NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
559128 | 2m2m | 18921 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 1H GLY 1 3.514 -2.322 1.492 2 H2 GLY 1 2H GLY 1 4.310 -2.649 2.892 3 H3 GLY 1 3H GLY 1 3.196 -3.709 2.311 4 HA2 GLY 1 HA2 GLY 1 5.762 -3.058 1.020 5 HA3 GLY 1 HA3 GLY 1 5.396 -4.548 1.910 6 H ILE 2 H ILE 2 5.972 -5.668 -0.058 7 HA ILE 2 HA ILE 2 4.720 -5.229 -2.563 8 HB ILE 2 HB ILE 2 6.868 -6.339 -2.262 9 HG12 ILE 2 2HG1 ILE 2 6.708 -8.151 -3.868 10 HG13 ILE 2 3HG1 ILE 2 4.958 -8.221 -3.678 11 HG21 ILE 2 1HG2 ILE 2 6.387 -7.726 -0.253 12 HG22 ILE 2 2HG2 ILE 2 5.382 -8.799 -1.253 13 HG23 ILE 2 3HG2 ILE 2 7.117 -8.654 -1.562 14 HD11 ILE 2 3HD1 ILE 2 6.541 -5.901 -4.841 15 HD12 ILE 2 1HD1 ILE 2 5.613 -7.101 -5.741 16 HD13 ILE 2 2HD1 ILE 2 4.768 -5.958 -4.687 17 H VAL 3 H VAL 3 3.663 -7.390 0.044 18 HA VAL 3 HA VAL 3 1.633 -8.737 -1.491 19 HB VAL 3 HB VAL 3 1.825 -8.257 1.507 20 HG11 VAL 3 1HG1 VAL 3 -0.536 -8.763 0.936 21 HG12 VAL 3 2HG1 VAL 3 -0.006 -10.182 0.001 22 HG13 VAL 3 3HG1 VAL 3 0.216 -10.130 1.760 23 HG21 VAL 3 3HG2 VAL 3 3.668 -9.639 0.569 24 HG22 VAL 3 1HG2 VAL 3 2.587 -10.617 1.565 25 HG23 VAL 3 2HG2 VAL 3 2.477 -10.705 -0.204 26 H GLU 4 H GLU 4 1.533 -5.750 0.514 27 HA GLU 4 HA GLU 4 -1.238 -5.190 -0.061 28 HB2 GLU 4 2HB GLU 4 0.985 -3.339 0.879 29 HB3 GLU 4 3HB GLU 4 -0.742 -3.006 0.907 30 HG2 GLU 4 2HG GLU 4 -0.210 -3.582 3.112 31 HG3 GLU 4 3HG GLU 4 -1.078 -4.962 2.444 32 H GLN 5 H GLN 5 1.441 -5.044 -2.148 33 HA GLN 5 HA GLN 5 0.248 -2.892 -3.830 34 HB2 GLN 5 2HB GLN 5 2.721 -2.875 -3.273 35 HB3 GLN 5 3HB GLN 5 2.880 -4.379 -4.177 36 HG2 GLN 5 2HG GLN 5 3.540 -2.526 -5.582 37 HG3 GLN 5 3HG GLN 5 2.079 -3.241 -6.235 38 HE21 GLN 5 2HE2 GLN 5 1.884 -1.103 -7.421 39 HE22 GLN 5 1HE2 GLN 5 1.175 0.242 -6.533 40 H CYS 6 H CYS 6 1.163 -6.368 -3.940 41 HA CYS 6 HA CYS 6 -0.101 -6.644 -6.625 42 HB2 CYS 6 2HB CYS 6 1.786 -8.317 -4.960 43 HB3 CYS 6 3HB CYS 6 1.129 -8.838 -6.504 44 H CYS 7 H CYS 7 -0.521 -8.031 -3.354 45 HA CYS 7 HA CYS 7 -2.289 -10.133 -4.282 46 HB2 CYS 7 2HB CYS 7 -0.823 -10.176 -2.236 47 HB3 CYS 7 3HB CYS 7 -1.957 -9.069 -1.462 48 H THR 8 H THR 8 -2.902 -6.914 -3.027 49 HA THR 8 HA THR 8 -5.790 -7.295 -2.711 50 HB THR 8 HB THR 8 -4.305 -5.861 -1.258 51 HG1 THR 8 HG1 THR 8 -5.933 -4.311 -1.055 52 HG21 THR 8 1HG2 THR 8 -4.530 -3.866 -3.552 53 HG22 THR 8 2HG2 THR 8 -3.747 -3.617 -1.977 54 HG23 THR 8 3HG2 THR 8 -3.045 -4.754 -3.148 55 H SER 9 H SER 9 -3.696 -6.019 -5.222 56 HA SER 9 HA SER 9 -5.780 -5.736 -7.203 57 HB2 SER 9 2HB SER 9 -5.624 -3.373 -7.557 58 HB3 SER 9 3HB SER 9 -6.167 -3.668 -5.905 59 HG SER 9 HG SER 9 -4.540 -2.030 -6.028 60 H ILE 10 H ILE 10 -4.782 -4.677 -9.243 61 HA ILE 10 HA ILE 10 -2.641 -6.484 -9.840 62 HB ILE 10 HB ILE 10 -4.047 -4.369 -11.520 63 HG12 ILE 10 2HG1 ILE 10 -4.289 -7.358 -11.017 64 HG13 ILE 10 3HG1 ILE 10 -5.506 -6.104 -10.825 65 HG21 ILE 10 1HG2 ILE 10 -1.963 -6.412 -12.340 66 HG22 ILE 10 2HG2 ILE 10 -2.993 -5.524 -13.489 67 HG23 ILE 10 3HG2 ILE 10 -1.838 -4.653 -12.497 68 HD11 ILE 10 3HD1 ILE 10 -5.642 -5.879 -13.274 69 HD12 ILE 10 1HD1 ILE 10 -4.473 -7.229 -13.445 70 HD13 ILE 10 2HD1 ILE 10 -6.050 -7.499 -12.658 71 H CYS 11 H CYS 11 -0.576 -6.328 -9.987 72 HA CYS 11 HA CYS 11 0.764 -3.657 -9.968 73 HB2 CYS 11 2HB CYS 11 2.546 -4.579 -8.693 74 HB3 CYS 11 3HB CYS 11 1.044 -4.957 -7.864 75 H SER 12 H SER 12 2.953 -3.734 -10.967 76 HA SER 12 HA SER 12 3.046 -5.420 -13.439 77 HB2 SER 12 2HB SER 12 3.502 -2.424 -13.185 78 HB3 SER 12 3HB SER 12 3.669 -3.394 -14.651 79 HG SER 12 HG SER 12 1.609 -2.297 -14.492 80 H LEU 13 H LEU 13 5.154 -5.530 -14.460 81 HA LEU 13 HA LEU 13 7.085 -6.436 -12.635 82 HB2 LEU 13 2HB LEU 13 8.552 -6.604 -14.550 83 HB3 LEU 13 3HB LEU 13 6.991 -7.332 -14.845 84 HG LEU 13 HG LEU 13 7.727 -4.571 -15.908 85 HD11 LEU 13 1HD1 LEU 13 9.408 -6.200 -16.673 86 HD12 LEU 13 2HD1 LEU 13 8.116 -7.272 -17.259 87 HD13 LEU 13 3HD1 LEU 13 8.373 -5.680 -18.010 88 HD21 LEU 13 3HD2 LEU 13 5.330 -4.979 -16.114 89 HD22 LEU 13 1HD2 LEU 13 6.076 -5.114 -17.696 90 HD23 LEU 13 2HD2 LEU 13 5.635 -6.586 -16.815 91 H TYR 14 H TYR 14 6.882 -3.366 -14.326 92 HA TYR 14 HA TYR 14 9.441 -2.407 -13.672 93 HB2 TYR 14 2HB TYR 14 8.641 -0.309 -14.528 94 HB3 TYR 14 3HB TYR 14 8.036 -1.645 -15.529 95 HD1 TYR 14 HD2 TYR 14 7.085 0.875 -12.922 96 HD2 TYR 14 HD1 TYR 14 5.697 -1.880 -15.939 97 HE1 TYR 14 HE2 TYR 14 4.796 1.809 -12.713 98 HE2 TYR 14 HE1 TYR 14 3.413 -0.919 -15.761 99 HH TYR 14 HH TYR 14 2.051 0.609 -14.690 100 H GLN 15 H GLN 15 6.831 -2.749 -11.565 101 HA GLN 15 HA GLN 15 7.903 -0.652 -9.703 102 HB2 GLN 15 2HB GLN 15 5.602 -0.433 -8.779 103 HB3 GLN 15 3HB GLN 15 5.767 0.169 -10.427 104 HG2 GLN 15 2HG GLN 15 4.654 -1.778 -11.338 105 HG3 GLN 15 3HG GLN 15 4.652 -2.586 -9.759 106 HE21 GLN 15 2HE2 GLN 15 3.363 0.443 -11.328 107 HE22 GLN 15 1HE2 GLN 15 1.879 0.386 -10.396 108 H LEU 16 H LEU 16 6.567 -3.960 -10.069 109 HA LEU 16 HA LEU 16 6.834 -4.611 -7.299 110 HB2 LEU 16 2HB LEU 16 5.742 -6.448 -7.940 111 HB3 LEU 16 3HB LEU 16 5.560 -5.655 -9.466 112 HG LEU 16 HG LEU 16 7.877 -6.805 -10.046 113 HD11 LEU 16 1HD1 LEU 16 6.789 -8.403 -7.693 114 HD12 LEU 16 2HD1 LEU 16 7.822 -9.145 -8.912 115 HD13 LEU 16 3HD1 LEU 16 8.440 -7.796 -7.957 116 HD21 LEU 16 3HD2 LEU 16 5.370 -8.517 -9.913 117 HD22 LEU 16 1HD2 LEU 16 5.674 -7.286 -11.155 118 HD23 LEU 16 2HD2 LEU 16 6.768 -8.676 -11.019 119 H GLU 17 H GLU 17 9.083 -4.758 -10.013 120 HA GLU 17 HA GLU 17 11.357 -6.054 -9.055 121 HB2 GLU 17 2HB GLU 17 10.916 -3.559 -10.722 122 HB3 GLU 17 3HB GLU 17 12.539 -3.884 -10.138 123 HG2 GLU 17 2HG GLU 17 12.538 -6.098 -11.190 124 HG3 GLU 17 3HG GLU 17 10.933 -5.783 -11.861 125 H ASN 18 H ASN 18 10.097 -2.912 -8.035 126 HA ASN 18 HA ASN 18 12.423 -1.845 -6.804 127 HB2 ASN 18 2HB ASN 18 9.462 -1.360 -6.267 128 HB3 ASN 18 3HB ASN 18 10.734 -0.363 -5.691 129 HD21 ASN 18 1HD2 ASN 18 8.792 0.837 -7.163 130 HD22 ASN 18 2HD2 ASN 18 9.463 1.332 -8.710 131 H TYR 19 H TYR 19 10.148 -4.218 -5.664 132 HA TYR 19 HA TYR 19 10.748 -3.896 -2.808 133 HB2 TYR 19 2HB TYR 19 8.960 -5.802 -4.365 134 HB3 TYR 19 3HB TYR 19 9.055 -5.700 -2.617 135 HD1 TYR 19 HD2 TYR 19 8.057 -3.753 -5.689 136 HD2 TYR 19 HD1 TYR 19 7.907 -4.029 -1.377 137 HE1 TYR 19 HE2 TYR 19 6.388 -1.932 -5.626 138 HE2 TYR 19 HE1 TYR 19 6.174 -2.247 -1.328 139 HH TYR 19 HH TYR 19 5.027 -0.614 -4.311 140 H CYS 20 H CYS 20 12.407 -5.442 -5.271 141 HA CYS 20 HA CYS 20 13.253 -7.840 -3.817 142 HB2 CYS 20 2HB CYS 20 13.163 -7.444 -6.360 143 HB3 CYS 20 3HB CYS 20 14.648 -6.513 -6.152 144 H ASN 21 H ASN 21 13.894 -4.641 -3.233 145 HA ASN 21 HA ASN 21 16.663 -4.402 -2.785 146 HB2 ASN 21 2HB ASN 21 16.095 -2.431 -1.557 147 HB3 ASN 21 3HB ASN 21 14.938 -2.554 -2.868 148 HD21 ASN 21 2HD2 ASN 21 15.330 -2.302 0.553 149 HD22 ASN 