASP 102 119.073 3.126 -13.546 750 HA ASP 102 HA ASP 102 121.692 2.649 -12.724 751 HB2 ASP 102 HB2 ASP 102 120.541 2.808 -15.513 752 HB3 ASP 102 HB3 ASP 102 122.135 2.164 -15.130 753 H ARG 103 H ARG 103 120.401 5.375 -14.608 754 HA ARG 103 HA ARG 103 122.913 6.358 -15.457 755 HB2 ARG 103 HB2 ARG 103 120.235 7.716 -15.134 756 HB3 ARG 103 HB3 ARG 103 121.645 8.491 -15.865 757 HG2 ARG 103 HG2 ARG 103 121.801 6.605 -17.488 758 HG3 ARG 103 HG3 ARG 103 120.323 5.929 -16.805 759 HD2 ARG 103 HD2 ARG 103 120.586 8.649 -18.116 760 HD3 ARG 103 HD3 ARG 103 119.827 7.229 -18.830 761 HE ARG 103 HE ARG 103 118.656 9.007 -16.911 762 HH11 ARG 103 HH11 ARG 103 118.646 5.653 -17.950 763 HH12 ARG 103 HH12 ARG 103 117.046 5.375 -17.349 764 HH21 ARG 103 HH21 ARG 103 116.632 8.600 -16.169 765 HH22 ARG 103 HH22 ARG 103 115.909 7.033 -16.344 766 H ALA 104 H ALA 104 120.914 7.166 -12.621 767 HA ALA 104 HA ALA 104 122.579 9.151 -11.552 768 HB1 ALA 104 HB1 ALA 104 121.477 8.699 -9.430 769 HB2 ALA 104 HB2 ALA 104 120.908 7.140 -10.029 770 HB3 ALA 104 HB3 ALA 104 120.295 8.633 -10.736 771 H GLU 105 H GLU 105 122.718 5.612 -11.234 772 HA GLU 105 HA GLU 105 124.869 5.499 -9.412 773 HB2 GLU 105 HB2 GLU 105 124.129 3.569 -11.625 774 HB3 GLU 105 HB3 GLU 105 125.264 3.227 -10.321 775 HG2 GLU 105 HG2 GLU 105 122.352 3.975 -9.942 776 HG3 GLU 105 HG3 GLU 105 122.997 2.342 -9.837 777 H LYS 106 H LYS 106 124.816 5.668 -12.958 778 HA LYS 106 HA LYS 106 127.572 5.520 -13.433 779 HB2 LYS 106 HB2 LYS 106 125.700 5.503 -15.146 780 HB3 LYS 106 HB3 LYS 106 125.658 7.260 -14.990 781 HG2 LYS 106 HG2 LYS 106 128.203 7.167 -15.434 782 HG3 LYS 106 HG3 LYS 106 127.908 5.524 -16.003 783 HD2 LYS 106 HD2 LYS 106 126.372 7.917 -17.037 784 HD3 LYS 106 HD3 LYS 106 127.845 7.320 -17.803 785 HE2 LYS 106 HE2 LYS 106 125.525 5.475 -17.239 786 HE3 LYS 106 HE3 LYS 106 125.588 6.442 -18.712 787 HZ1 LYS 106 HZ1 LYS 106 126.588 4.106 -18.757 788 HZ2 LYS 106 HZ2 LYS 106 127.883 4.781 -17.887 789 HZ3 LYS 106 HZ3 LYS 106 127.495 5.371 -19.433 790 H ALA 107 H ALA 107 125.575 8.229 -12.423 791 HA ALA 107 HA ALA 107 127.578 10.245 -12.715 792 HB1 ALA 107 HB1 ALA 107 125.118 10.260 -10.960 793 HB2 ALA 107 HB2 ALA 107 125.148 10.719 -12.663 794 HB3 ALA 107 HB3 ALA 107 126.049 11.665 -11.478 795 H GLY 108 H GLY 108 127.699 7.686 -10.673 796 HA2 GLY 108 HA2 GLY 108 129.078 7.244 -8.919 797 HA3 GLY 108 HA3 GLY 108 129.643 8.901 -8.987 798 H HIS 109 H HIS 109 126.204 8.341 -8.583 799 HA HIS 109 HA HIS 109 126.326 9.264 -5.836 800 HB2 HIS 109 HB2 HIS 109 124.130 8.603 -7.765 801 HB3 HIS 109 HB3 HIS 109 123.772 8.729 -6.054 802 HD1 HIS 109 HD1 HIS 109 124.233 11.113 -4.939 803 HD2 HIS 109 HD2 HIS 109 124.400 11.032 -9.104 804 HE1 HIS 109 HE1 HIS 109 124.101 13.521 -5.707 805 HA PRO 110 HA PRO 110 126.532 5.114 -4.270 806 HB2 PRO 110 HB2 PRO 110 125.589 5.400 -1.727 807 HB3 PRO 110 HB3 PRO 110 127.183 5.995 -2.234 808 HG2 PRO 110 HG2 PRO 110 124.646 7.489 -1.842 809 HG3 PRO 110 HG3 PRO 110 126.311 7.966 -1.466 810 HD2 PRO 110 HD2 PRO 110 124.950 8.836 -3.693 811 HD3 PRO 110 HD3 PRO 110 126.720 8.727 -3.596 812 HA PRO 111 HA PRO 111 122.368 3.586 -4.846 813 HB2 PRO 111 HB2 PRO 111 122.642 0.965 -4.157 814 HB3 PRO 111 HB3 PRO 111 123.285 1.643 -5.664 815 HG2 PRO 111 HG2 PRO 111 124.696 0.904 -3.178 816 HG3 PRO 111 HG3 PRO 111 125.253 0.856 -4.856 817 HD2 PRO 111 HD2 PRO 111 125.909 2.833 -2.995 818 HD3 PRO 111 HD3 PRO 111 126.087 2.973 -4.755 819 H ILE 112 H ILE 112 120.464 2.921 -3.728 820 HA ILE 112 HA ILE 112 120.274 3.770 -1.050 821 HB ILE 112 HB ILE 112 118.346 2.101 -2.687 822 HG12 ILE 112 HG12 ILE 112 118.393 5.060 -2.041 823 HG13 ILE 112 HG13 ILE 112 118.964 4.376 -3.561 824 HG21 ILE 112 HG21 ILE 112 117.934 3.632 -0.094 825 HG22 ILE 112 HG22 ILE 112 117.830 1.883 -0.292 826 HG23 ILE 112 HG23 ILE 112 116.638 2.924 -1.055 827 HD11 ILE 112 HD11 ILE 112 116.141 4.118 -2.466 828 HD12 ILE 112 HD12 ILE 112 116.715 3.474 -4.007 829 HD13 ILE 112 HD13 ILE 112 116.641 5.217 -3.749 830 H THR 113 H THR 113 121.500 0.792 -2.205 831 HA THR 113 HA THR 113 120.321 -1.113 -0.678 832 HB THR 113 HB THR 113 122.090 -1.426 -2.442 833 HG1 THR 113 HG1 THR 113 121.953 -3.360 -1.748 834 HG21 THR 113 HG21 THR 113 123.992 -0.254 -1.588 835 HG22 THR 113 HG22 THR 113 124.367 -1.968 -1.477 836 HG23 THR 113 HG23 THR 113 123.896 -1.079 -0.033 837 HA PRO 114 HA PRO 114 123.336 -0.468 3.054 838 HB2 PRO 114 HB2 PRO 114 123.208 2.479 3.381 839 HB3 PRO 114 HB3 PRO 114 124.584 1.376 3.588 840 HG2 PRO 114 HG2 PRO 114 124.442 2.999 1.500 841 HG3 PRO 114 HG3 PRO 114 125.076 1.348 1.339 842 HD2 PRO 114 HD2 PRO 114 122.362 2.398 0.596 843 HD3 PRO 114 HD3 PRO 114 123.410 1.286 -0.304 844 H ILE 115 H ILE 115 120.616 1.657 2.343 845 HA ILE 115 HA ILE 115 119.548 1.265 5.050 846 HB ILE 115 HB ILE 115 117.782 2.914 4.291 847 HG12 ILE 115 HG12 ILE 115 119.780 3.521 2.097 848 HG13 ILE 115 HG13 ILE 115 118.301 2.604 1.822 849 HG21 ILE 115 HG21 ILE 115 119.289 3.833 5.755 850 HG22 ILE 115 HG22 ILE 115 119.625 4.822 4.337 851 HG23 ILE 115 HG23 ILE 115 120.683 3.469 4.737 852 HD11 ILE 115 HD11 ILE 115 118.051 5.231 3.230 853 HD12 ILE 115 HD12 ILE 115 116.940 4.445 2.109 854 HD13 ILE 115 HD13 ILE 115 118.381 5.259 1.498 855 H ARG 116 H ARG 116 119.387 -0.552 2.359 856 HA ARG 116 HA ARG 116 116.546 -0.948 2.145 857 HB2 ARG 116 HB2 ARG 116 118.147 -1.382 0.282 858 HB3 ARG 116 HB3 ARG 116 118.800 -2.736 1.203 859 HG2 ARG 116 HG2 ARG 116 116.512 -3.739 1.272 860 HG3 ARG 116 HG3 ARG 116 115.945 -2.432 0.231 861 HD2 ARG 116 HD2 ARG 116 118.140 -4.403 -0.465 862 HD3 ARG 116 HD3 ARG 116 116.493 -4.450 -1.084 863 HE ARG 116 HE ARG 116 117.237 -1.988 -1.813 864 HH11 ARG 116 HH11 ARG 116 118.982 -5.019 -2.116 865 HH12 ARG 116 HH12 ARG 116 119.840 -4.499 -3.527 866 HH21 ARG 116 HH21 ARG 116 118.373 -1.375 -3.634 867 HH22 ARG 116 HH22 ARG 116 119.499 -2.462 -4.375 868 H ALA 117 H ALA 117 115.301 -2.562 3.058 869 HA ALA 117 HA ALA 117 116.375 -3.825 5.440 870 HB1 ALA 117 HB1 ALA 117 114.115 -4.362 5.958 871 HB2 ALA 117 HB2 ALA 117 113.609 -4.149 4.281 872 HB3 ALA 117 HB3 ALA 117 114.072 -2.748 5.248 873 H LYS 118 H LYS 118 116.869 -5.937 5.687 874 HA LYS 118 HA LYS 118 116.524 -7.721 3.379 875 HB2 LYS 118 HB2 LYS 118 118.149 -9.159 4.432 876 HB3 LYS 118 HB3 LYS 118 118.772 -7.513 4.434 877 HG2 LYS 118 HG2 LYS 118 117.965 -7.264 6.793 878 HG3 LYS 118 HG3 LYS 118 117.495 -8.964 6.772 879 HD2 LYS 118 HD2 LYS 118 119.900 -9.489 6.106 880 HD3 LYS 118 HD3 LYS 118 120.280 -7.814 6.507 881 HE2 LYS 118 HE2 LYS 118 119.824 -8.113 8.779 882 HE3 LYS 118 HE3 LYS 118 118.798 -9.518 8.490 883 HZ1 LYS 118 HZ1 LYS 118 121.160 -9.869 9.405 884 HZ2 LYS 118 HZ2 LYS 118 121.662 -9.598 7.805 885 HZ3 LYS 118 HZ3 LYS 118 120.611 -10.884 8.161 886 H GLY 119 H GLY 119 115.317 -9.591 3.459 887 HA2 GLY 119 HA2 GLY 119 113.377 -9.684 5.676 888 HA3 GLY 119 HA3 GLY 119 113.118 -10.334 4.072 889 H SER 120 H SER 120 112.574 -11.901 6.261 890 HA SER 120 HA SER 120 114.627 -13.583 7.161 891 HB2 SER 120 HB2 SER 120 112.291 -13.541 8.055 892 HB3 SER 120 HB3 SER 120 111.761 -14.374 6.598 893 HG SER 120 HG SER 120 113.325 -15.976 7.212 894 H GLY 121 H GLY 121 112.647 -13.727 4.227 895 HA2 GLY 121 HA2 GLY 121 114.640 -15.554 3.060 896 HA3 GLY 121 HA3 GLY 121 112.930 -15.964 2.951 897 H GLY 122 H GLY 122 114.425 -15.645 0.653 898 HA2 GLY 122 HA2 GLY 122 114.093 -14.680 -1.426 899 HA3 GLY 122 HA3 GLY 122 112.944 -13.572 -0.689 900 H GLY 123 H GLY 123 116.195 -13.861 0.591 901 HA2 GLY 123 HA2 GLY 123 117.988 -12.424 0.604 902 HA3 GLY 123 HA3 GLY 123 117.483 -11.926 -1.006 903 H TYR 124 H TYR 124 117.187 -9.813 -1.140 904 HA TYR 124 HA TYR 124 116.336 -8.322 1.265 905 HB2 TYR 124 HB2 TYR 124 117.980 -7.595 -1.138 906 HB3 TYR 124 HB3 TYR 124 117.223 -6.357 -0.153 907 HD1 TYR 124 HD1 TYR 124 118.919 -9.585 0.719 908 HD2 TYR 124 HD2 TYR 124 118.865 -5.310 1.125 909 HE1 TYR 124 HE1 TYR 124 120.830 -9.711 2.296 910 HE2 TYR 124 HE2 TYR 124 120.770 -5.435 2.707 911 HH TYR 124 HH TYR 124 122.421 -8.423 3.331 912 H ILE 125 H ILE 125 114.852 -6.570 1.016 913 HA ILE 125 HA ILE 125 112.638 -7.313 -0.667 914 HB ILE 125 HB ILE 125 113.038 -5.005 1.257 915 HG12 ILE 125 HG12 ILE 125 111.328 -7.455 1.655 916 HG13 ILE 125 HG13 ILE 125 113.043 -7.497 2.046 917 HG21 ILE 125 HG21 ILE 125 111.249 -4.639 -0.508 918 HG22 ILE 125 HG22 ILE 125 110.658 -4.657 1.152 919 HG23 ILE 125 HG23 ILE 125 110.439 -6.073 0.123 920 HD11 ILE 125 HD11 ILE 125 112.822 -6.039 3.813 921 HD12 ILE 125 HD12 ILE 125 111.228 -6.789 3.858 922 HD13 ILE 125 HD13 ILE 125 111.436 -5.208 3.104 923 H SER 126 H SER 126 112.034 -6.456 -2.548 924 HA SER 126 HA SER 126 113.909 -5.009 -4.096 925 HB2 SER 126 HB2 SER 126 110.981 -5.543 -4.619 926 HB3 SER 126 HB3 SER 126 112.153 -4.989 -5.810 927 HG SER 126 HG SER 126 112.028 -7.421 -4.481 928 H LEU 127 H LEU 127 114.107 -2.943 -4.642 929 HA LEU 127 HA LEU 127 112.334 -0.949 -3.438 930 HB2 LEU 127 HB2 LEU 127 114.797 -0.554 -5.149 931 HB3 LEU 127 HB3 LEU 127 113.949 0.687 -4.231 932 HG LEU 127 HG LEU 127 115.302 -1.749 -3.031 933 HD11 LEU 127 HD11 LEU 127 116.937 -0.098 -2.175 934 HD12 LEU 127 HD12 LEU 127 116.104 1.178 -3.062 935 HD13 LEU 127 HD13 LEU 127 116.913 -0.121 -3.938 936 HD21 LEU 127 HD21 LEU 127 113.729 0.563 -1.902 937 HD22 LEU 127 HD22 LEU 127 114.964 -0.236 -0.929 938 HD23 LEU 127 HD23 LEU 127 113.585 -1.156 -1.531 939 H GLY 128 H GLY 128 111.870 -2.793 -6.032 940 HA2 GLY 128 HA2 GLY 128 111.820 -1.303 -8.332 941 HA3 GLY 128 HA3 GLY 128 110.646 -2.561 -7.973 942 H ALA 129 H ALA 129 109.273 -1.348 -5.828 943 HA ALA 129 HA ALA 129 107.374 0.165 -7.248 944 HB1 ALA 129 HB1 ALA 129 106.200 0.319 -5.240 945 HB2 ALA 129 HB2 ALA 129 107.671 0.405 -4.271 946 HB3 ALA 129 HB3 ALA 129 107.176 -1.128 -4.988 947 H LEU 130 H LEU 130 109.894 1.203 -4.959 948 HA LEU 130 HA LEU 130 109.260 3.941 -4.947 949 HB2 LEU 130 HB2 LEU 130 110.794 2.825 -3.343 950 HB3 LEU 130 HB3 LEU 130 111.986 2.660 -4.632 951 HG LEU 130 HG LEU 130 111.889 5.168 -4.922 952 HD11 LEU 130 HD11 LEU 130 111.010 6.369 -2.836 953 HD12 LEU 130 HD12 LEU 130 110.186 4.861 -2.440 954 HD13 LEU 130 HD13 LEU 130 109.788 5.719 -3.929 955 HD21 LEU 130 HD21 LEU 130 112.650 4.525 -2.084 956 HD22 LEU 130 HD22 LEU 130 113.506 5.511 -3.268 957 HD23 LEU 130 HD23 LEU 130 113.519 3.755 -3.412 958 H LEU 131 H LEU 131 111.398 2.049 -7.050 959 HA LEU 131 HA LEU 131 112.520 4.192 -8.482 960 HB2 LEU 131 HB2 LEU 131 113.358 1.857 -8.569 961 HB3 LEU 131 HB3 LEU 131 111.922 1.393 -9.478 962 HG LEU 131 HG LEU 131 112.574 3.146 -11.197 963 HD11 LEU 131 HD11 LEU 131 115.025 3.182 -9.429 964 HD12 LEU 131 HD12 LEU 131 114.055 4.552 -9.971 965 HD13 LEU 131 HD13 LEU 131 115.079 3.687 -11.118 966 HD21 LEU 131 HD21 LEU 131 114.208 0.697 -10.576 967 HD22 LEU 131 HD22 LEU 131 114.628 1.704 -11.962 968 HD23 LEU 131 HD23 LEU 131 113.037 0.950 -11.870 969 H SER 132 H SER 132 109.569 2.303 -9.057 970 HA SER 132 HA SER 132 108.938 3.359 -11.577 971 HB2 SER 132 HB2 SER 132 106.994 2.460 -9.437 972 HB3 SER 132 HB3 SER 132 106.672 2.576 -11.164 973 HG SER 132 HG SER 132 107.370 0.592 -11.068 974 H THR 133 H THR 133 108.092 4.491 -8.321 975 HA THR 133 HA THR 133 106.324 6.538 -9.115 976 HB THR 133 HB THR 133 108.131 6.529 -6.686 977 HG1 THR 133 HG1 THR 133 106.867 5.037 -6.009 978 HG21 THR 133 HG21 THR 133 106.419 7.955 -5.709 979 HG22 THR 133 HG22 THR 133 105.426 7.812 -7.159 980 HG23 THR 133 HG23 THR 133 106.964 8.674 -7.224 981 H THR 134 H THR 134 109.823 6.627 -8.453 982 HA THR 134 HA THR 134 110.111 9.407 -8.880 983 HB THR 134 HB THR 134 112.233 7.298 -9.317 984 HG1 THR 134 HG1 THR 134 111.633 7.003 -7.300 985 HG21 THR 134 HG21 THR 134 113.733 9.154 -8.637 986 HG22 THR 134 HG22 THR 134 112.340 10.233 -8.545 987 HG23 THR 134 HG23 THR 134 112.828 9.551 -10.097 988 H LEU 135 H LEU 135 110.353 6.654 -11.107 989 HA LEU 135 HA LEU 135 111.310 8.064 -13.342 990 HB2 LEU 135 HB2 LEU 135 109.561 5.602 -13.172 991 HB3 LEU 135 HB3 LEU 135 110.281 6.200 -14.667 992 HG LEU 135 HG LEU 135 111.903 5.542 -12.196 993 HD11 LEU 135 HD11 LEU 135 111.163 3.856 -14.598 994 HD12 LEU 135 HD12 LEU 135 110.944 3.463 -12.893 995 HD13 LEU 135 HD13 LEU 135 112.565 3.503 -13.588 996 HD21 LEU 135 HD21 LEU 135 113.659 5.359 -14.128 997 HD22 LEU 135 HD22 LEU 135 113.185 6.960 -13.560 998 HD23 LEU 135 HD23 LEU 135 112.494 6.311 -15.047 999 H ASN 136 H ASN 136 108.005 7.535 -12.162 1000 HA ASN 136 HA ASN 136 106.616 8.631 -14.337 1001 HB2 ASN 136 HB2 ASN 136 105.937 8.683 -11.387 1002 HB3 ASN 136 HB3 ASN 136 104.814 9.095 -12.681 1003 HD21 ASN 136 HD21 ASN 136 104.449 6.861 -10.832 1004 HD22 ASN 136 HD22 ASN 136 104.485 5.439 -11.758 1005 H LEU 137 H LEU 137 107.962 10.178 -11.442 1006 HA LEU 137 HA LEU 137 107.166 12.818 -12.043 1007 HB2 LEU 137 HB2 LEU 137 109.633 11.895 -10.547 1008 HB3 LEU 137 HB3 LEU 137 108.928 13.510 -10.482 1009 HG LEU 137 HG LEU 137 107.485 10.969 -9.668 1010 HD11 LEU 137 HD11 LEU 137 109.079 11.274 -7.976 1011 HD12 LEU 137 HD12 LEU 137 107.709 12.201 -7.366 1012 HD13 LEU 137 HD13 LEU 137 109.060 13.029 -8.140 1013 HD21 LEU 137 HD21 LEU 137 105.901 12.635 -10.378 1014 HD22 LEU 137 HD22 LEU 137 106.784 13.915 -9.546 1015 HD23 LEU 137 HD23 LEU 137 105.927 12.686 -8.617 1016 H CYS 138 H CYS 138 110.066 10.995 -12.943 1017 HA CYS 138 HA CYS 138 111.472 13.041 -14.237 1018 HB2 CYS 138 HB2 CYS 138 111.418 10.060 -14.470 1019 HB3 CYS 138 HB3 CYS 138 112.302 10.986 -15.677 1020 H GLY 139 H GLY 139 108.635 11.281 -15.288 1021 HA2 GLY 139 HA2 GLY 139 107.220 11.863 -17.053 1022 HA3 GLY 139 HA3 GLY 139 108.453 12.962 -17.653 1023 H LYS 140 H LYS 140 109.386 9.678 -16.933 1024 HA LYS 140 HA LYS 140 109.936 9.224 -19.760 1025 HB2 LYS 140 HB2 LYS 140 111.617 8.682 -17.989 1026 HB3 LYS 140 HB3 LYS 140 110.522 7.436 -17.389 1027 HG2 LYS 140 HG2 LYS 140 110.559 6.361 -19.633 1028 HG3 LYS 140 HG3 LYS 140 111.730 7.568 -20.168 1029 HD2 LYS 140 HD2 LYS 140 113.245 6.841 -18.307 1030 HD3 LYS 140 HD3 LYS 140 112.106 5.543 -17.945 1031 HE2 LYS 140 HE2 LYS 140 113.743 4.556 -19.364 1032 HE3 LYS 140 HE3 LYS 140 112.347 4.851 -20.401 1033 HZ1 LYS 140 HZ1 LYS 140 113.614 6.110 -21.681 1034 HZ2 LYS 140 HZ2 LYS 140 114.953 5.842 -20.670 1035 HZ3 LYS 140 HZ3 LYS 140 113.919 7.160 -20.385 1036 H GLY 141 H GLY 141 108.811 7.894 -21.061 1037 HA2 GLY 141 HA2 GLY 141 107.115 6.527 -21.805 1038 HA3 GLY 141 HA3 GLY 141 107.360 5.624 -20.313 Start of MODEL 3 1 H1 HIS -5 HT1 HIS -5 53.366 14.153 -26.485 2 H2 HIS -5 HT2 HIS -5 52.487 14.818 -25.192 3 H3 HIS -5 HT3 HIS -5 51.847 13.516 -26.078 4 HA HIS -5 HA HIS -5 53.126 11.972 -25.055 5 HB2 HIS -5 HB2 HIS -5 55.116 14.204 -24.590 6 HB3 HIS -5 HB3 HIS -5 55.341 12.546 -24.063 7 HD1 HIS -5 HD1 HIS -5 55.417 14.741 -27.087 8 HD2 HIS -5 HD2 HIS -5 55.971 10.712 -26.171 9 HE1 HIS -5 HE1 HIS -5 56.455 13.678 -29.136 10 H HIS -4 H HIS -4 52.649 11.271 -23.040 11 HA HIS -4 HA HIS -4 52.019 13.303 -20.973 12 HB2 HIS -4 HB2 HIS -4 50.653 10.669 -21.539 13 HB3 HIS -4 HB3 HIS -4 50.326 11.683 -20.146 14 HD1 HIS -4 HD1 HIS -4 49.717 11.394 -23.819 15 HD2 HIS -4 HD2 HIS -4 48.830 14.055 -20.736 16 HE1 HIS -4 HE1 HIS -4 47.970 12.984 -24.728 17 H HIS -3 H HIS -3 52.692 12.905 -18.900 18 HA HIS -3 HA HIS -3 54.398 10.514 -18.488 19 HB2 HIS -3 HB2 HIS -3 55.689 12.617 -18.682 20 HB3 HIS -3 HB3 HIS -3 54.770 13.285 -17.346 21 HD1 HIS -3 HD1 HIS -3 56.933 10.200 -17.985 22 HD2 HIS -3 HD2 HIS -3 56.070 12.924 -14.949 23 HE1 HIS -3 HE1 HIS -3 58.417 9.585 -16.029 24 H HIS -2 H HIS -2 54.089 9.361 -16.660 25 HA HIS -2 HA HIS -2 52.104 10.372 -14.703 26 HB2 HIS -2 HB2 HIS -2 51.170 8.593 -16.126 27 HB3 HIS -2 HB3 HIS -2 52.491 7.536 -15.668 28 HD1 HIS -2 HD1 HIS -2 52.356 6.391 -13.377 29 HD2 HIS -2 HD2 HIS -2 49.216 9.044 -14.069 30 HE1 HIS -2 HE1 HIS -2 50.663 5.989 -11.540 31 H HIS -1 H HIS -1 52.521 10.003 -12.555 32 HA HIS -1 HA HIS -1 55.229 8.987 -11.923 33 HB2 HIS -1 HB2 HIS -1 53.450 10.893 -10.398 34 HB3 HIS -1 HB3 HIS -1 55.022 10.332 -9.861 35 HD1 HIS -1 HD1 HIS -1 57.065 10.989 -11.586 36 HD2 HIS -1 HD2 HIS -1 53.542 13.197 -11.903 37 HE1 HIS -1 HE1 HIS -1 57.658 13.106 -12.839 38 H HIS 0 H HIS 0 55.490 7.370 -10.476 39 HA HIS 0 HA HIS 0 53.092 6.333 -9.085 40 HB2 HIS 0 HB2 HIS 0 53.623 4.957 -11.072 41 HB3 HIS 0 HB3 HIS 0 55.238 4.694 -10.441 42 HD1 HIS 0 HD1 HIS 0 51.647 4.170 -9.244 43 HD2 HIS 0 HD2 HIS 0 55.390 2.350 -9.007 44 HE1 HIS 0 HE1 HIS 0 51.313 2.011 -7.964 45 H SER 1 H SER 1 53.483 5.311 -7.091 46 HA SER 1 HA SER 1 56.145 5.882 -5.912 47 HB2 SER 1 HB2 SER 1 53.441 5.855 -4.550 48 HB3 SER 1 HB3 SER 1 54.986 6.177 -3.772 49 HG SER 1 HG SER 1 53.487 7.901 -4.893 50 H SER 2 H SER 2 57.053 4.354 -4.552 51 HA SER 2 HA SER 2 55.647 1.801 -4.194 52 HB2 SER 2 HB2 SER 2 57.498 0.507 -5.055 53 HB3 SER 2 HB3 SER 2 57.005 1.656 -6.294 54 HG SER 2 HG SER 2 59.348 1.404 -5.311 55 H GLY 3 H GLY 3 56.797 0.372 -2.650 56 HA2 GLY 3 HA2 GLY 3 57.756 1.933 -0.402 57 HA3 GLY 3 HA3 GLY 3 57.436 0.201 -0.414 58 H LEU 4 H LEU 4 59.596 0.639 0.890 59 HA LEU 4 HA LEU 4 61.915 0.671 -0.909 60 HB2 LEU 4 HB2 LEU 4 61.807 0.647 2.118 61 HB3 LEU 4 HB3 LEU 4 63.249 0.875 1.130 62 HG LEU 4 HG LEU 4 60.826 2.701 1.095 63 HD11 LEU 4 HD11 LEU 4 61.937 2.979 3.206 64 HD12 LEU 4 HD12 LEU 4 62.475 4.306 2.177 65 HD13 LEU 4 HD13 LEU 4 63.527 2.918 2.446 66 HD21 LEU 4 HD21 LEU 4 62.489 4.199 -0.122 67 HD22 LEU 4 HD22 LEU 4 61.956 2.783 -1.028 68 HD23 LEU 4 HD23 LEU 4 63.540 2.789 -0.252 69 H VAL 5 H VAL 5 63.274 -1.046 -1.179 70 HA VAL 5 HA VAL 5 62.639 -3.555 0.250 71 HB VAL 5 HB VAL 5 62.978 -4.792 -1.866 72 HG11 VAL 5 HG11 VAL 5 60.841 -2.641 -1.959 73 HG12 VAL 5 HG12 VAL 5 60.702 -4.207 -1.159 74 HG13 VAL 5 HG13 VAL 5 60.830 -4.123 -2.917 75 HG21 VAL 5 HG21 VAL 5 62.862 -2.072 -3.200 76 HG22 VAL 5 HG22 VAL 5 63.126 -3.634 -3.975 77 HG23 VAL 5 HG23 VAL 5 64.368 -2.950 -2.926 78 HA PRO 6 HA PRO 6 67.055 -3.712 0.562 79 HB2 PRO 6 HB2 PRO 6 67.507 -6.301 1.164 80 HB3 PRO 6 HB3 PRO 6 66.633 -5.225 2.272 81 HG2 PRO 6 HG2 PRO 6 65.597 -7.350 0.498 82 HG3 PRO 6 HG3 PRO 6 65.009 -6.802 2.075 83 HD2 PRO 6 HD2 PRO 6 63.938 -6.083 -0.433 84 HD3 PRO 6 HD3 PRO 6 63.575 -5.313 1.126 85 H ARG 7 H ARG 7 68.196 -3.351 -1.283 86 HA ARG 7 HA ARG 7 68.608 -5.634 -3.128 87 HB2 ARG 7 HB2 ARG 7 68.371 -2.695 -3.818 88 HB3 ARG 7 HB3 ARG 7 68.835 -3.966 -4.952 89 HG2 ARG 7 HG2 ARG 7 66.681 -5.114 -4.535 90 HG3 ARG 7 HG3 ARG 7 66.212 -3.814 -3.438 91 HD2 ARG 7 HD2 ARG 7 65.212 -3.337 -5.576 92 HD3 ARG 7 HD3 ARG 7 66.533 -2.197 -5.345 93 HE ARG 7 HE ARG 7 67.488 -4.490 -6.704 94 HH11 ARG 7 HH11 ARG 7 65.473 -1.675 -7.286 95 HH12 ARG 7 HH12 ARG 7 65.815 -1.657 -8.984 96 HH21 ARG 7 HH21 ARG 7 67.892 -4.416 -8.895 97 HH22 ARG 7 HH22 ARG 7 67.168 -3.190 -9.883 98 H GLY 8 H GLY 8 70.683 -5.903 -3.946 99 HA2 GLY 8 HA2 GLY 8 72.805 -4.048 -3.523 100 HA3 GLY 8 HA3 GLY 8 72.852 -5.333 -2.319 101 H SER 9 H SER 9 73.998 -4.424 -5.276 102 HA SER 9 HA SER 9 74.808 -7.177 -5.891 103 HB2 SER 9 HB2 SER 9 74.256 -6.958 -8.236 104 HB3 SER 9 HB3 SER 9 72.808 -6.631 -7.290 105 HG SER 9 HG SER 9 74.067 -5.045 -8.971 106 H GLY 10 H GLY 10 76.667 -7.269 -7.344 107 HA2 GLY 10 HA2 GLY 10 78.630 -5.298 -6.683 108 HA3 GLY 10 HA3 GLY 10 78.851 -6.658 -7.780 109 H MET 11 H MET 11 79.488 -3.670 -7.905 110 HA MET 11 HA MET 11 78.359 -3.224 -10.606 111 HB2 MET 11 HB2 MET 11 78.745 -1.174 -8.412 112 HB3 MET 11 HB3 MET 11 78.321 -0.792 -10.081 113 HG2 MET 11 HG2 MET 11 76.293 -2.221 -9.861 114 HG3 MET 11 HG3 MET 11 76.697 -2.490 -8.165 115 HE1 MET 11 HE1 MET 11 73.980 -1.525 -8.966 116 HE2 MET 11 HE2 MET 11 73.649 -0.142 -7.927 117 HE3 MET 11 HE3 MET 11 74.440 -1.567 -7.259 118 H LYS 12 H LYS 12 79.705 -2.041 -12.041 119 HA LYS 12 HA LYS 12 82.564 -2.294 -11.398 120 HB2 LYS 12 HB2 LYS 12 81.122 -1.913 -14.033 121 HB3 LYS 12 HB3 LYS 12 82.876 -2.011 -13.855 122 HG2 LYS 12 HG2 LYS 12 82.709 -4.256 -12.936 123 HG3 LYS 12 HG3 LYS 12 80.948 -4.163 -12.938 124 HD2 LYS 12 HD2 LYS 12 81.593 -5.416 -14.891 125 HD3 LYS 12 HD3 LYS 12 81.056 -3.829 -15.442 126 HE2 LYS 12 HE2 LYS 12 83.164 -4.532 -16.551 127 HE3 LYS 12 HE3 LYS 12 83.378 -3.065 -15.598 128 HZ1 LYS 12 HZ1 LYS 12 84.493 -4.207 -13.939 129 HZ2 LYS 12 HZ2 LYS 12 85.083 -4.940 -15.353 130 HZ3 LYS 12 HZ3 LYS 12 83.896 -5.720 -14.422 131 H GLU 13 H GLU 13 83.997 -0.583 -11.621 132 HA GLU 13 HA GLU 13 82.747 2.090 -11.580 133 HB2 GLU 13 HB2 GLU 13 84.777 2.838 -10.442 134 HB3 GLU 13 HB3 GLU 13 84.054 1.478 -9.587 135 HG2 GLU 13 HG2 GLU 13 85.651 -0.048 -10.757 136 HG3 GLU 13 HG3 GLU 13 86.414 1.357 -11.486 137 H THR 14 H THR 14 83.584 3.786 -12.808 138 HA THR 14 HA THR 14 85.387 2.994 -15.026 139 HB THR 14 HB THR 14 84.123 4.476 -16.495 140 HG1 THR 14 HG1 THR 14 82.919 5.882 -15.584 141 HG21 THR 14 HG21 THR 14 82.023 3.195 -16.605 142 HG22 THR 14 HG22 THR 14 82.314 2.573 -14.981 143 HG23 THR 14 HG23 THR 14 83.393 2.127 -16.302 144 H ALA 15 H ALA 15 86.537 4.832 -16.013 145 HA ALA 15 HA ALA 15 87.917 6.353 -14.079 146 HB1 ALA 15 HB1 ALA 15 87.729 6.743 -17.076 147 HB2 ALA 15 HB2 ALA 15 88.929 5.772 -16.224 148 HB3 ALA 15 HB3 ALA 15 88.909 7.524 -16.024 149 H ALA 16 H ALA 16 87.827 8.519 -13.524 150 HA ALA 16 HA ALA 16 85.666 10.159 -14.641 151 HB1 ALA 16 HB1 ALA 16 84.997 10.811 -12.292 152 HB2 ALA 16 HB2 ALA 16 85.961 9.450 -11.716 153 HB3 ALA 16 HB3 ALA 16 84.565 9.165 -12.756 154 H ALA 17 H ALA 17 85.921 12.419 -14.223 155 HA ALA 17 HA ALA 17 88.599 13.318 -14.330 156 HB1 ALA 17 HB1 ALA 17 86.390 15.158 -13.501 157 HB2 ALA 17 HB2 ALA 17 86.340 14.438 -15.110 158 HB3 ALA 17 HB3 ALA 17 87.714 15.434 -14.632 159 H LYS 18 H LYS 18 89.907 14.298 -12.820 160 HA LYS 18 HA LYS 18 89.368 13.625 -10.052 161 HB2 LYS 18 HB2 LYS 18 91.625 13.355 -11.090 162 HB3 LYS 18 HB3 LYS 18 91.726 15.109 -11.236 163 HG2 LYS 18 HG2 LYS 18 92.858 14.603 -9.212 164 HG3 LYS 18 HG3 LYS 18 91.272 15.185 -8.708 165 HD2 LYS 18 HD2 LYS 18 90.477 12.889 -8.434 166 HD3 LYS 18 HD3 LYS 18 92.013 12.262 -9.032 167 HE2 LYS 18 HE2 LYS 18 93.113 13.564 -7.117 168 HE3 LYS 18 HE3 LYS 18 91.488 13.757 -6.459 169 HZ1 LYS 18 HZ1 LYS 18 92.923 11.737 -5.763 170 HZ2 LYS 18 HZ2 LYS 18 92.429 11.087 -7.253 171 HZ3 LYS 18 HZ3 LYS 18 91.272 11.516 -6.085 172 H PHE 19 H PHE 19 88.709 14.975 -8.486 173 HA PHE 19 HA PHE 19 88.358 17.834 -9.177 174 HB2 PHE 19 HB2 PHE 19 86.850 16.104 -7.215 175 HB3 PHE 19 HB3 PHE 19 86.589 17.822 -7.448 176 HD1 PHE 19 HD2 PHE 19 85.631 18.661 -9.592 177 HD2 PHE 19 HD1 PHE 19 85.976 14.467 -8.730 178 HE1 PHE 19 HE2 PHE 19 84.022 18.155 -11.410 179 HE2 PHE 19 HE1 PHE 19 84.367 13.961 -10.549 180 HZ PHE 19 HZ PHE 19 83.391 15.805 -11.889 181 H GLU 20 H GLU 20 89.096 19.395 -7.797 182 HA GLU 20 HA GLU 20 91.310 18.850 -6.169 183 HB2 GLU 20 HB2 GLU 20 89.453 21.240 -6.131 184 HB3 GLU 20 HB3 GLU 20 91.039 21.176 -5.362 185 HG2 GLU 20 HG2 GLU 20 90.514 20.779 -8.321 186 HG3 GLU 20 HG3 GLU 20 91.140 22.253 -7.594 187 H ARG 21 H ARG 21 91.590 18.635 -3.976 188 HA ARG 21 HA ARG 21 89.150 18.396 -2.313 189 HB2 ARG 21 HB2 ARG 21 90.052 16.158 -2.959 190 HB3 ARG 21 HB3 ARG 21 91.571 16.585 -2.171 191 HG2 ARG 21 HG2 ARG 21 90.347 16.944 -0.041 192 HG3 ARG 21 HG3 ARG 21 88.852 16.445 -0.835 193 HD2 ARG 21 HD2 ARG 21 89.923 14.255 -1.378 194 HD3 ARG 21 HD3 ARG 21 91.338 14.755 -0.456 195 HE ARG 21 HE ARG 21 88.896 14.953 1.054 196 HH11 ARG 21 HH11 ARG 21 91.416 12.719 0.062 197 HH12 ARG 21 HH12 ARG 21 91.142 11.658 1.404 198 HH21 ARG 21 HH21 ARG 21 88.590 13.550 2.761 199 HH22 ARG 21 HH22 ARG 21 89.562 12.124 2.911 200 H GLN 22 H GLN 22 89.314 19.126 -0.219 201 HA GLN 22 HA GLN 22 91.406 21.029 0.309 202 HB2 GLN 22 HB2 GLN 22 89.199 20.031 2.126 203 HB3 GLN 22 HB3 GLN 22 90.189 21.466 2.383 204 HG2 GLN 22 HG2 GLN 22 88.298 21.010 0.056 205 HG3 GLN 22 HG3 GLN 22 88.006 22.077 1.427 206 HE21 GLN 22 HE21 GLN 22 88.711 22.356 -1.709 207 HE22 GLN 22 HE22 GLN 22 89.781 23.674 -1.688 208 H HIS 23 H HIS 23 92.997 20.944 1.875 209 HA HIS 23 HA HIS 23 93.486 18.297 3.119 210 HB2 HIS 23 HB2 HIS 23 95.516 20.240 2.010 211 HB3 HIS 23 HB3 HIS 23 95.890 18.750 2.855 212 HD1 HIS 23 HD1 HIS 23 94.832 16.515 1.599 213 HD2 HIS 23 HD2 HIS 23 95.357 19.941 -0.717 214 HE1 HIS 23 HE1 HIS 23 94.805 15.757 -0.816 215 H MET 24 H MET 24 94.270 18.286 5.209 216 HA MET 24 HA MET 24 94.324 20.907 6.599 217 HB2 MET 24 HB2 MET 24 93.354 18.228 7.621 218 HB3 MET 24 HB3 MET 24 93.477 19.699 8.587 219 HG2 MET 24 HG2 MET 24 91.952 20.827 6.934 220 HG3 MET 24 HG3 MET 24 91.721 19.262 6.158 221 HE1 MET 24 HE1 MET 24 91.296 21.537 9.043 222 HE2 MET 24 HE2 MET 24 92.031 20.294 10.052 223 HE3 MET 24 HE3 MET 24 90.328 20.695 10.260 224 H ASP 25 H ASP 25 95.825 21.163 8.276 225 HA ASP 25 HA ASP 25 98.330 19.871 7.870 226 HB2 ASP 25 HB2 ASP 25 97.364 21.657 10.115 227 HB3 ASP 25 HB3 ASP 25 99.039 21.166 9.872 228 H SER 26 H SER 26 99.404 18.362 9.104 229 HA SER 26 HA SER 26 97.725 16.816 10.984 230 HB2 SER 26 HB2 SER 26 99.014 14.901 10.411 231 HB3 SER 26 HB3 SER 26 98.672 15.715 8.888 232 HG SER 26 HG SER 26 100.961 15.085 9.657 233 HA PRO 27 HA PRO 27 100.547 17.903 14.207 234 HB2 PRO 27 HB2 PRO 27 100.390 15.816 15.924 235 HB3 PRO 27 HB3 PRO 27 99.031 16.927 15.659 236 HG2 PRO 27 HG2 PRO 27 99.458 14.184 14.619 237 HG3 PRO 27 HG3 PRO 27 97.960 14.984 15.126 238 HD2 PRO 27 HD2 PRO 27 98.769 14.670 12.483 239 HD3 PRO 27 HD3 PRO 27 97.585 15.866 13.051 240 H ASP 28 H ASP 28 102.384 16.844 15.660 241 HA ASP 28 HA ASP 28 104.490 16.115 13.895 242 HB2 ASP 28 HB2 ASP 28 104.328 16.025 16.915 243 HB3 ASP 28 HB3 ASP 28 105.807 15.817 15.982 244 H LEU 29 H LEU 29 105.552 14.169 13.612 245 HA LEU 29 HA LEU 29 103.979 11.785 14.291 246 HB2 LEU 29 HB2 LEU 29 104.666 12.181 11.924 247 HB3 LEU 29 HB3 LEU 29 106.352 12.045 12.429 248 HG LEU 29 HG LEU 29 105.764 9.764 13.385 249 HD11 LEU 29 HD11 LEU 29 103.701 8.757 12.235 250 HD12 LEU 29 HD12 LEU 29 103.212 10.419 11.904 251 HD13 LEU 29 HD13 LEU 29 103.393 9.869 13.569 252 HD21 LEU 29 HD21 LEU 29 105.543 10.354 10.425 253 HD22 LEU 29 HD22 LEU 29 105.638 8.711 11.059 254 HD23 LEU 29 HD23 LEU 29 106.971 9.835 11.319 255 H GLY 30 H GLY 30 104.669 10.267 15.688 256 HA2 GLY 30 HA2 GLY 30 107.001 10.848 17.306 257 HA3 GLY 30 HA3 GLY 30 105.851 9.539 17.557 258 H THR 31 H THR 31 108.168 8.616 17.999 259 HA THR 31 HA THR 31 109.488 7.720 15.543 260 HB THR 31 HB THR 31 110.257 7.207 18.425 261 HG1 THR 31 HG1 THR 31 110.875 9.177 18.326 262 HG21 THR 31 HG21 THR 31 111.752 6.945 15.802 263 HG22 THR 31 HG22 THR 31 111.249 5.624 16.856 264 HG23 THR 31 HG23 THR 31 112.483 6.763 17.396 265 H ASP 32 H ASP 32 109.662 5.577 14.935 266 HA ASP 32 HA ASP 32 107.509 3.857 15.789 267 HB2 ASP 32 HB2 ASP 32 108.272 3.992 13.424 268 HB3 ASP 32 HB3 ASP 32 109.805 3.267 13.906 269 H ASP 33 H ASP 33 107.603 2.550 17.482 270 HA ASP 33 HA ASP 33 109.975 2.076 18.968 271 HB2 ASP 33 HB2 ASP 33 107.287 0.686 19.050 272 HB3 ASP 33 HB3 ASP 33 108.565 0.475 20.243 273 H ASP 34 H ASP 34 111.186 0.190 19.223 274 HA ASP 34 HA ASP 34 111.600 -1.343 16.858 275 HB2 ASP 34 HB2 ASP 34 113.229 -2.594 18.226 276 HB3 ASP 34 HB3 ASP 34 113.442 -0.855 18.368 277 H ASP 35 H ASP 35 111.954 -3.905 17.460 278 HA ASP 35 HA ASP 35 109.364 -4.991 17.365 279 HB2 ASP 35 HB2 ASP 35 110.454 -7.167 17.530 280 HB3 ASP 35 HB3 ASP 35 111.353 -6.118 16.439 281 H LYS 36 H LYS 36 107.974 -5.674 18.877 282 HA LYS 36 HA LYS 36 108.760 -5.349 21.698 283 HB2 LYS 36 HB2 LYS 36 106.041 -5.476 20.376 284 HB3 LYS 36 HB3 LYS 36 106.301 -5.335 22.115 285 HG2 LYS 36 HG2 LYS 36 107.469 -3.221 21.818 286 HG3 LYS 36 HG3 LYS 36 107.367 -3.375 20.063 287 HD2 LYS 36 HD2 LYS 36 105.602 -1.884 20.764 288 HD3 LYS 36 HD3 LYS 36 104.854 -3.412 20.296 289 HE2 LYS 36 HE2 LYS 36 104.462 -4.049 22.528 290 HE3 LYS 36 HE3 LYS 36 105.649 -2.908 23.158 291 HZ1 LYS 36 HZ1 LYS 36 104.223 -1.168 22.974 292 HZ2 LYS 36 HZ2 LYS 36 103.086 -2.405 23.231 293 HZ3 LYS 36 HZ3 LYS 36 103.381 -1.833 21.658 294 H THR 37 H THR 37 108.212 -6.931 23.248 295 HA THR 37 HA THR 37 108.421 -9.646 22.296 296 HB THR 37 HB THR 37 108.459 -10.252 24.660 297 HG1 THR 37 HG1 THR 37 107.490 -8.994 25.978 298 HG21 THR 37 HG21 THR 37 110.508 -9.292 23.595 299 HG22 THR 37 HG22 THR 37 110.432 -9.003 25.333 300 HG23 THR 37 HG23 THR 37 110.037 -7.705 24.206 301 H GLY 38 H GLY 38 106.915 -11.339 23.263 302 HA2 GLY 38 HA2 GLY 38 104.287 -10.875 22.310 303 HA3 GLY 38 HA3 GLY 38 104.811 -12.279 23.239 304 H GLY 39 H GLY 39 102.371 -10.492 23.372 305 HA2 GLY 39 HA2 GLY 39 102.270 -10.288 26.264 306 HA3 GLY 39 HA3 GLY 39 102.163 -8.749 25.416 307 H GLY 40 H GLY 40 100.068 -8.210 25.777 308 HA2 GLY 40 HA2 GLY 40 97.916 -10.113 25.623 309 HA3 GLY 40 HA3 GLY 40 97.759 -8.372 25.834 310 H ARG 41 H ARG 41 95.923 -8.758 24.319 311 HA ARG 41 HA ARG 41 96.155 -9.646 21.704 312 HB2 ARG 41 HB2 ARG 41 94.124 -8.384 21.247 313 HB3 ARG 41 HB3 ARG 41 94.016 -9.153 22.828 314 HG2 ARG 41 HG2 ARG 41 94.784 -6.979 23.851 315 HG3 ARG 41 HG3 ARG 41 94.642 -6.244 22.254 316 HD2 ARG 41 HD2 ARG 41 92.250 -6.966 22.187 317 HD3 ARG 41 HD3 ARG 41 92.416 -7.554 23.838 318 HE ARG 41 HE ARG 41 92.444 -5.344 24.594 319 HH11 ARG 41 HH11 ARG 41 92.582 -5.377 21.086 320 HH12 ARG 41 HH12 ARG 41 92.275 -3.678 20.959 321 HH21 ARG 41 HH21 ARG 41 92.051 -3.160 24.367 322 HH22 ARG 41 HH22 ARG 41 91.978 -2.439 22.793 323 H ALA 42 H ALA 42 96.258 -8.516 19.689 324 HA ALA 42 HA ALA 42 98.489 -6.868 19.403 325 HB1 ALA 42 HB1 ALA 42 97.707 -6.495 17.108 326 HB2 ALA 42 HB2 ALA 42 96.116 -7.124 17.539 327 HB3 ALA 42 HB3 ALA 42 97.522 -8.189 17.563 328 H ASP 43 H ASP 43 98.696 -4.657 18.835 329 HA ASP 43 HA ASP 43 97.333 -2.863 20.477 330 HB2 ASP 43 HB2 ASP 43 98.759 -2.245 17.880 331 HB3 ASP 43 HB3 ASP 43 98.407 -1.101 19.173 332 HA PRO 44 HA PRO 44 93.515 -1.936 18.526 333 HB2 PRO 44 HB2 PRO 44 94.054 0.982 18.574 334 HB3 PRO 44 HB3 PRO 44 92.750 0.059 19.342 335 HG2 PRO 44 HG2 PRO 44 94.750 1.106 20.755 336 HG3 PRO 44 HG3 PRO 44 94.004 -0.445 21.188 337 HD2 PRO 44 HD2 PRO 44 96.633 0.063 19.844 338 HD3 PRO 44 HD3 PRO 44 96.193 -1.188 21.027 339 H ALA 45 H ALA 45 92.474 -0.700 16.663 340 HA ALA 45 HA ALA 45 93.937 -1.172 14.285 341 HB1 ALA 45 HB1 ALA 45 91.576 -1.344 14.144 342 HB2 ALA 45 HB2 ALA 45 91.990 0.103 13.225 343 HB3 ALA 45 HB3 ALA 45 91.339 0.251 14.857 344 H HIS 46 H HIS 46 94.661 0.313 12.703 345 HA HIS 46 HA HIS 46 95.307 3.014 13.742 346 HB2 HIS 46 HB2 HIS 46 96.955 1.265 11.912 347 HB3 HIS 46 HB3 HIS 46 97.365 2.895 12.406 348 HD1 HIS 46 HD1 HIS 46 97.587 3.146 15.166 349 HD2 HIS 46 HD2 HIS 46 98.041 -0.665 13.539 350 HE1 HIS 46 HE1 HIS 46 98.774 1.758 16.918 351 H ARG 47 H ARG 47 95.409 4.706 12.183 352 HA ARG 47 HA ARG 47 93.284 4.761 10.371 353 HB2 ARG 47 HB2 ARG 47 95.785 6.465 10.437 354 HB3 ARG 47 HB3 ARG 47 94.332 6.839 9.507 355 HG2 ARG 47 HG2 ARG 47 93.013 6.815 11.621 356 HG3 ARG 47 HG3 ARG 47 94.509 6.557 12.521 357 HD2 ARG 47 HD2 ARG 47 95.404 8.671 11.480 358 HD3 ARG 47 HD3 ARG 47 93.798 8.953 10.813 359 HE ARG 47 HE ARG 47 93.305 8.591 13.461 360 HH11 ARG 47 HH11 ARG 47 95.534 10.701 11.756 361 HH12 ARG 47 HH12 ARG 47 95.488 11.913 12.993 362 HH21 ARG 47 HH21 ARG 47 93.286 10.186 15.018 363 HH22 ARG 47 HH22 ARG 47 94.231 11.624 14.817 364 H SER 48 H SER 48 93.139 4.598 8.146 365 HA SER 48 HA SER 48 94.883 2.694 6.913 366 HB2 SER 48 HB2 SER 48 92.886 4.395 5.437 367 HB3 SER 48 HB3 SER 48 93.399 2.748 5.091 368 HG SER 48 HG SER 48 91.630 3.684 6.963 369 HA PRO 49 HA PRO 49 98.010 5.096 4.933 370 HB2 PRO 49 HB2 PRO 49 96.956 4.226 2.274 371 HB3 PRO 49 HB3 PRO 49 98.613 4.167 2.906 372 HG2 PRO 49 HG2 PRO 49 97.111 1.980 2.752 373 HG3 PRO 49 HG3 PRO 49 98.240 2.242 4.093 374 HD2 PRO 49 HD2 PRO 49 95.269 2.398 4.091 375 HD3 PRO 49 HD3 PRO 49 96.379 1.984 5.415 376 H VAL 50 H VAL 50 98.205 7.202 4.294 377 HA VAL 50 HA VAL 50 95.731 8.611 3.648 378 HB VAL 50 HB VAL 50 98.506 9.657 4.279 379 HG11 VAL 50 HG11 VAL 50 97.427 11.822 4.561 380 HG12 VAL 50 HG12 VAL 50 95.851 11.118 4.199 381 HG13 VAL 50 HG13 VAL 50 97.082 11.217 2.941 382 HG21 VAL 50 HG21 VAL 50 97.306 8.398 6.117 383 HG22 VAL 50 HG22 VAL 50 96.026 9.607 6.019 384 HG23 VAL 50 HG23 VAL 50 97.655 10.085 6.496 385 HA PRO 51 HA PRO 51 96.700 8.822 -0.745 386 HB2 PRO 51 HB2 PRO 51 95.848 11.680 -0.586 387 HB3 PRO 51 HB3 PRO 51 95.318 10.406 -1.701 388 HG2 PRO 51 HG2 PRO 51 93.773 11.219 0.300 389 HG3 PRO 51 HG3 PRO 51 93.827 9.519 -0.202 390 HD2 PRO 51 HD2 PRO 51 95.011 10.800 2.216 391 HD3 PRO 51 HD3 PRO 51 94.390 9.150 2.001 392 H LEU 52 H LEU 52 98.299 9.765 -2.147 393 HA LEU 52 HA LEU 52 100.673 10.485 -0.804 394 HB2 LEU 52 HB2 LEU 52 99.935 10.693 -3.732 395 HB3 LEU 52 HB3 LEU 52 101.565 10.913 -3.098 396 HG LEU 52 HG LEU 52 99.921 8.409 -2.651 397 HD11 LEU 52 HD11 LEU 52 101.745 7.526 -4.325 398 HD12 LEU 52 HD12 LEU 52 101.826 9.213 -4.835 399 HD13 LEU 52 HD13 LEU 52 100.306 8.326 -4.956 400 HD21 LEU 52 HD21 LEU 52 102.755 9.270 -2.074 401 HD22 LEU 52 HD22 LEU 52 102.350 7.563 -2.247 402 HD23 LEU 52 HD23 LEU 52 101.587 8.525 -0.983 403 HA PRO 53 HA PRO 53 100.259 14.929 -0.490 404 HB2 PRO 53 HB2 PRO 53 103.088 15.214 -1.343 405 HB3 PRO 53 HB3 PRO 53 102.302 15.736 0.158 406 HG2 PRO 53 HG2 PRO 53 103.989 13.671 0.088 407 HG3 PRO 53 HG3 PRO 53 102.589 13.713 1.176 408 HD2 PRO 53 HD2 PRO 53 102.939 12.184 -1.375 409 HD3 PRO 53 HD3 PRO 53 102.090 11.719 0.116 410 H SER 54 H SER 54 99.950 16.730 -1.852 411 HA SER 54 HA SER 54 99.278 16.188 -4.487 412 HB2 SER 54 HB2 SER 54 99.248 18.707 -4.756 413 HB3 SER 54 HB3 SER 54 98.310 18.084 -3.404 414 HG SER 54 HG SER 54 99.551 19.327 -2.279 415 HA PRO 55 HA PRO 55 103.367 16.041 -6.085 416 HB2 PRO 55 HB2 PRO 55 102.927 15.740 -8.731 417 HB3 PRO 55 HB3 PRO 55 102.486 14.487 -7.552 418 HG2 PRO 55 HG2 PRO 55 100.764 16.429 -8.974 419 HG3 PRO 55 HG3 PRO 55 100.422 14.766 -8.466 420 HD2 PRO 55 HD2 PRO 55 99.597 17.084 -7.117 421 HD3 PRO 55 HD3 PRO 55 99.606 15.439 -6.448 422 H THR 56 H THR 56 104.694 17.772 -6.038 423 HA THR 56 HA THR 56 104.285 20.061 -7.784 424 HB THR 56 HB THR 56 106.446 20.827 -6.943 425 HG1 THR 56 HG1 THR 56 107.793 19.412 -6.269 426 HG21 THR 56 HG21 THR 56 105.904 21.040 -4.613 427 HG22 THR 56 HG22 THR 56 104.943 19.561 -4.643 428 HG23 THR 56 HG23 THR 56 104.376 20.998 -5.493 429 H SER 57 H SER 57 105.920 20.569 -9.515 430 HA SER 57 HA SER 57 105.926 18.449 -11.350 431 HB2 SER 57 HB2 SER 57 107.115 19.891 -12.814 432 HB3 SER 57 HB3 SER 57 106.112 20.947 -11.826 433 HG SER 57 HG SER 57 108.833 20.545 -11.772 434 H ASN 58 H ASN 58 107.137 16.711 -11.501 435 HA ASN 58 HA ASN 58 108.939 15.313 -11.542 436 HB2 ASN 58 HB2 ASN 58 110.524 17.870 -11.255 437 HB3 ASN 58 HB3 ASN 58 111.172 16.301 -11.733 438 HD21 ASN 58 HD21 ASN 58 110.751 19.017 -13.232 439 HD22 ASN 58 HD22 ASN 58 110.008 18.539 -14.681 440 H LYS 59 H LYS 59 107.739 16.260 -8.843 441 HA LYS 59 HA LYS 59 109.720 14.916 -7.211 442 HB2 LYS 59 HB2 LYS 59 110.554 17.257 -7.313 443 HB3 LYS 59 HB3 LYS 59 109.037 17.795 -6.591 444 HG2 LYS 59 HG2 LYS 59 109.479 16.324 -4.632 445 HG3 LYS 59 HG3 LYS 59 111.035 15.887 -5.341 446 HD2 LYS 59 HD2 LYS 59 111.647 18.319 -5.358 447 HD3 LYS 59 HD3 LYS 59 110.149 18.657 -4.489 448 HE2 LYS 59 HE2 LYS 59 110.852 17.340 -2.602 449 HE3 LYS 59 HE3 LYS 59 112.241 16.711 -3.487 450 HZ1 LYS 59 HZ1 LYS 59 111.920 19.613 -3.108 451 HZ2 LYS 59 HZ2 LYS 59 113.338 18.715 -3.368 452 HZ3 LYS 59 HZ3 LYS 59 112.562 18.664 -1.858 453 H GLN 60 H GLN 60 108.880 14.037 -5.371 454 HA GLN 60 HA GLN 60 106.413 15.099 -4.232 455 HB2 GLN 60 HB2 GLN 60 106.659 12.229 -5.147 456 HB3 GLN 60 HB3 GLN 60 105.432 12.797 -4.016 457 HG2 GLN 60 HG2 GLN 60 104.716 14.469 -5.754 458 HG3 GLN 60 HG3 GLN 60 105.835 13.692 -6.875 459 HE21 GLN 60 HE21 GLN 60 102.730 13.294 -5.194 460 HE22 GLN 60 HE22 GLN 60 102.292 11.875 -6.015 461 H ASP 61 H ASP 61 106.117 14.568 -2.043 462 HA ASP 61 HA ASP 61 108.458 13.450 -0.684 463 HB2 ASP 61 HB2 ASP 61 105.914 14.690 0.396 464 HB3 ASP 61 HB3 ASP 61 107.266 14.141 1.382 465 H ILE 62 H ILE 62 108.524 11.374 0.028 466 HA ILE 62 HA ILE 62 105.979 9.853 0.079 467 HB ILE 62 HB ILE 62 107.330 9.472 -1.994 468 HG12 ILE 62 HG12 ILE 62 107.347 6.910 -1.655 469 HG13 ILE 62 HG13 ILE 62 106.745 7.262 -0.035 470 HG21 ILE 62 HG21 ILE 62 109.354 8.017 -1.756 471 HG22 ILE 62 HG22 ILE 62 109.319 8.325 -0.020 472 HG23 ILE 62 HG23 ILE 62 109.585 9.657 -1.146 473 HD11 ILE 62 HD11 ILE 62 105.055 6.888 -2.047 474 HD12 ILE 62 HD12 ILE 62 105.405 8.583 -2.373 475 HD13 ILE 62 HD13 ILE 62 104.729 8.106 -0.815 476 H SER 63 H SER 63 105.839 8.162 1.632 477 HA SER 63 HA SER 63 108.020 7.931 3.553 478 HB2 SER 63 HB2 SER 63 106.795 8.749 5.443 479 HB3 SER 63 HB3 SER 63 106.737 9.989 4.195 480 HG SER 63 HG SER 63 104.749 8.543 5.268 481 H GLU 64 H GLU 64 107.618 6.380 5.249 482 HA GLU 64 HA GLU 64 106.634 3.950 4.357 483 HB2 GLU 64 HB2 GLU 64 106.833 3.208 6.693 484 HB3 GLU 64 HB3 GLU 64 108.227 4.166 6.200 485 HG2 GLU 64 HG2 GLU 64 107.180 6.169 7.236 486 HG3 GLU 64 HG3 GLU 64 105.863 5.155 7.812 487 H ALA 65 H ALA 65 104.960 6.521 6.108 488 HA ALA 65 HA ALA 65 102.785 5.041 7.077 489 HB1 ALA 65 HB1 ALA 65 103.221 7.925 6.399 490 HB2 ALA 65 HB2 ALA 65 102.889 7.181 7.962 491 HB3 ALA 65 HB3 ALA 65 101.592 7.368 6.782 492 H ASN 66 H ASN 66 103.256 6.653 3.945 493 HA ASN 66 HA ASN 66 100.567 6.213 3.067 494 HB2 ASN 66 HB2 ASN 66 102.969 6.722 1.304 495 HB3 ASN 66 HB3 ASN 66 101.274 7.041 0.945 496 HD21 ASN 66 HD21 ASN 66 100.242 8.875 2.073 497 HD22 ASN 66 HD22 ASN 66 101.191 10.101 2.764 498 H LEU 67 H LEU 67 103.671 4.609 2.383 499 HA LEU 67 HA LEU 67 102.521 2.772 0.521 500 HB2 LEU 67 HB2 LEU 67 105.199 3.004 1.854 501 HB3 LEU 67 HB3 LEU 67 104.790 1.571 0.909 502 HG LEU 67 HG LEU 67 104.067 3.205 -0.939 503 HD11 LEU 67 HD11 LEU 67 105.397 5.031 1.033 504 HD12 LEU 67 HD12 LEU 67 103.947 5.301 0.066 505 HD13 LEU 67 HD13 LEU 67 105.538 5.367 -0.690 506 HD21 LEU 67 HD21 LEU 67 107.009 3.498 -0.450 507 HD22 LEU 67 HD22 LEU 67 106.156 3.026 -1.916 508 HD23 LEU 67 HD23 LEU 67 106.353 1.868 -0.602 509 H ALA 68 H ALA 68 102.892 2.679 3.988 510 HA ALA 68 HA ALA 68 102.207 1.157 5.544 511 HB1 ALA 68 HB1 ALA 68 100.345 0.864 3.591 512 HB2 ALA 68 HB2 ALA 68 100.344 -0.070 5.087 513 HB3 ALA 68 HB3 ALA 68 101.030 -0.761 3.618 514 H TYR 69 H TYR 69 102.145 -1.872 4.816 515 HA TYR 69 HA TYR 69 104.737 -2.433 5.697 516 HB2 TYR 69 HB2 TYR 69 102.811 -4.182 4.173 517 HB3 TYR 69 HB3 TYR 69 104.256 -4.756 4.983 518 HD1 TYR 69 HD1 TYR 69 104.429 -4.554 7.491 519 HD2 TYR 69 HD2 TYR 69 100.790 -3.767 5.351 520 HE1 TYR 69 HE1 TYR 69 103.140 -4.783 9.598 521 HE2 TYR 69 HE2 TYR 69 99.500 -3.996 7.457 522 HH TYR 69 HH TYR 69 99.702 -4.844 9.628 523 H LEU 70 H LEU 70 103.644 -1.702 2.498 524 HA LEU 70 HA LEU 70 105.517 -3.103 0.938 525 HB2 LEU 70 HB2 LEU 70 104.279 -0.397 0.391 526 HB3 LEU 70 HB3 LEU 70 105.038 -1.448 -0.803 527 HG LEU 70 HG LEU 70 102.628 -2.209 0.876 528 HD11 LEU 70 HD11 LEU 70 102.863 -1.315 -2.013 529 HD12 LEU 70 HD12 LEU 70 102.029 -0.461 -0.716 530 HD13 LEU 70 HD13 LEU 70 101.406 -2.004 -1.298 531 HD21 LEU 70 HD21 LEU 70 102.548 -3.976 -1.053 532 HD22 LEU 70 HD22 LEU 70 103.681 -4.223 0.275 533 HD23 LEU 70 HD23 LEU 70 104.252 -3.575 -1.263 534 H TRP 71 H TRP 71 105.951 -0.290 2.944 535 HA TRP 71 HA TRP 71 108.037 1.031 1.678 536 HB2 TRP 71 HB2 TRP 71 106.735 1.683 3.758 537 HB3 TRP 71 HB3 TRP 71 107.832 0.647 4.651 538 HD1 TRP 71 HD1 TRP 71 109.865 1.810 5.591 539 HE1 TRP 71 HE1 TRP 71 111.120 4.006 5.110 540 HE3 TRP 71 HE3 TRP 71 107.312 3.414 1.473 541 HZ2 TRP 71 HZ2 TRP 71 111.074 6.157 3.213 542 HZ3 TRP 71 HZ3 TRP 71 107.937 5.528 0.349 543 HH2 TRP 71 HH2 TRP 71 109.811 6.901 1.211 544 HA PRO 72 HA PRO 72 110.917 -2.440 2.419 545 HB2 PRO 72 HB2 PRO 72 112.607 -2.087 0.376 546 HB3 PRO 72 HB3 PRO 72 110.937 -2.628 0.101 547 HG2 PRO 72 HG2 PRO 72 112.146 0.045 -0.314 548 HG3 PRO 72 HG3 PRO 72 110.888 -0.787 -1.245 549 HD2 PRO 72 HD2 PRO 72 110.463 1.182 0.728 550 HD3 PRO 72 HD3 PRO 72 109.228 0.121 0.019 551 H LEU 73 H LEU 73 111.670 0.915 2.606 552 HA LEU 73 HA LEU 73 114.517 0.491 3.124 553 HB2 LEU 73 HB2 LEU 73 112.906 3.048 3.188 554 HB3 LEU 73 HB3 LEU 73 114.661 2.911 3.230 555 HG LEU 73 HG LEU 73 112.909 1.956 0.950 556 HD11 LEU 73 HD11 LEU 73 113.625 3.913 -0.232 557 HD12 LEU 73 HD12 LEU 73 114.809 4.311 1.014 558 HD13 LEU 73 HD13 LEU 73 113.084 4.469 1.355 559 HD21 LEU 73 HD21 LEU 73 114.954 0.656 1.078 560 HD22 LEU 73 HD22 LEU 73 115.917 2.108 1.349 561 HD23 LEU 73 HD23 LEU 73 115.152 1.835 -0.217 562 H THR 74 H THR 74 115.541 0.830 5.023 563 HA THR 74 HA THR 74 114.131 0.518 7.472 564 HB THR 74 HB THR 74 116.325 0.806 8.526 565 HG1 THR 74 HG1 THR 74 117.670 2.005 7.519 566 HG21 THR 74 HG21 THR 74 115.828 -1.370 7.535 567 HG22 THR 74 HG22 THR 74 117.534 -0.990 7.297 568 HG23 THR 74 HG23 THR 74 116.395 -0.809 5.961 569 H VAL 75 H VAL 75 115.565 3.319 5.798 570 HA VAL 75 HA VAL 75 115.047 5.176 7.901 571 HB VAL 75 HB VAL 75 115.228 6.920 6.144 572 HG11 VAL 75 HG11 VAL 75 117.307 4.714 6.064 573 HG12 VAL 75 HG12 VAL 75 117.263 6.076 7.184 574 HG13 VAL 75 HG13 VAL 75 117.567 6.354 5.469 575 HG21 VAL 75 HG21 VAL 75 114.164 5.726 4.283 576 HG22 VAL 75 HG22 VAL 75 115.461 4.531 4.287 577 HG23 VAL 75 HG23 VAL 75 115.801 6.198 3.834 578 H ASP 76 H ASP 76 113.178 6.216 8.446 579 HA ASP 76 HA ASP 76 110.824 4.807 7.798 580 HB2 ASP 76 HB2 ASP 76 111.195 7.464 9.198 581 HB3 ASP 76 HB3 ASP 76 109.670 6.586 9.122 582 H HIS 77 H HIS 77 112.155 7.804 6.495 583 HA HIS 77 HA HIS 77 110.129 7.668 4.398 584 HB2 HIS 77 HB2 HIS 77 109.608 10.088 4.624 585 HB3 HIS 77 HB3 HIS 77 109.013 9.102 5.945 586 HD1 HIS 77 HD1 HIS 77 111.051 9.015 7.996 587 HD2 HIS 77 HD2 HIS 77 110.659 12.407 5.603 588 HE1 HIS 77 HE1 HIS 77 112.117 10.921 9.276 589 H GLY 78 H GLY 78 110.572 9.463 2.748 590 HA2 GLY 78 HA2 GLY 78 113.129 10.711 2.660 591 HA3 GLY 78 HA3 GLY 78 113.078 9.280 1.633 592 H THR 79 H THR 79 113.430 11.850 0.597 593 HA THR 79 HA THR 79 110.833 12.437 -0.697 594 HB THR 79 HB THR 79 113.278 14.199 -0.832 595 HG1 THR 79 HG1 THR 79 112.794 14.916 1.083 596 HG21 THR 79 HG21 THR 79 111.613 14.890 -2.354 597 HG22 THR 79 HG22 THR 79 111.278 15.874 -0.928 598 HG23 THR 79 HG23 THR 79 110.302 14.440 -1.261 599 H ILE 80 H ILE 80 110.622 12.241 -2.883 600 HA ILE 80 HA ILE 80 112.931 11.082 -4.326 601 HB ILE 80 HB ILE 80 111.203 10.161 -5.885 602 HG12 ILE 80 HG12 ILE 80 109.213 10.905 -3.723 603 HG13 ILE 80 HG13 ILE 80 109.417 11.865 -5.184 604 HG21 ILE 80 HG21 ILE 80 110.266 8.553 -4.034 605 HG22 ILE 80 HG22 ILE 80 111.342 9.456 -2.969 606 HG23 ILE 80 HG23 ILE 80 111.998 8.590 -4.357 607 HD11 ILE 80 HD11 ILE 80 108.299 9.113 -4.874 608 HD12 ILE 80 HD12 ILE 80 109.130 9.516 -6.377 609 HD13 ILE 80 HD13 ILE 80 107.724 10.455 -5.869 610 H GLU 81 H GLU 81 113.709 12.072 -6.118 611 HA GLU 81 HA GLU 81 112.164 14.243 -7.322 612 HB2 GLU 81 HB2 GLU 81 113.424 15.239 -5.411 613 HB3 GLU 81 HB3 GLU 81 114.922 14.733 -6.189 614 HG2 GLU 81 HG2 GLU 81 114.287 16.048 -8.204 615 HG3 GLU 81 HG3 GLU 81 112.849 16.605 -7.361 616 H CYS 82 H CYS 82 112.613 14.628 -9.401 617 HA CYS 82 HA CYS 82 114.880 13.211 -10.647 618 HB2 CYS 82 HB2 CYS 82 112.413 14.529 -11.814 619 HB3 CYS 82 HB3 CYS 82 113.732 13.889 -12.793 620 H LEU 83 H LEU 83 116.686 14.362 -11.027 621 HA LEU 83 HA LEU 83 116.603 17.219 -10.436 622 HB2 LEU 83 HB2 LEU 83 118.791 15.178 -10.687 623 HB3 LEU 83 HB3 LEU 83 119.166 16.902 -10.700 624 HG LEU 83 HG LEU 83 117.426 15.687 -8.555 625 HD11 LEU 83 HD11 LEU 83 119.525 14.457 -8.474 626 HD12 LEU 83 HD12 LEU 83 119.500 15.623 -7.151 627 HD13 LEU 83 HD13 LEU 83 120.446 15.956 -8.602 628 HD21 LEU 83 HD21 LEU 83 118.407 17.695 -7.319 629 HD22 LEU 83 HD22 LEU 83 117.314 18.078 -8.648 630 HD23 LEU 83 HD23 LEU 83 119.058 18.218 -8.872 631 HA PRO 84 HA PRO 84 116.962 18.770 -14.560 632 HB2 PRO 84 HB2 PRO 84 119.205 20.435 -14.384 633 HB3 PRO 84 HB3 PRO 84 117.540 20.889 -13.986 634 HG2 PRO 84 HG2 PRO 84 119.752 20.070 -12.190 635 HG3 PRO 84 HG3 PRO 84 118.476 21.276 -11.944 636 HD2 PRO 84 HD2 PRO 84 118.361 18.862 -10.748 637 HD3 PRO 84 HD3 PRO 84 116.892 19.685 -11.321 638 H SER 85 H SER 85 119.565 17.025 -13.127 639 HA SER 85 HA SER 85 121.238 16.905 -15.471 640 HB2 SER 85 HB2 SER 85 121.235 15.314 -12.904 641 HB3 SER 85 HB3 SER 85 122.442 15.146 -14.174 642 HG SER 85 HG SER 85 123.233 16.683 -12.894 643 H ASP 86 H ASP 86 118.264 15.568 -15.011 644 HA ASP 86 HA ASP 86 117.100 13.899 -16.028 645 HB2 ASP 86 HB2 ASP 86 119.573 13.664 -17.764 646 HB3 ASP 86 HB3 ASP 86 118.016 12.915 -18.091 647 H ASN 87 H ASN 87 118.404 13.334 -13.672 648 HA ASN 87 HA ASN 87 118.712 10.415 -13.972 649 HB2 ASN 87 HB2 ASN 87 120.423 10.401 -12.224 650 HB3 ASN 87 HB3 ASN 87 120.950 11.378 -13.590 651 HD21 ASN 87 HD21 ASN 87 121.915 11.674 -10.828 652 HD22 ASN 87 HD22 ASN 87 121.475 13.234 -10.324 653 H ALA 88 H ALA 88 117.689 9.215 -12.380 654 HA ALA 88 HA ALA 88 115.858 10.748 -10.654 655 HB1 ALA 88 HB1 ALA 88 115.197 8.820 -12.346 656 HB2 ALA 88 HB2 ALA 88 114.378 8.984 -10.793 657 HB3 ALA 88 HB3 ALA 88 115.657 7.787 -10.993 658 H VAL 89 H VAL 89 116.284 10.916 -8.540 659 HA VAL 89 HA VAL 89 117.912 8.807 -7.253 660 HB VAL 89 HB VAL 89 119.150 10.558 -6.026 661 HG11 VAL 89 HG11 VAL 89 120.387 11.449 -8.109 662 HG12 VAL 89 HG12 VAL 89 119.220 10.514 -9.044 663 HG13 VAL 89 HG13 VAL 89 120.298 9.700 -7.910 664 HG21 VAL 89 HG21 VAL 89 117.693 12.425 -7.928 665 HG22 VAL 89 HG22 VAL 89 119.016 12.895 -6.859 666 HG23 VAL 89 HG23 VAL 89 117.480 12.357 -6.178 667 H PHE 90 H PHE 90 117.773 8.742 -4.984 668 HA PHE 90 HA PHE 90 115.220 9.717 -3.856 669 HB2 PHE 90 HB2 PHE 90 115.304 7.299 -4.094 670 HB3 PHE 90 HB3 PHE 90 116.862 7.244 -3.302 671 HD1 PHE 90 HD1 PHE 90 113.265 8.085 -2.748 672 HD2 PHE 90 HD2 PHE 90 117.014 6.962 -0.981 673 HE1 PHE 90 HE1 PHE 90 112.129 7.720 -0.562 674 HE2 PHE 90 HE2 PHE 90 115.881 6.584 1.192 675 HZ PHE 90 HZ PHE 90 113.437 6.964 1.398 676 H VAL 91 H VAL 91 115.390 11.066 -2.138 677 HA VAL 91 HA VAL 91 118.036 11.381 -0.854 678 HB VAL 91 HB VAL 91 115.688 13.296 -0.952 679 HG11 VAL 91 HG11 VAL 91 116.959 14.839 0.223 680 HG12 VAL 91 HG12 VAL 91 118.490 14.078 -0.204 681 HG13 VAL 91 HG13 VAL 91 117.459 13.354 1.025 682 HG21 VAL 91 HG21 VAL 91 117.275 14.614 -2.428 683 HG22 VAL 91 HG22 VAL 91 116.638 13.137 -3.151 684 HG23 VAL 91 HG23 VAL 91 118.280 13.167 -2.509 685 H ALA 92 H ALA 92 118.246 10.860 1.256 686 HA ALA 92 HA ALA 92 115.797 10.074 2.715 687 HB1 ALA 92 HB1 ALA 92 118.723 9.429 3.068 688 HB2 ALA 92 HB2 ALA 92 117.382 8.323 2.776 689 HB3 ALA 92 HB3 ALA 92 117.547 9.113 4.344 690 HA PRO 93 HA PRO 93 115.724 13.530 5.469 691 HB2 PRO 93 HB2 PRO 93 116.019 11.659 7.774 692 HB3 PRO 93 HB3 PRO 93 114.797 12.910 7.484 693 HG2 PRO 93 HG2 PRO 93 114.296 10.293 7.177 694 HG3 PRO 93 HG3 PRO 93 113.506 11.547 6.211 695 HD2 PRO 93 HD2 PRO 93 115.560 9.587 5.385 696 HD3 PRO 93 HD3 PRO 93 114.381 10.478 4.403 697 H ASP 94 H ASP 94 118.235 11.128 5.850 698 HA ASP 94 HA ASP 94 119.854 12.513 7.711 699 HB2 ASP 94 HB2 ASP 94 121.665 11.003 6.866 700 HB3 ASP 94 HB3 ASP 94 120.203 10.179 7.391 701 H GLY 95 H GLY 95 119.216 13.271 4.444 702 HA2 GLY 95 HA2 GLY 95 120.018 15.181 3.314 703 HA3 GLY 95 HA3 GLY 95 121.371 15.250 4.438 704 H THR 96 H THR 96 120.923 12.106 3.244 705 HA THR 96 HA THR 96 123.239 12.389 1.458 706 HB THR 96 HB THR 96 121.930 9.910 2.612 707 HG1 THR 96 HG1 THR 96 122.960 11.280 4.122 708 HG21 THR 96 HG21 THR 96 123.117 9.097 0.804 709 HG22 THR 96 HG22 THR 96 124.393 9.106 2.021 710 HG23 THR 96 HG23 THR 96 124.291 10.413 0.841 711 H THR 97 H THR 97 123.088 11.886 -0.697 712 HA THR 97 HA THR 97 120.382 11.273 -1.716 713 HB THR 97 HB THR 97 122.800 12.302 -3.228 714 HG1 THR 97 HG1 THR 97 121.989 13.782 -1.736 715 HG21 THR 97 HG21 THR 97 121.002 12.917 -4.890 716 HG22 THR 97 HG22 THR 97 119.871 11.974 -3.921 717 HG23 THR 97 HG23 THR 97 121.245 11.182 -4.692 718 H TYR 98 H TYR 98 119.968 9.386 -2.577 719 HA TYR 98 HA TYR 98 122.180 7.543 -3.237 720 HB2 TYR 98 HB2 TYR 98 119.341 6.930 -2.406 721 HB3 TYR 98 HB3 TYR 98 120.570 5.739 -2.782 722 HD1 TYR 98 HD2 TYR 98 122.418 5.307 -1.202 723 HD2 TYR 98 HD1 TYR 98 119.308 8.132 -0.306 724 HE1 TYR 98 HE2 TYR 98 123.089 5.294 1.186 725 HE2 TYR 98 HE1 TYR 98 119.991 8.131 2.075 726 HH TYR 98 HH TYR 98 121.556 7.399 3.532 727 H ALA 99 H ALA 99 121.939 6.305 -5.167 728 HA ALA 99 HA ALA 99 120.368 7.638 -7.225 729 HB1 ALA 99 HB1 ALA 99 122.487 5.491 -7.244 730 HB2 ALA 99 HB2 ALA 99 122.567 7.115 -7.927 731 HB3 ALA 99 HB3 ALA 99 121.558 5.885 -8.690 732 H LEU 100 H LEU 100 118.443 6.938 -7.938 733 HA LEU 100 HA LEU 100 117.320 4.491 -6.841 734 HB2 LEU 100 HB2 LEU 100 116.253 6.755 -8.509 735 HB3 LEU 100 HB3 LEU 100 115.345 5.256 -8.351 736 HG LEU 100 HG LEU 100 116.375 6.692 -5.911 737 HD11 LEU 100 HD11 LEU 100 114.191 7.836 -5.787 738 HD12 LEU 100 HD12 LEU 100 113.734 7.128 -7.335 739 HD13 LEU 100 HD13 LEU 100 115.046 8.301 -7.259 740 HD21 LEU 100 HD21 LEU 100 114.676 5.423 -4.799 741 HD22 LEU 100 HD22 LEU 100 115.451 4.295 -5.909 742 HD23 LEU 100 HD23 LEU 100 113.893 5.006 -6.322 743 H ASN 101 H ASN 101 117.952 5.871 -10.054 744 HA ASN 101 HA ASN 101 117.672 3.147 -11.202 745 HB2 ASN 101 HB2 ASN 101 117.125 4.209 -13.305 746 HB3 ASN 101 HB3 ASN 101 116.068 4.817 -12.037 747 HD21 ASN 101 HD21 ASN 101 115.930 6.597 -13.868 748 HD22 ASN 101 HD22 ASN 101 117.030 7.882 -13.722 749 H ASP 102 H ASP 102 118.962 2.778 -13.207 750 HA ASP 102 HA ASP 102 121.650 2.634 -12.563 751 HB2 ASP 102 HB2 ASP 102 120.475 1.282 -14.305 752 HB3 ASP 102 HB3 ASP 102 120.521 2.689 -15.366 753 H ARG 103 H ARG 103 119.936 5.224 -14.218 754 HA ARG 103 HA ARG 103 122.155 6.458 -15.456 755 HB2 ARG 103 HB2 ARG 103 119.512 7.579 -14.496 756 HB3 ARG 103 HB3 ARG 103 120.648 8.445 -15.537 757 HG2 ARG 103 HG2 ARG 103 120.475 6.720 -17.245 758 HG3 ARG 103 HG3 ARG 103 119.447 5.741 -16.199 759 HD2 ARG 103 HD2 ARG 103 118.042 6.928 -17.789 760 HD3 ARG 103 HD3 ARG 103 117.775 7.593 -16.179 761 HE ARG 103 HE ARG 103 118.804 9.570 -16.856 762 HH11 ARG 103 HH11 ARG 103 119.189 7.166 -19.380 763 HH12 ARG 103 HH12 ARG 103 119.782 8.325 -20.522 764 HH21 ARG 103 HH21 ARG 103 119.558 10.991 -18.319 765 HH22 ARG 103 HH22 ARG 103 119.992 10.495 -19.925 766 H ALA 104 H ALA 104 120.525 7.164 -12.363 767 HA ALA 104 HA ALA 104 122.281 9.161 -11.478 768 HB1 ALA 104 HB1 ALA 104 120.552 7.190 -9.989 769 HB2 ALA 104 HB2 ALA 104 120.238 8.895 -10.307 770 HB3 ALA 104 HB3 ALA 104 121.497 8.429 -9.164 771 H GLU 105 H GLU 105 122.508 5.630 -11.219 772 HA GLU 105 HA GLU 105 124.776 5.524 -9.547 773 HB2 GLU 105 HB2 GLU 105 123.913 3.623 -11.742 774 HB3 GLU 105 HB3 GLU 105 125.147 3.276 -10.532 775 HG2 GLU 105 HG2 GLU 105 123.465 3.662 -8.743 776 HG3 GLU 105 HG3 GLU 105 122.238 3.914 -9.977 777 H LYS 106 H LYS 106 124.489 5.756 -13.081 778 HA LYS 106 HA LYS 106 127.215 5.719 -13.727 779 HB2 LYS 106 HB2 LYS 106 125.352 5.619 -15.373 780 HB3 LYS 106 HB3 LYS 106 125.044 7.331 -15.086 781 HG2 LYS 106 HG2 LYS 106 127.291 7.904 -15.851 782 HG3 LYS 106 HG3 LYS 106 127.685 6.196 -16.052 783 HD2 LYS 106 HD2 LYS 106 127.099 7.074 -18.227 784 HD3 LYS 106 HD3 LYS 106 125.782 6.028 -17.695 785 HE2 LYS 106 HE2 LYS 106 124.369 7.836 -17.206 786 HE3 LYS 106 HE3 LYS 106 125.710 8.976 -17.096 787 HZ1 LYS 106 HZ1 LYS 106 126.006 8.926 -19.423 788 HZ2 LYS 106 HZ2 LYS 106 124.339 9.124 -19.165 789 HZ3 LYS 106 HZ3 LYS 106 124.956 7.606 -19.612 790 H ALA 107 H ALA 107 125.177 8.329 -12.539 791 HA ALA 107 HA ALA 107 127.076 10.430 -12.881 792 HB1 ALA 107 HB1 ALA 107 124.960 10.524 -10.772 793 HB2 ALA 107 HB2 ALA 107 124.489 10.505 -12.471 794 HB3 ALA 107 HB3 ALA 107 125.523 11.796 -11.855 795 H GLY 108 H GLY 108 127.416 7.812 -10.922 796 HA2 GLY 108 HA2 GLY 108 128.922 7.369 -9.276 797 HA3 GLY 108 HA3 GLY 108 129.437 9.042 -9.341 798 H HIS 109 H HIS 109 126.052 8.373 -8.721 799 HA HIS 109 HA HIS 109 126.370 9.199 -5.948 800 HB2 HIS 109 HB2 HIS 109 124.026 8.691 -7.752 801 HB3 HIS 109 HB3 HIS 109 123.798 8.785 -6.016 802 HD1 HIS 109 HD1 HIS 109 124.633 11.122 -4.896 803 HD2 HIS 109 HD2 HIS 109 124.101 11.141 -9.031 804 HE1 HIS 109 HE1 HIS 109 124.495 13.553 -5.589 805 HA PRO 110 HA PRO 110 126.484 4.953 -4.618 806 HB2 PRO 110 HB2 PRO 110 125.733 5.146 -2.005 807 HB3 PRO 110 HB3 PRO 110 127.318 5.692 -2.590 808 HG2 PRO 110 HG2 PRO 110 124.892 7.280 -1.946 809 HG3 PRO 110 HG3 PRO 110 126.599 7.657 -1.663 810 HD2 PRO 110 HD2 PRO 110 125.135 8.708 -3.744 811 HD3 PRO 110 HD3 PRO 110 126.900 8.517 -3.773 812 HA PRO 111 HA PRO 111 122.235 3.689 -5.055 813 HB2 PRO 111 HB2 PRO 111 122.380 1.023 -4.510 814 HB3 PRO 111 HB3 PRO 111 123.000 1.743 -6.008 815 HG2 PRO 111 HG2 PRO 111 124.464 0.793 -3.626 816 HG3 PRO 111 HG3 PRO 111 124.950 0.804 -5.327 817 HD2 PRO 111 HD2 PRO 111 125.796 2.640 -3.398 818 HD3 PRO 111 HD3 PRO 111 125.906 2.865 -5.156 819 H ILE 112 H ILE 112 120.339 2.988 -3.904 820 HA ILE 112 HA ILE 112 120.245 3.800 -1.216 821 HB ILE 112 HB ILE 112 118.249 2.135 -2.773 822 HG12 ILE 112 HG12 ILE 112 118.340 5.107 -2.196 823 HG13 ILE 112 HG13 ILE 112 118.867 4.386 -3.715 824 HG21 ILE 112 HG21 ILE 112 117.985 3.698 -0.181 825 HG22 ILE 112 HG22 ILE 112 117.789 1.957 -0.380 826 HG23 ILE 112 HG23 ILE 112 116.616 3.058 -1.088 827 HD11 ILE 112 HD11 ILE 112 116.610 3.501 -4.100 828 HD12 ILE 112 HD12 ILE 112 116.535 5.245 -3.841 829 HD13 ILE 112 HD13 ILE 112 116.074 4.142 -2.544 830 H THR 113 H THR 113 121.447 0.844 -2.414 831 HA THR 113 HA THR 113 120.303 -1.090 -0.897 832 HB THR 113 HB THR 113 122.049 -1.369 -2.686 833 HG1 THR 113 HG1 THR 113 121.258 -3.094 -1.612 834 HG21 THR 113 HG21 THR 113 123.946 -0.173 -1.848 835 HG22 THR 113 HG22 THR 113 124.350 -1.884 -1.766 836 HG23 THR 113 HG23 THR 113 123.888 -1.021 -0.303 837 HA PRO 114 HA PRO 114 123.385 -0.491 2.787 838 HB2 PRO 114 HB2 PRO 114 123.250 2.446 3.186 839 HB3 PRO 114 HB3 PRO 114 124.637 1.346 3.326 840 HG2 PRO 114 HG2 PRO 114 124.421 3.024 1.285 841 HG3 PRO 114 HG3 PRO 114 125.070 1.386 1.067 842 HD2 PRO 114 HD2 PRO 114 122.326 2.420 0.416 843 HD3 PRO 114 HD3 PRO 114 123.364 1.340 -0.533 844 H ILE 115 H ILE 115 120.627 1.621 2.183 845 HA ILE 115 HA ILE 115 119.651 1.195 4.921 846 HB ILE 115 HB ILE 115 117.851 2.843 4.240 847 HG12 ILE 115 HG12 ILE 115 119.772 3.462 1.980 848 HG13 ILE 115 HG13 ILE 115 118.271 2.567 1.758 849 HG21 ILE 115 HG21 ILE 115 119.143 4.587 4.997 850 HG22 ILE 115 HG22 ILE 115 120.531 4.143 4.003 851 HG23 ILE 115 HG23 ILE 115 120.163 3.228 5.465 852 HD11 ILE 115 HD11 ILE 115 118.046 5.163 3.207 853 HD12 ILE 115 HD12 ILE 115 116.961 4.428 2.030 854 HD13 ILE 115 HD13 ILE 115 118.423 5.250 1.487 855 H ARG 116 H ARG 116 119.414 -0.611 2.238 856 HA ARG 116 HA ARG 116 116.567 -0.988 2.074 857 HB2 ARG 116 HB2 ARG 116 118.149 -1.443 0.192 858 HB3 ARG 116 HB3 ARG 116 118.785 -2.809 1.108 859 HG2 ARG 116 HG2 ARG 116 116.482 -3.771 1.195 860 HG3 ARG 116 HG3 ARG 116 115.928 -2.453 0.161 861 HD2 ARG 116 HD2 ARG 116 118.082 -4.459 -0.556 862 HD3 ARG 116 HD3 ARG 116 116.430 -4.474 -1.164 863 HE ARG 116 HE ARG 116 117.596 -1.951 -1.686 864 HH11 ARG 116 HH11 ARG 116 117.826 -5.278 -2.782 865 HH12 ARG 116 HH12 ARG 116 118.374 -4.824 -4.362 866 HH21 ARG 116 HH21 ARG 116 118.308 -1.428 -3.733 867 HH22 ARG 116 HH22 ARG 116 118.644 -2.671 -4.892 868 H ALA 117 H ALA 117 115.321 -2.564 3.033 869 HA ALA 117 HA ALA 117 116.411 -3.784 5.425 870 HB1 ALA 117 HB1 ALA 117 114.117 -4.374 5.915 871 HB2 ALA 117 HB2 ALA 117 113.627 -3.995 4.263 872 HB3 ALA 117 HB3 ALA 117 114.155 -2.705 5.345 873 H LYS 118 H LYS 118 116.805 -5.910 5.771 874 HA LYS 118 HA LYS 118 116.569 -7.749 3.501 875 HB2 LYS 118 HB2 LYS 118 118.685 -7.643 4.834 876 HB3 LYS 118 HB3 LYS 118 117.784 -8.230 6.233 877 HG2 LYS 118 HG2 LYS 118 117.130 -10.248 4.931 878 HG3 LYS 118 HG3 LYS 118 118.123 -9.676 3.589 879 HD2 LYS 118 HD2 LYS 118 120.100 -9.664 5.127 880 HD3 LYS 118 HD3 LYS 118 119.086 -10.393 6.372 881 HE2 LYS 118 HE2 LYS 118 120.078 -12.273 5.395 882 HE3 LYS 118 HE3 LYS 118 118.548 -12.170 4.523 883 HZ1 LYS 118 HZ1 LYS 118 119.608 -11.126 2.702 884 HZ2 LYS 118 HZ2 LYS 118 120.561 -12.474 3.104 885 HZ3 LYS 118 HZ3 LYS 118 121.054 -10.914 3.561 886 H GLY 119 H GLY 119 115.230 -9.530 3.491 887 HA2 GLY 119 HA2 GLY 119 113.143 -9.545 5.576 888 HA3 GLY 119 HA3 GLY 119 112.963 -10.179 3.954 889 H SER 120 H SER 120 112.214 -11.728 6.092 890 HA SER 120 HA SER 120 114.137 -13.487 7.122 891 HB2 SER 120 HB2 SER 120 111.754 -13.346 7.869 892 HB3 SER 120 HB3 SER 120 111.283 -14.163 6.383 893 HG SER 120 HG SER 120 112.983 -15.137 8.373 894 H GLY 121 H GLY 121 112.342 -13.559 4.069 895 HA2 GLY 121 HA2 GLY 121 114.318 -15.482 3.036 896 HA3 GLY 121 HA3 GLY 121 112.602 -15.829 2.838 897 H GLY 122 H GLY 122 114.245 -15.597 0.629 898 HA2 GLY 122 HA2 GLY 122 114.086 -14.655 -1.478 899 HA3 GLY 122 HA3 GLY 122 112.905 -13.519 -0.839 900 H GLY 123 H GLY 123 116.082 -13.867 0.618 901 HA2 GLY 123 HA2 GLY 123 117.892 -12.454 0.736 902 HA3 GLY 123 HA3 GLY 123 117.473 -11.934 -0.892 903 H TYR 124 H TYR 124 117.105 -9.832 -1.064 904 HA TYR 124 HA TYR 124 116.265 -8.329 1.336 905 HB2 TYR 124 HB2 TYR 124 117.860 -7.611 -1.100 906 HB3 TYR 124 HB3 TYR 124 117.087 -6.368 -0.133 907 HD1 TYR 124 HD1 TYR 124 118.859 -9.541 0.788 908 HD2 TYR 124 HD2 TYR 124 118.720 -5.260 1.105 909 HE1 TYR 124 HE1 TYR 124 120.789 -9.593 2.347 910 HE2 TYR 124 HE2 TYR 124 120.644 -5.312 2.669 911 HH TYR 124 HH TYR 124 122.548 -6.937 3.154 912 H ILE 125 H ILE 125 114.807 -6.535 1.049 913 HA ILE 125 HA ILE 125 112.538 -7.321 -0.547 914 HB ILE 125 HB ILE 125 113.000 -4.957 1.293 915 HG12 ILE 125 HG12 ILE 125 111.304 -7.396 1.813 916 HG13 ILE 125 HG13 ILE 125 113.027 -7.410 2.175 917 HG21 ILE 125 HG21 ILE 125 110.618 -4.605 1.242 918 HG22 ILE 125 HG22 ILE 125 110.367 -6.053 0.266 919 HG23 ILE 125 HG23 ILE 125 111.164 -4.644 -0.433 920 HD11 ILE 125 HD11 ILE 125 111.427 -5.093 3.178 921 HD12 ILE 125 HD12 ILE 125 112.824 -5.899 3.895 922 HD13 ILE 125 HD13 ILE 125 111.231 -6.646 3.988 923 H SER 126 H SER 126 111.843 -6.469 -2.409 924 HA SER 126 HA SER 126 113.668 -5.079 -4.071 925 HB2 SER 126 HB2 SER 126 110.706 -5.552 -4.439 926 HB3 SER 126 HB3 SER 126 111.831 -5.047 -5.695 927 HG SER 126 HG SER 126 111.342 -7.401 -5.276 928 H LEU 127 H LEU 127 113.887 -3.019 -4.632 929 HA LEU 127 HA LEU 127 112.220 -0.982 -3.351 930 HB2 LEU 127 HB2 LEU 127 114.601 -0.645 -5.187 931 HB3 LEU 127 HB3 LEU 127 113.832 0.614 -4.225 932 HG LEU 127 HG LEU 127 115.189 -1.855 -3.099 933 HD11 LEU 127 HD11 LEU 127 116.907 -0.248 -2.332 934 HD12 LEU 127 HD12 LEU 127 116.059 1.050 -3.171 935 HD13 LEU 127 HD13 LEU 127 116.788 -0.266 -4.092 936 HD21 LEU 127 HD21 LEU 127 113.718 0.482 -1.895 937 HD22 LEU 127 HD22 LEU 127 115.002 -0.318 -0.987 938 HD23 LEU 127 HD23 LEU 127 113.584 -1.232 -1.500 939 H GLY 128 H GLY 128 111.615 -2.817 -5.938 940 HA2 GLY 128 HA2 GLY 128 111.518 -1.312 -8.224 941 HA3 GLY 128 HA3 GLY 128 110.338 -2.556 -7.840 942 H ALA 129 H ALA 129 109.032 -1.326 -5.653 943 HA ALA 129 HA ALA 129 107.112 0.187 -7.040 944 HB1 ALA 129 HB1 ALA 129 107.492 0.440 -4.070 945 HB2 ALA 129 HB2 ALA 129 106.939 -1.079 -4.773 946 HB3 ALA 129 HB3 ALA 129 105.993 0.392 -4.998 947 H LEU 130 H LEU 130 109.646 1.254 -4.771 948 HA LEU 130 HA LEU 130 109.029 3.994 -4.834 949 HB2 LEU 130 HB2 LEU 130 110.547 2.914 -3.189 950 HB3 LEU 130 HB3 LEU 130 111.745 2.704 -4.465 951 HG LEU 130 HG LEU 130 111.644 5.217 -4.821 952 HD11 LEU 130 HD11 LEU 130 110.011 4.968 -2.286 953 HD12 LEU 130 HD12 LEU 130 109.552 5.766 -3.789 954 HD13 LEU 130 HD13 LEU 130 110.805 6.468 -2.766 955 HD21 LEU 130 HD21 LEU 130 112.466 4.630 -1.990 956 HD22 LEU 130 HD22 LEU 130 113.303 5.575 -3.221 957 HD23 LEU 130 HD23 LEU 130 113.297 3.816 -3.317 958 H LEU 131 H LEU 131 111.162 2.036 -6.880 959 HA LEU 131 HA LEU 131 112.334 4.147 -8.322 960 HB2 LEU 131 HB2 LEU 131 113.139 1.790 -8.346 961 HB3 LEU 131 HB3 LEU 131 111.728 1.346 -9.307 962 HG LEU 131 HG LEU 131 112.472 3.103 -10.993 963 HD11 LEU 131 HD11 LEU 131 114.798 3.109 -9.081 964 HD12 LEU 131 HD12 LEU 131 113.972 4.481 -9.822 965 HD13 LEU 131 HD13 LEU 131 115.047 3.470 -10.789 966 HD21 LEU 131 HD21 LEU 131 112.839 0.731 -11.413 967 HD22 LEU 131 HD22 LEU 131 114.276 0.740 -10.390 968 HD23 LEU 131 HD23 LEU 131 114.274 1.625 -11.915 969 H SER 132 H SER 132 109.366 2.289 -8.908 970 HA SER 132 HA SER 132 108.793 3.310 -11.459 971 HB2 SER 132 HB2 SER 132 107.642 1.360 -10.379 972 HB3 SER 132 HB3 SER 132 106.783 2.498 -9.347 973 HG SER 132 HG SER 132 106.132 1.775 -11.728 974 H THR 133 H THR 133 107.865 4.481 -8.232 975 HA THR 133 HA THR 133 106.152 6.542 -9.105 976 HB THR 133 HB THR 133 107.878 6.540 -6.617 977 HG1 THR 133 HG1 THR 133 106.600 4.707 -6.780 978 HG21 THR 133 HG21 THR 133 105.240 7.885 -7.268 979 HG22 THR 133 HG22 THR 133 106.800 8.697 -7.140 980 HG23 THR 133 HG23 THR 133 106.072 7.953 -5.715 981 H THR 134 H THR 134 109.631 6.584 -8.354 982 HA THR 134 HA THR 134 109.972 9.360 -8.777 983 HB THR 134 HB THR 134 112.064 7.206 -9.139 984 HG1 THR 134 HG1 THR 134 110.983 8.432 -6.905 985 HG21 THR 134 HG21 THR 134 112.503 9.628 -9.880 986 HG22 THR 134 HG22 THR 134 113.639 8.941 -8.719 987 HG23 THR 134 HG23 THR 134 112.384 10.054 -8.172 988 H LEU 135 H LEU 135 110.246 6.592 -10.990 989 HA LEU 135 HA LEU 135 111.282 7.979 -13.202 990 HB2 LEU 135 HB2 LEU 135 109.489 5.548 -13.061 991 HB3 LEU 135 HB3 LEU 135 110.235 6.133 -14.548 992 HG LEU 135 HG LEU 135 111.825 5.468 -12.059 993 HD11 LEU 135 HD11 LEU 135 111.271 3.763 -14.508 994 HD12 LEU 135 HD12 LEU 135 110.689 3.441 -12.875 995 HD13 LEU 135 HD13 LEU 135 112.415 3.363 -13.227 996 HD21 LEU 135 HD21 LEU 135 113.141 6.847 -13.425 997 HD22 LEU 135 HD22 LEU 135 112.443 6.203 -14.911 998 HD23 LEU 135 HD23 LEU 135 113.587 5.235 -13.982 999 H ASN 136 H ASN 136 107.940 7.507 -12.106 1000 HA ASN 136 HA ASN 136 106.620 8.606 -14.321 1001 HB2 ASN 136 HB2 ASN 136 105.865 8.693 -11.391 1002 HB3 ASN 136 HB3 ASN 136 104.780 9.095 -12.719 1003 HD21 ASN 136 HD21 ASN 136 104.353 6.890 -10.850 1004 HD22 ASN 136 HD22 ASN 136 104.403 5.454 -11.756 1005 H LEU 137 H LEU 137 107.913 10.155 -11.402 1006 HA LEU 137 HA LEU 137 107.126 12.794 -12.026 1007 HB2 LEU 137 HB2 LEU 137 109.564 11.895 -10.473 1008 HB3 LEU 137 HB3 LEU 137 108.828 13.496 -10.418 1009 HG LEU 137 HG LEU 137 107.435 10.919 -9.629 1010 HD11 LEU 137 HD11 LEU 137 108.896 13.046 -8.081 1011 HD12 LEU 137 HD12 LEU 137 108.974 11.292 -7.903 1012 HD13 LEU 137 HD13 LEU 137 107.556 12.174 -7.335 1013 HD21 LEU 137 HD21 LEU 137 105.820 12.539 -10.404 1014 HD22 LEU 137 HD22 LEU 137 106.624 13.840 -9.523 1015 HD23 LEU 137 HD23 LEU 137 105.780 12.566 -8.643 1016 H CYS 138 H CYS 138 110.067 10.985 -12.828 1017 HA CYS 138 HA CYS 138 111.464 13.018 -14.157 1018 HB2 CYS 138 HB2 CYS 138 111.438 10.030 -14.355 1019 HB3 CYS 138 HB3 CYS 138 112.367 10.969 -15.516 1020 H GLY 139 H GLY 139 108.669 11.185 -15.195 1021 HA2 GLY 139 HA2 GLY 139 107.267 11.692 -16.992 1022 HA3 GLY 139 HA3 GLY 139 108.481 12.810 -17.596 1023 H LYS 140 H LYS 140 109.477 9.557 -16.804 1024 HA LYS 140 HA LYS 140 110.131 9.086 -19.598 1025 HB2 LYS 140 HB2 LYS 140 111.727 8.545 -17.750 1026 HB3 LYS 140 HB3 LYS 140 110.604 7.303 -17.197 1027 HG2 LYS 140 HG2 LYS 140 112.157 6.146 -18.568 1028 HG3 LYS 140 HG3 LYS 140 110.733 6.357 -19.585 1029 HD2 LYS 140 HD2 LYS 140 111.751 8.302 -20.665 1030 HD3 LYS 140 HD3 LYS 140 113.153 8.185 -19.601 1031 HE2 LYS 140 HE2 LYS 140 113.917 6.210 -20.610 1032 HE3 LYS 140 HE3 LYS 140 112.334 5.835 -21.291 1033 HZ1 LYS 140 HZ1 LYS 140 114.118 6.762 -22.841 1034 HZ2 LYS 140 HZ2 LYS 140 113.807 8.260 -22.103 1035 HZ3 LYS 140 HZ3 LYS 140 112.566 7.443 -22.927 1036 H GLY 141 H GLY 141 109.111 7.707 -20.944 1037 HA2 GLY 141 HA2 GLY 141 107.649 6.083 -21.700 1038 HA3 GLY 141 HA3 GLY 141 107.421 5.572 -20.030 Start of MODEL 4 1 H1 HIS -5 HT1 HIS -5 121.985 38.966 -29.335 2 H2 HIS -5 HT2 HIS -5 122.154 37.596 -30.325 3 H3 HIS -5 HT3 HIS -5 123.284 37.901 -29.093 4 HA HIS -5 HA HIS -5 121.621 36.123 -28.582 5 HB2 HIS -5 HB2 HIS -5 122.924 37.384 -26.872 6 HB3 HIS -5 HB3 HIS -5 121.632 38.568 -26.799 7 HD1 HIS -5 HD1 HIS -5 121.988 34.787 -26.370 8 HD2 HIS -5 HD2 HIS -5 119.855 37.996 -24.779 9 HE1 HIS -5 HE1 HIS -5 120.587 33.848 -24.482 10 H HIS -4 H HIS -4 119.683 35.709 -29.470 11 HA HIS -4 HA HIS -4 117.525 37.719 -29.151 12 HB2 HIS -4 HB2 HIS -4 117.930 35.667 -31.329 13 HB3 HIS -4 HB3 HIS -4 116.499 36.663 -31.151 14 HD1 HIS -4 HD1 HIS -4 120.061 36.750 -32.266 15 HD2 HIS -4 HD2 HIS -4 116.873 39.409 -31.890 16 HE1 HIS -4 HE1 HIS -4 120.724 38.843 -33.525 17 H HIS -3 H HIS -3 115.597 37.049 -28.324 18 HA HIS -3 HA HIS -3 115.376 34.205 -27.517 19 HB2 HIS -3 HB2 HIS -3 115.883 35.688 -25.606 20 HB3 HIS -3 HB3 HIS -3 114.458 36.638 -25.981 21 HD1 HIS -3 HD1 HIS -3 115.256 32.977 -25.222 22 HD2 HIS -3 HD2 HIS -3 112.284 35.814 -24.510 23 HE1 HIS -3 HE1 HIS -3 113.531 31.852 -23.751 24 H HIS -2 H HIS -2 113.474 33.214 -27.918 25 HA HIS -2 HA HIS -2 111.246 34.855 -28.982 26 HB2 HIS -2 HB2 HIS -2 112.480 33.601 -30.753 27 HB3 HIS -2 HB3 HIS -2 112.077 32.110 -29.926 28 HD1 HIS -2 HD1 HIS -2 109.663 31.237 -30.154 29 HD2 HIS -2 HD2 HIS -2 110.301 34.864 -32.107 30 HE1 HIS -2 HE1 HIS -2 107.634 31.629 -31.615 31 H HIS -1 H HIS -1 109.185 34.240 -28.405 32 HA HIS -1 HA HIS -1 108.985 32.120 -26.340 33 HB2 HIS -1 HB2 HIS -1 108.707 34.385 -25.424 34 HB3 HIS -1 HB3 HIS -1 107.423 34.695 -26.577 35 HD1 HIS -1 HD1 HIS -1 105.106 33.720 -26.062 36 HD2 HIS -1 HD2 HIS -1 108.005 32.609 -23.281 37 HE1 HIS -1 HE1 HIS -1 103.869 32.656 -24.126 38 H HIS 0 H HIS 0 107.371 30.651 -26.523 39 HA HIS 0 HA HIS 0 105.642 30.839 -28.922 40 HB2 HIS 0 HB2 HIS 0 106.653 28.419 -27.424 41 HB3 HIS 0 HB3 HIS 0 105.521 28.366 -28.762 42 HD1 HIS 0 HD1 HIS 0 109.131 28.775 -27.940 43 HD2 HIS 0 HD2 HIS 0 106.705 28.929 -31.328 44 HE1 HIS 0 HE1 HIS 0 110.686 28.724 -29.936 45 H SER 1 H SER 1 103.468 30.576 -28.716 46 HA SER 1 HA SER 1 102.403 30.265 -25.965 47 HB2 SER 1 HB2 SER 1 102.051 32.517 -26.963 48 HB3 SER 1 HB3 SER 1 101.176 31.763 -28.291 49 HG SER 1 HG SER 1 100.519 31.692 -25.579 50 H SER 2 H SER 2 100.717 28.871 -25.631 51 HA SER 2 HA SER 2 99.596 27.444 -27.945 52 HB2 SER 2 HB2 SER 2 99.997 25.279 -26.943 53 HB3 SER 2 HB3 SER 2 101.532 26.132 -27.060 54 HG SER 2 HG SER 2 101.430 26.489 -24.924 55 H GLY 3 H GLY 3 97.658 26.193 -27.383 56 HA2 GLY 3 HA2 GLY 3 96.388 26.588 -24.831 57 HA3 GLY 3 HA3 GLY 3 95.697 27.602 -26.096 58 H LEU 4 H LEU 4 93.872 26.053 -25.209 59 HA LEU 4 HA LEU 4 93.860 23.527 -26.730 60 HB2 LEU 4 HB2 LEU 4 93.345 23.454 -24.289 61 HB3 LEU 4 HB3 LEU 4 91.938 24.472 -24.593 62 HG LEU 4 HG LEU 4 91.172 22.722 -26.269 63 HD11 LEU 4 HD11 LEU 4 93.190 21.522 -26.703 64 HD12 LEU 4 HD12 LEU 4 92.174 20.417 -25.777 65 HD13 LEU 4 HD13 LEU 4 93.496 21.274 -24.984 66 HD21 LEU 4 HD21 LEU 4 91.494 21.734 -23.419 67 HD22 LEU 4 HD22 LEU 4 90.213 21.303 -24.553 68 HD23 LEU 4 HD23 LEU 4 90.308 22.943 -23.911 69 H VAL 5 H VAL 5 92.653 23.317 -28.507 70 HA VAL 5 HA VAL 5 90.348 25.103 -28.907 71 HB VAL 5 HB VAL 5 91.038 25.501 -31.249 72 HG11 VAL 5 HG11 VAL 5 92.866 27.091 -30.726 73 HG12 VAL 5 HG12 VAL 5 93.084 26.309 -29.160 74 HG13 VAL 5 HG13 VAL 5 91.582 27.161 -29.518 75 HG21 VAL 5 HG21 VAL 5 92.453 23.558 -31.615 76 HG22 VAL 5 HG22 VAL 5 93.557 24.074 -30.340 77 HG23 VAL 5 HG23 VAL 5 93.434 25.007 -31.831 78 HA PRO 6 HA PRO 6 88.676 21.312 -30.500 79 HB2 PRO 6 HB2 PRO 6 86.514 22.162 -31.871 80 HB3 PRO 6 HB3 PRO 6 86.623 22.326 -30.106 81 HG2 PRO 6 HG2 PRO 6 86.935 24.376 -32.215 82 HG3 PRO 6 HG3 PRO 6 86.288 24.526 -30.573 83 HD2 PRO 6 HD2 PRO 6 88.884 25.250 -31.394 84 HD3 PRO 6 HD3 PRO 6 88.323 25.081 -29.718 85 H ARG 7 H ARG 7 89.244 19.984 -32.134 86 HA ARG 7 HA ARG 7 89.659 21.134 -34.836 87 HB2 ARG 7 HB2 ARG 7 91.285 19.000 -33.434 88 HB3 ARG 7 HB3 ARG 7 91.491 19.488 -35.116 89 HG2 ARG 7 HG2 ARG 7 91.932 21.819 -34.350 90 HG3 ARG 7 HG3 ARG 7 91.832 21.261 -32.680 91 HD2 ARG 7 HD2 ARG 7 93.667 19.615 -33.206 92 HD3 ARG 7 HD3 ARG 7 93.839 20.396 -34.776 93 HE ARG 7 HE ARG 7 94.780 21.389 -32.249 94 HH11 ARG 7 HH11 ARG 7 93.646 22.413 -35.410 95 HH12 ARG 7 HH12 ARG 7 94.479 23.929 -35.329 96 HH21 ARG 7 HH21 ARG 7 95.832 23.356 -32.202 97 HH22 ARG 7 HH22 ARG 7 95.701 24.455 -33.534 98 H GLY 8 H GLY 8 89.044 19.881 -36.581 99 HA2 GLY 8 HA2 GLY 8 88.289 17.179 -36.518 100 HA3 GLY 8 HA3 GLY 8 86.845 18.150 -36.244 101 H SER 9 H SER 9 86.495 16.833 -38.392 102 HA SER 9 HA SER 9 87.016 18.730 -40.585 103 HB2 SER 9 HB2 SER 9 87.593 16.941 -42.113 104 HB3 SER 9 HB3 SER 9 88.669 16.866 -40.724 105 HG SER 9 HG SER 9 86.416 15.305 -41.229 106 H GLY 10 H GLY 10 85.495 18.576 -42.332 107 HA2 GLY 10 HA2 GLY 10 83.413 16.897 -42.754 108 HA3 GLY 10 HA3 GLY 10 82.833 17.892 -41.422 109 H MET 11 H MET 11 81.255 18.227 -43.381 110 HA MET 11 HA MET 11 82.085 20.736 -44.719 111 HB2 MET 11 HB2 MET 11 80.351 18.546 -45.898 112 HB3 MET 11 HB3 MET 11 80.764 20.070 -46.678 113 HG2 MET 11 HG2 MET 11 82.721 17.899 -45.867 114 HG3 MET 11 HG3 MET 11 82.205 18.263 -47.511 115 HE1 MET 11 HE1 MET 11 83.627 21.666 -48.316 116 HE2 MET 11 HE2 MET 11 82.121 21.569 -47.407 117 HE3 MET 11 HE3 MET 11 82.463 20.381 -48.663 118 H LYS 12 H LYS 12 80.408 22.258 -45.061 119 HA LYS 12 HA LYS 12 78.236 22.001 -43.106 120 HB2 LYS 12 HB2 LYS 12 79.270 24.384 -44.659 121 HB3 LYS 12 HB3 LYS 12 77.938 24.442 -43.504 122 HG2 LYS 12 HG2 LYS 12 79.471 23.556 -41.747 123 HG3 LYS 12 HG3 LYS 12 80.799 23.635 -42.906 124 HD2 LYS 12 HD2 LYS 12 80.360 26.079 -43.178 125 HD3 LYS 12 HD3 LYS 12 79.137 25.967 -41.912 126 HE2 LYS 12 HE2 LYS 12 80.930 25.026 -40.394 127 HE3 LYS 12 HE3 LYS 12 82.105 25.433 -41.645 128 HZ1 LYS 12 HZ1 LYS 12 80.991 27.745 -41.516 129 HZ2 LYS 12 HZ2 LYS 12 82.123 27.300 -40.329 130 HZ3 LYS 12 HZ3 LYS 12 80.459 27.225 -39.990 131 H GLU 13 H GLU 13 76.135 21.873 -43.647 132 HA GLU 13 HA GLU 13 75.401 22.130 -46.508 133 HB2 GLU 13 HB2 GLU 13 74.357 20.135 -44.483 134 HB3 GLU 13 HB3 GLU 13 73.757 20.324 -46.131 135 HG2 GLU 13 HG2 GLU 13 76.040 19.833 -46.988 136 HG3 GLU 13 HG3 GLU 13 76.580 19.558 -45.337 137 H THR 14 H THR 14 73.167 22.734 -46.891 138 HA THR 14 HA THR 14 72.302 24.831 -45.142 139 HB THR 14 HB THR 14 70.811 23.562 -47.453 140 HG1 THR 14 HG1 THR 14 72.235 24.536 -48.589 141 HG21 THR 14 HG21 THR 14 70.567 26.191 -45.976 142 HG22 THR 14 HG22 THR 14 69.341 24.935 -46.147 143 HG23 THR 14 HG23 THR 14 69.820 25.898 -47.546 144 H ALA 15 H ALA 15 70.761 24.823 -43.598 145 HA ALA 15 HA ALA 15 68.950 22.539 -43.348 146 HB1 ALA 15 HB1 ALA 15 70.636 23.382 -40.992 147 HB2 ALA 15 HB2 ALA 15 71.101 22.058 -42.060 148 HB3 ALA 15 HB3 ALA 15 69.600 21.963 -41.138 149 H ALA 16 H ALA 16 67.237 22.916 -41.780 150 HA ALA 16 HA ALA 16 66.082 25.460 -41.976 151 HB1 ALA 16 HB1 ALA 16 65.568 23.203 -40.030 152 HB2 ALA 16 HB2 ALA 16 64.693 23.550 -41.521 153 HB3 ALA 16 HB3 ALA 16 64.559 24.644 -40.144 154 H ALA 17 H ALA 17 65.804 27.133 -40.468 155 HA ALA 17 HA ALA 17 68.074 27.909 -39.032 156 HB1 ALA 17 HB1 ALA 17 66.859 29.787 -38.391 157 HB2 ALA 17 HB2 ALA 17 65.348 28.889 -38.254 158 HB3 ALA 17 HB3 ALA 17 65.999 29.282 -39.846 159 H LYS 18 H LYS 18 68.585 27.938 -36.848 160 HA LYS 18 HA LYS 18 66.957 26.202 -35.085 161 HB2 LYS 18 HB2 LYS 18 68.999 25.030 -35.922 162 HB3 LYS 18 HB3 LYS 18 69.981 26.291 -35.175 163 HG2 LYS 18 HG2 LYS 18 68.945 25.759 -32.976 164 HG3 LYS 18 HG3 LYS 18 68.053 24.442 -33.740 165 HD2 LYS 18 HD2 LYS 18 70.243 23.456 -34.466 166 HD3 LYS 18 HD3 LYS 18 71.065 24.702 -33.527 167 HE2 LYS 18 HE2 LYS 18 69.058 22.742 -32.378 168 HE3 LYS 18 HE3 LYS 18 70.809 22.557 -32.270 169 HZ1 LYS 18 HZ1 LYS 18 69.137 24.710 -31.109 170 HZ2 LYS 18 HZ2 LYS 18 70.829 24.812 -31.214 171 HZ3 LYS 18 HZ3 LYS 18 70.106 23.588 -30.284 172 H PHE 19 H PHE 19 66.673 26.911 -33.028 173 HA PHE 19 HA PHE 19 66.955 29.630 -32.433 174 HB2 PHE 19 HB2 PHE 19 66.348 29.026 -30.154 175 HB3 PHE 19 HB3 PHE 19 65.350 28.169 -31.312 176 HD1 PHE 19 HD2 PHE 19 65.710 25.740 -31.719 177 HD2 PHE 19 HD1 PHE 19 67.846 27.882 -28.670 178 HE1 PHE 19 HE2 PHE 19 66.345 23.591 -30.655 179 HE2 PHE 19 HE1 PHE 19 68.480 25.733 -27.605 180 HZ PHE 19 HZ PHE 19 67.730 23.589 -28.598 181 H GLU 20 H GLU 20 68.297 30.720 -30.928 182 HA GLU 20 HA GLU 20 71.061 30.000 -31.138 183 HB2 GLU 20 HB2 GLU 20 70.227 32.349 -31.114 184 HB3 GLU 20 HB3 GLU 20 69.784 32.140 -29.420 185 HG2 GLU 20 HG2 GLU 20 71.950 33.182 -29.463 186 HG3 GLU 20 HG3 GLU 20 72.183 31.515 -28.955 187 H ARG 21 H ARG 21 72.460 29.268 -29.577 188 HA ARG 21 HA ARG 21 71.200 28.088 -27.178 189 HB2 ARG 21 HB2 ARG 21 73.779 27.390 -28.604 190 HB3 ARG 21 HB3 ARG 21 73.185 26.601 -27.143 191 HG2 ARG 21 HG2 ARG 21 71.128 25.934 -28.343 192 HG3 ARG 21 HG3 ARG 21 71.746 26.694 -29.810 193 HD2 ARG 21 HD2 ARG 21 72.245 24.343 -29.960 194 HD3 ARG 21 HD3 ARG 21 73.759 25.186 -29.645 195 HE ARG 21 HE ARG 21 72.795 24.514 -27.157 196 HH11 ARG 21 HH11 ARG 21 73.609 22.689 -30.043 197 HH12 ARG 21 HH12 ARG 21 74.030 21.269 -29.147 198 HH21 ARG 21 HH21 ARG 21 73.351 22.655 -26.058 199 HH22 ARG 21 HH22 ARG 21 73.885 21.251 -26.919 200 H GLN 22 H GLN 22 72.492 28.071 -25.198 201 HA GLN 22 HA GLN 22 74.425 30.281 -24.987 202 HB2 GLN 22 HB2 GLN 22 73.309 31.177 -23.024 203 HB3 GLN 22 HB3 GLN 22 72.191 31.160 -24.385 204 HG2 GLN 22 HG2 GLN 22 71.343 28.926 -23.509 205 HG3 GLN 22 HG3 GLN 22 72.285 29.237 -22.051 206 HE21 GLN 22 HE21 GLN 22 70.617 29.703 -20.552 207 HE22 GLN 22 HE22 GLN 22 69.493 30.958 -20.762 208 H HIS 23 H HIS 23 75.565 30.268 -22.861 209 HA HIS 23 HA HIS 23 75.898 27.506 -21.837 210 HB2 HIS 23 HB2 HIS 23 78.085 29.537 -22.295 211 HB3 HIS 23 HB3 HIS 23 78.287 27.907 -21.681 212 HD1 HIS 23 HD1 HIS 23 77.465 25.969 -23.479 213 HD2 HIS 23 HD2 HIS 23 78.389 29.731 -25.020 214 HE1 HIS 23 HE1 HIS 23 77.852 25.649 -25.959 215 H MET 24 H MET 24 77.205 27.560 -19.726 216 HA MET 24 HA MET 24 76.023 29.644 -17.996 217 HB2 MET 24 HB2 MET 24 76.983 26.841 -17.380 218 HB3 MET 24 HB3 MET 24 76.426 27.992 -16.164 219 HG2 MET 24 HG2 MET 24 74.249 28.159 -17.364 220 HG3 MET 24 HG3 MET 24 74.807 26.927 -18.496 221 HE1 MET 24 HE1 MET 24 72.202 24.985 -16.428 222 HE2 MET 24 HE2 MET 24 72.831 25.325 -18.038 223 HE3 MET 24 HE3 MET 24 72.178 26.637 -17.060 224 H ASP 25 H ASP 25 77.306 30.401 -16.186 225 HA ASP 25 HA ASP 25 79.895 31.244 -16.975 226 HB2 ASP 25 HB2 ASP 25 78.551 31.301 -14.265 227 HB3 ASP 25 HB3 ASP 25 80.045 32.144 -14.664 228 H SER 26 H SER 26 81.926 30.635 -16.270 229 HA SER 26 HA SER 26 82.309 27.880 -15.682 230 HB2 SER 26 HB2 SER 26 84.412 29.992 -15.269 231 HB3 SER 26 HB3 SER 26 84.609 28.329 -15.809 232 HG SER 26 HG SER 26 84.450 29.188 -17.705 233 HA PRO 27 HA PRO 27 82.216 28.137 -11.261 234 HB2 PRO 27 HB2 PRO 27 83.503 25.880 -10.531 235 HB3 PRO 27 HB3 PRO 27 81.933 25.836 -11.359 236 HG2 PRO 27 HG2 PRO 27 84.645 25.302 -12.423 237 HG3 PRO 27 HG3 PRO 27 83.092 24.564 -12.851 238 HD2 PRO 27 HD2 PRO 27 84.392 26.580 -14.306 239 HD3 PRO 27 HD3 PRO 27 82.690 26.105 -14.482 240 H ASP 28 H ASP 28 83.843 27.614 -9.285 241 HA ASP 28 HA ASP 28 86.014 29.508 -9.601 242 HB2 ASP 28 HB2 ASP 28 84.574 29.466 -7.572 243 HB3 ASP 28 HB3 ASP 28 85.222 27.874 -7.180 244 H LEU 29 H LEU 29 88.048 29.003 -10.072 245 HA LEU 29 HA LEU 29 88.852 26.230 -10.293 246 HB2 LEU 29 HB2 LEU 29 90.459 28.756 -10.745 247 HB3 LEU 29 HB3 LEU 29 90.925 27.126 -11.228 248 HG LEU 29 HG LEU 29 88.444 28.572 -12.205 249 HD11 LEU 29 HD11 LEU 29 91.197 28.178 -13.383 250 HD12 LEU 29 HD12 LEU 29 90.287 29.679 -13.209 251 HD13 LEU 29 HD13 LEU 29 89.790 28.479 -14.403 252 HD21 LEU 29 HD21 LEU 29 89.692 25.882 -12.787 253 HD22 LEU 29 HD22 LEU 29 88.607 26.660 -13.938 254 HD23 LEU 29 HD23 LEU 29 88.028 26.237 -12.326 255 H GLY 30 H GLY 30 90.610 25.269 -9.209 256 HA2 GLY 30 HA2 GLY 30 90.691 25.615 -6.450 257 HA3 GLY 30 HA3 GLY 30 91.913 24.759 -7.384 258 H THR 31 H THR 31 92.408 26.329 -5.060 259 HA THR 31 HA THR 31 94.043 28.525 -6.195 260 HB THR 31 HB THR 31 93.720 29.751 -4.111 261 HG1 THR 31 HG1 THR 31 93.316 28.363 -2.579 262 HG21 THR 31 HG21 THR 31 92.094 30.195 -5.850 263 HG22 THR 31 HG22 THR 31 91.248 30.157 -4.303 264 HG23 THR 31 HG23 THR 31 91.155 28.774 -5.393 265 H ASP 32 H ASP 32 95.879 29.116 -4.664 266 HA ASP 32 HA ASP 32 97.617 26.941 -4.392 267 HB2 ASP 32 HB2 ASP 32 97.680 29.632 -3.009 268 HB3 ASP 32 HB3 ASP 32 99.022 28.492 -3.051 269 H ASP 33 H ASP 33 98.406 25.831 -2.569 270 HA ASP 33 HA ASP 33 96.385 25.114 -0.684 271 HB2 ASP 33 HB2 ASP 33 98.118 23.637 0.263 272 HB3 ASP 33 HB3 ASP 33 97.984 23.467 -1.482 273 H ASP 34 H ASP 34 96.993 24.946 1.710 274 HA ASP 34 HA ASP 34 97.276 27.597 2.722 275 HB2 ASP 34 HB2 ASP 34 97.258 24.923 4.140 276 HB3 ASP 34 HB3 ASP 34 97.170 26.488 4.944 277 H ASP 35 H ASP 35 98.914 28.470 4.011 278 HA ASP 35 HA ASP 35 101.569 27.884 3.251 279 HB2 ASP 35 HB2 ASP 35 100.517 29.453 5.616 280 HB3 ASP 35 HB3 ASP 35 102.194 29.449 5.079 281 H LYS 36 H LYS 36 103.306 27.049 4.509 282 HA LYS 36 HA LYS 36 102.605 24.688 5.974 283 HB2 LYS 36 HB2 LYS 36 105.275 26.037 5.516 284 HB3 LYS 36 HB3 LYS 36 105.067 24.452 6.260 285 HG2 LYS 36 HG2 LYS 36 103.887 23.680 4.203 286 HG3 LYS 36 HG3 LYS 36 104.231 25.240 3.455 287 HD2 LYS 36 HD2 LYS 36 106.668 24.834 3.824 288 HD3 LYS 36 HD3 LYS 36 106.274 23.225 4.433 289 HE2 LYS 36 HE2 LYS 36 105.403 24.191 1.702 290 HE3 LYS 36 HE3 LYS 36 106.921 23.335 1.971 291 HZ1 LYS 36 HZ1 LYS 36 104.679 22.081 1.412 292 HZ2 LYS 36 HZ2 LYS 36 104.504 22.155 3.100 293 HZ3 LYS 36 HZ3 LYS 36 105.864 21.401 2.418 294 H THR 37 H THR 37 102.987 24.217 8.144 295 HA THR 37 HA THR 37 103.340 26.562 9.922 296 HB THR 37 HB THR 37 101.769 25.529 11.477 297 HG1 THR 37 HG1 THR 37 101.383 23.519 11.222 298 HG21 THR 37 HG21 THR 37 100.666 25.657 8.655 299 HG22 THR 37 HG22 THR 37 100.865 27.030 9.745 300 HG23 THR 37 HG23 THR 37 99.712 25.755 10.136 301 H GLY 38 H GLY 38 103.962 25.855 12.189 302 HA2 GLY 38 HA2 GLY 38 106.368 24.293 12.012 303 HA3 GLY 38 HA3 GLY 38 105.721 25.053 13.463 304 H GLY 39 H GLY 39 106.551 22.904 14.327 305 HA2 GLY 39 HA2 GLY 39 105.437 20.427 13.727 306 HA3 GLY 39 HA3 GLY 39 106.068 20.879 15.308 307 H GLY 40 H GLY 40 103.426 19.696 13.826 308 HA2 GLY 40 HA2 GLY 40 101.403 21.155 15.345 309 HA3 GLY 40 HA3 GLY 40 101.109 19.876 14.172 310 H ARG 41 H ARG 41 99.596 19.294 16.024 311 HA ARG 41 HA ARG 41 100.475 18.277 18.473 312 HB2 ARG 41 HB2 ARG 41 98.146 17.407 16.747 313 HB3 ARG 41 HB3 ARG 41 98.375 16.935 18.431 314 HG2 ARG 41 HG2 ARG 41 98.408 19.354 19.059 315 HG3 ARG 41 HG3 ARG 41 98.037 19.760 17.383 316 HD2 ARG 41 HD2 ARG 41 96.320 18.083 19.236 317 HD3 ARG 41 HD3 ARG 41 95.979 19.728 18.709 318 HE ARG 41 HE ARG 41 96.325 18.032 16.456 319 HH11 ARG 41 HH11 ARG 41 93.992 18.727 18.986 320 HH12 ARG 41 HH12 ARG 41 92.647 18.212 18.025 321 HH21 ARG 41 HH21 ARG 41 94.554 17.383 15.267 322 HH22 ARG 41 HH22 ARG 41 92.962 17.461 15.946 323 H ALA 42 H ALA 42 100.823 16.104 19.176 324 HA ALA 42 HA ALA 42 102.656 14.635 17.676 325 HB1 ALA 42 HB1 ALA 42 100.843 13.527 19.829 326 HB2 ALA 42 HB2 ALA 42 102.300 14.465 20.152 327 HB3 ALA 42 HB3 ALA 42 102.419 12.904 19.340 328 H ASP 43 H ASP 43 102.518 12.690 16.515 329 HA ASP 43 HA ASP 43 100.427 12.528 14.692 330 HB2 ASP 43 HB2 ASP 43 102.545 10.550 15.504 331 HB3 ASP 43 HB3 ASP 43 101.395 10.214 14.211 332 HA PRO 44 HA PRO 44 97.564 10.134 17.297 333 HB2 PRO 44 HB2 PRO 44 95.837 9.579 15.026 334 HB3 PRO 44 HB3 PRO 44 95.563 10.671 16.391 335 HG2 PRO 44 HG2 PRO 44 95.978 11.459 13.805 336 HG3 PRO 44 HG3 PRO 44 96.226 12.474 15.235 337 HD2 PRO 44 HD2 PRO 44 98.253 11.081 13.543 338 HD3 PRO 44 HD3 PRO 44 98.368 12.618 14.430 339 H ALA 45 H ALA 45 96.154 7.943 16.670 340 HA ALA 45 HA ALA 45 98.003 5.848 16.561 341 HB1 ALA 45 HB1 ALA 45 96.044 4.387 16.206 342 HB2 ALA 45 HB2 ALA 45 95.055 5.808 15.867 343 HB3 ALA 45 HB3 ALA 45 95.744 5.577 17.474 344 H HIS 46 H HIS 46 98.233 4.176 14.899 345 HA HIS 46 HA HIS 46 99.026 5.272 12.432 346 HB2 HIS 46 HB2 HIS 46 98.496 2.429 13.281 347 HB3 HIS 46 HB3 HIS 46 99.129 2.851 11.701 348 HD1 HIS 46 HD1 HIS 46 101.483 4.253 11.792 349 HD2 HIS 46 HD2 HIS 46 100.427 2.142 15.229 350 HE1 HIS 46 HE1 HIS 46 103.595 4.026 13.168 351 H ARG 47 H ARG 47 98.182 5.029 10.346 352 HA ARG 47 HA ARG 47 95.287 4.436 10.188 353 HB2 ARG 47 HB2 ARG 47 95.721 6.894 10.289 354 HB3 ARG 47 HB3 ARG 47 96.706 6.744 8.834 355 HG2 ARG 47 HG2 ARG 47 94.748 5.848 7.610 356 HG3 ARG 47 HG3 ARG 47 93.764 6.043 9.062 357 HD2 ARG 47 HD2 ARG 47 94.303 8.481 9.044 358 HD3 ARG 47 HD3 ARG 47 95.168 8.247 7.527 359 HE ARG 47 HE ARG 47 93.119 7.976 6.431 360 HH11 ARG 47 HH11 ARG 47 92.582 8.158 9.896 361 HH12 ARG 47 HH12 ARG 47 90.871 8.361 9.720 362 HH21 ARG 47 HH21 ARG 47 90.911 8.239 6.268 363 HH22 ARG 47 HH22 ARG 47 89.938 8.406 7.691 364 H SER 48 H SER 48 94.568 3.626 8.187 365 HA SER 48 HA SER 48 96.217 1.887 6.781 366 HB2 SER 48 HB2 SER 48 93.918 3.197 5.374 367 HB3 SER 48 HB3 SER 48 94.416 1.510 5.369 368 HG SER 48 HG SER 48 92.613 1.828 6.667 369 HA PRO 49 HA PRO 49 98.758 3.948 3.946 370 HB2 PRO 49 HB2 PRO 49 97.188 3.142 1.543 371 HB3 PRO 49 HB3 PRO 49 98.908 2.901 1.902 372 HG2 PRO 49 HG2 PRO 49 97.149 0.904 2.040 373 HG3 PRO 49 HG3 PRO 49 98.527 1.021 3.148 374 HD2 PRO 49 HD2 PRO 49 95.645 1.543 3.676 375 HD3 PRO 49 HD3 PRO 49 96.908 0.963 4.783 376 H VAL 50 H VAL 50 98.860 6.091 3.598 377 HA VAL 50 HA VAL 50 96.416 7.567 3.028 378 HB VAL 50 HB VAL 50 99.215 8.572 3.591 379 HG11 VAL 50 HG11 VAL 50 98.043 10.708 4.070 380 HG12 VAL 50 HG12 VAL 50 96.526 9.978 3.544 381 HG13 VAL 50 HG13 VAL 50 97.838 10.213 2.389 382 HG21 VAL 50 HG21 VAL 50 98.437 8.949 5.855 383 HG22 VAL 50 HG22 VAL 50 98.118 7.263 5.451 384 HG23 VAL 50 HG23 VAL 50 96.804 8.439 5.429 385 HA PRO 51 HA PRO 51 97.583 7.433 -1.396 386 HB2 PRO 51 HB2 PRO 51 95.871 9.873 -1.558 387 HB3 PRO 51 HB3 PRO 51 95.843 8.407 -2.558 388 HG2 PRO 51 HG2 PRO 51 93.986 8.858 -0.713 389 HG3 PRO 51 HG3 PRO 51 94.598 7.225 -1.037 390 HD2 PRO 51 HD2 PRO 51 95.167 9.017 1.281 391 HD3 PRO 51 HD3 PRO 51 95.086 7.243 1.215 392 H LEU 52 H LEU 52 98.914 8.719 -2.801 393 HA LEU 52 HA LEU 52 100.828 10.259 -1.407 394 HB2 LEU 52 HB2 LEU 52 100.345 10.101 -4.393 395 HB3 LEU 52 HB3 LEU 52 101.813 10.689 -3.613 396 HG LEU 52 HG LEU 52 100.694 7.893 -3.264 397 HD11 LEU 52 HD11 LEU 52 101.457 7.928 -5.488 398 HD12 LEU 52 HD12 LEU 52 102.879 7.384 -4.597 399 HD13 LEU 52 HD13 LEU 52 102.757 9.063 -5.122 400 HD21 LEU 52 HD21 LEU 52 103.231 9.285 -2.364 401 HD22 LEU 52 HD22 LEU 52 103.054 7.531 -2.368 402 HD23 LEU 52 HD23 LEU 52 102.006 8.520 -1.352 403 HA PRO 53 HA PRO 53 98.898 14.253 -1.778 404 HB2 PRO 53 HB2 PRO 53 100.978 15.927 -1.354 405 HB3 PRO 53 HB3 PRO 53 100.328 14.896 -0.063 406 HG2 PRO 53 HG2 PRO 53 102.788 14.570 -1.681 407 HG3 PRO 53 HG3 PRO 53 102.485 14.163 0.016 408 HD2 PRO 53 HD2 PRO 53 102.467 12.339 -2.100 409 HD3 PRO 53 HD3 PRO 53 101.749 12.066 -0.500 410 H SER 54 H SER 54 98.938 16.285 -3.072 411 HA SER 54 HA SER 54 99.144 15.757 -5.794 412 HB2 SER 54 HB2 SER 54 99.278 18.499 -4.519 413 HB3 SER 54 HB3 SER 54 98.737 18.114 -6.149 414 HG SER 54 HG SER 54 96.946 17.315 -5.312 415 HA PRO 55 HA PRO 55 103.472 16.011 -6.263 416 HB2 PRO 55 HB2 PRO 55 103.769 16.081 -8.947 417 HB3 PRO 55 HB3 PRO 55 103.112 14.661 -8.108 418 HG2 PRO 55 HG2 PRO 55 101.707 16.750 -9.667 419 HG3 PRO 55 HG3 PRO 55 101.355 15.021 -9.512 420 HD2 PRO 55 HD2 PRO 55 100.033 17.068 -8.134 421 HD3 PRO 55 HD3 PRO 55 100.003 15.345 -7.704 422 H THR 56 H THR 56 104.643 17.745 -5.653 423 HA THR 56 HA THR 56 104.447 20.317 -6.942 424 HB THR 56 HB THR 56 106.427 20.888 -5.607 425 HG1 THR 56 HG1 THR 56 107.253 18.671 -5.847 426 HG21 THR 56 HG21 THR 56 104.402 19.224 -4.084 427 HG22 THR 56 HG22 THR 56 104.243 20.932 -4.493 428 HG23 THR 56 HG23 THR 56 105.491 20.409 -3.363 429 H SER 57 H SER 57 106.394 21.252 -8.131 430 HA SER 57 HA SER 57 106.677 19.774 -10.472 431 HB2 SER 57 HB2 SER 57 108.429 22.005 -9.424 432 HB3 SER 57 HB3 SER 57 108.447 21.404 -11.079 433 HG SER 57 HG SER 57 106.711 23.046 -9.888 434 H ASN 58 H ASN 58 107.799 18.053 -10.961 435 HA ASN 58 HA ASN 58 109.547 16.625 -11.261 436 HB2 ASN 58 HB2 ASN 58 111.156 18.852 -10.011 437 HB3 ASN 58 HB3 ASN 58 111.817 17.469 -10.880 438 HD21 ASN 58 HD21 ASN 58 111.677 20.526 -11.501 439 HD22 ASN 58 HD22 ASN 58 111.097 20.565 -13.095 440 H LYS 59 H LYS 59 108.200 17.004 -8.353 441 HA LYS 59 HA LYS 59 109.765 14.878 -7.201 442 HB2 LYS 59 HB2 LYS 59 110.538 16.030 -5.232 443 HB3 LYS 59 HB3 LYS 59 111.125 16.871 -6.663 444 HG2 LYS 59 HG2 LYS 59 109.217 18.478 -6.441 445 HG3 LYS 59 HG3 LYS 59 108.769 17.677 -4.934 446 HD2 LYS 59 HD2 LYS 59 111.144 18.136 -4.131 447 HD3 LYS 59 HD3 LYS 59 111.318 19.189 -5.536 448 HE2 LYS 59 HE2 LYS 59 109.252 20.417 -4.766 449 HE3 LYS 59 HE3 LYS 59 109.314 19.468 -3.282 450 HZ1 LYS 59 HZ1 LYS 59 111.278 20.452 -2.629 451 HZ2 LYS 59 HZ2 LYS 59 110.461 21.754 -3.355 452 HZ3 LYS 59 HZ3 LYS 59 111.692 20.943 -4.199 453 H GLN 60 H GLN 60 108.929 13.997 -5.257 454 HA GLN 60 HA GLN 60 106.413 15.063 -4.203 455 HB2 GLN 60 HB2 GLN 60 106.743 12.215 -5.170 456 HB3 GLN 60 HB3 GLN 60 105.443 12.748 -4.105 457 HG2 GLN 60 HG2 GLN 60 104.786 14.429 -5.843 458 HG3 GLN 60 HG3 GLN 60 106.003 13.726 -6.910 459 HE21 GLN 60 HE21 GLN 60 102.770 13.237 -5.566 460 HE22 GLN 60 HE22 GLN 60 102.463 11.797 -6.407 461 H ASP 61 H ASP 61 105.996 14.427 -2.039 462 HA ASP 61 HA ASP 61 108.324 13.364 -0.607 463 HB2 ASP 61 HB2 ASP 61 105.714 14.530 0.395 464 HB3 ASP 61 HB3 ASP 61 107.041 13.997 1.424 465 H ILE 62 H ILE 62 108.438 11.286 0.052 466 HA ILE 62 HA ILE 62 105.929 9.704 0.132 467 HB ILE 62 HB ILE 62 107.242 9.251 -1.924 468 HG12 ILE 62 HG12 ILE 62 107.507 6.721 -1.433 469 HG13 ILE 62 HG13 ILE 62 106.908 7.118 0.176 470 HG21 ILE 62 HG21 ILE 62 109.405 8.094 -1.741 471 HG22 ILE 62 HG22 ILE 62 109.362 8.278 0.012 472 HG23 ILE 62 HG23 ILE 62 109.491 9.702 -1.021 473 HD11 ILE 62 HD11 ILE 62 105.191 6.447 -1.677 474 HD12 ILE 62 HD12 ILE 62 105.435 8.095 -2.254 475 HD13 ILE 62 HD13 ILE 62 104.821 7.814 -0.625 476 H SER 63 H SER 63 105.768 8.161 1.780 477 HA SER 63 HA SER 63 108.008 7.934 3.651 478 HB2 SER 63 HB2 SER 63 106.794 8.721 5.553 479 HB3 SER 63 HB3 SER 63 106.647 9.953 4.306 480 HG SER 63 HG SER 63 104.605 9.360 4.033 481 H GLU 64 H GLU 64 107.597 6.371 5.385 482 HA GLU 64 HA GLU 64 106.663 3.925 4.475 483 HB2 GLU 64 HB2 GLU 64 106.747 3.209 6.846 484 HB3 GLU 64 HB3 GLU 64 108.186 4.103 6.362 485 HG2 GLU 64 HG2 GLU 64 107.186 6.169 7.317 486 HG3 GLU 64 HG3 GLU 64 105.820 5.219 7.887 487 H ALA 65 H ALA 65 104.925 6.465 6.226 488 HA ALA 65 HA ALA 65 102.633 4.997 6.918 489 HB1 ALA 65 HB1 ALA 65 102.688 7.093 7.909 490 HB2 ALA 65 HB2 ALA 65 101.524 7.364 6.611 491 HB3 ALA 65 HB3 ALA 65 103.195 7.898 6.423 492 H ASN 66 H ASN 66 103.506 6.671 3.919 493 HA ASN 66 HA ASN 66 100.963 6.458 2.682 494 HB2 ASN 66 HB2 ASN 66 103.691 6.665 1.390 495 HB3 ASN 66 HB3 ASN 66 102.142 6.987 0.612 496 HD21 ASN 66 HD21 ASN 66 100.795 8.775 1.724 497 HD22 ASN 66 HD22 ASN 66 101.645 10.091 2.377 498 H LEU 67 H LEU 67 103.891 4.430 2.463 499 HA LEU 67 HA LEU 67 102.501 2.644 0.623 500 HB2 LEU 67 HB2 LEU 67 105.327 2.413 1.652 501 HB3 LEU 67 HB3 LEU 67 104.624 1.559 0.284 502 HG LEU 67 HG LEU 67 105.050 4.553 0.499 503 HD11 LEU 67 HD11 LEU 67 106.318 3.051 -1.720 504 HD12 LEU 67 HD12 LEU 67 106.938 2.647 -0.128 505 HD13 LEU 67 HD13 LEU 67 106.963 4.317 -0.682 506 HD21 LEU 67 HD21 LEU 67 104.411 4.394 -2.009 507 HD22 LEU 67 HD22 LEU 67 103.108 4.332 -0.820 508 HD23 LEU 67 HD23 LEU 67 103.683 2.846 -1.578 509 H ALA 68 H ALA 68 102.853 2.741 4.003 510 HA ALA 68 HA ALA 68 102.320 1.239 5.637 511 HB1 ALA 68 HB1 ALA 68 101.066 -0.273 3.326 512 HB2 ALA 68 HB2 ALA 68 100.279 0.971 4.296 513 HB3 ALA 68 HB3 ALA 68 100.749 -0.558 5.036 514 H TYR 69 H TYR 69 102.270 -1.819 4.972 515 HA TYR 69 HA TYR 69 104.847 -2.325 5.932 516 HB2 TYR 69 HB2 TYR 69 102.942 -4.147 4.469 517 HB3 TYR 69 HB3 TYR 69 104.381 -4.683 5.317 518 HD1 TYR 69 HD2 TYR 69 104.528 -4.398 7.811 519 HD2 TYR 69 HD1 TYR 69 100.914 -3.646 5.613 520 HE1 TYR 69 HE2 TYR 69 103.221 -4.529 9.915 521 HE2 TYR 69 HE1 TYR 69 99.608 -3.778 7.717 522 HH TYR 69 HH TYR 69 99.856 -3.745 10.017 523 H LEU 70 H LEU 70 103.778 -1.821 2.664 524 HA LEU 70 HA LEU 70 105.739 -3.271 1.258 525 HB2 LEU 70 HB2 LEU 70 104.183 -0.790 0.556 526 HB3 LEU 70 HB3 LEU 70 105.324 -1.538 -0.561 527 HG LEU 70 HG LEU 70 104.021 -3.739 -0.022 528 HD11 LEU 70 HD11 LEU 70 102.154 -1.564 0.926 529 HD12 LEU 70 HD12 LEU 70 102.593 -3.064 1.744 530 HD13 LEU 70 HD13 LEU 70 101.541 -3.106 0.329 531 HD21 LEU 70 HD21 LEU 70 102.583 -1.619 -1.635 532 HD22 LEU 70 HD22 LEU 70 102.623 -3.357 -1.929 533 HD23 LEU 70 HD23 LEU 70 104.072 -2.386 -2.187 534 H TRP 71 H TRP 71 106.049 -0.352 3.099 535 HA TRP 71 HA TRP 71 108.109 0.990 1.809 536 HB2 TRP 71 HB2 TRP 71 106.772 1.698 3.830 537 HB3 TRP 71 HB3 TRP 71 107.838 0.690 4.788 538 HD1 TRP 71 HD1 TRP 71 109.887 1.842 5.718 539 HE1 TRP 71 HE1 TRP 71 111.147 4.032 5.226 540 HE3 TRP 71 HE3 TRP 71 107.341 3.430 1.586 541 HZ2 TRP 71 HZ2 TRP 71 111.112 6.167 3.319 542 HZ3 TRP 71 HZ3 TRP 71 107.984 5.529 0.447 543 HH2 TRP 71 HH2 TRP 71 109.857 6.904 1.307 544 HA PRO 72 HA PRO 72 111.020 -2.431 2.669 545 HB2 PRO 72 HB2 PRO 72 112.715 -2.136 0.620 546 HB3 PRO 72 HB3 PRO 72 111.054 -2.710 0.360 547 HG2 PRO 72 HG2 PRO 72 112.218 -0.025 -0.127 548 HG3 PRO 72 HG3 PRO 72 111.008 -0.921 -1.063 549 HD2 PRO 72 HD2 PRO 72 110.455 1.103 0.796 550 HD3 PRO 72 HD3 PRO 72 109.282 -0.067 0.156 551 H LEU 73 H LEU 73 111.739 0.936 2.734 552 HA LEU 73 HA LEU 73 114.591 0.575 3.256 553 HB2 LEU 73 HB2 LEU 73 112.926 3.100 3.326 554 HB3 LEU 73 HB3 LEU 73 114.685 2.998 3.340 555 HG LEU 73 HG LEU 73 112.913 2.001 1.092 556 HD11 LEU 73 HD11 LEU 73 112.924 4.464 1.331 557 HD12 LEU 73 HD12 LEU 73 113.781 3.958 -0.133 558 HD13 LEU 73 HD13 LEU 73 114.686 4.453 1.300 559 HD21 LEU 73 HD21 LEU 73 115.130 1.906 -0.114 560 HD22 LEU 73 HD22 LEU 73 114.988 0.742 1.202 561 HD23 LEU 73 HD23 LEU 73 115.923 2.219 1.430 562 H THR 74 H THR 74 115.613 0.924 5.157 563 HA THR 74 HA THR 74 114.215 0.597 7.608 564 HB THR 74 HB THR 74 116.402 0.928 8.658 565 HG1 THR 74 HG1 THR 74 117.339 2.465 7.493 566 HG21 THR 74 HG21 THR 74 117.541 -0.926 7.633 567 HG22 THR 74 HG22 THR 74 116.734 -0.640 6.091 568 HG23 THR 74 HG23 THR 74 115.811 -1.228 7.476 569 H VAL 75 H VAL 75 115.594 3.422 5.931 570 HA VAL 75 HA VAL 75 115.042 5.270 8.038 571 HB VAL 75 HB VAL 75 115.225 7.018 6.296 572 HG11 VAL 75 HG11 VAL 75 117.557 6.277 5.470 573 HG12 VAL 75 HG12 VAL 75 117.271 4.800 6.389 574 HG13 VAL 75 HG13 VAL 75 117.305 6.359 7.213 575 HG21 VAL 75 HG21 VAL 75 115.799 6.290 3.972 576 HG22 VAL 75 HG22 VAL 75 114.149 5.875 4.430 577 HG23 VAL 75 HG23 VAL 75 115.402 4.636 4.427 578 H ASP 76 H ASP 76 113.155 6.302 8.559 579 HA ASP 76 HA ASP 76 110.826 4.854 7.902 580 HB2 ASP 76 HB2 ASP 76 111.144 7.521 9.295 581 HB3 ASP 76 HB3 ASP 76 109.634 6.617 9.212 582 H HIS 77 H HIS 77 112.130 7.856 6.584 583 HA HIS 77 HA HIS 77 110.105 7.689 4.488 584 HB2 HIS 77 HB2 HIS 77 109.572 10.108 4.694 585 HB3 HIS 77 HB3 HIS 77 108.984 9.130 6.023 586 HD1 HIS 77 HD1 HIS 77 111.022 9.073 8.074 587 HD2 HIS 77 HD2 HIS 77 110.614 12.440 5.649 588 HE1 HIS 77 HE1 HIS 77 112.083 10.994 9.334 589 H GLY 78 H GLY 78 110.538 9.452 2.812 590 HA2 GLY 78 HA2 GLY 78 113.078 10.733 2.709 591 HA3 GLY 78 HA3 GLY 78 113.052 9.287 1.704 592 H THR 79 H THR 79 113.374 11.836 0.628 593 HA THR 79 HA THR 79 110.776 12.369 -0.688 594 HB THR 79 HB THR 79 113.185 14.177 -0.823 595 HG1 THR 79 HG1 THR 79 112.470 15.084 1.022 596 HG21 THR 79 HG21 THR 79 111.153 15.813 -0.929 597 HG22 THR 79 HG22 THR 79 110.205 14.358 -1.251 598 HG23 THR 79 HG23 THR 79 111.507 14.827 -2.349 599 H ILE 80 H ILE 80 110.608 12.221 -2.900 600 HA ILE 80 HA ILE 80 112.949 11.069 -4.298 601 HB ILE 80 HB ILE 80 111.280 10.159 -5.900 602 HG12 ILE 80 HG12 ILE 80 109.246 11.129 -3.863 603 HG13 ILE 80 HG13 ILE 80 109.499 11.865 -5.444 604 HG21 ILE 80 HG21 ILE 80 110.438 8.418 -4.363 605 HG22 ILE 80 HG22 ILE 80 110.831 9.449 -2.986 606 HG23 ILE 80 HG23 ILE 80 112.119 8.822 -4.013 607 HD11 ILE 80 HD11 ILE 80 108.320 9.196 -4.773 608 HD12 ILE 80 HD12 ILE 80 109.147 9.404 -6.317 609 HD13 ILE 80 HD13 ILE 80 107.755 10.415 -5.920 610 H GLU 81 H GLU 81 113.757 12.047 -6.082 611 HA GLU 81 HA GLU 81 112.291 14.302 -7.246 612 HB2 GLU 81 HB2 GLU 81 113.628 15.207 -5.346 613 HB3 GLU 81 HB3 GLU 81 115.088 14.620 -6.144 614 HG2 GLU 81 HG2 GLU 81 114.509 15.989 -8.142 615 HG3 GLU 81 HG3 GLU 81 113.117 16.625 -7.277 616 H CYS 82 H CYS 82 112.704 14.655 -9.332 617 HA CYS 82 HA CYS 82 114.882 13.149 -10.632 618 HB2 CYS 82 HB2 CYS 82 112.391 14.496 -11.692 619 HB3 CYS 82 HB3 CYS 82 113.687 13.938 -12.749 620 H LEU 83 H LEU 83 116.719 14.228 -11.091 621 HA LEU 83 HA LEU 83 116.766 17.096 -10.536 622 HB2 LEU 83 HB2 LEU 83 119.048 15.209 -11.151 623 HB3 LEU 83 HB3 LEU 83 119.196 16.866 -10.569 624 HG LEU 83 HG LEU 83 117.695 14.717 -9.055 625 HD11 LEU 83 HD11 LEU 83 120.098 14.123 -9.309 626 HD12 LEU 83 HD12 LEU 83 119.683 14.515 -7.641 627 HD13 LEU 83 HD13 LEU 83 120.537 15.694 -8.637 628 HD21 LEU 83 HD21 LEU 83 117.035 16.939 -8.408 629 HD22 LEU 83 HD22 LEU 83 118.708 17.497 -8.401 630 HD23 LEU 83 HD23 LEU 83 118.152 16.362 -7.171 631 HA PRO 84 HA PRO 84 116.930 18.616 -14.688 632 HB2 PRO 84 HB2 PRO 84 119.522 19.941 -14.039 633 HB3 PRO 84 HB3 PRO 84 118.041 20.631 -14.731 634 HG2 PRO 84 HG2 PRO 84 118.711 21.063 -12.199 635 HG3 PRO 84 HG3 PRO 84 117.021 20.849 -12.689 636 HD2 PRO 84 HD2 PRO 84 118.812 18.945 -11.249 637 HD3 PRO 84 HD3 PRO 84 117.052 19.157 -11.122 638 H SER 85 H SER 85 119.588 16.821 -13.368 639 HA SER 85 HA SER 85 121.117 16.639 -15.800 640 HB2 SER 85 HB2 SER 85 122.555 15.187 -14.594 641 HB3 SER 85 HB3 SER 85 122.021 16.412 -13.447 642 HG SER 85 HG SER 85 121.339 14.754 -12.378 643 H ASP 86 H ASP 86 118.171 15.279 -15.090 644 HA ASP 86 HA ASP 86 116.942 13.634 -16.080 645 HB2 ASP 86 HB2 ASP 86 118.228 14.443 -18.140 646 HB3 ASP 86 HB3 ASP 86 119.285 13.054 -17.889 647 H ASN 87 H ASN 87 118.343 13.089 -13.756 648 HA ASN 87 HA ASN 87 118.533 10.155 -14.021 649 HB2 ASN 87 HB2 ASN 87 120.330 10.068 -12.398 650 HB3 ASN 87 HB3 ASN 87 120.820 11.081 -13.751 651 HD21 ASN 87 HD21 ASN 87 122.115 11.371 -11.258 652 HD22 ASN 87 HD22 ASN 87 121.679 12.863 -10.575 653 H ALA 88 H ALA 88 117.607 9.009 -12.312 654 HA ALA 88 HA ALA 88 115.823 10.628 -10.612 655 HB1 ALA 88 HB1 ALA 88 114.306 8.907 -10.710 656 HB2 ALA 88 HB2 ALA 88 115.552 7.664 -10.815 657 HB3 ALA 88 HB3 ALA 88 115.141 8.625 -12.235 658 H VAL 89 H VAL 89 116.252 10.830 -8.495 659 HA VAL 89 HA VAL 89 117.900 8.751 -7.183 660 HB VAL 89 HB VAL 89 119.120 10.532 -5.980 661 HG11 VAL 89 HG11 VAL 89 119.191 10.419 -8.992 662 HG12 VAL 89 HG12 VAL 89 120.297 9.677 -7.835 663 HG13 VAL 89 HG13 VAL 89 120.329 11.420 -8.092 664 HG21 VAL 89 HG21 VAL 89 117.839 12.427 -7.969 665 HG22 VAL 89 HG22 VAL 89 118.912 12.841 -6.631 666 HG23 VAL 89 HG23 VAL 89 117.282 12.254 -6.304 667 H PHE 90 H PHE 90 117.768 8.716 -4.909 668 HA PHE 90 HA PHE 90 115.205 9.676 -3.792 669 HB2 PHE 90 HB2 PHE 90 115.315 7.257 -3.993 670 HB3 PHE 90 HB3 PHE 90 116.874 7.228 -3.203 671 HD1 PHE 90 HD1 PHE 90 113.273 8.059 -2.653 672 HD2 PHE 90 HD2 PHE 90 117.028 6.966 -0.879 673 HE1 PHE 90 HE1 PHE 90 112.141 7.709 -0.467 674 HE2 PHE 90 HE2 PHE 90 115.897 6.607 1.298 675 HZ PHE 90 HZ PHE 90 113.452 6.980 1.501 676 H VAL 91 H VAL 91 115.353 11.045 -2.086 677 HA VAL 91 HA VAL 91 117.994 11.407 -0.800 678 HB VAL 91 HB VAL 91 115.617 13.286 -0.913 679 HG11 VAL 91 HG11 VAL 91 116.845 14.845 0.271 680 HG12 VAL 91 HG12 VAL 91 118.398 14.137 -0.173 681 HG13 VAL 91 HG13 VAL 91 117.403 13.374 1.061 682 HG21 VAL 91 HG21 VAL 91 117.092 14.611 -2.434 683 HG22 VAL 91 HG22 VAL 91 116.632 13.050 -3.112 684 HG23 VAL 91 HG23 VAL 91 118.242 13.274 -2.429 685 H ALA 92 H ALA 92 118.204 10.880 1.308 686 HA ALA 92 HA ALA 92 115.752 10.112 2.778 687 HB1 ALA 92 HB1 ALA 92 118.679 9.474 3.180 688 HB2 ALA 92 HB2 ALA 92 117.364 8.361 2.804 689 HB3 ALA 92 HB3 ALA 92 117.454 9.112 4.397 690 HA PRO 93 HA PRO 93 115.676 13.590 5.488 691 HB2 PRO 93 HB2 PRO 93 115.982 11.755 7.820 692 HB3 PRO 93 HB3 PRO 93 114.754 12.995 7.512 693 HG2 PRO 93 HG2 PRO 93 114.270 10.368 7.244 694 HG3 PRO 93 HG3 PRO 93 113.466 11.606 6.266 695 HD2 PRO 93 HD2 PRO 93 115.520 9.644 5.452 696 HD3 PRO 93 HD3 PRO 93 114.341 10.530 4.466 697 H ASP 94 H ASP 94 118.199 11.204 5.910 698 HA ASP 94 HA ASP 94 119.801 12.632 7.758 699 HB2 ASP 94 HB2 ASP 94 121.619 11.107 6.964 700 HB3 ASP 94 HB3 ASP 94 120.153 10.289 7.485 701 H GLY 95 H GLY 95 119.175 13.334 4.478 702 HA2 GLY 95 HA2 GLY 95 119.987 15.216 3.312 703 HA3 GLY 95 HA3 GLY 95 121.334 15.308 4.444 704 H THR 96 H THR 96 120.876 12.143 3.302 705 HA THR 96 HA THR 96 123.214 12.375 1.540 706 HB THR 96 HB THR 96 121.867 9.928 2.714 707 HG1 THR 96 HG1 THR 96 122.823 11.104 4.305 708 HG21 THR 96 HG21 THR 96 123.088 9.288 0.770 709 HG22 THR 96 HG22 THR 96 124.137 8.914 2.137 710 HG23 THR 96 HG23 THR 96 124.431 10.361 1.172 711 H THR 97 H THR 97 123.077 11.856 -0.611 712 HA THR 97 HA THR 97 120.377 11.260 -1.650 713 HB THR 97 HB THR 97 122.825 12.240 -3.147 714 HG1 THR 97 HG1 THR 97 120.608 13.623 -2.189 715 HG21 THR 97 HG21 THR 97 121.272 12.682 -4.946 716 HG22 THR 97 HG22 THR 97 119.901 12.227 -3.935 717 HG23 THR 97 HG23 THR 97 121.062 11.003 -4.449 718 H TYR 98 H TYR 98 119.949 9.378 -2.515 719 HA TYR 98 HA TYR 98 122.140 7.492 -3.122 720 HB2 TYR 98 HB2 TYR 98 119.305 6.930 -2.245 721 HB3 TYR 98 HB3 TYR 98 120.513 5.715 -2.610 722 HD1 TYR 98 HD2 TYR 98 122.415 5.342 -1.055 723 HD2 TYR 98 HD1 TYR 98 119.279 8.138 -0.163 724 HE1 TYR 98 HE2 TYR 98 123.122 5.382 1.322 725 HE2 TYR 98 HE1 TYR 98 119.996 8.189 2.207 726 HH TYR 98 HH TYR 98 121.576 7.492 3.659 727 H ALA 99 H ALA 99 121.860 6.194 -5.012 728 HA ALA 99 HA ALA 99 120.333 7.526 -7.102 729 HB1 ALA 99 HB1 ALA 99 122.454 5.397 -7.034 730 HB2 ALA 99 HB2 ALA 99 122.480 6.962 -7.845 731 HB3 ALA 99 HB3 ALA 99 121.496 5.651 -8.491 732 H LEU 100 H LEU 100 118.435 6.832 -7.900 733 HA LEU 100 HA LEU 100 117.247 4.408 -6.788 734 HB2 LEU 100 HB2 LEU 100 116.206 6.712 -8.420 735 HB3 LEU 100 HB3 LEU 100 115.273 5.229 -8.257 736 HG LEU 100 HG LEU 100 116.357 6.641 -5.824 737 HD11 LEU 100 HD11 LEU 100 113.685 7.113 -7.177 738 HD12 LEU 100 HD12 LEU 100 115.028 8.251 -7.209 739 HD13 LEU 100 HD13 LEU 100 114.236 7.864 -5.682 740 HD21 LEU 100 HD21 LEU 100 113.848 4.988 -6.227 741 HD22 LEU 100 HD22 LEU 100 114.631 5.404 -4.703 742 HD23 LEU 100 HD23 LEU 100 115.399 4.263 -5.805 743 H ASN 101 H ASN 101 117.728 5.847 -10.009 744 HA ASN 101 HA ASN 101 117.394 3.146 -11.184 745 HB2 ASN 101 HB2 ASN 101 116.774 4.235 -13.240 746 HB3 ASN 101 HB3 ASN 101 115.804 4.892 -11.928 747 HD21 ASN 101 HD21 ASN 101 115.735 6.606 -13.898 748 HD22 ASN 101 HD22 ASN 101 116.859 7.870 -13.754 749 H ASP 102 H ASP 102 118.681 2.623 -13.081 750 HA ASP 102 HA ASP 102 121.351 2.447 -12.478 751 HB2 ASP 102 HB2 ASP 102 120.112 1.118 -14.199 752 HB3 ASP 102 HB3 ASP 102 120.242 2.497 -15.286 753 H ARG 103 H ARG 103 119.745 5.008 -14.278 754 HA ARG 103 HA ARG 103 122.029 6.221 -15.406 755 HB2 ARG 103 HB2 ARG 103 119.341 7.354 -14.597 756 HB3 ARG 103 HB3 ARG 103 120.531 8.213 -15.581 757 HG2 ARG 103 HG2 ARG 103 120.453 6.477 -17.284 758 HG3 ARG 103 HG3 ARG 103 119.376 5.499 -16.286 759 HD2 ARG 103 HD2 ARG 103 118.059 6.676 -17.964 760 HD3 ARG 103 HD3 ARG 103 117.690 7.329 -16.371 761 HE ARG 103 HE ARG 103 118.678 9.328 -16.999 762 HH11 ARG 103 HH11 ARG 103 119.450 6.912 -19.422 763 HH12 ARG 103 HH12 ARG 103 120.172 8.075 -20.481 764 HH21 ARG 103 HH21 ARG 103 119.604 10.750 -18.351 765 HH22 ARG 103 HH22 ARG 103 120.261 10.254 -19.881 766 H ALA 104 H ALA 104 120.296 6.878 -12.361 767 HA ALA 104 HA ALA 104 121.928 8.905 -11.387 768 HB1 ALA 104 HB1 ALA 104 120.417 6.745 -9.914 769 HB2 ALA 104 HB2 ALA 104 119.872 8.383 -10.272 770 HB3 ALA 104 HB3 ALA 104 121.181 8.123 -9.119 771 H GLU 105 H GLU 105 122.406 5.371 -11.169 772 HA GLU 105 HA GLU 105 124.781 5.522 -9.627 773 HB2 GLU 105 HB2 GLU 105 123.751 3.419 -11.506 774 HB3 GLU 105 HB3 GLU 105 125.362 3.294 -10.804 775 HG2 GLU 105 HG2 GLU 105 124.008 2.121 -9.280 776 HG3 GLU 105 HG3 GLU 105 124.194 3.703 -8.536 777 H LYS 106 H LYS 106 124.263 5.664 -13.134 778 HA LYS 106 HA LYS 106 126.946 5.748 -13.937 779 HB2 LYS 106 HB2 LYS 106 124.994 5.587 -15.479 780 HB3 LYS 106 HB3 LYS 106 124.656 7.291 -15.175 781 HG2 LYS 106 HG2 LYS 106 126.940 7.861 -15.980 782 HG3 LYS 106 HG3 LYS 106 127.203 6.159 -16.366 783 HD2 LYS 106 HD2 LYS 106 125.191 6.244 -17.860 784 HD3 LYS 106 HD3 LYS 106 125.100 7.981 -17.566 785 HE2 LYS 106 HE2 LYS 106 127.293 8.322 -18.540 786 HE3 LYS 106 HE3 LYS 106 127.543 6.583 -18.688 787 HZ1 LYS 106 HZ1 LYS 106 125.657 6.484 -20.203 788 HZ2 LYS 106 HZ2 LYS 106 126.854 7.539 -20.787 789 HZ3 LYS 106 HZ3 LYS 106 125.444 8.162 -20.074 790 H ALA 107 H ALA 107 124.880 8.270 -12.617 791 HA ALA 107 HA ALA 107 126.698 10.435 -13.041 792 HB1 ALA 107 HB1 ALA 107 124.431 10.206 -11.056 793 HB2 ALA 107 HB2 ALA 107 124.273 10.755 -12.725 794 HB3 ALA 107 HB3 ALA 107 125.222 11.695 -11.574 795 H GLY 108 H GLY 108 127.194 7.828 -11.119 796 HA2 GLY 108 HA2 GLY 108 128.766 7.421 -9.523 797 HA3 GLY 108 HA3 GLY 108 129.223 9.112 -9.594 798 H HIS 109 H HIS 109 125.883 8.308 -8.854 799 HA HIS 109 HA HIS 109 126.285 9.181 -6.103 800 HB2 HIS 109 HB2 HIS 109 123.847 8.554 -7.755 801 HB3 HIS 109 HB3 HIS 109 123.748 8.845 -6.029 802 HD1 HIS 109 HD1 HIS 109 125.422 11.252 -5.560 803 HD2 HIS 109 HD2 HIS 109 123.088 10.874 -8.994 804 HE1 HIS 109 HE1 HIS 109 125.046 13.598 -6.431 805 HA PRO 110 HA PRO 110 126.442 4.937 -4.738 806 HB2 PRO 110 HB2 PRO 110 125.827 5.167 -2.096 807 HB3 PRO 110 HB3 PRO 110 127.382 5.700 -2.765 808 HG2 PRO 110 HG2 PRO 110 124.999 7.303 -2.014 809 HG3 PRO 110 HG3 PRO 110 126.721 7.679 -1.828 810 HD2 PRO 110 HD2 PRO 110 125.140 8.702 -3.843 811 HD3 PRO 110 HD3 PRO 110 126.904 8.526 -3.954 812 HA PRO 111 HA PRO 111 122.189 3.706 -5.017 813 HB2 PRO 111 HB2 PRO 111 122.319 1.050 -4.426 814 HB3 PRO 111 HB3 PRO 111 122.915 1.737 -5.948 815 HG2 PRO 111 HG2 PRO 111 124.418 0.814 -3.581 816 HG3 PRO 111 HG3 PRO 111 124.868 0.791 -5.291 817 HD2 PRO 111 HD2 PRO 111 125.773 2.651 -3.414 818 HD3 PRO 111 HD3 PRO 111 125.849 2.845 -5.177 819 H ILE 112 H ILE 112 120.315 2.989 -3.828 820 HA ILE 112 HA ILE 112 120.238 3.846 -1.150 821 HB ILE 112 HB ILE 112 118.251 2.137 -2.672 822 HG12 ILE 112 HG12 ILE 112 118.285 5.112 -2.118 823 HG13 ILE 112 HG13 ILE 112 118.851 4.400 -3.627 824 HG21 ILE 112 HG21 ILE 112 116.621 3.096 -0.986 825 HG22 ILE 112 HG22 ILE 112 118.005 3.703 -0.082 826 HG23 ILE 112 HG23 ILE 112 117.781 1.968 -0.292 827 HD11 ILE 112 HD11 ILE 112 116.053 4.043 -2.502 828 HD12 ILE 112 HD12 ILE 112 116.633 3.495 -4.077 829 HD13 ILE 112 HD13 ILE 112 116.487 5.221 -3.739 830 H THR 113 H THR 113 121.502 0.907 -2.298 831 HA THR 113 HA THR 113 120.414 -1.044 -0.772 832 HB THR 113 HB THR 113 122.191 -1.285 -2.533 833 HG1 THR 113 HG1 THR 113 122.514 -2.794 -0.228 834 HG21 THR 113 HG21 THR 113 124.029 0.000 -1.693 835 HG22 THR 113 HG22 THR 113 124.500 -1.690 -1.580 836 HG23 THR 113 HG23 THR 113 123.988 -0.825 -0.136 837 HA PRO 114 HA PRO 114 123.432 -0.313 2.931 838 HB2 PRO 114 HB2 PRO 114 123.215 2.618 3.322 839 HB3 PRO 114 HB3 PRO 114 124.633 1.560 3.461 840 HG2 PRO 114 HG2 PRO 114 124.359 3.234 1.420 841 HG3 PRO 114 HG3 PRO 114 125.073 1.622 1.206 842 HD2 PRO 114 HD2 PRO 114 122.295 2.550 0.539 843 HD3 PRO 114 HD3 PRO 114 123.377 1.504 -0.399 844 H ILE 115 H ILE 115 120.629 1.734 2.307 845 HA ILE 115 HA ILE 115 119.636 1.262 5.033 846 HB ILE 115 HB ILE 115 117.837 2.893 4.389 847 HG12 ILE 115 HG12 ILE 115 119.654 3.467 2.032 848 HG13 ILE 115 HG13 ILE 115 118.149 2.562 1.901 849 HG21 ILE 115 HG21 ILE 115 120.189 3.341 5.506 850 HG22 ILE 115 HG22 ILE 115 119.141 4.679 5.040 851 HG23 ILE 115 HG23 ILE 115 120.493 4.216 4.004 852 HD11 ILE 115 HD11 ILE 115 117.958 5.190 3.291 853 HD12 ILE 115 HD12 ILE 115 116.850 4.429 2.152 854 HD13 ILE 115 HD13 ILE 115 118.295 5.247 1.561 855 H ARG 116 H ARG 116 119.460 -0.479 2.278 856 HA ARG 116 HA ARG 116 116.614 -0.892 2.104 857 HB2 ARG 116 HB2 ARG 116 118.198 -1.142 0.184 858 HB3 ARG 116 HB3 ARG 116 118.855 -2.578 0.968 859 HG2 ARG 116 HG2 ARG 116 116.693 -3.684 0.874 860 HG3 ARG 116 HG3 ARG 116 115.936 -2.224 0.232 861 HD2 ARG 116 HD2 ARG 116 116.369 -3.697 -1.632 862 HD3 ARG 116 HD3 ARG 116 117.508 -2.359 -1.728 863 HE ARG 116 HE ARG 116 118.747 -4.388 -0.265 864 HH11 ARG 116 HH11 ARG 116 117.567 -3.937 -3.540 865 HH12 ARG 116 HH12 ARG 116 118.716 -5.044 -4.213 866 HH21 ARG 116 HH21 ARG 116 120.203 -5.802 -1.189 867 HH22 ARG 116 HH22 ARG 116 120.190 -6.086 -2.897 868 H ALA 117 H ALA 117 115.401 -2.453 3.058 869 HA ALA 117 HA ALA 117 116.499 -3.827 5.332 870 HB1 ALA 117 HB1 ALA 117 114.215 -2.817 5.274 871 HB2 ALA 117 HB2 ALA 117 114.216 -4.518 5.742 872 HB3 ALA 117 HB3 ALA 117 113.744 -4.053 4.106 873 H LYS 118 H LYS 118 116.632 -6.037 5.681 874 HA LYS 118 HA LYS 118 116.911 -7.719 3.319 875 HB2 LYS 118 HB2 LYS 118 117.254 -8.322 6.271 876 HB3 LYS 118 HB3 LYS 118 117.635 -9.435 4.958 877 HG2 LYS 118 HG2 LYS 118 119.240 -7.755 4.048 878 HG3 LYS 118 HG3 LYS 118 118.915 -6.731 5.448 879 HD2 LYS 118 HD2 LYS 118 119.636 -8.615 6.931 880 HD3 LYS 118 HD3 LYS 118 120.092 -9.524 5.490 881 HE2 LYS 118 HE2 LYS 118 122.124 -8.542 6.000 882 HE3 LYS 118 HE3 LYS 118 121.454 -7.306 4.936 883 HZ1 LYS 118 HZ1 LYS 118 120.867 -5.973 6.725 884 HZ2 LYS 118 HZ2 LYS 118 122.385 -6.582 7.182 885 HZ3 LYS 118 HZ3 LYS 118 120.967 -7.240 7.847 886 H GLY 119 H GLY 119 115.563 -9.462 2.807 887 HA2 GLY 119 HA2 GLY 119 112.919 -9.376 4.106 888 HA3 GLY 119 HA3 GLY 119 113.243 -9.981 2.495 889 H SER 120 H SER 120 111.786 -11.403 4.474 890 HA SER 120 HA SER 120 113.247 -13.329 5.884 891 HB2 SER 120 HB2 SER 120 110.565 -13.711 4.532 892 HB3 SER 120 HB3 SER 120 111.213 -14.661 5.865 893 HG SER 120 HG SER 120 110.202 -12.117 5.846 894 H GLY 121 H GLY 121 112.165 -13.283 2.511 895 HA2 GLY 121 HA2 GLY 121 114.206 -15.295 1.886 896 HA3 GLY 121 HA3 GLY 121 112.545 -15.633 1.403 897 H GLY 122 H GLY 122 114.578 -15.440 -0.485 898 HA2 GLY 122 HA2 GLY 122 114.785 -14.540 -2.607 899 HA3 GLY 122 HA3 GLY 122 113.489 -13.417 -2.214 900 H GLY 123 H GLY 123 116.443 -13.760 -0.315 901 HA2 GLY 123 HA2 GLY 123 118.261 -12.373 -0.026 902 HA3 GLY 123 HA3 GLY 123 117.890 -11.663 -1.593 903 H TYR 124 H TYR 124 117.448 -9.565 -1.526 904 HA TYR 124 HA TYR 124 116.551 -8.389 1.030 905 HB2 TYR 124 HB2 TYR 124 118.063 -7.270 -1.319 906 HB3 TYR 124 HB3 TYR 124 117.343 -6.240 -0.098 907 HD1 TYR 124 HD1 TYR 124 119.227 -9.492 0.127 908 HD2 TYR 124 HD2 TYR 124 119.032 -5.342 1.222 909 HE1 TYR 124 HE1 TYR 124 121.253 -9.765 1.519 910 HE2 TYR 124 HE2 TYR 124 121.060 -5.619 2.618 911 HH TYR 124 HH TYR 124 122.553 -8.745 3.058 912 H ILE 125 H ILE 125 115.078 -6.524 0.881 913 HA ILE 125 HA ILE 125 112.786 -7.320 -0.667 914 HB ILE 125 HB ILE 125 113.232 -5.001 1.234 915 HG12 ILE 125 HG12 ILE 125 111.707 -7.574 1.684 916 HG13 ILE 125 HG13 ILE 125 113.416 -7.425 2.079 917 HG21 ILE 125 HG21 ILE 125 110.618 -6.161 0.222 918 HG22 ILE 125 HG22 ILE 125 111.337 -4.673 -0.396 919 HG23 ILE 125 HG23 ILE 125 110.823 -4.770 1.287 920 HD11 ILE 125 HD11 ILE 125 113.032 -6.010 3.842 921 HD12 ILE 125 HD12 ILE 125 111.507 -6.890 3.868 922 HD13 ILE 125 HD13 ILE 125 111.590 -5.299 3.112 923 H SER 126 H SER 126 112.043 -6.483 -2.502 924 HA SER 126 HA SER 126 113.769 -5.000 -4.174 925 HB2 SER 126 HB2 SER 126 110.812 -5.549 -4.481 926 HB3 SER 126 HB3 SER 126 111.895 -4.997 -5.754 927 HG SER 126 HG SER 126 111.927 -7.148 -5.901 928 H LEU 127 H LEU 127 113.929 -2.933 -4.698 929 HA LEU 127 HA LEU 127 112.212 -0.957 -3.381 930 HB2 LEU 127 HB2 LEU 127 114.605 -0.536 -5.185 931 HB3 LEU 127 HB3 LEU 127 113.796 0.691 -4.214 932 HG LEU 127 HG LEU 127 115.183 -1.766 -3.100 933 HD11 LEU 127 HD11 LEU 127 116.877 -0.300 -3.931 934 HD12 LEU 127 HD12 LEU 127 116.767 0.032 -2.202 935 HD13 LEU 127 HD13 LEU 127 116.017 1.131 -3.360 936 HD21 LEU 127 HD21 LEU 127 114.941 -0.322 -0.963 937 HD22 LEU 127 HD22 LEU 127 113.498 -1.146 -1.555 938 HD23 LEU 127 HD23 LEU 127 113.724 0.574 -1.872 939 H GLY 128 H GLY 128 111.638 -2.763 -5.975 940 HA2 GLY 128 HA2 GLY 128 111.551 -1.255 -8.260 941 HA3 GLY 128 HA3 GLY 128 110.374 -2.505 -7.886 942 H ALA 129 H ALA 129 109.032 -1.292 -5.717 943 HA ALA 129 HA ALA 129 107.123 0.214 -7.127 944 HB1 ALA 129 HB1 ALA 129 106.013 0.499 -5.051 945 HB2 ALA 129 HB2 ALA 129 107.516 0.362 -4.139 946 HB3 ALA 129 HB3 ALA 129 106.831 -1.059 -4.927 947 H LEU 130 H LEU 130 109.599 1.295 -4.804 948 HA LEU 130 HA LEU 130 108.979 4.034 -4.885 949 HB2 LEU 130 HB2 LEU 130 110.462 2.960 -3.208 950 HB3 LEU 130 HB3 LEU 130 111.685 2.739 -4.459 951 HG LEU 130 HG LEU 130 111.618 5.246 -4.824 952 HD11 LEU 130 HD11 LEU 130 109.519 5.856 -3.873 953 HD12 LEU 130 HD12 LEU 130 110.733 6.499 -2.766 954 HD13 LEU 130 HD13 LEU 130 109.872 5.012 -2.365 955 HD21 LEU 130 HD21 LEU 130 113.212 3.847 -3.260 956 HD22 LEU 130 HD22 LEU 130 112.341 4.664 -1.963 957 HD23 LEU 130 HD23 LEU 130 113.223 5.606 -3.163 958 H LEU 131 H LEU 131 111.139 2.076 -6.895 959 HA LEU 131 HA LEU 131 112.348 4.178 -8.320 960 HB2 LEU 131 HB2 LEU 131 113.121 1.806 -8.320 961 HB3 LEU 131 HB3 LEU 131 111.725 1.382 -9.309 962 HG LEU 131 HG LEU 131 112.549 3.164 -10.963 963 HD11 LEU 131 HD11 LEU 131 114.129 4.443 -9.832 964 HD12 LEU 131 HD12 LEU 131 115.173 3.316 -10.696 965 HD13 LEU 131 HD13 LEU 131 114.811 3.051 -8.992 966 HD21 LEU 131 HD21 LEU 131 114.470 0.866 -10.543 967 HD22 LEU 131 HD22 LEU 131 113.946 1.582 -12.068 968 HD23 LEU 131 HD23 LEU 131 112.820 0.615 -11.115 969 H SER 132 H SER 132 109.385 2.330 -8.967 970 HA SER 132 HA SER 132 108.873 3.366 -11.526 971 HB2 SER 132 HB2 SER 132 106.842 2.480 -9.463 972 HB3 SER 132 HB3 SER 132 106.586 2.598 -11.201 973 HG SER 132 HG SER 132 107.193 0.500 -10.371 974 H THR 133 H THR 133 107.869 4.511 -8.311 975 HA THR 133 HA THR 133 106.161 6.567 -9.209 976 HB THR 133 HB THR 133 107.838 6.563 -6.688 977 HG1 THR 133 HG1 THR 133 106.605 4.734 -6.801 978 HG21 THR 133 HG21 THR 133 105.185 7.875 -7.344 979 HG22 THR 133 HG22 THR 133 106.735 8.714 -7.267 980 HG23 THR 133 HG23 THR 133 106.052 7.987 -5.812 981 H THR 134 H THR 134 109.627 6.615 -8.400 982 HA THR 134 HA THR 134 109.962 9.396 -8.783 983 HB THR 134 HB THR 134 112.082 7.272 -9.149 984 HG1 THR 134 HG1 THR 134 111.556 6.911 -7.160 985 HG21 THR 134 HG21 THR 134 112.290 10.099 -8.085 986 HG22 THR 134 HG22 THR 134 112.544 9.697 -9.783 987 HG23 THR 134 HG23 THR 134 113.607 9.022 -8.549 988 H LEU 135 H LEU 135 110.301 6.656 -11.020 989 HA LEU 135 HA LEU 135 111.362 8.086 -13.194 990 HB2 LEU 135 HB2 LEU 135 109.609 5.622 -13.132 991 HB3 LEU 135 HB3 LEU 135 110.403 6.235 -14.584 992 HG LEU 135 HG LEU 135 111.899 5.552 -12.041 993 HD11 LEU 135 HD11 LEU 135 111.212 3.890 -14.466 994 HD12 LEU 135 HD12 LEU 135 111.042 3.464 -12.762 995 HD13 LEU 135 HD13 LEU 135 112.644 3.548 -13.495 996 HD21 LEU 135 HD21 LEU 135 113.752 5.390 -13.883 997 HD22 LEU 135 HD22 LEU 135 113.249 6.985 -13.320 998 HD23 LEU 135 HD23 LEU 135 112.633 6.354 -14.848 999 H ASN 136 H ASN 136 108.008 7.574 -12.158 1000 HA ASN 136 HA ASN 136 106.713 8.659 -14.395 1001 HB2 ASN 136 HB2 ASN 136 105.921 8.751 -11.475 1002 HB3 ASN 136 HB3 ASN 136 104.852 9.153 -12.816 1003 HD21 ASN 136 HD21 ASN 136 104.397 6.945 -10.958 1004 HD22 ASN 136 HD22 ASN 136 104.462 5.512 -11.864 1005 H LEU 137 H LEU 137 107.963 10.231 -11.470 1006 HA LEU 137 HA LEU 137 107.190 12.866 -12.137 1007 HB2 LEU 137 HB2 LEU 137 109.579 11.962 -10.511 1008 HB3 LEU 137 HB3 LEU 137 108.882 13.580 -10.508 1009 HG LEU 137 HG LEU 137 107.395 11.061 -9.711 1010 HD11 LEU 137 HD11 LEU 137 107.512 12.359 -7.431 1011 HD12 LEU 137 HD12 LEU 137 108.911 13.145 -8.163 1012 HD13 LEU 137 HD13 LEU 137 108.895 11.396 -7.948 1013 HD21 LEU 137 HD21 LEU 137 106.689 14.010 -9.686 1014 HD22 LEU 137 HD22 LEU 137 105.786 12.800 -8.776 1015 HD23 LEU 137 HD23 LEU 137 105.847 12.713 -10.534 1016 H CYS 138 H CYS 138 110.123 11.036 -12.900 1017 HA CYS 138 HA CYS 138 111.575 13.076 -14.147 1018 HB2 CYS 138 HB2 CYS 138 111.520 10.096 -14.409 1019 HB3 CYS 138 HB3 CYS 138 112.473 11.042 -15.546 1020 H GLY 139 H GLY 139 108.781 11.312 -15.312 1021 HA2 GLY 139 HA2 GLY 139 107.417 12.098 -17.077 1022 HA3 GLY 139 HA3 GLY 139 108.790 12.990 -17.714 1023 H LYS 140 H LYS 140 109.266 9.650 -16.824 1024 HA LYS 140 HA LYS 140 109.948 8.958 -19.533 1025 HB2 LYS 140 HB2 LYS 140 111.115 8.025 -17.529 1026 HB3 LYS 140 HB3 LYS 140 109.643 7.137 -17.135 1027 HG2 LYS 140 HG2 LYS 140 109.740 6.038 -19.365 1028 HG3 LYS 140 HG3 LYS 140 111.264 6.869 -19.683 1029 HD2 LYS 140 HD2 LYS 140 112.212 5.802 -17.621 1030 HD3 LYS 140 HD3 LYS 140 110.721 4.870 -17.470 1031 HE2 LYS 140 HE2 LYS 140 