NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
581082 | 2mj6 | 19707 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 -4.812 -3.692 -3.768 2 H2 GLY 1 H2 GLY 1 -3.649 -3.279 -4.844 3 H3 GLY 1 H3 GLY 1 -3.961 -2.307 -3.563 4 HA2 GLY 1 HA2 GLY 1 -3.199 -3.991 -2.014 5 HA3 GLY 1 HA3 GLY 1 -2.862 -5.042 -3.401 6 H SER 2 H SER 2 -0.781 -4.809 -1.911 7 HA SER 2 HA SER 2 0.906 -2.545 -2.153 8 HB2 SER 2 HB2 SER 2 1.676 -5.452 -1.707 9 HB3 SER 2 HB3 SER 2 2.679 -4.033 -1.350 10 HG SER 2 HG SER 2 1.570 -4.783 0.504 11 H GLU 3 H GLU 3 2.996 -2.402 -3.171 12 HA GLU 3 HA GLU 3 3.361 -3.768 -5.783 13 HB2 GLU 3 HB2 GLU 3 3.050 -0.752 -5.472 14 HB3 GLU 3 HB3 GLU 3 3.825 -1.529 -6.851 15 HG2 GLU 3 HG2 GLU 3 1.724 -2.790 -7.321 16 HG3 GLU 3 HG3 GLU 3 0.927 -1.895 -6.018 17 H THR 4 H THR 4 5.408 -3.611 -6.681 18 HA THR 4 HA THR 4 7.646 -2.740 -4.893 19 HB THR 4 HB THR 4 7.679 -4.799 -7.132 20 HG1 THR 4 HG1 THR 4 7.781 -6.267 -5.430 21 HG21 THR 4 HG21 THR 4 9.942 -3.983 -6.790 22 HG22 THR 4 HG22 THR 4 9.809 -5.544 -5.991 23 HG23 THR 4 HG23 THR 4 9.756 -4.060 -5.016 24 H ARG 5 H ARG 5 9.606 -1.951 -6.102 25 HA ARG 5 HA ARG 5 9.324 -0.633 -8.638 26 HB2 ARG 5 HB2 ARG 5 9.587 1.051 -6.084 27 HB3 ARG 5 HB3 ARG 5 9.976 1.654 -7.689 28 HG2 ARG 5 HG2 ARG 5 7.215 0.790 -6.741 29 HG3 ARG 5 HG3 ARG 5 7.787 2.438 -7.000 30 HD2 ARG 5 HD2 ARG 5 8.157 1.934 -9.408 31 HD3 ARG 5 HD3 ARG 5 7.536 0.306 -9.162 32 HE ARG 5 HE ARG 5 5.996 2.841 -9.183 33 HH11 ARG 5 HH12 ARG 5 5.770 -0.657 -8.635 34 HH12 ARG 5 HH11 ARG 5 4.013 -0.580 -8.873 35 HH21 ARG 5 HH21 ARG 5 3.726 2.685 -9.415 36 HH22 ARG 5 HH22 ARG 5 2.997 1.089 -9.216 37 H THR 6 H THR 6 11.396 0.479 -9.200 38 HA THR 6 HA THR 6 13.659 -1.221 -8.189 39 HB THR 6 HB THR 6 13.406 0.060 -10.910 40 HG1 THR 6 HG1 THR 6 12.983 -2.645 -10.190 41 HG21 THR 6 HG21 THR 6 15.243 -2.128 -9.827 42 HG22 THR 6 HG22 THR 6 15.724 -0.485 -10.303 43 HG23 THR 6 HG23 THR 6 15.139 -1.616 -11.529 44 H ILE 7 H ILE 7 14.613 -0.004 -6.669 45 HA ILE 7 HA ILE 7 15.256 2.787 -6.920 46 HB ILE 7 HB ILE 7 16.285 0.638 -5.036 47 HG12 ILE 7 HG12 ILE 7 13.873 0.815 -4.840 48 HG13 ILE 7 HG13 ILE 7 14.641 1.489 -3.423 49 HG21 ILE 7 HG21 ILE 7 16.501 3.668 -4.792 50 HG22 ILE 7 HG22 ILE 7 16.726 2.538 -3.446 51 HG23 ILE 7 HG23 ILE 7 17.820 2.463 -4.813 52 HD11 ILE 7 HD11 ILE 7 13.389 3.085 -5.705 53 HD12 ILE 7 HD12 ILE 7 12.731 2.845 -4.082 54 HD13 ILE 7 HD13 ILE 7 14.206 3.798 -4.292 55 H SER 8 H SER 8 17.525 3.576 -6.725 56 HA SER 8 HA SER 8 19.352 2.202 -8.670 57 HB2 SER 8 HB2 SER 8 18.425 4.173 -9.753 58 HB3 SER 8 HB3 SER 8 18.908 5.183 -8.385 59 HG SER 8 HG SER 8 20.513 3.862 -10.296 60 H SER 9 H SER 9 21.416 1.949 -8.117 61 HA SER 9 HA SER 9 22.611 3.460 -5.838 62 HB2 SER 9 HB2 SER 9 23.294 0.612 -6.590 63 HB3 SER 9 HB3 SER 9 23.848 1.521 -5.188 64 HG SER 9 HG SER 9 21.660 1.545 -4.440 65 H THR 10 H THR 10 22.537 4.059 -8.733 66 HA THR 10 HA THR 10 25.409 3.964 -9.456 67 HB THR 10 HB THR 10 24.690 3.453 -11.822 68 HG1 THR 10 HG1 THR 10 22.705 2.299 -11.976 69 HG21 THR 10 HG21 THR 10 24.593 1.040 -11.539 70 HG22 THR 10 HG22 THR 10 24.101 1.213 -9.839 71 HG23 THR 10 HG23 THR 10 25.727 1.715 -10.356 72 H ALA 11 H ALA 11 22.399 5.010 -11.068 73 HA ALA 11 HA ALA 11 23.347 7.635 -11.717 74 HB1 ALA 11 HB1 ALA 11 20.501 6.544 -11.601 75 HB2 ALA 11 HB2 ALA 11 21.049 7.999 -12.464 76 HB3 ALA 11 HB3 ALA 11 21.617 6.405 -12.980 77 H GLN 12 H GLN 12 21.124 6.482 -9.110 78 HA GLN 12 HA GLN 12 20.967 9.098 -7.853 79 HB2 GLN 12 HB2 GLN 12 19.199 7.445 -7.647 80 HB3 GLN 12 HB3 GLN 12 20.297 6.318 -6.849 81 HG2 GLN 12 HG2 GLN 12 18.723 7.465 -5.294 82 HG3 GLN 12 HG3 GLN 12 20.415 7.669 -4.880 83 HE21 GLN 12 HE21 GLN 12 20.495 9.659 -3.871 84 HE22 GLN 12 HE22 GLN 12 19.845 11.135 -4.567 85 H GLU 13 H GLU 13 23.280 6.412 -7.494 86 HA GLU 13 HA GLU 13 24.544 7.523 -5.155 87 HB2 GLU 13 HB2 GLU 13 24.705 5.174 -5.701 88 HB3 GLU 13 HB3 GLU 13 25.492 5.507 -7.223 89 HG2 GLU 13 HG2 GLU 13 27.145 4.762 -5.668 90 HG3 GLU 13 HG3 GLU 13 27.452 6.458 -6.005 91 H ARG 14 H ARG 14 25.541 7.684 -8.526 92 HA ARG 14 HA ARG 14 27.792 9.238 -8.211 93 HB2 ARG 14 HB2 ARG 14 27.789 9.940 -10.502 94 HB3 ARG 14 HB3 ARG 14 27.435 8.228 -10.364 95 HG2 ARG 14 HG2 ARG 14 25.371 8.420 -11.276 96 HG3 ARG 14 HG3 ARG 14 25.020 9.998 -10.585 97 HD2 ARG 14 HD2 ARG 14 27.101 9.751 -12.765 98 HD3 ARG 14 HD3 ARG 14 25.389 9.679 -13.161 99 HE ARG 14 HE ARG 14 26.582 12.023 -11.655 100 HH11 ARG 14 HH21 ARG 14 24.490 10.953 -14.348 101 HH12 ARG 14 HH22 ARG 14 23.965 12.628 -14.559 102 HH21 ARG 14 HH12 ARG 14 25.813 14.014 -12.156 103 HH22 ARG 14 HH11 ARG 14 24.785 14.178 -13.596 104 H VAL 15 H VAL 15 24.531 10.508 -8.484 105 HA VAL 15 HA VAL 15 25.256 13.269 -8.530 106 HB VAL 15 HB VAL 15 23.024 13.832 -7.741 107 HG11 VAL 15 HG11 VAL 15 23.547 13.541 -10.119 108 HG12 VAL 15 HG12 VAL 15 23.095 11.825 -10.027 109 HG13 VAL 15 HG13 VAL 15 21.875 13.083 -9.749 110 HG21 VAL 15 HG21 VAL 15 21.289 12.159 -7.513 111 HG22 VAL 15 HG22 VAL 15 22.449 10.855 -7.809 112 HG23 VAL 15 HG23 VAL 15 22.556 11.823 -6.322 113 H ASP 16 H ASP 16 25.434 11.000 -5.884 114 HA ASP 16 HA ASP 16 25.343 13.031 -3.786 115 HB2 ASP 16 HB2 ASP 16 24.946 10.598 -3.411 116 HB3 ASP 16 HB3 ASP 16 26.644 10.283 -3.771 117 H LEU 17 H LEU 17 28.037 11.491 -5.578 118 HA LEU 17 HA LEU 17 30.119 12.674 -4.109 119 HB2 LEU 17 HB2 LEU 17 30.035 11.496 -6.929 120 HB3 LEU 17 HB3 LEU 17 31.503 12.049 -6.165 121 HG LEU 17 HG LEU 17 31.429 9.695 -6.027 122 HD11 LEU 17 HD11 LEU 17 31.754 9.300 -3.671 123 HD12 LEU 17 HD12 LEU 17 30.809 10.735 -3.236 124 HD13 LEU 17 HD13 LEU 17 32.371 10.912 -4.072 125 HD21 LEU 17 HD21 LEU 17 28.865 9.795 -4.411 126 HD22 LEU 17 HD22 LEU 17 29.771 8.370 -4.927 127 HD23 LEU 17 HD23 LEU 17 28.957 9.371 -6.137 128 H GLU 18 H GLU 18 28.685 13.674 -7.160 129 HA GLU 18 HA GLU 18 30.206 16.100 -7.498 130 HB2 GLU 18 HB2 GLU 18 28.436 16.690 -9.152 131 HB3 GLU 18 HB3 GLU 18 29.193 15.121 -9.399 132 HG2 GLU 18 HG2 GLU 18 27.166 14.155 -8.059 133 HG3 GLU 18 HG3 GLU 18 26.417 15.693 -8.342 134 H ALA 19 H ALA 19 27.229 15.399 -5.557 135 HA ALA 19 HA ALA 19 26.767 18.202 -4.944 136 HB1 ALA 19 HB1 ALA 19 25.248 17.328 -3.284 137 HB2 ALA 19 HB2 ALA 19 25.077 16.398 -4.793 138 HB3 ALA 19 HB3 ALA 19 25.955 15.703 -3.418 139 H VAL 20 H VAL 20 28.725 15.628 -3.370 140 HA VAL 20 HA VAL 20 29.681 17.323 -1.198 141 HB VAL 20 HB VAL 20 30.826 14.783 -2.415 142 HG11 VAL 20 HG11 VAL 20 31.635 16.240 0.142 143 HG12 VAL 20 HG12 VAL 20 32.130 14.590 -0.295 144 HG13 VAL 20 HG13 VAL 20 32.664 15.950 -1.281 145 HG21 VAL 20 HG21 VAL 20 29.910 13.714 -0.399 146 HG22 VAL 20 HG22 VAL 20 29.292 15.275 0.181 147 HG23 VAL 20 HG23 VAL 20 28.615 14.525 -1.278 148 H ARG 21 H ARG 21 30.987 16.619 -4.438 149 HA ARG 21 HA ARG 21 33.248 18.294 -4.345 150 HB2 ARG 21 HB2 ARG 21 32.616 16.680 -6.145 151 HB3 ARG 21 HB3 ARG 21 31.453 17.840 -6.773 152 HG2 ARG 21 HG2 ARG 21 34.308 18.739 -6.383 153 HG3 ARG 21 HG3 ARG 21 33.997 17.586 -7.654 154 HD2 ARG 21 HD2 ARG 21 32.729 20.334 -7.367 155 HD3 ARG 21 HD3 ARG 21 33.998 19.901 -8.509 156 HE ARG 21 HE ARG 21 31.272 19.775 -9.039 157 HH11 ARG 21 HH12 ARG 21 33.942 17.535 -9.598 158 HH12 ARG 21 HH11 ARG 21 33.028 16.696 -10.826 159 HH21 ARG 21 HH21 ARG 21 30.286 18.683 -10.717 160 HH22 ARG 21 HH22 ARG 21 31.060 17.273 -11.370 161 H LEU 22 H LEU 22 29.881 19.310 -5.178 162 HA LEU 22 HA LEU 22 30.610 22.109 -5.257 163 HB2 LEU 22 HB2 LEU 22 27.999 20.638 -5.340 164 HB3 LEU 22 HB3 LEU 22 28.037 22.341 -4.844 165 HG LEU 22 HG LEU 22 29.411 22.858 -6.913 166 HD11 LEU 22 HD11 LEU 22 30.095 20.582 -7.529 167 HD12 LEU 22 HD12 LEU 22 29.117 21.312 -8.822 168 HD13 LEU 22 HD13 LEU 22 28.391 20.107 -7.742 169 HD21 LEU 22 HD21 LEU 22 26.590 21.817 -7.248 170 HD22 LEU 22 HD22 LEU 22 27.428 23.006 -8.295 171 HD23 LEU 22 HD23 LEU 22 27.072 23.408 -6.600 172 H ALA 23 H ALA 23 29.403 20.097 -2.503 173 HA ALA 23 HA ALA 23 29.291 22.281 -0.677 174 HB1 ALA 23 HB1 ALA 23 30.234 19.431 -0.164 175 HB2 ALA 23 HB2 ALA 23 29.594 20.579 1.037 176 HB3 ALA 23 HB3 ALA 23 28.538 19.958 -0.241 177 H SER 24 H SER 24 32.108 20.448 -1.829 178 HA SER 24 HA SER 24 34.070 21.953 -0.456 179 HB2 SER 24 HB2 SER 24 34.538 20.571 -3.114 180 HB3 SER 24 HB3 SER 24 35.701 20.955 -1.853 181 HG SER 24 HG SER 24 33.536 19.093 -1.666 182 H ILE 25 H ILE 25 32.651 22.601 -3.760 183 HA ILE 25 HA ILE 25 34.418 24.851 -4.109 184 HB ILE 25 HB ILE 25 31.806 24.746 -5.559 185 HG12 ILE 25 HG12 ILE 25 32.462 22.513 -5.953 186 HG13 ILE 25 HG13 ILE 25 32.890 23.427 -7.339 187 HG21 ILE 25 HG21 ILE 25 34.651 25.649 -6.230 188 HG22 ILE 25 HG22 ILE 25 33.279 25.712 -7.335 189 HG23 ILE 25 HG23 ILE 25 33.255 26.683 -5.874 190 HD11 ILE 25 HD11 ILE 25 34.545 21.734 -6.815 191 HD12 ILE 25 HD12 ILE 25 35.268 23.361 -6.719 192 HD13 ILE 25 HD13 ILE 25 34.846 22.447 -5.237 193 H VAL 26 H VAL 26 31.175 24.493 -2.670 194 HA VAL 26 HA VAL 26 30.580 27.329 -2.421 195 HB VAL 26 HB VAL 26 29.608 24.887 -0.919 196 HG11 VAL 26 HG11 VAL 26 27.655 26.401 -0.298 197 HG12 VAL 26 HG12 VAL 26 29.176 26.705 0.548 198 HG13 VAL 26 HG13 VAL 26 28.698 27.771 -0.762 199 HG21 VAL 26 HG21 VAL 26 29.012 25.047 -3.416 200 HG22 VAL 26 HG22 VAL 26 27.625 25.069 -2.343 201 HG23 VAL 26 HG23 VAL 26 28.225 26.583 -3.064 202 H ASP 27 H ASP 27 32.116 24.933 -0.089 203 HA ASP 27 HA ASP 27 32.700 26.786 1.967 204 HB2 ASP 27 HB2 ASP 27 33.207 24.461 2.243 205 HB3 ASP 27 HB3 ASP 27 34.292 24.455 0.850 206 H SER 28 H SER 28 34.556 26.235 -1.018 207 HA SER 28 HA SER 28 36.604 28.147 -0.557 208 HB2 SER 28 HB2 SER 28 36.535 26.335 -2.358 209 HB3 SER 28 HB3 SER 28 35.517 27.435 -3.303 210 HG SER 28 HG SER 28 38.193 27.808 -2.435 211 H ARG 29 H ARG 29 33.303 28.603 -1.780 212 HA ARG 29 HA ARG 29 33.687 31.463 -2.369 213 HB2 ARG 29 HB2 ARG 29 32.099 29.949 -3.599 214 HB3 ARG 29 HB3 ARG 29 31.115 29.825 -2.153 215 HG2 ARG 29 HG2 ARG 29 30.145 31.399 -3.653 216 HG3 ARG 29 HG3 ARG 29 30.715 32.260 -2.214 217 HD2 ARG 29 HD2 ARG 29 32.627 33.128 -3.455 218 HD3 ARG 29 HD3 ARG 29 32.234 32.079 -4.840 219 HE ARG 29 HE ARG 29 30.071 33.915 -4.060 220 HH11 ARG 29 HH11 ARG 29 33.019 33.789 -5.953 221 HH12 ARG 29 HH12 ARG 29 32.482 35.021 -7.059 222 HH21 ARG 29 HH21 ARG 29 29.347 35.370 -5.662 223 HH22 ARG 29 HH22 ARG 29 30.492 35.917 -6.848 224 H LEU 30 H LEU 30 32.307 29.563 0.376 225 HA LEU 30 HA LEU 30 31.420 31.902 1.803 226 HB2 LEU 30 HB2 LEU 30 32.243 29.184 2.872 227 HB3 LEU 30 HB3 LEU 30 31.376 30.438 3.770 228 HG LEU 30 HG LEU 30 30.343 28.917 1.355 229 HD11 LEU 30 HD11 LEU 30 29.374 28.938 4.234 230 HD12 LEU 30 HD12 LEU 30 30.343 27.625 3.522 231 HD13 LEU 30 HD13 LEU 30 28.722 27.969 2.905 232 HD21 LEU 30 HD21 LEU 30 29.006 31.129 2.953 233 HD22 LEU 30 HD22 LEU 30 28.167 30.036 1.834 234 HD23 LEU 30 HD23 LEU 30 29.389 31.134 1.208 235 H ILE 31 H ILE 31 34.567 30.214 1.792 236 HA ILE 31 HA ILE 31 35.872 32.116 3.565 237 HB ILE 31 HB ILE 31 36.919 30.092 1.549 238 HG12 ILE 31 HG12 ILE 31 36.892 30.012 4.607 239 HG13 ILE 31 HG13 ILE 31 35.657 29.259 3.606 240 HG21 ILE 31 HG21 ILE 31 38.499 31.699 3.613 241 HG22 ILE 31 HG22 ILE 31 39.142 30.356 2.644 242 HG23 ILE 31 HG23 ILE 31 38.644 31.831 1.845 243 HD11 ILE 31 HD11 ILE 31 37.195 27.557 4.263 244 HD12 ILE 31 HD12 ILE 31 37.397 27.837 2.524 245 HD13 ILE 31 HD13 ILE 31 38.590 28.474 3.686 246 H GLY 32 H GLY 32 35.323 31.968 0.058 247 HA2 GLY 32 HA2 GLY 32 37.278 33.858 -0.791 248 HA3 GLY 32 HA3 GLY 32 35.857 33.258 -1.675 249 H THR 33 H THR 33 33.841 34.159 -0.020 250 HA THR 33 HA THR 33 34.062 37.067 0.222 251 HB THR 33 HB THR 33 33.692 36.739 -2.214 252 HG1 THR 33 HG1 THR 33 32.033 38.234 -2.357 253 HG21 THR 33 HG21 THR 33 31.635 35.948 -3.099 254 HG22 THR 33 HG22 THR 33 30.880 35.832 -1.499 255 HG23 THR 33 HG23 THR 33 32.183 34.708 -1.947 256 H GLY 34 H GLY 34 32.095 34.116 0.660 257 HA2 GLY 34 HA2 GLY 34 31.014 33.769 2.704 258 HA3 GLY 34 HA3 GLY 34 30.729 35.486 2.929 259 H SER 35 H SER 35 29.861 34.504 -0.214 260 HA SER 35 HA SER 35 27.301 33.341 0.343 261 HB2 SER 35 HB2 SER 35 25.972 35.116 -0.801 262 HB3 SER 35 HB3 SER 35 26.627 35.619 0.762 263 HG SER 35 HG SER 35 26.917 37.220 -0.845 264 H VAL 36 H VAL 36 26.349 32.332 -1.444 265 HA VAL 36 HA VAL 36 28.094 32.048 -3.870 266 HB VAL 36 HB VAL 36 25.845 30.382 -2.679 267 HG11 VAL 36 HG11 VAL 36 26.489 28.728 -4.448 268 HG12 VAL 36 HG12 VAL 36 25.665 30.156 -5.073 269 HG13 VAL 36 HG13 VAL 36 27.433 30.013 -5.238 270 HG21 VAL 36 HG21 VAL 36 28.769 29.650 -3.093 271 HG22 VAL 36 HG22 VAL 36 28.066 30.139 -1.527 272 HG23 VAL 36 HG23 VAL 36 27.488 28.680 -2.345 273 H ASP 37 H ASP 37 27.252 32.609 -5.913 274 HA ASP 37 HA ASP 37 24.424 33.448 -6.072 275 HB2 ASP 37 HB2 ASP 37 26.657 34.548 -7.788 276 HB3 ASP 37 HB3 ASP 37 25.022 35.157 -7.591 277 H GLU 38 H GLU 38 23.402 32.942 -8.127 278 HA GLU 38 HA GLU 38 23.873 30.396 -9.081 279 HB2 GLU 38 HB2 GLU 38 21.870 32.070 -9.471 280 HB3 GLU 38 HB3 GLU 38 22.753 32.524 -10.932 281 HG2 GLU 38 HG2 GLU 38 22.820 29.863 -11.289 282 HG3 GLU 38 HG3 GLU 38 21.457 29.906 -10.179 283 H ASP 39 H ASP 39 25.304 33.401 -10.495 284 HA ASP 39 HA ASP 39 26.454 32.135 -12.741 285 HB2 ASP 39 HB2 ASP 39 25.928 34.562 -12.477 286 HB3 ASP 39 HB3 ASP 39 27.261 34.693 -11.325 287 H PHE 40 H PHE 40 27.467 32.118 -9.375 288 HA PHE 40 HA PHE 40 30.251 31.409 -10.018 289 HB2 PHE 40 HB2 PHE 40 29.722 32.585 -7.931 290 HB3 PHE 40 HB3 PHE 40 28.635 31.292 -7.438 291 HD1 PHE 40 HD2 PHE 40 32.212 32.001 -8.284 292 HD2 PHE 40 HD1 PHE 40 29.432 29.400 -6.245 293 HE1 PHE 40 HE2 PHE 40 34.112 30.787 -7.234 294 HE2 PHE 40 HE1 PHE 40 31.332 28.167 -5.236 295 HZ PHE 40 HZ PHE 40 33.675 28.886 -5.702 296 H LEU 41 H LEU 41 27.206 29.682 -9.224 297 HA LEU 41 HA LEU 41 28.614 27.106 -9.109 298 HB2 LEU 41 HB2 LEU 41 25.770 28.017 -8.639 299 HB3 LEU 41 HB3 LEU 41 26.126 26.303 -8.778 300 HG LEU 41 HG LEU 41 27.133 28.232 -6.682 301 HD11 LEU 41 HD11 LEU 41 25.516 25.641 -6.593 302 HD12 LEU 41 HD12 LEU 41 24.878 27.288 -6.363 303 HD13 LEU 41 HD13 LEU 41 26.002 26.588 -5.178 304 HD21 LEU 41 HD21 LEU 41 28.098 25.407 -7.223 305 HD22 LEU 41 HD22 LEU 41 28.241 26.190 -5.631 306 HD23 LEU 41 HD23 LEU 41 29.073 26.883 -7.016 307 H ARG 42 H ARG 42 26.589 28.656 -11.587 308 HA ARG 42 HA ARG 42 26.191 26.359 -13.207 309 HB2 ARG 42 HB2 ARG 42 26.004 27.845 -15.112 310 HB3 ARG 42 HB3 ARG 42 25.117 28.406 -13.699 311 HG2 ARG 42 HG2 ARG 42 26.941 30.033 -13.200 312 HG3 ARG 42 HG3 ARG 42 27.838 29.445 -14.601 313 HD2 ARG 42 HD2 ARG 42 26.778 31.435 -15.205 314 HD3 ARG 42 HD3 ARG 42 25.989 30.142 -16.094 315 HE ARG 42 HE ARG 42 24.173 30.288 -14.257 316 HH11 ARG 42 HH11 ARG 42 25.939 33.234 -15.086 317 HH12 ARG 42 HH12 ARG 42 24.465 34.159 -15.171 318 HH21 ARG 42 HH21 ARG 42 22.413 31.603 -14.123 319 HH22 ARG 42 HH22 ARG 42 22.558 33.294 -14.539 320 H GLU 43 H GLU 43 29.194 28.118 -12.752 321 HA GLU 43 HA GLU 43 30.676 26.691 -14.796 322 HB2 GLU 43 HB2 GLU 43 31.826 28.189 -12.417 323 HB3 GLU 43 HB3 GLU 43 32.571 27.868 -13.988 324 HG2 GLU 43 HG2 GLU 43 30.559 29.253 -14.931 325 HG3 GLU 43 HG3 GLU 43 30.401 29.844 -13.272 326 H GLN 44 H GLN 44 29.496 25.439 -11.863 327 HA GLN 44 HA GLN 44 31.958 23.847 -11.305 328 HB2 GLN 44 HB2 GLN 44 29.726 24.507 -9.369 329 HB3 GLN 44 HB3 GLN 44 31.316 23.838 -9.013 330 HG2 GLN 44 HG2 GLN 44 30.668 26.623 -9.986 331 HG3 GLN 44 HG3 GLN 44 31.164 26.200 -8.360 332 HE21 GLN 44 HE21 GLN 44 32.430 28.184 -9.833 333 HE22 GLN 44 HE22 GLN 44 34.089 27.653 -10.133 334 H ILE 45 H ILE 45 28.582 23.647 -12.197 335 HA ILE 45 HA ILE 45 27.776 21.238 -11.029 336 HB ILE 45 HB ILE 45 26.669 20.922 -13.455 337 HG12 ILE 45 HG12 ILE 45 26.895 23.959 -13.321 338 HG13 ILE 45 HG13 ILE 45 27.878 22.967 -14.410 339 HG21 ILE 45 HG21 ILE 45 25.686 22.997 -11.457 340 HG22 ILE 45 HG22 ILE 45 24.698 21.992 -12.554 341 HG23 ILE 45 HG23 ILE 45 25.587 21.224 -11.233 342 HD11 ILE 45 HD11 ILE 45 26.000 23.864 -15.631 343 HD12 ILE 45 HD12 ILE 45 25.791 22.109 -15.478 344 HD13 ILE 45 HD13 ILE 45 24.843 23.221 -14.458 345 H ARG 46 H ARG 46 28.923 21.279 -14.512 346 HA ARG 46 HA ARG 46 30.309 20.167 -15.626 347 HB2 ARG 46 HB2 ARG 46 31.607 19.456 -12.981 348 HB3 ARG 46 HB3 ARG 46 32.338 19.137 -14.557 349 HG2 ARG 46 HG2 ARG 46 32.510 21.469 -15.087 350 HG3 ARG 46 HG3 ARG 46 31.462 21.944 -13.745 351 HD2 ARG 46 HD2 ARG 46 33.126 21.036 -12.141 352 HD3 ARG 46 HD3 ARG 46 34.228 20.745 -13.510 353 HE ARG 46 HE ARG 46 33.168 23.486 -13.390 354 HH11 ARG 46 HH11 ARG 46 35.852 21.538 -12.233 355 HH12 ARG 46 HH12 ARG 46 36.836 22.946 -11.939 356 HH21 ARG 46 HH22 ARG 46 34.361 25.159 -12.918 357 HH22 ARG 46 HH21 ARG 46 36.006 24.992 -12.341 358 H ASP 47 H ASP 47 28.414 18.452 -13.496 359 HA ASP 47 HA ASP 47 28.313 16.154 -15.414 360 HB2 ASP 47 HB2 ASP 47 28.312 15.902 -12.387 361 HB3 ASP 47 HB3 ASP 47 28.158 14.586 -13.544 362 H ALA 48 H ALA 48 26.654 18.103 -12.947 363 HA ALA 48 HA ALA 48 24.103 16.773 -13.403 364 HB1 ALA 48 HB1 ALA 48 23.354 18.149 -11.556 365 HB2 ALA 48 HB2 ALA 48 24.928 17.432 -11.156 366 HB3 ALA 48 HB3 ALA 48 24.833 19.131 -11.634 367 H ARG 49 H ARG 49 22.171 17.762 -13.954 368 HA ARG 49 HA ARG 49 22.132 19.956 -15.840 369 HB2 ARG 49 HB2 ARG 49 20.299 17.929 -14.826 370 HB3 ARG 49 HB3 ARG 49 19.536 19.468 -14.624 371 HG2 ARG 49 HG2 ARG 49 18.963 18.408 -16.754 372 HG3 ARG 49 HG3 ARG 49 19.698 19.997 -16.948 373 HD2 ARG 49 HD2 ARG 49 20.405 18.214 -18.604 374 HD3 ARG 49 HD3 ARG 49 21.720 19.085 -17.813 375 HE ARG 49 HE ARG 49 21.485 16.882 -16.189 376 HH11 ARG 49 HH11 ARG 49 21.932 17.117 -19.664 377 HH12 ARG 49 HH12 ARG 49 22.878 15.656 -19.711 378 HH21 ARG 49 HH21 ARG 49 22.686 15.129 -16.287 379 HH22 ARG 49 HH22 ARG 49 23.292 14.531 -17.822 380 H TYR 50 H TYR 50 20.959 19.727 -12.404 381 HA TYR 50 HA TYR 50 21.063 22.728 -12.305 382 HB2 TYR 50 HB2 TYR 50 19.038 20.994 -10.892 383 HB3 TYR 50 HB3 TYR 50 18.921 22.697 -11.268 384 HD1 TYR 50 HD2 TYR 50 19.390 22.875 -14.138 385 HD2 TYR 50 HD1 TYR 50 17.268 19.865 -11.918 386 HE1 TYR 50 HE2 TYR 50 18.009 22.390 -16.144 387 HE2 TYR 50 HE1 TYR 50 15.899 19.351 -13.938 388 HH TYR 50 HH TYR 50 16.350 21.080 -17.028 389 H ALA 51 H ALA 51 22.161 23.623 -10.520 390 HA ALA 51 HA ALA 51 22.649 21.840 -8.164 391 HB1 ALA 51 HB1 ALA 51 24.502 23.385 -7.634 392 HB2 ALA 51 HB2 ALA 51 24.729 22.547 -9.181 393 HB3 ALA 51 HB3 ALA 51 24.214 24.251 -9.157 394 H VAL 52 H VAL 52 22.154 22.624 -6.103 395 HA VAL 52 HA VAL 52 20.423 25.054 -5.911 396 HB VAL 52 HB VAL 52 19.747 22.238 -4.988 397 HG11 VAL 52 HG11 VAL 52 18.894 23.790 -3.312 398 HG12 VAL 52 HG12 VAL 52 18.229 24.851 -4.577 399 HG13 VAL 52 HG13 VAL 52 17.551 23.233 -4.303 400 HG21 VAL 52 HG21 VAL 52 17.778 22.514 -6.502 401 HG22 VAL 52 HG22 VAL 52 18.492 24.022 -7.108 402 HG23 VAL 52 HG23 VAL 52 19.313 22.466 -7.360 403 H ILE 53 H ILE 53 20.448 26.133 -3.988 404 HA ILE 53 HA ILE 53 22.525 25.285 -2.028 405 HB ILE 53 HB ILE 53 22.073 27.715 -3.626 406 HG12 ILE 53 HG12 ILE 53 24.031 26.334 -3.901 407 HG13 ILE 53 HG13 ILE 53 24.470 27.967 -3.406 408 HG21 ILE 53 HG21 ILE 53 22.788 28.184 -0.704 409 HG22 ILE 53 HG22 ILE 53 23.101 29.323 -2.031 410 HG23 ILE 53 HG23 ILE 53 21.450 28.885 -1.625 411 HD11 ILE 53 HD11 ILE 53 25.886 26.623 -2.117 412 HD12 ILE 53 HD12 ILE 53 24.571 26.950 -0.974 413 HD13 ILE 53 HD13 ILE 53 24.641 25.399 -1.815 414 H ARG 54 H ARG 54 22.015 24.987 -0.011 415 HA ARG 54 HA ARG 54 19.974 26.745 1.310 416 HB2 ARG 54 HB2 ARG 54 20.692 23.848 1.866 417 HB3 ARG 54 HB3 ARG 54 19.558 24.819 2.798 418 HG2 ARG 54 HG2 ARG 54 19.238 23.948 -0.115 419 HG3 ARG 54 HG3 ARG 54 18.478 23.177 1.266 420 HD2 ARG 54 HD2 ARG 54 17.971 26.050 0.398 421 HD3 ARG 54 HD3 ARG 54 16.961 24.649 0.001 422 HE ARG 54 HE ARG 54 17.308 24.792 2.843 423 HH11 ARG 54 HH11 ARG 54 15.476 26.359 0.303 424 HH12 ARG 54 HH12 ARG 54 14.218 26.869 1.396 425 HH21 ARG 54 HH21 ARG 54 15.672 25.471 4.186 426 HH22 ARG 54 HH22 ARG 54 14.331 26.367 3.541 427 H ILE 55 H ILE 55 21.732 28.213 1.695 428 HA ILE 55 HA ILE 55 23.736 27.366 3.747 429 HB ILE 55 HB ILE 55 23.649 29.822 1.970 430 HG12 ILE 55 HG12 ILE 55 26.015 27.966 2.173 431 HG13 ILE 55 HG13 ILE 55 24.630 27.424 1.229 432 HG21 ILE 55 HG21 ILE 55 25.537 29.167 4.285 433 HG22 ILE 55 HG22 ILE 55 25.856 30.409 3.075 434 HG23 ILE 55 HG23 ILE 55 24.453 30.575 4.133 435 HD11 ILE 55 HD11 ILE 55 26.169 30.014 0.791 436 HD12 ILE 55 HD12 ILE 55 26.311 28.518 -0.152 437 HD13 ILE 55 HD13 ILE 55 24.795 29.443 -0.176 438 HA PRO 56 HA PRO 56 20.833 29.377 6.563 439 HB2 PRO 56 HB2 PRO 56 22.377 29.546 8.831 440 HB3 PRO 56 HB3 PRO 56 21.603 28.038 8.258 441 HG2 PRO 56 HG2 PRO 56 24.458 28.954 7.792 442 HG3 PRO 56 HG3 PRO 56 23.887 27.350 8.354 443 HD2 PRO 56 HD2 PRO 56 24.509 27.795 5.763 444 HD3 PRO 56 HD3 PRO 56 23.108 26.769 6.195 445 H GLY 57 H GLY 57 20.342 31.487 6.940 446 HA2 GLY 57 HA2 GLY 57 20.611 33.739 7.358 447 HA3 GLY 57 HA3 GLY 57 22.362 33.575 7.260 448 H GLN 58 H GLN 58 21.242 32.216 4.401 449 HA GLN 58 HA GLN 58 20.777 34.792 3.011 450 HB2 GLN 58 HB2 GLN 58 22.542 34.568 1.479 451 HB3 GLN 58 HB3 GLN 58 23.217 34.154 3.049 452 HG2 GLN 58 HG2 GLN 58 22.970 31.761 2.501 453 HG3 GLN 58 HG3 GLN 58 22.492 32.191 0.845 454 HE21 GLN 58 HE21 GLN 58 25.093 33.116 3.227 455 HE22 GLN 58 HE22 GLN 58 26.390 33.067 2.059 456 HA PRO 59 HA PRO 59 17.621 32.679 0.962 457 HB2 PRO 59 HB2 PRO 59 17.416 33.808 -1.526 458 HB3 PRO 59 HB3 PRO 59 17.047 34.684 -0.008 459 HG2 PRO 59 HG2 PRO 59 19.644 34.708 -1.585 460 HG3 PRO 59 HG3 PRO 59 18.706 36.113 -0.979 461 HD2 PRO 59 HD2 PRO 59 20.823 35.136 0.388 462 HD3 PRO 59 HD3 PRO 59 19.367 35.703 1.259 463 H VAL 60 H VAL 60 17.012 31.027 -0.417 464 HA VAL 60 HA VAL 60 18.948 29.209 -1.419 465 HB VAL 60 HB VAL 60 16.836 28.367 -0.805 466 HG11 VAL 60 HG11 VAL 60 15.345 30.281 -1.205 467 HG12 VAL 60 HG12 VAL 60 15.512 30.064 -2.961 468 HG13 VAL 60 HG13 VAL 60 14.717 28.825 -1.974 469 HG21 VAL 60 HG21 VAL 60 17.915 27.203 -2.756 470 HG22 VAL 60 HG22 VAL 60 16.161 27.008 -2.681 471 HG23 VAL 60 HG23 VAL 60 16.872 28.143 -3.839 472 H VAL 61 H VAL 61 19.983 28.960 -3.232 473 HA VAL 61 HA VAL 61 19.275 30.560 -5.671 474 HB VAL 61 HB VAL 61 21.993 29.522 -4.788 475 HG11 VAL 61 HG11 VAL 61 22.903 30.623 -6.765 476 HG12 VAL 61 HG12 VAL 61 21.827 29.312 -7.229 477 HG13 VAL 61 HG13 VAL 61 21.258 31.000 -7.340 478 HG21 VAL 61 HG21 VAL 61 20.955 32.356 -5.180 479 HG22 VAL 61 HG22 VAL 61 21.327 31.584 -3.623 480 HG23 VAL 61 HG23 VAL 61 22.626 31.901 -4.775 481 H GLU 62 H GLU 62 19.009 29.448 -7.619 482 HA GLU 62 HA GLU 62 19.348 26.492 -7.648 483 HB2 GLU 62 HB2 GLU 62 16.861 28.014 -8.542 484 HB3 GLU 62 HB3 GLU 62 17.187 26.302 -8.834 485 HG2 GLU 62 HG2 GLU 62 17.183 25.880 -6.394 486 HG3 GLU 62 HG3 GLU 62 16.858 27.589 -6.093 487 H VAL 63 H VAL 63 20.633 26.004 -9.354 488 HA VAL 63 HA VAL 63 21.159 27.989 -11.463 489 HB VAL 63 HB VAL 63 22.519 25.381 -10.723 490 HG11 VAL 63 HG11 VAL 63 23.500 27.742 -12.345 491 HG12 VAL 63 HG12 VAL 63 24.508 26.384 -11.786 492 HG13 VAL 63 HG13 VAL 63 23.219 26.079 -12.943 493 HG21 VAL 63 HG21 VAL 63 23.362 28.171 -9.854 494 HG22 VAL 63 HG22 VAL 63 22.610 26.969 -8.780 495 HG23 VAL 63 HG23 VAL 63 24.155 26.624 -9.514 496 H GLY 64 H GLY 64 21.346 27.283 -13.778 497 HA2 GLY 64 HA2 GLY 64 20.724 26.139 -15.621 498 HA3 GLY 64 HA3 GLY 64 20.403 24.735 -14.619 499 H THR 65 H THR 65 18.219 24.347 -13.895 500 HA THR 65 HA THR 65 16.095 26.272 -14.459 501 HB THR 65 HB THR 65 15.934 23.605 -15.933 502 HG1 THR 65 HG1 THR 65 17.101 25.943 -16.616 503 HG21 THR 65 HG21 THR 65 14.187 26.103 -16.024 504 HG22 THR 65 HG22 THR 65 13.711 24.475 -15.478 505 HG23 THR 65 HG23 THR 65 14.084 24.753 -17.175 506 H LYS 66 H LYS 66 14.143 25.723 -13.322 507 HA LYS 66 HA LYS 66 14.435 24.011 -11.078 508 HB2 LYS 66 HB2 LYS 66 12.953 25.974 -11.070 509 HB3 LYS 66 HB3 LYS 66 11.918 25.228 -12.299 510 HG2 LYS 66 HG2 LYS 66 11.409 23.371 -10.700 511 HG3 LYS 66 HG3 LYS 66 12.391 24.183 -9.469 512 HD2 LYS 66 HD2 LYS 66 10.875 26.126 -9.536 513 HD3 LYS 66 HD3 LYS 66 9.911 25.371 -10.811 514 HE2 LYS 66 HE2 LYS 66 10.333 24.216 -8.011 515 HE3 LYS 66 HE3 LYS 66 8.936 25.179 -8.498 516 HZ1 LYS 66 HZ1 LYS 66 8.396 23.460 -10.150 517 HZ2 LYS 66 HZ2 LYS 66 8.422 22.833 -8.646 518 HZ3 LYS 66 HZ3 LYS 66 9.662 22.534 -9.664 519 HA PRO 67 HA PRO 67 13.309 20.178 -13.147 520 HB2 PRO 67 HB2 PRO 67 13.476 18.466 -11.050 521 HB3 PRO 67 HB3 PRO 67 14.911 19.219 -11.820 522 HG2 PRO 67 HG2 PRO 67 13.504 20.055 -9.279 523 HG3 PRO 67 HG3 PRO 67 15.266 19.905 -9.624 524 HD2 PRO 67 HD2 PRO 67 13.916 22.297 -9.740 525 HD3 PRO 67 HD3 PRO 67 15.347 21.916 -10.746 526 H THR 68 H THR 68 11.683 18.740 -13.321 527 HA THR 68 HA THR 68 9.121 19.621 -12.486 528 HB THR 68 HB THR 68 9.692 18.938 -14.750 529 HG1 THR 68 HG1 THR 68 7.766 17.872 -15.139 530 HG21 THR 68 HG21 THR 68 11.018 16.841 -14.169 531 HG22 THR 68 HG22 THR 68 9.828 16.659 -15.465 532 HG23 THR 68 HG23 THR 68 9.458 16.042 -13.847 533 H GLY 69 H GLY 69 10.909 16.754 -11.521 534 HA2 GLY 69 HA2 GLY 69 9.990 15.954 -9.163 535 HA3 GLY 69 HA3 GLY 69 8.550 15.575 -10.126 536 H ASP 70 H ASP 70 9.817 14.756 -12.470 537 HA ASP 70 HA ASP 70 10.901 12.097 -11.834 538 HB2 ASP 70 HB2 ASP 70 10.403 13.427 -14.506 539 HB3 ASP 70 HB3 ASP 70 10.980 11.769 -14.280 540 H VAL 71 H VAL 71 12.577 13.305 -10.559 541 HA VAL 71 HA VAL 71 15.062 13.523 -12.110 542 HB VAL 71 HB VAL 71 15.747 15.516 -10.834 543 HG11 VAL 71 HG11 VAL 71 14.856 17.046 -12.301 544 HG12 VAL 71 HG12 VAL 71 14.574 15.563 -13.170 545 HG13 VAL 71 HG13 VAL 71 13.224 16.351 -12.317 546 HG21 VAL 71 HG21 VAL 71 14.203 16.900 -9.627 547 HG22 VAL 71 HG22 VAL 71 12.852 15.791 -9.951 548 HG23 VAL 71 HG23 VAL 71 14.200 15.302 -8.903 549 H LEU 72 H LEU 72 16.943 13.349 -10.929 550 HA LEU 72 HA LEU 72 16.929 11.598 -8.508 551 HB2 LEU 72 HB2 LEU 72 19.105 12.572 -10.412 552 HB3 LEU 72 HB3 LEU 72 19.400 11.477 -9.069 553 HG LEU 72 HG LEU 72 17.405 10.798 -11.221 554 HD11 LEU 72 HD11 LEU 72 19.197 9.576 -12.426 555 HD12 LEU 72 HD12 LEU 72 20.406 10.267 -11.311 556 HD13 LEU 72 HD13 LEU 72 19.485 11.318 -12.411 557 HD21 LEU 72 HD21 LEU 72 17.965 8.488 -10.578 558 HD22 LEU 72 HD22 LEU 72 17.488 9.430 -9.145 559 HD23 LEU 72 HD23 LEU 72 19.206 9.106 -9.461 560 H GLN 73 H GLN 73 17.835 12.414 -6.472 561 HA GLN 73 HA GLN 73 18.859 15.213 -6.582 562 HB2 GLN 73 HB2 GLN 73 17.250 13.790 -4.446 563 HB3 GLN 73 HB3 GLN 73 17.973 15.401 -4.316 564 HG2 GLN 73 HG2 GLN 73 16.622 16.060 -6.370 565 HG3 GLN 73 HG3 GLN 73 15.737 14.546 -6.197 566 HE21 GLN 73 HE21 GLN 73 14.954 17.500 -5.854 567 HE22 GLN 73 HE22 GLN 73 14.217 17.543 -4.243 568 H GLY 74 H GLY 74 20.930 15.401 -6.096 569 HA2 GLY 74 HA2 GLY 74 22.375 13.450 -4.334 570 HA3 GLY 74 HA3 GLY 74 23.107 14.654 -5.410 571 H ARG 75 H ARG 75 23.591 14.426 -2.484 572 HA ARG 75 HA ARG 75 22.846 17.127 -1.641 573 HB2 ARG 75 HB2 ARG 75 20.749 15.866 -1.218 574 HB3 ARG 75 HB3 ARG 75 21.629 14.759 -0.157 575 HG2 ARG 75 HG2 ARG 75 22.146 16.626 1.383 576 HG3 ARG 75 HG3 ARG 75 21.359 17.776 0.281 577 HD2 ARG 75 HD2 ARG 75 19.207 16.663 0.609 578 HD3 ARG 75 HD3 ARG 75 19.975 15.411 1.610 579 HE ARG 75 HE ARG 75 20.614 17.877 2.803 580 HH11 ARG 75 HH11 ARG 75 17.688 16.034 2.254 581 HH12 ARG 75 HH12 ARG 75 16.899 16.678 3.668 582 HH21 ARG 75 HH21 ARG 75 19.557 18.658 4.609 583 HH22 ARG 75 HH22 ARG 75 17.939 18.132 4.961 584 H ALA 76 H ALA 76 24.197 17.948 -0.297 585 HA ALA 76 HA ALA 76 25.976 16.273 1.470 586 HB1 ALA 76 HB1 ALA 76 26.830 18.355 -0.595 587 HB2 ALA 76 HB2 ALA 76 27.923 17.543 0.557 588 HB3 ALA 76 HB3 ALA 76 27.093 16.601 -0.696 589 H THR 77 H THR 77 27.300 17.489 2.962 590 HA THR 77 HA THR 77 26.064 20.042 3.924 591 HB THR 77 HB THR 77 27.323 17.873 5.633 592 HG1 THR 77 HG1 THR 77 25.231 17.659 6.432 593 HG21 THR 77 HG21 THR 77 26.525 19.246 7.538 594 HG22 THR 77 HG22 THR 77 25.947 20.493 6.413 595 HG23 THR 77 HG23 THR 77 27.682 20.159 6.567 596 H GLY 78 H GLY 78 27.471 21.679 4.019 597 HA2 GLY 78 HA2 GLY 78 30.256 21.222 3.068 598 HA3 GLY 78 HA3 GLY 78 29.407 22.739 3.089 599 H GLU 79 H GLU 79 31.796 23.005 3.894 600 HA GLU 79 HA GLU 79 32.341 22.127 6.610 601 HB2 GLU 79 HB2 GLU 79 33.992 23.592 4.543 602 HB3 GLU 79 HB3 GLU 79 34.583 23.184 6.160 603 HG2 GLU 79 HG2 GLU 79 34.101 20.780 5.719 604 HG3 GLU 79 HG3 GLU 79 33.582 21.189 4.083 605 H GLU 80 H GLU 80 30.747 25.030 5.576 606 HA GLU 80 HA GLU 80 31.595 26.363 8.141 607 HB2 GLU 80 HB2 GLU 80 30.091 27.472 5.785 608 HB3 GLU 80 HB3 GLU 80 30.558 28.375 7.217 609 HG2 GLU 80 HG2 GLU 80 32.627 27.134 5.332 610 HG3 GLU 80 HG3 GLU 80 31.905 28.693 5.150 611 H GLY 81 H GLY 81 29.483 24.097 7.240 612 HA2 GLY 81 HA2 GLY 81 27.751 23.257 8.420 613 HA3 GLY 81 HA3 GLY 81 27.425 24.809 9.170 614 H GLU 82 H GLU 82 27.704 24.735 5.641 615 HA GLU 82 HA GLU 82 24.898 25.373 5.308 616 HB2 GLU 82 HB2 GLU 82 25.545 26.095 3.203 617 HB3 GLU 82 HB3 GLU 82 26.817 26.657 4.290 618 HG2 GLU 82 HG2 GLU 82 27.120 24.152 2.571 619 HG3 GLU 82 HG3 GLU 82 27.387 25.760 1.949 620 H THR 83 H THR 83 23.934 24.455 3.110 621 HA THR 83 HA THR 83 24.423 21.526 2.904 622 HB THR 83 HB THR 83 21.796 22.907 3.462 623 HG1 THR 83 HG1 THR 83 23.104 21.989 5.120 624 HG21 THR 83 HG21 THR 83 21.281 21.483 1.533 625 HG22 THR 83 HG22 THR 83 20.666 20.742 3.008 626 HG23 THR 83 HG23 THR 83 22.166 20.122 2.273 627 H VAL 84 H VAL 84 24.434 20.803 0.980 628 HA VAL 84 HA VAL 84 23.771 22.571 -1.384 629 HB VAL 84 HB VAL 84 26.048 20.574 -1.074 630 HG11 VAL 84 HG11 VAL 84 25.179 20.465 -3.391 631 HG12 VAL 84 HG12 VAL 84 25.291 22.242 -3.516 632 HG13 VAL 84 HG13 VAL 84 26.748 21.236 -3.313 633 HG21 VAL 84 HG21 VAL 84 26.616 22.659 -0.004 634 HG22 VAL 84 HG22 VAL 84 27.400 22.676 -1.596 635 HG23 VAL 84 HG23 VAL 84 25.921 23.602 -1.340 636 H LEU 85 H LEU 85 22.607 21.708 -3.034 637 HA LEU 85 HA LEU 85 22.005 18.819 -2.995 638 HB2 LEU 85 HB2 LEU 85 20.268 20.070 -1.736 639 HB3 LEU 85 HB3 LEU 85 19.834 20.953 -3.180 640 HG LEU 85 HG LEU 85 19.777 17.916 -3.179 641 HD11 LEU 85 HD11 LEU 85 18.591 18.532 -1.156 642 HD12 LEU 85 HD12 LEU 85 17.467 17.943 -2.391 643 HD13 LEU 85 HD13 LEU 85 17.590 19.690 -2.067 644 HD21 LEU 85 HD21 LEU 85 17.952 18.161 -4.745 645 HD22 LEU 85 HD22 LEU 85 19.276 19.173 -5.314 646 HD23 LEU 85 HD23 LEU 85 17.902 19.924 -4.496 647 H VAL 86 H VAL 86 21.469 17.990 -4.963 648 HA VAL 86 HA VAL 86 22.064 19.620 -7.437 649 HB VAL 86 HB VAL 86 23.332 16.926 -6.769 650 HG11 VAL 86 HG11 VAL 86 23.475 18.661 -9.262 651 HG12 VAL 86 HG12 VAL 86 24.542 17.269 -8.917 652 HG13 VAL 86 HG13 VAL 86 22.814 17.013 -9.156 653 HG21 VAL 86 HG21 VAL 86 24.481 18.774 -5.622 654 HG22 VAL 86 HG22 VAL 86 25.471 18.178 -6.962 655 HG23 VAL 86 HG23 VAL 86 24.561 19.697 -7.143 656 H GLU 87 H GLU 87 20.865 18.999 -9.294 657 HA GLU 87 HA GLU 87 19.128 16.645 -8.961 658 HB2 GLU 87 HB2 GLU 87 17.974 19.324 -9.762 659 HB3 GLU 87 HB3 GLU 87 17.125 17.777 -9.627 660 HG2 GLU 87 HG2 GLU 87 17.925 17.740 -7.176 661 HG3 GLU 87 HG3 GLU 87 18.398 19.425 -7.415 662 H GLU 88 H GLU 88 18.705 15.517 -10.619 663 HA GLU 88 HA GLU 88 19.737 16.210 -13.357 664 HB2 GLU 88 HB2 GLU 88 20.381 13.983 -11.459 665 HB3 GLU 88 HB3 GLU 88 20.323 13.581 -13.176 666 HG2 GLU 88 HG2 GLU 88 22.107 15.739 -12.032 667 HG3 GLU 88 HG3 GLU 88 22.554 14.029 -12.168 668 HA PRO 89 HA PRO 89 15.847 14.401 -14.694 669 HB2 PRO 89 HB2 PRO 89 16.439 13.404 -17.179 670 HB3 PRO 89 HB3 PRO 89 16.283 15.152 -16.821 671 HG2 PRO 89 HG2 PRO 89 18.835 13.502 -16.941 672 HG3 PRO 89 HG3 PRO 89 18.495 15.074 -17.737 673 HD2 PRO 89 HD2 PRO 89 19.828 14.898 -15.390 674 HD3 PRO 89 HD3 PRO 89 18.670 16.237 -15.680 675 H ARG 90 H ARG 90 14.803 12.533 -14.368 676 HA ARG 90 HA ARG 90 16.302 10.039 -13.798 677 HB2 ARG 90 HB2 ARG 90 14.758 10.980 -12.120 678 HB3 ARG 90 HB3 ARG 90 13.407 10.781 -13.237 679 HG2 ARG 90 HG2 ARG 90 13.674 8.341 -13.215 680 HG3 ARG 90 HG3 ARG 90 15.108 8.510 -12.180 681 HD2 ARG 90 HD2 ARG 90 13.317 8.004 -10.711 682 HD3 ARG 90 HD3 ARG 90 13.670 9.738 -10.521 683 HE ARG 90 HE ARG 90 11.564 9.407 -12.433 684 HH11 ARG 90 HH21 ARG 90 12.045 8.936 -8.997 685 HH12 ARG 90 HH22 ARG 90 10.376 9.257 -8.617 686 HH21 ARG 90 HH11 ARG 90 9.431 9.973 -11.848 687 HH22 ARG 90 HH12 ARG 90 8.951 9.756 -10.190 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 0.848 -8.615 -0.639 2 H2 GLY 1 H2 GLY 1 0.455 -7.735 0.685 3 H3 GLY 1 H3 GLY 1 2.028 -7.937 0.277 4 HA2 GLY 1 HA2 GLY 1 0.023 -6.447 -1.301 5 HA3 GLY 1 HA3 GLY 1 1.289 -5.712 -0.301 6 H SER 2 H SER 2 0.558 -6.131 -3.399 7 HA SER 2 HA SER 2 2.814 -7.434 -4.552 8 HB2 SER 2 HB2 SER 2 0.965 -5.379 -5.814 9 HB3 SER 2 HB3 SER 2 2.009 -6.531 -6.669 10 HG SER 2 HG SER 2 -0.140 -7.293 -6.496 11 H GLU 3 H GLU 3 2.323 -3.963 -3.840 12 HA GLU 3 HA GLU 3 4.215 -2.648 -5.110 13 HB2 GLU 3 HB2 GLU 3 2.743 -1.713 -3.393 14 HB3 GLU 3 HB3 GLU 3 3.688 -2.482 -2.120 15 HG2 GLU 3 HG2 GLU 3 4.201 -0.127 -2.215 16 HG3 GLU 3 HG3 GLU 3 5.627 -1.051 -2.664 17 H THR 4 H THR 4 6.321 -2.305 -5.303 18 HA THR 4 HA THR 4 8.377 -3.207 -3.543 19 HB THR 4 HB THR 4 7.845 -5.418 -4.487 20 HG1 THR 4 HG1 THR 4 9.949 -5.880 -5.057 21 HG21 THR 4 HG21 THR 4 8.333 -6.005 -6.791 22 HG22 THR 4 HG22 THR 4 8.751 -4.324 -7.187 23 HG23 THR 4 HG23 THR 4 7.079 -4.758 -6.768 24 H ARG 5 H ARG 5 10.474 -2.551 -4.289 25 HA ARG 5 HA ARG 5 10.706 -0.643 -6.504 26 HB2 ARG 5 HB2 ARG 5 11.045 0.303 -3.613 27 HB3 ARG 5 HB3 ARG 5 11.389 1.256 -5.051 28 HG2 ARG 5 HG2 ARG 5 8.630 0.291 -4.183 29 HG3 ARG 5 HG3 ARG 5 9.275 1.911 -3.960 30 HD2 ARG 5 HD2 ARG 5 9.327 2.343 -6.317 31 HD3 ARG 5 HD3 ARG 5 8.991 0.656 -6.706 32 HE ARG 5 HE ARG 5 6.751 0.910 -5.641 33 HH11 ARG 5 HH11 ARG 5 8.201 3.759 -7.116 34 HH12 ARG 5 HH12 ARG 5 6.652 4.539 -7.286 35 HH21 ARG 5 HH21 ARG 5 4.906 2.003 -5.708 36 HH22 ARG 5 HH22 ARG 5 4.807 3.541 -6.547 37 H THR 6 H THR 6 12.889 0.041 -6.860 38 HA THR 6 HA THR 6 15.032 -1.155 -5.226 39 HB THR 6 HB THR 6 14.527 -2.902 -6.872 40 HG1 THR 6 HG1 THR 6 16.660 -3.123 -7.532 41 HG21 THR 6 HG21 THR 6 13.792 -1.513 -8.801 42 HG22 THR 6 HG22 THR 6 15.063 -2.665 -9.229 43 HG23 THR 6 HG23 THR 6 15.465 -0.947 -9.019 44 H ILE 7 H ILE 7 16.992 -0.062 -5.325 45 HA ILE 7 HA ILE 7 16.644 2.719 -6.032 46 HB ILE 7 HB ILE 7 18.998 1.373 -4.694 47 HG12 ILE 7 HG12 ILE 7 16.552 2.784 -3.512 48 HG13 ILE 7 HG13 ILE 7 16.871 1.044 -3.445 49 HG21 ILE 7 HG21 ILE 7 19.572 3.623 -5.639 50 HG22 ILE 7 HG22 ILE 7 18.181 4.326 -4.777 51 HG23 ILE 7 HG23 ILE 7 19.568 3.648 -3.900 52 HD11 ILE 7 HD11 ILE 7 18.434 3.209 -2.011 53 HD12 ILE 7 HD12 ILE 7 17.434 1.932 -1.322 54 HD13 ILE 7 HD13 ILE 7 18.956 1.510 -2.124 55 H SER 8 H SER 8 17.548 3.868 -7.409 56 HA SER 8 HA SER 8 18.861 2.799 -9.823 57 HB2 SER 8 HB2 SER 8 18.137 5.650 -9.125 58 HB3 SER 8 HB3 SER 8 18.806 5.136 -10.684 59 HG SER 8 HG SER 8 16.380 4.166 -9.534 60 H SER 9 H SER 9 20.510 2.336 -7.642 61 HA SER 9 HA SER 9 22.530 3.994 -7.001 62 HB2 SER 9 HB2 SER 9 22.813 0.986 -7.168 63 HB3 SER 9 HB3 SER 9 23.581 2.096 -6.014 64 HG SER 9 HG SER 9 21.781 1.050 -5.102 65 H THR 10 H THR 10 22.642 4.436 -9.712 66 HA THR 10 HA THR 10 25.498 4.131 -10.217 67 HB THR 10 HB THR 10 25.035 3.923 -12.667 68 HG1 THR 10 HG1 THR 10 23.068 2.829 -13.200 69 HG21 THR 10 HG21 THR 10 24.892 1.483 -12.697 70 HG22 THR 10 HG22 THR 10 24.217 1.473 -11.051 71 HG23 THR 10 HG23 THR 10 25.893 2.004 -11.329 72 H ALA 11 H ALA 11 22.597 5.392 -11.839 73 HA ALA 11 HA ALA 11 23.625 8.054 -12.211 74 HB1 ALA 11 HB1 ALA 11 21.365 8.545 -13.036 75 HB2 ALA 11 HB2 ALA 11 21.952 7.007 -13.688 76 HB3 ALA 11 HB3 ALA 11 20.761 7.010 -12.369 77 H GLN 12 H GLN 12 21.200 6.754 -9.849 78 HA GLN 12 HA GLN 12 20.990 9.258 -8.399 79 HB2 GLN 12 HB2 GLN 12 19.218 7.567 -8.402 80 HB3 GLN 12 HB3 GLN 12 20.276 6.417 -7.579 81 HG2 GLN 12 HG2 GLN 12 18.604 7.464 -6.085 82 HG3 GLN 12 HG3 GLN 12 20.271 7.656 -5.560 83 HE21 GLN 12 HE21 GLN 12 20.453 9.621 -4.554 84 HE22 GLN 12 HE22 GLN 12 19.729 11.110 -5.122 85 H GLU 13 H GLU 13 23.207 6.446 -8.107 86 HA GLU 13 HA GLU 13 24.420 7.345 -5.690 87 HB2 GLU 13 HB2 GLU 13 24.583 5.059 -6.524 88 HB3 GLU 13 HB3 GLU 13 25.475 5.590 -7.931 89 HG2 GLU 13 HG2 GLU 13 27.001 4.627 -6.330 90 HG3 GLU 13 HG3 GLU 13 27.350 6.340 -6.508 91 H ARG 14 H ARG 14 25.712 7.705 -8.932 92 HA ARG 14 HA ARG 14 27.827 9.299 -8.261 93 HB2 ARG 14 HB2 ARG 14 28.263 9.870 -10.510 94 HB3 ARG 14 HB3 ARG 14 27.780 8.190 -10.404 95 HG2 ARG 14 HG2 ARG 14 26.077 8.464 -11.834 96 HG3 ARG 14 HG3 ARG 14 25.456 9.893 -11.011 97 HD2 ARG 14 HD2 ARG 14 27.950 10.236 -12.638 98 HD3 ARG 14 HD3 ARG 14 26.468 9.895 -13.515 99 HE ARG 14 HE ARG 14 26.983 12.295 -11.782 100 HH11 ARG 14 HH11 ARG 14 24.655 10.694 -13.919 101 HH12 ARG 14 HH12 ARG 14 23.595 12.087 -13.808 102 HH21 ARG 14 HH22 ARG 14 25.678 14.037 -12.001 103 HH22 ARG 14 HH21 ARG 14 24.279 13.922 -13.087 104 H VAL 15 H VAL 15 24.628 10.539 -8.835 105 HA VAL 15 HA VAL 15 25.320 13.329 -8.805 106 HB VAL 15 HB VAL 15 23.074 13.848 -8.014 107 HG11 VAL 15 HG11 VAL 15 23.510 13.746 -10.379 108 HG12 VAL 15 HG12 VAL 15 23.241 11.987 -10.409 109 HG13 VAL 15 HG13 VAL 15 21.902 13.089 -10.039 110 HG21 VAL 15 HG21 VAL 15 22.604 11.804 -6.675 111 HG22 VAL 15 HG22 VAL 15 21.346 12.161 -7.870 112 HG23 VAL 15 HG23 VAL 15 22.528 10.882 -8.190 113 H ASP 16 H ASP 16 25.450 10.970 -6.231 114 HA ASP 16 HA ASP 16 25.242 12.921 -4.067 115 HB2 ASP 16 HB2 ASP 16 24.896 10.465 -3.795 116 HB3 ASP 16 HB3 ASP 16 26.619 10.210 -4.097 117 H LEU 17 H LEU 17 28.064 11.460 -5.731 118 HA LEU 17 HA LEU 17 30.019 12.631 -4.101 119 HB2 LEU 17 HB2 LEU 17 30.234 11.532 -6.944 120 HB3 LEU 17 HB3 LEU 17 31.579 12.015 -5.930 121 HG LEU 17 HG LEU 17 30.477 10.317 -4.172 122 HD11 LEU 17 HD11 LEU 17 28.550 9.657 -5.606 123 HD12 LEU 17 HD12 LEU 17 29.632 8.300 -5.322 124 HD13 LEU 17 HD13 LEU 17 29.684 9.147 -6.880 125 HD21 LEU 17 HD21 LEU 17 32.006 8.586 -5.034 126 HD22 LEU 17 HD22 LEU 17 32.753 10.191 -5.053 127 HD23 LEU 17 HD23 LEU 17 32.154 9.477 -6.569 128 H GLU 18 H GLU 18 28.767 13.693 -7.185 129 HA GLU 18 HA GLU 18 30.280 16.136 -7.422 130 HB2 GLU 18 HB2 GLU 18 28.581 16.768 -9.117 131 HB3 GLU 18 HB3 GLU 18 29.318 15.187 -9.364 132 HG2 GLU 18 HG2 GLU 18 27.253 14.209 -8.144 133 HG3 GLU 18 HG3 GLU 18 26.532 15.786 -8.334 134 H ALA 19 H ALA 19 27.104 15.430 -5.751 135 HA ALA 19 HA ALA 19 26.681 18.177 -5.002 136 HB1 ALA 19 HB1 ALA 19 25.104 17.265 -3.415 137 HB2 ALA 19 HB2 ALA 19 24.981 16.388 -4.957 138 HB3 ALA 19 HB3 ALA 19 25.807 15.642 -3.574 139 H VAL 20 H VAL 20 28.577 15.575 -3.401 140 HA VAL 20 HA VAL 20 29.406 17.217 -1.133 141 HB VAL 20 HB VAL 20 30.622 14.704 -2.343 142 HG11 VAL 20 HG11 VAL 20 32.381 15.841 -1.063 143 HG12 VAL 20 HG12 VAL 20 31.264 16.089 0.301 144 HG13 VAL 20 HG13 VAL 20 31.789 14.454 -0.153 145 HG21 VAL 20 HG21 VAL 20 29.585 13.581 -0.420 146 HG22 VAL 20 HG22 VAL 20 28.925 15.123 0.162 147 HG23 VAL 20 HG23 VAL 20 28.345 14.412 -1.357 148 H ARG 21 H ARG 21 30.947 16.553 -4.294 149 HA ARG 21 HA ARG 21 33.172 18.234 -3.987 150 HB2 ARG 21 HB2 ARG 21 32.786 16.673 -5.885 151 HB3 ARG 21 HB3 ARG 21 31.554 17.748 -6.525 152 HG2 ARG 21 HG2 ARG 21 33.692 17.967 -7.708 153 HG3 ARG 21 HG3 ARG 21 33.152 19.481 -6.987 154 HD2 ARG 21 HD2 ARG 21 35.580 19.163 -6.753 155 HD3 ARG 21 HD3 ARG 21 34.782 19.271 -5.179 156 HE ARG 21 HE ARG 21 35.049 16.516 -6.055 157 HH11 ARG 21 HH21 ARG 21 37.017 19.085 -4.714 158 HH12 ARG 21 HH22 ARG 21 38.115 17.971 -3.946 159 HH21 ARG 21 HH11 ARG 21 36.481 15.145 -5.040 160 HH22 ARG 21 HH12 ARG 21 37.820 15.796 -4.145 161 H LEU 22 H LEU 22 29.887 19.226 -5.090 162 HA LEU 22 HA LEU 22 30.581 22.041 -5.136 163 HB2 LEU 22 HB2 LEU 22 27.994 20.545 -5.387 164 HB3 LEU 22 HB3 LEU 22 28.005 22.264 -4.947 165 HG LEU 22 HG LEU 22 29.546 22.687 -6.938 166 HD11 LEU 22 HD11 LEU 22 29.377 21.099 -8.816 167 HD12 LEU 22 HD12 LEU 22 28.537 19.937 -7.777 168 HD13 LEU 22 HD13 LEU 22 30.233 20.373 -7.453 169 HD21 LEU 22 HD21 LEU 22 27.681 22.835 -8.462 170 HD22 LEU 22 HD22 LEU 22 27.192 23.275 -6.813 171 HD23 LEU 22 HD23 LEU 22 26.742 21.679 -7.465 172 H ALA 23 H ALA 23 29.217 20.022 -2.461 173 HA ALA 23 HA ALA 23 28.959 22.216 -0.662 174 HB1 ALA 23 HB1 ALA 23 29.900 19.380 -0.077 175 HB2 ALA 23 HB2 ALA 23 29.197 20.530 1.087 176 HB3 ALA 23 HB3 ALA 23 28.210 19.897 -0.242 177 H SER 24 H SER 24 31.869 20.421 -1.612 178 HA SER 24 HA SER 24 33.721 22.019 -0.150 179 HB2 SER 24 HB2 SER 24 34.393 20.507 -2.689 180 HB3 SER 24 HB3 SER 24 35.450 20.961 -1.363 181 HG SER 24 HG SER 24 33.302 19.077 -1.272 182 H ILE 25 H ILE 25 32.558 22.483 -3.586 183 HA ILE 25 HA ILE 25 34.322 24.726 -3.928 184 HB ILE 25 HB ILE 25 31.797 24.583 -5.517 185 HG12 ILE 25 HG12 ILE 25 32.495 22.319 -5.766 186 HG13 ILE 25 HG13 ILE 25 32.930 23.190 -7.176 187 HG21 ILE 25 HG21 ILE 25 34.690 25.418 -6.084 188 HG22 ILE 25 HG22 ILE 25 33.364 25.477 -7.246 189 HG23 ILE 25 HG23 ILE 25 33.321 26.501 -5.813 190 HD11 ILE 25 HD11 ILE 25 34.873 22.350 -5.003 191 HD12 ILE 25 HD12 ILE 25 34.612 21.557 -6.559 192 HD13 ILE 25 HD13 ILE 25 35.296 23.199 -6.523 193 H VAL 26 H VAL 26 30.995 24.428 -2.650 194 HA VAL 26 HA VAL 26 30.448 27.281 -2.431 195 HB VAL 26 HB VAL 26 29.348 24.870 -0.962 196 HG11 VAL 26 HG11 VAL 26 28.304 27.734 -1.082 197 HG12 VAL 26 HG12 VAL 26 27.417 26.343 -0.412 198 HG13 VAL 26 HG13 VAL 26 28.903 26.886 0.358 199 HG21 VAL 26 HG21 VAL 26 27.961 26.490 -3.144 200 HG22 VAL 26 HG22 VAL 26 28.942 25.078 -3.554 201 HG23 VAL 26 HG23 VAL 26 27.542 24.878 -2.523 202 H ASP 27 H ASP 27 31.638 24.803 0.048 203 HA ASP 27 HA ASP 27 32.311 26.640 2.058 204 HB2 ASP 27 HB2 ASP 27 32.601 24.276 2.391 205 HB3 ASP 27 HB3 ASP 27 33.787 24.172 1.085 206 H SER 28 H SER 28 34.328 25.827 -0.782 207 HA SER 28 HA SER 28 36.486 27.588 -0.242 208 HB2 SER 28 HB2 SER 28 35.455 26.820 -3.002 209 HB3 SER 28 HB3 SER 28 37.059 27.430 -2.594 210 HG SER 28 HG SER 28 35.886 24.959 -1.770 211 H ARG 29 H ARG 29 33.326 28.308 -1.673 212 HA ARG 29 HA ARG 29 33.940 31.133 -2.204 213 HB2 ARG 29 HB2 ARG 29 32.348 29.768 -3.562 214 HB3 ARG 29 HB3 ARG 29 31.294 29.607 -2.168 215 HG2 ARG 29 HG2 ARG 29 30.391 31.282 -3.548 216 HG3 ARG 29 HG3 ARG 29 31.008 32.080 -2.108 217 HD2 ARG 29 HD2 ARG 29 32.939 32.910 -3.334 218 HD3 ARG 29 HD3 ARG 29 32.514 31.902 -4.740 219 HE ARG 29 HE ARG 29 30.401 33.775 -3.934 220 HH11 ARG 29 HH11 ARG 29 33.375 33.679 -5.776 221 HH12 ARG 29 HH12 ARG 29 32.850 34.917 -6.882 222 HH21 ARG 29 HH21 ARG 29 29.670 35.180 -5.563 223 HH22 ARG 29 HH22 ARG 29 30.836 35.789 -6.701 224 H LEU 30 H LEU 30 32.294 29.329 0.470 225 HA LEU 30 HA LEU 30 31.496 31.729 1.855 226 HB2 LEU 30 HB2 LEU 30 32.090 28.982 2.996 227 HB3 LEU 30 HB3 LEU 30 31.269 30.307 3.827 228 HG LEU 30 HG LEU 30 30.232 28.811 1.402 229 HD11 LEU 30 HD11 LEU 30 30.077 27.551 3.597 230 HD12 LEU 30 HD12 LEU 30 28.510 27.968 2.894 231 HD13 LEU 30 HD13 LEU 30 29.147 28.930 4.234 232 HD21 LEU 30 HD21 LEU 30 28.970 31.109 2.932 233 HD22 LEU 30 HD22 LEU 30 28.120 30.069 1.770 234 HD23 LEU 30 HD23 LEU 30 29.437 31.089 1.209 235 H ILE 31 H ILE 31 34.525 29.866 1.920 236 HA ILE 31 HA ILE 31 35.896 31.649 3.776 237 HB ILE 31 HB ILE 31 36.853 29.587 1.753 238 HG12 ILE 31 HG12 ILE 31 36.781 29.439 4.804 239 HG13 ILE 31 HG13 ILE 31 35.485 28.826 3.792 240 HG21 ILE 31 HG21 ILE 31 38.686 31.194 2.122 241 HG22 ILE 31 HG22 ILE 31 38.481 31.052 3.882 242 HG23 ILE 31 HG23 ILE 31 39.059 29.680 2.915 243 HD11 ILE 31 HD11 ILE 31 37.059 27.263 2.674 244 HD12 ILE 31 HD12 ILE 31 38.338 27.781 3.804 245 HD13 ILE 31 HD13 ILE 31 36.885 26.985 4.415 246 H GLY 32 H GLY 32 35.464 31.559 0.247 247 HA2 GLY 32 HA2 GLY 32 37.535 33.344 -0.515 248 HA3 GLY 32 HA3 GLY 32 36.106 32.837 -1.453 249 H THR 33 H THR 33 34.089 33.830 0.155 250 HA THR 33 HA THR 33 34.470 36.714 0.454 251 HB THR 33 HB THR 33 34.163 36.479 -1.993 252 HG1 THR 33 HG1 THR 33 32.593 38.049 -2.159 253 HG21 THR 33 HG21 THR 33 32.118 35.797 -2.986 254 HG22 THR 33 HG22 THR 33 31.287 35.673 -1.423 255 HG23 THR 33 HG23 THR 33 32.560 34.504 -1.849 256 H GLY 34 H GLY 34 32.328 33.887 0.735 257 HA2 GLY 34 HA2 GLY 34 31.173 33.545 2.774 258 HA3 GLY 34 HA3 GLY 34 30.960 35.269 3.017 259 H SER 35 H SER 35 30.137 34.449 -0.151 260 HA SER 35 HA SER 35 27.396 33.589 0.298 261 HB2 SER 35 HB2 SER 35 28.073 36.250 -1.028 262 HB3 SER 35 HB3 SER 35 26.494 35.444 -1.117 263 HG SER 35 HG SER 35 26.612 37.046 0.540 264 H VAL 36 H VAL 36 26.554 32.512 -1.519 265 HA VAL 36 HA VAL 36 28.405 32.206 -3.872 266 HB VAL 36 HB VAL 36 28.190 30.199 -2.348 267 HG11 VAL 36 HG11 VAL 36 25.724 30.461 -1.867 268 HG12 VAL 36 HG12 VAL 36 25.390 29.955 -3.534 269 HG13 VAL 36 HG13 VAL 36 26.213 28.845 -2.419 270 HG21 VAL 36 HG21 VAL 36 27.175 29.873 -5.191 271 HG22 VAL 36 HG22 VAL 36 28.878 30.072 -4.719 272 HG23 VAL 36 HG23 VAL 36 27.984 28.640 -4.195 273 H ASP 37 H ASP 37 27.472 32.315 -5.931 274 HA ASP 37 HA ASP 37 24.659 33.196 -6.084 275 HB2 ASP 37 HB2 ASP 37 26.929 34.287 -7.758 276 HB3 ASP 37 HB3 ASP 37 25.313 34.939 -7.542 277 H GLU 38 H GLU 38 23.627 32.770 -8.115 278 HA GLU 38 HA GLU 38 24.029 30.285 -9.216 279 HB2 GLU 38 HB2 GLU 38 22.105 32.096 -9.502 280 HB3 GLU 38 HB3 GLU 38 22.979 32.512 -10.979 281 HG2 GLU 38 HG2 GLU 38 22.857 29.933 -11.485 282 HG3 GLU 38 HG3 GLU 38 21.665 29.900 -10.191 283 H ASP 39 H ASP 39 25.469 33.332 -10.477 284 HA ASP 39 HA ASP 39 26.688 32.220 -12.763 285 HB2 ASP 39 HB2 ASP 39 26.100 34.613 -12.362 286 HB3 ASP 39 HB3 ASP 39 27.314 34.690 -11.083 287 H PHE 40 H PHE 40 27.696 32.054 -9.381 288 HA PHE 40 HA PHE 40 30.468 31.348 -10.115 289 HB2 PHE 40 HB2 PHE 40 29.994 32.487 -7.990 290 HB3 PHE 40 HB3 PHE 40 28.916 31.188 -7.501 291 HD1 PHE 40 HD2 PHE 40 32.476 32.055 -8.189 292 HD2 PHE 40 HD1 PHE 40 29.751 29.118 -6.599 293 HE1 PHE 40 HE2 PHE 40 34.378 30.861 -7.121 294 HE2 PHE 40 HE1 PHE 40 31.635 27.965 -5.486 295 HZ PHE 40 HZ PHE 40 33.961 28.827 -5.753 296 H LEU 41 H LEU 41 27.403 29.666 -9.250 297 HA LEU 41 HA LEU 41 28.745 27.071 -9.089 298 HB2 LEU 41 HB2 LEU 41 25.880 28.037 -8.835 299 HB3 LEU 41 HB3 LEU 41 26.265 26.322 -8.731 300 HG LEU 41 HG LEU 41 27.345 28.498 -6.905 301 HD11 LEU 41 HD11 LEU 41 24.950 27.996 -6.562 302 HD12 LEU 41 HD12 LEU 41 25.927 27.427 -5.200 303 HD13 LEU 41 HD13 LEU 41 25.329 26.263 -6.404 304 HD21 LEU 41 HD21 LEU 41 27.758 25.477 -6.852 305 HD22 LEU 41 HD22 LEU 41 28.125 26.556 -5.494 306 HD23 LEU 41 HD23 LEU 41 29.016 26.724 -6.997 307 H ARG 42 H ARG 42 26.718 28.599 -11.586 308 HA ARG 42 HA ARG 42 26.369 26.337 -13.244 309 HB2 ARG 42 HB2 ARG 42 26.169 27.893 -15.103 310 HB3 ARG 42 HB3 ARG 42 25.385 28.557 -13.668 311 HG2 ARG 42 HG2 ARG 42 27.339 30.024 -13.253 312 HG3 ARG 42 HG3 ARG 42 28.172 29.326 -14.650 313 HD2 ARG 42 HD2 ARG 42 26.268 30.129 -16.118 314 HD3 ARG 42 HD3 ARG 42 25.637 30.990 -14.712 315 HE ARG 42 HE ARG 42 27.344 32.587 -14.903 316 HH11 ARG 42 HH22 ARG 42 28.248 29.976 -17.108 317 HH12 ARG 42 HH21 ARG 42 29.646 30.867 -17.647 318 HH21 ARG 42 HH11 ARG 42 28.979 33.567 -15.584 319 HH22 ARG 42 HH12 ARG 42 30.082 32.907 -16.801 320 H GLU 43 H GLU 43 29.376 28.128 -12.754 321 HA GLU 43 HA GLU 43 30.816 26.751 -14.873 322 HB2 GLU 43 HB2 GLU 43 32.000 28.314 -12.554 323 HB3 GLU 43 HB3 GLU 43 32.713 27.981 -14.140 324 HG2 GLU 43 HG2 GLU 43 30.645 29.273 -15.070 325 HG3 GLU 43 HG3 GLU 43 30.481 29.894 -13.424 326 H GLN 44 H GLN 44 29.760 25.478 -11.935 327 HA GLN 44 HA GLN 44 32.260 23.902 -11.457 328 HB2 GLN 44 HB2 GLN 44 30.126 24.729 -9.449 329 HB3 GLN 44 HB3 GLN 44 31.660 23.935 -9.101 330 HG2 GLN 44 HG2 GLN 44 31.315 26.735 -10.208 331 HG3 GLN 44 HG3 GLN 44 31.662 26.357 -8.537 332 HE21 GLN 44 HE21 GLN 44 33.240 28.093 -10.072 333 HE22 GLN 44 HE22 GLN 44 34.829 27.337 -10.245 334 H ILE 45 H ILE 45 28.919 23.673 -12.298 335 HA ILE 45 HA ILE 45 28.160 21.327 -10.959 336 HB ILE 45 HB ILE 45 26.808 20.940 -13.220 337 HG12 ILE 45 HG12 ILE 45 27.064 23.956 -13.363 338 HG13 ILE 45 HG13 ILE 45 28.051 22.905 -14.401 339 HG21 ILE 45 HG21 ILE 45 25.015 22.184 -12.210 340 HG22 ILE 45 HG22 ILE 45 26.019 21.502 -10.921 341 HG23 ILE 45 HG23 ILE 45 26.168 23.232 -11.328 342 HD11 ILE 45 HD11 ILE 45 26.077 23.648 -15.604 343 HD12 ILE 45 HD12 ILE 45 25.971 21.899 -15.327 344 HD13 ILE 45 HD13 ILE 45 25.005 23.023 -14.342 345 H ARG 46 H ARG 46 29.177 21.228 -14.485 346 HA ARG 46 HA ARG 46 30.317 19.983 -15.639 347 HB2 ARG 46 HB2 ARG 46 31.675 18.738 -13.229 348 HB3 ARG 46 HB3 ARG 46 32.260 18.730 -14.888 349 HG2 ARG 46 HG2 ARG 46 32.055 21.137 -13.044 350 HG3 ARG 46 HG3 ARG 46 33.520 20.316 -13.553 351 HD2 ARG 46 HD2 ARG 46 33.156 21.056 -15.886 352 HD3 ARG 46 HD3 ARG 46 31.633 21.814 -15.421 353 HE ARG 46 HE ARG 46 32.741 23.560 -14.330 354 HH11 ARG 46 HH12 ARG 46 35.194 21.334 -15.511 355 HH12 ARG 46 HH11 ARG 46 36.473 22.477 -15.209 356 HH21 ARG 46 HH21 ARG 46 34.339 24.887 -13.936 357 HH22 ARG 46 HH22 ARG 46 36.001 24.484 -14.336 358 H ASP 47 H ASP 47 28.361 18.406 -13.405 359 HA ASP 47 HA ASP 47 27.817 16.246 -15.408 360 HB2 ASP 47 HB2 ASP 47 28.314 15.770 -12.450 361 HB3 ASP 47 HB3 ASP 47 27.845 14.554 -13.636 362 H ALA 48 H ALA 48 26.729 18.052 -12.552 363 HA ALA 48 HA ALA 48 24.058 16.972 -12.442 364 HB1 ALA 48 HB1 ALA 48 23.747 19.043 -10.991 365 HB2 ALA 48 HB2 ALA 48 25.116 18.000 -10.503 366 HB3 ALA 48 HB3 ALA 48 25.409 19.492 -11.397 367 H ARG 49 H ARG 49 22.096 17.991 -13.147 368 HA ARG 49 HA ARG 49 22.365 19.778 -15.515 369 HB2 ARG 49 HB2 ARG 49 20.577 17.731 -14.902 370 HB3 ARG 49 HB3 ARG 49 19.644 19.148 -14.478 371 HG2 ARG 49 HG2 ARG 49 19.156 18.585 -16.752 372 HG3 ARG 49 HG3 ARG 49 20.092 20.077 -16.770 373 HD2 ARG 49 HD2 ARG 49 20.781 18.549 -18.568 374 HD3 ARG 49 HD3 ARG 49 22.115 18.830 -17.469 375 HE ARG 49 HE ARG 49 20.504 16.336 -17.791 376 HH11 ARG 49 HH11 ARG 49 23.416 17.739 -16.438 377 HH12 ARG 49 HH12 ARG 49 23.901 16.246 -15.673 378 HH21 ARG 49 HH22 ARG 49 21.236 14.436 -16.818 379 HH22 ARG 49 HH21 ARG 49 22.537 14.556 -15.651 380 H TYR 50 H TYR 50 20.903 19.870 -12.267 381 HA TYR 50 HA TYR 50 21.016 22.857 -12.309 382 HB2 TYR 50 HB2 TYR 50 18.921 21.243 -10.850 383 HB3 TYR 50 HB3 TYR 50 18.836 22.907 -11.367 384 HD1 TYR 50 HD1 TYR 50 19.299 22.882 -14.231 385 HD2 TYR 50 HD2 TYR 50 17.185 20.033 -11.803 386 HE1 TYR 50 HE1 TYR 50 17.968 22.203 -16.208 387 HE2 TYR 50 HE2 TYR 50 15.862 19.326 -13.793 388 HH TYR 50 HH TYR 50 16.362 20.776 -17.016 389 H ALA 51 H ALA 51 22.299 23.669 -10.574 390 HA ALA 51 HA ALA 51 22.682 21.890 -8.201 391 HB1 ALA 51 HB1 ALA 51 24.255 24.312 -9.160 392 HB2 ALA 51 HB2 ALA 51 24.519 23.446 -7.631 393 HB3 ALA 51 HB3 ALA 51 24.778 22.609 -9.171 394 H VAL 52 H VAL 52 22.021 22.636 -6.165 395 HA VAL 52 HA VAL 52 20.369 25.124 -6.055 396 HB VAL 52 HB VAL 52 19.474 22.298 -5.417 397 HG11 VAL 52 HG11 VAL 52 18.650 23.668 -3.579 398 HG12 VAL 52 HG12 VAL 52 18.107 24.930 -4.709 399 HG13 VAL 52 HG13 VAL 52 17.313 23.343 -4.678 400 HG21 VAL 52 HG21 VAL 52 17.599 22.865 -6.947 401 HG22 VAL 52 HG22 VAL 52 18.400 24.404 -7.322 402 HG23 VAL 52 HG23 VAL 52 19.167 22.861 -7.749 403 H ILE 53 H ILE 53 20.319 26.144 -4.106 404 HA ILE 53 HA ILE 53 22.202 25.081 -2.072 405 HB ILE 53 HB ILE 53 22.183 27.493 -3.723 406 HG12 ILE 53 HG12 ILE 53 23.974 25.847 -3.711 407 HG13 ILE 53 HG13 ILE 53 24.547 27.464 -3.310 408 HG21 ILE 53 HG21 ILE 53 23.192 29.069 -2.107 409 HG22 ILE 53 HG22 ILE 53 21.480 28.793 -1.813 410 HG23 ILE 53 HG23 ILE 53 22.678 28.028 -0.763 411 HD11 ILE 53 HD11 ILE 53 25.653 25.919 -1.857 412 HD12 ILE 53 HD12 ILE 53 24.485 26.791 -0.852 413 HD13 ILE 53 HD13 ILE 53 24.143 25.138 -1.377 414 H ARG 54 H ARG 54 21.741 24.953 -0.074 415 HA ARG 54 HA ARG 54 19.758 26.810 1.203 416 HB2 ARG 54 HB2 ARG 54 20.350 23.889 1.808 417 HB3 ARG 54 HB3 ARG 54 19.263 24.922 2.734 418 HG2 ARG 54 HG2 ARG 54 18.860 24.103 -0.187 419 HG3 ARG 54 HG3 ARG 54 18.126 23.304 1.205 420 HD2 ARG 54 HD2 ARG 54 16.965 25.357 1.836 421 HD3 ARG 54 HD3 ARG 54 17.697 26.218 0.462 422 HE ARG 54 HE ARG 54 16.474 24.068 -0.737 423 HH11 ARG 54 HH11 ARG 54 15.212 26.563 1.380 424 HH12 ARG 54 HH12 ARG 54 13.621 26.485 0.678 425 HH21 ARG 54 HH21 ARG 54 14.417 24.024 -1.593 426 HH22 ARG 54 HH22 ARG 54 13.194 25.087 -0.970 427 H ILE 55 H ILE 55 21.505 28.250 1.649 428 HA ILE 55 HA ILE 55 23.421 27.357 3.773 429 HB ILE 55 HB ILE 55 23.472 29.825 2.019 430 HG12 ILE 55 HG12 ILE 55 25.781 27.909 2.259 431 HG13 ILE 55 HG13 ILE 55 24.407 27.400 1.281 432 HG21 ILE 55 HG21 ILE 55 25.671 30.287 3.222 433 HG22 ILE 55 HG22 ILE 55 24.239 30.503 4.226 434 HG23 ILE 55 HG23 ILE 55 25.233 29.037 4.396 435 HD11 ILE 55 HD11 ILE 55 26.118 28.493 -0.064 436 HD12 ILE 55 HD12 ILE 55 24.612 29.440 -0.077 437 HD13 ILE 55 HD13 ILE 55 25.992 29.970 0.910 438 HA PRO 56 HA PRO 56 20.410 29.422 6.455 439 HB2 PRO 56 HB2 PRO 56 22.703 29.260 8.398 440 HB3 PRO 56 HB3 PRO 56 20.974 28.872 8.655 441 HG2 PRO 56 HG2 PRO 56 22.775 26.876 8.293 442 HG3 PRO 56 HG3 PRO 56 21.180 26.804 7.478 443 HD2 PRO 56 HD2 PRO 56 23.841 27.672 6.319 444 HD3 PRO 56 HD3 PRO 56 22.585 26.597 5.621 445 H GLY 57 H GLY 57 20.024 31.555 6.694 446 HA2 GLY 57 HA2 GLY 57 20.357 33.778 7.196 447 HA3 GLY 57 HA3 GLY 57 22.094 33.512 7.326 448 H GLN 58 H GLN 58 21.130 32.331 4.273 449 HA GLN 58 HA GLN 58 21.079 35.001 3.017 450 HB2 GLN 58 HB2 GLN 58 22.910 34.688 1.591 451 HB3 GLN 58 HB3 GLN 58 23.424 34.140 3.183 452 HG2 GLN 58 HG2 GLN 58 23.120 31.831 2.509 453 HG3 GLN 58 HG3 GLN 58 22.650 32.316 0.865 454 HE21 GLN 58 HE21 GLN 58 25.313 33.082 3.230 455 HE22 GLN 58 HE22 GLN 58 26.584 33.067 2.033 456 HA PRO 59 HA PRO 59 18.050 33.592 0.274 457 HB2 PRO 59 HB2 PRO 59 19.668 34.545 -2.091 458 HB3 PRO 59 HB3 PRO 59 17.968 34.909 -1.662 459 HG2 PRO 59 HG2 PRO 59 19.920 36.730 -1.195 460 HG3 PRO 59 HG3 PRO 59 18.650 36.442 0.037 461 HD2 PRO 59 HD2 PRO 59 21.475 35.330 -0.031 462 HD3 PRO 59 HD3 PRO 59 20.566 36.062 1.317 463 H VAL 60 H VAL 60 17.421 31.729 -0.648 464 HA VAL 60 HA VAL 60 19.089 29.603 -1.473 465 HB VAL 60 HB VAL 60 16.201 30.280 -2.177 466 HG11 VAL 60 HG11 VAL 60 16.968 28.715 -3.890 467 HG12 VAL 60 HG12 VAL 60 17.648 27.639 -2.651 468 HG13 VAL 60 HG13 VAL 60 15.897 27.893 -2.760 469 HG21 VAL 60 HG21 VAL 60 15.685 28.545 -0.485 470 HG22 VAL 60 HG22 VAL 60 17.424 28.352 -0.160 471 HG23 VAL 60 HG23 VAL 60 16.600 29.876 0.223 472 H VAL 61 H VAL 61 20.144 29.129 -3.281 473 HA VAL 61 HA VAL 61 19.695 30.721 -5.783 474 HB VAL 61 HB VAL 61 22.231 29.421 -4.728 475 HG11 VAL 61 HG11 VAL 61 21.789 30.783 -7.411 476 HG12 VAL 61 HG12 VAL 61 23.356 30.279 -6.726 477 HG13 VAL 61 HG13 VAL 61 22.165 29.059 -7.157 478 HG21 VAL 61 HG21 VAL 61 23.123 31.708 -4.830 479 HG22 VAL 61 HG22 VAL 61 21.537 32.317 -5.359 480 HG23 VAL 61 HG23 VAL 61 21.740 31.615 -3.738 481 H GLU 62 H GLU 62 19.362 29.605 -7.711 482 HA GLU 62 HA GLU 62 19.430 26.643 -7.704 483 HB2 GLU 62 HB2 GLU 62 17.039 28.322 -8.595 484 HB3 GLU 62 HB3 GLU 62 17.244 26.585 -8.845 485 HG2 GLU 62 HG2 GLU 62 17.236 26.234 -6.387 486 HG3 GLU 62 HG3 GLU 62 17.007 27.967 -6.141 487 H VAL 63 H VAL 63 20.785 26.157 -9.377 488 HA VAL 63 HA VAL 63 21.287 28.082 -11.545 489 HB VAL 63 HB VAL 63 22.606 25.444 -10.864 490 HG11 VAL 63 HG11 VAL 63 23.248 26.132 -13.099 491 HG12 VAL 63 HG12 VAL 63 23.579 27.790 -12.518 492 HG13 VAL 63 HG13 VAL 63 24.584 26.420 -11.992 493 HG21 VAL 63 HG21 VAL 63 23.545 28.200 -10.008 494 HG22 VAL 63 HG22 VAL 63 22.837 26.986 -8.913 495 HG23 VAL 63 HG23 VAL 63 24.342 26.637 -9.735 496 H GLY 64 H GLY 64 21.354 27.370 -13.830 497 HA2 GLY 64 HA2 GLY 64 20.674 26.186 -15.654 498 HA3 GLY 64 HA3 GLY 64 20.338 24.815 -14.608 499 H THR 65 H THR 65 18.202 24.420 -13.957 500 HA THR 65 HA THR 65 16.030 26.251 -14.704 501 HB THR 65 HB THR 65 15.928 23.458 -15.893 502 HG1 THR 65 HG1 THR 65 16.350 24.454 -17.888 503 HG21 THR 65 HG21 THR 65 13.744 24.522 -15.673 504 HG22 THR 65 HG22 THR 65 14.206 24.502 -17.371 505 HG23 THR 65 HG23 THR 65 14.352 26.010 -16.440 506 H LYS 66 H LYS 66 14.116 25.782 -13.530 507 HA LYS 66 HA LYS 66 14.342 24.186 -11.206 508 HB2 LYS 66 HB2 LYS 66 12.859 26.149 -11.355 509 HB3 LYS 66 HB3 LYS 66 11.841 25.314 -12.540 510 HG2 LYS 66 HG2 LYS 66 11.326 23.566 -10.827 511 HG3 LYS 66 HG3 LYS 66 12.298 24.458 -9.644 512 HD2 LYS 66 HD2 LYS 66 10.775 26.393 -9.857 513 HD3 LYS 66 HD3 LYS 66 9.817 25.539 -11.072 514 HE2 LYS 66 HE2 LYS 66 10.244 24.603 -8.192 515 HE3 LYS 66 HE3 LYS 66 8.840 25.515 -8.753 516 HZ1 LYS 66 HZ1 LYS 66 9.589 22.792 -9.708 517 HZ2 LYS 66 HZ2 LYS 66 8.317 23.668 -10.268 518 HZ3 LYS 66 HZ3 LYS 66 8.344 23.161 -8.718 519 HA PRO 67 HA PRO 67 13.236 20.240 -13.066 520 HB2 PRO 67 HB2 PRO 67 13.370 18.652 -10.866 521 HB3 PRO 67 HB3 PRO 67 14.820 19.334 -11.671 522 HG2 PRO 67 HG2 PRO 67 13.408 20.339 -9.194 523 HG3 PRO 67 HG3 PRO 67 15.171 20.157 -9.519 524 HD2 PRO 67 HD2 PRO 67 13.836 22.547 -9.782 525 HD3 PRO 67 HD3 PRO 67 15.269 22.102 -10.758 526 H THR 68 H THR 68 11.547 18.924 -13.262 527 HA THR 68 HA THR 68 9.015 19.795 -12.406 528 HB THR 68 HB THR 68 9.576 18.946 -14.631 529 HG1 THR 68 HG1 THR 68 7.645 17.872 -14.938 530 HG21 THR 68 HG21 THR 68 10.882 16.884 -13.883 531 HG22 THR 68 HG22 THR 68 9.692 16.619 -15.169 532 HG23 THR 68 HG23 THR 68 9.311 16.132 -13.509 533 H GLY 69 H GLY 69 10.912 17.168 -11.154 534 HA2 GLY 69 HA2 GLY 69 10.196 16.447 -8.797 535 HA3 GLY 69 HA3 GLY 69 8.624 16.096 -9.534 536 H ASP 70 H ASP 70 9.596 15.074 -11.975 537 HA ASP 70 HA ASP 70 10.553 12.389 -11.283 538 HB2 ASP 70 HB2 ASP 70 9.879 13.599 -13.968 539 HB3 ASP 70 HB3 ASP 70 10.300 11.906 -13.686 540 H VAL 71 H VAL 71 12.419 13.566 -10.275 541 HA VAL 71 HA VAL 71 14.758 13.622 -12.087 542 HB VAL 71 HB VAL 71 15.616 15.634 -11.014 543 HG11 VAL 71 HG11 VAL 71 14.079 15.680 -13.118 544 HG12 VAL 71 HG12 VAL 71 12.875 16.430 -12.063 545 HG13 VAL 71 HG13 VAL 71 14.463 17.180 -12.309 546 HG21 VAL 71 HG21 VAL 71 12.914 15.964 -9.660 547 HG22 VAL 71 HG22 VAL 71 14.414 15.484 -8.840 548 HG23 VAL 71 HG23 VAL 71 14.307 17.067 -9.593 549 H LEU 72 H LEU 72 16.779 13.523 -11.036 550 HA LEU 72 HA LEU 72 16.868 11.670 -8.694 551 HB2 LEU 72 HB2 LEU 72 18.901 12.396 -10.852 552 HB3 LEU 72 HB3 LEU 72 19.185 11.237 -9.563 553 HG LEU 72 HG LEU 72 16.965 11.023 -11.610 554 HD11 LEU 72 HD11 LEU 72 18.357 9.265 -12.688 555 HD12 LEU 72 HD12 LEU 72 19.661 9.592 -11.518 556 HD13 LEU 72 HD13 LEU 72 19.176 10.833 -12.702 557 HD21 LEU 72 HD21 LEU 72 18.020 9.091 -9.548 558 HD22 LEU 72 HD22 LEU 72 16.927 8.615 -10.872 559 HD23 LEU 72 HD23 LEU 72 16.391 9.790 -9.660 560 H GLN 73 H GLN 73 17.507 12.442 -6.773 561 HA GLN 73 HA GLN 73 18.711 15.137 -6.671 562 HB2 GLN 73 HB2 GLN 73 17.101 13.487 -4.721 563 HB3 GLN 73 HB3 GLN 73 17.823 15.057 -4.368 564 HG2 GLN 73 HG2 GLN 73 16.550 15.979 -6.380 565 HG3 GLN 73 HG3 GLN 73 15.657 14.463 -6.434 566 HE21 GLN 73 HE21 GLN 73 14.837 17.358 -5.799 567 HE22 GLN 73 HE22 GLN 73 14.020 17.209 -4.239 568 H GLY 74 H GLY 74 20.822 15.277 -6.373 569 HA2 GLY 74 HA2 GLY 74 22.339 13.352 -4.637 570 HA3 GLY 74 HA3 GLY 74 23.032 14.577 -5.718 571 H ARG 75 H ARG 75 23.480 14.302 -2.727 572 HA ARG 75 HA ARG 75 22.644 16.981 -1.874 573 HB2 ARG 75 HB2 ARG 75 20.579 15.601 -1.572 574 HB3 ARG 75 HB3 ARG 75 21.455 14.571 -0.436 575 HG2 ARG 75 HG2 ARG 75 21.774 16.503 1.083 576 HG3 ARG 75 HG3 ARG 75 20.995 17.578 -0.100 577 HD2 ARG 75 HD2 ARG 75 18.895 16.339 0.105 578 HD3 ARG 75 HD3 ARG 75 19.661 15.170 1.205 579 HE ARG 75 HE ARG 75 20.034 17.739 2.326 580 HH11 ARG 75 HH21 ARG 75 17.336 15.598 1.701 581 HH12 ARG 75 HH22 ARG 75 16.405 16.216 3.037 582 HH21 ARG 75 HH11 ARG 75 18.798 18.484 4.037 583 HH22 ARG 75 HH12 ARG 75 17.219 17.816 4.319 584 H ALA 76 H ALA 76 23.902 17.822 -0.469 585 HA ALA 76 HA ALA 76 25.644 16.176 1.364 586 HB1 ALA 76 HB1 ALA 76 26.571 18.258 -0.662 587 HB2 ALA 76 HB2 ALA 76 27.620 17.448 0.531 588 HB3 ALA 76 HB3 ALA 76 26.841 16.506 -0.755 589 H THR 77 H THR 77 26.940 17.436 2.884 590 HA THR 77 HA THR 77 25.645 19.977 3.787 591 HB THR 77 HB THR 77 26.818 17.809 5.561 592 HG1 THR 77 HG1 THR 77 24.144 18.701 5.262 593 HG21 THR 77 HG21 THR 77 25.927 19.141 7.430 594 HG22 THR 77 HG22 THR 77 25.396 20.410 6.308 595 HG23 THR 77 HG23 THR 77 27.125 20.076 6.530 596 H GLY 78 H GLY 78 27.042 21.615 4.031 597 HA2 GLY 78 HA2 GLY 78 29.871 21.171 3.196 598 HA3 GLY 78 HA3 GLY 78 29.014 22.684 3.161 599 H GLU 79 H GLU 79 31.393 22.891 4.093 600 HA GLU 79 HA GLU 79 31.762 22.079 6.844 601 HB2 GLU 79 HB2 GLU 79 33.514 23.595 4.905 602 HB3 GLU 79 HB3 GLU 79 34.028 23.150 6.528 603 HG2 GLU 79 HG2 GLU 79 33.185 21.175 4.361 604 HG3 GLU 79 HG3 GLU 79 34.842 21.600 4.766 605 H GLU 80 H GLU 80 30.209 24.952 5.702 606 HA GLU 80 HA GLU 80 30.949 26.338 8.281 607 HB2 GLU 80 HB2 GLU 80 29.562 27.410 5.836 608 HB3 GLU 80 HB3 GLU 80 29.909 28.327 7.297 609 HG2 GLU 80 HG2 GLU 80 32.107 27.127 5.536 610 HG3 GLU 80 HG3 GLU 80 31.411 28.704 5.377 611 H GLY 81 H GLY 81 28.929 24.048 7.276 612 HA2 GLY 81 HA2 GLY 81 27.166 23.158 8.399 613 HA3 GLY 81 HA3 GLY 81 26.773 24.707 9.132 614 H GLU 82 H GLU 82 27.204 24.631 5.619 615 HA GLU 82 HA GLU 82 24.400 25.234 5.180 616 HB2 GLU 82 HB2 GLU 82 25.097 25.961 3.109 617 HB3 GLU 82 HB3 GLU 82 26.322 26.548 4.232 618 HG2 GLU 82 HG2 GLU 82 26.736 24.054 2.521 619 HG3 GLU 82 HG3 GLU 82 26.976 25.668 1.895 620 H THR 83 H THR 83 23.575 24.312 2.891 621 HA THR 83 HA THR 83 24.084 21.394 2.719 622 HB THR 83 HB THR 83 21.450 22.741 3.293 623 HG1 THR 83 HG1 THR 83 22.711 21.789 4.931 624 HG21 THR 83 HG21 THR 83 20.911 21.398 1.322 625 HG22 THR 83 HG22 THR 83 20.310 20.597 2.773 626 HG23 THR 83 HG23 THR 83 21.800 20.002 1.996 627 H VAL 84 H VAL 84 24.213 20.703 0.799 628 HA VAL 84 HA VAL 84 23.548 22.454 -1.575 629 HB VAL 84 HB VAL 84 25.831 20.487 -1.180 630 HG11 VAL 84 HG11 VAL 84 25.036 21.936 -3.749 631 HG12 VAL 84 HG12 VAL 84 26.545 21.037 -3.470 632 HG13 VAL 84 HG13 VAL 84 25.022 20.170 -3.489 633 HG21 VAL 84 HG21 VAL 84 26.261 22.723 -0.272 634 HG22 VAL 84 HG22 VAL 84 27.167 22.533 -1.787 635 HG23 VAL 84 HG23 VAL 84 25.679 23.469 -1.781 636 H LEU 85 H LEU 85 22.469 21.617 -3.283 637 HA LEU 85 HA LEU 85 21.678 18.763 -3.236 638 HB2 LEU 85 HB2 LEU 85 19.852 20.101 -2.238 639 HB3 LEU 85 HB3 LEU 85 19.855 21.152 -3.633 640 HG LEU 85 HG LEU 85 19.266 18.998 -5.016 641 HD11 LEU 85 HD11 LEU 85 18.267 18.079 -2.288 642 HD12 LEU 85 HD12 LEU 85 19.726 17.428 -3.037 643 HD13 LEU 85 HD13 LEU 85 18.172 17.227 -3.851 644 HD21 LEU 85 HD21 LEU 85 16.874 19.218 -4.458 645 HD22 LEU 85 HD22 LEU 85 17.675 20.783 -4.672 646 HD23 LEU 85 HD23 LEU 85 17.303 20.195 -3.034 647 H VAL 86 H VAL 86 21.414 17.907 -5.190 648 HA VAL 86 HA VAL 86 22.119 19.396 -7.712 649 HB VAL 86 HB VAL 86 23.159 16.732 -6.702 650 HG11 VAL 86 HG11 VAL 86 24.088 16.378 -9.039 651 HG12 VAL 86 HG12 VAL 86 22.370 16.058 -8.834 652 HG13 VAL 86 HG13 VAL 86 22.876 17.568 -9.601 653 HG21 VAL 86 HG21 VAL 86 24.520 18.759 -6.301 654 HG22 VAL 86 HG22 VAL 86 25.324 17.640 -7.409 655 HG23 VAL 86 HG23 VAL 86 24.526 19.099 -8.048 656 H GLU 87 H GLU 87 20.723 18.952 -9.413 657 HA GLU 87 HA GLU 87 18.870 16.673 -9.099 658 HB2 GLU 87 HB2 GLU 87 17.874 19.475 -9.670 659 HB3 GLU 87 HB3 GLU 87 16.914 17.985 -9.647 660 HG2 GLU 87 HG2 GLU 87 17.731 17.682 -7.221 661 HG3 GLU 87 HG3 GLU 87 18.342 19.330 -7.311 662 H GLU 88 H GLU 88 18.432 15.654 -10.863 663 HA GLU 88 HA GLU 88 18.665 16.889 -13.522 664 HB2 GLU 88 HB2 GLU 88 20.090 15.150 -14.439 665 HB3 GLU 88 HB3 GLU 88 20.929 16.125 -13.243 666 HG2 GLU 88 HG2 GLU 88 20.857 14.324 -11.656 667 HG3 GLU 88 HG3 GLU 88 19.747 13.394 -12.694 668 HA PRO 89 HA PRO 89 15.165 14.539 -14.557 669 HB2 PRO 89 HB2 PRO 89 15.490 13.833 -17.217 670 HB3 PRO 89 HB3 PRO 89 15.023 15.456 -16.618 671 HG2 PRO 89 HG2 PRO 89 17.794 14.464 -17.345 672 HG3 PRO 89 HG3 PRO 89 16.998 15.995 -17.846 673 HD2 PRO 89 HD2 PRO 89 18.736 15.986 -15.813 674 HD3 PRO 89 HD3 PRO 89 17.223 16.914 -15.646 675 H ARG 90 H ARG 90 14.393 12.640 -14.355 676 HA ARG 90 HA ARG 90 16.084 10.301 -13.859 677 HB2 ARG 90 HB2 ARG 90 14.131 10.946 -12.423 678 HB3 ARG 90 HB3 ARG 90 13.052 10.519 -13.763 679 HG2 ARG 90 HG2 ARG 90 14.004 8.168 -13.682 680 HG3 ARG 90 HG3 ARG 90 14.973 8.663 -12.283 681 HD2 ARG 90 HD2 ARG 90 13.036 7.590 -11.404 682 HD3 ARG 90 HD3 ARG 90 12.821 9.330 -11.146 683 HE ARG 90 HE ARG 90 11.628 7.904 -13.511 684 HH11 ARG 90 HH11 ARG 90 10.893 9.751 -10.592 685 HH12 ARG 90 HH12 ARG 90 9.375 10.311 -11.309 686 HH21 ARG 90 HH21 ARG 90 9.601 8.621 -14.189 687 HH22 ARG 90 HH22 ARG 90 8.724 9.728 -13.136 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 5.851 -10.380 -20.735 2 H2 GLY 1 H2 GLY 1 4.566 -10.454 -19.720 3 H3 GLY 1 H3 GLY 1 5.876 -11.398 -19.452 4 HA2 GLY 1 HA2 GLY 1 5.816 -8.449 -19.285 5 HA3 GLY 1 HA3 GLY 1 5.852 -9.555 -17.899 6 H SER 2 H SER 2 7.794 -8.208 -17.372 7 HA SER 2 HA SER 2 10.215 -9.708 -18.102 8 HB2 SER 2 HB2 SER 2 9.923 -6.729 -18.663 9 HB3 SER 2 HB3 SER 2 11.493 -7.535 -18.501 10 HG SER 2 HG SER 2 9.664 -8.763 -20.191 11 H GLU 3 H GLU 3 11.967 -9.375 -16.660 12 HA GLU 3 HA GLU 3 11.213 -9.254 -13.971 13 HB2 GLU 3 HB2 GLU 3 13.996 -9.007 -15.180 14 HB3 GLU 3 HB3 GLU 3 13.651 -9.407 -13.500 15 HG2 GLU 3 HG2 GLU 3 12.918 -11.092 -15.933 16 HG3 GLU 3 HG3 GLU 3 14.215 -11.406 -14.790 17 H THR 4 H THR 4 12.009 -8.028 -12.199 18 HA THR 4 HA THR 4 11.376 -5.298 -12.263 19 HB THR 4 HB THR 4 13.093 -6.712 -10.184 20 HG1 THR 4 HG1 THR 4 11.105 -7.215 -9.236 21 HG21 THR 4 HG21 THR 4 12.923 -4.317 -9.702 22 HG22 THR 4 HG22 THR 4 11.890 -5.205 -8.586 23 HG23 THR 4 HG23 THR 4 11.161 -4.355 -9.966 24 H ARG 5 H ARG 5 12.549 -3.399 -12.065 25 HA ARG 5 HA ARG 5 15.145 -3.348 -13.444 26 HB2 ARG 5 HB2 ARG 5 14.909 -0.947 -13.466 27 HB3 ARG 5 HB3 ARG 5 13.445 -1.740 -14.042 28 HG2 ARG 5 HG2 ARG 5 12.429 -1.353 -11.720 29 HG3 ARG 5 HG3 ARG 5 13.875 -0.414 -11.328 30 HD2 ARG 5 HD2 ARG 5 12.192 1.134 -11.965 31 HD3 ARG 5 HD3 ARG 5 13.393 1.089 -13.251 32 HE ARG 5 HE ARG 5 11.833 0.180 -14.719 33 HH11 ARG 5 HH11 ARG 5 10.364 0.177 -11.528 34 HH12 ARG 5 HH12 ARG 5 8.783 -0.190 -12.161 35 HH21 ARG 5 HH21 ARG 5 9.794 -0.287 -15.450 36 HH22 ARG 5 HH22 ARG 5 8.475 -0.444 -14.328 37 H THR 6 H THR 6 17.047 -3.510 -12.494 38 HA THR 6 HA THR 6 17.714 -3.555 -9.850 39 HB THR 6 HB THR 6 19.508 -2.350 -11.995 40 HG1 THR 6 HG1 THR 6 20.043 -4.503 -12.427 41 HG21 THR 6 HG21 THR 6 20.132 -4.051 -9.533 42 HG22 THR 6 HG22 THR 6 20.555 -2.338 -9.763 43 HG23 THR 6 HG23 THR 6 21.307 -3.568 -10.777 44 H ILE 7 H ILE 7 18.240 -2.133 -8.165 45 HA ILE 7 HA ILE 7 17.283 0.505 -8.129 46 HB ILE 7 HB ILE 7 19.386 -0.804 -6.361 47 HG12 ILE 7 HG12 ILE 7 16.352 -0.581 -6.022 48 HG13 ILE 7 HG13 ILE 7 17.214 -2.050 -6.474 49 HG21 ILE 7 HG21 ILE 7 17.628 1.642 -5.820 50 HG22 ILE 7 HG22 ILE 7 18.752 0.889 -4.670 51 HG23 ILE 7 HG23 ILE 7 19.388 1.671 -6.093 52 HD11 ILE 7 HD11 ILE 7 18.453 -1.968 -4.296 53 HD12 ILE 7 HD12 ILE 7 17.368 -0.643 -3.798 54 HD13 ILE 7 HD13 ILE 7 16.702 -2.237 -4.173 55 H SER 8 H SER 8 18.198 2.531 -8.508 56 HA SER 8 HA SER 8 20.426 2.454 -10.311 57 HB2 SER 8 HB2 SER 8 18.166 3.682 -10.567 58 HB3 SER 8 HB3 SER 8 18.903 4.963 -9.585 59 HG SER 8 HG SER 8 19.152 5.204 -11.895 60 H SER 9 H SER 9 21.261 2.109 -7.586 61 HA SER 9 HA SER 9 23.030 4.055 -6.779 62 HB2 SER 9 HB2 SER 9 23.541 1.074 -6.682 63 HB3 SER 9 HB3 SER 9 24.159 2.299 -5.564 64 HG SER 9 HG SER 9 22.153 2.550 -4.708 65 H THR 10 H THR 10 23.316 4.437 -9.371 66 HA THR 10 HA THR 10 26.169 4.234 -9.878 67 HB THR 10 HB THR 10 25.708 3.934 -12.323 68 HG1 THR 10 HG1 THR 10 23.783 2.789 -12.836 69 HG21 THR 10 HG21 THR 10 25.618 1.491 -12.280 70 HG22 THR 10 HG22 THR 10 24.928 1.515 -10.641 71 HG23 THR 10 HG23 THR 10 26.596 2.064 -10.917 72 H ALA 11 H ALA 11 23.184 5.346 -11.530 73 HA ALA 11 HA ALA 11 24.120 8.030 -11.935 74 HB1 ALA 11 HB1 ALA 11 21.310 6.863 -12.062 75 HB2 ALA 11 HB2 ALA 11 21.831 8.420 -12.744 76 HB3 ALA 11 HB3 ALA 11 22.490 6.903 -13.391 77 H GLN 12 H GLN 12 21.728 6.695 -9.528 78 HA GLN 12 HA GLN 12 21.448 9.265 -8.194 79 HB2 GLN 12 HB2 GLN 12 19.740 7.484 -8.128 80 HB3 GLN 12 HB3 GLN 12 20.841 6.441 -7.240 81 HG2 GLN 12 HG2 GLN 12 19.129 7.451 -5.799 82 HG3 GLN 12 HG3 GLN 12 20.761 7.840 -5.288 83 HE21 GLN 12 HE21 GLN 12 21.535 10.060 -5.589 84 HE22 GLN 12 HE22 GLN 12 20.283 11.304 -5.488 85 H GLU 13 H GLU 13 23.755 6.592 -7.894 86 HA GLU 13 HA GLU 13 24.920 7.489 -5.410 87 HB2 GLU 13 HB2 GLU 13 25.017 5.170 -6.328 88 HB3 GLU 13 HB3 GLU 13 26.094 5.723 -7.594 89 HG2 GLU 13 HG2 GLU 13 27.519 4.789 -5.991 90 HG3 GLU 13 HG3 GLU 13 27.673 6.515 -5.696 91 H ARG 14 H ARG 14 26.158 7.848 -8.742 92 HA ARG 14 HA ARG 14 28.218 9.639 -8.116 93 HB2 ARG 14 HB2 ARG 14 28.378 10.391 -10.377 94 HB3 ARG 14 HB3 ARG 14 28.214 8.648 -10.315 95 HG2 ARG 14 HG2 ARG 14 26.370 8.641 -11.581 96 HG3 ARG 14 HG3 ARG 14 25.608 9.977 -10.731 97 HD2 ARG 14 HD2 ARG 14 27.886 10.563 -12.609 98 HD3 ARG 14 HD3 ARG 14 26.321 10.124 -13.272 99 HE ARG 14 HE ARG 14 26.826 12.521 -11.507 100 HH11 ARG 14 HH21 ARG 14 24.832 11.141 -14.151 101 HH12 ARG 14 HH22 ARG 14 23.976 12.687 -14.239 102 HH21 ARG 14 HH11 ARG 14 25.526 14.232 -11.747 103 HH22 ARG 14 HH12 ARG 14 24.379 14.241 -13.114 104 H VAL 15 H VAL 15 24.846 10.449 -8.786 105 HA VAL 15 HA VAL 15 25.001 13.272 -8.563 106 HB VAL 15 HB VAL 15 22.805 11.277 -8.053 107 HG11 VAL 15 HG11 VAL 15 22.574 14.252 -7.715 108 HG12 VAL 15 HG12 VAL 15 21.204 13.143 -8.001 109 HG13 VAL 15 HG13 VAL 15 22.221 12.913 -6.573 110 HG21 VAL 15 HG21 VAL 15 21.908 12.248 -10.111 111 HG22 VAL 15 HG22 VAL 15 23.175 13.504 -10.095 112 HG23 VAL 15 HG23 VAL 15 23.599 11.816 -10.413 113 H ASP 16 H ASP 16 25.127 10.857 -5.996 114 HA ASP 16 HA ASP 16 24.697 12.830 -3.869 115 HB2 ASP 16 HB2 ASP 16 24.278 10.361 -3.657 116 HB3 ASP 16 HB3 ASP 16 26.026 10.113 -3.653 117 H LEU 17 H LEU 17 27.622 11.447 -5.361 118 HA LEU 17 HA LEU 17 29.430 12.688 -3.530 119 HB2 LEU 17 HB2 LEU 17 29.738 11.151 -6.126 120 HB3 LEU 17 HB3 LEU 17 31.114 11.995 -5.454 121 HG LEU 17 HG LEU 17 31.158 9.659 -4.859 122 HD11 LEU 17 HD11 LEU 17 31.628 9.850 -2.507 123 HD12 LEU 17 HD12 LEU 17 30.630 11.303 -2.352 124 HD13 LEU 17 HD13 LEU 17 32.133 11.348 -3.305 125 HD21 LEU 17 HD21 LEU 17 29.611 8.625 -3.303 126 HD22 LEU 17 HD22 LEU 17 28.746 9.174 -4.744 127 HD23 LEU 17 HD23 LEU 17 28.630 10.100 -3.228 128 H GLU 18 H GLU 18 28.386 13.615 -6.783 129 HA GLU 18 HA GLU 18 30.029 15.972 -6.968 130 HB2 GLU 18 HB2 GLU 18 28.431 16.684 -8.722 131 HB3 GLU 18 HB3 GLU 18 29.056 15.046 -8.924 132 HG2 GLU 18 HG2 GLU 18 26.888 14.266 -7.724 133 HG3 GLU 18 HG3 GLU 18 26.300 15.872 -7.944 134 H ALA 19 H ALA 19 26.942 15.408 -5.205 135 HA ALA 19 HA ALA 19 26.507 18.197 -4.597 136 HB1 ALA 19 HB1 ALA 19 24.960 17.385 -2.969 137 HB2 ALA 19 HB2 ALA 19 24.848 16.306 -4.381 138 HB3 ALA 19 HB3 ALA 19 25.722 15.785 -2.924 139 H VAL 20 H VAL 20 28.547 15.680 -3.126 140 HA VAL 20 HA VAL 20 29.451 17.343 -0.873 141 HB VAL 20 HB VAL 20 30.549 14.766 -2.060 142 HG11 VAL 20 HG11 VAL 20 32.365 15.907 -0.849 143 HG12 VAL 20 HG12 VAL 20 31.289 16.194 0.538 144 HG13 VAL 20 HG13 VAL 20 31.777 14.542 0.098 145 HG21 VAL 20 HG21 VAL 20 28.306 14.526 -1.034 146 HG22 VAL 20 HG22 VAL 20 29.543 13.717 -0.074 147 HG23 VAL 20 HG23 VAL 20 28.905 15.288 0.455 148 H ARG 21 H ARG 21 30.741 16.608 -4.143 149 HA ARG 21 HA ARG 21 33.054 18.231 -3.970 150 HB2 ARG 21 HB2 ARG 21 32.480 16.615 -5.815 151 HB3 ARG 21 HB3 ARG 21 31.287 17.761 -6.415 152 HG2 ARG 21 HG2 ARG 21 33.328 17.871 -7.719 153 HG3 ARG 21 HG3 ARG 21 33.007 19.404 -6.918 154 HD2 ARG 21 HD2 ARG 21 35.411 18.838 -6.848 155 HD3 ARG 21 HD3 ARG 21 34.733 18.947 -5.237 156 HE ARG 21 HE ARG 21 35.078 16.673 -4.894 157 HH11 ARG 21 HH11 ARG 21 35.708 17.290 -8.292 158 HH12 ARG 21 HH12 ARG 21 36.397 15.710 -8.538 159 HH21 ARG 21 HH21 ARG 21 35.965 14.683 -5.284 160 HH22 ARG 21 HH22 ARG 21 36.539 14.278 -6.874 161 H LEU 22 H LEU 22 29.740 19.260 -4.973 162 HA LEU 22 HA LEU 22 30.488 22.073 -5.098 163 HB2 LEU 22 HB2 LEU 22 27.858 20.634 -5.231 164 HB3 LEU 22 HB3 LEU 22 27.966 22.383 -4.935 165 HG LEU 22 HG LEU 22 29.493 22.569 -6.964 166 HD11 LEU 22 HD11 LEU 22 28.378 19.803 -7.581 167 HD12 LEU 22 HD12 LEU 22 30.096 20.209 -7.330 168 HD13 LEU 22 HD13 LEU 22 29.230 20.857 -8.724 169 HD21 LEU 22 HD21 LEU 22 26.645 21.639 -7.378 170 HD22 LEU 22 HD22 LEU 22 27.620 22.645 -8.496 171 HD23 LEU 22 HD23 LEU 22 27.186 23.267 -6.894 172 H ALA 23 H ALA 23 29.215 20.105 -2.342 173 HA ALA 23 HA ALA 23 29.047 22.343 -0.577 174 HB1 ALA 23 HB1 ALA 23 28.235 20.071 -0.073 175 HB2 ALA 23 HB2 ALA 23 29.911 19.485 0.015 176 HB3 ALA 23 HB3 ALA 23 29.315 20.674 1.196 177 H SER 24 H SER 24 31.865 20.497 -1.669 178 HA SER 24 HA SER 24 33.801 22.026 -0.208 179 HB2 SER 24 HB2 SER 24 34.348 20.460 -2.747 180 HB3 SER 24 HB3 SER 24 35.472 20.920 -1.475 181 HG SER 24 HG SER 24 33.275 19.102 -1.236 182 H ILE 25 H ILE 25 32.543 22.492 -3.641 183 HA ILE 25 HA ILE 25 34.371 24.673 -4.023 184 HB ILE 25 HB ILE 25 31.813 24.615 -5.562 185 HG12 ILE 25 HG12 ILE 25 32.398 22.317 -5.806 186 HG13 ILE 25 HG13 ILE 25 32.847 23.170 -7.231 187 HG21 ILE 25 HG21 ILE 25 34.727 25.271 -6.241 188 HG22 ILE 25 HG22 ILE 25 33.328 25.491 -7.294 189 HG23 ILE 25 HG23 ILE 25 33.487 26.451 -5.830 190 HD11 ILE 25 HD11 ILE 25 35.208 23.055 -6.667 191 HD12 ILE 25 HD12 ILE 25 34.812 22.280 -5.101 192 HD13 ILE 25 HD13 ILE 25 34.455 21.444 -6.617 193 H VAL 26 H VAL 26 31.037 24.499 -2.764 194 HA VAL 26 HA VAL 26 30.556 27.334 -2.503 195 HB VAL 26 HB VAL 26 29.485 24.980 -0.926 196 HG11 VAL 26 HG11 VAL 26 27.618 26.523 -0.314 197 HG12 VAL 26 HG12 VAL 26 29.158 27.028 0.368 198 HG13 VAL 26 HG13 VAL 26 28.518 27.871 -1.054 199 HG21 VAL 26 HG21 VAL 26 27.545 25.054 -2.354 200 HG22 VAL 26 HG22 VAL 26 28.042 26.594 -3.083 201 HG23 VAL 26 HG23 VAL 26 28.897 25.098 -3.474 202 H ASP 27 H ASP 27 31.801 24.890 -0.021 203 HA ASP 27 HA ASP 27 32.513 26.765 1.930 204 HB2 ASP 27 HB2 ASP 27 32.725 24.407 2.347 205 HB3 ASP 27 HB3 ASP 27 33.910 24.218 1.048 206 H SER 28 H SER 28 34.467 25.835 -0.929 207 HA SER 28 HA SER 28 36.731 27.483 -0.387 208 HB2 SER 28 HB2 SER 28 35.628 26.740 -3.129 209 HB3 SER 28 HB3 SER 28 37.264 27.288 -2.752 210 HG SER 28 HG SER 28 36.006 24.874 -1.884 211 H ARG 29 H ARG 29 33.662 28.276 -2.021 212 HA ARG 29 HA ARG 29 34.327 31.063 -2.538 213 HB2 ARG 29 HB2 ARG 29 32.704 29.718 -3.856 214 HB3 ARG 29 HB3 ARG 29 31.653 29.588 -2.456 215 HG2 ARG 29 HG2 ARG 29 30.754 31.253 -3.855 216 HG3 ARG 29 HG3 ARG 29 31.402 32.063 -2.433 217 HD2 ARG 29 HD2 ARG 29 33.325 32.851 -3.705 218 HD3 ARG 29 HD3 ARG 29 32.858 31.835 -5.089 219 HE ARG 29 HE ARG 29 30.782 33.735 -4.258 220 HH11 ARG 29 HH11 ARG 29 33.720 33.611 -6.148 221 HH12 ARG 29 HH12 ARG 29 33.170 34.815 -7.278 222 HH21 ARG 29 HH21 ARG 29 30.002 35.072 -5.932 223 HH22 ARG 29 HH22 ARG 29 31.153 35.679 -7.086 224 H LEU 30 H LEU 30 32.606 29.424 0.189 225 HA LEU 30 HA LEU 30 31.906 31.896 1.473 226 HB2 LEU 30 HB2 LEU 30 32.322 29.168 2.729 227 HB3 LEU 30 HB3 LEU 30 31.570 30.569 3.492 228 HG LEU 30 HG LEU 30 30.470 29.031 1.129 229 HD11 LEU 30 HD11 LEU 30 30.262 27.887 3.380 230 HD12 LEU 30 HD12 LEU 30 28.711 28.338 2.658 231 HD13 LEU 30 HD13 LEU 30 29.396 29.330 3.955 232 HD21 LEU 30 HD21 LEU 30 29.803 31.341 0.821 233 HD22 LEU 30 HD22 LEU 30 29.301 31.455 2.531 234 HD23 LEU 30 HD23 LEU 30 28.426 30.410 1.389 235 H ILE 31 H ILE 31 34.875 29.952 1.568 236 HA ILE 31 HA ILE 31 36.249 31.676 3.496 237 HB ILE 31 HB ILE 31 37.185 29.582 1.495 238 HG12 ILE 31 HG12 ILE 31 37.018 29.473 4.542 239 HG13 ILE 31 HG13 ILE 31 35.752 28.868 3.496 240 HG21 ILE 31 HG21 ILE 31 39.056 31.143 1.894 241 HG22 ILE 31 HG22 ILE 31 38.818 31.005 3.651 242 HG23 ILE 31 HG23 ILE 31 39.371 29.617 2.691 243 HD11 ILE 31 HD11 ILE 31 37.082 27.006 4.185 244 HD12 ILE 31 HD12 ILE 31 37.344 27.268 2.451 245 HD13 ILE 31 HD13 ILE 31 38.580 27.768 3.636 246 H GLY 32 H GLY 32 35.937 31.577 -0.059 247 HA2 GLY 32 HA2 GLY 32 38.046 33.366 -0.723 248 HA3 GLY 32 HA3 GLY 32 36.670 32.871 -1.732 249 H THR 33 H THR 33 34.559 33.858 -0.277 250 HA THR 33 HA THR 33 34.985 36.751 0.098 251 HB THR 33 HB THR 33 34.702 36.509 -2.332 252 HG1 THR 33 HG1 THR 33 33.119 38.063 -2.537 253 HG21 THR 33 HG21 THR 33 32.657 35.830 -3.360 254 HG22 THR 33 HG22 THR 33 31.831 35.655 -1.800 255 HG23 THR 33 HG23 THR 33 33.130 34.526 -2.254 256 H GLY 34 H GLY 34 32.811 33.984 0.380 257 HA2 GLY 34 HA2 GLY 34 31.582 33.662 2.450 258 HA3 GLY 34 HA3 GLY 34 31.525 35.386 2.722 259 H SER 35 H SER 35 30.609 34.448 -0.485 260 HA SER 35 HA SER 35 27.880 33.657 0.055 261 HB2 SER 35 HB2 SER 35 28.513 36.383 -1.158 262 HB3 SER 35 HB3 SER 35 26.970 35.548 -1.429 263 HG SER 35 HG SER 35 27.926 35.791 1.197 264 H VAL 36 H VAL 36 26.854 32.866 -1.857 265 HA VAL 36 HA VAL 36 28.685 32.255 -4.143 266 HB VAL 36 HB VAL 36 28.665 30.362 -2.489 267 HG11 VAL 36 HG11 VAL 36 25.786 29.954 -3.394 268 HG12 VAL 36 HG12 VAL 36 26.742 28.899 -2.340 269 HG13 VAL 36 HG13 VAL 36 26.278 30.523 -1.789 270 HG21 VAL 36 HG21 VAL 36 29.167 30.075 -4.902 271 HG22 VAL 36 HG22 VAL 36 28.413 28.644 -4.189 272 HG23 VAL 36 HG23 VAL 36 27.451 29.743 -5.204 273 H ASP 37 H ASP 37 27.729 32.213 -6.134 274 HA ASP 37 HA ASP 37 24.909 33.099 -6.267 275 HB2 ASP 37 HB2 ASP 37 27.190 33.977 -8.054 276 HB3 ASP 37 HB3 ASP 37 25.601 34.709 -7.875 277 H GLU 38 H GLU 38 23.726 32.544 -8.147 278 HA GLU 38 HA GLU 38 23.985 30.064 -9.241 279 HB2 GLU 38 HB2 GLU 38 22.115 31.908 -9.444 280 HB3 GLU 38 HB3 GLU 38 22.942 32.357 -10.939 281 HG2 GLU 38 HG2 GLU 38 22.730 29.810 -11.537 282 HG3 GLU 38 HG3 GLU 38 21.587 29.753 -10.197 283 H ASP 39 H ASP 39 25.448 33.022 -10.590 284 HA ASP 39 HA ASP 39 26.570 31.840 -12.938 285 HB2 ASP 39 HB2 ASP 39 26.001 34.246 -12.622 286 HB3 ASP 39 HB3 ASP 39 27.256 34.377 -11.387 287 H PHE 40 H PHE 40 27.694 31.812 -9.589 288 HA PHE 40 HA PHE 40 30.427 31.019 -10.392 289 HB2 PHE 40 HB2 PHE 40 30.070 32.323 -8.344 290 HB3 PHE 40 HB3 PHE 40 29.003 31.080 -7.706 291 HD1 PHE 40 HD2 PHE 40 32.526 31.902 -8.546 292 HD2 PHE 40 HD1 PHE 40 29.862 28.994 -6.801 293 HE1 PHE 40 HE2 PHE 40 34.466 30.735 -7.516 294 HE2 PHE 40 HE1 PHE 40 31.782 27.877 -5.718 295 HZ PHE 40 HZ PHE 40 34.100 28.737 -6.088 296 H LEU 41 H LEU 41 27.332 29.469 -9.356 297 HA LEU 41 HA LEU 41 28.561 26.854 -9.016 298 HB2 LEU 41 HB2 LEU 41 25.756 27.996 -8.896 299 HB3 LEU 41 HB3 LEU 41 26.025 26.271 -8.670 300 HG LEU 41 HG LEU 41 27.438 28.374 -6.988 301 HD11 LEU 41 HD11 LEU 41 25.759 27.874 -5.247 302 HD12 LEU 41 HD12 LEU 41 24.867 26.845 -6.393 303 HD13 LEU 41 HD13 LEU 41 25.012 28.597 -6.679 304 HD21 LEU 41 HD21 LEU 41 28.473 26.063 -6.983 305 HD22 LEU 41 HD22 LEU 41 26.903 25.418 -6.454 306 HD23 LEU 41 HD23 LEU 41 27.810 26.528 -5.420 307 H ARG 42 H ARG 42 26.563 28.302 -11.628 308 HA ARG 42 HA ARG 42 26.229 25.962 -13.175 309 HB2 ARG 42 HB2 ARG 42 25.991 27.422 -15.098 310 HB3 ARG 42 HB3 ARG 42 25.222 28.145 -13.689 311 HG2 ARG 42 HG2 ARG 42 27.185 29.640 -13.370 312 HG3 ARG 42 HG3 ARG 42 27.983 28.891 -14.763 313 HD2 ARG 42 HD2 ARG 42 26.013 29.613 -16.197 314 HD3 ARG 42 HD3 ARG 42 25.434 30.537 -14.808 315 HE ARG 42 HE ARG 42 27.147 32.116 -15.121 316 HH11 ARG 42 HH11 ARG 42 27.900 29.442 -17.301 317 HH12 ARG 42 HH12 ARG 42 29.230 30.329 -17.992 318 HH21 ARG 42 HH21 ARG 42 28.708 33.090 -15.964 319 HH22 ARG 42 HH22 ARG 42 29.701 32.412 -17.261 320 H GLU 43 H GLU 43 29.202 27.717 -12.654 321 HA GLU 43 HA GLU 43 30.703 26.290 -14.749 322 HB2 GLU 43 HB2 GLU 43 31.788 28.026 -12.502 323 HB3 GLU 43 HB3 GLU 43 32.609 27.522 -13.989 324 HG2 GLU 43 HG2 GLU 43 30.605 28.676 -15.198 325 HG3 GLU 43 HG3 GLU 43 30.341 29.495 -13.659 326 H GLN 44 H GLN 44 29.540 25.131 -11.816 327 HA GLN 44 HA GLN 44 31.961 23.478 -11.266 328 HB2 GLN 44 HB2 GLN 44 29.708 24.063 -9.332 329 HB3 GLN 44 HB3 GLN 44 31.307 23.407 -8.993 330 HG2 GLN 44 HG2 GLN 44 30.576 26.221 -9.799 331 HG3 GLN 44 HG3 GLN 44 31.153 25.717 -8.227 332 HE21 GLN 44 HE21 GLN 44 32.278 27.817 -9.794 333 HE22 GLN 44 HE22 GLN 44 33.956 27.342 -10.089 334 H ILE 45 H ILE 45 28.570 23.399 -12.177 335 HA ILE 45 HA ILE 45 27.792 20.889 -11.164 336 HB ILE 45 HB ILE 45 26.540 20.784 -13.528 337 HG12 ILE 45 HG12 ILE 45 26.769 23.787 -13.214 338 HG13 ILE 45 HG13 ILE 45 27.751 22.884 -14.383 339 HG21 ILE 45 HG21 ILE 45 24.660 21.806 -12.458 340 HG22 ILE 45 HG22 ILE 45 25.614 20.952 -11.236 341 HG23 ILE 45 HG23 ILE 45 25.722 22.735 -11.360 342 HD11 ILE 45 HD11 ILE 45 25.671 22.044 -15.462 343 HD12 ILE 45 HD12 ILE 45 24.710 23.052 -14.352 344 HD13 ILE 45 HD13 ILE 45 25.817 23.813 -15.502 