21 1HD2 ASN 21 13.626 -2.460 0.954 150 H1 PHE 1 1H PHE 1 5.592 -12.027 -19.736 151 H2 PHE 1 2H PHE 1 7.000 -11.469 -19.109 152 H3 PHE 1 3H PHE 1 5.935 -10.430 -19.801 153 HA PHE 1 HA PHE 1 5.454 -11.988 -17.355 154 HB2 PHE 1 2HB PHE 1 7.119 -10.069 -17.171 155 HB3 PHE 1 3HB PHE 1 5.810 -8.972 -17.582 156 HD1 PHE 1 HD1 PHE 1 6.946 -11.542 -15.100 157 HD2 PHE 1 HD2 PHE 1 4.274 -8.230 -15.856 158 HE1 PHE 1 HE1 PHE 1 6.268 -11.533 -12.715 159 HE2 PHE 1 HE2 PHE 1 3.620 -8.221 -13.467 160 HZ PHE 1 HZ PHE 1 4.586 -9.890 -11.902 161 H VAL 2 H VAL 2 3.441 -11.192 -16.165 162 HA VAL 2 HA VAL 2 1.329 -10.091 -17.978 163 HB VAL 2 HB VAL 2 0.923 -12.400 -16.025 164 HG11 VAL 2 1HG1 VAL 2 -1.073 -10.937 -16.135 165 HG12 VAL 2 2HG1 VAL 2 -1.039 -11.000 -17.909 166 HG13 VAL 2 3HG1 VAL 2 -1.391 -12.461 -16.962 167 HG21 VAL 2 3HG2 VAL 2 0.831 -12.374 -19.076 168 HG22 VAL 2 1HG2 VAL 2 2.025 -13.218 -18.064 169 HG23 VAL 2 2HG2 VAL 2 0.338 -13.734 -18.044 170 H ASN 3 H ASN 3 0.385 -8.358 -17.095 171 HA ASN 3 HA ASN 3 0.828 -7.653 -14.258 172 HB2 ASN 3 2HB ASN 3 -0.723 -6.225 -16.444 173 HB3 ASN 3 3HB ASN 3 -0.375 -5.588 -14.839 174 HD21 ASN 3 1HD2 ASN 3 0.382 -4.376 -17.386 175 HD22 ASN 3 2HD2 ASN 3 2.135 -4.321 -17.403 176 H GLN 4 H GLN 4 -0.368 -8.561 -12.746 177 HA GLN 4 HA GLN 4 -3.277 -8.858 -12.924 178 HB2 GLN 4 2HB GLN 4 -3.147 -11.342 -12.500 179 HB3 GLN 4 3HB GLN 4 -2.701 -10.865 -14.127 180 HG2 GLN 4 2HG GLN 4 -0.432 -11.119 -13.768 181 HG3 GLN 4 3HG GLN 4 -0.564 -11.179 -12.011 182 HE21 GLN 4 2HE2 GLN 4 -1.777 -13.090 -11.054 183 HE22 GLN 4 1HE2 GLN 4 -1.450 -14.606 -11.871 184 H HIS 5 H HIS 5 -3.910 -10.302 -10.933 185 HA HIS 5 HA HIS 5 -2.788 -9.151 -8.470 186 HB2 HIS 5 2HB HIS 5 -4.899 -11.307 -8.907 187 HB3 HIS 5 3HB HIS 5 -4.526 -10.499 -7.386 188 HD2 HIS 5 HD2 HIS 5 -6.161 -9.796 -10.834 189 HE1 HIS 5 HE1 HIS 5 -7.344 -6.657 -8.235 190 HE2 HIS 5 HE2 HIS 5 -7.736 -7.724 -10.516 191 H LEU 6 H LEU 6 -1.383 -10.206 -7.106 192 HA LEU 6 HA LEU 6 -0.568 -13.030 -7.602 193 HB2 LEU 6 2HB LEU 6 1.281 -10.614 -7.673 194 HB3 LEU 6 3HB LEU 6 1.846 -12.272 -7.527 195 HG LEU 6 HG LEU 6 0.216 -11.251 -9.894 196 HD11 LEU 6 1HD1 LEU 6 3.194 -11.492 -9.508 197 HD12 LEU 6 2HD1 LEU 6 2.400 -11.315 -11.099 198 HD13 LEU 6 3HD1 LEU 6 2.268 -10.024 -9.882 199 HD21 LEU 6 3HD2 LEU 6 0.149 -13.725 -9.595 200 HD22 LEU 6 1HD2 LEU 6 1.099 -13.267 -11.017 201 HD23 LEU 6 2HD2 LEU 6 1.924 -13.756 -9.527 202 H CYS 7 H CYS 7 -0.131 -14.121 -5.781 203 HA CYS 7 HA CYS 7 0.600 -12.751 -3.289 204 HB2 CYS 7 2HB CYS 7 -1.986 -12.679 -3.780 205 HB3 CYS 7 3HB CYS 7 -1.961 -14.350 -3.243 206 H GLY 8 H GLY 8 1.399 -14.160 -1.698 207 HA2 GLY 8 HA2 GLY 8 2.512 -16.035 -0.891 208 HA3 GLY 8 HA3 GLY 8 1.211 -16.969 -1.638 209 H SER 9 H SER 9 2.070 -18.577 -2.763 210 HA SER 9 HA SER 9 4.698 -18.758 -3.812 211 HB2 SER 9 2HB SER 9 3.059 -20.623 -3.330 212 HB3 SER 9 3HB SER 9 2.247 -20.220 -4.854 213 HG SER 9 HG SER 9 3.825 -21.903 -5.089 214 H HIS 10 H HIS 10 1.710 -17.575 -5.444 215 HA HIS 10 HA HIS 10 2.859 -17.314 -8.061 216 HB2 HIS 10 2HB HIS 10 0.351 -16.735 -6.743 217 HB3 HIS 10 3HB HIS 10 0.860 -15.284 -7.580 218 HD2 HIS 10 HD2 HIS 10 -1.179 -18.171 -8.224 219 HE1 HIS 10 HE1 HIS 10 0.476 -17.349 -12.060 220 HE2 HIS 10 HE2 HIS 10 -1.340 -18.628 -10.810 221 H LEU 11 H LEU 11 2.912 -15.203 -5.241 222 HA LEU 11 HA LEU 11 4.077 -12.913 -6.621 223 HB2 LEU 11 2HB LEU 11 2.597 -12.961 -4.502 224 HB3 LEU 11 3HB LEU 11 4.029 -13.488 -3.631 225 HG LEU 11 HG LEU 11 5.167 -11.353 -4.279 226 HD11 LEU 11 1HD1 LEU 11 3.907 -10.794 -6.358 227 HD12 LEU 11 2HD1 LEU 11 2.417 -10.623 -5.399 228 HD13 LEU 11 3HD1 LEU 11 3.763 -9.501 -5.168 229 HD21 LEU 11 3HD2 LEU 11 2.443 -11.061 -2.915 230 HD22 LEU 11 1HD2 LEU 11 3.954 -11.577 -2.129 231 HD23 LEU 11 2HD2 LEU 11 3.792 -9.930 -2.759 232 H VAL 12 H VAL 12 5.352 -15.518 -4.516 233 HA VAL 12 HA VAL 12 8.128 -14.813 -4.684 234 HB VAL 12 HB VAL 12 6.815 -17.548 -4.403 235 HG11 VAL 12 1HG1 VAL 12 9.725 -16.751 -3.956 236 HG12 VAL 12 2HG1 VAL 12 8.997 -18.290 -3.442 237 HG13 VAL 12 3HG1 VAL 12 9.114 -17.911 -5.160 238 HG21 VAL 12 3HG2 VAL 12 8.034 -15.677 -2.328 239 HG22 VAL 12 1HG2 VAL 12 6.302 -15.963 -2.569 240 HG23 VAL 12 2HG2 VAL 12 7.334 -17.283 -2.014 241 H GLU 13 H GLU 13 6.127 -16.852 -6.853 242 HA GLU 13 HA GLU 13 8.134 -17.405 -8.792 243 HB2 GLU 13 2HB GLU 13 5.117 -17.261 -8.862 244 HB3 GLU 13 3HB GLU 13 6.007 -17.304 -10.381 245 HG2 GLU 13 2HG GLU 13 7.213 -19.332 -9.635 246 HG3 GLU 13 3HG GLU 13 6.256 -19.348 -8.145 247 H ALA 14 H ALA 14 5.822 -14.549 -8.740 248 HA ALA 14 HA ALA 14 6.919 -13.358 -11.046 249 HB1 ALA 14 3HB ALA 14 4.823 -12.760 -9.987 250 HB2 ALA 14 1HB ALA 14 5.677 -12.066 -8.580 251 HB3 ALA 14 2HB ALA 14 5.848 -11.316 -10.182 252 H LEU 15 H LEU 15 7.942 -12.849 -7.615 253 HA LEU 15 HA LEU 15 10.032 -11.005 -8.180 254 HB2 LEU 15 2HB LEU 15 9.391 -12.872 -5.904 255 HB3 LEU 15 3HB LEU 15 11.026 -12.258 -6.002 256 HG LEU 15 HG LEU 15 9.752 -10.899 -4.505 257 HD11 LEU 15 1HD1 LEU 15 10.257 -9.232 -7.004 258 HD12 LEU 15 2HD1 LEU 15 10.261 -8.697 -5.321 259 HD13 LEU 15 3HD1 LEU 15 11.521 -9.803 -5.892 260 HD21 LEU 15 3HD2 LEU 15 7.892 -9.426 -5.351 261 HD22 LEU 15 1HD2 LEU 15 7.845 -10.420 -6.818 262 HD23 LEU 15 2HD2 LEU 15 7.502 -11.147 -5.237 263 H TYR 16 H TYR 16 10.083 -14.575 -8.417 264 HA TYR 16 HA TYR 16 12.895 -14.722 -9.022 265 HB2 TYR 16 2HB TYR 16 11.593 -16.723 -8.457 266 HB3 TYR 16 3HB TYR 16 10.641 -16.526 -9.932 267 HD1 TYR 16 HD2 TYR 16 14.133 -17.146 -8.720 268 HD2 TYR 16 HD1 TYR 16 11.412 -17.224 -12.065 269 HE1 TYR 16 HE2 TYR 16 15.882 -18.237 -10.120 270 HE2 TYR 16 HE1 TYR 16 13.144 -18.331 -13.458 271 HH TYR 16 HH TYR 16 15.275 -19.152 -13.544 272 H LEU 17 H LEU 17 10.010 -14.261 -11.143 273 HA LEU 17 HA LEU 17 11.546 -14.299 -13.557 274 HB2 LEU 17 2HB LEU 17 8.873 -12.888 -13.058 275 HB3 LEU 17 3HB LEU 17 9.548 -13.318 -14.622 276 HG LEU 17 HG LEU 17 8.666 -15.288 -12.513 277 HD11 LEU 17 1HD1 LEU 17 6.777 -14.043 -13.470 278 HD12 LEU 17 2HD1 LEU 17 7.321 -14.454 -15.112 279 HD13 LEU 17 3HD1 LEU 17 6.758 -15.729 -14.009 280 HD21 LEU 17 3HD2 LEU 17 8.878 -16.991 -14.310 281 HD22 LEU 17 1HD2 LEU 17 9.531 -15.752 -15.405 282 HD23 LEU 17 2HD2 LEU 17 10.441 -16.243 -13.961 283 H VAL 18 H VAL 18 10.399 -11.527 -11.626 284 HA VAL 18 HA VAL 18 11.635 -9.576 -13.400 285 HB VAL 18 HB VAL 18 11.404 -8.056 -11.270 286 HG11 VAL 18 1HG1 VAL 18 10.098 -7.791 -13.327 287 HG12 VAL 18 2HG1 VAL 18 8.931 -9.001 -12.738 288 HG13 VAL 18 3HG1 VAL 18 9.156 -7.459 -11.866 289 HG21 VAL 18 3HG2 VAL 18 10.033 -8.559 -9.597 290 HG22 VAL 18 1HG2 VAL 18 9.235 -9.873 -10.485 291 HG23 VAL 18 2HG2 VAL 18 10.884 -10.091 -9.836 292 H CYS 19 H CYS 19 12.733 -11.060 -10.313 293 HA CYS 19 HA CYS 19 15.301 -9.505 -10.550 294 HB2 CYS 19 