112.462 3.563 -18.633 1032 HE3 LYS 140 HE3 LYS 140 111.098 3.892 -19.701 1033 HZ1 LYS 140 HZ1 LYS 140 113.239 5.862 -19.684 1034 HZ2 LYS 140 HZ2 LYS 140 112.309 5.276 -20.979 1035 HZ3 LYS 140 HZ3 LYS 140 113.611 4.361 -20.383 1036 H GLY 141 H GLY 141 108.742 7.927 -21.023 1037 HA2 GLY 141 HA2 GLY 141 107.001 6.725 -21.966 1038 HA3 GLY 141 HA3 GLY 141 106.437 6.340 -20.342 Start of MODEL 5 1 H1 HIS -5 HT1 HIS -5 46.793 -24.191 -0.737 2 H2 HIS -5 HT2 HIS -5 46.154 -24.445 -2.291 3 H3 HIS -5 HT3 HIS -5 45.769 -23.030 -1.433 4 HA HIS -5 HA HIS -5 48.067 -22.303 -1.533 5 HB2 HIS -5 HB2 HIS -5 48.388 -24.848 -3.138 6 HB3 HIS -5 HB3 HIS -5 49.600 -23.586 -3.025 7 HD1 HIS -5 HD1 HIS -5 48.065 -26.413 -1.123 8 HD2 HIS -5 HD2 HIS -5 50.977 -23.492 -0.515 9 HE1 HIS -5 HE1 HIS -5 49.320 -27.081 0.970 10 H HIS -4 H HIS -4 48.681 -20.958 -3.269 11 HA HIS -4 HA HIS -4 46.913 -21.054 -5.648 12 HB2 HIS -4 HB2 HIS -4 46.286 -19.251 -4.064 13 HB3 HIS -4 HB3 HIS -4 47.906 -18.595 -4.202 14 HD1 HIS -4 HD1 HIS -4 45.049 -19.503 -6.573 15 HD2 HIS -4 HD2 HIS -4 48.030 -16.625 -6.116 16 HE1 HIS -4 HE1 HIS -4 44.730 -17.838 -8.453 17 H HIS -3 H HIS -3 47.884 -20.825 -7.588 18 HA HIS -3 HA HIS -3 50.791 -20.236 -7.618 19 HB2 HIS -3 HB2 HIS -3 49.231 -22.191 -9.310 20 HB3 HIS -3 HB3 HIS -3 50.915 -21.774 -9.561 21 HD1 HIS -3 HD1 HIS -3 48.640 -23.751 -7.352 22 HD2 HIS -3 HD2 HIS -3 52.713 -22.908 -7.640 23 HE1 HIS -3 HE1 HIS -3 49.816 -25.375 -5.809 24 H HIS -2 H HIS -2 51.565 -18.954 -9.256 25 HA HIS -2 HA HIS -2 49.529 -17.616 -10.945 26 HB2 HIS -2 HB2 HIS -2 52.161 -16.582 -9.885 27 HB3 HIS -2 HB3 HIS -2 51.117 -15.714 -10.994 28 HD1 HIS -2 HD1 HIS -2 48.639 -15.159 -9.993 29 HD2 HIS -2 HD2 HIS -2 51.581 -16.169 -7.217 30 HE1 HIS -2 HE1 HIS -2 47.796 -14.371 -7.739 31 H HIS -1 H HIS -1 49.875 -17.446 -13.112 32 HA HIS -1 HA HIS -1 52.308 -18.750 -14.200 33 HB2 HIS -1 HB2 HIS -1 50.268 -20.079 -14.555 34 HB3 HIS -1 HB3 HIS -1 49.511 -18.707 -15.342 35 HD1 HIS -1 HD1 HIS -1 50.160 -18.231 -17.778 36 HD2 HIS -1 HD2 HIS -1 52.312 -21.381 -16.097 37 HE1 HIS -1 HE1 HIS -1 51.378 -19.362 -19.686 38 H HIS 0 H HIS 0 53.478 -17.623 -15.634 39 HA HIS 0 HA HIS 0 52.345 -15.104 -16.711 40 HB2 HIS 0 HB2 HIS 0 53.996 -14.693 -14.918 41 HB3 HIS 0 HB3 HIS 0 55.184 -15.619 -15.816 42 HD1 HIS 0 HD1 HIS 0 52.951 -12.580 -16.438 43 HD2 HIS 0 HD2 HIS 0 56.760 -13.989 -17.375 44 HE1 HIS 0 HE1 HIS 0 54.087 -10.743 -17.756 45 H SER 1 H SER 1 52.629 -14.734 -18.842 46 HA SER 1 HA SER 1 54.190 -16.728 -20.383 47 HB2 SER 1 HB2 SER 1 51.731 -16.835 -20.749 48 HB3 SER 1 HB3 SER 1 51.762 -15.155 -21.273 49 HG SER 1 HG SER 1 52.355 -17.319 -22.650 50 H SER 2 H SER 2 55.541 -16.007 -21.993 51 HA SER 2 HA SER 2 56.703 -13.456 -21.711 52 HB2 SER 2 HB2 SER 2 56.847 -15.340 -24.077 53 HB3 SER 2 HB3 SER 2 57.945 -14.003 -23.752 54 HG SER 2 HG SER 2 57.492 -16.087 -21.958 55 H GLY 3 H GLY 3 56.742 -11.686 -23.201 56 HA2 GLY 3 HA2 GLY 3 54.912 -11.465 -25.377 57 HA3 GLY 3 HA3 GLY 3 54.276 -10.669 -23.941 58 H LEU 4 H LEU 4 54.518 -8.862 -25.664 59 HA LEU 4 HA LEU 4 57.244 -7.761 -25.702 60 HB2 LEU 4 HB2 LEU 4 55.955 -7.903 -27.834 61 HB3 LEU 4 HB3 LEU 4 54.771 -6.789 -27.152 62 HG LEU 4 HG LEU 4 56.688 -5.171 -26.749 63 HD11 LEU 4 HD11 LEU 4 58.617 -6.532 -26.850 64 HD12 LEU 4 HD12 LEU 4 58.645 -5.651 -28.378 65 HD13 LEU 4 HD13 LEU 4 58.087 -7.323 -28.334 66 HD21 LEU 4 HD21 LEU 4 56.631 -4.336 -29.007 67 HD22 LEU 4 HD22 LEU 4 55.069 -5.098 -28.703 68 HD23 LEU 4 HD23 LEU 4 56.292 -5.943 -29.652 69 H VAL 5 H VAL 5 57.818 -6.092 -24.457 70 HA VAL 5 HA VAL 5 56.110 -5.113 -22.426 71 HB VAL 5 HB VAL 5 58.736 -3.992 -23.446 72 HG11 VAL 5 HG11 VAL 5 57.377 -3.632 -20.759 73 HG12 VAL 5 HG12 VAL 5 57.402 -2.415 -22.035 74 HG13 VAL 5 HG13 VAL 5 58.908 -2.917 -21.267 75 HG21 VAL 5 HG21 VAL 5 59.766 -5.318 -21.694 76 HG22 VAL 5 HG22 VAL 5 58.780 -6.389 -22.689 77 HG23 VAL 5 HG23 VAL 5 58.188 -5.854 -21.117 78 HA PRO 6 HA PRO 6 54.382 -1.807 -24.932 79 HB2 PRO 6 HB2 PRO 6 52.878 -0.529 -23.081 80 HB3 PRO 6 HB3 PRO 6 52.460 -2.145 -23.684 81 HG2 PRO 6 HG2 PRO 6 53.578 -1.343 -21.087 82 HG3 PRO 6 HG3 PRO 6 52.596 -2.752 -21.515 83 HD2 PRO 6 HD2 PRO 6 55.422 -2.672 -21.158 84 HD3 PRO 6 HD3 PRO 6 54.448 -4.045 -21.719 85 H ARG 7 H ARG 7 55.229 0.078 -25.622 86 HA ARG 7 HA ARG 7 57.335 1.389 -24.295 87 HB2 ARG 7 HB2 ARG 7 55.521 2.378 -26.509 88 HB3 ARG 7 HB3 ARG 7 57.024 3.159 -26.012 89 HG2 ARG 7 HG2 ARG 7 58.268 1.085 -26.531 90 HG3 ARG 7 HG3 ARG 7 56.766 0.326 -27.062 91 HD2 ARG 7 HD2 ARG 7 57.887 1.144 -29.030 92 HD3 ARG 7 HD3 ARG 7 56.507 2.195 -28.732 93 HE ARG 7 HE ARG 7 59.020 3.074 -27.558 94 HH11 ARG 7 HH11 ARG 7 56.869 3.318 -30.321 95 HH12 ARG 7 HH12 ARG 7 57.539 4.830 -30.836 96 HH21 ARG 7 HH21 ARG 7 59.843 5.021 -28.269 97 HH22 ARG 7 HH22 ARG 7 59.204 5.780 -29.688 98 H GLY 8 H GLY 8 57.445 3.281 -23.120 99 HA2 GLY 8 HA2 GLY 8 55.008 4.029 -21.710 100 HA3 GLY 8 HA3 GLY 8 56.645 4.554 -21.324 101 H SER 9 H SER 9 55.170 6.590 -21.125 102 HA SER 9 HA SER 9 54.285 7.944 -23.436 103 HB2 SER 9 HB2 SER 9 55.264 9.115 -20.820 104 HB3 SER 9 HB3 SER 9 54.301 9.954 -22.031 105 HG SER 9 HG SER 9 52.636 8.920 -21.296 106 H GLY 10 H GLY 10 55.235 9.812 -24.473 107 HA2 GLY 10 HA2 GLY 10 57.820 9.389 -25.441 108 HA3 GLY 10 HA3 GLY 10 56.936 10.907 -25.570 109 H MET 11 H MET 11 59.816 10.263 -24.972 110 HA MET 11 HA MET 11 60.045 11.849 -22.481 111 HB2 MET 11 HB2 MET 11 61.767 9.522 -23.364 112 HB3 MET 11 HB3 MET 11 62.121 10.570 -21.989 113 HG2 MET 11 HG2 MET 11 59.873 9.962 -21.036 114 HG3 MET 11 HG3 MET 11 59.698 8.783 -22.334 115 HE1 MET 11 HE1 MET 11 62.882 7.818 -22.601 116 HE2 MET 11 HE2 MET 11 61.333 7.033 -22.897 117 HE3 MET 11 HE3 MET 11 62.501 6.282 -21.813 118 H LYS 12 H LYS 12 62.075 13.058 -22.319 119 HA LYS 12 HA LYS 12 62.773 14.225 -24.900 120 HB2 LYS 12 HB2 LYS 12 63.604 14.998 -22.092 121 HB3 LYS 12 HB3 LYS 12 63.930 15.928 -23.555 122 HG2 LYS 12 HG2 LYS 12 61.427 15.984 -23.955 123 HG3 LYS 12 HG3 LYS 12 61.228 15.305 -22.340 124 HD2 LYS 12 HD2 LYS 12 62.709 17.880 -22.947 125 HD3 LYS 12 HD3 LYS 12 61.047 17.796 -22.363 126 HE2 LYS 12 HE2 LYS 12 62.106 16.306 -20.462 127 HE3 LYS 12 HE3 LYS 12 63.595 17.131 -20.924 128 HZ1 LYS 12 HZ1 LYS 12 62.173 18.201 -19.132 129 HZ2 LYS 12 HZ2 LYS 12 61.102 18.622 -20.382 130 HZ3 LYS 12 HZ3 LYS 12 62.699 19.200 -20.398 131 H GLU 13 H GLU 13 64.889 14.379 -25.698 132 HA GLU 13 HA GLU 13 66.482 12.090 -25.484 133 HB2 GLU 13 HB2 GLU 13 67.251 14.872 -26.398 134 HB3 GLU 13 HB3 GLU 13 68.203 13.414 -26.682 135 HG2 GLU 13 HG2 GLU 13 66.261 12.415 -27.875 136 HG3 GLU 13 HG3 GLU 13 65.377 13.919 -27.654 137 H THR 14 H THR 14 68.324 11.588 -24.356 138 HA THR 14 HA THR 14 69.140 13.463 -22.209 139 HB THR 14 HB THR 14 69.511 11.543 -20.752 140 HG1 THR 14 HG1 THR 14 68.380 9.982 -22.748 141 HG21 THR 14 HG21 THR 14 67.232 12.633 -20.916 142 HG22 THR 14 HG22 THR 14 67.218 10.975 -20.313 143 HG23 THR 14 HG23 THR 14 66.756 11.310 -21.981 144 H ALA 15 H ALA 15 71.355 13.070 -21.412 145 HA ALA 15 HA ALA 15 73.230 13.051 -23.517 146 HB1 ALA 15 HB1 ALA 15 73.903 12.446 -20.640 147 HB2 ALA 15 HB2 ALA 15 73.467 14.069 -21.175 148 HB3 ALA 15 HB3 ALA 15 74.891 13.272 -21.846 149 H ALA 16 H ALA 16 74.692 11.512 -24.219 150 HA ALA 16 HA ALA 16 73.837 8.820 -24.231 151 HB1 ALA 16 HB1 ALA 16 76.479 10.088 -24.977 152 HB2 ALA 16 HB2 ALA 16 75.163 9.639 -26.061 153 HB3 ALA 16 HB3 ALA 16 76.102 8.387 -25.249 154 H ALA 17 H ALA 17 74.587 7.005 -23.169 155 HA ALA 17 HA ALA 17 76.634 7.327 -21.097 156 HB1 ALA 17 HB1 ALA 17 75.297 6.775 -19.298 157 HB2 ALA 17 HB2 ALA 17 74.107 5.945 -20.299 158 HB3 ALA 17 HB3 ALA 17 74.152 7.707 -20.261 159 H LYS 18 H LYS 18 77.507 5.324 -20.353 160 HA LYS 18 HA LYS 18 77.540 3.284 -22.388 161 HB2 LYS 18 HB2 LYS 18 79.558 3.960 -21.077 162 HB3 LYS 18 HB3 LYS 18 78.816 3.244 -19.644 163 HG2 LYS 18 HG2 LYS 18 78.671 1.066 -20.838 164 HG3 LYS 18 HG3 LYS 18 79.504 1.791 -22.215 165 HD2 LYS 18 HD2 LYS 18 81.412 2.358 -20.691 166 HD3 LYS 18 HD3 LYS 18 80.598 1.462 -19.408 167 HE2 LYS 18 HE2 LYS 18 81.235 0.225 -22.092 168 HE3 LYS 18 HE3 LYS 18 82.353 0.159 -20.730 169 HZ1 LYS 18 HZ1 LYS 18 79.584 -0.905 -20.819 170 HZ2 LYS 18 HZ2 LYS 18 80.535 -0.838 -19.413 171 HZ3 LYS 18 HZ3 LYS 18 81.020 -1.804 -20.723 172 H PHE 19 H PHE 19 76.503 1.372 -22.409 173 HA PHE 19 HA PHE 19 74.701 0.767 -20.146 174 HB2 PHE 19 HB2 PHE 19 74.626 -0.144 -23.025 175 HB3 PHE 19 HB3 PHE 19 73.492 -0.639 -21.784 176 HD1 PHE 19 HD1 PHE 19 71.901 1.015 -20.812 177 HD2 PHE 19 HD2 PHE 19 74.489 1.997 -24.097 178 HE1 PHE 19 HE1 PHE 19 70.510 3.006 -21.314 179 HE2 PHE 19 HE2 PHE 19 73.098 3.987 -24.599 180 HZ PHE 19 HZ PHE 19 71.108 4.492 -23.207 181 H GLU 20 H GLU 20 74.952 -1.054 -18.992 182 HA GLU 20 HA GLU 20 77.126 -2.891 -19.782 183 HB2 GLU 20 HB2 GLU 20 77.289 -1.730 -17.568 184 HB3 GLU 20 HB3 GLU 20 75.821 -2.572 -17.070 185 HG2 GLU 20 HG2 GLU 20 76.944 -4.744 -17.547 186 HG3 GLU 20 HG3 GLU 20 78.418 -3.871 -17.940 187 H ARG 21 H ARG 21 76.767 -5.044 -20.036 188 HA ARG 21 HA ARG 21 74.176 -5.966 -20.660 189 HB2 ARG 21 HB2 ARG 21 76.703 -7.505 -20.024 190 HB3 ARG 21 HB3 ARG 21 75.240 -8.220 -20.702 191 HG2 ARG 21 HG2 ARG 21 75.399 -6.620 -22.617 192 HG3 ARG 21 HG3 ARG 21 76.936 -6.048 -21.966 193 HD2 ARG 21 HD2 ARG 21 76.314 -8.881 -22.845 194 HD3 ARG 21 HD3 ARG 21 77.340 -7.731 -23.697 195 HE ARG 21 HE ARG 21 78.008 -9.212 -21.274 196 HH11 ARG 21 HH11 ARG 21 78.910 -6.606 -23.445 197 HH12 ARG 21 HH12 ARG 21 80.554 -6.587 -22.900 198 HH21 ARG 21 HH21 ARG 21 80.137 -9.142 -20.612 199 HH22 ARG 21 HH22 ARG 21 81.239 -8.005 -21.317 200 H GLN 22 H GLN 22 72.801 -7.410 -19.574 201 HA GLN 22 HA GLN 22 73.030 -7.281 -16.645 202 HB2 GLN 22 HB2 GLN 22 70.676 -8.085 -18.371 203 HB3 GLN 22 HB3 GLN 22 70.656 -7.855 -16.624 204 HG2 GLN 22 HG2 GLN 22 71.262 -5.717 -18.686 205 HG3 GLN 22 HG3 GLN 22 69.766 -5.870 -17.770 206 HE21 GLN 22 HE21 GLN 22 72.326 -3.917 -17.827 207 HE22 GLN 22 HE22 GLN 22 72.568 -3.640 -16.170 208 H HIS 23 H HIS 23 72.926 -9.103 -15.352 209 HA HIS 23 HA HIS 23 73.106 -11.725 -16.709 210 HB2 HIS 23 HB2 HIS 23 74.825 -10.795 -14.406 211 HB3 HIS 23 HB3 HIS 23 74.867 -12.380 -15.152 212 HD1 HIS 23 HD1 HIS 23 75.508 -12.274 -17.851 213 HD2 HIS 23 HD2 HIS 23 76.640 -9.035 -15.482 214 HE1 HIS 23 HE1 HIS 23 77.307 -11.041 -19.136 215 H MET 24 H MET 24 72.923 -13.533 -15.016 216 HA MET 24 HA MET 24 70.510 -13.025 -13.475 217 HB2 MET 24 HB2 MET 24 72.107 -15.558 -13.928 218 HB3 MET 24 HB3 MET 24 70.566 -15.473 -13.073 219 HG2 MET 24 HG2 MET 24 69.556 -14.455 -15.142 220 HG3 MET 24 HG3 MET 24 71.076 -14.774 -15.977 221 HE1 MET 24 HE1 MET 24 68.055 -15.916 -14.236 222 HE2 MET 24 HE2 MET 24 69.010 -17.037 -13.268 223 HE3 MET 24 HE3 MET 24 67.896 -17.659 -14.483 224 H ASP 25 H ASP 25 70.304 -13.254 -11.251 225 HA ASP 25 HA ASP 25 72.504 -12.392 -9.692 226 HB2 ASP 25 HB2 ASP 25 69.863 -13.608 -8.853 227 HB3 ASP 25 HB3 ASP 25 71.004 -12.830 -7.759 228 H SER 26 H SER 26 73.883 -13.465 -8.350 229 HA SER 26 HA SER 26 73.661 -16.409 -8.191 230 HB2 SER 26 HB2 SER 26 76.326 -15.051 -8.493 231 HB3 SER 26 HB3 SER 26 75.903 -16.736 -8.774 232 HG SER 26 HG SER 26 76.016 -15.695 -10.720 233 HA PRO 27 HA PRO 27 74.618 -15.647 -3.943 234 HB2 PRO 27 HB2 PRO 27 75.720 -17.966 -3.105 235 HB3 PRO 27 HB3 PRO 27 74.022 -17.864 -3.611 236 HG2 PRO 27 HG2 PRO 27 76.361 -18.961 -5.058 237 HG3 PRO 27 HG3 PRO 27 74.671 -19.494 -5.063 238 HD2 PRO 27 HD2 PRO 27 75.881 -17.934 -7.048 239 HD3 PRO 27 HD3 PRO 27 74.132 -18.132 -6.811 240 H ASP 28 H ASP 28 76.142 -14.117 -3.535 241 HA ASP 28 HA ASP 28 78.897 -15.003 -3.172 242 HB2 ASP 28 HB2 ASP 28 79.810 -13.107 -4.464 243 HB3 ASP 28 HB3 ASP 28 78.919 -14.234 -5.478 244 H LEU 29 H LEU 29 80.220 -13.296 -2.088 245 HA LEU 29 HA LEU 29 78.528 -11.787 -0.195 246 HB2 LEU 29 HB2 LEU 29 80.115 -13.477 0.730 247 HB3 LEU 29 HB3 LEU 29 81.449 -12.545 0.051 248 HG LEU 29 HG LEU 29 80.572 -10.546 1.350 249 HD11 LEU 29 HD11 LEU 29 78.798 -12.739 2.427 250 HD12 LEU 29 HD12 LEU 29 78.335 -11.138 1.851 251 HD13 LEU 29 HD13 LEU 29 79.177 -11.310 3.390 252 HD21 LEU 29 HD21 LEU 29 82.508 -11.857 2.120 253 HD22 LEU 29 HD22 LEU 29 81.429 -13.005 2.912 254 HD23 LEU 29 HD23 LEU 29 81.531 -11.343 3.495 255 H GLY 30 H GLY 30 78.476 -9.637 -0.303 256 HA2 GLY 30 HA2 GLY 30 80.248 -8.247 -2.158 257 HA3 GLY 30 HA3 GLY 30 78.839 -7.566 -1.351 258 H THR 31 H THR 31 80.752 -5.870 -1.253 259 HA THR 31 HA THR 31 82.015 -6.168 1.414 260 HB THR 31 HB THR 31 83.893 -4.834 0.612 261 HG1 THR 31 HG1 THR 31 83.288 -3.637 -0.994 262 HG21 THR 31 HG21 THR 31 83.296 -7.104 -1.304 263 HG22 THR 31 HG22 THR 31 83.947 -7.307 0.322 264 HG23 THR 31 HG23 THR 31 84.890 -6.463 -0.907 265 H ASP 32 H ASP 32 82.340 -4.152 2.565 266 HA ASP 32 HA ASP 32 80.047 -2.429 2.365 267 HB2 ASP 32 HB2 ASP 32 82.508 -2.285 4.120 268 HB3 ASP 32 HB3 ASP 32 81.091 -1.251 4.288 269 H ASP 33 H ASP 33 79.903 -0.405 1.542 270 HA ASP 33 HA ASP 33 81.940 0.501 -0.261 271 HB2 ASP 33 HB2 ASP 33 79.418 1.847 0.736 272 HB3 ASP 33 HB3 ASP 33 80.436 2.457 -0.566 273 H ASP 34 H ASP 34 83.450 2.075 -0.001 274 HA ASP 34 HA ASP 34 84.147 2.852 2.674 275 HB2 ASP 34 HB2 ASP 34 85.263 3.702 -0.008 276 HB3 ASP 34 HB3 ASP 34 85.970 4.117 1.551 277 H ASP 35 H ASP 35 83.706 4.696 3.730 278 HA ASP 35 HA ASP 35 82.847 7.070 2.269 279 HB2 ASP 35 HB2 ASP 35 80.784 7.328 3.546 280 HB3 ASP 35 HB3 ASP 35 80.754 5.818 2.641 281 H LYS 36 H LYS 36 82.532 8.939 3.805 282 HA LYS 36 HA LYS 36 84.086 8.643 6.289 283 HB2 LYS 36 HB2 LYS 36 85.421 10.591 5.806 284 HB3 LYS 36 HB3 LYS 36 85.592 9.447 4.480 285 HG2 LYS 36 HG2 LYS 36 83.856 10.737 3.211 286 HG3 LYS 36 HG3 LYS 36 83.847 11.929 4.512 287 HD2 LYS 36 HD2 LYS 36 86.363 12.145 4.159 288 HD3 LYS 36 HD3 LYS 36 86.143 11.212 2.677 289 HE2 LYS 36 HE2 LYS 36 84.275 12.969 2.153 290 HE3 LYS 36 HE3 LYS 36 85.114 13.957 3.349 291 HZ1 LYS 36 HZ1 LYS 36 86.952 14.144 2.047 292 HZ2 LYS 36 HZ2 LYS 36 85.780 14.001 0.826 293 HZ3 LYS 36 HZ3 LYS 36 86.714 12.654 1.275 294 H THR 37 H THR 37 83.112 9.519 7.975 295 HA THR 37 HA THR 37 81.209 11.745 7.544 296 HB THR 37 HB THR 37 79.725 10.785 9.226 297 HG1 THR 37 HG1 THR 37 81.357 9.648 10.332 298 HG21 THR 37 HG21 THR 37 78.919 8.851 7.955 299 HG22 THR 37 HG22 THR 37 80.466 8.739 7.114 300 HG23 THR 37 HG23 THR 37 79.418 10.133 6.853 301 H GLY 38 H GLY 38 80.859 13.068 9.469 302 HA2 GLY 38 HA2 GLY 38 83.336 13.429 10.961 303 HA3 GLY 38 HA3 GLY 38 81.944 14.509 10.966 304 H GLY 39 H GLY 39 83.186 13.869 13.342 305 HA2 GLY 39 HA2 GLY 39 80.993 12.845 14.860 306 HA3 GLY 39 HA3 GLY 39 82.313 11.683 14.789 307 H GLY 40 H GLY 40 81.903 12.333 17.225 308 HA2 GLY 40 HA2 GLY 40 83.357 14.731 18.023 309 HA3 GLY 40 HA3 GLY 40 82.553 13.588 19.096 310 H ARG 41 H ARG 41 84.731 14.052 20.215 311 HA ARG 41 HA ARG 41 87.154 13.016 19.268 312 HB2 ARG 41 HB2 ARG 41 86.126 13.190 22.111 313 HB3 ARG 41 HB3 ARG 41 87.806 12.892 21.659 314 HG2 ARG 41 HG2 ARG 41 87.819 15.048 20.410 315 HG3 ARG 41 HG3 ARG 41 86.179 15.359 20.982 316 HD2 ARG 41 HD2 ARG 41 87.044 15.124 23.338 317 HD3 ARG 41 HD3 ARG 41 88.673 15.054 22.672 318 HE ARG 41 HE ARG 41 88.583 17.339 22.400 319 HH11 ARG 41 HH11 ARG 41 85.280 16.170 22.624 320 HH12 ARG 41 HH12 ARG 41 84.608 17.766 22.608 321 HH21 ARG 41 HH21 ARG 41 87.660 19.369 22.383 322 HH22 ARG 41 HH22 ARG 41 85.940 19.554 22.472 323 H ALA 42 H ALA 42 88.181 11.024 19.529 324 HA ALA 42 HA ALA 42 86.574 8.785 20.546 325 HB1 ALA 42 HB1 ALA 42 87.806 8.888 17.783 326 HB2 ALA 42 HB2 ALA 42 86.083 8.848 18.157 327 HB3 ALA 42 HB3 ALA 42 87.097 7.451 18.522 328 H ASP 43 H ASP 43 87.825 6.859 20.947 329 HA ASP 43 HA ASP 43 90.306 7.362 22.185 330 HB2 ASP 43 HB2 ASP 43 88.993 4.783 21.310 331 HB3 ASP 43 HB3 ASP 43 90.473 4.849 22.266 332 HA PRO 44 HA PRO 44 93.241 7.171 18.906 333 HB2 PRO 44 HB2 PRO 44 95.226 5.524 19.940 334 HB3 PRO 44 HB3 PRO 44 95.050 7.251 20.301 335 HG2 PRO 44 HG2 PRO 44 94.213 4.892 21.898 336 HG3 PRO 44 HG3 PRO 44 94.888 6.443 22.433 337 HD2 PRO 44 HD2 PRO 44 92.248 5.901 22.654 338 HD3 PRO 44 HD3 PRO 44 92.844 7.541 22.314 339 H ALA 45 H ALA 45 93.277 6.049 17.045 340 HA ALA 45 HA ALA 45 93.180 3.122 17.084 341 HB1 ALA 45 HB1 ALA 45 91.210 4.693 15.422 342 HB2 ALA 45 HB2 ALA 45 90.809 4.056 17.017 343 HB3 ALA 45 HB3 ALA 45 91.245 2.953 15.712 344 H HIS 46 H HIS 46 93.504 2.210 14.885 345 HA HIS 46 HA HIS 46 95.507 3.793 13.462 346 HB2 HIS 46 HB2 HIS 46 94.644 0.917 13.128 347 HB3 HIS 46 HB3 HIS 46 95.967 1.683 12.269 348 HD1 HIS 46 HD1 HIS 46 97.887 2.721 14.008 349 HD2 HIS 46 HD2 HIS 46 95.452 -0.354 15.422 350 HE1 HIS 46 HE1 HIS 46 99.076 1.731 16.012 351 H ARG 47 H ARG 47 95.487 3.853 11.090 352 HA ARG 47 HA ARG 47 92.808 3.662 9.888 353 HB2 ARG 47 HB2 ARG 47 93.046 5.918 8.915 354 HB3 ARG 47 HB3 ARG 47 93.003 5.970 10.677 355 HG2 ARG 47 HG2 ARG 47 95.488 6.059 10.713 356 HG3 ARG 47 HG3 ARG 47 95.493 6.088 8.949 357 HD2 ARG 47 HD2 ARG 47 95.671 8.368 9.663 358 HD3 ARG 47 HD3 ARG 47 94.023 8.149 9.084 359 HE ARG 47 HE ARG 47 93.250 8.402 11.269 360 HH11 ARG 47 HH11 ARG 47 96.752 8.155 11.305 361 HH12 ARG 47 HH12 ARG 47 96.869 8.637 12.965 362 HH21 ARG 47 HH21 ARG 47 93.463 9.017 13.404 363 HH22 ARG 47 HH22 ARG 47 95.030 9.118 14.137 364 H SER 48 H SER 48 92.841 3.754 7.543 365 HA SER 48 HA SER 48 94.936 2.196 6.425 366 HB2 SER 48 HB2 SER 48 92.963 3.822 4.828 367 HB3 SER 48 HB3 SER 48 93.721 2.293 4.400 368 HG SER 48 HG SER 48 91.586 2.797 6.005 369 HA PRO 49 HA PRO 49 98.037 5.090 5.232 370 HB2 PRO 49 HB2 PRO 49 97.741 4.167 2.408 371 HB3 PRO 49 HB3 PRO 49 99.199 4.294 3.411 372 HG2 PRO 49 HG2 PRO 49 98.062 1.943 2.899 373 HG3 PRO 49 HG3 PRO 49 98.826 2.296 4.460 374 HD2 PRO 49 HD2 PRO 49 95.931 2.088 3.794 375 HD3 PRO 49 HD3 PRO 49 96.766 1.758 5.327 376 H VAL 50 H VAL 50 98.288 7.141 4.257 377 HA VAL 50 HA VAL 50 95.749 8.345 3.466 378 HB VAL 50 HB VAL 50 98.436 9.598 4.100 379 HG11 VAL 50 HG11 VAL 50 95.702 10.880 3.826 380 HG12 VAL 50 HG12 VAL 50 96.991 10.995 2.629 381 HG13 VAL 50 HG13 VAL 50 97.207 11.706 4.227 382 HG21 VAL 50 HG21 VAL 50 97.267 10.258 6.217 383 HG22 VAL 50 HG22 VAL 50 97.480 8.515 6.056 384 HG23 VAL 50 HG23 VAL 50 95.907 9.244 5.736 385 HA PRO 51 HA PRO 51 96.829 8.365 -0.908 386 HB2 PRO 51 HB2 PRO 51 95.804 11.171 -0.927 387 HB3 PRO 51 HB3 PRO 51 95.388 9.812 -1.990 388 HG2 PRO 51 HG2 PRO 51 93.731 10.625 -0.083 389 HG3 PRO 51 HG3 PRO 51 93.910 8.907 -0.486 390 HD2 PRO 51 HD2 PRO 51 94.933 10.391 1.887 391 HD3 PRO 51 HD3 PRO 51 94.422 8.696 1.750 392 H LEU 52 H LEU 52 98.289 9.519 -2.406 393 HA LEU 52 HA LEU 52 100.671 10.289 -1.093 394 HB2 LEU 52 HB2 LEU 52 99.831 10.588 -3.985 395 HB3 LEU 52 HB3 LEU 52 101.465 10.876 -3.390 396 HG LEU 52 HG LEU 52 99.984 8.259 -3.023 397 HD11 LEU 52 HD11 LEU 52 101.789 9.277 -5.202 398 HD12 LEU 52 HD12 LEU 52 100.315 8.319 -5.339 399 HD13 LEU 52 HD13 LEU 52 101.808 7.565 -4.780 400 HD21 LEU 52 HD21 LEU 52 101.698 8.467 -1.381 401 HD22 LEU 52 HD22 LEU 52 102.810 9.219 -2.526 402 HD23 LEU 52 HD23 LEU 52 102.420 7.504 -2.671 403 HA PRO 53 HA PRO 53 99.992 14.646 -0.635 404 HB2 PRO 53 HB2 PRO 53 102.513 15.665 -0.756 405 HB3 PRO 53 HB3 PRO 53 101.923 14.735 0.636 406 HG2 PRO 53 HG2 PRO 53 103.675 13.876 -1.604 407 HG3 PRO 53 HG3 PRO 53 103.746 13.453 0.116 408 HD2 PRO 53 HD2 PRO 53 102.685 11.801 -1.811 409 HD3 PRO 53 HD3 PRO 53 102.215 11.753 -0.098 410 H SER 54 H SER 54 99.852 16.602 -1.818 411 HA SER 54 HA SER 54 99.485 16.347 -4.552 412 HB2 SER 54 HB2 SER 54 99.955 18.817 -2.878 413 HB3 SER 54 HB3 SER 54 99.468 18.867 -4.568 414 HG SER 54 HG SER 54 97.552 18.325 -3.933 415 HA PRO 55 HA PRO 55 103.774 16.384 -5.652 416 HB2 PRO 55 HB2 PRO 55 103.649 16.257 -8.342 417 HB3 PRO 55 HB3 PRO 55 103.122 14.909 -7.313 418 HG2 PRO 55 HG2 PRO 55 101.504 16.907 -8.781 419 HG3 PRO 55 HG3 PRO 55 101.173 15.197 -8.456 420 HD2 PRO 55 HD2 PRO 55 100.094 17.355 -7.033 421 HD3 PRO 55 HD3 PRO 55 100.112 15.664 -6.494 422 H THR 56 H THR 56 105.000 18.182 -5.336 423 HA THR 56 HA THR 56 104.669 20.605 -6.860 424 HB THR 56 HB THR 56 106.829 21.252 -5.927 425 HG1 THR 56 HG1 THR 56 107.005 18.699 -4.859 426 HG21 THR 56 HG21 THR 56 106.201 21.346 -3.677 427 HG22 THR 56 HG22 THR 56 105.516 19.721 -3.699 428 HG23 THR 56 HG23 THR 56 104.659 21.051 -4.478 429 H SER 57 H SER 57 106.427 21.320 -8.462 430 HA SER 57 HA SER 57 106.335 19.545 -10.616 431 HB2 SER 57 HB2 SER 57 108.264 21.827 -10.138 432 HB3 SER 57 HB3 SER 57 108.004 21.030 -11.686 433 HG SER 57 HG SER 57 106.711 22.988 -11.013 434 H ASN 58 H ASN 58 107.367 17.748 -11.029 435 HA ASN 58 HA ASN 58 108.957 16.182 -11.265 436 HB2 ASN 58 HB2 ASN 58 111.111 16.828 -11.800 437 HB3 ASN 58 HB3 ASN 58 110.149 18.245 -12.176 438 HD21 ASN 58 HD21 ASN 58 110.788 20.196 -11.194 439 HD22 ASN 58 HD22 ASN 58 111.951 20.304 -9.962 440 H LYS 59 H LYS 59 107.996 17.008 -8.404 441 HA LYS 59 HA LYS 59 109.849 15.190 -7.042 442 HB2 LYS 59 HB2 LYS 59 109.179 17.946 -5.985 443 HB3 LYS 59 HB3 LYS 59 110.071 16.704 -5.110 444 HG2 LYS 59 HG2 LYS 59 111.829 16.734 -6.828 445 HG3 LYS 59 HG3 LYS 59 110.923 17.942 -7.739 446 HD2 LYS 59 HD2 LYS 59 112.603 19.111 -6.463 447 HD3 LYS 59 HD3 LYS 59 111.036 19.447 -5.727 448 HE2 LYS 59 HE2 LYS 59 111.426 17.858 -3.969 449 HE3 LYS 59 HE3 LYS 59 112.860 17.226 -4.777 450 HZ1 LYS 59 HZ1 LYS 59 113.872 19.442 -4.533 451 HZ2 LYS 59 HZ2 LYS 59 113.525 18.709 -3.040 452 HZ3 LYS 59 HZ3 LYS 59 112.523 19.945 -3.636 453 H GLN 60 H GLN 60 108.987 14.187 -5.195 454 HA GLN 60 HA GLN 60 106.438 15.123 -4.128 455 HB2 GLN 60 HB2 GLN 60 106.815 12.307 -5.158 456 HB3 GLN 60 HB3 GLN 60 105.551 12.763 -4.018 457 HG2 GLN 60 HG2 GLN 60 104.815 14.515 -5.695 458 HG3 GLN 60 HG3 GLN 60 105.941 13.775 -6.836 459 HE21 GLN 60 HE21 GLN 60 102.828 13.336 -5.205 460 HE22 GLN 60 HE22 GLN 60 102.412 11.916 -6.038 461 H ASP 61 H ASP 61 106.093 14.550 -1.970 462 HA ASP 61 HA ASP 61 108.409 13.437 -0.560 463 HB2 ASP 61 HB2 ASP 61 105.825 14.641 0.467 464 HB3 ASP 61 HB3 ASP 61 107.152 14.086 1.482 465 H ILE 62 H ILE 62 108.487 11.341 0.054 466 HA ILE 62 HA ILE 62 105.952 9.802 0.065 467 HB ILE 62 HB ILE 62 107.330 9.466 -1.998 468 HG12 ILE 62 HG12 ILE 62 107.391 6.893 -1.675 469 HG13 ILE 62 HG13 ILE 62 106.726 7.232 -0.077 470 HG21 ILE 62 HG21 ILE 62 109.305 8.275 -0.034 471 HG22 ILE 62 HG22 ILE 62 109.573 9.668 -1.081 472 HG23 ILE 62 HG23 ILE 62 109.376 8.063 -1.784 473 HD11 ILE 62 HD11 ILE 62 105.454 8.542 -2.458 474 HD12 ILE 62 HD12 ILE 62 104.728 8.051 -0.928 475 HD13 ILE 62 HD13 ILE 62 105.115 6.841 -2.150 476 H SER 63 H SER 63 105.805 8.098 1.601 477 HA SER 63 HA SER 63 107.974 7.850 3.533 478 HB2 SER 63 HB2 SER 63 106.744 8.644 5.425 479 HB3 SER 63 HB3 SER 63 106.676 9.896 4.189 480 HG SER 63 HG SER 63 104.703 8.342 5.202 481 H GLU 64 H GLU 64 107.547 6.292 5.224 482 HA GLU 64 HA GLU 64 106.598 3.859 4.293 483 HB2 GLU 64 HB2 GLU 64 106.775 3.097 6.623 484 HB3 GLU 64 HB3 GLU 64 108.166 4.075 6.159 485 HG2 GLU 64 HG2 GLU 64 107.081 6.055 7.203 486 HG3 GLU 64 HG3 GLU 64 105.771 5.018 7.754 487 H ALA 65 H ALA 65 104.884 6.397 6.056 488 HA ALA 65 HA ALA 65 102.704 4.883 6.966 489 HB1 ALA 65 HB1 ALA 65 102.275 7.700 6.068 490 HB2 ALA 65 HB2 ALA 65 103.419 7.398 7.377 491 HB3 ALA 65 HB3 ALA 65 101.736 6.894 7.540 492 H ASN 66 H ASN 66 103.240 6.527 3.868 493 HA ASN 66 HA ASN 66 100.559 6.117 2.939 494 HB2 ASN 66 HB2 ASN 66 102.985 6.658 1.222 495 HB3 ASN 66 HB3 ASN 66 101.297 6.990 0.848 496 HD21 ASN 66 HD21 ASN 66 100.241 8.770 2.076 497 HD22 ASN 66 HD22 ASN 66 101.189 9.993 2.772 498 H LEU 67 H LEU 67 103.675 4.531 2.274 499 HA LEU 67 HA LEU 67 102.558 2.717 0.370 500 HB2 LEU 67 HB2 LEU 67 105.213 2.941 1.747 501 HB3 LEU 67 HB3 LEU 67 104.825 1.512 0.789 502 HG LEU 67 HG LEU 67 104.134 3.143 -1.067 503 HD11 LEU 67 HD11 LEU 67 105.572 5.322 -0.780 504 HD12 LEU 67 HD12 LEU 67 105.391 4.983 0.938 505 HD13 LEU 67 HD13 LEU 67 103.963 5.234 -0.066 506 HD21 LEU 67 HD21 LEU 67 106.433 1.837 -0.677 507 HD22 LEU 67 HD22 LEU 67 107.059 3.479 -0.522 508 HD23 LEU 67 HD23 LEU 67 106.241 2.984 -2.000 509 H ALA 68 H ALA 68 102.878 2.579 3.841 510 HA ALA 68 HA ALA 68 102.165 1.041 5.367 511 HB1 ALA 68 HB1 ALA 68 101.007 -0.711 3.221 512 HB2 ALA 68 HB2 ALA 68 100.250 0.840 3.577 513 HB3 ALA 68 HB3 ALA 68 100.398 -0.379 4.843 514 H TYR 69 H TYR 69 102.109 -1.983 4.576 515 HA TYR 69 HA TYR 69 104.677 -2.569 5.511 516 HB2 TYR 69 HB2 TYR 69 102.819 -4.290 3.874 517 HB3 TYR 69 HB3 TYR 69 104.214 -4.872 4.761 518 HD1 TYR 69 HD2 TYR 69 104.239 -4.691 7.280 519 HD2 TYR 69 HD1 TYR 69 100.731 -3.894 4.932 520 HE1 TYR 69 HE2 TYR 69 102.828 -4.944 9.303 521 HE2 TYR 69 HE1 TYR 69 99.319 -4.147 6.955 522 HH TYR 69 HH TYR 69 100.706 -4.517 10.104 523 H LEU 70 H LEU 70 103.666 -1.770 2.299 524 HA LEU 70 HA LEU 70 105.577 -3.148 0.763 525 HB2 LEU 70 HB2 LEU 70 104.331 -0.445 0.220 526 HB3 LEU 70 HB3 LEU 70 105.123 -1.477 -0.970 527 HG LEU 70 HG LEU 70 102.685 -2.275 0.649 528 HD11 LEU 70 HD11 LEU 70 102.107 -0.513 -0.935 529 HD12 LEU 70 HD12 LEU 70 101.508 -2.055 -1.548 530 HD13 LEU 70 HD13 LEU 70 102.975 -1.347 -2.224 531 HD21 LEU 70 HD21 LEU 70 103.876 -4.245 0.032 532 HD22 LEU 70 HD22 LEU 70 104.287 -3.591 -1.554 533 HD23 LEU 70 HD23 LEU 70 102.626 -4.064 -1.199 534 H TRP 71 H TRP 71 105.962 -0.366 2.818 535 HA TRP 71 HA TRP 71 108.056 0.989 1.600 536 HB2 TRP 71 HB2 TRP 71 106.725 1.599 3.676 537 HB3 TRP 71 HB3 TRP 71 107.822 0.559 4.564 538 HD1 TRP 71 HD1 TRP 71 109.826 1.733 5.551 539 HE1 TRP 71 HE1 TRP 71 111.069 3.945 5.116 540 HE3 TRP 71 HE3 TRP 71 107.323 3.361 1.411 541 HZ2 TRP 71 HZ2 TRP 71 111.035 6.117 3.239 542 HZ3 TRP 71 HZ3 TRP 71 107.948 5.492 0.320 543 HH2 TRP 71 HH2 TRP 71 109.796 6.872 1.226 544 HA PRO 72 HA PRO 72 110.957 -2.467 2.323 545 HB2 PRO 72 HB2 PRO 72 112.681 -2.054 0.318 546 HB3 PRO 72 HB3 PRO 72 111.025 -2.614 0.005 547 HG2 PRO 72 HG2 PRO 72 112.202 0.080 -0.350 548 HG3 PRO 72 HG3 PRO 72 110.964 -0.752 -1.307 549 HD2 PRO 72 HD2 PRO 72 110.498 1.182 0.694 550 HD3 PRO 72 HD3 PRO 72 109.281 0.125 -0.053 551 H LEU 73 H LEU 73 111.672 0.890 2.586 552 HA LEU 73 HA LEU 73 114.510 0.478 3.169 553 HB2 LEU 73 HB2 LEU 73 112.883 3.026 3.218 554 HB3 LEU 73 HB3 LEU 73 114.638 2.898 3.302 555 HG LEU 73 HG LEU 73 112.943 1.968 0.969 556 HD11 LEU 73 HD11 LEU 73 113.682 3.938 -0.171 557 HD12 LEU 73 HD12 LEU 73 114.845 4.315 1.101 558 HD13 LEU 73 HD13 LEU 73 113.115 4.477 1.414 559 HD21 LEU 73 HD21 LEU 73 115.941 2.118 1.429 560 HD22 LEU 73 HD22 LEU 73 115.204 1.848 -0.151 561 HD23 LEU 73 HD23 LEU 73 114.987 0.664 1.136 562 H THR 74 H THR 74 115.477 0.792 5.101 563 HA THR 74 HA THR 74 113.996 0.473 7.510 564 HB THR 74 HB THR 74 116.159 0.744 8.626 565 HG1 THR 74 HG1 THR 74 116.990 1.547 6.098 566 HG21 THR 74 HG21 THR 74 115.534 -1.382 7.364 567 HG22 THR 74 HG22 THR 74 117.257 -1.146 7.660 568 HG23 THR 74 HG23 THR 74 116.582 -0.809 6.066 569 H VAL 75 H VAL 75 115.502 3.270 5.892 570 HA VAL 75 HA VAL 75 114.936 5.130 7.975 571 HB VAL 75 HB VAL 75 115.131 6.868 6.199 572 HG11 VAL 75 HG11 VAL 75 117.511 6.111 5.484 573 HG12 VAL 75 HG12 VAL 75 117.196 4.693 6.484 574 HG13 VAL 75 HG13 VAL 75 117.181 6.302 7.206 575 HG21 VAL 75 HG21 VAL 75 115.769 6.154 3.922 576 HG22 VAL 75 HG22 VAL 75 114.151 5.590 4.326 577 HG23 VAL 75 HG23 VAL 75 115.514 4.472 4.373 578 H ASP 76 H ASP 76 113.061 6.174 8.485 579 HA ASP 76 HA ASP 76 110.721 4.759 7.795 580 HB2 ASP 76 HB2 ASP 76 111.058 7.412 9.213 581 HB3 ASP 76 HB3 ASP 76 109.540 6.526 9.111 582 H HIS 77 H HIS 77 112.062 7.769 6.528 583 HA HIS 77 HA HIS 77 110.058 7.642 4.409 584 HB2 HIS 77 HB2 HIS 77 109.547 10.065 4.641 585 HB3 HIS 77 HB3 HIS 77 108.931 9.073 5.946 586 HD1 HIS 77 HD1 HIS 77 110.939 8.961 8.023 587 HD2 HIS 77 HD2 HIS 77 110.601 12.372 5.649 588 HE1 HIS 77 HE1 HIS 77 112.004 10.849 9.329 589 H GLY 78 H GLY 78 110.518 9.419 2.759 590 HA2 GLY 78 HA2 GLY 78 113.067 10.684 2.694 591 HA3 GLY 78 HA3 GLY 78 113.037 9.250 1.672 592 H THR 79 H THR 79 113.384 11.813 0.628 593 HA THR 79 HA THR 79 110.798 12.382 -0.698 594 HB THR 79 HB THR 79 113.226 14.175 -0.760 595 HG1 THR 79 HG1 THR 79 112.803 14.625 1.216 596 HG21 THR 79 HG21 THR 79 111.602 14.853 -2.333 597 HG22 THR 79 HG22 THR 79 111.214 15.828 -0.915 598 HG23 THR 79 HG23 THR 79 110.263 14.386 -1.282 599 H ILE 80 H ILE 80 110.647 12.270 -2.910 600 HA ILE 80 HA ILE 80 112.996 11.143 -4.319 601 HB ILE 80 HB ILE 80 111.350 10.188 -5.897 602 HG12 ILE 80 HG12 ILE 80 109.287 11.243 -3.934 603 HG13 ILE 80 HG13 ILE 80 109.585 11.925 -5.531 604 HG21 ILE 80 HG21 ILE 80 112.124 8.885 -3.958 605 HG22 ILE 80 HG22 ILE 80 110.448 8.495 -4.338 606 HG23 ILE 80 HG23 ILE 80 110.821 9.553 -2.977 607 HD11 ILE 80 HD11 ILE 80 109.196 9.469 -6.359 608 HD12 ILE 80 HD12 ILE 80 107.808 10.487 -5.966 609 HD13 ILE 80 HD13 ILE 80 108.376 9.277 -4.811 610 H GLU 81 H GLU 81 113.719 12.100 -6.183 611 HA GLU 81 HA GLU 81 112.175 14.307 -7.319 612 HB2 GLU 81 HB2 GLU 81 114.050 15.887 -7.128 613 HB3 GLU 81 HB3 GLU 81 113.478 15.370 -5.543 614 HG2 GLU 81 HG2 GLU 81 115.293 13.653 -5.497 615 HG3 GLU 81 HG3 GLU 81 115.901 14.302 -7.014 616 H CYS 82 H CYS 82 112.582 14.755 -9.397 617 HA CYS 82 HA CYS 82 114.669 13.186 -10.781 618 HB2 CYS 82 HB2 CYS 82 112.023 14.329 -11.651 619 HB3 CYS 82 HB3 CYS 82 113.274 13.956 -12.837 620 H LEU 83 H LEU 83 116.413 14.263 -11.479 621 HA LEU 83 HA LEU 83 116.477 17.165 -11.252 622 HB2 LEU 83 HB2 LEU 83 118.588 15.102 -11.903 623 HB3 LEU 83 HB3 LEU 83 118.903 16.838 -11.872 624 HG LEU 83 HG LEU 83 117.669 15.371 -9.533 625 HD11 LEU 83 HD11 LEU 83 119.927 14.448 -10.078 626 HD12 LEU 83 HD12 LEU 83 119.893 15.298 -8.533 627 HD13 LEU 83 HD13 LEU 83 120.589 16.078 -9.954 628 HD21 LEU 83 HD21 LEU 83 117.291 17.692 -9.322 629 HD22 LEU 83 HD22 LEU 83 118.854 18.100 -10.027 630 HD23 LEU 83 HD23 LEU 83 118.770 17.435 -8.396 631 HA PRO 84 HA PRO 84 115.892 18.268 -15.511 632 HB2 PRO 84 HB2 PRO 84 118.541 19.640 -15.442 633 HB3 PRO 84 HB3 PRO 84 116.959 20.261 -15.950 634 HG2 PRO 84 HG2 PRO 84 118.029 20.949 -13.619 635 HG3 PRO 84 HG3 PRO 84 116.284 20.694 -13.802 636 HD2 PRO 84 HD2 PRO 84 118.304 18.947 -12.477 637 HD3 PRO 84 HD3 PRO 84 116.582 19.171 -12.100 638 H SER 85 H SER 85 118.806 16.679 -14.494 639 HA SER 85 HA SER 85 119.832 16.155 -17.138 640 HB2 SER 85 HB2 SER 85 121.522 14.847 -15.998 641 HB3 SER 85 HB3 SER 85 121.286 16.370 -15.147 642 HG SER 85 HG SER 85 120.218 13.878 -14.483 643 H ASP 86 H ASP 86 117.145 14.924 -15.741 644 HA ASP 86 HA ASP 86 115.868 13.066 -16.020 645 HB2 ASP 86 HB2 ASP 86 117.849 12.380 -18.205 646 HB3 ASP 86 HB3 ASP 86 116.290 11.609 -17.946 647 H ASN 87 H ASN 87 117.891 13.085 -14.042 648 HA ASN 87 HA ASN 87 118.465 10.183 -13.838 649 HB2 ASN 87 HB2 ASN 87 119.792 12.523 -12.442 650 HB3 ASN 87 HB3 ASN 87 120.153 10.825 -12.141 651 HD21 ASN 87 HD21 ASN 87 120.140 9.820 -14.803 652 HD22 ASN 87 HD22 ASN 87 121.407 10.546 -15.665 653 H ALA 88 H ALA 88 117.345 9.090 -12.339 654 HA ALA 88 HA ALA 88 115.598 10.607 -10.529 655 HB1 ALA 88 HB1 ALA 88 115.598 7.830 -11.647 656 HB2 ALA 88 HB2 ALA 88 114.285 9.005 -11.565 657 HB3 ALA 88 HB3 ALA 88 114.775 8.129 -10.116 658 H VAL 89 H VAL 89 116.132 10.859 -8.448 659 HA VAL 89 HA VAL 89 117.880 8.835 -7.181 660 HB VAL 89 HB VAL 89 119.064 10.659 -5.998 661 HG11 VAL 89 HG11 VAL 89 120.243 9.843 -7.864 662 HG12 VAL 89 HG12 VAL 89 120.200 11.584 -8.141 663 HG13 VAL 89 HG13 VAL 89 119.087 10.526 -9.009 664 HG21 VAL 89 HG21 VAL 89 117.390 12.412 -6.095 665 HG22 VAL 89 HG22 VAL 89 117.418 12.400 -7.858 666 HG23 VAL 89 HG23 VAL 89 118.821 12.975 -6.957 667 H PHE 90 H PHE 90 117.765 8.759 -4.913 668 HA PHE 90 HA PHE 90 115.208 9.682 -3.752 669 HB2 PHE 90 HB2 PHE 90 115.361 7.259 -3.995 670 HB3 PHE 90 HB3 PHE 90 116.911 7.252 -3.185 671 HD1 PHE 90 HD1 PHE 90 113.289 8.009 -2.676 672 HD2 PHE 90 HD2 PHE 90 117.042 6.987 -0.857 673 HE1 PHE 90 HE1 PHE 90 112.136 7.638 -0.502 674 HE2 PHE 90 HE2 PHE 90 115.892 6.604 1.305 675 HZ PHE 90 HZ PHE 90 113.438 6.931 1.480 676 H VAL 91 H VAL 91 115.379 11.062 -2.064 677 HA VAL 91 HA VAL 91 118.014 11.390 -0.759 678 HB VAL 91 HB VAL 91 115.654 13.292 -0.874 679 HG11 VAL 91 HG11 VAL 91 116.892 14.833 0.326 680 HG12 VAL 91 HG12 VAL 91 118.439 14.107 -0.106 681 HG13 VAL 91 HG13 VAL 91 117.421 13.350 1.114 682 HG21 VAL 91 HG21 VAL 91 116.810 12.934 -3.060 683 HG22 VAL 91 HG22 VAL 91 118.324 13.432 -2.303 684 HG23 VAL 91 HG23 VAL 91 116.992 14.578 -2.449 685 H ALA 92 H ALA 92 118.203 10.845 1.347 686 HA ALA 92 HA ALA 92 115.738 10.060 2.783 687 HB1 ALA 92 HB1 ALA 92 118.659 9.400 3.157 688 HB2 ALA 92 HB2 ALA 92 117.319 8.300 2.835 689 HB3 ALA 92 HB3 ALA 92 117.467 9.071 4.414 690 HA PRO 93 HA PRO 93 115.664 13.492 5.566 691 HB2 PRO 93 HB2 PRO 93 115.946 11.597 7.854 692 HB3 PRO 93 HB3 PRO 93 114.730 12.858 7.573 693 HG2 PRO 93 HG2 PRO 93 114.214 10.247 7.240 694 HG3 PRO 93 HG3 PRO 93 113.436 11.516 6.281 695 HD2 PRO 93 HD2 PRO 93 115.481 9.550 5.448 696 HD3 PRO 93 HD3 PRO 93 114.312 10.457 4.467 697 H ASP 94 H ASP 94 118.169 11.078 5.930 698 HA ASP 94 HA ASP 94 119.788 12.444 7.807 699 HB2 ASP 94 HB2 ASP 94 121.594 10.934 6.963 700 HB3 ASP 94 HB3 ASP 94 120.125 10.107 7.463 701 H GLY 95 H GLY 95 119.157 13.228 4.544 702 HA2 GLY 95 HA2 GLY 95 119.963 15.146 3.432 703 HA3 GLY 95 HA3 GLY 95 121.315 15.203 4.558 704 H THR 96 H THR 96 120.867 12.071 3.339 705 HA THR 96 HA THR 96 123.185 12.369 1.559 706 HB THR 96 HB THR 96 121.883 9.880 2.696 707 HG1 THR 96 HG1 THR 96 123.550 9.980 4.136 708 HG21 THR 96 HG21 THR 96 124.344 9.083 2.101 709 HG22 THR 96 HG22 THR 96 124.245 10.400 0.932 710 HG23 THR 96 HG23 THR 96 123.072 9.084 0.880 711 H THR 97 H THR 97 123.042 11.874 -0.599 712 HA THR 97 HA THR 97 120.339 11.259 -1.627 713 HB THR 97 HB THR 97 122.745 12.336 -3.123 714 HG1 THR 97 HG1 THR 97 122.004 13.847 -1.705 715 HG21 THR 97 HG21 THR 97 121.008 12.914 -4.815 716 HG22 THR 97 HG22 THR 97 119.812 12.064 -3.836 717 HG23 THR 97 HG23 THR 97 121.153 11.175 -4.559 718 H TYR 98 H TYR 98 119.946 9.399 -2.564 719 HA TYR 98 HA TYR 98 122.178 7.576 -3.214 720 HB2 TYR 98 HB2 TYR 98 119.343 6.920 -2.398 721 HB3 TYR 98 HB3 TYR 98 120.593 5.751 -2.770 722 HD1 TYR 98 HD2 TYR 98 122.448 5.354 -1.181 723 HD2 TYR 98 HD1 TYR 98 119.266 8.098 -0.287 724 HE1 TYR 98 HE2 TYR 98 123.103 5.341 1.211 725 HE2 TYR 98 HE1 TYR 98 119.932 8.097 2.098 726 HH TYR 98 HH TYR 98 121.514 7.398 3.560 727 H ALA 99 H ALA 99 121.996 6.405 -5.178 728 HA ALA 99 HA ALA 99 120.372 7.735 -7.197 729 HB1 ALA 99 HB1 ALA 99 122.442 7.372 -8.122 730 HB2 ALA 99 HB2 ALA 99 121.687 5.854 -8.600 731 HB3 ALA 99 HB3 ALA 99 122.727 5.913 -7.178 732 H LEU 100 H LEU 100 118.515 6.967 -8.008 733 HA LEU 100 HA LEU 100 117.507 4.406 -7.040 734 HB2 LEU 100 HB2 LEU 100 116.270 6.677 -8.598 735 HB3 LEU 100 HB3 LEU 100 115.444 5.142 -8.357 736 HG LEU 100 HG LEU 100 116.573 6.667 -6.016 737 HD11 LEU 100 HD11 LEU 100 114.283 7.638 -5.752 738 HD12 LEU 100 HD12 LEU 100 113.856 6.977 -7.330 739 HD13 LEU 100 HD13 LEU 100 115.098 8.222 -7.204 740 HD21 LEU 100 HD21 LEU 100 115.853 4.286 -5.759 741 HD22 LEU 100 HD22 LEU 100 114.248 4.738 -6.332 742 HD23 LEU 100 HD23 LEU 100 114.859 5.391 -4.814 743 H ASN 101 H ASN 101 118.070 6.046 -10.151 744 HA ASN 101 HA ASN 101 117.706 3.438 -11.506 745 HB2 ASN 101 HB2 ASN 101 117.199 4.631 -13.501 746 HB3 ASN 101 HB3 ASN 101 116.266 5.348 -12.197 747 HD21 ASN 101 HD21 ASN 101 116.462 7.028 -14.251 748 HD22 ASN 101 HD22 ASN 101 117.654 8.214 -14.021 749 H ASP 102 H ASP 102 119.001 3.154 -13.541 750 HA ASP 102 HA ASP 102 121.613 2.637 -12.743 751 HB2 ASP 102 HB2 ASP 102 120.389 1.491 -14.587 752 HB3 ASP 102 HB3 ASP 102 120.644 2.917 -15.591 753 H ARG 103 H ARG 103 120.363 5.403 -14.596 754 HA ARG 103 HA ARG 103 122.895 6.335 -15.452 755 HB2 ARG 103 HB2 ARG 103 120.242 7.742 -15.135 756 HB3 ARG 103 HB3 ARG 103 121.667 8.489 -15.867 757 HG2 ARG 103 HG2 ARG 103 121.791 6.598 -17.484 758 HG3 ARG 103 HG3 ARG 103 120.302 5.947 -16.800 759 HD2 ARG 103 HD2 ARG 103 120.607 8.660 -18.116 760 HD3 ARG 103 HD3 ARG 103 119.831 7.250 -18.831 761 HE ARG 103 HE ARG 103 118.679 9.046 -16.918 762 HH11 ARG 103 HH11 ARG 103 118.629 5.690 -17.950 763 HH12 ARG 103 HH12 ARG 103 117.023 5.433 -17.354 764 HH21 ARG 103 HH21 ARG 103 116.645 8.666 -16.182 765 HH22 ARG 103 HH22 ARG 103 115.904 7.108 -16.358 766 H ALA 104 H ALA 104 120.906 7.199 -12.621 767 HA ALA 104 HA ALA 104 122.629 9.132 -11.546 768 HB1 ALA 104 HB1 ALA 104 121.505 8.716 -9.430 769 HB2 ALA 104 HB2 ALA 104 120.895 7.172 -10.027 770 HB3 ALA 104 HB3 ALA 104 120.326 8.680 -10.740 771 H GLU 105 H GLU 105 122.672 5.591 -11.253 772 HA GLU 105 HA GLU 105 124.791 5.410 -9.399 773 HB2 GLU 105 HB2 GLU 105 124.024 3.505 -11.625 774 HB3 GLU 105 HB3 GLU 105 125.128 3.128 -10.304 775 HG2 GLU 105 HG2 GLU 105 122.235 3.966 -9.969 776 HG3 GLU 105 HG3 GLU 105 122.828 2.314 -9.853 777 H LYS 106 H LYS 106 124.796 5.581 -12.948 778 HA LYS 106 HA LYS 106 127.559 5.365 -13.366 779 HB2 LYS 106 HB2 LYS 106 125.480 6.925 -14.913 780 HB3 LYS 106 HB3 LYS 106 127.126 6.631 -15.473 781 HG2 LYS 106 HG2 LYS 106 126.768 4.229 -15.432 782 HG3 LYS 106 HG3 LYS 106 125.171 4.442 -14.715 783 HD2 LYS 106 HD2 LYS 106 124.853 4.067 -17.074 784 HD3 LYS 106 HD3 LYS 106 124.524 5.771 -16.762 785 HE2 LYS 106 HE2 LYS 106 125.944 5.451 -18.776 786 HE3 LYS 106 HE3 LYS 106 126.770 6.378 -17.525 787 HZ1 LYS 106 HZ1 LYS 106 127.907 4.342 -18.707 788 HZ2 LYS 106 HZ2 LYS 106 127.081 3.471 -17.504 789 HZ3 LYS 106 HZ3 LYS 106 128.189 4.683 -17.069 790 H ALA 107 H ALA 107 125.601 8.126 -12.413 791 HA ALA 107 HA ALA 107 127.629 10.108 -12.663 792 HB1 ALA 107 HB1 ALA 107 125.217 10.624 -12.579 793 HB2 ALA 107 HB2 ALA 107 126.132 11.517 -11.364 794 HB3 ALA 107 HB3 ALA 107 125.179 10.109 -10.893 795 H GLY 108 H GLY 108 127.658 7.517 -10.610 796 HA2 GLY 108 HA2 GLY 108 129.026 7.019 -8.863 797 HA3 GLY 108 HA3 GLY 108 129.681 8.642 -8.955 798 H HIS 109 H HIS 109 126.219 8.266 -8.513 799 HA HIS 109 HA HIS 109 126.415 9.250 -5.796 800 HB2 HIS 109 HB2 HIS 109 124.107 8.532 -7.588 801 HB3 HIS 109 HB3 HIS 109 123.878 8.980 -5.908 802 HD1 HIS 109 HD1 HIS 109 126.116 11.262 -5.949 803 HD2 HIS 109 HD2 HIS 109 122.971 10.868 -8.657 804 HE1 HIS 109 HE1 HIS 109 125.735 13.559 -6.942 805 HA PRO 110 HA PRO 110 126.612 5.076 -4.166 806 HB2 PRO 110 HB2 PRO 110 125.236 6.022 -1.713 807 HB3 PRO 110 HB3 PRO 110 126.836 5.282 -1.898 808 HG2 PRO 110 HG2 PRO 110 126.511 7.878 -1.341 809 HG3 PRO 110 HG3 PRO 110 127.860 7.273 -2.318 810 HD2 PRO 110 HD2 PRO 110 125.382 8.689 -3.211 811 HD3 PRO 110 HD3 PRO 110 127.035 8.775 -3.860 812 HA PRO 111 HA PRO 111 122.378 3.709 -4.847 813 HB2 PRO 111 HB2 PRO 111 122.568 1.065 -4.221 814 HB3 PRO 111 HB3 PRO 111 123.225 1.755 -5.718 815 HG2 PRO 111 HG2 PRO 111 124.623 0.910 -3.259 816 HG3 PRO 111 HG3 PRO 111 125.169 0.883 -4.941 817 HD2 PRO 111 HD2 PRO 111 125.901 2.794 -3.038 818 HD3 PRO 111 HD3 PRO 111 126.077 2.966 -4.795 819 H ILE 112 H ILE 112 120.465 2.980 -3.706 820 HA ILE 112 HA ILE 112 120.321 3.846 -1.030 821 HB ILE 112 HB ILE 112 118.364 2.141 -2.595 822 HG12 ILE 112 HG12 ILE 112 118.372 5.111 -2.010 823 HG13 ILE 112 HG13 ILE 112 118.973 4.420 -3.515 824 HG21 ILE 112 HG21 ILE 112 116.706 3.088 -0.926 825 HG22 ILE 112 HG22 ILE 112 118.076 3.681 0.006 826 HG23 ILE 112 HG23 ILE 112 117.852 1.949 -0.227 827 HD11 ILE 112 HD11 ILE 112 116.156 4.013 -2.457 828 HD12 ILE 112 HD12 ILE 112 116.775 3.520 -4.034 829 HD13 ILE 112 HD13 ILE 112 116.598 5.233 -3.649 830 H THR 113 H THR 113 121.624 0.916 -2.151 831 HA THR 113 HA THR 113 120.491 -1.041 -0.659 832 HB THR 113 HB THR 113 122.324 -1.263 -2.378 833 HG1 THR 113 HG1 THR 113 122.701 -3.235 -1.560 834 HG21 THR 113 HG21 THR 113 124.159 -0.037 -1.456 835 HG22 THR 113 HG22 THR 113 124.588 -1.737 -1.345 836 HG23 THR 113 HG23 THR 113 124.043 -0.875 0.089 837 HA PRO 114 HA PRO 114 123.410 -0.321 3.130 838 HB2 PRO 114 HB2 PRO 114 123.188 2.615 3.497 839 HB3 PRO 114 HB3 PRO 114 124.597 1.553 3.691 840 HG2 PRO 114 HG2 PRO 114 124.403 3.211 1.631 841 HG3 PRO 114 HG3 PRO 114 125.106 1.591 1.450 842 HD2 PRO 114 HD2 PRO 114 122.358 2.539 0.694 843 HD3 PRO 114 HD3 PRO 114 123.459 1.480 -0.207 844 H ILE 115 H ILE 115 120.633 1.739 2.419 845 HA ILE 115 HA ILE 115 119.567 1.289 5.121 846 HB ILE 115 HB ILE 115 117.782 2.923 4.400 847 HG12 ILE 115 HG12 ILE 115 119.731 3.545 2.168 848 HG13 ILE 115 HG13 ILE 115 118.246 2.631 1.926 849 HG21 ILE 115 HG21 ILE 115 119.049 4.689 5.158 850 HG22 ILE 115 HG22 ILE 115 120.458 4.241 4.194 851 HG23 ILE 115 HG23 ILE 115 120.067 3.339 5.661 852 HD11 ILE 115 HD11 ILE 115 116.904 4.475 2.182 853 HD12 ILE 115 HD12 ILE 115 118.357 5.306 1.626 854 HD13 ILE 115 HD13 ILE 115 117.982 5.242 3.347 855 H ARG 116 H ARG 116 119.459 -0.512 2.429 856 HA ARG 116 HA ARG 116 116.626 -0.912 2.142 857 HB2 ARG 116 HB2 ARG 116 118.302 -1.334 0.330 858 HB3 ARG 116 HB3 ARG 116 118.890 -2.714 1.257 859 HG2 ARG 116 HG2 ARG 116 116.594 -3.682 1.212 860 HG3 ARG 116 HG3 ARG 116 116.077 -2.339 0.190 861 HD2 ARG 116 HD2 ARG 116 118.272 -4.314 -0.492 862 HD3 ARG 116 HD3 ARG 116 116.644 -4.329 -1.162 863 HE ARG 116 HE ARG 116 117.577 -1.802 -1.686 864 HH11 ARG 116 HH11 ARG 116 118.743 -5.026 -2.438 865 HH12 ARG 116 HH12 ARG 116 119.528 -4.512 -3.895 866 HH21 ARG 116 HH21 ARG 116 118.607 -1.198 -3.571 867 HH22 ARG 116 HH22 ARG 116 119.450 -2.371 -4.527 868 H ALA 117 H ALA 117 115.355 -2.518 3.018 869 HA ALA 117 HA ALA 117 116.341 -3.662 5.499 870 HB1 ALA 117 HB1 ALA 117 113.594 -3.915 4.274 871 HB2 ALA 117 HB2 ALA 117 114.097 -2.533 5.249 872 HB3 ALA 117 HB3 ALA 117 114.041 -4.144 5.965 873 H LYS 118 H LYS 118 116.479 -5.814 5.998 874 HA LYS 118 HA LYS 118 116.646 -7.729 3.834 875 HB2 LYS 118 HB2 LYS 118 118.168 -7.787 5.815 876 HB3 LYS 118 HB3 LYS 118 116.780 -8.178 6.829 877 HG2 LYS 118 HG2 LYS 118 117.774 -10.274 6.321 878 HG3 LYS 118 HG3 LYS 118 116.384 -10.161 5.243 879 HD2 LYS 118 HD2 LYS 118 117.822 -9.415 3.410 880 HD3 LYS 118 HD3 LYS 118 119.223 -9.423 4.483 881 HE2 LYS 118 HE2 LYS 118 119.119 -11.476 3.093 882 HE3 LYS 118 HE3 LYS 118 118.992 -11.839 4.814 883 HZ1 LYS 118 HZ1 LYS 118 116.822 -12.420 4.630 884 HZ2 LYS 118 HZ2 LYS 118 117.314 -12.819 3.052 885 HZ3 LYS 118 HZ3 LYS 118 116.511 -11.351 3.350 886 H GLY 119 H GLY 119 115.175 -9.340 3.357 887 HA2 GLY 119 HA2 GLY 119 112.533 -9.076 4.637 888 HA3 GLY 119 HA3 GLY 119 112.832 -9.761 3.054 889 H SER 120 H SER 120 111.271 -11.134 4.863 890 HA SER 120 HA SER 120 112.567 -13.009 6.490 891 HB2 SER 120 HB2 SER 120 110.046 -13.431 4.868 892 HB3 SER 120 HB3 SER 120 110.544 -14.348 6.285 893 HG SER 120 HG SER 120 109.938 -11.625 6.169 894 H GLY 121 H GLY 121 111.866 -13.070 3.018 895 HA2 GLY 121 HA2 GLY 121 113.972 -15.075 2.673 896 HA3 GLY 121 HA3 GLY 121 112.367 -15.483 2.070 897 H GLY 122 H GLY 122 114.471 -15.371 0.311 898 HA2 GLY 122 HA2 GLY 122 114.826 -14.570 -1.830 899 HA3 GLY 122 HA3 GLY 122 113.521 -13.420 -1.570 900 H GLY 123 H GLY 123 116.329 -13.679 0.546 901 HA2 GLY 123 HA2 GLY 123 118.114 -12.276 0.921 902 HA3 GLY 123 HA3 GLY 123 117.918 -11.700 -0.730 903 H TYR 124 H TYR 124 117.514 -9.602 -0.887 904 HA TYR 124 HA TYR 124 116.427 -8.189 1.459 905 HB2 TYR 124 HB2 TYR 124 118.132 -7.364 -0.867 906 HB3 TYR 124 HB3 TYR 124 117.265 -6.170 0.083 907 HD1 TYR 124 HD1 TYR 124 119.079 -9.305 1.039 908 HD2 TYR 124 HD2 TYR 124 118.798 -5.037 1.427 909 HE1 TYR 124 HE1 TYR 124 120.930 -9.333 2.691 910 HE2 TYR 124 HE2 TYR 124 120.639 -5.065 3.087 911 HH TYR 124 HH TYR 124 122.057 -8.070 4.179 912 H ILE 125 H ILE 125 114.957 -6.397 1.089 913 HA ILE 125 HA ILE 125 112.788 -7.244 -0.611 914 HB ILE 125 HB ILE 125 113.091 -4.868 1.245 915 HG12 ILE 125 HG12 ILE 125 111.543 -7.437 1.653 916 HG13 ILE 125 HG13 ILE 125 113.205 -7.240 2.204 917 HG21 ILE 125 HG21 ILE 125 111.328 -4.614 -0.555 918 HG22 ILE 125 HG22 ILE 125 110.700 -4.609 1.092 919 HG23 ILE 125 HG23 ILE 125 110.551 -6.058 0.098 920 HD11 ILE 125 HD11 ILE 125 111.230 -5.127 2.964 921 HD12 ILE 125 HD12 ILE 125 112.634 -5.733 3.846 922 HD13 ILE 125 HD13 ILE 125 111.151 -6.681 3.796 923 H SER 126 H SER 126 112.139 -6.396 -2.492 924 HA SER 126 HA SER 126 113.993 -4.959 -4.079 925 HB2 SER 126 HB2 SER 126 111.061 -5.510 -4.558 926 HB3 SER 126 HB3 SER 126 112.214 -4.963 -5.770 927 HG SER 126 HG SER 126 113.243 -6.879 -5.556 928 H LEU 127 H LEU 127 114.176 -2.896 -4.642 929 HA LEU 127 HA LEU 127 112.414 -0.901 -3.422 930 HB2 LEU 127 HB2 LEU 127 114.858 -0.509 -5.162 931 HB3 LEU 127 HB3 LEU 127 114.019 0.735 -4.238 932 HG LEU 127 HG LEU 127 115.378 -1.699 -3.041 933 HD11 LEU 127 HD11 LEU 127 117.005 -0.007 -2.184 934 HD12 LEU 127 HD12 LEU 127 116.197 1.219 -3.162 935 HD13 LEU 127 HD13 LEU 127 117.019 -0.132 -3.943 936 HD21 LEU 127 HD21 LEU 127 113.863 0.649 -1.898 937 HD22 LEU 127 HD22 LEU 127 115.067 -0.210 -0.938 938 HD23 LEU 127 HD23 LEU 127 113.652 -1.068 -1.550 939 H GLY 128 H GLY 128 111.933 -2.752 -6.012 940 HA2 GLY 128 HA2 GLY 128 111.862 -1.263 -8.312 941 HA3 GLY 128 HA3 GLY 128 110.696 -2.526 -7.946 942 H ALA 129 H ALA 129 109.305 -1.330 -5.811 943 HA ALA 129 HA ALA 129 107.406 0.171 -7.246 944 HB1 ALA 129 HB1 ALA 129 106.571 -0.895 -5.337 945 HB2 ALA 129 HB2 ALA 129 106.623 0.799 -4.848 946 HB3 ALA 129 HB3 ALA 129 107.886 -0.311 -4.317 947 H LEU 130 H LEU 130 109.906 1.224 -4.944 948 HA LEU 130 HA LEU 130 109.253 3.957 -4.928 949 HB2 LEU 130 HB2 LEU 130 110.796 2.850 -3.326 950 HB3 LEU 130 HB3 LEU 130 111.989 2.696 -4.617 951 HG LEU 130 HG LEU 130 111.878 5.201 -4.902 952 HD11 LEU 130 HD11 LEU 130 110.997 6.355 -2.753 953 HD12 LEU 130 HD12 LEU 130 110.108 4.856 -2.484 954 HD13 LEU 130 HD13 LEU 130 109.809 5.810 -3.937 955 HD21 LEU 130 HD21 LEU 130 113.485 5.553 -3.241 956 HD22 LEU 130 HD22 LEU 130 113.508 3.799 -3.381 957 HD23 LEU 130 HD23 LEU 130 112.629 4.567 -2.060 958 H LEU 131 H LEU 131 111.411 2.086 -7.029 959 HA LEU 131 HA LEU 131 112.508 4.234 -8.471 960 HB2 LEU 131 HB2 LEU 131 113.360 1.904 -8.558 961 HB3 LEU 131 HB3 LEU 131 111.923 1.431 -9.461 962 HG LEU 131 HG LEU 131 112.556 3.185 -11.184 963 HD11 LEU 131 HD11 LEU 131 114.034 4.588 -9.923 964 HD12 LEU 131 HD12 LEU 131 115.032 3.776 -11.129 965 HD13 LEU 131 HD13 LEU 131 115.041 3.216 -9.457 966 HD21 LEU 131 HD21 LEU 131 114.542 1.765 -12.029 967 HD22 LEU 131 HD22 LEU 131 113.008 0.933 -11.772 968 HD23 LEU 131 HD23 LEU 131 114.298 0.793 -10.578 969 H SER 132 H SER 132 109.558 2.338 -9.012 970 HA SER 132 HA SER 132 108.908 3.363 -11.538 971 HB2 SER 132 HB2 SER 132 107.808 1.398 -10.434 972 HB3 SER 132 HB3 SER 132 106.956 2.525 -9.384 973 HG SER 132 HG SER 132 106.056 1.802 -11.554 974 H THR 133 H THR 133 108.054 4.519 -8.288 975 HA THR 133 HA THR 133 106.291 6.560 -9.105 976 HB THR 133 HB THR 133 108.089 6.572 -6.669 977 HG1 THR 133 HG1 THR 133 106.899 4.757 -6.614 978 HG21 THR 133 HG21 THR 133 106.332 7.981 -5.708 979 HG22 THR 133 HG22 THR 133 105.401 7.867 -7.202 980 HG23 THR 133 HG23 THR 133 106.948 8.714 -7.189 981 H THR 134 H THR 134 109.790 6.646 -8.449 982 HA THR 134 HA THR 134 110.092 9.422 -8.877 983 HB THR 134 HB THR 134 112.197 7.305 -9.351 984 HG1 THR 134 HG1 THR 134 111.408 7.040 -7.331 985 HG21 THR 134 HG21 THR 134 112.307 10.234 -8.559 986 HG22 THR 134 HG22 THR 134 112.816 9.551 -10.104 987 HG23 THR 134 HG23 THR 134 113.701 9.156 -8.631 988 H LEU 135 H LEU 135 110.311 6.670 -11.109 989 HA LEU 135 HA LEU 135 111.265 8.079 -13.346 990 HB2 LEU 135 HB2 LEU 135 109.512 5.619 -13.172 991 HB3 LEU 135 HB3 LEU 135 110.230 6.217 -14.669 992 HG LEU 135 HG LEU 135 111.856 5.557 -12.202 993 HD11 LEU 135 HD11 LEU 135 112.521 3.544 -13.712 994 HD12 LEU 135 HD12 LEU 135 111.004 3.867 -14.550 995 HD13 LEU 135 HD13 LEU 135 110.994 3.454 -12.834 996 HD21 LEU 135 HD21 LEU 135 113.632 5.395 -14.087 997 HD22 LEU 135 HD22 LEU 135 113.099 7.004 -13.599 998 HD23 LEU 135 HD23 LEU 135 112.460 6.271 -15.071 999 H ASN 136 H ASN 136 107.962 7.549 -12.161 1000 HA ASN 136 HA ASN 136 106.571 8.638 -14.339 1001 HB2 ASN 136 HB2 ASN 136 105.887 8.694 -11.390 1002 HB3 ASN 136 HB3 ASN 136 104.764 9.095 -12.688 1003 HD21 ASN 136 HD21 ASN 136 104.407 6.864 -10.834 1004 HD22 ASN 136 HD22 ASN 136 104.454 5.439 -11.756 1005 H LEU 137 H LEU 137 107.906 10.192 -11.443 1006 HA LEU 137 HA LEU 137 107.090 12.826 -12.054 1007 HB2 LEU 137 HB2 LEU 137 109.538 11.918 -10.519 1008 HB3 LEU 137 HB3 LEU 137 108.830 13.533 -10.470 1009 HG LEU 137 HG LEU 137 107.373 10.994 -9.673 1010 HD11 LEU 137 HD11 LEU 137 108.940 11.295 -7.957 1011 HD12 LEU 137 HD12 LEU 137 107.561 12.225 -7.370 1012 HD13 LEU 137 HD13 LEU 137 108.927 13.051 -8.122 1013 HD21 LEU 137 HD21 LEU 137 105.801 12.657 -10.406 1014 HD22 LEU 137 HD22 LEU 137 106.677 13.941 -9.574 1015 HD23 LEU 137 HD23 LEU 137 105.807 12.722 -8.645 1016 H CYS 138 H CYS 138 109.995 11.016 -12.954 1017 HA CYS 138 HA CYS 138 111.427 13.088 -14.172 1018 HB2 CYS 138 HB2 CYS 138 111.361 10.116 -14.488 1019 HB3 CYS 138 HB3 CYS 138 112.269 11.071 -15.655 1020 H GLY 139 H GLY 139 108.604 11.363 -15.326 1021 HA2 GLY 139 HA2 GLY 139 107.217 11.949 -17.094 1022 HA3 GLY 139 HA3 GLY 139 108.378 13.183 -17.561 1023 H LYS 140 H LYS 140 109.520 9.912 -17.126 1024 HA LYS 140 HA LYS 140 110.229 9.787 -19.943 1025 HB2 LYS 140 HB2 LYS 140 111.814 9.089 -18.146 1026 HB3 LYS 140 HB3 LYS 140 110.725 7.758 -17.753 1027 HG2 LYS 140 HG2 LYS 140 110.965 6.843 -20.002 1028 HG3 LYS 140 HG3 LYS 140 111.968 8.214 -20.481 1029 HD2 LYS 140 HD2 LYS 140 113.442 6.372 -19.959 1030 HD3 LYS 140 HD3 LYS 140 113.590 7.564 -18.666 1031 HE2 LYS 140 HE2 LYS 140 112.124 6.280 -17.229 1032 HE3 LYS 140 HE3 LYS 140 111.756 5.155 -18.537 1033 HZ1 LYS 140 HZ1 LYS 140 114.431 5.061 -18.472 1034 HZ2 LYS 140 HZ2 LYS 140 113.417 3.974 -17.648 1035 HZ3 LYS 140 HZ3 LYS 140 114.083 5.306 -16.829 1036 H GLY 141 H GLY 141 109.254 8.580 -21.465 1037 HA2 GLY 141 HA2 GLY 141 106.702 7.386 -20.894 1038 HA3 GLY 141 HA3 GLY 141 107.513 7.419 -22.457 Start of MODEL 6 1 H1 HIS -5 HT1 HIS -5 66.953 26.185 -2.644 2 H2 HIS -5 HT2 HIS -5 67.579 24.615 -2.474 3 H3 HIS -5 HT3 HIS -5 66.104 25.027 -1.741 4 HA HIS -5 HA HIS -5 65.253 25.504 -4.065 5 HB2 HIS -5 HB2 HIS -5 67.730 23.869 -4.657 6 HB3 HIS -5 HB3 HIS -5 66.453 24.202 -5.811 7 HD1 HIS -5 HD1 HIS -5 69.397 25.745 -4.109 8 HD2 HIS -5 HD2 HIS -5 66.437 26.890 -6.812 9 HE1 HIS -5 HE1 HIS -5 70.132 27.966 -5.075 10 H HIS -4 H HIS -4 63.961 23.803 -5.003 11 HA HIS -4 HA HIS -4 63.850 21.357 -3.329 12 HB2 HIS -4 HB2 HIS -4 61.619 22.871 -4.691 13 HB3 HIS -4 HB3 HIS -4 61.428 21.331 -3.876 14 HD1 HIS -4 HD1 HIS -4 61.885 24.987 -3.253 15 HD2 HIS -4 HD2 HIS -4 61.509 21.488 -1.017 16 HE1 HIS -4 HE1 HIS -4 61.482 25.707 -0.860 17 H HIS -3 H HIS -3 63.792 19.416 -4.331 18 HA HIS -3 HA HIS -3 63.689 19.386 -7.294 19 HB2 HIS -3 HB2 HIS -3 65.434 17.747 -5.453 20 HB3 HIS -3 HB3 HIS -3 65.279 17.481 -7.179 21 HD1 HIS -3 HD1 HIS -3 66.838 19.744 -4.647 22 HD2 HIS -3 HD2 HIS -3 66.613 19.433 -8.800 23 HE1 HIS -3 HE1 HIS -3 68.577 21.329 -5.579 24 H HIS -2 H HIS -2 62.541 17.748 -8.244 25 HA HIS -2 HA HIS -2 61.028 15.960 -6.423 26 HB2 HIS -2 HB2 HIS -2 60.201 17.120 -9.087 27 HB3 HIS -2 HB3 HIS -2 59.260 15.983 -8.141 28 HD1 HIS -2 HD1 HIS -2 58.656 16.944 -5.608 29 HD2 HIS -2 HD2 HIS -2 59.601 19.746 -8.547 30 HE1 HIS -2 HE1 HIS -2 57.769 19.168 -4.787 31 H HIS -1 H HIS -1 61.012 13.818 -6.851 32 HA HIS -1 HA HIS -1 62.332 12.876 -9.329 33 HB2 HIS -1 HB2 HIS -1 63.874 12.687 -7.423 34 HB3 HIS -1 HB3 HIS -1 62.674 11.761 -6.542 35 HD1 HIS -1 HD1 HIS -1 62.411 9.281 -7.145 36 HD2 HIS -1 HD2 HIS -1 65.148 11.276 -9.575 37 HE1 HIS -1 HE1 HIS -1 63.631 7.497 -8.462 38 H HIS 0 H HIS 0 61.350 11.219 -10.357 39 HA HIS 0 HA HIS 0 58.947 10.043 -9.077 40 HB2 HIS 0 HB2 HIS 0 59.512 10.601 -11.991 41 HB3 HIS 0 HB3 HIS 0 58.110 9.733 -11.394 42 HD1 HIS 0 HD1 HIS 0 59.571 13.156 -11.716 43 HD2 HIS 0 HD2 HIS 0 56.140 11.392 -10.137 44 HE1 HIS 0 HE1 HIS 0 57.955 15.043 -11.230 45 H SER 1 H SER 1 58.746 7.864 -9.040 46 HA SER 1 HA SER 1 61.033 6.238 -9.379 47 HB2 SER 1 HB2 SER 1 58.126 5.409 -9.189 48 HB3 SER 1 HB3 SER 1 59.519 4.359 -8.949 49 HG SER 1 HG SER 1 59.545 5.119 -7.011 50 H SER 2 H SER 2 61.388 4.518 -10.872 51 HA SER 2 HA SER 2 60.028 4.862 -13.485 52 HB2 SER 2 HB2 SER 2 62.358 5.738 -13.494 53 HB3 SER 2 HB3 SER 2 62.931 4.145 -13.011 54 HG SER 2 HG SER 2 62.973 4.113 -15.167 55 H GLY 3 H GLY 3 59.451 3.028 -14.572 56 HA2 GLY 3 HA2 GLY 3 59.416 0.561 -13.032 57 HA3 GLY 3 HA3 GLY 3 58.587 0.855 -14.558 58 H LEU 4 H LEU 4 59.609 -1.466 -14.676 59 HA LEU 4 HA LEU 4 62.376 -1.336 -15.669 60 HB2 LEU 4 HB2 LEU 4 61.762 -3.085 -13.997 61 HB3 LEU 4 HB3 LEU 4 60.636 -3.764 -15.174 62 HG LEU 4 HG LEU 4 62.602 -3.940 -16.779 63 HD11 LEU 4 HD11 LEU 4 64.837 -4.067 -15.502 64 HD12 LEU 4 HD12 LEU 4 64.022 -3.156 -14.230 65 HD13 LEU 4 HD13 LEU 4 64.201 -2.458 -15.840 66 HD21 LEU 4 HD21 LEU 4 61.778 -5.925 -15.668 67 HD22 LEU 4 HD22 LEU 4 62.602 -5.487 -14.171 68 HD23 LEU 4 HD23 LEU 4 63.540 -5.961 -15.588 69 H VAL 5 H VAL 5 62.814 -1.388 -17.783 70 HA VAL 5 HA VAL 5 60.691 -1.376 -19.706 71 HB VAL 5 HB VAL 5 62.520 -1.192 -21.366 72 HG11 VAL 5 HG11 VAL 5 62.845 0.533 -18.892 73 HG12 VAL 5 HG12 VAL 5 61.717 0.823 -20.217 74 HG13 VAL 5 HG13 VAL 5 63.456 0.935 -20.497 75 HG21 VAL 5 HG21 VAL 5 64.832 -1.224 -20.665 76 HG22 VAL 5 HG22 VAL 5 64.088 -2.712 -20.085 77 HG23 VAL 5 HG23 VAL 5 64.369 -1.375 -18.970 78 HA PRO 6 HA PRO 6 60.838 -5.727 -20.603 79 HB2 PRO 6 HB2 PRO 6 59.521 -5.844 -22.953 80 HB3 PRO 6 HB3 PRO 6 58.703 -5.370 -21.451 81 HG2 PRO 6 HG2 PRO 6 59.596 -3.701 -23.721 82 HG3 PRO 6 HG3 PRO 6 58.209 -3.498 -22.639 83 HD2 PRO 6 HD2 PRO 6 60.674 -2.139 -22.447 84 HD3 PRO 6 HD3 PRO 6 59.397 -2.181 -21.215 85 H ARG 7 H ARG 7 61.261 -7.240 -22.656 86 HA ARG 7 HA ARG 7 63.969 -6.899 -23.394 87 HB2 ARG 7 HB2 ARG 7 61.774 -8.760 -24.231 88 HB3 ARG 7 HB3 ARG 7 63.278 -8.726 -25.150 89 HG2 ARG 7 HG2 ARG 7 63.713 -10.366 -23.536 90 HG3 ARG 7 HG3 ARG 7 64.426 -8.925 -22.814 91 HD2 ARG 7 HD2 ARG 7 62.348 -8.567 -21.510 92 HD3 ARG 7 HD3 ARG 7 61.668 -10.032 -22.210 93 HE ARG 7 HE ARG 7 63.619 -9.868 -20.094 94 HH11 ARG 7 HH11 ARG 7 62.424 -11.921 -22.680 95 HH12 ARG 7 HH12 ARG 7 63.000 -13.371 -21.928 96 HH21 ARG 7 HH21 ARG 7 64.337 -11.769 -19.177 97 HH22 ARG 7 HH22 ARG 7 64.069 -13.285 -19.970 98 H GLY 8 H GLY 8 64.926 -6.225 -25.291 99 HA2 GLY 8 HA2 GLY 8 63.757 -5.728 -27.746 100 HA3 GLY 8 HA3 GLY 8 63.539 -4.248 -26.816 101 H SER 9 H SER 9 64.944 -3.634 -28.813 102 HA SER 9 HA SER 9 67.694 -4.290 -28.865 103 HB2 SER 9 HB2 SER 9 66.322 -1.774 -29.844 104 HB3 SER 9 HB3 SER 9 67.935 -2.315 -30.298 105 HG SER 9 HG SER 9 65.662 -3.884 -30.645 106 H GLY 10 H GLY 10 69.504 -2.947 -28.279 107 HA2 GLY 10 HA2 GLY 10 69.162 -0.712 -26.500 108 HA3 GLY 10 HA3 GLY 10 69.669 -2.174 -25.660 109 H MET 11 H MET 11 71.480 -0.450 -25.297 110 HA MET 11 HA MET 11 73.576 -0.921 -27.338 111 HB2 MET 11 HB2 MET 11 73.067 1.598 -25.738 112 HB3 MET 11 HB3 MET 11 74.485 1.320 -26.752 113 HG2 MET 11 HG2 MET 11 72.932 0.930 -28.694 114 HG3 MET 11 HG3 MET 11 71.595 1.429 -27.659 115 HE1 MET 11 HE1 MET 11 72.188 5.014 -26.788 116 HE2 MET 11 HE2 MET 11 73.220 3.896 -25.901 117 HE3 MET 11 HE3 MET 11 71.571 3.428 -26.308 118 H LYS 12 H LYS 12 75.755 -0.927 -26.500 119 HA LYS 12 HA LYS 12 75.964 -2.363 -24.029 120 HB2 LYS 12 HB2 LYS 12 77.447 -2.757 -25.996 121 HB3 LYS 12 HB3 LYS 12 78.178 -1.176 -25.715 122 HG2 LYS 12 HG2 LYS 12 78.909 -1.864 -23.490 123 HG3 LYS 12 HG3 LYS 12 78.099 -3.421 -23.680 124 HD2 LYS 12 HD2 LYS 12 80.444 -3.750 -24.166 125 HD3 LYS 12 HD3 LYS 12 79.559 -3.850 -25.688 126 HE2 LYS 12 HE2 LYS 12 80.196 -1.624 -26.310 127 HE3 LYS 12 HE3 LYS 12 80.827 -1.287 -24.698 128 HZ1 LYS 12 HZ1 LYS 12 81.907 -3.393 -26.486 129 HZ2 LYS 12 HZ2 LYS 12 82.572 -2.847 -25.021 130 HZ3 LYS 12 HZ3 LYS 12 82.550 -1.826 -26.380 131 H GLU 13 H GLU 13 76.647 -1.680 -22.054 132 HA GLU 13 HA GLU 13 76.767 1.219 -21.646 133 HB2 GLU 13 HB2 GLU 13 75.267 -0.186 -20.234 134 HB3 GLU 13 HB3 GLU 13 76.691 -1.007 -19.596 135 HG2 GLU 13 HG2 GLU 13 76.123 0.727 -18.032 136 HG3 GLU 13 HG3 GLU 13 77.569 1.252 -18.888 137 H THR 14 H THR 14 78.533 2.288 -20.894 138 HA THR 14 HA THR 14 81.012 0.712 -20.490 139 HB THR 14 HB THR 14 80.790 3.470 -21.718 140 HG1 THR 14 HG1 THR 14 81.060 0.943 -22.834 141 HG21 THR 14 HG21 THR 14 83.170 2.946 -22.362 142 HG22 THR 14 HG22 THR 14 83.077 1.526 -21.320 143 HG23 THR 14 HG23 THR 14 82.918 3.140 -20.628 144 H ALA 15 H ALA 15 82.350 1.318 -18.827 145 HA ALA 15 HA ALA 15 81.233 2.515 -16.559 146 HB1 ALA 15 HB1 ALA 15 83.372 1.016 -16.867 147 HB2 ALA 15 HB2 ALA 15 83.289 2.174 -15.540 148 HB3 ALA 15 HB3 ALA 15 84.195 2.570 -17.001 149 H ALA 16 H ALA 16 81.518 4.534 -15.590 150 HA ALA 16 HA ALA 16 82.732 6.659 -17.227 151 HB1 ALA 16 HB1 ALA 16 80.475 6.903 -17.866 152 HB2 ALA 16 HB2 ALA 16 80.688 8.083 -16.572 153 HB3 ALA 16 HB3 ALA 16 79.886 6.547 -16.242 154 H ALA 17 H ALA 17 83.147 8.627 -16.014 155 HA ALA 17 HA ALA 17 84.385 8.170 -13.548 156 HB1 ALA 17 HB1 ALA 17 83.451 10.699 -14.902 157 HB2 ALA 17 HB2 ALA 17 85.092 10.060 -14.796 158 HB3 ALA 17 HB3 ALA 17 84.307 10.719 -13.361 159 H LYS 18 H LYS 18 83.827 8.678 -11.427 160 HA LYS 18 HA LYS 18 80.990 8.456 -10.844 161 HB2 LYS 18 HB2 LYS 18 83.419 8.578 -9.042 162 HB3 LYS 18 HB3 LYS 18 81.767 8.316 -8.482 163 HG2 LYS 18 HG2 LYS 18 81.624 6.309 -9.957 164 HG3 LYS 18 HG3 LYS 18 83.319 6.542 -10.389 165 HD2 LYS 18 HD2 LYS 18 83.916 6.375 -7.969 166 HD3 LYS 18 HD3 LYS 18 82.228 6.007 -7.611 167 HE2 LYS 18 HE2 LYS 18 83.881 4.397 -9.570 168 HE3 LYS 18 HE3 LYS 18 83.740 3.981 -7.862 169 HZ1 LYS 18 HZ1 LYS 18 82.024 2.784 -8.735 170 HZ2 LYS 18 HZ2 LYS 18 81.705 3.906 -9.970 171 HZ3 LYS 18 HZ3 LYS 18 81.207 4.227 -8.379 172 H PHE 19 H PHE 19 79.843 9.908 -9.476 173 HA PHE 19 HA PHE 19 80.963 12.639 -9.306 174 HB2 PHE 19 HB2 PHE 19 78.830 13.562 -9.994 175 HB3 PHE 19 HB3 PHE 19 79.457 12.501 -11.240 176 HD1 PHE 19 HD2 PHE 19 78.442 10.248 -11.587 177 HD2 PHE 19 HD1 PHE 19 76.779 13.105 -8.844 178 HE1 PHE 19 HE2 PHE 19 76.314 8.974 -11.549 179 HE2 PHE 19 HE1 PHE 19 74.651 11.832 -8.806 180 HZ PHE 19 HZ PHE 19 74.419 9.766 -10.159 181 H GLU 20 H GLU 20 79.714 14.022 -7.778 182 HA GLU 20 HA GLU 20 79.629 12.879 -5.234 183 HB2 GLU 20 HB2 GLU 20 78.265 15.387 -6.240 184 HB3 GLU 20 HB3 GLU 20 78.495 14.972 -4.541 185 HG2 GLU 20 HG2 GLU 20 80.952 14.882 -4.927 186 HG3 GLU 20 HG3 GLU 20 80.689 15.389 -6.590 187 H ARG 21 H ARG 21 77.999 12.164 -3.903 188 HA ARG 21 HA ARG 21 75.353 11.713 -5.158 189 HB2 ARG 21 HB2 ARG 21 76.715 9.632 -5.006 190 HB3 ARG 21 HB3 ARG 21 76.822 9.862 -3.262 191 HG2 ARG 21 HG2 ARG 21 75.024 8.346 -3.559 192 HG3 ARG 21 HG3 ARG 21 74.245 9.901 -3.282 193 HD2 ARG 21 HD2 ARG 21 74.027 10.203 -5.740 194 HD3 ARG 21 HD3 ARG 21 74.749 8.615 -5.980 195 HE ARG 21 HE ARG 21 72.563 8.333 -4.238 196 HH11 ARG 21 HH11 ARG 21 73.142 9.140 -7.606 197 HH12 ARG 21 HH12 ARG 21 71.603 8.534 -8.118 198 HH21 ARG 21 HH21 ARG 21 70.596 7.569 -4.958 199 HH22 ARG 21 HH22 ARG 21 70.181 7.655 -6.639 200 H GLN 22 H GLN 22 73.573 12.074 -3.892 201 HA GLN 22 HA GLN 22 74.084 13.370 -1.288 202 HB2 GLN 22 HB2 GLN 22 71.711 13.533 -3.162 203 HB3 GLN 22 HB3 GLN 22 71.817 14.345 -1.600 204 HG2 GLN 22 HG2 GLN 22 73.782 15.594 -2.343 205 HG3 GLN 22 HG3 GLN 22 73.772 14.738 -3.883 206 HE21 GLN 22 HE21 GLN 22 73.560 17.591 -3.754 207 HE22 GLN 22 HE22 GLN 22 72.011 18.035 -4.288 208 H HIS 23 H HIS 23 72.897 12.803 0.533 209 HA HIS 23 HA HIS 23 71.397 10.250 0.362 210 HB2 HIS 23 HB2 HIS 23 73.192 11.226 2.587 211 HB3 HIS 23 HB3 HIS 23 72.234 9.758 2.624 212 HD1 HIS 23 HD1 HIS 23 72.882 8.004 0.577 213 HD2 HIS 23 HD2 HIS 23 75.743 10.843 1.641 214 HE1 HIS 23 HE1 HIS 23 75.092 7.166 -0.328 215 H MET 24 H MET 24 69.537 10.073 1.572 216 HA MET 24 HA MET 24 68.565 12.574 2.838 217 HB2 MET 24 HB2 MET 24 66.965 10.375 1.499 218 HB3 MET 24 HB3 MET 24 66.309 11.845 2.212 219 HG2 MET 24 HG2 MET 24 68.213 11.706 -0.145 220 HG3 MET 24 HG3 MET 24 66.495 12.082 -0.226 221 HE1 MET 24 HE1 MET 24 66.082 15.426 1.474 222 HE2 MET 24 HE2 MET 24 66.155 13.973 2.468 223 HE3 MET 24 HE3 MET 24 65.370 13.916 0.892 224 H ASP 25 H ASP 25 67.485 12.432 4.789 225 HA ASP 25 HA ASP 25 68.143 10.111 6.402 226 HB2 ASP 25 HB2 ASP 25 68.373 12.432 7.271 227 HB3 ASP 25 HB3 ASP 25 66.623 12.616 7.162 228 H SER 26 H SER 26 66.849 8.410 6.613 229 HA SER 26 HA SER 26 64.276 8.236 5.480 230 HB2 SER 26 HB2 SER 26 65.674 6.522 7.542 231 HB3 SER 26 HB3 SER 26 64.109 6.117 6.845 232 HG SER 26 HG SER 26 66.342 5.535 5.832 233 HA PRO 27 HA PRO 27 61.885 9.955 8.792 234 HB2 PRO 27 HB2 PRO 27 59.406 9.052 8.223 235 HB3 PRO 27 HB3 PRO 27 60.246 10.202 7.165 236 HG2 PRO 27 HG2 PRO 27 59.798 7.299 6.815 237 HG3 PRO 27 HG3 PRO 27 59.877 8.588 5.604 238 HD2 PRO 27 HD2 PRO 27 61.958 6.811 6.241 239 HD3 PRO 27 HD3 PRO 27 62.121 8.318 5.315 240 H ASP 28 H ASP 28 59.923 9.176 10.326 241 HA ASP 28 HA ASP 28 61.027 7.213 12.062 242 HB2 ASP 28 HB2 ASP 28 58.273 8.470 12.002 243 HB3 ASP 28 HB3 ASP 28 58.901 7.486 13.322 244 H LEU 29 H LEU 29 60.295 5.136 12.562 245 HA LEU 29 HA LEU 29 59.081 3.722 10.329 246 HB2 LEU 29 HB2 LEU 29 60.191 2.740 12.969 247 HB3 LEU 29 HB3 LEU 29 59.586 1.697 11.682 248 HG LEU 29 HG LEU 29 61.273 3.067 10.186 249 HD11 LEU 29 HD11 LEU 29 62.124 4.699 11.625 250 HD12 LEU 29 HD12 LEU 29 63.359 3.446 11.740 251 HD13 LEU 29 HD13 LEU 29 62.146 3.608 13.010 252 HD21 LEU 29 HD21 LEU 29 63.008 1.380 10.676 253 HD22 LEU 29 HD22 LEU 29 61.407 0.640 10.657 254 HD23 LEU 29 HD23 LEU 29 62.201 0.985 12.193 255 H GLY 30 H GLY 30 57.144 2.619 10.375 256 HA2 GLY 30 HA2 GLY 30 55.452 2.908 12.771 257 HA3 GLY 30 HA3 GLY 30 54.857 3.499 11.222 258 H THR 31 H THR 31 53.205 2.101 10.849 259 HA THR 31 HA THR 31 53.432 -0.729 11.321 260 HB THR 31 HB THR 31 51.199 -0.862 10.346 261 HG1 THR 31 HG1 THR 31 50.339 1.067 9.521 262 HG21 THR 31 HG21 THR 31 50.029 0.611 11.893 263 HG22 THR 31 HG22 THR 31 51.464 1.620 12.063 264 HG23 THR 31 HG23 THR 31 51.470 -0.031 12.682 265 H ASP 32 H ASP 32 52.935 -2.306 9.541 266 HA ASP 32 HA ASP 32 54.952 -2.203 7.582 267 HB2 ASP 32 HB2 ASP 32 52.456 -3.909 7.708 268 HB3 ASP 32 HB3 ASP 32 53.808 -4.187 6.615 269 H ASP 33 H ASP 33 54.941 -1.732 5.418 270 HA ASP 33 HA ASP 33 52.476 -0.856 4.130 271 HB2 ASP 33 HB2 ASP 33 53.432 1.326 3.490 272 HB3 ASP 33 HB3 ASP 33 53.222 1.182 5.229 273 H ASP 34 H ASP 34 53.369 0.226 1.859 274 HA ASP 34 HA ASP 34 54.243 -1.943 0.327 275 HB2 ASP 34 HB2 ASP 34 54.419 1.019 -0.268 276 HB3 ASP 34 HB3 ASP 34 54.649 -0.260 -1.457 277 H ASP 35 H ASP 35 56.240 -2.306 -0.783 278 HA ASP 35 HA ASP 35 58.485 -2.287 0.871 279 HB2 ASP 35 HB2 ASP 35 59.756 -2.922 -1.152 280 HB3 ASP 35 HB3 ASP 35 58.270 -3.845 -0.977 281 H LYS 36 H LYS 36 60.500 -1.176 0.684 282 HA LYS 36 HA LYS 36 60.368 1.475 -0.600 283 HB2 LYS 36 HB2 LYS 36 61.339 2.494 1.427 284 HB3 LYS 36 HB3 LYS 36 59.752 1.795 1.746 285 HG2 LYS 36 HG2 LYS 36 60.950 -0.301 2.531 286 HG3 LYS 36 HG3 LYS 36 62.453 0.619 2.444 287 HD2 LYS 36 HD2 LYS 36 60.035 1.464 4.063 288 HD3 LYS 36 HD3 LYS 36 61.432 0.620 4.732 289 HE2 LYS 36 HE2 LYS 36 62.887 2.477 3.876 290 HE3 LYS 36 HE3 LYS 36 61.424 3.344 3.403 291 HZ1 LYS 36 HZ1 LYS 36 61.902 2.373 6.162 292 HZ2 LYS 36 HZ2 LYS 36 60.719 3.471 5.633 293 HZ3 LYS 36 HZ3 LYS 36 62.358 3.923 5.641 294 H THR 37 H THR 37 62.633 2.560 -0.333 295 HA THR 37 HA THR 37 64.521 0.810 -1.608 296 HB THR 37 HB THR 37 65.966 2.774 -1.708 297 HG1 THR 37 HG1 THR 37 65.747 4.118 -0.156 298 HG21 THR 37 HG21 THR 37 64.488 4.262 -2.960 299 HG22 THR 37 HG22 THR 37 63.073 3.529 -2.204 300 HG23 THR 37 HG23 THR 37 64.072 2.584 -3.307 301 H GLY 38 H GLY 38 66.818 0.695 -0.838 302 HA2 GLY 38 HA2 GLY 38 66.837 -0.368 1.843 303 HA3 GLY 38 HA3 GLY 38 68.189 -0.350 0.715 304 H GLY 39 H GLY 39 69.185 0.181 2.945 305 HA2 GLY 39 HA2 GLY 39 68.839 2.897 3.880 306 HA3 GLY 39 HA3 GLY 39 69.987 1.714 4.499 307 H GLY 40 H GLY 40 71.235 3.879 4.442 308 HA2 GLY 40 HA2 GLY 40 72.226 4.697 1.846 309 HA3 GLY 40 HA3 GLY 40 72.724 5.339 3.409 310 H ARG 41 H ARG 41 74.823 5.133 2.062 311 HA ARG 41 HA ARG 41 76.022 2.654 1.545 312 HB2 ARG 41 HB2 ARG 41 77.285 5.302 2.286 313 HB3 ARG 41 HB3 ARG 41 78.170 3.913 1.654 314 HG2 ARG 41 HG2 ARG 41 76.690 3.942 -0.361 315 HG3 ARG 41 HG3 ARG 41 75.941 5.417 0.253 316 HD2 ARG 41 HD2 ARG 41 78.869 5.056 -0.441 317 HD3 ARG 41 HD3 ARG 41 77.689 5.982 -1.364 318 HE ARG 41 HE ARG 41 77.715 6.969 1.267 319 HH11 ARG 41 HH11 ARG 41 79.859 6.863 -1.511 320 HH12 ARG 41 HH12 ARG 41 80.676 8.323 -1.061 321 HH21 ARG 41 HH21 ARG 41 78.804 8.842 1.795 322 HH22 ARG 41 HH22 ARG 41 80.085 9.428 0.787 323 H ALA 42 H ALA 42 77.518 1.412 2.702 324 HA ALA 42 HA ALA 42 76.946 0.929 5.395 325 HB1 ALA 42 HB1 ALA 42 79.466 0.258 3.856 326 HB2 ALA 42 HB2 ALA 42 78.009 -0.733 3.933 327 HB3 ALA 42 HB3 ALA 42 78.974 -0.470 5.385 328 H ASP 43 H ASP 43 78.220 1.253 7.292 329 HA ASP 43 HA ASP 43 79.025 3.880 7.748 330 HB2 ASP 43 HB2 ASP 43 79.898 1.397 9.245 331 HB3 ASP 43 HB3 ASP 43 79.973 3.052 9.850 332 HA PRO 44 HA PRO 44 83.109 4.346 6.232 333 HB2 PRO 44 HB2 PRO 44 84.180 5.147 8.882 334 HB3 PRO 44 HB3 PRO 44 84.134 6.054 7.358 335 HG2 PRO 44 HG2 PRO 44 82.541 6.662 9.403 336 HG3 PRO 44 HG3 PRO 44 82.009 6.821 7.718 337 HD2 PRO 44 HD2 PRO 44 81.316 4.696 9.714 338 HD3 PRO 44 HD3 PRO 44 80.303 5.434 8.452 339 H ALA 45 H ALA 45 84.903 3.113 5.889 340 HA ALA 45 HA ALA 45 85.157 0.644 7.341 341 HB1 ALA 45 HB1 ALA 45 86.880 0.106 5.728 342 HB2 ALA 45 HB2 ALA 45 86.990 1.792 5.224 343 HB3 ALA 45 HB3 ALA 45 85.533 0.862 4.877 344 H HIS 46 H HIS 46 87.746 0.063 7.582 345 HA HIS 46 HA HIS 46 88.551 1.638 9.868 346 HB2 HIS 46 HB2 HIS 46 89.886 -0.698 8.495 347 HB3 HIS 46 HB3 HIS 46 90.406 0.012 10.011 348 HD1 HIS 46 HD1 HIS 46 88.384 -0.030 11.936 349 HD2 HIS 46 HD2 HIS 46 88.166 -2.808 8.835 350 HE1 HIS 46 HE1 HIS 46 86.833 -1.866 12.728 351 H ARG 47 H ARG 47 90.700 2.556 10.101 352 HA ARG 47 HA ARG 47 91.329 4.326 7.990 353 HB2 ARG 47 HB2 ARG 47 91.773 4.758 10.412 354 HB3 ARG 47 HB3 ARG 47 93.081 3.577 10.337 355 HG2 ARG 47 HG2 ARG 47 94.230 4.893 8.635 356 HG3 ARG 47 HG3 ARG 47 92.893 6.042 8.583 357 HD2 ARG 47 HD2 ARG 47 94.607 7.006 9.968 358 HD3 ARG 47 HD3 ARG 47 93.297 6.501 11.028 359 HE ARG 47 HE ARG 47 95.954 5.298 10.828 360 HH11 ARG 47 HH11 ARG 47 92.712 5.031 12.154 361 HH12 ARG 47 HH12 ARG 47 93.210 3.944 13.406 362 HH21 ARG 47 HH21 ARG 47 96.529 3.894 12.459 363 HH22 ARG 47 HH22 ARG 47 95.342 3.308 13.574 364 H SER 48 H SER 48 92.868 4.304 6.439 365 HA SER 48 HA SER 48 94.734 2.029 6.311 366 HB2 SER 48 HB2 SER 48 93.357 2.922 3.802 367 HB3 SER 48 HB3 SER 48 94.104 1.375 4.173 368 HG SER 48 HG SER 48 91.596 2.241 4.651 369 HA PRO 49 HA PRO 49 97.885 4.843 5.036 370 HB2 PRO 49 HB2 PRO 49 97.939 3.655 2.288 371 HB3 PRO 49 HB3 PRO 49 99.279 3.969 3.410 372 HG2 PRO 49 HG2 PRO 49 98.349 1.516 3.058 373 HG3 PRO 49 HG3 PRO 49 98.864 2.083 4.657 374 HD2 PRO 49 HD2 PRO 49 96.105 1.639 3.621 375 HD3 PRO 49 HD3 PRO 49 96.726 1.479 5.279 376 H VAL 50 H VAL 50 98.132 6.855 3.978 377 HA VAL 50 HA VAL 50 95.611 7.824 2.878 378 HB VAL 50 HB VAL 50 98.100 9.328 3.728 379 HG11 VAL 50 HG11 VAL 50 96.691 11.318 3.649 380 HG12 VAL 50 HG12 VAL 50 95.301 10.348 3.161 381 HG13 VAL 50 HG13 VAL 50 96.674 10.533 2.069 382 HG21 VAL 50 HG21 VAL 50 96.972 8.146 5.585 383 HG22 VAL 50 HG22 VAL 50 95.445 8.903 5.135 384 HG23 VAL 50 HG23 VAL 50 96.778 9.894 5.730 385 HA PRO 51 HA PRO 51 97.136 7.791 -1.359 386 HB2 PRO 51 HB2 PRO 51 95.864 10.480 -1.618 387 HB3 PRO 51 HB3 PRO 51 95.681 9.041 -2.642 388 HG2 PRO 51 HG2 PRO 51 93.776 9.780 -0.944 389 HG3 PRO 51 HG3 PRO 51 94.143 8.071 -1.245 390 HD2 PRO 51 HD2 PRO 51 94.796 9.737 1.140 391 HD3 PRO 51 HD3 PRO 51 94.444 8.000 1.038 392 H LEU 52 H LEU 52 98.629 9.025 -2.755 393 HA LEU 52 HA LEU 52 100.772 10.097 -1.255 394 HB2 LEU 52 HB2 LEU 52 100.225 10.263 -4.230 395 HB3 LEU 52 HB3 LEU 52 101.764 10.641 -3.459 396 HG LEU 52 HG LEU 52 100.378 7.955 -3.250 397 HD11 LEU 52 HD11 LEU 52 102.469 7.351 -4.723 398 HD12 LEU 52 HD12 LEU 52 102.417 9.058 -5.165 399 HD13 LEU 52 HD13 LEU 52 101.030 8.019 -5.494 400 HD21 LEU 52 HD21 LEU 52 101.825 8.223 -1.386 401 HD22 LEU 52 HD22 LEU 52 103.037 9.071 -2.346 402 HD23 LEU 52 HD23 LEU 52 102.794 7.339 -2.564 403 HA PRO 53 HA PRO 53 99.563 14.364 -1.088 404 HB2 PRO 53 HB2 PRO 53 101.950 15.655 -0.926 405 HB3 PRO 53 HB3 PRO 53 101.290 14.700 0.416 406 HG2 PRO 53 HG2 PRO 53 103.405 13.993 -1.543 407 HG3 PRO 53 HG3 PRO 53 103.292 13.618 0.186 408 HD2 PRO 53 HD2 PRO 53 102.679 11.820 -1.814 409 HD3 PRO 53 HD3 PRO 53 102.015 11.743 -0.168 410 H SER 54 H SER 54 99.490 16.329 -2.328 411 HA SER 54 HA SER 54 99.436 15.959 -5.085 412 HB2 SER 54 HB2 SER 54 99.584 18.504 -3.459 413 HB3 SER 54 HB3 SER 54 99.302 18.475 -5.196 414 HG SER 54 HG SER 54 97.361 17.788 -4.792 415 HA PRO 55 HA PRO 55 103.692 16.195 -5.984 416 HB2 PRO 55 HB2 PRO 55 103.717 16.512 -8.666 417 HB3 PRO 55 HB3 PRO 55 103.117 15.029 -7.896 418 HG2 PRO 55 HG2 PRO 55 101.609 17.273 -9.105 419 HG3 PRO 55 HG3 PRO 55 101.234 15.543 -9.072 420 HD2 PRO 55 HD2 PRO 55 100.107 17.471 -7.384 421 HD3 PRO 55 HD3 PRO 55 100.083 15.717 -7.111 422 H THR 56 H THR 56 104.961 17.838 -5.338 423 HA THR 56 HA THR 56 104.727 20.510 -6.432 424 HB THR 56 HB THR 56 106.741 20.995 -5.141 425 HG1 THR 56 HG1 THR 56 108.040 19.433 -4.775 426 HG21 THR 56 HG21 THR 56 105.885 20.598 -2.952 427 HG22 THR 56 HG22 THR 56 105.041 19.138 -3.469 428 HG23 THR 56 HG23 THR 56 104.473 20.720 -4.001 429 H SER 57 H SER 57 106.678 21.478 -7.610 430 HA SER 57 HA SER 57 106.850 20.170 -10.058 431 HB2 SER 57 HB2 SER 57 108.722 22.249 -8.907 432 HB3 SER 57 HB3 SER 57 108.646 21.784 -10.602 433 HG SER 57 HG SER 57 107.028 23.385 -9.205 434 H ASN 58 H ASN 58 107.902 18.454 -10.706 435 HA ASN 58 HA ASN 58 109.591 16.993 -11.154 436 HB2 ASN 58 HB2 ASN 58 111.273 19.108 -9.809 437 HB3 ASN 58 HB3 ASN 58 111.910 17.732 -10.708 438 HD21 ASN 58 HD21 ASN 58 112.288 20.545 -11.456 439 HD22 ASN 58 HD22 ASN 58 111.542 20.755 -12.966 440 H LYS 59 H LYS 59 108.337 17.221 -8.182 441 HA LYS 59 HA LYS 59 109.834 14.961 -7.217 442 HB2 LYS 59 HB2 LYS 59 110.733 15.945 -5.212 443 HB3 LYS 59 HB3 LYS 59 111.311 16.852 -6.606 444 HG2 LYS 59 HG2 LYS 59 109.489 18.526 -6.209 445 HG3 LYS 59 HG3 LYS 59 109.059 17.649 -4.739 446 HD2 LYS 59 HD2 LYS 59 111.482 17.944 -4.006 447 HD3 LYS 59 HD3 LYS 59 111.654 19.080 -5.344 448 HE2 LYS 59 HE2 LYS 59 109.422 19.372 -3.338 449 HE3 LYS 59 HE3 LYS 59 111.022 20.045 -3.025 450 HZ1 LYS 59 HZ1 LYS 59 109.012 21.188 -4.512 451 HZ2 LYS 59 HZ2 LYS 59 110.148 20.656 -5.658 452 HZ3 LYS 59 HZ3 LYS 59 110.624 21.710 -4.412 453 H GLN 60 H GLN 60 109.068 14.095 -5.188 454 HA GLN 60 HA GLN 60 106.557 15.176 -4.127 455 HB2 GLN 60 HB2 GLN 60 106.902 12.323 -5.069 456 HB3 GLN 60 HB3 GLN 60 105.616 12.842 -3.983 457 HG2 GLN 60 HG2 GLN 60 104.899 14.503 -5.711 458 HG3 GLN 60 HG3 GLN 60 106.113 13.827 -6.798 459 HE21 GLN 60 HE21 GLN 60 102.945 13.219 -5.319 460 HE22 GLN 60 HE22 GLN 60 102.634 11.801 -6.195 461 H ASP 61 H ASP 61 106.163 14.598 -1.953 462 HA ASP 61 HA ASP 61 108.461 13.475 -0.515 463 HB2 ASP 61 HB2 ASP 61 105.875 14.698 0.488 464 HB3 ASP 61 HB3 ASP 61 107.198 14.145 1.512 465 H ILE 62 H ILE 62 108.513 11.364 0.060 466 HA ILE 62 HA ILE 62 105.949 9.871 0.089 467 HB ILE 62 HB ILE 62 107.318 9.523 -1.987 468 HG12 ILE 62 HG12 ILE 62 107.288 6.939 -1.673 469 HG13 ILE 62 HG13 ILE 62 106.598 7.305 -0.093 470 HG21 ILE 62 HG21 ILE 62 109.567 9.623 -1.085 471 HG22 ILE 62 HG22 ILE 62 109.302 8.025 -1.782 472 HG23 ILE 62 HG23 ILE 62 109.245 8.245 -0.033 473 HD11 ILE 62 HD11 ILE 62 105.451 7.789 -2.817 474 HD12 ILE 62 HD12 ILE 62 105.012 8.891 -1.514 475 HD13 ILE 62 HD13 ILE 62 104.660 7.172 -1.369 476 H SER 63 H SER 63 105.791 8.142 1.594 477 HA SER 63 HA SER 63 107.942 7.899 3.552 478 HB2 SER 63 HB2 SER 63 106.641 8.632 5.431 479 HB3 SER 63 HB3 SER 63 106.599 9.907 4.217 480 HG SER 63 HG SER 63 104.596 8.500 5.227 481 H GLU 64 H GLU 64 107.505 6.311 5.220 482 HA GLU 64 HA GLU 64 106.613 3.874 4.237 483 HB2 GLU 64 HB2 GLU 64 106.751 3.090 6.568 484 HB3 GLU 64 HB3 GLU 64 108.143 4.081 6.133 485 HG2 GLU 64 HG2 GLU 64 107.032 6.046 7.171 486 HG3 GLU 64 HG3 GLU 64 105.716 5.001 7.690 487 H ALA 65 H ALA 65 104.828 6.371 5.990 488 HA ALA 65 HA ALA 65 102.657 4.819 6.854 489 HB1 ALA 65 HB1 ALA 65 101.423 7.127 6.589 490 HB2 ALA 65 HB2 ALA 65 103.050 7.729 6.271 491 HB3 ALA 65 HB3 ALA 65 102.689 6.933 7.803 492 H ASN 66 H ASN 66 103.163 6.570 3.802 493 HA ASN 66 HA ASN 66 100.527 6.105 2.819 494 HB2 ASN 66 HB2 ASN 66 102.993 6.674 1.166 495 HB3 ASN 66 HB3 ASN 66 101.311 6.968 0.730 496 HD21 ASN 66 HD21 ASN 66 100.178 8.737 1.879 497 HD22 ASN 66 HD22 ASN 66 101.065 9.977 2.622 498 H LEU 67 H LEU 67 103.661 4.538 2.201 499 HA LEU 67 HA LEU 67 102.579 2.717 0.281 500 HB2 LEU 67 HB2 LEU 67 105.218 2.977 1.680 501 HB3 LEU 67 HB3 LEU 67 104.856 1.533 0.733 502 HG LEU 67 HG LEU 67 104.176 3.118 -1.154 503 HD11 LEU 67 HD11 LEU 67 105.553 5.346 -0.867 504 HD12 LEU 67 HD12 LEU 67 105.319 5.030 0.852 505 HD13 LEU 67 HD13 LEU 67 103.922 5.220 -0.209 506 HD21 LEU 67 HD21 LEU 67 106.518 1.896 -0.680 507 HD22 LEU 67 HD22 LEU 67 107.078 3.565 -0.580 508 HD23 LEU 67 HD23 LEU 67 106.296 2.984 -2.047 509 H ALA 68 H ALA 68 102.849 2.583 3.754 510 HA ALA 68 HA ALA 68 102.109 1.044 5.269 511 HB1 ALA 68 HB1 ALA 68 100.289 -0.222 4.727 512 HB2 ALA 68 HB2 ALA 68 101.031 -0.856 3.259 513 HB3 ALA 68 HB3 ALA 68 100.319 0.758 3.260 514 H TYR 69 H TYR 69 102.102 -1.972 4.552 515 HA TYR 69 HA TYR 69 104.676 -2.527 5.487 516 HB2 TYR 69 HB2 TYR 69 102.803 -4.278 3.900 517 HB3 TYR 69 HB3 TYR 69 104.228 -4.848 4.749 518 HD1 TYR 69 HD1 TYR 69 104.322 -4.667 7.262 519 HD2 TYR 69 HD2 TYR 69 100.745 -3.877 5.019 520 HE1 TYR 69 HE1 TYR 69 102.973 -4.921 9.327 521 HE2 TYR 69 HE2 TYR 69 99.395 -4.130 7.084 522 HH TYR 69 HH TYR 69 99.554 -5.046 9.260 523 H LEU 70 H LEU 70 103.669 -1.748 2.280 524 HA LEU 70 HA LEU 70 105.573 -3.133 0.740 525 HB2 LEU 70 HB2 LEU 70 104.328 -0.429 0.208 526 HB3 LEU 70 HB3 LEU 70 105.122 -1.454 -0.987 527 HG LEU 70 HG LEU 70 102.691 -2.274 0.631 528 HD11 LEU 70 HD11 LEU 70 102.850 -1.531 -2.303 529 HD12 LEU 70 HD12 LEU 70 102.312 -0.416 -1.047 530 HD13 LEU 70 HD13 LEU 70 101.399 -1.890 -1.368 531 HD21 LEU 70 HD21 LEU 70 104.279 -3.553 -1.606 532 HD22 LEU 70 HD22 LEU 70 102.629 -4.046 -1.226 533 HD23 LEU 70 HD23 LEU 70 103.904 -4.226 -0.020 534 H TRP 71 H TRP 71 105.990 -0.390 2.829 535 HA TRP 71 HA TRP 71 108.048 1.002 1.596 536 HB2 TRP 71 HB2 TRP 71 106.757 1.552 3.720 537 HB3 TRP 71 HB3 TRP 71 107.893 0.512 4.556 538 HD1 TRP 71 HD1 TRP 71 109.831 1.760 5.580 539 HE1 TRP 71 HE1 TRP 71 111.063 3.971 5.113 540 HE3 TRP 71 HE3 TRP 71 107.376 3.272 1.371 541 HZ2 TRP 71 HZ2 TRP 71 111.040 6.098 3.186 542 HZ3 TRP 71 HZ3 TRP 71 107.999 5.383 0.240 543 HH2 TRP 71 HH2 TRP 71 109.824 6.797 1.139 544 HA PRO 72 HA PRO 72 111.004 -2.430 2.165 545 HB2 PRO 72 HB2 PRO 72 112.715 -1.904 0.180 546 HB3 PRO 72 HB3 PRO 72 111.061 -2.451 -0.160 547 HG2 PRO 72 HG2 PRO 72 112.228 0.261 -0.374 548 HG3 PRO 72 HG3 PRO 72 110.991 -0.523 -1.371 549 HD2 PRO 72 HD2 PRO 72 110.522 1.296 0.738 550 HD3 PRO 72 HD3 PRO 72 109.308 0.284 -0.072 551 H LEU 73 H LEU 73 111.682 0.917 2.592 552 HA LEU 73 HA LEU 73 114.523 0.488 3.179 553 HB2 LEU 73 HB2 LEU 73 112.910 3.046 3.237 554 HB3 LEU 73 HB3 LEU 73 114.663 2.908 3.336 555 HG LEU 73 HG LEU 73 112.984 2.010 0.977 556 HD11 LEU 73 HD11 LEU 73 113.818 3.985 -0.148 557 HD12 LEU 73 HD12 LEU 73 114.854 4.381 1.225 558 HD13 LEU 73 HD13 LEU 73 113.100 4.494 1.385 559 HD21 LEU 73 HD21 LEU 73 115.979 2.156 1.458 560 HD22 LEU 73 HD22 LEU 73 115.249 1.891 -0.125 561 HD23 LEU 73 HD23 LEU 73 115.027 0.703 1.155 562 H THR 74 H THR 74 115.457 0.781 5.141 563 HA THR 74 HA THR 74 113.915 0.468 7.516 564 HB THR 74 HB THR 74 116.054 0.710 8.683 565 HG1 THR 74 HG1 THR 74 117.809 1.348 7.545 566 HG21 THR 74 HG21 THR 74 116.313 -0.876 6.112 567 HG22 THR 74 HG22 THR 74 115.522 -1.440 7.584 568 HG23 THR 74 HG23 THR 74 117.258 -1.128 7.580 569 H VAL 75 H VAL 75 115.484 3.248 5.937 570 HA VAL 75 HA VAL 75 114.919 5.124 7.995 571 HB VAL 75 HB VAL 75 115.097 6.843 6.178 572 HG11 VAL 75 HG11 VAL 75 117.497 6.187 5.575 573 HG12 VAL 75 HG12 VAL 75 117.205 4.697 6.471 574 HG13 VAL 75 HG13 VAL 75 117.116 6.254 7.294 575 HG21 VAL 75 HG21 VAL 75 115.734 6.123 3.930 576 HG22 VAL 75 HG22 VAL 75 114.169 5.427 4.338 577 HG23 VAL 75 HG23 VAL 75 115.623 4.432 4.408 578 H ASP 76 H ASP 76 113.055 6.217 8.484 579 HA ASP 76 HA ASP 76 110.710 4.791 7.798 580 HB2 ASP 76 HB2 ASP 76 109.533 6.387 9.225 581 HB3 ASP 76 HB3 ASP 76 111.031 5.869 9.992 582 H HIS 77 H HIS 77 112.052 7.801 6.523 583 HA HIS 77 HA HIS 77 110.118 7.571 4.370 584 HB2 HIS 77 HB2 HIS 77 109.234 9.767 4.498 585 HB3 HIS 77 HB3 HIS 77 108.998 9.007 6.056 586 HD1 HIS 77 HD1 HIS 77 110.621 9.851 8.012 587 HD2 HIS 77 HD2 HIS 77 110.658 12.149 4.536 588 HE1 HIS 77 HE1 HIS 77 111.648 12.077 8.639 589 H GLY 78 H GLY 78 110.548 9.428 2.740 590 HA2 GLY 78 HA2 GLY 78 113.110 10.672 2.703 591 HA3 GLY 78 HA3 GLY 78 113.072 9.242 1.676 592 H THR 79 H THR 79 113.446 11.808 0.643 593 HA THR 79 HA THR 79 110.874 12.399 -0.696 594 HB THR 79 HB THR 79 113.316 14.165 -0.793 595 HG1 THR 79 HG1 THR 79 112.917 14.724 1.169 596 HG21 THR 79 HG21 THR 79 111.310 15.839 -0.867 597 HG22 THR 79 HG22 THR 79 110.341 14.406 -1.222 598 HG23 THR 79 HG23 THR 79 111.653 14.876 -2.306 599 H ILE 80 H ILE 80 110.729 12.284 -2.910 600 HA ILE 80 HA ILE 80 113.067 11.106 -4.299 601 HB ILE 80 HB ILE 80 111.408 10.162 -5.876 602 HG12 ILE 80 HG12 ILE 80 109.360 11.250 -3.914 603 HG13 ILE 80 HG13 ILE 80 109.657 11.914 -5.519 604 HG21 ILE 80 HG21 ILE 80 110.507 8.480 -4.316 605 HG22 ILE 80 HG22 ILE 80 110.859 9.545 -2.955 606 HG23 ILE 80 HG23 ILE 80 112.178 8.871 -3.913 607 HD11 ILE 80 HD11 ILE 80 108.462 9.258 -4.777 608 HD12 ILE 80 HD12 ILE 80 109.230 9.483 -6.349 609 HD13 ILE 80 HD13 ILE 80 107.846 10.481 -5.894 610 H GLU 81 H GLU 81 113.830 12.046 -6.144 611 HA GLU 81 HA GLU 81 112.372 14.335 -7.256 612 HB2 GLU 81 HB2 GLU 81 113.829 15.200 -5.427 613 HB3 GLU 81 HB3 GLU 81 115.228 14.568 -6.293 614 HG2 GLU 81 HG2 GLU 81 114.597 15.955 -8.262 615 HG3 GLU 81 HG3 GLU 81 113.267 16.632 -7.333 616 H CYS 82 H CYS 82 112.753 14.748 -9.350 617 HA CYS 82 HA CYS 82 114.756 13.092 -10.758 618 HB2 CYS 82 HB2 CYS 82 112.117 14.277 -11.560 619 HB3 CYS 82 HB3 CYS 82 113.339 13.957 -12.791 620 H LEU 83 H LEU 83 116.536 14.103 -11.450 621 HA LEU 83 HA LEU 83 116.735 16.989 -11.213 622 HB2 LEU 83 HB2 LEU 83 118.675 14.772 -11.817 623 HB3 LEU 83 HB3 LEU 83 119.126 16.460 -12.064 624 HG LEU 83 HG LEU 83 117.942 15.483 -9.461 625 HD11 LEU 83 HD11 LEU 83 120.087 14.270 -10.083 626 HD12 LEU 83 HD12 LEU 83 120.164 15.204 -8.589 627 HD13 LEU 83 HD13 LEU 83 120.889 15.841 -10.065 628 HD21 LEU 83 HD21 LEU 83 119.305 17.967 -10.471 629 HD22 LEU 83 HD22 LEU 83 119.400 17.556 -8.759 630 HD23 LEU 83 HD23 LEU 83 117.829 17.821 -9.517 631 HA PRO 84 HA PRO 84 116.098 18.229 -15.418 632 HB2 PRO 84 HB2 PRO 84 118.851 19.375 -15.468 633 HB3 PRO 84 HB3 PRO 84 117.301 20.137 -15.873 634 HG2 PRO 84 HG2 PRO 84 118.554 20.679 -13.596 635 HG3 PRO 84 HG3 PRO 84 116.786 20.576 -13.683 636 HD2 PRO 84 HD2 PRO 84 118.722 18.632 -12.513 637 HD3 PRO 84 HD3 PRO 84 117.052 18.996 -12.027 638 H SER 85 H SER 85 118.935 16.404 -14.579 639 HA SER 85 HA SER 85 119.763 15.851 -17.289 640 HB2 SER 85 HB2 SER 85 121.485 14.534 -16.316 641 HB3 SER 85 HB3 SER 85 121.283 15.936 -15.271 642 HG SER 85 HG SER 85 120.269 14.659 -13.848 643 H ASP 86 H ASP 86 117.087 14.786 -15.747 644 HA ASP 86 HA ASP 86 115.683 13.011 -15.941 645 HB2 ASP 86 HB2 ASP 86 117.482 12.181 -18.235 646 HB3 ASP 86 HB3 ASP 86 115.883 11.540 -17.885 647 H ASN 87 H ASN 87 117.781 12.911 -14.073 648 HA ASN 87 HA ASN 87 118.268 9.991 -13.916 649 HB2 ASN 87 HB2 ASN 87 119.736 12.294 -12.606 650 HB3 ASN 87 HB3 ASN 87 120.044 10.592 -12.273 651 HD21 ASN 87 HD21 ASN 87 122.033 12.378 -13.401 652 HD22 ASN 87 HD22 ASN 87 122.385 11.823 -14.967 653 H ALA 88 H ALA 88 117.200 8.918 -12.366 654 HA ALA 88 HA ALA 88 115.539 10.462 -10.507 655 HB1 ALA 88 HB1 ALA 88 114.721 7.986 -10.042 656 HB2 ALA 88 HB2 ALA 88 115.485 7.680 -11.600 657 HB3 ALA 88 HB3 ALA 88 114.181 8.860 -11.475 658 H VAL 89 H VAL 89 116.136 10.740 -8.450 659 HA VAL 89 HA VAL 89 117.874 8.704 -7.192 660 HB VAL 89 HB VAL 89 119.112 10.518 -6.054 661 HG11 VAL 89 HG11 VAL 89 119.195 10.959 -9.042 662 HG12 VAL 89 HG12 VAL 89 119.784 9.471 -8.301 663 HG13 VAL 89 HG13 VAL 89 120.531 11.014 -7.892 664 HG21 VAL 89 HG21 VAL 89 117.511 12.291 -7.928 665 HG22 VAL 89 HG22 VAL 89 118.879 12.829 -6.952 666 HG23 VAL 89 HG23 VAL 89 117.401 12.271 -6.167 667 H PHE 90 H PHE 90 117.805 8.669 -4.912 668 HA PHE 90 HA PHE 90 115.254 9.605 -3.745 669 HB2 PHE 90 HB2 PHE 90 115.408 7.178 -3.967 670 HB3 PHE 90 HB3 PHE 90 116.957 7.181 -3.154 671 HD1 PHE 90 HD1 PHE 90 113.331 7.920 -2.666 672 HD2 PHE 90 HD2 PHE 90 117.089 6.970 -0.819 673 HE1 PHE 90 HE1 PHE 90 112.178 7.581 -0.485 674 HE2 PHE 90 HE2 PHE 90 115.940 6.616 1.349 675 HZ PHE 90 HZ PHE 90 113.482 6.924 1.513 676 H VAL 91 H VAL 91 115.450 11.034 -2.102 677 HA VAL 91 HA VAL 91 118.074 11.339 -0.782 678 HB VAL 91 HB VAL 91 115.723 13.250 -0.923 679 HG11 VAL 91 HG11 VAL 91 117.062 14.847 0.184 680 HG12 VAL 91 HG12 VAL 91 118.537 13.908 -0.044 681 HG13 VAL 91 HG13 VAL 91 117.324 13.377 1.117 682 HG21 VAL 91 HG21 VAL 91 118.422 13.428 -2.286 683 HG22 VAL 91 HG22 VAL 91 117.042 14.506 -2.506 684 HG23 VAL 91 HG23 VAL 91 116.961 12.840 -3.081 685 H ALA 92 H ALA 92 118.259 10.804 1.325 686 HA ALA 92 HA ALA 92 115.794 10.015 2.757 687 HB1 ALA 92 HB1 ALA 92 118.719 9.373 3.137 688 HB2 ALA 92 HB2 ALA 92 117.385 8.264 2.821 689 HB3 ALA 92 HB3 ALA 92 117.529 9.043 4.396 690 HA PRO 93 HA PRO 93 115.700 13.455 5.530 691 HB2 PRO 93 HB2 PRO 93 115.983 11.568 7.824 692 HB3 PRO 93 HB3 PRO 93 114.765 12.824 7.538 693 HG2 PRO 93 HG2 PRO 93 114.261 10.209 7.208 694 HG3 PRO 93 HG3 PRO 93 113.476 11.472 6.249 695 HD2 PRO 93 HD2 PRO 93 115.518 9.511 5.414 696 HD3 PRO 93 HD3 PRO 93 114.354 10.426 4.435 697 H ASP 94 H ASP 94 118.214 11.054 5.902 698 HA ASP 94 HA ASP 94 119.827 12.428 7.777 699 HB2 ASP 94 HB2 ASP 94 121.639 10.927 6.933 700 HB3 ASP 94 HB3 ASP 94 120.174 10.092 7.429 701 H GLY 95 H GLY 95 119.193 13.205 4.508 702 HA2 GLY 95 HA2 GLY 95 119.985 15.135 3.407 703 HA3 GLY 95 HA3 GLY 95 121.338 15.195 4.531 704 H THR 96 H THR 96 120.916 12.063 3.305 705 HA THR 96 HA THR 96 123.221 12.395 1.512 706 HB THR 96 HB THR 96 121.962 9.879 2.638 707 HG1 THR 96 HG1 THR 96 123.124 10.299 4.296 708 HG21 THR 96 HG21 THR 96 124.325 10.459 0.891 709 HG22 THR 96 HG22 THR 96 123.163 9.134 0.803 710 HG23 THR 96 HG23 THR 96 124.425 9.120 2.034 711 H THR 97 H THR 97 123.066 11.924 -0.646 712 HA THR 97 HA THR 97 120.368 11.273 -1.663 713 HB THR 97 HB THR 97 122.761 12.378 -3.164 714 HG1 THR 97 HG1 THR 97 120.488 13.705 -2.269 715 HG21 THR 97 HG21 THR 97 119.827 12.282 -3.915 716 HG22 THR 97 HG22 THR 97 121.027 11.118 -4.481 717 HG23 THR 97 HG23 THR 97 121.167 12.818 -4.930 718 H TYR 98 H TYR 98 119.993 9.420 -2.641 719 HA TYR 98 HA TYR 98 122.248 7.619 -3.282 720 HB2 TYR 98 HB2 TYR 98 119.430 6.925 -2.444 721 HB3 TYR 98 HB3 TYR 98 120.697 5.774 -2.815 722 HD1 TYR 98 HD2 TYR 98 122.549 5.396 -1.229 723 HD2 TYR 98 HD1 TYR 98 119.357 8.131 -0.343 724 HE1 TYR 98 HE2 TYR 98 123.213 5.402 1.161 725 HE2 TYR 98 HE1 TYR 98 120.031 8.148 2.041 726 HH TYR 98 HH TYR 98 121.597 7.446 3.509 727 H ALA 99 H ALA 99 121.993 6.339 -5.198 728 HA ALA 99 HA ALA 99 120.372 7.643 -7.243 729 HB1 ALA 99 HB1 ALA 99 121.610 5.895 -8.710 730 HB2 ALA 99 HB2 ALA 99 122.596 5.616 -7.275 731 HB3 ALA 99 HB3 ALA 99 122.550 7.215 -8.015 732 H LEU 100 H LEU 100 118.502 6.854 -8.019 733 HA LEU 100 HA LEU 100 117.514 4.306 -6.992 734 HB2 LEU 100 HB2 LEU 100 116.250 6.544 -8.574 735 HB3 LEU 100 HB3 LEU 100 115.434 5.009 -8.304 736 HG LEU 100 HG LEU 100 116.583 6.556 -5.989 737 HD11 LEU 100 HD11 LEU 100 114.313 7.560 -5.716 738 HD12 LEU 100 HD12 LEU 100 113.857 6.886 -7.279 739 HD13 LEU 100 HD13 LEU 100 115.116 8.116 -7.184 740 HD21 LEU 100 HD21 LEU 100 114.918 5.290 -4.750 741 HD22 LEU 100 HD22 LEU 100 115.820 4.164 -5.762 742 HD23 LEU 100 HD23 LEU 100 114.206 4.686 -6.245 743 H ASN 101 H ASN 101 118.008 5.902 -10.135 744 HA ASN 101 HA ASN 101 117.730 3.262 -11.443 745 HB2 ASN 101 HB2 ASN 101 117.175 4.407 -13.459 746 HB3 ASN 101 HB3 ASN 101 116.207 5.091 -12.161 747 HD21 ASN 101 HD21 ASN 101 116.312 6.772 -14.210 748 HD22 ASN 101 HD22 ASN 101 117.454 8.010 -13.997 749 H ASP 102 H ASP 102 119.024 3.029 -13.506 750 HA ASP 102 HA ASP 102 121.662 2.621 -12.716 751 HB2 ASP 102 HB2 ASP 102 120.485 2.779 -15.495 752 HB3 ASP 102 HB3 ASP 102 122.096 2.168 -15.129 753 H ARG 103 H ARG 103 120.281 5.327 -14.568 754 HA ARG 103 HA ARG 103 122.760 6.383 -15.426 755 HB2 ARG 103 HB2 ARG 103 120.046 7.664 -15.088 756 HB3 ARG 103 HB3 ARG 103 121.431 8.480 -15.823 757 HG2 ARG 103 HG2 ARG 103 121.636 6.600 -17.449 758 HG3 ARG 103 HG3 ARG 103 120.177 5.885 -16.764 759 HD2 ARG 103 HD2 ARG 103 120.367 8.611 -18.074 760 HD3 ARG 103 HD3 ARG 103 119.647 7.173 -18.791 761 HE ARG 103 HE ARG 103 118.420 8.923 -16.888 762 HH11 ARG 103 HH11 ARG 103 118.527 5.552 -17.863 763 HH12 ARG 103 HH12 ARG 103 116.932 5.233 -17.270 764 HH21 ARG 103 HH21 ARG 103 116.402 8.466 -16.158 765 HH22 ARG 103 HH22 ARG 103 115.732 6.873 -16.308 766 H ALA 104 H ALA 104 120.759 7.115 -12.571 767 HA ALA 104 HA ALA 104 122.360 9.148 -11.498 768 HB1 ALA 104 HB1 ALA 104 120.198 8.727 -10.552 769 HB2 ALA 104 HB2 ALA 104 121.388 8.407 -9.291 770 HB3 ALA 104 HB3 ALA 104 120.632 7.066 -10.151 771 H GLU 105 H GLU 105 122.631 5.615 -11.209 772 HA GLU 105 HA GLU 105 124.816 5.571 -9.424 773 HB2 GLU 105 HB2 GLU 105 124.085 3.617 -11.618 774 HB3 GLU 105 HB3 GLU 105 125.261 3.309 -10.341 775 HG2 GLU 105 HG2 GLU 105 123.488 3.707 -8.645 776 HG3 GLU 105 HG3 GLU 105 122.321 3.921 -9.943 777 H LYS 106 H LYS 106 124.693 5.749 -12.968 778 HA LYS 106 HA LYS 106 127.442 5.676 -13.496 779 HB2 LYS 106 HB2 LYS 106 125.642 5.580 -15.216 780 HB3 LYS 106 HB3 LYS 106 125.360 7.304 -14.970 781 HG2 LYS 106 HG2 LYS 106 127.734 7.751 -15.568 782 HG3 LYS 106 HG3 LYS 106 127.950 6.031 -15.900 783 HD2 LYS 106 HD2 LYS 106 126.095 6.180 -17.580 784 HD3 LYS 106 HD3 LYS 106 126.059 7.924 -17.323 785 HE2 LYS 106 HE2 LYS 106 128.463 8.037 -17.971 786 HE3 LYS 106 HE3 LYS 106 128.422 6.309 -18.322 787 HZ1 LYS 106 HZ1 LYS 106 126.905 8.469 -19.667 788 HZ2 LYS 106 HZ2 LYS 106 126.538 6.823 -19.869 789 HZ3 LYS 106 HZ3 LYS 106 128.053 7.424 -20.350 790 H ALA 107 H ALA 107 125.397 8.325 -12.421 791 HA ALA 107 HA ALA 107 127.351 10.390 -12.738 792 HB1 ALA 107 HB1 ALA 107 125.045 10.501 -10.814 793 HB2 ALA 107 HB2 ALA 107 124.796 10.617 -12.557 794 HB3 ALA 107 HB3 ALA 107 125.789 11.815 -11.726 795 H GLY 108 H GLY 108 127.569 7.830 -10.718 796 HA2 GLY 108 HA2 GLY 108 128.977 7.416 -8.979 797 HA3 GLY 108 HA3 GLY 108 129.490 9.091 -9.038 798 H HIS 109 H HIS 109 126.074 8.420 -8.608 799 HA HIS 109 HA HIS 109 126.191 9.338 -5.861 800 HB2 HIS 109 HB2 HIS 109 124.034 8.686 -7.816 801 HB3 HIS 109 HB3 HIS 109 123.635 8.662 -6.109 802 HD1 HIS 109 HD1 HIS 109 124.571 11.032 -4.853 803 HD2 HIS 109 HD2 HIS 109 123.618 11.158 -8.909 804 HE1 HIS 109 HE1 HIS 109 124.190 13.468 -5.422 805 HA PRO 110 HA PRO 110 126.552 5.200 -4.304 806 HB2 PRO 110 HB2 PRO 110 125.650 5.450 -1.747 807 HB3 PRO 110 HB3 PRO 110 127.208 6.110 -2.284 808 HG2 PRO 110 HG2 PRO 110 124.617 7.499 -1.852 809 HG3 PRO 110 HG3 PRO 110 126.265 8.042 -1.494 810 HD2 PRO 110 HD2 PRO 110 124.850 8.862 -3.705 811 HD3 PRO 110 HD3 PRO 110 126.623 8.813 -3.631 812 HA PRO 111 HA PRO 111 122.453 3.456 -4.763 813 HB2 PRO 111 HB2 PRO 111 122.848 0.892 -3.894 814 HB3 PRO 111 HB3 PRO 111 123.399 1.492 -5.468 815 HG2 PRO 111 HG2 PRO 111 124.945 0.978 -3.002 816 HG3 PRO 111 HG3 PRO 111 125.430 0.845 -4.697 817 HD2 PRO 111 HD2 PRO 111 126.095 2.953 -3.009 818 HD3 PRO 111 HD3 PRO 111 126.149 3.004 -4.782 819 H ILE 112 H ILE 112 120.569 2.878 -3.598 820 HA ILE 112 HA ILE 112 120.400 3.853 -0.960 821 HB ILE 112 HB ILE 112 118.437 2.115 -2.482 822 HG12 ILE 112 HG12 ILE 112 118.493 5.106 -2.021 823 HG13 ILE 112 HG13 ILE 112 119.080 4.339 -3.496 824 HG21 ILE 112 HG21 ILE 112 116.767 3.124 -0.877 825 HG22 ILE 112 HG22 ILE 112 118.119 3.786 0.036 826 HG23 ILE 112 HG23 ILE 112 117.915 2.042 -0.098 827 HD11 ILE 112 HD11 ILE 112 116.849 3.427 -3.936 828 HD12 ILE 112 HD12 ILE 112 116.739 5.174 -3.712 829 HD13 ILE 112 HD13 ILE 112 116.252 4.090 -2.412 830 H THR 113 H THR 113 121.639 0.836 -1.956 831 HA THR 113 HA THR 113 120.413 -0.983 -0.338 832 HB THR 113 HB THR 113 121.908 -1.824 -1.926 833 HG1 THR 113 HG1 THR 113 122.037 -3.230 -0.380 834 HG21 THR 113 HG21 THR 113 124.209 -1.365 -2.084 835 HG22 THR 113 HG22 THR 113 124.282 -0.711 -0.447 836 HG23 THR 113 HG23 THR 113 123.491 0.204 -1.727 837 HA PRO 114 HA PRO 114 123.444 -0.128 3.362 838 HB2 PRO 114 HB2 PRO 114 123.157 2.825 3.545 839 HB3 PRO 114 HB3 PRO 114 124.573 1.804 3.868 840 HG2 PRO 114 HG2 PRO 114 124.462 3.294 1.689 841 HG3 PRO 114 HG3 PRO 114 125.143 1.654 1.635 842 HD2 PRO 114 HD2 PRO 114 122.431 2.592 0.758 843 HD3 PRO 114 HD3 PRO 114 123.537 1.468 -0.053 844 H ILE 115 H ILE 115 120.676 1.914 2.550 845 HA ILE 115 HA ILE 115 119.526 1.476 5.216 846 HB ILE 115 HB ILE 115 117.759 3.096 4.430 847 HG12 ILE 115 HG12 ILE 115 119.762 3.718 2.244 848 HG13 ILE 115 HG13 ILE 115 118.304 2.768 1.968 849 HG21 ILE 115 HG21 ILE 115 119.246 4.056 5.896 850 HG22 ILE 115 HG22 ILE 115 119.560 5.042 4.470 851 HG23 ILE 115 HG23 ILE 115 120.649 3.716 4.882 852 HD11 ILE 115 HD11 ILE 115 118.329 5.416 1.609 853 HD12 ILE 115 HD12 ILE 115 117.997 5.408 3.342 854 HD13 ILE 115 HD13 ILE 115 116.903 4.584 2.230 855 H ARG 116 H ARG 116 119.530 -0.345 2.547 856 HA ARG 116 HA ARG 116 116.719 -0.775 2.121 857 HB2 ARG 116 HB2 ARG 116 118.450 -1.167 0.386 858 HB3 ARG 116 HB3 ARG 116 119.097 -2.488 1.357 859 HG2 ARG 116 HG2 ARG 116 116.906 -3.641 1.226 860 HG3 ARG 116 HG3 ARG 116 116.294 -2.334 0.208 861 HD2 ARG 116 HD2 ARG 116 118.119 -2.795 -1.423 862 HD3 ARG 116 HD3 ARG 116 118.627 -4.159 -0.434 863 HE ARG 116 HE ARG 116 116.069 -4.785 -0.863 864 HH11 ARG 116 HH11 ARG 116 118.472 -3.625 -3.148 865 HH12 ARG 116 HH12 ARG 116 117.747 -4.455 -4.483 866 HH21 ARG 116 HH21 ARG 116 115.185 -5.834 -2.623 867 HH22 ARG 116 HH22 ARG 116 115.912 -5.689 -4.189 868 H ALA 117 H ALA 117 115.432 -2.427 2.917 869 HA ALA 117 HA ALA 117 116.368 -3.657 5.389 870 HB1 ALA 117 HB1 ALA 117 113.630 -3.852 4.133 871 HB2 ALA 117 HB2 ALA 117 114.128 -2.497 5.148 872 HB3 ALA 117 HB3 ALA 117 114.064 -4.127 5.820 873 H LYS 118 H LYS 118 116.685 -5.786 5.719 874 HA LYS 118 HA LYS 118 116.340 -7.609 3.427 875 HB2 LYS 118 HB2 LYS 118 117.980 -9.034 4.480 876 HB3 LYS 118 HB3 LYS 118 118.619 -7.396 4.407 877 HG2 LYS 118 HG2 LYS 118 117.884 -7.057 6.778 878 HG3 LYS 118 HG3 LYS 118 117.397 -8.752 6.830 879 HD2 LYS 118 HD2 LYS 118 119.777 -9.326 6.120 880 HD3 LYS 118 HD3 LYS 118 120.184 -7.640 6.446 881 HE2 LYS 118 HE2 LYS 118 119.329 -7.909 8.766 882 HE3 LYS 118 HE3 LYS 118 119.018 -9.613 8.432 883 HZ1 LYS 118 HZ1 LYS 118 121.317 -10.001 8.084 884 HZ2 LYS 118 HZ2 LYS 118 121.180 -9.140 9.543 885 HZ3 LYS 118 HZ3 LYS 118 121.682 -8.345 8.128 886 H GLY 119 H GLY 119 115.166 -9.506 3.617 887 HA2 GLY 119 HA2 GLY 119 113.270 -9.527 5.868 888 HA3 GLY 119 HA3 GLY 119 113.009 -10.287 4.312 889 H SER 120 H SER 120 112.793 -11.475 6.982 890 HA SER 120 HA SER 120 114.982 -13.077 7.676 891 HB2 SER 120 HB2 SER 120 112.915 -12.763 9.053 892 HB3 SER 120 HB3 SER 120 112.057 -13.813 7.931 893 HG SER 120 HG SER 120 113.468 -14.547 9.942 894 H GLY 121 H GLY 121 112.338 -13.660 5.385 895 HA2 GLY 121 HA2 GLY 121 113.690 -16.126 4.481 896 HA3 GLY 121 HA3 GLY 121 112.006 -15.712 4.172 897 H GLY 122 H GLY 122 113.443 -16.492 2.039 898 HA2 GLY 122 HA2 GLY 122 113.978 -15.873 -0.111 899 HA3 GLY 122 HA3 GLY 122 113.145 -14.360 0.229 900 H GLY 123 H GLY 123 114.372 -12.626 -0.058 901 HA2 GLY 123 HA2 GLY 123 117.191 -12.692 0.795 902 HA3 GLY 123 HA3 GLY 123 116.800 -12.170 -0.842 903 H TYR 124 H TYR 124 116.739 -10.039 -1.073 904 HA TYR 124 HA TYR 124 116.130 -8.359 1.275 905 HB2 TYR 124 HB2 TYR 124 117.680 -7.897 -1.254 906 HB3 TYR 124 HB3 TYR 124 117.100 -6.552 -0.289 907 HD1 TYR 124 HD1 TYR 124 118.555 -9.881 0.640 908 HD2 TYR 124 HD2 TYR 124 118.904 -5.605 0.842 909 HE1 TYR 124 HE1 TYR 124 120.539 -10.113 2.109 910 HE2 TYR 124 HE2 TYR 124 120.885 -5.836 2.315 911 HH TYR 124 HH TYR 124 122.632 -7.694 2.734 912 H ILE 125 H ILE 125 114.767 -6.509 1.018 913 HA ILE 125 HA ILE 125 112.407 -7.217 -0.485 914 HB ILE 125 HB ILE 125 113.005 -4.880 1.351 915 HG12 ILE 125 HG12 ILE 125 111.308 -7.317 1.909 916 HG13 ILE 125 HG13 ILE 125 113.034 -7.315 2.246 917 HG21 ILE 125 HG21 ILE 125 110.304 -5.919 0.453 918 HG22 ILE 125 HG22 ILE 125 111.099 -4.541 -0.308 919 HG23 ILE 125 HG23 ILE 125 110.641 -4.464 1.392 920 HD11 ILE 125 HD11 ILE 125 111.274 -6.577 4.091 921 HD12 ILE 125 HD12 ILE 125 111.414 -5.021 3.272 922 HD13 ILE 125 HD13 ILE 125 112.845 -5.792 3.962 923 H SER 126 H SER 126 111.754 -6.413 -2.364 924 HA SER 126 HA SER 126 113.580 -5.090 -4.054 925 HB2 SER 126 HB2 SER 126 110.600 -5.472 -4.383 926 HB3 SER 126 HB3 SER 126 111.728 -5.024 -5.660 927 HG SER 126 HG SER 126 112.487 -7.007 -5.614 928 H LEU 127 H LEU 127 113.864 -3.060 -4.669 929 HA LEU 127 HA LEU 127 112.267 -0.932 -3.440 930 HB2 LEU 127 HB2 LEU 127 114.696 -0.727 -5.231 931 HB3 LEU 127 HB3 LEU 127 113.958 0.583 -4.314 932 HG LEU 127 HG LEU 127 115.188 -1.912 -3.104 933 HD11 LEU 127 HD11 LEU 127 116.188 0.951 -3.121 934 HD12 LEU 127 HD12 LEU 127 116.832 -0.339 -4.137 935 HD13 LEU 127 HD13 LEU 127 116.992 -0.435 -2.383 936 HD21 LEU 127 HD21 LEU 127 115.003 -0.404 -1.011 937 HD22 LEU 127 HD22 LEU 127 113.519 -1.148 -1.605 938 HD23 LEU 127 HD23 LEU 127 113.858 0.546 -1.958 939 H GLY 128 H GLY 128 111.682 -2.794 -6.030 940 HA2 GLY 128 HA2 GLY 128 111.650 -1.293 -8.324 941 HA3 GLY 128 HA3 GLY 128 110.447 -2.520 -7.958 942 H ALA 129 H ALA 129 109.116 -1.285 -5.802 943 HA ALA 129 HA ALA 129 107.243 0.264 -7.214 944 HB1 ALA 129 HB1 ALA 129 107.526 0.558 -4.248 945 HB2 ALA 129 HB2 ALA 129 107.080 -1.013 -4.915 946 HB3 ALA 129 HB3 ALA 129 106.065 0.396 -5.223 947 H LEU 130 H LEU 130 109.794 1.261 -4.941 948 HA LEU 130 HA LEU 130 109.207 4.010 -4.936 949 HB2 LEU 130 HB2 LEU 130 110.724 2.872 -3.330 950 HB3 LEU 130 HB3 LEU 130 111.911 2.684 -4.619 951 HG LEU 130 HG LEU 130 111.862 5.190 -4.915 952 HD11 LEU 130 HD11 LEU 130 110.053 4.887 -2.526 953 HD12 LEU 130 HD12 LEU 130 109.831 5.888 -3.961 954 HD13 LEU 130 HD13 LEU 130 111.013 6.351 -2.738 955 HD21 LEU 130 HD21 LEU 130 112.593 4.545 -2.070 956 HD22 LEU 130 HD22 LEU 130 113.472 5.514 -3.250 957 HD23 LEU 130 HD23 LEU 130 113.459 3.758 -3.391 958 H LEU 131 H LEU 131 111.307 2.073 -7.038 959 HA LEU 131 HA LEU 131 112.471 4.196 -8.467 960 HB2 LEU 131 HB2 LEU 131 113.266 1.842 -8.549 961 HB3 LEU 131 HB3 LEU 131 111.827 1.409 -9.469 962 HG LEU 131 HG LEU 131 112.521 3.154 -11.178 963 HD11 LEU 131 HD11 LEU 131 114.890 3.206 -9.321 964 HD12 LEU 131 HD12 LEU 131 114.034 4.558 -10.061 965 HD13 LEU 131 HD13 LEU 131 115.099 3.548 -11.039 966 HD21 LEU 131 HD21 LEU 131 114.180 1.685 -12.218 967 HD22 LEU 131 HD22 LEU 131 112.923 0.710 -11.458 968 HD23 LEU 131 HD23 LEU 131 114.489 0.900 -10.669 969 H SER 132 H SER 132 109.486 2.362 -9.048 970 HA SER 132 HA SER 132 108.879 3.433 -11.569 971 HB2 SER 132 HB2 SER 132 106.921 2.557 -9.432 972 HB3 SER 132 HB3 SER 132 106.597 2.692 -11.158 973 HG SER 132 HG SER 132 107.189 0.644 -10.901 974 H THR 133 H THR 133 108.043 4.570 -8.310 975 HA THR 133 HA THR 133 106.311 6.646 -9.100 976 HB THR 133 HB THR 133 108.121 6.606 -6.674 977 HG1 THR 133 HG1 THR 133 106.582 5.403 -5.789 978 HG21 THR 133 HG21 THR 133 107.012 8.773 -7.172 979 HG22 THR 133 HG22 THR 133 106.395 8.038 -5.691 980 HG23 THR 133 HG23 THR 133 105.451 7.951 -7.178 981 H THR 134 H THR 134 109.812 6.678 -8.444 982 HA THR 134 HA THR 134 110.148 9.453 -8.858 983 HB THR 134 HB THR 134 112.245 7.333 -9.349 984 HG1 THR 134 HG1 THR 134 111.137 7.222 -7.311 985 HG21 THR 134 HG21 THR 134 112.852 9.614 -10.033 986 HG22 THR 134 HG22 THR 134 113.752 9.153 -8.589 987 HG23 THR 134 HG23 THR 134 112.362 10.233 -8.455 988 H LEU 135 H LEU 135 110.343 6.706 -11.097 989 HA LEU 135 HA LEU 135 111.314 8.109 -13.329 990 HB2 LEU 135 HB2 LEU 135 109.533 5.671 -13.162 991 HB3 LEU 135 HB3 LEU 135 110.261 6.261 -14.656 992 HG LEU 135 HG LEU 135 111.875 5.583 -12.186 993 HD11 LEU 135 HD11 LEU 135 110.659 3.591 -13.111 994 HD12 LEU 135 HD12 LEU 135 112.413 3.466 -13.261 995 HD13 LEU 135 HD13 LEU 135 111.436 3.893 -14.666 996 HD21 LEU 135 HD21 LEU 135 112.483 6.306 -15.050 997 HD22 LEU 135 HD22 LEU 135 113.641 5.387 -14.089 998 HD23 LEU 135 HD23 LEU 135 113.150 7.000 -13.572 999 H ASN 136 H ASN 136 108.007 7.629 -12.142 1000 HA ASN 136 HA ASN 136 106.625 8.721 -14.323 1001 HB2 ASN 136 HB2 ASN 136 105.949 8.807 -11.374 1002 HB3 ASN 136 HB3 ASN 136 104.828 9.208 -12.673 1003 HD21 ASN 136 HD21 ASN 136 104.464 6.996 -10.792 1004 HD22 ASN 136 HD22 ASN 136 104.489 5.564 -11.703 1005 H LEU 137 H LEU 137 107.981 10.279 -11.439 1006 HA LEU 137 HA LEU 137 107.205 12.920 -12.081 1007 HB2 LEU 137 HB2 LEU 137 109.619 11.983 -10.509 1008 HB3 LEU 137 HB3 LEU 137 108.956 13.617 -10.498 1009 HG LEU 137 HG LEU 137 107.409 11.140 -9.681 1010 HD11 LEU 137 HD11 LEU 137 109.033 13.148 -8.139 1011 HD12 LEU 137 HD12 LEU 137 108.968 11.395 -7.952 1012 HD13 LEU 137 HD13 LEU 137 107.627 12.392 -7.389 1013 HD21 LEU 137 HD21 LEU 137 106.827 14.112 -9.618 1014 HD22 LEU 137 HD22 LEU 137 105.903 12.937 -8.682 1015 HD23 LEU 137 HD23 LEU 137 105.905 12.853 -10.440 1016 H CYS 138 H CYS 138 110.092 11.059 -12.943 1017 HA CYS 138 HA CYS 138 111.537 13.093 -14.212 1018 HB2 CYS 138 HB2 CYS 138 111.443 10.118 -14.463 1019 HB3 CYS 138 HB3 CYS 138 112.339 11.035 -15.668 1020 H GLY 139 H GLY 139 108.682 11.380 -15.303 1021 HA2 GLY 139 HA2 GLY 139 107.293 12.303 -17.016 1022 HA3 GLY 139 HA3 GLY 139 108.723 13.005 -17.757 1023 H LYS 140 H LYS 140 110.030 10.195 -17.265 1024 HA LYS 140 HA LYS 140 109.113 9.101 -19.830 1025 HB2 LYS 140 HB2 LYS 140 111.546 8.485 -18.138 1026 HB3 LYS 140 HB3 LYS 140 111.178 7.723 -19.687 1027 HG2 LYS 140 HG2 LYS 140 111.157 9.979 -20.751 1028 HG3 LYS 140 HG3 LYS 140 111.646 10.680 -19.208 1029 HD2 LYS 140 HD2 LYS 140 113.672 9.218 -19.234 1030 HD3 LYS 140 HD3 LYS 140 113.207 8.661 -20.842 1031 HE2 LYS 140 HE2 LYS 140 114.863 10.501 -20.963 1032 HE3 LYS 140 HE3 LYS 140 113.326 10.960 -21.696 1033 HZ1 LYS 140 HZ1 LYS 140 112.731 12.190 -19.786 1034 HZ2 LYS 140 HZ2 LYS 140 114.326 12.640 -20.162 1035 HZ3 LYS 140 HZ3 LYS 140 114.023 11.568 -18.880 1036 H GLY 141 H GLY 141 108.397 6.993 -20.074 1037 HA2 GLY 141 HA2 GLY 141 107.412 5.729 -17.605 1038 HA3 GLY 141 HA3 GLY 141 106.807 5.426 -19.232 Start of MODEL 7 1 H1 HIS -5 HT1 HIS -5 57.393 15.556 -18.224 2 H2 HIS -5 HT2 HIS -5 56.777 14.892 -19.660 3 H3 HIS -5 HT3 HIS -5 58.228 15.775 -19.684 4 HA HIS -5 HA HIS -5 59.435 14.111 -18.644 5 HB2 HIS -5 HB2 HIS -5 56.745 12.925 -17.927 6 HB3 HIS -5 HB3 HIS -5 58.288 12.162 -17.596 7 HD1 HIS -5 HD1 HIS -5 56.021 14.903 -16.450 8 HD2 HIS -5 HD2 HIS -5 59.759 13.353 -15.445 9 HE1 HIS -5 HE1 HIS -5 56.638 15.916 -14.215 10 H HIS -4 H HIS -4 60.083 12.095 -19.589 11 HA HIS -4 HA HIS -4 58.634 11.422 -22.089 12 HB2 HIS -4 HB2 HIS -4 61.600 11.385 -21.518 13 HB3 HIS -4 HB3 HIS -4 60.858 10.772 -22.983 14 HD1 HIS -4 HD1 HIS -4 61.797 13.931 -21.224 15 HD2 HIS -4 HD2 HIS -4 59.930 12.805 -24.777 16 HE1 HIS -4 HE1 HIS -4 61.667 16.015 -22.655 17 H HIS -3 H HIS -3 58.284 9.296 -22.544 18 HA HIS -3 HA HIS -3 59.219 7.306 -20.552 19 HB2 HIS -3 HB2 HIS -3 56.813 7.830 -20.317 20 HB3 HIS -3 HB3 HIS -3 56.565 7.375 -21.991 21 HD1 HIS -3 HD1 HIS -3 58.010 5.762 -18.843 22 HD2 HIS -3 HD2 HIS -3 55.774 4.750 -22.212 23 HE1 HIS -3 HE1 HIS -3 57.397 3.320 -18.587 24 H HIS -2 H HIS -2 60.107 5.481 -21.336 25 HA HIS -2 HA HIS -2 60.023 5.033 -24.266 26 HB2 HIS -2 HB2 HIS -2 62.340 4.590 -22.377 27 HB3 HIS -2 HB3 HIS -2 62.321 4.169 -24.079 28 HD1 HIS -2 HD1 HIS -2 61.862 6.365 -25.716 29 HD2 HIS -2 HD2 HIS -2 63.344 7.100 -21.890 30 HE1 HIS -2 HE1 HIS -2 62.843 8.697 -25.764 31 H HIS -1 H HIS -1 59.936 2.904 -24.967 32 HA HIS -1 HA HIS -1 59.228 0.917 -22.886 33 HB2 HIS -1 HB2 HIS -1 58.379 1.078 -25.779 34 HB3 HIS -1 HB3 HIS -1 57.940 -0.203 -24.665 35 HD1 HIS -1 HD1 HIS -1 56.547 0.708 -22.461 36 HD2 HIS -1 HD2 HIS -1 56.583 3.162 -25.830 37 HE1 HIS -1 HE1 HIS -1 54.622 2.328 -22.186 38 H HIS 0 H HIS 0 60.234 -1.033 -22.866 39 HA HIS 0 HA HIS 0 62.369 -1.480 -24.875 40 HB2 HIS 0 HB2 HIS 0 62.277 -2.244 -21.955 41 HB3 HIS 0 HB3 HIS 0 63.531 -2.737 -23.077 42 HD1 HIS 0 HD1 HIS 0 62.292 0.179 -21.095 43 HD2 HIS 0 HD2 HIS 0 65.363 -0.652 -23.789 44 HE1 HIS 0 HE1 HIS 0 63.900 2.130 -20.971 45 H SER 1 H SER 1 62.524 -3.465 -25.813 46 HA SER 1 HA SER 1 60.445 -5.457 -25.101 47 HB2 SER 1 HB2 SER 1 60.100 -4.373 -27.315 48 HB3 SER 1 HB3 SER 1 61.688 -4.944 -27.814 49 HG SER 1 HG SER 1 60.836 -7.049 -27.285 50 H SER 2 H SER 2 61.036 -7.595 -24.975 51 HA SER 2 HA SER 2 63.753 -8.160 -24.328 52 HB2 SER 2 HB2 SER 2 63.010 -10.390 -23.901 53 HB3 SER 2 HB3 SER 2 61.702 -9.325 -23.398 54 HG SER 2 HG SER 2 61.161 -11.138 -24.803 55 H GLY 3 H GLY 3 65.049 -9.871 -25.362 56 HA2 GLY 3 HA2 GLY 3 64.573 -10.764 -28.006 57 HA3 GLY 3 HA3 GLY 3 65.594 -9.331 -28.049 58 H LEU 4 H LEU 4 67.015 -11.103 -29.048 59 HA LEU 4 HA LEU 4 68.297 -12.863 -27.111 60 HB2 LEU 4 HB2 LEU 4 68.961 -12.374 -30.025 61 HB3 LEU 4 HB3 LEU 4 69.593 -13.673 -29.016 62 HG LEU 4 HG LEU 4 66.660 -13.265 -29.672 63 HD11 LEU 4 HD11 LEU 4 67.786 -13.970 -31.674 64 HD12 LEU 4 HD12 LEU 4 67.034 -15.409 -30.986 65 HD13 LEU 4 HD13 LEU 4 68.764 -15.137 -30.784 66 HD21 LEU 4 HD21 LEU 4 66.757 -14.409 -27.605 67 HD22 LEU 4 HD22 LEU 4 68.207 -15.299 -28.065 68 HD23 LEU 4 HD23 LEU 4 66.653 -15.710 -28.790 69 H VAL 5 H VAL 5 70.398 -12.669 -26.375 70 HA VAL 5 HA VAL 5 71.386 -10.047 -26.022 71 HB VAL 5 HB VAL 5 73.362 -11.156 -25.019 72 HG11 VAL 5 HG11 VAL 5 71.583 -10.910 -23.499 73 HG12 VAL 5 HG12 VAL 5 71.958 -12.630 -23.397 74 HG13 VAL 5 HG13 VAL 5 70.576 -12.084 -24.346 75 HG21 VAL 5 HG21 VAL 5 73.523 -13.581 -25.002 76 HG22 VAL 5 HG22 VAL 5 73.418 -13.047 -26.679 77 HG23 VAL 5 HG23 VAL 5 72.002 -13.728 -25.879 78 HA PRO 6 HA PRO 6 73.880 -9.824 -29.706 79 HB2 PRO 6 HB2 PRO 6 75.330 -7.611 -29.215 80 HB3 PRO 6 HB3 PRO 6 73.568 -7.535 -29.419 81 HG2 PRO 6 HG2 PRO 6 75.190 -7.337 -26.960 82 HG3 PRO 6 HG3 PRO 6 73.632 -6.594 -27.355 83 HD2 PRO 6 HD2 PRO 6 74.043 -8.928 -25.792 84 HD3 PRO 6 HD3 PRO 6 72.489 -8.297 -26.378 85 H ARG 7 H ARG 7 76.317 -9.340 -30.324 86 HA ARG 7 HA ARG 7 78.108 -10.783 -28.453 87 HB2 ARG 7 HB2 ARG 7 78.131 -10.926 -31.479 88 HB3 ARG 7 HB3 ARG 7 79.218 -11.780 -30.385 89 HG2 ARG 7 HG2 ARG 7 76.207 -12.123 -30.392 90 HG3 ARG 7 HG3 ARG 7 77.327 -13.199 -31.227 91 HD2 ARG 7 HD2 ARG 7 78.469 -13.620 -29.037 92 HD3 ARG 7 HD3 ARG 7 77.219 -12.665 -28.246 93 HE ARG 7 HE ARG 7 75.734 -14.463 -29.554 94 HH11 ARG 7 HH11 ARG 7 78.608 -14.944 -27.596 95 HH12 ARG 7 HH12 ARG 7 78.133 -16.539 -27.114 96 HH21 ARG 7 HH21 ARG 7 75.177 -16.521 -28.901 97 HH22 ARG 7 HH22 ARG 7 76.215 -17.420 -27.845 98 H GLY 8 H GLY 8 80.210 -10.030 -28.289 99 HA2 GLY 8 HA2 GLY 8 81.437 -8.137 -29.958 100 HA3 GLY 8 HA3 GLY 8 80.624 -7.265 -28.662 101 H SER 9 H SER 9 83.022 -6.699 -28.366 102 HA SER 9 HA SER 9 84.341 -8.708 -26.631 103 HB2 SER 9 HB2 SER 9 85.625 -8.043 -28.657 104 HB3 SER 9 HB3 SER 9 85.585 -6.373 -28.101 105 HG SER 9 HG SER 9 86.786 -8.570 -26.882 106 H GLY 10 H GLY 10 85.013 -8.117 -24.603 107 HA2 GLY 10 HA2 GLY 10 83.710 -5.783 -23.462 108 HA3 GLY 10 HA3 GLY 10 84.577 -7.036 -22.579 109 H MET 11 H MET 11 85.226 -4.820 -21.558 110 HA MET 11 HA MET 11 87.774 -3.971 -22.812 111 HB2 MET 11 HB2 MET 11 85.789 -2.262 -21.291 112 HB3 MET 11 HB3 MET 11 87.381 -1.728 -21.836 113 HG2 MET 11 HG2 MET 11 86.698 -2.323 -24.184 114 HG3 MET 11 HG3 MET 11 85.071 -2.633 -23.576 115 HE1 MET 11 HE1 MET 11 87.754 0.275 -22.625 116 HE2 MET 11 HE2 MET 11 87.328 1.299 -23.995 117 HE3 MET 11 HE3 MET 11 87.877 -0.352 -24.274 118 H LYS 12 H LYS 12 89.326 -3.070 -21.211 119 HA LYS 12 HA LYS 12 89.462 -4.835 -18.912 120 HB2 LYS 12 HB2 LYS 12 91.367 -2.681 -19.861 121 HB3 LYS 12 HB3 LYS 12 91.698 -3.862 -18.593 122 HG2 LYS 12 HG2 LYS 12 91.236 -5.676 -20.301 123 HG3 LYS 12 HG3 LYS 12 91.211 -4.411 -21.530 124 HD2 LYS 12 HD2 LYS 12 93.536 -4.938 -19.656 125 HD3 LYS 12 HD3 LYS 12 93.445 -5.507 -21.323 126 HE2 LYS 12 HE2 LYS 12 92.977 -2.971 -21.857 127 HE3 LYS 12 HE3 LYS 12 93.751 -2.703 -20.295 128 HZ1 LYS 12 HZ1 LYS 12 95.738 -3.523 -21.030 129 HZ2 LYS 12 HZ2 LYS 12 95.158 -2.822 -22.466 130 HZ3 LYS 12 HZ3 LYS 12 95.036 -4.499 -22.228 131 H GLU 13 H GLU 13 89.308 -4.264 -16.790 132 HA GLU 13 HA GLU 13 88.400 -1.500 -16.216 133 HB2 GLU 13 HB2 GLU 13 87.695 -4.088 -14.809 134 HB3 GLU 13 HB3 GLU 13 87.143 -2.481 -14.334 135 HG2 GLU 13 HG2 GLU 13 86.610 -3.787 -17.018 136 HG3 GLU 13 HG3 GLU 13 85.451 -3.675 -15.701 137 H THR 14 H THR 14 88.968 -0.637 -14.131 138 HA THR 14 HA THR 14 91.310 -1.898 -12.852 139 HB THR 14 HB THR 14 92.110 -0.152 -14.395 140 HG1 THR 14 HG1 THR 14 93.309 0.839 -12.848 141 HG21 THR 14 HG21 THR 14 89.911 1.204 -14.097 142 HG22 THR 14 HG22 THR 14 91.424 2.089 -14.292 143 HG23 THR 14 HG23 THR 14 90.715 1.897 -12.689 144 H ALA 15 H ALA 15 91.714 -1.132 -10.663 145 HA ALA 15 HA ALA 15 89.381 -1.121 -9.089 146 HB1 ALA 15 HB1 ALA 15 90.969 -0.436 -7.235 147 HB2 ALA 15 HB2 ALA 15 92.241 -0.383 -8.455 148 HB3 ALA 15 HB3 ALA 15 91.415 -1.901 -8.109 149 H ALA 16 H ALA 16 88.239 0.481 -8.081 150 HA ALA 16 HA ALA 16 88.236 3.069 -9.278 151 HB1 ALA 16 HB1 ALA 16 86.412 3.558 -7.823 152 HB2 ALA 16 HB2 ALA 16 86.893 2.299 -6.685 153 HB3 ALA 16 HB3 ALA 16 86.244 1.858 -8.264 154 H ALA 17 H ALA 17 88.899 5.038 -8.465 155 HA ALA 17 HA ALA 17 91.187 5.079 -6.799 156 HB1 ALA 17 HB1 ALA 17 90.521 6.799 -8.555 157 HB2 ALA 17 HB2 ALA 17 91.119 7.450 -7.029 158 HB3 ALA 17 HB3 ALA 17 89.387 7.439 -7.364 159 H LYS 18 H LYS 18 91.463 5.707 -4.667 160 HA LYS 18 HA LYS 18 89.117 5.340 -2.981 161 HB2 LYS 18 HB2 LYS 18 90.674 5.122 -1.151 162 HB3 LYS 18 HB3 LYS 18 91.245 4.147 -2.499 163 HG2 LYS 18 HG2 LYS 18 92.779 6.019 -3.141 164 HG3 LYS 18 HG3 LYS 18 92.270 6.884 -1.691 165 HD2 LYS 18 HD2 LYS 18 92.974 4.821 -0.368 166 HD3 LYS 18 HD3 LYS 18 93.744 4.248 -1.848 167 HE2 LYS 18 HE2 LYS 18 94.990 6.456 -1.933 168 HE3 LYS 18 HE3 LYS 18 94.373 6.780 -0.313 169 HZ1 LYS 18 HZ1 LYS 18 95.334 4.503 0.254 170 HZ2 LYS 18 HZ2 LYS 18 96.426 5.788 0.046 171 HZ3 LYS 18 HZ3 LYS 18 96.212 4.643 -1.192 172 H PHE 19 H PHE 19 88.109 6.872 -1.838 173 HA PHE 19 HA PHE 19 89.247 9.610 -1.857 174 HB2 PHE 19 HB2 PHE 19 86.354 8.767 -2.075 175 HB3 PHE 19 HB3 PHE 19 86.912 10.422 -1.918 176 HD1 PHE 19 HD2 PHE 19 88.195 11.490 -3.771 177 HD2 PHE 19 HD1 PHE 19 86.444 7.586 -4.158 178 HE1 PHE 19 HE2 PHE 19 88.428 11.630 -6.235 179 HE2 PHE 19 HE1 PHE 19 86.678 7.727 -6.623 180 HZ PHE 19 HZ PHE 19 87.670 9.749 -7.662 181 H GLU 20 H GLU 20 88.634 10.952 -0.049 182 HA GLU 20 HA GLU 20 88.757 9.564 2.445 183 HB2 GLU 20 HB2 GLU 20 89.743 11.829 2.020 184 HB3 GLU 20 HB3 GLU 20 88.104 12.482 1.970 185 HG2 GLU 20 HG2 GLU 20 87.711 11.584 4.259 186 HG3 GLU 20 HG3 GLU 20 89.381 11.037 4.309 187 H ARG 21 H ARG 21 87.189 9.197 3.958 188 HA ARG 21 HA ARG 21 84.398 9.844 3.189 189 HB2 ARG 21 HB2 ARG 21 85.461 7.326 4.492 190 HB3 ARG 21 HB3 ARG 21 83.755 7.693 4.240 191 HG2 ARG 21 HG2 ARG 21 84.154 7.846 1.802 192 HG3 ARG 21 HG3 ARG 21 85.849 7.434 2.063 193 HD2 ARG 21 HD2 ARG 21 84.710 5.403 1.455 194 HD3 ARG 21 HD3 ARG 21 85.076 5.307 3.174 195 HE ARG 21 HE ARG 21 82.811 5.215 3.563 196 HH11 ARG 21 HH11 ARG 21 83.276 6.757 0.443 197 HH12 ARG 21 HH12 ARG 21 81.576 6.861 0.130 198 HH21 ARG 21 HH21 ARG 21 80.635 5.377 3.104 199 HH22 ARG 21 HH22 ARG 21 80.100 6.090 1.619 200 H GLN 22 H GLN 22 82.935 10.215 4.894 201 HA GLN 22 HA GLN 22 84.225 11.071 7.413 202 HB2 GLN 22 HB2 GLN 22 81.621 11.931 6.128 203 HB3 GLN 22 HB3 GLN 22 82.207 12.496 7.693 204 HG2 GLN 22 HG2 GLN 22 84.208 13.430 6.646 205 HG3 GLN 22 HG3 GLN 22 83.709 12.800 5.079 206 HE21 GLN 22 HE21 GLN 22 84.150 15.600 5.500 207 HE22 GLN 22 HE22 GLN 22 82.659 16.399 5.361 208 H HIS 23 H HIS 23 83.110 10.672 9.407 209 HA HIS 23 HA HIS 23 81.571 8.155 9.333 210 HB2 HIS 23 HB2 HIS 23 83.667 8.144 10.622 211 HB3 HIS 23 HB3 HIS 23 83.069 9.469 11.603 212 HD1 HIS 23 HD1 HIS 23 81.390 8.907 13.461 213 HD2 HIS 23 HD2 HIS 23 82.436 5.603 11.144 214 HE1 HIS 23 HE1 HIS 23 80.491 6.873 14.669 215 H MET 24 H MET 24 79.517 8.086 9.980 216 HA MET 24 HA MET 24 78.397 10.405 11.442 217 HB2 MET 24 HB2 MET 24 77.157 8.885 9.136 218 HB3 MET 24 HB3 MET 24 76.309 10.078 10.122 219 HG2 MET 24 HG2 MET 24 78.023 11.772 9.489 220 HG3 MET 24 HG3 MET 24 78.775 10.579 8.431 221 HE1 MET 24 HE1 MET 24 77.679 13.469 7.244 222 HE2 MET 24 HE2 MET 24 77.323 12.684 5.707 223 HE3 MET 24 HE3 MET 24 78.715 12.164 6.654 224 H ASP 25 H ASP 25 76.303 9.857 12.519 225 HA ASP 25 HA ASP 25 76.604 7.624 14.216 226 HB2 ASP 25 HB2 ASP 25 74.157 9.306 13.625 227 HB3 ASP 25 HB3 ASP 25 74.291 8.158 14.955 228 H SER 26 H SER 26 75.497 5.658 14.317 229 HA SER 26 HA SER 26 75.087 4.322 11.892 230 HB2 SER 26 HB2 SER 26 73.777 3.473 14.470 231 HB3 SER 26 HB3 SER 26 74.419 2.465 13.178 232 HG SER 26 HG SER 26 75.723 2.872 15.159 233 HA PRO 27 HA PRO 27 70.908 5.528 11.027 234 HB2 PRO 27 HB2 PRO 27 70.223 3.753 9.116 235 HB3 PRO 27 HB3 PRO 27 71.486 4.970 8.847 236 HG2 PRO 27 HG2 PRO 27 71.738 2.072 9.352 237 HG3 PRO 27 HG3 PRO 27 72.772 3.154 8.407 238 HD2 PRO 27 HD2 PRO 27 73.256 2.256 11.049 239 HD3 PRO 27 HD3 PRO 27 74.141 3.529 10.182 240 H ASP 28 H ASP 28 68.624 4.578 10.759 241 HA ASP 28 HA ASP 28 67.927 3.125 13.101 242 HB2 ASP 28 HB2 ASP 28 66.306 3.776 10.630 243 HB3 ASP 28 HB3 ASP 28 65.641 3.125 12.126 244 H LEU 29 H LEU 29 66.994 1.038 13.276 245 HA LEU 29 HA LEU 29 68.226 -0.914 11.539 246 HB2 LEU 29 HB2 LEU 29 66.264 -1.318 13.811 247 HB3 LEU 29 HB3 LEU 29 67.249 -2.565 13.050 248 HG LEU 29 HG LEU 29 68.350 -0.140 14.501 249 HD11 LEU 29 HD11 LEU 29 68.177 -3.051 15.339 250 HD12 LEU 29 HD12 LEU 29 67.257 -1.721 16.040 251 HD13 LEU 29 HD13 LEU 29 69.008 -1.781 16.235 252 HD21 LEU 29 HD21 LEU 29 70.468 -1.583 14.373 253 HD22 LEU 29 HD22 LEU 29 69.937 -0.850 12.860 254 HD23 LEU 29 HD23 LEU 29 69.610 -2.554 13.177 255 H GLY 30 H GLY 30 67.197 -2.351 10.162 256 HA2 GLY 30 HA2 GLY 30 65.026 -1.357 8.677 257 HA3 GLY 30 HA3 GLY 30 65.664 -2.995 8.571 258 H THR 31 H THR 31 62.909 -1.418 9.016 259 HA THR 31 HA THR 31 61.781 -3.516 10.776 260 HB THR 31 HB THR 31 60.184 -1.886 11.640 261 HG1 THR 31 HG1 THR 31 60.039 -0.464 10.004 262 HG21 THR 31 HG21 THR 31 62.662 -2.138 12.509 263 HG22 THR 31 HG22 THR 31 61.627 -0.860 13.145 264 HG23 THR 31 HG23 THR 31 62.824 -0.490 11.905 265 H ASP 32 H ASP 32 59.427 -3.865 10.380 266 HA ASP 32 HA ASP 32 58.943 -4.061 7.532 267 HB2 ASP 32 HB2 ASP 32 58.318 -5.871 9.127 268 HB3 ASP 32 HB3 ASP 32 57.129 -4.788 9.844 269 H ASP 33 H ASP 33 58.303 -2.289 6.479 270 HA ASP 33 HA ASP 33 55.925 -0.881 7.408 271 HB2 ASP 33 HB2 ASP 33 56.947 1.327 7.240 272 HB3 ASP 33 HB3 ASP 33 57.787 0.358 8.446 273 H ASP 34 H ASP 34 55.631 1.075 5.689 274 HA ASP 34 HA ASP 34 54.987 -0.115 3.238 275 HB2 ASP 34 HB2 ASP 34 54.022 2.018 4.123 276 HB3 ASP 34 HB3 ASP 34 55.540 2.820 3.724 277 H ASP 35 H ASP 35 55.890 0.282 1.113 278 HA ASP 35 HA ASP 35 58.711 -0.173 1.062 279 HB2 ASP 35 HB2 ASP 35 57.117 -1.129 -0.596 280 HB3 ASP 35 HB3 ASP 35 56.861 0.491 -1.241 281 H LYS 36 H LYS 36 60.274 1.283 1.116 282 HA LYS 36 HA LYS 36 59.791 3.976 0.021 283 HB2 LYS 36 HB2 LYS 36 60.822 5.023 1.930 284 HB3 LYS 36 HB3 LYS 36 59.502 4.004 2.494 285 HG2 LYS 36 HG2 LYS 36 61.173 2.208 3.003 286 HG3 LYS 36 HG3 LYS 36 62.459 3.331 2.560 287 HD2 LYS 36 HD2 LYS 36 61.481 4.931 4.288 288 HD3 LYS 36 HD3 LYS 36 60.494 3.580 4.844 289 HE2 LYS 36 HE2 LYS 36 63.523 3.571 4.678 290 HE3 LYS 36 HE3 LYS 36 62.586 3.780 6.159 291 HZ1 LYS 36 HZ1 LYS 36 63.198 1.504 5.987 292 HZ2 LYS 36 HZ2 LYS 36 62.636 1.400 4.388 293 HZ3 LYS 36 HZ3 LYS 36 61.536 1.602 5.666 294 H THR 37 H THR 37 62.114 5.180 0.277 295 HA THR 37 HA THR 37 63.788 3.814 -1.603 296 HB THR 37 HB THR 37 65.229 5.777 -1.441 297 HG1 THR 37 HG1 THR 37 64.509 7.364 0.100 298 HG21 THR 37 HG21 THR 37 62.382 6.761 -1.257 299 HG22 THR 37 HG22 THR 37 62.957 5.831 -2.640 300 HG23 THR 37 HG23 THR 37 63.693 7.387 -2.257 301 H GLY 38 H GLY 38 66.178 3.588 -1.216 302 HA2 GLY 38 HA2 GLY 38 66.562 1.885 1.075 303 HA3 GLY 38 HA3 GLY 38 67.747 2.234 -0.178 304 H GLY 39 H GLY 39 69.009 2.188 1.995 305 HA2 GLY 39 HA2 GLY 