345 H ARG 46 H ARG 46 28.820 21.246 -14.693 346 HA ARG 46 HA ARG 46 30.179 20.273 -15.905 347 HB2 ARG 46 HB2 ARG 46 31.477 19.200 -13.382 348 HB3 ARG 46 HB3 ARG 46 32.183 19.041 -14.995 349 HG2 ARG 46 HG2 ARG 46 32.443 21.405 -15.261 350 HG3 ARG 46 HG3 ARG 46 31.411 21.770 -13.872 351 HD2 ARG 46 HD2 ARG 46 33.023 20.632 -12.379 352 HD3 ARG 46 HD3 ARG 46 34.120 20.437 -13.770 353 HE ARG 46 HE ARG 46 33.188 23.197 -13.372 354 HH11 ARG 46 HH11 ARG 46 35.762 21.016 -12.399 355 HH12 ARG 46 HH12 ARG 46 36.806 22.338 -11.949 356 HH21 ARG 46 HH21 ARG 46 34.442 24.755 -12.705 357 HH22 ARG 46 HH22 ARG 46 36.069 24.454 -12.131 358 H ASP 47 H ASP 47 28.220 18.373 -14.013 359 HA ASP 47 HA ASP 47 27.844 16.611 -16.383 360 HB2 ASP 47 HB2 ASP 47 29.485 15.533 -14.712 361 HB3 ASP 47 HB3 ASP 47 28.126 15.417 -13.597 362 H ALA 48 H ALA 48 26.621 17.857 -13.275 363 HA ALA 48 HA ALA 48 23.997 16.678 -13.591 364 HB1 ALA 48 HB1 ALA 48 23.439 17.862 -11.578 365 HB2 ALA 48 HB2 ALA 48 25.079 17.218 -11.381 366 HB3 ALA 48 HB3 ALA 48 24.847 18.928 -11.742 367 H ARG 49 H ARG 49 22.049 17.728 -13.982 368 HA ARG 49 HA ARG 49 21.988 20.009 -15.780 369 HB2 ARG 49 HB2 ARG 49 20.112 18.005 -14.685 370 HB3 ARG 49 HB3 ARG 49 19.401 19.584 -14.670 371 HG2 ARG 49 HG2 ARG 49 18.900 18.342 -16.730 372 HG3 ARG 49 HG3 ARG 49 19.674 19.898 -17.001 373 HD2 ARG 49 HD2 ARG 49 20.436 18.042 -18.507 374 HD3 ARG 49 HD3 ARG 49 21.737 18.887 -17.664 375 HE ARG 49 HE ARG 49 21.309 16.759 -15.985 376 HH11 ARG 49 HH11 ARG 49 21.927 16.822 -19.444 377 HH12 ARG 49 HH12 ARG 49 22.831 15.335 -19.379 378 HH21 ARG 49 HH21 ARG 49 22.520 15.011 -15.943 379 HH22 ARG 49 HH22 ARG 49 23.160 14.316 -17.418 380 H TYR 50 H TYR 50 20.768 19.682 -12.406 381 HA TYR 50 HA TYR 50 20.950 22.673 -12.190 382 HB2 TYR 50 HB2 TYR 50 18.992 20.913 -10.725 383 HB3 TYR 50 HB3 TYR 50 18.874 22.628 -11.057 384 HD1 TYR 50 HD2 TYR 50 19.275 22.828 -13.951 385 HD2 TYR 50 HD1 TYR 50 17.139 19.869 -11.683 386 HE1 TYR 50 HE2 TYR 50 17.858 22.335 -15.943 387 HE2 TYR 50 HE1 TYR 50 15.717 19.370 -13.664 388 HH TYR 50 HH TYR 50 15.284 19.857 -15.856 389 H ALA 51 H ALA 51 22.014 23.611 -10.416 390 HA ALA 51 HA ALA 51 22.646 21.838 -8.099 391 HB1 ALA 51 HB1 ALA 51 24.509 23.407 -7.642 392 HB2 ALA 51 HB2 ALA 51 24.715 22.512 -9.162 393 HB3 ALA 51 HB3 ALA 51 24.197 24.217 -9.191 394 H VAL 52 H VAL 52 22.081 22.640 -6.088 395 HA VAL 52 HA VAL 52 20.433 25.135 -5.966 396 HB VAL 52 HB VAL 52 19.590 22.343 -5.128 397 HG11 VAL 52 HG11 VAL 52 18.203 25.017 -4.653 398 HG12 VAL 52 HG12 VAL 52 17.423 23.432 -4.466 399 HG13 VAL 52 HG13 VAL 52 18.765 23.870 -3.414 400 HG21 VAL 52 HG21 VAL 52 19.239 22.678 -7.497 401 HG22 VAL 52 HG22 VAL 52 17.683 22.768 -6.681 402 HG23 VAL 52 HG23 VAL 52 18.485 24.261 -7.210 403 H ILE 53 H ILE 53 20.454 26.260 -4.059 404 HA ILE 53 HA ILE 53 22.382 25.287 -2.051 405 HB ILE 53 HB ILE 53 22.300 27.634 -3.788 406 HG12 ILE 53 HG12 ILE 53 24.199 26.189 -3.704 407 HG13 ILE 53 HG13 ILE 53 24.652 27.800 -3.164 408 HG21 ILE 53 HG21 ILE 53 23.162 29.344 -2.221 409 HG22 ILE 53 HG22 ILE 53 21.459 28.989 -1.971 410 HG23 ILE 53 HG23 ILE 53 22.662 28.343 -0.843 411 HD11 ILE 53 HD11 ILE 53 24.229 26.827 -0.732 412 HD12 ILE 53 HD12 ILE 53 24.372 25.264 -1.561 413 HD13 ILE 53 HD13 ILE 53 25.723 26.405 -1.613 414 H ARG 54 H ARG 54 21.908 25.169 -0.032 415 HA ARG 54 HA ARG 54 19.836 26.976 1.185 416 HB2 ARG 54 HB2 ARG 54 20.537 24.088 1.836 417 HB3 ARG 54 HB3 ARG 54 19.388 25.076 2.726 418 HG2 ARG 54 HG2 ARG 54 19.130 24.146 -0.173 419 HG3 ARG 54 HG3 ARG 54 18.332 23.418 1.208 420 HD2 ARG 54 HD2 ARG 54 17.858 26.266 0.241 421 HD3 ARG 54 HD3 ARG 54 16.855 24.853 -0.131 422 HE ARG 54 HE ARG 54 17.189 25.179 2.727 423 HH11 ARG 54 HH11 ARG 54 15.239 26.346 0.061 424 HH12 ARG 54 HH12 ARG 54 13.939 26.842 1.110 425 HH21 ARG 54 HH21 ARG 54 15.494 25.825 4.007 426 HH22 ARG 54 HH22 ARG 54 14.084 26.541 3.287 427 H ILE 55 H ILE 55 21.441 28.511 1.731 428 HA ILE 55 HA ILE 55 23.459 27.686 3.780 429 HB ILE 55 HB ILE 55 23.396 30.057 1.902 430 HG12 ILE 55 HG12 ILE 55 25.773 28.259 2.368 431 HG13 ILE 55 HG13 ILE 55 24.449 27.649 1.374 432 HG21 ILE 55 HG21 ILE 55 24.076 30.971 4.069 433 HG22 ILE 55 HG22 ILE 55 25.219 29.628 4.322 434 HG23 ILE 55 HG23 ILE 55 25.508 30.819 3.051 435 HD11 ILE 55 HD11 ILE 55 26.188 28.638 0.020 436 HD12 ILE 55 HD12 ILE 55 24.687 29.574 -0.134 437 HD13 ILE 55 HD13 ILE 55 26.029 30.194 0.861 438 HA PRO 56 HA PRO 56 20.520 29.671 6.542 439 HB2 PRO 56 HB2 PRO 56 22.032 29.886 8.826 440 HB3 PRO 56 HB3 PRO 56 21.309 28.356 8.246 441 HG2 PRO 56 HG2 PRO 56 24.142 29.355 7.812 442 HG3 PRO 56 HG3 PRO 56 23.612 27.735 8.371 443 HD2 PRO 56 HD2 PRO 56 24.249 28.196 5.784 444 HD3 PRO 56 HD3 PRO 56 22.877 27.129 6.203 445 H GLY 57 H GLY 57 19.949 31.750 6.775 446 HA2 GLY 57 HA2 GLY 57 20.147 34.025 7.261 447 HA3 GLY 57 HA3 GLY 57 21.903 33.923 7.173 448 H GLN 58 H GLN 58 20.808 32.477 4.346 449 HA GLN 58 HA GLN 58 20.265 35.009 2.897 450 HB2 GLN 58 HB2 GLN 58 21.923 34.678 1.254 451 HB3 GLN 58 HB3 GLN 58 22.717 34.381 2.796 452 HG2 GLN 58 HG2 GLN 58 22.534 31.974 2.460 453 HG3 GLN 58 HG3 GLN 58 21.751 32.216 0.888 454 HE21 GLN 58 HE21 GLN 58 24.754 33.378 2.614 455 HE22 GLN 58 HE22 GLN 58 25.762 33.203 1.189 456 HA PRO 59 HA PRO 59 17.102 32.649 0.938 457 HB2 PRO 59 HB2 PRO 59 16.861 33.700 -1.581 458 HB3 PRO 59 HB3 PRO 59 16.403 34.587 -0.094 459 HG2 PRO 59 HG2 PRO 59 19.020 34.759 -1.627 460 HG3 PRO 59 HG3 PRO 59 17.971 36.107 -1.077 461 HD2 PRO 59 HD2 PRO 59 20.127 35.329 0.353 462 HD3 PRO 59 HD3 PRO 59 18.618 35.807 1.182 463 H VAL 60 H VAL 60 16.629 30.964 -0.488 464 HA VAL 60 HA VAL 60 18.698 29.222 -1.380 465 HB VAL 60 HB VAL 60 16.537 28.350 -0.868 466 HG11 VAL 60 HG11 VAL 60 15.356 29.954 -3.174 467 HG12 VAL 60 HG12 VAL 60 14.505 28.741 -2.201 468 HG13 VAL 60 HG13 VAL 60 15.054 30.233 -1.445 469 HG21 VAL 60 HG21 VAL 60 15.996 26.945 -2.768 470 HG22 VAL 60 HG22 VAL 60 16.829 28.041 -3.880 471 HG23 VAL 60 HG23 VAL 60 17.748 27.119 -2.676 472 H VAL 61 H VAL 61 19.666 28.844 -3.256 473 HA VAL 61 HA VAL 61 19.084 30.559 -5.647 474 HB VAL 61 HB VAL 61 21.807 29.597 -4.696 475 HG11 VAL 61 HG11 VAL 61 22.720 30.856 -6.610 476 HG12 VAL 61 HG12 VAL 61 21.733 29.502 -7.150 477 HG13 VAL 61 HG13 VAL 61 21.072 31.157 -7.208 478 HG21 VAL 61 HG21 VAL 61 20.671 32.407 -4.993 479 HG22 VAL 61 HG22 VAL 61 21.035 31.582 -3.463 480 HG23 VAL 61 HG23 VAL 61 22.349 32.003 -4.563 481 H GLU 62 H GLU 62 18.872 29.489 -7.571 482 HA GLU 62 HA GLU 62 19.274 26.525 -7.653 483 HB2 GLU 62 HB2 GLU 62 16.822 28.048 -8.634 484 HB3 GLU 62 HB3 GLU 62 17.128 26.322 -8.848 485 HG2 GLU 62 HG2 GLU 62 17.032 25.979 -6.411 486 HG3 GLU 62 HG3 GLU 62 16.787 27.707 -6.154 487 H VAL 63 H VAL 63 20.554 25.972 -9.401 488 HA VAL 63 HA VAL 63 21.061 27.960 -11.518 489 HB VAL 63 HB VAL 63 22.426 25.341 -10.827 490 HG11 VAL 63 HG11 VAL 63 24.375 26.341 -11.995 491 HG12 VAL 63 HG12 VAL 63 23.024 26.012 -13.076 492 HG13 VAL 63 HG13 VAL 63 23.336 27.683 -12.525 493 HG21 VAL 63 HG21 VAL 63 22.645 26.937 -8.900 494 HG22 VAL 63 HG22 VAL 63 24.148 26.546 -9.716 495 HG23 VAL 63 HG23 VAL 63 23.374 28.106 -10.027 496 H GLY 64 H GLY 64 20.977 27.358 -13.766 497 HA2 GLY 64 HA2 GLY 64 20.500 26.049 -15.597 498 HA3 GLY 64 HA3 GLY 64 20.163 24.689 -14.536 499 H THR 65 H THR 65 17.986 24.219 -14.026 500 HA THR 65 HA THR 65 15.847 26.162 -14.583 501 HB THR 65 HB THR 65 15.847 23.458 -15.993 502 HG1 THR 65 HG1 THR 65 17.018 25.395 -16.859 503 HG21 THR 65 HG21 THR 65 13.743 24.279 -17.053 504 HG22 THR 65 HG22 THR 65 13.731 25.650 -15.922 505 HG23 THR 65 HG23 THR 65 13.562 23.980 -15.325 506 H LYS 66 H LYS 66 14.136 25.857 -13.171 507 HA LYS 66 HA LYS 66 14.537 24.246 -10.909 508 HB2 LYS 66 HB2 LYS 66 13.216 26.377 -11.028 509 HB3 LYS 66 HB3 LYS 66 11.899 25.486 -11.812 510 HG2 LYS 66 HG2 LYS 66 11.748 24.006 -9.792 511 HG3 LYS 66 HG3 LYS 66 13.069 24.923 -9.050 512 HD2 LYS 66 HD2 LYS 66 11.608 27.009 -9.241 513 HD3 LYS 66 HD3 LYS 66 10.311 25.960 -9.830 514 HE2 LYS 66 HE2 LYS 66 9.845 26.185 -7.539 515 HE3 LYS 66 HE3 LYS 66 10.600 24.594 -7.674 516 HZ1 LYS 66 HZ1 LYS 66 12.736 25.691 -6.960 517 HZ2 LYS 66 HZ2 LYS 66 11.553 25.832 -5.826 518 HZ3 LYS 66 HZ3 LYS 66 11.946 27.098 -6.786 519 HA PRO 67 HA PRO 67 13.159 20.415 -12.648 520 HB2 PRO 67 HB2 PRO 67 13.400 18.758 -10.493 521 HB3 PRO 67 HB3 PRO 67 14.792 19.441 -11.398 522 HG2 PRO 67 HG2 PRO 67 13.580 20.416 -8.808 523 HG3 PRO 67 HG3 PRO 67 15.312 20.197 -9.249 524 HD2 PRO 67 HD2 PRO 67 14.054 22.634 -9.389 525 HD3 PRO 67 HD3 PRO 67 15.359 22.148 -10.515 526 H THR 68 H THR 68 11.534 19.107 -12.824 527 HA THR 68 HA THR 68 8.996 19.942 -11.966 528 HB THR 68 HB THR 68 9.594 19.129 -14.205 529 HG1 THR 68 HG1 THR 68 7.636 18.095 -14.562 530 HG21 THR 68 HG21 THR 68 10.831 17.029 -13.474 531 HG22 THR 68 HG22 THR 68 9.656 16.806 -14.779 532 HG23 THR 68 HG23 THR 68 9.239 16.310 -13.131 533 H GLY 69 H GLY 69 10.875 17.350 -10.659 534 HA2 GLY 69 HA2 GLY 69 10.105 16.531 -8.371 535 HA3 GLY 69 HA3 GLY 69 8.534 16.236 -9.141 536 H ASP 70 H ASP 70 9.452 15.273 -11.577 537 HA ASP 70 HA ASP 70 10.349 12.538 -11.027 538 HB2 ASP 70 HB2 ASP 70 9.868 13.898 -13.680 539 HB3 ASP 70 HB3 ASP 70 10.068 12.160 -13.400 540 H VAL 71 H VAL 71 12.244 13.664 -9.936 541 HA VAL 71 HA VAL 71 14.605 13.752 -11.727 542 HB VAL 71 HB VAL 71 15.497 15.678 -10.475 543 HG11 VAL 71 HG11 VAL 71 12.890 16.615 -11.738 544 HG12 VAL 71 HG12 VAL 71 14.539 17.259 -11.861 545 HG13 VAL 71 HG13 VAL 71 14.130 15.787 -12.706 546 HG21 VAL 71 HG21 VAL 71 12.713 16.079 -9.341 547 HG22 VAL 71 HG22 VAL 71 14.125 15.516 -8.422 548 HG23 VAL 71 HG23 VAL 71 14.136 17.124 -9.137 549 H LEU 72 H LEU 72 16.631 13.563 -10.639 550 HA LEU 72 HA LEU 72 16.614 11.692 -8.284 551 HB2 LEU 72 HB2 LEU 72 18.821 12.492 -10.219 552 HB3 LEU 72 HB3 LEU 72 19.027 11.370 -8.887 553 HG LEU 72 HG LEU 72 17.050 10.900 -11.128 554 HD11 LEU 72 HD11 LEU 72 19.304 11.101 -12.114 555 HD12 LEU 72 HD12 LEU 72 18.764 9.416 -12.149 556 HD13 LEU 72 HD13 LEU 72 19.944 9.942 -10.924 557 HD21 LEU 72 HD21 LEU 72 17.304 8.529 -10.426 558 HD22 LEU 72 HD22 LEU 72 16.693 9.552 -9.112 559 HD23 LEU 72 HD23 LEU 72 18.401 9.061 -9.130 560 H GLN 73 H GLN 73 17.602 12.366 -6.346 561 HA GLN 73 HA GLN 73 18.644 15.177 -6.257 562 HB2 GLN 73 HB2 GLN 73 16.949 13.577 -4.315 563 HB3 GLN 73 HB3 GLN 73 17.737 15.111 -3.938 564 HG2 GLN 73 HG2 GLN 73 16.525 16.121 -5.934 565 HG3 GLN 73 HG3 GLN 73 15.571 14.643 -6.030 566 HE21 GLN 73 HE21 GLN 73 14.789 17.495 -5.405 567 HE22 GLN 73 HE22 GLN 73 13.973 17.383 -3.837 568 H GLY 74 H GLY 74 20.676 15.401 -5.680 569 HA2 GLY 74 HA2 GLY 74 22.063 13.428 -3.889 570 HA3 GLY 74 HA3 GLY 74 22.869 14.501 -5.050 571 H ARG 75 H ARG 75 23.311 14.448 -2.122 572 HA ARG 75 HA ARG 75 22.632 17.208 -1.422 573 HB2 ARG 75 HB2 ARG 75 20.528 15.956 -0.924 574 HB3 ARG 75 HB3 ARG 75 21.419 14.928 0.199 575 HG2 ARG 75 HG2 ARG 75 21.922 16.879 1.626 576 HG3 ARG 75 HG3 ARG 75 21.141 17.965 0.455 577 HD2 ARG 75 HD2 ARG 75 18.985 16.895 0.842 578 HD3 ARG 75 HD3 ARG 75 19.738 15.679 1.897 579 HE ARG 75 HE ARG 75 20.397 18.188 2.987 580 HH11 ARG 75 HH12 ARG 75 17.460 16.342 2.512 581 HH12 ARG 75 HH11 ARG 75 16.673 17.049 3.897 582 HH21 ARG 75 HH21 ARG 75 19.342 19.052 4.758 583 HH22 ARG 75 HH22 ARG 75 17.720 18.551 5.128 584 H ALA 76 H ALA 76 23.926 18.071 0.022 585 HA ALA 76 HA ALA 76 25.732 16.430 1.772 586 HB1 ALA 76 HB1 ALA 76 26.554 18.467 -0.346 587 HB2 ALA 76 HB2 ALA 76 27.670 17.705 0.821 588 HB3 ALA 76 HB3 ALA 76 26.849 16.716 -0.404 589 H THR 77 H THR 77 27.038 17.698 3.252 590 HA THR 77 HA THR 77 25.781 20.282 4.100 591 HB THR 77 HB THR 77 27.065 18.187 5.882 592 HG1 THR 77 HG1 THR 77 24.982 17.644 5.177 593 HG21 THR 77 HG21 THR 77 26.236 19.599 7.738 594 HG22 THR 77 HG22 THR 77 25.654 20.810 6.579 595 HG23 THR 77 HG23 THR 77 27.392 20.499 6.752 596 H GLY 78 H GLY 78 27.154 21.931 4.084 597 HA2 GLY 78 HA2 GLY 78 29.984 21.516 3.242 598 HA3 GLY 78 HA3 GLY 78 29.100 23.019 3.204 599 H GLU 79 H GLU 79 31.544 23.232 4.136 600 HA GLU 79 HA GLU 79 31.802 22.468 6.935 601 HB2 GLU 79 HB2 GLU 79 33.712 23.657 4.930 602 HB3 GLU 79 HB3 GLU 79 34.127 23.439 6.636 603 HG2 GLU 79 HG2 GLU 79 33.557 21.014 6.443 604 HG3 GLU 79 HG3 GLU 79 33.230 21.240 4.724 605 H GLU 80 H GLU 80 30.504 25.413 5.595 606 HA GLU 80 HA GLU 80 31.213 26.851 8.137 607 HB2 GLU 80 HB2 GLU 80 29.751 27.767 5.659 608 HB3 GLU 80 HB3 GLU 80 30.065 28.761 7.073 609 HG2 GLU 80 HG2 GLU 80 32.290 27.537 5.367 610 HG3 GLU 80 HG3 GLU 80 31.580 29.109 5.170 611 H GLY 81 H GLY 81 29.134 24.524 7.237 612 HA2 GLY 81 HA2 GLY 81 27.448 23.647 8.533 613 HA3 GLY 81 HA3 GLY 81 27.057 25.225 9.199 614 H GLU 82 H GLU 82 27.397 25.103 5.717 615 HA GLU 82 HA GLU 82 24.562 25.590 5.317 616 HB2 GLU 82 HB2 GLU 82 25.167 26.255 3.196 617 HB3 GLU 82 HB3 GLU 82 26.401 26.927 4.256 618 HG2 GLU 82 HG2 GLU 82 26.818 24.397 2.589 619 HG3 GLU 82 HG3 GLU 82 27.040 26.008 1.950 620 H THR 83 H THR 83 23.653 24.625 3.177 621 HA THR 83 HA THR 83 24.175 21.691 2.993 622 HB THR 83 HB THR 83 21.538 23.085 3.451 623 HG1 THR 83 HG1 THR 83 22.788 22.183 5.157 624 HG21 THR 83 HG21 THR 83 21.915 20.281 2.309 625 HG22 THR 83 HG22 THR 83 21.062 21.639 1.528 626 HG23 THR 83 HG23 THR 83 20.402 20.924 2.995 627 H VAL 84 H VAL 84 24.154 20.867 1.018 628 HA VAL 84 HA VAL 84 23.551 22.644 -1.331 629 HB VAL 84 HB VAL 84 25.804 20.606 -1.085 630 HG11 VAL 84 HG11 VAL 84 26.505 21.436 -3.299 631 HG12 VAL 84 HG12 VAL 84 24.934 20.662 -3.400 632 HG13 VAL 84 HG13 VAL 84 25.040 22.442 -3.406 633 HG21 VAL 84 HG21 VAL 84 27.195 22.710 -1.514 634 HG22 VAL 84 HG22 VAL 84 25.749 23.638 -1.128 635 HG23 VAL 84 HG23 VAL 84 26.463 22.574 0.101 636 H LEU 85 H LEU 85 22.360 21.790 -2.887 637 HA LEU 85 HA LEU 85 21.735 18.888 -2.870 638 HB2 LEU 85 HB2 LEU 85 19.864 20.182 -1.878 639 HB3 LEU 85 HB3 LEU 85 19.828 21.213 -3.289 640 HG LEU 85 HG LEU 85 19.308 18.978 -4.614 641 HD11 LEU 85 HD11 LEU 85 19.715 17.553 -2.495 642 HD12 LEU 85 HD12 LEU 85 18.233 17.250 -3.417 643 HD13 LEU 85 HD13 LEU 85 18.184 18.191 -1.903 644 HD21 LEU 85 HD21 LEU 85 17.722 20.781 -4.416 645 HD22 LEU 85 HD22 LEU 85 17.297 20.285 -2.761 646 HD23 LEU 85 HD23 LEU 85 16.908 19.234 -4.144 647 H VAL 86 H VAL 86 21.447 17.939 -4.934 648 HA VAL 86 HA VAL 86 21.975 19.604 -7.356 649 HB VAL 86 HB VAL 86 23.170 16.835 -6.912 650 HG11 VAL 86 HG11 VAL 86 23.477 18.873 -9.155 651 HG12 VAL 86 HG12 VAL 86 24.396 17.358 -8.990 652 HG13 VAL 86 HG13 VAL 86 22.652 17.302 -9.259 653 HG21 VAL 86 HG21 VAL 86 25.369 17.962 -6.875 654 HG22 VAL 86 HG22 VAL 86 24.555 19.549 -6.856 655 HG23 VAL 86 HG23 VAL 86 24.368 18.418 -5.491 656 H GLU 87 H GLU 87 20.617 19.104 -9.032 657 HA GLU 87 HA GLU 87 18.888 16.715 -8.700 658 HB2 GLU 87 HB2 GLU 87 17.805 19.462 -9.354 659 HB3 GLU 87 HB3 GLU 87 16.897 17.946 -9.239 660 HG2 GLU 87 HG2 GLU 87 17.780 17.768 -6.825 661 HG3 GLU 87 HG3 GLU 87 18.346 19.425 -6.998 662 H GLU 88 H GLU 88 18.562 15.504 -10.363 663 HA GLU 88 HA GLU 88 19.382 16.381 -13.121 664 HB2 GLU 88 HB2 GLU 88 19.771 13.841 -11.535 665 HB3 GLU 88 HB3 GLU 88 19.841 13.814 -13.291 666 HG2 GLU 88 HG2 GLU 88 21.665 15.613 -11.695 667 HG3 GLU 88 HG3 GLU 88 21.981 13.884 -11.933 668 HA PRO 89 HA PRO 89 15.337 14.745 -14.408 669 HB2 PRO 89 HB2 PRO 89 15.893 13.836 -16.941 670 HB3 PRO 89 HB3 PRO 89 15.708 15.569 -16.523 671 HG2 PRO 89 HG2 PRO 89 18.289 13.978 -16.755 672 HG3 PRO 89 HG3 PRO 89 17.900 15.570 -17.489 673 HD2 PRO 89 HD2 PRO 89 19.296 15.364 -15.184 674 HD3 PRO 89 HD3 PRO 89 18.085 16.666 -15.391 675 H ARG 90 H ARG 90 14.358 12.846 -14.075 676 HA ARG 90 HA ARG 90 15.975 10.457 -13.457 677 HB2 ARG 90 HB2 ARG 90 14.248 11.475 -11.911 678 HB3 ARG 90 HB3 ARG 90 13.001 10.850 -12.993 679 HG2 ARG 90 HG2 ARG 90 13.667 8.564 -12.538 680 HG3 ARG 90 HG3 ARG 90 15.144 9.102 -11.705 681 HD2 ARG 90 HD2 ARG 90 13.766 10.234 -9.991 682 HD3 ARG 90 HD3 ARG 90 12.291 9.634 -10.776 683 HE ARG 90 HE ARG 90 13.687 7.330 -10.338 684 HH11 ARG 90 HH11 ARG 90 12.803 9.915 -8.136 685 HH12 ARG 90 HH12 ARG 90 12.722 8.842 -6.767 686 HH21 ARG 90 HH21 ARG 90 13.582 6.027 -8.545 687 HH22 ARG 90 HH22 ARG 90 13.159 6.697 -6.998 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 3.281 -3.277 -10.715 2 H2 GLY 1 H2 GLY 1 4.059 -4.611 -11.255 3 H3 GLY 1 H3 GLY 1 4.701 -3.129 -11.521 4 HA2 GLY 1 HA2 GLY 1 4.360 -4.403 -8.878 5 HA3 GLY 1 HA3 GLY 1 5.896 -4.259 -9.753 6 H SER 2 H SER 2 4.975 -3.190 -7.083 7 HA SER 2 HA SER 2 5.090 -0.257 -7.443 8 HB2 SER 2 HB2 SER 2 4.366 -0.221 -5.077 9 HB3 SER 2 HB3 SER 2 3.264 -1.102 -6.141 10 HG SER 2 HG SER 2 3.709 -2.224 -4.177 11 H GLU 3 H GLU 3 7.524 -2.038 -7.713 12 HA GLU 3 HA GLU 3 9.383 -0.423 -6.237 13 HB2 GLU 3 HB2 GLU 3 10.537 -2.165 -5.014 14 HB3 GLU 3 HB3 GLU 3 8.872 -2.053 -4.460 15 HG2 GLU 3 HG2 GLU 3 8.291 -4.056 -5.850 16 HG3 GLU 3 HG3 GLU 3 9.978 -4.171 -6.361 17 H THR 4 H THR 4 11.691 -1.117 -6.783 18 HA THR 4 HA THR 4 11.781 -1.950 -9.658 19 HB THR 4 HB THR 4 13.888 -0.378 -8.148 20 HG1 THR 4 HG1 THR 4 13.013 1.389 -9.238 21 HG21 THR 4 HG21 THR 4 14.698 -1.492 -10.226 22 HG22 THR 4 HG22 THR 4 14.615 0.257 -10.434 23 HG23 THR 4 HG23 THR 4 13.350 -0.779 -11.136 24 H ARG 5 H ARG 5 12.614 -3.868 -10.129 25 HA ARG 5 HA ARG 5 13.620 -5.780 -8.447 26 HB2 ARG 5 HB2 ARG 5 14.343 -5.361 -11.383 27 HB3 ARG 5 HB3 ARG 5 14.626 -6.855 -10.483 28 HG2 ARG 5 HG2 ARG 5 12.199 -7.101 -10.067 29 HG3 ARG 5 HG3 ARG 5 11.885 -5.611 -10.982 30 HD2 ARG 5 HD2 ARG 5 12.915 -6.624 -12.992 31 HD3 ARG 5 HD3 ARG 5 13.198 -8.126 -12.086 32 HE ARG 5 HE ARG 5 10.440 -7.492 -11.874 33 HH11 ARG 5 HH11 ARG 5 12.647 -8.520 -14.393 34 HH12 ARG 5 HH12 ARG 5 11.386 -9.288 -15.320 35 HH21 ARG 5 HH22 ARG 5 8.871 -8.487 -13.104 36 HH22 ARG 5 HH21 ARG 5 9.299 -9.265 -14.600 37 H THR 6 H THR 6 15.604 -3.310 -9.941 38 HA THR 6 HA THR 6 17.940 -4.147 -8.261 39 HB THR 6 HB THR 6 18.305 -4.312 -10.714 40 HG1 THR 6 HG1 THR 6 20.296 -3.348 -10.577 41 HG21 THR 6 HG21 THR 6 18.723 -2.293 -12.022 42 HG22 THR 6 HG22 THR 6 18.224 -1.258 -10.669 43 HG23 THR 6 HG23 THR 6 17.040 -2.308 -11.482 44 H ILE 7 H ILE 7 19.434 -2.034 -8.032 45 HA ILE 7 HA ILE 7 17.786 0.188 -6.902 46 HB ILE 7 HB ILE 7 20.298 -0.930 -5.626 47 HG12 ILE 7 HG12 ILE 7 17.387 -1.105 -4.703 48 HG13 ILE 7 HG13 ILE 7 18.377 -2.454 -5.266 49 HG21 ILE 7 HG21 ILE 7 18.411 1.294 -4.706 50 HG22 ILE 7 HG22 ILE 7 19.852 0.718 -3.838 51 HG23 ILE 7 HG23 ILE 7 20.046 1.537 -5.369 52 HD11 ILE 7 HD11 ILE 7 19.944 -2.067 -3.344 53 HD12 ILE 7 HD12 ILE 7 18.762 -0.896 -2.699 54 HD13 ILE 7 HD13 ILE 7 18.306 -2.592 -2.902 55 H SER 8 H SER 8 18.523 2.253 -7.635 56 HA SER 8 HA SER 8 20.439 2.099 -9.761 57 HB2 SER 8 HB2 SER 8 19.550 4.387 -10.285 58 HB3 SER 8 HB3 SER 8 18.303 3.137 -10.156 59 HG SER 8 HG SER 8 17.756 5.053 -9.004 60 H SER 9 H SER 9 21.538 1.992 -7.106 61 HA SER 9 HA SER 9 23.196 4.186 -6.589 62 HB2 SER 9 HB2 SER 9 24.518 2.508 -5.257 63 HB3 SER 9 HB3 SER 9 22.800 2.691 -4.872 64 HG SER 9 HG SER 9 23.541 0.474 -5.025 65 H THR 10 H THR 10 23.433 4.229 -9.076 66 HA THR 10 HA THR 10 26.288 4.091 -9.654 67 HB THR 10 HB THR 10 25.746 3.611 -12.067 68 HG1 THR 10 HG1 THR 10 23.836 2.383 -12.410 69 HG21 THR 10 HG21 THR 10 26.754 1.870 -10.586 70 HG22 THR 10 HG22 THR 10 25.727 1.179 -11.851 71 HG23 THR 10 HG23 THR 10 25.121 1.295 -10.184 72 H ALA 11 H ALA 11 23.250 5.023 -11.321 73 HA ALA 11 HA ALA 11 24.077 7.708 -11.900 74 HB1 ALA 11 HB1 ALA 11 22.466 6.437 -13.247 75 HB2 ALA 11 HB2 ALA 11 21.312 6.419 -11.892 76 HB3 ALA 11 HB3 ALA 11 21.746 7.953 -12.673 77 H GLN 12 H GLN 12 21.787 6.441 -9.386 78 HA GLN 12 HA GLN 12 21.436 9.064 -8.170 79 HB2 GLN 12 HB2 GLN 12 19.708 7.346 -8.167 80 HB3 GLN 12 HB3 GLN 12 20.735 6.264 -7.236 81 HG2 GLN 12 HG2 GLN 12 18.957 7.287 -5.891 82 HG3 GLN 12 HG3 GLN 12 20.560 7.633 -5.270 83 HE21 GLN 12 HE21 GLN 12 21.379 9.824 -5.440 84 HE22 GLN 12 HE22 GLN 12 20.186 11.122 -5.442 85 H GLU 13 H GLU 13 23.857 6.523 -7.791 86 HA GLU 13 HA GLU 13 24.949 7.595 -5.330 87 HB2 GLU 13 HB2 GLU 13 25.199 5.235 -6.201 88 HB3 GLU 13 HB3 GLU 13 26.304 5.853 -7.424 89 HG2 GLU 13 HG2 GLU 13 27.650 4.987 -5.677 90 HG3 GLU 13 HG3 GLU 13 27.761 6.737 -5.528 91 H ARG 14 H ARG 14 26.093 7.880 -8.684 92 HA ARG 14 HA ARG 14 28.252 9.531 -8.153 93 HB2 ARG 14 HB2 ARG 14 28.384 10.222 -10.454 94 HB3 ARG 14 HB3 ARG 14 28.147 8.491 -10.305 95 HG2 ARG 14 HG2 ARG 14 26.193 8.507 -11.441 96 HG3 ARG 14 HG3 ARG 14 25.615 10.009 -10.716 97 HD2 ARG 14 HD2 ARG 14 27.865 10.111 -12.720 98 HD3 ARG 14 HD3 ARG 14 26.215 9.867 -13.280 99 HE ARG 14 HE ARG 14 27.200 12.265 -11.751 100 HH11 ARG 14 HH22 ARG 14 24.453 10.869 -13.511 101 HH12 ARG 14 HH21 ARG 14 23.633 12.419 -13.446 102 HH21 ARG 14 HH11 ARG 14 26.160 14.112 -11.971 103 HH22 ARG 14 HH12 ARG 14 24.548 14.118 -12.715 104 H VAL 15 H VAL 15 24.963 10.646 -8.710 105 HA VAL 15 HA VAL 15 25.513 13.446 -8.652 106 HB VAL 15 HB VAL 15 23.212 13.840 -7.942 107 HG11 VAL 15 HG11 VAL 15 22.149 12.970 -9.967 108 HG12 VAL 15 HG12 VAL 15 23.758 13.626 -10.302 109 HG13 VAL 15 HG13 VAL 15 23.510 11.865 -10.236 110 HG21 VAL 15 HG21 VAL 15 22.884 10.824 -7.988 111 HG22 VAL 15 HG22 VAL 15 22.838 11.830 -6.524 112 HG23 VAL 15 HG23 VAL 15 21.601 12.027 -7.776 113 H ASP 16 H ASP 16 25.672 11.134 -6.034 114 HA ASP 16 HA ASP 16 25.363 13.132 -3.891 115 HB2 ASP 16 HB2 ASP 16 24.968 10.634 -3.675 116 HB3 ASP 16 HB3 ASP 16 26.718 10.415 -3.779 117 H LEU 17 H LEU 17 28.095 11.664 -5.625 118 HA LEU 17 HA LEU 17 30.179 12.719 -4.028 119 HB2 LEU 17 HB2 LEU 17 30.290 11.718 -6.873 120 HB3 LEU 17 HB3 LEU 17 31.632 11.989 -5.771 121 HG LEU 17 HG LEU 17 29.499 9.834 -5.666 122 HD11 LEU 17 HD11 LEU 17 31.515 8.428 -5.485 123 HD12 LEU 17 HD12 LEU 17 32.511 9.904 -5.360 124 HD13 LEU 17 HD13 LEU 17 31.649 9.534 -6.875 125 HD21 LEU 17 HD21 LEU 17 31.318 10.611 -3.334 126 HD22 LEU 17 HD22 LEU 17 30.419 9.083 -3.470 127 HD23 LEU 17 HD23 LEU 17 29.537 10.600 -3.328 128 H GLU 18 H GLU 18 28.843 13.834 -7.109 129 HA GLU 18 HA GLU 18 30.382 16.272 -7.257 130 HB2 GLU 18 HB2 GLU 18 28.670 16.990 -8.921 131 HB3 GLU 18 HB3 GLU 18 29.477 15.473 -9.267 132 HG2 GLU 18 HG2 GLU 18 27.372 14.392 -8.070 133 HG3 GLU 18 HG3 GLU 18 26.620 15.913 -8.421 134 H ALA 19 H ALA 19 27.214 15.524 -5.603 135 HA ALA 19 HA ALA 19 26.750 18.256 -4.854 136 HB1 ALA 19 HB1 ALA 19 25.952 15.706 -3.408 137 HB2 ALA 19 HB2 ALA 19 25.211 17.313 -3.250 138 HB3 ALA 19 HB3 ALA 19 25.096 16.420 -4.786 139 H VAL 20 H VAL 20 28.752 15.692 -3.334 140 HA VAL 20 HA VAL 20 29.619 17.344 -1.080 141 HB VAL 20 HB VAL 20 30.780 14.826 -2.307 142 HG11 VAL 20 HG11 VAL 20 31.600 16.265 0.256 143 HG12 VAL 20 HG12 VAL 20 32.081 14.613 -0.187 144 HG13 VAL 20 HG13 VAL 20 32.626 15.970 -1.168 145 HG21 VAL 20 HG21 VAL 20 29.253 15.316 0.294 146 HG22 VAL 20 HG22 VAL 20 28.565 14.587 -1.168 147 HG23 VAL 20 HG23 VAL 20 29.851 13.753 -0.300 148 H ARG 21 H ARG 21 31.049 16.728 -4.318 149 HA ARG 21 HA ARG 21 33.283 18.432 -4.020 150 HB2 ARG 21 HB2 ARG 21 32.885 16.844 -5.909 151 HB3 ARG 21 HB3 ARG 21 31.643 17.920 -6.542 152 HG2 ARG 21 HG2 ARG 21 33.781 18.129 -7.738 153 HG3 ARG 21 HG3 ARG 21 33.232 19.645 -7.034 154 HD2 ARG 21 HD2 ARG 21 35.664 19.342 -6.806 155 HD3 ARG 21 HD3 ARG 21 34.868 19.477 -5.233 156 HE ARG 21 HE ARG 21 35.145 16.706 -6.051 157 HH11 ARG 21 HH11 ARG 21 37.111 19.311 -4.777 158 HH12 ARG 21 HH12 ARG 21 38.211 18.218 -3.982 159 HH21 ARG 21 HH21 ARG 21 36.580 15.363 -5.006 160 HH22 ARG 21 HH22 ARG 21 37.921 16.037 -4.129 161 H LEU 22 H LEU 22 29.955 19.345 -5.063 162 HA LEU 22 HA LEU 22 30.588 22.185 -5.161 163 HB2 LEU 22 HB2 LEU 22 28.022 20.627 -5.299 164 HB3 LEU 22 HB3 LEU 22 28.032 22.367 -4.943 165 HG LEU 22 HG LEU 22 29.520 22.705 -6.987 166 HD11 LEU 22 HD11 LEU 22 29.307 21.039 -8.793 167 HD12 LEU 22 HD12 LEU 22 28.521 19.914 -7.679 168 HD13 LEU 22 HD13 LEU 22 30.223 20.384 -7.431 169 HD21 LEU 22 HD21 LEU 22 26.720 21.642 -7.404 170 HD22 LEU 22 HD22 LEU 22 27.622 22.765 -8.471 171 HD23 LEU 22 HD23 LEU 22 27.167 23.267 -6.830 172 H ALA 23 H ALA 23 29.358 20.143 -2.437 173 HA ALA 23 HA ALA 23 29.108 22.351 -0.647 174 HB1 ALA 23 HB1 ALA 23 28.361 20.040 -0.185 175 HB2 ALA 23 HB2 ALA 23 30.055 19.518 -0.060 176 HB3 ALA 23 HB3 ALA 23 29.385 20.681 1.112 177 H SER 24 H SER 24 31.995 20.592 -1.716 178 HA SER 24 HA SER 24 33.872 22.185 -0.260 179 HB2 SER 24 HB2 SER 24 34.488 20.659 -2.807 180 HB3 SER 24 HB3 SER 24 35.582 21.140 -1.517 181 HG SER 24 HG SER 24 33.442 19.251 -1.324 182 H ILE 25 H ILE 25 32.623 22.649 -3.699 183 HA ILE 25 HA ILE 25 34.379 24.896 -4.058 184 HB ILE 25 HB ILE 25 31.801 24.747 -5.562 185 HG12 ILE 25 HG12 ILE 25 32.484 22.493 -5.878 186 HG13 ILE 25 HG13 ILE 25 32.909 23.388 -7.283 187 HG21 ILE 25 HG21 ILE 25 33.201 25.734 -7.318 188 HG22 ILE 25 HG22 ILE 25 33.395 26.667 -5.838 189 HG23 ILE 25 HG23 ILE 25 34.656 25.546 -6.330 190 HD11 ILE 25 HD11 ILE 25 34.595 21.739 -6.718 191 HD12 ILE 25 HD12 ILE 25 35.281 23.374 -6.658 192 HD13 ILE 25 HD13 ILE 25 34.877 22.502 -5.149 193 H VAL 26 H VAL 26 31.069 24.581 -2.767 194 HA VAL 26 HA VAL 26 30.492 27.402 -2.481 195 HB VAL 26 HB VAL 26 29.445 24.979 -0.991 196 HG11 VAL 26 HG11 VAL 26 27.510 26.441 -0.407 197 HG12 VAL 26 HG12 VAL 26 29.009 26.966 0.352 198 HG13 VAL 26 HG13 VAL 26 28.395 27.840 -1.066 199 HG21 VAL 26 HG21 VAL 26 28.001 26.601 -3.134 200 HG22 VAL 26 HG22 VAL 26 28.966 25.189 -3.569 201 HG23 VAL 26 HG23 VAL 26 27.590 24.991 -2.500 202 H ASP 27 H ASP 27 31.767 24.942 -0.032 203 HA ASP 27 HA ASP 27 32.403 26.775 1.975 204 HB2 ASP 27 HB2 ASP 27 32.714 24.404 2.286 205 HB3 ASP 27 HB3 ASP 27 33.924 24.334 0.998 206 H SER 28 H SER 28 34.424 26.007 -0.885 207 HA SER 28 HA SER 28 36.595 27.748 -0.299 208 HB2 SER 28 HB2 SER 28 35.544 27.039 -3.069 209 HB3 SER 28 HB3 SER 28 37.154 27.639 -2.660 210 HG SER 28 HG SER 28 35.983 25.149 -1.887 211 H ARG 29 H ARG 29 33.476 28.464 -1.849 212 HA ARG 29 HA ARG 29 34.042 31.296 -2.291 213 HB2 ARG 29 HB2 ARG 29 32.490 29.921 -3.676 214 HB3 ARG 29 HB3 ARG 29 31.422 29.731 -2.295 215 HG2 ARG 29 HG2 ARG 29 30.503 31.414 -3.664 216 HG3 ARG 29 HG3 ARG 29 31.109 32.203 -2.217 217 HD2 ARG 29 HD2 ARG 29 33.014 33.093 -3.423 218 HD3 ARG 29 HD3 ARG 29 32.646 32.066 -4.833 219 HE ARG 29 HE ARG 29 30.460 33.868 -4.065 220 HH11 ARG 29 HH11 ARG 29 33.451 33.868 -5.881 221 HH12 ARG 29 HH12 ARG 29 32.878 35.051 -7.023 222 HH21 ARG 29 HH21 ARG 29 29.677 35.189 -5.731 223 HH22 ARG 29 HH22 ARG 29 30.818 35.830 -6.879 224 H LEU 30 H LEU 30 32.374 29.480 0.361 225 HA LEU 30 HA LEU 30 31.528 31.884 1.697 226 HB2 LEU 30 HB2 LEU 30 32.082 29.158 2.903 227 HB3 LEU 30 HB3 LEU 30 31.239 30.502 3.678 228 HG LEU 30 HG LEU 30 30.269 28.897 1.300 229 HD11 LEU 30 HD11 LEU 30 28.494 28.183 2.804 230 HD12 LEU 30 HD12 LEU 30 29.128 29.213 4.098 231 HD13 LEU 30 HD13 LEU 30 30.051 27.795 3.549 232 HD21 LEU 30 HD21 LEU 30 28.165 30.191 1.454 233 HD22 LEU 30 HD22 LEU 30 29.506 31.179 0.912 234 HD23 LEU 30 HD23 LEU 30 28.944 31.299 2.603 235 H ILE 31 H ILE 31 34.569 30.051 1.821 236 HA ILE 31 HA ILE 31 35.884 31.789 3.758 237 HB ILE 31 HB ILE 31 36.901 29.831 1.659 238 HG12 ILE 31 HG12 ILE 31 36.826 29.566 4.700 239 HG13 ILE 31 HG13 ILE 31 35.543 28.967 3.666 240 HG21 ILE 31 HG21 ILE 31 38.489 31.254 3.847 241 HG22 ILE 31 HG22 ILE 31 39.102 29.932 2.832 242 HG23 ILE 31 HG23 ILE 31 38.695 31.465 2.093 243 HD11 ILE 31 HD11 ILE 31 36.989 27.133 4.219 244 HD12 ILE 31 HD12 ILE 31 37.145 27.479 2.489 245 HD13 ILE 31 HD13 ILE 31 38.420 27.983 3.630 246 H GLY 32 H GLY 32 35.518 31.809 0.212 247 HA2 GLY 32 HA2 GLY 32 37.536 33.714 -0.425 248 HA3 GLY 32 HA3 GLY 32 36.169 33.179 -1.428 249 H THR 33 H THR 33 34.037 34.019 0.098 250 HA THR 33 HA THR 33 34.290 36.916 0.518 251 HB THR 33 HB THR 33 34.074 36.701 -1.937 252 HG1 THR 33 HG1 THR 33 32.450 38.213 -2.134 253 HG21 THR 33 HG21 THR 33 32.543 34.664 -1.880 254 HG22 THR 33 HG22 THR 33 32.090 35.955 -3.010 255 HG23 THR 33 HG23 THR 33 31.215 35.777 -1.477 256 H GLY 34 H GLY 34 32.260 34.012 0.703 257 HA2 GLY 34 HA2 GLY 34 30.998 33.595 2.685 258 HA3 GLY 34 HA3 GLY 34 30.758 35.310 2.952 259 H SER 35 H SER 35 30.125 34.560 -0.259 260 HA SER 35 HA SER 35 27.307 33.789 0.043 261 HB2 SER 35 HB2 SER 35 28.208 36.348 -1.343 262 HB3 SER 35 HB3 SER 35 26.594 35.625 -1.487 263 HG SER 35 HG SER 35 26.709 37.279 0.119 264 H VAL 36 H VAL 36 26.536 32.716 -1.762 265 HA VAL 36 HA VAL 36 28.431 32.268 -4.042 266 HB VAL 36 HB VAL 36 28.381 30.298 -2.439 267 HG11 VAL 36 HG11 VAL 36 25.594 29.853 -3.591 268 HG12 VAL 36 HG12 VAL 36 26.494 28.799 -2.480 269 HG13 VAL 36 HG13 VAL 36 25.922 30.394 -1.936 270 HG21 VAL 36 HG21 VAL 36 29.073 30.142 -4.803 271 HG22 VAL 36 HG22 VAL 36 28.276 28.668 -4.244 272 HG23 VAL 36 HG23 VAL 36 27.392 29.821 -5.271 273 H ASP 37 H ASP 37 27.490 32.219 -6.061 274 HA ASP 37 HA ASP 37 24.662 33.074 -6.220 275 HB2 ASP 37 HB2 ASP 37 26.941 34.144 -7.895 276 HB3 ASP 37 HB3 ASP 37 25.325 34.809 -7.687 277 H GLU 38 H GLU 38 23.605 32.644 -8.227 278 HA GLU 38 HA GLU 38 23.948 30.189 -9.372 279 HB2 GLU 38 HB2 GLU 38 22.011 31.840 -9.634 280 HB3 GLU 38 HB3 GLU 38 22.943 32.624 -10.902 281 HG2 GLU 38 HG2 GLU 38 22.919 29.857 -11.603 282 HG3 GLU 38 HG3 GLU 38 21.327 30.180 -10.947 283 H ASP 39 H ASP 39 25.463 33.205 -10.608 284 HA ASP 39 HA ASP 39 26.644 31.988 -12.891 285 HB2 ASP 39 HB2 ASP 39 27.920 34.150 -13.002 286 HB3 ASP 39 HB3 ASP 39 26.174 34.323 -12.921 287 H PHE 40 H PHE 40 27.655 31.933 -9.537 288 HA PHE 40 HA PHE 40 30.433 31.221 -10.252 289 HB2 PHE 40 HB2 PHE 40 29.939 32.465 -8.187 290 HB3 PHE 40 HB3 PHE 40 28.896 31.165 -7.627 291 HD1 PHE 40 HD2 PHE 40 32.417 32.140 -8.300 292 HD2 PHE 40 HD1 PHE 40 29.797 29.101 -6.725 293 HE1 PHE 40 HE2 PHE 40 34.354 31.037 -7.195 294 HE2 PHE 40 HE1 PHE 40 31.704 28.056 -5.555 295 HZ PHE 40 HZ PHE 40 34.001 29.006 -5.805 296 H LEU 41 H LEU 41 27.354 29.574 -9.367 297 HA LEU 41 HA LEU 41 28.606 26.945 -9.126 298 HB2 LEU 41 HB2 LEU 41 25.804 28.110 -8.932 299 HB3 LEU 41 HB3 LEU 41 26.063 26.374 -8.763 300 HG LEU 41 HG LEU 41 27.452 28.452 -7.026 301 HD11 LEU 41 HD11 LEU 41 24.944 26.811 -6.469 302 HD12 LEU 41 HD12 LEU 41 25.023 28.576 -6.696 303 HD13 LEU 41 HD13 LEU 41 25.807 27.830 -5.293 304 HD21 LEU 41 HD21 LEU 41 27.861 26.552 -5.507 305 HD22 LEU 41 HD22 LEU 41 28.594 26.222 -7.074 306 HD23 LEU 41 HD23 LEU 41 27.050 25.459 -6.636 307 H ARG 42 H ARG 42 26.586 28.475 -11.673 308 HA ARG 42 HA ARG 42 26.222 26.123 -13.207 309 HB2 ARG 42 HB2 ARG 42 25.830 27.617 -15.091 310 HB3 ARG 42 HB3 ARG 42 25.105 28.228 -13.613 311 HG2 ARG 42 HG2 ARG 42 27.098 29.797 -13.369 312 HG3 ARG 42 HG3 ARG 42 27.598 29.273 -14.986 313 HD2 ARG 42 HD2 ARG 42 25.272 29.907 -15.814 314 HD3 ARG 42 HD3 ARG 42 24.945 30.543 -14.194 315 HE ARG 42 HE ARG 42 27.312 31.643 -15.570 316 HH11 ARG 42 HH21 ARG 42 23.932 32.229 -14.693 317 HH12 ARG 42 HH22 ARG 42 23.993 33.858 -15.314 318 HH21 ARG 42 HH12 ARG 42 27.288 33.747 -16.289 319 HH22 ARG 42 HH11 ARG 42 25.852 34.708 -16.130 320 H GLU 43 H GLU 43 29.199 27.851 -12.773 321 HA GLU 43 HA GLU 43 30.632 26.467 -14.913 322 HB2 GLU 43 HB2 GLU 43 31.805 28.001 -12.564 323 HB3 GLU 43 HB3 GLU 43 32.555 27.630 -14.123 324 HG2 GLU 43 HG2 GLU 43 30.540 28.970 -15.117 325 HG3 GLU 43 HG3 GLU 43 30.376 29.625 -13.487 326 H GLN 44 H GLN 44 29.527 25.247 -11.913 327 HA GLN 44 HA GLN 44 31.997 23.652 -11.426 328 HB2 GLN 44 HB2 GLN 44 29.780 24.237 -9.446 329 HB3 GLN 44 HB3 GLN 44 31.397 23.618 -9.123 330 HG2 GLN 44 HG2 GLN 44 30.640 26.390 -10.046 331 HG3 GLN 44 HG3 GLN 44 31.154 25.963 -8.430 332 HE21 GLN 44 HE21 GLN 44 32.334 27.997 -9.960 333 HE22 GLN 44 HE22 GLN 44 34.020 27.530 -10.230 334 H ILE 45 H ILE 45 28.625 23.445 -12.280 335 HA ILE 45 HA ILE 45 27.820 21.029 -11.124 336 HB ILE 45 HB ILE 45 26.676 20.762 -13.561 337 HG12 ILE 45 HG12 ILE 45 26.786 23.781 -13.366 338 HG13 ILE 45 HG13 ILE 45 27.910 22.882 -14.413 339 HG21 ILE 45 HG21 ILE 45 24.744 21.854 -12.607 340 HG22 ILE 45 HG22 ILE 45 25.620 20.990 -11.335 341 HG23 ILE 45 HG23 ILE 45 25.779 22.766 -11.470 342 HD11 ILE 45 HD11 ILE 45 24.871 22.872 -14.623 343 HD12 ILE 45 HD12 ILE 45 26.025 23.639 -15.725 344 HD13 ILE 45 HD13 ILE 45 25.971 21.868 -15.600 345 H ARG 46 H ARG 46 29.164 21.123 -14.560 346 HA ARG 46 HA ARG 46 30.407 19.946 -15.662 347 HB2 ARG 46 HB2 ARG 46 31.546 18.705 -13.131 348 HB3 ARG 46 HB3 ARG 46 32.277 18.605 -14.729 349 HG2 ARG 46 HG2 ARG 46 31.888 21.151 -13.119 350 HG3 ARG 46 HG3 ARG 46 33.394 20.267 -13.315 351 HD2 ARG 46 HD2 ARG 46 33.435 20.787 -15.715 352 HD3 ARG 46 HD3 ARG 46 31.852 21.560 -15.605 353 HE ARG 46 HE ARG 46 32.733 23.365 -14.343 354 HH11 ARG 46 HH11 ARG 46 35.370 21.312 -15.437 355 HH12 ARG 46 HH12 ARG 46 36.555 22.541 -15.091 356 HH21 ARG 46 HH21 ARG 46 34.209 24.790 -13.895 357 HH22 ARG 46 HH22 ARG 46 35.908 24.513 -14.237 358 H ASP 47 H ASP 47 28.192 18.226 -13.856 359 HA ASP 47 HA ASP 47 27.849 16.471 -16.211 360 HB2 ASP 47 HB2 ASP 47 29.448 15.364 -14.469 361 HB3 ASP 47 HB3 ASP 47 28.017 15.181 -13.465 362 H ALA 48 H ALA 48 26.601 17.749 -13.157 363 HA ALA 48 HA ALA 48 23.948 16.634 -13.455 364 HB1 ALA 48 HB1 ALA 48 25.135 18.757 -11.629 365 HB2 ALA 48 HB2 ALA 48 23.458 18.165 -11.546 366 HB3 ALA 48 HB3 ALA 48 24.807 17.057 -11.252 367 H ARG 49 H ARG 49 22.002 17.856 -13.628 368 HA ARG 49 HA ARG 49 22.097 19.891 -15.748 369 HB2 ARG 49 HB2 ARG 49 20.423 17.873 -15.468 370 HB3 ARG 49 HB3 ARG 49 19.592 18.931 -14.330 371 HG2 ARG 49 HG2 ARG 49 18.496 19.256 -16.385 372 HG3 ARG 49 HG3 ARG 49 19.541 20.679 -16.228 373 HD2 ARG 49 HD2 ARG 49 21.192 19.643 -17.747 374 HD3 ARG 49 HD3 ARG 49 20.173 18.192 -17.869 375 HE ARG 49 HE ARG 49 18.575 20.419 -18.578 376 HH11 ARG 49 HH12 ARG 49 21.336 18.733 -19.924 377 HH12 ARG 49 HH11 ARG 49 20.938 19.188 -21.559 378 HH21 ARG 49 HH21 ARG 49 18.121 20.968 -20.689 379 HH22 ARG 49 HH22 ARG 49 19.156 20.423 -21.973 380 H TYR 50 H TYR 50 20.803 19.788 -12.417 381 HA TYR 50 HA TYR 50 20.930 22.766 -12.259 382 HB2 TYR 50 HB2 TYR 50 19.005 20.991 -10.746 383 HB3 TYR 50 HB3 TYR 50 18.864 22.702 -11.078 384 HD1 TYR 50 HD2 TYR 50 19.177 22.899 -13.987 385 HD2 TYR 50 HD1 TYR 50 17.136 19.936 -11.639 386 HE1 TYR 50 HE2 TYR 50 17.617 22.479 -15.882 387 HE2 TYR 50 HE1 TYR 50 15.605 19.471 -13.544 388 HH TYR 50 HH TYR 50 15.034 20.017 -15.695 389 H ALA 51 H ALA 51 22.052 23.666 -10.508 390 HA ALA 51 HA ALA 51 22.727 21.876 -8.204 391 HB1 ALA 51 HB1 ALA 51 24.748 22.659 -9.301 392 HB2 ALA 51 HB2 ALA 51 24.176 24.344 -9.246 393 HB3 ALA 51 HB3 ALA 51 24.553 23.479 -7.741 394 H VAL 52 H VAL 52 22.128 22.615 -6.135 395 HA VAL 52 HA VAL 52 20.396 25.048 -5.985 396 HB VAL 52 HB VAL 52 19.623 22.214 -5.217 397 HG11 VAL 52 HG11 VAL 52 18.186 24.843 -4.641 398 HG12 VAL 52 HG12 VAL 52 17.438 23.238 -4.506 399 HG13 VAL 52 HG13 VAL 52 18.781 23.663 -3.447 400 HG21 VAL 52 HG21 VAL 52 18.446 24.180 -7.216 401 HG22 VAL 52 HG22 VAL 52 19.253 22.638 -7.577 402 HG23 VAL 52 HG23 VAL 52 17.703 22.638 -6.744 403 H ILE 53 H ILE 53 20.393 26.115 -4.097 404 HA ILE 53 HA ILE 53 22.362 25.192 -2.065 405 HB ILE 53 HB ILE 53 22.135 27.588 -3.735 406 HG12 ILE 53 HG12 ILE 53 24.028 26.081 -3.822 407 HG13 ILE 53 HG13 ILE 53 24.514 27.714 -3.387 408 HG21 ILE 53 HG21 ILE 53 22.706 28.151 -0.798 409 HG22 ILE 53 HG22 ILE 53 23.123 29.219 -2.153 410 HG23 ILE 53 HG23 ILE 53 21.439 28.856 -1.808 411 HD11 ILE 53 HD11 ILE 53 24.363 25.288 -1.563 412 HD12 ILE 53 HD12 ILE 53 25.770 26.268 -1.991 413 HD13 ILE 53 HD13 ILE 53 24.515 26.928 -0.930 414 H ARG 54 H ARG 54 21.919 25.050 -0.041 415 HA ARG 54 HA ARG 54 19.858 26.837 1.212 416 HB2 ARG 54 HB2 ARG 54 20.474 23.931 1.847 417 HB3 ARG 54 HB3 ARG 54 19.307 24.951 2.689 418 HG2 ARG 54 HG2 ARG 54 19.125 24.033 -0.224 419 HG3 ARG 54 HG3 ARG 54 18.298 23.287 1.136 420 HD2 ARG 54 HD2 ARG 54 16.993 25.319 1.545 421 HD3 ARG 54 HD3 ARG 54 17.886 26.182 0.292 422 HE ARG 54 HE ARG 54 16.695 25.128 -1.376 423 HH11 ARG 54 HH21 ARG 54 15.849 23.510 1.624 424 HH12 ARG 54 HH22 ARG 54 14.553 22.618 0.882 425 HH21 ARG 54 HH11 ARG 54 15.013 23.958 -2.252 426 HH22 ARG 54 HH12 ARG 54 14.097 22.874 -1.253 427 H ILE 55 H ILE 55 21.595 28.276 1.657 428 HA ILE 55 HA ILE 55 23.543 27.415 3.762 429 HB ILE 55 HB ILE 55 23.515 29.874 1.989 430 HG12 ILE 55 HG12 ILE 55 25.863 27.997 2.184 431 HG13 ILE 55 HG13 ILE 55 24.470 27.464 1.242 432 HG21 ILE 55 HG21 ILE 55 25.417 29.164 4.282 433 HG22 ILE 55 HG22 ILE 55 25.718 30.436 3.097 434 HG23 ILE 55 HG23 ILE 55 24.339 30.579 4.185 435 HD11 ILE 55 HD11 ILE 55 26.153 28.576 -0.130 436 HD12 ILE 55 HD12 ILE 55 24.623 29.483 -0.143 437 HD13 ILE 55 HD13 ILE 55 25.995 30.063 0.823 438 HA PRO 56 HA PRO 56 20.645 29.530 6.510 439 HB2 PRO 56 HB2 PRO 56 22.157 29.684 8.799 440 HB3 PRO 56 HB3 PRO 56 21.357 28.188 8.225 441 HG2 PRO 56 HG2 PRO 56 24.241 29.034 7.802 442 HG3 PRO 56 HG3 PRO 56 23.623 27.448 8.367 443 HD2 PRO 56 HD2 PRO 56 24.300 27.863 5.782 444 HD3 PRO 56 HD3 PRO 56 22.874 26.865 6.201 445 H GLY 57 H GLY 57 20.184 31.643 6.594 446 HA2 GLY 57 HA2 GLY 57 20.460 33.896 7.091 447 HA3 GLY 57 HA3 GLY 57 22.206 33.696 7.176 448 H GLN 58 H GLN 58 21.220 32.386 4.209 449 HA GLN 58 HA GLN 58 20.973 34.978 2.814 450 HB2 GLN 58 HB2 GLN 58 22.777 34.683 1.346 451 HB3 GLN 58 HB3 GLN 58 23.383 34.247 2.938 452 HG2 GLN 58 HG2 GLN 58 23.150 31.890 2.398 453 HG3 GLN 58 HG3 GLN 58 22.633 32.279 0.741 454 HE21 GLN 58 HE21 GLN 58 25.312 33.147 3.058 455 HE22 GLN 58 HE22 GLN 58 26.560 33.190 1.838 456 HA PRO 59 HA PRO 59 17.780 33.042 0.691 457 HB2 PRO 59 HB2 PRO 59 17.753 34.096 -1.847 458 HB3 PRO 59 HB3 PRO 59 17.353 35.029 -0.371 459 HG2 PRO 59 HG2 PRO 59 20.021 34.887 -1.817 460 HG3 PRO 59 HG3 PRO 59 19.129 36.351 -1.283 461 HD2 PRO 59 HD2 PRO 59 21.127 35.310 0.198 462 HD3 PRO 59 HD3 PRO 59 19.655 35.947 0.994 463 H VAL 60 H VAL 60 17.116 31.366 -0.613 464 HA VAL 60 HA VAL 60 18.972 29.396 -1.503 465 HB VAL 60 HB VAL 60 16.819 28.683 -0.872 466 HG11 VAL 60 HG11 VAL 60 15.586 30.394 -3.071 467 HG12 VAL 60 HG12 VAL 60 14.725 29.227 -2.052 468 HG13 VAL 60 HG13 VAL 60 15.432 30.664 -1.320 469 HG21 VAL 60 HG21 VAL 60 16.819 28.386 -3.898 470 HG22 VAL 60 HG22 VAL 60 17.823 27.416 -2.805 471 HG23 VAL 60 HG23 VAL 60 16.058 27.318 -2.709 472 H VAL 61 H VAL 61 20.034 29.058 -3.295 473 HA VAL 61 HA VAL 61 19.412 30.599 -5.795 474 HB VAL 61 HB VAL 61 22.059 29.425 -4.871 475 HG11 VAL 61 HG11 VAL 61 23.022 30.422 -6.884 476 HG12 VAL 61 HG12 VAL 61 21.862 29.171 -7.311 477 HG13 VAL 61 HG13 VAL 61 21.400 30.889 -7.455 478 HG21 VAL 61 HG21 VAL 61 21.185 32.305 -5.325 479 HG22 VAL 61 HG22 VAL 61 21.521 31.547 -3.752 480 HG23 VAL 61 HG23 VAL 61 22.829 31.765 -4.916 481 H GLU 62 H GLU 62 18.959 29.469 -7.616 482 HA GLU 62 HA GLU 62 19.241 26.499 -7.651 483 HB2 GLU 62 HB2 GLU 62 16.777 28.078 -8.512 484 HB3 GLU 62 HB3 GLU 62 17.042 26.351 -8.777 485 HG2 GLU 62 HG2 GLU 62 17.080 25.963 -6.343 486 HG3 GLU 62 HG3 GLU 62 16.852 27.687 -6.048 487 H VAL 63 H VAL 63 20.582 26.021 -9.354 488 HA VAL 63 HA VAL 63 21.015 27.998 -11.484 489 HB VAL 63 HB VAL 63 22.448 25.421 -10.768 490 HG11 VAL 63 HG11 VAL 63 24.362 26.471 -11.967 491 HG12 VAL 63 HG12 VAL 63 23.025 26.036 -13.025 492 HG13 VAL 63 HG13 VAL 63 23.249 27.739 -12.538 493 HG21 VAL 63 HG21 VAL 63 24.146 26.816 -9.727 494 HG22 VAL 63 HG22 VAL 63 23.145 28.263 -9.972 495 HG23 VAL 63 HG23 VAL 63 22.628 26.973 -8.864 496 H GLY 64 H GLY 64 20.991 27.396 -13.744 497 HA2 GLY 64 HA2 GLY 64 20.403 26.172 -15.605 498 HA3 GLY 64 HA3 GLY 64 20.110 24.770 -14.579 499 H THR 65 H THR 65 17.983 24.403 -13.768 500 HA THR 65 HA THR 65 15.821 26.297 -14.322 501 HB THR 65 HB THR 65 15.478 23.507 -15.472 502 HG1 THR 65 HG1 THR 65 15.743 24.429 -17.502 503 HG21 THR 65 HG21 THR 65 13.380 24.665 -15.020 504 HG22 THR 65 HG22 THR 65 13.648 24.612 -16.759 505 HG23 THR 65 HG23 THR 65 13.960 26.119 -15.869 506 H LYS 66 H LYS 66 14.007 25.880 -12.934 507 HA LYS 66 HA LYS 66 14.506 24.244 -10.664 508 HB2 LYS 66 HB2 LYS 66 13.135 26.363 -10.738 509 HB3 LYS 66 HB3 LYS 66 11.836 25.447 -11.519 510 HG2 LYS 66 HG2 LYS 66 11.756 23.930 -9.521 511 HG3 LYS 66 HG3 LYS 66 13.060 24.876 -8.784 512 HD2 LYS 66 HD2 LYS 66 11.530 26.925 -8.949 513 HD3 LYS 66 HD3 LYS 66 10.256 25.828 -9.497 514 HE2 LYS 66 HE2 LYS 66 9.844 26.045 -7.197 515 HE3 LYS 66 HE3 LYS 66 10.659 24.484 -7.342 516 HZ1 LYS 66 HZ1 LYS 66 12.764 25.665 -6.687 517 HZ2 LYS 66 HZ2 LYS 66 11.604 25.784 -5.527 518 HZ3 LYS 66 HZ3 LYS 66 11.931 27.048 -6.513 519 HA PRO 67 HA PRO 67 13.231 20.448 -12.559 520 HB2 PRO 67 HB2 PRO 67 13.395 18.735 -10.431 521 HB3 PRO 67 HB3 PRO 67 14.821 19.445 -11.256 522 HG2 PRO 67 HG2 PRO 67 13.486 20.357 -8.702 523 HG3 PRO 67 HG3 PRO 67 15.237 20.159 -9.074 524 HD2 PRO 67 HD2 PRO 67 13.969 22.588 -9.211 525 HD3 PRO 67 HD3 PRO 67 15.328 22.138 -10.289 526 H THR 68 H THR 68 11.634 19.077 -12.799 527 HA THR 68 HA THR 68 9.050 19.903 -12.014 528 HB THR 68 HB THR 68 9.724 19.136 -14.264 529 HG1 THR 68 HG1 THR 68 7.567 19.243 -13.867 530 HG21 THR 68 HG21 THR 68 9.802 16.814 -14.867 531 HG22 THR 68 HG22 THR 68 9.399 16.296 -13.223 532 HG23 THR 68 HG23 THR 68 10.976 17.051 -13.563 533 H GLY 69 H GLY 69 10.939 17.326 -10.709 534 HA2 GLY 69 HA2 GLY 69 10.148 16.499 -8.444 535 HA3 GLY 69 HA3 GLY 69 8.590 16.182 -9.226 536 H ASP 70 H ASP 70 9.543 15.171 -11.667 537 HA ASP 70 HA ASP 70 10.451 12.467 -11.023 538 HB2 ASP 70 HB2 ASP 70 9.949 13.754 -13.707 539 HB3 ASP 70 HB3 ASP 70 10.163 12.025 -13.384 540 H VAL 71 H VAL 71 12.339 13.672 -9.969 541 HA VAL 71 HA VAL 71 14.688 13.697 -11.804 542 HB VAL 71 HB VAL 71 15.610 15.628 -10.623 543 HG11 VAL 71 HG11 VAL 71 14.146 15.801 -12.752 544 HG12 VAL 71 HG12 VAL 71 12.899 16.499 -11.705 545 HG13 VAL 71 HG13 VAL 71 14.492 17.265 -11.859 546 HG21 VAL 71 HG21 VAL 71 14.366 15.453 -8.479 547 HG22 VAL 71 HG22 VAL 71 14.303 17.062 -9.191 548 HG23 VAL 71 HG23 VAL 71 12.891 15.992 -9.310 549 H LEU 72 H LEU 72 16.724 13.550 -10.759 550 HA LEU 72 HA LEU 72 16.826 11.645 -8.449 551 HB2 LEU 72 HB2 LEU 72 18.944 12.555 -10.454 552 HB3 LEU 72 HB3 LEU 72 19.227 11.411 -9.143 553 HG LEU 72 HG LEU 72 17.239 10.984 -11.381 554 HD11 LEU 72 HD11 LEU 72 20.059 9.853 -11.048 555 HD12 LEU 72 HD12 LEU 72 19.546 11.037 -12.274 556 HD13 LEU 72 HD13 LEU 72 18.901 9.392 -12.321 557 HD21 LEU 72 HD21 LEU 72 16.664 9.709 -9.435 558 HD22 LEU 72 HD22 LEU 72 18.343 9.146 -9.247 559 HD23 LEU 72 HD23 LEU 72 17.361 8.603 -10.631 560 H GLN 73 H GLN 73 17.760 12.304 -6.531 561 HA GLN 73 HA GLN 73 18.765 15.118 -6.395 562 HB2 GLN 73 HB2 GLN 73 17.226 13.396 -4.433 563 HB3 GLN 73 HB3 GLN 73 17.956 14.957 -4.051 564 HG2 GLN 73 HG2 GLN 73 16.627 15.951 -5.979 565 HG3 GLN 73 HG3 GLN 73 15.741 14.432 -6.077 566 HE21 GLN 73 HE21 GLN 73 14.881 17.254 -5.342 567 HE22 GLN 73 HE22 GLN 73 14.104 17.054 -3.764 568 H GLY 74 H GLY 74 20.846 15.323 -6.097 569 HA2 GLY 74 HA2 GLY 74 22.453 13.376 -4.456 570 HA3 GLY 74 HA3 GLY 74 23.101 14.596 -5.573 571 H ARG 75 H ARG 75 23.620 14.345 -2.549 572 HA ARG 75 HA ARG 75 22.798 17.043 -1.745 573 HB2 ARG 75 HB2 ARG 75 20.739 15.611 -1.372 574 HB3 ARG 75 HB3 ARG 75 21.658 14.692 -0.178 575 HG2 ARG 75 HG2 ARG 75 21.977 16.791 1.153 576 HG3 ARG 75 HG3 ARG 75 21.060 17.692 -0.069 577 HD2 ARG 75 HD2 ARG 75 19.076 16.305 0.369 578 HD3 ARG 75 HD3 ARG 75 19.965 15.335 1.540 579 HE ARG 75 HE ARG 75 18.820 17.999 1.910 580 HH11 ARG 75 HH11 ARG 75 21.196 15.794 3.269 581 HH12 ARG 75 HH12 ARG 75 21.157 16.574 4.824 582 HH21 ARG 75 HH21 ARG 75 18.789 18.903 3.941 583 HH22 ARG 75 HH22 ARG 75 19.839 18.294 5.183 584 H ALA 76 H ALA 76 24.087 17.907 -0.344 585 HA ALA 76 HA ALA 76 25.862 16.278 1.464 586 HB1 ALA 76 HB1 ALA 76 26.700 18.378 -0.584 587 HB2 ALA 76 HB2 ALA 76 27.796 17.588 0.579 588 HB3 ALA 76 HB3 ALA 76 27.006 16.631 -0.687 589 H THR 77 H THR 77 27.214 17.622 2.893 590 HA THR 77 HA THR 77 25.873 20.116 3.852 591 HB THR 77 HB THR 77 27.127 17.986 5.613 592 HG1 THR 77 HG1 THR 77 25.014 17.687 6.328 593 HG21 THR 77 HG21 THR 77 26.214 19.311 7.487 594 HG22 THR 77 HG22 THR 77 25.582 20.523 6.356 595 HG23 THR 77 HG23 THR 77 27.330 20.306 6.549 596 H GLY 78 H GLY 78 27.257 21.770 4.085 597 HA2 GLY 78 HA2 GLY 78 30.100 21.379 3.239 598 HA3 GLY 78 HA3 GLY 78 29.218 22.879 3.206 599 H GLU 79 H GLU 79 31.553 23.239 4.184 600 HA GLU 79 HA GLU 79 31.898 22.348 6.948 601 HB2 GLU 79 HB2 GLU 79 33.653 23.918 5.057 602 HB3 GLU 79 HB3 GLU 79 34.136 23.460 6.684 603 HG2 GLU 79 HG2 GLU 79 33.399 21.505 4.460 604 HG3 GLU 79 HG3 GLU 79 35.032 21.950 4.932 605 H GLU 80 H GLU 80 30.441 25.284 5.681 606 HA GLU 80 HA GLU 80 31.042 26.679 8.274 607 HB2 GLU 80 HB2 GLU 80 29.602 27.630 5.798 608 HB3 GLU 80 HB3 GLU 80 29.920 28.595 7.233 609 HG2 GLU 80 HG2 GLU 80 32.141 27.426 5.481 610 HG3 GLU 80 HG3 GLU 80 31.408 28.988 5.317 611 H GLY 81 H GLY 81 29.087 24.296 7.310 612 HA2 GLY 81 HA2 GLY 81 27.352 23.359 8.438 613 HA3 GLY 81 HA3 GLY 81 26.913 24.895 9.168 614 H GLU 82 H GLU 82 27.385 24.897 5.686 615 HA GLU 82 HA GLU 82 24.573 25.400 5.195 616 HB2 GLU 82 HB2 GLU 82 25.259 26.066 3.100 617 HB3 GLU 82 HB3 GLU 82 26.472 26.711 4.209 618 HG2 GLU 82 HG2 GLU 82 26.936 24.168 2.586 619 HG3 GLU 82 HG3 GLU 82 27.143 25.763 1.900 620 H THR 83 H THR 83 23.728 24.440 3.013 621 HA THR 83 HA THR 83 24.212 21.507 2.866 622 HB THR 83 HB THR 83 21.582 22.903 3.361 623 HG1 THR 83 HG1 THR 83 22.868 22.013 5.052 624 HG21 THR 83 HG21 THR 83 21.942 20.088 2.242 625 HG22 THR 83 HG22 THR 83 21.094 21.443 1.448 626 HG23 THR 83 HG23 THR 83 20.439 20.750 2.929 627 H VAL 84 H VAL 84 24.192 20.728 0.925 628 HA VAL 84 HA VAL 84 23.605 22.503 -1.442 629 HB VAL 84 HB VAL 84 25.902 20.535 -1.102 630 HG11 VAL 84 HG11 VAL 84 25.093 22.138 -3.574 631 HG12 VAL 84 HG12 VAL 84 26.599 21.211 -3.367 632 HG13 VAL 84 HG13 VAL 84 25.065 20.360 -3.420 633 HG21 VAL 84 HG21 VAL 84 26.391 22.680 -0.073 634 HG22 VAL 84 HG22 VAL 84 27.235 22.619 -1.634 635 HG23 VAL 84 HG23 VAL 84 25.747 23.547 -1.486 636 H LEU 85 H LEU 85 22.431 21.676 -3.026 637 HA LEU 85 HA LEU 85 21.773 18.782 -3.033 638 HB2 LEU 85 HB2 LEU 85 19.944 20.059 -1.951 639 HB3 LEU 85 HB3 LEU 85 19.861 21.119 -3.340 640 HG LEU 85 HG LEU 85 19.262 18.973 -4.714 641 HD11 LEU 85 HD11 LEU 85 18.451 17.975 -1.951 642 HD12 LEU 85 HD12 LEU 85 19.868 17.374 -2.812 643 HD13 LEU 85 HD13 LEU 85 18.264 17.154 -3.522 644 HD21 LEU 85 HD21 LEU 85 16.901 19.126 -4.040 645 HD22 LEU 85 HD22 LEU 85 17.653 20.713 -4.246 646 HD23 LEU 85 HD23 LEU 85 17.373 20.072 -2.609 647 H VAL 86 H VAL 86 21.396 17.911 -5.090 648 HA VAL 86 HA VAL 86 22.000 19.565 -7.510 649 HB VAL 86 HB VAL 86 23.170 16.825 -6.822 650 HG11 VAL 86 HG11 VAL 86 23.255 18.455 -9.377 651 HG12 VAL 86 HG12 VAL 86 24.296 17.040 -9.034 652 HG13 VAL 86 HG13 VAL 86 22.548 16.834 -9.186 653 HG21 VAL 86 HG21 VAL 86 24.422 18.687 -5.787 654 HG22 VAL 86 HG22 VAL 86 25.350 17.950 -7.100 655 HG23 VAL 86 HG23 VAL 86 24.524 19.506 -7.364 656 H GLU 87 H GLU 87 20.575 19.139 -9.168 657 HA GLU 87 HA GLU 87 18.861 16.736 -8.899 658 HB2 GLU 87 HB2 GLU 87 17.727 19.513 -9.315 659 HB3 GLU 87 HB3 GLU 87 16.831 17.985 -9.280 660 HG2 GLU 87 HG2 GLU 87 17.789 17.637 -6.920 661 HG3 GLU 87 HG3 GLU 87 18.345 19.306 -6.986 662 H GLU 88 H GLU 88 18.321 15.708 -10.680 663 HA GLU 88 HA GLU 88 18.481 16.991 -13.330 664 HB2 GLU 88 HB2 GLU 88 20.014 15.225 -14.198 665 HB3 GLU 88 HB3 GLU 88 20.770 16.356 -13.087 666 HG2 GLU 88 HG2 GLU 88 20.736 14.686 -11.306 667 HG3 GLU 88 HG3 GLU 88 19.788 13.581 -12.336 668 HA PRO 89 HA PRO 89 15.045 14.550 -14.245 669 HB2 PRO 89 HB2 PRO 89 15.317 13.722 -16.871 670 HB3 PRO 89 HB3 PRO 89 14.883 15.377 -16.343 671 HG2 PRO 89 HG2 PRO 89 17.632 14.305 -17.056 672 HG3 PRO 89 HG3 PRO 89 16.850 15.819 -17.628 673 HD2 PRO 89 HD2 PRO 89 18.613 15.890 -15.623 674 HD3 PRO 89 HD3 PRO 89 17.121 16.851 -15.481 675 H ARG 90 H ARG 90 14.216 12.647 -13.980 676 HA ARG 90 HA ARG 90 15.960 10.325 -13.476 677 HB2 ARG 90 HB2 ARG 90 14.261 11.161 -11.826 678 HB3 ARG 90 HB3 ARG 90 12.983 10.641 -12.932 679 HG2 ARG 90 HG2 ARG 90 13.693 8.313 -12.739 680 HG3 ARG 90 HG3 ARG 90 15.130 8.787 -11.806 681 HD2 ARG 90 HD2 ARG 90 13.683 9.671 -10.010 682 HD3 ARG 90 HD3 ARG 90 12.241 9.182 -10.927 683 HE ARG 90 HE ARG 90 13.816 6.878 -10.681 684 HH11 ARG 90 HH11 ARG 90 12.159 9.000 -8.438 685 HH12 ARG 90 HH12 ARG 90 11.936 7.734 -7.261 686 HH21 ARG 90 HH21 ARG 90 13.503 5.313 -9.138 687 HH22 ARG 90 HH22 ARG 90 12.681 5.699 -7.655 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 2.500 -12.457 1.282 2 H2 GLY 1 H2 GLY 1 2.912 -11.796 -0.159 3 H3 GLY 1 H3 GLY 1 1.999 -10.944 0.903 4 HA2 GLY 1 HA2 GLY 1 3.813 -10.852 2.491 5 HA3 GLY 1 HA3 GLY 1 4.799 -11.770 1.338 6 H SER 2 H SER 2 6.215 -9.843 1.723 7 HA SER 2 HA SER 2 5.921 -7.933 -0.494 8 HB2 SER 2 HB2 SER 2 4.800 -6.843 1.484 9 HB3 SER 2 HB3 SER 2 6.350 -6.916 2.343 10 HG SER 2 HG SER 2 5.985 -4.910 1.254 11 H GLU 3 H GLU 3 7.902 -7.001 -1.129 12 HA GLU 3 HA GLU 3 10.417 -7.972 0.154 13 HB2 GLU 3 HB2 GLU 3 9.719 -8.195 -2.804 14 HB3 GLU 3 HB3 GLU 3 11.319 -8.465 -2.108 15 HG2 GLU 3 HG2 GLU 3 10.411 -10.337 -0.743 16 HG3 GLU 3 HG3 GLU 3 8.827 -10.109 -1.494 17 H THR 4 H THR 4 12.130 -6.556 0.054 18 HA THR 4 HA THR 4 11.892 -3.880 -0.220 19 HB THR 4 HB THR 4 14.427 -5.398 -0.946 20 HG1 THR 4 HG1 THR 4 14.790 -5.368 1.284 21 HG21 THR 4 HG21 THR 4 15.553 -3.505 0.226 22 HG22 THR 4 HG22 THR 4 13.982 -2.690 0.403 23 HG23 THR 4 HG23 THR 4 14.685 -2.962 -1.210 24 H ARG 5 H ARG 5 12.013 -2.284 -1.718 25 HA ARG 5 HA ARG 5 11.432 -2.818 -4.472 26 HB2 ARG 5 HB2 ARG 5 11.525 -0.334 -4.652 27 HB3 ARG 5 HB3 ARG 5 10.497 -0.890 -3.342 28 HG2 ARG 5 HG2 ARG 5 12.020 -0.225 -1.656 29 HG3 ARG 5 HG3 ARG 5 13.388 -0.114 -2.766 30 HD2 ARG 5 HD2 ARG 5 10.970 1.722 -2.927 31 HD3 ARG 5 HD3 ARG 5 12.424 2.078 -1.972 32 HE ARG 5 HE ARG 5 13.273 1.400 -4.594 33 HH11 ARG 5 HH21 ARG 5 11.648 4.083 -3.032 34 HH12 ARG 5 HH22 ARG 5 12.228 5.231 -4.209 35 HH21 ARG 5 HH12 ARG 5 13.919 2.835 -6.054 36 HH22 ARG 5 HH11 ARG 5 13.511 4.529 -5.911 37 H THR 6 H THR 6 12.508 -1.832 -6.311 38 HA THR 6 HA THR 6 15.333 -2.370 -6.595 39 HB THR 6 HB THR 6 13.544 -0.604 -8.322 40 HG1 THR 6 HG1 THR 6 14.029 -3.381 -8.562 41 HG21 THR 6 HG21 THR 6 15.864 -0.416 -9.032 42 HG22 THR 6 HG22 THR 6 15.001 -1.435 -10.183 43 HG23 THR 6 HG23 THR 6 16.073 -2.185 -8.978 44 H ILE 7 H ILE 7 17.053 -0.678 -6.984 45 HA ILE 7 HA ILE 7 16.553 1.927 -5.734 46 HB ILE 7 HB ILE 7 18.805 0.144 -4.773 47 HG12 ILE 7 HG12 ILE 7 16.296 1.041 -3.260 48 HG13 ILE 7 HG13 ILE 7 16.566 -0.589 -3.887 49 HG21 ILE 7 HG21 ILE 7 17.882 2.916 -3.839 50 HG22 ILE 7 HG22 ILE 7 19.250 1.990 -3.186 51 HG23 ILE 7 HG23 ILE 7 19.334 2.602 -4.817 52 HD11 ILE 7 HD11 ILE 7 17.070 -0.659 -1.596 53 HD12 ILE 7 HD12 ILE 7 18.589 -0.810 -2.508 54 HD13 ILE 7 HD13 ILE 7 18.166 0.730 -1.705 55 H SER 8 H SER 8 17.801 3.473 -6.677 56 HA SER 8 HA SER 8 18.996 2.691 -9.250 57 HB2 SER 8 HB2 SER 8 18.247 5.444 -8.231 58 HB3 SER 8 HB3 SER 8 18.736 5.036 -9.888 59 HG SER 8 HG SER 8 16.467 5.084 -9.670 60 H SER 9 H SER 9 20.637 2.156 -7.026 61 HA SER 9 HA SER 9 22.613 3.847 -6.370 62 HB2 SER 9 HB2 SER 9 23.119 0.891 -6.627 63 HB3 SER 9 HB3 SER 9 23.709 2.007 -5.387 64 HG SER 9 HG SER 9 21.987 0.747 -4.611 65 H THR 10 H THR 10 22.606 4.179 -9.207 66 HA THR 10 HA THR 10 25.475 4.126 -9.725 67 HB THR 10 HB THR 10 25.019 3.729 -12.152 68 HG1 THR 10 HG1 THR 10 23.144 2.481 -12.614 69 HG21 THR 10 HG21 THR 10 25.998 1.947 -10.697 70 HG22 THR 10 HG22 THR 10 25.032 1.285 -12.025 71 HG23 THR 10 HG23 THR 10 24.359 1.337 -10.380 72 H ALA 11 H ALA 11 22.447 5.055 -11.340 73 HA ALA 11 HA ALA 11 23.258 7.705 -12.012 74 HB1 ALA 11 HB1 ALA 11 20.907 7.975 -12.703 75 HB2 ALA 11 HB2 ALA 11 21.561 6.420 -13.245 76 HB3 ALA 11 HB3 ALA 11 20.468 6.482 -11.842 77 H GLN 12 H GLN 12 21.145 6.532 -9.314 78 HA GLN 12 HA GLN 12 20.930 9.223 -8.163 79 HB2 GLN 12 HB2 GLN 12 19.110 7.628 -7.955 80 HB3 GLN 12 HB3 GLN 12 20.153 6.487 -7.106 81 HG2 GLN 12 HG2 GLN 12 18.603 7.687 -5.604 82 HG3 GLN 12 HG3 GLN 12 20.294 7.864 -5.173 83 HE21 GLN 12 HE21 GLN 12 20.304 9.841 -4.130 84 HE22 GLN 12 HE22 GLN 12 19.723 11.329 -4.848 85 H GLU 13 H GLU 13 23.162 6.465 -7.735 86 HA GLU 13 HA GLU 13 24.402 7.510 -5.377 87 HB2 GLU 13 HB2 GLU 13 24.527 5.164 -6.145 88 HB3 GLU 13 HB3 GLU 13 25.504 5.643 -7.517 89 HG2 GLU 13 HG2 GLU 13 27.039 4.820 -5.949 90 HG3 GLU 13 HG3 GLU 13 27.212 6.562 -5.803 91 H ARG 14 H ARG 14 25.576 7.707 -8.681 92 HA ARG 14 HA ARG 14 27.735 9.306 -8.316 93 HB2 ARG 14 HB2 ARG 14 27.782 10.023 -10.601 94 HB3 ARG 14 HB3 ARG 14 27.411 8.313 -10.489 95 HG2 ARG 14 HG2 ARG 14 25.396 8.529 -11.491 96 HG3 ARG 14 HG3 ARG 14 24.988 10.051 -10.718 97 HD2 ARG 14 HD2 ARG 14 27.143 9.992 -12.837 98 HD3 ARG 14 HD3 ARG 14 25.452 9.868 -13.302 99 HE ARG 14 HE ARG 14 26.544 12.196 -11.695 100 HH11 ARG 14 HH11 ARG 14 24.412 11.136 -14.365 101 HH12 ARG 14 HH12 ARG 14 23.838 12.802 -14.516 102 HH21 ARG 14 HH21 ARG 14 25.669 14.161 -12.086 103 HH22 ARG 14 HH22 ARG 14 24.599 14.334 -13.501 104 H VAL 15 H VAL 15 24.517 10.538 -8.584 105 HA VAL 15 HA VAL 15 25.208 13.329 -8.622 106 HB VAL 15 HB VAL 15 22.957 13.903 -7.927 107 HG11 VAL 15 HG11 VAL 15 23.097 11.895 -10.209 108 HG12 VAL 15 HG12 VAL 15 21.863 13.148 -9.969 109 HG13 VAL 15 HG13 VAL 15 23.544 13.613 -10.286 110 HG21 VAL 15 HG21 VAL 15 22.355 10.938 -8.022 111 HG22 VAL 15 HG22 VAL 15 22.422 11.899 -6.526 112 HG23 VAL 15 HG23 VAL 15 21.198 12.252 -7.759 113 H ASP 16 H ASP 16 25.332 11.025 -6.034 114 HA ASP 16 HA ASP 16 25.164 13.039 -3.905 115 HB2 ASP 16 HB2 ASP 16 24.731 10.612 -3.562 116 HB3 ASP 16 HB3 ASP 16 26.438 10.282 -3.865 117 H LEU 17 H LEU 17 27.936 11.457 -5.569 118 HA LEU 17 HA LEU 17 29.932 12.648 -4.026 119 HB2 LEU 17 HB2 LEU 17 29.999 11.458 -6.839 120 HB3 LEU 17 HB3 LEU 17 31.426 11.991 -5.988 121 HG LEU 17 HG LEU 17 31.314 9.643 -5.843 122 HD11 LEU 17 HD11 LEU 17 32.129 10.855 -3.827 123 HD12 LEU 17 HD12 LEU 17 31.469 9.250 -3.469 124 HD13 LEU 17 HD13 LEU 17 30.510 10.695 -3.104 125 HD21 LEU 17 HD21 LEU 17 28.849 9.348 -6.123 126 HD22 LEU 17 HD22 LEU 17 28.648 9.769 -4.405 127 HD23 LEU 17 HD23 LEU 17 29.572 8.336 -4.865 128 H GLU 18 H GLU 18 28.732 13.622 -7.137 129 HA GLU 18 HA GLU 18 30.253 16.033 -7.486 130 HB2 GLU 18 HB2 GLU 18 28.462 16.708 -9.098 131 HB3 GLU 18 HB3 GLU 18 29.176 15.131 -9.393 132 HG2 GLU 18 HG2 GLU 18 27.163 14.161 -8.065 133 HG3 GLU 18 HG3 GLU 18 26.440 15.738 -8.258 134 H ALA 19 H ALA 19 27.163 15.479 -5.666 135 HA ALA 19 HA ALA 19 26.845 18.277 -5.003 136 HB1 ALA 19 HB1 ALA 19 25.015 16.607 -4.984 137 HB2 ALA 19 HB2 ALA 19 25.774 15.797 -3.601 138 HB3 ALA 19 HB3 ALA 19 25.174 17.460 -3.434 139 H VAL 20 H VAL 20 28.464 15.554 -3.285 140 HA VAL 20 HA VAL 20 29.344 17.109 -1.009 141 HB VAL 20 HB VAL 20 30.450 14.576 -2.274 142 HG11 VAL 20 HG11 VAL 20 31.216 15.883 0.375 143 HG12 VAL 20 HG12 VAL 20 31.644 14.229 -0.112 144 HG13 VAL 20 HG13 VAL 20 32.291 15.598 -1.014 145 HG21 VAL 20 HG21 VAL 20 29.380 13.475 -0.360 146 HG22 VAL 20 HG22 VAL 20 28.836 15.041 0.278 147 HG23 VAL 20 HG23 VAL 20 28.173 14.412 -1.240 148 H ARG 21 H ARG 21 31.021 16.412 -4.088 149 HA ARG 21 HA ARG 21 33.199 18.146 -3.632 150 HB2 ARG 21 HB2 ARG 21 33.166 16.523 -5.422 151 HB3 ARG 21 HB3 ARG 21 31.890 17.391 -6.267 152 HG2 ARG 21 HG2 ARG 21 34.252 19.110 -5.648 153 HG3 ARG 21 HG3 ARG 21 34.676 17.702 -6.605 154 HD2 ARG 21 HD2 ARG 21 32.369 19.548 -7.309 155 HD3 ARG 21 HD3 ARG 21 34.019 19.762 -7.936 156 HE ARG 21 HE ARG 21 33.710 17.221 -8.593 157 HH11 ARG 21 HH12 ARG 21 31.464 19.822 -9.388 158 HH12 ARG 21 HH11 ARG 21 30.662 18.844 -10.582 159 HH21 ARG 21 HH22 ARG 21 32.714 16.108 -10.133 160 HH22 ARG 21 HH21 ARG 21 31.412 16.789 -11.056 161 H LEU 22 H LEU 22 30.011 19.081 -4.959 162 HA LEU 22 HA LEU 22 30.640 21.881 -5.144 163 HB2 LEU 22 HB2 LEU 22 28.089 20.336 -5.268 164 HB3 LEU 22 HB3 LEU 22 28.024 22.018 -4.718 165 HG LEU 22 HG LEU 22 29.437 22.655 -6.752 166 HD11 LEU 22 HD11 LEU 22 28.476 19.937 -7.729 167 HD12 LEU 22 HD12 LEU 22 30.168 20.390 -7.414 168 HD13 LEU 22 HD13 LEU 22 29.254 21.194 -8.709 169 HD21 LEU 22 HD21 LEU 22 26.637 21.583 -7.144 170 HD22 LEU 22 HD22 LEU 22 27.477 22.784 -8.175 171 HD23 LEU 22 HD23 LEU 22 27.104 23.175 -6.481 172 H ALA 23 H ALA 23 29.480 19.954 -2.327 173 HA ALA 23 HA ALA 23 29.266 22.226 -0.629 174 HB1 ALA 23 HB1 ALA 23 28.606 19.826 -0.183 175 HB2 ALA 23 HB2 ALA 23 30.309 19.499 0.198 176 HB3 ALA 23 HB3 ALA 23 29.389 20.676 1.162 177 H SER 24 H SER 24 32.237 20.488 -1.663 178 HA SER 24 HA SER 24 34.006 22.262 -0.268 179 HB2 SER 24 HB2 SER 24 34.620 20.529 -2.688 180 HB3 SER 24 HB3 SER 24 35.788 21.356 -1.657 181 HG SER 24 HG SER 24 33.992 19.284 -0.890 182 H ILE 25 H ILE 25 32.671 22.470 -3.628 183 HA ILE 25 HA ILE 25 34.263 24.773 -4.257 184 HB ILE 25 HB ILE 25 31.576 24.315 -5.502 185 HG12 ILE 25 HG12 ILE 25 32.523 22.136 -5.748 186 HG13 ILE 25 HG13 ILE 25 32.679 22.957 -7.253 187 HG21 ILE 25 HG21 ILE 25 32.703 26.358 -6.142 188 HG22 ILE 25 HG22 ILE 25 34.234 25.507 -6.431 189 HG23 ILE 25 HG23 ILE 25 32.845 25.226 -7.482 190 HD11 ILE 25 HD11 ILE 25 34.583 21.545 -6.680 191 HD12 ILE 25 HD12 ILE 25 35.085 23.249 -6.877 192 HD13 ILE 25 HD13 ILE 25 34.918 22.513 -5.248 193 H VAL 26 H VAL 26 31.045 24.402 -2.723 194 HA VAL 26 HA VAL 26 30.427 27.216 -2.476 195 HB VAL 26 HB VAL 26 29.524 24.763 -0.941 196 HG11 VAL 26 HG11 VAL 26 29.070 26.572 0.515 197 HG12 VAL 26 HG12 VAL 26 28.579 27.634 -0.795 198 HG13 VAL 26 HG13 VAL 26 27.544 26.263 -0.323 199 HG21 VAL 26 HG21 VAL 26 28.856 24.794 -3.393 200 HG22 VAL 26 HG22 VAL 26 27.478 24.952 -2.323 201 HG23 VAL 26 HG23 VAL 26 28.148 26.388 -3.144 202 H ASP 27 H ASP 27 31.892 24.851 -0.047 203 HA ASP 27 HA ASP 27 32.614 26.733 1.885 204 HB2 ASP 27 HB2 ASP 27 33.070 24.389 2.189 205 HB3 ASP 27 HB3 ASP 27 34.170 24.360 0.808 206 H SER 28 H SER 28 34.442 26.051 -1.107 207 HA SER 28 HA SER 28 36.515 27.943 -0.727 208 HB2 SER 28 HB2 SER 28 35.349 27.133 -3.418 209 HB3 SER 28 HB3 SER 28 36.943 27.813 -3.101 210 HG SER 28 HG SER 28 35.948 25.285 -2.208 211 H ARG 29 H ARG 29 33.224 28.481 -1.874 212 HA ARG 29 HA ARG 29 33.631 31.345 -2.420 213 HB2 ARG 29 HB2 ARG 29 32.050 29.875 -3.682 214 HB3 ARG 29 HB3 ARG 29 31.062 29.704 -2.244 215 HG2 ARG 29 HG2 ARG 29 30.077 31.302 -3.709 216 HG3 ARG 29 HG3 ARG 29 30.629 32.144 -2.255 217 HD2 ARG 29 HD2 ARG 29 32.536 33.054 -3.486 218 HD3 ARG 29 HD3 ARG 29 32.146 32.026 -4.886 219 HE ARG 29 HE ARG 29 29.969 33.829 -4.057 220 HH11 ARG 29 HH11 ARG 29 32.892 33.755 -5.988 221 HH12 ARG 29 HH12 ARG 29 32.322 34.981 -7.083 222 HH21 ARG 29 HH21 ARG 29 29.203 35.288 -5.641 223 HH22 ARG 29 HH22 ARG 29 30.328 35.853 -6.837 224 H LEU 30 H LEU 30 32.276 29.410 0.319 225 HA LEU 30 HA LEU 30 31.424 31.749 1.785 226 HB2 LEU 30 HB2 LEU 30 32.289 29.037 2.843 227 HB3 LEU 30 HB3 LEU 30 31.450 30.298 3.755 228 HG LEU 30 HG LEU 30 30.334 28.739 1.402 229 HD11 LEU 30 HD11 LEU 30 30.390 27.521 3.607 230 HD12 LEU 30 HD12 LEU 30 28.757 27.851 3.020 231 HD13 LEU 30 HD13 LEU 30 29.443 28.860 4.302 232 HD21 LEU 30 HD21 LEU 30 29.079 31.012 2.982 233 HD22 LEU 30 HD22 LEU 30 28.186 29.891 1.935 234 HD23 LEU 30 HD23 LEU 30 29.394 30.956 1.223 235 H ILE 31 H ILE 31 34.566 30.074 1.665 236 HA ILE 31 HA ILE 31 35.937 31.957 3.414 237 HB ILE 31 HB ILE 31 36.901 29.972 1.316 238 HG12 ILE 31 HG12 ILE 31 37.055 29.812 4.366 239 HG13 ILE 31 HG13 ILE 31 35.731 29.114 3.444 240 HG21 ILE 31 HG21 ILE 31 39.169 30.226 2.332 241 HG22 ILE 31 HG22 ILE 31 38.633 31.707 1.570 242 HG23 ILE 31 HG23 ILE 31 38.557 31.553 3.340 243 HD11 ILE 31 HD11 ILE 31 38.642 28.269 3.237 244 HD12 ILE 31 HD12 ILE 31 37.296 27.373 3.948 245 HD13 ILE 31 HD13 ILE 31 37.321 27.670 2.200 246 H GLY 32 H GLY 32 35.261 31.841 -0.068 247 HA2 GLY 32 HA2 GLY 32 37.134 33.754 -0.985 248 HA3 GLY 32 HA3 GLY 32 35.665 33.164 -1.805 249 H THR 33 H THR 33 33.726 34.027 -0.030 250 HA THR 33 HA THR 33 33.931 36.920 0.249 251 HB THR 33 HB THR 33 33.503 36.656 -2.184 252 HG1 THR 33 HG1 THR 33 31.817 38.124 -2.252 253 HG21 THR 33 HG21 THR 33 32.031 34.592 -1.944 254 HG22 THR 33 HG22 THR 33 31.440 35.856 -3.048 255 HG23 THR 33 HG23 THR 33 30.721 35.685 -1.437 256 H GLY 34 H GLY 34 31.998 33.951 0.649 257 HA2 GLY 34 HA2 GLY 34 30.940 33.553 2.721 258 HA3 GLY 34 HA3 GLY 34 30.610 35.260 2.952 259 H SER 35 H SER 35 29.766 34.300 -0.182 260 HA SER 35 HA SER 35 27.206 33.084 0.333 261 HB2 SER 35 HB2 SER 35 25.846 34.896 -0.718 262 HB3 SER 35 HB3 SER 35 26.503 35.329 0.864 263 HG SER 35 HG SER 35 26.762 37.012 -0.661 264 H VAL 36 H VAL 36 26.354 31.995 -1.454 265 HA VAL 36 HA VAL 36 28.020 31.969 -3.906 266 HB VAL 36 HB VAL 36 25.814 30.219 -2.756 267 HG11 VAL 36 HG11 VAL 36 25.643 30.017 -5.167 268 HG12 VAL 36 HG12 VAL 36 27.412 29.936 -5.335 269 HG13 VAL 36 HG13 VAL 36 26.516 28.605 -4.571 270 HG21 VAL 36 HG21 VAL 36 28.056 30.021 -1.624 271 HG22 VAL 36 HG22 VAL 36 27.501 28.557 -2.449 272 HG23 VAL 36 HG23 VAL 36 28.750 29.555 -3.201 273 H ASP 37 H ASP 37 27.212 32.557 -5.935 274 HA ASP 37 HA ASP 37 24.355 33.269 -6.171 275 HB2 ASP 37 HB2 ASP 37 26.593 34.467 -7.815 276 HB3 ASP 37 HB3 ASP 37 24.932 35.017 -7.655 277 H GLU 38 H GLU 38 23.400 32.719 -8.219 278 HA GLU 38 HA GLU 38 23.925 30.244 -9.251 279 HB2 GLU 38 HB2 GLU 38 21.977 32.017 -9.678 280 HB3 GLU 38 HB3 GLU 38 22.905 32.403 -11.127 281 HG2 GLU 38 HG2 GLU 38 22.848 29.830 -11.584 282 HG3 GLU 38 HG3 GLU 38 21.626 29.778 -10.313 283 H ASP 39 H ASP 39 25.324 33.282 -10.542 284 HA ASP 39 HA ASP 39 26.626 32.208 -12.794 285 HB2 ASP 39 HB2 ASP 39 26.043 34.596 -12.360 286 HB3 ASP 39 HB3 ASP 39 27.243 34.646 -11.067 287 H PHE 40 H PHE 40 27.556 32.035 -9.407 288 HA PHE 40 HA PHE 40 30.359 31.357 -10.030 289 HB2 PHE 40 HB2 PHE 40 29.867 32.497 -7.938 290 HB3 PHE 40 HB3 PHE 40 28.714 31.251 -7.474 291 HD1 PHE 40 HD2 PHE 40 32.344 31.809 -8.226 292 HD2 PHE 40 HD1 PHE 40 29.399 29.289 -6.332 293 HE1 PHE 40 HE2 PHE 40 34.158 30.470 -7.177 294 HE2 PHE 40 HE1 PHE 40 31.206 27.955 -5.293 295 HZ PHE 40 HZ PHE 40 33.592 28.546 -5.708 296 H LEU 41 H LEU 41 27.283 29.571 -9.343 297 HA LEU 41 HA LEU 41 28.776 27.040 -9.247 298 HB2 LEU 41 HB2 LEU 41 25.916 27.907 -8.791 299 HB3 LEU 41 HB3 LEU 41 26.279 26.202 -8.978 300 HG LEU 41 HG LEU 41 27.296 28.062 -6.810 301 HD11 LEU 41 HD11 LEU 41 25.568 25.542 -6.796 302 HD12 LEU 41 HD12 LEU 41 24.993 27.210 -6.559 303 HD13 LEU 41 HD13 LEU 41 26.060 26.452 -5.360 304 HD21 LEU 41 HD21 LEU 41 29.175 26.608 -7.185 305 HD22 LEU 41 HD22 LEU 41 28.114 25.191 -7.388 306 HD23 LEU 41 HD23 LEU 41 28.309 25.964 -5.796 307 H ARG 42 H ARG 42 26.701 28.603 -11.665 308 HA ARG 42 HA ARG 42 26.310 26.376 -13.347 309 HB2 ARG 42 HB2 ARG 42 26.012 27.944 -15.175 310 HB3 ARG 42 HB3 ARG 42 25.286 28.557 -13.690 311 HG2 ARG 42 HG2 ARG 42 27.249 30.049 -13.339 312 HG3 ARG 42 HG3 ARG 42 27.995 29.413 -14.817 313 HD2 ARG 42 HD2 ARG 42 25.931 30.208 -16.093 314 HD3 ARG 42 HD3 ARG 42 25.436 31.035 -14.617 315 HE ARG 42 HE ARG 42 27.173 32.618 -14.890 316 HH11 ARG 42 HH21 ARG 42 27.630 30.184 -17.406 317 HH12 ARG 42 HH22 ARG 42 28.847 31.159 -18.182 318 HH21 ARG 42 HH11 ARG 42 28.611 33.692 -15.828 319 HH22 ARG 42 HH12 ARG 42 29.412 33.166 -17.314 320 H GLU 43 H GLU 43 29.351 28.156 -13.026 321 HA GLU 43 HA GLU 43 30.636 26.520 -15.104 322 HB2 GLU 43 HB2 GLU 43 32.641 27.835 -14.552 323 HB3 GLU 43 HB3 GLU 43 31.247 28.820 -14.996 324 HG2 GLU 43 HG2 GLU 43 30.875 29.517 -12.739 325 HG3 GLU 43 HG3 GLU 43 31.973 28.286 -12.115 326 H GLN 44 H GLN 44 29.669 25.475 -12.123 327 HA GLN 44 HA GLN 44 32.176 23.953 -11.571 328 HB2 GLN 44 HB2 GLN 44 30.162 25.100 -9.597 329 HB3 GLN 44 HB3 GLN 44 31.618 24.197 -9.194 330 HG2 GLN 44 HG2 GLN 44 31.534 26.887 -10.589 331 HG3 GLN 44 HG3 GLN 44 31.872 26.672 -8.897 332 HE21 GLN 44 HE21 GLN 44 33.579 27.922 -11.007 333 HE22 GLN 44 HE22 GLN 44 35.075 27.005 -10.908 334 H ILE 45 H ILE 45 28.834 23.662 -12.341 335 HA ILE 45 HA ILE 45 28.051 21.340 -10.975 336 HB ILE 45 HB ILE 45 26.911 20.853 -13.360 337 HG12 ILE 45 HG12 ILE 45 27.087 23.877 -13.509 338 HG13 ILE 45 HG13 ILE 45 28.227 22.865 -14.422 339 HG21 ILE 45 HG21 ILE 45 25.012 22.142 -12.569 340 HG22 ILE 45 HG22 ILE 45 25.843 21.370 -11.208 341 HG23 ILE 45 HG23 ILE 45 26.071 23.122 -11.519 342 HD11 ILE 45 HD11 ILE 45 26.377 23.537 -15.840 343 HD12 ILE 45 HD12 ILE 45 26.332 21.783 -15.589 344 HD13 ILE 45 HD13 ILE 45 25.196 22.844 -14.719 345 H ARG 46 H ARG 46 29.377 21.158 -14.403 346 HA ARG 46 HA ARG 46 30.692 19.932 -15.388 347 HB2 ARG 46 HB2 ARG 46 31.821 18.785 -12.813 348 HB3 ARG 46 HB3 ARG 46 32.570 18.731 -14.401 349 HG2 ARG 46 HG2 ARG 46 32.119 21.217 -12.707 350 HG3 ARG 46 HG3 ARG 46 33.646 20.392 -12.974 351 HD2 ARG 46 HD2 ARG 46 33.597 20.998 -15.368 352 HD3 ARG 46 HD3 ARG 46 32.004 21.726 -15.170 353 HE ARG 46 HE ARG 46 32.907 23.605 -14.170 354 HH11 ARG 46 HH11 ARG 46 35.544 21.301 -14.491 355 HH12 ARG 46 HH12 ARG 46 36.731 22.496 -14.051 356 HH21 ARG 46 HH21 ARG 46 34.388 25.001 -13.589 357 HH22 ARG 46 HH22 ARG 46 36.093 24.585 -13.563 358 H ASP 47 H ASP 47 28.539 18.386 -13.346 359 HA ASP 47 HA ASP 47 28.276 16.175 -15.368 360 HB2 ASP 47 HB2 ASP 47 28.013 15.790 -12.378 361 HB3 ASP 47 HB3 ASP 47 27.983 14.544 -13.622 362 H ALA 48 H ALA 48 26.655 18.303 -13.075 363 HA ALA 48 HA ALA 48 24.083 16.925 -13.367 364 HB1 ALA 48 HB1 ALA 48 23.422 18.325 -11.506 365 HB2 ALA 48 HB2 ALA 48 25.011 17.613 -11.148 366 HB3 ALA 48 HB3 ALA 48 24.900 19.304 -11.652 367 H ARG 49 H ARG 49 22.167 17.872 -14.028 368 HA ARG 49 HA ARG 49 22.168 20.105 -15.867 369 HB2 ARG 49 HB2 ARG 49 20.265 18.114 -14.883 370 HB3 ARG 49 HB3 ARG 49 19.546 19.676 -14.708 371 HG2 ARG 49 HG2 ARG 49 18.995 18.633 -16.857 372 HG3 ARG 49 HG3 ARG 49 19.784 20.196 -17.025 373 HD2 ARG 49 HD2 ARG 49 20.478 18.369 -18.659 374 HD3 ARG 49 HD3 ARG 49 21.788 19.233 -17.853 375 HE ARG 49 HE ARG 49 21.434 17.026 -16.215 376 HH11 ARG 49 HH11 ARG 49 22.146 17.322 -19.640 377 HH12 ARG 49 HH12 ARG 49 23.128 15.883 -19.633 378 HH21 ARG 49 HH21 ARG 49 22.688 15.303 -16.239 379 HH22 ARG 49 HH22 ARG 49 23.423 14.742 -17.731 380 H TYR 50 H TYR 50 20.883 19.844 -12.444 381 HA TYR 50 HA TYR 50 21.135 22.822 -12.296 382 HB2 TYR 50 HB2 TYR 50 19.115 21.082 -10.882 383 HB3 TYR 50 HB3 TYR 50 19.026 22.800 -11.203 384 HD1 TYR 50 HD2 TYR 50 19.473 23.006 -14.093 385 HD2 TYR 50 HD1 TYR 50 17.277 20.050 -11.881 386 HE1 TYR 50 HE2 TYR 50 18.084 22.543 -16.110 387 HE2 TYR 50 HE1 TYR 50 15.884 19.579 -13.889 388 HH TYR 50 HH TYR 50 15.480 20.095 -16.081 389 H ALA 51 H ALA 51 22.375 23.610 -10.625 390 HA ALA 51 HA ALA 51 22.839 21.868 -8.223 391 HB1 ALA 51 HB1 ALA 51 24.914 22.534 -9.273 392 HB2 ALA 51 HB2 ALA 51 24.421 24.244 -9.276 393 HB3 ALA 51 HB3 ALA 51 24.719 23.400 -7.740 394 H VAL 52 H VAL 52 22.350 22.744 -6.107 395 HA VAL 52 HA VAL 52 20.630 25.184 -6.092 396 HB VAL 52 HB VAL 52 19.786 22.432 -5.126 397 HG11 VAL 52 HG11 VAL 52 17.581 23.617 -4.656 398 HG12 VAL 52 HG12 VAL 52 18.893 24.026 -3.552 399 HG13 VAL 52 HG13 VAL 52 18.446 25.154 -4.849 400 HG21 VAL 52 HG21 VAL 52 19.496 22.566 -7.520 401 HG22 VAL 52 HG22 VAL 52 17.918 22.722 -6.758 402 HG23 VAL 52 HG23 VAL 52 18.736 24.167 -7.389 403 H ILE 53 H ILE 53 20.609 26.328 -4.272 404 HA ILE 53 HA ILE 53 22.563 25.549 -2.164 405 HB ILE 53 HB ILE 53 21.875 28.064 -3.610 406 HG12 ILE 53 HG12 ILE 53 23.807 26.584 -4.198 407 HG13 ILE 53 HG13 ILE 53 24.221 28.265 -3.886 408 HG21 ILE 53 HG21 ILE 53 23.154 29.472 -1.968 409 HG22 ILE 53 HG22 ILE 53 21.556 28.986 -1.420 410 HG23 ILE 53 HG23 ILE 53 22.994 28.158 -0.781 411 HD11 ILE 53 HD11 ILE 53 25.848 26.678 -2.888 412 HD12 ILE 53 HD12 ILE 53 25.085 27.705 -1.666 413 HD13 ILE 53 HD13 ILE 53 24.582 26.023 -1.829 414 H ARG 54 H ARG 54 22.019 25.272 -0.201 415 HA ARG 54 HA ARG 54 19.737 26.715 1.067 416 HB2 ARG 54 HB2 ARG 54 19.135 24.496 0.305 417 HB3 ARG 54 HB3 ARG 54 20.530 23.802 1.135 418 HG2 ARG 54 HG2 ARG 54 18.191 23.453 2.162 419 HG3 ARG 54 HG3 ARG 54 19.506 23.900 3.222 420 HD2 ARG 54 HD2 ARG 54 18.686 26.336 3.057 421 HD3 ARG 54 HD3 ARG 54 17.293 25.706 2.177 422 HE ARG 54 HE ARG 54 16.395 24.990 4.172 423 HH11 ARG 54 HH11 ARG 54 19.850 25.414 4.806 424 HH12 ARG 54 HH12 ARG 54 19.622 25.186 6.521 425 HH21 ARG 54 HH21 ARG 54 16.224 24.710 6.354 426 HH22 ARG 54 HH22 ARG 54 17.628 24.805 7.372 427 H ILE 55 H ILE 55 21.922 27.882 1.371 428 HA ILE 55 HA ILE 55 23.680 26.998 3.592 429 HB ILE 55 HB ILE 55 23.551 29.580 1.986 430 HG12 ILE 55 HG12 ILE 55 25.968 27.777 2.101 431 HG13 ILE 55 HG13 ILE 55 24.653 27.372 0.992 432 HG21 ILE 55 HG21 ILE 55 25.707 30.143 3.253 433 HG22 ILE 55 HG22 ILE 55 24.238 30.201 4.217 434 HG23 ILE 55 HG23 ILE 55 25.338 28.803 4.343 435 HD11 ILE 55 HD11 ILE 55 26.145 30.028 1.057 436 HD12 ILE 55 HD12 ILE 55 26.463 28.682 -0.043 437 HD13 ILE 55 HD13 ILE 55 24.908 29.544 -0.114 438 HA PRO 56 HA PRO 56 20.536 28.732 6.397 439 HB2 PRO 56 HB2 PRO 56 22.868 28.739 8.306 440 HB3 PRO 56 HB3 PRO 56 21.188 28.183 8.576 441 HG2 PRO 56 HG2 PRO 56 23.171 26.388 8.136 442 HG3 PRO 56 HG3 PRO 56 21.575 26.176 7.344 443 HD2 PRO 56 HD2 PRO 56 24.116 27.335 6.172 444 HD3 PRO 56 HD3 PRO 56 22.958 26.158 5.461 445 H GLY 57 H GLY 57 19.946 30.816 6.758 446 HA2 GLY 57 HA2 GLY 57 20.098 33.031 7.392 447 HA3 GLY 57 HA3 GLY 57 21.855 32.916 7.455 448 H GLN 58 H GLN 58 20.993 31.788 4.387 449 HA GLN 58 HA GLN 58 20.646 34.496 3.246 450 HB2 GLN 58 HB2 GLN 58 22.444 34.362 1.742 451 HB3 GLN 58 HB3 GLN 58 23.055 33.820 3.302 452 HG2 GLN 58 HG2 GLN 58 22.858 31.494 2.566 453 HG3 GLN 58 HG3 GLN 58 22.322 32.019 0.956 454 HE21 GLN 58 HE21 GLN 58 24.995 32.887 3.265 455 HE22 GLN 58 HE22 GLN 58 26.253 32.833 2.048 456 HA PRO 59 HA PRO 59 17.619 32.968 0.574 457 HB2 PRO 59 HB2 PRO 59 19.013 34.179 -1.808 458 HB3 PRO 59 HB3 PRO 59 17.323 34.393 -1.256 459 HG2 PRO 59 HG2 PRO 59 19.183 36.320 -0.811 460 HG3 PRO 59 HG3 PRO 59 18.000 35.888 0.470 461 HD2 PRO 59 HD2 PRO 59 20.892 34.983 0.213 462 HD3 PRO 59 HD3 PRO 59 19.992 35.580 1.634 463 H VAL 60 H VAL 60 17.051 31.172 -0.554 464 HA VAL 60 HA VAL 60 19.001 29.328 -1.619 465 HB VAL 60 HB VAL 60 17.053 28.317 -0.801 466 HG11 VAL 60 HG11 VAL 60 15.442 30.153 -0.846 467 HG12 VAL 60 HG12 VAL 60 15.384 30.090 -2.624 468 HG13 VAL 60 HG13 VAL 60 14.760 28.742 -1.651 469 HG21 VAL 60 HG21 VAL 60 17.848 27.338 -3.017 470 HG22 VAL 60 HG22 VAL 60 16.165 27.003 -2.603 471 HG23 VAL 60 HG23 VAL 60 16.549 28.242 -3.808 472 H VAL 61 H VAL 61 19.913 29.234 -3.468 473 HA VAL 61 HA VAL 61 18.654 30.479 -5.873 474 HB VAL 61 HB VAL 61 20.535 31.780 -5.077 475 HG11 VAL 61 HG11 VAL 61 22.269 29.361 -5.674 476 HG12 VAL 61 HG12 VAL 61 22.870 31.019 -5.458 477 HG13 VAL 61 HG13 VAL 61 22.050 30.224 -4.119 478 HG21 VAL 61 HG21 VAL 61 19.896 31.696 -7.500 479 HG22 VAL 61 HG22 VAL 61 21.584 32.122 -7.207 480 HG23 VAL 61 HG23 VAL 61 21.178 30.481 -7.755 481 H GLU 62 H GLU 62 18.908 29.428 -7.913 482 HA GLU 62 HA GLU 62 19.440 26.505 -7.766 483 HB2 GLU 62 HB2 GLU 62 16.906 27.907 -8.731 484 HB3 GLU 62 HB3 GLU 62 17.271 26.196 -8.972 485 HG2 GLU 62 HG2 GLU 62 17.157 25.757 -6.601 486 HG3 GLU 62 HG3 GLU 62 17.020 27.472 -6.213 487 H VAL 63 H VAL 63 20.784 26.031 -9.427 488 HA VAL 63 HA VAL 63 21.278 27.956 -11.584 489 HB VAL 63 HB VAL 63 22.627 25.377 -10.760 490 HG11 VAL 63 HG11 VAL 63 23.618 27.578 -12.579 491 HG12 VAL 63 HG12 VAL 63 24.630 26.280 -11.898 492 HG13 VAL 63 HG13 VAL 63 23.332 25.869 -13.016 493 HG21 VAL 63 HG21 VAL 63 23.619 28.170 -10.143 494 HG22 VAL 63 HG22 VAL 63 22.709 27.190 -8.968 495 HG23 VAL 63 HG23 VAL 63 24.235 26.606 -9.584 496 H GLY 64 H GLY 64 21.503 27.290 -13.857 497 HA2 GLY 64 HA2 GLY 64 20.953 26.144 -15.743 498 HA3 GLY 64 HA3 GLY 64 20.552 24.752 -14.746 499 H THR 65 H THR 65 18.332 24.547 -13.961 500 HA THR 65 HA THR 65 16.288 26.498 -14.633 501 HB THR 65 HB THR 65 16.134 23.785 -16.035 502 HG1 THR 65 HG1 THR 65 17.271 26.032 -16.754 503 HG21 THR 65 HG21 THR 65 14.154 24.790 -17.198 504 HG22 THR 65 HG22 THR 65 14.196 26.138 -16.040 505 HG23 THR 65 HG23 THR 65 13.875 24.472 -15.490 506 H LYS 66 H LYS 66 14.278 26.003 -13.487 507 HA LYS 66 HA LYS 66 14.700 24.443 -11.115 508 HB2 LYS 66 HB2 LYS 66 13.373 26.570 -11.252 509 HB3 LYS 66 HB3 LYS 66 12.086 25.674 -12.079 510 HG2 LYS 66 HG2 LYS 66 11.895 24.166 -10.093 511 HG3 LYS 66 HG3 LYS 66 13.211 25.057 -9.311 512 HD2 LYS 66 HD2 LYS 66 11.775 27.154 -9.447 513 HD3 LYS 66 HD3 LYS 66 10.476 26.143 -10.095 514 HE2 LYS 66 HE2 LYS 66 9.979 26.302 -7.802 515 HE3 LYS 66 HE3 LYS 66 10.697 24.699 -7.990 516 HZ1 LYS 66 HZ1 LYS 66 12.845 25.705 -7.192 517 HZ2 LYS 66 HZ2 LYS 66 11.644 25.842 -6.077 518 HZ3 LYS 66 HZ3 LYS 66 12.095 27.129 -6.979 519 HA PRO 67 HA PRO 67 13.396 20.622 -13.004 520 HB2 PRO 67 HB2 PRO 67 13.515 18.952 -10.842 521 HB3 PRO 67 HB3 PRO 67 14.957 19.584 -11.696 522 HG2 PRO 67 HG2 PRO 67 13.696 20.586 -9.142 523 HG3 PRO 67 HG3 PRO 67 15.436 20.350 -9.540 524 HD2 PRO 67 HD2 PRO 67 14.192 22.795 -9.693 525 HD3 PRO 67 HD3 PRO 67 15.546 22.317 -10.765 526 H THR 68 H THR 68 11.735 19.289 -13.206 527 HA THR 68 HA THR 68 9.202 20.228 -12.396 528 HB THR 68 HB THR 68 9.776 19.414 -14.638 529 HG1 THR 68 HG1 THR 68 7.633 19.550 -14.171 530 HG21 THR 68 HG21 THR 68 11.026 17.321 -13.965 531 HG22 THR 68 HG22 THR 68 9.799 17.085 -15.221 532 HG23 THR 68 HG23 THR 68 9.455 16.588 -13.557 533 H GLY 69 H GLY 69 10.973 17.487 -11.180 534 HA2 GLY 69 HA2 GLY 69 10.151 16.796 -8.838 535 HA3 GLY 69 HA3 GLY 69 8.601 16.487 -9.641 536 H ASP 70 H ASP 70 9.609 15.376 -12.051 537 HA ASP 70 HA ASP 70 10.429 12.680 -11.283 538 HB2 ASP 70 HB2 ASP 70 10.012 13.905 -14.014 539 HB3 ASP 70 HB3 ASP 70 10.180 12.180 -13.647 540 H VAL 71 H VAL 71 12.342 13.822 -10.217 541 HA VAL 71 HA VAL 71 14.716 13.832 -12.005 542 HB VAL 71 HB VAL 71 15.574 15.842 -10.885 543 HG11 VAL 71 HG11 VAL 71 14.196 15.884 -13.072 544 HG12 VAL 71 HG12 VAL 71 12.888 16.605 -12.110 545 HG13 VAL 71 HG13 VAL 71 14.459 17.401 -12.241 546 HG21 VAL 71 HG21 VAL 71 14.266 15.720 -8.780 547 HG22 VAL 71 HG22 VAL 71 14.214 17.299 -9.551 548 HG23 VAL 71 HG23 VAL 71 12.815 16.211 -9.675 549 H LEU 72 H LEU 72 16.732 13.679 -10.953 550 HA LEU 72 HA LEU 72 16.786 11.821 -8.605 551 HB2 LEU 72 HB2 LEU 72 18.844 12.644 -10.693 552 HB3 LEU 72 HB3 LEU 72 19.187 11.518 -9.388 553 HG LEU 72 HG LEU 72 16.964 11.072 -11.367 554 HD11 LEU 72 HD11 LEU 72 19.876 10.196 -11.638 555 HD12 LEU 72 HD12 LEU 72 19.010 11.334 -12.696 556 HD13 LEU 72 HD13 LEU 72 18.538 9.629 -12.668 557 HD21 LEU 72 HD21 LEU 72 18.684 9.186 -9.707 558 HD22 LEU 72 HD22 LEU 72 17.312 8.695 -10.734 559 HD23 LEU 72 HD23 LEU 72 17.036 9.691 -9.283 560 H GLN 73 H GLN 73 17.535 12.608 -6.617 561 HA GLN 73 HA GLN 73 18.739 15.323 -6.661 562 HB2 GLN 73 HB2 GLN 73 17.128 13.873 -4.546 563 HB3 GLN 73 HB3 GLN 73 17.838 15.486 -4.399 564 HG2 GLN 73 HG2 GLN 73 16.479 16.157 -6.451 565 HG3 GLN 73 HG3 GLN 73 15.609 14.634 -6.290 566 HE21 GLN 73 HE21 GLN 73 14.784 17.587 -5.913 567 HE22 GLN 73 HE22 GLN 73 14.028 17.578 -4.317 568 H GLY 74 H GLY 74 20.822 15.478 -6.277 569 HA2 GLY 74 HA2 GLY 74 22.322 13.584 -4.516 570 HA3 GLY 74 HA3 GLY 74 22.990 14.858 -5.556 571 H ARG 75 H ARG 75 23.550 14.543 -2.669 572 HA ARG 75 HA ARG 75 22.724 17.170 -1.691 573 HB2 ARG 75 HB2 ARG 75 21.578 14.644 -0.450 574 HB3 ARG 75 HB3 ARG 75 21.942 16.041 0.568 575 HG2 ARG 75 HG2 ARG 75 20.562 17.491 -0.895 576 HG3 ARG 75 HG3 ARG 75 20.076 16.054 -1.830 577 HD2 ARG 75 HD2 ARG 75 19.128 15.053 0.249 578 HD3 ARG 75 HD3 ARG 75 19.592 16.507 1.136 579 HE ARG 75 HE ARG 75 17.837 17.693 0.218 580 HH11 ARG 75 HH11 ARG 75 17.926 14.569 -1.422 581 HH12 ARG 75 HH12 ARG 75 16.397 14.895 -2.225 582 HH21 ARG 75 HH21 ARG 75 15.854 17.929 -0.821 583 HH22 ARG 75 HH22 ARG 75 15.322 16.667 -1.915 584 H ALA 76 H ALA 76 23.663 17.718 0.354 585 HA ALA 76 HA ALA 76 25.840 16.249 1.498 586 HB1 ALA 76 HB1 ALA 76 27.754 17.647 0.681 587 HB2 ALA 76 HB2 ALA 76 26.996 16.732 -0.625 588 HB3 ALA 76 HB3 ALA 76 26.651 18.458 -0.457 589 H THR 77 H THR 77 27.247 17.546 2.892 590 HA THR 77 HA THR 77 26.011 20.019 4.006 591 HB THR 77 HB THR 77 27.265 17.764 5.621 592 HG1 THR 77 HG1 THR 77 24.634 18.813 5.656 593 HG21 THR 77 HG21 THR 77 26.131 20.453 6.515 594 HG22 THR 77 HG22 THR 77 27.826 19.929 6.626 595 HG23 THR 77 HG23 THR 77 26.592 19.117 7.593 596 H GLY 78 H GLY 78 27.488 21.612 4.294 597 HA2 GLY 78 HA2 GLY 78 30.232 21.110 3.189 598 HA3 GLY 78 HA3 GLY 78 29.409 22.636 3.183 599 H GLU 79 H GLU 79 31.797 22.912 3.937 600 HA GLU 79 HA GLU 79 32.444 22.041 6.620 601 HB2 GLU 79 HB2 GLU 79 33.964 23.717 4.604 602 HB3 GLU 79 HB3 GLU 79 34.641 23.145 6.123 603 HG2 GLU 79 HG2 GLU 79 33.643 21.363 3.857 604 HG3 GLU 79 HG3 GLU 79 35.318 21.766 4.189 605 H GLU 80 H GLU 80 30.772 24.930 5.656 606 HA GLU 80 HA GLU 80 31.660 26.273 8.204 607 HB2 GLU 80 HB2 GLU 80 30.119 27.405 5.882 608 HB3 GLU 80 HB3 GLU 80 30.618 28.289 7.312 609 HG2 GLU 80 HG2 GLU 80 32.619 27.092 5.329 610 HG3 GLU 80 HG3 GLU 80 31.926 28.674 5.250 611 H GLY 81 H GLY 81 29.556 24.025 7.259 612 HA2 GLY 81 HA2 GLY 81 27.804 23.161 8.440 613 HA3 GLY 81 HA3 GLY 81 27.466 24.717 9.187 614 H GLU 82 H GLU 82 27.797 24.688 5.683 615 HA GLU 82 HA GLU 82 25.034 25.396 5.313 616 HB2 GLU 82 HB2 GLU 82 25.687 25.965 3.136 617 HB3 GLU 82 HB3 GLU 82 26.956 26.542 4.223 618 HG2 GLU 82 HG2 GLU 82 27.260 23.905 2.737 619 HG3 GLU 82 HG3 GLU 82 27.483 25.431 1.916 620 H THR 83 H THR 83 24.091 24.470 3.037 621 HA THR 83 HA THR 83 24.184 21.530 3.087 622 HB THR 83 HB THR 83 21.599 23.092 3.348 623 HG1 THR 83 HG1 THR 83 21.416 21.866 5.240 624 HG21 THR 83 HG21 THR 83 21.252 21.179 1.840 625 HG22 THR 83 HG22 THR 83 20.522 20.845 3.411 626 HG23 THR 83 HG23 THR 83 22.081 20.100 2.988 627 H VAL 84 H VAL 84 24.110 20.765 1.220 628 HA VAL 84 HA VAL 84 23.604 22.514 -1.216 629 HB VAL 84 HB VAL 84 25.803 20.475 -0.800 630 HG11 VAL 84 HG11 VAL 84 25.100 21.973 -3.366 631 HG12 VAL 84 HG12 VAL 84 26.575 21.021 -3.077 632 HG13 VAL 84 HG13 VAL 84 25.022 20.205 -3.123 633 HG21 VAL 84 HG21 VAL 84 26.313 22.660 0.142 634 HG22 VAL 84 HG22 VAL 84 27.220 22.480 -1.368 635 HG23 VAL 84 HG23 VAL 84 25.753 23.474 -1.337 636 H LEU 85 H LEU 85 22.603 21.726 -2.985 637 HA LEU 85 HA LEU 85 21.624 18.943 -2.998 638 HB2 LEU 85 HB2 LEU 85 19.823 20.145 -1.981 639 HB3 LEU 85 HB3 LEU 85 19.963 21.466 -3.117 640 HG LEU 85 HG LEU 85 19.079 19.993 -4.942 641 HD11 LEU 85 HD11 LEU 85 19.501 17.729 -4.293 642 HD12 LEU 85 HD12 LEU 85 17.776 17.930 -4.112 643 HD13 LEU 85 HD13 LEU 85 18.814 17.978 -2.669 644 HD21 LEU 85 HD21 LEU 85 16.791 19.992 -4.124 645 HD22 LEU 85 HD22 LEU 85 17.626 21.455 -3.587 646 HD23 LEU 85 HD23 LEU 85 17.362 20.118 -2.441 647 H VAL 86 H VAL 86 21.157 18.235 -5.029 648 HA VAL 86 HA VAL 86 21.930 19.805 -7.449 649 HB VAL 86 HB VAL 86 23.254 17.139 -6.763 650 HG11 VAL 86 HG11 VAL 86 24.435 17.426 -8.914 651 HG12 VAL 86 HG12 VAL 86 22.705 17.180 -9.147 652 HG13 VAL 86 HG13 VAL 86 23.382 18.820 -9.283 653 HG21 VAL 86 HG21 VAL 86 24.393 19.050 -5.675 654 HG22 VAL 86 HG22 VAL 86 25.372 18.421 -7.006 655 HG23 VAL 86 HG23 VAL 86 24.437 19.919 -7.226 656 H GLU 87 H GLU 87 20.760 19.147 -9.297 657 HA GLU 87 HA GLU 87 18.974 16.829 -8.932 658 HB2 GLU 87 HB2 GLU 87 17.899 19.568 -9.628 659 HB3 GLU 87 HB3 GLU 87 16.993 18.048 -9.553 660 HG2 GLU 87 HG2 GLU 87 17.792 17.861 -7.110 661 HG3 GLU 87 HG3 GLU 87 18.362 19.521 -7.258 662 H GLU 88 H GLU 88 18.587 15.691 -10.595 663 HA GLU 88 HA GLU 88 19.553 16.478 -13.338 664 HB2 GLU 88 HB2 GLU 88 20.052 14.060 -11.634 665 HB3 GLU 88 HB3 GLU 88 20.028 13.858 -13.386 666 HG2 GLU 88 HG2 GLU 88 21.870 15.814 -11.996 667 HG3 GLU 88 HG3 GLU 88 22.234 14.091 -12.196 668 HA PRO 89 HA PRO 89 15.539 14.862 -14.705 669 HB2 PRO 89 HB2 PRO 89 16.129 14.055 -17.265 670 HB3 PRO 89 HB3 PRO 89 15.911 15.766 -16.788 671 HG2 PRO 89 HG2 PRO 89 18.525 14.234 -17.052 672 HG3 PRO 89 HG3 PRO 89 18.110 15.843 -17.731 673 HD2 PRO 89 HD2 PRO 89 19.487 15.580 -15.426 674 HD3 PRO 89 HD3 PRO 89 18.245 16.862 -15.592 675 H ARG 90 H ARG 90 14.607 12.926 -14.359 676 HA ARG 90 HA ARG 90 16.248 10.571 -13.777 677 HB2 ARG 90 HB2 ARG 90 14.362 11.323 -12.329 678 HB3 ARG 90 HB3 ARG 90 13.234 10.939 -13.641 679 HG2 ARG 90 HG2 ARG 90 13.891 8.565 -13.541 680 HG3 ARG 90 HG3 ARG 90 15.096 8.933 -12.287 681 HD2 ARG 90 HD2 ARG 90 13.321 9.678 -10.764 682 HD3 ARG 90 HD3 ARG 90 12.099 9.416 -12.027 683 HE ARG 90 HE ARG 90 13.507 6.983 -11.657 684 HH11 ARG 90 HH21 ARG 90 