2HB CYS 19 13.576 -8.833 -8.818 295 HB3 CYS 19 3HB CYS 19 13.823 -10.404 -8.058 296 H GLY 20 H GLY 20 13.939 -12.692 -9.635 297 HA2 GLY 20 HA2 GLY 20 16.398 -13.598 -8.376 298 HA3 GLY 20 HA3 GLY 20 14.990 -14.605 -8.762 299 H GLU 21 H GLU 21 14.938 -14.245 -11.559 300 HA GLU 21 HA GLU 21 16.920 -16.024 -12.558 301 HB2 GLU 21 2HB GLU 21 14.652 -15.618 -13.518 302 HB3 GLU 21 3HB GLU 21 15.176 -14.025 -14.066 303 HG2 GLU 21 2HG GLU 21 16.897 -15.077 -15.509 304 HG3 GLU 21 3HG GLU 21 16.472 -16.671 -14.880 305 H ARG 22 H ARG 22 16.688 -12.451 -12.637 306 HA ARG 22 HA ARG 22 19.125 -11.966 -14.071 307 HB2 ARG 22 2HB ARG 22 17.629 -10.155 -12.134 308 HB3 ARG 22 3HB ARG 22 18.904 -9.666 -13.253 309 HG2 ARG 22 2HG ARG 22 17.454 -10.477 -15.169 310 HG3 ARG 22 3HG ARG 22 16.163 -10.766 -13.995 311 HD2 ARG 22 2HD ARG 22 15.725 -8.645 -15.003 312 HD3 ARG 22 3HD ARG 22 16.225 -8.370 -13.338 313 HE ARG 22 HE ARG 22 18.163 -7.339 -14.044 314 HH11 ARG 22 1HH1 ARG 22 16.677 -8.794 -16.907 315 HH12 ARG 22 2HH1 ARG 22 17.731 -7.945 -17.998 316 HH21 ARG 22 1HH2 ARG 22 19.482 -6.268 -15.507 317 HH22 ARG 22 2HH2 ARG 22 19.298 -6.541 -17.213 318 H GLY 23 H GLY 23 18.704 -13.161 -10.911 319 HA2 GLY 23 HA2 GLY 23 21.073 -12.072 -9.624 320 HA3 GLY 23 HA3 GLY 23 20.088 -13.472 -9.113 321 H HIS 24 H HIS 24 20.404 -14.922 -11.607 322 HA HIS 24 HA HIS 24 23.288 -15.720 -11.407 323 HB2 HIS 24 2HB HIS 24 22.670 -17.971 -11.843 324 HB3 HIS 24 3HB HIS 24 21.751 -17.367 -10.472 325 HD2 HIS 24 HD2 HIS 24 19.129 -17.191 -10.718 326 HE1 HIS 24 HE1 HIS 24 18.786 -19.042 -14.540 327 HE2 HIS 24 HE2 HIS 24 17.490 -18.279 -12.486 328 H PHE 25 H PHE 25 20.802 -14.750 -13.700 329 HA PHE 25 HA PHE 25 22.146 -15.549 -16.108 330 HB2 PHE 25 2HB PHE 25 19.770 -14.910 -15.982 331 HB3 PHE 25 3HB PHE 25 20.222 -13.264 -15.556 332 HD1 PHE 25 HD1 PHE 25 20.653 -15.848 -18.255 333 HD2 PHE 25 HD2 PHE 25 20.554 -11.650 -17.267 334 HE1 PHE 25 HE1 PHE 25 20.817 -15.274 -20.663 335 HE2 PHE 25 HE2 PHE 25 20.719 -11.080 -19.672 336 HZ PHE 25 HZ PHE 25 20.850 -12.889 -21.379 337 H TYR 26 H TYR 26 23.379 -14.270 -17.587 338 HA TYR 26 HA TYR 26 25.551 -12.909 -16.328 339 HB2 TYR 26 2HB TYR 26 25.703 -14.303 -18.374 340 HB3 TYR 26 3HB TYR 26 24.832 -13.060 -19.272 341 HD1 TYR 26 HD1 TYR 26 27.832 -13.462 -17.031 342 HD2 TYR 26 HD2 TYR 26 26.128 -11.436 -20.441 343 HE1 TYR 26 HE1 TYR 26 29.982 -12.282 -17.404 344 HE2 TYR 26 HE2 TYR 26 28.300 -10.311 -20.856 345 HH TYR 26 HH TYR 26 30.472 -10.010 -20.148 346 H THR 27 H THR 27 26.315 -10.844 -16.467 347 HA THR 27 HA THR 27 24.507 -8.641 -17.394 348 HB THR 27 HB THR 27 25.425 -7.284 -15.494 349 HG1 THR 27 HG1 THR 27 27.116 -8.729 -14.936 350 HG21 THR 27 1HG2 THR 27 23.722 -9.702 -14.734 351 HG22 THR 27 2HG2 THR 27 23.812 -8.151 -13.873 352 HG23 THR 27 3HG2 THR 27 23.123 -8.217 -15.504 353 HA PRO 28 HA PRO 28 28.365 -8.163 -19.770 354 HB2 PRO 28 2HB PRO 28 26.560 -6.125 -21.074 355 HB3 PRO 28 3HB PRO 28 27.726 -7.249 -21.842 356 HG2 PRO 28 2HG PRO 28 25.091 -7.816 -21.864 357 HG3 PRO 28 3HG PRO 28 26.277 -9.104 -21.464 358 HD2 PRO 28 2HD PRO 28 24.604 -7.432 -19.563 359 HD3 PRO 28 3HD PRO 28 24.888 -9.200 -19.559 360 H LYS 29 H LYS 29 29.784 -6.378 -20.271 361 HA LYS 29 HA LYS 29 30.173 -4.613 -18.028 362 HB2 LYS 29 2HB LYS 29 31.985 -5.706 -19.391 363 HB3 LYS 29 3HB LYS 29 31.555 -4.644 -20.742 364 HG2 LYS 29 2HG LYS 29 32.012 -2.682 -19.187 365 HG3 LYS 29 3HG LYS 29 32.646 -3.825 -18.009 366 HD2 LYS 29 2HD LYS 29 34.443 -4.449 -19.501 367 HD3 LYS 29 3HD LYS 29 33.720 -3.577 -20.862 368 HE2 LYS 29 2HE LYS 29 34.635 -2.238 -18.275 369 HE3 LYS 29 3HE LYS 29 35.650 -2.386 -19.712 370 HZ1 LYS 29 HZ1 LYS 29 34.036 -1.078 -20.945 371 HZ2 LYS 29 HZ2 LYS 29 33.034 -0.950 -19.661 372 HZ3 LYS 29 HZ3 LYS 29 34.508 -0.241 -19.626 373 H THR 30 H THR 30 29.873 -2.454 -17.779 374 HA THR 30 HA THR 30 28.126 -0.949 -19.591 375 HB THR 30 HB THR 30 27.944 -0.856 -17.116 376 HG1 THR 30 HG1 THR 30 28.355 1.485 -18.637 377 HG21 THR 30 1HG2 THR 30 30.407 0.937 -17.220 378 HG22 THR 30 2HG2 THR 30 29.362 0.621 -15.820 379 HG23 THR 30 3HG2 THR 30 30.347 -0.685 -16.496 Start of MODEL 2 1 H1 GLY 1 1H GLY 1 3.107 -3.001 2.088 2 H2 GLY 1 2H GLY 1 4.186 -2.109 1.241 3 H3 GLY 1 3H GLY 1 4.475 -2.464 2.814 4 HA2 GLY 1 HA2 GLY 1 5.854 -3.844 1.415 5 HA3 GLY 1 HA3 GLY 1 4.682 -4.810 2.328 6 H ILE 2 H ILE 2 5.813 -5.890 0.097 7 HA ILE 2 HA ILE 2 4.706 -5.326 -2.418 8 HB ILE 2 HB ILE 2 6.752 -6.570 -2.073 9 HG12 ILE 2 2HG1 ILE 2 6.581 -8.373 -3.669 10 HG13 ILE 2 3HG1 ILE 2 4.826 -8.401 -3.517 11 HG21 ILE 2 1HG2 ILE 2 6.164 -7.914 -0.077 12 HG22 ILE 2 2HG2 ILE 2 5.103 -8.931 -1.081 13 HG23 ILE 2 3HG2 ILE 2 6.849 -8.901 -1.363 14 HD11 ILE 2 3HD1 ILE 2 5.503 -7.347 -5.584 15 HD12 ILE 2 1HD1 ILE 2 4.736 -6.126 -4.556 16 HD13 ILE 2 2HD1 ILE 2 6.509 -6.183 -4.721 17 H VAL 3 H VAL 3 3.351 -7.502 0.021 18 HA VAL 3 HA VAL 3 1.319 -8.643 -1.634 19 HB VAL 3 HB VAL 3 1.335 -8.184 1.374 20 HG11 VAL 3 1HG1 VAL 3 -0.393 -10.133 -0.212 21 HG12 VAL 3 2HG1 VAL 3 -0.324 -9.986 1.551 22 HG13 VAL 3 3HG1 VAL 3 -0.994 -8.662 0.598 23 HG21 VAL 3 3HG2 VAL 3 2.058 -10.646 -0.291 24 HG22 VAL 3 1HG2 VAL 3 3.208 -9.619 0.590 25 HG23 VAL 3 2HG2 VAL 3 2.023 -10.572 1.482 26 H GLU 4 H GLU 4 1.455 -5.540 0.086 27 HA GLU 4 HA GLU 4 -1.342 -4.854 -0.495 28 HB2 GLU 4 2HB GLU 4 -0.096 -4.272 1.609 29 HB3 GLU 4 3HB GLU 4 0.878 -3.137 0.666 30 HG2 GLU 4 2HG GLU 4 -1.114 -1.790 0.186 31 HG3 GLU 4 3HG GLU 4 -2.159 -3.025 0.901 32 H GLN 5 H GLN 5 1.460 -4.930 -2.370 33 HA GLN 5 HA GLN 5 0.517 -2.745 -4.186 34 HB2 GLN 5 2HB GLN 5 2.967 -2.926 -3.574 35 HB3 GLN 5 3HB GLN 5 3.000 -4.496 -4.372 36 HG2 GLN 5 2HG GLN 5 3.854 -2.869 -5.901 37 HG3 GLN 5 3HG GLN 5 2.295 -3.397 -6.517 38 HE21 GLN 5 2HE2 GLN 5 3.847 -0.747 -4.568 39 HE22 GLN 5 1HE2 GLN 5 2.717 0.482 -5.122 40 H CYS 6 H CYS 6 1.303 -6.261 -4.160 41 HA CYS 6 HA CYS 6 0.028 -6.550 -6.829 42 HB2 CYS 6 2HB CYS 6 2.021 -8.129 -5.205 43 HB3 CYS 6 3HB CYS 6 1.339 -8.714 -6.719 44 H CYS 7 H CYS 7 -0.498 -7.910 -3.555 45 HA CYS 7 HA CYS 7 -2.271 -9.975 -4.704 46 HB2 CYS 7 2HB CYS 7 -0.812 -10.425 -2.751 47 HB3 CYS 7 3HB CYS 7 -1.749 -9.264 -1.814 48 H THR 8 H THR 8 -2.700 -6.915 -3.022 49 HA THR 8 HA THR 8 -5.607 -7.140 -2.821 50 HB THR 8 HB THR 8 -4.041 -5.930 -1.235 51 HG1 THR 8 HG1 THR 8 -5.603 -4.342 -0.866 52 HG21 THR 8 1HG2 THR 8 -2.754 -4.706 -3.026 53 HG22 THR 8 2HG2 THR 8 -4.194 -3.708 -3.313 54 HG23 THR 8 3HG2 THR 8 -3.387 -3.663 -1.732 55 H SER 9 H SER 9 -3.460 -6.062 -5.332 56 HA SER 9 HA SER 9 -5.652 -5.162 -7.054 57 HB2 SER 9 2HB SER 9 -4.557 -2.947 -7.448 58 HB3 SER 9 3HB SER 9 -5.314 -3.133 -5.867 59 HG SER 9 HG SER 9 -2.506 -3.492 -6.314 60 H ILE 10 H ILE 10 -4.862 -4.594 -9.280 61 HA ILE 10 HA ILE 10 -2.889 -6.434 -10.315 62 HB ILE 10 HB ILE 10 -3.960 -3.854 -11.532 63 HG12 ILE 10 2HG1 ILE 10 -5.813 -5.440 -11.042 64 HG13 ILE 10 3HG1 ILE 10 -5.610 -5.033 -12.734 65 HG21 ILE 10 1HG2 ILE 10 -3.313 -4.957 -13.727 66 HG22 ILE 10 2HG2 ILE 10 -1.935 -4.525 -12.716 67 HG23 ILE 10 3HG2 ILE 10 -2.485 -6.210 -12.778 68 HD11 ILE 10 3HD1 ILE 10 -6.133 -7.431 -12.366 69 HD12 ILE 10 1HD1 ILE 10 -4.611 -7.192 -13.228 70 HD13 ILE 10 2HD1 ILE 10 -4.594 -7.613 -11.495 71 H CYS 11 H CYS 11 -0.698 -6.268 -10.359 72 HA CYS 11 HA CYS 11 0.524 -3.545 -10.103 73 HB2 CYS 11 2HB CYS 11 2.310 -4.395 -8.844 74 HB3 CYS 11 3HB CYS 11 0.826 -4.930 -8.075 75 H SER 12 H SER 12 2.498 -3.174 -11.112 76 HA SER 12 HA SER 12 2.948 -4.735 -13.631 77 HB2 SER 12 2HB SER 12 3.806 -1.914 -12.909 78 HB3 SER 12 3HB SER 12 3.988 -2.724 -14.473 79 HG SER 12 HG SER 12 2.119 -1.291 -14.288 80 H LEU 13 H LEU 13 5.046 -5.172 -14.381 81 HA LEU 13 HA LEU 13 6.694 -6.431 -12.466 82 HB2 LEU 13 2HB LEU 13 8.213 -6.778 -14.290 83 HB3 LEU 13 3HB LEU 13 6.577 -7.198 -14.735 84 HG LEU 13 HG LEU 13 7.946 -4.613 -15.598 85 HD11 LEU 13 1HD1 LEU 13 8.422 -5.758 -17.731 86 HD12 LEU 13 2HD1 LEU 13 9.227 -6.571 -16.382 87 HD13 LEU 13 3HD1 LEU 13 7.748 -7.269 -17.078 88 HD21 LEU 13 3HD2 LEU 13 5.548 -4.405 -15.930 89 HD22 LEU 13 1HD2 LEU 13 6.310 -4.677 -17.487 90 HD23 LEU 13 2HD2 LEU 13 5.476 -6.018 -16.685 91 H TYR 14 H TYR 14 7.000 -3.294 -14.009 92 HA TYR 14 HA TYR 14 9.658 -2.757 -13.187 93 HB2 TYR 14 2HB TYR 14 9.207 -0.517 -14.027 94 HB3 TYR 14 3HB TYR 14 8.584 -1.774 -15.110 95 HD1 TYR 14 HD1 TYR 14 7.470 0.660 -12.449 96 HD2 TYR 14 HD2 TYR 14 6.402 -1.649 -15.936 97 HE1 TYR 14 HE1 TYR 14 5.251 1.762 -12.493 98 HE2 TYR 14 HE2 TYR 14 4.199 -0.504 -16.014 99 HH TYR 14 HH TYR 14 3.225 1.948 -13.580 100 H GLN 15 H GLN 15 6.858 -2.719 -11.311 101 HA GLN 15 HA GLN 15 8.048 -0.803 -9.319 102 HB2 GLN 15 2HB GLN 15 5.767 -0.475 -8.430 103 HB3 GLN 15 3HB GLN 15 5.964 0.134 -10.079 104 HG2 GLN 15 2HG GLN 15 4.820 -1.775 -11.000 105 HG3 GLN 15 3HG GLN 15 4.725 -2.567 -9.414 106 HE21 GLN 15 2HE2 GLN 15 3.974 0.801 -9.042 107 HE22 GLN 15 1HE2 GLN 15 2.237 0.558 -9.102 108 H LEU 16 H LEU 16 6.720 -4.065 -9.893 109 HA LEU 16 HA LEU 16 6.862 -4.784 -7.111 110 HB2 LEU 16 2HB LEU 16 5.758 -6.594 -7.748 111 HB3 LEU 16 3HB LEU 16 5.513 -5.703 -9.223 112 HG LEU 16 HG LEU 16 7.704 -6.876 -10.027 113 HD11 LEU 16 1HD1 LEU 16 6.875 -8.550 -7.629 114 HD12 LEU 16 2HD1 LEU 16 7.700 -9.298 -8.997 115 HD13 LEU 16 3HD1 LEU 16 8.502 -8.013 -8.106 116 HD21 LEU 16 3HD2 LEU 16 5.140 -8.520 -9.635 117 HD22 LEU 16 1HD2 LEU 16 5.368 -7.302 -10.909 118 HD23 LEU 16 2HD2 LEU 16 6.368 -8.766 -10.894 119 H GLU 17 H GLU 17 9.196 -4.882 -9.777 120 HA GLU 17 HA GLU 17 11.314 -6.397 -8.660 121 HB2 GLU 17 2HB GLU 17 11.328 -3.845 -10.342 122 HB3 GLU 17 3HB GLU 17 12.822 -4.573 -9.754 123 HG2 GLU 17 2HG GLU 17 12.109 -6.738 -10.842 124 HG3 GLU 17 3HG GLU 17 10.855 -5.784 -11.659 125 H ASN 18 H ASN 18 10.212 -3.168 -7.904 126 HA ASN 18 HA ASN 18 12.550 -2.275 -6.481 127 HB2 ASN 18 2HB ASN 18 9.749 -1.288 -6.854 128 HB3 ASN 18 3HB ASN 18 10.608 -0.690 -5.474 129 HD21 ASN 18 2HD2 ASN 18 10.667 -0.871 -9.062 130 HD22 ASN 18 1HD2 ASN 18 11.776 0.466 -9.243 131 H TYR 19 H TYR 19 10.153 -4.534 -5.493 132 HA TYR 19 HA TYR 19 10.686 -4.199 -2.598 133 HB2 TYR 19 2HB TYR 19 8.896 -6.088 -4.166 134 HB3 TYR 19 3HB TYR 19 9.012 -6.010 -2.415 135 HD1 TYR 19 HD1 TYR 19 7.939 -4.088 -5.451 136 HD2 TYR 19 HD2 TYR 19 7.939 -4.288 -1.136 137 HE1 TYR 19 HE1 TYR 19 6.258 -2.261 -5.356 138 HE2 TYR 19 HE2 TYR 19 6.251 -2.464 -1.050 139 HH TYR 19 HH TYR 19 4.971 -0.991 -2.256 140 H CYS 20 H CYS 20 12.238 -5.751 -5.175 141 HA CYS 20 HA CYS 20 13.203 -8.137 -3.782 142 HB2 CYS 20 2HB CYS 20 13.050 -7.738 -6.299 143 HB3 CYS 20 3HB CYS 20 14.417 -6.640 -6.132 144 H ASN 21 H ASN 21 14.146 -4.768 -3.922 145 HA ASN 21 HA ASN 21 16.866 -4.975 -3.011 146 HB2 ASN 21 2HB ASN 21 14.860 -2.666 -2.926 147 HB3 ASN 21 3HB ASN 21 16.582 -2.516 -2.599 148 HD21 ASN 21 1HD2 ASN 21 18.078 -3.282 -4.432 149 HD22 ASN 21 2HD2 ASN 21 17.532 -2.895 -6.057 150 H1 PHE 1 1H PHE 1 5.459 -12.175 -19.323 151 H2 PHE 1 2H PHE 1 6.803 -11.514 -18.658 152 H3 PHE 1 3H PHE 1 5.804 -10.598 -19.582 153 HA PHE 1 HA PHE 1 5.100 -11.801 -16.993 154 HB2 PHE 1 2HB PHE 1 6.722 -9.920 -16.800 155 HB3 PHE 1 3HB PHE 1 5.615 -8.875 -17.675 156 HD1 PHE 1 HD1 PHE 1 6.046 -10.869 -14.530 157 HD2 PHE 1 HD2 PHE 1 3.820 -7.739 -16.511 158 HE1 PHE 1 HE1 PHE 1 4.976 -10.254 -12.378 159 HE2 PHE 1 HE2 PHE 1 2.803 -7.102 -14.345 160 HZ PHE 1 HZ PHE 1 3.363 -8.362 -12.279 161 H VAL 2 H VAL 2 2.994 -11.141 -16.159 162 HA VAL 2 HA VAL 2 1.109 -9.853 -18.070 163 HB VAL 2 HB VAL 2 0.456 -12.375 -16.477 164 HG11 VAL 2 1HG1 VAL 2 -1.353 -10.605 -18.189 165 HG12 VAL 2 2HG1 VAL 2 -1.804 -12.192 -17.529 166 HG13 VAL 2 3HG1 VAL 2 -1.478 -10.852 -16.433 167 HG21 VAL 2 3HG2 VAL 2 1.635 -12.918 -18.560 168 HG22 VAL 2 1HG2 VAL 2 -0.066 -13.366 -18.690 169 HG23 VAL 2 2HG2 VAL 2 0.518 -11.889 -19.486 170 H ASN 3 H ASN 3 0.419 -8.070 -17.082 171 HA ASN 3 HA ASN 3 0.596 -7.493 -14.307 172 HB2 ASN 3 2HB ASN 3 -1.310 -6.301 -16.375 173 HB3 ASN 3 3HB ASN 3 -0.823 -5.589 -14.832 174 HD21 ASN 3 2HD2 ASN 3 0.844 -4.222 -14.782 175 HD22 ASN 3 1HD2 ASN 3 1.888 -3.983 -16.150 176 H GLN 4 H GLN 4 -0.474 -8.507 -12.696 177 HA GLN 4 HA GLN 4 -3.342 -9.113 -12.873 178 HB2 GLN 4 2HB GLN 4 -3.131 -11.489 -12.636 179 HB3 GLN 4 3HB GLN 4 -2.223 -11.006 -14.053 180 HG2 GLN 4 2HG GLN 4 -0.137 -10.981 -12.464 181 HG3 GLN 4 3HG GLN 4 -1.167 -11.833 -11.322 182 HE21 GLN 4 2HE2 GLN 4 0.942 -12.195 -13.981 183 HE22 GLN 4 1HE2 GLN 4 0.631 -13.907 -14.252 184 H HIS 5 H HIS 5 -3.883 -10.502 -10.863 185 HA HIS 5 HA HIS 5 -2.774 -9.234 -8.423 186 HB2 HIS 5 2HB HIS 5 -5.033 -11.239 -8.788 187 HB3 HIS 5 3HB HIS 5 -4.546 -10.497 -7.266 188 HD2 HIS 5 HD2 HIS 5 -6.166 -9.567 -10.659 189 HE1 HIS 5 HE1 HIS 5 -7.137 -6.467 -7.904 190 HE2 HIS 5 HE2 HIS 5 -7.590 -7.391 -10.237 191 H LEU 6 H LEU 6 -1.191 -10.176 -7.283 192 HA LEU 6 HA LEU 6 -0.527 -13.085 -7.642 193 HB2 LEU 6 2HB LEU 6 1.323 -10.692 -7.454 194 HB3 LEU 6 3HB LEU 6 1.853 -12.367 -7.372 195 HG LEU 6 HG LEU 6 0.469 -11.097 -9.778 196 HD11 LEU 6 1HD1 LEU 6 2.784 -11.217 -10.770 197 HD12 LEU 6 2HD1 LEU 6 2.625 -10.056 -9.435 198 HD13 LEU 6 3HD1 LEU 6 3.385 -11.632 -9.145 199 HD21 LEU 6 3HD2 LEU 6 0.150 -13.549 -9.718 200 HD22 LEU 6 1HD2 LEU 6 1.325 -13.120 -10.966 201 HD23 LEU 6 2HD2 LEU 6 1.886 -13.783 -9.417 202 H CYS 7 H CYS 7 -0.553 -14.203 -5.850 203 HA CYS 7 HA CYS 7 -0.107 -12.937 -3.180 204 HB2 CYS 7 2HB CYS 7 -2.400 -14.778 -3.958 205 HB3 CYS 7 3HB CYS 7 -2.088 -14.171 -2.341 206 H GLY 8 H GLY 8 0.667 -14.422 -1.592 207 HA2 GLY 8 HA2 GLY 8 1.770 -16.291 -0.762 208 HA3 GLY 8 HA3 GLY 8 0.653 -17.222 -1.768 209 H SER 9 H SER 9 1.860 -18.744 -2.718 210 HA SER 9 HA SER 9 4.559 -18.667 -3.486 211 HB2 SER 9 2HB SER 9 2.308 -20.192 -4.849 212 HB3 SER 9 3HB SER 9 4.036 -20.585 -4.890 213 HG SER 9 HG SER 9 2.895 -21.844 -3.321 214 H HIS 10 H HIS 10 1.704 -17.682 -5.456 215 HA HIS 10 HA HIS 10 3.027 -17.421 -7.938 216 HB2 HIS 10 2HB HIS 10 0.433 -16.891 -6.873 217 HB3 HIS 10 3HB HIS 10 0.959 -15.378 -7.557 218 HD2 HIS 10 HD2 HIS 10 -0.912 -18.268 -8.574 219 HE1 HIS 10 HE1 HIS 10 1.045 -17.146 -12.183 220 HE2 HIS 10 HE2 HIS 10 -0.834 -18.550 -11.189 221 H LEU 11 H LEU 11 2.808 -15.172 -5.252 222 HA LEU 11 HA LEU 11 3.993 -12.903 -6.583 223 HB2 LEU 11 2HB LEU 11 2.432 -13.005 -4.530 224 HB3 LEU 11 3HB LEU 11 3.827 -13.527 -3.602 225 HG LEU 11 HG LEU 11 4.985 -11.400 -4.072 226 HD11 LEU 11 1HD1 LEU 11 2.392 -10.595 -5.463 227 HD12 LEU 11 2HD1 LEU 11 3.745 -9.516 -5.102 228 HD13 LEU 11 3HD1 LEU 11 3.964 -10.808 -6.274 229 HD21 LEU 11 3HD2 LEU 11 3.465 -9.978 -2.686 230 HD22 LEU 11 1HD2 LEU 11 2.134 -11.098 -3.001 231 HD23 LEU 11 2HD2 LEU 11 3.553 -11.637 -2.071 232 H VAL 12 H VAL 12 5.310 -15.697 -4.962 233 HA VAL 12 HA VAL 12 8.008 -14.516 -4.547 234 HB VAL 12 HB VAL 12 6.933 -17.324 -4.038 235 HG11 VAL 12 1HG1 VAL 12 9.650 -16.119 -3.359 236 HG12 VAL 12 2HG1 VAL 12 9.033 -17.666 -2.735 237 HG13 VAL 12 3HG1 VAL 12 9.335 -17.479 -4.464 238 HG21 VAL 12 3HG2 VAL 12 5.993 -15.623 -2.508 239 HG22 VAL 12 1HG2 VAL 12 7.102 -16.699 -1.654 240 HG23 VAL 12 2HG2 VAL 12 7.630 -15.063 -2.112 241 H GLU 13 H GLU 13 6.305 -16.855 -6.618 242 HA GLU 13 HA GLU 13 8.293 -17.561 -8.473 243 HB2 GLU 13 3HB GLU 13 5.387 -17.553 -8.177 244 HB3 GLU 13 2HB GLU 13 5.750 -16.930 -9.707 245 HG2 GLU 13 2HG GLU 13 7.201 -18.957 -10.171 246 HG3 GLU 13 3HG GLU 13 6.802 -19.546 -8.549 247 H ALA 14 H ALA 14 6.033 -14.685 -8.510 248 HA ALA 14 HA ALA 14 7.109 -13.499 -10.799 249 HB1 ALA 14 3HB ALA 14 5.945 -11.512 -9.998 250 HB2 ALA 14 1HB ALA 14 4.986 -12.990 -9.712 251 HB3 ALA 14 2HB ALA 14 5.837 -12.203 -8.361 252 H LEU 15 H LEU 15 8.048 -12.758 -7.351 253 HA LEU 15 HA LEU 15 10.107 -10.953 -8.052 254 HB2 LEU 15 2HB LEU 15 9.555 -12.695 -5.642 255 HB3 LEU 15 3HB LEU 15 11.164 -12.026 -5.804 256 HG LEU 15 HG LEU 15 9.906 -10.605 -4.383 257 HD11 LEU 15 1HD1 LEU 15 10.203 -9.132 -7.036 258 HD12 LEU 15 2HD1 LEU 15 10.242 -8.450 -5.404 259 HD13 LEU 15 3HD1 LEU 15 11.535 -9.538 -5.934 260 HD21 LEU 15 3HD2 LEU 15 7.845 -10.452 -6.605 261 HD22 LEU 15 1HD2 LEU 15 7.648 -11.026 -4.938 262 HD23 LEU 15 2HD2 LEU 15 7.920 -9.305 -5.254 263 H TYR 16 H TYR 16 10.308 -14.523 -7.991 264 HA TYR 16 HA TYR 16 13.134 -14.566 -8.622 265 HB2 TYR 16 2HB TYR 16 11.907 -16.551 -7.789 266 HB3 TYR 16 3HB TYR 16 10.975 -16.606 -9.284 267 HD1 TYR 16 HD1 TYR 16 14.412 -16.906 -7.860 268 HD2 TYR 16 HD2 TYR 16 11.939 -17.460 -11.350 269 HE1 TYR 16 HE1 TYR 16 16.304 -18.027 -9.019 270 HE2 TYR 16 HE2 TYR 16 13.833 -18.567 -12.521 271 HH TYR 16 HH TYR 16 17.023 -19.055 -10.933 272 H LEU 17 H LEU 17 10.202 -14.585 -10.697 273 HA LEU 17 HA LEU 17 11.600 -14.790 -13.182 274 HB2 LEU 17 2HB LEU 17 8.836 -13.689 -12.480 275 HB3 LEU 17 3HB LEU 17 9.375 -13.985 -14.124 276 HG LEU 17 HG LEU 17 9.413 -16.188 -12.061 277 HD11 LEU 17 1HD1 LEU 17 7.204 -16.949 -12.830 278 HD12 LEU 17 2HD1 LEU 17 7.103 -15.379 -12.051 279 HD13 LEU 17 3HD1 LEU 17 7.042 -15.481 -13.828 280 HD21 LEU 17 3HD2 LEU 17 9.249 -17.665 -14.024 281 HD22 LEU 17 1HD2 LEU 17 9.202 -16.248 -15.095 282 HD23 LEU 17 2HD2 LEU 17 10.660 -16.606 -14.143 283 H VAL 18 H VAL 18 10.440 -11.876 -11.455 284 HA VAL 18 HA VAL 18 11.457 -10.138 -13.576 285 HB VAL 18 HB VAL 18 11.038 -8.675 -11.069 286 HG11 VAL 18 1HG1 VAL 18 9.584 -7.328 -12.449 287 HG12 VAL 18 2HG1 VAL 18 11.109 -7.635 -13.292 288 HG13 VAL 18 3HG1 VAL 18 9.645 -8.540 -13.757 289 HG21 VAL 18 3HG2 VAL 18 8.788 -10.471 -11.886 290 HG22 VAL 18 1HG2 VAL 18 9.514 -10.068 -10.278 291 HG23 VAL 18 2HG2 VAL 18 8.558 -8.874 -11.138 292 H CYS 19 H CYS 19 12.623 -10.976 -10.264 293 HA CYS 19 HA CYS 19 14.876 -9.092 -10.645 294 HB2 CYS 19 2HB CYS 19 13.374 -9.010 -8.642 295 HB3 CYS 19 3HB CYS 19 14.009 -10.583 -8.158 296 H GLY 20 H GLY 20 14.337 -12.562 -9.940 297 HA2 GLY 20 HA2 GLY 20 17.161 -13.042 -9.305 298 HA3 GLY 20 HA3 GLY 20 15.826 -14.216 -9.271 299 H GLU 21 H GLU 21 14.919 -14.244 -11.823 300 HA GLU 21 HA GLU 21 16.709 -16.009 -13.082 301 HB2 GLU 21 2HB GLU 21 14.208 -15.922 -13.308 302 HB3 GLU 21 3HB GLU 21 14.385 -14.524 -14.377 303 HG2 GLU 21 2HG GLU 21 15.671 -15.901 -15.978 304 HG3 GLU 21 3HG GLU 21 15.631 -17.266 -14.861 305 H ARG 22 H ARG 22 16.187 -12.530 -13.674 306 HA ARG 22 HA ARG 22 17.749 -12.283 -16.031 307 HB2 ARG 22 2HB ARG 22 17.299 -10.166 -13.892 308 HB3 ARG 22 3HB ARG 22 17.813 -9.911 -15.566 309 HG2 ARG 22 2HG ARG 22 15.593 -11.108 -16.222 310 HG3 ARG 22 3HG ARG 22 15.097 -10.808 -14.557 311 HD2 ARG 22 2HD ARG 22 15.870 -8.736 -16.657 312 HD3 ARG 22 3HD ARG 22 14.258 -9.069 -16.049 313 HE ARG 22 HE ARG 22 14.787 -8.065 -13.956 314 HH11 ARG 22 2HH2 ARG 22 17.485 -7.653 -16.232 315 HH12 ARG 22 1HH2 ARG 22 18.118 -6.295 -15.353 316 HH21 ARG 22 1HH1 ARG 22 15.536 -6.199 -13.028 317 HH22 ARG 22 2HH1 ARG 22 17.068 -5.522 -13.524 318 H GLY 23 H GLY 23 18.878 -13.092 -12.938 319 HA2 GLY 23 HA2 GLY 23 21.569 -12.001 -13.044 320 HA3 GLY 23 HA3 GLY 23 20.962 -13.355 -12.047 321 H HIS 24 H HIS 24 19.999 -14.758 -14.496 322 HA HIS 24 HA HIS 24 22.610 -15.586 -15.710 323 HB2 HIS 24 2HB HIS 24 22.031 -17.891 -15.543 324 HB3 HIS 24 3HB HIS 24 21.970 -17.153 -13.949 325 HD2 HIS 24 HD2 HIS 24 19.617 -17.021 -12.733 326 HE1 HIS 24 HE1 HIS 24 17.414 -19.362 -15.530 327 HE2 HIS 24 HE2 HIS 24 17.374 -18.343 -13.195 328 H PHE 25 H PHE 25 19.176 -15.007 -16.362 329 HA PHE 25 HA PHE 25 19.759 -14.985 -19.241 330 HB2 PHE 25 2HB PHE 25 19.261 -17.367 -18.836 331 HB3 PHE 25 3HB PHE 25 17.742 -16.932 -18.063 332 HD1 PHE 25 HD2 PHE 25 19.628 -16.689 -21.300 333 HD2 PHE 25 HD1 PHE 25 15.765 -16.622 -19.381 334 HE1 PHE 25 HE2 PHE 25 18.523 -16.670 -23.521 335 HE2 PHE 25 HE1 PHE 25 14.663 -16.615 -21.606 336 HZ PHE 25 HZ PHE 25 16.038 -16.637 -23.679 337 H TYR 26 H TYR 26 18.704 -13.378 -20.205 338 HA TYR 26 HA TYR 26 15.946 -12.671 -19.473 339 HB2 TYR 26 2HB TYR 26 17.371 -11.251 -18.061 340 HB3 TYR 26 3HB TYR 26 18.311 -10.762 -19.468 341 HD1 TYR 26 HD1 TYR 26 14.665 -10.988 -18.555 342 HD2 TYR 26 HD2 TYR 26 17.842 -8.618 -20.222 343 HE1 TYR 26 HE1 TYR 26 13.048 -9.144 -18.977 344 HE2 TYR 26 HE2 TYR 26 16.244 -6.733 -20.602 345 HH TYR 26 HH TYR 26 14.064 -6.009 -20.422 346 H THR 27 H THR 27 14.855 -11.532 -21.094 347 HA THR 27 HA THR 27 16.031 -11.586 -23.852 348 HB THR 27 HB THR 27 13.659 -11.890 -24.602 349 HG1 THR 27 HG1 THR 27 12.655 -11.298 -22.648 350 HG21 THR 27 1HG2 THR 27 14.811 -14.100 -22.838 351 HG22 THR 27 2HG2 THR 27 