39 68.818 4.600 3.593 306 HA3 GLY 39 HA3 GLY 39 69.979 3.293 3.802 307 H GLY 40 H GLY 40 71.297 5.377 4.142 308 HA2 GLY 40 HA2 GLY 40 72.080 6.792 1.737 309 HA3 GLY 40 HA3 GLY 40 72.737 7.028 3.353 310 H ARG 41 H ARG 41 74.744 7.129 1.942 311 HA ARG 41 HA ARG 41 75.813 4.898 0.628 312 HB2 ARG 41 HB2 ARG 41 77.319 7.047 2.142 313 HB3 ARG 41 HB3 ARG 41 77.987 5.989 0.900 314 HG2 ARG 41 HG2 ARG 41 75.690 7.912 0.434 315 HG3 ARG 41 HG3 ARG 41 77.372 8.268 0.048 316 HD2 ARG 41 HD2 ARG 41 77.407 6.237 -1.421 317 HD3 ARG 41 HD3 ARG 41 75.683 6.039 -1.118 318 HE ARG 41 HE ARG 41 76.010 8.647 -2.000 319 HH11 ARG 41 HH11 ARG 41 76.599 5.449 -3.324 320 HH12 ARG 41 HH12 ARG 41 76.354 5.971 -4.957 321 HH21 ARG 41 HH21 ARG 41 75.705 9.260 -4.123 322 HH22 ARG 41 HH22 ARG 41 75.854 8.102 -5.402 323 H ALA 42 H ALA 42 77.303 3.317 1.270 324 HA ALA 42 HA ALA 42 76.772 2.016 3.684 325 HB1 ALA 42 HB1 ALA 42 77.970 1.223 1.465 326 HB2 ALA 42 HB2 ALA 42 78.318 0.440 3.007 327 HB3 ALA 42 HB3 ALA 42 79.427 1.649 2.362 328 H ASP 43 H ASP 43 77.964 1.770 5.595 329 HA ASP 43 HA ASP 43 79.023 4.108 6.717 330 HB2 ASP 43 HB2 ASP 43 79.795 2.629 8.554 331 HB3 ASP 43 HB3 ASP 43 78.121 2.316 8.096 332 HA PRO 44 HA PRO 44 83.194 4.193 5.295 333 HB2 PRO 44 HB2 PRO 44 84.594 5.083 7.483 334 HB3 PRO 44 HB3 PRO 44 83.591 6.130 6.463 335 HG2 PRO 44 HG2 PRO 44 82.968 4.908 9.099 336 HG3 PRO 44 HG3 PRO 44 82.571 6.519 8.476 337 HD2 PRO 44 HD2 PRO 44 80.746 4.502 8.558 338 HD3 PRO 44 HD3 PRO 44 80.716 5.771 7.314 339 H ALA 45 H ALA 45 85.581 3.660 6.397 340 HA ALA 45 HA ALA 45 85.391 0.969 7.600 341 HB1 ALA 45 HB1 ALA 45 87.361 1.601 5.410 342 HB2 ALA 45 HB2 ALA 45 85.750 0.981 5.046 343 HB3 ALA 45 HB3 ALA 45 86.863 0.024 6.024 344 H HIS 46 H HIS 46 87.583 0.225 8.381 345 HA HIS 46 HA HIS 46 88.603 2.029 10.259 346 HB2 HIS 46 HB2 HIS 46 89.946 -0.408 9.085 347 HB3 HIS 46 HB3 HIS 46 90.425 0.407 10.561 348 HD1 HIS 46 HD1 HIS 46 88.387 0.475 12.448 349 HD2 HIS 46 HD2 HIS 46 88.187 -2.474 9.508 350 HE1 HIS 46 HE1 HIS 46 86.806 -1.298 13.321 351 H ARG 47 H ARG 47 90.901 2.759 10.408 352 HA ARG 47 HA ARG 47 91.470 4.588 8.380 353 HB2 ARG 47 HB2 ARG 47 93.316 3.413 10.471 354 HB3 ARG 47 HB3 ARG 47 93.681 4.834 9.491 355 HG2 ARG 47 HG2 ARG 47 91.659 5.955 10.382 356 HG3 ARG 47 HG3 ARG 47 91.337 4.547 11.394 357 HD2 ARG 47 HD2 ARG 47 92.485 6.161 12.764 358 HD3 ARG 47 HD3 ARG 47 93.620 4.859 12.416 359 HE ARG 47 HE ARG 47 94.048 6.691 10.417 360 HH11 ARG 47 HH11 ARG 47 94.124 6.858 13.924 361 HH12 ARG 47 HH12 ARG 47 95.308 8.123 13.937 362 HH21 ARG 47 HH21 ARG 47 95.571 8.318 10.498 363 HH22 ARG 47 HH22 ARG 47 96.117 8.938 12.020 364 H SER 48 H SER 48 92.887 4.643 6.687 365 HA SER 48 HA SER 48 94.384 2.201 6.015 366 HB2 SER 48 HB2 SER 48 92.850 3.602 3.851 367 HB3 SER 48 HB3 SER 48 93.436 1.945 3.907 368 HG SER 48 HG SER 48 91.297 3.054 5.305 369 HA PRO 49 HA PRO 49 97.712 4.797 4.705 370 HB2 PRO 49 HB2 PRO 49 97.298 3.985 1.853 371 HB3 PRO 49 HB3 PRO 49 98.789 3.998 2.817 372 HG2 PRO 49 HG2 PRO 49 97.522 1.730 2.304 373 HG3 PRO 49 HG3 PRO 49 98.285 2.020 3.878 374 HD2 PRO 49 HD2 PRO 49 95.392 2.020 3.169 375 HD3 PRO 49 HD3 PRO 49 96.177 1.581 4.702 376 H VAL 50 H VAL 50 98.092 6.889 3.868 377 HA VAL 50 HA VAL 50 95.625 8.280 3.174 378 HB VAL 50 HB VAL 50 98.381 9.352 3.841 379 HG11 VAL 50 HG11 VAL 50 95.720 10.801 3.781 380 HG12 VAL 50 HG12 VAL 50 96.906 10.876 2.478 381 HG13 VAL 50 HG13 VAL 50 97.310 11.507 4.075 382 HG21 VAL 50 HG21 VAL 50 95.863 9.089 5.514 383 HG22 VAL 50 HG22 VAL 50 97.351 9.882 6.031 384 HG23 VAL 50 HG23 VAL 50 97.341 8.147 5.717 385 HA PRO 51 HA PRO 51 96.643 8.488 -1.204 386 HB2 PRO 51 HB2 PRO 51 95.747 11.333 -1.075 387 HB3 PRO 51 HB3 PRO 51 95.243 10.041 -2.182 388 HG2 PRO 51 HG2 PRO 51 93.674 10.855 -0.198 389 HG3 PRO 51 HG3 PRO 51 93.749 9.152 -0.687 390 HD2 PRO 51 HD2 PRO 51 94.903 10.460 1.730 391 HD3 PRO 51 HD3 PRO 51 94.300 8.804 1.521 392 H LEU 52 H LEU 52 98.128 9.637 -2.668 393 HA LEU 52 HA LEU 52 100.554 10.299 -1.380 394 HB2 LEU 52 HB2 LEU 52 99.563 10.425 -4.207 395 HB3 LEU 52 HB3 LEU 52 101.100 11.185 -3.793 396 HG LEU 52 HG LEU 52 100.444 8.321 -3.067 397 HD11 LEU 52 HD11 LEU 52 102.020 7.824 -5.029 398 HD12 LEU 52 HD12 LEU 52 101.736 9.489 -5.540 399 HD13 LEU 52 HD13 LEU 52 100.390 8.352 -5.452 400 HD21 LEU 52 HD21 LEU 52 102.245 9.109 -1.742 401 HD22 LEU 52 HD22 LEU 52 102.915 10.059 -3.069 402 HD23 LEU 52 HD23 LEU 52 103.036 8.300 -3.095 403 HA PRO 53 HA PRO 53 99.916 14.657 -0.770 404 HB2 PRO 53 HB2 PRO 53 102.456 15.621 -0.729 405 HB3 PRO 53 HB3 PRO 53 101.790 14.639 0.589 406 HG2 PRO 53 HG2 PRO 53 103.639 13.862 -1.596 407 HG3 PRO 53 HG3 PRO 53 103.598 13.335 0.095 408 HD2 PRO 53 HD2 PRO 53 102.605 11.849 -2.017 409 HD3 PRO 53 HD3 PRO 53 102.093 11.660 -0.327 410 H SER 54 H SER 54 99.865 16.655 -1.893 411 HA SER 54 HA SER 54 99.641 16.493 -4.655 412 HB2 SER 54 HB2 SER 54 99.980 18.859 -2.816 413 HB3 SER 54 HB3 SER 54 99.746 19.049 -4.550 414 HG SER 54 HG SER 54 97.998 18.260 -2.632 415 HA PRO 55 HA PRO 55 103.909 16.520 -5.677 416 HB2 PRO 55 HB2 PRO 55 103.850 16.798 -8.361 417 HB3 PRO 55 HB3 PRO 55 103.226 15.347 -7.551 418 HG2 PRO 55 HG2 PRO 55 101.755 17.623 -8.742 419 HG3 PRO 55 HG3 PRO 55 101.323 15.908 -8.669 420 HD2 PRO 55 HD2 PRO 55 100.327 17.901 -6.972 421 HD3 PRO 55 HD3 PRO 55 100.240 16.152 -6.678 422 H THR 56 H THR 56 105.241 18.152 -5.088 423 HA THR 56 HA THR 56 105.059 20.796 -6.250 424 HB THR 56 HB THR 56 107.149 21.241 -5.075 425 HG1 THR 56 HG1 THR 56 107.994 19.398 -3.907 426 HG21 THR 56 HG21 THR 56 106.399 20.916 -2.832 427 HG22 THR 56 HG22 THR 56 105.472 19.483 -3.277 428 HG23 THR 56 HG23 THR 56 104.941 21.079 -3.811 429 H SER 57 H SER 57 107.020 21.657 -7.523 430 HA SER 57 HA SER 57 106.982 20.317 -9.962 431 HB2 SER 57 HB2 SER 57 107.556 22.710 -9.682 432 HB3 SER 57 HB3 SER 57 109.105 22.239 -8.990 433 HG SER 57 HG SER 57 108.168 21.925 -11.576 434 H ASN 58 H ASN 58 107.895 18.540 -10.646 435 HA ASN 58 HA ASN 58 109.467 16.975 -11.165 436 HB2 ASN 58 HB2 ASN 58 111.396 18.925 -9.903 437 HB3 ASN 58 HB3 ASN 58 111.821 17.573 -10.951 438 HD21 ASN 58 HD21 ASN 58 109.843 17.787 -12.953 439 HD22 ASN 58 HD22 ASN 58 110.032 19.264 -13.767 440 H LYS 59 H LYS 59 108.343 17.245 -8.178 441 HA LYS 59 HA LYS 59 109.786 14.931 -7.262 442 HB2 LYS 59 HB2 LYS 59 110.766 15.862 -5.276 443 HB3 LYS 59 HB3 LYS 59 111.330 16.778 -6.668 444 HG2 LYS 59 HG2 LYS 59 109.565 18.492 -6.191 445 HG3 LYS 59 HG3 LYS 59 109.155 17.599 -4.725 446 HD2 LYS 59 HD2 LYS 59 111.606 17.817 -4.059 447 HD3 LYS 59 HD3 LYS 59 111.767 18.976 -5.380 448 HE2 LYS 59 HE2 LYS 59 109.905 20.310 -4.378 449 HE3 LYS 59 HE3 LYS 59 109.889 19.196 -3.010 450 HZ1 LYS 59 HZ1 LYS 59 111.932 21.156 -3.790 451 HZ2 LYS 59 HZ2 LYS 59 112.411 19.757 -2.953 452 HZ3 LYS 59 HZ3 LYS 59 111.287 20.824 -2.257 453 H GLN 60 H GLN 60 109.045 14.117 -5.172 454 HA GLN 60 HA GLN 60 106.577 15.267 -4.097 455 HB2 GLN 60 HB2 GLN 60 106.795 12.402 -5.038 456 HB3 GLN 60 HB3 GLN 60 105.528 12.990 -3.964 457 HG2 GLN 60 HG2 GLN 60 104.919 14.683 -5.711 458 HG3 GLN 60 HG3 GLN 60 106.093 13.918 -6.783 459 HE21 GLN 60 HE21 GLN 60 102.906 13.500 -5.269 460 HE22 GLN 60 HE22 GLN 60 102.501 12.105 -6.146 461 H ASP 61 H ASP 61 106.178 14.695 -1.923 462 HA ASP 61 HA ASP 61 108.442 13.508 -0.499 463 HB2 ASP 61 HB2 ASP 61 105.854 14.721 0.508 464 HB3 ASP 61 HB3 ASP 61 107.163 14.139 1.532 465 H ILE 62 H ILE 62 108.489 11.391 0.030 466 HA ILE 62 HA ILE 62 105.927 9.894 0.017 467 HB ILE 62 HB ILE 62 107.307 9.541 -2.037 468 HG12 ILE 62 HG12 ILE 62 107.276 7.001 -1.807 469 HG13 ILE 62 HG13 ILE 62 106.777 7.258 -0.135 470 HG21 ILE 62 HG21 ILE 62 109.550 9.717 -1.119 471 HG22 ILE 62 HG22 ILE 62 109.336 8.110 -1.814 472 HG23 ILE 62 HG23 ILE 62 109.263 8.332 -0.065 473 HD11 ILE 62 HD11 ILE 62 104.977 7.000 -2.089 474 HD12 ILE 62 HD12 ILE 62 105.277 8.724 -2.275 475 HD13 ILE 62 HD13 ILE 62 104.706 8.090 -0.732 476 H SER 63 H SER 63 105.763 8.136 1.503 477 HA SER 63 HA SER 63 107.884 7.904 3.496 478 HB2 SER 63 HB2 SER 63 106.566 8.633 5.357 479 HB3 SER 63 HB3 SER 63 106.510 9.903 4.140 480 HG SER 63 HG SER 63 104.473 9.430 3.820 481 H GLU 64 H GLU 64 107.457 6.302 5.137 482 HA GLU 64 HA GLU 64 106.600 3.866 4.119 483 HB2 GLU 64 HB2 GLU 64 106.773 3.043 6.426 484 HB3 GLU 64 HB3 GLU 64 108.132 4.087 6.019 485 HG2 GLU 64 HG2 GLU 64 106.962 5.989 7.107 486 HG3 GLU 64 HG3 GLU 64 105.674 4.894 7.591 487 H ALA 65 H ALA 65 104.782 6.309 5.909 488 HA ALA 65 HA ALA 65 102.630 4.715 6.744 489 HB1 ALA 65 HB1 ALA 65 102.986 7.639 6.206 490 HB2 ALA 65 HB2 ALA 65 102.633 6.814 7.725 491 HB3 ALA 65 HB3 ALA 65 101.366 7.010 6.512 492 H ASN 66 H ASN 66 103.121 6.513 3.714 493 HA ASN 66 HA ASN 66 100.491 6.034 2.723 494 HB2 ASN 66 HB2 ASN 66 102.959 6.648 1.089 495 HB3 ASN 66 HB3 ASN 66 101.279 6.920 0.638 496 HD21 ASN 66 HD21 ASN 66 100.099 8.649 1.830 497 HD22 ASN 66 HD22 ASN 66 100.967 9.898 2.580 498 H LEU 67 H LEU 67 103.639 4.499 2.086 499 HA LEU 67 HA LEU 67 102.575 2.700 0.136 500 HB2 LEU 67 HB2 LEU 67 105.206 2.930 1.559 501 HB3 LEU 67 HB3 LEU 67 104.847 1.514 0.570 502 HG LEU 67 HG LEU 67 104.180 3.159 -1.275 503 HD11 LEU 67 HD11 LEU 67 105.569 5.367 -0.920 504 HD12 LEU 67 HD12 LEU 67 105.342 4.999 0.788 505 HD13 LEU 67 HD13 LEU 67 103.941 5.235 -0.257 506 HD21 LEU 67 HD21 LEU 67 106.496 1.897 -0.848 507 HD22 LEU 67 HD22 LEU 67 107.083 3.547 -0.648 508 HD23 LEU 67 HD23 LEU 67 106.314 3.063 -2.156 509 H ALA 68 H ALA 68 102.945 2.494 3.610 510 HA ALA 68 HA ALA 68 102.274 0.925 5.118 511 HB1 ALA 68 HB1 ALA 68 100.307 0.814 3.346 512 HB2 ALA 68 HB2 ALA 68 100.427 -0.380 4.637 513 HB3 ALA 68 HB3 ALA 68 100.994 -0.777 3.015 514 H TYR 69 H TYR 69 102.126 -2.091 4.040 515 HA TYR 69 HA TYR 69 104.624 -2.830 5.018 516 HB2 TYR 69 HB2 TYR 69 102.695 -4.342 4.791 517 HB3 TYR 69 HB3 TYR 69 102.886 -4.314 3.048 518 HD1 TYR 69 HD2 TYR 69 104.377 -5.439 6.241 519 HD2 TYR 69 HD1 TYR 69 104.591 -5.622 1.955 520 HE1 TYR 69 HE2 TYR 69 105.967 -7.334 6.402 521 HE2 TYR 69 HE1 TYR 69 106.182 -7.518 2.115 522 HH TYR 69 HH TYR 69 107.641 -8.424 5.023 523 H LEU 70 H LEU 70 103.744 -1.759 1.824 524 HA LEU 70 HA LEU 70 105.709 -3.005 0.269 525 HB2 LEU 70 HB2 LEU 70 104.131 -0.471 0.005 526 HB3 LEU 70 HB3 LEU 70 105.438 -0.784 -1.127 527 HG LEU 70 HG LEU 70 103.225 -1.542 -1.962 528 HD11 LEU 70 HD11 LEU 70 104.866 -4.006 -1.475 529 HD12 LEU 70 HD12 LEU 70 105.522 -2.683 -2.437 530 HD13 LEU 70 HD13 LEU 70 104.038 -3.491 -2.944 531 HD21 LEU 70 HD21 LEU 70 103.368 -3.620 0.238 532 HD22 LEU 70 HD22 LEU 70 102.100 -3.447 -0.974 533 HD23 LEU 70 HD23 LEU 70 102.303 -2.215 0.271 534 H TRP 71 H TRP 71 106.022 -0.359 2.518 535 HA TRP 71 HA TRP 71 108.182 1.032 1.463 536 HB2 TRP 71 HB2 TRP 71 106.760 1.533 3.526 537 HB3 TRP 71 HB3 TRP 71 107.867 0.487 4.394 538 HD1 TRP 71 HD1 TRP 71 109.790 1.710 5.484 539 HE1 TRP 71 HE1 TRP 71 111.027 3.935 5.090 540 HE3 TRP 71 HE3 TRP 71 107.421 3.307 1.256 541 HZ2 TRP 71 HZ2 TRP 71 111.037 6.102 3.210 542 HZ3 TRP 71 HZ3 TRP 71 108.063 5.442 0.182 543 HH2 TRP 71 HH2 TRP 71 109.864 6.841 1.151 544 HA PRO 72 HA PRO 72 111.059 -2.455 2.190 545 HB2 PRO 72 HB2 PRO 72 112.843 -1.996 0.256 546 HB3 PRO 72 HB3 PRO 72 111.201 -2.549 -0.132 547 HG2 PRO 72 HG2 PRO 72 112.379 0.162 -0.362 548 HG3 PRO 72 HG3 PRO 72 111.204 -0.656 -1.407 549 HD2 PRO 72 HD2 PRO 72 110.597 1.219 0.602 550 HD3 PRO 72 HD3 PRO 72 109.440 0.143 -0.210 551 H LEU 73 H LEU 73 111.719 0.905 2.544 552 HA LEU 73 HA LEU 73 114.553 0.522 3.181 553 HB2 LEU 73 HB2 LEU 73 112.897 3.053 3.219 554 HB3 LEU 73 HB3 LEU 73 114.652 2.943 3.327 555 HG LEU 73 HG LEU 73 112.995 2.017 0.961 556 HD11 LEU 73 HD11 LEU 73 113.717 4.006 -0.148 557 HD12 LEU 73 HD12 LEU 73 114.874 4.381 1.130 558 HD13 LEU 73 HD13 LEU 73 113.142 4.525 1.440 559 HD21 LEU 73 HD21 LEU 73 115.055 0.734 1.158 560 HD22 LEU 73 HD22 LEU 73 115.988 2.202 1.449 561 HD23 LEU 73 HD23 LEU 73 115.261 1.916 -0.133 562 H THR 74 H THR 74 115.464 0.839 5.145 563 HA THR 74 HA THR 74 113.920 0.515 7.514 564 HB THR 74 HB THR 74 116.049 0.809 8.689 565 HG1 THR 74 HG1 THR 74 117.846 1.260 7.301 566 HG21 THR 74 HG21 THR 74 117.198 -1.070 7.752 567 HG22 THR 74 HG22 THR 74 116.543 -0.753 6.146 568 HG23 THR 74 HG23 THR 74 115.483 -1.329 7.432 569 H VAL 75 H VAL 75 115.454 3.317 5.932 570 HA VAL 75 HA VAL 75 114.839 5.192 7.973 571 HB VAL 75 HB VAL 75 114.990 6.905 6.146 572 HG11 VAL 75 HG11 VAL 75 116.996 6.288 7.329 573 HG12 VAL 75 HG12 VAL 75 117.399 6.382 5.615 574 HG13 VAL 75 HG13 VAL 75 117.163 4.811 6.381 575 HG21 VAL 75 HG21 VAL 75 115.576 4.493 4.396 576 HG22 VAL 75 HG22 VAL 75 115.664 6.183 3.909 577 HG23 VAL 75 HG23 VAL 75 114.107 5.465 4.307 578 H ASP 76 H ASP 76 112.954 6.238 8.462 579 HA ASP 76 HA ASP 76 110.631 4.791 7.750 580 HB2 ASP 76 HB2 ASP 76 109.425 6.367 9.173 581 HB3 ASP 76 HB3 ASP 76 110.924 5.864 9.951 582 H HIS 77 H HIS 77 111.943 7.833 6.513 583 HA HIS 77 HA HIS 77 110.028 7.592 4.339 584 HB2 HIS 77 HB2 HIS 77 109.146 9.790 4.468 585 HB3 HIS 77 HB3 HIS 77 108.901 9.027 6.021 586 HD1 HIS 77 HD1 HIS 77 110.520 9.861 7.988 587 HD2 HIS 77 HD2 HIS 77 110.564 12.173 4.522 588 HE1 HIS 77 HE1 HIS 77 111.549 12.082 8.626 589 H GLY 78 H GLY 78 110.470 9.450 2.712 590 HA2 GLY 78 HA2 GLY 78 113.031 10.695 2.691 591 HA3 GLY 78 HA3 GLY 78 113.004 9.264 1.664 592 H THR 79 H THR 79 113.381 11.831 0.630 593 HA THR 79 HA THR 79 110.814 12.420 -0.722 594 HB THR 79 HB THR 79 113.263 14.177 -0.807 595 HG1 THR 79 HG1 THR 79 112.848 14.098 1.300 596 HG21 THR 79 HG21 THR 79 111.629 14.870 -2.361 597 HG22 THR 79 HG22 THR 79 111.272 15.856 -0.943 598 HG23 THR 79 HG23 THR 79 110.298 14.426 -1.291 599 H ILE 80 H ILE 80 110.678 12.310 -2.939 600 HA ILE 80 HA ILE 80 113.007 11.107 -4.317 601 HB ILE 80 HB ILE 80 111.350 10.163 -5.887 602 HG12 ILE 80 HG12 ILE 80 109.302 11.317 -3.963 603 HG13 ILE 80 HG13 ILE 80 109.625 11.947 -5.576 604 HG21 ILE 80 HG21 ILE 80 112.078 8.885 -3.902 605 HG22 ILE 80 HG22 ILE 80 110.403 8.518 -4.313 606 HG23 ILE 80 HG23 ILE 80 110.764 9.596 -2.965 607 HD11 ILE 80 HD11 ILE 80 108.418 9.297 -4.814 608 HD12 ILE 80 HD12 ILE 80 109.141 9.548 -6.402 609 HD13 ILE 80 HD13 ILE 80 107.768 10.536 -5.893 610 H GLU 81 H GLU 81 113.768 12.017 -6.182 611 HA GLU 81 HA GLU 81 112.329 14.309 -7.309 612 HB2 GLU 81 HB2 GLU 81 113.811 15.188 -5.509 613 HB3 GLU 81 HB3 GLU 81 115.196 14.516 -6.366 614 HG2 GLU 81 HG2 GLU 81 114.587 15.877 -8.359 615 HG3 GLU 81 HG3 GLU 81 113.272 16.595 -7.441 616 H CYS 82 H CYS 82 112.698 14.695 -9.408 617 HA CYS 82 HA CYS 82 114.664 12.991 -10.816 618 HB2 CYS 82 HB2 CYS 82 112.021 14.178 -11.604 619 HB3 CYS 82 HB3 CYS 82 113.222 13.815 -12.844 620 H LEU 83 H LEU 83 116.436 13.974 -11.551 621 HA LEU 83 HA LEU 83 116.671 16.861 -11.396 622 HB2 LEU 83 HB2 LEU 83 118.598 14.654 -12.128 623 HB3 LEU 83 HB3 LEU 83 119.033 16.362 -12.188 624 HG LEU 83 HG LEU 83 117.782 15.234 -9.699 625 HD11 LEU 83 HD11 LEU 83 120.071 14.764 -8.850 626 HD12 LEU 83 HD12 LEU 83 120.717 15.092 -10.458 627 HD13 LEU 83 HD13 LEU 83 119.642 13.718 -10.203 628 HD21 LEU 83 HD21 LEU 83 119.397 17.016 -8.759 629 HD22 LEU 83 HD22 LEU 83 118.007 17.598 -9.675 630 HD23 LEU 83 HD23 LEU 83 119.598 17.536 -10.432 631 HA PRO 84 HA PRO 84 115.921 17.941 -15.625 632 HB2 PRO 84 HB2 PRO 84 118.256 19.361 -16.280 633 HB3 PRO 84 HB3 PRO 84 116.789 20.033 -15.547 634 HG2 PRO 84 HG2 PRO 84 119.333 19.218 -14.267 635 HG3 PRO 84 HG3 PRO 84 118.240 20.557 -13.872 636 HD2 PRO 84 HD2 PRO 84 118.303 18.323 -12.368 637 HD3 PRO 84 HD3 PRO 84 116.782 19.197 -12.662 638 H SER 85 H SER 85 118.840 16.260 -14.774 639 HA SER 85 HA SER 85 119.654 15.635 -17.469 640 HB2 SER 85 HB2 SER 85 121.268 15.785 -15.608 641 HB3 SER 85 HB3 SER 85 120.506 14.391 -14.850 642 HG SER 85 HG SER 85 121.140 13.203 -16.605 643 H ASP 86 H ASP 86 117.000 14.578 -15.882 644 HA ASP 86 HA ASP 86 115.618 12.780 -16.020 645 HB2 ASP 86 HB2 ASP 86 117.411 11.931 -18.311 646 HB3 ASP 86 HB3 ASP 86 115.837 11.249 -17.924 647 H ASN 87 H ASN 87 117.715 12.757 -14.161 648 HA ASN 87 HA ASN 87 118.248 9.850 -13.930 649 HB2 ASN 87 HB2 ASN 87 119.679 12.204 -12.666 650 HB3 ASN 87 HB3 ASN 87 120.023 10.512 -12.317 651 HD21 ASN 87 HD21 ASN 87 121.952 12.354 -13.492 652 HD22 ASN 87 HD22 ASN 87 122.313 11.778 -15.048 653 H ALA 88 H ALA 88 117.185 8.803 -12.352 654 HA ALA 88 HA ALA 88 115.515 10.385 -10.531 655 HB1 ALA 88 HB1 ALA 88 114.703 7.931 -9.993 656 HB2 ALA 88 HB2 ALA 88 115.481 7.565 -11.533 657 HB3 ALA 88 HB3 ALA 88 114.173 8.745 -11.465 658 H VAL 89 H VAL 89 116.074 10.694 -8.469 659 HA VAL 89 HA VAL 89 117.857 8.722 -7.171 660 HB VAL 89 HB VAL 89 119.028 10.589 -6.042 661 HG11 VAL 89 HG11 VAL 89 120.132 11.477 -8.219 662 HG12 VAL 89 HG12 VAL 89 119.031 10.375 -9.047 663 HG13 VAL 89 HG13 VAL 89 120.208 9.746 -7.891 664 HG21 VAL 89 HG21 VAL 89 117.375 12.274 -7.948 665 HG22 VAL 89 HG22 VAL 89 118.747 12.878 -7.020 666 HG23 VAL 89 HG23 VAL 89 117.304 12.305 -6.186 667 H PHE 90 H PHE 90 117.735 8.658 -4.912 668 HA PHE 90 HA PHE 90 115.188 9.613 -3.753 669 HB2 PHE 90 HB2 PHE 90 115.324 7.187 -3.979 670 HB3 PHE 90 HB3 PHE 90 116.871 7.177 -3.162 671 HD1 PHE 90 HD1 PHE 90 113.245 7.910 -2.689 672 HD2 PHE 90 HD2 PHE 90 117.000 6.994 -0.820 673 HE1 PHE 90 HE1 PHE 90 112.083 7.577 -0.511 674 HE2 PHE 90 HE2 PHE 90 115.843 6.645 1.344 675 HZ PHE 90 HZ PHE 90 113.383 6.937 1.496 676 H VAL 91 H VAL 91 115.382 11.026 -2.093 677 HA VAL 91 HA VAL 91 118.011 11.322 -0.775 678 HB VAL 91 HB VAL 91 115.676 13.254 -0.913 679 HG11 VAL 91 HG11 VAL 91 117.410 13.312 1.091 680 HG12 VAL 91 HG12 VAL 91 116.946 14.795 0.269 681 HG13 VAL 91 HG13 VAL 91 118.474 14.013 -0.126 682 HG21 VAL 91 HG21 VAL 91 117.305 14.553 -2.367 683 HG22 VAL 91 HG22 VAL 91 116.651 13.087 -3.097 684 HG23 VAL 91 HG23 VAL 91 118.286 13.089 -2.436 685 H ALA 92 H ALA 92 118.185 10.810 1.342 686 HA ALA 92 HA ALA 92 115.708 10.032 2.762 687 HB1 ALA 92 HB1 ALA 92 117.352 8.289 2.753 688 HB2 ALA 92 HB2 ALA 92 117.349 8.973 4.379 689 HB3 ALA 92 HB3 ALA 92 118.628 9.403 3.243 690 HA PRO 93 HA PRO 93 115.614 13.468 5.532 691 HB2 PRO 93 HB2 PRO 93 115.891 11.581 7.828 692 HB3 PRO 93 HB3 PRO 93 114.677 12.842 7.541 693 HG2 PRO 93 HG2 PRO 93 114.162 10.230 7.209 694 HG3 PRO 93 HG3 PRO 93 113.387 11.497 6.246 695 HD2 PRO 93 HD2 PRO 93 115.422 9.526 5.419 696 HD3 PRO 93 HD3 PRO 93 114.268 10.446 4.436 697 H ASP 94 H ASP 94 118.130 11.070 5.923 698 HA ASP 94 HA ASP 94 119.723 12.464 7.806 699 HB2 ASP 94 HB2 ASP 94 121.537 10.945 7.024 700 HB3 ASP 94 HB3 ASP 94 120.056 10.116 7.482 701 H GLY 95 H GLY 95 119.113 13.222 4.538 702 HA2 GLY 95 HA2 GLY 95 119.912 15.146 3.433 703 HA3 GLY 95 HA3 GLY 95 121.262 15.207 4.560 704 H THR 96 H THR 96 120.836 12.074 3.337 705 HA THR 96 HA THR 96 123.150 12.396 1.555 706 HB THR 96 HB THR 96 121.874 9.893 2.690 707 HG1 THR 96 HG1 THR 96 122.867 11.203 4.236 708 HG21 THR 96 HG21 THR 96 124.229 10.438 0.923 709 HG22 THR 96 HG22 THR 96 123.066 9.112 0.870 710 HG23 THR 96 HG23 THR 96 124.341 9.120 2.090 711 H THR 97 H THR 97 122.998 11.944 -0.605 712 HA THR 97 HA THR 97 120.307 11.291 -1.632 713 HB THR 97 HB THR 97 122.711 12.376 -3.128 714 HG1 THR 97 HG1 THR 97 122.043 13.969 -1.860 715 HG21 THR 97 HG21 THR 97 119.778 12.252 -3.880 716 HG22 THR 97 HG22 THR 97 121.007 11.131 -4.469 717 HG23 THR 97 HG23 THR 97 121.098 12.841 -4.889 718 H TYR 98 H TYR 98 119.926 9.428 -2.582 719 HA TYR 98 HA TYR 98 122.171 7.610 -3.195 720 HB2 TYR 98 HB2 TYR 98 119.344 6.952 -2.361 721 HB3 TYR 98 HB3 TYR 98 120.591 5.780 -2.735 722 HD1 TYR 98 HD2 TYR 98 122.484 5.428 -1.166 723 HD2 TYR 98 HD1 TYR 98 119.256 8.111 -0.249 724 HE1 TYR 98 HE2 TYR 98 123.159 5.431 1.221 725 HE2 TYR 98 HE1 TYR 98 119.942 8.125 2.130 726 HH TYR 98 HH TYR 98 121.535 7.447 3.584 727 H ALA 99 H ALA 99 122.005 6.414 -5.141 728 HA ALA 99 HA ALA 99 120.366 7.681 -7.186 729 HB1 ALA 99 HB1 ALA 99 122.619 5.684 -7.214 730 HB2 ALA 99 HB2 ALA 99 122.576 7.302 -7.912 731 HB3 ALA 99 HB3 ALA 99 121.659 5.992 -8.659 732 H LEU 100 H LEU 100 118.495 6.880 -7.938 733 HA LEU 100 HA LEU 100 117.533 4.323 -6.926 734 HB2 LEU 100 HB2 LEU 100 116.272 6.527 -8.559 735 HB3 LEU 100 HB3 LEU 100 115.472 4.982 -8.293 736 HG LEU 100 HG LEU 100 116.550 6.563 -5.968 737 HD11 LEU 100 HD11 LEU 100 113.852 6.850 -7.327 738 HD12 LEU 100 HD12 LEU 100 115.089 8.099 -7.199 739 HD13 LEU 100 HD13 LEU 100 114.254 7.532 -5.752 740 HD21 LEU 100 HD21 LEU 100 114.838 5.293 -4.768 741 HD22 LEU 100 HD22 LEU 100 115.829 4.178 -5.706 742 HD23 LEU 100 HD23 LEU 100 114.227 4.633 -6.284 743 H ASN 101 H ASN 101 118.096 5.879 -10.077 744 HA ASN 101 HA ASN 101 117.871 3.214 -11.353 745 HB2 ASN 101 HB2 ASN 101 117.322 4.314 -13.392 746 HB3 ASN 101 HB3 ASN 101 116.329 5.011 -12.120 747 HD21 ASN 101 HD21 ASN 101 116.450 6.642 -14.218 748 HD22 ASN 101 HD22 ASN 101 117.566 7.904 -14.008 749 H ASP 102 H ASP 102 119.204 2.976 -13.391 750 HA ASP 102 HA ASP 102 121.842 2.665 -12.523 751 HB2 ASP 102 HB2 ASP 102 122.330 1.976 -14.822 752 HB3 ASP 102 HB3 ASP 102 120.814 1.272 -14.259 753 H ARG 103 H ARG 103 120.395 5.245 -14.482 754 HA ARG 103 HA ARG 103 122.841 6.339 -15.390 755 HB2 ARG 103 HB2 ARG 103 120.096 7.557 -15.073 756 HB3 ARG 103 HB3 ARG 103 121.455 8.390 -15.837 757 HG2 ARG 103 HG2 ARG 103 121.704 6.469 -17.409 758 HG3 ARG 103 HG3 ARG 103 120.266 5.738 -16.698 759 HD2 ARG 103 HD2 ARG 103 120.381 8.430 -18.086 760 HD3 ARG 103 HD3 ARG 103 119.699 6.952 -18.759 761 HE ARG 103 HE ARG 103 118.435 8.719 -16.891 762 HH11 ARG 103 HH11 ARG 103 118.608 5.338 -17.821 763 HH12 ARG 103 HH12 ARG 103 117.015 4.997 -17.229 764 HH21 ARG 103 HH21 ARG 103 116.422 8.234 -16.163 765 HH22 ARG 103 HH22 ARG 103 115.783 6.628 -16.295 766 H ALA 104 H ALA 104 120.843 7.095 -12.539 767 HA ALA 104 HA ALA 104 122.422 9.179 -11.525 768 HB1 ALA 104 HB1 ALA 104 120.286 8.785 -10.541 769 HB2 ALA 104 HB2 ALA 104 121.478 8.444 -9.287 770 HB3 ALA 104 HB3 ALA 104 120.699 7.116 -10.148 771 H GLU 105 H GLU 105 122.752 5.657 -11.174 772 HA GLU 105 HA GLU 105 124.944 5.686 -9.397 773 HB2 GLU 105 HB2 GLU 105 124.240 3.672 -11.547 774 HB3 GLU 105 HB3 GLU 105 125.427 3.415 -10.271 775 HG2 GLU 105 HG2 GLU 105 123.655 3.817 -8.575 776 HG3 GLU 105 HG3 GLU 105 122.478 3.981 -9.871 777 H LYS 106 H LYS 106 124.808 5.811 -12.945 778 HA LYS 106 HA LYS 106 127.556 5.804 -13.474 779 HB2 LYS 106 HB2 LYS 106 125.765 5.654 -15.197 780 HB3 LYS 106 HB3 LYS 106 125.430 7.367 -14.954 781 HG2 LYS 106 HG2 LYS 106 126.889 7.283 -16.828 782 HG3 LYS 106 HG3 LYS 106 127.913 7.767 -15.479 783 HD2 LYS 106 HD2 LYS 106 128.691 5.462 -15.202 784 HD3 LYS 106 HD3 LYS 106 127.611 4.924 -16.489 785 HE2 LYS 106 HE2 LYS 106 129.800 6.984 -16.869 786 HE3 LYS 106 HE3 LYS 106 129.979 5.272 -17.250 787 HZ1 LYS 106 HZ1 LYS 106 127.990 7.135 -18.429 788 HZ2 LYS 106 HZ2 LYS 106 128.079 5.469 -18.756 789 HZ3 LYS 106 HZ3 LYS 106 129.354 6.497 -19.210 790 H ALA 107 H ALA 107 125.445 8.408 -12.416 791 HA ALA 107 HA ALA 107 127.343 10.521 -12.708 792 HB1 ALA 107 HB1 ALA 107 125.771 11.838 -11.394 793 HB2 ALA 107 HB2 ALA 107 124.899 10.375 -10.938 794 HB3 ALA 107 HB3 ALA 107 124.912 10.904 -12.620 795 H GLY 108 H GLY 108 127.621 7.944 -10.705 796 HA2 GLY 108 HA2 GLY 108 129.054 7.544 -8.985 797 HA3 GLY 108 HA3 GLY 108 129.539 9.227 -9.039 798 H HIS 109 H HIS 109 126.138 8.499 -8.578 799 HA HIS 109 HA HIS 109 126.289 9.373 -5.813 800 HB2 HIS 109 HB2 HIS 109 124.090 8.747 -7.739 801 HB3 HIS 109 HB3 HIS 109 123.735 8.750 -6.022 802 HD1 HIS 109 HD1 HIS 109 124.363 11.090 -4.757 803 HD2 HIS 109 HD2 HIS 109 124.047 11.246 -8.911 804 HE1 HIS 109 HE1 HIS 109 124.096 13.533 -5.363 805 HA PRO 110 HA PRO 110 126.551 5.155 -4.371 806 HB2 PRO 110 HB2 PRO 110 125.729 5.388 -1.788 807 HB3 PRO 110 HB3 PRO 110 127.300 5.998 -2.348 808 HG2 PRO 110 HG2 PRO 110 124.784 7.478 -1.805 809 HG3 PRO 110 HG3 PRO 110 126.464 7.948 -1.493 810 HD2 PRO 110 HD2 PRO 110 124.995 8.862 -3.639 811 HD3 PRO 110 HD3 PRO 110 126.768 8.778 -3.612 812 HA PRO 111 HA PRO 111 122.370 3.662 -4.787 813 HB2 PRO 111 HB2 PRO 111 122.620 1.056 -4.036 814 HB3 PRO 111 HB3 PRO 111 123.242 1.685 -5.573 815 HG2 PRO 111 HG2 PRO 111 124.692 0.988 -3.097 816 HG3 PRO 111 HG3 PRO 111 125.215 0.889 -4.784 817 HD2 PRO 111 HD2 PRO 111 125.938 2.905 -2.989 818 HD3 PRO 111 HD3 PRO 111 126.079 2.997 -4.756 819 H ILE 112 H ILE 112 120.484 2.953 -3.600 820 HA ILE 112 HA ILE 112 120.351 3.924 -0.954 821 HB ILE 112 HB ILE 112 118.392 2.129 -2.414 822 HG12 ILE 112 HG12 ILE 112 118.376 5.130 -2.028 823 HG13 ILE 112 HG13 ILE 112 118.992 4.353 -3.485 824 HG21 ILE 112 HG21 ILE 112 116.759 3.225 -0.794 825 HG22 ILE 112 HG22 ILE 112 118.157 3.827 0.089 826 HG23 ILE 112 HG23 ILE 112 117.882 2.090 -0.050 827 HD11 ILE 112 HD11 ILE 112 116.826 3.450 -4.008 828 HD12 ILE 112 HD12 ILE 112 116.579 5.149 -3.605 829 HD13 ILE 112 HD13 ILE 112 116.185 3.902 -2.428 830 H THR 113 H THR 113 121.706 0.991 -1.963 831 HA THR 113 HA THR 113 120.600 -0.948 -0.435 832 HB THR 113 HB THR 113 122.449 -1.188 -2.122 833 HG1 THR 113 HG1 THR 113 121.962 -3.020 -1.257 834 HG21 THR 113 HG21 THR 113 124.227 0.151 -1.238 835 HG22 THR 113 HG22 THR 113 124.726 -1.528 -1.072 836 HG23 THR 113 HG23 THR 113 124.140 -0.644 0.333 837 HA PRO 114 HA PRO 114 123.450 -0.054 3.374 838 HB2 PRO 114 HB2 PRO 114 123.106 2.879 3.665 839 HB3 PRO 114 HB3 PRO 114 124.549 1.878 3.923 840 HG2 PRO 114 HG2 PRO 114 124.354 3.469 1.813 841 HG3 PRO 114 HG3 PRO 114 125.108 1.865 1.690 842 HD2 PRO 114 HD2 PRO 114 122.351 2.713 0.854 843 HD3 PRO 114 HD3 PRO 114 123.501 1.668 0.001 844 H ILE 115 H ILE 115 120.632 1.929 2.589 845 HA ILE 115 HA ILE 115 119.503 1.431 5.257 846 HB ILE 115 HB ILE 115 117.718 3.039 4.527 847 HG12 ILE 115 HG12 ILE 115 119.641 3.648 2.267 848 HG13 ILE 115 HG13 ILE 115 118.163 2.714 2.056 849 HG21 ILE 115 HG21 ILE 115 119.985 3.518 5.772 850 HG22 ILE 115 HG22 ILE 115 118.977 4.853 5.219 851 HG23 ILE 115 HG23 ILE 115 120.392 4.370 4.280 852 HD11 ILE 115 HD11 ILE 115 117.878 5.346 3.430 853 HD12 ILE 115 HD12 ILE 115 116.808 4.552 2.277 854 HD13 ILE 115 HD13 ILE 115 118.252 5.387 1.708 855 H ARG 116 H ARG 116 119.529 -0.339 2.545 856 HA ARG 116 HA ARG 116 116.720 -0.823 2.145 857 HB2 ARG 116 HB2 ARG 116 118.454 -1.136 0.385 858 HB3 ARG 116 HB3 ARG 116 119.119 -2.477 1.315 859 HG2 ARG 116 HG2 ARG 116 116.940 -3.647 1.163 860 HG3 ARG 116 HG3 ARG 116 116.309 -2.318 0.186 861 HD2 ARG 116 HD2 ARG 116 118.135 -2.714 -1.464 862 HD3 ARG 116 HD3 ARG 116 118.652 -4.107 -0.519 863 HE ARG 116 HE ARG 116 116.107 -4.744 -0.953 864 HH11 ARG 116 HH11 ARG 116 118.461 -3.466 -3.226 865 HH12 ARG 116 HH12 ARG 116 117.708 -4.232 -4.584 866 HH21 ARG 116 HH21 ARG 116 115.189 -5.707 -2.742 867 HH22 ARG 116 HH22 ARG 116 115.883 -5.483 -4.314 868 H ALA 117 H ALA 117 115.464 -2.460 3.001 869 HA ALA 117 HA ALA 117 116.491 -3.721 5.410 870 HB1 ALA 117 HB1 ALA 117 114.189 -4.324 5.833 871 HB2 ALA 117 HB2 ALA 117 113.733 -3.891 4.184 872 HB3 ALA 117 HB3 ALA 117 114.241 -2.638 5.318 873 H LYS 118 H LYS 118 116.972 -5.822 5.663 874 HA LYS 118 HA LYS 118 116.612 -7.625 3.367 875 HB2 LYS 118 HB2 LYS 118 118.282 -9.033 4.391 876 HB3 LYS 118 HB3 LYS 118 118.886 -7.380 4.359 877 HG2 LYS 118 HG2 LYS 118 118.140 -7.113 6.735 878 HG3 LYS 118 HG3 LYS 118 117.688 -8.819 6.746 879 HD2 LYS 118 HD2 LYS 118 120.080 -9.326 6.025 880 HD3 LYS 118 HD3 LYS 118 120.452 -7.641 6.397 881 HE2 LYS 118 HE2 LYS 118 120.957 -8.699 8.420 882 HE3 LYS 118 HE3 LYS 118 119.296 -8.171 8.690 883 HZ1 LYS 118 HZ1 LYS 118 119.050 -10.597 7.464 884 HZ2 LYS 118 HZ2 LYS 118 118.854 -10.288 9.123 885 HZ3 LYS 118 HZ3 LYS 118 120.354 -10.819 8.527 886 H GLY 119 H GLY 119 115.438 -9.518 3.503 887 HA2 GLY 119 HA2 GLY 119 113.557 -9.609 5.771 888 HA3 GLY 119 HA3 GLY 119 113.273 -10.297 4.186 889 H SER 120 H SER 120 112.816 -11.830 6.418 890 HA SER 120 HA SER 120 114.927 -13.443 7.307 891 HB2 SER 120 HB2 SER 120 112.053 -14.277 6.852 892 HB3 SER 120 HB3 SER 120 113.219 -15.072 7.904 893 HG SER 120 HG SER 120 113.171 -13.298 9.182 894 H GLY 121 H GLY 121 112.891 -13.695 4.420 895 HA2 GLY 121 HA2 GLY 121 114.896 -15.506 3.251 896 HA3 GLY 121 HA3 GLY 121 113.197 -15.970 3.206 897 H GLY 122 H GLY 122 114.599 -15.685 0.855 898 HA2 GLY 122 HA2 GLY 122 114.185 -14.792 -1.241 899 HA3 GLY 122 HA3 GLY 122 113.015 -13.705 -0.506 900 H GLY 123 H GLY 123 116.328 -13.864 0.649 901 HA2 GLY 123 HA2 GLY 123 118.072 -12.370 0.561 902 HA3 GLY 123 HA3 GLY 123 117.468 -11.898 -1.023 903 H TYR 124 H TYR 124 117.080 -9.796 -1.154 904 HA TYR 124 HA TYR 124 116.309 -8.326 1.293 905 HB2 TYR 124 HB2 TYR 124 117.828 -7.541 -1.174 906 HB3 TYR 124 HB3 TYR 124 117.093 -6.336 -0.133 907 HD1 TYR 124 HD1 TYR 124 118.906 -9.537 0.602 908 HD2 TYR 124 HD2 TYR 124 118.770 -5.271 1.080 909 HE1 TYR 124 HE1 TYR 124 120.892 -9.640 2.085 910 HE2 TYR 124 HE2 TYR 124 120.752 -5.374 2.567 911 HH TYR 124 HH TYR 124 122.561 -8.265 2.986 912 H ILE 125 H ILE 125 114.877 -6.486 1.014 913 HA ILE 125 HA ILE 125 112.532 -7.316 -0.446 914 HB ILE 125 HB ILE 125 113.087 -4.939 1.351 915 HG12 ILE 125 HG12 ILE 125 111.402 -7.359 1.972 916 HG13 ILE 125 HG13 ILE 125 113.143 -7.400 2.228 917 HG21 ILE 125 HG21 ILE 125 110.393 -6.023 0.492 918 HG22 ILE 125 HG22 ILE 125 111.157 -4.638 -0.286 919 HG23 ILE 125 HG23 ILE 125 110.721 -4.558 1.418 920 HD11 ILE 125 HD11 ILE 125 113.070 -5.869 3.947 921 HD12 ILE 125 HD12 ILE 125 111.486 -6.614 4.151 922 HD13 ILE 125 HD13 ILE 125 111.629 -5.064 3.322 923 H SER 126 H SER 126 111.801 -6.551 -2.324 924 HA SER 126 HA SER 126 113.534 -5.234 -4.095 925 HB2 SER 126 HB2 SER 126 110.538 -5.580 -4.284 926 HB3 SER 126 HB3 SER 126 111.610 -5.158 -5.613 927 HG SER 126 HG SER 126 111.330 -7.536 -4.263 928 H LEU 127 H LEU 127 113.832 -3.207 -4.706 929 HA LEU 127 HA LEU 127 112.308 -1.061 -3.413 930 HB2 LEU 127 HB2 LEU 127 114.695 -0.876 -5.261 931 HB3 LEU 127 HB3 LEU 127 114.005 0.431 -4.307 932 HG LEU 127 HG LEU 127 115.229 -2.100 -3.168 933 HD11 LEU 127 HD11 LEU 127 117.005 -0.768 -4.043 934 HD12 LEU 127 HD12 LEU 127 116.943 -0.397 -2.319 935 HD13 LEU 127 HD13 LEU 127 116.251 0.728 -3.490 936 HD21 LEU 127 HD21 LEU 127 115.130 -0.560 -1.060 937 HD22 LEU 127 HD22 LEU 127 113.656 -1.377 -1.577 938 HD23 LEU 127 HD23 LEU 127 113.903 0.325 -1.966 939 H GLY 128 H GLY 128 111.647 -2.886 -6.019 940 HA2 GLY 128 HA2 GLY 128 111.589 -1.343 -8.286 941 HA3 GLY 128 HA3 GLY 128 110.386 -2.571 -7.923 942 H ALA 129 H ALA 129 109.109 -1.356 -5.711 943 HA ALA 129 HA ALA 129 107.210 0.212 -7.067 944 HB1 ALA 129 HB1 ALA 129 106.428 0.799 -4.719 945 HB2 ALA 129 HB2 ALA 129 107.783 -0.161 -4.126 946 HB3 ALA 129 HB3 ALA 129 106.518 -0.923 -5.090 947 H LEU 130 H LEU 130 109.810 1.182 -4.837 948 HA LEU 130 HA LEU 130 109.228 3.933 -4.800 949 HB2 LEU 130 HB2 LEU 130 110.766 2.773 -3.227 950 HB3 LEU 130 HB3 LEU 130 111.934 2.600 -4.538 951 HG LEU 130 HG LEU 130 111.887 5.107 -4.805 952 HD11 LEU 130 HD11 LEU 130 110.114 4.790 -2.387 953 HD12 LEU 130 HD12 LEU 130 109.852 5.781 -3.822 954 HD13 LEU 130 HD13 LEU 130 111.056 6.261 -2.627 955 HD21 LEU 130 HD21 LEU 130 112.643 4.433 -1.972 956 HD22 LEU 130 HD22 LEU 130 113.512 5.415 -3.149 957 HD23 LEU 130 HD23 LEU 130 113.496 3.661 -3.308 958 H LEU 131 H LEU 131 111.303 2.010 -6.942 959 HA LEU 131 HA LEU 131 112.434 4.147 -8.381 960 HB2 LEU 131 HB2 LEU 131 113.240 1.798 -8.483 961 HB3 LEU 131 HB3 LEU 131 111.792 1.362 -9.388 962 HG LEU 131 HG LEU 131 112.454 3.122 -11.093 963 HD11 LEU 131 HD11 LEU 131 115.023 3.548 -10.989 964 HD12 LEU 131 HD12 LEU 131 114.855 3.166 -9.276 965 HD13 LEU 131 HD13 LEU 131 113.969 4.525 -9.967 966 HD21 LEU 131 HD21 LEU 131 114.138 0.685 -10.516 967 HD22 LEU 131 HD22 LEU 131 114.425 1.674 -11.948 968 HD23 LEU 131 HD23 LEU 131 112.867 0.879 -11.722 969 H SER 132 H SER 132 109.444 2.310 -8.907 970 HA SER 132 HA SER 132 108.788 3.363 -11.421 971 HB2 SER 132 HB2 SER 132 107.661 1.413 -10.316 972 HB3 SER 132 HB3 SER 132 106.844 2.550 -9.250 973 HG SER 132 HG SER 132 105.499 2.562 -10.869 974 H THR 133 H THR 133 108.012 4.523 -8.154 975 HA THR 133 HA THR 133 106.264 6.593 -8.924 976 HB THR 133 HB THR 133 108.124 6.572 -6.534 977 HG1 THR 133 HG1 THR 133 105.510 5.652 -6.669 978 HG21 THR 133 HG21 THR 133 105.414 7.871 -6.909 979 HG22 THR 133 HG22 THR 133 106.945 8.726 -7.105 980 HG23 THR 133 HG23 THR 133 106.503 8.055 -5.535 981 H THR 134 H THR 134 109.779 6.629 -8.341 982 HA THR 134 HA THR 134 110.106 9.402 -8.784 983 HB THR 134 HB THR 134 112.189 7.274 -9.301 984 HG1 THR 134 HG1 THR 134 111.781 6.919 -7.277 985 HG21 THR 134 HG21 THR 134 112.315 10.196 -8.487 986 HG22 THR 134 HG22 THR 134 112.813 9.519 -10.038 987 HG23 THR 134 HG23 THR 134 113.708 9.116 -8.573 988 H LEU 135 H LEU 135 110.260 6.638 -11.007 989 HA LEU 135 HA LEU 135 111.180 8.034 -13.267 990 HB2 LEU 135 HB2 LEU 135 109.423 5.581 -13.059 991 HB3 LEU 135 HB3 LEU 135 110.130 6.167 -14.564 992 HG LEU 135 HG LEU 135 111.773 5.506 -12.106 993 HD11 LEU 135 HD11 LEU 135 112.416 3.476 -13.559 994 HD12 LEU 135 HD12 LEU 135 110.952 3.822 -14.478 995 HD13 LEU 135 HD13 LEU 135 110.843 3.420 -12.764 996 HD21 LEU 135 HD21 LEU 135 113.059 6.910 -13.476 997 HD22 LEU 135 HD22 LEU 135 112.340 6.281 -14.959 998 HD23 LEU 135 HD23 LEU 135 113.507 5.308 -14.062 999 H ASN 136 H ASN 136 107.903 7.558 -12.000 1000 HA ASN 136 HA ASN 136 106.460 8.592 -14.167 1001 HB2 ASN 136 HB2 ASN 136 105.529 7.465 -12.093 1002 HB3 ASN 136 HB3 ASN 136 105.747 9.003 -11.259 1003 HD21 ASN 136 HD21 ASN 136 103.901 10.280 -11.286 1004 HD22 ASN 136 HD22 ASN 136 102.721 10.263 -12.506 1005 H LEU 137 H LEU 137 107.865 10.228 -11.350 1006 HA LEU 137 HA LEU 137 107.099 12.854 -12.073 1007 HB2 LEU 137 HB2 LEU 137 109.511 11.943 -10.485 1008 HB3 LEU 137 HB3 LEU 137 108.877 13.589 -10.532 1009 HG LEU 137 HG LEU 137 107.283 11.175 -9.624 1010 HD11 LEU 137 HD11 LEU 137 108.942 13.207 -8.140 1011 HD12 LEU 137 HD12 LEU 137 108.894 11.457 -7.930 1012 HD13 LEU 137 HD13 LEU 137 107.551 12.450 -7.365 1013 HD21 LEU 137 HD21 LEU 137 105.817 12.905 -10.420 1014 HD22 LEU 137 HD22 LEU 137 106.778 14.164 -9.643 1015 HD23 LEU 137 HD23 LEU 137 105.833 13.042 -8.665 1016 H CYS 138 H CYS 138 109.964 10.944 -12.895 1017 HA CYS 138 HA CYS 138 111.421 12.924 -14.233 1018 HB2 CYS 138 HB2 CYS 138 111.300 9.942 -14.389 1019 HB3 CYS 138 HB3 CYS 138 112.199 10.813 -15.625 1020 H GLY 139 H GLY 139 108.545 11.208 -15.255 1021 HA2 GLY 139 HA2 GLY 139 107.142 11.844 -17.021 1022 HA3 GLY 139 HA3 GLY 139 108.433 12.851 -17.659 1023 H LYS 140 H LYS 140 109.174 9.540 -16.844 1024 HA LYS 140 HA LYS 140 109.423 8.933 -19.721 1025 HB2 LYS 140 HB2 LYS 140 110.651 7.505 -17.350 1026 HB3 LYS 140 HB3 LYS 140 110.984 7.187 -19.051 1027 HG2 LYS 140 HG2 LYS 140 111.512 9.825 -17.651 1028 HG3 LYS 140 HG3 LYS 140 112.737 8.603 -17.991 1029 HD2 LYS 140 HD2 LYS 140 112.141 8.792 -20.431 1030 HD3 LYS 140 HD3 LYS 140 111.100 10.154 -20.015 1031 HE2 LYS 140 HE2 LYS 140 113.117 11.242 -18.939 1032 HE3 LYS 140 HE3 LYS 140 114.098 9.960 -19.650 1033 HZ1 LYS 140 HZ1 LYS 140 113.676 10.691 -21.775 1034 HZ2 LYS 140 HZ2 LYS 140 113.761 12.161 -20.929 1035 HZ3 LYS 140 HZ3 LYS 140 112.250 11.504 -21.343 1036 H GLY 141 H GLY 141 108.539 7.075 -20.599 1037 HA2 GLY 141 HA2 GLY 141 107.394 4.915 -19.317 1038 HA3 GLY 141 HA3 GLY 141 106.123 6.130 -19.399 Start of MODEL 8 1 H1 HIS -5 HT1 HIS -5 105.605 24.027 45.384 2 H2 HIS -5 HT2 HIS -5 106.744 24.118 46.643 3 H3 HIS -5 HT3 HIS -5 106.953 25.047 45.237 4 HA HIS -5 HA HIS -5 104.715 25.356 47.162 5 HB2 HIS -5 HB2 HIS -5 106.949 26.010 48.053 6 HB3 HIS -5 HB3 HIS -5 107.148 27.092 46.688 7 HD1 HIS -5 HD1 HIS -5 104.564 26.551 49.455 8 HD2 HIS -5 HD2 HIS -5 106.373 29.648 47.331 9 HE1 HIS -5 HE1 HIS -5 103.657 28.707 50.423 10 H HIS -4 H HIS -4 103.076 26.560 46.393 11 HA HIS -4 HA HIS -4 103.483 28.082 43.884 12 HB2 HIS -4 HB2 HIS -4 102.315 25.939 43.456 13 HB3 HIS -4 HB3 HIS -4 101.076 26.404 44.607 14 HD1 HIS -4 HD1 HIS -4 102.635 27.865 41.437 15 HD2 HIS -4 HD2 HIS -4 98.942 27.604 43.353 16 HE1 HIS -4 HE1 HIS -4 100.955 28.975 39.904 17 H HIS -3 H HIS -3 102.312 29.979 43.680 18 HA HIS -3 HA HIS -3 101.013 30.944 46.162 19 HB2 HIS -3 HB2 HIS -3 102.470 32.468 44.000 20 HB3 HIS -3 HB3 HIS -3 101.618 33.209 45.341 21 HD1 HIS -3 HD1 HIS -3 104.761 31.408 44.450 22 HD2 HIS -3 HD2 HIS -3 102.946 32.945 47.875 23 HE1 HIS -3 HE1 HIS -3 106.535 31.419 46.256 24 H HIS -2 H HIS -2 99.033 31.915 46.042 25 HA HIS -2 HA HIS -2 97.656 31.775 43.424 26 HB2 HIS -2 HB2 HIS -2 96.532 31.650 46.225 27 HB3 HIS -2 HB3 HIS -2 95.580 31.628 44.754 28 HD1 HIS -2 HD1 HIS -2 96.168 29.502 43.103 29 HD2 HIS -2 HD2 HIS -2 97.279 29.151 47.106 30 HE1 HIS -2 HE1 HIS -2 96.544 27.036 43.528 31 H HIS -1 H HIS -1 96.630 33.544 42.636 32 HA HIS -1 HA HIS -1 96.595 35.994 44.295 33 HB2 HIS -1 HB2 HIS -1 97.360 35.819 41.379 34 HB3 HIS -1 HB3 HIS -1 97.229 37.291 42.321 35 HD1 HIS -1 HD1 HIS -1 98.951 37.330 44.493 36 HD2 HIS -1 HD2 HIS -1 99.896 34.761 41.348 37 HE1 HIS -1 HE1 HIS -1 101.405 36.761 44.748 38 H HIS 0 H HIS 0 95.114 37.667 43.376 39 HA HIS 0 HA HIS 0 92.700 36.376 42.243 40 HB2 HIS 0 HB2 HIS 0 92.980 38.813 44.004 41 HB3 HIS 0 HB3 HIS 0 91.472 38.260 43.300 42 HD1 HIS 0 HD1 HIS 0 93.939 37.517 46.008 43 HD2 HIS 0 HD2 HIS 0 90.383 35.915 44.535 44 HE1 HIS 0 HE1 HIS 0 93.143 35.840 47.729 45 H SER 1 H SER 1 91.784 37.191 40.433 46 HA SER 1 HA SER 1 93.310 38.821 38.701 47 HB2 SER 1 HB2 SER 1 90.358 38.158 38.574 48 HB3 SER 1 HB3 SER 1 91.332 38.791 37.252 49 HG SER 1 HG SER 1 91.927 36.431 38.609 50 H SER 2 H SER 2 92.834 40.920 37.882 51 HA SER 2 HA SER 2 91.321 42.650 39.758 52 HB2 SER 2 HB2 SER 2 93.825 43.334 38.196 53 HB3 SER 2 HB3 SER 2 92.932 44.429 39.247 54 HG SER 2 HG SER 2 94.712 42.565 39.887 55 H GLY 3 H GLY 3 90.141 44.360 38.858 56 HA2 GLY 3 HA2 GLY 3 88.862 43.863 36.412 57 HA3 GLY 3 HA3 GLY 3 88.810 45.391 37.287 58 H LEU 4 H LEU 4 89.178 44.572 34.350 59 HA LEU 4 HA LEU 4 91.763 45.855 33.791 60 HB2 LEU 4 HB2 LEU 4 89.836 44.478 31.905 61 HB3 LEU 4 HB3 LEU 4 91.451 45.056 31.503 62 HG LEU 4 HG LEU 4 90.846 42.953 33.603 63 HD11 LEU 4 HD11 LEU 4 90.380 42.127 31.335 64 HD12 LEU 4 HD12 LEU 4 91.852 41.386 31.964 65 HD13 LEU 4 HD13 LEU 4 91.957 42.699 30.792 66 HD21 LEU 4 HD21 LEU 4 93.367 44.217 32.530 67 HD22 LEU 4 HD22 LEU 4 93.396 42.599 33.230 68 HD23 LEU 4 HD23 LEU 4 92.888 43.975 34.210 69 H VAL 5 H VAL 5 91.951 47.771 32.721 70 HA VAL 5 HA VAL 5 89.762 49.590 32.799 71 HB VAL 5 HB VAL 5 91.316 51.145 31.660 72 HG11 VAL 5 HG11 VAL 5 92.871 51.302 33.463 73 HG12 VAL 5 HG12 VAL 5 92.798 49.567 33.772 74 HG13 VAL 5 HG13 VAL 5 91.413 50.589 34.155 75 HG21 VAL 5 HG21 VAL 5 92.366 49.409 30.190 76 HG22 VAL 5 HG22 VAL 5 93.200 48.766 31.605 77 HG23 VAL 5 HG23 VAL 5 93.553 50.398 31.041 78 HA PRO 6 HA PRO 6 87.852 48.851 28.896 79 HB2 PRO 6 HB2 PRO 6 87.263 51.390 27.992 80 HB3 PRO 6 HB3 PRO 6 86.326 50.530 29.228 81 HG2 PRO 6 HG2 PRO 6 88.397 52.636 29.554 82 HG3 PRO 6 HG3 PRO 6 86.884 52.386 30.445 83 HD2 PRO 6 HD2 PRO 6 89.291 51.676 31.477 84 HD3 PRO 6 HD3 PRO 6 87.801 50.780 31.841 85 H ARG 7 H ARG 7 89.121 48.065 27.316 86 HA ARG 7 HA ARG 7 90.912 49.934 25.870 87 HB2 ARG 7 HB2 ARG 7 91.350 47.001 26.482 88 HB3 ARG 7 HB3 ARG 7 92.384 47.983 25.444 89 HG2 ARG 7 HG2 ARG 7 92.820 49.514 27.339 90 HG3 ARG 7 HG3 ARG 7 91.817 48.502 28.377 91 HD2 ARG 7 HD2 ARG 7 94.107 47.856 28.751 92 HD3 ARG 7 HD3 ARG 7 93.339 46.569 27.826 93 HE ARG 7 HE ARG 7 94.391 48.076 25.868 94 HH11 ARG 7 HH11 ARG 7 95.843 46.910 28.845 95 HH12 ARG 7 HH12 ARG 7 97.434 46.857 28.164 96 HH21 ARG 7 HH21 ARG 7 96.462 47.985 25.046 97 HH22 ARG 7 HH22 ARG 7 97.779 47.458 26.041 98 H GLY 8 H GLY 8 91.148 49.563 23.619 99 HA2 GLY 8 HA2 GLY 8 88.727 48.584 22.364 100 HA3 GLY 8 HA3 GLY 8 90.087 49.360 21.556 101 H SER 9 H SER 9 89.329 47.440 20.085 102 HA SER 9 HA SER 9 90.916 45.033 20.784 103 HB2 SER 9 HB2 SER 9 88.465 44.629 20.627 104 HB3 SER 9 HB3 SER 9 88.501 45.213 18.967 105 HG SER 9 HG SER 9 88.825 43.086 18.810 106 H GLY 10 H GLY 10 92.308 44.213 19.272 107 HA2 GLY 10 HA2 GLY 10 92.430 45.442 16.613 108 HA3 GLY 10 HA3 GLY 10 93.851 45.596 17.644 109 H MET 11 H MET 11 94.431 44.375 15.427 110 HA MET 11 HA MET 11 94.439 41.476 16.058 111 HB2 MET 11 HB2 MET 11 94.323 42.826 13.350 112 HB3 MET 11 HB3 MET 11 94.555 41.095 13.601 113 HG2 MET 11 HG2 MET 11 92.401 41.018 14.850 114 HG3 MET 11 HG3 MET 11 92.156 42.726 14.483 115 HE1 MET 11 HE1 MET 11 89.546 41.393 12.145 116 HE2 MET 11 HE2 MET 11 89.968 42.220 13.641 117 HE3 MET 11 HE3 MET 11 89.958 40.459 13.587 118 H LYS 12 H LYS 12 96.346 40.352 15.665 119 HA LYS 12 HA LYS 12 98.701 41.927 14.863 120 HB2 LYS 12 HB2 LYS 12 100.002 41.101 16.720 121 HB3 LYS 12 HB3 LYS 12 98.557 41.886 17.346 122 HG2 LYS 12 HG2 LYS 12 97.477 39.635 17.537 123 HG3 LYS 12 HG3 LYS 12 99.002 38.901 17.041 124 HD2 LYS 12 HD2 LYS 12 100.088 40.154 18.979 125 HD3 LYS 12 HD3 LYS 12 98.455 40.518 19.538 126 HE2 LYS 12 HE2 LYS 12 97.967 38.051 19.503 127 HE3 LYS 12 HE3 LYS 12 99.671 37.770 19.147 128 HZ1 LYS 12 HZ1 LYS 12 99.930 39.348 21.230 129 HZ2 LYS 12 HZ2 LYS 12 99.747 37.667 21.393 130 HZ3 LYS 12 HZ3 LYS 12 98.412 38.694 21.614 131 H GLU 13 H GLU 13 100.548 40.608 14.236 132 HA GLU 13 HA GLU 13 99.676 38.043 13.050 133 HB2 GLU 13 HB2 GLU 13 101.953 39.884 12.281 134 HB3 GLU 13 HB3 GLU 13 101.550 38.369 11.475 135 HG2 GLU 13 HG2 GLU 13 99.696 40.753 11.738 136 HG3 GLU 13 HG3 GLU 13 100.598 40.327 10.289 137 H THR 14 H THR 14 100.931 36.202 13.281 138 HA THR 14 HA THR 14 103.293 36.358 15.023 139 HB THR 14 HB THR 14 101.360 35.868 16.474 140 HG1 THR 14 HG1 THR 14 103.339 34.918 16.917 141 HG21 THR 14 HG21 THR 14 101.055 33.408 14.729 142 HG22 THR 14 HG22 THR 14 99.921 34.755 14.821 143 HG23 THR 14 HG23 THR 14 100.173 33.717 16.225 144 H ALA 15 H ALA 15 104.625 34.420 14.958 145 HA ALA 15 HA ALA 15 104.107 32.595 12.721 146 HB1 ALA 15 HB1 ALA 15 106.622 34.257 12.999 147 HB2 ALA 15 HB2 ALA 15 105.426 34.376 11.709 148 HB3 ALA 15 HB3 ALA 15 106.416 32.924 11.863 149 H ALA 16 H ALA 16 105.251 30.623 12.858 150 HA ALA 16 HA ALA 16 105.794 29.756 15.527 151 HB1 ALA 16 HB1 ALA 16 106.587 27.648 14.274 152 HB2 ALA 16 HB2 ALA 16 106.035 28.470 12.813 153 HB3 ALA 16 HB3 ALA 16 104.892 28.106 14.106 154 H ALA 17 H ALA 17 107.705 29.385 16.549 155 HA ALA 17 HA ALA 17 110.033 30.765 15.632 156 HB1 ALA 17 HB1 ALA 17 109.463 30.477 18.034 157 HB2 ALA 17 HB2 ALA 17 111.089 29.908 17.653 158 HB3 ALA 17 HB3 ALA 17 109.778 28.749 17.878 159 H LYS 18 H LYS 18 111.971 29.953 14.862 160 HA LYS 18 HA LYS 18 111.809 27.481 13.391 161 HB2 LYS 18 HB2 LYS 18 113.009 29.507 12.554 162 HB3 LYS 18 HB3 LYS 18 114.204 29.281 13.830 163 HG2 LYS 18 HG2 LYS 18 115.145 28.227 11.922 164 HG3 LYS 18 HG3 LYS 18 114.512 26.905 12.901 165 HD2 LYS 18 HD2 LYS 18 112.490 26.810 11.527 166 HD3 LYS 18 HD3 LYS 18 113.040 28.198 10.585 167 HE2 LYS 18 HE2 LYS 18 113.709 26.415 9.235 168 HE3 LYS 18 HE3 LYS 18 115.172 26.725 10.171 169 HZ1 LYS 18 HZ1 LYS 18 114.444 24.343 10.045 170 HZ2 LYS 18 HZ2 LYS 18 113.111 24.768 11.008 171 HZ3 LYS 18 HZ3 LYS 18 114.689 24.943 11.612 172 H PHE 19 H PHE 19 112.566 25.527 13.957 173 HA PHE 19 HA PHE 19 114.102 25.305 16.485 174 HB2 PHE 19 HB2 PHE 19 112.156 23.359 15.241 175 HB3 PHE 19 HB3 PHE 19 113.091 23.065 16.695 176 HD1 PHE 19 HD2 PHE 19 112.616 24.359 18.771 177 HD2 PHE 19 HD1 PHE 19 110.180 24.715 15.251 178 HE1 PHE 19 HE2 PHE 19 110.822 25.412 20.120 179 HE2 PHE 19 HE1 PHE 19 108.385 25.767 16.600 180 HZ PHE 19 HZ PHE 19 108.705 26.117 19.034 181 H GLU 20 H GLU 20 115.835 23.903 16.565 182 HA GLU 20 HA GLU 20 116.772 22.843 13.959 183 HB2 GLU 20 HB2 GLU 20 118.386 23.838 16.321 184 HB3 GLU 20 HB3 GLU 20 119.058 23.139 14.847 185 HG2 GLU 20 HG2 GLU 20 117.945 24.928 13.524 186 HG3 GLU 20 HG3 GLU 20 117.372 25.651 15.021 187 H ARG 21 H ARG 21 117.939 20.852 14.001 188 HA ARG 21 HA ARG 21 117.860 19.282 16.462 189 HB2 ARG 21 HB2 ARG 21 116.670 17.412 15.379 190 HB3 ARG 21 HB3 ARG 21 115.663 18.857 15.469 191 HG2 ARG 21 HG2 ARG 21 116.346 19.411 13.120 192 HG3 ARG 21 HG3 ARG 21 117.190 17.864 13.047 193 HD2 ARG 21 HD2 ARG 21 114.227 18.250 13.553 194 HD3 ARG 21 HD3 ARG 21 114.953 17.649 12.066 195 HE ARG 21 HE ARG 21 115.899 15.925 13.933 196 HH11 ARG 21 HH11 ARG 21 112.643 17.016 13.199 197 HH12 ARG 21 HH12 ARG 21 111.920 15.536 13.735 198 HH21 ARG 21 HH21 ARG 21 114.910 14.042 14.607 199 HH22 ARG 21 HH22 ARG 21 113.188 13.874 14.521 200 H GLN 22 H GLN 22 119.051 17.252 16.267 201 HA GLN 22 HA GLN 22 121.250 17.516 14.316 202 HB2 GLN 22 HB2 GLN 22 121.826 17.572 16.742 203 HB3 GLN 22 HB3 GLN 22 121.176 15.940 16.899 204 HG2 GLN 22 HG2 GLN 22 122.790 15.199 15.120 205 HG3 GLN 22 HG3 GLN 22 123.509 16.808 15.171 206 HE21 GLN 22 HE21 GLN 22 125.386 16.756 16.405 207 HE22 GLN 22 HE22 GLN 22 125.587 15.867 17.837 208 H HIS 23 H HIS 23 121.578 16.004 12.809 209 HA HIS 23 HA HIS 23 120.050 13.469 12.993 210 HB2 HIS 23 HB2 HIS 23 120.854 15.044 10.544 211 HB3 HIS 23 HB3 HIS 23 120.082 13.471 10.519 212 HD1 HIS 23 HD1 HIS 23 117.623 13.452 11.778 213 HD2 HIS 23 HD2 HIS 23 119.080 17.146 10.507 214 HE1 HIS 23 HE1 HIS 23 115.633 15.016 11.694 215 H MET 24 H MET 24 121.123 11.583 12.634 216 HA MET 24 HA MET 24 124.004 11.745 11.955 217 HB2 MET 24 HB2 MET 24 122.676 10.016 14.054 218 HB3 MET 24 HB3 MET 24 124.355 9.853 13.538 219 HG2 MET 24 HG2 MET 24 124.753 12.224 14.199 220 HG3 MET 24 HG3 MET 24 123.099 12.306 14.805 221 HE1 MET 24 HE1 MET 24 124.771 13.290 16.397 222 HE2 MET 24 HE2 MET 24 125.665 12.417 17.640 223 HE3 MET 24 HE3 MET 24 123.921 12.614 17.792 224 H ASP 25 H ASP 25 124.883 9.806 10.994 225 HA ASP 25 HA ASP 25 123.058 8.594 9.123 226 HB2 ASP 25 HB2 ASP 25 125.066 7.425 8.291 227 HB3 ASP 25 HB3 ASP 25 125.315 9.161 8.417 228 H SER 26 H SER 26 123.312 6.121 8.773 229 HA SER 26 HA SER 26 122.219 4.842 11.058 230 HB2 SER 26 HB2 SER 26 123.356 3.477 8.612 231 HB3 SER 26 HB3 SER 26 122.120 2.866 9.707 232 HG SER 26 HG SER 26 121.741 4.261 7.587 233 HA PRO 27 HA PRO 27 126.086 3.423 12.768 234 HB2 PRO 27 HB2 PRO 27 125.215 1.721 14.660 235 HB3 PRO 27 HB3 PRO 27 124.871 3.460 14.755 236 HG2 PRO 27 HG2 PRO 27 123.085 1.223 14.030 237 HG3 PRO 27 HG3 PRO 27 122.713 2.763 14.821 238 HD2 PRO 27 HD2 PRO 27 122.342 2.141 12.076 239 HD3 PRO 27 HD3 PRO 27 122.180 3.736 12.840 240 H ASP 28 H ASP 28 127.271 1.322 13.362 241 HA ASP 28 HA ASP 28 127.309 -0.436 11.123 242 HB2 ASP 28 HB2 ASP 28 128.597 -0.682 13.851 243 HB3 ASP 28 HB3 ASP 28 128.951 -1.724 12.477 244 H LEU 29 H LEU 29 126.692 -2.608 10.975 245 HA LEU 29 HA LEU 29 124.465 -3.325 12.741 246 HB2 LEU 29 HB2 LEU 29 124.187 -3.409 10.261 247 HB3 LEU 29 HB3 LEU 29 125.409 -4.680 10.204 248 HG LEU 29 HG LEU 29 123.973 -5.979 11.850 249 HD11 LEU 29 HD11 LEU 29 122.567 -4.297 12.769 250 HD12 LEU 29 HD12 LEU 29 121.509 -5.251 11.731 251 HD13 LEU 29 HD13 LEU 29 122.116 -3.692 11.176 252 HD21 LEU 29 HD21 LEU 29 122.552 -6.855 10.116 253 HD22 LEU 29 HD22 LEU 29 124.041 -6.326 9.333 254 HD23 LEU 29 HD23 LEU 29 122.591 -5.327 9.233 255 H GLY 30 H GLY 30 124.651 -4.790 14.300 256 HA2 GLY 30 HA2 GLY 30 127.152 -6.273 14.585 257 HA3 GLY 30 HA3 GLY 30 125.886 -6.116 15.799 258 H THR 31 H THR 31 126.516 -8.523 15.853 259 HA THR 31 HA THR 31 125.511 -10.224 13.777 260 HB THR 31 HB THR 31 126.108 -10.913 16.665 261 HG1 THR 31 HG1 THR 31 128.108 -10.951 16.058 262 HG21 THR 31 HG21 THR 31 125.807 -12.533 14.128 263 HG22 THR 31 HG22 THR 31 124.874 -12.680 15.618 264 HG23 THR 31 HG23 THR 31 126.569 -13.169 15.585 265 H ASP 32 H ASP 32 123.582 -11.320 13.658 266 HA ASP 32 HA ASP 32 121.289 -10.097 14.709 267 HB2 ASP 32 HB2 ASP 32 120.063 -12.015 13.834 268 HB3 ASP 32 HB3 ASP 32 121.286 -11.496 12.679 269 H ASP 33 H ASP 33 120.138 -10.350 16.527 270 HA ASP 33 HA ASP 33 121.275 -11.733 18.746 271 HB2 ASP 33 HB2 ASP 33 118.553 -10.463 18.384 272 HB3 ASP 33 HB3 ASP 33 119.194 -11.044 19.918 273 H ASP 34 H ASP 34 120.464 -13.518 19.886 274 HA ASP 34 HA ASP 34 119.565 -15.696 18.360 275 HB2 ASP 34 HB2 ASP 34 119.434 -15.246 21.350 276 HB3 ASP 34 HB3 ASP 34 119.169 -16.795 20.554 277 H ASP 35 H ASP 35 117.539 -16.875 18.551 278 HA ASP 35 HA ASP 35 115.293 -15.126 18.203 279 HB2 ASP 35 HB2 ASP 35 115.602 -17.232 16.918 280 HB3 ASP 35 HB3 ASP 35 115.342 -18.145 18.403 281 H LYS 36 H LYS 36 114.137 -14.284 19.790 282 HA LYS 36 HA LYS 36 114.073 -15.624 22.410 283 HB2 LYS 36 HB2 LYS 36 113.361 -12.798 21.588 284 HB3 LYS 36 HB3 LYS 36 113.222 -13.432 23.229 285 HG2 LYS 36 HG2 LYS 36 115.654 -13.982 23.184 286 HG3 LYS 36 HG3 LYS 36 115.767 -13.224 21.595 287 HD2 LYS 36 HD2 LYS 36 114.900 -11.103 22.591 288 HD3 LYS 36 HD3 LYS 36 114.942 -11.870 24.179 289 HE2 LYS 36 HE2 LYS 36 117.390 -12.316 23.827 290 HE3 LYS 36 HE3 LYS 36 117.302 -11.361 22.348 291 HZ1 LYS 36 HZ1 LYS 36 117.236 -10.501 25.117 292 HZ2 LYS 36 HZ2 LYS 36 116.146 -9.709 24.083 293 HZ3 LYS 36 HZ3 LYS 36 117.811 -9.692 23.742 294 H THR 37 H THR 37 111.945 -15.274 23.624 295 HA THR 37 HA THR 37 109.875 -16.640 22.276 296 HB THR 37 HB THR 37 109.638 -14.937 24.770 297 HG1 THR 37 HG1 THR 37 110.777 -16.439 25.616 298 HG21 THR 37 HG21 THR 37 107.501 -15.663 23.726 299 HG22 THR 37 HG22 THR 37 107.772 -16.430 25.291 300 HG23 THR 37 HG23 THR 37 108.054 -17.335 23.804 301 H GLY 38 H GLY 38 107.924 -15.942 21.422 302 HA2 GLY 38 HA2 GLY 38 107.978 -13.473 20.038 303 HA3 GLY 38 HA3 GLY 38 106.593 -14.554 20.157 304 H GLY 39 H GLY 39 106.203 -11.842 20.158 305 HA2 GLY 39 HA2 GLY 39 106.025 -10.847 22.879 306 HA3 GLY 39 HA3 GLY 39 105.528 -9.999 21.418 307 H GLY 40 H GLY 40 103.712 -9.488 22.990 308 HA2 GLY 40 HA2 GLY 40 101.792 -11.567 23.547 309 HA3 GLY 40 HA3 GLY 40 101.584 -9.842 23.839 310 H ARG 41 H ARG 41 99.386 -10.294 23.012 311 HA ARG 41 HA ARG 41 98.808 -11.175 20.422 312 HB2 ARG 41 HB2 ARG 41 97.141 -10.829 22.251 313 HB3 ARG 41 HB3 ARG 41 97.295 -9.090 22.014 314 HG2 ARG 41 HG2 ARG 41 95.400 -9.686 20.730 315 HG3 ARG 41 HG3 ARG 41 96.701 -9.557 19.546 316 HD2 ARG 41 HD2 ARG 41 97.039 -12.017 19.684 317 HD3 ARG 41 HD3 ARG 41 95.698 -12.119 20.818 318 HE ARG 41 HE ARG 41 94.204 -11.716 19.060 319 HH11 ARG 41 HH11 ARG 41 97.508 -11.430 17.896 320 HH12 ARG 41 HH12 ARG 41 97.024 -11.445 16.235 321 HH21 ARG 41 HH21 ARG 41 93.650 -11.729 16.904 322 HH22 ARG 41 HH22 ARG 41 94.871 -11.612 15.681 323 H ALA 42 H ALA 42 98.675 -10.189 18.452 324 HA ALA 42 HA ALA 42 100.370 -8.039 17.864 325 HB1 ALA 42 HB1 ALA 42 98.156 -9.405 16.359 326 HB2 ALA 42 HB2 ALA 42 99.893 -9.440 16.052 327 HB3 ALA 42 HB3 ALA 42 98.960 -7.990 15.679 328 H ASP 43 H ASP 43 99.957 -5.892 17.261 329 HA ASP 43 HA ASP 43 98.185 -4.454 18.877 330 HB2 ASP 43 HB2 ASP 43 98.668 -2.543 17.349 331 HB3 ASP 43 HB3 ASP 43 100.120 -3.383 17.892 332 HA PRO 44 HA PRO 44 94.342 -4.806 16.750 333 HB2 PRO 44 HB2 PRO 44 93.107 -2.434 17.258 334 HB3 PRO 44 HB3 PRO 44 93.352 -3.677 18.503 335 HG2 PRO 44 HG2 PRO 44 94.872 -1.172 18.008 336 HG3 PRO 44 HG3 PRO 44 94.413 -1.934 19.542 337 HD2 PRO 44 HD2 PRO 44 96.927 -2.132 18.451 338 HD3 PRO 44 HD3 PRO 44 96.230 -3.343 19.547 339 H ALA 45 H ALA 45 92.761 -3.135 15.383 340 HA ALA 45 HA ALA 45 94.029 -2.862 12.878 341 HB1 ALA 45 HB1 ALA 45 91.948 -1.699 12.201 342 HB2 ALA 45 HB2 ALA 45 91.447 -1.649 13.892 343 HB3 ALA 45 HB3 ALA 45 91.621 -3.199 13.069 344 H HIS 46 H HIS 46 94.570 -1.007 11.683 345 HA HIS 46 HA HIS 46 95.015 1.457 13.270 346 HB2 HIS 46 HB2 HIS 46 96.846 0.279 11.175 347 HB3 HIS 46 HB3 HIS 46 97.099 1.787 12.033 348 HD1 HIS 46 HD1 HIS 46 97.282 1.445 14.776 349 HD2 HIS 46 HD2 HIS 46 98.044 -1.881 12.379 350 HE1 HIS 46 HE1 HIS 46 98.554 -0.200 16.218 351 H ARG 47 H ARG 47 95.414 3.375 11.796 352 HA ARG 47 HA ARG 47 93.178 3.704 10.086 353 HB2 ARG 47 HB2 ARG 47 94.310 5.548 11.340 354 HB3 ARG 47 HB3 ARG 47 95.666 5.420 10.219 355 HG2 ARG 47 HG2 ARG 47 94.197 5.931 8.331 356 HG3 ARG 47 HG3 ARG 47 92.800 5.985 9.407 357 HD2 ARG 47 HD2 ARG 47 93.505 8.258 9.035 358 HD3 ARG 47 HD3 ARG 47 93.956 7.827 10.681 359 HE ARG 47 HE ARG 47 96.031 7.370 8.707 360 HH11 ARG 47 HH11 ARG 47 94.682 9.688 10.971 361 HH12 ARG 47 HH12 ARG 47 96.155 10.593 11.076 362 HH21 ARG 47 HH21 ARG 47 97.898 8.574 8.883 363 HH22 ARG 47 HH22 ARG 47 97.953 9.968 9.908 364 H SER 48 H SER 48 93.001 3.749 7.875 365 HA SER 48 HA SER 48 94.737 2.070 6.384 366 HB2 SER 48 HB2 SER 48 92.629 4.016 5.412 367 HB3 SER 48 HB3 SER 48 93.380 2.752 4.445 368 HG SER 48 HG SER 48 91.354 2.544 6.080 369 HA PRO 49 HA PRO 49 97.955 4.771 5.036 370 HB2 PRO 49 HB2 PRO 49 97.455 3.947 2.219 371 HB3 PRO 49 HB3 PRO 49 98.945 3.865 3.176 372 HG2 PRO 49 HG2 PRO 49 97.525 1.686 2.614 373 HG3 PRO 49 HG3 PRO 49 98.373 1.881 4.160 374 HD2 PRO 49 HD2 PRO 49 95.450 2.100 3.580 375 HD3 PRO 49 HD3 PRO 49 96.272 1.517 5.044 376 H VAL 50 H VAL 50 98.245 6.849 4.188 377 HA VAL 50 HA VAL 50 95.755 8.184 3.454 378 HB VAL 50 HB VAL 50 98.489 9.326 4.093 379 HG11 VAL 50 HG11 VAL 50 95.783 10.683 3.903 380 HG12 VAL 50 HG12 VAL 50 97.063 10.811 2.697 381 HG13 VAL 50 HG13 VAL 50 97.310 11.460 4.318 382 HG21 VAL 50 HG21 VAL 50 97.601 9.791 6.287 383 HG22 VAL 50 HG22 VAL 50 97.301 8.086 5.955 384 HG23 VAL 50 HG23 VAL 50 95.990 9.257 5.807 385 HA PRO 51 HA PRO 51 96.797 8.236 -0.920 386 HB2 PRO 51 HB2 PRO 51 95.854 11.068 -0.919 387 HB3 PRO 51 HB3 PRO 51 95.375 9.720 -1.969 388 HG2 PRO 51 HG2 PRO 51 93.787 10.599 -0.026 389 HG3 PRO 51 HG3 PRO 51 93.886 8.879 -0.445 390 HD2 PRO 51 HD2 PRO 51 95.009 10.299 1.923 391 HD3 PRO 51 HD3 PRO 51 94.432 8.626 1.778 392 H LEU 52 H LEU 52 98.275 9.343 -2.421 393 HA LEU 52 HA LEU 52 100.679 10.117 -1.152 394 HB2 LEU 52 HB2 LEU 52 99.709 10.122 -3.995 395 HB3 LEU 52 HB3 LEU 52 101.246 10.882 -3.587 396 HG LEU 52 HG LEU 52 100.553 8.049 -2.778 397 HD11 LEU 52 HD11 LEU 52 100.549 7.968 -5.151 398 HD12 LEU 52 HD12 LEU 52 102.192 7.507 -4.698 399 HD13 LEU 52 HD13 LEU 52 101.861 9.142 -5.272 400 HD21 LEU 52 HD21 LEU 52 102.338 8.865 -1.446 401 HD22 LEU 52 HD22 LEU 52 103.043 9.761 -2.793 402 HD23 LEU 52 HD23 LEU 52 103.143 8.001 -2.756 403 HA PRO 53 HA PRO 53 100.004 14.494 -0.742 404 HB2 PRO 53 HB2 PRO 53 102.529 15.504 -0.928 405 HB3 PRO 53 HB3 PRO 53 101.950 14.622 0.500 406 HG2 PRO 53 HG2 PRO 53 103.677 13.685 -1.726 407 HG3 PRO 53 HG3 PRO 53 103.756 13.312 0.005 408 HD2 PRO 53 HD2 PRO 53 102.676 11.610 -1.867 409 HD3 PRO 53 HD3 PRO 53 102.215 11.614 -0.152 410 H SER 54 H SER 54 99.786 16.387 -1.987 411 HA SER 54 HA SER 54 99.405 16.028 -4.708 412 HB2 SER 54 HB2 SER 54 99.156 18.480 -4.830 413 HB3 SER 54 HB3 SER 54 98.323 17.813 -3.430 414 HG SER 54 HG SER 54 99.723 18.800 -2.210 415 HA PRO 55 HA PRO 55 103.672 16.169 -5.847 416 HB2 PRO 55 HB2 PRO 55 103.531 15.955 -8.533 417 HB3 PRO 55 HB3 PRO 55 103.059 14.625 -7.457 418 HG2 PRO 55 HG2 PRO 55 101.363 16.512 -8.980 419 HG3 PRO 55 HG3 PRO 55 101.087 14.809 -8.578 420 HD2 PRO 55 HD2 PRO 55 99.966 17.004 -7.235 421 HD3 PRO 55 HD3 PRO 55 100.019 15.333 -6.635 422 H THR 56 H THR 56 104.860 17.990 -5.600 423 HA THR 56 HA THR 56 104.443 20.363 -7.191 424 HB THR 56 HB THR 56 106.559 21.126 -6.249 425 HG1 THR 56 HG1 THR 56 107.929 19.599 -5.971 426 HG21 THR 56 HG21 THR 56 105.109 19.585 -4.088 427 HG22 THR 56 HG22 THR 56 104.466 21.059 -4.812 428 HG23 THR 56 HG23 THR 56 105.988 21.106 -3.923 429 H SER 57 H SER 57 106.160 21.096 -8.797 430 HA SER 57 HA SER 57 106.211 19.227 -10.875 431 HB2 SER 57 HB2 SER 57 107.477 20.815 -12.105 432 HB3 SER 57 HB3 SER 57 106.462 21.761 -11.021 433 HG SER 57 HG SER 57 108.417 22.527 -10.631 434 H ASN 58 H ASN 58 107.392 17.496 -11.217 435 HA ASN 58 HA ASN 58 109.168 16.073 -11.385 436 HB2 ASN 58 HB2 ASN 58 110.813 18.509 -10.692 437 HB3 ASN 58 HB3 ASN 58 111.416 17.012 -11.402 438 HD21 ASN 58 HD21 ASN 58 109.433 16.477 -13.333 439 HD22 ASN 58 HD22 ASN 58 109.419 17.727 -14.481 440 H LYS 59 H LYS 59 107.972 16.866 -8.553 441 HA LYS 59 HA LYS 59 109.915 15.276 -7.062 442 HB2 LYS 59 HB2 LYS 59 109.174 18.092 -6.242 443 HB3 LYS 59 HB3 LYS 59 110.054 16.946 -5.234 444 HG2 LYS 59 HG2 LYS 59 111.804 16.795 -7.024 445 HG3 LYS 59 HG3 LYS 59 110.954 18.066 -7.903 446 HD2 LYS 59 HD2 LYS 59 111.183 19.550 -5.911 447 HD3 LYS 59 HD3 LYS 59 112.149 18.298 -5.129 448 HE2 LYS 59 HE2 LYS 59 113.934 18.561 -6.608 449 HE3 LYS 59 HE3 LYS 59 112.916 19.250 -7.872 450 HZ1 LYS 59 HZ1 LYS 59 114.136 20.535 -5.562 451 HZ2 LYS 59 HZ2 LYS 59 112.580 21.065 -5.990 452 HZ3 LYS 59 HZ3 LYS 59 113.848 21.146 -7.118 453 H GLN 60 H GLN 60 109.089 14.270 -5.244 454 HA GLN 60 HA GLN 60 106.521 15.133 -4.159 455 HB2 GLN 60 HB2 GLN 60 106.980 12.337 -5.207 456 HB3 GLN 60 HB3 GLN 60 105.710 12.742 -4.054 457 HG2 GLN 60 HG2 GLN 60 104.885 14.465 -5.697 458 HG3 GLN 60 HG3 GLN 60 106.048 13.821 -6.855 459 HE21 GLN 60 HE21 GLN 60 102.953 13.185 -5.264 460 HE22 GLN 60 HE22 GLN 60 102.617 11.763 -6.129 461 H ASP 61 H ASP 61 106.208 14.555 -2.000 462 HA ASP 61 HA ASP 61 108.547 13.450 -0.615 463 HB2 ASP 61 HB2 ASP 61 105.977 14.660 0.443 464 HB3 ASP 61 HB3 ASP 61 107.314 14.100 1.444 465 H ILE 62 H ILE 62 108.615 11.359 0.040 466 HA ILE 62 HA ILE 62 106.074 9.828 0.038 467 HB ILE 62 HB ILE 62 107.473 9.469 -2.008 468 HG12 ILE 62 HG12 ILE 62 107.535 6.886 -1.630 469 HG13 ILE 62 HG13 ILE 62 106.799 7.272 -0.074 470 HG21 ILE 62 HG21 ILE 62 109.500 8.026 -1.738 471 HG22 ILE 62 HG22 ILE 62 109.422 8.316 -0.001 472 HG23 ILE 62 HG23 ILE 62 109.707 9.659 -1.105 473 HD11 ILE 62 HD11 ILE 62 105.275 6.831 -2.192 474 HD12 ILE 62 HD12 ILE 62 105.652 8.513 -2.554 475 HD13 ILE 62 HD13 ILE 62 104.852 8.096 -1.039 476 H SER 63 H SER 63 105.897 8.150 1.591 477 HA SER 63 HA SER 63 108.038 7.931 3.562 478 HB2 SER 63 HB2 SER 63 106.749 8.732 5.422 479 HB3 SER 63 HB3 SER 63 106.727 9.975 4.176 480 HG SER 63 HG SER 63 104.712 8.491 5.165 481 H GLU 64 H GLU 64 107.630 6.357 5.224 482 HA GLU 64 HA GLU 64 106.677 3.931 4.288 483 HB2 GLU 64 HB2 GLU 64 106.858 3.156 6.615 484 HB3 GLU 64 HB3 GLU 64 108.248 4.136 6.154 485 HG2 GLU 64 HG2 GLU 64 107.175 6.109 7.212 486 HG3 GLU 64 HG3 GLU 64 105.855 5.080 7.750 487 H ALA 65 H ALA 65 104.959 6.464 6.052 488 HA ALA 65 HA ALA 65 102.788 4.948 6.976 489 HB1 ALA 65 HB1 ALA 65 103.204 7.847 6.352 490 HB2 ALA 65 HB2 ALA 65 102.867 7.072 7.901 491 HB3 ALA 65 HB3 ALA 65 101.577 7.268 6.713 492 H ASN 66 H ASN 66 103.260 6.639 3.884 493 HA ASN 66 HA ASN 66 100.597 6.172 2.960 494 HB2 ASN 66 HB2 ASN 66 103.028 6.731 1.252 495 HB3 ASN 66 HB3 ASN 66 101.336 7.012 0.848 496 HD21 ASN 66 HD21 ASN 66 100.211 8.773 2.037 497 HD22 ASN 66 HD22 ASN 66 101.112 10.032 2.733 498 H LEU 67 H LEU 67 103.722 4.597 2.297 499 HA LEU 67 HA LEU 67 102.597 2.752 0.424 500 HB2 LEU 67 HB2 LEU 67 105.261 2.985 1.786 501 HB3 LEU 67 HB3 LEU 67 104.865 1.563 0.820 502 HG LEU 67 HG LEU 67 104.149 3.224 -1.011 503 HD11 LEU 67 HD11 LEU 67 105.635 5.373 -0.728 504 HD12 LEU 67 HD12 LEU 67 105.482 5.016 0.989 505 HD13 LEU 67 HD13 LEU 67 104.039 5.307 0.018 506 HD21 LEU 67 HD21 LEU 67 106.240 3.046 -1.983 507 HD22 LEU 67 HD22 LEU 67 106.424 1.868 -0.686 508 HD23 LEU 67 HD23 LEU 67 107.091 3.489 -0.507 509 H ALA 68 H ALA 68 102.916 2.670 3.894 510 HA ALA 68 HA ALA 68 102.202 1.155 5.444 511 HB1 ALA 68 HB1 ALA 68 100.303 0.914 3.629 512 HB2 ALA 68 HB2 ALA 68 100.433 -0.261 4.938 513 HB3 ALA 68 HB3 ALA 68 101.062 -0.652 3.338 514 H TYR 69 H TYR 69 102.155 -1.870 4.764 515 HA TYR 69 HA TYR 69 104.749 -2.436 5.638 516 HB2 TYR 69 HB2 TYR 69 102.821 -4.194 4.125 517 HB3 TYR 69 HB3 TYR 69 104.256 -4.762 4.957 518 HD1 TYR 69 HD1 TYR 69 104.404 -4.531 7.464 519 HD2 TYR 69 HD2 TYR 69 100.790 -3.750 5.277 520 HE1 TYR 69 HE1 TYR 69 103.093 -4.725 9.561 521 HE2 TYR 69 HE2 TYR 69 99.479 -3.945 7.373 522 HH TYR 69 HH TYR 69 100.823 -3.887 10.370 523 H LEU 70 H LEU 70 103.658 -1.692 2.447 524 HA LEU 70 HA LEU 70 105.515 -3.106 0.875 525 HB2 LEU 70 HB2 LEU 70 104.282 -0.395 0.340 526 HB3 LEU 70 HB3 LEU 70 105.031 -1.446 -0.860 527 HG LEU 70 HG LEU 70 102.629 -2.203 0.830 528 HD11 LEU 70 HD11 LEU 70 101.975 -0.476 -0.727 529 HD12 LEU 70 HD12 LEU 70 101.427 -2.018 -1.384 530 HD13 LEU 70 HD13 LEU 70 102.873 -1.246 -2.035 531 HD21 LEU 70 HD21 LEU 70 103.823 -4.180 0.188 532 HD22 LEU 70 HD22 LEU 70 104.125 -3.551 -1.431 533 HD23 LEU 70 HD23 LEU 70 102.493 -4.024 -0.959 534 H TRP 71 H TRP 71 105.986 -0.323 2.905 535 HA TRP 71 HA TRP 71 108.037 1.029 1.616 536 HB2 TRP 71 HB2 TRP 71 106.777 1.647 3.727 537 HB3 TRP 71 HB3 TRP 71 107.882 0.593 4.585 538 HD1 TRP 71 HD1 TRP 71 109.880 1.770 5.570 539 HE1 TRP 71 HE1 TRP 71 111.146 3.963 5.110 540 HE3 TRP 71 HE3 TRP 71 107.397 3.380 1.411 541 HZ2 TRP 71 HZ2 TRP 71 111.139 6.111 3.213 542 HZ3 TRP 71 HZ3 TRP 71 108.049 5.494 0.296 543 HH2 TRP 71 HH2 TRP 71 109.912 6.858 1.191 544 HA PRO 72 HA PRO 72 110.964 -2.423 2.218 545 HB2 PRO 72 HB2 PRO 72 112.663 -1.954 0.206 546 HB3 PRO 72 HB3 PRO 72 110.996 -2.484 -0.111 547 HG2 PRO 72 HG2 PRO 72 112.195 0.216 -0.362 548 HG3 PRO 72 HG3 PRO 72 110.957 -0.571 -1.354 549 HD2 PRO 72 HD2 PRO 72 110.482 1.281 0.713 550 HD3 PRO 72 HD3 PRO 72 109.270 0.240 -0.062 551 H LEU 73 H LEU 73 111.694 0.925 2.566 552 HA LEU 73 HA LEU 73 114.532 0.476 3.135 553 HB2 LEU 73 HB2 LEU 73 112.945 3.049 3.232 554 HB3 LEU 73 HB3 LEU 73 114.699 2.889 3.284 555 HG LEU 73 HG LEU 73 112.940 2.041 0.964 556 HD11 LEU 73 HD11 LEU 73 114.813 4.402 1.306 557 HD12 LEU 73 HD12 LEU 73 113.052 4.485 1.272 558 HD13 LEU 73 HD13 LEU 73 113.945 3.992 -0.174 559 HD21 LEU 73 HD21 LEU 73 115.153 1.852 -0.207 560 HD22 LEU 73 HD22 LEU 73 114.965 0.683 1.096 561 HD23 LEU 73 HD23 LEU 73 115.955 2.123 1.341 562 H THR 74 H THR 74 115.489 0.730 5.081 563 HA THR 74 HA THR 74 113.987 0.416 7.475 564 HB THR 74 HB THR 74 116.148 0.643 8.609 565 HG1 THR 74 HG1 THR 74 117.823 1.426 7.551 566 HG21 THR 74 HG21 THR 74 117.376 -1.147 7.353 567 HG22 THR 74 HG22 THR 74 116.220 -0.952 6.034 568 HG23 THR 74 HG23 THR 74 115.670 -1.514 7.613 569 H VAL 75 H VAL 75 115.565 3.204 5.910 570 HA VAL 75 HA VAL 75 115.003 5.058 7.991 571 HB VAL 75 HB VAL 75 115.212 6.803 6.215 572 HG11 VAL 75 HG11 VAL 75 117.335 4.637 6.215 573 HG12 VAL 75 HG12 VAL 75 117.193 5.946 7.389 574 HG13 VAL 75 HG13 VAL 75 117.583 6.308 5.708 575 HG21 VAL 75 HG21 VAL 75 115.624 4.408 4.394 576 HG22 VAL 75 HG22 VAL 75 115.860 6.093 3.946 577 HG23 VAL 75 HG23 VAL 75 114.247 5.507 4.338 578 H ASP 76 H ASP 76 113.140 6.138 8.495 579 HA ASP 76 HA ASP 76 110.785 4.748 7.802 580 HB2 ASP 76 HB2 ASP 76 111.154 7.395 9.221 581 HB3 ASP 76 HB3 ASP 76 109.622 6.533 9.112 582 H HIS 77 H HIS 77 112.159 7.747 6.541 583 HA HIS 77 HA HIS 77 110.158 7.642 4.416 584 HB2 HIS 77 HB2 HIS 77 109.669 10.070 4.656 585 HB3 HIS 77 HB3 HIS 77 109.040 9.078 5.955 586 HD1 HIS 77 HD1 HIS 77 111.042 8.939 8.037 587 HD2 HIS 77 HD2 HIS 77 110.741 12.363 5.677 588 HE1 HIS 77 HE1 HIS 77 112.118 10.814 9.355 589 H GLY 78 H GLY 78 110.633 9.419 2.774 590 HA2 GLY 78 HA2 GLY 78 113.185 10.679 2.726 591 HA3 GLY 78 HA3 GLY 78 113.155 9.253 1.693 592 H THR 79 H THR 79 113.512 11.822 0.671 593 HA THR 79 HA THR 79 110.930 12.416 -0.650 594 HB THR 79 HB THR 79 113.375 14.185 -0.718 595 HG1 THR 79 HG1 THR 79 112.772 14.962 1.164 596 HG21 THR 79 HG21 THR 79 111.750 14.884 -2.280 597 HG22 THR 79 HG22 THR 79 111.377 15.858 -0.856 598 HG23 THR 79 HG23 THR 79 110.411 14.425 -1.224 599 H ILE 80 H ILE 80 110.772 12.317 -2.865 600 HA ILE 80 HA ILE 80 113.106 11.166 -4.280 601 HB ILE 80 HB ILE 80 111.451 10.215 -5.847 602 HG12 ILE 80 HG12 ILE 80 109.398 11.309 -3.892 603 HG13 ILE 80 HG13 ILE 80 109.699 11.966 -5.499 604 HG21 ILE 80 HG21 ILE 80 110.893 9.599 -2.927 605 HG22 ILE 80 HG22 ILE 80 112.214 8.924 -3.882 606 HG23 ILE 80 HG23 ILE 80 110.543 8.534 -4.290 607 HD11 ILE 80 HD11 ILE 80 107.900 10.541 -5.898 608 HD12 ILE 80 HD12 ILE 80 108.476 9.333 -4.744 609 HD13 ILE 80 HD13 ILE 80 109.280 9.514 -6.302 610 H GLU 81 H GLU 81 113.844 12.131 -6.125 611 HA GLU 81 HA GLU 81 112.336 14.400 -7.218 612 HB2 GLU 81 HB2 GLU 81 115.176 14.619 -6.196 613 HB3 GLU 81 HB3 GLU 81 114.309 15.874 -7.082 614 HG2 GLU 81 HG2 GLU 81 112.567 15.878 -5.298 615 HG3 GLU 81 HG3 GLU 81 113.519 14.706 -4.400 616 H CYS 82 H CYS 82 112.715 14.848 -9.317 617 HA CYS 82 HA CYS 82 114.673 13.167 -10.756 618 HB2 CYS 82 HB2 CYS 82 112.030 14.370 -11.491 619 HB3 CYS 82 HB3 CYS 82 113.230 14.113 -12.758 620 H LEU 83 H LEU 83 116.483 14.156 -11.381 621 HA LEU 83 HA LEU 83 116.724 17.035 -11.180 622 HB2 LEU 83 HB2 LEU 83 118.633 14.789 -11.787 623 HB3 LEU 83 HB3 LEU 83 119.108 16.473 -12.012 624 HG LEU 83 HG LEU 83 117.845 15.592 -9.428 625 HD11 LEU 83 HD11 LEU 83 119.624 14.064 -9.468 626 HD12 LEU 83 HD12 LEU 83 120.341 15.459 -8.664 627 HD13 LEU 83 HD13 LEU 83 120.671 15.159 -10.369 628 HD21 LEU 83 HD21 LEU 83 118.042 17.935 -9.553 629 HD22 LEU 83 HD22 LEU 83 119.582 17.851 -10.408 630 HD23 LEU 83 HD23 LEU 83 119.507 17.463 -8.690 631 HA PRO 84 HA PRO 84 116.028 18.233 -15.382 632 HB2 PRO 84 HB2 PRO 84 118.739 19.478 -15.418 633 HB3 PRO 84 HB3 PRO 84 117.164 20.184 -15.830 634 HG2 PRO 84 HG2 PRO 84 118.385 20.769 -13.546 635 HG3 PRO 84 HG3 PRO 84 116.623 20.599 -13.640 636 HD2 PRO 84 HD2 PRO 84 118.629 18.725 -12.469 637 HD3 PRO 84 HD3 PRO 84 116.946 19.028 -11.984 638 H SER 85 H SER 85 118.897 16.467 -14.533 639 HA SER 85 HA SER 85 119.769 16.000 -17.249 640 HB2 SER 85 HB2 SER 85 120.639 14.824 -14.608 641 HB3 SER 85 HB3 SER 85 121.385 14.438 -16.155 642 HG SER 85 HG SER 85 121.769 16.687 -16.335 643 H ASP 86 H ASP 86 117.128 14.794 -15.729 644 HA ASP 86 HA ASP 86 115.775 12.991 -16.075 645 HB2 ASP 86 HB2 ASP 86 116.622 13.255 -18.479 646 HB3 ASP 86 HB3 ASP 86 117.740 11.944 -18.107 647 H ASN 87 H ASN 87 117.800 12.989 -14.057 648 HA ASN 87 HA ASN 87 118.348 10.084 -13.830 649 HB2 ASN 87 HB2 ASN 87 119.715 12.439 -12.503 650 HB3 ASN 87 HB3 ASN 87 120.063 10.747 -12.154 651 HD21 ASN 87 HD21 ASN 87 122.004 12.627 -13.262 652 HD22 ASN 87 HD22 ASN 87 122.421 12.058 -14.807 653 H ALA 88 H ALA 88 117.237 9.009 -12.319 654 HA ALA 88 HA ALA 88 115.533 10.536 -10.481 655 HB1 ALA 88 HB1 ALA 88 114.724 8.063 -10.025 656 HB2 ALA 88 HB2 ALA 88 115.525 7.745 -11.564 657 HB3 ALA 88 HB3 ALA 88 114.210 8.918 -11.480 658 H VAL 89 H VAL 89 116.141 10.841 -8.429 659 HA VAL 89 HA VAL 89 117.927 8.842 -7.169 660 HB VAL 89 HB VAL 89 119.116 10.695 -6.043 661 HG11 VAL 89 HG11 VAL 89 120.134 11.635 -8.267 662 HG12 VAL 89 HG12 VAL 89 119.062 10.468 -9.040 663 HG13 VAL 89 HG13 VAL 89 120.295 9.918 -7.904 664 HG21 VAL 89 HG21 VAL 89 117.203 12.333 -6.286 665 HG22 VAL 89 HG22 VAL 89 117.639 12.492 -7.988 666 HG23 VAL 89 HG23 VAL 89 118.779 12.986 -6.735 667 H PHE 90 H PHE 90 117.839 8.750 -4.913 668 HA PHE 90 HA PHE 90 115.298 9.673 -3.712 669 HB2 PHE 90 HB2 PHE 90 115.441 7.251 -3.974 670 HB3 PHE 90 HB3 PHE 90 116.995 7.233 -3.172 671 HD1 PHE 90 HD1 PHE 90 113.371 7.953 -2.654 672 HD2 PHE 90 HD2 PHE 90 117.145 7.014 -0.833 673 HE1 PHE 90 HE1 PHE 90 112.231 7.585 -0.472 674 HE2 PHE 90 HE2 PHE 90 116.008 6.633 1.337 675 HZ PHE 90 HZ PHE 90 113.550 6.921 1.515 676 H VAL 91 H VAL 91 115.494 11.052 -2.030 677 HA VAL 91 HA VAL 91 118.132 11.349 -0.729 678 HB VAL 91 HB VAL 91 115.793 13.275 -0.839 679 HG11 VAL 91 HG11 VAL 91 117.055 14.806 0.356 680 HG12 VAL 91 HG12 VAL 91 118.589 14.048 -0.069 681 HG13 VAL 91 HG13 VAL 91 117.552 13.315 1.150 682 HG21 VAL 91 HG21 VAL 91 116.927 12.924 -3.028 683 HG22 VAL 91 HG22 VAL 91 118.460 13.370 -2.277 684 HG23 VAL 91 HG23 VAL 91 117.161 14.557 -2.403 685 H ALA 92 H ALA 92 118.317 10.805 1.377 686 HA ALA 92 HA ALA 92 115.849 10.028 2.811 687 HB1 ALA 92 HB1 ALA 92 117.589 9.034 4.438 688 HB2 ALA 92 HB2 ALA 92 118.766 9.344 3.161 689 HB3 ALA 92 HB3 ALA 92 117.409 8.256 2.866 690 HA PRO 93 HA PRO 93 115.817 13.445 5.623 691 HB2 PRO 93 HB2 PRO 93 116.081 11.520 7.889 692 HB3 PRO 93 HB3 PRO 93 114.885 12.802 7.629 693 HG2 PRO 93 HG2 PRO 93 114.320 10.208 7.266 694 HG3 PRO 93 HG3 PRO 93 113.569 11.498 6.314 695 HD2 PRO 93 HD2 PRO 93 115.590 9.507 5.475 696 HD3 PRO 93 HD3 PRO 93 114.429 10.429 4.499 697 H ASP 94 H ASP 94 118.303 11.007 5.931 698 HA ASP 94 HA ASP 94 119.948 12.338 7.815 699 HB2 ASP 94 HB2 ASP 94 121.729 10.815 6.949 700 HB3 ASP 94 HB3 ASP 94 120.253 9.999 7.445 701 H GLY 95 H GLY 95 119.296 13.164 4.568 702 HA2 GLY 95 HA2 GLY 95 120.108 15.089 3.475 703 HA3 GLY 95 HA3 GLY 95 121.474 15.117 4.585 704 H THR 96 H THR 96 121.000 12.003 3.341 705 HA THR 96 HA THR 96 123.291 12.316 1.529 706 HB THR 96 HB THR 96 122.009 9.818 2.671 707 HG1 THR 96 HG1 THR 96 123.105 10.382 4.332 708 HG21 THR 96 HG21 THR 96 124.342 10.351 0.870 709 HG22 THR 96 HG22 THR 96 123.166 9.036 0.828 710 HG23 THR 96 HG23 THR 96 124.459 9.026 2.028 711 H THR 97 H THR 97 123.107 11.863 -0.630 712 HA THR 97 HA THR 97 120.398 11.221 -1.624 713 HB THR 97 HB THR 97 122.770 12.341 -3.143 714 HG1 THR 97 HG1 THR 97 122.166 14.057 -2.143 715 HG21 THR 97 HG21 THR 97 121.073 12.859 -4.846 716 HG22 THR 97 HG22 THR 97 119.826 12.127 -3.835 717 HG23 THR 97 HG23 THR 97 121.110 11.127 -4.515 718 H TYR 98 H TYR 98 120.020 9.380 -2.637 719 HA TYR 98 HA TYR 98 122.277 7.592 -3.304 720 HB2 TYR 98 HB2 TYR 98 119.461 6.867 -2.492 721 HB3 TYR 98 HB3 TYR 98 120.744 5.735 -2.864 722 HD1 TYR 98 HD1 TYR 98 119.376 8.076 -0.380 723 HD2 TYR 98 HD2 TYR 98 122.549 5.316 -1.252 724 HE1 TYR 98 HE1 TYR 98 120.017 8.060 2.013 725 HE2 TYR 98 HE2 TYR 98 123.178 5.286 1.148 726 HH TYR 98 HH TYR 98 121.576 7.340 3.490 727 H ALA 99 H ALA 99 122.046 6.370 -5.258 728 HA ALA 99 HA ALA 99 120.383 7.677 -7.263 729 HB1 ALA 99 HB1 ALA 99 122.563 5.584 -7.388 730 HB2 ALA 99 HB2 ALA 99 122.589 7.231 -8.019 731 HB3 ALA 99 HB3 ALA 99 121.588 6.006 -8.797 732 H LEU 100 H LEU 100 118.447 6.942 -7.897 733 HA LEU 100 HA LEU 100 117.470 4.392 -6.894 734 HB2 LEU 100 HB2 LEU 100 116.215 6.639 -8.470 735 HB3 LEU 100 HB3 LEU 100 115.390 5.104 -8.222 736 HG LEU 100 HG LEU 100 116.521 6.636 -5.886 737 HD11 LEU 100 HD11 LEU 100 113.828 6.970 -7.238 738 HD12 LEU 100 HD12 LEU 100 115.064 8.210 -7.040 739 HD13 LEU 100 HD13 LEU 100 114.204 7.588 -5.631 740 HD21 LEU 100 HD21 LEU 100 115.699 4.194 -5.791 741 HD22 LEU 100 HD22 LEU 100 114.087 4.847 -6.075 742 HD23 LEU 100 HD23 LEU 100 114.982 5.309 -4.631 743 H ASN 101 H ASN 101 117.981 5.967 -10.039 744 HA ASN 101 HA ASN 101 117.698 3.327 -11.345 745 HB2 ASN 101 HB2 ASN 101 117.207 4.477 -13.376 746 HB3 ASN 101 HB3 ASN 101 116.218 5.179 -12.102 747 HD21 ASN 101 HD21 ASN 101 116.400 6.850 -14.156 748 HD22 ASN 101 HD22 ASN 101 117.553 8.073 -13.917 749 H ASP 102 H ASP 102 119.052 3.076 -13.374 750 HA ASP 102 HA ASP 102 121.662 2.672 -12.470 751 HB2 ASP 102 HB2 ASP 102 122.178 1.998 -14.751 752 HB3 ASP 102 HB3 ASP 102 120.608 1.366 -14.269 753 H ARG 103 H ARG 103 120.335 5.343 -14.394 754 HA ARG 103 HA ARG 103 122.834 6.344 -15.269 755 HB2 ARG 103 HB2 ARG 103 120.134 7.663 -14.986 756 HB3 ARG 103 HB3 ARG 103 121.532 8.445 -15.730 757 HG2 ARG 103 HG2 ARG 103 121.726 6.521 -17.306 758 HG3 ARG 103 HG3 ARG 103 120.252 5.843 -16.617 759 HD2 ARG 103 HD2 ARG 103 120.490 8.535 -17.990 760 HD3 ARG 103 HD3 ARG 103 119.755 7.089 -18.676 761 HE ARG 103 HE ARG 103 118.545 8.898 -16.811 762 HH11 ARG 103 HH11 ARG 103 118.591 5.517 -17.759 763 HH12 ARG 103 HH12 ARG 103 116.982 5.237 -17.180 764 HH21 ARG 103 HH21 ARG 103 116.509 8.489 -16.100 765 HH22 ARG 103 HH22 ARG 103 115.807 6.910 -16.246 766 H ALA 104 H ALA 104 120.807 7.213 -12.465 767 HA ALA 104 HA ALA 104 122.446 9.252 -11.449 768 HB1 ALA 104 HB1 ALA 104 120.300 8.999 -10.474 769 HB2 ALA 104 HB2 ALA 104 121.440 8.541 -9.207 770 HB3 ALA 104 HB3 ALA 104 120.580 7.295 -10.112 771 H GLU 105 H GLU 105 122.599 5.733 -11.032 772 HA GLU 105 HA GLU 105 124.710 5.679 -9.164 773 HB2 GLU 105 HB2 GLU 105 123.225 3.743 -9.883 774 HB3 GLU 105 HB3 GLU 105 124.248 3.611 -11.315 775 HG2 GLU 105 HG2 GLU 105 126.239 3.404 -9.830 776 HG3 GLU 105 HG3 GLU 105 125.166 3.433 -8.436 777 H LYS 106 H LYS 106 124.727 5.688 -12.721 778 HA LYS 106 HA LYS 106 127.493 5.523 -13.128 779 HB2 LYS 106 HB2 LYS 106 125.385 6.980 -14.733 780 HB3 LYS 106 HB3 LYS 106 127.040 6.709 -15.280 781 HG2 LYS 106 HG2 LYS 106 126.693 4.255 -14.997 782 HG3 LYS 106 HG3 LYS 106 125.009 4.570 -14.577 783 HD2 LYS 106 HD2 LYS 106 124.715 5.711 -16.778 784 HD3 LYS 106 HD3 LYS 106 126.364 5.254 -17.201 785 HE2 LYS 106 HE2 LYS 106 124.950 3.579 -18.159 786 HE3 LYS 106 HE3 LYS 106 125.684 2.843 -16.735 787 HZ1 LYS 106 HZ1 LYS 106 123.296 4.210 -16.049 788 HZ2 LYS 106 HZ2 LYS 106 123.699 2.575 -15.824 789 HZ3 LYS 106 HZ3 LYS 106 122.993 3.085 -17.282 790 H ALA 107 H ALA 107 125.485 8.261 -12.242 791 HA ALA 107 HA ALA 107 127.488 10.269 -12.577 792 HB1 ALA 107 HB1 ALA 107 125.035 10.352 -10.818 793 HB2 ALA 107 HB2 ALA 107 125.042 10.718 -12.544 794 HB3 ALA 107 HB3 ALA 107 125.953 11.731 -11.424 795 H GLY 108 H GLY 108 127.615 7.769 -10.472 796 HA2 GLY 108 HA2 GLY 108 128.998 7.379 -8.713 797 HA3 GLY 108 HA3 GLY 108 129.548 9.039 -8.814 798 H HIS 109 H HIS 109 126.110 8.470 -8.407 799 HA HIS 109 HA HIS 109 126.209 9.423 -5.679 800 HB2 HIS 109 HB2 HIS 109 124.056 8.679 -7.612 801 HB3 HIS 109 HB3 HIS 109 123.666 8.720 -5.903 802 HD1 HIS 109 HD1 HIS 109 125.201 11.203 -5.006 803 HD2 HIS 109 HD2 HIS 109 122.996 11.046 -8.541 804 HE1 HIS 109 HE1 HIS 109 124.632 13.597 -5.601 805 HA PRO 110 HA PRO 110 126.644 5.329 -3.971 806 HB2 PRO 110 HB2 PRO 110 125.459 5.614 -1.508 807 HB3 PRO 110 HB3 PRO 110 127.081 6.220 -1.895 808 HG2 PRO 110 HG2 PRO 110 124.497 7.688 -1.774 809 HG3 PRO 110 HG3 PRO 110 126.110 8.189 -1.234 810 HD2 PRO 110 HD2 PRO 110 125.035 9.067 -3.572 811 HD3 PRO 110 HD3 PRO 110 126.783 8.826 -3.357 812 HA PRO 111 HA PRO 111 122.642 3.429 -4.671 813 HB2 PRO 111 HB2 PRO 111 123.056 0.908 -3.718 814 HB3 PRO 111 HB3 PRO 111 123.736 1.492 -5.248 815 HG2 PRO 111 HG2 PRO 111 125.056 1.092 -2.633 816 HG3 PRO 111 HG3 PRO 111 125.705 0.932 -4.271 817 HD2 PRO 111 HD2 PRO 111 126.120 3.112 -2.580 818 HD3 PRO 111 HD3 PRO 111 126.375 3.107 -4.338 819 H ILE 112 H ILE 112 120.695 2.871 -3.597 820 HA ILE 112 HA ILE 112 120.397 3.779 -0.937 821 HB ILE 112 HB ILE 112 118.520 2.156 -2.674 822 HG12 ILE 112 HG12 ILE 112 118.539 5.084 -1.912 823 HG13 ILE 112 HG13 ILE 112 119.174 4.462 -3.436 824 HG21 ILE 112 HG21 ILE 112 116.741 2.877 -1.107 825 HG22 ILE 112 HG22 ILE 112 117.954 3.629 -0.075 826 HG23 ILE 112 HG23 ILE 112 117.930 1.878 -0.280 827 HD11 ILE 112 HD11 ILE 112 116.883 3.479 -3.876 828 HD12 ILE 112 HD12 ILE 112 116.921 5.242 -3.834 829 HD13 ILE 112 HD13 ILE 112 116.305 4.342 -2.447 830 H THR 113 H THR 113 121.596 0.756 -2.037 831 HA THR 113 HA THR 113 120.321 -1.069 -0.465 832 HB THR 113 HB THR 113 121.782 -1.916 -2.074 833 HG1 THR 113 HG1 THR 113 121.669 -3.121 -0.184 834 HG21 THR 113 HG21 THR 113 123.428 0.060 -1.835 835 HG22 THR 113 HG22 THR 113 124.093 -1.520 -2.240 836 HG23 THR 113 HG23 THR 113 124.200 -0.914 -0.587 837 HA PRO 114 HA PRO 114 123.362 -0.391 3.263 838 HB2 PRO 114 HB2 PRO 114 123.175 2.567 3.502 839 HB3 PRO 114 HB3 PRO 114 124.555 1.492 3.808 840 HG2 PRO 114 HG2 PRO 114 124.501 3.027 1.661 841 HG3 PRO 114 HG3 PRO 114 125.126 1.367 1.575 842 HD2 PRO 114 HD2 PRO 114 122.449 2.414 0.714 843 HD3 PRO 114 HD3 PRO 114 123.518 1.271 -0.122 844 H ILE 115 H ILE 115 120.662 1.742 2.466 845 HA ILE 115 HA ILE 115 119.476 1.293 5.116 846 HB ILE 115 HB ILE 115 117.763 2.962 4.350 847 HG12 ILE 115 HG12 ILE 115 119.737 3.472 2.107 848 HG13 ILE 115 HG13 ILE 115 118.220 2.607 1.888 849 HG21 ILE 115 HG21 ILE 115 119.083 4.735 5.038 850 HG22 ILE 115 HG22 ILE 115 120.493 4.180 4.134 851 HG23 ILE 115 HG23 ILE 115 120.022 3.364 5.626 852 HD11 ILE 115 HD11 ILE 115 116.956 4.507 2.054 853 HD12 ILE 115 HD12 ILE 115 118.453 5.281 1.535 854 HD13 ILE 115 HD13 ILE 115 118.022 5.252 3.243 855 H ARG 116 H ARG 116 119.459 -0.473 2.390 856 HA ARG 116 HA ARG 116 116.640 -0.880 1.997 857 HB2 ARG 116 HB2 ARG 116 118.340 -1.204 0.220 858 HB3 ARG 116 HB3 ARG 116 119.008 -2.556 1.130 859 HG2 ARG 116 HG2 ARG 116 116.828 -3.721 0.982 860 HG3 ARG 116 HG3 ARG 116 116.187 -2.376 0.032 861 HD2 ARG 116 HD2 ARG 116 117.985 -2.744 -1.646 862 HD3 ARG 116 HD3 ARG 116 118.529 -4.143 -0.727 863 HE ARG 116 HE ARG 116 115.979 -4.793 -1.139 864 HH11 ARG 116 HH11 ARG 116 118.309 -3.479 -3.416 865 HH12 ARG 116 HH12 ARG 116 117.562 -4.250 -4.774 866 HH21 ARG 116 HH21 ARG 116 115.069 -5.765 -2.929 867 HH22 ARG 116 HH22 ARG 116 115.754 -5.527 -4.502 868 H ALA 117 H ALA 117 115.350 -2.480 2.834 869 HA ALA 117 HA ALA 117 116.284 -3.755 5.257 870 HB1 ALA 117 HB1 ALA 117 113.585 -3.867 3.895 871 HB2 ALA 117 HB2 ALA 117 114.055 -2.700 5.132 872 HB3 ALA 117 HB3 ALA 117 113.946 -4.414 5.533 873 H LYS 118 H LYS 118 116.695 -5.855 5.586 874 HA LYS 118 HA LYS 118 116.559 -7.685 3.290 875 HB2 LYS 118 HB2 LYS 118 118.680 -7.406 4.674 876 HB3 LYS 118 HB3 LYS 118 117.820 -8.218 5.983 877 HG2 LYS 118 HG2 LYS 118 117.303 -10.060 4.252 878 HG3 LYS 118 HG3 LYS 118 118.567 -9.316 3.275 879 HD2 LYS 118 HD2 LYS 118 118.989 -10.161 6.150 880 HD3 LYS 118 HD3 LYS 118 119.355 -11.204 4.775 881 HE2 LYS 118 HE2 LYS 118 120.979 -9.647 3.923 882 HE3 LYS 118 HE3 LYS 118 120.492 -8.416 5.088 883 HZ1 LYS 118 HZ1 LYS 118 122.111 -10.815 5.481 884 HZ2 LYS 118 HZ2 LYS 118 121.092 -10.345 6.757 885 HZ3 LYS 118 HZ3 LYS 118 122.273 -9.274 6.171 886 H GLY 119 H GLY 119 115.310 -9.527 3.297 887 HA2 GLY 119 HA2 GLY 119 113.305 -9.696 5.449 888 HA3 GLY 119 HA3 GLY 119 113.131 -10.367 3.841 889 H SER 120 H SER 120 112.945 -11.607 6.582 890 HA SER 120 HA SER 120 115.132 -13.265 7.131 891 HB2 SER 120 HB2 SER 120 112.202 -13.914 7.529 892 HB3 SER 120 HB3 SER 120 113.561 -14.666 8.357 893 HG SER 120 HG SER 120 114.011 -12.380 8.939 894 H GLY 121 H GLY 121 112.380 -13.752 4.947 895 HA2 GLY 121 HA2 GLY 121 113.637 -16.222 3.935 896 HA3 GLY 121 HA3 GLY 121 111.966 -15.735 3.661 897 H GLY 122 H GLY 122 113.424 -16.510 1.502 898 HA2 GLY 122 HA2 GLY 122 113.974 -15.843 -0.630 899 HA3 GLY 122 HA3 GLY 122 113.137 -14.338 -0.261 900 H GLY 123 H GLY 123 114.357 -12.593 -0.479 901 HA2 GLY 123 HA2 GLY 123 117.183 -12.682 0.347 902 HA3 GLY 123 HA3 GLY 123 116.779 -12.119 -1.272 903 H TYR 124 H TYR 124 116.718 -9.985 -1.450 904 HA TYR 124 HA TYR 124 116.153 -8.357 0.943 905 HB2 TYR 124 HB2 TYR 124 117.618 -7.823 -1.628 906 HB3 TYR 124 HB3 TYR 124 117.086 -6.516 -0.589 907 HD1 TYR 124 HD1 TYR 124 118.577 -9.879 0.161 908 HD2 TYR 124 HD2 TYR 124 118.943 -5.611 0.481 909 HE1 TYR 124 HE1 TYR 124 120.636 -10.157 1.512 910 HE2 TYR 124 HE2 TYR 124 120.998 -5.889 1.840 911 HH TYR 124 HH TYR 124 122.263 -7.415 2.933 912 H ILE 125 H ILE 125 114.724 -6.562 0.795 913 HA ILE 125 HA ILE 125 112.358 -7.245 -0.690 914 HB ILE 125 HB ILE 125 112.978 -4.906 1.137 915 HG12 ILE 125 HG12 ILE 125 111.250 -7.297 1.752 916 HG13 ILE 125 HG13 ILE 125 112.992 -7.383 1.990 917 HG21 ILE 125 HG21 ILE 125 110.604 -4.510 1.224 918 HG22 ILE 125 HG22 ILE 125 110.271 -5.946 0.256 919 HG23 ILE 125 HG23 ILE 125 111.052 -4.548 -0.480 920 HD11 ILE 125 HD11 ILE 125 112.974 -5.868 3.724 921 HD12 ILE 125 HD12 ILE 125 111.374 -6.573 3.937 922 HD13 ILE 125 HD13 ILE 125 111.549 -5.019 3.121 923 H SER 126 H SER 126 111.692 -6.469 -2.574 924 HA SER 126 HA SER 126 113.461 -5.114 -4.289 925 HB2 SER 126 HB2 SER 126 110.474 -5.496 -4.548 926 HB3 SER 126 HB3 SER 126 111.565 -5.027 -5.847 927 HG SER 126 HG SER 126 112.492 -6.999 -5.689 928 H LEU 127 H LEU 127 113.763 -3.074 -4.839 929 HA LEU 127 HA LEU 127 112.170 -0.969 -3.560 930 HB2 LEU 127 HB2 LEU 127 114.629 -0.728 -5.306 931 HB3 LEU 127 HB3 LEU 127 113.885 0.557 -4.360 932 HG LEU 127 HG LEU 127 115.075 -1.985 -3.208 933 HD11 LEU 127 HD11 LEU 127 116.102 0.850 -3.454 934 HD12 LEU 127 HD12 LEU 127 116.884 -0.639 -3.986 935 HD13 LEU 127 HD13 LEU 127 116.744 -0.283 -2.264 936 HD21 LEU 127 HD21 LEU 127 113.403 -1.261 -1.699 937 HD22 LEU 127 HD22 LEU 127 113.730 0.443 -2.017 938 HD23 LEU 127 HD23 LEU 127 114.875 -0.515 -1.078 939 H GLY 128 H GLY 128 111.609 -2.748 -6.213 940 HA2 GLY 128 HA2 GLY 128 111.605 -1.171 -8.458 941 HA3 GLY 128 HA3 GLY 128 110.397 -2.408 -8.144 942 H ALA 129 H ALA 129 109.086 -1.214 -5.928 943 HA ALA 129 HA ALA 129 107.197 0.358 -7.293 944 HB1 ALA 129 HB1 ALA 129 107.623 0.431 -4.306 945 HB2 ALA 129 HB2 ALA 129 106.889 -0.950 -5.120 946 HB3 ALA 129 HB3 ALA 129 106.114 0.632 -5.198 947 H LEU 130 H LEU 130 109.757 1.326 -5.012 948 HA LEU 130 HA LEU 130 109.166 4.076 -4.983 949 HB2 LEU 130 HB2 LEU 130 110.675 2.925 -3.377 950 HB3 LEU 130 HB3 LEU 130 111.871 2.753 -4.660 951 HG LEU 130 HG LEU 130 111.809 5.265 -4.933 952 HD11 LEU 130 HD11 LEU 130 110.951 6.412 -2.765 953 HD12 LEU 130 HD12 LEU 130 110.020 4.932 -2.527 954 HD13 LEU 130 HD13 LEU 130 109.758 5.917 -3.966 955 HD21 LEU 130 HD21 LEU 130 112.543 4.587 -2.096 956 HD22 LEU 130 HD22 LEU 130 113.416 5.579 -3.263 957 HD23 LEU 130 HD23 LEU 130 113.412 3.824 -3.427 958 H LEU 131 H LEU 131 111.290 2.163 -7.085 959 HA LEU 131 HA LEU 131 112.456 4.308 -8.484 960 HB2 LEU 131 HB2 LEU 131 113.262 1.956 -8.580 961 HB3 LEU 131 HB3 LEU 131 111.838 1.531 -9.528 962 HG LEU 131 HG LEU 131 112.550 3.308 -11.198 963 HD11 LEU 131 HD11 LEU 131 114.891 3.333 -9.305 964 HD12 LEU 131 HD12 LEU 131 114.041 4.697 -10.034 965 HD13 LEU 131 HD13 LEU 131 115.125 3.708 -11.013 966 HD21 LEU 131 HD21 LEU 131 114.621 1.141 -10.771 967 HD22 LEU 131 HD22 LEU 131 114.091 1.840 -12.301 968 HD23 LEU 131 HD23 LEU 131 113.001 0.804 -11.380 969 H SER 132 H SER 132 109.481 2.472 -9.096 970 HA SER 132 HA SER 132 108.885 3.549 -11.616 971 HB2 SER 132 HB2 SER 132 107.736 1.584 -10.566 972 HB3 SER 132 HB3 SER 132 106.894 2.703 -9.499 973 HG SER 132 HG SER 132 106.630 2.314 -12.208 974 H THR 133 H THR 133 108.018 4.669 -8.358 975 HA THR 133 HA THR 133 106.290 6.745 -9.148 976 HB THR 133 HB THR 133 108.090 6.706 -6.714 977 HG1 THR 133 HG1 THR 133 105.585 5.596 -7.185 978 HG21 THR 133 HG21 THR 133 106.330 8.116 -5.738 979 HG22 THR 133 HG22 THR 133 105.426 8.051 -7.250 980 HG23 THR 133 HG23 THR 133 106.987 8.870 -7.191 981 H THR 134 H THR 134 109.789 6.775 -8.489 982 HA THR 134 HA THR 134 110.129 9.553 -8.883 983 HB THR 134 HB THR 134 112.219 7.428 -9.387 984 HG1 THR 134 HG1 THR 134 111.806 7.046 -7.376 985 HG21 THR 134 HG21 THR 134 113.728 9.251 -8.608 986 HG22 THR 134 HG22 THR 134 112.339 10.334 -8.515 987 HG23 THR 134 HG23 THR 134 112.854 9.690 -10.075 988 H LEU 135 H LEU 135 110.345 6.821 -11.141 989 HA LEU 135 HA LEU 135 111.301 8.256 -13.361 990 HB2 LEU 135 HB2 LEU 135 109.556 5.790 -13.229 991 HB3 LEU 135 HB3 LEU 135 110.299 6.401 -14.707 992 HG LEU 135 HG LEU 135 111.877 5.710 -12.215 993 HD11 LEU 135 HD11 LEU 135 112.557 3.681 -13.570 994 HD12 LEU 135 HD12 LEU 135 111.245 4.067 -14.682 995 HD13 LEU 135 HD13 LEU 135 110.887 3.655 -13.004 996 HD21 LEU 135 HD21 LEU 135 112.543 6.470 -15.060 997 HD22 LEU 135 HD22 LEU 135 113.695 5.583 -14.060 998 HD23 LEU 135 HD23 LEU 135 113.145 7.184 -13.563 999 H ASN 136 H ASN 136 108.002 7.731 -12.175 1000 HA ASN 136 HA ASN 136 106.598 8.798 -14.352 1001 HB2 ASN 136 HB2 ASN 136 105.573 7.618 -12.400 1002 HB3 ASN 136 HB3 ASN 136 105.860 9.060 -11.429 1003 HD21 ASN 136 HD21 ASN 136 104.196 8.007 -14.444 1004 HD22 ASN 136 HD22 ASN 136 102.971 9.178 -14.346 1005 H LEU 137 H LEU 137 107.934 10.383 -11.473 1006 HA LEU 137 HA LEU 137 107.140 13.014 -12.124 1007 HB2 LEU 137 HB2 LEU 137 109.591 12.127 -10.584 1008 HB3 LEU 137 HB3 LEU 137 108.871 13.736 -10.549 1009 HG LEU 137 HG LEU 137 107.452 11.191 -9.708 1010 HD11 LEU 137 HD11 LEU 137 109.129 11.646 -8.068 1011 HD12 LEU 137 HD12 LEU 137 107.634 12.319 -7.418 1012 HD13 LEU 137 HD13 LEU 137 108.836 13.383 -8.148 1013 HD21 LEU 137 HD21 LEU 137 106.694 14.127 -9.644 1014 HD22 LEU 137 HD22 LEU 137 105.840 12.890 -8.721 1015 HD23 LEU 137 HD23 LEU 137 105.853 12.821 -10.480 1016 H CYS 138 H CYS 138 110.056 11.185 -12.960 1017 HA CYS 138 HA CYS 138 111.451 13.204 -14.307 1018 HB2 CYS 138 HB2 CYS 138 111.415 10.220 -14.456 1019 HB3 CYS 138 HB3 CYS 138 112.283 11.114 -15.700 1020 H GLY 139 H GLY 139 108.617 11.411 -15.307 1021 HA2 GLY 139 HA2 GLY 139 107.216 12.278 -17.060 1022 HA3 GLY 139 HA3 GLY 139 108.657 12.871 -17.870 1023 H LYS 140 H LYS 140 109.898 10.080 -17.171 1024 HA LYS 140 HA LYS 140 108.909 8.789 -19.609 1025 HB2 LYS 140 HB2 LYS 140 111.319 8.225 -17.869 1026 HB3 LYS 140 HB3 LYS 140 110.906 7.328 -19.330 1027 HG2 LYS 140 HG2 LYS 140 110.983 9.463 -20.619 1028 HG3 LYS 140 HG3 LYS 140 111.517 10.293 -19.156 1029 HD2 LYS 140 HD2 LYS 140 113.471 8.740 -19.037 1030 HD3 LYS 140 HD3 LYS 140 112.966 8.040 -20.575 1031 HE2 LYS 140 HE2 LYS 140 113.060 10.399 -21.536 1032 HE3 LYS 140 HE3 LYS 140 113.872 10.877 -20.045 1033 HZ1 LYS 140 HZ1 LYS 140 115.700 10.282 -21.178 1034 HZ2 LYS 140 HZ2 LYS 140 114.851 9.289 -22.263 1035 HZ3 LYS 140 HZ3 LYS 140 115.267 8.707 -20.722 1036 H GLY 141 H GLY 141 108.091 6.707 -19.660 1037 HA2 GLY 141 HA2 GLY 141 108.039 4.727 -17.810 1038 HA3 GLY 141 HA3 GLY 141 106.781 5.818 -17.238 Start of MODEL 9 1 H1 HIS -5 HT1 HIS -5 61.169 -28.512 -2.525 2 H2 HIS -5 HT2 HIS -5 59.561 -28.676 -3.050 3 H3 HIS -5 HT3 HIS -5 60.282 -27.139 -2.981 4 HA HIS -5 HA HIS -5 61.171 -29.343 -4.760 5 HB2 HIS -5 HB2 HIS -5 59.531 -26.862 -5.320 6 HB3 HIS -5 HB3 HIS -5 60.197 -27.915 -6.553 7 HD1 HIS -5 HD1 HIS -5 57.460 -27.660 -4.022 8 HD2 HIS -5 HD2 HIS -5 58.833 -30.422 -6.828 9 HE1 HIS -5 HE1 HIS -5 55.648 -29.412 -4.247 10 H HIS -4 H HIS -4 62.799 -28.671 -6.245 11 HA HIS -4 HA HIS -4 64.309 -26.265 -5.391 12 HB2 HIS -4 HB2 HIS -4 65.329 -28.902 -6.450 13 HB3 HIS -4 HB3 HIS -4 66.326 -27.488 -6.166 14 HD1 HIS -4 HD1 HIS -4 64.543 -30.269 -4.419 15 HD2 HIS -4 HD2 HIS -4 66.839 -26.942 -3.399 16 HE1 HIS -4 HE1 HIS -4 65.141 -30.534 -1.974 17 H HIS -3 H HIS -3 65.011 -24.877 -6.939 18 HA HIS -3 HA HIS -3 64.315 -25.509 -9.752 19 HB2 HIS -3 HB2 HIS -3 64.218 -22.859 -8.305 20 HB3 HIS -3 HB3 HIS -3 63.979 -23.063 -10.030 21 HD1 HIS -3 HD1 HIS -3 62.313 -23.547 -6.720 22 HD2 HIS -3 HD2 HIS -3 61.456 -24.220 -10.744 23 HE1 HIS -3 HE1 HIS -3 59.836 -24.051 -6.850 24 H HIS -2 H HIS -2 65.803 -25.040 -11.312 25 HA HIS -2 HA HIS -2 68.449 -24.079 -10.382 26 HB2 HIS -2 HB2 HIS -2 67.778 -25.973 -12.638 27 HB3 HIS -2 HB3 HIS -2 69.387 -25.405 -12.237 28 HD1 HIS -2 HD1 HIS -2 70.130 -26.049 -9.640 29 HD2 HIS -2 HD2 HIS -2 67.114 -28.331 -11.394 30 HE1 HIS -2 HE1 HIS -2 69.980 -28.190 -8.299 31 H HIS -1 H HIS -1 69.430 -22.458 -11.481 32 HA HIS -1 HA HIS -1 68.027 -21.350 -13.847 33 HB2 HIS -1 HB2 HIS -1 69.398 -19.842 -11.618 34 HB3 HIS -1 HB3 HIS -1 68.717 -19.120 -13.063 35 HD1 HIS -1 HD1 HIS -1 66.004 -19.644 -13.340 36 HD2 HIS -1 HD2 HIS -1 67.634 -19.940 -9.514 37 HE1 HIS -1 HE1 HIS -1 64.062 -19.513 -11.723 38 H HIS 0 H HIS 0 69.297 -20.543 -15.495 39 HA HIS 0 HA HIS 0 72.184 -21.194 -15.330 40 HB2 HIS 0 HB2 HIS 0 70.327 -21.144 -17.710 41 HB3 HIS 0 HB3 HIS 0 72.060 -21.396 -17.803 42 HD1 HIS 0 HD1 HIS 0 68.856 -23.081 -16.876 43 HD2 HIS 0 HD2 HIS 0 72.927 -23.979 -16.912 44 HE1 HIS 0 HE1 HIS 0 69.040 -25.582 -16.532 45 H SER 1 H SER 1 73.664 -19.673 -15.918 46 HA SER 1 HA SER 1 72.973 -16.948 -15.757 47 HB2 SER 1 HB2 SER 1 75.474 -18.190 -16.931 48 HB3 SER 1 HB3 SER 1 75.292 -16.514 -16.424 49 HG SER 1 HG SER 1 75.171 -18.808 -14.844 50 H SER 2 H SER 2 73.078 -15.300 -17.360 51 HA SER 2 HA SER 2 72.577 -16.242 -20.127 52 HB2 SER 2 HB2 SER 2 70.509 -15.437 -18.998 53 HB3 SER 2 HB3 SER 2 71.289 -13.880 -18.736 54 HG SER 2 HG SER 2 71.379 -13.657 -20.936 55 H GLY 3 H GLY 3 73.451 -15.033 -21.788 56 HA2 GLY 3 HA2 GLY 3 75.738 -13.398 -21.078 57 HA3 GLY 3 HA3 GLY 3 75.260 -13.884 -22.703 58 H LEU 4 H LEU 4 75.996 -11.455 -22.815 59 HA LEU 4 HA LEU 4 73.813 -9.621 -22.137 60 HB2 LEU 4 HB2 LEU 4 76.515 -9.053 -23.380 61 HB3 LEU 4 HB3 LEU 4 75.362 -7.851 -22.803 62 HG LEU 4 HG LEU 4 76.644 -9.982 -21.067 63 HD11 LEU 4 HD11 LEU 4 77.201 -7.006 -21.284 64 HD12 LEU 4 HD12 LEU 4 78.274 -8.292 -21.837 65 HD13 LEU 4 HD13 LEU 4 77.935 -8.105 -20.116 66 HD21 LEU 4 HD21 LEU 4 74.734 -7.697 -20.553 67 HD22 LEU 4 HD22 LEU 4 75.739 -8.365 -19.266 68 HD23 LEU 4 HD23 LEU 4 74.563 -9.391 -20.089 69 H VAL 5 H VAL 5 72.533 -8.617 -23.614 70 HA VAL 5 HA VAL 5 72.246 -9.818 -26.192 71 HB VAL 5 HB VAL 5 70.483 -8.113 -26.527 72 HG11 VAL 5 HG11 VAL 5 70.410 -9.305 -23.740 73 HG12 VAL 5 HG12 VAL 5 70.087 -10.219 -25.213 74 HG13 VAL 5 HG13 VAL 5 69.026 -8.889 -24.751 75 HG21 VAL 5 HG21 VAL 5 71.721 -6.294 -25.291 76 HG22 VAL 5 HG22 VAL 5 71.303 -7.110 -23.785 77 HG23 VAL 5 HG23 VAL 5 70.030 -6.457 -24.817 78 HA PRO 6 HA PRO 6 74.926 -7.204 -28.536 79 HB2 PRO 6 HB2 PRO 6 73.634 -6.971 -30.936 80 HB3 PRO 6 HB3 PRO 6 74.475 -8.447 -30.422 81 HG2 PRO 6 HG2 PRO 6 71.570 -7.817 -30.387 82 HG3 PRO 6 HG3 PRO 6 72.395 -9.336 -30.780 83 HD2 PRO 6 HD2 PRO 6 71.198 -8.883 -28.364 84 HD3 PRO 6 HD3 PRO 6 72.591 -9.968 -28.570 85 H ARG 7 H ARG 7 75.202 -5.091 -28.134 86 HA ARG 7 HA ARG 7 73.202 -3.170 -29.019 87 HB2 ARG 7 HB2 ARG 7 73.025 -2.060 -26.857 88 HB3 ARG 7 HB3 ARG 7 72.504 -3.738 -26.720 89 HG2 ARG 7 HG2 ARG 7 74.821 -4.311 -25.906 90 HG3 ARG 7 HG3 ARG 7 75.171 -2.582 -25.866 91 HD2 ARG 7 HD2 ARG 7 73.215 -2.267 -24.343 92 HD3 ARG 7 HD3 ARG 7 73.002 -4.015 -24.309 93 HE ARG 7 HE ARG 7 75.661 -3.458 -23.611 94 HH11 ARG 7 HH11 ARG 7 72.456 -2.942 -22.273 95 HH12 ARG 7 HH12 ARG 7 73.029 -2.953 -20.638 96 HH21 ARG 7 HH21 ARG 7 76.338 -3.462 -21.487 97 HH22 ARG 7 HH22 ARG 7 75.199 -3.243 -20.200 98 H GLY 8 H GLY 8 74.001 -0.897 -28.749 99 HA2 GLY 8 HA2 GLY 8 76.756 -0.768 -29.638 100 HA3 GLY 8 HA3 GLY 8 75.619 0.575 -29.549 101 H SER 9 H SER 9 77.829 1.457 -28.724 102 HA SER 9 HA SER 9 78.005 1.077 -25.790 103 HB2 SER 9 HB2 SER 9 80.050 0.449 -27.062 104 HB3 SER 9 HB3 SER 9 80.132 2.092 -27.690 105 HG SER 9 HG SER 9 80.290 1.277 -25.026 106 H GLY 10 H GLY 10 77.995 2.855 -24.466 107 HA2 GLY 10 HA2 GLY 10 78.173 5.545 -25.439 108 HA3 GLY 10 HA3 GLY 10 76.508 5.083 -25.095 109 H MET 11 H MET 11 77.048 7.015 -23.564 110 HA MET 11 HA MET 11 78.166 5.984 -21.023 111 HB2 MET 11 HB2 MET 11 77.839 8.819 -22.031 112 HB3 MET 11 HB3 MET 11 78.404 8.389 -20.415 113 HG2 MET 11 HG2 MET 11 80.263 7.088 -21.447 114 HG3 MET 11 HG3 MET 11 79.728 7.631 -23.037 115 HE1 MET 11 HE1 MET 11 82.055 8.903 -23.687 116 HE2 MET 11 HE2 MET 11 82.466 7.883 -22.311 117 HE3 MET 11 HE3 MET 11 83.026 9.552 -22.361 118 H LYS 12 H LYS 12 76.991 6.159 -19.146 119 HA LYS 12 HA LYS 12 74.148 6.952 -19.441 120 HB2 LYS 12 HB2 LYS 12 75.391 4.823 -17.684 121 HB3 LYS 12 HB3 LYS 12 73.694 5.305 -17.638 122 HG2 LYS 12 HG2 LYS 12 73.383 4.623 -19.950 123 HG3 LYS 12 HG3 LYS 12 75.103 4.269 -20.113 124 HD2 LYS 12 HD2 LYS 12 73.970 2.174 -19.735 125 HD3 LYS 12 HD3 LYS 12 74.848 2.576 -18.259 126 HE2 LYS 12 HE2 LYS 12 72.013 3.511 -18.529 127 HE3 LYS 12 HE3 LYS 12 72.310 1.814 -18.157 128 HZ1 LYS 12 HZ1 LYS 12 72.630 4.126 -16.497 129 HZ2 LYS 12 HZ2 LYS 12 74.013 3.140 -16.510 130 HZ3 LYS 12 HZ3 LYS 12 72.507 2.492 -16.063 131 H GLU 13 H GLU 13 73.182 8.083 -17.744 132 HA GLU 13 HA GLU 13 74.735 9.992 -16.420 133 HB2 GLU 13 HB2 GLU 13 72.698 10.467 -15.106 134 HB3 GLU 13 HB3 GLU 13 72.340 10.290 -16.824 135 HG2 GLU 13 HG2 GLU 13 71.718 7.907 -16.401 136 HG3 GLU 13 HG3 GLU 13 71.960 8.181 -14.682 137 H THR 14 H THR 14 75.453 10.209 -14.306 138 HA THR 14 HA THR 14 75.510 7.720 -12.694 139 HB THR 14 HB THR 14 77.747 8.342 -11.948 140 HG1 THR 14 HG1 THR 14 78.455 10.253 -12.346 141 HG21 THR 14 HG21 THR 14 77.407 8.372 -14.959 142 HG22 THR 14 HG22 THR 14 77.626 6.951 -13.937 143 HG23 THR 14 HG23 THR 14 78.943 8.108 -14.132 144 H ALA 15 H ALA 15 75.829 8.088 -10.370 145 HA ALA 15 HA ALA 15 73.950 9.924 -9.335 146 HB1 ALA 15 HB1 ALA 15 74.418 7.932 -8.091 147 HB2 ALA 15 HB2 ALA 15 74.976 9.289 -7.111 148 HB3 ALA 15 HB3 ALA 15 76.138 8.313 -8.011 149 H ALA 16 H ALA 16 74.215 11.826 -8.155 150 HA ALA 16 HA ALA 16 76.175 13.626 -9.055 151 HB1 ALA 16 HB1 ALA 16 74.487 13.769 -6.544 152 HB2 ALA 16 HB2 ALA 16 74.005 14.343 -8.141 153 HB3 ALA 16 HB3 ALA 16 75.340 15.121 -7.291 154 H ALA 17 H ALA 17 77.997 14.510 -8.051 155 HA ALA 17 HA ALA 17 79.686 12.723 -6.706 156 HB1 ALA 17 HB1 ALA 17 80.163 14.978 -8.002 157 HB2 ALA 17 HB2 ALA 17 81.259 14.415 -6.739 158 HB3 ALA 17 HB3 ALA 17 80.071 15.670 -6.382 159 H LYS 18 H LYS 18 80.329 12.533 -4.570 160 HA LYS 18 HA LYS 18 78.352 13.429 -2.608 161 HB2 LYS 18 HB2 LYS 18 80.671 11.493 -2.397 162 HB3 LYS 18 HB3 LYS 18 79.549 11.864 -1.087 163 HG2 LYS 18 HG2 LYS 18 77.663 11.122 -2.539 164 HG3 LYS 18 HG3 LYS 18 78.834 10.652 -3.771 165 HD2 LYS 18 HD2 LYS 18 79.910 9.130 -2.108 166 HD3 LYS 18 HD3 LYS 18 78.630 9.531 -0.962 167 HE2 LYS 18 HE2 LYS 18 78.075 8.414 -3.719 168 HE3 LYS 18 HE3 LYS 18 78.257 7.397 -2.290 169 HZ1 LYS 18 HZ1 LYS 18 75.962 7.841 -2.551 170 HZ2 LYS 18 HZ2 LYS 18 76.227 9.507 -2.758 171 HZ3 LYS 18 HZ3 LYS 18 76.487 8.784 -1.243 172 H PHE 19 H PHE 19 78.930 14.507 -0.678 173 HA PHE 19 HA PHE 19 81.348 16.179 -0.944 174 HB2 PHE 19 HB2 PHE 19 78.841 16.569 0.695 175 HB3 PHE 19 HB3 PHE 19 80.212 17.661 0.682 176 HD1 PHE 19 HD2 PHE 19 80.749 18.971 -1.370 177 HD2 PHE 19 HD1 PHE 19 77.222 16.537 -1.071 178 HE1 PHE 19 HE2 PHE 19 79.766 20.154 -3.316 179 HE2 PHE 19 HE1 PHE 19 76.240 17.720 -3.018 180 HZ PHE 19 HZ PHE 19 77.512 19.529 -4.140 181 H GLU 20 H GLU 20 82.934 16.119 0.544 182 HA GLU 20 HA GLU 20 82.628 14.210 2.780 183 HB2 GLU 20 HB2 GLU 20 85.116 15.233 1.391 184 HB3 GLU 20 HB3 GLU 20 85.110 14.134 2.770 185 HG2 GLU 20 HG2 GLU 20 85.282 12.697 0.910 186 HG3 GLU 20 HG3 GLU 20 83.577 12.637 1.336 187 H ARG 21 H ARG 21 83.609 14.748 4.818 188 HA ARG 21 HA ARG 21 84.263 17.559 5.282 189 HB2 ARG 21 HB2 ARG 21 82.648 17.738 7.140 190 HB3 ARG 21 HB3 ARG 21 81.836 17.486 5.594 191 HG2 ARG 21 HG2 ARG 21 81.726 15.038 6.112 192 HG3 ARG 21 HG3 ARG 21 82.391 15.385 7.708 193 HD2 ARG 21 HD2 ARG 21 79.803 16.491 6.582 194 HD3 ARG 21 HD3 ARG 21 79.945 15.250 7.823 195 HE ARG 21 HE ARG 21 81.319 17.259 8.941 196 HH11 ARG 21 HH11 ARG 21 78.191 17.306 7.349 197 HH12 ARG 21 HH12 ARG 21 77.615 18.635 8.299 198 HH21 ARG 21 HH21 ARG 21 80.524 18.968 10.134 199 HH22 ARG 21 HH22 ARG 21 78.921 19.563 9.856 200 H GLN 22 H GLN 22 85.093 17.914 7.498 201 HA GLN 22 HA GLN 22 86.511 15.501 8.467 202 HB2 GLN 22 HB2 GLN 22 87.272 18.427 8.624 203 HB3 GLN 22 HB3 GLN 22 88.188 17.106 9.354 204 HG2 GLN 22 HG2 GLN 22 88.535 16.088 7.160 205 HG3 GLN 22 HG3 GLN 22 87.547 17.335 6.401 206 HE21 GLN 22 HE21 GLN 22 90.277 16.910 5.638 207 HE22 GLN 22 HE22 GLN 22 91.176 18.274 6.102 208 H HIS 23 H HIS 23 86.747 15.189 10.705 209 HA HIS 23 HA HIS 23 84.946 16.781 12.433 210 HB2 HIS 23 HB2 HIS 23 85.295 13.781 12.467 211 HB3 HIS 23 HB3 HIS 23 84.329 14.711 13.596 212 HD1 HIS 23 HD1 HIS 23 82.314 16.151 12.346 213 HD2 HIS 23 HD2 HIS 23 83.867 12.863 10.306 214 HE1 HIS 23 HE1 HIS 23 80.608 15.533 10.581 215 H MET 24 H MET 24 85.493 16.663 14.725 216 HA MET 24 HA MET 24 88.408 16.501 15.087 217 HB2 MET 24 HB2 MET 24 86.260 17.804 16.776 218 HB3 MET 24 HB3 MET 24 87.985 17.823 17.143 219 HG2 MET 24 HG2 MET 24 88.379 18.886 14.896 220 HG3 MET 24 HG3 MET 24 86.630 19.017 14.711 221 HE1 MET 24 HE1 MET 24 89.722 19.745 16.470 222 HE2 MET 24 HE2 MET 24 88.981 19.709 18.068 223 HE3 MET 24 HE3 MET 24 89.507 21.244 17.382 224 H ASP 25 H ASP 25 89.357 15.202 16.598 225 HA ASP 25 HA ASP 25 87.731 13.016 17.626 226 HB2 ASP 25 HB2 ASP 25 89.902 12.029 18.270 227 HB3 ASP 25 HB3 ASP 25 89.850 12.467 16.568 228 H SER 26 H SER 26 88.362 12.223 19.904 229 HA SER 26 HA SER 26 87.537 14.184 21.772 230 HB2 SER 26 HB2 SER 26 88.376 12.349 23.436 231 HB3 SER 26 HB3 SER 26 86.990 12.012 22.404 232 HG SER 26 HG SER 26 89.587 11.419 21.616 233 HA PRO 27 HA PRO 27 91.501 15.882 22.792 234 HB2 PRO 27 HB2 PRO 27 91.027 17.044 25.182 235 HB3 PRO 27 HB3 PRO 27 90.275 17.637 23.687 236 HG2 PRO 27 HG2 PRO 27 89.105 16.026 25.878 237 HG3 PRO 27 HG3 PRO 27 88.357 17.264 24.856 238 HD2 PRO 27 HD2 PRO 27 88.096 14.495 24.505 239 HD3 PRO 27 HD3 PRO 27 87.704 15.735 23.296 240 H ASP 28 H ASP 28 93.362 15.647 24.137 241 HA ASP 28 HA ASP 28 93.689 13.070 25.297 242 HB2 ASP 28 HB2 ASP 28 95.443 15.533 25.430 243 HB3 ASP 28 HB3 ASP 28 95.927 13.925 25.963 244 H LEU 29 H LEU 29 94.030 12.489 27.461 245 HA LEU 29 HA LEU 29 92.529 14.086 29.369 246 HB2 LEU 29 HB2 LEU 29 93.959 11.444 29.744 247 HB3 LEU 29 HB3 LEU 29 92.819 12.178 30.870 248 HG LEU 29 HG LEU 29 92.157 11.377 28.020 249 HD11 LEU 29 HD11 LEU 29 90.825 9.581 29.125 250 HD12 LEU 29 HD12 LEU 29 91.518 10.056 30.675 251 HD13 LEU 29 HD13 LEU 29 92.556 9.403 29.408 252 HD21 LEU 29 HD21 LEU 29 89.783 11.646 29.057 253 HD22 LEU 29 HD22 LEU 29 90.665 13.107 28.613 254 HD23 LEU 29 HD23 LEU 29 90.601 12.595 30.299 255 H GLY 30 H GLY 30 93.339 15.025 31.228 256 HA2 GLY 30 HA2 GLY 30 96.164 14.876 31.868 257 HA3 GLY 30 HA3 GLY 30 95.644 16.429 31.220 258 H THR 31 H THR 31 95.798 17.698 33.005 259 HA THR 31 HA THR 31 94.951 16.868 35.612 260 HB THR 31 HB THR 31 95.390 19.178 36.269 261 HG1 THR 31 HG1 THR 31 95.962 20.607 34.589 262 HG21 THR 31 HG21 THR 31 97.737 19.324 35.580 263 HG22 THR 31 HG22 THR 31 97.434 18.198 34.257 264 HG23 THR 31 HG23 THR 31 97.312 17.648 35.929 265 H ASP 32 H ASP 32 93.339 18.273 36.850 266 HA ASP 32 HA ASP 32 90.779 17.826 35.846 267 HB2 ASP 32 HB2 ASP 32 89.977 19.198 37.696 268 HB3 ASP 32 HB3 ASP 32 91.285 18.151 38.236 269 H ASP 33 H ASP 33 89.211 19.120 34.923 270 HA ASP 33 HA ASP 33 89.888 21.839 34.100 271 HB2 ASP 33 HB2 ASP 33 90.814 20.271 32.350 272 HB3 ASP 33 HB3 ASP 33 89.160 19.755 32.035 273 H ASP 34 H ASP 34 88.007 22.844 32.911 274 HA ASP 34 HA ASP 34 85.660 22.676 34.398 275 HB2 ASP 34 HB2 ASP 34 86.324 24.583 32.928 276 HB3 ASP 34 HB3 ASP 34 85.888 23.605 31.528 277 H ASP 35 H ASP 35 83.556 21.890 33.866 278 HA ASP 35 HA ASP 35 83.609 19.212 32.867 279 HB2 ASP 35 HB2 ASP 35 82.108 19.977 34.698 280 HB3 ASP 35 HB3 ASP 35 81.215 20.943 33.524 281 H LYS 36 H LYS 36 83.434 18.564 30.841 282 HA LYS 36 HA LYS 36 81.995 20.263 28.890 283 HB2 LYS 36 HB2 LYS 36 84.473 20.426 28.615 284 HB3 LYS 36 HB3 LYS 36 84.517 18.684 28.336 285 HG2 LYS 36 HG2 LYS 36 82.944 18.976 26.432 286 HG3 LYS 36 HG3 LYS 36 83.004 20.722 26.678 287 HD2 LYS 36 HD2 LYS 36 85.489 20.624 26.360 288 HD3 LYS 36 HD3 LYS 36 85.327 18.916 25.950 289 HE2 LYS 36 HE2 LYS 36 83.542 19.787 24.228 290 HE3 LYS 36 HE3 LYS 36 84.385 21.325 24.423 291 HZ1 LYS 36 HZ1 LYS 36 86.482 20.058 23.966 292 HZ2 LYS 36 HZ2 LYS 36 85.422 20.203 22.646 293 HZ3 LYS 36 HZ3 LYS 36 85.513 18.742 23.509 294 H THR 37 H THR 37 80.761 19.189 27.374 295 HA THR 37 HA THR 37 79.851 16.574 28.090 296 HB THR 37 HB THR 37 78.380 16.775 26.150 297 HG1 THR 37 HG1 THR 37 79.294 17.795 24.587 298 HG21 THR 37 HG21 THR 37 77.274 18.916 26.745 299 HG22 THR 37 HG22 THR 37 78.702 19.377 27.671 300 HG23 THR 37 HG23 THR 37 77.735 17.990 28.173 301 H GLY 38 H GLY 38 79.765 14.750 26.539 302 HA2 GLY 38 HA2 GLY 38 82.434 14.197 25.571 303 HA3 GLY 38 HA3 GLY 38 81.071 13.082 25.581 304 H GLY 39 H GLY 39 82.428 12.845 23.397 305 HA2 GLY 39 HA2 GLY 39 81.581 14.722 21.337 306 HA3 GLY 39 HA3 GLY 39 82.646 13.337 21.118 307 H GLY 40 H GLY 40 81.137 13.250 19.158 308 HA2 GLY 40 HA2 GLY 40 78.472 12.245 19.564 309 HA3 GLY 40 HA3 GLY 40 79.338 12.322 18.032 310 H ARG 41 H ARG 41 78.529 10.205 17.540 311 HA ARG 41 HA ARG 41 78.838 7.910 19.094 312 HB2 ARG 41 HB2 ARG 41 78.916 8.202 16.082 313 HB3 ARG 41 HB3 ARG 41 78.721 6.674 16.942 314 HG2 ARG 41 HG2 ARG 41 76.676 7.549 18.025 315 HG3 ARG 41 HG3 ARG 41 76.857 9.059 17.130 316 HD2 ARG 41 HD2 ARG 41 75.283 7.698 15.919 317 HD3 ARG 41 HD3 ARG 41 76.785 7.709 15.002 318 HE ARG 41 HE ARG 41 76.717 5.504 16.808 319 HH11 ARG 41 HH11 ARG 41 75.399 6.560 13.730 320 HH12 ARG 41 HH12 ARG 41 75.178 4.941 13.157 321 HH21 ARG 41 HH21 ARG 41 76.407 3.443 16.016 322 HH22 ARG 41 HH22 ARG 41 75.742 3.199 14.436 323 H ALA 42 H ALA 42 80.397 6.268 19.145 324 HA ALA 42 HA ALA 42 83.059 7.094 19.332 325 HB1 ALA 42 HB1 ALA 42 83.507 4.543 19.198 326 HB2 ALA 42 HB2 ALA 42 81.751 4.393 19.139 327 HB3 ALA 42 HB3 ALA 42 82.526 5.152 20.530 328 H ASP 43 H ASP 43 84.851 6.865 18.021 329 HA ASP 43 HA ASP 43 84.415 7.072 15.213 330 HB2 ASP 43 HB2 ASP 43 86.915 6.788 16.884 331 HB3 ASP 43 HB3 ASP 43 86.949 6.969 15.132 332 HA PRO 44 HA PRO 44 84.699 2.811 14.091 333 HB2 PRO 44 HB2 PRO 44 85.815 2.873 11.615 334 HB3 PRO 44 HB3 PRO 44 84.165 3.445 11.933 335 HG2 PRO 44 HG2 PRO 44 86.664 5.003 11.554 336 HG3 PRO 44 HG3 PRO 44 85.015 5.357 11.011 337 HD2 PRO 44 HD2 PRO 44 86.183 6.518 13.223 338 HD3 PRO 44 HD3 PRO 44 84.429 6.347 12.997 339 H ALA 45 H ALA 45 86.461 1.311 12.745 340 HA ALA 45 HA ALA 45 88.593 0.941 14.578 341 HB1 ALA 45 HB1 ALA 45 89.267 -0.871 13.162 342 HB2 ALA 45 HB2 ALA 45 88.407 -0.190 11.781 343 HB3 ALA 45 HB3 ALA 45 87.503 -0.839 13.149 344 H HIS 46 H HIS 46 90.867 0.448 13.246 345 HA HIS 46 HA HIS 46 92.093 2.943 13.006 346 HB2 HIS 46 HB2 HIS 46 92.977 0.342 11.751 347 HB3 HIS 46 HB3 HIS 46 93.990 1.742 12.051 348 HD1 HIS 46 HD1 HIS 46 94.131 2.410 14.736 349 HD2 HIS 46 HD2 HIS 46 93.009 -1.494 13.796 350 HE1 HIS 46 HE1 HIS 46 94.497 1.036 16.829 351 H ARG 47 H ARG 47 93.315 3.663 10.987 352 HA ARG 47 HA ARG 47 91.458 3.609 8.674 353 HB2 ARG 47 HB2 ARG 47 93.240 5.839 9.680 354 HB3 ARG 47 HB3 ARG 47 92.312 5.892 8.181 355 HG2 ARG 47 HG2 ARG 47 90.230 5.501 9.505 356 HG3 ARG 47 HG3 ARG 47 91.190 5.594 10.981 357 HD2 ARG 47 HD2 ARG 47 90.880 7.789 8.914 358 HD3 ARG 47 HD3 ARG 47 90.156 7.766 10.518 359 HE ARG 47 HE ARG 47 92.762 7.531 11.112 360 HH11 ARG 47 HH11 ARG 47 91.151 9.742 8.913 361 HH12 ARG 47 HH12 ARG 47 92.338 10.983 9.134 362 HH21 ARG 47 HH21 ARG 47 94.258 9.166 11.356 363 HH22 ARG 47 HH22 ARG 47 94.076 10.660 10.499 364 H SER 48 H SER 48 92.319 3.492 6.618 365 HA SER 48 HA SER 48 94.803 2.106 6.342 366 HB2 SER 48 HB2 SER 48 93.369 3.417 4.049 367 HB3 SER 48 HB3 SER 48 94.259 1.900 4.079 368 HG SER 48 HG SER 48 91.691 2.397 4.693 369 HA PRO 49 HA PRO 49 97.865 5.223 5.756 370 HB2 PRO 49 HB2 PRO 49 98.127 4.464 2.873 371 HB3 PRO 49 HB3 PRO 49 99.387 4.656 4.109 372 HG2 PRO 49 HG2 PRO 49 98.585 2.251 3.331 373 HG3 PRO 49 HG3 PRO 49 99.003 2.585 5.022 374 HD2 PRO 49 HD2 PRO 49 96.317 2.182 3.799 375 HD3 PRO 49 HD3 PRO 49 96.872 1.825 5.450 376 H VAL 50 H VAL 50 98.327 7.281 4.628 377 HA VAL 50 HA VAL 50 95.814 8.493 3.772 378 HB VAL 50 HB VAL 50 98.502 9.738 4.414 379 HG11 VAL 50 HG11 VAL 50 97.016 11.080 2.886 380 HG12 VAL 50 HG12 VAL 50 97.335 11.857 4.436 381 HG13 VAL 50 HG13 VAL 50 95.789 11.060 4.152 382 HG21 VAL 50 HG21 VAL 50 97.555 8.725 6.394 383 HG22 VAL 50 HG22 VAL 50 95.960 9.384 6.026 384 HG23 VAL 50 HG23 VAL 50 97.273 10.463 6.498 385 HA PRO 51 HA PRO 51 96.933 8.356 -0.577 386 HB2 PRO 51 HB2 PRO 51 95.940 11.169 -0.728 387 HB3 PRO 51 HB3 PRO 51 95.510 9.765 -1.726 388 HG2 PRO 51 HG2 PRO 51 93.863 10.696 0.140 389 HG3 PRO 51 HG3 PRO 51 94.008 8.960 -0.193 390 HD2 PRO 51 HD2 PRO 51 95.046 10.514 2.127 391 HD3 PRO 51 HD3 PRO 51 94.514 8.822 2.047 392 H LEU 52 H LEU 52 98.414 9.418 -2.109 393 HA LEU 52 HA LEU 52 100.792 10.261 -0.834 394 HB2 LEU 52 HB2 LEU 52 99.908 10.280 -3.722 395 HB3 LEU 52 HB3 LEU 52 101.511 10.814 -3.218 396 HG LEU 52 HG LEU 52 100.375 8.105 -2.491 397 HD11 LEU 52 HD11 LEU 52 102.146 7.415 -4.304 398 HD12 LEU 52 HD12 LEU 52 101.891 9.052 -4.909 399 HD13 LEU 52 HD13 LEU 52 100.537 7.925 -4.818 400 HD21 LEU 52 HD21 LEU 52 102.158 8.678 -1.026 401 HD22 LEU 52 HD22 LEU 52 103.083 9.440 -2.322 402 HD23 LEU 52 HD23 LEU 52 102.914 7.684 -2.273 403 HA PRO 53 HA PRO 53 100.146 14.648 -0.594 404 HB2 PRO 53 HB2 PRO 53 102.667 15.645 -0.974 405 HB3 PRO 53 HB3 PRO 53 102.141 14.879 0.538 406 HG2 PRO 53 HG2 PRO 53 103.770 13.761 -1.679 407 HG3 PRO 53 HG3 PRO 53 103.922 13.523 0.072 408 HD2 PRO 53 HD2 PRO 53 102.774 11.673 -1.586 409 HD3 PRO 53 HD3 PRO 53 102.334 11.853 0.126 410 H SER 54 H SER 54 99.957 16.535 -1.904 411 HA SER 54 HA SER 54 99.342 16.036 -4.563 412 HB2 SER 54 HB2 SER 54 99.873 18.593 -3.064 413 HB3 SER 54 HB3 SER 54 99.451 18.603 -4.772 414 HG SER 54 HG SER 54 97.955 17.201 -2.899 415 HA PRO 55 HA PRO 55 103.426 15.929 -6.167 416 HB2 PRO 55 HB2 PRO 55 102.988 15.822 -8.827 417 HB3 PRO 55 HB3 PRO 55 102.516 14.500 -7.741 418 HG2 PRO 55 HG2 PRO 55 100.842 16.578 -9.023 419 HG3 PRO 55 HG3 PRO 55 100.463 14.890 -8.644 420 HD2 PRO 55 HD2 PRO 55 99.676 17.111 -7.126 421 HD3 PRO 55 HD3 PRO 55 99.659 15.422 -6.579 422 H THR 56 H THR 56 104.784 17.635 -5.994 423 HA THR 56 HA THR 56 104.421 20.039 -7.591 424 HB THR 56 HB THR 56 106.589 20.713 -6.696 425 HG1 THR 56 HG1 THR 56 107.744 19.247 -5.496 426 HG21 THR 56 HG21 THR 56 105.286 19.347 -4.365 427 HG22 THR 56 HG22 THR 56 104.401 20.595 -5.240 428 HG23 THR 56 HG23 THR 56 105.943 20.979 -4.475 429 H SER 57 H SER 57 106.096 20.629 -9.272 430 HA SER 57 HA SER 57 106.080 18.648 -11.253 431 HB2 SER 57 HB2 SER 57 106.308 21.081 -11.701 432 HB3 SER 57 HB3 SER 57 107.947 21.022 -11.064 433 HG SER 57 HG SER 57 107.451 20.664 -13.438 434 H ASN 58 H ASN 58 107.237 16.884 -11.507 435 HA ASN 58 HA ASN 58 108.993 15.434 -11.618 436 HB2 ASN 58 HB2 ASN 58 110.619 17.937 -11.161 437 HB3 ASN 58 HB3 ASN 58 111.275 16.377 -11.650 438 HD21 ASN 58 HD21 ASN 58 111.404 18.830 -13.256 439 HD22 ASN 58 HD22 ASN 58 110.532 18.527 -14.681 440 H LYS 59 H LYS 59 107.845 16.394 -8.825 441 HA LYS 59 HA LYS 59 109.782 14.861 -7.273 442 HB2 LYS 59 HB2 LYS 59 109.130 17.739 -6.609 443 HB3 LYS 59 HB3 LYS 59 109.984 16.628 -5.541 444 HG2 LYS 59 HG2 LYS 59 111.712 16.322 -7.336 445 HG3 LYS 59 HG3 LYS 59 110.894 17.571 -8.275 446 HD2 LYS 59 HD2 LYS 59 111.185 19.150 -6.367 447 HD3 LYS 59 HD3 LYS 59 112.123 17.912 -5.529 448 HE2 LYS 59 HE2 LYS 59 113.766 19.231 -6.595 449 HE3 LYS 59 HE3 LYS 59 113.576 17.845 -7.668 450 HZ1 LYS 59 HZ1 LYS 59 112.975 20.609 -8.132 451 HZ2 LYS 59 HZ2 LYS 59 111.678 19.585 -8.524 452 HZ3 LYS 59 HZ3 LYS 59 113.197 19.349 -9.246 453 H GLN 60 H GLN 60 108.974 14.026 -5.352 454 HA GLN 60 HA GLN 60 106.454 15.000 -4.276 455 HB2 GLN 60 HB2 GLN 60 106.770 12.158 -5.247 456 HB3 GLN 60 HB3 GLN 60 105.550 12.645 -4.073 457 HG2 GLN 60 HG2 GLN 60 104.740 14.351 -5.734 458 HG3 GLN 60 HG3 GLN 60 105.855 13.650 -6.907 459 HE21 GLN 60 HE21 GLN 60 102.789 13.128 -5.212 460 HE22 GLN 60 HE22 GLN 60 102.382 11.709 -6.049 461 H ASP 61 H ASP 61 106.145 14.473 -2.091 462 HA ASP 61 HA ASP 61 108.495 13.391 -0.711 463 HB2 ASP 61 HB2 ASP 61 105.953 14.652 0.352 464 HB3 ASP 61 HB3 ASP 61 107.310 14.124 1.343 465 H ILE 62 H ILE 62 108.559 11.334 0.055 466 HA ILE 62 HA ILE 62 106.014 9.818 0.154 467 HB ILE 62 HB ILE 62 107.350 9.396 -1.923 468 HG12 ILE 62 HG12 ILE 62 107.387 6.825 -1.493 469 HG13 ILE 62 HG13 ILE 62 106.712 7.252 0.080 470 HG21 ILE 62 HG21 ILE 62 109.345 8.271 0.055 471 HG22 ILE 62 HG22 ILE 62 109.612 9.582 -1.094 472 HG23 ILE 62 HG23 ILE 62 109.367 7.934 -1.675 473 HD11 ILE 62 HD11 ILE 62 105.106 6.791 -1.973 474 HD12 ILE 62 HD12 ILE 62 105.494 8.460 -2.383 475 HD13 ILE 62 HD13 ILE 62 104.743 8.085 -0.832 476 H SER 63 H SER 63 105.881 8.174 1.756 477 HA SER 63 HA SER 63 108.096 7.959 3.639 478 HB2 SER 63 HB2 SER 63 106.933 8.836 5.533 479 HB3 SER 63 HB3 SER 63 106.832 10.043 4.257 480 HG SER 63 HG SER 63 104.775 9.812 4.505 481 H GLU 64 H GLU 64 107.727 6.432 5.356 482 HA GLU 64 HA GLU 64 106.688 4.004 4.521 483 HB2 GLU 64 HB2 GLU 64 106.949 3.283 6.857 484 HB3 GLU 64 HB3 GLU 64 108.337 4.225 6.317 485 HG2 GLU 64 HG2 GLU 64 107.335 6.245 7.367 486 HG3 GLU 64 HG3 GLU 64 106.026 5.247 7.986 487 H ALA 65 H ALA 65 105.098 6.614 6.293 488 HA ALA 65 HA ALA 65 102.926 5.174 7.329 489 HB1 ALA 65 HB1 ALA 65 103.387 8.046 6.617 490 HB2 ALA 65 HB2 ALA 65 103.085 7.319 8.195 491 HB3 ALA 65 HB3 ALA 65 101.760 7.516 7.047 492 H ASN 66 H ASN 66 103.341 6.756 4.174 493 HA ASN 66 HA ASN 66 100.629 6.357 3.363 494 HB2 ASN 66 HB2 ASN 66 103.005 6.784 1.544 495 HB3 ASN 66 HB3 ASN 66 101.311 7.128 1.207 496 HD21 ASN 66 HD21 ASN 66 100.316 8.965 2.409 497 HD22 ASN 66 HD22 ASN 66 101.301 10.200 3.026 498 H LEU 67 H LEU 67 103.678 4.676 2.633 499 HA LEU 67 HA LEU 67 102.454 2.843 0.816 500 HB2 LEU 67 HB2 LEU 67 105.162 3.043 2.088 501 HB3 LEU 67 HB3 LEU 67 104.712 1.603 1.175 502 HG LEU 67 HG LEU 67 103.973 3.229 -0.680 503 HD11 LEU 67 HD11 LEU 67 103.932 5.340 0.299 504 HD12 LEU 67 HD12 LEU 67 105.504 5.354 -0.500 505 HD13 LEU 67 HD13 LEU 67 105.402 5.046 1.231 506 HD21 LEU 67 HD21 LEU 67 106.934 3.458 -0.281 507 HD22 LEU 67 HD22 LEU 67 106.026 2.973 -1.709 508 HD23 LEU 67 HD23 LEU 67 106.237 1.840 -0.377 509 H ALA 68 H ALA 68 102.932 2.770 4.274 510 HA ALA 68 HA ALA 68 102.262 1.277 5.864 511 HB1 ALA 68 HB1 ALA 68 100.369 0.039 5.482 512 HB2 ALA 68 HB2 ALA 68 100.938 -0.555 3.923 513 HB3 ALA 68 HB3 ALA 68 100.289 1.079 4.059 514 H TYR 69 H TYR 69 102.064 -1.764 5.078 515 HA TYR 69 HA TYR 69 104.641 -2.436 5.915 516 HB2 TYR 69 HB2 TYR 69 102.688 -4.091 4.317 517 HB3 TYR 69 HB3 TYR 69 104.085 -4.716 5.174 518 HD1 TYR 69 HD2 TYR 69 104.161 -4.571 7.688 519 HD2 TYR 69 HD1 TYR 69 100.639 -3.615 5.423 520 HE1 TYR 69 HE2 TYR 69 102.783 -4.794 9.738 521 HE2 TYR 69 HE1 TYR 69 99.260 -3.839 7.472 522 HH TYR 69 HH TYR 69 100.620 -4.085 10.561 523 H LEU 70 H LEU 70 103.531 -1.603 2.740 524 HA LEU 70 HA LEU 70 105.353 -3.037 1.144 525 HB2 LEU 70 HB2 LEU 70 104.116 -0.328 0.618 526 HB3 LEU 70 HB3 LEU 70 104.850 -1.380 -0.591 527 HG LEU 70 HG LEU 70 102.478 -2.144 1.137 528 HD11 LEU 70 HD11 LEU 70 102.677 -1.143 -1.715 529 HD12 LEU 70 HD12 LEU 70 101.761 -0.428 -0.388 530 HD13 LEU 70 HD13 LEU 70 101.253 -1.969 -1.081 531 HD21 LEU 70 HD21 LEU 70 102.330 -3.928 -0.731 532 HD22 LEU 70 HD22 LEU 70 103.591 -4.136 0.484 533 HD23 LEU 70 HD23 LEU 70 103.996 -3.485 -1.105 534 H TRP 71 H TRP 71 105.888 -0.266 3.170 535 HA TRP 71 HA TRP 71 107.919 1.071 1.830 536 HB2 TRP 71 HB2 TRP 71 106.733 1.700 3.983 537 HB3 TRP 71 HB3 TRP 71 107.857 0.636 4.803 538 HD1 TRP 71 HD1 TRP 71 109.898 1.805 5.716 539 HE1 TRP 71 HE1 TRP 71 111.181 3.973 5.183 540 HE3 TRP 71 HE3 TRP 71 107.294 3.399 1.629 541 HZ2 TRP 71 HZ2 TRP 71 111.137 6.100 3.258 542 HZ3 TRP 71 HZ3 TRP 71 107.934 5.487 0.462 543 HH2 TRP 71 HH2 TRP 71 109.847 6.838 1.271 544 HA PRO 72 HA PRO 72 110.827 -2.411 2.363 545 HB2 PRO 72 HB2 PRO 72 112.438 -1.988 0.260 546 HB3 PRO 72 HB3 PRO 72 110.774 -2.569 0.051 547 HG2 PRO 72 HG2 PRO 72 111.904 0.121 -0.420 548 HG3 PRO 72 HG3 PRO 72 110.583 -0.716 -1.251 549 HD2 PRO 72 HD2 PRO 72 110.322 1.242 0.778 550 HD3 PRO 72 HD3 PRO 72 109.029 0.223 0.114 551 H LEU 73 H LEU 73 111.597 0.940 2.587 552 HA LEU 73 HA LEU 73 114.449 0.489 3.048 553 HB2 LEU 73 HB2 LEU 73 112.835 3.043 3.175 554 HB3 LEU 73 HB3 LEU 73 114.592 2.918 3.232 555 HG LEU 73 HG LEU 73 112.873 1.975 0.920 556 HD11 LEU 73 HD11 LEU 73 114.677 4.402 1.135 557 HD12 LEU 73 HD12 LEU 73 112.921 4.459 1.290 558 HD13 LEU 73 HD13 LEU 73 113.661 3.962 -0.238 559 HD21 LEU 73 HD21 LEU 73 115.148 1.951 -0.220 560 HD22 LEU 73 HD22 LEU 73 114.932 0.716 1.019 561 HD23 LEU 73 HD23 LEU 73 115.869 2.167 1.375 562 H THR 74 H THR 74 115.498 0.751 4.949 563 HA THR 74 HA THR 74 114.102 0.465 7.414 564 HB THR 74 HB THR 74 116.313 0.675 8.447 565 HG1 THR 74 HG1 THR 74 117.143 2.261 7.121 566 HG21 THR 74 HG21 THR 74 115.555 -1.415 7.141 567 HG22 THR 74 HG22 THR 74 117.275 -1.266 7.497 568 HG23 THR 74 HG23 THR 74 116.672 -0.879 5.886 569 H VAL 75 H VAL 75 115.636 3.216 5.746 570 HA VAL 75 HA VAL 75 115.199 5.107 7.819 571 HB VAL 75 HB VAL 75 115.307 6.816 5.984 572 HG11 VAL 75 HG11 VAL 75 117.520 4.815 5.603 573 HG12 VAL 75 HG12 VAL 75 117.299 5.609 7.162 574 HG13 VAL 75 HG13 VAL 75 117.622 6.571 5.720 575 HG21 VAL 75 HG21 VAL 75 114.282 5.401 4.197 576 HG22 VAL 75 HG22 VAL 75 115.726 4.391 4.206 577 HG23 VAL 75 HG23 VAL 75 115.834 6.077 3.715 578 H ASP 76 H ASP 76 113.374 6.208 8.410 579 HA ASP 76 HA ASP 76 110.972 4.829 7.870 580 HB2 ASP 76 HB2 ASP 76 111.439 7.499 9.218 581 HB3 ASP 76 HB3 ASP 76 109.898 6.647 9.211 582 H HIS 77 H HIS 77 112.293 7.804 6.501 583 HA HIS 77 HA HIS 77 110.230 7.647 4.447 584 HB2 HIS 77 HB2 HIS 77 109.699 10.063 4.656 585 HB3 HIS 77 HB3 HIS 77 109.141 9.093 6.004 586 HD1 HIS 77 HD1 HIS 77 111.225 9.050 8.009 587 HD2 HIS 77 HD2 HIS 77 110.758 12.402 5.574 588 HE1 HIS 77 HE1 HIS 77 112.310 10.981 9.234 589 H GLY 78 H GLY 78 110.647 9.437 2.774 590 HA2 GLY 78 HA2 GLY 78 113.217 10.652 2.618 591 HA3 GLY 78 HA3 GLY 78 113.126 9.209 1.613 592 H THR 79 H THR 79 113.496 11.759 0.537 593 HA THR 79 HA THR 79 110.887 12.353 -0.734 594 HB THR 79 HB THR 79 113.334 14.109 -0.897 595 HG1 THR 79 HG1 THR 79 112.145 15.157 0.882 596 HG21 THR 79 HG21 THR 79 111.337 15.789 -0.978 597 HG22 THR 79 HG22 THR 79 110.356 14.356 -1.299 598 HG23 THR 79 HG23 THR 79 111.659 14.800 -2.405 599 H ILE 80 H ILE 80 110.671 12.168 -2.929 600 HA ILE 80 HA ILE 80 112.972 11.001 -4.377 601 HB ILE 80 HB ILE 80 111.253 10.123 -5.954 602 HG12 ILE 80 HG12 ILE 80 109.277 11.061 -3.848 603 HG13 ILE 80 HG13 ILE 80 109.495 11.838 -5.413 604 HG21 ILE 80 HG21 ILE 80 110.434 8.375 -4.405 605 HG22 ILE 80 HG22 ILE 80 110.901 9.383 -3.035 606 HG23 ILE 80 HG23 ILE 80 112.133 8.749 -4.124 607 HD11 ILE 80 HD11 