11.246 8.948 -9.841 685 HH12 ARG 90 HH22 ARG 90 10.584 7.576 -8.997 686 HH21 ARG 90 HH12 ARG 90 12.616 5.274 -10.554 687 HH22 ARG 90 HH11 ARG 90 11.345 5.546 -9.398 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 5.296 -7.973 -14.767 2 H2 GLY 1 H2 GLY 1 6.437 -9.007 -15.323 3 H3 GLY 1 H3 GLY 1 6.606 -7.397 -15.564 4 HA2 GLY 1 HA2 GLY 1 6.664 -8.754 -12.944 5 HA3 GLY 1 HA3 GLY 1 8.085 -8.139 -13.808 6 H SER 2 H SER 2 7.182 -7.384 -11.128 7 HA SER 2 HA SER 2 5.924 -4.774 -11.217 8 HB2 SER 2 HB2 SER 2 7.403 -6.179 -8.964 9 HB3 SER 2 HB3 SER 2 6.301 -4.797 -8.814 10 HG SER 2 HG SER 2 5.264 -6.795 -8.358 11 H GLU 3 H GLU 3 6.904 -2.853 -10.163 12 HA GLU 3 HA GLU 3 9.439 -2.129 -11.343 13 HB2 GLU 3 HB2 GLU 3 9.083 0.025 -10.366 14 HB3 GLU 3 HB3 GLU 3 7.613 -0.531 -11.136 15 HG2 GLU 3 HG2 GLU 3 8.050 -0.771 -8.127 16 HG3 GLU 3 HG3 GLU 3 7.455 0.699 -8.879 17 H THR 4 H THR 4 11.029 -0.756 -9.826 18 HA THR 4 HA THR 4 12.490 -2.789 -8.421 19 HB THR 4 HB THR 4 14.046 -0.827 -7.876 20 HG1 THR 4 HG1 THR 4 12.653 0.898 -8.068 21 HG21 THR 4 HG21 THR 4 14.395 -2.314 -9.814 22 HG22 THR 4 HG22 THR 4 14.848 -0.641 -10.183 23 HG23 THR 4 HG23 THR 4 13.315 -1.301 -10.798 24 H ARG 5 H ARG 5 13.322 -2.703 -6.341 25 HA ARG 5 HA ARG 5 11.534 -1.519 -4.214 26 HB2 ARG 5 HB2 ARG 5 12.488 -4.358 -4.533 27 HB3 ARG 5 HB3 ARG 5 12.504 -3.676 -2.914 28 HG2 ARG 5 HG2 ARG 5 10.430 -4.799 -3.171 29 HG3 ARG 5 HG3 ARG 5 10.118 -3.064 -3.101 30 HD2 ARG 5 HD2 ARG 5 9.927 -3.060 -5.605 31 HD3 ARG 5 HD3 ARG 5 10.099 -4.824 -5.594 32 HE ARG 5 HE ARG 5 8.024 -4.405 -3.848 33 HH11 ARG 5 HH11 ARG 5 8.502 -3.367 -7.167 34 HH12 ARG 5 HH12 ARG 5 6.809 -2.974 -7.388 35 HH21 ARG 5 HH21 ARG 5 5.844 -4.009 -4.256 36 HH22 ARG 5 HH22 ARG 5 5.357 -3.445 -5.830 37 H THR 6 H THR 6 14.806 -2.126 -5.239 38 HA THR 6 HA THR 6 15.930 -0.853 -2.804 39 HB THR 6 HB THR 6 16.887 -2.960 -3.712 40 HG1 THR 6 HG1 THR 6 18.961 -2.277 -3.348 41 HG21 THR 6 HG21 THR 6 18.031 -1.185 -5.920 42 HG22 THR 6 HG22 THR 6 16.815 -2.460 -6.156 43 HG23 THR 6 HG23 THR 6 18.437 -2.881 -5.594 44 H ILE 7 H ILE 7 18.077 0.437 -3.695 45 HA ILE 7 HA ILE 7 17.080 2.773 -5.269 46 HB ILE 7 HB ILE 7 19.194 2.852 -3.077 47 HG12 ILE 7 HG12 ILE 7 17.421 4.266 -1.869 48 HG13 ILE 7 HG13 ILE 7 16.216 3.466 -2.865 49 HG21 ILE 7 HG21 ILE 7 19.401 4.616 -4.787 50 HG22 ILE 7 HG22 ILE 7 17.686 5.051 -4.570 51 HG23 ILE 7 HG23 ILE 7 18.864 5.306 -3.265 52 HD11 ILE 7 HD11 ILE 7 16.578 2.580 -0.513 53 HD12 ILE 7 HD12 ILE 7 16.741 1.334 -1.744 54 HD13 ILE 7 HD13 ILE 7 18.194 2.047 -1.003 55 H SER 8 H SER 8 18.396 3.348 -7.018 56 HA SER 8 HA SER 8 20.356 1.706 -8.117 57 HB2 SER 8 HB2 SER 8 19.293 3.497 -9.376 58 HB3 SER 8 HB3 SER 8 20.047 4.718 -8.346 59 HG SER 8 HG SER 8 21.124 3.226 -10.416 60 H SER 9 H SER 9 22.616 1.735 -8.257 61 HA SER 9 HA SER 9 24.083 3.006 -5.999 62 HB2 SER 9 HB2 SER 9 24.998 0.529 -7.454 63 HB3 SER 9 HB3 SER 9 25.617 1.192 -5.945 64 HG SER 9 HG SER 9 23.561 0.678 -4.990 65 H THR 10 H THR 10 23.540 3.267 -9.160 66 HA THR 10 HA THR 10 26.215 4.441 -9.784 67 HB THR 10 HB THR 10 25.534 4.120 -12.166 68 HG1 THR 10 HG1 THR 10 23.850 2.607 -12.504 69 HG21 THR 10 HG21 THR 10 25.977 1.715 -12.211 70 HG22 THR 10 HG22 THR 10 25.525 1.568 -10.496 71 HG23 THR 10 HG23 THR 10 26.980 2.478 -10.961 72 H ALA 11 H ALA 11 22.883 4.985 -11.023 73 HA ALA 11 HA ALA 11 23.571 7.685 -11.752 74 HB1 ALA 11 HB1 ALA 11 21.958 6.277 -12.978 75 HB2 ALA 11 HB2 ALA 11 20.857 6.294 -11.580 76 HB3 ALA 11 HB3 ALA 11 21.207 7.798 -12.461 77 H GLN 12 H GLN 12 21.778 6.348 -8.983 78 HA GLN 12 HA GLN 12 21.271 9.058 -7.886 79 HB2 GLN 12 HB2 GLN 12 19.558 7.308 -7.795 80 HB3 GLN 12 HB3 GLN 12 20.614 6.305 -6.804 81 HG2 GLN 12 HG2 GLN 12 18.812 7.445 -5.533 82 HG3 GLN 12 HG3 GLN 12 20.424 7.792 -4.932 83 HE21 GLN 12 HE21 GLN 12 21.288 9.938 -5.217 84 HE22 GLN 12 HE22 GLN 12 20.139 11.271 -5.346 85 H GLU 13 H GLU 13 23.752 6.581 -7.565 86 HA GLU 13 HA GLU 13 24.866 7.693 -5.125 87 HB2 GLU 13 HB2 GLU 13 25.072 5.323 -5.836 88 HB3 GLU 13 HB3 GLU 13 26.066 5.817 -7.198 89 HG2 GLU 13 HG2 GLU 13 27.572 5.056 -5.565 90 HG3 GLU 13 HG3 GLU 13 27.708 6.805 -5.487 91 H ARG 14 H ARG 14 25.956 7.867 -8.506 92 HA ARG 14 HA ARG 14 28.148 9.497 -8.050 93 HB2 ARG 14 HB2 ARG 14 28.278 10.075 -10.373 94 HB3 ARG 14 HB3 ARG 14 27.983 8.362 -10.151 95 HG2 ARG 14 HG2 ARG 14 26.064 8.390 -11.325 96 HG3 ARG 14 HG3 ARG 14 25.478 9.896 -10.614 97 HD2 ARG 14 HD2 ARG 14 27.743 9.939 -12.619 98 HD3 ARG 14 HD3 ARG 14 26.086 9.738 -13.167 99 HE ARG 14 HE ARG 14 27.125 12.120 -11.644 100 HH11 ARG 14 HH11 ARG 14 24.398 10.793 -13.484 101 HH12 ARG 14 HH12 ARG 14 23.631 12.371 -13.480 102 HH21 ARG 14 HH22 ARG 14 26.171 13.997 -11.940 103 HH22 ARG 14 HH21 ARG 14 24.566 14.048 -12.701 104 H VAL 15 H VAL 15 24.866 10.631 -8.608 105 HA VAL 15 HA VAL 15 25.447 13.431 -8.663 106 HB VAL 15 HB VAL 15 23.137 13.843 -7.970 107 HG11 VAL 15 HG11 VAL 15 23.682 13.560 -10.319 108 HG12 VAL 15 HG12 VAL 15 23.444 11.801 -10.201 109 HG13 VAL 15 HG13 VAL 15 22.077 12.906 -9.969 110 HG21 VAL 15 HG21 VAL 15 22.759 11.886 -6.485 111 HG22 VAL 15 HG22 VAL 15 21.530 12.025 -7.751 112 HG23 VAL 15 HG23 VAL 15 22.821 10.822 -7.906 113 H ASP 16 H ASP 16 25.542 11.196 -5.963 114 HA ASP 16 HA ASP 16 25.232 13.261 -3.898 115 HB2 ASP 16 HB2 ASP 16 24.794 10.765 -3.639 116 HB3 ASP 16 HB3 ASP 16 26.542 10.526 -3.680 117 H LEU 17 H LEU 17 27.963 11.704 -5.567 118 HA LEU 17 HA LEU 17 30.055 12.744 -3.981 119 HB2 LEU 17 HB2 LEU 17 30.168 11.717 -6.814 120 HB3 LEU 17 HB3 LEU 17 31.504 11.969 -5.698 121 HG LEU 17 HG LEU 17 29.320 9.864 -5.594 122 HD11 LEU 17 HD11 LEU 17 31.300 8.411 -5.385 123 HD12 LEU 17 HD12 LEU 17 32.331 9.863 -5.265 124 HD13 LEU 17 HD13 LEU 17 31.471 9.500 -6.783 125 HD21 LEU 17 HD21 LEU 17 29.358 10.648 -3.264 126 HD22 LEU 17 HD22 LEU 17 31.137 10.617 -3.254 127 HD23 LEU 17 HD23 LEU 17 30.203 9.110 -3.387 128 H GLU 18 H GLU 18 28.770 13.847 -7.080 129 HA GLU 18 HA GLU 18 30.339 16.267 -7.257 130 HB2 GLU 18 HB2 GLU 18 28.617 16.991 -8.929 131 HB3 GLU 18 HB3 GLU 18 29.438 15.483 -9.273 132 HG2 GLU 18 HG2 GLU 18 27.323 14.393 -8.076 133 HG3 GLU 18 HG3 GLU 18 26.570 15.901 -8.481 134 H ALA 19 H ALA 19 27.171 15.567 -5.609 135 HA ALA 19 HA ALA 19 26.720 18.316 -4.883 136 HB1 ALA 19 HB1 ALA 19 25.872 15.792 -3.437 137 HB2 ALA 19 HB2 ALA 19 25.149 17.411 -3.314 138 HB3 ALA 19 HB3 ALA 19 25.054 16.502 -4.842 139 H VAL 20 H VAL 20 28.671 15.733 -3.323 140 HA VAL 20 HA VAL 20 29.543 17.391 -1.075 141 HB VAL 20 HB VAL 20 30.660 14.829 -2.261 142 HG11 VAL 20 HG11 VAL 20 31.938 14.612 -0.130 143 HG12 VAL 20 HG12 VAL 20 32.526 15.942 -1.124 144 HG13 VAL 20 HG13 VAL 20 31.497 16.282 0.289 145 HG21 VAL 20 HG21 VAL 20 28.432 14.660 -1.135 146 HG22 VAL 20 HG22 VAL 20 29.693 13.804 -0.250 147 HG23 VAL 20 HG23 VAL 20 29.130 15.388 0.323 148 H ARG 21 H ARG 21 30.998 16.739 -4.297 149 HA ARG 21 HA ARG 21 33.235 18.425 -3.987 150 HB2 ARG 21 HB2 ARG 21 32.840 16.872 -5.894 151 HB3 ARG 21 HB3 ARG 21 31.597 17.952 -6.516 152 HG2 ARG 21 HG2 ARG 21 33.748 18.173 -7.697 153 HG3 ARG 21 HG3 ARG 21 33.180 19.682 -6.992 154 HD2 ARG 21 HD2 ARG 21 35.618 19.387 -6.749 155 HD3 ARG 21 HD3 ARG 21 34.802 19.534 -5.186 156 HE ARG 21 HE ARG 21 35.110 16.757 -5.992 157 HH11 ARG 21 HH11 ARG 21 37.018 19.378 -4.663 158 HH12 ARG 21 HH12 ARG 21 38.090 18.295 -3.821 159 HH21 ARG 21 HH21 ARG 21 36.511 15.427 -4.886 160 HH22 ARG 21 HH22 ARG 21 37.817 16.113 -3.967 161 H LEU 22 H LEU 22 29.922 19.394 -5.052 162 HA LEU 22 HA LEU 22 30.552 22.227 -5.084 163 HB2 LEU 22 HB2 LEU 22 28.002 20.649 -5.213 164 HB3 LEU 22 HB3 LEU 22 27.987 22.368 -4.774 165 HG LEU 22 HG LEU 22 29.394 22.853 -6.831 166 HD11 LEU 22 HD11 LEU 22 30.166 20.576 -7.403 167 HD12 LEU 22 HD12 LEU 22 29.203 21.273 -8.714 168 HD13 LEU 22 HD13 LEU 22 28.477 20.063 -7.642 169 HD21 LEU 22 HD21 LEU 22 26.625 21.702 -7.226 170 HD22 LEU 22 HD22 LEU 22 27.447 22.921 -8.249 171 HD23 LEU 22 HD23 LEU 22 27.018 23.310 -6.569 172 H ALA 23 H ALA 23 29.357 20.139 -2.375 173 HA ALA 23 HA ALA 23 29.140 22.299 -0.529 174 HB1 ALA 23 HB1 ALA 23 30.130 19.463 -0.026 175 HB2 ALA 23 HB2 ALA 23 29.436 20.578 1.169 176 HB3 ALA 23 HB3 ALA 23 28.427 19.951 -0.147 177 H SER 24 H SER 24 32.028 20.570 -1.637 178 HA SER 24 HA SER 24 33.905 22.171 -0.193 179 HB2 SER 24 HB2 SER 24 34.513 20.715 -2.782 180 HB3 SER 24 HB3 SER 24 35.611 21.171 -1.486 181 HG SER 24 HG SER 24 33.495 19.251 -1.327 182 H ILE 25 H ILE 25 32.561 22.656 -3.579 183 HA ILE 25 HA ILE 25 34.281 24.919 -3.996 184 HB ILE 25 HB ILE 25 31.626 24.568 -5.389 185 HG12 ILE 25 HG12 ILE 25 32.467 22.430 -5.811 186 HG13 ILE 25 HG13 ILE 25 32.882 23.351 -7.187 187 HG21 ILE 25 HG21 ILE 25 32.987 25.618 -7.252 188 HG22 ILE 25 HG22 ILE 25 32.728 26.647 -5.858 189 HG23 ILE 25 HG23 ILE 25 34.302 25.850 -6.104 190 HD11 ILE 25 HD11 ILE 25 34.767 22.444 -4.987 191 HD12 ILE 25 HD12 ILE 25 34.672 21.863 -6.646 192 HD13 ILE 25 HD13 ILE 25 35.249 23.518 -6.333 193 H VAL 26 H VAL 26 31.040 24.576 -2.582 194 HA VAL 26 HA VAL 26 30.448 27.418 -2.351 195 HB VAL 26 HB VAL 26 29.414 25.002 -0.843 196 HG11 VAL 26 HG11 VAL 26 27.500 26.479 -0.236 197 HG12 VAL 26 HG12 VAL 26 29.009 27.014 0.486 198 HG13 VAL 26 HG13 VAL 26 28.371 27.868 -0.933 199 HG21 VAL 26 HG21 VAL 26 27.955 26.609 -2.994 200 HG22 VAL 26 HG22 VAL 26 28.908 25.184 -3.412 201 HG23 VAL 26 HG23 VAL 26 27.539 25.007 -2.334 202 H ASP 27 H ASP 27 31.747 24.952 0.093 203 HA ASP 27 HA ASP 27 32.433 26.804 2.076 204 HB2 ASP 27 HB2 ASP 27 32.730 24.443 2.419 205 HB3 ASP 27 HB3 ASP 27 33.902 24.334 1.101 206 H SER 28 H SER 28 34.368 26.018 -0.833 207 HA SER 28 HA SER 28 36.563 27.750 -0.297 208 HB2 SER 28 HB2 SER 28 35.464 27.001 -3.038 209 HB3 SER 28 HB3 SER 28 37.075 27.626 -2.673 210 HG SER 28 HG SER 28 35.951 25.140 -1.831 211 H ARG 29 H ARG 29 33.400 28.468 -1.741 212 HA ARG 29 HA ARG 29 33.990 31.293 -2.261 213 HB2 ARG 29 HB2 ARG 29 32.393 29.891 -3.587 214 HB3 ARG 29 HB3 ARG 29 31.355 29.753 -2.181 215 HG2 ARG 29 HG2 ARG 29 30.448 31.388 -3.614 216 HG3 ARG 29 HG3 ARG 29 31.035 32.214 -2.172 217 HD2 ARG 29 HD2 ARG 29 32.968 33.054 -3.412 218 HD3 ARG 29 HD3 ARG 29 32.529 32.053 -4.817 219 HE ARG 29 HE ARG 29 30.400 33.887 -3.969 220 HH11 ARG 29 HH11 ARG 29 33.358 33.865 -5.834 221 HH12 ARG 29 HH12 ARG 29 32.817 35.131 -6.898 222 HH21 ARG 29 HH21 ARG 29 29.632 35.299 -5.575 223 HH22 ARG 29 HH22 ARG 29 30.787 35.963 -6.692 224 H LEU 30 H LEU 30 32.391 29.497 0.430 225 HA LEU 30 HA LEU 30 31.578 31.876 1.823 226 HB2 LEU 30 HB2 LEU 30 32.185 29.112 2.930 227 HB3 LEU 30 HB3 LEU 30 31.391 30.429 3.798 228 HG LEU 30 HG LEU 30 30.284 29.024 1.348 229 HD11 LEU 30 HD11 LEU 30 28.615 28.079 2.816 230 HD12 LEU 30 HD12 LEU 30 29.219 29.012 4.188 231 HD13 LEU 30 HD13 LEU 30 30.180 27.670 3.525 232 HD21 LEU 30 HD21 LEU 30 29.498 31.301 1.293 233 HD22 LEU 30 HD22 LEU 30 29.096 31.250 3.033 234 HD23 LEU 30 HD23 LEU 30 28.190 30.269 1.861 235 H ILE 31 H ILE 31 34.633 30.068 1.824 236 HA ILE 31 HA ILE 31 35.984 31.848 3.711 237 HB ILE 31 HB ILE 31 36.961 29.806 1.677 238 HG12 ILE 31 HG12 ILE 31 36.868 29.646 4.728 239 HG13 ILE 31 HG13 ILE 31 35.590 29.020 3.702 240 HG21 ILE 31 HG21 ILE 31 39.163 29.911 2.846 241 HG22 ILE 31 HG22 ILE 31 38.779 31.429 2.063 242 HG23 ILE 31 HG23 ILE 31 38.571 31.271 3.822 243 HD11 ILE 31 HD11 ILE 31 37.203 27.491 2.587 244 HD12 ILE 31 HD12 ILE 31 38.452 28.007 3.751 245 HD13 ILE 31 HD13 ILE 31 36.993 27.190 4.321 246 H GLY 32 H GLY 32 35.547 31.776 0.177 247 HA2 GLY 32 HA2 GLY 32 37.613 33.595 -0.552 248 HA3 GLY 32 HA3 GLY 32 36.214 33.069 -1.516 249 H THR 33 H THR 33 34.156 34.025 0.046 250 HA THR 33 HA THR 33 34.496 36.923 0.372 251 HB THR 33 HB THR 33 34.193 36.687 -2.067 252 HG1 THR 33 HG1 THR 33 32.589 38.225 -2.234 253 HG21 THR 33 HG21 THR 33 32.160 35.983 -3.070 254 HG22 THR 33 HG22 THR 33 31.337 35.810 -1.509 255 HG23 THR 33 HG23 THR 33 32.643 34.684 -1.960 256 H GLY 34 H GLY 34 32.380 34.088 0.607 257 HA2 GLY 34 HA2 GLY 34 31.239 33.700 2.664 258 HA3 GLY 34 HA3 GLY 34 31.041 35.417 2.953 259 H SER 35 H SER 35 30.117 34.528 -0.254 260 HA SER 35 HA SER 35 27.567 33.345 0.301 261 HB2 SER 35 HB2 SER 35 27.755 36.187 -0.791 262 HB3 SER 35 HB3 SER 35 26.323 35.157 -0.982 263 HG SER 35 HG SER 35 27.388 35.403 1.585 264 H VAL 36 H VAL 36 26.642 32.410 -1.577 265 HA VAL 36 HA VAL 36 28.468 32.312 -3.965 266 HB VAL 36 HB VAL 36 28.491 30.261 -2.539 267 HG11 VAL 36 HG11 VAL 36 25.672 29.786 -3.581 268 HG12 VAL 36 HG12 VAL 36 26.653 28.729 -2.545 269 HG13 VAL 36 HG13 VAL 36 26.053 30.280 -1.922 270 HG21 VAL 36 HG21 VAL 36 27.368 29.867 -5.333 271 HG22 VAL 36 HG22 VAL 36 29.064 30.230 -4.964 272 HG23 VAL 36 HG23 VAL 36 28.351 28.715 -4.400 273 H ASP 37 H ASP 37 27.552 32.391 -6.027 274 HA ASP 37 HA ASP 37 24.699 33.100 -6.182 275 HB2 ASP 37 HB2 ASP 37 26.934 34.327 -7.811 276 HB3 ASP 37 HB3 ASP 37 25.289 34.906 -7.597 277 H GLU 38 H GLU 38 23.744 32.717 -8.278 278 HA GLU 38 HA GLU 38 24.056 30.247 -9.309 279 HB2 GLU 38 HB2 GLU 38 22.291 32.176 -9.720 280 HB3 GLU 38 HB3 GLU 38 23.246 32.507 -11.167 281 HG2 GLU 38 HG2 GLU 38 22.957 29.966 -11.672 282 HG3 GLU 38 HG3 GLU 38 21.742 29.994 -10.393 283 H ASP 39 H ASP 39 25.791 33.094 -10.566 284 HA ASP 39 HA ASP 39 26.968 31.716 -12.808 285 HB2 ASP 39 HB2 ASP 39 27.822 34.333 -11.546 286 HB3 ASP 39 HB3 ASP 39 28.235 33.753 -13.161 287 H PHE 40 H PHE 40 27.864 31.722 -9.437 288 HA PHE 40 HA PHE 40 30.625 30.858 -10.080 289 HB2 PHE 40 HB2 PHE 40 29.916 32.334 -8.079 290 HB3 PHE 40 HB3 PHE 40 29.286 30.858 -7.360 291 HD1 PHE 40 HD1 PHE 40 32.339 32.531 -8.704 292 HD2 PHE 40 HD2 PHE 40 30.837 29.262 -6.323 293 HE1 PHE 40 HE1 PHE 40 34.644 32.048 -7.913 294 HE2 PHE 40 HE2 PHE 40 33.147 28.802 -5.519 295 HZ PHE 40 HZ PHE 40 35.046 30.184 -6.315 296 H LEU 41 H LEU 41 27.493 29.430 -9.683 297 HA LEU 41 HA LEU 41 28.574 26.714 -9.069 298 HB2 LEU 41 HB2 LEU 41 25.808 27.958 -9.043 299 HB3 LEU 41 HB3 LEU 41 26.065 26.239 -8.760 300 HG LEU 41 HG LEU 41 27.156 28.512 -7.057 301 HD11 LEU 41 HD11 LEU 41 25.030 26.406 -6.480 302 HD12 LEU 41 HD12 LEU 41 24.721 28.122 -6.843 303 HD13 LEU 41 HD13 LEU 41 25.588 27.675 -5.366 304 HD21 LEU 41 HD21 LEU 41 28.762 26.708 -6.880 305 HD22 LEU 41 HD22 LEU 41 27.469 25.494 -6.777 306 HD23 LEU 41 HD23 LEU 41 27.743 26.626 -5.445 307 H ARG 42 H ARG 42 26.765 28.364 -11.726 308 HA ARG 42 HA ARG 42 26.373 26.021 -13.272 309 HB2 ARG 42 HB2 ARG 42 26.044 27.428 -15.144 310 HB3 ARG 42 HB3 ARG 42 25.386 28.201 -13.710 311 HG2 ARG 42 HG2 ARG 42 27.350 29.730 -13.631 312 HG3 ARG 42 HG3 ARG 42 28.083 28.860 -14.973 313 HD2 ARG 42 HD2 ARG 42 27.226 30.591 -16.113 314 HD3 ARG 42 HD3 ARG 42 25.899 29.466 -16.304 315 HE ARG 42 HE ARG 42 25.948 32.009 -14.807 316 HH11 ARG 42 HH11 ARG 42 23.896 29.139 -15.320 317 HH12 ARG 42 HH12 ARG 42 22.575 29.996 -14.503 318 HH21 ARG 42 HH21 ARG 42 24.213 32.875 -14.014 319 HH22 ARG 42 HH22 ARG 42 22.695 31.927 -13.907 320 H GLU 43 H GLU 43 29.376 27.661 -12.718 321 HA GLU 43 HA GLU 43 30.866 26.267 -14.817 322 HB2 GLU 43 HB2 GLU 43 31.971 27.756 -12.410 323 HB3 GLU 43 HB3 GLU 43 32.790 27.369 -13.931 324 HG2 GLU 43 HG2 GLU 43 30.882 28.778 -15.024 325 HG3 GLU 43 HG3 GLU 43 30.634 29.416 -13.395 326 H GLN 44 H GLN 44 29.539 24.996 -12.032 327 HA GLN 44 HA GLN 44 31.933 23.342 -11.338 328 HB2 GLN 44 HB2 GLN 44 29.631 23.952 -9.481 329 HB3 GLN 44 HB3 GLN 44 31.225 23.307 -9.086 330 HG2 GLN 44 HG2 GLN 44 30.544 26.098 -10.029 331 HG3 GLN 44 HG3 GLN 44 30.996 25.653 -8.399 332 HE21 GLN 44 HE21 GLN 44 32.229 27.676 -9.775 333 HE22 GLN 44 HE22 GLN 44 33.911 27.237 -10.112 334 H ILE 45 H ILE 45 28.535 23.260 -12.254 335 HA ILE 45 HA ILE 45 27.718 20.752 -11.369 336 HB ILE 45 HB ILE 45 26.571 20.671 -13.791 337 HG12 ILE 45 HG12 ILE 45 26.779 23.675 -13.488 338 HG13 ILE 45 HG13 ILE 45 27.908 22.791 -14.539 339 HG21 ILE 45 HG21 ILE 45 24.691 21.844 -12.814 340 HG22 ILE 45 HG22 ILE 45 25.504 20.855 -11.590 341 HG23 ILE 45 HG23 ILE 45 25.756 22.635 -11.627 342 HD11 ILE 45 HD11 ILE 45 26.069 23.661 -15.855 343 HD12 ILE 45 HD12 ILE 45 25.984 21.888 -15.828 344 HD13 ILE 45 HD13 ILE 45 24.875 22.854 -14.827 345 H ARG 46 H ARG 46 29.013 21.115 -14.752 346 HA ARG 46 HA ARG 46 30.328 20.047 -15.970 347 HB2 ARG 46 HB2 ARG 46 31.383 18.462 -13.598 348 HB3 ARG 46 HB3 ARG 46 32.137 18.555 -15.183 349 HG2 ARG 46 HG2 ARG 46 31.816 20.871 -13.240 350 HG3 ARG 46 HG3 ARG 46 33.285 19.945 -13.514 351 HD2 ARG 46 HD2 ARG 46 33.414 20.766 -15.834 352 HD3 ARG 46 HD3 ARG 46 31.878 21.614 -15.639 353 HE ARG 46 HE ARG 46 32.852 23.229 -14.253 354 HH11 ARG 46 HH11 ARG 46 35.377 20.950 -15.142 355 HH12 ARG 46 HH12 ARG 46 36.624 21.981 -14.497 356 HH21 ARG 46 HH21 ARG 46 34.390 24.403 -13.432 357 HH22 ARG 46 HH22 ARG 46 36.079 23.943 -13.551 358 H ASP 47 H ASP 47 28.142 18.203 -14.217 359 HA ASP 47 HA ASP 47 27.682 16.534 -16.635 360 HB2 ASP 47 HB2 ASP 47 29.400 15.368 -15.137 361 HB3 ASP 47 HB3 ASP 47 28.135 15.238 -13.915 362 H ALA 48 H ALA 48 26.536 17.747 -13.529 363 HA ALA 48 HA ALA 48 23.874 16.573 -13.816 364 HB1 ALA 48 HB1 ALA 48 25.086 18.524 -11.818 365 HB2 ALA 48 HB2 ALA 48 23.418 17.894 -11.764 366 HB3 ALA 48 HB3 ALA 48 24.789 16.789 -11.591 367 H ARG 49 H ARG 49 21.934 17.889 -13.801 368 HA ARG 49 HA ARG 49 22.076 19.906 -15.928 369 HB2 ARG 49 HB2 ARG 49 20.387 17.945 -15.719 370 HB3 ARG 49 HB3 ARG 49 19.581 18.922 -14.494 371 HG2 ARG 49 HG2 ARG 49 18.426 19.327 -16.514 372 HG3 ARG 49 HG3 ARG 49 19.408 20.771 -16.247 373 HD2 ARG 49 HD2 ARG 49 21.085 19.936 -17.893 374 HD3 ARG 49 HD3 ARG 49 20.128 18.471 -18.103 375 HE ARG 49 HE ARG 49 18.613 19.598 -19.424 376 HH11 ARG 49 HH11 ARG 49 20.652 22.062 -17.964 377 HH12 ARG 49 HH12 ARG 49 20.015 23.315 -18.990 378 HH21 ARG 49 HH21 ARG 49 17.841 21.248 -20.677 379 HH22 ARG 49 HH22 ARG 49 18.452 22.861 -20.478 380 H TYR 50 H TYR 50 20.789 19.887 -12.591 381 HA TYR 50 HA TYR 50 20.947 22.868 -12.480 382 HB2 TYR 50 HB2 TYR 50 19.011 21.083 -10.979 383 HB3 TYR 50 HB3 TYR 50 18.882 22.804 -11.267 384 HD1 TYR 50 HD1 TYR 50 19.173 23.076 -14.161 385 HD2 TYR 50 HD2 TYR 50 17.130 20.052 -11.894 386 HE1 TYR 50 HE1 TYR 50 17.540 22.789 -16.025 387 HE2 TYR 50 HE2 TYR 50 15.548 19.702 -13.781 388 HH TYR 50 HH TYR 50 14.920 20.366 -15.876 389 H ALA 51 H ALA 51 22.031 23.792 -10.641 390 HA ALA 51 HA ALA 51 22.560 21.979 -8.333 391 HB1 ALA 51 HB1 ALA 51 24.662 22.578 -9.399 392 HB2 ALA 51 HB2 ALA 51 24.218 24.304 -9.381 393 HB3 ALA 51 HB3 ALA 51 24.493 23.440 -7.855 394 H VAL 52 H VAL 52 21.935 22.739 -6.358 395 HA VAL 52 HA VAL 52 20.470 25.355 -6.165 396 HB VAL 52 HB VAL 52 19.471 22.560 -5.502 397 HG11 VAL 52 HG11 VAL 52 18.241 25.247 -4.761 398 HG12 VAL 52 HG12 VAL 52 17.361 23.703 -4.741 399 HG13 VAL 52 HG13 VAL 52 18.731 23.940 -3.659 400 HG21 VAL 52 HG21 VAL 52 18.433 24.699 -7.396 401 HG22 VAL 52 HG22 VAL 52 19.136 23.129 -7.837 402 HG23 VAL 52 HG23 VAL 52 17.588 23.189 -7.001 403 H ILE 53 H ILE 53 20.635 26.461 -4.186 404 HA ILE 53 HA ILE 53 22.245 25.099 -2.134 405 HB ILE 53 HB ILE 53 22.705 27.457 -3.796 406 HG12 ILE 53 HG12 ILE 53 24.317 25.702 -3.584 407 HG13 ILE 53 HG13 ILE 53 24.983 27.203 -2.970 408 HG21 ILE 53 HG21 ILE 53 23.665 28.991 -2.146 409 HG22 ILE 53 HG22 ILE 53 21.919 28.876 -1.974 410 HG23 ILE 53 HG23 ILE 53 22.966 28.054 -0.813 411 HD11 ILE 53 HD11 ILE 53 25.654 25.695 -1.316 412 HD12 ILE 53 HD12 ILE 53 24.118 26.233 -0.601 413 HD13 ILE 53 HD13 ILE 53 24.202 24.709 -1.503 414 H ARG 54 H ARG 54 21.709 25.112 -0.138 415 HA ARG 54 HA ARG 54 19.942 27.268 0.987 416 HB2 ARG 54 HB2 ARG 54 19.926 24.290 1.682 417 HB3 ARG 54 HB3 ARG 54 19.101 25.559 2.577 418 HG2 ARG 54 HG2 ARG 54 17.367 24.791 1.333 419 HG3 ARG 54 HG3 ARG 54 17.921 26.093 0.281 420 HD2 ARG 54 HD2 ARG 54 19.123 24.417 -1.122 421 HD3 ARG 54 HD3 ARG 54 18.653 23.134 -0.021 422 HE ARG 54 HE ARG 54 16.897 24.670 -1.886 423 HH11 ARG 54 HH12 ARG 54 17.020 22.044 0.446 424 HH12 ARG 54 HH11 ARG 54 15.518 21.366 -0.112 425 HH21 ARG 54 HH21 ARG 54 14.987 23.738 -2.543 426 HH22 ARG 54 HH22 ARG 54 14.402 22.309 -1.751 427 H ILE 55 H ILE 55 21.672 28.538 1.737 428 HA ILE 55 HA ILE 55 23.526 27.331 3.734 429 HB ILE 55 HB ILE 55 23.733 29.832 2.034 430 HG12 ILE 55 HG12 ILE 55 25.931 27.794 2.143 431 HG13 ILE 55 HG13 ILE 55 24.463 27.337 1.279 432 HG21 ILE 55 HG21 ILE 55 25.559 28.958 4.317 433 HG22 ILE 55 HG22 ILE 55 25.985 30.177 3.115 434 HG23 ILE 55 HG23 ILE 55 24.616 30.468 4.190 435 HD11 ILE 55 HD11 ILE 55 26.281 29.691 0.720 436 HD12 ILE 55 HD12 ILE 55 25.950 28.263 -0.289 437 HD13 ILE 55 HD13 ILE 55 24.687 29.480 -0.036 438 HA PRO 56 HA PRO 56 20.911 29.626 6.617 439 HB2 PRO 56 HB2 PRO 56 22.523 29.659 8.847 440 HB3 PRO 56 HB3 PRO 56 21.590 28.231 8.304 441 HG2 PRO 56 HG2 PRO 56 24.508 28.863 7.757 442 HG3 PRO 56 HG3 PRO 56 23.800 27.325 8.351 443 HD2 PRO 56 HD2 PRO 56 24.389 27.678 5.741 444 HD3 PRO 56 HD3 PRO 56 22.897 26.816 6.219 445 H GLY 57 H GLY 57 20.604 31.768 6.793 446 HA2 GLY 57 HA2 GLY 57 21.085 33.992 7.289 447 HA3 GLY 57 HA3 GLY 57 22.813 33.676 7.189 448 H GLN 58 H GLN 58 21.567 32.404 4.341 449 HA GLN 58 HA GLN 58 21.256 35.004 2.955 450 HB2 GLN 58 HB2 GLN 58 22.931 34.623 1.335 451 HB3 GLN 58 HB3 GLN 58 23.641 34.216 2.888 452 HG2 GLN 58 HG2 GLN 58 23.128 31.810 2.383 453 HG3 GLN 58 HG3 GLN 58 22.715 32.281 0.722 454 HE21 GLN 58 HE21 GLN 58 25.345 32.928 3.136 455 HE22 GLN 58 HE22 GLN 58 26.657 32.706 2.000 456 HA PRO 59 HA PRO 59 17.909 33.033 0.988 457 HB2 PRO 59 HB2 PRO 59 17.721 34.191 -1.488 458 HB3 PRO 59 HB3 PRO 59 17.400 35.067 0.039 459 HG2 PRO 59 HG2 PRO 59 19.979 35.017 -1.567 460 HG3 PRO 59 HG3 PRO 59 19.098 36.449 -0.934 461 HD2 PRO 59 HD2 PRO 59 21.204 35.367 0.399 462 HD3 PRO 59 HD3 PRO 59 19.783 35.997 1.286 463 H VAL 60 H VAL 60 17.318 31.300 -0.244 464 HA VAL 60 HA VAL 60 19.171 29.526 -1.448 465 HB VAL 60 HB VAL 60 17.104 28.619 -0.765 466 HG11 VAL 60 HG11 VAL 60 14.891 29.218 -1.708 467 HG12 VAL 60 HG12 VAL 60 15.612 30.562 -0.829 468 HG13 VAL 60 HG13 VAL 60 15.636 30.553 -2.608 469 HG21 VAL 60 HG21 VAL 60 16.204 27.447 -2.669 470 HG22 VAL 60 HG22 VAL 60 16.801 28.673 -3.798 471 HG23 VAL 60 HG23 VAL 60 17.940 27.624 -2.935 472 H VAL 61 H VAL 61 20.027 29.240 -3.398 473 HA VAL 61 HA VAL 61 19.017 30.836 -5.683 474 HB VAL 61 HB VAL 61 21.087 31.794 -4.762 475 HG11 VAL 61 HG11 VAL 61 23.258 30.738 -5.166 476 HG12 VAL 61 HG12 VAL 61 22.269 29.829 -4.024 477 HG13 VAL 61 HG13 VAL 61 22.455 29.244 -5.697 478 HG21 VAL 61 HG21 VAL 61 22.174 32.150 -6.885 479 HG22 VAL 61 HG22 VAL 61 21.467 30.672 -7.573 480 HG23 VAL 61 HG23 VAL 61 20.432 32.064 -7.160 481 H GLU 62 H GLU 62 19.014 29.844 -7.635 482 HA GLU 62 HA GLU 62 19.466 26.883 -7.732 483 HB2 GLU 62 HB2 GLU 62 17.014 28.365 -8.774 484 HB3 GLU 62 HB3 GLU 62 17.326 26.630 -8.877 485 HG2 GLU 62 HG2 GLU 62 17.273 26.508 -6.378 486 HG3 GLU 62 HG3 GLU 62 16.874 28.224 -6.312 487 H VAL 63 H VAL 63 20.597 26.226 -9.535 488 HA VAL 63 HA VAL 63 21.178 28.183 -11.675 489 HB VAL 63 HB VAL 63 22.464 25.514 -11.017 490 HG11 VAL 63 HG11 VAL 63 24.409 26.465 -12.232 491 HG12 VAL 63 HG12 VAL 63 23.009 26.214 -13.279 492 HG13 VAL 63 HG13 VAL 63 23.407 27.856 -12.694 493 HG21 VAL 63 HG21 VAL 63 22.804 27.070 -9.078 494 HG22 VAL 63 HG22 VAL 63 24.261 26.636 -9.955 495 HG23 VAL 63 HG23 VAL 63 23.535 28.234 -10.209 496 H GLY 64 H GLY 64 20.931 27.554 -13.914 497 HA2 GLY 64 HA2 GLY 64 20.160 26.333 -15.687 498 HA3 GLY 64 HA3 GLY 64 19.975 24.942 -14.629 499 H THR 65 H THR 65 17.863 24.486 -13.768 500 HA THR 65 HA THR 65 15.700 26.453 -13.956 501 HB THR 65 HB THR 65 15.510 23.927 -15.658 502 HG1 THR 65 HG1 THR 65 16.449 26.328 -16.176 503 HG21 THR 65 HG21 THR 65 13.483 26.155 -15.184 504 HG22 THR 65 HG22 THR 65 13.295 24.427 -14.787 505 HG23 THR 65 HG23 THR 65 13.373 24.934 -16.472 506 H LYS 66 H LYS 66 14.013 25.961 -12.574 507 HA LYS 66 HA LYS 66 14.485 24.123 -10.471 508 HB2 LYS 66 HB2 LYS 66 13.281 26.219 -10.166 509 HB3 LYS 66 HB3 LYS 66 11.959 25.652 -11.199 510 HG2 LYS 66 HG2 LYS 66 11.441 23.854 -9.581 511 HG3 LYS 66 HG3 LYS 66 12.810 24.351 -8.569 512 HD2 LYS 66 HD2 LYS 66 11.752 26.553 -8.203 513 HD3 LYS 66 HD3 LYS 66 10.398 26.089 -9.261 514 HE2 LYS 66 HE2 LYS 66 9.869 24.195 -7.727 515 HE3 LYS 66 HE3 LYS 66 11.198 24.687 -6.667 516 HZ1 LYS 66 HZ1 LYS 66 8.808 26.350 -7.291 517 HZ2 LYS 66 HZ2 LYS 66 10.037 26.808 -6.312 518 HZ3 LYS 66 HZ3 LYS 66 9.069 25.563 -5.885 519 HA PRO 67 HA PRO 67 12.670 20.551 -12.524 520 HB2 PRO 67 HB2 PRO 67 13.220 18.640 -10.710 521 HB3 PRO 67 HB3 PRO 67 14.493 19.430 -11.703 522 HG2 PRO 67 HG2 PRO 67 13.683 20.067 -8.851 523 HG3 PRO 67 HG3 PRO 67 15.331 19.852 -9.541 524 HD2 PRO 67 HD2 PRO 67 14.193 22.331 -9.194 525 HD3 PRO 67 HD3 PRO 67 15.319 21.950 -10.530 526 H THR 68 H THR 68 11.039 19.130 -12.362 527 HA THR 68 HA THR 68 8.809 19.933 -10.724 528 HB THR 68 HB THR 68 8.756 19.890 -13.140 529 HG1 THR 68 HG1 THR 68 6.710 18.984 -13.303 530 HG21 THR 68 HG21 THR 68 10.021 17.745 -13.492 531 HG22 THR 68 HG22 THR 68 8.517 17.869 -14.422 532 HG23 THR 68 HG23 THR 68 8.571 16.865 -12.958 533 H GLY 69 H GLY 69 10.566 16.864 -10.870 534 HA2 GLY 69 HA2 GLY 69 9.924 15.734 -8.531 535 HA3 GLY 69 HA3 GLY 69 8.391 15.474 -9.373 536 H ASP 70 H ASP 70 9.672 14.970 -11.951 537 HA ASP 70 HA ASP 70 10.625 12.178 -11.523 538 HB2 ASP 70 HB2 ASP 70 10.559 11.881 -13.928 539 HB3 ASP 70 HB3 ASP 70 9.000 12.209 -13.182 540 H VAL 71 H VAL 71 12.388 13.504 -10.358 541 HA VAL 71 HA VAL 71 14.727 13.743 -12.091 542 HB VAL 71 HB VAL 71 15.490 15.728 -10.966 543 HG11 VAL 71 HG11 VAL 71 12.736 16.658 -11.859 544 HG12 VAL 71 HG12 VAL 71 14.359 17.251 -12.236 545 HG13 VAL 71 HG13 VAL 71 13.786 15.797 -13.011 546 HG21 VAL 71 HG21 VAL 71 14.364 15.449 -8.774 547 HG22 VAL 71 HG22 VAL 71 14.147 17.052 -9.447 548 HG23 VAL 71 HG23 VAL 71 12.813 15.877 -9.526 549 H LEU 72 H LEU 72 16.720 13.518 -10.992 550 HA LEU 72 HA LEU 72 16.755 11.768 -8.578 551 HB2 LEU 72 HB2 LEU 72 18.906 12.768 -10.511 552 HB3 LEU 72 HB3 LEU 72 19.233 11.700 -9.150 553 HG LEU 72 HG LEU 72 17.297 10.998 -11.362 554 HD11 LEU 72 HD11 LEU 72 19.111 9.574 -12.305 555 HD12 LEU 72 HD12 LEU 72 20.250 10.277 -11.130 556 HD13 LEU 72 HD13 LEU 72 19.503 11.295 -12.382 557 HD21 LEU 72 HD21 LEU 72 18.748 9.342 -9.269 558 HD22 LEU 72 HD22 LEU 72 17.712 8.678 -10.557 559 HD23 LEU 72 HD23 LEU 72 17.011 9.718 -9.304 560 H GLN 73 H GLN 73 17.870 12.470 -6.586 561 HA GLN 73 HA GLN 73 18.710 15.336 -6.588 562 HB2 GLN 73 HB2 GLN 73 17.225 13.678 -4.524 563 HB3 GLN 73 HB3 GLN 73 17.924 15.273 -4.239 564 HG2 GLN 73 HG2 GLN 73 16.523 16.129 -6.186 565 HG3 GLN 73 HG3 GLN 73 15.673 14.588 -6.176 566 HE21 GLN 73 HE21 GLN 73 14.896 17.505 -5.502 567 HE22 GLN 73 HE22 GLN 73 14.094 17.331 -3.932 568 H GLY 74 H GLY 74 20.803 15.565 -6.242 569 HA2 GLY 74 HA2 GLY 74 22.417 13.578 -4.676 570 HA3 GLY 74 HA3 GLY 74 23.051 14.816 -5.785 571 H ARG 75 H ARG 75 23.427 14.432 -2.736 572 HA ARG 75 HA ARG 75 22.702 17.171 -1.893 573 HB2 ARG 75 HB2 ARG 75 20.669 15.780 -1.529 574 HB3 ARG 75 HB3 ARG 75 21.597 14.707 -0.479 575 HG2 ARG 75 HG2 ARG 75 21.947 16.549 1.129 576 HG3 ARG 75 HG3 ARG 75 21.114 17.682 0.037 577 HD2 ARG 75 HD2 ARG 75 19.036 16.411 0.249 578 HD3 ARG 75 HD3 ARG 75 19.857 15.177 1.230 579 HE ARG 75 HE ARG 75 20.243 17.666 2.518 580 HH11 ARG 75 HH11 ARG 75 17.562 15.514 1.858 581 HH12 ARG 75 HH12 ARG 75 16.685 16.005 3.282 582 HH21 ARG 75 HH21 ARG 75 19.077 18.244 4.341 583 HH22 ARG 75 HH22 ARG 75 17.527 17.521 4.641 584 H ALA 76 H ALA 76 23.842 17.981 -0.233 585 HA ALA 76 HA ALA 76 25.693 16.298 1.388 586 HB1 ALA 76 HB1 ALA 76 26.920 16.690 -0.714 587 HB2 ALA 76 HB2 ALA 76 26.626 18.435 -0.585 588 HB3 ALA 76 HB3 ALA 76 27.672 17.612 0.601 589 H THR 77 H THR 77 26.845 17.423 3.043 590 HA THR 77 HA THR 77 25.652 20.032 3.891 591 HB THR 77 HB THR 77 26.795 17.834 5.643 592 HG1 THR 77 HG1 THR 77 24.660 17.667 6.341 593 HG21 THR 77 HG21 THR 77 25.453 20.482 6.374 594 HG22 THR 77 HG22 THR 77 27.169 20.091 6.616 595 HG23 THR 77 HG23 THR 77 25.932 19.209 7.518 596 H GLY 78 H GLY 78 27.055 21.675 3.947 597 HA2 GLY 78 HA2 GLY 78 29.900 21.198 3.256 598 HA3 GLY 78 HA3 GLY 78 29.052 22.718 3.190 599 H GLU 79 H GLU 79 31.329 23.055 4.142 600 HA GLU 79 HA GLU 79 31.750 22.238 6.890 601 HB2 GLU 79 HB2 GLU 79 33.514 23.586 4.845 602 HB3 GLU 79 HB3 GLU 79 34.009 23.358 6.528 603 HG2 GLU 79 HG2 GLU 79 33.576 20.908 6.306 604 HG3 GLU 79 HG3 GLU 79 33.174 21.147 4.604 605 H GLU 80 H GLU 80 30.229 25.091 5.679 606 HA GLU 80 HA GLU 80 30.931 26.519 8.251 607 HB2 GLU 80 HB2 GLU 80 29.493 27.490 5.788 608 HB3 GLU 80 HB3 GLU 80 29.765 28.444 7.240 609 HG2 GLU 80 HG2 GLU 80 32.023 27.335 5.499 610 HG3 GLU 80 HG3 GLU 80 31.305 28.912 5.402 611 H GLY 81 H GLY 81 28.929 24.185 7.236 612 HA2 GLY 81 HA2 GLY 81 27.202 23.241 8.420 613 HA3 GLY 81 HA3 GLY 81 26.780 24.786 9.146 614 H GLU 82 H GLU 82 27.205 24.666 5.607 615 HA GLU 82 HA GLU 82 24.405 25.286 5.196 616 HB2 GLU 82 HB2 GLU 82 25.090 25.907 3.066 617 HB3 GLU 82 HB3 GLU 82 26.287 26.576 4.171 618 HG2 GLU 82 HG2 GLU 82 26.772 23.997 2.604 619 HG3 GLU 82 HG3 GLU 82 26.971 25.572 1.879 620 H THR 83 H THR 83 23.428 24.413 3.099 621 HA THR 83 HA THR 83 23.845 21.461 2.842 622 HB THR 83 HB THR 83 21.188 22.923 2.921 623 HG1 THR 83 HG1 THR 83 20.890 21.766 4.790 624 HG21 THR 83 HG21 THR 83 21.838 19.960 2.547 625 HG22 THR 83 HG22 THR 83 21.053 21.024 1.356 626 HG23 THR 83 HG23 THR 83 20.212 20.621 2.854 627 H VAL 84 H VAL 84 23.986 20.711 0.827 628 HA VAL 84 HA VAL 84 23.566 22.571 -1.485 629 HB VAL 84 HB VAL 84 25.630 20.353 -1.205 630 HG11 VAL 84 HG11 VAL 84 25.271 22.457 -3.389 631 HG12 VAL 84 HG12 VAL 84 26.593 21.270 -3.260 632 HG13 VAL 84 HG13 VAL 84 24.962 20.709 -3.565 633 HG21 VAL 84 HG21 VAL 84 26.414 22.081 0.206 634 HG22 VAL 84 HG22 VAL 84 27.231 22.348 -1.350 635 HG23 VAL 84 HG23 VAL 84 25.861 23.354 -0.901 636 H LEU 85 H LEU 85 22.517 21.801 -3.221 637 HA LEU 85 HA LEU 85 21.692 18.964 -3.286 638 HB2 LEU 85 HB2 LEU 85 19.902 20.361 -2.254 639 HB3 LEU 85 HB3 LEU 85 19.901 21.384 -3.676 640 HG LEU 85 HG LEU 85 19.219 19.265 -5.014 641 HD11 LEU 85 HD11 LEU 85 19.774 17.604 -3.187 642 HD12 LEU 85 HD12 LEU 85 18.116 17.497 -3.785 643 HD13 LEU 85 HD13 LEU 85 18.457 18.287 -2.227 644 HD21 LEU 85 HD21 LEU 85 17.367 20.401 -2.894 645 HD22 LEU 85 HD22 LEU 85 16.865 19.487 -4.335 646 HD23 LEU 85 HD23 LEU 85 17.661 21.054 -4.525 647 H VAL 86 H VAL 86 21.348 18.130 -5.301 648 HA VAL 86 HA VAL 86 22.020 19.695 -7.771 649 HB VAL 86 HB VAL 86 23.140 16.947 -7.037 650 HG11 VAL 86 HG11 VAL 86 22.600 16.979 -9.418 651 HG12 VAL 86 HG12 VAL 86 23.331 18.592 -9.588 652 HG13 VAL 86 HG13 VAL 86 24.345 17.168 -9.222 653 HG21 VAL 86 HG21 VAL 86 25.351 18.028 -7.243 654 HG22 VAL 86 HG22 VAL 86 24.561 19.606 -7.490 655 HG23 VAL 86 HG23 VAL 86 24.402 18.746 -5.938 656 H GLU 87 H GLU 87 20.650 19.155 -9.510 657 HA GLU 87 HA GLU 87 18.927 16.777 -9.153 658 HB2 GLU 87 HB2 GLU 87 17.762 19.540 -9.603 659 HB3 GLU 87 HB3 GLU 87 16.879 18.007 -9.519 660 HG2 GLU 87 HG2 GLU 87 17.781 17.724 -7.159 661 HG3 GLU 87 HG3 GLU 87 18.427 19.361 -7.268 662 H GLU 88 H GLU 88 18.391 15.763 -10.873 663 HA GLU 88 HA GLU 88 18.482 16.952 -13.585 664 HB2 GLU 88 HB2 GLU 88 20.032 15.155 -14.389 665 HB3 GLU 88 HB3 GLU 88 20.770 16.357 -13.342 666 HG2 GLU 88 HG2 GLU 88 20.760 14.789 -11.465 667 HG3 GLU 88 HG3 GLU 88 19.844 13.610 -12.435 668 HA PRO 89 HA PRO 89 15.073 14.484 -14.394 669 HB2 PRO 89 HB2 PRO 89 15.225 13.721 -17.045 670 HB3 PRO 89 HB3 PRO 89 14.863 15.376 -16.467 671 HG2 PRO 89 HG2 PRO 89 17.553 14.239 -17.297 672 HG3 PRO 89 HG3 PRO 89 16.791 15.779 -17.827 673 HD2 PRO 89 HD2 PRO 89 18.625 15.769 -15.873 674 HD3 PRO 89 HD3 PRO 89 17.168 16.784 -15.689 675 H ARG 90 H ARG 90 14.232 12.601 -14.207 676 HA ARG 90 HA ARG 90 15.953 10.216 -13.870 677 HB2 ARG 90 HB2 ARG 90 14.519 11.294 -12.034 678 HB3 ARG 90 HB3 ARG 90 13.130 10.564 -12.787 679 HG2 ARG 90 HG2 ARG 90 14.048 8.311 -12.470 680 HG3 ARG 90 HG3 ARG 90 15.563 9.004 -11.857 681 HD2 ARG 90 HD2 ARG 90 14.299 8.404 -9.926 682 HD3 ARG 90 HD3 ARG 90 14.245 10.168 -10.086 683 HE ARG 90 HE ARG 90 12.015 8.379 -10.982 684 HH11 ARG 90 HH11 ARG 90 12.961 11.247 -9.126 685 HH12 ARG 90 HH12 ARG 90 11.295 11.713 -8.903 686 HH21 ARG 90 HH21 ARG 90 9.948 9.007 -10.510 687 HH22 ARG 90 HH22 ARG 90 9.662 10.417 -9.533 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 24.144 -12.120 1.465 2 H2 GLY 1 H2 GLY 1 25.622 -11.504 1.803 3 H3 GLY 1 H3 GLY 1 25.491 -12.992 1.135 4 HA2 GLY 1 HA2 GLY 1 24.748 -10.444 -0.165 5 HA3 GLY 1 HA3 GLY 1 26.198 -11.396 -0.532 6 H SER 2 H SER 2 25.883 -12.202 -2.553 7 HA SER 2 HA SER 2 25.157 -13.362 -4.275 8 HB2 SER 2 HB2 SER 2 23.697 -15.046 -2.230 9 HB3 SER 2 HB3 SER 2 24.237 -15.556 -3.836 10 HG SER 2 HG SER 2 26.372 -15.279 -3.181 11 H GLU 3 H GLU 3 22.756 -11.507 -2.934 12 HA GLU 3 HA GLU 3 20.955 -12.012 -5.266 13 HB2 GLU 3 HB2 GLU 3 20.168 -13.280 -3.272 14 HB3 GLU 3 HB3 GLU 3 20.085 -11.775 -2.352 15 HG2 GLU 3 HG2 GLU 3 18.375 -10.909 -3.923 16 HG3 GLU 3 HG3 GLU 3 18.505 -12.380 -4.892 17 H THR 4 H THR 4 20.439 -10.117 -6.345 18 HA THR 4 HA THR 4 21.197 -7.562 -5.383 19 HB THR 4 HB THR 4 19.951 -6.785 -7.439 20 HG1 THR 4 HG1 THR 4 19.250 -8.425 -8.834 21 HG21 THR 4 HG21 THR 4 22.346 -7.420 -7.529 22 HG22 THR 4 HG22 THR 4 21.499 -7.797 -9.036 23 HG23 THR 4 HG23 THR 4 21.890 -9.099 -7.890 24 H ARG 5 H ARG 5 19.811 -5.671 -5.269 25 HA ARG 5 HA ARG 5 17.370 -6.252 -3.601 26 HB2 ARG 5 HB2 ARG 5 19.294 -3.933 -3.271 27 HB3 ARG 5 HB3 ARG 5 17.971 -4.387 -2.206 28 HG2 ARG 5 HG2 ARG 5 20.621 -5.801 -2.599 29 HG3 ARG 5 HG3 ARG 5 19.992 -5.037 -1.148 30 HD2 ARG 5 HD2 ARG 5 19.148 -7.675 -2.381 31 HD3 ARG 5 HD3 ARG 5 19.923 -7.404 -0.841 32 HE ARG 5 HE ARG 5 17.844 -6.291 -0.053 33 HH11 ARG 5 HH11 ARG 5 17.440 -8.474 -2.807 34 HH12 ARG 5 HH12 ARG 5 15.868 -8.978 -2.256 35 HH21 ARG 5 HH21 ARG 5 15.779 -6.887 0.469 36 HH22 ARG 5 HH22 ARG 5 14.916 -8.025 -0.523 37 H THR 6 H THR 6 18.117 -4.733 -6.514 38 HA THR 6 HA THR 6 17.123 -3.193 -7.830 39 HB THR 6 HB THR 6 14.541 -3.778 -6.408 40 HG1 THR 6 HG1 THR 6 14.360 -5.506 -7.856 41 HG21 THR 6 HG21 THR 6 13.581 -3.493 -8.682 42 HG22 THR 6 HG22 THR 6 15.205 -3.167 -9.332 43 HG23 THR 6 HG23 THR 6 14.449 -2.032 -8.197 44 H ILE 7 H ILE 7 18.484 -1.770 -6.554 45 HA ILE 7 HA ILE 7 16.989 0.578 -5.516 46 HB ILE 7 HB ILE 7 19.584 -0.427 -4.297 47 HG12 ILE 7 HG12 ILE 7 16.755 -0.457 -3.136 48 HG13 ILE 7 HG13 ILE 7 17.680 -1.873 -3.639 49 HG21 ILE 7 HG21 ILE 7 19.265 1.419 -2.689 50 HG22 ILE 7 HG22 ILE 7 19.325 2.065 -4.309 51 HG23 ILE 7 HG23 ILE 7 17.755 1.892 -3.495 52 HD11 ILE 7 HD11 ILE 7 19.413 -1.339 -1.932 53 HD12 ILE 7 HD12 ILE 7 18.322 -0.075 -1.302 54 HD13 ILE 7 HD13 ILE 7 17.816 -1.770 -1.286 55 H SER 8 H SER 8 17.820 2.561 -6.416 56 HA SER 8 HA SER 8 19.342 2.141 -8.811 57 HB2 SER 8 HB2 SER 8 18.659 4.519 -9.283 58 HB3 SER 8 HB3 SER 8 17.325 3.413 -8.924 59 HG SER 8 HG SER 8 17.130 5.378 -7.773 60 H SER 9 H SER 9 20.892 1.969 -6.417 61 HA SER 9 HA SER 9 22.748 3.986 -6.093 62 HB2 SER 9 HB2 SER 9 23.306 1.038 -5.724 63 HB3 SER 9 HB3 SER 9 24.054 2.399 -4.870 64 HG SER 9 HG SER 9 22.429 1.472 -3.600 65 H THR 10 H THR 10 22.715 4.150 -8.699 66 HA THR 10 HA THR 10 25.478 3.869 -9.513 67 HB THR 10 HB THR 10 24.749 3.359 -11.865 68 HG1 THR 10 HG1 THR 10 22.805 2.142 -12.044 69 HG21 THR 10 HG21 THR 10 25.837 1.631 -10.421 70 HG22 THR 10 HG22 THR 10 24.720 0.932 -11.607 71 HG23 THR 10 HG23 THR 10 24.225 1.087 -9.905 72 H ALA 11 H ALA 11 22.365 4.813 -10.983 73 HA ALA 11 HA ALA 11 23.178 7.449 -11.732 74 HB1 ALA 11 HB1 ALA 11 21.430 6.156 -12.877 75 HB2 ALA 11 HB2 ALA 11 20.393 6.240 -11.434 76 HB3 ALA 11 HB3 ALA 11 20.804 7.721 -12.327 77 H GLN 12 H GLN 12 21.124 6.344 -8.944 78 HA GLN 12 HA GLN 12 20.975 9.044 -7.847 79 HB2 GLN 12 HB2 GLN 12 19.162 7.448 -7.577 80 HB3 GLN 12 HB3 GLN 12 20.219 6.335 -6.710 81 HG2 GLN 12 HG2 GLN 12 18.675 7.596 -5.232 82 HG3 GLN 12 HG3 GLN 12 20.371 7.769 -4.816 83 HE21 GLN 12 HE21 GLN 12 20.455 9.783 -3.862 84 HE22 GLN 12 HE22 GLN 12 19.860 11.253 -4.612 85 H GLU 13 H GLU 13 23.278 6.382 -7.501 86 HA GLU 13 HA GLU 13 24.593 7.463 -5.174 87 HB2 GLU 13 HB2 GLU 13 24.734 5.100 -5.928 88 HB3 GLU 13 HB3 GLU 13 25.655 5.601 -7.335 89 HG2 GLU 13 HG2 GLU 13 27.260 4.828 -5.817 90 HG3 GLU 13 HG3 GLU 13 27.386 6.574 -5.677 91 H ARG 14 H ARG 14 25.554 7.640 -8.576 92 HA ARG 14 HA ARG 14 27.772 9.210 -8.307 93 HB2 ARG 14 HB2 ARG 14 27.679 9.946 -10.599 94 HB3 ARG 14 HB3 ARG 14 27.359 8.228 -10.458 95 HG2 ARG 14 HG2 ARG 14 25.257 8.386 -11.298 96 HG3 ARG 14 HG3 ARG 14 24.907 9.952 -10.588 97 HD2 ARG 14 HD2 ARG 14 26.907 9.730 -12.848 98 HD3 ARG 14 HD3 ARG 14 25.177 9.676 -13.171 99 HE ARG 14 HE ARG 14 26.450 11.993 -11.693 100 HH11 ARG 14 HH11 ARG 14 24.223 10.984 -14.299 101 HH12 ARG 14 HH12 ARG 14 23.733 12.674 -14.477 102 HH21 ARG 14 HH21 ARG 14 25.755 13.988 -12.164 103 HH22 ARG 14 HH22 ARG 14 24.562 14.180 -13.482 104 H VAL 15 H VAL 15 24.538 10.467 -8.527 105 HA VAL 15 HA VAL 15 25.203 13.245 -8.592 106 HB VAL 15 HB VAL 15 22.963 13.772 -7.812 107 HG11 VAL 15 HG11 VAL 15 23.035 11.720 -10.056 108 HG12 VAL 15 HG12 VAL 15 21.815 12.982 -9.800 109 HG13 VAL 15 HG13 VAL 15 23.485 13.433 -10.194 110 HG21 VAL 15 HG21 VAL 15 22.449 10.783 -7.817 111 HG22 VAL 15 HG22 VAL 15 22.538 11.784 -6.351 112 HG23 VAL 15 HG23 VAL 15 21.261 12.067 -7.543 113 H ASP 16 H ASP 16 25.416 10.979 -5.953 114 HA ASP 16 HA ASP 16 25.271 13.019 -3.852 115 HB2 ASP 16 HB2 ASP 16 24.874 10.593 -3.464 116 HB3 ASP 16 HB3 ASP 16 26.575 10.273 -3.808 117 H LEU 17 H LEU 17 28.011 11.490 -5.605 118 HA LEU 17 HA LEU 17 30.045 12.701 -4.085 119 HB2 LEU 17 HB2 LEU 17 30.057 11.494 -6.893 120 HB3 LEU 17 HB3 LEU 17 31.494 12.045 -6.071 121 HG LEU 17 HG LEU 17 31.427 9.703 -5.908 122 HD11 LEU 17 HD11 LEU 17 32.226 10.929 -3.895 123 HD12 LEU 17 HD12 LEU 17 31.597 9.311 -3.536 124 HD13 LEU 17 HD13 LEU 17 30.612 10.738 -3.167 125 HD21 LEU 17 HD21 LEU 17 29.713 8.363 -4.927 126 HD22 LEU 17 HD22 LEU 17 28.969 9.362 -6.183 127 HD23 LEU 17 HD23 LEU 17 28.762 9.779 -4.465 128 H GLU 18 H GLU 18 28.685 13.652 -7.172 129 HA GLU 18 HA GLU 18 30.189 16.079 -7.527 130 HB2 GLU 18 HB2 GLU 18 28.412 16.679 -9.168 131 HB3 GLU 18 HB3 GLU 18 29.167 15.111 -9.420 132 HG2 GLU 18 HG2 GLU 18 27.138 14.136 -8.106 133 HG3 GLU 18 HG3 GLU 18 26.381 15.676 -8.387 134 H ALA 19 H ALA 19 27.150 15.429 -5.655 135 HA ALA 19 HA ALA 19 26.740 18.218 -4.999 136 HB1 ALA 19 HB1 ALA 19 25.894 15.723 -3.482 137 HB2 ALA 19 HB2 ALA 19 25.189 17.348 -3.367 138 HB3 ALA 19 HB3 ALA 19 25.039 16.411 -4.873 139 H VAL 20 H VAL 20 28.637 15.614 -3.418 140 HA VAL 20 HA VAL 20 29.555 17.243 -1.191 141 HB VAL 20 HB VAL 20 30.708 14.733 -2.460 142 HG11 VAL 20 HG11 VAL 20 32.027 14.495 -0.359 143 HG12 VAL 20 HG12 VAL 20 32.559 15.872 -1.321 144 HG13 VAL 20 HG13 VAL 20 31.543 16.138 0.116 145 HG21 VAL 20 HG21 VAL 20 29.792 13.635 -0.464 146 HG22 VAL 20 HG22 VAL 20 29.200 15.190 0.157 147 HG23 VAL 20 HG23 VAL 20 28.499 14.483 -1.309 148 H ARG 21 H ARG 21 31.048 16.589 -4.394 149 HA ARG 21 HA ARG 21 33.270 18.272 -4.141 150 HB2 ARG 21 HB2 ARG 21 32.847 16.729 -6.033 151 HB3 ARG 21 HB3 ARG 21 31.561 17.772 -6.620 152 HG2 ARG 21 HG2 ARG 21 33.628 18.043 -7.910 153 HG3 ARG 21 HG3 ARG 21 33.109 19.545 -7.156 154 HD2 ARG 21 HD2 ARG 21 35.540 19.280 -7.038 155 HD3 ARG 21 HD3 ARG 21 34.829 19.324 -5.418 156 HE ARG 21 HE ARG 21 35.091 16.601 -6.362 157 HH11 ARG 21 HH11 ARG 21 37.121 19.182 -5.142 158 HH12 ARG 21 HH12 ARG 21 38.297 18.076 -4.487 159 HH21 ARG 21 HH22 ARG 21 36.624 15.239 -5.492 160 HH22 ARG 21 HH21 ARG 21 38.020 15.898 -4.695 161 H LEU 22 H LEU 22 29.976 19.277 -5.099 162 HA LEU 22 HA LEU 22 30.645 22.082 -5.227 163 HB2 LEU 22 HB2 LEU 22 28.081 20.549 -5.348 164 HB3 LEU 22 HB3 LEU 22 28.061 22.249 -4.843 165 HG LEU 22 HG LEU 22 29.428 22.837 -6.888 166 HD11 LEU 22 HD11 LEU 22 29.295 21.322 -8.823 167 HD12 LEU 22 HD12 LEU 22 28.581 20.058 -7.804 168 HD13 LEU 22 HD13 LEU 22 30.255 20.593 -7.528 169 HD21 LEU 22 HD21 LEU 22 27.041 23.231 -6.618 170 HD22 LEU 22 HD22 LEU 22 26.685 21.634 -7.322 171 HD23 LEU 22 HD23 LEU 22 27.479 22.901 -8.308 172 H ALA 23 H ALA 23 29.501 20.083 -2.460 173 HA ALA 23 HA ALA 23 29.245 22.287 -0.675 174 HB1 ALA 23 HB1 ALA 23 28.616 19.892 -0.258 175 HB2 ALA 23 HB2 ALA 23 30.338 19.532 -0.006 176 HB3 ALA 23 HB3 ALA 23 29.492 20.665 1.071 177 H SER 24 H SER 24 32.225 20.620 -1.747 178 HA SER 24 HA SER 24 33.997 22.364 -0.357 179 HB2 SER 24 HB2 SER 24 34.580 20.779 -2.877 180 HB3 SER 24 HB3 SER 24 35.759 21.511 -1.781 181 HG SER 24 HG SER 24 35.420 19.300 -1.302 182 H ILE 25 H ILE 25 32.639 22.738 -3.731 183 HA ILE 25 HA ILE 25 34.288 25.058 -4.175 184 HB ILE 25 HB ILE 25 31.675 24.767 -5.594 185 HG12 ILE 25 HG12 ILE 25 32.453 22.564 -5.894 186 HG13 ILE 25 HG13 ILE 25 32.812 23.434 -7.333 187 HG21 ILE 25 HG21 ILE 25 34.441 25.873 -6.290 188 HG22 ILE 25 HG22 ILE 25 33.123 25.746 -7.449 189 HG23 ILE 25 HG23 ILE 25 32.933 26.786 -6.051 190 HD11 ILE 25 HD11 ILE 25 34.814 22.614 -5.200 191 HD12 ILE 25 HD12 ILE 25 34.540 21.842 -6.758 192 HD13 ILE 25 HD13 ILE 25 35.208 23.498 -6.704 193 H VAL 26 H VAL 26 31.080 24.590 -2.698 194 HA VAL 26 HA VAL 26 30.409 27.426 -2.454 195 HB VAL 26 HB VAL 26 29.449 24.972 -0.955 196 HG11 VAL 26 HG11 VAL 26 28.296 27.793 -1.077 197 HG12 VAL 26 HG12 VAL 26 27.475 26.375 -0.374 198 HG13 VAL 26 HG13 VAL 26 28.961 26.981 0.355 199 HG21 VAL 26 HG21 VAL 26 27.572 24.936 -2.463 200 HG22 VAL 26 HG22 VAL 26 27.997 26.522 -3.157 201 HG23 VAL 26 HG23 VAL 26 28.959 25.087 -3.519 202 H ASP 27 H ASP 27 31.809 24.974 -0.072 203 HA ASP 27 HA ASP 27 32.464 26.809 1.955 204 HB2 ASP 27 HB2 ASP 27 32.849 24.445 2.223 205 HB3 ASP 27 HB3 ASP 27 34.001 24.419 0.884 206 H SER 28 H SER 28 34.385 26.127 -0.979 207 HA SER 28 HA SER 28 36.511 27.936 -0.487 208 HB2 SER 28 HB2 SER 28 35.378 27.202 -3.218 209 HB3 SER 28 HB3 SER 28 36.975 27.874 -2.875 210 HG SER 28 HG SER 28 35.950 25.337 -2.055 211 H ARG 29 H ARG 29 33.278 28.590 -1.739 212 HA ARG 29 HA ARG 29 33.779 31.443 -2.238 213 HB2 ARG 29 HB2 ARG 29 32.188 30.015 -3.558 214 HB3 ARG 29 HB3 ARG 29 31.177 29.848 -2.138 215 HG2 ARG 29 HG2 ARG 29 30.253 31.485 -3.581 216 HG3 ARG 29 HG3 ARG 29 30.780 32.271 -2.092 217 HD2 ARG 29 HD2 ARG 29 32.721 33.213 -3.249 218 HD3 ARG 29 HD3 ARG 29 32.339 32.266 -4.704 219 HE ARG 29 HE ARG 29 30.150 34.016 -3.822 220 HH11 ARG 29 HH11 ARG 29 33.156 34.148 -5.606 221 HH12 ARG 29 HH12 ARG 29 32.619 35.465 -6.610 222 HH21 ARG 29 HH21 ARG 29 29.397 35.501 -5.372 223 HH22 ARG 29 HH22 ARG 29 30.570 36.244 -6.419 224 H LEU 30 H LEU 30 32.276 29.526 0.439 225 HA LEU 30 HA LEU 30 31.461 31.865 1.915 226 HB2 LEU 30 HB2 LEU 30 32.189 29.107 2.956 227 HB3 LEU 30 HB3 LEU 30 31.358 30.382 3.855 228 HG LEU 30 HG LEU 30 30.278 28.927 1.423 229 HD11 LEU 30 HD11 LEU 30 29.286 28.929 4.292 230 HD12 LEU 30 HD12 LEU 30 30.239 27.600 3.588 231 HD13 LEU 30 HD13 LEU 30 28.638 27.982 2.945 232 HD21 LEU 30 HD21 LEU 30 29.407 31.180 1.341 233 HD22 LEU 30 HD22 LEU 30 29.014 31.137 3.084 234 HD23 LEU 30 HD23 LEU 30 28.142 30.105 1.930 235 H ILE 31 H ILE 31 34.544 30.083 1.853 236 HA ILE 31 HA ILE 31 35.928 31.871 3.686 237 HB ILE 31 HB ILE 31 36.880 29.896 1.575 238 HG12 ILE 31 HG12 ILE 31 36.935 29.678 4.624 239 HG13 ILE 31 HG13 ILE 31 35.623 29.039 3.646 240 HG21 ILE 31 HG21 ILE 31 38.667 31.562 1.908 241 HG22 ILE 31 HG22 ILE 31 38.540 31.373 3.671 242 HG23 ILE 31 HG23 ILE 31 39.128 30.045 2.650 243 HD11 ILE 31 HD11 ILE 31 37.115 27.239 4.169 244 HD12 ILE 31 HD12 ILE 31 37.212 27.567 2.430 245 HD13 ILE 31 HD13 ILE 31 38.512 28.105 3.525 246 H GLY 32 H GLY 32 35.386 31.850 0.173 247 HA2 GLY 32 HA2 GLY 32 37.373 33.705 -0.618 248 HA3 GLY 32 HA3 GLY 32 35.921 33.191 -1.515 249 H THR 33 H THR 33 33.957 34.093 0.212 250 HA THR 33 HA THR 33 34.262 36.972 0.561 251 HB THR 33 HB THR 33 33.900 36.786 -1.887 252 HG1 THR 33 HG1 THR 33 32.293 38.330 -1.972 253 HG21 THR 33 HG21 THR 33 32.340 34.778 -1.745 254 HG22 THR 33 HG22 THR 33 31.841 36.091 -2.837 255 HG23 THR 33 HG23 THR 33 31.057 35.912 -1.257 256 H GLY 34 H GLY 34 32.194 34.081 0.828 257 HA2 GLY 34 HA2 GLY 34 31.059 33.676 2.864 258 HA3 GLY 34 HA3 GLY 34 30.848 35.389 3.160 259 H SER 35 H SER 35 29.947 34.473 -0.043 260 HA SER 35 HA SER 35 27.362 33.344 0.480 261 HB2 SER 35 HB2 SER 35 27.571 36.212 -0.542 262 HB3 SER 35 HB3 SER 35 26.133 35.195 -0.768 263 HG SER 35 HG SER 35 27.195 35.385 1.809 264 H VAL 36 H VAL 36 26.475 32.365 -1.413 265 HA VAL 36 HA VAL 36 28.310 32.363 -3.782 266 HB VAL 36 HB VAL 36 28.226 30.269 -2.435 267 HG11 VAL 36 HG11 VAL 36 25.401 29.950 -3.519 268 HG12 VAL 36 HG12 VAL 36 26.321 28.825 -2.494 269 HG13 VAL 36 HG13 VAL 36 25.781 30.386 -1.844 270 HG21 VAL 36 HG21 VAL 36 28.828 30.255 -4.853 271 HG22 VAL 36 HG22 VAL 36 28.030 28.767 -4.330 272 HG23 VAL 36 HG23 VAL 36 27.121 29.975 -5.257 273 H ASP 37 H ASP 37 27.413 32.504 -5.857 274 HA ASP 37 HA ASP 37 24.552 33.198 -6.077 275 HB2 ASP 37 HB2 ASP 37 26.796 34.461 -7.667 276 HB3 ASP 37 HB3 ASP 37 25.131 35.001 -7.504 277 H GLU 38 H GLU 38 23.657 32.767 -8.222 278 HA GLU 38 HA GLU 38 24.148 30.275 -9.219 279 HB2 GLU 38 HB2 GLU 38 22.257 32.074 -9.694 280 HB3 GLU 38 HB3 GLU 38 23.226 32.442 -11.125 281 HG2 GLU 38 HG2 GLU 38 23.119 29.857 -11.573 282 HG3 GLU 38 HG3 GLU 38 21.860 29.852 -10.341 283 H ASP 39 H ASP 39 25.710 33.254 -10.456 284 HA ASP 39 HA ASP 39 27.031 32.126 -12.672 285 HB2 ASP 39 HB2 ASP 39 26.573 34.539 -12.222 286 HB3 ASP 39 HB3 ASP 39 27.774 34.508 -10.927 287 H PHE 40 H PHE 40 27.795 31.874 -9.259 288 HA PHE 40 HA PHE 40 30.555 30.936 -9.802 289 HB2 PHE 40 HB2 PHE 40 29.859 32.588 -7.904 290 HB3 PHE 40 HB3 PHE 40 29.250 31.150 -7.096 291 HD1 PHE 40 HD2 PHE 40 32.247 32.893 -8.423 292 HD2 PHE 40 HD1 PHE 40 30.866 29.479 -6.178 293 HE1 PHE 40 HE2 PHE 40 34.574 32.441 -7.676 294 HE2 PHE 40 HE1 PHE 40 33.197 29.027 -5.444 295 HZ PHE 40 HZ PHE 40 35.050 30.510 -6.180 296 H LEU 41 H LEU 41 27.586 29.548 -10.007 297 HA LEU 41 HA LEU 41 28.738 26.871 -9.298 298 HB2 LEU 41 HB2 LEU 41 25.927 28.024 -8.979 299 HB3 LEU 41 HB3 LEU 41 26.220 26.296 -8.874 300 HG LEU 41 HG LEU 41 27.419 28.422 -7.040 301 HD11 LEU 41 HD11 LEU 41 25.949 27.424 -5.347 302 HD12 LEU 41 HD12 LEU 41 25.288 26.297 -6.555 303 HD13 LEU 41 HD13 LEU 41 25.005 28.049 -6.709 304 HD21 LEU 41 HD21 LEU 41 27.660 25.386 -7.011 305 HD22 LEU 41 HD22 LEU 41 28.110 26.441 -5.650 306 HD23 LEU 41 HD23 LEU 41 28.984 26.557 -7.175 307 H ARG 42 H ARG 42 26.766 28.629 -11.733 308 HA ARG 42 HA ARG 42 26.167 26.408 -13.375 309 HB2 ARG 42 HB2 ARG 42 25.836 28.006 -15.164 310 HB3 ARG 42 HB3 ARG 42 25.270 28.665 -13.631 311 HG2 ARG 42 HG2 ARG 42 27.407 29.998 -13.459 312 HG3 ARG 42 HG3 ARG 42 27.926 29.321 -15.005 313 HD2 ARG 42 HD2 ARG 42 25.856 30.338 -16.063 314 HD3 ARG 42 HD3 ARG 42 25.532 31.130 -14.521 315 HE ARG 42 HE ARG 42 27.420 32.554 -14.812 316 HH11 ARG 42 HH11 ARG 42 27.292 30.386 -17.593 317 HH12 ARG 42 HH12 ARG 42 28.487 31.333 -18.436 318 HH21 ARG 42 HH21 ARG 42 28.828 33.594 -15.830 319 HH22 ARG 42 HH22 ARG 42 29.364 33.173 -17.461 320 H GLU 43 H GLU 43 29.320 27.911 -13.100 321 HA GLU 43 HA GLU 43 30.482 26.361 -15.298 322 HB2 GLU 43 HB2 GLU 43 32.398 27.521 -13.452 323 HB3 GLU 43 HB3 GLU 43 32.181 27.814 -15.159 324 HG2 GLU 43 HG2 GLU 43 30.628 29.614 -14.714 325 HG3 GLU 43 HG3 GLU 43 30.548 29.229 -12.998 326 H GLN 44 H GLN 44 29.529 25.461 -12.162 327 HA GLN 44 HA GLN 44 31.943 23.901 -11.500 328 HB2 GLN 44 HB2 GLN 44 29.555 24.924 -9.894 329 HB3 GLN 44 HB3 GLN 44 30.783 23.870 -9.266 330 HG2 GLN 44 HG2 GLN 44 31.133 26.192 -8.604 331 HG3 GLN 44 HG3 GLN 44 32.465 25.452 -9.466 332 HE21 GLN 44 HE21 GLN 44 33.562 27.301 -10.169 333 HE22 GLN 44 HE22 GLN 44 32.797 28.425 -11.289 334 H ILE 45 H ILE 45 28.571 23.671 -12.488 335 HA ILE 45 HA ILE 45 27.778 21.213 -11.370 336 HB ILE 45 HB ILE 45 26.563 21.032 -13.737 337 HG12 ILE 45 HG12 ILE 45 26.851 24.049 -13.572 338 HG13 ILE 45 HG13 ILE 45 27.827 23.072 -14.680 339 HG21 ILE 45 HG21 ILE 45 24.688 22.184 -12.756 340 HG22 ILE 45 HG22 ILE 45 25.584 21.329 -11.492 341 HG23 ILE 45 HG23 ILE 45 25.760 23.113 -11.674 342 HD11 ILE 45 HD11 ILE 45 24.791 23.324 -14.700 343 HD12 ILE 45 HD12 ILE 45 25.938 23.965 -15.885 344 HD13 ILE 45 HD13 ILE 45 25.725 22.210 -15.730 345 H ARG 46 H ARG 46 28.750 21.388 -14.902 346 HA ARG 46 HA ARG 46 30.175 20.404 -16.089 347 HB2 ARG 46 HB2 ARG 46 31.502 19.436 -13.537 348 HB3 ARG 46 HB3 ARG 46 32.195 19.249 -15.152 349 HG2 ARG 46 HG2 ARG 46 32.415 21.616 -15.469 350 HG3 ARG 46 HG3 ARG 46 31.425 21.988 -14.049 351 HD2 ARG 46 HD2 ARG 46 33.086 20.897 -12.593 352 HD3 ARG 46 HD3 ARG 46 34.132 20.638 -14.013 353 HE ARG 46 HE ARG 46 33.283 23.415 -13.748 354 HH11 ARG 46 HH11 ARG 46 35.713 21.217 -12.498 355 HH12 ARG 46 HH12 ARG 46 36.806 22.515 -12.097 356 HH21 ARG 46 HH21 ARG 46 34.683 24.994 -13.239 357 HH22 ARG 46 HH22 ARG 46 36.225 24.628 -12.514 358 H ASP 47 H ASP 47 28.249 18.591 -14.066 359 HA ASP 47 HA ASP 47 27.940 16.598 -16.264 360 HB2 ASP 47 HB2 ASP 47 29.649 15.777 -14.530 361 HB3 ASP 47 HB3 ASP 47 28.322 15.721 -13.373 362 H ALA 48 H ALA 48 26.637 18.136 -13.347 363 HA ALA 48 HA ALA 48 24.043 16.816 -13.580 364 HB1 ALA 48 HB1 ALA 48 24.983 17.426 -11.374 365 HB2 ALA 48 HB2 ALA 48 24.945 19.136 -11.832 366 HB3 ALA 48 HB3 ALA 48 23.429 18.221 -11.686 367 H ARG 49 H ARG 49 22.102 17.789 -14.107 368 HA ARG 49 HA ARG 49 22.010 20.008 -15.956 369 HB2 ARG 49 HB2 ARG 49 20.170 18.016 -14.838 370 HB3 ARG 49 HB3 ARG 49 19.446 19.581 -14.702 371 HG2 ARG 49 HG2 ARG 49 18.839 18.431 -16.786 372 HG3 ARG 49 HG3 ARG 49 19.586 20.005 -17.036 373 HD2 ARG 49 HD2 ARG 49 20.264 18.152 -18.638 374 HD3 ARG 49 HD3 ARG 49 21.584 19.061 -17.897 375 HE ARG 49 HE ARG 49 21.305 16.878 -16.200 376 HH11 ARG 49 HH21 ARG 49 21.968 17.143 -19.638 377 HH12 ARG 49 HH22 ARG 49 22.992 15.734 -19.621 378 HH21 ARG 49 HH11 ARG 49 22.623 15.207 -16.212 379 HH22 ARG 49 HH12 ARG 49 23.363 14.648 -17.700 380 H TYR 50 H TYR 50 20.887 19.785 -12.498 381 HA TYR 50 HA TYR 50 21.107 22.775 -12.389 382 HB2 TYR 50 HB2 TYR 50 19.085 21.104 -10.908 383 HB3 TYR 50 HB3 TYR 50 19.008 22.806 -11.298 384 HD1 TYR 50 HD1 TYR 50 19.378 22.931 -14.193 385 HD2 TYR 50 HD2 TYR 50 17.249 20.033 -11.838 386 HE1 TYR 50 HE1 TYR 50 17.945 22.412 -16.153 387 HE2 TYR 50 HE2 TYR 50 15.807 19.501 -13.803 388 HH TYR 50 HH TYR 50 16.249 21.098 -16.967 389 H ALA 51 H ALA 51 22.202 23.657 -10.631 390 HA ALA 51 HA ALA 51 22.705 21.896 -8.258 391 HB1 ALA 51 HB1 ALA 51 24.795 22.591 -9.283 392 HB2 ALA 51 HB2 ALA 51 24.274 24.293 -9.278 393 HB3 ALA 51 HB3 ALA 51 24.558 23.449 -7.744 394 H VAL 52 H VAL 52 22.054 22.653 -6.243 395 HA VAL 52 HA VAL 52 20.457 25.176 -6.128 396 HB VAL 52 HB VAL 52 19.502 22.390 -5.401 397 HG11 VAL 52 HG11 VAL 52 18.207 25.092 -4.826 398 HG12 VAL 52 HG12 VAL 52 17.360 23.535 -4.733 399 HG13 VAL 52 HG13 VAL 52 18.698 23.866 -3.637 400 HG21 VAL 52 HG21 VAL 52 17.647 22.944 -6.973 401 HG22 VAL 52 HG22 VAL 52 18.499 24.437 -7.413 402 HG23 VAL 52 HG23 VAL 52 19.218 22.851 -7.763 403 H ILE 53 H ILE 53 20.421 26.221 -4.180 404 HA ILE 53 HA ILE 53 22.337 25.187 -2.162 405 HB ILE 53 HB ILE 53 22.160 27.637 -3.765 406 HG12 ILE 53 HG12 ILE 53 24.009 26.067 -3.887 407 HG13 ILE 53 HG13 ILE 53 24.537 27.678 -3.441 408 HG21 ILE 53 HG21 ILE 53 22.722 28.091 -0.808 409 HG22 ILE 53 HG22 ILE 53 23.190 29.188 -2.125 410 HG23 ILE 53 HG23 ILE 53 21.491 28.866 -1.814 411 HD11 ILE 53 HD11 ILE 53 24.501 26.835 -0.975 412 HD12 ILE 53 HD12 ILE 53 24.369 25.215 -1.669 413 HD13 ILE 53 HD13 ILE 53 25.768 26.226 -2.045 414 H ARG 54 H ARG 54 21.821 24.942 -0.164 415 HA ARG 54 HA ARG 54 19.797 26.742 1.131 416 HB2 ARG 54 HB2 ARG 54 20.377 23.804 1.656 417 HB3 ARG 54 HB3 ARG 54 19.243 24.810 2.558 418 HG2 ARG 54 HG2 ARG 54 18.988 24.042 -0.393 419 HG3 ARG 54 HG3 ARG 54 18.170 23.242 0.947 420 HD2 ARG 54 HD2 ARG 54 16.994 25.305 1.526 421 HD3 ARG 54 HD3 ARG 54 17.803 26.166 0.194 422 HE ARG 54 HE ARG 54 16.573 23.914 -0.953 423 HH11 ARG 54 HH11 ARG 54 15.419 26.762 0.727 424 HH12 ARG 54 HH12 ARG 54 13.895 26.764 -0.118 425 HH21 ARG 54 HH21 ARG 54 14.606 23.966 -2.000 426 HH22 ARG 54 HH22 ARG 54 13.455 25.212 -1.629 427 H ILE 55 H ILE 55 21.580 28.144 1.620 428 HA ILE 55 HA ILE 55 23.462 27.189 3.740 429 HB ILE 55 HB ILE 55 23.526 29.684 2.036 430 HG12 ILE 55 HG12 ILE 55 25.847 27.791 2.224 431 HG13 ILE 55 HG13 ILE 55 24.469 27.284 1.242 432 HG21 ILE 55 HG21 ILE 55 24.279 30.356 4.226 433 HG22 ILE 55 HG22 ILE 55 25.237 28.867 4.433 434 HG23 ILE 55 HG23 ILE 55 25.741 30.098 3.269 435 HD11 ILE 55 HD11 ILE 55 24.649 29.391 -0.045 436 HD12 ILE 55 HD12 ILE 55 26.056 29.863 0.934 437 HD13 ILE 55 HD13 ILE 55 26.139 28.426 -0.098 438 HA PRO 56 HA PRO 56 20.491 29.229 6.485 439 HB2 PRO 56 HB2 PRO 56 22.826 29.119 8.383 440 HB3 PRO 56 HB3 PRO 56 21.109 28.708 8.679 441 HG2 PRO 56 HG2 PRO 56 22.925 26.733 8.288 442 HG3 PRO 56 HG3 PRO 56 21.315 26.640 7.497 443 HD2 PRO 56 HD2 PRO 56 23.948 27.541 6.295 444 HD3 PRO 56 HD3 PRO 56 22.696 26.447 5.620 445 H GLY 57 H GLY 57 20.055 31.345 6.743 446 HA2 GLY 57 HA2 GLY 57 20.350 33.584 7.263 447 HA3 GLY 57 HA3 GLY 57 22.098 33.370 7.303 448 H GLN 58 H GLN 58 21.133 32.129 4.326 449 HA GLN 58 HA GLN 58 20.853 34.760 2.986 450 HB2 GLN 58 HB2 GLN 58 22.681 34.492 1.535 451 HB3 GLN 58 HB3 GLN 58 23.267 34.006 3.118 452 HG2 GLN 58 HG2 GLN 58 22.914 31.644 2.483 453 HG3 GLN 58 HG3 GLN 58 22.501 32.141 0.829 454 HE21 GLN 58 HE21 GLN 58 25.098 32.768 3.297 455 HE22 GLN 58 HE22 GLN 58 26.412 32.667 2.145 456 HA PRO 59 HA PRO 59 17.698 32.853 0.757 457 HB2 PRO 59 HB2 PRO 59 17.676 34.014 -1.726 458 HB3 PRO 59 HB3 PRO 59 17.287 34.895 -0.216 459 HG2 PRO 59 HG2 PRO 59 19.951 34.789 -1.670 460 HG3 PRO 59 HG3 PRO 59 19.069 36.238 -1.086 461 HD2 PRO 59 HD2 PRO 59 21.065 35.117 0.355 462 HD3 PRO 59 HD3 PRO 59 19.610 35.767 1.169 463 H VAL 60 H VAL 60 17.088 31.188 -0.581 464 HA VAL 60 HA VAL 60 18.964 29.317 -1.576 465 HB VAL 60 HB VAL 60 16.816 28.544 -1.008 466 HG11 VAL 60 HG11 VAL 60 15.402 30.517 -1.400 467 HG12 VAL 60 HG12 VAL 60 15.586 30.320 -3.157 468 HG13 VAL 60 HG13 VAL 60 14.731 29.097 -2.200 469 HG21 VAL 60 HG21 VAL 60 16.111 27.238 -2.912 470 HG22 VAL 60 HG22 VAL 60 16.882 28.359 -4.044 471 HG23 VAL 60 HG23 VAL 60 17.871 27.363 -2.961 472 H VAL 61 H VAL 61 20.020 29.036 -3.370 473 HA VAL 61 HA VAL 61 19.443 30.690 -5.808 474 HB VAL 61 HB VAL 61 22.084 29.530 -4.848 475 HG11 VAL 61 HG11 VAL 61 21.990 29.319 -7.298 476 HG12 VAL 61 HG12 VAL 61 21.507 31.032 -7.432 477 HG13 VAL 61 HG13 VAL 61 23.111 30.578 -6.800 478 HG21 VAL 61 HG21 VAL 61 22.814 31.883 -4.823 479 HG22 VAL 61 HG22 VAL 61 21.179 32.404 -5.285 480 HG23 VAL 61 HG23 VAL 61 21.468 31.624 -3.715 481 H GLU 62 H GLU 62 19.208 29.600 -7.791 482 HA GLU 62 HA GLU 62 19.381 26.634 -7.809 483 HB2 GLU 62 HB2 GLU 62 16.991 28.267 -8.775 484 HB3 GLU 62 HB3 GLU 62 17.225 26.529 -8.997 485 HG2 GLU 62 HG2 GLU 62 17.145 26.201 -6.546 486 HG3 GLU 62 HG3 GLU 62 16.920 27.935 -6.311 487 H VAL 63 H VAL 63 20.725 26.122 -9.474 488 HA VAL 63 HA VAL 63 21.301 28.047 -11.627 489 HB VAL 63 HB VAL 63 22.545 25.413 -10.805 490 HG11 VAL 63 HG11 VAL 63 24.557 26.203 -11.978 491 HG12 VAL 63 HG12 VAL 63 23.217 25.883 -13.074 492 HG13 VAL 63 HG13 VAL 63 23.613 27.567 -12.633 493 HG21 VAL 63 HG21 VAL 63 23.647 28.164 -10.168 494 HG22 VAL 63 HG22 VAL 63 22.770 27.156 -8.991 495 HG23 VAL 63 HG23 VAL 63 24.263 26.577 -9.693 496 H GLY 64 H GLY 64 21.355 27.355 -13.902 497 HA2 GLY 64 HA2 GLY 64 20.672 26.189 -15.741 498 HA3 GLY 64 HA3 GLY 64 20.344 24.802 -14.713 499 H THR 65 H THR 65 18.207 24.415 -14.027 500 HA THR 65 HA THR 65 16.057 26.313 -14.654 501 HB THR 65 HB THR 65 15.823 23.536 -15.863 502 HG1 THR 65 HG1 THR 65 16.106 24.576 -17.865 503 HG21 THR 65 HG21 THR 65 14.231 26.107 -16.248 504 HG22 THR 65 HG22 THR 65 13.670 24.611 -15.462 505 HG23 THR 65 HG23 THR 65 14.005 24.616 -17.190 506 H LYS 66 H LYS 66 14.220 25.924 -13.344 507 HA LYS 66 HA LYS 66 14.631 24.349 -11.030 508 HB2 LYS 66 HB2 LYS 66 13.279 26.468 -11.209 509 HB3 LYS 66 HB3 LYS 66 11.985 25.530 -11.974 510 HG2 LYS 66 HG2 LYS 66 11.872 24.085 -9.924 511 HG3 LYS 66 HG3 LYS 66 13.173 25.050 -9.206 512 HD2 LYS 66 HD2 LYS 66 11.658 27.100 -9.456 513 HD3 LYS 66 HD3 LYS 66 10.384 25.994 -9.986 514 HE2 LYS 66 HE2 LYS 66 9.945 26.287 -7.699 515 HE3 LYS 66 HE3 LYS 66 10.748 24.716 -7.785 516 HZ1 LYS 66 HZ1 LYS 66 12.856 25.901 -7.141 517 HZ2 LYS 66 HZ2 LYS 66 11.682 26.061 -6.000 518 HZ3 LYS 66 HZ3 LYS 66 12.030 27.294 -7.017 519 HA PRO 67 HA PRO 67 13.291 20.493 -12.811 520 HB2 PRO 67 HB2 PRO 67 13.557 18.839 -10.667 521 HB3 PRO 67 HB3 PRO 67 14.943 19.534 -11.570 522 HG2 PRO 67 HG2 PRO 67 13.735 20.494 -8.971 523 HG3 PRO 67 HG3 PRO 67 15.466 20.296 -9.424 524 HD2 PRO 67 HD2 PRO 67 14.169 22.716 -9.547 525 HD3 PRO 67 HD3 PRO 67 15.492 22.254 -10.661 526 H THR 68 H THR 68 11.653 19.148 -12.939 527 HA THR 68 HA THR 68 9.143 20.008 -12.011 528 HB THR 68 HB THR 68 9.633 19.265 -14.277 529 HG1 THR 68 HG1 THR 68 7.689 18.209 -14.583 530 HG21 THR 68 HG21 THR 68 9.740 16.970 -14.938 531 HG22 THR 68 HG22 THR 68 9.404 16.397 -13.296 532 HG23 THR 68 HG23 THR 68 10.961 17.174 -13.672 533 H GLY 69 H GLY 69 10.961 17.206 -10.956 534 HA2 GLY 69 HA2 GLY 69 10.124 16.413 -8.606 535 HA3 GLY 69 HA3 GLY 69 8.613 16.085 -9.473 536 H ASP 70 H ASP 70 9.697 15.195 -11.892 537 HA ASP 70 HA ASP 70 10.719 12.502 -11.297 538 HB2 ASP 70 HB2 ASP 70 10.097 13.841 -13.942 539 HB3 ASP 70 HB3 ASP 70 10.627 12.164 -13.745 540 H VAL 71 H VAL 71 12.526 13.660 -10.151 541 HA VAL 71 HA VAL 71 14.887 13.798 -11.871 542 HB VAL 71 HB VAL 71 15.741 15.766 -10.664 543 HG11 VAL 71 HG11 VAL 71 14.400 15.875 -12.897 544 HG12 VAL 71 HG12 VAL 71 13.132 16.685 -11.945 545 HG13 VAL 71 HG13 VAL 71 14.769 17.350 -12.039 546 HG21 VAL 71 HG21 VAL 71 12.943 16.141 -9.546 547 HG22 VAL 71 HG22 VAL 71 14.360 15.623 -8.612 548 HG23 VAL 71 HG23 VAL 71 14.344 17.217 -9.350 549 H LEU 72 H LEU 72 16.844 13.482 -10.845 550 HA LEU 72 HA LEU 72 16.882 11.721 -8.433 551 HB2 LEU 72 HB2 LEU 72 19.006 12.614 -10.426 552 HB3 LEU 72 HB3 LEU 72 19.321 11.511 -9.095 553 HG LEU 72 HG LEU 72 17.227 10.929 -11.181 554 HD11 LEU 72 HD11 LEU 72 18.936 9.586 -12.403 555 HD12 LEU 72 HD12 LEU 72 20.194 10.222 -11.315 556 HD13 LEU 72 HD13 LEU 72 19.318 11.312 -12.415 557 HD21 LEU 72 HD21 LEU 72 17.691 8.586 -10.528 558 HD22 LEU 72 HD22 LEU 72 17.260 9.567 -9.107 559 HD23 LEU 72 HD23 LEU 72 18.963 9.162 -9.418 560 H GLN 73 H GLN 73 17.727 12.511 -6.428 561 HA GLN 73 HA GLN 73 18.792 15.296 -6.461 562 HB2 GLN 73 HB2 GLN 73 17.167 13.708 -4.457 563 HB3 GLN 73 HB3 GLN 73 17.923 15.270 -4.132 564 HG2 GLN 73 HG2 GLN 73 16.666 16.197 -6.142 565 HG3 GLN 73 HG3 GLN 73 15.749 14.695 -6.192 566 HE21 GLN 73 HE21 GLN 73 14.942 17.571 -5.614 567 HE22 GLN 73 HE22 GLN 73 14.118 17.466 -4.050 568 H GLY 74 H GLY 74 20.888 15.429 -6.183 569 HA2 GLY 74 HA2 GLY 74 22.450 13.516 -4.488 570 HA3 GLY 74 HA3 GLY 74 23.091 14.759 -5.589 571 H ARG 75 H ARG 75 23.539 14.444 -2.566 572 HA ARG 75 HA ARG 75 22.759 17.148 -1.741 573 HB2 ARG 75 HB2 ARG 75 20.673 15.771 -1.430 574 HB3 ARG 75 HB3 ARG 75 21.544 14.779 -0.259 575 HG2 ARG 75 HG2 ARG 75 21.880 16.795 1.176 576 HG3 ARG 75 HG3 ARG 75 21.044 17.790 -0.033 577 HD2 ARG 75 HD2 ARG 75 18.994 16.466 0.256 578 HD3 ARG 75 HD3 ARG 75 19.794 15.404 1.410 579 HE ARG 75 HE ARG 75 18.760 18.110 1.859 580 HH11 ARG 75 HH11 ARG 75 20.905 15.685 3.227 581 HH12 ARG 75 HH12 ARG 75 20.778 16.352 4.829 582 HH21 ARG 75 HH21 ARG 75 18.599 18.862 3.944 583 HH22 ARG 75 HH22 ARG 75 19.510 18.107 5.216 584 H ALA 76 H ALA 76 24.102 17.961 -0.379 585 HA ALA 76 HA ALA 76 25.841 16.252 1.401 586 HB1 ALA 76 HB1 ALA 76 26.762 18.357 -0.607 587 HB2 ALA 76 HB2 ALA 76 27.816 17.497 0.544 588 HB3 ALA 76 HB3 ALA 76 26.987 16.601 -0.744 589 H THR 77 H THR 77 27.168 17.436 2.931 590 HA THR 77 HA THR 77 25.902 19.956 3.942 591 HB THR 77 HB THR 77 27.188 17.762 5.599 592 HG1 THR 77 HG1 THR 77 25.098 17.270 4.883 593 HG21 THR 77 HG21 THR 77 27.561 19.999 6.597 594 HG22 THR 77 HG22 THR 77 26.369 19.089 7.531 595 HG23 THR 77 HG23 THR 77 25.833 20.374 6.429 596 H GLY 78 H GLY 78 27.277 21.614 4.017 597 HA2 GLY 78 HA2 GLY 78 30.087 21.209 3.133 598 HA3 GLY 78 HA3 GLY 78 29.209 22.711 3.131 599 H GLU 79 H GLU 79 31.604 22.939 3.962 600 HA GLU 79 HA GLU 79 32.157 22.115 6.665 601 HB2 GLU 79 HB2 GLU 79 33.728 23.762 4.676 602 HB3 GLU 79 HB3 GLU 79 34.358 23.271 6.245 603 HG2 GLU 79 HG2 GLU 79 33.465 21.356 4.043 604 HG3 GLU 79 HG3 GLU 79 35.122 21.831 4.376 605 H GLU 80 H GLU 80 30.475 24.978 5.647 606 HA GLU 80 HA GLU 80 31.279 26.320 8.230 607 HB2 GLU 80 HB2 GLU 80 29.790 27.422 5.860 608 HB3 GLU 80 HB3 GLU 80 30.187 28.314 7.321 609 HG2 GLU 80 HG2 GLU 80 32.320 27.176 5.442 610 HG3 GLU 80 HG3 GLU 80 31.602 28.748 5.355 611 H GLY 81 H GLY 81 29.218 24.037 7.236 612 HA2 GLY 81 HA2 GLY 81 27.500 23.134 8.428 613 HA3 GLY 81 HA3 GLY 81 27.129 24.681 9.177 614 H GLU 82 H GLU 82 27.446 24.631 5.658 615 HA GLU 82 HA GLU 82 24.632 25.231 5.311 616 HB2 GLU 82 HB2 GLU 82 25.257 25.940 3.207 617 HB3 GLU 82 HB3 GLU 82 26.511 26.547 4.294 618 HG2 GLU 82 HG2 GLU 82 26.900 24.035 2.601 619 HG3 GLU 82 HG3 GLU 82 27.099 25.641 1.941 620 H THR 83 H THR 83 23.675 24.347 3.102 621 HA THR 83 HA THR 83 24.101 21.409 2.910 622 HB THR 83 HB THR 83 21.495 22.893 3.303 623 HG1 THR 83 HG1 THR 83 21.273 21.408 4.922 624 HG21 THR 83 HG21 THR 83 21.865 20.043 2.277 625 HG22 THR 83 HG22 THR 83 21.067 21.387 1.418 626 HG23 THR 83 HG23 THR 83 20.337 20.737 2.880 627 H VAL 84 H VAL 84 24.336 20.769 0.961 628 HA VAL 84 HA VAL 84 23.718 22.565 -1.391 629 HB VAL 84 HB VAL 84 25.935 20.510 -1.055 630 HG11 VAL 84 HG11 VAL 84 25.146 20.444 -3.400 631 HG12 VAL 84 HG12 VAL 84 25.269 22.222 -3.496 632 HG13 VAL 84 HG13 VAL 84 26.717 21.209 -3.270 633 HG21 VAL 84 HG21 VAL 84 25.865 23.541 -1.295 634 HG22 VAL 84 HG22 VAL 84 26.497 22.574 0.057 635 HG23 VAL 84 HG23 VAL 84 27.334 22.590 -1.509 636 H LEU 85 H LEU 85 22.641 21.770 -3.139 637 HA LEU 85 HA LEU 85 21.804 18.938 -3.111 638 HB2 LEU 85 HB2 LEU 85 20.002 20.335 -2.107 639 HB3 LEU 85 HB3 LEU 85 20.014 21.357 -3.527 640 HG LEU 85 HG LEU 85 19.356 19.219 -4.868 641 HD11 LEU 85 HD11 LEU 85 18.452 18.284 -2.111 642 HD12 LEU 85 HD12 LEU 85 19.868 17.625 -2.927 643 HD13 LEU 85 HD13 LEU 85 18.277 17.448 -3.677 644 HD21 LEU 85 HD21 LEU 85 16.982 19.444 -4.239 645 HD22 LEU 85 HD22 LEU 85 17.776 21.007 -4.453 646 HD23 LEU 85 HD23 LEU 85 17.455 20.398 -2.813 647 H VAL 86 H VAL 86 21.478 18.099 -5.099 648 HA VAL 86 HA VAL 86 22.108 19.673 -7.580 649 HB VAL 86 HB VAL 86 23.318 16.940 -6.966 650 HG11 VAL 86 HG11 VAL 86 23.541 18.772 -9.384 651 HG12 VAL 86 HG12 VAL 86 24.528 17.313 -9.099 652 HG13 VAL 86 HG13 VAL 86 22.787 17.162 -9.347 653 HG21 VAL 86 HG21 VAL 86 25.494 18.120 -7.093 654 HG22 VAL 86 HG22 VAL 86 24.642 19.678 -7.226 655 HG23 VAL 86 HG23 VAL 86 24.516 18.706 -5.740 656 H GLU 87 H GLU 87 20.810 19.091 -9.346 657 HA GLU 87 HA GLU 87 19.002 16.797 -8.920 658 HB2 GLU 87 HB2 GLU 87 17.961 19.556 -9.579 659 HB3 GLU 87 HB3 GLU 87 17.027 18.055 -9.478 660 HG2 GLU 87 HG2 GLU 87 17.920 17.838 -7.068 661 HG3 GLU 87 HG3 GLU 87 18.497 19.493 -7.225 662 H GLU 88 H GLU 88 18.620 15.621 -10.532 663 HA GLU 88 HA GLU 88 19.537 16.340 -13.309 664 HB2 GLU 88 HB2 GLU 88 20.141 14.041 -11.478 665 HB3 GLU 88 HB3 GLU 88 20.092 13.721 -13.212 666 HG2 GLU 88 HG2 GLU 88 21.884 15.824 -11.984 667 HG3 GLU 88 HG3 GLU 88 22.315 14.110 -12.108 668 HA PRO 89 HA PRO 89 15.555 14.680 -14.582 669 HB2 PRO 89 HB2 PRO 89 16.101 13.670 -17.084 670 HB3 PRO 89 HB3 PRO 89 15.953 15.416 -16.719 671 HG2 PRO 89 HG2 PRO 89 18.505 13.765 -16.868 672 HG3 PRO 89 HG3 PRO 89 18.154 15.333 -17.668 673 HD2 PRO 89 HD2 PRO 89 19.520 15.194 -15.353 674 HD3 PRO 89 HD3 PRO 89 18.313 16.497 -15.600 675 H ARG 90 H ARG 90 14.497 12.842 -14.138 676 HA ARG 90 HA ARG 90 15.965 10.308 -13.688 677 HB2 ARG 90 HB2 ARG 90 14.551 11.267 -11.911 678 HB3 ARG 90 HB3 ARG 90 13.129 11.118 -12.943 679 HG2 ARG 90 HG2 ARG 90 13.336 8.670 -12.966 680 HG3 ARG 90 HG3 ARG 90 14.832 8.792 -12.017 681 HD2 ARG 90 HD2 ARG 90 13.127 8.307 -10.449 682 HD3 ARG 90 HD3 ARG 90 13.519 10.031 -10.260 683 HE ARG 90 HE ARG 90 11.307 9.799 -12.044 684 HH11 ARG 90 HH21 ARG 90 11.954 9.130 -8.669 685 HH12 ARG 90 HH22 ARG 90 10.311 9.443 -8.187 686 HH21 ARG 90 HH11 ARG 90 9.209 10.353 -11.319 687 HH22 ARG 90 HH12 ARG 90 8.815 10.045 -9.654 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 1.538 -6.680 -2.918 2 H2 GLY 1 H2 GLY 1 2.753 -6.365 -3.969 3 H3 GLY 1 H3 GLY 1 1.472 -7.269 -4.444 4 HA2 GLY 1 HA2 GLY 1 -0.026 -5.393 -4.200 5 HA3 GLY 1 HA3 GLY 1 1.367 -4.415 -3.702 6 H SER 2 H SER 2 0.964 -2.965 -5.434 7 HA SER 2 HA SER 2 1.092 -3.896 -8.222 8 HB2 SER 2 HB2 SER 2 -0.427 -2.060 -7.323 9 HB3 SER 2 HB3 SER 2 1.016 -1.032 -7.241 10 HG SER 2 HG SER 2 -0.138 -0.841 -9.231 11 H GLU 3 H GLU 3 2.478 -2.691 -9.760 12 HA GLU 3 HA GLU 3 5.304 -2.936 -9.164 13 HB2 GLU 3 HB2 GLU 3 5.684 -2.112 -11.402 14 HB3 GLU 3 HB3 GLU 3 4.415 -3.336 -11.401 15 HG2 GLU 3 HG2 GLU 3 2.689 -1.533 -11.537 16 HG3 GLU 3 HG3 GLU 3 3.971 -0.319 -11.565 17 H THR 4 H THR 4 6.929 -1.180 -9.421 18 HA THR 4 HA THR 4 6.310 1.565 -9.070 19 HB THR 4 HB THR 4 7.249 0.139 -6.534 20 HG1 THR 4 HG1 THR 4 4.909 0.631 -7.335 21 HG21 THR 4 HG21 THR 4 8.511 2.239 -6.722 22 HG22 THR 4 HG22 THR 4 7.240 2.430 -5.513 23 HG23 THR 4 HG23 THR 4 7.028 3.129 -7.135 24 H ARG 5 H ARG 5 7.956 2.256 -10.366 25 HA ARG 5 HA ARG 5 10.351 1.178 -10.960 26 HB2 ARG 5 HB2 ARG 5 11.158 3.484 -11.497 27 HB3 ARG 5 HB3 ARG 5 9.573 3.070 -12.145 28 HG2 ARG 5 HG2 ARG 5 8.451 4.387 -10.392 29 HG3 ARG 5 HG3 ARG 5 10.006 4.757 -9.638 30 HD2 ARG 5 HD2 ARG 5 10.715 5.959 -11.682 31 HD3 ARG 5 HD3 ARG 5 9.155 5.567 -12.440 32 HE ARG 5 HE ARG 5 8.730 6.862 -9.905 33 HH11 ARG 5 HH22 ARG 5 9.608 7.712 -13.227 34 HH12 ARG 5 HH21 ARG 5 8.930 9.333 -13.000 35 HH21 ARG 5 HH11 ARG 5 7.932 8.985 -9.833 36 HH22 ARG 5 HH12 ARG 5 8.100 9.969 -11.291 37 H THR 6 H THR 6 12.224 0.704 -10.136 38 HA THR 6 HA THR 6 12.795 1.184 -7.343 39 HB THR 6 HB THR 6 13.146 -0.955 -8.584 40 HG1 THR 6 HG1 THR 6 14.961 -1.435 -7.378 41 HG21 THR 6 HG21 THR 6 14.374 -0.054 -10.579 42 HG22 THR 6 HG22 THR 6 15.234 -1.358 -9.748 43 HG23 THR 6 HG23 THR 6 15.753 0.324 -9.524 44 H ILE 7 H ILE 7 15.115 1.607 -6.655 45 HA ILE 7 HA ILE 7 16.394 3.895 -8.082 46 HB ILE 7 HB ILE 7 15.922 3.714 -5.084 47 HG12 ILE 7 HG12 ILE 7 14.814 5.662 -7.158 48 HG13 ILE 7 HG13 ILE 7 13.891 4.397 -6.340 49 HG21 ILE 7 HG21 ILE 7 17.051 5.899 -4.959 50 HG22 ILE 7 HG22 ILE 7 18.141 4.712 -5.636 51 HG23 ILE 7 HG23 ILE 7 17.333 5.879 -6.715 52 HD11 ILE 7 HD11 ILE 7 13.344 6.446 -5.285 53 HD12 ILE 7 HD12 ILE 7 14.355 5.529 -4.149 54 HD13 ILE 7 HD13 ILE 7 15.040 6.896 -5.070 55 H SER 8 H SER 8 18.567 3.656 -8.285 56 HA SER 8 HA SER 8 19.814 1.205 -7.085 57 HB2 SER 8 HB2 SER 8 20.228 2.445 -9.827 58 HB3 SER 8 HB3 SER 8 21.023 0.985 -9.203 59 HG SER 8 HG SER 8 19.190 0.497 -10.496 60 H SER 9 H SER 9 21.633 1.456 -5.943 61 HA SER 9 HA SER 9 23.204 3.552 -5.498 62 HB2 SER 9 HB2 SER 9 24.180 0.682 -5.572 63 HB3 SER 9 HB3 SER 9 24.775 1.994 -4.540 64 HG SER 9 HG SER 9 23.295 0.657 -3.433 65 H THR 10 H THR 10 23.017 3.066 -8.520 66 HA THR 10 HA THR 10 25.803 3.894 -9.169 67 HB THR 10 HB THR 10 25.099 3.407 -11.538 68 HG1 THR 10 HG1 THR 10 23.346 1.966 -11.744 69 HG21 THR 10 HG21 THR 10 25.428 0.980 -11.372 70 HG22 THR 10 HG22 THR 10 25.024 1.017 -9.638 71 HG23 THR 10 HG23 THR 10 26.499 1.816 -10.230 72 H ALA 11 H ALA 11 22.451 4.502 -10.401 73 HA ALA 11 HA ALA 11 23.123 7.158 -11.296 74 HB1 ALA 11 HB1 ALA 11 21.439 5.703 -12.354 75 HB2 ALA 11 HB2 ALA 11 20.422 5.797 -10.897 76 HB3 ALA 11 HB3 ALA 11 20.733 7.253 -11.866 77 H GLN 12 H GLN 12 21.507 5.973 -8.307 78 HA GLN 12 HA GLN 12 21.164 8.776 -7.357 79 HB2 GLN 12 HB2 GLN 12 19.397 7.133 -7.046 80 HB3 GLN 12 HB3 GLN 12 20.474 6.099 -6.113 81 HG2 GLN 12 HG2 GLN 12 18.878 7.357 -4.703 82 HG3 GLN 12 HG3 GLN 12 20.551 7.695 -4.293 83 HE21 GLN 12 HE21 GLN 12 21.383 9.808 -4.680 84 HE22 GLN 12 HE22 GLN 12 20.236 11.150 -4.798 85 H GLU 13 H GLU 13 23.570 6.237 -7.047 86 HA GLU 13 HA GLU 13 24.926 7.465 -4.799 87 HB2 GLU 13 HB2 GLU 13 25.042 5.077 -5.472 88 HB3 GLU 13 HB3 GLU 13 25.921 5.555 -6.932 89 HG2 GLU 13 HG2 GLU 13 27.532 4.754 -5.456 90 HG3 GLU 13 HG3 GLU 13 27.728 6.502 -5.403 91 H ARG 14 H ARG 14 25.569 7.527 -8.260 92 HA ARG 14 HA ARG 14 27.881 9.045 -8.262 93 HB2 ARG 14 HB2 ARG 14 27.690 9.360 -10.596 94 HB3 ARG 14 HB3 ARG 14 27.166 7.751 -10.152 95 HG2 ARG 14 HG2 ARG 14 25.489 8.168 -11.562 96 HG3 ARG 14 HG3 ARG 14 24.735 8.916 -10.168 97 HD2 ARG 14 HD2 ARG 14 24.444 10.357 -12.078 98 HD3 ARG 14 HD3 ARG 14 25.566 11.157 -10.968 99 HE ARG 14 HE ARG 14 27.139 9.660 -12.767 100 HH11 ARG 14 HH12 ARG 14 24.856 12.374 -13.174 101 HH12 ARG 14 HH11 ARG 14 25.883 13.010 -14.463 102 HH21 ARG 14 HH22 ARG 14 28.233 10.658 -14.496 103 HH22 ARG 14 HH21 ARG 14 27.519 12.143 -15.142 104 H VAL 15 H VAL 15 24.626 10.299 -8.188 105 HA VAL 15 HA VAL 15 25.337 13.086 -8.447 106 HB VAL 15 HB VAL 15 23.130 13.597 -7.498 107 HG11 VAL 15 HG11 VAL 15 21.814 12.739 -9.341 108 HG12 VAL 15 HG12 VAL 15 23.426 13.207 -9.904 109 HG13 VAL 15 HG13 VAL 15 23.028 11.492 -9.687 110 HG21 VAL 15 HG21 VAL 15 22.874 11.636 -5.966 111 HG22 VAL 15 HG22 VAL 15 21.496 11.866 -7.055 112 HG23 VAL 15 HG23 VAL 15 22.677 10.593 -7.392 113 H ASP 16 H ASP 16 25.699 10.890 -5.737 114 HA ASP 16 HA ASP 16 25.551 12.971 -3.704 115 HB2 ASP 16 HB2 ASP 16 25.194 10.538 -3.288 116 HB3 ASP 16 HB3 ASP 16 26.907 10.253 -3.590 117 H LEU 17 H LEU 17 28.299 11.460 -5.420 118 HA LEU 17 HA LEU 17 30.333 12.719 -3.929 119 HB2 LEU 17 HB2 LEU 17 30.339 11.514 -6.745 120 HB3 LEU 17 HB3 LEU 17 31.773 12.080 -5.930 121 HG LEU 17 HG LEU 17 31.757 9.743 -5.777 122 HD11 LEU 17 HD11 LEU 17 32.519 10.965 -3.747 123 HD12 LEU 17 HD12 LEU 17 31.919 9.332 -3.406 124 HD13 LEU 17 HD13 LEU 17 30.905 10.735 -3.031 125 HD21 LEU 17 HD21 LEU 17 29.079 9.748 -4.352 126 HD22 LEU 17 HD22 LEU 17 30.066 8.358 -4.815 127 HD23 LEU 17 HD23 LEU 17 29.310 9.347 -6.072 128 H GLU 18 H GLU 18 28.826 13.686 -6.962 129 HA GLU 18 HA GLU 18 30.383 16.097 -7.337 130 HB2 GLU 18 HB2 GLU 18 28.671 16.615 -9.046 131 HB3 GLU 18 HB3 GLU 18 29.398 15.012 -9.199 132 HG2 GLU 18 HG2 GLU 18 27.345 14.093 -7.939 133 HG3 GLU 18 HG3 GLU 18 26.668 15.700 -8.085 134 H ALA 19 H ALA 19 27.383 15.384 -5.416 135 HA ALA 19 HA ALA 19 26.821 18.180 -4.896 136 HB1 ALA 19 HB1 ALA 19 26.203 15.743 -3.191 137 HB2 ALA 19 HB2 ALA 19 25.360 17.309 -3.219 138 HB3 ALA 19 HB3 ALA 19 25.280 16.218 -4.624 139 H VAL 20 H VAL 20 28.897 15.715 -3.297 140 HA VAL 20 HA VAL 20 29.832 17.463 -1.168 141 HB VAL 20 HB VAL 20 31.009 14.927 -2.337 142 HG11 VAL 20 HG11 VAL 20 32.831 16.133 -1.223 143 HG12 VAL 20 HG12 VAL 20 31.800 16.437 0.195 144 HG13 VAL 20 HG13 VAL 20 32.316 14.785 -0.213 145 HG21 VAL 20 HG21 VAL 20 30.105 13.882 -0.295 146 HG22 VAL 20 HG22 VAL 20 29.461 15.447 0.246 147 HG23 VAL 20 HG23 VAL 20 28.802 14.655 -1.197 148 H ARG 21 H ARG 21 31.144 16.743 -4.419 149 HA ARG 21 HA ARG 21 33.372 18.469 -4.296 150 HB2 ARG 21 HB2 ARG 21 32.885 16.861 -6.135 151 HB3 ARG 21 HB3 ARG 21 31.584 17.902 -6.702 152 HG2 ARG 21 HG2 ARG 21 33.638 18.136 -8.032 153 HG3 ARG 21 HG3 ARG 21 33.104 19.652 -7.313 154 HD2 ARG 21 HD2 ARG 21 35.553 19.399 -7.236 155 HD3 ARG 21 HD3 ARG 21 34.854 19.539 -5.618 156 HE ARG 21 HE ARG 21 35.141 16.764 -6.431 157 HH11 ARG 21 HH11 ARG 21 37.102 19.422 -5.263 158 HH12 ARG 21 HH12 ARG 21 38.263 18.361 -4.512 159 HH21 ARG 21 HH21 ARG 21 36.656 15.462 -5.443 160 HH22 ARG 21 HH22 ARG 21 38.018 16.176 -4.632 161 H LEU 22 H LEU 22 29.969 19.383 -5.234 162 HA LEU 22 HA LEU 22 30.643 22.194 -5.357 163 HB2 LEU 22 HB2 LEU 22 28.077 20.660 -5.430 164 HB3 LEU 22 HB3 LEU 22 28.068 22.374 -4.958 165 HG LEU 22 HG LEU 22 29.460 22.879 -7.032 166 HD11 LEU 22 HD11 LEU 22 30.222 20.621 -7.625 167 HD12 LEU 22 HD12 LEU 22 29.216 21.286 -8.919 168 HD13 LEU 22 HD13 LEU 22 28.536 20.080 -7.811 169 HD21 LEU 22 HD21 LEU 22 27.108 23.389 -6.768 170 HD22 LEU 22 HD22 LEU 22 26.666 21.777 -7.390 171 HD23 LEU 22 HD23 LEU 22 27.498 22.959 -8.446 172 H ALA 23 H ALA 23 29.468 20.220 -2.565 173 HA ALA 23 HA ALA 23 29.239 22.434 -0.790 174 HB1 ALA 23 HB1 ALA 23 29.779 20.764 0.963 175 HB2 ALA 23 HB2 ALA 23 28.589 20.168 -0.211 176 HB3 ALA 23 HB3 ALA 23 30.276 19.613 -0.296 177 H SER 24 H SER 24 32.140 20.651 -1.811 178 HA SER 24 HA SER 24 34.047 22.274 -0.482 179 HB2 SER 24 HB2 SER 24 34.596 20.784 -3.067 180 HB3 SER 24 HB3 SER 24 35.724 21.246 -1.800 181 HG SER 24 HG SER 24 33.604 19.336 -1.599 182 H ILE 25 H ILE 25 32.658 22.758 -3.841 183 HA ILE 25 HA ILE 25 34.407 25.011 -4.296 184 HB ILE 25 HB ILE 25 31.766 24.771 -5.685 185 HG12 ILE 25 HG12 ILE 25 32.499 22.552 -6.026 186 HG13 ILE 25 HG13 ILE 25 32.874 23.432 -7.448 187 HG21 ILE 25 HG21 ILE 25 33.057 25.751 -7.534 188 HG22 ILE 25 HG22 ILE 25 33.220 26.749 -6.098 189 HG23 ILE 25 HG23 ILE 25 34.545 25.687 -6.580 190 HD11 ILE 25 HD11 ILE 25 35.269 23.469 -6.829 191 HD12 ILE 25 HD12 ILE 25 34.876 22.561 -5.338 192 HD13 ILE 25 HD13 ILE 25 34.592 21.826 -6.914 193 H VAL 26 H VAL 26 31.169 24.643 -2.822 194 HA VAL 26 HA VAL 26 30.567 27.499 -2.577 195 HB VAL 26 HB VAL 26 29.554 25.046 -1.108 196 HG11 VAL 26 HG11 VAL 26 28.454 27.885 -1.144 197 HG12 VAL 26 HG12 VAL 26 27.596 26.459 -0.511 198 HG13 VAL 26 HG13 VAL 26 29.082 26.998 0.265 199 HG21 VAL 26 HG21 VAL 26 27.679 25.074 -2.606 200 HG22 VAL 26 HG22 VAL 26 28.118 26.666 -3.263 201 HG23 VAL 26 HG23 VAL 26 29.059 25.226 -3.669 202 H ASP 27 H ASP 27 32.056 25.037 -0.267 203 HA ASP 27 HA ASP 27 32.587 26.931 1.808 204 HB2 ASP 27 HB2 ASP 27 34.181 24.512 0.886 205 HB3 ASP 27 HB3 ASP 27 34.517 25.430 2.351 206 H SER 28 H SER 28 34.477 26.186 -1.097 207 HA SER 28 HA SER 28 36.620 27.997 -0.593 208 HB2 SER 28 HB2 SER 28 35.552 27.213 -3.337 209 HB3 SER 28 HB3 SER 28 37.147 27.863 -2.958 210 HG SER 28 HG SER 28 36.063 25.347 -2.149 211 H ARG 29 H ARG 29 33.362 28.636 -1.695 212 HA ARG 29 HA ARG 29 33.861 31.492 -2.285 213 HB2 ARG 29 HB2 ARG 29 32.238 30.022 -3.553 214 HB3 ARG 29 HB3 ARG 29 31.249 29.925 -2.111 215 HG2 ARG 29 HG2 ARG 29 30.253 31.518 -3.462 216 HG3 ARG 29 HG3 ARG 29 31.014 32.434 -2.160 217 HD2 ARG 29 HD2 ARG 29 32.842 33.082 -3.680 218 HD3 ARG 29 HD3 ARG 29 32.182 32.020 -4.938 219 HE ARG 29 HE ARG 29 30.220 33.970 -4.048 220 HH11 ARG 29 HH11 ARG 29 33.136 33.868 -5.976 221 HH12 ARG 29 HH12 ARG 29 32.600 35.139 -7.040 222 HH21 ARG 29 HH22 ARG 29 29.455 35.400 -5.644 223 HH22 ARG 29 HH21 ARG 29 30.603 36.029 -6.791 224 H LEU 30 H LEU 30 32.393 29.560 0.403 225 HA LEU 30 HA LEU 30 31.588 31.886 1.902 226 HB2 LEU 30 HB2 LEU 30 32.234 29.085 2.897 227 HB3 LEU 30 HB3 LEU 30 31.410 30.344 3.812 228 HG LEU 30 HG LEU 30 30.358 28.953 1.328 229 HD11 LEU 30 HD11 LEU 30 29.294 28.937 4.167 230 HD12 LEU 30 HD12 LEU 30 30.286 27.631 3.474 231 HD13 LEU 30 HD13 LEU 30 28.692 28.004 2.789 232 HD21 LEU 30 HD21 LEU 30 28.235 30.171 1.772 233 HD22 LEU 30 HD22 LEU 30 29.531 31.233 1.240 234 HD23 LEU 30 HD23 LEU 30 29.085 31.173 2.968 235 H ILE 31 H ILE 31 34.558 29.921 2.038 236 HA ILE 31 HA ILE 31 35.939 31.480 4.004 237 HB ILE 31 HB ILE 31 36.906 29.613 1.801 238 HG12 ILE 31 HG12 ILE 31 36.681 29.106 4.805 239 HG13 ILE 31 HG13 ILE 31 35.390 28.701 3.689 240 HG21 ILE 31 HG21 ILE 31 39.042 29.439 3.080 241 HG22 ILE 31 HG22 ILE 31 38.795 31.051 2.439 242 HG23 ILE 31 HG23 ILE 31 38.486 30.732 4.161 243 HD11 ILE 31 HD11 ILE 31 38.169 27.478 3.703 244 HD12 ILE 31 HD12 ILE 31 36.629 26.709 4.102 245 HD13 ILE 31 HD13 ILE 31 36.954 27.203 2.431 246 H GLY 32 H GLY 32 35.574 31.873 0.536 247 HA2 GLY 32 HA2 GLY 32 37.623 33.868 0.107 248 HA3 GLY 32 HA3 GLY 32 36.334 33.412 -1.003 249 H THR 33 H THR 33 34.189 34.241 -0.591 250 HA THR 33 HA THR 33 34.312 37.009 0.476 251 HB THR 33 HB THR 33 34.218 36.672 -1.959 252 HG1 THR 33 HG1 THR 33 32.562 38.127 -2.325 253 HG21 THR 33 HG21 THR 33 32.237 35.846 -3.060 254 HG22 THR 33 HG22 THR 33 31.388 35.631 -1.510 255 HG23 THR 33 HG23 THR 33 32.776 34.604 -1.907 256 H GLY 34 H GLY 34 32.298 34.089 0.785 257 HA2 GLY 34 HA2 GLY 34 31.095 33.749 2.710 258 HA3 GLY 34 HA3 GLY 34 30.850 35.470 2.955 259 H SER 35 H SER 35 30.055 34.635 -0.215 260 HA SER 35 HA SER 35 27.297 33.791 0.234 261 HB2 SER 35 HB2 SER 35 27.987 36.440 -1.103 262 HB3 SER 35 HB3 SER 35 26.403 35.647 -1.176 263 HG SER 35 HG SER 35 26.549 37.257 0.471 264 H VAL 36 H VAL 36 26.569 32.489 -1.510 265 HA VAL 36 HA VAL 36 28.314 32.369 -3.947 266 HB VAL 36 HB VAL 36 28.205 30.360 -2.476 267 HG11 VAL 36 HG11 VAL 36 25.806 30.551 -1.776 268 HG12 VAL 36 HG12 VAL 36 25.324 30.103 -3.423 269 HG13 VAL 36 HG13 VAL 36 26.251 28.961 -2.424 270 HG21 VAL 36 HG21 VAL 36 28.710 30.287 -4.894 271 HG22 VAL 36 HG22 VAL 36 27.948 28.806 -4.292 272 HG23 VAL 36 HG23 VAL 36 26.989 29.973 -5.230 273 H ASP 37 H ASP 37 27.336 32.375 -5.991 274 HA ASP 37 HA ASP 37 24.521 33.261 -6.143 275 HB2 ASP 37 HB2 ASP 37 26.756 34.403 -7.830 276 HB3 ASP 37 HB3 ASP 37 25.123 35.009 -7.620 277 H GLU 38 H GLU 38 23.567 32.940 -8.283 278 HA GLU 38 HA GLU 38 23.903 30.364 -9.242 279 HB2 GLU 38 HB2 GLU 38 22.009 32.192 -9.603 280 HB3 GLU 38 HB3 GLU 38 22.887 32.527 -11.097 281 HG2 GLU 38 HG2 GLU 38 22.717 29.956 -11.525 282 HG3 GLU 38 HG3 GLU 38 21.565 29.945 -10.192 283 H ASP 39 H ASP 39 25.464 33.348 -10.610 284 HA ASP 39 HA ASP 39 26.578 32.132 -12.855 285 HB2 ASP 39 HB2 ASP 39 26.132 34.550 -12.489 286 HB3 ASP 39 HB3 ASP 39 27.389 34.587 -11.248 287 H PHE 40 H PHE 40 27.632 32.060 -9.456 288 HA PHE 40 HA PHE 40 30.394 31.322 -10.136 289 HB2 PHE 40 HB2 PHE 40 29.849 32.567 -8.087 290 HB3 PHE 40 HB3 PHE 40 28.831 31.241 -7.533 291 HD1 PHE 40 HD1 PHE 40 32.354 32.223 -8.298 292 HD2 PHE 40 HD2 PHE 40 29.772 29.256 -6.536 293 HE1 PHE 40 HE1 PHE 40 34.319 31.148 -7.213 294 HE2 PHE 40 HE2 PHE 40 31.710 28.238 -5.395 295 HZ PHE 40 HZ PHE 40 33.997 29.169 -5.736 296 H LEU 41 H LEU 41 27.326 29.673 -9.626 297 HA LEU 41 HA LEU 41 28.606 26.999 -9.345 298 HB2 LEU 41 HB2 LEU 41 25.782 28.063 -8.988 299 HB3 LEU 41 HB3 LEU 41 26.170 26.353 -8.836 300 HG LEU 41 HG LEU 41 27.265 28.610 -7.102 301 HD11 LEU 41 HD11 LEU 41 24.902 28.031 -6.680 302 HD12 LEU 41 HD12 LEU 41 25.935 27.524 -5.332 303 HD13 LEU 41 HD13 LEU 41 25.347 26.316 -6.497 304 HD21 LEU 41 HD21 LEU 41 28.994 26.898 -7.214 305 HD22 LEU 41 HD22 LEU 41 27.789 25.607 -6.993 306 HD23 LEU 41 HD23 LEU 41 28.159 26.732 -5.674 307 H ARG 42 H ARG 42 26.648 28.697 -11.808 308 HA ARG 42 HA ARG 42 26.079 26.363 -13.352 309 HB2 ARG 42 HB2 ARG 42 25.654 27.863 -15.196 310 HB3 ARG 42 HB3 ARG 42 25.070 28.585 -13.701 311 HG2 ARG 42 HG2 ARG 42 27.133 30.007 -13.607 312 HG3 ARG 42 HG3 ARG 42 27.672 29.294 -15.137 313 HD2 ARG 42 HD2 ARG 42 25.528 30.132 -16.199 314 HD3 ARG 42 HD3 ARG 42 25.177 30.973 -14.688 315 HE ARG 42 HE ARG 42 26.990 32.482 -15.065 316 HH11 ARG 42 HH11 ARG 42 26.834 30.262 -17.802 317 HH12 ARG 42 HH12 ARG 42 27.912 31.268 -18.731 318 HH21 ARG 42 HH21 ARG 42 28.254 33.593 -16.177 319 HH22 ARG 42 HH22 ARG 42 28.726 33.183 -17.831 320 H GLU 43 H GLU 43 29.125 28.104 -13.139 321 HA GLU 43 HA GLU 43 30.422 26.430 -15.153 322 HB2 GLU 43 HB2 GLU 43 32.472 27.677 -14.424 323 HB3 GLU 43 HB3 GLU 43 31.153 28.652 -15.074 324 HG2 GLU 43 HG2 GLU 43 30.546 29.442 -12.879 325 HG3 GLU 43 HG3 GLU 43 31.617 28.285 -12.106 326 H GLN 44 H GLN 44 29.391 25.412 -12.170 327 HA GLN 44 HA GLN 44 31.842 23.772 -11.685 328 HB2 GLN 44 HB2 GLN 44 29.673 24.423 -9.674 329 HB3 GLN 44 HB3 GLN 44 31.267 23.732 -9.370 330 HG2 GLN 44 HG2 GLN 44 30.650 26.536 -10.314 331 HG3 GLN 44 HG3 GLN 44 31.106 26.102 -8.681 332 HE21 GLN 44 HE21 GLN 44 32.416 28.061 -10.161 333 HE22 GLN 44 HE22 GLN 44 34.044 27.518 -10.546 334 H ILE 45 H ILE 45 28.508 23.636 -12.630 335 HA ILE 45 HA ILE 45 27.713 21.135 -11.572 336 HB ILE 45 HB ILE 45 26.486 21.009 -13.935 337 HG12 ILE 45 HG12 ILE 45 26.685 24.005 -13.765 338 HG13 ILE 45 HG13 ILE 45 27.799 23.094 -14.806 339 HG21 ILE 45 HG21 ILE 45 25.778 23.015 -11.791 340 HG22 ILE 45 HG22 ILE 45 24.653 22.207 -12.924 341 HG23 ILE 45 HG23 ILE 45 25.516 21.242 -11.717 342 HD11 ILE 45 HD11 ILE 45 25.913 23.847 -16.124 343 