13.638 -14.299 -24.155 352 HG23 THR 27 3HG2 THR 27 15.287 -13.763 -24.517 353 HA PRO 28 HA PRO 28 15.093 -7.163 -22.997 354 HB2 PRO 28 2HB PRO 28 17.163 -6.028 -24.351 355 HB3 PRO 28 3HB PRO 28 17.376 -6.778 -22.741 356 HG2 PRO 28 2HG PRO 28 17.902 -8.035 -25.455 357 HG3 PRO 28 3HG PRO 28 18.991 -7.984 -24.032 358 HD2 PRO 28 2HD PRO 28 17.418 -10.135 -24.570 359 HD3 PRO 28 3HD PRO 28 17.722 -9.608 -22.886 360 H LYS 29 H LYS 29 14.545 -5.374 -24.457 361 HA LYS 29 HA LYS 29 13.131 -6.334 -26.817 362 HB2 LYS 29 2HB LYS 29 12.341 -4.736 -24.906 363 HB3 LYS 29 3HB LYS 29 13.202 -3.475 -25.795 364 HG2 LYS 29 2HG LYS 29 11.748 -3.942 -27.783 365 HG3 LYS 29 3HG LYS 29 10.950 -5.241 -26.881 366 HD2 LYS 29 2HD LYS 29 10.192 -3.590 -25.189 367 HD3 LYS 29 3HD LYS 29 10.962 -2.284 -26.097 368 HE2 LYS 29 2HE LYS 29 8.746 -4.102 -27.168 369 HE3 LYS 29 3HE LYS 29 8.473 -2.513 -26.448 370 HZ1 LYS 29 HZ1 LYS 29 8.560 -2.356 -28.847 371 HZ2 LYS 29 HZ2 LYS 29 9.823 -1.537 -28.219 372 HZ3 LYS 29 HZ3 LYS 29 10.055 -3.004 -28.908 373 H THR 30 H THR 30 16.123 -6.025 -26.810 374 HA THR 30 HA THR 30 17.044 -3.976 -28.555 375 HB THR 30 HB THR 30 18.212 -6.762 -28.205 376 HG1 THR 30 HG1 THR 30 19.382 -5.736 -26.530 377 HG21 THR 30 1HG2 THR 30 20.373 -5.591 -28.601 378 HG22 THR 30 2HG2 THR 30 19.312 -5.476 -30.008 379 HG23 THR 30 3HG2 THR 30 19.492 -4.079 -28.924 Start of MODEL 3 1 H1 GLY 1 1H GLY 1 4.265 -2.192 1.244 2 H2 GLY 1 2H GLY 1 4.765 -2.572 2.759 3 H3 GLY 1 3H GLY 1 3.336 -3.142 2.206 4 HA2 GLY 1 HA2 GLY 1 6.025 -3.878 1.228 5 HA3 GLY 1 HA3 GLY 1 4.937 -4.916 2.164 6 H ILE 2 H ILE 2 5.907 -5.893 -0.158 7 HA ILE 2 HA ILE 2 4.673 -5.280 -2.584 8 HB ILE 2 HB ILE 2 6.716 -6.572 -2.344 9 HG12 ILE 2 2HG1 ILE 2 6.401 -8.361 -3.966 10 HG13 ILE 2 3HG1 ILE 2 4.651 -8.268 -3.768 11 HG21 ILE 2 1HG2 ILE 2 5.063 -8.917 -1.329 12 HG22 ILE 2 2HG2 ILE 2 6.792 -8.920 -1.694 13 HG23 ILE 2 3HG2 ILE 2 6.191 -7.947 -0.356 14 HD11 ILE 2 3HD1 ILE 2 5.392 -7.196 -5.807 15 HD12 ILE 2 1HD1 ILE 2 4.700 -5.965 -4.739 16 HD13 ILE 2 2HD1 ILE 2 6.469 -6.126 -4.916 17 H VAL 3 H VAL 3 3.424 -7.459 -0.108 18 HA VAL 3 HA VAL 3 1.295 -8.582 -1.644 19 HB VAL 3 HB VAL 3 1.432 -8.097 1.359 20 HG11 VAL 3 1HG1 VAL 3 -0.291 -10.105 -0.160 21 HG12 VAL 3 2HG1 VAL 3 -0.178 -9.940 1.600 22 HG13 VAL 3 3HG1 VAL 3 -0.904 -8.641 0.653 23 HG21 VAL 3 3HG2 VAL 3 3.317 -9.499 0.554 24 HG22 VAL 3 1HG2 VAL 3 2.175 -10.467 1.483 25 HG23 VAL 3 2HG2 VAL 3 2.171 -10.564 -0.288 26 H GLU 4 H GLU 4 1.582 -5.479 0.015 27 HA GLU 4 HA GLU 4 -1.233 -4.725 -0.354 28 HB2 GLU 4 2HB GLU 4 1.160 -3.093 0.552 29 HB3 GLU 4 3HB GLU 4 -0.528 -2.596 0.634 30 HG2 GLU 4 2HG GLU 4 -1.046 -4.313 2.268 31 HG3 GLU 4 3HG GLU 4 0.573 -5.008 2.140 32 H GLN 5 H GLN 5 1.225 -5.086 -2.549 33 HA GLN 5 HA GLN 5 -0.030 -3.038 -4.351 34 HB2 GLN 5 2HB GLN 5 2.707 -4.385 -4.464 35 HB3 GLN 5 3HB GLN 5 2.009 -3.424 -5.774 36 HG2 GLN 5 2HG GLN 5 2.651 -2.408 -2.966 37 HG3 GLN 5 3HG GLN 5 3.624 -2.177 -4.414 38 HE21 GLN 5 2HE2 GLN 5 0.416 -1.292 -2.959 39 HE22 GLN 5 1HE2 GLN 5 0.286 0.173 -3.926 40 H CYS 6 H CYS 6 1.459 -6.330 -4.536 41 HA CYS 6 HA CYS 6 -0.069 -6.832 -6.972 42 HB2 CYS 6 2HB CYS 6 1.825 -8.493 -5.299 43 HB3 CYS 6 3HB CYS 6 1.152 -9.012 -6.842 44 H CYS 7 H CYS 7 -0.438 -8.047 -3.621 45 HA CYS 7 HA CYS 7 -2.355 -10.069 -4.551 46 HB2 CYS 7 2HB CYS 7 -0.787 -10.384 -2.632 47 HB3 CYS 7 3HB CYS 7 -1.752 -9.217 -1.720 48 H THR 8 H THR 8 -2.605 -6.810 -3.357 49 HA THR 8 HA THR 8 -5.518 -6.938 -2.964 50 HB THR 8 HB THR 8 -3.998 -5.612 -1.514 51 HG1 THR 8 HG1 THR 8 -5.460 -3.894 -1.427 52 HG21 THR 8 1HG2 THR 8 -2.502 -4.676 -3.267 53 HG22 THR 8 2HG2 THR 8 -3.844 -3.674 -3.860 54 HG23 THR 8 3HG2 THR 8 -3.212 -3.430 -2.222 55 H SER 9 H SER 9 -3.298 -5.765 -5.493 56 HA SER 9 HA SER 9 -5.592 -5.207 -7.302 57 HB2 SER 9 2HB SER 9 -3.379 -3.278 -6.546 58 HB3 SER 9 3HB SER 9 -4.454 -3.079 -7.945 59 HG SER 9 HG SER 9 -5.204 -1.907 -6.116 60 H ILE 10 H ILE 10 -4.717 -4.622 -9.588 61 HA ILE 10 HA ILE 10 -2.712 -6.500 -10.553 62 HB ILE 10 HB ILE 10 -3.698 -3.908 -11.824 63 HG12 ILE 10 2HG1 ILE 10 -5.602 -5.463 -11.441 64 HG13 ILE 10 3HG1 ILE 10 -5.287 -5.082 -13.121 65 HG21 ILE 10 1HG2 ILE 10 -2.932 -5.025 -13.969 66 HG22 ILE 10 2HG2 ILE 10 -1.615 -4.617 -12.872 67 HG23 ILE 10 3HG2 ILE 10 -2.191 -6.294 -12.971 68 HD11 ILE 10 3HD1 ILE 10 -4.292 -7.261 -13.524 69 HD12 ILE 10 1HD1 ILE 10 -4.379 -7.657 -11.788 70 HD13 ILE 10 2HD1 ILE 10 -5.864 -7.471 -12.746 71 H CYS 11 H CYS 11 -0.541 -6.337 -10.296 72 HA CYS 11 HA CYS 11 0.660 -3.620 -9.891 73 HB2 CYS 11 2HB CYS 11 2.459 -4.641 -8.722 74 HB3 CYS 11 3HB CYS 11 0.941 -5.132 -7.984 75 H SER 12 H SER 12 2.397 -2.982 -11.069 76 HA SER 12 HA SER 12 2.979 -4.492 -13.571 77 HB2 SER 12 2HB SER 12 3.731 -1.665 -12.779 78 HB3 SER 12 3HB SER 12 4.017 -2.442 -14.345 79 HG SER 12 HG SER 12 2.075 -1.108 -14.242 80 H LEU 13 H LEU 13 5.099 -4.886 -14.326 81 HA LEU 13 HA LEU 13 6.747 -6.164 -12.424 82 HB2 LEU 13 2HB LEU 13 8.319 -6.416 -14.245 83 HB3 LEU 13 3HB LEU 13 6.704 -6.923 -14.683 84 HG LEU 13 HG LEU 13 7.930 -4.270 -15.559 85 HD11 LEU 13 1HD1 LEU 13 8.434 -5.400 -17.694 86 HD12 LEU 13 2HD1 LEU 13 9.293 -6.170 -16.355 87 HD13 LEU 13 3HD1 LEU 13 7.840 -6.939 -17.031 88 HD21 LEU 13 3HD2 LEU 13 6.262 -4.471 -17.442 89 HD22 LEU 13 1HD2 LEU 13 5.501 -5.813 -16.566 90 HD23 LEU 13 2HD2 LEU 13 5.528 -4.167 -15.879 91 H TYR 14 H TYR 14 7.075 -2.996 -13.954 92 HA TYR 14 HA TYR 14 9.629 -2.391 -12.963 93 HB2 TYR 14 2HB TYR 14 9.146 -0.143 -13.719 94 HB3 TYR 14 3HB TYR 14 8.559 -1.357 -14.874 95 HD1 TYR 14 HD2 TYR 14 7.384 0.944 -12.122 96 HD2 TYR 14 HD1 TYR 14 6.376 -1.225 -15.715 97 HE1 TYR 14 HE2 TYR 14 5.158 2.042 -12.160 98 HE2 TYR 14 HE1 TYR 14 4.174 -0.084 -15.786 99 HH TYR 14 HH TYR 14 2.763 1.427 -14.763 100 H GLN 15 H GLN 15 6.798 -2.573 -11.119 101 HA GLN 15 HA GLN 15 7.882 -0.674 -9.055 102 HB2 GLN 15 2HB GLN 15 5.574 -0.387 -8.222 103 HB3 GLN 15 3HB GLN 15 5.838 0.284 -9.836 104 HG2 GLN 15 2HG GLN 15 4.727 -1.595 -10.869 105 HG3 GLN 15 3HG GLN 15 4.543 -2.422 -9.309 106 HE21 GLN 15 2HE2 GLN 15 3.841 1.016 -9.101 107 HE22 GLN 15 1HE2 GLN 15 2.102 0.795 -9.191 108 H LEU 16 H LEU 16 6.460 -3.888 -9.727 109 HA LEU 16 HA LEU 16 6.697 -4.826 -7.030 110 HB2 LEU 16 2HB LEU 16 5.562 -6.521 -7.906 111 HB3 LEU 16 3HB LEU 16 5.550 -5.674 -9.405 112 HG LEU 16 HG LEU 16 7.803 -6.858 -9.904 113 HD11 LEU 16 1HD1 LEU 16 6.742 -8.407 -7.505 114 HD12 LEU 16 2HD1 LEU 16 7.714 -9.219 -8.731 115 HD13 LEU 16 3HD1 LEU 16 8.401 -7.863 -7.844 116 HD21 LEU 16 3HD2 LEU 16 5.302 -8.594 -9.758 117 HD22 LEU 16 1HD2 LEU 16 5.600 -7.377 -11.014 118 HD23 LEU 16 2HD2 LEU 16 6.692 -8.766 -10.865 119 H GLU 17 H GLU 17 8.936 -4.741 -9.760 120 HA GLU 17 HA GLU 17 11.195 -6.135 -8.901 121 HB2 GLU 17 2HB GLU 17 10.789 -3.598 -10.507 122 