ILE 80 107.738 10.408 -5.892 608 HD12 ILE 80 HD12 ILE 80 108.315 9.161 -4.782 609 HD13 ILE 80 HD13 ILE 80 109.114 9.394 -6.337 610 H GLU 81 H GLU 81 113.768 11.994 -6.160 611 HA GLU 81 HA GLU 81 112.267 14.223 -7.326 612 HB2 GLU 81 HB2 GLU 81 115.032 14.543 -6.140 613 HB3 GLU 81 HB3 GLU 81 114.185 15.760 -7.097 614 HG2 GLU 81 HG2 GLU 81 112.337 15.736 -5.419 615 HG3 GLU 81 HG3 GLU 81 113.272 14.610 -4.446 616 H CYS 82 H CYS 82 112.700 14.613 -9.418 617 HA CYS 82 HA CYS 82 114.863 13.092 -10.719 618 HB2 CYS 82 HB2 CYS 82 112.412 14.510 -11.778 619 HB3 CYS 82 HB3 CYS 82 113.700 13.927 -12.832 620 H LEU 83 H LEU 83 116.724 14.129 -11.101 621 HA LEU 83 HA LEU 83 116.895 16.962 -10.499 622 HB2 LEU 83 HB2 LEU 83 118.933 14.835 -11.145 623 HB3 LEU 83 HB3 LEU 83 119.371 16.534 -10.963 624 HG LEU 83 HG LEU 83 117.765 15.102 -8.850 625 HD11 LEU 83 HD11 LEU 83 119.845 14.615 -7.671 626 HD12 LEU 83 HD12 LEU 83 120.787 15.347 -8.971 627 HD13 LEU 83 HD13 LEU 83 119.892 13.855 -9.262 628 HD21 LEU 83 HD21 LEU 83 118.886 16.883 -7.443 629 HD22 LEU 83 HD22 LEU 83 117.790 17.513 -8.673 630 HD23 LEU 83 HD23 LEU 83 119.533 17.565 -8.937 631 HA PRO 84 HA PRO 84 116.880 18.616 -14.607 632 HB2 PRO 84 HB2 PRO 84 119.183 20.208 -14.583 633 HB3 PRO 84 HB3 PRO 84 117.572 20.701 -14.034 634 HG2 PRO 84 HG2 PRO 84 119.902 19.769 -12.453 635 HG3 PRO 84 HG3 PRO 84 118.688 21.003 -12.068 636 HD2 PRO 84 HD2 PRO 84 118.603 18.561 -10.930 637 HD3 PRO 84 HD3 PRO 84 117.115 19.438 -11.354 638 H SER 85 H SER 85 119.587 16.818 -13.440 639 HA SER 85 HA SER 85 121.001 16.680 -15.953 640 HB2 SER 85 HB2 SER 85 121.295 15.138 -13.374 641 HB3 SER 85 HB3 SER 85 122.351 14.943 -14.769 642 HG SER 85 HG SER 85 123.309 16.626 -14.000 643 H ASP 86 H ASP 86 118.100 15.353 -15.170 644 HA ASP 86 HA ASP 86 116.848 13.640 -15.987 645 HB2 ASP 86 HB2 ASP 86 119.132 13.280 -17.949 646 HB3 ASP 86 HB3 ASP 86 117.531 12.565 -18.082 647 H ASN 87 H ASN 87 118.256 13.170 -13.732 648 HA ASN 87 HA ASN 87 118.766 10.263 -13.952 649 HB2 ASN 87 HB2 ASN 87 120.198 12.164 -12.078 650 HB3 ASN 87 HB3 ASN 87 120.471 10.431 -12.232 651 HD21 ASN 87 HD21 ASN 87 120.476 10.187 -15.078 652 HD22 ASN 87 HD22 ASN 87 121.811 11.040 -15.688 653 H ALA 88 H ALA 88 117.654 9.045 -12.477 654 HA ALA 88 HA ALA 88 115.799 10.489 -10.720 655 HB1 ALA 88 HB1 ALA 88 115.873 7.520 -11.274 656 HB2 ALA 88 HB2 ALA 88 115.026 8.667 -12.312 657 HB3 ALA 88 HB3 ALA 88 114.532 8.468 -10.631 658 H VAL 89 H VAL 89 116.244 10.733 -8.618 659 HA VAL 89 HA VAL 89 117.979 8.731 -7.296 660 HB VAL 89 HB VAL 89 119.100 10.577 -6.090 661 HG11 VAL 89 HG11 VAL 89 120.233 11.554 -8.229 662 HG12 VAL 89 HG12 VAL 89 119.194 10.422 -9.093 663 HG13 VAL 89 HG13 VAL 89 120.362 9.825 -7.913 664 HG21 VAL 89 HG21 VAL 89 117.640 12.365 -8.061 665 HG22 VAL 89 HG22 VAL 89 118.803 12.882 -6.839 666 HG23 VAL 89 HG23 VAL 89 117.240 12.229 -6.348 667 H PHE 90 H PHE 90 117.780 8.603 -5.053 668 HA PHE 90 HA PHE 90 115.238 9.596 -3.915 669 HB2 PHE 90 HB2 PHE 90 115.272 7.185 -4.129 670 HB3 PHE 90 HB3 PHE 90 116.848 7.099 -3.372 671 HD1 PHE 90 HD1 PHE 90 113.290 8.043 -2.737 672 HD2 PHE 90 HD2 PHE 90 117.037 6.794 -1.052 673 HE1 PHE 90 HE1 PHE 90 112.188 7.707 -0.535 674 HE2 PHE 90 HE2 PHE 90 115.936 6.449 1.144 675 HZ PHE 90 HZ PHE 90 113.508 6.910 1.400 676 H VAL 91 H VAL 91 115.421 10.949 -2.210 677 HA VAL 91 HA VAL 91 118.084 11.282 -0.964 678 HB VAL 91 HB VAL 91 115.735 13.198 -1.059 679 HG11 VAL 91 HG11 VAL 91 118.556 13.962 -0.355 680 HG12 VAL 91 HG12 VAL 91 117.515 13.291 0.896 681 HG13 VAL 91 HG13 VAL 91 117.044 14.765 0.058 682 HG21 VAL 91 HG21 VAL 91 116.751 12.886 -3.269 683 HG22 VAL 91 HG22 VAL 91 118.353 13.175 -2.590 684 HG23 VAL 91 HG23 VAL 91 117.164 14.477 -2.630 685 H ALA 92 H ALA 92 118.322 10.809 1.155 686 HA ALA 92 HA ALA 92 115.894 10.027 2.653 687 HB1 ALA 92 HB1 ALA 92 117.644 9.081 4.271 688 HB2 ALA 92 HB2 ALA 92 118.832 9.424 3.014 689 HB3 ALA 92 HB3 ALA 92 117.515 8.294 2.698 690 HA PRO 93 HA PRO 93 115.810 13.525 5.345 691 HB2 PRO 93 HB2 PRO 93 116.151 11.703 7.684 692 HB3 PRO 93 HB3 PRO 93 114.909 12.932 7.380 693 HG2 PRO 93 HG2 PRO 93 114.445 10.299 7.128 694 HG3 PRO 93 HG3 PRO 93 113.623 11.526 6.151 695 HD2 PRO 93 HD2 PRO 93 115.687 9.578 5.330 696 HD3 PRO 93 HD3 PRO 93 114.492 10.447 4.348 697 H ASP 94 H ASP 94 118.357 11.162 5.751 698 HA ASP 94 HA ASP 94 119.969 12.609 7.574 699 HB2 ASP 94 HB2 ASP 94 121.791 11.097 6.752 700 HB3 ASP 94 HB3 ASP 94 120.342 10.272 7.307 701 H GLY 95 H GLY 95 119.299 13.294 4.301 702 HA2 GLY 95 HA2 GLY 95 120.074 15.193 3.132 703 HA3 GLY 95 HA3 GLY 95 121.440 15.287 4.238 704 H THR 96 H THR 96 121.007 12.123 3.103 705 HA THR 96 HA THR 96 123.299 12.401 1.284 706 HB THR 96 HB THR 96 122.034 9.922 2.482 707 HG1 THR 96 HG1 THR 96 122.985 11.011 4.090 708 HG21 THR 96 HG21 THR 96 124.390 10.444 0.706 709 HG22 THR 96 HG22 THR 96 123.225 9.120 0.666 710 HG23 THR 96 HG23 THR 96 124.496 9.140 1.888 711 H THR 97 H THR 97 123.135 11.845 -0.859 712 HA THR 97 HA THR 97 120.424 11.195 -1.841 713 HB THR 97 HB THR 97 122.820 12.222 -3.389 714 HG1 THR 97 HG1 THR 97 120.627 13.525 -2.283 715 HG21 THR 97 HG21 THR 97 119.930 11.677 -4.044 716 HG22 THR 97 HG22 THR 97 121.373 11.169 -4.923 717 HG23 THR 97 HG23 THR 97 120.861 12.857 -4.966 718 H TYR 98 H TYR 98 120.020 9.282 -2.651 719 HA TYR 98 HA TYR 98 122.247 7.455 -3.315 720 HB2 TYR 98 HB2 TYR 98 119.430 6.808 -2.434 721 HB3 TYR 98 HB3 TYR 98 120.684 5.637 -2.787 722 HD1 TYR 98 HD2 TYR 98 122.529 5.263 -1.205 723 HD2 TYR 98 HD1 TYR 98 119.412 8.099 -0.376 724 HE1 TYR 98 HE2 TYR 98 123.225 5.334 1.174 725 HE2 TYR 98 HE1 TYR 98 120.115 8.179 2.000 726 HH TYR 98 HH TYR 98 121.678 7.484 3.473 727 H ALA 99 H ALA 99 121.951 6.131 -5.199 728 HA ALA 99 HA ALA 99 120.391 7.461 -7.270 729 HB1 ALA 99 HB1 ALA 99 121.531 5.608 -8.695 730 HB2 ALA 99 HB2 ALA 99 122.512 5.318 -7.259 731 HB3 ALA 99 HB3 ALA 99 122.538 6.899 -8.040 732 H LEU 100 H LEU 100 118.442 6.811 -7.920 733 HA LEU 100 HA LEU 100 117.263 4.398 -6.821 734 HB2 LEU 100 HB2 LEU 100 116.276 6.660 -8.538 735 HB3 LEU 100 HB3 LEU 100 115.337 5.176 -8.400 736 HG LEU 100 HG LEU 100 116.338 6.574 -5.929 737 HD11 LEU 100 HD11 LEU 100 113.698 7.100 -7.317 738 HD12 LEU 100 HD12 LEU 100 115.074 8.196 -7.403 739 HD13 LEU 100 HD13 LEU 100 114.295 7.878 -5.852 740 HD21 LEU 100 HD21 LEU 100 115.327 4.212 -5.991 741 HD22 LEU 100 HD22 LEU 100 113.805 4.992 -6.426 742 HD23 LEU 100 HD23 LEU 100 114.571 5.354 -4.879 743 H ASN 101 H ASN 101 118.095 5.697 -10.010 744 HA ASN 101 HA ASN 101 117.936 2.934 -11.103 745 HB2 ASN 101 HB2 ASN 101 117.399 3.885 -13.251 746 HB3 ASN 101 HB3 ASN 101 116.277 4.507 -12.048 747 HD21 ASN 101 HD21 ASN 101 116.217 6.137 -14.080 748 HD22 ASN 101 HD22 ASN 101 117.223 7.495 -13.913 749 H ASP 102 H ASP 102 119.343 2.619 -13.069 750 HA ASP 102 HA ASP 102 121.992 2.650 -12.237 751 HB2 ASP 102 HB2 ASP 102 122.561 1.946 -14.497 752 HB3 ASP 102 HB3 ASP 102 121.098 1.130 -13.956 753 H ARG 103 H ARG 103 120.238 5.062 -14.103 754 HA ARG 103 HA ARG 103 122.443 6.425 -15.221 755 HB2 ARG 103 HB2 ARG 103 119.680 7.384 -14.435 756 HB3 ARG 103 HB3 ARG 103 120.813 8.304 -15.428 757 HG2 ARG 103 HG2 ARG 103 120.831 6.576 -17.125 758 HG3 ARG 103 HG3 ARG 103 119.859 5.509 -16.110 759 HD2 ARG 103 HD2 ARG 103 118.412 6.558 -17.759 760 HD3 ARG 103 HD3 ARG 103 118.023 7.196 -16.165 761 HE ARG 103 HE ARG 103 118.867 9.264 -16.820 762 HH11 ARG 103 HH11 ARG 103 119.632 6.897 -19.293 763 HH12 ARG 103 HH12 ARG 103 120.144 8.107 -20.421 764 HH21 ARG 103 HH21 ARG 103 119.521 10.750 -18.268 765 HH22 ARG 103 HH22 ARG 103 120.082 10.292 -19.846 766 H ALA 104 H ALA 104 120.572 7.069 -12.256 767 HA ALA 104 HA ALA 104 122.092 9.209 -11.293 768 HB1 ALA 104 HB1 ALA 104 120.388 7.121 -9.969 769 HB2 ALA 104 HB2 ALA 104 120.082 8.847 -10.160 770 HB3 ALA 104 HB3 ALA 104 121.286 8.288 -8.998 771 H GLU 105 H GLU 105 122.575 5.716 -10.934 772 HA GLU 105 HA GLU 105 124.712 5.804 -9.105 773 HB2 GLU 105 HB2 GLU 105 123.424 3.754 -9.883 774 HB3 GLU 105 HB3 GLU 105 124.430 3.784 -11.334 775 HG2 GLU 105 HG2 GLU 105 126.456 3.725 -9.882 776 HG3 GLU 105 HG3 GLU 105 125.407 3.583 -8.476 777 H LYS 106 H LYS 106 124.678 5.912 -12.655 778 HA LYS 106 HA LYS 106 127.430 6.059 -13.125 779 HB2 LYS 106 HB2 LYS 106 125.680 5.803 -14.880 780 HB3 LYS 106 HB3 LYS 106 125.252 7.498 -14.656 781 HG2 LYS 106 HG2 LYS 106 127.594 8.135 -15.214 782 HG3 LYS 106 HG3 LYS 106 127.955 6.436 -15.527 783 HD2 LYS 106 HD2 LYS 106 126.126 6.421 -17.241 784 HD3 LYS 106 HD3 LYS 106 125.942 8.158 -16.999 785 HE2 LYS 106 HE2 LYS 106 128.046 8.643 -17.906 786 HE3 LYS 106 HE3 LYS 106 128.647 7.007 -17.633 787 HZ1 LYS 106 HZ1 LYS 106 126.341 7.145 -19.356 788 HZ2 LYS 106 HZ2 LYS 106 127.797 6.292 -19.553 789 HZ3 LYS 106 HZ3 LYS 106 127.707 7.934 -19.981 790 H ALA 107 H ALA 107 125.160 8.538 -12.111 791 HA ALA 107 HA ALA 107 126.986 10.738 -12.406 792 HB1 ALA 107 HB1 ALA 107 124.615 10.873 -10.598 793 HB2 ALA 107 HB2 ALA 107 124.355 10.688 -12.334 794 HB3 ALA 107 HB3 ALA 107 125.247 12.080 -11.720 795 H GLY 108 H GLY 108 127.395 8.282 -10.389 796 HA2 GLY 108 HA2 GLY 108 128.774 8.056 -8.592 797 HA3 GLY 108 HA3 GLY 108 129.016 9.791 -8.595 798 H HIS 109 H HIS 109 125.738 8.594 -8.356 799 HA HIS 109 HA HIS 109 125.672 9.258 -5.506 800 HB2 HIS 109 HB2 HIS 109 123.556 8.673 -7.559 801 HB3 HIS 109 HB3 HIS 109 123.189 8.793 -5.850 802 HD1 HIS 109 HD1 HIS 109 124.194 11.210 -4.778 803 HD2 HIS 109 HD2 HIS 109 123.265 11.074 -8.840 804 HE1 HIS 109 HE1 HIS 109 123.913 13.611 -5.528 805 HA PRO 110 HA PRO 110 126.326 4.740 -4.964 806 HB2 PRO 110 HB2 PRO 110 125.550 5.346 -2.148 807 HB3 PRO 110 HB3 PRO 110 126.953 4.450 -2.765 808 HG2 PRO 110 HG2 PRO 110 127.198 6.914 -1.803 809 HG3 PRO 110 HG3 PRO 110 128.160 6.354 -3.184 810 HD2 PRO 110 HD2 PRO 110 125.807 8.195 -3.159 811 HD3 PRO 110 HD3 PRO 110 127.228 8.190 -4.226 812 HA PRO 111 HA PRO 111 122.072 3.518 -5.225 813 HB2 PRO 111 HB2 PRO 111 122.173 0.857 -4.545 814 HB3 PRO 111 HB3 PRO 111 122.676 1.497 -6.120 815 HG2 PRO 111 HG2 PRO 111 124.328 0.670 -3.805 816 HG3 PRO 111 HG3 PRO 111 124.646 0.511 -5.540 817 HD2 PRO 111 HD2 PRO 111 125.805 2.437 -3.963 818 HD3 PRO 111 HD3 PRO 111 125.541 2.622 -5.709 819 H ILE 112 H ILE 112 120.199 2.869 -3.978 820 HA ILE 112 HA ILE 112 120.218 3.778 -1.313 821 HB ILE 112 HB ILE 112 118.136 2.062 -2.692 822 HG12 ILE 112 HG12 ILE 112 118.270 5.069 -2.345 823 HG13 ILE 112 HG13 ILE 112 118.762 4.239 -3.820 824 HG21 ILE 112 HG21 ILE 112 116.619 3.227 -1.000 825 HG22 ILE 112 HG22 ILE 112 118.083 3.770 -0.185 826 HG23 ILE 112 HG23 ILE 112 117.730 2.048 -0.312 827 HD11 ILE 112 HD11 ILE 112 116.002 4.013 -2.577 828 HD12 ILE 112 HD12 ILE 112 116.516 3.369 -4.139 829 HD13 ILE 112 HD13 ILE 112 116.410 5.112 -3.894 830 H THR 113 H THR 113 121.378 0.791 -2.444 831 HA THR 113 HA THR 113 120.292 -1.105 -0.850 832 HB THR 113 HB THR 113 121.999 -1.434 -2.655 833 HG1 THR 113 HG1 THR 113 122.440 -2.878 -0.332 834 HG21 THR 113 HG21 THR 113 124.342 -1.820 -1.790 835 HG22 THR 113 HG22 THR 113 123.890 -0.918 -0.346 836 HG23 THR 113 HG23 THR 113 123.871 -0.129 -1.922 837 HA PRO 114 HA PRO 114 123.415 -0.343 2.769 838 HB2 PRO 114 HB2 PRO 114 123.215 2.600 3.088 839 HB3 PRO 114 HB3 PRO 114 124.628 1.538 3.250 840 HG2 PRO 114 HG2 PRO 114 124.365 3.149 1.163 841 HG3 PRO 114 HG3 PRO 114 125.045 1.518 0.986 842 HD2 PRO 114 HD2 PRO 114 122.276 2.480 0.333 843 HD3 PRO 114 HD3 PRO 114 123.326 1.398 -0.600 844 H ILE 115 H ILE 115 120.639 1.753 2.156 845 HA ILE 115 HA ILE 115 119.652 1.299 4.886 846 HB ILE 115 HB ILE 115 117.866 2.956 4.230 847 HG12 ILE 115 HG12 ILE 115 119.746 3.589 1.941 848 HG13 ILE 115 HG13 ILE 115 118.262 2.662 1.736 849 HG21 ILE 115 HG21 ILE 115 119.697 4.874 4.194 850 HG22 ILE 115 HG22 ILE 115 120.783 3.526 4.526 851 HG23 ILE 115 HG23 ILE 115 119.444 3.872 5.621 852 HD11 ILE 115 HD11 ILE 115 118.298 5.313 1.419 853 HD12 ILE 115 HD12 ILE 115 118.073 5.283 3.167 854 HD13 ILE 115 HD13 ILE 115 116.902 4.491 2.113 855 H ARG 116 H ARG 116 119.441 -0.473 2.175 856 HA ARG 116 HA ARG 116 116.592 -0.793 1.935 857 HB2 ARG 116 HB2 ARG 116 118.209 -1.207 0.072 858 HB3 ARG 116 HB3 ARG 116 118.791 -2.623 0.948 859 HG2 ARG 116 HG2 ARG 116 116.463 -3.529 0.948 860 HG3 ARG 116 HG3 ARG 116 115.963 -2.157 -0.041 861 HD2 ARG 116 HD2 ARG 116 118.080 -4.188 -0.800 862 HD3 ARG 116 HD3 ARG 116 116.441 -4.137 -1.438 863 HE ARG 116 HE ARG 116 117.790 -1.641 -1.803 864 HH11 ARG 116 HH11 ARG 116 117.541 -4.872 -3.153 865 HH12 ARG 116 HH12 ARG 116 118.041 -4.359 -4.730 866 HH21 ARG 116 HH21 ARG 116 118.431 -1.041 -3.854 867 HH22 ARG 116 HH22 ARG 116 118.539 -2.218 -5.120 868 H ALA 117 H ALA 117 115.301 -2.378 2.777 869 HA ALA 117 HA ALA 117 116.178 -3.663 5.190 870 HB1 ALA 117 HB1 ALA 117 113.887 -4.401 5.378 871 HB2 ALA 117 HB2 ALA 117 113.588 -4.035 3.678 872 HB3 ALA 117 HB3 ALA 117 113.881 -2.725 4.824 873 H LYS 118 H LYS 118 116.427 -5.831 5.605 874 HA LYS 118 HA LYS 118 116.961 -7.552 3.316 875 HB2 LYS 118 HB2 LYS 118 117.231 -8.003 6.300 876 HB3 LYS 118 HB3 LYS 118 117.685 -9.179 5.065 877 HG2 LYS 118 HG2 LYS 118 119.322 -7.643 4.129 878 HG3 LYS 118 HG3 LYS 118 118.808 -6.368 5.235 879 HD2 LYS 118 HD2 LYS 118 120.804 -7.343 6.162 880 HD3 LYS 118 HD3 LYS 118 119.450 -7.893 7.148 881 HE2 LYS 118 HE2 LYS 118 121.008 -9.747 6.595 882 HE3 LYS 118 HE3 LYS 118 119.396 -10.023 5.937 883 HZ1 LYS 118 HZ1 LYS 118 120.092 -9.468 3.801 884 HZ2 LYS 118 HZ2 LYS 118 121.375 -10.401 4.409 885 HZ3 LYS 118 HZ3 LYS 118 121.508 -8.708 4.343 886 H GLY 119 H GLY 119 116.004 -9.663 3.121 887 HA2 GLY 119 HA2 GLY 119 113.152 -9.592 3.791 888 HA3 GLY 119 HA3 GLY 119 113.881 -10.583 2.544 889 H SER 120 H SER 120 112.540 -12.279 3.597 890 HA SER 120 HA SER 120 112.771 -13.028 6.280 891 HB2 SER 120 HB2 SER 120 112.163 -14.829 3.926 892 HB3 SER 120 HB3 SER 120 111.760 -15.135 5.612 893 HG SER 120 HG SER 120 110.477 -13.650 3.827 894 H GLY 121 H GLY 121 114.524 -14.336 3.438 895 HA2 GLY 121 HA2 GLY 121 116.768 -15.037 5.126 896 HA3 GLY 121 HA3 GLY 121 115.878 -16.425 4.517 897 H GLY 122 H GLY 122 118.391 -14.307 3.903 898 HA2 GLY 122 HA2 GLY 122 119.934 -14.263 2.204 899 HA3 GLY 122 HA3 GLY 122 119.201 -15.753 1.625 900 H GLY 123 H GLY 123 117.481 -12.686 1.944 901 HA2 GLY 123 HA2 GLY 123 117.670 -12.210 -0.941 902 HA3 GLY 123 HA3 GLY 123 116.067 -12.512 -0.278 903 H TYR 124 H TYR 124 117.016 -10.095 -1.561 904 HA TYR 124 HA TYR 124 116.841 -8.168 0.678 905 HB2 TYR 124 HB2 TYR 124 117.973 -7.996 -2.100 906 HB3 TYR 124 HB3 TYR 124 117.533 -6.547 -1.212 907 HD1 TYR 124 HD1 TYR 124 119.152 -9.760 -0.146 908 HD2 TYR 124 HD2 TYR 124 119.490 -5.492 -0.502 909 HE1 TYR 124 HE1 TYR 124 121.350 -9.837 0.998 910 HE2 TYR 124 HE2 TYR 124 121.682 -5.568 0.652 911 HH TYR 124 HH TYR 124 122.851 -8.414 2.149 912 H ILE 125 H ILE 125 115.220 -6.596 0.674 913 HA ILE 125 HA ILE 125 112.829 -7.402 -0.730 914 HB ILE 125 HB ILE 125 113.357 -5.112 1.186 915 HG12 ILE 125 HG12 ILE 125 111.859 -7.682 1.709 916 HG13 ILE 125 HG13 ILE 125 113.600 -7.586 1.942 917 HG21 ILE 125 HG21 ILE 125 111.389 -4.603 -0.145 918 HG22 ILE 125 HG22 ILE 125 110.849 -5.163 1.439 919 HG23 ILE 125 HG23 ILE 125 110.782 -6.248 0.049 920 HD11 ILE 125 HD11 ILE 125 113.427 -6.151 3.737 921 HD12 ILE 125 HD12 ILE 125 111.925 -7.054 3.929 922 HD13 ILE 125 HD13 ILE 125 111.902 -5.457 3.181 923 H SER 126 H SER 126 111.994 -6.556 -2.514 924 HA SER 126 HA SER 126 113.630 -5.050 -4.248 925 HB2 SER 126 HB2 SER 126 110.669 -5.625 -4.428 926 HB3 SER 126 HB3 SER 126 111.688 -5.053 -5.745 927 HG SER 126 HG SER 126 112.715 -6.966 -5.702 928 H LEU 127 H LEU 127 113.777 -2.979 -4.739 929 HA LEU 127 HA LEU 127 112.049 -1.030 -3.387 930 HB2 LEU 127 HB2 LEU 127 114.451 -0.543 -5.162 931 HB3 LEU 127 HB3 LEU 127 113.630 0.643 -4.153 932 HG LEU 127 HG LEU 127 115.062 -1.829 -3.130 933 HD11 LEU 127 HD11 LEU 127 116.649 -0.111 -2.195 934 HD12 LEU 127 HD12 LEU 127 115.816 1.108 -3.159 935 HD13 LEU 127 HD13 LEU 127 116.669 -0.214 -3.955 936 HD21 LEU 127 HD21 LEU 127 113.337 -1.301 -1.579 937 HD22 LEU 127 HD22 LEU 127 113.572 0.434 -1.788 938 HD23 LEU 127 HD23 LEU 127 114.779 -0.521 -0.928 939 H GLY 128 H GLY 128 111.471 -2.799 -5.982 940 HA2 GLY 128 HA2 GLY 128 111.426 -1.295 -8.271 941 HA3 GLY 128 HA3 GLY 128 110.224 -2.523 -7.900 942 H ALA 129 H ALA 129 108.904 -1.273 -5.734 943 HA ALA 129 HA ALA 129 107.019 0.254 -7.152 944 HB1 ALA 129 HB1 ALA 129 107.543 0.013 -4.183 945 HB2 ALA 129 HB2 ALA 129 106.351 -0.872 -5.136 946 HB3 ALA 129 HB3 ALA 129 106.154 0.859 -4.863 947 H LEU 130 H LEU 130 109.531 1.308 -4.854 948 HA LEU 130 HA LEU 130 108.949 4.055 -4.940 949 HB2 LEU 130 HB2 LEU 130 110.429 2.969 -3.269 950 HB3 LEU 130 HB3 LEU 130 111.638 2.720 -4.529 951 HG LEU 130 HG LEU 130 111.606 5.229 -4.907 952 HD11 LEU 130 HD11 LEU 130 110.789 6.425 -2.721 953 HD12 LEU 130 HD12 LEU 130 109.787 4.987 -2.524 954 HD13 LEU 130 HD13 LEU 130 109.607 5.997 -3.959 955 HD21 LEU 130 HD21 LEU 130 112.355 4.650 -2.054 956 HD22 LEU 130 HD22 LEU 130 113.240 5.567 -3.272 957 HD23 LEU 130 HD23 LEU 130 113.195 3.808 -3.356 958 H LEU 131 H LEU 131 111.073 2.058 -6.954 959 HA LEU 131 HA LEU 131 112.294 4.143 -8.395 960 HB2 LEU 131 HB2 LEU 131 113.058 1.772 -8.395 961 HB3 LEU 131 HB3 LEU 131 111.650 1.346 -9.367 962 HG LEU 131 HG LEU 131 112.448 3.087 -11.055 963 HD11 LEU 131 HD11 LEU 131 114.728 3.058 -9.099 964 HD12 LEU 131 HD12 LEU 131 113.987 4.430 -9.923 965 HD13 LEU 131 HD13 LEU 131 115.053 3.339 -10.808 966 HD21 LEU 131 HD21 LEU 131 114.077 1.550 -12.044 967 HD22 LEU 131 HD22 LEU 131 112.752 0.630 -11.332 968 HD23 LEU 131 HD23 LEU 131 114.298 0.749 -10.489 969 H SER 132 H SER 132 109.311 2.318 -9.018 970 HA SER 132 HA SER 132 108.802 3.351 -11.581 971 HB2 SER 132 HB2 SER 132 106.535 2.554 -11.277 972 HB3 SER 132 HB3 SER 132 107.640 1.390 -10.556 973 HG SER 132 HG SER 132 107.058 2.138 -8.602 974 H THR 133 H THR 133 107.846 4.524 -8.364 975 HA THR 133 HA THR 133 106.141 6.586 -9.251 976 HB THR 133 HB THR 133 107.853 6.581 -6.753 977 HG1 THR 133 HG1 THR 133 106.654 4.909 -6.406 978 HG21 THR 133 HG21 THR 133 105.210 7.921 -7.398 979 HG22 THR 133 HG22 THR 133 106.770 8.740 -7.307 980 HG23 THR 133 HG23 THR 133 106.070 8.013 -5.860 981 H THR 134 H THR 134 109.617 6.616 -8.486 982 HA THR 134 HA THR 134 109.972 9.389 -8.899 983 HB THR 134 HB THR 134 112.040 7.212 -9.252 984 HG1 THR 134 HG1 THR 134 111.574 6.982 -7.231 985 HG21 THR 134 HG21 THR 134 112.639 9.501 -10.070 986 HG22 THR 134 HG22 THR 134 113.620 8.983 -8.698 987 HG23 THR 134 HG23 THR 134 112.300 10.129 -8.456 988 H LEU 135 H LEU 135 110.249 6.631 -11.119 989 HA LEU 135 HA LEU 135 111.293 8.026 -13.322 990 HB2 LEU 135 HB2 LEU 135 109.492 5.599 -13.214 991 HB3 LEU 135 HB3 LEU 135 110.277 6.184 -14.682 992 HG LEU 135 HG LEU 135 111.795 5.487 -12.156 993 HD11 LEU 135 HD11 LEU 135 111.285 3.823 -14.641 994 HD12 LEU 135 HD12 LEU 135 110.698 3.470 -13.016 995 HD13 LEU 135 HD13 LEU 135 112.425 3.404 -13.362 996 HD21 LEU 135 HD21 LEU 135 112.538 6.157 -15.008 997 HD22 LEU 135 HD22 LEU 135 113.655 5.320 -13.929 998 HD23 LEU 135 HD23 LEU 135 113.087 6.940 -13.525 999 H ASN 136 H ASN 136 107.944 7.544 -12.250 1000 HA ASN 136 HA ASN 136 106.642 8.677 -14.458 1001 HB2 ASN 136 HB2 ASN 136 105.591 7.475 -12.478 1002 HB3 ASN 136 HB3 ASN 136 105.746 8.988 -11.590 1003 HD21 ASN 136 HD21 ASN 136 103.341 9.089 -11.508 1004 HD22 ASN 136 HD22 ASN 136 102.473 9.595 -12.877 1005 H LEU 137 H LEU 137 107.934 10.184 -11.521 1006 HA LEU 137 HA LEU 137 107.137 12.829 -12.075 1007 HB2 LEU 137 HB2 LEU 137 109.602 11.904 -10.581 1008 HB3 LEU 137 HB3 LEU 137 108.862 13.500 -10.475 1009 HG LEU 137 HG LEU 137 107.486 10.901 -9.732 1010 HD11 LEU 137 HD11 LEU 137 108.986 12.979 -8.158 1011 HD12 LEU 137 HD12 LEU 137 109.041 11.222 -8.015 1012 HD13 LEU 137 HD13 LEU 137 107.645 12.112 -7.407 1013 HD21 LEU 137 HD21 LEU 137 106.676 13.818 -9.543 1014 HD22 LEU 137 HD22 LEU 137 105.847 12.526 -8.677 1015 HD23 LEU 137 HD23 LEU 137 105.858 12.537 -10.438 1016 H CYS 138 H CYS 138 110.054 11.045 -12.990 1017 HA CYS 138 HA CYS 138 111.473 13.135 -14.196 1018 HB2 CYS 138 HB2 CYS 138 111.415 10.165 -14.568 1019 HB3 CYS 138 HB3 CYS 138 112.354 11.157 -15.675 1020 H GLY 139 H GLY 139 108.665 11.394 -15.364 1021 HA2 GLY 139 HA2 GLY 139 107.279 11.978 -17.136 1022 HA3 GLY 139 HA3 GLY 139 108.435 13.220 -17.596 1023 H LYS 140 H LYS 140 109.592 9.953 -17.164 1024 HA LYS 140 HA LYS 140 110.418 9.845 -19.928 1025 HB2 LYS 140 HB2 LYS 140 111.810 8.977 -18.042 1026 HB3 LYS 140 HB3 LYS 140 110.615 7.701 -17.801 1027 HG2 LYS 140 HG2 LYS 140 110.959 6.971 -20.155 1028 HG3 LYS 140 HG3 LYS 140 112.217 8.196 -20.327 1029 HD2 LYS 140 HD2 LYS 140 113.431 7.139 -18.405 1030 HD3 LYS 140 HD3 LYS 140 112.229 5.848 -18.412 1031 HE2 LYS 140 HE2 LYS 140 112.932 5.024 -20.484 1032 HE3 LYS 140 HE3 LYS 140 113.675 6.554 -20.951 1033 HZ1 LYS 140 HZ1 LYS 140 114.969 5.774 -18.653 1034 HZ2 LYS 140 HZ2 LYS 140 115.581 5.713 -20.238 1035 HZ3 LYS 140 HZ3 LYS 140 114.818 4.352 -19.566 1036 H GLY 141 H GLY 141 109.484 8.758 -21.565 1037 HA2 GLY 141 HA2 GLY 141 106.824 7.726 -21.236 1038 HA3 GLY 141 HA3 GLY 141 107.761 7.743 -22.728 Start of MODEL 10 1 H1 HIS -5 HT1 HIS -5 88.201 -18.130 3.725 2 H2 HIS -5 HT2 HIS -5 86.555 -18.070 3.313 3 H3 HIS -5 HT3 HIS -5 87.075 -19.050 4.599 4 HA HIS -5 HA HIS -5 87.813 -17.032 5.790 5 HB2 HIS -5 HB2 HIS -5 86.356 -15.717 3.487 6 HB3 HIS -5 HB3 HIS -5 86.865 -14.889 4.946 7 HD1 HIS -5 HD1 HIS -5 88.140 -16.301 1.731 8 HD2 HIS -5 HD2 HIS -5 89.684 -14.397 5.102 9 HE1 HIS -5 HE1 HIS -5 90.512 -15.634 1.152 10 H HIS -4 H HIS -4 86.492 -16.736 7.502 11 HA HIS -4 HA HIS -4 83.589 -17.217 7.136 12 HB2 HIS -4 HB2 HIS -4 84.733 -19.132 8.211 13 HB3 HIS -4 HB3 HIS -4 85.311 -18.059 9.471 14 HD1 HIS -4 HD1 HIS -4 81.938 -19.051 7.969 15 HD2 HIS -4 HD2 HIS -4 83.633 -18.073 11.651 16 HE1 HIS -4 HE1 HIS -4 80.103 -19.308 9.693 17 H HIS -3 H HIS -3 82.250 -15.770 8.053 18 HA HIS -3 HA HIS -3 83.393 -13.770 9.914 19 HB2 HIS -3 HB2 HIS -3 83.152 -12.841 7.627 20 HB3 HIS -3 HB3 HIS -3 81.443 -13.229 7.672 21 HD1 HIS -3 HD1 HIS -3 83.911 -11.228 9.796 22 HD2 HIS -3 HD2 HIS -3 79.949 -11.078 8.511 23 HE1 HIS -3 HE1 HIS -3 82.954 -9.059 10.682 24 H HIS -2 H HIS -2 81.976 -12.950 11.470 25 HA HIS -2 HA HIS -2 79.513 -14.550 11.863 26 HB2 HIS -2 HB2 HIS -2 81.272 -13.170 13.894 27 HB3 HIS -2 HB3 HIS -2 79.794 -14.041 14.258 28 HD1 HIS -2 HD1 HIS -2 79.891 -16.695 13.473 29 HD2 HIS -2 HD2 HIS -2 83.528 -14.734 14.019 30 HE1 HIS -2 HE1 HIS -2 81.644 -18.501 13.734 31 H HIS -1 H HIS -1 77.606 -13.532 12.275 32 HA HIS -1 HA HIS -1 77.600 -10.576 12.069 33 HB2 HIS -1 HB2 HIS -1 75.474 -12.578 11.295 34 HB3 HIS -1 HB3 HIS -1 75.303 -10.837 11.199 35 HD1 HIS -1 HD1 HIS -1 77.126 -9.644 9.524 36 HD2 HIS -1 HD2 HIS -1 76.498 -13.734 9.013 37 HE1 HIS -1 HE1 HIS -1 78.004 -10.221 7.221 38 H HIS 0 H HIS 0 76.504 -9.393 13.563 39 HA HIS 0 HA HIS 0 75.200 -10.871 15.779 40 HB2 HIS 0 HB2 HIS 0 77.368 -9.874 16.419 41 HB3 HIS 0 HB3 HIS 0 76.779 -8.300 15.921 42 HD1 HIS 0 HD1 HIS 0 75.696 -11.058 18.335 43 HD2 HIS 0 HD2 HIS 0 75.727 -6.899 18.041 44 HE1 HIS 0 HE1 HIS 0 74.770 -10.180 20.521 45 H SER 1 H SER 1 73.183 -10.274 16.293 46 HA SER 1 HA SER 1 71.694 -8.546 14.626 47 HB2 SER 1 HB2 SER 1 71.018 -9.553 17.401 48 HB3 SER 1 HB3 SER 1 69.881 -8.864 16.247 49 HG SER 1 HG SER 1 69.995 -10.664 15.148 50 H SER 2 H SER 2 70.626 -6.561 15.186 51 HA SER 2 HA SER 2 72.367 -4.653 16.389 52 HB2 SER 2 HB2 SER 2 70.690 -3.037 15.851 53 HB3 SER 2 HB3 SER 2 70.682 -4.216 14.544 54 HG SER 2 HG SER 2 68.605 -3.779 15.357 55 H GLY 3 H GLY 3 71.727 -3.201 18.175 56 HA2 GLY 3 HA2 GLY 3 70.870 -4.768 20.461 57 HA3 GLY 3 HA3 GLY 3 71.492 -3.121 20.494 58 H LEU 4 H LEU 4 69.533 -3.264 22.114 59 HA LEU 4 HA LEU 4 66.998 -2.711 20.722 60 HB2 LEU 4 HB2 LEU 4 67.018 -4.367 22.590 61 HB3 LEU 4 HB3 LEU 4 67.511 -3.073 23.683 62 HG LEU 4 HG LEU 4 65.447 -1.798 22.923 63 HD11 LEU 4 HD11 LEU 4 63.635 -3.402 22.034 64 HD12 LEU 4 HD12 LEU 4 64.966 -4.478 21.613 65 HD13 LEU 4 HD13 LEU 4 64.866 -2.873 20.888 66 HD21 LEU 4 HD21 LEU 4 63.906 -3.218 24.320 67 HD22 LEU 4 HD22 LEU 4 65.466 -2.908 25.082 68 HD23 LEU 4 HD23 LEU 4 65.148 -4.470 24.327 69 H VAL 5 H VAL 5 66.187 -0.711 20.590 70 HA VAL 5 HA VAL 5 67.389 1.424 22.258 71 HB VAL 5 HB VAL 5 67.102 2.946 20.330 72 HG11 VAL 5 HG11 VAL 5 69.275 1.899 20.660 73 HG12 VAL 5 HG12 VAL 5 68.929 1.957 18.932 74 HG13 VAL 5 HG13 VAL 5 68.739 0.445 19.819 75 HG21 VAL 5 HG21 VAL 5 66.506 0.433 18.742 76 HG22 VAL 5 HG22 VAL 5 66.514 2.093 18.149 77 HG23 VAL 5 HG23 VAL 5 65.261 1.564 19.272 78 HA PRO 6 HA PRO 6 63.329 2.608 23.469 79 HB2 PRO 6 HB2 PRO 6 63.722 5.407 22.558 80 HB3 PRO 6 HB3 PRO 6 63.371 4.783 24.181 81 HG2 PRO 6 HG2 PRO 6 65.772 5.735 23.531 82 HG3 PRO 6 HG3 PRO 6 65.573 4.375 24.651 83 HD2 PRO 6 HD2 PRO 6 66.434 4.334 21.782 84 HD3 PRO 6 HD3 PRO 6 66.982 3.326 23.140 85 H ARG 7 H ARG 7 61.211 3.241 22.697 86 HA ARG 7 HA ARG 7 60.685 2.492 20.033 87 HB2 ARG 7 HB2 ARG 7 58.974 4.016 22.011 88 HB3 ARG 7 HB3 ARG 7 58.387 3.341 20.490 89 HG2 ARG 7 HG2 ARG 7 59.161 1.086 21.243 90 HG3 ARG 7 HG3 ARG 7 59.596 1.793 22.800 91 HD2 ARG 7 HD2 ARG 7 56.824 1.741 21.576 92 HD3 ARG 7 HD3 ARG 7 57.375 0.773 22.939 93 HE ARG 7 HE ARG 7 57.791 3.519 23.494 94 HH11 ARG 7 HH11 ARG 7 55.163 1.208 23.222 95 HH12 ARG 7 HH12 ARG 7 54.144 2.086 24.314 96 HH21 ARG 7 HH21 ARG 7 56.435 4.607 24.892 97 HH22 ARG 7 HH22 ARG 7 54.858 3.987 25.246 98 H GLY 8 H GLY 8 60.105 3.686 18.218 99 HA2 GLY 8 HA2 GLY 8 59.925 6.536 18.201 100 HA3 GLY 8 HA3 GLY 8 61.497 5.996 17.619 101 H SER 9 H SER 9 60.355 7.265 15.734 102 HA SER 9 HA SER 9 59.088 5.247 13.974 103 HB2 SER 9 HB2 SER 9 57.444 6.958 14.725 104 HB3 SER 9 HB3 SER 9 58.475 8.210 14.041 105 HG SER 9 HG SER 9 56.812 6.489 12.814 106 H GLY 10 H GLY 10 59.795 5.185 11.873 107 HA2 GLY 10 HA2 GLY 10 62.341 6.485 11.338 108 HA3 GLY 10 HA3 GLY 10 61.552 5.271 10.335 109 H MET 11 H MET 11 62.483 7.050 8.785 110 HA MET 11 HA MET 11 60.442 9.149 8.351 111 HB2 MET 11 HB2 MET 11 63.290 8.935 7.345 112 HB3 MET 11 HB3 MET 11 62.170 10.238 6.948 113 HG2 MET 11 HG2 MET 11 61.936 10.694 9.412 114 HG3 MET 11 HG3 MET 11 63.220 9.519 9.697 115 HE1 MET 11 HE1 MET 11 63.424 13.638 7.760 116 HE2 MET 11 HE2 MET 11 62.024 12.736 8.335 117 HE3 MET 11 HE3 MET 11 62.764 12.312 6.793 118 H LYS 12 H LYS 12 59.432 9.344 6.380 119 HA LYS 12 HA LYS 12 59.286 6.939 4.786 120 HB2 LYS 12 HB2 LYS 12 57.291 8.344 5.330 121 HB3 LYS 12 HB3 LYS 12 57.960 9.617 4.306 122 HG2 LYS 12 HG2 LYS 12 57.988 8.026 2.393 123 HG3 LYS 12 HG3 LYS 12 57.229 6.810 3.421 124 HD2 LYS 12 HD2 LYS 12 55.332 8.405 3.810 125 HD3 LYS 12 HD3 LYS 12 56.063 9.494 2.631 126 HE2 LYS 12 HE2 LYS 12 55.457 6.618 1.947 127 HE3 LYS 12 HE3 LYS 12 54.241 7.883 1.771 128 HZ1 LYS 12 HZ1 LYS 12 56.902 7.771 0.463 129 HZ2 LYS 12 HZ2 LYS 12 55.865 9.115 0.397 130 HZ3 LYS 12 HZ3 LYS 12 55.388 7.637 -0.290 131 H GLU 13 H GLU 13 60.171 6.565 2.830 132 HA GLU 13 HA GLU 13 62.377 8.027 1.917 133 HB2 GLU 13 HB2 GLU 13 60.573 6.141 0.381 134 HB3 GLU 13 HB3 GLU 13 62.164 6.683 -0.153 135 HG2 GLU 13 HG2 GLU 13 61.604 5.171 2.414 136 HG3 GLU 13 HG3 GLU 13 62.270 4.464 0.947 137 H THR 14 H THR 14 62.664 9.522 0.280 138 HA THR 14 HA THR 14 60.241 10.664 -0.955 139 HB THR 14 HB THR 14 60.831 12.036 1.005 140 HG1 THR 14 HG1 THR 14 60.841 13.904 -0.151 141 HG21 THR 14 HG21 THR 14 62.924 12.974 1.357 142 HG22 THR 14 HG22 THR 14 63.371 12.874 -0.346 143 HG23 THR 14 HG23 THR 14 63.373 11.420 0.653 144 H ALA 15 H ALA 15 60.670 11.950 -2.866 145 HA ALA 15 HA ALA 15 62.435 10.682 -4.660 146 HB1 ALA 15 HB1 ALA 15 61.927 12.709 -6.121 147 HB2 ALA 15 HB2 ALA 15 60.938 13.301 -4.785 148 HB3 ALA 15 HB3 ALA 15 60.533 11.777 -5.574 149 H ALA 16 H ALA 16 64.366 11.376 -5.606 150 HA ALA 16 HA ALA 16 66.274 12.521 -3.905 151 HB1 ALA 16 HB1 ALA 16 66.553 12.637 -6.893 152 HB2 ALA 16 HB2 ALA 16 66.570 11.084 -6.058 153 HB3 ALA 16 HB3 ALA 16 67.783 12.304 -5.674 154 H ALA 17 H ALA 17 67.264 14.548 -3.855 155 HA ALA 17 HA ALA 17 65.557 16.738 -4.825 156 HB1 ALA 17 HB1 ALA 17 67.586 16.486 -2.623 157 HB2 ALA 17 HB2 ALA 17 65.906 17.014 -2.528 158 HB3 ALA 17 HB3 ALA 17 67.125 18.072 -3.241 159 H LYS 18 H LYS 18 66.378 18.456 -6.011 160 HA LYS 18 HA LYS 18 68.717 17.818 -7.626 161 HB2 LYS 18 HB2 LYS 18 66.845 20.193 -7.790 162 HB3 LYS 18 HB3 LYS 18 68.038 19.716 -8.998 163 HG2 LYS 18 HG2 LYS 18 65.689 18.010 -8.120 164 HG3 LYS 18 HG3 LYS 18 65.738 18.973 -9.595 165 HD2 LYS 18 HD2 LYS 18 67.792 17.687 -10.280 166 HD3 LYS 18 HD3 LYS 18 67.532 16.636 -8.887 167 HE2 LYS 18 HE2 LYS 18 65.550 15.750 -9.755 168 HE3 LYS 18 HE3 LYS 18 65.292 17.123 -10.832 169 HZ1 LYS 18 HZ1 LYS 18 67.494 16.328 -11.887 170 HZ2 LYS 18 HZ2 LYS 18 66.052 15.511 -12.261 171 HZ3 LYS 18 HZ3 LYS 18 67.137 14.851 -11.133 172 H PHE 19 H PHE 19 70.451 19.321 -7.962 173 HA PHE 19 HA PHE 19 71.150 20.741 -5.492 174 HB2 PHE 19 HB2 PHE 19 72.740 19.114 -6.479 175 HB3 PHE 19 HB3 PHE 19 72.833 20.109 -7.919 176 HD1 PHE 19 HD2 PHE 19 73.667 19.899 -4.322 177 HD2 PHE 19 HD1 PHE 19 74.149 22.129 -7.961 178 HE1 PHE 19 HE2 PHE 19 75.486 21.218 -3.272 179 HE2 PHE 19 HE1 PHE 19 75.968 23.449 -6.912 180 HZ PHE 19 HZ PHE 19 76.636 22.994 -4.567 181 H GLU 20 H GLU 20 71.236 22.896 -5.344 182 HA GLU 20 HA GLU 20 70.778 24.483 -7.802 183 HB2 GLU 20 HB2 GLU 20 70.081 25.100 -4.922 184 HB3 GLU 20 HB3 GLU 20 69.834 26.199 -6.279 185 HG2 GLU 20 HG2 GLU 20 67.741 25.147 -6.025 186 HG3 GLU 20 HG3 GLU 20 68.494 24.276 -7.353 187 H ARG 21 H ARG 21 71.782 26.606 -7.876 188 HA ARG 21 HA ARG 21 74.550 26.526 -7.308 189 HB2 ARG 21 HB2 ARG 21 73.499 27.872 -9.130 190 HB3 ARG 21 HB3 ARG 21 72.860 28.966 -7.902 191 HG2 ARG 21 HG2 ARG 21 75.174 29.403 -7.115 192 HG3 ARG 21 HG3 ARG 21 75.790 28.360 -8.397 193 HD2 ARG 21 HD2 ARG 21 74.673 29.838 -10.074 194 HD3 ARG 21 HD3 ARG 21 74.203 30.914 -8.762 195 HE ARG 21 HE ARG 21 76.866 30.757 -8.410 196 HH11 ARG 21 HH11 ARG 21 74.990 31.362 -11.315 197 HH12 ARG 21 HH12 ARG 21 76.236 32.322 -12.041 198 HH21 ARG 21 HH21 ARG 21 78.434 32.001 -9.396 199 HH22 ARG 21 HH22 ARG 21 78.161 32.678 -10.966 200 H GLN 22 H GLN 22 75.786 27.583 -5.764 201 HA GLN 22 HA GLN 22 74.375 28.939 -3.572 202 HB2 GLN 22 HB2 GLN 22 75.535 27.601 -1.888 203 HB3 GLN 22 HB3 GLN 22 74.551 26.570 -2.924 204 HG2 GLN 22 HG2 GLN 22 76.560 26.011 -4.261 205 HG3 GLN 22 HG3 GLN 22 77.540 27.015 -3.192 206 HE21 GLN 22 HE21 GLN 22 78.153 26.137 -1.148 207 HE22 GLN 22 HE22 GLN 22 77.742 24.565 -0.657 208 H HIS 23 H HIS 23 75.907 29.999 -2.051 209 HA HIS 23 HA HIS 23 78.238 31.057 -3.536 210 HB2 HIS 23 HB2 HIS 23 76.630 32.303 -1.303 211 HB3 HIS 23 HB3 HIS 23 78.017 33.034 -2.087 212 HD1 HIS 23 HD1 HIS 23 77.652 33.367 -4.816 213 HD2 HIS 23 HD2 HIS 23 74.233 32.982 -2.462 214 HE1 HIS 23 HE1 HIS 23 75.731 34.274 -6.192 215 H MET 24 H MET 24 80.220 31.260 -2.496 216 HA MET 24 HA MET 24 80.683 29.330 -0.387 217 HB2 MET 24 HB2 MET 24 82.593 31.257 -1.739 218 HB3 MET 24 HB3 MET 24 83.052 29.912 -0.699 219 HG2 MET 24 HG2 MET 24 81.591 29.696 -3.349 220 HG3 MET 24 HG3 MET 24 83.280 29.287 -3.064 221 HE1 MET 24 HE1 MET 24 83.020 27.778 -0.058 222 HE2 MET 24 HE2 MET 24 84.102 27.722 -1.447 223 HE3 MET 24 HE3 MET 24 83.310 26.249 -0.896 224 H ASP 25 H ASP 25 80.989 29.717 1.718 225 HA ASP 25 HA ASP 25 80.286 32.253 2.819 226 HB2 ASP 25 HB2 ASP 25 81.506 29.800 4.106 227 HB3 ASP 25 HB3 ASP 25 80.884 31.193 4.987 228 H SER 26 H SER 26 81.568 33.712 3.984 229 HA SER 26 HA SER 26 84.074 34.348 2.916 230 HB2 SER 26 HB2 SER 26 83.289 35.131 5.711 231 HB3 SER 26 HB3 SER 26 84.167 36.066 4.506 232 HG SER 26 HG SER 26 82.309 36.517 3.575 233 HA PRO 27 HA PRO 27 86.925 31.632 4.871 234 HB2 PRO 27 HB2 PRO 27 88.995 33.328 5.621 235 HB3 PRO 27 HB3 PRO 27 88.763 32.666 3.993 236 HG2 PRO 27 HG2 PRO 27 88.058 35.344 5.059 237 HG3 PRO 27 HG3 PRO 27 88.683 34.886 3.464 238 HD2 PRO 27 HD2 PRO 27 86.073 35.486 3.844 239 HD3 PRO 27 HD3 PRO 27 86.593 34.264 2.662 240 H ASP 28 H ASP 28 86.886 30.710 6.827 241 HA ASP 28 HA ASP 28 85.751 32.010 9.085 242 HB2 ASP 28 HB2 ASP 28 87.268 29.401 8.866 243 HB3 ASP 28 HB3 ASP 28 86.374 29.927 10.290 244 H LEU 29 H LEU 29 86.700 32.597 11.054 245 HA LEU 29 HA LEU 29 89.400 33.632 10.817 246 HB2 LEU 29 HB2 LEU 29 87.484 33.728 13.161 247 HB3 LEU 29 HB3 LEU 29 88.966 34.667 12.988 248 HG LEU 29 HG LEU 29 86.596 34.819 11.100 249 HD11 LEU 29 HD11 LEU 29 87.476 36.504 13.447 250 HD12 LEU 29 HD12 LEU 29 85.880 35.831 13.118 251 HD13 LEU 29 HD13 LEU 29 86.485 37.178 12.153 252 HD21 LEU 29 HD21 LEU 29 89.266 36.220 11.269 253 HD22 LEU 29 HD22 LEU 29 87.891 36.978 10.466 254 HD23 LEU 29 HD23 LEU 29 88.522 35.442 9.872 255 H GLY 30 H GLY 30 91.145 33.085 12.156 256 HA2 GLY 30 HA2 GLY 30 91.230 30.292 12.897 257 HA3 GLY 30 HA3 GLY 30 92.567 31.437 12.973 258 H THR 31 H THR 31 92.671 29.966 15.040 259 HA THR 31 HA THR 31 91.279 31.392 17.236 260 HB THR 31 HB THR 31 91.277 29.308 18.500 261 HG1 THR 31 HG1 THR 31 92.721 27.965 17.860 262 HG21 THR 31 HG21 THR 31 89.537 28.206 17.328 263 HG22 THR 31 HG22 THR 31 90.196 28.663 15.758 264 HG23 THR 31 HG23 THR 31 89.447 29.883 16.789 265 H ASP 32 H ASP 32 92.475 31.169 19.345 266 HA ASP 32 HA ASP 32 95.110 32.176 19.042 267 HB2 ASP 32 HB2 ASP 32 95.202 32.064 21.505 268 HB3 ASP 32 HB3 ASP 32 93.722 32.820 20.931 269 H ASP 33 H ASP 33 96.849 31.129 20.651 270 HA ASP 33 HA ASP 33 97.638 28.705 19.355 271 HB2 ASP 33 HB2 ASP 33 99.575 28.795 20.880 272 HB3 ASP 33 HB3 ASP 33 99.299 30.330 20.068 273 H ASP 34 H ASP 34 98.441 26.813 20.715 274 HA ASP 34 HA ASP 34 96.179 25.817 22.229 275 HB2 ASP 34 HB2 ASP 34 97.442 23.697 22.256 276 HB3 ASP 34 HB3 ASP 34 97.270 24.345 20.630 277 H ASP 35 H ASP 35 96.794 24.419 24.226 278 HA ASP 35 HA ASP 35 97.827 26.218 26.206 279 HB2 ASP 35 HB2 ASP 35 97.363 24.374 27.779 280 HB3 ASP 35 HB3 ASP 35 95.986 24.721 26.742 281 H LYS 36 H LYS 36 99.269 24.845 27.968 282 HA LYS 36 HA LYS 36 101.854 24.703 26.713 283 HB2 LYS 36 HB2 LYS 36 101.015 24.063 29.553 284 HB3 LYS 36 HB3 LYS 36 102.675 24.263 28.988 285 HG2 LYS 36 HG2 LYS 36 102.025 26.585 28.210 286 HG3 LYS 36 HG3 LYS 36 100.496 26.363 29.061 287 HD2 LYS 36 HD2 LYS 36 103.229 26.133 30.354 288 HD3 LYS 36 HD3 LYS 36 102.199 27.561 30.440 289 HE2 LYS 36 HE2 LYS 36 101.602 26.479 32.408 290 HE3 LYS 36 HE3 LYS 36 100.396 25.830 31.298 291 HZ1 LYS 36 HZ1 LYS 36 102.364 24.445 32.740 292 HZ2 LYS 36 HZ2 LYS 36 102.687 24.256 31.083 293 HZ3 LYS 36 HZ3 LYS 36 101.172 23.815 31.711 294 H THR 37 H THR 37 103.259 22.893 26.686 295 HA THR 37 HA THR 37 101.973 20.445 25.964 296 HB THR 37 HB THR 37 104.911 20.941 26.496 297 HG1 THR 37 HG1 THR 37 103.285 21.420 24.314 298 HG21 THR 37 HG21 THR 37 104.120 18.555 26.337 299 HG22 THR 37 HG22 THR 37 105.266 19.017 25.080 300 HG23 THR 37 HG23 THR 37 103.545 18.912 24.709 301 H GLY 38 H GLY 38 101.674 18.610 27.103 302 HA2 GLY 38 HA2 GLY 38 102.577 18.582 29.929 303 HA3 GLY 38 HA3 GLY 38 101.046 17.905 29.378 304 H GLY 39 H GLY 39 101.534 15.845 30.187 305 HA2 GLY 39 HA2 GLY 39 103.915 14.440 29.331 306 HA3 GLY 39 HA3 GLY 39 102.592 13.776 30.286 307 H GLY 40 H GLY 40 103.193 11.963 28.673 308 HA2 GLY 40 HA2 GLY 40 102.194 12.285 25.976 309 HA3 GLY 40 HA3 GLY 40 102.813 10.800 26.693 310 H ARG 41 H ARG 41 100.747 10.294 25.243 311 HA ARG 41 HA ARG 41 98.444 10.091 27.097 312 HB2 ARG 41 HB2 ARG 41 98.383 10.518 24.098 313 HB3 ARG 41 HB3 ARG 41 96.970 10.229 25.114 314 HG2 ARG 41 HG2 ARG 41 97.547 12.260 26.438 315 HG3 ARG 41 HG3 ARG 41 98.879 12.574 25.323 316 HD2 ARG 41 HD2 ARG 41 97.193 12.576 23.446 317 HD3 ARG 41 HD3 ARG 41 95.925 12.502 24.665 318 HE ARG 41 HE ARG 41 96.392 14.718 25.251 319 HH11 ARG 41 HH11 ARG 41 98.780 13.582 22.939 320 HH12 ARG 41 HH12 ARG 41 99.393 15.175 22.641 321 HH21 ARG 41 HH21 ARG 41 97.225 16.742 24.825 322 HH22 ARG 41 HH22 ARG 41 98.523 16.940 23.697 323 H ALA 42 H ALA 42 97.118 8.203 26.803 324 HA ALA 42 HA ALA 42 98.512 5.797 26.471 325 HB1 ALA 42 HB1 ALA 42 96.362 4.707 26.585 326 HB2 ALA 42 HB2 ALA 42 95.533 6.190 26.114 327 HB3 ALA 42 HB3 ALA 42 96.331 6.086 27.684 328 H ASP 43 H ASP 43 98.470 4.226 24.797 329 HA ASP 43 HA ASP 43 98.949 5.237 22.255 330 HB2 ASP 43 HB2 ASP 43 98.133 2.419 22.987 331 HB3 ASP 43 HB3 ASP 43 98.944 2.907 21.500 332 HA PRO 44 HA PRO 44 94.614 5.343 20.933 333 HB2 PRO 44 HB2 PRO 44 94.878 6.661 18.612 334 HB3 PRO 44 HB3 PRO 44 95.209 7.465 20.160 335 HG2 PRO 44 HG2 PRO 44 97.086 6.503 18.100 336 HG3 PRO 44 HG3 PRO 44 97.248 7.841 19.248 337 HD2 PRO 44 HD2 PRO 44 98.339 5.213 19.508 338 HD3 PRO 44 HD3 PRO 44 98.385 6.526 20.704 339 H ALA 45 H ALA 45 93.543 5.076 18.519 340 HA ALA 45 HA ALA 45 93.989 2.329 17.798 341 HB1 ALA 45 HB1 ALA 45 92.105 2.557 16.400 342 HB2 ALA 45 HB2 ALA 45 92.339 4.296 16.220 343 HB3 ALA 45 HB3 ALA 45 91.766 3.636 17.752 344 H HIS 46 H HIS 46 93.823 2.102 15.150 345 HA HIS 46 HA HIS 46 96.312 3.371 14.178 346 HB2 HIS 46 HB2 HIS 46 94.942 0.826 13.302 347 HB3 HIS 46 HB3 HIS 46 96.412 1.476 12.601 348 HD1 HIS 46 HD1 HIS 46 98.428 1.794 14.507 349 HD2 HIS 46 HD2 HIS 46 95.422 -0.981 15.310 350 HE1 HIS 46 HE1 HIS 46 99.343 0.244 16.286 351 H ARG 47 H ARG 47 96.340 4.482 12.282 352 HA ARG 47 HA ARG 47 93.715 5.043 11.057 353 HB2 ARG 47 HB2 ARG 47 95.022 6.953 11.994 354 HB3 ARG 47 HB3 ARG 47 96.294 6.609 10.823 355 HG2 ARG 47 HG2 ARG 47 94.739 6.977 8.972 356 HG3 ARG 47 HG3 ARG 47 93.416 7.240 10.109 357 HD2 ARG 47 HD2 ARG 47 94.213 9.408 9.424 358 HD3 ARG 47 HD3 ARG 47 94.736 9.150 11.085 359 HE ARG 47 HE ARG 47 96.639 8.390 9.009 360 HH11 ARG 47 HH11 ARG 47 95.643 10.862 11.294 361 HH12 ARG 47 HH12 ARG 47 97.186 11.647 11.269 362 HH21 ARG 47 HH21 ARG 47 98.605 9.443 9.019 363 HH22 ARG 47 HH22 ARG 47 98.841 10.854 9.997 364 H SER 48 H SER 48 93.381 4.838 8.874 365 HA SER 48 HA SER 48 94.970 2.910 7.495 366 HB2 SER 48 HB2 SER 48 93.432 3.702 5.532 367 HB3 SER 48 HB3 SER 48 92.727 2.831 6.889 368 HG SER 48 HG SER 48 92.007 4.743 7.658 369 HA PRO 49 HA PRO 49 98.064 5.305 5.447 370 HB2 PRO 49 HB2 PRO 49 97.062 4.242 2.841 371 HB3 PRO 49 HB3 PRO 49 98.710 4.247 3.502 372 HG2 PRO 49 HG2 PRO 49 97.243 2.032 3.457 373 HG3 PRO 49 HG3 PRO 49 98.345 2.393 4.799 374 HD2 PRO 49 HD2 PRO 49 95.369 2.524 4.730 375 HD3 PRO 49 HD3 PRO 49 96.454 2.172 6.092 376 H VAL 50 H VAL 50 98.220 7.354 4.623 377 HA VAL 50 HA VAL 50 95.711 8.666 3.908 378 HB VAL 50 HB VAL 50 98.477 9.802 4.410 379 HG11 VAL 50 HG11 VAL 50 95.811 11.237 4.307 380 HG12 VAL 50 HG12 VAL 50 96.957 11.204 2.967 381 HG13 VAL 50 HG13 VAL 50 97.406 11.965 4.494 382 HG21 VAL 50 HG21 VAL 50 97.223 10.622 6.528 383 HG22 VAL 50 HG22 VAL 50 97.727 8.933 6.475 384 HG23 VAL 50 HG23 VAL 50 96.049 9.363 6.146 385 HA PRO 51 HA PRO 51 96.610 8.543 -0.501 386 HB2 PRO 51 HB2 PRO 51 95.718 11.394 -0.555 387 HB3 PRO 51 HB3 PRO 51 95.190 10.028 -1.558 388 HG2 PRO 51 HG2 PRO 51 93.663 10.976 0.397 389 HG3 PRO 51 HG3 PRO 51 93.735 9.242 0.030 390 HD2 PRO 51 HD2 PRO 51 94.933 10.724 2.321 391 HD3 PRO 51 HD3 PRO 51 94.336 9.053 2.244 392 H LEU 52 H LEU 52 98.091 9.534 -2.067 393 HA LEU 52 HA LEU 52 100.532 10.252 -0.857 394 HB2 LEU 52 HB2 LEU 52 99.571 10.315 -3.715 395 HB3 LEU 52 HB3 LEU 52 101.202 10.811 -3.269 396 HG LEU 52 HG LEU 52 100.029 8.130 -2.497 397 HD11 LEU 52 HD11 LEU 52 100.103 7.957 -4.833 398 HD12 LEU 52 HD12 LEU 52 101.711 7.395 -4.372 399 HD13 LEU 52 HD13 LEU 52 101.487 9.041 -4.966 400 HD21 LEU 52 HD21 LEU 52 102.614 7.699 -2.445 401 HD22 LEU 52 HD22 LEU 52 101.867 8.559 -1.100 402 HD23 LEU 52 HD23 LEU 52 102.729 9.456 -2.349 403 HA PRO 53 HA PRO 53 100.074 14.718 -0.607 404 HB2 PRO 53 HB2 PRO 53 102.921 15.022 -1.350 405 HB3 PRO 53 HB3 PRO 53 102.084 15.508 0.135 406 HG2 PRO 53 HG2 PRO 53 103.807 13.463 0.060 407 HG3 PRO 53 HG3 PRO 53 102.400 13.488 1.138 408 HD2 PRO 53 HD2 PRO 53 102.777 11.977 -1.421 409 HD3 PRO 53 HD3 PRO 53 101.929 11.497 0.067 410 H SER 54 H SER 54 99.757 16.453 -2.025 411 HA SER 54 HA SER 54 99.258 15.852 -4.690 412 HB2 SER 54 HB2 SER 54 99.029 18.299 -5.015 413 HB3 SER 54 HB3 SER 54 98.214 17.746 -3.557 414 HG SER 54 HG SER 54 99.649 18.799 -2.431 415 HA PRO 55 HA PRO 55 103.374 15.859 -6.175 416 HB2 PRO 55 HB2 PRO 55 103.023 15.746 -8.848 417 HB3 PRO 55 HB3 PRO 55 102.548 14.413 -7.777 418 HG2 PRO 55 HG2 PRO 55 100.868 16.452 -9.111 419 HG3 PRO 55 HG3 PRO 55 100.515 14.756 -8.743 420 HD2 PRO 55 HD2 PRO 55 99.628 16.957 -7.252 421 HD3 PRO 55 HD3 PRO 55 99.637 15.268 -6.703 422 H THR 56 H THR 56 104.695 17.585 -5.965 423 HA THR 56 HA THR 56 104.322 20.006 -7.525 424 HB THR 56 HB THR 56 106.466 20.698 -6.585 425 HG1 THR 56 HG1 THR 56 107.695 19.257 -5.527 426 HG21 THR 56 HG21 THR 56 104.754 19.260 -4.537 427 HG22 THR 56 HG22 THR 56 104.501 20.903 -5.126 428 HG23 THR 56 HG23 THR 56 105.936 20.519 -4.175 429 H SER 57 H SER 57 106.030 20.668 -9.150 430 HA SER 57 HA SER 57 106.059 18.752 -11.193 431 HB2 SER 57 HB2 SER 57 106.271 21.197 -11.564 432 HB3 SER 57 HB3 SER 57 107.899 21.136 -10.897 433 HG SER 57 HG SER 57 108.311 20.728 -12.926 434 H ASN 58 H ASN 58 107.235 17.006 -11.491 435 HA ASN 58 HA ASN 58 109.006 15.573 -11.618 436 HB2 ASN 58 HB2 ASN 58 110.660 18.021 -10.987 437 HB3 ASN 58 HB3 ASN 58 111.257 16.504 -11.656 438 HD21 ASN 58 HD21 ASN 58 109.268 15.931 -13.575 439 HD22 ASN 58 HD22 ASN 58 109.265 17.150 -14.756 440 H LYS 59 H LYS 59 107.809 16.448 -8.808 441 HA LYS 59 HA LYS 59 109.740 14.893 -7.268 442 HB2 LYS 59 HB2 LYS 59 109.043 17.747 -6.546 443 HB3 LYS 59 HB3 LYS 59 109.904 16.623 -5.497 444 HG2 LYS 59 HG2 LYS 59 111.653 16.383 -7.279 445 HG3 LYS 59 HG3 LYS 59 110.825 17.639 -8.200 446 HD2 LYS 59 HD2 LYS 59 111.073 19.183 -6.261 447 HD3 LYS 59 HD3 LYS 59 112.017 17.944 -5.433 448 HE2 LYS 59 HE2 LYS 59 113.692 19.227 -6.439 449 HE3 LYS 59 HE3 LYS 59 113.450 17.949 -7.629 450 HZ1 LYS 59 HZ1 LYS 59 112.001 19.387 -8.875 451 HZ2 LYS 59 HZ2 LYS 59 113.486 20.173 -8.623 452 HZ3 LYS 59 HZ3 LYS 59 112.127 20.606 -7.701 453 H GLN 60 H GLN 60 108.904 13.980 -5.396 454 HA GLN 60 HA GLN 60 106.371 14.942 -4.320 455 HB2 GLN 60 HB2 GLN 60 106.742 12.105 -5.284 456 HB3 GLN 60 HB3 GLN 60 105.521 12.563 -4.100 457 HG2 GLN 60 HG2 GLN 60 104.672 14.262 -5.763 458 HG3 GLN 60 HG3 GLN 60 105.780 13.556 -6.941 459 HE21 GLN 60 HE21 GLN 60 102.733 13.031 -5.216 460 HE22 GLN 60 HE22 GLN 60 102.336 11.594 -6.028 461 H ASP 61 H ASP 61 106.069 14.443 -2.135 462 HA ASP 61 HA ASP 61 108.411 13.364 -0.736 463 HB2 ASP 61 HB2 ASP 61 105.865 14.635 0.306 464 HB3 ASP 61 HB3 ASP 61 107.214 14.107 1.308 465 H ILE 62 H ILE 62 108.464 11.304 0.022 466 HA ILE 62 HA ILE 62 105.907 9.811 0.148 467 HB ILE 62 HB ILE 62 107.198 9.362 -1.947 468 HG12 ILE 62 HG12 ILE 62 107.186 6.815 -1.563 469 HG13 ILE 62 HG13 ILE 62 106.661 7.196 0.077 470 HG21 ILE 62 HG21 ILE 62 109.475 9.543 -1.170 471 HG22 ILE 62 HG22 ILE 62 109.213 7.889 -1.722 472 HG23 ILE 62 HG23 ILE 62 109.229 8.251 0.004 473 HD11 ILE 62 HD11 ILE 62 104.621 8.047 -0.623 474 HD12 ILE 62 HD12 ILE 62 104.881 6.814 -1.855 475 HD13 ILE 62 HD13 ILE 62 105.230 8.502 -2.213 476 H SER 63 H SER 63 105.789 8.145 1.735 477 HA SER 63 HA SER 63 108.006 7.947 3.618 478 HB2 SER 63 HB2 SER 63 106.823 8.815 5.513 479 HB3 SER 63 HB3 SER 63 106.750 10.027 4.239 480 HG SER 63 HG SER 63 104.763 8.927 5.455 481 H GLU 64 H GLU 64 107.637 6.432 5.350 482 HA GLU 64 HA GLU 64 106.614 3.994 4.519 483 HB2 GLU 64 HB2 GLU 64 106.890 3.273 6.848 484 HB3 GLU 64 HB3 GLU 64 108.266 4.234 6.313 485 HG2 GLU 64 HG2 GLU 64 107.250 6.235 7.377 486 HG3 GLU 64 HG3 GLU 64 105.943 5.227 7.982 487 H ALA 65 H ALA 65 105.009 6.600 6.282 488 HA ALA 65 HA ALA 65 102.856 5.153 7.339 489 HB1 ALA 65 HB1 ALA 65 101.666 7.482 7.031 490 HB2 ALA 65 HB2 ALA 65 103.288 8.020 6.597 491 HB3 ALA 65 HB3 ALA 65 102.992 7.306 8.181 492 H ASN 66 H ASN 66 103.252 6.686 4.161 493 HA ASN 66 HA ASN 66 100.537 6.235 3.364 494 HB2 ASN 66 HB2 ASN 66 102.896 6.705 1.533 495 HB3 ASN 66 HB3 ASN 66 101.193 7.011 1.203 496 HD21 ASN 66 HD21 ASN 66 100.175 8.858 2.332 497 HD22 ASN 66 HD22 ASN 66 101.133 10.105 2.968 498 H LEU 67 H LEU 67 103.621 4.615 2.635 499 HA LEU 67 HA LEU 67 102.422 2.731 0.851 500 HB2 LEU 67 HB2 LEU 67 105.135 2.998 2.100 501 HB3 LEU 67 HB3 LEU 67 104.703 1.545 1.198 502 HG LEU 67 HG LEU 67 103.918 3.146 -0.658 503 HD11 LEU 67 HD11 LEU 67 105.330 5.001 1.228 504 HD12 LEU 67 HD12 LEU 67 103.846 5.261 0.310 505 HD13 LEU 67 HD13 LEU 67 105.410 5.301 -0.506 506 HD21 LEU 67 HD21 LEU 67 105.962 2.918 -1.706 507 HD22 LEU 67 HD22 LEU 67 106.213 1.803 -0.366 508 HD23 LEU 67 HD23 LEU 67 106.876 3.435 -0.292 509 H ALA 68 H ALA 68 102.906 2.725 4.306 510 HA ALA 68 HA ALA 68 102.289 1.240 5.924 511 HB1 ALA 68 HB1 ALA 68 100.449 -0.100 5.564 512 HB2 ALA 68 HB2 ALA 68 101.008 -0.633 3.980 513 HB3 ALA 68 HB3 ALA 68 100.301 0.971 4.170 514 H TYR 69 H TYR 69 102.170 -1.808 5.238 515 HA TYR 69 HA TYR 69 104.768 -2.411 6.039 516 HB2 TYR 69 HB2 TYR 69 102.830 -3.940 6.188 517 HB3 TYR 69 HB3 TYR 69 102.890 -4.159 4.449 518 HD1 TYR 69 HD2 TYR 69 104.650 -4.792 7.643 519 HD2 TYR 69 HD1 TYR 69 104.517 -5.611 3.428 520 HE1 TYR 69 HE2 TYR 69 106.283 -6.634 7.948 521 HE2 TYR 69 HE1 TYR 69 106.149 -7.453 3.734 522 HH TYR 69 HH TYR 69 107.640 -8.066 6.823 523 H LEU 70 H LEU 70 103.544 -1.772 2.844 524 HA LEU 70 HA LEU 70 105.367 -3.133 1.230 525 HB2 LEU 70 HB2 LEU 70 103.335 -1.954 0.430 526 HB3 LEU 70 HB3 LEU 70 104.152 -0.416 0.700 527 HG LEU 70 HG LEU 70 105.983 -1.209 -0.847 528 HD11 LEU 70 HD11 LEU 70 105.801 -3.549 -0.896 529 HD12 LEU 70 HD12 LEU 70 105.076 -3.080 -2.434 530 HD13 LEU 70 HD13 LEU 70 104.046 -3.504 -1.067 531 HD21 LEU 70 HD21 LEU 70 104.155 0.295 -1.596 532 HD22 LEU 70 HD22 LEU 70 103.182 -1.116 -2.015 533 HD23 LEU 70 HD23 LEU 70 104.678 -0.785 -2.888 534 H TRP 71 H TRP 71 105.870 -0.304 3.197 535 HA TRP 71 HA TRP 71 107.889 1.024 1.831 536 HB2 TRP 71 HB2 TRP 71 106.673 1.712 3.937 537 HB3 TRP 71 HB3 TRP 71 107.778 0.672 4.815 538 HD1 TRP 71 HD1 TRP 71 109.841 1.829 5.703 539 HE1 TRP 71 HE1 TRP 71 111.109 4.006 5.170 540 HE3 TRP 71 HE3 TRP 71 107.220 3.406 1.620 541 HZ2 TRP 71 HZ2 TRP 71 111.046 6.131 3.246 542 HZ3 TRP 71 HZ3 TRP 71 107.843 5.498 0.454 543 HH2 TRP 71 HH2 TRP 71 109.749 6.862 1.261 544 HA PRO 72 HA PRO 72 110.819 -2.417 2.476 545 HB2 PRO 72 HB2 PRO 72 112.438 -2.051 0.378 546 HB3 PRO 72 HB3 PRO 72 110.760 -2.590 0.158 547 HG2 PRO 72 HG2 PRO 72 111.953 0.083 -0.289 548 HG3 PRO 72 HG3 PRO 72 110.658 -0.743 -1.172 549 HD2 PRO 72 HD2 PRO 72 110.319 1.217 0.831 550 HD3 PRO 72 HD3 PRO 72 109.053 0.171 0.154 551 H LEU 73 H LEU 73 111.586 0.938 2.636 552 HA LEU 73 HA LEU 73 114.439 0.505 3.113 553 HB2 LEU 73 HB2 LEU 73 112.821 3.059 3.202 554 HB3 LEU 73 HB3 LEU 73 114.577 2.934 3.245 555 HG LEU 73 HG LEU 73 112.833 1.962 0.963 556 HD11 LEU 73 HD11 LEU 73 112.911 4.455 1.305 557 HD12 LEU 73 HD12 LEU 73 113.611 3.926 -0.232 558 HD13 LEU 73 HD13 LEU 73 114.662 4.375 1.112 559 HD21 LEU 73 HD21 LEU 73 115.091 1.895 -0.200 560 HD22 LEU 73 HD22 LEU 73 114.888 0.691 1.071 561 HD23 LEU 73 HD23 LEU 73 115.835 2.145 1.379 562 H THR 74 H THR 74 115.482 0.806 5.011 563 HA THR 74 HA THR 74 114.091 0.533 7.477 564 HB THR 74 HB THR 74 116.299 0.796 8.508 565 HG1 THR 74 HG1 THR 74 117.039 1.562 5.940 566 HG21 THR 74 HG21 THR 74 116.651 -0.786 5.960 567 HG22 THR 74 HG22 THR 74 115.587 -1.329 7.257 568 HG23 THR 74 HG23 THR 74 117.314 -1.131 7.558 569 H VAL 75 H VAL 75 115.565 3.298 5.776 570 HA VAL 75 HA VAL 75 115.093 5.192 7.844 571 HB VAL 75 HB VAL 75 115.192 6.896 6.012 572 HG11 VAL 75 HG11 VAL 75 117.334 4.752 6.075 573 HG12 VAL 75 HG12 VAL 75 117.241 6.183 7.101 574 HG13 VAL 75 HG13 VAL 75 117.555 6.355 5.374 575 HG21 VAL 75 HG21 VAL 75 114.178 5.498 4.217 576 HG22 VAL 75 HG22 VAL 75 115.608 4.469 4.235 577 HG23 VAL 75 HG23 VAL 75 115.740 6.152 3.740 578 H ASP 76 H ASP 76 113.243 6.245 8.428 579 HA ASP 76 HA ASP 76 110.866 4.840 7.859 580 HB2 ASP 76 HB2 ASP 76 111.290 7.511 9.219 581 HB3 ASP 76 HB3 ASP 76 109.756 6.647 9.190 582 H HIS 77 H HIS 77 112.161 7.838 6.516 583 HA HIS 77 HA HIS 77 110.122 7.656 4.437 584 HB2 HIS 77 HB2 HIS 77 109.576 10.070 4.631 585 HB3 HIS 77 HB3 HIS 77 109.010 9.103 5.977 586 HD1 HIS 77 HD1 HIS 77 111.072 9.081 8.005 587 HD2 HIS 77 HD2 HIS 77 110.613 12.419 5.551 588 HE1 HIS 77 HE1 HIS 77 112.130 11.024 9.235 589 H GLY 78 H GLY 78 110.547 9.431 2.754 590 HA2 GLY 78 HA2 GLY 78 113.101 10.682 2.634 591 HA3 GLY 78 HA3 GLY 78 113.049 9.235 1.630 592 H THR 79 H THR 79 113.393 11.784 0.549 593 HA THR 79 HA THR 79 110.790 12.341 -0.749 594 HB THR 79 HB THR 79 113.217 14.129 -0.875 595 HG1 THR 79 HG1 THR 79 112.867 14.439 1.148 596 HG21 THR 79 HG21 THR 79 110.245 14.336 -1.342 597 HG22 THR 79 HG22 THR 79 111.565 14.788 -2.425 598 HG23 THR 79 HG23 THR 79 111.203 15.782 -1.012 599 H ILE 80 H ILE 80 110.592 12.133 -2.938 600 HA ILE 80 HA ILE 80 112.923 11.000 -4.363 601 HB ILE 80 HB ILE 80 111.219 10.074 -5.944 602 HG12 ILE 80 HG12 ILE 80 109.201 10.803 -3.804 603 HG13 ILE 80 HG13 ILE 80 109.417 11.766 -5.262 604 HG21 ILE 80 HG21 ILE 80 110.271 8.454 -4.109 605 HG22 ILE 80 HG22 ILE 80 111.328 9.363 -3.027 606 HG23 ILE 80 HG23 ILE 80 112.008 8.505 -4.410 607 HD11 ILE 80 HD11 ILE 80 108.306 9.008 -4.965 608 HD12 ILE 80 HD12 ILE 80 109.155 9.414 -6.458 609 HD13 ILE 80 HD13 ILE 80 107.739 10.347 -5.967 610 H GLU 81 H GLU 81 113.714 12.002 -6.142 611 HA GLU 81 HA GLU 81 112.185 14.207 -7.320 612 HB2 GLU 81 HB2 GLU 81 114.926 14.577 -6.092 613 HB3 GLU 81 HB3 GLU 81 114.056 15.785 -7.037 614 HG2 GLU 81 HG2 GLU 81 112.196 15.690 -5.374 615 HG3 GLU 81 HG3 GLU 81 113.153 14.575 -4.410 616 H CYS 82 H CYS 82 112.672 14.633 -9.412 617 HA CYS 82 HA CYS 82 114.958 13.225 -10.637 618 HB2 CYS 82 HB2 CYS 82 112.766 14.810 -12.003 619 HB3 CYS 82 HB3 CYS 82 113.947 13.752 -12.774 620 H LEU 83 H LEU 83 116.800 14.327 -10.960 621 HA LEU 83 HA LEU 83 116.817 17.162 -10.259 622 HB2 LEU 83 HB2 LEU 83 119.096 15.258 -10.834 623 HB3 LEU 83 HB3 LEU 83 119.264 16.900 -10.217 624 HG LEU 83 HG LEU 83 117.634 14.769 -8.816 625 HD11 LEU 83 HD11 LEU 83 119.682 14.876 -7.210 626 HD12 LEU 83 HD12 LEU 83 120.548 15.510 -8.610 627 HD13 LEU 83 HD13 LEU 83 119.818 13.905 -8.677 628 HD21 LEU 83 HD21 LEU 83 118.242 16.455 -6.890 629 HD22 LEU 83 HD22 LEU 83 116.934 16.851 -8.005 630 HD23 LEU 83 HD23 LEU 83 118.526 17.579 -8.220 631 HA PRO 84 HA PRO 84 117.219 18.854 -14.337 632 HB2 PRO 84 HB2 PRO 84 119.545 20.416 -14.044 633 HB3 PRO 84 HB3 PRO 84 117.881 20.933 -13.729 634 HG2 PRO 84 HG2 PRO 84 119.960 20.010 -11.833 635 HG3 PRO 84 HG3 PRO 84 118.700 21.242 -11.628 636 HD2 PRO 84 HD2 PRO 84 118.462 18.818 -10.485 637 HD3 PRO 84 HD3 PRO 84 117.044 19.673 -11.138 638 H SER 85 H SER 85 119.779 17.008 -12.925 639 HA SER 85 HA SER 85 121.453 16.894 -15.265 640 HB2 SER 85 HB2 SER 85 121.386 15.233 -12.744 641 HB3 SER 85 HB3 SER 85 122.594 15.061 -14.012 642 HG SER 85 HG SER 85 122.050 17.522 -12.857 643 H ASP 86 H ASP 86 118.440 15.631 -14.855 644 HA ASP 86 HA ASP 86 117.231 14.039 -15.941 645 HB2 ASP 86 HB2 ASP 86 119.706 13.815 -17.674 646 HB3 ASP 86 HB3 ASP 86 118.138 13.105 -18.038 647 H ASN 87 H ASN 87 118.539 13.333 -13.604 648 HA ASN 87 HA ASN 87 118.707 10.420 -14.037 649 HB2 ASN 87 HB2 ASN 87 120.441 10.230 -12.339 650 HB3 ASN 87 HB3 ASN 87 120.993 11.277 -13.641 651 HD21 ASN 87 HD21 ASN 87 122.100 11.389 -10.975 652 HD22 ASN 87 HD22 ASN 87 121.701 12.901 -10.313 653 H ALA 88 H ALA 88 117.730 9.181 -12.417 654 HA ALA 88 HA ALA 88 115.894 10.704 -10.692 655 HB1 ALA 88 HB1 ALA 88 115.268 8.757 -12.386 656 HB2 ALA 88 HB2 ALA 88 114.422 8.941 -10.851 657 HB3 ALA 88 HB3 ALA 88 115.704 7.741 -11.012 658 H VAL 89 H VAL 89 116.272 10.853 -8.567 659 HA VAL 89 HA VAL 89 117.932 8.777 -7.272 660 HB VAL 89 HB VAL 89 119.122 10.548 -6.026 661 HG11 VAL 89 HG11 VAL 89 119.815 9.562 -8.344 662 HG12 VAL 89 HG12 VAL 89 120.668 10.980 -7.731 663 HG13 VAL 89 HG13 VAL 89 119.411 11.166 -8.956 664 HG21 VAL 89 HG21 VAL 89 117.825 12.457 -7.991 665 HG22 VAL 89 HG22 VAL 89 118.907 12.869 -6.662 666 HG23 VAL 89 HG23 VAL 89 117.286 12.264 -6.323 667 H PHE 90 H PHE 90 117.760 8.687 -5.007 668 HA PHE 90 HA PHE 90 115.203 9.662 -3.890 669 HB2 PHE 90 HB2 PHE 90 115.280 7.246 -4.116 670 HB3 PHE 90 HB3 PHE 90 116.840 7.186 -3.327 671 HD1 PHE 90 HD1 PHE 90 113.255 8.089 -2.757 672 HD2 PHE 90 HD2 PHE 90 116.985 6.869 -1.014 673 HE1 PHE 90 HE1 PHE 90 112.121 7.735 -0.570 674 HE2 PHE 90 HE2 PHE 90 115.854 6.506 1.162 675 HZ PHE 90 HZ PHE 90 113.420 6.940 1.381 676 H VAL 91 H VAL 91 115.363 11.014 -2.177 677 HA VAL 91 HA VAL 91 118.009 11.354 -0.897 678 HB VAL 91 HB VAL 91 115.646 13.251 -1.007 679 HG11 VAL 91 HG11 VAL 91 117.412 13.337 0.972 680 HG12 VAL 91 HG12 VAL 91 116.903 14.811 0.160 681 HG13 VAL 91 HG13 VAL 91 118.441 14.060 -0.262 682 HG21 VAL 91 HG21 VAL 91 116.533 13.188 -3.195 683 HG22 VAL 91 HG22 VAL 91 118.191 13.032 -2.612 684 HG23 VAL 91 HG23 VAL 91 117.338 14.568 -2.448 685 H ALA 92 H ALA 92 118.224 10.847 1.217 686 HA ALA 92 HA ALA 92 115.779 10.064 2.687 687 HB1 ALA 92 HB1 ALA 92 117.377 8.322 2.758 688 HB2 ALA 92 HB2 ALA 92 117.527 9.122 4.322 689 HB3 ALA 92 HB3 ALA 92 118.709 9.440 3.053 690 HA PRO 93 HA PRO 93 115.689 13.555 5.396 691 HB2 PRO 93 HB2 PRO 93 115.982 11.710 7.724 692 HB3 PRO 93 HB3 PRO 93 114.759 12.958 7.417 693 HG2 PRO 93 HG2 PRO 93 114.257 10.339 7.137 694 HG3 PRO 93 HG3 PRO 93 113.475 11.582 6.148 695 HD2 PRO 93 HD2 PRO 93 115.536 9.611 5.363 696 HD3 PRO 93 HD3 PRO 93 114.361 10.484 4.363 697 H ASP 94 H ASP 94 118.208 11.165 5.814 698 HA ASP 94 HA ASP 94 119.815 12.579 7.666 699 HB2 ASP 94 HB2 ASP 94 121.634 11.065 6.845 700 HB3 ASP 94 HB3 ASP 94 120.174 10.241 7.373 701 H GLY 95 H GLY 95 119.185 13.296 4.387 702 HA2 GLY 95 HA2 GLY 95 119.981 15.194 3.237 703 HA3 GLY 95 HA3 GLY 95 121.331 15.284 4.363 704 H THR 96 H THR 96 120.894 12.125 3.205 705 HA THR 96 HA THR 96 123.218 12.388 1.427 706 HB THR 96 HB THR 96 121.903 9.926 2.607 707 HG1 THR 96 HG1 THR 96 122.922 10.635 4.274 708 HG21 THR 96 HG21 THR 96 123.092 9.078 0.818 709 HG22 THR 96 HG22 THR 96 124.370 9.114 2.034 710 HG23 THR 96 HG23 THR 96 124.263 10.398 0.828 711 H THR 97 H THR 97 123.077 11.859 -0.724 712 HA THR 97 HA THR 97 120.374 11.250 -1.749 713 HB THR 97 HB THR 97 122.806 12.248 -3.260 714 HG1 THR 97 HG1 THR 97 122.234 13.979 -2.240 715 HG21 THR 97 HG21 THR 97 121.223 12.698 -5.040 716 HG22 THR 97 HG22 THR 97 119.874 12.199 -4.021 717 HG23 THR 97 HG23 THR 97 121.057 11.009 -4.564 718 H TYR 98 H TYR 98 119.952 9.358 -2.591 719 HA TYR 98 HA TYR 98 122.153 7.491 -3.222 720 HB2 TYR 98 HB2 TYR 98 119.306 6.914 -2.389 721 HB3 TYR 98 HB3 TYR 98 120.521 5.706 -2.754 722 HD1 TYR 98 HD2 TYR 98 122.388 5.298 -1.175 723 HD2 TYR 98 HD1 TYR 98 119.266 8.114 -0.295 724 HE1 TYR 98 HE2 TYR 98 123.067 5.309 1.210 725 HE2 TYR 98 HE1 TYR 98 119.956 8.137 2.085 726 HH TYR 98 HH TYR 98 121.530 7.425 3.544 727 H ALA 99 H ALA 99 121.926 6.254 -5.147 728 HA ALA 99 HA ALA 99 120.385 7.600 -7.219 729 HB1 ALA 99 HB1 ALA 99 122.630 5.631 -7.137 730 HB2 ALA 99 HB2 ALA 99 122.474 7.118 -8.071 731 HB3 ALA 99 HB3 ALA 99 121.615 5.664 -8.580 732 H LEU 100 H LEU 100 118.483 6.908 -7.977 733 HA LEU 100 HA LEU 100 117.328 4.461 -6.910 734 HB2 LEU 100 HB2 LEU 100 116.294 6.752 -8.561 735 HB3 LEU 100 HB3 LEU 100 115.373 5.258 -8.426 736 HG LEU 100 HG LEU 100 116.397 6.658 -5.961 737 HD11 LEU 100 HD11 LEU 100 113.738 7.125 -7.340 738 HD12 LEU 100 HD12 LEU 100 115.080 8.265 -7.375 739 HD13 LEU 100 HD13 LEU 100 114.287 7.883 -5.847 740 HD21 LEU 100 HD21 LEU 100 113.915 4.982 -6.444 741 HD22 LEU 100 HD22 LEU 100 114.638 5.406 -4.892 742 HD23 LEU 100 HD23 LEU 100 115.461 4.280 -5.967 743 H ASN 101 H ASN 101 118.013 5.867 -10.103 744 HA ASN 101 HA ASN 101 117.722 3.151 -11.277 745 HB2 ASN 101 HB2 ASN 101 117.092 4.205 -13.349 746 HB3 ASN 101 HB3 ASN 101 116.075 4.819 -12.052 747 HD21 ASN 101 HD21 ASN 101 115.928 6.549 -13.978 748 HD22 ASN 101 HD22 ASN 101 117.006 7.853 -13.839 749 H ASP 102 H ASP 102 118.962 2.841 -13.330 750 HA ASP 102 HA ASP 102 121.667 2.716 -12.742 751 HB2 ASP 102 HB2 ASP 102 120.290 2.687 -15.432 752 HB3 ASP 102 HB3 ASP 102 121.975 2.244 -15.175 753 H ARG 103 H ARG 103 119.889 5.293 -14.357 754 HA ARG 103 HA ARG 103 122.069 6.598 -15.581 755 HB2 ARG 103 HB2 ARG 103 119.435 7.673 -14.541 756 HB3 ARG 103 HB3 ARG 103 120.536 8.560 -15.602 757 HG2 ARG 103 HG2 ARG 103 120.334 6.843 -17.322 758 HG3 ARG 103 HG3 ARG 103 119.327 5.858 -16.260 759 HD2 ARG 103 HD2 ARG 103 117.883 7.052 -17.804 760 HD3 ARG 103 HD3 ARG 103 117.664 7.722 -16.190 761 HE ARG 103 HE ARG 103 118.726 9.684 -16.886 762 HH11 ARG 103 HH11 ARG 103 118.874 7.303 -19.460 763 HH12 ARG 103 HH12 ARG 103 119.404 8.468 -20.628 764 HH21 ARG 103 HH21 ARG 103 119.399 11.108 -18.383 765 HH22 ARG 103 HH22 ARG 103 119.703 10.625 -20.023 766 H ALA 104 H ALA 104 120.496 7.151 -12.434 767 HA ALA 104 HA ALA 104 122.232 9.140 -11.493 768 HB1 ALA 104 HB1 ALA 104 120.746 7.027 -9.918 769 HB2 ALA 104 HB2 ALA 104 120.106 8.596 -10.404 770 HB3 ALA 104 HB3 ALA 104 121.437 8.508 -9.252 771 H GLU 105 H GLU 105 122.533 5.606 -11.413 772 HA GLU 105 HA GLU 105 124.810 5.465 -9.757 773 HB2 GLU 105 HB2 GLU 105 123.997 3.647 -12.040 774 HB3 GLU 105 HB3 GLU 105 125.229 3.275 -10.836 775 HG2 GLU 105 HG2 GLU 105 122.322 3.870 -10.222 776 HG3 GLU 105 HG3 GLU 105 123.039 2.264 -10.262 777 H LYS 106 H LYS 106 124.507 5.859 -13.276 778 HA LYS 106 HA LYS 106 127.239 5.930 -13.914 779 HB2 LYS 106 HB2 LYS 106 124.920 7.409 -15.177 780 HB3 LYS 106 HB3 LYS 106 126.529 7.272 -15.887 781 HG2 LYS 106 HG2 LYS 106 126.313 4.788 -15.814 782 HG3 LYS 106 HG3 LYS 106 124.661 4.979 -15.223 783 HD2 LYS 106 HD2 LYS 106 124.124 6.302 -17.272 784 HD3 LYS 106 HD3 LYS 106 125.745 5.959 -17.878 785 HE2 LYS 106 HE2 LYS 106 125.168 3.477 -17.521 786 HE3 LYS 106 HE3 LYS 106 123.495 4.013 -17.369 787 HZ1 LYS 106 HZ1 LYS 106 123.543 3.733 -19.592 788 HZ2 LYS 106 HZ2 LYS 106 125.224 3.955 -19.708 789 HZ3 LYS 106 HZ3 LYS 106 124.195 5.300 -19.570 790 H ALA 107 H ALA 107 125.115 8.426 -12.629 791 HA ALA 107 HA ALA 107 126.937 10.599 -12.842 792 HB1 ALA 107 HB1 ALA 107 124.712 10.298 -10.826 793 HB2 ALA 107 HB2 ALA 107 124.452 10.772 -12.504 794 HB3 ALA 107 HB3 ALA 107 125.416 11.794 -11.439 795 H GLY 108 H GLY 108 127.333 7.869 -11.006 796 HA2 GLY 108 HA2 GLY 108 128.858 7.361 -9.395 797 HA3 GLY 108 HA3 GLY 108 129.380 9.033 -9.410 798 H HIS 109 H HIS 109 126.004 8.344 -8.766 799 HA HIS 109 HA HIS 109 126.354 9.125 -5.984 800 HB2 HIS 109 HB2 HIS 109 124.002 8.677 -7.784 801 HB3 HIS 109 HB3 HIS 109 123.772 8.690 -6.046 802 HD1 HIS 109 HD1 HIS 109 124.967 10.986 -4.901 803 HD2 HIS 109 HD2 HIS 109 123.705 11.171 -8.870 804 HE1 HIS 109 HE1 HIS 109 124.727 13.442 -5.461 805 HA PRO 110 HA PRO 110 126.428 4.848 -4.726 806 HB2 PRO 110 HB2 PRO 110 125.771 5.018 -2.090 807 HB3 PRO 110 HB3 PRO 110 127.343 5.554 -2.719 808 HG2 PRO 110 HG2 PRO 110 124.962 7.161 -1.968 809 HG3 PRO 110 HG3 PRO 110 126.683 7.514 -1.742 810 HD2 PRO 110 HD2 PRO 110 125.148 8.602 -3.760 811 HD3 PRO 110 HD3 PRO 110 126.912 8.415 -3.841 812 HA PRO 111 HA PRO 111 122.152 3.678 -5.086 813 HB2 PRO 111 HB2 PRO 111 122.241 1.010 -4.520 814 HB3 PRO 111 HB3 PRO 111 122.841 1.705 -6.037 815 HG2 PRO 111 HG2 PRO 111 124.339 0.737 -3.684 816 HG3 PRO 111 HG3 PRO 111 124.783 0.725 -5.396 817 HD2 PRO 111 HD2 PRO 111 125.729 2.548 -3.509 818 HD3 PRO 111 HD3 PRO 111 125.783 2.770 -5.269 819 H ILE 112 H ILE 112 120.258 2.974 -3.907 820 HA ILE 112 HA ILE 112 120.194 3.812 -1.225 821 HB ILE 112 HB ILE 112 118.181 2.111 -2.723 822 HG12 ILE 112 HG12 ILE 112 118.278 5.101 -2.239 823 HG13 ILE 112 HG13 ILE 112 118.790 4.335 -3.742 824 HG21 ILE 112 HG21 ILE 112 117.980 3.734 -0.164 825 HG22 ILE 112 HG22 ILE 112 117.737 1.997 -0.334 826 HG23 ILE 112 HG23 ILE 112 116.580 3.116 -1.036 827 HD11 ILE 112 HD11 ILE 112 116.011 4.106 -2.536 828 HD12 ILE 112 HD12 ILE 112 116.535 3.445 -4.087 829 HD13 ILE 112 HD13 ILE 112 116.450 5.191 -3.854 830 H THR 113 H THR 113 121.409 0.856 -2.399 831 HA THR 113 HA THR 113 120.289 -1.082 -0.881 832 HB THR 113 HB THR 113 122.050 -1.348 -2.654 833 HG1 THR 113 HG1 THR 113 122.579 -3.304 -1.736 834 HG21 THR 113 HG21 THR 113 124.355 -1.812 -1.720 835 HG22 THR 113 HG22 THR 113 123.871 -0.947 -0.266 836 HG23 THR 113 HG23 THR 113 123.921 -0.110 -1.817 837 HA PRO 114 HA PRO 114 123.335 -0.439 2.818 838 HB2 PRO 114 HB2 PRO 114 123.180 2.495 3.220 839 HB3 PRO 114 HB3 PRO 114 124.576 1.406 3.356 840 HG2 PRO 114 HG2 PRO 114 124.341 3.090 1.320 841 HG3 PRO 114 HG3 PRO 114 125.013 1.462 1.100 842 HD2 PRO 114 HD2 PRO 114 122.258 2.460 0.444 843 HD3 PRO 114 HD3 PRO 114 123.312 1.396 -0.504 844 H ILE 115 H ILE 115 120.571 1.666 2.206 845 HA ILE 115 HA ILE 115 119.580 1.213 4.934 846 HB ILE 115 HB ILE 115 117.801 2.875 4.287 847 HG12 ILE 115 HG12 ILE 115 119.662 3.458 1.967 848 HG13 ILE 115 HG13 ILE 115 118.149 2.573 1.797 849 HG21 ILE 115 HG21 ILE 115 120.485 4.156 3.960 850 HG22 ILE 115 HG22 ILE 115 120.146 3.262 5.444 851 HG23 ILE 115 HG23 ILE 115 119.127 4.625 4.984 852 HD11 ILE 115 HD11 ILE 115 118.313 5.252 1.491 853 HD12 ILE 115 HD12 ILE 115 117.987 5.188 3.221 854 HD13 ILE 115 HD13 ILE 115 116.862 4.447 2.085 855 H ARG 116 H ARG 116 119.362 -0.554 2.214 856 HA ARG 116 HA ARG 116 116.515 -0.930 2.036 857 HB2 ARG 116 HB2 ARG 116 118.097 -1.309 0.143 858 HB3 ARG 116 HB3 ARG 116 118.747 -2.700 1.012 859 HG2 ARG 116 HG2 ARG 116 116.582 -3.804 0.971 860 HG3 ARG 116 HG3 ARG 116 115.832 -2.380 0.245 861 HD2 ARG 116 HD2 ARG 116 116.269 -3.961 -1.529 862 HD3 ARG 116 HD3 ARG 116 117.405 -2.629 -1.700 863 HE ARG 116 HE ARG 116 118.809 -4.383 -0.205 864 HH11 ARG 116 HH11 ARG 116 116.999 -4.837 -3.179 865 HH12 ARG 116 HH12 ARG 116 118.028 -6.120 -3.726 866 HH21 ARG 116 HH21 ARG 116 120.098 -6.040 -0.962 867 HH22 ARG 116 HH22 ARG 116 119.759 -6.790 -2.485 868 H ALA 117 H ALA 117 115.265 -2.488 2.996 869 HA ALA 117 HA ALA 117 116.354 -3.695 5.388 870 HB1 ALA 117 HB1 ALA 117 113.575 -4.189 4.397 871 HB2 ALA 117 HB2 ALA 117 114.009 -2.587 4.993 872 HB3 ALA 117 HB3 ALA 117 114.153 -3.990 6.052 873 H LYS 118 H LYS 118 116.634 -5.823 5.820 874 HA LYS 118 HA LYS 118 116.311 -7.728 3.593 875 HB2 LYS 118 HB2 LYS 118 118.549 -7.549 4.691 876 HB3 LYS 118 HB3 LYS 118 117.808 -8.077 6.203 877 HG2 LYS 118 HG2 LYS 118 117.123 -10.184 5.174 878 HG3 LYS 118 HG3 LYS 118 117.764 -9.659 3.617 879 HD2 LYS 118 HD2 LYS 118 119.416 -11.095 4.639 880 HD3 LYS 118 HD3 LYS 118 120.026 -9.441 4.711 881 HE2 LYS 118 HE2 LYS 118 119.614 -9.246 7.007 882 HE3 LYS 118 HE3 LYS 118 118.422 -10.547 7.002 883 HZ1 LYS 118 HZ1 LYS 118 120.096 -11.799 7.738 884 HZ2 LYS 118 HZ2 LYS 118 121.284 -10.679 7.269 885 HZ3 LYS 118 HZ3 LYS 118 120.660 -11.783 6.138 886 H GLY 119 H GLY 119 114.991 -9.510 3.782 887 HA2 GLY 119 HA2 GLY 119 113.166 -9.511 6.094 888 HA3 GLY 119 HA3 GLY 119 112.832 -10.233 4.534 889 H SER 120 H SER 120 112.687 -11.451 7.210 890 HA SER 120 HA SER 120 114.851 -13.132 7.781 891 HB2 SER 120 HB2 SER 120 112.864 -12.771 9.258 892 HB3 SER 120 HB3 SER 120 111.919 -13.776 8.163 893 HG SER 120 HG SER 120 113.951 -14.467 9.879 894 H GLY 121 H GLY 121 112.082 -13.605 5.614 895 HA2 GLY 121 HA2 GLY 121 113.269 -16.123 4.652 896 HA3 GLY 121 HA3 GLY 121 111.625 -15.572 4.337 897 H GLY 122 H GLY 122 113.008 -16.443 2.204 898 HA2 GLY 122 HA2 GLY 122 113.638 -15.851 0.072 899 HA3 GLY 122 HA3 GLY 122 112.868 -14.302 0.400 900 H GLY 123 H GLY 123 114.168 -12.623 0.152 901 HA2 GLY 123 HA2 GLY 123 116.954 -12.790 1.077 902 HA3 GLY 123 HA3 GLY 123 116.646 -12.299 -0.585 903 H TYR 124 H TYR 124 116.686 -10.175 -0.875 904 HA TYR 124 HA TYR 124 116.050 -8.403 1.396 905 HB2 TYR 124 HB2 TYR 124 117.687 -8.067 -1.100 906 HB3 TYR 124 HB3 TYR 124 117.120 -6.677 -0.192 907 HD1 TYR 124 HD1 TYR 124 118.443 -10.016 0.886 908 HD2 TYR 124 HD2 TYR 124 118.926 -5.748 0.953 909 HE1 TYR 124 HE1 TYR 124 120.384 -10.259 2.410 910 HE2 TYR 124 HE2 TYR 124 120.861 -5.992 2.486 911 HH TYR 124 HH TYR 124 121.815 -9.114 3.729 912 H ILE 125 H ILE 125 114.706 -6.572 1.081 913 HA ILE 125 HA ILE 125 112.411 -7.262 -0.532 914 HB ILE 125 HB ILE 125 112.916 -4.922 1.326 915 HG12 ILE 125 HG12 ILE 125 111.324 -7.460 1.781 916 HG13 ILE 125 HG13 ILE 125 112.989 -7.258 2.315 917 HG21 ILE 125 HG21 ILE 125 110.282 -6.002 0.286 918 HG22 ILE 125 HG22 ILE 125 111.091 -4.589 -0.394 919 HG23 ILE 125 HG23 ILE 125 110.531 -4.564 1.277 920 HD11 ILE 125 HD11 ILE 125 111.947 -6.554 4.226 921 HD12 ILE 125 HD12 ILE 125 110.497 -6.025 3.372 922 HD13 ILE 125 HD13 ILE 125 111.941 -5.012 3.371 923 H SER 126 H SER 126 111.827 -6.432 -2.420 924 HA SER 126 HA SER 126 113.708 -5.024 -4.002 925 HB2 SER 126 HB2 SER 126 110.771 -5.535 -4.496 926 HB3 SER 126 HB3 SER 126 111.941 -5.013 -5.703 927 HG SER 126 HG SER 126 112.917 -6.945 -5.505 928 H LEU 127 H LEU 127 113.921 -2.967 -4.571 929 HA LEU 127 HA LEU 127 112.171 -0.945 -3.377 930 HB2 LEU 127 HB2 LEU 127 114.643 -0.588 -5.084 931 HB3 LEU 127 HB3 LEU 127 113.809 0.668 -4.174 932 HG LEU 127 HG LEU 127 115.121 -1.781 -2.956 933 HD11 LEU 127 HD11 LEU 127 116.733 -0.068 -2.059 934 HD12 LEU 127 HD12 LEU 127 115.983 1.120 -3.125 935 HD13 LEU 127 HD13 LEU 127 116.818 -0.276 -3.808 936 HD21 LEU 127 HD21 LEU 127 114.787 -0.372 -0.843 937 HD22 LEU 127 HD22 LEU 127 113.327 -1.077 -1.538 938 HD23 LEU 127 HD23 LEU 127 113.695 0.627 -1.802 939 H GLY 128 H GLY 128 111.719 -2.798 -5.976 940 HA2 GLY 128 HA2 GLY 128 111.696 -1.307 -8.275 941 HA3 GLY 128 HA3 GLY 128 110.518 -2.566 -7.931 942 H ALA 129 H ALA 129 109.129 -1.334 -5.789 943 HA ALA 129 HA ALA 129 107.227 0.132 -7.254 944 HB1 ALA 129 HB1 ALA 129 106.671 -1.066 -5.186 945 HB2 ALA 129 HB2 ALA 129 106.206 0.631 -5.066 946 HB3 ALA 129 HB3 ALA 129 107.666 0.056 -4.259 947 H LEU 130 H LEU 130 109.667 1.259 -4.914 948 HA LEU 130 HA LEU 130 109.017 3.990 -5.018 949 HB2 LEU 130 HB2 LEU 130 110.512 2.945 -3.330 950 HB3 LEU 130 HB3 LEU 130 111.742 2.742 -4.577 951 HG LEU 130 HG LEU 130 111.606 5.255 -4.957 952 HD11 LEU 130 HD11 LEU 130 110.751 6.411 -2.769 953 HD12 LEU 130 HD12 LEU 130 109.818 4.930 -2.559 954 HD13 LEU 130 HD13 LEU 130 109.578 5.928 -3.994 955 HD21 LEU 130 HD21 LEU 130 112.398 4.704 -2.111 956 HD22 LEU 130 HD22 LEU 130 113.240 5.642 -3.343 957 HD23 LEU 130 HD23 LEU 130 113.254 3.883 -3.415 958 H LEU 131 H LEU 131 111.214 2.042 -7.000 959 HA LEU 131 HA LEU 131 112.413 4.144 -8.427 960 HB2 LEU 131 HB2 LEU 131 113.209 1.783 -8.425 961 HB3 LEU 131 HB3 LEU 131 111.817 1.340 -9.410 962 HG LEU 131 HG LEU 131 112.616 3.107 -11.082 963 HD11 LEU 131 HD11 LEU 131 115.220 3.349 -10.821 964 HD12 LEU 131 HD12 LEU 131 114.886 3.052 -9.115 965 HD13 LEU 131 HD13 LEU 131 114.153 4.435 -9.929 966 HD21 LEU 131 HD21 LEU 131 114.125 1.559 -12.134 967 HD22 LEU 131 HD22 LEU 131 112.938 0.592 -11.258 968 HD23 LEU 131 HD23 LEU 131 114.551 0.830 -10.587 969 H SER 132 H SER 132 109.475 2.265 -9.096 970 HA SER 132 HA SER 132 108.967 3.306 -11.655 971 HB2 SER 132 HB2 SER 132 106.932 2.388 -9.610 972 HB3 SER 132 HB3 SER 132 106.688 2.509 -11.349 973 HG SER 132 HG SER 132 107.422 0.546 -11.271 974 H THR 133 H THR 133 107.934 4.430 -8.445 975 HA THR 133 HA THR 133 106.207 6.468 -9.341 976 HB THR 133 HB THR 133 107.877 6.473 -6.814 977 HG1 THR 133 HG1 THR 133 105.519 5.209 -7.510 978 HG21 THR 133 HG21 THR 133 106.126 7.905 -5.937 979 HG22 THR 133 HG22 THR 133 105.188 7.731 -7.420 980 HG23 THR 133 HG23 THR 133 106.718 8.608 -7.443 981 H THR 134 H THR 134 109.673 6.551 -8.534 982 HA THR 134 HA THR 134 109.981 9.338 -8.896 983 HB THR 134 HB THR 134 112.096 7.206 -9.262 984 HG1 THR 134 HG1 THR 134 110.989 8.412 -7.026 985 HG21 THR 134 HG21 THR 134 113.651 8.953 -8.757 986 HG22 THR 134 HG22 THR 134 112.360 10.057 -8.284 987 HG23 THR 134 HG23 THR 134 112.562 9.611 -9.978 988 H LEU 135 H LEU 135 110.366 6.616 -11.154 989 HA LEU 135 HA LEU 135 111.394 8.077 -13.322 990 HB2 LEU 135 HB2 LEU 135 109.660 5.597 -13.283 991 HB3 LEU 135 HB3 LEU 135 110.464 6.225 -14.723 992 HG LEU 135 HG LEU 135 111.933 5.520 -12.169 993 HD11 LEU 135 HD11 LEU 135 111.502 3.899 -14.698 994 HD12 LEU 135 HD12 LEU 135 110.938 3.485 -13.078 995 HD13 LEU 135 HD13 LEU 135 112.664 3.490 -13.436 996 HD21 LEU 135 HD21 LEU 135 113.843 5.435 -13.905 997 HD22 LEU 135 HD22 LEU 135 113.232 7.031 -13.463 998 HD23 LEU 135 HD23 LEU 135 112.733 6.285 -14.982 999 H ASN 136 H ASN 136 108.053 7.486 -12.288 1000 HA ASN 136 HA ASN 136 106.743 8.574 -14.516 1001 HB2 ASN 136 HB2 ASN 136 105.918 8.557 -11.604 1002 HB3 ASN 136 HB3 ASN 136 104.848 8.958 -12.947 1003 HD21 ASN 136 HD21 ASN 136 104.457 6.684 -11.154 1004 HD22 ASN 136 HD22 ASN 136 104.583 5.279 -12.100 1005 H LEU 137 H LEU 137 107.925 10.121 -11.545 1006 HA LEU 137 HA LEU 137 107.012 12.729 -12.108 1007 HB2 LEU 137 HB2 LEU 137 109.512 11.918 -10.606 1008 HB3 LEU 137 HB3 LEU 137 108.718 13.488 -10.523 1009 HG LEU 137 HG LEU 137 107.455 10.851 -9.714 1010 HD11 LEU 137 HD11 LEU 137 108.993 11.287 -8.011 1011 HD12 LEU 137 HD12 LEU 137 107.570 12.150 -7.426 1012 HD13 LEU 137 HD13 LEU 137 108.879 13.034 -8.212 1013 HD21 LEU 137 HD21 LEU 137 106.511 13.732 -9.595 1014 HD22 LEU 137 HD22 LEU 137 105.741 12.421 -8.702 1015 HD23 LEU 137 HD23 LEU 137 105.753 12.397 -10.463 1016 H CYS 138 H CYS 138 110.015 11.076 -12.984 1017 HA CYS 138 HA CYS 138 111.344 13.288 -14.093 1018 HB2 CYS 138 HB2 CYS 138 111.590 10.365 -14.808 1019 HB3 CYS 138 HB3 CYS 138 112.723 11.621 -15.282 1020 H GLY 139 H GLY 139 108.778 11.317 -15.416 1021 HA2 GLY 139 HA2 GLY 139 107.449 11.887 -17.259 1022 HA3 GLY 139 HA3 GLY 139 108.660 13.065 -17.743 1023 H LYS 140 H LYS 140 109.715 9.817 -17.026 1024 HA LYS 140 HA LYS 140 110.375 9.448 -19.861 1025 HB2 LYS 140 HB2 LYS 140 111.264 7.961 -17.378 1026 HB3 LYS 140 HB3 LYS 140 111.794 7.583 -19.018 1027 HG2 LYS 140 HG2 LYS 140 112.653 9.913 -19.240 1028 HG3 LYS 140 HG3 LYS 140 112.219 10.204 -17.555 1029 HD2 LYS 140 HD2 LYS 140 113.693 8.300 -16.890 1030 HD3 LYS 140 HD3 LYS 140 114.198 8.146 -18.573 1031 HE2 LYS 140 HE2 LYS 140 114.474 10.705 -16.978 1032 HE3 LYS 140 HE3 LYS 140 115.766 9.516 -17.145 1033 HZ1 LYS 140 HZ1 LYS 140 114.741 11.413 -19.071 1034 HZ2 LYS 140 HZ2 LYS 140 115.008 9.853 -19.689 1035 HZ3 LYS 140 HZ3 LYS 140 116.280 10.707 -18.954 1036 H GLY 141 H GLY 141 109.716 7.675 -21.054 1037 HA2 GLY 141 HA2 GLY 141 107.244 6.426 -20.160 1038 HA3 GLY 141 HA3 GLY 141 107.958 6.303 -21.765 Start of MODEL 11 1 H1 HIS -5 HT1 HIS -5 70.972 -31.450 -21.026 2 H2 HIS -5 HT2 HIS -5 71.290 -31.502 -22.695 3 H3 HIS -5 HT3 HIS -5 71.646 -30.100 -21.803 4 HA HIS -5 HA HIS -5 73.130 -31.751 -20.435 5 HB2 HIS -5 HB2 HIS -5 72.346 -33.677 -21.809 6 HB3 HIS -5 HB3 HIS -5 73.058 -32.924 -23.223 7 HD1 HIS -5 HD1 HIS -5 74.224 -34.024 -19.753 8 HD2 HIS -5 HD2 HIS -5 75.605 -33.854 -23.684 9 HE1 HIS -5 HE1 HIS -5 76.524 -35.080 -19.750 10 H HIS -4 H HIS -4 75.473 -31.579 -21.009 11 HA HIS -4 HA HIS -4 75.962 -29.252 -22.783 12 HB2 HIS -4 HB2 HIS -4 77.358 -30.057 -20.228 13 HB3 HIS -4 HB3 HIS -4 77.880 -28.757 -21.283 14 HD1 HIS -4 HD1 HIS -4 75.306 -29.664 -18.729 15 HD2 HIS -4 HD2 HIS -4 76.247 -26.407 -21.156 16 HE1 HIS -4 HE1 HIS -4 73.940 -27.713 -17.870 17 H HIS -3 H HIS -3 77.604 -29.376 -24.233 18 HA HIS -3 HA HIS -3 79.156 -31.902 -24.325 19 HB2 HIS -3 HB2 HIS -3 78.075 -30.244 -26.606 20 HB3 HIS -3 HB3 HIS -3 79.164 -31.605 -26.790 21 HD1 HIS -3 HD1 HIS -3 75.606 -30.722 -26.073 22 HD2 HIS -3 HD2 HIS -3 77.939 -34.164 -26.379 23 HE1 HIS -3 HE1 HIS -3 73.995 -32.673 -26.166 24 H HIS -2 H HIS -2 81.318 -31.765 -24.779 25 HA HIS -2 HA HIS -2 82.470 -29.036 -24.881 26 HB2 HIS -2 HB2 HIS -2 83.646 -31.584 -23.761 27 HB3 HIS -2 HB3 HIS -2 84.466 -30.036 -23.834 28 HD1 HIS -2 HD1 HIS -2 83.109 -28.043 -22.459 29 HD2 HIS -2 HD2 HIS -2 82.301 -31.993 -21.401 30 HE1 HIS -2 HE1 HIS -2 82.048 -27.965 -20.162 31 H HIS -1 H HIS -1 83.933 -28.554 -26.440 32 HA HIS -1 HA HIS -1 84.631 -30.693 -28.372 33 HB2 HIS -1 HB2 HIS -1 84.041 -27.784 -28.928 34 HB3 HIS -1 HB3 HIS -1 84.576 -28.957 -30.116 35 HD1 HIS -1 HD1 HIS -1 82.841 -31.110 -30.348 36 HD2 HIS -1 HD2 HIS -1 81.307 -27.576 -28.753 37 HE1 HIS -1 HE1 HIS -1 80.323 -31.267 -30.552 38 H HIS 0 H HIS 0 86.703 -30.709 -29.178 39 HA HIS 0 HA HIS 0 88.626 -28.876 -27.864 40 HB2 HIS 0 HB2 HIS 0 88.989 -31.709 -28.844 41 HB3 HIS 0 HB3 HIS 0 90.279 -30.694 -28.228 42 HD1 HIS 0 HD1 HIS 0 87.336 -32.734 -27.163 43 HD2 HIS 0 HD2 HIS 0 90.236 -30.321 -25.387 44 HE1 HIS 0 HE1 HIS 0 87.194 -33.160 -24.672 45 H SER 1 H SER 1 90.093 -27.801 -29.096 46 HA SER 1 HA SER 1 90.148 -28.341 -32.000 47 HB2 SER 1 HB2 SER 1 89.984 -25.973 -32.491 48 HB3 SER 1 HB3 SER 1 88.597 -26.448 -31.518 49 HG SER 1 HG SER 1 90.659 -24.805 -30.916 50 H SER 2 H SER 2 92.030 -27.420 -33.076 51 HA SER 2 HA SER 2 94.428 -27.897 -31.620 52 HB2 SER 2 HB2 SER 2 95.567 -27.390 -33.659 53 HB3 SER 2 HB3 SER 2 94.078 -28.214 -34.111 54 HG SER 2 HG SER 2 94.596 -26.187 -35.205 55 H GLY 3 H GLY 3 96.230 -26.315 -31.477 56 HA2 GLY 3 HA2 GLY 3 95.288 -23.890 -30.204 57 HA3 GLY 3 HA3 GLY 3 96.956 -24.448 -30.292 58 H LEU 4 H LEU 4 96.973 -21.943 -30.678 59 HA LEU 4 HA LEU 4 96.462 -21.251 -33.478 60 HB2 LEU 4 HB2 LEU 4 97.489 -19.529 -31.209 61 HB3 LEU 4 HB3 LEU 4 96.984 -18.964 -32.800 62 HG LEU 4 HG LEU 4 95.186 -20.409 -30.830 63 HD11 LEU 4 HD11 LEU 4 95.221 -17.485 -31.636 64 HD12 LEU 4 HD12 LEU 4 95.874 -18.105 -30.120 65 HD13 LEU 4 HD13 LEU 4 94.148 -18.239 -30.457 66 HD21 LEU 4 HD21 LEU 4 94.297 -20.828 -32.969 67 HD22 LEU 4 HD22 LEU 4 94.819 -19.264 -33.594 68 HD23 LEU 4 HD23 LEU 4 93.454 -19.357 -32.482 69 H VAL 5 H VAL 5 98.039 -20.712 -34.942 70 HA VAL 5 HA VAL 5 100.580 -21.931 -34.665 71 HB VAL 5 HB VAL 5 101.111 -20.797 -36.801 72 HG11 VAL 5 HG11 VAL 5 99.754 -22.889 -36.740 73 HG12 VAL 5 HG12 VAL 5 99.348 -21.863 -38.116 74 HG13 VAL 5 HG13 VAL 5 98.290 -21.906 -36.707 75 HG21 VAL 5 HG21 VAL 5 99.904 -18.665 -36.222 76 HG22 VAL 5 HG22 VAL 5 98.380 -19.515 -36.485 77 HG23 VAL 5 HG23 VAL 5 99.506 -19.290 -37.824 78 HA PRO 6 HA PRO 6 102.932 -18.832 -32.593 79 HB2 PRO 6 HB2 PRO 6 105.342 -18.870 -33.940 80 HB3 PRO 6 HB3 PRO 6 104.857 -20.069 -32.727 81 HG2 PRO 6 HG2 PRO 6 104.789 -20.249 -35.692 82 HG3 PRO 6 HG3 PRO 6 105.209 -21.485 -34.491 83 HD2 PRO 6 HD2 PRO 6 102.795 -21.451 -35.729 84 HD3 PRO 6 HD3 PRO 6 102.997 -22.024 -34.058 85 H ARG 7 H ARG 7 102.987 -16.656 -32.691 86 HA ARG 7 HA ARG 7 103.080 -15.356 -35.355 87 HB2 ARG 7 HB2 ARG 7 101.433 -14.596 -32.931 88 HB3 ARG 7 HB3 ARG 7 101.578 -13.621 -34.393 89 HG2 ARG 7 HG2 ARG 7 100.713 -15.556 -35.718 90 HG3 ARG 7 HG3 ARG 7 100.456 -16.431 -34.207 91 HD2 ARG 7 HD2 ARG 7 99.170 -13.799 -34.988 92 HD3 ARG 7 HD3 ARG 7 98.369 -15.367 -34.920 93 HE ARG 7 HE ARG 7 99.515 -14.873 -32.406 94 HH11 ARG 7 HH11 ARG 7 96.952 -13.549 -34.405 95 HH12 ARG 7 HH12 ARG 7 96.040 -12.994 -33.042 96 HH21 ARG 7 HH21 ARG 7 98.297 -14.136 -30.690 97 HH22 ARG 7 HH22 ARG 7 96.793 -13.323 -30.965 98 H GLY 8 H GLY 8 104.082 -13.302 -35.446 99 HA2 GLY 8 HA2 GLY 8 106.284 -13.010 -33.587 100 HA3 GLY 8 HA3 GLY 8 105.994 -12.040 -35.029 101 H SER 9 H SER 9 106.763 -10.459 -33.203 102 HA SER 9 HA SER 9 104.872 -9.674 -31.220 103 HB2 SER 9 HB2 SER 9 106.331 -7.831 -30.800 104 HB3 SER 9 HB3 SER 9 107.364 -9.195 -31.214 105 HG SER 9 HG SER 9 106.604 -7.052 -32.820 106 H GLY 10 H GLY 10 103.755 -7.599 -31.148 107 HA2 GLY 10 HA2 GLY 10 103.337 -5.869 -33.281 108 HA3 GLY 10 HA3 GLY 10 102.152 -7.161 -33.456 109 H MET 11 H MET 11 100.839 -5.030 -33.143 110 HA MET 11 HA MET 11 100.451 -4.436 -30.287 111 HB2 MET 11 HB2 MET 11 99.409 -3.076 -32.782 112 HB3 MET 11 HB3 MET 11 99.020 -2.579 -31.135 113 HG2 MET 11 HG2 MET 11 101.452 -2.282 -30.683 114 HG3 MET 11 HG3 MET 11 101.788 -2.681 -32.368 115 HE1 MET 11 HE1 MET 11 102.539 0.989 -32.615 116 HE2 MET 11 HE2 MET 11 103.101 -0.681 -32.579 117 HE3 MET 11 HE3 MET 11 102.762 0.160 -31.069 118 H LYS 12 H LYS 12 98.649 -5.017 -29.201 119 HA LYS 12 HA LYS 12 96.399 -6.190 -30.715 120 HB2 LYS 12 HB2 LYS 12 97.969 -7.948 -29.748 121 HB3 LYS 12 HB3 LYS 12 97.459 -7.388 -28.155 122 HG2 LYS 12 HG2 LYS 12 95.048 -7.724 -29.019 123 HG3 LYS 12 HG3 LYS 12 95.786 -8.674 -30.309 124 HD2 LYS 12 HD2 LYS 12 96.318 -9.187 -27.374 125 HD3 LYS 12 HD3 LYS 12 95.052 -10.014 -28.283 126 HE2 LYS 12 HE2 LYS 12 96.645 -11.001 -29.777 127 HE3 LYS 12 HE3 LYS 12 97.946 -9.980 -29.165 128 HZ1 LYS 12 HZ1 LYS 12 98.149 -11.203 -27.277 129 HZ2 LYS 12 HZ2 LYS 12 97.610 -12.429 -28.321 130 HZ3 LYS 12 HZ3 LYS 12 96.520 -11.678 -27.256 131 H GLU 13 H GLU 13 94.433 -5.573 -30.018 132 HA GLU 13 HA GLU 13 94.100 -3.443 -28.226 133 HB2 GLU 13 HB2 GLU 13 92.088 -5.515 -29.135 134 HB3 GLU 13 HB3 GLU 13 91.686 -3.997 -28.331 135 HG2 GLU 13 HG2 GLU 13 92.819 -2.759 -30.168 136 HG3 GLU 13 HG3 GLU 13 93.119 -4.286 -30.986 137 H THR 14 H THR 14 93.453 -3.320 -26.092 138 HA THR 14 HA THR 14 93.524 -5.852 -24.548 139 HB THR 14 HB THR 14 94.589 -4.627 -22.728 140 HG1 THR 14 HG1 THR 14 95.111 -2.503 -23.049 141 HG21 THR 14 HG21 THR 14 96.007 -5.664 -24.495 142 HG22 THR 14 HG22 THR 14 96.770 -4.257 -23.754 143 HG23 THR 14 HG23 THR 14 96.026 -4.120 -25.348 144 H ALA 15 H ALA 15 92.335 -5.797 -22.522 145 HA ALA 15 HA ALA 15 90.300 -3.717 -22.249 146 HB1 ALA 15 HB1 ALA 15 88.467 -5.368 -22.184 147 HB2 ALA 15 HB2 ALA 15 89.605 -6.641 -22.624 148 HB3 ALA 15 HB3 ALA 15 89.254 -5.340 -23.762 149 H ALA 16 H ALA 16 89.184 -3.818 -20.193 150 HA ALA 16 HA ALA 16 90.880 -4.406 -18.026 151 HB1 ALA 16 HB1 ALA 16 89.113 -3.701 -16.634 152 HB2 ALA 16 HB2 ALA 16 87.883 -4.220 -17.786 153 HB3 ALA 16 HB3 ALA 16 88.869 -2.798 -18.128 154 H ALA 17 H ALA 17 90.992 -6.100 -16.603 155 HA ALA 17 HA ALA 17 89.146 -8.346 -16.866 156 HB1 ALA 17 HB1 ALA 17 92.067 -8.987 -17.029 157 HB2 ALA 17 HB2 ALA 17 91.200 -8.536 -18.497 158 HB3 ALA 17 HB3 ALA 17 90.680 -9.938 -17.562 159 H LYS 18 H LYS 18 89.391 -9.913 -15.142 160 HA LYS 18 HA LYS 18 89.918 -8.714 -12.621 161 HB2 LYS 18 HB2 LYS 18 88.278 -10.562 -13.006 162 HB3 LYS 18 HB3 LYS 18 89.636 -11.662 -13.248 163 HG2 LYS 18 HG2 LYS 18 90.479 -11.081 -10.981 164 HG3 LYS 18 HG3 LYS 18 89.057 -10.066 -10.736 165 HD2 LYS 18 HD2 LYS 18 87.620 -12.078 -11.157 166 HD3 LYS 18 HD3 LYS 18 89.085 -13.060 -11.210 167 HE2 LYS 18 HE2 LYS 18 88.196 -13.198 -8.968 168 HE3 LYS 18 HE3 LYS 18 89.649 -12.202 -8.908 169 HZ1 LYS 18 HZ1 LYS 18 87.056 -10.904 -9.351 170 HZ2 LYS 18 HZ2 LYS 18 88.451 -10.300 -8.595 171 HZ3 LYS 18 HZ3 LYS 18 87.455 -11.410 -7.782 172 H PHE 19 H PHE 19 91.643 -8.884 -11.250 173 HA PHE 19 HA PHE 19 94.121 -9.955 -12.435 174 HB2 PHE 19 HB2 PHE 19 93.678 -7.991 -10.185 175 HB3 PHE 19 HB3 PHE 19 95.249 -8.549 -10.729 176 HD1 PHE 19 HD2 PHE 19 96.082 -7.920 -12.993 177 HD2 PHE 19 HD1 PHE 19 92.432 -6.330 -11.380 178 HE1 PHE 19 HE2 PHE 19 96.114 -6.116 -14.696 179 HE2 PHE 19 HE1 PHE 19 92.465 -4.527 -13.082 180 HZ PHE 19 HZ PHE 19 94.306 -4.420 -14.741 181 H GLU 20 H GLU 20 95.200 -11.600 -11.536 182 HA GLU 20 HA GLU 20 94.076 -12.813 -9.095 183 HB2 GLU 20 HB2 GLU 20 94.229 -14.191 -11.185 184 HB3 GLU 20 HB3 GLU 20 95.984 -14.032 -11.104 185 HG2 GLU 20 HG2 GLU 20 95.938 -15.034 -8.825 186 HG3 GLU 20 HG3 GLU 20 94.202 -15.263 -8.984 187 H ARG 21 H ARG 21 95.387 -13.357 -7.352 188 HA ARG 21 HA ARG 21 97.428 -11.599 -6.663 189 HB2 ARG 21 HB2 ARG 21 97.874 -13.085 -4.785 190 HB3 ARG 21 HB3 ARG 21 96.137 -12.941 -5.042 191 HG2 ARG 21 HG2 ARG 21 96.235 -15.079 -6.376 192 HG3 ARG 21 HG3 ARG 21 97.918 -15.247 -5.876 193 HD2 ARG 21 HD2 ARG 21 97.174 -15.143 -3.493 194 HD3 ARG 21 HD3 ARG 21 95.504 -15.120 -4.050 195 HE ARG 21 HE ARG 21 97.330 -17.395 -4.089 196 HH11 ARG 21 HH11 ARG 21 94.254 -16.099 -5.179 197 HH12 ARG 21 HH12 ARG 21 93.603 -17.667 -5.523 198 HH21 ARG 21 HH21 ARG 21 96.437 -19.385 -4.552 199 HH22 ARG 21 HH22 ARG 21 94.825 -19.503 -5.173 200 H GLN 22 H GLN 22 99.671 -11.758 -6.539 201 HA GLN 22 HA GLN 22 100.913 -13.014 -8.770 202 HB2 GLN 22 HB2 GLN 22 102.200 -11.800 -6.313 203 HB3 GLN 22 HB3 GLN 22 102.998 -12.136 -7.848 204 HG2 GLN 22 HG2 GLN 22 100.698 -10.204 -7.431 205 HG3 GLN 22 HG3 GLN 22 102.382 -9.760 -7.693 206 HE21 GLN 22 HE21 GLN 22 99.609 -9.683 -9.339 207 HE22 GLN 22 HE22 GLN 22 100.140 -10.097 -10.897 208 H HIS 23 H HIS 23 102.379 -14.717 -8.842 209 HA HIS 23 HA HIS 23 102.344 -16.543 -6.505 210 HB2 HIS 23 HB2 HIS 23 102.402 -17.233 -9.446 211 HB3 HIS 23 HB3 HIS 23 102.498 -18.388 -8.130 212 HD1 HIS 23 HD1 HIS 23 100.287 -18.295 -6.459 213 HD2 HIS 23 HD2 HIS 23 99.835 -16.781 -10.317 214 HE1 HIS 23 HE1 HIS 23 97.797 -18.222 -6.911 215 H MET 24 H MET 24 104.243 -17.594 -5.980 216 HA MET 24 HA MET 24 106.687 -16.613 -7.345 217 HB2 MET 24 HB2 MET 24 106.258 -17.306 -4.428 218 HB3 MET 24 HB3 MET 24 107.809 -16.870 -5.148 219 HG2 MET 24 HG2 MET 24 106.773 -14.705 -5.901 220 HG3 MET 24 HG3 MET 24 105.333 -15.132 -4.976 221 HE1 MET 24 HE1 MET 24 109.479 -13.934 -3.560 222 HE2 MET 24 HE2 MET 24 108.900 -14.300 -5.184 223 HE3 MET 24 HE3 MET 24 109.298 -15.613 -4.079 224 H ASP 25 H ASP 25 108.578 -18.097 -7.058 225 HA ASP 25 HA ASP 25 107.991 -20.651 -8.092 226 HB2 ASP 25 HB2 ASP 25 110.509 -19.625 -6.762 227 HB3 ASP 25 HB3 ASP 25 110.393 -21.129 -7.671 228 H SER 26 H SER 26 108.006 -22.693 -7.172 229 HA SER 26 HA SER 26 106.943 -22.925 -4.574 230 HB2 SER 26 HB2 SER 26 107.104 -25.312 -4.901 231 HB3 SER 26 HB3 SER 26 106.643 -24.579 -6.433 232 HG SER 26 HG SER 26 108.745 -24.809 -7.076 233 HA PRO 27 HA PRO 27 110.731 -23.060 -2.261 234 HB2 PRO 27 HB2 PRO 27 109.886 -24.036 0.105 235 HB3 PRO 27 HB3 PRO 27 109.366 -22.445 -0.485 236 HG2 PRO 27 HG2 PRO 27 107.880 -24.997 -0.384 237 HG3 PRO 27 HG3 PRO 27 107.290 -23.333 -0.238 238 HD2 PRO 27 HD2 PRO 27 107.178 -24.944 -2.558 239 HD3 PRO 27 HD3 PRO 27 106.855 -23.200 -2.466 240 H ASP 28 H ASP 28 111.853 -24.692 -0.560 241 HA ASP 28 HA ASP 28 112.426 -27.082 -2.073 242 HB2 ASP 28 HB2 ASP 28 114.180 -25.796 -0.861 243 HB3 ASP 28 HB3 ASP 28 113.424 -26.256 0.662 244 H LEU 29 H LEU 29 111.444 -28.985 -1.857 245 HA LEU 29 HA LEU 29 109.460 -29.363 0.220 246 HB2 LEU 29 HB2 LEU 29 110.376 -31.263 -1.952 247 HB3 LEU 29 HB3 LEU 29 108.936 -31.440 -0.952 248 HG LEU 29 HG LEU 29 109.459 -29.116 -2.828 249 HD11 LEU 29 HD11 LEU 29 109.064 -31.248 -4.026 250 HD12 LEU 29 HD12 LEU 29 107.707 -30.138 -4.225 251 HD13 LEU 29 HD13 LEU 29 107.585 -31.487 -3.096 252 HD21 LEU 29 HD21 LEU 29 108.013 -28.320 -1.141 253 HD22 LEU 29 HD22 LEU 29 107.204 -29.879 -0.975 254 HD23 LEU 29 HD23 LEU 29 106.903 -28.875 -2.394 255 H GLY 30 H GLY 30 109.502 -30.873 1.856 256 HA2 GLY 30 HA2 GLY 30 111.660 -32.738 2.200 257 HA3 GLY 30 HA3 GLY 30 111.811 -31.338 3.258 258 H THR 31 H THR 31 111.358 -32.248 5.210 259 HA THR 31 HA THR 31 109.426 -34.214 5.734 260 HB THR 31 HB THR 31 111.195 -33.677 7.330 261 HG1 THR 31 HG1 THR 31 109.905 -33.931 9.009 262 HG21 THR 31 HG21 THR 31 111.397 -31.291 7.004 263 HG22 THR 31 HG22 THR 31 110.968 -31.571 8.691 264 HG23 THR 31 HG23 THR 31 109.740 -31.030 7.547 265 H ASP 32 H ASP 32 107.475 -33.861 7.159 266 HA ASP 32 HA ASP 32 105.582 -32.287 5.792 267 HB2 ASP 32 HB2 ASP 32 105.468 -33.496 8.563 268 HB3 ASP 32 HB3 ASP 32 104.085 -32.825 7.702 269 H ASP 33 H ASP 33 104.611 -30.339 6.264 270 HA ASP 33 HA ASP 33 106.237 -28.418 7.645 271 HB2 ASP 33 HB2 ASP 33 104.481 -26.818 7.004 272 HB3 ASP 33 HB3 ASP 33 104.978 -27.807 5.632 273 H ASP 34 H ASP 34 104.846 -26.766 9.058 274 HA ASP 34 HA ASP 34 104.365 -28.062 11.519 275 HB2 ASP 34 HB2 ASP 34 103.580 -25.293 10.585 276 HB3 ASP 34 HB3 ASP 34 103.505 -25.848 12.255 277 H ASP 35 H ASP 35 102.433 -28.356 12.686 278 HA ASP 35 HA ASP 35 100.284 -29.444 11.248 279 HB2 ASP 35 HB2 ASP 35 100.379 -28.420 14.095 280 HB3 ASP 35 HB3 ASP 35 99.085 -29.411 13.426 281 H LYS 36 H LYS 36 98.143 -28.711 10.943 282 HA LYS 36 HA LYS 36 97.907 -26.080 9.985 283 HB2 LYS 36 HB2 LYS 36 96.480 -28.001 9.278 284 HB3 LYS 36 HB3 LYS 36 95.661 -27.921 10.839 285 HG2 LYS 36 HG2 LYS 36 94.926 -25.639 10.381 286 HG3 LYS 36 HG3 LYS 36 95.820 -25.629 8.860 287 HD2 LYS 36 HD2 LYS 36 93.506 -26.103 8.348 288 HD3 LYS 36 HD3 LYS 36 94.426 -27.591 8.115 289 HE2 LYS 36 HE2 LYS 36 93.711 -28.449 10.259 290 HE3 LYS 36 HE3 LYS 36 92.953 -26.911 10.674 291 HZ1 LYS 36 HZ1 LYS 36 91.428 -27.205 8.822 292 HZ2 LYS 36 HZ2 LYS 36 91.322 -28.510 9.904 293 HZ3 LYS 36 HZ3 LYS 36 92.152 -28.689 8.433 294 H THR 37 H THR 37 97.204 -24.208 10.861 295 HA THR 37 HA THR 37 97.062 -24.053 13.754 296 HB THR 37 HB THR 37 96.998 -21.637 13.413 297 HG1 THR 37 HG1 THR 37 96.446 -20.865 11.555 298 HG21 THR 37 HG21 THR 37 99.168 -22.898 13.214 299 HG22 THR 37 HG22 THR 37 99.145 -21.363 12.344 300 HG23 THR 37 HG23 THR 37 98.953 -22.880 11.465 301 H GLY 38 H GLY 38 95.328 -22.681 14.760 302 HA2 GLY 38 HA2 GLY 38 92.752 -23.781 14.083 303 HA3 GLY 38 HA3 GLY 38 93.103 -22.676 15.410 304 H GLY 39 H GLY 39 90.992 -21.755 14.640 305 HA2 GLY 39 HA2 GLY 39 90.898 -20.382 12.120 306 HA3 GLY 39 HA3 GLY 39 89.736 -20.231 13.435 307 H GLY 40 H GLY 40 90.037 -17.925 12.429 308 HA2 GLY 40 HA2 GLY 40 92.395 -16.496 13.320 309 HA3 GLY 40 HA3 GLY 40 91.003 -15.807 12.491 310 H ARG 41 H ARG 41 91.708 -14.184 14.305 311 HA ARG 41 HA ARG 41 89.732 -14.460 16.412 312 HB2 ARG 41 HB2 ARG 41 91.203 -14.148 18.255 313 HB3 ARG 41 HB3 ARG 41 91.828 -15.494 17.318 314 HG2 ARG 41 HG2 ARG 41 92.876 -12.660 17.040 315 HG3 ARG 41 HG3 ARG 41 93.555 -13.833 18.156 316 HD2 ARG 41 HD2 ARG 41 93.903 -15.375 16.174 317 HD3 ARG 41 HD3 ARG 41 93.459 -14.021 15.139 318 HE ARG 41 HE ARG 41 95.405 -12.974 16.719 319 HH11 ARG 41 HH11 ARG 41 95.278 -15.842 14.698 320 HH12 ARG 41 HH12 ARG 41 96.978 -15.806 14.368 321 HH21 ARG 41 HH21 ARG 41 97.587 -12.979 16.257 322 HH22 ARG 41 HH22 ARG 41 98.268 -14.204 15.239 323 H ALA 42 H ALA 42 89.648 -12.402 17.764 324 HA ALA 42 HA ALA 42 89.157 -10.220 16.084 325 HB1 ALA 42 HB1 ALA 42 88.740 -8.964 18.060 326 HB2 ALA 42 HB2 ALA 42 89.808 -9.985 19.022 327 HB3 ALA 42 HB3 ALA 42 88.270 -10.621 18.440 328 H ASP 43 H ASP 43 90.274 -8.345 15.622 329 HA ASP 43 HA ASP 43 93.155 -8.317 16.322 330 HB2 ASP 43 HB2 ASP 43 93.545 -7.318 14.080 331 HB3 ASP 43 HB3 ASP 43 92.896 -8.954 13.989 332 HA PRO 44 HA PRO 44 92.445 -4.196 17.753 333 HB2 PRO 44 HB2 PRO 44 94.740 -2.872 17.024 334 HB3 PRO 44 HB3 PRO 44 94.640 -3.992 18.397 335 HG2 PRO 44 HG2 PRO 44 95.703 -4.450 15.661 336 HG3 PRO 44 HG3 PRO 44 96.309 -5.030 17.224 337 HD2 PRO 44 HD2 PRO 44 94.885 -6.620 15.535 338 HD3 PRO 44 HD3 PRO 44 94.830 -6.807 17.301 339 H ALA 45 H ALA 45 92.506 -1.818 16.995 340 HA ALA 45 HA ALA 45 90.952 -1.583 14.647 341 HB1 ALA 45 HB1 ALA 45 91.224 0.001 16.741 342 HB2 ALA 45 HB2 ALA 45 90.788 0.665 15.166 343 HB3 ALA 45 HB3 ALA 45 92.454 0.765 15.734 344 H HIS 46 H HIS 46 91.432 -0.908 12.595 345 HA HIS 46 HA HIS 46 94.268 -0.414 11.929 346 HB2 HIS 46 HB2 HIS 46 92.369 -2.214 10.417 347 HB3 HIS 46 HB3 HIS 46 93.983 -1.770 9.893 348 HD1 HIS 46 HD1 HIS 46 95.934 -2.507 11.738 349 HD2 HIS 46 HD2 HIS 46 92.304 -4.556 11.848 350 HE1 HIS 46 HE1 HIS 46 96.368 -4.662 12.990 351 H ARG 47 H ARG 47 94.512 0.584 9.754 352 HA ARG 47 HA ARG 47 92.150 1.982 8.756 353 HB2 ARG 47 HB2 ARG 47 93.182 4.184 8.922 354 HB3 ARG 47 HB3 ARG 47 93.056 3.454 10.521 355 HG2 ARG 47 HG2 ARG 47 95.443 2.681 10.272 356 HG3 ARG 47 HG3 ARG 47 95.534 3.626 8.785 357 HD2 ARG 47 HD2 ARG 47 94.879 5.655 10.089 358 HD3 ARG 47 HD3 ARG 47 94.941 4.688 11.559 359 HE ARG 47 HE ARG 47 97.228 4.928 11.520 360 HH11 ARG 47 HH11 ARG 47 96.064 5.420 8.243 361 HH12 ARG 47 HH12 ARG 47 97.640 5.804 7.636 362 HH21 ARG 47 HH21 ARG 47 99.231 5.431 10.679 363 HH22 ARG 47 HH22 ARG 47 99.410 5.810 8.999 364 H SER 48 H SER 48 92.479 2.978 6.675 365 HA SER 48 HA SER 48 94.323 1.471 5.036 366 HB2 SER 48 HB2 SER 48 92.532 3.747 4.172 367 HB3 SER 48 HB3 SER 48 93.217 2.475 3.167 368 HG SER 48 HG SER 48 91.009 2.446 4.652 369 HA PRO 49 HA PRO 49 97.664 4.375 4.924 370 HB2 PRO 49 HB2 PRO 49 97.739 4.189 1.960 371 HB3 PRO 49 HB3 PRO 49 99.004 3.837 3.151 372 HG2 PRO 49 HG2 PRO 49 97.730 1.902 1.828 373 HG3 PRO 49 HG3 PRO 49 98.276 1.702 3.503 374 HD2 PRO 49 HD2 PRO 49 95.508 2.168 2.472 375 HD3 PRO 49 HD3 PRO 49 96.050 1.213 3.872 376 H VAL 50 H VAL 50 98.276 6.547 4.092 377 HA VAL 50 HA VAL 50 95.849 8.110 3.668 378 HB VAL 50 HB VAL 50 98.690 9.008 4.228 379 HG11 VAL 50 HG11 VAL 50 97.702 11.177 4.719 380 HG12 VAL 50 HG12 VAL 50 96.083 10.547 4.415 381 HG13 VAL 50 HG13 VAL 50 97.234 10.699 3.087 382 HG21 VAL 50 HG21 VAL 50 97.593 7.660 6.045 383 HG22 VAL 50 HG22 VAL 50 96.297 8.856 6.086 384 HG23 VAL 50 HG23 VAL 50 97.943 9.324 6.516 385 HA PRO 51 HA PRO 51 96.629 8.549 -0.740 386 HB2 PRO 51 HB2 PRO 51 95.865 11.414 -0.403 387 HB3 PRO 51 HB3 PRO 51 95.236 10.205 -1.538 388 HG2 PRO 51 HG2 PRO 51 93.836 10.982 0.587 389 HG3 PRO 51 HG3 PRO 51 93.792 9.311 -0.001 390 HD2 PRO 51 HD2 PRO 51 95.159 10.414 2.407 391 HD3 PRO 51 HD3 PRO 51 94.460 8.804 2.143 392 H LEU 52 H LEU 52 98.203 9.496 -2.149 393 HA LEU 52 HA LEU 52 100.637 10.195 -0.893 394 HB2 LEU 52 HB2 LEU 52 99.666 10.210 -3.736 395 HB3 LEU 52 HB3 LEU 52 101.233 10.910 -3.335 396 HG LEU 52 HG LEU 52 100.422 8.109 -2.523 397 HD11 LEU 52 HD11 LEU 52 102.075 7.523 -4.430 398 HD12 LEU 52 HD12 LEU 52 101.773 9.163 -5.008 399 HD13 LEU 52 HD13 LEU 52 100.443 8.010 -4.887 400 HD21 LEU 52 HD21 LEU 52 103.006 7.954 -2.475 401 HD22 LEU 52 HD22 LEU 52 102.229 8.856 -1.174 402 HD23 LEU 52 HD23 LEU 52 102.982 9.716 -2.517 403 HA PRO 53 HA PRO 53 100.139 14.615 -0.556 404 HB2 PRO 53 HB2 PRO 53 102.704 15.514 -0.882 405 HB3 PRO 53 HB3 PRO 53 102.122 14.755 0.612 406 HG2 PRO 53 HG2 PRO 53 103.754 13.601 -1.580 407 HG3 PRO 53 HG3 PRO 53 103.848 13.327 0.168 408 HD2 PRO 53 HD2 PRO 53 102.667 11.562 -1.568 409 HD3 PRO 53 HD3 PRO 53 102.211 11.708 0.144 410 H SER 54 H SER 54 99.869 16.426 -1.887 411 HA SER 54 HA SER 54 99.450 15.938 -4.591 412 HB2 SER 54 HB2 SER 54 99.742 18.496 -3.026 413 HB3 SER 54 HB3 SER 54 99.424 18.508 -4.758 414 HG SER 54 HG SER 54 97.464 18.008 -4.263 415 HA PRO 55 HA PRO 55 103.585 16.101 -6.009 416 HB2 PRO 55 HB2 PRO 55 103.277 16.179 -8.689 417 HB3 PRO 55 HB3 PRO 55 102.797 14.765 -7.728 418 HG2 PRO 55 HG2 PRO 55 101.120 16.890 -8.930 419 HG3 PRO 55 HG3 PRO 55 100.780 15.166 -8.708 420 HD2 PRO 55 HD2 PRO 55 99.834 17.222 -7.061 421 HD3 PRO 55 HD3 PRO 55 99.870 15.497 -6.643 422 H THR 56 H THR 56 104.880 17.821 -5.660 423 HA THR 56 HA THR 56 104.469 20.345 -7.048 424 HB THR 56 HB THR 56 106.538 21.046 -5.961 425 HG1 THR 56 HG1 THR 56 107.781 19.589 -4.961 426 HG21 THR 56 HG21 THR 56 105.793 20.999 -3.724 427 HG22 THR 56 HG22 THR 56 105.078 19.397 -3.904 428 HG23 THR 56 HG23 THR 56 104.314 20.794 -4.661 429 H SER 57 H SER 57 106.244 21.179 -8.523 430 HA SER 57 HA SER 57 106.448 19.445 -10.706 431 HB2 SER 57 HB2 SER 57 107.779 21.113 -11.748 432 HB3 SER 57 HB3 SER 57 106.687 21.984 -10.678 433 HG SER 57 HG SER 57 109.231 22.124 -10.666 434 H ASN 58 H ASN 58 107.644 17.744 -11.057 435 HA ASN 58 HA ASN 58 109.371 16.323 -11.230 436 HB2 ASN 58 HB2 ASN 58 111.521 17.154 -11.548 437 HB3 ASN 58 HB3 ASN 58 110.465 18.471 -12.023 438 HD21 ASN 58 HD21 ASN 58 111.259 20.436 -11.289 439 HD22 ASN 58 HD22 ASN 58 112.089 20.671 -9.827 440 H LYS 59 H LYS 59 108.148 16.934 -8.423 441 HA LYS 59 HA LYS 59 109.995 15.219 -6.980 442 HB2 LYS 59 HB2 LYS 59 110.969 17.491 -6.716 443 HB3 LYS 59 HB3 LYS 59 109.463 18.021 -5.969 444 HG2 LYS 59 HG2 LYS 59 109.740 16.384 -4.172 445 HG3 LYS 59 HG3 LYS 59 111.203 15.762 -4.937 446 HD2 LYS 59 HD2 LYS 59 111.883 17.284 -3.189 447 HD3 LYS 59 HD3 LYS 59 112.196 18.068 -4.738 448 HE2 LYS 59 HE2 LYS 59 110.349 19.510 -4.523 449 HE3 LYS 59 HE3 LYS 59 109.580 18.492 -3.306 450 HZ1 LYS 59 HZ1 LYS 59 110.793 20.629 -2.577 451 HZ2 LYS 59 HZ2 LYS 59 112.207 19.707 -2.769 452 HZ3 LYS 59 HZ3 LYS 59 111.010 19.212 -1.671 453 H GLN 60 H GLN 60 109.047 14.124 -5.321 454 HA GLN 60 HA GLN 60 106.539 15.143 -4.172 455 HB2 GLN 60 HB2 GLN 60 106.955 12.333 -5.198 456 HB3 GLN 60 HB3 GLN 60 105.708 12.749 -4.026 457 HG2 GLN 60 HG2 GLN 60 104.865 14.471 -5.669 458 HG3 GLN 60 HG3 GLN 60 106.000 13.801 -6.842 459 HE21 GLN 60 HE21 GLN 60 102.944 13.184 -5.151 460 HE22 GLN 60 HE22 GLN 60 102.579 11.764 -6.002 461 H ASP 61 H ASP 61 106.181 14.534 -2.009 462 HA ASP 61 HA ASP 61 108.513 13.446 -0.602 463 HB2 ASP 61 HB2 ASP 61 105.916 14.618 0.429 464 HB3 ASP 61 HB3 ASP 61 107.247 14.068 1.443 465 H ILE 62 H ILE 62 108.603 11.351 0.031 466 HA ILE 62 HA ILE 62 106.080 9.790 0.011 467 HB ILE 62 HB ILE 62 107.509 9.427 -2.008 468 HG12 ILE 62 HG12 ILE 62 107.579 6.865 -1.649 469 HG13 ILE 62 HG13 ILE 62 106.902 7.217 -0.059 470 HG21 ILE 62 HG21 ILE 62 109.731 9.664 -1.093 471 HG22 ILE 62 HG22 ILE 62 109.557 8.014 -1.691 472 HG23 ILE 62 HG23 ILE 62 109.458 8.341 0.040 473 HD11 ILE 62 HD11 ILE 62 105.634 8.481 -2.466 474 HD12 ILE 62 HD12 ILE 62 104.905 8.022 -0.928 475 HD13 ILE 62 HD13 ILE 62 105.299 6.786 -2.122 476 H SER 63 H SER 63 105.910 8.106 1.567 477 HA SER 63 HA SER 63 108.012 7.936 3.580 478 HB2 SER 63 HB2 SER 63 106.691 8.759 5.406 479 HB3 SER 63 HB3 SER 63 106.679 9.983 4.141 480 HG SER 63 HG SER 63 104.615 9.227 5.144 481 H GLU 64 H GLU 64 107.590 6.385 5.255 482 HA GLU 64 HA GLU 64 106.628 3.941 4.372 483 HB2 GLU 64 HB2 GLU 64 106.771 3.235 6.727 484 HB3 GLU 64 HB3 GLU 64 108.183 4.174 6.242 485 HG2 GLU 64 HG2 GLU 64 107.121 6.205 7.217 486 HG3 GLU 64 HG3 GLU 64 105.793 5.205 7.790 487 H ALA 65 H ALA 65 104.910 6.528 6.054 488 HA ALA 65 HA ALA 65 102.711 5.054 6.977 489 HB1 ALA 65 HB1 ALA 65 102.792 7.202 7.845 490 HB2 ALA 65 HB2 ALA 65 101.521 7.370 6.633 491 HB3 ALA 65 HB3 ALA 65 103.155 7.932 6.280 492 H ASN 66 H ASN 66 103.287 6.605 3.835 493 HA ASN 66 HA ASN 66 100.616 6.150 2.894 494 HB2 ASN 66 HB2 ASN 66 103.065 6.711 1.214 495 HB3 ASN 66 HB3 ASN 66 101.376 6.973 0.783 496 HD21 ASN 66 HD21 ASN 66 100.206 8.708 2.002 497 HD22 ASN 66 HD22 ASN 66 101.090 9.992 2.673 498 H LEU 67 H LEU 67 103.757 4.581 2.275 499 HA LEU 67 HA LEU 67 102.666 2.719 0.405 500 HB2 LEU 67 HB2 LEU 67 105.300 2.947 1.824 501 HB3 LEU 67 HB3 LEU 67 104.913 1.516 0.865 502 HG LEU 67 HG LEU 67 104.257 3.160 -1.002 503 HD11 LEU 67 HD11 LEU 67 105.550 4.969 1.009 504 HD12 LEU 67 HD12 LEU 67 104.133 5.256 -0.002 505 HD13 LEU 67 HD13 LEU 67 105.747 5.304 -0.709 506 HD21 LEU 67 HD21 LEU 67 107.187 3.428 -0.448 507 HD22 LEU 67 HD22 LEU 67 106.361 2.942 -1.924 508 HD23 LEU 67 HD23 LEU 67 106.524 1.800 -0.594 509 H ALA 68 H ALA 68 102.985 2.656 3.885 510 HA ALA 68 HA ALA 68 102.274 1.156 5.447 511 HB1 ALA 68 HB1 ALA 68 100.326 0.994 3.680 512 HB2 ALA 68 HB2 ALA 68 100.444 -0.196 4.976 513 HB3 ALA 68 HB3 ALA 68 101.019 -0.596 3.358 514 H TYR 69 H TYR 69 102.119 -1.893 4.568 515 HA TYR 69 HA TYR 69 104.631 -2.597 5.537 516 HB2 TYR 69 HB2 TYR 69 102.677 -4.099 5.432 517 HB3 TYR 69 HB3 TYR 69 102.852 -4.188 3.690 518 HD1 TYR 69 HD1 TYR 69 104.366 -5.110 6.937 519 HD2 TYR 69 HD2 TYR 69 104.534 -5.583 2.670 520 HE1 TYR 69 HE1 TYR 69 105.943 -7.004 7.209 521 HE2 TYR 69 HE2 TYR 69 106.110 -7.477 2.943 522 HH TYR 69 HH TYR 69 107.338 -8.384 6.081 523 H LEU 70 H LEU 70 103.682 -1.728 2.298 524 HA LEU 70 HA LEU 70 105.636 -3.064 0.794 525 HB2 LEU 70 HB2 LEU 70 104.086 -0.529 0.349 526 HB3 LEU 70 HB3 LEU 70 105.282 -1.088 -0.820 527 HG LEU 70 HG LEU 70 104.061 -3.357 -0.712 528 HD11 LEU 70 HD11 LEU 70 101.565 -2.956 -0.181 529 HD12 LEU 70 HD12 LEU 70 102.113 -1.526 0.691 530 HD13 LEU 70 HD13 LEU 70 102.664 -3.126 1.187 531 HD21 LEU 70 HD21 LEU 70 103.963 -1.654 -2.586 532 HD22 LEU 70 HD22 LEU 70 102.494 -1.022 -1.843 533 HD23 LEU 70 HD23 LEU 70 102.534 -2.678 -2.450 534 H TRP 71 H TRP 71 105.965 -0.288 2.867 535 HA TRP 71 HA TRP 71 108.078 1.079 1.687 536 HB2 TRP 71 HB2 TRP 71 106.725 1.697 3.740 537 HB3 TRP 71 HB3 TRP 71 107.797 0.647 4.645 538 HD1 TRP 71 HD1 TRP 71 109.808 1.798 5.654 539 HE1 TRP 71 HE1 TRP 71 111.091 3.988 5.220 540 HE3 TRP 71 HE3 TRP 71 107.366 3.449 1.490 541 HZ2 TRP 71 HZ2 TRP 71 111.104 6.154 3.339 542 HZ3 TRP 71 HZ3 TRP 71 108.032 5.567 0.395 543 HH2 TRP 71 HH2 TRP 71 109.893 6.922 1.312 544 HA PRO 72 HA PRO 72 110.937 -2.418 2.430 545 HB2 PRO 72 HB2 PRO 72 112.675 -2.037 0.432 546 HB3 PRO 72 HB3 PRO 72 111.017 -2.585 0.110 547 HG2 PRO 72 HG2 PRO 72 112.203 0.117 -0.211 548 HG3 PRO 72 HG3 PRO 72 111.022 -0.728 -1.228 549 HD2 PRO 72 HD2 PRO 72 110.408 1.201 0.704 550 HD3 PRO 72 HD3 PRO 72 109.258 0.052 -0.011 551 H LEU 73 H LEU 73 111.660 0.938 2.671 552 HA LEU 73 HA LEU 73 114.501 0.536 3.227 553 HB2 LEU 73 HB2 LEU 73 112.860 3.074 3.294 554 HB3 LEU 73 HB3 LEU 73 114.616 2.958 3.366 555 HG LEU 73 HG LEU 73 112.915 2.003 1.045 556 HD11 LEU 73 HD11 LEU 73 114.757 4.401 1.213 557 HD12 LEU 73 HD12 LEU 73 113.010 4.502 1.442 558 HD13 LEU 73 HD13 LEU 73 113.670 3.979 -0.112 559 HD21 LEU 73 HD21 LEU 73 115.178 1.930 -0.085 560 HD22 LEU 73 HD22 LEU 73 114.977 0.733 1.193 561 HD23 LEU 73 HD23 LEU 73 115.912 2.197 1.497 562 H THR 74 H THR 74 115.493 0.850 5.148 563 HA THR 74 HA THR 74 114.038 0.538 7.575 564 HB THR 74 HB THR 74 116.215 0.808 8.665 565 HG1 THR 74 HG1 THR 74 117.956 1.324 7.323 566 HG21 THR 74 HG21 THR 74 115.596 -1.332 7.474 567 HG22 THR 74 HG22 THR 74 117.332 -1.068 7.646 568 HG23 THR 74 HG23 THR 74 116.543 -0.764 6.098 569 H VAL 75 H VAL 75 115.537 3.326 5.934 570 HA VAL 75 HA VAL 75 114.999 5.193 8.016 571 HB VAL 75 HB VAL 75 115.197 6.925 6.237 572 HG11 VAL 75 HG11 VAL 75 117.535 6.536 5.805 573 HG12 VAL 75 HG12 VAL 75 117.336 4.795 6.000 574 HG13 VAL 75 HG13 VAL 75 117.176 5.862 7.395 575 HG21 VAL 75 HG21 VAL 75 115.788 6.206 3.951 576 HG22 VAL 75 HG22 VAL 75 114.174 5.650 4.381 577 HG23 VAL 75 HG23 VAL 75 115.531 4.525 4.409 578 H ASP 76 H ASP 76 113.136 6.265 8.532 579 HA ASP 76 HA ASP 76 110.774 4.868 7.877 580 HB2 ASP 76 HB2 ASP 76 111.148 7.537 9.254 581 HB3 ASP 76 HB3 ASP 76 109.620 6.662 9.177 582 H HIS 77 H HIS 77 112.140 7.850 6.565 583 HA HIS 77 HA HIS 77 110.124 7.715 4.456 584 HB2 HIS 77 HB2 HIS 77 109.647 10.145 4.649 585 HB3 HIS 77 HB3 HIS 77 109.035 9.191 5.986 586 HD1 HIS 77 HD1 HIS 77 111.072 9.101 8.037 587 HD2 HIS 77 HD2 HIS 77 110.742 12.459 5.588 588 HE1 HIS 77 HE1 HIS 77 112.176 11.006 9.284 589 H GLY 78 H GLY 78 110.605 9.462 2.780 590 HA2 GLY 78 HA2 GLY 78 113.178 10.674 2.673 591 HA3 GLY 78 HA3 GLY 78 113.110 9.226 1.674 592 H THR 79 H THR 79 113.496 11.763 0.581 593 HA THR 79 HA THR 79 110.902 12.365 -0.716 594 HB THR 79 HB THR 79 113.366 14.106 -0.839 595 HG1 THR 79 HG1 THR 79 112.105 15.175 0.887 596 HG21 THR 79 HG21 THR 79 111.743 14.790 -2.410 597 HG22 THR 79 HG22 THR 79 111.387 15.797 -1.005 598 HG23 THR 79 HG23 THR 79 110.404 14.369 -1.339 599 H ILE 80 H ILE 80 110.716 12.246 -2.929 600 HA ILE 80 HA ILE 80 113.011 11.034 -4.356 601 HB ILE 80 HB ILE 80 111.305 10.138 -5.924 602 HG12 ILE 80 HG12 ILE 80 109.313 11.170 -3.876 603 HG13 ILE 80 HG13 ILE 80 109.563 11.883 -5.467 604 HG21 ILE 80 HG21 ILE 80 112.135 8.803 -4.027 605 HG22 ILE 80 HG22 ILE 80 110.447 8.427 -4.369 606 HG23 ILE 80 HG23 ILE 80 110.861 9.462 -3.001 607 HD11 ILE 80 HD11 ILE 80 109.151 9.411 -6.301 608 HD12 ILE 80 HD12 ILE 80 107.790 10.471 -5.920 609 HD13 ILE 80 HD13 ILE 80 108.322 9.258 -4.751 610 H GLU 81 H GLU 81 113.799 11.999 -6.165 611 HA GLU 81 HA GLU 81 112.344 14.299 -7.272 612 HB2 GLU 81 HB2 GLU 81 113.827 15.137 -5.446 613 HB3 GLU 81 HB3 GLU 81 115.212 14.503 -6.336 614 HG2 GLU 81 HG2 GLU 81 114.559 15.905 -8.287 615 HG3 GLU 81 HG3 GLU 81 113.250 16.586 -7.333 616 H CYS 82 H CYS 82 112.701 14.713 -9.357 617 HA CYS 82 HA CYS 82 114.673 13.048 -10.800 618 HB2 CYS 82 HB2 CYS 82 112.018 14.224 -11.540 619 HB3 CYS 82 HB3 CYS 82 113.219 13.962 -12.804 620 H LEU 83 H LEU 83 116.456 14.055 -11.488 621 HA LEU 83 HA LEU 83 116.659 16.943 -11.260 622 HB2 LEU 83 HB2 LEU 83 118.594 14.719 -11.845 623 HB3 LEU 83 HB3 LEU 83 119.050 16.402 -12.114 624 HG LEU 83 HG LEU 83 117.811 15.575 -9.501 625 HD11 LEU 83 HD11 LEU 83 119.676 14.034 -9.797 626 HD12 LEU 83 HD12 LEU 83 120.137 15.273 -8.630 627 HD13 LEU 83 HD13 LEU 83 120.733 15.358 -10.288 628 HD21 LEU 83 HD21 LEU 83 119.059 17.521 -8.693 629 HD22 LEU 83 HD22 LEU 83 118.101 17.982 -10.100 630 HD23 LEU 83 HD23 LEU 83 119.834 17.705 -10.266 631 HA PRO 84 HA PRO 84 116.021 18.091 -15.479 632 HB2 PRO 84 HB2 PRO 84 118.314 19.585 -16.064 633 HB3 PRO 84 HB3 PRO 84 116.841 20.201 -15.297 634 HG2 PRO 84 HG2 PRO 84 119.405 19.370 -14.061 635 HG3 PRO 84 HG3 PRO 84 118.305 20.689 -13.619 636 HD2 PRO 84 HD2 PRO 84 118.388 18.402 -12.192 637 HD3 PRO 84 HD3 PRO 84 116.865 19.287 -12.441 638 H SER 85 H SER 85 118.898 16.383 -14.596 639 HA SER 85 HA SER 85 119.806 15.869 -17.288 640 HB2 SER 85 HB2 SER 85 120.607 14.705 -14.620 641 HB3 SER 85 HB3 SER 85 121.376 14.296 -16.149 642 HG SER 85 HG SER 85 121.125 16.879 -15.119 643 H ASP 86 H ASP 86 117.116 14.736 -15.812 644 HA ASP 86 HA ASP 86 115.759 12.930 -16.048 645 HB2 ASP 86 HB2 ASP 86 117.631 12.157 -18.303 646 HB3 ASP 86 HB3 ASP 86 116.048 11.462 -17.988 647 H ASN 87 H ASN 87 117.773 12.875 -14.117 648 HA ASN 87 HA ASN 87 118.337 9.969 -13.949 649 HB2 ASN 87 HB2 ASN 87 119.734 12.299 -12.607 650 HB3 ASN 87 HB3 ASN 87 120.082 10.600 -12.296 651 HD21 ASN 87 HD21 ASN 87 122.003 12.507 -13.407 652 HD22 ASN 87 HD22 ASN 87 122.397 11.962 -14.966 653 H ALA 88 H ALA 88 117.251 8.883 -12.415 654 HA ALA 88 HA ALA 88 115.557 10.417 -10.576 655 HB1 ALA 88 HB1 ALA 88 114.230 8.797 -11.563 656 HB2 ALA 88 HB2 ALA 88 114.743 7.952 -10.103 657 HB3 ALA 88 HB3 ALA 88 115.541 7.620 -11.640 658 H VAL 89 H VAL 89 116.130 10.711 -8.519 659 HA VAL 89 HA VAL 89 117.913 8.723 -7.241 660 HB VAL 89 HB VAL 89 119.062 10.585 -6.080 661 HG11 VAL 89 HG11 VAL 89 120.307 9.839 -7.897 662 HG12 VAL 89 HG12 VAL 89 120.109 11.545 -8.297 663 HG13 VAL 89 HG13 VAL 89 119.087 10.334 -9.071 664 HG21 VAL 89 HG21 VAL 89 118.762 12.885 -7.116 665 HG22 VAL 89 HG22 VAL 89 117.394 12.319 -6.157 666 HG23 VAL 89 HG23 VAL 89 117.324 12.255 -7.918 667 H PHE 90 H PHE 90 117.761 8.593 -4.992 668 HA PHE 90 HA PHE 90 115.236 9.588 -3.820 669 HB2 PHE 90 HB2 PHE 90 115.276 7.173 -4.052 670 HB3 PHE 90 HB3 PHE 90 116.845 7.089 -3.284 671 HD1 PHE 90 HD1 PHE 90 113.272 7.980 -2.684 672 HD2 PHE 90 HD2 PHE 90 117.032 6.846 -0.949 673 HE1 PHE 90 HE1 PHE 90 112.161 7.658 -0.483 674 HE2 PHE 90 HE2 PHE 90 115.923 6.512 1.242 675 HZ PHE 90 HZ PHE 90 113.485 6.922 1.475 676 H VAL 91 H VAL 91 115.434 10.937 -2.124 677 HA VAL 91 HA VAL 91 118.086 11.233 -0.850 678 HB VAL 91 HB VAL 91 115.756 13.171 -0.980 679 HG11 VAL 91 HG11 VAL 91 117.344 13.308 1.051 680 HG12 VAL 91 HG12 VAL 91 117.143 14.767 0.089 681 HG13 VAL 91 HG13 VAL 91 118.588 13.776 -0.108 682 HG21 VAL 91 HG21 VAL 91 116.742 12.986 -3.160 683 HG22 VAL 91 HG22 VAL 91 118.373 12.999 -2.490 684 HG23 VAL 91 HG23 VAL 91 117.387 14.460 -2.437 685 H ALA 92 H ALA 92 118.293 10.735 1.265 686 HA ALA 92 HA ALA 92 115.837 9.991 2.739 687 HB1 ALA 92 HB1 ALA 92 117.559 9.004 4.365 688 HB2 ALA 92 HB2 ALA 92 118.760 9.326 3.114 689 HB3 ALA 92 HB3 ALA 92 117.421 8.225 2.788 690 HA PRO 93 HA PRO 93 115.818 13.482 5.452 691 HB2 PRO 93 HB2 PRO 93 116.099 11.623 7.771 692 HB3 PRO 93 HB3 PRO 93 114.900 12.898 7.483 693 HG2 PRO 93 HG2 PRO 93 114.337 10.293 7.196 694 HG3 PRO 93 HG3 PRO 93 113.576 11.556 6.216 695 HD2 PRO 93 HD2 PRO 93 115.584 9.542 5.411 696 HD3 PRO 93 HD3 PRO 93 114.423 10.447 4.421 697 H ASP 94 H ASP 94 118.305 11.055 5.835 698 HA ASP 94 HA ASP 94 119.950 12.440 7.678 699 HB2 ASP 94 HB2 ASP 94 121.735 10.898 6.856 700 HB3 ASP 94 HB3 ASP 94 120.258 10.091 7.366 701 H GLY 95 H GLY 95 119.299 13.174 4.407 702 HA2 GLY 95 HA2 GLY 95 120.112 15.070 3.262 703 HA3 GLY 95 HA3 GLY 95 121.476 15.130 4.373 704 H THR 96 H THR 96 120.992 11.984 3.206 705 HA THR 96 HA THR 96 123.292 12.241 1.395 706 HB THR 96 HB THR 96 121.988 9.776 2.580 707 HG1 THR 96 HG1 THR 96 124.134 11.337 3.379 708 HG21 THR 96 HG21 THR 96 123.155 8.952 0.761 709 HG22 THR 96 HG22 THR 96 124.437 8.956 1.973 710 HG23 THR 96 HG23 THR 96 124.338 10.261 0.791 711 H THR 97 H THR 97 123.119 11.715 -0.753 712 HA THR 97 HA THR 97 120.400 11.100 -1.739 713 HB THR 97 HB THR 97 122.790 12.155 -3.278 714 HG1 THR 97 HG1 THR 97 121.919 14.083 -2.926 715 HG21 THR 97 HG21 THR 97 121.117 12.655 -4.998 716 HG22 THR 97 HG22 THR 97 119.842 12.001 -3.970 717 HG23 THR 97 HG23 THR 97 121.091 10.934 -4.612 718 H TYR 98 H TYR 98 119.991 9.233 -2.654 719 HA TYR 98 HA TYR 98 122.209 7.396 -3.314 720 HB2 TYR 98 HB2 TYR 98 119.383 6.757 -2.459 721 HB3 TYR 98 HB3 TYR 98 120.631 5.581 -2.820 722 HD1 TYR 98 HD2 TYR 98 122.499 5.214 -1.241 723 HD2 TYR 98 HD1 TYR 98 119.325 7.975 -0.370 724 HE1 TYR 98 HE2 TYR 98 123.179 5.248 1.144 725 HE2 TYR 98 HE1 TYR 98 120.013 8.018 2.010 726 HH TYR 98 HH TYR 98 121.605 7.343 3.472 727 H ALA 99 H ALA 99 121.983 6.190 -5.259 728 HA ALA 99 HA ALA 99 120.364 7.536 -7.275 729 HB1 ALA 99 HB1 ALA 99 122.585 5.501 -7.353 730 HB2 ALA 99 HB2 ALA 99 122.532 7.113 -8.067 731 HB3 ALA 99 HB3 ALA 99 121.591 5.804 -8.779 732 H LEU 100 H LEU 100 118.447 6.826 -7.963 733 HA LEU 100 HA LEU 100 117.408 4.283 -7.014 734 HB2 LEU 100 HB2 LEU 100 116.236 6.546 -8.632 735 HB3 LEU 100 HB3 LEU 100 115.381 5.028 -8.388 736 HG LEU 100 HG LEU 100 116.494 6.548 -6.039 737 HD11 LEU 100 HD11 LEU 100 113.805 6.924 -7.394 738 HD12 LEU 100 HD12 LEU 100 115.084 8.131 -7.287 739 HD13 LEU 100 HD13 LEU 100 114.245 7.603 -5.828 740 HD21 LEU 100 HD21 LEU 100 114.127 4.680 -6.407 741 HD22 LEU 100 HD22 LEU 100 114.711 5.326 -4.875 742 HD23 LEU 100 HD23 LEU 100 115.704 4.192 -5.789 743 H ASN 101 H ASN 101 118.097 5.857 -10.122 744 HA ASN 101 HA ASN 101 117.904 3.202 -11.436 745 HB2 ASN 101 HB2 ASN 101 117.407 4.327 -13.484 746 HB3 ASN 101 HB3 ASN 101 116.347 4.965 -12.235 747 HD21 ASN 101 HD21 ASN 101 116.448 6.673 -14.237 748 HD22 ASN 101 HD22 ASN 101 117.535 7.952 -13.981 749 H ASP 102 H ASP 102 119.308 3.017 -13.439 750 HA ASP 102 HA ASP 102 121.908 2.698 -12.507 751 HB2 ASP 102 HB2 ASP 102 120.885 2.830 -15.348 752 HB3 ASP 102 HB3 ASP 102 122.494 2.274 -14.894 753 H ARG 103 H ARG 103 120.551 5.359 -14.441 754 HA ARG 103 HA ARG 103 123.042 6.493 -15.154 755 HB2 ARG 103 HB2 ARG 103 120.274 7.689 -14.983 756 HB3 ARG 103 HB3 ARG 103 121.674 8.542 -15.642 757 HG2 ARG 103 HG2 ARG 103 122.022 6.662 -17.244 758 HG3 ARG 103 HG3 ARG 103 120.549 5.908 -16.637 759 HD2 ARG 103 HD2 ARG 103 120.734 8.634 -17.949 760 HD3 ARG 103 HD3 ARG 103 120.094 7.173 -18.695 761 HE ARG 103 HE ARG 103 118.708 8.903 -16.897 762 HH11 ARG 103 HH11 ARG 103 118.997 5.510 -17.753 763 HH12 ARG 103 HH12 ARG 103 117.390 5.142 -17.219 764 HH21 ARG 103 HH21 ARG 103 116.680 8.384 -16.240 765 HH22 ARG 103 HH22 ARG 103 116.084 6.759 -16.365 766 H ALA 104 H ALA 104 120.835 7.191 -12.444 767 HA ALA 104 HA ALA 104 122.282 9.288 -11.289 768 HB1 ALA 104 HB1 ALA 104 120.524 7.147 -10.097 769 HB2 ALA 104 HB2 ALA 104 120.131 8.838 -10.404 770 HB3 ALA 104 HB3 ALA 104 121.255 8.414 -9.112 771 H GLU 105 H GLU 105 122.662 5.775 -10.932 772 HA GLU 105 HA GLU 105 124.723 5.819 -9.012 773 HB2 GLU 105 HB2 GLU 105 123.419 3.796 -9.800 774 HB3 GLU 105 HB3 GLU 105 124.446 3.791 -11.235 775 HG2 GLU 105 HG2 GLU 105 126.449 3.681 -9.759 776 HG3 GLU 105 HG3 GLU 105 125.382 3.583 -8.364 777 H LYS 106 H LYS 106 124.832 5.923 -12.558 778 HA LYS 106 HA LYS 106 127.603 5.933 -12.923 779 HB2 LYS 106 HB2 LYS 106 125.804 5.805 -14.706 780 HB3 LYS 106 HB3 LYS 106 125.656 7.557 -14.562 781 HG2 LYS 106 HG2 LYS 106 128.218 7.606 -14.910 782 HG3 LYS 106 HG3 LYS 106 128.037 5.947 -15.483 783 HD2 LYS 106 HD2 LYS 106 126.418 8.257 -16.582 784 HD3 LYS 106 HD3 LYS 106 127.938 7.719 -17.298 785 HE2 LYS 106 HE2 LYS 106 126.942 5.406 -17.471 786 HE3 LYS 106 HE3 LYS 106 125.399 6.099 -16.972 787 HZ1 LYS 106 HZ1 LYS 106 125.401 6.080 -19.313 788 HZ2 LYS 106 HZ2 LYS 106 126.970 6.724 -19.404 789 HZ3 LYS 106 HZ3 LYS 106 125.681 7.693 -18.869 790 H ALA 107 H ALA 107 125.435 8.520 -11.969 791 HA ALA 107 HA ALA 107 127.379 10.627 -12.225 792 HB1 ALA 107 HB1 ALA 107 125.686 12.023 -11.158 793 HB2 ALA 107 HB2 ALA 107 124.740 10.591 -10.753 794 HB3 ALA 107 HB3 ALA 107 124.967 11.050 -12.441 795 H GLY 108 H GLY 108 127.615 8.167 -10.200 796 HA2 GLY 108 HA2 GLY 108 128.899 7.878 -8.343 797 HA3 GLY 108 HA3 GLY 108 129.209 9.602 -8.324 798 H HIS 109 H HIS 109 125.872 8.546 -8.247 799 HA HIS 109 HA HIS 109 125.691 9.193 -5.404 800 HB2 HIS 109 HB2 HIS 109 123.744 8.772 -7.627 801 HB3 HIS 109 HB3 HIS 109 123.197 8.589 -5.971 802 HD1 HIS 109 HD1 HIS 109 124.751 10.913 -4.657 803 HD2 HIS 109 HD2 HIS 109 122.698 11.249 -8.269 804 HE1 HIS 109 HE1 HIS 109 124.233 13.372 -4.958 805 HA PRO 110 HA PRO 110 126.299 4.679 -4.862 806 HB2 PRO 110 HB2 PRO 110 125.733 4.614 -2.127 807 HB3 PRO 110 HB3 PRO 110 127.333 4.893 -2.839 808 HG2 PRO 110 HG2 PRO 110 125.372 6.850 -1.778 809 HG3 PRO 110 HG3 PRO 110 127.143 6.852 -1.682 810 HD2 PRO 110 HD2 PRO 110 125.838 8.452 -3.416 811 HD3 PRO 110 HD3 PRO 110 127.404 7.715 -3.828 812 HA PRO 111 HA PRO 111 122.063 3.393 -5.073 813 HB2 PRO 111 HB2 PRO 111 122.195 0.754 -4.325 814 HB3 PRO 111 HB3 PRO 111 122.702 1.356 -5.914 815 HG2 PRO 111 HG2 PRO 111 124.349 0.620 -3.563 816 HG3 PRO 111 HG3 PRO 111 124.676 0.403 -5.290 817 HD2 PRO 111 HD2 PRO 111 125.810 2.394 -3.780 818 HD3 PRO 111 HD3 PRO 111 125.545 2.518 -5.533 819 H ILE 112 H ILE 112 120.201 2.761 -3.800 820 HA ILE 112 HA ILE 112 120.241 3.724 -1.150 821 HB ILE 112 HB ILE 112 118.136 2.003 -2.489 822 HG12 ILE 112 HG12 ILE 112 118.270 5.012 -2.182 823 HG13 ILE 112 HG13 ILE 112 118.785 4.175 -3.644 824 HG21 ILE 112 HG21 ILE 112 117.730 2.034 -0.114 825 HG22 ILE 112 HG22 ILE 112 116.649 3.237 -0.811 826 HG23 ILE 112 HG23 ILE 112 118.132 3.746 -0.009 827 HD11 ILE 112 HD11 ILE 112 116.575 3.365 -4.066 828 HD12 ILE 112 HD12 ILE 112 116.395 5.070 -3.650 829 HD13 ILE 112 HD13 ILE 112 116.018 3.831 -2.458 830 H THR 113 H THR 113 121.404 0.731 -2.230 831 HA THR 113 HA THR 113 120.299 -1.151 -0.628 832 HB THR 113 HB THR 113 122.017 -1.503 -2.416 833 HG1 THR 113 HG1 THR 113 121.244 -3.125 -1.070 834 HG21 THR 113 HG21 THR 113 123.894 -0.959 -0.101 835 HG22 THR 113 HG22 THR 113 123.883 -0.186 -1.685 836 HG23 THR 113 HG23 THR 113 124.355 -1.876 -1.533 837 HA PRO 114 HA PRO 114 123.399 -0.353 3.005 838 HB2 PRO 114 HB2 PRO 114 123.190 2.593 3.294 839 HB3 PRO 114 HB3 PRO 114 124.603 1.535 3.479 840 HG2 PRO 114 HG2 PRO 114 124.356 3.123 1.373 841 HG3 PRO 114 HG3 PRO 114 125.036 1.491 1.218 842 HD2 PRO 114 HD2 PRO 114 122.272 2.444 0.534 843 HD3 PRO 114 HD3 PRO 114 123.331 1.353 -0.379 844 H ILE 115 H ILE 115 120.614 1.722 2.357 845 HA ILE 115 HA ILE 115 119.623 1.293 5.090 846 HB ILE 115 HB ILE 115 117.819 2.928 4.403 847 HG12 ILE 115 HG12 ILE 115 119.732 3.574 2.145 848 HG13 ILE 115 HG13 ILE 115 118.260 2.634 1.916 849 HG21 ILE 115 HG21 ILE 115 119.366 3.859 5.819 850 HG22 ILE 115 HG22 ILE 115 119.635 4.861 4.394 851 HG23 ILE 115 HG23 ILE 115 120.727 3.522 4.748 852 HD11 ILE 115 HD11 ILE 115 118.277 5.284 1.595 853 HD12 ILE 115 HD12 ILE 115 118.026 5.255 3.340 854 HD13 ILE 115 HD13 ILE 115 116.877 4.450 2.271 855 H ARG 116 H ARG 116 119.428 -0.505 2.396 856 HA ARG 116 HA ARG 116 116.584 -0.890 2.190 857 HB2 ARG 116 HB2 ARG 116 118.184 -1.300 0.317 858 HB3 ARG 116 HB3 ARG 116 118.830 -2.673 1.216 859 HG2 ARG 116 HG2 ARG 116 116.544 -3.671 1.262 860 HG3 ARG 116 HG3 ARG 116 115.974 -2.339 0.256 861 HD2 ARG 116 HD2 ARG 116 118.170 -4.289 -0.497 862 HD3 ARG 116 HD3 ARG 116 116.519 -4.328 -1.109 863 HE ARG 116 HE ARG 116 117.719 -1.775 -1.550 864 HH11 ARG 116 HH11 ARG 116 117.694 -5.052 -2.810 865 HH12 ARG 116 HH12 ARG 116 118.158 -4.551 -4.401 866 HH21 ARG 116 HH21 ARG 116 118.318 -1.190 -3.619 867 HH22 ARG 116 HH22 ARG 116 118.506 -2.392 -4.852 868 H ALA 117 H ALA 117 115.335 -2.503 3.100 869 HA ALA 117 HA ALA 117 116.411 -3.739 5.494 870 HB1 ALA 117 HB1 ALA 117 114.203 -4.089 6.119 871 HB2 ALA 117 HB2 ALA 117 113.650 -4.240 4.450 872 HB3 ALA 117 HB3 ALA 117 114.053 -2.652 5.105 873 H LYS 118 H LYS 118 116.750 -5.882 5.841 874 HA LYS 118 HA LYS 118 116.532 -7.684 3.529 875 HB2 LYS 118 HB2 LYS 118 118.685 -7.559 4.793 876 HB3 LYS 118 HB3 LYS 118 117.841 -8.171 6.216 877 HG2 LYS 118 HG2 LYS 118 117.248 -10.222 5.032 878 HG3 LYS 118 HG3 LYS 118 117.985 -9.608 3.551 879 HD2 LYS 118 HD2 LYS 118 119.577 -11.092 4.602 880 HD3 LYS 118 HD3 LYS 118 120.169 -9.442 4.797 881 HE2 LYS 118 HE2 LYS 118 119.356 -9.348 7.072 882 HE3 LYS 118 HE3 LYS 118 118.540 -10.900 6.894 883 HZ1 LYS 118 HZ1 LYS 118 120.714 -11.020 8.049 884 HZ2 LYS 118 HZ2 LYS 118 121.470 -10.528 6.610 885 HZ3 LYS 118 HZ3 LYS 118 120.622 -12.000 6.668 886 H GLY 119 H GLY 119 115.213 -9.475 3.531 887 HA2 GLY 119 HA2 GLY 119 113.214 -9.579 5.697 888 HA3 GLY 119 HA3 GLY 119 112.984 -10.190 4.072 889 H SER 120 H SER 120 112.331 -11.829 6.135 890 HA SER 120 HA SER 120 114.353 -13.542 7.081 891 HB2 SER 120 HB2 SER 120 112.570 -15.100 7.582 892 HB3 SER 120 HB3 SER 120 112.008 -13.469 7.930 893 HG SER 120 HG SER 120 111.428 -15.072 