HD12 ILE 45 HD12 ILE 45 25.844 22.078 -15.976 344 HD13 ILE 45 HD13 ILE 45 24.759 23.103 -15.006 345 H ARG 46 H ARG 46 28.905 21.414 -15.057 346 HA ARG 46 HA ARG 46 30.361 20.485 -16.141 347 HB2 ARG 46 HB2 ARG 46 31.451 19.060 -13.683 348 HB3 ARG 46 HB3 ARG 46 32.229 19.093 -15.260 349 HG2 ARG 46 HG2 ARG 46 31.733 21.525 -13.502 350 HG3 ARG 46 HG3 ARG 46 33.255 20.659 -13.661 351 HD2 ARG 46 HD2 ARG 46 33.400 21.283 -16.042 352 HD3 ARG 46 HD3 ARG 46 31.833 22.089 -15.944 353 HE ARG 46 HE ARG 46 32.719 23.773 -14.503 354 HH11 ARG 46 HH11 ARG 46 35.329 21.798 -15.783 355 HH12 ARG 46 HH12 ARG 46 36.528 22.979 -15.333 356 HH21 ARG 46 HH21 ARG 46 34.204 25.136 -13.934 357 HH22 ARG 46 HH22 ARG 46 35.900 24.876 -14.302 358 H ASP 47 H ASP 47 28.035 18.754 -14.663 359 HA ASP 47 HA ASP 47 27.642 17.187 -17.035 360 HB2 ASP 47 HB2 ASP 47 29.366 15.727 -15.851 361 HB3 ASP 47 HB3 ASP 47 28.203 15.520 -14.544 362 H ALA 48 H ALA 48 26.742 17.933 -13.712 363 HA ALA 48 HA ALA 48 24.195 16.621 -13.646 364 HB1 ALA 48 HB1 ALA 48 23.828 18.022 -11.660 365 HB2 ALA 48 HB2 ALA 48 25.421 17.241 -11.612 366 HB3 ALA 48 HB3 ALA 48 25.286 18.961 -12.025 367 H ARG 49 H ARG 49 22.083 17.549 -13.700 368 HA ARG 49 HA ARG 49 21.758 19.472 -15.860 369 HB2 ARG 49 HB2 ARG 49 20.294 17.348 -15.197 370 HB3 ARG 49 HB3 ARG 49 19.447 18.499 -14.167 371 HG2 ARG 49 HG2 ARG 49 18.224 18.470 -16.173 372 HG3 ARG 49 HG3 ARG 49 19.179 19.959 -16.284 373 HD2 ARG 49 HD2 ARG 49 20.826 18.790 -17.724 374 HD3 ARG 49 HD3 ARG 49 19.898 17.285 -17.563 375 HE ARG 49 HE ARG 49 18.151 19.305 -18.532 376 HH11 ARG 49 HH21 ARG 49 20.907 17.494 -19.722 377 HH12 ARG 49 HH22 ARG 49 20.403 17.637 -21.383 378 HH21 ARG 49 HH12 ARG 49 17.565 19.448 -20.687 379 HH22 ARG 49 HH11 ARG 49 18.564 18.713 -21.905 380 H TYR 50 H TYR 50 20.709 19.540 -12.412 381 HA TYR 50 HA TYR 50 20.830 22.536 -12.482 382 HB2 TYR 50 HB2 TYR 50 18.886 20.945 -10.814 383 HB3 TYR 50 HB3 TYR 50 18.765 22.607 -11.326 384 HD1 TYR 50 HD2 TYR 50 18.898 22.620 -14.207 385 HD2 TYR 50 HD1 TYR 50 17.138 19.661 -11.621 386 HE1 TYR 50 HE2 TYR 50 17.271 22.044 -15.986 387 HE2 TYR 50 HE1 TYR 50 15.549 19.031 -13.432 388 HH TYR 50 HH TYR 50 15.514 20.704 -16.587 389 H ALA 51 H ALA 51 22.065 23.509 -10.785 390 HA ALA 51 HA ALA 51 22.690 21.818 -8.396 391 HB1 ALA 51 HB1 ALA 51 24.699 22.560 -9.541 392 HB2 ALA 51 HB2 ALA 51 24.127 24.248 -9.528 393 HB3 ALA 51 HB3 ALA 51 24.519 23.433 -8.002 394 H VAL 52 H VAL 52 22.185 22.621 -6.333 395 HA VAL 52 HA VAL 52 20.457 25.066 -6.165 396 HB VAL 52 HB VAL 52 19.785 22.180 -5.516 397 HG11 VAL 52 HG11 VAL 52 18.344 24.657 -4.514 398 HG12 VAL 52 HG12 VAL 52 17.653 23.026 -4.499 399 HG13 VAL 52 HG13 VAL 52 19.072 23.382 -3.515 400 HG21 VAL 52 HG21 VAL 52 17.722 22.723 -6.798 401 HG22 VAL 52 HG22 VAL 52 18.381 24.332 -7.141 402 HG23 VAL 52 HG23 VAL 52 19.185 22.876 -7.764 403 H ILE 53 H ILE 53 20.514 26.209 -4.292 404 HA ILE 53 HA ILE 53 22.292 25.203 -2.133 405 HB ILE 53 HB ILE 53 22.061 27.768 -3.613 406 HG12 ILE 53 HG12 ILE 53 23.928 26.201 -3.927 407 HG13 ILE 53 HG13 ILE 53 24.434 27.801 -3.409 408 HG21 ILE 53 HG21 ILE 53 21.433 28.754 -1.519 409 HG22 ILE 53 HG22 ILE 53 22.700 27.878 -0.643 410 HG23 ILE 53 HG23 ILE 53 23.129 29.126 -1.823 411 HD11 ILE 53 HD11 ILE 53 24.583 26.880 -1.022 412 HD12 ILE 53 HD12 ILE 53 24.338 25.271 -1.710 413 HD13 ILE 53 HD13 ILE 53 25.750 26.227 -2.182 414 H ARG 54 H ARG 54 21.666 25.048 -0.183 415 HA ARG 54 HA ARG 54 19.611 26.838 1.033 416 HB2 ARG 54 HB2 ARG 54 20.206 23.905 1.573 417 HB3 ARG 54 HB3 ARG 54 19.044 24.897 2.451 418 HG2 ARG 54 HG2 ARG 54 18.821 24.111 -0.496 419 HG3 ARG 54 HG3 ARG 54 18.056 23.258 0.842 420 HD2 ARG 54 HD2 ARG 54 16.783 25.253 1.460 421 HD3 ARG 54 HD3 ARG 54 17.529 26.171 0.155 422 HE ARG 54 HE ARG 54 15.407 24.149 -0.050 423 HH11 ARG 54 HH11 ARG 54 17.775 25.965 -1.994 424 HH12 ARG 54 HH12 ARG 54 16.750 25.716 -3.425 425 HH21 ARG 54 HH21 ARG 54 14.313 23.963 -2.059 426 HH22 ARG 54 HH22 ARG 54 15.064 24.733 -3.463 427 H ILE 55 H ILE 55 21.548 28.174 1.505 428 HA ILE 55 HA ILE 55 23.305 27.159 3.698 429 HB ILE 55 HB ILE 55 23.512 29.696 2.057 430 HG12 ILE 55 HG12 ILE 55 25.699 27.626 2.223 431 HG13 ILE 55 HG13 ILE 55 24.331 27.300 1.157 432 HG21 ILE 55 HG21 ILE 55 25.723 29.953 3.328 433 HG22 ILE 55 HG22 ILE 55 24.275 30.228 4.287 434 HG23 ILE 55 HG23 ILE 55 25.160 28.692 4.430 435 HD11 ILE 55 HD11 ILE 55 24.765 29.437 -0.002 436 HD12 ILE 55 HD12 ILE 55 26.126 29.753 1.098 437 HD13 ILE 55 HD13 ILE 55 26.193 28.373 -0.003 438 HA PRO 56 HA PRO 56 20.433 29.374 6.445 439 HB2 PRO 56 HB2 PRO 56 22.723 28.982 8.369 440 HB3 PRO 56 HB3 PRO 56 20.970 28.729 8.630 441 HG2 PRO 56 HG2 PRO 56 22.598 26.608 8.207 442 HG3 PRO 56 HG3 PRO 56 21.008 26.689 7.375 443 HD2 PRO 56 HD2 PRO 56 23.741 27.416 6.272 444 HD3 PRO 56 HD3 PRO 56 22.440 26.423 5.535 445 H GLY 57 H GLY 57 20.209 31.549 6.855 446 HA2 GLY 57 HA2 GLY 57 20.750 33.706 7.440 447 HA3 GLY 57 HA3 GLY 57 22.457 33.280 7.508 448 H GLN 58 H GLN 58 21.356 32.335 4.460 449 HA GLN 58 HA GLN 58 21.484 35.020 3.231 450 HB2 GLN 58 HB2 GLN 58 23.308 34.598 1.828 451 HB3 GLN 58 HB3 GLN 58 23.788 33.957 3.397 452 HG2 GLN 58 HG2 GLN 58 23.315 31.708 2.666 453 HG3 GLN 58 HG3 GLN 58 22.830 32.271 1.053 454 HE21 GLN 58 HE21 GLN 58 25.636 32.650 3.355 455 HE22 GLN 58 HE22 GLN 58 26.835 32.696 2.088 456 HA PRO 59 HA PRO 59 18.218 33.566 0.805 457 HB2 PRO 59 HB2 PRO 59 18.521 34.688 -1.696 458 HB3 PRO 59 HB3 PRO 59 18.061 35.599 -0.225 459 HG2 PRO 59 HG2 PRO 59 20.831 35.281 -1.427 460 HG3 PRO 59 HG3 PRO 59 20.020 36.792 -0.895 461 HD2 PRO 59 HD2 PRO 59 21.779 35.527 0.695 462 HD3 PRO 59 HD3 PRO 59 20.294 36.237 1.395 463 H VAL 60 H VAL 60 17.530 31.910 -0.388 464 HA VAL 60 HA VAL 60 19.250 29.807 -1.369 465 HB VAL 60 HB VAL 60 16.286 30.474 -1.616 466 HG11 VAL 60 HG11 VAL 60 15.958 28.155 -2.516 467 HG12 VAL 60 HG12 VAL 60 16.664 29.288 -3.660 468 HG13 VAL 60 HG13 VAL 60 17.711 28.101 -2.860 469 HG21 VAL 60 HG21 VAL 60 16.087 28.445 -0.177 470 HG22 VAL 60 HG22 VAL 60 17.864 28.316 -0.160 471 HG23 VAL 60 HG23 VAL 60 17.062 29.713 0.577 472 H VAL 61 H VAL 61 20.171 29.455 -3.226 473 HA VAL 61 HA VAL 61 19.130 30.830 -5.664 474 HB VAL 61 HB VAL 61 21.148 31.903 -4.813 475 HG11 VAL 61 HG11 VAL 61 22.409 30.085 -3.873 476 HG12 VAL 61 HG12 VAL 61 22.607 29.321 -5.477 477 HG13 VAL 61 HG13 VAL 61 23.365 30.888 -5.121 478 HG21 VAL 61 HG21 VAL 61 21.645 30.568 -7.502 479 HG22 VAL 61 HG22 VAL 61 20.499 31.912 -7.237 480 HG23 VAL 61 HG23 VAL 61 22.218 32.153 -6.924 481 H GLU 62 H GLU 62 19.071 29.699 -7.588 482 HA GLU 62 HA GLU 62 19.718 26.798 -7.504 483 HB2 GLU 62 HB2 GLU 62 16.965 27.913 -8.195 484 HB3 GLU 62 HB3 GLU 62 17.482 26.221 -8.266 485 HG2 GLU 62 HG2 GLU 62 18.018 26.432 -5.768 486 HG3 GLU 62 HG3 GLU 62 17.160 27.970 -5.790 487 H VAL 63 H VAL 63 20.679 26.170 -9.313 488 HA VAL 63 HA VAL 63 20.987 28.043 -11.560 489 HB VAL 63 HB VAL 63 22.447 25.466 -10.918 490 HG11 VAL 63 HG11 VAL 63 22.969 26.203 -13.158 491 HG12 VAL 63 HG12 VAL 63 23.218 27.877 -12.582 492 HG13 VAL 63 HG13 VAL 63 24.331 26.576 -12.108 493 HG21 VAL 63 HG21 VAL 63 22.722 26.963 -8.944 494 HG22 VAL 63 HG22 VAL 63 24.197 26.701 -9.851 495 HG23 VAL 63 HG23 VAL 63 23.326 28.233 -10.037 496 H GLY 64 H GLY 64 20.937 27.222 -13.831 497 HA2 GLY 64 HA2 GLY 64 20.208 25.919 -15.539 498 HA3 GLY 64 HA3 GLY 64 19.994 24.585 -14.418 499 H THR 65 H THR 65 17.895 24.222 -13.493 500 HA THR 65 HA THR 65 15.690 26.055 -13.946 501 HB THR 65 HB THR 65 15.354 23.357 -15.318 502 HG1 THR 65 HG1 THR 65 16.546 25.650 -16.239 503 HG21 THR 65 HG21 THR 65 13.810 25.983 -15.476 504 HG22 THR 65 HG22 THR 65 13.235 24.435 -14.810 505 HG23 THR 65 HG23 THR 65 13.538 24.583 -16.535 506 H LYS 66 H LYS 66 13.809 25.422 -12.719 507 HA LYS 66 HA LYS 66 14.245 23.663 -10.509 508 HB2 LYS 66 HB2 LYS 66 12.758 25.651 -10.452 509 HB3 LYS 66 HB3 LYS 66 11.659 24.872 -11.599 510 HG2 LYS 66 HG2 LYS 66 11.223 23.068 -9.923 511 HG3 LYS 66 HG3 LYS 66 12.308 23.890 -8.781 512 HD2 LYS 66 HD2 LYS 66 10.832 25.880 -8.808 513 HD3 LYS 66 HD3 LYS 66 9.764 25.077 -9.983 514 HE2 LYS 66 HE2 LYS 66 9.348 23.249 -8.342 515 HE3 LYS 66 HE3 LYS 66 10.392 24.066 -7.169 516 HZ1 LYS 66 HZ1 LYS 66 7.873 25.193 -8.288 517 HZ2 LYS 66 HZ2 LYS 66 8.837 25.951 -7.204 518 HZ3 LYS 66 HZ3 LYS 66 8.048 24.584 -6.783 519 HA PRO 67 HA PRO 67 13.210 19.875 -12.661 520 HB2 PRO 67 HB2 PRO 67 13.216 18.112 -10.600 521 HB3 PRO 67 HB3 PRO 67 14.720 18.931 -11.152 522 HG2 PRO 67 HG2 PRO 67 12.890 19.735 -8.864 523 HG3 PRO 67 HG3 PRO 67 14.665 19.491 -8.851 524 HD2 PRO 67 HD2 PRO 67 13.571 21.951 -9.185 525 HD3 PRO 67 HD3 PRO 67 15.055 21.476 -10.067 526 H THR 68 H THR 68 11.606 18.383 -12.938 527 HA THR 68 HA THR 68 8.967 19.225 -12.246 528 HB THR 68 HB THR 68 9.673 18.460 -14.471 529 HG1 THR 68 HG1 THR 68 7.758 17.378 -14.894 530 HG21 THR 68 HG21 THR 68 10.952 16.386 -13.762 531 HG22 THR 68 HG22 THR 68 9.785 16.133 -15.068 532 HG23 THR 68 HG23 THR 68 9.380 15.619 -13.423 533 H GLY 69 H GLY 69 10.886 16.580 -11.039 534 HA2 GLY 69 HA2 GLY 69 10.099 15.830 -8.686 535 HA3 GLY 69 HA3 GLY 69 8.587 15.417 -9.516 536 H ASP 70 H ASP 70 9.760 14.503 -11.918 537 HA ASP 70 HA ASP 70 10.733 11.821 -11.287 538 HB2 ASP 70 HB2 ASP 70 10.402 13.214 -13.955 539 HB3 ASP 70 HB3 ASP 70 10.670 11.481 -13.697 540 H VAL 71 H VAL 71 12.536 13.019 -10.029 541 HA VAL 71 HA VAL 71 14.971 13.211 -11.700 542 HB VAL 71 HB VAL 71 15.709 15.221 -10.504 543 HG11 VAL 71 HG11 VAL 71 14.446 15.264 -12.754 544 HG12 VAL 71 HG12 VAL 71 13.070 15.933 -11.852 545 HG13 VAL 71 HG13 VAL 71 14.634 16.767 -11.881 546 HG21 VAL 71 HG21 VAL 71 12.880 15.495 -9.435 547 HG22 VAL 71 HG22 VAL 71 14.292 15.017 -8.469 548 HG23 VAL 71 HG23 VAL 71 14.247 16.611 -9.208 549 H LEU 72 H LEU 72 16.915 13.098 -10.637 550 HA LEU 72 HA LEU 72 17.077 11.373 -8.207 551 HB2 LEU 72 HB2 LEU 72 19.097 12.292 -10.316 552 HB3 LEU 72 HB3 LEU 72 19.514 11.260 -8.950 553 HG LEU 72 HG LEU 72 17.343 10.481 -10.887 554 HD11 LEU 72 HD11 LEU 72 20.316 9.898 -11.186 555 HD12 LEU 72 HD12 LEU 72 19.320 10.898 -12.266 556 HD13 LEU 72 HD13 LEU 72 19.013 9.161 -12.155 557 HD21 LEU 72 HD21 LEU 72 19.244 8.887 -9.127 558 HD22 LEU 72 HD22 LEU 72 17.972 8.190 -10.160 559 HD23 LEU 72 HD23 LEU 72 17.528 9.208 -8.779 560 H GLN 73 H GLN 73 17.960 12.258 -6.226 561 HA GLN 73 HA GLN 73 18.930 15.081 -6.365 562 HB2 GLN 73 HB2 GLN 73 17.326 13.498 -4.325 563 HB3 GLN 73 HB3 GLN 73 17.997 15.103 -4.056 564 HG2 GLN 73 HG2 GLN 73 16.698 15.893 -6.094 565 HG3 GLN 73 HG3 GLN 73 15.875 14.337 -6.106 566 HE21 GLN 73 HE21 GLN 73 15.132 17.328 -5.420 567 HE22 GLN 73 HE22 GLN 73 14.213 17.130 -3.918 568 H GLY 74 H GLY 74 21.081 15.244 -5.993 569 HA2 GLY 74 HA2 GLY 74 22.445 13.358 -4.092 570 HA3 GLY 74 HA3 GLY 74 23.252 14.384 -5.278 571 H ARG 75 H ARG 75 23.709 14.393 -2.367 572 HA ARG 75 HA ARG 75 22.952 17.171 -1.678 573 HB2 ARG 75 HB2 ARG 75 21.025 15.655 -1.035 574 HB3 ARG 75 HB3 ARG 75 22.109 14.833 0.090 575 HG2 ARG 75 HG2 ARG 75 22.418 16.995 1.321 576 HG3 ARG 75 HG3 ARG 75 21.330 17.791 0.168 577 HD2 ARG 75 HD2 ARG 75 19.500 16.281 0.841 578 HD3 ARG 75 HD3 ARG 75 20.566 15.436 1.960 579 HE ARG 75 HE ARG 75 19.246 18.011 2.335 580 HH11 ARG 75 HH11 ARG 75 21.929 16.082 3.538 581 HH12 ARG 75 HH12 ARG 75 22.002 16.966 5.036 582 HH21 ARG 75 HH21 ARG 75 19.375 19.054 4.296 583 HH22 ARG 75 HH22 ARG 75 20.606 18.613 5.436 584 H ALA 76 H ALA 76 24.092 18.074 -0.016 585 HA ALA 76 HA ALA 76 26.168 16.590 1.457 586 HB1 ALA 76 HB1 ALA 76 28.069 17.880 0.467 587 HB2 ALA 76 HB2 ALA 76 27.270 16.839 -0.721 588 HB3 ALA 76 HB3 ALA 76 26.935 18.584 -0.720 589 H THR 77 H THR 77 27.477 18.002 2.868 590 HA THR 77 HA THR 77 26.366 20.711 3.436 591 HB THR 77 HB THR 77 26.679 18.420 5.386 592 HG1 THR 77 HG1 THR 77 24.799 20.502 5.120 593 HG21 THR 77 HG21 THR 77 27.927 20.099 6.550 594 HG22 THR 77 HG22 THR 77 26.299 20.113 7.229 595 HG23 THR 77 HG23 THR 77 26.794 21.382 6.083 596 H GLY 78 H GLY 78 27.936 22.124 3.216 597 HA2 GLY 78 HA2 GLY 78 30.731 21.517 3.143 598 HA3 GLY 78 HA3 GLY 78 29.971 23.110 3.180 599 H GLU 79 H GLU 79 32.201 23.025 4.368 600 HA GLU 79 HA GLU 79 32.613 22.296 7.000 601 HB2 GLU 79 HB2 GLU 79 34.215 23.248 5.297 602 HB3 GLU 79 HB3 GLU 79 33.450 24.824 5.506 603 HG2 GLU 79 HG2 GLU 79 35.429 24.809 6.769 604 HG3 GLU 79 HG3 GLU 79 34.081 24.752 7.913 605 H GLU 80 H GLU 80 31.230 25.670 5.938 606 HA GLU 80 HA GLU 80 30.773 26.353 8.478 607 HB2 GLU 80 HB2 GLU 80 29.339 27.262 5.965 608 HB3 GLU 80 HB3 GLU 80 29.630 28.224 7.412 609 HG2 GLU 80 HG2 GLU 80 31.727 27.282 5.403 610 HG3 GLU 80 HG3 GLU 80 31.055 28.848 5.685 611 H GLY 81 H GLY 81 28.971 23.890 7.474 612 HA2 GLY 81 HA2 GLY 81 27.236 22.948 8.447 613 HA3 GLY 81 HA3 GLY 81 26.831 24.466 9.261 614 H GLU 82 H GLU 82 27.147 24.232 5.741 615 HA GLU 82 HA GLU 82 24.388 25.135 5.449 616 HB2 GLU 82 HB2 GLU 82 25.130 25.915 3.320 617 HB3 GLU 82 HB3 GLU 82 26.248 26.434 4.574 618 HG2 GLU 82 HG2 GLU 82 27.665 25.870 2.835 619 HG3 GLU 82 HG3 GLU 82 27.747 24.450 3.870 620 H THR 83 H THR 83 23.893 24.390 2.758 621 HA THR 83 HA THR 83 24.024 21.497 2.629 622 HB THR 83 HB THR 83 21.390 22.902 3.071 623 HG1 THR 83 HG1 THR 83 22.924 21.731 4.615 624 HG21 THR 83 HG21 THR 83 21.826 20.122 1.906 625 HG22 THR 83 HG22 THR 83 20.988 21.486 1.118 626 HG23 THR 83 HG23 THR 83 20.284 20.747 2.554 627 H VAL 84 H VAL 84 24.626 21.074 0.731 628 HA VAL 84 HA VAL 84 23.775 22.640 -1.668 629 HB VAL 84 HB VAL 84 26.034 20.672 -1.175 630 HG11 VAL 84 HG11 VAL 84 25.127 21.726 -3.894 631 HG12 VAL 84 HG12 VAL 84 26.650 20.871 -3.552 632 HG13 VAL 84 HG13 VAL 84 25.129 20.019 -3.370 633 HG21 VAL 84 HG21 VAL 84 27.373 22.567 -2.112 634 HG22 VAL 84 HG22 VAL 84 25.890 23.527 -2.227 635 HG23 VAL 84 HG23 VAL 84 26.496 23.003 -0.644 636 H LEU 85 H LEU 85 22.612 21.738 -3.246 637 HA LEU 85 HA LEU 85 21.906 18.868 -3.124 638 HB2 LEU 85 HB2 LEU 85 20.038 20.204 -2.143 639 HB3 LEU 85 HB3 LEU 85 19.973 21.152 -3.610 640 HG LEU 85 HG LEU 85 19.499 18.862 -4.820 641 HD11 LEU 85 HD11 LEU 85 18.481 17.155 -3.503 642 HD12 LEU 85 HD12 LEU 85 18.554 18.135 -2.016 643 HD13 LEU 85 HD13 LEU 85 20.034 17.487 -2.725 644 HD21 LEU 85 HD21 LEU 85 17.093 19.023 -4.281 645 HD22 LEU 85 HD22 LEU 85 17.825 20.594 -4.632 646 HD23 LEU 85 HD23 LEU 85 17.475 20.137 -2.947 647 H VAL 86 H VAL 86 21.700 17.969 -5.071 648 HA VAL 86 HA VAL 86 22.042 19.571 -7.578 649 HB VAL 86 HB VAL 86 24.297 18.682 -6.930 650 HG11 VAL 86 HG11 VAL 86 23.506 16.497 -6.023 651 HG12 VAL 86 HG12 VAL 86 23.175 15.962 -7.687 652 HG13 VAL 86 HG13 VAL 86 24.826 16.366 -7.181 653 HG21 VAL 86 HG21 VAL 86 23.178 17.579 -9.529 654 HG22 VAL 86 HG22 VAL 86 23.716 19.252 -9.273 655 HG23 VAL 86 HG23 VAL 86 24.884 17.920 -9.153 656 H GLU 87 H GLU 87 20.964 18.735 -9.416 657 HA GLU 87 HA GLU 87 19.270 16.383 -8.865 658 HB2 GLU 87 HB2 GLU 87 18.128 19.097 -9.586 659 HB3 GLU 87 HB3 GLU 87 17.226 17.584 -9.409 660 HG2 GLU 87 HG2 GLU 87 18.081 17.456 -7.020 661 HG3 GLU 87 HG3 GLU 87 18.763 19.070 -7.223 662 H GLU 88 H GLU 88 18.827 15.172 -10.485 663 HA GLU 88 HA GLU 88 19.389 16.049 -13.294 664 HB2 GLU 88 HB2 GLU 88 20.084 13.277 -12.268 665 HB3 GLU 88 HB3 GLU 88 20.420 13.989 -13.842 666 HG2 GLU 88 HG2 GLU 88 21.869 15.691 -12.502 667 HG3 GLU 88 HG3 GLU 88 21.788 14.461 -11.219 668 HA PRO 89 HA PRO 89 15.482 14.028 -14.340 669 HB2 PRO 89 HB2 PRO 89 16.040 12.969 -16.832 670 HB3 PRO 89 HB3 PRO 89 15.654 14.689 -16.520 671 HG2 PRO 89 HG2 PRO 89 18.410 13.417 -16.743 672 HG3 PRO 89 HG3 PRO 89 17.795 14.883 -17.580 673 HD2 PRO 89 HD2 PRO 89 19.274 15.104 -15.363 674 HD3 PRO 89 HD3 PRO 89 17.824 16.134 -15.547 675 H ARG 90 H ARG 90 14.633 12.150 -13.943 676 HA ARG 90 HA ARG 90 16.294 9.793 -13.250 677 HB2 ARG 90 HB2 ARG 90 14.562 10.663 -11.674 678 HB3 ARG 90 HB3 ARG 90 13.311 10.189 -12.833 679 HG2 ARG 90 HG2 ARG 90 13.989 7.827 -12.639 680 HG3 ARG 90 HG3 ARG 90 15.331 8.281 -11.564 681 HD2 ARG 90 HD2 ARG 90 13.745 9.135 -9.901 682 HD3 ARG 90 HD3 ARG 90 12.382 8.761 -10.983 683 HE ARG 90 HE ARG 90 13.920 6.391 -10.564 684 HH11 ARG 90 HH11 ARG 90 11.739 8.428 -8.735 685 HH12 ARG 90 HH12 ARG 90 11.196 7.113 -7.733 686 HH21 ARG 90 HH21 ARG 90 13.219 4.753 -9.224 687 HH22 ARG 90 HH22 ARG 90 11.940 5.061 -8.087 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 1.362 -8.013 -5.087 2 H2 GLY 1 H2 GLY 1 0.247 -7.858 -3.900 3 H3 GLY 1 H3 GLY 1 1.842 -7.758 -3.542 4 HA2 GLY 1 HA2 GLY 1 0.331 -5.838 -5.201 5 HA3 GLY 1 HA3 GLY 1 0.841 -5.563 -3.523 6 H SER 2 H SER 2 1.506 -4.133 -6.076 7 HA SER 2 HA SER 2 4.067 -4.617 -7.021 8 HB2 SER 2 HB2 SER 2 2.722 -1.906 -6.711 9 HB3 SER 2 HB3 SER 2 4.048 -2.307 -7.822 10 HG SER 2 HG SER 2 1.998 -2.395 -8.845 11 H GLU 3 H GLU 3 6.114 -4.030 -6.579 12 HA GLU 3 HA GLU 3 6.905 -3.570 -3.912 13 HB2 GLU 3 HB2 GLU 3 9.166 -3.605 -4.740 14 HB3 GLU 3 HB3 GLU 3 8.203 -4.845 -5.540 15 HG2 GLU 3 HG2 GLU 3 7.970 -3.313 -7.534 16 HG3 GLU 3 HG3 GLU 3 9.030 -2.155 -6.724 17 H THR 4 H THR 4 8.366 -1.962 -3.039 18 HA THR 4 HA THR 4 7.227 0.645 -3.089 19 HB THR 4 HB THR 4 9.909 -0.198 -1.926 20 HG1 THR 4 HG1 THR 4 8.688 -0.608 -0.069 21 HG21 THR 4 HG21 THR 4 9.608 2.238 -1.828 22 HG22 THR 4 HG22 THR 4 9.403 1.548 -0.217 23 HG23 THR 4 HG23 THR 4 7.971 2.034 -1.155 24 H ARG 5 H ARG 5 7.802 2.540 -4.021 25 HA ARG 5 HA ARG 5 9.369 2.677 -6.414 26 HB2 ARG 5 HB2 ARG 5 8.398 4.870 -4.533 27 HB3 ARG 5 HB3 ARG 5 9.127 5.159 -6.116 28 HG2 ARG 5 HG2 ARG 5 7.300 3.885 -7.218 29 HG3 ARG 5 HG3 ARG 5 6.578 3.544 -5.635 30 HD2 ARG 5 HD2 ARG 5 5.358 5.348 -6.609 31 HD3 ARG 5 HD3 ARG 5 6.294 5.990 -5.251 32 HE ARG 5 HE ARG 5 7.719 6.242 -7.770 33 HH11 ARG 5 HH11 ARG 5 5.159 7.787 -5.952 34 HH12 ARG 5 HH12 ARG 5 5.402 9.331 -6.727 35 HH21 ARG 5 HH21 ARG 5 7.991 8.246 -8.723 36 HH22 ARG 5 HH22 ARG 5 6.966 9.571 -8.262 37 H THR 6 H THR 6 11.473 2.419 -6.557 38 HA THR 6 HA THR 6 13.387 3.592 -4.587 39 HB THR 6 HB THR 6 13.413 0.698 -5.567 40 HG1 THR 6 HG1 THR 6 11.761 0.844 -4.161 41 HG21 THR 6 HG21 THR 6 15.635 1.506 -5.011 42 HG22 THR 6 HG22 THR 6 15.083 0.397 -3.752 43 HG23 THR 6 HG23 THR 6 15.059 2.152 -3.456 44 H ILE 7 H ILE 7 15.209 4.410 -5.574 45 HA ILE 7 HA ILE 7 15.737 3.722 -8.447 46 HB ILE 7 HB ILE 7 16.597 6.225 -7.030 47 HG12 ILE 7 HG12 ILE 7 14.224 5.826 -8.890 48 HG13 ILE 7 HG13 ILE 7 14.118 6.178 -7.184 49 HG21 ILE 7 HG21 ILE 7 17.999 5.508 -8.976 50 HG22 ILE 7 HG22 ILE 7 16.534 5.462 -9.987 51 HG23 ILE 7 HG23 ILE 7 17.133 6.992 -9.307 52 HD11 ILE 7 HD11 ILE 7 15.282 8.353 -7.569 53 HD12 ILE 7 HD12 ILE 7 15.167 8.041 -9.325 54 HD13 ILE 7 HD13 ILE 7 13.687 8.203 -8.354 55 H SER 8 H SER 8 17.440 2.540 -8.792 56 HA SER 8 HA SER 8 19.150 1.365 -7.179 57 HB2 SER 8 HB2 SER 8 19.857 2.310 -9.981 58 HB3 SER 8 HB3 SER 8 20.564 0.912 -9.149 59 HG SER 8 HG SER 8 18.874 0.297 -10.563 60 H SER 9 H SER 9 20.990 1.646 -6.057 61 HA SER 9 HA SER 9 22.542 3.994 -5.921 62 HB2 SER 9 HB2 SER 9 23.244 1.151 -5.110 63 HB3 SER 9 HB3 SER 9 24.030 2.645 -4.528 64 HG SER 9 HG SER 9 22.422 1.915 -3.073 65 H THR 10 H THR 10 22.549 3.912 -8.445 66 HA THR 10 HA THR 10 25.319 3.581 -9.321 67 HB THR 10 HB THR 10 24.486 2.821 -11.584 68 HG1 THR 10 HG1 THR 10 22.519 1.665 -11.568 69 HG21 THR 10 HG21 THR 10 25.616 1.234 -10.005 70 HG22 THR 10 HG22 THR 10 24.448 0.442 -11.075 71 HG23 THR 10 HG23 THR 10 24.017 0.766 -9.383 72 H ALA 11 H ALA 11 22.165 4.415 -10.725 73 HA ALA 11 HA ALA 11 22.908 7.027 -11.632 74 HB1 ALA 11 HB1 ALA 11 20.503 7.238 -12.151 75 HB2 ALA 11 HB2 ALA 11 21.137 5.666 -12.663 76 HB3 ALA 11 HB3 ALA 11 20.155 5.789 -11.187 77 H GLN 12 H GLN 12 21.088 5.967 -8.711 78 HA GLN 12 HA GLN 12 20.922 8.732 -7.711 79 HB2 GLN 12 HB2 GLN 12 19.065 7.200 -7.426 80 HB3 GLN 12 HB3 GLN 12 20.071 6.076 -6.507 81 HG2 GLN 12 HG2 GLN 12 18.527 7.429 -5.099 82 HG3 GLN 12 HG3 GLN 12 20.217 7.572 -4.647 83 HE21 GLN 12 HE21 GLN 12 20.402 9.622 -3.808 84 HE22 GLN 12 HE22 GLN 12 19.830 11.077 -4.599 85 H GLU 13 H GLU 13 23.297 6.179 -7.399 86 HA GLU 13 HA GLU 13 24.529 7.286 -5.022 87 HB2 GLU 13 HB2 GLU 13 24.716 4.912 -5.773 88 HB3 GLU 13 HB3 GLU 13 25.692 5.451 -7.131 89 HG2 GLU 13 HG2 GLU 13 27.224 4.675 -5.521 90 HG3 GLU 13 HG3 GLU 13 27.334 6.424 -5.416 91 H ARG 14 H ARG 14 25.530 7.412 -8.415 92 HA ARG 14 HA ARG 14 27.740 8.986 -8.190 93 HB2 ARG 14 HB2 ARG 14 27.627 9.454 -10.563 94 HB3 ARG 14 HB3 ARG 14 27.163 7.789 -10.230 95 HG2 ARG 14 HG2 ARG 14 24.743 8.471 -10.455 96 HG3 ARG 14 HG3 ARG 14 25.266 10.103 -10.838 97 HD2 ARG 14 HD2 ARG 14 24.740 8.972 -12.888 98 HD3 ARG 14 HD3 ARG 14 26.494 9.240 -12.815 99 HE ARG 14 HE ARG 14 25.788 6.648 -11.736 100 HH11 ARG 14 HH12 ARG 14 26.038 8.242 -14.849 101 HH12 ARG 14 HH11 ARG 14 26.444 6.772 -15.690 102 HH21 ARG 14 HH21 ARG 14 26.423 4.808 -12.858 103 HH22 ARG 14 HH22 ARG 14 26.621 4.869 -14.585 104 H VAL 15 H VAL 15 24.535 10.197 -8.384 105 HA VAL 15 HA VAL 15 25.161 13.002 -8.528 106 HB VAL 15 HB VAL 15 22.912 13.526 -7.749 107 HG11 VAL 15 HG11 VAL 15 22.905 11.352 -9.878 108 HG12 VAL 15 HG12 VAL 15 21.726 12.663 -9.666 109 HG13 VAL 15 HG13 VAL 15 23.384 13.041 -10.137 110 HG21 VAL 15 HG21 VAL 15 21.238 11.809 -7.355 111 HG22 VAL 15 HG22 VAL 15 22.441 10.527 -7.591 112 HG23 VAL 15 HG23 VAL 15 22.550 11.607 -6.182 113 H ASP 16 H ASP 16 25.394 10.777 -5.851 114 HA ASP 16 HA ASP 16 25.239 12.831 -3.772 115 HB2 ASP 16 HB2 ASP 16 24.951 10.385 -3.371 116 HB3 ASP 16 HB3 ASP 16 26.674 10.152 -3.711 117 H LEU 17 H LEU 17 28.032 11.418 -5.545 118 HA LEU 17 HA LEU 17 30.028 12.657 -3.997 119 HB2 LEU 17 HB2 LEU 17 30.123 11.484 -6.810 120 HB3 LEU 17 HB3 LEU 17 31.512 12.060 -5.903 121 HG LEU 17 HG LEU 17 30.628 10.403 -4.011 122 HD11 LEU 17 HD11 LEU 17 28.593 9.616 -5.170 123 HD12 LEU 17 HD12 LEU 17 29.750 8.303 -5.013 124 HD13 LEU 17 HD13 LEU 17 29.565 9.124 -6.574 125 HD21 LEU 17 HD21 LEU 17 32.086 9.499 -6.521 126 HD22 LEU 17 HD22 LEU 17 32.115 8.677 -4.942 127 HD23 LEU 17 HD23 LEU 17 32.802 10.300 -5.102 128 H GLU 18 H GLU 18 28.675 13.616 -7.089 129 HA GLU 18 HA GLU 18 30.126 16.058 -7.445 130 HB2 GLU 18 HB2 GLU 18 28.331 16.655 -9.056 131 HB3 GLU 18 HB3 GLU 18 29.035 15.050 -9.286 132 HG2 GLU 18 HG2 GLU 18 27.045 14.111 -7.962 133 HG3 GLU 18 HG3 GLU 18 26.340 15.723 -8.043 134 H ALA 19 H ALA 19 27.176 15.406 -5.479 135 HA ALA 19 HA ALA 19 26.724 18.187 -4.853 136 HB1 ALA 19 HB1 ALA 19 25.073 16.325 -4.655 137 HB2 ALA 19 HB2 ALA 19 25.973 15.721 -3.248 138 HB3 ALA 19 HB3 ALA 19 25.223 17.331 -3.189 139 H VAL 20 H VAL 20 28.778 15.662 -3.373 140 HA VAL 20 HA VAL 20 29.716 17.360 -1.169 141 HB VAL 20 HB VAL 20 30.898 14.823 -2.347 142 HG11 VAL 20 HG11 VAL 20 31.599 16.302 0.225 143 HG12 VAL 20 HG12 VAL 20 32.145 14.664 -0.194 144 HG13 VAL 20 HG13 VAL 20 32.677 16.037 -1.165 145 HG21 VAL 20 HG21 VAL 20 29.938 13.754 -0.345 146 HG22 VAL 20 HG22 VAL 20 29.260 15.310 0.180 147 HG23 VAL 20 HG23 VAL 20 28.662 14.520 -1.293 148 H ARG 21 H ARG 21 31.025 16.625 -4.414 149 HA ARG 21 HA ARG 21 33.259 18.315 -4.360 150 HB2 ARG 21 HB2 ARG 21 32.539 16.682 -6.147 151 HB3 ARG 21 HB3 ARG 21 31.443 17.899 -6.785 152 HG2 ARG 21 HG2 ARG 21 34.359 18.607 -6.382 153 HG3 ARG 21 HG3 ARG 21 33.948 17.506 -7.675 154 HD2 ARG 21 HD2 ARG 21 32.856 20.328 -7.349 155 HD3 ARG 21 HD3 ARG 21 34.141 19.852 -8.455 156 HE ARG 21 HE ARG 21 31.368 19.773 -8.991 157 HH11 ARG 21 HH11 ARG 21 34.170 17.747 -9.715 158 HH12 ARG 21 HH12 ARG 21 33.348 17.032 -11.078 159 HH21 ARG 21 HH21 ARG 21 30.508 18.870 -10.845 160 HH22 ARG 21 HH22 ARG 21 31.381 17.595 -11.636 161 H LEU 22 H LEU 22 29.935 19.292 -5.178 162 HA LEU 22 HA LEU 22 30.564 22.126 -5.257 163 HB2 LEU 22 HB2 LEU 22 27.982 20.596 -5.352 164 HB3 LEU 22 HB3 LEU 22 28.003 22.310 -4.905 165 HG LEU 22 HG LEU 22 29.444 22.738 -6.988 166 HD11 LEU 22 HD11 LEU 22 28.335 20.006 -7.747 167 HD12 LEU 22 HD12 LEU 22 30.053 20.418 -7.514 168 HD13 LEU 22 HD13 LEU 22 29.132 21.150 -8.845 169 HD21 LEU 22 HD21 LEU 22 27.486 22.915 -8.389 170 HD22 LEU 22 HD22 LEU 22 27.138 23.393 -6.713 171 HD23 LEU 22 HD23 LEU 22 26.591 21.800 -7.308 172 H ALA 23 H ALA 23 29.441 20.064 -2.518 173 HA ALA 23 HA ALA 23 29.229 22.237 -0.682 174 HB1 ALA 23 HB1 ALA 23 28.556 19.909 -0.215 175 HB2 ALA 23 HB2 ALA 23 30.261 19.415 -0.192 176 HB3 ALA 23 HB3 ALA 23 29.647 20.543 1.033 177 H SER 24 H SER 24 32.110 20.506 -1.848 178 HA SER 24 HA SER 24 34.020 22.100 -0.465 179 HB2 SER 24 HB2 SER 24 34.539 20.666 -3.087 180 HB3 SER 24 HB3 SER 24 35.684 21.115 -1.830 181 HG SER 24 HG SER 24 33.584 19.184 -1.619 182 H ILE 25 H ILE 25 32.695 22.553 -3.851 183 HA ILE 25 HA ILE 25 34.336 24.857 -4.247 184 HB ILE 25 HB ILE 25 31.691 24.632 -5.636 185 HG12 ILE 25 HG12 ILE 25 32.441 22.434 -6.046 186 HG13 ILE 25 HG13 ILE 25 32.834 23.348 -7.437 187 HG21 ILE 25 HG21 ILE 25 33.077 25.615 -7.479 188 HG22 ILE 25 HG22 ILE 25 33.008 26.637 -6.052 189 HG23 ILE 25 HG23 ILE 25 34.462 25.678 -6.391 190 HD11 ILE 25 HD11 ILE 25 35.228 23.427 -6.748 191 HD12 ILE 25 HD12 ILE 25 34.806 22.450 -5.306 192 HD13 ILE 25 HD13 ILE 25 34.590 21.775 -6.912 193 H VAL 26 H VAL 26 31.103 24.503 -2.821 194 HA VAL 26 HA VAL 26 30.489 27.308 -2.492 195 HB VAL 26 HB VAL 26 29.599 24.819 -1.023 196 HG11 VAL 26 HG11 VAL 26 27.642 26.264 -0.286 197 HG12 VAL 26 HG12 VAL 26 29.189 26.560 0.518 198 HG13 VAL 26 HG13 VAL 26 28.647 27.670 -0.727 199 HG21 VAL 26 HG21 VAL 26 28.926 25.059 -3.506 200 HG22 VAL 26 HG22 VAL 26 27.583 24.964 -2.380 201 HG23 VAL 26 HG23 VAL 26 28.081 26.539 -3.052 202 H ASP 27 H ASP 27 31.951 24.872 -0.139 203 HA ASP 27 HA ASP 27 32.627 26.702 1.860 204 HB2 ASP 27 HB2 ASP 27 33.016 24.341 2.120 205 HB3 ASP 27 HB3 ASP 27 34.169 24.318 0.782 206 H SER 28 H SER 28 34.533 26.077 -1.121 207 HA SER 28 HA SER 28 36.614 27.924 -0.617 208 HB2 SER 28 HB2 SER 28 36.534 26.204 -2.459 209 HB3 SER 28 HB3 SER 28 35.474 27.306 -3.366 210 HG SER 28 HG SER 28 37.719 27.541 -3.877 211 H ARG 29 H ARG 29 33.406 28.516 -2.059 212 HA ARG 29 HA ARG 29 33.807 31.376 -2.424 213 HB2 ARG 29 HB2 ARG 29 32.166 29.945 -3.673 214 HB3 ARG 29 HB3 ARG 29 31.195 29.798 -2.224 215 HG2 ARG 29 HG2 ARG 29 30.234 31.443 -3.642 216 HG3 ARG 29 HG3 ARG 29 30.872 32.248 -2.201 217 HD2 ARG 29 HD2 ARG 29 32.763 33.105 -3.465 218 HD3 ARG 29 HD3 ARG 29 32.321 32.097 -4.865 219 HE ARG 29 HE ARG 29 30.200 33.936 -4.006 220 HH11 ARG 29 HH12 ARG 29 33.139 33.876 -5.904 221 HH12 ARG 29 HH11 ARG 29 32.597 35.134 -6.978 222 HH21 ARG 29 HH21 ARG 29 29.454 35.416 -5.584 223 HH22 ARG 29 HH22 ARG 29 30.601 36.014 -6.743 224 H LEU 30 H LEU 30 32.376 29.448 0.289 225 HA LEU 30 HA LEU 30 31.569 31.801 1.724 226 HB2 LEU 30 HB2 LEU 30 32.267 29.075 2.853 227 HB3 LEU 30 HB3 LEU 30 31.419 30.387 3.683 228 HG LEU 30 HG LEU 30 30.399 28.822 1.305 229 HD11 LEU 30 HD11 LEU 30 29.337 29.017 4.145 230 HD12 LEU 30 HD12 LEU 30 30.297 27.647 3.541 231 HD13 LEU 30 HD13 LEU 30 28.708 27.997 2.842 232 HD21 LEU 30 HD21 LEU 30 28.256 30.041 1.638 233 HD22 LEU 30 HD22 LEU 30 29.537 31.074 1.030 234 HD23 LEU 30 HD23 LEU 30 29.084 31.145 2.759 235 H ILE 31 H ILE 31 34.669 30.070 1.646 236 HA ILE 31 HA ILE 31 36.002 31.828 3.554 237 HB ILE 31 HB ILE 31 37.011 29.916 1.409 238 HG12 ILE 31 HG12 ILE 31 37.033 29.634 4.450 239 HG13 ILE 31 HG13 ILE 31 35.741 29.000 3.453 240 HG21 ILE 31 HG21 ILE 31 39.242 30.079 2.515 241 HG22 ILE 31 HG22 ILE 31 38.766 31.605 1.804 242 HG23 ILE 31 HG23 ILE 31 38.624 31.373 3.560 243 HD11 ILE 31 HD11 ILE 31 37.354 27.572 2.216 244 HD12 ILE 31 HD12 ILE 31 38.639 28.101 3.333 245 HD13 ILE 31 HD13 ILE 31 37.244 27.206 3.947 246 H GLY 32 H GLY 32 35.564 31.842 0.015 247 HA2 GLY 32 HA2 GLY 32 37.475 33.794 -0.682 248 HA3 GLY 32 HA3 GLY 32 36.080 33.239 -1.633 249 H THR 33 H THR 33 33.999 34.033 -0.007 250 HA THR 33 HA THR 33 34.239 36.923 0.432 251 HB THR 33 HB THR 33 33.874 36.793 -1.996 252 HG1 THR 33 HG1 THR 33 32.148 38.212 -2.055 253 HG21 THR 33 HG21 THR 33 31.862 35.991 -2.986 254 HG22 THR 33 HG22 THR 33 31.098 35.686 -1.414 255 HG23 THR 33 HG23 THR 33 32.466 34.683 -1.954 256 H GLY 34 H GLY 34 32.189 34.009 0.593 257 HA2 GLY 34 HA2 GLY 34 31.126 33.527 2.696 258 HA3 GLY 34 HA3 GLY 34 30.865 35.220 3.014 259 H SER 35 H SER 35 29.968 34.480 -0.178 260 HA SER 35 HA SER 35 27.392 33.325 0.347 261 HB2 SER 35 HB2 SER 35 26.141 35.162 -0.784 262 HB3 SER 35 HB3 SER 35 26.822 35.625 0.789 263 HG SER 35 HG SER 35 27.182 37.223 -0.810 264 H VAL 36 H VAL 36 26.374 32.493 -1.443 265 HA VAL 36 HA VAL 36 28.128 32.077 -3.876 266 HB VAL 36 HB VAL 36 25.950 30.341 -2.654 267 HG11 VAL 36 HG11 VAL 36 26.677 28.697 -4.420 268 HG12 VAL 36 HG12 VAL 36 25.782 30.090 -5.048 269 HG13 VAL 36 HG13 VAL 36 27.557 30.021 -5.212 270 HG21 VAL 36 HG21 VAL 36 28.896 29.704 -3.066 271 HG22 VAL 36 HG22 VAL 36 28.177 30.182 -1.495 272 HG23 VAL 36 HG23 VAL 36 27.643 28.700 -2.312 273 H ASP 37 H ASP 37 27.337 32.794 -5.837 274 HA ASP 37 HA ASP 37 24.469 33.441 -6.060 275 HB2 ASP 37 HB2 ASP 37 26.709 34.564 -7.777 276 HB3 ASP 37 HB3 ASP 37 25.058 35.186 -7.535 277 H GLU 38 H GLU 38 23.437 32.814 -8.040 278 HA GLU 38 HA GLU 38 23.971 30.385 -9.084 279 HB2 GLU 38 HB2 GLU 38 21.922 31.832 -9.392 280 HB3 GLU 38 HB3 GLU 38 22.755 32.668 -10.697 281 HG2 GLU 38 HG2 GLU 38 22.819 29.732 -11.004 282 HG3 GLU 38 HG3 GLU 38 21.195 30.322 -10.829 283 H ASP 39 H ASP 39 25.303 33.385 -10.424 284 HA ASP 39 HA ASP 39 26.529 32.201 -12.745 285 HB2 ASP 39 HB2 ASP 39 27.424 34.721 -11.308 286 HB3 ASP 39 HB3 ASP 39 27.686 34.298 -12.995 287 H PHE 40 H PHE 40 27.481 32.072 -9.397 288 HA PHE 40 HA PHE 40 30.283 31.368 -10.041 289 HB2 PHE 40 HB2 PHE 40 29.847 32.685 -8.028 290 HB3 PHE 40 HB3 PHE 40 28.754 31.473 -7.430 291 HD1 PHE 40 HD1 PHE 40 32.319 32.089 -8.297 292 HD2 PHE 40 HD2 PHE 40 29.515 29.507 -6.277 293 HE1 PHE 40 HE1 PHE 40 34.204 30.815 -7.301 294 HE2 PHE 40 HE2 PHE 40 31.395 28.223 -5.315 295 HZ PHE 40 HZ PHE 40 33.744 28.874 -5.813 296 H LEU 41 H LEU 41 27.158 29.694 -9.767 297 HA LEU 41 HA LEU 41 28.568 27.111 -9.243 298 HB2 LEU 41 HB2 LEU 41 25.681 28.028 -8.986 299 HB3 LEU 41 HB3 LEU 41 26.140 26.314 -8.949 300 HG LEU 41 HG LEU 41 26.932 28.457 -6.951 301 HD11 LEU 41 HD11 LEU 41 24.659 27.533 -6.731 302 HD12 LEU 41 HD12 LEU 41 25.685 26.928 -5.418 303 HD13 LEU 41 HD13 LEU 41 25.301 25.872 -6.782 304 HD21 LEU 41 HD21 LEU 41 27.994 26.543 -5.665 305 HD22 LEU 41 HD22 LEU 41 28.889 27.032 -7.098 306 HD23 LEU 41 HD23 LEU 41 27.888 25.561 -7.141 307 H ARG 42 H ARG 42 26.489 28.658 -11.715 308 HA ARG 42 HA ARG 42 26.128 26.430 -13.357 309 HB2 ARG 42 HB2 ARG 42 25.889 27.947 -15.238 310 HB3 ARG 42 HB3 ARG 42 25.086 28.530 -13.779 311 HG2 ARG 42 HG2 ARG 42 26.832 30.186 -13.411 312 HG3 ARG 42 HG3 ARG 42 27.866 29.461 -14.630 313 HD2 ARG 42 HD2 ARG 42 26.989 31.372 -15.570 314 HD3 ARG 42 HD3 ARG 42 26.228 30.014 -16.397 315 HE ARG 42 HE ARG 42 24.395 30.679 -14.398 316 HH11 ARG 42 HH11 ARG 42 25.769 32.487 -17.094 317 HH12 ARG 42 HH12 ARG 42 24.364 33.508 -17.211 318 HH21 ARG 42 HH21 ARG 42 22.758 31.964 -14.549 319 HH22 ARG 42 HH22 ARG 42 22.651 33.224 -15.777 320 H GLU 43 H GLU 43 29.205 28.122 -12.956 321 HA GLU 43 HA GLU 43 30.519 26.540 -15.099 322 HB2 GLU 43 HB2 GLU 43 32.496 27.935 -14.498 323 HB3 GLU 43 HB3 GLU 43 31.111 28.844 -15.079 324 HG2 GLU 43 HG2 GLU 43 30.622 29.743 -12.973 325 HG3 GLU 43 HG3 GLU 43 31.470 28.474 -12.111 326 H GLN 44 H GLN 44 29.536 25.555 -12.187 327 HA GLN 44 HA GLN 44 32.027 24.058 -11.516 328 HB2 GLN 44 HB2 GLN 44 30.020 25.265 -9.571 329 HB3 GLN 44 HB3 GLN 44 31.462 24.345 -9.151 330 HG2 GLN 44 HG2 GLN 44 31.418 27.031 -10.564 331 HG3 GLN 44 HG3 GLN 44 31.787 26.794 -8.878 332 HE21 GLN 44 HE21 GLN 44 33.484 28.019 -11.024 333 HE22 GLN 44 HE22 GLN 44 34.965 27.087 -10.903 334 H ILE 45 H ILE 45 28.556 23.922 -12.099 335 HA ILE 45 HA ILE 45 27.886 21.430 -10.986 336 HB ILE 45 HB ILE 45 26.717 21.083 -13.360 337 HG12 ILE 45 HG12 ILE 45 26.887 24.138 -13.255 338 HG13 ILE 45 HG13 ILE 45 27.880 23.175 -14.358 339 HG21 ILE 45 HG21 ILE 45 25.677 21.366 -11.151 340 HG22 ILE 45 HG22 ILE 45 25.779 23.155 -11.349 341 HG23 ILE 45 HG23 ILE 45 24.753 22.170 -12.429 342 HD11 ILE 45 HD11 ILE 45 25.945 24.038 -15.531 343 HD12 ILE 45 HD12 ILE 45 25.813 22.279 -15.418 344 HD13 ILE 45 HD13 ILE 45 24.827 23.314 -14.366 345 H ARG 46 H ARG 46 28.919 21.640 -14.481 346 HA ARG 46 HA ARG 46 30.284 20.607 -15.709 347 HB2 ARG 46 HB2 ARG 46 31.717 19.782 -13.171 348 HB3 ARG 46 HB3 ARG 46 32.358 19.549 -14.800 349 HG2 ARG 46 HG2 ARG 46 32.438 21.920 -15.230 350 HG3 ARG 46 HG3 ARG 46 31.524 22.298 -13.760 351 HD2 ARG 46 HD2 ARG 46 33.338 21.368 -12.377 352 HD3 ARG 46 HD3 ARG 46 34.299 21.106 -13.853 353 HE ARG 46 HE ARG 46 33.263 23.849 -13.538 354 HH11 ARG 46 HH11 ARG 46 36.063 21.875 -12.785 355 HH12 ARG 46 HH12 ARG 46 37.097 23.271 -12.642 356 HH21 ARG 46 HH21 ARG 46 34.539 25.516 -13.300 357 HH22 ARG 46 HH22 ARG 46 36.253 25.324 -12.986 358 H ASP 47 H ASP 47 28.581 18.711 -13.502 359 HA ASP 47 HA ASP 47 28.448 16.469 -15.499 360 HB2 ASP 47 HB2 ASP 47 28.809 16.317 -12.499 361 HB3 ASP 47 HB3 ASP 47 28.616 14.928 -13.560 362 H ALA 48 H ALA 48 26.617 18.696 -14.173 363 HA ALA 48 HA ALA 48 24.205 16.997 -13.724 364 HB1 ALA 48 HB1 ALA 48 25.223 17.381 -11.507 365 HB2 ALA 48 HB2 ALA 48 25.160 19.133 -11.771 366 HB3 ALA 48 HB3 ALA 48 23.655 18.193 -11.664 367 H ARG 49 H ARG 49 22.261 17.913 -14.178 368 HA ARG 49 HA ARG 49 22.081 20.212 -15.881 369 HB2 ARG 49 HB2 ARG 49 20.330 18.093 -14.898 370 HB3 ARG 49 HB3 ARG 49 19.520 19.605 -14.704 371 HG2 ARG 49 HG2 ARG 49 18.976 18.607 -16.851 372 HG3 ARG 49 HG3 ARG 49 19.774 20.168 -17.045 373 HD2 ARG 49 HD2 ARG 49 20.515 18.480 -18.691 374 HD3 ARG 49 HD3 ARG 49 21.853 19.096 -17.727 375 HE ARG 49 HE ARG 49 21.539 16.949 -16.297 376 HH11 ARG 49 HH11 ARG 49 21.088 16.946 -19.785 377 HH12 ARG 49 HH12 ARG 49 21.550 15.272 -19.909 378 HH21 ARG 49 HH21 ARG 49 22.091 14.909 -16.499 379 HH22 ARG 49 HH22 ARG 49 22.115 14.131 -18.071 380 H TYR 50 H TYR 50 20.882 19.864 -12.475 381 HA TYR 50 HA TYR 50 20.949 22.859 -12.299 382 HB2 TYR 50 HB2 TYR 50 18.951 21.099 -10.892 383 HB3 TYR 50 HB3 TYR 50 18.802 22.791 -11.306 384 HD1 TYR 50 HD2 TYR 50 19.236 22.941 -14.174 385 HD2 TYR 50 HD1 TYR 50 17.235 19.898 -11.886 386 HE1 TYR 50 HE2 TYR 50 17.866 22.364 -16.164 387 HE2 TYR 50 HE1 TYR 50 15.868 19.299 -13.886 388 HH TYR 50 HH TYR 50 16.265 20.961 -17.021 389 H ALA 51 H ALA 51 22.121 23.703 -10.529 390 HA ALA 51 HA ALA 51 22.577 21.880 -8.205 391 HB1 ALA 51 HB1 ALA 51 24.464 23.379 -7.640 392 HB2 ALA 51 HB2 ALA 51 24.693 22.496 -9.160 393 HB3 ALA 51 HB3 ALA 51 24.246 24.215 -9.190 394 H VAL 52 H VAL 52 22.107 22.698 -6.144 395 HA VAL 52 HA VAL 52 20.484 25.197 -5.973 396 HB VAL 52 HB VAL 52 19.609 22.414 -5.141 397 HG11 VAL 52 HG11 VAL 52 18.843 23.936 -3.398 398 HG12 VAL 52 HG12 VAL 52 18.274 25.105 -4.615 399 HG13 VAL 52 HG13 VAL 52 17.471 23.531 -4.429 400 HG21 VAL 52 HG21 VAL 52 18.492 24.355 -7.190 401 HG22 VAL 52 HG22 VAL 52 19.207 22.758 -7.495 402 HG23 VAL 52 HG23 VAL 52 17.673 22.876 -6.644 403 H ILE 53 H ILE 53 20.499 26.253 -4.016 404 HA ILE 53 HA ILE 53 22.528 25.289 -2.075 405 HB ILE 53 HB ILE 53 22.240 27.718 -3.692 406 HG12 ILE 53 HG12 ILE 53 24.164 26.304 -3.839 407 HG13 ILE 53 HG13 ILE 53 24.635 27.920 -3.292 408 HG21 ILE 53 HG21 ILE 53 22.822 28.249 -0.747 409 HG22 ILE 53 HG22 ILE 53 23.194 29.348 -2.091 410 HG23 ILE 53 HG23 ILE 53 21.526 28.936 -1.735 411 HD11 ILE 53 HD11 ILE 53 24.640 25.308 -1.786 412 HD12 ILE 53 HD12 ILE 53 25.899 26.553 -1.909 413 HD13 ILE 53 HD13 ILE 53 24.489 26.818 -0.871 414 H ARG 54 H ARG 54 22.096 25.107 -0.039 415 HA ARG 54 HA ARG 54 20.033 26.872 1.254 416 HB2 ARG 54 HB2 ARG 54 20.633 23.936 1.782 417 HB3 ARG 54 HB3 ARG 54 19.555 24.944 2.752 418 HG2 ARG 54 HG2 ARG 54 19.135 24.200 -0.186 419 HG3 ARG 54 HG3 ARG 54 18.382 23.400 1.192 420 HD2 ARG 54 HD2 ARG 54 17.259 25.473 1.844 421 HD3 ARG 54 HD3 ARG 54 18.005 26.333 0.476 422 HE ARG 54 HE ARG 54 16.695 24.107 -0.624 423 HH11 ARG 54 HH12 ARG 54 15.657 26.947 1.147 424 HH12 ARG 54 HH11 ARG 54 14.098 26.980 0.372 425 HH21 ARG 54 HH21 ARG 54 14.683 24.201 -1.578 426 HH22 ARG 54 HH22 ARG 54 13.571 25.459 -1.140 427 H ILE 55 H ILE 55 21.731 28.326 1.735 428 HA ILE 55 HA ILE 55 23.765 27.418 3.735 429 HB ILE 55 HB ILE 55 23.715 29.876 1.969 430 HG12 ILE 55 HG12 ILE 55 26.059 27.996 2.186 431 HG13 ILE 55 HG13 ILE 55 24.668 27.444 1.262 432 HG21 ILE 55 HG21 ILE 55 25.925 30.413 3.107 433 HG22 ILE 55 HG22 ILE 55 24.509 30.613 4.143 434 HG23 ILE 55 HG23 ILE 55 25.549 29.178 4.313 435 HD11 ILE 55 HD11 ILE 55 26.339 28.511 -0.156 436 HD12 ILE 55 HD12 ILE 55 24.820 29.431 -0.186 437 HD13 ILE 55 HD13 ILE 55 26.195 30.026 0.762 438 HA PRO 56 HA PRO 56 20.782 29.295 6.557 439 HB2 PRO 56 HB2 PRO 56 23.138 29.201 8.424 440 HB3 PRO 56 HB3 PRO 56 21.437 28.744 8.732 441 HG2 PRO 56 HG2 PRO 56 23.293 26.822 8.263 442 HG3 PRO 56 HG3 PRO 56 21.670 26.710 7.504 443 HD2 PRO 56 HD2 PRO 56 24.261 27.671 6.269 444 HD3 PRO 56 HD3 PRO 56 22.993 26.596 5.590 445 H GLY 57 H GLY 57 20.285 31.357 6.812 446 HA2 GLY 57 HA2 GLY 57 20.476 33.611 7.354 447 HA3 GLY 57 HA3 GLY 57 22.234 33.472 7.409 448 H GLN 58 H GLN 58 21.273 32.191 4.401 449 HA GLN 58 HA GLN 58 20.915 34.849 3.160 450 HB2 GLN 58 HB2 GLN 58 22.649 34.646 1.588 451 HB3 GLN 58 HB3 GLN 58 23.310 34.174 3.146 452 HG2 GLN 58 HG2 GLN 58 23.039 31.809 2.512 453 HG3 GLN 58 HG3 GLN 58 22.535 32.286 0.872 454 HE21 GLN 58 HE21 GLN 58 25.155 33.233 3.208 455 HE22 GLN 58 HE22 GLN 58 26.463 33.106 2.054 456 HA PRO 59 HA PRO 59 17.782 33.195 0.672 457 HB2 PRO 59 HB2 PRO 59 19.059 34.340 -1.805 458 HB3 PRO 59 HB3 PRO 59 17.402 34.571 -1.182 459 HG2 PRO 59 HG2 PRO 59 19.280 36.513 -0.896 460 HG3 PRO 59 HG3 PRO 59 18.152 36.133 0.452 461 HD2 PRO 59 HD2 PRO 59 21.028 35.216 0.109 462 HD3 PRO 59 HD3 PRO 59 20.188 35.869 1.540 463 H VAL 60 H VAL 60 17.241 31.306 -0.336 464 HA VAL 60 HA VAL 60 19.048 29.413 -1.341 465 HB VAL 60 HB VAL 60 16.894 28.691 -0.717 466 HG11 VAL 60 HG11 VAL 60 14.797 29.241 -1.880 467 HG12 VAL 60 HG12 VAL 60 15.508 30.678 -1.152 468 HG13 VAL 60 HG13 VAL 60 15.650 30.410 -2.903 469 HG21 VAL 60 HG21 VAL 60 17.881 27.416 -2.638 470 HG22 VAL 60 HG22 VAL 60 16.119 27.347 -2.571 471 HG23 VAL 60 HG23 VAL 60 16.911 28.402 -3.749 472 H VAL 61 H VAL 61 20.032 29.023 -3.206 473 HA VAL 61 HA VAL 61 19.394 30.674 -5.630 474 HB VAL 61 HB VAL 61 22.076 29.613 -4.696 475 HG11 VAL 61 HG11 VAL 61 23.044 30.615 -6.691 476 HG12 VAL 61 HG12 VAL 61 21.950 29.306 -7.128 477 HG13 VAL 61 HG13 VAL 61 21.414 31.004 -7.310 478 HG21 VAL 61 HG21 VAL 61 21.440 31.713 -3.616 479 HG22 VAL 61 HG22 VAL 61 22.742 31.979 -4.777 480 HG23 VAL 61 HG23 VAL 61 21.079 32.441 -5.200 481 H GLU 62 H GLU 62 19.103 29.608 -7.555 482 HA GLU 62 HA GLU 62 19.371 26.648 -7.626 483 HB2 GLU 62 HB2 GLU 62 16.938 28.242 -8.536 484 HB3 GLU 62 HB3 GLU 62 17.214 26.518 -8.813 485 HG2 GLU 62 HG2 GLU 62 17.151 26.103 -6.378 486 HG3 GLU 62 HG3 GLU 62 16.894 27.828 -6.076 487 H VAL 63 H VAL 63 20.647 26.128 -9.363 488 HA VAL 63 HA VAL 63 21.152 28.104 -11.491 489 HB VAL 63 HB VAL 63 22.385 25.384 -11.015 490 HG11 VAL 63 HG11 VAL 63 22.947 26.252 -13.211 491 HG12 VAL 63 HG12 VAL 63 23.407 27.814 -12.484 492 HG13 VAL 63 HG13 VAL 63 24.344 26.339 -12.155 493 HG21 VAL 63 HG21 VAL 63 24.219 26.399 -9.870 494 HG22 VAL 63 HG22 VAL 63 23.467 28.005 -9.941 495 HG23 VAL 63 HG23 VAL 63 22.761 26.719 -8.943 496 H GLY 64 H GLY 64 20.952 27.542 -13.752 497 HA2 GLY 64 HA2 GLY 64 20.346 26.287 -15.592 498 HA3 GLY 64 HA3 GLY 64 20.093 24.910 -14.530 499 H THR 65 H THR 65 17.978 24.362 -13.946 500 HA THR 65 HA THR 65 15.720 26.149 -14.539 501 HB THR 65 HB THR 65 15.708 23.417 -15.868 502 HG1 THR 65 HG1 THR 65 15.994 24.545 -17.816 503 HG21 THR 65 HG21 THR 65 13.973 25.899 -16.209 504 HG22 THR 65 HG22 THR 65 13.478 24.338 -15.507 505 HG23 THR 65 HG23 THR 65 13.872 24.439 -17.220 506 H LYS 66 H LYS 66 13.874 25.577 -13.317 507 HA LYS 66 HA LYS 66 14.261 23.937 -11.057 508 HB2 LYS 66 HB2 LYS 66 12.736 25.872 -11.117 509 HB3 LYS 66 HB3 LYS 66 11.688 25.041 -12.274 510 HG2 LYS 66 HG2 LYS 66 11.193 23.296 -10.560 511 HG3 LYS 66 HG3 LYS 66 12.231 24.157 -9.403 512 HD2 LYS 66 HD2 LYS 66 10.749 26.136 -9.543 513 HD3 LYS 66 HD3 LYS 66 9.744 25.308 -10.756 514 HE2 LYS 66 HE2 LYS 66 9.248 23.512 -9.097 515 HE3 LYS 66 HE3 LYS 66 10.211 24.370 -7.886 516 HZ1 LYS 66 HZ1 LYS 66 7.757 25.441 -9.187 517 HZ2 LYS 66 HZ2 LYS 66 8.646 26.239 -8.068 518 HZ3 LYS 66 HZ3 LYS 66 7.844 24.877 -7.658 519 HA PRO 67 HA PRO 67 13.273 20.008 -12.978 520 HB2 PRO 67 HB2 PRO 67 13.574 18.359 -10.847 521 HB3 PRO 67 HB3 PRO 67 14.951 19.162 -11.673 522 HG2 PRO 67 HG2 PRO 67 13.552 19.985 -9.123 523 HG3 PRO 67 HG3 PRO 67 15.312 19.922 -9.490 524 HD2 PRO 67 HD2 PRO 67 13.834 22.241 -9.639 525 HD3 PRO 67 HD3 PRO 67 15.255 21.914 -10.677 526 H THR 68 H THR 68 11.663 18.646 -13.223 527 HA THR 68 HA THR 68 9.119 19.300 -12.300 528 HB THR 68 HB THR 68 9.663 18.607 -14.569 529 HG1 THR 68 HG1 THR 68 7.538 18.471 -14.040 530 HG21 THR 68 HG21 THR 68 9.968 16.338 -15.248 531 HG22 THR 68 HG22 THR 68 9.689 15.722 -13.614 532 HG23 THR 68 HG23 THR 68 11.169 16.643 -13.985 533 H GLY 69 H GLY 69 11.073 16.599 -11.267 534 HA2 GLY 69 HA2 GLY 69 10.306 15.739 -8.914 535 HA3 GLY 69 HA3 GLY 69 8.799 15.352 -9.759 536 H ASP 70 H ASP 70 9.941 14.558 -12.191 537 HA ASP 70 HA ASP 70 11.070 11.887 -11.634 538 HB2 ASP 70 HB2 ASP 70 10.320 13.214 -14.252 539 HB3 ASP 70 HB3 ASP 70 11.027 11.598 -14.117 540 H VAL 71 H VAL 71 12.796 13.126 -10.472 541 HA VAL 71 HA VAL 71 15.184 13.454 -12.123 542 HB VAL 71 HB VAL 71 15.852 15.469 -10.907 543 HG11 VAL 71 HG11 VAL 71 14.469 15.491 -13.133 544 HG12 VAL 71 HG12 VAL 71 13.179 16.221 -12.155 545 HG13 VAL 71 HG13 VAL 71 14.772 16.979 -12.277 546 HG21 VAL 71 HG21 VAL 71 14.479 15.169 -8.853 547 HG22 VAL 71 HG22 VAL 71 14.375 16.777 -9.540 548 HG23 VAL 71 HG23 VAL 71 13.037 15.629 -9.777 549 H LEU 72 H LEU 72 17.122 13.368 -10.965 550 HA LEU 72 HA LEU 72 17.194 11.534 -8.610 551 HB2 LEU 72 HB2 LEU 72 19.291 12.577 -10.568 552 HB3 LEU 72 HB3 LEU 72 19.650 11.467 -9.247 553 HG LEU 72 HG LEU 72 17.594 10.809 -11.346 554 HD11 LEU 72 HD11 LEU 72 19.625 11.325 -12.596 555 HD12 LEU 72 HD12 LEU 72 19.328 9.584 -12.613 556 HD13 LEU 72 HD13 LEU 72 20.583 10.258 -11.541 557 HD21 LEU 72 HD21 LEU 72 18.212 8.485 -10.744 558 HD22 LEU 72 HD22 LEU 72 17.721 9.406 -9.299 559 HD23 LEU 72 HD23 LEU 72 19.442 9.117 -9.620 560 H GLN 73 H GLN 73 17.888 12.332 -6.576 561 HA GLN 73 HA GLN 73 18.870 15.155 -6.511 562 HB2 GLN 73 HB2 GLN 73 17.234 13.505 -4.563 563 HB3 GLN 73 HB3 GLN 73 17.947 15.082 -4.207 564 HG2 GLN 73 HG2 GLN 73 16.696 16.000 -6.225 565 HG3 GLN 73 HG3 GLN 73 15.806 14.483 -6.292 566 HE21 GLN 73 HE21 GLN 73 14.959 17.353 -5.673 567 HE22 GLN 73 HE22 GLN 73 14.141 17.218 -4.110 568 H GLY 74 H GLY 74 20.931 15.375 -6.094 569 HA2 GLY 74 HA2 GLY 74 22.439 13.442 -4.360 570 HA3 GLY 74 HA3 GLY 74 23.136 14.625 -5.494 571 H ARG 75 H ARG 75 23.532 14.415 -2.412 572 HA ARG 75 HA ARG 75 22.797 17.166 -1.738 573 HB2 ARG 75 HB2 ARG 75 20.761 15.669 -1.381 574 HB3 ARG 75 HB3 ARG 75 21.686 14.827 -0.136 575 HG2 ARG 75 HG2 ARG 75 21.876 17.001 1.138 576 HG3 ARG 75 HG3 ARG 75 20.979 17.803 -0.171 577 HD2 ARG 75 HD2 ARG 75 19.349 17.316 1.466 578 HD3 ARG 75 HD3 ARG 75 19.147 16.094 0.182 579 HE ARG 75 HE ARG 75 20.914 15.114 2.236 580 HH11 ARG 75 HH11 ARG 75 17.498 15.687 1.748 581 HH12 ARG 75 HH12 ARG 75 17.025 14.454 2.886 582 HH21 ARG 75 HH21 ARG 75 20.255 13.541 3.672 583 HH22 ARG 75 HH22 ARG 75 18.560 13.274 3.950 584 H ALA 76 H ALA 76 24.117 18.006 -0.304 585 HA ALA 76 HA ALA 76 25.915 16.305 1.417 586 HB1 ALA 76 HB1 ALA 76 27.023 16.665 -0.737 587 HB2 ALA 76 HB2 ALA 76 26.759 18.422 -0.611 588 HB3 ALA 76 HB3 ALA 76 27.859 17.589 0.526 589 H THR 77 H THR 77 27.362 17.604 2.860 590 HA THR 77 HA THR 77 26.032 20.058 3.939 591 HB THR 77 HB THR 77 27.246 17.828 5.613 592 HG1 THR 77 HG1 THR 77 25.150 17.383 4.826 593 HG21 THR 77 HG21 THR 77 27.620 20.062 6.635 594 HG22 THR 77 HG22 THR 77 26.386 19.166 7.524 595 HG23 THR 77 HG23 THR 77 25.908 20.468 6.410 596 H GLY 78 H GLY 78 27.348 21.652 3.937 597 HA2 GLY 78 HA2 GLY 78 30.222 21.330 3.179 598 HA3 GLY 78 HA3 GLY 78 29.317 22.808 3.174 599 H GLU 79 H GLU 79 31.728 23.099 4.074 600 HA GLU 79 HA GLU 79 32.176 22.237 6.781 601 HB2 GLU 79 HB2 GLU 79 33.823 22.521 4.657 602 HB3 GLU 79 HB3 GLU 79 34.126 24.070 5.466 603 HG2 GLU 79 HG2 GLU 79 34.617 22.821 7.579 604 HG3 GLU 79 HG3 GLU 79 34.313 21.308 6.746 605 H GLU 80 H GLU 80 30.605 25.097 5.677 606 HA GLU 80 HA GLU 80 31.373 26.531 8.224 607 HB2 GLU 80 HB2 GLU 80 29.835 27.510 5.820 608 HB3 GLU 80 HB3 GLU 80 30.173 28.449 7.271 609 HG2 GLU 80 HG2 GLU 80 32.353 27.386 5.403 610 HG3 GLU 80 HG3 GLU 80 31.606 28.951 5.347 611 H GLY 81 H GLY 81 29.381 24.202 7.240 612 HA2 GLY 81 HA2 GLY 81 27.660 23.211 8.432 613 HA3 GLY 81 HA3 GLY 81 27.231 24.731 9.195 614 H GLU 82 H GLU 82 27.623 24.834 5.696 615 HA GLU 82 HA GLU 82 24.828 25.376 5.291 616 HB2 GLU 82 HB2 GLU 82 25.484 26.058 3.159 617 HB3 GLU 82 HB3 GLU 82 26.694 26.694 4.276 618 HG2 GLU 82 HG2 GLU 82 27.117 24.164 2.610 619 HG3 GLU 82 HG3 GLU 82 27.366 25.768 1.969 620 H THR 83 H THR 83 23.918 24.462 3.088 621 HA THR 83 HA THR 83 24.307 21.523 2.925 622 HB THR 83 HB THR 83 21.707 22.991 3.406 623 HG1 THR 83 HG1 THR 83 22.972 22.160 5.136 624 HG21 THR 83 HG21 THR 83 22.043 20.134 2.390 625 HG22 THR 83 HG22 THR 83 21.185 21.464 1.564 626 HG23 THR 83 HG23 THR 83 20.548 20.818 3.074 627 H VAL 84 H VAL 84 24.219 20.737 0.967 628 HA VAL 84 HA VAL 84 23.654 22.556 -1.376 629 HB VAL 84 HB VAL 84 25.871 20.495 -1.112 630 HG11 VAL 84 HG11 VAL 84 26.614 21.254 -3.325 631 HG12 VAL 84 HG12 VAL 84 25.033 20.498 -3.434 632 HG13 VAL 84 HG13 VAL 84 25.165 22.278 -3.482 633 HG21 VAL 84 HG21 VAL 84 27.300 22.552 -1.539 634 HG22 VAL 84 HG22 VAL 84 25.856 23.525 -1.252 635 HG23 VAL 84 HG23 VAL 84 26.506 22.501 0.049 636 H LEU 85 H LEU 85 22.503 21.756 -3.030 637 HA LEU 85 HA LEU 85 21.793 18.879 -3.055 638 HB2 LEU 85 HB2 LEU 85 19.933 20.114 -2.013 639 HB3 LEU 85 HB3 LEU 85 19.906 21.235 -3.354 640 HG LEU 85 HG LEU 85 19.339 19.144 -4.842 641 HD11 LEU 85 HD11 LEU 85 18.254 17.307 -3.746 642 HD12 LEU 85 HD12 LEU 85 18.405 18.075 -2.145 643 HD13 LEU 85 HD13 LEU 85 19.836 17.468 -2.977 644 HD21 LEU 85 HD21 LEU 85 17.737 20.894 -4.391 645 HD22 LEU 85 HD22 LEU 85 17.374 20.204 -2.790 646 HD23 LEU 85 HD23 LEU 85 16.954 19.313 -4.274 647 H VAL 86 H VAL 86 21.478 18.030 -5.087 648 HA VAL 86 HA VAL 86 22.033 19.694 -7.508 649 HB VAL 86 HB VAL 86 23.319 16.966 -7.054 650 HG11 VAL 86 HG11 VAL 86 23.585 19.046 -9.269 651 HG12 VAL 86 HG12 VAL 86 24.584 17.583 -9.103 652 HG13 VAL 86 HG13 VAL 86 22.852 17.432 -9.407 653 HG21 VAL 86 HG21 VAL 86 24.608 19.728 -6.937 654 HG22 VAL 86 HG22 VAL 86 24.451 18.566 -5.597 655 HG23 VAL 86 HG23 VAL 86 25.481 18.176 -6.980 656 H GLU 87 H GLU 87 20.764 19.113 -9.264 657 HA GLU 87 HA GLU 87 19.055 16.727 -8.934 658 HB2 GLU 87 HB2 GLU 87 17.938 19.459 -9.580 659 HB3 GLU 87 HB3 GLU 87 17.053 17.926 -9.504 660 HG2 GLU 87 HG2 GLU 87 17.906 17.721 -7.080 661 HG3 GLU 87 HG3 GLU 87 18.443 19.393 -7.216 662 H GLU 88 H GLU 88 18.826 15.538 -10.575 663 HA GLU 88 HA GLU 88 19.799 16.343 -13.303 664 HB2 GLU 88 HB2 GLU 88 20.535 14.203 -11.368 665 HB3 GLU 88 HB3 GLU 88 20.324 13.641 -13.023 666 HG2 GLU 88 HG2 GLU 88 22.194 15.875 -12.210 667 HG3 GLU 88 HG3 GLU 88 22.633 14.156 -12.314 668 HA PRO 89 HA PRO 89 15.854 14.528 -14.627 669 HB2 PRO 89 HB2 PRO 89 16.406 13.818 -17.224 670 HB3 PRO 89 HB3 PRO 89 16.098 15.498 -16.687 671 HG2 PRO 89 HG2 PRO 89 18.780 14.139 -17.098 672 HG3 PRO 89 HG3 PRO 89 18.252 15.747 -17.687 673 HD2 PRO 89 HD2 PRO 89 19.728 15.468 -15.438 674 HD3 PRO 89 HD3 PRO 89 18.421 16.691 -15.520 675 H ARG 90 H ARG 90 14.996 12.561 -14.340 676 HA ARG 90 HA ARG 90 16.719 10.241 -13.841 677 HB2 ARG 90 HB2 ARG 90 14.870 10.880 -12.327 678 HB3 ARG 90 HB3 ARG 90 13.701 10.556 -13.613 679 HG2 ARG 90 HG2 ARG 90 14.433 8.165 -13.653 680 HG3 ARG 90 HG3 ARG 90 15.568 8.525 -12.339 681 HD2 ARG 90 HD2 ARG 90 13.620 7.603 -11.300 682 HD3 ARG 90 HD3 ARG 90 13.627 9.338 -10.970 683 HE ARG 90 HE ARG 90 11.639 9.565 -12.101 684 HH11 ARG 90 HH11 ARG 90 12.884 6.418 -13.020 685 HH12 ARG 90 HH12 ARG 90 11.411 5.991 -13.845 686 HH21 ARG 90 HH21 ARG 90 9.813 8.979 -13.177 687 HH22 ARG 90 HH22 ARG 90 9.725 7.403 -13.927 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 0.727 -9.294 1.591 2 H2 GLY 1 H2 GLY 1 0.837 -8.042 0.539 3 H3 GLY 1 H3 GLY 1 0.644 -7.753 2.141 4 HA2 GLY 1 HA2 GLY 1 2.803 -8.697 2.643 5 HA3 GLY 1 HA3 GLY 1 3.015 -9.016 0.911 6 H SER 2 H SER 2 4.730 -7.419 2.627 7 HA SER 2 HA SER 2 4.290 -4.625 2.266 8 HB2 SER 2 HB2 SER 2 6.632 -4.411 3.051 9 HB3 SER 2 HB3 SER 2 5.628 -5.444 4.077 10 HG SER 2 HG SER 2 7.687 -6.361 3.650 11 H GLU 3 H GLU 3 5.714 -3.148 1.245 12 HA GLU 3 HA GLU 3 6.702 -3.947 -1.480 13 HB2 GLU 3 HB2 GLU 3 4.961 -1.540 -0.815 14 HB3 GLU 3 HB3 GLU 3 5.749 -1.836 -2.368 15 HG2 GLU 3 HG2 GLU 3 4.480 -3.978 -2.590 16 HG3 GLU 3 HG3 GLU 3 3.620 -3.605 -1.090 17 H THR 4 H THR 4 8.318 -2.629 -2.425 18 HA THR 4 HA THR 4 9.450 -0.352 -1.004 19 HB THR 4 HB THR 4 11.159 -2.858 -1.352 20 HG1 THR 4 HG1 THR 4 9.587 -2.099 0.567 21 HG21 THR 4 HG21 THR 4 12.592 -0.922 -1.721 22 HG22 THR 4 HG22 THR 4 12.887 -1.522 -0.091 23 HG23 THR 4 HG23 THR 4 11.887 -0.070 -0.328 24 H ARG 5 H ARG 5 10.708 0.888 -2.289 25 HA ARG 5 HA ARG 5 10.347 0.611 -5.217 26 HB2 ARG 5 HB2 ARG 5 11.645 2.800 -3.540 27 HB3 ARG 5 HB3 ARG 5 11.480 2.852 -5.302 28 HG2 ARG 5 HG2 ARG 5 9.030 2.721 -5.124 29 HG3 ARG 5 HG3 ARG 5 9.137 2.619 -3.356 30 HD2 ARG 5 HD2 ARG 5 10.189 4.832 -3.260 31 HD3 ARG 5 HD3 ARG 5 10.137 4.950 -5.035 32 HE ARG 5 HE ARG 5 7.505 4.424 -4.039 33 HH11 ARG 5 HH12 ARG 5 9.773 7.089 -4.146 34 HH12 ARG 5 HH11 ARG 5 8.513 8.292 -4.093 35 HH21 ARG 5 HH21 ARG 5 5.939 6.003 -3.974 36 HH22 ARG 5 HH22 ARG 5 6.392 7.681 -3.995 37 H THR 6 H THR 6 11.817 0.069 -6.730 38 HA THR 6 HA THR 6 14.228 -1.303 -5.974 39 HB THR 6 HB THR 6 13.403 -0.349 -8.743 40 HG1 THR 6 HG1 THR 6 12.515 -2.422 -8.891 41 HG21 THR 6 HG21 THR 6 14.729 -2.312 -9.506 42 HG22 THR 6 HG22 THR 6 15.230 -2.627 -7.828 43 HG23 THR 6 HG23 THR 6 15.748 -1.143 -8.659 44 H ILE 7 H ILE 7 16.105 -0.374 -5.353 45 HA ILE 7 HA ILE 7 16.447 2.427 -5.581 46 HB ILE 7 HB ILE 7 18.523 0.452 -4.600 47 HG12 ILE 7 HG12 ILE 7 16.204 1.778 -3.109 48 HG13 ILE 7 HG13 ILE 7 16.382 0.054 -3.440 49 HG21 ILE 7 HG21 ILE 7 19.338 2.813 -4.975 50 HG22 ILE 7 HG22 ILE 7 18.041 3.404 -3.908 51 HG23 ILE 7 HG23 ILE 7 19.351 2.376 -3.285 52 HD11 ILE 7 HD11 ILE 7 16.953 0.386 -1.159 53 HD12 ILE 7 HD12 ILE 7 18.458 0.020 -2.026 54 HD13 ILE 7 HD13 ILE 7 18.082 1.695 -1.539 55 H SER 8 H SER 8 17.598 3.639 -6.708 56 HA SER 8 HA SER 8 18.717 2.717 -9.295 57 HB2 SER 8 HB2 SER 8 18.190 5.550 -8.348 58 HB3 SER 8 HB3 SER 8 18.623 5.068 -9.997 59 HG SER 8 HG SER 8 16.682 3.887 -10.098 60 H SER 9 H SER 9 20.405 2.036 -7.183 61 HA SER 9 HA SER 9 22.450 3.637 -6.462 62 HB2 SER 9 HB2 SER 9 22.785 0.663 -6.844 63 HB3 SER 9 HB3 SER 9 23.469 1.693 -5.579 64 HG SER 9 HG SER 9 21.690 0.506 -4.811 65 H THR 10 H THR 10 22.424 4.035 -9.312 66 HA THR 10 HA THR 10 25.286 3.849 -9.852 67 HB THR 10 HB THR 10 24.790 3.565 -12.293 68 HG1 THR 10 HG1 THR 10 22.841 2.445 -12.774 69 HG21 THR 10 HG21 THR 10 25.680 1.688 -10.913 70 HG22 THR 10 HG22 THR 10 24.657 1.124 -12.245 71 HG23 THR 10 HG23 THR 10 24.011 1.163 -10.586 72 H ALA 11 H ALA 11 22.296 5.022 -11.437 73 HA ALA 11 HA ALA 11 23.272 7.632 -11.986 74 HB1 ALA 11 HB1 ALA 11 20.413 6.593 -11.866 75 HB2 ALA 11 HB2 ALA 11 20.979 8.051 -12.707 76 HB3 ALA 11 HB3 ALA 11 21.516 6.460 -13.251 77 H GLN 12 H GLN 12 21.105 6.490 -9.327 78 HA GLN 12 HA GLN 12 20.978 9.142 -8.086 79 HB2 GLN 12 HB2 GLN 12 19.100 7.674 -7.962 80 HB3 GLN 12 HB3 GLN 12 20.054 6.407 -7.176 81 HG2 GLN 12 HG2 GLN 12 18.569 7.576 -5.609 82 HG3 GLN 12 HG3 GLN 12 20.267 7.617 -5.170 83 HE21 GLN 12 HE21 GLN 12 20.451 9.565 -4.053 84 HE22 GLN 12 HE22 GLN 12 19.938 11.105 -4.705 85 H GLU 13 H GLU 13 23.117 6.320 -7.813 86 HA GLU 13 HA GLU 13 24.387 7.187 -5.380 87 HB2 GLU 13 HB2 GLU 13 24.438 4.883 -6.180 88 HB3 GLU 13 HB3 GLU 13 25.316 5.352 -7.614 89 HG2 GLU 13 HG2 GLU 13 26.844 4.360 -6.029 90 HG3 GLU 13 HG3 GLU 13 27.253 6.057 -6.253 91 H ARG 14 H ARG 14 25.474 7.538 -8.702 92 HA ARG 14 HA ARG 14 27.781 8.952 -8.284 93 HB2 ARG 14 HB2 ARG 14 27.808 9.767 -10.548 94 HB3 ARG 14 HB3 ARG 14 27.350 8.071 -10.494 95 HG2 ARG 14 HG2 ARG 14 25.184 8.477 -11.224 96 HG3 ARG 14 HG3 ARG 14 25.131 10.136 -10.664 97 HD2 ARG 14 HD2 ARG 14 26.922 9.254 -12.940 98 HD3 ARG 14 HD3 ARG 14 25.243 9.785 -13.162 99 HE ARG 14 HE ARG 14 26.610 11.774 -11.606 100 HH11 ARG 14 HH11 ARG 14 26.570 10.710 -15.004 101 HH12 ARG 14 HH12 ARG 14 27.008 12.359 -15.480 102 HH21 ARG 14 HH21 ARG 14 27.064 13.699 -12.409 103 HH22 ARG 14 HH22 ARG 14 27.251 13.868 -14.182 104 H VAL 15 H VAL 15 24.623 10.411 -8.585 105 HA VAL 15 HA VAL 15 25.419 13.134 -8.543 106 HB VAL 15 HB VAL 15 23.179 13.708 -7.720 107 HG11 VAL 15 HG11 VAL 15 23.693 13.548 -10.108 108 HG12 VAL 15 HG12 VAL 15 23.230 11.835 -10.099 109 HG13 VAL 15 HG13 VAL 15 22.020 13.086 -9.762 110 HG21 VAL 15 HG21 VAL 15 21.424 12.030 -7.605 111 HG22 VAL 15 HG22 VAL 15 22.592 10.742 -7.928 112 HG23 VAL 15 HG23 VAL 15 22.669 11.649 -6.403 113 H ASP 16 H ASP 16 25.475 10.795 -5.963 114 HA ASP 16 HA ASP 16 25.315 12.744 -3.782 115 HB2 ASP 16 HB2 ASP 16 24.994 10.283 -3.506 116 HB3 ASP 16 HB3 ASP 16 26.710 10.032 -3.851 117 H LEU 17 H LEU 17 28.091 11.378 -5.581 118 HA LEU 17 HA LEU 17 30.088 12.531 -3.943 119 HB2 LEU 17 HB2 LEU 17 30.260 11.399 -6.774 120 HB3 LEU 17 HB3 LEU 17 31.616 11.862 -5.765 121 HG LEU 17 HG LEU 17 30.485 10.178 -4.006 122 HD11 LEU 17 HD11 LEU 17 28.551 9.552 -5.432 123 HD12 LEU 17 HD12 LEU 17 29.612 8.174 -5.171 124 HD13 LEU 17 HD13 LEU 17 29.662 9.040 -6.720 125 HD21 LEU 17 HD21 LEU 17 32.147 9.312 -6.402 126 HD22 LEU 17 HD22 LEU 17 31.985 8.424 -4.867 127 HD23 LEU 17 HD23 LEU 17 32.757 10.017 -4.887 128 H GLU 18 H GLU 18 28.764 13.539 -7.059 129 HA GLU 18 HA GLU 18 30.330 15.954 -7.280 130 HB2 GLU 18 HB2 GLU 18 28.700 16.553 -9.067 131 HB3 GLU 18 HB3 GLU 18 29.488 14.990 -9.259 132 HG2 GLU 18 HG2 GLU 18 27.334 14.020 -8.105 133 HG3 GLU 18 HG3 GLU 18 26.617 15.541 -8.505 134 H ALA 19 H ALA 19 27.205 15.245 -5.566 135 HA ALA 19 HA ALA 19 26.684 18.020 -4.971 136 HB1 ALA 19 HB1 ALA 19 25.102 16.115 -4.837 137 HB2 ALA 19 HB2 ALA 19 25.955 15.527 -3.403 138 HB3 ALA 19 HB3 ALA 19 25.149 17.116 -3.362 139 H VAL 20 H VAL 20 28.714 15.527 -3.374 140 HA VAL 20 HA VAL 20 29.534 17.240 -1.142 141 HB VAL 20 HB VAL 20 30.741 14.707 -2.291 142 HG11 VAL 20 HG11 VAL 20 31.999 14.552 -0.139 143 HG12 VAL 20 HG12 VAL 20 32.548 15.897 -1.136 144 HG13 VAL 20 HG13 VAL 20 31.488 16.206 0.259 145 HG21 VAL 20 HG21 VAL 20 29.158 15.220 0.271 146 HG22 VAL 20 HG22 VAL 20 28.504 14.460 -1.193 147 HG23 VAL 20 HG23 VAL 20 29.786 13.655 -0.288 148 H ARG 21 H ARG 21 30.956 16.574 -4.368 149 HA ARG 21 HA ARG 21 33.189 18.288 -4.108 150 HB2 ARG 21 HB2 ARG 21 32.783 16.684 -5.974 151 HB3 ARG 21 HB3 ARG 21 31.527 17.743 -6.607 152 HG2 ARG 21 HG2 ARG 21 33.655 17.956 -7.823 153 HG3 ARG 21 HG3 ARG 21 33.100 19.475 -7.129 154 HD2 ARG 21 HD2 ARG 21 35.539 19.188 -6.915 155 HD3 ARG 21 HD3 ARG 21 34.750 19.340 -5.340 156 HE ARG 21 HE ARG 21 35.049 16.561 -6.137 157 HH11 ARG 21 HH21 ARG 21 36.975 19.195 -4.859 158 HH12 ARG 21 HH22 ARG 21 38.074 18.119 -4.039 159 HH21 ARG 21 HH12 ARG 21 36.483 15.241 -5.060 160 HH22 ARG 21 HH11 ARG 21 37.806 15.935 -4.172 161 H LEU 22 H LEU 22 29.830 19.205 -5.140 162 HA LEU 22 HA LEU 22 30.522 22.030 -5.230 163 HB2 LEU 22 HB2 LEU 22 27.930 20.523 -5.412 164 HB3 LEU 22 HB3 LEU 22 27.958 22.253 -5.019 165 HG LEU 22 HG LEU 22 29.463 22.635 -7.030 166 HD11 LEU 22 HD11 LEU 22 28.480 19.854 -7.798 167 HD12 LEU 22 HD12 LEU 22 30.173 20.331 -7.517 168 HD13 LEU 22 HD13 LEU 22 29.278 21.011 -8.881 169 HD21 LEU 22 HD21 LEU 22 27.113 23.216 -6.901 170 HD22 LEU 22 HD22 LEU 22 26.658 21.601 -7.504 171 HD23 LEU 22 HD23 LEU 22 27.581 22.729 -8.543 172 H ALA 23 H ALA 23 29.246 20.005 -2.517 173 HA ALA 23 HA ALA 23 29.017 22.220 -0.738 174 HB1 ALA 23 HB1 ALA 23 28.255 19.924 -0.263 175 HB2 ALA 23 HB2 ALA 23 29.942 19.385 -0.131 176 HB3 ALA 23 HB3 ALA 23 29.277 20.558 1.037 177 H SER 24 H SER 24 31.900 20.446 -1.767 178 HA SER 24 HA SER 24 33.775 22.023 -0.298 179 HB2 SER 24 HB2 SER 24 34.386 20.540 -2.873 180 HB3 SER 24 HB3 SER 24 35.489 21.003 -1.583 181 HG SER 24 HG SER 24 33.351 19.108 -1.407 182 H ILE 25 H ILE 25 32.510 22.539 -3.714 183 HA ILE 25 HA ILE 25 34.276 24.795 -4.032 184 HB ILE 25 HB ILE 25 31.752 24.649 -5.620 185 HG12 ILE 25 HG12 ILE 25 32.406 22.392 -5.904 186 HG13 ILE 25 HG13 ILE 25 32.901 23.271 -7.292 187 HG21 ILE 25 HG21 ILE 25 33.277 25.569 -7.336 188 HG22 ILE 25 HG22 ILE 25 33.329 26.555 -5.878 189 HG23 ILE 25 HG23 ILE 25 34.648 25.437 -6.232 190 HD11 ILE 25 HD11 ILE 25 35.255 23.212 -6.559 191 HD12 ILE 25 HD12 ILE 25 34.762 22.324 -5.086 192 HD13 ILE 25 HD13 ILE 25 34.529 21.593 -6.675 193 H VAL 26 H VAL 26 30.961 24.451 -2.759 194 HA VAL 26 HA VAL 26 30.358 27.290 -2.481 195 HB VAL 26 HB VAL 26 29.351 24.841 -1.006 196 HG11 VAL 26 HG11 VAL 26 28.224 27.673 -1.060 197 HG12 VAL 26 HG12 VAL 26 27.425 26.244 -0.351 198 HG13 VAL 26 HG13 VAL 26 28.922 26.842 0.345 199 HG21 VAL 26 HG21 VAL 26 27.453 24.873 -2.493 200 HG22 VAL 26 HG22 VAL 26 27.907 26.460 -3.159 201 HG23 VAL 26 HG23 VAL 26 28.838 25.015 -3.559 202 H ASP 27 H ASP 27 31.646 24.805 -0.057 203 HA ASP 27 HA ASP 27 32.285 26.628 1.967 204 HB2 ASP 27 HB2 ASP 27 32.580 24.251 2.258 205 HB3 ASP 27 HB3 ASP 27 33.792 24.185 0.974 206 H SER 28 H SER 28 34.296 25.872 -0.896 207 HA SER 28 HA SER 28 36.468 27.617 -0.316 208 HB2 SER 28 HB2 SER 28 35.409 26.897 -3.079 209 HB3 SER 28 HB3 SER 28 37.015 27.514 -2.681 210 HG SER 28 HG SER 28 35.875 25.015 -1.892 211 H ARG 29 H ARG 29 33.303 28.348 -1.750 212 HA ARG 29 HA ARG 29 33.904 31.184 -2.217 213 HB2 ARG 29 HB2 ARG 29 32.339 29.848 -3.616 214 HB3 ARG 29 HB3 ARG 29 31.278 29.623 -2.237 215 HG2 ARG 29 HG2 ARG 29 30.360 31.315 -3.594 216 HG3 ARG 29 HG3 ARG 29 30.924 32.076 -2.110 217 HD2 ARG 29 HD2 ARG 29 32.867 32.994 -3.275 218 HD3 ARG 29 HD3 ARG 29 32.475 32.040 -4.724 219 HE ARG 29 HE ARG 29 30.324 33.845 -3.850 220 HH11 ARG 29 HH11 ARG 29 33.307 33.868 -5.677 221 HH12 ARG 29 HH12 ARG 29 32.765 35.132 -6.745 222 HH21 ARG 29 HH21 ARG 29 29.573 35.288 -5.441 223 HH22 ARG 29 HH22 ARG 29 30.738 35.964 -6.543 224 H LEU 30 H LEU 30 32.262 29.334 0.426 225 HA LEU 30 HA LEU 30 31.469 31.717 1.844 226 HB2 LEU 30 HB2 LEU 30 32.051 28.952 2.957 227 HB3 LEU 30 HB3 LEU 30 31.232 30.273 3.794 228 HG LEU 30 HG LEU 30 30.196 28.787 1.365 229 HD11 LEU 30 HD11 LEU 30 30.033 27.540 3.563 230 HD12 LEU 30 HD12 LEU 30 28.467 27.958 2.857 231 HD13 LEU 30 HD13 LEU 30 29.106 28.921 4.197 232 HD21 LEU 30 HD21 LEU 30 28.939 31.098 2.885 233 HD22 LEU 30 HD22 LEU 30 28.088 30.062 1.718 234 HD23 LEU 30 HD23 LEU 30 29.416 31.071 1.163 235 H ILE 31 H ILE 31 34.500 29.849 1.867 236 HA ILE 31 HA ILE 31 35.871 31.568 3.777 237 HB ILE 31 HB ILE 31 36.828 29.589 1.668 238 HG12 ILE 31 HG12 ILE 31 36.787 29.329 4.713 239 HG13 ILE 31 HG13 ILE 31 35.483 28.749 3.692 240 HG21 ILE 31 HG21 ILE 31 39.044 29.656 2.810 241 HG22 ILE 31 HG22 ILE 31 38.657 31.195 2.076 242 HG23 ILE 31 HG23 ILE 31 38.467 30.989 3.832 243 HD11 ILE 31 HD11 ILE 31 36.902 26.895 4.234 244 HD12 ILE 31 HD12 ILE 31 37.051 27.239 2.500 245 HD13 ILE 31 HD13 ILE 31 38.342 27.722 3.634 246 H GLY 32 H GLY 32 35.425 31.601 0.244 247 HA2 GLY 32 HA2 GLY 32 37.480 33.444 -0.452 248 HA3 GLY 32 HA3 GLY 32 36.063 32.954 -1.409 249 H THR 33 H THR 33 34.028 33.856 0.218 250 HA THR 33 HA THR 33 34.372 36.738 0.622 251 HB THR 33 HB THR 33 34.064 36.540 -1.840 252 HG1 THR 33 HG1 THR 33 33.398 38.425 -0.929 253 HG21 THR 33 HG21 THR 33 32.006 35.883 -2.826 254 HG22 THR 33 HG22 THR 33 31.200 35.714 -1.260 255 HG23 THR 33 HG23 THR 33 32.472 34.563 -1.728 256 H GLY 34 H GLY 34 32.273 33.882 0.855 257 HA2 GLY 34 HA2 GLY 34 31.070 33.490 2.873 258 HA3 GLY 34 HA3 GLY 34 30.915 35.208 3.173 259 H SER 35 H SER 35 30.070 34.312 -0.050 260 HA SER 35 HA SER 35 27.392 33.359 0.411 261 HB2 SER 35 HB2 SER 35 27.834 36.184 -0.649 262 HB3 SER 35 HB3 SER 35 26.342 35.264 -0.925 263 HG SER 35 HG SER 35 27.309 35.416 1.692 264 H VAL 36 H VAL 36 26.463 32.495 -1.521 265 HA VAL 36 HA VAL 36 28.359 32.268 -3.840 266 HB VAL 36 HB VAL 36 28.311 30.224 -2.429 267 HG11 VAL 36 HG11 VAL 36 25.433 29.907 -3.378 268 HG12 VAL 36 HG12 VAL 36 26.392 28.771 -2.404 269 HG13 VAL 36 HG13 VAL 36 25.907 30.339 -1.726 270 HG21 VAL 36 HG21 VAL 36 28.067 28.694 -4.280 271 HG22 VAL 36 HG22 VAL 36 27.082 29.872 -5.181 272 HG23 VAL 36 HG23 VAL 36 28.799 30.199 -4.859 273 H ASP 37 H ASP 37 27.405 32.375 -5.892 274 HA ASP 37 HA ASP 37 24.574 33.228 -5.995 275 HB2 ASP 37 HB2 ASP 37 26.816 34.382 -7.666 276 HB3 ASP 37 HB3 ASP 37 25.202 35.020 -7.412 277 H GLU 38 H GLU 38 23.525 32.896 -8.052 278 HA GLU 38 HA GLU 38 23.889 30.425 -9.190 279 HB2 GLU 38 HB2 GLU 38 21.976 32.240 -9.436 280 HB3 GLU 38 HB3 GLU 38 22.839 32.681 -10.914 281 HG2 GLU 38 HG2 GLU 38 22.717 30.116 -11.469 282 HG3 GLU 38 HG3 GLU 38 21.542 30.046 -10.162 283 H ASP 39 H ASP 39 25.383 33.467 -10.419 284 HA ASP 39 HA ASP 39 26.588 32.261 -12.686 285 HB2 ASP 39 HB2 ASP 39 27.252 34.844 -11.248 286 HB3 ASP 39 HB3 ASP 39 27.863 34.369 -12.833 287 H PHE 40 H PHE 40 27.572 32.139 -9.328 288 HA PHE 40 HA PHE 40 30.361 31.463 -10.032 289 HB2 PHE 40 HB2 PHE 40 29.836 32.554 -7.891 290 HB3 PHE 40 HB3 PHE 40 28.793 31.209 -7.439 291 HD1 PHE 40 HD1 PHE 40 32.323 32.227 -8.062 292 HD2 PHE 40 HD2 PHE 40 29.705 29.109 -6.644 293 HE1 PHE 40 HE1 PHE 40 34.267 31.042 -7.061 294 HE2 PHE 40 HE2 PHE 40 31.625 27.969 -5.588 295 HZ PHE 40 HZ PHE 40 33.922 28.923 -5.807 296 H LEU 41 H LEU 41 27.280 29.762 -9.331 297 HA LEU 41 HA LEU 41 28.624 27.160 -9.197 298 HB2 LEU 41 HB2 LEU 41 25.789 28.165 -8.833 299 HB3 LEU 41 HB3 LEU 41 26.134 26.437 -8.803 300 HG LEU 41 HG LEU 41 27.360 28.503 -6.936 301 HD11 LEU 41 HD11 LEU 41 24.954 28.137 -6.537 302 HD12 LEU 41 HD12 LEU 41 25.934 27.454 -5.227 303 HD13 LEU 41 HD13 LEU 41 25.226 26.377 -6.453 304 HD21 LEU 41 HD21 LEU 41 28.074 26.484 -5.606 305 HD22 LEU 41 HD22 LEU 41 28.918 26.628 -7.142 306 HD23 LEU 41 HD23 LEU 41 27.588 25.460 -6.970 307 H ARG 42 H ARG 42 26.592 28.768 -11.661 308 HA ARG 42 HA ARG 42 26.262 26.476 -13.314 309 HB2 ARG 42 HB2 ARG 42 25.996 28.013 -15.190 310 HB3 ARG 42 HB3 ARG 42 25.141 28.557 -13.756 311 HG2 ARG 42 HG2 ARG 42 26.926 30.220 -13.311 312 HG3 ARG 42 HG3 ARG 42 27.781 29.696 -14.773 313 HD2 ARG 42 HD2 ARG 42 25.833 30.287 -16.182 314 HD3 ARG 42 HD3 ARG 42 24.900 30.709 -14.749 315 HE ARG 42 HE ARG 42 25.840 32.797 -14.740 316 HH11 ARG 42 HH12 ARG 42 27.976 30.898 -16.806 317 HH12 ARG 42 HH11 ARG 42 28.874 32.317 -17.262 318 HH21 ARG 42 HH21 ARG 42 26.918 34.429 -15.325 319 HH22 ARG 42 HH22 ARG 42 28.280 34.338 -16.443 320 H GLU 43 H GLU 43 29.229 28.257 -12.774 321 HA GLU 43 HA GLU 43 30.724 26.947 -14.890 322 HB2 GLU 43 HB2 GLU 43 31.816 28.355 -12.425 323 HB3 GLU 43 HB3 GLU 43 32.627 28.057 -13.969 324 HG2 GLU 43 HG2 GLU 43 30.668 29.450 -14.989 325 HG3 GLU 43 HG3 GLU 43 30.410 30.021 -13.337 326 H GLN 44 H GLN 44 29.568 25.623 -11.946 327 HA GLN 44 HA GLN 44 31.998 23.962 -11.515 328 HB2 GLN 44 HB2 GLN 44 29.808 24.618 -9.518 329 HB3 GLN 44 HB3 GLN 44 31.360 23.844 -9.202 330 HG2 GLN 44 HG2 GLN 44 30.898 26.709 -10.071 331 HG3 GLN 44 HG3 GLN 44 31.317 26.196 -8.452 332 HE21 GLN 44 HE21 GLN 44 32.801 28.137 -9.772 333 HE22 GLN 44 HE22 GLN 44 34.406 27.482 -10.097 334 H ILE 45 H ILE 45 28.692 23.838 -12.489 335 HA ILE 45 HA ILE 45 27.920 21.266 -11.555 336 HB ILE 45 HB ILE 45 26.747 21.251 -13.955 337 HG12 ILE 45 HG12 ILE 45 26.865 24.237 -13.542 338 HG13 ILE 45 HG13 ILE 45 27.965 23.407 -14.657 339 HG21 ILE 45 HG21 ILE 45 24.834 22.255 -12.901 340 HG22 ILE 45 HG22 ILE 45 25.720 21.241 -11.761 341 HG23 ILE 45 HG23 ILE 45 25.882 23.021 -11.670 342 HD11 ILE 45 HD11 ILE 45 26.049 24.242 -15.918 343 HD12 ILE 45 HD12 ILE 45 25.987 22.457 -15.860 344 HD13 ILE 45 HD13 ILE 45 24.922 23.427 -14.830 345 H ARG 46 H ARG 46 29.154 21.788 -14.990 346 HA ARG 46 HA ARG 46 30.636 20.950 -16.123 347 HB2 ARG 46 HB2 ARG 46 31.779 19.547 -13.688 348 HB3 ARG 46 HB3 ARG 46 32.553 19.603 -15.263 349 HG2 ARG 46 HG2 ARG 46 32.045 21.933 -13.387 350 HG3 ARG 46 HG3 ARG 46 33.592 21.223 -13.812 351 HD2 ARG 46 HD2 ARG 46 31.769 22.845 -15.627 352 HD3 ARG 46 HD3 ARG 46 33.316 23.346 -14.935 353 HE ARG 46 HE ARG 46 33.839 21.008 -16.419 354 HH11 ARG 46 HH11 ARG 46 32.856 24.298 -17.104 355 HH12 ARG 46 HH12 ARG 46 33.519 24.265 -18.718 356 HH21 ARG 46 HH21 ARG 46 34.653 21.019 -18.492 357 HH22 ARG 46 HH22 ARG 46 34.522 22.451 -19.472 358 H ASP 47 H ASP 47 28.449 18.988 -14.656 359 HA ASP 47 HA ASP 47 28.150 17.500 -17.137 360 HB2 ASP 47 HB2 ASP 47 29.893 16.123 -15.886 361 HB3 ASP 47 HB3 ASP 47 28.666 15.838 -14.643 362 H ALA 48 H ALA 48 27.034 18.203 -13.848 363 HA ALA 48 HA ALA 48 24.479 16.868 -14.126 364 HB1 ALA 48 HB1 ALA 48 25.590 17.143 -11.934 365 HB2 ALA 48 HB2 ALA 48 25.497 18.909 -12.072 366 HB3 ALA 48 HB3 ALA 48 24.008 17.959 -11.969 367 H ARG 49 H ARG 49 22.384 17.968 -13.964 368 HA ARG 49 HA ARG 49 22.237 20.027 -16.040 369 HB2 ARG 49 HB2 ARG 49 20.710 17.906 -15.642 370 HB3 ARG 49 HB3 ARG 49 19.846 18.955 -14.519 371 HG2 ARG 49 HG2 ARG 49 18.683 19.172 -16.547 372 HG3 ARG 49 HG3 ARG 49 19.677 20.638 -16.480 373 HD2 ARG 49 HD2 ARG 49 21.330 19.587 -17.992 374 HD3 ARG 49 HD3 ARG 49 20.354 18.099 -18.019 375 HE ARG 49 HE ARG 49 18.702 20.281 -18.809 376 HH11 ARG 49 HH11 ARG 49 21.401 18.471 -20.119 377 HH12 ARG 49 HH12 ARG 49 20.941 18.795 -21.769 378 HH21 ARG 49 HH21 ARG 49 18.167 20.660 -20.939 379 HH22 ARG 49 HH22 ARG 49 19.153 20.005 -22.213 380 H TYR 50 H TYR 50 20.991 19.901 -12.676 381 HA TYR 50 HA TYR 50 21.078 22.898 -12.542 382 HB2 TYR 50 HB2 TYR 50 19.140 21.117 -11.057 383 HB3 TYR 50 HB3 TYR 50 18.979 22.819 -11.411 384 HD1 TYR 50 HD1 TYR 50 19.282 23.023 -14.307 385 HD2 TYR 50 HD2 TYR 50 17.333 19.979 -11.970 386 HE1 TYR 50 HE1 TYR 50 17.702 22.611 -16.177 387 HE2 TYR 50 HE2 TYR 50 15.788 19.516 -13.873 388 HH TYR 50 HH TYR 50 15.933 21.357 -16.925 389 H ALA 51 H ALA 51 22.141 23.795 -10.720 390 HA ALA 51 HA ALA 51 22.751 21.967 -8.427 391 HB1 ALA 51 HB1 ALA 51 24.231 24.450 -9.381 392 HB2 ALA 51 HB2 ALA 51 24.566 23.549 -7.889 393 HB3 ALA 51 HB3 ALA 51 24.799 22.764 -9.467 394 H VAL 52 H VAL 52 22.090 22.633 -6.384 395 HA VAL 52 HA VAL 52 20.465 25.132 -6.168 396 HB VAL 52 HB VAL 52 19.561 22.310 -5.540 397 HG11 VAL 52 HG11 VAL 52 17.434 23.350 -4.739 398 HG12 VAL 52 HG12 VAL 52 18.793 23.661 -3.667 399 HG13 VAL 52 HG13 VAL 52 18.226 24.939 -4.768 400 HG21 VAL 52 HG21 VAL 52 19.195 22.903 -7.859 401 HG22 VAL 52 HG22 VAL 52 17.649 22.958 -7.022 402 HG23 VAL 52 HG23 VAL 52 18.495 24.467 -7.398 403 H ILE 53 H ILE 53 20.386 26.116 -4.209 404 HA ILE 53 HA ILE 53 22.312 25.113 -2.181 405 HB ILE 53 HB ILE 53 22.229 27.521 -3.855 406 HG12 ILE 53 HG12 ILE 53 24.101 26.006 -3.867 407 HG13 ILE 53 HG13 ILE 53 24.599 27.601 -3.328 408 HG21 ILE 53 HG21 ILE 53 21.464 28.813 -1.961 409 HG22 ILE 53 HG22 ILE 53 22.664 28.081 -0.885 410 HG23 ILE 53 HG23 ILE 53 23.173 29.135 -2.226 411 HD11 ILE 53 HD11 ILE 53 24.254 26.580 -0.886 412 HD12 ILE 53 HD12 ILE 53 24.402 25.039 -1.746 413 HD13 ILE 53 HD13 ILE 53 25.717 26.223 -1.827 414 H ARG 54 H ARG 54 21.796 24.995 -0.164 415 HA ARG 54 HA ARG 54 19.730 26.801 1.036 416 HB2 ARG 54 HB2 ARG 54 18.975 24.488 0.452 417 HB3 ARG 54 HB3 ARG 54 20.219 23.870 1.532 418 HG2 ARG 54 HG2 ARG 54 18.165 23.745 2.721 419 HG3 ARG 54 HG3 ARG 54 19.037 25.105 3.438 420 HD2 ARG 54 HD2 ARG 54 17.693 26.692 2.139 421 HD3 ARG 54 HD3 ARG 54 16.929 25.379 1.243 422 HE ARG 54 HE ARG 54 16.358 26.262 4.001 423 HH11 ARG 54 HH11 ARG 54 15.725 23.718 1.655 424 HH12 ARG 54 HH12 ARG 54 14.305 23.176 2.503 425 HH21 ARG 54 HH21 ARG 54 14.540 25.508 5.020 426 HH22 ARG 54 HH22 ARG 54 13.658 24.164 4.360 427 H ILE 55 H ILE 55 21.416 28.061 1.653 428 HA ILE 55 HA ILE 55 23.318 27.107 3.762 429 HB ILE 55 HB ILE 55 23.413 29.605 2.042 430 HG12 ILE 55 HG12 ILE 55 25.696 27.652 2.225 431 HG13 ILE 55 HG13 ILE 55 24.300 27.173 1.259 432 HG21 ILE 55 HG21 ILE 55 25.204 28.776 4.376 433 HG22 ILE 55 HG22 ILE 55 25.627 30.027 3.210 434 HG23 ILE 55 HG23 ILE 55 24.208 30.250 4.239 435 HD11 ILE 55 HD11 ILE 55 25.962 29.691 0.904 436 HD12 ILE 55 HD12 ILE 55 25.977 28.238 -0.110 437 HD13 ILE 55 HD13 ILE 55 24.526 29.263 -0.053 438 HA PRO 56 HA PRO 56 20.438 29.290 6.484 439 HB2 PRO 56 HB2 PRO 56 21.888 29.321 8.814 440 HB3 PRO 56 HB3 PRO 56 21.045 27.873 8.184 441 HG2 PRO 56 HG2 PRO 56 23.973 28.610 7.855 442 HG3 PRO 56 HG3 PRO 56 23.277 27.040 8.371 443 HD2 PRO 56 HD2 PRO 56 24.037 27.481 5.813 444 HD3 PRO 56 HD3 PRO 56 22.565 26.531 6.172 445 H GLY 57 H GLY 57 20.082 31.427 6.752 446 HA2 GLY 57 HA2 GLY 57 20.486 33.647 7.274 447 HA3 GLY 57 HA3 GLY 57 22.221 33.351 7.317 448 H GLN 58 H GLN 58 21.151 32.159 4.349 449 HA GLN 58 HA GLN 58 20.995 34.782 2.993 450 HB2 GLN 58 HB2 GLN 58 22.808 34.452 1.541 451 HB3 GLN 58 HB3 GLN 58 23.384 33.950 3.122 452 HG2 GLN 58 HG2 GLN 58 22.995 31.608 2.503 453 HG3 GLN 58 HG3 GLN 58 22.569 32.096 0.849 454 HE21 GLN 58 HE21 GLN 58 25.199 32.694 3.288 455 HE22 GLN 58 HE22 GLN 58 26.499 32.613 2.123 456 HA PRO 59 HA PRO 59 17.765 32.970 0.798 457 HB2 PRO 59 HB2 PRO 59 17.807 34.059 -1.724 458 HB3 PRO 59 HB3 PRO 59 17.423 34.989 -0.242 459 HG2 PRO 59 HG2 PRO 59 20.102 34.770 -1.657 460 HG3 PRO 59 HG3 PRO 59 19.256 36.258 -1.114 461 HD2 PRO 59 HD2 PRO 59 21.197 35.122 0.375 462 HD3 PRO 59 HD3 PRO 59 19.746 35.814 1.161 463 H VAL 60 H VAL 60 17.091 31.287 -0.489 464 HA VAL 60 HA VAL 60 18.911 29.305 -1.429 465 HB VAL 60 HB VAL 60 15.959 29.802 -1.960 466 HG11 VAL 60 HG11 VAL 60 15.803 27.467 -2.780 467 HG12 VAL 60 HG12 VAL 60 16.714 28.499 -3.877 468 HG13 VAL 60 HG13 VAL 60 17.572 27.361 -2.814 469 HG21 VAL 60 HG21 VAL 60 17.418 27.729 -0.263 470 HG22 VAL 60 HG22 VAL 60 16.591 29.172 0.361 471 HG23 VAL 60 HG23 VAL 60 15.657 27.895 -0.427 472 H VAL 61 H VAL 61 19.940 28.992 -3.260 473 HA VAL 61 HA VAL 61 19.348 30.664 -5.678 474 HB VAL 61 HB VAL 61 21.998 29.540 -4.709 475 HG11 VAL 61 HG11 VAL 61 21.926 29.294 -7.156 476 HG12 VAL 61 HG12 VAL 61 21.409 30.993 -7.317 477 HG13 VAL 61 HG13 VAL 61 23.020 30.584 -6.676 478 HG21 VAL 61 HG21 VAL 61 21.063 32.397 -5.194 479 HG22 VAL 61 HG22 VAL 61 21.347 31.642 -3.610 480 HG23 VAL 61 HG23 VAL 61 22.701 31.903 -4.711 481 H GLU 62 H GLU 62 19.047 29.611 -7.621 482 HA GLU 62 HA GLU 62 19.335 26.649 -7.740 483 HB2 GLU 62 HB2 GLU 62 16.875 28.217 -8.627 484 HB3 GLU 62 HB3 GLU 62 17.169 26.493 -8.884 485 HG2 GLU 62 HG2 GLU 62 17.158 26.143 -6.419 486 HG3 GLU 62 HG3 GLU 62 16.824 27.860 -6.180 487 H VAL 63 H VAL 63 20.652 26.199 -9.452 488 HA VAL 63 HA VAL 63 21.104 28.207 -11.559 489 HB VAL 63 HB VAL 63 22.532 25.615 -10.900 490 HG11 VAL 63 HG11 VAL 63 24.460 26.695 -12.025 491 HG12 VAL 63 HG12 VAL 63 23.128 26.361 -13.128 492 HG13 VAL 63 HG13 VAL 63 23.385 28.023 -12.523 493 HG21 VAL 63 HG21 VAL 63 24.203 26.845 -9.740 494 HG22 VAL 63 HG22 VAL 63 23.381 28.390 -10.015 495 HG23 VAL 63 HG23 VAL 63 22.683 27.161 -8.932 496 H GLY 64 H GLY 64 21.101 27.581 -13.847 497 HA2 GLY 64 HA2 GLY 64 20.459 26.399 -15.687 498 HA3 GLY 64 HA3 GLY 64 20.238 24.972 -14.683 499 H THR 65 H THR 65 18.122 24.539 -13.791 500 HA THR 65 HA THR 65 15.922 26.415 -14.181 501 HB THR 65 HB THR 65 15.632 23.757 -15.648 502 HG1 THR 65 HG1 THR 65 16.781 26.096 -16.455 503 HG21 THR 65 HG21 THR 65 13.765 24.968 -16.799 504 HG22 THR 65 HG22 THR 65 13.996 26.331 -15.681 505 HG23 THR 65 HG23 THR 65 13.482 24.733 -15.076 506 H LYS 66 H LYS 66 14.072 25.816 -12.938 507 HA LYS 66 HA LYS 66 14.505 24.026 -10.769 508 HB2 LYS 66 HB2 LYS 66 13.094 26.044 -10.622 509 HB3 LYS 66 HB3 LYS 66 11.935 25.341 -11.760 510 HG2 LYS 66 HG2 LYS 66 11.458 23.514 -10.133 511 HG3 LYS 66 HG3 LYS 66 12.629 24.225 -9.003 512 HD2 LYS 66 HD2 LYS 66 11.270 26.294 -8.892 513 HD3 LYS 66 HD3 LYS 66 10.113 25.602 -10.051 514 HE2 LYS 66 HE2 LYS 66 9.661 23.732 -8.465 515 HE3 LYS 66 HE3 LYS 66 10.795 24.443 -7.308 516 HZ1 LYS 66 HZ1 LYS 66 8.502 25.069 -6.801 517 HZ2 LYS 66 HZ2 LYS 66 8.299 25.748 -8.270 518 HZ3 LYS 66 HZ3 LYS 66 9.346 26.408 -7.199 519 HA PRO 67 HA PRO 67 13.317 20.316 -12.959 520 HB2 PRO 67 HB2 PRO 67 13.505 18.494 -10.949 521 HB3 PRO 67 HB3 PRO 67 14.935 19.313 -11.661 522 HG2 PRO 67 HG2 PRO 67 13.447 20.014 -9.120 523 HG3 PRO 67 HG3 PRO 67 15.216 19.858 -9.407 524 HD2 PRO 67 HD2 PRO 67 13.923 22.276 -9.461 525 HD3 PRO 67 HD3 PRO 67 15.344 21.911 -10.489 526 H THR 68 H THR 68 11.722 18.857 -13.208 527 HA THR 68 HA THR 68 9.132 19.641 -12.381 528 HB THR 68 HB THR 68 9.786 18.886 -14.637 529 HG1 THR 68 HG1 THR 68 7.836 17.864 -15.030 530 HG21 THR 68 HG21 THR 68 9.439 16.041 -13.617 531 HG22 THR 68 HG22 THR 68 11.025 16.777 -13.957 532 HG23 THR 68 HG23 THR 68 9.844 16.572 -15.257 533 H GLY 69 H GLY 69 11.100 17.060 -11.178 534 HA2 GLY 69 HA2 GLY 69 10.395 16.216 -8.868 535 HA3 GLY 69 HA3 GLY 69 8.830 15.858 -9.620 536 H ASP 70 H ASP 70 9.801 14.940 -12.091 537 HA ASP 70 HA ASP 70 10.822 12.262 -11.502 538 HB2 ASP 70 HB2 ASP 70 10.180 13.548 -14.152 539 HB3 ASP 70 HB3 ASP 70 10.538 11.833 -13.887 540 H VAL 71 H VAL 71 12.665 13.406 -10.448 541 HA VAL 71 HA VAL 71 15.015 13.603 -12.256 542 HB VAL 71 HB VAL 71 15.840 15.549 -11.019 543 HG11 VAL 71 HG11 VAL 71 14.776 17.132 -12.308 544 HG12 VAL 71 HG12 VAL 71 14.438 15.663 -13.202 545 HG13 VAL 71 HG13 VAL 71 13.161 16.382 -12.196 546 HG21 VAL 71 HG21 VAL 71 14.454 16.909 -9.603 547 HG22 VAL 71 HG22 VAL 71 13.068 15.808 -9.804 548 HG23 VAL 71 HG23 VAL 71 14.520 15.284 -8.923 549 H LEU 72 H LEU 72 17.029 13.531 -11.218 550 HA LEU 72 HA LEU 72 17.218 11.605 -8.916 551 HB2 LEU 72 HB2 LEU 72 19.208 12.658 -10.985 552 HB3 LEU 72 HB3 LEU 72 19.647 11.551 -9.703 553 HG LEU 72 HG LEU 72 17.426 10.881 -11.612 554 HD11 LEU 72 HD11 LEU 72 19.107 9.630 -12.979 555 HD12 LEU 72 HD12 LEU 72 20.415 10.336 -12.006 556 HD13 LEU 72 HD13 LEU 72 19.406 11.375 -13.012 557 HD21 LEU 72 HD21 LEU 72 19.357 9.194 -10.023 558 HD22 LEU 72 HD22 LEU 72 18.054 8.553 -11.058 559 HD23 LEU 72 HD23 LEU 72 17.641 9.480 -9.612 560 H GLN 73 H GLN 73 18.102 12.417 -6.885 561 HA GLN 73 HA GLN 73 19.032 15.256 -6.827 562 HB2 GLN 73 HB2 GLN 73 17.367 13.597 -4.894 563 HB3 GLN 73 HB3 GLN 73 17.978 15.239 -4.640 564 HG2 GLN 73 HG2 GLN 73 16.691 15.929 -6.702 565 HG3 GLN 73 HG3 GLN 73 15.903 14.344 -6.677 566 HE21 GLN 73 HE21 GLN 73 15.266 17.432 -5.872 567 HE22 GLN 73 HE22 GLN 73 14.374 17.238 -4.350 568 H GLY 74 H GLY 74 21.153 15.372 -6.296 569 HA2 GLY 74 HA2 GLY 74 22.381 13.326 -4.473 570 HA3 GLY 74 HA3 GLY 74 23.271 14.402 -5.557 571 H ARG 75 H ARG 75 23.485 14.238 -2.561 572 HA ARG 75 HA ARG 75 22.781 17.015 -1.844 573 HB2 ARG 75 HB2 ARG 75 20.678 15.694 -1.470 574 HB3 ARG 75 HB3 ARG 75 21.544 14.659 -0.341 575 HG2 ARG 75 HG2 ARG 75 21.952 16.580 1.155 576 HG3 ARG 75 HG3 ARG 75 21.191 17.681 -0.016 577 HD2 ARG 75 HD2 ARG 75 19.046 16.563 0.262 578 HD3 ARG 75 HD3 ARG 75 19.782 15.320 1.297 579 HE ARG 75 HE ARG 75 20.357 17.783 2.518 580 HH11 ARG 75 HH21 ARG 75 17.461 15.941 1.828 581 HH12 ARG 75 HH22 ARG 75 16.605 16.581 3.205 582 HH21 ARG 75 HH11 ARG 75 19.213 18.562 4.277 583 HH22 ARG 75 HH12 ARG 75 17.582 18.031 4.548 584 H ALA 76 H ALA 76 24.066 17.853 -0.401 585 HA ALA 76 HA ALA 76 25.775 16.156 1.400 586 HB1 ALA 76 HB1 ALA 76 27.002 16.524 -0.694 587 HB2 ALA 76 HB2 ALA 76 26.702 18.271 -0.590 588 HB3 ALA 76 HB3 ALA 76 27.748 17.468 0.610 589 H THR 77 H THR 77 27.010 17.366 2.977 590 HA THR 77 HA THR 77 25.687 19.879 3.917 591 HB THR 77 HB THR 77 26.919 17.703 5.641 592 HG1 THR 77 HG1 THR 77 24.799 17.432 6.345 593 HG21 THR 77 HG21 THR 77 26.015 19.019 7.538 594 HG22 THR 77 HG22 THR 77 25.452 20.273 6.415 595 HG23 THR 77 HG23 THR 77 27.187 19.977 6.633 596 H GLY 78 H GLY 78 27.033 21.537 3.979 597 HA2 GLY 78 HA2 GLY 78 29.883 21.155 3.219 598 HA3 GLY 78 HA3 GLY 78 29.003 22.654 3.194 599 H GLU 79 H GLU 79 31.417 22.876 4.153 600 HA GLU 79 HA GLU 79 31.811 22.012 6.862 601 HB2 GLU 79 HB2 GLU 79 33.512 21.921 5.139 602 HB3 GLU 79 HB3 GLU 79 33.382 23.646 4.867 603 HG2 GLU 79 HG2 GLU 79 35.395 23.106 6.057 604 HG3 GLU 79 HG3 GLU 79 34.346 24.139 7.018 605 H GLU 80 H GLU 80 30.297 24.973 5.668 606 HA GLU 80 HA GLU 80 30.936 26.345 8.269 607 HB2 GLU 80 HB2 GLU 80 29.506 27.350 5.819 608 HB3 GLU 80 HB3 GLU 80 29.837 28.279 7.279 609 HG2 GLU 80 HG2 GLU 80 32.044 27.137 5.492 610 HG3 GLU 80 HG3 GLU 80 31.322 28.704 5.365 611 H GLY 81 H GLY 81 28.954 23.993 7.283 612 HA2 GLY 81 HA2 GLY 81 27.238 23.074 8.462 613 HA3 GLY 81 HA3 GLY 81 26.821 24.624 9.173 614 H GLU 82 H GLU 82 27.197 24.528 5.658 615 HA GLU 82 HA GLU 82 24.384 25.111 5.284 616 HB2 GLU 82 HB2 GLU 82 25.023 25.769 3.158 617 HB3 GLU 82 HB3 GLU 82 26.248 26.410 4.258 618 HG2 GLU 82 HG2 GLU 82 26.723 23.857 2.661 619 HG3 GLU 82 HG3 GLU 82 26.870 25.431 1.917 620 H THR 83 H THR 83 23.422 24.244 3.126 621 HA THR 83 HA THR 83 23.790 21.295 2.902 622 HB THR 83 HB THR 83 21.205 22.835 3.242 623 HG1 THR 83 HG1 THR 83 22.266 21.929 5.048 624 HG21 THR 83 HG21 THR 83 20.017 20.704 2.745 625 HG22 THR 83 HG22 THR 83 21.546 20.011 2.142 626 HG23 THR 83 HG23 THR 83 20.778 21.393 1.315 627 H VAL 84 H VAL 84 24.024 20.658 0.919 628 HA VAL 84 HA VAL 84 23.507 22.550 -1.376 629 HB VAL 84 HB VAL 84 25.922 20.712 -1.158 630 HG11 VAL 84 HG11 VAL 84 26.764 22.125 -3.024 631 HG12 VAL 84 HG12 VAL 84 25.316 21.233 -3.485 632 HG13 VAL 84 HG13 VAL 84 25.205 22.973 -3.095 633 HG21 VAL 84 HG21 VAL 84 25.525 23.623 -0.447 634 HG22 VAL 84 HG22 VAL 84 26.300 22.326 0.494 635 HG23 VAL 84 HG23 VAL 84 27.105 23.002 -0.939 636 H LEU 85 H LEU 85 22.735 21.726 -3.271 637 HA LEU 85 HA LEU 85 22.165 18.839 -3.338 638 HB2 LEU 85 HB2 LEU 85 20.229 20.133 -2.369 639 HB3 LEU 85 HB3 LEU 85 20.181 21.093 -3.854 640 HG LEU 85 HG LEU 85 19.748 18.810 -5.046 641 HD11 LEU 85 HD11 LEU 85 20.215 17.483 -2.853 642 HD12 LEU 85 HD12 LEU 85 18.785 17.072 -3.787 643 HD13 LEU 85 HD13 LEU 85 18.655 18.074 -2.308 644 HD21 LEU 85 HD21 LEU 85 17.371 18.947 -4.599 645 HD22 LEU 85 HD22 LEU 85 18.056 20.549 -4.905 646 HD23 LEU 85 HD23 LEU 85 17.661 20.066 -3.235 647 H VAL 86 H VAL 86 21.947 17.970 -5.374 648 HA VAL 86 HA VAL 86 22.324 19.718 -7.769 649 HB VAL 86 HB VAL 86 24.535 18.671 -7.178 650 HG11 VAL 86 HG11 VAL 86 23.543 16.462 -6.423 651 HG12 VAL 86 HG12 VAL 86 23.344 16.054 -8.142 652 HG13 VAL 86 HG13 VAL 86 24.957 16.368 -7.468 653 HG21 VAL 86 HG21 VAL 86 25.069 18.001 -9.448 654 HG22 VAL 86 HG22 VAL 86 23.347 17.796 -9.833 655 HG23 VAL 86 HG23 VAL 86 23.990 19.417 -9.474 656 H GLU 87 H GLU 87 21.161 19.033 -9.602 657 HA GLU 87 HA GLU 87 19.500 16.612 -9.243 658 HB2 GLU 87 HB2 GLU 87 18.330 19.344 -9.825 659 HB3 GLU 87 HB3 GLU 87 17.448 17.810 -9.746 660 HG2 GLU 87 HG2 GLU 87 18.216 17.551 -7.359 661 HG3 GLU 87 HG3 GLU 87 18.922 19.169 -7.452 662 H GLU 88 H GLU 88 18.976 15.509 -10.966 663 HA GLU 88 HA GLU 88 19.584 16.557 -13.697 664 HB2 GLU 88 HB2 GLU 88 20.199 13.707 -12.796 665 HB3 GLU 88 HB3 GLU 88 20.521 14.438 -14.366 666 HG2 GLU 88 HG2 GLU 88 22.083 16.054 -13.051 667 HG3 GLU 88 HG3 GLU 88 21.924 14.886 -11.729 668 HA PRO 89 HA PRO 89 15.615 14.714 -14.823 669 HB2 PRO 89 HB2 PRO 89 16.091 13.923 -17.431 670 HB3 PRO 89 HB3 PRO 89 15.763 15.607 -16.927 671 HG2 PRO 89 HG2 PRO 89 18.478 14.307 -17.358 672 HG3 PRO 89 HG3 PRO 89 17.873 15.867 -18.016 673 HD2 PRO 89 HD2 PRO 89 19.423 15.790 -15.822 674 HD3 PRO 89 HD3 PRO 89 18.027 16.898 -15.874 675 H ARG 90 H ARG 90 14.784 12.768 -14.543 676 HA ARG 90 HA ARG 90 16.498 10.439 -14.015 677 HB2 ARG 90 HB2 ARG 90 14.587 11.100 -12.528 678 HB3 ARG 90 HB3 ARG 90 13.472 10.652 -13.829 679 HG2 ARG 90 HG2 ARG 90 14.415 8.310 -13.751 680 HG3 ARG 90 HG3 ARG 90 15.451 8.820 -12.402 681 HD2 ARG 90 HD2 ARG 90 13.553 7.761 -11.424 682 HD3 ARG 90 HD3 ARG 90 13.362 9.510 -11.183 683 HE ARG 90 HE ARG 90 12.066 8.179 -13.528 684 HH11 ARG 90 HH21 ARG 90 11.458 9.628 -10.382 