HB3 GLU 17 3HB GLU 17 12.414 -3.955 -9.949 123 HG2 GLU 17 2HG GLU 17 12.358 -6.162 -11.022 124 HG3 GLU 17 3HG GLU 17 10.753 -5.800 -11.670 125 H ASN 18 H ASN 18 10.043 -3.019 -7.737 126 HA ASN 18 HA ASN 18 12.497 -2.181 -6.460 127 HB2 ASN 18 2HB ASN 18 9.647 -1.249 -6.531 128 HB3 ASN 18 3HB ASN 18 10.590 -0.762 -5.158 129 HD21 ASN 18 2HD2 ASN 18 10.520 -0.668 -8.770 130 HD22 ASN 18 1HD2 ASN 18 11.540 0.747 -8.874 131 H TYR 19 H TYR 19 10.077 -4.477 -5.478 132 HA TYR 19 HA TYR 19 10.805 -4.382 -2.624 133 HB2 TYR 19 2HB TYR 19 8.900 -6.135 -4.216 134 HB3 TYR 19 3HB TYR 19 9.098 -6.165 -2.473 135 HD1 TYR 19 HD1 TYR 19 7.824 -4.117 -5.335 136 HD2 TYR 19 HD2 TYR 19 8.267 -4.400 -1.043 137 HE1 TYR 19 HE1 TYR 19 6.188 -2.276 -5.033 138 HE2 TYR 19 HE2 TYR 19 6.656 -2.525 -0.755 139 HH TYR 19 HH TYR 19 5.330 -0.972 -1.794 140 H CYS 20 H CYS 20 12.281 -5.733 -5.335 141 HA CYS 20 HA CYS 20 13.340 -8.164 -4.080 142 HB2 CYS 20 2HB CYS 20 13.158 -7.696 -6.567 143 HB3 CYS 20 3HB CYS 20 14.469 -6.531 -6.381 144 H ASN 21 H ASN 21 14.137 -4.756 -4.002 145 HA ASN 21 HA ASN 21 16.870 -4.959 -3.092 146 HB2 ASN 21 2HB ASN 21 15.685 -2.997 -4.277 147 HB3 ASN 21 3HB ASN 21 14.952 -2.622 -2.719 148 HD21 ASN 21 2HD2 ASN 21 17.558 -3.367 -1.267 149 HD22 ASN 21 1HD2 ASN 21 18.594 -1.973 -1.605 150 H1 PHE 1 1H PHE 1 6.113 -12.323 -19.075 151 H2 PHE 1 2H PHE 1 7.446 -11.935 -18.207 152 H3 PHE 1 3H PHE 1 6.640 -10.775 -19.043 153 HA PHE 1 HA PHE 1 5.567 -12.279 -16.755 154 HB2 PHE 1 2HB PHE 1 7.348 -10.659 -16.121 155 HB3 PHE 1 3HB PHE 1 6.446 -9.363 -16.892 156 HD1 PHE 1 HD2 PHE 1 6.303 -11.906 -14.131 157 HD2 PHE 1 HD1 PHE 1 4.730 -8.188 -15.677 158 HE1 PHE 1 HE2 PHE 1 5.068 -11.535 -12.010 159 HE2 PHE 1 HE1 PHE 1 3.541 -7.809 -13.539 160 HZ PHE 1 HZ PHE 1 3.690 -9.484 -11.711 161 H VAL 2 H VAL 2 3.467 -11.480 -15.979 162 HA VAL 2 HA VAL 2 1.877 -9.831 -17.896 163 HB VAL 2 HB VAL 2 0.909 -12.413 -16.588 164 HG11 VAL 2 1HG1 VAL 2 -0.912 -10.763 -16.510 165 HG12 VAL 2 2HG1 VAL 2 -0.643 -10.344 -18.217 166 HG13 VAL 2 3HG1 VAL 2 -1.253 -11.951 -17.765 167 HG21 VAL 2 3HG2 VAL 2 2.189 -12.845 -18.637 168 HG22 VAL 2 1HG2 VAL 2 0.473 -13.150 -18.915 169 HG23 VAL 2 2HG2 VAL 2 1.211 -11.652 -19.524 170 H ASN 3 H ASN 3 1.284 -8.064 -16.809 171 HA ASN 3 HA ASN 3 1.239 -7.725 -13.989 172 HB2 ASN 3 2HB ASN 3 -0.303 -6.283 -16.190 173 HB3 ASN 3 3HB ASN 3 -0.165 -5.736 -14.523 174 HD21 ASN 3 2HD2 ASN 3 0.493 -3.915 -16.148 175 HD22 ASN 3 1HD2 ASN 3 2.223 -3.739 -16.246 176 H GLN 4 H GLN 4 -0.063 -8.694 -12.538 177 HA GLN 4 HA GLN 4 -2.929 -9.006 -12.968 178 HB2 GLN 4 2HB GLN 4 -3.030 -11.392 -12.904 179 HB3 GLN 4 3HB GLN 4 -1.966 -10.937 -14.217 180 HG2 GLN 4 2HG GLN 4 -0.015 -11.311 -12.521 181 HG3 GLN 4 3HG GLN 4 -1.230 -12.088 -11.506 182 HE21 GLN 4 2HE2 GLN 4 0.856 -12.472 -14.255 183 HE22 GLN 4 1HE2 GLN 4 0.342 -14.110 -14.650 184 H HIS 5 H HIS 5 -3.677 -10.569 -11.076 185 HA HIS 5 HA HIS 5 -2.759 -9.363 -8.525 186 HB2 HIS 5 2HB HIS 5 -5.031 -11.291 -9.135 187 HB3 HIS 5 3HB HIS 5 -4.654 -10.626 -7.548 188 HD2 HIS 5 HD2 HIS 5 -6.034 -9.552 -10.992 189 HE1 HIS 5 HE1 HIS 5 -6.965 -6.432 -8.248 190 HE2 HIS 5 HE2 HIS 5 -7.359 -7.310 -10.609 191 H LEU 6 H LEU 6 -1.303 -10.344 -7.232 192 HA LEU 6 HA LEU 6 -0.696 -13.267 -7.502 193 HB2 LEU 6 2HB LEU 6 1.298 -10.982 -7.581 194 HB3 LEU 6 3HB LEU 6 1.729 -12.681 -7.463 195 HG LEU 6 HG LEU 6 0.192 -11.464 -9.803 196 HD11 LEU 6 1HD1 LEU 6 3.124 -12.160 -9.631 197 HD12 LEU 6 2HD1 LEU 6 2.271 -11.520 -11.047 198 HD13 LEU 6 3HD1 LEU 6 2.469 -10.509 -9.600 199 HD21 LEU 6 3HD2 LEU 6 1.599 -14.157 -9.450 200 HD22 LEU 6 1HD2 LEU 6 -0.155 -13.915 -9.585 201 HD23 LEU 6 2HD2 LEU 6 0.893 -13.566 -10.967 202 H CYS 7 H CYS 7 -0.488 -14.295 -5.672 203 HA CYS 7 HA CYS 7 0.072 -12.892 -3.098 204 HB2 CYS 7 2HB CYS 7 -2.208 -14.834 -3.627 205 HB3 CYS 7 3HB CYS 7 -1.825 -14.110 -2.076 206 H GLY 8 H GLY 8 0.914 -14.336 -1.463 207 HA2 GLY 8 HA2 GLY 8 2.045 -16.171 -0.607 208 HA3 GLY 8 HA3 GLY 8 0.888 -17.127 -1.538 209 H SER 9 H SER 9 2.061 -18.714 -2.436 210 HA SER 9 HA SER 9 4.736 -18.689 -3.303 211 HB2 SER 9 2HB SER 9 2.439 -20.282 -4.501 212 HB3 SER 9 3HB SER 9 4.164 -20.681 -4.574 213 HG SER 9 HG SER 9 3.070 -21.846 -2.901 214 H HIS 10 H HIS 10 1.803 -17.817 -5.202 215 HA HIS 10 HA HIS 10 3.053 -17.563 -7.733 216 HB2 HIS 10 2HB HIS 10 0.468 -17.072 -6.578 217 HB3 HIS 10 3HB HIS 10 0.934 -15.597 -7.386 218 HD2 HIS 10 HD2 HIS 10 -0.959 -18.526 -8.140 219 HE1 HIS 10 HE1 HIS 10 0.926 -17.720 -11.871 220 HE2 HIS 10 HE2 HIS 10 -0.945 -19.018 -10.726 221 H LEU 11 H LEU 11 2.984 -15.360 -5.012 222 HA LEU 11 HA LEU 11 4.061 -13.080 -6.466 223 HB2 LEU 11 2HB LEU 11 2.509 -13.131 -4.401 224 HB3 LEU 11 3HB LEU 11 3.928 -13.562 -3.457 225 HG LEU 11 HG LEU 11 5.028 -11.451 -4.073 226 HD11 LEU 11 1HD1 LEU 11 4.029 -10.981 -6.283 227 HD12 LEU 11 2HD1 LEU 11 2.415 -10.865 -5.546 228 HD13 LEU 11 3HD1 LEU 11 3.667 -9.661 -5.187 229 HD21 LEU 11 3HD2 LEU 11 2.186 -11.151 -2.979 230 HD22 LEU 11 1HD2 LEU 11 3.635 -11.582 -2.043 231 HD23 LEU 11 2HD2 LEU 11 3.488 -9.973 -2.766 232 H VAL 12 H VAL 12 5.422 -15.807 -4.809 233 HA VAL 12 HA VAL 12 8.157 -14.647 -4.522 234 HB VAL 12 HB VAL 12 7.111 -17.466 -4.009 235 HG11 VAL 12 1HG1 VAL 12 9.827 -16.231 -3.386 236 HG12 VAL 12 2HG1 VAL 12 9.255 -17.809 -2.792 237 HG13 VAL 12 3HG1 VAL 12 9.496 -17.560 -4.522 238 HG21 VAL 12 3HG2 VAL 12 6.196 -15.823 -2.409 239 HG22 VAL 12 1HG2 VAL 12 7.362 -16.884 -1.616 240 HG23 VAL 12 2HG2 VAL 12 7.832 -15.228 -2.065 241 H GLU 13 H GLU 13 6.328 -16.877 -6.575 242 HA GLU 13 HA GLU 13 8.219 -17.409 -8.610 243 HB2 GLU 13 3HB GLU 13 5.336 -17.473 -8.126 244 HB3 GLU 13 2HB GLU 13 5.611 -16.736 -9.632 245 HG2 GLU 13 3HG GLU 13 7.058 -18.703 -10.312 246 HG3 GLU 13 2HG GLU 13 6.752 -19.413 -8.719 247 H ALA 14 H ALA 14 5.948 -14.595 -8.206 248 HA ALA 14 HA ALA 14 6.713 -13.152 -10.436 249 HB1 ALA 14 3HB ALA 14 6.056 -11.770 -7.825 250 HB2 ALA 14 1HB ALA 14 5.549 -11.371 -9.470 251 HB3 ALA 14 2HB ALA 14 4.872 -12.801 -8.643 252 H LEU 15 H LEU 15 8.131 -12.696 -7.147 253 HA LEU 15 HA LEU 15 10.151 -10.862 -7.922 254 HB2 LEU 15 2HB LEU 15 9.806 -12.783 -5.611 255 HB3 LEU 15 3HB LEU 15 11.387 -12.075 -5.868 256 HG LEU 15 HG LEU 15 10.208 -10.809 -4.226 257 HD11 LEU 15 1HD1 LEU 15 10.496 -8.573 -5.064 258 HD12 LEU 15 2HD1 LEU 15 11.752 -9.599 -5.776 259 HD13 LEU 15 3HD1 LEU 15 10.350 -9.095 -6.745 260 HD21 LEU 15 3HD2 LEU 15 7.908 -11.236 -4.816 261 HD22 LEU 15 1HD2 LEU 15 8.190 -9.490 -4.746 262 HD23 LEU 15 2HD2 LEU 15 8.063 -10.299 -6.320 263 H TYR 16 H TYR 16 10.219 -14.428 -8.197 264 HA TYR 16 HA TYR 16 12.983 -14.469 -9.086 265 HB2 TYR 16 2HB TYR 16 11.825 -16.484 -8.271 266 HB3 TYR 16 3HB TYR 16 10.733 -16.425 -9.647 267 HD1 TYR 16 HD2 TYR 16 14.365 -16.751 -8.751 268 HD2 TYR 16 HD1 