5.732 894 H GLY 121 H GLY 121 112.535 -13.536 4.049 895 HA2 GLY 121 HA2 GLY 121 114.478 -15.461 2.965 896 HA3 GLY 121 HA3 GLY 121 112.757 -15.788 2.767 897 H GLY 122 H GLY 122 114.412 -15.507 0.562 898 HA2 GLY 122 HA2 GLY 122 114.258 -14.512 -1.522 899 HA3 GLY 122 HA3 GLY 122 113.069 -13.400 -0.859 900 H GLY 123 H GLY 123 116.219 -13.731 0.645 901 HA2 GLY 123 HA2 GLY 123 118.011 -12.304 0.811 902 HA3 GLY 123 HA3 GLY 123 117.637 -11.796 -0.832 903 H TYR 124 H TYR 124 117.310 -9.690 -1.006 904 HA TYR 124 HA TYR 124 116.380 -8.183 1.354 905 HB2 TYR 124 HB2 TYR 124 118.087 -7.503 -1.008 906 HB3 TYR 124 HB3 TYR 124 117.251 -6.233 -0.134 907 HD1 TYR 124 HD1 TYR 124 118.968 -9.365 1.003 908 HD2 TYR 124 HD2 TYR 124 118.801 -5.076 1.169 909 HE1 TYR 124 HE1 TYR 124 120.794 -9.359 2.682 910 HE2 TYR 124 HE2 TYR 124 120.621 -5.071 2.853 911 HH TYR 124 HH TYR 124 122.483 -6.654 3.523 912 H ILE 125 H ILE 125 114.929 -6.397 1.026 913 HA ILE 125 HA ILE 125 112.700 -7.224 -0.604 914 HB ILE 125 HB ILE 125 113.079 -4.857 1.249 915 HG12 ILE 125 HG12 ILE 125 111.586 -7.458 1.677 916 HG13 ILE 125 HG13 ILE 125 113.239 -7.193 2.224 917 HG21 ILE 125 HG21 ILE 125 110.687 -4.588 1.185 918 HG22 ILE 125 HG22 ILE 125 110.495 -6.030 0.187 919 HG23 ILE 125 HG23 ILE 125 111.254 -4.586 -0.483 920 HD11 ILE 125 HD11 ILE 125 112.168 -6.538 4.131 921 HD12 ILE 125 HD12 ILE 125 110.692 -6.083 3.280 922 HD13 ILE 125 HD13 ILE 125 112.080 -4.995 3.282 923 H SER 126 H SER 126 111.985 -6.369 -2.453 924 HA SER 126 HA SER 126 113.799 -4.963 -4.114 925 HB2 SER 126 HB2 SER 126 110.847 -5.482 -4.495 926 HB3 SER 126 HB3 SER 126 111.973 -4.970 -5.747 927 HG SER 126 HG SER 126 111.740 -7.212 -5.693 928 H LEU 127 H LEU 127 113.982 -2.913 -4.707 929 HA LEU 127 HA LEU 127 112.256 -0.887 -3.477 930 HB2 LEU 127 HB2 LEU 127 114.703 -0.530 -5.220 931 HB3 LEU 127 HB3 LEU 127 113.879 0.727 -4.302 932 HG LEU 127 HG LEU 127 115.213 -1.716 -3.093 933 HD11 LEU 127 HD11 LEU 127 116.073 1.193 -3.055 934 HD12 LEU 127 HD12 LEU 127 116.789 -0.043 -4.089 935 HD13 LEU 127 HD13 LEU 127 116.934 -0.168 -2.336 936 HD21 LEU 127 HD21 LEU 127 114.923 -0.194 -1.002 937 HD22 LEU 127 HD22 LEU 127 113.510 -1.067 -1.594 938 HD23 LEU 127 HD23 LEU 127 113.710 0.646 -1.968 939 H GLY 128 H GLY 128 111.745 -2.750 -6.047 940 HA2 GLY 128 HA2 GLY 128 111.712 -1.285 -8.363 941 HA3 GLY 128 HA3 GLY 128 110.520 -2.521 -7.990 942 H ALA 129 H ALA 129 109.125 -1.287 -5.890 943 HA ALA 129 HA ALA 129 107.274 0.239 -7.357 944 HB1 ALA 129 HB1 ALA 129 107.624 0.255 -4.351 945 HB2 ALA 129 HB2 ALA 129 106.791 -1.020 -5.240 946 HB3 ALA 129 HB3 ALA 129 106.155 0.625 -5.254 947 H LEU 130 H LEU 130 109.769 1.259 -5.036 948 HA LEU 130 HA LEU 130 109.160 4.002 -5.034 949 HB2 LEU 130 HB2 LEU 130 110.668 2.873 -3.414 950 HB3 LEU 130 HB3 LEU 130 111.870 2.695 -4.691 951 HG LEU 130 HG LEU 130 111.827 5.195 -4.981 952 HD11 LEU 130 HD11 LEU 130 109.739 5.848 -4.076 953 HD12 LEU 130 HD12 LEU 130 110.911 6.390 -2.874 954 HD13 LEU 130 HD13 LEU 130 109.989 4.911 -2.603 955 HD21 LEU 130 HD21 LEU 130 113.386 3.776 -3.414 956 HD22 LEU 130 HD22 LEU 130 112.479 4.552 -2.115 957 HD23 LEU 130 HD23 LEU 130 113.385 5.532 -3.267 958 H LEU 131 H LEU 131 111.295 2.088 -7.118 959 HA LEU 131 HA LEU 131 112.450 4.216 -8.547 960 HB2 LEU 131 HB2 LEU 131 113.260 1.871 -8.629 961 HB3 LEU 131 HB3 LEU 131 111.820 1.421 -9.537 962 HG LEU 131 HG LEU 131 112.495 3.159 -11.264 963 HD11 LEU 131 HD11 LEU 131 114.932 3.179 -9.480 964 HD12 LEU 131 HD12 LEU 131 114.000 4.555 -10.068 965 HD13 LEU 131 HD13 LEU 131 115.021 3.642 -11.180 966 HD21 LEU 131 HD21 LEU 131 114.526 1.683 -12.022 967 HD22 LEU 131 HD22 LEU 131 112.923 0.954 -11.926 968 HD23 LEU 131 HD23 LEU 131 114.091 0.689 -10.631 969 H SER 132 H SER 132 109.481 2.359 -9.138 970 HA SER 132 HA SER 132 108.877 3.416 -11.663 971 HB2 SER 132 HB2 SER 132 106.913 2.540 -9.532 972 HB3 SER 132 HB3 SER 132 106.598 2.662 -11.260 973 HG SER 132 HG SER 132 107.170 0.578 -10.754 974 H THR 133 H THR 133 108.029 4.569 -8.414 975 HA THR 133 HA THR 133 106.282 6.627 -9.226 976 HB THR 133 HB THR 133 108.075 6.611 -6.785 977 HG1 THR 133 HG1 THR 133 106.825 4.783 -6.866 978 HG21 THR 133 HG21 THR 133 105.386 7.918 -7.283 979 HG22 THR 133 HG22 THR 133 106.933 8.764 -7.333 980 HG23 THR 133 HG23 THR 133 106.366 8.053 -5.822 981 H THR 134 H THR 134 109.780 6.686 -8.554 982 HA THR 134 HA THR 134 110.099 9.462 -8.982 983 HB THR 134 HB THR 134 112.197 7.333 -9.435 984 HG1 THR 134 HG1 THR 134 111.574 7.035 -7.419 985 HG21 THR 134 HG21 THR 134 113.714 9.174 -8.739 986 HG22 THR 134 HG22 THR 134 112.329 10.264 -8.651 987 HG23 THR 134 HG23 THR 134 112.818 9.581 -10.203 988 H LEU 135 H LEU 135 110.307 6.706 -11.209 989 HA LEU 135 HA LEU 135 111.288 8.093 -13.444 990 HB2 LEU 135 HB2 LEU 135 109.481 5.673 -13.277 991 HB3 LEU 135 HB3 LEU 135 110.224 6.251 -14.768 992 HG LEU 135 HG LEU 135 111.816 5.560 -12.289 993 HD11 LEU 135 HD11 LEU 135 110.578 3.584 -13.228 994 HD12 LEU 135 HD12 LEU 135 112.332 3.435 -13.346 995 HD13 LEU 135 HD13 LEU 135 111.386 3.871 -14.770 996 HD21 LEU 135 HD21 LEU 135 113.596 5.349 -14.168 997 HD22 LEU 135 HD22 LEU 135 113.106 6.969 -13.676 998 HD23 LEU 135 HD23 LEU 135 112.452 6.261 -15.152 999 H ASN 136 H ASN 136 107.970 7.616 -12.279 1000 HA ASN 136 HA ASN 136 106.611 8.757 -14.450 1001 HB2 ASN 136 HB2 ASN 136 105.539 7.547 -12.544 1002 HB3 ASN 136 HB3 ASN 136 105.839 8.958 -11.532 1003 HD21 ASN 136 HD21 ASN 136 104.205 8.023 -14.602 1004 HD22 ASN 136 HD22 ASN 136 102.996 9.208 -14.487 1005 H LEU 137 H LEU 137 107.952 10.247 -11.529 1006 HA LEU 137 HA LEU 137 107.162 12.897 -12.075 1007 HB2 LEU 137 HB2 LEU 137 109.601 11.928 -10.566 1008 HB3 LEU 137 HB3 LEU 137 108.919 13.551 -10.483 1009 HG LEU 137 HG LEU 137 107.418 11.022 -9.744 1010 HD11 LEU 137 HD11 LEU 137 108.988 11.238 -8.021 1011 HD12 LEU 137 HD12 LEU 137 107.643 12.201 -7.409 1012 HD13 LEU 137 HD13 LEU 137 109.033 12.997 -8.149 1013 HD21 LEU 137 HD21 LEU 137 106.789 13.981 -9.574 1014 HD22 LEU 137 HD22 LEU 137 105.896 12.765 -8.662 1015 HD23 LEU 137 HD23 LEU 137 105.877 12.733 -10.423 1016 H CYS 138 H CYS 138 110.020 11.078 -13.077 1017 HA CYS 138 HA CYS 138 111.505 13.184 -14.164 1018 HB2 CYS 138 HB2 CYS 138 111.376 10.240 -14.651 1019 HB3 CYS 138 HB3 CYS 138 112.301 11.237 -15.770 1020 H GLY 139 H GLY 139 108.655 11.586 -15.444 1021 HA2 GLY 139 HA2 GLY 139 107.272 12.345 -17.147 1022 HA3 GLY 139 HA3 GLY 139 108.443 13.608 -17.496 1023 H LYS 140 H LYS 140 109.544 10.293 -17.393 1024 HA LYS 140 HA LYS 140 110.641 10.392 -19.967 1025 HB2 LYS 140 HB2 LYS 140 111.123 8.045 -19.694 1026 HB3 LYS 140 HB3 LYS 140 111.369 8.854 -18.151 1027 HG2 LYS 140 HG2 LYS 140 109.078 8.121 -17.455 1028 HG3 LYS 140 HG3 LYS 140 108.951 7.212 -18.961 1029 HD2 LYS 140 HD2 LYS 140 111.117 6.043 -18.285 1030 HD3 LYS 140 HD3 LYS 140 110.899 6.768 -16.691 1031 HE2 LYS 140 HE2 LYS 140 108.928 5.562 -16.271 1032 HE3 LYS 140 HE3 LYS 140 108.658 5.227 -17.980 1033 HZ1 LYS 140 HZ1 LYS 140 109.604 3.390 -16.445 1034 HZ2 LYS 140 HZ2 LYS 140 111.080 4.204 -16.666 1035 HZ3 LYS 140 HZ3 LYS 140 110.239 3.585 -18.006 1036 H GLY 141 H GLY 141 110.006 9.631 -21.953 1037 HA2 GLY 141 HA2 GLY 141 107.293 9.791 -22.639 1038 HA3 GLY 141 HA3 GLY 141 108.554 9.098 -23.655 Start of MODEL 12 1 H1 HIS -5 HT1 HIS -5 71.852 -21.967 33.030 2 H2 HIS -5 HT2 HIS -5 73.348 -21.177 33.186 3 H3 HIS -5 HT3 HIS -5 73.202 -22.532 32.172 4 HA HIS -5 HA HIS -5 71.853 -19.919 31.765 5 HB2 HIS -5 HB2 HIS -5 74.185 -21.237 30.358 6 HB3 HIS -5 HB3 HIS -5 73.375 -19.786 29.799 7 HD1 HIS -5 HD1 HIS -5 75.790 -21.043 32.358 8 HD2 HIS -5 HD2 HIS -5 73.981 -17.433 31.318 9 HE1 HIS -5 HE1 HIS -5 77.034 -19.233 33.614 10 H HIS -4 H HIS -4 71.045 -19.841 29.450 11 HA HIS -4 HA HIS -4 69.880 -22.460 28.687 12 HB2 HIS -4 HB2 HIS -4 68.700 -19.689 28.456 13 HB3 HIS -4 HB3 HIS -4 67.978 -21.141 27.788 14 HD1 HIS -4 HD1 HIS -4 68.542 -19.306 30.993 15 HD2 HIS -4 HD2 HIS -4 66.789 -22.873 29.736 16 HE1 HIS -4 HE1 HIS -4 67.201 -20.173 32.956 17 H HIS -3 H HIS -3 69.967 -23.057 26.573 18 HA HIS -3 HA HIS -3 71.378 -21.231 24.709 19 HB2 HIS -3 HB2 HIS -3 71.439 -24.246 24.872 20 HB3 HIS -3 HB3 HIS -3 72.181 -23.300 23.597 21 HD1 HIS -3 HD1 HIS -3 72.596 -24.319 27.166 22 HD2 HIS -3 HD2 HIS -3 74.574 -21.931 24.381 23 HE1 HIS -3 HE1 HIS -3 74.865 -23.796 28.157 24 H HIS -2 H HIS -2 70.519 -20.908 22.719 25 HA HIS -2 HA HIS -2 67.995 -22.326 22.071 26 HB2 HIS -2 HB2 HIS -2 68.753 -19.461 21.482 27 HB3 HIS -2 HB3 HIS -2 67.284 -20.254 20.945 28 HD1 HIS -2 HD1 HIS -2 65.745 -21.200 23.049 29 HD2 HIS -2 HD2 HIS -2 68.475 -18.161 23.887 30 HE1 HIS -2 HE1 HIS -2 65.010 -20.162 25.237 31 H HIS -1 H HIS -1 67.726 -23.041 20.001 32 HA HIS -1 HA HIS -1 69.977 -22.619 18.116 33 HB2 HIS -1 HB2 HIS -1 69.991 -24.888 19.066 34 HB3 HIS -1 HB3 HIS -1 68.336 -25.121 18.537 35 HD1 HIS -1 HD1 HIS -1 67.948 -25.680 16.064 36 HD2 HIS -1 HD2 HIS -1 71.948 -24.924 16.963 37 HE1 HIS -1 HE1 HIS -1 69.283 -26.388 14.033 38 H HIS 0 H HIS 0 69.449 -21.983 16.112 39 HA HIS 0 HA HIS 0 66.596 -22.058 15.312 40 HB2 HIS 0 HB2 HIS 0 67.312 -19.782 15.956 41 HB3 HIS 0 HB3 HIS 0 68.600 -19.863 14.769 42 HD1 HIS 0 HD1 HIS 0 64.796 -20.237 14.803 43 HD2 HIS 0 HD2 HIS 0 67.838 -18.740 12.377 44 HE1 HIS 0 HE1 HIS 0 63.662 -19.193 12.795 45 H SER 1 H SER 1 66.176 -22.783 13.301 46 HA SER 1 HA SER 1 68.482 -23.384 11.536 47 HB2 SER 1 HB2 SER 1 65.904 -24.942 11.848 48 HB3 SER 1 HB3 SER 1 67.217 -25.328 10.740 49 HG SER 1 HG SER 1 67.732 -26.438 12.490 50 H SER 2 H SER 2 68.217 -23.063 9.330 51 HA SER 2 HA SER 2 65.806 -21.536 8.521 52 HB2 SER 2 HB2 SER 2 67.845 -20.117 8.698 53 HB3 SER 2 HB3 SER 2 68.641 -21.162 7.525 54 HG SER 2 HG SER 2 67.478 -19.238 6.745 55 H GLY 3 H GLY 3 64.932 -21.982 6.523 56 HA2 GLY 3 HA2 GLY 3 66.243 -23.766 4.662 57 HA3 GLY 3 HA3 GLY 3 64.876 -24.494 5.499 58 H LEU 4 H LEU 4 64.376 -24.513 3.004 59 HA LEU 4 HA LEU 4 63.063 -22.005 2.196 60 HB2 LEU 4 HB2 LEU 4 64.634 -23.111 0.603 61 HB3 LEU 4 HB3 LEU 4 63.558 -24.507 0.568 62 HG LEU 4 HG LEU 4 61.700 -22.917 -0.127 63 HD11 LEU 4 HD11 LEU 4 62.747 -20.822 -1.295 64 HD12 LEU 4 HD12 LEU 4 64.084 -21.081 -0.174 65 HD13 LEU 4 HD13 LEU 4 62.462 -20.774 0.444 66 HD21 LEU 4 HD21 LEU 4 62.478 -22.821 -2.479 67 HD22 LEU 4 HD22 LEU 4 62.852 -24.380 -1.741 68 HD23 LEU 4 HD23 LEU 4 64.121 -23.172 -1.941 69 H VAL 5 H VAL 5 60.907 -21.810 2.160 70 HA VAL 5 HA VAL 5 59.269 -24.240 2.621 71 HB VAL 5 HB VAL 5 57.665 -22.750 3.771 72 HG11 VAL 5 HG11 VAL 5 59.041 -22.369 5.789 73 HG12 VAL 5 HG12 VAL 5 60.504 -22.602 4.832 74 HG13 VAL 5 HG13 VAL 5 59.384 -23.944 5.072 75 HG21 VAL 5 HG21 VAL 5 58.301 -20.454 4.311 76 HG22 VAL 5 HG22 VAL 5 58.333 -20.666 2.561 77 HG23 VAL 5 HG23 VAL 5 59.841 -20.655 3.475 78 HA PRO 6 HA PRO 6 57.137 -23.048 -1.068 79 HB2 PRO 6 HB2 PRO 6 54.726 -24.233 -0.789 80 HB3 PRO 6 HB3 PRO 6 56.218 -25.178 -0.975 81 HG2 PRO 6 HG2 PRO 6 54.610 -24.646 1.453 82 HG3 PRO 6 HG3 PRO 6 55.538 -26.086 0.998 83 HD2 PRO 6 HD2 PRO 6 56.394 -24.095 2.779 84 HD3 PRO 6 HD3 PRO 6 57.429 -25.317 2.010 85 H ARG 7 H ARG 7 55.624 -21.596 -1.959 86 HA ARG 7 HA ARG 7 53.733 -20.246 -0.195 87 HB2 ARG 7 HB2 ARG 7 54.613 -18.006 -0.752 88 HB3 ARG 7 HB3 ARG 7 55.788 -18.963 0.152 89 HG2 ARG 7 HG2 ARG 7 56.902 -19.582 -1.975 90 HG3 ARG 7 HG3 ARG 7 55.750 -18.579 -2.857 91 HD2 ARG 7 HD2 ARG 7 57.721 -17.246 -2.538 92 HD3 ARG 7 HD3 ARG 7 56.500 -16.630 -1.428 93 HE ARG 7 HE ARG 7 58.316 -18.644 -0.350 94 HH11 ARG 7 HH11 ARG 7 57.601 -15.219 -0.657 95 HH12 ARG 7 HH12 ARG 7 58.589 -14.790 0.699 96 HH21 ARG 7 HH21 ARG 7 59.572 -18.029 1.387 97 HH22 ARG 7 HH22 ARG 7 59.690 -16.362 1.841 98 H GLY 8 H GLY 8 52.338 -18.723 -1.406 99 HA2 GLY 8 HA2 GLY 8 51.625 -19.882 -3.971 100 HA3 GLY 8 HA3 GLY 8 50.719 -18.658 -3.086 101 H SER 9 H SER 9 50.708 -18.016 -5.548 102 HA SER 9 HA SER 9 52.986 -16.801 -6.691 103 HB2 SER 9 HB2 SER 9 50.064 -16.155 -7.152 104 HB3 SER 9 HB3 SER 9 51.401 -15.700 -8.202 105 HG SER 9 HG SER 9 50.242 -17.704 -8.681 106 H GLY 10 H GLY 10 53.474 -14.557 -6.946 107 HA2 GLY 10 HA2 GLY 10 52.169 -12.468 -5.569 108 HA3 GLY 10 HA3 GLY 10 53.488 -13.068 -4.570 109 H MET 11 H MET 11 54.051 -10.679 -5.042 110 HA MET 11 HA MET 11 55.741 -10.556 -7.477 111 HB2 MET 11 HB2 MET 11 54.286 -8.330 -6.032 112 HB3 MET 11 HB3 MET 11 55.444 -8.084 -7.340 113 HG2 MET 11 HG2 MET 11 54.034 -9.515 -8.815 114 HG3 MET 11 HG3 MET 11 52.850 -9.644 -7.515 115 HE1 MET 11 HE1 MET 11 51.015 -8.851 -8.969 116 HE2 MET 11 HE2 MET 11 52.037 -8.596 -10.381 117 HE3 MET 11 HE3 MET 11 50.940 -7.322 -9.854 118 H LYS 12 H LYS 12 57.760 -9.479 -7.272 119 HA LYS 12 HA LYS 12 58.905 -9.750 -4.588 120 HB2 LYS 12 HB2 LYS 12 60.240 -9.261 -7.263 121 HB3 LYS 12 HB3 LYS 12 61.071 -9.570 -5.738 122 HG2 LYS 12 HG2 LYS 12 59.785 -11.749 -5.595 123 HG3 LYS 12 HG3 LYS 12 59.246 -11.454 -7.247 124 HD2 LYS 12 HD2 LYS 12 62.150 -11.589 -6.389 125 HD3 LYS 12 HD3 LYS 12 61.267 -12.917 -7.143 126 HE2 LYS 12 HE2 LYS 12 61.765 -10.189 -8.370 127 HE3 LYS 12 HE3 LYS 12 62.549 -11.696 -8.840 128 HZ1 LYS 12 HZ1 LYS 12 60.855 -11.591 -10.349 129 HZ2 LYS 12 HZ2 LYS 12 59.783 -10.821 -9.279 130 HZ3 LYS 12 HZ3 LYS 12 60.098 -12.483 -9.121 131 H GLU 13 H GLU 13 59.849 -8.094 -3.464 132 HA GLU 13 HA GLU 13 59.389 -5.361 -4.511 133 HB2 GLU 13 HB2 GLU 13 59.554 -6.345 -1.652 134 HB3 GLU 13 HB3 GLU 13 59.332 -4.665 -2.141 135 HG2 GLU 13 HG2 GLU 13 57.256 -5.320 -3.346 136 HG3 GLU 13 HG3 GLU 13 57.460 -6.966 -2.760 137 H THR 14 H THR 14 60.979 -3.744 -3.978 138 HA THR 14 HA THR 14 63.673 -4.744 -4.249 139 HB THR 14 HB THR 14 64.310 -2.393 -4.398 140 HG1 THR 14 HG1 THR 14 62.846 -0.857 -3.935 141 HG21 THR 14 HG21 THR 14 62.910 -1.748 -6.324 142 HG22 THR 14 HG22 THR 14 61.728 -2.977 -5.875 143 HG23 THR 14 HG23 THR 14 63.343 -3.456 -6.397 144 H ALA 15 H ALA 15 65.440 -4.070 -2.837 145 HA ALA 15 HA ALA 15 64.705 -3.378 -0.090 146 HB1 ALA 15 HB1 ALA 15 65.566 -5.301 0.916 147 HB2 ALA 15 HB2 ALA 15 66.471 -5.768 -0.523 148 HB3 ALA 15 HB3 ALA 15 64.718 -5.954 -0.486 149 H ALA 16 H ALA 16 66.536 -2.759 1.210 150 HA ALA 16 HA ALA 16 68.748 -1.716 -0.431 151 HB1 ALA 16 HB1 ALA 16 67.833 0.070 0.760 152 HB2 ALA 16 HB2 ALA 16 69.176 -0.422 1.794 153 HB3 ALA 16 HB3 ALA 16 67.530 -0.913 2.193 154 H ALA 17 H ALA 17 70.895 -2.085 0.108 155 HA ALA 17 HA ALA 17 71.543 -4.607 1.169 156 HB1 ALA 17 HB1 ALA 17 73.806 -4.003 0.853 157 HB2 ALA 17 HB2 ALA 17 73.464 -2.287 1.068 158 HB3 ALA 17 HB3 ALA 17 72.930 -3.116 -0.394 159 H LYS 18 H LYS 18 72.381 -5.261 3.131 160 HA LYS 18 HA LYS 18 72.230 -3.302 5.352 161 HB2 LYS 18 HB2 LYS 18 71.531 -6.246 5.473 162 HB3 LYS 18 HB3 LYS 18 71.414 -5.084 6.793 163 HG2 LYS 18 HG2 LYS 18 69.866 -4.904 4.190 164 HG3 LYS 18 HG3 LYS 18 69.211 -5.510 5.711 165 HD2 LYS 18 HD2 LYS 18 69.789 -3.298 6.762 166 HD3 LYS 18 HD3 LYS 18 70.228 -2.710 5.157 167 HE2 LYS 18 HE2 LYS 18 68.017 -2.871 4.357 168 HE3 LYS 18 HE3 LYS 18 67.531 -3.956 5.660 169 HZ1 LYS 18 HZ1 LYS 18 66.659 -1.918 6.285 170 HZ2 LYS 18 HZ2 LYS 18 68.024 -1.049 5.765 171 HZ3 LYS 18 HZ3 LYS 18 68.102 -1.996 7.174 172 H PHE 19 H PHE 19 73.760 -3.497 6.991 173 HA PHE 19 HA PHE 19 76.143 -5.091 6.268 174 HB2 PHE 19 HB2 PHE 19 75.863 -2.658 8.036 175 HB3 PHE 19 HB3 PHE 19 77.360 -3.521 7.741 176 HD1 PHE 19 HD1 PHE 19 78.402 -3.480 5.477 177 HD2 PHE 19 HD2 PHE 19 74.942 -1.124 6.442 178 HE1 PHE 19 HE1 PHE 19 78.795 -2.080 3.468 179 HE2 PHE 19 HE2 PHE 19 75.336 0.277 4.433 180 HZ PHE 19 HZ PHE 19 77.262 -0.202 2.946 181 H GLU 20 H GLU 20 76.877 -6.643 7.596 182 HA GLU 20 HA GLU 20 75.472 -7.036 10.173 183 HB2 GLU 20 HB2 GLU 20 76.835 -9.048 8.366 184 HB3 GLU 20 HB3 GLU 20 76.120 -9.419 9.936 185 HG2 GLU 20 HG2 GLU 20 74.416 -9.965 8.401 186 HG3 GLU 20 HG3 GLU 20 73.960 -8.374 8.994 187 H ARG 21 H ARG 21 76.688 -7.713 11.985 188 HA ARG 21 HA ARG 21 79.333 -6.555 12.102 189 HB2 ARG 21 HB2 ARG 21 77.662 -6.402 13.969 190 HB3 ARG 21 HB3 ARG 21 77.873 -8.134 14.230 191 HG2 ARG 21 HG2 ARG 21 80.300 -7.771 14.590 192 HG3 ARG 21 HG3 ARG 21 80.057 -6.035 14.386 193 HD2 ARG 21 HD2 ARG 21 78.439 -6.088 16.294 194 HD3 ARG 21 HD3 ARG 21 78.839 -7.785 16.539 195 HE ARG 21 HE ARG 21 80.523 -5.485 17.150 196 HH11 ARG 21 HH11 ARG 21 80.362 -8.974 16.805 197 HH12 ARG 21 HH12 ARG 21 81.798 -9.232 17.739 198 HH21 ARG 21 HH21 ARG 21 82.364 -5.879 18.343 199 HH22 ARG 21 HH22 ARG 21 82.916 -7.501 18.599 200 H GLN 22 H GLN 22 81.266 -7.649 12.544 201 HA GLN 22 HA GLN 22 81.226 -10.581 12.304 202 HB2 GLN 22 HB2 GLN 22 82.957 -10.554 10.602 203 HB3 GLN 22 HB3 GLN 22 81.559 -9.643 10.039 204 HG2 GLN 22 HG2 GLN 22 82.738 -7.548 10.877 205 HG3 GLN 22 HG3 GLN 22 84.174 -8.546 11.098 206 HE21 GLN 22 HE21 GLN 22 85.490 -7.796 9.380 207 HE22 GLN 22 HE22 GLN 22 85.024 -7.851 7.748 208 H HIS 23 H HIS 23 83.372 -11.549 12.793 209 HA HIS 23 HA HIS 23 84.672 -10.041 14.981 210 HB2 HIS 23 HB2 HIS 23 84.535 -13.020 14.498 211 HB3 HIS 23 HB3 HIS 23 85.325 -12.239 15.854 212 HD1 HIS 23 HD1 HIS 23 83.625 -10.792 17.445 213 HD2 HIS 23 HD2 HIS 23 81.882 -13.631 14.936 214 HE1 HIS 23 HE1 HIS 23 81.303 -11.224 18.355 215 H MET 24 H MET 24 86.877 -9.834 15.038 216 HA MET 24 HA MET 24 88.279 -10.438 12.535 217 HB2 MET 24 HB2 MET 24 89.046 -8.734 14.914 218 HB3 MET 24 HB3 MET 24 90.045 -8.952 13.477 219 HG2 MET 24 HG2 MET 24 88.117 -8.108 12.096 220 HG3 MET 24 HG3 MET 24 87.277 -7.724 13.598 221 HE1 MET 24 HE1 MET 24 89.219 -5.077 15.315 222 HE2 MET 24 HE2 MET 24 90.028 -6.638 15.435 223 HE3 MET 24 HE3 MET 24 88.268 -6.561 15.446 224 H ASP 25 H ASP 25 90.130 -11.679 12.423 225 HA ASP 25 HA ASP 25 91.156 -12.933 14.855 226 HB2 ASP 25 HB2 ASP 25 90.902 -15.197 13.982 227 HB3 ASP 25 HB3 ASP 25 89.328 -14.419 14.119 228 H SER 26 H SER 26 93.018 -14.488 14.201 229 HA SER 26 HA SER 26 94.978 -12.958 12.867 230 HB2 SER 26 HB2 SER 26 95.152 -15.941 13.263 231 HB3 SER 26 HB3 SER 26 96.453 -14.756 13.274 232 HG SER 26 HG SER 26 95.755 -15.403 15.360 233 HA PRO 27 HA PRO 27 94.205 -14.239 8.696 234 HB2 PRO 27 HB2 PRO 27 96.530 -13.621 7.471 235 HB3 PRO 27 HB3 PRO 27 95.457 -12.369 8.126 236 HG2 PRO 27 HG2 PRO 27 97.995 -13.437 9.212 237 HG3 PRO 27 HG3 PRO 27 97.329 -11.797 9.290 238 HD2 PRO 27 HD2 PRO 27 97.221 -13.694 11.352 239 HD3 PRO 27 HD3 PRO 27 96.236 -12.220 11.246 240 H ASP 28 H ASP 28 94.691 -15.832 7.087 241 HA ASP 28 HA ASP 28 95.705 -18.285 8.113 242 HB2 ASP 28 HB2 ASP 28 95.036 -17.454 5.280 243 HB3 ASP 28 HB3 ASP 28 95.382 -19.105 5.787 244 H LEU 29 H LEU 29 97.591 -19.395 7.633 245 HA LEU 29 HA LEU 29 99.848 -17.712 6.872 246 HB2 LEU 29 HB2 LEU 29 99.798 -20.593 7.800 247 HB3 LEU 29 HB3 LEU 29 101.229 -19.579 7.631 248 HG LEU 29 HG LEU 29 98.900 -18.984 9.482 249 HD11 LEU 29 HD11 LEU 29 100.112 -20.927 10.288 250 HD12 LEU 29 HD12 LEU 29 100.580 -19.537 11.268 251 HD13 LEU 29 HD13 LEU 29 101.659 -20.130 10.004 252 HD21 LEU 29 HD21 LEU 29 100.786 -17.433 10.433 253 HD22 LEU 29 HD22 LEU 29 99.897 -16.911 9.003 254 HD23 LEU 29 HD23 LEU 29 101.504 -17.616 8.833 255 H GLY 30 H GLY 30 101.198 -18.083 5.130 256 HA2 GLY 30 HA2 GLY 30 100.047 -19.032 2.753 257 HA3 GLY 30 HA3 GLY 30 101.763 -18.712 2.989 258 H THR 31 H THR 31 100.337 -20.907 1.557 259 HA THR 31 HA THR 31 101.755 -23.145 2.843 260 HB THR 31 HB THR 31 99.375 -23.319 3.456 261 HG1 THR 31 HG1 THR 31 99.176 -25.402 2.642 262 HG21 THR 31 HG21 THR 31 98.810 -23.654 0.505 263 HG22 THR 31 HG22 THR 31 98.568 -22.128 1.355 264 HG23 THR 31 HG23 THR 31 97.646 -23.556 1.826 265 H ASP 32 H ASP 32 102.136 -24.963 1.354 266 HA ASP 32 HA ASP 32 103.164 -24.032 -1.136 267 HB2 ASP 32 HB2 ASP 32 103.725 -26.403 -1.530 268 HB3 ASP 32 HB3 ASP 32 104.243 -25.856 0.059 269 H ASP 33 H ASP 33 102.649 -25.645 -3.118 270 HA ASP 33 HA ASP 33 100.063 -24.895 -4.001 271 HB2 ASP 33 HB2 ASP 33 100.560 -26.227 -5.985 272 HB3 ASP 33 HB3 ASP 33 101.961 -25.262 -5.534 273 H ASP 34 H ASP 34 98.150 -25.843 -3.752 274 HA ASP 34 HA ASP 34 97.960 -28.717 -3.297 275 HB2 ASP 34 HB2 ASP 34 96.589 -28.437 -1.265 276 HB3 ASP 34 HB3 ASP 34 98.237 -27.868 -1.035 277 H ASP 35 H ASP 35 95.458 -29.182 -2.846 278 HA ASP 35 HA ASP 35 94.086 -28.510 -5.210 279 HB2 ASP 35 HB2 ASP 35 93.019 -29.555 -2.578 280 HB3 ASP 35 HB3 ASP 35 92.108 -29.507 -4.084 281 H LYS 36 H LYS 36 92.261 -27.178 -5.551 282 HA LYS 36 HA LYS 36 92.420 -24.635 -4.251 283 HB2 LYS 36 HB2 LYS 36 90.402 -25.750 -6.214 284 HB3 LYS 36 HB3 LYS 36 90.476 -24.064 -5.699 285 HG2 LYS 36 HG2 LYS 36 92.827 -23.952 -6.525 286 HG3 LYS 36 HG3 LYS 36 92.661 -25.599 -7.133 287 HD2 LYS 36 HD2 LYS 36 90.725 -24.847 -8.522 288 HD3 LYS 36 HD3 LYS 36 91.027 -23.194 -7.988 289 HE2 LYS 36 HE2 LYS 36 92.134 -23.429 -10.101 290 HE3 LYS 36 HE3 LYS 36 93.397 -23.463 -8.871 291 HZ1 LYS 36 HZ1 LYS 36 92.143 -25.951 -9.848 292 HZ2 LYS 36 HZ2 LYS 36 93.640 -25.749 -9.068 293 HZ3 LYS 36 HZ3 LYS 36 93.442 -25.242 -10.677 294 H THR 37 H THR 37 90.958 -23.641 -2.884 295 HA THR 37 HA THR 37 88.954 -25.412 -1.600 296 HB THR 37 HB THR 37 89.447 -24.316 0.521 297 HG1 THR 37 HG1 THR 37 90.270 -22.425 0.240 298 HG21 THR 37 HG21 THR 37 90.842 -26.291 -0.393 299 HG22 THR 37 HG22 THR 37 91.503 -25.386 0.969 300 HG23 THR 37 HG23 THR 37 92.110 -25.094 -0.661 301 H GLY 38 H GLY 38 87.244 -24.170 -0.438 302 HA2 GLY 38 HA2 GLY 38 86.133 -22.179 -2.214 303 HA3 GLY 38 HA3 GLY 38 85.369 -22.839 -0.770 304 H GLY 39 H GLY 39 84.792 -20.455 -0.612 305 HA2 GLY 39 HA2 GLY 39 86.873 -18.616 0.156 306 HA3 GLY 39 HA3 GLY 39 85.138 -18.320 0.225 307 H GLY 40 H GLY 40 86.137 -17.280 2.297 308 HA2 GLY 40 HA2 GLY 40 85.456 -19.030 4.512 309 HA3 GLY 40 HA3 GLY 40 87.133 -18.493 4.486 310 H ARG 41 H ARG 41 86.372 -17.564 6.610 311 HA ARG 41 HA ARG 41 84.522 -15.478 6.820 312 HB2 ARG 41 HB2 ARG 41 87.079 -15.929 8.378 313 HB3 ARG 41 HB3 ARG 41 85.787 -14.826 8.852 314 HG2 ARG 41 HG2 ARG 41 84.196 -16.744 8.864 315 HG3 ARG 41 HG3 ARG 41 85.540 -17.827 8.500 316 HD2 ARG 41 HD2 ARG 41 86.685 -16.972 10.579 317 HD3 ARG 41 HD3 ARG 41 85.201 -16.108 10.969 318 HE ARG 41 HE ARG 41 85.686 -18.898 11.330 319 HH11 ARG 41 HH11 ARG 41 83.128 -16.639 10.504 320 HH12 ARG 41 HH12 ARG 41 81.877 -17.694 11.074 321 HH21 ARG 41 HH21 ARG 41 84.033 -20.211 12.047 322 HH22 ARG 41 HH22 ARG 41 82.384 -19.691 11.936 323 H ALA 42 H ALA 42 84.692 -13.245 6.713 324 HA ALA 42 HA ALA 42 86.333 -12.180 4.683 325 HB1 ALA 42 HB1 ALA 42 84.087 -11.306 5.711 326 HB2 ALA 42 HB2 ALA 42 85.268 -10.153 5.088 327 HB3 ALA 42 HB3 ALA 42 85.151 -10.444 6.824 328 H ASP 43 H ASP 43 88.141 -10.855 4.752 329 HA ASP 43 HA ASP 43 90.064 -11.411 6.750 330 HB2 ASP 43 HB2 ASP 43 91.407 -9.655 5.627 331 HB3 ASP 43 HB3 ASP 43 90.726 -10.810 4.484 332 HA PRO 44 HA PRO 44 89.063 -8.400 9.818 333 HB2 PRO 44 HB2 PRO 44 91.507 -7.709 10.833 334 HB3 PRO 44 HB3 PRO 44 90.713 -9.259 11.176 335 HG2 PRO 44 HG2 PRO 44 92.895 -8.638 9.256 336 HG3 PRO 44 HG3 PRO 44 92.671 -10.057 10.297 337 HD2 PRO 44 HD2 PRO 44 92.087 -10.073 7.625 338 HD3 PRO 44 HD3 PRO 44 91.250 -11.101 8.809 339 H ALA 45 H ALA 45 89.430 -6.105 10.492 340 HA ALA 45 HA ALA 45 89.381 -4.369 8.269 341 HB1 ALA 45 HB1 ALA 45 88.321 -3.942 10.513 342 HB2 ALA 45 HB2 ALA 45 89.242 -2.581 9.874 343 HB3 ALA 45 HB3 ALA 45 89.932 -3.594 11.141 344 H HIS 46 H HIS 46 90.877 -2.945 7.440 345 HA HIS 46 HA HIS 46 93.664 -3.206 8.415 346 HB2 HIS 46 HB2 HIS 46 92.717 -3.016 5.553 347 HB3 HIS 46 HB3 HIS 46 94.392 -3.005 6.071 348 HD1 HIS 46 HD1 HIS 46 95.083 -5.294 7.486 349 HD2 HIS 46 HD2 HIS 46 91.784 -5.527 4.947 350 HE1 HIS 46 HE1 HIS 46 94.686 -7.756 7.054 351 H ARG 47 H ARG 47 94.931 -1.355 8.334 352 HA ARG 47 HA ARG 47 93.553 1.122 8.607 353 HB2 ARG 47 HB2 ARG 47 95.700 0.539 9.764 354 HB3 ARG 47 HB3 ARG 47 96.523 0.696 8.212 355 HG2 ARG 47 HG2 ARG 47 95.799 3.026 8.026 356 HG3 ARG 47 HG3 ARG 47 94.891 2.885 9.532 357 HD2 ARG 47 HD2 ARG 47 96.992 3.937 10.061 358 HD3 ARG 47 HD3 ARG 47 97.055 2.290 10.683 359 HE ARG 47 HE ARG 47 98.710 1.807 9.129 360 HH11 ARG 47 HH11 ARG 47 97.247 4.883 8.281 361 HH12 ARG 47 HH12 ARG 47 98.444 5.233 7.078 362 HH21 ARG 47 HH21 ARG 47 100.221 2.313 7.569 363 HH22 ARG 47 HH22 ARG 47 100.106 3.795 6.681 364 H SER 48 H SER 48 93.559 2.933 7.272 365 HA SER 48 HA SER 48 94.012 2.340 4.419 366 HB2 SER 48 HB2 SER 48 92.478 4.225 4.014 367 HB3 SER 48 HB3 SER 48 91.740 2.986 5.024 368 HG SER 48 HG SER 48 92.438 5.532 5.625 369 HA PRO 49 HA PRO 49 97.667 5.101 5.225 370 HB2 PRO 49 HB2 PRO 49 97.863 4.622 2.277 371 HB3 PRO 49 HB3 PRO 49 99.140 4.613 3.510 372 HG2 PRO 49 HG2 PRO 49 98.166 2.352 2.504 373 HG3 PRO 49 HG3 PRO 49 98.652 2.486 4.203 374 HD2 PRO 49 HD2 PRO 49 95.921 2.332 3.046 375 HD3 PRO 49 HD3 PRO 49 96.498 1.839 4.652 376 H VAL 50 H VAL 50 98.258 7.230 4.302 377 HA VAL 50 HA VAL 50 95.825 8.686 3.626 378 HB VAL 50 HB VAL 50 98.618 9.675 4.268 379 HG11 VAL 50 HG11 VAL 50 97.174 11.246 2.922 380 HG12 VAL 50 HG12 VAL 50 97.619 11.861 4.514 381 HG13 VAL 50 HG13 VAL 50 96.004 11.207 4.240 382 HG21 VAL 50 HG21 VAL 50 97.603 10.247 6.467 383 HG22 VAL 50 HG22 VAL 50 97.585 8.510 6.160 384 HG23 VAL 50 HG23 VAL 50 96.110 9.456 5.962 385 HA PRO 51 HA PRO 51 96.803 8.867 -0.759 386 HB2 PRO 51 HB2 PRO 51 96.010 11.744 -0.619 387 HB3 PRO 51 HB3 PRO 51 95.451 10.472 -1.724 388 HG2 PRO 51 HG2 PRO 51 93.930 11.337 0.277 389 HG3 PRO 51 HG3 PRO 51 93.939 9.634 -0.217 390 HD2 PRO 51 HD2 PRO 51 95.157 10.893 2.194 391 HD3 PRO 51 HD3 PRO 51 94.500 9.257 1.984 392 H LEU 52 H LEU 52 98.403 9.806 -2.180 393 HA LEU 52 HA LEU 52 100.800 10.466 -0.851 394 HB2 LEU 52 HB2 LEU 52 99.962 10.549 -3.745 395 HB3 LEU 52 HB3 LEU 52 101.571 11.058 -3.236 396 HG LEU 52 HG LEU 52 100.393 8.367 -2.508 397 HD11 LEU 52 HD11 LEU 52 100.543 8.187 -4.838 398 HD12 LEU 52 HD12 LEU 52 102.142 7.646 -4.327 399 HD13 LEU 52 HD13 LEU 52 101.918 9.288 -4.931 400 HD21 LEU 52 HD21 LEU 52 102.931 7.912 -2.307 401 HD22 LEU 52 HD22 LEU 52 102.188 8.902 -1.051 402 HD23 LEU 52 HD23 LEU 52 103.117 9.665 -2.341 403 HA PRO 53 HA PRO 53 100.444 14.910 -0.456 404 HB2 PRO 53 HB2 PRO 53 103.277 15.158 -1.316 405 HB3 PRO 53 HB3 PRO 53 102.502 15.687 0.190 406 HG2 PRO 53 HG2 PRO 53 104.148 13.593 0.117 407 HG3 PRO 53 HG3 PRO 53 102.739 13.645 1.192 408 HD2 PRO 53 HD2 PRO 53 103.086 12.141 -1.375 409 HD3 PRO 53 HD3 PRO 53 102.221 11.669 0.106 410 H SER 54 H SER 54 100.097 16.704 -1.793 411 HA SER 54 HA SER 54 99.458 16.195 -4.449 412 HB2 SER 54 HB2 SER 54 99.412 18.736 -4.659 413 HB3 SER 54 HB3 SER 54 98.419 18.047 -3.380 414 HG SER 54 HG SER 54 99.627 19.638 -2.484 415 HA PRO 55 HA PRO 55 103.472 16.195 -6.162 416 HB2 PRO 55 HB2 PRO 55 102.973 16.236 -8.814 417 HB3 PRO 55 HB3 PRO 55 102.513 14.862 -7.791 418 HG2 PRO 55 HG2 PRO 55 100.831 17.022 -8.918 419 HG3 PRO 55 HG3 PRO 55 100.445 15.317 -8.629 420 HD2 PRO 55 HD2 PRO 55 99.702 17.449 -6.970 421 HD3 PRO 55 HD3 PRO 55 99.697 15.732 -6.515 422 H THR 56 H THR 56 104.846 17.870 -5.930 423 HA THR 56 HA THR 56 104.472 20.345 -7.433 424 HB THR 56 HB THR 56 106.590 21.033 -6.433 425 HG1 THR 56 HG1 THR 56 106.763 18.588 -5.168 426 HG21 THR 56 HG21 THR 56 105.206 19.580 -4.200 427 HG22 THR 56 HG22 THR 56 104.351 20.852 -5.073 428 HG23 THR 56 HG23 THR 56 105.855 21.219 -4.228 429 H SER 57 H SER 57 106.215 21.014 -9.016 430 HA SER 57 HA SER 57 106.302 19.096 -11.057 431 HB2 SER 57 HB2 SER 57 107.595 20.658 -12.294 432 HB3 SER 57 HB3 SER 57 106.550 21.626 -11.260 433 HG SER 57 HG SER 57 108.262 22.196 -10.163 434 H ASN 58 H ASN 58 107.497 17.359 -11.322 435 HA ASN 58 HA ASN 58 109.282 15.939 -11.407 436 HB2 ASN 58 HB2 ASN 58 110.903 18.399 -10.739 437 HB3 ASN 58 HB3 ASN 58 111.525 16.886 -11.396 438 HD21 ASN 58 HD21 ASN 58 109.583 16.300 -13.359 439 HD22 ASN 58 HD22 ASN 58 109.598 17.521 -14.539 440 H LYS 59 H LYS 59 108.000 16.778 -8.634 441 HA LYS 59 HA LYS 59 109.956 15.300 -7.038 442 HB2 LYS 59 HB2 LYS 59 109.065 18.104 -6.333 443 HB3 LYS 59 HB3 LYS 59 109.965 17.033 -5.263 444 HG2 LYS 59 HG2 LYS 59 111.778 16.912 -6.982 445 HG3 LYS 59 HG3 LYS 59 110.895 18.097 -7.946 446 HD2 LYS 59 HD2 LYS 59 110.972 19.670 -6.005 447 HD3 LYS 59 HD3 LYS 59 111.988 18.507 -5.150 448 HE2 LYS 59 HE2 LYS 59 112.698 19.615 -7.875 449 HE3 LYS 59 HE3 LYS 59 113.249 20.346 -6.367 450 HZ1 LYS 59 HZ1 LYS 59 114.703 18.702 -6.007 451 HZ2 LYS 59 HZ2 LYS 59 114.541 18.392 -7.669 452 HZ3 LYS 59 HZ3 LYS 59 113.643 17.492 -6.543 453 H GLN 60 H GLN 60 109.089 14.256 -5.268 454 HA GLN 60 HA GLN 60 106.539 15.134 -4.172 455 HB2 GLN 60 HB2 GLN 60 106.917 12.350 -5.276 456 HB3 GLN 60 HB3 GLN 60 105.676 12.757 -4.094 457 HG2 GLN 60 HG2 GLN 60 104.885 14.552 -5.701 458 HG3 GLN 60 HG3 GLN 60 105.989 13.854 -6.889 459 HE21 GLN 60 HE21 GLN 60 102.920 13.345 -5.196 460 HE22 GLN 60 HE22 GLN 60 102.492 11.947 -6.060 461 H ASP 61 H ASP 61 106.186 14.460 -2.032 462 HA ASP 61 HA ASP 61 108.535 13.336 -0.673 463 HB2 ASP 61 HB2 ASP 61 105.987 14.559 0.421 464 HB3 ASP 61 HB3 ASP 61 107.331 13.977 1.400 465 H ILE 62 H ILE 62 108.582 11.257 0.020 466 HA ILE 62 HA ILE 62 106.030 9.750 0.066 467 HB ILE 62 HB ILE 62 107.364 9.353 -2.012 468 HG12 ILE 62 HG12 ILE 62 107.419 6.778 -1.624 469 HG13 ILE 62 HG13 ILE 62 106.750 7.171 -0.040 470 HG21 ILE 62 HG21 ILE 62 109.392 7.897 -1.779 471 HG22 ILE 62 HG22 ILE 62 109.370 8.225 -0.047 472 HG23 ILE 62 HG23 ILE 62 109.624 9.543 -1.190 473 HD11 ILE 62 HD11 ILE 62 105.507 8.416 -2.472 474 HD12 ILE 62 HD12 ILE 62 104.768 8.000 -0.926 475 HD13 ILE 62 HD13 ILE 62 105.139 6.735 -2.096 476 H SER 63 H SER 63 105.882 8.073 1.639 477 HA SER 63 HA SER 63 108.078 7.835 3.542 478 HB2 SER 63 HB2 SER 63 106.884 8.682 5.436 479 HB3 SER 63 HB3 SER 63 106.817 9.910 4.178 480 HG SER 63 HG SER 63 104.770 8.797 3.661 481 H GLU 64 H GLU 64 107.675 6.301 5.255 482 HA GLU 64 HA GLU 64 106.673 3.872 4.378 483 HB2 GLU 64 HB2 GLU 64 106.872 3.142 6.721 484 HB3 GLU 64 HB3 GLU 64 108.275 4.080 6.212 485 HG2 GLU 64 HG2 GLU 64 107.258 6.103 7.238 486 HG3 GLU 64 HG3 GLU 64 105.930 5.111 7.827 487 H ALA 65 H ALA 65 105.019 6.462 6.123 488 HA ALA 65 HA ALA 65 102.833 5.001 7.099 489 HB1 ALA 65 HB1 ALA 65 101.654 7.335 6.792 490 HB2 ALA 65 HB2 ALA 65 103.288 7.879 6.410 491 HB3 ALA 65 HB3 ALA 65 102.947 7.143 7.976 492 H ASN 66 H ASN 66 103.293 6.631 3.971 493 HA ASN 66 HA ASN 66 100.610 6.202 3.091 494 HB2 ASN 66 HB2 ASN 66 103.016 6.654 1.319 495 HB3 ASN 66 HB3 ASN 66 101.327 7.001 0.962 496 HD21 ASN 66 HD21 ASN 66 100.340 8.875 2.055 497 HD22 ASN 66 HD22 ASN 66 101.313 10.084 2.740 498 H LEU 67 H LEU 67 103.690 4.552 2.422 499 HA LEU 67 HA LEU 67 102.512 2.703 0.587 500 HB2 LEU 67 HB2 LEU 67 105.201 2.924 1.899 501 HB3 LEU 67 HB3 LEU 67 104.773 1.491 0.964 502 HG LEU 67 HG LEU 67 104.049 3.125 -0.886 503 HD11 LEU 67 HD11 LEU 67 103.964 5.228 0.101 504 HD12 LEU 67 HD12 LEU 67 105.555 5.269 -0.657 505 HD13 LEU 67 HD13 LEU 67 105.413 4.945 1.068 506 HD21 LEU 67 HD21 LEU 67 106.999 3.389 -0.435 507 HD22 LEU 67 HD22 LEU 67 106.122 2.906 -1.883 508 HD23 LEU 67 HD23 LEU 67 106.327 1.763 -0.559 509 H ALA 68 H ALA 68 102.906 2.656 4.051 510 HA ALA 68 HA ALA 68 102.229 1.162 5.637 511 HB1 ALA 68 HB1 ALA 68 101.022 -0.747 3.700 512 HB2 ALA 68 HB2 ALA 68 100.326 0.872 3.753 513 HB3 ALA 68 HB3 ALA 68 100.376 -0.114 5.214 514 H TYR 69 H TYR 69 102.142 -1.876 4.963 515 HA TYR 69 HA TYR 69 104.749 -2.449 5.791 516 HB2 TYR 69 HB2 TYR 69 102.778 -4.198 4.326 517 HB3 TYR 69 HB3 TYR 69 104.237 -4.775 5.109 518 HD1 TYR 69 HD1 TYR 69 104.464 -4.555 7.612 519 HD2 TYR 69 HD2 TYR 69 100.787 -3.752 5.543 520 HE1 TYR 69 HE1 TYR 69 103.219 -4.757 9.747 521 HE2 TYR 69 HE2 TYR 69 99.541 -3.953 7.678 522 HH TYR 69 HH TYR 69 100.827 -3.777 10.556 523 H LEU 70 H LEU 70 103.595 -1.728 2.614 524 HA LEU 70 HA LEU 70 105.426 -3.154 1.023 525 HB2 LEU 70 HB2 LEU 70 104.167 -0.459 0.477 526 HB3 LEU 70 HB3 LEU 70 104.897 -1.522 -0.724 527 HG LEU 70 HG LEU 70 102.534 -2.267 1.025 528 HD11 LEU 70 HD11 LEU 70 101.157 -1.929 -0.918 529 HD12 LEU 70 HD12 LEU 70 102.567 -1.650 -1.941 530 HD13 LEU 70 HD13 LEU 70 102.118 -0.464 -0.715 531 HD21 LEU 70 HD21 LEU 70 104.048 -3.648 -1.196 532 HD22 LEU 70 HD22 LEU 70 102.386 -4.089 -0.803 533 HD23 LEU 70 HD23 LEU 70 103.656 -4.267 0.408 534 H TRP 71 H TRP 71 105.939 -0.367 3.027 535 HA TRP 71 HA TRP 71 107.945 0.993 1.676 536 HB2 TRP 71 HB2 TRP 71 106.751 1.614 3.821 537 HB3 TRP 71 HB3 TRP 71 107.874 0.556 4.650 538 HD1 TRP 71 HD1 TRP 71 109.898 1.729 5.584 539 HE1 TRP 71 HE1 TRP 71 111.166 3.911 5.081 540 HE3 TRP 71 HE3 TRP 71 107.318 3.336 1.484 541 HZ2 TRP 71 HZ2 TRP 71 111.122 6.051 3.176 542 HZ3 TRP 71 HZ3 TRP 71 107.952 5.441 0.344 543 HH2 TRP 71 HH2 TRP 71 109.847 6.797 1.184 544 HA PRO 72 HA PRO 72 110.858 -2.471 2.142 545 HB2 PRO 72 HB2 PRO 72 112.494 -1.989 0.088 546 HB3 PRO 72 HB3 PRO 72 110.807 -2.472 -0.184 547 HG2 PRO 72 HG2 PRO 72 112.063 0.196 -0.438 548 HG3 PRO 72 HG3 PRO 72 110.747 -0.533 -1.373 549 HD2 PRO 72 HD2 PRO 72 110.464 1.282 0.781 550 HD3 PRO 72 HD3 PRO 72 109.168 0.343 0.008 551 H LEU 73 H LEU 73 111.670 0.849 2.551 552 HA LEU 73 HA LEU 73 114.510 0.306 3.054 553 HB2 LEU 73 HB2 LEU 73 112.984 2.917 3.108 554 HB3 LEU 73 HB3 LEU 73 114.733 2.730 3.218 555 HG LEU 73 HG LEU 73 113.076 1.777 0.868 556 HD11 LEU 73 HD11 LEU 73 113.198 4.316 1.346 557 HD12 LEU 73 HD12 LEU 73 113.676 3.769 -0.267 558 HD13 LEU 73 HD13 LEU 73 114.908 4.176 0.928 559 HD21 LEU 73 HD21 LEU 73 115.374 1.746 -0.203 560 HD22 LEU 73 HD22 LEU 73 115.154 0.551 1.072 561 HD23 LEU 73 HD23 LEU 73 116.054 2.031 1.399 562 H THR 74 H THR 74 115.518 0.609 4.987 563 HA THR 74 HA THR 74 114.048 0.358 7.410 564 HB THR 74 HB THR 74 116.227 0.589 8.506 565 HG1 THR 74 HG1 THR 74 117.618 1.748 7.514 566 HG21 THR 74 HG21 THR 74 117.148 -1.396 7.681 567 HG22 THR 74 HG22 THR 74 116.753 -0.997 6.008 568 HG23 THR 74 HG23 THR 74 115.478 -1.500 7.119 569 H VAL 75 H VAL 75 115.595 3.100 5.739 570 HA VAL 75 HA VAL 75 115.127 5.005 7.795 571 HB VAL 75 HB VAL 75 115.235 6.703 5.940 572 HG11 VAL 75 HG11 VAL 75 117.390 4.582 6.117 573 HG12 VAL 75 HG12 VAL 75 117.262 6.050 7.086 574 HG13 VAL 75 HG13 VAL 75 117.620 6.160 5.363 575 HG21 VAL 75 HG21 VAL 75 114.284 5.230 4.148 576 HG22 VAL 75 HG22 VAL 75 115.761 4.270 4.202 577 HG23 VAL 75 HG23 VAL 75 115.823 5.955 3.696 578 H ASP 76 H ASP 76 113.285 6.070 8.378 579 HA ASP 76 HA ASP 76 110.899 4.686 7.783 580 HB2 ASP 76 HB2 ASP 76 111.329 7.339 9.175 581 HB3 ASP 76 HB3 ASP 76 109.795 6.476 9.134 582 H HIS 77 H HIS 77 112.223 7.687 6.478 583 HA HIS 77 HA HIS 77 110.192 7.551 4.389 584 HB2 HIS 77 HB2 HIS 77 109.655 9.966 4.626 585 HB3 HIS 77 HB3 HIS 77 109.067 8.968 5.941 586 HD1 HIS 77 HD1 HIS 77 111.102 8.885 7.993 587 HD2 HIS 77 HD2 HIS 77 110.689 12.287 5.619 588 HE1 HIS 77 HE1 HIS 77 112.155 10.791 9.285 589 H GLY 78 H GLY 78 110.624 9.362 2.746 590 HA2 GLY 78 HA2 GLY 78 113.182 10.607 2.654 591 HA3 GLY 78 HA3 GLY 78 113.131 9.179 1.626 592 H THR 79 H THR 79 113.491 11.742 0.591 593 HA THR 79 HA THR 79 110.898 12.334 -0.711 594 HB THR 79 HB THR 79 113.324 14.125 -0.786 595 HG1 THR 79 HG1 THR 79 111.280 14.154 1.107 596 HG21 THR 79 HG21 THR 79 111.305 15.777 -0.887 597 HG22 THR 79 HG22 THR 79 110.353 14.337 -1.259 598 HG23 THR 79 HG23 THR 79 111.677 14.822 -2.323 599 H ILE 80 H ILE 80 110.735 12.266 -2.928 600 HA ILE 80 HA ILE 80 113.055 11.101 -4.351 601 HB ILE 80 HB ILE 80 111.378 10.219 -5.950 602 HG12 ILE 80 HG12 ILE 80 109.350 11.237 -3.932 603 HG13 ILE 80 HG13 ILE 80 109.635 11.966 -5.510 604 HG21 ILE 80 HG21 ILE 80 110.483 8.497 -4.426 605 HG22 ILE 80 HG22 ILE 80 110.881 9.517 -3.043 606 HG23 ILE 80 HG23 ILE 80 112.168 8.863 -4.054 607 HD11 ILE 80 HD11 ILE 80 109.229 9.508 -6.382 608 HD12 ILE 80 HD12 ILE 80 107.862 10.561 -6.007 609 HD13 ILE 80 HD13 ILE 80 108.379 9.331 -4.848 610 H GLU 81 H GLU 81 113.841 12.077 -6.153 611 HA GLU 81 HA GLU 81 112.396 14.393 -7.238 612 HB2 GLU 81 HB2 GLU 81 115.225 14.507 -6.173 613 HB3 GLU 81 HB3 GLU 81 114.429 15.794 -7.079 614 HG2 GLU 81 HG2 GLU 81 112.649 15.875 -5.341 615 HG3 GLU 81 HG3 GLU 81 113.522 14.658 -4.419 616 H CYS 82 H CYS 82 112.733 14.792 -9.332 617 HA CYS 82 HA CYS 82 114.742 13.168 -10.774 618 HB2 CYS 82 HB2 CYS 82 112.076 14.321 -11.556 619 HB3 CYS 82 HB3 CYS 82 113.285 13.962 -12.789 620 H LEU 83 H LEU 83 116.488 14.217 -11.491 621 HA LEU 83 HA LEU 83 116.622 17.107 -11.268 622 HB2 LEU 83 HB2 LEU 83 118.632 14.976 -11.995 623 HB3 LEU 83 HB3 LEU 83 119.009 16.698 -12.068 624 HG LEU 83 HG LEU 83 117.820 15.480 -9.582 625 HD11 LEU 83 HD11 LEU 83 120.781 15.793 -10.141 626 HD12 LEU 83 HD12 LEU 83 119.927 14.255 -10.268 627 HD13 LEU 83 HD13 LEU 83 120.032 15.079 -8.713 628 HD21 LEU 83 HD21 LEU 83 119.345 17.981 -10.312 629 HD22 LEU 83 HD22 LEU 83 119.242 17.431 -8.639 630 HD23 LEU 83 HD23 LEU 83 117.774 17.846 -9.524 631 HA PRO 84 HA PRO 84 115.873 18.293 -15.474 632 HB2 PRO 84 HB2 PRO 84 118.561 19.584 -15.546 633 HB3 PRO 84 HB3 PRO 84 116.968 20.264 -15.934 634 HG2 PRO 84 HG2 PRO 84 118.217 20.870 -13.670 635 HG3 PRO 84 HG3 PRO 84 116.455 20.675 -13.737 636 HD2 PRO 84 HD2 PRO 84 118.505 18.830 -12.595 637 HD3 PRO 84 HD3 PRO 84 116.826 19.113 -12.083 638 H SER 85 H SER 85 118.830 16.649 -14.650 639 HA SER 85 HA SER 85 119.650 16.109 -17.363 640 HB2 SER 85 HB2 SER 85 121.454 14.893 -16.393 641 HB3 SER 85 HB3 SER 85 121.197 16.312 -15.383 642 HG SER 85 HG SER 85 120.071 14.975 -13.987 643 H ASP 86 H ASP 86 117.062 14.913 -15.772 644 HA ASP 86 HA ASP 86 115.761 13.058 -15.917 645 HB2 ASP 86 HB2 ASP 86 117.572 12.304 -18.228 646 HB3 ASP 86 HB3 ASP 86 116.028 11.560 -17.837 647 H ASN 87 H ASN 87 117.909 13.109 -14.088 648 HA ASN 87 HA ASN 87 118.574 10.229 -13.897 649 HB2 ASN 87 HB2 ASN 87 119.809 12.639 -12.539 650 HB3 ASN 87 HB3 ASN 87 120.242 10.966 -12.193 651 HD21 ASN 87 HD21 ASN 87 122.141 12.868 -13.233 652 HD22 ASN 87 HD22 ASN 87 122.581 12.366 -14.793 653 H ALA 88 H ALA 88 117.539 9.068 -12.391 654 HA ALA 88 HA ALA 88 115.699 10.477 -10.589 655 HB1 ALA 88 HB1 ALA 88 115.184 8.405 -12.169 656 HB2 ALA 88 HB2 ALA 88 114.408 8.567 -10.595 657 HB3 ALA 88 HB3 ALA 88 115.797 7.498 -10.788 658 H VAL 89 H VAL 89 116.235 10.798 -8.515 659 HA VAL 89 HA VAL 89 118.004 8.826 -7.197 660 HB VAL 89 HB VAL 89 119.129 10.683 -6.011 661 HG11 VAL 89 HG11 VAL 89 120.361 9.873 -7.845 662 HG12 VAL 89 HG12 VAL 89 120.288 11.610 -8.140 663 HG13 VAL 89 HG13 VAL 89 119.215 10.520 -9.019 664 HG21 VAL 89 HG21 VAL 89 117.440 12.354 -7.891 665 HG22 VAL 89 HG22 VAL 89 118.860 12.982 -7.053 666 HG23 VAL 89 HG23 VAL 89 117.468 12.419 -6.128 667 H PHE 90 H PHE 90 117.806 8.685 -4.968 668 HA PHE 90 HA PHE 90 115.263 9.661 -3.822 669 HB2 PHE 90 HB2 PHE 90 115.317 7.250 -4.091 670 HB3 PHE 90 HB3 PHE 90 116.881 7.162 -3.313 671 HD1 PHE 90 HD1 PHE 90 113.291 8.003 -2.724 672 HD2 PHE 90 HD2 PHE 90 117.053 6.877 -0.986 673 HE1 PHE 90 HE1 PHE 90 112.167 7.607 -0.543 674 HE2 PHE 90 HE2 PHE 90 115.931 6.473 1.188 675 HZ PHE 90 HZ PHE 90 113.485 6.840 1.408 676 H VAL 91 H VAL 91 115.446 10.997 -2.106 677 HA VAL 91 HA VAL 91 118.093 11.290 -0.819 678 HB VAL 91 HB VAL 91 115.747 13.210 -0.906 679 HG11 VAL 91 HG11 VAL 91 118.541 13.999 -0.143 680 HG12 VAL 91 HG12 VAL 91 117.518 13.249 1.077 681 HG13 VAL 91 HG13 VAL 91 117.004 14.739 0.295 682 HG21 VAL 91 HG21 VAL 91 116.855 12.889 -3.100 683 HG22 VAL 91 HG22 VAL 91 118.405 13.292 -2.363 684 HG23 VAL 91 HG23 VAL 91 117.130 14.508 -2.458 685 H ALA 92 H ALA 92 118.299 10.765 1.294 686 HA ALA 92 HA ALA 92 115.845 9.976 2.745 687 HB1 ALA 92 HB1 ALA 92 117.622 9.028 4.379 688 HB2 ALA 92 HB2 ALA 92 118.763 9.299 3.062 689 HB3 ALA 92 HB3 ALA 92 117.393 8.211 2.834 690 HA PRO 93 HA PRO 93 115.781 13.427 5.511 691 HB2 PRO 93 HB2 PRO 93 116.050 11.535 7.805 692 HB3 PRO 93 HB3 PRO 93 114.843 12.804 7.522 693 HG2 PRO 93 HG2 PRO 93 114.305 10.198 7.191 694 HG3 PRO 93 HG3 PRO 93 113.543 11.470 6.223 695 HD2 PRO 93 HD2 PRO 93 115.579 9.487 5.407 696 HD3 PRO 93 HD3 PRO 93 114.419 10.396 4.418 697 H ASP 94 H ASP 94 118.273 11.002 5.890 698 HA ASP 94 HA ASP 94 119.894 12.366 7.767 699 HB2 ASP 94 HB2 ASP 94 121.698 10.847 6.920 700 HB3 ASP 94 HB3 ASP 94 120.229 10.031 7.437 701 H GLY 95 H GLY 95 119.273 13.147 4.501 702 HA2 GLY 95 HA2 GLY 95 120.097 15.048 3.377 703 HA3 GLY 95 HA3 GLY 95 121.442 15.110 4.511 704 H THR 96 H THR 96 120.971 11.972 3.307 705 HA THR 96 HA THR 96 123.308 12.228 1.546 706 HB THR 96 HB THR 96 121.953 9.773 2.695 707 HG1 THR 96 HG1 THR 96 123.390 9.939 4.246 708 HG21 THR 96 HG21 THR 96 124.309 10.217 0.906 709 HG22 THR 96 HG22 THR 96 123.120 8.913 0.901 710 HG23 THR 96 HG23 THR 96 124.408 8.928 2.107 711 H THR 97 H THR 97 123.156 11.781 -0.615 712 HA THR 97 HA THR 97 120.456 11.205 -1.660 713 HB THR 97 HB THR 97 122.914 12.181 -3.147 714 HG1 THR 97 HG1 THR 97 120.791 13.504 -1.952 715 HG21 THR 97 HG21 THR 97 119.988 12.199 -3.932 716 HG22 THR 97 HG22 THR 97 121.142 10.977 -4.465 717 HG23 THR 97 HG23 THR 97 121.360 12.662 -4.939 718 H TYR 98 H TYR 98 120.011 9.341 -2.566 719 HA TYR 98 HA TYR 98 122.190 7.439 -3.169 720 HB2 TYR 98 HB2 TYR 98 119.331 6.904 -2.353 721 HB3 TYR 98 HB3 TYR 98 120.514 5.674 -2.747 722 HD1 TYR 98 HD2 TYR 98 122.402 5.217 -1.188 723 HD2 TYR 98 HD1 TYR 98 119.292 8.018 -0.224 724 HE1 TYR 98 HE2 TYR 98 123.078 5.153 1.198 725 HE2 TYR 98 HE1 TYR 98 119.980 7.968 2.154 726 HH TYR 98 HH TYR 98 121.570 7.224 3.586 727 H ALA 99 H ALA 99 122.007 6.273 -5.131 728 HA ALA 99 HA ALA 99 120.455 7.644 -7.177 729 HB1 ALA 99 HB1 ALA 99 121.701 5.880 -8.642 730 HB2 ALA 99 HB2 ALA 99 122.662 5.607 -7.189 731 HB3 ALA 99 HB3 ALA 99 122.621 7.206 -7.931 732 H LEU 100 H LEU 100 118.554 6.962 -7.921 733 HA LEU 100 HA LEU 100 117.438 4.446 -6.993 734 HB2 LEU 100 HB2 LEU 100 116.374 6.745 -8.625 735 HB3 LEU 100 HB3 LEU 100 115.479 5.240 -8.463 736 HG LEU 100 HG LEU 100 116.513 6.642 -6.011 737 HD11 LEU 100 HD11 LEU 100 115.221 8.284 -7.408 738 HD12 LEU 100 HD12 LEU 100 114.432 7.906 -5.875 739 HD13 LEU 100 HD13 LEU 100 113.856 7.172 -7.372 740 HD21 LEU 100 HD21 LEU 100 115.553 4.295 -5.986 741 HD22 LEU 100 HD22 LEU 100 114.021 4.987 -6.521 742 HD23 LEU 100 HD23 LEU 100 114.695 5.441 -4.957 743 H ASN 101 H ASN 101 118.270 5.979 -10.085 744 HA ASN 101 HA ASN 101 118.037 3.320 -11.389 745 HB2 ASN 101 HB2 ASN 101 117.487 4.435 -13.433 746 HB3 ASN 101 HB3 ASN 101 116.436 5.045 -12.164 747 HD21 ASN 101 HD21 ASN 101 116.429 6.787 -14.112 748 HD22 ASN 101 HD22 ASN 101 117.509 8.078 -13.887 749 H ASP 102 H ASP 102 119.386 3.134 -13.415 750 HA ASP 102 HA ASP 102 122.013 2.846 -12.577 751 HB2 ASP 102 HB2 ASP 102 120.937 1.628 -14.464 752 HB3 ASP 102 HB3 ASP 102 121.086 3.087 -15.442 753 H ARG 103 H ARG 103 120.581 5.515 -14.446 754 HA ARG 103 HA ARG 103 123.044 6.684 -15.199 755 HB2 ARG 103 HB2 ARG 103 120.271 7.856 -14.947 756 HB3 ARG 103 HB3 ARG 103 121.648 8.728 -15.629 757 HG2 ARG 103 HG2 ARG 103 121.976 6.864 -17.257 758 HG3 ARG 103 HG3 ARG 103 120.519 6.097 -16.629 759 HD2 ARG 103 HD2 ARG 103 120.667 8.835 -17.921 760 HD3 ARG 103 HD3 ARG 103 120.009 7.378 -18.660 761 HE ARG 103 HE ARG 103 118.671 9.094 -16.812 762 HH11 ARG 103 HH11 ARG 103 118.933 5.709 -17.710 763 HH12 ARG 103 HH12 ARG 103 117.338 5.340 -17.145 764 HH21 ARG 103 HH21 ARG 103 116.657 8.573 -16.117 765 HH22 ARG 103 HH22 ARG 103 116.053 6.952 -16.247 766 H ALA 104 H ALA 104 120.911 7.292 -12.412 767 HA ALA 104 HA ALA 104 122.362 9.371 -11.243 768 HB1 ALA 104 HB1 ALA 104 120.732 7.149 -10.006 769 HB2 ALA 104 HB2 ALA 104 120.223 8.804 -10.341 770 HB3 ALA 104 HB3 ALA 104 121.405 8.484 -9.072 771 H GLU 105 H GLU 105 122.836 5.855 -11.014 772 HA GLU 105 HA GLU 105 124.978 5.910 -9.177 773 HB2 GLU 105 HB2 GLU 105 124.409 3.941 -11.407 774 HB3 GLU 105 HB3 GLU 105 125.567 3.685 -10.103 775 HG2 GLU 105 HG2 GLU 105 123.732 3.970 -8.450 776 HG3 GLU 105 HG3 GLU 105 122.588 4.132 -9.777 777 H LYS 106 H LYS 106 124.928 6.127 -12.719 778 HA LYS 106 HA LYS 106 127.684 6.192 -13.193 779 HB2 LYS 106 HB2 LYS 106 125.926 6.054 -14.951 780 HB3 LYS 106 HB3 LYS 106 125.556 7.755 -14.671 781 HG2 LYS 106 HG2 LYS 106 127.827 8.393 -15.295 782 HG3 LYS 106 HG3 LYS 106 128.279 6.698 -15.481 783 HD2 LYS 106 HD2 LYS 106 127.810 7.571 -17.682 784 HD3 LYS 106 HD3 LYS 106 126.489 6.492 -17.240 785 HE2 LYS 106 HE2 LYS 106 126.223 9.395 -16.553 786 HE3 LYS 106 HE3 LYS 106 126.004 8.910 -18.233 787 HZ1 LYS 106 HZ1 LYS 106 124.617 7.060 -16.745 788 HZ2 LYS 106 HZ2 LYS 106 123.960 8.316 -17.681 789 HZ3 LYS 106 HZ3 LYS 106 124.257 8.554 -16.025 790 H ALA 107 H ALA 107 125.508 8.720 -12.089 791 HA ALA 107 HA ALA 107 127.411 10.859 -12.339 792 HB1 ALA 107 HB1 ALA 107 125.100 11.429 -12.471 793 HB2 ALA 107 HB2 ALA 107 125.712 12.115 -10.966 794 HB3 ALA 107 HB3 ALA 107 124.751 10.636 -10.935 795 H GLY 108 H GLY 108 127.711 8.332 -10.374 796 HA2 GLY 108 HA2 GLY 108 129.045 7.998 -8.559 797 HA3 GLY 108 HA3 GLY 108 129.380 9.717 -8.526 798 H HIS 109 H HIS 109 126.039 8.681 -8.355 799 HA HIS 109 HA HIS 109 125.933 9.388 -5.523 800 HB2 HIS 109 HB2 HIS 109 123.910 8.912 -7.675 801 HB3 HIS 109 HB3 HIS 109 123.425 8.850 -5.991 802 HD1 HIS 109 HD1 HIS 109 125.009 11.206 -4.845 803 HD2 HIS 109 HD2 HIS 109 122.978 11.376 -8.482 804 HE1 HIS 109 HE1 HIS 109 124.554 13.655 -5.298 805 HA PRO 110 HA PRO 110 126.482 4.878 -4.867 806 HB2 PRO 110 HB2 PRO 110 125.843 4.930 -2.130 807 HB3 PRO 110 HB3 PRO 110 127.466 5.079 -2.824 808 HG2 PRO 110 HG2 PRO 110 125.629 7.187 -1.850 809 HG3 PRO 110 HG3 PRO 110 127.399 7.096 -1.774 810 HD2 PRO 110 HD2 PRO 110 126.157 8.699 -3.551 811 HD3 PRO 110 HD3 PRO 110 127.676 7.866 -3.954 812 HA PRO 111 HA PRO 111 122.220 3.748 -5.153 813 HB2 PRO 111 HB2 PRO 111 122.275 1.066 -4.627 814 HB3 PRO 111 HB3 PRO 111 122.850 1.780 -6.145 815 HG2 PRO 111 HG2 PRO 111 124.388 0.756 -3.841 816 HG3 PRO 111 HG3 PRO 111 124.790 0.759 -5.564 817 HD2 PRO 111 HD2 PRO 111 125.824 2.537 -3.691 818 HD3 PRO 111 HD3 PRO 111 125.805 2.801 -5.446 819 H ILE 112 H ILE 112 120.324 3.058 -3.977 820 HA ILE 112 HA ILE 112 120.261 3.829 -1.281 821 HB ILE 112 HB ILE 112 118.263 2.121 -2.789 822 HG12 ILE 112 HG12 ILE 112 118.273 5.102 -2.271 823 HG13 ILE 112 HG13 ILE 112 118.857 4.384 -3.772 824 HG21 ILE 112 HG21 ILE 112 116.664 3.144 -1.089 825 HG22 ILE 112 HG22 ILE 112 118.083 3.703 -0.207 826 HG23 ILE 112 HG23 ILE 112 117.800 1.976 -0.419 827 HD11 ILE 112 HD11 ILE 112 116.669 3.471 -4.255 828 HD12 ILE 112 HD12 ILE 112 116.464 5.177 -3.855 829 HD13 ILE 112 HD13 ILE 112 116.066 3.943 -2.662 830 H THR 113 H THR 113 121.486 0.892 -2.513 831 HA THR 113 HA THR 113 120.386 -1.073 -1.032 832 HB THR 113 HB THR 113 122.152 -1.298 -2.802 833 HG1 THR 113 HG1 THR 113 122.338 -3.266 -2.103 834 HG21 THR 113 HG21 THR 113 124.002 -0.042 -1.944 835 HG22 THR 113 HG22 THR 113 124.463 -1.739 -1.874 836 HG23 THR 113 HG23 THR 113 123.965 -0.905 -0.406 837 HA PRO 114 HA PRO 114 123.460 -0.514 2.659 838 HB2 PRO 114 HB2 PRO 114 123.244 2.401 3.169 839 HB3 PRO 114 HB3 PRO 114 124.660 1.337 3.268 840 HG2 PRO 114 HG2 PRO 114 124.392 3.081 1.289 841 HG3 PRO 114 HG3 PRO 114 125.091 1.473 1.012 842 HD2 PRO 114 HD2 PRO 114 122.320 2.449 0.390 843 HD3 PRO 114 HD3 PRO 114 123.388 1.427 -0.589 844 H ILE 115 H ILE 115 120.602 1.468 2.131 845 HA ILE 115 HA ILE 115 119.739 1.054 4.906 846 HB ILE 115 HB ILE 115 117.875 2.650 4.271 847 HG12 ILE 115 HG12 ILE 115 119.722 3.284 1.952 848 HG13 ILE 115 HG13 ILE 115 118.211 2.396 1.782 849 HG21 ILE 115 HG21 ILE 115 120.201 3.086 5.439 850 HG22 ILE 115 HG22 ILE 115 119.156 4.427 4.980 851 HG23 ILE 115 HG23 ILE 115 120.530 3.993 3.961 852 HD11 ILE 115 HD11 ILE 115 118.416 5.109 1.548 853 HD12 ILE 115 HD12 ILE 115 117.981 4.968 3.250 854 HD13 ILE 115 HD13 ILE 115 116.937 4.271 2.013 855 H ARG 116 H ARG 116 119.464 -0.879 2.353 856 HA ARG 116 HA ARG 116 116.632 -1.118 2.030 857 HB2 ARG 116 HB2 ARG 116 117.113 -3.078 0.713 858 HB3 ARG 116 HB3 ARG 116 118.318 -1.856 0.329 859 HG2 ARG 116 HG2 ARG 116 119.822 -3.011 2.060 860 HG3 ARG 116 HG3 ARG 116 118.652 -4.324 2.043 861 HD2 ARG 116 HD2 ARG 116 118.925 -4.497 -0.430 862 HD3 ARG 116 HD3 ARG 116 120.189 -3.275 -0.346 863 HE ARG 116 HE ARG 116 120.475 -6.040 0.251 864 HH11 ARG 116 HH11 ARG 116 121.614 -2.895 1.312 865 HH12 ARG 116 HH12 ARG 116 123.079 -3.541 1.973 866 HH21 ARG 116 HH21 ARG 116 122.377 -6.811 1.114 867 HH22 ARG 116 HH22 ARG 116 123.506 -5.729 1.860 868 H ALA 117 H ALA 117 115.227 -2.727 2.803 869 HA ALA 117 HA ALA 117 115.953 -3.681 5.473 870 HB1 ALA 117 HB1 ALA 117 113.246 -3.805 4.150 871 HB2 ALA 117 HB2 ALA 117 113.833 -2.357 4.973 872 HB3 ALA 117 HB3 ALA 117 113.616 -3.859 5.875 873 H LYS 118 H LYS 118 115.944 -5.787 6.090 874 HA LYS 118 HA LYS 118 115.718 -7.824 3.984 875 HB2 LYS 118 HB2 LYS 118 116.674 -8.055 6.851 876 HB3 LYS 118 HB3 LYS 118 116.747 -9.327 5.632 877 HG2 LYS 118 HG2 LYS 118 118.129 -7.752 4.214 878 HG3 LYS 118 HG3 LYS 118 118.217 -6.682 5.611 879 HD2 LYS 118 HD2 LYS 118 119.120 -9.577 5.605 880 HD3 LYS 118 HD3 LYS 118 120.196 -8.189 5.439 881 HE2 LYS 118 HE2 LYS 118 119.055 -7.374 7.653 882 HE3 LYS 118 HE3 LYS 118 118.609 -9.071 7.834 883 HZ1 LYS 118 HZ1 LYS 118 120.776 -9.721 8.028 884 HZ2 LYS 118 HZ2 LYS 118 120.862 -8.190 8.759 885 HZ3 LYS 118 HZ3 LYS 118 121.383 -8.398 7.155 886 H GLY 119 H GLY 119 114.157 -9.414 4.015 887 HA2 GLY 119 HA2 GLY 119 111.963 -9.015 5.950 888 HA3 GLY 119 HA3 GLY 119 111.804 -9.752 4.369 889 H SER 120 H SER 120 110.939 -10.861 6.904 890 HA SER 120 HA SER 120 112.639 -12.869 7.879 891 HB2 SER 120 HB2 SER 120 110.638 -13.921 8.747 892 HB3 SER 120 HB3 SER 120 110.479 -12.176 8.916 893 HG SER 120 HG SER 120 109.203 -13.903 7.197 894 H GLY 121 H GLY 121 110.518 -12.816 5.051 895 HA2 GLY 121 HA2 GLY 121 111.868 -15.260 4.099 896 HA3 GLY 121 HA3 GLY 121 110.113 -15.137 4.007 897 H GLY 122 H GLY 122 111.832 -15.476 1.762 898 HA2 GLY 122 HA2 GLY 122 111.802 -14.700 -0.422 899 HA3 GLY 122 HA3 GLY 122 110.897 -13.295 0.125 900 H GLY 123 H GLY 123 113.925 -14.091 1.685 901 HA2 GLY 123 HA2 GLY 123 116.000 -13.104 1.650 902 HA3 GLY 123 HA3 GLY 123 115.693 -12.719 -0.039 903 H TYR 124 H TYR 124 115.766 -10.633 -0.489 904 HA TYR 124 HA TYR 124 115.349 -8.683 1.686 905 HB2 TYR 124 HB2 TYR 124 116.944 -8.650 -0.858 906 HB3 TYR 124 HB3 TYR 124 116.526 -7.159 -0.033 907 HD1 TYR 124 HD1 TYR 124 117.582 -10.526 1.242 908 HD2 TYR 124 HD2 TYR 124 118.441 -6.326 0.995 909 HE1 TYR 124 HE1 TYR 124 119.552 -10.842 2.714 910 HE2 TYR 124 HE2 TYR 124 120.403 -6.638 2.477 911 HH TYR 124 HH TYR 124 121.665 -9.645 3.210 912 H ILE 125 H ILE 125 114.246 -6.680 1.188 913 HA ILE 125 HA ILE 125 111.887 -7.225 -0.425 914 HB ILE 125 HB ILE 125 112.570 -4.862 1.347 915 HG12 ILE 125 HG12 ILE 125 110.706 -7.181 1.912 916 HG13 ILE 125 HG13 ILE 125 112.387 -7.178 2.434 917 HG21 ILE 125 HG21 ILE 125 109.845 -5.758 0.387 918 HG22 ILE 125 HG22 ILE 125 110.786 -4.543 -0.477 919 HG23 ILE 125 HG23 ILE 125 110.274 -4.244 1.180 920 HD11 ILE 125 HD11 ILE 125 110.720 -4.786 3.100 921 HD12 ILE 125 HD12 ILE 125 112.048 -5.522 3.997 922 HD13 ILE 125 HD13 ILE 125 110.454 -6.270 4.014 923 H SER 126 H SER 126 111.398 -6.334 -2.327 924 HA SER 126 HA SER 126 113.472 -5.159 -3.891 925 HB2 SER 126 HB2 SER 126 110.522 -5.457 -4.477 926 HB3 SER 126 HB3 SER 126 111.770 -5.057 -5.652 927 HG SER 126 HG SER 126 111.311 -7.288 -5.538 928 H LEU 127 H LEU 127 113.848 -3.134 -4.518 929 HA LEU 127 HA LEU 127 112.253 -0.959 -3.387 930 HB2 LEU 127 HB2 LEU 127 114.736 -0.824 -5.110 931 HB3 LEU 127 HB3 LEU 127 114.004 0.507 -4.219 932 HG LEU 127 HG LEU 127 115.154 -2.008 -2.970 933 HD11 LEU 127 HD11 LEU 127 117.001 -0.732 -3.722 934 HD12 LEU 127 HD12 LEU 127 116.794 -0.237 -2.042 935 HD13 LEU 127 HD13 LEU 127 116.206 0.796 -3.345 936 HD21 LEU 127 HD21 LEU 127 113.972 0.526 -1.791 937 HD22 LEU 127 HD22 LEU 127 114.886 -0.659 -0.856 938 HD23 LEU 127 HD23 LEU 127 113.359 -1.118 -1.610 939 H GLY 128 H GLY 128 111.741 -2.834 -5.999 940 HA2 GLY 128 HA2 GLY 128 111.750 -1.309 -8.283 941 HA3 GLY 128 HA3 GLY 128 110.549 -2.550 -7.954 942 H ALA 129 H ALA 129 109.189 -1.336 -5.794 943 HA ALA 129 HA ALA 129 107.315 0.206 -7.213 944 HB1 ALA 129 HB1 ALA 129 107.708 0.235 -4.215 945 HB2 ALA 129 HB2 ALA 129 106.904 -1.076 -5.077 946 HB3 ALA 129 HB3 ALA 129 106.219 0.548 -5.106 947 H LEU 130 H LEU 130 109.857 1.202 -4.932 948 HA LEU 130 HA LEU 130 109.245 3.947 -4.893 949 HB2 LEU 130 HB2 LEU 130 110.776 2.808 -3.301 950 HB3 LEU 130 HB3 LEU 130 111.958 2.634 -4.597 951 HG LEU 130 HG LEU 130 111.897 5.144 -4.873 952 HD11 LEU 130 HD11 LEU 130 109.794 5.699 -3.870 953 HD12 LEU 130 HD12 LEU 130 111.032 6.359 -2.802 954 HD13 LEU 130 HD13 LEU 130 110.209 4.859 -2.376 955 HD21 LEU 130 HD21 LEU 130 112.653 4.479 -2.039 956 HD22 LEU 130 HD22 LEU 130 113.522 5.458 -3.219 957 HD23 LEU 130 HD23 LEU 130 113.509 3.702 -3.371 958 H LEU 131 H LEU 131 111.376 2.058 -7.010 959 HA LEU 131 HA LEU 131 112.483 4.216 -8.435 960 HB2 LEU 131 HB2 LEU 131 113.350 1.896 -8.539 961 HB3 LEU 131 HB3 LEU 131 111.911 1.412 -9.433 962 HG LEU 131 HG LEU 131 112.509 3.138 -11.173 963 HD11 LEU 131 HD11 LEU 131 114.980 3.803 -11.114 964 HD12 LEU 131 HD12 LEU 131 114.966 3.310 -9.421 965 HD13 LEU 131 HD13 LEU 131 113.927 4.627 -9.965 966 HD21 LEU 131 HD21 LEU 131 113.072 0.955 -11.814 967 HD22 LEU 131 HD22 LEU 131 114.258 0.779 -10.520 968 HD23 LEU 131 HD23 LEU 131 114.626 1.783 -11.924 969 H SER 132 H SER 132 109.522 2.340 -8.985 970 HA SER 132 HA SER 132 108.895 3.386 -11.512 971 HB2 SER 132 HB2 SER 132 106.954 2.490 -9.367 972 HB3 SER 132 HB3 SER 132 106.625 2.611 -11.092 973 HG SER 132 HG SER 132 107.746 0.634 -9.771 974 H THR 133 H THR 133 108.042 4.535 -8.256 975 HA THR 133 HA THR 133 106.281 6.578 -9.086 976 HB THR 133 HB THR 133 108.051 6.575 -6.628 977 HG1 THR 133 HG1 THR 133 106.881 4.808 -6.445 978 HG21 THR 133 HG21 THR 133 106.895 8.720 -7.198 979 HG22 THR 133 HG22 THR 133 106.332 8.012 -5.684 980 HG23 THR 133 HG23 THR 133 105.355 7.860 -7.144 981 H THR 134 H THR 134 109.772 6.657 -8.379 982 HA THR 134 HA THR 134 110.063 9.438 -8.806 983 HB THR 134 HB THR 134 112.220 7.364 -9.220 984 HG1 THR 134 HG1 THR 134 111.256 7.056 -7.244 985 HG21 THR 134 HG21 THR 134 112.616 9.794 -9.836 986 HG22 THR 134 HG22 THR 134 113.702 9.156 -8.602 987 HG23 THR 134 HG23 THR 134 112.352 10.191 -8.138 988 H LEU 135 H LEU 135 110.350 6.673 -11.017 989 HA LEU 135 HA LEU 135 111.351 8.082 -13.235 990 HB2 LEU 135 HB2 LEU 135 109.625 5.604 -13.085 991 HB3 LEU 135 HB3 LEU 135 110.345 6.209 -14.577 992 HG LEU 135 HG LEU 135 111.963 5.573 -12.097 993 HD11 LEU 135 HD11 LEU 135 111.205 3.874 -14.478 994 HD12 LEU 135 HD12 LEU 135 111.071 3.472 -12.766 995 HD13 LEU 135 HD13 LEU 135 112.658 3.551 -13.533 996 HD21 LEU 135 HD21 LEU 135 113.754 5.430 -13.965 997 HD22 LEU 135 HD22 LEU 135 113.192 7.035 -13.495 998 HD23 LEU 135 HD23 LEU 135 112.578 6.282 -14.966 999 H ASN 136 H ASN 136 108.027 7.555 -12.110 1000 HA ASN 136 HA ASN 136 106.669 8.604 -14.325 1001 HB2 ASN 136 HB2 ASN 136 105.661 7.436 -12.309 1002 HB3 ASN 136 HB3 ASN 136 105.820 8.966 -11.448 1003 HD21 ASN 136 HD21 ASN 136 103.947 10.200 -11.533 1004 HD22 ASN 136 HD22 ASN 136 102.830 10.190 -12.811 1005 H LEU 137 H LEU 137 107.950 10.214 -11.434 1006 HA LEU 137 HA LEU 137 107.170 12.841 -12.115 1007 HB2 LEU 137 HB2 LEU 137 109.600 11.949 -10.542 1008 HB3 LEU 137 HB3 LEU 137 108.907 13.570 -10.539 1009 HG LEU 137 HG LEU 137 107.429 11.064 -9.681 1010 HD11 LEU 137 HD11 LEU 137 108.978 11.399 -7.960 1011 HD12 LEU 137 HD12 LEU 137 107.617 12.379 -7.413 1012 HD13 LEU 137 HD13 LEU 137 109.003 13.148 -8.189 1013 HD21 LEU 137 HD21 LEU 137 105.870 12.716 -10.471 1014 HD22 LEU 137 HD22 LEU 137 106.747 14.017 -9.666 1015 HD23 LEU 137 HD23 LEU 137 105.864 12.826 -8.713 1016 H CYS 138 H CYS 138 110.087 10.996 -12.905 1017 HA CYS 138 HA CYS 138 111.533 13.018 -14.192 1018 HB2 CYS 138 HB2 CYS 138 111.487 10.035 -14.365 1019 HB3 CYS 138 HB3 CYS 138 112.406 10.935 -15.567 1020 H GLY 139 H GLY 139 108.731 11.237 -15.306 1021 HA2 GLY 139 HA2 GLY 139 107.377 11.768 -17.129 1022 HA3 GLY 139 HA3 GLY 139 108.599 12.903 -17.678 1023 H LYS 140 H LYS 140 109.589 9.637 -16.942 1024 HA LYS 140 HA LYS 140 110.339 9.231 -19.718 1025 HB2 LYS 140 HB2 LYS 140 111.836 8.602 -17.817 1026 HB3 LYS 140 HB3 LYS 140 110.668 7.363 -17.360 1027 HG2 LYS 140 HG2 LYS 140 110.892 6.354 -19.624 1028 HG3 LYS 140 HG3 LYS 140 112.129 7.551 -20.011 1029 HD2 LYS 140 HD2 LYS 140 113.454 6.735 -18.044 1030 HD3 LYS 140 HD3 LYS 140 112.262 5.452 -17.829 1031 HE2 LYS 140 HE2 LYS 140 114.215 4.668 -19.137 1032 HE3 LYS 140 HE3 LYS 140 112.730 4.609 -20.087 1033 HZ1 LYS 140 HZ1 LYS 140 114.967 5.758 -20.938 1034 HZ2 LYS 140 HZ2 LYS 140 114.220 7.098 -20.207 1035 HZ3 LYS 140 HZ3 LYS 140 113.423 6.246 -21.442 1036 H GLY 141 H GLY 141 109.338 7.945 -21.159 1037 HA2 GLY 141 HA2 GLY 141 107.707 6.629 -22.107 1038 HA3 GLY 141 HA3 GLY 141 107.787 5.684 -20.623 Start of MODEL 13 1 H1 HIS -5 HT1 HIS -5 68.133 62.526 -1.732 2 H2 HIS -5 HT2 HIS -5 68.252 60.836 -1.605 3 H3 HIS -5 HT3 HIS -5 66.808 61.622 -1.176 4 HA HIS -5 HA HIS -5 66.454 60.645 -3.290 5 HB2 HIS -5 HB2 HIS -5 67.043 63.604 -3.514 6 HB3 HIS -5 HB3 HIS -5 66.113 62.684 -4.681 7 HD1 HIS -5 HD1 HIS -5 65.931 64.219 -1.279 8 HD2 HIS -5 HD2 HIS -5 63.477 61.983 -3.801 9 HE1 HIS -5 HE1 HIS -5 63.601 64.335 -0.297 10 H HIS -4 H HIS -4 67.647 59.422 -4.602 11 HA HIS -4 HA HIS -4 70.123 60.563 -5.772 12 HB2 HIS -4 HB2 HIS -4 69.516 57.705 -5.005 13 HB3 HIS -4 HB3 HIS -4 70.941 58.221 -5.886 14 HD1 HIS -4 HD1 HIS -4 69.407 58.170 -2.480 15 HD2 HIS -4 HD2 HIS -4 72.888 59.588 -4.284 16 HE1 HIS -4 HE1 HIS -4 70.988 58.786 -0.601 17 H HIS -3 H HIS -3 70.456 60.290 -7.941 18 HA HIS -3 HA HIS -3 68.211 59.121 -9.484 19 HB2 HIS -3 HB2 HIS -3 70.124 61.343 -10.206 20 HB3 HIS -3 HB3 HIS -3 68.936 60.656 -11.296 21 HD1 HIS -3 HD1 HIS -3 69.310 62.942 -8.364 22 HD2 HIS -3 HD2 HIS -3 66.234 61.433 -10.739 23 HE1 HIS -3 HE1 HIS -3 67.253 64.315 -7.827 24 H HIS -2 H HIS -2 68.641 57.617 -11.012 25 HA HIS -2 HA HIS -2 71.478 56.855 -11.428 26 HB2 HIS -2 HB2 HIS -2 69.040 55.074 -11.330 27 HB3 HIS -2 HB3 HIS -2 70.669 54.545 -11.700 28 HD1 HIS -2 HD1 HIS -2 72.459 55.077 -9.648 29 HD2 HIS -2 HD2 HIS -2 68.413 54.896 -8.661 30 HE1 HIS -2 HE1 HIS -2 72.349 54.726 -7.144 31 H HIS -1 H HIS -1 72.144 56.464 -13.485 32 HA HIS -1 HA HIS -1 70.149 56.820 -15.652 33 HB2 HIS -1 HB2 HIS -1 73.046 57.679 -15.590 34 HB3 HIS -1 HB3 HIS -1 71.975 57.820 -16.971 35 HD1 HIS -1 HD1 HIS -1 69.736 59.368 -16.435 36 HD2 HIS -1 HD2 HIS -1 73.073 59.916 -13.997 37 HE1 HIS -1 HE1 HIS -1 69.437 61.615 -15.308 38 H HIS 0 H HIS 0 70.225 55.423 -17.356 39 HA HIS 0 HA HIS 0 72.256 53.264 -17.251 40 HB2 HIS 0 HB2 HIS 0 70.021 52.504 -16.518 41 HB3 HIS 0 HB3 HIS 0 69.351 53.042 -18.046 42 HD1 HIS 0 HD1 HIS 0 72.123 50.683 -16.879 43 HD2 HIS 0 HD2 HIS 0 69.241 50.991 -19.877 44 HE1 HIS 0 HE1 HIS 0 72.280 48.557 -18.243 45 H SER 1 H SER 1 73.327 52.866 -19.090 46 HA SER 1 HA SER 1 72.362 54.140 -21.587 47 HB2 SER 1 HB2 SER 1 74.379 55.249 -20.641 48 HB3 SER 1 HB3 SER 1 75.232 53.711 -20.729 49 HG SER 1 HG SER 1 75.361 53.982 -22.810 50 H SER 2 H SER 2 72.467 52.952 -23.453 51 HA SER 2 HA SER 2 72.382 50.134 -23.255 52 HB2 SER 2 HB2 SER 2 72.793 51.852 -25.715 53 HB3 SER 2 HB3 SER 2 72.304 50.161 -25.707 54 HG SER 2 HG SER 2 70.401 51.025 -25.546 55 H GLY 3 H GLY 3 73.808 48.571 -24.212 56 HA2 GLY 3 HA2 GLY 3 76.441 49.265 -25.091 57 HA3 GLY 3 HA3 GLY 3 76.448 48.687 -23.427 58 H LEU 4 H LEU 4 77.871 47.085 -24.773 59 HA LEU 4 HA LEU 4 76.215 44.965 -25.972 60 HB2 LEU 4 HB2 LEU 4 78.204 45.806 -27.226 61 HB3 LEU 4 HB3 LEU 4 79.230 45.230 -25.913 62 HG LEU 4 HG LEU 4 78.187 42.937 -26.255 63 HD11 LEU 4 HD11 LEU 4 76.196 43.455 -27.458 64 HD12 LEU 4 HD12 LEU 4 77.250 42.656 -28.625 65 HD13 LEU 4 HD13 LEU 4 77.077 44.411 -28.650 66 HD21 LEU 4 HD21 LEU 4 80.385 43.196 -27.088 67 HD22 LEU 4 HD22 LEU 4 79.868 44.320 -28.344 68 HD23 LEU 4 HD23 LEU 4 79.478 42.605 -28.481 69 H VAL 5 H VAL 5 75.790 43.143 -24.903 70 HA VAL 5 HA VAL 5 77.548 42.323 -22.686 71 HB VAL 5 HB VAL 5 75.565 41.797 -21.303 72 HG11 VAL 5 HG11 VAL 5 76.745 43.942 -21.007 73 HG12 VAL 5 HG12 VAL 5 75.016 44.134 -20.715 74 HG13 VAL 5 HG13 VAL 5 75.720 44.679 -22.238 75 HG21 VAL 5 HG21 VAL 5 74.014 43.376 -23.378 76 HG22 VAL 5 HG22 VAL 5 73.367 42.580 -21.943 77 HG23 VAL 5 HG23 VAL 5 73.995 41.615 -23.279 78 HA PRO 6 HA PRO 6 77.151 38.247 -24.313 79 HB2 PRO 6 HB2 PRO 6 76.284 37.139 -21.698 80 HB3 PRO 6 HB3 PRO 6 77.704 36.738 -22.682 81 HG2 PRO 6 HG2 PRO 6 77.910 38.127 -20.418 82 HG3 PRO 6 HG3 PRO 6 78.960 38.440 -21.812 83 HD2 PRO 6 HD2 PRO 6 76.606 40.018 -20.843 84 HD3 PRO 6 HD3 PRO 6 78.126 40.589 -21.568 85 H ARG 7 H ARG 7 75.623 36.554 -24.884 86 HA ARG 7 HA ARG 7 73.000 37.500 -25.309 87 HB2 ARG 7 HB2 ARG 7 72.529 35.213 -26.115 88 HB3 ARG 7 HB3 ARG 7 74.038 35.841 -26.776 89 HG2 ARG 7 HG2 ARG 7 75.275 34.640 -24.959 90 HG3 ARG 7 HG3 ARG 7 73.748 33.919 -24.450 91 HD2 ARG 7 HD2 ARG 7 75.035 33.617 -27.177 92 HD3 ARG 7 HD3 ARG 7 74.959 32.380 -25.926 93 HE ARG 7 HE ARG 7 72.339 33.210 -26.436 94 HH11 ARG 7 HH11 ARG 7 74.912 31.580 -28.183 95 HH12 ARG 7 HH12 ARG 7 73.807 30.704 -29.190 96 HH21 ARG 7 HH21 ARG 7 70.967 32.055 -27.761 97 HH22 ARG 7 HH22 ARG 7 71.602 30.970 -28.954 98 H GLY 8 H GLY 8 71.068 37.085 -24.307 99 HA2 GLY 8 HA2 GLY 8 70.553 35.143 -22.359 100 HA3 GLY 8 HA3 GLY 8 71.076 36.601 -21.520 101 H SER 9 H SER 9 68.727 36.147 -20.743 102 HA SER 9 HA SER 9 66.925 37.833 -22.376 103 HB2 SER 9 HB2 SER 9 65.049 36.402 -21.794 104 HB3 SER 9 HB3 SER 9 66.296 35.432 -22.570 105 HG SER 9 HG SER 9 65.491 35.493 -19.945 106 H GLY 10 H GLY 10 65.316 38.977 -21.152 107 HA2 GLY 10 HA2 GLY 10 66.316 39.817 -18.553 108 HA3 GLY 10 HA3 GLY 10 64.993 40.553 -19.455 109 H MET 11 H MET 11 64.391 40.376 -16.948 110 HA MET 11 HA MET 11 62.581 38.048 -16.742 111 HB2 MET 11 HB2 MET 11 64.288 39.196 -14.519 112 HB3 MET 11 HB3 MET 11 63.045 37.961 -14.312 113 HG2 MET 11 HG2 MET 11 64.281 36.537 -15.978 114 HG3 MET 11 HG3 MET 11 65.578 37.732 -15.958 115 HE1 MET 11 HE1 MET 11 63.226 36.287 -13.034 116 HE2 MET 11 HE2 MET 11 64.224 34.887 -12.648 117 HE3 MET 11 HE3 MET 11 63.585 35.083 -14.278 118 H LYS 12 H LYS 12 60.736 38.418 -15.348 119 HA LYS 12 HA LYS 12 60.117 41.259 -14.851 120 HB2 LYS 12 HB2 LYS 12 57.903 41.003 -15.783 121 HB3 LYS 12 HB3 LYS 12 59.087 40.527 -16.995 122 HG2 LYS 12 HG2 LYS 12 58.726 38.136 -16.338 123 HG3 LYS 12 HG3 LYS 12 57.446 38.669 -15.247 124 HD2 LYS 12 HD2 LYS 12 56.367 39.795 -17.264 125 HD3 LYS 12 HD3 LYS 12 57.523 38.911 -18.262 126 HE2 LYS 12 HE2 LYS 12 55.813 37.477 -16.234 127 HE3 LYS 12 HE3 LYS 12 55.205 37.824 -17.852 128 HZ1 LYS 12 HZ1 LYS 12 56.947 36.586 -18.823 129 HZ2 LYS 12 HZ2 LYS 12 56.317 35.619 -17.575 130 HZ3 LYS 12 HZ3 LYS 12 57.782 36.450 -17.353 131 H GLU 13 H GLU 13 58.960 41.692 -13.029 132 HA GLU 13 HA GLU 13 58.323 39.378 -11.287 133 HB2 GLU 13 HB2 GLU 13 59.245 42.156 -10.516 134 HB3 GLU 13 HB3 GLU 13 58.811 40.872 -9.386 135 HG2 GLU 13 HG2 GLU 13 61.021 40.704 -11.454 136 HG3 GLU 13 HG3 GLU 13 61.263 41.001 -9.737 137 H THR 14 H THR 14 56.477 39.512 -9.981 138 HA THR 14 HA THR 14 54.534 41.629 -10.711 139 HB THR 14 HB THR 14 53.903 38.726 -10.125 140 HG1 THR 14 HG1 THR 14 54.692 38.720 -12.102 141 HG21 THR 14 HG21 THR 14 52.182 40.973 -11.210 142 HG22 THR 14 HG22 THR 14 52.147 40.403 -9.541 143 HG23 THR 14 HG23 THR 14 51.656 39.329 -10.851 144 H ALA 15 H ALA 15 53.341 42.499 -9.054 145 HA ALA 15 HA ALA 15 54.367 42.060 -6.378 146 HB1 ALA 15 HB1 ALA 15 52.440 44.000 -7.625 147 HB2 ALA 15 HB2 ALA 15 53.968 44.324 -6.806 148 HB3 ALA 15 HB3 ALA 15 52.549 43.850 -5.871 149 H ALA 16 H ALA 16 53.663 40.296 -5.342 150 HA ALA 16 HA ALA 16 50.795 40.016 -4.881 151 HB1 ALA 16 HB1 ALA 16 51.029 38.581 -6.790 152 HB2 ALA 16 HB2 ALA 16 50.935 37.542 -5.368 153 HB3 ALA 16 HB3 ALA 16 52.494 37.851 -6.133 154 H ALA 17 H ALA 17 50.312 38.638 -3.055 155 HA ALA 17 HA ALA 17 52.375 38.744 -1.027 156 HB1 ALA 17 HB1 ALA 17 49.558 37.635 -0.927 157 HB2 ALA 17 HB2 ALA 17 50.046 39.262 -0.451 158 HB3 ALA 17 HB3 ALA 17 50.618 37.868 0.464 159 H LYS 18 H LYS 18 53.950 37.258 -1.204 160 HA LYS 18 HA LYS 18 53.161 34.419 -1.314 161 HB2 LYS 18 HB2 LYS 18 53.922 35.317 -3.583 162 HB3 LYS 18 HB3 LYS 18 55.521 35.491 -2.859 163 HG2 LYS 18 HG2 LYS 18 55.252 33.022 -2.138 164 HG3 LYS 18 HG3 LYS 18 53.938 32.963 -3.313 165 HD2 LYS 18 HD2 LYS 18 56.719 33.939 -3.999 166 HD3 LYS 18 HD3 LYS 18 56.205 32.265 -4.213 167 HE2 LYS 18 HE2 LYS 18 54.218 33.253 -5.543 168 HE3 LYS 18 HE3 LYS 18 55.174 34.734 -5.605 169 HZ1 LYS 18 HZ1 LYS 18 55.447 33.080 -7.497 170 HZ2 LYS 18 HZ2 LYS 18 56.312 32.122 -6.391 171 HZ3 LYS 18 HZ3 LYS 18 56.865 33.680 -6.784 172 H PHE 19 H PHE 19 54.431 33.049 -0.112 173 HA PHE 19 HA PHE 19 56.676 34.270 1.394 174 HB2 PHE 19 HB2 PHE 19 56.090 32.850 3.269 175 HB3 PHE 19 HB3 PHE 19 54.721 33.848 2.821 176 HD1 PHE 19 HD1 PHE 19 52.770 32.840 1.646 177 HD2 PHE 19 HD2 PHE 19 56.032 30.457 3.106 178 HE1 PHE 19 HE1 PHE 19 51.370 30.803 1.448 179 HE2 PHE 19 HE2 PHE 19 54.633 28.420 2.908 180 HZ PHE 19 HZ PHE 19 52.302 28.592 2.079 181 H GLU 20 H GLU 20 58.412 32.832 1.945 182 HA GLU 20 HA GLU 20 58.519 30.310 0.446 183 HB2 GLU 20 HB2 GLU 20 60.708 30.905 -0.520 184 HB3 GLU 20 HB3 GLU 20 59.434 31.985 -1.084 185 HG2 GLU 20 HG2 GLU 20 60.092 33.615 0.692 186 HG3 GLU 20 HG3 GLU 20 61.430 32.560 1.124 187 H ARG 21 H ARG 21 60.578 29.105 0.953 188 HA ARG 21 HA ARG 21 61.779 29.758 3.533 189 HB2 ARG 21 HB2 ARG 21 61.285 27.523 4.457 190 HB3 ARG 21 HB3 ARG 21 59.811 28.443 4.158 191 HG2 ARG 21 HG2 ARG 21 59.583 27.270 1.958 192 HG3 ARG 21 HG3 ARG 21 60.974 26.273 2.390 193 HD2 ARG 21 HD2 ARG 21 58.368 26.450 3.929 194 HD3 ARG 21 HD3 ARG 21 58.890 25.097 2.929 195 HE ARG 21 HE ARG 21 60.919 25.463 4.760 196 HH11 ARG 21 HH11 ARG 21 57.481 24.792 4.992 197 HH12 ARG 21 HH12 ARG 21 57.647 23.936 6.488 198 HH21 ARG 21 HH21 ARG 21 61.071 24.351 6.686 199 HH22 ARG 21 HH22 ARG 21 59.656 23.689 7.434 200 H GLN 22 H GLN 22 63.587 28.241 4.049 201 HA GLN 22 HA GLN 22 65.194 27.874 1.686 202 HB2 GLN 22 HB2 GLN 22 65.777 27.114 4.558 203 HB3 GLN 22 HB3 GLN 22 66.951 27.204 3.248 204 HG2 GLN 22 HG2 GLN 22 65.321 29.520 4.331 205 HG3 GLN 22 HG3 GLN 22 67.034 29.238 4.628 206 HE21 GLN 22 HE21 GLN 22 65.213 31.278 2.918 207 HE22 GLN 22 HE22 GLN 22 66.138 31.438 1.504 208 H HIS 23 H HIS 23 65.836 25.998 0.729 209 HA HIS 23 HA HIS 23 64.786 23.454 1.811 210 HB2 HIS 23 HB2 HIS 23 64.697 24.368 -1.066 211 HB3 HIS 23 HB3 HIS 23 64.288 22.757 -0.509 212 HD1 HIS 23 HD1 HIS 23 62.187 22.692 1.246 213 HD2 HIS 23 HD2 HIS 23 62.578 26.132 -1.076 214 HE1 HIS 23 HE1 HIS 23 59.947 23.869 1.328 215 H MET 24 H MET 24 65.954 21.567 1.111 216 HA MET 24 HA MET 24 68.781 22.167 0.522 217 HB2 MET 24 HB2 MET 24 67.456 19.718 1.711 218 HB3 MET 24 HB3 MET 24 69.182 19.856 1.371 219 HG2 MET 24 HG2 MET 24 69.282 21.855 2.856 220 HG3 MET 24 HG3 MET 24 67.580 21.614 3.253 221 HE1 MET 24 HE1 MET 24 69.926 21.597 5.637 222 HE2 MET 24 HE2 MET 24 68.887 20.505 6.551 223 HE3 MET 24 HE3 MET 24 68.168 21.756 5.540 224 H ASP 25 H ASP 25 69.837 21.255 -1.197 225 HA ASP 25 HA ASP 25 68.139 20.190 -3.315 226 HB2 ASP 25 HB2 ASP 25 70.089 20.489 -4.750 227 HB3 ASP 25 HB3 ASP 25 69.778 21.959 -3.832 228 H SER 26 H SER 26 67.828 18.082 -3.531 229 HA SER 26 HA SER 26 70.069 16.241 -3.007 230 HB2 SER 26 HB2 SER 26 67.237 15.765 -2.050 231 HB3 SER 26 HB3 SER 26 68.618 14.697 -1.825 232 HG SER 26 HG SER 26 68.188 16.097 -0.050 233 HA PRO 27 HA PRO 27 68.528 14.446 -6.757 234 HB2 PRO 27 HB2 PRO 27 69.550 11.947 -6.698 235 HB3 PRO 27 HB3 PRO 27 70.589 13.379 -6.846 236 HG2 PRO 27 HG2 PRO 27 70.079 11.653 -4.497 237 HG3 PRO 27 HG3 PRO 27 71.552 12.511 -4.976 238 HD2 PRO 27 HD2 PRO 27 69.718 13.375 -3.033 239 HD3 PRO 27 HD3 PRO 27 70.974 14.373 -3.795 240 H ASP 28 H ASP 28 67.556 12.149 -7.549 241 HA ASP 28 HA ASP 28 65.057 11.877 -6.145 242 HB2 ASP 28 HB2 ASP 28 64.466 10.316 -7.924 243 HB3 ASP 28 HB3 ASP 28 65.184 11.771 -8.606 244 H LEU 29 H LEU 29 64.531 10.435 -4.632 245 HA LEU 29 HA LEU 29 66.498 8.348 -3.958 246 HB2 LEU 29 HB2 LEU 29 65.790 9.960 -2.188 247 HB3 LEU 29 HB3 LEU 29 64.143 9.345 -2.338 248 HG LEU 29 HG LEU 29 65.083 7.031 -1.871 249 HD11 LEU 29 HD11 LEU 29 67.400 7.301 -2.344 250 HD12 LEU 29 HD12 LEU 29 67.308 7.148 -0.591 251 HD13 LEU 29 HD13 LEU 29 67.519 8.736 -1.328 252 HD21 LEU 29 HD21 LEU 29 65.557 7.686 0.630 253 HD22 LEU 29 HD22 LEU 29 63.953 7.968 -0.048 254 HD23 LEU 29 HD23 LEU 29 65.097 9.303 0.100 255 H GLY 30 H GLY 30 66.075 6.255 -4.273 256 HA2 GLY 30 HA2 GLY 30 63.546 5.478 -5.479 257 HA3 GLY 30 HA3 GLY 30 64.964 4.455 -5.267 258 H THR 31 H THR 31 63.008 3.013 -4.651 259 HA THR 31 HA THR 31 61.819 3.406 -2.076 260 HB THR 31 HB THR 31 62.070 0.843 -3.668 261 HG1 THR 31 HG1 THR 31 60.914 2.060 -4.937 262 HG21 THR 31 HG21 THR 31 60.111 0.152 -2.393 263 HG22 THR 31 HG22 THR 31 60.049 1.719 -1.584 264 HG23 THR 31 HG23 THR 31 61.393 0.619 -1.276 265 H ASP 32 H ASP 32 62.461 2.707 -0.105 266 HA ASP 32 HA ASP 32 64.684 0.823 0.129 267 HB2 ASP 32 HB2 ASP 32 65.701 3.106 -0.040 268 HB3 ASP 32 HB3 ASP 32 64.811 3.558 1.413 269 H ASP 33 H ASP 33 64.965 0.023 2.301 270 HA ASP 33 HA ASP 33 62.527 -0.472 3.645 271 HB2 ASP 33 HB2 ASP 33 65.384 -0.840 4.575 272 HB3 ASP 33 HB3 ASP 33 63.968 -1.493 5.395 273 H ASP 34 H ASP 34 61.803 0.221 5.689 274 HA ASP 34 HA ASP 34 62.029 2.976 6.198 275 HB2 ASP 34 HB2 ASP 34 61.105 0.742 8.019 276 HB3 ASP 34 HB3 ASP 34 60.861 2.460 8.330 277 H ASP 35 H ASP 35 63.124 4.149 7.767 278 HA ASP 35 HA ASP 35 65.720 3.157 8.453 279 HB2 ASP 35 HB2 ASP 35 66.003 5.343 9.562 280 HB3 ASP 35 HB3 ASP 35 65.394 5.507 7.921 281 H LYS 36 H LYS 36 66.534 3.529 10.774 282 HA LYS 36 HA LYS 36 64.555 2.619 12.757 283 HB2 LYS 36 HB2 LYS 36 66.024 0.884 13.561 284 HB3 LYS 36 HB3 LYS 36 65.770 0.651 11.835 285 HG2 LYS 36 HG2 LYS 36 67.940 1.822 11.404 286 HG3 LYS 36 HG3 LYS 36 68.204 1.896 13.148 287 HD2 LYS 36 HD2 LYS 36 67.905 -0.636 13.171 288 HD3 LYS 36 HD3 LYS 36 68.009 -0.572 11.410 289 HE2 LYS 36 HE2 LYS 36 70.218 0.470 11.545 290 HE3 LYS 36 HE3 LYS 36 70.115 0.506 13.305 291 HZ1 LYS 36 HZ1 LYS 36 71.400 -1.393 12.392 292 HZ2 LYS 36 HZ2 LYS 36 69.966 -1.980 11.695 293 HZ3 LYS 36 HZ3 LYS 36 70.103 -1.855 13.384 294 H THR 37 H THR 37 65.569 2.656 15.019 295 HA THR 37 HA THR 37 66.496 5.315 15.509 296 HB THR 37 HB THR 37 66.403 2.970 17.423 297 HG1 THR 37 HG1 THR 37 64.486 4.792 16.594 298 HG21 THR 37 HG21 THR 37 66.010 4.950 19.032 299 HG22 THR 37 HG22 THR 37 66.629 5.963 17.728 300 HG23 THR 37 HG23 THR 37 67.650 4.707 18.432 301 H GLY 38 H GLY 38 68.507 6.049 16.055 302 HA2 GLY 38 HA2 GLY 38 70.747 4.428 15.217 303 HA3 GLY 38 HA3 GLY 38 70.812 6.098 15.772 304 H GLY 39 H GLY 39 72.811 4.884 16.755 305 HA2 GLY 39 HA2 GLY 39 72.093 4.215 19.534 306 HA3 GLY 39 HA3 GLY 39 73.157 3.137 18.637 307 H GLY 40 H GLY 40 75.044 3.412 19.727 308 HA2 GLY 40 HA2 GLY 40 75.990 6.038 20.501 309 HA3 GLY 40 HA3 GLY 40 76.828 4.508 20.744 310 H ARG 41 H ARG 41 78.595 6.133 20.038 311 HA ARG 41 HA ARG 41 78.834 7.029 17.397 312 HB2 ARG 41 HB2 ARG 41 80.996 6.188 19.342 313 HB3 ARG 41 HB3 ARG 41 81.272 7.098 17.855 314 HG2 ARG 41 HG2 ARG 41 79.730 8.869 18.691 315 HG3 ARG 41 HG3 ARG 41 79.574 7.981 20.208 316 HD2 ARG 41 HD2 ARG 41 82.080 8.111 20.448 317 HD3 ARG 41 HD3 ARG 41 82.102 9.182 19.049 318 HE ARG 41 HE ARG 41 80.306 10.013 21.168 319 HH11 ARG 41 HH11 ARG 41 83.577 10.260 19.919 320 HH12 ARG 41 HH12 ARG 41 83.887 11.751 20.745 321 HH21 ARG 41 HH21 ARG 41 80.763 11.932 22.207 322 HH22 ARG 41 HH22 ARG 41 82.312 12.684 22.024 323 H ALA 42 H ALA 42 79.881 6.190 15.583 324 HA ALA 42 HA ALA 42 79.445 3.490 14.987 325 HB1 ALA 42 HB1 ALA 42 81.504 5.258 13.656 326 HB2 ALA 42 HB2 ALA 42 79.773 5.379 13.339 327 HB3 ALA 42 HB3 ALA 42 80.639 3.893 12.949 328 H ASP 43 H ASP 43 80.897 1.747 14.686 329 HA ASP 43 HA ASP 43 82.672 1.266 16.784 330 HB2 ASP 43 HB2 ASP 43 82.680 -0.029 14.049 331 HB3 ASP 43 HB3 ASP 43 83.388 -0.695 15.520 332 HA PRO 44 HA PRO 44 86.446 3.268 15.766 333 HB2 PRO 44 HB2 PRO 44 88.001 0.761 16.101 334 HB3 PRO 44 HB3 PRO 44 88.126 2.296 16.978 335 HG2 PRO 44 HG2 PRO 44 87.079 0.116 18.097 336 HG3 PRO 44 HG3 PRO 44 86.474 1.743 18.460 337 HD2 PRO 44 HD2 PRO 44 85.261 -0.363 16.709 338 HD3 PRO 44 HD3 PRO 44 84.465 0.815 17.777 339 H ALA 45 H ALA 45 88.598 2.878 14.410 340 HA ALA 45 HA ALA 45 88.050 1.303 11.995 341 HB1 ALA 45 HB1 ALA 45 88.537 3.216 10.535 342 HB2 ALA 45 HB2 ALA 45 88.686 4.264 11.946 343 HB3 ALA 45 HB3 ALA 45 87.127 3.542 11.543 344 H HIS 46 H HIS 46 89.942 1.055 10.627 345 HA HIS 46 HA HIS 46 92.455 1.247 12.177 346 HB2 HIS 46 HB2 HIS 46 91.694 -0.602 9.913 347 HB3 HIS 46 HB3 HIS 46 93.251 -0.575 10.718 348 HD1 HIS 46 HD1 HIS 46 93.047 -1.049 13.448 349 HD2 HIS 46 HD2 HIS 46 89.923 -2.381 11.029 350 HE1 HIS 46 HE1 HIS 46 91.793 -2.788 14.793 351 H ARG 47 H ARG 47 94.244 2.189 11.289 352 HA ARG 47 HA ARG 47 93.870 4.157 9.289 353 HB2 ARG 47 HB2 ARG 47 95.586 4.264 11.104 354 HB3 ARG 47 HB3 ARG 47 96.490 3.001 10.266 355 HG2 ARG 47 HG2 ARG 47 96.696 4.421 8.283 356 HG3 ARG 47 HG3 ARG 47 95.729 5.677 9.058 357 HD2 ARG 47 HD2 ARG 47 98.043 6.291 9.325 358 HD3 ARG 47 HD3 ARG 47 97.452 5.757 10.895 359 HE ARG 47 HE ARG 47 98.825 3.875 10.742 360 HH11 ARG 47 HH11 ARG 47 98.873 5.602 7.687 361 HH12 ARG 47 HH12 ARG 47 100.213 4.688 7.077 362 HH21 ARG 47 HH21 ARG 47 100.546 2.731 9.904 363 HH22 ARG 47 HH22 ARG 47 101.147 3.083 8.317 364 H SER 48 H SER 48 94.398 4.215 7.148 365 HA SER 48 HA SER 48 95.396 1.711 5.916 366 HB2 SER 48 HB2 SER 48 93.809 1.903 4.154 367 HB3 SER 48 HB3 SER 48 92.895 2.137 5.639 368 HG SER 48 HG SER 48 92.500 4.064 4.952 369 HA PRO 49 HA PRO 49 98.452 4.027 3.736 370 HB2 PRO 49 HB2 PRO 49 97.212 3.266 1.127 371 HB3 PRO 49 HB3 PRO 49 98.890 3.088 1.672 372 HG2 PRO 49 HG2 PRO 49 97.248 1.004 1.540 373 HG3 PRO 49 HG3 PRO 49 98.458 1.157 2.826 374 HD2 PRO 49 HD2 PRO 49 95.506 1.518 2.980 375 HD3 PRO 49 HD3 PRO 49 96.643 0.962 4.226 376 H VAL 50 H VAL 50 98.539 6.202 3.432 377 HA VAL 50 HA VAL 50 96.068 7.579 2.723 378 HB VAL 50 HB VAL 50 98.728 8.709 3.634 379 HG11 VAL 50 HG11 VAL 50 95.979 9.986 3.512 380 HG12 VAL 50 HG12 VAL 50 97.273 10.286 2.352 381 HG13 VAL 50 HG13 VAL 50 97.473 10.762 4.039 382 HG21 VAL 50 HG21 VAL 50 97.713 8.885 5.825 383 HG22 VAL 50 HG22 VAL 50 97.534 7.215 5.285 384 HG23 VAL 50 HG23 VAL 50 96.162 8.320 5.203 385 HA PRO 51 HA PRO 51 97.353 8.133 -1.546 386 HB2 PRO 51 HB2 PRO 51 96.286 10.910 -1.331 387 HB3 PRO 51 HB3 PRO 51 95.911 9.645 -2.516 388 HG2 PRO 51 HG2 PRO 51 94.206 10.299 -0.578 389 HG3 PRO 51 HG3 PRO 51 94.374 8.633 -1.159 390 HD2 PRO 51 HD2 PRO 51 95.345 9.834 1.392 391 HD3 PRO 51 HD3 PRO 51 94.824 8.172 1.051 392 H LEU 52 H LEU 52 98.964 9.290 -2.769 393 HA LEU 52 HA LEU 52 101.162 10.189 -1.232 394 HB2 LEU 52 HB2 LEU 52 100.614 10.569 -4.188 395 HB3 LEU 52 HB3 LEU 52 102.177 10.782 -3.398 396 HG LEU 52 HG LEU 52 100.597 8.195 -3.379 397 HD11 LEU 52 HD11 LEU 52 103.153 8.648 -4.897 398 HD12 LEU 52 HD12 LEU 52 101.613 9.106 -5.623 399 HD13 LEU 52 HD13 LEU 52 101.907 7.429 -5.161 400 HD21 LEU 52 HD21 LEU 52 102.945 7.351 -2.714 401 HD22 LEU 52 HD22 LEU 52 102.038 8.238 -1.488 402 HD23 LEU 52 HD23 LEU 52 103.325 9.043 -2.387 403 HA PRO 53 HA PRO 53 100.190 14.484 -0.684 404 HB2 PRO 53 HB2 PRO 53 102.656 15.686 -0.968 405 HB3 PRO 53 HB3 PRO 53 102.123 14.850 0.503 406 HG2 PRO 53 HG2 PRO 53 103.897 13.891 -1.677 407 HG3 PRO 53 HG3 PRO 53 104.004 13.621 0.073 408 HD2 PRO 53 HD2 PRO 53 103.057 11.723 -1.628 409 HD3 PRO 53 HD3 PRO 53 102.472 11.884 0.043 410 H SER 54 H SER 54 99.954 16.481 -1.867 411 HA SER 54 HA SER 54 99.365 16.122 -4.553 412 HB2 SER 54 HB2 SER 54 99.908 18.673 -3.022 413 HB3 SER 54 HB3 SER 54 99.247 18.630 -4.654 414 HG SER 54 HG SER 54 98.108 17.172 -2.586 415 HA PRO 55 HA PRO 55 103.515 16.190 -6.024 416 HB2 PRO 55 HB2 PRO 55 103.162 16.033 -8.694 417 HB3 PRO 55 HB3 PRO 55 102.730 14.698 -7.608 418 HG2 PRO 55 HG2 PRO 55 100.985 16.667 -8.962 419 HG3 PRO 55 HG3 PRO 55 100.686 14.965 -8.574 420 HD2 PRO 55 HD2 PRO 55 99.736 17.158 -7.107 421 HD3 PRO 55 HD3 PRO 55 99.792 15.476 -6.542 422 H THR 56 H THR 56 104.767 17.969 -5.834 423 HA THR 56 HA THR 56 104.312 20.331 -7.473 424 HB THR 56 HB THR 56 106.386 21.161 -6.490 425 HG1 THR 56 HG1 THR 56 107.645 19.823 -5.337 426 HG21 THR 56 HG21 THR 56 104.624 19.728 -4.484 427 HG22 THR 56 HG22 THR 56 104.405 21.369 -5.093 428 HG23 THR 56 HG23 THR 56 105.791 20.985 -4.071 429 H SER 57 H SER 57 106.044 21.017 -9.065 430 HA SER 57 HA SER 57 106.236 19.060 -11.049 431 HB2 SER 57 HB2 SER 57 107.928 21.544 -10.693 432 HB3 SER 57 HB3 SER 57 107.812 20.598 -12.173 433 HG SER 57 HG SER 57 105.530 21.038 -11.995 434 H ASN 58 H ASN 58 107.444 17.340 -11.234 435 HA ASN 58 HA ASN 58 109.186 15.925 -11.286 436 HB2 ASN 58 HB2 ASN 58 111.324 16.738 -11.723 437 HB3 ASN 58 HB3 ASN 58 110.242 17.977 -12.334 438 HD21 ASN 58 HD21 ASN 58 111.014 20.023 -11.844 439 HD22 ASN 58 HD22 ASN 58 111.859 20.438 -10.431 440 H LYS 59 H LYS 59 107.980 16.764 -8.559 441 HA LYS 59 HA LYS 59 109.933 15.308 -6.964 442 HB2 LYS 59 HB2 LYS 59 110.715 17.664 -6.913 443 HB3 LYS 59 HB3 LYS 59 109.165 18.137 -6.221 444 HG2 LYS 59 HG2 LYS 59 109.574 16.591 -4.315 445 HG3 LYS 59 HG3 LYS 59 111.162 16.217 -4.989 446 HD2 LYS 59 HD2 LYS 59 111.720 18.659 -4.889 447 HD3 LYS 59 HD3 LYS 59 110.189 18.930 -4.056 448 HE2 LYS 59 HE2 LYS 59 111.799 18.718 -2.321 449 HE3 LYS 59 HE3 LYS 59 110.973 17.161 -2.373 450 HZ1 LYS 59 HZ1 LYS 59 113.285 17.433 -4.107 451 HZ2 LYS 59 HZ2 LYS 59 112.789 16.119 -3.152 452 HZ3 LYS 59 HZ3 LYS 59 113.616 17.423 -2.443 453 H GLN 60 H GLN 60 109.035 14.251 -5.255 454 HA GLN 60 HA GLN 60 106.498 15.181 -4.133 455 HB2 GLN 60 HB2 GLN 60 106.894 12.382 -5.201 456 HB3 GLN 60 HB3 GLN 60 105.611 12.829 -4.078 457 HG2 GLN 60 HG2 GLN 60 104.883 14.580 -5.744 458 HG3 GLN 60 HG3 GLN 60 106.052 13.891 -6.872 459 HE21 GLN 60 HE21 GLN 60 102.913 13.343 -5.322 460 HE22 GLN 60 HE22 GLN 60 102.544 11.941 -6.203 461 H ASP 61 H ASP 61 106.124 14.489 -1.996 462 HA ASP 61 HA ASP 61 108.462 13.378 -0.612 463 HB2 ASP 61 HB2 ASP 61 105.875 14.543 0.450 464 HB3 ASP 61 HB3 ASP 61 107.213 13.976 1.446 465 H ILE 62 H ILE 62 108.536 11.287 0.048 466 HA ILE 62 HA ILE 62 106.006 9.739 0.036 467 HB ILE 62 HB ILE 62 107.362 9.310 -1.997 468 HG12 ILE 62 HG12 ILE 62 107.602 6.757 -1.514 469 HG13 ILE 62 HG13 ILE 62 106.898 7.159 0.051 470 HG21 ILE 62 HG21 ILE 62 109.426 8.374 0.013 471 HG22 ILE 62 HG22 ILE 62 109.599 9.692 -1.146 472 HG23 ILE 62 HG23 ILE 62 109.491 8.026 -1.715 473 HD11 ILE 62 HD11 ILE 62 104.897 7.960 -0.918 474 HD12 ILE 62 HD12 ILE 62 105.270 6.504 -1.842 475 HD13 ILE 62 HD13 ILE 62 105.628 8.093 -2.518 476 H SER 63 H SER 63 105.764 8.202 1.663 477 HA SER 63 HA SER 63 107.960 7.891 3.579 478 HB2 SER 63 HB2 SER 63 106.674 8.624 5.466 479 HB3 SER 63 HB3 SER 63 106.618 9.900 4.256 480 HG SER 63 HG SER 63 104.671 7.955 4.732 481 H GLU 64 H GLU 64 107.483 6.295 5.268 482 HA GLU 64 HA GLU 64 106.591 3.871 4.264 483 HB2 GLU 64 HB2 GLU 64 106.592 3.096 6.619 484 HB3 GLU 64 HB3 GLU 64 108.048 3.995 6.199 485 HG2 GLU 64 HG2 GLU 64 107.024 6.044 7.174 486 HG3 GLU 64 HG3 GLU 64 105.643 5.082 7.685 487 H ALA 65 H ALA 65 104.785 6.354 6.019 488 HA ALA 65 HA ALA 65 102.512 4.843 6.663 489 HB1 ALA 65 HB1 ALA 65 101.365 7.194 6.393 490 HB2 ALA 65 HB2 ALA 65 103.026 7.759 6.218 491 HB3 ALA 65 HB3 ALA 65 102.531 6.922 7.689 492 H ASN 66 H ASN 66 103.382 6.561 3.690 493 HA ASN 66 HA ASN 66 100.809 6.303 2.485 494 HB2 ASN 66 HB2 ASN 66 103.475 6.755 1.131 495 HB3 ASN 66 HB3 ASN 66 101.876 7.066 0.456 496 HD21 ASN 66 HD21 ASN 66 100.520 8.710 1.711 497 HD22 ASN 66 HD22 ASN 66 101.332 10.003 2.454 498 H LEU 67 H LEU 67 103.857 4.471 2.099 499 HA LEU 67 HA LEU 67 102.587 2.751 0.138 500 HB2 LEU 67 HB2 LEU 67 105.346 2.477 1.328 501 HB3 LEU 67 HB3 LEU 67 104.735 1.685 -0.120 502 HG LEU 67 HG LEU 67 105.158 4.662 0.268 503 HD11 LEU 67 HD11 LEU 67 106.494 3.217 -1.962 504 HD12 LEU 67 HD12 LEU 67 107.058 2.788 -0.356 505 HD13 LEU 67 HD13 LEU 67 107.105 4.467 -0.883 506 HD21 LEU 67 HD21 LEU 67 103.774 3.094 -1.885 507 HD22 LEU 67 HD22 LEU 67 104.664 4.553 -2.324 508 HD23 LEU 67 HD23 LEU 67 103.330 4.645 -1.174 509 H ALA 68 H ALA 68 102.771 2.645 3.545 510 HA ALA 68 HA ALA 68 102.031 1.068 5.030 511 HB1 ALA 68 HB1 ALA 68 101.176 -0.951 3.080 512 HB2 ALA 68 HB2 ALA 68 100.493 0.644 2.772 513 HB3 ALA 68 HB3 ALA 68 100.246 -0.134 4.335 514 H TYR 69 H TYR 69 102.175 -1.916 4.450 515 HA TYR 69 HA TYR 69 104.750 -2.363 5.451 516 HB2 TYR 69 HB2 TYR 69 102.925 -4.236 3.947 517 HB3 TYR 69 HB3 TYR 69 104.357 -4.731 4.830 518 HD1 TYR 69 HD1 TYR 69 104.440 -4.419 7.328 519 HD2 TYR 69 HD2 TYR 69 100.856 -3.812 5.040 520 HE1 TYR 69 HE1 TYR 69 103.089 -4.581 9.402 521 HE2 TYR 69 HE2 TYR 69 99.505 -3.974 7.114 522 HH TYR 69 HH TYR 69 100.011 -3.603 9.646 523 H LEU 70 H LEU 70 103.765 -1.778 2.191 524 HA LEU 70 HA LEU 70 105.730 -3.153 0.733 525 HB2 LEU 70 HB2 LEU 70 104.507 -0.456 0.110 526 HB3 LEU 70 HB3 LEU 70 105.319 -1.518 -1.037 527 HG LEU 70 HG LEU 70 102.833 -2.261 0.534 528 HD11 LEU 70 HD11 LEU 70 103.186 -1.468 -2.375 529 HD12 LEU 70 HD12 LEU 70 102.370 -0.513 -1.136 530 HD13 LEU 70 HD13 LEU 70 101.687 -2.055 -1.654 531 HD21 LEU 70 HD21 LEU 70 104.012 -4.259 0.003 532 HD22 LEU 70 HD22 LEU 70 104.493 -3.647 -1.580 533 HD23 LEU 70 HD23 LEU 70 102.813 -4.093 -1.280 534 H TRP 71 H TRP 71 106.024 -0.319 2.733 535 HA TRP 71 HA TRP 71 108.163 1.022 1.580 536 HB2 TRP 71 HB2 TRP 71 106.736 1.679 3.564 537 HB3 TRP 71 HB3 TRP 71 107.764 0.645 4.536 538 HD1 TRP 71 HD1 TRP 71 109.794 1.755 5.557 539 HE1 TRP 71 HE1 TRP 71 111.062 3.963 5.180 540 HE3 TRP 71 HE3 TRP 71 107.369 3.489 1.411 541 HZ2 TRP 71 HZ2 TRP 71 111.084 6.162 3.348 542 HZ3 TRP 71 HZ3 TRP 71 108.043 5.626 0.366 543 HH2 TRP 71 HH2 TRP 71 109.886 6.970 1.328 544 HA PRO 72 HA PRO 72 110.996 -2.456 2.497 545 HB2 PRO 72 HB2 PRO 72 112.788 -2.131 0.533 546 HB3 PRO 72 HB3 PRO 72 111.141 -2.704 0.191 547 HG2 PRO 72 HG2 PRO 72 112.322 -0.012 -0.208 548 HG3 PRO 72 HG3 PRO 72 111.155 -0.895 -1.208 549 HD2 PRO 72 HD2 PRO 72 110.520 1.105 0.648 550 HD3 PRO 72 HD3 PRO 72 109.377 -0.057 -0.054 551 H LEU 73 H LEU 73 111.723 0.906 2.658 552 HA LEU 73 HA LEU 73 114.546 0.520 3.295 553 HB2 LEU 73 HB2 LEU 73 112.894 3.050 3.301 554 HB3 LEU 73 HB3 LEU 73 114.647 2.942 3.422 555 HG LEU 73 HG LEU 73 113.016 1.957 1.066 556 HD11 LEU 73 HD11 LEU 73 113.755 3.932 -0.082 557 HD12 LEU 73 HD12 LEU 73 114.856 4.355 1.230 558 HD13 LEU 73 HD13 LEU 73 113.113 4.469 1.474 559 HD21 LEU 73 HD21 LEU 73 115.317 1.891 0.002 560 HD22 LEU 73 HD22 LEU 73 115.077 0.698 1.275 561 HD23 LEU 73 HD23 LEU 73 116.000 2.164 1.605 562 H THR 74 H THR 74 115.502 0.866 5.223 563 HA THR 74 HA THR 74 114.017 0.523 7.625 564 HB THR 74 HB THR 74 116.175 0.820 8.748 565 HG1 THR 74 HG1 THR 74 117.241 2.303 7.673 566 HG21 THR 74 HG21 THR 74 116.324 -0.786 6.182 567 HG22 THR 74 HG22 THR 74 115.726 -1.355 7.740 568 HG23 THR 74 HG23 THR 74 117.433 -0.961 7.542 569 H VAL 75 H VAL 75 115.488 3.346 6.015 570 HA VAL 75 HA VAL 75 114.878 5.183 8.111 571 HB VAL 75 HB VAL 75 115.117 6.941 6.377 572 HG11 VAL 75 HG11 VAL 75 117.148 6.248 7.401 573 HG12 VAL 75 HG12 VAL 75 117.480 6.244 5.668 574 HG13 VAL 75 HG13 VAL 75 117.168 4.726 6.510 575 HG21 VAL 75 HG21 VAL 75 115.394 4.567 4.509 576 HG22 VAL 75 HG22 VAL 75 115.772 6.231 4.078 577 HG23 VAL 75 HG23 VAL 75 114.114 5.780 4.470 578 H ASP 76 H ASP 76 112.981 6.188 8.605 579 HA ASP 76 HA ASP 76 110.665 4.773 7.847 580 HB2 ASP 76 HB2 ASP 76 110.951 7.414 9.297 581 HB3 ASP 76 HB3 ASP 76 109.445 6.510 9.160 582 H HIS 77 H HIS 77 112.029 7.788 6.620 583 HA HIS 77 HA HIS 77 110.044 7.682 4.477 584 HB2 HIS 77 HB2 HIS 77 109.573 10.114 4.705 585 HB3 HIS 77 HB3 HIS 77 108.926 9.131 6.002 586 HD1 HIS 77 HD1 HIS 77 110.910 8.982 8.100 587 HD2 HIS 77 HD2 HIS 77 110.656 12.401 5.727 588 HE1 HIS 77 HE1 HIS 77 111.993 10.851 9.420 589 H GLY 78 H GLY 78 110.548 9.433 2.825 590 HA2 GLY 78 HA2 GLY 78 113.098 10.698 2.795 591 HA3 GLY 78 HA3 GLY 78 113.083 9.265 1.769 592 H THR 79 H THR 79 113.434 11.824 0.725 593 HA THR 79 HA THR 79 110.850 12.409 -0.597 594 HB THR 79 HB THR 79 113.276 14.197 -0.675 595 HG1 THR 79 HG1 THR 79 112.903 14.630 1.317 596 HG21 THR 79 HG21 THR 79 111.613 14.897 -2.195 597 HG22 THR 79 HG22 THR 79 111.259 15.852 -0.754 598 HG23 THR 79 HG23 THR 79 110.301 14.414 -1.117 599 H ILE 80 H ILE 80 110.696 12.328 -2.809 600 HA ILE 80 HA ILE 80 113.030 11.188 -4.231 601 HB ILE 80 HB ILE 80 111.367 10.268 -5.819 602 HG12 ILE 80 HG12 ILE 80 109.321 11.287 -3.819 603 HG13 ILE 80 HG13 ILE 80 109.608 12.005 -5.402 604 HG21 ILE 80 HG21 ILE 80 110.478 8.551 -4.287 605 HG22 ILE 80 HG22 ILE 80 110.848 9.587 -2.908 606 HG23 ILE 80 HG23 ILE 80 112.155 8.936 -3.897 607 HD11 ILE 80 HD11 ILE 80 108.383 9.357 -4.728 608 HD12 ILE 80 HD12 ILE 80 109.221 9.553 -6.267 609 HD13 ILE 80 HD13 ILE 80 107.839 10.583 -5.877 610 H GLU 81 H GLU 81 113.783 12.173 -6.055 611 HA GLU 81 HA GLU 81 112.254 14.383 -7.200 612 HB2 GLU 81 HB2 GLU 81 114.122 15.969 -6.969 613 HB3 GLU 81 HB3 GLU 81 113.519 15.445 -5.396 614 HG2 GLU 81 HG2 GLU 81 115.337 13.730 -5.323 615 HG3 GLU 81 HG3 GLU 81 115.973 14.386 -6.825 616 H CYS 82 H CYS 82 112.723 14.869 -9.267 617 HA CYS 82 HA CYS 82 114.835 13.294 -10.610 618 HB2 CYS 82 HB2 CYS 82 112.233 14.474 -11.575 619 HB3 CYS 82 HB3 CYS 82 113.506 14.003 -12.701 620 H LEU 83 H LEU 83 116.577 14.354 -11.321 621 HA LEU 83 HA LEU 83 116.693 17.245 -11.024 622 HB2 LEU 83 HB2 LEU 83 118.776 15.198 -11.811 623 HB3 LEU 83 HB3 LEU 83 119.099 16.922 -11.634 624 HG LEU 83 HG LEU 83 117.790 15.381 -9.402 625 HD11 LEU 83 HD11 LEU 83 120.774 15.696 -9.858 626 HD12 LEU 83 HD12 LEU 83 119.879 14.185 -10.021 627 HD13 LEU 83 HD13 LEU 83 120.011 14.966 -8.446 628 HD21 LEU 83 HD21 LEU 83 119.033 17.174 -8.094 629 HD22 LEU 83 HD22 LEU 83 117.762 17.775 -9.158 630 HD23 LEU 83 HD23 LEU 83 119.452 17.904 -9.644 631 HA PRO 84 HA PRO 84 116.142 18.535 -15.226 632 HB2 PRO 84 HB2 PRO 84 118.902 19.671 -15.222 633 HB3 PRO 84 HB3 PRO 84 117.362 20.441 -15.652 634 HG2 PRO 84 HG2 PRO 84 118.572 20.965 -13.347 635 HG3 PRO 84 HG3 PRO 84 116.805 20.868 -13.469 636 HD2 PRO 84 HD2 PRO 84 118.712 18.914 -12.270 637 HD3 PRO 84 HD3 PRO 84 117.031 19.275 -11.821 638 H SER 85 H SER 85 118.953 16.681 -14.364 639 HA SER 85 HA SER 85 119.810 16.148 -17.070 640 HB2 SER 85 HB2 SER 85 120.613 14.953 -14.417 641 HB3 SER 85 HB3 SER 85 121.349 14.526 -15.958 642 HG SER 85 HG SER 85 122.487 16.194 -15.057 643 H ASP 86 H ASP 86 117.108 15.090 -15.570 644 HA ASP 86 HA ASP 86 115.705 13.316 -15.771 645 HB2 ASP 86 HB2 ASP 86 117.503 12.537 -18.082 646 HB3 ASP 86 HB3 ASP 86 115.923 11.850 -17.730 647 H ASN 87 H ASN 87 117.813 13.188 -13.910 648 HA ASN 87 HA ASN 87 118.315 10.270 -13.797 649 HB2 ASN 87 HB2 ASN 87 119.721 12.558 -12.396 650 HB3 ASN 87 HB3 ASN 87 120.058 10.850 -12.121 651 HD21 ASN 87 HD21 ASN 87 122.008 12.747 -13.170 652 HD22 ASN 87 HD22 ASN 87 122.399 12.246 -14.744 653 H ALA 88 H ALA 88 117.225 9.150 -12.292 654 HA ALA 88 HA ALA 88 115.522 10.637 -10.423 655 HB1 ALA 88 HB1 ALA 88 115.506 7.885 -11.589 656 HB2 ALA 88 HB2 ALA 88 114.189 9.048 -11.441 657 HB3 ALA 88 HB3 ALA 88 114.724 8.137 -10.029 658 H VAL 89 H VAL 89 116.132 10.907 -8.369 659 HA VAL 89 HA VAL 89 117.864 8.856 -7.126 660 HB VAL 89 HB VAL 89 119.094 10.666 -5.966 661 HG11 VAL 89 HG11 VAL 89 120.186 11.586 -8.146 662 HG12 VAL 89 HG12 VAL 89 119.062 10.506 -8.974 663 HG13 VAL 89 HG13 VAL 89 120.245 9.849 -7.841 664 HG21 VAL 89 HG21 VAL 89 117.226 12.355 -6.215 665 HG22 VAL 89 HG22 VAL 89 117.688 12.522 -7.909 666 HG23 VAL 89 HG23 VAL 89 118.824 12.971 -6.636 667 H PHE 90 H PHE 90 117.775 8.774 -4.856 668 HA PHE 90 HA PHE 90 115.233 9.715 -3.677 669 HB2 PHE 90 HB2 PHE 90 115.351 7.295 -3.941 670 HB3 PHE 90 HB3 PHE 90 116.906 7.258 -3.141 671 HD1 PHE 90 HD1 PHE 90 113.289 8.010 -2.615 672 HD2 PHE 90 HD2 PHE 90 117.057 7.027 -0.805 673 HE1 PHE 90 HE1 PHE 90 112.148 7.638 -0.435 674 HE2 PHE 90 HE2 PHE 90 115.919 6.643 1.364 675 HZ PHE 90 HZ PHE 90 113.463 6.950 1.546 676 H VAL 91 H VAL 91 115.417 11.069 -1.975 677 HA VAL 91 HA VAL 91 118.052 11.362 -0.667 678 HB VAL 91 HB VAL 91 115.705 13.280 -0.771 679 HG11 VAL 91 HG11 VAL 91 118.484 14.085 0.020 680 HG12 VAL 91 HG12 VAL 91 117.466 13.307 1.228 681 HG13 VAL 91 HG13 VAL 91 116.936 14.799 0.461 682 HG21 VAL 91 HG21 VAL 91 116.727 13.088 -2.959 683 HG22 VAL 91 HG22 VAL 91 118.341 13.231 -2.262 684 HG23 VAL 91 HG23 VAL 91 117.244 14.613 -2.237 685 H ALA 92 H ALA 92 118.235 10.790 1.432 686 HA ALA 92 HA ALA 92 115.760 10.019 2.863 687 HB1 ALA 92 HB1 ALA 92 117.332 8.245 2.888 688 HB2 ALA 92 HB2 ALA 92 117.466 8.989 4.482 689 HB3 ALA 92 HB3 ALA 92 118.676 9.332 3.245 690 HA PRO 93 HA PRO 93 115.730 13.440 5.662 691 HB2 PRO 93 HB2 PRO 93 115.971 11.526 7.939 692 HB3 PRO 93 HB3 PRO 93 114.780 12.811 7.665 693 HG2 PRO 93 HG2 PRO 93 114.212 10.216 7.310 694 HG3 PRO 93 HG3 PRO 93 113.467 11.505 6.352 695 HD2 PRO 93 HD2 PRO 93 115.481 9.503 5.525 696 HD3 PRO 93 HD3 PRO 93 114.334 10.432 4.543 697 H ASP 94 H ASP 94 118.196 10.986 6.021 698 HA ASP 94 HA ASP 94 119.831 12.314 7.909 699 HB2 ASP 94 HB2 ASP 94 121.617 10.790 7.060 700 HB3 ASP 94 HB3 ASP 94 120.133 9.974 7.532 701 H GLY 95 H GLY 95 119.217 13.128 4.646 702 HA2 GLY 95 HA2 GLY 95 120.037 15.054 3.559 703 HA3 GLY 95 HA3 GLY 95 121.388 15.089 4.687 704 H THR 96 H THR 96 120.917 11.974 3.429 705 HA THR 96 HA THR 96 123.236 12.277 1.651 706 HB THR 96 HB THR 96 121.914 9.782 2.751 707 HG1 THR 96 HG1 THR 96 122.947 10.398 4.443 708 HG21 THR 96 HG21 THR 96 124.288 10.315 1.006 709 HG22 THR 96 HG22 THR 96 123.101 9.012 0.920 710 HG23 THR 96 HG23 THR 96 124.366 8.973 2.148 711 H THR 97 H THR 97 123.082 11.820 -0.514 712 HA THR 97 HA THR 97 120.373 11.235 -1.544 713 HB THR 97 HB THR 97 122.780 12.329 -3.029 714 HG1 THR 97 HG1 THR 97 120.673 13.536 -1.711 715 HG21 THR 97 HG21 THR 97 119.839 12.167 -3.750 716 HG22 THR 97 HG22 THR 97 121.116 11.160 -4.431 717 HG23 THR 97 HG23 THR 97 121.103 12.897 -4.740 718 H TYR 98 H TYR 98 119.971 9.410 -2.546 719 HA TYR 98 HA TYR 98 122.190 7.573 -3.206 720 HB2 TYR 98 HB2 TYR 98 119.359 6.936 -2.375 721 HB3 TYR 98 HB3 TYR 98 120.594 5.755 -2.763 722 HD1 TYR 98 HD2 TYR 98 122.489 5.376 -1.196 723 HD2 TYR 98 HD1 TYR 98 119.273 8.061 -0.250 724 HE1 TYR 98 HE2 TYR 98 123.162 5.345 1.192 725 HE2 TYR 98 HE1 TYR 98 119.955 8.041 2.132 726 HH TYR 98 HH TYR 98 121.548 7.341 3.578 727 H ALA 99 H ALA 99 121.975 6.399 -5.171 728 HA ALA 99 HA ALA 99 120.338 7.731 -7.178 729 HB1 ALA 99 HB1 ALA 99 121.598 5.848 -8.598 730 HB2 ALA 99 HB2 ALA 99 122.653 5.851 -7.186 731 HB3 ALA 99 HB3 ALA 99 122.407 7.335 -8.104 732 H LEU 100 H LEU 100 118.454 6.974 -7.951 733 HA LEU 100 HA LEU 100 117.442 4.428 -6.944 734 HB2 LEU 100 HB2 LEU 100 116.198 6.706 -8.484 735 HB3 LEU 100 HB3 LEU 100 115.365 5.174 -8.249 736 HG LEU 100 HG LEU 100 116.510 6.694 -5.908 737 HD11 LEU 100 HD11 LEU 100 113.818 7.006 -7.265 738 HD12 LEU 100 HD12 LEU 100 115.029 8.262 -7.021 739 HD13 LEU 100 HD13 LEU 100 114.160 7.594 -5.639 740 HD21 LEU 100 HD21 LEU 100 115.800 4.304 -5.650 741 HD22 LEU 100 HD22 LEU 100 114.188 4.755 -6.202 742 HD23 LEU 100 HD23 LEU 100 114.818 5.407 -4.690 743 H ASN 101 H ASN 101 117.913 6.047 -10.081 744 HA ASN 101 HA ASN 101 117.498 3.433 -11.406 745 HB2 ASN 101 HB2 ASN 101 116.915 4.623 -13.388 746 HB3 ASN 101 HB3 ASN 101 116.021 5.327 -12.048 747 HD21 ASN 101 HD21 ASN 101 116.102 7.034 -14.065 748 HD22 ASN 101 HD22 ASN 101 117.300 8.223 -13.889 749 H ASP 102 H ASP 102 118.699 3.177 -13.517 750 HA ASP 102 HA ASP 102 121.339 2.638 -12.841 751 HB2 ASP 102 HB2 ASP 102 120.043 1.534 -14.657 752 HB3 ASP 102 HB3 ASP 102 120.251 2.984 -15.638 753 H ARG 103 H ARG 103 120.031 5.447 -14.590 754 HA ARG 103 HA ARG 103 122.534 6.386 -15.517 755 HB2 ARG 103 HB2 ARG 103 119.901 7.800 -15.081 756 HB3 ARG 103 HB3 ARG 103 121.303 8.552 -15.851 757 HG2 ARG 103 HG2 ARG 103 121.357 6.681 -17.501 758 HG3 ARG 103 HG3 ARG 103 119.883 6.040 -16.779 759 HD2 ARG 103 HD2 ARG 103 120.183 8.765 -18.068 760 HD3 ARG 103 HD3 ARG 103 119.360 7.377 -18.772 761 HE ARG 103 HE ARG 103 118.297 9.172 -16.813 762 HH11 ARG 103 HH11 ARG 103 118.182 5.811 -17.823 763 HH12 ARG 103 HH12 ARG 103 116.595 5.575 -17.173 764 HH21 ARG 103 HH21 ARG 103 116.287 8.818 -16.012 765 HH22 ARG 103 HH22 ARG 103 115.524 7.266 -16.151 766 H ALA 104 H ALA 104 120.651 7.201 -12.602 767 HA ALA 104 HA ALA 104 122.407 9.118 -11.555 768 HB1 ALA 104 HB1 ALA 104 120.149 8.657 -10.656 769 HB2 ALA 104 HB2 ALA 104 121.381 8.632 -9.395 770 HB3 ALA 104 HB3 ALA 104 120.729 7.118 -10.023 771 H GLU 105 H GLU 105 122.461 5.574 -11.312 772 HA GLU 105 HA GLU 105 124.663 5.365 -9.562 773 HB2 GLU 105 HB2 GLU 105 123.786 3.493 -11.775 774 HB3 GLU 105 HB3 GLU 105 124.950 3.094 -10.513 775 HG2 GLU 105 HG2 GLU 105 122.080 3.935 -10.030 776 HG3 GLU 105 HG3 GLU 105 122.674 2.281 -9.963 777 H LYS 106 H LYS 106 124.501 5.599 -13.102 778 HA LYS 106 HA LYS 106 127.235 5.367 -13.664 779 HB2 LYS 106 HB2 LYS 106 125.412 5.386 -15.363 780 HB3 LYS 106 HB3 LYS 106 125.234 7.121 -15.102 781 HG2 LYS 106 HG2 LYS 106 127.623 7.433 -15.727 782 HG3 LYS 106 HG3 LYS 106 127.734 5.707 -16.071 783 HD2 LYS 106 HD2 LYS 106 125.868 5.976 -17.726 784 HD3 LYS 106 HD3 LYS 106 125.943 7.718 -17.460 785 HE2 LYS 106 HE2 LYS 106 128.286 6.030 -18.381 786 HE3 LYS 106 HE3 LYS 106 127.260 6.982 -19.455 787 HZ1 LYS 106 HZ1 LYS 106 128.587 8.685 -19.019 788 HZ2 LYS 106 HZ2 LYS 106 129.404 7.835 -17.796 789 HZ3 LYS 106 HZ3 LYS 106 127.985 8.694 -17.434 790 H ALA 107 H ALA 107 125.354 8.128 -12.561 791 HA ALA 107 HA ALA 107 127.398 10.089 -12.870 792 HB1 ALA 107 HB1 ALA 107 125.025 10.102 -11.001 793 HB2 ALA 107 HB2 ALA 107 124.997 10.634 -12.682 794 HB3 ALA 107 HB3 ALA 107 125.975 11.502 -11.498 795 H GLY 108 H GLY 108 127.478 7.468 -10.864 796 HA2 GLY 108 HA2 GLY 108 128.889 6.925 -9.164 797 HA3 GLY 108 HA3 GLY 108 129.560 8.541 -9.251 798 H HIS 109 H HIS 109 126.109 8.192 -8.711 799 HA HIS 109 HA HIS 109 126.377 9.192 -6.013 800 HB2 HIS 109 HB2 HIS 109 124.100 8.549 -7.838 801 HB3 HIS 109 HB3 HIS 109 123.794 8.714 -6.120 802 HD1 HIS 109 HD1 HIS 109 124.262 11.098 -5.062 803 HD2 HIS 109 HD2 HIS 109 124.501 10.950 -9.222 804 HE1 HIS 109 HE1 HIS 109 124.209 13.497 -5.868 805 HA PRO 110 HA PRO 110 126.600 5.039 -4.312 806 HB2 PRO 110 HB2 PRO 110 125.340 6.030 -1.821 807 HB3 PRO 110 HB3 PRO 110 126.936 5.300 -2.067 808 HG2 PRO 110 HG2 PRO 110 126.604 7.905 -1.537 809 HG3 PRO 110 HG3 PRO 110 127.927 7.290 -2.544 810 HD2 PRO 110 HD2 PRO 110 125.411 8.672 -3.386 811 HD3 PRO 110 HD3 PRO 110 127.044 8.759 -4.085 812 HA PRO 111 HA PRO 111 122.336 3.719 -4.828 813 HB2 PRO 111 HB2 PRO 111 122.506 1.086 -4.161 814 HB3 PRO 111 HB3 PRO 111 123.136 1.739 -5.685 815 HG2 PRO 111 HG2 PRO 111 124.582 0.919 -3.247 816 HG3 PRO 111 HG3 PRO 111 125.086 0.854 -4.940 817 HD2 PRO 111 HD2 PRO 111 125.889 2.790 -3.089 818 HD3 PRO 111 HD3 PRO 111 126.027 2.926 -4.854 819 H ILE 112 H ILE 112 120.448 3.009 -3.632 820 HA ILE 112 HA ILE 112 120.355 3.919 -0.967 821 HB ILE 112 HB ILE 112 118.376 2.176 -2.462 822 HG12 ILE 112 HG12 ILE 112 118.360 5.155 -1.948 823 HG13 ILE 112 HG13 ILE 112 118.976 4.445 -3.438 824 HG21 ILE 112 HG21 ILE 112 118.154 3.770 0.110 825 HG22 ILE 112 HG22 ILE 112 117.883 2.042 -0.095 826 HG23 ILE 112 HG23 ILE 112 116.751 3.198 -0.790 827 HD11 ILE 112 HD11 ILE 112 116.808 3.533 -3.977 828 HD12 ILE 112 HD12 ILE 112 116.568 5.228 -3.544 829 HD13 ILE 112 HD13 ILE 112 116.171 3.960 -2.388 830 H THR 113 H THR 113 121.671 0.987 -2.051 831 HA THR 113 HA THR 113 120.580 -0.966 -0.534 832 HB THR 113 HB THR 113 122.411 -1.178 -2.250 833 HG1 THR 113 HG1 THR 113 122.498 -2.664 0.094 834 HG21 THR 113 HG21 THR 113 124.130 -0.711 0.202 835 HG22 THR 113 HG22 THR 113 124.218 0.111 -1.353 836 HG23 THR 113 HG23 THR 113 124.691 -1.577 -1.224 837 HA PRO 114 HA PRO 114 123.493 -0.162 3.239 838 HB2 PRO 114 HB2 PRO 114 123.210 2.770 3.594 839 HB3 PRO 114 HB3 PRO 114 124.641 1.739 3.790 840 HG2 PRO 114 HG2 PRO 114 124.406 3.382 1.722 841 HG3 PRO 114 HG3 PRO 114 125.146 1.778 1.547 842 HD2 PRO 114 HD2 PRO 114 122.377 2.662 0.790 843 HD3 PRO 114 HD3 PRO 114 123.498 1.621 -0.106 844 H ILE 115 H ILE 115 120.659 1.816 2.529 845 HA ILE 115 HA ILE 115 119.645 1.400 5.255 846 HB ILE 115 HB ILE 115 117.809 2.979 4.522 847 HG12 ILE 115 HG12 ILE 115 119.745 3.645 2.291 848 HG13 ILE 115 HG13 ILE 115 118.290 2.681 2.049 849 HG21 ILE 115 HG21 ILE 115 120.448 4.366 4.312 850 HG22 ILE 115 HG22 ILE 115 120.086 3.455 5.780 851 HG23 ILE 115 HG23 ILE 115 119.029 4.773 5.278 852 HD11 ILE 115 HD11 ILE 115 117.955 5.295 3.455 853 HD12 ILE 115 HD12 ILE 115 116.884 4.481 2.317 854 HD13 ILE 115 HD13 ILE 115 118.301 5.348 1.727 855 H ARG 116 H ARG 116 119.526 -0.486 2.632 856 HA ARG 116 HA ARG 116 116.701 -0.822 2.294 857 HB2 ARG 116 HB2 ARG 116 117.248 -2.664 0.855 858 HB3 ARG 116 HB3 ARG 116 118.393 -1.371 0.540 859 HG2 ARG 116 HG2 ARG 116 119.929 -3.051 0.727 860 HG3 ARG 116 HG3 ARG 116 119.763 -2.722 2.448 861 HD2 ARG 116 HD2 ARG 116 117.987 -4.503 2.557 862 HD3 ARG 116 HD3 ARG 116 118.313 -4.865 0.869 863 HE ARG 116 HE ARG 116 120.136 -6.066 1.576 864 HH11 ARG 116 HH11 ARG 116 119.403 -3.718 4.080 865 HH12 ARG 116 HH12 ARG 116 120.657 -4.295 5.126 866 HH21 ARG 116 HH21 ARG 116 121.731 -6.767 2.966 867 HH22 ARG 116 HH22 ARG 116 121.956 -6.000 4.503 868 H ALA 117 H ALA 117 115.363 -2.454 3.054 869 HA ALA 117 HA ALA 117 116.152 -3.782 5.506 870 HB1 ALA 117 HB1 ALA 117 113.856 -2.831 5.106 871 HB2 ALA 117 HB2 ALA 117 113.857 -4.528 5.592 872 HB3 ALA 117 HB3 ALA 117 113.609 -4.095 3.899 873 H LYS 118 H LYS 118 116.673 -5.909 5.735 874 HA LYS 118 HA LYS 118 117.095 -7.472 3.324 875 HB2 LYS 118 HB2 LYS 118 118.220 -9.058 4.760 876 HB3 LYS 118 HB3 LYS 118 118.762 -7.435 5.175 877 HG2 LYS 118 HG2 LYS 118 117.106 -7.415 7.055 878 HG3 LYS 118 HG3 LYS 118 116.711 -9.092 6.675 879 HD2 LYS 118 HD2 LYS 118 119.195 -9.603 6.940 880 HD3 LYS 118 HD3 LYS 118 119.360 -7.988 7.629 881 HE2 LYS 118 HE2 LYS 118 117.633 -8.564 9.326 882 HE3 LYS 118 HE3 LYS 118 117.567 -10.200 8.670 883 HZ1 LYS 118 HZ1 LYS 118 119.047 -10.271 10.478 884 HZ2 LYS 118 HZ2 LYS 118 119.856 -8.860 9.987 885 HZ3 LYS 118 HZ3 LYS 118 120.026 -10.294 9.093 886 H GLY 119 H GLY 119 115.992 -9.254 2.702 887 HA2 GLY 119 HA2 GLY 119 113.416 -9.734 4.063 888 HA3 GLY 119 HA3 GLY 119 113.739 -10.040 2.369 889 H SER 120 H SER 120 112.738 -11.822 4.558 890 HA SER 120 HA SER 120 114.683 -13.744 5.240 891 HB2 SER 120 HB2 SER 120 112.819 -15.203 5.749 892 HB3 SER 120 HB3 SER 120 112.417 -13.567 6.261 893 HG SER 120 HG SER 120 111.295 -15.098 4.355 894 H GLY 121 H GLY 121 112.690 -13.359 2.348 895 HA2 GLY 121 HA2 GLY 121 114.126 -15.644 1.115 896 HA3 GLY 121 HA3 GLY 121 112.473 -15.192 0.703 897 H GLY 122 H GLY 122 115.220 -15.269 -0.749 898 HA2 GLY 122 HA2 GLY 122 115.790 -14.145 -2.741 899 HA3 GLY 122 HA3 GLY 122 114.778 -12.792 -2.244 900 H GLY 123 H GLY 123 115.881 -12.507 0.392 901 HA2 GLY 123 HA2 GLY 123 118.021 -12.093 1.442 902 HA3 GLY 123 HA3 GLY 123 118.688 -11.753 -0.150 903 H TYR 124 H TYR 124 117.255 -9.936 -1.305 904 HA TYR 124 HA TYR 124 117.136 -7.669 0.595 905 HB2 TYR 124 HB2 TYR 124 117.845 -7.914 -2.314 906 HB3 TYR 124 HB3 TYR 124 117.345 -6.374 -1.642 907 HD1 TYR 124 HD1 TYR 124 119.487 -9.121 -0.259 908 HD2 TYR 124 HD2 TYR 124 119.235 -5.012 -1.488 909 HE1 TYR 124 HE1 TYR 124 121.832 -8.759 0.466 910 HE2 TYR 124 HE2 TYR 124 121.571 -4.644 -0.741 911 HH TYR 124 HH TYR 124 123.635 -6.220 -0.392 912 H ILE 125 H ILE 125 115.278 -6.425 0.731 913 HA ILE 125 HA ILE 125 112.903 -7.424 -0.585 914 HB ILE 125 HB ILE 125 113.317 -5.031 1.230 915 HG12 ILE 125 HG12 ILE 125 112.147 -7.769 1.803 916 HG13 ILE 125 HG13 ILE 125 113.812 -7.326 2.165 917 HG21 ILE 125 HG21 ILE 125 110.863 -5.125 1.512 918 HG22 ILE 125 HG22 ILE 125 110.775 -6.427 0.327 919 HG23 ILE 125 HG23 ILE 125 111.289 -4.815 -0.171 920 HD11 ILE 125 HD11 ILE 125 111.828 -5.406 3.216 921 HD12 ILE 125 HD12 ILE 125 113.215 -6.154 4.006 922 HD13 ILE 125 HD13 ILE 125 111.693 -7.029 3.891 923 H SER 126 H SER 126 111.849 -6.562 -2.286 924 HA SER 126 HA SER 126 113.385 -5.227 -4.220 925 HB2 SER 126 HB2 SER 126 110.387 -5.583 -4.081 926 HB3 SER 126 HB3 SER 126 111.298 -5.124 -5.515 927 HG SER 126 HG SER 126 111.079 -7.535 -4.281 928 H LEU 127 H LEU 127 113.665 -3.195 -4.787 929 HA LEU 127 HA LEU 127 112.190 -1.068 -3.390 930 HB2 LEU 127 HB2 LEU 127 114.576 -0.848 -5.235 931 HB3 LEU 127 HB3 LEU 127 113.894 0.438 -4.245 932 HG LEU 127 HG LEU 127 115.102 -2.131 -3.172 933 HD11 LEU 127 HD11 LEU 127 116.175 0.699 -3.023 934 HD12 LEU 127 HD12 LEU 127 116.711 -0.482 -4.217 935 HD13 LEU 127 HD13 LEU 127 116.984 -0.778 -2.501 936 HD21 LEU 127 HD21 LEU 127 115.025 -0.618 -1.034 937 HD22 LEU 127 HD22 LEU 127 113.552 -1.440 -1.550 938 HD23 LEU 127 HD23 LEU 127 113.784 0.270 -1.919 939 H GLY 128 H GLY 128 111.496 -2.822 -6.028 940 HA2 GLY 128 HA2 GLY 128 111.479 -1.241 -8.267 941 HA3 GLY 128 HA3 GLY 128 110.253 -2.455 -7.932 942 H ALA 129 H ALA 129 109.000 -1.237 -5.692 943 HA ALA 129 HA ALA 129 107.114 0.350 -7.037 944 HB1 ALA 129 HB1 ALA 129 107.675 0.172 -4.067 945 HB2 ALA 129 HB2 ALA 129 106.576 -0.862 -4.980 946 HB3 ALA 129 HB3 ALA 129 106.218 0.855 -4.791 947 H LEU 130 H LEU 130 109.691 1.319 -4.773 948 HA LEU 130 HA LEU 130 109.136 4.074 -4.793 949 HB2 LEU 130 HB2 LEU 130 110.626 2.935 -3.163 950 HB3 LEU 130 HB3 LEU 130 111.820 2.716 -4.442 951 HG LEU 130 HG LEU 130 111.795 5.227 -4.764 952 HD11 LEU 130 HD11 LEU 130 109.741 5.892 -3.785 953 HD12 LEU 130 HD12 LEU 130 110.967 6.446 -2.644 954 HD13 LEU 130 HD13 LEU 130 110.052 4.976 -2.311 955 HD21 LEU 130 HD21 LEU 130 113.383 3.777 -3.239 956 HD22 LEU 130 HD22 LEU 130 112.546 4.597 -1.921 957 HD23 LEU 130 HD23 LEU 130 113.429 5.534 -3.124 958 H LEU 131 H LEU 131 111.223 2.096 -6.869 959 HA LEU 131 HA LEU 131 112.426 4.204 -8.295 960 HB2 LEU 131 HB2 LEU 131 113.199 1.842 -8.357 961 HB3 LEU 131 HB3 LEU 131 111.765 1.418 -9.289 962 HG LEU 131 HG LEU 131 112.497 3.153 -10.998 963 HD11 LEU 131 HD11 LEU 131 115.026 3.591 -10.877 964 HD12 LEU 131 HD12 LEU 131 114.914 3.107 -9.185 965 HD13 LEU 131 HD13 LEU 131 114.012 4.508 -9.763 966 HD21 LEU 131 HD21 LEU 131 112.883 0.934 -11.654 967 HD22 LEU 131 HD22 LEU 131 114.047 0.654 -10.359 968 HD23 LEU 131 HD23 LEU 131 114.496 1.642 -11.749 969 H SER 132 H SER 132 109.424 2.404 -8.891 970 HA SER 132 HA SER 132 108.868 3.464 -11.430 971 HB2 SER 132 HB2 SER 132 106.868 2.615 -9.322 972 HB3 SER 132 HB3 SER 132 106.577 2.737 -11.054 973 HG SER 132 HG SER 132 107.298 0.777 -11.054 974 H THR 133 H THR 133 107.996 4.627 -8.187 975 HA THR 133 HA THR 133 106.293 6.712 -9.029 976 HB THR 133 HB THR 133 108.048 6.673 -6.561 977 HG1 THR 133 HG1 THR 133 106.838 4.930 -6.389 978 HG21 THR 133 HG21 THR 133 106.414 8.178 -5.631 979 HG22 THR 133 HG22 THR 133 105.365 7.991 -7.037 980 HG23 THR 133 HG23 THR 133 106.905 8.835 -7.193 981 H THR 134 H THR 134 109.782 6.718 -8.300 982 HA THR 134 HA THR 134 110.135 9.493 -8.729 983 HB THR 134 HB THR 134 112.227 7.345 -9.113 984 HG1 THR 134 HG1 THR 134 111.177 8.555 -6.851 985 HG21 THR 134 HG21 THR 134 112.373 10.272 -8.319 986 HG22 THR 134 HG22 THR 134 112.859 9.602 -9.877 987 HG23 THR 134 HG23 THR 134 113.747 9.169 -8.417 988 H LEU 135 H LEU 135 110.385 6.719 -10.935 989 HA LEU 135 HA LEU 135 111.424 8.107 -13.148 990 HB2 LEU 135 HB2 LEU 135 109.652 5.660 -13.012 991 HB3 LEU 135 HB3 LEU 135 110.419 6.242 -14.490 992 HG LEU 135 HG LEU 135 111.967 5.595 -11.970 993 HD11 LEU 135 HD11 LEU 135 112.661 3.554 -13.398 994 HD12 LEU 135 HD12 LEU 135 111.210 3.888 -14.344 995 HD13 LEU 135 HD13 LEU 135 111.075 3.499 -12.628 996 HD21 LEU 135 HD21 LEU 135 113.768 5.375 -13.863 997 HD22 LEU 135 HD22 LEU 135 113.305 6.982 -13.301 998 HD23 LEU 135 HD23 LEU 135 112.637 6.345 -14.805 999 H ASN 136 H ASN 136 108.083 7.633 -12.048 1000 HA ASN 136 HA ASN 136 106.762 8.671 -14.291 1001 HB2 ASN 136 HB2 ASN 136 105.714 7.524 -12.290 1002 HB3 ASN 136 HB3 ASN 136 105.882 9.051 -11.425 1003 HD21 ASN 136 HD21 ASN 136 104.043 10.332 -11.543 1004 HD22 ASN 136 HD22 ASN 136 102.932 10.328 -12.828 1005 H LEU 137 H LEU 137 108.001 10.296 -11.392 1006 HA LEU 137 HA LEU 137 107.241 12.920 -12.114 1007 HB2 LEU 137 HB2 LEU 137 109.622 12.031 -10.466 1008 HB3 LEU 137 HB3 LEU 137 108.944 13.658 -10.501 1009 HG LEU 137 HG LEU 137 107.417 11.177 -9.659 1010 HD11 LEU 137 HD11 LEU 137 107.559 12.511 -7.399 1011 HD12 LEU 137 HD12 LEU 137 108.976 13.253 -8.143 1012 HD13 LEU 137 HD13 LEU 137 108.921 11.507 -7.898 1013 HD21 LEU 137 HD21 LEU 137 106.772 14.138 -9.695 1014 HD22 LEU 137 HD22 LEU 137 105.851 12.972 -8.746 1015 HD23 LEU 137 HD23 LEU 137 105.898 12.837 -10.503 1016 H CYS 138 H CYS 138 110.170 11.062 -12.820 1017 HA CYS 138 HA CYS 138 111.658 13.072 -14.073 1018 HB2 CYS 138 HB2 CYS 138 111.592 10.087 -14.248 1019 HB3 CYS 138 HB3 CYS 138 112.560 10.984 -15.412 1020 H GLY 139 H GLY 139 108.881 11.298 -15.260 1021 HA2 GLY 139 HA2 GLY 139 107.585 11.778 -17.129 1022 HA3 GLY 139 HA3 GLY 139 108.770 12.987 -17.605 1023 H LYS 140 H LYS 140 109.880 9.745 -16.930 1024 HA LYS 140 HA LYS 140 110.891 9.481 -19.609 1025 HB2 LYS 140 HB2 LYS 140 112.082 8.626 -17.584 1026 HB3 LYS 140 HB3 LYS 140 110.815 7.415 -17.397 1027 HG2 LYS 140 HG2 LYS 140 112.542 6.307 -18.591 1028 HG3 LYS 140 HG3 LYS 140 111.343 6.724 -19.815 1029 HD2 LYS 140 HD2 LYS 140 112.636 8.697 -20.460 1030 HD3 LYS 140 HD3 LYS 140 113.807 8.375 -19.179 1031 HE2 LYS 140 HE2 LYS 140 114.857 7.423 -21.037 1032 HE3 LYS 140 HE3 LYS 140 114.028 6.033 -20.336 1033 HZ1 LYS 140 HZ1 LYS 140 113.786 6.638 -22.864 1034 HZ2 LYS 140 HZ2 LYS 140 112.572 7.670 -22.274 1035 HZ3 LYS 140 HZ3 LYS 140 112.484 5.999 -21.984 1036 H GLY 141 H GLY 141 110.072 8.346 -21.279 1037 HA2 GLY 141 HA2 GLY 141 108.815 6.572 -22.260 1038 HA3 GLY 141 HA3 GLY 141 107.827 6.504 -20.804 Start of MODEL 14 1 H1 HIS -5 HT1 HIS -5 147.870 20.759 29.825 2 H2 HIS -5 HT2 HIS -5 146.716 21.935 30.241 3 H3 HIS -5 HT3 HIS -5 147.751 21.298 31.429 4 HA HIS -5 HA HIS -5 149.655 22.225 30.077 5 HB2 HIS -5 HB2 HIS -5 147.306 23.703 28.873 6 HB3 HIS -5 HB3 HIS -5 148.984 24.164 28.665 7 HD1 HIS -5 HD1 HIS -5 146.423 21.684 27.550 8 HD2 HIS -5 HD2 HIS -5 150.463 22.470 26.887 9 HE1 HIS -5 HE1 HIS -5 147.104 20.289 25.551 10 H HIS -4 H HIS -4 150.431 24.383 30.717 11 HA HIS -4 HA HIS -4 148.922 25.468 33.030 12 HB2 HIS -4 HB2 HIS -4 151.904 25.261 32.602 13 HB3 HIS -4 HB3 HIS -4 151.144 26.100 33.940 14 HD1 HIS -4 HD1 HIS -4 151.959 22.692 32.647 15 HD2 HIS -4 HD2 HIS -4 150.014 24.371 35.929 16 HE1 HIS -4 HE1 HIS -4 151.640 20.822 34.322 17 H HIS -3 H HIS -3 148.669 27.647 33.178 18 HA HIS -3 HA HIS -3 149.836 29.309 31.016 19 HB2 HIS -3 HB2 HIS -3 147.431 28.870 30.659 20 HB3 HIS -3 HB3 HIS -3 147.084 29.541 32.241 21 HD1 HIS -3 HD1 HIS -3 148.834 30.683 29.041 22 HD2 HIS -3 HD2 HIS -3 146.421 32.206 32.080 23 HE1 HIS -3 HE1 HIS -3 148.371 33.098 28.443 24 H HIS -2 H HIS -2 150.774 31.171 31.627 25 HA HIS -2 HA HIS -2 150.418 32.084 34.422 26 HB2 HIS -2 HB2 HIS -2 152.575 30.881 34.104 27 HB3 HIS -2 HB3 HIS -2 153.008 32.048 32.869 28 HD1 HIS -2 HD1 HIS -2 153.767 34.382 33.650 29 HD2 HIS -2 HD2 HIS -2 152.654 31.872 36.787 30 HE1 HIS -2 HE1 HIS -2 154.532 35.516 35.779 31 H HIS -1 H HIS -1 150.547 34.315 34.753 32 HA HIS -1 HA HIS -1 150.262 35.939 32.293 33 HB2 HIS -1 HB2 HIS -1 149.194 36.423 35.076 34 HB3 HIS -1 HB3 HIS -1 148.989 37.502 33.710 35 HD1 HIS -1 HD1 HIS -1 147.682 36.300 31.581 36 HD2 HIS -1 HD2 HIS -1 147.147 34.610 35.354 37 HE1 HIS -1 HE1 HIS -1 145.602 34.866 31.435 38 H HIS 0 H HIS 0 151.501 37.718 32.005 39 HA HIS 0 HA HIS 0 153.498 38.352 34.105 40 HB2 HIS 0 HB2 HIS 0 153.758 38.489 31.099 41 HB3 HIS 0 HB3 HIS 0 154.957 39.081 32.232 42 HD1 HIS 0 HD1 HIS 0 153.605 35.969 30.694 43 HD2 HIS 0 HD2 HIS 0 156.413 37.005 33.595 44 HE1 HIS 0 HE1 HIS 0 154.963 33.883 31.151 45 H SER 1 H SER 1 153.874 40.488 34.577 46 HA SER 1 HA SER 1 152.055 42.460 33.309 47 HB2 SER 1 HB2 SER 1 153.100 42.410 36.151 48 HB3 SER 1 HB3 SER 1 152.047 43.639 35.458 49 HG SER 1 HG SER 1 150.580 42.289 36.116 50 H SER 2 H SER 2 152.860 44.505 32.861 51 HA SER 2 HA SER 2 155.723 44.987 33.327 52 HB2 SER 2 HB2 SER 2 156.117 45.576 31.015 53 HB3 SER 2 HB3 SER 2 155.449 43.948 31.067 54 HG SER 2 HG SER 2 154.083 44.846 29.741 55 H GLY 3 H GLY 3 156.327 47.255 32.886 56 HA2 GLY 3 HA2 GLY 3 154.284 49.042 33.907 57 HA3 GLY 3 HA3 GLY 3 155.973 49.443 33.609 58 H LEU 4 H LEU 4 154.533 51.396 32.824 59 HA LEU 4 HA LEU 4 153.629 51.016 30.061 60 HB2 LEU 4 HB2 LEU 4 153.458 53.402 31.917 61 HB3 LEU 4 HB3 LEU 4 152.825 53.361 30.271 62 HG LEU 4 HG LEU 4 151.599 51.181 31.117 63 HD11 LEU 4 HD11 LEU 4 152.410 50.873 33.287 64 HD12 LEU 4 HD12 LEU 4 150.908 51.746 33.589 65 HD13 LEU 4 HD13 LEU 4 152.448 52.604 33.625 66 HD21 LEU 4 HD21 LEU 4 150.666 53.507 30.450 67 HD22 LEU 4 HD22 LEU 4 150.573 53.813 32.184 68 HD23 LEU 4 HD23 LEU 4 149.657 52.484 31.472 69 H VAL 5 H VAL 5 154.588 51.959 28.309 70 HA VAL 5 HA VAL 5 157.077 53.496 28.773 71 HB VAL 5 HB VAL 5 158.065 52.335 26.827 72 HG11 VAL 5 HG11 VAL 5 158.328 51.529 29.224 73 HG12 VAL 5 HG12 VAL 5 158.599 50.303 27.986 74 HG13 VAL 5 HG13 VAL 5 157.076 50.336 28.874 75 HG21 VAL 5 HG21 VAL 5 155.650 50.510 27.024 76 HG22 VAL 5 HG22 VAL 5 156.977 50.387 25.869 77 HG23 VAL 5 HG23 VAL 5 155.852 51.742 25.779 78 HA PRO 6 HA PRO 6 155.566 56.471 25.904 79 HB2 PRO 6 HB2 PRO 6 158.002 56.289 24.218 80 HB3 PRO 6 HB3 PRO 6 157.330 57.681 25.089 81 HG2 PRO 6 HG2 PRO 6 159.535 56.435 25.918 82 HG3 PRO 6 HG3 PRO 6 158.360 57.123 27.054 83 HD2 PRO 6 HD2 PRO 6 158.790 54.254 26.304 84 HD3 PRO 6 HD3 PRO 6 158.355 54.956 27.879 85 H ARG 7 H ARG 7 155.254 56.902 23.448 86 HA ARG 7 HA ARG 7 153.900 54.709 22.307 87 HB2 ARG 7 HB2 ARG 7 154.940 57.190 20.914 88 HB3 ARG 7 HB3 ARG 7 153.677 56.113 20.319 89 HG2 ARG 7 HG2 ARG 7 153.510 57.644 22.929 90 HG3 ARG 7 HG3 ARG 7 152.789 58.189 21.416 91 HD2 ARG 7 HD2 ARG 7 151.494 56.045 21.324 92 HD3 ARG 7 HD3 ARG 7 152.130 55.640 22.915 93 HE ARG 7 HE ARG 7 150.990 58.185 23.100 94 HH11 ARG 7 HH11 ARG 7 149.897 54.905 22.482 95 HH12 ARG 7 HH12 ARG 7 148.320 55.202 23.136 96 HH21 ARG 7 HH21 ARG 7 148.944 58.506 23.930 97 HH22 ARG 7 HH22 ARG 7 147.789 57.215 23.945 98 H GLY 8 H GLY 8 154.405 53.367 20.570 99 HA2 GLY 8 HA2 GLY 8 157.057 53.463 19.380 100 HA3 GLY 8 HA3 GLY 8 156.752 52.071 20.415 101 H SER 9 H SER 9 157.276 51.192 18.099 102 HA SER 9 HA SER 9 154.724 50.833 16.631 103 HB2 SER 9 HB2 SER 9 156.487 52.016 15.332 104 HB3 SER 9 HB3 SER 9 157.544 50.624 15.548 105 HG SER 9 HG SER 9 155.769 49.452 14.560 106 H GLY 10 H GLY 10 154.115 48.770 16.066 107 HA2 GLY 10 HA2 GLY 10 155.835 46.493 16.427 108 HA3 GLY 10 HA3 GLY 10 154.627 46.638 17.703 109 H MET 11 H MET 11 154.193 44.437 16.552 110 HA MET 11 HA MET 11 152.471 44.780 14.195 111 HB2 MET 11 HB2 MET 11 154.280 42.996 14.291 112 HB3 MET 11 HB3 MET 11 153.286 42.182 15.501 113 HG2 MET 11 HG2 MET 11 151.378 42.229 13.861 114 HG3 MET 11 HG3 MET 11 152.501 42.848 12.651 115 HE1 MET 11 HE1 MET 11 155.239 41.251 13.509 116 HE2 MET 11 HE2 MET 11 154.597 41.815 11.969 117 HE3 MET 11 HE3 MET 11 155.078 40.130 12.152 118 H LYS 12 H LYS 12 150.308 44.500 14.254 119 HA LYS 12 HA LYS 12 149.060 44.221 16.879 120 HB2 LYS 12 HB2 LYS 12 147.848 44.815 14.168 121 HB3 LYS 12 HB3 LYS 12 146.997 44.877 15.713 122 HG2 LYS 12 HG2 LYS 12 148.719 46.572 16.479 123 HG3 LYS 12 HG3 LYS 12 149.299 46.627 14.815 124 HD2 LYS 12 HD2 LYS 12 146.441 47.192 15.655 125 HD3 LYS 12 HD3 LYS 12 147.648 48.432 15.316 126 HE2 LYS 12 HE2 LYS 12 147.934 47.291 13.028 127 HE3 LYS 12 HE3 LYS 12 146.436 46.437 13.399 128 HZ1 LYS 12 HZ1 LYS 12 146.536 48.830 12.223 129 HZ2 LYS 12 HZ2 LYS 12 146.380 49.298 13.849 130 HZ3 LYS 12 HZ3 LYS 12 145.216 48.285 13.139 131 H GLU 13 H GLU 13 147.572 42.628 17.416 132 HA GLU 13 HA GLU 13 147.776 40.169 15.815 133 HB2 GLU 13 HB2 GLU 13 148.369 40.117 18.247 134 HB3 GLU 13 HB3 GLU 13 146.691 40.518 18.618 135 HG2 GLU 13 HG2 GLU 13 145.963 38.496 17.360 136 HG3 GLU 13 HG3 GLU 13 147.651 38.078 17.098 137 H THR 14 H THR 14 146.023 39.167 14.943 138 HA THR 14 HA THR 14 143.388 40.489 15.274 139 HB THR 14 HB THR 14 142.917 39.980 12.936 140 HG1 THR 14 HG1 THR 14 144.123 38.242 12.534 141 HG21 THR 14 HG21 THR 14 144.240 41.670 11.971 142 HG22 THR 14 HG22 THR 14 145.644 41.260 12.958 143 HG23 THR 14 HG23 THR 14 144.258 42.069 13.689 144 H ALA 15 H ALA 15 141.545 39.057 14.779 145 HA ALA 15 HA ALA 15 141.637 36.685 16.290 146 HB1 ALA 15 HB1 ALA 15 139.387 36.246 15.341 147 HB2 ALA 15 HB2 ALA 15 139.631 37.567 14.199 148 HB3 ALA 15 HB3 ALA 15 139.552 37.901 15.929 149 H ALA 16 H ALA 16 141.625 34.513 15.698 150 HA ALA 16 HA ALA 16 143.316 33.752 13.590 151 HB1 ALA 16 HB1 ALA 16 142.330 31.435 14.032 152 HB2 ALA 16 HB2 ALA 16 