685 HH12 ARG 90 HH22 ARG 90 9.816 10.026 -10.820 686 HH21 ARG 90 HH11 ARG 90 9.966 8.751 -13.968 687 HH22 ARG 90 HH12 ARG 90 9.109 9.768 -12.829 Start of MODEL 11 1 H1 GLY 1 H1 GLY 1 -0.429 -1.339 -0.570 2 H2 GLY 1 H2 GLY 1 0.983 -0.907 -1.276 3 H3 GLY 1 H3 GLY 1 0.952 -1.324 0.309 4 HA2 GLY 1 HA2 GLY 1 0.324 -3.590 -0.229 5 HA3 GLY 1 HA3 GLY 1 0.372 -3.142 -1.944 6 H SER 2 H SER 2 2.036 -4.481 -2.603 7 HA SER 2 HA SER 2 4.580 -4.681 -1.190 8 HB2 SER 2 HB2 SER 2 5.227 -6.092 -3.119 9 HB3 SER 2 HB3 SER 2 3.733 -6.612 -2.328 10 HG SER 2 HG SER 2 3.554 -6.601 -4.615 11 H GLU 3 H GLU 3 6.664 -4.256 -2.207 12 HA GLU 3 HA GLU 3 6.801 -2.062 -4.180 13 HB2 GLU 3 HB2 GLU 3 6.471 -1.019 -1.921 14 HB3 GLU 3 HB3 GLU 3 7.963 -1.788 -1.374 15 HG2 GLU 3 HG2 GLU 3 9.264 -0.489 -3.000 16 HG3 GLU 3 HG3 GLU 3 7.784 0.143 -3.729 17 H THR 4 H THR 4 8.786 -1.884 -5.220 18 HA THR 4 HA THR 4 10.380 -4.148 -5.566 19 HB THR 4 HB THR 4 11.151 -1.265 -6.173 20 HG1 THR 4 HG1 THR 4 10.101 -1.682 -8.129 21 HG21 THR 4 HG21 THR 4 11.972 -3.923 -7.439 22 HG22 THR 4 HG22 THR 4 13.035 -2.695 -6.697 23 HG23 THR 4 HG23 THR 4 12.217 -2.342 -8.213 24 H ARG 5 H ARG 5 12.608 -4.543 -5.188 25 HA ARG 5 HA ARG 5 13.485 -3.694 -2.437 26 HB2 ARG 5 HB2 ARG 5 14.509 -5.788 -2.131 27 HB3 ARG 5 HB3 ARG 5 12.881 -6.074 -2.746 28 HG2 ARG 5 HG2 ARG 5 13.865 -6.466 -5.040 29 HG3 ARG 5 HG3 ARG 5 15.484 -6.273 -4.339 30 HD2 ARG 5 HD2 ARG 5 14.899 -8.163 -2.730 31 HD3 ARG 5 HD3 ARG 5 13.398 -8.370 -3.634 32 HE ARG 5 HE ARG 5 14.546 -9.342 -5.400 33 HH11 ARG 5 HH12 ARG 5 16.964 -8.075 -3.187 34 HH12 ARG 5 HH11 ARG 5 18.263 -8.916 -3.986 35 HH21 ARG 5 HH22 ARG 5 16.253 -10.386 -6.362 36 HH22 ARG 5 HH21 ARG 5 17.864 -10.190 -5.735 37 H THR 6 H THR 6 14.643 -3.808 -5.737 38 HA THR 6 HA THR 6 17.438 -3.390 -5.096 39 HB THR 6 HB THR 6 16.013 -2.979 -7.752 40 HG1 THR 6 HG1 THR 6 16.653 -5.119 -8.123 41 HG21 THR 6 HG21 THR 6 18.321 -2.093 -7.740 42 HG22 THR 6 HG22 THR 6 18.231 -3.568 -8.707 43 HG23 THR 6 HG23 THR 6 18.921 -3.628 -7.069 44 H ILE 7 H ILE 7 18.475 -1.520 -4.678 45 HA ILE 7 HA ILE 7 17.045 1.050 -4.938 46 HB ILE 7 HB ILE 7 19.656 0.392 -3.559 47 HG12 ILE 7 HG12 ILE 7 17.855 -0.803 -2.460 48 HG13 ILE 7 HG13 ILE 7 18.412 0.519 -1.455 49 HG21 ILE 7 HG21 ILE 7 17.945 2.919 -3.494 50 HG22 ILE 7 HG22 ILE 7 19.259 2.560 -2.357 51 HG23 ILE 7 HG23 ILE 7 19.621 2.757 -4.066 52 HD11 ILE 7 HD11 ILE 7 15.982 0.300 -1.348 53 HD12 ILE 7 HD12 ILE 7 16.397 1.851 -2.094 54 HD13 ILE 7 HD13 ILE 7 15.838 0.490 -3.099 55 H SER 8 H SER 8 17.795 2.771 -6.075 56 HA SER 8 HA SER 8 19.104 2.192 -8.543 57 HB2 SER 8 HB2 SER 8 18.249 4.919 -7.503 58 HB3 SER 8 HB3 SER 8 18.512 4.468 -9.197 59 HG SER 8 HG SER 8 16.749 3.077 -9.070 60 H SER 9 H SER 9 20.955 1.934 -6.409 61 HA SER 9 HA SER 9 22.851 3.939 -6.224 62 HB2 SER 9 HB2 SER 9 23.390 0.990 -5.849 63 HB3 SER 9 HB3 SER 9 24.200 2.352 -5.059 64 HG SER 9 HG SER 9 22.641 1.456 -3.687 65 H THR 10 H THR 10 22.691 4.153 -8.769 66 HA THR 10 HA THR 10 25.369 3.765 -9.784 67 HB THR 10 HB THR 10 24.474 3.307 -12.085 68 HG1 THR 10 HG1 THR 10 22.479 2.157 -12.146 69 HG21 THR 10 HG21 THR 10 23.974 1.038 -10.115 70 HG22 THR 10 HG22 THR 10 25.576 1.521 -10.717 71 HG23 THR 10 HG23 THR 10 24.366 0.879 -11.843 72 H ALA 11 H ALA 11 22.255 4.814 -11.106 73 HA ALA 11 HA ALA 11 23.100 7.441 -11.851 74 HB1 ALA 11 HB1 ALA 11 21.294 6.190 -12.965 75 HB2 ALA 11 HB2 ALA 11 20.293 6.298 -11.498 76 HB3 ALA 11 HB3 ALA 11 20.725 7.768 -12.399 77 H GLN 12 H GLN 12 21.127 6.333 -9.014 78 HA GLN 12 HA GLN 12 21.024 9.029 -7.902 79 HB2 GLN 12 HB2 GLN 12 19.209 7.438 -7.592 80 HB3 GLN 12 HB3 GLN 12 20.282 6.331 -6.732 81 HG2 GLN 12 HG2 GLN 12 18.786 7.598 -5.226 82 HG3 GLN 12 HG3 GLN 12 20.490 7.800 -4.865 83 HE21 GLN 12 HE22 GLN 12 20.524 9.829 -3.916 84 HE22 GLN 12 HE21 GLN 12 19.896 11.277 -4.687 85 H GLU 13 H GLU 13 23.333 6.374 -7.659 86 HA GLU 13 HA GLU 13 24.693 7.408 -5.322 87 HB2 GLU 13 HB2 GLU 13 24.812 5.054 -6.096 88 HB3 GLU 13 HB3 GLU 13 25.695 5.556 -7.523 89 HG2 GLU 13 HG2 GLU 13 27.338 4.770 -6.055 90 HG3 GLU 13 HG3 GLU 13 27.472 6.514 -5.898 91 H ARG 14 H ARG 14 25.606 7.600 -8.755 92 HA ARG 14 HA ARG 14 27.815 9.189 -8.494 93 HB2 ARG 14 HB2 ARG 14 27.684 9.917 -10.792 94 HB3 ARG 14 HB3 ARG 14 27.387 8.197 -10.638 95 HG2 ARG 14 HG2 ARG 14 25.277 8.324 -11.461 96 HG3 ARG 14 HG3 ARG 14 24.904 9.873 -10.724 97 HD2 ARG 14 HD2 ARG 14 26.849 9.691 -13.041 98 HD3 ARG 14 HD3 ARG 14 25.106 9.679 -13.296 99 HE ARG 14 HE ARG 14 26.451 11.940 -11.799 100 HH11 ARG 14 HH11 ARG 14 24.277 11.040 -14.495 101 HH12 ARG 14 HH12 ARG 14 23.845 12.748 -14.654 102 HH21 ARG 14 HH21 ARG 14 25.765 13.947 -12.207 103 HH22 ARG 14 HH22 ARG 14 24.636 14.198 -13.563 104 H VAL 15 H VAL 15 24.568 10.409 -8.672 105 HA VAL 15 HA VAL 15 25.225 13.197 -8.741 106 HB VAL 15 HB VAL 15 22.987 13.729 -7.986 107 HG11 VAL 15 HG11 VAL 15 21.846 12.933 -9.972 108 HG12 VAL 15 HG12 VAL 15 23.521 13.361 -10.364 109 HG13 VAL 15 HG13 VAL 15 23.053 11.654 -10.211 110 HG21 VAL 15 HG21 VAL 15 22.472 10.740 -7.954 111 HG22 VAL 15 HG22 VAL 15 22.557 11.760 -6.504 112 HG23 VAL 15 HG23 VAL 15 21.281 12.028 -7.701 113 H ASP 16 H ASP 16 25.442 10.922 -6.120 114 HA ASP 16 HA ASP 16 25.247 12.953 -4.009 115 HB2 ASP 16 HB2 ASP 16 24.830 10.515 -3.661 116 HB3 ASP 16 HB3 ASP 16 26.543 10.203 -3.935 117 H LEU 17 H LEU 17 28.027 11.413 -5.718 118 HA LEU 17 HA LEU 17 30.034 12.637 -4.150 119 HB2 LEU 17 HB2 LEU 17 30.092 11.400 -6.947 120 HB3 LEU 17 HB3 LEU 17 31.514 11.979 -6.119 121 HG LEU 17 HG LEU 17 31.466 9.637 -5.923 122 HD11 LEU 17 HD11 LEU 17 31.632 9.284 -3.547 123 HD12 LEU 17 HD12 LEU 17 30.630 10.704 -3.200 124 HD13 LEU 17 HD13 LEU 17 32.244 10.902 -3.926 125 HD21 LEU 17 HD21 LEU 17 29.759 8.300 -4.922 126 HD22 LEU 17 HD22 LEU 17 29.018 9.262 -6.209 127 HD23 LEU 17 HD23 LEU 17 28.788 9.715 -4.501 128 H GLU 18 H GLU 18 28.753 13.552 -7.291 129 HA GLU 18 HA GLU 18 30.242 15.978 -7.635 130 HB2 GLU 18 HB2 GLU 18 28.506 16.566 -9.304 131 HB3 GLU 18 HB3 GLU 18 29.206 14.968 -9.517 132 HG2 GLU 18 HG2 GLU 18 27.163 14.072 -8.209 133 HG3 GLU 18 HG3 GLU 18 26.459 15.652 -8.433 134 H ALA 19 H ALA 19 27.191 15.350 -5.781 135 HA ALA 19 HA ALA 19 26.772 18.150 -5.155 136 HB1 ALA 19 HB1 ALA 19 25.902 15.676 -3.616 137 HB2 ALA 19 HB2 ALA 19 25.219 17.312 -3.515 138 HB3 ALA 19 HB3 ALA 19 25.048 16.365 -5.010 139 H VAL 20 H VAL 20 28.641 15.539 -3.557 140 HA VAL 20 HA VAL 20 29.511 17.154 -1.294 141 HB VAL 20 HB VAL 20 30.664 14.644 -2.544 142 HG11 VAL 20 HG11 VAL 20 31.491 16.037 0.040 143 HG12 VAL 20 HG12 VAL 20 31.957 14.387 -0.428 144 HG13 VAL 20 HG13 VAL 20 32.517 15.756 -1.386 145 HG21 VAL 20 HG21 VAL 20 29.135 15.119 0.058 146 HG22 VAL 20 HG22 VAL 20 28.437 14.427 -1.415 147 HG23 VAL 20 HG23 VAL 20 29.708 13.555 -0.559 148 H ARG 21 H ARG 21 31.067 16.525 -4.467 149 HA ARG 21 HA ARG 21 33.244 18.294 -4.139 150 HB2 ARG 21 HB2 ARG 21 31.626 17.467 -6.573 151 HB3 ARG 21 HB3 ARG 21 32.903 18.662 -6.740 152 HG2 ARG 21 HG2 ARG 21 33.344 15.903 -5.517 153 HG3 ARG 21 HG3 ARG 21 33.584 16.262 -7.227 154 HD2 ARG 21 HD2 ARG 21 35.058 17.666 -4.954 155 HD3 ARG 21 HD3 ARG 21 35.694 16.302 -5.886 156 HE ARG 21 HE ARG 21 35.019 18.139 -7.832 157 HH11 ARG 21 HH12 ARG 21 37.200 18.230 -5.091 158 HH12 ARG 21 HH11 ARG 21 38.226 19.432 -5.826 159 HH21 ARG 21 HH21 ARG 21 36.366 19.676 -8.713 160 HH22 ARG 21 HH22 ARG 21 37.765 20.215 -7.835 161 H LEU 22 H LEU 22 29.944 19.234 -5.167 162 HA LEU 22 HA LEU 22 30.630 22.048 -5.266 163 HB2 LEU 22 HB2 LEU 22 28.055 20.534 -5.453 164 HB3 LEU 22 HB3 LEU 22 28.059 22.239 -4.952 165 HG LEU 22 HG LEU 22 29.529 22.743 -6.988 166 HD11 LEU 22 HD11 LEU 22 28.522 20.003 -7.851 167 HD12 LEU 22 HD12 LEU 22 30.223 20.456 -7.579 168 HD13 LEU 22 HD13 LEU 22 29.305 21.197 -8.899 169 HD21 LEU 22 HD21 LEU 22 27.188 23.315 -6.756 170 HD22 LEU 22 HD22 LEU 22 26.716 21.734 -7.433 171 HD23 LEU 22 HD23 LEU 22 27.611 22.918 -8.437 172 H ALA 23 H ALA 23 29.399 20.007 -2.544 173 HA ALA 23 HA ALA 23 29.097 22.214 -0.764 174 HB1 ALA 23 HB1 ALA 23 30.119 19.401 -0.211 175 HB2 ALA 23 HB2 ALA 23 29.579 20.571 1.009 176 HB3 ALA 23 HB3 ALA 23 28.429 19.956 -0.194 177 H SER 24 H SER 24 32.090 20.475 -1.735 178 HA SER 24 HA SER 24 33.856 22.200 -0.294 179 HB2 SER 24 HB2 SER 24 34.473 20.516 -2.747 180 HB3 SER 24 HB3 SER 24 35.648 21.276 -1.662 181 HG SER 24 HG SER 24 35.261 19.090 -1.101 182 H ILE 25 H ILE 25 32.684 22.504 -3.758 183 HA ILE 25 HA ILE 25 34.367 24.787 -4.158 184 HB ILE 25 HB ILE 25 31.809 24.600 -5.672 185 HG12 ILE 25 HG12 ILE 25 32.523 22.337 -5.922 186 HG13 ILE 25 HG13 ILE 25 32.902 23.198 -7.355 187 HG21 ILE 25 HG21 ILE 25 34.678 25.434 -6.340 188 HG22 ILE 25 HG22 ILE 25 33.310 25.485 -7.449 189 HG23 ILE 25 HG23 ILE 25 33.320 26.521 -6.026 190 HD11 ILE 25 HD11 ILE 25 34.945 22.447 -5.234 191 HD12 ILE 25 HD12 ILE 25 34.606 21.554 -6.722 192 HD13 ILE 25 HD13 ILE 25 35.278 23.200 -6.822 193 H VAL 26 H VAL 26 31.093 24.452 -2.784 194 HA VAL 26 HA VAL 26 30.501 27.294 -2.534 195 HB VAL 26 HB VAL 26 29.488 24.841 -1.064 196 HG11 VAL 26 HG11 VAL 26 28.495 27.719 -0.995 197 HG12 VAL 26 HG12 VAL 26 27.582 26.318 -0.388 198 HG13 VAL 26 HG13 VAL 26 29.104 26.755 0.369 199 HG21 VAL 26 HG21 VAL 26 28.905 25.015 -3.571 200 HG22 VAL 26 HG22 VAL 26 27.532 25.001 -2.483 201 HG23 VAL 26 HG23 VAL 26 28.082 26.536 -3.184 202 H ASP 27 H ASP 27 31.834 24.835 -0.088 203 HA ASP 27 HA ASP 27 32.470 26.747 1.870 204 HB2 ASP 27 HB2 ASP 27 34.073 24.302 1.043 205 HB3 ASP 27 HB3 ASP 27 34.297 25.219 2.530 206 H SER 28 H SER 28 34.422 25.926 -0.999 207 HA SER 28 HA SER 28 36.608 27.662 -0.463 208 HB2 SER 28 HB2 SER 28 35.508 26.946 -3.213 209 HB3 SER 28 HB3 SER 28 37.125 27.547 -2.836 210 HG SER 28 HG SER 28 35.966 25.068 -2.018 211 H ARG 29 H ARG 29 33.431 28.396 -1.792 212 HA ARG 29 HA ARG 29 33.999 31.241 -2.264 213 HB2 ARG 29 HB2 ARG 29 32.435 29.894 -3.648 214 HB3 ARG 29 HB3 ARG 29 31.388 29.659 -2.260 215 HG2 ARG 29 HG2 ARG 29 30.425 31.344 -3.580 216 HG3 ARG 29 HG3 ARG 29 31.040 32.126 -2.126 217 HD2 ARG 29 HD2 ARG 29 32.949 33.011 -3.375 218 HD3 ARG 29 HD3 ARG 29 32.480 32.056 -4.802 219 HE ARG 29 HE ARG 29 30.387 33.881 -3.824 220 HH11 ARG 29 HH11 ARG 29 33.240 33.868 -5.841 221 HH12 ARG 29 HH12 ARG 29 32.628 35.111 -6.896 222 HH21 ARG 29 HH21 ARG 29 29.529 35.300 -5.375 223 HH22 ARG 29 HH22 ARG 29 30.612 35.947 -6.573 224 H LEU 30 H LEU 30 32.348 29.365 0.348 225 HA LEU 30 HA LEU 30 31.561 31.707 1.829 226 HB2 LEU 30 HB2 LEU 30 32.167 28.916 2.855 227 HB3 LEU 30 HB3 LEU 30 31.332 30.183 3.751 228 HG LEU 30 HG LEU 30 30.319 28.889 1.204 229 HD11 LEU 30 HD11 LEU 30 28.701 27.747 2.576 230 HD12 LEU 30 HD12 LEU 30 29.205 28.633 4.018 231 HD13 LEU 30 HD13 LEU 30 30.283 27.412 3.309 232 HD21 LEU 30 HD21 LEU 30 28.958 30.911 3.012 233 HD22 LEU 30 HD22 LEU 30 28.163 29.999 1.711 234 HD23 LEU 30 HD23 LEU 30 29.439 31.145 1.312 235 H ILE 31 H ILE 31 34.567 29.811 1.858 236 HA ILE 31 HA ILE 31 35.943 31.537 3.777 237 HB ILE 31 HB ILE 31 36.915 29.484 1.752 238 HG12 ILE 31 HG12 ILE 31 36.721 29.282 4.796 239 HG13 ILE 31 HG13 ILE 31 35.456 28.707 3.725 240 HG21 ILE 31 HG21 ILE 31 38.760 31.051 2.222 241 HG22 ILE 31 HG22 ILE 31 38.490 30.873 3.971 242 HG23 ILE 31 HG23 ILE 31 39.077 29.510 2.994 243 HD11 ILE 31 HD11 ILE 31 38.282 27.612 3.864 244 HD12 ILE 31 HD12 ILE 31 36.776 26.825 4.350 245 HD13 ILE 31 HD13 ILE 31 37.078 27.152 2.633 246 H GLY 32 H GLY 32 35.627 31.473 0.234 247 HA2 GLY 32 HA2 GLY 32 37.735 33.210 -0.462 248 HA3 GLY 32 HA3 GLY 32 36.328 32.749 -1.446 249 H THR 33 H THR 33 34.291 33.798 0.087 250 HA THR 33 HA THR 33 34.797 36.668 0.438 251 HB THR 33 HB THR 33 34.405 36.486 -1.984 252 HG1 THR 33 HG1 THR 33 32.837 38.065 -2.089 253 HG21 THR 33 HG21 THR 33 32.347 35.830 -2.948 254 HG22 THR 33 HG22 THR 33 31.542 35.682 -1.375 255 HG23 THR 33 HG23 THR 33 32.809 34.518 -1.840 256 H GLY 34 H GLY 34 32.508 33.949 0.645 257 HA2 GLY 34 HA2 GLY 34 31.423 33.556 2.748 258 HA3 GLY 34 HA3 GLY 34 31.342 35.272 3.097 259 H SER 35 H SER 35 30.274 34.462 -0.124 260 HA SER 35 HA SER 35 27.675 33.428 0.534 261 HB2 SER 35 HB2 SER 35 28.033 36.227 -0.634 262 HB3 SER 35 HB3 SER 35 26.526 35.297 -0.759 263 HG SER 35 HG SER 35 27.658 35.467 1.768 264 H VAL 36 H VAL 36 26.722 32.441 -1.290 265 HA VAL 36 HA VAL 36 28.420 32.272 -3.762 266 HB VAL 36 HB VAL 36 28.529 30.241 -2.386 267 HG11 VAL 36 HG11 VAL 36 26.266 30.275 -1.378 268 HG12 VAL 36 HG12 VAL 36 25.558 29.900 -2.965 269 HG13 VAL 36 HG13 VAL 36 26.635 28.735 -2.171 270 HG21 VAL 36 HG21 VAL 36 26.991 29.801 -4.968 271 HG22 VAL 36 HG22 VAL 36 28.715 30.223 -4.870 272 HG23 VAL 36 HG23 VAL 36 28.141 28.693 -4.185 273 H ASP 37 H ASP 37 27.435 32.459 -5.740 274 HA ASP 37 HA ASP 37 24.562 33.126 -5.823 275 HB2 ASP 37 HB2 ASP 37 26.722 34.462 -7.465 276 HB3 ASP 37 HB3 ASP 37 25.088 35.016 -7.142 277 H GLU 38 H GLU 38 23.573 32.805 -7.943 278 HA GLU 38 HA GLU 38 24.051 30.371 -9.082 279 HB2 GLU 38 HB2 GLU 38 22.080 32.091 -9.378 280 HB3 GLU 38 HB3 GLU 38 22.983 32.637 -10.793 281 HG2 GLU 38 HG2 GLU 38 23.019 30.011 -11.350 282 HG3 GLU 38 HG3 GLU 38 21.666 29.984 -10.229 283 H ASP 39 H ASP 39 25.489 33.445 -10.269 284 HA ASP 39 HA ASP 39 26.653 32.320 -12.616 285 HB2 ASP 39 HB2 ASP 39 26.116 34.735 -12.232 286 HB3 ASP 39 HB3 ASP 39 27.453 34.811 -11.080 287 H PHE 40 H PHE 40 27.698 32.211 -9.254 288 HA PHE 40 HA PHE 40 30.457 31.458 -9.965 289 HB2 PHE 40 HB2 PHE 40 29.991 32.606 -7.843 290 HB3 PHE 40 HB3 PHE 40 28.930 31.292 -7.343 291 HD1 PHE 40 HD2 PHE 40 32.469 32.183 -8.128 292 HD2 PHE 40 HD1 PHE 40 29.811 29.204 -6.501 293 HE1 PHE 40 HE2 PHE 40 34.417 30.937 -7.211 294 HE2 PHE 40 HE1 PHE 40 31.739 28.006 -5.530 295 HZ PHE 40 HZ PHE 40 34.056 28.858 -5.895 296 H LEU 41 H LEU 41 27.333 29.788 -9.278 297 HA LEU 41 HA LEU 41 28.686 27.173 -9.160 298 HB2 LEU 41 HB2 LEU 41 25.838 28.146 -8.823 299 HB3 LEU 41 HB3 LEU 41 26.208 26.427 -8.818 300 HG LEU 41 HG LEU 41 27.303 28.508 -6.879 301 HD11 LEU 41 HD11 LEU 41 25.927 27.323 -5.226 302 HD12 LEU 41 HD12 LEU 41 25.347 26.203 -6.482 303 HD13 LEU 41 HD13 LEU 41 24.921 27.931 -6.552 304 HD21 LEU 41 HD21 LEU 41 29.017 26.796 -7.075 305 HD22 LEU 41 HD22 LEU 41 27.798 25.503 -7.034 306 HD23 LEU 41 HD23 LEU 41 28.126 26.483 -5.593 307 H ARG 42 H ARG 42 26.703 28.859 -11.605 308 HA ARG 42 HA ARG 42 26.246 26.650 -13.293 309 HB2 ARG 42 HB2 ARG 42 25.931 28.202 -15.101 310 HB3 ARG 42 HB3 ARG 42 25.209 28.768 -13.594 311 HG2 ARG 42 HG2 ARG 42 27.107 30.309 -13.237 312 HG3 ARG 42 HG3 ARG 42 27.894 29.709 -14.696 313 HD2 ARG 42 HD2 ARG 42 26.873 31.763 -15.186 314 HD3 ARG 42 HD3 ARG 42 26.032 30.512 -16.084 315 HE ARG 42 HE ARG 42 24.260 30.638 -14.228 316 HH11 ARG 42 HH11 ARG 42 26.103 33.576 -14.900 317 HH12 ARG 42 HH12 ARG 42 24.653 34.543 -14.933 318 HH21 ARG 42 HH21 ARG 42 22.541 31.978 -14.032 319 HH22 ARG 42 HH22 ARG 42 22.720 33.690 -14.343 320 H GLU 43 H GLU 43 29.354 28.273 -12.902 321 HA GLU 43 HA GLU 43 30.560 26.699 -15.102 322 HB2 GLU 43 HB2 GLU 43 32.631 27.908 -14.490 323 HB3 GLU 43 HB3 GLU 43 31.293 28.964 -14.951 324 HG2 GLU 43 HG2 GLU 43 30.906 29.628 -12.669 325 HG3 GLU 43 HG3 GLU 43 31.926 28.320 -12.068 326 H GLN 44 H GLN 44 29.629 25.771 -12.075 327 HA GLN 44 HA GLN 44 32.067 24.119 -11.555 328 HB2 GLN 44 HB2 GLN 44 30.078 25.217 -9.538 329 HB3 GLN 44 HB3 GLN 44 31.490 24.230 -9.177 330 HG2 GLN 44 HG2 GLN 44 31.527 26.991 -10.428 331 HG3 GLN 44 HG3 GLN 44 31.884 26.657 -8.754 332 HE21 GLN 44 HE21 GLN 44 33.588 27.939 -10.894 333 HE22 GLN 44 HE22 GLN 44 35.044 26.966 -10.855 334 H ILE 45 H ILE 45 28.602 24.037 -12.129 335 HA ILE 45 HA ILE 45 27.893 21.496 -11.193 336 HB ILE 45 HB ILE 45 26.749 21.340 -13.617 337 HG12 ILE 45 HG12 ILE 45 27.033 24.362 -13.334 338 HG13 ILE 45 HG13 ILE 45 27.944 23.402 -14.506 339 HG21 ILE 45 HG21 ILE 45 24.810 22.354 -12.649 340 HG22 ILE 45 HG22 ILE 45 25.708 21.478 -11.408 341 HG23 ILE 45 HG23 ILE 45 25.807 23.274 -11.487 342 HD11 ILE 45 HD11 ILE 45 24.920 23.743 -14.427 343 HD12 ILE 45 HD12 ILE 45 26.054 24.392 -15.620 344 HD13 ILE 45 HD13 ILE 45 25.791 22.643 -15.522 345 H ARG 46 H ARG 46 29.135 21.977 -14.560 346 HA ARG 46 HA ARG 46 30.629 21.107 -15.737 347 HB2 ARG 46 HB2 ARG 46 31.888 20.928 -13.225 348 HB3 ARG 46 HB3 ARG 46 32.036 19.303 -13.871 349 HG2 ARG 46 HG2 ARG 46 33.980 20.431 -14.574 350 HG3 ARG 46 HG3 ARG 46 32.957 20.385 -16.016 351 HD2 ARG 46 HD2 ARG 46 32.238 22.748 -15.527 352 HD3 ARG 46 HD3 ARG 46 33.300 22.744 -14.105 353 HE ARG 46 HE ARG 46 34.651 22.023 -16.597 354 HH11 ARG 46 HH21 ARG 46 33.758 24.844 -14.669 355 HH12 ARG 46 HH22 ARG 46 35.057 25.790 -15.343 356 HH21 ARG 46 HH11 ARG 46 36.246 23.315 -17.409 357 HH22 ARG 46 HH12 ARG 46 36.408 24.956 -16.867 358 H ASP 47 H ASP 47 28.546 19.058 -14.118 359 HA ASP 47 HA ASP 47 28.387 17.350 -16.553 360 HB2 ASP 47 HB2 ASP 47 30.058 16.293 -14.978 361 HB3 ASP 47 HB3 ASP 47 28.778 16.167 -13.771 362 H ALA 48 H ALA 48 26.902 18.563 -13.595 363 HA ALA 48 HA ALA 48 24.412 17.066 -13.945 364 HB1 ALA 48 HB1 ALA 48 25.095 19.303 -11.987 365 HB2 ALA 48 HB2 ALA 48 23.705 18.195 -11.927 366 HB3 ALA 48 HB3 ALA 48 25.342 17.579 -11.685 367 H ARG 49 H ARG 49 22.388 18.000 -14.345 368 HA ARG 49 HA ARG 49 22.195 20.300 -16.086 369 HB2 ARG 49 HB2 ARG 49 20.420 18.208 -15.026 370 HB3 ARG 49 HB3 ARG 49 19.648 19.751 -14.888 371 HG2 ARG 49 HG2 ARG 49 19.109 18.619 -16.996 372 HG3 ARG 49 HG3 ARG 49 19.820 20.213 -17.212 373 HD2 ARG 49 HD2 ARG 49 20.579 18.405 -18.825 374 HD3 ARG 49 HD3 ARG 49 21.867 19.317 -18.035 375 HE ARG 49 HE ARG 49 21.587 17.106 -16.383 376 HH11 ARG 49 HH11 ARG 49 22.316 17.432 -19.802 377 HH12 ARG 49 HH12 ARG 49 23.355 16.032 -19.785 378 HH21 ARG 49 HH21 ARG 49 22.907 15.443 -16.395 379 HH22 ARG 49 HH22 ARG 49 23.691 14.916 -17.872 380 H TYR 50 H TYR 50 20.997 19.916 -12.652 381 HA TYR 50 HA TYR 50 21.169 22.906 -12.449 382 HB2 TYR 50 HB2 TYR 50 19.168 21.145 -11.045 383 HB3 TYR 50 HB3 TYR 50 19.057 22.857 -11.394 384 HD1 TYR 50 HD1 TYR 50 19.453 23.101 -14.247 385 HD2 TYR 50 HD2 TYR 50 17.421 20.000 -12.077 386 HE1 TYR 50 HE1 TYR 50 18.107 22.593 -16.266 387 HE2 TYR 50 HE2 TYR 50 16.056 19.486 -14.104 388 HH TYR 50 HH TYR 50 16.470 21.263 -17.169 389 H ALA 51 H ALA 51 22.259 23.772 -10.657 390 HA ALA 51 HA ALA 51 22.680 21.968 -8.306 391 HB1 ALA 51 HB1 ALA 51 24.354 24.305 -9.300 392 HB2 ALA 51 HB2 ALA 51 24.573 23.468 -7.752 393 HB3 ALA 51 HB3 ALA 51 24.811 22.583 -9.273 394 H VAL 52 H VAL 52 21.973 22.699 -6.342 395 HA VAL 52 HA VAL 52 20.452 25.268 -6.207 396 HB VAL 52 HB VAL 52 19.455 22.473 -5.541 397 HG11 VAL 52 HG11 VAL 52 18.169 25.172 -4.949 398 HG12 VAL 52 HG12 VAL 52 17.311 23.618 -4.899 399 HG13 VAL 52 HG13 VAL 52 18.630 23.922 -3.774 400 HG21 VAL 52 HG21 VAL 52 17.642 23.049 -7.144 401 HG22 VAL 52 HG22 VAL 52 18.489 24.555 -7.538 402 HG23 VAL 52 HG23 VAL 52 19.227 22.983 -7.907 403 H ILE 53 H ILE 53 20.509 26.342 -4.218 404 HA ILE 53 HA ILE 53 22.233 25.077 -2.204 405 HB ILE 53 HB ILE 53 22.473 27.471 -3.834 406 HG12 ILE 53 HG12 ILE 53 24.240 25.879 -3.647 407 HG13 ILE 53 HG13 ILE 53 24.773 27.435 -3.030 408 HG21 ILE 53 HG21 ILE 53 22.635 28.073 -0.851 409 HG22 ILE 53 HG22 ILE 53 23.323 29.071 -2.151 410 HG23 ILE 53 HG23 ILE 53 21.579 28.835 -2.054 411 HD11 ILE 53 HD11 ILE 53 24.060 26.434 -0.667 412 HD12 ILE 53 HD12 ILE 53 24.167 24.885 -1.535 413 HD13 ILE 53 HD13 ILE 53 25.590 25.930 -1.427 414 H ARG 54 H ARG 54 21.657 24.908 -0.242 415 HA ARG 54 HA ARG 54 19.630 26.761 0.979 416 HB2 ARG 54 HB2 ARG 54 20.112 23.809 1.546 417 HB3 ARG 54 HB3 ARG 54 18.943 24.839 2.358 418 HG2 ARG 54 HG2 ARG 54 18.897 24.005 -0.583 419 HG3 ARG 54 HG3 ARG 54 17.941 23.285 0.700 420 HD2 ARG 54 HD2 ARG 54 17.707 26.188 -0.193 421 HD3 ARG 54 HD3 ARG 54 16.681 24.848 -0.731 422 HE ARG 54 HE ARG 54 16.784 25.134 2.179 423 HH11 ARG 54 HH11 ARG 54 15.001 26.164 -0.663 424 HH12 ARG 54 HH12 ARG 54 13.603 26.616 0.273 425 HH21 ARG 54 HH21 ARG 54 14.963 25.712 3.300 426 HH22 ARG 54 HH22 ARG 54 13.587 26.354 2.457 427 H ILE 55 H ILE 55 21.265 28.188 1.747 428 HA ILE 55 HA ILE 55 23.132 27.118 3.805 429 HB ILE 55 HB ILE 55 23.192 29.575 2.050 430 HG12 ILE 55 HG12 ILE 55 25.534 27.754 2.603 431 HG13 ILE 55 HG13 ILE 55 24.283 27.216 1.481 432 HG21 ILE 55 HG21 ILE 55 24.913 29.103 4.526 433 HG22 ILE 55 HG22 ILE 55 25.165 30.379 3.316 434 HG23 ILE 55 HG23 ILE 55 23.715 30.403 4.302 435 HD11 ILE 55 HD11 ILE 55 26.157 28.292 0.331 436 HD12 ILE 55 HD12 ILE 55 24.643 29.181 0.079 437 HD13 ILE 55 HD13 ILE 55 25.862 29.802 1.212 438 HA PRO 56 HA PRO 56 20.112 28.968 6.561 439 HB2 PRO 56 HB2 PRO 56 21.518 29.031 8.921 440 HB3 PRO 56 HB3 PRO 56 20.830 27.538 8.209 441 HG2 PRO 56 HG2 PRO 56 23.672 28.575 7.975 442 HG3 PRO 56 HG3 PRO 56 23.131 26.919 8.396 443 HD2 PRO 56 HD2 PRO 56 23.887 27.575 5.877 444 HD3 PRO 56 HD3 PRO 56 22.523 26.454 6.156 445 H GLY 57 H GLY 57 19.545 31.050 7.007 446 HA2 GLY 57 HA2 GLY 57 19.763 33.284 7.586 447 HA3 GLY 57 HA3 GLY 57 21.519 33.166 7.509 448 H GLN 58 H GLN 58 20.439 31.894 4.594 449 HA GLN 58 HA GLN 58 20.026 34.520 3.266 450 HB2 GLN 58 HB2 GLN 58 21.710 34.200 1.663 451 HB3 GLN 58 HB3 GLN 58 22.451 33.817 3.216 452 HG2 GLN 58 HG2 GLN 58 22.304 31.456 2.788 453 HG3 GLN 58 HG3 GLN 58 21.408 31.712 1.289 454 HE21 GLN 58 HE21 GLN 58 22.648 31.402 -0.457 455 HE22 GLN 58 HE22 GLN 58 24.309 31.929 -0.635 456 HA PRO 59 HA PRO 59 16.929 32.338 0.959 457 HB2 PRO 59 HB2 PRO 59 16.829 33.618 -1.446 458 HB3 PRO 59 HB3 PRO 59 16.279 34.363 0.089 459 HG2 PRO 59 HG2 PRO 59 18.981 34.706 -1.266 460 HG3 PRO 59 HG3 PRO 59 17.876 35.975 -0.649 461 HD2 PRO 59 HD2 PRO 59 19.948 35.082 0.835 462 HD3 PRO 59 HD3 PRO 59 18.380 35.470 1.599 463 H VAL 60 H VAL 60 16.650 30.687 -0.456 464 HA VAL 60 HA VAL 60 18.696 29.116 -1.503 465 HB VAL 60 HB VAL 60 16.526 28.205 -1.158 466 HG11 VAL 60 HG11 VAL 60 15.061 30.114 -1.660 467 HG12 VAL 60 HG12 VAL 60 15.437 29.968 -3.391 468 HG13 VAL 60 HG13 VAL 60 14.556 28.682 -2.550 469 HG21 VAL 60 HG21 VAL 60 16.074 26.933 -3.166 470 HG22 VAL 60 HG22 VAL 60 16.946 28.099 -4.170 471 HG23 VAL 60 HG23 VAL 60 17.820 27.103 -2.993 472 H VAL 61 H VAL 61 19.715 28.826 -3.352 473 HA VAL 61 HA VAL 61 19.293 30.689 -5.677 474 HB VAL 61 HB VAL 61 21.890 29.479 -4.662 475 HG11 VAL 61 HG11 VAL 61 23.012 30.687 -6.480 476 HG12 VAL 61 HG12 VAL 61 21.933 29.452 -7.119 477 HG13 VAL 61 HG13 VAL 61 21.432 31.164 -7.153 478 HG21 VAL 61 HG21 VAL 61 22.624 31.819 -4.419 479 HG22 VAL 61 HG22 VAL 61 21.018 32.380 -4.939 480 HG23 VAL 61 HG23 VAL 61 21.212 31.492 -3.412 481 H GLU 62 H GLU 62 19.086 29.681 -7.722 482 HA GLU 62 HA GLU 62 19.371 26.716 -7.853 483 HB2 GLU 62 HB2 GLU 62 16.995 28.317 -8.898 484 HB3 GLU 62 HB3 GLU 62 17.268 26.583 -9.098 485 HG2 GLU 62 HG2 GLU 62 17.115 26.306 -6.620 486 HG3 GLU 62 HG3 GLU 62 16.776 28.031 -6.464 487 H VAL 63 H VAL 63 20.710 26.195 -9.533 488 HA VAL 63 HA VAL 63 21.366 28.165 -11.625 489 HB VAL 63 HB VAL 63 22.580 25.536 -10.736 490 HG11 VAL 63 HG11 VAL 63 24.635 26.305 -11.876 491 HG12 VAL 63 HG12 VAL 63 23.319 25.918 -12.988 492 HG13 VAL 63 HG13 VAL 63 23.678 27.625 -12.605 493 HG21 VAL 63 HG21 VAL 63 22.754 27.401 -8.988 494 HG22 VAL 63 HG22 VAL 63 24.226 26.660 -9.559 495 HG23 VAL 63 HG23 VAL 63 23.767 28.260 -10.173 496 H GLY 64 H GLY 64 21.498 27.433 -13.905 497 HA2 GLY 64 HA2 GLY 64 20.761 26.318 -15.760 498 HA3 GLY 64 HA3 GLY 64 20.415 24.923 -14.749 499 H THR 65 H THR 65 18.244 24.532 -14.147 500 HA THR 65 HA THR 65 16.317 26.609 -14.103 501 HB THR 65 HB THR 65 16.289 26.314 -16.563 502 HG1 THR 65 HG1 THR 65 14.082 26.364 -16.645 503 HG21 THR 65 HG21 THR 65 15.106 23.575 -15.956 504 HG22 THR 65 HG22 THR 65 16.544 23.968 -16.935 505 HG23 THR 65 HG23 THR 65 14.945 24.435 -17.503 506 H LYS 66 H LYS 66 14.204 25.895 -13.372 507 HA LYS 66 HA LYS 66 14.596 24.169 -11.193 508 HB2 LYS 66 HB2 LYS 66 13.143 26.244 -11.319 509 HB3 LYS 66 HB3 LYS 66 11.896 25.248 -12.088 510 HG2 LYS 66 HG2 LYS 66 11.918 23.745 -10.074 511 HG3 LYS 66 HG3 LYS 66 13.170 24.772 -9.354 512 HD2 LYS 66 HD2 LYS 66 11.501 26.729 -9.563 513 HD3 LYS 66 HD3 LYS 66 10.295 25.520 -10.025 514 HE2 LYS 66 HE2 LYS 66 9.944 25.785 -7.721 515 HE3 LYS 66 HE3 LYS 66 10.886 24.293 -7.837 516 HZ1 LYS 66 HZ1 LYS 66 11.958 26.987 -7.148 517 HZ2 LYS 66 HZ2 LYS 66 12.903 25.674 -7.306 518 HZ3 LYS 66 HZ3 LYS 66 11.778 25.737 -6.109 519 HA PRO 67 HA PRO 67 13.377 20.360 -13.195 520 HB2 PRO 67 HB2 PRO 67 13.713 18.617 -11.149 521 HB3 PRO 67 HB3 PRO 67 15.083 19.399 -12.000 522 HG2 PRO 67 HG2 PRO 67 13.832 20.182 -9.361 523 HG3 PRO 67 HG3 PRO 67 15.572 20.065 -9.809 524 HD2 PRO 67 HD2 PRO 67 14.194 22.441 -9.811 525 HD3 PRO 67 HD3 PRO 67 15.539 22.089 -10.938 526 H THR 68 H THR 68 11.726 19.009 -13.368 527 HA THR 68 HA THR 68 9.261 19.705 -12.329 528 HB THR 68 HB THR 68 9.775 18.974 -14.625 529 HG1 THR 68 HG1 THR 68 7.640 17.670 -13.313 530 HG21 THR 68 HG21 THR 68 9.478 16.117 -13.647 531 HG22 THR 68 HG22 THR 68 11.055 16.869 -14.008 532 HG23 THR 68 HG23 THR 68 9.834 16.689 -15.284 533 H GLY 69 H GLY 69 11.239 17.136 -11.192 534 HA2 GLY 69 HA2 GLY 69 10.623 16.240 -8.872 535 HA3 GLY 69 HA3 GLY 69 9.012 15.955 -9.548 536 H ASP 70 H ASP 70 10.037 15.155 -12.111 537 HA ASP 70 HA ASP 70 10.924 12.363 -11.614 538 HB2 ASP 70 HB2 ASP 70 10.072 13.746 -14.165 539 HB3 ASP 70 HB3 ASP 70 10.705 12.098 -14.089 540 H VAL 71 H VAL 71 12.823 13.506 -10.573 541 HA VAL 71 HA VAL 71 15.102 13.651 -12.346 542 HB VAL 71 HB VAL 71 15.954 15.670 -11.260 543 HG11 VAL 71 HG11 VAL 71 14.476 15.722 -13.411 544 HG12 VAL 71 HG12 VAL 71 13.266 16.554 -12.403 545 HG13 VAL 71 HG13 VAL 71 14.892 17.218 -12.612 546 HG21 VAL 71 HG21 VAL 71 13.230 16.063 -9.983 547 HG22 VAL 71 HG22 VAL 71 14.690 15.539 -9.123 548 HG23 VAL 71 HG23 VAL 71 14.660 17.119 -9.867 549 H LEU 72 H LEU 72 17.065 13.319 -11.284 550 HA LEU 72 HA LEU 72 17.058 11.673 -8.812 551 HB2 LEU 72 HB2 LEU 72 19.249 12.681 -10.677 552 HB3 LEU 72 HB3 LEU 72 19.537 11.586 -9.331 553 HG LEU 72 HG LEU 72 17.548 10.889 -11.477 554 HD11 LEU 72 HD11 LEU 72 20.539 10.379 -11.650 555 HD12 LEU 72 HD12 LEU 72 19.583 11.456 -12.702 556 HD13 LEU 72 HD13 LEU 72 19.289 9.715 -12.739 557 HD21 LEU 72 HD21 LEU 72 18.185 8.579 -10.855 558 HD22 LEU 72 HD22 LEU 72 17.689 9.498 -9.416 559 HD23 LEU 72 HD23 LEU 72 19.415 9.228 -9.742 560 H GLN 73 H GLN 73 17.950 12.461 -6.727 561 HA GLN 73 HA GLN 73 18.755 15.338 -6.700 562 HB2 GLN 73 HB2 GLN 73 17.106 13.624 -4.808 563 HB3 GLN 73 HB3 GLN 73 17.740 15.226 -4.450 564 HG2 GLN 73 HG2 GLN 73 16.510 16.051 -6.544 565 HG3 GLN 73 HG3 GLN 73 15.666 14.504 -6.554 566 HE21 GLN 73 HE21 GLN 73 14.972 17.524 -5.868 567 HE22 GLN 73 HE22 GLN 73 14.093 17.353 -4.339 568 H GLY 74 H GLY 74 20.894 15.419 -6.353 569 HA2 GLY 74 HA2 GLY 74 22.325 13.444 -4.623 570 HA3 GLY 74 HA3 GLY 74 23.056 14.637 -5.717 571 H ARG 75 H ARG 75 23.509 14.390 -2.783 572 HA ARG 75 HA ARG 75 22.689 17.092 -1.912 573 HB2 ARG 75 HB2 ARG 75 20.814 15.405 -1.339 574 HB3 ARG 75 HB3 ARG 75 21.958 14.688 -0.203 575 HG2 ARG 75 HG2 ARG 75 22.159 17.128 0.768 576 HG3 ARG 75 HG3 ARG 75 20.709 17.468 -0.175 577 HD2 ARG 75 HD2 ARG 75 19.537 15.621 0.995 578 HD3 ARG 75 HD3 ARG 75 20.985 15.274 1.945 579 HE ARG 75 HE ARG 75 19.005 17.280 2.456 580 HH11 ARG 75 HH12 ARG 75 22.469 16.839 2.933 581 HH12 ARG 75 HH11 ARG 75 22.555 18.156 4.069 582 HH21 ARG 75 HH21 ARG 75 19.193 18.830 4.019 583 HH22 ARG 75 HH22 ARG 75 20.780 19.347 4.516 584 H ALA 76 H ALA 76 23.983 17.983 -0.428 585 HA ALA 76 HA ALA 76 25.922 16.374 1.164 586 HB1 ALA 76 HB1 ALA 76 27.036 16.702 -0.992 587 HB2 ALA 76 HB2 ALA 76 26.737 18.451 -0.913 588 HB3 ALA 76 HB3 ALA 76 27.846 17.670 0.252 589 H THR 77 H THR 77 27.241 17.723 2.636 590 HA THR 77 HA THR 77 26.186 20.430 3.282 591 HB THR 77 HB THR 77 26.368 18.065 5.154 592 HG1 THR 77 HG1 THR 77 24.609 20.258 4.972 593 HG21 THR 77 HG21 THR 77 26.084 19.685 7.068 594 HG22 THR 77 HG22 THR 77 26.628 20.988 5.983 595 HG23 THR 77 HG23 THR 77 27.711 19.644 6.381 596 H GLY 78 H GLY 78 27.765 21.842 3.366 597 HA2 GLY 78 HA2 GLY 78 30.570 21.109 3.207 598 HA3 GLY 78 HA3 GLY 78 29.856 22.719 3.201 599 H GLU 79 H GLU 79 31.867 22.847 4.370 600 HA GLU 79 HA GLU 79 32.295 22.115 7.082 601 HB2 GLU 79 HB2 GLU 79 33.446 24.378 5.385 602 HB3 GLU 79 HB3 GLU 79 33.894 24.110 7.073 603 HG2 GLU 79 HG2 GLU 79 34.607 21.793 6.532 604 HG3 GLU 79 HG3 GLU 79 34.243 22.078 4.833 605 H GLU 80 H GLU 80 31.146 25.424 5.817 606 HA GLU 80 HA GLU 80 30.572 26.283 8.341 607 HB2 GLU 80 HB2 GLU 80 29.192 27.100 5.771 608 HB3 GLU 80 HB3 GLU 80 29.412 28.102 7.207 609 HG2 GLU 80 HG2 GLU 80 31.613 27.114 5.329 610 HG3 GLU 80 HG3 GLU 80 30.959 28.709 5.532 611 H GLY 81 H GLY 81 28.864 23.786 7.255 612 HA2 GLY 81 HA2 GLY 81 27.229 22.685 8.356 613 HA3 GLY 81 HA3 GLY 81 26.779 24.159 9.228 614 H GLU 82 H GLU 82 26.979 24.152 5.719 615 HA GLU 82 HA GLU 82 24.148 24.851 5.510 616 HB2 GLU 82 HB2 GLU 82 24.838 25.729 3.361 617 HB3 GLU 82 HB3 GLU 82 25.844 26.315 4.679 618 HG2 GLU 82 HG2 GLU 82 27.340 25.949 2.934 619 HG3 GLU 82 HG3 GLU 82 27.598 24.575 3.997 620 H THR 83 H THR 83 23.692 24.200 2.799 621 HA THR 83 HA THR 83 23.924 21.301 2.537 622 HB THR 83 HB THR 83 21.300 22.696 3.028 623 HG1 THR 83 HG1 THR 83 22.620 21.457 4.558 624 HG21 THR 83 HG21 THR 83 20.892 21.544 0.901 625 HG22 THR 83 HG22 THR 83 20.112 20.694 2.222 626 HG23 THR 83 HG23 THR 83 21.637 20.058 1.543 627 H VAL 84 H VAL 84 24.322 20.777 0.565 628 HA VAL 84 HA VAL 84 23.613 22.544 -1.743 629 HB VAL 84 HB VAL 84 25.801 20.455 -1.408 630 HG11 VAL 84 HG11 VAL 84 24.915 20.201 -3.692 631 HG12 VAL 84 HG12 VAL 84 25.035 21.963 -3.948 632 HG13 VAL 84 HG13 VAL 84 26.489 20.964 -3.709 633 HG21 VAL 84 HG21 VAL 84 25.860 23.435 -1.991 634 HG22 VAL 84 HG22 VAL 84 26.395 22.631 -0.503 635 HG23 VAL 84 HG23 VAL 84 27.275 22.378 -2.018 636 H LEU 85 H LEU 85 22.425 21.706 -3.358 637 HA LEU 85 HA LEU 85 21.771 18.823 -3.354 638 HB2 LEU 85 HB2 LEU 85 19.871 20.203 -2.375 639 HB3 LEU 85 HB3 LEU 85 19.766 21.020 -3.922 640 HG LEU 85 HG LEU 85 19.496 18.555 -4.896 641 HD11 LEU 85 HD11 LEU 85 18.435 16.994 -3.418 642 HD12 LEU 85 HD12 LEU 85 18.421 18.153 -2.067 643 HD13 LEU 85 HD13 LEU 85 19.948 17.467 -2.633 644 HD21 LEU 85 HD21 LEU 85 17.266 19.877 -3.312 645 HD22 LEU 85 HD22 LEU 85 17.089 18.679 -4.621 646 HD23 LEU 85 HD23 LEU 85 17.759 20.281 -4.970 647 H VAL 86 H VAL 86 21.769 17.945 -5.300 648 HA VAL 86 HA VAL 86 22.211 19.619 -7.778 649 HB VAL 86 HB VAL 86 23.454 16.880 -7.292 650 HG11 VAL 86 HG11 VAL 86 24.685 17.391 -9.376 651 HG12 VAL 86 HG12 VAL 86 22.949 17.253 -9.657 652 HG13 VAL 86 HG13 VAL 86 23.705 18.863 -9.586 653 HG21 VAL 86 HG21 VAL 86 24.747 19.646 -7.356 654 HG22 VAL 86 HG22 VAL 86 24.593 18.589 -5.933 655 HG23 VAL 86 HG23 VAL 86 25.612 18.090 -7.290 656 H GLU 87 H GLU 87 20.932 19.062 -9.587 657 HA GLU 87 HA GLU 87 19.119 16.772 -9.193 658 HB2 GLU 87 HB2 GLU 87 18.091 19.555 -9.766 659 HB3 GLU 87 HB3 GLU 87 17.146 18.057 -9.767 660 HG2 GLU 87 HG2 GLU 87 17.909 17.699 -7.355 661 HG3 GLU 87 HG3 GLU 87 18.585 19.326 -7.394 662 H GLU 88 H GLU 88 18.805 15.631 -10.799 663 HA GLU 88 HA GLU 88 19.740 16.418 -13.551 664 HB2 GLU 88 HB2 GLU 88 20.391 14.132 -11.734 665 HB3 GLU 88 HB3 GLU 88 20.416 13.831 -13.475 666 HG2 GLU 88 HG2 GLU 88 22.030 16.040 -12.194 667 HG3 GLU 88 HG3 GLU 88 22.575 14.354 -12.272 668 HA PRO 89 HA PRO 89 15.858 14.731 -15.034 669 HB2 PRO 89 HB2 PRO 89 16.556 13.928 -17.586 670 HB3 PRO 89 HB3 PRO 89 16.274 15.627 -17.099 671 HG2 PRO 89 HG2 PRO 89 18.943 14.168 -17.259 672 HG3 PRO 89 HG3 PRO 89 18.506 15.766 -17.959 673 HD2 PRO 89 HD2 PRO 89 19.794 15.564 -15.617 674 HD3 PRO 89 HD3 PRO 89 18.477 16.766 -15.794 675 H ARG 90 H ARG 90 14.921 12.865 -14.628 676 HA ARG 90 HA ARG 90 16.447 10.382 -14.256 677 HB2 ARG 90 HB2 ARG 90 14.759 11.182 -12.606 678 HB3 ARG 90 HB3 ARG 90 13.488 10.925 -13.803 679 HG2 ARG 90 HG2 ARG 90 14.058 8.494 -13.884 680 HG3 ARG 90 HG3 ARG 90 15.321 8.778 -12.674 681 HD2 ARG 90 HD2 ARG 90 13.425 7.989 -11.458 682 HD3 ARG 90 HD3 ARG 90 13.561 9.723 -11.154 683 HE ARG 90 HE ARG 90 11.484 10.045 -12.088 684 HH11 ARG 90 HH11 ARG 90 12.496 6.858 -13.137 685 HH12 ARG 90 HH12 ARG 90 10.948 6.517 -13.859 686 HH21 ARG 90 HH21 ARG 90 9.541 9.561 -13.040 687 HH22 ARG 90 HH22 ARG 90 9.334 8.002 -13.795 Start of MODEL 12 1 H1 GLY 1 H1 GLY 1 2.618 -9.906 -7.745 2 H2 GLY 1 H2 GLY 1 4.212 -10.287 -7.734 3 H3 GLY 1 H3 GLY 1 3.516 -9.710 -9.099 4 HA2 GLY 1 HA2 GLY 1 4.836 -7.982 -8.080 5 HA3 GLY 1 HA3 GLY 1 3.111 -7.570 -8.086 6 H SER 2 H SER 2 3.052 -6.289 -6.296 7 HA SER 2 HA SER 2 3.099 -5.582 -4.126 8 HB2 SER 2 HB2 SER 2 2.418 -8.482 -3.545 9 HB3 SER 2 HB3 SER 2 2.146 -7.103 -2.466 10 HG SER 2 HG SER 2 0.705 -6.245 -3.968 11 H GLU 3 H GLU 3 5.453 -5.268 -4.540 12 HA GLU 3 HA GLU 3 7.077 -6.556 -2.422 13 HB2 GLU 3 HB2 GLU 3 8.961 -6.928 -3.896 14 HB3 GLU 3 HB3 GLU 3 7.556 -7.855 -4.416 15 HG2 GLU 3 HG2 GLU 3 7.107 -6.073 -6.168 16 HG3 GLU 3 HG3 GLU 3 8.626 -5.303 -5.697 17 H THR 4 H THR 4 8.569 -5.255 -1.437 18 HA THR 4 HA THR 4 8.125 -2.556 -1.327 19 HB THR 4 HB THR 4 10.730 -3.922 -0.552 20 HG1 THR 4 HG1 THR 4 9.650 -4.397 1.369 21 HG21 THR 4 HG21 THR 4 10.798 -1.505 -0.133 22 HG22 THR 4 HG22 THR 4 10.626 -2.362 1.398 23 HG23 THR 4 HG23 THR 4 9.210 -1.571 0.670 24 H ARG 5 H ARG 5 8.963 -0.663 -2.140 25 HA ARG 5 HA ARG 5 10.194 -0.212 -4.468 26 HB2 ARG 5 HB2 ARG 5 9.103 1.367 -2.895 27 HB3 ARG 5 HB3 ARG 5 10.508 1.299 -1.833 28 HG2 ARG 5 HG2 ARG 5 11.884 2.432 -3.536 29 HG3 ARG 5 HG3 ARG 5 10.512 2.409 -4.676 30 HD2 ARG 5 HD2 ARG 5 9.180 3.761 -3.093 31 HD3 ARG 5 HD3 ARG 5 10.530 3.755 -1.939 32 HE ARG 5 HE ARG 5 11.476 4.798 -4.416 33 HH11 ARG 5 HH12 ARG 5 9.283 5.776 -1.866 34 HH12 ARG 5 HH11 ARG 5 9.544 7.476 -2.151 35 HH21 ARG 5 HH21 ARG 5 11.786 7.004 -4.721 36 HH22 ARG 5 HH22 ARG 5 10.924 8.142 -3.732 37 H THR 6 H THR 6 12.170 0.508 -5.176 38 HA THR 6 HA THR 6 14.629 0.017 -3.662 39 HB THR 6 HB THR 6 14.223 -2.182 -4.688 40 HG1 THR 6 HG1 THR 6 16.280 -2.344 -5.534 41 HG21 THR 6 HG21 THR 6 14.651 -0.807 -7.379 42 HG22 THR 6 HG22 THR 6 13.109 -1.486 -6.810 43 HG23 THR 6 HG23 THR 6 14.496 -2.550 -7.080 44 H ILE 7 H ILE 7 16.444 1.089 -4.484 45 HA ILE 7 HA ILE 7 16.039 3.102 -6.645 46 HB ILE 7 HB ILE 7 17.085 3.702 -3.853 47 HG12 ILE 7 HG12 ILE 7 14.526 4.621 -5.253 48 HG13 ILE 7 HG13 ILE 7 14.617 3.486 -3.905 49 HG21 ILE 7 HG21 ILE 7 16.743 5.555 -6.262 50 HG22 ILE 7 HG22 ILE 7 17.281 6.037 -4.637 51 HG23 ILE 7 HG23 ILE 7 18.295 4.989 -5.598 52 HD11 ILE 7 HD11 ILE 7 15.240 6.443 -3.794 53 HD12 ILE 7 HD12 ILE 7 13.934 5.554 -2.999 54 HD13 ILE 7 HD13 ILE 7 15.613 5.288 -2.485 55 H SER 8 H SER 8 17.879 3.412 -7.910 56 HA SER 8 HA SER 8 19.871 1.436 -7.888 57 HB2 SER 8 HB2 SER 8 20.836 2.645 -9.755 58 HB3 SER 8 HB3 SER 8 19.074 2.629 -9.877 59 HG SER 8 HG SER 8 19.638 4.688 -10.268 60 H SER 9 H SER 9 22.255 1.893 -8.114 61 HA SER 9 HA SER 9 23.315 3.638 -5.954 62 HB2 SER 9 HB2 SER 9 24.238 0.807 -6.497 63 HB3 SER 9 HB3 SER 9 24.774 1.886 -5.215 64 HG SER 9 HG SER 9 22.627 1.800 -4.356 65 H THR 10 H THR 10 23.163 4.112 -8.844 66 HA THR 10 HA THR 10 26.021 4.219 -9.584 67 HB THR 10 HB THR 10 25.346 3.645 -11.933 68 HG1 THR 10 HG1 THR 10 23.431 2.380 -12.099 69 HG21 THR 10 HG21 THR 10 25.379 1.229 -11.632 70 HG22 THR 10 HG22 THR 10 24.857 1.391 -9.940 71 HG23 THR 10 HG23 THR 10 26.460 1.974 -10.442 72 H ALA 11 H ALA 11 22.978 5.067 -11.261 73 HA ALA 11 HA ALA 11 23.851 7.731 -11.871 74 HB1 ALA 11 HB1 ALA 11 21.062 6.496 -11.949 75 HB2 ALA 11 HB2 ALA 11 21.562 8.004 -12.744 76 HB3 ALA 11 HB3 ALA 11 22.269 6.460 -13.255 77 H GLN 12 H GLN 12 21.442 6.553 -9.430 78 HA GLN 12 HA GLN 12 21.108 9.177 -8.270 79 HB2 GLN 12 HB2 GLN 12 19.369 7.516 -8.176 80 HB3 GLN 12 HB3 GLN 12 20.399 6.404 -7.281 81 HG2 GLN 12 HG2 GLN 12 18.674 7.583 -5.893 82 HG3 GLN 12 HG3 GLN 12 20.322 7.733 -5.309 83 HE21 GLN 12 HE21 GLN 12 20.087 9.656 -4.148 84 HE22 GLN 12 HE22 GLN 12 19.652 11.174 -4.900 85 H GLU 13 H GLU 13 23.512 6.634 -7.690 86 HA GLU 13 HA GLU 13 24.551 7.862 -5.278 87 HB2 GLU 13 HB2 GLU 13 24.851 5.479 -5.850 88 HB3 GLU 13 HB3 GLU 13 25.839 5.908 -7.231 89 HG2 GLU 13 HG2 GLU 13 27.376 5.306 -5.576 90 HG3 GLU 13 HG3 GLU 13 27.432 7.061 -5.543 91 H ARG 14 H ARG 14 25.792 7.927 -8.616 92 HA ARG 14 HA ARG 14 27.863 9.690 -8.092 93 HB2 ARG 14 HB2 ARG 14 28.186 10.127 -10.401 94 HB3 ARG 14 HB3 ARG 14 27.874 8.424 -10.135 95 HG2 ARG 14 HG2 ARG 14 26.128 8.403 -11.537 96 HG3 ARG 14 HG3 ARG 14 25.388 9.839 -10.821 97 HD2 ARG 14 HD2 ARG 14 27.773 10.144 -12.639 98 HD3 ARG 14 HD3 ARG 14 26.185 9.836 -13.320 99 HE ARG 14 HE ARG 14 26.928 12.225 -11.652 100 HH11 ARG 14 HH12 ARG 14 24.407 10.727 -13.657 101 HH12 ARG 14 HH11 ARG 14 23.516 12.245 -13.666 102 HH21 ARG 14 HH21 ARG 14 25.805 14.072 -11.995 103 HH22 ARG 14 HH22 ARG 14 24.267 13.994 -12.856 104 H VAL 15 H VAL 15 24.563 10.677 -8.875 105 HA VAL 15 HA VAL 15 25.082 13.502 -8.996 106 HB VAL 15 HB VAL 15 22.765 13.916 -8.335 107 HG11 VAL 15 HG11 VAL 15 21.690 12.857 -10.286 108 HG12 VAL 15 HG12 VAL 15 23.249 13.602 -10.657 109 HG13 VAL 15 HG13 VAL 15 23.120 11.831 -10.513 110 HG21 VAL 15 HG21 VAL 15 22.452 10.915 -8.165 111 HG22 VAL 15 HG22 VAL 15 22.371 12.030 -6.784 112 HG23 VAL 15 HG23 VAL 15 21.155 12.118 -8.060 113 H ASP 16 H ASP 16 25.062 11.316 -6.258 114 HA ASP 16 HA ASP 16 24.791 13.519 -4.302 115 HB2 ASP 16 HB2 ASP 16 24.055 11.078 -3.966 116 HB3 ASP 16 HB3 ASP 16 25.774 10.705 -3.750 117 H LEU 17 H LEU 17 27.467 11.631 -5.686 118 HA LEU 17 HA LEU 17 29.530 12.562 -4.024 119 HB2 LEU 17 HB2 LEU 17 29.718 11.571 -6.873 120 HB3 LEU 17 HB3 LEU 17 31.021 11.753 -5.707 121 HG LEU 17 HG LEU 17 28.775 9.725 -5.737 122 HD11 LEU 17 HD11 LEU 17 30.685 8.207 -5.435 123 HD12 LEU 17 HD12 LEU 17 31.757 9.621 -5.233 124 HD13 LEU 17 HD13 LEU 17 30.975 9.308 -6.804 125 HD21 LEU 17 HD21 LEU 17 28.691 10.479 -3.399 126 HD22 LEU 17 HD22 LEU 17 30.465 10.390 -3.280 127 HD23 LEU 17 HD23 LEU 17 29.493 8.917 -3.492 128 H GLU 18 H GLU 18 28.407 13.753 -7.099 129 HA GLU 18 HA GLU 18 30.066 16.117 -7.204 130 HB2 GLU 18 HB2 GLU 18 28.529 16.889 -8.988 131 HB3 GLU 18 HB3 GLU 18 29.232 15.292 -9.216 132 HG2 GLU 18 HG2 GLU 18 26.995 14.410 -8.156 133 HG3 GLU 18 HG3 GLU 18 26.373 15.974 -8.533 134 H ALA 19 H ALA 19 26.836 15.522 -5.634 135 HA ALA 19 HA ALA 19 26.481 18.280 -4.900 136 HB1 ALA 19 HB1 ALA 19 24.768 16.438 -4.891 137 HB2 ALA 19 HB2 ALA 19 25.521 15.811 -3.413 138 HB3 ALA 19 HB3 ALA 19 24.811 17.435 -3.416 139 H VAL 20 H VAL 20 28.271 15.603 -3.319 140 HA VAL 20 HA VAL 20 29.180 17.180 -1.038 141 HB VAL 20 HB VAL 20 30.288 14.644 -2.285 142 HG11 VAL 20 HG11 VAL 20 32.106 15.705 -1.021 143 HG12 VAL 20 HG12 VAL 20 31.018 15.979 0.361 144 HG13 VAL 20 HG13 VAL 20 31.479 14.330 -0.115 145 HG21 VAL 20 HG21 VAL 20 28.648 15.100 0.251 146 HG22 VAL 20 HG22 VAL 20 28.011 14.437 -1.267 147 HG23 VAL 20 HG23 VAL 20 29.230 13.538 -0.363 148 H ARG 21 H ARG 21 30.725 16.466 -4.203 149 HA ARG 21 HA ARG 21 32.982 18.090 -3.874 150 HB2 ARG 21 HB2 ARG 21 32.562 16.544 -5.783 151 HB3 ARG 21 HB3 ARG 21 31.371 17.669 -6.429 152 HG2 ARG 21 HG2 ARG 21 33.546 17.796 -7.580 153 HG3 ARG 21 HG3 ARG 21 33.021 19.331 -6.897 154 HD2 ARG 21 HD2 ARG 21 35.441 18.958 -6.612 155 HD3 ARG 21 HD3 ARG 21 34.609 19.136 -5.061 156 HE ARG 21 HE ARG 21 34.832 16.348 -5.849 157 HH11 ARG 21 HH11 ARG 21 36.818 18.910 -4.522 158 HH12 ARG 21 HH12 ARG 21 37.855 17.797 -3.674 159 HH21 ARG 21 HH21 ARG 21 36.187 14.978 -4.735 160 HH22 ARG 21 HH22 ARG 21 37.510 15.623 -3.814 161 H LEU 22 H LEU 22 29.749 19.186 -5.010 162 HA LEU 22 HA LEU 22 30.517 21.965 -5.079 163 HB2 LEU 22 HB2 LEU 22 27.881 20.551 -5.325 164 HB3 LEU 22 HB3 LEU 22 27.948 22.274 -4.906 165 HG LEU 22 HG LEU 22 29.509 22.619 -6.899 166 HD11 LEU 22 HD11 LEU 22 30.079 20.255 -7.400 167 HD12 LEU 22 HD12 LEU 22 29.294 21.047 -8.771 168 HD13 LEU 22 HD13 LEU 22 28.367 19.926 -7.754 169 HD21 LEU 22 HD21 LEU 22 27.183 23.311 -6.775 170 HD22 LEU 22 HD22 LEU 22 26.660 21.727 -7.403 171 HD23 LEU 22 HD23 LEU 22 27.640 22.827 -8.421 172 H ALA 23 H ALA 23 29.099 20.020 -2.377 173 HA ALA 23 HA ALA 23 28.897 22.257 -0.620 174 HB1 ALA 23 HB1 ALA 23 28.065 19.970 -0.177 175 HB2 ALA 23 HB2 ALA 23 29.734 19.399 0.015 176 HB3 ALA 23 HB3 ALA 23 29.054 20.591 1.157 177 H SER 24 H SER 24 31.749 20.342 -1.557 178 HA SER 24 HA SER 24 33.650 21.911 -0.117 179 HB2 SER 24 HB2 SER 24 34.288 20.324 -2.617 180 HB3 SER 24 HB3 SER 24 35.348 20.774 -1.290 181 HG SER 24 HG SER 24 33.140 18.960 -1.175 182 H ILE 25 H ILE 25 32.538 22.296 -3.592 183 HA ILE 25 HA ILE 25 34.315 24.472 -4.085 184 HB ILE 25 HB ILE 25 31.612 24.273 -5.380 185 HG12 ILE 25 HG12 ILE 25 32.408 22.059 -5.760 186 HG13 ILE 25 HG13 ILE 25 32.642 22.958 -7.199 187 HG21 ILE 25 HG21 ILE 25 32.923 25.208 -7.320 188 HG22 ILE 25 HG22 ILE 25 32.848 26.272 -5.923 189 HG23 ILE 25 HG23 ILE 25 34.328 25.353 -6.256 190 HD11 ILE 25 HD11 ILE 25 35.064 23.096 -6.760 191 HD12 ILE 25 HD12 ILE 25 34.814 22.213 -5.217 192 HD13 ILE 25 HD13 ILE 25 34.458 21.420 -6.755 193 H VAL 26 H VAL 26 31.041 24.352 -2.682 194 HA VAL 26 HA VAL 26 30.562 27.184 -2.500 195 HB VAL 26 HB VAL 26 29.469 24.802 -0.987 196 HG11 VAL 26 HG11 VAL 26 28.774 27.725 -0.744 197 HG12 VAL 26 HG12 VAL 26 27.572 26.450 -0.403 198 HG13 VAL 26 HG13 VAL 26 29.081 26.549 0.512 199 HG21 VAL 26 HG21 VAL 26 27.497 25.085 -2.409 200 HG22 VAL 26 HG22 VAL 26 28.178 26.564 -3.134 201 HG23 VAL 26 HG23 VAL 26 28.883 24.983 -3.478 202 H ASP 27 H ASP 27 31.855 24.809 0.009 203 HA ASP 27 HA ASP 27 32.527 26.687 1.944 204 HB2 ASP 27 HB2 ASP 27 32.905 24.321 2.258 205 HB3 ASP 27 HB3 ASP 27 34.127 24.292 0.985 206 H SER 28 H SER 28 34.508 26.002 -0.992 207 HA SER 28 HA SER 28 36.572 27.879 -0.409 208 HB2 SER 28 HB2 SER 28 35.586 26.996 -3.149 209 HB3 SER 28 HB3 SER 28 37.096 27.853 -2.811 210 HG SER 28 HG SER 28 37.418 25.594 -2.935 211 H ARG 29 H ARG 29 33.377 28.407 -1.840 212 HA ARG 29 HA ARG 29 33.839 31.254 -2.387 213 HB2 ARG 29 HB2 ARG 29 32.262 29.806 -3.677 214 HB3 ARG 29 HB3 ARG 29 31.231 29.663 -2.263 215 HG2 ARG 29 HG2 ARG 29 30.301 31.293 -3.716 216 HG3 ARG 29 HG3 ARG 29 30.901 32.118 -2.274 217 HD2 ARG 29 HD2 ARG 29 32.820 32.967 -3.495 218 HD3 ARG 29 HD3 ARG 29 32.434 31.926 -4.889 219 HE ARG 29 HE ARG 29 30.277 33.771 -4.136 220 HH11 ARG 29 HH11 ARG 29 33.240 33.639 -6.001 221 HH12 ARG 29 HH12 ARG 29 32.708 34.855 -7.126 222 HH21 ARG 29 HH21 ARG 29 29.563 35.207 -5.742 223 HH22 ARG 29 HH22 ARG 29 30.710 35.755 -6.930 224 H LEU 30 H LEU 30 32.285 29.403 0.316 225 HA LEU 30 HA LEU 30 31.465 31.811 1.666 226 HB2 LEU 30 HB2 LEU 30 32.070 29.109 2.890 227 HB3 LEU 30 HB3 LEU 30 31.188 30.446 3.639 228 HG LEU 30 HG LEU 30 30.302 28.784 1.269 229 HD11 LEU 30 HD11 LEU 30 29.092 29.151 4.035 230 HD12 LEU 30 HD12 LEU 30 30.039 27.734 3.531 231 HD13 LEU 30 HD13 LEU 30 28.489 28.089 2.752 232 HD21 LEU 30 HD21 LEU 30 29.496 31.050 0.818 233 HD22 LEU 30 HD22 LEU 30 28.887 31.187 2.490 234 HD23 LEU 30 HD23 LEU 30 28.169 30.039 1.344 235 H ILE 31 H ILE 31 34.539 30.026 1.746 236 HA ILE 31 HA ILE 31 35.845 31.826 3.635 237 HB ILE 31 HB ILE 31 36.879 29.838 1.575 238 HG12 ILE 31 HG12 ILE 31 36.812 29.668 4.627 239 HG13 ILE 31 HG13 ILE 31 35.560 28.988 3.602 240 HG21 ILE 31 HG21 ILE 31 39.091 30.014 2.713 241 HG22 ILE 31 HG22 ILE 31 38.644 31.522 1.949 242 HG23 ILE 31 HG23 ILE 31 38.465 31.344 3.709 243 HD11 ILE 31 HD11 ILE 31 38.467 28.102 3.639 244 HD12 ILE 31 HD12 ILE 31 37.055 27.225 4.231 245 HD13 ILE 31 HD13 ILE 31 37.232 27.521 2.492 246 H GLY 32 H GLY 32 35.433 31.763 0.099 247 HA2 GLY 32 HA2 GLY 32 37.417 33.664 -0.619 248 HA3 GLY 32 HA3 GLY 32 36.029 33.099 -1.578 249 H THR 33 H THR 33 33.931 33.964 -0.013 250 HA THR 33 HA THR 33 34.179 36.866 0.342 251 HB THR 33 HB THR 33 33.898 36.620 -2.103 252 HG1 THR 33 HG1 THR 33 32.254 38.112 -2.276 253 HG21 THR 33 HG21 THR 33 32.391 34.564 -1.976 254 HG22 THR 33 HG22 THR 33 31.898 35.835 -3.115 255 HG23 THR 33 HG23 THR 33 31.061 35.671 -1.560 256 H GLY 34 H GLY 34 32.178 33.942 0.618 257 HA2 GLY 34 HA2 GLY 34 30.930 33.543 2.616 258 HA3 GLY 34 HA3 GLY 34 30.709 35.260 2.877 259 H SER 35 H SER 35 30.049 34.469 -0.330 260 HA SER 35 HA SER 35 27.194 33.839 0.043 261 HB2 SER 35 HB2 SER 35 28.209 36.279 -1.467 262 HB3 SER 35 HB3 SER 35 26.553 35.645 -1.546 263 HG SER 35 HG SER 35 26.799 37.349 -0.010 264 H VAL 36 H VAL 36 26.346 32.714 -1.631 265 HA VAL 36 HA VAL 36 28.156 31.930 -3.912 266 HB VAL 36 HB VAL 36 25.905 30.333 -2.631 267 HG11 VAL 36 HG11 VAL 36 25.736 29.986 -5.020 268 HG12 VAL 36 HG12 VAL 36 27.502 29.835 -5.168 269 HG13 VAL 36 HG13 VAL 36 26.560 28.588 -4.326 270 HG21 VAL 36 HG21 VAL 36 28.118 30.151 -1.469 271 HG22 VAL 36 HG22 VAL 36 27.570 28.655 -2.245 272 HG23 VAL 36 HG23 VAL 36 28.843 29.623 -3.012 273 H ASP 37 H ASP 37 27.378 32.475 -5.954 274 HA ASP 37 HA ASP 37 24.566 33.343 -6.201 275 HB2 ASP 37 HB2 ASP 37 26.891 34.376 -7.834 276 HB3 ASP 37 HB3 ASP 37 25.274 35.046 -7.682 277 H GLU 38 H GLU 38 23.548 32.801 -8.209 278 HA GLU 38 HA GLU 38 24.002 30.325 -9.274 279 HB2 GLU 38 HB2 GLU 38 22.076 32.132 -9.642 280 HB3 GLU 38 HB3 GLU 38 22.972 32.495 -11.121 281 HG2 GLU 38 HG2 GLU 38 22.854 29.913 -11.555 282 HG3 GLU 38 HG3 GLU 38 21.658 29.901 -10.261 283 H ASP 39 H ASP 39 25.462 33.325 -10.533 284 HA ASP 39 HA ASP 39 26.751 32.228 -12.804 285 HB2 ASP 39 HB2 ASP 39 26.230 34.629 -12.381 286 HB3 ASP 39 HB3 ASP 39 27.414 34.648 -11.072 287 H PHE 40 H PHE 40 27.627 32.003 -9.408 288 HA PHE 40 HA PHE 40 30.424 31.270 -9.990 289 HB2 PHE 40 HB2 PHE 40 29.905 32.417 -7.900 290 HB3 PHE 40 HB3 PHE 40 28.752 31.163 -7.453 291 HD1 PHE 40 HD2 PHE 40 32.380 31.673 -8.271 292 HD2 PHE 40 HD1 PHE 40 29.440 29.267 -6.223 293 HE1 PHE 40 HE2 PHE 40 34.196 30.322 -7.245 294 HE2 PHE 40 HE1 PHE 40 31.252 27.913 -5.214 295 HZ PHE 40 HZ PHE 40 33.636 28.448 -5.715 296 H LEU 41 H LEU 41 27.296 29.556 -9.312 297 HA LEU 41 HA LEU 41 28.692 26.978 -9.240 298 HB2 LEU 41 HB2 LEU 41 25.826 27.922 -8.911 299 HB3 LEU 41 HB3 LEU 41 26.216 26.211 -8.942 300 HG LEU 41 HG LEU 41 27.072 28.270 -6.888 301 HD11 LEU 41 HD11 LEU 41 25.461 25.676 -6.767 302 HD12 LEU 41 HD12 LEU 41 24.811 27.330 -6.656 303 HD13 LEU 41 HD13 LEU 41 25.859 26.691 -5.374 304 HD21 LEU 41 HD21 LEU 41 28.049 25.404 -7.191 305 HD22 LEU 41 HD22 LEU 41 28.161 26.332 -5.677 306 HD23 LEU 41 HD23 LEU 41 29.036 26.880 -7.103 307 H ARG 42 H ARG 42 26.616 28.589 -11.638 308 HA ARG 42 HA ARG 42 26.145 26.410 -13.332 309 HB2 ARG 42 HB2 ARG 42 25.924 28.013 -15.155 310 HB3 ARG 42 HB3 ARG 42 25.241 28.678 -13.671 311 HG2 ARG 42 HG2 ARG 42 27.289 30.035 -13.315 312 HG3 ARG 42 HG3 ARG 42 27.995 29.360 -14.796 313 HD2 ARG 42 HD2 ARG 42 25.988 30.263 -16.076 314 HD3 ARG 42 HD3 ARG 42 25.527 31.115 -14.603 315 HE ARG 42 HE ARG 42 27.335 32.613 -14.875 316 HH11 ARG 42 HH21 ARG 42 27.711 30.135 -17.362 317 HH12 ARG 42 HH22 ARG 42 28.977 31.048 -18.135 318 HH21 ARG 42 HH12 ARG 42 28.827 33.613 -15.806 319 HH22 ARG 42 HH11 ARG 42 29.623 33.037 -17.277 320 H GLU 43 H GLU 43 29.256 28.036 -13.001 321 HA GLU 43 HA GLU 43 30.481 26.457 -15.160 322 HB2 GLU 43 HB2 GLU 43 32.528 27.712 -14.551 323 HB3 GLU 43 HB3 GLU 43 31.156 28.738 -14.977 324 HG2 GLU 43 HG2 GLU 43 30.779 29.366 -12.702 325 HG3 GLU 43 HG3 GLU 43 31.825 28.074 -12.108 326 H GLN 44 H GLN 44 29.602 25.386 -12.104 327 HA GLN 44 HA GLN 44 32.116 23.836 -11.684 328 HB2 GLN 44 HB2 GLN 44 30.048 24.828 -9.675 329 HB3 GLN 44 HB3 GLN 44 31.506 23.917 -9.295 330 HG2 GLN 44 HG2 GLN 44 31.421 26.691 -10.519 331 HG3 GLN 44 HG3 GLN 44 31.738 26.360 -8.837 332 HE21 GLN 44 HE21 GLN 44 33.466 27.696 -10.979 333 HE22 GLN 44 HE22 GLN 44 34.948 26.759 -10.916 334 H ILE 45 H ILE 45 28.776 23.576 -12.450 335 HA ILE 45 HA ILE 45 27.936 21.345 -10.970 336 HB ILE 45 HB ILE 45 26.573 20.894 -13.208 337 HG12 ILE 45 HG12 ILE 45 26.779 23.843 -13.631 338 HG13 ILE 45 HG13 ILE 45 27.992 22.812 -14.436 339 HG21 ILE 45 HG21 ILE 45 26.201 23.253 -11.353 340 HG22 ILE 45 HG22 ILE 45 24.921 22.509 -12.355 341 HG23 ILE 45 HG23 ILE 45 25.704 21.553 -11.085 342 HD11 ILE 45 HD11 ILE 45 26.125 23.163 -15.940 343 HD12 ILE 45 HD12 ILE 45 26.148 21.459 -15.432 344 HD13 ILE 45 HD13 ILE 45 24.970 22.588 -14.723 345 H ARG 46 H ARG 46 29.233 21.106 -14.382 346 HA ARG 46 HA ARG 46 30.372 19.871 -15.407 347 HB2 ARG 46 HB2 ARG 46 32.143 18.558 -14.724 348 HB3 ARG 46 HB3 ARG 46 32.015 19.906 -13.621 349 HG2 ARG 46 HG2 ARG 46 32.691 17.973 -12.419 350 HG3 ARG 46 HG3 ARG 46 31.069 18.380 -11.877 351 HD2 ARG 46 HD2 ARG 46 30.125 16.580 -13.209 352 HD3 ARG 46 HD3 ARG 46 31.693 16.247 -13.972 353 HE ARG 46 HE ARG 46 32.439 15.761 -11.513 354 HH11 ARG 46 HH11 ARG 46 29.378 14.824 -12.894 355 HH12 ARG 46 HH12 ARG 46 28.962 13.798 -11.550 356 HH21 ARG 46 HH21 ARG 46 32.064 14.089 -10.051 357 HH22 ARG 46 HH22 ARG 46 30.615 13.136 -10.197 358 H ASP 47 H ASP 47 27.847 18.496 -13.771 359 HA ASP 47 HA ASP 47 27.099 17.142 -16.248 360 HB2 ASP 47 HB2 ASP 47 28.514 15.420 -14.969 361 HB3 ASP 47 HB3 ASP 47 27.264 15.423 -13.734 362 H ALA 48 H ALA 48 26.477 17.404 -12.879 363 HA ALA 48 HA ALA 48 23.810 17.217 -12.363 364 HB1 ALA 48 HB1 ALA 48 25.785 19.319 -11.386 365 HB2 ALA 48 HB2 ALA 48 24.141 19.203 -10.737 366 HB3 ALA 48 HB3 ALA 48 25.268 17.838 -10.572 367 H ARG 49 H ARG 49 22.077 17.836 -13.570 368 HA ARG 49 HA ARG 49 22.203 19.919 -15.490 369 HB2 ARG 49 HB2 ARG 49 20.602 17.863 -15.352 370 HB3 ARG 49 HB3 ARG 49 19.601 18.877 -14.308 371 HG2 ARG 49 HG2 ARG 49 18.689 19.065 -16.481 372 HG3 ARG 49 HG3 ARG 49 19.551 20.586 -16.212 373 HD2 ARG 49 HD2 ARG 49 21.461 19.747 -17.547 374 HD3 ARG 49 HD3 ARG 49 20.624 18.194 -17.764 375 HE ARG 49 HE ARG 49 18.922 20.305 -18.662 376 HH11 ARG 49 HH12 ARG 49 21.861 18.706 -19.700 377 HH12 ARG 49 HH11 ARG 49 21.578 19.066 -21.381 378 HH21 ARG 49 HH21 ARG 49 18.615 20.733 -20.827 379 HH22 ARG 49 HH22 ARG 49 19.781 20.189 -21.995 380 H TYR 50 H TYR 50 20.713 19.945 -12.267 381 HA TYR 50 HA TYR 50 20.770 22.927 -12.244 382 HB2 TYR 50 HB2 TYR 50 18.761 21.289 -10.700 383 HB3 TYR 50 HB3 TYR 50 18.639 22.951 -11.212 384 HD1 TYR 50 HD2 TYR 50 18.929 22.928 -14.103 385 HD2 TYR 50 HD1 TYR 50 17.014 20.042 -11.555 386 HE1 TYR 50 HE2 TYR 50 17.456 22.258 -15.983 387 HE2 TYR 50 HE1 TYR 50 15.564 19.331 -13.450 388 HH TYR 50 HH TYR 50 15.778 20.844 -16.675 389 H ALA 51 H ALA 51 22.151 23.706 -10.577 390 HA ALA 51 HA ALA 51 22.643 21.903 -8.236 391 HB1 ALA 51 HB1 ALA 51 24.719 22.550 -9.259 392 HB2 ALA 51 HB2 ALA 51 24.238 24.264 -9.304 393 HB3 ALA 51 HB3 ALA 51 24.529 23.450 -7.750 394 H VAL 52 H VAL 52 22.118 22.732 -6.118 395 HA VAL 52 HA VAL 52 20.441 25.201 -6.069 396 HB VAL 52 HB VAL 52 19.557 22.405 -5.293 397 HG11 VAL 52 HG11 VAL 52 18.738 23.883 -3.540 398 HG12 VAL 52 HG12 VAL 52 18.196 25.077 -4.742 399 HG13 VAL 52 HG13 VAL 52 17.398 23.496 -4.614 400 HG21 VAL 52 HG21 VAL 52 19.229 22.813 -7.653 401 HG22 VAL 52 HG22 VAL 52 17.670 22.880 -6.844 402 HG23 VAL 52 HG23 VAL 52 18.475 24.387 -7.323 403 H ILE 53 H ILE 53 20.438 26.277 -4.237 404 HA ILE 53 HA ILE 53 22.404 25.437 -2.156 405 HB ILE 53 HB ILE 53 21.860 27.906 -3.682 406 HG12 ILE 53 HG12 ILE 53 23.826 26.479 -4.058 407 HG13 ILE 53 HG13 ILE 53 24.237 28.148 -3.671 408 HG21 ILE 53 HG21 ILE 53 22.955 29.449 -2.065 409 HG22 ILE 53 HG22 ILE 53 21.327 28.973 -1.603 410 HG23 ILE 53 HG23 ILE 53 22.715 28.240 -0.785 411 HD11 ILE 53 HD11 ILE 53 24.687 27.411 -1.279 412 HD12 ILE 53 HD12 ILE 53 24.469 25.742 -1.808 413 HD13 ILE 53 HD13 ILE 53 25.774 26.724 -2.496 414 H ARG 54 H ARG 54 21.955 25.238 -0.137 415 HA ARG 54 HA ARG 54 19.801 26.884 1.148 416 HB2 ARG 54 HB2 ARG 54 20.520 23.978 1.667 417 HB3 ARG 54 HB3 ARG 54 19.398 24.942 2.631 418 HG2 ARG 54 HG2 ARG 54 19.003 24.194 -0.308 419 HG3 ARG 54 HG3 ARG 54 18.299 23.338 1.063 420 HD2 ARG 54 HD2 ARG 54 17.069 25.337 1.749 421 HD3 ARG 54 HD3 ARG 54 17.770 26.258 0.400 422 HE ARG 54 HE ARG 54 16.624 24.105 -0.863 423 HH11 ARG 54 HH11 ARG 54 15.275 26.486 1.333 424 HH12 ARG 54 HH12 ARG 54 13.688 26.373 0.626 425 HH21 ARG 54 HH21 ARG 54 14.570 24.015 -1.720 426 HH22 ARG 54 HH22 ARG 54 13.310 25.014 -1.064 427 H ILE 55 H ILE 55 21.634 28.308 1.430 428 HA ILE 55 HA ILE 55 23.556 27.554 3.591 429 HB ILE 55 HB ILE 55 23.455 30.034 1.836 430 HG12 ILE 55 HG12 ILE 55 25.822 28.162 2.055 431 HG13 ILE 55 HG13 ILE 55 24.479 27.691 1.016 432 HG21 ILE 55 HG21 ILE 55 24.204 30.714 4.059 433 HG22 ILE 55 HG22 ILE 55 25.318 29.328 4.162 434 HG23 ILE 55 HG23 ILE 55 25.620 30.632 3.013 435 HD11 ILE 55 HD11 ILE 55 26.274 28.849 -0.182 436 HD12 ILE 55 HD12 ILE 55 24.737 29.740 -0.294 437 HD13 ILE 55 HD13 ILE 55 26.019 30.307 0.795 438 HA PRO 56 HA PRO 56 20.460 29.503 6.248 439 HB2 PRO 56 HB2 PRO 56 21.839 29.607 8.616 440 HB3 PRO 56 HB3 PRO 56 21.122 28.110 7.947 441 HG2 PRO 56 HG2 PRO 56 23.996 29.060 7.714 442 HG3 PRO 56 HG3 PRO 56 23.400 27.436 8.186 443 HD2 PRO 56 HD2 PRO 56 24.200 27.980 5.657 444 HD3 PRO 56 HD3 PRO 56 22.798 26.908 5.963 445 H GLY 57 H GLY 57 19.950 31.604 6.509 446 HA2 GLY 57 HA2 GLY 57 20.169 33.836 7.048 447 HA3 GLY 57 HA3 GLY 57 21.915 33.658 7.189 448 H GLN 58 H GLN 58 21.037 32.450 4.126 449 HA GLN 58 HA GLN 58 20.876 35.122 2.880 450 HB2 GLN 58 HB2 GLN 58 22.711 34.874 1.446 451 HB3 GLN 58 HB3 GLN 58 23.255 34.350 3.036 452 HG2 GLN 58 HG2 GLN 58 23.046 32.033 2.377 453 HG3 GLN 58 HG3 GLN 58 22.535 32.492 0.738 454 HE21 GLN 58 HE21 GLN 58 25.192 33.387 3.064 455 HE22 GLN 58 HE22 GLN 58 26.452 33.412 1.858 456 HA PRO 59 HA PRO 59 17.877 33.643 0.152 457 HB2 PRO 59 HB2 PRO 59 19.474 34.626 -2.215 458 HB3 PRO 59 HB3 PRO 59 17.759 34.936 -1.802 459 HG2 PRO 59 HG2 PRO 59 19.641 36.824 -1.325 460 HG3 PRO 59 HG3 PRO 59 18.379 36.487 -0.093 461 HD2 PRO 59 HD2 PRO 59 21.244 35.481 -0.166 462 HD3 PRO 59 HD3 PRO 59 20.307 36.173 1.188 463 H VAL 60 H VAL 60 17.260 31.781 -0.789 464 HA VAL 60 HA VAL 60 19.000 29.684 -1.598 465 HB VAL 60 HB VAL 60 16.070 30.240 -2.236 466 HG11 VAL 60 HG11 VAL 60 17.623 27.661 -2.717 467 HG12 VAL 60 HG12 VAL 60 15.859 27.828 -2.776 468 HG13 VAL 60 HG13 VAL 60 16.854 28.686 -3.947 469 HG21 VAL 60 HG21 VAL 60 17.418 28.388 -0.227 470 HG22 VAL 60 HG22 VAL 60 16.549 29.886 0.159 471 HG23 VAL 60 HG23 VAL 60 15.664 28.513 -0.508 472 H VAL 61 H VAL 61 20.064 29.276 -3.375 473 HA VAL 61 HA VAL 61 19.481 30.766 -5.917 474 HB VAL 61 HB VAL 61 22.106 29.601 -4.925 475 HG11 VAL 61 HG11 VAL 61 23.123 30.468 -6.949 476 HG12 VAL 61 HG12 VAL 61 21.951 29.222 -7.350 477 HG13 VAL 61 HG13 VAL 61 21.523 30.938 -7.589 478 HG21 VAL 61 HG21 VAL 61 22.880 31.928 -5.061 479 HG22 VAL 61 HG22 VAL 61 21.250 32.456 -5.535 480 HG23 VAL 61 HG23 VAL 61 21.543 31.769 -3.921 481 H GLU 62 H GLU 62 19.115 29.618 -7.784 482 HA GLU 62 HA GLU 62 19.290 26.656 -7.720 483 HB2 GLU 62 HB2 GLU 62 16.862 28.272 -8.624 484 HB3 GLU 62 HB3 GLU 62 17.103 26.544 -8.902 485 HG2 GLU 62 HG2 GLU 62 17.092 26.134 -6.471 486 HG3 GLU 62 HG3 GLU 62 16.884 27.860 -6.163 487 H VAL 63 H VAL 63 20.717 26.199 -9.356 488 HA VAL 63 HA VAL 63 21.168 28.081 -11.557 489 HB VAL 63 HB VAL 63 22.479 25.448 -10.846 490 HG11 VAL 63 HG11 VAL 63 23.071 26.072 -13.113 491 HG12 VAL 63 HG12 VAL 63 23.458 27.731 -12.578 492 HG13 VAL 63 HG13 VAL 63 24.437 26.348 -12.037 493 HG21 VAL 63 HG21 VAL 63 24.218 26.615 -9.749 494 HG22 VAL 63 HG22 VAL 63 23.504 28.201 -10.094 495 HG23 VAL 63 HG23 VAL 63 22.734 27.077 -8.949 496 H GLY 64 H GLY 64 21.072 27.464 -13.802 497 HA2 GLY 64 HA2 GLY 64 20.426 26.221 -15.636 498 HA3 GLY 64 HA3 GLY 64 20.105 24.847 -14.580 499 H THR 65 H THR 65 17.986 24.578 -13.696 500 HA THR 65 HA THR 65 15.821 26.408 -14.404 501 HB THR 65 HB THR 65 15.484 23.594 -15.475 502 HG1 THR 65 HG1 THR 65 15.936 24.439 -17.547 503 HG21 THR 65 HG21 THR 65 13.858 24.730 -16.997 504 HG22 THR 65 HG22 THR 65 14.186 26.266 -16.163 505 HG23 THR 65 HG23 THR 65 13.430 24.904 -15.300 506 H LYS 66 H LYS 66 13.831 25.845 -13.233 507 HA LYS 66 HA LYS 66 14.157 24.235 -10.892 508 HB2 LYS 66 HB2 LYS 66 12.620 26.171 -11.007 509 HB3 LYS 66 HB3 LYS 66 11.636 25.337 -12.220 510 HG2 LYS 66 HG2 LYS 66 11.136 23.550 -10.538 511 HG3 LYS 66 HG3 LYS 66 12.063 24.459 -9.328 512 HD2 LYS 66 HD2 LYS 66 10.509 26.356 -9.544 513 HD3 LYS 66 HD3 LYS 66 9.591 25.506 -10.793 514 HE2 LYS 66 HE2 LYS 66 9.980 24.511 -7.928 515 HE3 LYS 66 HE3 LYS 66 8.580 25.431 -8.481 516 HZ1 LYS 66 HZ1 LYS 66 9.352 22.744 -9.515 517 HZ2 LYS 66 HZ2 LYS 66 8.078 23.629 -10.049 518 HZ3 LYS 66 HZ3 LYS 66 8.101 23.071 -8.518 519 HA PRO 67 HA PRO 67 13.234 20.291 -12.813 520 HB2 PRO 67 HB2 PRO 67 13.129 18.691 -10.617 521 HB3 PRO 67 HB3 PRO 67 14.659 19.425 -11.206 522 HG2 PRO 67 HG2 PRO 67 12.843 20.416 -8.991 523 HG3 PRO 67 HG3 PRO 67 14.626 20.208 -8.989 524 HD2 PRO 67 HD2 PRO 67 13.440 22.615 -9.489 525 HD3 PRO 67 HD3 PRO 67 14.972 22.123 -10.278 526 H THR 68 H THR 68 11.606 18.941 -13.193 527 HA THR 68 HA THR 68 8.957 19.700 -12.561 528 HB THR 68 HB THR 68 9.748 18.868 -14.737 529 HG1 THR 68 HG1 THR 68 7.877 17.719 -15.187 530 HG21 THR 68 HG21 THR 68 11.054 16.863 -13.889 531 HG22 THR 68 HG22 THR 68 9.958 16.528 -15.237 532 HG23 THR 68 HG23 THR 68 9.494 16.058 -13.593 533 H GLY 69 H GLY 69 10.883 17.197 -11.140 534 HA2 GLY 69 HA2 GLY 69 10.065 16.484 -8.827 535 HA3 GLY 69 HA3 GLY 69 8.541 16.074 -9.634 536 H ASP 70 H ASP 70 9.602 14.980 -11.992 537 HA ASP 70 HA ASP 70 10.564 12.339 -11.201 538 HB2 ASP 70 HB2 ASP 70 10.142 13.504 -13.955 539 HB3 ASP 70 HB3 ASP 70 10.373 11.794 -13.555 540 H VAL 71 H VAL 71 12.379 13.680 -10.133 541 HA VAL 71 HA VAL 71 14.775 13.730 -11.919 542 HB VAL 71 HB VAL 71 15.576 15.732 -10.751 543 HG11 VAL 71 HG11 VAL 71 12.850 16.365 -11.964 544 HG12 VAL 71 HG12 VAL 71 14.356 17.299 -12.027 545 HG13 VAL 71 HG13 VAL 71 14.224 15.804 -12.926 546 HG21 VAL 71 HG21 VAL 71 14.184 17.107 -9.369 547 HG22 VAL 71 HG22 VAL 71 12.793 16.023 -9.558 548 HG23 VAL 71 HG23 VAL 71 14.227 15.502 -8.645 549 H LEU 72 H LEU 72 16.805 13.756 -10.856 550 HA LEU 72 HA LEU 72 16.976 11.725 -8.659 551 HB2 LEU 72 HB2 LEU 72 18.919 12.648 -10.823 552 HB3 LEU 72 HB3 LEU 72 19.330 11.478 -9.572 553 HG LEU 72 HG LEU 72 17.038 11.117 -11.516 554 HD11 LEU 72 HD11 LEU 72 19.179 11.195 -12.756 555 HD12 LEU 72 HD12 LEU 72 18.536 9.547 -12.740 556 HD13 LEU 72 HD13 LEU 72 19.874 9.985 -11.652 557 HD21 LEU 72 HD21 LEU 72 16.762 9.781 -9.547 558 HD22 LEU 72 HD22 LEU 72 18.454 9.237 -9.614 559 HD23 LEU 72 HD23 LEU 72 17.289 8.708 -10.853 560 H GLN 73 H GLN 73 17.435 12.491 -6.679 561 HA GLN 73 HA GLN 73 18.570 15.213 -6.445 562 HB2 GLN 73 HB2 GLN 73 16.965 13.477 -4.559 563 HB3 GLN 73 HB3 GLN 73 17.643 15.058 -4.162 564 HG2 GLN 73 HG2 GLN 73 16.381 15.986 -6.183 565 HG3 GLN 73 HG3 GLN 73 15.512 14.455 -6.251 566 HE21 GLN 73 HE21 GLN 73 14.748 17.394 -5.507 567 HE22 GLN 73 HE22 GLN 73 13.929 17.196 -3.954 568 H GLY 74 H GLY 74 20.676 15.371 -6.137 569 HA2 GLY 74 HA2 GLY 74 22.185 13.468 -4.358 570 HA3 GLY 74 HA3 GLY 74 22.894 14.686 -5.438 571 H ARG 75 H ARG 75 23.310 14.515 -2.422 572 HA ARG 75 HA ARG 75 22.382 17.172 -1.656 573 HB2 ARG 75 HB2 ARG 75 20.287 15.770 -1.421 574 HB3 ARG 75 HB3 ARG 75 21.111 14.838 -0.173 575 HG2 ARG 75 HG2 ARG 75 21.409 16.951 1.160 576 HG3 ARG 75 HG3 ARG 75 20.557 17.850 -0.111 577 HD2 ARG 75 HD2 ARG 75 18.554 16.461 0.230 578 HD3 ARG 75 HD3 ARG 75 19.385 15.505 1.455 579 HE ARG 75 HE ARG 75 18.228 18.183 1.739 580 HH11 ARG 75 HH11 ARG 75 20.488 15.959 3.254 581 HH12 ARG 75 HH12 ARG 75 20.385 16.767 4.791 582 HH21 ARG 75 HH21 ARG 75 18.121 19.135 3.740 583 HH22 ARG 75 HH22 ARG 75 19.076 18.517 5.053 584 H ALA 76 H ALA 76 23.847 18.000 -0.426 585 HA ALA 76 HA ALA 76 25.459 16.333 1.489 586 HB1 ALA 76 HB1 ALA 76 27.449 17.516 0.591 587 HB2 ALA 76 HB2 ALA 76 26.596 16.598 -0.667 588 HB3 ALA 76 HB3 ALA 76 26.400 18.364 -0.576 589 H THR 77 H THR 77 26.946 17.704 2.818 590 HA THR 77 HA THR 77 25.624 20.159 3.881 591 HB THR 77 HB THR 77 26.876 17.990 5.600 592 HG1 THR 77 HG1 THR 77 24.776 17.752 6.367 593 HG21 THR 77 HG21 THR 77 26.036 19.346 7.500 594 HG22 THR 77 HG22 THR 77 25.471 20.599 6.375 595 HG23 THR 77 HG23 THR 77 27.206 20.269 6.556 596 H GLY 78 H GLY 78 27.039 21.773 4.168 597 HA2 GLY 78 HA2 GLY 78 29.840 21.374 3.180 598 HA3 GLY 78 HA3 GLY 78 28.983 22.880 3.231 599 H GLU 79 H GLU 79 31.313 23.283 4.143 600 HA GLU 79 HA GLU 79 31.858 22.247 6.811 601 HB2 GLU 79 HB2 GLU 79 33.482 22.158 5.004 602 HB3 GLU 79 HB3 GLU 79 33.361 23.890 4.766 603 HG2 GLU 79 HG2 GLU 79 35.415 23.311 5.868 604 HG3 GLU 79 HG3 GLU 79 34.412 24.336 6.886 605 H GLU 80 H GLU 80 30.359 25.231 5.672 606 HA GLU 80 HA GLU 80 31.074 26.606 8.248 607 HB2 GLU 80 HB2 GLU 80 29.633 27.639 5.802 608 HB3 GLU 80 HB3 GLU 80 30.003 28.572 7.244 609 HG2 GLU 80 HG2 GLU 80 32.167 27.363 5.448 610 HG3 GLU 80 HG3 GLU 80 31.463 28.940 5.291 611 H GLY 81 H GLY 81 29.065 24.298 7.288 612 HA2 GLY 81 HA2 GLY 81 27.270 23.391 8.368 613 HA3 GLY 81 HA3 GLY 81 26.891 24.922 9.143 614 H GLU 82 H GLU 82 27.367 25.017 5.661 615 HA GLU 82 HA GLU 82 24.594 25.619 5.140 616 HB2 GLU 82 HB2 GLU 82 25.361 26.271 3.036 617 HB3 GLU 82 HB3 GLU 82 26.575 26.835 4.180 618 HG2 GLU 82 HG2 GLU 82 26.936 24.272 2.567 619 HG3 GLU 82 HG3 GLU 82 27.251 25.856 1.896 620 H THR 83 H THR 83 23.867 24.626 2.799 621 HA THR 83 HA THR 83 24.234 21.703 2.769 622 HB THR 83 HB THR 83 21.609 23.083 3.381 623 HG1 THR 83 HG1 THR 83 23.347 22.094 4.849 624 HG21 THR 83 HG21 THR 83 20.497 20.892 3.176 625 HG22 THR 83 HG22 THR 83 21.972 20.187 2.481 626 HG23 THR 83 HG23 THR 83 21.071 21.449 1.602 627 H VAL 84 H VAL 84 23.870 20.829 0.912 628 HA VAL 84 HA VAL 84 23.419 22.592 -1.507 629 HB VAL 84 HB VAL 84 25.711 20.647 -1.056 630 HG11 VAL 84 HG11 VAL 84 26.454 21.195 -3.344 631 HG12 VAL 84 HG12 VAL 84 24.932 20.322 -3.380 632 HG13 VAL 84 HG13 VAL 84 24.944 22.088 -3.641 633 HG21 VAL 84 HG21 VAL 84 25.531 23.634 -1.636 634 HG22 VAL 84 HG22 VAL 84 26.141 22.865 -0.150 635 HG23 VAL 84 HG23 VAL 84 27.040 22.712 -1.671 636 H LEU 85 H LEU 85 22.311 21.745 -3.156 637 HA LEU 85 HA LEU 85 21.570 18.873 -3.092 638 HB2 LEU 85 HB2 LEU 85 19.742 20.203 -2.078 639 HB3 LEU 85 HB3 LEU 85 19.711 21.237 -3.486 640 HG LEU 85 HG LEU 85 19.122 19.046 -4.822 641 HD11 LEU 85 HD11 LEU 85 18.091 18.197 -2.088 642 HD12 LEU 85 HD12 LEU 85 19.576 17.548 -2.775 643 HD13 LEU 85 HD13 LEU 85 18.046 17.298 -3.629 644 HD21 LEU 85 HD21 LEU 85 17.547 20.850 -4.519 645 HD22 LEU 85 HD22 LEU 85 17.181 20.314 -2.860 646 HD23 LEU 85 HD23 LEU 85 16.734 19.299 -4.251 647 H VAL 86 H VAL 86 21.247 17.964 -5.116 648 HA VAL 86 HA VAL 86 21.937 19.514 -7.587 649 HB VAL 86 HB VAL 86 22.970 16.794 -6.682 650 HG11 VAL 86 HG11 VAL 86 22.839 17.938 -9.488 651 HG12 VAL 86 HG12 VAL 86 24.015 16.676 -8.995 652 HG13 VAL 86 HG13 VAL 86 22.288 16.359 -8.910 653 HG21 VAL 86 HG21 VAL 86 25.169 17.742 -7.190 654 HG22 VAL 86 HG22 VAL 86 24.416 19.278 -7.694 655 HG23 VAL 86 HG23 VAL 86 24.321 18.734 -5.998 656 H GLU 87 H GLU 87 20.483 19.135 -9.221 657 HA GLU 87 HA GLU 87 18.685 16.786 -8.980 658 HB2 GLU 87 HB2 GLU 87 17.671 19.611 -9.403 659 HB3 GLU 87 HB3 GLU 87 16.713 18.121 -9.414 660 HG2 GLU 87 HG2 GLU 87 17.567 17.713 -7.030 661 HG3 GLU 87 HG3 GLU 87 18.218 19.351 -7.062 662 H GLU 88 H GLU 88 18.205 15.824 -10.811 663 HA GLU 88 HA GLU 88 18.393 17.159 -13.407 664 HB2 GLU 88 HB2 GLU 88 19.949 15.518 -14.359 665 HB3 GLU 88 HB3 GLU 88 20.689 16.568 -13.163 666 HG2 GLU 88 HG2 GLU 88 20.660 14.734 -11.532 667 HG3 GLU 88 HG3 GLU 88 19.804 13.700 -12.702 668 HA PRO 89 HA PRO 89 15.048 14.569 -14.436 669 HB2 PRO 89 HB2 PRO 89 15.415 13.864 -17.093 670 HB3 PRO 89 HB3 PRO 89 14.815 15.441 -16.499 671 HG2 PRO 89 HG2 PRO 89 17.647 14.688 -17.270 672 HG3 PRO 89 HG3 PRO 89 16.723 16.156 -17.729 673 HD2 PRO 89 HD2 PRO 89 18.505 16.238 -15.729 674 HD3 PRO 89 HD3 PRO 89 16.943 17.075 -15.536 675 H ARG 90 H ARG 90 14.417 12.644 -14.123 676 HA ARG 90 HA ARG 90 16.268 10.379 -13.798 677 HB2 ARG 90 HB2 ARG 90 14.501 10.920 -12.112 678 HB3 ARG 90 HB3 ARG 90 13.266 10.493 -13.307 679 HG2 ARG 90 HG2 ARG 90 14.079 8.192 -13.410 680 HG3 ARG 90 HG3 ARG 90 15.465 8.594 -12.377 681 HD2 ARG 90 HD2 ARG 90 13.919 9.134 -10.518 682 HD3 ARG 90 HD3 ARG 90 12.537 8.715 -11.556 683 HE ARG 90 HE ARG 90 14.372 6.527 -11.501 684 HH11 ARG 90 HH11 ARG 90 12.057 8.046 -9.363 685 HH12 ARG 90 HH12 ARG 90 11.751 6.571 -8.488 686 HH21 ARG 90 HH22 ARG 90 13.960 4.685 -10.342 687 HH22 ARG 90 HH21 ARG 90 12.828 4.714 -9.022 Start of MODEL 13 1 H1 GLY 1 H1 GLY 1 6.268 -13.087 1.671 2 H2 GLY 1 H2 GLY 1 6.398 -14.426 0.736 3 H3 GLY 1 H3 GLY 1 4.928 -13.753 1.003 4 HA2 GLY 1 HA2 GLY 1 5.669 -13.219 -1.218 5 HA3 GLY 1 HA3 GLY 1 5.525 -11.768 -0.207 6 H SER 2 H SER 2 6.975 -11.017 -2.016 7 HA SER 2 HA SER 2 9.817 -11.804 -1.892 8 HB2 SER 2 HB2 SER 2 8.402 -9.690 -3.556 9 HB3 SER 2 HB3 SER 2 10.087 -10.210 -3.741 10 HG SER 2 HG SER 2 8.683 -11.279 -5.201 11 H GLU 3 H GLU 3 11.485 -10.081 -1.845 12 HA GLU 3 HA GLU 3 10.896 -7.824 0.026 13 HB2 GLU 3 HB2 GLU 3 13.165 -7.935 0.821 14 HB3 GLU 3 HB3 GLU 3 12.353 -9.475 1.098 15 HG2 GLU 3 HG2 GLU 3 13.512 -10.393 -0.959 16 HG3 GLU 3 HG3 GLU 3 14.396 -8.871 -1.089 17 H THR 4 H THR 4 11.646 -5.620 -0.702 18 HA THR 4 HA THR 4 11.991 -5.509 -3.534 19 HB THR 4 HB THR 4 11.862 -3.032 -2.980 20 HG1 THR 4 HG1 THR 4 11.183 -2.580 -0.858 21 HG21 THR 4 HG21 THR 4 9.643 -4.788 -1.847 22 HG22 THR 4 HG22 THR 4 9.874 -4.390 -3.562 23 HG23 THR 4 HG23 THR 4 9.494 -3.104 -2.403 24 H ARG 5 H ARG 5 13.424 -3.651 -4.312 25 HA ARG 5 HA ARG 5 16.241 -4.458 -3.616 26 HB2 ARG 5 HB2 ARG 5 15.224 -3.572 -6.332 27 HB3 ARG 5 HB3 ARG 5 16.776 -4.306 -5.946 28 HG2 ARG 5 HG2 ARG 5 14.047 -5.652 -5.954 29 HG3 ARG 5 HG3 ARG 5 15.399 -5.934 -7.048 30 HD2 ARG 5 HD2 ARG 5 16.737 -6.824 -5.135 31 HD3 ARG 5 HD3 ARG 5 15.322 -6.607 -4.079 32 HE ARG 5 HE ARG 5 14.469 -8.146 -6.278 33 HH11 ARG 5 HH22 ARG 5 16.651 -8.567 -3.570 34 HH12 ARG 5 HH21 ARG 5 16.430 -10.295 -3.532 35 HH21 ARG 5 HH12 ARG 5 14.209 -10.352 -6.169 36 HH22 ARG 5 HH11 ARG 5 15.063 -11.277 -4.971 37 H THR 6 H THR 6 14.319 -1.842 -3.272 38 HA THR 6 HA THR 6 14.414 0.390 -3.283 39 HB THR 6 HB THR 6 15.799 -0.207 -1.336 40 HG1 THR 6 HG1 THR 6 16.289 1.897 -0.976 41 HG21 THR 6 HG21 THR 6 18.167 0.610 -1.317 42 HG22 THR 6 HG22 THR 6 18.145 0.624 -3.092 43 HG23 THR 6 HG23 THR 6 17.938 -0.898 -2.194 44 H ILE 7 H ILE 7 16.104 2.477 -3.861 45 HA ILE 7 HA ILE 7 15.949 2.557 -6.707 46 HB ILE 7 HB ILE 7 17.283 4.437 -4.731 47 HG12 ILE 7 HG12 ILE 7 14.934 4.156 -4.151 48 HG13 ILE 7 HG13 ILE 7 15.230 5.755 -4.794 49 HG21 ILE 7 HG21 ILE 7 16.440 4.918 -7.624 50 HG22 ILE 7 HG22 ILE 7 16.845 6.202 -6.469 51 HG23 ILE 7 HG23 ILE 7 18.076 5.030 -6.931 52 HD11 ILE 7 HD11 ILE 7 14.206 5.086 -6.965 53 HD12 ILE 7 HD12 ILE 7 13.909 3.456 -6.310 54 HD13 ILE 7 HD13 ILE 7 13.104 4.862 -5.601 55 H SER 8 H SER 8 17.687 3.054 -8.173 56 HA SER 8 HA SER 8 19.773 1.021 -8.032 57 HB2 SER 8 HB2 SER 8 19.324 3.201 -10.103 58 HB3 SER 8 HB3 SER 8 20.427 1.818 -10.255 59 HG SER 8 HG SER 8 18.416 1.402 -11.251 60 H SER 9 H SER 9 21.285 1.494 -6.408 61 HA SER 9 HA SER 9 22.822 3.787 -6.151 62 HB2 SER 9 HB2 SER 9 24.423 2.260 -4.985 63 HB3 SER 9 HB3 SER 9 22.742 2.229 -4.421 64 HG SER 9 HG SER 9 23.681 0.118 -4.674 65 H THR 10 H THR 10 22.809 3.966 -8.606 66 HA THR 10 HA THR 10 25.557 3.950 -9.529 67 HB THR 10 HB THR 10 24.769 3.411 -11.869 68 HG1 THR 10 HG1 THR 10 22.935 2.049 -11.992 69 HG21 THR 10 HG21 THR 10 24.969 0.989 -11.655 70 HG22 THR 10 HG22 THR 10 24.536 1.071 -9.932 71 HG23 THR 10 HG23 THR 10 26.072 1.763 -10.504 72 H ALA 11 H ALA 11 22.297 4.631 -10.826 73 HA ALA 11 HA ALA 11 22.867 7.307 -11.641 74 HB1 ALA 11 HB1 ALA 11 20.447 7.378 -12.124 75 HB2 ALA 11 HB2 ALA 11 21.170 5.858 -12.683 76 HB3 ALA 11 HB3 ALA 11 20.204 5.886 -11.189 77 H GLN 12 H GLN 12 21.172 6.077 -8.688 78 HA GLN 12 HA GLN 12 20.937 8.831 -7.661 79 HB2 GLN 12 HB2 GLN 12 19.133 7.251 -7.367 80 HB3 GLN 12 HB3 GLN 12 20.183 6.157 -6.463 81 HG2 GLN 12 HG2 GLN 12 18.621 7.503 -5.039 82 HG3 GLN 12 HG3 GLN 12 20.315 7.662 -4.608 83 HE21 GLN 12 HE21 GLN 12 20.415 9.703 -3.720 84 HE22 GLN 12 HE22 GLN 12 19.850 11.154 -4.527 85 H GLU 13 H GLU 13 23.317 6.254 -7.384 86 HA GLU 13 HA GLU 13 24.628 7.350 -5.055 87 HB2 GLU 13 HB2 GLU 13 24.791 4.982 -5.934 88 HB3 GLU 13 HB3 GLU 13 25.790 5.593 -7.250 89 HG2 GLU 13 HG2 GLU 13 27.288 4.739 -5.635 90 HG3 GLU 13 HG3 GLU 13 27.399 6.485 -5.470 91 H ARG 14 H ARG 14 25.502 7.537 -8.462 92 HA ARG 14 HA ARG 14 27.682 9.154 -8.389 93 HB2 ARG 14 HB2 ARG 14 27.458 9.649 -10.707 94 HB3 ARG 14 HB3 ARG 14 26.942 8.001 -10.392 95 HG2 ARG 14 HG2 ARG 14 25.188 8.525 -11.673 96 HG3 ARG 14 HG3 ARG 14 24.530 9.240 -10.222 97 HD2 ARG 14 HD2 ARG 14 24.203 10.938 -11.778 98 HD3 ARG 14 HD3 ARG 14 25.715 11.447 -11.019 99 HE ARG 14 HE ARG 14 25.776 9.777 -13.497 100 HH11 ARG 14 HH12 ARG 14 26.604 12.996 -12.107 101 HH12 ARG 14 HH11 ARG 14 27.268 13.429 -13.682 102 HH21 ARG 14 HH21 ARG 14 26.792 10.618 -15.338 103 HH22 ARG 14 HH22 ARG 14 27.407 12.273 -15.237 104 H VAL 15 H VAL 15 24.421 10.307 -8.317 105 HA VAL 15 HA VAL 15 25.027 13.111 -8.425 106 HB VAL 15 HB VAL 15 22.808 13.618 -7.601 107 HG11 VAL 15 HG11 VAL 15 23.239 13.188 -10.005 108 HG12 VAL 15 HG12 VAL 15 22.754 11.495 -9.780 109 HG13 VAL 15 HG13 VAL 15 21.586 12.804 -9.514 110 HG21 VAL 15 HG21 VAL 15 21.137 11.899 -7.223 111 HG22 VAL 15 HG22 VAL 15 22.328 10.622 -7.516 112 HG23 VAL 15 HG23 VAL 15 22.466 11.658 -6.078 113 H ASP 16 H ASP 16 25.400 10.845 -5.813 114 HA ASP 16 HA ASP 16 25.230 12.885 -3.716 115 HB2 ASP 16 HB2 ASP 16 24.911 10.461 -3.293 116 HB3 ASP 16 HB3 ASP 16 26.606 10.173 -3.692 117 H LEU 17 H LEU 17 27.989 11.438 -5.505 118 HA LEU 17 HA LEU 17 30.020 12.681 -4.030 119 HB2 LEU 17 HB2 LEU 17 29.988 11.574 -6.881 120 HB3 LEU 17 HB3 LEU 17 31.432 12.127 -6.071 121 HG LEU 17 HG LEU 17 31.427 9.782 -5.999 122 HD11 LEU 17 HD11 LEU 17 30.642 10.690 -3.204 123 HD12 LEU 17 HD12 LEU 17 32.236 10.949 -3.954 124 HD13 LEU 17 HD13 LEU 17 31.655 9.304 -3.646 125 HD21 LEU 17 HD21 LEU 17 28.971 9.389 -6.238 126 HD22 LEU 17 HD22 LEU 17 28.791 9.729 -4.499 127 HD23 LEU 17 HD23 LEU 17 29.767 8.361 -5.039 128 H GLU 18 H GLU 18 28.569 13.675 -7.049 129 HA GLU 18 HA GLU 18 29.990 16.131 -7.437 130 HB2 GLU 18 HB2 GLU 18 28.128 16.726 -8.974 131 HB3 GLU 18 HB3 GLU 18 28.846 15.139 -9.259 132 HG2 GLU 18 HG2 GLU 18 26.926 14.158 -7.866 133 HG3 GLU 18 HG3 GLU 18 26.184 15.749 -7.928 134 H ALA 19 H ALA 19 27.081 15.422 -5.411 135 HA ALA 19 HA ALA 19 26.660 18.202 -4.720 136 HB1 ALA 19 HB1 ALA 19 24.974 16.354 -4.529 137 HB2 ALA 19 HB2 ALA 19 25.888 15.706 -3.154 138 HB3 ALA 19 HB3 ALA 19 25.162 17.322 -3.046 139 H VAL 20 H VAL 20 28.654 15.609 -3.234 140 HA VAL 20 HA VAL 20 29.600 17.264 -1.026 141 HB VAL 20 HB VAL 20 30.779 14.765 -2.297 142 HG11 VAL 20 HG11 VAL 20 32.582 15.931 -1.104 143 HG12 VAL 20 HG12 VAL 20 31.531 16.158 0.314 144 HG13 VAL 20 HG13 VAL 20 32.059 14.531 -0.170 145 HG21 VAL 20 HG21 VAL 20 29.190 15.170 0.281 146 HG22 VAL 20 HG22 VAL 20 28.560 14.438 -1.207 147 HG23 VAL 20 HG23 VAL 20 29.850 13.633 -0.318 148 H ARG 21 H ARG 21 30.981 16.587 -4.260 149 HA ARG 21 HA ARG 21 33.179 18.303 -4.133 150 HB2 ARG 21 HB2 ARG 21 32.642 16.729 -5.994 151 HB3 ARG 21 HB3 ARG 21 31.360 17.802 -6.534 152 HG2 ARG 21 HG2 ARG 21 33.380 18.034 -7.896 153 HG3 ARG 21 HG3 ARG 21 32.937 19.545 -7.108 154 HD2 ARG 21 HD2 ARG 21 35.367 19.187 -7.094 155 HD3 ARG 21 HD3 ARG 21 34.717 19.263 -5.451 156 HE ARG 21 HE ARG 21 34.867 16.532 -6.443 157 HH11 ARG 21 HH11 ARG 21 36.950 19.024 -5.131 158 HH12 ARG 21 HH12 ARG 21 38.081 17.870 -4.482 159 HH21 ARG 21 HH21 ARG 21 36.345 15.107 -5.580 160 HH22 ARG 21 HH22 ARG 21 37.748 15.708 -4.750 161 H LEU 22 H LEU 22 29.843 19.265 -5.025 162 HA LEU 22 HA LEU 22 30.508 22.090 -5.126 163 HB2 LEU 22 HB2 LEU 22 27.920 20.578 -5.279 164 HB3 LEU 22 HB3 LEU 22 27.934 22.294 -4.842 165 HG LEU 22 HG LEU 22 29.426 22.718 -6.882 166 HD11 LEU 22 HD11 LEU 22 29.158 21.135 -8.755 167 HD12 LEU 22 HD12 LEU 22 28.353 19.982 -7.680 168 HD13 LEU 22 HD13 LEU 22 30.066 20.401 -7.426 169 HD21 LEU 22 HD21 LEU 22 27.505 22.886 -8.336 170 HD22 LEU 22 HD22 LEU 22 27.096 23.349 -6.671 171 HD23 LEU 22 HD23 LEU 22 26.588 21.756 -7.293 172 H ALA 23 H ALA 23 29.322 20.071 -2.379 173 HA ALA 23 HA ALA 23 29.080 22.273 -0.583 174 HB1 ALA 23 HB1 ALA 23 29.404 20.604 1.160 175 HB2 ALA 23 HB2 ALA 23 28.381 19.936 -0.123 176 HB3 ALA 23 HB3 ALA 23 30.089 19.456 -0.016 177 H SER 24 H SER 24 31.965 20.523 -1.667 178 HA SER 24 HA SER 24 33.857 22.139 -0.289 179 HB2 SER 24 HB2 SER 24 34.432 20.604 -2.839 180 HB3 SER 24 HB3 SER 24 35.543 21.079 -1.560 181 HG SER 24 HG SER 24 33.414 19.178 -1.372 182 H ILE 25 H ILE 25 32.586 22.532 -3.688 183 HA ILE 25 HA ILE 25 34.303 24.782 -4.105 184 HB ILE 25 HB ILE 25 31.759 24.626 -5.655 185 HG12 ILE 25 HG12 ILE 25 32.420 22.345 -5.863 186 HG13 ILE 25 HG13 ILE 25 32.846 23.183 -7.296 187 HG21 ILE 25 HG21 ILE 25 34.661 25.438 -6.211 188 HG22 ILE 25 HG22 ILE 25 33.384 25.418 -7.418 189 HG23 ILE 25 HG23 ILE 25 33.267 26.513 -6.040 190 HD11 ILE 25 HD11 ILE 25 34.533 21.559 -6.690 191 HD12 ILE 25 HD12 ILE 25 35.221 23.198 -6.669 192 HD13 ILE 25 HD13 ILE 25 34.815 22.359 -5.141 193 H VAL 26 H VAL 26 31.028 24.510 -2.772 194 HA VAL 26 HA VAL 26 30.463 27.353 -2.538 195 HB VAL 26 HB VAL 26 29.465 24.958 -0.975 196 HG11 VAL 26 HG11 VAL 26 27.561 26.451 -0.331 197 HG12 VAL 26 HG12 VAL 26 29.097 26.985 0.349 198 HG13 VAL 26 HG13 VAL 26 28.427 27.828 -1.060 199 HG21 VAL 26 HG21 VAL 26 28.863 25.073 -3.505 200 HG22 VAL 26 HG22 VAL 26 27.505 25.024 -2.392 201 HG23 VAL 26 HG23 VAL 26 27.998 26.564 -3.127 202 H ASP 27 H ASP 27 31.803 24.923 -0.090 203 HA ASP 27 HA ASP 27 32.538 26.798 1.856 204 HB2 ASP 27 HB2 ASP 27 32.833 24.448 2.251 205 HB3 ASP 27 HB3 ASP 27 33.960 24.295 0.899 206 H SER 28 H SER 28 34.463 25.903 -1.027 207 HA SER 28 HA SER 28 36.659 27.631 -0.599 208 HB2 SER 28 HB2 SER 28 35.483 26.875 -3.305 209 HB3 SER 28 HB3 SER 28 37.115 27.466 -2.981 210 HG SER 28 HG SER 28 35.957 25.019 -2.065 211 H ARG 29 H ARG 29 33.524 28.366 -2.081 212 HA ARG 29 HA ARG 29 34.083 31.179 -2.578 213 HB2 ARG 29 HB2 ARG 29 32.440 29.814 -3.857 214 HB3 ARG 29 HB3 ARG 29 31.442 29.656 -2.422 215 HG2 ARG 29 HG2 ARG 29 30.471 31.325 -3.762 216 HG3 ARG 29 HG3 ARG 29 31.167 32.135 -2.364 217 HD2 ARG 29 HD2 ARG 29 33.040 32.932 -3.715 218 HD3 ARG 29 HD3 ARG 29 32.502 31.933 -5.088 219 HE ARG 29 HE ARG 29 30.473 33.827 -4.124 220 HH11 ARG 29 HH11 ARG 29 33.309 33.726 -6.167 221 HH12 ARG 29 HH12 ARG 29 32.707 34.957 -7.240 222 HH21 ARG 29 HH21 ARG 29 29.621 35.211 -5.711 223 HH22 ARG 29 HH22 ARG 29 30.703 35.820 -6.929 224 H LEU 30 H LEU 30 32.500 29.450 0.182 225 HA LEU 30 HA LEU 30 31.806 31.875 1.553 226 HB2 LEU 30 HB2 LEU 30 32.362 29.136 2.733 227 HB3 LEU 30 HB3 LEU 30 31.595 30.497 3.556 228 HG LEU 30 HG LEU 30 30.459 28.995 1.184 229 HD11 LEU 30 HD11 LEU 30 28.780 28.168 2.728 230 HD12 LEU 30 HD12 LEU 30 29.446 29.145 4.043 231 HD13 LEU 30 HD13 LEU 30 30.356 27.755 3.411 232 HD21 LEU 30 HD21 LEU 30 28.377 30.284 1.586 233 HD22 LEU 30 HD22 LEU 30 29.699 31.285 0.999 234 HD23 LEU 30 HD23 LEU 30 29.264 31.316 2.730 235 H ILE 31 H ILE 31 34.818 29.983 1.530 236 HA ILE 31 HA ILE 31 36.241 31.744 3.368 237 HB ILE 31 HB ILE 31 37.147 29.689 1.315 238 HG12 ILE 31 HG12 ILE 31 37.138 29.541 4.365 239 HG13 ILE 31 HG13 ILE 31 35.826 28.922 3.381 240 HG21 ILE 31 HG21 ILE 31 38.825 31.148 3.411 241 HG22 ILE 31 HG22 ILE 31 39.382 29.784 2.421 242 HG23 ILE 31 HG23 ILE 31 38.986 31.303 1.647 243 HD11 ILE 31 HD11 ILE 31 37.381 27.364 2.231 244 HD12 ILE 31 HD12 ILE 31 38.684 27.888 3.331 245 HD13 ILE 31 HD13 ILE 31 37.248 27.087 3.978 246 H GLY 32 H GLY 32 35.860 31.609 -0.179 247 HA2 GLY 32 HA2 GLY 32 37.887 33.413 -0.919 248 HA3 GLY 32 HA3 GLY 32 36.474 32.909 -1.879 249 H THR 33 H THR 33 34.424 33.895 -0.326 250 HA THR 33 HA THR 33 34.866 36.780 0.024 251 HB THR 33 HB THR 33 34.452 36.576 -2.386 252 HG1 THR 33 HG1 THR 33 32.826 38.099 -2.489 253 HG21 THR 33 HG21 THR 33 32.925 34.554 -2.237 254 HG22 THR 33 HG22 THR 33 32.383 35.853 -3.318 255 HG23 THR 33 HG23 THR 33 31.628 35.660 -1.725 256 H GLY 34 H GLY 34 32.647 34.016 0.361 257 HA2 GLY 34 HA2 GLY 34 31.579 33.678 2.498 258 HA3 GLY 34 HA3 GLY 34 31.509 35.401 2.787 259 H SER 35 H SER 35 30.424 34.515 -0.376 260 HA SER 35 HA SER 35 27.788 33.563 0.287 261 HB2 SER 35 HB2 SER 35 28.211 36.365 -0.841 262 HB3 SER 35 HB3 SER 35 26.700 35.460 -1.064 263 HG SER 35 HG SER 35 27.788 35.648 1.514 264 H VAL 36 H VAL 36 26.699 32.768 -1.595 265 HA VAL 36 HA VAL 36 28.467 32.303 -3.981 266 HB VAL 36 HB VAL 36 28.494 30.389 -2.387 267 HG11 VAL 36 HG11 VAL 36 26.173 30.536 -1.533 268 HG12 VAL 36 HG12 VAL 36 25.563 30.039 -3.122 269 HG13 VAL 36 HG13 VAL 36 26.568 28.928 -2.174 270 HG21 VAL 36 HG21 VAL 36 28.153 28.695 -4.088 271 HG22 VAL 36 HG22 VAL 36 27.116 29.794 -5.026 272 HG23 VAL 36 HG23 VAL 36 28.850 30.139 -4.840 273 H ASP 37 H ASP 37 27.465 32.391 -5.981 274 HA ASP 37 HA ASP 37 24.614 33.131 -6.028 275 HB2 ASP 37 HB2 ASP 37 26.802 34.304 -7.752 276 HB3 ASP 37 HB3 ASP 37 25.186 34.927 -7.454 277 H GLU 38 H GLU 38 23.511 32.703 -8.006 278 HA GLU 38 HA GLU 38 23.913 30.291 -9.203 279 HB2 GLU 38 HB2 GLU 38 21.932 31.996 -9.393 280 HB3 GLU 38 HB3 GLU 38 22.785 32.606 -10.810 281 HG2 GLU 38 HG2 GLU 38 22.803 29.940 -11.393 282 HG3 GLU 38 HG3 GLU 38 21.391 29.991 -10.350 283 H ASP 39 H ASP 39 25.286 33.375 -10.449 284 HA ASP 39 HA ASP 39 26.442 32.250 -12.805 285 HB2 ASP 39 HB2 ASP 39 27.689 34.421 -12.855 286 HB3 ASP 39 HB3 ASP 39 25.938 34.562 -12.768 287 H PHE 40 H PHE 40 27.540 32.153 -9.459 288 HA PHE 40 HA PHE 40 30.299 31.477 -10.280 289 HB2 PHE 40 HB2 PHE 40 29.928 32.595 -8.140 290 HB3 PHE 40 HB3 PHE 40 28.847 31.312 -7.613 291 HD1 PHE 40 HD1 PHE 40 32.395 32.089 -8.488 292 HD2 PHE 40 HD2 PHE 40 29.682 29.233 -6.736 293 HE1 PHE 40 HE1 PHE 40 34.320 30.830 -7.543 294 HE2 PHE 40 HE2 PHE 40 31.593 28.012 -5.751 295 HZ PHE 40 HZ PHE 40 33.925 28.808 -6.154 296 H LEU 41 H LEU 41 27.269 29.772 -9.225 297 HA LEU 41 HA LEU 41 28.619 27.207 -9.172 298 HB2 LEU 41 HB2 LEU 41 25.766 28.151 -8.797 299 HB3 LEU 41 HB3 LEU 41 26.161 26.438 -8.736 300 HG LEU 41 HG LEU 41 27.322 28.579 -6.913 301 HD11 LEU 41 HD11 LEU 41 25.964 27.478 -5.175 302 HD12 LEU 41 HD12 LEU 41 25.309 26.350 -6.382 303 HD13 LEU 41 HD13 LEU 41 24.940 28.088 -6.484 304 HD21 LEU 41 HD21 LEU 41 27.716 25.552 -6.934 305 HD22 LEU 41 HD22 LEU 41 28.139 26.597 -5.566 306 HD23 LEU 41 HD23 LEU 41 28.976 26.794 -7.099 307 H ARG 42 H ARG 42 26.528 28.716 -11.647 308 HA ARG 42 HA ARG 42 26.260 26.464 -13.331 309 HB2 ARG 42 HB2 ARG 42 26.130 27.993 -15.211 310 HB3 ARG 42 HB3 ARG 42 25.203 28.539 -13.815 311 HG2 ARG 42 HG2 ARG 42 27.007 30.142 -13.224 312 HG3 ARG 42 HG3 ARG 42 27.991 29.540 -14.557 313 HD2 ARG 42 HD2 ARG 42 27.050 31.535 -15.251 314 HD3 ARG 42 HD3 ARG 42 26.277 30.256 -16.190 315 HE ARG 42 HE ARG 42 24.470 30.623 -14.164 316 HH11 ARG 42 HH11 ARG 42 25.962 32.955 -16.322 317 HH12 ARG 42 HH12 ARG 42 24.576 34.007 -16.291 318 HH21 ARG 42 HH22 ARG 42 22.683 31.948 -14.273 319 HH22 ARG 42 HH21 ARG 42 22.784 33.461 -15.140 320 H GLU 43 H GLU 43 29.238 28.236 -12.721 321 HA GLU 43 HA GLU 43 30.781 26.800 -14.764 322 HB2 GLU 43 HB2 GLU 43 31.841 28.435 -12.428 323 HB3 GLU 43 HB3 GLU 43 32.681 27.973 -13.912 324 HG2 GLU 43 HG2 GLU 43 30.753 29.240 -15.123 325 HG3 GLU 43 HG3 GLU 43 30.458 29.994 -13.558 326 H GLN 44 H GLN 44 29.491 25.604 -11.907 327 HA GLN 44 HA GLN 44 31.891 23.969 -11.252 328 HB2 GLN 44 HB2 GLN 44 29.691 24.726 -9.324 329 HB3 GLN 44 HB3 GLN 44 31.231 23.940 -8.975 330 HG2 GLN 44 HG2 GLN 44 30.769 26.794 -9.846 331 HG3 GLN 44 HG3 GLN 44 31.309 26.268 -8.271 332 HE21 GLN 44 HE21 GLN 44 32.689 28.217 -9.608 333 HE22 GLN 44 HE22 GLN 44 34.271 27.579 -10.057 334 H ILE 45 H ILE 45 28.576 23.884 -12.337 335 HA ILE 45 HA ILE 45 27.858 21.263 -11.433 336 HB ILE 45 HB ILE 45 26.618 21.266 -13.778 337 HG12 ILE 45 HG12 ILE 45 26.850 24.265 -13.376 338 HG13 ILE 45 HG13 ILE 45 27.768 23.386 -14.604 339 HG21 ILE 45 HG21 ILE 45 25.777 23.088 -11.518 340 HG22 ILE 45 HG22 ILE 45 24.719 22.235 -12.681 341 HG23 ILE 45 HG23 ILE 45 25.667 21.292 -11.525 342 HD11 ILE 45 HD11 ILE 45 25.604 22.554 -15.576 343 HD12 ILE 45 HD12 ILE 45 24.740 23.626 -14.448 344 HD13 ILE 45 HD13 ILE 45 25.824 24.317 -15.661 345 H ARG 46 H ARG 46 28.781 21.864 -14.936 346 HA ARG 46 HA ARG 46 30.333 21.197 -16.175 347 HB2 ARG 46 HB2 ARG 46 31.683 19.800 -13.847 348 HB3 ARG 46 HB3 ARG 46 32.382 20.067 -15.443 349 HG2 ARG 46 HG2 ARG 46 32.375 22.503 -15.112 350 HG3 ARG 46 HG3 ARG 46 31.559 22.316 -13.545 351 HD2 ARG 46 HD2 ARG 46 33.444 20.866 -12.782 352 HD3 ARG 46 HD3 ARG 46 34.300 21.265 -14.288 353 HE ARG 46 HE ARG 46 33.496 23.686 -12.914 354 HH11 ARG 46 HH11 ARG 46 36.010 21.243 -12.927 355 HH12 ARG 46 HH12 ARG 46 37.087 22.200 -11.951 356 HH21 ARG 46 HH21 ARG 46 34.787 24.680 -11.351 357 HH22 ARG 46 HH22 ARG 46 36.443 24.172 -11.189 358 H ASP 47 H ASP 47 28.465 19.078 -14.444 359 HA ASP 47 HA ASP 47 28.158 17.356 -16.833 360 HB2 ASP 47 HB2 ASP 47 30.055 16.344 -15.501 361 HB3 ASP 47 HB3 ASP 47 28.926 16.096 -14.170 362 H ALA 48 H ALA 48 26.970 18.374 -13.663 363 HA ALA 48 HA ALA 48 24.466 16.850 -13.869 364 HB1 ALA 48 HB1 ALA 48 23.938 17.900 -11.732 365 HB2 ALA 48 HB2 ALA 48 25.584 17.253 -11.673 366 HB3 ALA 48 HB3 ALA 48 25.327 18.995 -11.880 367 H ARG 49 H ARG 49 22.412 17.795 -14.151 368 HA ARG 49 HA ARG 49 22.204 20.092 -15.880 369 HB2 ARG 49 HB2 ARG 49 20.422 18.022 -14.816 370 HB3 ARG 49 HB3 ARG 49 19.656 19.572 -14.676 371 HG2 ARG 49 HG2 ARG 49 19.086 18.484 -16.783 372 HG3 ARG 49 HG3 ARG 49 19.876 20.037 -17.023 373 HD2 ARG 49 HD2 ARG 49 20.583 18.279 -18.627 374 HD3 ARG 49 HD3 ARG 49 21.931 18.981 -17.736 375 HE ARG 49 HE ARG 49 21.607 16.858 -16.186 376 HH11 ARG 49 HH11 ARG 49 21.504 16.830 -19.702 377 HH12 ARG 49 HH12 ARG 49 22.118 15.202 -19.769 378 HH21 ARG 49 HH21 ARG 49 22.364 14.889 -16.320 379 HH22 ARG 49 HH22 ARG 49 22.594 14.110 -17.876 380 H TYR 50 H TYR 50 20.945 19.793 -12.485 381 HA TYR 50 HA TYR 50 21.150 22.782 -12.332 382 HB2 TYR 50 HB2 TYR 50 19.144 21.046 -10.905 383 HB3 TYR 50 HB3 TYR 50 19.041 22.757 -11.256 384 HD1 TYR 50 HD2 TYR 50 19.507 22.930 -14.149 385 HD2 TYR 50 HD1 TYR 50 17.337 19.980 -11.900 386 HE1 TYR 50 HE2 TYR 50 18.113 22.452 -16.151 387 HE2 TYR 50 HE1 TYR 50 15.939 19.484 -13.909 388 HH TYR 50 HH TYR 50 16.431 21.166 -17.021 389 H ALA 51 H ALA 51 22.281 23.687 -10.591 390 HA ALA 51 HA ALA 51 22.847 21.919 -8.241 391 HB1 ALA 51 HB1 ALA 51 24.645 23.552 -7.737 392 HB2 ALA 51 HB2 ALA 51 24.905 22.677 -9.261 393 HB3 ALA 51 HB3 ALA 51 24.331 24.362 -9.282 394 H VAL 52 H VAL 52 22.208 22.665 -6.200 395 HA VAL 52 HA VAL 52 20.549 25.146 -6.081 396 HB VAL 52 HB VAL 52 19.633 22.366 -5.279 397 HG11 VAL 52 HG11 VAL 52 18.740 23.999 -3.673 398 HG12 VAL 52 HG12 VAL 52 18.222 25.060 -5.009 399 HG13 VAL 52 HG13 VAL 52 17.456 23.478 -4.760 400 HG21 VAL 52 HG21 VAL 52 19.415 22.637 -7.676 401 HG22 VAL 52 HG22 VAL 52 17.821 22.763 -6.944 402 HG23 VAL 52 HG23 VAL 52 18.661 24.235 -7.469 403 H ILE 53 H ILE 53 20.480 26.194 -4.134 404 HA ILE 53 HA ILE 53 22.445 25.245 -2.134 405 HB ILE 53 HB ILE 53 22.073 27.715 -3.679 406 HG12 ILE 53 HG12 ILE 53 24.061 26.363 -3.845 407 HG13 ILE 53 HG13 ILE 53 24.447 27.982 -3.277 408 HG21 ILE 53 HG21 ILE 53 22.949 29.313 -1.997 409 HG22 ILE 53 HG22 ILE 53 21.284 28.833 -1.704 410 HG23 ILE 53 HG23 ILE 53 22.580 28.152 -0.708 411 HD11 ILE 53 HD11 ILE 53 24.481 25.380 -1.733 412 HD12 ILE 53 HD12 ILE 53 25.763 26.583 -1.923 413 HD13 ILE 53 HD13 ILE 53 24.372 26.923 -0.870 414 H ARG 54 H ARG 54 21.925 24.921 -0.127 415 HA ARG 54 HA ARG 54 19.724 26.512 1.151 416 HB2 ARG 54 HB2 ARG 54 20.544 23.635 1.674 417 HB3 ARG 54 HB3 ARG 54 19.268 24.526 2.507 418 HG2 ARG 54 HG2 ARG 54 19.269 23.731 -0.449 419 HG3 ARG 54 HG3 ARG 54 18.459 22.856 0.841 420 HD2 ARG 54 HD2 ARG 54 16.992 24.783 1.292 421 HD3 ARG 54 HD3 ARG 54 17.840 25.737 0.080 422 HE ARG 54 HE ARG 54 16.744 24.648 -1.628 423 HH11 ARG 54 HH11 ARG 54 16.034 22.850 1.303 424 HH12 ARG 54 HH12 ARG 54 14.837 21.862 0.515 425 HH21 ARG 54 HH21 ARG 54 15.185 23.354 -2.566 426 HH22 ARG 54 HH22 ARG 54 14.374 22.150 -1.614 427 H ILE 55 H ILE 55 21.380 28.050 1.694 428 HA ILE 55 HA ILE 55 23.329 27.221 3.799 429 HB ILE 55 HB ILE 55 23.203 29.690 2.049 430 HG12 ILE 55 HG12 ILE 55 25.654 27.984 2.464 431 HG13 ILE 55 HG13 ILE 55 24.394 27.390 1.378 432 HG21 ILE 55 HG21 ILE 55 23.780 30.488 4.289 433 HG22 ILE 55 HG22 ILE 55 24.972 29.181 4.493 434 HG23 ILE 55 HG23 ILE 55 25.248 30.469 3.317 435 HD11 ILE 55 HD11 ILE 55 26.142 28.575 0.180 436 HD12 ILE 55 HD12 ILE 55 24.600 29.446 0.035 437 HD13 ILE 55 HD13 ILE 55 25.868 30.044 1.135 438 HA PRO 56 HA PRO 56 20.169 28.986 6.496 439 HB2 PRO 56 HB2 PRO 56 21.541 29.092 8.870 440 HB3 PRO 56 HB3 PRO 56 20.895 27.581 8.161 441 HG2 PRO 56 HG2 PRO 56 23.721 28.670 7.961 442 HG3 PRO 56 HG3 PRO 56 23.201 27.008 8.388 443 HD2 PRO 56 HD2 PRO 56 23.980 27.659 5.874 444 HD3 PRO 56 HD3 PRO 56 22.637 26.510 6.146 445 H GLY 57 H GLY 57 19.564 31.056 6.919 446 HA2 GLY 57 HA2 GLY 57 19.738 33.298 7.496 447 HA3 GLY 57 HA3 GLY 57 21.496 33.211 7.433 448 H GLN 58 H GLN 58 20.471 31.911 4.514 449 HA GLN 58 HA GLN 58 19.932 34.506 3.187 450 HB2 GLN 58 HB2 GLN 58 21.664 34.311 1.601 451 HB3 GLN 58 HB3 GLN 58 22.401 33.943 3.160 452 HG2 GLN 58 HG2 GLN 58 22.341 31.577 2.698 453 HG3 GLN 58 HG3 GLN 58 21.549 31.843 1.136 454 HE21 GLN 58 HE21 GLN 58 24.522 33.025 2.898 455 HE22 GLN 58 HE22 GLN 58 25.526 32.937 1.459 456 HA PRO 59 HA PRO 59 16.908 32.191 0.989 457 HB2 PRO 59 HB2 PRO 59 16.663 33.433 -1.434 458 HB3 PRO 59 HB3 PRO 59 16.175 34.194 0.112 459 HG2 PRO 59 HG2 PRO 59 18.798 34.539 -1.384 460 HG3 PRO 59 HG3 PRO 59 17.717 35.818 -0.739 461 HD2 PRO 59 HD2 PRO 59 19.886 34.963 0.638 462 HD3 PRO 59 HD3 PRO 59 18.368 35.370 1.491 463 H VAL 60 H VAL 60 16.561 30.529 -0.459 464 HA VAL 60 HA VAL 60 18.666 28.983 -1.508 465 HB VAL 60 HB VAL 60 16.565 27.965 -1.095 466 HG11 VAL 60 HG11 VAL 60 15.300 29.682 -3.271 467 HG12 VAL 60 HG12 VAL 60 14.516 28.352 -2.398 468 HG13 VAL 60 HG13 VAL 60 14.987 29.809 -1.527 469 HG21 VAL 60 HG21 VAL 60 17.861 26.975 -3.004 470 HG22 VAL 60 HG22 VAL 60 16.121 26.681 -3.093 471 HG23 VAL 60 HG23 VAL 60 16.859 27.911 -4.129 472 H VAL 61 H VAL 61 19.730 28.823 -3.302 473 HA VAL 61 HA VAL 61 19.091 30.528 -5.688 474 HB VAL 61 HB VAL 61 21.827 29.640 -4.691 475 HG11 VAL 61 HG11 VAL 61 21.112 31.204 -7.201 476 HG12 VAL 61 HG12 VAL 61 22.751 30.916 -6.564 477 HG13 VAL 61 HG13 VAL 61 21.798 29.558 -7.149 478 HG21 VAL 61 HG21 VAL 61 20.619 32.417 -4.995 479 HG22 VAL 61 HG22 VAL 61 20.966 31.590 -3.462 480 HG23 VAL 61 HG23 VAL 61 22.295 32.054 -4.524 481 H GLU 62 H GLU 62 19.007 29.442 -7.677 482 HA GLU 62 HA GLU 62 19.595 26.546 -7.735 483 HB2 GLU 62 HB2 GLU 62 17.381 26.122 -8.822 484 HB3 GLU 62 HB3 GLU 62 17.349 26.458 -7.091 485 HG2 GLU 62 HG2 GLU 62 16.584 28.774 -7.525 486 HG3 GLU 62 HG3 GLU 62 16.648 28.474 -9.264 487 H VAL 63 H VAL 63 20.702 26.021 -9.491 488 HA VAL 63 HA VAL 63 21.176 28.043 -11.577 489 HB VAL 63 HB VAL 63 22.585 25.446 -10.881 490 HG11 VAL 63 HG11 VAL 63 23.531 27.832 -12.493 491 HG12 VAL 63 HG12 VAL 63 24.547 26.472 -11.958 492 HG13 VAL 63 HG13 VAL 63 23.249 26.174 -13.106 493 HG21 VAL 63 HG21 VAL 63 24.233 26.706 -9.697 494 HG22 VAL 63 HG22 VAL 63 23.402 28.239 -10.013 495 HG23 VAL 63 HG23 VAL 63 22.692 27.022 -8.930 496 H GLY 64 H GLY 64 21.310 27.393 -13.876 497 HA2 GLY 64 HA2 GLY 64 20.777 26.181 -15.734 498 HA3 GLY 64 HA3 GLY 64 20.445 24.791 -14.708 499 H THR 65 H THR 65 18.251 24.391 -14.049 500 HA THR 65 HA THR 65 16.129 26.327 -14.587 501 HB THR 65 HB THR 65 16.069 23.678 -16.103 502 HG1 THR 65 HG1 THR 65 17.115 26.027 -16.713 503 HG21 THR 65 HG21 THR 65 13.790 24.307 -15.528 504 HG22 THR 65 HG22 THR 65 14.066 24.673 -17.228 505 HG23 THR 65 HG23 THR 65 14.082 25.990 -16.036 506 H LYS 66 H LYS 66 14.236 25.829 -13.387 507 HA LYS 66 HA LYS 66 14.646 24.245 -11.089 508 HB2 LYS 66 HB2 LYS 66 13.203 26.329 -11.354 509 HB3 LYS 66 HB3 LYS 66 11.955 25.289 -12.057 510 HG2 LYS 66 HG2 LYS 66 12.000 23.918 -9.927 511 HG3 LYS 66 HG3 LYS 66 13.198 25.050 -9.280 512 HD2 LYS 66 HD2 LYS 66 11.436 26.912 -9.747 513 HD3 LYS 66 HD3 LYS 66 10.300 25.589 -10.033 514 HE2 LYS 66 HE2 LYS 66 9.933 26.092 -7.783 515 HE3 LYS 66 HE3 LYS 66 11.017 24.698 -7.700 516 HZ1 LYS 66 HZ1 LYS 66 11.802 27.555 -7.404 517 HZ2 LYS 66 HZ2 LYS 66 12.888 26.343 -7.407 518 HZ3 LYS 66 HZ3 LYS 66 11.771 26.445 -6.203 519 HA PRO 67 HA PRO 67 13.417 20.352 -12.910 520 HB2 PRO 67 HB2 PRO 67 13.705 18.700 -10.766 521 HB3 PRO 67 HB3 PRO 67 15.084 19.405 -11.670 522 HG2 PRO 67 HG2 PRO 67 13.865 20.347 -9.069 523 HG3 PRO 67 HG3 PRO 67 15.598 20.186 -9.522 524 HD2 PRO 67 HD2 PRO 67 14.249 22.579 -9.632 525 HD3 PRO 67 HD3 PRO 67 15.584 22.155 -10.747 526 H THR 68 H THR 68 11.766 19.031 -13.069 527 HA THR 68 HA THR 68 9.273 19.831 -12.104 528 HB THR 68 HB THR 68 9.735 19.080 -14.368 529 HG1 THR 68 HG1 THR 68 7.813 17.957 -14.635 530 HG21 THR 68 HG21 THR 68 9.875 16.778 -15.016 531 HG22 THR 68 HG22 THR 68 9.595 16.215 -13.361 532 HG23 THR 68 HG23 THR 68 11.122 17.027 -13.785 533 H GLY 69 H GLY 69 11.138 17.069 -11.073 534 HA2 GLY 69 HA2 GLY 69 10.419 16.297 -8.681 535 HA3 GLY 69 HA3 GLY 69 8.863 15.969 -9.469 536 H ASP 70 H ASP 70 9.870 15.059 -11.915 537 HA ASP 70 HA ASP 70 10.781 12.326 -11.365 538 HB2 ASP 70 HB2 ASP 70 10.343 13.720 -14.010 539 HB3 ASP 70 HB3 ASP 70 10.557 11.979 -13.753 540 H VAL 71 H VAL 71 12.669 13.507 -10.224 541 HA VAL 71 HA VAL 71 15.033 13.654 -11.957 542 HB VAL 71 HB VAL 71 15.832 15.665 -10.830 543 HG11 VAL 71 HG11 VAL 71 14.761 17.200 -12.192 544 HG12 VAL 71 HG12 VAL 71 14.384 15.701 -13.007 545 HG13 VAL 71 HG13 VAL 71 13.149 16.501 -12.007 546 HG21 VAL 71 HG21 VAL 71 13.076 15.981 -9.598 547 HG22 VAL 71 HG22 VAL 71 14.542 15.503 -8.720 548 HG23 VAL 71 HG23 VAL 71 14.462 17.088 -9.466 549 H LEU 72 H LEU 72 17.011 13.454 -10.862 550 HA LEU 72 HA LEU 72 17.031 11.650 -8.481 551 HB2 LEU 72 HB2 LEU 72 19.164 12.601 -10.439 552 HB3 LEU 72 HB3 LEU 72 19.481 11.485 -9.116 553 HG LEU 72 HG LEU 72 17.406 10.895 -11.213 554 HD11 LEU 72 HD11 LEU 72 19.127 9.607 -12.469 555 HD12 LEU 72 HD12 LEU 72 20.382 10.268 -11.393 556 HD13 LEU 72 HD13 LEU 72 19.456 11.343 -12.464 557 HD21 LEU 72 HD21 LEU 72 17.491 9.486 -9.157 558 HD22 LEU 72 HD22 LEU 72 19.196 9.129 -9.494 559 HD23 LEU 72 HD23 LEU 72 17.930 8.546 -10.601 560 H GLN 73 H GLN 73 17.832 12.412 -6.445 561 HA GLN 73 HA GLN 73 18.828 15.231 -6.412 562 HB2 GLN 73 HB2 GLN 73 17.150 13.608 -4.479 563 HB3 GLN 73 HB3 GLN 73 17.890 15.167 -4.107 564 HG2 GLN 73 HG2 GLN 73 16.695 16.115 -6.149 565 HG3 GLN 73 HG3 GLN 73 15.774 14.616 -6.230 566 HE21 GLN 73 HE21 GLN 73 14.961 17.491 -5.644 567 HE22 GLN 73 HE22 GLN 73 14.119 17.382 -4.092 568 H GLY 74 H GLY 74 20.892 15.427 -6.017 569 HA2 GLY 74 HA2 GLY 74 22.434 13.505 -4.318 570 HA3 GLY 74 HA3 GLY 74 23.074 14.782 -5.382 571 H ARG 75 H ARG 75 23.453 14.423 -2.349 572 HA ARG 75 HA ARG 75 22.611 17.104 -1.512 573 HB2 ARG 75 HB2 ARG 75 20.545 15.756 -1.202 574 HB3 ARG 75 HB3 ARG 75 21.423 14.669 -0.121 575 HG2 ARG 75 HG2 ARG 75 21.817 16.539 1.459 576 HG3 ARG 75 HG3 ARG 75 21.013 17.666 0.343 577 HD2 ARG 75 HD2 ARG 75 18.905 16.444 0.575 578 HD3 ARG 75 HD3 ARG 75 19.697 15.211 1.582 579 HE ARG 75 HE ARG 75 20.130 17.727 2.814 580 HH11 ARG 75 HH11 ARG 75 17.416 15.599 2.210 581 HH12 ARG 75 HH12 ARG 75 16.550 16.137 3.624 582 HH21 ARG 75 HH21 ARG 75 18.977 18.366 4.624 583 HH22 ARG 75 HH22 ARG 75 17.418 17.671 4.946 584 H ALA 76 H ALA 76 24.036 17.922 -0.220 585 HA ALA 76 HA ALA 76 25.786 16.225 1.548 586 HB1 ALA 76 HB1 ALA 76 26.865 16.500 -0.645 587 HB2 ALA 76 HB2 ALA 76 26.671 18.265 -0.539 588 HB3 ALA 76 HB3 ALA 76 27.754 17.411 0.589 589 H THR 77 H THR 77 27.321 17.590 2.876 590 HA THR 77 HA THR 77 25.997 20.048 3.945 591 HB THR 77 HB THR 77 27.370 17.905 5.595 592 HG1 THR 77 HG1 THR 77 25.302 17.581 6.424 593 HG21 THR 77 HG21 THR 77 27.632 20.189 6.575 594 HG22 THR 77 HG22 THR 77 26.542 19.197 7.542 595 HG23 THR 77 HG23 THR 77 25.880 20.436 6.459 596 H GLY 78 H GLY 78 27.350 21.710 4.172 597 HA2 GLY 78 HA2 GLY 78 30.148 21.418 3.150 598 HA3 GLY 78 HA3 GLY 78 29.215 22.887 3.173 599 H GLU 79 H GLU 79 31.646 23.167 3.993 600 HA GLU 79 HA GLU 79 32.163 22.375 6.727 601 HB2 GLU 79 HB2 GLU 79 33.782 23.919 4.709 602 HB3 GLU 79 HB3 GLU 79 34.378 23.505 6.311 603 HG2 GLU 79 HG2 GLU 79 33.508 21.490 4.190 604 HG3 GLU 79 HG3 GLU 79 35.165 21.964 4.529 605 H GLU 80 H GLU 80 30.524 25.214 5.586 606 HA GLU 80 HA GLU 80 31.313 26.658 8.119 607 HB2 GLU 80 HB2 GLU 80 29.772 27.620 5.710 608 HB3 GLU 80 HB3 GLU 80 30.093 28.568 7.156 609 HG2 GLU 80 HG2 GLU 80 32.303 27.480 5.339 610 HG3 GLU 80 HG3 GLU 80 31.554 29.042 5.247 611 H GLY 81 H GLY 81 29.367 24.275 7.218 612 HA2 GLY 81 HA2 GLY 81 27.730 23.261 8.444 613 HA3 GLY 81 HA3 GLY 81 27.308 24.771 9.237 614 H GLU 82 H GLU 82 27.507 24.815 5.710 615 HA GLU 82 HA GLU 82 24.657 25.273 5.460 616 HB2 GLU 82 HB2 GLU 82 25.181 26.044 3.355 617 HB3 GLU 82 HB3 GLU 82 26.448 26.685 4.403 618 HG2 GLU 82 HG2 GLU 82 26.842 24.239 2.613 619 HG3 GLU 82 HG3 GLU 82 27.014 25.878 2.032 620 H THR 83 H THR 83 23.729 24.375 3.210 621 HA THR 83 HA THR 83 24.250 21.455 3.022 622 HB THR 83 HB THR 83 21.569 22.810 3.407 623 HG1 THR 83 HG1 THR 83 21.455 21.432 5.119 624 HG21 THR 83 HG21 THR 83 22.126 19.929 2.575 625 HG22 THR 83 HG22 THR 83 21.253 21.151 1.617 626 HG23 THR 83 HG23 THR 83 20.556 20.563 3.124 627 H VAL 84 H VAL 84 24.229 20.705 1.064 628 HA VAL 84 HA VAL 84 23.637 22.529 -1.277 629 HB VAL 84 HB VAL 84 25.927 20.557 -0.943 630 HG11 VAL 84 HG11 VAL 84 26.659 21.232 -3.184 631 HG12 VAL 84 HG12 VAL 84 25.125 20.386 -3.273 632 HG13 VAL 84 HG13 VAL 84 25.161 22.166 -3.422 633 HG21 VAL 84 HG21 VAL 84 26.423 22.671 0.105 634 HG22 VAL 84 HG22 VAL 84 27.226 22.696 -1.480 635 HG23 VAL 84 HG23 VAL 84 25.719 23.576 -1.252 636 H LEU 85 H LEU 85 22.568 21.736 -3.006 637 HA LEU 85 HA LEU 85 21.798 18.878 -3.020 638 HB2 LEU 85 HB2 LEU 85 19.959 20.234 -2.036 639 HB3 LEU 85 HB3 LEU 85 19.975 21.267 -3.446 640 HG LEU 85 HG LEU 85 19.413 19.067 -4.792 641 HD11 LEU 85 HD11 LEU 85 18.291 17.339 -3.613 642 HD12 LEU 85 HD12 LEU 85 18.302 18.248 -2.079 643 HD13 LEU 85 HD13 LEU 85 19.800 17.579 -2.720 644 HD21 LEU 85 HD21 LEU 85 17.008 19.337 -4.303 645 HD22 LEU 85 HD22 LEU 85 17.834 20.880 -4.557 646 HD23 LEU 85 HD23 LEU 85 17.417 20.361 -2.906 647 H VAL 86 H VAL 86 21.554 18.025 -5.043 648 HA VAL 86 HA VAL 86 22.108 19.691 -7.471 649 HB VAL 86 HB VAL 86 23.384 16.945 -7.156 650 HG11 VAL 86 HG11 VAL 86 22.916 17.570 -9.457 651 HG12 VAL 86 HG12 VAL 86 23.702 19.156 -9.217 652 HG13 VAL 86 HG13 VAL 86 24.652 17.659 -9.143 653 HG21 VAL 86 HG21 VAL 86 25.551 18.127 -6.979 654 HG22 VAL 86 HG22 VAL 86 24.695 19.685 -6.865 655 HG23 VAL 86 HG23 VAL 86 24.512 18.458 -5.588 656 H GLU 87 H GLU 87 20.849 19.117 -9.250 657 HA GLU 87 HA GLU 87 19.072 16.781 -8.875 658 HB2 GLU 87 HB2 GLU 87 18.022 19.535 -9.542 659 HB3 GLU 87 HB3 GLU 87 17.100 18.023 -9.466 660 HG2 GLU 87 HG2 GLU 87 17.945 17.805 -7.039 661 HG3 GLU 87 HG3 GLU 87 18.504 19.468 -7.176 662 H GLU 88 H GLU 88 18.900 15.558 -10.467 663 HA GLU 88 HA GLU 88 19.813 16.330 -13.225 664 HB2 GLU 88 HB2 GLU 88 20.427 14.090 -11.349 665 HB3 GLU 88 HB3 GLU 88 20.276 13.651 -13.049 666 HG2 GLU 88 HG2 GLU 88 22.169 15.789 -12.050 667 HG3 GLU 88 HG3 GLU 88 22.570 14.062 -12.141 668 HA PRO 89 HA PRO 89 15.804 14.671 -14.542 669 HB2 PRO 89 HB2 PRO 89 16.358 13.884 -17.119 670 HB3 PRO 89 HB3 PRO 89 16.117 15.587 -16.622 671 HG2 PRO 89 HG2 PRO 89 18.749 14.103 -16.957 672 HG3 PRO 89 HG3 PRO 89 18.297 15.716 -17.601 673 HD2 PRO 89 HD2 PRO 89 19.725 15.442 -15.325 674 HD3 PRO 89 HD3 PRO 89 18.459 16.706 -15.450 675 H ARG 90 H ARG 90 14.882 12.734 -14.187 676 HA ARG 90 HA ARG 90 16.549 10.403 -13.605 677 HB2 ARG 90 HB2 ARG 90 14.653 11.160 -12.157 678 HB3 ARG 90 HB3 ARG 90 13.528 10.703 -13.445 679 HG2 ARG 90 HG2 ARG 90 14.236 8.361 -13.285 680 HG3 ARG 90 HG3 ARG 90 15.484 8.789 -12.092 681 HD2 ARG 90 HD2 ARG 90 13.750 9.527 -10.513 682 HD3 ARG 90 HD3 ARG 90 12.486 9.171 -11.713 683 HE ARG 90 HE ARG 90 14.014 6.815 -11.339 684 HH11 ARG 90 HH11 ARG 90 11.777 8.737 -9.449 685 HH12 ARG 90 HH12 ARG 90 11.227 7.363 -8.530 686 HH21 ARG 90 HH21 ARG 90 13.257 5.103 -10.147 687 HH22 ARG 90 HH22 ARG 90 12.045 5.356 -8.925 Start of MODEL 14 1 H1 GLY 1 H1 GLY 1 -2.804 0.439 -2.679 2 H2 GLY 1 H2 GLY 1 -3.429 1.398 -3.848 3 H3 GLY 1 H3 GLY 1 -2.113 1.888 -3.007 4 HA2 GLY 1 HA2 GLY 1 -2.215 -0.415 -4.852 5 HA3 GLY 1 HA3 GLY 1 -1.475 1.155 -5.219 6 H SER 2 H SER 2 -0.361 -1.649 -5.028 7 HA SER 2 HA SER 2 1.493 -1.508 -2.720 8 HB2 SER 2 HB2 SER 2 1.104 -3.681 -4.801 9 HB3 SER 2 HB3 SER 2 2.086 -3.790 -3.330 10 HG SER 2 HG SER 2 -0.000 -4.687 -3.039 11 H GLU 3 H GLU 3 1.632 -0.665 -6.072 12 HA GLU 3 HA GLU 3 4.329 -1.264 -6.660 13 HB2 GLU 3 HB2 GLU 3 2.519 -0.709 -8.270 14 HB3 GLU 3 HB3 GLU 3 2.589 0.982 -7.760 15 HG2 GLU 3 HG2 GLU 3 4.877 1.184 -8.615 16 HG3 GLU 3 HG3 GLU 3 4.939 -0.547 -8.962 17 H THR 4 H THR 4 6.207 0.033 -6.811 18 HA THR 4 HA THR 4 6.389 2.673 -5.621 19 HB THR 4 HB THR 4 7.790 0.336 -4.242 20 HG1 THR 4 HG1 THR 4 5.469 1.341 -3.902 21 HG21 THR 4 HG21 THR 4 8.026 3.340 -3.724 22 HG22 THR 4 HG22 THR 4 9.343 2.215 -4.148 23 HG23 THR 4 HG23 THR 4 8.544 2.077 -2.586 24 H ARG 5 H ARG 5 8.524 3.602 -5.955 25 HA ARG 5 HA ARG 5 9.774 2.600 -8.479 26 HB2 ARG 5 HB2 ARG 5 9.954 5.262 -7.022 27 HB3 ARG 5 HB3 ARG 5 10.971 4.822 -8.408 28 HG2 ARG 5 HG2 ARG 5 9.009 4.505 -9.829 29 HG3 ARG 5 HG3 ARG 5 7.916 4.880 -8.481 30 HD2 ARG 5 HD2 ARG 5 8.821 7.129 -8.303 31 HD3 ARG 5 HD3 ARG 5 10.074 6.763 -9.508 32 HE ARG 5 HE ARG 5 7.457 6.320 -10.626 33 HH11 ARG 5 HH21 ARG 5 9.570 9.031 -9.779 34 HH12 ARG 5 HH22 ARG 5 8.895 9.987 -11.114 35 HH21 ARG 5 HH11 ARG 5 6.718 7.745 -12.261 36 HH22 ARG 5 HH12 ARG 5 7.476 9.347 -12.347 37 H THR 6 H THR 6 11.474 1.257 -8.297 38 HA THR 6 HA THR 6 13.247 1.002 -6.095 39 HB THR 6 HB THR 6 13.826 0.421 -9.025 40 HG1 THR 6 HG1 THR 6 12.982 -1.609 -8.518 41 HG21 THR 6 HG21 THR 6 14.899 -0.813 -6.447 42 HG22 THR 6 HG22 THR 6 15.842 0.116 -7.642 43 HG23 THR 6 HG23 THR 6 15.180 -1.463 -8.077 44 H ILE 7 H ILE 7 15.331 1.803 -5.673 45 HA ILE 7 HA ILE 7 16.388 4.019 -7.370 46 HB ILE 7 HB ILE 7 16.316 4.008 -4.336 47 HG12 ILE 7 HG12 ILE 7 14.772 5.730 -6.343 48 HG13 ILE 7 HG13 ILE 7 14.079 4.502 -5.272 49 HG21 ILE 7 HG21 ILE 7 17.339 6.118 -6.291 50 HG22 ILE 7 HG22 ILE 7 17.335 6.243 -4.521 51 HG23 ILE 7 HG23 ILE 7 18.364 5.061 -5.292 52 HD11 ILE 7 HD11 ILE 7 15.267 7.149 -4.428 53 HD12 ILE 7 HD12 ILE 7 13.592 6.598 -4.307 54 HD13 ILE 7 HD13 ILE 7 14.840 5.832 -3.299 55 H SER 8 H SER 8 18.486 3.776 -7.872 56 HA SER 8 HA SER 8 19.946 1.435 -6.701 57 HB2 SER 8 HB2 SER 8 19.976 2.510 -9.538 58 HB3 SER 8 HB3 SER 8 20.893 1.118 -8.927 59 HG SER 8 HG SER 8 18.927 0.498 -9.940 60 H SER 9 H SER 9 21.805 1.858 -5.690 61 HA SER 9 HA SER 9 23.306 4.213 -5.842 62 HB2 SER 9 HB2 SER 9 24.998 2.933 -4.587 63 HB3 SER 9 HB3 SER 9 23.360 2.866 -3.928 64 HG SER 9 HG SER 9 24.727 0.847 -5.388 65 H THR 10 H THR 10 23.142 4.103 -8.301 66 HA THR 10 HA THR 10 25.850 3.934 -9.361 67 HB THR 10 HB THR 10 24.901 3.178 -11.583 68 HG1 THR 10 HG1 THR 10 23.043 1.863 -11.454 69 HG21 THR 10 HG21 THR 10 24.746 1.053 -9.407 70 HG22 THR 10 HG22 THR 10 26.261 1.646 -10.125 71 HG23 THR 10 HG23 THR 10 25.081 0.789 -11.134 72 H ALA 11 H ALA 11 22.548 4.564 -10.555 73 HA ALA 11 HA ALA 11 23.092 7.181 -11.580 74 HB1 ALA 11 HB1 ALA 11 20.445 5.819 -10.906 75 HB2 ALA 11 HB2 ALA 11 20.658 7.252 -11.937 76 HB3 ALA 11 HB3 ALA 11 21.335 5.693 -12.443 77 H GLN 12 H GLN 12 21.447 6.143 -8.516 78 HA GLN 12 HA GLN 12 21.248 8.911 -7.597 79 HB2 GLN 12 HB2 GLN 12 19.544 7.278 -7.044 80 HB3 GLN 12 HB3 GLN 12 20.733 6.250 -6.229 81 HG2 GLN 12 HG2 GLN 12 19.330 7.539 -4.643 82 HG3 GLN 12 HG3 GLN 12 21.038 7.845 -4.461 83 HE21 GLN 12 HE21 GLN 12 20.790 9.866 -3.443 84 HE22 GLN 12 HE22 GLN 12 20.123 11.250 -4.279 85 H GLU 13 H GLU 13 23.719 6.397 -7.272 86 HA GLU 13 HA GLU 13 25.154 7.694 -5.142 87 HB2 GLU 13 HB2 GLU 13 25.373 5.291 -5.901 88 HB3 GLU 13 HB3 GLU 13 26.246 5.868 -7.314 89 HG2 GLU 13 HG2 GLU 13 27.911 5.193 -5.796 90 HG3 GLU 13 HG3 GLU 13 27.915 6.949 -5.667 91 H ARG 14 H ARG 14 25.678 7.805 -8.604 92 HA ARG 14 HA ARG 14 27.858 9.428 -8.738 93 HB2 ARG 14 HB2 ARG 14 27.419 10.092 -10.988 94 HB3 ARG 14 HB3 ARG 14 27.039 8.393 -10.785 95 HG2 ARG 14 HG2 ARG 14 24.818 8.670 -11.233 96 HG3 ARG 14 HG3 ARG 14 24.702 10.280 -10.544 97 HD2 ARG 14 HD2 ARG 14 26.090 9.679 -13.165 98 HD3 ARG 14 HD3 ARG 14 24.394 10.170 -13.016 99 HE ARG 14 HE ARG 14 25.829 12.169 -11.642 100 HH11 ARG 14 HH11 ARG 14 25.692 11.103 -15.040 101 HH12 ARG 14 HH12 ARG 14 26.231 12.716 -15.536 102 HH21 ARG 14 HH21 ARG 14 26.578 14.018 -12.480 103 HH22 ARG 14 HH22 ARG 14 26.651 14.192 -14.264 104 H VAL 15 H VAL 15 24.627 10.582 -8.390 105 HA VAL 15 HA VAL 15 25.222 13.409 -8.495 106 HB VAL 15 HB VAL 15 23.000 13.824 -7.581 107 HG11 VAL 15 HG11 VAL 15 21.747 13.061 -9.501 108 HG12 VAL 15 HG12 VAL 15 23.363 13.589 -9.999 109 HG13 VAL 15 HG13 VAL 15 22.984 11.854 -9.895 110 HG21 VAL 15 HG21 VAL 15 22.566 10.821 -7.695 111 HG22 VAL 15 HG22 VAL 15 22.741 11.749 -6.186 112 HG23 VAL 15 HG23 VAL 15 21.377 12.059 -7.269 113 H ASP 16 H ASP 16 25.586 11.083 -5.912 114 HA ASP 16 HA ASP 16 25.520 13.083 -3.804 115 HB2 ASP 16 HB2 ASP 16 25.164 10.645 -3.452 116 HB3 ASP 16 HB3 ASP 16 26.858 10.352 -3.862 117 H LEU 17 H LEU 17 28.208 11.589 -5.617 118 HA LEU 17 HA LEU 17 30.260 12.805 -4.181 119 HB2 LEU 17 HB2 LEU 17 30.170 11.563 -6.965 120 HB3 LEU 17 HB3 LEU 17 31.642 12.221 -6.299 121 HG LEU 17 HG LEU 17 31.669 9.863 -6.059 122 HD11 LEU 17 HD11 LEU 17 31.207 11.023 -3.286 123 HD12 LEU 17 HD12 LEU 17 32.695 11.228 -4.243 124 HD13 LEU 17 HD13 LEU 17 32.185 9.612 -3.722 125 HD21 LEU 17 HD21 LEU 17 30.142 8.558 -4.732 126 HD22 LEU 17 HD22 LEU 17 29.235 9.418 -5.984 127 HD23 LEU 17 HD23 LEU 17 29.200 9.992 -4.298 128 H GLU 18 H GLU 18 28.799 13.789 -7.138 129 HA GLU 18 HA GLU 18 30.314 16.223 -7.528 130 HB2 GLU 18 HB2 GLU 18 28.602 16.758 -9.240 131 HB3 GLU 18 HB3 GLU 18 29.421 15.204 -9.395 132 HG2 GLU 18 HG2 GLU 18 27.315 14.213 -8.173 133 HG3 GLU 18 HG3 GLU 18 26.550 15.703 -8.546 134 H ALA 19 H ALA 19 27.267 15.520 -5.736 135 HA ALA 19 HA ALA 19 26.802 18.302 -5.075 136 HB1 ALA 19 HB1 ALA 19 26.008 15.758 -3.604 137 HB2 ALA 19 HB2 ALA 19 25.279 17.370 -3.412 138 HB3 ALA 19 HB3 ALA 19 25.119 16.481 -4.952 139 H VAL 20 H VAL 20 28.728 15.723 -3.433 140 HA VAL 20 HA VAL 20 29.645 17.424 -1.282 141 HB VAL 20 HB VAL 20 30.813 14.900 -2.494 142 HG11 VAL 20 HG11 VAL 20 31.667 16.363 0.045 143 HG12 VAL 20 HG12 VAL 20 32.147 14.709 -0.393 144 HG13 VAL 20 HG13 VAL 20 32.671 16.060 -1.394 145 HG21 VAL 20 HG21 VAL 20 29.332 15.391 0.133 146 HG22 VAL 20 HG22 VAL 20 28.613 14.664 -1.316 147 HG23 VAL 20 HG23 VAL 20 29.921 13.829 -0.475 148 H ARG 21 H ARG 21 31.155 16.690 -4.431 149 HA ARG 21 HA ARG 21 33.309 18.437 -4.285 150 HB2 ARG 21 HB2 ARG 21 32.847 16.847 -6.146 151 HB3 ARG 21 HB3 ARG 21 31.565 17.904 -6.729 152 HG2 ARG 21 HG2 ARG 21 33.621 18.143 -8.032 153 HG3 ARG 21 HG3 ARG 21 33.120 19.655 -7.280 154 HD2 ARG 21 HD2 ARG 21 35.558 19.355 -7.188 155 HD3 ARG 21 HD3 ARG 21 34.854 19.442 -5.568 156 HE ARG 21 HE ARG 21 35.101 16.699 -6.501 157 HH11 ARG 21 HH11 ARG 21 37.092 19.270 -5.195 158 HH12 ARG 21 HH12 ARG 21 38.234 18.158 -4.493 159 HH21 ARG 21 HH21 ARG 21 36.589 15.331 -5.573 160 HH22 ARG 21 HH22 ARG 21 37.958 15.981 -4.721 161 H LEU 22 H LEU 22 29.964 19.369 -5.201 162 HA LEU 22 HA LEU 22 30.642 22.183 -5.365 163 HB2 LEU 22 HB2 LEU 22 28.067 20.668 -5.551 164 HB3 LEU 22 HB3 LEU 22 28.074 22.387 -5.078 165 HG LEU 22 HG LEU 22 29.533 22.882 -7.088 166 HD11 LEU 22 HD11 LEU 22 28.672 20.089 -7.958 167 HD12 LEU 22 HD12 LEU 22 30.345 20.612 -7.645 168 HD13 LEU 22 HD13 LEU 22 29.437 21.302 -8.997 169 HD21 LEU 22 HD21 LEU 22 27.639 22.942 -8.592 170 HD22 LEU 22 HD22 LEU 22 27.160 23.331 -6.928 171 HD23 LEU 22 HD23 LEU 22 26.787 21.721 -7.594 172 H ALA 23 H ALA 23 29.337 20.209 -2.608 173 HA ALA 23 HA ALA 23 29.026 22.452 -0.885 174 HB1 ALA 23 HB1 ALA 23 28.337 20.242 -0.219 175 HB2 ALA 23 HB2 ALA 23 30.009 19.628 -0.303 176 HB3 ALA 23 HB3 ALA 23 29.551 20.827 0.929 177 H SER 24 H SER 24 31.958 20.603 -1.711 178 HA SER 24 HA SER 24 33.821 22.217 -0.378 179 HB2 SER 24 HB2 SER 24 34.472 20.788 -2.970 180 HB3 SER 24 HB3 SER 24 35.533 21.196 -1.631 181 HG SER 24 HG SER 24 33.392 19.299 -1.600 182 H ILE 25 H ILE 25 32.610 22.714 -3.754 183 HA ILE 25 HA ILE 25 34.327 25.008 -4.080 184 HB ILE 25 HB ILE 25 31.859 24.812 -5.699 185 HG12 ILE 25 HG12 ILE 25 32.533 22.567 -5.970 186 HG13 ILE 25 HG13 ILE 25 33.066 23.421 -7.351 187 HG21 ILE 25 HG21 ILE 25 33.485 25.677 -7.441 188 HG22 ILE 25 HG22 ILE 25 33.288 26.734 -6.054 189 HG23 ILE 25 HG23 ILE 25 34.732 25.716 -6.196 190 HD11 ILE 25 HD11 ILE 25 35.406 23.404 -6.511 191 HD12 ILE 25 HD12 ILE 25 34.851 22.478 -5.087 192 HD13 ILE 25 HD13 ILE 25 34.696 21.781 -6.696 193 H VAL 26 H VAL 26 31.047 24.594 -2.780 194 HA VAL 26 HA VAL 26 30.417 27.423 -2.532 195 HB VAL 26 HB VAL 26 29.478 25.006 -0.957 196 HG11 VAL 26 HG11 VAL 26 29.109 26.950 0.416 197 HG12 VAL 26 HG12 VAL 26 28.495 27.885 -0.960 198 HG13 VAL 26 HG13 VAL 26 27.562 26.516 -0.312 199 HG21 VAL 26 HG21 VAL 26 28.053 26.607 -3.132 200 HG22 VAL 26 HG22 VAL 26 28.766 25.011 -3.424 201 HG23 VAL 26 HG23 VAL 26 27.436 25.170 -2.296 202 H ASP 27 H ASP 27 31.907 25.010 -0.206 203 HA ASP 27 HA ASP 27 32.535 26.903 1.784 204 HB2 ASP 27 HB2 ASP 27 34.138 24.460 0.981 205 HB3 ASP 27 HB3 ASP 27 34.284 25.349 2.493 206 H SER 28 H SER 28 34.615 26.034 -1.025 207 HA SER 28 HA SER 28 36.653 27.856 -0.336 208 HB2 SER 28 HB2 SER 28 37.570 27.672 -2.500 209 HB3 SER 28 HB3 SER 28 36.935 26.085 -2.034 210 HG SER 28 HG SER 28 36.455 26.770 -4.213 211 H ARG 29 H ARG 29 33.605 28.521 -1.830 212 HA ARG 29 HA ARG 29 34.140 31.375 -2.302 213 HB2 ARG 29 HB2 ARG 29 32.625 30.002 -3.727 214 HB3 ARG 29 HB3 ARG 29 31.542 29.776 -2.368 215 HG2 ARG 29 HG2 ARG 29 30.619 31.460 -3.710 216 HG3 ARG 29 HG3 ARG 29 31.207 32.245 -2.249 217 HD2 ARG 29 HD2 ARG 29 33.122 33.136 -3.458 218 HD3 ARG 29 HD3 ARG 29 32.713 32.156 -4.888 219 HE ARG 29 HE ARG 29 30.549 33.943 -4.030 220 HH11 ARG 29 HH11 ARG 29 33.522 33.994 -5.869 221 HH12 ARG 29 HH12 ARG 29 32.959 35.244 -6.943 222 HH21 ARG 29 HH21 ARG 29 29.758 35.336 -5.659 223 HH22 ARG 29 HH22 ARG 29 30.913 36.030 -6.756 224 H LEU 30 H LEU 30 32.488 29.484 0.306 225 HA LEU 30 HA LEU 30 31.667 31.803 1.790 226 HB2 LEU 30 HB2 LEU 30 32.401 29.054 2.847 227 HB3 LEU 30 HB3 LEU 30 31.562 30.315 3.734 228 HG LEU 30 HG LEU 30 30.496 28.862 1.308 229 HD11 LEU 30 HD11 LEU 30 29.508 28.806 4.171 230 HD12 LEU 30 HD12 LEU 30 30.496 27.491 3.479 231 HD13 LEU 30 HD13 LEU 30 28.892 27.850 2.824 232 HD21 LEU 30 HD21 LEU 30 29.177 31.009 2.992 233 HD22 LEU 30 HD22 LEU 30 28.341 29.981 1.806 234 HD23 LEU 30 HD23 LEU 30 29.588 31.098 1.257 235 H ILE 31 H ILE 31 34.711 29.925 1.899 236 HA ILE 31 HA ILE 31 36.089 31.735 3.682 237 HB ILE 31 HB ILE 31 37.078 29.704 1.642 238 HG12 ILE 31 HG12 ILE 31 36.928 29.469 4.688 239 HG13 ILE 31 HG13 ILE 31 35.659 28.876 3.627 240 HG21 ILE 31 HG21 ILE 31 38.641 31.113 3.856 241 HG22 ILE 31 HG22 ILE 31 39.250 29.773 2.864 242 HG23 ILE 31 HG23 ILE 31 38.891 31.311 2.107 243 HD11 ILE 31 HD11 ILE 31 38.512 27.843 3.712 244 HD12 ILE 31 HD12 ILE 31 37.030 27.019 4.211 245 HD13 ILE 31 HD13 ILE 31 37.299 27.371 2.495 246 H GLY 32 H GLY 32 35.682 31.644 0.175 247 HA2 GLY 32 HA2 GLY 32 37.719 33.416 -0.616 248 HA3 GLY 32 HA3 GLY 32 36.278 32.929 -1.546 249 H THR 33 H THR 33 34.274 33.938 0.063 250 HA THR 33 HA THR 33 34.698 36.814 0.363 251 HB THR 33 HB THR 33 34.341 36.542 -2.084 252 HG1 THR 33 HG1 THR 33 32.781 38.133 -2.239 253 HG21 THR 33 HG21 THR 33 32.257 35.866 -3.003 254 HG22 THR 33 HG22 THR 33 31.474 35.782 -1.415 255 HG23 THR 33 HG23 THR 33 32.720 34.592 -1.850 256 H GLY 34 H GLY 34 32.536 33.988 0.745 257 HA2 GLY 34 HA2 GLY 34 31.434 33.718 2.796 258 HA3 GLY 34 HA3 GLY 34 31.228 35.449 2.995 259 H SER 35 H SER 35 30.316 34.414 -0.134 260 HA SER 35 HA SER 35 27.813 33.168 0.422 261 HB2 SER 35 HB2 SER 35 27.215 35.595 0.849 262 HB3 SER 35 HB3 SER 35 27.638 35.929 -0.845 263 HG SER 35 HG SER 35 25.430 35.491 -0.642 264 H VAL 36 H VAL 36 26.812 32.392 -1.568 265 HA VAL 36 HA VAL 36 28.599 32.412 -3.970 266 HB VAL 36 HB VAL 36 28.750 30.313 -2.604 267 HG11 VAL 36 HG11 VAL 36 26.930 28.714 -2.598 268 HG12 VAL 36 HG12 VAL 36 26.395 30.205 -1.806 269 HG13 VAL 36 HG13 VAL 36 25.864 29.839 -3.460 270 HG21 VAL 36 HG21 VAL 36 27.480 29.930 -5.333 271 HG22 VAL 36 HG22 VAL 36 29.179 30.363 -5.060 272 HG23 VAL 36 HG23 VAL 36 28.568 28.807 -4.482 273 H ASP 37 H ASP 37 27.611 32.387 -5.985 274 HA ASP 37 HA ASP 37 24.754 33.139 -6.043 275 HB2 ASP 37 HB2 ASP 37 26.911 34.247 -7.851 276 HB3 ASP 37 HB3 ASP 37 25.294 34.868 -7.563 277 H GLU 38 H GLU 38 23.672 32.654 -8.052 278 HA GLU 38 HA GLU 38 24.035 30.130 -9.054 279 HB2 GLU 38 HB2 GLU 38 22.099 31.893 -9.400 280 HB3 GLU 38 HB3 GLU 38 22.968 32.303 -10.881 281 HG2 GLU 38 HG2 GLU 38 22.904 29.659 -11.258 282 HG3 GLU 38 HG3 GLU 38 21.589 29.731 -10.091 283 H ASP 39 H ASP 39 25.493 33.097 -10.517 284 HA ASP 39 HA ASP 39 26.592 31.822 -12.764 285 HB2 ASP 39 HB2 ASP 39 26.137 34.254 -12.463 286 HB3 ASP 39 HB3 ASP 39 27.511 34.342 -11.356 287 H PHE 40 H PHE 40 27.747 31.832 -9.412 288 HA PHE 40 HA PHE 40 30.474 31.025 -10.190 289 HB2 PHE 40 HB2 PHE 40 29.758 32.353 -8.093 290 HB3 PHE 40 HB3 PHE 40 29.187 30.819 -7.454 291 HD1 PHE 40 HD1 PHE 40 32.169 32.621 -8.809 292 HD2 PHE 40 HD2 PHE 40 30.792 29.272 -6.463 293 HE1 PHE 40 HE1 PHE 40 34.501 32.177 -8.074 294 HE2 PHE 40 HE2 PHE 40 33.120 28.867 -5.698 295 HZ PHE 40 HZ PHE 40 34.975 30.298 -6.512 296 H LEU 41 H LEU 41 27.402 29.457 -9.225 297 HA LEU 41 HA LEU 41 28.597 26.827 -8.969 298 HB2 LEU 41 HB2 LEU 41 25.767 27.933 -8.891 299 HB3 LEU 41 HB3 LEU 41 26.113 26.227 -8.602 300 HG LEU 41 HG LEU 41 27.316 28.500 -6.979 301 HD11 LEU 41 HD11 LEU 41 24.981 26.658 -6.332 302 HD12 LEU 41 HD12 LEU 41 24.882 28.403 -6.672 303 HD13 LEU 41 HD13 LEU 41 25.729 27.833 -5.224 304 HD21 LEU 41 HD21 LEU 41 27.860 26.704 -5.360 305 HD22 LEU 41 HD22 LEU 41 28.688 26.437 -6.887 306 HD23 LEU 41 HD23 LEU 41 27.233 25.496 -6.487 307 H ARG 42 H ARG 42 26.621 28.357 -11.525 308 HA ARG 42 HA ARG 42 26.186 26.078 -13.117 309 HB2 ARG 42 HB2 ARG 42 25.897 27.539 -15.001 310 HB3 ARG 42 HB3 ARG 42 25.115 28.137 -13.547 311 HG2 ARG 42 HG2 ARG 42 26.992 29.736 -13.197 312 HG3 ARG 42 HG3 ARG 42 27.812 29.093 -14.623 313 HD2 ARG 42 HD2 ARG 42 26.781 31.099 -15.230 314 HD3 ARG 42 HD3 ARG 42 25.925 29.804 -16.055 315 HE ARG 42 HE ARG 42 24.175 30.043 -14.181 316 HH11 ARG 42 HH11 ARG 42 26.024 32.924 -15.062 317 HH12 ARG 42 HH12 ARG 42 24.580 33.900 -15.114 318 HH21 ARG 42 HH21 ARG 42 22.461 31.418 -14.026 319 HH22 ARG 42 HH22 ARG 42 22.657 33.103 -14.441 320 H GLU 43 H GLU 43 29.238 27.789 -12.778 321 HA GLU 43 HA GLU 43 30.575 26.395 -14.898 322 HB2 GLU 43 HB2 GLU 43 31.789 27.714 -12.437 323 HB3 GLU 43 HB3 GLU 43 32.605 27.315 -13.959 324 HG2 GLU 43 HG2 GLU 43 30.759 28.797 -15.048 325 HG3 GLU 43 HG3 GLU 43 30.523 29.442 -13.425 326 H GLN 44 H GLN 44 29.618 25.169 -11.771 327 HA GLN 44 HA GLN 44 31.961 23.383 -11.577 328 HB2 GLN 44 HB2 GLN 44 29.767 23.729 -9.538 329 HB3 GLN 44 HB3 GLN 44 31.406 23.129 -9.304 330 HG2 GLN 44 HG2 GLN 44 30.499 25.976 -9.832 331 HG3 GLN 44 HG3 GLN 44 31.185 25.351 -8.349 332 HE21 GLN 44 HE22 GLN 44 32.077 27.648 -9.890 333 HE22 GLN 44 HE21 GLN 44 33.757 27.304 -10.318 334 H ILE 45 H ILE 45 28.360 23.118 -11.448 335 HA ILE 45 HA ILE 45 27.688 20.555 -11.410 336 HB ILE 45 HB ILE 45 26.367 21.139 -13.643 337 HG12 ILE 45 HG12 ILE 45 26.905 23.961 -12.799 338 HG13 ILE 45 HG13 ILE 45 27.589 23.172 -14.234 339 HG21 ILE 45 HG21 ILE 45 25.459 20.874 -11.280 340 HG22 ILE 45 HG22 ILE 45 25.679 22.651 -11.095 341 HG23 ILE 45 HG23 ILE 45 24.546 21.991 -12.296 342 HD11 ILE 45 HD11 ILE 45 24.645 23.728 -13.713 343 HD12 ILE 45 HD12 ILE 45 25.692 24.392 -14.986 344 HD13 ILE 45 HD13 ILE 45 25.251 22.682 -15.024 345 H ARG 46 H ARG 46 29.482 21.492 -13.633 346 HA ARG 46 HA ARG 46 29.824 21.328 -16.213 347 HB2 ARG 46 HB2 ARG 46 31.790 19.886 -16.112 348 HB3 ARG 46 HB3 ARG 46 31.690 20.975 -14.755 349 HG2 ARG 46 HG2 ARG 46 32.512 18.943 -13.899 350 HG3 ARG 46 HG3 ARG 46 30.856 19.054 -13.322 351 HD2 ARG 46 HD2 ARG 46 30.202 17.500 -15.231 352 HD3 ARG 46 HD3 ARG 46 31.909 17.341 -15.612 353 HE ARG 46 HE ARG 46 32.170 15.933 -13.785 354 HH11 ARG 46 HH11 ARG 46 29.020 17.501 -13.271 355 HH12 ARG 46 HH12 ARG 46 28.506 16.145 -12.269 356 HH21 ARG 46 HH21 ARG 46 31.299 14.342 -12.372 357 HH22 ARG 46 HH22 ARG 46 29.649 14.597 -11.793 358 H ASP 47 H ASP 47 27.445 19.441 -15.363 359 HA ASP 47 HA ASP 47 26.954 17.908 -17.691 360 HB2 ASP 47 HB2 ASP 47 28.936 16.540 -17.074 361 HB3 ASP 47 HB3 ASP 47 28.289 16.326 -15.447 362 H ALA 48 H ALA 48 26.604 18.195 -14.191 363 HA ALA 48 HA ALA 48 24.102 16.686 -13.982 364 HB1 ALA 48 HB1 ALA 48 25.476 18.592 -12.035 365 HB2 ALA 48 HB2 ALA 48 24.092 17.544 -11.666 366 HB3 ALA 48 HB3 ALA 48 25.662 16.823 -12.055 367 H ARG 49 H ARG 49 22.061 17.562 -14.078 368 HA ARG 49 HA ARG 49 21.737 19.853 -15.681 369 HB2 ARG 49 HB2 ARG 49 20.069 17.729 -14.662 370 HB3 ARG 49 HB3 ARG 49 19.246 19.225 -14.324 371 HG2 ARG 49 HG2 ARG 49 18.577 18.297 -16.483 372 HG3 ARG 49 HG3 ARG 49 19.301 19.890 -16.654 373 HD2 ARG 49 HD2 ARG 49 19.937 18.193 -18.410 374 HD3 ARG 49 HD3 ARG 49 21.295 19.001 -17.629 375 HE ARG 49 HE ARG 49 21.187 16.764 -16.107 376 HH11 ARG 49 HH11 ARG 49 21.280 17.057 -19.608 377 HH12 ARG 49 HH12 ARG 49 22.097 15.528 -19.774 378 HH21 ARG 49 HH21 ARG 49 22.162 14.931 -16.352 379 HH22 ARG 49 HH22 ARG 49 22.601 14.326 -17.941 380 H TYR 50 H TYR 50 20.620 19.617 -12.212 381 HA TYR 50 HA TYR 50 20.804 22.615 -12.158 382 HB2 TYR 50 HB2 TYR 50 18.774 20.985 -10.656 383 HB3 TYR 50 HB3 TYR 50 18.676 22.656 -11.147 384 HD1 TYR 50 HD2 TYR 50 19.008 22.703 -14.009 385 HD2 TYR 50 HD1 TYR 50 17.086 19.702 -11.599 386 HE1 TYR 50 HE2 TYR 50 17.615 22.050 -15.956 387 HE2 TYR 50 HE1 TYR 50 15.701 19.022 -13.560 388 HH TYR 50 HH TYR 50 15.998 20.620 -16.738 389 H ALA 51 H ALA 51 22.063 23.445 -10.488 390 HA ALA 51 HA ALA 51 22.481 21.725 -8.062 391 HB1 ALA 51 HB1 ALA 51 24.158 24.007 -9.163 392 HB2 ALA 51 HB2 ALA 51 24.407 23.229 -7.586 393 HB3 ALA 51 HB3 ALA 51 24.590 22.281 -9.071 394 H VAL 52 H VAL 52 22.035 22.628 -5.987 395 HA VAL 52 HA VAL 52 20.382 25.108 -5.964 396 HB VAL 52 HB VAL 52 19.449 22.345 -5.138 397 HG11 VAL 52 HG11 VAL 52 18.128 25.036 -4.598 398 HG12 VAL 52 HG12 VAL 52 17.328 23.458 -4.424 399 HG13 VAL 52 HG13 VAL 52 18.689 23.861 -3.383 400 HG21 VAL 52 HG21 VAL 52 17.548 22.841 -6.657 401 HG22 VAL 52 HG22 VAL 52 18.373 24.330 -7.160 402 HG23 VAL 52 HG23 VAL 52 19.091 22.740 -7.494 403 H ILE 53 H ILE 53 20.346 26.188 -4.114 404 HA ILE 53 HA ILE 53 22.346 25.382 -2.046 405 HB ILE 53 HB ILE 53 21.669 27.895 -3.480 406 HG12 ILE 53 HG12 ILE 53 23.666 26.526 -3.989 407 HG13 ILE 53 HG13 ILE 53 24.039 28.194 -3.559 408 HG21 ILE 53 HG21 ILE 53 21.200 28.858 -1.347 409 HG22 ILE 53 HG22 ILE 53 22.610 28.082 -0.602 410 HG23 ILE 53 HG23 ILE 53 22.817 29.368 -1.813 411 HD11 ILE 53 HD11 ILE 53 24.350 25.772 -1.718 412 HD12 ILE 53 HD12 ILE 53 25.637 26.692 -2.504 413 HD13 ILE 53 HD13 ILE 53 24.642 27.448 -1.246 414 H ARG 54 H ARG 54 21.721 24.888 -0.122 415 HA ARG 54 HA ARG 54 19.523 26.423 1.213 416 HB2 ARG 54 HB2 ARG 54 20.438 23.609 1.829 417 HB3 ARG 54 HB3 ARG 54 19.062 24.465 2.506 418 HG2 ARG 54 HG2 ARG 54 19.373 23.441 -0.361 419 HG3 ARG 54 HG3 ARG 54 18.451 22.657 0.907 420 HD2 ARG 54 HD2 ARG 54 17.797 25.405 -0.222 421 HD3 ARG 54 HD3 ARG 54 17.082 23.875 -0.749 422 HE ARG 54 HE ARG 54 16.872 24.436 2.138 423 HH11 ARG 54 HH12 ARG 54 15.179 24.684 -0.925 424 HH12 ARG 54 HH11 ARG 54 13.623 24.813 -0.154 425 HH21 ARG 54 HH21 ARG 54 14.855 24.602 3.049 426 HH22 ARG 54 HH22 ARG 54 13.454 24.774 2.038 427 H ILE 55 H ILE 55 21.437 27.896 1.493 428 HA ILE 55 HA ILE 55 23.337 27.176 3.671 429 HB ILE 55 HB ILE 55 23.056 29.706 2.015 430 HG12 ILE 55 HG12 ILE 55 25.519 27.950 2.286 431 HG13 ILE 55 HG13 ILE 55 24.278 27.554 1.100 432 HG21 ILE 55 HG21 ILE 55 23.662 30.377 4.284 433 HG22 ILE 55 HG22 ILE 55 24.909 29.109 4.379 434 HG23 ILE 55 HG23 ILE 55 25.089 30.488 3.280 435 HD11 ILE 55 HD11 ILE 55 24.607 29.764 0.036 436 HD12 ILE 55 HD12 ILE 55 25.864 30.156 1.234 437 HD13 ILE 55 HD13 ILE 55 26.110 28.813 0.114 438 HA PRO 56 HA PRO 56 20.126 28.673 6.514 439 HB2 PRO 56 HB2 PRO 56 22.504 28.826 8.371 440 HB3 PRO 56 HB3 PRO 56 20.859 28.192 8.691 441 HG2 PRO 56 HG2 PRO 56 22.890 26.478 8.198 442 HG3 PRO 56 HG3 PRO 56 21.298 26.214 7.414 443 HD2 PRO 56 HD2 PRO 56 23.779 27.498 6.234 444 HD3 PRO 56 HD3 PRO 56 22.675 26.273 5.525 445 H GLY 57 H GLY 57 19.405 30.714 7.109 446 HA2 GLY 57 HA2 GLY 57 19.399 32.935 7.613 447 HA3 GLY 57 HA3 GLY 57 21.160 32.940 7.640 448 H GLN 58 H GLN 58 20.344 31.777 4.592 449 HA GLN 58 HA GLN 58 19.867 34.456 3.399 450 HB2 GLN 58 HB2 GLN 58 21.774 34.437 2.063 451 HB3 GLN 58 HB3 GLN 58 22.343 33.829 3.615 452 HG2 GLN 58 HG2 GLN 58 22.349 31.576 2.820 453 HG3 GLN 58 HG3 GLN 58 21.707 32.058 1.241 454 HE21 GLN 58 HE21 GLN 58 23.232 32.513 -0.349 455 HE22 GLN 58 HE22 GLN 58 24.843 33.131 -0.002 456 HA PRO 59 HA PRO 59 17.017 32.463 0.854 457 HB2 PRO 59 HB2 PRO 59 17.035 33.784 -1.548 458 HB3 PRO 59 HB3 PRO 59 16.479 34.516 -0.011 459 HG2 PRO 59 HG2 PRO 59 19.221 34.748 -1.294 460 HG3 PRO 59 HG3 PRO 59 18.179 36.066 -0.667 461 HD2 PRO 59 HD2 PRO 59 20.178 35.028 0.809 462 HD3 PRO 59 HD3 PRO 59 18.626 35.474 1.580 463 H VAL 60 H VAL 60 16.606 30.878 -0.578 464 HA VAL 60 HA VAL 60 18.652 29.131 -1.493 465 HB VAL 60 HB VAL 60 15.702 29.330 -2.232 466 HG11 VAL 60 HG11 VAL 60 17.576 26.976 -2.723 467 HG12 VAL 60 HG12 VAL 60 15.816 26.973 -2.924 468 HG13 VAL 60 HG13 VAL 60 16.812 27.989 -3.961 469 HG21 VAL 60 HG21 VAL 60 17.180 27.589 -0.214 470 HG22 VAL 60 HG22 VAL 60 16.061 28.913 0.161 471 HG23 VAL 60 HG23 VAL 60 15.451 27.455 -0.620 472 H VAL 61 H VAL 61 19.807 29.025 -3.244 473 HA VAL 61 HA VAL 61 19.097 30.565 -5.719 474 HB VAL 61 HB VAL 61 21.824 29.501 -4.882 475 HG11 VAL 61 HG11 VAL 61 22.683 30.780 -6.782 476 HG12 VAL 61 HG12 VAL 61 21.617 29.489 -7.320 477 HG13 VAL 61 HG13 VAL 61 21.022 31.171 -7.290 478 HG21 VAL 61 HG21 VAL 61 20.777 32.357 -5.019 479 HG22 VAL 61 HG22 VAL 61 21.184 31.465 -3.538 480 HG23 VAL 61 HG23 VAL 61 22.457 31.876 -4.686 481 H GLU 62 H GLU 62 19.001 29.429 -7.728 482 HA GLU 62 HA GLU 62 19.187 26.478 -7.638 483 HB2 GLU 62 HB2 GLU 62 16.768 28.018 -8.678 484 HB3 GLU 62 HB3 GLU 62 17.052 26.282 -8.833 485 HG2 GLU 62 HG2 GLU 62 16.966 26.070 -6.347 486 HG3 GLU 62 HG3 GLU 62 16.630 27.800 -6.229 487 H VAL 63 H VAL 63 20.636 26.039 -9.210 488 HA VAL 63 HA VAL 63 21.138 27.857 -11.452 489 HB VAL 63 HB VAL 63 22.390 25.189 -10.739 490 HG11 VAL 63 HG11 VAL 63 23.002 25.835 -12.988 491 HG12 VAL 63 HG12 VAL 63 23.355 27.498 -12.434 492 HG13 VAL 63 HG13 VAL 63 24.371 26.131 -11.915 493 HG21 VAL 63 HG21 VAL 63 23.420 27.926 -9.916 494 HG22 VAL 63 HG22 VAL 63 22.685 26.751 -8.806 495 HG23 VAL 63 HG23 VAL 63 24.176 26.349 -9.637 496 H GLY 64 H GLY 64 21.068 27.163 -13.717 497 HA2 GLY 64 HA2 GLY 64 20.307 25.989 -15.521 498 HA3 GLY 64 HA3 GLY 64 20.038 24.605 -14.475 499 H THR 65 H THR 65 17.928 24.274 -13.580 500 HA THR 65 HA THR 65 15.708 26.026 -14.279 501 HB THR 65 HB THR 65 15.484 23.222 -15.411 502 HG1 THR 65 HG1 THR 65 15.880 24.138 -17.460 503 HG21 THR 65 HG21 THR 65 14.039 25.842 -16.001 504 HG22 THR 65 HG22 THR 65 13.366 24.405 -15.192 505 HG23 THR 65 HG23 THR 65 13.793 24.326 -16.895 506 H LYS 66 H LYS 66 13.731 25.355 -13.136 507 HA LYS 66 HA LYS 66 14.117 23.734 -10.803 508 HB2 LYS 66 HB2 LYS 66 12.551 25.645 -10.912 509 HB3 LYS 66 HB3 LYS 66 11.549 24.771 -12.083 510 HG2 LYS 66 HG2 LYS 66 11.105 23.013 -10.370 511 HG3 LYS 66 HG3 LYS 66 12.108 23.904 -9.209 512 HD2 LYS 66 HD2 LYS 66 10.561 25.835 -9.352 513 HD3 LYS 66 HD3 LYS 66 9.575 24.961 -10.548 514 HE2 LYS 66 HE2 LYS 66 9.158 23.161 -8.875 515 HE3 LYS 66 HE3 LYS 66 10.121 24.047 -7.683 516 HZ1 LYS 66 HZ1 LYS 66 7.607 25.046 -8.929 517 HZ2 LYS 66 HZ2 LYS 66 8.497 25.868 -7.828 518 HZ3 LYS 66 HZ3 LYS 66 7.746 24.482 -7.404 519 HA PRO 67 HA PRO 67 13.328 19.808 -12.862 520 HB2 PRO 67 HB2 PRO 67 13.367 18.138 -10.712 521 HB3 PRO 67 HB3 PRO 67 14.845 18.919 -11.358 522 HG2 PRO 67 HG2 PRO 67 13.143 19.777 -9.003 523 HG3 PRO 67 HG3 PRO 67 14.930 19.661 -9.137 524 HD2 PRO 67 HD2 PRO 67 13.564 22.016 -9.466 525 HD3 PRO 67 HD3 PRO 67 15.085 21.645 -10.343 526 H THR 68 H THR 68 11.746 18.336 -13.174 527 HA THR 68 HA THR 68 9.110 19.105 -12.517 528 HB THR 68 HB THR 68 9.829 18.316 -14.706 529 HG1 THR 68 HG1 THR 68 7.978 17.129 -15.122 530 HG21 THR 68 HG21 THR 68 10.081 15.996 -15.267 531 HG22 THR 68 HG22 THR 68 9.686 15.476 -13.621 532 HG23 THR 68 HG23 THR 68 11.216 16.327 -13.951 533 H GLY 69 H GLY 69 10.994 16.426 -11.299 534 HA2 GLY 69 HA2 GLY 69 10.168 15.771 -8.904 535 HA3 GLY 69 HA3 GLY 69 8.679 15.326 -9.762 536 H ASP 70 H ASP 70 9.903 14.306 -12.102 537 HA ASP 70 HA ASP 70 10.865 11.665 -11.302 538 HB2 ASP 70 HB2 ASP 70 10.566 12.887 -14.051 539 HB3 ASP 70 HB3 ASP 70 10.788 11.168 -13.677 540 H VAL 71 H VAL 71 12.648 12.954 -10.108 541 HA VAL 71 HA VAL 71 15.088 13.125 -11.763 542 HB VAL 71 HB VAL 71 15.761 15.205 -10.683 543 HG11 VAL 71 HG11 VAL 71 13.041 15.770 -11.944 544 HG12 VAL 71 HG12 VAL 71 14.547 16.689 -12.044 545 HG13 VAL 71 HG13 VAL 71 14.415 15.157 -12.882 546 HG21 VAL 71 HG21 VAL 71 14.290 16.585 -9.377 547 HG22 VAL 71 HG22 VAL 71 12.963 15.409 -9.509 548 HG23 VAL 71 HG23 VAL 71 14.431 15.025 -8.587 549 H LEU 72 H LEU 72 17.030 13.082 -10.662 550 HA LEU 72 HA LEU 72 17.182 11.356 -8.236 551 HB2 LEU 72 HB2 LEU 72 19.206 12.350 -10.295 552 HB3 LEU 72 HB3 LEU 72 19.632 11.297 -8.949 553 HG LEU 72 HG LEU 72 17.482 10.543 -10.919 554 HD11 LEU 72 HD11 LEU 72 19.185 9.285 -12.223 555 HD12 LEU 72 HD12 LEU 72 20.472 10.031 -11.243 556 HD13 LEU 72 HD13 LEU 72 19.442 11.029 -12.293 557 HD21 LEU 72 HD21 LEU 72 17.750 9.235 -8.809 558 HD22 LEU 72 HD22 LEU 72 19.440 8.915 -9.245 559 HD23 LEU 72 HD23 LEU 72 18.121 8.249 -10.242 560 H GLN 73 H GLN 73 17.918 12.243 -6.207 561 HA GLN 73 HA GLN 73 18.840 15.073 -6.287 562 HB2 GLN 73 HB2 GLN 73 17.262 13.416 -4.308 563 HB3 GLN 73 HB3 GLN 73 17.909 15.032 -3.984 564 HG2 GLN 73 HG2 GLN 73 16.633 15.831 -6.050 565 HG3 GLN 73 HG3 GLN 73 15.805 14.280 -6.058 566 HE21 GLN 73 HE21 GLN 73 15.005 17.251 -5.419 567 HE22 GLN 73 HE22 GLN 73 14.150 17.083 -3.882 568 H GLY 74 H GLY 74 20.972 15.207 -6.095 569 HA2 GLY 74 HA2 GLY 74 22.573 13.433 -4.298 570 HA3 GLY 74 HA3 GLY 74 23.182 14.660 -5.421 571 H ARG 75 H ARG 75 23.824 14.500 -2.558 572 HA ARG 75 HA ARG 75 22.897 17.139 -1.640 573 HB2 ARG 75 HB2 ARG 75 21.101 15.439 -1.013 574 HB3 ARG 75 HB3 ARG 75 22.278 14.691 0.067 575 HG2 ARG 75 HG2 ARG 75 22.421 16.823 1.357 576 HG3 ARG 75 HG3 ARG 75 21.309 17.589 0.203 577 HD2 ARG 75 HD2 ARG 75 19.553 15.960 0.798 578 HD3 ARG 75 HD3 ARG 75 20.633 15.173 1.947 579 HE ARG 75 HE ARG 75 19.173 17.690 2.267 580 HH11 ARG 75 HH11 ARG 75 21.861 15.851 3.594 581 HH12 ARG 75 HH12 ARG 75 21.791 16.690 5.117 582 HH21 ARG 75 HH21 ARG 75 19.115 18.668 4.259 583 HH22 ARG 75 HH22 ARG 75 20.282 18.246 5.473 584 H ALA 76 H ALA 76 24.033 17.888 0.256 585 HA ALA 76 HA ALA 76 26.245 16.437 1.395 586 HB1 ALA 76 HB1 ALA 76 28.087 17.861 0.443 587 HB2 ALA 76 HB2 ALA 76 27.297 16.845 -0.771 588 HB3 ALA 76 HB3 ALA 76 26.894 18.567 -0.684 589 H THR 77 H THR 77 27.655 17.885 2.803 590 HA THR 77 HA THR 77 26.221 20.297 3.855 591 HB THR 77 HB THR 77 27.306 17.978 5.495 592 HG1 THR 77 HG1 THR 77 25.154 17.780 6.125 593 HG21 THR 77 HG21 THR 77 27.687 20.137 6.666 594 HG22 THR 77 HG22 THR 77 26.449 19.170 7.467 595 HG23 THR 77 HG23 THR 77 25.975 20.551 6.461 596 H GLY 78 H GLY 78 27.661 21.871 3.359 597 HA2 GLY 78 HA2 GLY 78 30.470 21.514 3.179 598 HA3 GLY 78 HA3 GLY 78 29.603 23.037 3.168 599 H GLU 79 H GLU 79 32.047 22.842 4.203 600 HA GLU 79 HA GLU 79 32.297 22.206 6.977 601 HB2 GLU 79 HB2 GLU 79 34.079 23.792 5.083 602 HB3 GLU 79 HB3 GLU 79 34.527 23.355 6.735 603 HG2 GLU 79 HG2 GLU 79 34.187 20.939 6.171 604 HG3 GLU 79 HG3 GLU 79 33.927 21.393 4.486 605 H GLU 80 H GLU 80 30.681 24.965 5.717 606 HA GLU 80 HA GLU 80 31.276 26.466 8.276 607 HB2 GLU 80 HB2 GLU 80 29.937 27.456 5.789 608 HB3 GLU 80 HB3 GLU 80 30.379 28.423 7.190 609 HG2 GLU 80 HG2 GLU 80 32.326 27.074 5.247 610 HG3 GLU 80 HG3 GLU 80 31.883 28.744 5.342 611 H GLY 81 H GLY 81 29.276 24.137 7.228 612 HA2 GLY 81 HA2 GLY 81 27.538 23.295 8.427 613 HA3 GLY 81 HA3 GLY 81 27.173 24.876 9.106 614 H GLU 82 H GLU 82 27.447 24.544 5.592 615 HA GLU 82 HA GLU 82 24.644 25.286 5.294 616 HB2 GLU 82 HB2 GLU 82 25.313 26.000 3.132 617 HB3 GLU 82 HB3 GLU 82 26.498 26.563 4.304 618 HG2 GLU 82 HG2 GLU 82 27.807 25.889 2.500 619 HG3 GLU 82 HG3 GLU 82 27.940 24.539 3.621 620 H THR 83 H THR 83 24.044 24.363 2.725 621 HA THR 83 HA THR 83 24.421 21.510 2.664 622 HB THR 83 HB THR 83 21.695 22.639 3.306 623 HG1 THR 83 HG1 THR 83 23.541 21.605 4.662 624 HG21 THR 83 HG21 THR 83 20.781 20.375 2.917 625 HG22 THR 83 HG22 THR 83 22.319 19.886 2.159 626 HG23 THR 83 HG23 THR 83 21.292 21.139 1.412 627 H VAL 84 H VAL 84 24.872 21.084 0.746 628 HA VAL 84 HA VAL 84 23.727 22.554 -1.600 629 HB VAL 84 HB VAL 84 26.063 20.641 -1.331 630 HG11 VAL 84 HG11 VAL 84 24.917 21.708 -3.952 631 HG12 VAL 84 HG12 VAL 84 26.486 20.901 -3.745 632 HG13 VAL 84 HG13 VAL 84 25.014 19.994 -3.460 633 HG21 VAL 84 HG21 VAL 84 25.714 23.522 -2.267 634 HG22 VAL 84 HG22 VAL 84 26.527 22.954 -0.796 635 HG23 VAL 84 HG23 VAL 84 27.236 22.621 -2.376 636 H LEU 85 H LEU 85 22.575 21.640 -3.210 637 HA LEU 85 HA LEU 85 21.840 18.787 -3.044 638 HB2 LEU 85 HB2 LEU 85 19.994 20.127 -2.041 639 HB3 LEU 85 HB3 LEU 85 19.928 21.097 -3.493 640 HG LEU 85 HG LEU 85 19.426 18.797 -4.713 641 HD11 LEU 85 HD11 LEU 85 19.892 17.466 -2.544 642 HD12 LEU 85 HD12 LEU 85 18.389 17.111 -3.412 643 HD13 LEU 85 HD13 LEU 85 18.371 18.119 -1.941 644 HD21 LEU 85 HD21 LEU 85 17.016 19.030 -4.209 645 HD22 LEU 85 HD22 LEU 85 17.792 20.585 -4.553 646 HD23 LEU 85 HD23 LEU 85 17.410 20.138 -2.876 647 H VAL 86 H VAL 86 21.603 17.897 -5.012 648 HA VAL 86 HA VAL 86 22.011 19.503 -7.514 649 HB VAL 86 HB VAL 86 23.483 16.858 -7.168 650 HG11 VAL 86 HG11 VAL 86 24.541 17.468 -9.285 651 HG12 VAL 86 HG12 VAL 86 22.803 17.218 -9.465 652 HG13 VAL 86 HG13 VAL 86 23.463 18.876 -9.428 653 HG21 VAL 86 HG21 VAL 86 24.573 18.656 -5.837 654 HG22 VAL 86 HG22 VAL 86 25.542 18.213 -7.249 655 HG23 VAL 86 HG23 VAL 86 24.575 19.710 -7.266 656 H GLU 87 H GLU 87 20.776 18.808 -9.286 657 HA GLU 87 HA GLU 87 19.012 16.506 -8.782 658 HB2 GLU 87 HB2 GLU 87 17.934 19.248 -9.452 659 HB3 GLU 87 HB3 GLU 87 17.013 17.738 -9.332 660 HG2 GLU 87 HG2 GLU 87 17.898 17.538 -6.934 661 HG3 GLU 87 HG3 GLU 87 18.510 19.178 -7.095 662 H GLU 88 H GLU 88 18.715 15.311 -10.366 663 HA GLU 88 HA GLU 88 19.634 16.006 -13.148 664 HB2 GLU 88 HB2 GLU 88 20.453 13.947 -11.179 665 HB3 GLU 88 HB3 GLU 88 20.206 13.317 -12.815 666 HG2 GLU 88 HG2 GLU 88 22.103 15.567 -12.090 667 HG3 GLU 88 HG3 GLU 88 22.528 13.853 -12.219 668 HA PRO 89 HA PRO 89 15.702 14.095 -14.335 669 HB2 PRO 89 HB2 PRO 89 16.191 13.421 -16.954 670 HB3 PRO 89 HB3 PRO 89 15.849 15.088 -16.394 671 HG2 PRO 89 HG2 PRO 89 18.561 13.817 -16.898 672 HG3 PRO 89 HG3 PRO 89 17.961 15.412 -17.465 673 HD2 PRO 89 HD2 PRO 89 19.514 15.164 -15.268 674 HD3 PRO 89 HD3 PRO 89 18.168 16.347 -15.296 675 H ARG 90 H ARG 90 14.913 12.127 -14.152 676 HA ARG 90 HA ARG 90 16.678 9.769 -13.869 677 HB2 ARG 90 HB2 ARG 90 14.870 10.174 -12.210 678 HB3 ARG 90 HB3 ARG 90 13.665 9.952 -13.493 679 HG2 ARG 90 HG2 ARG 90 14.442 7.654 -13.879 680 HG3 ARG 90 HG3 ARG 90 15.744 7.860 -12.696 681 HD2 ARG 90 HD2 ARG 90 14.125 8.091 -10.891 682 HD3 ARG 90 HD3 ARG 90 12.778 8.035 -12.041 683 HE ARG 90 HE ARG 90 13.684 5.729 -12.685 684 HH11 ARG 90 HH22 ARG 90 13.905 6.834 -9.340 685 HH12 ARG 90 HH21 ARG 90 14.002 5.175 -8.765 686 HH21 ARG 90 HH11 ARG 90 13.835 3.701 -11.807 687 HH22 ARG 90 HH12 ARG 90 13.972 3.533 -10.066 Start of MODEL 15 1 H1 GLY 1 H1 GLY 1 4.608 -10.537 -3.946 2 H2 GLY 1 H2 GLY 1 3.522 -11.403 -3.078 3 H3 GLY 1 H3 GLY 1 4.779 -12.163 -3.801 4 HA2 GLY 1 HA2 GLY 1 5.001 -10.216 -1.592 5 HA3 GLY 1 HA3 GLY 1 5.145 -11.975 -1.415 6 H SER 2 H SER 2 7.120 -10.061 -0.660 7 HA SER 2 HA SER 2 9.307 -9.533 -0.784 8 HB2 SER 2 HB2 SER 2 9.591 -12.218 -2.158 9 HB3 SER 2 HB3 SER 2 10.868 -11.311 -1.329 10 HG SER 2 HG SER 2 9.916 -12.916 0.006 11 H GLU 3 H GLU 3 7.903 -8.246 -2.777 12 HA GLU 3 HA GLU 3 9.538 -8.335 -5.246 13 HB2 GLU 3 HB2 GLU 3 6.880 -7.046 -4.542 14 HB3 GLU 3 HB3 GLU 3 7.688 -6.782 -6.094 15 HG2 GLU 3 HG2 GLU 3 7.480 -9.027 -6.770 16 HG3 GLU 3 HG3 GLU 3 7.140 -9.599 -5.143 17 H THR 4 H THR 4 10.975 -7.470 -3.143 18 HA THR 4 HA THR 4 11.135 -4.798 -2.558 19 HB THR 4 HB THR 4 13.507 -6.686 -2.821 20 HG1 THR 4 HG1 THR 4 12.943 -7.288 -0.711 21 HG21 THR 4 HG21 THR 4 14.308 -5.501 -0.770 22 HG22 THR 4 HG22 THR 4 12.945 -4.367 -0.911 23 HG23 THR 4 HG23 THR 4 14.211 -4.426 -2.164 24 H ARG 5 H ARG 5 12.278 -3.038 -3.217 25 HA ARG 5 HA ARG 5 13.993 -3.065 -5.589 26 HB2 ARG 5 HB2 ARG 5 12.839 -1.529 -6.939 27 HB3 ARG 5 HB3 ARG 5 11.702 -2.800 -6.561 28 HG2 ARG 5 HG2 ARG 5 11.775 -0.016 -5.300 29 HG3 ARG 5 HG3 ARG 5 10.704 -0.538 -6.586 30 HD2 ARG 5 HD2 ARG 5 10.691 -1.588 -3.730 31 HD3 ARG 5 HD3 ARG 5 9.545 -0.462 -4.423 32 HE ARG 5 HE ARG 5 9.667 -3.380 -4.864 33 HH11 ARG 5 HH21 ARG 5 8.188 -0.422 -6.066 34 HH12 ARG 5 HH22 ARG 5 6.917 -1.304 -6.865 35 HH21 ARG 5 HH11 ARG 5 8.105 -4.391 -5.852 36 HH22 ARG 5 HH12 ARG 5 6.860 -3.539 -6.753 37 H THR 6 H THR 6 15.178 -1.144 -5.950 38 HA THR 6 HA THR 6 15.106 1.060 -4.029 39 HB THR 6 HB THR 6 16.461 -0.645 -2.836 40 HG1 THR 6 HG1 THR 6 18.121 0.777 -2.382 41 HG21 THR 6 HG21 THR 6 18.528 -0.266 -5.050 42 HG22 THR 6 HG22 THR 6 17.575 -1.743 -4.783 43 HG23 THR 6 HG23 THR 6 18.718 -1.196 -3.550 44 H ILE 7 H ILE 7 16.610 2.835 -4.675 45 HA ILE 7 HA ILE 7 16.641 3.063 -7.610 46 HB ILE 7 HB ILE 7 17.611 5.111 -5.637 47 HG12 ILE 7 HG12 ILE 7 14.812 4.750 -6.816 48 HG13 ILE 7 HG13 ILE 7 15.253 4.576 -5.117 49 HG21 ILE 7 HG21 ILE 7 17.303 6.687 -7.505 50 HG22 ILE 7 HG22 ILE 7 18.366 5.386 -8.010 51 HG23 ILE 7 HG23 ILE 7 16.667 5.381 -8.529 52 HD11 ILE 7 HD11 ILE 7 15.222 7.155 -6.712 53 HD12 ILE 7 HD12 ILE 7 14.188 6.689 -5.354 54 HD13 ILE 7 HD13 ILE 7 15.915 6.999 -5.075 55 H SER 8 H SER 8 18.223 2.301 -8.693 56 HA SER 8 HA SER 8 20.434 1.079 -8.145 57 HB2 SER 8 HB2 SER 8 20.286 2.995 -10.503 58 HB3 SER 8 HB3 SER 8 21.302 1.546 -10.384 59 HG SER 8 HG SER 8 19.349 1.139 -11.519 60 H SER 9 H SER 9 22.224 1.467 -6.899 61 HA SER 9 HA SER 9 23.653 3.839 -6.680 62 HB2 SER 9 HB2 SER 9 24.695 1.003 -6.380 63 HB3 SER 9 HB3 SER 9 25.402 2.473 -5.686 64 HG SER 9 HG SER 9 24.086 1.387 -4.175 65 H THR 10 H THR 10 23.506 4.389 -9.027 66 HA THR 10 HA THR 10 26.045 4.086 -10.388 67 HB THR 10 HB THR 10 24.901 3.782 -12.592 68 HG1 THR 10 HG1 THR 10 22.904 2.667 -12.532 69 HG21 THR 10 HG21 THR 10 26.127 1.909 -11.453 70 HG22 THR 10 HG22 THR 10 24.817 1.350 -12.510 71 HG23 THR 10 HG23 THR 10 24.582 1.383 -10.747 72 H ALA 11 H ALA 11 22.976 5.280 -11.670 73 HA ALA 11 HA ALA 11 23.978 7.928 -12.138 74 HB1 ALA 11 HB1 ALA 11 22.249 6.860 -13.526 75 HB2 ALA 11 HB2 ALA 11 21.113 6.879 -12.157 76 HB3 ALA 11 HB3 ALA 11 21.676 8.405 -12.872 77 H GLN 12 H GLN 12 21.625 6.711 -9.652 78 HA GLN 12 HA GLN 12 21.414 9.258 -8.323 79 HB2 GLN 12 HB2 GLN 12 19.730 7.528 -8.089 80 HB3 GLN 12 HB3 GLN 12 20.897 6.411 -7.392 81 HG2 GLN 12 HG2 GLN 12 19.382 7.361 -5.698 82 HG3 GLN 12 HG3 GLN 12 21.072 7.689 -5.367 83 HE21 GLN 12 HE21 GLN 12 20.504 9.471 -3.970 84 HE22 GLN 12 HE22 GLN 12 19.964 10.994 -4.674 85 H GLU 13 H GLU 13 23.852 6.725 -8.116 86 HA GLU 13 HA GLU 13 25.032 7.656 -5.623 87 HB2 GLU 13 HB2 GLU 13 25.254 5.324 -6.504 88 HB3 GLU 13 HB3 GLU 13 26.237 5.934 -7.826 89 HG2 GLU 13 HG2 GLU 13 27.786 5.105 -6.313 90 HG3 GLU 13 HG3 GLU 13 27.844 6.834 -6.012 91 H ARG 14 H ARG 14 26.237 7.916 -9.000 92 HA ARG 14 HA ARG 14 28.287 9.718 -8.398 93 HB2 ARG 14 HB2 ARG 14 28.399 10.400 -10.719 94 HB3 ARG 14 HB3 ARG 14 28.347 8.658 -10.531 95 HG2 ARG 14 HG2 ARG 14 26.459 8.432 -11.737 96 HG3 ARG 14 HG3 ARG 14 25.668 9.836 -11.020 97 HD2 ARG 14 HD2 ARG 14 27.897 10.213 -13.019 98 HD3 ARG 14 HD3 ARG 14 26.260 9.847 -13.552 99 HE ARG 14 HE ARG 14 27.056 12.271 -11.949 100 HH11 ARG 14 HH22 ARG 14 24.498 10.785 -13.931 101 HH12 ARG 14 HH21 ARG 14 23.573 12.275 -13.818 102 HH21 ARG 14 HH12 ARG 14 25.913 14.039 -12.132 103 HH22 ARG 14 HH11 ARG 14 24.344 14.006 -12.950 104 H VAL 15 H VAL 15 24.927 10.530 -9.172 105 HA VAL 15 HA VAL 15 25.118 13.371 -9.127 106 HB VAL 15 HB VAL 15 22.895 11.412 -8.459 107 HG11 VAL 15 HG11 VAL 15 22.678 14.399 -8.318 108 HG12 VAL 15 HG12 VAL 15 21.292 13.297 -8.560 109 HG13 VAL 15 HG13 VAL 15 22.288 13.130 -7.117 110 HG21 VAL 15 HG21 VAL 15 21.949 12.223 -10.568 111 HG22 VAL 15 HG22 VAL 15 23.224 13.457 -10.695 112 HG23 VAL 15 HG23 VAL 15 23.620 11.735 -10.861 113 H ASP 16 H ASP 16 25.175 11.069 -6.439 114 HA ASP 16 HA ASP 16 24.734 13.211 -4.464 115 HB2 ASP 16 HB2 ASP 16 24.087 10.718 -4.250 116 HB3 ASP 16 HB3 ASP 16 25.791 10.445 -3.864 117 H LEU 17 H LEU 17 27.591 11.557 -5.818 118 HA LEU 17 HA LEU 17 29.470 12.661 -3.957 119 HB2 LEU 17 HB2 LEU 17 29.734 11.226 -6.603 120 HB3 LEU 17 HB3 LEU 17 31.099 12.033 -5.845 121 HG LEU 17 HG LEU 17 30.466 10.726 -3.674 122 HD11 LEU 17 HD11 LEU 17 28.323 9.762 -4.400 123 HD12 LEU 17 HD12 LEU 17 29.504 8.487 -4.103 124 HD13 LEU 17 HD13 LEU 17 29.127 8.969 -5.772 125 HD21 LEU 17 HD21 LEU 17 31.644 9.348 -6.103 126 HD22 LEU 17 HD22 LEU 17 31.865 8.853 -4.402 127 HD23 LEU 17 HD23 LEU 17 32.486 10.418 -4.952 128 H GLU 18 H GLU 18 28.449 13.675 -7.197 129 HA GLU 18 HA GLU 18 30.071 16.057 -7.261 130 HB2 GLU 18 HB2 GLU 18 28.548 16.821 -9.054 131 HB3 GLU 18 HB3 GLU 18 29.246 15.221 -9.292 132 HG2 GLU 18 HG2 GLU 18 27.003 14.348 -8.246 133 HG3 GLU 18 HG3 GLU 18 26.392 15.921 -8.589 134 H ALA 19 H ALA 19 26.940 15.412 -5.620 135 HA ALA 19 HA ALA 19 26.450 18.188 -4.966 136 HB1 ALA 19 HB1 ALA 19 25.617 15.736 -3.401 137 HB2 ALA 19 HB2 ALA 19 24.831 17.323 -3.475 138 HB3 ALA 19 HB3 ALA 19 24.834 16.259 -4.906 139 H VAL 20 H VAL 20 28.458 15.640 -3.485 140 HA VAL 20 HA VAL 20 29.274 17.269 -1.155 141 HB VAL 20 HB VAL 20 30.457 14.738 -2.353 142 HG11 VAL 20 HG11 VAL 20 32.216 15.878 -1.072 143 HG12 VAL 20 HG12 VAL 20 31.095 16.132 0.286 144 HG13 VAL 20 HG13 VAL 20 31.619 14.493 -0.160 145 HG21 VAL 20 HG21 VAL 20 28.178 14.457 -1.378 146 HG22 VAL 20 HG22 VAL 20 29.410 13.621 -0.435 147 HG23 VAL 20 HG23 VAL 20 28.754 15.167 0.142 148 H ARG 21 H ARG 21 30.697 16.614 -4.388 149 HA ARG 21 HA ARG 21 32.976 18.257 -4.077 150 HB2 ARG 21 HB2 ARG 21 32.519 16.693 -5.976 151 HB3 ARG 21 HB3 ARG 21 31.320 17.817 -6.604 152 HG2 ARG 21 HG2 ARG 21 33.473 17.958 -7.789 153 HG3 ARG 21 HG3 ARG 21 32.980 19.488 -7.075 154 HD2 ARG 21 HD2 ARG 21 35.399 19.082 -6.837 155 HD3 ARG 21 HD3 ARG 21 34.597 19.245 -5.270 156 HE ARG 21 HE ARG 21 34.781 16.468 -6.114 157 HH11 ARG 21 HH11 ARG 21 36.800 18.987 -4.754 158 HH12 ARG 21 HH12 ARG 21 37.836 17.849 -3.939 159 HH21 ARG 21 HH21 ARG 21 36.134 15.065 -5.039 160 HH22 ARG 21 HH22 ARG 21 37.472 15.682 -4.117 161 H LEU 22 H LEU 22 29.676 19.292 -5.130 162 HA LEU 22 HA LEU 22 30.436 22.099 -5.175 163 HB2 LEU 22 HB2 LEU 22 27.800 20.677 -5.424 164 HB3 LEU 22 HB3 LEU 22 27.896 22.412 -5.056 165 HG LEU 22 HG LEU 22 29.480 22.681 -7.030 166 HD11 LEU 22 HD11 LEU 22 29.270 21.044 -8.866 167 HD12 LEU 22 HD12 LEU 22 28.376 19.949 -7.798 168 HD13 LEU 22 HD13 LEU 22 30.085 20.332 -7.472 169 HD21 LEU 22 HD21 LEU 22 27.646 22.817 -8.616 170 HD22 LEU 22 HD22 LEU 22 27.186 23.396 -7.004 171 HD23 LEU 22 HD23 LEU 22 26.639 21.789 -7.549 172 H ALA 23 H ALA 23 29.076 20.070 -2.503 173 HA ALA 23 HA ALA 23 28.861 22.275 -0.708 174 HB1 ALA 23 HB1 ALA 23 29.710 19.400 -0.174 175 HB2 ALA 23 HB2 ALA 23 29.178 20.570 1.056 176 HB3 ALA 23 HB3 ALA 23 28.048 20.036 -0.204 177 H SER 24 H SER 24 31.729 20.452 -1.757 178 HA SER 24 HA SER 24 33.622 21.960 -0.208 179 HB2 SER 24 HB2 SER 24 34.231 20.478 -2.784 180 HB3 SER 24 HB3 SER 24 35.327 20.901 -1.474 181 HG SER 24 HG SER 24 33.137 19.063 -1.342 182 H ILE 25 H ILE 25 32.456 22.483 -3.655 183 HA ILE 25 HA ILE 25 34.243 24.714 -3.920 184 HB ILE 25 HB ILE 25 31.764 24.644 -5.577 185 HG12 ILE 25 HG12 ILE 25 32.359 22.362 -5.854 186 HG13 ILE 25 HG13 ILE 25 32.922 23.236 -7.220 187 HG21 ILE 25 HG21 ILE 25 33.353 25.548 -7.227 188 HG22 ILE 25 HG22 ILE 25 33.440 26.487 -5.748 189 HG23 ILE 25 HG23 ILE 25 34.704 25.318 -6.114 190 HD11 ILE 25 HD11 ILE 25 34.486 21.513 -6.570 191 HD12 ILE 25 HD12 ILE 25 35.245 23.112 -6.431 192 HD13 ILE 25 HD13 ILE 25 34.696 22.235 -4.972 193 H VAL 26 H VAL 26 30.895 24.458 -2.716 194 HA VAL 26 HA VAL 26 30.364 27.291 -2.409 195 HB VAL 26 HB VAL 26 29.325 24.857 -0.935 196 HG11 VAL 26 HG11 VAL 26 28.948 26.794 0.485 197 HG12 VAL 26 HG12 VAL 26 28.307 27.725 -0.890 198 HG13 VAL 26 HG13 VAL 26 27.426 26.307 -0.258 199 HG21 VAL 26 HG21 VAL 26 27.954 26.587 -3.052 200 HG22 VAL 26 HG22 VAL 26 28.725 25.042 -3.447 201 HG23 VAL 26 HG23 VAL 26 27.347 25.069 -2.359 202 H ASP 27 H ASP 27 31.652 24.809 0.026 203 HA ASP 27 HA ASP 27 32.331 26.652 2.015 204 HB2 ASP 27 HB2 ASP 27 32.627 24.294 2.367 205 HB3 ASP 27 HB3 ASP 27 33.793 24.176 1.046 206 H SER 28 H SER 28 34.252 25.883 -0.906 207 HA SER 28 HA SER 28 36.466 27.605 -0.344 208 HB2 SER 28 HB2 SER 28 35.389 26.890 -3.100 209 HB3 SER 28 HB3 SER 28 37.008 27.456 -2.693 210 HG SER 28 HG SER 28 35.800 25.000 -1.861 211 H ARG 29 H ARG 29 33.291 28.332 -1.793 212 HA ARG 29 HA ARG 29 33.888 31.154 -2.268 213 HB2 ARG 29 HB2 ARG 29 32.169 29.706 -3.484 214 HB3 ARG 29 HB3 ARG 29 31.161 29.796 -2.054 215 HG2 ARG 29 HG2 ARG 29 30.403 31.407 -3.645 216 HG3 ARG 29 HG3 ARG 29 31.083 32.284 -2.274 217 HD2 ARG 29 HD2 ARG 29 33.073 32.834 -3.526 218 HD3 ARG 29 HD3 ARG 29 32.644 31.681 -4.809 219 HE ARG 29 HE ARG 29 30.565 33.657 -4.518 220 HH11 ARG 29 HH11 ARG 29 33.830 33.432 -5.773 221 HH12 ARG 29 HH12 ARG 29 33.564 34.681 -6.956 222 HH21 ARG 29 HH21 ARG 29 30.230 35.123 -6.158 223 HH22 ARG 29 HH22 ARG 29 31.580 35.637 -7.141 224 H LEU 30 H LEU 30 32.284 29.354 0.421 225 HA LEU 30 HA LEU 30 31.545 31.725 1.847 226 HB2 LEU 30 HB2 LEU 30 32.153 28.970 2.960 227 HB3 LEU 30 HB3 LEU 30 31.367 30.299 3.820 228 HG LEU 30 HG LEU 30 30.253 28.914 1.370 229 HD11 LEU 30 HD11 LEU 30 29.167 28.844 4.204 230 HD12 LEU 30 HD12 LEU 30 30.205 27.546 3.579 231 HD13 LEU 30 HD13 LEU 30 28.639 27.876 2.824 232 HD21 LEU 30 HD21 LEU 30 29.443 31.176 1.363 233 HD22 LEU 30 HD22 LEU 30 29.050 31.089 3.103 234 HD23 LEU 30 HD23 LEU 30 28.148 30.115 1.917 235 H ILE 31 H ILE 31 34.594 29.939 1.739 236 HA ILE 31 HA ILE 31 35.983 31.667 3.676 237 HB ILE 31 HB ILE 31 36.918 29.678 1.569 238 HG12 ILE 31 HG12 ILE 31 36.872 29.422 4.610 239 HG13 ILE 31 HG13 ILE 31 35.571 28.837 3.598 240 HG21 ILE 31 HG21 ILE 31 38.745 31.282 1.977 241 HG22 ILE 31 HG22 ILE 31 38.563 31.071 3.733 242 HG23 ILE 31 HG23 ILE 31 39.136 29.740 2.708 243 HD11 ILE 31 HD11 ILE 31 38.424 27.800 3.539 244 HD12 ILE 31 HD12 ILE 31 36.975 26.979 4.129 245 HD13 ILE 31 HD13 ILE 31 37.135 27.326 2.400 246 H GLY 32 H GLY 32 35.507 31.665 0.144 247 HA2 GLY 32 HA2 GLY 32 37.559 33.515 -0.564 248 HA3 GLY 32 HA3 GLY 32 36.196 32.953 -1.544 249 H THR 33 H THR 33 34.095 33.893 -0.044 250 HA THR 33 HA THR 33 34.363 36.815 0.173 251 HB THR 33 HB THR 33 34.089 36.377 -2.270 252 HG1 THR 33 HG1 THR 33 32.502 37.921 -2.560 253 HG21 THR 33 HG21 THR 33 32.521 34.413 -1.979 254 HG22 THR 33 HG22 THR 33 32.044 35.615 -3.203 255 HG23 THR 33 HG23 THR 33 31.231 35.583 -1.626 256 H GLY 34 H GLY 34 32.511 33.932 0.639 257 HA2 GLY 34 HA2 GLY 34 31.283 33.559 2.584 258 HA3 GLY 34 HA3 GLY 34 31.120 35.275 2.919 259 H SER 35 H SER 35 29.942 34.533 -0.243 260 HA SER 35 HA SER 35 27.548 33.161 0.431 261 HB2 SER 35 HB2 SER 35 27.517 36.077 -0.455 262 HB3 SER 35 HB3 SER 35 26.132 34.988 -0.665 263 HG SER 35 HG SER 35 27.328 35.109 1.858 264 H VAL 36 H VAL 36 26.510 32.363 -1.414 265 HA VAL 36 HA VAL 36 28.301 32.211 -3.816 266 HB VAL 36 HB VAL 36 27.801 30.199 -2.369 267 HG11 VAL 36 HG11 VAL 36 25.805 28.928 -2.789 268 HG12 VAL 36 HG12 VAL 36 25.323 30.526 -2.190 269 HG13 VAL 36 HG13 VAL 36 25.183 30.150 -3.919 270 HG21 VAL 36 HG21 VAL 36 27.244 30.021 -5.346 271 HG22 VAL 36 HG22 VAL 36 28.846 30.086 -4.580 272 HG23 VAL 36 HG23 VAL 36 27.793 28.703 -4.278 273 H ASP 37 H ASP 37 27.723 32.494 -5.794 274 HA ASP 37 HA ASP 37 25.008 33.534 -6.451 275 HB2 ASP 37 HB2 ASP 37 27.510 33.971 -8.084 276 HB3 ASP 37 HB3 ASP 37 26.005 34.879 -8.122 277 H GLU 38 H GLU 38 23.894 32.796 -8.440 278 HA GLU 38 HA GLU 38 24.266 30.171 -9.234 279 HB2 GLU 38 HB2 GLU 38 22.385 31.970 -9.644 280 HB3 GLU 38 HB3 GLU 38 23.315 32.391 -11.087 281 HG2 GLU 38 HG2 GLU 38 23.189 29.822 -11.617 282 HG3 GLU 38 HG3 GLU 38 21.960 29.795 -10.356 283 H ASP 39 H ASP 39 25.781 33.091 -10.460 284 HA ASP 39 HA ASP 39 27.056 31.925 -12.780 285 HB2 ASP 39 HB2 ASP 39 26.478 34.348 -12.462 286 HB3 ASP 39 HB3 ASP 39 27.705 34.455 -11.198 287 H PHE 40 H PHE 40 27.918 31.833 -9.357 288 HA PHE 40 HA PHE 40 30.683 31.010 -9.979 289 HB2 PHE 40 HB2 PHE 40 30.195 32.333 -7.970 290 HB3 PHE 40 HB3 PHE 40 29.105 31.077 -7.387 291 HD1 PHE 40 HD1 PHE 40 32.670 31.838 -8.205 292 HD2 PHE 40 HD2 PHE 40 29.931 29.077 -6.340 293 HE1 PHE 40 HE1 PHE 40 34.582 30.661 -7.133 294 HE2 PHE 40 HE2 PHE 40 31.824 27.937 -5.242 295 HZ PHE 40 HZ PHE 40 34.163 28.726 -5.630 296 H LEU 41 H LEU 41 27.529 29.529 -9.325 297 HA LEU 41 HA LEU 41 28.642 26.848 -8.836 298 HB2 LEU 41 HB2 LEU 41 25.879 28.091 -8.894 299 HB3 LEU 41 HB3 LEU 41 26.069 26.355 -8.658 300 HG LEU 41 HG LEU 41 27.517 28.340 -6.881 301 HD11 LEU 41 HD11 LEU 41 24.748 27.115 -6.518 302 HD12 LEU 41 HD12 LEU 41 25.126 28.840 -6.759 303 HD13 LEU 41 HD13 LEU 41 25.665 28.021 -5.287 304 HD21 LEU 41 HD21 LEU 41 28.265 25.918 -6.849 305 HD22 LEU 41 HD22 LEU 41 26.601 25.475 -6.395 306 HD23 LEU 41 HD23 LEU 41 27.587 26.473 -5.319 307 H ARG 42 H ARG 42 26.826 28.399 -11.541 308 HA ARG 42 HA ARG 42 26.400 26.060 -13.068 309 HB2 ARG 42 HB2 ARG 42 26.115 27.557 -14.948 310 HB3 ARG 42 HB3 ARG 42 25.462 28.310 -13.498 311 HG2 ARG 42 HG2 ARG 42 27.548 29.701 -13.314 312 HG3 ARG 42 HG3 ARG 42 28.172 28.925 -14.770 313 HD2 ARG 42 HD2 ARG 42 26.148 29.790 -16.026 314 HD3 ARG 42 HD3 ARG 42 25.714 30.695 -14.574 315 HE ARG 42 HE ARG 42 27.499 32.193 -14.938 316 HH11 ARG 42 HH11 ARG 42 27.868 29.622 -17.330 317 HH12 ARG 42 HH12 ARG 42 29.145 30.495 -18.130 318 HH21 ARG 42 HH22 ARG 42 29.007 33.145 -15.899 319 HH22 ARG 42 HH21 ARG 42 29.805 32.507 -17.341 320 H GLU 43 H GLU 43 29.404 27.649 -12.454 321 HA GLU 43 HA GLU 43 30.895 26.385 -14.675 322 HB2 GLU 43 HB2 GLU 43 32.002 27.899 -12.285 323 HB3 GLU 43 HB3 GLU 43 32.807 27.532 -13.819 324 HG2 GLU 43 HG2 GLU 43 30.867 28.893 -14.899 325 HG3 GLU 43 HG3 GLU 43 30.584 29.506 -13.266 326 H GLN 44 H GLN 44 29.687 25.114 -11.850 327 HA GLN 44 HA GLN 44 32.103 23.443 -11.247 328 HB2 GLN 44 HB2 GLN 44 29.808 23.950 -9.344 329 HB3 GLN 44 HB3 GLN 44 31.413 23.316 -8.990 330 HG2 GLN 44 HG2 GLN 44 30.637 26.130 -9.763 331 HG3 GLN 44 HG3 GLN 44 31.199 25.613 -8.190 332 HE21 GLN 44 HE21 GLN 44 32.299 27.754 -9.660 333 HE22 GLN 44 HE22 GLN 44 33.989 27.339 -9.986 334 H ILE 45 H ILE 45 28.653 23.375 -11.964 335 HA ILE 45 HA ILE 45 27.952 20.812 -11.190 336 HB ILE 45 HB ILE 45 26.530 20.845 -13.427 337 HG12 ILE 45 HG12 ILE 45 26.894 23.839 -13.141 338 HG13 ILE 45 HG13 ILE 45 27.814 22.919 -14.345 339 HG21 ILE 45 HG21 ILE 45 25.974 22.876 -11.242 340 HG22 ILE 45 HG22 ILE 45 24.803 21.950 -12.227 341 HG23 ILE 45 HG23 ILE 45 25.815 21.108 -11.045 342 HD11 ILE 45 HD11 ILE 45 25.846 23.901 -15.370 343 HD12 ILE 45 HD12 ILE 45 25.680 22.135 -15.355 344 HD13 ILE 45 HD13 ILE 45 24.776 23.132 -14.188 345 H ARG 46 H ARG 46 28.896 21.422 -14.618 346 HA ARG 46 HA ARG 46 29.985 20.390 -16.103 347 HB2 ARG 46 HB2 ARG 46 31.256 18.542 -14.052 348 HB3 ARG 46 HB3 ARG 46 31.817 18.818 -15.694 349 HG2 ARG 46 HG2 ARG 46 31.841 20.849 -13.432 350 HG3 ARG 46 HG3 ARG 46 33.223 19.961 -14.053 351 HD2 ARG 46 HD2 ARG 46 33.051 21.114 -16.219 352 HD3 ARG 46 HD3 ARG 46 31.572 21.923 -15.698 353 HE ARG 46 HE ARG 46 32.755 23.366 -14.306 354 HH11 ARG 46 HH11 ARG 46 35.096 21.119 -15.659 355 HH12 ARG 46 HH12 ARG 46 36.438 22.059 -15.065 356 HH21 ARG 46 HH21 ARG 46 34.411 24.437 -13.570 357 HH22 ARG 46 HH22 ARG 46 36.062 23.940 -13.901 358 H ASP 47 H ASP 47 28.080 18.424 -14.115 359 HA ASP 47 HA ASP 47 27.274 16.797 -16.503 360 HB2 ASP 47 HB2 ASP 47 29.202 15.786 -15.127 361 HB3 ASP 47 HB3 ASP 47 28.050 15.611 -13.806 362 H ALA 48 H ALA 48 26.501 18.067 -13.324 363 HA ALA 48 HA ALA 48 23.843 16.928 -13.061 364 HB1 ALA 48 HB1 ALA 48 23.749 18.941 -11.400 365 HB2 ALA 48 HB2 ALA 48 24.871 17.606 -11.039 366 HB3 ALA 48 HB3 ALA 48 25.483 19.100 -11.734 367 H ARG 49 H ARG 49 21.890 17.924 -13.566 368 HA ARG 49 HA ARG 49 21.963 19.914 -15.722 369 HB2 ARG 49 HB2 ARG 49 20.312 17.860 -15.355 370 HB3 ARG 49 HB3 ARG 49 19.418 19.002 -14.355 371 HG2 ARG 49 HG2 ARG 49 18.440 19.132 -16.502 372 HG3 ARG 49 HG3 ARG 49 19.450 20.584 -16.391 373 HD2 ARG 49 HD2 ARG 49 21.228 19.431 -17.697 374 HD3 ARG 49 HD3 ARG 49 20.208 17.979 -17.784 375 HE ARG 49 HE ARG 49 18.690 20.146 -18.793 376 HH11 ARG 49 HH11 ARG 49 21.550 18.369 -19.765 377 HH12 ARG 49 HH12 ARG 49 21.305 18.710 -21.456 378 HH21 ARG 49 HH21 ARG 49 18.432 20.546 -20.971 379 HH22 ARG 49 HH22 ARG 49 19.577 19.912 -22.114 380 H TYR 50 H TYR 50 20.627 19.886 -12.435 381 HA TYR 50 HA TYR 50 20.812 22.871 -12.306 382 HB2 TYR 50 HB2 TYR 50 18.786 21.236 -10.785 383 HB3 TYR 50 HB3 TYR 50 18.685 22.898 -11.295 384 HD1 TYR 50 HD2 TYR 50 18.942 22.918 -14.153 385 HD2 TYR 50 HD1 TYR 50 17.038 19.988 -11.645 386 HE1 TYR 50 HE2 TYR 50 17.414 22.322 -16.015 387 HE2 TYR 50 HE1 TYR 50 15.540 19.349 -13.525 388 HH TYR 50 HH TYR 50 15.679 20.987 -16.696 389 H ALA 51 H ALA 51 22.069 23.718 -10.438 390 HA ALA 51 HA ALA 51 22.336 21.832 -8.156 391 HB1 ALA 51 HB1 ALA 51 24.048 24.196 -9.006 392 HB2 ALA 51 HB2 ALA 51 24.244 23.240 -7.526 393 HB3 ALA 51 HB3 ALA 51 24.488 22.471 -9.113 394 H VAL 52 H VAL 52 21.387 22.430 -6.305 395 HA VAL 52 HA VAL 52 20.193 25.170 -6.029 396 HB VAL 52 HB VAL 52 18.977 22.503 -5.252 397 HG11 VAL 52 HG11 VAL 52 16.972 23.861 -4.608 398 HG12 VAL 52 HG12 VAL 52 18.342 24.114 -3.530 399 HG13 VAL 52 HG13 VAL 52 17.952 25.336 -4.767 400 HG21 VAL 52 HG21 VAL 52 18.749 22.959 -7.633 401 HG22 VAL 52 HG22 VAL 52 17.192 23.223 -6.849 402 HG23 VAL 52 HG23 VAL 52 18.200 24.615 -7.299 403 H ILE 53 H ILE 53 20.305 26.285 -3.927 404 HA ILE 53 HA ILE 53 22.254 25.078 -2.081 405 HB ILE 53 HB ILE 53 21.600 27.783 -3.293 406 HG12 ILE 53 HG12 ILE 53 23.135 26.391 -4.586 407 HG13 ILE 53 HG13 ILE 53 23.882 27.866 -3.988 408 HG21 ILE 53 HG21 ILE 53 23.352 28.852 -1.901 409 HG22 ILE 53 HG22 ILE 53 21.885 28.454 -1.028 410 HG23 ILE 53 HG23 ILE 53 23.318 27.414 -0.846 411 HD11 ILE 53 HD11 ILE 53 24.950 26.582 -2.148 412 HD12 ILE 53 HD12 ILE 53 24.244 25.092 -2.809 413 HD13 ILE 53 HD13 ILE 53 25.428 26.005 -3.761 414 H ARG 54 H ARG 54 21.551 24.790 -0.031 415 HA ARG 54 HA ARG 54 19.304 26.437 1.034 416 HB2 ARG 54 HB2 ARG 54 20.518 23.855 2.060 417 HB3 ARG 54 HB3 ARG 54 19.076 24.626 2.692 418 HG2 ARG 54 HG2 ARG 54 19.417 23.373 -0.063 419 HG3 ARG 54 HG3 ARG 54 18.482 22.741 1.283 420 HD2 ARG 54 HD2 ARG 54 17.854 25.277 -0.289 421 HD3 ARG 54 HD3 ARG 54 17.042 23.713 -0.427 422 HE ARG 54 HE ARG 54 16.935 24.604 2.299 423 HH11 ARG 54 HH11 ARG 54 15.397 25.255 -0.781 424 HH12 ARG 54 HH12 ARG 54 13.946 25.863 -0.034 425 HH21 ARG 54 HH21 ARG 54 15.069 25.421 3.191 426 HH22 ARG 54 HH22 ARG 54 13.776 25.956 2.162 427 H ILE 55 H ILE 55 22.544 26.802 1.297 428 HA ILE 55 HA ILE 55 23.482 27.031 3.709 429 HB ILE 55 HB ILE 55 23.615 29.450 1.891 430 HG12 ILE 55 HG12 ILE 55 25.874 27.472 2.004 431 HG13 ILE 55 HG13 ILE 55 24.460 27.006 1.063 432 HG21 ILE 55 HG21 ILE 55 25.308 28.574 4.275 433 HG22 ILE 55 HG22 ILE 55 25.913 29.702 3.062 434 HG23 ILE 55 HG23 ILE 55 24.483 30.129 4.005 435 HD11 ILE 55 HD11 ILE 55 24.713 29.302 -0.086 436 HD12 ILE 55 HD12 ILE 55 26.305 29.377 0.697 437 HD13 ILE 55 HD13 ILE 55 25.924 28.057 -0.429 438 HA PRO 56 HA PRO 56 20.661 29.465 6.295 439 HB2 PRO 56 HB2 PRO 56 22.985 29.212 8.206 440 HB3 PRO 56 HB3 PRO 56 21.232 29.013 8.523 441 HG2 PRO 56 HG2 PRO 56 22.806 26.834 8.234 442 HG3 PRO 56 HG3 PRO 56 21.206 26.883 7.418 443 HD2 PRO 56 HD2 PRO 56 23.939 27.470 6.235 444 HD3 PRO 56 HD3 PRO 56 22.605 26.458 5.585 445 H GLY 57 H GLY 57 20.419 31.603 6.668 446 HA2 GLY 57 HA2 GLY 57 20.910 33.819 7.139 447 HA3 GLY 57 HA3 GLY 57 22.634 33.450 7.153 448 H GLN 58 H GLN 58 21.576 32.266 4.241 449 HA GLN 58 HA GLN 58 21.483 34.875 2.817 450 HB2 GLN 58 HB2 GLN 58 23.175 34.299 1.295 451 HB3 GLN 58 HB3 GLN 58 23.767 33.815 2.870 452 HG2 GLN 58 HG2 GLN 58 23.110 31.470 2.350 453 HG3 GLN 58 HG3 GLN 58 22.736 31.953 0.688 454 HE21 GLN 58 HE21 GLN 58 25.391 32.347 3.142 455 HE22 GLN 58 HE22 GLN 58 26.686 32.140 1.985 456 HA PRO 59 HA PRO 59 18.043 33.138 0.638 457 HB2 PRO 59 HB2 PRO 59 18.347 33.956 -1.974 458 HB3 PRO 59 HB3 PRO 59 17.886 35.055 -0.638 459 HG2 PRO 59 HG2 PRO 59 20.664 34.578 -1.770 460 HG3 PRO 59 HG3 PRO 59 19.842 36.147 -1.478 461 HD2 PRO 59 HD2 PRO 59 21.581 35.156 0.308 462 HD3 PRO 59 HD3 PRO 59 20.075 35.931 0.874 463 H VAL 60 H VAL 60 17.419 31.638 -1.189 464 HA VAL 60 HA VAL 60 19.297 29.367 -1.438 465 HB VAL 60 HB VAL 60 16.387 29.949 -2.206 466 HG11 VAL 60 HG11 VAL 60 17.903 27.404 -2.890 467 HG12 VAL 60 HG12 VAL 60 16.152 27.633 -2.999 468 HG13 VAL 60 HG13 VAL 60 17.220 28.583 -4.025 469 HG21 VAL 60 HG21 VAL 60 15.822 28.139 -0.668 470 HG22 VAL 60 HG22 VAL 60 17.542 27.859 -0.319 471 HG23 VAL 60 HG23 VAL 60 16.764 29.377 0.169 472 H VAL 61 H VAL 61 20.100 28.812 -3.429 473 HA VAL 61 HA VAL 61 19.763 30.711 -5.697 474 HB VAL 61 HB VAL 61 22.326 29.253 -4.961 475 HG11 VAL 61 HG11 VAL 61 23.301 30.435 -6.893 476 HG12 VAL 61 HG12 VAL 61 22.061 29.290 -7.399 477 HG13 VAL 61 HG13 VAL 61 21.690 31.034 -7.349 478 HG21 VAL 61 HG21 VAL 61 22.024 31.271 -3.593 479 HG22 VAL 61 HG22 VAL 61 23.276 31.533 -4.810 480 HG23 VAL 61 HG23 VAL 61 21.659 32.226 -5.049 481 H GLU 62 H GLU 62 19.192 29.737 -7.520 482 HA GLU 62 HA GLU 62 19.268 26.746 -7.755 483 HB2 GLU 62 HB2 GLU 62 17.055 28.573 -8.784 484 HB3 GLU 62 HB3 GLU 62 17.184 26.832 -9.048 485 HG2 GLU 62 HG2 GLU 62 16.984 26.461 -6.590 486 HG3 GLU 62 HG3 GLU 62 16.803 28.198 -6.349 487 H VAL 63 H VAL 63 20.570 26.108 -9.453 488 HA VAL 63 HA VAL 63 21.326 28.074 -11.537 489 HB VAL 63 HB VAL 63 22.540 25.408 -10.782 490 HG11 VAL 63 HG11 VAL 63 23.545 27.654 -12.542 491 HG12 VAL 63 HG12 VAL 63 24.550 26.312 -11.951 492 HG13 VAL 63 HG13 VAL 63 23.199 25.970 -13.027 493 HG21 VAL 63 HG21 VAL 63 22.829 27.026 -8.885 494 HG22 VAL 63 HG22 VAL 63 24.294 26.502 -9.686 495 HG23 VAL 63 HG23 VAL 63 23.653 28.120 -10.027 496 H GLY 64 H GLY 64 21.286 27.349 -13.782 497 HA2 GLY 64 HA2 GLY 64 20.504 26.134 -15.580 498 HA3 GLY 64 HA3 GLY 64 20.098 24.804 -14.493 499 H THR 65 H THR 65 17.930 24.485 -14.020 500 HA THR 65 HA THR 65 16.121 26.691 -13.779 501 HB THR 65 HB THR 65 16.029 26.485 -16.237 502 HG1 THR 65 HG1 THR 65 13.812 26.505 -16.313 503 HG21 THR 65 HG21 THR 65 14.852 23.725 -15.728 504 HG22 THR 65 HG22 THR 65 16.317 24.138 -16.657 505 HG23 THR 65 HG23 THR 65 14.732 24.626 -17.254 506 H LYS 66 H LYS 66 14.051 26.043 -12.959 507 HA LYS 66 HA LYS 66 14.229 24.188 -10.927 508 HB2 LYS 66 HB2 LYS 66 12.652 26.246 -11.357 509 HB3 LYS 66 HB3 LYS 66 11.520 25.050 -11.992 510 HG2 LYS 66 HG2 LYS 66 11.524 23.887 -9.814 511 HG3 LYS 66 HG3 LYS 66 12.822 24.954 -9.235 512 HD2 LYS 66 HD2 LYS 66 11.180 26.917 -9.632 513 HD3 LYS 66 HD3 LYS 66 9.938 25.677 -9.861 514 HE2 LYS 66 HE2 LYS 66 9.741 26.257 -7.592 515 HE3 LYS 66 HE3 LYS 66 10.648 24.741 -7.565 516 HZ1 LYS 66 HZ1 LYS 66 11.670 26.382 -6.103 517 HZ2 LYS 66 HZ2 LYS 66 11.805 27.478 -7.305 518 HZ3 LYS 66 HZ3 LYS 66 12.721 26.131 -7.337 519 HA PRO 67 HA PRO 67 13.450 20.239 -12.799 520 HB2 PRO 67 HB2 PRO 67 12.734 18.718 -10.617 521 HB3 PRO 67 HB3 PRO 67 14.374 19.333 -10.969 522 HG2 PRO 67 HG2 PRO 67 12.287 20.574 -9.163 523 HG3 PRO 67 HG3 PRO 67 13.997 20.154 -8.804 524 HD2 PRO 67 HD2 PRO 67 13.371 22.660 -9.538 525 HD3 PRO 67 HD3 PRO 67 14.810 21.893 -10.239 526 H THR 68 H THR 68 11.581 18.389 -11.959 527 HA THR 68 HA THR 68 9.218 19.383 -13.432 528 HB THR 68 HB THR 68 10.951 18.337 -14.938 529 HG1 THR 68 HG1 THR 68 9.329 17.489 -16.229 530 HG21 THR 68 HG21 THR 68 10.909 15.963 -15.311 531 HG22 THR 68 HG22 THR 68 9.698 15.716 -14.041 532 HG23 THR 68 HG23 THR 68 11.349 16.245 -13.624 533 H GLY 69 H GLY 69 10.257 17.008 -11.003 534 HA2 GLY 69 HA2 GLY 69 8.529 16.359 -9.389 535 HA3 GLY 69 HA3 GLY 69 7.441 16.078 -10.754 536 H ASP 70 H ASP 70 10.107 15.114 -11.983 537 HA ASP 70 HA ASP 70 10.516 12.469 -10.724 538 HB2 ASP 70 HB2 ASP 70 9.997 12.785 -13.701 539 HB3 ASP 70 HB3 ASP 70 10.544 11.313 -12.907 540 H VAL 71 H VAL 71 12.542 13.302 -9.930 541 HA VAL 71 HA VAL 71 14.680 13.646 -11.816 542 HB VAL 71 HB VAL 71 15.552 15.602 -10.468 543 HG11 VAL 71 HG11 VAL 71 13.050 16.173 -12.083 544 HG12 VAL 71 HG12 VAL 71 14.431 17.264 -11.791 545 HG13 VAL 71 HG13 VAL 71 14.652 15.826 -12.763 546 HG21 VAL 71 HG21 VAL 71 13.998 17.100 -9.341 547 HG22 VAL 71 HG22 VAL 71 12.638 16.010 -9.663 548 HG23 VAL 71 HG23 VAL 71 13.942 15.517 -8.553 549 H LEU 72 H LEU 72 16.671 13.199 -11.012 550 HA LEU 72 HA LEU 72 16.926 11.558 -8.569 551 HB2 LEU 72 HB2 LEU 72 18.958 12.684 -10.563 552 HB3 LEU 72 HB3 LEU 72 19.362 11.581 -9.248 553 HG LEU 72 HG LEU 72 17.401 10.929 -11.455 554 HD11 LEU 72 HD11 LEU 72 19.191 9.511 -12.421 555 HD12 LEU 72 HD12 LEU 72 20.333 10.135 -11.204 556 HD13 LEU 72 HD13 LEU 72 19.633 11.220 -12.431 557 HD21 LEU 72 HD21 LEU 72 18.763 9.220 -9.359 558 HD22 LEU 72 HD22 LEU 72 17.806 8.571 -10.713 559 HD23 LEU 72 HD23 LEU 72 17.027 9.580 -9.485 560 H GLN 73 H GLN 73 18.179 12.265 -6.658 561 HA GLN 73 HA GLN 73 18.644 15.197 -6.488 562 HB2 GLN 73 HB2 GLN 73 17.061 13.435 -4.593 563 HB3 GLN 73 HB3 GLN 73 17.708 15.029 -4.195 564 HG2 GLN 73 HG2 GLN 73 16.422 15.919 -6.235 565 HG3 GLN 73 HG3 GLN 73 15.581 14.372 -6.268 566 HE21 GLN 73 HE21 GLN 73 14.809 17.342 -5.519 567 HE22 GLN 73 HE22 GLN 73 13.991 17.121 -3.970 568 H GLY 74 H GLY 74 20.741 15.457 -5.974 569 HA2 GLY 74 HA2 GLY 74 22.212 13.432 -4.345 570 HA3 GLY 74 HA3 GLY 74 22.963 14.587 -5.461 571 H ARG 75 H ARG 75 23.300 14.328 -2.564 572 HA ARG 75 HA ARG 75 22.621 17.093 -1.687 573 HB2 ARG 75 HB2 ARG 75 20.637 15.589 -1.234 574 HB3 ARG 75 HB3 ARG 75 21.649 14.663 -0.124 575 HG2 ARG 75 HG2 ARG 75 21.939 16.691 1.292 576 HG3 ARG 75 HG3 ARG 75 20.982 17.639 0.135 577 HD2 ARG 75 HD2 ARG 75 19.031 16.190 0.544 578 HD3 ARG 75 HD3 ARG 75 19.962 15.190 1.655 579 HE ARG 75 HE ARG 75 18.775 17.818 2.155 580 HH11 ARG 75 HH11 ARG 75 21.188 15.583 3.395 581 HH12 ARG 75 HH12 ARG 75 21.132 16.274 4.991 582 HH21 ARG 75 HH21 ARG 75 18.718 18.602 4.233 583 HH22 ARG 75 HH22 ARG 75 19.772 17.942 5.444 584 H ALA 76 H ALA 76 23.814 17.936 0.027 585 HA ALA 76 HA ALA 76 25.759 16.266 1.474 586 HB1 ALA 76 HB1 ALA 76 26.854 16.671 -0.695 587 HB2 ALA 76 HB2 ALA 76 26.500 18.405 -0.576 588 HB3 ALA 76 HB3 ALA 76 27.653 17.643 0.560 589 H THR 77 H THR 77 26.780 17.296 3.144 590 HA THR 77 HA THR 77 25.837 20.027 3.921 591 HB THR 77 HB THR 77 26.677 17.735 5.722 592 HG1 THR 77 HG1 THR 77 24.214 19.106 5.411 593 HG21 THR 77 HG21 THR 77 25.780 20.554 6.469 594 HG22 THR 77 HG22 THR 77 27.402 19.871 6.717 595 HG23 THR 77 HG23 THR 77 26.021 19.201 7.593 596 H GLY 78 H GLY 78 27.357 21.562 4.127 597 HA2 GLY 78 HA2 GLY 78 30.175 20.879 3.460 598 HA3 GLY 78 HA3 GLY 78 29.430 22.451 3.388 599 H GLU 79 H GLU 79 31.251 23.191 4.464 600 HA GLU 79 HA GLU 79 31.883 22.285 7.179 601 HB2 GLU 79 HB2 GLU 79 33.544 23.556 5.014 602 HB3 GLU 79 HB3 GLU 79 34.077 23.579 6.697 603 HG2 GLU 79 HG2 GLU 79 33.829 21.097 6.798 604 HG3 GLU 79 HG3 GLU 79 33.354 21.087 5.098 605 H GLU 80 H GLU 80 30.349 25.064 5.843 606 HA GLU 80 HA GLU 80 30.943 26.616 8.380 607 HB2 GLU 80 HB2 GLU 80 29.450 27.379 5.871 608 HB3 GLU 80 HB3 GLU 80 29.610 28.408 7.290 609 HG2 GLU 80 HG2 GLU 80 31.962 27.435 5.582 610 HG3 GLU 80 HG3 GLU 80 31.175 28.982 5.527 611 H GLY 81 H GLY 81 28.965 24.221 7.309 612 HA2 GLY 81 HA2 GLY 81 27.225 23.191 8.575 613 HA3 GLY 81 HA3 GLY 81 26.782 24.743 9.281 614 H GLU 82 H GLU 82 27.407 24.552 5.861 615 HA GLU 82 HA GLU 82 24.655 25.249 5.188 616 HB2 GLU 82 HB2 GLU 82 25.411 25.691 3.046 617 HB3 GLU 82 HB3 GLU 82 26.562 26.456 4.143 618 HG2 GLU 82 HG2 GLU 82 27.086 23.796 2.716 619 HG3 GLU 82 HG3 GLU 82 27.387 25.354 1.983 620 H THR 83 H THR 83 23.632 24.320 3.342 621 HA THR 83 HA THR 83 24.177 21.416 2.867 622 HB THR 83 HB THR 83 21.471 22.568 3.572 623 HG1 THR 83 HG1 THR 83 22.826 21.902 5.254 624 HG21 THR 83 HG21 THR 83 20.579 20.287 3.235 625 HG22 THR 83 HG22 THR 83 22.121 19.778 2.512 626 HG23 THR 83 HG23 THR 83 21.097 20.994 1.703 627 H VAL 84 H VAL 84 23.878 20.649 0.821 628 HA VAL 84 HA VAL 84 23.253 22.614 -1.337 629 HB VAL 84 HB VAL 84 25.704 20.808 -1.081 630 HG11 VAL 84 HG11 VAL 84 26.429 21.814 -3.237 631 HG12 VAL 84 HG12 VAL 84 24.997 20.818 -3.444 632 HG13 VAL 84 HG13 VAL 84 24.842 22.595 -3.412 633 HG21 VAL 84 HG21 VAL 84 25.324 23.821 -1.133 634 HG22 VAL 84 HG22 VAL 84 25.991 22.833 0.188 635 HG23 VAL 84 HG23 VAL 84 26.897 23.015 -1.317 636 H LEU 85 H LEU 85 22.307 21.756 -3.078 637 HA LEU 85 HA LEU 85 21.739 18.852 -3.144 638 HB2 LEU 85 HB2 LEU 85 19.844 20.225 -2.185 639 HB3 LEU 85 HB3 LEU 85 19.783 21.111 -3.697 640 HG LEU 85 HG LEU 85 19.305 18.784 -4.810 641 HD11 LEU 85 HD11 LEU 85 18.385 17.074 -3.476 642 HD12 LEU 85 HD12 LEU 85 18.291 18.109 -2.024 643 HD13 LEU 85 HD13 LEU 85 19.854 17.533 -2.599 644 HD21 LEU 85 HD21 LEU 85 17.616 20.523 -4.655 645 HD22 LEU 85 HD22 LEU 85 17.271 20.084 -2.967 646 HD23 LEU 85 HD23 LEU 85 16.904 18.945 -4.284 647 H VAL 86 H VAL 86 21.474 17.902 -5.161 648 HA VAL 86 HA VAL 86 22.000 19.486 -7.654 649 HB VAL 86 HB VAL 86 22.985 16.684 -6.944 650 HG11 VAL 86 HG11 VAL 86 22.959 18.161 -9.572 651 HG12 VAL 86 HG12 VAL 86 24.013 16.745 -9.216 652 HG13 VAL 86 HG13 VAL 86 22.264 16.574 -9.222 653 HG21 VAL 86 HG21 VAL 86 24.389 18.484 -6.033 654 HG22 VAL 86 HG22 VAL 86 25.213 17.601 -7.319 655 HG23 VAL 86 HG23 VAL 86 24.522 19.211 -7.656 656 H GLU 87 H GLU 87 20.510 19.061 -9.318 657 HA GLU 87 HA GLU 87 18.715 16.741 -8.974 658 HB2 GLU 87 HB2 GLU 87 17.677 19.551 -9.450 659 HB3 GLU 87 HB3 GLU 87 16.725 18.059 -9.431 660 HG2 GLU 87 HG2 GLU 87 17.553 17.699 -7.041 661 HG3 GLU 87 HG3 GLU 87 18.219 19.331 -7.098 662 H GLU 88 H GLU 88 18.396 15.675 -10.729 663 HA GLU 88 HA GLU 88 18.343 16.980 -13.395 664 HB2 GLU 88 HB2 GLU 88 19.911 15.373 -14.347 665 HB3 GLU 88 HB3 GLU 88 20.647 16.374 -13.110 666 HG2 GLU 88 HG2 GLU 88 20.563 14.492 -11.523 667 HG3 GLU 88 HG3 GLU 88 19.712 13.508 -12.734 668 HA PRO 89 HA PRO 89 14.910 14.467 -14.339 669 HB2 PRO 89 HB2 PRO 89 15.218 13.756 -16.990 670 HB3 PRO 89 HB3 PRO 89 14.724 15.375 -16.406 671 HG2 PRO 89 HG2 PRO 89 17.521 14.433 -17.126 672 HG3 PRO 89 HG3 PRO 89 16.676 15.921 -17.685 673 HD2 PRO 89 HD2 PRO 89 18.403 16.060 -15.664 674 HD3 PRO 89 HD3 PRO 89 16.841 16.908 -15.501 675 H ARG 90 H ARG 90 14.388 12.566 -13.718 676 HA ARG 90 HA ARG 90 16.220 10.320 -13.562 677 HB2 ARG 90 HB2 ARG 90 14.491 10.909 -11.824 678 HB3 ARG 90 HB3 ARG 90 13.242 10.351 -12.945 679 HG2 ARG 90 HG2 ARG 90 14.419 8.081 -12.978 680 HG3 ARG 90 HG3 ARG 90 15.517 8.710 -11.743 681 HD2 ARG 90 HD2 ARG 90 13.832 7.477 -10.596 682 HD3 ARG 90 HD3 ARG 90 13.498 9.190 -10.307 683 HE ARG 90 HE ARG 90 12.097 7.533 -12.394 684 HH11 ARG 90 HH11 ARG 90 11.708 9.749 -9.690 685 HH12 ARG 90 HH12 ARG 90 10.032 10.036 -10.101 686 HH21 ARG 90 HH21 ARG 90 9.968 8.007 -12.819 687 HH22 ARG 90 HH22 ARG 90 9.169 9.256 -11.878 Start of MODEL 16 1 H1 GLY 1 H1 GLY 1 6.257 -6.975 5.526 2 H2 GLY 1 H2 GLY 1 6.759 -5.642 6.333 3 H3 GLY 1 H3 GLY 1 7.662 -6.243 5.106 4 HA2 GLY 1 HA2 GLY 1 4.973 -5.053 4.837 5 HA3 GLY 1 HA3 GLY 1 6.493 -4.258 4.385 6 H SER 2 H SER 2 4.031 -5.143 2.810 7 HA SER 2 HA SER 2 4.809 -7.360 1.154 8 HB2 SER 2 HB2 SER 2 2.818 -6.714 -0.185 9 HB3 SER 2 HB3 SER 2 2.498 -6.926 1.545 10 HG SER 2 HG SER 2 1.530 -5.024 0.683 11 H GLU 3 H GLU 3 4.968 -3.746 0.485 12 HA GLU 3 HA GLU 3 5.607 -4.082 -2.223 13 HB2 GLU 3 HB2 GLU 3 5.934 -1.769 -0.266 14 HB3 GLU 3 HB3 GLU 3 6.087 -1.629 -2.017 15 HG2 GLU 3 HG2 GLU 3 3.751 -2.295 -2.331 16 HG3 GLU 3 HG3 GLU 3 3.552 -2.519 -0.588 17 H THR 4 H THR 4 7.419 -3.014 -3.290 18 HA THR 4 HA THR 4 9.984 -2.796 -1.922 19 HB THR 4 HB THR 4 9.914 -5.189 -2.634 20 HG1 THR 4 HG1 THR 4 11.981 -5.098 -3.478 21 HG21 THR 4 HG21 THR 4 10.255 -5.790 -4.963 22 HG22 THR 4 HG22 THR 4 10.143 -4.091 -5.472 23 HG23 THR 4 HG23 THR 4 8.718 -4.925 -4.812 24 H ARG 5 H ARG 5 11.563 -1.669 -3.190 25 HA ARG 5 HA ARG 5 10.387 0.193 -5.238 26 HB2 ARG 5 HB2 ARG 5 12.553 0.633 -3.131 27 HB3 ARG 5 HB3 ARG 5 11.972 1.864 -4.256 28 HG2 ARG 5 HG2 ARG 5 10.230 0.536 -2.144 29 HG3 ARG 5 HG3 ARG 5 11.023 2.104 -1.994 30 HD2 ARG 5 HD2 ARG 5 9.765 3.004 -3.876 31 HD3 ARG 5 HD3 ARG 5 9.021 1.439 -4.194 32 HE ARG 5 HE ARG 5 8.521 3.187 -1.814 33 HH11 ARG 5 HH21 ARG 5 7.373 0.458 -3.784 34 HH12 ARG 5 HH22 ARG 5 5.818 0.506 -2.938 35 HH21 ARG 5 HH12 ARG 5 6.464 3.022 -0.857 36 HH22 ARG 5 HH11 ARG 5 5.376 1.769 -1.464 37 H THR 6 H THR 6 13.134 1.160 -5.426 38 HA THR 6 HA THR 6 14.871 -0.468 -6.649 39 HB THR 6 HB THR 6 13.269 -1.022 -8.418 40 HG1 THR 6 HG1 THR 6 14.787 -0.868 -10.036 41 HG21 THR 6 HG21 THR 6 13.838 1.657 -9.677 42 HG22 THR 6 HG22 THR 6 12.375 1.375 -8.707 43 HG23 THR 6 HG23 THR 6 12.667 0.412 -10.179 44 H ILE 7 H ILE 7 16.372 0.768 -5.869 45 HA ILE 7 HA ILE 7 16.764 3.524 -6.475 46 HB ILE 7 HB ILE 7 18.634 1.548 -5.118 47 HG12 ILE 7 HG12 ILE 7 17.980 2.822 -3.047 48 HG13 ILE 7 HG13 ILE 7 16.749 3.674 -3.967 49 HG21 ILE 7 HG21 ILE 7 19.783 3.547 -4.202 50 HG22 ILE 7 HG22 ILE 7 19.934 3.499 -5.941 51 HG23 ILE 7 HG23 ILE 7 18.761 4.612 -5.187 52 HD11 ILE 7 HD11 ILE 7 15.410 1.670 -4.129 53 HD12 ILE 7 HD12 ILE 7 16.771 0.648 -3.582 54 HD13 ILE 7 HD13 ILE 7 15.983 1.781 -2.470 55 H SER 8 H SER 8 18.280 4.505 -7.555 56 HA SER 8 HA SER 8 19.305 3.172 -10.070 57 HB2 SER 8 HB2 SER 8 18.670 6.088 -9.579 58 HB3 SER 8 HB3 SER 8 19.504 5.492 -11.026 59 HG SER 8 HG SER 8 17.743 4.343 -11.602 60 H SER 9 H SER 9 20.761 2.571 -7.888 61 HA SER 9 HA SER 9 22.740 4.004 -6.899 62 HB2 SER 9 HB2 SER 9 23.187 1.096 -7.523 63 HB3 SER 9 HB3 SER 9 23.626 1.995 -6.064 64 HG SER 9 HG SER 9 21.793 0.674 -5.735 65 H THR 10 H THR 10 22.950 4.216 -9.953 66 HA THR 10 HA THR 10 25.913 4.319 -10.052 67 HB THR 10 HB THR 10 25.769 3.988 -12.506 68 HG1 THR 10 HG1 THR 10 23.924 2.835 -13.256 69 HG21 THR 10 HG21 THR 10 25.661 1.533 -12.435 70 HG22 THR 10 HG22 THR 10 24.779 1.594 -10.890 71 HG23 THR 10 HG23 THR 10 26.469 2.137 -10.976 72 H ALA 11 H ALA 11 23.079 5.375 -11.903 73 HA ALA 11 HA ALA 11 24.053 7.989 -12.487 74 HB1 ALA 11 HB1 ALA 11 22.388 6.805 -13.856 75 HB2 ALA 11 HB2 ALA 11 21.201 6.898 -12.536 76 HB3 ALA 11 HB3 ALA 11 21.765 8.382 -13.335 77 H GLN 12 H GLN 12 21.689 6.895 -9.983 78 HA GLN 12 HA GLN 12 21.393 9.536 -8.799 79 HB2 GLN 12 HB2 GLN 12 19.737 7.688 -8.521 80 HB3 GLN 12 HB3 GLN 12 20.921 6.766 -7.608 81 HG2 GLN 12 HG2 GLN 12 19.283 7.798 -6.136 82 HG3 GLN 12 HG3 GLN 12 20.902 8.377 -5.790 83 HE21 GLN 12 HE21 GLN 12 21.466 10.618 -6.511 84 HE22 GLN 12 HE22 GLN 12 20.138 11.767 -6.667 85 H GLU 13 H GLU 13 23.597 6.773 -8.245 86 HA GLU 13 HA GLU 13 24.703 7.778 -5.821 87 HB2 GLU 13 HB2 GLU 13 24.688 5.415 -6.558 88 HB3 GLU 13 HB3 GLU 13 25.827 5.787 -7.834 89 HG2 GLU 13 HG2 GLU 13 27.154 4.871 -6.140 90 HG3 GLU 13 HG3 GLU 13 27.435 6.597 -5.963 91 H ARG 14 H ARG 14 26.282 7.771 -8.993 92 HA ARG 14 HA ARG 14 28.294 9.567 -8.428 93 HB2 ARG 14 HB2 ARG 14 28.591 10.146 -10.735 94 HB3 ARG 14 HB3 ARG 14 28.361 8.419 -10.535 95 HG2 ARG 14 HG2 ARG 14 26.615 8.372 -11.927 96 HG3 ARG 14 HG3 ARG 14 25.804 9.732 -11.141 97 HD2 ARG 14 HD2 ARG 14 28.142 10.248 -12.960 98 HD3 ARG 14 HD3 ARG 14 26.571 9.849 -13.646 99 HE ARG 14 HE ARG 14 27.163 12.246 -11.931 100 HH11 ARG 14 HH12 ARG 14 24.734 10.671 -14.010 101 HH12 ARG 14 HH11 ARG 14 23.743 12.123 -13.906 102 HH21 ARG 14 HH22 ARG 14 25.932 13.978 -12.147 103 HH22 ARG 14 HH21 ARG 14 24.412 13.886 -13.043 104 H VAL 15 H VAL 15 25.011 10.469 -9.249 105 HA VAL 15 HA VAL 15 25.249 13.316 -9.206 106 HB VAL 15 HB VAL 15 23.017 11.346 -8.773 107 HG11 VAL 15 HG11 VAL 15 21.361 13.162 -8.564 108 HG12 VAL 15 HG12 VAL 15 22.373 12.911 -7.139 109 HG13 VAL 15 HG13 VAL 15 22.692 14.288 -8.220 110 HG21 VAL 15 HG21 VAL 15 22.052 12.464 -10.697 111 HG22 VAL 15 HG22 VAL 15 23.336 13.701 -10.661 112 HG23 VAL 15 HG23 VAL 15 23.714 12.005 -11.046 113 H ASP 16 H ASP 16 25.328 11.027 -6.533 114 HA ASP 16 HA ASP 16 24.876 13.166 -4.550 115 HB2 ASP 16 HB2 ASP 16 24.299 10.670 -4.292 116 HB3 ASP 16 HB3 ASP 16 26.024 10.422 -3.995 117 H LEU 17 H LEU 17 27.713 11.423 -5.811 118 HA LEU 17 HA LEU 17 29.628 12.536 -4.099 119 HB2 LEU 17 HB2 LEU 17 29.831 11.177 -6.795 120 HB3 LEU 17 HB3 LEU 17 31.222 11.905 -6.008 121 HG LEU 17 HG LEU 17 30.542 10.535 -3.889 122 HD11 LEU 17 HD11 LEU 17 29.140 8.912 -6.057 123 HD12 LEU 17 HD12 LEU 17 28.373 9.667 -4.640 124 HD13 LEU 17 HD13 LEU 17 29.513 8.343 -4.416 125 HD21 LEU 17 HD21 LEU 17 31.680 9.221 -6.372 126 HD22 LEU 17 HD22 LEU 17 31.881 8.650 -4.692 127 HD23 LEU 17 HD23 LEU 17 32.552 10.216 -5.176 128 H GLU 18 H GLU 18 28.548 13.620 -7.200 129 HA GLU 18 HA GLU 18 30.201 15.996 -7.368 130 HB2 GLU 18 HB2 GLU 18 28.640 16.737 -9.146 131 HB3 GLU 18 HB3 GLU 18 29.335 15.131 -9.372 132 HG2 GLU 18 HG2 GLU 18 27.147 14.229 -8.287 133 HG3 GLU 18 HG3 GLU 18 26.506 15.819 -8.525 134 H ALA 19 H ALA 19 26.978 15.406 -5.826 135 HA ALA 19 HA ALA 19 26.597 18.167 -5.084 136 HB1 ALA 19 HB1 ALA 19 24.870 16.307 -5.115 137 HB2 ALA 19 HB2 ALA 19 25.587 15.697 -3.615 138 HB3 ALA 19 HB3 ALA 19 24.871 17.317 -3.650 139 H VAL 20 H VAL 20 28.233 15.450 -3.395 140 HA VAL 20 HA VAL 20 29.115 16.973 -1.108 141 HB VAL 20 HB VAL 20 30.275 14.489 -2.418 142 HG11 VAL 20 HG11 VAL 20 32.054 15.531 -1.085 143 HG12 VAL 20 HG12 VAL 20 30.937 15.742 0.285 144 HG13 VAL 20 HG13 VAL 20 31.428 14.116 -0.240 145 HG21 VAL 20 HG21 VAL 20 28.574 14.851 0.096 146 HG22 VAL 20 HG22 VAL 20 27.981 14.225 -1.453 147 HG23 VAL 20 HG23 VAL 20 29.190 13.314 -0.548 148 H ARG 21 H ARG 21 30.818 16.301 -4.188 149 HA ARG 21 HA ARG 21 33.023 17.953 -3.798 150 HB2 ARG 21 HB2 ARG 21 32.694 16.428 -5.732 151 HB3 ARG 21 HB3 ARG 21 31.487 17.519 -6.398 152 HG2 ARG 21 HG2 ARG 21 33.641 17.725 -7.535 153 HG3 ARG 21 HG3 ARG 21 33.112 19.238 -6.809 154 HD2 ARG 21 HD2 ARG 21 35.526 18.899 -6.525 155 HD3 ARG 21 HD3 ARG 21 34.702 18.964 -4.961 156 HE ARG 21 HE ARG 21 34.943 16.234 -5.888 157 HH11 ARG 21 HH11 ARG 21 36.977 18.746 -4.537 158 HH12 ARG 21 HH12 ARG 21 38.063 17.601 -3.800 159 HH21 ARG 21 HH21 ARG 21 36.362 14.822 -4.914 160 HH22 ARG 21 HH22 ARG 21 37.723 15.434 -4.025 161 H LEU 22 H LEU 22 29.818 19.014 -4.911 162 HA LEU 22 HA LEU 22 30.520 21.810 -5.074 163 HB2 LEU 22 HB2 LEU 22 27.942 20.318 -5.258 164 HB3 LEU 22 HB3 LEU 22 27.903 21.996 -4.698 165 HG LEU 22 HG LEU 22 29.378 22.610 -6.704 166 HD11 LEU 22 HD11 LEU 22 30.069 20.334 -7.381 167 HD12 LEU 22 HD12 LEU 22 29.184 21.157 -8.674 168 HD13 LEU 22 HD13 LEU 22 28.369 19.919 -7.707 169 HD21 LEU 22 HD21 LEU 22 26.560 21.617 -7.157 170 HD22 LEU 22 HD22 LEU 22 27.447 22.813 -8.154 171 HD23 LEU 22 HD23 LEU 22 27.051 23.188 -6.464 172 H ALA 23 H ALA 23 29.257 19.898 -2.289 173 HA ALA 23 HA ALA 23 29.021 22.173 -0.589 174 HB1 ALA 23 HB1 ALA 23 29.965 19.379 0.150 175 HB2 ALA 23 HB2 ALA 23 29.216 20.586 1.226 176 HB3 ALA 23 HB3 ALA 23 28.275 19.865 -0.090 177 H SER 24 H SER 24 31.974 20.347 -1.501 178 HA SER 24 HA SER 24 33.775 22.067 -0.125 179 HB2 SER 24 HB2 SER 24 34.393 20.378 -2.568 180 HB3 SER 24 HB3 SER 24 35.541 21.058 -1.410 181 HG SER 24 HG SER 24 35.056 18.884 -0.917 182 H ILE 25 H ILE 25 32.566 22.329 -3.552 183 HA ILE 25 HA ILE 25 34.286 24.559 -4.099 184 HB ILE 25 HB ILE 25 31.633 24.322 -5.449 185 HG12 ILE 25 HG12 ILE 25 32.401 22.072 -5.695 186 HG13 ILE 25 HG13 ILE 25 32.644 22.911 -7.174 187 HG21 ILE 25 HG21 ILE 25 34.418 25.218 -6.347 188 HG22 ILE 25 HG22 ILE 25 32.956 25.224 -7.346 189 HG23 ILE 25 HG23 ILE 25 33.066 26.276 -5.937 190 HD11 ILE 25 HD11 ILE 25 34.826 22.229 -5.179 191 HD12 ILE 25 HD12 ILE 25 34.427 21.340 -6.653 192 HD13 ILE 25 HD13 ILE 25 35.064 22.998 -6.781 193 H VAL 26 H VAL 26 31.005 24.309 -2.674 194 HA VAL 26 HA VAL 26 30.478 27.161 -2.516 195 HB VAL 26 HB VAL 26 29.376 24.798 -0.971 196 HG11 VAL 26 HG11 VAL 26 28.345 27.664 -1.185 197 HG12 VAL 26 HG12 VAL 26 27.433 26.302 -0.491 198 HG13 VAL 26 HG13 VAL 26 28.921 26.849 0.284 199 HG21 VAL 26 HG21 VAL 26 28.959 24.924 -3.565 200 HG22 VAL 26 HG22 VAL 26 27.563 24.756 -2.515 201 HG23 VAL 26 HG23 VAL 26 27.986 26.345 -3.202 202 H ASP 27 H ASP 27 31.674 24.760 0.017 203 HA ASP 27 HA ASP 27 32.384 26.624 1.972 204 HB2 ASP 27 HB2 ASP 27 32.689 24.269 2.352 205 HB3 ASP 27 HB3 ASP 27 33.851 24.142 1.026 206 H SER 28 H SER 28 34.375 25.767 -0.870 207 HA SER 28 HA SER 28 36.540 27.511 -0.369 208 HB2 SER 28 HB2 SER 28 35.475 26.766 -3.124 209 HB3 SER 28 HB3 SER 28 37.089 27.365 -2.730 210 HG SER 28 HG SER 28 35.909 24.902 -1.895 211 H ARG 29 H ARG 29 33.414 28.241 -1.835 212 HA ARG 29 HA ARG 29 34.004 31.060 -2.354 213 HB2 ARG 29 HB2 ARG 29 32.412 29.687 -3.695 214 HB3 ARG 29 HB3 ARG 29 31.360 29.534 -2.299 215 HG2 ARG 29 HG2 ARG 29 30.452 31.223 -3.672 216 HG3 ARG 29 HG3 ARG 29 31.101 32.013 -2.244 217 HD2 ARG 29 HD2 ARG 29 33.008 32.841 -3.486 218 HD3 ARG 29 HD3 ARG 29 32.591 31.811 -4.883 219 HE ARG 29 HE ARG 29 30.472 33.684 -4.087 220 HH11 ARG 29 HH11 ARG 29 33.412 33.551 -5.980 221 HH12 ARG 29 HH12 ARG 29 32.869 34.770 -7.099 222 HH21 ARG 29 HH21 ARG 29 29.721 35.076 -5.709 223 HH22 ARG 29 HH22 ARG 29 30.860 35.655 -6.890 224 H LEU 30 H LEU 30 32.316 29.298 0.331 225 HA LEU 30 HA LEU 30 31.543 31.737 1.659 226 HB2 LEU 30 HB2 LEU 30 32.090 29.021 2.886 227 HB3 LEU 30 HB3 LEU 30 31.258 30.378 3.655 228 HG LEU 30 HG LEU 30 30.273 28.754 1.296 229 HD11 LEU 30 HD11 LEU 30 28.499 28.065 2.818 230 HD12 LEU 30 HD12 LEU 30 29.149 29.104 4.097 231 HD13 LEU 30 HD13 LEU 30 30.062 27.677 3.554 232 HD21 LEU 30 HD21 LEU 30 28.959 31.178 2.578 233 HD22 LEU 30 HD22 LEU 30 28.174 30.059 1.445 234 HD23 LEU 30 HD23 LEU 30 29.512 31.038 0.886 235 H ILE 31 H ILE 31 34.550 29.834 1.838 236 HA ILE 31 HA ILE 31 35.905 31.639 3.673 237 HB ILE 31 HB ILE 31 36.887 29.563 1.674 238 HG12 ILE 31 HG12 ILE 31 36.799 29.466 4.729 239 HG13 ILE 31 HG13 ILE 31 35.521 28.815 3.711 240 HG21 ILE 31 HG21 ILE 31 38.508 31.067 3.783 241 HG22 ILE 31 HG22 ILE 31 39.093 29.689 2.829 242 HG23 ILE 31 HG23 ILE 31 38.708 31.191 2.020 243 HD11 ILE 31 HD11 ILE 31 38.391 27.818 3.792 244 HD12 ILE 31 HD12 ILE 31 36.935 27.003 4.372 245 HD13 ILE 31 HD13 ILE 31 37.152 27.272 2.632 246 H GLY 32 H GLY 32 35.548 31.505 0.141 247 HA2 GLY 32 HA2 GLY 32 37.578 33.309 -0.626 248 HA3 GLY 32 HA3 GLY 32 36.152 32.798 -1.563 249 H THR 33 H THR 33 34.110 33.779 0.017 250 HA THR 33 HA THR 33 34.494 36.662 0.327 251 HB THR 33 HB THR 33 34.180 36.384 -2.119 252 HG1 THR 33 HG1 THR 33 32.606 37.949 -2.306 253 HG21 THR 33 HG21 THR 33 31.307 35.594 -1.526 254 HG22 THR 33 HG22 THR 33 32.573 34.404 -1.913 255 HG23 THR 33 HG23 THR 33 32.139 35.666 -3.089 256 H GLY 34 H GLY 34 32.377 33.825 0.685 257 HA2 GLY 34 HA2 GLY 34 31.124 33.521 2.684 258 HA3 GLY 34 HA3 GLY 34 30.963 35.252 2.901 259 H SER 35 H SER 35 30.270 34.401 -0.272 260 HA SER 35 HA SER 35 27.399 33.831 0.085 261 HB2 SER 35 HB2 SER 35 28.434 36.274 -1.413 262 HB3 SER 35 HB3 SER 35 26.777 35.646 -1.507 263 HG SER 35 HG SER 35 27.010 37.350 0.029 264 H VAL 36 H VAL 36 26.549 32.756 -1.678 265 HA VAL 36 HA VAL 36 28.406 32.076 -3.924 266 HB VAL 36 HB VAL 36 28.026 30.141 -2.281 267 HG11 VAL 36 HG11 VAL 36 25.541 30.543 -2.027 268 HG12 VAL 36 HG12 VAL 36 25.331 29.962 -3.690 269 HG13 VAL 36 HG13 VAL 36 26.008 28.881 -2.460 270 HG21 VAL 36 HG21 VAL 36 27.839 28.518 -4.104 271 HG22 VAL 36 HG22 VAL 36 27.267 29.794 -5.203 272 HG23 VAL 36 HG23 VAL 36 28.917 29.846 -4.538 273 H ASP 37 H ASP 37 27.469 32.204 -5.976 274 HA ASP 37 HA ASP 37 24.674 33.162 -6.137 275 HB2 ASP 37 HB2 ASP 37 26.967 34.211 -7.811 276 HB3 ASP 37 HB3 ASP 37 25.364 34.895 -7.594 277 H GLU 38 H GLU 38 23.637 32.721 -8.158 278 HA GLU 38 HA GLU 38 24.049 30.225 -9.236 279 HB2 GLU 38 HB2 GLU 38 22.098 32.014 -9.577 280 HB3 GLU 38 HB3 GLU 38 22.982 32.396 -11.052 281 HG2 GLU 38 HG2 GLU 38 22.921 29.722 -11.350 282 HG3 GLU 38 HG3 GLU 38 21.564 29.860 -10.236 283 H ASP 39 H ASP 39 25.490 33.272 -10.530 284 HA ASP 39 HA ASP 39 26.686 32.116 -12.796 285 HB2 ASP 39 HB2 ASP 39 26.167 34.528 -12.403 286 HB3 ASP 39 HB3 ASP 39 27.499 34.591 -11.246 287 H PHE 40 H PHE 40 27.718 32.006 -9.423 288 HA PHE 40 HA PHE 40 30.474 31.231 -10.131 289 HB2 PHE 40 HB2 PHE 40 30.049 32.420 -8.040 290 HB3 PHE 40 HB3 PHE 40 28.932 31.164 -7.514 291 HD1 PHE 40 HD2 PHE 40 32.522 31.833 -8.348 292 HD2 PHE 40 HD1 PHE 40 29.705 29.130 -6.525 293 HE1 PHE 40 HE2 PHE 40 34.400 30.532 -7.364 294 HE2 PHE 40 HE1 PHE 40 31.569 27.876 -5.488 295 HZ PHE 40 HZ PHE 40 33.928 28.563 -5.924 296 H LEU 41 H LEU 41 27.377 29.569 -9.276 297 HA LEU 41 HA LEU 41 28.747 26.968 -9.260 298 HB2 LEU 41 HB2 LEU 41 25.896 27.887 -8.794 299 HB3 LEU 41 HB3 LEU 41 26.343 26.181 -8.765 300 HG LEU 41 HG LEU 41 27.417 28.342 -6.916 301 HD11 LEU 41 HD11 LEU 41 25.079 27.696 -6.472 302 HD12 LEU 41 HD12 LEU 41 26.149 27.104 -5.190 303 HD13 LEU 41 HD13 LEU 41 25.550 25.979 -6.428 304 HD21 LEU 41 HD21 LEU 41 28.389 26.414 -5.625 305 HD22 LEU 41 HD22 LEU 41 29.176 26.667 -7.177 306 HD23 LEU 41 HD23 LEU 41 27.996 25.348 -6.990 307 H ARG 42 H ARG 42 26.658 28.605 -11.611 308 HA ARG 42 HA ARG 42 26.139 26.425 -13.307 309 HB2 ARG 42 HB2 ARG 42 25.919 27.970 -15.141 310 HB3 ARG 42 HB3 ARG 42 25.177 28.573 -13.657 311 HG2 ARG 42 HG2 ARG 42 27.138 30.035 -13.256 312 HG3 ARG 42 HG3 ARG 42 27.912 29.411 -14.714 313 HD2 ARG 42 HD2 ARG 42 26.950 31.516 -15.182 314 HD3 ARG 42 HD3 ARG 42 26.114 30.288 -16.122 315 HE ARG 42 HE ARG 42 24.317 30.422 -14.257 316 HH11 ARG 42 HH11 ARG 42 26.146 33.342 -15.043 317 HH12 ARG 42 HH12 ARG 42 24.692 34.301 -15.095 318 HH21 ARG 42 HH21 ARG 42 22.592 31.755 -14.111 319 HH22 ARG 42 HH22 ARG 42 22.763 33.459 -14.472 320 H GLU 43 H GLU 43 29.294 28.012 -13.037 321 HA GLU 43 HA GLU 43 30.442 26.300 -15.123 322 HB2 GLU 43 HB2 GLU 43 32.536 27.513 -14.581 323 HB3 GLU 43 HB3 GLU 43 31.193 28.558 -15.051 324 HG2 GLU 43 HG2 GLU 43 30.856 29.316 -12.809 325 HG3 GLU 43 HG3 GLU 43 31.863 28.020 -12.158 326 H GLN 44 H GLN 44 29.527 25.334 -12.057 327 HA GLN 44 HA GLN 44 32.037 23.806 -11.556 328 HB2 GLN 44 HB2 GLN 44 30.006 24.956 -9.590 329 HB3 GLN 44 HB3 GLN 44 31.424 24.011 -9.153 330 HG2 GLN 44 HG2 GLN 44 31.457 26.698 -10.546 331 HG3 GLN 44 HG3 GLN 44 31.767 26.462 -8.844 332 HE21 GLN 44 HE21 GLN 44 33.522 27.604 -11.044 333 HE22 GLN 44 HE22 GLN 44 34.972 26.623 -10.938 334 H ILE 45 H ILE 45 28.762 23.467 -12.374 335 HA ILE 45 HA ILE 45 27.777 21.417 -10.769 336 HB ILE 45 HB ILE 45 26.727 20.685 -13.160 337 HG12 ILE 45 HG12 ILE 45 26.915 23.617 -13.707 338 HG13 ILE 45 HG13 ILE 45 28.218 22.564 -14.328 339 HG21 ILE 45 HG21 ILE 45 26.021 23.131 -11.551 340 HG22 ILE 45 HG22 ILE 45 24.916 22.203 -12.619 341 HG23 ILE 45 HG23 ILE 45 25.604 21.428 -11.180 342 HD11 ILE 45 HD11 ILE 45 25.252 22.301 -14.938 343 HD12 ILE 45 HD12 ILE 45 26.543 22.803 -16.045 344 HD13 ILE 45 HD13 ILE 45 26.499 21.132 -15.435 345 H ARG 46 H ARG 46 29.535 20.824 -13.874 346 HA ARG 46 HA ARG 46 30.997 19.508 -14.455 347 HB2 ARG 46 HB2 ARG 46 30.952 18.277 -11.688 348 HB3 ARG 46 HB3 ARG 46 31.938 17.598 -12.977 349 HG2 ARG 46 HG2 ARG 46 33.295 19.509 -13.177 350 HG3 ARG 46 HG3 ARG 46 32.170 20.545 -12.295 351 HD2 ARG 46 HD2 ARG 46 32.614 19.353 -10.201 352 HD3 ARG 46 HD3 ARG 46 33.601 18.167 -11.056 353 HE ARG 46 HE ARG 46 35.387 19.623 -11.126 354 HH11 ARG 46 HH11 ARG 46 32.621 21.563 -10.104 355 HH12 ARG 46 HH12 ARG 46 33.660 22.953 -9.794 356 HH21 ARG 46 HH21 ARG 46 36.578 21.441 -10.661 357 HH22 ARG 46 HH22 ARG 46 35.784 22.870 -10.061 358 H ASP 47 H ASP 47 28.086 18.318 -13.400 359 HA ASP 47 HA ASP 47 27.685 16.990 -15.947 360 HB2 ASP 47 HB2 ASP 47 28.816 15.181 -14.497 361 HB3 ASP 47 HB3 ASP 47 27.361 15.185 -13.515 362 H ALA 48 H ALA 48 26.545 17.155 -12.746 363 HA ALA 48 HA ALA 48 23.943 17.074 -12.480 364 HB1 ALA 48 HB1 ALA 48 25.745 19.281 -11.437 365 HB2 ALA 48 HB2 ALA 48 24.048 19.168 -10.936 366 HB3 ALA 48 HB3 ALA 48 25.191 17.842 -10.598 367 H ARG 49 H ARG 49 22.050 17.823 -13.343 368 HA ARG 49 HA ARG 49 22.134 19.838 -15.450 369 HB2 ARG 49 HB2 ARG 49 20.487 17.750 -15.090 370 HB3 ARG 49 HB3 ARG 49 19.536 18.949 -14.222 371 HG2 ARG 49 HG2 ARG 49 18.653 19.095 -16.339 372 HG3 ARG 49 HG3 ARG 49 19.834 20.398 -16.413 373 HD2 ARG 49 HD2 ARG 49 20.223 17.556 -17.488 374 HD3 ARG 49 HD3 ARG 49 19.730 18.942 -18.447 375 HE ARG 49 HE ARG 49 21.870 19.891 -18.324 376 HH11 ARG 49 HH11 ARG 49 21.941 16.702 -16.794 377 HH12 ARG 49 HH12 ARG 49 23.659 16.866 -16.462 378 HH21 ARG 49 HH21 ARG 49 24.094 19.844 -17.992 379 HH22 ARG 49 HH22 ARG 49 24.771 18.493 -17.101 380 H TYR 50 H TYR 50 20.673 19.850 -12.159 381 HA TYR 50 HA TYR 50 20.872 22.816 -12.135 382 HB2 TYR 50 HB2 TYR 50 18.805 21.177 -10.658 383 HB3 TYR 50 HB3 TYR 50 18.716 22.853 -11.127 384 HD1 TYR 50 HD1 TYR 50 19.113 22.881 -14.012 385 HD2 TYR 50 HD2 TYR 50 17.074 19.967 -11.594 386 HE1 TYR 50 HE1 TYR 50 17.727 22.230 -15.975 387 HE2 TYR 50 HE2 TYR 50 15.698 19.297 -13.554 388 HH TYR 50 HH TYR 50 15.241 19.670 -15.772 389 H ALA 51 H ALA 51 22.358 23.479 -10.535 390 HA ALA 51 HA ALA 51 22.802 21.703 -8.167 391 HB1 ALA 51 HB1 ALA 51 24.613 23.328 -7.642 392 HB2 ALA 51 HB2 ALA 51 24.852 22.491 -9.185 393 HB3 ALA 51 HB3 ALA 51 24.279 24.174 -9.165 394 H VAL 52 H VAL 52 22.271 22.561 -5.969 395 HA VAL 52 HA VAL 52 20.415 24.896 -5.981 396 HB VAL 52 HB VAL 52 19.695 22.026 -5.343 397 HG11 VAL 52 HG11 VAL 52 18.861 23.278 -3.425 398 HG12 VAL 52 HG12 VAL 52 18.195 24.538 -4.484 399 HG13 VAL 52 HG13 VAL 52 17.508 22.903 -4.487 400 HG21 VAL 52 HG21 VAL 52 17.738 22.522 -6.782 401 HG22 VAL 52 HG22 VAL 52 18.413 24.127 -7.122 402 HG23 VAL 52 HG23 VAL 52 19.267 22.659 -7.642 403 H ILE 53 H ILE 53 20.535 26.043 -4.279 404 HA ILE 53 HA ILE 53 22.296 25.172 -2.030 405 HB ILE 53 HB ILE 53 21.998 27.648 -3.644 406 HG12 ILE 53 HG12 ILE 53 23.834 25.969 -3.894 407 HG13 ILE 53 HG13 ILE 53 24.363 27.626 -3.645 408 HG21 ILE 53 HG21 ILE 53 21.513 28.760 -1.568 409 HG22 ILE 53 HG22 ILE 53 22.820 27.904 -0.723 410 HG23 ILE 53 HG23 ILE 53 23.190 29.086 -1.990 411 HD11 ILE 53 HD11 ILE 53 24.871 27.149 -1.269 412 HD12 ILE 53 HD12 ILE 53 24.288 25.495 -1.448 413 HD13 ILE 53 HD13 ILE 53 25.717 26.032 -2.347 414 H ARG 54 H ARG 54 21.879 25.275 -0.007 415 HA ARG 54 HA ARG 54 19.828 27.129 1.086 416 HB2 ARG 54 HB2 ARG 54 18.916 24.817 0.621 417 HB3 ARG 54 HB3 ARG 54 19.960 24.233 1.905 418 HG2 ARG 54 HG2 ARG 54 17.717 26.291 2.139 419 HG3 ARG 54 HG3 ARG 54 17.596 24.596 2.586 420 HD2 ARG 54 HD2 ARG 54 19.364 26.654 3.966 421 HD3 ARG 54 HD3 ARG 54 17.811 26.091 4.540 422 HE ARG 54 HE ARG 54 20.375 24.598 4.503 423 HH11 ARG 54 HH11 ARG 54 16.973 24.510 5.398 424 HH12 ARG 54 HH12 ARG 54 17.186 23.136 6.445 425 HH21 ARG 54 HH21 ARG 54 20.541 22.762 5.762 426 HH22 ARG 54 HH22 ARG 54 19.165 22.203 6.681 427 H ILE 55 H ILE 55 21.741 28.185 1.449 428 HA ILE 55 HA ILE 55 23.553 27.321 3.676 429 HB ILE 55 HB ILE 55 23.529 29.859 2.013 430 HG12 ILE 55 HG12 ILE 55 25.888 27.991 2.085 431 HG13 ILE 55 HG13 ILE 55 24.508 27.534 1.080 432 HG21 ILE 55 HG21 ILE 55 24.325 30.420 4.254 433 HG22 ILE 55 HG22 ILE 55 25.381 28.991 4.292 434 HG23 ILE 55 HG23 ILE 55 25.730 30.339 3.197 435 HD11 ILE 55 HD11 ILE 55 25.986 30.195 0.929 436 HD12 ILE 55 HD12 ILE 55 26.246 28.803 -0.133 437 HD13 ILE 55 HD13 ILE 55 24.672 29.647 -0.129 438 HA PRO 56 HA PRO 56 20.402 29.267 6.320 439 HB2 PRO 56 HB2 PRO 56 22.598 29.023 8.360 440 HB3 PRO 56 HB3 PRO 56 20.858 28.634 8.521 441 HG2 PRO 56 HG2 PRO 56 22.658 26.639 8.162 442 HG3 PRO 56 HG3 PRO 56 21.108 26.617 7.259 443 HD2 PRO 56 HD2 PRO 56 23.832 27.524 6.288 444 HD3 PRO 56 HD3 PRO 56 22.620 26.476 5.477 445 H GLY 57 H GLY 57 20.001 31.379 6.608 446 HA2 GLY 57 HA2 GLY 57 20.324 33.600 7.197 447 HA3 GLY 57 HA3 GLY 57 22.064 33.353 7.291 448 H GLN 58 H GLN 58 21.174 32.177 4.243 449 HA GLN 58 HA GLN 58 20.938 34.833 2.994 450 HB2 GLN 58 HB2 GLN 58 22.826 34.692 1.615 451 HB3 GLN 58 HB3 GLN 58 23.352 34.168 3.209 452 HG2 GLN 58 HG2 GLN 58 23.305 31.874 2.552 453 HG3 GLN 58 HG3 GLN 58 22.742 32.276 0.912 454 HE21 GLN 58 HE21 GLN 58 25.419 33.193 3.205 455 HE22 GLN 58 HE22 GLN 58 26.637 33.318 1.954 456 HA PRO 59 HA PRO 59 18.042 33.327 0.271 457 HB2 PRO 59 HB2 PRO 59 19.638 34.180 -2.147 458 HB3 PRO 59 HB3 PRO 59 17.935 34.548 -1.732 459 HG2 PRO 59 HG2 PRO 59 19.868 36.400 -1.332 460 HG3 PRO 59 HG3 PRO 59 18.611 36.138 -0.077 461 HD2 PRO 59 HD2 PRO 59 21.452 35.064 -0.137 462 HD3 PRO 59 HD3 PRO 59 20.536 35.812 1.198 463 H VAL 60 H VAL 60 17.307 31.499 -0.606 464 HA VAL 60 HA VAL 60 18.995 29.325 -1.497 465 HB VAL 60 HB VAL 60 16.005 29.878 -1.623 466 HG11 VAL 60 HG11 VAL 60 17.386 27.318 -2.517 467 HG12 VAL 60 HG12 VAL 60 15.651 27.494 -2.203 468 HG13 VAL 60 HG13 VAL 60 16.397 28.403 -3.514 469 HG21 VAL 60 HG21 VAL 60 17.629 27.884 0.011 470 HG22 VAL 60 HG22 VAL 60 16.971 29.418 0.621 471 HG23 VAL 60 HG23 VAL 60 15.874 28.133 0.100 472 H VAL 61 H VAL 61 20.075 29.360 -3.269 473 HA VAL 61 HA VAL 61 18.923 30.517 -5.774 474 HB VAL 61 HB VAL 61 20.866 31.721 -5.014 475 HG11 VAL 61 HG11 VAL 61 22.173 30.031 -3.880 476 HG12 VAL 61 HG12 VAL 61 22.457 29.159 -5.416 477 HG13 VAL 61 HG13 VAL 61 23.134 30.780 -5.153 478 HG21 VAL 61 HG21 VAL 61 21.525 30.178 -7.552 479 HG22 VAL 61 HG22 VAL 61 20.339 31.512 -7.445 480 HG23 VAL 61 HG23 VAL 61 22.042 31.813 -7.088 481 H GLU 62 H GLU 62 19.139 29.387 -7.758 482 HA GLU 62 HA GLU 62 19.485 26.474 -7.497 483 HB2 GLU 62 HB2 GLU 62 16.885 27.804 -8.392 484 HB3 GLU 62 HB3 GLU 62 17.254 26.076 -8.472 485 HG2 GLU 62 HG2 GLU 62 17.480 26.045 -5.983 486 HG3 GLU 62 HG3 GLU 62 17.013 27.744 -5.927 487 H VAL 63 H VAL 63 20.855 26.067 -9.133 488 HA VAL 63 HA VAL 63 21.239 27.900 -11.360 489 HB VAL 63 HB VAL 63 22.560 25.253 -10.705 490 HG11 VAL 63 HG11 VAL 63 23.161 25.932 -12.964 491 HG12 VAL 63 HG12 VAL 63 23.549 27.577 -12.383 492 HG13 VAL 63 HG13 VAL 63 24.520 26.174 -11.876 493 HG21 VAL 63 HG21 VAL 63 22.811 26.799 -8.772 494 HG22 VAL 63 HG22 VAL 63 24.315 26.491 -9.611 495 HG23 VAL 63 HG23 VAL 63 23.473 28.030 -9.872 496 H GLY 64 H GLY 64 21.263 27.290 -13.630 497 HA2 GLY 64 HA2 GLY 64 20.654 26.137 -15.504 498 HA3 GLY 64 HA3 GLY 64 20.301 24.737 -14.497 499 H THR 65 H THR 65 18.113 24.583 -13.535 500 HA THR 65 HA THR 65 15.988 26.377 -14.341 501 HB THR 65 HB THR 65 15.787 23.586 -15.557 502 HG1 THR 65 HG1 THR 65 17.064 25.802 -16.485 503 HG21 THR 65 HG21 THR 65 14.200 26.154 -15.980 504 HG22 THR 65 HG22 THR 65 13.604 24.604 -15.331 505 HG23 THR 65 HG23 THR 65 14.075 24.719 -17.018 506 H LYS 66 H LYS 66 13.888 25.678 -13.356 507 HA LYS 66 HA LYS 66 14.225 24.144 -10.936 508 HB2 LYS 66 HB2 LYS 66 12.666 26.160 -11.304 509 HB3 LYS 66 HB3 LYS 66 11.633 25.093 -12.246 510 HG2 LYS 66 HG2 LYS 66 10.643 25.148 -10.124 511 HG3 LYS 66 HG3 LYS 66 11.493 23.603 -10.136 512 HD2 LYS 66 HD2 LYS 66 13.405 24.748 -8.889 513 HD3 LYS 66 HD3 LYS 66 12.417 26.219 -8.848 514 HE2 LYS 66 HE2 LYS 66 10.617 24.902 -7.657 515 HE3 LYS 66 HE3 LYS 66 11.720 23.516 -7.610 516 HZ1 LYS 66 HZ1 LYS 66 11.907 24.741 -5.551 517 HZ2 LYS 66 HZ2 LYS 66 12.177 26.160 -6.328 518 HZ3 LYS 66 HZ3 LYS 66 13.311 24.996 -6.386 519 HA PRO 67 HA PRO 67 13.388 20.209 -12.901 520 HB2 PRO 67 HB2 PRO 67 13.217 18.587 -10.721 521 HB3 PRO 67 HB3 PRO 67 14.763 19.323 -11.263 522 HG2 PRO 67 HG2 PRO 67 12.889 20.293 -9.088 523 HG3 PRO 67 HG3 PRO 67 14.671 20.097 -9.042 524 HD2 PRO 67 HD2 PRO 67 13.479 22.498 -9.560 525 HD3 PRO 67 HD3 PRO 67 15.033 22.024 -10.318 526 H THR 68 H THR 68 11.814 18.779 -13.314 527 HA THR 68 HA THR 68 9.130 19.585 -12.853 528 HB THR 68 HB THR 68 10.001 18.791 -14.993 529 HG1 THR 68 HG1 THR 68 8.180 17.615 -15.538 530 HG21 THR 68 HG21 THR 68 10.273 16.458 -15.526 531 HG22 THR 68 HG22 THR 68 9.790 15.954 -13.897 532 HG23 THR 68 HG23 THR 68 11.332 16.806 -14.152 533 H GLY 69 H GLY 69 10.909 16.878 -11.488 534 HA2 GLY 69 HA2 GLY 69 9.824 16.291 -9.172 535 HA3 GLY 69 HA3 GLY 69 8.457 15.785 -10.180 536 H ASP 70 H ASP 70 9.732 14.598 -12.304 537 HA ASP 70 HA ASP 70 10.749 12.073 -11.239 538 HB2 ASP 70 HB2 ASP 70 10.474 12.950 -14.114 539 HB3 ASP 70 HB3 ASP 70 10.732 11.301 -13.522 540 H VAL 71 H VAL 71 12.443 13.575 -10.193 541 HA VAL 71 HA VAL 71 14.923 13.579 -11.869 542 HB VAL 71 HB VAL 71 15.645 15.618 -10.711 543 HG11 VAL 71 HG11 VAL 71 14.389 17.146 -12.051 544 HG12 VAL 71 HG12 VAL 71 14.441 15.642 -12.944 545 HG13 VAL 71 HG13 VAL 71 12.962 16.097 -12.085 546 HG21 VAL 71 HG21 VAL 71 12.801 15.881 -9.656 547 HG22 VAL 71 HG22 VAL 71 14.197 15.405 -8.663 548 HG23 VAL 71 HG23 VAL 71 14.162 16.994 -9.422 549 H LEU 72 H LEU 72 16.895 13.594 -10.816 550 HA LEU 72 HA LEU 72 17.056 11.604 -8.596 551 HB2 LEU 72 HB2 LEU 72 19.013 12.540 -10.742 552 HB3 LEU 72 HB3 LEU 72 19.429 11.384 -9.479 553 HG LEU 72 HG LEU 72 17.182 10.999 -11.474 554 HD11 LEU 72 HD11 LEU 72 19.391 11.004 -12.607 555 HD12 LEU 72 HD12 LEU 72 18.708 9.374 -12.590 556 HD13 LEU 72 HD13 LEU 72 19.999 9.805 -11.443 557 HD21 LEU 72 HD21 LEU 72 17.434 8.574 -10.732 558 HD22 LEU 72 HD22 LEU 72 16.736 9.694 -9.549 559 HD23 LEU 72 HD23 LEU 72 18.432 9.202 -9.405 560 H GLN 73 H GLN 73 17.229 12.500 -6.653 561 HA GLN 73 HA GLN 73 18.488 15.122 -6.295 562 HB2 GLN 73 HB2 GLN 73 16.834 13.345 -4.487 563 HB3 GLN 73 HB3 GLN 73 17.491 14.925 -4.051 564 HG2 GLN 73 HG2 GLN 73 16.296 15.845 -6.134 565 HG3 GLN 73 HG3 GLN 73 15.411 14.324 -6.189 566 HE21 GLN 73 HE21 GLN 73 14.652 17.267 -5.554 567 HE22 GLN 73 HE22 GLN 73 13.789 17.120 -4.015 568 H GLY 74 H GLY 74 20.629 15.110 -6.170 569 HA2 GLY 74 HA2 GLY 74 22.137 13.261 -4.354 570 HA3 GLY 74 HA3 GLY 74 22.837 14.463 -5.455 571 H ARG 75 H ARG 75 23.506 14.347 -2.620 572 HA ARG 75 HA ARG 75 22.454 16.925 -1.636 573 HB2 ARG 75 HB2 ARG 75 20.702 15.127 -1.112 574 HB3 ARG 75 HB3 ARG 75 21.870 14.422 0.007 575 HG2 ARG 75 HG2 ARG 75 21.839 16.469 1.369 576 HG3 ARG 75 HG3 ARG 75 20.843 17.300 0.150 577 HD2 ARG 75 HD2 ARG 75 19.032 15.657 0.512 578 HD3 ARG 75 HD3 ARG 75 20.020 14.835 1.740 579 HE ARG 75 HE ARG 75 19.861 17.531 2.529 580 HH11 ARG 75 HH11 ARG 75 17.582 14.902 2.120 581 HH12 ARG 75 HH12 ARG 75 16.481 15.537 3.311 582 HH21 ARG 75 HH21 ARG 75 18.412 18.292 4.054 583 HH22 ARG 75 HH22 ARG 75 16.950 17.410 4.378 584 H ALA 76 H ALA 76 23.470 17.639 0.357 585 HA ALA 76 HA ALA 76 25.671 16.274 1.538 586 HB1 ALA 76 HB1 ALA 76 26.448 18.424 -0.495 587 HB2 ALA 76 HB2 ALA 76 27.557 17.672 0.679 588 HB3 ALA 76 HB3 ALA 76 26.825 16.701 -0.597 589 H THR 77 H THR 77 27.043 17.692 2.873 590 HA THR 77 HA THR 77 25.722 20.157 3.893 591 HB THR 77 HB THR 77 26.908 17.998 5.678 592 HG1 THR 77 HG1 THR 77 24.792 17.777 6.394 593 HG21 THR 77 HG21 THR 77 27.211 20.312 6.589 594 HG22 THR 77 HG22 THR 77 26.060 19.370 7.538 595 HG23 THR 77 HG23 THR 77 25.471 20.598 6.403 596 H GLY 78 H GLY 78 27.188 21.760 4.225 597 HA2 GLY 78 HA2 GLY 78 29.986 21.251 3.259 598 HA3 GLY 78 HA3 GLY 78 29.175 22.785 3.230 599 H GLU 79 H GLU 79 31.474 23.178 4.163 600 HA GLU 79 HA GLU 79 31.870 22.251 6.928 601 HB2 GLU 79 HB2 GLU 79 33.697 23.486 4.872 602 HB3 GLU 79 HB3 GLU 79 34.171 23.241 6.557 603 HG2 GLU 79 HG2 GLU 79 33.596 20.811 6.334 604 HG3 GLU 79 HG3 GLU 79 33.241 21.075 4.626 605 H GLU 80 H GLU 80 30.429 25.161 5.695 606 HA GLU 80 HA GLU 80 31.191 26.568 8.245 607 HB2 GLU 80 HB2 GLU 80 29.796 27.601 5.780 608 HB3 GLU 80 HB3 GLU 80 30.190 28.549 7.206 609 HG2 GLU 80 HG2 GLU 80 32.337 27.243 5.459 610 HG3 GLU 80 HG3 GLU 80 31.662 28.820 5.230 611 H GLY 81 H GLY 81 29.185 24.274 7.350 612 HA2 GLY 81 HA2 GLY 81 27.386 23.403 8.417 613 HA3 GLY 81 HA3 GLY 81 26.995 24.951 9.148 614 H GLU 82 H GLU 82 27.479 24.880 5.659 615 HA GLU 82 HA GLU 82 24.718 25.561 5.168 616 HB2 GLU 82 HB2 GLU 82 25.436 26.131 3.045 617 HB3 GLU 82 HB3 GLU 82 26.688 26.707 4.153 618 HG2 GLU 82 HG2 GLU 82 27.010 24.087 2.639 619 HG3 GLU 82 HG3 GLU 82 27.266 25.627 1.849 620 H THR 83 H THR 83 23.949 24.571 2.803 621 HA THR 83 HA THR 83 23.986 21.638 2.990 622 HB THR 83 HB THR 83 21.403 23.222 3.073 623 HG1 THR 83 HG1 THR 83 22.906 21.945 5.050 624 HG21 THR 83 HG21 THR 83 21.908 20.238 3.242 625 HG22 THR 83 HG22 THR 83 21.104 21.113 1.909 626 HG23 THR 83 HG23 THR 83 20.344 21.058 3.504 627 H VAL 84 H VAL 84 23.651 20.737 1.164 628 HA VAL 84 HA VAL 84 23.317 22.385 -1.358 629 HB VAL 84 HB VAL 84 25.564 20.416 -0.826 630 HG11 VAL 84 HG11 VAL 84 24.882 21.871 -3.423 631 HG12 VAL 84 HG12 VAL 84 26.377 20.961 -3.100 632 HG13 VAL 84 HG13 VAL 84 24.846 20.106 -3.164 633 HG21 VAL 84 HG21 VAL 84 26.039 22.619 0.095 634 HG22 VAL 84 HG22 VAL 84 26.981 22.414 -1.387 635 HG23 VAL 84 HG23 VAL 84 25.513 23.404 -1.414 636 H LEU 85 H LEU 85 22.348 21.456 -3.071 637 HA LEU 85 HA LEU 85 21.608 18.601 -2.979 638 HB2 LEU 85 HB2 LEU 85 19.731 19.996 -2.027 639 HB3 LEU 85 HB3 LEU 85 19.673 20.870 -3.535 640 HG LEU 85 HG LEU 85 19.233 18.474 -4.603 641 HD11 LEU 85 HD11 LEU 85 18.139 16.901 -3.179 642 HD12 LEU 85 HD12 LEU 85 18.136 18.020 -1.795 643 HD13 LEU 85 HD13 LEU 85 19.652 17.305 -2.347 644 HD21 LEU 85 HD21 LEU 85 17.596 20.286 -4.601 645 HD22 LEU 85 HD22 LEU 85 17.148 19.917 -2.923 646 HD23 LEU 85 HD23 LEU 85 16.815 18.742 -4.217 647 H VAL 86 H VAL 86 21.301 17.748 -5.002 648 HA VAL 86 HA VAL 86 21.947 19.356 -7.459 649 HB VAL 86 HB VAL 86 23.155 16.671 -6.696 650 HG11 VAL 86 HG11 VAL 86 24.093 16.599 -9.007 651 HG12 VAL 86 HG12 VAL 86 22.351 16.359 -8.973 652 HG13 VAL 86 HG13 VAL 86 22.982 17.934 -9.452 653 HG21 VAL 86 HG21 VAL 86 25.266 17.800 -7.287 654 HG22 VAL 86 HG22 VAL 86 24.377 19.274 -7.732 655 HG23 VAL 86 HG23 VAL 86 24.405 18.725 -6.042 656 H GLU 87 H GLU 87 20.615 18.909 -9.198 657 HA GLU 87 HA GLU 87 18.803 16.588 -8.985 658 HB2 GLU 87 HB2 GLU 87 17.777 19.413 -9.398 659 HB3 GLU 87 HB3 GLU 87 16.830 17.918 -9.480 660 HG2 GLU 87 HG2 GLU 87 17.575 17.441 -7.088 661 HG3 GLU 87 HG3 GLU 87 18.250 19.068 -7.034 662 H GLU 88 H GLU 88 18.290 15.700 -10.812 663 HA GLU 88 HA GLU 88 18.512 16.954 -13.413 664 HB2 GLU 88 HB2 GLU 88 20.074 15.370 -14.364 665 HB3 GLU 88 HB3 GLU 88 20.824 16.368 -13.132 666 HG2 GLU 88 HG2 GLU 88 20.828 14.466 -11.587 667 HG3 GLU 88 HG3 GLU 88 19.950 13.479 -12.775 668 HA PRO 89 HA PRO 89 15.207 14.220 -14.335 669 HB2 PRO 89 HB2 PRO 89 15.565 13.440 -16.971 670 HB3 PRO 89 HB3 PRO 89 14.922 15.019 -16.425 671 HG2 PRO 89 HG2 PRO 89 17.773 14.328 -17.194 672 HG3 PRO 89 HG3 PRO 89 16.796 15.740 -17.712 673 HD2 PRO 89 HD2 PRO 89 18.580 15.982 -15.731 674 HD3 PRO 89 HD3 PRO 89 16.983 16.758 -15.561 675 H ARG 90 H ARG 90 14.614 12.260 -14.086 676 HA ARG 90 HA ARG 90 16.551 10.033 -13.815 677 HB2 ARG 90 HB2 ARG 90 14.841 10.488 -12.017 678 HB3 ARG 90 HB3 ARG 90 13.579 9.986 -13.148 679 HG2 ARG 90 HG2 ARG 90 14.494 7.750 -13.310 680 HG3 ARG 90 HG3 ARG 90 15.979 8.235 -12.483 681 HD2 ARG 90 HD2 ARG 90 14.509 8.739 -10.437 682 HD3 ARG 90 HD3 ARG 90 13.211 7.888 -11.300 683 HE ARG 90 HE ARG 90 15.736 6.399 -11.128 684 HH11 ARG 90 HH11 ARG 90 12.731 6.938 -9.396 685 HH12 ARG 90 HH12 ARG 90 12.927 5.481 -8.456 686 HH21 ARG 90 HH21 ARG 90 15.943 4.648 -9.895 687 HH22 ARG 90 HH22 ARG 90 14.705 4.169 -8.752 Start of MODEL 17 1 H1 GLY 1 H1 GLY 1 5.575 2.778 9.943 2 H2 GLY 1 H2 GLY 1 4.133 3.153 9.263 3 H3 GLY 1 H3 GLY 1 5.276 4.313 9.456 4 HA2 GLY 1 HA2 GLY 1 6.747 3.213 7.892 5 HA3 GLY 1 HA3 GLY 1 5.510 1.958 7.687 6 H SER 2 H SER 2 6.783 4.142 5.891 7 HA SER 2 HA SER 2 4.267 5.199 4.671 8 HB2 SER 2 HB2 SER 2 6.798 6.800 5.212 9 HB3 SER 2 HB3 SER 2 5.381 7.368 4.313 10 HG SER 2 HG SER 2 5.348 8.049 6.495 11 H GLU 3 H GLU 3 4.435 5.801 2.468 12 HA GLU 3 HA GLU 3 5.987 4.167 0.753 13 HB2 GLU 3 HB2 GLU 3 4.595 6.814 0.178 14 HB3 GLU 3 HB3 GLU 3 5.218 5.721 -1.055 15 HG2 GLU 3 HG2 GLU 3 3.001 5.081 0.934 16 HG3 GLU 3 HG3 GLU 3 2.801 5.456 -0.771 17 H THR 4 H THR 4 7.398 5.060 -1.099 18 HA THR 4 HA THR 4 9.424 6.997 -0.466 19 HB THR 4 HB THR 4 10.095 4.039 -0.063 20 HG1 THR 4 HG1 THR 4 9.242 5.784 1.569 21 HG21 THR 4 HG21 THR 4 12.385 4.856 0.594 22 HG22 THR 4 HG22 THR 4 11.989 6.436 -0.108 23 HG23 THR 4 HG23 THR 4 12.066 4.970 -1.130 24 H ARG 5 H ARG 5 11.196 6.803 -2.156 25 HA ARG 5 HA ARG 5 10.094 5.752 -4.751 26 HB2 ARG 5 HB2 ARG 5 11.666 7.375 -5.858 27 HB3 ARG 5 HB3 ARG 5 10.222 8.030 -5.087 28 HG2 ARG 5 HG2 ARG 5 11.508 8.848 -3.179 29 HG3 ARG 5 HG3 ARG 5 12.972 8.049 -3.767 30 HD2 ARG 5 HD2 ARG 5 13.042 10.410 -4.209 31 HD3 ARG 5 HD3 ARG 5 13.006 9.487 -5.728 32 HE ARG 5 HE ARG 5 10.378 10.397 -4.766 33 HH11 ARG 5 HH11 ARG 5 13.083 11.428 -6.787 34 HH12 ARG 5 HH12 ARG 5 12.047 12.492 -7.712 35 HH21 ARG 5 HH21 ARG 5 9.168 11.775 -6.070 36 HH22 ARG 5 HH22 ARG 5 9.980 12.654 -7.348 37 H THR 6 H THR 6 11.093 4.113 -5.659 38 HA THR 6 HA THR 6 13.715 3.148 -4.649 39 HB THR 6 HB THR 6 11.899 2.045 -6.829 40 HG1 THR 6 HG1 THR 6 11.072 1.886 -4.712 41 HG21 THR 6 HG21 THR 6 14.377 0.843 -5.503 42 HG22 THR 6 HG22 THR 6 14.196 1.268 -7.224 43 HG23 THR 6 HG23 THR 6 13.233 -0.042 -6.537 44 H ILE 7 H ILE 7 15.664 3.241 -5.851 45 HA ILE 7 HA ILE 7 15.773 4.671 -8.380 46 HB ILE 7 HB ILE 7 17.492 5.842 -6.253 47 HG12 ILE 7 HG12 ILE 7 14.624 6.777 -6.745 48 HG13 ILE 7 HG13 ILE 7 15.261 6.071 -5.244 49 HG21 ILE 7 HG21 ILE 7 17.410 7.782 -7.826 50 HG22 ILE 7 HG22 ILE 7 17.820 6.335 -8.727 51 HG23 ILE 7 HG23 ILE 7 16.166 6.973 -8.790 52 HD11 ILE 7 HD11 ILE 7 15.184 8.363 -4.890 53 HD12 ILE 7 HD12 ILE 7 16.892 7.913 -5.111 54 HD13 ILE 7 HD13 ILE 7 15.991 8.719 -6.435 55 H SER 8 H SER 8 18.123 4.503 -9.206 56 HA SER 8 HA SER 8 19.327 1.925 -8.272 57 HB2 SER 8 HB2 SER 8 19.766 3.470 -10.846 58 HB3 SER 8 HB3 SER 8 20.489 1.906 -10.421 59 HG SER 8 HG SER 8 18.598 1.663 -11.694 60 H SER 9 H SER 9 20.918 2.233 -6.718 61 HA SER 9 HA SER 9 22.748 4.261 -6.497 62 HB2 SER 9 HB2 SER 9 23.137 1.361 -5.703 63 HB3 SER 9 HB3 SER 9 23.948 2.784 -5.008 64 HG SER 9 HG SER 9 22.162 2.109 -3.744 65 H THR 10 H THR 10 22.985 4.304 -8.955 66 HA THR 10 HA THR 10 25.761 3.788 -9.605 67 HB THR 10 HB THR 10 25.111 3.278 -11.986 68 HG1 THR 10 HG1 THR 10 23.087 2.224 -12.245 69 HG21 THR 10 HG21 THR 10 24.859 0.869 -11.684 70 HG22 THR 10 HG22 THR 10 24.302 1.102 -10.014 71 HG23 THR 10 HG23 THR 10 25.976 1.497 -10.458 72 H ALA 11 H ALA 11 22.788 4.916 -11.199 73 HA ALA 11 HA ALA 11 23.775 7.532 -11.897 74 HB1 ALA 11 HB1 ALA 11 21.442 7.922 -12.591 75 HB2 ALA 11 HB2 ALA 11 22.023 6.341 -13.147 76 HB3 ALA 11 HB3 ALA 11 20.929 6.443 -11.749 77 H GLN 12 H GLN 12 21.535 6.445 -9.249 78 HA GLN 12 HA GLN 12 21.412 9.077 -8.050 79 HB2 GLN 12 HB2 GLN 12 19.659 7.474 -7.761 80 HB3 GLN 12 HB3 GLN 12 20.739 6.316 -6.989 81 HG2 GLN 12 HG2 GLN 12 19.270 7.474 -5.372 82 HG3 GLN 12 HG3 GLN 12 20.976 7.666 -5.033 83 HE21 GLN 12 HE21 GLN 12 20.763 9.570 -3.815 84 HE22 GLN 12 HE22 GLN 12 20.219 11.085 -4.519 85 H GLU 13 H GLU 13 23.668 6.348 -7.638 86 HA GLU 13 HA GLU 13 24.936 7.391 -5.297 87 HB2 GLU 13 HB2 GLU 13 25.010 5.029 -6.112 88 HB3 GLU 13 HB3 GLU 13 26.044 5.537 -7.442 89 HG2 GLU 13 HG2 GLU 13 27.513 4.651 -5.831 90 HG3 GLU 13 HG3 GLU 13 27.700 6.388 -5.663 91 H ARG 14 H ARG 14 26.009 7.579 -8.631 92 HA ARG 14 HA ARG 14 28.179 9.217 -8.273 93 HB2 ARG 14 HB2 ARG 14 28.264 9.838 -10.566 94 HB3 ARG 14 HB3 ARG 14 27.897 8.131 -10.410 95 HG2 ARG 14 HG2 ARG 14 25.925 8.307 -11.491 96 HG3 ARG 14 HG3 ARG 14 25.466 9.822 -10.720 97 HD2 ARG 14 HD2 ARG 14 27.669 9.848 -12.771 98 HD3 ARG 14 HD3 ARG 14 26.008 9.668 -13.305 99 HE ARG 14 HE ARG 14 27.084 12.032 -11.766 100 HH11 ARG 14 HH11 ARG 14 24.371 10.761 -13.684 101 HH12 ARG 14 HH12 ARG 14 23.635 12.354 -13.718 102 HH21 ARG 14 HH21 ARG 14 26.066 13.896 -11.921 103 HH22 ARG 14 HH22 ARG 14 24.519 13.996 -12.730 104 H VAL 15 H VAL 15 24.880 10.398 -8.602 105 HA VAL 15 HA VAL 15 25.589 13.185 -8.655 106 HB VAL 15 HB VAL 15 23.335 13.750 -7.953 107 HG11 VAL 15 HG11 VAL 15 23.499 11.759 -10.247 108 HG12 VAL 15 HG12 VAL 15 22.223 12.968 -9.990 109 HG13 VAL 15 HG13 VAL 15 23.879 13.498 -10.304 110 HG21 VAL 15 HG21 VAL 15 21.584 12.100 -7.779 111 HG22 VAL 15 HG22 VAL 15 22.745 10.791 -8.049 112 HG23 VAL 15 HG23 VAL 15 22.814 11.748 -6.552 113 H ASP 16 H ASP 16 25.696 10.906 -6.017 114 HA ASP 16 HA ASP 16 25.456 12.920 -3.920 115 HB2 ASP 16 HB2 ASP 16 25.092 10.467 -3.609 116 HB3 ASP 16 HB3 ASP 16 26.823 10.209 -3.829 117 H LEU 17 H LEU 17 28.307 11.423 -5.503 118 HA LEU 17 HA LEU 17 30.243 12.691 -3.928 119 HB2 LEU 17 HB2 LEU 17 30.371 11.478 -6.731 120 HB3 LEU 17 HB3 LEU 17 31.777 12.092 -5.900 121 HG LEU 17 HG LEU 17 31.765 9.736 -5.723 122 HD11 LEU 17 HD11 LEU 17 32.568 11.021 -3.749 123 HD12 LEU 17 HD12 LEU 17 31.981 9.398 -3.346 124 HD13 LEU 17 HD13 LEU 17 30.971 10.810 -2.991 125 HD21 LEU 17 HD21 LEU 17 29.119 9.791 -4.241 126 HD22 LEU 17 HD22 LEU 17 30.092 8.383 -4.680 127 HD23 LEU 17 HD23 LEU 17 29.313 9.333 -5.953 128 H GLU 18 H GLU 18 28.977 13.638 -7.033 129 HA GLU 18 HA GLU 18 30.460 16.088 -7.349 130 HB2 GLU 18 HB2 GLU 18 28.738 16.665 -9.042 131 HB3 GLU 18 HB3 GLU 18 29.518 15.103 -9.272 132 HG2 GLU 18 HG2 GLU 18 27.484 14.079 -8.038 133 HG3 GLU 18 HG3 GLU 18 26.723 15.637 -8.238 134 H ALA 19 H ALA 19 27.306 15.393 -5.662 135 HA ALA 19 HA ALA 19 26.820 18.153 -5.003 136 HB1 ALA 19 HB1 ALA 19 25.995 15.646 -3.504 137 HB2 ALA 19 HB2 ALA 19 25.248 17.255 -3.410 138 HB3 ALA 19 HB3 ALA 19 25.170 16.322 -4.922 139 H VAL 20 H VAL 20 28.775 15.653 -3.315 140 HA VAL 20 HA VAL 20 29.565 17.369 -1.101 141 HB VAL 20 HB VAL 20 30.832 14.856 -2.243 142 HG11 VAL 20 HG11 VAL 20 32.009 14.692 -0.048 143 HG12 VAL 20 HG12 VAL 20 32.569 16.064 -1.001 144 HG13 VAL 20 HG13 VAL 20 31.450 16.328 0.358 145 HG21 VAL 20 HG21 VAL 20 28.561 14.548 -1.242 146 HG22 VAL 20 HG22 VAL 20 29.818 13.760 -0.291 147 HG23 VAL 20 HG23 VAL 20 29.134 15.304 0.256 148 H ARG 21 H ARG 21 31.118 16.650 -4.236 149 HA ARG 21 HA ARG 21 33.266 18.493 -3.973 150 HB2 ARG 21 HB2 ARG 21 31.732 17.523 -6.402 151 HB3 ARG 21 HB3 ARG 21 33.002 18.719 -6.575 152 HG2 ARG 21 HG2 ARG 21 33.414 16.003 -5.250 153 HG3 ARG 21 HG3 ARG 21 33.733 16.327 -6.953 154 HD2 ARG 21 HD2 ARG 21 35.096 17.754 -4.626 155 HD3 ARG 21 HD3 ARG 21 35.781 16.406 -5.544 156 HE ARG 21 HE ARG 21 35.190 18.219 -7.516 157 HH11 ARG 21 HH11 ARG 21 37.181 18.421 -4.641 158 HH12 ARG 21 HH12 ARG 21 38.201 19.660 -5.318 159 HH21 ARG 21 HH21 ARG 21 36.529 19.805 -8.325 160 HH22 ARG 21 HH22 ARG 21 37.841 20.409 -7.361 161 H LEU 22 H LEU 22 29.929 19.293 -5.109 162 HA LEU 22 HA LEU 22 30.588 22.116 -5.217 163 HB2 LEU 22 HB2 LEU 22 28.004 20.606 -5.403 164 HB3 LEU 22 HB3 LEU 22 28.028 22.337 -5.003 165 HG LEU 22 HG LEU 22 29.549 22.718 -7.013 166 HD11 LEU 22 HD11 LEU 22 28.560 19.943 -7.789 167 HD12 LEU 22 HD12 LEU 22 30.253 20.406 -7.483 168 HD13 LEU 22 HD13 LEU 22 29.385 21.095 -8.859 169 HD21 LEU 22 HD21 LEU 22 27.206 23.304 -6.887 170 HD22 LEU 22 HD22 LEU 22 26.749 21.695 -7.505 171 HD23 LEU 22 HD23 LEU 22 27.684 22.831 -8.530 172 H ALA 23 H ALA 23 29.296 20.140 -2.478 173 HA ALA 23 HA ALA 23 29.059 22.373 -0.718 174 HB1 ALA 23 HB1 ALA 23 29.987 19.533 -0.130 175 HB2 ALA 23 HB2 ALA 23 29.364 20.704 1.056 176 HB3 ALA 23 HB3 ALA 23 28.301 20.091 -0.221 177 H SER 24 H SER 24 31.942 20.562 -1.678 178 HA SER 24 HA SER 24 33.819 22.151 -0.274 179 HB2 SER 24 HB2 SER 24 34.448 20.663 -2.838 180 HB3 SER 24 HB3 SER 24 35.531 21.112 -1.530 181 HG SER 24 HG SER 24 33.367 19.243 -1.371 182 H ILE 25 H ILE 25 32.617 22.600 -3.688 183 HA ILE 25 HA ILE 25 34.358 24.861 -4.059 184 HB ILE 25 HB ILE 25 31.819 24.730 -5.611 185 HG12 ILE 25 HG12 ILE 25 32.490 22.456 -5.866 186 HG13 ILE 25 HG13 ILE 25 32.907 23.323 -7.283 187 HG21 ILE 25 HG21 ILE 25 34.711 25.513 -6.244 188 HG22 ILE 25 HG22 ILE 25 33.342 25.628 -7.352 189 HG23 ILE 25 HG23 ILE 25 33.383 26.625 -5.906 190 HD11 ILE 25 HD11 ILE 25 34.908 22.513 -5.152 191 HD12 ILE 25 HD12 ILE 25 34.576 21.649 -6.658 192 HD13 ILE 25 HD13 ILE 25 35.272 23.289 -6.723 193 H VAL 26 H VAL 26 31.023 24.553 -2.797 194 HA VAL 26 HA VAL 26 30.457 27.401 -2.541 195 HB VAL 26 HB VAL 26 29.433 24.980 -1.027 196 HG11 VAL 26 HG11 VAL 26 28.341 27.825 -1.143 197 HG12 VAL 26 HG12 VAL 26 27.483 26.423 -0.456 198 HG13 VAL 26 HG13 VAL 26 28.976 26.989 0.287 199 HG21 VAL 26 HG21 VAL 26 28.938 25.149 -3.606 200 HG22 VAL 26 HG22 VAL 26 27.573 24.945 -2.525 201 HG23 VAL 26 HG23 VAL 26 27.956 26.554 -3.183 202 H ASP 27 H ASP 27 31.843 24.938 -0.179 203 HA ASP 27 HA ASP 27 32.408 26.777 1.908 204 HB2 ASP 27 HB2 ASP 27 32.760 24.439 2.248 205 HB3 ASP 27 HB3 ASP 27 33.908 24.338 0.910 206 H SER 28 H SER 28 34.442 26.068 -0.945 207 HA SER 28 HA SER 28 36.517 27.901 -0.416 208 HB2 SER 28 HB2 SER 28 36.480 26.165 -2.243 209 HB3 SER 28 HB3 SER 28 35.470 27.268 -3.200 210 HG SER 28 HG SER 28 37.738 27.463 -3.628 211 H ARG 29 H ARG 29 33.374 28.524 -2.046 212 HA ARG 29 HA ARG 29 33.799 31.364 -2.426 213 HB2 ARG 29 HB2 ARG 29 32.137 29.891 -3.637 214 HB3 ARG 29 HB3 ARG 29 31.184 29.810 -2.170 215 HG2 ARG 29 HG2 ARG 29 30.162 31.400 -3.519 216 HG3 ARG 29 HG3 ARG 29 30.950 32.317 -2.233 217 HD2 ARG 29 HD2 ARG 29 32.762 32.942 -3.785 218 HD3 ARG 29 HD3 ARG 29 32.068 31.888 -5.030 219 HE ARG 29 HE ARG 29 30.142 33.858 -4.110 220 HH11 ARG 29 HH11 ARG 29 33.034 33.729 -6.076 221 HH12 ARG 29 HH12 ARG 29 32.500 35.010 -7.128 222 HH21 ARG 29 HH21 ARG 29 29.379 35.313 -5.688 223 HH22 ARG 29 HH22 ARG 29 30.521 35.927 -6.848 224 H LEU 30 H LEU 30 32.340 29.501 0.306 225 HA LEU 30 HA LEU 30 31.498 31.854 1.723 226 HB2 LEU 30 HB2 LEU 30 32.166 29.104 2.816 227 HB3 LEU 30 HB3 LEU 30 31.344 30.399 3.689 228 HG LEU 30 HG LEU 30 30.263 28.920 1.277 229 HD11 LEU 30 HD11 LEU 30 28.605 28.017 2.805 230 HD12 LEU 30 HD12 LEU 30 29.259 28.971 4.142 231 HD13 LEU 30 HD13 LEU 30 30.193 27.618 3.465 232 HD21 LEU 30 HD21 LEU 30 29.428 31.187 1.155 233 HD22 LEU 30 HD22 LEU 30 29.010 31.166 2.889 234 HD23 LEU 30 HD23 LEU 30 28.142 30.133 1.734 235 H ILE 31 H ILE 31 34.550 29.994 1.908 236 HA ILE 31 HA ILE 31 35.832 31.704 3.842 237 HB ILE 31 HB ILE 31 36.893 29.763 1.755 238 HG12 ILE 31 HG12 ILE 31 36.688 29.549 4.801 239 HG13 ILE 31 HG13 ILE 31 35.500 28.888 3.685 240 HG21 ILE 31 HG21 ILE 31 38.464 31.169 3.967 241 HG22 ILE 31 HG22 ILE 31 39.076 29.851 2.947 242 HG23 ILE 31 HG23 ILE 31 38.692 31.392 2.217 243 HD11 ILE 31 HD11 ILE 31 38.392 27.992 3.941 244 HD12 ILE 31 HD12 ILE 31 36.931 27.101 4.372 245 HD13 ILE 31 HD13 ILE 31 37.272 27.447 2.665 246 H GLY 32 H GLY 32 35.626 31.839 0.314 247 HA2 GLY 32 HA2 GLY 32 37.612 33.832 -0.152 248 HA3 GLY 32 HA3 GLY 32 36.328 33.350 -1.268 249 H THR 33 H THR 33 34.093 34.174 -0.700 250 HA THR 33 HA THR 33 34.259 36.959 0.329 251 HB THR 33 HB THR 33 34.099 36.677 -2.100 252 HG1 THR 33 HG1 THR 33 32.384 38.067 -2.406 253 HG21 THR 33 HG21 THR 33 32.773 34.557 -2.124 254 HG22 THR 33 HG22 THR 33 32.087 35.820 -3.165 255 HG23 THR 33 HG23 THR 33 31.347 35.463 -1.588 256 H GLY 34 H GLY 34 32.282 34.026 0.637 257 HA2 GLY 34 HA2 GLY 34 31.075 33.645 2.582 258 HA3 GLY 34 HA3 GLY 34 30.883 35.360 2.889 259 H SER 35 H SER 35 29.978 34.576 -0.320 260 HA SER 35 HA SER 35 27.261 33.759 0.211 261 HB2 SER 35 HB2 SER 35 27.944 36.381 -1.181 262 HB3 SER 35 HB3 SER 35 26.354 35.598 -1.214 263 HG SER 35 HG SER 35 26.539 37.236 0.401 264 H VAL 36 H VAL 36 26.464 32.535 -1.509 265 HA VAL 36 HA VAL 36 28.220 32.266 -3.943 266 HB VAL 36 HB VAL 36 27.965 30.278 -2.415 267 HG11 VAL 36 HG11 VAL 36 25.179 30.059 -3.629 268 HG12 VAL 36 HG12 VAL 36 25.984 28.945 -2.503 269 HG13 VAL 36 HG13 VAL 36 25.497 30.567 -1.960 270 HG21 VAL 36 HG21 VAL 36 26.989 29.945 -5.271 271 HG22 VAL 36 HG22 VAL 36 28.686 30.145 -4.775 272 HG23 VAL 36 HG23 VAL 36 27.779 28.718 -4.252 273 H ASP 37 H ASP 37 27.284 32.390 -6.018 274 HA ASP 37 HA ASP 37 24.457 33.197 -6.189 275 HB2 ASP 37 HB2 ASP 37 26.681 34.378 -7.863 276 HB3 ASP 37 HB3 ASP 37 25.043 34.965 -7.637 277 H GLU 38 H GLU 38 23.509 32.794 -8.298 278 HA GLU 38 HA GLU 38 23.925 30.266 -9.277 279 HB2 GLU 38 HB2 GLU 38 22.015 32.051 -9.677 280 HB3 GLU 38 HB3 GLU 38 22.920 32.422 -11.150 281 HG2 GLU 38 HG2 GLU 38 22.815 29.835 -11.590 282 HG3 GLU 38 HG3 GLU 38 21.615 29.820 -10.302 283 H ASP 39 H ASP 39 25.462 33.240 -10.641 284 HA ASP 39 HA ASP 39 26.674 31.915 -12.825 285 HB2 ASP 39 HB2 ASP 39 27.355 34.555 -11.505 286 HB3 ASP 39 HB3 ASP 39 27.959 34.008 -13.067 287 H PHE 40 H PHE 40 27.633 31.919 -9.451 288 HA PHE 40 HA PHE 40 30.427 31.223 -10.129 289 HB2 PHE 40 HB2 PHE 40 29.908 32.453 -8.065 290 HB3 PHE 40 HB3 PHE 40 28.862 31.144 -7.520 291 HD1 PHE 40 HD1 PHE 40 32.402 32.042 -8.316 292 HD2 PHE 40 HD2 PHE 40 29.758 29.153 -6.511 293 HE1 PHE 40 HE1 PHE 40 34.350 30.915 -7.253 294 HE2 PHE 40 HE2 PHE 40 31.689 28.055 -5.427 295 HZ PHE 40 HZ PHE 40 33.996 28.935 -5.792 296 H LEU 41 H LEU 41 27.353 29.570 -9.494 297 HA LEU 41 HA LEU 41 28.651 26.935 -9.165 298 HB2 LEU 41 HB2 LEU 41 25.816 27.999 -8.941 299 HB3 LEU 41 HB3 LEU 41 26.168 26.284 -8.767 300 HG LEU 41 HG LEU 41 27.247 28.525 -7.013 301 HD11 LEU 41 HD11 LEU 41 25.830 27.483 -5.285 302 HD12 LEU 41 HD12 LEU 41 25.261 26.275 -6.458 303 HD13 LEU 41 HD13 LEU 41 24.855 27.996 -6.673 304 HD21 LEU 41 HD21 LEU 41 27.705 25.515 -6.862 305 HD22 LEU 41 HD22 LEU 41 28.059 26.645 -5.542 306 HD23 LEU 41 HD23 LEU 41 28.945 26.775 -7.054 307 H ARG 42 H ARG 42 26.685 28.496 -11.716 308 HA ARG 42 HA ARG 42 26.313 26.141 -13.271 309 HB2 ARG 42 HB2 ARG 42 26.024 27.598 -15.194 310 HB3 ARG 42 HB3 ARG 42 25.218 28.247 -13.775 311 HG2 ARG 42 HG2 ARG 42 27.047 29.884 -13.467 312 HG3 ARG 42 HG3 ARG 42 27.870 29.247 -14.901 313 HD2 ARG 42 HD2 ARG 42 25.965 29.849 -16.331 314 HD3 ARG 42 HD3 ARG 42 25.010 30.307 -14.922 315 HE ARG 42 HE ARG 42 25.954 32.389 -14.939 316 HH11 ARG 42 HH11 ARG 42 28.125 30.443 -16.923 317 HH12 ARG 42 HH12 ARG 42 29.038 31.851 -17.389 318 HH21 ARG 42 HH21 ARG 42 27.048 34.008 -15.539 319 HH22 ARG 42 HH22 ARG 42 28.432 33.888 -16.629 320 H GLU 43 H GLU 43 29.274 27.964 -12.864 321 HA GLU 43 HA GLU 43 30.762 26.568 -14.911 322 HB2 GLU 43 HB2 GLU 43 31.890 28.048 -12.506 323 HB3 GLU 43 HB3 GLU 43 32.661 27.732 -14.068 324 HG2 GLU 43 HG2 GLU 43 30.669 29.101 -15.051 325 HG3 GLU 43 HG3 GLU 43 30.457 29.688 -13.399 326 H GLN 44 H GLN 44 29.647 25.306 -11.948 327 HA GLN 44 HA GLN 44 32.160 23.760 -11.433 328 HB2 GLN 44 HB2 GLN 44 29.885 24.225 -9.488 329 HB3 GLN 44 HB3 GLN 44 31.510 23.636 -9.146 330 HG2 GLN 44 HG2 GLN 44 30.702 26.405 -10.026 331 HG3 GLN 44 HG3 GLN 44 31.206 25.960 -8.408 332 HE21 GLN 44 HE21 GLN 44 32.361 28.054 -9.781 333 HE22 GLN 44 HE22 GLN 44 34.062 27.645 -10.064 334 H ILE 45 H ILE 45 28.803 23.464 -12.320 335 HA ILE 45 HA ILE 45 28.137 21.042 -11.088 336 HB ILE 45 HB ILE 45 26.678 20.789 -13.289 337 HG12 ILE 45 HG12 ILE 45 26.983 23.804 -13.318 338 HG13 ILE 45 HG13 ILE 45 27.869 22.773 -14.456 339 HG21 ILE 45 HG21 ILE 45 24.942 21.962 -12.146 340 HG22 ILE 45 HG22 ILE 45 26.010 21.262 -10.920 341 HG23 ILE 45 HG23 ILE 45 26.123 23.000 -11.285 342 HD11 ILE 45 HD11 ILE 45 25.848 23.616 -15.501 343 HD12 ILE 45 HD12 ILE 45 25.706 21.859 -15.283 344 HD13 ILE 45 HD13 ILE 45 24.837 22.972 -14.199 345 H ARG 46 H ARG 46 28.876 21.065 -14.672 346 HA ARG 46 HA ARG 46 30.051 19.922 -15.937 347 HB2 ARG 46 HB2 ARG 46 31.509 18.554 -13.653 348 HB3 ARG 46 HB3 ARG 46 32.026 18.640 -15.331 349 HG2 ARG 46 HG2 ARG 46 31.896 20.942 -13.352 350 HG3 ARG 46 HG3 ARG 46 33.341 20.137 -13.941 351 HD2 ARG 46 HD2 ARG 46 32.922 20.998 -16.223 352 HD3 ARG 46 HD3 ARG 46 31.421 21.747 -15.676 353 HE ARG 46 HE ARG 46 32.585 23.413 -14.518 354 HH11 ARG 46 HH21 ARG 46 34.977 21.222 -15.875 355 HH12 ARG 46 HH22 ARG 46 36.285 22.312 -15.502 356 HH21 ARG 46 HH11 ARG 46 34.215 24.672 -14.043 357 HH22 ARG 46 HH12 ARG 46 35.863 24.265 -14.487 358 H ASP 47 H ASP 47 28.214 18.277 -13.672 359 HA ASP 47 HA ASP 47 27.524 16.198 -15.712 360 HB2 ASP 47 HB2 ASP 47 28.173 15.512 -12.826 361 HB3 ASP 47 HB3 ASP 47 27.647 14.396 -14.077 362 H ALA 48 H ALA 48 26.689 17.884 -12.724 363 HA ALA 48 HA ALA 48 23.974 16.888 -12.451 364 HB1 ALA 48 HB1 ALA 48 25.163 17.723 -10.515 365 HB2 ALA 48 HB2 ALA 48 25.581 19.218 -11.338 366 HB3 ALA 48 HB3 ALA 48 23.889 18.918 -10.897 367 H ARG 49 H ARG 49 22.081 17.905 -13.104 368 HA ARG 49 HA ARG 49 22.332 19.768 -15.406 369 HB2 ARG 49 HB2 ARG 49 20.556 17.681 -14.765 370 HB3 ARG 49 HB3 ARG 49 19.598 19.111 -14.480 371 HG2 ARG 49 HG2 ARG 49 19.342 18.249 -16.756 372 HG3 ARG 49 HG3 ARG 49 20.005 19.882 -16.755 373 HD2 ARG 49 HD2 ARG 49 20.991 18.021 -18.381 374 HD3 ARG 49 HD3 ARG 49 22.040 19.199 -17.624 375 HE ARG 49 HE ARG 49 23.142 17.562 -16.498 376 HH11 ARG 49 HH11 ARG 49 20.250 16.001 -17.679 377 HH12 ARG 49 HH12 ARG 49 20.674 14.472 -16.955 378 HH21 ARG 49 HH21 ARG 49 23.603 15.621 -15.553 379 HH22 ARG 49 HH22 ARG 49 22.434 14.338 -15.583 380 H TYR 50 H TYR 50 20.920 19.794 -12.125 381 HA TYR 50 HA TYR 50 20.883 22.774 -12.184 382 HB2 TYR 50 HB2 TYR 50 18.895 21.110 -10.648 383 HB3 TYR 50 HB3 TYR 50 18.730 22.742 -11.248 384 HD1 TYR 50 HD2 TYR 50 19.024 22.670 -14.080 385 HD2 TYR 50 HD1 TYR 50 17.287 19.691 -11.522 386 HE1 TYR 50 HE2 TYR 50 17.711 21.808 -15.995 387 HE2 TYR 50 HE1 TYR 50 15.978 18.802 -13.450 388 HH TYR 50 HH TYR 50 16.197 20.242 -16.708 389 H ALA 51 H ALA 51 22.229 23.594 -10.511 390 HA ALA 51 HA ALA 51 22.644 21.872 -8.103 391 HB1 ALA 51 HB1 ALA 51 24.464 23.447 -7.581 392 HB2 ALA 51 HB2 ALA 51 24.708 22.642 -9.143 393 HB3 ALA 51 HB3 ALA 51 24.145 24.329 -9.088 394 H VAL 52 H VAL 52 21.853 22.540 -6.136 395 HA VAL 52 HA VAL 52 20.229 25.055 -6.008 396 HB VAL 52 HB VAL 52 19.380 22.237 -5.265 397 HG11 VAL 52 HG11 VAL 52 18.548 23.685 -3.494 398 HG12 VAL 52 HG12 VAL 52 17.983 24.883 -4.680 399 HG13 VAL 52 HG13 VAL 52 17.212 23.286 -4.573 400 HG21 VAL 52 HG21 VAL 52 17.514 22.712 -6.840 401 HG22 VAL 52 HG22 VAL 52 18.290 24.252 -7.266 402 HG23 VAL 52 HG23 VAL 52 19.088 22.708 -7.631 403 H ILE 53 H ILE 53 20.237 26.152 -4.059 404 HA ILE 53 HA ILE 53 22.171 25.127 -2.073 405 HB ILE 53 HB ILE 53 21.993 27.553 -3.719 406 HG12 ILE 53 HG12 ILE 53 23.829 25.971 -3.855 407 HG13 ILE 53 HG13 ILE 53 24.378 27.587 -3.434 408 HG21 ILE 53 HG21 ILE 53 21.377 28.819 -1.767 409 HG22 ILE 53 HG22 ILE 53 22.633 28.052 -0.786 410 HG23 ILE 53 HG23 ILE 53 23.067 29.124 -2.137 411 HD11 ILE 53 HD11 ILE 53 25.616 26.077 -2.060 412 HD12 ILE 53 HD12 ILE 53 24.415 26.808 -0.973 413 HD13 ILE 53 HD13 ILE 53 24.171 25.172 -1.589 414 H ARG 54 H ARG 54 21.671 24.903 -0.093 415 HA ARG 54 HA ARG 54 19.738 26.763 1.248 416 HB2 ARG 54 HB2 ARG 54 20.397 23.863 1.877 417 HB3 ARG 54 HB3 ARG 54 19.255 24.886 2.748 418 HG2 ARG 54 HG2 ARG 54 18.962 23.945 -0.152 419 HG3 ARG 54 HG3 ARG 54 18.212 23.183 1.251 420 HD2 ARG 54 HD2 ARG 54 16.963 25.221 1.752 421 HD3 ARG 54 HD3 ARG 54 17.704 26.040 0.357 422 HE ARG 54 HE ARG 54 16.615 23.815 -0.797 423 HH11 ARG 54 HH11 ARG 54 15.141 26.245 1.258 424 HH12 ARG 54 HH12 ARG 54 13.567 26.024 0.545 425 HH21 ARG 54 HH21 ARG 54 14.576 23.584 -1.662 426 HH22 ARG 54 HH22 ARG 54 13.266 24.558 -1.070 427 H ILE 55 H ILE 55 21.534 28.217 1.647 428 HA ILE 55 HA ILE 55 23.477 27.314 3.731 429 HB ILE 55 HB ILE 55 23.518 29.764 1.956 430 HG12 ILE 55 HG12 ILE 55 25.828 27.853 2.145 431 HG13 ILE 55 HG13 ILE 55 24.428 27.334 1.203 432 HG21 ILE 55 HG21 ILE 55 25.754 30.203 3.122 433 HG22 ILE 55 HG22 ILE 55 24.329 30.466 4.125 434 HG23 ILE 55 HG23 ILE 55 25.295 28.984 4.319 435 HD11 ILE 55 HD11 ILE 55 24.599 29.391 -0.148 436 HD12 ILE 55 HD12 ILE 55 26.016 29.899 0.799 437 HD13 ILE 55 HD13 ILE 55 26.094 28.430 -0.189 438 HA PRO 56 HA PRO 56 20.537 29.477 6.437 439 HB2 PRO 56 HB2 PRO 56 22.868 29.278 8.338 440 HB3 PRO 56 HB3 PRO 56 21.133 28.952 8.639 441 HG2 PRO 56 HG2 PRO 56 22.852 26.890 8.270 442 HG3 PRO 56 HG3 PRO 56 21.244 26.865 7.474 443 HD2 PRO 56 HD2 PRO 56 23.920 27.640 6.275 444 HD3 PRO 56 HD3 PRO 56 22.630 26.587 5.606 445 H GLY 57 H GLY 57 20.209 31.642 6.719 446 HA2 GLY 57 HA2 GLY 57 20.653 33.862 7.173 447 HA3 GLY 57 HA3 GLY 57 22.384 33.548 7.156 448 H GLN 58 H GLN 58 21.231 32.310 4.237 449 HA GLN 58 HA GLN 58 21.042 34.921 2.862 450 HB2 GLN 58 HB2 GLN 58 22.835 34.590 1.387 451 HB3 GLN 58 HB3 GLN 58 23.429 34.118 2.973 452 HG2 GLN 58 HG2 GLN 58 23.085 31.765 2.389 453 HG3 GLN 58 HG3 GLN 58 22.623 32.213 0.732 454 HE21 GLN 58 HE21 GLN 58 25.278 32.934 3.126 455 HE22 GLN 58 HE22 GLN 58 26.556 32.924 1.935 456 HA PRO 59 HA PRO 59 17.811 33.075 0.701 457 HB2 PRO 59 HB2 PRO 59 17.775 34.217 -1.792 458 HB3 PRO 59 HB3 PRO 59 17.421 35.114 -0.283 459 HG2 PRO 59 HG2 PRO 59 20.063 34.952 -1.772 460 HG3 PRO 59 HG3 PRO 59 19.214 36.420 -1.183 461 HD2 PRO 59 HD2 PRO 59 21.208 35.276 0.237 462 HD3 PRO 59 HD3 PRO 59 19.773 35.948 1.069 463 H VAL 60 H VAL 60 17.166 31.398 -0.555 464 HA VAL 60 HA VAL 60 18.911 29.412 -1.512 465 HB VAL 60 HB VAL 60 16.017 30.003 -2.286 466 HG11 VAL 60 HG11 VAL 60 15.836 27.616 -2.904 467 HG12 VAL 60 HG12 VAL 60 16.944 28.476 -3.967 468 HG13 VAL 60 HG13 VAL 60 17.584 27.418 -2.692 469 HG21 VAL 60 HG21 VAL 60 16.287 29.595 0.121 470 HG22 VAL 60 HG22 VAL 60 15.505 28.210 -0.639 471 HG23 VAL 60 HG23 VAL 60 17.232 28.132 -0.214 472 H VAL 61 H VAL 61 19.979 29.030 -3.321 473 HA VAL 61 HA VAL 61 19.461 30.653 -5.790 474 HB VAL 61 HB VAL 61 22.076 29.428 -4.836 475 HG11 VAL 61 HG11 VAL 61 23.104 30.456 -6.802 476 HG12 VAL 61 HG12 VAL 61 21.946 29.222 -7.282 477 HG13 VAL 61 HG13 VAL 61 21.502 30.946 -7.410 478 HG21 VAL 61 HG21 VAL 61 22.875 31.759 -4.825 479 HG22 VAL 61 HG22 VAL 61 21.246 32.326 -5.251 480 HG23 VAL 61 HG23 VAL 61 21.544 31.532 -3.689 481 H GLU 62 H GLU 62 19.148 29.517 -7.742 482 HA GLU 62 HA GLU 62 19.357 26.555 -7.717 483 HB2 GLU 62 HB2 GLU 62 16.934 28.138 -8.683 484 HB3 GLU 62 HB3 GLU 62 17.195 26.402 -8.879 485 HG2 GLU 62 HG2 GLU 62 17.149 26.128 -6.411 486 HG3 GLU 62 HG3 GLU 62 16.859 27.858 -6.224 487 H VAL 63 H VAL 63 20.683 26.041 -9.406 488 HA VAL 63 HA VAL 63 21.153 27.943 -11.617 489 HB VAL 63 HB VAL 63 22.541 25.354 -10.883 490 HG11 VAL 63 HG11 VAL 63 24.484 26.395 -12.056 491 HG12 VAL 63 HG12 VAL 63 23.158 25.972 -13.128 492 HG13 VAL 63 HG13 VAL 63 23.391 27.674 -12.630 493 HG21 VAL 63 HG21 VAL 63 23.437 28.146 -10.102 494 HG22 VAL 63 HG22 VAL 63 22.761 26.946 -8.972 495 HG23 VAL 63 HG23 VAL 63 24.262 26.606 -9.806 496 H GLY 64 H GLY 64 21.310 27.040 -13.902 497 HA2 GLY 64 HA2 GLY 64 20.532 25.823 -15.663 498 HA3 GLY 64 HA3 GLY 64 20.167 24.509 -14.552 499 H THR 65 H THR 65 18.029 24.191 -13.915 500 HA THR 65 HA THR 65 16.076 26.233 -14.027 501 HB THR 65 HB THR 65 16.031 25.795 -16.445 502 HG1 THR 65 HG1 THR 65 13.821 25.662 -16.544 503 HG21 THR 65 HG21 THR 65 16.468 23.464 -16.686 504 HG22 THR 65 HG22 THR 65 14.840 23.765 -17.284 505 HG23 THR 65 HG23 THR 65 15.061 23.012 -15.688 506 H LYS 66 H LYS 66 13.991 25.521 -13.222 507 HA LYS 66 HA LYS 66 14.454 23.923 -10.941 508 HB2 LYS 66 HB2 LYS 66 13.039 26.019 -11.120 509 HB3 LYS 66 HB3 LYS 66 11.749 25.013 -11.799 510 HG2 LYS 66 HG2 LYS 66 11.810 23.611 -9.712 511 HG3 LYS 66 HG3 LYS 66 13.099 24.652 -9.086 512 HD2 LYS 66 HD2 LYS 66 11.467 26.622 -9.312 513 HD3 LYS 66 HD3 LYS 66 10.224 25.431 -9.715 514 HE2 LYS 66 HE2 LYS 66 9.925 25.773 -7.414 515 HE3 LYS 66 HE3 LYS 66 10.821 24.253 -7.505 516 HZ1 LYS 66 HZ1 LYS 66 11.988 26.932 -6.916 517 HZ2 LYS 66 HZ2 LYS 66 12.887 25.583 -7.039 518 HZ3 LYS 66 HZ3 LYS 66 11.780 25.725 -5.833 519 HA PRO 67 HA PRO 67 13.135 20.026 -12.691 520 HB2 PRO 67 HB2 PRO 67 13.434 18.406 -10.530 521 HB3 PRO 67 HB3 PRO 67 14.820 19.081 -11.453 522 HG2 PRO 67 HG2 PRO 67 13.637 20.075 -8.855 523 HG3 PRO 67 HG3 PRO 67 15.363 19.870 -9.315 524 HD2 PRO 67 HD2 PRO 67 14.051 22.289 -9.456 525 HD3 PRO 67 HD3 PRO 67 15.375 21.829 -10.573 526 H THR 68 H THR 68 11.438 18.709 -12.778 527 HA THR 68 HA THR 68 8.979 19.544 -11.683 528 HB THR 68 HB THR 68 9.307 18.814 -13.984 529 HG1 THR 68 HG1 THR 68 7.380 17.698 -14.141 530 HG21 THR 68 HG21 THR 68 9.267 15.939 -12.983 531 HG22 THR 68 HG22 THR 68 10.756 16.774 -13.489 532 HG23 THR 68 HG23 THR 68 9.443 16.516 -14.649 533 H GLY 69 H GLY 69 10.945 16.788 -10.772 534 HA2 GLY 69 HA2 GLY 69 10.329 16.001 -8.349 535 HA3 GLY 69 HA3 GLY 69 8.748 15.654 -9.082 536 H ASP 70 H ASP 70 9.636 14.721 -11.545 537 HA ASP 70 HA ASP 70 10.596 12.002 -10.984 538 HB2 ASP 70 HB2 ASP 70 9.986 13.312 -13.637 539 HB3 ASP 70 HB3 ASP 70 10.231 11.574 -13.340 540 H VAL 71 H VAL 71 12.545 13.210 -10.008 541 HA VAL 71 HA VAL 71 14.786 13.373 -11.905 542 HB VAL 71 HB VAL 71 15.591 15.422 -10.858 543 HG11 VAL 71 HG11 VAL 71 12.766 16.112 -11.731 544 HG12 VAL 71 HG12 VAL 71 14.300 16.928 -12.073 545 HG13 VAL 71 HG13 VAL 71 13.925 15.416 -12.867 546 HG21 VAL 71 HG21 VAL 71 12.969 15.621 -9.341 547 HG22 VAL 71 HG22 VAL 71 14.541 15.216 -8.622 548 HG23 VAL 71 HG23 VAL 71 14.310 16.790 -9.354 549 H LEU 72 H LEU 72 16.821 13.202 -10.996 550 HA LEU 72 HA LEU 72 17.123 11.494 -8.604 551 HB2 LEU 72 HB2 LEU 72 19.171 12.782 -10.461 552 HB3 LEU 72 HB3 LEU 72 19.515 11.553 -9.247 553 HG LEU 72 HG LEU 72 17.789 11.186 -11.736 554 HD11 LEU 72 HD11 LEU 72 19.527 9.664 -12.484 555 HD12 LEU 72 HD12 LEU 72 20.506 10.024 -11.035 556 HD13 LEU 72 HD13 LEU 72 20.182 11.284 -12.251 557 HD21 LEU 72 HD21 LEU 72 18.575 9.185 -9.580 558 HD22 LEU 72 HD22 LEU 72 17.810 8.768 -11.134 559 HD23 LEU 72 HD23 LEU 72 16.926 9.747 -9.964 560 H GLN 73 H GLN 73 19.207 12.416 -7.121 561 HA GLN 73 HA GLN 73 18.777 15.072 -6.272 562 HB2 GLN 73 HB2 GLN 73 17.274 12.972 -4.661 563 HB3 GLN 73 HB3 GLN 73 17.842 14.519 -4.023 564 HG2 GLN 73 HG2 GLN 73 16.582 15.576 -6.046 565 HG3 GLN 73 HG3 GLN 73 15.712 14.045 -6.120 566 HE21 GLN 73 HE21 GLN 73 14.977 16.960 -5.328 567 HE22 GLN 73 HE22 GLN 73 14.205 16.751 -3.749 568 H GLY 74 H GLY 74 20.974 15.157 -6.207 569 HA2 GLY 74 HA2 GLY 74 22.561 13.308 -4.462 570 HA3 GLY 74 HA3 GLY 74 23.208 14.516 -5.581 571 H ARG 75 H ARG 75 23.697 14.284 -2.610 572 HA ARG 75 HA ARG 75 22.841 16.985 -1.765 573 HB2 ARG 75 HB2 ARG 75 21.003 15.256 -1.314 574 HB3 ARG 75 HB3 ARG 75 22.089 14.517 -0.137 575 HG2 ARG 75 HG2 ARG 75 22.072 16.603 1.205 576 HG3 ARG 75 HG3 ARG 75 21.181 17.437 -0.082 577 HD2 ARG 75 HD2 ARG 75 19.558 16.845 1.539 578 HD3 ARG 75 HD3 ARG 75 19.356 15.732 0.164 579 HE ARG 75 HE ARG 75 21.110 14.569 2.127 580 HH11 ARG 75 HH11 ARG 75 17.698 15.256 1.730 581 HH12 ARG 75 HH12 ARG 75 17.214 13.958 2.786 582 HH21 ARG 75 HH21 ARG 75 20.429 12.917 3.459 583 HH22 ARG 75 HH22 ARG 75 18.731 12.672 3.741 584 H ALA 76 H ALA 76 23.907 17.824 -0.017 585 HA ALA 76 HA ALA 76 25.947 16.295 1.484 586 HB1 ALA 76 HB1 ALA 76 27.146 16.734 -0.621 587 HB2 ALA 76 HB2 ALA 76 26.732 18.450 -0.535 588 HB3 ALA 76 HB3 ALA 76 27.839 17.731 0.668 589 H THR 77 H THR 77 27.003 17.436 3.144 590 HA THR 77 HA THR 77 25.747 20.015 3.996 591 HB THR 77 HB THR 77 27.004 17.861 5.723 592 HG1 THR 77 HG1 THR 77 24.904 17.653 6.515 593 HG21 THR 77 HG21 THR 77 26.186 19.243 7.624 594 HG22 THR 77 HG22 THR 77 25.642 20.491 6.485 595 HG23 THR 77 HG23 THR 77 27.365 20.139 6.662 596 H GLY 78 H GLY 78 27.136 21.696 4.004 597 HA2 GLY 78 HA2 GLY 78 29.931 21.226 3.139 598 HA3 GLY 78 HA3 GLY 78 29.075 22.742 3.118 599 H GLU 79 H GLU 79 31.491 22.905 3.913 600 HA GLU 79 HA GLU 79 32.001 22.178 6.649 601 HB2 GLU 79 HB2 GLU 79 33.699 23.479 4.520 602 HB3 GLU 79 HB3 GLU 79 34.272 23.205 6.173 603 HG2 GLU 79 HG2 GLU 79 33.762 20.776 5.932 604 HG3 GLU 79 HG3 GLU 79 33.269 21.056 4.262 605 H GLU 80 H GLU 80 30.379 25.008 5.576 606 HA GLU 80 HA GLU 80 31.286 26.411 8.099 607 HB2 GLU 80 HB2 GLU 80 29.792 27.507 5.732 608 HB3 GLU 80 HB3 GLU 80 30.240 28.419 7.166 609 HG2 GLU 80 HG2 GLU 80 32.329 27.161 5.316 610 HG3 GLU 80 HG3 GLU 80 31.629 28.729 5.131 611 H GLY 81 H GLY 81 29.190 24.138 7.210 612 HA2 GLY 81 HA2 GLY 81 27.467 23.296 8.409 613 HA3 GLY 81 HA3 GLY 81 27.121 24.858 9.131 614 H GLU 82 H GLU 82 27.410 24.690 5.589 615 HA GLU 82 HA GLU 82 24.593 25.332 5.270 616 HB2 GLU 82 HB2 GLU 82 25.205 26.015 3.159 617 HB3 GLU 82 HB3 GLU 82 26.483 26.616 4.227 618 HG2 GLU 82 HG2 GLU 82 26.822 24.089 2.550 619 HG3 GLU 82 HG3 GLU 82 27.031 25.686 1.874 620 H THR 83 H THR 83 23.640 24.389 3.063 621 HA THR 83 HA THR 83 24.163 21.466 2.852 622 HB THR 83 HB THR 83 21.525 22.831 3.408 623 HG1 THR 83 HG1 THR 83 22.937 21.935 5.047 624 HG21 THR 83 HG21 THR 83 20.436 20.621 3.024 625 HG22 THR 83 HG22 THR 83 21.939 20.029 2.276 626 HG23 THR 83 HG23 THR 83 21.009 21.358 1.528 627 H VAL 84 H VAL 84 24.258 20.771 0.903 628 HA VAL 84 HA VAL 84 23.509 22.528 -1.434 629 HB VAL 84 HB VAL 84 25.825 20.560 -1.217 630 HG11 VAL 84 HG11 VAL 84 25.014 20.660 -3.543 631 HG12 VAL 84 HG12 VAL 84 25.042 22.445 -3.490 632 HG13 VAL 84 HG13 VAL 84 26.545 21.499 -3.384 633 HG21 VAL 84 HG21 VAL 84 27.160 22.718 -1.540 634 HG22 VAL 84 HG22 VAL 84 25.678 23.594 -1.165 635 HG23 VAL 84 HG23 VAL 84 26.396 22.515 0.049 636 H LEU 85 H LEU 85 22.520 21.602 -3.228 637 HA LEU 85 HA LEU 85 21.920 18.718 -3.126 638 HB2 LEU 85 HB2 LEU 85 20.017 20.050 -2.107 639 HB3 LEU 85 HB3 LEU 85 19.855 20.880 -3.639 640 HG LEU 85 HG LEU 85 19.509 18.450 -4.636 641 HD11 LEU 85 HD11 LEU 85 18.607 17.973 -1.763 642 HD12 LEU 85 HD12 LEU 85 20.112 17.322 -2.422 643 HD13 LEU 85 HD13 LEU 85 18.566 16.832 -3.132 644 HD21 LEU 85 HD21 LEU 85 17.764 20.159 -4.568 645 HD22 LEU 85 HD22 LEU 85 17.417 19.769 -2.868 646 HD23 LEU 85 HD23 LEU 85 17.102 18.571 -4.142 647 H VAL 86 H VAL 86 21.772 17.816 -5.001 648 HA VAL 86 HA VAL 86 22.240 19.277 -7.610 649 HB VAL 86 HB VAL 86 23.306 16.615 -6.629 650 HG11 VAL 86 HG11 VAL 86 22.414 15.949 -8.734 651 HG12 VAL 86 HG12 VAL 86 22.923 17.448 -9.521 652 HG13 VAL 86 HG13 VAL 86 24.129 16.234 -8.995 653 HG21 VAL 86 HG21 VAL 86 25.443 17.502 -7.428 654 HG22 VAL 86 HG22 VAL 86 24.632 18.964 -8.047 655 HG23 VAL 86 HG23 VAL 86 24.695 18.636 -6.298 656 H GLU 87 H GLU 87 20.775 18.829 -9.254 657 HA GLU 87 HA GLU 87 18.967 16.552 -8.913 658 HB2 GLU 87 HB2 GLU 87 17.860 19.362 -9.250 659 HB3 GLU 87 HB3 GLU 87 16.943 17.849 -9.358 660 HG2 GLU 87 HG2 GLU 87 17.727 17.326 -6.992 661 HG3 GLU 87 HG3 GLU 87 18.367 18.965 -6.904 662 H GLU 88 H GLU 88 18.261 15.818 -10.658 663 HA GLU 88 HA GLU 88 18.516 16.975 -13.311 664 HB2 GLU 88 HB2 GLU 88 20.016 15.356 -14.235 665 HB3 GLU 88 HB3 GLU 88 20.792 16.307 -12.987 666 HG2 GLU 88 HG2 GLU 88 20.612 14.361 -11.461 667 HG3 GLU 88 HG3 GLU 88 19.868 13.434 -12.793 668 HA PRO 89 HA PRO 89 15.091 14.489 -14.386 669 HB2 PRO 89 HB2 PRO 89 15.468 13.838 -17.045 670 HB3 PRO 89 HB3 PRO 89 14.972 15.452 -16.444 671 HG2 PRO 89 HG2 PRO 89 17.790 14.477 -17.047 672 HG3 PRO 89 HG3 PRO 89 16.987 15.973 -17.660 673 HD2 PRO 89 HD2 PRO 89 18.596 16.137 -15.560 674 HD3 PRO 89 HD3 PRO 89 17.016 16.949 -15.451 675 H ARG 90 H ARG 90 14.367 12.585 -14.349 676 HA ARG 90 HA ARG 90 16.124 10.183 -14.281 677 HB2 ARG 90 HB2 ARG 90 14.508 10.638 -12.411 678 HB3 ARG 90 HB3 ARG 90 13.181 10.317 -13.536 679 HG2 ARG 90 HG2 ARG 90 13.947 8.026 -13.898 680 HG3 ARG 90 HG3 ARG 90 15.452 8.331 -13.016 681 HD2 ARG 90 HD2 ARG 90 14.239 8.681 -10.942 682 HD3 ARG 90 HD3 ARG 90 12.676 8.477 -11.776 683 HE ARG 90 HE ARG 90 14.112 6.167 -12.360 684 HH11 ARG 90 HH22 ARG 90 12.929 7.624 -9.388 685 HH12 ARG 90 HH21 ARG 90 12.940 6.072 -8.557 686 HH21 ARG 90 HH11 ARG 90 13.973 4.240 -11.225 687 HH22 ARG 90 HH12 ARG 90 13.451 4.280 -9.551 Start of MODEL 18 1 H1 GLY 1 H1 GLY 1 11.013 1.577 8.086 2 H2 GLY 1 H2 GLY 1 11.124 -0.045 8.292 3 H3 GLY 1 H3 GLY 1 9.989 0.810 9.107 4 HA2 GLY 1 HA2 GLY 1 8.943 -0.383 7.306 5 HA3 GLY 1 HA3 GLY 1 8.837 1.372 7.073 6 H SER 2 H SER 2 8.544 0.983 4.835 7 HA SER 2 HA SER 2 9.116 0.803 2.645 8 HB2 SER 2 HB2 SER 2 11.919 1.511 3.559 9 HB3 SER 2 HB3 SER 2 11.309 1.572 1.896 10 HG SER 2 HG SER 2 11.198 3.609 2.970 11 H GLU 3 H GLU 3 8.644 -1.531 3.537 12 HA GLU 3 HA GLU 3 10.845 -3.462 3.028 13 HB2 GLU 3 HB2 GLU 3 7.937 -3.868 3.824 14 HB3 GLU 3 HB3 GLU 3 9.106 -5.167 3.548 15 HG2 GLU 3 HG2 GLU 3 10.555 -4.254 5.349 16 HG3 GLU 3 HG3 GLU 3 9.373 -2.979 5.659 17 H THR 4 H THR 4 10.930 -4.853 1.270 18 HA THR 4 HA THR 4 10.915 -5.302 -0.943 19 HB THR 4 HB THR 4 7.896 -5.042 -0.924 20 HG1 THR 4 HG1 THR 4 8.645 -6.263 0.843 21 HG21 THR 4 HG21 THR 4 8.045 -6.969 -2.477 22 HG22 THR 4 HG22 THR 4 9.820 -6.917 -2.394 23 HG23 THR 4 HG23 THR 4 8.915 -5.581 -3.138 24 H ARG 5 H ARG 5 11.932 -3.093 -0.850 25 HA ARG 5 HA ARG 5 10.895 -1.388 -3.034 26 HB2 ARG 5 HB2 ARG 5 11.921 -0.281 -0.374 27 HB3 ARG 5 HB3 ARG 5 11.616 0.679 -1.810 28 HG2 ARG 5 HG2 ARG 5 9.525 -0.816 -0.180 29 HG3 ARG 5 HG3 ARG 5 9.822 0.916 -0.157 30 HD2 ARG 5 HD2 ARG 5 8.853 -0.670 -2.568 31 HD3 ARG 5 HD3 ARG 5 7.826 0.278 -1.512 32 HE ARG 5 HE ARG 5 9.605 1.249 -3.625 33 HH11 ARG 5 HH21 ARG 5 7.816 2.293 -0.791 34 HH12 ARG 5 HH22 ARG 5 7.822 3.961 -1.295 35 HH21 ARG 5 HH11 ARG 5 9.587 3.391 -4.194 36 HH22 ARG 5 HH12 ARG 5 8.798 4.558 -3.176 37 H THR 6 H THR 6 12.511 -0.402 -4.238 38 HA THR 6 HA THR 6 15.356 -1.082 -3.630 39 HB THR 6 HB THR 6 13.960 -1.460 -6.310 40 HG1 THR 6 HG1 THR 6 14.370 -3.636 -5.919 41 HG21 THR 6 HG21 THR 6 16.314 -0.853 -6.621 42 HG22 THR 6 HG22 THR 6 16.099 -2.574 -6.953 43 HG23 THR 6 HG23 THR 6 16.814 -2.054 -5.406 44 H ILE 7 H ILE 7 16.724 0.548 -3.930 45 HA ILE 7 HA ILE 7 16.019 2.861 -5.685 46 HB ILE 7 HB ILE 7 17.448 2.936 -3.004 47 HG12 ILE 7 HG12 ILE 7 15.002 2.738 -2.755 48 HG13 ILE 7 HG13 ILE 7 15.645 4.248 -2.154 49 HG21 ILE 7 HG21 ILE 7 18.515 4.572 -4.413 50 HG22 ILE 7 HG22 ILE 7 16.954 5.179 -5.008 51 HG23 ILE 7 HG23 ILE 7 17.439 5.431 -3.316 52 HD11 ILE 7 HD11 ILE 7 14.772 5.462 -4.111 53 HD12 ILE 7 HD12 ILE 7 14.194 3.937 -4.823 54 HD13 ILE 7 HD13 ILE 7 13.488 4.542 -3.316 55 H SER 8 H SER 8 17.552 3.431 -7.105 56 HA SER 8 HA SER 8 19.595 1.831 -7.941 57 HB2 SER 8 HB2 SER 8 18.762 3.608 -9.313 58 HB3 SER 8 HB3 SER 8 19.288 4.835 -8.160 59 HG SER 8 HG SER 8 20.811 3.289 -9.943 60 H SER 9 H SER 9 21.786 1.702 -7.852 61 HA SER 9 HA SER 9 23.285 3.104 -5.691 62 HB2 SER 9 HB2 SER 9 23.827 0.301 -6.677 63 HB3 SER 9 HB3 SER 9 24.651 1.156 -5.375 64 HG SER 9 HG SER 9 23.074 -0.332 -4.596 65 H THR 10 H THR 10 22.842 3.895 -8.539 66 HA THR 10 HA THR 10 25.581 3.959 -9.558 67 HB THR 10 HB THR 10 24.682 3.461 -11.868 68 HG1 THR 10 HG1 THR 10 22.849 2.083 -11.894 69 HG21 THR 10 HG21 THR 10 24.561 1.095 -9.951 70 HG22 THR 10 HG22 THR 10 26.059 1.804 -10.593 71 HG23 THR 10 HG23 THR 10 24.900 1.044 -11.695 72 H ALA 11 H ALA 11 22.349 4.741 -10.861 73 HA ALA 11 HA ALA 11 23.065 7.417 -11.605 74 HB1 ALA 11 HB1 ALA 11 21.391 6.041 -12.784 75 HB2 ALA 11 HB2 ALA 11 20.336 6.075 -11.350 76 HB3 ALA 11 HB3 ALA 11 20.689 7.574 -12.237 77 H GLN 12 H GLN 12 21.182 6.141 -8.804 78 HA GLN 12 HA GLN 12 20.928 8.861 -7.686 79 HB2 GLN 12 HB2 GLN 12 19.113 7.257 -7.489 80 HB3 GLN 12 HB3 GLN 12 20.144 6.160 -6.573 81 HG2 GLN 12 HG2 GLN 12 18.536 7.443 -5.170 82 HG3 GLN 12 HG3 GLN 12 20.218 7.616 -4.688 83 HE21 GLN 12 HE21 GLN 12 20.418 9.659 -3.855 84 HE22 GLN 12 HE22 GLN 12 19.800 11.115 -4.618 85 H GLU 13 H GLU 13 23.263 6.234 -7.330 86 HA GLU 13 HA GLU 13 24.526 7.374 -4.987 87 HB2 GLU 13 HB2 GLU 13 24.665 4.999 -5.626 88 HB3 GLU 13 HB3 GLU 13 25.565 5.405 -7.069 89 HG2 GLU 13 HG2 GLU 13 27.190 4.699 -5.545 90 HG3 GLU 13 HG3 GLU 13 27.339 6.448 -5.487 91 H ARG 14 H ARG 14 25.469 7.474 -8.379 92 HA ARG 14 HA ARG 14 27.700 9.040 -8.205 93 HB2 ARG 14 HB2 ARG 14 27.666 9.417 -10.538 94 HB3 ARG 14 HB3 ARG 14 27.121 7.798 -10.181 95 HG2 ARG 14 HG2 ARG 14 25.527 8.245 -11.674 96 HG3 ARG 14 HG3 ARG 14 24.695 8.975 -10.316 97 HD2 ARG 14 HD2 ARG 14 24.525 10.440 -12.222 98 HD3 ARG 14 HD3 ARG 14 25.574 11.224 -11.032 99 HE ARG 14 HE ARG 14 27.236 9.720 -12.761 100 HH11 ARG 14 HH11 ARG 14 25.068 12.517 -13.219 101 HH12 ARG 14 HH12 ARG 14 26.241 13.207 -14.350 102 HH21 ARG 14 HH22 ARG 14 28.516 10.788 -14.312 103 HH22 ARG 14 HH21 ARG 14 27.910 12.333 -14.922 104 H VAL 15 H VAL 15 24.466 10.276 -8.343 105 HA VAL 15 HA VAL 15 25.160 13.067 -8.504 106 HB VAL 15 HB VAL 15 22.929 13.608 -7.649 107 HG11 VAL 15 HG11 VAL 15 21.674 12.782 -9.548 108 HG12 VAL 15 HG12 VAL 15 23.313 13.221 -10.042 109 HG13 VAL 15 HG13 VAL 15 22.880 11.514 -9.851 110 HG21 VAL 15 HG21 VAL 15 21.246 11.887 -7.282 111 HG22 VAL 15 HG22 VAL 15 22.434 10.610 -7.577 112 HG23 VAL 15 HG23 VAL 15 22.573 11.640 -6.137 113 H ASP 16 H ASP 16 25.416 10.840 -5.823 114 HA ASP 16 HA ASP 16 25.265 12.910 -3.770 115 HB2 ASP 16 HB2 ASP 16 24.913 10.482 -3.346 116 HB3 ASP 16 HB3 ASP 16 26.622 10.190 -3.677 117 H LEU 17 H LEU 17 28.045 11.414 -5.481 118 HA LEU 17 HA LEU 17 30.056 12.643 -3.961 119 HB2 LEU 17 HB2 LEU 17 30.084 11.506 -6.803 120 HB3 LEU 17 HB3 LEU 17 31.515 12.044 -5.958 121 HG LEU 17 HG LEU 17 31.462 9.697 -5.869 122 HD11 LEU 17 HD11 LEU 17 30.640 10.654 -3.101 123 HD12 LEU 17 HD12 LEU 17 32.253 10.870 -3.823 124 HD13 LEU 17 HD13 LEU 17 31.631 9.241 -3.505 125 HD21 LEU 17 HD21 LEU 17 28.999 9.353 -6.151 126 HD22 LEU 17 HD22 LEU 17 28.801 9.702 -4.415 127 HD23 LEU 17 HD23 LEU 17 29.759 8.314 -4.938 128 H GLU 18 H GLU 18 28.654 13.650 -7.001 129 HA GLU 18 HA GLU 18 30.173 16.070 -7.352 130 HB2 GLU 18 HB2 GLU 18 28.412 16.658 -9.001 131 HB3 GLU 18 HB3 GLU 18 29.141 15.065 -9.215 132 HG2 GLU 18 HG2 GLU 18 27.114 14.105 -7.941 133 HG3 GLU 18 HG3 GLU 18 26.410 15.709 -8.044 134 H ALA 19 H ALA 19 27.195 15.381 -5.442 135 HA ALA 19 HA ALA 19 26.713 18.176 -4.824 136 HB1 ALA 19 HB1 ALA 19 25.176 17.302 -3.191 137 HB2 ALA 19 HB2 ALA 19 25.048 16.308 -4.665 138 HB3 ALA 19 HB3 ALA 19 25.925 15.691 -3.251 139 H VAL 20 H VAL 20 28.715 15.629 -3.283 140 HA VAL 20 HA VAL 20 29.630 17.326 -1.095 141 HB VAL 20 HB VAL 20 30.848 14.820 -2.301 142 HG11 VAL 20 HG11 VAL 20 32.620 16.036 -1.112 143 HG12 VAL 20 HG12 VAL 20 31.546 16.277 0.286 144 HG13 VAL 20 HG13 VAL 20 32.104 14.648 -0.153 145 HG21 VAL 20 HG21 VAL 20 29.905 13.719 -0.306 146 HG22 VAL 20 HG22 VAL 20 29.216 15.262 0.241 147 HG23 VAL 20 HG23 VAL 20 28.619 14.485 -1.237 148 H ARG 21 H ARG 21 31.004 16.636 -4.332 149 HA ARG 21 HA ARG 21 33.199 18.377 -4.189 150 HB2 ARG 21 HB2 ARG 21 32.740 16.774 -6.031 151 HB3 ARG 21 HB3 ARG 21 31.439 17.803 -6.613 152 HG2 ARG 21 HG2 ARG 21 33.494 18.063 -7.927 153 HG3 ARG 21 HG3 ARG 21 32.954 19.573 -7.200 154 HD2 ARG 21 HD2 ARG 21 35.399 19.328 -7.114 155 HD3 ARG 21 HD3 ARG 21 34.700 19.446 -5.495 156 HE ARG 21 HE ARG 21 35.000 16.683 -6.356 157 HH11 ARG 21 HH11 ARG 21 36.941 19.325 -5.125 158 HH12 ARG 21 HH12 ARG 21 38.102 18.255 -4.389 159 HH21 ARG 21 HH21 ARG 21 36.513 15.367 -5.384 160 HH22 ARG 21 HH22 ARG 21 37.867 16.070 -4.552 161 H LEU 22 H LEU 22 29.852 19.301 -5.162 162 HA LEU 22 HA LEU 22 30.499 22.122 -5.249 163 HB2 LEU 22 HB2 LEU 22 27.923 20.598 -5.397 164 HB3 LEU 22 HB3 LEU 22 27.948 22.328 -4.998 165 HG LEU 22 HG LEU 22 29.418 22.717 -7.039 166 HD11 LEU 22 HD11 LEU 22 29.234 21.102 -8.886 167 HD12 LEU 22 HD12 LEU 22 28.425 19.943 -7.812 168 HD13 LEU 22 HD13 LEU 22 30.122 20.397 -7.533 169 HD21 LEU 22 HD21 LEU 22 27.062 23.281 -6.856 170 HD22 LEU 22 HD22 LEU 22 26.614 21.666 -7.460 171 HD23 LEU 22 HD23 LEU 22 27.504 22.811 -8.511 172 H ALA 23 H ALA 23 29.303 20.100 -2.510 173 HA ALA 23 HA ALA 23 29.054 22.298 -0.715 174 HB1 ALA 23 HB1 ALA 23 30.069 19.487 -0.147 175 HB2 ALA 23 HB2 ALA 23 29.375 20.631 1.029 176 HB3 ALA 23 HB3 ALA 23 28.360 19.962 -0.260 177 H SER 24 H SER 24 31.950 20.561 -1.780 178 HA SER 24 HA SER 24 33.831 22.189 -0.400 179 HB2 SER 24 HB2 SER 24 34.437 20.670 -2.951 180 HB3 SER 24 HB3 SER 24 35.531 21.149 -1.659 181 HG SER 24 HG SER 24 33.410 19.237 -1.478 182 H ILE 25 H ILE 25 32.528 22.605 -3.781 183 HA ILE 25 HA ILE 25 34.213 24.872 -4.276 184 HB ILE 25 HB ILE 25 31.521 24.561 -5.572 185 HG12 ILE 25 HG12 ILE 25 32.360 22.393 -5.964 186 HG13 ILE 25 HG13 ILE 25 32.637 23.290 -7.394 187 HG21 ILE 25 HG21 ILE 25 32.656 26.617 -6.117 188 HG22 ILE 25 HG22 ILE 25 34.197 25.773 -6.392 189 HG23 ILE 25 HG23 ILE 25 32.848 25.544 -7.504 190 HD11 ILE 25 HD11 ILE 25 34.730 22.511 -5.337 191 HD12 ILE 25 HD12 ILE 25 34.456 21.787 -6.921 192 HD13 ILE 25 HD13 ILE 25 35.054 23.465 -6.820 193 H VAL 26 H VAL 26 30.974 24.549 -2.823 194 HA VAL 26 HA VAL 26 30.412 27.383 -2.557 195 HB VAL 26 HB VAL 26 29.388 24.967 -1.045 196 HG11 VAL 26 HG11 VAL 26 28.979 26.965 0.293 197 HG12 VAL 26 HG12 VAL 26 28.346 27.832 -1.120 198 HG13 VAL 26 HG13 VAL 26 27.464 26.444 -0.434 199 HG21 VAL 26 HG21 VAL 26 27.976 26.582 -3.231 200 HG22 VAL 26 HG22 VAL 26 28.840 25.086 -3.585 201 HG23 VAL 26 HG23 VAL 26 27.457 25.039 -2.510 202 H ASP 27 H ASP 27 31.722 24.921 -0.142 203 HA ASP 27 HA ASP 27 32.427 26.755 1.854 204 HB2 ASP 27 HB2 ASP 27 32.714 24.392 2.190 205 HB3 ASP 27 HB3 ASP 27 33.866 24.280 0.851 206 H SER 28 H SER 28 34.367 25.944 -1.045 207 HA SER 28 HA SER 28 36.556 27.657 -0.543 208 HB2 SER 28 HB2 SER 28 35.420 26.973 -3.285 209 HB3 SER 28 HB3 SER 28 37.041 27.575 -2.926 210 HG SER 28 HG SER 28 35.899 25.089 -2.106 211 H ARG 29 H ARG 29 33.403 28.452 -1.929 212 HA ARG 29 HA ARG 29 34.015 31.281 -2.379 213 HB2 ARG 29 HB2 ARG 29 32.398 29.952 -3.737 214 HB3 ARG 29 HB3 ARG 29 31.364 29.771 -2.335 215 HG2 ARG 29 HG2 ARG 29 30.474 31.471 -3.702 216 HG3 ARG 29 HG3 ARG 29 31.065 32.232 -2.229 217 HD2 ARG 29 HD2 ARG 29 33.005 33.108 -3.442 218 HD3 ARG 29 HD3 ARG 29 32.550 32.176 -4.885 219 HE ARG 29 HE ARG 29 30.441 33.988 -3.937 220 HH11 ARG 29 HH11 ARG 29 33.383 34.029 -5.825 221 HH12 ARG 29 HH12 ARG 29 32.839 35.340 -6.833 222 HH21 ARG 29 HH21 ARG 29 29.662 35.463 -5.487 223 HH22 ARG 29 HH22 ARG 29 30.814 36.168 -6.581 224 H LEU 30 H LEU 30 32.362 29.457 0.279 225 HA LEU 30 HA LEU 30 31.640 31.842 1.721 226 HB2 LEU 30 HB2 LEU 30 32.205 29.078 2.829 227 HB3 LEU 30 HB3 LEU 30 31.401 30.410 3.667 228 HG LEU 30 HG LEU 30 30.335 28.939 1.244 229 HD11 LEU 30 HD11 LEU 30 30.234 27.651 3.435 230 HD12 LEU 30 HD12 LEU 30 28.650 28.052 2.756 231 HD13 LEU 30 HD13 LEU 30 29.295 29.008 4.098 232 HD21 LEU 30 HD21 LEU 30 28.217 30.172 1.636 233 HD22 LEU 30 HD22 LEU 30 29.530 31.226 1.120 234 HD23 LEU 30 HD23 LEU 30 29.048 31.184 2.835 235 H ILE 31 H ILE 31 34.650 29.917 1.720 236 HA ILE 31 HA ILE 31 36.045 31.660 3.590 237 HB ILE 31 HB ILE 31 36.980 29.618 1.539 238 HG12 ILE 31 HG12 ILE 31 36.903 29.463 4.593 239 HG13 ILE 31 HG13 ILE 31 35.626 28.832 3.563 240 HG21 ILE 31 HG21 ILE 31 38.639 31.052 3.667 241 HG22 ILE 31 HG22 ILE 31 39.197 29.689 2.674 242 HG23 ILE 31 HG23 ILE 31 38.824 31.216 1.904 243 HD11 ILE 31 HD11 ILE 31 37.256 27.301 2.463 244 HD12 ILE 31 HD12 ILE 31 38.490 27.822 3.640 245 HD13 ILE 31 HD13 ILE 31 37.026 27.005 4.196 246 H GLY 32 H GLY 32 35.670 31.605 0.055 247 HA2 GLY 32 HA2 GLY 32 37.726 33.390 -0.675 248 HA3 GLY 32 HA3 GLY 32 36.288 32.930 -1.620 249 H THR 33 H THR 33 34.295 33.905 0.020 250 HA THR 33 HA THR 33 34.740 36.774 0.410 251 HB THR 33 HB THR 33 34.354 36.604 -2.025 252 HG1 THR 33 HG1 THR 33 32.785 38.186 -2.114 253 HG21 THR 33 HG21 THR 33 31.495 35.787 -1.378 254 HG22 THR 33 HG22 THR 33 32.752 34.641 -1.898 255 HG23 THR 33 HG23 THR 33 32.262 35.974 -2.968 256 H GLY 34 H GLY 34 32.553 33.984 0.704 257 HA2 GLY 34 HA2 GLY 34 31.453 33.644 2.797 258 HA3 GLY 34 HA3 GLY 34 31.286 35.368 3.052 259 H SER 35 H SER 35 30.348 34.434 -0.119 260 HA SER 35 HA SER 35 27.678 33.475 0.450 261 HB2 SER 35 HB2 SER 35 26.580 35.362 -0.777 262 HB3 SER 35 HB3 SER 35 27.253 35.837 0.786 263 HG SER 35 HG SER 35 28.595 36.198 -1.702 264 H VAL 36 H VAL 36 26.850 32.323 -1.395 265 HA VAL 36 HA VAL 36 28.549 32.402 -3.858 266 HB VAL 36 HB VAL 36 28.591 30.253 -2.574 267 HG11 VAL 36 HG11 VAL 36 26.669 28.775 -2.588 268 HG12 VAL 36 HG12 VAL 36 26.226 30.281 -1.766 269 HG13 VAL 36 HG13 VAL 36 25.679 29.985 -3.426 270 HG21 VAL 36 HG21 VAL 36 28.269 28.815 -4.495 271 HG22 VAL 36 HG22 VAL 36 27.265 30.040 -5.300 272 HG23 VAL 36 HG23 VAL 36 28.995 30.338 -5.027 273 H ASP 37 H ASP 37 27.531 32.596 -5.863 274 HA ASP 37 HA ASP 37 24.665 33.296 -5.864 275 HB2 ASP 37 HB2 ASP 37 26.789 34.523 -7.633 276 HB3 ASP 37 HB3 ASP 37 25.168 35.114 -7.297 277 H GLU 38 H GLU 38 23.604 32.846 -7.927 278 HA GLU 38 HA GLU 38 24.012 30.373 -8.966 279 HB2 GLU 38 HB2 GLU 38 22.104 32.172 -9.326 280 HB3 GLU 38 HB3 GLU 38 22.991 32.551 -10.807 281 HG2 GLU 38 HG2 GLU 38 22.869 29.934 -11.204 282 HG3 GLU 38 HG3 GLU 38 21.611 29.992 -9.974 283 H ASP 39 H ASP 39 25.516 33.322 -10.350 284 HA ASP 39 HA ASP 39 26.652 32.014 -12.612 285 HB2 ASP 39 HB2 ASP 39 27.532 34.593 -11.286 286 HB3 ASP 39 HB3 ASP 39 27.908 34.073 -12.928 287 H PHE 40 H PHE 40 27.660 31.935 -9.292 288 HA PHE 40 HA PHE 40 30.417 31.103 -10.019 289 HB2 PHE 40 HB2 PHE 40 29.848 32.627 -8.027 290 HB3 PHE 40 HB3 PHE 40 29.219 31.185 -7.246 291 HD1 PHE 40 HD2 PHE 40 32.241 32.808 -8.690 292 HD2 PHE 40 HD1 PHE 40 30.793 29.484 -6.354 293 HE1 PHE 40 HE2 PHE 40 34.571 32.241 -8.046 294 HE2 PHE 40 HE1 PHE 40 33.128 28.916 -5.726 295 HZ PHE 40 HZ PHE 40 35.017 30.286 -6.573 296 H LEU 41 H LEU 41 27.384 29.655 -9.984 297 HA LEU 41 HA LEU 41 28.502 26.952 -9.298 298 HB2 LEU 41 HB2 LEU 41 25.766 28.203 -8.932 299 HB3 LEU 41 HB3 LEU 41 25.980 26.458 -8.848 300 HG LEU 41 HG LEU 41 27.322 28.547 -7.059 301 HD11 LEU 41 HD11 LEU 41 25.199 26.448 -6.440 302 HD12 LEU 41 HD12 LEU 41 24.918 28.201 -6.608 303 HD13 LEU 41 HD13 LEU 41 25.928 27.592 -5.287 304 HD21 LEU 41 HD21 LEU 41 28.873 26.694 -7.213 305 HD22 LEU 41 HD22 LEU 41 27.556 25.509 -7.051 306 HD23 LEU 41 HD23 LEU 41 28.024 26.538 -5.683 307 H ARG 42 H ARG 42 26.447 28.684 -11.690 308 HA ARG 42 HA ARG 42 25.939 26.372 -13.268 309 HB2 ARG 42 HB2 ARG 42 25.356 27.883 -15.072 310 HB3 ARG 42 HB3 ARG 42 24.748 28.461 -13.531 311 HG2 ARG 42 HG2 ARG 42 26.654 30.091 -13.445 312 HG3 ARG 42 HG3 ARG 42 27.162 29.545 -15.047 313 HD2 ARG 42 HD2 ARG 42 24.953 30.191 -15.988 314 HD3 ARG 42 HD3 ARG 42 24.396 30.655 -14.382 315 HE ARG 42 HE ARG 42 25.459 32.687 -14.570 316 HH11 ARG 42 HH11 ARG 42 26.805 30.719 -17.172 317 HH12 ARG 42 HH12 ARG 42 27.610 32.100 -17.862 318 HH21 ARG 42 HH21 ARG 42 26.428 34.267 -15.428 319 HH22 ARG 42 HH22 ARG 42 27.406 34.126 -16.892 320 H GLU 43 H GLU 43 28.925 28.208 -13.118 321 HA GLU 43 HA GLU 43 30.181 26.690 -15.295 322 HB2 GLU 43 HB2 GLU 43 32.201 27.976 -14.642 323 HB3 GLU 43 HB3 GLU 43 30.808 28.988 -15.045 324 HG2 GLU 43 HG2 GLU 43 30.389 29.497 -12.729 325 HG3 GLU 43 HG3 GLU 43 31.472 28.230 -12.189 326 H GLN 44 H GLN 44 29.313 25.587 -12.269 327 HA GLN 44 HA GLN 44 31.810 24.010 -11.858 328 HB2 GLN 44 HB2 GLN 44 29.774 24.929 -9.795 329 HB3 GLN 44 HB3 GLN 44 31.263 24.049 -9.483 330 HG2 GLN 44 HG2 GLN 44 31.052 26.878 -10.575 331 HG3 GLN 44 HG3 GLN 44 31.456 26.445 -8.934 332 HE21 GLN 44 HE21 GLN 44 33.086 27.997 -10.966 333 HE22 GLN 44 HE22 GLN 44 34.598 27.116 -10.975 334 H ILE 45 H ILE 45 28.395 23.849 -12.551 335 HA ILE 45 HA ILE 45 27.821 21.254 -11.531 336 HB ILE 45 HB ILE 45 26.458 21.109 -13.805 337 HG12 ILE 45 HG12 ILE 45 26.541 24.129 -13.530 338 HG13 ILE 45 HG13 ILE 45 27.511 23.266 -14.729 339 HG21 ILE 45 HG21 ILE 45 25.622 21.162 -11.539 340 HG22 ILE 45 HG22 ILE 45 25.682 22.957 -11.545 341 HG23 ILE 45 HG23 ILE 45 24.590 22.070 -12.649 342 HD11 ILE 45 HD11 ILE 45 25.436 22.253 -15.667 343 HD12 ILE 45 HD12 ILE 45 24.470 23.260 -14.559 344 HD13 ILE 45 HD13 ILE 45 25.488 24.028 -15.788 345 H ARG 46 H ARG 46 28.603 21.742 -15.097 346 HA ARG 46 HA ARG 46 30.107 21.055 -16.359 347 HB2 ARG 46 HB2 ARG 46 31.591 19.908 -13.965 348 HB3 ARG 46 HB3 ARG 46 32.226 19.943 -15.621 