141.333 32.212 15.261 153 HB3 ALA 16 HB3 ALA 16 143.090 32.240 15.404 154 H ALA 17 H ALA 17 142.928 32.824 11.581 155 HA ALA 17 HA ALA 17 140.796 33.864 10.077 156 HB1 ALA 17 HB1 ALA 17 142.769 33.242 8.907 157 HB2 ALA 17 HB2 ALA 17 141.526 32.111 8.374 158 HB3 ALA 17 HB3 ALA 17 142.730 31.605 9.560 159 H LYS 18 H LYS 18 138.926 32.926 9.241 160 HA LYS 18 HA LYS 18 137.563 31.144 10.976 161 HB2 LYS 18 HB2 LYS 18 135.718 31.323 9.427 162 HB3 LYS 18 HB3 LYS 18 136.459 32.908 9.617 163 HG2 LYS 18 HG2 LYS 18 137.753 32.504 7.512 164 HG3 LYS 18 HG3 LYS 18 136.870 30.992 7.304 165 HD2 LYS 18 HD2 LYS 18 134.730 32.369 7.442 166 HD3 LYS 18 HD3 LYS 18 135.749 33.801 7.298 167 HE2 LYS 18 HE2 LYS 18 136.728 32.736 5.198 168 HE3 LYS 18 HE3 LYS 18 135.419 31.559 5.296 169 HZ1 LYS 18 HZ1 LYS 18 133.836 33.142 4.875 170 HZ2 LYS 18 HZ2 LYS 18 135.118 33.718 3.921 171 HZ3 LYS 18 HZ3 LYS 18 134.795 34.426 5.430 172 H PHE 19 H PHE 19 136.873 29.024 10.664 173 HA PHE 19 HA PHE 19 138.170 27.510 8.488 174 HB2 PHE 19 HB2 PHE 19 138.836 25.771 10.039 175 HB3 PHE 19 HB3 PHE 19 139.560 27.299 10.503 176 HD1 PHE 19 HD2 PHE 19 138.710 28.533 12.491 177 HD2 PHE 19 HD1 PHE 19 137.263 24.626 11.443 178 HE1 PHE 19 HE2 PHE 19 137.756 28.277 14.766 179 HE2 PHE 19 HE1 PHE 19 136.308 24.370 13.718 180 HZ PHE 19 HZ PHE 19 136.556 26.195 15.379 181 H GLU 20 H GLU 20 137.229 25.307 8.258 182 HA GLU 20 HA GLU 20 134.320 25.467 8.597 183 HB2 GLU 20 HB2 GLU 20 136.029 23.583 6.955 184 HB3 GLU 20 HB3 GLU 20 134.265 23.603 6.973 185 HG2 GLU 20 HG2 GLU 20 136.030 25.933 6.169 186 HG3 GLU 20 HG3 GLU 20 135.182 24.873 5.051 187 H ARG 21 H ARG 21 133.107 23.780 9.507 188 HA ARG 21 HA ARG 21 134.627 21.845 11.156 189 HB2 ARG 21 HB2 ARG 21 133.724 23.722 12.523 190 HB3 ARG 21 HB3 ARG 21 132.105 23.319 11.961 191 HG2 ARG 21 HG2 ARG 21 132.298 22.235 14.059 192 HG3 ARG 21 HG3 ARG 21 132.560 20.954 12.878 193 HD2 ARG 21 HD2 ARG 21 135.016 21.260 13.125 194 HD3 ARG 21 HD3 ARG 21 134.720 22.490 14.351 195 HE ARG 21 HE ARG 21 133.485 19.908 14.861 196 HH11 ARG 21 HH11 ARG 21 136.294 21.935 15.425 197 HH12 ARG 21 HH12 ARG 21 136.773 21.050 16.835 198 HH21 ARG 21 HH21 ARG 21 134.150 18.807 16.682 199 HH22 ARG 21 HH22 ARG 21 135.573 19.301 17.536 200 H GLN 22 H GLN 22 133.821 19.792 11.244 201 HA GLN 22 HA GLN 22 131.516 19.210 9.484 202 HB2 GLN 22 HB2 GLN 22 133.835 17.467 10.347 203 HB3 GLN 22 HB3 GLN 22 132.484 16.924 9.350 204 HG2 GLN 22 HG2 GLN 22 133.043 18.574 7.636 205 HG3 GLN 22 HG3 GLN 22 134.342 19.211 8.640 206 HE21 GLN 22 HE21 GLN 22 134.846 18.167 6.019 207 HE22 GLN 22 HE22 GLN 22 135.769 16.752 6.179 208 H HIS 23 H HIS 23 129.904 17.802 10.175 209 HA HIS 23 HA HIS 23 129.892 17.145 13.065 210 HB2 HIS 23 HB2 HIS 23 127.577 18.108 11.379 211 HB3 HIS 23 HB3 HIS 23 127.470 17.584 13.049 212 HD1 HIS 23 HD1 HIS 23 129.077 19.086 14.743 213 HD2 HIS 23 HD2 HIS 23 127.976 20.812 11.112 214 HE1 HIS 23 HE1 HIS 23 129.433 21.579 14.999 215 H MET 24 H MET 24 128.903 15.215 13.652 216 HA MET 24 HA MET 24 128.290 13.361 11.418 217 HB2 MET 24 HB2 MET 24 129.561 12.802 14.109 218 HB3 MET 24 HB3 MET 24 129.071 11.559 12.956 219 HG2 MET 24 HG2 MET 24 130.568 12.594 11.255 220 HG3 MET 24 HG3 MET 24 131.110 13.750 12.470 221 HE1 MET 24 HE1 MET 24 134.192 11.467 12.113 222 HE2 MET 24 HE2 MET 24 133.609 13.124 12.243 223 HE3 MET 24 HE3 MET 24 133.086 12.116 10.896 224 H ASP 25 H ASP 25 126.616 11.849 11.743 225 HA ASP 25 HA ASP 25 124.368 12.839 13.175 226 HB2 ASP 25 HB2 ASP 25 124.868 10.132 11.916 227 HB3 ASP 25 HB3 ASP 25 123.307 10.692 12.512 228 H SER 26 H SER 26 123.418 12.148 15.066 229 HA SER 26 HA SER 26 125.081 10.404 16.791 230 HB2 SER 26 HB2 SER 26 123.255 12.715 17.475 231 HB3 SER 26 HB3 SER 26 123.920 11.612 18.676 232 HG SER 26 HG SER 26 125.152 13.558 18.161 233 HA PRO 27 HA PRO 27 121.788 7.497 17.130 234 HB2 PRO 27 HB2 PRO 27 121.906 7.566 20.096 235 HB3 PRO 27 HB3 PRO 27 122.158 6.207 18.984 236 HG2 PRO 27 HG2 PRO 27 124.179 7.346 20.295 237 HG3 PRO 27 HG3 PRO 27 124.365 6.712 18.649 238 HD2 PRO 27 HD2 PRO 27 124.108 9.559 19.547 239 HD3 PRO 27 HD3 PRO 27 125.086 8.874 18.229 240 H ASP 28 H ASP 28 119.666 7.074 18.524 241 HA ASP 28 HA ASP 28 117.989 9.340 18.160 242 HB2 ASP 28 HB2 ASP 28 117.498 6.737 19.625 243 HB3 ASP 28 HB3 ASP 28 116.254 7.923 19.239 244 H LEU 29 H LEU 29 116.963 10.653 19.674 245 HA LEU 29 HA LEU 29 118.424 10.946 22.200 246 HB2 LEU 29 HB2 LEU 29 118.018 12.892 20.637 247 HB3 LEU 29 HB3 LEU 29 116.309 12.774 21.048 248 HG LEU 29 HG LEU 29 118.319 12.903 23.273 249 HD11 LEU 29 HD11 LEU 29 117.265 15.325 21.783 250 HD12 LEU 29 HD12 LEU 29 118.923 14.733 21.690 251 HD13 LEU 29 HD13 LEU 29 118.290 15.344 23.219 252 HD21 LEU 29 HD21 LEU 29 116.145 12.616 24.092 253 HD22 LEU 29 HD22 LEU 29 115.428 13.593 22.811 254 HD23 LEU 29 HD23 LEU 29 116.307 14.370 24.127 255 H GLY 30 H GLY 30 117.601 10.330 24.095 256 HA2 GLY 30 HA2 GLY 30 114.812 10.421 24.718 257 HA3 GLY 30 HA3 GLY 30 115.350 8.769 24.425 258 H THR 31 H THR 31 114.535 8.832 26.807 259 HA THR 31 HA THR 31 116.383 9.926 28.738 260 HB THR 31 HB THR 31 114.138 7.940 29.159 261 HG1 THR 31 HG1 THR 31 113.631 10.036 28.230 262 HG21 THR 31 HG21 THR 31 115.726 9.749 30.991 263 HG22 THR 31 HG22 THR 31 115.591 7.993 31.066 264 HG23 THR 31 HG23 THR 31 114.200 9.002 31.465 265 H ASP 32 H ASP 32 117.995 8.896 29.803 266 HA ASP 32 HA ASP 32 119.098 6.519 28.698 267 HB2 ASP 32 HB2 ASP 32 119.720 7.969 31.281 268 HB3 ASP 32 HB3 ASP 32 120.693 6.669 30.600 269 H ASP 33 H ASP 33 119.169 4.434 29.496 270 HA ASP 33 HA ASP 33 117.708 3.799 31.945 271 HB2 ASP 33 HB2 ASP 33 116.323 2.102 30.806 272 HB3 ASP 33 HB3 ASP 33 115.959 3.733 30.258 273 H ASP 34 H ASP 34 117.829 1.368 32.367 274 HA ASP 34 HA ASP 34 120.561 0.592 32.352 275 HB2 ASP 34 HB2 ASP 34 118.064 -0.998 32.983 276 HB3 ASP 34 HB3 ASP 34 119.707 -1.541 33.306 277 H ASP 35 H ASP 35 121.634 -0.982 31.189 278 HA ASP 35 HA ASP 35 120.838 -1.371 28.494 279 HB2 ASP 35 HB2 ASP 35 122.952 -2.774 30.142 280 HB3 ASP 35 HB3 ASP 35 122.781 -2.919 28.395 281 H LYS 36 H LYS 36 120.054 -3.173 27.436 282 HA LYS 36 HA LYS 36 119.167 -5.443 29.096 283 HB2 LYS 36 HB2 LYS 36 116.983 -5.429 28.072 284 HB3 LYS 36 HB3 LYS 36 117.288 -3.844 28.773 285 HG2 LYS 36 HG2 LYS 36 117.985 -3.030 26.509 286 HG3 LYS 36 HG3 LYS 36 117.522 -4.597 25.844 287 HD2 LYS 36 HD2 LYS 36 115.223 -4.214 26.875 288 HD3 LYS 36 HD3 LYS 36 115.731 -2.550 27.167 289 HE2 LYS 36 HE2 LYS 36 115.964 -3.792 24.429 290 HE3 LYS 36 HE3 LYS 36 114.464 -3.037 24.966 291 HZ1 LYS 36 HZ1 LYS 36 117.134 -1.743 24.850 292 HZ2 LYS 36 HZ2 LYS 36 115.720 -1.012 25.443 293 HZ3 LYS 36 HZ3 LYS 36 115.831 -1.447 23.804 294 H THR 37 H THR 37 118.459 -7.321 27.723 295 HA THR 37 HA THR 37 120.531 -7.861 25.785 296 HB THR 37 HB THR 37 119.586 -10.108 25.705 297 HG1 THR 37 HG1 THR 37 117.686 -10.502 26.721 298 HG21 THR 37 HG21 THR 37 121.034 -9.571 27.608 299 HG22 THR 37 HG22 THR 37 119.759 -10.680 28.111 300 HG23 THR 37 HG23 THR 37 119.645 -8.966 28.512 301 H GLY 38 H GLY 38 120.007 -8.809 23.646 302 HA2 GLY 38 HA2 GLY 38 118.429 -7.027 22.113 303 HA3 GLY 38 HA3 GLY 38 119.137 -8.531 21.531 304 H GLY 39 H GLY 39 116.436 -7.275 21.133 305 HA2 GLY 39 HA2 GLY 39 114.894 -9.678 21.255 306 HA3 GLY 39 HA3 GLY 39 114.377 -8.527 22.485 307 H GLY 40 H GLY 40 112.381 -8.863 21.011 308 HA2 GLY 40 HA2 GLY 40 112.413 -7.352 18.531 309 HA3 GLY 40 HA3 GLY 40 111.022 -8.164 19.246 310 H ARG 41 H ARG 41 110.277 -5.895 18.341 311 HA ARG 41 HA ARG 41 110.214 -4.045 20.651 312 HB2 ARG 41 HB2 ARG 41 111.661 -3.166 18.817 313 HB3 ARG 41 HB3 ARG 41 110.268 -3.230 17.736 314 HG2 ARG 41 HG2 ARG 41 109.032 -1.717 19.270 315 HG3 ARG 41 HG3 ARG 41 110.465 -1.611 20.293 316 HD2 ARG 41 HD2 ARG 41 111.745 -0.734 18.336 317 HD3 ARG 41 HD3 ARG 41 110.253 -0.737 17.400 318 HE ARG 41 HE ARG 41 110.179 0.745 19.909 319 HH11 ARG 41 HH11 ARG 41 110.626 0.918 16.431 320 HH12 ARG 41 HH12 ARG 41 110.289 2.616 16.372 321 HH21 ARG 41 HH21 ARG 41 109.753 2.931 19.770 322 HH22 ARG 41 HH22 ARG 41 109.801 3.740 18.240 323 H ALA 42 H ALA 42 108.242 -3.145 21.122 324 HA ALA 42 HA ALA 42 105.904 -4.497 20.352 325 HB1 ALA 42 HB1 ALA 42 104.736 -2.943 21.666 326 HB2 ALA 42 HB2 ALA 42 105.882 -1.649 21.319 327 HB3 ALA 42 HB3 ALA 42 106.341 -2.965 22.398 328 H ASP 43 H ASP 43 104.255 -3.999 18.914 329 HA ASP 43 HA ASP 43 105.040 -2.794 16.481 330 HB2 ASP 43 HB2 ASP 43 103.148 -4.558 17.074 331 HB3 ASP 43 HB3 ASP 43 102.144 -3.113 17.148 332 HA PRO 44 HA PRO 44 103.785 1.373 17.514 333 HB2 PRO 44 HB2 PRO 44 104.045 2.584 15.124 334 HB3 PRO 44 HB3 PRO 44 105.454 1.941 15.991 335 HG2 PRO 44 HG2 PRO 44 104.057 0.878 13.621 336 HG3 PRO 44 HG3 PRO 44 105.758 0.742 14.091 337 HD2 PRO 44 HD2 PRO 44 103.735 -1.223 14.453 338 HD3 PRO 44 HD3 PRO 44 105.392 -1.264 15.091 339 H ALA 45 H ALA 45 102.378 3.225 16.230 340 HA ALA 45 HA ALA 45 99.684 2.381 16.343 341 HB1 ALA 45 HB1 ALA 45 100.372 4.718 16.713 342 HB2 ALA 45 HB2 ALA 45 99.160 4.606 15.438 343 HB3 ALA 45 HB3 ALA 45 100.857 4.842 15.022 344 H HIS 46 H HIS 46 98.180 1.968 14.723 345 HA HIS 46 HA HIS 46 99.327 1.356 12.057 346 HB2 HIS 46 HB2 HIS 46 98.643 -0.636 13.319 347 HB3 HIS 46 HB3 HIS 46 97.032 0.032 13.506 348 HD1 HIS 46 HD1 HIS 46 95.434 -0.147 11.508 349 HD2 HIS 46 HD2 HIS 46 99.260 -1.579 10.676 350 HE1 HIS 46 HE1 HIS 46 95.280 -1.352 9.288 351 H ARG 47 H ARG 47 98.633 2.641 10.503 352 HA ARG 47 HA ARG 47 95.838 3.607 10.570 353 HB2 ARG 47 HB2 ARG 47 98.292 5.202 9.790 354 HB3 ARG 47 HB3 ARG 47 96.625 5.747 9.599 355 HG2 ARG 47 HG2 ARG 47 96.289 5.478 12.054 356 HG3 ARG 47 HG3 ARG 47 97.993 5.051 12.214 357 HD2 ARG 47 HD2 ARG 47 98.563 7.256 11.130 358 HD3 ARG 47 HD3 ARG 47 96.857 7.680 11.233 359 HE ARG 47 HE ARG 47 97.112 8.003 13.517 360 HH11 ARG 47 HH11 ARG 47 99.963 6.358 12.296 361 HH12 ARG 47 HH12 ARG 47 100.830 6.547 13.784 362 HH21 ARG 47 HH21 ARG 47 98.278 8.216 15.406 363 HH22 ARG 47 HH22 ARG 47 99.888 7.585 15.522 364 H SER 48 H SER 48 94.818 3.751 8.564 365 HA SER 48 HA SER 48 95.694 1.961 6.554 366 HB2 SER 48 HB2 SER 48 93.716 4.163 6.029 367 HB3 SER 48 HB3 SER 48 93.735 2.518 5.402 368 HG SER 48 HG SER 48 93.003 3.439 7.904 369 HA PRO 49 HA PRO 49 98.561 4.302 4.142 370 HB2 PRO 49 HB2 PRO 49 96.893 3.721 1.732 371 HB3 PRO 49 HB3 PRO 49 98.628 3.457 1.993 372 HG2 PRO 49 HG2 PRO 49 96.903 1.439 2.031 373 HG3 PRO 49 HG3 PRO 49 98.300 1.488 3.123 374 HD2 PRO 49 HD2 PRO 49 95.420 1.955 3.741 375 HD3 PRO 49 HD3 PRO 49 96.703 1.285 4.771 376 H VAL 50 H VAL 50 98.692 6.477 3.952 377 HA VAL 50 HA VAL 50 96.226 7.994 3.636 378 HB VAL 50 HB VAL 50 99.039 8.959 4.212 379 HG11 VAL 50 HG11 VAL 50 97.932 11.044 4.884 380 HG12 VAL 50 HG12 VAL 50 96.360 10.361 4.472 381 HG13 VAL 50 HG13 VAL 50 97.546 10.671 3.204 382 HG21 VAL 50 HG21 VAL 50 97.984 7.451 5.953 383 HG22 VAL 50 HG22 VAL 50 96.695 8.645 6.108 384 HG23 VAL 50 HG23 VAL 50 98.353 9.079 6.524 385 HA PRO 51 HA PRO 51 96.952 8.680 -0.750 386 HB2 PRO 51 HB2 PRO 51 96.063 11.487 -0.277 387 HB3 PRO 51 HB3 PRO 51 95.471 10.298 -1.454 388 HG2 PRO 51 HG2 PRO 51 94.073 10.933 0.721 389 HG3 PRO 51 HG3 PRO 51 94.080 9.290 0.056 390 HD2 PRO 51 HD2 PRO 51 95.442 10.330 2.499 391 HD3 PRO 51 HD3 PRO 51 94.797 8.709 2.166 392 H LEU 52 H LEU 52 98.691 9.409 -1.945 393 HA LEU 52 HA LEU 52 100.931 10.469 -0.586 394 HB2 LEU 52 HB2 LEU 52 100.255 9.916 -3.450 395 HB3 LEU 52 HB3 LEU 52 101.676 10.895 -3.095 396 HG LEU 52 HG LEU 52 101.211 8.242 -1.733 397 HD11 LEU 52 HD11 LEU 52 102.931 7.456 -3.519 398 HD12 LEU 52 HD12 LEU 52 102.384 8.855 -4.443 399 HD13 LEU 52 HD13 LEU 52 101.239 7.587 -4.001 400 HD21 LEU 52 HD21 LEU 52 102.944 10.098 -1.029 401 HD22 LEU 52 HD22 LEU 52 103.846 9.522 -2.428 402 HD23 LEU 52 HD23 LEU 52 103.465 8.415 -1.110 403 HA PRO 53 HA PRO 53 100.201 14.867 -0.842 404 HB2 PRO 53 HB2 PRO 53 103.009 15.251 -1.728 405 HB3 PRO 53 HB3 PRO 53 102.173 15.910 -0.309 406 HG2 PRO 53 HG2 PRO 53 104.005 13.984 -0.099 407 HG3 PRO 53 HG3 PRO 53 102.591 14.063 0.969 408 HD2 PRO 53 HD2 PRO 53 103.092 12.240 -1.352 409 HD3 PRO 53 HD3 PRO 53 102.247 11.915 0.180 410 H SER 54 H SER 54 99.627 16.351 -2.427 411 HA SER 54 HA SER 54 99.147 15.396 -5.000 412 HB2 SER 54 HB2 SER 54 99.326 18.270 -4.061 413 HB3 SER 54 HB3 SER 54 98.607 17.742 -5.580 414 HG SER 54 HG SER 54 97.027 17.862 -4.035 415 HA PRO 55 HA PRO 55 103.065 15.638 -6.824 416 HB2 PRO 55 HB2 PRO 55 102.540 15.881 -9.485 417 HB3 PRO 55 HB3 PRO 55 102.228 14.392 -8.571 418 HG2 PRO 55 HG2 PRO 55 100.332 16.505 -9.444 419 HG3 PRO 55 HG3 PRO 55 100.116 14.748 -9.373 420 HD2 PRO 55 HD2 PRO 55 99.121 16.474 -7.477 421 HD3 PRO 55 HD3 PRO 55 99.512 14.771 -7.155 422 H THR 56 H THR 56 104.391 17.309 -6.502 423 HA THR 56 HA THR 56 103.906 19.855 -7.897 424 HB THR 56 HB THR 56 105.756 20.730 -6.569 425 HG1 THR 56 HG1 THR 56 107.127 19.153 -6.264 426 HG21 THR 56 HG21 THR 56 104.095 19.042 -4.694 427 HG22 THR 56 HG22 THR 56 103.416 20.421 -5.559 428 HG23 THR 56 HG23 THR 56 104.743 20.660 -4.422 429 H SER 57 H SER 57 105.758 20.735 -9.205 430 HA SER 57 HA SER 57 106.338 18.890 -11.224 431 HB2 SER 57 HB2 SER 57 106.335 21.349 -11.537 432 HB3 SER 57 HB3 SER 57 107.825 21.452 -10.607 433 HG SER 57 HG SER 57 108.785 20.898 -12.370 434 H ASN 58 H ASN 58 107.718 17.282 -11.327 435 HA ASN 58 HA ASN 58 109.648 16.076 -11.233 436 HB2 ASN 58 HB2 ASN 58 110.896 18.684 -10.360 437 HB3 ASN 58 HB3 ASN 58 111.755 17.267 -10.962 438 HD21 ASN 58 HD21 ASN 58 110.109 16.517 -13.133 439 HD22 ASN 58 HD22 ASN 58 110.116 17.759 -14.290 440 H LYS 59 H LYS 59 108.025 16.801 -8.557 441 HA LYS 59 HA LYS 59 109.954 15.455 -6.816 442 HB2 LYS 59 HB2 LYS 59 108.817 18.188 -6.197 443 HB3 LYS 59 HB3 LYS 59 109.674 17.174 -5.037 444 HG2 LYS 59 HG2 LYS 59 111.639 17.151 -6.572 445 HG3 LYS 59 HG3 LYS 59 110.788 18.277 -7.632 446 HD2 LYS 59 HD2 LYS 59 110.600 19.870 -5.716 447 HD3 LYS 59 HD3 LYS 59 111.581 18.769 -4.748 448 HE2 LYS 59 HE2 LYS 59 113.303 18.925 -6.672 449 HE3 LYS 59 HE3 LYS 59 112.389 20.340 -7.193 450 HZ1 LYS 59 HZ1 LYS 59 113.745 19.922 -4.589 451 HZ2 LYS 59 HZ2 LYS 59 112.655 21.194 -4.879 452 HZ3 LYS 59 HZ3 LYS 59 114.100 21.092 -5.766 453 H GLN 60 H GLN 60 109.051 14.314 -5.142 454 HA GLN 60 HA GLN 60 106.399 15.030 -4.167 455 HB2 GLN 60 HB2 GLN 60 107.027 12.308 -5.298 456 HB3 GLN 60 HB3 GLN 60 105.753 12.558 -4.105 457 HG2 GLN 60 HG2 GLN 60 104.784 14.312 -5.646 458 HG3 GLN 60 HG3 GLN 60 105.959 13.792 -6.855 459 HE21 GLN 60 HE21 GLN 60 102.923 12.934 -5.282 460 HE22 GLN 60 HE22 GLN 60 102.662 11.517 -6.180 461 H ASP 61 H ASP 61 106.060 14.484 -2.019 462 HA ASP 61 HA ASP 61 108.393 13.413 -0.579 463 HB2 ASP 61 HB2 ASP 61 105.880 14.757 0.451 464 HB3 ASP 61 HB3 ASP 61 107.245 14.247 1.440 465 H ILE 62 H ILE 62 108.380 11.350 0.175 466 HA ILE 62 HA ILE 62 105.763 10.000 0.484 467 HB ILE 62 HB ILE 62 106.738 9.372 -1.686 468 HG12 ILE 62 HG12 ILE 62 107.093 6.973 0.080 469 HG13 ILE 62 HG13 ILE 62 105.519 7.756 0.022 470 HG21 ILE 62 HG21 ILE 62 108.848 8.323 -1.896 471 HG22 ILE 62 HG22 ILE 62 108.984 8.058 -0.158 472 HG23 ILE 62 HG23 ILE 62 109.142 9.687 -0.817 473 HD11 ILE 62 HD11 ILE 62 106.363 5.830 -1.735 474 HD12 ILE 62 HD12 ILE 62 106.718 7.297 -2.644 475 HD13 ILE 62 HD13 ILE 62 105.080 6.991 -2.061 476 H SER 63 H SER 63 105.747 8.196 1.937 477 HA SER 63 HA SER 63 108.034 7.923 3.722 478 HB2 SER 63 HB2 SER 63 106.867 8.629 5.709 479 HB3 SER 63 HB3 SER 63 106.787 9.933 4.529 480 HG SER 63 HG SER 63 104.798 8.953 5.679 481 H GLU 64 H GLU 64 107.624 6.335 5.459 482 HA GLU 64 HA GLU 64 106.650 3.915 4.516 483 HB2 GLU 64 HB2 GLU 64 106.782 3.151 6.861 484 HB3 GLU 64 HB3 GLU 64 108.206 4.076 6.390 485 HG2 GLU 64 HG2 GLU 64 107.192 6.102 7.407 486 HG3 GLU 64 HG3 GLU 64 105.841 5.122 7.963 487 H ALA 65 H ALA 65 104.961 6.463 6.300 488 HA ALA 65 HA ALA 65 102.701 4.997 7.091 489 HB1 ALA 65 HB1 ALA 65 101.561 7.310 6.935 490 HB2 ALA 65 HB2 ALA 65 103.158 7.910 6.487 491 HB3 ALA 65 HB3 ALA 65 102.916 7.132 8.051 492 H ASN 66 H ASN 66 103.428 6.689 4.064 493 HA ASN 66 HA ASN 66 100.849 6.423 2.917 494 HB2 ASN 66 HB2 ASN 66 103.519 6.656 1.508 495 HB3 ASN 66 HB3 ASN 66 101.934 6.991 0.814 496 HD21 ASN 66 HD21 ASN 66 100.667 8.804 1.917 497 HD22 ASN 66 HD22 ASN 66 101.545 10.094 2.583 498 H LEU 67 H LEU 67 103.803 4.470 2.622 499 HA LEU 67 HA LEU 67 102.508 2.660 0.766 500 HB2 LEU 67 HB2 LEU 67 105.266 3.064 1.810 501 HB3 LEU 67 HB3 LEU 67 104.864 1.468 1.186 502 HG LEU 67 HG LEU 67 104.153 2.460 -0.948 503 HD11 LEU 67 HD11 LEU 67 105.049 5.095 0.265 504 HD12 LEU 67 HD12 LEU 67 103.378 4.653 -0.098 505 HD13 LEU 67 HD13 LEU 67 104.541 4.845 -1.405 506 HD21 LEU 67 HD21 LEU 67 106.824 3.698 -0.342 507 HD22 LEU 67 HD22 LEU 67 106.309 2.814 -1.778 508 HD23 LEU 67 HD23 LEU 67 106.635 1.945 -0.279 509 H ALA 68 H ALA 68 102.800 2.726 4.193 510 HA ALA 68 HA ALA 68 102.166 1.222 5.799 511 HB1 ALA 68 HB1 ALA 68 101.040 -0.517 3.599 512 HB2 ALA 68 HB2 ALA 68 100.224 0.954 4.131 513 HB3 ALA 68 HB3 ALA 68 100.488 -0.367 5.268 514 H TYR 69 H TYR 69 102.142 -1.804 5.229 515 HA TYR 69 HA TYR 69 104.762 -2.337 6.053 516 HB2 TYR 69 HB2 TYR 69 102.786 -4.146 4.669 517 HB3 TYR 69 HB3 TYR 69 104.254 -4.689 5.459 518 HD1 TYR 69 HD1 TYR 69 104.506 -4.369 7.950 519 HD2 TYR 69 HD2 TYR 69 100.802 -3.683 5.888 520 HE1 TYR 69 HE1 TYR 69 103.284 -4.503 10.104 521 HE2 TYR 69 HE2 TYR 69 99.578 -3.816 8.041 522 HH TYR 69 HH TYR 69 101.139 -3.783 11.024 523 H LEU 70 H LEU 70 103.573 -1.726 2.866 524 HA LEU 70 HA LEU 70 105.386 -3.184 1.289 525 HB2 LEU 70 HB2 LEU 70 104.158 -0.480 0.713 526 HB3 LEU 70 HB3 LEU 70 104.869 -1.569 -0.477 527 HG LEU 70 HG LEU 70 102.506 -2.262 1.293 528 HD11 LEU 70 HD11 LEU 70 102.683 -1.385 -1.603 529 HD12 LEU 70 HD12 LEU 70 101.824 -0.573 -0.295 530 HD13 LEU 70 HD13 LEU 70 101.249 -2.129 -0.895 531 HD21 LEU 70 HD21 LEU 70 102.344 -4.082 -0.573 532 HD22 LEU 70 HD22 LEU 70 103.535 -4.298 0.710 533 HD23 LEU 70 HD23 LEU 70 104.039 -3.696 -0.870 534 H TRP 71 H TRP 71 105.937 -0.378 3.252 535 HA TRP 71 HA TRP 71 107.940 0.956 1.875 536 HB2 TRP 71 HB2 TRP 71 106.756 1.581 4.037 537 HB3 TRP 71 HB3 TRP 71 107.919 0.554 4.852 538 HD1 TRP 71 HD1 TRP 71 109.877 1.831 5.780 539 HE1 TRP 71 HE1 TRP 71 111.121 4.005 5.191 540 HE3 TRP 71 HE3 TRP 71 107.329 3.191 1.572 541 HZ2 TRP 71 HZ2 TRP 71 111.068 6.049 3.176 542 HZ3 TRP 71 HZ3 TRP 71 107.946 5.245 0.338 543 HH2 TRP 71 HH2 TRP 71 109.808 6.675 1.130 544 HA PRO 72 HA PRO 72 110.908 -2.469 2.423 545 HB2 PRO 72 HB2 PRO 72 112.540 -2.002 0.349 546 HB3 PRO 72 HB3 PRO 72 110.881 -2.583 0.102 547 HG2 PRO 72 HG2 PRO 72 112.006 0.125 -0.285 548 HG3 PRO 72 HG3 PRO 72 110.717 -0.707 -1.173 549 HD2 PRO 72 HD2 PRO 72 110.372 1.202 0.886 550 HD3 PRO 72 HD3 PRO 72 109.113 0.171 0.176 551 H LEU 73 H LEU 73 111.613 0.891 2.713 552 HA LEU 73 HA LEU 73 114.475 0.468 3.175 553 HB2 LEU 73 HB2 LEU 73 112.866 3.028 3.267 554 HB3 LEU 73 HB3 LEU 73 114.622 2.892 3.293 555 HG LEU 73 HG LEU 73 112.843 1.954 1.024 556 HD11 LEU 73 HD11 LEU 73 112.958 4.434 1.343 557 HD12 LEU 73 HD12 LEU 73 113.690 3.899 -0.177 558 HD13 LEU 73 HD13 LEU 73 114.713 4.334 1.192 559 HD21 LEU 73 HD21 LEU 73 115.061 1.814 -0.172 560 HD22 LEU 73 HD22 LEU 73 114.883 0.639 1.127 561 HD23 LEU 73 HD23 LEU 73 115.857 2.088 1.378 562 H THR 74 H THR 74 115.509 0.762 5.075 563 HA THR 74 HA THR 74 114.115 0.474 7.533 564 HB THR 74 HB THR 74 116.317 0.747 8.571 565 HG1 THR 74 HG1 THR 74 118.011 1.100 6.939 566 HG21 THR 74 HG21 THR 74 117.520 -1.042 7.289 567 HG22 THR 74 HG22 THR 74 116.309 -0.883 6.018 568 HG23 THR 74 HG23 THR 74 115.833 -1.432 7.625 569 H VAL 75 H VAL 75 115.571 3.258 5.854 570 HA VAL 75 HA VAL 75 115.084 5.140 7.929 571 HB VAL 75 HB VAL 75 115.172 6.852 6.103 572 HG11 VAL 75 HG11 VAL 75 117.311 4.720 6.267 573 HG12 VAL 75 HG12 VAL 75 117.240 6.250 7.141 574 HG13 VAL 75 HG13 VAL 75 117.544 6.240 5.404 575 HG21 VAL 75 HG21 VAL 75 115.722 6.124 3.830 576 HG22 VAL 75 HG22 VAL 75 114.167 5.449 4.306 577 HG23 VAL 75 HG23 VAL 75 115.609 4.435 4.317 578 H ASP 76 H ASP 76 113.227 6.212 8.495 579 HA ASP 76 HA ASP 76 110.870 4.765 7.910 580 HB2 ASP 76 HB2 ASP 76 109.734 6.365 9.364 581 HB3 ASP 76 HB3 ASP 76 111.267 5.873 10.079 582 H HIS 77 H HIS 77 112.128 7.782 6.573 583 HA HIS 77 HA HIS 77 110.180 7.489 4.445 584 HB2 HIS 77 HB2 HIS 77 109.311 9.747 4.572 585 HB3 HIS 77 HB3 HIS 77 108.933 8.853 6.028 586 HD1 HIS 77 HD1 HIS 77 110.075 9.626 8.231 587 HD2 HIS 77 HD2 HIS 77 111.010 11.983 4.923 588 HE1 HIS 77 HE1 HIS 77 111.140 11.737 9.135 589 H GLY 78 H GLY 78 110.517 9.409 2.838 590 HA2 GLY 78 HA2 GLY 78 113.063 10.684 2.759 591 HA3 GLY 78 HA3 GLY 78 113.033 9.253 1.733 592 H THR 79 H THR 79 113.367 11.822 0.706 593 HA THR 79 HA THR 79 110.788 12.365 -0.642 594 HB THR 79 HB THR 79 113.194 14.179 -0.722 595 HG1 THR 79 HG1 THR 79 112.719 13.922 1.415 596 HG21 THR 79 HG21 THR 79 110.221 14.350 -1.202 597 HG22 THR 79 HG22 THR 79 111.543 14.865 -2.254 598 HG23 THR 79 HG23 THR 79 111.143 15.806 -0.816 599 H ILE 80 H ILE 80 110.673 12.289 -2.870 600 HA ILE 80 HA ILE 80 113.032 11.129 -4.234 601 HB ILE 80 HB ILE 80 111.401 10.213 -5.855 602 HG12 ILE 80 HG12 ILE 80 109.322 11.252 -3.899 603 HG13 ILE 80 HG13 ILE 80 109.635 11.948 -5.488 604 HG21 ILE 80 HG21 ILE 80 110.493 8.498 -4.335 605 HG22 ILE 80 HG22 ILE 80 110.831 9.541 -2.952 606 HG23 ILE 80 HG23 ILE 80 112.160 8.892 -3.914 607 HD11 ILE 80 HD11 ILE 80 107.876 10.515 -5.981 608 HD12 ILE 80 HD12 ILE 80 108.392 9.313 -4.792 609 HD13 ILE 80 HD13 ILE 80 109.264 9.475 -6.317 610 H GLU 81 H GLU 81 113.833 12.076 -6.039 611 HA GLU 81 HA GLU 81 112.472 14.478 -7.066 612 HB2 GLU 81 HB2 GLU 81 114.045 15.171 -5.269 613 HB3 GLU 81 HB3 GLU 81 115.363 14.428 -6.173 614 HG2 GLU 81 HG2 GLU 81 114.846 15.923 -8.096 615 HG3 GLU 81 HG3 GLU 81 113.606 16.705 -7.129 616 H CYS 82 H CYS 82 112.683 14.819 -9.161 617 HA CYS 82 HA CYS 82 114.668 13.254 -10.696 618 HB2 CYS 82 HB2 CYS 82 111.958 14.356 -11.327 619 HB3 CYS 82 HB3 CYS 82 113.137 14.234 -12.633 620 H LEU 83 H LEU 83 116.437 14.356 -11.302 621 HA LEU 83 HA LEU 83 116.471 17.254 -10.968 622 HB2 LEU 83 HB2 LEU 83 118.675 15.291 -11.635 623 HB3 LEU 83 HB3 LEU 83 118.910 17.012 -11.333 624 HG LEU 83 HG LEU 83 117.467 15.315 -9.312 625 HD11 LEU 83 HD11 LEU 83 120.471 15.690 -9.508 626 HD12 LEU 83 HD12 LEU 83 119.615 14.178 -9.810 627 HD13 LEU 83 HD13 LEU 83 119.611 14.885 -8.194 628 HD21 LEU 83 HD21 LEU 83 117.371 17.688 -8.934 629 HD22 LEU 83 HD22 LEU 83 119.093 17.871 -9.274 630 HD23 LEU 83 HD23 LEU 83 118.567 17.046 -7.807 631 HA PRO 84 HA PRO 84 116.282 18.498 -15.265 632 HB2 PRO 84 HB2 PRO 84 118.948 19.782 -14.845 633 HB3 PRO 84 HB3 PRO 84 117.465 20.460 -15.546 634 HG2 PRO 84 HG2 PRO 84 118.239 21.082 -13.082 635 HG3 PRO 84 HG3 PRO 84 116.527 20.889 -13.499 636 HD2 PRO 84 HD2 PRO 84 118.289 19.075 -11.926 637 HD3 PRO 84 HD3 PRO 84 116.533 19.325 -11.812 638 H SER 85 H SER 85 119.029 16.838 -13.954 639 HA SER 85 HA SER 85 120.344 16.243 -16.437 640 HB2 SER 85 HB2 SER 85 121.816 14.898 -15.124 641 HB3 SER 85 HB3 SER 85 121.450 16.337 -14.180 642 HG SER 85 HG SER 85 120.237 13.833 -13.942 643 H ASP 86 H ASP 86 117.417 15.207 -15.460 644 HA ASP 86 HA ASP 86 116.087 13.421 -15.687 645 HB2 ASP 86 HB2 ASP 86 116.171 12.172 -17.724 646 HB3 ASP 86 HB3 ASP 86 116.536 13.853 -18.067 647 H ASN 87 H ASN 87 118.255 13.176 -13.856 648 HA ASN 87 HA ASN 87 118.523 10.231 -13.785 649 HB2 ASN 87 HB2 ASN 87 119.982 12.331 -12.157 650 HB3 ASN 87 HB3 ASN 87 120.274 10.593 -12.117 651 HD21 ASN 87 HD21 ASN 87 120.208 9.986 -14.887 652 HD22 ASN 87 HD22 ASN 87 121.493 10.787 -15.655 653 H ALA 88 H ALA 88 117.422 9.123 -12.259 654 HA ALA 88 HA ALA 88 115.688 10.659 -10.450 655 HB1 ALA 88 HB1 ALA 88 114.791 8.210 -10.069 656 HB2 ALA 88 HB2 ALA 88 115.635 7.886 -11.583 657 HB3 ALA 88 HB3 ALA 88 114.354 9.097 -11.530 658 H VAL 89 H VAL 89 116.198 10.863 -8.360 659 HA VAL 89 HA VAL 89 117.904 8.795 -7.108 660 HB VAL 89 HB VAL 89 119.119 10.581 -5.901 661 HG11 VAL 89 HG11 VAL 89 120.278 9.759 -7.784 662 HG12 VAL 89 HG12 VAL 89 120.288 11.507 -8.018 663 HG13 VAL 89 HG13 VAL 89 119.148 10.505 -8.916 664 HG21 VAL 89 HG21 VAL 89 117.502 12.373 -7.739 665 HG22 VAL 89 HG22 VAL 89 118.921 12.913 -6.840 666 HG23 VAL 89 HG23 VAL 89 117.483 12.368 -5.975 667 H PHE 90 H PHE 90 117.804 8.740 -4.823 668 HA PHE 90 HA PHE 90 115.234 9.660 -3.685 669 HB2 PHE 90 HB2 PHE 90 115.404 7.236 -3.912 670 HB3 PHE 90 HB3 PHE 90 116.944 7.244 -3.083 671 HD1 PHE 90 HD1 PHE 90 113.315 8.031 -2.611 672 HD2 PHE 90 HD2 PHE 90 117.041 6.947 -0.767 673 HE1 PHE 90 HE1 PHE 90 112.142 7.664 -0.446 674 HE2 PHE 90 HE2 PHE 90 115.869 6.568 1.384 675 HZ PHE 90 HZ PHE 90 113.419 6.927 1.541 676 H VAL 91 H VAL 91 115.399 11.090 -2.040 677 HA VAL 91 HA VAL 91 118.018 11.437 -0.716 678 HB VAL 91 HB VAL 91 115.634 13.306 -0.829 679 HG11 VAL 91 HG11 VAL 91 118.406 14.177 -0.083 680 HG12 VAL 91 HG12 VAL 91 117.425 13.386 1.145 681 HG13 VAL 91 HG13 VAL 91 116.848 14.858 0.376 682 HG21 VAL 91 HG21 VAL 91 117.071 14.640 -2.356 683 HG22 VAL 91 HG22 VAL 91 116.676 13.058 -3.028 684 HG23 VAL 91 HG23 VAL 91 118.269 13.345 -2.328 685 H ALA 92 H ALA 92 118.215 10.863 1.375 686 HA ALA 92 HA ALA 92 115.757 10.096 2.834 687 HB1 ALA 92 HB1 ALA 92 118.677 9.417 3.161 688 HB2 ALA 92 HB2 ALA 92 117.313 8.327 2.906 689 HB3 ALA 92 HB3 ALA 92 117.522 9.133 4.462 690 HA PRO 93 HA PRO 93 115.717 13.546 5.595 691 HB2 PRO 93 HB2 PRO 93 115.998 11.668 7.897 692 HB3 PRO 93 HB3 PRO 93 114.786 12.929 7.608 693 HG2 PRO 93 HG2 PRO 93 114.262 10.317 7.298 694 HG3 PRO 93 HG3 PRO 93 113.485 11.578 6.329 695 HD2 PRO 93 HD2 PRO 93 115.526 9.601 5.509 696 HD3 PRO 93 HD3 PRO 93 114.353 10.497 4.526 697 H ASP 94 H ASP 94 118.211 11.123 5.963 698 HA ASP 94 HA ASP 94 119.849 12.488 7.821 699 HB2 ASP 94 HB2 ASP 94 121.644 10.970 6.955 700 HB3 ASP 94 HB3 ASP 94 120.181 10.153 7.483 701 H GLY 95 H GLY 95 119.201 13.258 4.553 702 HA2 GLY 95 HA2 GLY 95 120.010 15.164 3.424 703 HA3 GLY 95 HA3 GLY 95 121.366 15.226 4.544 704 H THR 96 H THR 96 120.897 12.085 3.350 705 HA THR 96 HA THR 96 123.213 12.357 1.562 706 HB THR 96 HB THR 96 121.895 9.881 2.711 707 HG1 THR 96 HG1 THR 96 123.415 10.020 4.227 708 HG21 THR 96 HG21 THR 96 124.270 10.385 0.955 709 HG22 THR 96 HG22 THR 96 123.083 9.082 0.891 710 HG23 THR 96 HG23 THR 96 124.347 9.063 2.120 711 H THR 97 H THR 97 123.054 11.859 -0.594 712 HA THR 97 HA THR 97 120.347 11.236 -1.606 713 HB THR 97 HB THR 97 122.741 12.326 -3.113 714 HG1 THR 97 HG1 THR 97 122.051 13.881 -1.774 715 HG21 THR 97 HG21 THR 97 121.186 11.185 -4.574 716 HG22 THR 97 HG22 THR 97 120.948 12.921 -4.773 717 HG23 THR 97 HG23 THR 97 119.813 11.979 -3.806 718 H TYR 98 H TYR 98 119.961 9.343 -2.472 719 HA TYR 98 HA TYR 98 122.203 7.551 -3.169 720 HB2 TYR 98 HB2 TYR 98 119.375 6.864 -2.360 721 HB3 TYR 98 HB3 TYR 98 120.642 5.712 -2.723 722 HD1 TYR 98 HD1 TYR 98 119.304 8.091 -0.262 723 HD2 TYR 98 HD2 TYR 98 122.449 5.289 -1.107 724 HE1 TYR 98 HE1 TYR 98 119.950 8.096 2.130 725 HE2 TYR 98 HE2 TYR 98 123.084 5.283 1.291 726 HH TYR 98 HH TYR 98 121.511 7.387 3.609 727 H ALA 99 H ALA 99 121.989 6.348 -5.123 728 HA ALA 99 HA ALA 99 120.385 7.695 -7.145 729 HB1 ALA 99 HB1 ALA 99 122.691 5.802 -7.132 730 HB2 ALA 99 HB2 ALA 99 122.466 7.291 -8.047 731 HB3 ALA 99 HB3 ALA 99 121.655 5.812 -8.558 732 H LEU 100 H LEU 100 118.522 6.947 -7.966 733 HA LEU 100 HA LEU 100 117.476 4.405 -6.982 734 HB2 LEU 100 HB2 LEU 100 116.270 6.700 -8.526 735 HB3 LEU 100 HB3 LEU 100 115.420 5.177 -8.297 736 HG LEU 100 HG LEU 100 116.578 6.649 -5.939 737 HD11 LEU 100 HD11 LEU 100 115.129 8.234 -7.175 738 HD12 LEU 100 HD12 LEU 100 114.369 7.732 -5.665 739 HD13 LEU 100 HD13 LEU 100 113.841 7.032 -7.193 740 HD21 LEU 100 HD21 LEU 100 114.871 5.386 -4.744 741 HD22 LEU 100 HD22 LEU 100 115.772 4.267 -5.766 742 HD23 LEU 100 HD23 LEU 100 114.173 4.821 -6.263 743 H ASN 101 H ASN 101 118.019 6.037 -10.101 744 HA ASN 101 HA ASN 101 117.618 3.432 -11.450 745 HB2 ASN 101 HB2 ASN 101 117.098 4.639 -13.441 746 HB3 ASN 101 HB3 ASN 101 116.170 5.337 -12.120 747 HD21 ASN 101 HD21 ASN 101 116.312 7.062 -14.115 748 HD22 ASN 101 HD22 ASN 101 117.512 8.243 -13.898 749 H ASP 102 H ASP 102 118.867 3.166 -13.522 750 HA ASP 102 HA ASP 102 121.499 2.638 -12.794 751 HB2 ASP 102 HB2 ASP 102 120.186 1.543 -14.637 752 HB3 ASP 102 HB3 ASP 102 120.507 2.965 -15.626 753 H ARG 103 H ARG 103 120.201 5.420 -14.590 754 HA ARG 103 HA ARG 103 122.701 6.373 -15.501 755 HB2 ARG 103 HB2 ARG 103 120.075 7.798 -15.052 756 HB3 ARG 103 HB3 ARG 103 121.475 8.534 -15.838 757 HG2 ARG 103 HG2 ARG 103 121.495 6.649 -17.477 758 HG3 ARG 103 HG3 ARG 103 120.016 6.035 -16.743 759 HD2 ARG 103 HD2 ARG 103 120.353 8.747 -18.052 760 HD3 ARG 103 HD3 ARG 103 119.500 7.369 -18.739 761 HE ARG 103 HE ARG 103 118.494 9.193 -16.769 762 HH11 ARG 103 HH11 ARG 103 118.270 5.853 -17.824 763 HH12 ARG 103 HH12 ARG 103 116.668 5.663 -17.195 764 HH21 ARG 103 HH21 ARG 103 116.461 8.902 -15.998 765 HH22 ARG 103 HH22 ARG 103 115.646 7.380 -16.164 766 H ALA 104 H ALA 104 120.819 7.150 -12.581 767 HA ALA 104 HA ALA 104 122.559 9.087 -11.533 768 HB1 ALA 104 HB1 ALA 104 121.516 8.604 -9.379 769 HB2 ALA 104 HB2 ALA 104 120.862 7.094 -10.016 770 HB3 ALA 104 HB3 ALA 104 120.296 8.637 -10.651 771 H GLU 105 H GLU 105 122.623 5.545 -11.296 772 HA GLU 105 HA GLU 105 124.795 5.337 -9.510 773 HB2 GLU 105 HB2 GLU 105 123.970 3.474 -11.751 774 HB3 GLU 105 HB3 GLU 105 125.114 3.074 -10.470 775 HG2 GLU 105 HG2 GLU 105 122.229 3.896 -10.037 776 HG3 GLU 105 HG3 GLU 105 122.831 2.244 -9.966 777 H LYS 106 H LYS 106 124.698 5.581 -13.053 778 HA LYS 106 HA LYS 106 127.450 5.377 -13.553 779 HB2 LYS 106 HB2 LYS 106 125.337 6.978 -15.011 780 HB3 LYS 106 HB3 LYS 106 126.961 6.668 -15.626 781 HG2 LYS 106 HG2 LYS 106 126.523 4.219 -15.442 782 HG3 LYS 106 HG3 LYS 106 124.868 4.582 -14.950 783 HD2 LYS 106 HD2 LYS 106 124.549 5.836 -17.086 784 HD3 LYS 106 HD3 LYS 106 126.162 5.327 -17.588 785 HE2 LYS 106 HE2 LYS 106 125.313 2.918 -17.087 786 HE3 LYS 106 HE3 LYS 106 123.705 3.638 -17.169 787 HZ1 LYS 106 HZ1 LYS 106 123.902 4.071 -19.373 788 HZ2 LYS 106 HZ2 LYS 106 124.919 2.711 -19.296 789 HZ3 LYS 106 HZ3 LYS 106 125.585 4.274 -19.312 790 H ALA 107 H ALA 107 125.516 8.117 -12.496 791 HA ALA 107 HA ALA 107 127.548 10.097 -12.771 792 HB1 ALA 107 HB1 ALA 107 126.006 11.287 -11.030 793 HB2 ALA 107 HB2 ALA 107 124.916 9.940 -11.355 794 HB3 ALA 107 HB3 ALA 107 125.420 11.002 -12.668 795 H GLY 108 H GLY 108 127.618 7.489 -10.755 796 HA2 GLY 108 HA2 GLY 108 129.000 6.974 -9.022 797 HA3 GLY 108 HA3 GLY 108 129.643 8.603 -9.096 798 H HIS 109 H HIS 109 126.189 8.196 -8.638 799 HA HIS 109 HA HIS 109 126.378 9.171 -5.918 800 HB2 HIS 109 HB2 HIS 109 124.147 8.526 -7.806 801 HB3 HIS 109 HB3 HIS 109 123.804 8.678 -6.093 802 HD1 HIS 109 HD1 HIS 109 125.287 11.084 -5.210 803 HD2 HIS 109 HD2 HIS 109 123.501 10.916 -8.973 804 HE1 HIS 109 HE1 HIS 109 124.955 13.481 -5.952 805 HA PRO 110 HA PRO 110 126.559 5.089 -4.217 806 HB2 PRO 110 HB2 PRO 110 125.572 5.448 -1.695 807 HB3 PRO 110 HB3 PRO 110 127.180 6.008 -2.196 808 HG2 PRO 110 HG2 PRO 110 124.656 7.543 -1.886 809 HG3 PRO 110 HG3 PRO 110 126.321 8.011 -1.498 810 HD2 PRO 110 HD2 PRO 110 125.014 8.843 -3.764 811 HD3 PRO 110 HD3 PRO 110 126.781 8.688 -3.648 812 HA PRO 111 HA PRO 111 122.402 3.541 -4.818 813 HB2 PRO 111 HB2 PRO 111 122.684 0.928 -4.103 814 HB3 PRO 111 HB3 PRO 111 123.336 1.596 -5.612 815 HG2 PRO 111 HG2 PRO 111 124.731 0.887 -3.107 816 HG3 PRO 111 HG3 PRO 111 125.301 0.825 -4.780 817 HD2 PRO 111 HD2 PRO 111 125.931 2.822 -2.932 818 HD3 PRO 111 HD3 PRO 111 126.124 2.946 -4.692 819 H ILE 112 H ILE 112 120.489 2.891 -3.707 820 HA ILE 112 HA ILE 112 120.297 3.718 -1.018 821 HB ILE 112 HB ILE 112 118.355 2.101 -2.691 822 HG12 ILE 112 HG12 ILE 112 118.428 5.041 -1.969 823 HG13 ILE 112 HG13 ILE 112 118.987 4.391 -3.510 824 HG21 ILE 112 HG21 ILE 112 116.647 2.865 -1.052 825 HG22 ILE 112 HG22 ILE 112 117.921 3.591 -0.076 826 HG23 ILE 112 HG23 ILE 112 117.855 1.843 -0.283 827 HD11 ILE 112 HD11 ILE 112 116.165 4.157 -2.406 828 HD12 ILE 112 HD12 ILE 112 116.719 3.511 -3.952 829 HD13 ILE 112 HD13 ILE 112 116.679 5.254 -3.687 830 H THR 113 H THR 113 121.448 0.722 -2.234 831 HA THR 113 HA THR 113 120.243 -1.163 -0.700 832 HB THR 113 HB THR 113 121.959 -1.519 -2.505 833 HG1 THR 113 HG1 THR 113 122.185 -3.076 -0.221 834 HG21 THR 113 HG21 THR 113 124.244 -2.127 -1.604 835 HG22 THR 113 HG22 THR 113 123.832 -1.241 -0.140 836 HG23 THR 113 HG23 THR 113 123.910 -0.402 -1.687 837 HA PRO 114 HA PRO 114 123.348 -0.632 2.980 838 HB2 PRO 114 HB2 PRO 114 123.283 2.317 3.323 839 HB3 PRO 114 HB3 PRO 114 124.637 1.186 3.516 840 HG2 PRO 114 HG2 PRO 114 124.518 2.814 1.434 841 HG3 PRO 114 HG3 PRO 114 125.104 1.147 1.260 842 HD2 PRO 114 HD2 PRO 114 122.413 2.274 0.553 843 HD3 PRO 114 HD3 PRO 114 123.420 1.138 -0.366 844 H ILE 115 H ILE 115 120.679 1.586 2.337 845 HA ILE 115 HA ILE 115 119.604 1.132 5.030 846 HB ILE 115 HB ILE 115 117.855 2.814 4.319 847 HG12 ILE 115 HG12 ILE 115 119.819 3.400 2.088 848 HG13 ILE 115 HG13 ILE 115 118.311 2.523 1.843 849 HG21 ILE 115 HG21 ILE 115 120.155 3.170 5.577 850 HG22 ILE 115 HG22 ILE 115 119.159 4.540 5.095 851 HG23 ILE 115 HG23 ILE 115 120.555 4.081 4.119 852 HD11 ILE 115 HD11 ILE 115 117.017 4.399 2.099 853 HD12 ILE 115 HD12 ILE 115 118.493 5.200 1.560 854 HD13 ILE 115 HD13 ILE 115 118.106 5.131 3.278 855 H ARG 116 H ARG 116 119.403 -0.561 2.228 856 HA ARG 116 HA ARG 116 116.552 -0.894 2.029 857 HB2 ARG 116 HB2 ARG 116 118.204 -1.183 0.141 858 HB3 ARG 116 HB3 ARG 116 118.717 -2.683 0.911 859 HG2 ARG 116 HG2 ARG 116 116.485 -3.612 0.720 860 HG3 ARG 116 HG3 ARG 116 115.858 -2.081 0.107 861 HD2 ARG 116 HD2 ARG 116 116.223 -3.516 -1.797 862 HD3 ARG 116 HD3 ARG 116 117.475 -2.279 -1.814 863 HE ARG 116 HE ARG 116 118.159 -4.780 -0.481 864 HH11 ARG 116 HH11 ARG 116 118.374 -2.888 -3.430 865 HH12 ARG 116 HH12 ARG 116 119.720 -3.796 -4.032 866 HH21 ARG 116 HH21 ARG 116 119.892 -5.913 -1.308 867 HH22 ARG 116 HH22 ARG 116 120.568 -5.487 -2.846 868 H ALA 117 H ALA 117 115.292 -2.445 2.941 869 HA ALA 117 HA ALA 117 116.311 -3.763 5.280 870 HB1 ALA 117 HB1 ALA 117 114.045 -2.716 5.121 871 HB2 ALA 117 HB2 ALA 117 114.015 -4.392 5.673 872 HB3 ALA 117 HB3 ALA 117 113.582 -4.004 4.008 873 H LYS 118 H LYS 118 116.507 -5.929 5.687 874 HA LYS 118 HA LYS 118 116.611 -7.723 3.375 875 HB2 LYS 118 HB2 LYS 118 117.383 -8.127 6.278 876 HB3 LYS 118 HB3 LYS 118 117.595 -9.325 5.001 877 HG2 LYS 118 HG2 LYS 118 119.074 -7.824 3.780 878 HG3 LYS 118 HG3 LYS 118 118.805 -6.546 4.965 879 HD2 LYS 118 HD2 LYS 118 120.906 -7.602 5.509 880 HD3 LYS 118 HD3 LYS 118 119.730 -8.100 6.728 881 HE2 LYS 118 HE2 LYS 118 119.498 -10.254 5.798 882 HE3 LYS 118 HE3 LYS 118 120.192 -9.760 4.254 883 HZ1 LYS 118 HZ1 LYS 118 121.655 -9.928 6.833 884 HZ2 LYS 118 HZ2 LYS 118 122.323 -9.460 5.342 885 HZ3 LYS 118 HZ3 LYS 118 121.762 -11.049 5.565 886 H GLY 119 H GLY 119 115.248 -9.476 3.101 887 HA2 GLY 119 HA2 GLY 119 112.831 -9.456 4.792 888 HA3 GLY 119 HA3 GLY 119 112.925 -10.079 3.158 889 H SER 120 H SER 120 111.878 -11.488 5.432 890 HA SER 120 HA SER 120 113.654 -13.365 6.525 891 HB2 SER 120 HB2 SER 120 111.692 -14.695 7.021 892 HB3 SER 120 HB3 SER 120 111.301 -12.996 7.268 893 HG SER 120 HG SER 120 109.850 -13.297 5.808 894 H GLY 121 H GLY 121 111.945 -13.332 3.429 895 HA2 GLY 121 HA2 GLY 121 113.749 -15.463 2.500 896 HA3 GLY 121 HA3 GLY 121 112.014 -15.649 2.246 897 H GLY 122 H GLY 122 113.890 -15.547 0.137 898 HA2 GLY 122 HA2 GLY 122 113.899 -14.637 -1.991 899 HA3 GLY 122 HA3 GLY 122 112.718 -13.452 -1.449 900 H GLY 123 H GLY 123 115.785 -13.901 0.210 901 HA2 GLY 123 HA2 GLY 123 117.674 -12.596 0.357 902 HA3 GLY 123 HA3 GLY 123 117.300 -12.006 -1.257 903 H TYR 124 H TYR 124 117.001 -9.890 -1.375 904 HA TYR 124 HA TYR 124 116.262 -8.418 1.077 905 HB2 TYR 124 HB2 TYR 124 117.813 -7.659 -1.387 906 HB3 TYR 124 HB3 TYR 124 117.188 -6.456 -0.278 907 HD1 TYR 124 HD1 TYR 124 118.813 -9.798 0.293 908 HD2 TYR 124 HD2 TYR 124 118.973 -5.550 0.912 909 HE1 TYR 124 HE1 TYR 124 120.849 -10.077 1.675 910 HE2 TYR 124 HE2 TYR 124 121.005 -5.832 2.303 911 HH TYR 124 HH TYR 124 121.954 -8.555 3.609 912 H ILE 125 H ILE 125 114.873 -6.528 0.827 913 HA ILE 125 HA ILE 125 112.571 -7.244 -0.769 914 HB ILE 125 HB ILE 125 113.059 -4.939 1.138 915 HG12 ILE 125 HG12 ILE 125 111.412 -7.438 1.567 916 HG13 ILE 125 HG13 ILE 125 113.116 -7.369 2.000 917 HG21 ILE 125 HG21 ILE 125 110.434 -6.005 0.054 918 HG22 ILE 125 HG22 ILE 125 111.228 -4.550 -0.550 919 HG23 ILE 125 HG23 ILE 125 110.659 -4.615 1.117 920 HD11 ILE 125 HD11 ILE 125 112.762 -5.917 3.743 921 HD12 ILE 125 HD12 ILE 125 111.199 -6.731 3.743 922 HD13 ILE 125 HD13 ILE 125 111.368 -5.152 2.976 923 H SER 126 H SER 126 111.926 -6.369 -2.625 924 HA SER 126 HA SER 126 113.779 -4.935 -4.218 925 HB2 SER 126 HB2 SER 126 110.836 -5.445 -4.674 926 HB3 SER 126 HB3 SER 126 111.989 -4.907 -5.891 927 HG SER 126 HG SER 126 112.114 -7.285 -4.430 928 H LEU 127 H LEU 127 113.989 -2.872 -4.750 929 HA LEU 127 HA LEU 127 112.222 -0.874 -3.530 930 HB2 LEU 127 HB2 LEU 127 114.740 -0.484 -5.162 931 HB3 LEU 127 HB3 LEU 127 113.877 0.758 -4.257 932 HG LEU 127 HG LEU 127 115.142 -1.714 -3.033 933 HD11 LEU 127 HD11 LEU 127 116.668 0.092 -2.022 934 HD12 LEU 127 HD12 LEU 127 116.044 1.161 -3.278 935 HD13 LEU 127 HD13 LEU 127 116.928 -0.299 -3.722 936 HD21 LEU 127 HD21 LEU 127 114.763 -0.269 -0.924 937 HD22 LEU 127 HD22 LEU 127 113.346 -1.047 -1.630 938 HD23 LEU 127 HD23 LEU 127 113.648 0.666 -1.921 939 H GLY 128 H GLY 128 111.807 -2.670 -6.163 940 HA2 GLY 128 HA2 GLY 128 111.835 -1.143 -8.440 941 HA3 GLY 128 HA3 GLY 128 110.639 -2.395 -8.133 942 H ALA 129 H ALA 129 109.221 -1.197 -6.004 943 HA ALA 129 HA ALA 129 107.366 0.336 -7.456 944 HB1 ALA 129 HB1 ALA 129 106.599 -0.803 -5.509 945 HB2 ALA 129 HB2 ALA 129 106.460 0.918 -5.150 946 HB3 ALA 129 HB3 ALA 129 107.802 -0.016 -4.487 947 H LEU 130 H LEU 130 109.840 1.354 -5.107 948 HA LEU 130 HA LEU 130 109.214 4.093 -5.093 949 HB2 LEU 130 HB2 LEU 130 110.713 2.958 -3.465 950 HB3 LEU 130 HB3 LEU 130 111.933 2.812 -4.729 951 HG LEU 130 HG LEU 130 111.841 5.319 -4.996 952 HD11 LEU 130 HD11 LEU 130 109.717 5.873 -4.069 953 HD12 LEU 130 HD12 LEU 130 110.898 6.495 -2.916 954 HD13 LEU 130 HD13 LEU 130 110.050 4.984 -2.582 955 HD21 LEU 130 HD21 LEU 130 113.397 5.660 -3.281 956 HD22 LEU 130 HD22 LEU 130 113.430 3.906 -3.453 957 HD23 LEU 130 HD23 LEU 130 112.513 4.647 -2.141 958 H LEU 131 H LEU 131 111.388 2.207 -7.164 959 HA LEU 131 HA LEU 131 112.561 4.355 -8.549 960 HB2 LEU 131 HB2 LEU 131 113.383 2.015 -8.637 961 HB3 LEU 131 HB3 LEU 131 111.961 1.566 -9.575 962 HG LEU 131 HG LEU 131 112.663 3.324 -11.274 963 HD11 LEU 131 HD11 LEU 131 115.024 3.369 -9.402 964 HD12 LEU 131 HD12 LEU 131 114.150 4.728 -10.108 965 HD13 LEU 131 HD13 LEU 131 115.224 3.753 -11.113 966 HD21 LEU 131 HD21 LEU 131 114.533 1.876 -12.174 967 HD22 LEU 131 HD22 LEU 131 113.069 0.990 -11.747 968 HD23 LEU 131 HD23 LEU 131 114.464 0.961 -10.668 969 H SER 132 H SER 132 109.619 2.484 -9.228 970 HA SER 132 HA SER 132 109.058 3.593 -11.744 971 HB2 SER 132 HB2 SER 132 107.060 2.640 -9.678 972 HB3 SER 132 HB3 SER 132 106.778 2.805 -11.408 973 HG SER 132 HG SER 132 107.452 0.802 -11.309 974 H THR 133 H THR 133 108.139 4.664 -8.489 975 HA THR 133 HA THR 133 106.378 6.715 -9.276 976 HB THR 133 HB THR 133 108.150 6.675 -6.821 977 HG1 THR 133 HG1 THR 133 106.849 5.208 -6.141 978 HG21 THR 133 HG21 THR 133 105.501 8.017 -7.433 979 HG22 THR 133 HG22 THR 133 107.052 8.826 -7.213 980 HG23 THR 133 HG23 THR 133 106.287 8.005 -5.853 981 H THR 134 H THR 134 109.869 6.809 -8.565 982 HA THR 134 HA THR 134 110.145 9.600 -8.931 983 HB THR 134 HB THR 134 112.303 7.538 -9.411 984 HG1 THR 134 HG1 THR 134 111.662 7.130 -7.424 985 HG21 THR 134 HG21 THR 134 112.360 10.418 -8.450 986 HG22 THR 134 HG22 THR 134 112.832 9.865 -10.058 987 HG23 THR 134 HG23 THR 134 113.765 9.370 -8.647 988 H LEU 135 H LEU 135 110.446 6.891 -11.206 989 HA LEU 135 HA LEU 135 111.415 8.352 -13.401 990 HB2 LEU 135 HB2 LEU 135 109.681 5.875 -13.312 991 HB3 LEU 135 HB3 LEU 135 110.441 6.503 -14.775 992 HG LEU 135 HG LEU 135 111.989 5.797 -12.268 993 HD11 LEU 135 HD11 LEU 135 111.493 4.175 -14.784 994 HD12 LEU 135 HD12 LEU 135 110.952 3.767 -13.155 995 HD13 LEU 135 HD13 LEU 135 112.673 3.761 -13.539 996 HD21 LEU 135 HD21 LEU 135 113.272 7.286 -13.582 997 HD22 LEU 135 HD22 LEU 135 112.687 6.593 -15.094 998 HD23 LEU 135 HD23 LEU 135 113.830 5.695 -14.096 999 H ASN 136 H ASN 136 108.103 7.774 -12.271 1000 HA ASN 136 HA ASN 136 106.726 8.874 -14.452 1001 HB2 ASN 136 HB2 ASN 136 105.991 8.940 -11.515 1002 HB3 ASN 136 HB3 ASN 136 104.886 9.263 -12.850 1003 HD21 ASN 136 HD21 ASN 136 105.610 7.246 -14.676 1004 HD22 ASN 136 HD22 ASN 136 105.298 5.726 -13.986 1005 H LEU 137 H LEU 137 108.021 10.413 -11.529 1006 HA LEU 137 HA LEU 137 107.189 13.046 -12.122 1007 HB2 LEU 137 HB2 LEU 137 109.647 12.156 -10.593 1008 HB3 LEU 137 HB3 LEU 137 108.911 13.757 -10.528 1009 HG LEU 137 HG LEU 137 107.513 11.180 -9.748 1010 HD11 LEU 137 HD11 LEU 137 109.063 11.516 -8.026 1011 HD12 LEU 137 HD12 LEU 137 107.669 12.423 -7.441 1012 HD13 LEU 137 HD13 LEU 137 109.020 13.270 -8.195 1013 HD21 LEU 137 HD21 LEU 137 106.732 14.108 -9.618 1014 HD22 LEU 137 HD22 LEU 137 105.888 12.845 -8.723 1015 HD23 LEU 137 HD23 LEU 137 105.901 12.815 -10.484 1016 H CYS 138 H CYS 138 110.132 11.278 -12.994 1017 HA CYS 138 HA CYS 138 111.507 13.354 -14.271 1018 HB2 CYS 138 HB2 CYS 138 111.515 10.376 -14.504 1019 HB3 CYS 138 HB3 CYS 138 112.379 11.317 -15.716 1020 H GLY 139 H GLY 139 108.709 11.545 -15.353 1021 HA2 GLY 139 HA2 GLY 139 107.290 12.396 -17.071 1022 HA3 GLY 139 HA3 GLY 139 108.683 13.169 -17.804 1023 H LYS 140 H LYS 140 109.574 10.029 -16.975 1024 HA LYS 140 HA LYS 140 109.114 9.126 -19.741 1025 HB2 LYS 140 HB2 LYS 140 111.025 8.145 -17.607 1026 HB3 LYS 140 HB3 LYS 140 110.859 7.427 -19.210 1027 HG2 LYS 140 HG2 LYS 140 111.411 9.640 -20.221 1028 HG3 LYS 140 HG3 LYS 140 111.682 10.280 -18.599 1029 HD2 LYS 140 HD2 LYS 140 113.417 8.523 -18.238 1030 HD3 LYS 140 HD3 LYS 140 113.197 8.003 -19.909 1031 HE2 LYS 140 HE2 LYS 140 115.119 9.556 -19.678 1032 HE3 LYS 140 HE3 LYS 140 113.857 10.224 -20.713 1033 HZ1 LYS 140 HZ1 LYS 140 114.073 10.811 -17.814 1034 HZ2 LYS 140 HZ2 LYS 140 113.082 11.585 -18.956 1035 HZ3 LYS 140 HZ3 LYS 140 114.767 11.785 -19.017 1036 H GLY 141 H GLY 141 108.136 7.169 -20.197 1037 HA2 GLY 141 HA2 GLY 141 106.466 6.086 -18.033 1038 HA3 GLY 141 HA3 GLY 141 106.191 5.867 -19.759 Start of MODEL 15 1 H1 HIS -5 HT1 HIS -5 63.433 9.850 -24.956 2 H2 HIS -5 HT2 HIS -5 63.963 11.049 -23.875 3 H3 HIS -5 HT3 HIS -5 64.353 9.419 -23.598 4 HA HIS -5 HA HIS -5 66.131 10.972 -24.597 5 HB2 HIS -5 HB2 HIS -5 65.424 8.278 -25.777 6 HB3 HIS -5 HB3 HIS -5 66.977 9.067 -25.961 7 HD1 HIS -5 HD1 HIS -5 64.871 7.183 -23.516 8 HD2 HIS -5 HD2 HIS -5 68.610 9.027 -23.606 9 HE1 HIS -5 HE1 HIS -5 66.096 6.417 -21.439 10 H HIS -4 H HIS -4 67.030 11.426 -26.767 11 HA HIS -4 HA HIS -4 64.894 12.006 -28.743 12 HB2 HIS -4 HB2 HIS -4 67.404 13.563 -28.110 13 HB3 HIS -4 HB3 HIS -4 66.318 13.916 -29.440 14 HD1 HIS -4 HD1 HIS -4 66.669 14.207 -25.732 15 HD2 HIS -4 HD2 HIS -4 63.839 15.120 -28.655 16 HE1 HIS -4 HE1 HIS -4 64.953 15.702 -24.624 17 H HIS -3 H HIS -3 65.253 11.473 -30.845 18 HA HIS -3 HA HIS -3 67.792 10.070 -31.465 19 HB2 HIS -3 HB2 HIS -3 65.003 9.571 -32.511 20 HB3 HIS -3 HB3 HIS -3 66.449 8.782 -33.110 21 HD1 HIS -3 HD1 HIS -3 64.055 8.819 -30.243 22 HD2 HIS -3 HD2 HIS -3 67.526 6.793 -31.351 23 HE1 HIS -3 HE1 HIS -3 64.273 6.856 -28.661 24 H HIS -2 H HIS -2 68.867 10.618 -33.292 25 HA HIS -2 HA HIS -2 67.679 12.728 -35.006 26 HB2 HIS -2 HB2 HIS -2 70.564 12.380 -34.185 27 HB3 HIS -2 HB3 HIS -2 69.969 13.579 -35.316 28 HD1 HIS -2 HD1 HIS -2 68.083 15.271 -34.190 29 HD2 HIS -2 HD2 HIS -2 70.659 13.277 -31.589 30 HE1 HIS -2 HE1 HIS -2 68.002 16.533 -31.998 31 H HIS -1 H HIS -1 67.974 12.549 -37.200 32 HA HIS -1 HA HIS -1 69.235 10.044 -38.164 33 HB2 HIS -1 HB2 HIS -1 66.784 10.039 -38.387 34 HB3 HIS -1 HB3 HIS -1 66.865 11.533 -39.301 35 HD1 HIS -1 HD1 HIS -1 67.544 11.377 -41.772 36 HD2 HIS -1 HD2 HIS -1 67.684 7.706 -39.800 37 HE1 HIS -1 HE1 HIS -1 67.834 9.612 -43.563 38 H HIS 0 H HIS 0 70.792 10.240 -39.645 39 HA HIS 0 HA HIS 0 71.114 12.833 -41.043 40 HB2 HIS 0 HB2 HIS 0 73.266 11.080 -39.853 41 HB3 HIS 0 HB3 HIS 0 73.563 12.469 -40.881 42 HD1 HIS 0 HD1 HIS 0 72.567 11.494 -37.414 43 HD2 HIS 0 HD2 HIS 0 73.131 14.997 -39.602 44 HE1 HIS 0 HE1 HIS 0 72.592 13.389 -35.737 45 H SER 1 H SER 1 71.940 12.736 -43.146 46 HA SER 1 HA SER 1 71.163 10.520 -44.698 47 HB2 SER 1 HB2 SER 1 73.131 12.712 -45.404 48 HB3 SER 1 HB3 SER 1 72.322 11.641 -46.543 49 HG SER 1 HG SER 1 70.405 12.564 -45.894 50 H SER 2 H SER 2 72.460 9.043 -45.914 51 HA SER 2 HA SER 2 75.079 8.433 -44.660 52 HB2 SER 2 HB2 SER 2 73.040 6.494 -45.780 53 HB3 SER 2 HB3 SER 2 74.604 6.068 -45.095 54 HG SER 2 HG SER 2 73.819 7.094 -43.183 55 H GLY 3 H GLY 3 76.733 7.710 -46.001 56 HA2 GLY 3 HA2 GLY 3 76.554 8.617 -48.755 57 HA3 GLY 3 HA3 GLY 3 78.001 8.041 -47.933 58 H LEU 4 H LEU 4 78.080 7.015 -50.217 59 HA LEU 4 HA LEU 4 76.495 4.551 -50.384 60 HB2 LEU 4 HB2 LEU 4 76.751 6.008 -52.394 61 HB3 LEU 4 HB3 LEU 4 78.485 5.687 -52.362 62 HG LEU 4 HG LEU 4 77.917 3.213 -52.457 63 HD11 LEU 4 HD11 LEU 4 75.645 3.155 -51.766 64 HD12 LEU 4 HD12 LEU 4 75.594 2.820 -53.496 65 HD13 LEU 4 HD13 LEU 4 75.186 4.428 -52.896 66 HD21 LEU 4 HD21 LEU 4 76.849 4.761 -54.827 67 HD22 LEU 4 HD22 LEU 4 77.723 3.229 -54.835 68 HD23 LEU 4 HD23 LEU 4 78.566 4.723 -54.431 69 H VAL 5 H VAL 5 77.301 2.592 -49.935 70 HA VAL 5 HA VAL 5 79.751 2.304 -48.582 71 HB VAL 5 HB VAL 5 78.039 0.182 -49.906 72 HG11 VAL 5 HG11 VAL 5 79.088 -1.342 -48.272 73 HG12 VAL 5 HG12 VAL 5 80.104 -0.022 -47.693 74 HG13 VAL 5 HG13 VAL 5 80.298 -0.629 -49.338 75 HG21 VAL 5 HG21 VAL 5 78.022 1.405 -47.133 76 HG22 VAL 5 HG22 VAL 5 77.175 -0.086 -47.544 77 HG23 VAL 5 HG23 VAL 5 76.717 1.431 -48.319 78 HA PRO 6 HA PRO 6 82.260 1.757 -52.272 79 HB2 PRO 6 HB2 PRO 6 84.660 1.224 -51.151 80 HB3 PRO 6 HB3 PRO 6 83.908 2.828 -51.042 81 HG2 PRO 6 HG2 PRO 6 84.205 0.748 -48.984 82 HG3 PRO 6 HG3 PRO 6 84.069 2.504 -48.813 83 HD2 PRO 6 HD2 PRO 6 81.999 0.581 -48.449 84 HD3 PRO 6 HD3 PRO 6 81.841 2.349 -48.419 85 H ARG 7 H ARG 7 84.168 0.101 -52.950 86 HA ARG 7 HA ARG 7 82.962 -2.369 -53.417 87 HB2 ARG 7 HB2 ARG 7 85.133 -3.102 -54.244 88 HB3 ARG 7 HB3 ARG 7 84.816 -1.448 -54.763 89 HG2 ARG 7 HG2 ARG 7 86.170 -0.653 -52.788 90 HG3 ARG 7 HG3 ARG 7 86.609 -2.334 -52.486 91 HD2 ARG 7 HD2 ARG 7 87.514 -2.467 -54.813 92 HD3 ARG 7 HD3 ARG 7 87.180 -0.749 -55.004 93 HE ARG 7 HE ARG 7 88.733 -1.127 -52.678 94 HH11 ARG 7 HH11 ARG 7 89.086 -1.329 -56.165 95 HH12 ARG 7 HH12 ARG 7 90.780 -0.976 -56.114 96 HH21 ARG 7 HH21 ARG 7 90.917 -0.678 -52.675 97 HH22 ARG 7 HH22 ARG 7 91.804 -0.611 -54.162 98 H GLY 8 H GLY 8 83.366 -4.467 -52.613 99 HA2 GLY 8 HA2 GLY 8 84.097 -6.044 -51.031 100 HA3 GLY 8 HA3 GLY 8 84.796 -4.737 -50.080 101 H SER 9 H SER 9 83.732 -5.950 -48.293 102 HA SER 9 HA SER 9 80.847 -5.300 -48.070 103 HB2 SER 9 HB2 SER 9 81.386 -7.729 -48.016 104 HB3 SER 9 HB3 SER 9 82.413 -7.444 -46.615 105 HG SER 9 HG SER 9 80.498 -7.859 -45.750 106 H GLY 10 H GLY 10 80.122 -4.215 -46.295 107 HA2 GLY 10 HA2 GLY 10 82.124 -2.805 -44.721 108 HA3 GLY 10 HA3 GLY 10 80.390 -2.497 -44.729 109 H MET 11 H MET 11 81.080 -2.390 -42.325 110 HA MET 11 HA MET 11 80.980 -5.079 -41.099 111 HB2 MET 11 HB2 MET 11 81.837 -2.408 -39.966 112 HB3 MET 11 HB3 MET 11 81.748 -3.906 -39.038 113 HG2 MET 11 HG2 MET 11 83.319 -4.950 -40.705 114 HG3 MET 11 HG3 MET 11 83.512 -3.360 -41.441 115 HE1 MET 11 HE1 MET 11 83.970 -1.339 -40.225 116 HE2 MET 11 HE2 MET 11 85.141 -1.170 -38.918 117 HE3 MET 11 HE3 MET 11 83.446 -1.467 -38.541 118 H LYS 12 H LYS 12 79.549 -5.436 -39.329 119 HA LYS 12 HA LYS 12 76.952 -4.319 -39.722 120 HB2 LYS 12 HB2 LYS 12 77.385 -6.646 -38.923 121 HB3 LYS 12 HB3 LYS 12 77.943 -5.975 -37.391 122 HG2 LYS 12 HG2 LYS 12 75.738 -4.858 -37.106 123 HG3 LYS 12 HG3 LYS 12 75.181 -5.628 -38.593 124 HD2 LYS 12 HD2 LYS 12 75.698 -7.857 -37.565 125 HD3 LYS 12 HD3 LYS 12 76.068 -7.025 -36.054 126 HE2 LYS 12 HE2 LYS 12 73.742 -5.999 -36.189 127 HE3 LYS 12 HE3 LYS 12 73.411 -7.138 -37.495 128 HZ1 LYS 12 HZ1 LYS 12 74.499 -8.094 -34.931 129 HZ2 LYS 12 HZ2 LYS 12 73.590 -8.939 -36.091 130 HZ3 LYS 12 HZ3 LYS 12 72.837 -7.793 -35.088 131 H GLU 13 H GLU 13 75.956 -2.671 -38.725 132 HA GLU 13 HA GLU 13 77.378 -0.748 -37.254 133 HB2 GLU 13 HB2 GLU 13 74.392 -1.232 -37.408 134 HB3 GLU 13 HB3 GLU 13 75.150 0.231 -36.777 135 HG2 GLU 13 HG2 GLU 13 76.275 0.559 -38.971 136 HG3 GLU 13 HG3 GLU 13 75.429 -0.850 -39.594 137 H THR 14 H THR 14 77.502 -0.267 -35.085 138 HA THR 14 HA THR 14 76.481 -2.325 -33.208 139 HB THR 14 HB THR 14 79.034 -0.721 -32.941 140 HG1 THR 14 HG1 THR 14 79.996 -2.497 -33.664 141 HG21 THR 14 HG21 THR 14 78.055 -1.373 -30.799 142 HG22 THR 14 HG22 THR 14 79.479 -2.360 -31.122 143 HG23 THR 14 HG23 THR 14 77.867 -3.032 -31.365 144 H ALA 15 H ALA 15 75.448 -1.621 -31.406 145 HA ALA 15 HA ALA 15 74.391 1.006 -31.349 146 HB1 ALA 15 HB1 ALA 15 74.506 -0.865 -28.985 147 HB2 ALA 15 HB2 ALA 15 73.390 -1.114 -30.328 148 HB3 ALA 15 HB3 ALA 15 73.285 0.353 -29.354 149 H ALA 16 H ALA 16 74.847 2.758 -30.030 150 HA ALA 16 HA ALA 16 77.548 3.229 -29.371 151 HB1 ALA 16 HB1 ALA 16 75.065 4.659 -28.391 152 HB2 ALA 16 HB2 ALA 16 75.967 5.044 -29.858 153 HB3 ALA 16 HB3 ALA 16 76.714 5.274 -28.277 154 H ALA 17 H ALA 17 78.633 3.279 -27.408 155 HA ALA 17 HA ALA 17 77.232 2.294 -25.024 156 HB1 ALA 17 HB1 ALA 17 79.546 0.930 -26.387 157 HB2 ALA 17 HB2 ALA 17 78.027 0.228 -25.829 158 HB3 ALA 17 HB3 ALA 17 79.249 0.730 -24.660 159 H LYS 18 H LYS 18 78.366 2.695 -23.057 160 HA LYS 18 HA LYS 18 80.129 5.024 -23.234 161 HB2 LYS 18 HB2 LYS 18 78.740 3.711 -20.887 162 HB3 LYS 18 HB3 LYS 18 79.757 5.148 -20.769 163 HG2 LYS 18 HG2 LYS 18 78.275 6.377 -22.260 164 HG3 LYS 18 HG3 LYS 18 77.298 4.933 -22.530 165 HD2 LYS 18 HD2 LYS 18 76.161 6.280 -20.880 166 HD3 LYS 18 HD3 LYS 18 76.837 4.878 -20.050 167 HE2 LYS 18 HE2 LYS 18 78.568 6.129 -19.073 168 HE3 LYS 18 HE3 LYS 18 78.412 7.437 -20.247 169 HZ1 LYS 18 HZ1 LYS 18 77.446 8.181 -18.237 170 HZ2 LYS 18 HZ2 LYS 18 76.549 6.751 -18.045 171 HZ3 LYS 18 HZ3 LYS 18 76.158 7.842 -19.288 172 H PHE 19 H PHE 19 82.104 5.141 -22.020 173 HA PHE 19 HA PHE 19 83.514 2.572 -21.977 174 HB2 PHE 19 HB2 PHE 19 84.491 4.513 -23.178 175 HB3 PHE 19 HB3 PHE 19 84.579 5.381 -21.657 176 HD1 PHE 19 HD1 PHE 19 85.914 2.527 -23.595 177 HD2 PHE 19 HD2 PHE 19 86.309 4.913 -20.047 178 HE1 PHE 19 HE1 PHE 19 88.138 1.518 -23.164 179 HE2 PHE 19 HE2 PHE 19 88.533 3.904 -19.616 180 HZ PHE 19 HZ PHE 19 89.447 2.206 -21.175 181 H GLU 20 H GLU 20 84.097 1.567 -20.157 182 HA GLU 20 HA GLU 20 83.669 2.971 -17.582 183 HB2 GLU 20 HB2 GLU 20 83.452 0.021 -18.229 184 HB3 GLU 20 HB3 GLU 20 83.231 0.737 -16.632 185 HG2 GLU 20 HG2 GLU 20 81.584 1.404 -19.086 186 HG3 GLU 20 HG3 GLU 20 81.066 0.350 -17.777 187 H ARG 21 H ARG 21 85.063 2.311 -15.814 188 HA ARG 21 HA ARG 21 87.756 1.473 -16.730 189 HB2 ARG 21 HB2 ARG 21 86.988 3.365 -14.492 190 HB3 ARG 21 HB3 ARG 21 88.633 2.845 -14.863 191 HG2 ARG 21 HG2 ARG 21 88.378 3.781 -17.158 192 HG3 ARG 21 HG3 ARG 21 86.783 4.385 -16.706 193 HD2 ARG 21 HD2 ARG 21 87.883 5.643 -14.819 194 HD3 ARG 21 HD3 ARG 21 89.441 5.172 -15.490 195 HE ARG 21 HE ARG 21 88.003 6.331 -17.570 196 HH11 ARG 21 HH11 ARG 21 89.250 7.372 -14.458 197 HH12 ARG 21 HH12 ARG 21 89.432 9.017 -14.969 198 HH21 ARG 21 HH21 ARG 21 88.260 8.464 -18.171 199 HH22 ARG 21 HH22 ARG 21 88.879 9.626 -17.045 200 H GLN 22 H GLN 22 88.997 0.196 -15.268 201 HA GLN 22 HA GLN 22 87.608 -1.921 -14.102 202 HB2 GLN 22 HB2 GLN 22 89.746 -2.623 -13.186 203 HB3 GLN 22 HB3 GLN 22 89.972 -2.019 -14.824 204 HG2 GLN 22 HG2 GLN 22 90.576 0.225 -13.785 205 HG3 GLN 22 HG3 GLN 22 90.615 -0.602 -12.228 206 HE21 GLN 22 HE21 GLN 22 92.868 -0.648 -11.818 207 HE22 GLN 22 HE22 GLN 22 93.995 -1.376 -12.860 208 H HIS 23 H HIS 23 86.967 -2.440 -12.059 209 HA HIS 23 HA HIS 23 87.317 -0.404 -9.944 210 HB2 HIS 23 HB2 HIS 23 84.755 -1.864 -10.600 211 HB3 HIS 23 HB3 HIS 23 84.996 -0.775 -9.248 212 HD1 HIS 23 HD1 HIS 23 85.938 1.746 -10.198 213 HD2 HIS 23 HD2 HIS 23 83.541 -0.584 -12.688 214 HE1 HIS 23 HE1 HIS 23 84.966 3.317 -11.929 215 H MET 24 H MET 24 86.742 -1.314 -7.762 216 HA MET 24 HA MET 24 87.868 -4.019 -7.543 217 HB2 MET 24 HB2 MET 24 87.437 -1.842 -5.485 218 HB3 MET 24 HB3 MET 24 88.106 -3.436 -5.126 219 HG2 MET 24 HG2 MET 24 89.916 -3.013 -6.786 220 HG3 MET 24 HG3 MET 24 89.277 -1.388 -7.031 221 HE1 MET 24 HE1 MET 24 92.338 -1.871 -6.118 222 HE2 MET 24 HE2 MET 24 92.378 -0.433 -5.102 223 HE3 MET 24 HE3 MET 24 91.458 -0.417 -6.604 224 H ASP 25 H ASP 25 86.820 -5.681 -6.473 225 HA ASP 25 HA ASP 25 83.975 -5.674 -6.607 226 HB2 ASP 25 HB2 ASP 25 84.124 -7.933 -5.695 227 HB3 ASP 25 HB3 ASP 25 85.327 -7.707 -6.961 228 H SER 26 H SER 26 82.449 -5.494 -5.033 229 HA SER 26 HA SER 26 83.357 -5.006 -2.263 230 HB2 SER 26 HB2 SER 26 81.401 -3.274 -2.259 231 HB3 SER 26 HB3 SER 26 82.961 -2.810 -2.930 232 HG SER 26 HG SER 26 80.587 -3.171 -4.161 233 HA PRO 27 HA PRO 27 79.929 -7.638 -1.311 234 HB2 PRO 27 HB2 PRO 27 79.242 -6.916 1.202 235 HB3 PRO 27 HB3 PRO 27 80.794 -7.697 0.839 236 HG2 PRO 27 HG2 PRO 27 80.200 -4.852 1.413 237 HG3 PRO 27 HG3 PRO 27 81.621 -5.822 1.836 238 HD2 PRO 27 HD2 PRO 27 81.481 -4.022 -0.298 239 HD3 PRO 27 HD3 PRO 27 82.694 -5.306 -0.112 240 H ASP 28 H ASP 28 77.609 -7.480 -0.110 241 HA ASP 28 HA ASP 28 76.027 -5.768 -1.779 242 HB2 ASP 28 HB2 ASP 28 74.114 -6.742 -0.561 243 HB3 ASP 28 HB3 ASP 28 75.215 -7.974 -1.162 244 H LEU 29 H LEU 29 74.109 -4.579 -0.606 245 HA LEU 29 HA LEU 29 75.380 -2.647 1.207 246 HB2 LEU 29 HB2 LEU 29 74.263 -1.833 -0.870 247 HB3 LEU 29 HB3 LEU 29 72.733 -2.449 -0.247 248 HG LEU 29 HG LEU 29 73.125 -1.018 1.816 249 HD11 LEU 29 HD11 LEU 29 75.474 -0.600 1.695 250 HD12 LEU 29 HD12 LEU 29 74.696 0.945 1.347 251 HD13 LEU 29 HD13 LEU 29 75.357 -0.026 0.031 252 HD21 LEU 29 HD21 LEU 29 72.312 1.005 0.739 253 HD22 LEU 29 HD22 LEU 29 71.615 -0.388 -0.089 254 HD23 LEU 29 HD23 LEU 29 72.966 0.484 -0.815 255 H GLY 30 H GLY 30 74.875 -2.539 3.298 256 HA2 GLY 30 HA2 GLY 30 72.870 -4.358 4.375 257 HA3 GLY 30 HA3 GLY 30 74.028 -3.407 5.302 258 H THR 31 H THR 31 71.860 -3.193 6.533 259 HA THR 31 HA THR 31 69.974 -1.290 5.447 260 HB THR 31 HB THR 31 68.874 -1.453 7.618 261 HG1 THR 31 HG1 THR 31 69.981 -2.944 9.084 262 HG21 THR 31 HG21 THR 31 68.555 -3.942 7.690 263 HG22 THR 31 HG22 THR 31 69.883 -4.098 6.541 264 HG23 THR 31 HG23 THR 31 68.407 -3.257 6.071 265 H ASP 32 H ASP 32 69.434 0.712 6.708 266 HA ASP 32 HA ASP 32 71.660 2.435 6.779 267 HB2 ASP 32 HB2 ASP 32 70.123 4.099 7.686 268 HB3 ASP 32 HB3 ASP 32 69.351 3.206 6.381 269 H ASP 33 H ASP 33 73.003 3.087 8.364 270 HA ASP 33 HA ASP 33 73.202 1.500 10.735 271 HB2 ASP 33 HB2 ASP 33 74.653 4.021 9.902 272 HB3 ASP 33 HB3 ASP 33 75.082 3.029 11.291 273 H ASP 34 H ASP 34 72.682 1.973 12.815 274 HA ASP 34 HA ASP 34 70.800 4.139 13.260 275 HB2 ASP 34 HB2 ASP 34 70.445 1.868 14.220 276 HB3 ASP 34 HB3 ASP 34 71.883 2.097 15.213 277 H ASP 35 H ASP 35 71.349 6.092 13.988 278 HA ASP 35 HA ASP 35 73.988 6.888 14.474 279 HB2 ASP 35 HB2 ASP 35 73.037 8.976 15.303 280 HB3 ASP 35 HB3 ASP 35 72.177 8.445 13.862 281 H LYS 36 H LYS 36 75.257 6.971 16.241 282 HA LYS 36 HA LYS 36 74.220 5.701 18.687 283 HB2 LYS 36 HB2 LYS 36 77.050 6.181 17.727 284 HB3 LYS 36 HB3 LYS 36 76.624 5.417 19.260 285 HG2 LYS 36 HG2 LYS 36 75.345 3.686 17.999 286 HG3 LYS 36 HG3 LYS 36 75.898 4.415 16.492 287 HD2 LYS 36 HD2 LYS 36 78.257 4.050 17.231 288 HD3 LYS 36 HD3 LYS 36 77.646 3.204 18.653 289 HE2 LYS 36 HE2 LYS 36 78.112 1.484 17.085 290 HE3 LYS 36 HE3 LYS 36 76.364 1.704 17.006 291 HZ1 LYS 36 HZ1 LYS 36 77.979 3.354 15.230 292 HZ2 LYS 36 HZ2 LYS 36 76.474 2.615 14.960 293 HZ3 LYS 36 HZ3 LYS 36 77.902 1.700 14.861 294 H THR 37 H THR 37 74.611 6.604 20.736 295 HA THR 37 HA THR 37 74.582 9.497 20.787 296 HB THR 37 HB THR 37 74.203 9.243 23.185 297 HG1 THR 37 HG1 THR 37 74.741 7.468 24.128 298 HG21 THR 37 HG21 THR 37 72.336 8.844 21.531 299 HG22 THR 37 HG22 THR 37 72.106 8.064 23.096 300 HG23 THR 37 HG23 THR 37 72.637 7.116 21.708 301 H GLY 38 H GLY 38 75.977 10.662 22.411 302 HA2 GLY 38 HA2 GLY 38 78.740 10.105 21.811 303 HA3 GLY 38 HA3 GLY 38 78.129 11.444 22.779 304 H GLY 39 H GLY 39 80.300 10.487 23.815 305 HA2 GLY 39 HA2 GLY 39 79.528 9.333 26.311 306 HA3 GLY 39 HA3 GLY 39 80.365 8.158 25.301 307 H GLY 40 H GLY 40 81.916 8.251 27.142 308 HA2 GLY 40 HA2 GLY 40 83.529 10.613 27.487 309 HA3 GLY 40 HA3 GLY 40 83.838 9.023 28.180 310 H ARG 41 H ARG 41 86.102 9.681 27.564 311 HA ARG 41 HA ARG 41 86.978 10.000 24.933 312 HB2 ARG 41 HB2 ARG 41 88.395 8.713 27.278 313 HB3 ARG 41 HB3 ARG 41 89.177 9.212 25.776 314 HG2 ARG 41 HG2 ARG 41 88.439 11.534 26.158 315 HG3 ARG 41 HG3 ARG 41 87.661 11.042 27.660 316 HD2 ARG 41 HD2 ARG 41 89.800 11.960 28.247 317 HD3 ARG 41 HD3 ARG 41 89.911 10.219 28.456 318 HE ARG 41 HE ARG 41 91.214 11.825 26.385 319 HH11 ARG 41 HH11 ARG 41 90.504 8.596 27.578 320 HH12 ARG 41 HH12 ARG 41 91.816 7.883 26.703 321 HH21 ARG 41 HH21 ARG 41 92.880 10.843 25.282 322 HH22 ARG 41 HH22 ARG 41 93.141 9.135 25.419 323 H ALA 42 H ALA 42 87.708 8.603 23.355 324 HA ALA 42 HA ALA 42 86.746 5.820 23.605 325 HB1 ALA 42 HB1 ALA 42 87.019 7.723 21.303 326 HB2 ALA 42 HB2 ALA 42 85.640 6.728 21.772 327 HB3 ALA 42 HB3 ALA 42 87.045 5.984 21.009 328 H ASP 43 H ASP 43 88.031 4.107 22.840 329 HA ASP 43 HA ASP 43 90.759 4.201 23.462 330 HB2 ASP 43 HB2 ASP 43 90.884 2.008 22.292 331 HB3 ASP 43 HB3 ASP 43 89.530 2.101 23.416 332 HA PRO 44 HA PRO 44 92.702 6.028 19.961 333 HB2 PRO 44 HB2 PRO 44 94.861 4.341 19.493 334 HB3 PRO 44 HB3 PRO 44 94.819 5.622 20.717 335 HG2 PRO 44 HG2 PRO 44 94.397 2.700 21.029 336 HG3 PRO 44 HG3 PRO 44 95.220 3.848 22.102 337 HD2 PRO 44 HD2 PRO 44 92.727 2.951 22.639 338 HD3 PRO 44 HD3 PRO 44 93.238 4.603 23.053 339 H ALA 45 H ALA 45 93.492 5.535 17.670 340 HA ALA 45 HA ALA 45 92.224 3.152 16.513 341 HB1 ALA 45 HB1 ALA 45 91.004 4.444 14.870 342 HB2 ALA 45 HB2 ALA 45 91.672 5.949 15.503 343 HB3 ALA 45 HB3 ALA 45 90.548 5.004 16.479 344 H HIS 46 H HIS 46 92.850 2.797 14.264 345 HA HIS 46 HA HIS 46 95.575 3.809 13.742 346 HB2 HIS 46 HB2 HIS 46 94.162 1.357 12.679 347 HB3 HIS 46 HB3 HIS 46 95.810 1.826 12.305 348 HD1 HIS 46 HD1 HIS 46 97.435 1.959 14.530 349 HD2 HIS 46 HD2 HIS 46 93.948 -0.301 14.863 350 HE1 HIS 46 HE1 HIS 46 97.756 0.439 16.529 351 H ARG 47 H ARG 47 96.122 4.640 11.733 352 HA ARG 47 HA ARG 47 93.827 5.493 10.079 353 HB2 ARG 47 HB2 ARG 47 96.642 6.610 10.125 354 HB3 ARG 47 HB3 ARG 47 95.250 7.290 9.287 355 HG2 ARG 47 HG2 ARG 47 95.383 6.919 12.291 356 HG3 ARG 47 HG3 ARG 47 95.796 8.424 11.472 357 HD2 ARG 47 HD2 ARG 47 93.108 7.028 11.301 358 HD3 ARG 47 HD3 ARG 47 93.462 8.437 12.293 359 HE ARG 47 HE ARG 47 94.166 8.925 9.577 360 HH11 ARG 47 HH11 ARG 47 91.356 8.711 11.672 361 HH12 ARG 47 HH12 ARG 47 90.411 9.769 10.678 362 HH21 ARG 47 HH21 ARG 47 92.900 10.279 8.338 363 HH22 ARG 47 HH22 ARG 47 91.275 10.644 8.813 364 H SER 48 H SER 48 93.784 5.143 7.895 365 HA SER 48 HA SER 48 95.385 2.926 6.940 366 HB2 SER 48 HB2 SER 48 93.436 4.514 5.283 367 HB3 SER 48 HB3 SER 48 93.888 2.819 5.130 368 HG SER 48 HG SER 48 92.487 3.971 7.256 369 HA PRO 49 HA PRO 49 98.556 4.978 4.635 370 HB2 PRO 49 HB2 PRO 49 97.419 3.837 2.115 371 HB3 PRO 49 HB3 PRO 49 99.084 3.791 2.724 372 HG2 PRO 49 HG2 PRO 49 97.501 1.659 2.848 373 HG3 PRO 49 HG3 PRO 49 98.674 2.029 4.126 374 HD2 PRO 49 HD2 PRO 49 95.711 2.291 4.170 375 HD3 PRO 49 HD3 PRO 49 96.841 1.996 5.509 376 H VAL 50 H VAL 50 98.665 7.077 4.008 377 HA VAL 50 HA VAL 50 96.206 8.345 3.087 378 HB VAL 50 HB VAL 50 98.854 9.579 3.893 379 HG11 VAL 50 HG11 VAL 50 97.385 10.956 2.375 380 HG12 VAL 50 HG12 VAL 50 97.649 11.676 3.964 381 HG13 VAL 50 HG13 VAL 50 96.124 10.866 3.605 382 HG21 VAL 50 HG21 VAL 50 97.533 10.195 5.963 383 HG22 VAL 50 HG22 VAL 50 97.869 8.471 5.800 384 HG23 VAL 50 HG23 VAL 50 96.270 9.099 5.404 385 HA PRO 51 HA PRO 51 97.532 8.315 -1.195 386 HB2 PRO 51 HB2 PRO 51 96.498 11.108 -1.372 387 HB3 PRO 51 HB3 PRO 51 96.121 9.698 -2.379 388 HG2 PRO 51 HG2 PRO 51 94.405 10.622 -0.565 389 HG3 PRO 51 HG3 PRO 51 94.564 8.891 -0.912 390 HD2 PRO 51 HD2 PRO 51 95.519 10.420 1.462 391 HD3 PRO 51 HD3 PRO 51 94.992 8.730 1.342 392 H LEU 52 H LEU 52 99.071 9.365 -2.628 393 HA LEU 52 HA LEU 52 101.353 10.380 -1.297 394 HB2 LEU 52 HB2 LEU 52 100.646 10.501 -4.239 395 HB3 LEU 52 HB3 LEU 52 102.252 10.748 -3.555 396 HG LEU 52 HG LEU 52 100.636 8.208 -3.215 397 HD11 LEU 52 HD11 LEU 52 102.598 7.384 -4.765 398 HD12 LEU 52 HD12 LEU 52 102.665 9.078 -5.255 399 HD13 LEU 52 HD13 LEU 52 101.181 8.151 -5.485 400 HD21 LEU 52 HD21 LEU 52 103.362 9.154 -2.369 401 HD22 LEU 52 HD22 LEU 52 103.102 7.440 -2.691 402 HD23 LEU 52 HD23 LEU 52 102.161 8.254 -1.443 403 HA PRO 53 HA PRO 53 100.624 14.769 -1.174 404 HB2 PRO 53 HB2 PRO 53 103.248 15.278 -2.471 405 HB3 PRO 53 HB3 PRO 53 102.648 15.809 -0.889 406 HG2 PRO 53 HG2 PRO 53 104.506 13.914 -1.133 407 HG3 PRO 53 HG3 PRO 53 103.290 13.883 0.158 408 HD2 PRO 53 HD2 PRO 53 103.415 12.247 -2.347 409 HD3 PRO 53 HD3 PRO 53 102.835 11.792 -0.727 410 H SER 54 H SER 54 99.967 16.486 -2.555 411 HA SER 54 HA SER 54 98.839 15.629 -4.947 412 HB2 SER 54 HB2 SER 54 98.624 18.182 -5.382 413 HB3 SER 54 HB3 SER 54 97.817 17.495 -3.978 414 HG SER 54 HG SER 54 100.301 18.770 -4.032 415 HA PRO 55 HA PRO 55 102.152 15.506 -7.758 416 HB2 PRO 55 HB2 PRO 55 101.025 16.481 -10.111 417 HB3 PRO 55 HB3 PRO 55 100.866 14.822 -9.508 418 HG2 PRO 55 HG2 PRO 55 98.965 17.092 -9.302 419 HG3 PRO 55 HG3 PRO 55 98.649 15.368 -9.571 420 HD2 PRO 55 HD2 PRO 55 98.255 16.503 -7.154 421 HD3 PRO 55 HD3 PRO 55 98.841 14.831 -7.315 422 H THR 56 H THR 56 103.822 16.817 -7.529 423 HA THR 56 HA THR 56 103.629 19.553 -8.646 424 HB THR 56 HB THR 56 105.369 20.249 -7.077 425 HG1 THR 56 HG1 THR 56 106.289 18.821 -5.793 426 HG21 THR 56 HG21 THR 56 102.830 20.069 -6.441 427 HG22 THR 56 HG22 THR 56 104.015 20.429 -5.185 428 HG23 THR 56 HG23 THR 56 103.384 18.792 -5.358 429 H SER 57 H SER 57 105.406 20.168 -9.989 430 HA SER 57 HA SER 57 106.192 18.095 -11.686 431 HB2 SER 57 HB2 SER 57 107.428 20.835 -11.346 432 HB3 SER 57 HB3 SER 57 107.729 19.753 -12.701 433 HG SER 57 HG SER 57 105.702 21.382 -12.321 434 H ASN 58 H ASN 58 107.607 16.552 -11.449 435 HA ASN 58 HA ASN 58 109.544 15.457 -11.168 436 HB2 ASN 58 HB2 ASN 58 111.572 16.588 -11.446 437 HB3 ASN 58 HB3 ASN 58 110.387 17.529 -12.334 438 HD21 ASN 58 HD21 ASN 58 110.734 19.725 -12.038 439 HD22 ASN 58 HD22 ASN 58 111.288 20.442 -10.603 440 H LYS 59 H LYS 59 107.939 16.457 -8.646 441 HA LYS 59 HA LYS 59 109.944 15.481 -6.758 442 HB2 LYS 59 HB2 LYS 59 110.309 17.928 -6.891 443 HB3 LYS 59 HB3 LYS 59 108.638 18.186 -6.394 444 HG2 LYS 59 HG2 LYS 59 109.097 16.928 -4.295 445 HG3 LYS 59 HG3 LYS 59 110.785 16.776 -4.783 446 HD2 LYS 59 HD2 LYS 59 110.919 19.276 -4.901 447 HD3 LYS 59 HD3 LYS 59 109.283 19.353 -4.245 448 HE2 LYS 59 HE2 LYS 59 111.453 17.809 -2.830 449 HE3 LYS 59 HE3 LYS 59 111.252 19.543 -2.575 450 HZ1 LYS 59 HZ1 LYS 59 109.993 17.835 -1.091 451 HZ2 LYS 59 HZ2 LYS 59 108.903 17.793 -2.393 452 HZ3 LYS 59 HZ3 LYS 59 109.222 19.259 -1.593 453 H GLN 60 H GLN 60 109.076 14.318 -5.136 454 HA GLN 60 HA GLN 60 106.477 15.057 -4.045 455 HB2 GLN 60 HB2 GLN 60 107.034 12.308 -5.156 456 HB3 GLN 60 HB3 GLN 60 105.777 12.618 -3.960 457 HG2 GLN 60 HG2 GLN 60 104.796 14.318 -5.519 458 HG3 GLN 60 HG3 GLN 60 105.996 13.834 -6.719 459 HE21 GLN 60 HE21 GLN 60 102.805 13.251 -5.843 460 HE22 GLN 60 HE22 GLN 60 102.652 11.691 -6.494 461 H ASP 61 H ASP 61 106.224 14.518 -1.885 462 HA ASP 61 HA ASP 61 108.600 13.438 -0.531 463 HB2 ASP 61 HB2 ASP 61 106.094 14.741 0.571 464 HB3 ASP 61 HB3 ASP 61 107.467 14.206 1.536 465 H ILE 62 H ILE 62 108.635 11.376 0.240 466 HA ILE 62 HA ILE 62 106.051 9.927 0.406 467 HB ILE 62 HB ILE 62 107.277 9.402 -1.692 468 HG12 ILE 62 HG12 ILE 62 107.294 6.882 -1.272 469 HG13 ILE 62 HG13 ILE 62 106.905 7.262 0.405 470 HG21 ILE 62 HG21 ILE 62 109.384 8.381 0.229 471 HG22 ILE 62 HG22 ILE 62 109.577 9.653 -0.977 472 HG23 ILE 62 HG23 ILE 62 109.331 7.983 -1.488 473 HD11 ILE 62 HD11 ILE 62 104.956 6.832 -1.302 474 HD12 ILE 62 HD12 ILE 62 105.278 8.492 -1.799 475 HD13 ILE 62 HD13 ILE 62 104.815 8.144 -0.133 476 H SER 63 H SER 63 105.855 8.394 2.039 477 HA SER 63 HA SER 63 108.146 8.002 3.824 478 HB2 SER 63 HB2 SER 63 107.002 8.738 5.788 479 HB3 SER 63 HB3 SER 63 106.859 10.029 4.599 480 HG SER 63 HG SER 63 104.795 9.484 4.335 481 H GLU 64 H GLU 64 107.708 6.379 5.513 482 HA GLU 64 HA GLU 64 106.732 3.999 4.483 483 HB2 GLU 64 HB2 GLU 64 106.822 3.160 6.814 484 HB3 GLU 64 HB3 GLU 64 108.271 4.054 6.362 485 HG2 GLU 64 HG2 GLU 64 107.308 6.086 7.431 486 HG3 GLU 64 HG3 GLU 64 105.941 5.121 7.973 487 H ALA 65 H ALA 65 105.050 6.464 6.381 488 HA ALA 65 HA ALA 65 102.761 4.980 7.050 489 HB1 ALA 65 HB1 ALA 65 103.350 7.896 6.716 490 HB2 ALA 65 HB2 ALA 65 102.872 7.010 8.163 491 HB3 ALA 65 HB3 ALA 65 101.677 7.375 6.917 492 H ASN 66 H ASN 66 103.582 6.791 4.117 493 HA ASN 66 HA ASN 66 100.970 6.647 2.982 494 HB2 ASN 66 HB2 ASN 66 103.614 7.077 1.579 495 HB3 ASN 66 HB3 ASN 66 102.009 7.435 0.941 496 HD21 ASN 66 HD21 ASN 66 100.711 9.083 2.236 497 HD22 ASN 66 HD22 ASN 66 101.558 10.333 3.011 498 H LEU 67 H LEU 67 103.937 4.715 2.483 499 HA LEU 67 HA LEU 67 102.550 3.091 0.510 500 HB2 LEU 67 HB2 LEU 67 105.347 2.724 1.578 501 HB3 LEU 67 HB3 LEU 67 104.660 1.979 0.143 502 HG LEU 67 HG LEU 67 105.168 4.936 0.569 503 HD11 LEU 67 HD11 LEU 67 106.387 3.536 -1.748 504 HD12 LEU 67 HD12 LEU 67 106.988 3.011 -0.184 505 HD13 LEU 67 HD13 LEU 67 107.076 4.711 -0.631 506 HD21 LEU 67 HD21 LEU 67 104.569 4.887 -2.000 507 HD22 LEU 67 HD22 LEU 67 103.282 4.981 -0.797 508 HD23 LEU 67 HD23 LEU 67 103.668 3.436 -1.556 509 H ALA 68 H ALA 68 102.849 2.894 3.900 510 HA ALA 68 HA ALA 68 102.145 1.290 5.372 511 HB1 ALA 68 HB1 ALA 68 100.323 0.068 4.734 512 HB2 ALA 68 HB2 ALA 68 101.100 -0.521 3.264 513 HB3 ALA 68 HB3 ALA 68 100.408 1.101 3.306 514 H TYR 69 H TYR 69 102.108 -1.686 4.612 515 HA TYR 69 HA TYR 69 104.677 -2.309 5.523 516 HB2 TYR 69 HB2 TYR 69 102.768 -4.008 3.920 517 HB3 TYR 69 HB3 TYR 69 104.167 -4.610 4.788 518 HD1 TYR 69 HD1 TYR 69 104.232 -4.434 7.302 519 HD2 TYR 69 HD2 TYR 69 100.706 -3.557 5.012 520 HE1 TYR 69 HE1 TYR 69 102.848 -4.654 9.349 521 HE2 TYR 69 HE2 TYR 69 99.322 -3.777 7.059 522 HH TYR 69 HH TYR 69 100.562 -5.028 9.966 523 H LEU 70 H LEU 70 103.641 -1.515 2.319 524 HA LEU 70 HA LEU 70 105.501 -2.883 0.736 525 HB2 LEU 70 HB2 LEU 70 103.561 -1.588 -0.120 526 HB3 LEU 70 HB3 LEU 70 104.417 -0.099 0.276 527 HG LEU 70 HG LEU 70 106.311 -0.906 -1.195 528 HD11 LEU 70 HD11 LEU 70 104.283 -3.079 -1.652 529 HD12 LEU 70 HD12 LEU 70 106.021 -3.222 -1.399 530 HD13 LEU 70 HD13 LEU 70 105.399 -2.634 -2.941 531 HD21 LEU 70 HD21 LEU 70 103.545 -0.319 -2.233 532 HD22 LEU 70 HD22 LEU 70 104.880 -0.579 -3.355 533 HD23 LEU 70 HD23 LEU 70 104.954 0.740 -2.185 534 H TRP 71 H TRP 71 105.960 -0.137 2.841 535 HA TRP 71 HA TRP 71 108.119 1.157 1.667 536 HB2 TRP 71 HB2 TRP 71 106.764 1.824 3.694 537 HB3 TRP 71 HB3 TRP 71 107.767 0.724 4.621 538 HD1 TRP 71 HD1 TRP 71 109.865 1.728 5.624 539 HE1 TRP 71 HE1 TRP 71 111.211 3.895 5.274 540 HE3 TRP 71 HE3 TRP 71 107.421 3.659 1.576 541 HZ2 TRP 71 HZ2 TRP 71 111.279 6.135 3.495 542 HZ3 TRP 71 HZ3 TRP 71 108.158 5.793 0.567 543 HH2 TRP 71 HH2 TRP 71 110.073 7.038 1.522 544 HA PRO 72 HA PRO 72 110.861 -2.429 2.443 545 HB2 PRO 72 HB2 PRO 72 112.608 -2.126 0.442 546 HB3 PRO 72 HB3 PRO 72 110.931 -2.614 0.121 547 HG2 PRO 72 HG2 PRO 72 112.214 0.045 -0.205 548 HG3 PRO 72 HG3 PRO 72 111.017 -0.766 -1.230 549 HD2 PRO 72 HD2 PRO 72 110.439 1.190 0.681 550 HD3 PRO 72 HD3 PRO 72 109.263 0.062 -0.026 551 H LEU 73 H LEU 73 111.693 0.907 2.642 552 HA LEU 73 HA LEU 73 114.518 0.435 3.204 553 HB2 LEU 73 HB2 LEU 73 112.931 3.007 3.332 554 HB3 LEU 73 HB3 LEU 73 114.686 2.853 3.380 555 HG LEU 73 HG LEU 73 112.931 1.990 1.063 556 HD11 LEU 73 HD11 LEU 73 113.836 3.959 -0.074 557 HD12 LEU 73 HD12 LEU 73 114.808 4.355 1.345 558 HD13 LEU 73 HD13 LEU 73 113.048 4.454 1.430 559 HD21 LEU 73 HD21 LEU 73 114.960 0.656 1.167 560 HD22 LEU 73 HD22 LEU 73 115.940 2.091 1.463 561 HD23 LEU 73 HD23 LEU 73 115.166 1.859 -0.104 562 H THR 74 H THR 74 115.518 0.672 5.129 563 HA THR 74 HA THR 74 114.065 0.368 7.557 564 HB THR 74 HB THR 74 116.250 0.566 8.645 565 HG1 THR 74 HG1 THR 74 117.970 1.195 7.449 566 HG21 THR 74 HG21 THR 74 115.705 -1.577 7.611 567 HG22 THR 74 HG22 THR 74 117.425 -1.244 7.399 568 HG23 THR 74 HG23 THR 74 116.308 -1.008 6.055 569 H VAL 75 H VAL 75 115.644 3.135 5.957 570 HA VAL 75 HA VAL 75 115.156 5.004 8.039 571 HB VAL 75 HB VAL 75 115.319 6.733 6.232 572 HG11 VAL 75 HG11 VAL 75 117.473 4.607 6.098 573 HG12 VAL 75 HG12 VAL 75 117.303 5.760 7.421 574 HG13 VAL 75 HG13 VAL 75 117.668 6.333 5.794 575 HG21 VAL 75 HG21 VAL 75 115.897 6.016 3.964 576 HG22 VAL 75 HG22 VAL 75 114.322 5.362 4.402 577 HG23 VAL 75 HG23 VAL 75 115.746 4.325 4.433 578 H ASP 76 H ASP 76 113.321 6.104 8.597 579 HA ASP 76 HA ASP 76 110.928 4.746 7.953 580 HB2 ASP 76 HB2 ASP 76 111.363 7.367 9.403 581 HB3 ASP 76 HB3 ASP 76 109.825 6.513 9.331 582 H HIS 77 H HIS 77 112.307 7.749 6.699 583 HA HIS 77 HA HIS 77 110.244 7.698 4.632 584 HB2 HIS 77 HB2 HIS 77 109.800 10.128 4.904 585 HB3 HIS 77 HB3 HIS 77 109.197 9.136 6.216 586 HD1 HIS 77 HD1 HIS 77 111.261 8.959 8.236 587 HD2 HIS 77 HD2 HIS 77 110.928 12.400 5.906 588 HE1 HIS 77 HE1 HIS 77 112.393 10.815 9.534 589 H GLY 78 H GLY 78 110.711 9.445 2.970 590 HA2 GLY 78 HA2 GLY 78 113.275 10.676 2.854 591 HA3 GLY 78 HA3 GLY 78 113.211 9.241 1.836 592 H THR 79 H THR 79 113.570 11.793 0.777 593 HA THR 79 HA THR 79 110.964 12.390 -0.500 594 HB THR 79 HB THR 79 113.415 14.151 -0.600 595 HG1 THR 79 HG1 THR 79 112.905 14.834 1.312 596 HG21 THR 79 HG21 THR 79 110.454 14.394 -1.120 597 HG22 THR 79 HG22 THR 79 111.800 14.845 -2.171 598 HG23 THR 79 HG23 THR 79 111.418 15.828 -0.756 599 H ILE 80 H ILE 80 110.763 12.258 -2.709 600 HA ILE 80 HA ILE 80 113.080 11.118 -4.155 601 HB ILE 80 HB ILE 80 111.411 10.206 -5.732 602 HG12 ILE 80 HG12 ILE 80 109.369 11.233 -3.733 603 HG13 ILE 80 HG13 ILE 80 109.655 11.947 -5.317 604 HG21 ILE 80 HG21 ILE 80 110.901 9.534 -2.818 605 HG22 ILE 80 HG22 ILE 80 112.200 8.877 -3.814 606 HG23 ILE 80 HG23 ILE 80 110.519 8.496 -4.193 607 HD11 ILE 80 HD11 ILE 80 109.274 9.458 -6.147 608 HD12 ILE 80 HD12 ILE 80 107.907 10.529 -5.832 609 HD13 ILE 80 HD13 ILE 80 108.388 9.331 -4.627 610 H GLU 81 H GLU 81 113.847 12.102 -5.955 611 HA GLU 81 HA GLU 81 112.390 14.424 -7.012 612 HB2 GLU 81 HB2 GLU 81 115.227 14.540 -5.966 613 HB3 GLU 81 HB3 GLU 81 114.409 15.836 -6.842 614 HG2 GLU 81 HG2 GLU 81 112.653 15.874 -5.081 615 HG3 GLU 81 HG3 GLU 81 113.547 14.652 -4.189 616 H CYS 82 H CYS 82 112.704 14.828 -9.100 617 HA CYS 82 HA CYS 82 114.741 13.260 -10.564 618 HB2 CYS 82 HB2 CYS 82 112.138 14.545 -11.373 619 HB3 CYS 82 HB3 CYS 82 113.368 14.164 -12.579 620 H LEU 83 H LEU 83 116.560 14.324 -11.093 621 HA LEU 83 HA LEU 83 116.624 17.224 -10.734 622 HB2 LEU 83 HB2 LEU 83 118.695 15.074 -10.973 623 HB3 LEU 83 HB3 LEU 83 119.148 16.748 -11.289 624 HG LEU 83 HG LEU 83 117.636 15.980 -8.794 625 HD11 LEU 83 HD11 LEU 83 120.637 16.261 -8.915 626 HD12 LEU 83 HD12 LEU 83 119.860 14.693 -9.138 627 HD13 LEU 83 HD13 LEU 83 119.648 15.576 -7.625 628 HD21 LEU 83 HD21 LEU 83 119.379 18.296 -9.669 629 HD22 LEU 83 HD22 LEU 83 118.892 18.052 -7.993 630 HD23 LEU 83 HD23 LEU 83 117.671 18.339 -9.232 631 HA PRO 84 HA PRO 84 116.506 18.536 -14.915 632 HB2 PRO 84 HB2 PRO 84 119.227 19.727 -14.676 633 HB3 PRO 84 HB3 PRO 84 117.706 20.476 -15.197 634 HG2 PRO 84 HG2 PRO 84 118.737 20.971 -12.802 635 HG3 PRO 84 HG3 PRO 84 116.986 20.838 -13.049 636 HD2 PRO 84 HD2 PRO 84 118.855 18.886 -11.780 637 HD3 PRO 84 HD3 PRO 84 117.147 19.217 -11.415 638 H SER 85 H SER 85 119.198 16.625 -13.862 639 HA SER 85 HA SER 85 120.360 16.277 -16.483 640 HB2 SER 85 HB2 SER 85 121.959 14.899 -15.426 641 HB3 SER 85 HB3 SER 85 121.593 16.167 -14.261 642 HG SER 85 HG SER 85 121.333 14.354 -13.144 643 H ASP 86 H ASP 86 117.511 15.101 -15.334 644 HA ASP 86 HA ASP 86 116.111 13.439 -16.029 645 HB2 ASP 86 HB2 ASP 86 117.192 13.945 -18.282 646 HB3 ASP 86 HB3 ASP 86 118.232 12.557 -17.982 647 H ASN 87 H ASN 87 118.063 13.033 -13.884 648 HA ASN 87 HA ASN 87 118.108 10.068 -13.938 649 HB2 ASN 87 HB2 ASN 87 120.026 10.125 -12.453 650 HB3 ASN 87 HB3 ASN 87 120.384 11.042 -13.912 651 HD21 ASN 87 HD21 ASN 87 121.811 11.499 -11.469 652 HD22 ASN 87 HD22 ASN 87 121.413 13.049 -10.905 653 H ALA 88 H ALA 88 117.184 9.024 -12.252 654 HA ALA 88 HA ALA 88 115.612 10.680 -10.403 655 HB1 ALA 88 HB1 ALA 88 115.377 7.913 -11.504 656 HB2 ALA 88 HB2 ALA 88 114.142 9.159 -11.327 657 HB3 ALA 88 HB3 ALA 88 114.673 8.238 -9.921 658 H VAL 89 H VAL 89 116.142 10.849 -8.309 659 HA VAL 89 HA VAL 89 117.866 8.768 -7.112 660 HB VAL 89 HB VAL 89 119.119 10.538 -5.920 661 HG11 VAL 89 HG11 VAL 89 119.675 9.555 -8.292 662 HG12 VAL 89 HG12 VAL 89 120.590 10.935 -7.687 663 HG13 VAL 89 HG13 VAL 89 119.287 11.183 -8.850 664 HG21 VAL 89 HG21 VAL 89 118.885 12.864 -6.581 665 HG22 VAL 89 HG22 VAL 89 117.297 12.265 -6.101 666 HG23 VAL 89 HG23 VAL 89 117.695 12.436 -7.810 667 H PHE 90 H PHE 90 117.790 8.661 -4.838 668 HA PHE 90 HA PHE 90 115.273 9.637 -3.628 669 HB2 PHE 90 HB2 PHE 90 115.346 7.217 -3.884 670 HB3 PHE 90 HB3 PHE 90 116.917 7.154 -3.117 671 HD1 PHE 90 HD1 PHE 90 113.327 7.979 -2.513 672 HD2 PHE 90 HD2 PHE 90 117.111 6.912 -0.783 673 HE1 PHE 90 HE1 PHE 90 112.224 7.625 -0.312 674 HE2 PHE 90 HE2 PHE 90 116.009 6.548 1.408 675 HZ PHE 90 HZ PHE 90 113.564 6.907 1.641 676 H VAL 91 H VAL 91 115.504 11.011 -1.952 677 HA VAL 91 HA VAL 91 118.165 11.283 -0.692 678 HB VAL 91 HB VAL 91 115.838 13.224 -0.761 679 HG11 VAL 91 HG11 VAL 91 118.639 14.018 -0.046 680 HG12 VAL 91 HG12 VAL 91 117.660 13.242 1.192 681 HG13 VAL 91 HG13 VAL 91 117.105 14.732 0.439 682 HG21 VAL 91 HG21 VAL 91 117.129 14.477 -2.378 683 HG22 VAL 91 HG22 VAL 91 116.983 12.819 -2.963 684 HG23 VAL 91 HG23 VAL 91 118.488 13.363 -2.223 685 H ALA 92 H ALA 92 118.388 10.742 1.411 686 HA ALA 92 HA ALA 92 115.937 9.998 2.896 687 HB1 ALA 92 HB1 ALA 92 118.854 9.284 3.242 688 HB2 ALA 92 HB2 ALA 92 117.508 8.209 2.862 689 HB3 ALA 92 HB3 ALA 92 117.638 8.923 4.469 690 HA PRO 93 HA PRO 93 116.006 13.405 5.703 691 HB2 PRO 93 HB2 PRO 93 116.313 11.496 7.976 692 HB3 PRO 93 HB3 PRO 93 115.113 12.777 7.731 693 HG2 PRO 93 HG2 PRO 93 114.551 10.172 7.399 694 HG3 PRO 93 HG3 PRO 93 113.760 11.460 6.474 695 HD2 PRO 93 HD2 PRO 93 115.740 9.468 5.559 696 HD3 PRO 93 HD3 PRO 93 114.566 10.413 4.624 697 H ASP 94 H ASP 94 118.479 10.949 5.985 698 HA ASP 94 HA ASP 94 120.164 12.286 7.827 699 HB2 ASP 94 HB2 ASP 94 121.920 10.740 6.959 700 HB3 ASP 94 HB3 ASP 94 120.442 9.939 7.473 701 H GLY 95 H GLY 95 119.466 13.089 4.585 702 HA2 GLY 95 HA2 GLY 95 120.281 14.993 3.457 703 HA3 GLY 95 HA3 GLY 95 121.661 15.022 4.550 704 H THR 96 H THR 96 121.126 11.901 3.335 705 HA THR 96 HA THR 96 123.407 12.161 1.503 706 HB THR 96 HB THR 96 122.082 9.695 2.665 707 HG1 THR 96 HG1 THR 96 123.120 10.478 4.315 708 HG21 THR 96 HG21 THR 96 123.210 8.876 0.822 709 HG22 THR 96 HG22 THR 96 124.513 8.851 2.010 710 HG23 THR 96 HG23 THR 96 124.410 10.170 0.843 711 H THR 97 H THR 97 123.200 11.678 -0.654 712 HA THR 97 HA THR 97 120.462 11.112 -1.615 713 HB THR 97 HB THR 97 122.846 12.162 -3.167 714 HG1 THR 97 HG1 THR 97 122.206 13.712 -1.785 715 HG21 THR 97 HG21 THR 97 121.132 12.731 -4.844 716 HG22 THR 97 HG22 THR 97 119.888 12.017 -3.818 717 HG23 THR 97 HG23 THR 97 121.144 10.997 -4.521 718 H TYR 98 H TYR 98 120.019 9.261 -2.542 719 HA TYR 98 HA TYR 98 122.205 7.407 -3.259 720 HB2 TYR 98 HB2 TYR 98 119.375 6.804 -2.390 721 HB3 TYR 98 HB3 TYR 98 120.591 5.610 -2.794 722 HD1 TYR 98 HD2 TYR 98 122.468 5.165 -1.243 723 HD2 TYR 98 HD1 TYR 98 119.364 7.972 -0.275 724 HE1 TYR 98 HE2 TYR 98 123.172 5.128 1.135 725 HE2 TYR 98 HE1 TYR 98 120.078 7.945 2.098 726 HH TYR 98 HH TYR 98 121.682 7.212 3.523 727 H ALA 99 H ALA 99 121.960 6.255 -5.232 728 HA ALA 99 HA ALA 99 120.338 7.651 -7.206 729 HB1 ALA 99 HB1 ALA 99 121.544 5.928 -8.744 730 HB2 ALA 99 HB2 ALA 99 122.543 5.611 -7.325 731 HB3 ALA 99 HB3 ALA 99 122.492 7.229 -8.023 732 H LEU 100 H LEU 100 118.444 6.949 -7.978 733 HA LEU 100 HA LEU 100 117.387 4.399 -7.039 734 HB2 LEU 100 HB2 LEU 100 116.196 6.723 -8.553 735 HB3 LEU 100 HB3 LEU 100 115.331 5.207 -8.327 736 HG LEU 100 HG LEU 100 116.536 6.641 -5.970 737 HD11 LEU 100 HD11 LEU 100 115.093 8.259 -7.175 738 HD12 LEU 100 HD12 LEU 100 114.357 7.761 -5.651 739 HD13 LEU 100 HD13 LEU 100 113.784 7.079 -7.173 740 HD21 LEU 100 HD21 LEU 100 114.125 4.824 -6.308 741 HD22 LEU 100 HD22 LEU 100 114.785 5.404 -4.780 742 HD23 LEU 100 HD23 LEU 100 115.717 4.285 -5.773 743 H ASN 101 H ASN 101 117.974 6.054 -10.137 744 HA ASN 101 HA ASN 101 117.632 3.447 -11.507 745 HB2 ASN 101 HB2 ASN 101 117.076 4.633 -13.492 746 HB3 ASN 101 HB3 ASN 101 116.134 5.323 -12.178 747 HD21 ASN 101 HD21 ASN 101 116.282 7.007 -14.242 748 HD22 ASN 101 HD22 ASN 101 117.441 8.226 -14.011 749 H ASP 102 H ASP 102 118.923 3.245 -13.575 750 HA ASP 102 HA ASP 102 121.548 2.773 -12.789 751 HB2 ASP 102 HB2 ASP 102 120.360 1.639 -14.661 752 HB3 ASP 102 HB3 ASP 102 120.569 3.096 -15.629 753 H ARG 103 H ARG 103 120.237 5.543 -14.597 754 HA ARG 103 HA ARG 103 122.756 6.559 -15.395 755 HB2 ARG 103 HB2 ARG 103 120.066 7.900 -15.101 756 HB3 ARG 103 HB3 ARG 103 121.485 8.684 -15.807 757 HG2 ARG 103 HG2 ARG 103 121.670 6.798 -17.433 758 HG3 ARG 103 HG3 ARG 103 120.175 6.130 -16.783 759 HD2 ARG 103 HD2 ARG 103 120.485 8.846 -18.089 760 HD3 ARG 103 HD3 ARG 103 119.720 7.435 -18.810 761 HE ARG 103 HE ARG 103 118.526 9.247 -16.958 762 HH11 ARG 103 HH11 ARG 103 118.551 5.844 -17.823 763 HH12 ARG 103 HH12 ARG 103 116.950 5.584 -17.216 764 HH21 ARG 103 HH21 ARG 103 116.504 8.863 -16.209 765 HH22 ARG 103 HH22 ARG 103 115.793 7.283 -16.305 766 H ALA 104 H ALA 104 120.713 7.292 -12.569 767 HA ALA 104 HA ALA 104 122.329 9.264 -11.422 768 HB1 ALA 104 HB1 ALA 104 121.331 8.480 -9.245 769 HB2 ALA 104 HB2 ALA 104 120.577 7.160 -10.140 770 HB3 ALA 104 HB3 ALA 104 120.152 8.831 -10.508 771 H GLU 105 H GLU 105 122.566 5.721 -11.226 772 HA GLU 105 HA GLU 105 124.732 5.619 -9.420 773 HB2 GLU 105 HB2 GLU 105 124.001 3.706 -11.651 774 HB3 GLU 105 HB3 GLU 105 125.161 3.368 -10.368 775 HG2 GLU 105 HG2 GLU 105 123.377 3.762 -8.683 776 HG3 GLU 105 HG3 GLU 105 122.224 4.007 -9.988 777 H LYS 106 H LYS 106 124.648 5.875 -12.962 778 HA LYS 106 HA LYS 106 127.400 5.795 -13.461 779 HB2 LYS 106 HB2 LYS 106 125.620 5.770 -15.205 780 HB3 LYS 106 HB3 LYS 106 125.344 7.484 -14.903 781 HG2 LYS 106 HG2 LYS 106 126.818 7.416 -16.765 782 HG3 LYS 106 HG3 LYS 106 127.845 7.815 -15.390 783 HD2 LYS 106 HD2 LYS 106 128.540 5.475 -15.190 784 HD3 LYS 106 HD3 LYS 106 127.452 5.021 -16.502 785 HE2 LYS 106 HE2 LYS 106 129.570 7.125 -16.911 786 HE3 LYS 106 HE3 LYS 106 129.953 5.411 -17.077 787 HZ1 LYS 106 HZ1 LYS 106 127.815 5.443 -18.551 788 HZ2 LYS 106 HZ2 LYS 106 129.316 5.914 -19.193 789 HZ3 LYS 106 HZ3 LYS 106 128.189 7.090 -18.710 790 H ALA 107 H ALA 107 125.368 8.426 -12.323 791 HA ALA 107 HA ALA 107 127.337 10.486 -12.544 792 HB1 ALA 107 HB1 ALA 107 125.062 10.586 -10.596 793 HB2 ALA 107 HB2 ALA 107 124.751 10.665 -12.331 794 HB3 ALA 107 HB3 ALA 107 125.764 11.885 -11.560 795 H GLY 108 H GLY 108 127.519 7.849 -10.615 796 HA2 GLY 108 HA2 GLY 108 128.908 7.361 -8.879 797 HA3 GLY 108 HA3 GLY 108 129.437 9.032 -8.875 798 H HIS 109 H HIS 109 126.012 8.377 -8.502 799 HA HIS 109 HA HIS 109 126.126 9.176 -5.715 800 HB2 HIS 109 HB2 HIS 109 123.964 8.694 -7.715 801 HB3 HIS 109 HB3 HIS 109 123.558 8.660 -6.010 802 HD1 HIS 109 HD1 HIS 109 125.440 10.993 -5.095 803 HD2 HIS 109 HD2 HIS 109 122.868 11.165 -8.372 804 HE1 HIS 109 HE1 HIS 109 124.983 13.447 -5.517 805 HA PRO 110 HA PRO 110 126.483 4.802 -4.580 806 HB2 PRO 110 HB2 PRO 110 125.408 5.561 -1.919 807 HB3 PRO 110 HB3 PRO 110 126.942 4.775 -2.336 808 HG2 PRO 110 HG2 PRO 110 126.834 7.308 -1.516 809 HG3 PRO 110 HG3 PRO 110 128.012 6.759 -2.721 810 HD2 PRO 110 HD2 PRO 110 125.489 8.321 -3.138 811 HD3 PRO 110 HD3 PRO 110 127.053 8.458 -3.972 812 HA PRO 111 HA PRO 111 122.227 3.545 -4.990 813 HB2 PRO 111 HB2 PRO 111 122.362 0.885 -4.417 814 HB3 PRO 111 HB3 PRO 111 122.983 1.584 -5.924 815 HG2 PRO 111 HG2 PRO 111 124.446 0.655 -3.534 816 HG3 PRO 111 HG3 PRO 111 124.929 0.642 -5.237 817 HD2 PRO 111 HD2 PRO 111 125.790 2.496 -3.333 818 HD3 PRO 111 HD3 PRO 111 125.898 2.699 -5.093 819 H ILE 112 H ILE 112 120.337 2.836 -3.806 820 HA ILE 112 HA ILE 112 120.292 3.681 -1.119 821 HB ILE 112 HB ILE 112 118.248 2.026 -2.626 822 HG12 ILE 112 HG12 ILE 112 118.363 5.003 -2.084 823 HG13 ILE 112 HG13 ILE 112 118.900 4.273 -3.594 824 HG21 ILE 112 HG21 ILE 112 116.674 3.065 -0.917 825 HG22 ILE 112 HG22 ILE 112 118.101 3.596 -0.032 826 HG23 ILE 112 HG23 ILE 112 117.788 1.876 -0.251 827 HD11 ILE 112 HD11 ILE 112 116.542 5.162 -3.656 828 HD12 ILE 112 HD12 ILE 112 116.104 3.947 -2.459 829 HD13 ILE 112 HD13 ILE 112 116.668 3.449 -4.056 830 H THR 113 H THR 113 121.495 0.732 -2.295 831 HA THR 113 HA THR 113 120.358 -1.210 -0.787 832 HB THR 113 HB THR 113 122.129 -1.476 -2.553 833 HG1 THR 113 HG1 THR 113 122.145 -3.427 -1.859 834 HG21 THR 113 HG21 THR 113 124.426 -1.954 -1.604 835 HG22 THR 113 HG22 THR 113 123.936 -1.087 -0.152 836 HG23 THR 113 HG23 THR 113 124.001 -0.250 -1.702 837 HA PRO 114 HA PRO 114 123.386 -0.572 2.927 838 HB2 PRO 114 HB2 PRO 114 123.247 2.362 3.326 839 HB3 PRO 114 HB3 PRO 114 124.636 1.266 3.462 840 HG2 PRO 114 HG2 PRO 114 124.410 2.953 1.427 841 HG3 PRO 114 HG3 PRO 114 125.078 1.324 1.209 842 HD2 PRO 114 HD2 PRO 114 122.326 2.328 0.545 843 HD3 PRO 114 HD3 PRO 114 123.381 1.260 -0.399 844 H ILE 115 H ILE 115 120.641 1.558 2.303 845 HA ILE 115 HA ILE 115 119.633 1.112 5.027 846 HB ILE 115 HB ILE 115 117.875 2.797 4.366 847 HG12 ILE 115 HG12 ILE 115 119.780 3.407 2.092 848 HG13 ILE 115 HG13 ILE 115 118.280 2.508 1.875 849 HG21 ILE 115 HG21 ILE 115 120.799 3.319 4.684 850 HG22 ILE 115 HG22 ILE 115 119.459 3.682 5.772 851 HG23 ILE 115 HG23 ILE 115 119.736 4.687 4.352 852 HD11 ILE 115 HD11 ILE 115 118.124 5.124 3.318 853 HD12 ILE 115 HD12 ILE 115 116.953 4.362 2.241 854 HD13 ILE 115 HD13 ILE 115 118.375 5.164 1.571 855 H ARG 116 H ARG 116 119.417 -0.656 2.318 856 HA ARG 116 HA ARG 116 116.567 -1.002 2.109 857 HB2 ARG 116 HB2 ARG 116 118.172 -1.425 0.239 858 HB3 ARG 116 HB3 ARG 116 118.783 -2.818 1.131 859 HG2 ARG 116 HG2 ARG 116 116.475 -3.766 1.157 860 HG3 ARG 116 HG3 ARG 116 115.940 -2.414 0.158 861 HD2 ARG 116 HD2 ARG 116 118.094 -4.409 -0.597 862 HD3 ARG 116 HD3 ARG 116 116.448 -4.400 -1.222 863 HE ARG 116 HE ARG 116 117.447 -1.874 -1.732 864 HH11 ARG 116 HH11 ARG 116 118.364 -5.141 -2.634 865 HH12 ARG 116 HH12 ARG 116 119.079 -4.635 -4.127 866 HH21 ARG 116 HH21 ARG 116 118.384 -1.283 -3.668 867 HH22 ARG 116 HH22 ARG 116 119.090 -2.479 -4.705 868 H ALA 117 H ALA 117 115.293 -2.586 3.035 869 HA ALA 117 HA ALA 117 116.363 -3.839 5.421 870 HB1 ALA 117 HB1 ALA 117 113.584 -4.281 4.399 871 HB2 ALA 117 HB2 ALA 117 114.027 -2.702 5.051 872 HB3 ALA 117 HB3 ALA 117 114.152 -4.142 6.063 873 H LYS 118 H LYS 118 116.622 -5.998 5.787 874 HA LYS 118 HA LYS 118 116.468 -7.799 3.485 875 HB2 LYS 118 HB2 LYS 118 118.445 -7.732 5.101 876 HB3 LYS 118 HB3 LYS 118 117.377 -8.491 6.282 877 HG2 LYS 118 HG2 LYS 118 116.894 -10.236 4.439 878 HG3 LYS 118 HG3 LYS 118 118.331 -9.594 3.641 879 HD2 LYS 118 HD2 LYS 118 118.323 -10.540 6.517 880 HD3 LYS 118 HD3 LYS 118 118.755 -11.582 5.159 881 HE2 LYS 118 HE2 LYS 118 120.552 -10.036 4.517 882 HE3 LYS 118 HE3 LYS 118 120.113 -8.958 5.843 883 HZ1 LYS 118 HZ1 LYS 118 120.466 -10.992 7.310 884 HZ2 LYS 118 HZ2 LYS 118 121.848 -10.229 6.684 885 HZ3 LYS 118 HZ3 LYS 118 121.279 -11.668 5.984 886 H GLY 119 H GLY 119 115.058 -9.518 3.340 887 HA2 GLY 119 HA2 GLY 119 112.809 -9.464 5.247 888 HA3 GLY 119 HA3 GLY 119 112.740 -10.083 3.611 889 H SER 120 H SER 120 111.742 -11.633 5.619 890 HA SER 120 HA SER 120 113.493 -13.458 6.828 891 HB2 SER 120 HB2 SER 120 110.702 -14.006 5.793 892 HB3 SER 120 HB3 SER 120 111.567 -14.936 7.014 893 HG SER 120 HG SER 120 111.482 -13.139 8.308 894 H GLY 121 H GLY 121 112.042 -13.444 3.597 895 HA2 GLY 121 HA2 GLY 121 114.084 -15.378 2.743 896 HA3 GLY 121 HA3 GLY 121 112.393 -15.732 2.393 897 H GLY 122 H GLY 122 114.178 -15.503 0.320 898 HA2 GLY 122 HA2 GLY 122 114.187 -14.551 -1.788 899 HA3 GLY 122 HA3 GLY 122 112.973 -13.407 -1.233 900 H GLY 123 H GLY 123 116.038 -13.799 0.440 901 HA2 GLY 123 HA2 GLY 123 117.855 -12.412 0.684 902 HA3 GLY 123 HA3 GLY 123 117.537 -11.853 -0.954 903 H TYR 124 H TYR 124 117.178 -9.750 -1.109 904 HA TYR 124 HA TYR 124 116.261 -8.282 1.281 905 HB2 TYR 124 HB2 TYR 124 117.944 -7.552 -1.087 906 HB3 TYR 124 HB3 TYR 124 117.133 -6.306 -0.156 907 HD1 TYR 124 HD1 TYR 124 118.848 -9.482 0.849 908 HD2 TYR 124 HD2 TYR 124 118.717 -5.200 1.149 909 HE1 TYR 124 HE1 TYR 124 120.710 -9.540 2.487 910 HE2 TYR 124 HE2 TYR 124 120.573 -5.258 2.795 911 HH TYR 124 HH TYR 124 121.498 -7.856 4.400 912 H ILE 125 H ILE 125 114.827 -6.468 0.978 913 HA ILE 125 HA ILE 125 112.583 -7.253 -0.656 914 HB ILE 125 HB ILE 125 112.989 -4.903 1.214 915 HG12 ILE 125 HG12 ILE 125 111.489 -7.503 1.633 916 HG13 ILE 125 HG13 ILE 125 113.139 -7.232 2.188 917 HG21 ILE 125 HG21 ILE 125 110.399 -6.056 0.144 918 HG22 ILE 125 HG22 ILE 125 111.165 -4.605 -0.506 919 HG23 ILE 125 HG23 ILE 125 110.593 -4.628 1.161 920 HD11 ILE 125 HD11 ILE 125 112.002 -5.046 3.254 921 HD12 ILE 125 HD12 ILE 125 112.027 -6.598 4.091 922 HD13 ILE 125 HD13 ILE 125 110.583 -6.094 3.211 923 H SER 126 H SER 126 111.885 -6.370 -2.502 924 HA SER 126 HA SER 126 113.714 -4.961 -4.139 925 HB2 SER 126 HB2 SER 126 110.754 -5.434 -4.524 926 HB3 SER 126 HB3 SER 126 111.884 -4.913 -5.770 927 HG SER 126 HG SER 126 111.482 -7.358 -4.724 928 H LEU 127 H LEU 127 113.927 -2.900 -4.700 929 HA LEU 127 HA LEU 127 112.240 -0.871 -3.425 930 HB2 LEU 127 HB2 LEU 127 114.655 -0.517 -5.212 931 HB3 LEU 127 HB3 LEU 127 113.864 0.733 -4.256 932 HG LEU 127 HG LEU 127 115.211 -1.738 -3.123 933 HD11 LEU 127 HD11 LEU 127 116.838 -0.161 -4.051 934 HD12 LEU 127 HD12 LEU 127 116.886 -0.095 -2.290 935 HD13 LEU 127 HD13 LEU 127 116.063 1.173 -3.198 936 HD21 LEU 127 HD21 LEU 127 114.975 -0.216 -1.003 937 HD22 LEU 127 HD22 LEU 127 113.575 -1.140 -1.547 938 HD23 LEU 127 HD23 LEU 127 113.700 0.577 -1.928 939 H GLY 128 H GLY 128 111.686 -2.694 -6.028 940 HA2 GLY 128 HA2 GLY 128 111.618 -1.181 -8.312 941 HA3 GLY 128 HA3 GLY 128 110.433 -2.426 -7.947 942 H ALA 129 H ALA 129 109.108 -1.206 -5.767 943 HA ALA 129 HA ALA 129 107.206 0.327 -7.163 944 HB1 ALA 129 HB1 ALA 129 107.572 0.505 -4.181 945 HB2 ALA 129 HB2 ALA 129 106.967 -0.968 -4.937 946 HB3 ALA 129 HB3 ALA 129 106.076 0.543 -5.114 947 H LEU 130 H LEU 130 109.751 1.344 -4.889 948 HA LEU 130 HA LEU 130 109.137 4.086 -4.885 949 HB2 LEU 130 HB2 LEU 130 110.667 2.964 -3.278 950 HB3 LEU 130 HB3 LEU 130 111.858 2.798 -4.568 951 HG LEU 130 HG LEU 130 111.747 5.311 -4.861 952 HD11 LEU 130 HD11 LEU 130 109.720 5.955 -3.859 953 HD12 LEU 130 HD12 LEU 130 110.920 6.437 -2.659 954 HD13 LEU 130 HD13 LEU 130 109.997 4.951 -2.436 955 HD21 LEU 130 HD21 LEU 130 113.402 3.895 -3.378 956 HD22 LEU 130 HD22 LEU 130 112.554 4.665 -2.037 957 HD23 LEU 130 HD23 LEU 130 113.390 5.652 -3.235 958 H LEU 131 H LEU 131 111.246 2.169 -6.993 959 HA LEU 131 HA LEU 131 112.402 4.301 -8.415 960 HB2 LEU 131 HB2 LEU 131 113.206 1.955 -8.510 961 HB3 LEU 131 HB3 LEU 131 111.763 1.515 -9.419 962 HG LEU 131 HG LEU 131 112.440 3.261 -11.136 963 HD11 LEU 131 HD11 LEU 131 113.952 4.664 -10.004 964 HD12 LEU 131 HD12 LEU 131 115.004 3.683 -11.024 965 HD13 LEU 131 HD13 LEU 131 114.835 3.305 -9.310 966 HD21 LEU 131 HD21 LEU 131 114.039 0.787 -10.521 967 HD22 LEU 131 HD22 LEU 131 114.464 1.788 -11.910 968 HD23 LEU 131 HD23 LEU 131 112.863 1.056 -11.808 969 H SER 132 H SER 132 109.427 2.455 -9.007 970 HA SER 132 HA SER 132 108.822 3.541 -11.522 971 HB2 SER 132 HB2 SER 132 106.861 2.630 -9.402 972 HB3 SER 132 HB3 SER 132 106.545 2.775 -11.128 973 HG SER 132 HG SER 132 107.785 1.060 -11.449 974 H THR 133 H THR 133 107.963 4.645 -8.257 975 HA THR 133 HA THR 133 106.220 6.715 -9.051 976 HB THR 133 HB THR 133 107.996 6.664 -6.599 977 HG1 THR 133 HG1 THR 133 105.401 5.713 -6.874 978 HG21 THR 133 HG21 THR 133 105.325 7.995 -7.133 979 HG22 THR 133 HG22 THR 133 106.880 8.827 -7.087 980 HG23 THR 133 HG23 THR 133 106.241 8.070 -5.627 981 H THR 134 H THR 134 109.716 6.760 -8.362 982 HA THR 134 HA THR 134 110.032 9.545 -8.736 983 HB THR 134 HB THR 134 112.155 7.452 -9.230 984 HG1 THR 134 HG1 THR 134 111.142 8.541 -6.884 985 HG21 THR 134 HG21 THR 134 113.631 9.278 -8.421 986 HG22 THR 134 HG22 THR 134 112.228 10.339 -8.293 987 HG23 THR 134 HG23 THR 134 112.746 9.749 -9.873 988 H LEU 135 H LEU 135 110.266 6.826 -11.010 989 HA LEU 135 HA LEU 135 111.260 8.265 -13.209 990 HB2 LEU 135 HB2 LEU 135 109.482 5.820 -13.101 991 HB3 LEU 135 HB3 LEU 135 110.223 6.437 -14.579 992 HG LEU 135 HG LEU 135 111.811 5.711 -12.105 993 HD11 LEU 135 HD11 LEU 135 111.085 4.087 -14.554 994 HD12 LEU 135 HD12 LEU 135 110.833 3.660 -12.861 995 HD13 LEU 135 HD13 LEU 135 112.466 3.695 -13.529 996 HD21 LEU 135 HD21 LEU 135 113.115 7.152 -13.430 997 HD22 LEU 135 HD22 LEU 135 112.449 6.521 -14.936 998 HD23 LEU 135 HD23 LEU 135 113.595 5.554 -14.007 999 H ASN 136 H ASN 136 107.937 7.737 -12.079 1000 HA ASN 136 HA ASN 136 106.582 8.888 -14.246 1001 HB2 ASN 136 HB2 ASN 136 105.867 8.881 -11.305 1002 HB3 ASN 136 HB3 ASN 136 104.762 9.331 -12.602 1003 HD21 ASN 136 HD21 ASN 136 104.348 7.061 -10.816 1004 HD22 ASN 136 HD22 ASN 136 104.388 5.660 -11.772 1005 H LEU 137 H LEU 137 107.911 10.366 -11.309 1006 HA LEU 137 HA LEU 137 107.112 13.018 -11.845 1007 HB2 LEU 137 HB2 LEU 137 109.584 12.086 -10.367 1008 HB3 LEU 137 HB3 LEU 137 108.840 13.679 -10.249 1009 HG LEU 137 HG LEU 137 107.489 11.067 -9.502 1010 HD11 LEU 137 HD11 LEU 137 109.045 11.413 -7.791 1011 HD12 LEU 137 HD12 LEU 137 107.640 12.286 -7.181 1012 HD13 LEU 137 HD13 LEU 137 108.966 13.169 -7.938 1013 HD21 LEU 137 HD21 LEU 137 105.841 12.688 -10.211 1014 HD22 LEU 137 HD22 LEU 137 106.638 13.973 -9.302 1015 HD23 LEU 137 HD23 LEU 137 105.826 12.661 -8.450 1016 H CYS 138 H CYS 138 110.013 11.223 -12.787 1017 HA CYS 138 HA CYS 138 111.446 13.313 -13.974 1018 HB2 CYS 138 HB2 CYS 138 111.382 10.345 -14.327 1019 HB3 CYS 138 HB3 CYS 138 112.294 11.316 -15.479 1020 H GLY 139 H GLY 139 108.623 11.605 -15.152 1021 HA2 GLY 139 HA2 GLY 139 107.235 12.308 -16.900 1022 HA3 GLY 139 HA3 GLY 139 108.497 13.407 -17.434 1023 H LYS 140 H LYS 140 109.351 10.073 -16.856 1024 HA LYS 140 HA LYS 140 110.114 9.738 -19.614 1025 HB2 LYS 140 HB2 LYS 140 111.413 8.787 -17.705 1026 HB3 LYS 140 HB3 LYS 140 110.071 7.689 -17.385 1027 HG2 LYS 140 HG2 LYS 140 111.583 6.436 -18.721 1028 HG3 LYS 140 HG3 LYS 140 110.310 6.939 -19.830 1029 HD2 LYS 140 HD2 LYS 140 111.688 8.796 -20.626 1030 HD3 LYS 140 HD3 LYS 140 112.948 8.387 -19.461 1031 HE2 LYS 140 HE2 LYS 140 113.483 7.494 -21.700 1032 HE3 LYS 140 HE3 LYS 140 113.242 6.192 -20.536 1033 HZ1 LYS 140 HZ1 LYS 140 111.149 5.710 -21.395 1034 HZ2 LYS 140 HZ2 LYS 140 112.091 5.997 -22.779 1035 HZ3 LYS 140 HZ3 LYS 140 111.023 7.191 -22.211 1036 H GLY 141 H GLY 141 109.055 8.686 -21.198 1037 HA2 GLY 141 HA2 GLY 141 107.464 7.400 -22.274 1038 HA3 GLY 141 HA3 GLY 141 107.003 6.741 -20.707 Start of MODEL 16 1 H1 HIS -5 HT1 HIS -5 70.324 1.029 -24.743 2 H2 HIS -5 HT2 HIS -5 71.067 2.267 -25.639 3 H3 HIS -5 HT3 HIS -5 70.328 2.618 -24.150 4 HA HIS -5 HA HIS -5 72.794 2.520 -24.053 5 HB2 HIS -5 HB2 HIS -5 71.206 0.505 -22.449 6 HB3 HIS -5 HB3 HIS -5 72.815 1.063 -22.033 7 HD1 HIS -5 HD1 HIS -5 69.219 2.077 -22.014 8 HD2 HIS -5 HD2 HIS -5 72.905 3.728 -20.982 9 HE1 HIS -5 HE1 HIS -5 68.717 4.162 -20.671 10 H HIS -4 H HIS -4 74.625 1.397 -24.522 11 HA HIS -4 HA HIS -4 74.325 -1.342 -25.617 12 HB2 HIS -4 HB2 HIS -4 74.735 0.339 -27.384 13 HB3 HIS -4 HB3 HIS -4 76.203 0.830 -26.560 14 HD1 HIS -4 HD1 HIS -4 74.731 -2.405 -27.965 15 HD2 HIS -4 HD2 HIS -4 78.407 -0.480 -27.556 16 HE1 HIS -4 HE1 HIS -4 76.441 -3.877 -29.114 17 H HIS -3 H HIS -3 75.665 -2.845 -24.815 18 HA HIS -3 HA HIS -3 77.959 -1.962 -23.160 19 HB2 HIS -3 HB2 HIS -3 76.043 -2.697 -21.762 20 HB3 HIS -3 HB3 HIS -3 76.084 -4.254 -22.567 21 HD1 HIS -3 HD1 HIS -3 78.537 -2.047 -20.638 22 HD2 HIS -3 HD2 HIS -3 77.579 -6.072 -21.146 23 HE1 HIS -3 HE1 HIS -3 80.054 -3.345 -19.082 24 H HIS -2 H HIS -2 79.812 -3.154 -23.339 25 HA HIS -2 HA HIS -2 79.789 -5.391 -25.285 26 HB2 HIS -2 HB2 HIS -2 80.787 -3.362 -26.245 27 HB3 HIS -2 HB3 HIS -2 81.904 -3.269 -24.898 28 HD1 HIS -2 HD1 HIS -2 83.949 -4.817 -24.941 29 HD2 HIS -2 HD2 HIS -2 81.344 -5.457 -28.133 30 HE1 HIS -2 HE1 HIS -2 85.167 -6.327 -26.568 31 H HIS -1 H HIS -1 80.958 -7.181 -24.774 32 HA HIS -1 HA HIS -1 82.232 -7.225 -22.100 33 HB2 HIS -1 HB2 HIS -1 80.956 -9.446 -23.701 34 HB3 HIS -1 HB3 HIS -1 81.797 -9.669 -22.179 35 HD1 HIS -1 HD1 HIS -1 80.675 -8.352 -20.073 36 HD2 HIS -1 HD2 HIS -1 78.274 -8.832 -23.447 37 HE1 HIS -1 HE1 HIS -1 78.293 -7.960 -19.317 38 H HIS 0 H HIS 0 84.292 -7.932 -21.892 39 HA HIS 0 HA HIS 0 85.688 -8.870 -24.336 40 HB2 HIS 0 HB2 HIS 0 86.295 -6.549 -23.738 41 HB3 HIS 0 HB3 HIS 0 86.781 -7.099 -22.145 42 HD1 HIS 0 HD1 HIS 0 87.646 -7.928 -25.775 43 HD2 HIS 0 HD2 HIS 0 89.480 -7.622 -22.045 44 HE1 HIS 0 HE1 HIS 0 90.111 -8.359 -26.153 45 H SER 1 H SER 1 86.817 -10.707 -24.134 46 HA SER 1 HA SER 1 87.233 -11.808 -21.411 47 HB2 SER 1 HB2 SER 1 85.495 -13.022 -22.714 48 HB3 SER 1 HB3 SER 1 86.694 -13.342 -23.964 49 HG SER 1 HG SER 1 86.567 -15.020 -22.456 50 H SER 2 H SER 2 89.191 -12.727 -20.957 51 HA SER 2 HA SER 2 91.276 -12.553 -23.060 52 HB2 SER 2 HB2 SER 2 91.533 -10.850 -21.262 53 HB3 SER 2 HB3 SER 2 91.617 -12.151 -20.079 54 HG SER 2 HG SER 2 93.553 -11.202 -21.503 55 H GLY 3 H GLY 3 92.653 -14.263 -23.286 56 HA2 GLY 3 HA2 GLY 3 91.832 -16.765 -22.047 57 HA3 GLY 3 HA3 GLY 3 93.014 -16.574 -23.338 58 H LEU 4 H LEU 4 93.952 -18.264 -21.699 59 HA LEU 4 HA LEU 4 95.370 -16.983 -19.483 60 HB2 LEU 4 HB2 LEU 4 95.242 -19.871 -20.382 61 HB3 LEU 4 HB3 LEU 4 96.127 -19.295 -18.969 62 HG LEU 4 HG LEU 4 93.807 -18.209 -18.332 63 HD11 LEU 4 HD11 LEU 4 92.434 -18.670 -20.166 64 HD12 LEU 4 HD12 LEU 4 92.029 -19.996 -19.077 65 HD13 LEU 4 HD13 LEU 4 93.140 -20.266 -20.419 66 HD21 LEU 4 HD21 LEU 4 93.286 -20.189 -17.020 67 HD22 LEU 4 HD22 LEU 4 95.038 -20.021 -17.103 68 HD23 LEU 4 HD23 LEU 4 94.217 -21.208 -18.118 69 H VAL 5 H VAL 5 97.565 -16.701 -19.399 70 HA VAL 5 HA VAL 5 98.938 -16.386 -21.851 71 HB VAL 5 HB VAL 5 100.046 -16.467 -19.031 72 HG11 VAL 5 HG11 VAL 5 101.749 -16.712 -20.848 73 HG12 VAL 5 HG12 VAL 5 101.924 -15.211 -19.939 74 HG13 VAL 5 HG13 VAL 5 101.181 -15.191 -21.538 75 HG21 VAL 5 HG21 VAL 5 99.145 -14.129 -20.744 76 HG22 VAL 5 HG22 VAL 5 99.829 -14.021 -19.122 77 HG23 VAL 5 HG23 VAL 5 98.256 -14.779 -19.366 78 HA PRO 6 HA PRO 6 100.552 -20.590 -21.928 79 HB2 PRO 6 HB2 PRO 6 102.067 -20.481 -24.154 80 HB3 PRO 6 HB3 PRO 6 100.299 -20.369 -24.229 81 HG2 PRO 6 HG2 PRO 6 102.330 -18.266 -24.571 82 HG3 PRO 6 HG3 PRO 6 100.702 -18.394 -25.255 83 HD2 PRO 6 HD2 PRO 6 101.494 -16.846 -22.997 84 HD3 PRO 6 HD3 PRO 6 99.843 -17.104 -23.600 85 H ARG 7 H ARG 7 102.883 -21.632 -22.477 86 HA ARG 7 HA ARG 7 104.614 -20.950 -20.377 87 HB2 ARG 7 HB2 ARG 7 105.187 -22.470 -22.934 88 HB3 ARG 7 HB3 ARG 7 106.254 -22.423 -21.529 89 HG2 ARG 7 HG2 ARG 7 104.439 -23.371 -20.133 90 HG3 ARG 7 HG3 ARG 7 103.402 -23.458 -21.558 91 HD2 ARG 7 HD2 ARG 7 104.382 -25.637 -21.257 92 HD3 ARG 7 HD3 ARG 7 105.164 -24.895 -22.650 93 HE ARG 7 HE ARG 7 107.146 -24.994 -21.487 94 HH11 ARG 7 HH11 ARG 7 104.543 -25.072 -19.133 95 HH12 ARG 7 HH12 ARG 7 105.624 -25.289 -17.797 96 HH21 ARG 7 HH21 ARG 7 108.488 -25.274 -19.728 97 HH22 ARG 7 HH22 ARG 7 107.829 -25.402 -18.130 98 H GLY 8 H GLY 8 106.630 -19.902 -20.348 99 HA2 GLY 8 HA2 GLY 8 106.792 -17.470 -21.702 100 HA3 GLY 8 HA3 GLY 8 108.139 -18.247 -20.879 101 H SER 9 H SER 9 107.307 -16.968 -23.725 102 HA SER 9 HA SER 9 109.327 -18.518 -25.164 103 HB2 SER 9 HB2 SER 9 107.929 -18.908 -27.091 104 HB3 SER 9 HB3 SER 9 107.102 -19.558 -25.679 105 HG SER 9 HG SER 9 106.542 -17.314 -27.174 106 H GLY 10 H GLY 10 109.962 -17.428 -27.209 107 HA2 GLY 10 HA2 GLY 10 110.440 -14.669 -26.796 108 HA3 GLY 10 HA3 GLY 10 110.743 -15.550 -28.292 109 H MET 11 H MET 11 108.982 -13.091 -26.944 110 HA MET 11 HA MET 11 107.028 -13.153 -29.159 111 HB2 MET 11 HB2 MET 11 106.455 -12.456 -26.271 112 HB3 MET 11 HB3 MET 11 105.331 -12.207 -27.607 113 HG2 MET 11 HG2 MET 11 105.505 -14.664 -28.122 114 HG3 MET 11 HG3 MET 11 106.451 -14.854 -26.646 115 HE1 MET 11 HE1 MET 11 104.826 -12.576 -24.708 116 HE2 MET 11 HE2 MET 11 105.805 -14.020 -24.458 117 HE3 MET 11 HE3 MET 11 104.170 -13.947 -23.804 118 H LYS 12 H LYS 12 106.130 -11.015 -29.653 119 HA LYS 12 HA LYS 12 108.201 -9.010 -29.615 120 HB2 LYS 12 HB2 LYS 12 106.756 -7.754 -31.088 121 HB3 LYS 12 HB3 LYS 12 106.770 -9.436 -31.604 122 HG2 LYS 12 HG2 LYS 12 104.631 -9.788 -30.350 123 HG3 LYS 12 HG3 LYS 12 104.602 -8.062 -29.987 124 HD2 LYS 12 HD2 LYS 12 104.756 -7.660 -32.500 125 HD3 LYS 12 HD3 LYS 12 104.431 -9.382 -32.703 126 HE2 LYS 12 HE2 LYS 12 102.285 -8.430 -32.816 127 HE3 LYS 12 HE3 LYS 12 102.398 -8.951 -31.135 128 HZ1 LYS 12 HZ1 LYS 12 103.349 -6.267 -31.788 129 HZ2 LYS 12 HZ2 LYS 12 102.573 -6.834 -30.387 130 HZ3 LYS 12 HZ3 LYS 12 101.671 -6.520 -31.792 131 H GLU 13 H GLU 13 107.639 -6.705 -29.071 132 HA GLU 13 HA GLU 13 106.980 -6.528 -26.329 133 HB2 GLU 13 HB2 GLU 13 107.165 -4.375 -28.445 134 HB3 GLU 13 HB3 GLU 13 106.956 -4.053 -26.725 135 HG2 GLU 13 HG2 GLU 13 109.286 -3.900 -27.040 136 HG3 GLU 13 HG3 GLU 13 109.053 -5.516 -26.384 137 H THR 14 H THR 14 105.157 -5.833 -25.269 138 HA THR 14 HA THR 14 102.689 -5.607 -26.899 139 HB THR 14 HB THR 14 101.489 -6.747 -25.108 140 HG1 THR 14 HG1 THR 14 102.696 -6.234 -23.367 141 HG21 THR 14 HG21 THR 14 103.938 -8.409 -25.696 142 HG22 THR 14 HG22 THR 14 102.762 -8.018 -26.952 143 HG23 THR 14 HG23 THR 14 102.265 -8.941 -25.535 144 H ALA 15 H ALA 15 100.915 -4.468 -25.751 145 HA ALA 15 HA ALA 15 101.694 -1.896 -24.951 146 HB1 ALA 15 HB1 ALA 15 99.516 -1.994 -25.755 147 HB2 ALA 15 HB2 ALA 15 99.242 -1.880 -24.016 148 HB3 ALA 15 HB3 ALA 15 99.129 -3.443 -24.826 149 H ALA 16 H ALA 16 101.704 -0.860 -22.944 150 HA ALA 16 HA ALA 16 102.820 -2.270 -20.795 151 HB1 ALA 16 HB1 ALA 16 103.196 0.076 -20.902 152 HB2 ALA 16 HB2 ALA 16 102.201 -0.183 -19.470 153 HB3 ALA 16 HB3 ALA 16 101.468 0.425 -20.955 154 H ALA 17 H ALA 17 101.992 -2.942 -18.809 155 HA ALA 17 HA ALA 17 99.486 -4.201 -18.837 156 HB1 ALA 17 HB1 ALA 17 101.313 -4.897 -17.352 157 HB2 ALA 17 HB2 ALA 17 99.850 -4.558 -16.427 158 HB3 ALA 17 HB3 ALA 17 101.168 -3.386 -16.454 159 H LYS 18 H LYS 18 97.522 -3.714 -17.860 160 HA LYS 18 HA LYS 18 96.965 -0.860 -17.612 161 HB2 LYS 18 HB2 LYS 18 95.156 -3.287 -17.599 162 HB3 LYS 18 HB3 LYS 18 94.591 -1.619 -17.490 163 HG2 LYS 18 HG2 LYS 18 95.560 -1.098 -19.660 164 HG3 LYS 18 HG3 LYS 18 96.276 -2.707 -19.763 165 HD2 LYS 18 HD2 LYS 18 94.253 -2.727 -21.081 166 HD3 LYS 18 HD3 LYS 18 93.947 -3.665 -19.618 167 HE2 LYS 18 HE2 LYS 18 92.805 -1.788 -18.586 168 HE3 LYS 18 HE3 LYS 18 93.227 -0.740 -19.939 169 HZ1 LYS 18 HZ1 LYS 18 92.019 -2.549 -21.315 170 HZ2 LYS 18 HZ2 LYS 18 91.106 -1.386 -20.476 171 HZ3 LYS 18 HZ3 LYS 18 91.290 -2.949 -19.836 172 H PHE 19 H PHE 19 95.974 0.082 -15.795 173 HA PHE 19 HA PHE 19 96.484 -1.357 -13.261 174 HB2 PHE 19 HB2 PHE 19 96.303 1.603 -13.831 175 HB3 PHE 19 HB3 PHE 19 96.555 0.895 -12.247 176 HD1 PHE 19 HD2 PHE 19 98.685 -0.294 -11.733 177 HD2 PHE 19 HD1 PHE 19 98.074 1.806 -15.430 178 HE1 PHE 19 HE2 PHE 19 101.130 -0.308 -12.145 179 HE2 PHE 19 HE1 PHE 19 100.520 1.792 -15.843 180 HZ PHE 19 HZ PHE 19 102.048 0.734 -14.200 181 H GLU 20 H GLU 20 94.905 -1.485 -11.708 182 HA GLU 20 HA GLU 20 92.177 -0.828 -12.615 183 HB2 GLU 20 HB2 GLU 20 93.142 -2.739 -10.475 184 HB3 GLU 20 HB3 GLU 20 91.455 -2.471 -10.913 185 HG2 GLU 20 HG2 GLU 20 91.981 -3.165 -13.244 186 HG3 GLU 20 HG3 GLU 20 93.632 -3.513 -12.746 187 H ARG 21 H ARG 21 90.672 0.088 -11.135 188 HA ARG 21 HA ARG 21 91.758 2.203 -9.555 189 HB2 ARG 21 HB2 ARG 21 89.578 2.326 -10.763 190 HB3 ARG 21 HB3 ARG 21 88.914 1.168 -9.609 191 HG2 ARG 21 HG2 ARG 21 89.473 2.722 -7.756 192 HG3 ARG 21 HG3 ARG 21 90.067 3.891 -8.935 193 HD2 ARG 21 HD2 ARG 21 87.811 3.892 -10.008 194 HD3 ARG 21 HD3 ARG 21 87.238 2.827 -8.727 195 HE ARG 21 HE ARG 21 87.145 4.657 -7.320 196 HH11 ARG 21 HH11 ARG 21 89.167 5.505 -10.063 197 HH12 ARG 21 HH12 ARG 21 89.300 7.163 -9.579 198 HH21 ARG 21 HH21 ARG 21 87.354 6.803 -6.749 199 HH22 ARG 21 HH22 ARG 21 88.285 7.887 -7.726 200 H GLN 22 H GLN 22 91.756 2.480 -7.329 201 HA GLN 22 HA GLN 22 91.913 0.013 -5.792 202 HB2 GLN 22 HB2 GLN 22 93.623 1.824 -5.575 203 HB3 GLN 22 HB3 GLN 22 92.376 2.863 -4.886 204 HG2 GLN 22 HG2 GLN 22 93.489 1.899 -3.017 205 HG3 GLN 22 HG3 GLN 22 91.982 1.000 -3.171 206 HE21 GLN 22 HE21 GLN 22 92.248 -1.231 -3.100 207 HE22 GLN 22 HE22 GLN 22 93.664 -2.056 -3.538 208 H HIS 23 H HIS 23 90.536 -0.615 -4.206 209 HA HIS 23 HA HIS 23 88.118 1.048 -3.773 210 HB2 HIS 23 HB2 HIS 23 87.697 -1.037 -5.028 211 HB3 HIS 23 HB3 HIS 23 88.388 -1.960 -3.707 212 HD1 HIS 23 HD1 HIS 23 86.911 -2.385 -1.660 213 HD2 HIS 23 HD2 HIS 23 85.117 0.115 -4.472 214 HE1 HIS 23 HE1 HIS 23 84.490 -2.145 -0.962 215 H MET 24 H MET 24 87.385 1.324 -1.700 216 HA MET 24 HA MET 24 89.324 0.813 0.406 217 HB2 MET 24 HB2 MET 24 86.665 2.261 0.432 218 HB3 MET 24 HB3 MET 24 87.785 2.179 1.793 219 HG2 MET 24 HG2 MET 24 89.549 3.194 0.311 220 HG3 MET 24 HG3 MET 24 88.306 3.429 -0.918 221 HE1 MET 24 HE1 MET 24 89.643 3.951 2.407 222 HE2 MET 24 HE2 MET 24 88.075 4.047 3.206 223 HE3 MET 24 HE3 MET 24 89.047 5.503 3.011 224 H ASP 25 H ASP 25 88.961 -0.408 2.251 225 HA ASP 25 HA ASP 25 86.494 -1.983 2.422 226 HB2 ASP 25 HB2 ASP 25 88.135 -3.295 1.060 227 HB3 ASP 25 HB3 ASP 25 89.229 -3.277 2.442 228 H SER 26 H SER 26 86.303 -3.119 4.494 229 HA SER 26 HA SER 26 86.840 -1.471 6.686 230 HB2 SER 26 HB2 SER 26 86.472 -4.447 6.954 231 HB3 SER 26 HB3 SER 26 85.915 -3.166 8.025 232 HG SER 26 HG SER 26 84.203 -3.159 6.842 233 HA PRO 27 HA PRO 27 91.031 -2.391 7.689 234 HB2 PRO 27 HB2 PRO 27 91.088 -2.194 10.414 235 HB3 PRO 27 HB3 PRO 27 90.958 -0.786 9.341 236 HG2 PRO 27 HG2 PRO 27 88.839 -2.187 10.884 237 HG3 PRO 27 HG3 PRO 27 89.063 -0.454 10.585 238 HD2 PRO 27 HD2 PRO 27 87.253 -1.976 9.208 239 HD3 PRO 27 HD3 PRO 27 88.029 -0.530 8.526 240 H ASP 28 H ASP 28 92.252 -4.190 7.943 241 HA ASP 28 HA ASP 28 91.239 -6.394 9.617 242 HB2 ASP 28 HB2 ASP 28 92.193 -6.660 6.757 243 HB3 ASP 28 HB3 ASP 28 91.837 -8.006 7.835 244 H LEU 29 H LEU 29 92.970 -8.123 9.857 245 HA LEU 29 HA LEU 29 95.467 -6.786 10.549 246 HB2 LEU 29 HB2 LEU 29 94.595 -9.648 11.016 247 HB3 LEU 29 HB3 LEU 29 96.011 -8.866 11.715 248 HG LEU 29 HG LEU 29 93.151 -7.951 12.144 249 HD11 LEU 29 HD11 LEU 29 93.440 -8.852 14.421 250 HD12 LEU 29 HD12 LEU 29 95.046 -9.438 13.989 251 HD13 LEU 29 HD13 LEU 29 93.619 -10.129 13.218 252 HD21 LEU 29 HD21 LEU 29 94.425 -6.742 14.087 253 HD22 LEU 29 HD22 LEU 29 94.504 -6.055 12.465 254 HD23 LEU 29 HD23 LEU 29 95.853 -7.006 13.086 255 H GLY 30 H GLY 30 97.484 -7.325 9.749 256 HA2 GLY 30 HA2 GLY 30 97.493 -8.374 7.045 257 HA3 GLY 30 HA3 GLY 30 98.861 -7.669 7.901 258 H THR 31 H THR 31 99.776 -9.651 6.680 259 HA THR 31 HA THR 31 99.869 -11.896 8.591 260 HB THR 31 HB THR 31 98.404 -12.534 6.716 261 HG1 THR 31 HG1 THR 31 99.766 -14.066 7.635 262 HG21 THR 31 HG21 THR 31 99.100 -12.534 4.467 263 HG22 THR 31 HG22 THR 31 100.799 -12.350 4.898 264 HG23 THR 31 HG23 THR 31 99.691 -10.990 5.079 265 H ASP 32 H ASP 32 101.807 -13.300 8.213 266 HA ASP 32 HA ASP 32 104.148 -11.722 8.268 267 HB2 ASP 32 HB2 ASP 32 105.350 -13.877 8.301 268 HB3 ASP 32 HB3 ASP 32 104.016 -13.845 9.446 269 H ASP 33 H ASP 33 106.091 -12.229 6.850 270 HA ASP 33 HA ASP 33 105.439 -11.494 4.171 271 HB2 ASP 33 HB2 ASP 33 108.059 -12.349 5.419 272 HB3 ASP 33 HB3 ASP 33 107.893 -11.692 3.793 273 H ASP 34 H ASP 34 105.375 -12.672 2.334 274 HA ASP 34 HA ASP 34 106.317 -15.435 2.311 275 HB2 ASP 34 HB2 ASP 34 103.947 -15.514 3.128 276 HB3 ASP 34 HB3 ASP 34 103.450 -14.773 1.607 277 H ASP 35 H ASP 35 106.490 -16.302 0.164 278 HA ASP 35 HA ASP 35 107.166 -14.315 -1.790 279 HB2 ASP 35 HB2 ASP 35 107.754 -16.208 -3.215 280 HB3 ASP 35 HB3 ASP 35 108.399 -16.444 -1.594 281 H LYS 36 H LYS 36 106.335 -14.587 -4.108 282 HA LYS 36 HA LYS 36 103.406 -14.492 -3.984 283 HB2 LYS 36 HB2 LYS 36 105.369 -13.608 -6.112 284 HB3 LYS 36 HB3 LYS 36 103.617 -13.463 -6.249 285 HG2 LYS 36 HG2 LYS 36 103.529 -12.017 -4.299 286 HG3 LYS 36 HG3 LYS 36 105.251 -12.251 -4.003 287 HD2 LYS 36 HD2 LYS 36 105.001 -10.130 -5.117 288 HD3 LYS 36 HD3 LYS 36 105.690 -11.258 -6.285 289 HE2 LYS 36 HE2 LYS 36 103.849 -9.912 -7.269 290 HE3 LYS 36 HE3 LYS 36 103.479 -11.635 -7.269 291 HZ1 LYS 36 HZ1 LYS 36 102.650 -9.949 -5.003 292 HZ2 LYS 36 HZ2 LYS 36 101.976 -11.405 -5.560 293 HZ3 LYS 36 HZ3 LYS 36 101.725 -9.964 -6.424 294 H THR 37 H THR 37 102.377 -16.331 -4.388 295 HA THR 37 HA THR 37 103.260 -17.970 -6.686 296 HB THR 37 HB THR 37 102.686 -20.000 -5.461 297 HG1 THR 37 HG1 THR 37 101.962 -18.176 -3.517 298 HG21 THR 37 HG21 THR 37 104.993 -19.192 -5.277 299 HG22 THR 37 HG22 THR 37 104.490 -19.942 -3.763 300 HG23 THR 37 HG23 THR 37 104.545 -18.184 -3.900 301 H GLY 38 H GLY 38 101.509 -19.318 -7.578 302 HA2 GLY 38 HA2 GLY 38 99.098 -17.840 -7.925 303 HA3 GLY 38 HA3 GLY 38 99.403 -19.474 -8.512 304 H GLY 39 H GLY 39 97.116 -18.066 -6.980 305 HA2 GLY 39 HA2 GLY 39 96.345 -20.329 -5.415 306 HA3 GLY 39 HA3 GLY 39 96.847 -18.991 -4.388 307 H GLY 40 H GLY 40 94.517 -19.291 -3.724 308 HA2 GLY 40 HA2 GLY 40 92.410 -18.507 -5.477 309 HA3 GLY 40 HA3 GLY 40 92.310 -18.625 -3.723 310 H ARG 41 H ARG 41 91.138 -16.709 -3.512 311 HA ARG 41 HA ARG 41 91.687 -14.254 -4.710 312 HB2 ARG 41 HB2 ARG 41 90.309 -15.060 -2.174 313 HB3 ARG 41 HB3 ARG 41 90.601 -13.352 -2.499 314 HG2 ARG 41 HG2 ARG 41 88.491 -13.689 -3.457 315 HG3 ARG 41 HG3 ARG 41 89.568 -13.874 -4.840 316 HD2 ARG 41 HD2 ARG 41 89.525 -16.330 -4.535 317 HD3 ARG 41 HD3 ARG 41 88.428 -16.134 -3.171 318 HE ARG 41 HE ARG 41 87.342 -14.833 -5.430 319 HH11 ARG 41 HH11 ARG 41 87.961 -18.092 -4.280 320 HH12 ARG 41 HH12 ARG 41 86.655 -18.770 -5.195 321 HH21 ARG 41 HH21 ARG 41 85.676 -15.763 -6.584 322 HH22 ARG 41 HH22 ARG 41 85.379 -17.466 -6.483 323 H ALA 42 H ALA 42 92.766 -12.392 -4.000 324 HA ALA 42 HA ALA 42 95.332 -12.777 -2.923 325 HB1 ALA 42 HB1 ALA 42 94.905 -10.884 -4.344 326 HB2 ALA 42 HB2 ALA 42 95.363 -10.267 -2.756 327 HB3 ALA 42 HB3 ALA 42 93.669 -10.273 -3.245 328 H ASP 43 H ASP 43 96.210 -11.744 -0.965 329 HA ASP 43 HA ASP 43 95.056 -12.716 1.370 330 HB2 ASP 43 HB2 ASP 43 96.976 -10.395 1.070 331 HB3 ASP 43 HB3 ASP 43 96.662 -11.279 2.562 332 HA PRO 44 HA PRO 44 91.905 -9.961 2.641 333 HB2 PRO 44 HB2 PRO 44 93.193 -9.400 5.257 334 HB3 PRO 44 HB3 PRO 44 91.618 -10.136 4.904 335 HG2 PRO 44 HG2 PRO 44 93.669 -11.575 5.809 336 HG3 PRO 44 HG3 PRO 44 92.500 -12.233 4.649 337 HD2 PRO 44 HD2 PRO 44 95.292 -11.263 4.155 338 HD3 PRO 44 HD3 PRO 44 94.420 -12.622 3.410 339 H ALA 45 H ALA 45 91.391 -7.718 3.418 340 HA ALA 45 HA ALA 45 92.946 -5.807 2.032 341 HB1 ALA 45 HB1 ALA 45 91.465 -4.180 3.429 342 HB2 ALA 45 HB2 ALA 45 90.646 -5.650 3.957 343 HB3 ALA 45 HB3 ALA 45 90.693 -5.234 2.244 344 H HIS 46 H HIS 46 94.060 -3.964 2.890 345 HA HIS 46 HA HIS 46 95.368 -4.503 5.495 346 HB2 HIS 46 HB2 HIS 46 96.448 -2.938 3.149 347 HB3 HIS 46 HB3 HIS 46 97.300 -3.322 4.633 348 HD1 HIS 46 HD1 HIS 46 97.507 -6.081 5.032 349 HD2 HIS 46 HD2 HIS 46 96.966 -4.718 1.129 350 HE1 HIS 46 HE1 HIS 46 98.241 -7.964 3.509 351 H ARG 47 H ARG 47 96.350 -2.355 6.382 352 HA ARG 47 HA ARG 47 94.234 -0.725 7.205 353 HB2 ARG 47 HB2 ARG 47 97.202 -0.128 7.161 354 HB3 ARG 47 HB3 ARG 47 95.999 0.796 8.062 355 HG2 ARG 47 HG2 ARG 47 95.356 -1.287 9.274 356 HG3 ARG 47 HG3 ARG 47 96.649 -2.143 8.433 357 HD2 ARG 47 HD2 ARG 47 98.266 -0.448 9.367 358 HD3 ARG 47 HD3 ARG 47 96.945 0.187 10.343 359 HE ARG 47 HE ARG 47 97.459 -2.673 10.591 360 HH11 ARG 47 HH11 ARG 47 98.002 0.520 11.946 361 HH12 ARG 47 HH12 ARG 47 98.427 -0.106 13.504 362 HH21 ARG 47 HH21 ARG 47 98.016 -3.419 12.617 363 HH22 ARG 47 HH22 ARG 47 98.434 -2.308 13.879 364 H SER 48 H SER 48 93.550 1.327 6.638 365 HA SER 48 HA SER 48 93.536 1.949 3.893 366 HB2 SER 48 HB2 SER 48 92.853 3.763 6.207 367 HB3 SER 48 HB3 SER 48 92.324 3.943 4.538 368 HG SER 48 HG SER 48 91.577 2.084 6.432 369 HA PRO 49 HA PRO 49 97.583 4.134 4.150 370 HB2 PRO 49 HB2 PRO 49 97.179 4.670 1.267 371 HB3 PRO 49 HB3 PRO 49 98.519 3.853 2.089 372 HG2 PRO 49 HG2 PRO 49 96.757 2.525 0.590 373 HG3 PRO 49 HG3 PRO 49 97.493 1.814 2.040 374 HD2 PRO 49 HD2 PRO 49 94.745 2.976 1.707 375 HD3 PRO 49 HD3 PRO 49 95.257 1.538 2.620 376 H VAL 50 H VAL 50 98.265 6.383 3.824 377 HA VAL 50 HA VAL 50 95.991 8.195 4.032 378 HB VAL 50 HB VAL 50 98.956 8.712 4.390 379 HG11 VAL 50 HG11 VAL 50 98.249 10.793 5.463 380 HG12 VAL 50 HG12 VAL 50 96.555 10.386 5.185 381 HG13 VAL 50 HG13 VAL 50 97.614 10.733 3.819 382 HG21 VAL 50 HG21 VAL 50 96.730 7.934 6.267 383 HG22 VAL 50 HG22 VAL 50 98.111 8.862 6.852 384 HG23 VAL 50 HG23 VAL 50 98.357 7.264 6.146 385 HA PRO 51 HA PRO 51 96.305 9.492 -0.257 386 HB2 PRO 51 HB2 PRO 51 95.909 12.276 0.740 387 HB3 PRO 51 HB3 PRO 51 95.024 11.391 -0.517 388 HG2 PRO 51 HG2 PRO 51 93.971 11.817 1.888 389 HG3 PRO 51 HG3 PRO 51 93.677 10.316 0.991 390 HD2 PRO 51 HD2 PRO 51 95.423 10.770 3.366 391 HD3 PRO 51 HD3 PRO 51 94.528 9.315 2.882 392 H LEU 52 H LEU 52 98.037 10.007 -1.512 393 HA LEU 52 HA LEU 52 100.519 10.614 -0.316 394 HB2 LEU 52 HB2 LEU 52 99.525 10.412 -3.135 395 HB3 LEU 52 HB3 LEU 52 101.121 11.097 -2.841 396 HG LEU 52 HG LEU 52 100.243 8.430 -1.711 397 HD11 LEU 52 HD11 LEU 52 101.525 9.168 -4.337 398 HD12 LEU 52 HD12 LEU 52 100.205 8.037 -4.033 399 HD13 LEU 52 HD13 LEU 52 101.856 7.606 -3.585 400 HD21 LEU 52 HD21 LEU 52 102.104 9.172 -0.485 401 HD22 LEU 52 HD22 LEU 52 102.812 9.994 -1.875 402 HD23 LEU 52 HD23 LEU 52 102.858 8.233 -1.773 403 HA PRO 53 HA PRO 53 100.464 15.095 -0.275 404 HB2 PRO 53 HB2 PRO 53 103.260 15.090 -1.272 405 HB3 PRO 53 HB3 PRO 53 102.594 15.774 0.222 406 HG2 PRO 53 HG2 PRO 53 104.105 13.578 0.226 407 HG3 PRO 53 HG3 PRO 53 102.766 13.803 1.366 408 HD2 PRO 53 HD2 PRO 53 102.874 12.093 -1.091 409 HD3 PRO 53 HD3 PRO 53 102.067 11.789 0.465 410 H SER 54 H SER 54 100.071 16.746 -1.744 411 HA SER 54 HA SER 54 99.344 16.044 -4.330 412 HB2 SER 54 HB2 SER 54 99.100 18.453 -4.747 413 HB3 SER 54 HB3 SER 54 98.479 18.027 -3.156 414 HG SER 54 HG SER 54 99.929 19.321 -2.412 415 HA PRO 55 HA PRO 55 103.333 15.863 -6.130 416 HB2 PRO 55 HB2 PRO 55 102.764 15.617 -8.757 417 HB3 PRO 55 HB3 PRO 55 102.351 14.354 -7.581 418 HG2 PRO 55 HG2 PRO 55 100.609 16.357 -8.890 419 HG3 PRO 55 HG3 PRO 55 100.253 14.694 -8.394 420 HD2 PRO 55 HD2 PRO 55 99.540 17.003 -6.971 421 HD3 PRO 55 HD3 PRO 55 99.547 15.347 -6.329 422 H THR 56 H THR 56 104.701 17.561 -6.124 423 HA THR 56 HA THR 56 104.241 19.884 -7.823 424 HB THR 56 HB THR 56 106.409 20.655 -7.011 425 HG1 THR 56 HG1 THR 56 107.720 19.312 -5.988 426 HG21 THR 56 HG21 THR 56 105.813 21.016 -4.784 427 HG22 THR 56 HG22 THR 56 105.163 19.388 -4.590 428 HG23 THR 56 HG23 THR 56 104.261 20.594 -5.508 429 H SER 57 H SER 57 105.832 20.408 -9.584 430 HA SER 57 HA SER 57 105.864 18.297 -11.426 431 HB2 SER 57 HB2 SER 57 107.546 20.815 -11.413 432 HB3 SER 57 HB3 SER 57 107.314 19.755 -12.798 433 HG SER 57 HG SER 57 105.581 21.507 -11.617 434 H ASN 58 H ASN 58 107.101 16.579 -11.592 435 HA ASN 58 HA ASN 58 108.920 15.205 -11.634 436 HB2 ASN 58 HB2 ASN 58 110.444 17.801 -11.374 437 HB3 ASN 58 HB3 ASN 58 111.153 16.241 -11.782 438 HD21 ASN 58 HD21 ASN 58 111.140 18.600 -13.534 439 HD22 ASN 58 HD22 ASN 58 110.259 18.172 -14.920 440 H LYS 59 H LYS 59 107.706 16.128 -8.936 441 HA LYS 59 HA LYS 59 109.714 14.838 -7.292 442 HB2 LYS 59 HB2 LYS 59 110.501 17.190 -7.419 443 HB3 LYS 59 HB3 LYS 59 108.971 17.712 -6.717 444 HG2 LYS 59 HG2 LYS 59 109.432 16.286 -4.728 445 HG3 LYS 59 HG3 LYS 59 111.001 15.869 -5.420 446 HD2 LYS 59 HD2 LYS 59 111.560 18.312 -5.485 447 HD3 LYS 59 HD3 LYS 59 110.051 18.637 -4.632 448 HE2 LYS 59 HE2 LYS 59 111.692 18.531 -2.922 449 HE3 LYS 59 HE3 LYS 59 110.884 16.964 -2.866 450 HZ1 LYS 59 HZ1 LYS 59 112.660 15.909 -3.843 451 HZ2 LYS 59 HZ2 LYS 59 113.452 17.076 -2.894 452 HZ3 LYS 59 HZ3 LYS 59 113.259 17.323 -4.564 453 H GLN 60 H GLN 60 108.867 13.917 -5.482 454 HA GLN 60 HA GLN 60 106.397 14.972 -4.331 455 HB2 GLN 60 HB2 GLN 60 106.698 12.109 -5.238 456 HB3 GLN 60 HB3 GLN 60 105.520 12.610 -4.028 457 HG2 GLN 60 HG2 GLN 60 104.658 14.292 -5.714 458 HG3 GLN 60 HG3 GLN 60 105.699 13.508 -6.903 459 HE21 GLN 60 HE21 GLN 60 102.722 13.125 -5.018 460 HE22 GLN 60 HE22 GLN 60 102.246 11.678 -5.768 461 H ASP 61 H ASP 61 106.129 14.485 -2.128 462 HA ASP 61 HA ASP 61 108.482 13.393 -0.768 463 HB2 ASP 61 HB2 ASP 61 105.926 14.616 0.310 464 HB3 ASP 61 HB3 ASP 61 107.280 14.075 1.300 465 H ILE 62 H ILE 62 108.572 11.317 -0.085 466 HA ILE 62 HA ILE 62 106.050 9.754 -0.084 467 HB ILE 62 HB ILE 62 107.490 9.366 -2.087 468 HG12 ILE 62 HG12 ILE 62 107.619 6.801 -1.651 469 HG13 ILE 62 HG13 ILE 62 106.866 7.196 -0.105 470 HG21 ILE 62 HG21 ILE 62 109.702 9.651 -1.171 471 HG22 ILE 62 HG22 ILE 62 109.555 7.987 -1.735 472 HG23 ILE 62 HG23 ILE 62 109.443 8.347 -0.012 473 HD11 ILE 62 HD11 ILE 62 105.360 6.666 -2.213 474 HD12 ILE 62 HD12 ILE 62 105.695 8.347 -2.619 475 HD13 ILE 62 HD13 ILE 62 104.901 7.949 -1.095 476 H SER 63 H SER 63 105.872 8.095 1.500 477 HA SER 63 HA SER 63 107.949 7.981 3.543 478 HB2 SER 63 HB2 SER 63 106.587 8.830 5.334 479 HB3 SER 63 HB3 SER 63 106.612 10.033 4.050 480 HG SER 63 HG SER 63 104.531 9.031 5.088 481 H GLU 64 H GLU 64 107.514 6.454 5.241 482 HA GLU 64 HA GLU 64 106.573 4.001 4.374 483 HB2 GLU 64 HB2 GLU 64 106.653 3.324 6.752 484 HB3 GLU 64 HB3 GLU 64 108.091 4.221 6.262 485 HG2 GLU 64 HG2 GLU 64 107.079 6.293 7.179 486 HG3 GLU 64 HG3 GLU 64 105.706 5.351 7.748 487 H ALA 65 H ALA 65 104.815 6.599 6.000 488 HA ALA 65 HA ALA 65 102.595 5.142 6.891 489 HB1 ALA 65 HB1 ALA 65 103.036 8.004 6.120 490 HB2 ALA 65 HB2 ALA 65 102.636 7.318 7.695 491 HB3 ALA 65 HB3 ALA 65 101.397 7.438 6.444 492 H ASN 66 H ASN 66 103.213 6.670 3.739 493 HA ASN 66 HA ASN 66 100.590 6.158 2.725 494 HB2 ASN 66 HB2 ASN 66 103.097 6.648 1.109 495 HB3 ASN 66 HB3 ASN 66 101.428 6.902 0.608 496 HD21 ASN 66 HD21 ASN 66 100.222 8.690 1.743 497 HD22 ASN 66 HD22 ASN 66 101.100 9.990 2.389 498 H LEU 67 H LEU 67 103.741 4.561 2.268 499 HA LEU 67 HA LEU 67 102.683 2.637 0.433 500 HB2 LEU 67 HB2 LEU 67 105.311 2.937 1.850 501 HB3 LEU 67 HB3 LEU 67 104.945 1.486 0.915 502 HG LEU 67 HG LEU 67 104.261 3.101 -0.974 503 HD11 LEU 67 HD11 LEU 67 105.548 4.945 1.007 504 HD12 LEU 67 HD12 LEU 67 104.137 5.213 -0.017 505 HD13 LEU 67 HD13 LEU 67 105.755 5.254 -0.714 506 HD21 LEU 67 HD21 LEU 67 107.193 3.381 -0.431 507 HD22 LEU 67 HD22 LEU 67 106.366 2.885 -1.903 508 HD23 LEU 67 HD23 LEU 67 106.532 1.752 -0.565 509 H ALA 68 H ALA 68 102.853 2.713 3.904 510 HA ALA 68 HA ALA 68 102.125 1.242 5.492 511 HB1 ALA 68 HB1 ALA 68 101.131 -0.683 3.417 512 HB2 ALA 68 HB2 ALA 68 100.309 0.863 3.621 513 HB3 ALA 68 HB3 ALA 68 100.426 -0.257 4.977 514 H TYR 69 H TYR 69 102.190 -1.790 5.011 515 HA TYR 69 HA TYR 69 104.771 -2.248 5.961 516 HB2 TYR 69 HB2 TYR 69 102.846 -3.826 6.111 517 HB3 TYR 69 HB3 TYR 69 103.072 -4.199 4.412 518 HD1 TYR 69 HD2 TYR 69 104.563 -4.443 7.788 519 HD2 TYR 69 HD1 TYR 69 104.849 -5.654 3.677 520 HE1 TYR 69 HE2 TYR 69 106.247 -6.153 8.410 521 HE2 TYR 69 HE1 TYR 69 106.535 -7.365 4.299 522 HH TYR 69 HH TYR 69 107.150 -8.235 7.485 523 H LEU 70 H LEU 70 103.677 -1.835 2.686 524 HA LEU 70 HA LEU 70 105.600 -3.215 1.216 525 HB2 LEU 70 HB2 LEU 70 103.599 -2.067 0.277 526 HB3 LEU 70 HB3 LEU 70 104.412 -0.522 0.525 527 HG LEU 70 HG LEU 70 106.319 -1.411 -0.885 528 HD11 LEU 70 HD11 LEU 70 105.426 -3.309 -2.462 529 HD12 LEU 70 HD12 LEU 70 104.347 -3.669 -1.114 530 HD13 LEU 70 HD13 LEU 70 106.095 -3.740 -0.889 531 HD21 LEU 70 HD21 LEU 70 104.941 -1.249 -3.050 532 HD22 LEU 70 HD22 LEU 70 104.835 0.120 -1.943 533 HD23 LEU 70 HD23 LEU 70 103.533 -1.067 -2.004 534 H TRP 71 H TRP 71 105.935 -0.271 3.059 535 HA TRP 71 HA TRP 71 108.061 0.990 1.788 536 HB2 TRP 71 HB2 TRP 71 106.675 1.801 3.731 537 HB3 TRP 71 HB3 TRP 71 107.678 0.802 4.764 538 HD1 TRP 71 HD1 TRP 71 109.767 1.898 5.694 539 HE1 TRP 71 HE1 TRP 71 111.062 4.070 5.210 540 HE3 TRP 71 HE3 TRP 71 107.310 3.496 1.515 541 HZ2 TRP 71 HZ2 TRP 71 111.083 6.197 3.295 542 HZ3 TRP 71 HZ3 TRP 71 107.987 5.590 0.382 543 HH2 TRP 71 HH2 TRP 71 109.866 6.942 1.264 544 HA PRO 72 HA PRO 72 110.888 -2.434 2.896 545 HB2 PRO 72 HB2 PRO 72 112.623 -2.291 0.872 546 HB3 PRO 72 HB3 PRO 72 110.948 -2.818 0.597 547 HG2 PRO 72 HG2 PRO 72 112.209 -0.185 0.045 548 HG3 PRO 72 HG3 PRO 72 111.021 -1.093 -0.910 549 HD2 PRO 72 HD2 PRO 72 110.421 1.011 0.833 550 HD3 PRO 72 HD3 PRO 72 109.259 -0.180 0.214 551 H LEU 73 H LEU 73 111.659 0.922 2.790 552 HA LEU 73 HA LEU 73 114.496 0.573 3.342 553 HB2 LEU 73 HB2 LEU 73 112.826 3.094 3.345 554 HB3 LEU 73 HB3 LEU 73 114.585 2.998 3.372 555 HG LEU 73 HG LEU 73 112.838 1.920 1.143 556 HD11 LEU 73 HD11 LEU 73 112.762 4.357 1.227 557 HD12 LEU 73 HD12 LEU 73 113.784 3.857 -0.129 558 HD13 LEU 73 HD13 LEU 73 114.518 4.434 1.368 559 HD21 LEU 73 HD21 LEU 73 115.076 1.837 -0.040 560 HD22 LEU 73 HD22 LEU 73 114.925 0.693 1.292 561 HD23 LEU 73 HD23 LEU 73 115.841 2.184 1.511 562 H THR 74 H THR 74 115.528 0.946 5.224 563 HA THR 74 HA THR 74 114.154 0.680 7.692 564 HB THR 74 HB THR 74 116.351 1.047 8.715 565 HG1 THR 74 HG1 THR 74 117.303 1.539 6.158 566 HG21 THR 74 HG21 THR 74 115.966 -1.171 7.867 567 HG22 THR 74 HG22 THR 74 117.611 -0.722 7.415 568 HG23 THR 74 HG23 THR 74 116.319 -0.661 6.217 569 H VAL 75 H VAL 75 115.513 3.476 5.948 570 HA VAL 75 HA VAL 75 114.954 5.362 8.022 571 HB VAL 75 HB VAL 75 115.150 7.078 6.255 572 HG11 VAL 75 HG11 VAL 75 117.236 4.886 6.027 573 HG12 VAL 75 HG12 VAL 75 117.178 6.102 7.304 574 HG13 VAL 75 HG13 VAL 75 117.472 6.588 5.635 575 HG21 VAL 75 HG21 VAL 75 114.060 5.932 4.404 576 HG22 VAL 75 HG22 VAL 75 115.286 4.664 4.425 577 HG23 VAL 75 HG23 VAL 75 115.719 6.300 3.938 578 H ASP 76 H ASP 76 113.062 6.381 8.529 579 HA ASP 76 HA ASP 76 110.727 4.947 7.861 580 HB2 ASP 76 HB2 ASP 76 111.050 7.629 9.227 581 HB3 ASP 76 HB3 ASP 76 109.537 6.732 9.140 582 H HIS 77 H HIS 77 112.066 7.933 6.536 583 HA HIS 77 HA HIS 77 110.072 7.752 4.411 584 HB2 HIS 77 HB2 HIS 77 109.560 10.175 4.570 585 HB3 HIS 77 HB3 HIS 77 108.955 9.234 5.918 586 HD1 HIS 77 HD1 HIS 77 110.982 9.198 7.980 587 HD2 HIS 77 HD2 HIS 77 110.623 12.517 5.482 588 HE1 HIS 77 HE1 HIS 77 112.055 11.136 9.206 589 H GLY 78 H GLY 78 110.555 9.485 2.719 590 HA2 GLY 78 HA2 GLY 78 113.110 10.736 2.637 591 HA3 GLY 78 HA3 GLY 78 113.079 9.277 1.649 592 H THR 79 H THR 79 113.437 11.809 0.533 593 HA THR 79 HA THR 79 110.843 12.381 -0.773 594 HB THR 79 HB THR 79 113.296 14.135 -0.895 595 HG1 THR 79 HG1 THR 79 112.880 14.154 1.196 596 HG21 THR 79 HG21 THR 79 111.679 14.802 -2.479 597 HG22 THR 79 HG22 THR 79 111.307 15.814 -1.081 598 HG23 THR 79 HG23 THR 79 110.336 14.377 -1.415 599 H ILE 80 H ILE 80 110.640 12.188 -2.963 600 HA ILE 80 HA ILE 80 112.950 11.023 -4.399 601 HB ILE 80 HB ILE 80 111.217 10.083 -5.952 602 HG12 ILE 80 HG12 ILE 80 109.233 10.720 -3.759 603 HG13 ILE 80 HG13 ILE 80 109.416 11.762 -5.164 604 HG21 ILE 80 HG21 ILE 80 110.348 8.444 -4.099 605 HG22 ILE 80 HG22 ILE 80 111.417 9.368 -3.042 606 HG23 ILE 80 HG23 ILE 80 112.076 8.525 -4.443 607 HD11 ILE 80 HD11 ILE 80 107.747 10.356 -5.921 608 HD12 ILE 80 HD12 ILE 80 108.356 8.972 -5.006 609 HD13 ILE 80 HD13 ILE 80 109.171 9.478 -6.486 610 H GLU 81 H GLU 81 113.717 12.011 -6.194 611 HA GLU 81 HA GLU 81 112.149 14.160 -7.411 612 HB2 GLU 81 HB2 GLU 81 113.389 15.171 -5.498 613 HB3 GLU 81 HB3 GLU 81 114.898 14.679 -6.267 614 HG2 GLU 81 HG2 GLU 81 114.267 15.989 -8.284 615 HG3 GLU 81 HG3 GLU 81 112.813 16.529 -7.456 616 H CYS 82 H CYS 82 112.601 14.537 -9.500 617 HA CYS 82 HA CYS 82 114.930 13.188 -10.714 618 HB2 CYS 82 HB2 CYS 82 112.661 14.637 -12.105 619 HB3 CYS 82 HB3 CYS 82 113.871 13.597 -12.851 620 H LEU 83 H LEU 83 116.721 14.383 -11.040 621 HA LEU 83 HA LEU 83 116.560 17.236 -10.435 622 HB2 LEU 83 HB2 LEU 83 118.941 15.420 -10.866 623 HB3 LEU 83 HB3 LEU 83 119.036 17.118 -10.397 624 HG LEU 83 HG LEU 83 117.447 15.090 -8.814 625 HD11 LEU 83 HD11 LEU 83 119.681 14.263 -8.704 626 HD12 LEU 83 HD12 LEU 83 119.465 15.220 -7.239 627 HD13 LEU 83 HD13 LEU 83 120.357 15.889 -8.605 628 HD21 LEU 83 HD21 LEU 83 118.028 16.904 -7.032 629 HD22 LEU 83 HD22 LEU 83 116.775 17.268 -8.218 630 HD23 LEU 83 HD23 LEU 83 118.400 17.923 -8.422 631 HA PRO 84 HA PRO 84 116.936 18.890 -14.524 632 HB2 PRO 84 HB2 PRO 84 119.453 20.254 -13.682 633 HB3 PRO 84 HB3 PRO 84 118.005 20.928 -14.454 634 HG2 PRO 84 HG2 PRO 84 118.497 21.311 -11.874 635 HG3 PRO 84 HG3 PRO 84 116.848 21.069 -12.477 636 HD2 PRO 84 HD2 PRO 84 118.588 19.176 -10.965 637 HD3 PRO 84 HD3 PRO 84 116.817 19.337 -10.958 638 H SER 85 H SER 85 119.567 17.135 -13.100 639 HA SER 85 HA SER 85 121.212 17.025 -15.460 640 HB2 SER 85 HB2 SER 85 122.647 15.628 -14.202 641 HB3 SER 85 HB3 SER 85 121.995 16.791 -13.052 642 HG SER 85 HG SER 85 121.095 14.185 -13.496 643 H ASP 86 H ASP 86 118.270 15.640 -14.969 644 HA ASP 86 HA ASP 86 117.121 13.963 -15.987 645 HB2 ASP 86 HB2 ASP 86 119.581 13.791 -17.744 646 HB3 ASP 86 HB3 ASP 86 118.041 13.004 -18.065 647 H ASN 87 H ASN 87 118.423 13.373 -13.641 648 HA ASN 87 HA ASN 87 118.759 10.464 -13.999 649 HB2 ASN 87 HB2 ASN 87 120.481 10.404 -12.290 650 HB3 ASN 87 HB3 ASN 87 120.985 11.477 -13.591 651 HD21 ASN 87 HD21 ASN 87 122.150 11.752 -11.032 652 HD22 ASN 87 HD22 ASN 87 121.614 13.203 -10.330 653 H ALA 88 H ALA 88 117.793 9.214 -12.400 654 HA ALA 88 HA ALA 88 115.894 10.677 -10.686 655 HB1 ALA 88 HB1 ALA 88 115.192 8.842 -12.368 656 HB2 ALA 88 HB2 ALA 88 114.531 8.762 -10.735 657 HB3 ALA 88 HB3 ALA 88 115.869 7.710 -11.196 658 H VAL 89 H VAL 89 116.320 10.862 -8.573 659 HA VAL 89 HA VAL 89 117.957 8.769 -7.271 660 HB VAL 89 HB VAL 89 119.161 10.534 -6.022 661 HG11 VAL 89 HG11 VAL 89 119.297 10.438 -9.031 662 HG12 VAL 89 HG12 VAL 89 120.378 9.694 -7.852 663 HG13 VAL 89 HG13 VAL 89 120.414 11.438 -8.104 664 HG21 VAL 89 HG21 VAL 89 119.035 12.866 -6.899 665 HG22 VAL 89 HG22 VAL 89 117.509 12.331 -6.196 666 HG23 VAL 89 HG23 VAL 89 117.706 12.374 -7.948 667 H PHE 90 H PHE 90 117.787 8.687 -5.010 668 HA PHE 90 HA PHE 90 115.247 9.695 -3.886 669 HB2 PHE 90 HB2 PHE 90 115.295 7.279 -4.115 670 HB3 PHE 90 HB3 PHE 90 116.856 7.201 -3.330 671 HD1 PHE 90 HD1 PHE 90 113.274 8.097 -2.757 672 HD2 PHE 90 HD2 PHE 90 117.018 6.928 -1.007 673 HE1 PHE 90 HE1 PHE 90 112.147 7.757 -0.566 674 HE2 PHE 90 HE2 PHE 90 115.893 6.579 1.175 675 HZ PHE 90 HZ PHE 90 113.455 6.996 1.394 676 H VAL 91 H VAL 91 115.427 11.036 -2.159 677 HA VAL 91 HA VAL 91 118.069 11.294 -0.850 678 HB VAL 91 HB VAL 91 115.781 13.271 -1.069 679 HG11 VAL 91 HG11 VAL 91 116.747 14.002 0.883 680 HG12 VAL 91 HG12 VAL 91 117.854 14.779 -0.244 681 HG13 VAL 91 HG13 VAL 91 118.305 13.260 0.531 682 HG21 VAL 91 HG21 VAL 91 117.062 12.845 -3.165 683 HG22 VAL 91 HG22 VAL 91 118.544 13.286 -2.318 684 HG23 VAL 91 HG23 VAL 91 117.278 14.489 -2.563 685 H ALA 92 H ALA 92 118.245 10.786 1.259 686 HA ALA 92 HA ALA 92 115.770 10.069 2.708 687 HB1 ALA 92 HB1 ALA 92 117.317 8.290 2.815 688 HB2 ALA 92 HB2 ALA 92 117.499 9.107 4.366 689 HB3 ALA 92 HB3 ALA 92 118.681 9.375 3.084 690 HA PRO 93 HA PRO 93 115.747 13.579 5.397 691 HB2 PRO 93 HB2 PRO 93 115.954 11.747 7.742 692 HB3 PRO 93 HB3 PRO 93 114.767 13.021 7.403 693 HG2 PRO 93 HG2 PRO 93 114.209 10.409 7.143 694 HG3 PRO 93 HG3 PRO 93 113.464 11.662 6.138 695 HD2 PRO 93 HD2 PRO 93 115.487 9.638 5.387 696 HD3 PRO 93 HD3 PRO 93 114.341 10.531 4.369 697 H ASP 94 H ASP 94 118.199 11.130 5.815 698 HA ASP 94 HA ASP 94 119.823 12.493 7.695 699 HB2 ASP 94 HB2 ASP 94 121.604 10.923 6.896 700 HB3 ASP 94 HB3 ASP 94 120.113 10.144 7.406 701 H GLY 95 H GLY 95 119.244 13.240 4.412 702 HA2 GLY 95 HA2 GLY 95 120.122 15.114 3.278 703 HA3 GLY 95 HA3 GLY 95 121.460 15.150 4.421 704 H THR 96 H THR 96 120.939 12.009 3.257 705 HA THR 96 HA THR 96 123.283 12.208 1.496 706 HB THR 96 HB THR 96 121.894 9.782 2.670 707 HG1 THR 96 HG1 THR 96 124.181 11.156 3.459 708 HG21 THR 96 HG21 THR 96 124.333 8.896 2.110 709 HG22 THR 96 HG22 THR 96 124.283 10.190 0.913 710 HG23 THR 96 HG23 THR 96 123.070 8.909 0.881 711 H THR 97 H THR 97 123.128 11.721 -0.657 712 HA THR 97 HA THR 97 120.419 11.159 -1.694 713 HB THR 97 HB THR 97 122.867 12.143 -3.188 714 HG1 THR 97 HG1 THR 97 120.781 13.444 -1.925 715 HG21 THR 97 HG21 THR 97 119.930 11.991 -3.922 716 HG22 THR 97 HG22 THR 97 121.219 10.997 -4.597 717 HG23 THR 97 HG23 THR 97 121.187 12.732 -4.913 718 H TYR 98 H TYR 98 119.976 9.280 -2.555 719 HA TYR 98 HA TYR 98 122.156 7.395 -3.200 720 HB2 TYR 98 HB2 TYR 98 119.295 6.826 -2.412 721 HB3 TYR 98 HB3 TYR 98 120.517 5.621 -2.761 722 HD1 TYR 98 HD2 TYR 98 122.316 5.157 -1.141 723 HD2 TYR 98 HD1 TYR 98 119.248 8.048 -0.318 724 HE1 TYR 98 HE2 TYR 98 122.944 5.144 1.259 725 HE2 TYR 98 HE1 TYR 98 119.886 8.047 2.075 726 HH TYR 98 HH TYR 98 121.419 7.299 3.564 727 H ALA 99 H ALA 99 121.944 6.205 -5.150 728 HA ALA 99 HA ALA 99 120.403 7.575 -7.207 729 HB1 ALA 99 HB1 ALA 99 121.635 5.662 -8.592 730 HB2 ALA 99 HB2 ALA 99 122.646 5.604 -7.149 731 HB3 ALA 99 HB3 ALA 99 122.496 7.105 -8.058 732 H LEU 100 H LEU 100 118.500 6.892 -7.969 733 HA LEU 100 HA LEU 100 117.339 4.440 -6.923 734 HB2 LEU 100 HB2 LEU 100 116.312 6.728 -8.589 735 HB3 LEU 100 HB3 LEU 100 115.383 5.241 -8.416 736 HG LEU 100 HG LEU 100 116.446 6.689 -5.996 737 HD11 LEU 100 HD11 LEU 100 115.105 8.284 -7.360 738 HD12 LEU 100 HD12 LEU 100 114.283 7.855 -5.859 739 HD13 LEU 100 HD13 LEU 100 113.783 7.120 -7.381 740 HD21 LEU 100 HD21 LEU 100 115.614 4.381 -5.728 741 HD22 LEU 100 HD22 LEU 100 114.103 4.826 -6.519 742 HD23 LEU 100 HD23 LEU 100 114.515 5.520 -4.952 743 H ASN 101 H ASN 101 118.049 5.855 -10.106 744 HA ASN 101 HA ASN 101 117.766 3.141 -11.289 745 HB2 ASN 101 HB2 ASN 101 117.150 4.200 -13.365 746 HB3 ASN 101 HB3 ASN 101 116.118 4.800 -12.074 747 HD21 ASN 101 HD21 ASN 101 115.962 6.547 -13.972 748 HD22 ASN 101 HD22 ASN 101 117.035 7.853 -13.825 749 H ASP 102 H ASP 102 119.013 2.838 -13.336 750 HA ASP 102 HA ASP 102 121.713 2.704 -12.748 751 HB2 ASP 102 HB2 ASP 102 120.344 2.714 -15.442 752 HB3 ASP 102 HB3 ASP 102 122.026 2.258 -15.185 753 H ARG 103 H ARG 103 119.946 5.308 -14.330 754 HA ARG 103 HA ARG 103 122.141 6.610 -15.539 755 HB2 ARG 103 HB2 ARG 103 119.493 7.676 -14.530 756 HB3 ARG 103 HB3 ARG 103 120.607 8.573 -15.569 757 HG2 ARG 103 HG2 ARG 103 120.441 6.859 -17.299 758 HG3 ARG 103 HG3 ARG 103 119.415 5.870 -16.259 759 HD2 ARG 103 HD2 ARG 103 118.003 7.071 -17.829 760 HD3 ARG 103 HD3 ARG 103 117.747 7.731 -16.215 761 HE ARG 103 HE ARG 103 118.815 9.699 -16.880 762 HH11 ARG 103 HH11 ARG 103 119.044 7.329 -19.455 763 HH12 ARG 103 HH12 ARG 103 119.608 8.496 -20.603 764 HH21 ARG 103 HH21 ARG 103 119.532 11.130 -18.351 765 HH22 ARG 103 HH22 ARG 103 119.885 10.652 -19.983 766 H ALA 104 H ALA 104 120.531 7.174 -12.408 767 HA ALA 104 HA ALA 104 122.267 9.153 -11.452 768 HB1 ALA 104 HB1 ALA 104 121.458 8.515 -9.213 769 HB2 ALA 104 HB2 ALA 104 120.750 7.050 -9.894 770 HB3 ALA 104 HB3 ALA 104 120.137 8.631 -10.374 771 H GLU 105 H GLU 105 122.566 5.617 -11.372 772 HA GLU 105 HA GLU 105 124.845 5.478 -9.717 773 HB2 GLU 105 HB2 GLU 105 124.047 3.666 -12.011 774 HB3 GLU 105 HB3 GLU 105 125.277 3.296 -10.806 775 HG2 GLU 105 HG2 GLU 105 122.366 3.869 -10.194 776 HG3 GLU 105 HG3 GLU 105 123.089 2.267 -10.250 777 H LYS 106 H LYS 106 124.536 5.889 -13.234 778 HA LYS 106 HA LYS 106 127.261 5.985 -13.881 779 HB2 LYS 106 HB2 LYS 106 125.403 5.916 -15.532 780 HB3 LYS 106 HB3 LYS 106 125.024 7.592 -15.138 781 HG2 LYS 106 HG2 LYS 106 126.394 7.702 -17.079 782 HG3 LYS 106 HG3 LYS 106 127.463 8.125 -15.743 783 HD2 LYS 106 HD2 LYS 106 128.334 5.837 -15.675 784 HD3 LYS 106 HD3 LYS 106 127.216 5.354 -16.951 785 HE2 LYS 106 HE2 LYS 106 128.297 6.771 -18.555 786 HE3 LYS 106 HE3 LYS 106 129.253 7.564 -17.302 787 HZ1 LYS 106 HZ1 LYS 106 130.553 5.682 -16.993 788 HZ2 LYS 106 HZ2 LYS 106 130.358 5.744 -18.679 789 HZ3 LYS 106 HZ3 LYS 106 129.441 4.653 -17.754 790 H ALA 107 H ALA 107 125.133 8.453 -12.552 791 HA ALA 107 HA ALA 107 126.936 10.641 -12.750 792 HB1 ALA 107 HB1 ALA 107 124.813 10.386 -10.637 793 HB2 ALA 107 HB2 ALA 107 124.401 10.668 -12.329 794 HB3 ALA 107 HB3 ALA 107 125.391 11.838 -11.455 795 H GLY 108 H GLY 108 127.361 7.891 -10.947 796 HA2 GLY 108 HA2 GLY 108 128.899 7.371 -9.352 797 HA3 GLY 108 HA3 GLY 108 129.417 9.045 -9.355 798 H HIS 109 H HIS 109 126.047 8.341 -8.693 799 HA HIS 109 HA HIS 109 126.425 9.092 -5.904 800 HB2 HIS 109 HB2 HIS 109 124.051 8.686 -7.688 801 HB3 HIS 109 HB3 HIS 109 123.841 8.699 -5.946 802 HD1 HIS 109 HD1 HIS 109 124.935 10.973 -4.767 803 HD2 HIS 109 HD2 HIS 109 123.926 11.189 -8.806 804 HE1 HIS 109 HE1 HIS 109 124.764 13.434 -5.331 805 HA PRO 110 HA PRO 110 126.469 4.796 -4.687 806 HB2 PRO 110 HB2 PRO 110 125.774 4.946 -2.058 807 HB3 PRO 110 HB3 PRO 110 127.363 5.464 -2.658 808 HG2 PRO 110 HG2 PRO 110 124.995 7.099 -1.925 809 HG3 PRO 110 HG3 PRO 110 126.719 7.423 -1.669 810 HD2 PRO 110 HD2 PRO 110 125.238 8.564 -3.691 811 HD3 PRO 110 HD3 PRO 110 126.998 8.333 -3.760 812 HA PRO 111 HA PRO 111 122.194 3.644 -5.068 813 HB2 PRO 111 HB2 PRO 111 122.271 0.974 -4.540 814 HB3 PRO 111 HB3 PRO 111 122.911 1.686 -6.034 815 HG2 PRO 111 HG2 PRO 111 124.348 0.684 -3.658 816 HG3 PRO 111 HG3 PRO 111 124.834 0.690 -5.358 817 HD2 PRO 111 HD2 PRO 111 125.727 2.494 -3.419 818 HD3 PRO 111 HD3 PRO 111 125.850 2.721 -5.175 819 H ILE 112 H ILE 112 120.292 2.935 -3.916 820 HA ILE 112 HA ILE 112 120.189 3.731 -1.225 821 HB ILE 112 HB ILE 112 118.222 2.073 -2.828 822 HG12 ILE 112 HG12 ILE 112 118.273 5.022 -2.136 823 HG13 ILE 112 HG13 ILE 112 118.797 4.363 -3.684 824 HG21 ILE 112 HG21 ILE 112 117.774 1.811 -0.421 825 HG22 ILE 112 HG22 ILE 112 116.551 2.847 -1.138 826 HG23 ILE 112 HG23 ILE 112 117.863 3.557 -0.200 827 HD11 ILE 112 HD11 ILE 112 116.470 5.193 -3.794 828 HD12 ILE 112 HD12 ILE 112 116.012 4.086 -2.502 829 HD13 ILE 112 HD13 ILE 112 116.537 3.450 -4.063 830 H THR 113 H THR 113 121.426 0.791 -2.433 831 HA THR 113 HA THR 113 120.265 -1.169 -0.989 832 HB THR 113 HB THR 113 122.059 -1.401 -2.735 833 HG1 THR 113 HG1 THR 113 122.346 -3.029 -0.513 834 HG21 THR 113 HG21 THR 113 123.832 -1.102 -0.295 835 HG22 THR 113 HG22 THR 113 123.930 -0.222 -1.818 836 HG23 THR 113 HG23 THR 113 124.336 -1.932 -1.763 837 HA PRO 114 HA PRO 114 123.255 -0.745 2.752 838 HB2 PRO 114 HB2 PRO 114 123.308 2.163 3.283 839 HB3 PRO 114 HB3 PRO 114 124.634 0.987 3.298 840 HG2 PRO 114 HG2 PRO 114 124.404 2.811 1.374 841 HG3 PRO 114 HG3 PRO 114 125.009 1.175 1.044 842 HD2 PRO 114 HD2 PRO 114 122.271 2.301 0.531 843 HD3 PRO 114 HD3 PRO 114 123.260 1.259 -0.509 844 H ILE 115 H ILE 115 120.549 1.408 2.167 845 HA ILE 115 HA ILE 115 119.640 1.116 4.943 846 HB ILE 115 HB ILE 115 117.832 2.758 4.204 847 HG12 ILE 115 HG12 ILE 115 119.813 3.358 1.992 848 HG13 ILE 115 HG13 ILE 115 118.324 2.452 1.727 849 HG21 ILE 115 HG21 ILE 115 119.698 4.647 4.234 850 HG22 ILE 115 HG22 ILE 115 120.740 3.282 4.633 851 HG23 ILE 115 HG23 ILE 115 119.353 3.665 5.654 852 HD11 ILE 115 HD11 ILE 115 116.978 4.299 2.040 853 HD12 ILE 115 HD12 ILE 115 118.416 5.107 1.416 854 HD13 ILE 115 HD13 ILE 115 118.108 5.074 3.151 855 H ARG 116 H ARG 116 119.259 -0.783 2.314 856 HA ARG 116 HA ARG 116 116.402 -1.103 2.332 857 HB2 ARG 116 HB2 ARG 116 118.585 -2.912 1.276 858 HB3 ARG 116 HB3 ARG 116 116.858 -3.184 1.044 859 HG2 ARG 116 HG2 ARG 116 116.718 -0.916 -0.032 860 HG3 ARG 116 HG3 ARG 116 118.476 -0.822 0.055 861 HD2 ARG 116 HD2 ARG 116 116.859 -2.918 -1.422 862 HD3 ARG 116 HD3 ARG 116 117.815 -1.633 -2.151 863 HE ARG 116 HE ARG 116 119.558 -3.073 -0.541 864 HH11 ARG 116 HH11 ARG 116 117.548 -3.775 -3.333 865 HH12 ARG 116 HH12 ARG 116 118.605 -5.023 -3.905 866 HH21 ARG 116 HH21 ARG 116 120.881 -4.688 -1.328 867 HH22 ARG 116 HH22 ARG 116 120.468 -5.532 -2.783 868 H ALA 117 H ALA 117 115.167 -2.597 3.387 869 HA ALA 117 HA ALA 117 116.227 -3.816 5.772 870 HB1 ALA 117 HB1 ALA 117 113.997 -4.311 6.296 871 HB2 ALA 117 HB2 ALA 117 113.526 -4.397 4.597 872 HB3 ALA 117 HB3 ALA 117 113.854 -2.832 5.343 873 H LYS 118 H LYS 118 116.338 -6.039 6.228 874 HA LYS 118 HA LYS 118 116.817 -7.768 3.954 875 HB2 LYS 118 HB2 LYS 118 118.115 -7.808 6.156 876 HB3 LYS 118 HB3 LYS 118 116.702 -8.601 6.854 877 HG2 LYS 118 HG2 LYS 118 116.885 -10.247 4.870 878 HG3 LYS 118 HG3 LYS 118 118.511 -9.597 4.656 879 HD2 LYS 118 HD2 LYS 118 117.504 -10.676 7.298 880 HD3 LYS 118 HD3 LYS 118 118.372 -11.664 6.122 881 HE2 LYS 118 HE2 LYS 118 120.109 -10.915 7.495 882 HE3 LYS 118 HE3 LYS 118 120.135 -9.726 6.192 883 HZ1 LYS 118 HZ1 LYS 118 119.473 -8.109 7.557 884 HZ2 LYS 118 HZ2 LYS 118 119.934 -9.147 8.820 885 HZ3 LYS 118 HZ3 LYS 118 118.311 -9.079 8.322 886 H GLY 119 H GLY 119 115.531 -9.388 3.224 887 HA2 GLY 119 HA2 GLY 119 113.179 -10.240 4.702 888 HA3 GLY 119 HA3 GLY 119 112.846 -9.363 3.222 889 H SER 120 H SER 120 111.893 -11.852 3.298 890 HA SER 120 HA SER 120 113.613 -13.935 2.487 891 HB2 SER 120 HB2 SER 120 110.680 -13.580 1.839 892 HB3 SER 120 HB3 SER 120 111.587 -15.087 1.782 893 HG SER 120 HG SER 120 110.598 -13.735 3.904 894 H GLY 121 H GLY 121 111.961 -11.414 0.655 895 HA2 GLY 121 HA2 GLY 121 112.171 -12.609 -1.900 896 HA3 GLY 121 HA3 GLY 121 111.928 -10.896 -1.586 897 H GLY 122 H GLY 122 114.068 -13.232 -2.728 898 HA2 GLY 122 HA2 GLY 122 116.216 -13.142 -3.545 899 HA3 GLY 122 HA3 GLY 122 115.831 -11.464 -3.894 900 H GLY 123 H GLY 123 115.896 -12.648 -0.591 901 HA2 GLY 123 HA2 GLY 123 117.524 -12.413 1.071 902 HA3 GLY 123 HA3 GLY 123 118.602 -11.686 -0.118 903 H TYR 124 H TYR 124 117.565 -9.508 -1.023 904 HA TYR 124 HA TYR 124 116.800 -7.889 1.332 905 HB2 TYR 124 HB2 TYR 124 118.373 -7.290 -1.150 906 HB3 TYR 124 HB3 TYR 124 117.598 -5.996 -0.252 907 HD1 TYR 124 HD1 TYR 124 119.376 -9.110 0.838 908 HD2 TYR 124 HD2 TYR 124 119.233 -4.817 0.923 909 HE1 TYR 124 HE1 TYR 124 121.310 -9.076 2.393 910 HE2 TYR 124 HE2 TYR 124 121.161 -4.783 2.484 911 HH TYR 124 HH TYR 124 122.222 -7.417 4.120 912 H ILE 125 H ILE 125 115.105 -6.402 1.170 913 HA ILE 125 HA ILE 125 112.983 -7.285 -0.539 914 HB ILE 125 HB ILE 125 113.150 -4.926 1.353 915 HG12 ILE 125 HG12 ILE 125 111.906 -7.666 1.720 916 HG13 ILE 125 HG13 ILE 125 113.503 -7.232 2.318 917 HG21 ILE 125 HG21 ILE 125 111.336 -4.674 -0.306 918 HG22 ILE 125 HG22 ILE 125 110.686 -5.005 1.299 919 HG23 ILE 125 HG23 ILE 125 110.749 -6.291 0.092 920 HD11 ILE 125 HD11 ILE 125 110.830 -6.463 3.335 921 HD12 ILE 125 HD12 ILE 125 112.039 -5.178 3.344 922 HD13 ILE 125 HD13 ILE 125 112.348 -6.689 4.202 923 H SER 126 H SER 126 112.201 -6.432 -2.364 924 HA SER 126 HA SER 126 113.939 -4.923 -4.006 925 HB2 SER 126 HB2 SER 126 111.011 -5.559 -4.384 926 HB3 SER 126 HB3 SER 126 112.108 -4.982 -5.633 927 HG SER 126 HG SER 126 113.279 -6.868 -5.304 928 H LEU 127 H LEU 127 114.042 -2.862 -4.569 929 HA LEU 127 HA LEU 127 112.231 -0.923 -3.321 930 HB2 LEU 127 HB2 LEU 127 114.655 -0.431 -5.062 931 HB3 LEU 127 HB3 LEU 127 113.784 0.767 -4.110 932 HG LEU 127 HG LEU 127 115.249 -1.635 -2.975 933 HD11 LEU 127 HD11 LEU 127 116.936 -0.148 -3.671 934 HD12 LEU 127 HD12 LEU 127 116.658 0.323 -1.994 935 HD13 LEU 127 HD13 LEU 127 115.960 1.274 -3.306 936 HD21 LEU 127 HD21 LEU 127 113.589 0.576 -1.784 937 HD22 LEU 127 HD22 LEU 127 114.896 -0.146 -0.845 938 HD23 LEU 127 HD23 LEU 127 113.562 -1.149 -1.418 939 H GLY 128 H GLY 128 111.765 -2.781 -5.884 940 HA2 GLY 128 HA2 GLY 128 111.699 -1.332 -8.207 941 HA3 GLY 128 HA3 GLY 128 110.533 -2.588 -7.824 942 H ALA 129 H ALA 129 109.123 -1.357 -5.723 943 HA ALA 129 HA ALA 129 107.230 0.107 -7.195 944 HB1 ALA 129 HB1 ALA 129 106.925 -1.133 -4.966 945 HB2 ALA 129 HB2 ALA 129 106.065 0.394 -5.157 946 HB3 ALA 129 HB3 ALA 129 107.548 0.331 -4.205 947 H LEU 130 H LEU 130 109.688 1.241 -4.881 948 HA LEU 130 HA LEU 130 109.024 3.969 -4.974 949 HB2 LEU 130 HB2 LEU 130 110.533 2.926 -3.296 950 HB3 LEU 130 HB3 LEU 130 111.757 2.734 -4.551 951 HG LEU 130 HG LEU 130 111.613 5.242 -4.924 952 HD11 LEU 130 HD11 LEU 130 110.705 6.498 -2.912 953 HD12 LEU 130 HD12 LEU 130 109.954 4.985 -2.403 954 HD13 LEU 130 HD13 LEU 130 109.481 5.736 -3.928 955 HD21 LEU 130 HD21 LEU 130 113.234 5.643 -3.295 956 HD22 LEU 130 HD22 LEU 130 113.264 3.884 -3.379 957 HD23 LEU 130 HD23 LEU 130 112.393 4.689 -2.075 958 H LEU 131 H LEU 131 111.220 2.032 -6.972 959 HA LEU 131 HA LEU 131 112.396 4.140 -8.411 960 HB2 LEU 131 HB2 LEU 131 113.207 1.787 -8.419 961 HB3 LEU 131 HB3 LEU 131 111.805 1.332 -9.384 962 HG LEU 131 HG LEU 131 112.558 3.078 -11.082 963 HD11 LEU 131 HD11 LEU 131 114.838 3.130 -9.127 964 HD12 LEU 131 HD12 LEU 131 114.065 4.472 -9.971 965 HD13 LEU 131 HD13 LEU 131 115.160 3.397 -10.840 966 HD21 LEU 131 HD21 LEU 131 112.917 0.684 -11.448 967 HD22 LEU 131 HD22 LEU 131 114.378 0.731 -10.461 968 HD23 LEU 131 HD23 LEU 131 114.328 1.585 -12.004 969 H SER 132 H SER 132 109.458 2.250 -9.047 970 HA SER 132 HA SER 132 108.919 3.279 -11.605 971 HB2 SER 132 HB2 SER 132 106.912 2.364 -9.531 972 HB3 SER 132 HB3 SER 132 106.642 2.481 -11.267 973 HG SER 132 HG SER 132 107.319 0.480 -11.083 974 H THR 133 H THR 133 107.910 4.411 -8.389 975 HA THR 133 HA THR 133 106.177 6.448 -9.274 976 HB THR 133 HB THR 133 107.874 6.460 -6.765 977 HG1 THR 133 HG1 THR 133 105.284 5.520 -7.031 978 HG21 THR 133 HG21 THR 133 106.786 8.606 -7.267 979 HG22 THR 133 HG22 THR 133 106.017 7.834 -5.881 980 HG23 THR 133 HG23 THR 133 105.237 7.785 -7.462 981 H THR 134 H THR 134 109.651 6.523 -8.514 982 HA THR 134 HA THR 134 109.979 9.304 -8.872 983 HB THR 134 HB THR 134 112.063 7.159 -9.320 984 HG1 THR 134 HG1 THR 134 111.080 8.367 -7.020 985 HG21 THR 134 HG21 THR 134 113.641 8.891 -8.796 986 HG22 THR 134 HG22 THR 134 112.356 9.998 -8.311 987 HG23 THR 134 HG23 THR 134 112.549 9.559 -10.008 988 H LEU 135 H LEU 135 110.302 6.595 -11.152 989 HA LEU 135 HA LEU 135 111.295 8.064 -13.331 990 HB2 LEU 135 HB2 LEU 135 109.554 5.590 -13.284 991 HB3 LEU 135 HB3 LEU 135 110.352 6.219 -14.724 992 HG LEU 135 HG LEU 135 111.829 5.485 -12.185 993 HD11 LEU 135 HD11 LEU 135 112.476 3.426 -13.322 994 HD12 LEU 135 HD12 LEU 135 111.559 3.893 -14.754 995 HD13 LEU 135 HD13 LEU 135 110.716 3.513 -13.253 996 HD21 LEU 135 HD21 LEU 135 113.707 5.381 -14.001 997 HD22 LEU 135 HD22 LEU 135 113.185 6.960 -13.413 998 HD23 LEU 135 HD23 LEU 135 112.598 6.358 -14.962 999 H ASN 136 H ASN 136 107.968 7.461 -12.255 1000 HA ASN 136 HA ASN 136 106.630 8.589 -14.448 1001 HB2 ASN 136 HB2 ASN 136 105.846 8.528 -11.526 1002 HB3 ASN 136 HB3 ASN 136 104.759 8.955 -12.845 1003 HD21 ASN 136 HD21 ASN 136 104.396 6.650 -11.079 1004 HD22 ASN 136 HD22 ASN 136 104.499 5.262 -12.051 1005 H LEU 137 H LEU 137 107.876 10.081 -11.480 1006 HA LEU 137 HA LEU 137 106.936 12.694 -11.948 1007 HB2 LEU 137 HB2 LEU 137 109.495 11.880 -10.554 1008 HB3 LEU 137 HB3 LEU 137 108.661 13.422 -10.383 1009 HG LEU 137 HG LEU 137 107.499 10.721 -9.640 1010 HD11 LEU 137 HD11 LEU 137 107.649 11.931 -7.307 1011 HD12 LEU 137 HD12 LEU 137 108.905 12.887 -8.096 1012 HD13 LEU 137 HD13 LEU 137 109.077 11.137 -7.969 1013 HD21 LEU 137 HD21 LEU 137 106.476 13.565 -9.355 1014 HD22 LEU 137 HD22 LEU 137 105.766 12.180 -8.525 1015 HD23 LEU 137 HD23 LEU 137 105.738 12.259 -10.284 1016 H CYS 138 H CYS 138 109.911 11.078 -12.977 1017 HA CYS 138 HA CYS 138 111.245 13.312 -14.000 1018 HB2 CYS 138 HB2 CYS 138 111.363 10.447 -14.948 1019 HB3 CYS 138 HB3 CYS 138 112.521 11.700 -15.368 1020 H GLY 139 H GLY 139 108.581 11.502 -15.392 1021 HA2 GLY 139 HA2 GLY 139 107.183 12.211 -17.108 1022 HA3 GLY 139 HA3 GLY 139 108.279 13.550 -17.411 1023 H LYS 140 H LYS 140 109.576 10.304 -17.333 1024 HA LYS 140 HA LYS 140 110.811 10.497 -19.812 1025 HB2 LYS 140 HB2 LYS 140 111.280 8.141 -19.619 1026 HB3 LYS 140 HB3 LYS 140 111.395 8.870 -18.021 1027 HG2 LYS 140 HG2 LYS 140 109.057 8.100 -17.555 1028 HG3 LYS 140 HG3 LYS 140 109.060 7.269 -19.111 1029 HD2 LYS 140 HD2 LYS 140 111.171 6.072 -18.318 1030 HD3 LYS 140 HD3 LYS 140 110.813 6.710 -16.712 1031 HE2 LYS 140 HE2 LYS 140 108.862 5.074 -18.355 1032 HE3 LYS 140 HE3 LYS 140 109.903 4.399 -17.102 1033 HZ1 LYS 140 HZ1 LYS 140 107.481 5.234 -16.579 1034 HZ2 LYS 140 HZ2 LYS 140 108.273 6.728 -16.417 1035 HZ3 LYS 140 HZ3 LYS 140 108.739 5.408 -15.454 1036 H GLY 141 H GLY 141 110.339 9.872 -21.878 1037 HA2 GLY 141 HA2 GLY 141 107.619 9.941 -22.691 1038 HA3 GLY 141 HA3 GLY 141 108.994 9.558 -23.723 Start of MODEL 17 1 H1 HIS -5 HT1 HIS -5 110.951 9.476 39.556 2 H2 HIS -5 HT2 HIS -5 112.195 8.572 38.836 3 H3 HIS -5 HT3 HIS -5 110.857 7.783 39.523 4 HA HIS -5 HA HIS -5 111.036 8.161 36.946 5 HB2 HIS -5 HB2 HIS -5 108.540 8.537 38.615 6 HB3 HIS -5 HB3 HIS -5 108.545 8.175 36.900 7 HD1 HIS -5 HD1 HIS -5 109.088 6.641 40.264 8 HD2 HIS -5 HD2 HIS -5 109.245 5.470 36.266 9 HE1 HIS -5 HE1 HIS -5 109.207 4.113 40.263 10 H HIS -4 H HIS -4 111.709 9.923 35.861 11 HA HIS -4 HA HIS -4 110.262 12.476 36.301 12 HB2 HIS -4 HB2 HIS -4 112.615 12.565 37.056 13 HB3 HIS -4 HB3 HIS -4 113.135 12.088 35.451 14 HD1 HIS -4 HD1 HIS -4 111.025 14.874 36.999 15 HD2 HIS -4 HD2 HIS -4 113.745 14.274 33.896 16 HE1 HIS -4 HE1 HIS -4 111.395 17.136 35.923 17 H HIS -3 H HIS -3 109.235 13.266 34.580 18 HA HIS -3 HA HIS -3 110.070 12.409 31.881 19 HB2 HIS -3 HB2 HIS -3 108.150 11.033 32.627 20 HB3 HIS -3 HB3 HIS -3 107.221 12.498 32.883 21 HD1 HIS -3 HD1 HIS -3 109.134 10.863 30.005 22 HD2 HIS -3 HD2 HIS -3 105.695 13.120 30.680 23 HE1 HIS -3 HE1 HIS -3 107.979 11.092 27.765 24 H HIS -2 H HIS -2 109.357 13.837 30.182 25 HA HIS -2 HA HIS -2 108.908 16.606 31.132 26 HB2 HIS -2 HB2 HIS -2 110.226 15.616 28.602 27 HB3 HIS -2 HB3 HIS -2 109.969 17.299 29.017 28 HD1 HIS -2 HD1 HIS -2 111.192 18.005 31.410 29 HD2 HIS -2 HD2 HIS -2 112.669 14.656 29.414 30 HE1 HIS -2 HE1 HIS -2 113.510 17.585 32.335 31 H HIS -1 H HIS -1 107.256 17.784 30.294 32 HA HIS -1 HA HIS -1 105.451 16.403 28.388 33 HB2 HIS -1 HB2 HIS -1 104.786 18.385 30.568 34 HB3 HIS -1 HB3 HIS -1 103.636 17.699 29.436 35 HD1 HIS -1 HD1 HIS -1 103.472 14.949 29.584 36 HD2 HIS -1 HD2 HIS -1 105.060 16.933 32.890 37 HE1 HIS -1 HE1 HIS -1 103.337 13.328 31.523 38 H HIS 0 H HIS 0 104.766 17.483 26.615 39 HA HIS 0 HA HIS 0 105.602 20.308 26.294 40 HB2 HIS 0 HB2 HIS 0 107.041 18.771 24.996 41 HB3 HIS 0 HB3 HIS 0 105.618 18.142 24.187 42 HD1 HIS 0 HD1 HIS 0 107.260 21.554 24.714 43 HD2 HIS 0 HD2 HIS 0 105.168 19.431 21.799 44 HE1 HIS 0 HE1 HIS 0 107.182 23.039 22.666 45 H SER 1 H SER 1 104.077 21.672 25.544 46 HA SER 1 HA SER 1 101.479 20.511 24.703 47 HB2 SER 1 HB2 SER 1 101.411 21.632 26.923 48 HB3 SER 1 HB3 SER 1 101.968 23.119 26.160 49 HG SER 1 HG SER 1 99.909 23.352 25.837 50 H SER 2 H SER 2 100.486 21.352 22.928 51 HA SER 2 HA SER 2 101.872 23.538 21.485 52 HB2 SER 2 HB2 SER 2 102.304 21.319 20.440 53 HB3 SER 2 HB3 SER 2 100.568 21.099 20.251 54 HG SER 2 HG SER 2 100.607 22.948 18.965 55 H GLY 3 H GLY 3 100.574 25.025 20.446 56 HA2 GLY 3 HA2 GLY 3 97.836 25.182 21.397 57 HA3 GLY 3 HA3 GLY 3 98.692 26.403 20.458 58 H LEU 4 H LEU 4 96.273 26.162 19.598 59 HA LEU 4 HA LEU 4 96.151 24.112 17.494 60 HB2 LEU 4 HB2 LEU 4 94.028 26.061 18.424 61 HB3 LEU 4 HB3 LEU 4 93.800 24.739 17.279 62 HG LEU 4 HG LEU 4 94.685 24.395 20.160 63 HD11 LEU 4 HD11 LEU 4 92.335 25.169 19.942 64 HD12 LEU 4 HD12 LEU 4 92.425 23.508 20.528 65 HD13 LEU 4 HD13 LEU 4 92.010 23.828 18.844 66 HD21 LEU 4 HD21 LEU 4 94.042 21.977 19.606 67 HD22 LEU 4 HD22 LEU 4 95.523 22.572 18.854 68 HD23 LEU 4 HD23 LEU 4 94.035 22.473 17.913 69 H VAL 5 H VAL 5 96.161 24.593 15.350 70 HA VAL 5 HA VAL 5 97.253 27.100 14.540 71 HB VAL 5 HB VAL 5 96.093 24.848 12.874 72 HG11 VAL 5 HG11 VAL 5 97.449 25.792 11.055 73 HG12 VAL 5 HG12 VAL 5 97.986 27.094 12.117 74 HG13 VAL 5 HG13 VAL 5 96.291 26.987 11.641 75 HG21 VAL 5 HG21 VAL 5 97.918 24.023 14.226 76 HG22 VAL 5 HG22 VAL 5 98.897 25.444 13.859 77 HG23 VAL 5 HG23 VAL 5 98.537 24.270 12.593 78 HA PRO 6 HA PRO 6 93.206 28.922 13.807 79 HB2 PRO 6 HB2 PRO 6 93.931 31.307 12.764 80 HB3 PRO 6 HB3 PRO 6 94.222 30.899 14.466 81 HG2 PRO 6 HG2 PRO 6 96.119 31.074 12.225 82 HG3 PRO 6 HG3 PRO 6 96.386 31.302 13.960 83 HD2 PRO 6 HD2 PRO 6 96.967 28.971 12.425 84 HD3 PRO 6 HD3 PRO 6 97.103 29.162 14.185 85 H ARG 7 H ARG 7 91.735 28.666 12.211 86 HA ARG 7 HA ARG 7 92.472 29.131 9.426 87 HB2 ARG 7 HB2 ARG 7 91.642 26.920 8.702 88 HB3 ARG 7 HB3 ARG 7 93.060 26.778 9.742 89 HG2 ARG 7 HG2 ARG 7 91.585 26.342 11.682 90 HG3 ARG 7 HG3 ARG 7 90.177 26.446 10.624 91 HD2 ARG 7 HD2 ARG 7 90.693 24.114 10.855 92 HD3 ARG 7 HD3 ARG 7 91.201 24.593 9.239 93 HE ARG 7 HE ARG 7 93.315 24.834 11.170 94 HH11 ARG 7 HH11 ARG 7 91.667 22.527 9.099 95 HH12 ARG 7 HH12 ARG 7 93.030 21.462 9.032 96 HH21 ARG 7 HH21 ARG 7 95.038 23.423 11.046 97 HH22 ARG 7 HH22 ARG 7 94.915 21.964 10.121 98 H GLY 8 H GLY 8 90.573 29.048 7.985 99 HA2 GLY 8 HA2 GLY 8 88.298 29.284 7.509 100 HA3 GLY 8 HA3 GLY 8 87.944 29.107 9.226 101 H SER 9 H SER 9 86.450 30.933 8.687 102 HA SER 9 HA SER 9 87.846 33.511 9.079 103 HB2 SER 9 HB2 SER 9 86.265 34.609 7.599 104 HB3 SER 9 HB3 SER 9 87.053 33.297 6.729 105 HG SER 9 HG SER 9 84.703 33.425 6.626 106 H GLY 10 H GLY 10 86.581 35.120 10.180 107 HA2 GLY 10 HA2 GLY 10 84.875 33.947 12.223 108 HA3 GLY 10 HA3 GLY 10 85.472 35.603 12.181 109 H MET 11 H MET 11 83.066 35.742 12.889 110 HA MET 11 HA MET 11 81.317 35.961 10.514 111 HB2 MET 11 HB2 MET 11 80.663 35.760 13.463 112 HB3 MET 11 HB3 MET 11 79.466 36.038 12.196 113 HG2 MET 11 HG2 MET 11 80.188 33.924 11.093 114 HG3 MET 11 HG3 MET 11 81.293 33.630 12.436 115 HE1 MET 11 HE1 MET 11 79.527 31.572 11.591 116 HE2 MET 11 HE2 MET 11 78.445 31.039 12.874 117 HE3 MET 11 HE3 MET 11 80.160 31.262 13.212 118 H LYS 12 H LYS 12 79.870 37.833 10.441 119 HA LYS 12 HA LYS 12 81.297 40.266 10.827 120 HB2 LYS 12 HB2 LYS 12 79.617 39.877 9.018 121 HB3 LYS 12 HB3 LYS 12 78.349 39.896 10.241 122 HG2 LYS 12 HG2 LYS 12 78.402 42.110 9.387 123 HG3 LYS 12 HG3 LYS 12 79.262 42.198 10.923 124 HD2 LYS 12 HD2 LYS 12 81.414 42.069 9.767 125 HD3 LYS 12 HD3 LYS 12 80.593 41.874 8.217 126 HE2 LYS 12 HE2 LYS 12 81.139 44.179 8.308 127 HE3 LYS 12 HE3 LYS 12 79.433 44.112 8.753 128 HZ1 LYS 12 HZ1 LYS 12 80.756 45.518 10.247 129 HZ2 LYS 12 HZ2 LYS 12 81.685 44.164 10.688 130 HZ3 LYS 12 HZ3 LYS 12 80.027 44.220 11.062 131 H GLU 13 H GLU 13 81.431 41.501 12.577 132 HA GLU 13 HA GLU 13 79.332 41.286 14.658 133 HB2 GLU 13 HB2 GLU 13 81.460 40.130 15.301 134 HB3 GLU 13 HB3 GLU 13 82.289 41.680 15.159 135 HG2 GLU 13 HG2 GLU 13 80.710 42.640 16.829 136 HG3 GLU 13 HG3 GLU 13 79.976 41.054 17.014 137 H THR 14 H THR 14 78.705 43.179 15.635 138 HA THR 14 HA THR 14 79.254 45.623 14.222 139 HB THR 14 HB THR 14 77.037 45.214 15.164 140 HG1 THR 14 HG1 THR 14 77.942 47.345 15.138 141 HG21 THR 14 HG21 THR 14 76.786 45.312 17.673 142 HG22 THR 14 HG22 THR 14 78.539 45.154 17.792 143 HG23 THR 14 HG23 THR 14 77.582 43.855 17.079 144 H ALA 15 H ALA 15 80.195 47.531 15.115 145 HA ALA 15 HA ALA 15 82.623 47.081 16.490 146 HB1 ALA 15 HB1 ALA 15 81.830 49.061 14.936 147 HB2 ALA 15 HB2 ALA 15 83.029 49.342 16.198 148 HB3 ALA 15 HB3 ALA 15 81.344 49.787 16.467 149 H ALA 16 H ALA 16 83.163 47.160 18.597 150 HA ALA 16 HA ALA 16 81.340 48.333 20.551 151 HB1 ALA 16 HB1 ALA 16 82.058 45.399 20.496 152 HB2 ALA 16 HB2 ALA 16 80.447 46.118 20.502 153 HB3 ALA 16 HB3 ALA 16 81.463 46.215 21.941 154 H ALA 17 H ALA 17 82.324 48.653 22.623 155 HA ALA 17 HA ALA 17 85.069 49.341 22.521 156 HB1 ALA 17 HB1 ALA 17 83.221 50.256 24.073 157 HB2 ALA 17 HB2 ALA 17 84.828 50.026 24.763 158 HB3 ALA 17 HB3 ALA 17 83.555 48.846 25.078 159 H LYS 18 H LYS 18 86.882 48.350 23.388 160 HA LYS 18 HA LYS 18 86.760 45.466 23.535 161 HB2 LYS 18 HB2 LYS 18 89.203 45.597 23.763 162 HB3 LYS 18 HB3 LYS 18 88.637 46.568 22.406 163 HG2 LYS 18 HG2 LYS 18 88.771 48.601 23.773 164 HG3 LYS 18 HG3 LYS 18 89.279 47.646 25.167 165 HD2 LYS 18 HD2 LYS 18 91.273 48.563 24.189 166 HD3 LYS 18 HD3 LYS 18 91.242 46.848 23.774 167 HE2 LYS 18 HE2 LYS 18 90.401 47.334 21.557 168 HE3 LYS 18 HE3 LYS 18 90.200 49.039 21.959 169 HZ1 LYS 18 HZ1 LYS 18 92.812 47.639 22.048 170 HZ2 LYS 18 HZ2 LYS 18 92.529 49.311 22.146 171 HZ3 LYS 18 HZ3 LYS 18 92.257 48.486 20.687 172 H PHE 19 H PHE 19 86.955 44.189 25.301 173 HA PHE 19 HA PHE 19 87.167 45.524 27.941 174 HB2 PHE 19 HB2 PHE 19 85.500 43.127 27.168 175 HB3 PHE 19 HB3 PHE 19 85.684 43.746 28.799 176 HD1 PHE 19 HD1 PHE 19 84.726 45.967 29.408 177 HD2 PHE 19 HD2 PHE 19 84.039 44.155 25.573 178 HE1 PHE 19 HE1 PHE 19 82.828 47.514 29.017 179 HE2 PHE 19 HE2 PHE 19 82.141 45.703 25.183 180 HZ PHE 19 HZ PHE 19 81.534 47.382 26.904 181 H GLU 20 H GLU 20 88.153 44.295 29.621 182 HA GLU 20 HA GLU 20 90.499 42.945 28.903 183 HB2 GLU 20 HB2 GLU 20 88.957 42.838 31.506 184 HB3 GLU 20 HB3 GLU 20 90.621 42.294 31.288 185 HG2 GLU 20 HG2 GLU 20 89.626 45.112 30.782 186 HG3 GLU 20 HG3 GLU 20 90.518 44.593 32.207 187 H ARG 21 H ARG 21 91.079 40.774 28.880 188 HA ARG 21 HA ARG 21 88.966 38.776 29.221 189 HB2 ARG 21 HB2 ARG 21 89.393 37.758 27.048 190 HB3 ARG 21 HB3 ARG 21 88.888 39.434 26.842 191 HG2 ARG 21 HG2 ARG 21 91.326 40.068 26.693 192 HG3 ARG 21 HG3 ARG 21 91.712 38.346 26.682 193 HD2 ARG 21 HD2 ARG 21 90.236 38.076 24.683 194 HD3 ARG 21 HD3 ARG 21 90.001 39.821 24.662 195 HE ARG 21 HE ARG 21 92.723 39.509 24.648 196 HH11 ARG 21 HH11 ARG 21 90.144 38.316 22.585 197 HH12 ARG 21 HH12 ARG 21 91.160 38.253 21.184 198 HH21 ARG 21 HH21 ARG 21 93.981 39.407 22.809 199 HH22 ARG 21 HH22 ARG 21 93.305 38.863 21.311 200 H GLN 22 H GLN 22 89.795 36.566 29.266 201 HA GLN 22 HA GLN 22 92.601 36.461 30.217 202 HB2 GLN 22 HB2 GLN 22 90.197 34.851 31.105 203 HB3 GLN 22 HB3 GLN 22 91.853 34.574 31.648 204 HG2 GLN 22 HG2 GLN 22 91.961 36.828 32.584 205 HG3 GLN 22 HG3 GLN 22 90.345 37.182 31.977 206 HE21 GLN 22 HE21 GLN 22 90.971 37.344 34.770 207 HE22 GLN 22 HE22 GLN 22 90.114 36.121 35.577 208 H HIS 23 H HIS 23 93.739 34.468 29.844 209 HA HIS 23 HA HIS 23 92.871 33.132 27.354 210 HB2 HIS 23 HB2 HIS 23 95.028 34.310 27.261 211 HB3 HIS 23 HB3 HIS 23 95.612 33.349 28.606 212 HD1 HIS 23 HD1 HIS 23 96.398 30.960 28.104 213 HD2 HIS 23 HD2 HIS 23 94.819 32.898 24.768 214 HE1 HIS 23 HE1 HIS 23 96.967 29.517 26.103 215 H MET 24 H MET 24 92.504 30.987 27.318 216 HA MET 24 HA MET 24 92.711 29.545 29.874 217 HB2 MET 24 HB2 MET 24 91.152 28.955 27.348 218 HB3 MET 24 HB3 MET 24 91.175 27.912 28.771 219 HG2 MET 24 HG2 MET 24 90.338 29.818 30.141 220 HG3 MET 24 HG3 MET 24 90.227 30.790 28.674 221 HE1 MET 24 HE1 MET 24 86.524 30.082 29.494 222 HE2 MET 24 HE2 MET 24 87.677 31.294 28.939 223 HE3 MET 24 HE3 MET 24 87.900 30.527 30.510 224 H ASP 25 H ASP 25 93.716 27.548 30.044 225 HA ASP 25 HA ASP 25 95.956 27.134 28.294 226 HB2 ASP 25 HB2 ASP 25 96.501 25.270 29.770 227 HB3 ASP 25 HB3 ASP 25 96.084 26.694 30.718 228 H SER 26 H SER 26 96.359 24.647 27.745 229 HA SER 26 HA SER 26 94.645 24.031 25.603 230 HB2 SER 26 HB2 SER 26 95.939 22.038 25.337 231 HB3 SER 26 HB3 SER 26 97.046 23.284 25.907 232 HG SER 26 HG SER 26 97.283 21.448 27.138 233 HA PRO 27 HA PRO 27 91.266 21.862 27.423 234 HB2 PRO 27 HB2 PRO 27 91.590 19.598 25.531 235 HB3 PRO 27 HB3 PRO 27 90.209 20.683 25.771 236 HG2 PRO 27 HG2 PRO 27 91.773 20.843 23.618 237 HG3 PRO 27 HG3 PRO 27 91.040 22.278 24.360 238 HD2 PRO 27 HD2 PRO 27 93.872 21.316 24.525 239 HD3 PRO 27 HD3 PRO 27 93.243 22.978 24.455 240 H ASP 28 H ASP 28 90.671 19.969 28.673 241 HA ASP 28 HA ASP 28 92.915 18.813 30.051 242 HB2 ASP 28 HB2 ASP 28 91.193 17.691 31.417 243 HB3 ASP 28 HB3 ASP 28 90.910 19.422 31.285 244 H LEU 29 H LEU 29 92.366 16.293 30.651 245 HA LEU 29 HA LEU 29 92.779 14.907 28.107 246 HB2 LEU 29 HB2 LEU 29 94.230 14.627 30.225 247 HB3 LEU 29 HB3 LEU 29 92.895 13.661 30.848 248 HG LEU 29 HG LEU 29 93.952 13.076 28.103 249 HD11 LEU 29 HD11 LEU 29 95.895 13.234 29.739 250 HD12 LEU 29 HD12 LEU 29 95.692 11.666 28.959 251 HD13 LEU 29 HD13 LEU 29 95.151 11.900 30.621 252 HD21 LEU 29 HD21 LEU 29 92.441 11.666 30.279 253 HD22 LEU 29 HD22 LEU 29 93.403 10.698 29.162 254 HD23 LEU 29 HD23 LEU 29 92.115 11.729 28.548 255 H GLY 30 H GLY 30 91.295 13.614 27.185 256 HA2 GLY 30 HA2 GLY 30 88.600 13.739 27.837 257 HA3 GLY 30 HA3 GLY 30 89.317 12.501 26.811 258 H THR 31 H THR 31 87.216 12.563 29.053 259 HA THR 31 HA THR 31 88.212 10.152 30.420 260 HB THR 31 HB THR 31 88.496 12.052 31.961 261 HG1 THR 31 HG1 THR 31 87.956 10.556 33.275 262 HG21 THR 31 HG21 THR 31 86.808 13.580 31.165 263 HG22 THR 31 HG22 THR 31 86.408 13.162 32.832 264 HG23 THR 31 HG23 THR 31 85.526 12.416 31.499 265 H ASP 32 H ASP 32 86.460 8.834 31.348 266 HA ASP 32 HA ASP 32 84.241 8.696 29.490 267 HB2 ASP 32 HB2 ASP 32 85.428 6.664 30.295 268 HB3 ASP 32 HB3 ASP 32 84.831 6.991 31.920 269 H ASP 33 H ASP 33 82.609 10.074 29.781 270 HA ASP 33 HA ASP 33 81.260 10.116 32.382 271 HB2 ASP 33 HB2 ASP 33 82.254 12.566 30.921 272 HB3 ASP 33 HB3 ASP 33 80.991 12.627 32.148 273 H ASP 34 H ASP 34 79.162 11.507 32.109 274 HA ASP 34 HA ASP 34 77.558 10.300 30.126 275 HB2 ASP 34 HB2 ASP 34 76.714 11.251 32.277 276 HB3 ASP 34 HB3 ASP 34 76.996 12.866 31.630 277 H ASP 35 H ASP 35 76.657 11.126 28.221 278 HA ASP 35 HA ASP 35 78.383 12.579 26.562 279 HB2 ASP 35 HB2 ASP 35 75.401 12.129 26.304 280 HB3 ASP 35 HB3 ASP 35 76.443 12.730 25.017 281 H LYS 36 H LYS 36 78.609 14.686 26.064 282 HA LYS 36 HA LYS 36 76.682 16.631 27.129 283 HB2 LYS 36 HB2 LYS 36 78.510 18.012 28.041 284 HB3 LYS 36 HB3 LYS 36 78.429 16.440 28.836 285 HG2 LYS 36 HG2 LYS 36 80.245 15.600 27.413 286 HG3 LYS 36 HG3 LYS 36 80.312 17.147 26.567 287 HD2 LYS 36 HD2 LYS 36 82.057 17.184 28.219 288 HD3 LYS 36 HD3 LYS 36 80.771 18.239 28.807 289 HE2 LYS 36 HE2 LYS 36 79.974 16.576 30.331 290 HE3 LYS 36 HE3 LYS 36 80.973 15.325 29.592 291 HZ1 LYS 36 HZ1 LYS 36 82.927 16.337 30.404 292 HZ2 LYS 36 HZ2 LYS 36 81.845 16.288 31.714 293 HZ3 LYS 36 HZ3 LYS 36 82.104 17.744 30.877 294 H THR 37 H THR 37 77.798 18.955 26.447 295 HA THR 37 HA THR 37 77.417 19.171 23.688 296 HB THR 37 HB THR 37 77.235 21.086 25.199 297 HG1 THR 37 HG1 THR 37 77.720 22.090 23.459 298 HG21 THR 37 HG21 THR 37 79.142 22.073 26.268 299 HG22 THR 37 HG22 THR 37 80.252 21.009 25.404 300 HG23 THR 37 HG23 THR 37 79.185 20.350 26.644 301 H GLY 38 H GLY 38 79.247 20.304 22.292 302 HA2 GLY 38 HA2 GLY 38 81.180 18.253 21.803 303 HA3 GLY 38 HA3 GLY 38 81.058 19.791 20.954 304 H GLY 39 H GLY 39 83.531 19.171 21.255 305 HA2 GLY 39 HA2 GLY 39 84.547 20.976 23.296 306 HA3 GLY 39 HA3 GLY 39 85.034 19.293 23.474 307 H GLY 40 H GLY 40 87.230 19.940 23.145 308 HA2 GLY 40 HA2 GLY 40 88.035 21.197 20.676 309 HA3 GLY 40 HA3 GLY 40 89.102 20.542 21.915 310 H ARG 41 H ARG 41 90.145 19.922 19.721 311 HA ARG 41 HA ARG 41 89.019 17.799 18.199 312 HB2 ARG 41 HB2 ARG 41 90.797 19.343 17.375 313 HB3 ARG 41 HB3 ARG 41 91.936 18.562 18.472 314 HG2 ARG 41 HG2 ARG 41 91.443 16.378 17.368 315 HG3 ARG 41 HG3 ARG 41 90.414 17.228 16.214 316 HD2 ARG 41 HD2 ARG 41 93.367 17.758 16.652 317 HD3 ARG 41 HD3 ARG 41 92.680 16.866 15.298 318 HE ARG 41 HE ARG 41 91.404 19.340 15.350 319 HH11 ARG 41 HH11 ARG 41 94.689 18.184 14.898 320 HH12 ARG 41 HH12 ARG 41 95.131 19.529 13.899 321 HH21 ARG 41 HH21 ARG 41 92.031 21.046 14.059 322 HH22 ARG 41 HH22 ARG 41 93.644 21.129 13.431 323 H ALA 42 H ALA 42 89.332 15.612 18.290 324 HA ALA 42 HA ALA 42 89.802 14.421 20.811 325 HB1 ALA 42 HB1 ALA 42 89.959 13.011 18.144 326 HB2 ALA 42 HB2 ALA 42 88.431 13.475 18.890 327 HB3 ALA 42 HB3 ALA 42 89.498 12.330 19.705 328 H ASP 43 H ASP 43 91.507 13.074 21.507 329 HA ASP 43 HA ASP 43 94.097 14.029 21.070 330 HB2 ASP 43 HB2 ASP 43 93.194 11.334 22.111 331 HB3 ASP 43 HB3 ASP 43 94.838 11.956 22.230 332 HA PRO 44 HA PRO 44 95.555 12.185 17.365 333 HB2 PRO 44 HB2 PRO 44 97.901 10.968 18.717 334 HB3 PRO 44 HB3 PRO 44 97.843 12.157 17.402 335 HG2 PRO 44 HG2 PRO 44 98.558 12.834 19.877 336 HG3 PRO 44 HG3 PRO 44 97.639 13.933 18.830 337 HD2 PRO 44 HD2 PRO 44 96.667 12.285 21.136 338 HD3 PRO 44 HD3 PRO 44 96.171 13.914 20.624 339 H ALA 45 H ALA 45 95.421 10.286 16.197 340 HA ALA 45 HA ALA 45 95.345 7.729 17.631 341 HB1 ALA 45 HB1 ALA 45 93.087 8.617 15.822 342 HB2 ALA 45 HB2 ALA 45 93.009 8.646 17.584 343 HB3 ALA 45 HB3 ALA 45 93.190 7.111 16.734 344 H HIS 46 H HIS 46 95.348 5.875 16.143 345 HA HIS 46 HA HIS 46 97.120 6.373 13.915 346 HB2 HIS 46 HB2 HIS 46 97.429 4.419 15.357 347 HB3 HIS 46 HB3 HIS 46 95.839 3.828 14.918 348 HD1 HIS 46 HD1 HIS 46 95.597 2.636 12.656 349 HD2 HIS 46 HD2 HIS 46 99.429 4.139 13.316 350 HE1 HIS 46 HE1 HIS 46 97.073 1.647 10.853 351 H ARG 47 H ARG 47 96.620 6.438 11.804 352 HA ARG 47 HA ARG 47 93.850 5.768 10.988 353 HB2 ARG 47 HB2 ARG 47 95.544 8.108 10.080 354 HB3 ARG 47 HB3 ARG 47 93.976 7.667 9.403 355 HG2 ARG 47 HG2 ARG 47 92.962 7.922 11.664 356 HG3 ARG 47 HG3 ARG 47 94.526 8.467 12.275 357 HD2 ARG 47 HD2 ARG 47 94.479 10.289 10.533 358 HD3 ARG 47 HD3 ARG 47 92.827 9.808 10.157 359 HE ARG 47 HE ARG 47 92.699 10.198 12.820 360 HH11 ARG 47 HH11 ARG 47 94.027 12.222 10.277 361 HH12 ARG 47 HH12 ARG 47 93.698 13.689 11.135 362 HH21 ARG 47 HH21 ARG 47 92.302 12.121 13.878 363 HH22 ARG 47 HH22 ARG 47 92.734 13.632 13.149 364 H SER 48 H SER 48 93.594 5.013 8.849 365 HA SER 48 HA SER 48 95.601 3.263 7.930 366 HB2 SER 48 HB2 SER 48 93.345 4.374 6.253 367 HB3 SER 48 HB3 SER 48 94.161 2.824 6.076 368 HG SER 48 HG SER 48 92.084 2.963 7.279 369 HA PRO 49 HA PRO 49 98.431 5.608 5.506 370 HB2 PRO 49 HB2 PRO 49 97.629 4.046 3.088 371 HB3 PRO 49 HB3 PRO 49 99.246 4.354 3.751 372 HG2 PRO 49 HG2 PRO 49 98.047 1.998 4.047 373 HG3 PRO 49 HG3 PRO 49 99.079 2.690 5.311 374 HD2 PRO 49 HD2 PRO 49 96.117 2.432 5.248 375 HD3 PRO 49 HD3 PRO 49 97.219 2.470 6.640 376 H VAL 50 H VAL 50 98.350 7.537 4.440 377 HA VAL 50 HA VAL 50 95.722 8.402 3.520 378 HB VAL 50 HB VAL 50 98.286 9.962 3.946 379 HG11 VAL 50 HG11 VAL 50 96.852 11.947 3.830 380 HG12 VAL 50 HG12 VAL 50 95.442 10.932 3.530 381 HG13 VAL 50 HG13 VAL 50 96.732 11.029 2.330 382 HG21 VAL 50 HG21 VAL 50 97.246 8.921 5.993 383 HG22 VAL 50 HG22 VAL 50 95.783 9.844 5.650 384 HG23 VAL 50 HG23 VAL 50 97.285 10.684 6.028 385 HA PRO 51 HA PRO 51 96.803 7.948 -0.838 386 HB2 PRO 51 HB2 PRO 51 95.491 10.602 -1.218 387 HB3 PRO 51 HB3 PRO 51 95.212 9.073 -2.074 388 HG2 PRO 51 HG2 PRO 51 93.489 9.979 -0.266 389 HG3 PRO 51 HG3 PRO 51 93.833 8.248 -0.438 390 HD2 PRO 51 HD2 PRO 51 94.722 10.134 1.693 391 HD3 PRO 51 HD3 PRO 51 94.369 8.397 1.798 392 H LEU 52 H LEU 52 98.146 9.028 -2.483 393 HA LEU 52 HA LEU 52 100.399 10.293 -1.339 394 HB2 LEU 52 HB2 LEU 52 99.481 9.722 -4.133 395 HB3 LEU 52 HB3 LEU 52 100.836 10.824 -3.898 396 HG LEU 52 HG LEU 52 100.717 8.060 -2.666 397 HD11 LEU 52 HD11 LEU 52 101.971 9.025 -5.253 398 HD12 LEU 52 HD12 LEU 52 100.715 7.798 -5.080 399 HD13 LEU 52 HD13 LEU 52 102.348 7.477 -4.494 400 HD21 LEU 52 HD21 LEU 52 102.291 9.392 -1.489 401 HD22 LEU 52 HD22 LEU 52 102.812 10.218 -2.957 402 HD23 LEU 52 HD23 LEU 52 103.264 8.536 -2.684 403 HA PRO 53 HA PRO 53 99.031 14.539 -1.727 404 HB2 PRO 53 HB2 PRO 53 101.373 15.885 -1.569 405 HB3 PRO 53 HB3 PRO 53 100.682 15.040 -0.170 406 HG2 PRO 53 HG2 PRO 53 102.934 14.261 -1.920 407 HG3 PRO 53 HG3 PRO 53 102.684 13.964 -0.192 408 HD2 PRO 53 HD2 PRO 53 102.234 12.106 -2.245 409 HD3 PRO 53 HD3 PRO 53 101.638 11.976 -0.578 410 H SER 54 H SER 54 98.894 16.239 -3.270 411 HA SER 54 HA SER 54 99.097 15.462 -5.926 412 HB2 SER 54 HB2 SER 54 98.802 17.938 -6.425 413 HB3 SER 54 HB3 SER 54 97.593 17.223 -5.362 414 HG SER 54 HG SER 54 98.297 18.992 -4.331 415 HA PRO 55 HA PRO 55 103.438 15.928 -6.387 416 HB2 PRO 55 HB2 PRO 55 103.770 15.545 -9.037 417 HB3 PRO 55 HB3 PRO 55 103.208 14.248 -7.962 418 HG2 PRO 55 HG2 PRO 55 101.676 15.914 -9.872 419 HG3 PRO 55 HG3 PRO 55 101.451 14.218 -9.411 420 HD2 PRO 55 HD2 PRO 55 99.965 16.378 -8.422 421 HD3 PRO 55 HD3 PRO 55 100.043 14.757 -7.702 422 H THR 56 H THR 56 104.447 17.848 -6.087 423 HA THR 56 HA THR 56 104.094 20.100 -7.857 424 HB THR 56 HB THR 56 105.972 21.087 -6.650 425 HG1 THR 56 HG1 THR 56 107.374 19.581 -6.223 426 HG21 THR 56 HG21 THR 56 104.281 19.522 -4.684 427 HG22 THR 56 HG22 THR 56 103.710 20.950 -5.547 428 HG23 THR 56 HG23 THR 56 105.058 21.084 -4.417 429 H SER 57 H SER 57 105.920 20.895 -9.270 430 HA SER 57 HA SER 57 106.464 18.936 -11.178 431 HB2 SER 57 HB2 SER 57 107.909 21.551 -10.700 432 HB3 SER 57 HB3 SER 57 108.041 20.577 -12.160 433 HG SER 57 HG SER 57 106.431 22.229 -12.227 434 H ASN 58 H ASN 58 107.799 17.307 -11.201 435 HA ASN 58 HA ASN 58 109.642 16.035 -11.077 436 HB2 ASN 58 HB2 ASN 58 111.741 17.010 -11.343 437 HB3 ASN 58 HB3 ASN 58 110.622 18.150 -12.068 438 HD21 ASN 58 HD21 ASN 58 111.191 20.258 -11.556 439 HD22 ASN 58 HD22 ASN 58 111.868 20.757 -10.081 440 H LYS 59 H LYS 59 108.150 16.823 -8.468 441 HA LYS 59 HA LYS 59 110.075 15.518 -6.715 442 HB2 LYS 59 HB2 LYS 59 110.669 17.917 -6.595 443 HB3 LYS 59 HB3 LYS 59 109.030 18.280 -6.059 444 HG2 LYS 59 HG2 LYS 59 109.365 16.785 -4.100 445 HG3 LYS 59 HG3 LYS 59 111.028 16.511 -4.617 446 HD2 LYS 59 HD2 LYS 59 111.414 18.987 -4.493 447 HD3 LYS 59 HD3 LYS 59 109.796 19.159 -3.809 448 HE2 LYS 59 HE2 LYS 59 110.546 17.434 -2.051 449 HE3 LYS 59 HE3 LYS 59 112.186 17.747 -2.619 450 HZ1 LYS 59 HZ1 LYS 59 111.095 20.227 -2.300 451 HZ2 LYS 59 HZ2 LYS 59 112.174 19.463 -1.233 452 HZ3 LYS 59 HZ3 LYS 59 110.499 19.358 -0.969 453 H GLN 60 H GLN 60 109.140 14.334 -5.147 454 HA GLN 60 HA GLN 60 106.522 15.125 -4.088 455 HB2 GLN 60 HB2 GLN 60 107.148 12.409 -5.225 456 HB3 GLN 60 HB3 GLN 60 105.922 12.626 -3.980 457 HG2 GLN 60 HG2 GLN 60 104.820 14.332 -5.460 458 HG3 GLN 60 HG3 GLN 60 105.982 13.905 -6.717 459 HE21 GLN 60 HE21 GLN 60 102.872 13.115 -5.544 460 HE22 GLN 60 HE22 GLN 60 102.745 11.589 -6.275 461 H ASP 61 H ASP 61 106.194 14.543 -1.931 462 HA ASP 61 HA ASP 61 108.545 13.495 -0.511 463 HB2 ASP 61 HB2 ASP 61 105.978 14.735 0.517 464 HB3 ASP 61 HB3 ASP 61 107.315 14.197 1.528 465 H ILE 62 H ILE 62 108.607 11.409 0.169 466 HA ILE 62 HA ILE 62 106.053 9.903 0.235 467 HB ILE 62 HB ILE 62 107.386 9.502 -1.845 468 HG12 ILE 62 HG12 ILE 62 107.328 6.970 -1.561 469 HG13 ILE 62 HG13 ILE 62 106.877 7.266 0.119 470 HG21 ILE 62 HG21 ILE 62 109.651 9.673 -0.975 471 HG22 ILE 62 HG22 ILE 62 109.404 8.057 -1.637 472 HG23 ILE 62 HG23 ILE 62 109.371 8.309 0.107 473 HD11 ILE 62 HD11 ILE 62 104.805 8.129 -0.442 474 HD12 ILE 62 HD12 ILE 62 105.018 6.989 -1.769 475 HD13 ILE 62 HD13 ILE 62 105.343 8.701 -2.021 476 H SER 63 H SER 63 105.928 8.179 1.761 477 HA SER 63 HA SER 63 108.094 7.968 3.700 478 HB2 SER 63 HB2 SER 63 106.845 8.765 5.583 479 HB3 SER 63 HB3 SER 63 106.786 10.011 4.341 480 HG SER 63 HG SER 63 104.754 9.113 3.788 481 H GLU 64 H GLU 64 107.719 6.382 5.359 482 HA GLU 64 HA GLU 64 106.724 3.965 4.445 483 HB2 GLU 64 HB2 GLU 64 106.946 3.189 6.767 484 HB3 GLU 64 HB3 GLU 64 108.335 4.157 6.276 485 HG2 GLU 64 HG2 GLU 64 107.301 6.139 7.356 486 HG3 GLU 64 HG3 GLU 64 105.983 5.120 7.922 487 H ALA 65 H ALA 65 105.068 6.515 6.242 488 HA ALA 65 HA ALA 65 102.898 5.026 7.208 489 HB1 ALA 65 HB1 ALA 65 103.018 7.148 8.128 490 HB2 ALA 65 HB2 ALA 65 101.711 7.362 6.961 491 HB3 ALA 65 HB3 ALA 65 103.340 7.918 6.575 492 H ASN 66 H ASN 66 103.321 6.719 4.108 493 HA ASN 66 HA ASN 66 100.641 6.276 3.235 494 HB2 ASN 66 HB2 ASN 66 103.069 6.834 1.520 495 HB3 ASN 66 HB3 ASN 66 101.379 7.089 1.091 496 HD21 ASN 66 HD21 ASN 66 100.220 8.856 2.211 497 HD22 ASN 66 HD22 ASN 66 101.085 10.119 2.941 498 H LEU 67 H LEU 67 103.732 4.660 2.510 499 HA LEU 67 HA LEU 67 102.550 2.827 0.664 500 HB2 LEU 67 HB2 LEU 67 105.239 3.025 1.980 501 HB3 LEU 67 HB3 LEU 67 104.804 1.601 1.032 502 HG LEU 67 HG LEU 67 104.089 3.256 -0.803 503 HD11 LEU 67 HD11 LEU 67 105.461 5.052 1.166 504 HD12 LEU 67 HD12 LEU 67 104.017 5.351 0.200 505 HD13 LEU 67 HD13 LEU 67 105.610 5.389 -0.555 506 HD21 LEU 67 HD21 LEU 67 106.362 1.879 -0.486 507 HD22 LEU 67 HD22 LEU 67 107.040 3.501 -0.351 508 HD23 LEU 67 HD23 LEU 67 106.161 3.033 -1.802 509 H ALA 68 H ALA 68 102.939 2.748 4.127 510 HA ALA 68 HA ALA 68 102.252 1.243 5.698 511 HB1 ALA 68 HB1 ALA 68 100.398 -0.020 5.261 512 HB2 ALA 68 HB2 ALA 68 101.056 -0.660 3.754 513 HB3 ALA 68 HB3 ALA 68 100.361 0.960 3.795 514 H TYR 69 H TYR 69 102.169 -1.784 5.029 515 HA TYR 69 HA TYR 69 104.784 -2.345 5.855 516 HB2 TYR 69 HB2 TYR 69 102.791 -4.108 4.437 517 HB3 TYR 69 HB3 TYR 69 104.263 -4.682 5.199 518 HD1 TYR 69 HD1 TYR 69 104.543 -4.413 7.697 519 HD2 TYR 69 HD2 TYR 69 100.821 -3.667 5.686 520 HE1 TYR 69 HE1 TYR 69 103.341 -4.585 9.859 521 HE2 TYR 69 HE2 TYR 69 99.619 -3.838 7.850 522 HH TYR 69 HH TYR 69 101.195 -3.846 10.810 523 H LEU 70 H LEU 70 103.627 -1.638 2.681 524 HA LEU 70 HA LEU 70 105.442 -3.079 1.087 525 HB2 LEU 70 HB2 LEU 70 104.230 -0.360 0.550 526 HB3 LEU 70 HB3 LEU 70 104.944 -1.433 -0.653 527 HG LEU 70 HG LEU 70 102.560 -2.136 1.087 528 HD11 LEU 70 HD11 LEU 70 101.375 -2.007 -1.179 529 HD12 LEU 70 HD12 LEU 70 102.799 -1.147 -1.761 530 HD13 LEU 70 HD13 LEU 70 101.831 -0.466 -0.454 531 HD21 LEU 70 HD21 LEU 70 104.100 -3.555 -1.084 532 HD22 LEU 70 HD22 LEU 70 102.402 -3.934 -0.797 533 HD23 LEU 70 HD23 LEU 70 103.587 -4.171 0.486 534 H TRP 71 H TRP 71 105.978 -0.292 3.090 535 HA TRP 71 HA TRP 71 108.020 1.033 1.760 536 HB2 TRP 71 HB2 TRP 71 106.801 1.665 3.892 537 HB3 TRP 71 HB3 TRP 71 107.916 0.607 4.733 538 HD1 TRP 71 HD1 TRP 71 109.942 1.772 5.672 539 HE1 TRP 71 HE1 TRP 71 111.210 3.957 5.181 540 HE3 TRP 71 HE3 TRP 71 107.379 3.388 1.564 541 HZ2 TRP 71 HZ2 TRP 71 111.174 6.102 3.280 542 HZ3 TRP 71 HZ3 TRP 71 108.017 5.496 0.432 543 HH2 TRP 71 HH2 TRP 71 109.907 6.853 1.283 544 HA PRO 72 HA PRO 72 110.925 -2.445 2.332 545 HB2 PRO 72 HB2 PRO 72 112.580 -2.015 0.278 546 HB3 PRO 72 HB3 PRO 72 110.903 -2.533 0.007 547 HG2 PRO 72 HG2 PRO 72 112.120 0.152 -0.303 548 HG3 PRO 72 HG3 PRO 72 110.853 -0.635 -1.260 549 HD2 PRO 72 HD2 PRO 72 110.444 1.245 0.799 550 HD3 PRO 72 HD3 PRO 72 109.204 0.210 0.062 551 H LEU 73 H LEU 73 111.686 0.899 2.632 552 HA LEU 73 HA LEU 73 114.536 0.443 3.122 553 HB2 LEU 73 HB2 LEU 73 112.944 3.012 3.244 554 HB3 LEU 73 HB3 LEU 73 114.700 2.863 3.278 555 HG LEU 73 HG LEU 73 112.931 1.969 0.984 556 HD11 LEU 73 HD11 LEU 73 113.833 3.932 -0.181 557 HD12 LEU 73 HD12 LEU 73 114.780 4.359 1.246 558 HD13 LEU 73 HD13 LEU 73 113.018 4.432 1.307 559 HD21 LEU 73 HD21 LEU 73 115.163 1.850 -0.197 560 HD22 LEU 73 HD22 LEU 73 114.968 0.651 1.080 561 HD23 LEU 73 HD23 LEU 73 115.942 2.094 1.367 562 H THR 74 H THR 74 115.559 0.706 5.034 563 HA THR 74 HA THR 74 114.142 0.386 7.476 564 HB THR 74 HB THR 74 116.337 0.628 8.537 565 HG1 THR 74 HG1 THR 74 117.895 1.563 7.497 566 HG21 THR 74 HG21 THR 74 115.802 -1.524 7.498 567 HG22 THR 74 HG22 THR 74 117.519 -1.171 7.300 568 HG23 THR 74 HG23 THR 74 116.410 -0.945 5.947 569 H VAL 75 H VAL 75 115.644 3.183 5.856 570 HA VAL 75 HA VAL 75 115.146 5.029 7.965 571 HB VAL 75 HB VAL 75 115.317 6.782 6.198 572 HG11 VAL 75 HG11 VAL 75 117.415 4.592 6.152 573 HG12 VAL 75 HG12 VAL 75 117.337 5.943 7.283 574 HG13 VAL 75 HG13 VAL 75 117.669 6.239 5.577 575 HG21 VAL 75 HG21 VAL 75 115.647 4.397 4.346 576 HG22 VAL 75 HG22 VAL 75 115.892 6.083 3.903 577 HG23 VAL 75 HG23 VAL 75 114.284 5.516 4.341 578 H ASP 76 H ASP 76 113.298 6.108 8.520 579 HA ASP 76 HA ASP 76 110.921 4.728 7.880 580 HB2 ASP 76 HB2 ASP 76 111.339 7.362 9.309 581 HB3 ASP 76 HB3 ASP 76 109.800 6.509 9.233 582 H HIS 77 H HIS 77 112.270 7.731 6.604 583 HA HIS 77 HA HIS 77 110.224 7.642 4.525 584 HB2 HIS 77 HB2 HIS 77 109.728 10.066 4.793 585 HB3 HIS 77 HB3 HIS 77 109.130 9.060 6.097 586 HD1 HIS 77 HD1 HIS 77 111.174 8.919 8.138 587 HD2 HIS 77 HD2 HIS 77 110.806 12.356 5.807 588 HE1 HIS 77 HE1 HIS 77 112.266 10.790 9.447 589 H GLY 78 H GLY 78 110.661 9.448 2.890 590 HA2 GLY 78 HA2 GLY 78 113.226 10.681 2.790 591 HA3 GLY 78 HA3 GLY 78 113.159 9.259 1.752 592 H THR 79 H THR 79 113.528 11.831 0.743 593 HA THR 79 HA THR 79 110.939 12.436 -0.564 594 HB THR 79 HB THR 79 113.387 14.198 -0.643 595 HG1 THR 79 HG1 THR 79 113.033 14.414 1.399 596 HG21 THR 79 HG21 THR 79 111.753 14.907 -2.189 597 HG22 THR 79 HG22 THR 79 111.391 15.877 -0.761 598 HG23 THR 79 HG23 THR 79 110.421 14.448 -1.127 599 H ILE 80 H ILE 80 110.782 12.337 -2.788 600 HA ILE 80 HA ILE 80 113.113 11.162 -4.186 601 HB ILE 80 HB ILE 80 111.460 10.258 -5.786 602 HG12 ILE 80 HG12 ILE 80 109.404 11.328 -3.822 603 HG13 ILE 80 HG13 ILE 80 109.716 12.014 -5.414 604 HG21 ILE 80 HG21 ILE 80 112.211 8.933 -3.849 605 HG22 ILE 80 HG22 ILE 80 110.536 8.561 -4.253 606 HG23 ILE 80 HG23 ILE 80 110.900 9.603 -2.877 607 HD11 ILE 80 HD11 ILE 80 108.414 9.420 -4.697 608 HD12 ILE 80 HD12 ILE 80 109.312 9.519 -6.211 609 HD13 ILE 80 HD13 ILE 80 107.952 10.606 -5.920 610 H GLU 81 H GLU 81 113.911 12.120 -5.991 611 HA GLU 81 HA GLU 81 112.524 14.511 -7.015 612 HB2 GLU 81 HB2 GLU 81 115.409 14.428 -6.103 613 HB3 GLU 81 HB3 GLU 81 114.645 15.779 -6.941 614 HG2 GLU 81 HG2 GLU 81 112.984 15.943 -5.102 615 HG3 GLU 81 HG3 GLU 81 113.822 14.653 -4.251 616 H CYS 82 H CYS 82 112.795 14.942 -9.103 617 HA CYS 82 HA CYS 82 114.628 13.232 -10.677 618 HB2 CYS 82 HB2 CYS 82 111.941 14.416 -11.223 619 HB3 CYS 82 HB3 CYS 82 113.061 14.260 -12.575 620 H LEU 83 H LEU 83 116.427 14.220 -11.341 621 HA LEU 83 HA LEU 83 116.664 17.107 -11.143 622 HB2 LEU 83 HB2 LEU 83 118.622 14.933 -11.903 623 HB3 LEU 83 HB3 LEU 83 119.038 16.647 -11.840 624 HG LEU 83 HG LEU 83 117.717 15.352 -9.473 625 HD11 LEU 83 HD11 LEU 83 120.095 14.998 -8.604 626 HD12 LEU 83 HD12 LEU 83 120.630 15.179 -10.274 627 HD13 LEU 83 HD13 LEU 83 119.548 13.857 -9.833 628 HD21 LEU 83 HD21 LEU 83 119.201 17.088 -8.338 629 HD22 LEU 83 HD22 LEU 83 117.925 17.740 -9.365 630 HD23 LEU 83 HD23 LEU 83 119.588 17.685 -9.951 631 HA PRO 84 HA PRO 84 115.973 18.204 -15.374 632 HB2 PRO 84 HB2 PRO 84 118.240 19.744 -15.952 633 HB3 PRO 84 HB3 PRO 84 116.743 20.332 -15.208 634 HG2 PRO 84 HG2 PRO 84 119.313 19.575 -13.937 635 HG3 PRO 84 HG3 PRO 84 118.175 20.870 -13.518 636 HD2 PRO 84 HD2 PRO 84 118.299 18.600 -12.068 637 HD3 PRO 84 HD3 PRO 84 116.756 19.441 -12.345 638 H SER 85 H SER 85 118.879 16.563 -14.463 639 HA SER 85 HA SER 85 119.813 16.047 -17.145 640 HB2 SER 85 HB2 SER 85 120.613 14.909 -14.466 641 HB3 SER 85 HB3 SER 85 121.401 14.505 -15.987 642 HG SER 85 HG SER 85 122.470 16.254 -15.549 643 H ASP 86 H ASP 86 117.133 14.880 -15.683 644 HA ASP 86 HA ASP 86 115.804 13.055 -15.923 645 HB2 ASP 86 HB2 ASP 86 117.706 12.295 -18.156 646 HB3 ASP 86 HB3 ASP 86 116.129 11.581 -17.851 647 H ASN 87 H ASN 87 117.826 13.039 -13.983 648 HA ASN 87 HA ASN 87 118.402 10.137 -13.785 649 HB2 ASN 87 HB2 ASN 87 119.768 12.486 -12.447 650 HB3 ASN 87 HB3 ASN 87 120.127 10.792 -12.121 651 HD21 ASN 87 HD21 ASN 87 122.041 12.712 -13.231 652 HD22 ASN 87 HD22 ASN 87 122.453 12.157 -14.782 653 H ALA 88 H ALA 88 117.299 9.058 -12.261 654 HA ALA 88 HA ALA 88 115.608 10.601 -10.421 655 HB1 ALA 88 HB1 ALA 88 115.542 7.815 -11.518 656 HB2 ALA 88 HB2 ALA 88 114.256 9.019 -11.445 657 HB3 ALA 88 HB3 ALA 88 114.738 8.154 -9.985 658 H VAL 89 H VAL 89 116.164 10.834 -8.349 659 HA VAL 89 HA VAL 89 117.917 8.798 -7.110 660 HB VAL 89 HB VAL 89 119.132 10.611 -5.941 661 HG11 VAL 89 HG11 VAL 89 119.124 10.454 -8.948 662 HG12 VAL 89 HG12 VAL 89 120.297 9.795 -7.808 663 HG13 VAL 89 HG13 VAL 89 120.240 11.531 -8.109 664 HG21 VAL 89 HG21 VAL 89 118.879 12.921 -6.694 665 HG22 VAL 89 HG22 VAL 89 117.316 12.317 -6.144 666 HG23 VAL 89 HG23 VAL 89 117.659 12.432 -7.869 667 H PHE 90 H PHE 90 117.822 8.708 -4.841 668 HA PHE 90 HA PHE 90 115.289 9.667 -3.656 669 HB2 PHE 90 HB2 PHE 90 115.398 7.246 -3.910 670 HB3 PHE 90 HB3 PHE 90 116.954 7.206 -3.114 671 HD1 PHE 90 HD1 PHE 90 113.348 8.014 -2.570 672 HD2 PHE 90 HD2 PHE 90 117.104 6.937 -0.788 673 HE1 PHE 90 HE1 PHE 90 112.210 7.645 -0.389 674 HE2 PHE 90 HE2 PHE 90 115.967 6.556 1.382 675 HZ PHE 90 HZ PHE 90 113.519 6.911 1.579 676 H VAL 91 H VAL 91 115.507 11.074 -1.999 677 HA VAL 91 HA VAL 91 118.149 11.347 -0.702 678 HB VAL 91 HB VAL 91 115.813 13.279 -0.798 679 HG11 VAL 91 HG11 VAL 91 118.612 14.057 -0.039 680 HG12 VAL 91 HG12 VAL 91 117.587 13.316 1.184 681 HG13 VAL 91 HG13 VAL 91 117.078 14.805 0.398 682 HG21 VAL 91 HG21 VAL 91 117.128 14.542 -2.391 683 HG22 VAL 91 HG22 VAL 91 116.981 12.887 -2.985 684 HG23 VAL 91 HG23 VAL 91 118.481 13.421 -2.226 685 H ALA 92 H ALA 92 118.352 10.792 1.397 686 HA ALA 92 HA ALA 92 115.893 10.032 2.854 687 HB1 ALA 92 HB1 ALA 92 117.459 8.252 2.867 688 HB2 ALA 92 HB2 ALA 92 117.612 9.000 4.458 689 HB3 ALA 92 HB3 ALA 92 118.809 9.336 3.207 690 HA PRO 93 HA PRO 93 115.893 13.443 5.661 691 HB2 PRO 93 HB2 PRO 93 116.179 11.528 7.933 692 HB3 PRO 93 HB3 PRO 93 114.977 12.806 7.677 693 HG2 PRO 93 HG2 PRO 93 114.421 10.205 7.329 694 HG3 PRO 93 HG3 PRO 93 113.650 11.492 6.388 695 HD2 PRO 93 HD2 PRO 93 115.659 9.505 5.517 696 HD3 PRO 93 HD3 PRO 93 114.492 10.436 4.557 697 H ASP 94 H ASP 94 118.377 11.003 5.975 698 HA ASP 94 HA ASP 94 120.032 12.346 7.841 699 HB2 ASP 94 HB2 ASP 94 121.811 10.816 6.982 700 HB3 ASP 94 HB3 ASP 94 120.336 10.004 7.487 701 H GLY 95 H GLY 95 119.369 13.150 4.590 702 HA2 GLY 95 HA2 GLY 95 120.182 15.065 3.481 703 HA3 GLY 95 HA3 GLY 95 121.550 15.098 4.587 704 H THR 96 H THR 96 121.055 11.978 3.359 705 HA THR 96 HA THR 96 123.348 12.266 1.545 706 HB THR 96 HB THR 96 122.043 9.781 2.688 707 HG1 THR 96 HG1 THR 96 123.896 9.852 4.011 708 HG21 THR 96 HG21 THR 96 124.493 8.973 2.059 709 HG22 THR 96 HG22 THR 96 124.386 10.294 0.897 710 HG23 THR 96 HG23 THR 96 123.204 8.985 0.855 711 H THR 97 H THR 97 123.169 11.776 -0.612 712 HA THR 97 HA THR 97 120.447 11.189 -1.604 713 HB THR 97 HB THR 97 122.849 12.229 -3.135 714 HG1 THR 97 HG1 THR 97 121.795 13.569 -1.463 715 HG21 THR 97 HG21 THR 97 121.099 11.020 -4.448 716 HG22 THR 97 HG22 THR 97 121.217 12.729 -4.869 717 HG23 THR 97 HG23 THR 97 119.903 12.164 -3.838 718 H TYR 98 H TYR 98 120.018 9.324 -2.518 719 HA TYR 98 HA TYR 98 122.220 7.476 -3.197 720 HB2 TYR 98 HB2 TYR 98 119.388 6.858 -2.347 721 HB3 TYR 98 HB3 TYR 98 120.612 5.671 -2.744 722 HD1 TYR 98 HD2 TYR 98 122.458 5.204 -1.179 723 HD2 TYR 98 HD1 TYR 98 119.386 8.054 -0.236 724 HE1 TYR 98 HE2 TYR 98 123.146 5.162 1.204 725 HE2 TYR 98 HE1 TYR 98 120.084 8.024 2.140 726 HH TYR 98 HH TYR 98 121.654 7.263 3.581 727 H ALA 99 H ALA 99 121.986 6.283 -5.152 728 HA ALA 99 HA ALA 99 120.379 7.641 -7.165 729 HB1 ALA 99 HB1 ALA 99 121.582 5.930 -8.681 730 HB2 ALA 99 HB2 ALA 99 122.545 5.545 -7.255 731 HB3 ALA 99 HB3 ALA 99 122.566 7.178 -7.917 732 H LEU 100 H LEU 100 118.470 6.936 -7.905 733 HA LEU 100 HA LEU 100 117.414 4.396 -6.943 734 HB2 LEU 100 HB2 LEU 100 116.235 6.703 -8.490 735 HB3 LEU 100 HB3 LEU 100 115.375 5.180 -8.293 736 HG LEU 100 HG LEU 100 116.509 6.608 -5.898 737 HD11 LEU 100 HD11 LEU 100 113.805 7.054 -7.202 738 HD12 LEU 100 HD12 LEU 100 115.105 8.241 -7.107 739 HD13 LEU 100 HD13 LEU 100 114.296 7.700 -5.636 740 HD21 LEU 100 HD21 LEU 100 115.666 4.230 -5.793 741 HD22 LEU 100 HD22 LEU 100 114.078 4.830 -6.274 742 HD23 LEU 100 HD23 LEU 100 114.789 5.342 -4.745 743 H ASN 101 H ASN 101 118.016 6.007 -10.059 744 HA ASN 101 HA ASN 101 117.706 3.385 -11.401 745 HB2 ASN 101 HB2 ASN 101 117.239 4.565 -13.423 746 HB3 ASN 101 HB3 ASN 101 116.243 5.252 -12.148 747 HD21 ASN 101 HD21 ASN 101 116.433 6.960 -14.159 748 HD22 ASN 101 HD22 ASN 101 117.594 8.171 -13.899 749 H ASP 102 H ASP 102 119.067 3.158 -13.437 750 HA ASP 102 HA ASP 102 121.658 2.690 -12.518 751 HB2 ASP 102 HB2 ASP 102 122.189 2.057 -14.808 752 HB3 ASP 102 HB3 ASP 102 120.599 1.447 -14.360 753 H ARG 103 H ARG 103 120.402 5.424 -14.394 754 HA ARG 103 HA ARG 103 122.933 6.423 -15.181 755 HB2 ARG 103 HB2 ARG 103 120.231 7.749 -14.943 756 HB3 ARG 103 HB3 ARG 103 121.656 8.547 -15.620 757 HG2 ARG 103 HG2 ARG 103 121.895 6.672 -17.245 758 HG3 ARG 103 HG3 ARG 103 120.404 5.972 -16.617 759 HD2 ARG 103 HD2 ARG 103 120.670 8.702 -17.905 760 HD3 ARG 103 HD3 ARG 103 119.964 7.275 -18.655 761 HE ARG 103 HE ARG 103 118.678 9.029 -16.803 762 HH11 ARG 103 HH11 ARG 103 118.816 5.647 -17.735 763 HH12 ARG 103 HH12 ARG 103 117.203 5.334 -17.188 764 HH21 ARG 103 HH21 ARG 103 116.639 8.577 -16.129 765 HH22 ARG 103 HH22 ARG 103 115.974 6.982 -16.283 766 H ALA 104 H ALA 104 120.842 7.226 -12.405 767 HA ALA 104 HA ALA 104 122.491 9.195 -11.275 768 HB1 ALA 104 HB1 ALA 104 120.591 7.212 -10.020 769 HB2 ALA 104 HB2 ALA 104 120.288 8.907 -10.401 770 HB3 ALA 104 HB3 ALA 104 121.401 8.480 -9.100 771 H GLU 105 H GLU 105 122.617 5.660 -11.051 772 HA GLU 105 HA GLU 105 124.523 5.519 -8.964 773 HB2 GLU 105 HB2 GLU 105 123.076 3.627 -9.773 774 HB3 GLU 105 HB3 GLU 105 124.130 3.503 -11.183 775 HG2 GLU 105 HG2 GLU 105 126.076 3.198 -9.659 776 HG3 GLU 105 HG3 GLU 105 124.977 3.224 -8.289 777 H LYS 106 H LYS 106 124.937 5.247 -12.504 778 HA LYS 106 HA LYS 106 127.764 5.113 -12.384 779 HB2 LYS 106 HB2 LYS 106 127.764 5.413 -14.768 780 HB3 LYS 106 HB3 LYS 106 126.435 4.347 -14.328 781 HG2 LYS 106 HG2 LYS 106 124.887 6.289 -14.429 782 HG3 LYS 106 HG3 LYS 106 126.224 7.302 -14.979 783 HD2 LYS 106 HD2 LYS 106 126.541 5.609 -16.866 784 HD3 LYS 106 HD3 LYS 106 124.983 4.932 -16.390 785 HE2 LYS 106 HE2 LYS 106 124.337 6.473 -18.019 786 HE3 LYS 106 HE3 LYS 106 124.170 7.429 -16.547 787 HZ1 LYS 106 HZ1 LYS 106 126.208 7.582 -18.643 788 HZ2 LYS 106 HZ2 LYS 106 126.669 7.957 -17.051 789 HZ3 LYS 106 HZ3 LYS 106 125.422 8.830 -17.805 790 H ALA 107 H ALA 107 125.630 7.833 -12.167 791 HA ALA 107 HA ALA 107 127.618 9.826 -12.745 792 HB1 ALA 107 HB1 ALA 107 125.368 10.483 -13.071 793 HB2 ALA 107 HB2 ALA 107 125.907 11.346 -11.629 794 HB3 ALA 107 HB3 ALA 107 124.889 9.914 -11.472 795 H GLY 108 H GLY 108 127.801 7.690 -10.369 796 HA2 GLY 108 HA2 GLY 108 129.119 7.647 -8.514 797 HA3 GLY 108 HA3 GLY 108 129.478 9.343 -8.759 798 H HIS 109 H HIS 109 126.114 8.428 -8.469 799 HA HIS 109 HA HIS 109 126.045 9.395 -5.707 800 HB2 HIS 109 HB2 HIS 109 123.943 8.755 -7.756 801 HB3 HIS 109 HB3 HIS 109 123.533 9.005 -6.070 802 HD1 HIS 109 HD1 HIS 109 124.938 11.430 -5.217 803 HD2 HIS 109 HD2 HIS 109 123.490 11.085 -9.111 804 HE1 HIS 109 HE1 HIS 109 124.710 13.789 -6.106 805 HA PRO 110 HA PRO 110 126.559 4.962 -4.730 806 HB2 PRO 110 HB2 PRO 110 125.616 5.758 -2.016 807 HB3 PRO 110 HB3 PRO 110 127.065 4.845 -2.486 808 HG2 PRO 110 HG2 PRO 110 127.222 7.374 -1.689 809 HG3 PRO 110 HG3 PRO 110 128.266 6.738 -2.973 810 HD2 PRO 110 HD2 PRO 110 125.882 8.526 -3.206 811 HD3 PRO 110 HD3 PRO 110 127.366 8.487 -4.184 812 HA PRO 111 HA PRO 111 122.326 3.717 -5.039 813 HB2 PRO 111 HB2 PRO 111 122.455 1.052 -4.504 814 HB3 PRO 111 HB3 PRO 111 123.078 1.770 -6.001 815 HG2 PRO 111 HG2 PRO 111 124.538 0.803 -3.625 816 HG3 PRO 111 HG3 PRO 111 125.021 0.813 -5.327 817 HD2 PRO 111 HD2 PRO 111 125.883 2.641 -3.395 818 HD3 PRO 111 HD3 PRO 111 125.999 2.864 -5.152 819 H ILE 112 H ILE 112 120.442 2.982 -3.882 820 HA ILE 112 HA ILE 112 120.344 3.737 -1.174 821 HB ILE 112 HB ILE 112 118.374 2.096 -2.790 822 HG12 ILE 112 HG12 ILE 112 118.397 5.037 -2.071 823 HG13 ILE 112 HG13 ILE 112 118.967 4.408 -3.615 824 HG21 ILE 112 HG21 ILE 112 118.094 3.519 -0.122 825 HG22 ILE 112 HG22 ILE 112 117.883 1.796 -0.423 826 HG23 ILE 112 HG23 ILE 112 116.723 2.946 -1.068 827 HD11 ILE 112 HD11 ILE 112 116.745 3.510 -4.102 828 HD12 ILE 112 HD12 ILE 112 116.611 5.225 -3.712 829 HD13 ILE 112 HD13 ILE 112 116.165 4.014 -2.512 830 H THR 113 H THR 113 121.645 0.854 -2.414 831 HA THR 113 HA THR 113 120.574 -1.177 -1.012 832 HB THR 113 HB THR 113 122.427 -1.280 -2.710 833 HG1 THR 113 HG1 THR 113 122.332 -3.243 -2.114 834 HG21 THR 113 HG21 THR 113 124.212 -0.028 -1.730 835 HG22 THR 113 HG22 THR 113 124.697 -1.717 -1.668 836 HG23 THR 113 HG23 THR 113 124.107 -0.922 -0.214 837 HA PRO 114 HA PRO 114 123.411 -0.633 2.815 838 HB2 PRO 114 HB2 PRO 114 123.334 2.273 3.360 839 HB3 PRO 114 HB3 PRO 114 124.707 1.152 3.408 840 HG2 PRO 114 HG2 PRO 114 124.466 2.973 1.484 841 HG3 PRO 114 HG3 PRO 114 125.133 1.359 1.163 842 HD2 PRO 114 HD2 PRO 114 122.365 2.390 0.597 843 HD3 PRO 114 HD3 PRO 114 123.417 1.406 -0.435 844 H ILE 115 H ILE 115 120.676 1.493 2.195 845 HA ILE 115 HA ILE 115 119.673 1.055 4.921 846 HB ILE 115 HB ILE 115 117.901 2.727 4.250 847 HG12 ILE 115 HG12 ILE 115 119.830 3.344 1.999 848 HG13 ILE 115 HG13 ILE 115 118.321 2.465 1.766 849 HG21 ILE 115 HG21 ILE 115 120.600 3.993 4.026 850 HG22 ILE 115 HG22 ILE 115 120.212 3.075 5.483 851 HG23 ILE 115 HG23 ILE 115 119.215 4.453 5.017 852 HD11 ILE 115 HD11 ILE 115 117.027 4.336 2.063 853 HD12 ILE 115 HD12 ILE 115 118.494 5.146 1.513 854 HD13 ILE 115 HD13 ILE 115 118.130 5.056 3.235 855 H ARG 116 H ARG 116 119.416 -0.692 2.163 856 HA ARG 116 HA ARG 116 116.563 -1.051 2.060 857 HB2 ARG 116 HB2 ARG 116 118.835 -2.704 0.938 858 HB3 ARG 116 HB3 ARG 116 117.127 -3.037 0.644 859 HG2 ARG 116 HG2 ARG 116 116.865 -0.759 -0.308 860 HG3 ARG 116 HG3 ARG 116 118.591 -0.479 -0.072 861 HD2 ARG 116 HD2 ARG 116 118.303 -1.165 -2.356 862 HD3 ARG 116 HD3 ARG 116 119.027 -2.518 -1.495 863 HE ARG 116 HE ARG 116 116.195 -2.742 -1.466 864 HH11 ARG 116 HH11 ARG 116 118.927 -3.134 -3.639 865 HH12 ARG 116 HH12 ARG 116 118.097 -4.280 -4.636 866 HH21 ARG 116 HH21 ARG 116 115.178 -4.224 -2.795 867 HH22 ARG 116 HH22 ARG 116 116.004 -4.888 -4.164 868 H ALA 117 H ALA 117 115.322 -2.677 2.957 869 HA ALA 117 HA ALA 117 116.436 -3.949 5.320 870 HB1 ALA 117 HB1 ALA 117 113.631 -4.098 4.198 871 HB2 ALA 117 HB2 ALA 117 114.190 -2.848 5.311 872 HB3 ALA 117 HB3 ALA 117 114.142 -4.533 5.830 873 H LYS 118 H LYS 118 116.844 -6.084 5.582 874 HA LYS 118 HA LYS 118 116.576 -7.835 3.249 875 HB2 LYS 118 HB2 LYS 118 118.708 -7.760 4.566 876 HB3 LYS 118 HB3 LYS 118 117.829 -8.425 5.943 877 HG2 LYS 118 HG2 LYS 118 117.187 -10.386 4.552 878 HG3 LYS 118 HG3 LYS 118 118.157 -9.737 3.229 879 HD2 LYS 118 HD2 LYS 118 120.151 -9.767 4.749 880 HD3 LYS 118 HD3 LYS 118 119.160 -10.581 5.961 881 HE2 LYS 118 HE2 LYS 118 118.767 -12.451 4.448 882 HE3 LYS 118 HE3 LYS 118 119.641 -11.626 3.157 883 HZ1 LYS 118 HZ1 LYS 118 120.839 -13.370 4.641 884 HZ2 LYS 118 HZ2 LYS 118 120.978 -12.074 5.732 885 HZ3 LYS 118 HZ3 LYS 118 121.648 -11.953 4.176 886 H GLY 119 H GLY 119 115.246 -9.616 3.184 887 HA2 GLY 119 HA2 GLY 119 113.192 -9.738 5.298 888 HA3 GLY 119 HA3 GLY 119 112.990 -10.297 3.652 889 H SER 120 H SER 120 112.255 -11.973 5.658 890 HA SER 120 HA SER 120 114.188 -13.758 6.626 891 HB2 SER 120 HB2 SER 120 111.788 -13.695 7.331 892 HB3 SER 120 HB3 SER 120 111.359 -14.437 5.794 893 HG SER 120 HG SER 120 112.383 -16.225 6.435 894 H GLY 121 H GLY 121 112.449 -13.686 3.540 895 HA2 GLY 121 HA2 GLY 121 114.488 -15.494 2.429 896 HA3 GLY 121 HA3 GLY 121 112.786 -15.891 2.197 897 H GLY 122 H GLY 122 114.411 -15.496 0.011 898 HA2 GLY 122 HA2 GLY 122 114.216 -14.453 -2.046 899 HA3 GLY 122 HA3 GLY 122 113.015 -13.377 -1.345 900 H GLY 123 H GLY 123 116.199 -13.721 0.093 901 HA2 GLY 123 HA2 GLY 123 117.981 -12.279 0.271 902 HA3 GLY 123 HA3 GLY 123 117.551 -11.700 -1.335 903 H TYR 124 H TYR 124 117.173 -9.595 -1.407 904 HA TYR 124 HA TYR 124 116.274 -8.217 1.045 905 HB2 TYR 124 HB2 TYR 124 117.915 -7.372 -1.317 906 HB3 TYR 124 HB3 TYR 124 117.103 -6.178 -0.322 907 HD1 TYR 124 HD1 TYR 124 118.889 -9.368 0.513 908 HD2 TYR 124 HD2 TYR 124 118.688 -5.106 1.007 909 HE1 TYR 124 HE1 TYR 124 120.776 -9.466 2.120 910 HE2 TYR 124 HE2 TYR 124 120.571 -5.204 2.619 911 HH TYR 124 HH TYR 124 122.492 -6.850 3.072 912 H ILE 125 H ILE 125 114.758 -6.490 0.859 913 HA ILE 125 HA ILE 125 112.537 -7.210 -0.810 914 HB ILE 125 HB ILE 125 112.965 -4.906 1.112 915 HG12 ILE 125 HG12 ILE 125 111.218 -7.314 1.562 916 HG13 ILE 125 HG13 ILE 125 112.947 -7.434 1.858 917 HG21 ILE 125 HG21 ILE 125 111.157 -4.518 -0.621 918 HG22 ILE 125 HG22 ILE 125 110.583 -4.551 1.044 919 HG23 ILE 125 HG23 ILE 125 110.347 -5.955 0.002 920 HD11 ILE 125 HD11 ILE 125 111.271 -6.666 3.773 921 HD12 ILE 125 HD12 ILE 125 111.502 -5.088 3.019 922 HD13 ILE 125 HD13 ILE 125 112.890 -5.982 3.643 923 H SER 126 H SER 126 111.919 -6.360 -2.689 924 HA SER 126 HA SER 126 113.754 -4.892 -4.261 925 HB2 SER 126 HB2 SER 126 110.813 -5.410 -4.727 926 HB3 SER 126 HB3 SER 126 111.967 -4.860 -5.937 927 HG SER 126 HG SER 126 112.094 -6.975 -6.128 928 H LEU 127 H LEU 127 113.951 -2.821 -4.782 929 HA LEU 127 HA LEU 127 112.204 -0.837 -3.522 930 HB2 LEU 127 HB2 LEU 127 114.642 -0.420 -5.263 931 HB3 LEU 127 HB3 LEU 127 113.815 0.805 -4.305 932 HG LEU 127 HG LEU 127 115.181 -1.659 -3.179 933 HD11 LEU 127 HD11 LEU 127 116.928 -0.242 -3.868 934 HD12 LEU 127 HD12 LEU 127 116.667 0.239 -2.191 935 HD13 LEU 127 HD13 LEU 127 116.011 1.219 -3.501 936 HD21 LEU 127 HD21 LEU 127 113.624 0.625 -1.980 937 HD22 LEU 127 HD22 LEU 127 114.884 -0.176 -1.044 938 HD23 LEU 127 HD23 LEU 127 113.501 -1.099 -1.631 939 H GLY 128 H GLY 128 111.694 -2.638 -6.135 940 HA2 GLY 128 HA2 GLY 128 111.643 -1.121 -8.416 941 HA3 GLY 128 HA3 GLY 128 110.456 -2.368 -8.063 942 H ALA 129 H ALA 129 109.108 -1.155 -5.897 943 HA ALA 129 HA ALA 129 107.228 0.400 -7.299 944 HB1 ALA 129 HB1 ALA 129 107.718 0.097 -4.330 945 HB2 ALA 129 HB2 ALA 129 106.557 -0.794 -5.315 946 HB3 ALA 129 HB3 ALA 129 106.322 0.928 -5.015 947 H LEU 130 H LEU 130 109.752 1.376 -4.986 948 HA LEU 130 HA LEU 130 109.162 4.122 -4.952 949 HB2 LEU 130 HB2 LEU 130 110.674 2.961 -3.354 950 HB3 LEU 130 HB3 LEU 130 111.870 2.805 -4.639 951 HG LEU 130 HG LEU 130 111.812 5.311 -4.894 952 HD11 LEU 130 HD11 LEU 130 110.054 5.001 -2.451 953 HD12 LEU 130 HD12 LEU 130 109.699 5.882 -3.938 954 HD13 LEU 130 HD13 LEU 130 110.907 6.502 -2.812 955 HD21 LEU 130 HD21 LEU 130 113.396 3.868 -3.367 956 HD22 LEU 130 HD22 LEU 130 112.509 4.632 -2.048 957 HD23 LEU 130 HD23 LEU 130 113.397 5.622 -3.204 958 H LEU 131 H LEU 131 111.266 2.216 -7.073 959 HA LEU 131 HA LEU 131 112.447 4.357 -8.465 960 HB2 LEU 131 HB2 LEU 131 113.241 2.008 -8.569 961 HB3 LEU 131 HB3 LEU 131 111.804 1.581 -9.494 962 HG LEU 131 HG LEU 131 112.505 3.337 -11.191 963 HD11 LEU 131 HD11 LEU 131 114.972 3.273 -9.438 964 HD12 LEU 131 HD12 LEU 131 114.014 4.679 -9.898 965 HD13 LEU 131 HD13 LEU 131 114.998 3.851 -11.104 966 HD21 LEU 131 HD21 LEU 131 114.354 0.996 -10.641 967 HD22 LEU 131 HD22 LEU 131 114.280 1.876 -12.168 968 HD23 LEU 131 HD23 LEU 131 112.880 0.960 -11.608 969 H SER 132 H SER 132 109.476 2.516 -9.110 970 HA SER 132 HA SER 132 108.897 3.646 -11.612 971 HB2 SER 132 HB2 SER 132 106.651 2.814 -11.299 972 HB3 SER 132 HB3 SER 132 107.773 1.640 -10.621 973 HG SER 132 HG SER 132 106.861 2.018 -8.786 974 H THR 133 H THR 133 108.061 4.715 -8.335 975 HA THR 133 HA THR 133 106.294 6.782 -9.080 976 HB THR 133 HB THR 133 108.116 6.719 -6.663 977 HG1 THR 133 HG1 THR 133 106.725 5.362 -5.868 978 HG21 THR 133 HG21 THR 133 105.432 8.045 -7.145 979 HG22 THR 133 HG22 THR 133 106.986 8.880 -7.104 980 HG23 THR 133 HG23 THR 133 106.363 8.103 -5.647 981 H THR 134 H THR 134 109.798 6.853 -8.421 982 HA THR 134 HA THR 134 110.087 9.639 -8.806 983 HB THR 134 HB THR 134 112.221 7.559 -9.311 984 HG1 THR 134 HG1 THR 134 111.296 7.291 -7.294 985 HG21 THR 134 HG21 THR 134 112.321 10.447 -8.378 986 HG22 THR 134 HG22 THR 134 112.749 9.879 -9.992 987 HG23 THR 134 HG23 THR 134 113.714 9.387 -8.601 988 H LEU 135 H LEU 135 110.329 6.918 -11.072 989 HA LEU 135 HA LEU 135 111.280 8.356 -13.291 990 HB2 LEU 135 HB2 LEU 135 109.522 5.897 -13.155 991 HB3 LEU 135 HB3 LEU 135 110.256 6.509 -14.637 992 HG LEU 135 HG LEU 135 111.855 5.811 -12.162 993 HD11 LEU 135 HD11 LEU 135 111.438 4.160 -14.672 994 HD12 LEU 135 HD12 LEU 135 110.676 3.821 -13.118 995 HD13 LEU 135 HD13 LEU 135 112.429 3.721 -13.281 996 HD21 LEU 135 HD21 LEU 135 112.480 6.602 -15.002 997 HD22 LEU 135 HD22 LEU 135 113.636 5.657 -14.063 998 HD23 LEU 135 HD23 LEU 135 113.142 7.254 -13.503 999 H ASN 136 H ASN 136 107.976 7.806 -12.118 1000 HA ASN 136 HA ASN 136 106.583 8.931 -14.273 1001 HB2 ASN 136 HB2 ASN 136 105.602 7.694 -12.290 1002 HB3 ASN 136 HB3 ASN 136 105.787 9.186 -11.369 1003 HD21 ASN 136 HD21 ASN 136 103.936 10.455 -11.378 1004 HD22 ASN 136 HD22 ASN 136 102.788 10.496 -12.628 1005 H LEU 137 H LEU 137 107.928 10.438 -11.358 1006 HA LEU 137 HA LEU 137 107.107 13.081 -11.891 1007 HB2 LEU 137 HB2 LEU 137 109.616 12.168 -10.463 1008 HB3 LEU 137 HB3 LEU 137 108.867 13.759 -10.336 1009 HG LEU 137 HG LEU 137 107.534 11.149 -9.556 1010 HD11 LEU 137 HD11 LEU 137 109.125 11.482 -7.877 1011 HD12 LEU 137 HD12 LEU 137 107.744 12.370 -7.237 1012 HD13 LEU 137 HD13 LEU 137 109.061 13.237 -8.025 1013 HD21 LEU 137 HD21 LEU 137 106.699 14.057 -9.339 1014 HD22 LEU 137 HD22 LEU 137 105.902 12.750 -8.464 1015 HD23 LEU 137 HD23 LEU 137 105.874 12.774 -10.224 1016 H CYS 138 H CYS 138 110.012 11.310 -12.867 1017 HA CYS 138 HA CYS 138 111.382 13.398 -14.130 1018 HB2 CYS 138 HB2 CYS 138 111.365 10.423 -14.418 1019 HB3 CYS 138 HB3 CYS 138 112.220 11.382 -15.622 1020 H GLY 139 H GLY 139 108.552 11.632 -15.193 1021 HA2 GLY 139 HA2 GLY 139 107.116 12.387 -16.911 1022 HA3 GLY 139 HA3 GLY 139 108.446 13.310 -17.591 1023 H LYS 140 H LYS 140 109.017 9.978 -16.727 1024 HA LYS 140 HA LYS 140 109.443 9.335 -19.542 1025 HB2 LYS 140 HB2 LYS 140 109.908 7.635 -17.079 1026 HB3 LYS 140 HB3 LYS 140 110.473 7.286 -18.711 1027 HG2 LYS 140 HG2 LYS 140 111.260 9.728 -17.093 1028 HG3 LYS 140 HG3 LYS 140 112.255 8.285 -17.287 1029 HD2 LYS 140 HD2 LYS 140 112.159 8.644 -19.779 1030 HD3 LYS 140 HD3 LYS 140 111.358 10.185 -19.470 1031 HE2 LYS 140 HE2 LYS 140 113.629 10.781 -19.652 1032 HE3 LYS 140 HE3 LYS 140 113.368 10.682 -17.911 1033 HZ1 LYS 140 HZ1 LYS 140 114.134 8.206 -19.213 1034 HZ2 LYS 140 HZ2 LYS 140 114.643 8.860 -17.730 1035 HZ3 LYS 140 HZ3 LYS 140 115.329 9.411 -19.184 1036 H GLY 141 H GLY 141 108.381 7.706 -20.657 1037 HA2 GLY 141 HA2 GLY 141 105.737 7.007 -19.580 1038 HA3 GLY 141 HA3 GLY 141 106.216 6.932 -21.274 Start of MODEL 18 1 H1 HIS -5 HT1 HIS -5 43.389 1.637 14.198 2 H2 HIS -5 HT2 HIS -5 41.748 1.284 14.462 3 H3 HIS -5 HT3 HIS -5 42.237 2.883 14.159 4 HA HIS -5 HA HIS -5 42.426 0.627 12.237 5 HB2 HIS -5 HB2 HIS -5 40.580 3.022 12.376 6 HB3 HIS -5 HB3 HIS -5 40.685 1.920 11.016 7 HD1 HIS -5 HD1 HIS -5 39.338 2.241 14.484 8 HD2 HIS -5 HD2 HIS -5 39.478 -0.640 11.473 9 HE1 HIS -5 HE1 HIS -5 37.708 0.423 15.156 10 H HIS -4 H HIS -4 43.196 1.265 10.164 11 HA HIS -4 HA HIS -4 44.796 3.763 10.174 12 HB2 HIS -4 HB2 HIS -4 45.390 1.103 8.873 13 HB3 HIS -4 HB3 HIS -4 46.332 2.563 8.634 14 HD1 HIS -4 HD1 HIS -4 45.652 -0.170 11.091 15 HD2 HIS -4 HD2 HIS -4 47.975 3.285 10.869 16 HE1 HIS -4 HE1 HIS -4 47.276 -0.274 13.030 17 H HIS -3 H HIS -3 44.669 5.081 8.425 18 HA HIS -3 HA HIS -3 42.856 4.262 6.226 19 HB2 HIS -3 HB2 HIS -3 43.226 6.983 7.483 20 HB3 HIS -3 HB3 HIS -3 42.276 6.671 6.043 21 HD1 HIS -3 HD1 HIS -3 42.246 6.299 9.761 22 HD2 HIS -3 HD2 HIS -3 39.771 5.373 6.536 23 HE1 HIS -3 HE1 HIS -3 39.995 5.683 10.740 24 H HIS -2 H HIS -2 43.482 4.710 4.156 25 HA HIS -2 HA HIS -2 46.208 5.824 3.807 26 HB2 HIS -2 HB2 HIS -2 44.722 3.815 2.109 27 HB3 HIS -2 HB3 HIS -2 46.316 4.456 1.764 28 HD1 HIS -2 HD1 HIS -2 48.136 3.941 3.798 29 HD2 HIS -2 HD2 HIS -2 44.776 1.485 3.562 30 HE1 HIS -2 HE1 HIS -2 48.686 1.851 5.114 31 H HIS -1 H HIS -1 46.505 7.457 2.383 32 HA HIS -1 HA HIS -1 44.182 8.345 0.773 33 HB2 HIS -1 HB2 HIS -1 44.450 9.768 2.765 34 HB3 HIS -1 HB3 HIS -1 46.112 10.087 2.311 35 HD1 HIS -1 HD1 HIS -1 46.528 11.815 0.459 36 HD2 HIS -1 HD2 HIS -1 42.481 11.087 1.144 37 HE1 HIS -1 HE1 HIS -1 45.256 13.604 -0.801 38 H HIS 0 H HIS 0 44.612 8.913 -1.288 39 HA HIS 0 HA HIS 0 47.449 8.946 -2.151 40 HB2 HIS 0 HB2 HIS 0 45.011 7.928 -3.614 41 HB3 HIS 0 HB3 HIS 0 46.604 8.090 -4.327 42 HD1 HIS 0 HD1 HIS 0 44.592 5.974 -1.997 43 HD2 HIS 0 HD2 HIS 0 48.494 6.118 -3.457 44 HE1 HIS 0 HE1 HIS 0 45.671 3.771 -1.374 45 H SER 1 H SER 1 48.092 10.543 -3.531 46 HA SER 1 HA SER 1 46.089 12.629 -4.189 47 HB2 SER 1 HB2 SER 1 49.024 12.985 -3.537 48 HB3 SER 1 HB3 SER 1 47.898 14.268 -3.966 49 HG SER 1 HG SER 1 48.326 13.469 -1.627 50 H SER 2 H SER 2 46.282 13.670 -6.186 51 HA SER 2 HA SER 2 47.265 12.043 -8.320 52 HB2 SER 2 HB2 SER 2 45.278 13.527 -8.525 53 HB3 SER 2 HB3 SER 2 46.340 14.925 -8.393 54 HG SER 2 HG SER 2 45.976 13.193 -10.460 55 H GLY 3 H GLY 3 48.942 12.487 -9.787 56 HA2 GLY 3 HA2 GLY 3 51.339 13.449 -8.633 57 HA3 GLY 3 HA3 GLY 3 51.108 13.047 -10.331 58 H LEU 4 H LEU 4 52.438 15.349 -8.850 59 HA LEU 4 HA LEU 4 50.940 17.611 -10.000 60 HB2 LEU 4 HB2 LEU 4 51.657 17.734 -7.609 61 HB3 LEU 4 HB3 LEU 4 53.335 17.659 -8.149 62 HG LEU 4 HG LEU 4 52.831 19.680 -9.611 63 HD11 LEU 4 HD11 LEU 4 50.455 19.671 -9.720 64 HD12 LEU 4 HD12 LEU 4 50.856 21.039 -8.682 65 HD13 LEU 4 HD13 LEU 4 50.299 19.526 -7.969 66 HD21 LEU 4 HD21 LEU 4 52.860 21.257 -7.613 67 HD22 LEU 4 HD22 LEU 4 54.096 20.000 -7.591 68 HD23 LEU 4 HD23 LEU 4 52.653 19.835 -6.591 69 H VAL 5 H VAL 5 51.717 18.766 -11.691 70 HA VAL 5 HA VAL 5 53.610 17.647 -13.405 71 HB VAL 5 HB VAL 5 51.871 19.201 -14.148 72 HG11 VAL 5 HG11 VAL 5 51.999 20.696 -12.147 73 HG12 VAL 5 HG12 VAL 5 52.000 21.578 -13.674 74 HG13 VAL 5 HG13 VAL 5 53.506 21.356 -12.783 75 HG21 VAL 5 HG21 VAL 5 53.781 18.986 -15.620 76 HG22 VAL 5 HG22 VAL 5 54.710 20.134 -14.656 77 HG23 VAL 5 HG23 VAL 5 53.315 20.686 -15.582 78 HA PRO 6 HA PRO 6 57.269 19.324 -11.410 79 HB2 PRO 6 HB2 PRO 6 59.184 18.400 -13.052 80 HB3 PRO 6 HB3 PRO 6 58.194 17.292 -12.080 81 HG2 PRO 6 HG2 PRO 6 58.079 17.876 -14.971 82 HG3 PRO 6 HG3 PRO 6 57.689 16.386 -14.098 83 HD2 PRO 6 HD2 PRO 6 55.846 18.338 -15.028 84 HD3 PRO 6 HD3 PRO 6 55.494 16.945 -13.985 85 H ARG 7 H ARG 7 57.488 21.519 -11.475 86 HA ARG 7 HA ARG 7 58.657 22.698 -13.923 87 HB2 ARG 7 HB2 ARG 7 56.240 23.306 -13.706 88 HB3 ARG 7 HB3 ARG 7 56.610 24.054 -12.152 89 HG2 ARG 7 HG2 ARG 7 58.250 25.540 -13.275 90 HG3 ARG 7 HG3 ARG 7 57.812 24.825 -14.827 91 HD2 ARG 7 HD2 ARG 7 55.448 25.538 -14.436 92 HD3 ARG 7 HD3 ARG 7 55.973 26.354 -12.967 93 HE ARG 7 HE ARG 7 56.427 27.220 -15.702 94 HH11 ARG 7 HH11 ARG 7 57.425 27.588 -12.356 95 HH12 ARG 7 HH12 ARG 7 58.124 29.149 -12.633 96 HH21 ARG 7 HH21 ARG 7 57.343 29.231 -15.996 97 HH22 ARG 7 HH22 ARG 7 58.078 30.066 -14.668 98 H GLY 8 H GLY 8 60.436 23.891 -13.574 99 HA2 GLY 8 HA2 GLY 8 61.098 25.619 -11.598 100 HA3 GLY 8 HA3 GLY 8 61.499 24.059 -10.885 101 H SER 9 H SER 9 63.656 25.307 -10.955 102 HA SER 9 HA SER 9 65.048 24.680 -13.498 103 HB2 SER 9 HB2 SER 9 65.710 26.845 -11.485 104 HB3 SER 9 HB3 SER 9 66.612 26.489 -12.954 105 HG SER 9 HG SER 9 65.217 27.817 -13.778 106 H GLY 10 H GLY 10 67.077 23.711 -13.359 107 HA2 GLY 10 HA2 GLY 10 67.499 22.133 -10.954 108 HA3 GLY 10 HA3 GLY 10 68.377 21.982 -12.474 109 H MET 11 H MET 11 70.045 21.798 -10.556 110 HA MET 11 HA MET 11 71.269 24.476 -10.225 111 HB2 MET 11 HB2 MET 11 71.175 22.212 -8.218 112 HB3 MET 11 HB3 MET 11 72.146 23.674 -8.038 113 HG2 MET 11 HG2 MET 11 70.068 25.037 -8.208 114 HG3 MET 11 HG3 MET 11 69.126 23.548 -8.276 115 HE1 MET 11 HE1 MET 11 68.154 24.556 -4.787 116 HE2 MET 11 HE2 MET 11 67.726 24.335 -6.481 117 HE3 MET 11 HE3 MET 11 68.579 25.792 -5.977 118 H LYS 12 H LYS 12 73.580 24.491 -10.127 119 HA LYS 12 HA LYS 12 74.780 22.523 -11.875 120 HB2 LYS 12 HB2 LYS 12 75.328 24.955 -11.994 121 HB3 LYS 12 HB3 LYS 12 76.089 24.824 -10.408 122 HG2 LYS 12 HG2 LYS 12 77.678 23.181 -11.262 123 HG3 LYS 12 HG3 LYS 12 76.884 23.193 -12.837 124 HD2 LYS 12 HD2 LYS 12 78.825 24.625 -12.983 125 HD3 LYS 12 HD3 LYS 12 77.394 25.656 -12.990 126 HE2 LYS 12 HE2 LYS 12 77.684 26.216 -10.671 127 HE3 LYS 12 HE3 LYS 12 78.940 24.993 -10.473 128 HZ1 LYS 12 HZ1 LYS 12 79.107 27.649 -11.609 129 HZ2 LYS 12 HZ2 LYS 12 79.920 26.446 -12.491 130 HZ3 LYS 12 HZ3 LYS 12 80.304 26.711 -10.857 131 H GLU 13 H GLU 13 76.063 20.857 -11.318 132 HA GLU 13 HA GLU 13 76.156 19.985 -8.604 133 HB2 GLU 13 HB2 GLU 13 77.626 18.999 -11.059 134 HB3 GLU 13 HB3 GLU 13 77.662 18.196 -9.490 135 HG2 GLU 13 HG2 GLU 13 75.951 17.074 -10.669 136 HG3 GLU 13 HG3 GLU 13 75.092 18.198 -9.625 137 H THR 14 H THR 14 77.834 19.966 -7.147 138 HA THR 14 HA THR 14 80.324 21.352 -7.901 139 HB THR 14 HB THR 14 78.836 23.005 -6.844 140 HG1 THR 14 HG1 THR 14 80.331 23.431 -5.112 141 HG21 THR 14 HG21 THR 14 78.914 21.123 -4.470 142 HG22 THR 14 HG22 THR 14 77.499 21.463 -5.467 143 HG23 THR 14 HG23 THR 14 78.206 22.739 -4.475 144 H ALA 15 H ALA 15 82.115 20.926 -6.480 145 HA ALA 15 HA ALA 15 82.306 18.201 -5.718 146 HB1 ALA 15 HB1 ALA 15 84.155 19.957 -6.379 147 HB2 ALA 15 HB2 ALA 15 84.532 18.648 -5.259 148 HB3 ALA 15 HB3 ALA 15 84.190 20.263 -4.642 149 H ALA 16 H ALA 16 82.407 17.242 -3.689 150 HA ALA 16 HA ALA 16 80.683 18.250 -1.698 151 HB1 ALA 16 HB1 ALA 16 81.525 16.395 -0.315 152 HB2 ALA 16 HB2 ALA 16 82.835 16.132 -1.466 153 HB3 ALA 16 HB3 ALA 16 81.163 15.854 -1.954 154 H ALA 17 H ALA 17 81.090 19.154 0.323 155 HA ALA 17 HA ALA 17 83.171 21.043 0.478 156 HB1 ALA 17 HB1 ALA 17 82.475 21.182 2.920 157 HB2 ALA 17 HB2 ALA 17 81.317 19.899 2.569 158 HB3 ALA 17 HB3 ALA 17 81.192 21.452 1.741 159 H LYS 18 H LYS 18 85.095 21.090 1.601 160 HA LYS 18 HA LYS 18 86.202 18.456 2.293 161 HB2 LYS 18 HB2 LYS 18 87.624 21.103 1.923 162 HB3 LYS 18 HB3 LYS 18 88.386 19.527 2.127 163 HG2 LYS 18 HG2 LYS 18 86.539 20.270 -0.161 164 HG3 LYS 18 HG3 LYS 18 88.300 20.234 -0.259 165 HD2 LYS 18 HD2 LYS 18 88.215 17.814 0.437 166 HD3 LYS 18 HD3 LYS 18 86.458 17.891 0.292 167 HE2 LYS 18 HE2 LYS 18 87.155 17.071 -1.808 168 HE3 LYS 18 HE3 LYS 18 86.890 18.791 -2.093 169 HZ1 LYS 18 HZ1 LYS 18 89.183 19.221 -1.985 170 HZ2 LYS 18 HZ2 LYS 18 89.034 17.838 -2.960 171 HZ3 LYS 18 HZ3 LYS 18 89.534 17.691 -1.343 172 H PHE 19 H PHE 19 87.372 18.140 4.237 173 HA PHE 19 HA PHE 19 86.867 20.116 6.375 174 HB2 PHE 19 HB2 PHE 19 86.264 18.335 7.904 175 HB3 PHE 19 HB3 PHE 19 85.184 18.330 6.522 176 HD1 PHE 19 HD2 PHE 19 85.407 16.566 4.771 177 HD2 PHE 19 HD1 PHE 19 87.711 16.493 8.395 178 HE1 PHE 19 HE2 PHE 19 85.941 14.176 4.383 179 HE2 PHE 19 HE1 PHE 19 88.245 14.102 8.007 180 HZ PHE 19 HZ PHE 19 87.361 12.944 6.000 181 H GLU 20 H GLU 20 88.246 19.721 8.303 182 HA GLU 20 HA GLU 20 90.954 19.671 7.621 183 HB2 GLU 20 HB2 GLU 20 89.653 19.139 10.303 184 HB3 GLU 20 HB3 GLU 20 91.365 19.490 10.060 185 HG2 GLU 20 HG2 GLU 20 90.740 21.653 8.999 186 HG3 GLU 20 HG3 GLU 20 89.050 21.310 9.341 187 H ARG 21 H ARG 21 92.555 18.134 7.725 188 HA ARG 21 HA ARG 21 91.834 15.454 7.195 189 HB2 ARG 21 HB2 ARG 21 94.228 14.998 7.225 190 HB3 ARG 21 HB3 ARG 21 93.912 16.506 6.371 191 HG2 ARG 21 HG2 ARG 21 94.419 17.735 8.515 192 HG3 ARG 21 HG3 ARG 21 94.928 16.195 9.209 193 HD2 ARG 21 HD2 ARG 21 96.570 15.949 7.341 194 HD3 ARG 21 HD3 ARG 21 96.117 17.555 6.777 195 HE ARG 21 HE ARG 21 96.789 17.927 9.408 196 HH11 ARG 21 HH11 ARG 21 98.476 16.558 6.650 197 HH12 ARG 21 HH12 ARG 21 100.035 17.014 7.251 198 HH21 ARG 21 HH21 ARG 21 98.823 18.488 10.131 199 HH22 ARG 21 HH22 ARG 21 100.228 18.093 9.197 200 H GLN 22 H GLN 22 91.994 13.587 8.422 201 HA GLN 22 HA GLN 22 91.849 14.025 11.328 202 HB2 GLN 22 HB2 GLN 22 89.972 12.852 10.166 203 HB3 GLN 22 HB3 GLN 22 91.098 11.565 9.733 204 HG2 GLN 22 HG2 GLN 22 90.036 10.816 11.724 205 HG3 GLN 22 HG3 GLN 22 91.624 11.386 12.234 206 HE21 GLN 22 HE21 GLN 22 91.563 12.754 14.015 207 HE22 GLN 22 HE22 GLN 22 90.241 13.724 14.454 208 H HIS 23 H HIS 23 93.484 13.452 12.599 209 HA HIS 23 HA HIS 23 95.399 11.402 11.647 210 HB2 HIS 23 HB2 HIS 23 96.344 13.687 11.468 211 HB3 HIS 23 HB3 HIS 23 96.057 13.918 13.183 212 HD1 HIS 23 HD1 HIS 23 97.718 12.850 14.816 213 HD2 HIS 23 HD2 HIS 23 98.483 11.871 10.836 214 HE1 HIS 23 HE1 HIS 23 99.989 11.735 14.778 215 H MET 24 H MET 24 96.018 9.900 13.123 216 HA MET 24 HA MET 24 95.007 10.193 15.894 217 HB2 MET 24 HB2 MET 24 94.992 7.709 14.163 218 HB3 MET 24 HB3 MET 24 94.557 7.758 15.872 219 HG2 MET 24 HG2 MET 24 92.801 9.468 15.303 220 HG3 MET 24 HG3 MET 24 93.162 9.194 13.598 221 HE1 MET 24 HE1 MET 24 92.945 6.666 16.726 222 HE2 MET 24 HE2 MET 24 91.207 6.390 16.627 223 HE3 MET 24 HE3 MET 24 91.823 8.025 16.856 224 H ASP 25 H ASP 25 96.146 8.814 17.458 225 HA ASP 25 HA ASP 25 98.980 9.073 17.161 226 HB2 ASP 25 HB2 ASP 25 99.098 8.104 19.397 227 HB3 ASP 25 HB3 ASP 25 97.846 9.340 19.336 228 H SER 26 H SER 26 100.204 6.949 18.152 229 HA SER 26 HA SER 26 100.425 5.171 16.006 230 HB2 SER 26 HB2 SER 26 101.732 3.754 17.591 231 HB3 SER 26 HB3 SER 26 102.228 5.443 17.601 232 HG SER 26 HG SER 26 101.141 3.971 19.555 233 HA PRO 27 HA PRO 27 97.073 2.401 16.795 234 HB2 PRO 27 HB2 PRO 27 97.824 0.174 15.462 235 HB3 PRO 27 HB3 PRO 27 97.416 1.681 14.618 236 HG2 PRO 27 HG2 PRO 27 100.072 0.495 15.188 237 HG3 PRO 27 HG3 PRO 27 99.518 1.408 13.775 238 HD2 PRO 27 HD2 PRO 27 101.032 2.466 15.866 239 HD3 PRO 27 HD3 PRO 27 100.081 3.416 14.705 240 H ASP 28 H ASP 28 96.603 0.047 17.517 241 HA ASP 28 HA ASP 28 98.067 -0.411 19.978 242 HB2 ASP 28 HB2 ASP 28 95.587 -0.571 19.863 243 HB3 ASP 28 HB3 ASP 28 95.753 -1.964 18.796 244 H LEU 29 H LEU 29 99.723 -1.761 20.189 245 HA LEU 29 HA LEU 29 100.570 -3.428 17.998 246 HB2 LEU 29 HB2 LEU 29 101.629 -3.124 20.817 247 HB3 LEU 29 HB3 LEU 29 102.400 -4.088 19.557 248 HG LEU 29 HG LEU 29 102.224 -1.861 18.158 249 HD11 LEU 29 HD11 LEU 29 101.033 -0.405 19.544 250 HD12 LEU 29 HD12 LEU 29 102.699 0.047 19.899 251 HD13 LEU 29 HD13 LEU 29 101.814 -1.001 21.008 252 HD21 LEU 29 HD21 LEU 29 104.277 -3.119 19.196 253 HD22 LEU 29 HD22 LEU 29 104.250 -1.815 20.384 254 HD23 LEU 29 HD23 LEU 29 104.474 -1.446 18.674 255 H GLY 30 H GLY 30 100.850 -5.709 18.069 256 HA2 GLY 30 HA2 GLY 30 98.615 -7.164 18.851 257 HA3 GLY 30 HA3 GLY 30 100.180 -7.874 18.471 258 H THR 31 H THR 31 98.240 -8.682 20.499 259 HA THR 31 HA THR 31 99.879 -8.320 22.943 260 HB THR 31 HB THR 31 97.837 -8.561 24.253 261 HG1 THR 31 HG1 THR 31 96.047 -9.121 23.317 262 HG21 THR 31 HG21 THR 31 98.543 -6.304 23.360 263 HG22 THR 31 HG22 THR 31 96.828 -6.436 23.747 264 HG23 THR 31 HG23 THR 31 97.363 -6.520 22.069 265 H ASP 32 H ASP 32 99.488 -10.163 24.531 266 HA ASP 32 HA ASP 32 100.212 -12.609 23.252 267 HB2 ASP 32 HB2 ASP 32 101.003 -11.928 25.513 268 HB3 ASP 32 HB3 ASP 32 99.365 -12.161 26.123 269 H ASP 33 H ASP 33 98.963 -14.210 22.532 270 HA ASP 33 HA ASP 33 96.171 -13.971 22.334 271 HB2 ASP 33 HB2 ASP 33 96.226 -16.302 21.533 272 HB3 ASP 33 HB3 ASP 33 97.491 -15.330 20.783 273 H ASP 34 H ASP 34 94.479 -14.952 23.403 274 HA ASP 34 HA ASP 34 95.092 -16.462 25.858 275 HB2 ASP 34 HB2 ASP 34 93.242 -14.071 25.687 276 HB3 ASP 34 HB3 ASP 34 93.404 -15.128 27.087 277 H ASP 35 H ASP 35 92.896 -17.243 26.831 278 HA ASP 35 HA ASP 35 91.693 -18.981 24.980 279 HB2 ASP 35 HB2 ASP 35 90.686 -18.021 27.668 280 HB3 ASP 35 HB3 ASP 35 90.014 -19.379 26.770 281 H LYS 36 H LYS 36 89.602 -18.995 24.063 282 HA LYS 36 HA LYS 36 88.760 -16.445 23.068 283 HB2 LYS 36 HB2 LYS 36 87.508 -19.191 22.839 284 HB3 LYS 36 HB3 LYS 36 86.965 -17.764 21.955 285 HG2 LYS 36 HG2 LYS 36 89.251 -17.543 20.982 286 HG3 LYS 36 HG3 LYS 36 89.709 -19.042 21.789 287 HD2 LYS 36 HD2 LYS 36 87.857 -20.207 20.582 288 HD3 LYS 36 HD3 LYS 36 87.534 -18.713 19.702 289 HE2 LYS 36 HE2 LYS 36 89.801 -18.736 18.773 290 HE3 LYS 36 HE3 LYS 36 90.183 -20.189 19.697 291 HZ1 LYS 36 HZ1 LYS 36 88.070 -19.966 17.621 292 HZ2 LYS 36 HZ2 LYS 36 88.444 -21.365 18.509 293 HZ3 LYS 36 HZ3 LYS 36 89.576 -20.720 17.419 294 H THR 37 H THR 37 86.970 -15.250 23.557 295 HA THR 37 HA THR 37 85.368 -16.105 25.900 296 HB THR 37 HB THR 37 85.317 -13.783 26.642 297 HG1 THR 37 HG1 THR 37 86.004 -12.286 25.373 298 HG21 THR 37 HG21 THR 37 87.224 -15.359 27.270 299 HG22 THR 37 HG22 THR 37 87.552 -13.637 27.463 300 HG23 THR 37 HG23 THR 37 88.194 -14.506 26.069 301 H GLY 38 H GLY 38 83.292 -14.840 26.059 302 HA2 GLY 38 HA2 GLY 38 81.867 -15.063 23.572 303 HA3 GLY 38 HA3 GLY 38 81.195 -14.556 25.119 304 H GLY 39 H GLY 39 80.044 -12.995 23.684 305 HA2 GLY 39 HA2 GLY 39 81.246 -10.992 22.178 306 HA3 GLY 39 HA3 GLY 39 79.700 -10.822 23.003 307 H GLY 40 H GLY 40 81.891 -8.873 22.606 308 HA2 GLY 40 HA2 GLY 40 82.001 -7.845 25.304 309 HA3 GLY 40 HA3 GLY 40 83.567 -8.355 24.681 310 H ARG 41 H ARG 41 84.232 -6.127 24.857 311 HA ARG 41 HA ARG 41 82.994 -3.960 23.575 312 HB2 ARG 41 HB2 ARG 41 85.960 -4.392 24.010 313 HB3 ARG 41 HB3 ARG 41 85.165 -2.847 23.721 314 HG2 ARG 41 HG2 ARG 41 84.496 -4.635 26.072 315 HG3 ARG 41 HG3 ARG 41 85.690 -3.343 26.151 316 HD2 ARG 41 HD2 ARG 41 82.773 -2.973 25.400 317 HD3 ARG 41 HD3 ARG 41 83.475 -2.602 26.969 318 HE ARG 41 HE ARG 41 85.032 -1.138 25.360 319 HH11 ARG 41 HH11 ARG 41 81.535 -1.452 25.400 320 HH12 ARG 41 HH12 ARG 41 81.285 0.148 24.786 321 HH21 ARG 41 HH21 ARG 41 84.647 0.913 24.572 322 HH22 ARG 41 HH22 ARG 41 83.025 1.469 24.323 323 H ALA 42 H ALA 42 83.276 -3.003 21.569 324 HA ALA 42 HA ALA 42 83.548 -4.730 19.362 325 HB1 ALA 42 HB1 ALA 42 83.925 -1.744 19.211 326 HB2 ALA 42 HB2 ALA 42 82.341 -2.463 19.502 327 HB3 ALA 42 HB3 ALA 42 83.213 -2.823 18.012 328 H ASP 43 H ASP 43 85.172 -4.967 17.824 329 HA ASP 43 HA ASP 43 87.831 -4.964 18.776 330 HB2 ASP 43 HB2 ASP 43 86.821 -5.114 15.925 331 HB3 ASP 43 HB3 ASP 43 88.442 -5.550 16.464 332 HA PRO 44 HA PRO 44 89.053 -0.815 17.886 333 HB2 PRO 44 HB2 PRO 44 91.720 -1.046 17.408 334 HB3 PRO 44 HB3 PRO 44 91.016 -1.244 19.025 335 HG2 PRO 44 HG2 PRO 44 91.921 -3.310 17.094 336 HG3 PRO 44 HG3 PRO 44 92.068 -3.269 18.860 337 HD2 PRO 44 HD2 PRO 44 90.157 -4.735 17.527 338 HD3 PRO 44 HD3 PRO 44 89.968 -4.144 19.190 339 H ALA 45 H ALA 45 90.304 0.551 16.223 340 HA ALA 45 HA ALA 45 89.653 -0.462 13.529 341 HB1 ALA 45 HB1 ALA 45 88.488 1.552 13.905 342 HB2 ALA 45 HB2 ALA 45 89.894 2.037 12.958 343 HB3 ALA 45 HB3 ALA 45 89.870 2.305 14.701 344 H HIS 46 H HIS 46 91.125 -0.204 11.817 345 HA HIS 46 HA HIS 46 93.948 0.041 12.676 346 HB2 HIS 46 HB2 HIS 46 92.751 -1.378 10.292 347 HB3 HIS 46 HB3 HIS 46 94.462 -1.282 10.660 348 HD1 HIS 46 HD1 HIS 46 95.074 -2.352 13.152 349 HD2 HIS 46 HD2 HIS 46 91.538 -3.609 11.337 350 HE1 HIS 46 HE1 HIS 46 94.414 -4.512 14.292 351 H ARG 47 H ARG 47 95.286 1.467 11.684 352 HA ARG 47 HA ARG 47 94.183 3.689 10.334 353 HB2 ARG 47 HB2 ARG 47 96.485 4.436 10.063 354 HB3 ARG 47 HB3 ARG 47 96.251 3.786 11.684 355 HG2 ARG 47 HG2 ARG 47 97.178 1.591 10.853 356 HG3 ARG 47 HG3 ARG 47 97.576 2.400 9.336 357 HD2 ARG 47 HD2 ARG 47 98.923 4.062 10.631 358 HD3 ARG 47 HD3 ARG 47 98.607 3.128 12.090 359 HE ARG 47 HE ARG 47 99.770 1.618 9.898 360 HH11 ARG 47 HH11 ARG 47 100.444 3.488 12.792 361 HH12 ARG 47 HH12 ARG 47 102.008 2.776 13.008 362 HH21 ARG 47 HH21 ARG 47 101.794 0.739 10.227 363 HH22 ARG 47 HH22 ARG 47 102.761 1.239 11.572 364 H SER 48 H SER 48 94.327 4.361 8.190 365 HA SER 48 HA SER 48 94.896 2.212 6.225 366 HB2 SER 48 HB2 SER 48 92.963 4.519 5.911 367 HB3 SER 48 HB3 SER 48 93.188 3.162 4.812 368 HG SER 48 HG SER 48 91.602 3.280 6.845 369 HA PRO 49 HA PRO 49 98.017 4.698 4.335 370 HB2 PRO 49 HB2 PRO 49 96.603 4.433 1.722 371 HB3 PRO 49 HB3 PRO 49 98.284 4.049 2.141 372 HG2 PRO 49 HG2 PRO 49 96.474 2.138 1.778 373 HG3 PRO 49 HG3 PRO 49 97.745 1.996 3.006 374 HD2 PRO 49 HD2 PRO 49 94.840 2.578 3.371 375 HD3 PRO 49 HD3 PRO 49 95.961 1.704 4.438 376 H VAL 50 H VAL 50 98.311 6.871 4.148 377 HA VAL 50 HA VAL 50 95.944 8.554 4.003 378 HB VAL 50 HB VAL 50 98.861 9.271 4.416 379 HG11 VAL 50 HG11 VAL 50 98.066 11.437 5.123 380 HG12 VAL 50 HG12 VAL 50 96.385 10.923 4.978 381 HG13 VAL 50 HG13 VAL 50 97.377 11.113 3.532 382 HG21 VAL 50 HG21 VAL 50 96.606 9.084 6.433 383 HG22 VAL 50 HG22 VAL 50 98.307 9.405 6.770 384 HG23 VAL 50 HG23 VAL 50 97.807 7.818 6.184 385 HA PRO 51 HA PRO 51 96.365 9.329 -0.392 386 HB2 PRO 51 HB2 PRO 51 95.813 12.197 0.225 387 HB3 PRO 51 HB3 PRO 51 95.013 11.117 -0.934 388 HG2 PRO 51 HG2 PRO 51 93.859 11.797 1.365 389 HG3 PRO 51 HG3 PRO 51 93.656 10.185 0.656 390 HD2 PRO 51 HD2 PRO 51 95.286 11.003 3.011 391 HD3 PRO 51 HD3 PRO 51 94.482 9.457 2.675 392 H LEU 52 H LEU 52 97.891 10.186 -1.852 393 HA LEU 52 HA LEU 52 100.453 10.715 -0.781 394 HB2 LEU 52 HB2 LEU 52 99.260 10.843 -3.537 395 HB3 LEU 52 HB3 LEU 52 100.896 11.438 -3.252 396 HG LEU 52 HG LEU 52 99.981 8.680 -2.403 397 HD11 LEU 52 HD11 LEU 52 101.386 7.990 -4.446 398 HD12 LEU 52 HD12 LEU 52 101.216 9.662 -4.981 399 HD13 LEU 52 HD13 LEU 52 99.784 8.652 -4.773 400 HD21 LEU 52 HD21 LEU 52 101.939 9.297 -1.210 401 HD22 LEU 52 HD22 LEU 52 102.626 10.129 -2.606 402 HD23 LEU 52 HD23 LEU 52 102.545 8.368 -2.581 403 HA PRO 53 HA PRO 53 100.252 15.158 -0.392 404 HB2 PRO 53 HB2 PRO 53 102.844 15.895 -0.823 405 HB3 PRO 53 HB3 PRO 53 102.299 15.123 0.679 406 HG2 PRO 53 HG2 PRO 53 103.737 13.946 -1.635 407 HG3 PRO 53 HG3 PRO 53 103.909 13.612 0.098 408 HD2 PRO 53 HD2 PRO 53 102.518 11.988 -1.633 409 HD3 PRO 53 HD3 PRO 53 102.195 12.080 0.111 410 H SER 54 H SER 54 100.076 17.015 -1.687 411 HA SER 54 HA SER 54 99.455 16.588 -4.363 412 HB2 SER 54 HB2 SER 54 100.175 19.178 -2.971 413 HB3 SER 54 HB3 SER 54 99.429 19.070 -4.561 414 HG SER 54 HG SER 54 97.657 18.270 -3.614 415 HA PRO 55 HA PRO 55 103.484 16.408 -6.038 416 HB2 PRO 55 HB2 PRO 55 103.021 16.560 -8.692 417 HB3 PRO 55 HB3 PRO 55 102.469 15.182 -7.719 418 HG2 PRO 55 HG2 PRO 55 100.929 17.477 -8.787 419 HG3 PRO 55 HG3 PRO 55 100.442 15.788 -8.569 420 HD2 PRO 55 HD2 PRO 55 99.795 17.891 -6.839 421 HD3 PRO 55 HD3 PRO 55 99.697 16.161 -6.445 422 H THR 56 H THR 56 104.950 17.997 -5.748 423 HA THR 56 HA THR 56 104.695 20.537 -7.168 424 HB THR 56 HB THR 56 106.809 21.122 -6.096 425 HG1 THR 56 HG1 THR 56 107.586 19.406 -4.647 426 HG21 THR 56 HG21 THR 56 104.675 21.251 -4.780 427 HG22 THR 56 HG22 THR 56 106.110 21.031 -3.778 428 HG23 THR 56 HG23 THR 56 105.047 19.663 -4.110 429 H SER 57 H SER 57 106.564 21.198 -8.632 430 HA SER 57 HA SER 57 106.505 19.455 -10.806 431 HB2 SER 57 HB2 SER 57 107.977 20.960 -11.899 432 HB3 SER 57 HB3 SER 57 107.034 21.948 -10.788 433 HG SER 57 HG SER 57 108.805 22.300 -9.726 434 H ASN 58 H ASN 58 107.474 17.617 -11.192 435 HA ASN 58 HA ASN 58 109.108 16.063 -11.506 436 HB2 ASN 58 HB2 ASN 58 110.905 18.366 -10.753 437 HB3 ASN 58 HB3 ASN 58 111.466 16.826 -11.399 438 HD21 ASN 58 HD21 ASN 58 111.834 19.371 -12.759 439 HD22 ASN 58 HD22 ASN 58 110.948 19.302 -14.206 440 H LYS 59 H LYS 59 108.054 16.750 -8.581 441 HA LYS 59 HA LYS 59 109.667 14.690 -7.375 442 HB2 LYS 59 HB2 LYS 59 110.606 15.966 -5.572 443 HB3 LYS 59 HB3 LYS 59 111.078 16.708 -7.096 444 HG2 LYS 59 HG2 LYS 59 109.195 18.342 -6.822 445 HG3 LYS 59 HG3 LYS 59 108.882 17.644 -5.232 446 HD2 LYS 59 HD2 LYS 59 111.320 18.134 -4.675 447 HD3 LYS 59 HD3 LYS 59 111.369 19.096 -6.154 448 HE2 LYS 59 HE2 LYS 59 110.822 20.675 -4.490 449 HE3 LYS 59 HE3 LYS 59 109.263 20.277 -5.213 450 HZ1 LYS 59 HZ1 LYS 59 109.179 18.486 -3.396 451 HZ2 LYS 59 HZ2 LYS 59 108.866 20.098 -2.958 452 HZ3 LYS 59 HZ3 LYS 59 110.382 19.404 -2.628 453 H GLN 60 H GLN 60 108.943 13.968 -5.318 454 HA GLN 60 HA GLN 60 106.538 15.168 -4.175 455 HB2 GLN 60 HB2 GLN 60 106.636 12.279 -5.065 456 HB3 GLN 60 HB3 GLN 60 105.440 12.925 -3.946 457 HG2 GLN 60 HG2 GLN 60 104.815 14.609 -5.718 458 HG3 GLN 60 HG3 GLN 60 105.882 13.736 -6.821 459 HE21 GLN 60 HE21 GLN 60 102.773 13.547 -5.101 460 HE22 GLN 60 HE22 GLN 60 102.250 12.140 -5.891 461 H ASP 61 H ASP 61 106.227 14.640 -1.975 462 HA ASP 61 HA ASP 61 108.524 13.422 -0.634 463 HB2 ASP 61 HB2 ASP 61 106.004 14.700 0.462 464 HB3 ASP 61 HB3 ASP 61 107.340 14.102 1.442 465 H ILE 62 H ILE 62 108.549 11.323 -0.018 466 HA ILE 62 HA ILE 62 105.967 9.869 0.076 467 HB ILE 62 HB ILE 62 107.249 9.460 -2.030 468 HG12 ILE 62 HG12 ILE 62 107.175 6.933 -1.779 469 HG13 ILE 62 HG13 ILE 62 106.790 7.199 -0.078 470 HG21 ILE 62 HG21 ILE 62 109.254 8.150 -0.175 471 HG22 ILE 62 HG22 ILE 62 109.531 9.625 -1.102 472 HG23 ILE 62 HG23 ILE 62 109.281 8.092 -1.938 473 HD11 ILE 62 HD11 ILE 62 105.178 8.679 -2.125 474 HD12 ILE 62 HD12 ILE 62 104.697 8.068 -0.543 475 HD13 ILE 62 HD13 ILE 62 104.862 6.960 -1.903 476 H SER 63 H SER 63 105.849 8.112 1.577 477 HA SER 63 HA SER 63 108.033 7.875 3.492 478 HB2 SER 63 HB2 SER 63 106.806 8.664 5.393 479 HB3 SER 63 HB3 SER 63 106.736 9.916 4.157 480 HG SER 63 HG SER 63 104.696 9.500 4.966 481 H GLU 64 H GLU 64 107.638 6.307 5.174 482 HA GLU 64 HA GLU 64 106.664 3.879 4.264 483 HB2 GLU 64 HB2 GLU 64 106.860 3.125 6.598 484 HB3 GLU 64 HB3 GLU 64 108.254 4.088 6.111 485 HG2 GLU 64 HG2 GLU 64 107.195 6.084 7.154 486 HG3 GLU 64 HG3 GLU 64 105.885 5.061 7.727 487 H ALA 65 H ALA 65 104.983 6.432 6.036 488 HA ALA 65 HA ALA 65 102.799 4.937 6.967 489 HB1 ALA 65 HB1 ALA 65 103.248 7.832 6.356 490 HB2 ALA 65 HB2 ALA 65 102.905 7.054 7.901 491 HB3 ALA 65 HB3 ALA 65 101.615 7.271 6.719 492 H ASN 66 H ASN 66 103.271 6.642 3.881 493 HA ASN 66 HA ASN 66 100.601 6.241 2.966 494 HB2 ASN 66 HB2 ASN 66 103.065 6.713 1.277 495 HB3 ASN 66 HB3 ASN 66 101.389 7.022 0.830 496 HD21 ASN 66 HD21 ASN 66 100.272 8.829 1.973 497 HD22 ASN 66 HD22 ASN 66 101.187 10.070 2.678 498 H LEU 67 H LEU 67 103.669 4.561 2.307 499 HA LEU 67 HA LEU 67 102.485 2.758 0.427 500 HB2 LEU 67 HB2 LEU 67 105.170 2.940 1.752 501 HB3 LEU 67 HB3 LEU 67 104.734 1.518 0.803 502 HG LEU 67 HG LEU 67 104.047 3.154 -1.046 503 HD11 LEU 67 HD11 LEU 67 103.921 5.253 -0.049 504 HD12 LEU 67 HD12 LEU 67 105.521 5.317 -0.786 505 HD13 LEU 67 HD13 LEU 67 105.358 4.984 0.936 506 HD21 LEU 67 HD21 LEU 67 106.984 3.440 -0.519 507 HD22 LEU 67 HD22 LEU 67 106.150 2.985 -2.002 508 HD23 LEU 67 HD23 LEU 67 106.323 1.814 -0.695 509 H ALA 68 H ALA 68 102.891 2.639 3.891 510 HA ALA 68 HA ALA 68 102.211 1.121 5.451 511 HB1 ALA 68 HB1 ALA 68 100.973 -0.720 3.460 512 HB2 ALA 68 HB2 ALA 68 100.280 0.894 3.607 513 HB3 ALA 68 HB3 ALA 68 100.359 -0.162 5.016 514 H TYR 69 H TYR 69 102.099 -1.913 4.657 515 HA TYR 69 HA TYR 69 104.686 -2.517 5.530 516 HB2 TYR 69 HB2 TYR 69 102.759 -4.224 3.959 517 HB3 TYR 69 HB3 TYR 69 104.184 -4.819 4.790 518 HD1 TYR 69 HD1 TYR 69 104.310 -4.624 7.309 519 HD2 TYR 69 HD2 TYR 69 100.716 -3.828 5.095 520 HE1 TYR 69 HE1 TYR 69 102.977 -4.867 9.386 521 HE2 TYR 69 HE2 TYR 69 99.383 -4.071 7.173 522 HH TYR 69 HH TYR 69 100.882 -4.977 10.202 523 H LEU 70 H LEU 70 103.626 -1.663 2.361 524 HA LEU 70 HA LEU 70 105.456 -3.070 0.758 525 HB2 LEU 70 HB2 LEU 70 103.912 -0.521 0.439 526 HB3 LEU 70 HB3 LEU 70 105.141 -0.928 -0.748 527 HG LEU 70 HG LEU 70 102.868 -1.684 -1.403 528 HD11 LEU 70 HD11 LEU 70 105.132 -2.915 -1.910 529 HD12 LEU 70 HD12 LEU 70 103.598 -3.672 -2.341 530 HD13 LEU 70 HD13 LEU 70 104.448 -4.172 -0.879 531 HD21 LEU 70 HD21 LEU 70 101.756 -3.485 -0.238 532 HD22 LEU 70 HD22 LEU 70 102.086 -2.205 0.929 533 HD23 LEU 70 HD23 LEU 70 103.102 -3.647 0.891 534 H TRP 71 H TRP 71 105.979 -0.353 2.862 535 HA TRP 71 HA TRP 71 108.054 0.991 1.603 536 HB2 TRP 71 HB2 TRP 71 106.789 1.554 3.746 537 HB3 TRP 71 HB3 TRP 71 107.938 0.511 4.564 538 HD1 TRP 71 HD1 TRP 71 109.914 1.737 5.527 539 HE1 TRP 71 HE1 TRP 71 111.145 3.942 5.032 540 HE3 TRP 71 HE3 TRP 71 107.348 3.279 1.394 541 HZ2 TRP 71 HZ2 TRP 71 111.078 6.079 3.117 542 HZ3 TRP 71 HZ3 TRP 71 107.951 5.391 0.254 543 HH2 TRP 71 HH2 TRP 71 109.808 6.793 1.108 544 HA PRO 72 HA PRO 72 110.971 -2.481 2.196 545 HB2 PRO 72 HB2 PRO 72 112.648 -2.021 0.151 546 HB3 PRO 72 HB3 PRO 72 111.001 -2.625 -0.118 547 HG2 PRO 72 HG2 PRO 72 112.105 0.084 -0.535 548 HG3 PRO 72 HG3 PRO 72 110.827 -0.768 -1.415 549 HD2 PRO 72 HD2 PRO 72 110.466 1.174 0.614 550 HD3 PRO 72 HD3 PRO 72 109.213 0.139 -0.100 551 H LEU 73 H LEU 73 111.676 0.880 2.476 552 HA LEU 73 HA LEU 73 114.527 0.472 2.995 553 HB2 LEU 73 HB2 LEU 73 112.876 3.004 3.081 554 HB3 LEU 73 HB3 LEU 73 114.632 2.903 3.172 555 HG LEU 73 HG LEU 73 112.971 1.932 0.830 556 HD11 LEU 73 HD11 LEU 73 112.987 4.421 1.196 557 HD12 LEU 73 HD12 LEU 73 113.751 3.925 -0.320 558 HD13 LEU 73 HD13 LEU 73 114.745 4.379 1.065 559 HD21 LEU 73 HD21 LEU 73 115.266 1.930 -0.266 560 HD22 LEU 73 HD22 LEU 73 115.043 0.698 0.974 561 HD23 LEU 73 HD23 LEU 73 115.954 2.162 1.340 562 H THR 74 H THR 74 115.527 0.758 4.920 563 HA THR 74 HA THR 74 114.082 0.449 7.352 564 HB THR 74 HB THR 74 116.264 0.709 8.434 565 HG1 THR 74 HG1 THR 74 117.153 2.285 7.197 566 HG21 THR 74 HG21 THR 74 115.839 -1.469 7.511 567 HG22 THR 74 HG22 THR 74 117.506 -1.055 7.110 568 HG23 THR 74 HG23 THR 74 116.245 -0.921 5.885 569 H VAL 75 H VAL 75 115.592 3.233 5.715 570 HA VAL 75 HA VAL 75 115.069 5.110 7.782 571 HB VAL 75 HB VAL 75 115.185 6.827 5.954 572 HG11 VAL 75 HG11 VAL 75 117.213 6.151 7.093 573 HG12 VAL 75 HG12 VAL 75 117.569 6.311 5.373 574 HG13 VAL 75 HG13 VAL 75 117.350 4.712 6.084 575 HG21 VAL 75 HG21 VAL 75 115.686 4.411 4.182 576 HG22 VAL 75 HG22 VAL 75 115.794 6.099 3.698 577 HG23 VAL 75 HG23 VAL 75 114.235 5.410 4.135 578 H ASP 76 H ASP 76 113.208 6.150 8.348 579 HA ASP 76 HA ASP 76 110.845 4.741 7.722 580 HB2 ASP 76 HB2 ASP 76 111.228 7.397 9.124 581 HB3 ASP 76 HB3 ASP 76 109.705 6.515 9.064 582 H HIS 77 H HIS 77 112.151 7.761 6.436 583 HA HIS 77 HA HIS 77 110.131 7.608 4.335 584 HB2 HIS 77 HB2 HIS 77 109.596 10.022 4.555 585 HB3 HIS 77 HB3 HIS 77 109.015 9.041 5.886 586 HD1 HIS 77 HD1 HIS 77 111.063 8.979 7.926 587 HD2 HIS 77 HD2 HIS 77 110.640 12.353 5.513 588 HE1 HIS 77 HE1 HIS 77 112.127 10.899 9.187 589 H GLY 78 H GLY 78 110.577 9.398 2.679 590 HA2 GLY 78 HA2 GLY 78 113.135 10.645 2.588 591 HA3 GLY 78 HA3 GLY 78 113.086 9.210 1.569 592 H THR 79 H THR 79 113.442 11.773 0.521 593 HA THR 79 HA THR 79 110.849 12.357 -0.784 594 HB THR 79 HB THR 79 113.301 14.108 -0.925 595 HG1 THR 79 HG1 THR 79 112.966 14.217 1.151 596 HG21 THR 79 HG21 THR 79 110.330 14.359 -1.370 597 HG22 THR 79 HG22 THR 79 111.648 14.796 -2.460 598 HG23 THR 79 HG23 THR 79 111.310 15.790 -1.042 599 H ILE 80 H ILE 80 110.659 12.207 -2.988 600 HA ILE 80 HA ILE 80 112.956 11.001 -4.413 601 HB ILE 80 HB ILE 80 111.242 10.113 -5.984 602 HG12 ILE 80 HG12 ILE 80 109.259 11.114 -3.913 603 HG13 ILE 80 HG13 ILE 80 109.500 11.855 -5.492 604 HG21 ILE 80 HG21 ILE 80 110.383 8.401 -4.408 605 HG22 ILE 80 HG22 ILE 80 110.866 9.426 -3.056 606 HG23 ILE 80 HG23 ILE 80 112.089 8.755 -4.134 607 HD11 ILE 80 HD11 ILE 80 108.340 9.164 -4.837 608 HD12 ILE 80 HD12 ILE 80 109.066 9.456 -6.417 609 HD13 ILE 80 HD13 ILE 80 107.692 10.430 -5.884 610 H GLU 81 H GLU 81 113.743 11.945 -6.234 611 HA GLU 81 HA GLU 81 112.281 14.203 -7.395 612 HB2 GLU 81 HB2 GLU 81 113.675 15.115 -5.540 613 HB3 GLU 81 HB3 GLU 81 115.107 14.500 -6.364 614 HG2 GLU 81 HG2 GLU 81 114.496 15.850 -8.365 615 HG3 GLU 81 HG3 GLU 81 113.133 16.514 -7.476 616 H CYS 82 H CYS 82 112.611 14.491 -9.492 617 HA CYS 82 HA CYS 82 114.752 12.974 -10.837 618 HB2 CYS 82 HB2 CYS 82 112.181 14.232 -11.804 619 HB3 CYS 82 HB3 CYS 82 113.447 13.723 -12.921 620 H LEU 83 H LEU 83 116.557 14.073 -11.334 621 HA LEU 83 HA LEU 83 116.617 16.941 -10.921 622 HB2 LEU 83 HB2 LEU 83 118.804 15.011 -11.734 623 HB3 LEU 83 HB3 LEU 83 119.046 16.701 -11.288 624 HG LEU 83 HG LEU 83 117.674 14.733 -9.449 625 HD11 LEU 83 HD11 LEU 83 119.774 14.344 -8.350 626 HD12 LEU 83 HD12 LEU 83 120.589 15.547 -9.351 627 HD13 LEU 83 HD13 LEU 83 120.038 14.032 -10.066 628 HD21 LEU 83 HD21 LEU 83 118.841 17.506 -9.220 629 HD22 LEU 83 HD22 LEU 83 118.638 16.490 -7.794 630 HD23 LEU 83 HD23 LEU 83 117.233 16.947 -8.756 631 HA PRO 84 HA PRO 84 116.258 18.322 -15.141 632 HB2 PRO 84 HB2 PRO 84 118.790 19.846 -14.748 633 HB3 PRO 84 HB3 PRO 84 117.209 20.408 -15.327 634 HG2 PRO 84 HG2 PRO 84 118.059 20.969 -12.876 635 HG3 PRO 84 HG3 PRO 84 116.353 20.616 -13.207 636 HD2 PRO 84 HD2 PRO 84 118.405 18.890 -11.892 637 HD3 PRO 84 HD3 PRO 84 116.654 18.989 -11.600 638 H SER 85 H SER 85 119.125 16.770 -13.983 639 HA SER 85 HA SER 85 120.446 16.554 -16.539 640 HB2 SER 85 HB2 SER 85 120.953 15.223 -13.876 641 HB3 SER 85 HB3 SER 85 121.969 15.015 -15.299 642 HG SER 85 HG SER 85 121.318 17.518 -14.274 643 H ASP 86 H ASP 86 117.686 15.077 -15.543 644 HA ASP 86 HA ASP 86 116.541 13.222 -16.186 645 HB2 ASP 86 HB2 ASP 86 118.769 12.901 -18.216 646 HB3 ASP 86 HB3 ASP 86 117.236 12.041 -18.224 647 H ASN 87 H ASN 87 118.049 13.021 -13.963 648 HA ASN 87 HA ASN 87 118.740 10.143 -13.996 649 HB2 ASN 87 HB2 ASN 87 120.097 12.340 -12.411 650 HB3 ASN 87 HB3 ASN 87 120.388 10.614 -12.199 651 HD21 ASN 87 HD21 ASN 87 122.413 12.551 -13.052 652 HD22 ASN 87 HD22 ASN 87 122.897 12.103 -14.616 653 H ALA 88 H ALA 88 117.658 8.964 -12.487 654 HA ALA 88 HA ALA 88 115.788 10.421 -10.753 655 HB1 ALA 88 HB1 ALA 88 115.852 7.437 -11.137 656 HB2 ALA 88 HB2 ALA 88 115.110 8.495 -12.338 657 HB3 ALA 88 HB3 ALA 88 114.490 8.463 -10.687 658 H VAL 89 H VAL 89 116.256 10.716 -8.665 659 HA VAL 89 HA VAL 89 117.993 8.738 -7.310 660 HB VAL 89 HB VAL 89 119.112 10.604 -6.133 661 HG11 VAL 89 HG11 VAL 89 119.198 10.427 -9.138 662 HG12 VAL 89 HG12 VAL 89 120.351 9.801 -7.959 663 HG13 VAL 89 HG13 VAL 89 120.262 11.534 -8.270 664 HG21 VAL 89 HG21 VAL 89 118.824 12.900 -6.981 665 HG22 VAL 89 HG22 VAL 89 117.293 12.270 -6.374 666 HG23 VAL 89 HG23 VAL 89 117.592 12.336 -8.111 667 H PHE 90 H PHE 90 117.790 8.638 -5.070 668 HA PHE 90 HA PHE 90 115.238 9.620 -3.948 669 HB2 PHE 90 HB2 PHE 90 115.302 7.206 -4.161 670 HB3 PHE 90 HB3 PHE 90 116.868 7.142 -3.385 671 HD1 PHE 90 HD1 PHE 90 113.283 8.004 -2.804 672 HD2 PHE 90 HD2 PHE 90 117.042 6.884 -1.057 673 HE1 PHE 90 HE1 PHE 90 112.162 7.657 -0.611 674 HE2 PHE 90 HE2 PHE 90 115.924 6.527 1.127 675 HZ PHE 90 HZ PHE 90 113.481 6.916 1.347 676 H VAL 91 H VAL 91 115.389 10.937 -2.199 677 HA VAL 91 HA VAL 91 118.046 11.280 -0.935 678 HB VAL 91 HB VAL 91 115.700 13.198 -1.040 679 HG11 VAL 91 HG11 VAL 91 118.509 13.966 -0.301 680 HG12 VAL 91 HG12 VAL 91 117.466 13.268 0.934 681 HG13 VAL 91 HG13 VAL 91 116.988 14.750 0.114 682 HG21 VAL 91 HG21 VAL 91 116.822 12.822 -3.236 683 HG22 VAL 91 HG22 VAL 91 118.353 13.296 -2.501 684 HG23 VAL 91 HG23 VAL 91 117.039 14.465 -2.634 685 H ALA 92 H ALA 92 118.257 10.795 1.185 686 HA ALA 92 HA ALA 92 115.807 10.003 2.645 687 HB1 ALA 92 HB1 ALA 92 117.424 8.265 2.693 688 HB2 ALA 92 HB2 ALA 92 117.533 9.036 4.275 689 HB3 ALA 92 HB3 ALA 92 118.739 9.389 3.037 690 HA PRO 93 HA PRO 93 115.701 13.478 5.367 691 HB2 PRO 93 HB2 PRO 93 116.002 11.631 7.692 692 HB3 PRO 93 HB3 PRO 93 114.771 12.870 7.385 693 HG2 PRO 93 HG2 PRO 93 114.294 10.244 7.100 694 HG3 PRO 93 HG3 PRO 93 113.495 11.484 6.122 695 HD2 PRO 93 HD2 PRO 93 115.560 9.532 5.315 696 HD3 PRO 93 HD3 PRO 93 114.383 10.415 4.324 697 H ASP 94 H ASP 94 118.231 11.098 5.787 698 HA ASP 94 HA ASP 94 119.823 12.520 7.647 699 HB2 ASP 94 HB2 ASP 94 121.652 11.013 6.838 700 HB3 ASP 94 HB3 ASP 94 120.191 10.183 7.356 701 H GLY 95 H GLY 95 119.201 13.237 4.368 702 HA2 GLY 95 HA2 GLY 95 119.994 15.141 3.225 703 HA3 GLY 95 HA3 GLY 95 121.339 15.234 4.357 704 H THR 96 H THR 96 120.920 12.077 3.187 705 HA THR 96 HA THR 96 123.247 12.358 1.416 706 HB THR 96 HB THR 96 121.942 9.875 2.564 707 HG1 THR 96 HG1 THR 96 123.732 9.986 3.950 708 HG21 THR 96 HG21 THR 96 124.338 10.400 0.843 709 HG22 THR 96 HG22 THR 96 123.163 9.087 0.760 710 HG23 THR 96 HG23 THR 96 124.407 9.079 2.009 711 H THR 97 H THR 97 123.108 11.866 -0.738 712 HA THR 97 HA THR 97 120.416 11.236 -1.775 713 HB THR 97 HB THR 97 122.849 12.255 -3.270 714 HG1 THR 97 HG1 THR 97 120.704 13.536 -2.075 715 HG21 THR 97 HG21 THR 97 121.116 11.008 -4.589 716 HG22 THR 97 HG22 THR 97 121.277 12.700 -5.060 717 HG23 THR 97 HG23 THR 97 119.923 12.191 -4.050 718 H TYR 98 H TYR 98 120.009 9.359 -2.672 719 HA TYR 98 HA TYR 98 122.225 7.496 -3.261 720 HB2 TYR 98 HB2 TYR 98 119.387 6.905 -2.415 721 HB3 TYR 98 HB3 TYR 98 120.606 5.700 -2.779 722 HD1 TYR 98 HD2 TYR 98 122.495 5.324 -1.214 723 HD2 TYR 98 HD1 TYR 98 119.339 8.098 -0.323 724 HE1 TYR 98 HE2 TYR 98 123.185 5.348 1.168 725 HE2 TYR 98 HE1 TYR 98 120.037 8.132 2.054 726 HH TYR 98 HH TYR 98 121.612 7.431 3.511 727 H ALA 99 H ALA 99 121.984 6.207 -5.163 728 HA ALA 99 HA ALA 99 120.421 7.504 -7.252 729 HB1 ALA 99 HB1 ALA 99 122.556 5.374 -7.221 730 HB2 ALA 99 HB2 ALA 99 122.597 6.965 -7.979 731 HB3 ALA 99 HB3 ALA 99 121.600 5.685 -8.670 732 H LEU 100 H LEU 100 118.483 6.818 -7.913 733 HA LEU 100 HA LEU 100 117.335 4.397 -6.801 734 HB2 LEU 100 HB2 LEU 100 116.323 6.617 -8.560 735 HB3 LEU 100 HB3 LEU 100 115.407 5.122 -8.395 736 HG LEU 100 HG LEU 100 116.381 6.571 -5.946 737 HD11 LEU 100 HD11 LEU 100 113.759 7.072 -7.377 738 HD12 LEU 100 HD12 LEU 100 115.129 8.177 -7.429 739 HD13 LEU 100 HD13 LEU 100 114.314 7.854 -5.897 740 HD21 LEU 100 HD21 LEU 100 113.851 4.980 -6.421 741 HD22 LEU 100 HD22 LEU 100 114.626 5.354 -4.883 742 HD23 LEU 100 HD23 LEU 100 115.373 4.202 -5.989 743 H ASN 101 H ASN 101 118.182 5.676 -9.993 744 HA ASN 101 HA ASN 101 118.068 2.900 -11.062 745 HB2 ASN 101 HB2 ASN 101 117.563 3.833 -13.229 746 HB3 ASN 101 HB3 ASN 101 116.413 4.444 -12.049 747 HD21 ASN 101 HD21 ASN 101 116.339 6.085 -14.053 748 HD22 ASN 101 HD22 ASN 101 117.337 7.448 -13.887 749 H ASP 102 H ASP 102 119.515 2.540 -12.963 750 HA ASP 102 HA ASP 102 122.152 2.613 -12.117 751 HB2 ASP 102 HB2 ASP 102 121.047 2.335 -14.915 