349 HG2 ARG 46 HG2 ARG 46 32.255 22.325 -15.710 350 HG3 ARG 46 HG3 ARG 46 31.311 22.492 -14.221 351 HD2 ARG 46 HD2 ARG 46 33.087 21.437 -12.927 352 HD3 ARG 46 HD3 ARG 46 34.069 21.262 -14.404 353 HE ARG 46 HE ARG 46 33.163 24.010 -13.921 354 HH11 ARG 46 HH11 ARG 46 35.743 21.795 -13.068 355 HH12 ARG 46 HH12 ARG 46 36.871 23.085 -12.758 356 HH21 ARG 46 HH21 ARG 46 34.589 25.575 -13.529 357 HH22 ARG 46 HH22 ARG 46 36.224 25.214 -13.034 358 H ASP 47 H ASP 47 28.341 18.965 -14.548 359 HA ASP 47 HA ASP 47 27.977 17.288 -16.949 360 HB2 ASP 47 HB2 ASP 47 29.859 16.149 -15.704 361 HB3 ASP 47 HB3 ASP 47 28.748 15.894 -14.356 362 H ALA 48 H ALA 48 26.924 18.135 -13.666 363 HA ALA 48 HA ALA 48 24.403 16.669 -13.791 364 HB1 ALA 48 HB1 ALA 48 25.331 18.900 -11.933 365 HB2 ALA 48 HB2 ALA 48 23.921 17.843 -11.708 366 HB3 ALA 48 HB3 ALA 48 25.558 17.166 -11.646 367 H ARG 49 H ARG 49 22.300 17.715 -13.882 368 HA ARG 49 HA ARG 49 22.215 19.743 -15.983 369 HB2 ARG 49 HB2 ARG 49 20.623 17.667 -15.536 370 HB3 ARG 49 HB3 ARG 49 19.769 18.786 -14.478 371 HG2 ARG 49 HG2 ARG 49 18.662 18.969 -16.547 372 HG3 ARG 49 HG3 ARG 49 19.715 20.394 -16.513 373 HD2 ARG 49 HD2 ARG 49 21.359 19.223 -17.942 374 HD3 ARG 49 HD3 ARG 49 20.337 17.770 -17.934 375 HE ARG 49 HE ARG 49 18.776 19.970 -18.844 376 HH11 ARG 49 HH11 ARG 49 21.442 18.025 -20.023 377 HH12 ARG 49 HH12 ARG 49 21.026 18.296 -21.693 378 HH21 ARG 49 HH21 ARG 49 18.295 20.279 -20.993 379 HH22 ARG 49 HH22 ARG 49 19.283 19.546 -22.222 380 H TYR 50 H TYR 50 21.089 19.691 -12.577 381 HA TYR 50 HA TYR 50 21.201 22.679 -12.509 382 HB2 TYR 50 HB2 TYR 50 19.171 21.021 -11.023 383 HB3 TYR 50 HB3 TYR 50 19.094 22.715 -11.443 384 HD1 TYR 50 HD1 TYR 50 19.380 22.826 -14.343 385 HD2 TYR 50 HD2 TYR 50 17.406 19.864 -11.929 386 HE1 TYR 50 HE1 TYR 50 17.842 22.336 -16.224 387 HE2 TYR 50 HE2 TYR 50 15.891 19.327 -13.838 388 HH TYR 50 HH TYR 50 16.060 21.076 -16.943 389 H ALA 51 H ALA 51 21.932 23.630 -10.564 390 HA ALA 51 HA ALA 51 22.406 21.820 -8.216 391 HB1 ALA 51 HB1 ALA 51 24.128 24.171 -9.096 392 HB2 ALA 51 HB2 ALA 51 24.329 23.217 -7.612 393 HB3 ALA 51 HB3 ALA 51 24.551 22.448 -9.195 394 H VAL 52 H VAL 52 21.884 22.661 -6.164 395 HA VAL 52 HA VAL 52 20.334 25.225 -6.070 396 HB VAL 52 HB VAL 52 19.319 22.503 -5.190 397 HG11 VAL 52 HG11 VAL 52 18.100 25.270 -4.825 398 HG12 VAL 52 HG12 VAL 52 17.219 23.744 -4.592 399 HG13 VAL 52 HG13 VAL 52 18.576 24.134 -3.540 400 HG21 VAL 52 HG21 VAL 52 17.453 23.001 -6.779 401 HG22 VAL 52 HG22 VAL 52 18.368 24.409 -7.354 402 HG23 VAL 52 HG23 VAL 52 19.008 22.767 -7.569 403 H ILE 53 H ILE 53 20.328 26.319 -4.144 404 HA ILE 53 HA ILE 53 22.304 25.323 -2.174 405 HB ILE 53 HB ILE 53 22.037 27.804 -3.715 406 HG12 ILE 53 HG12 ILE 53 23.959 26.353 -3.914 407 HG13 ILE 53 HG13 ILE 53 24.428 27.949 -3.347 408 HG21 ILE 53 HG21 ILE 53 21.333 28.936 -1.707 409 HG22 ILE 53 HG22 ILE 53 22.611 28.181 -0.739 410 HG23 ILE 53 HG23 ILE 53 23.022 29.338 -2.020 411 HD11 ILE 53 HD11 ILE 53 25.697 26.475 -2.021 412 HD12 ILE 53 HD12 ILE 53 24.354 26.894 -0.938 413 HD13 ILE 53 HD13 ILE 53 24.355 25.346 -1.800 414 H ARG 54 H ARG 54 21.887 25.130 -0.174 415 HA ARG 54 HA ARG 54 19.755 26.733 1.182 416 HB2 ARG 54 HB2 ARG 54 19.158 24.411 0.562 417 HB3 ARG 54 HB3 ARG 54 20.531 23.841 1.498 418 HG2 ARG 54 HG2 ARG 54 18.544 23.467 2.800 419 HG3 ARG 54 HG3 ARG 54 19.458 24.752 3.580 420 HD2 ARG 54 HD2 ARG 54 17.103 25.285 3.595 421 HD3 ARG 54 HD3 ARG 54 17.952 26.443 2.556 422 HE ARG 54 HE ARG 54 16.951 24.226 1.002 423 HH11 ARG 54 HH11 ARG 54 15.691 27.047 2.647 424 HH12 ARG 54 HH12 ARG 54 14.298 27.153 1.606 425 HH21 ARG 54 HH21 ARG 54 15.166 24.421 -0.309 426 HH22 ARG 54 HH22 ARG 54 14.012 25.686 -0.027 427 H ILE 55 H ILE 55 21.426 28.111 1.675 428 HA ILE 55 HA ILE 55 23.461 27.308 3.724 429 HB ILE 55 HB ILE 55 23.272 29.751 1.956 430 HG12 ILE 55 HG12 ILE 55 25.729 28.034 2.342 431 HG13 ILE 55 HG13 ILE 55 24.440 27.436 1.297 432 HG21 ILE 55 HG21 ILE 55 25.320 30.589 3.122 433 HG22 ILE 55 HG22 ILE 55 23.915 30.580 4.172 434 HG23 ILE 55 HG23 ILE 55 25.142 29.302 4.335 435 HD11 ILE 55 HD11 ILE 55 24.621 29.456 -0.090 436 HD12 ILE 55 HD12 ILE 55 25.908 30.082 0.963 437 HD13 ILE 55 HD13 ILE 55 26.166 28.593 0.035 438 HA PRO 56 HA PRO 56 20.406 28.986 6.621 439 HB2 PRO 56 HB2 PRO 56 22.840 28.998 8.411 440 HB3 PRO 56 HB3 PRO 56 21.168 28.472 8.783 441 HG2 PRO 56 HG2 PRO 56 23.069 26.628 8.239 442 HG3 PRO 56 HG3 PRO 56 21.440 26.466 7.497 443 HD2 PRO 56 HD2 PRO 56 23.970 27.583 6.251 444 HD3 PRO 56 HD3 PRO 56 22.767 26.435 5.571 445 H GLY 57 H GLY 57 19.800 31.060 7.118 446 HA2 GLY 57 HA2 GLY 57 19.960 33.300 7.656 447 HA3 GLY 57 HA3 GLY 57 21.714 33.238 7.508 448 H GLN 58 H GLN 58 20.605 31.940 4.633 449 HA GLN 58 HA GLN 58 19.995 34.536 3.327 450 HB2 GLN 58 HB2 GLN 58 21.671 34.368 1.713 451 HB3 GLN 58 HB3 GLN 58 22.466 33.955 3.234 452 HG2 GLN 58 HG2 GLN 58 22.443 31.626 2.717 453 HG3 GLN 58 HG3 GLN 58 21.493 31.882 1.251 454 HE21 GLN 58 HE21 GLN 58 22.726 31.703 -0.545 455 HE22 GLN 58 HE22 GLN 58 24.338 32.362 -0.732 456 HA PRO 59 HA PRO 59 16.914 32.208 1.221 457 HB2 PRO 59 HB2 PRO 59 16.596 33.448 -1.198 458 HB3 PRO 59 HB3 PRO 59 16.136 34.199 0.364 459 HG2 PRO 59 HG2 PRO 59 18.714 34.582 -1.195 460 HG3 PRO 59 HG3 PRO 59 17.638 35.843 -0.516 461 HD2 PRO 59 HD2 PRO 59 19.849 35.015 0.799 462 HD3 PRO 59 HD3 PRO 59 18.348 35.390 1.694 463 H VAL 60 H VAL 60 16.533 30.550 -0.219 464 HA VAL 60 HA VAL 60 18.695 29.106 -1.422 465 HB VAL 60 HB VAL 60 16.840 27.832 -0.770 466 HG11 VAL 60 HG11 VAL 60 15.026 29.461 -0.715 467 HG12 VAL 60 HG12 VAL 60 15.026 29.569 -2.491 468 HG13 VAL 60 HG13 VAL 60 14.538 28.070 -1.679 469 HG21 VAL 60 HG21 VAL 60 16.448 27.951 -3.792 470 HG22 VAL 60 HG22 VAL 60 17.797 27.112 -3.006 471 HG23 VAL 60 HG23 VAL 60 16.139 26.589 -2.701 472 H VAL 61 H VAL 61 19.588 29.072 -3.336 473 HA VAL 61 HA VAL 61 18.296 30.506 -5.611 474 HB VAL 61 HB VAL 61 20.191 31.755 -4.734 475 HG11 VAL 61 HG11 VAL 61 22.511 31.037 -5.169 476 HG12 VAL 61 HG12 VAL 61 21.687 30.065 -3.950 477 HG13 VAL 61 HG13 VAL 61 21.922 29.416 -5.599 478 HG21 VAL 61 HG21 VAL 61 20.747 30.669 -7.528 479 HG22 VAL 61 HG22 VAL 61 19.520 31.901 -7.139 480 HG23 VAL 61 HG23 VAL 61 21.235 32.243 -6.874 481 H GLU 62 H GLU 62 18.468 29.575 -7.670 482 HA GLU 62 HA GLU 62 19.129 26.659 -7.692 483 HB2 GLU 62 HB2 GLU 62 16.695 28.052 -8.882 484 HB3 GLU 62 HB3 GLU 62 17.093 26.337 -9.032 485 HG2 GLU 62 HG2 GLU 62 16.848 26.046 -6.593 486 HG3 GLU 62 HG3 GLU 62 16.489 27.761 -6.395 487 H VAL 63 H VAL 63 20.460 26.085 -9.315 488 HA VAL 63 HA VAL 63 21.330 28.078 -11.298 489 HB VAL 63 HB VAL 63 22.564 25.513 -10.255 490 HG11 VAL 63 HG11 VAL 63 23.949 27.864 -11.539 491 HG12 VAL 63 HG12 VAL 63 24.678 26.337 -10.982 492 HG13 VAL 63 HG13 VAL 63 23.582 26.318 -12.357 493 HG21 VAL 63 HG21 VAL 63 23.282 28.286 -9.245 494 HG22 VAL 63 HG22 VAL 63 22.230 27.181 -8.346 495 HG23 VAL 63 HG23 VAL 63 23.862 26.703 -8.667 496 H GLY 64 H GLY 64 21.736 27.335 -13.580 497 HA2 GLY 64 HA2 GLY 64 21.207 26.131 -15.444 498 HA3 GLY 64 HA3 GLY 64 20.767 24.751 -14.440 499 H THR 65 H THR 65 18.558 24.497 -13.779 500 HA THR 65 HA THR 65 16.549 26.541 -14.323 501 HB THR 65 HB THR 65 16.202 23.926 -15.851 502 HG1 THR 65 HG1 THR 65 17.585 26.169 -16.506 503 HG21 THR 65 HG21 THR 65 14.518 25.282 -17.132 504 HG22 THR 65 HG22 THR 65 14.721 26.590 -15.948 505 HG23 THR 65 HG23 THR 65 14.069 25.005 -15.454 506 H LYS 66 H LYS 66 14.472 25.962 -13.285 507 HA LYS 66 HA LYS 66 14.772 24.242 -11.058 508 HB2 LYS 66 HB2 LYS 66 13.353 26.313 -11.202 509 HB3 LYS 66 HB3 LYS 66 12.173 25.396 -12.155 510 HG2 LYS 66 HG2 LYS 66 11.919 23.804 -10.230 511 HG3 LYS 66 HG3 LYS 66 13.110 24.754 -9.326 512 HD2 LYS 66 HD2 LYS 66 11.540 26.771 -9.599 513 HD3 LYS 66 HD3 LYS 66 10.362 25.646 -10.289 514 HE2 LYS 66 HE2 LYS 66 9.735 25.785 -8.029 515 HE3 LYS 66 HE3 LYS 66 10.621 24.260 -8.134 516 HZ1 LYS 66 HZ1 LYS 66 11.703 26.849 -7.135 517 HZ2 LYS 66 HZ2 LYS 66 12.615 25.512 -7.280 518 HZ3 LYS 66 HZ3 LYS 66 11.359 25.539 -6.215 519 HA PRO 67 HA PRO 67 13.633 20.385 -13.022 520 HB2 PRO 67 HB2 PRO 67 13.716 18.731 -10.853 521 HB3 PRO 67 HB3 PRO 67 15.174 19.400 -11.639 522 HG2 PRO 67 HG2 PRO 67 13.784 20.362 -9.141 523 HG3 PRO 67 HG3 PRO 67 15.543 20.180 -9.482 524 HD2 PRO 67 HD2 PRO 67 14.217 22.582 -9.663 525 HD3 PRO 67 HD3 PRO 67 15.650 22.159 -10.653 526 H THR 68 H THR 68 11.953 19.068 -13.276 527 HA THR 68 HA THR 68 9.417 19.889 -12.418 528 HB THR 68 HB THR 68 10.027 19.104 -14.668 529 HG1 THR 68 HG1 THR 68 7.851 17.715 -13.512 530 HG21 THR 68 HG21 THR 68 11.293 17.031 -13.980 531 HG22 THR 68 HG22 THR 68 10.091 16.777 -15.255 532 HG23 THR 68 HG23 THR 68 9.729 16.272 -13.596 533 H GLY 69 H GLY 69 11.313 17.326 -11.161 534 HA2 GLY 69 HA2 GLY 69 10.651 16.547 -8.818 535 HA3 GLY 69 HA3 GLY 69 9.043 16.256 -9.508 536 H ASP 70 H ASP 70 9.949 15.249 -11.987 537 HA ASP 70 HA ASP 70 10.755 12.493 -11.393 538 HB2 ASP 70 HB2 ASP 70 10.334 13.853 -14.056 539 HB3 ASP 70 HB3 ASP 70 10.460 12.109 -13.768 540 H VAL 71 H VAL 71 12.719 13.538 -10.307 541 HA VAL 71 HA VAL 71 15.053 13.651 -12.094 542 HB VAL 71 HB VAL 71 15.906 15.649 -10.974 543 HG11 VAL 71 HG11 VAL 71 13.192 16.464 -12.103 544 HG12 VAL 71 HG12 VAL 71 14.773 17.235 -12.263 545 HG13 VAL 71 HG13 VAL 71 14.457 15.745 -13.120 546 HG21 VAL 71 HG21 VAL 71 14.684 15.508 -8.835 547 HG22 VAL 71 HG22 VAL 71 14.562 17.088 -9.590 548 HG23 VAL 71 HG23 VAL 71 13.185 15.967 -9.668 549 H LEU 72 H LEU 72 17.057 13.410 -11.036 550 HA LEU 72 HA LEU 72 17.079 11.580 -8.674 551 HB2 LEU 72 HB2 LEU 72 19.186 12.515 -10.683 552 HB3 LEU 72 HB3 LEU 72 19.532 11.413 -9.352 553 HG LEU 72 HG LEU 72 17.379 10.787 -11.365 554 HD11 LEU 72 HD11 LEU 72 20.341 10.126 -11.630 555 HD12 LEU 72 HD12 LEU 72 19.397 11.193 -12.693 556 HD13 LEU 72 HD13 LEU 72 19.041 9.462 -12.651 557 HD21 LEU 72 HD21 LEU 72 17.488 9.425 -9.304 558 HD22 LEU 72 HD22 LEU 72 19.197 9.064 -9.635 559 HD23 LEU 72 HD23 LEU 72 17.923 8.450 -10.719 560 H GLN 73 H GLN 73 17.861 12.353 -6.620 561 HA GLN 73 HA GLN 73 18.857 15.171 -6.578 562 HB2 GLN 73 HB2 GLN 73 17.200 13.521 -4.646 563 HB3 GLN 73 HB3 GLN 73 17.846 15.134 -4.337 564 HG2 GLN 73 HG2 GLN 73 16.600 15.896 -6.451 565 HG3 GLN 73 HG3 GLN 73 15.752 14.354 -6.408 566 HE21 GLN 73 HE21 GLN 73 15.038 17.367 -5.870 567 HE22 GLN 73 HE22 GLN 73 14.134 17.270 -4.353 568 H GLY 74 H GLY 74 20.929 15.344 -6.167 569 HA2 GLY 74 HA2 GLY 74 22.414 13.434 -4.405 570 HA3 GLY 74 HA3 GLY 74 23.110 14.642 -5.509 571 H ARG 75 H ARG 75 23.469 14.388 -2.507 572 HA ARG 75 HA ARG 75 22.661 17.096 -1.708 573 HB2 ARG 75 HB2 ARG 75 20.608 15.699 -1.345 574 HB3 ARG 75 HB3 ARG 75 21.522 14.690 -0.224 575 HG2 ARG 75 HG2 ARG 75 21.877 16.638 1.266 576 HG3 ARG 75 HG3 ARG 75 21.043 17.694 0.104 577 HD2 ARG 75 HD2 ARG 75 18.965 16.441 0.403 578 HD3 ARG 75 HD3 ARG 75 19.785 15.279 1.469 579 HE ARG 75 HE ARG 75 20.179 17.861 2.567 580 HH11 ARG 75 HH11 ARG 75 17.496 15.665 2.088 581 HH12 ARG 75 HH12 ARG 75 16.624 16.265 3.473 582 HH21 ARG 75 HH22 ARG 75 19.024 18.581 4.342 583 HH22 ARG 75 HH21 ARG 75 17.477 17.883 4.710 584 H ALA 76 H ALA 76 24.002 17.946 -0.335 585 HA ALA 76 HA ALA 76 25.773 16.267 1.424 586 HB1 ALA 76 HB1 ALA 76 26.907 16.577 -0.728 587 HB2 ALA 76 HB2 ALA 76 26.657 18.336 -0.633 588 HB3 ALA 76 HB3 ALA 76 27.736 17.517 0.526 589 H THR 77 H THR 77 27.176 17.541 2.863 590 HA THR 77 HA THR 77 25.902 20.055 3.856 591 HB THR 77 HB THR 77 27.178 17.892 5.557 592 HG1 THR 77 HG1 THR 77 25.084 17.625 6.333 593 HG21 THR 77 HG21 THR 77 25.722 20.461 6.361 594 HG22 THR 77 HG22 THR 77 27.468 20.184 6.516 595 HG23 THR 77 HG23 THR 77 26.338 19.219 7.469 596 H GLY 78 H GLY 78 27.289 21.697 4.036 597 HA2 GLY 78 HA2 GLY 78 30.099 21.301 3.087 598 HA3 GLY 78 HA3 GLY 78 29.218 22.802 3.086 599 H GLU 79 H GLU 79 31.641 23.012 3.944 600 HA GLU 79 HA GLU 79 32.049 22.219 6.702 601 HB2 GLU 79 HB2 GLU 79 33.832 23.505 4.641 602 HB3 GLU 79 HB3 GLU 79 34.334 23.266 6.320 603 HG2 GLU 79 HG2 GLU 79 33.818 20.830 6.102 604 HG3 GLU 79 HG3 GLU 79 33.415 21.081 4.403 605 H GLU 80 H GLU 80 30.509 25.084 5.560 606 HA GLU 80 HA GLU 80 31.320 26.487 8.108 607 HB2 GLU 80 HB2 GLU 80 29.832 27.503 5.697 608 HB3 GLU 80 HB3 GLU 80 30.183 28.442 7.139 609 HG2 GLU 80 HG2 GLU 80 32.374 27.273 5.351 610 HG3 GLU 80 HG3 GLU 80 31.649 28.840 5.198 611 H GLY 81 H GLY 81 29.298 24.165 7.184 612 HA2 GLY 81 HA2 GLY 81 27.603 23.239 8.397 613 HA3 GLY 81 HA3 GLY 81 27.206 24.787 9.131 614 H GLU 82 H GLU 82 27.500 24.733 5.592 615 HA GLU 82 HA GLU 82 24.680 25.302 5.307 616 HB2 GLU 82 HB2 GLU 82 25.257 26.055 3.205 617 HB3 GLU 82 HB3 GLU 82 26.530 26.646 4.275 618 HG2 GLU 82 HG2 GLU 82 26.873 24.177 2.512 619 HG3 GLU 82 HG3 GLU 82 27.087 25.803 1.905 620 H THR 83 H THR 83 23.707 24.426 3.092 621 HA THR 83 HA THR 83 24.132 21.485 2.889 622 HB THR 83 HB THR 83 21.509 22.951 3.287 623 HG1 THR 83 HG1 THR 83 22.704 22.198 5.088 624 HG21 THR 83 HG21 THR 83 21.907 20.068 2.384 625 HG22 THR 83 HG22 THR 83 21.093 21.363 1.465 626 HG23 THR 83 HG23 THR 83 20.379 20.782 2.968 627 H VAL 84 H VAL 84 24.138 20.750 0.928 628 HA VAL 84 HA VAL 84 23.567 22.573 -1.418 629 HB VAL 84 HB VAL 84 25.872 20.613 -1.091 630 HG11 VAL 84 HG11 VAL 84 25.145 22.351 -3.490 631 HG12 VAL 84 HG12 VAL 84 26.645 21.417 -3.282 632 HG13 VAL 84 HG13 VAL 84 25.118 20.567 -3.442 633 HG21 VAL 84 HG21 VAL 84 26.373 22.648 0.077 634 HG22 VAL 84 HG22 VAL 84 27.178 22.780 -1.503 635 HG23 VAL 84 HG23 VAL 84 25.667 23.639 -1.219 636 H LEU 85 H LEU 85 22.540 21.737 -3.172 637 HA LEU 85 HA LEU 85 21.879 18.853 -3.179 638 HB2 LEU 85 HB2 LEU 85 19.993 20.179 -2.192 639 HB3 LEU 85 HB3 LEU 85 19.949 21.145 -3.651 640 HG LEU 85 HG LEU 85 19.492 18.855 -4.883 641 HD11 LEU 85 HD11 LEU 85 19.977 17.545 -2.690 642 HD12 LEU 85 HD12 LEU 85 18.536 17.111 -3.624 643 HD13 LEU 85 HD13 LEU 85 18.400 18.107 -2.147 644 HD21 LEU 85 HD21 LEU 85 17.085 19.028 -4.416 645 HD22 LEU 85 HD22 LEU 85 17.821 20.613 -4.698 646 HD23 LEU 85 HD23 LEU 85 17.425 20.107 -3.041 647 H VAL 86 H VAL 86 21.684 17.974 -5.172 648 HA VAL 86 HA VAL 86 22.248 19.598 -7.639 649 HB VAL 86 HB VAL 86 23.523 16.881 -7.120 650 HG11 VAL 86 HG11 VAL 86 24.824 17.471 -9.156 651 HG12 VAL 86 HG12 VAL 86 23.099 17.279 -9.482 652 HG13 VAL 86 HG13 VAL 86 23.802 18.909 -9.376 653 HG21 VAL 86 HG21 VAL 86 24.610 18.520 -5.674 654 HG22 VAL 86 HG22 VAL 86 25.674 18.108 -7.026 655 HG23 VAL 86 HG23 VAL 86 24.788 19.653 -7.038 656 H GLU 87 H GLU 87 21.059 18.942 -9.464 657 HA GLU 87 HA GLU 87 19.349 16.568 -9.091 658 HB2 GLU 87 HB2 GLU 87 18.209 19.301 -9.715 659 HB3 GLU 87 HB3 GLU 87 17.322 17.767 -9.700 660 HG2 GLU 87 HG2 GLU 87 18.041 17.460 -7.287 661 HG3 GLU 87 HG3 GLU 87 18.724 19.083 -7.323 662 H GLU 88 H GLU 88 19.091 15.368 -10.724 663 HA GLU 88 HA GLU 88 19.694 16.346 -13.500 664 HB2 GLU 88 HB2 GLU 88 20.203 13.504 -12.545 665 HB3 GLU 88 HB3 GLU 88 20.571 14.203 -14.117 666 HG2 GLU 88 HG2 GLU 88 22.103 15.832 -12.780 667 HG3 GLU 88 HG3 GLU 88 21.958 14.624 -11.483 668 HA PRO 89 HA PRO 89 15.649 14.685 -14.675 669 HB2 PRO 89 HB2 PRO 89 16.134 13.861 -17.262 670 HB3 PRO 89 HB3 PRO 89 15.868 15.563 -16.778 671 HG2 PRO 89 HG2 PRO 89 18.533 14.137 -17.152 672 HG3 PRO 89 HG3 PRO 89 18.015 15.719 -17.833 673 HD2 PRO 89 HD2 PRO 89 19.513 15.588 -15.613 674 HD3 PRO 89 HD3 PRO 89 18.156 16.756 -15.692 675 H ARG 90 H ARG 90 14.728 12.770 -14.327 676 HA ARG 90 HA ARG 90 16.383 10.406 -13.797 677 HB2 ARG 90 HB2 ARG 90 14.580 11.211 -12.256 678 HB3 ARG 90 HB3 ARG 90 13.380 10.760 -13.478 679 HG2 ARG 90 HG2 ARG 90 14.066 8.409 -13.329 680 HG3 ARG 90 HG3 ARG 90 15.376 8.832 -12.205 681 HD2 ARG 90 HD2 ARG 90 13.701 9.662 -10.573 682 HD3 ARG 90 HD3 ARG 90 12.393 9.232 -11.673 683 HE ARG 90 HE ARG 90 14.002 7.451 -9.990 684 HH11 ARG 90 HH11 ARG 90 11.804 7.470 -12.731 685 HH12 ARG 90 HH12 ARG 90 11.415 5.785 -12.536 686 HH21 ARG 90 HH21 ARG 90 13.459 5.318 -9.812 687 HH22 ARG 90 HH22 ARG 90 12.330 4.603 -10.925 Start of MODEL 19 1 H1 GLY 1 H1 GLY 1 12.954 -14.762 -12.246 2 H2 GLY 1 H2 GLY 1 11.642 -15.543 -11.650 3 H3 GLY 1 H3 GLY 1 12.934 -15.256 -10.685 4 HA2 GLY 1 HA2 GLY 1 11.167 -13.727 -10.135 5 HA3 GLY 1 HA3 GLY 1 12.583 -12.882 -10.787 6 H SER 2 H SER 2 10.957 -11.172 -11.187 7 HA SER 2 HA SER 2 9.974 -11.253 -13.949 8 HB2 SER 2 HB2 SER 2 7.711 -10.479 -13.360 9 HB3 SER 2 HB3 SER 2 8.024 -12.117 -12.772 10 HG SER 2 HG SER 2 7.013 -10.815 -11.189 11 H GLU 3 H GLU 3 9.301 -9.127 -14.712 12 HA GLU 3 HA GLU 3 11.192 -7.138 -14.206 13 HB2 GLU 3 HB2 GLU 3 8.425 -6.704 -15.414 14 HB3 GLU 3 HB3 GLU 3 9.850 -5.686 -15.594 15 HG2 GLU 3 HG2 GLU 3 10.007 -6.804 -17.555 16 HG3 GLU 3 HG3 GLU 3 10.938 -7.926 -16.572 17 H THR 4 H THR 4 11.521 -6.112 -12.331 18 HA THR 4 HA THR 4 9.233 -4.936 -10.793 19 HB THR 4 HB THR 4 11.594 -6.453 -9.620 20 HG1 THR 4 HG1 THR 4 10.189 -7.860 -10.637 21 HG21 THR 4 HG21 THR 4 10.202 -6.433 -7.548 22 HG22 THR 4 HG22 THR 4 9.033 -5.364 -8.356 23 HG23 THR 4 HG23 THR 4 10.694 -4.811 -8.032 24 H ARG 5 H ARG 5 9.548 -2.950 -9.956 25 HA ARG 5 HA ARG 5 11.796 -1.304 -10.752 26 HB2 ARG 5 HB2 ARG 5 9.324 -0.905 -9.034 27 HB3 ARG 5 HB3 ARG 5 10.597 0.299 -9.017 28 HG2 ARG 5 HG2 ARG 5 8.838 0.915 -10.587 29 HG3 ARG 5 HG3 ARG 5 10.405 0.734 -11.366 30 HD2 ARG 5 HD2 ARG 5 8.622 -0.141 -12.776 31 HD3 ARG 5 HD3 ARG 5 9.755 -1.412 -12.309 32 HE ARG 5 HE ARG 5 7.310 -1.098 -10.647 33 HH11 ARG 5 HH11 ARG 5 8.641 -2.818 -13.388 34 HH12 ARG 5 HH12 ARG 5 7.743 -4.277 -13.034 35 HH21 ARG 5 HH21 ARG 5 6.011 -2.908 -10.394 36 HH22 ARG 5 HH22 ARG 5 6.148 -4.232 -11.513 37 H THR 6 H THR 6 13.136 -0.023 -9.353 38 HA THR 6 HA THR 6 13.740 -0.855 -6.659 39 HB THR 6 HB THR 6 14.852 -2.677 -7.961 40 HG1 THR 6 HG1 THR 6 16.751 -2.503 -6.818 41 HG21 THR 6 HG21 THR 6 16.906 -2.264 -9.184 42 HG22 THR 6 HG22 THR 6 16.769 -0.512 -8.932 43 HG23 THR 6 HG23 THR 6 15.591 -1.367 -9.955 44 H ILE 7 H ILE 7 15.713 0.402 -5.847 45 HA ILE 7 HA ILE 7 15.700 3.142 -7.061 46 HB ILE 7 HB ILE 7 16.385 2.364 -4.229 47 HG12 ILE 7 HG12 ILE 7 13.993 2.124 -4.594 48 HG13 ILE 7 HG13 ILE 7 14.335 3.501 -3.562 49 HG21 ILE 7 HG21 ILE 7 16.250 5.097 -5.572 50 HG22 ILE 7 HG22 ILE 7 16.327 4.840 -3.817 51 HG23 ILE 7 HG23 ILE 7 17.666 4.319 -4.836 52 HD11 ILE 7 HD11 ILE 7 13.909 5.046 -5.469 53 HD12 ILE 7 HD12 ILE 7 13.558 3.644 -6.511 54 HD13 ILE 7 HD13 ILE 7 12.522 4.003 -5.124 55 H SER 8 H SER 8 17.376 3.815 -8.005 56 HA SER 8 HA SER 8 19.618 2.377 -8.640 57 HB2 SER 8 HB2 SER 8 18.905 4.317 -9.913 58 HB3 SER 8 HB3 SER 8 19.325 5.396 -8.579 59 HG SER 8 HG SER 8 21.037 3.882 -10.251 60 H SER 9 H SER 9 21.671 2.120 -8.070 61 HA SER 9 HA SER 9 22.901 3.644 -5.825 62 HB2 SER 9 HB2 SER 9 23.313 0.697 -6.408 63 HB3 SER 9 HB3 SER 9 24.078 1.638 -5.130 64 HG SER 9 HG SER 9 21.277 1.216 -5.365 65 H THR 10 H THR 10 22.933 4.280 -8.620 66 HA THR 10 HA THR 10 25.721 3.877 -9.454 67 HB THR 10 HB THR 10 24.886 3.321 -11.778 68 HG1 THR 10 HG1 THR 10 22.860 2.228 -11.802 69 HG21 THR 10 HG21 THR 10 25.917 1.597 -10.282 70 HG22 THR 10 HG22 THR 10 24.723 0.928 -11.407 71 HG23 THR 10 HG23 THR 10 24.291 1.171 -9.701 72 H ALA 11 H ALA 11 22.825 4.978 -11.161 73 HA ALA 11 HA ALA 11 23.855 7.537 -11.916 74 HB1 ALA 11 HB1 ALA 11 22.085 6.353 -13.150 75 HB2 ALA 11 HB2 ALA 11 20.973 6.538 -11.774 76 HB3 ALA 11 HB3 ALA 11 21.544 7.969 -12.661 77 H GLN 12 H GLN 12 21.540 6.616 -9.307 78 HA GLN 12 HA GLN 12 21.405 9.263 -8.143 79 HB2 GLN 12 HB2 GLN 12 19.676 7.595 -7.794 80 HB3 GLN 12 HB3 GLN 12 20.834 6.491 -7.058 81 HG2 GLN 12 HG2 GLN 12 19.352 7.568 -5.407 82 HG3 GLN 12 HG3 GLN 12 21.057 7.872 -5.106 83 HE21 GLN 12 HE21 GLN 12 20.420 9.664 -3.766 84 HE22 GLN 12 HE22 GLN 12 19.928 11.182 -4.503 85 H GLU 13 H GLU 13 23.677 6.557 -7.655 86 HA GLU 13 HA GLU 13 24.905 7.702 -5.310 87 HB2 GLU 13 HB2 GLU 13 24.848 5.360 -5.689 88 HB3 GLU 13 HB3 GLU 13 25.773 5.443 -7.162 89 HG2 GLU 13 HG2 GLU 13 26.869 6.455 -4.498 90 HG3 GLU 13 HG3 GLU 13 26.863 4.741 -4.885 91 H ARG 14 H ARG 14 26.156 7.584 -8.648 92 HA ARG 14 HA ARG 14 28.264 9.333 -8.303 93 HB2 ARG 14 HB2 ARG 14 28.286 9.991 -10.605 94 HB3 ARG 14 HB3 ARG 14 28.057 8.260 -10.456 95 HG2 ARG 14 HG2 ARG 14 25.970 8.294 -11.406 96 HG3 ARG 14 HG3 ARG 14 25.563 9.908 -10.840 97 HD2 ARG 14 HD2 ARG 14 27.624 9.434 -13.009 98 HD3 ARG 14 HD3 ARG 14 25.892 9.634 -13.328 99 HE ARG 14 HE ARG 14 26.841 11.817 -11.676 100 HH11 ARG 14 HH11 ARG 14 26.954 10.871 -15.109 101 HH12 ARG 14 HH12 ARG 14 27.065 12.588 -15.535 102 HH21 ARG 14 HH21 ARG 14 26.947 13.819 -12.422 103 HH22 ARG 14 HH22 ARG 14 27.069 14.078 -14.189 104 H VAL 15 H VAL 15 24.943 10.266 -8.860 105 HA VAL 15 HA VAL 15 25.202 13.098 -8.854 106 HB VAL 15 HB VAL 15 22.950 11.170 -8.375 107 HG11 VAL 15 HG11 VAL 15 21.362 13.052 -8.320 108 HG12 VAL 15 HG12 VAL 15 22.353 12.836 -6.876 109 HG13 VAL 15 HG13 VAL 15 22.729 14.158 -8.026 110 HG21 VAL 15 HG21 VAL 15 23.779 11.685 -10.691 111 HG22 VAL 15 HG22 VAL 15 22.107 12.202 -10.436 112 HG23 VAL 15 HG23 VAL 15 23.426 13.398 -10.400 113 H ASP 16 H ASP 16 25.244 10.843 -6.162 114 HA ASP 16 HA ASP 16 24.873 12.943 -4.146 115 HB2 ASP 16 HB2 ASP 16 24.396 10.518 -3.763 116 HB3 ASP 16 HB3 ASP 16 26.131 10.202 -3.817 117 H LEU 17 H LEU 17 27.772 11.403 -5.556 118 HA LEU 17 HA LEU 17 29.623 12.677 -3.831 119 HB2 LEU 17 HB2 LEU 17 29.914 11.099 -6.388 120 HB3 LEU 17 HB3 LEU 17 31.270 11.957 -5.670 121 HG LEU 17 HG LEU 17 30.645 10.782 -3.431 122 HD11 LEU 17 HD11 LEU 17 28.491 9.789 -4.073 123 HD12 LEU 17 HD12 LEU 17 29.666 8.526 -3.713 124 HD13 LEU 17 HD13 LEU 17 29.275 8.906 -5.402 125 HD21 LEU 17 HD21 LEU 17 32.027 8.861 -4.043 126 HD22 LEU 17 HD22 LEU 17 32.652 10.385 -4.697 127 HD23 LEU 17 HD23 LEU 17 31.800 9.245 -5.772 128 H GLU 18 H GLU 18 28.570 13.524 -7.053 129 HA GLU 18 HA GLU 18 30.163 15.915 -7.337 130 HB2 GLU 18 HB2 GLU 18 28.539 16.561 -9.099 131 HB3 GLU 18 HB3 GLU 18 29.266 14.971 -9.292 132 HG2 GLU 18 HG2 GLU 18 27.103 14.074 -8.114 133 HG3 GLU 18 HG3 GLU 18 26.421 15.616 -8.494 134 H ALA 19 H ALA 19 27.074 15.331 -5.565 135 HA ALA 19 HA ALA 19 26.657 18.151 -5.026 136 HB1 ALA 19 HB1 ALA 19 25.765 15.768 -3.365 137 HB2 ALA 19 HB2 ALA 19 25.006 17.363 -3.497 138 HB3 ALA 19 HB3 ALA 19 24.988 16.242 -4.888 139 H VAL 20 H VAL 20 28.552 15.589 -3.392 140 HA VAL 20 HA VAL 20 29.417 17.281 -1.172 141 HB VAL 20 HB VAL 20 30.653 14.740 -2.297 142 HG11 VAL 20 HG11 VAL 20 31.758 14.562 -0.072 143 HG12 VAL 20 HG12 VAL 20 32.350 15.944 -0.990 144 HG13 VAL 20 HG13 VAL 20 31.187 16.194 0.333 145 HG21 VAL 20 HG21 VAL 20 28.856 15.200 0.129 146 HG22 VAL 20 HG22 VAL 20 28.356 14.421 -1.386 147 HG23 VAL 20 HG23 VAL 20 29.573 13.652 -0.368 148 H ARG 21 H ARG 21 30.897 16.532 -4.342 149 HA ARG 21 HA ARG 21 33.105 18.240 -4.144 150 HB2 ARG 21 HB2 ARG 21 32.647 16.652 -6.006 151 HB3 ARG 21 HB3 ARG 21 31.396 17.724 -6.619 152 HG2 ARG 21 HG2 ARG 21 33.504 17.917 -7.867 153 HG3 ARG 21 HG3 ARG 21 32.982 19.443 -7.159 154 HD2 ARG 21 HD2 ARG 21 35.418 19.125 -6.992 155 HD3 ARG 21 HD3 ARG 21 34.664 19.275 -5.400 156 HE ARG 21 HE ARG 21 34.912 16.498 -6.225 157 HH11 ARG 21 HH11 ARG 21 36.892 19.096 -4.959 158 HH12 ARG 21 HH12 ARG 21 37.994 18.000 -4.172 159 HH21 ARG 21 HH21 ARG 21 36.350 15.151 -5.189 160 HH22 ARG 21 HH22 ARG 21 37.698 15.821 -4.320 161 H LEU 22 H LEU 22 29.771 19.236 -5.095 162 HA LEU 22 HA LEU 22 30.484 22.053 -5.200 163 HB2 LEU 22 HB2 LEU 22 27.887 20.579 -5.359 164 HB3 LEU 22 HB3 LEU 22 27.929 22.291 -4.864 165 HG LEU 22 HG LEU 22 29.367 22.777 -6.905 166 HD11 LEU 22 HD11 LEU 22 29.157 21.241 -8.829 167 HD12 LEU 22 HD12 LEU 22 28.384 20.032 -7.784 168 HD13 LEU 22 HD13 LEU 22 30.080 20.497 -7.516 169 HD21 LEU 22 HD21 LEU 22 27.025 23.322 -6.654 170 HD22 LEU 22 HD22 LEU 22 26.562 21.742 -7.338 171 HD23 LEU 22 HD23 LEU 22 27.438 22.943 -8.340 172 H ALA 23 H ALA 23 29.199 20.045 -2.462 173 HA ALA 23 HA ALA 23 29.009 22.252 -0.673 174 HB1 ALA 23 HB1 ALA 23 29.924 19.393 -0.164 175 HB2 ALA 23 HB2 ALA 23 29.460 20.565 1.088 176 HB3 ALA 23 HB3 ALA 23 28.259 20.022 -0.099 177 H SER 24 H SER 24 31.878 20.390 -1.666 178 HA SER 24 HA SER 24 33.801 21.948 -0.290 179 HB2 SER 24 HB2 SER 24 34.347 20.463 -2.878 180 HB3 SER 24 HB3 SER 24 35.468 20.879 -1.589 181 HG SER 24 HG SER 24 33.289 19.031 -1.438 182 H ILE 25 H ILE 25 32.552 22.457 -3.679 183 HA ILE 25 HA ILE 25 34.303 24.702 -4.049 184 HB ILE 25 HB ILE 25 31.698 24.600 -5.512 185 HG12 ILE 25 HG12 ILE 25 32.361 22.355 -5.882 186 HG13 ILE 25 HG13 ILE 25 32.784 23.259 -7.273 187 HG21 ILE 25 HG21 ILE 25 33.196 26.523 -5.816 188 HG22 ILE 25 HG22 ILE 25 34.554 25.459 -6.207 189 HG23 ILE 25 HG23 ILE 25 33.163 25.568 -7.288 190 HD11 ILE 25 HD11 ILE 25 34.735 22.283 -5.159 191 HD12 ILE 25 HD12 ILE 25 34.455 21.590 -6.757 192 HD13 ILE 25 HD13 ILE 25 35.172 23.212 -6.623 193 H VAL 26 H VAL 26 31.009 24.401 -2.706 194 HA VAL 26 HA VAL 26 30.454 27.189 -2.296 195 HB VAL 26 HB VAL 26 29.571 24.669 -0.899 196 HG11 VAL 26 HG11 VAL 26 27.638 26.077 -0.039 197 HG12 VAL 26 HG12 VAL 26 29.191 26.251 0.774 198 HG13 VAL 26 HG13 VAL 26 28.663 27.493 -0.368 199 HG21 VAL 26 HG21 VAL 26 28.060 26.500 -2.830 200 HG22 VAL 26 HG22 VAL 26 28.826 24.983 -3.329 201 HG23 VAL 26 HG23 VAL 26 27.512 24.941 -2.182 202 H ASP 27 H ASP 27 31.869 24.749 0.096 203 HA ASP 27 HA ASP 27 32.577 26.673 2.025 204 HB2 ASP 27 HB2 ASP 27 34.131 24.211 1.158 205 HB3 ASP 27 HB3 ASP 27 34.409 25.121 2.641 206 H SER 28 H SER 28 34.428 25.809 -0.871 207 HA SER 28 HA SER 28 36.641 27.536 -0.417 208 HB2 SER 28 HB2 SER 28 35.512 26.767 -3.141 209 HB3 SER 28 HB3 SER 28 37.140 27.348 -2.784 210 HG SER 28 HG SER 28 35.945 24.898 -1.934 211 H ARG 29 H ARG 29 33.451 28.264 -1.719 212 HA ARG 29 HA ARG 29 34.042 31.088 -2.266 213 HB2 ARG 29 HB2 ARG 29 32.432 29.676 -3.563 214 HB3 ARG 29 HB3 ARG 29 31.383 29.589 -2.162 215 HG2 ARG 29 HG2 ARG 29 30.520 31.209 -3.656 216 HG3 ARG 29 HG3 ARG 29 31.121 32.055 -2.222 217 HD2 ARG 29 HD2 ARG 29 33.094 32.797 -3.457 218 HD3 ARG 29 HD3 ARG 29 32.644 31.768 -4.837 219 HE ARG 29 HE ARG 29 30.570 33.702 -4.077 220 HH11 ARG 29 HH11 ARG 29 33.522 33.469 -5.947 221 HH12 ARG 29 HH12 ARG 29 33.020 34.690 -7.082 222 HH21 ARG 29 HH21 ARG 29 29.872 35.098 -5.725 223 HH22 ARG 29 HH22 ARG 29 31.039 35.631 -6.900 224 H LEU 30 H LEU 30 32.381 29.299 0.410 225 HA LEU 30 HA LEU 30 31.655 31.693 1.833 226 HB2 LEU 30 HB2 LEU 30 32.213 28.905 2.906 227 HB3 LEU 30 HB3 LEU 30 31.423 30.207 3.795 228 HG LEU 30 HG LEU 30 30.357 28.880 1.282 229 HD11 LEU 30 HD11 LEU 30 29.239 28.798 4.102 230 HD12 LEU 30 HD12 LEU 30 30.241 27.497 3.414 231 HD13 LEU 30 HD13 LEU 30 28.669 27.896 2.691 232 HD21 LEU 30 HD21 LEU 30 29.141 31.073 2.996 233 HD22 LEU 30 HD22 LEU 30 28.252 30.122 1.784 234 HD23 LEU 30 HD23 LEU 30 29.570 31.165 1.262 235 H ILE 31 H ILE 31 34.618 29.731 1.939 236 HA ILE 31 HA ILE 31 36.043 31.487 3.780 237 HB ILE 31 HB ILE 31 36.960 29.383 1.779 238 HG12 ILE 31 HG12 ILE 31 36.824 29.218 4.826 239 HG13 ILE 31 HG13 ILE 31 35.507 28.679 3.800 240 HG21 ILE 31 HG21 ILE 31 38.583 30.781 3.955 241 HG22 ILE 31 HG22 ILE 31 39.132 29.385 3.005 242 HG23 ILE 31 HG23 ILE 31 38.840 30.915 2.201 243 HD11 ILE 31 HD11 ILE 31 36.777 26.758 4.401 244 HD12 ILE 31 HD12 ILE 31 37.043 27.059 2.675 245 HD13 ILE 31 HD13 ILE 31 38.297 27.488 3.866 246 H GLY 32 H GLY 32 35.682 31.368 0.246 247 HA2 GLY 32 HA2 GLY 32 37.828 33.051 -0.485 248 HA3 GLY 32 HA3 GLY 32 36.420 32.586 -1.468 249 H THR 33 H THR 33 34.371 33.706 -0.001 250 HA THR 33 HA THR 33 34.907 36.575 0.273 251 HB THR 33 HB THR 33 34.613 36.294 -2.173 252 HG1 THR 33 HG1 THR 33 33.994 38.241 -1.363 253 HG21 THR 33 HG21 THR 33 32.950 34.377 -1.993 254 HG22 THR 33 HG22 THR 33 32.566 35.649 -3.173 255 HG23 THR 33 HG23 THR 33 31.707 35.597 -1.624 256 H GLY 34 H GLY 34 32.626 33.875 0.576 257 HA2 GLY 34 HA2 GLY 34 31.419 33.605 2.610 258 HA3 GLY 34 HA3 GLY 34 31.371 35.337 2.880 259 H SER 35 H SER 35 30.419 34.421 -0.330 260 HA SER 35 HA SER 35 27.721 33.597 0.268 261 HB2 SER 35 HB2 SER 35 28.279 36.311 -0.981 262 HB3 SER 35 HB3 SER 35 26.738 35.450 -1.186 263 HG SER 35 HG SER 35 27.746 35.677 1.406 264 H VAL 36 H VAL 36 26.702 32.597 -1.465 265 HA VAL 36 HA VAL 36 28.431 31.930 -3.847 266 HB VAL 36 HB VAL 36 26.210 30.387 -2.433 267 HG11 VAL 36 HG11 VAL 36 26.752 28.555 -4.039 268 HG12 VAL 36 HG12 VAL 36 25.979 29.947 -4.801 269 HG13 VAL 36 HG13 VAL 36 27.735 29.709 -4.968 270 HG21 VAL 36 HG21 VAL 36 29.113 29.584 -2.840 271 HG22 VAL 36 HG22 VAL 36 28.454 30.230 -1.312 272 HG23 VAL 36 HG23 VAL 36 27.847 28.706 -1.970 273 H ASP 37 H ASP 37 27.548 32.356 -5.885 274 HA ASP 37 HA ASP 37 24.765 33.333 -6.020 275 HB2 ASP 37 HB2 ASP 37 27.067 34.167 -7.794 276 HB3 ASP 37 HB3 ASP 37 25.489 34.921 -7.623 277 H GLU 38 H GLU 38 23.586 32.777 -7.941 278 HA GLU 38 HA GLU 38 23.878 30.283 -9.044 279 HB2 GLU 38 HB2 GLU 38 22.001 32.138 -9.276 280 HB3 GLU 38 HB3 GLU 38 22.836 32.538 -10.780 281 HG2 GLU 38 HG2 GLU 38 22.613 29.989 -11.325 282 HG3 GLU 38 HG3 GLU 38 21.491 29.940 -9.968 283 H ASP 39 H ASP 39 25.362 33.252 -10.375 284 HA ASP 39 HA ASP 39 26.527 32.108 -12.676 285 HB2 ASP 39 HB2 ASP 39 26.052 34.521 -12.244 286 HB3 ASP 39 HB3 ASP 39 27.303 34.536 -11.002 287 H PHE 40 H PHE 40 27.541 31.880 -9.314 288 HA PHE 40 HA PHE 40 30.292 31.081 -10.032 289 HB2 PHE 40 HB2 PHE 40 29.864 32.373 -7.989 290 HB3 PHE 40 HB3 PHE 40 28.775 31.124 -7.396 291 HD1 PHE 40 HD2 PHE 40 32.328 31.740 -8.409 292 HD2 PHE 40 HD1 PHE 40 29.590 29.266 -6.169 293 HE1 PHE 40 HE2 PHE 40 34.248 30.540 -7.386 294 HE2 PHE 40 HE1 PHE 40 31.505 28.060 -5.166 295 HZ PHE 40 HZ PHE 40 33.842 28.712 -5.754 296 H LEU 41 H LEU 41 27.163 29.498 -9.147 297 HA LEU 41 HA LEU 41 28.428 26.872 -8.935 298 HB2 LEU 41 HB2 LEU 41 25.573 27.883 -8.819 299 HB3 LEU 41 HB3 LEU 41 25.964 26.172 -8.688 300 HG LEU 41 HG LEU 41 26.739 28.387 -6.769 301 HD11 LEU 41 HD11 LEU 41 24.444 27.465 -6.620 302 HD12 LEU 41 HD12 LEU 41 25.415 27.021 -5.206 303 HD13 LEU 41 HD13 LEU 41 25.113 25.819 -6.472 304 HD21 LEU 41 HD21 LEU 41 27.685 25.483 -6.782 305 HD22 LEU 41 HD22 LEU 41 27.735 26.528 -5.351 306 HD23 LEU 41 HD23 LEU 41 28.692 26.947 -6.768 307 H ARG 42 H ARG 42 26.474 28.475 -11.460 308 HA ARG 42 HA ARG 42 26.092 26.231 -13.125 309 HB2 ARG 42 HB2 ARG 42 25.823 27.774 -14.962 310 HB3 ARG 42 HB3 ARG 42 25.084 28.412 -13.496 311 HG2 ARG 42 HG2 ARG 42 27.059 29.899 -13.149 312 HG3 ARG 42 HG3 ARG 42 27.819 29.223 -14.599 313 HD2 ARG 42 HD2 ARG 42 25.778 30.012 -15.922 314 HD3 ARG 42 HD3 ARG 42 25.293 30.897 -14.476 315 HE ARG 42 HE ARG 42 27.058 32.433 -14.797 316 HH11 ARG 42 HH11 ARG 42 27.522 29.878 -17.191 317 HH12 ARG 42 HH12 ARG 42 28.796 30.779 -17.962 318 HH21 ARG 42 HH21 ARG 42 28.561 33.421 -15.730 319 HH22 ARG 42 HH22 ARG 42 29.395 32.804 -17.163 320 H GLU 43 H GLU 43 29.108 27.962 -12.645 321 HA GLU 43 HA GLU 43 30.546 26.586 -14.751 322 HB2 GLU 43 HB2 GLU 43 31.677 28.042 -12.332 323 HB3 GLU 43 HB3 GLU 43 32.505 27.644 -13.848 324 HG2 GLU 43 HG2 GLU 43 30.565 28.999 -14.961 325 HG3 GLU 43 HG3 GLU 43 30.328 29.682 -13.354 326 H GLN 44 H GLN 44 29.402 25.260 -11.822 327 HA GLN 44 HA GLN 44 31.767 23.487 -11.485 328 HB2 GLN 44 HB2 GLN 44 29.519 23.840 -9.504 329 HB3 GLN 44 HB3 GLN 44 31.145 23.213 -9.242 330 HG2 GLN 44 HG2 GLN 44 30.297 26.077 -9.750 331 HG3 GLN 44 HG3 GLN 44 30.937 25.426 -8.258 332 HE21 GLN 44 HE21 GLN 44 31.891 27.728 -9.724 333 HE22 GLN 44 HE22 GLN 44 33.582 27.375 -10.102 334 H ILE 45 H ILE 45 28.136 23.300 -11.453 335 HA ILE 45 HA ILE 45 27.456 20.757 -11.515 336 HB ILE 45 HB ILE 45 26.208 21.353 -13.793 337 HG12 ILE 45 HG12 ILE 45 26.678 24.163 -12.884 338 HG13 ILE 45 HG13 ILE 45 27.461 23.401 -14.274 339 HG21 ILE 45 HG21 ILE 45 25.397 22.856 -11.280 340 HG22 ILE 45 HG22 ILE 45 24.332 22.142 -12.514 341 HG23 ILE 45 HG23 ILE 45 25.237 21.074 -11.439 342 HD11 ILE 45 HD11 ILE 45 25.581 24.626 -15.120 343 HD12 ILE 45 HD12 ILE 45 25.192 22.895 -15.232 344 HD13 ILE 45 HD13 ILE 45 24.478 23.895 -13.943 345 H ARG 46 H ARG 46 29.303 21.708 -13.708 346 HA ARG 46 HA ARG 46 29.540 21.679 -16.382 347 HB2 ARG 46 HB2 ARG 46 31.059 19.776 -14.582 348 HB3 ARG 46 HB3 ARG 46 31.544 20.094 -16.248 349 HG2 ARG 46 HG2 ARG 46 32.112 22.335 -15.856 350 HG3 ARG 46 HG3 ARG 46 31.155 22.442 -14.373 351 HD2 ARG 46 HD2 ARG 46 32.641 20.733 -13.333 352 HD3 ARG 46 HD3 ARG 46 33.688 20.828 -14.768 353 HE ARG 46 HE ARG 46 33.148 23.455 -13.626 354 HH11 ARG 46 HH11 ARG 46 35.284 20.707 -13.174 355 HH12 ARG 46 HH12 ARG 46 36.461 21.654 -12.305 356 HH21 ARG 46 HH22 ARG 46 34.601 24.562 -12.439 357 HH22 ARG 46 HH21 ARG 46 36.083 23.815 -11.914 358 H ASP 47 H ASP 47 27.553 19.535 -15.278 359 HA ASP 47 HA ASP 47 27.122 17.867 -17.643 360 HB2 ASP 47 HB2 ASP 47 29.187 16.781 -16.739 361 HB3 ASP 47 HB3 ASP 47 28.376 16.540 -15.194 362 H ALA 48 H ALA 48 26.523 18.416 -14.192 363 HA ALA 48 HA ALA 48 24.008 16.915 -14.122 364 HB1 ALA 48 HB1 ALA 48 25.267 18.851 -12.134 365 HB2 ALA 48 HB2 ALA 48 23.818 17.859 -11.841 366 HB3 ALA 48 HB3 ALA 48 25.387 17.086 -12.087 367 H ARG 49 H ARG 49 21.970 17.806 -14.211 368 HA ARG 49 HA ARG 49 21.607 20.110 -15.838 369 HB2 ARG 49 HB2 ARG 49 19.965 17.969 -14.774 370 HB3 ARG 49 HB3 ARG 49 19.147 19.462 -14.453 371 HG2 ARG 49 HG2 ARG 49 18.458 18.487 -16.586 372 HG3 ARG 49 HG3 ARG 49 19.146 20.097 -16.775 373 HD2 ARG 49 HD2 ARG 49 19.790 18.425 -18.540 374 HD3 ARG 49 HD3 ARG 49 21.150 19.239 -17.771 375 HE ARG 49 HE ARG 49 21.093 16.997 -16.264 376 HH11 ARG 49 HH21 ARG 49 21.050 17.271 -19.768 377 HH12 ARG 49 HH22 ARG 49 21.866 15.744 -19.959 378 HH21 ARG 49 HH11 ARG 49 22.077 15.163 -16.542 379 HH22 ARG 49 HH12 ARG 49 22.450 14.557 -18.147 380 H TYR 50 H TYR 50 20.538 19.813 -12.349 381 HA TYR 50 HA TYR 50 20.711 22.807 -12.250 382 HB2 TYR 50 HB2 TYR 50 18.711 21.106 -10.774 383 HB3 TYR 50 HB3 TYR 50 18.594 22.798 -11.187 384 HD1 TYR 50 HD1 TYR 50 18.958 22.946 -14.055 385 HD2 TYR 50 HD2 TYR 50 16.973 19.904 -11.753 386 HE1 TYR 50 HE1 TYR 50 17.529 22.418 -16.015 387 HE2 TYR 50 HE2 TYR 50 15.555 19.345 -13.732 388 HH TYR 50 HH TYR 50 15.871 21.069 -16.841 389 H ALA 51 H ALA 51 21.903 23.663 -10.550 390 HA ALA 51 HA ALA 51 22.446 21.917 -8.176 391 HB1 ALA 51 HB1 ALA 51 24.305 23.511 -7.703 392 HB2 ALA 51 HB2 ALA 51 24.518 22.565 -9.181 393 HB3 ALA 51 HB3 ALA 51 24.016 24.274 -9.283 394 H VAL 52 H VAL 52 21.931 22.708 -6.126 395 HA VAL 52 HA VAL 52 20.202 25.148 -5.959 396 HB VAL 52 HB VAL 52 19.499 22.246 -5.440 397 HG11 VAL 52 HG11 VAL 52 17.983 24.655 -4.388 398 HG12 VAL 52 HG12 VAL 52 17.373 22.992 -4.409 399 HG13 VAL 52 HG13 VAL 52 18.762 23.392 -3.401 400 HG21 VAL 52 HG21 VAL 52 18.123 24.459 -6.999 401 HG22 VAL 52 HG22 VAL 52 18.952 23.037 -7.665 402 HG23 VAL 52 HG23 VAL 52 17.470 22.831 -6.740 403 H ILE 53 H ILE 53 20.276 26.219 -4.044 404 HA ILE 53 HA ILE 53 22.088 25.134 -1.949 405 HB ILE 53 HB ILE 53 22.232 27.466 -3.716 406 HG12 ILE 53 HG12 ILE 53 23.991 25.836 -3.599 407 HG13 ILE 53 HG13 ILE 53 24.571 27.435 -3.131 408 HG21 ILE 53 HG21 ILE 53 23.198 29.111 -2.171 409 HG22 ILE 53 HG22 ILE 53 21.480 28.862 -1.873 410 HG23 ILE 53 HG23 ILE 53 22.670 28.155 -0.777 411 HD11 ILE 53 HD11 ILE 53 24.194 26.635 -0.678 412 HD12 ILE 53 HD12 ILE 53 24.122 25.013 -1.371 413 HD13 ILE 53 HD13 ILE 53 25.580 25.998 -1.576 414 H ARG 54 H ARG 54 21.666 25.311 0.092 415 HA ARG 54 HA ARG 54 19.797 27.412 1.133 416 HB2 ARG 54 HB2 ARG 54 19.828 24.451 1.909 417 HB3 ARG 54 HB3 ARG 54 19.078 25.731 2.852 418 HG2 ARG 54 HG2 ARG 54 17.243 25.009 1.750 419 HG3 ARG 54 HG3 ARG 54 17.755 26.265 0.627 420 HD2 ARG 54 HD2 ARG 54 18.869 24.449 -0.767 421 HD3 ARG 54 HD3 ARG 54 18.313 23.268 0.409 422 HE ARG 54 HE ARG 54 16.183 23.353 -0.462 423 HH11 ARG 54 HH12 ARG 54 17.824 26.218 -1.817 424 HH12 ARG 54 HH11 ARG 54 16.580 26.296 -3.082 425 HH21 ARG 54 HH21 ARG 54 14.694 23.744 -2.146 426 HH22 ARG 54 HH22 ARG 54 15.045 25.079 -3.248 427 H ILE 55 H ILE 55 21.585 28.694 1.686 428 HA ILE 55 HA ILE 55 23.401 27.628 3.812 429 HB ILE 55 HB ILE 55 23.783 29.989 1.958 430 HG12 ILE 55 HG12 ILE 55 25.793 27.773 2.259 431 HG13 ILE 55 HG13 ILE 55 24.344 27.423 1.326 432 HG21 ILE 55 HG21 ILE 55 25.385 29.060 4.393 433 HG22 ILE 55 HG22 ILE 55 26.055 30.126 3.156 434 HG23 ILE 55 HG23 ILE 55 24.660 30.661 4.104 435 HD11 ILE 55 HD11 ILE 55 26.283 29.705 0.805 436 HD12 ILE 55 HD12 ILE 55 26.187 28.179 -0.090 437 HD13 ILE 55 HD13 ILE 55 24.839 29.335 -0.161 438 HA PRO 56 HA PRO 56 20.797 30.150 6.499 439 HB2 PRO 56 HB2 PRO 56 23.158 29.837 8.337 440 HB3 PRO 56 HB3 PRO 56 21.414 29.669 8.702 441 HG2 PRO 56 HG2 PRO 56 22.950 27.457 8.361 442 HG3 PRO 56 HG3 PRO 56 21.310 27.536 7.638 443 HD2 PRO 56 HD2 PRO 56 23.979 27.975 6.281 444 HD3 PRO 56 HD3 PRO 56 22.538 27.076 5.716 445 H GLY 57 H GLY 57 20.617 32.282 6.621 446 HA2 GLY 57 HA2 GLY 57 21.139 34.502 7.082 447 HA3 GLY 57 HA3 GLY 57 22.850 34.096 7.187 448 H GLN 58 H GLN 58 21.821 32.893 4.209 449 HA GLN 58 HA GLN 58 21.977 35.509 2.798 450 HB2 GLN 58 HB2 GLN 58 23.723 34.861 1.368 451 HB3 GLN 58 HB3 GLN 58 24.215 34.318 2.965 452 HG2 GLN 58 HG2 GLN 58 23.456 32.043 2.406 453 HG3 GLN 58 HG3 GLN 58 23.077 32.553 0.749 454 HE21 GLN 58 HE21 GLN 58 25.839 32.808 3.112 455 HE22 GLN 58 HE22 GLN 58 27.063 32.450 1.916 456 HA PRO 59 HA PRO 59 18.578 34.076 0.507 457 HB2 PRO 59 HB2 PRO 59 18.884 35.066 -2.040 458 HB3 PRO 59 HB3 PRO 59 18.517 36.075 -0.607 459 HG2 PRO 59 HG2 PRO 59 21.231 35.535 -1.854 460 HG3 PRO 59 HG3 PRO 59 20.521 37.117 -1.388 461 HD2 PRO 59 HD2 PRO 59 22.245 35.826 0.230 462 HD3 PRO 59 HD3 PRO 59 20.831 36.675 0.919 463 H VAL 60 H VAL 60 17.856 32.323 -0.504 464 HA VAL 60 HA VAL 60 19.339 30.132 -1.422 465 HB VAL 60 HB VAL 60 17.087 29.833 -0.809 466 HG11 VAL 60 HG11 VAL 60 16.203 31.732 -3.025 467 HG12 VAL 60 HG12 VAL 60 15.128 30.726 -2.036 468 HG13 VAL 60 HG13 VAL 60 16.061 32.011 -1.275 469 HG21 VAL 60 HG21 VAL 60 16.978 29.511 -3.824 470 HG22 VAL 60 HG22 VAL 60 17.883 28.419 -2.753 471 HG23 VAL 60 HG23 VAL 60 16.120 28.576 -2.590 472 H VAL 61 H VAL 61 20.189 29.433 -3.196 473 HA VAL 61 HA VAL 61 19.943 30.922 -5.785 474 HB VAL 61 HB VAL 61 22.356 29.543 -4.547 475 HG11 VAL 61 HG11 VAL 61 22.034 30.549 -7.394 476 HG12 VAL 61 HG12 VAL 61 23.572 30.058 -6.627 477 HG13 VAL 61 HG13 VAL 61 22.311 28.861 -6.897 478 HG21 VAL 61 HG21 VAL 61 23.434 31.710 -4.908 479 HG22 VAL 61 HG22 VAL 61 21.927 32.377 -5.575 480 HG23 VAL 61 HG23 VAL 61 22.020 31.883 -3.868 481 H GLU 62 H GLU 62 19.273 29.713 -7.513 482 HA GLU 62 HA GLU 62 19.476 26.768 -7.432 483 HB2 GLU 62 HB2 GLU 62 16.836 28.203 -7.954 484 HB3 GLU 62 HB3 GLU 62 17.155 26.465 -8.127 485 HG2 GLU 62 HG2 GLU 62 17.815 26.447 -5.675 486 HG3 GLU 62 HG3 GLU 62 17.237 28.106 -5.565 487 H VAL 63 H VAL 63 20.485 26.207 -9.234 488 HA VAL 63 HA VAL 63 20.835 28.133 -11.424 489 HB VAL 63 HB VAL 63 22.217 25.490 -10.882 490 HG11 VAL 63 HG11 VAL 63 23.068 27.925 -12.478 491 HG12 VAL 63 HG12 VAL 63 24.139 26.577 -12.043 492 HG13 VAL 63 HG13 VAL 63 22.763 26.277 -13.101 493 HG21 VAL 63 HG21 VAL 63 23.996 26.627 -9.773 494 HG22 VAL 63 HG22 VAL 63 23.196 28.201 -9.932 495 HG23 VAL 63 HG23 VAL 63 22.529 26.941 -8.869 496 H GLY 64 H GLY 64 20.785 27.439 -13.712 497 HA2 GLY 64 HA2 GLY 64 20.086 26.245 -15.512 498 HA3 GLY 64 HA3 GLY 64 19.851 24.856 -14.466 499 H THR 65 H THR 65 17.717 24.419 -13.648 500 HA THR 65 HA THR 65 15.494 26.230 -14.149 501 HB THR 65 HB THR 65 15.435 23.578 -15.659 502 HG1 THR 65 HG1 THR 65 16.459 25.971 -16.329 503 HG21 THR 65 HG21 THR 65 13.482 24.635 -16.829 504 HG22 THR 65 HG22 THR 65 13.527 25.955 -15.641 505 HG23 THR 65 HG23 THR 65 13.175 24.282 -15.133 506 H LYS 66 H LYS 66 13.571 25.534 -13.017 507 HA LYS 66 HA LYS 66 14.028 23.845 -10.764 508 HB2 LYS 66 HB2 LYS 66 12.512 25.788 -10.738 509 HB3 LYS 66 HB3 LYS 66 11.423 24.978 -11.876 510 HG2 LYS 66 HG2 LYS 66 11.015 23.184 -10.188 511 HG3 LYS 66 HG3 LYS 66 12.105 24.014 -9.059 512 HD2 LYS 66 HD2 LYS 66 10.613 25.991 -9.065 513 HD3 LYS 66 HD3 LYS 66 9.543 25.188 -10.238 514 HE2 LYS 66 HE2 LYS 66 9.148 23.348 -8.604 515 HE3 LYS 66 HE3 LYS 66 10.189 24.169 -7.431 516 HZ1 LYS 66 HZ1 LYS 66 8.618 26.041 -7.450 517 HZ2 LYS 66 HZ2 LYS 66 7.843 24.665 -7.034 518 HZ3 LYS 66 HZ3 LYS 66 7.657 25.280 -8.534 519 HA PRO 67 HA PRO 67 13.028 19.998 -12.866 520 HB2 PRO 67 HB2 PRO 67 13.331 18.258 -10.796 521 HB3 PRO 67 HB3 PRO 67 14.709 19.092 -11.587 522 HG2 PRO 67 HG2 PRO 67 13.311 19.820 -9.009 523 HG3 PRO 67 HG3 PRO 67 15.070 19.751 -9.387 524 HD2 PRO 67 HD2 PRO 67 13.617 22.088 -9.439 525 HD3 PRO 67 HD3 PRO 67 15.037 21.785 -10.490 526 H THR 68 H THR 68 11.487 18.463 -13.026 527 HA THR 68 HA THR 68 8.901 19.200 -12.152 528 HB THR 68 HB THR 68 9.482 18.470 -14.421 529 HG1 THR 68 HG1 THR 68 7.351 18.444 -13.912 530 HG21 THR 68 HG21 THR 68 9.375 15.608 -13.398 531 HG22 THR 68 HG22 THR 68 10.890 16.452 -13.812 532 HG23 THR 68 HG23 THR 68 9.660 16.166 -15.053 533 H GLY 69 H GLY 69 10.898 16.550 -11.068 534 HA2 GLY 69 HA2 GLY 69 10.146 15.756 -8.697 535 HA3 GLY 69 HA3 GLY 69 8.652 15.299 -9.532 536 H ASP 70 H ASP 70 9.809 14.440 -11.944 537 HA ASP 70 HA ASP 70 10.996 11.829 -11.290 538 HB2 ASP 70 HB2 ASP 70 10.265 13.064 -13.957 539 HB3 ASP 70 HB3 ASP 70 10.930 11.439 -13.743 540 H VAL 71 H VAL 71 12.710 13.156 -10.167 541 HA VAL 71 HA VAL 71 15.081 13.373 -11.892 542 HB VAL 71 HB VAL 71 15.817 15.415 -10.758 543 HG11 VAL 71 HG11 VAL 71 14.710 16.907 -12.139 544 HG12 VAL 71 HG12 VAL 71 14.440 15.391 -12.963 545 HG13 VAL 71 HG13 VAL 71 13.129 16.120 -12.007 546 HG21 VAL 71 HG21 VAL 71 14.375 16.797 -9.427 547 HG22 VAL 71 HG22 VAL 71 13.024 15.652 -9.588 548 HG23 VAL 71 HG23 VAL 71 14.479 15.215 -8.671 549 H LEU 72 H LEU 72 17.053 13.302 -10.838 550 HA LEU 72 HA LEU 72 17.238 11.464 -8.504 551 HB2 LEU 72 HB2 LEU 72 19.182 12.495 -10.625 552 HB3 LEU 72 HB3 LEU 72 19.676 11.424 -9.316 553 HG LEU 72 HG LEU 72 17.413 10.697 -11.166 554 HD11 LEU 72 HD11 LEU 72 19.298 11.175 -12.650 555 HD12 LEU 72 HD12 LEU 72 19.032 9.428 -12.563 556 HD13 LEU 72 HD13 LEU 72 20.376 10.168 -11.655 557 HD21 LEU 72 HD21 LEU 72 17.848 9.391 -9.052 558 HD22 LEU 72 HD22 LEU 72 19.477 9.044 -9.665 559 HD23 LEU 72 HD23 LEU 72 18.055 8.404 -10.524 560 H GLN 73 H GLN 73 17.762 12.346 -6.444 561 HA GLN 73 HA GLN 73 18.765 15.143 -6.419 562 HB2 GLN 73 HB2 GLN 73 17.101 13.452 -4.533 563 HB3 GLN 73 HB3 GLN 73 17.769 15.033 -4.132 564 HG2 GLN 73 HG2 GLN 73 16.588 15.960 -6.186 565 HG3 GLN 73 HG3 GLN 73 15.742 14.420 -6.323 566 HE21 GLN 73 HE21 GLN 73 14.876 17.317 -5.613 567 HE22 GLN 73 HE22 GLN 73 13.969 17.096 -4.111 568 H GLY 74 H GLY 74 20.869 15.313 -6.075 569 HA2 GLY 74 HA2 GLY 74 22.363 13.472 -4.243 570 HA3 GLY 74 HA3 GLY 74 23.068 14.659 -5.357 571 H ARG 75 H ARG 75 23.482 14.510 -2.393 572 HA ARG 75 HA ARG 75 22.579 17.197 -1.626 573 HB2 ARG 75 HB2 ARG 75 20.584 15.705 -1.208 574 HB3 ARG 75 HB3 ARG 75 21.552 14.813 -0.033 575 HG2 ARG 75 HG2 ARG 75 21.841 16.918 1.294 576 HG3 ARG 75 HG3 ARG 75 20.872 17.795 0.094 577 HD2 ARG 75 HD2 ARG 75 18.937 16.353 0.571 578 HD3 ARG 75 HD3 ARG 75 19.877 15.405 1.720 579 HE ARG 75 HE ARG 75 18.670 18.041 2.118 580 HH11 ARG 75 HH12 ARG 75 21.108 15.876 3.432 581 HH12 ARG 75 HH11 ARG 75 21.069 16.642 4.995 582 HH21 ARG 75 HH21 ARG 75 18.655 18.941 4.152 583 HH22 ARG 75 HH22 ARG 75 19.727 18.341 5.379 584 H ALA 76 H ALA 76 23.957 18.119 -0.367 585 HA ALA 76 HA ALA 76 25.779 16.556 1.447 586 HB1 ALA 76 HB1 ALA 76 27.722 17.689 0.408 587 HB2 ALA 76 HB2 ALA 76 26.827 16.710 -0.766 588 HB3 ALA 76 HB3 ALA 76 26.626 18.476 -0.760 589 H THR 77 H THR 77 27.286 18.015 2.698 590 HA THR 77 HA THR 77 26.011 20.553 3.628 591 HB THR 77 HB THR 77 26.769 18.149 5.332 592 HG1 THR 77 HG1 THR 77 24.627 18.351 5.997 593 HG21 THR 77 HG21 THR 77 26.086 20.975 6.237 594 HG22 THR 77 HG22 THR 77 27.566 20.061 6.573 595 HG23 THR 77 HG23 THR 77 26.040 19.546 7.290 596 H GLY 78 H GLY 78 27.582 22.056 3.340 597 HA2 GLY 78 HA2 GLY 78 30.382 21.487 3.253 598 HA3 GLY 78 HA3 GLY 78 29.596 23.064 3.289 599 H GLU 79 H GLU 79 31.849 22.894 4.512 600 HA GLU 79 HA GLU 79 32.179 22.174 7.172 601 HB2 GLU 79 HB2 GLU 79 33.884 22.989 5.495 602 HB3 GLU 79 HB3 GLU 79 33.198 24.609 5.636 603 HG2 GLU 79 HG2 GLU 79 35.125 24.547 6.959 604 HG3 GLU 79 HG3 GLU 79 33.749 24.560 8.070 605 H GLU 80 H GLU 80 31.022 25.577 5.978 606 HA GLU 80 HA GLU 80 30.454 26.348 8.475 607 HB2 GLU 80 HB2 GLU 80 29.152 27.212 5.875 608 HB3 GLU 80 HB3 GLU 80 29.361 28.204 7.317 609 HG2 GLU 80 HG2 GLU 80 31.585 27.202 5.463 610 HG3 GLU 80 HG3 GLU 80 30.931 28.792 5.675 611 H GLY 81 H GLY 81 28.667 23.914 7.348 612 HA2 GLY 81 HA2 GLY 81 26.931 22.908 8.345 613 HA3 GLY 81 HA3 GLY 81 26.544 24.392 9.231 614 H GLU 82 H GLU 82 26.840 24.424 5.723 615 HA GLU 82 HA GLU 82 24.070 25.251 5.410 616 HB2 GLU 82 HB2 GLU 82 24.846 26.008 3.266 617 HB3 GLU 82 HB3 GLU 82 25.951 26.540 4.523 618 HG2 GLU 82 HG2 GLU 82 27.369 25.918 2.789 619 HG3 GLU 82 HG3 GLU 82 27.458 24.549 3.889 620 H THR 83 H THR 83 23.556 24.449 2.747 621 HA THR 83 HA THR 83 23.815 21.563 2.644 622 HB THR 83 HB THR 83 21.072 22.831 2.894 623 HG1 THR 83 HG1 THR 83 22.766 21.794 4.565 624 HG21 THR 83 HG21 THR 83 20.226 20.513 2.626 625 HG22 THR 83 HG22 THR 83 21.870 19.979 2.180 626 HG23 THR 83 HG23 THR 83 20.975 21.120 1.143 627 H VAL 84 H VAL 84 24.338 21.072 0.736 628 HA VAL 84 HA VAL 84 23.517 22.627 -1.681 629 HB VAL 84 HB VAL 84 25.739 20.623 -1.140 630 HG11 VAL 84 HG11 VAL 84 24.910 21.695 -3.879 631 HG12 VAL 84 HG12 VAL 84 26.416 20.826 -3.503 632 HG13 VAL 84 HG13 VAL 84 24.885 19.987 -3.359 633 HG21 VAL 84 HG21 VAL 84 25.700 23.459 -2.242 634 HG22 VAL 84 HG22 VAL 84 26.178 22.981 -0.600 635 HG23 VAL 84 HG23 VAL 84 27.150 22.471 -1.986 636 H LEU 85 H LEU 85 22.359 21.717 -3.278 637 HA LEU 85 HA LEU 85 21.695 18.844 -3.166 638 HB2 LEU 85 HB2 LEU 85 19.809 20.157 -2.181 639 HB3 LEU 85 HB3 LEU 85 19.718 21.085 -3.656 640 HG LEU 85 HG LEU 85 19.318 18.723 -4.812 641 HD11 LEU 85 HD11 LEU 85 18.245 18.137 -2.021 642 HD12 LEU 85 HD12 LEU 85 19.780 17.489 -2.599 643 HD13 LEU 85 HD13 LEU 85 18.283 17.072 -3.450 644 HD21 LEU 85 HD21 LEU 85 17.229 20.077 -3.067 645 HD22 LEU 85 HD22 LEU 85 16.897 18.914 -4.372 646 HD23 LEU 85 HD23 LEU 85 17.642 20.476 -4.750 647 H VAL 86 H VAL 86 21.543 17.938 -5.130 648 HA VAL 86 HA VAL 86 21.966 19.566 -7.627 649 HB VAL 86 HB VAL 86 23.311 16.854 -7.335 650 HG11 VAL 86 HG11 VAL 86 24.516 17.569 -9.343 651 HG12 VAL 86 HG12 VAL 86 22.776 17.448 -9.619 652 HG13 VAL 86 HG13 VAL 86 23.534 19.051 -9.411 653 HG21 VAL 86 HG21 VAL 86 24.423 18.433 -5.793 654 HG22 VAL 86 HG22 VAL 86 25.446 18.079 -7.192 655 HG23 VAL 86 HG23 VAL 86 24.566 19.627 -7.104 656 H GLU 87 H GLU 87 20.706 18.932 -9.398 657 HA GLU 87 HA GLU 87 18.915 16.631 -8.945 658 HB2 GLU 87 HB2 GLU 87 17.862 19.385 -9.593 659 HB3 GLU 87 HB3 GLU 87 16.938 17.880 -9.478 660 HG2 GLU 87 HG2 GLU 87 17.832 17.669 -7.079 661 HG3 GLU 87 HG3 GLU 87 18.431 19.317 -7.237 662 H GLU 88 H GLU 88 18.750 15.426 -10.532 663 HA GLU 88 HA GLU 88 19.610 16.185 -13.316 664 HB2 GLU 88 HB2 GLU 88 20.482 14.134 -11.360 665 HB3 GLU 88 HB3 GLU 88 20.226 13.498 -12.986 666 HG2 GLU 88 HG2 GLU 88 22.079 15.786 -12.274 667 HG3 GLU 88 HG3 GLU 88 22.541 14.083 -12.429 668 HA PRO 89 HA PRO 89 15.708 14.326 -14.546 669 HB2 PRO 89 HB2 PRO 89 16.184 13.521 -17.127 670 HB3 PRO 89 HB3 PRO 89 15.952 15.228 -16.637 671 HG2 PRO 89 HG2 PRO 89 18.574 13.753 -17.052 672 HG3 PRO 89 HG3 PRO 89 18.095 15.363 -17.684 673 HD2 PRO 89 HD2 PRO 89 19.598 15.067 -15.454 674 HD3 PRO 89 HD3 PRO 89 18.366 16.365 -15.557 675 H ARG 90 H ARG 90 14.810 12.424 -14.175 676 HA ARG 90 HA ARG 90 16.434 10.024 -13.689 677 HB2 ARG 90 HB2 ARG 90 14.645 10.773 -12.133 678 HB3 ARG 90 HB3 ARG 90 13.437 10.436 -13.382 679 HG2 ARG 90 HG2 ARG 90 14.141 8.030 -13.379 680 HG3 ARG 90 HG3 ARG 90 15.305 8.411 -12.097 681 HD2 ARG 90 HD2 ARG 90 13.375 7.540 -10.989 682 HD3 ARG 90 HD3 ARG 90 13.395 9.283 -10.715 683 HE ARG 90 HE ARG 90 11.379 9.477 -11.805 684 HH11 ARG 90 HH21 ARG 90 12.618 6.316 -12.688 685 HH12 ARG 90 HH22 ARG 90 11.140 5.880 -13.500 686 HH21 ARG 90 HH11 ARG 90 9.557 8.882 -12.855 687 HH22 ARG 90 HH12 ARG 90 9.449 7.294 -13.583 Start of MODEL 20 1 H1 GLY 1 H1 GLY 1 9.169 -3.084 9.044 2 H2 GLY 1 H2 GLY 1 8.900 -3.396 7.458 3 H3 GLY 1 H3 GLY 1 9.308 -1.882 7.939 4 HA2 GLY 1 HA2 GLY 1 11.493 -2.621 8.645 5 HA3 GLY 1 HA3 GLY 1 11.049 -4.259 8.126 6 H SER 2 H SER 2 13.059 -4.008 6.842 7 HA SER 2 HA SER 2 13.028 -2.329 4.438 8 HB2 SER 2 HB2 SER 2 15.141 -3.509 3.935 9 HB3 SER 2 HB3 SER 2 15.127 -2.773 5.544 10 HG SER 2 HG SER 2 15.952 -4.909 5.577 11 H GLU 3 H GLU 3 13.529 -3.500 2.239 12 HA GLU 3 HA GLU 3 12.130 -6.029 1.855 13 HB2 GLU 3 HB2 GLU 3 10.300 -4.341 1.819 14 HB3 GLU 3 HB3 GLU 3 11.121 -3.482 0.511 15 HG2 GLU 3 HG2 GLU 3 10.836 -5.400 -0.982 16 HG3 GLU 3 HG3 GLU 3 10.226 -6.393 0.346 17 H THR 4 H THR 4 12.796 -7.068 0.060 18 HA THR 4 HA THR 4 15.191 -6.105 -1.332 19 HB THR 4 HB THR 4 15.020 -8.319 -2.580 20 HG1 THR 4 HG1 THR 4 13.733 -9.859 -1.549 21 HG21 THR 4 HG21 THR 4 16.525 -7.938 -0.658 22 HG22 THR 4 HG22 THR 4 15.872 -9.582 -0.647 23 HG23 THR 4 HG23 THR 4 15.214 -8.359 0.466 24 H ARG 5 H ARG 5 15.275 -4.950 -2.998 25 HA ARG 5 HA ARG 5 13.649 -5.277 -5.392 26 HB2 ARG 5 HB2 ARG 5 12.542 -3.206 -5.522 27 HB3 ARG 5 HB3 ARG 5 12.129 -3.860 -3.956 28 HG2 ARG 5 HG2 ARG 5 14.162 -1.643 -4.472 29 HG3 ARG 5 HG3 ARG 5 12.495 -1.422 -3.960 30 HD2 ARG 5 HD2 ARG 5 12.977 -2.624 -1.851 31 HD3 ARG 5 HD3 ARG 5 14.673 -2.808 -2.360 32 HE ARG 5 HE ARG 5 13.878 -0.048 -2.477 33 HH11 ARG 5 HH12 ARG 5 14.709 -2.475 -0.090 34 HH12 ARG 5 HH11 ARG 5 15.427 -1.296 0.990 35 HH21 ARG 5 HH21 ARG 5 14.726 1.411 -1.023 36 HH22 ARG 5 HH22 ARG 5 15.370 0.860 0.492 37 H THR 6 H THR 6 14.284 -3.725 -7.188 38 HA THR 6 HA THR 6 17.150 -3.344 -7.361 39 HB THR 6 HB THR 6 14.937 -2.203 -9.119 40 HG1 THR 6 HG1 THR 6 16.343 -4.641 -9.416 41 HG21 THR 6 HG21 THR 6 16.654 -2.395 -10.925 42 HG22 THR 6 HG22 THR 6 17.872 -2.817 -9.699 43 HG23 THR 6 HG23 THR 6 17.093 -1.217 -9.689 44 H ILE 7 H ILE 7 18.302 -1.304 -7.457 45 HA ILE 7 HA ILE 7 16.963 1.104 -6.442 46 HB ILE 7 HB ILE 7 19.424 -0.055 -5.097 47 HG12 ILE 7 HG12 ILE 7 16.609 0.351 -3.959 48 HG13 ILE 7 HG13 ILE 7 17.275 -1.207 -4.449 49 HG21 ILE 7 HG21 ILE 7 19.476 2.436 -5.216 50 HG22 ILE 7 HG22 ILE 7 17.842 2.505 -4.513 51 HG23 ILE 7 HG23 ILE 7 19.225 1.905 -3.576 52 HD11 ILE 7 HD11 ILE 7 19.116 -0.951 -2.825 53 HD12 ILE 7 HD12 ILE 7 18.274 0.483 -2.165 54 HD13 ILE 7 HD13 ILE 7 17.492 -1.108 -2.119 55 H SER 8 H SER 8 18.024 2.981 -7.187 56 HA SER 8 HA SER 8 19.513 2.557 -9.646 57 HB2 SER 8 HB2 SER 8 19.057 5.044 -9.956 58 HB3 SER 8 HB3 SER 8 17.654 3.980 -9.810 59 HG SER 8 HG SER 8 17.409 5.809 -8.496 60 H SER 9 H SER 9 21.015 2.069 -7.300 61 HA SER 9 HA SER 9 22.849 3.880 -6.492 62 HB2 SER 9 HB2 SER 9 23.465 0.934 -6.742 63 HB3 SER 9 HB3 SER 9 24.005 2.065 -5.490 64 HG SER 9 HG SER 9 22.292 0.798 -4.738 65 H THR 10 H THR 10 22.934 4.127 -9.368 66 HA THR 10 HA THR 10 25.860 4.240 -9.729 67 HB THR 10 HB THR 10 25.525 3.899 -12.178 68 HG1 THR 10 HG1 THR 10 23.676 2.652 -12.760 69 HG21 THR 10 HG21 THR 10 25.552 1.456 -12.112 70 HG22 THR 10 HG22 THR 10 24.820 1.462 -10.488 71 HG23 THR 10 HG23 THR 10 26.458 2.107 -10.735 72 H ALA 11 H ALA 11 22.918 5.179 -11.446 73 HA ALA 11 HA ALA 11 23.705 7.858 -11.998 74 HB1 ALA 11 HB1 ALA 11 20.919 6.610 -11.966 75 HB2 ALA 11 HB2 ALA 11 21.369 8.137 -12.757 76 HB3 ALA 11 HB3 ALA 11 22.057 6.607 -13.332 77 H GLN 12 H GLN 12 21.513 6.586 -9.425 78 HA GLN 12 HA GLN 12 21.210 9.233 -8.187 79 HB2 GLN 12 HB2 GLN 12 19.422 7.572 -8.170 80 HB3 GLN 12 HB3 GLN 12 20.432 6.440 -7.289 81 HG2 GLN 12 HG2 GLN 12 18.738 7.454 -5.868 82 HG3 GLN 12 HG3 GLN 12 20.366 7.764 -5.294 83 HE21 GLN 12 HE21 GLN 12 21.215 9.946 -5.451 84 HE22 GLN 12 HE22 GLN 12 20.040 11.257 -5.361 85 H GLU 13 H GLU 13 23.475 6.495 -7.772 86 HA GLU 13 HA GLU 13 24.602 7.496 -5.344 87 HB2 GLU 13 HB2 GLU 13 24.772 5.173 -6.179 88 HB3 GLU 13 HB3 GLU 13 25.826 5.708 -7.479 89 HG2 GLU 13 HG2 GLU 13 27.269 4.842 -5.841 90 HG3 GLU 13 HG3 GLU 13 27.417 6.582 -5.652 91 H ARG 14 H ARG 14 25.991 7.746 -8.579 92 HA ARG 14 HA ARG 14 28.078 9.373 -7.993 93 HB2 ARG 14 HB2 ARG 14 28.387 9.993 -10.286 94 HB3 ARG 14 HB3 ARG 14 28.013 8.289 -10.132 95 HG2 ARG 14 HG2 ARG 14 26.207 8.430 -11.459 96 HG3 ARG 14 HG3 ARG 14 25.579 9.878 -10.670 97 HD2 ARG 14 HD2 ARG 14 27.963 10.143 -12.491 98 HD3 ARG 14 HD3 ARG 14 26.388 9.857 -13.207 99 HE ARG 14 HE ARG 14 27.154 12.223 -11.525 100 HH11 ARG 14 HH21 ARG 14 24.595 10.735 -13.468 101 HH12 ARG 14 HH22 ARG 14 23.670 12.227 -13.440 102 HH21 ARG 14 HH12 ARG 14 25.964 14.086 -11.789 103 HH22 ARG 14 HH11 ARG 14 24.436 14.000 -12.657 104 H VAL 15 H VAL 15 24.920 10.572 -8.572 105 HA VAL 15 HA VAL 15 25.530 13.388 -8.561 106 HB VAL 15 HB VAL 15 23.231 13.873 -7.831 107 HG11 VAL 15 HG11 VAL 15 22.134 13.087 -9.885 108 HG12 VAL 15 HG12 VAL 15 23.741 13.760 -10.178 109 HG13 VAL 15 HG13 VAL 15 23.497 11.994 -10.200 110 HG21 VAL 15 HG21 VAL 15 22.780 11.827 -6.490 111 HG22 VAL 15 HG22 VAL 15 21.547 12.136 -7.726 112 HG23 VAL 15 HG23 VAL 15 22.774 10.885 -7.999 113 H ASP 16 H ASP 16 25.611 11.074 -5.975 114 HA ASP 16 HA ASP 16 25.394 13.073 -3.825 115 HB2 ASP 16 HB2 ASP 16 24.973 10.636 -3.504 116 HB3 ASP 16 HB3 ASP 16 26.693 10.330 -3.759 117 H LEU 17 H LEU 17 28.223 11.534 -5.432 118 HA LEU 17 HA LEU 17 30.161 12.748 -3.816 119 HB2 LEU 17 HB2 LEU 17 30.304 11.530 -6.616 120 HB3 LEU 17 HB3 LEU 17 31.712 12.099 -5.753 121 HG LEU 17 HG LEU 17 31.604 9.737 -5.590 122 HD11 LEU 17 HD11 LEU 17 30.841 10.851 -2.863 123 HD12 LEU 17 HD12 LEU 17 32.449 10.992 -3.613 124 HD13 LEU 17 HD13 LEU 17 31.792 9.397 -3.208 125 HD21 LEU 17 HD21 LEU 17 28.963 9.892 -4.105 126 HD22 LEU 17 HD22 LEU 17 29.878 8.450 -4.556 127 HD23 LEU 17 HD23 LEU 17 29.128 9.435 -5.819 128 H GLU 18 H GLU 18 29.023 13.697 -6.963 129 HA GLU 18 HA GLU 18 30.505 16.147 -7.218 130 HB2 GLU 18 HB2 GLU 18 28.752 16.819 -8.877 131 HB3 GLU 18 HB3 GLU 18 29.542 15.287 -9.190 132 HG2 GLU 18 HG2 GLU 18 27.480 14.227 -7.926 133 HG3 GLU 18 HG3 GLU 18 26.722 15.764 -8.226 134 H ALA 19 H ALA 19 27.380 15.492 -5.506 135 HA ALA 19 HA ALA 19 26.932 18.273 -4.880 136 HB1 ALA 19 HB1 ALA 19 25.319 17.422 -3.289 137 HB2 ALA 19 HB2 ALA 19 25.225 16.450 -4.775 138 HB3 ALA 19 HB3 ALA 19 26.037 15.801 -3.339 139 H VAL 20 H VAL 20 28.854 15.716 -3.251 140 HA VAL 20 HA VAL 20 29.691 17.422 -1.025 141 HB VAL 20 HB VAL 20 30.928 14.878 -2.143 142 HG11 VAL 20 HG11 VAL 20 32.653 16.091 -0.884 143 HG12 VAL 20 HG12 VAL 20 31.516 16.364 0.457 144 HG13 VAL 20 HG13 VAL 20 32.075 14.724 0.064 145 HG21 VAL 20 HG21 VAL 20 29.187 15.365 0.319 146 HG22 VAL 20 HG22 VAL 20 28.645 14.585 -1.179 147 HG23 VAL 20 HG23 VAL 20 29.881 13.813 -0.190 148 H ARG 21 H ARG 21 31.252 16.649 -4.168 149 HA ARG 21 HA ARG 21 33.433 18.379 -3.952 150 HB2 ARG 21 HB2 ARG 21 32.987 16.770 -5.829 151 HB3 ARG 21 HB3 ARG 21 31.751 17.858 -6.448 152 HG2 ARG 21 HG2 ARG 21 33.786 18.100 -7.721 153 HG3 ARG 21 HG3 ARG 21 33.408 19.600 -6.880 154 HD2 ARG 21 HD2 ARG 21 35.816 19.153 -6.784 155 HD3 ARG 21 HD3 ARG 21 35.128 19.111 -5.174 156 HE ARG 21 HE ARG 21 35.510 16.804 -5.020 157 HH11 ARG 21 HH11 ARG 21 36.330 17.795 -8.286 158 HH12 ARG 21 HH12 ARG 21 37.138 16.292 -8.633 159 HH21 ARG 21 HH21 ARG 21 36.566 14.923 -5.528 160 HH22 ARG 21 HH22 ARG 21 37.262 14.711 -7.106 161 H LEU 22 H LEU 22 30.161 19.291 -5.040 162 HA LEU 22 HA LEU 22 30.770 22.116 -5.183 163 HB2 LEU 22 HB2 LEU 22 28.207 20.564 -5.396 164 HB3 LEU 22 HB3 LEU 22 28.204 22.305 -5.030 165 HG LEU 22 HG LEU 22 29.751 22.653 -7.026 166 HD11 LEU 22 HD11 LEU 22 30.490 20.331 -7.431 167 HD12 LEU 22 HD12 LEU 22 29.644 20.990 -8.836 168 HD13 LEU 22 HD13 LEU 22 28.805 19.855 -7.767 169 HD21 LEU 22 HD21 LEU 22 27.891 22.671 -8.580 170 HD22 LEU 22 HD22 LEU 22 27.410 23.207 -6.958 171 HD23 LEU 22 HD23 LEU 22 26.970 21.570 -7.507 172 H ALA 23 H ALA 23 29.439 20.141 -2.459 173 HA ALA 23 HA ALA 23 29.072 22.377 -0.736 174 HB1 ALA 23 HB1 ALA 23 28.414 20.088 -0.167 175 HB2 ALA 23 HB2 ALA 23 30.121 19.589 -0.091 176 HB3 ALA 23 HB3 ALA 23 29.483 20.764 1.079 177 H SER 24 H SER 24 32.060 20.614 -1.591 178 HA SER 24 HA SER 24 33.848 22.294 -0.161 179 HB2 SER 24 HB2 SER 24 34.587 20.724 -2.647 180 HB3 SER 24 HB3 SER 24 35.617 21.226 -1.316 181 HG SER 24 HG SER 24 33.495 19.313 -1.218 182 H ILE 25 H ILE 25 32.775 22.601 -3.642 183 HA ILE 25 HA ILE 25 34.434 24.889 -4.029 184 HB ILE 25 HB ILE 25 31.875 24.578 -5.556 185 HG12 ILE 25 HG12 ILE 25 32.684 22.382 -5.850 186 HG13 ILE 25 HG13 ILE 25 33.136 23.258 -7.249 187 HG21 ILE 25 HG21 ILE 25 33.090 26.593 -6.015 188 HG22 ILE 25 HG22 ILE 25 34.646 25.737 -6.117 189 HG23 ILE 25 HG23 ILE 25 33.425 25.522 -7.367 190 HD11 ILE 25 HD11 ILE 25 34.885 21.733 -6.586 191 HD12 ILE 25 HD12 ILE 25 35.484 23.403 -6.422 192 HD13 ILE 25 HD13 ILE 25 34.998 22.458 -4.984 193 H VAL 26 H VAL 26 31.114 24.553 -2.790 194 HA VAL 26 HA VAL 26 30.492 27.348 -2.511 195 HB VAL 26 HB VAL 26 29.526 24.885 -1.027 196 HG11 VAL 26 HG11 VAL 26 27.578 26.332 -0.372 197 HG12 VAL 26 HG12 VAL 26 29.091 26.741 0.431 198 HG13 VAL 26 HG13 VAL 26 28.514 27.746 -0.915 199 HG21 VAL 26 HG21 VAL 26 28.926 25.046 -3.532 200 HG22 VAL 26 HG22 VAL 26 27.560 25.035 -2.439 201 HG23 VAL 26 HG23 VAL 26 28.108 26.568 -3.141 202 H ASP 27 H ASP 27 31.842 24.976 -0.019 203 HA ASP 27 HA ASP 27 32.477 26.906 1.896 204 HB2 ASP 27 HB2 ASP 27 34.099 24.462 1.127 205 HB3 ASP 27 HB3 ASP 27 34.286 25.396 2.609 206 H SER 28 H SER 28 34.519 26.025 -0.916 207 HA SER 28 HA SER 28 36.665 27.779 -0.396 208 HB2 SER 28 HB2 SER 28 35.557 27.105 -3.152 209 HB3 SER 28 HB3 SER 28 37.178 27.688 -2.771 210 HG SER 28 HG SER 28 36.014 25.205 -1.959 211 H ARG 29 H ARG 29 33.554 28.498 -1.881 212 HA ARG 29 HA ARG 29 34.055 31.355 -2.251 213 HB2 ARG 29 HB2 ARG 29 32.534 29.974 -3.680 214 HB3 ARG 29 HB3 ARG 29 31.449 29.767 -2.315 215 HG2 ARG 29 HG2 ARG 29 30.549 31.458 -3.666 216 HG3 ARG 29 HG3 ARG 29 31.147 32.241 -2.210 217 HD2 ARG 29 HD2 ARG 29 33.056 33.133 -3.421 218 HD3 ARG 29 HD3 ARG 29 32.662 32.132 -4.844 219 HE ARG 29 HE ARG 29 30.489 33.920 -4.003 220 HH11 ARG 29 HH11 ARG 29 33.440 33.949 -5.885 221 HH12 ARG 29 HH12 ARG 29 32.846 35.162 -6.982 222 HH21 ARG 29 HH21 ARG 29 29.669 35.259 -5.636 223 HH22 ARG 29 HH22 ARG 29 30.795 35.943 -6.775 224 H LEU 30 H LEU 30 32.360 29.447 0.311 225 HA LEU 30 HA LEU 30 31.484 31.763 1.755 226 HB2 LEU 30 HB2 LEU 30 32.147 29.015 2.867 227 HB3 LEU 30 HB3 LEU 30 31.264 30.297 3.691 228 HG LEU 30 HG LEU 30 30.317 28.802 1.237 229 HD11 LEU 30 HD11 LEU 30 29.147 28.849 4.029 230 HD12 LEU 30 HD12 LEU 30 30.169 27.509 3.454 231 HD13 LEU 30 HD13 LEU 30 28.619 27.857 2.671 232 HD21 LEU 30 HD21 LEU 30 29.461 31.050 1.046 233 HD22 LEU 30 HD22 LEU 30 28.949 31.035 2.759 234 HD23 LEU 30 HD23 LEU 30 28.170 29.979 1.561 235 H ILE 31 H ILE 31 34.573 30.007 1.871 236 HA ILE 31 HA ILE 31 35.826 31.783 3.813 237 HB ILE 31 HB ILE 31 36.928 29.816 1.767 238 HG12 ILE 31 HG12 ILE 31 36.747 29.559 4.807 239 HG13 ILE 31 HG13 ILE 31 35.501 28.948 3.733 240 HG21 ILE 31 HG21 ILE 31 38.680 31.479 2.267 241 HG22 ILE 31 HG22 ILE 31 38.408 31.269 4.011 242 HG23 ILE 31 HG23 ILE 31 39.079 29.953 3.027 243 HD11 ILE 31 HD11 ILE 31 36.912 27.116 4.313 244 HD12 ILE 31 HD12 ILE 31 37.180 27.490 2.601 245 HD13 ILE 31 HD13 ILE 31 38.377 27.982 3.825 246 H GLY 32 H GLY 32 35.592 31.738 0.266 247 HA2 GLY 32 HA2 GLY 32 37.544 33.655 -0.381 248 HA3 GLY 32 HA3 GLY 32 36.168 33.127 -1.381 249 H THR 33 H THR 33 34.034 33.973 0.143 250 HA THR 33 HA THR 33 34.330 36.843 0.630 251 HB THR 33 HB THR 33 34.095 36.740 -1.822 252 HG1 THR 33 HG1 THR 33 33.235 38.536 -0.882 253 HG21 THR 33 HG21 THR 33 32.664 34.646 -1.868 254 HG22 THR 33 HG22 THR 33 32.138 35.973 -2.928 255 HG23 THR 33 HG23 THR 33 31.284 35.667 -1.406 256 H GLY 34 H GLY 34 32.258 33.957 0.731 257 HA2 GLY 34 HA2 GLY 34 31.043 33.513 2.748 258 HA3 GLY 34 HA3 GLY 34 30.767 35.221 3.019 259 H SER 35 H SER 35 30.115 34.510 -0.182 260 HA SER 35 HA SER 35 27.347 33.593 0.128 261 HB2 SER 35 HB2 SER 35 28.097 36.237 -1.188 262 HB3 SER 35 HB3 SER 35 26.522 35.435 -1.342 263 HG SER 35 HG SER 35 26.569 37.044 0.316 264 H VAL 36 H VAL 36 26.624 32.511 -1.710 265 HA VAL 36 HA VAL 36 28.540 32.253 -3.992 266 HB VAL 36 HB VAL 36 28.690 30.250 -2.491 267 HG11 VAL 36 HG11 VAL 36 26.900 28.619 -2.445 268 HG12 VAL 36 HG12 VAL 36 26.305 30.154 -1.787 269 HG13 VAL 36 HG13 VAL 36 25.854 29.659 -3.427 270 HG21 VAL 36 HG21 VAL 36 29.202 30.166 -4.942 271 HG22 VAL 36 HG22 VAL 36 28.617 28.634 -4.283 272 HG23 VAL 36 HG23 VAL 36 27.528 29.663 -5.239 273 H ASP 37 H ASP 37 27.639 32.235 -6.011 274 HA ASP 37 HA ASP 37 24.768 32.903 -6.159 275 HB2 ASP 37 HB2 ASP 37 27.006 34.087 -7.817 276 HB3 ASP 37 HB3 ASP 37 25.354 34.665 -7.636 277 H GLU 38 H GLU 38 23.730 32.401 -8.121 278 HA GLU 38 HA GLU 38 24.060 29.999 -9.264 279 HB2 GLU 38 HB2 GLU 38 22.253 31.923 -9.609 280 HB3 GLU 38 HB3 GLU 38 23.166 32.258 -11.080 281 HG2 GLU 38 HG2 GLU 38 22.890 29.726 -11.597 282 HG3 GLU 38 HG3 GLU 38 21.725 29.715 -10.271 283 H ASP 39 H ASP 39 25.647 32.901 -10.483 284 HA ASP 39 HA ASP 39 26.853 31.753 -12.808 285 HB2 ASP 39 HB2 ASP 39 26.348 34.164 -12.439 286 HB3 ASP 39 HB3 ASP 39 27.547 34.217 -11.145 287 H PHE 40 H PHE 40 27.842 31.547 -9.442 288 HA PHE 40 HA PHE 40 30.608 30.798 -10.149 289 HB2 PHE 40 HB2 PHE 40 29.733 31.980 -7.981 290 HB3 PHE 40 HB3 PHE 40 29.249 30.369 -7.473 291 HD1 PHE 40 HD2 PHE 40 32.161 32.345 -8.778 292 HD2 PHE 40 HD1 PHE 40 30.896 28.998 -6.363 293 HE1 PHE 40 HE2 PHE 40 34.496 32.034 -7.989 294 HE2 PHE 40 HE1 PHE 40 33.233 28.724 -5.548 295 HZ PHE 40 HZ PHE 40 35.029 30.221 -6.369 296 H LEU 41 H LEU 41 27.529 29.151 -9.210 297 HA LEU 41 HA LEU 41 28.692 26.517 -9.138 298 HB2 LEU 41 HB2 LEU 41 25.884 27.694 -9.004 299 HB3 LEU 41 HB3 LEU 41 26.204 25.996 -8.684 300 HG LEU 41 HG LEU 41 27.403 28.314 -7.098 301 HD11 LEU 41 HD11 LEU 41 25.800 27.676 -5.341 302 HD12 LEU 41 HD12 LEU 41 25.072 26.469 -6.430 303 HD13 LEU 41 HD13 LEU 41 24.967 28.205 -6.813 304 HD21 LEU 41 HD21 LEU 41 28.767 26.220 -6.971 305 HD22 LEU 41 HD22 LEU 41 27.307 25.340 -6.452 306 HD23 LEU 41 HD23 LEU 41 27.992 26.617 -5.440 307 H ARG 42 H ARG 42 26.601 28.119 -11.554 308 HA ARG 42 HA ARG 42 26.227 25.928 -13.282 309 HB2 ARG 42 HB2 ARG 42 26.058 27.519 -15.114 310 HB3 ARG 42 HB3 ARG 42 25.325 28.175 -13.650 311 HG2 ARG 42 HG2 ARG 42 27.339 29.559 -13.227 312 HG3 ARG 42 HG3 ARG 42 28.126 28.861 -14.651 313 HD2 ARG 42 HD2 ARG 42 26.188 29.740 -16.062 314 HD3 ARG 42 HD3 ARG 42 25.675 30.644 -14.636 315 HE ARG 42 HE ARG 42 27.479 32.127 -14.913 316 HH11 ARG 42 HH11 ARG 42 28.071 29.475 -17.169 317 HH12 ARG 42 HH12 ARG 42 29.457 30.297 -17.829 318 HH21 ARG 42 HH22 ARG 42 29.098 33.027 -15.728 319 HH22 ARG 42 HH21 ARG 42 30.055 32.321 -17.039 320 H GLU 43 H GLU 43 29.296 27.521 -12.755 321 HA GLU 43 HA GLU 43 30.668 26.140 -14.909 322 HB2 GLU 43 HB2 GLU 43 31.896 27.546 -12.517 323 HB3 GLU 43 HB3 GLU 43 32.649 27.173 -14.077 324 HG2 GLU 43 HG2 GLU 43 30.634 28.574 -15.033 325 HG3 GLU 43 HG3 GLU 43 30.564 29.250 -13.406 326 H GLN 44 H GLN 44 29.684 24.884 -11.748 327 HA GLN 44 HA GLN 44 32.067 23.143 -11.576 328 HB2 GLN 44 HB2 GLN 44 29.966 23.617 -9.459 329 HB3 GLN 44 HB3 GLN 44 31.614 23.029 -9.262 330 HG2 GLN 44 HG2 GLN 44 30.703 25.845 -9.923 331 HG3 GLN 44 HG3 GLN 44 31.360 25.302 -8.401 332 HE21 GLN 44 HE21 GLN 44 32.289 27.483 -10.083 333 HE22 GLN 44 HE22 GLN 44 33.980 27.113 -10.438 334 H ILE 45 H ILE 45 28.718 23.070 -12.372 335 HA ILE 45 HA ILE 45 27.781 20.490 -11.320 336 HB ILE 45 HB ILE 45 26.475 20.869 -13.586 337 HG12 ILE 45 HG12 ILE 45 26.904 23.772 -13.102 338 HG13 ILE 45 HG13 ILE 45 27.875 22.845 -14.273 339 HG21 ILE 45 HG21 ILE 45 25.948 22.671 -11.180 340 HG22 ILE 45 HG22 ILE 45 24.718 22.095 -12.329 341 HG23 ILE 45 HG23 ILE 45 25.514 20.933 -11.254 342 HD11 ILE 45 HD11 ILE 45 24.842 23.162 -14.325 343 HD12 ILE 45 HD12 ILE 45 26.012 23.899 -15.430 344 HD13 ILE 45 HD13 ILE 45 25.789 22.140 -15.432 345 H ARG 46 H ARG 46 29.661 21.111 -13.487 346 HA ARG 46 HA ARG 46 30.163 20.967 -16.003 347 HB2 ARG 46 HB2 ARG 46 31.848 19.180 -15.885 348 HB3 ARG 46 HB3 ARG 46 31.889 20.276 -14.524 349 HG2 ARG 46 HG2 ARG 46 32.344 18.038 -13.778 350 HG3 ARG 46 HG3 ARG 46 30.832 18.577 -13.067 351 HD2 ARG 46 HD2 ARG 46 29.588 17.229 -14.788 352 HD3 ARG 46 HD3 ARG 46 31.129 16.726 -15.472 353 HE ARG 46 HE ARG 46 31.512 15.308 -13.649 354 HH11 ARG 46 HH11 ARG 46 28.577 17.117 -12.919 355 HH12 ARG 46 HH12 ARG 46 27.924 15.828 -11.934 356 HH21 ARG 46 HH21 ARG 46 30.661 13.767 -12.279 357 HH22 ARG 46 HH22 ARG 46 29.100 14.024 -11.529 358 H ASP 47 H ASP 47 27.540 19.367 -15.254 359 HA ASP 47 HA ASP 47 26.843 18.244 -17.766 360 HB2 ASP 47 HB2 ASP 47 28.459 16.439 -17.175 361 HB3 ASP 47 HB3 ASP 47 27.658 16.215 -15.623 362 H ALA 48 H ALA 48 26.467 17.554 -14.319 363 HA ALA 48 HA ALA 48 23.896 16.937 -14.038 364 HB1 ALA 48 HB1 ALA 48 23.978 17.694 -11.719 365 HB2 ALA 48 HB2 ALA 48 25.549 17.040 -12.193 366 HB3 ALA 48 HB3 ALA 48 25.336 18.787 -12.086 367 H ARG 49 H ARG 49 21.904 17.754 -14.246 368 HA ARG 49 HA ARG 49 21.595 20.023 -15.849 369 HB2 ARG 49 HB2 ARG 49 20.013 17.899 -15.311 370 HB3 ARG 49 HB3 ARG 49 19.207 19.073 -14.275 371 HG2 ARG 49 HG2 ARG 49 18.070 19.172 -16.339 372 HG3 ARG 49 HG3 ARG 49 19.112 20.606 -16.353 373 HD2 ARG 49 HD2 ARG 49 20.754 19.382 -17.762 374 HD3 ARG 49 HD3 ARG 49 19.706 17.949 -17.725 375 HE ARG 49 HE ARG 49 18.141 20.110 -18.657 376 HH11 ARG 49 HH11 ARG 49 20.885 18.277 -19.828 377 HH12 ARG 49 HH12 ARG 49 20.496 18.576 -21.501 378 HH21 ARG 49 HH21 ARG 49 17.694 20.462 -20.809 379 HH22 ARG 49 HH22 ARG 49 18.725 19.788 -22.035 380 H TYR 50 H TYR 50 20.490 19.856 -12.426 381 HA TYR 50 HA TYR 50 20.767 22.815 -12.248 382 HB2 TYR 50 HB2 TYR 50 18.791 21.145 -10.697 383 HB3 TYR 50 HB3 TYR 50 18.708 22.848 -11.083 384 HD1 TYR 50 HD1 TYR 50 18.903 23.003 -13.968 385 HD2 TYR 50 HD2 TYR 50 16.942 20.040 -11.553 386 HE1 TYR 50 HE1 TYR 50 17.357 22.500 -15.853 387 HE2 TYR 50 HE2 TYR 50 15.399 19.517 -13.438 388 HH TYR 50 HH TYR 50 14.804 20.010 -15.588 389 H ALA 51 H ALA 51 22.002 23.580 -10.573 390 HA ALA 51 HA ALA 51 22.553 21.775 -8.231 391 HB1 ALA 51 HB1 ALA 51 24.630 22.361 -9.261 392 HB2 ALA 51 HB2 ALA 51 24.189 24.086 -9.340 393 HB3 ALA 51 HB3 ALA 51 24.475 23.300 -7.770 394 H VAL 52 H VAL 52 22.074 22.629 -6.087 395 HA VAL 52 HA VAL 52 20.392 25.086 -6.067 396 HB VAL 52 HB VAL 52 19.492 22.293 -5.297 397 HG11 VAL 52 HG11 VAL 52 17.348 23.375 -4.583 398 HG12 VAL 52 HG12 VAL 52 18.697 23.754 -3.517 399 HG13 VAL 52 HG13 VAL 52 18.141 24.961 -4.702 400 HG21 VAL 52 HG21 VAL 52 18.403 24.317 -7.286 401 HG22 VAL 52 HG22 VAL 52 19.150 22.746 -7.653 402 HG23 VAL 52 HG23 VAL 52 17.597 22.804 -6.828 403 H ILE 53 H ILE 53 20.390 26.158 -4.255 404 HA ILE 53 HA ILE 53 22.269 25.296 -2.097 405 HB ILE 53 HB ILE 53 21.790 27.809 -3.599 406 HG12 ILE 53 HG12 ILE 53 23.736 26.412 -4.060 407 HG13 ILE 53 HG13 ILE 53 24.196 28.015 -3.500 408 HG21 ILE 53 HG21 ILE 53 22.908 29.274 -1.927 409 HG22 ILE 53 HG22 ILE 53 21.267 28.816 -1.494 410 HG23 ILE 53 HG23 ILE 53 22.635 28.030 -0.690 411 HD11 ILE 53 HD11 ILE 53 25.665 26.521 -2.392 412 HD12 ILE 53 HD12 ILE 53 24.473 26.955 -1.151 413 HD13 ILE 53 HD13 ILE 53 24.372 25.394 -1.968 414 H ARG 54 H ARG 54 21.791 25.149 -0.105 415 HA ARG 54 HA ARG 54 19.583 26.771 1.115 416 HB2 ARG 54 HB2 ARG 54 20.157 23.842 1.647 417 HB3 ARG 54 HB3 ARG 54 18.970 24.838 2.489 418 HG2 ARG 54 HG2 ARG 54 18.877 24.043 -0.462 419 HG3 ARG 54 HG3 ARG 54 18.004 23.240 0.831 420 HD2 ARG 54 HD2 ARG 54 16.670 25.224 1.281 421 HD3 ARG 54 HD3 ARG 54 17.629 26.179 0.153 422 HE ARG 54 HE ARG 54 16.549 25.254 -1.660 423 HH11 ARG 54 HH11 ARG 54 15.510 23.438 1.160 424 HH12 ARG 54 HH12 ARG 54 14.253 22.616 0.280 425 HH21 ARG 54 HH21 ARG 54 14.915 24.169 -2.719 426 HH22 ARG 54 HH22 ARG 54 13.932 23.025 -1.858 427 H ILE 55 H ILE 55 21.500 28.085 1.487 428 HA ILE 55 HA ILE 55 23.294 27.205 3.707 429 HB ILE 55 HB ILE 55 23.426 29.665 1.944 430 HG12 ILE 55 HG12 ILE 55 25.651 27.643 2.199 431 HG13 ILE 55 HG13 ILE 55 24.292 27.263 1.138 432 HG21 ILE 55 HG21 ILE 55 25.144 28.825 4.336 433 HG22 ILE 55 HG22 ILE 55 25.623 30.074 3.179 434 HG23 ILE 55 HG23 ILE 55 24.185 30.314 4.164 435 HD11 ILE 55 HD11 ILE 55 26.025 29.757 0.970 436 HD12 ILE 55 HD12 ILE 55 26.162 28.311 -0.041 437 HD13 ILE 55 HD13 ILE 55 24.701 29.324 -0.130 438 HA PRO 56 HA PRO 56 20.330 29.412 6.316 439 HB2 PRO 56 HB2 PRO 56 22.570 29.301 8.310 440 HB3 PRO 56 HB3 PRO 56 20.841 28.901 8.530 441 HG2 PRO 56 HG2 PRO 56 22.680 26.919 8.264 442 HG3 PRO 56 HG3 PRO 56 21.098 26.803 7.424 443 HD2 PRO 56 HD2 PRO 56 23.768 27.670 6.284 444 HD3 PRO 56 HD3 PRO 56 22.536 26.557 5.602 445 H GLY 57 H GLY 57 19.959 31.529 6.408 446 HA2 GLY 57 HA2 GLY 57 20.270 33.776 6.945 447 HA3 GLY 57 HA3 GLY 57 22.000 33.510 7.143 448 H GLN 58 H GLN 58 21.160 32.276 4.101 449 HA GLN 58 HA GLN 58 21.125 34.899 2.740 450 HB2 GLN 58 HB2 GLN 58 22.977 34.519 1.360 451 HB3 GLN 58 HB3 GLN 58 23.481 34.023 2.971 452 HG2 GLN 58 HG2 GLN 58 23.167 31.699 2.397 453 HG3 GLN 58 HG3 GLN 58 22.701 32.122 0.732 454 HE21 GLN 58 HE21 GLN 58 25.378 32.822 3.099 455 HE22 GLN 58 HE22 GLN 58 26.643 32.824 1.893 456 HA PRO 59 HA PRO 59 17.911 33.220 0.473 457 HB2 PRO 59 HB2 PRO 59 18.022 34.336 -2.032 458 HB3 PRO 59 HB3 PRO 59 17.662 35.261 -0.537 459 HG2 PRO 59 HG2 PRO 59 20.344 34.968 -1.937 460 HG3 PRO 59 HG3 PRO 59 19.541 36.475 -1.377 461 HD2 PRO 59 HD2 PRO 59 21.428 35.243 0.114 462 HD3 PRO 59 HD3 PRO 59 19.999 35.982 0.889 463 H VAL 60 H VAL 60 17.215 31.532 -0.742 464 HA VAL 60 HA VAL 60 18.948 29.518 -1.690 465 HB VAL 60 HB VAL 60 16.774 28.903 -1.041 466 HG11 VAL 60 HG11 VAL 60 15.600 30.667 -3.228 467 HG12 VAL 60 HG12 VAL 60 14.693 29.541 -2.203 468 HG13 VAL 60 HG13 VAL 60 15.473 30.944 -1.477 469 HG21 VAL 60 HG21 VAL 60 17.711 27.604 -2.998 470 HG22 VAL 60 HG22 VAL 60 15.946 27.557 -2.853 471 HG23 VAL 60 HG23 VAL 60 16.705 28.601 -4.064 472 H VAL 61 H VAL 61 20.004 29.160 -3.414 473 HA VAL 61 HA VAL 61 19.478 30.639 -5.973 474 HB VAL 61 HB VAL 61 22.067 29.428 -4.937 475 HG11 VAL 61 HG11 VAL 61 21.550 30.760 -7.615 476 HG12 VAL 61 HG12 VAL 61 23.130 30.264 -6.949 477 HG13 VAL 61 HG13 VAL 61 21.941 29.038 -7.361 478 HG21 VAL 61 HG21 VAL 61 21.527 31.621 -3.957 479 HG22 VAL 61 HG22 VAL 61 22.897 31.735 -5.062 480 HG23 VAL 61 HG23 VAL 61 21.293 32.299 -5.583 481 H GLU 62 H GLU 62 19.120 29.471 -7.840 482 HA GLU 62 HA GLU 62 19.244 26.511 -7.741 483 HB2 GLU 62 HB2 GLU 62 16.818 28.119 -8.662 484 HB3 GLU 62 HB3 GLU 62 17.037 26.376 -8.861 485 HG2 GLU 62 HG2 GLU 62 17.066 26.090 -6.408 486 HG3 GLU 62 HG3 GLU 62 16.869 27.827 -6.190 487 H VAL 63 H VAL 63 20.732 26.099 -9.330 488 HA VAL 63 HA VAL 63 21.179 27.950 -11.544 489 HB VAL 63 HB VAL 63 22.441 25.278 -10.883 490 HG11 VAL 63 HG11 VAL 63 23.403 27.562 -12.616 491 HG12 VAL 63 HG12 VAL 63 24.395 26.175 -12.109 492 HG13 VAL 63 HG13 VAL 63 22.997 25.907 -13.150 493 HG21 VAL 63 HG21 VAL 63 22.775 26.870 -8.973 494 HG22 VAL 63 HG22 VAL 63 24.243 26.407 -9.816 495 HG23 VAL 63 HG23 VAL 63 23.529 28.000 -10.123 496 H GLY 64 H GLY 64 20.979 27.422 -13.772 497 HA2 GLY 64 HA2 GLY 64 20.329 26.201 -15.631 498 HA3 GLY 64 HA3 GLY 64 20.006 24.815 -14.591 499 H THR 65 H THR 65 17.882 24.621 -13.612 500 HA THR 65 HA THR 65 15.750 26.491 -14.270 501 HB THR 65 HB THR 65 15.315 23.661 -15.271 502 HG1 THR 65 HG1 THR 65 15.651 24.424 -17.359 503 HG21 THR 65 HG21 THR 65 13.588 24.791 -16.691 504 HG22 THR 65 HG22 THR 65 13.955 26.320 -15.861 505 HG23 THR 65 HG23 THR 65 13.271 24.939 -14.967 506 H LYS 66 H LYS 66 13.762 25.926 -12.985 507 HA LYS 66 HA LYS 66 14.357 24.398 -10.613 508 HB2 LYS 66 HB2 LYS 66 12.949 26.499 -10.750 509 HB3 LYS 66 HB3 LYS 66 11.664 25.523 -11.481 510 HG2 LYS 66 HG2 LYS 66 11.653 24.070 -9.440 511 HG3 LYS 66 HG3 LYS 66 12.963 25.052 -8.761 512 HD2 LYS 66 HD2 LYS 66 11.398 27.075 -8.939 513 HD3 LYS 66 HD3 LYS 66 10.122 25.943 -9.403 514 HE2 LYS 66 HE2 LYS 66 9.802 26.246 -7.095 515 HE3 LYS 66 HE3 LYS 66 10.616 24.682 -7.216 516 HZ1 LYS 66 HZ1 LYS 66 11.625 26.061 -5.489 517 HZ2 LYS 66 HZ2 LYS 66 11.917 27.277 -6.542 518 HZ3 LYS 66 HZ3 LYS 66 12.741 25.882 -6.684 519 HA PRO 67 HA PRO 67 13.101 20.539 -12.447 520 HB2 PRO 67 HB2 PRO 67 13.281 18.872 -10.288 521 HB3 PRO 67 HB3 PRO 67 14.702 19.570 -11.135 522 HG2 PRO 67 HG2 PRO 67 13.381 20.537 -8.595 523 HG3 PRO 67 HG3 PRO 67 15.130 20.333 -8.970 524 HD2 PRO 67 HD2 PRO 67 13.857 22.754 -9.154 525 HD3 PRO 67 HD3 PRO 67 15.213 22.284 -10.227 526 H THR 68 H THR 68 11.497 19.161 -12.642 527 HA THR 68 HA THR 68 8.932 20.004 -11.802 528 HB THR 68 HB THR 68 9.515 19.303 -14.062 529 HG1 THR 68 HG1 THR 68 7.599 18.220 -14.451 530 HG21 THR 68 HG21 THR 68 10.861 17.232 -13.461 531 HG22 THR 68 HG22 THR 68 9.663 17.001 -14.740 532 HG23 THR 68 HG23 THR 68 9.320 16.420 -13.100 533 H GLY 69 H GLY 69 10.760 17.205 -10.738 534 HA2 GLY 69 HA2 GLY 69 9.842 16.442 -8.405 535 HA3 GLY 69 HA3 GLY 69 8.390 16.035 -9.335 536 H ASP 70 H ASP 70 9.505 15.016 -11.682 537 HA ASP 70 HA ASP 70 10.666 12.451 -10.895 538 HB2 ASP 70 HB2 ASP 70 9.995 13.571 -13.628 539 HB3 ASP 70 HB3 ASP 70 10.568 11.931 -13.303 540 H VAL 71 H VAL 71 12.399 13.783 -9.843 541 HA VAL 71 HA VAL 71 14.772 13.866 -11.650 542 HB VAL 71 HB VAL 71 15.636 15.828 -10.496 543 HG11 VAL 71 HG11 VAL 71 14.167 15.964 -12.629 544 HG12 VAL 71 HG12 VAL 71 12.913 16.658 -11.586 545 HG13 VAL 71 HG13 VAL 71 14.497 17.433 -11.743 546 HG21 VAL 71 HG21 VAL 71 14.284 17.244 -9.082 547 HG22 VAL 71 HG22 VAL 71 12.897 16.144 -9.204 548 HG23 VAL 71 HG23 VAL 71 14.374 15.644 -8.352 549 H LEU 72 H LEU 72 16.812 13.761 -10.588 550 HA LEU 72 HA LEU 72 16.876 11.776 -8.340 551 HB2 LEU 72 HB2 LEU 72 18.886 12.517 -10.516 552 HB3 LEU 72 HB3 LEU 72 19.209 11.367 -9.222 553 HG LEU 72 HG LEU 72 16.976 11.074 -11.253 554 HD11 LEU 72 HD11 LEU 72 18.428 9.348 -12.305 555 HD12 LEU 72 HD12 LEU 72 19.721 9.734 -11.142 556 HD13 LEU 72 HD13 LEU 72 19.199 10.941 -12.342 557 HD21 LEU 72 HD21 LEU 72 16.477 9.854 -9.249 558 HD22 LEU 72 HD22 LEU 72 18.124 9.188 -9.185 559 HD23 LEU 72 HD23 LEU 72 16.999 8.691 -10.477 560 H GLN 73 H GLN 73 17.554 12.462 -6.443 561 HA GLN 73 HA GLN 73 18.750 15.176 -6.214 562 HB2 GLN 73 HB2 GLN 73 17.139 13.443 -4.325 563 HB3 GLN 73 HB3 GLN 73 17.893 14.977 -3.882 564 HG2 GLN 73 HG2 GLN 73 16.657 16.054 -5.820 565 HG3 GLN 73 HG3 GLN 73 15.733 14.564 -5.995 566 HE21 GLN 73 HE21 GLN 73 14.876 17.355 -5.255 567 HE22 GLN 73 HE22 GLN 73 14.066 17.160 -3.693 568 H GLY 74 H GLY 74 20.858 15.287 -6.015 569 HA2 GLY 74 HA2 GLY 74 22.424 13.385 -4.285 570 HA3 GLY 74 HA3 GLY 74 23.089 14.585 -5.414 571 H ARG 75 H ARG 75 23.754 14.510 -2.456 572 HA ARG 75 HA ARG 75 22.751 17.108 -1.624 573 HB2 ARG 75 HB2 ARG 75 20.765 15.585 -1.185 574 HB3 ARG 75 HB3 ARG 75 21.750 14.751 0.014 575 HG2 ARG 75 HG2 ARG 75 22.035 16.962 1.225 576 HG3 ARG 75 HG3 ARG 75 20.970 17.711 0.021 577 HD2 ARG 75 HD2 ARG 75 19.171 16.129 0.632 578 HD3 ARG 75 HD3 ARG 75 20.214 15.368 1.831 579 HE ARG 75 HE ARG 75 18.744 17.877 2.061 580 HH11 ARG 75 HH21 ARG 75 21.498 16.184 3.430 581 HH12 ARG 75 HH22 ARG 75 21.465 17.129 4.891 582 HH21 ARG 75 HH11 ARG 75 18.724 18.998 3.985 583 HH22 ARG 75 HH12 ARG 75 19.942 18.688 5.182 584 H ALA 76 H ALA 76 24.221 18.018 -0.447 585 HA ALA 76 HA ALA 76 25.949 16.483 1.494 586 HB1 ALA 76 HB1 ALA 76 27.051 16.700 -0.686 587 HB2 ALA 76 HB2 ALA 76 26.799 18.459 -0.659 588 HB3 ALA 76 HB3 ALA 76 27.891 17.686 0.522 589 H THR 77 H THR 77 27.497 18.154 2.670 590 HA THR 77 HA THR 77 26.187 20.653 3.480 591 HB THR 77 HB THR 77 26.387 18.278 5.337 592 HG1 THR 77 HG1 THR 77 24.599 20.439 5.089 593 HG21 THR 77 HG21 THR 77 27.623 19.868 6.657 594 HG22 THR 77 HG22 THR 77 25.966 19.878 7.256 595 HG23 THR 77 HG23 THR 77 26.539 21.198 6.209 596 H GLY 78 H GLY 78 27.781 21.995 3.221 597 HA2 GLY 78 HA2 GLY 78 30.559 21.390 3.433 598 HA3 GLY 78 HA3 GLY 78 29.817 22.961 3.184 599 H GLU 79 H GLU 79 32.004 23.062 4.449 600 HA GLU 79 HA GLU 79 32.115 22.517 7.260 601 HB2 GLU 79 HB2 GLU 79 33.826 24.227 5.413 602 HB3 GLU 79 HB3 GLU 79 34.216 23.920 7.109 603 HG2 GLU 79 HG2 GLU 79 34.188 21.456 6.649 604 HG3 GLU 79 HG3 GLU 79 33.969 21.803 4.935 605 H GLU 80 H GLU 80 30.345 25.086 5.791 606 HA GLU 80 HA GLU 80 30.625 26.711 8.335 607 HB2 GLU 80 HB2 GLU 80 29.274 27.447 5.754 608 HB3 GLU 80 HB3 GLU 80 29.489 28.490 7.160 609 HG2 GLU 80 HG2 GLU 80 31.710 27.380 5.374 610 HG3 GLU 80 HG3 GLU 80 31.073 28.996 5.449 611 H GLY 81 H GLY 81 28.974 24.133 7.309 612 HA2 GLY 81 HA2 GLY 81 27.293 23.060 8.450 613 HA3 GLY 81 HA3 GLY 81 26.798 24.571 9.214 614 H GLU 82 H GLU 82 27.096 24.378 5.707 615 HA GLU 82 HA GLU 82 24.295 25.116 5.414 616 HB2 GLU 82 HB2 GLU 82 25.010 25.868 3.242 617 HB3 GLU 82 HB3 GLU 82 26.101 26.442 4.486 618 HG2 GLU 82 HG2 GLU 82 27.535 25.854 2.751 619 HG3 GLU 82 HG3 GLU 82 27.657 24.471 3.827 620 H THR 83 H THR 83 23.825 24.339 2.736 621 HA THR 83 HA THR 83 23.976 21.450 2.623 622 HB THR 83 HB THR 83 21.346 22.842 3.070 623 HG1 THR 83 HG1 THR 83 22.857 21.673 4.592 624 HG21 THR 83 HG21 THR 83 20.224 20.706 2.510 625 HG22 THR 83 HG22 THR 83 21.760 20.082 1.848 626 HG23 THR 83 HG23 THR 83 20.929 21.465 1.083 627 H VAL 84 H VAL 84 24.575 21.017 0.783 628 HA VAL 84 HA VAL 84 23.733 22.538 -1.679 629 HB VAL 84 HB VAL 84 26.001 20.560 -1.257 630 HG11 VAL 84 HG11 VAL 84 25.075 20.063 -3.488 631 HG12 VAL 84 HG12 VAL 84 25.077 21.801 -3.892 632 HG13 VAL 84 HG13 VAL 84 26.599 20.920 -3.628 633 HG21 VAL 84 HG21 VAL 84 26.548 22.801 -0.579 634 HG22 VAL 84 HG22 VAL 84 27.313 22.542 -2.149 635 HG23 VAL 84 HG23 VAL 84 25.825 23.496 -2.041 636 H LEU 85 H LEU 85 22.520 21.655 -3.223 637 HA LEU 85 HA LEU 85 21.853 18.768 -3.107 638 HB2 LEU 85 HB2 LEU 85 20.025 20.168 -2.082 639 HB3 LEU 85 HB3 LEU 85 19.898 21.033 -3.595 640 HG LEU 85 HG LEU 85 19.404 18.652 -4.642 641 HD11 LEU 85 HD11 LEU 85 18.424 17.045 -3.172 642 HD12 LEU 85 HD12 LEU 85 18.501 18.145 -1.773 643 HD13 LEU 85 HD13 LEU 85 19.981 17.458 -2.439 644 HD21 LEU 85 HD21 LEU 85 17.424 20.040 -2.794 645 HD22 LEU 85 HD22 LEU 85 17.021 18.886 -4.088 646 HD23 LEU 85 HD23 LEU 85 17.760 20.447 -4.491 647 H VAL 86 H VAL 86 21.584 17.831 -5.142 648 HA VAL 86 HA VAL 86 21.991 19.522 -7.584 649 HB VAL 86 HB VAL 86 23.272 16.770 -7.300 650 HG11 VAL 86 HG11 VAL 86 23.373 18.815 -9.524 651 HG12 VAL 86 HG12 VAL 86 24.337 17.322 -9.417 652 HG13 VAL 86 HG13 VAL 86 22.581 17.216 -9.572 653 HG21 VAL 86 HG21 VAL 86 24.590 19.522 -7.334 654 HG22 VAL 86 HG22 VAL 86 24.515 18.426 -5.935 655 HG23 VAL 86 HG23 VAL 86 25.431 17.951 -7.369 656 H GLU 87 H GLU 87 20.570 19.075 -9.210 657 HA GLU 87 HA GLU 87 18.775 16.741 -8.890 658 HB2 GLU 87 HB2 GLU 87 17.765 19.570 -9.274 659 HB3 GLU 87 HB3 GLU 87 16.803 18.084 -9.240 660 HG2 GLU 87 HG2 GLU 87 17.798 17.677 -6.896 661 HG3 GLU 87 HG3 GLU 87 18.391 19.333 -6.960 662 H GLU 88 H GLU 88 18.365 15.723 -10.644 663 HA GLU 88 HA GLU 88 18.437 16.981 -13.314 664 HB2 GLU 88 HB2 GLU 88 19.977 15.237 -14.205 665 HB3 GLU 88 HB3 GLU 88 20.724 16.418 -13.137 666 HG2 GLU 88 HG2 GLU 88 20.779 14.769 -11.319 667 HG3 GLU 88 HG3 GLU 88 19.901 13.604 -12.338 668 HA PRO 89 HA PRO 89 14.987 14.568 -14.048 669 HB2 PRO 89 HB2 PRO 89 15.041 13.825 -16.704 670 HB3 PRO 89 HB3 PRO 89 14.711 15.478 -16.101 671 HG2 PRO 89 HG2 PRO 89 17.358 14.331 -17.043 672 HG3 PRO 89 HG3 PRO 89 16.594 15.885 -17.522 673 HD2 PRO 89 HD2 PRO 89 18.504 15.818 -15.639 674 HD3 PRO 89 HD3 PRO 89 17.074 16.857 -15.388 675 H ARG 90 H ARG 90 14.173 12.665 -13.645 676 HA ARG 90 HA ARG 90 15.858 10.272 -13.456 677 HB2 ARG 90 HB2 ARG 90 14.516 11.027 -11.564 678 HB3 ARG 90 HB3 ARG 90 13.038 10.950 -12.517 679 HG2 ARG 90 HG2 ARG 90 13.219 8.500 -12.700 680 HG3 ARG 90 HG3 ARG 90 14.757 8.557 -11.813 681 HD2 ARG 90 HD2 ARG 90 13.076 7.997 -10.214 682 HD3 ARG 90 HD3 ARG 90 13.551 9.687 -9.927 683 HE ARG 90 HE ARG 90 11.241 9.583 -11.639 684 HH11 ARG 90 HH11 ARG 90 12.071 8.987 -8.289 685 HH12 ARG 90 HH12 ARG 90 10.480 9.405 -7.717 686 HH21 ARG 90 HH21 ARG 90 9.221 10.234 -10.811 687 HH22 ARG 90 HH22 ARG 90 8.923 10.029 -9.109
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