752 HB3 ASP 102 HB3 ASP 102 122.721 2.013 -14.475 753 H ARG 103 H ARG 103 120.403 4.971 -14.054 754 HA ARG 103 HA ARG 103 122.611 6.316 -15.187 755 HB2 ARG 103 HB2 ARG 103 119.822 7.252 -14.473 756 HB3 ARG 103 HB3 ARG 103 120.958 8.175 -15.462 757 HG2 ARG 103 HG2 ARG 103 121.041 6.429 -17.127 758 HG3 ARG 103 HG3 ARG 103 120.100 5.342 -16.106 759 HD2 ARG 103 HD2 ARG 103 118.639 6.308 -17.794 760 HD3 ARG 103 HD3 ARG 103 118.198 6.946 -16.213 761 HE ARG 103 HE ARG 103 118.921 9.041 -16.896 762 HH11 ARG 103 HH11 ARG 103 119.979 6.682 -19.267 763 HH12 ARG 103 HH12 ARG 103 120.485 7.901 -20.388 764 HH21 ARG 103 HH21 ARG 103 119.573 10.537 -18.331 765 HH22 ARG 103 HH22 ARG 103 120.257 10.088 -19.862 766 H ALA 104 H ALA 104 120.697 7.047 -12.268 767 HA ALA 104 HA ALA 104 122.209 9.216 -11.352 768 HB1 ALA 104 HB1 ALA 104 121.376 8.320 -9.034 769 HB2 ALA 104 HB2 ALA 104 120.445 7.192 -10.019 770 HB3 ALA 104 HB3 ALA 104 120.209 8.930 -10.207 771 H GLU 105 H GLU 105 122.683 5.733 -10.885 772 HA GLU 105 HA GLU 105 124.791 5.876 -9.026 773 HB2 GLU 105 HB2 GLU 105 123.516 3.803 -9.745 774 HB3 GLU 105 HB3 GLU 105 124.526 3.787 -11.193 775 HG2 GLU 105 HG2 GLU 105 126.549 3.769 -9.738 776 HG3 GLU 105 HG3 GLU 105 125.500 3.674 -8.328 777 H LYS 106 H LYS 106 124.812 5.871 -12.577 778 HA LYS 106 HA LYS 106 127.575 5.993 -13.000 779 HB2 LYS 106 HB2 LYS 106 125.753 5.709 -14.742 780 HB3 LYS 106 HB3 LYS 106 125.526 7.457 -14.663 781 HG2 LYS 106 HG2 LYS 106 128.075 7.613 -15.059 782 HG3 LYS 106 HG3 LYS 106 127.964 5.926 -15.561 783 HD2 LYS 106 HD2 LYS 106 126.219 8.109 -16.724 784 HD3 LYS 106 HD3 LYS 106 127.753 7.615 -17.443 785 HE2 LYS 106 HE2 LYS 106 126.736 5.200 -17.283 786 HE3 LYS 106 HE3 LYS 106 125.198 6.056 -17.189 787 HZ1 LYS 106 HZ1 LYS 106 125.774 7.219 -19.238 788 HZ2 LYS 106 HZ2 LYS 106 125.747 5.536 -19.470 789 HZ3 LYS 106 HZ3 LYS 106 127.230 6.353 -19.334 790 H ALA 107 H ALA 107 125.296 8.508 -12.112 791 HA ALA 107 HA ALA 107 127.132 10.693 -12.459 792 HB1 ALA 107 HB1 ALA 107 124.743 10.910 -10.687 793 HB2 ALA 107 HB2 ALA 107 124.494 10.640 -12.412 794 HB3 ALA 107 HB3 ALA 107 125.384 12.059 -11.861 795 H GLY 108 H GLY 108 127.517 8.308 -10.361 796 HA2 GLY 108 HA2 GLY 108 128.877 8.142 -8.544 797 HA3 GLY 108 HA3 GLY 108 129.113 9.877 -8.596 798 H HIS 109 H HIS 109 125.834 8.680 -8.358 799 HA HIS 109 HA HIS 109 125.746 9.398 -5.520 800 HB2 HIS 109 HB2 HIS 109 123.624 8.747 -7.553 801 HB3 HIS 109 HB3 HIS 109 123.274 8.981 -5.851 802 HD1 HIS 109 HD1 HIS 109 124.507 11.447 -4.997 803 HD2 HIS 109 HD2 HIS 109 123.175 11.065 -8.928 804 HE1 HIS 109 HE1 HIS 109 124.210 13.799 -5.882 805 HA PRO 110 HA PRO 110 126.419 4.894 -4.911 806 HB2 PRO 110 HB2 PRO 110 125.596 5.521 -2.113 807 HB3 PRO 110 HB3 PRO 110 127.016 4.634 -2.701 808 HG2 PRO 110 HG2 PRO 110 127.222 7.109 -1.762 809 HG3 PRO 110 HG3 PRO 110 128.208 6.547 -3.124 810 HD2 PRO 110 HD2 PRO 110 125.834 8.360 -3.148 811 HD3 PRO 110 HD3 PRO 110 127.269 8.363 -4.196 812 HA PRO 111 HA PRO 111 122.187 3.614 -5.206 813 HB2 PRO 111 HB2 PRO 111 122.315 0.957 -4.536 814 HB3 PRO 111 HB3 PRO 111 122.847 1.608 -6.097 815 HG2 PRO 111 HG2 PRO 111 124.455 0.797 -3.745 816 HG3 PRO 111 HG3 PRO 111 124.815 0.645 -5.472 817 HD2 PRO 111 HD2 PRO 111 125.906 2.587 -3.861 818 HD3 PRO 111 HD3 PRO 111 125.695 2.761 -5.615 819 H ILE 112 H ILE 112 120.307 2.937 -3.986 820 HA ILE 112 HA ILE 112 120.278 3.834 -1.317 821 HB ILE 112 HB ILE 112 118.234 2.101 -2.730 822 HG12 ILE 112 HG12 ILE 112 118.323 5.107 -2.370 823 HG13 ILE 112 HG13 ILE 112 118.854 4.293 -3.839 824 HG21 ILE 112 HG21 ILE 112 118.142 3.793 -0.216 825 HG22 ILE 112 HG22 ILE 112 117.786 2.073 -0.362 826 HG23 ILE 112 HG23 ILE 112 116.686 3.259 -1.054 827 HD11 ILE 112 HD11 ILE 112 116.477 5.150 -3.912 828 HD12 ILE 112 HD12 ILE 112 116.077 3.976 -2.661 829 HD13 ILE 112 HD13 ILE 112 116.637 3.425 -4.242 830 H THR 113 H THR 113 121.496 0.870 -2.442 831 HA THR 113 HA THR 113 120.395 -1.049 -0.882 832 HB THR 113 HB THR 113 122.137 -1.350 -2.657 833 HG1 THR 113 HG1 THR 113 122.431 -2.780 -0.296 834 HG21 THR 113 HG21 THR 113 123.985 -0.033 -1.879 835 HG22 THR 113 HG22 THR 113 124.467 -1.720 -1.751 836 HG23 THR 113 HG23 THR 113 123.982 -0.835 -0.309 837 HA PRO 114 HA PRO 114 123.458 -0.282 2.791 838 HB2 PRO 114 HB2 PRO 114 123.204 2.656 3.129 839 HB3 PRO 114 HB3 PRO 114 124.629 1.614 3.315 840 HG2 PRO 114 HG2 PRO 114 124.389 3.229 1.231 841 HG3 PRO 114 HG3 PRO 114 125.087 1.606 1.057 842 HD2 PRO 114 HD2 PRO 114 122.320 2.545 0.362 843 HD3 PRO 114 HD3 PRO 114 123.398 1.480 -0.560 844 H ILE 115 H ILE 115 120.633 1.744 2.161 845 HA ILE 115 HA ILE 115 119.661 1.286 4.896 846 HB ILE 115 HB ILE 115 117.837 2.897 4.240 847 HG12 ILE 115 HG12 ILE 115 119.688 3.534 1.929 848 HG13 ILE 115 HG13 ILE 115 118.208 2.595 1.750 849 HG21 ILE 115 HG21 ILE 115 120.164 3.350 5.405 850 HG22 ILE 115 HG22 ILE 115 119.114 4.684 4.933 851 HG23 ILE 115 HG23 ILE 115 120.488 4.243 3.918 852 HD11 ILE 115 HD11 ILE 115 118.264 5.269 1.433 853 HD12 ILE 115 HD12 ILE 115 117.961 5.211 3.168 854 HD13 ILE 115 HD13 ILE 115 116.849 4.421 2.053 855 H ARG 116 H ARG 116 119.489 -0.523 2.218 856 HA ARG 116 HA ARG 116 116.655 -0.944 1.994 857 HB2 ARG 116 HB2 ARG 116 118.275 -1.350 0.144 858 HB3 ARG 116 HB3 ARG 116 118.940 -2.699 1.062 859 HG2 ARG 116 HG2 ARG 116 116.811 -3.863 1.002 860 HG3 ARG 116 HG3 ARG 116 116.031 -2.475 0.241 861 HD2 ARG 116 HD2 ARG 116 116.540 -4.080 -1.495 862 HD3 ARG 116 HD3 ARG 116 117.630 -2.710 -1.680 863 HE ARG 116 HE ARG 116 118.951 -4.535 -0.060 864 HH11 ARG 116 HH11 ARG 116 117.690 -4.522 -3.337 865 HH12 ARG 116 HH12 ARG 116 118.870 -5.657 -3.902 866 HH21 ARG 116 HH21 ARG 116 120.445 -5.993 -0.845 867 HH22 ARG 116 HH22 ARG 116 120.410 -6.478 -2.508 868 H ALA 117 H ALA 117 115.401 -2.490 2.962 869 HA ALA 117 HA ALA 117 116.474 -3.642 5.401 870 HB1 ALA 117 HB1 ALA 117 113.671 -3.954 4.345 871 HB2 ALA 117 HB2 ALA 117 114.206 -2.473 5.141 872 HB3 ALA 117 HB3 ALA 117 114.221 -4.002 6.020 873 H LYS 118 H LYS 118 116.350 -5.837 5.971 874 HA LYS 118 HA LYS 118 116.588 -7.721 3.769 875 HB2 LYS 118 HB2 LYS 118 116.735 -8.079 6.775 876 HB3 LYS 118 HB3 LYS 118 117.018 -9.361 5.597 877 HG2 LYS 118 HG2 LYS 118 118.902 -8.164 4.655 878 HG3 LYS 118 HG3 LYS 118 118.568 -6.757 5.663 879 HD2 LYS 118 HD2 LYS 118 120.334 -7.897 6.770 880 HD3 LYS 118 HD3 LYS 118 118.881 -8.317 7.675 881 HE2 LYS 118 HE2 LYS 118 118.834 -10.344 5.921 882 HE3 LYS 118 HE3 LYS 118 120.566 -10.020 5.896 883 HZ1 LYS 118 HZ1 LYS 118 120.461 -10.091 8.383 884 HZ2 LYS 118 HZ2 LYS 118 120.193 -11.576 7.602 885 HZ3 LYS 118 HZ3 LYS 118 118.884 -10.699 8.236 886 H GLY 119 H GLY 119 115.205 -9.512 3.437 887 HA2 GLY 119 HA2 GLY 119 112.460 -9.046 4.381 888 HA3 GLY 119 HA3 GLY 119 112.907 -10.019 2.996 889 H SER 120 H SER 120 111.145 -11.112 4.710 890 HA SER 120 HA SER 120 112.115 -12.500 6.939 891 HB2 SER 120 HB2 SER 120 109.943 -13.393 5.030 892 HB3 SER 120 HB3 SER 120 110.169 -13.940 6.688 893 HG SER 120 HG SER 120 108.668 -12.158 6.305 894 H GLY 121 H GLY 121 112.142 -13.365 3.509 895 HA2 GLY 121 HA2 GLY 121 114.099 -15.476 4.123 896 HA3 GLY 121 HA3 GLY 121 112.686 -15.882 3.152 897 H GLY 122 H GLY 122 114.902 -16.383 1.871 898 HA2 GLY 122 HA2 GLY 122 115.988 -15.975 -0.120 899 HA3 GLY 122 HA3 GLY 122 114.865 -14.645 -0.380 900 H GLY 123 H GLY 123 115.811 -12.729 -0.560 901 HA2 GLY 123 HA2 GLY 123 118.347 -12.236 0.901 902 HA3 GLY 123 HA3 GLY 123 118.047 -11.654 -0.732 903 H TYR 124 H TYR 124 117.552 -9.579 -0.843 904 HA TYR 124 HA TYR 124 116.430 -8.252 1.543 905 HB2 TYR 124 HB2 TYR 124 118.158 -7.318 -0.724 906 HB3 TYR 124 HB3 TYR 124 117.252 -6.174 0.249 907 HD1 TYR 124 HD1 TYR 124 119.114 -9.304 1.132 908 HD2 TYR 124 HD2 TYR 124 118.738 -5.060 1.660 909 HE1 TYR 124 HE1 TYR 124 120.939 -9.352 2.813 910 HE2 TYR 124 HE2 TYR 124 120.553 -5.107 3.349 911 HH TYR 124 HH TYR 124 121.644 -6.708 4.801 912 H ILE 125 H ILE 125 114.989 -6.411 1.133 913 HA ILE 125 HA ILE 125 112.799 -7.330 -0.506 914 HB ILE 125 HB ILE 125 113.110 -4.937 1.326 915 HG12 ILE 125 HG12 ILE 125 111.549 -7.484 1.782 916 HG13 ILE 125 HG13 ILE 125 113.237 -7.339 2.259 917 HG21 ILE 125 HG21 ILE 125 111.319 -4.676 -0.433 918 HG22 ILE 125 HG22 ILE 125 110.707 -4.703 1.219 919 HG23 ILE 125 HG23 ILE 125 110.563 -6.137 0.203 920 HD11 ILE 125 HD11 ILE 125 112.786 -5.811 3.924 921 HD12 ILE 125 HD12 ILE 125 111.283 -6.730 3.947 922 HD13 ILE 125 HD13 ILE 125 111.351 -5.178 3.112 923 H SER 126 H SER 126 112.108 -6.530 -2.390 924 HA SER 126 HA SER 126 113.883 -5.082 -4.044 925 HB2 SER 126 HB2 SER 126 110.934 -5.631 -4.415 926 HB3 SER 126 HB3 SER 126 112.048 -5.099 -5.670 927 HG SER 126 HG SER 126 112.646 -7.090 -5.800 928 H LEU 127 H LEU 127 114.055 -3.022 -4.604 929 HA LEU 127 HA LEU 127 112.339 -1.022 -3.328 930 HB2 LEU 127 HB2 LEU 127 114.718 -0.629 -5.155 931 HB3 LEU 127 HB3 LEU 127 113.920 0.610 -4.191 932 HG LEU 127 HG LEU 127 115.323 -1.835 -3.066 933 HD11 LEU 127 HD11 LEU 127 116.140 1.062 -3.368 934 HD12 LEU 127 HD12 LEU 127 117.007 -0.374 -3.914 935 HD13 LEU 127 HD13 LEU 127 116.899 -0.012 -2.191 936 HD21 LEU 127 HD21 LEU 127 113.623 -1.192 -1.530 937 HD22 LEU 127 HD22 LEU 127 113.894 0.525 -1.828 938 HD23 LEU 127 HD23 LEU 127 115.089 -0.413 -0.931 939 H GLY 128 H GLY 128 111.758 -2.871 -5.895 940 HA2 GLY 128 HA2 GLY 128 111.637 -1.393 -8.198 941 HA3 GLY 128 HA3 GLY 128 110.470 -2.644 -7.794 942 H ALA 129 H ALA 129 109.133 -1.427 -5.639 943 HA ALA 129 HA ALA 129 107.218 0.079 -7.045 944 HB1 ALA 129 HB1 ALA 129 106.742 -1.162 -4.956 945 HB2 ALA 129 HB2 ALA 129 106.211 0.516 -4.863 946 HB3 ALA 129 HB3 ALA 129 107.696 0.016 -4.056 947 H LEU 130 H LEU 130 109.741 1.138 -4.771 948 HA LEU 130 HA LEU 130 109.116 3.878 -4.790 949 HB2 LEU 130 HB2 LEU 130 110.651 2.781 -3.177 950 HB3 LEU 130 HB3 LEU 130 111.832 2.576 -4.469 951 HG LEU 130 HG LEU 130 111.766 5.083 -4.801 952 HD11 LEU 130 HD11 LEU 130 110.918 6.346 -2.760 953 HD12 LEU 130 HD12 LEU 130 110.112 4.853 -2.275 954 HD13 LEU 130 HD13 LEU 130 109.667 5.646 -3.787 955 HD21 LEU 130 HD21 LEU 130 113.389 3.664 -3.281 956 HD22 LEU 130 HD22 LEU 130 112.550 4.479 -1.962 957 HD23 LEU 130 HD23 LEU 130 113.410 5.422 -3.176 958 H LEU 131 H LEU 131 111.240 1.955 -6.878 959 HA LEU 131 HA LEU 131 112.361 4.079 -8.341 960 HB2 LEU 131 HB2 LEU 131 113.183 1.730 -8.391 961 HB3 LEU 131 HB3 LEU 131 111.752 1.274 -9.313 962 HG LEU 131 HG LEU 131 112.439 3.034 -11.023 963 HD11 LEU 131 HD11 LEU 131 114.786 3.085 -9.147 964 HD12 LEU 131 HD12 LEU 131 113.964 4.431 -9.934 965 HD13 LEU 131 HD13 LEU 131 115.037 3.387 -10.866 966 HD21 LEU 131 HD21 LEU 131 112.811 0.672 -11.464 967 HD22 LEU 131 HD22 LEU 131 114.260 0.675 -10.459 968 HD23 LEU 131 HD23 LEU 131 114.240 1.567 -11.979 969 H SER 132 H SER 132 109.397 2.199 -8.865 970 HA SER 132 HA SER 132 108.762 3.201 -11.406 971 HB2 SER 132 HB2 SER 132 106.834 2.347 -9.235 972 HB3 SER 132 HB3 SER 132 106.491 2.444 -10.958 973 HG SER 132 HG SER 132 107.867 0.778 -11.259 974 H THR 133 H THR 133 107.923 4.401 -8.168 975 HA THR 133 HA THR 133 106.164 6.437 -9.010 976 HB THR 133 HB THR 133 107.965 6.471 -6.575 977 HG1 THR 133 HG1 THR 133 106.789 4.810 -6.135 978 HG21 THR 133 HG21 THR 133 106.247 7.921 -5.632 979 HG22 THR 133 HG22 THR 133 105.272 7.763 -7.093 980 HG23 THR 133 HG23 THR 133 106.816 8.611 -7.151 981 H THR 134 H THR 134 109.663 6.519 -8.353 982 HA THR 134 HA THR 134 109.965 9.290 -8.831 983 HB THR 134 HB THR 134 112.062 7.141 -9.193 984 HG1 THR 134 HG1 THR 134 111.530 6.943 -7.163 985 HG21 THR 134 HG21 THR 134 113.625 8.945 -8.727 986 HG22 THR 134 HG22 THR 134 112.299 10.072 -8.443 987 HG23 THR 134 HG23 THR 134 112.586 9.437 -10.063 988 H LEU 135 H LEU 135 110.197 6.494 -11.006 989 HA LEU 135 HA LEU 135 111.166 7.850 -13.267 990 HB2 LEU 135 HB2 LEU 135 109.382 5.417 -13.048 991 HB3 LEU 135 HB3 LEU 135 110.096 5.982 -14.558 992 HG LEU 135 HG LEU 135 111.735 5.348 -12.093 993 HD11 LEU 135 HD11 LEU 135 112.294 3.225 -13.212 994 HD12 LEU 135 HD12 LEU 135 111.179 3.615 -14.521 995 HD13 LEU 135 HD13 LEU 135 110.562 3.319 -12.896 996 HD21 LEU 135 HD21 LEU 135 113.470 5.104 -14.028 997 HD22 LEU 135 HD22 LEU 135 113.013 6.725 -13.506 998 HD23 LEU 135 HD23 LEU 135 112.306 6.036 -14.968 999 H ASN 136 H ASN 136 107.853 7.380 -12.079 1000 HA ASN 136 HA ASN 136 106.478 8.495 -14.253 1001 HB2 ASN 136 HB2 ASN 136 105.479 7.316 -12.245 1002 HB3 ASN 136 HB3 ASN 136 105.698 8.820 -11.352 1003 HD21 ASN 136 HD21 ASN 136 103.891 10.154 -11.396 1004 HD22 ASN 136 HD22 ASN 136 102.733 10.186 -12.637 1005 H LEU 137 H LEU 137 107.867 10.024 -11.374 1006 HA LEU 137 HA LEU 137 107.074 12.668 -11.932 1007 HB2 LEU 137 HB2 LEU 137 109.565 11.726 -10.492 1008 HB3 LEU 137 HB3 LEU 137 108.858 13.337 -10.389 1009 HG LEU 137 HG LEU 137 107.437 10.780 -9.591 1010 HD11 LEU 137 HD11 LEU 137 109.037 11.048 -7.910 1011 HD12 LEU 137 HD12 LEU 137 107.698 12.003 -7.274 1012 HD13 LEU 137 HD13 LEU 137 109.054 12.804 -8.067 1013 HD21 LEU 137 HD21 LEU 137 105.887 12.469 -8.491 1014 HD22 LEU 137 HD22 LEU 137 105.838 12.454 -10.252 1015 HD23 LEU 137 HD23 LEU 137 106.727 13.721 -9.405 1016 H CYS 138 H CYS 138 109.940 10.847 -12.930 1017 HA CYS 138 HA CYS 138 111.346 12.919 -14.181 1018 HB2 CYS 138 HB2 CYS 138 111.247 9.949 -14.543 1019 HB3 CYS 138 HB3 CYS 138 112.152 10.927 -15.692 1020 H GLY 139 H GLY 139 108.484 11.206 -15.262 1021 HA2 GLY 139 HA2 GLY 139 107.037 11.853 -16.965 1022 HA3 GLY 139 HA3 GLY 139 108.212 13.053 -17.476 1023 H LYS 140 H LYS 140 109.281 9.754 -17.088 1024 HA LYS 140 HA LYS 140 109.619 9.573 -20.005 1025 HB2 LYS 140 HB2 LYS 140 110.874 8.002 -17.741 1026 HB3 LYS 140 HB3 LYS 140 111.199 7.729 -19.453 1027 HG2 LYS 140 HG2 LYS 140 111.941 10.101 -19.655 1028 HG3 LYS 140 HG3 LYS 140 111.720 10.289 -17.915 1029 HD2 LYS 140 HD2 LYS 140 113.335 8.417 -17.551 1030 HD3 LYS 140 HD3 LYS 140 113.622 8.372 -19.292 1031 HE2 LYS 140 HE2 LYS 140 115.362 9.738 -18.428 1032 HE3 LYS 140 HE3 LYS 140 114.189 10.870 -19.097 1033 HZ1 LYS 140 HZ1 LYS 140 113.984 10.054 -16.280 1034 HZ2 LYS 140 HZ2 LYS 140 113.459 11.487 -17.025 1035 HZ3 LYS 140 HZ3 LYS 140 115.113 11.239 -16.725 1036 H GLY 141 H GLY 141 108.823 7.871 -21.199 1037 HA2 GLY 141 HA2 GLY 141 107.387 5.702 -19.888 1038 HA3 GLY 141 HA3 GLY 141 106.397 6.804 -20.840 Start of MODEL 19 1 H1 HIS -5 HT1 HIS -5 55.003 -6.766 8.660 2 H2 HIS -5 HT2 HIS -5 54.307 -7.559 9.991 3 H3 HIS -5 HT3 HIS -5 53.923 -8.051 8.411 4 HA HIS -5 HA HIS -5 56.519 -8.347 9.813 5 HB2 HIS -5 HB2 HIS -5 54.540 -10.307 8.629 6 HB3 HIS -5 HB3 HIS -5 56.106 -10.747 9.283 7 HD1 HIS -5 HD1 HIS -5 52.649 -9.733 10.275 8 HD2 HIS -5 HD2 HIS -5 56.255 -10.671 12.144 9 HE1 HIS -5 HE1 HIS -5 52.122 -10.044 12.731 10 H HIS -4 H HIS -4 58.281 -8.953 8.563 11 HA HIS -4 HA HIS -4 57.942 -8.779 5.622 12 HB2 HIS -4 HB2 HIS -4 59.000 -6.752 6.596 13 HB3 HIS -4 HB3 HIS -4 60.271 -7.764 7.256 14 HD1 HIS -4 HD1 HIS -4 58.736 -7.084 3.823 15 HD2 HIS -4 HD2 HIS -4 62.438 -7.885 5.566 16 HE1 HIS -4 HE1 HIS -4 60.443 -6.980 1.957 17 H HIS -3 H HIS -3 58.911 -10.334 4.438 18 HA HIS -3 HA HIS -3 60.698 -12.242 5.834 19 HB2 HIS -3 HB2 HIS -3 58.421 -13.168 5.547 20 HB3 HIS -3 HB3 HIS -3 58.548 -12.906 3.818 21 HD1 HIS -3 HD1 HIS -3 60.527 -14.747 6.521 22 HD2 HIS -3 HD2 HIS -3 59.429 -15.167 2.521 23 HE1 HIS -3 HE1 HIS -3 61.425 -16.989 5.764 24 H HIS -2 H HIS -2 62.369 -13.102 4.634 25 HA HIS -2 HA HIS -2 62.864 -11.816 2.012 26 HB2 HIS -2 HB2 HIS -2 64.829 -12.862 4.054 27 HB3 HIS -2 HB3 HIS -2 65.254 -12.177 2.497 28 HD1 HIS -2 HD1 HIS -2 64.451 -9.568 2.187 29 HD2 HIS -2 HD2 HIS -2 64.681 -11.014 6.091 30 HE1 HIS -2 HE1 HIS -2 64.521 -7.539 3.699 31 H HIS -1 H HIS -1 63.462 -13.064 0.288 32 HA HIS -1 HA HIS -1 63.290 -15.995 0.667 33 HB2 HIS -1 HB2 HIS -1 62.765 -14.311 -1.786 34 HB3 HIS -1 HB3 HIS -1 62.680 -16.061 -1.725 35 HD1 HIS -1 HD1 HIS -1 60.812 -17.006 0.062 36 HD2 HIS -1 HD2 HIS -1 60.384 -13.056 -1.203 37 HE1 HIS -1 HE1 HIS -1 58.428 -16.340 0.589 38 H HIS 0 H HIS 0 64.945 -17.267 0.046 39 HA HIS 0 HA HIS 0 67.182 -16.042 -1.454 40 HB2 HIS 0 HB2 HIS 0 67.368 -17.809 0.987 41 HB3 HIS 0 HB3 HIS 0 68.728 -17.351 -0.019 42 HD1 HIS 0 HD1 HIS 0 66.396 -16.057 2.598 43 HD2 HIS 0 HD2 HIS 0 69.576 -14.633 0.309 44 HE1 HIS 0 HE1 HIS 0 67.082 -13.846 3.622 45 H SER 1 H SER 1 68.417 -17.491 -2.713 46 HA SER 1 HA SER 1 67.112 -20.104 -3.234 47 HB2 SER 1 HB2 SER 1 68.532 -18.291 -5.201 48 HB3 SER 1 HB3 SER 1 67.820 -19.857 -5.569 49 HG SER 1 HG SER 1 66.638 -17.526 -5.462 50 H SER 2 H SER 2 68.444 -21.869 -3.653 51 HA SER 2 HA SER 2 71.314 -21.492 -3.002 52 HB2 SER 2 HB2 SER 2 69.540 -23.859 -2.350 53 HB3 SER 2 HB3 SER 2 71.254 -23.720 -1.980 54 HG SER 2 HG SER 2 69.113 -22.319 -0.924 55 H GLY 3 H GLY 3 72.811 -22.695 -4.156 56 HA2 GLY 3 HA2 GLY 3 72.275 -24.780 -5.946 57 HA3 GLY 3 HA3 GLY 3 72.201 -23.273 -6.854 58 H LEU 4 H LEU 4 74.078 -24.629 -7.860 59 HA LEU 4 HA LEU 4 76.604 -24.160 -6.422 60 HB2 LEU 4 HB2 LEU 4 76.156 -26.419 -7.387 61 HB3 LEU 4 HB3 LEU 4 76.123 -25.687 -8.991 62 HG LEU 4 HG LEU 4 78.445 -24.777 -8.499 63 HD11 LEU 4 HD11 LEU 4 78.556 -24.925 -6.121 64 HD12 LEU 4 HD12 LEU 4 79.660 -26.164 -6.718 65 HD13 LEU 4 HD13 LEU 4 78.060 -26.618 -6.131 66 HD21 LEU 4 HD21 LEU 4 78.078 -26.751 -9.929 67 HD22 LEU 4 HD22 LEU 4 78.065 -27.788 -8.502 68 HD23 LEU 4 HD23 LEU 4 79.543 -26.947 -8.966 69 H VAL 5 H VAL 5 77.930 -22.548 -6.979 70 HA VAL 5 HA VAL 5 77.154 -20.637 -8.935 71 HB VAL 5 HB VAL 5 79.793 -20.948 -7.479 72 HG11 VAL 5 HG11 VAL 5 79.830 -19.472 -9.517 73 HG12 VAL 5 HG12 VAL 5 80.165 -18.616 -8.012 74 HG13 VAL 5 HG13 VAL 5 78.575 -18.489 -8.762 75 HG21 VAL 5 HG21 VAL 5 77.431 -19.167 -6.821 76 HG22 VAL 5 HG22 VAL 5 78.887 -19.405 -5.855 77 HG23 VAL 5 HG23 VAL 5 77.726 -20.720 -6.040 78 HA PRO 6 HA PRO 6 79.467 -22.625 -12.247 79 HB2 PRO 6 HB2 PRO 6 79.044 -20.869 -14.248 80 HB3 PRO 6 HB3 PRO 6 77.728 -21.858 -13.585 81 HG2 PRO 6 HG2 PRO 6 78.288 -18.990 -13.228 82 HG3 PRO 6 HG3 PRO 6 76.749 -19.861 -13.173 83 HD2 PRO 6 HD2 PRO 6 78.318 -19.013 -10.951 84 HD3 PRO 6 HD3 PRO 6 76.851 -20.014 -10.913 85 H ARG 7 H ARG 7 81.532 -22.590 -13.097 86 HA ARG 7 HA ARG 7 83.445 -20.808 -12.047 87 HB2 ARG 7 HB2 ARG 7 83.608 -22.637 -14.456 88 HB3 ARG 7 HB3 ARG 7 84.988 -21.838 -13.700 89 HG2 ARG 7 HG2 ARG 7 84.467 -22.973 -11.564 90 HG3 ARG 7 HG3 ARG 7 83.115 -23.797 -12.341 91 HD2 ARG 7 HD2 ARG 7 84.982 -25.318 -12.358 92 HD3 ARG 7 HD3 ARG 7 84.755 -24.742 -14.006 93 HE ARG 7 HE ARG 7 86.764 -23.558 -13.842 94 HH11 ARG 7 HH11 ARG 7 85.941 -24.912 -10.709 95 HH12 ARG 7 HH12 ARG 7 87.504 -24.578 -10.043 96 HH21 ARG 7 HH21 ARG 7 88.758 -23.154 -12.929 97 HH22 ARG 7 HH22 ARG 7 89.078 -23.594 -11.285 98 H GLY 8 H GLY 8 84.505 -19.046 -12.912 99 HA2 GLY 8 HA2 GLY 8 84.486 -18.078 -15.492 100 HA3 GLY 8 HA3 GLY 8 83.020 -17.436 -14.756 101 H SER 9 H SER 9 84.323 -15.413 -15.335 102 HA SER 9 HA SER 9 86.088 -14.676 -13.068 103 HB2 SER 9 HB2 SER 9 87.161 -13.079 -14.561 104 HB3 SER 9 HB3 SER 9 87.221 -14.686 -15.278 105 HG SER 9 HG SER 9 86.077 -13.893 -16.828 106 H GLY 10 H GLY 10 85.878 -12.527 -12.251 107 HA2 GLY 10 HA2 GLY 10 83.122 -11.620 -12.221 108 HA3 GLY 10 HA3 GLY 10 84.441 -10.996 -11.236 109 H MET 11 H MET 11 83.027 -9.035 -12.050 110 HA MET 11 HA MET 11 84.422 -7.906 -14.405 111 HB2 MET 11 HB2 MET 11 81.503 -7.572 -13.669 112 HB3 MET 11 HB3 MET 11 82.329 -6.705 -14.964 113 HG2 MET 11 HG2 MET 11 82.925 -8.930 -15.978 114 HG3 MET 11 HG3 MET 11 81.901 -9.697 -14.765 115 HE1 MET 11 HE1 MET 11 82.323 -7.541 -17.752 116 HE2 MET 11 HE2 MET 11 81.466 -6.284 -16.862 117 HE3 MET 11 HE3 MET 11 80.714 -7.025 -18.273 118 H LYS 12 H LYS 12 84.472 -5.531 -14.407 119 HA LYS 12 HA LYS 12 85.014 -4.537 -11.719 120 HB2 LYS 12 HB2 LYS 12 85.443 -3.307 -14.452 121 HB3 LYS 12 HB3 LYS 12 85.926 -2.560 -12.928 122 HG2 LYS 12 HG2 LYS 12 87.316 -4.569 -12.424 123 HG3 LYS 12 HG3 LYS 12 86.903 -5.218 -14.012 124 HD2 LYS 12 HD2 LYS 12 87.865 -3.161 -15.056 125 HD3 LYS 12 HD3 LYS 12 88.380 -2.629 -13.454 126 HE2 LYS 12 HE2 LYS 12 89.203 -5.254 -14.727 127 HE3 LYS 12 HE3 LYS 12 90.195 -3.796 -14.721 128 HZ1 LYS 12 HZ1 LYS 12 89.488 -5.575 -12.509 129 HZ2 LYS 12 HZ2 LYS 12 89.682 -3.923 -12.166 130 HZ3 LYS 12 HZ3 LYS 12 90.960 -4.807 -12.851 131 H GLU 13 H GLU 13 83.985 -2.817 -10.752 132 HA GLU 13 HA GLU 13 81.420 -1.988 -11.980 133 HB2 GLU 13 HB2 GLU 13 80.608 -1.639 -9.687 134 HB3 GLU 13 HB3 GLU 13 81.131 -3.305 -9.931 135 HG2 GLU 13 HG2 GLU 13 83.339 -2.711 -8.921 136 HG3 GLU 13 HG3 GLU 13 82.719 -1.101 -8.586 137 H THR 14 H THR 14 80.682 0.191 -11.437 138 HA THR 14 HA THR 14 82.746 2.123 -11.867 139 HB THR 14 HB THR 14 79.857 2.592 -11.089 140 HG1 THR 14 HG1 THR 14 79.819 1.503 -12.944 141 HG21 THR 14 HG21 THR 14 80.310 4.716 -12.435 142 HG22 THR 14 HG22 THR 14 82.021 4.301 -12.330 143 HG23 THR 14 HG23 THR 14 81.098 4.618 -10.860 144 H ALA 15 H ALA 15 83.716 3.502 -10.464 145 HA ALA 15 HA ALA 15 83.897 2.809 -7.741 146 HB1 ALA 15 HB1 ALA 15 85.618 4.069 -9.093 147 HB2 ALA 15 HB2 ALA 15 85.288 4.747 -7.498 148 HB3 ALA 15 HB3 ALA 15 84.594 5.497 -8.936 149 H ALA 16 H ALA 16 83.024 3.679 -5.896 150 HA ALA 16 HA ALA 16 80.410 4.768 -6.045 151 HB1 ALA 16 HB1 ALA 16 82.105 5.017 -3.584 152 HB2 ALA 16 HB2 ALA 16 81.599 3.420 -4.136 153 HB3 ALA 16 HB3 ALA 16 80.389 4.635 -3.724 154 H ALA 17 H ALA 17 79.659 6.835 -5.408 155 HA ALA 17 HA ALA 17 81.049 9.023 -6.459 156 HB1 ALA 17 HB1 ALA 17 79.387 10.373 -5.032 157 HB2 ALA 17 HB2 ALA 17 78.746 8.810 -4.526 158 HB3 ALA 17 HB3 ALA 17 78.712 9.267 -6.229 159 H LYS 18 H LYS 18 82.198 10.719 -5.517 160 HA LYS 18 HA LYS 18 83.711 9.956 -3.155 161 HB2 LYS 18 HB2 LYS 18 83.937 12.388 -4.943 162 HB3 LYS 18 HB3 LYS 18 85.082 11.927 -3.683 163 HG2 LYS 18 HG2 LYS 18 85.362 9.714 -4.887 164 HG3 LYS 18 HG3 LYS 18 84.428 10.402 -6.216 165 HD2 LYS 18 HD2 LYS 18 86.972 11.614 -5.098 166 HD3 LYS 18 HD3 LYS 18 86.891 10.626 -6.557 167 HE2 LYS 18 HE2 LYS 18 85.083 12.327 -7.336 168 HE3 LYS 18 HE3 LYS 18 85.747 13.370 -6.079 169 HZ1 LYS 18 HZ1 LYS 18 87.615 12.065 -7.913 170 HZ2 LYS 18 HZ2 LYS 18 87.719 13.582 -7.157 171 HZ3 LYS 18 HZ3 LYS 18 86.708 13.370 -8.507 172 H PHE 19 H PHE 19 83.712 10.987 -1.206 173 HA PHE 19 HA PHE 19 81.671 13.097 -0.787 174 HB2 PHE 19 HB2 PHE 19 82.525 10.887 1.087 175 HB3 PHE 19 HB3 PHE 19 81.423 12.187 1.498 176 HD1 PHE 19 HD1 PHE 19 79.176 12.308 0.430 177 HD2 PHE 19 HD2 PHE 19 81.830 8.991 -0.204 178 HE1 PHE 19 HE1 PHE 19 77.282 10.959 -0.434 179 HE2 PHE 19 HE2 PHE 19 79.936 7.641 -1.068 180 HZ PHE 19 HZ PHE 19 77.662 8.625 -1.183 181 H GLU 20 H GLU 20 82.144 14.610 0.934 182 HA GLU 20 HA GLU 20 84.998 15.236 1.037 183 HB2 GLU 20 HB2 GLU 20 83.296 16.984 0.470 184 HB3 GLU 20 HB3 GLU 20 82.661 16.832 2.109 185 HG2 GLU 20 HG2 GLU 20 84.920 17.383 3.000 186 HG3 GLU 20 HG3 GLU 20 85.487 17.623 1.353 187 H ARG 21 H ARG 21 86.236 15.139 2.829 188 HA ARG 21 HA ARG 21 84.944 14.358 5.380 189 HB2 ARG 21 HB2 ARG 21 87.528 13.310 4.199 190 HB3 ARG 21 HB3 ARG 21 86.936 12.947 5.821 191 HG2 ARG 21 HG2 ARG 21 84.879 11.974 4.846 192 HG3 ARG 21 HG3 ARG 21 85.501 12.302 3.228 193 HD2 ARG 21 HD2 ARG 21 86.003 10.001 3.732 194 HD3 ARG 21 HD3 ARG 21 87.516 10.900 3.807 195 HE ARG 21 HE ARG 21 86.373 10.860 6.379 196 HH11 ARG 21 HH11 ARG 21 87.845 8.613 4.120 197 HH12 ARG 21 HH12 ARG 21 88.407 7.562 5.376 198 HH21 ARG 21 HH21 ARG 21 87.121 9.469 7.954 199 HH22 ARG 21 HH22 ARG 21 88.001 8.041 7.519 200 H GLN 22 H GLN 22 86.013 15.043 7.287 201 HA GLN 22 HA GLN 22 87.169 17.643 7.114 202 HB2 GLN 22 HB2 GLN 22 86.952 15.715 9.439 203 HB3 GLN 22 HB3 GLN 22 87.464 17.398 9.574 204 HG2 GLN 22 HG2 GLN 22 85.320 18.157 8.681 205 HG3 GLN 22 HG3 GLN 22 84.804 16.491 8.439 206 HE21 GLN 22 HE21 GLN 22 83.323 18.291 10.104 207 HE22 GLN 22 HE22 GLN 22 83.438 17.748 11.708 208 H HIS 23 H HIS 23 89.269 18.316 7.589 209 HA HIS 23 HA HIS 23 91.341 16.221 7.286 210 HB2 HIS 23 HB2 HIS 23 91.429 19.151 6.560 211 HB3 HIS 23 HB3 HIS 23 92.755 18.020 6.374 212 HD1 HIS 23 HD1 HIS 23 92.103 15.876 4.731 213 HD2 HIS 23 HD2 HIS 23 89.864 19.369 4.315 214 HE1 HIS 23 HE1 HIS 23 90.976 15.738 2.467 215 H MET 24 H MET 24 93.061 16.171 8.668 216 HA MET 24 HA MET 24 92.957 18.011 10.992 217 HB2 MET 24 HB2 MET 24 93.787 15.104 10.846 218 HB3 MET 24 HB3 MET 24 93.992 16.130 12.267 219 HG2 MET 24 HG2 MET 24 91.538 16.559 12.273 220 HG3 MET 24 HG3 MET 24 91.365 15.441 10.920 221 HE1 MET 24 HE1 MET 24 89.741 13.395 12.445 222 HE2 MET 24 HE2 MET 24 89.657 15.115 12.817 223 HE3 MET 24 HE3 MET 24 89.842 13.945 14.122 224 H ASP 25 H ASP 25 95.066 18.329 12.072 225 HA ASP 25 HA ASP 25 97.012 19.245 10.235 226 HB2 ASP 25 HB2 ASP 25 97.211 18.747 13.213 227 HB3 ASP 25 HB3 ASP 25 98.406 19.621 12.258 228 H SER 26 H SER 26 99.009 18.448 9.662 229 HA SER 26 HA SER 26 99.546 15.613 10.351 230 HB2 SER 26 HB2 SER 26 99.834 17.097 7.742 231 HB3 SER 26 HB3 SER 26 100.707 15.602 8.064 232 HG SER 26 HG SER 26 98.010 16.038 7.762 233 HA PRO 27 HA PRO 27 103.567 16.732 11.749 234 HB2 PRO 27 HB2 PRO 27 104.915 14.907 9.831 235 HB3 PRO 27 HB3 PRO 27 104.953 14.914 11.605 236 HG2 PRO 27 HG2 PRO 27 103.613 13.063 10.240 237 HG3 PRO 27 HG3 PRO 27 103.023 13.695 11.789 238 HD2 PRO 27 HD2 PRO 27 102.073 14.326 9.018 239 HD3 PRO 27 HD3 PRO 27 101.138 14.167 10.523 240 H ASP 28 H ASP 28 104.150 18.759 11.196 241 HA ASP 28 HA ASP 28 104.474 19.667 8.518 242 HB2 ASP 28 HB2 ASP 28 105.366 20.886 11.140 243 HB3 ASP 28 HB3 ASP 28 105.394 21.714 9.585 244 H LEU 29 H LEU 29 106.311 20.087 7.336 245 HA LEU 29 HA LEU 29 108.731 18.663 8.206 246 HB2 LEU 29 HB2 LEU 29 107.669 18.201 5.964 247 HB3 LEU 29 HB3 LEU 29 108.124 19.834 5.485 248 HG LEU 29 HG LEU 29 110.231 18.047 6.656 249 HD11 LEU 29 HD11 LEU 29 109.505 17.993 3.719 250 HD12 LEU 29 HD12 LEU 29 108.947 16.767 4.857 251 HD13 LEU 29 HD13 LEU 29 110.673 16.978 4.564 252 HD21 LEU 29 HD21 LEU 29 111.463 19.345 4.714 253 HD22 LEU 29 HD22 LEU 29 111.075 20.181 6.215 254 HD23 LEU 29 HD23 LEU 29 110.054 20.402 4.796 255 H GLY 30 H GLY 30 110.525 19.719 8.805 256 HA2 GLY 30 HA2 GLY 30 110.575 22.431 9.406 257 HA3 GLY 30 HA3 GLY 30 112.009 21.426 9.230 258 H THR 31 H THR 31 110.103 23.905 7.857 259 HA THR 31 HA THR 31 111.898 24.028 5.504 260 HB THR 31 HB THR 31 108.984 24.849 5.575 261 HG1 THR 31 HG1 THR 31 109.216 22.632 5.588 262 HG21 THR 31 HG21 THR 31 111.062 24.699 3.376 263 HG22 THR 31 HG22 THR 31 110.262 26.148 3.983 264 HG23 THR 31 HG23 THR 31 109.339 24.941 3.088 265 H ASP 32 H ASP 32 112.626 26.063 4.912 266 HA ASP 32 HA ASP 32 112.633 28.044 7.012 267 HB2 ASP 32 HB2 ASP 32 114.629 27.565 5.602 268 HB3 ASP 32 HB3 ASP 32 113.766 28.216 4.209 269 H ASP 33 H ASP 33 111.035 29.448 7.285 270 HA ASP 33 HA ASP 33 109.887 30.826 4.980 271 HB2 ASP 33 HB2 ASP 33 108.490 28.768 5.370 272 HB3 ASP 33 HB3 ASP 33 108.101 29.407 6.966 273 H ASP 34 H ASP 34 108.395 32.598 5.709 274 HA ASP 34 HA ASP 34 109.624 34.268 7.582 275 HB2 ASP 34 HB2 ASP 34 106.769 34.290 6.576 276 HB3 ASP 34 HB3 ASP 34 107.536 35.611 7.455 277 H ASP 35 H ASP 35 108.846 35.030 9.648 278 HA ASP 35 HA ASP 35 108.187 32.855 11.390 279 HB2 ASP 35 HB2 ASP 35 109.683 34.735 12.037 280 HB3 ASP 35 HB3 ASP 35 108.291 35.816 12.006 281 H LYS 36 H LYS 36 106.238 32.118 11.848 282 HA LYS 36 HA LYS 36 103.949 33.971 11.858 283 HB2 LYS 36 HB2 LYS 36 102.570 32.412 10.643 284 HB3 LYS 36 HB3 LYS 36 104.016 32.738 9.695 285 HG2 LYS 36 HG2 LYS 36 105.022 30.628 10.595 286 HG3 LYS 36 HG3 LYS 36 103.493 30.288 11.406 287 HD2 LYS 36 HD2 LYS 36 102.380 30.502 9.120 288 HD3 LYS 36 HD3 LYS 36 104.005 30.482 8.431 289 HE2 LYS 36 HE2 LYS 36 102.997 28.333 10.307 290 HE3 LYS 36 HE3 LYS 36 102.853 28.218 8.552 291 HZ1 LYS 36 HZ1 LYS 36 105.328 28.670 8.518 292 HZ2 LYS 36 HZ2 LYS 36 104.843 27.143 9.080 293 HZ3 LYS 36 HZ3 LYS 36 105.317 28.345 10.183 294 H THR 37 H THR 37 101.938 32.484 12.664 295 HA THR 37 HA THR 37 102.572 31.909 15.394 296 HB THR 37 HB THR 37 100.207 31.335 15.612 297 HG1 THR 37 HG1 THR 37 99.429 30.446 13.909 298 HG21 THR 37 HG21 THR 37 100.746 33.707 15.582 299 HG22 THR 37 HG22 THR 37 99.232 33.454 14.715 300 HG23 THR 37 HG23 THR 37 100.726 33.723 13.819 301 H GLY 38 H GLY 38 101.964 29.834 16.452 302 HA2 GLY 38 HA2 GLY 38 103.323 27.667 15.114 303 HA3 GLY 38 HA3 GLY 38 102.662 27.640 16.746 304 H GLY 39 H GLY 39 102.218 25.390 15.583 305 HA2 GLY 39 HA2 GLY 39 99.804 25.395 13.959 306 HA3 GLY 39 HA3 GLY 39 100.737 23.983 14.445 307 H GLY 40 H GLY 40 98.320 23.361 14.716 308 HA2 GLY 40 HA2 GLY 40 97.080 24.288 17.172 309 HA3 GLY 40 HA3 GLY 40 96.444 23.069 16.072 310 H ARG 41 H ARG 41 95.970 22.025 18.213 311 HA ARG 41 HA ARG 41 97.910 21.061 19.969 312 HB2 ARG 41 HB2 ARG 41 95.279 19.815 19.140 313 HB3 ARG 41 HB3 ARG 41 96.241 19.297 20.526 314 HG2 ARG 41 HG2 ARG 41 96.098 21.621 21.437 315 HG3 ARG 41 HG3 ARG 41 95.022 22.041 20.104 316 HD2 ARG 41 HD2 ARG 41 94.514 19.917 22.207 317 HD3 ARG 41 HD3 ARG 41 93.706 21.477 22.090 318 HE ARG 41 HE ARG 41 93.178 20.405 19.678 319 HH11 ARG 41 HH11 ARG 41 92.870 19.029 22.894 320 HH12 ARG 41 HH12 ARG 41 91.563 17.991 22.432 321 HH21 ARG 41 HH21 ARG 41 91.494 19.045 19.144 322 HH22 ARG 41 HH22 ARG 41 90.795 18.000 20.335 323 H ALA 42 H ALA 42 98.878 18.978 20.183 324 HA ALA 42 HA ALA 42 100.239 18.073 17.930 325 HB1 ALA 42 HB1 ALA 42 101.102 17.584 20.114 326 HB2 ALA 42 HB2 ALA 42 100.747 16.041 19.337 327 HB3 ALA 42 HB3 ALA 42 99.646 16.690 20.552 328 H ASP 43 H ASP 43 100.036 16.274 16.596 329 HA ASP 43 HA ASP 43 97.426 15.669 15.730 330 HB2 ASP 43 HB2 ASP 43 99.983 14.139 15.194 331 HB3 ASP 43 HB3 ASP 43 98.494 14.037 14.255 332 HA PRO 44 HA PRO 44 96.492 12.264 18.418 333 HB2 PRO 44 HB2 PRO 44 94.489 11.032 17.094 334 HB3 PRO 44 HB3 PRO 44 94.293 12.658 17.780 335 HG2 PRO 44 HG2 PRO 44 94.705 11.834 14.968 336 HG3 PRO 44 HG3 PRO 44 93.762 13.179 15.629 337 HD2 PRO 44 HD2 PRO 44 96.334 13.382 14.526 338 HD3 PRO 44 HD3 PRO 44 95.534 14.608 15.530 339 H ALA 45 H ALA 45 95.766 9.723 18.003 340 HA ALA 45 HA ALA 45 98.106 8.334 17.424 341 HB1 ALA 45 HB1 ALA 45 95.271 7.292 17.239 342 HB2 ALA 45 HB2 ALA 45 96.218 7.404 18.721 343 HB3 ALA 45 HB3 ALA 45 96.729 6.317 17.431 344 H HIS 46 H HIS 46 98.633 6.887 15.681 345 HA HIS 46 HA HIS 46 98.460 8.127 13.154 346 HB2 HIS 46 HB2 HIS 46 99.188 5.270 13.810 347 HB3 HIS 46 HB3 HIS 46 99.525 6.092 12.299 348 HD1 HIS 46 HD1 HIS 46 101.095 8.361 12.655 349 HD2 HIS 46 HD2 HIS 46 101.252 5.429 15.613 350 HE1 HIS 46 HE1 HIS 46 103.223 8.777 13.961 351 H ARG 47 H ARG 47 97.459 7.406 11.227 352 HA ARG 47 HA ARG 47 94.986 5.824 11.646 353 HB2 ARG 47 HB2 ARG 47 95.387 8.155 9.754 354 HB3 ARG 47 HB3 ARG 47 93.894 7.249 9.995 355 HG2 ARG 47 HG2 ARG 47 95.311 8.797 12.181 356 HG3 ARG 47 HG3 ARG 47 93.954 9.422 11.246 357 HD2 ARG 47 HD2 ARG 47 92.595 7.460 12.008 358 HD3 ARG 47 HD3 ARG 47 93.938 6.980 13.041 359 HE ARG 47 HE ARG 47 93.189 9.696 13.511 360 HH11 ARG 47 HH11 ARG 47 92.208 6.403 14.235 361 HH12 ARG 47 HH12 ARG 47 91.403 6.860 15.699 362 HH21 ARG 47 HH21 ARG 47 92.138 10.222 15.406 363 HH22 ARG 47 HH22 ARG 47 91.365 8.995 16.353 364 H SER 48 H SER 48 94.113 5.003 9.491 365 HA SER 48 HA SER 48 95.881 3.174 8.367 366 HB2 SER 48 HB2 SER 48 94.164 2.687 6.791 367 HB3 SER 48 HB3 SER 48 93.338 3.184 8.262 368 HG SER 48 HG SER 48 93.822 4.692 5.968 369 HA PRO 49 HA PRO 49 98.484 5.103 5.424 370 HB2 PRO 49 HB2 PRO 49 97.145 3.620 3.199 371 HB3 PRO 49 HB3 PRO 49 98.871 3.752 3.590 372 HG2 PRO 49 HG2 PRO 49 97.500 1.548 4.140 373 HG3 PRO 49 HG3 PRO 49 98.767 2.149 5.226 374 HD2 PRO 49 HD2 PRO 49 95.812 2.219 5.577 375 HD3 PRO 49 HD3 PRO 49 97.094 2.139 6.805 376 H VAL 50 H VAL 50 98.367 7.117 4.629 377 HA VAL 50 HA VAL 50 95.774 8.156 3.787 378 HB VAL 50 HB VAL 50 98.419 9.559 4.267 379 HG11 VAL 50 HG11 VAL 50 97.132 11.621 4.227 380 HG12 VAL 50 HG12 VAL 50 95.634 10.723 3.983 381 HG13 VAL 50 HG13 VAL 50 96.859 10.756 2.715 382 HG21 VAL 50 HG21 VAL 50 97.636 8.684 6.349 383 HG22 VAL 50 HG22 VAL 50 95.965 9.111 5.979 384 HG23 VAL 50 HG23 VAL 50 97.143 10.377 6.324 385 HA PRO 51 HA PRO 51 96.786 7.858 -0.593 386 HB2 PRO 51 HB2 PRO 51 95.646 10.609 -0.827 387 HB3 PRO 51 HB3 PRO 51 95.268 9.147 -1.762 388 HG2 PRO 51 HG2 PRO 51 93.612 10.055 0.104 389 HG3 PRO 51 HG3 PRO 51 93.853 8.318 -0.158 390 HD2 PRO 51 HD2 PRO 51 94.856 10.035 2.061 391 HD3 PRO 51 HD3 PRO 51 94.410 8.316 2.077 392 H LEU 52 H LEU 52 98.170 8.943 -2.212 393 HA LEU 52 HA LEU 52 100.542 9.907 -1.016 394 HB2 LEU 52 HB2 LEU 52 99.568 9.686 -3.850 395 HB3 LEU 52 HB3 LEU 52 101.083 10.511 -3.495 396 HG LEU 52 HG LEU 52 100.461 7.711 -2.526 397 HD11 LEU 52 HD11 LEU 52 102.136 7.114 -4.397 398 HD12 LEU 52 HD12 LEU 52 101.774 8.709 -5.058 399 HD13 LEU 52 HD13 LEU 52 100.490 7.510 -4.893 400 HD21 LEU 52 HD21 LEU 52 102.905 9.488 -2.605 401 HD22 LEU 52 HD22 LEU 52 103.051 7.735 -2.476 402 HD23 LEU 52 HD23 LEU 52 102.208 8.644 -1.221 403 HA PRO 53 HA PRO 53 99.701 14.274 -0.973 404 HB2 PRO 53 HB2 PRO 53 102.186 15.357 -1.163 405 HB3 PRO 53 HB3 PRO 53 101.616 14.536 0.303 406 HG2 PRO 53 HG2 PRO 53 103.423 13.547 -1.834 407 HG3 PRO 53 HG3 PRO 53 103.480 13.273 -0.084 408 HD2 PRO 53 HD2 PRO 53 102.494 11.439 -1.895 409 HD3 PRO 53 HD3 PRO 53 102.034 11.494 -0.181 410 H SER 54 H SER 54 99.429 16.041 -2.370 411 HA SER 54 HA SER 54 99.151 15.471 -5.065 412 HB2 SER 54 HB2 SER 54 98.993 18.004 -5.324 413 HB3 SER 54 HB3 SER 54 97.891 17.266 -4.167 414 HG SER 54 HG SER 54 99.942 18.964 -3.757 415 HA PRO 55 HA PRO 55 103.488 15.758 -6.016 416 HB2 PRO 55 HB2 PRO 55 103.500 15.178 -8.648 417 HB3 PRO 55 HB3 PRO 55 103.076 13.965 -7.423 418 HG2 PRO 55 HG2 PRO 55 101.319 15.501 -9.246 419 HG3 PRO 55 HG3 PRO 55 101.162 13.839 -8.651 420 HD2 PRO 55 HD2 PRO 55 99.788 16.057 -7.634 421 HD3 PRO 55 HD3 PRO 55 99.973 14.491 -6.819 422 H THR 56 H THR 56 104.513 17.691 -5.982 423 HA THR 56 HA THR 56 103.952 19.798 -7.872 424 HB THR 56 HB THR 56 105.957 20.863 -6.974 425 HG1 THR 56 HG1 THR 56 107.211 19.683 -5.540 426 HG21 THR 56 HG21 THR 56 105.308 21.035 -4.650 427 HG22 THR 56 HG22 THR 56 104.484 19.476 -4.720 428 HG23 THR 56 HG23 THR 56 103.842 20.854 -5.615 429 H SER 57 H SER 57 105.625 20.478 -9.524 430 HA SER 57 HA SER 57 105.961 18.365 -11.327 431 HB2 SER 57 HB2 SER 57 107.409 21.021 -11.237 432 HB3 SER 57 HB3 SER 57 107.380 19.930 -12.618 433 HG SER 57 HG SER 57 105.750 21.574 -12.614 434 H ASN 58 H ASN 58 107.343 16.755 -11.399 435 HA ASN 58 HA ASN 58 109.270 15.535 -11.309 436 HB2 ASN 58 HB2 ASN 58 110.588 18.228 -10.934 437 HB3 ASN 58 HB3 ASN 58 111.406 16.727 -11.365 438 HD21 ASN 58 HD21 ASN 58 110.825 19.402 -12.891 439 HD22 ASN 58 HD22 ASN 58 110.228 18.860 -14.385 440 H LYS 59 H LYS 59 107.795 16.318 -8.720 441 HA LYS 59 HA LYS 59 109.830 15.276 -6.927 442 HB2 LYS 59 HB2 LYS 59 110.285 17.710 -6.974 443 HB3 LYS 59 HB3 LYS 59 108.638 18.012 -6.428 444 HG2 LYS 59 HG2 LYS 59 109.094 16.665 -4.387 445 HG3 LYS 59 HG3 LYS 59 110.762 16.458 -4.921 446 HD2 LYS 59 HD2 LYS 59 111.000 18.955 -4.958 447 HD3 LYS 59 HD3 LYS 59 109.386 19.075 -4.255 448 HE2 LYS 59 HE2 LYS 59 110.303 17.466 -2.431 449 HE3 LYS 59 HE3 LYS 59 111.892 17.948 -3.023 450 HZ1 LYS 59 HZ1 LYS 59 111.265 20.266 -2.662 451 HZ2 LYS 59 HZ2 LYS 59 111.200 19.370 -1.220 452 HZ3 LYS 59 HZ3 LYS 59 109.767 19.773 -2.039 453 H GLN 60 H GLN 60 108.971 14.124 -5.284 454 HA GLN 60 HA GLN 60 106.362 14.877 -4.200 455 HB2 GLN 60 HB2 GLN 60 106.971 12.116 -5.252 456 HB3 GLN 60 HB3 GLN 60 105.709 12.425 -4.062 457 HG2 GLN 60 HG2 GLN 60 104.727 14.104 -5.665 458 HG3 GLN 60 HG3 GLN 60 105.898 13.549 -6.861 459 HE21 GLN 60 HE21 GLN 60 102.855 12.754 -5.282 460 HE22 GLN 60 HE22 GLN 60 102.610 11.294 -6.112 461 H ASP 61 H ASP 61 106.125 14.427 -2.028 462 HA ASP 61 HA ASP 61 108.483 13.386 -0.628 463 HB2 ASP 61 HB2 ASP 61 105.919 14.623 0.411 464 HB3 ASP 61 HB3 ASP 61 107.273 14.114 1.415 465 H ILE 62 H ILE 62 108.571 11.320 0.102 466 HA ILE 62 HA ILE 62 106.039 9.778 0.188 467 HB ILE 62 HB ILE 62 107.402 9.381 -1.878 468 HG12 ILE 62 HG12 ILE 62 107.467 6.801 -1.431 469 HG13 ILE 62 HG13 ILE 62 106.739 7.236 0.115 470 HG21 ILE 62 HG21 ILE 62 109.653 9.580 -1.038 471 HG22 ILE 62 HG22 ILE 62 109.427 7.926 -1.607 472 HG23 ILE 62 HG23 ILE 62 109.389 8.277 0.120 473 HD11 ILE 62 HD11 ILE 62 105.131 8.689 -1.422 474 HD12 ILE 62 HD12 ILE 62 104.827 6.971 -1.182 475 HD13 ILE 62 HD13 ILE 62 105.625 7.526 -2.652 476 H SER 63 H SER 63 105.926 8.101 1.775 477 HA SER 63 HA SER 63 108.083 7.987 3.729 478 HB2 SER 63 HB2 SER 63 106.843 8.873 5.574 479 HB3 SER 63 HB3 SER 63 106.763 10.056 4.274 480 HG SER 63 HG SER 63 104.787 8.851 5.470 481 H GLU 64 H GLU 64 107.738 6.450 5.426 482 HA GLU 64 HA GLU 64 106.729 4.008 4.589 483 HB2 GLU 64 HB2 GLU 64 107.002 3.282 6.917 484 HB3 GLU 64 HB3 GLU 64 108.376 4.248 6.385 485 HG2 GLU 64 HG2 GLU 64 107.361 6.243 7.451 486 HG3 GLU 64 HG3 GLU 64 106.046 5.237 8.047 487 H ALA 65 H ALA 65 105.105 6.600 6.352 488 HA ALA 65 HA ALA 65 102.948 5.141 7.388 489 HB1 ALA 65 HB1 ALA 65 103.078 7.292 8.241 490 HB2 ALA 65 HB2 ALA 65 101.756 7.468 7.087 491 HB3 ALA 65 HB3 ALA 65 103.378 8.014 6.661 492 H ASN 66 H ASN 66 103.338 6.735 4.232 493 HA ASN 66 HA ASN 66 100.649 6.261 3.398 494 HB2 ASN 66 HB2 ASN 66 103.063 6.765 1.646 495 HB3 ASN 66 HB3 ASN 66 101.368 7.001 1.222 496 HD21 ASN 66 HD21 ASN 66 100.191 8.749 2.421 497 HD22 ASN 66 HD22 ASN 66 101.067 10.061 3.045 498 H LEU 67 H LEU 67 103.739 4.632 2.698 499 HA LEU 67 HA LEU 67 102.554 2.746 0.912 500 HB2 LEU 67 HB2 LEU 67 105.246 2.946 2.227 501 HB3 LEU 67 HB3 LEU 67 104.798 1.534 1.267 502 HG LEU 67 HG LEU 67 104.054 3.275 -0.519 503 HD11 LEU 67 HD11 LEU 67 104.177 5.334 0.573 504 HD12 LEU 67 HD12 LEU 67 105.707 5.289 -0.304 505 HD13 LEU 67 HD13 LEU 67 105.668 4.906 1.413 506 HD21 LEU 67 HD21 LEU 67 106.050 2.920 -1.618 507 HD22 LEU 67 HD22 LEU 67 106.245 1.738 -0.326 508 HD23 LEU 67 HD23 LEU 67 107.034 3.311 -0.209 509 H ALA 68 H ALA 68 102.969 2.759 4.377 510 HA ALA 68 HA ALA 68 102.301 1.295 5.994 511 HB1 ALA 68 HB1 ALA 68 101.050 -0.632 4.105 512 HB2 ALA 68 HB2 ALA 68 100.374 0.997 4.131 513 HB3 ALA 68 HB3 ALA 68 100.426 0.040 5.611 514 H TYR 69 H TYR 69 102.175 -1.752 5.357 515 HA TYR 69 HA TYR 69 104.788 -2.350 6.149 516 HB2 TYR 69 HB2 TYR 69 102.792 -4.093 4.708 517 HB3 TYR 69 HB3 TYR 69 104.242 -4.672 5.506 518 HD1 TYR 69 HD1 TYR 69 104.462 -4.414 8.007 519 HD2 TYR 69 HD2 TYR 69 100.798 -3.622 5.909 520 HE1 TYR 69 HE1 TYR 69 103.206 -4.575 10.139 521 HE2 TYR 69 HE2 TYR 69 99.543 -3.782 8.041 522 HH TYR 69 HH TYR 69 100.879 -3.615 10.955 523 H LEU 70 H LEU 70 103.581 -1.652 2.982 524 HA LEU 70 HA LEU 70 105.401 -3.104 1.393 525 HB2 LEU 70 HB2 LEU 70 103.799 -0.604 0.925 526 HB3 LEU 70 HB3 LEU 70 104.887 -1.248 -0.306 527 HG LEU 70 HG LEU 70 103.684 -3.501 0.085 528 HD11 LEU 70 HD11 LEU 70 101.868 -1.549 1.498 529 HD12 LEU 70 HD12 LEU 70 102.439 -3.122 2.058 530 HD13 LEU 70 HD13 LEU 70 101.234 -3.027 0.774 531 HD21 LEU 70 HD21 LEU 70 102.010 -2.943 -1.568 532 HD22 LEU 70 HD22 LEU 70 103.439 -1.969 -1.911 533 HD23 LEU 70 HD23 LEU 70 102.049 -1.242 -1.104 534 H TRP 71 H TRP 71 105.943 -0.306 3.353 535 HA TRP 71 HA TRP 71 107.844 1.101 1.906 536 HB2 TRP 71 HB2 TRP 71 106.773 1.726 4.098 537 HB3 TRP 71 HB3 TRP 71 107.912 0.650 4.881 538 HD1 TRP 71 HD1 TRP 71 109.940 1.835 5.795 539 HE1 TRP 71 HE1 TRP 71 111.226 3.998 5.245 540 HE3 TRP 71 HE3 TRP 71 107.331 3.403 1.703 541 HZ2 TRP 71 HZ2 TRP 71 111.184 6.107 3.303 542 HZ3 TRP 71 HZ3 TRP 71 107.976 5.483 0.516 543 HH2 TRP 71 HH2 TRP 71 109.895 6.832 1.313 544 HA PRO 72 HA PRO 72 110.890 -2.247 2.129 545 HB2 PRO 72 HB2 PRO 72 112.514 -1.543 0.133 546 HB3 PRO 72 HB3 PRO 72 110.836 -2.023 -0.191 547 HG2 PRO 72 HG2 PRO 72 112.048 0.679 -0.165 548 HG3 PRO 72 HG3 PRO 72 110.761 0.023 -1.191 549 HD2 PRO 72 HD2 PRO 72 110.403 1.608 1.121 550 HD3 PRO 72 HD3 PRO 72 109.141 0.711 0.250 551 H LEU 73 H LEU 73 111.601 1.035 2.868 552 HA LEU 73 HA LEU 73 114.471 0.506 3.262 553 HB2 LEU 73 HB2 LEU 73 112.979 3.132 3.385 554 HB3 LEU 73 HB3 LEU 73 114.726 2.914 3.410 555 HG LEU 73 HG LEU 73 112.909 2.101 1.124 556 HD11 LEU 73 HD11 LEU 73 114.770 4.459 1.518 557 HD12 LEU 73 HD12 LEU 73 113.022 4.513 1.297 558 HD13 LEU 73 HD13 LEU 73 114.069 4.011 -0.040 559 HD21 LEU 73 HD21 LEU 73 115.927 2.102 1.470 560 HD22 LEU 73 HD22 LEU 73 115.109 1.867 -0.075 561 HD23 LEU 73 HD23 LEU 73 114.893 0.695 1.220 562 H THR 74 H THR 74 115.496 0.709 5.173 563 HA THR 74 HA THR 74 114.088 0.496 7.625 564 HB THR 74 HB THR 74 116.292 0.719 8.672 565 HG1 THR 74 HG1 THR 74 118.014 1.217 7.336 566 HG21 THR 74 HG21 THR 74 117.469 -1.093 7.362 567 HG22 THR 74 HG22 THR 74 116.210 -0.934 6.138 568 HG23 THR 74 HG23 THR 74 115.793 -1.458 7.769 569 H VAL 75 H VAL 75 115.659 3.229 5.955 570 HA VAL 75 HA VAL 75 115.164 5.144 7.992 571 HB VAL 75 HB VAL 75 115.296 6.832 6.132 572 HG11 VAL 75 HG11 VAL 75 117.456 4.710 6.290 573 HG12 VAL 75 HG12 VAL 75 117.305 6.133 7.321 574 HG13 VAL 75 HG13 VAL 75 117.682 6.321 5.609 575 HG21 VAL 75 HG21 VAL 75 115.833 4.390 4.410 576 HG22 VAL 75 HG22 VAL 75 115.906 6.072 3.895 577 HG23 VAL 75 HG23 VAL 75 114.359 5.356 4.337 578 H ASP 76 H ASP 76 113.321 6.221 8.539 579 HA ASP 76 HA ASP 76 110.942 4.829 7.937 580 HB2 ASP 76 HB2 ASP 76 111.374 7.485 9.320 581 HB3 ASP 76 HB3 ASP 76 109.830 6.643 9.261 582 H HIS 77 H HIS 77 112.274 7.819 6.610 583 HA HIS 77 HA HIS 77 110.224 7.681 4.535 584 HB2 HIS 77 HB2 HIS 77 109.719 10.109 4.764 585 HB3 HIS 77 HB3 HIS 77 109.121 9.118 6.079 586 HD1 HIS 77 HD1 HIS 77 111.158 9.010 8.129 587 HD2 HIS 77 HD2 HIS 77 110.783 12.417 5.755 588 HE1 HIS 77 HE1 HIS 77 112.235 10.904 9.419 589 H GLY 78 H GLY 78 110.649 9.436 2.857 590 HA2 GLY 78 HA2 GLY 78 113.191 10.712 2.740 591 HA3 GLY 78 HA3 GLY 78 113.154 9.265 1.737 592 H THR 79 H THR 79 113.489 11.809 0.659 593 HA THR 79 HA THR 79 110.889 12.360 -0.651 594 HB THR 79 HB THR 79 113.306 14.167 -0.721 595 HG1 THR 79 HG1 THR 79 111.228 14.166 1.138 596 HG21 THR 79 HG21 THR 79 111.685 14.828 -2.305 597 HG22 THR 79 HG22 THR 79 111.286 15.809 -0.893 598 HG23 THR 79 HG23 THR 79 110.345 14.360 -1.256 599 H ILE 80 H ILE 80 110.723 12.204 -2.860 600 HA ILE 80 HA ILE 80 113.086 11.114 -4.268 601 HB ILE 80 HB ILE 80 111.446 10.167 -5.868 602 HG12 ILE 80 HG12 ILE 80 109.380 11.117 -3.853 603 HG13 ILE 80 HG13 ILE 80 109.633 11.845 -5.438 604 HG21 ILE 80 HG21 ILE 80 110.929 9.447 -2.967 605 HG22 ILE 80 HG22 ILE 80 112.295 8.877 -3.927 606 HG23 ILE 80 HG23 ILE 80 110.652 8.403 -4.363 607 HD11 ILE 80 HD11 ILE 80 107.918 10.367 -5.925 608 HD12 ILE 80 HD12 ILE 80 108.478 9.170 -4.752 609 HD13 ILE 80 HD13 ILE 80 109.325 9.364 -6.286 610 H GLU 81 H GLU 81 113.868 12.121 -6.046 611 HA GLU 81 HA GLU 81 112.399 14.464 -7.072 612 HB2 GLU 81 HB2 GLU 81 115.270 14.496 -6.115 613 HB3 GLU 81 HB3 GLU 81 114.452 15.825 -6.937 614 HG2 GLU 81 HG2 GLU 81 112.763 15.871 -5.114 615 HG3 GLU 81 HG3 GLU 81 113.656 14.611 -4.277 616 H CYS 82 H CYS 82 112.693 14.923 -9.164 617 HA CYS 82 HA CYS 82 114.631 13.304 -10.703 618 HB2 CYS 82 HB2 CYS 82 111.962 14.491 -11.322 619 HB3 CYS 82 HB3 CYS 82 113.139 14.397 -12.632 620 H LEU 83 H LEU 83 116.450 14.323 -11.255 621 HA LEU 83 HA LEU 83 116.666 17.198 -10.932 622 HB2 LEU 83 HB2 LEU 83 118.640 15.026 -11.634 623 HB3 LEU 83 HB3 LEU 83 119.074 16.736 -11.621 624 HG LEU 83 HG LEU 83 117.694 15.522 -9.242 625 HD11 LEU 83 HD11 LEU 83 119.904 15.021 -8.272 626 HD12 LEU 83 HD12 LEU 83 120.680 15.494 -9.783 627 HD13 LEU 83 HD13 LEU 83 119.637 14.071 -9.733 628 HD21 LEU 83 HD21 LEU 83 119.077 17.309 -8.112 629 HD22 LEU 83 HD22 LEU 83 117.902 17.933 -9.269 630 HD23 LEU 83 HD23 LEU 83 119.606 17.828 -9.714 631 HA PRO 84 HA PRO 84 116.114 18.531 -15.117 632 HB2 PRO 84 HB2 PRO 84 118.810 19.802 -15.007 633 HB3 PRO 84 HB3 PRO 84 117.243 20.508 -15.451 634 HG2 PRO 84 HG2 PRO 84 118.376 21.022 -13.104 635 HG3 PRO 84 HG3 PRO 84 116.619 20.843 -13.269 636 HD2 PRO 84 HD2 PRO 84 118.598 18.944 -12.090 637 HD3 PRO 84 HD3 PRO 84 116.895 19.218 -11.658 638 H SER 85 H SER 85 118.979 16.779 -14.215 639 HA SER 85 HA SER 85 119.951 16.402 -16.910 640 HB2 SER 85 HB2 SER 85 120.747 15.162 -14.275 641 HB3 SER 85 HB3 SER 85 121.551 14.833 -15.807 642 HG SER 85 HG SER 85 121.388 17.214 -14.392 643 H ASP 86 H ASP 86 117.277 15.119 -15.518 644 HA ASP 86 HA ASP 86 115.958 13.313 -15.970 645 HB2 ASP 86 HB2 ASP 86 116.886 13.655 -18.330 646 HB3 ASP 86 HB3 ASP 86 118.011 12.352 -17.957 647 H ASN 87 H ASN 87 117.973 13.266 -13.899 648 HA ASN 87 HA ASN 87 118.506 10.354 -13.743 649 HB2 ASN 87 HB2 ASN 87 119.797 12.636 -12.225 650 HB3 ASN 87 HB3 ASN 87 120.188 10.927 -12.043 651 HD21 ASN 87 HD21 ASN 87 120.231 10.073 -14.725 652 HD22 ASN 87 HD22 ASN 87 121.465 10.892 -15.556 653 H ALA 88 H ALA 88 117.363 9.221 -12.295 654 HA ALA 88 HA ALA 88 115.614 10.680 -10.442 655 HB1 ALA 88 HB1 ALA 88 114.788 8.195 -10.102 656 HB2 ALA 88 HB2 ALA 88 115.616 7.935 -11.637 657 HB3 ALA 88 HB3 ALA 88 114.304 9.109 -11.531 658 H VAL 89 H VAL 89 116.174 10.893 -8.367 659 HA VAL 89 HA VAL 89 117.917 8.833 -7.150 660 HB VAL 89 HB VAL 89 119.125 10.629 -5.945 661 HG11 VAL 89 HG11 VAL 89 120.308 9.841 -7.809 662 HG12 VAL 89 HG12 VAL 89 120.243 11.579 -8.101 663 HG13 VAL 89 HG13 VAL 89 119.138 10.500 -8.952 664 HG21 VAL 89 HG21 VAL 89 117.395 12.372 -6.066 665 HG22 VAL 89 HG22 VAL 89 117.572 12.441 -7.819 666 HG23 VAL 89 HG23 VAL 89 118.900 12.956 -6.778 667 H PHE 90 H PHE 90 117.839 8.744 -4.871 668 HA PHE 90 HA PHE 90 115.296 9.670 -3.677 669 HB2 PHE 90 HB2 PHE 90 115.442 7.247 -3.919 670 HB3 PHE 90 HB3 PHE 90 117.002 7.238 -3.127 671 HD1 PHE 90 HD1 PHE 90 113.389 8.008 -2.576 672 HD2 PHE 90 HD2 PHE 90 117.161 6.979 -0.800 673 HE1 PHE 90 HE1 PHE 90 112.262 7.647 -0.388 674 HE2 PHE 90 HE2 PHE 90 116.036 6.606 1.378 675 HZ PHE 90 HZ PHE 90 113.585 6.944 1.583 676 H VAL 91 H VAL 91 115.501 11.077 -2.017 677 HA VAL 91 HA VAL 91 118.141 11.370 -0.715 678 HB VAL 91 HB VAL 91 115.803 13.292 -0.841 679 HG11 VAL 91 HG11 VAL 91 118.478 14.325 -0.101 680 HG12 VAL 91 HG12 VAL 91 117.764 13.254 1.095 681 HG13 VAL 91 HG13 VAL 91 116.888 14.684 0.566 682 HG21 VAL 91 HG21 VAL 91 117.241 14.586 -2.376 683 HG22 VAL 91 HG22 VAL 91 116.895 12.982 -3.023 684 HG23 VAL 91 HG23 VAL 91 118.465 13.319 -2.293 685 H ALA 92 H ALA 92 118.326 10.788 1.377 686 HA ALA 92 HA ALA 92 115.850 10.075 2.830 687 HB1 ALA 92 HB1 ALA 92 118.749 9.311 3.160 688 HB2 ALA 92 HB2 ALA 92 117.363 8.262 2.865 689 HB3 ALA 92 HB3 ALA 92 117.570 9.027 4.441 690 HA PRO 93 HA PRO 93 115.924 13.502 5.628 691 HB2 PRO 93 HB2 PRO 93 116.153 11.575 7.898 692 HB3 PRO 93 HB3 PRO 93 114.991 12.892 7.647 693 HG2 PRO 93 HG2 PRO 93 114.347 10.317 7.290 694 HG3 PRO 93 HG3 PRO 93 113.630 11.628 6.340 695 HD2 PRO 93 HD2 PRO 93 115.583 9.573 5.492 696 HD3 PRO 93 HD3 PRO 93 114.449 10.530 4.520 697 H ASP 94 H ASP 94 118.341 10.995 5.956 698 HA ASP 94 HA ASP 94 120.029 12.290 7.822 699 HB2 ASP 94 HB2 ASP 94 121.773 10.728 6.942 700 HB3 ASP 94 HB3 ASP 94 120.283 9.945 7.450 701 H GLY 95 H GLY 95 119.390 13.114 4.566 702 HA2 GLY 95 HA2 GLY 95 120.246 15.005 3.449 703 HA3 GLY 95 HA3 GLY 95 121.607 15.024 4.567 704 H THR 96 H THR 96 121.048 11.908 3.347 705 HA THR 96 HA THR 96 123.365 12.127 1.553 706 HB THR 96 HB THR 96 121.977 9.691 2.704 707 HG1 THR 96 HG1 THR 96 123.352 9.877 4.277 708 HG21 THR 96 HG21 THR 96 124.403 8.799 2.079 709 HG22 THR 96 HG22 THR 96 124.324 10.105 0.895 710 HG23 THR 96 HG23 THR 96 123.105 8.828 0.885 711 H THR 97 H THR 97 123.178 11.672 -0.606 712 HA THR 97 HA THR 97 120.451 11.115 -1.610 713 HB THR 97 HB THR 97 122.858 12.171 -3.121 714 HG1 THR 97 HG1 THR 97 122.183 14.052 -2.528 715 HG21 THR 97 HG21 THR 97 119.921 12.179 -3.853 716 HG22 THR 97 HG22 THR 97 121.063 10.960 -4.417 717 HG23 THR 97 HG23 THR 97 121.278 12.648 -4.877 718 H TYR 98 H TYR 98 120.023 9.255 -2.534 719 HA TYR 98 HA TYR 98 122.226 7.422 -3.248 720 HB2 TYR 98 HB2 TYR 98 119.386 6.769 -2.452 721 HB3 TYR 98 HB3 TYR 98 120.638 5.605 -2.831 722 HD1 TYR 98 HD2 TYR 98 122.434 5.130 -1.215 723 HD2 TYR 98 HD1 TYR 98 119.314 7.945 -0.326 724 HE1 TYR 98 HE2 TYR 98 123.049 5.058 1.187 725 HE2 TYR 98 HE1 TYR 98 119.943 7.888 2.068 726 HH TYR 98 HH TYR 98 121.521 7.153 3.533 727 H ALA 99 H ALA 99 122.002 6.282 -5.235 728 HA ALA 99 HA ALA 99 120.386 7.679 -7.215 729 HB1 ALA 99 HB1 ALA 99 121.606 6.016 -8.770 730 HB2 ALA 99 HB2 ALA 99 122.562 5.596 -7.350 731 HB3 ALA 99 HB3 ALA 99 122.583 7.246 -7.968 732 H LEU 100 H LEU 100 118.497 6.968 -7.994 733 HA LEU 100 HA LEU 100 117.458 4.404 -7.072 734 HB2 LEU 100 HB2 LEU 100 116.244 6.723 -8.579 735 HB3 LEU 100 HB3 LEU 100 115.390 5.202 -8.336 736 HG LEU 100 HG LEU 100 116.604 6.656 -5.996 737 HD11 LEU 100 HD11 LEU 100 114.415 7.762 -5.672 738 HD12 LEU 100 HD12 LEU 100 113.847 7.074 -7.192 739 HD13 LEU 100 HD13 LEU 100 115.148 8.263 -7.196 740 HD21 LEU 100 HD21 LEU 100 115.778 4.283 -5.821 741 HD22 LEU 100 HD22 LEU 100 114.176 4.857 -6.282 742 HD23 LEU 100 HD23 LEU 100 114.909 5.405 -4.777 743 H ASN 101 H ASN 101 118.023 6.094 -10.154 744 HA ASN 101 HA ASN 101 117.669 3.513 -11.557 745 HB2 ASN 101 HB2 ASN 101 117.194 4.748 -13.541 746 HB3 ASN 101 HB3 ASN 101 116.231 5.425 -12.235 747 HD21 ASN 101 HD21 ASN 101 116.433 7.170 -14.219 748 HD22 ASN 101 HD22 ASN 101 117.619 8.354 -13.946 749 H ASP 102 H ASP 102 118.988 3.285 -13.594 750 HA ASP 102 HA ASP 102 121.603 2.779 -12.776 751 HB2 ASP 102 HB2 ASP 102 120.460 3.000 -15.564 752 HB3 ASP 102 HB3 ASP 102 122.050 2.341 -15.190 753 H ARG 103 H ARG 103 120.323 5.552 -14.594 754 HA ARG 103 HA ARG 103 122.837 6.536 -15.438 755 HB2 ARG 103 HB2 ARG 103 120.171 7.908 -15.070 756 HB3 ARG 103 HB3 ARG 103 121.582 8.684 -15.798 757 HG2 ARG 103 HG2 ARG 103 121.708 6.823 -17.454 758 HG3 ARG 103 HG3 ARG 103 120.226 6.152 -16.773 759 HD2 ARG 103 HD2 ARG 103 120.513 8.890 -18.042 760 HD3 ARG 103 HD3 ARG 103 119.730 7.491 -18.772 761 HE ARG 103 HE ARG 103 118.606 9.250 -16.800 762 HH11 ARG 103 HH11 ARG 103 118.514 5.934 -17.952 763 HH12 ARG 103 HH12 ARG 103 116.905 5.676 -17.363 764 HH21 ARG 103 HH21 ARG 103 116.570 8.870 -16.078 765 HH22 ARG 103 HH22 ARG 103 115.808 7.329 -16.306 766 H ALA 104 H ALA 104 120.860 7.298 -12.573 767 HA ALA 104 HA ALA 104 122.543 9.255 -11.476 768 HB1 ALA 104 HB1 ALA 104 121.528 8.504 -9.273 769 HB2 ALA 104 HB2 ALA 104 120.682 7.256 -10.188 770 HB3 ALA 104 HB3 ALA 104 120.376 8.958 -10.529 771 H GLU 105 H GLU 105 122.657 5.711 -11.224 772 HA GLU 105 HA GLU 105 124.826 5.552 -9.426 773 HB2 GLU 105 HB2 GLU 105 124.030 3.659 -11.652 774 HB3 GLU 105 HB3 GLU 105 125.185 3.286 -10.374 775 HG2 GLU 105 HG2 GLU 105 123.419 3.734 -8.682 776 HG3 GLU 105 HG3 GLU 105 122.270 4.012 -9.983 777 H LYS 106 H LYS 106 124.738 5.794 -12.968 778 HA LYS 106 HA LYS 106 127.487 5.623 -13.476 779 HB2 LYS 106 HB2 LYS 106 125.701 5.632 -15.213 780 HB3 LYS 106 HB3 LYS 106 125.484 7.361 -14.934 781 HG2 LYS 106 HG2 LYS 106 127.879 7.725 -15.503 782 HG3 LYS 106 HG3 LYS 106 128.032 6.006 -15.867 783 HD2 LYS 106 HD2 LYS 106 126.199 6.261 -17.559 784 HD3 LYS 106 HD3 LYS 106 126.230 8.001 -17.268 785 HE2 LYS 106 HE2 LYS 106 128.668 6.413 -18.106 786 HE3 LYS 106 HE3 LYS 106 127.613 7.246 -19.247 787 HZ1 LYS 106 HZ1 LYS 106 128.483 8.842 -16.999 788 HZ2 LYS 106 HZ2 LYS 106 128.398 9.240 -18.648 789 HZ3 LYS 106 HZ3 LYS 106 129.727 8.369 -18.049 790 H ALA 107 H ALA 107 125.536 8.331 -12.370 791 HA ALA 107 HA ALA 107 127.566 10.326 -12.618 792 HB1 ALA 107 HB1 ALA 107 125.105 10.303 -10.864 793 HB2 ALA 107 HB2 ALA 107 125.165 10.861 -12.535 794 HB3 ALA 107 HB3 ALA 107 126.070 11.717 -11.287 795 H GLY 108 H GLY 108 127.660 7.705 -10.651 796 HA2 GLY 108 HA2 GLY 108 129.038 7.187 -8.915 797 HA3 GLY 108 HA3 GLY 108 129.635 8.835 -8.940 798 H HIS 109 H HIS 109 126.188 8.328 -8.537 799 HA HIS 109 HA HIS 109 126.321 9.216 -5.787 800 HB2 HIS 109 HB2 HIS 109 124.151 8.624 -7.749 801 HB3 HIS 109 HB3 HIS 109 123.749 8.618 -6.043 802 HD1 HIS 109 HD1 HIS 109 125.546 11.017 -5.165 803 HD2 HIS 109 HD2 HIS 109 123.021 11.050 -8.481 804 HE1 HIS 109 HE1 HIS 109 125.033 13.448 -5.649 805 HA PRO 110 HA PRO 110 126.583 5.081 -4.194 806 HB2 PRO 110 HB2 PRO 110 125.521 5.348 -1.688 807 HB3 PRO 110 HB3 PRO 110 127.132 5.951 -2.129 808 HG2 PRO 110 HG2 PRO 110 124.572 7.432 -1.851 809 HG3 PRO 110 HG3 PRO 110 126.214 7.916 -1.395 810 HD2 PRO 110 HD2 PRO 110 124.980 8.807 -3.671 811 HD3 PRO 110 HD3 PRO 110 126.743 8.647 -3.515 812 HA PRO 111 HA PRO 111 122.500 3.375 -4.848 813 HB2 PRO 111 HB2 PRO 111 122.827 0.806 -3.998 814 HB3 PRO 111 HB3 PRO 111 123.510 1.421 -5.514 815 HG2 PRO 111 HG2 PRO 111 124.847 0.871 -2.936 816 HG3 PRO 111 HG3 PRO 111 125.467 0.747 -4.587 817 HD2 PRO 111 HD2 PRO 111 125.988 2.845 -2.821 818 HD3 PRO 111 HD3 PRO 111 126.225 2.893 -4.579 819 H ILE 112 H ILE 112 120.554 2.785 -3.769 820 HA ILE 112 HA ILE 112 120.294 3.633 -1.084 821 HB ILE 112 HB ILE 112 118.389 2.073 -2.848 822 HG12 ILE 112 HG12 ILE 112 118.425 4.971 -1.978 823 HG13 ILE 112 HG13 ILE 112 119.033 4.404 -3.533 824 HG21 ILE 112 HG21 ILE 112 117.824 3.466 -0.205 825 HG22 ILE 112 HG22 ILE 112 117.842 1.718 -0.441 826 HG23 ILE 112 HG23 ILE 112 116.626 2.704 -1.249 827 HD11 ILE 112 HD11 ILE 112 116.182 4.137 -2.513 828 HD12 ILE 112 HD12 ILE 112 116.769 3.518 -4.060 829 HD13 ILE 112 HD13 ILE 112 116.737 5.255 -3.758 830 H THR 113 H THR 113 121.396 0.598 -2.299 831 HA THR 113 HA THR 113 120.106 -1.216 -0.726 832 HB THR 113 HB THR 113 121.482 -2.082 -2.402 833 HG1 THR 113 HG1 THR 113 122.715 -2.718 0.002 834 HG21 THR 113 HG21 THR 113 123.979 -1.195 -0.973 835 HG22 THR 113 HG22 THR 113 123.205 -0.175 -2.183 836 HG23 THR 113 HG23 THR 113 123.803 -1.770 -2.630 837 HA PRO 114 HA PRO 114 123.326 -0.789 2.868 838 HB2 PRO 114 HB2 PRO 114 123.298 2.157 3.247 839 HB3 PRO 114 HB3 PRO 114 124.643 1.010 3.412 840 HG2 PRO 114 HG2 PRO 114 124.513 2.662 1.347 841 HG3 PRO 114 HG3 PRO 114 125.088 0.993 1.153 842 HD2 PRO 114 HD2 PRO 114 122.403 2.148 0.472 843 HD3 PRO 114 HD3 PRO 114 123.393 1.004 -0.454 844 H ILE 115 H ILE 115 120.621 1.365 2.246 845 HA ILE 115 HA ILE 115 119.644 1.016 4.988 846 HB ILE 115 HB ILE 115 117.873 2.672 4.275 847 HG12 ILE 115 HG12 ILE 115 119.766 3.148 1.955 848 HG13 ILE 115 HG13 ILE 115 118.224 2.312 1.801 849 HG21 ILE 115 HG21 ILE 115 119.212 4.422 4.942 850 HG22 ILE 115 HG22 ILE 115 120.576 3.909 3.946 851 HG23 ILE 115 HG23 ILE 115 120.209 3.062 5.449 852 HD11 ILE 115 HD11 ILE 115 117.020 4.240 1.951 853 HD12 ILE 115 HD12 ILE 115 118.532 5.004 1.464 854 HD13 ILE 115 HD13 ILE 115 118.081 4.947 3.166 855 H ARG 116 H ARG 116 119.313 -0.791 2.233 856 HA ARG 116 HA ARG 116 116.461 -1.035 2.241 857 HB2 ARG 116 HB2 ARG 116 116.698 -2.083 0.298 858 HB3 ARG 116 HB3 ARG 116 118.377 -1.616 0.399 859 HG2 ARG 116 HG2 ARG 116 117.418 -4.281 1.479 860 HG3 ARG 116 HG3 ARG 116 117.819 -4.055 -0.216 861 HD2 ARG 116 HD2 ARG 116 120.064 -3.272 0.409 862 HD3 ARG 116 HD3 ARG 116 119.686 -3.535 2.113 863 HE ARG 116 HE ARG 116 119.196 -5.926 0.733 864 HH11 ARG 116 HH11 ARG 116 121.960 -3.913 1.528 865 HH12 ARG 116 HH12 ARG 116 123.062 -5.249 1.513 866 HH21 ARG 116 HH21 ARG 116 120.662 -7.605 0.729 867 HH22 ARG 116 HH22 ARG 116 122.336 -7.313 1.066 868 H ALA 117 H ALA 117 115.160 -2.671 3.043 869 HA ALA 117 HA ALA 117 116.274 -3.908 5.458 870 HB1 ALA 117 HB1 ALA 117 114.107 -3.884 6.314 871 HB2 ALA 117 HB2 ALA 117 113.372 -3.915 4.709 872 HB3 ALA 117 HB3 ALA 117 114.122 -2.434 5.308 873 H LYS 118 H LYS 118 115.940 -6.083 5.992 874 HA LYS 118 HA LYS 118 115.619 -7.897 3.748 875 HB2 LYS 118 HB2 LYS 118 116.277 -9.637 5.289 876 HB3 LYS 118 HB3 LYS 118 117.359 -8.265 5.492 877 HG2 LYS 118 HG2 LYS 118 115.973 -7.523 7.443 878 HG3 LYS 118 HG3 LYS 118 115.016 -8.995 7.275 879 HD2 LYS 118 HD2 LYS 118 117.206 -10.288 7.462 880 HD3 LYS 118 HD3 LYS 118 117.955 -8.769 7.956 881 HE2 LYS 118 HE2 LYS 118 115.612 -10.116 9.331 882 HE3 LYS 118 HE3 LYS 118 117.269 -10.064 9.931 883 HZ1 LYS 118 HZ1 LYS 118 117.028 -7.557 9.760 884 HZ2 LYS 118 HZ2 LYS 118 116.182 -8.329 11.015 885 HZ3 LYS 118 HZ3 LYS 118 115.360 -7.829 9.615 886 H GLY 119 H GLY 119 113.924 -9.322 3.430 887 HA2 GLY 119 HA2 GLY 119 111.461 -8.638 4.898 888 HA3 GLY 119 HA3 GLY 119 111.528 -9.360 3.304 889 H SER 120 H SER 120 109.862 -10.588 4.941 890 HA SER 120 HA SER 120 110.845 -12.561 6.671 891 HB2 SER 120 HB2 SER 120 108.406 -12.743 4.887 892 HB3 SER 120 HB3 SER 120 108.712 -13.685 6.342 893 HG SER 120 HG SER 120 107.588 -11.377 6.204 894 H GLY 121 H GLY 121 110.388 -12.591 3.159 895 HA2 GLY 121 HA2 GLY 121 112.306 -14.779 2.948 896 HA3 GLY 121 HA3 GLY 121 110.691 -15.103 2.323 897 H GLY 122 H GLY 122 112.712 -15.261 0.551 898 HA2 GLY 122 HA2 GLY 122 113.182 -14.559 -1.600 899 HA3 GLY 122 HA3 GLY 122 112.002 -13.270 -1.386 900 H GLY 123 H GLY 123 114.814 -13.838 0.682 901 HA2 GLY 123 HA2 GLY 123 116.716 -12.600 1.063 902 HA3 GLY 123 HA3 GLY 123 116.534 -11.946 -0.561 903 H TYR 124 H TYR 124 116.398 -9.800 -0.566 904 HA TYR 124 HA TYR 124 115.184 -8.445 1.768 905 HB2 TYR 124 HB2 TYR 124 117.321 -7.598 -0.167 906 HB3 TYR 124 HB3 TYR 124 116.481 -6.449 0.859 907 HD1 TYR 124 HD1 TYR 124 117.909 -9.885 1.368 908 HD2 TYR 124 HD2 TYR 124 117.779 -5.795 2.669 909 HE1 TYR 124 HE1 TYR 124 119.469 -10.425 3.220 910 HE2 TYR 124 HE2 TYR 124 119.336 -6.333 4.522 911 HH TYR 124 HH TYR 124 121.041 -9.210 4.686 912 H ILE 125 H ILE 125 114.133 -6.363 1.295 913 HA ILE 125 HA ILE 125 112.016 -6.900 -0.569 914 HB ILE 125 HB ILE 125 112.553 -4.543 1.258 915 HG12 ILE 125 HG12 ILE 125 110.482 -6.688 1.665 916 HG13 ILE 125 HG13 ILE 125 112.142 -6.980 2.168 917 HG21 ILE 125 HG21 ILE 125 110.249 -3.920 0.925 918 HG22 ILE 125 HG22 ILE 125 109.948 -5.350 -0.064 919 HG23 ILE 125 HG23 ILE 125 110.990 -4.060 -0.667 920 HD11 ILE 125 HD11 ILE 125 112.086 -5.347 3.804 921 HD12 ILE 125 HD12 ILE 125 110.412 -5.895 3.840 922 HD13 ILE 125 HD13 ILE 125 110.835 -4.411 2.984 923 H SER 126 H SER 126 111.658 -6.047 -2.518 924 HA SER 126 HA SER 126 113.806 -4.768 -3.915 925 HB2 SER 126 HB2 SER 126 110.951 -5.283 -4.759 926 HB3 SER 126 HB3 SER 126 112.264 -4.794 -5.824 927 HG SER 126 HG SER 126 113.285 -6.718 -5.214 928 H LEU 127 H LEU 127 114.091 -2.721 -4.526 929 HA LEU 127 HA LEU 127 112.249 -0.668 -3.553 930 HB2 LEU 127 HB2 LEU 127 114.863 -0.363 -5.041 931 HB3 LEU 127 HB3 LEU 127 113.958 0.920 -4.245 932 HG LEU 127 HG LEU 127 115.136 -1.502 -2.847 933 HD11 LEU 127 HD11 LEU 127 116.915 -0.029 -3.574 934 HD12 LEU 127 HD12 LEU 127 116.668 0.232 -1.848 935 HD13 LEU 127 HD13 LEU 127 116.030 1.390 -3.015 936 HD21 LEU 127 HD21 LEU 127 114.597 -0.120 -0.799 937 HD22 LEU 127 HD22 LEU 127 113.178 -0.700 -1.671 938 HD23 LEU 127 HD23 LEU 127 113.697 0.976 -1.849 939 H GLY 128 H GLY 128 112.033 -2.580 -6.149 940 HA2 GLY 128 HA2 GLY 128 112.116 -1.104 -8.464 941 HA3 GLY 128 HA3 GLY 128 110.945 -2.384 -8.176 942 H ALA 129 H ALA 129 109.428 -1.179 -6.118 943 HA ALA 129 HA ALA 129 107.585 0.291 -7.657 944 HB1 ALA 129 HB1 ALA 129 106.903 -0.932 -5.661 945 HB2 ALA 129 HB2 ALA 129 106.476 0.770 -5.490 946 HB3 ALA 129 HB3 ALA 129 107.885 0.126 -4.649 947 H LEU 130 H LEU 130 109.968 1.372 -5.244 948 HA LEU 130 HA LEU 130 109.284 4.094 -5.249 949 HB2 LEU 130 HB2 LEU 130 110.785 2.997 -3.595 950 HB3 LEU 130 HB3 LEU 130 112.028 2.882 -4.840 951 HG LEU 130 HG LEU 130 111.876 5.384 -5.111 952 HD11 LEU 130 HD11 LEU 130 109.722 5.885 -4.223 953 HD12 LEU 130 HD12 LEU 130 110.866 6.539 -3.051 954 HD13 LEU 130 HD13 LEU 130 110.053 5.009 -2.728 955 HD21 LEU 130 HD21 LEU 130 112.515 4.741 -2.242 956 HD22 LEU 130 HD22 LEU 130 113.395 5.767 -3.373 957 HD23 LEU 130 HD23 LEU 130 113.472 4.014 -3.532 958 H LEU 131 H LEU 131 111.523 2.253 -7.284 959 HA LEU 131 HA LEU 131 112.675 4.413 -8.667 960 HB2 LEU 131 HB2 LEU 131 113.535 2.090 -8.744 961 HB3 LEU 131 HB3 LEU 131 112.120 1.608 -9.676 962 HG LEU 131 HG LEU 131 112.796 3.357 -11.397 963 HD11 LEU 131 HD11 LEU 131 115.368 3.792 -11.228 964 HD12 LEU 131 HD12 LEU 131 115.135 3.476 -9.509 965 HD13 LEU 131 HD13 LEU 131 114.270 4.801 -10.287 966 HD21 LEU 131 HD21 LEU 131 114.321 1.873 -12.474 967 HD22 LEU 131 HD22 LEU 131 113.296 0.843 -11.476 968 HD23 LEU 131 HD23 LEU 131 114.922 1.257 -10.935 969 H SER 132 H SER 132 109.774 2.485 -9.380 970 HA SER 132 HA SER 132 109.233 3.594 -11.902 971 HB2 SER 132 HB2 SER 132 107.006 2.690 -11.656 972 HB3 SER 132 HB3 SER 132 108.142 1.555 -10.936 973 HG SER 132 HG SER 132 107.422 2.135 -9.009 974 H THR 133 H THR 133 108.258 4.638 -8.656 975 HA THR 133 HA THR 133 106.456 6.650 -9.459 976 HB THR 133 HB THR 133 108.198 6.639 -6.983 977 HG1 THR 133 HG1 THR 133 105.660 5.564 -7.364 978 HG21 THR 133 HG21 THR 133 107.012 8.765 -7.473 979 HG22 THR 133 HG22 THR 133 106.384 7.976 -6.025 980 HG23 THR 133 HG23 THR 133 105.488 7.879 -7.542 981 H THR 134 H THR 134 109.938 6.814 -8.711 982 HA THR 134 HA THR 134 110.161 9.610 -9.060 983 HB THR 134 HB THR 134 112.352 7.579 -9.525 984 HG1 THR 134 HG1 THR 134 111.497 7.238 -7.537 985 HG21 THR 134 HG21 THR 134 112.881 9.888 -10.196 986 HG22 THR 134 HG22 THR 134 113.782 9.445 -8.746 987 HG23 THR 134 HG23 THR 134 112.356 10.477 -8.618 988 H LEU 135 H LEU 135 110.534 6.924 -11.352 989 HA LEU 135 HA LEU 135 111.493 8.417 -13.530 990 HB2 LEU 135 HB2 LEU 135 109.787 5.919 -13.483 991 HB3 LEU 135 HB3 LEU 135 110.566 6.567 -14.927 992 HG LEU 135 HG LEU 135 112.072 5.843 -12.400 993 HD11 LEU 135 HD11 LEU 135 112.815 3.844 -13.720 994 HD12 LEU 135 HD12 LEU 135 111.614 4.257 -14.945 995 HD13 LEU 135 HD13 LEU 135 111.098 3.810 -13.318 996 HD21 LEU 135 HD21 LEU 135 113.402 7.339 -13.630 997 HD22 LEU 135 HD22 LEU 135 112.804 6.742 -15.179 998 HD23 LEU 135 HD23 LEU 135 113.935 5.770 -14.236 999 H ASN 136 H ASN 136 108.180 7.748 -12.448 1000 HA ASN 136 HA ASN 136 106.813 8.901 -14.609 1001 HB2 ASN 136 HB2 ASN 136 106.053 8.787 -11.682 1002 HB3 ASN 136 HB3 ASN 136 104.952 9.223 -12.985 1003 HD21 ASN 136 HD21 ASN 136 104.612 6.891 -11.259 1004 HD22 ASN 136 HD22 ASN 136 104.725 5.518 -12.250 1005 H LEU 137 H LEU 137 108.056 10.350 -11.622 1006 HA LEU 137 HA LEU 137 107.132 12.976 -12.063 1007 HB2 LEU 137 HB2 LEU 137 109.655 12.104 -10.634 1008 HB3 LEU 137 HB3 LEU 137 108.846 13.661 -10.459 1009 HG LEU 137 HG LEU 137 107.597 10.975 -9.801 1010 HD11 LEU 137 HD11 LEU 137 109.161 11.305 -8.091 1011 HD12 LEU 137 HD12 LEU 137 107.729 12.096 -7.434 1012 HD13 LEU 137 HD13 LEU 137 109.015 13.060 -8.160 1013 HD21 LEU 137 HD21 LEU 137 105.889 12.562 -10.425 1014 HD22 LEU 137 HD22 LEU 137 106.660 13.843 -9.490 1015 HD23 LEU 137 HD23 LEU 137 105.901 12.482 -8.665 1016 H CYS 138 H CYS 138 110.106 11.357 -13.095 1017 HA CYS 138 HA CYS 138 111.417 13.557 -14.223 1018 HB2 CYS 138 HB2 CYS 138 111.499 10.606 -14.682 1019 HB3 CYS 138 HB3 CYS 138 112.335 11.658 -15.818 1020 H GLY 139 H GLY 139 108.669 11.748 -15.431 1021 HA2 GLY 139 HA2 GLY 139 107.202 12.496 -17.099 1022 HA3 GLY 139 HA3 GLY 139 108.416 13.650 -17.625 1023 H LYS 140 H LYS 140 109.384 10.324 -17.207 1024 HA LYS 140 HA LYS 140 109.593 10.061 -20.141 1025 HB2 LYS 140 HB2 LYS 140 111.006 8.489 -17.973 1026 HB3 LYS 140 HB3 LYS 140 111.301 8.377 -19.707 1027 HG2 LYS 140 HG2 LYS 140 111.680 10.888 -18.049 1028 HG3 LYS 140 HG3 LYS 140 112.980 9.809 -18.551 1029 HD2 LYS 140 HD2 LYS 140 112.280 10.201 -20.941 1030 HD3 LYS 140 HD3 LYS 140 111.162 11.432 -20.351 1031 HE2 LYS 140 HE2 LYS 140 112.972 12.740 -19.435 1032 HE3 LYS 140 HE3 LYS 140 114.134 11.458 -19.776 1033 HZ1 LYS 140 HZ1 LYS 140 113.249 11.766 -22.190 1034 HZ2 LYS 140 HZ2 LYS 140 114.432 12.817 -21.571 1035 HZ3 LYS 140 HZ3 LYS 140 112.806 13.305 -21.630 1036 H GLY 141 H GLY 141 108.823 8.250 -21.197 1037 HA2 GLY 141 HA2 GLY 141 107.995 5.840 -20.513 1038 HA3 GLY 141 HA3 GLY 141 106.714 6.796 -19.773 Start of MODEL 20 1 H1 HIS -5 HT1 HIS -5 45.514 29.861 -14.226 2 H2 HIS -5 HT2 HIS -5 44.517 30.186 -15.563 3 H3 HIS -5 HT3 HIS -5 46.010 29.403 -15.782 4 HA HIS -5 HA HIS -5 43.523 28.341 -14.597 5 HB2 HIS -5 HB2 HIS -5 43.974 28.120 -17.036 6 HB3 HIS -5 HB3 HIS -5 45.464 27.277 -16.659 7 HD1 HIS -5 HD1 HIS -5 41.750 26.888 -15.849 8 HD2 HIS -5 HD2 HIS -5 45.105 24.550 -16.657 9 HE1 HIS -5 HE1 HIS -5 40.958 24.484 -15.872 10 H HIS -4 H HIS -4 43.676 26.302 -13.509 11 HA HIS -4 HA HIS -4 46.315 25.815 -12.243 12 HB2 HIS -4 HB2 HIS -4 43.540 25.487 -11.097 13 HB3 HIS -4 HB3 HIS -4 45.016 24.978 -10.299 14 HD1 HIS -4 HD1 HIS -4 42.986 27.998 -11.150 15 HD2 HIS -4 HD2 HIS -4 46.586 27.126 -9.237 16 HE1 HIS -4 HE1 HIS -4 43.691 30.114 -9.954 17 H HIS -3 H HIS -3 47.051 23.744 -12.136 18 HA HIS -3 HA HIS -3 45.394 21.657 -13.442 19 HB2 HIS -3 HB2 HIS -3 48.391 22.028 -13.461 20 HB3 HIS -3 HB3 HIS -3 47.552 20.638 -14.123 21 HD1 HIS -3 HD1 HIS -3 48.347 24.225 -14.790 22 HD2 HIS -3 HD2 HIS -3 46.175 21.153 -16.587 23 HE1 HIS -3 HE1 HIS -3 47.806 25.008 -17.135 24 H HIS -2 H HIS -2 45.217 19.702 -12.458 25 HA HIS -2 HA HIS -2 46.552 19.382 -9.829 26 HB2 HIS -2 HB2 HIS -2 43.873 18.339 -10.757 27 HB3 HIS -2 HB3 HIS -2 44.609 17.998 -9.204 28 HD1 HIS -2 HD1 HIS -2 45.120 20.298 -7.736 29 HD2 HIS -2 HD2 HIS -2 42.223 20.535 -10.723 30 HE1 HIS -2 HE1 HIS -2 43.725 22.345 -7.218 31 H HIS -1 H HIS -1 47.591 17.493 -9.404 32 HA HIS -1 HA HIS -1 47.526 15.381 -11.479 33 HB2 HIS -1 HB2 HIS -1 49.968 16.431 -10.043 34 HB3 HIS -1 HB3 HIS -1 49.940 15.082 -11.162 35 HD1 HIS -1 HD1 HIS -1 49.054 15.795 -13.687 36 HD2 HIS -1 HD2 HIS -1 50.516 18.841 -11.246 37 HE1 HIS -1 HE1 HIS -1 49.606 17.734 -15.217 38 H HIS 0 H HIS 0 48.108 13.270 -10.726 39 HA HIS 0 HA HIS 0 47.655 12.895 -7.821 40 HB2 HIS 0 HB2 HIS 0 46.986 11.086 -10.146 41 HB3 HIS 0 HB3 HIS 0 46.803 10.649 -8.458 42 HD1 HIS 0 HD1 HIS 0 45.269 12.698 -11.181 43 HD2 HIS 0 HD2 HIS 0 44.586 11.903 -7.146 44 HE1 HIS 0 HE1 HIS 0 42.957 13.585 -10.659 45 H SER 1 H SER 1 49.034 11.601 -6.687 46 HA SER 1 HA SER 1 51.428 10.628 -8.139 47 HB2 SER 1 HB2 SER 1 51.838 12.467 -6.513 48 HB3 SER 1 HB3 SER 1 51.182 11.448 -5.235 49 HG SER 1 HG SER 1 53.038 10.502 -5.219 50 H SER 2 H SER 2 52.161 8.580 -7.781 51 HA SER 2 HA SER 2 50.501 6.834 -6.052 52 HB2 SER 2 HB2 SER 2 50.168 6.418 -8.485 53 HB3 SER 2 HB3 SER 2 51.891 6.090 -8.637 54 HG SER 2 HG SER 2 51.593 4.283 -7.544 55 H GLY 3 H GLY 3 51.560 5.268 -4.845 56 HA2 GLY 3 HA2 GLY 3 54.086 5.880 -3.826 57 HA3 GLY 3 HA3 GLY 3 53.284 4.323 -3.647 58 H LEU 4 H LEU 4 56.144 5.136 -4.214 59 HA LEU 4 HA LEU 4 56.585 3.953 -6.857 60 HB2 LEU 4 HB2 LEU 4 58.571 5.113 -4.888 61 HB3 LEU 4 HB3 LEU 4 58.914 4.630 -6.547 62 HG LEU 4 HG LEU 4 56.917 6.771 -5.756 63 HD11 LEU 4 HD11 LEU 4 58.606 8.333 -6.697 64 HD12 LEU 4 HD12 LEU 4 59.722 6.981 -6.893 65 HD13 LEU 4 HD13 LEU 4 59.217 7.481 -5.279 66 HD21 LEU 4 HD21 LEU 4 57.904 5.654 -8.382 67 HD22 LEU 4 HD22 LEU 4 57.241 7.285 -8.278 68 HD23 LEU 4 HD23 LEU 4 56.240 5.898 -7.850 69 H VAL 5 H VAL 5 57.655 2.035 -7.199 70 HA VAL 5 HA VAL 5 57.424 0.020 -5.228 71 HB VAL 5 HB VAL 5 58.690 -1.385 -6.826 72 HG11 VAL 5 HG11 VAL 5 56.320 -1.155 -7.210 73 HG12 VAL 5 HG12 VAL 5 57.120 -1.028 -8.778 74 HG13 VAL 5 HG13 VAL 5 56.542 0.425 -7.962 75 HG21 VAL 5 HG21 VAL 5 59.560 -0.445 -8.877 76 HG22 VAL 5 HG22 VAL 5 60.239 0.483 -7.539 77 HG23 VAL 5 HG23 VAL 5 58.904 1.145 -8.484 78 HA PRO 6 HA PRO 6 61.253 0.596 -3.094 79 HB2 PRO 6 HB2 PRO 6 61.712 -1.845 -2.019 80 HB3 PRO 6 HB3 PRO 6 60.373 -0.814 -1.478 81 HG2 PRO 6 HG2 PRO 6 60.329 -3.182 -3.262 82 HG3 PRO 6 HG3 PRO 6 59.151 -2.657 -2.048 83 HD2 PRO 6 HD2 PRO 6 58.879 -2.253 -4.782 84 HD3 PRO 6 HD3 PRO 6 58.034 -1.319 -3.529 85 H ARG 7 H ARG 7 63.080 0.953 -4.223 86 HA ARG 7 HA ARG 7 64.389 -1.344 -5.568 87 HB2 ARG 7 HB2 ARG 7 64.325 1.561 -6.418 88 HB3 ARG 7 HB3 ARG 7 65.325 0.316 -7.168 89 HG2 ARG 7 HG2 ARG 7 63.250 -0.992 -7.654 90 HG3 ARG 7 HG3 ARG 7 62.297 0.350 -7.022 91 HD2 ARG 7 HD2 ARG 7 64.198 0.464 -9.380 92 HD3 ARG 7 HD3 ARG 7 62.439 0.504 -9.461 93 HE ARG 7 HE ARG 7 63.284 2.591 -7.781 94 HH11 ARG 7 HH11 ARG 7 63.470 1.732 -11.181 95 HH12 ARG 7 HH12 ARG 7 63.547 3.383 -11.696 96 HH21 ARG 7 HH21 ARG 7 63.386 4.699 -8.506 97 HH22 ARG 7 HH22 ARG 7 63.501 5.041 -10.200 98 H GLY 8 H GLY 8 66.618 -1.508 -5.356 99 HA2 GLY 8 HA2 GLY 8 67.727 -0.461 -2.943 100 HA3 GLY 8 HA3 GLY 8 68.584 -1.411 -4.153 101 H SER 9 H SER 9 68.966 1.290 -2.602 102 HA SER 9 HA SER 9 70.189 2.665 -4.898 103 HB2 SER 9 HB2 SER 9 68.005 3.763 -4.431 104 HB3 SER 9 HB3 SER 9 68.538 4.062 -2.780 105 HG SER 9 HG SER 9 68.950 5.786 -4.247 106 H GLY 10 H GLY 10 72.085 3.754 -4.424 107 HA2 GLY 10 HA2 GLY 10 73.546 2.871 -2.146 108 HA3 GLY 10 HA3 GLY 10 74.072 4.092 -3.303 109 H MET 11 H MET 11 73.802 3.767 -0.184 110 HA MET 11 HA MET 11 72.896 6.546 0.252 111 HB2 MET 11 HB2 MET 11 72.236 4.136 1.961 112 HB3 MET 11 HB3 MET 11 71.914 5.810 2.417 113 HG2 MET 11 HG2 MET 11 70.531 6.071 0.362 114 HG3 MET 11 HG3 MET 11 70.789 4.364 0.001 115 HE1 MET 11 HE1 MET 11 67.716 5.587 0.397 116 HE2 MET 11 HE2 MET 11 67.219 4.005 0.992 117 HE3 MET 11 HE3 MET 11 68.447 4.120 -0.266 118 H LYS 12 H LYS 12 73.816 7.555 2.147 119 HA LYS 12 HA LYS 12 76.535 6.591 2.670 120 HB2 LYS 12 HB2 LYS 12 75.175 9.222 3.300 121 HB3 LYS 12 HB3 LYS 12 76.855 8.844 3.682 122 HG2 LYS 12 HG2 LYS 12 77.269 8.403 1.262 123 HG3 LYS 12 HG3 LYS 12 75.616 8.911 0.916 124 HD2 LYS 12 HD2 LYS 12 76.118 11.119 1.970 125 HD3 LYS 12 HD3 LYS 12 77.796 10.608 2.164 126 HE2 LYS 12 HE2 LYS 12 78.046 10.359 -0.246 127 HE3 LYS 12 HE3 LYS 12 76.340 10.730 -0.492 128 HZ1 LYS 12 HZ1 LYS 12 78.406 12.550 0.617 129 HZ2 LYS 12 HZ2 LYS 12 76.748 12.911 0.537 130 HZ3 LYS 12 HZ3 LYS 12 77.640 12.685 -0.891 131 H GLU 13 H GLU 13 77.334 6.224 4.743 132 HA GLU 13 HA GLU 13 75.263 5.637 6.757 133 HB2 GLU 13 HB2 GLU 13 78.131 4.690 6.530 134 HB3 GLU 13 HB3 GLU 13 77.001 4.217 7.800 135 HG2 GLU 13 HG2 GLU 13 75.466 3.320 6.058 136 HG3 GLU 13 HG3 GLU 13 76.660 3.719 4.830 137 H THR 14 H THR 14 75.501 6.302 8.906 138 HA THR 14 HA THR 14 77.464 8.475 9.369 139 HB THR 14 HB THR 14 75.781 9.629 10.704 140 HG1 THR 14 HG1 THR 14 73.907 7.792 9.847 141 HG21 THR 14 HG21 THR 14 74.512 10.485 8.925 142 HG22 THR 14 HG22 THR 14 74.396 8.916 8.129 143 HG23 THR 14 HG23 THR 14 75.920 9.803 8.110 144 H ALA 15 H ALA 15 77.917 8.851 11.684 145 HA ALA 15 HA ALA 15 77.471 6.516 13.409 146 HB1 ALA 15 HB1 ALA 15 79.725 6.450 12.080 147 HB2 ALA 15 HB2 ALA 15 79.724 6.085 13.805 148 HB3 ALA 15 HB3 ALA 15 80.231 7.678 13.240 149 H ALA 16 H ALA 16 77.821 6.947 15.658 150 HA ALA 16 HA ALA 16 76.908 9.482 16.498 151 HB1 ALA 16 HB1 ALA 16 78.093 7.110 17.915 152 HB2 ALA 16 HB2 ALA 16 76.446 7.739 17.990 153 HB3 ALA 16 HB3 ALA 16 77.757 8.602 18.794 154 H ALA 17 H ALA 17 77.947 11.224 17.418 155 HA ALA 17 HA ALA 17 80.856 11.367 16.932 156 HB1 ALA 17 HB1 ALA 17 79.688 13.077 15.741 157 HB2 ALA 17 HB2 ALA 17 80.443 13.861 17.129 158 HB3 ALA 17 HB3 ALA 17 78.719 13.491 17.155 159 H LYS 18 H LYS 18 82.261 12.071 18.523 160 HA LYS 18 HA LYS 18 81.284 11.765 21.262 161 HB2 LYS 18 HB2 LYS 18 84.082 12.028 20.135 162 HB3 LYS 18 HB3 LYS 18 83.705 11.792 21.842 163 HG2 LYS 18 HG2 LYS 18 82.504 9.688 21.251 164 HG3 LYS 18 HG3 LYS 18 83.012 9.903 19.575 165 HD2 LYS 18 HD2 LYS 18 85.390 9.906 20.341 166 HD3 LYS 18 HD3 LYS 18 84.830 9.551 21.975 167 HE2 LYS 18 HE2 LYS 18 83.595 7.546 20.907 168 HE3 LYS 18 HE3 LYS 18 84.641 7.819 19.514 169 HZ1 LYS 18 HZ1 LYS 18 85.368 6.242 21.449 170 HZ2 LYS 18 HZ2 LYS 18 85.857 7.696 22.177 171 HZ3 LYS 18 HZ3 LYS 18 86.500 7.239 20.673 172 H PHE 19 H PHE 19 81.483 13.336 22.852 173 HA PHE 19 HA PHE 19 81.819 16.092 21.838 174 HB2 PHE 19 HB2 PHE 19 80.379 15.051 24.279 175 HB3 PHE 19 HB3 PHE 19 80.528 16.743 23.846 176 HD1 PHE 19 HD1 PHE 19 79.373 17.621 21.820 177 HD2 PHE 19 HD2 PHE 19 78.808 13.595 23.204 178 HE1 PHE 19 HE1 PHE 19 77.333 17.427 20.423 179 HE2 PHE 19 HE2 PHE 19 76.768 13.401 21.808 180 HZ PHE 19 HZ PHE 19 76.030 15.318 20.417 181 H GLU 20 H GLU 20 83.354 17.396 22.648 182 HA GLU 20 HA GLU 20 85.140 16.285 24.717 183 HB2 GLU 20 HB2 GLU 20 86.113 16.934 22.501 184 HB3 GLU 20 HB3 GLU 20 85.642 18.602 22.835 185 HG2 GLU 20 HG2 GLU 20 86.984 18.525 24.931 186 HG3 GLU 20 HG3 GLU 20 87.509 16.901 24.510 187 H ARG 21 H ARG 21 85.607 17.408 26.576 188 HA ARG 21 HA ARG 21 83.642 19.208 27.557 189 HB2 ARG 21 HB2 ARG 21 84.998 17.667 28.979 190 HB3 ARG 21 HB3 ARG 21 86.405 18.688 28.676 191 HG2 ARG 21 HG2 ARG 21 85.186 20.626 29.632 192 HG3 ARG 21 HG3 ARG 21 83.818 19.569 29.988 193 HD2 ARG 21 HD2 ARG 21 85.329 18.155 31.385 194 HD3 ARG 21 HD3 ARG 21 86.623 19.316 31.104 195 HE ARG 21 HE ARG 21 85.590 20.777 32.588 196 HH11 ARG 21 HH11 ARG 21 83.376 18.150 31.864 197 HH12 ARG 21 HH12 ARG 21 82.262 18.614 33.107 198 HH21 ARG 21 HH21 ARG 21 84.119 21.326 34.171 199 HH22 ARG 21 HH22 ARG 21 82.679 20.390 34.396 200 H GLN 22 H GLN 22 83.656 21.403 27.806 201 HA GLN 22 HA GLN 22 85.703 22.855 26.259 202 HB2 GLN 22 HB2 GLN 22 83.307 23.135 25.624 203 HB3 GLN 22 HB3 GLN 22 82.999 23.818 27.221 204 HG2 GLN 22 HG2 GLN 22 84.618 25.610 26.791 205 HG3 GLN 22 HG3 GLN 22 84.988 24.918 25.214 206 HE21 GLN 22 HE21 GLN 22 84.117 27.516 25.167 207 HE22 GLN 22 HE22 GLN 22 82.513 27.611 24.617 208 H HIS 23 H HIS 23 87.090 24.206 27.217 209 HA HIS 23 HA HIS 23 86.670 24.867 30.078 210 HB2 HIS 23 HB2 HIS 23 89.250 24.533 28.540 211 HB3 HIS 23 HB3 HIS 23 89.130 25.041 30.213 212 HD1 HIS 23 HD1 HIS 23 87.880 23.174 31.824 213 HD2 HIS 23 HD2 HIS 23 89.492 21.811 28.229 214 HE1 HIS 23 HE1 HIS 23 88.115 20.664 32.051 215 H MET 24 H MET 24 86.818 26.967 30.699 216 HA MET 24 HA MET 24 87.254 28.972 28.560 217 HB2 MET 24 HB2 MET 24 85.579 29.119 31.077 218 HB3 MET 24 HB3 MET 24 85.838 30.462 29.961 219 HG2 MET 24 HG2 MET 24 84.914 29.017 28.119 220 HG3 MET 24 HG3 MET 24 84.498 27.815 29.340 221 HE1 MET 24 HE1 MET 24 83.677 29.880 31.844 222 HE2 MET 24 HE2 MET 24 83.192 28.253 31.374 223 HE3 MET 24 HE3 MET 24 81.968 29.499 31.601 224 H ASP 25 H ASP 25 88.562 30.731 28.957 225 HA ASP 25 HA ASP 25 90.672 30.365 30.847 226 HB2 ASP 25 HB2 ASP 25 89.942 32.744 29.124 227 HB3 ASP 25 HB3 ASP 25 91.438 32.588 30.042 228 H SER 26 H SER 26 91.109 31.454 32.740 229 HA SER 26 HA SER 26 88.918 32.321 34.307 230 HB2 SER 26 HB2 SER 26 91.869 32.832 34.761 231 HB3 SER 26 HB3 SER 26 90.594 32.937 35.970 232 HG SER 26 HG SER 26 91.910 30.821 35.206 233 HA PRO 27 HA PRO 27 88.638 36.556 33.099 234 HB2 PRO 27 HB2 PRO 27 87.764 37.793 35.365 235 HB3 PRO 27 HB3 PRO 27 86.730 36.734 34.383 236 HG2 PRO 27 HG2 PRO 27 88.146 36.159 36.930 237 HG3 PRO 27 HG3 PRO 27 86.542 35.640 36.384 238 HD2 PRO 27 HD2 PRO 27 88.758 34.019 36.305 239 HD3 PRO 27 HD3 PRO 27 87.370 33.842 35.210 240 H ASP 28 H ASP 28 90.549 37.530 32.656 241 HA ASP 28 HA ASP 28 91.896 38.957 34.813 242 HB2 ASP 28 HB2 ASP 28 94.119 38.104 34.160 243 HB3 ASP 28 HB3 ASP 28 93.084 36.837 34.803 244 H LEU 29 H LEU 29 93.700 40.355 33.876 245 HA LEU 29 HA LEU 29 92.676 41.606 31.431 246 HB2 LEU 29 HB2 LEU 29 94.804 42.562 33.364 247 HB3 LEU 29 HB3 LEU 29 94.106 43.496 32.042 248 HG LEU 29 HG LEU 29 92.527 42.370 34.374 249 HD11 LEU 29 HD11 LEU 29 94.027 44.160 35.112 250 HD12 LEU 29 HD12 LEU 29 92.367 44.754 35.074 251 HD13 LEU 29 HD13 LEU 29 93.488 45.187 33.783 252 HD21 LEU 29 HD21 LEU 29 90.893 44.173 33.395 253 HD22 LEU 29 HD22 LEU 29 91.000 42.599 32.607 254 HD23 LEU 29 HD23 LEU 29 91.850 43.985 31.925 255 H GLY 30 H GLY 30 93.839 41.800 29.561 256 HA2 GLY 30 HA2 GLY 30 95.853 39.852 29.042 257 HA3 GLY 30 HA3 GLY 30 95.322 41.113 27.935 258 H THR 31 H THR 31 98.018 40.000 29.072 259 HA THR 31 HA THR 31 99.257 42.666 29.447 260 HB THR 31 HB THR 31 100.880 41.653 30.961 261 HG1 THR 31 HG1 THR 31 101.033 39.602 30.559 262 HG21 THR 31 HG21 THR 31 98.701 42.536 31.846 263 HG22 THR 31 HG22 THR 31 99.429 41.293 32.863 264 HG23 THR 31 HG23 THR 31 98.075 40.888 31.808 265 H ASP 32 H ASP 32 101.557 42.722 28.809 266 HA ASP 32 HA ASP 32 101.924 41.345 26.282 267 HB2 ASP 32 HB2 ASP 32 102.517 43.744 26.577 268 HB3 ASP 32 HB3 ASP 32 103.775 43.263 27.716 269 H ASP 33 H ASP 33 102.731 39.352 26.231 270 HA ASP 33 HA ASP 33 105.133 38.736 27.765 271 HB2 ASP 33 HB2 ASP 33 104.216 36.692 28.726 272 HB3 ASP 33 HB3 ASP 33 103.291 38.087 29.270 273 H ASP 34 H ASP 34 105.806 36.368 27.217 274 HA ASP 34 HA ASP 34 106.206 36.215 24.422 275 HB2 ASP 34 HB2 ASP 34 106.557 34.107 26.566 276 HB3 ASP 34 HB3 ASP 34 107.152 33.969 24.914 277 H ASP 35 H ASP 35 105.395 34.735 22.894 278 HA ASP 35 HA ASP 35 102.617 34.282 22.993 279 HB2 ASP 35 HB2 ASP 35 104.727 33.025 21.226 280 HB3 ASP 35 HB3 ASP 35 102.990 32.912 20.954 281 H LYS 36 H LYS 36 101.393 32.481 23.408 282 HA LYS 36 HA LYS 36 102.684 30.430 25.050 283 HB2 LYS 36 HB2 LYS 36 99.769 31.047 24.512 284 HB3 LYS 36 HB3 LYS 36 100.342 29.772 25.588 285 HG2 LYS 36 HG2 LYS 36 101.578 31.491 26.908 286 HG3 LYS 36 HG3 LYS 36 100.879 32.742 25.879 287 HD2 LYS 36 HD2 LYS 36 98.602 31.948 26.531 288 HD3 LYS 36 HD3 LYS 36 99.354 30.810 27.649 289 HE2 LYS 36 HE2 LYS 36 100.375 32.638 28.893 290 HE3 LYS 36 HE3 LYS 36 99.761 33.813 27.730 291 HZ1 LYS 36 HZ1 LYS 36 97.591 33.488 28.421 292 HZ2 LYS 36 HZ2 LYS 36 98.457 33.429 29.882 293 HZ3 LYS 36 HZ3 LYS 36 97.925 31.993 29.149 294 H THR 37 H THR 37 102.353 28.189 24.697 295 HA THR 37 HA THR 37 101.708 27.474 21.892 296 HB THR 37 HB THR 37 103.333 25.666 22.081 297 HG1 THR 37 HG1 THR 37 104.105 26.673 24.532 298 HG21 THR 37 HG21 THR 37 104.658 28.184 23.098 299 HG22 THR 37 HG22 THR 37 104.027 28.047 21.457 300 HG23 THR 37 HG23 THR 37 105.320 26.976 21.995 301 H GLY 38 H GLY 38 100.931 25.231 21.624 302 HA2 GLY 38 HA2 GLY 38 98.859 24.682 23.581 303 HA3 GLY 38 HA3 GLY 38 99.079 23.873 22.032 304 H GLY 39 H GLY 39 98.477 22.122 23.782 305 HA2 GLY 39 HA2 GLY 39 100.744 21.168 25.329 306 HA3 GLY 39 HA3 GLY 39 99.150 20.425 25.238 307 H GLY 40 H GLY 40 100.702 18.496 25.114 308 HA2 GLY 40 HA2 GLY 40 102.015 18.042 22.582 309 HA3 GLY 40 HA3 GLY 40 101.844 16.881 23.896 310 H ARG 41 H ARG 41 101.483 15.623 21.726 311 HA ARG 41 HA ARG 41 98.569 15.564 21.168 312 HB2 ARG 41 HB2 ARG 41 100.824 14.829 19.284 313 HB3 ARG 41 HB3 ARG 41 99.102 14.792 18.915 314 HG2 ARG 41 HG2 ARG 41 100.606 17.291 19.735 315 HG3 ARG 41 HG3 ARG 41 100.261 16.849 18.065 316 HD2 ARG 41 HD2 ARG 41 97.822 16.807 18.638 317 HD3 ARG 41 HD3 ARG 41 98.230 17.408 20.242 318 HE ARG 41 HE ARG 41 99.403 19.238 18.656 319 HH11 ARG 41 HH11 ARG 41 96.155 17.907 18.585 320 HH12 ARG 41 HH12 ARG 41 95.472 19.350 17.913 321 HH21 ARG 41 HH21 ARG 41 98.466 21.067 17.789 322 HH22 ARG 41 HH22 ARG 41 96.765 21.115 17.469 323 H ALA 42 H ALA 42 97.625 13.520 20.859 324 HA ALA 42 HA ALA 42 98.501 11.480 22.576 325 HB1 ALA 42 HB1 ALA 42 96.689 10.196 21.746 326 HB2 ALA 42 HB2 ALA 42 96.707 11.030 20.192 327 HB3 ALA 42 HB3 ALA 42 96.152 11.872 21.638 328 H ASP 43 H ASP 43 99.318 9.381 22.115 329 HA ASP 43 HA ASP 43 101.555 9.305 20.450 330 HB2 ASP 43 HB2 ASP 43 99.908 6.978 21.467 331 HB3 ASP 43 HB3 ASP 43 101.557 6.879 20.853 332 HA PRO 44 HA PRO 44 99.954 8.577 16.418 333 HB2 PRO 44 HB2 PRO 44 101.760 6.812 15.326 334 HB3 PRO 44 HB3 PRO 44 102.069 8.547 15.527 335 HG2 PRO 44 HG2 PRO 44 102.965 6.263 17.204 336 HG3 PRO 44 HG3 PRO 44 103.838 7.735 16.734 337 HD2 PRO 44 HD2 PRO 44 102.729 7.435 19.199 338 HD3 PRO 44 HD3 PRO 44 102.866 9.016 18.398 339 H ALA 45 H ALA 45 99.207 6.826 14.885 340 HA ALA 45 HA ALA 45 98.627 4.262 16.185 341 HB1 ALA 45 HB1 ALA 45 96.763 6.067 16.541 342 HB2 ALA 45 HB2 ALA 45 96.310 4.434 16.053 343 HB3 ALA 45 HB3 ALA 45 96.373 5.726 14.855 344 H HIS 46 H HIS 46 97.837 2.643 14.684 345 HA HIS 46 HA HIS 46 99.084 2.921 12.078 346 HB2 HIS 46 HB2 HIS 46 99.334 0.846 13.355 347 HB3 HIS 46 HB3 HIS 46 97.596 0.617 13.343 348 HD1 HIS 46 HD1 HIS 46 96.539 -0.335 11.208 349 HD2 HIS 46 HD2 HIS 46 100.638 0.334 10.848 350 HE1 HIS 46 HE1 HIS 46 97.261 -1.458 9.058 351 H ARG 47 H ARG 47 98.066 3.091 10.139 352 HA ARG 47 HA ARG 47 95.162 2.823 10.004 353 HB2 ARG 47 HB2 ARG 47 94.834 5.044 9.059 354 HB3 ARG 47 HB3 ARG 47 95.549 5.170 10.664 355 HG2 ARG 47 HG2 ARG 47 97.809 5.355 9.556 356 HG3 ARG 47 HG3 ARG 47 96.974 5.448 8.004 357 HD2 ARG 47 HD2 ARG 47 95.694 7.416 8.861 358 HD3 ARG 47 HD3 ARG 47 96.659 7.359 10.334 359 HE ARG 47 HE ARG 47 98.209 7.502 7.888 360 HH11 ARG 47 HH11 ARG 47 96.644 9.380 10.408 361 HH12 ARG 47 HH12 ARG 47 97.630 10.775 10.119 362 HH21 ARG 47 HH21 ARG 47 99.447 9.328 7.562 363 HH22 ARG 47 HH22 ARG 47 99.197 10.744 8.527 364 H SER 48 H SER 48 94.357 3.024 7.750 365 HA SER 48 HA SER 48 95.833 1.347 6.022 366 HB2 SER 48 HB2 SER 48 93.626 3.192 5.120 367 HB3 SER 48 HB3 SER 48 94.051 1.604 4.492 368 HG SER 48 HG SER 48 92.252 1.702 5.985 369 HA PRO 49 HA PRO 49 98.602 3.884 3.708 370 HB2 PRO 49 HB2 PRO 49 97.036 3.324 1.225 371 HB3 PRO 49 HB3 PRO 49 98.777 3.155 1.522 372 HG2 PRO 49 HG2 PRO 49 97.165 1.041 1.433 373 HG3 PRO 49 HG3 PRO 49 98.547 1.118 2.538 374 HD2 PRO 49 HD2 PRO 49 95.648 1.335 3.152 375 HD3 PRO 49 HD3 PRO 49 96.982 0.767 4.179 376 H VAL 50 H VAL 50 98.648 6.071 3.606 377 HA VAL 50 HA VAL 50 96.127 7.500 3.274 378 HB VAL 50 HB VAL 50 98.887 8.537 3.976 379 HG11 VAL 50 HG11 VAL 50 97.731 10.569 4.657 380 HG12 VAL 50 HG12 VAL 50 96.170 9.854 4.252 381 HG13 VAL 50 HG13 VAL 50 97.330 10.221 2.975 382 HG21 VAL 50 HG21 VAL 50 98.053 7.027 5.699 383 HG22 VAL 50 HG22 VAL 50 96.484 7.833 5.689 384 HG23 VAL 50 HG23 VAL 50 97.911 8.688 6.277 385 HA PRO 51 HA PRO 51 96.900 8.328 -1.056 386 HB2 PRO 51 HB2 PRO 51 95.952 11.110 -0.543 387 HB3 PRO 51 HB3 PRO 51 95.402 9.934 -1.752 388 HG2 PRO 51 HG2 PRO 51 93.962 10.491 0.418 389 HG3 PRO 51 HG3 PRO 51 94.013 8.864 -0.284 390 HD2 PRO 51 HD2 PRO 51 95.308 9.873 2.204 391 HD3 PRO 51 HD3 PRO 51 94.718 8.245 1.816 392 H LEU 52 H LEU 52 98.443 9.380 -2.373 393 HA LEU 52 HA LEU 52 100.810 10.183 -1.054 394 HB2 LEU 52 HB2 LEU 52 99.895 10.212 -3.918 395 HB3 LEU 52 HB3 LEU 52 101.431 10.949 -3.464 396 HG LEU 52 HG LEU 52 100.689 8.119 -2.693 397 HD11 LEU 52 HD11 LEU 52 100.741 7.977 -5.040 398 HD12 LEU 52 HD12 LEU 52 102.409 7.618 -4.592 399 HD13 LEU 52 HD13 LEU 52 101.980 9.224 -5.181 400 HD21 LEU 52 HD21 LEU 52 103.294 8.065 -2.656 401 HD22 LEU 52 HD22 LEU 52 102.458 8.869 -1.326 402 HD23 LEU 52 HD23 LEU 52 103.176 9.824 -2.624 403 HA PRO 53 HA PRO 53 100.074 14.548 -0.622 404 HB2 PRO 53 HB2 PRO 53 102.586 15.596 -0.823 405 HB3 PRO 53 HB3 PRO 53 102.018 14.719 0.612 406 HG2 PRO 53 HG2 PRO 53 103.759 13.788 -1.606 407 HG3 PRO 53 HG3 PRO 53 103.840 13.427 0.128 408 HD2 PRO 53 HD2 PRO 53 102.790 11.694 -1.727 409 HD3 PRO 53 HD3 PRO 53 102.312 11.714 -0.016 410 H SER 54 H SER 54 99.905 16.488 -1.844 411 HA SER 54 HA SER 54 99.461 16.137 -4.562 412 HB2 SER 54 HB2 SER 54 99.616 18.755 -4.563 413 HB3 SER 54 HB3 SER 54 98.338 17.957 -3.652 414 HG SER 54 HG SER 54 99.699 19.576 -2.557 415 HA PRO 55 HA PRO 55 103.628 16.180 -5.925 416 HB2 PRO 55 HB2 PRO 55 103.349 16.264 -8.608 417 HB3 PRO 55 HB3 PRO 55 102.822 14.865 -7.651 418 HG2 PRO 55 HG2 PRO 55 101.213 17.029 -8.873 419 HG3 PRO 55 HG3 PRO 55 100.826 15.315 -8.651 420 HD2 PRO 55 HD2 PRO 55 99.921 17.402 -7.017 421 HD3 PRO 55 HD3 PRO 55 99.901 15.676 -6.599 422 H THR 56 H THR 56 104.954 17.880 -5.552 423 HA THR 56 HA THR 56 104.650 20.408 -6.943 424 HB THR 56 HB THR 56 106.792 20.991 -5.933 425 HG1 THR 56 HG1 THR 56 107.818 19.339 -4.723 426 HG21 THR 56 HG21 THR 56 106.238 20.666 -3.557 427 HG22 THR 56 HG22 THR 56 105.073 19.417 -3.995 428 HG23 THR 56 HG23 THR 56 104.798 21.089 -4.483 429 H SER 57 H SER 57 106.361 21.152 -8.520 430 HA SER 57 HA SER 57 106.390 19.357 -10.675 431 HB2 SER 57 HB2 SER 57 106.604 21.822 -10.900 432 HB3 SER 57 HB3 SER 57 108.232 21.719 -10.239 433 HG SER 57 HG SER 57 108.247 21.635 -12.487 434 H ASN 58 H ASN 58 107.573 17.634 -11.068 435 HA ASN 58 HA ASN 58 109.341 16.204 -11.250 436 HB2 ASN 58 HB2 ASN 58 110.995 18.610 -10.468 437 HB3 ASN 58 HB3 ASN 58 111.594 17.129 -11.215 438 HD21 ASN 58 HD21 ASN 58 109.636 16.668 -13.188 439 HD22 ASN 58 HD22 ASN 58 109.645 17.952 -14.297 440 H LYS 59 H LYS 59 108.047 16.787 -8.472 441 HA LYS 59 HA LYS 59 109.923 15.178 -6.960 442 HB2 LYS 59 HB2 LYS 59 110.844 17.473 -6.745 443 HB3 LYS 59 HB3 LYS 59 109.318 17.992 -6.029 444 HG2 LYS 59 HG2 LYS 59 109.608 16.418 -4.182 445 HG3 LYS 59 HG3 LYS 59 111.087 15.795 -4.916 446 HD2 LYS 59 HD2 LYS 59 111.726 17.380 -3.208 447 HD3 LYS 59 HD3 LYS 59 112.049 18.117 -4.777 448 HE2 LYS 59 HE2 LYS 59 110.209 19.562 -4.624 449 HE3 LYS 59 HE3 LYS 59 109.399 18.557 -3.422 450 HZ1 LYS 59 HZ1 LYS 59 110.228 20.244 -2.135 451 HZ2 LYS 59 HZ2 LYS 59 111.629 20.439 -3.077 452 HZ3 LYS 59 HZ3 LYS 59 111.491 19.117 -2.019 453 H GLN 60 H GLN 60 108.987 14.108 -5.273 454 HA GLN 60 HA GLN 60 106.470 15.113 -4.149 455 HB2 GLN 60 HB2 GLN 60 106.847 12.287 -5.154 456 HB3 GLN 60 HB3 GLN 60 105.563 12.771 -4.049 457 HG2 GLN 60 HG2 GLN 60 104.877 14.500 -5.769 458 HG3 GLN 60 HG3 GLN 60 106.024 13.734 -6.872 459 HE21 GLN 60 HE21 GLN 60 102.891 13.303 -5.252 460 HE22 GLN 60 HE22 GLN 60 102.477 11.890 -6.095 461 H ASP 61 H ASP 61 106.082 14.460 -2.001 462 HA ASP 61 HA ASP 61 108.414 13.369 -0.591 463 HB2 ASP 61 HB2 ASP 61 105.828 14.563 0.439 464 HB3 ASP 61 HB3 ASP 61 107.155 14.005 1.453 465 H ILE 62 H ILE 62 108.497 11.281 0.031 466 HA ILE 62 HA ILE 62 105.967 9.731 0.073 467 HB ILE 62 HB ILE 62 107.315 9.271 -1.954 468 HG12 ILE 62 HG12 ILE 62 107.594 6.733 -1.429 469 HG13 ILE 62 HG13 ILE 62 106.902 7.149 0.137 470 HG21 ILE 62 HG21 ILE 62 109.465 8.026 -1.664 471 HG22 ILE 62 HG22 ILE 62 109.403 8.398 0.059 472 HG23 ILE 62 HG23 ILE 62 109.551 9.702 -1.120 473 HD11 ILE 62 HD11 ILE 62 105.087 8.388 -1.288 474 HD12 ILE 62 HD12 ILE 62 104.992 6.636 -1.107 475 HD13 ILE 62 HD13 ILE 62 105.651 7.336 -2.587 476 H SER 63 H SER 63 105.736 8.222 1.727 477 HA SER 63 HA SER 63 107.940 7.958 3.644 478 HB2 SER 63 HB2 SER 63 106.646 8.702 5.521 479 HB3 SER 63 HB3 SER 63 106.569 9.960 4.294 480 HG SER 63 HG SER 63 104.517 9.571 4.905 481 H GLU 64 H GLU 64 107.510 6.357 5.329 482 HA GLU 64 HA GLU 64 106.604 3.926 4.351 483 HB2 GLU 64 HB2 GLU 64 106.661 3.159 6.707 484 HB3 GLU 64 HB3 GLU 64 108.101 4.073 6.261 485 HG2 GLU 64 HG2 GLU 64 107.079 6.110 7.249 486 HG3 GLU 64 HG3 GLU 64 105.709 5.141 7.779 487 H ALA 65 H ALA 65 104.827 6.427 6.111 488 HA ALA 65 HA ALA 65 102.565 4.919 6.813 489 HB1 ALA 65 HB1 ALA 65 103.079 7.830 6.337 490 HB2 ALA 65 HB2 ALA 65 102.602 7.006 7.822 491 HB3 ALA 65 HB3 ALA 65 101.418 7.271 6.540 492 H ASN 66 H ASN 66 103.383 6.621 3.815 493 HA ASN 66 HA ASN 66 100.804 6.347 2.634 494 HB2 ASN 66 HB2 ASN 66 103.476 6.757 1.280 495 HB3 ASN 66 HB3 ASN 66 101.887 7.028 0.566 496 HD21 ASN 66 HD21 ASN 66 100.492 8.703 1.760 497 HD22 ASN 66 HD22 ASN 66 101.289 10.029 2.458 498 H LEU 67 H LEU 67 103.835 4.487 2.267 499 HA LEU 67 HA LEU 67 102.520 2.723 0.367 500 HB2 LEU 67 HB2 LEU 67 105.322 2.489 1.454 501 HB3 LEU 67 HB3 LEU 67 104.665 1.692 0.031 502 HG LEU 67 HG LEU 67 105.102 4.668 0.404 503 HD11 LEU 67 HD11 LEU 67 106.312 3.203 -1.888 504 HD12 LEU 67 HD12 LEU 67 106.966 2.808 -0.308 505 HD13 LEU 67 HD13 LEU 67 106.975 4.477 -0.869 506 HD21 LEU 67 HD21 LEU 67 104.384 4.821 -2.006 507 HD22 LEU 67 HD22 LEU 67 103.080 4.394 -0.898 508 HD23 LEU 67 HD23 LEU 67 103.835 3.149 -1.894 509 H ALA 68 H ALA 68 102.809 2.694 3.763 510 HA ALA 68 HA ALA 68 102.181 1.133 5.311 511 HB1 ALA 68 HB1 ALA 68 100.595 -0.582 4.592 512 HB2 ALA 68 HB2 ALA 68 101.038 -0.320 2.905 513 HB3 ALA 68 HB3 ALA 68 100.211 0.949 3.809 514 H TYR 69 H TYR 69 102.139 -1.891 4.514 515 HA TYR 69 HA TYR 69 104.663 -2.529 5.500 516 HB2 TYR 69 HB2 TYR 69 102.753 -4.071 5.462 517 HB3 TYR 69 HB3 TYR 69 102.879 -4.185 3.716 518 HD1 TYR 69 HD2 TYR 69 104.492 -5.044 6.933 519 HD2 TYR 69 HD1 TYR 69 104.558 -5.562 2.669 520 HE1 TYR 69 HE2 TYR 69 106.102 -6.914 7.184 521 HE2 TYR 69 HE1 TYR 69 106.168 -7.431 2.921 522 HH TYR 69 HH TYR 69 107.964 -8.002 5.097 523 H LEU 70 H LEU 70 103.699 -1.772 2.237 524 HA LEU 70 HA LEU 70 105.669 -3.090 0.750 525 HB2 LEU 70 HB2 LEU 70 104.422 -0.389 0.196 526 HB3 LEU 70 HB3 LEU 70 105.247 -1.410 -0.982 527 HG LEU 70 HG LEU 70 102.780 -2.237 0.578 528 HD11 LEU 70 HD11 LEU 70 103.138 -1.218 -2.255 529 HD12 LEU 70 HD12 LEU 70 102.166 -0.490 -0.976 530 HD13 LEU 70 HD13 LEU 70 101.678 -2.028 -1.686 531 HD21 LEU 70 HD21 LEU 70 104.491 -3.525 -1.547 532 HD22 LEU 70 HD22 LEU 70 102.796 -3.974 -1.364 533 HD23 LEU 70 HD23 LEU 70 103.919 -4.213 -0.026 534 H TRP 71 H TRP 71 105.967 -0.294 2.808 535 HA TRP 71 HA TRP 71 108.105 1.057 1.658 536 HB2 TRP 71 HB2 TRP 71 106.707 1.697 3.675 537 HB3 TRP 71 HB3 TRP 71 107.761 0.658 4.615 538 HD1 TRP 71 HD1 TRP 71 109.787 1.800 5.619 539 HE1 TRP 71 HE1 TRP 71 111.070 3.991 5.183 540 HE3 TRP 71 HE3 TRP 71 107.330 3.463 1.465 541 HZ2 TRP 71 HZ2 TRP 71 111.085 6.151 3.301 542 HZ3 TRP 71 HZ3 TRP 71 108.007 5.571 0.365 543 HH2 TRP 71 HH2 TRP 71 109.870 6.922 1.278 544 HA PRO 72 HA PRO 72 110.940 -2.437 2.503 545 HB2 PRO 72 HB2 PRO 72 112.695 -2.110 0.512 546 HB3 PRO 72 HB3 PRO 72 111.032 -2.646 0.184 547 HG2 PRO 72 HG2 PRO 72 112.253 0.037 -0.175 548 HG3 PRO 72 HG3 PRO 72 111.068 -0.812 -1.184 549 HD2 PRO 72 HD2 PRO 72 110.468 1.156 0.716 550 HD3 PRO 72 HD3 PRO 72 109.307 0.019 0.001 551 H LEU 73 H LEU 73 111.679 0.919 2.681 552 HA LEU 73 HA LEU 73 114.516 0.513 3.263 553 HB2 LEU 73 HB2 LEU 73 112.914 3.076 3.298 554 HB3 LEU 73 HB3 LEU 73 114.668 2.922 3.324 555 HG LEU 73 HG LEU 73 112.870 2.005 1.062 556 HD11 LEU 73 HD11 LEU 73 113.146 4.514 1.488 557 HD12 LEU 73 HD12 LEU 73 113.609 3.943 -0.121 558 HD13 LEU 73 HD13 LEU 73 114.850 4.291 1.084 559 HD21 LEU 73 HD21 LEU 73 115.052 1.764 -0.145 560 HD22 LEU 73 HD22 LEU 73 114.903 0.649 1.210 561 HD23 LEU 73 HD23 LEU 73 115.893 2.101 1.369 562 H THR 74 H THR 74 115.502 0.879 5.176 563 HA THR 74 HA THR 74 114.044 0.582 7.600 564 HB THR 74 HB THR 74 116.215 0.888 8.693 565 HG1 THR 74 HG1 THR 74 117.931 1.503 7.451 566 HG21 THR 74 HG21 THR 74 115.825 -1.309 7.800 567 HG22 THR 74 HG22 THR 74 117.487 -0.880 7.398 568 HG23 THR 74 HG23 THR 74 116.228 -0.779 6.167 569 H VAL 75 H VAL 75 115.510 3.373 5.934 570 HA VAL 75 HA VAL 75 114.964 5.250 8.006 571 HB VAL 75 HB VAL 75 115.126 6.975 6.222 572 HG11 VAL 75 HG11 VAL 75 117.227 4.789 6.205 573 HG12 VAL 75 HG12 VAL 75 117.170 6.192 7.274 574 HG13 VAL 75 HG13 VAL 75 117.473 6.409 5.550 575 HG21 VAL 75 HG21 VAL 75 115.713 6.225 3.926 576 HG22 VAL 75 HG22 VAL 75 114.081 5.737 4.379 577 HG23 VAL 75 HG23 VAL 75 115.394 4.560 4.404 578 H ASP 76 H ASP 76 113.088 6.287 8.540 579 HA ASP 76 HA ASP 76 110.750 4.849 7.857 580 HB2 ASP 76 HB2 ASP 76 109.572 6.412 9.316 581 HB3 ASP 76 HB3 ASP 76 111.087 5.907 10.061 582 H HIS 77 H HIS 77 112.060 7.880 6.599 583 HA HIS 77 HA HIS 77 110.101 7.659 4.467 584 HB2 HIS 77 HB2 HIS 77 109.221 9.855 4.618 585 HB3 HIS 77 HB3 HIS 77 109.002 9.084 6.172 586 HD1 HIS 77 HD1 HIS 77 110.657 9.908 8.114 587 HD2 HIS 77 HD2 HIS 77 110.626 12.245 4.663 588 HE1 HIS 77 HE1 HIS 77 111.682 12.133 8.749 589 H GLY 78 H GLY 78 110.520 9.457 2.806 590 HA2 GLY 78 HA2 GLY 78 113.053 10.756 2.744 591 HA3 GLY 78 HA3 GLY 78 113.054 9.300 1.751 592 H THR 79 H THR 79 113.374 11.842 0.651 593 HA THR 79 HA THR 79 110.785 12.363 -0.688 594 HB THR 79 HB THR 79 113.198 14.171 -0.781 595 HG1 THR 79 HG1 THR 79 112.739 14.063 1.331 596 HG21 THR 79 HG21 THR 79 111.171 15.807 -0.960 597 HG22 THR 79 HG22 THR 79 110.233 14.352 -1.305 598 HG23 THR 79 HG23 THR 79 111.570 14.814 -2.363 599 H ILE 80 H ILE 80 110.643 12.240 -2.905 600 HA ILE 80 HA ILE 80 112.995 11.097 -4.292 601 HB ILE 80 HB ILE 80 111.346 10.154 -5.886 602 HG12 ILE 80 HG12 ILE 80 109.287 11.165 -3.896 603 HG13 ILE 80 HG13 ILE 80 109.560 11.865 -5.489 604 HG21 ILE 80 HG21 ILE 80 110.770 9.468 -2.990 605 HG22 ILE 80 HG22 ILE 80 112.167 8.891 -3.898 606 HG23 ILE 80 HG23 ILE 80 110.540 8.410 -4.382 607 HD11 ILE 80 HD11 ILE 80 108.366 9.216 -4.774 608 HD12 ILE 80 HD12 ILE 80 109.208 9.389 -6.313 609 HD13 ILE 80 HD13 ILE 80 107.816 10.415 -5.950 610 H GLU 81 H GLU 81 113.780 12.079 -6.096 611 HA GLU 81 HA GLU 81 112.291 14.348 -7.218 612 HB2 GLU 81 HB2 GLU 81 113.736 15.217 -5.375 613 HB3 GLU 81 HB3 GLU 81 115.143 14.616 -6.252 614 HG2 GLU 81 HG2 GLU 81 114.478 16.003 -8.208 615 HG3 GLU 81 HG3 GLU 81 113.141 16.650 -7.269 616 H CYS 82 H CYS 82 112.676 14.772 -9.303 617 HA CYS 82 HA CYS 82 114.667 13.108 -10.718 618 HB2 CYS 82 HB2 CYS 82 112.032 14.304 -11.492 619 HB3 CYS 82 HB3 CYS 82 113.249 14.042 -12.741 620 H LEU 83 H LEU 83 116.465 14.097 -11.391 621 HA LEU 83 HA LEU 83 116.708 16.976 -11.139 622 HB2 LEU 83 HB2 LEU 83 118.625 14.748 -11.788 623 HB3 LEU 83 HB3 LEU 83 119.092 16.441 -11.960 624 HG LEU 83 HG LEU 83 117.822 15.478 -9.409 625 HD11 LEU 83 HD11 LEU 83 119.901 14.087 -10.169 626 HD12 LEU 83 HD12 LEU 83 119.869 14.739 -8.530 627 HD13 LEU 83 HD13 LEU 83 120.808 15.550 -9.782 628 HD21 LEU 83 HD21 LEU 83 119.701 17.718 -10.210 629 HD22 LEU 83 HD22 LEU 83 119.302 17.343 -8.533 630 HD23 LEU 83 HD23 LEU 83 118.037 17.868 -9.644 631 HA PRO 84 HA PRO 84 116.102 18.253 -15.337 632 HB2 PRO 84 HB2 PRO 84 118.867 19.373 -15.368 633 HB3 PRO 84 HB3 PRO 84 117.325 20.154 -15.768 634 HG2 PRO 84 HG2 PRO 84 118.579 20.662 -13.483 635 HG3 PRO 84 HG3 PRO 84 116.810 20.576 -13.573 636 HD2 PRO 84 HD2 PRO 84 118.728 18.600 -12.425 637 HD3 PRO 84 HD3 PRO 84 117.063 18.979 -11.931 638 H SER 85 H SER 85 118.934 16.409 -14.503 639 HA SER 85 HA SER 85 119.756 15.864 -17.216 640 HB2 SER 85 HB2 SER 85 121.459 14.501 -16.240 641 HB3 SER 85 HB3 SER 85 121.304 15.944 -15.243 642 HG SER 85 HG SER 85 120.107 13.469 -14.747 643 H ASP 86 H ASP 86 117.079 14.803 -15.677 644 HA ASP 86 HA ASP 86 115.667 13.035 -15.877 645 HB2 ASP 86 HB2 ASP 86 117.468 12.190 -18.163 646 HB3 ASP 86 HB3 ASP 86 115.863 11.562 -17.817 647 H ASN 87 H ASN 87 117.769 12.926 -14.005 648 HA ASN 87 HA ASN 87 118.246 10.005 -13.851 649 HB2 ASN 87 HB2 ASN 87 119.692 12.308 -12.518 650 HB3 ASN 87 HB3 ASN 87 119.994 10.608 -12.172 651 HD21 ASN 87 HD21 ASN 87 121.988 12.411 -13.293 652 HD22 ASN 87 HD22 ASN 87 122.368 11.838 -14.844 653 H ALA 88 H ALA 88 117.177 8.918 -12.312 654 HA ALA 88 HA ALA 88 115.473 10.442 -10.475 655 HB1 ALA 88 HB1 ALA 88 114.672 7.963 -10.021 656 HB2 ALA 88 HB2 ALA 88 115.469 7.655 -11.563 657 HB3 ALA 88 HB3 ALA 88 114.150 8.822 -11.470 658 H VAL 89 H VAL 89 116.092 10.761 -8.429 659 HA VAL 89 HA VAL 89 117.836 8.739 -7.149 660 HB VAL 89 HB VAL 89 119.050 10.579 -6.020 661 HG11 VAL 89 HG11 VAL 89 120.240 9.761 -7.853 662 HG12 VAL 89 HG12 VAL 89 120.114 11.477 -8.242 663 HG13 VAL 89 HG13 VAL 89 119.032 10.316 -9.013 664 HG21 VAL 89 HG21 VAL 89 118.809 12.876 -6.999 665 HG22 VAL 89 HG22 VAL 89 117.367 12.333 -6.141 666 HG23 VAL 89 HG23 VAL 89 117.408 12.299 -7.904 667 H PHE 90 H PHE 90 117.749 8.698 -4.879 668 HA PHE 90 HA PHE 90 115.204 9.650 -3.711 669 HB2 PHE 90 HB2 PHE 90 115.345 7.223 -3.924 670 HB3 PHE 90 HB3 PHE 90 116.900 7.222 -3.122 671 HD1 PHE 90 HD1 PHE 90 113.274 7.934 -2.618 672 HD2 PHE 90 HD2 PHE 90 117.055 7.059 -0.779 673 HE1 PHE 90 HE1 PHE 90 112.136 7.607 -0.427 674 HE2 PHE 90 HE2 PHE 90 115.920 6.716 1.398 675 HZ PHE 90 HZ PHE 90 113.460 6.990 1.571 676 H VAL 91 H VAL 91 115.403 11.082 -2.070 677 HA VAL 91 HA VAL 91 118.027 11.366 -0.740 678 HB VAL 91 HB VAL 91 115.712 13.309 -0.980 679 HG11 VAL 91 HG11 VAL 91 116.656 14.078 0.964 680 HG12 VAL 91 HG12 VAL 91 117.774 14.846 -0.159 681 HG13 VAL 91 HG13 VAL 91 118.220 13.336 0.640 682 HG21 VAL 91 HG21 VAL 91 117.364 14.571 -2.388 683 HG22 VAL 91 HG22 VAL 91 116.876 13.027 -3.089 684 HG23 VAL 91 HG23 VAL 91 118.442 13.179 -2.291 685 H ALA 92 H ALA 92 118.202 10.840 1.355 686 HA ALA 92 HA ALA 92 115.731 10.112 2.809 687 HB1 ALA 92 HB1 ALA 92 117.308 8.332 2.840 688 HB2 ALA 92 HB2 ALA 92 117.428 9.085 4.430 689 HB3 ALA 92 HB3 ALA 92 118.647 9.422 3.202 690 HA PRO 93 HA PRO 93 115.732 13.562 5.567 691 HB2 PRO 93 HB2 PRO 93 116.037 11.692 7.872 692 HB3 PRO 93 HB3 PRO 93 114.825 12.956 7.594 693 HG2 PRO 93 HG2 PRO 93 114.301 10.337 7.297 694 HG3 PRO 93 HG3 PRO 93 113.498 11.600 6.353 695 HD2 PRO 93 HD2 PRO 93 115.497 9.619 5.472 696 HD3 PRO 93 HD3 PRO 93 114.327 10.551 4.519 697 H ASP 94 H ASP 94 118.228 11.138 5.901 698 HA ASP 94 HA ASP 94 119.875 12.509 7.754 699 HB2 ASP 94 HB2 ASP 94 121.656 10.965 6.918 700 HB3 ASP 94 HB3 ASP 94 120.181 10.163 7.443 701 H GLY 95 H GLY 95 119.212 13.275 4.492 702 HA2 GLY 95 HA2 GLY 95 120.045 15.174 3.365 703 HA3 GLY 95 HA3 GLY 95 121.414 15.202 4.468 704 H THR 96 H THR 96 120.898 12.071 3.285 705 HA THR 96 HA THR 96 123.191 12.327 1.464 706 HB THR 96 HB THR 96 121.890 9.863 2.655 707 HG1 THR 96 HG1 THR 96 124.026 11.436 3.444 708 HG21 THR 96 HG21 THR 96 123.038 9.036 0.826 709 HG22 THR 96 HG22 THR 96 124.331 9.037 2.026 710 HG23 THR 96 HG23 THR 96 124.224 10.342 0.844 711 H THR 97 H THR 97 122.990 11.866 -0.686 712 HA THR 97 HA THR 97 120.281 11.198 -1.660 713 HB THR 97 HB THR 97 122.649 12.297 -3.203 714 HG1 THR 97 HG1 THR 97 121.829 13.757 -1.709 715 HG21 THR 97 HG21 THR 97 120.941 12.787 -4.910 716 HG22 THR 97 HG22 THR 97 119.705 12.053 -3.889 717 HG23 THR 97 HG23 THR 97 120.999 11.060 -4.559 718 H TYR 98 H TYR 98 119.904 9.315 -2.577 719 HA TYR 98 HA TYR 98 122.163 7.531 -3.244 720 HB2 TYR 98 HB2 TYR 98 119.347 6.809 -2.424 721 HB3 TYR 98 HB3 TYR 98 120.636 5.678 -2.774 722 HD1 TYR 98 HD1 TYR 98 119.261 8.063 -0.337 723 HD2 TYR 98 HD2 TYR 98 122.435 5.286 -1.151 724 HE1 TYR 98 HE1 TYR 98 119.897 8.089 2.058 725 HE2 TYR 98 HE2 TYR 98 123.060 5.301 1.249 726 HH TYR 98 HH TYR 98 121.461 7.402 3.549 727 H ALA 99 H ALA 99 121.954 6.308 -5.187 728 HA ALA 99 HA ALA 99 120.308 7.606 -7.209 729 HB1 ALA 99 HB1 ALA 99 122.630 5.723 -7.204 730 HB2 ALA 99 HB2 ALA 99 122.400 7.216 -8.110 731 HB3 ALA 99 HB3 ALA 99 121.583 5.741 -8.622 732 H LEU 100 H LEU 100 118.421 6.837 -7.937 733 HA LEU 100 HA LEU 100 117.447 4.273 -6.952 734 HB2 LEU 100 HB2 LEU 100 116.170 6.512 -8.526 735 HB3 LEU 100 HB3 LEU 100 115.357 4.980 -8.226 736 HG LEU 100 HG LEU 100 116.534 6.561 -5.948 737 HD11 LEU 100 HD11 LEU 100 113.820 6.877 -7.262 738 HD12 LEU 100 HD12 LEU 100 115.057 8.120 -7.089 739 HD13 LEU 100 HD13 LEU 100 114.213 7.510 -5.665 740 HD21 LEU 100 HD21 LEU 100 114.150 4.691 -6.130 741 HD22 LEU 100 HD22 LEU 100 114.913 5.300 -4.661 742 HD23 LEU 100 HD23 LEU 100 115.774 4.160 -5.693 743 H ASN 101 H ASN 101 117.951 5.903 -10.074 744 HA ASN 101 HA ASN 101 117.655 3.280 -11.415 745 HB2 ASN 101 HB2 ASN 101 117.112 4.445 -13.416 746 HB3 ASN 101 HB3 ASN 101 116.161 5.148 -12.116 747 HD21 ASN 101 HD21 ASN 101 116.328 6.805 -14.203 748 HD22 ASN 101 HD22 ASN 101 117.483 8.028 -13.976 749 H ASP 102 H ASP 102 118.964 3.057 -13.473 750 HA ASP 102 HA ASP 102 121.599 2.652 -12.637 751 HB2 ASP 102 HB2 ASP 102 122.057 1.995 -14.936 752 HB3 ASP 102 HB3 ASP 102 120.502 1.352 -14.417 753 H ARG 103 H ARG 103 120.217 5.320 -14.534 754 HA ARG 103 HA ARG 103 122.686 6.363 -15.427 755 HB2 ARG 103 HB2 ARG 103 119.986 7.664 -15.051 756 HB3 ARG 103 HB3 ARG 103 121.364 8.466 -15.814 757 HG2 ARG 103 HG2 ARG 103 121.529 6.572 -17.430 758 HG3 ARG 103 HG3 ARG 103 120.074 5.876 -16.720 759 HD2 ARG 103 HD2 ARG 103 120.269 8.592 -18.048 760 HD3 ARG 103 HD3 ARG 103 119.528 7.155 -18.746 761 HE ARG 103 HE ARG 103 118.350 8.922 -16.820 762 HH11 ARG 103 HH11 ARG 103 118.383 5.565 -17.846 763 HH12 ARG 103 HH12 ARG 103 116.783 5.271 -17.252 764 HH21 ARG 103 HH21 ARG 103 116.324 8.498 -16.092 765 HH22 ARG 103 HH22 ARG 103 115.620 6.921 -16.262 766 H ALA 104 H ALA 104 120.732 7.106 -12.545 767 HA ALA 104 HA ALA 104 122.375 9.122 -11.497 768 HB1 ALA 104 HB1 ALA 104 120.731 7.064 -10.007 769 HB2 ALA 104 HB2 ALA 104 120.146 8.613 -10.609 770 HB3 ALA 104 HB3 ALA 104 121.357 8.567 -9.330 771 H GLU 105 H GLU 105 122.624 5.585 -11.249 772 HA GLU 105 HA GLU 105 124.786 5.515 -9.438 773 HB2 GLU 105 HB2 GLU 105 124.096 3.576 -11.659 774 HB3 GLU 105 HB3 GLU 105 125.246 3.264 -10.362 775 HG2 GLU 105 HG2 GLU 105 123.437 3.648 -8.700 776 HG3 GLU 105 HG3 GLU 105 122.296 3.862 -10.020 777 H LYS 106 H LYS 106 124.717 5.740 -12.986 778 HA LYS 106 HA LYS 106 127.486 5.736 -13.447 779 HB2 LYS 106 HB2 LYS 106 125.371 7.313 -14.932 780 HB3 LYS 106 HB3 LYS 106 126.984 6.924 -15.528 781 HG2 LYS 106 HG2 LYS 106 124.892 4.870 -14.760 782 HG3 LYS 106 HG3 LYS 106 125.235 5.380 -16.412 783 HD2 LYS 106 HD2 LYS 106 127.631 4.668 -16.041 784 HD3 LYS 106 HD3 LYS 106 127.119 3.969 -14.504 785 HE2 LYS 106 HE2 LYS 106 125.361 2.678 -15.835 786 HE3 LYS 106 HE3 LYS 106 126.236 3.177 -17.282 787 HZ1 LYS 106 HZ1 LYS 106 126.956 1.003 -16.457 788 HZ2 LYS 106 HZ2 LYS 106 127.433 1.716 -14.990 789 HZ3 LYS 106 HZ3 LYS 106 128.219 2.135 -16.438 790 H ALA 107 H ALA 107 125.352 8.319 -12.380 791 HA ALA 107 HA ALA 107 127.246 10.437 -12.577 792 HB1 ALA 107 HB1 ALA 107 124.652 10.502 -12.312 793 HB2 ALA 107 HB2 ALA 107 125.635 11.769 -11.578 794 HB3 ALA 107 HB3 ALA 107 125.011 10.451 -10.586 795 H GLY 108 H GLY 108 127.462 7.787 -10.617 796 HA2 GLY 108 HA2 GLY 108 128.868 7.319 -8.890 797 HA3 GLY 108 HA3 GLY 108 129.417 8.982 -8.930 798 H HIS 109 H HIS 109 125.991 8.363 -8.491 799 HA HIS 109 HA HIS 109 126.108 9.334 -5.773 800 HB2 HIS 109 HB2 HIS 109 123.949 8.570 -7.687 801 HB3 HIS 109 HB3 HIS 109 123.565 8.613 -5.976 802 HD1 HIS 109 HD1 HIS 109 125.414 11.130 -5.340 803 HD2 HIS 109 HD2 HIS 109 122.555 10.906 -8.367 804 HE1 HIS 109 HE1 HIS 109 124.750 13.514 -5.875 805 HA PRO 110 HA PRO 110 126.545 5.265 -4.011 806 HB2 PRO 110 HB2 PRO 110 125.427 5.592 -1.532 807 HB3 PRO 110 HB3 PRO 110 127.030 6.216 -1.968 808 HG2 PRO 110 HG2 PRO 110 124.426 7.644 -1.809 809 HG3 PRO 110 HG3 PRO 110 126.043 8.182 -1.317 810 HD2 PRO 110 HD2 PRO 110 124.886 8.988 -3.649 811 HD3 PRO 110 HD3 PRO 110 126.643 8.811 -3.459 812 HA PRO 111 HA PRO 111 122.545 3.359 -4.641 813 HB2 PRO 111 HB2 PRO 111 122.947 0.859 -3.656 814 HB3 PRO 111 HB3 PRO 111 123.680 1.420 -5.172 815 HG2 PRO 111 HG2 PRO 111 124.899 1.117 -2.485 816 HG3 PRO 111 HG3 PRO 111 125.601 0.839 -4.088 817 HD2 PRO 111 HD2 PRO 111 126.039 3.103 -2.549 818 HD3 PRO 111 HD3 PRO 111 126.261 3.016 -4.308 819 H ILE 112 H ILE 112 120.597 2.833 -3.564 820 HA ILE 112 HA ILE 112 120.300 3.698 -0.886 821 HB ILE 112 HB ILE 112 118.425 2.084 -2.636 822 HG12 ILE 112 HG12 ILE 112 118.443 5.009 -1.854 823 HG13 ILE 112 HG13 ILE 112 119.052 4.396 -3.390 824 HG21 ILE 112 HG21 ILE 112 117.856 3.538 -0.027 825 HG22 ILE 112 HG22 ILE 112 117.864 1.787 -0.232 826 HG23 ILE 112 HG23 ILE 112 116.652 2.763 -1.053 827 HD11 ILE 112 HD11 ILE 112 116.200 4.200 -2.359 828 HD12 ILE 112 HD12 ILE 112 116.776 3.453 -3.852 829 HD13 ILE 112 HD13 ILE 112 116.769 5.209 -3.688 830 H THR 113 H THR 113 121.454 0.676 -2.079 831 HA THR 113 HA THR 113 120.222 -1.171 -0.512 832 HB THR 113 HB THR 113 121.910 -1.598 -2.318 833 HG1 THR 113 HG1 THR 113 122.129 -3.068 0.027 834 HG21 THR 113 HG21 THR 113 123.866 -0.444 -1.559 835 HG22 THR 113 HG22 THR 113 124.211 -2.166 -1.444 836 HG23 THR 113 HG23 THR 113 123.819 -1.251 0.008 837 HA PRO 114 HA PRO 114 123.331 -0.587 3.166 838 HB2 PRO 114 HB2 PRO 114 123.262 2.370 3.434 839 HB3 PRO 114 HB3 PRO 114 124.612 1.243 3.678 840 HG2 PRO 114 HG2 PRO 114 124.533 2.809 1.550 841 HG3 PRO 114 HG3 PRO 114 125.103 1.132 1.426 842 HD2 PRO 114 HD2 PRO 114 122.429 2.267 0.670 843 HD3 PRO 114 HD3 PRO 114 123.435 1.105 -0.218 844 H ILE 115 H ILE 115 120.676 1.632 2.453 845 HA ILE 115 HA ILE 115 119.569 1.237 5.139 846 HB ILE 115 HB ILE 115 117.816 2.887 4.356 847 HG12 ILE 115 HG12 ILE 115 119.822 3.449 2.159 848 HG13 ILE 115 HG13 ILE 115 118.331 2.548 1.897 849 HG21 ILE 115 HG21 ILE 115 120.514 4.163 4.189 850 HG22 ILE 115 HG22 ILE 115 120.083 3.283 5.658 851 HG23 ILE 115 HG23 ILE 115 119.094 4.638 5.121 852 HD11 ILE 115 HD11 ILE 115 117.005 4.412 2.107 853 HD12 ILE 115 HD12 ILE 115 118.476 5.214 1.557 854 HD13 ILE 115 HD13 ILE 115 118.077 5.186 3.273 855 H ARG 116 H ARG 116 119.404 -0.531 2.385 856 HA ARG 116 HA ARG 116 116.564 -0.928 2.175 857 HB2 ARG 116 HB2 ARG 116 118.184 -1.286 0.303 858 HB3 ARG 116 HB3 ARG 116 118.821 -2.680 1.173 859 HG2 ARG 116 HG2 ARG 116 116.533 -3.679 1.170 860 HG3 ARG 116 HG3 ARG 116 115.977 -2.323 0.186 861 HD2 ARG 116 HD2 ARG 116 118.184 -4.256 -0.578 862 HD3 ARG 116 HD3 ARG 116 116.545 -4.274 -1.222 863 HE ARG 116 HE ARG 116 117.806 -1.721 -1.560 864 HH11 ARG 116 HH11 ARG 116 117.615 -4.937 -2.954 865 HH12 ARG 116 HH12 ARG 116 118.079 -4.389 -4.530 866 HH21 ARG 116 HH21 ARG 116 118.404 -1.076 -3.611 867 HH22 ARG 116 HH22 ARG 116 118.518 -2.231 -4.897 868 H ALA 117 H ALA 117 115.323 -2.535 3.100 869 HA ALA 117 HA ALA 117 116.416 -3.795 5.465 870 HB1 ALA 117 HB1 ALA 117 114.043 -2.742 5.079 871 HB2 ALA 117 HB2 ALA 117 114.211 -4.184 6.081 872 HB3 ALA 117 HB3 ALA 117 113.666 -4.330 4.410 873 H LYS 118 H LYS 118 116.782 -5.937 5.801 874 HA LYS 118 HA LYS 118 116.706 -7.725 3.488 875 HB2 LYS 118 HB2 LYS 118 118.660 -7.597 5.134 876 HB3 LYS 118 HB3 LYS 118 117.603 -8.410 6.290 877 HG2 LYS 118 HG2 LYS 118 117.218 -10.152 4.420 878 HG3 LYS 118 HG3 LYS 118 118.640 -9.445 3.653 879 HD2 LYS 118 HD2 LYS 118 118.626 -10.423 6.518 880 HD3 LYS 118 HD3 LYS 118 119.116 -11.433 5.157 881 HE2 LYS 118 HE2 LYS 118 121.162 -10.534 5.847 882 HE3 LYS 118 HE3 LYS 118 120.685 -9.417 4.568 883 HZ1 LYS 118 HZ1 LYS 118 120.487 -7.761 6.017 884 HZ2 LYS 118 HZ2 LYS 118 121.292 -8.750 7.139 885 HZ3 LYS 118 HZ3 LYS 118 119.594 -8.699 7.111 886 H GLY 119 H GLY 119 115.354 -9.489 3.312 887 HA2 GLY 119 HA2 GLY 119 113.086 -9.528 5.193 888 HA3 GLY 119 HA3 GLY 119 113.057 -10.140 3.553 889 H SER 120 H SER 120 112.091 -11.725 5.552 890 HA SER 120 HA SER 120 113.883 -13.493 6.781 891 HB2 SER 120 HB2 SER 120 111.422 -13.369 7.224 892 HB3 SER 120 HB3 SER 120 111.147 -14.175 5.683 893 HG SER 120 HG SER 120 111.281 -15.717 7.246 894 H GLY 121 H GLY 121 112.470 -13.534 3.531 895 HA2 GLY 121 HA2 GLY 121 114.605 -15.372 2.695 896 HA3 GLY 121 HA3 GLY 121 112.936 -15.810 2.337 897 H GLY 122 H GLY 122 114.730 -15.488 0.277 898 HA2 GLY 122 HA2 GLY 122 114.695 -14.543 -1.836 899 HA3 GLY 122 HA3 GLY 122 113.423 -13.460 -1.288 900 H GLY 123 H GLY 123 116.503 -13.705 0.391 901 HA2 GLY 123 HA2 GLY 123 118.260 -12.241 0.624 902 HA3 GLY 123 HA3 GLY 123 117.903 -11.689 -1.008 903 H TYR 124 H TYR 124 117.457 -9.600 -1.146 904 HA TYR 124 HA TYR 124 116.482 -8.191 1.260 905 HB2 TYR 124 HB2 TYR 124 118.145 -7.362 -1.093 906 HB3 TYR 124 HB3 TYR 124 117.303 -6.167 -0.122 907 HD1 TYR 124 HD1 TYR 124 119.116 -9.320 0.781 908 HD2 TYR 124 HD2 TYR 124 118.864 -5.054 1.205 909 HE1 TYR 124 HE1 TYR 124 120.992 -9.370 2.405 910 HE2 TYR 124 HE2 TYR 124 120.731 -5.105 2.837 911 HH TYR 124 HH TYR 124 122.638 -7.850 3.330 912 H ILE 125 H ILE 125 114.998 -6.414 0.958 913 HA ILE 125 HA ILE 125 112.792 -7.250 -0.701 914 HB ILE 125 HB ILE 125 113.122 -4.915 1.201 915 HG12 ILE 125 HG12 ILE 125 111.660 -7.542 1.569 916 HG13 ILE 125 HG13 ILE 125 113.307 -7.273 2.126 917 HG21 ILE 125 HG21 ILE 125 110.717 -4.697 1.132 918 HG22 ILE 125 HG22 ILE 125 110.571 -6.102 0.075 919 HG23 ILE 125 HG23 ILE 125 111.312 -4.619 -0.527 920 HD11 ILE 125 HD11 ILE 125 112.229 -6.665 4.044 921 HD12 ILE 125 HD12 ILE 125 110.747 -6.214 3.199 922 HD13 ILE 125 HD13 ILE 125 112.120 -5.107 3.225 923 H SER 126 H SER 126 112.129 -6.413 -2.571 924 HA SER 126 HA SER 126 113.935 -4.940 -4.166 925 HB2 SER 126 HB2 SER 126 111.000 -5.493 -4.618 926 HB3 SER 126 HB3 SER 126 112.149 -4.955 -5.839 927 HG SER 126 HG SER 126 112.913 -6.910 -5.879 928 H LEU 127 H LEU 127 114.102 -2.880 -4.726 929 HA LEU 127 HA LEU 127 112.327 -0.895 -3.502 930 HB2 LEU 127 HB2 LEU 127 114.792 -0.483 -5.208 931 HB3 LEU 127 HB3 LEU 127 113.937 0.751 -4.286 932 HG LEU 127 HG LEU 127 115.292 -1.685 -3.089 933 HD11 LEU 127 HD11 LEU 127 116.979 -0.116 -2.292 934 HD12 LEU 127 HD12 LEU 127 116.105 1.237 -3.010 935 HD13 LEU 127 HD13 LEU 127 116.855 0.023 -4.046 936 HD21 LEU 127 HD21 LEU 127 113.727 0.634 -1.963 937 HD22 LEU 127 HD22 LEU 127 114.954 -0.175 -0.989 938 HD23 LEU 127 HD23 LEU 127 113.570 -1.085 -1.596 939 H GLY 128 H GLY 128 111.871 -2.736 -6.096 940 HA2 GLY 128 HA2 GLY 128 111.844 -1.249 -8.398 941 HA3 GLY 128 HA3 GLY 128 110.664 -2.503 -8.049 942 H ALA 129 H ALA 129 109.248 -1.297 -5.937 943 HA ALA 129 HA ALA 129 107.380 0.215 -7.398 944 HB1 ALA 129 HB1 ALA 129 107.819 -0.178 -4.440 945 HB2 ALA 129 HB2 ALA 129 106.576 -0.891 -5.468 946 HB3 ALA 129 HB3 ALA 129 106.508 0.825 -5.063 947 H LEU 130 H LEU 130 109.855 1.259 -5.064 948 HA LEU 130 HA LEU 130 109.212 3.994 -5.062 949 HB2 LEU 130 HB2 LEU 130 110.727 2.873 -3.435 950 HB3 LEU 130 HB3 LEU 130 111.943 2.737 -4.706 951 HG LEU 130 HG LEU 130 111.826 5.241 -4.977 952 HD11 LEU 130 HD11 LEU 130 109.998 4.871 -2.604 953 HD12 LEU 130 HD12 LEU 130 109.734 5.837 -4.055 954 HD13 LEU 130 HD13 LEU 130 110.890 6.375 -2.837 955 HD21 LEU 130 HD21 LEU 130 113.434 3.848 -3.436 956 HD22 LEU 130 HD22 LEU 130 112.513 4.579 -2.121 957 HD23 LEU 130 HD23 LEU 130 113.382 5.601 -3.264 958 H LEU 131 H LEU 131 111.386 2.110 -7.131 959 HA LEU 131 HA LEU 131 112.543 4.251 -8.536 960 HB2 LEU 131 HB2 LEU 131 113.364 1.910 -8.619 961 HB3 LEU 131 HB3 LEU 131 111.936 1.459 -9.547 962 HG LEU 131 HG LEU 131 112.633 3.221 -11.252 963 HD11 LEU 131 HD11 LEU 131 114.158 4.613 -10.152 964 HD12 LEU 131 HD12 LEU 131 115.227 3.570 -11.091 965 HD13 LEU 131 HD13 LEU 131 114.980 3.261 -9.372 966 HD21 LEU 131 HD21 LEU 131 113.019 0.763 -11.514 967 HD22 LEU 131 HD22 LEU 131 114.599 0.965 -10.757 968 HD23 LEU 131 HD23 LEU 131 114.257 1.739 -12.305 969 H SER 132 H SER 132 109.597 2.376 -9.179 970 HA SER 132 HA SER 132 109.022 3.459 -11.702 971 HB2 SER 132 HB2 SER 132 107.039 2.519 -9.615 972 HB3 SER 132 HB3 SER 132 106.746 2.666 -11.344 973 HG SER 132 HG SER 132 107.640 0.793 -11.500 974 H THR 133 H THR 133 108.094 4.549 -8.452 975 HA THR 133 HA THR 133 106.340 6.598 -9.265 976 HB THR 133 HB THR 133 108.095 6.572 -6.798 977 HG1 THR 133 HG1 THR 133 106.921 4.904 -6.402 978 HG21 THR 133 HG21 THR 133 106.908 8.714 -7.376 979 HG22 THR 133 HG22 THR 133 106.395 8.005 -5.845 980 HG23 THR 133 HG23 THR 133 105.383 7.834 -7.279 981 H THR 134 H THR 134 109.829 6.679 -8.554 982 HA THR 134 HA THR 134 110.125 9.468 -8.916 983 HB THR 134 HB THR 134 112.258 7.384 -9.415 984 HG1 THR 134 HG1 THR 134 111.297 8.502 -7.055 985 HG21 THR 134 HG21 THR 134 112.850 9.679 -10.053 986 HG22 THR 134 HG22 THR 134 113.727 9.213 -8.596 987 HG23 THR 134 HG23 THR 134 112.321 10.270 -8.478 988 H LEU 135 H LEU 135 110.428 6.760 -11.196 989 HA LEU 135 HA LEU 135 111.397 8.244 -13.381 990 HB2 LEU 135 HB2 LEU 135 109.709 5.733 -13.327 991 HB3 LEU 135 HB3 LEU 135 110.500 6.376 -14.767 992 HG LEU 135 HG LEU 135 111.989 5.692 -12.221 993 HD11 LEU 135 HD11 LEU 135 112.757 3.682 -13.509 994 HD12 LEU 135 HD12 LEU 135 111.560 4.068 -14.746 995 HD13 LEU 135 HD13 LEU 135 111.038 3.639 -13.118 996 HD21 LEU 135 HD21 LEU 135 113.262 7.224 -13.510 997 HD22 LEU 135 HD22 LEU 135 112.761 6.484 -15.031 998 HD23 LEU 135 HD23 LEU 135 113.890 5.642 -13.969 999 H ASN 136 H ASN 136 108.086 7.634 -12.265 1000 HA ASN 136 HA ASN 136 106.701 8.729 -14.442 1001 HB2 ASN 136 HB2 ASN 136 105.660 7.505 -12.525 1002 HB3 ASN 136 HB3 ASN 136 105.924 8.932 -11.524 1003 HD21 ASN 136 HD21 ASN 136 104.303 7.919 -14.575 1004 HD22 ASN 136 HD22 ASN 136 103.068 9.078 -14.474 1005 H LEU 137 H LEU 137 107.987 10.268 -11.519 1006 HA LEU 137 HA LEU 137 107.158 12.900 -12.101 1007 HB2 LEU 137 HB2 LEU 137 109.598 11.996 -10.553 1008 HB3 LEU 137 HB3 LEU 137 108.871 13.601 -10.489 1009 HG LEU 137 HG LEU 137 107.437 11.036 -9.743 1010 HD11 LEU 137 HD11 LEU 137 107.591 12.251 -7.422 1011 HD12 LEU 137 HD12 LEU 137 108.963 13.082 -8.155 1012 HD13 LEU 137 HD13 LEU 137 108.974 11.326 -8.003 1013 HD21 LEU 137 HD21 LEU 137 105.841 12.735 -8.707 1014 HD22 LEU 137 HD22 LEU 137 105.852 12.690 -10.470 1015 HD23 LEU 137 HD23 LEU 137 106.707 13.973 -9.615 1016 H CYS 138 H CYS 138 110.051 11.113 -13.060 1017 HA CYS 138 HA CYS 138 111.523 13.230 -14.137 1018 HB2 CYS 138 HB2 CYS 138 111.444 10.284 -14.612 1019 HB3 CYS 138 HB3 CYS 138 112.364 11.289 -15.726 1020 H GLY 139 H GLY 139 108.696 11.616 -15.451 1021 HA2 GLY 139 HA2 GLY 139 107.346 12.670 -17.105 1022 HA3 GLY 139 HA3 GLY 139 108.770 13.514 -17.693 1023 H LYS 140 H LYS 140 108.985 10.081 -17.076 1024 HA LYS 140 HA LYS 140 110.032 9.401 -19.525 1025 HB2 LYS 140 HB2 LYS 140 109.578 7.101 -18.960 1026 HB3 LYS 140 HB3 LYS 140 110.026 7.969 -17.495 1027 HG2 LYS 140 HG2 LYS 140 107.595 8.230 -16.959 1028 HG3 LYS 140 HG3 LYS 140 107.213 7.238 -18.367 1029 HD2 LYS 140 HD2 LYS 140 108.731 5.453 -17.356 1030 HD3 LYS 140 HD3 LYS 140 108.722 6.417 -15.878 1031 HE2 LYS 140 HE2 LYS 140 106.230 6.311 -15.866 1032 HE3 LYS 140 HE3 LYS 140 106.296 5.253 -17.276 1033 HZ1 LYS 140 HZ1 LYS 140 107.458 4.713 -14.597 1034 HZ2 LYS 140 HZ2 LYS 140 107.674 3.719 -15.958 1035 HZ3 LYS 140 HZ3 LYS 140 106.124 3.934 -15.298 1036 H GLY 141 H GLY 141 109.272 8.507 -21.440 1037 HA2 GLY 141 HA2 GLY 141 106.362 8.525 -21.888 1038 HA3 GLY 141 HA3 GLY 141 107.390 9.488 -22.945
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