TYR 16 11.371 -17.214 -11.824 269 HE1 TYR 16 HE2 TYR 16 16.071 -17.745 -10.266 270 HE2 TYR 16 HE1 TYR 16 13.069 -18.215 -13.332 271 HH TYR 16 HH TYR 16 15.280 -18.791 -13.607 272 H LEU 17 H LEU 17 9.846 -14.282 -10.845 273 HA LEU 17 HA LEU 17 10.995 -14.399 -13.447 274 HB2 LEU 17 2HB LEU 17 8.352 -13.181 -12.495 275 HB3 LEU 17 3HB LEU 17 8.735 -13.523 -14.179 276 HG LEU 17 HG LEU 17 8.810 -15.666 -12.069 277 HD11 LEU 17 1HD1 LEU 17 6.384 -14.937 -13.746 278 HD12 LEU 17 2HD1 LEU 17 6.533 -16.352 -12.671 279 HD13 LEU 17 3HD1 LEU 17 6.547 -14.734 -11.986 280 HD21 LEU 17 3HD2 LEU 17 8.449 -15.822 -15.085 281 HD22 LEU 17 1HD2 LEU 17 9.925 -16.235 -14.186 282 HD23 LEU 17 2HD2 LEU 17 8.464 -17.206 -13.972 283 H VAL 18 H VAL 18 10.161 -11.563 -11.482 284 HA VAL 18 HA VAL 18 11.213 -9.684 -13.486 285 HB VAL 18 HB VAL 18 11.295 -8.155 -11.277 286 HG11 VAL 18 1HG1 VAL 18 9.054 -7.372 -11.782 287 HG12 VAL 18 2HG1 VAL 18 9.967 -7.679 -13.269 288 HG13 VAL 18 3HG1 VAL 18 8.725 -8.841 -12.738 289 HG21 VAL 18 3HG2 VAL 18 10.605 -10.191 -9.890 290 HG22 VAL 18 1HG2 VAL 18 9.865 -8.610 -9.598 291 HG23 VAL 18 2HG2 VAL 18 8.980 -9.841 -10.533 292 H CYS 19 H CYS 19 12.542 -10.898 -10.326 293 HA CYS 19 HA CYS 19 15.029 -9.350 -10.907 294 HB2 CYS 19 2HB CYS 19 13.457 -8.927 -8.932 295 HB3 CYS 19 3HB CYS 19 14.026 -10.461 -8.276 296 H GLY 20 H GLY 20 14.014 -12.672 -10.098 297 HA2 GLY 20 HA2 GLY 20 16.735 -13.503 -9.312 298 HA3 GLY 20 HA3 GLY 20 15.277 -14.516 -9.371 299 H GLU 21 H GLU 21 14.582 -14.053 -12.067 300 HA GLU 21 HA GLU 21 16.148 -15.915 -13.530 301 HB2 GLU 21 2HB GLU 21 13.708 -15.326 -13.786 302 HB3 GLU 21 3HB GLU 21 14.193 -13.808 -14.533 303 HG2 GLU 21 2HG GLU 21 15.324 -15.150 -16.356 304 HG3 GLU 21 3HG GLU 21 14.741 -16.622 -15.576 305 H ARG 22 H ARG 22 16.648 -12.517 -13.005 306 HA ARG 22 HA ARG 22 18.321 -11.918 -15.287 307 HB2 ARG 22 2HB ARG 22 18.425 -10.668 -12.524 308 HB3 ARG 22 3HB ARG 22 18.963 -9.948 -14.030 309 HG2 ARG 22 2HG ARG 22 16.051 -10.518 -13.295 310 HG3 ARG 22 3HG ARG 22 16.881 -8.987 -13.126 311 HD2 ARG 22 2HD ARG 22 15.558 -8.799 -15.064 312 HD3 ARG 22 3HD ARG 22 17.244 -8.860 -15.564 313 HE ARG 22 HE ARG 22 16.861 -10.829 -16.668 314 HH11 ARG 22 1HH1 ARG 22 14.057 -10.322 -14.571 315 HH12 ARG 22 2HH1 ARG 22 13.165 -11.640 -15.272 316 HH21 ARG 22 2HH2 ARG 22 15.647 -12.479 -17.577 317 HH22 ARG 22 1HH2 ARG 22 14.065 -12.867 -16.948 318 H GLY 23 H GLY 23 18.847 -13.824 -12.452 319 HA2 GLY 23 HA2 GLY 23 21.768 -13.526 -12.294 320 HA3 GLY 23 HA3 GLY 23 20.737 -14.616 -11.350 321 H HIS 24 H HIS 24 22.912 -15.753 -11.972 322 HA HIS 24 HA HIS 24 23.158 -16.799 -14.639 323 HB2 HIS 24 2HB HIS 24 25.100 -17.938 -13.778 324 HB3 HIS 24 3HB HIS 24 25.061 -16.284 -13.182 325 HD2 HIS 24 HD2 HIS 24 24.615 -15.926 -10.544 326 HE1 HIS 24 HE1 HIS 24 24.981 -20.008 -9.386 327 HE2 HIS 24 HE2 HIS 24 24.842 -17.611 -8.530 328 H PHE 25 H PHE 25 21.285 -17.984 -11.982 329 HA PHE 25 HA PHE 25 20.551 -20.452 -13.355 330 HB2 PHE 25 2HB PHE 25 22.744 -21.043 -12.355 331 HB3 PHE 25 3HB PHE 25 22.165 -20.538 -10.777 332 HD1 PHE 25 HD1 PHE 25 21.179 -22.873 -13.587 333 HD2 PHE 25 HD2 PHE 25 21.431 -22.230 -9.329 334 HE1 PHE 25 HE1 PHE 25 20.291 -25.158 -13.185 335 HE2 PHE 25 HE2 PHE 25 20.534 -24.500 -8.929 336 HZ PHE 25 HZ PHE 25 19.962 -25.976 -10.858 337 H TYR 26 H TYR 26 18.947 -21.699 -12.232 338 HA TYR 26 HA TYR 26 16.788 -20.215 -11.069 339 HB2 TYR 26 2HB TYR 26 16.590 -22.228 -12.494 340 HB3 TYR 26 3HB TYR 26 17.350 -23.200 -11.238 341 HD1 TYR 26 HD1 TYR 26 14.486 -20.798 -11.677 342 HD2 TYR 26 HD2 TYR 26 15.901 -24.415 -9.795 343 HE1 TYR 26 HE1 TYR 26 12.273 -21.104 -10.627 344 HE2 TYR 26 HE2 TYR 26 13.651 -24.773 -8.810 345 HH TYR 26 HH TYR 26 10.950 -22.460 -9.293 346 H THR 27 H THR 27 15.768 -20.515 -9.012 347 HA THR 27 HA THR 27 17.350 -21.811 -6.858 348 HB THR 27 HB THR 27 16.442 -20.141 -5.226 349 HG1 THR 27 HG1 THR 27 16.244 -18.412 -7.448 350 HG21 THR 27 1HG2 THR 27 18.211 -18.500 -5.639 351 HG22 THR 27 2HG2 THR 27 18.805 -20.140 -5.958 352 HG23 THR 27 3HG2 THR 27 18.397 -19.070 -7.313 353 HA PRO 28 HA PRO 28 13.282 -23.727 -6.688 354 HB2 PRO 28 2HB PRO 28 13.789 -25.824 -5.068 355 HB3 PRO 28 3HB PRO 28 14.505 -25.724 -6.703 356 HG2 PRO 28 2HG PRO 28 15.779 -24.921 -4.068 357 HG3 PRO 28 3HG PRO 28 16.465 -25.983 -5.342 358 HD2 PRO 28 2HD PRO 28 17.053 -23.311 -5.184 359 HD3 PRO 28 3HD PRO 28 16.910 -24.153 -6.759 360 H LYS 29 H LYS 29 11.561 -23.883 -5.255 361 HA LYS 29 HA LYS 29 11.788 -22.240 -2.757 362 HB2 LYS 29 2HB LYS 29 9.653 -22.500 -4.898 363 HB3 LYS 29 3HB LYS 29 9.232 -21.977 -3.277 364 HG2 LYS 29 2HG LYS 29 9.525 -20.073 -4.732 365 HG3 LYS 29 3HG LYS 29 10.687 -20.045 -3.404 366 HD2 LYS 29 2HD LYS 29 12.490 -20.724 -4.886 367 HD3 LYS 29 3HD LYS 29 11.353 -20.983 -6.229 368 HE2 LYS 29 2HE LYS 29 10.814 -18.562 -6.212 369 HE3 LYS 29 3HE LYS 29 11.903 -18.320 -4.837 370 HZ1 LYS 29 HZ1 LYS 29 12.996 -17.777 -6.934 371 HZ2 LYS 29 HZ2 LYS 29 13.752 -19.052 -6.256 372 HZ3 LYS 29 HZ3 LYS 29 12.753 -19.302 -7.506 373 H THR 30 H THR 30 10.462 -22.742 -0.984 374 HA THR 30 HA THR 30 10.366 -25.536 -0.273 375 HB THR 30 HB THR 30 10.890 -23.733 1.309 376 HG1 THR 30 HG1 THR 30 10.218 -25.713 2.073 377 HG21 THR 30 1HG2 THR 30 9.175 -22.415 2.391 378 HG22 THR 30 2HG2 THR 30 9.175 -22.040 0.662 379 HG23 THR 30 3HG2 THR 30 7.914 -23.091 1.344 Start of MODEL 4 1 H1 GLY 1 1H GLY 1 3.952 -1.854 0.917 2 H2 GLY 1 2H GLY 1 4.359 -2.104 2.486 3 H3 GLY 1 3H GLY 1 2.979 -2.745 1.891 4 HA2 GLY 1 HA2 GLY 1 5.737 -3.500 1.150 5 HA3 GLY 1 HA3 GLY 1 4.602 -4.484 2.090 6 H ILE 2 H ILE 2 5.749 -5.605 -0.093 7 HA ILE 2 HA ILE 2 4.655 -5.170 -2.629 8 HB ILE 2 HB ILE 2 6.707 -6.388 -2.199 9 HG12 ILE 2 2HG1 ILE 2 6.535 -8.273 -3.731 10 HG13 ILE 2 3HG1 ILE 2 4.776 -8.234 -3.634 11 HG21 ILE 2 1HG2 ILE 2 6.085 -7.666 -0.165 12 HG22 ILE 2 2HG2 ILE 2 5.058 -8.727 -1.158 13 HG23 ILE 2 3HG2 ILE 2 6.808 -8.686 -1.404 14 HD11 ILE 2 3HD1 ILE 2 5.591 -7.243 -5.692 15 HD12 ILE 2 1HD1 ILE 2 4.798 -5.987 -4.730 16 HD13 ILE 2 2HD1 ILE 2 6.577 -6.081 -4.801 17 H VAL 3 H VAL 3 3.317 -7.268 -0.111 18 HA VAL 3 HA VAL 3 1.308 -8.501 -1.714 19 HB VAL 3 HB VAL 3 1.277 -7.879 1.264 20 HG11 VAL 3 1HG1 VAL 3 -0.457 -9.860 -0.280 21 HG12 VAL 3 2HG1 VAL 3 -0.381 -9.711 1.485 22 HG13 VAL 3 3HG1 VAL 3 -1.036 -8.383 0.529 23 HG21 VAL 3 3HG2 VAL 3 3.161 -9.354 0.577 24 HG22 VAL 3 1HG2 VAL 3 1.971 -10.241 1.531 25 HG23 VAL 3 2HG2 VAL 3 2.011 -10.440 -0.232 26 H GLU 4 H GLU 4 1.392 -5.305 -0.173 27 HA GLU 4 HA GLU 4 -1.429 -4.715 -0.715 28 HB2 GLU 4 2HB GLU 4 0.851 -2.901 0.130 29 HB3 GLU 4 3HB GLU 4 -0.864 -2.485 0.117 30 HG2 GLU 4 2HG GLU 4 -1.357 -4.096 1.864 31 HG3 GLU 4 3HG GLU 4 0.296 -4.719 1.840 32 H GLN 5 H GLN 5 1.391 -4.798 -2.666 33 HA GLN 5 HA GLN 5 0.256 -2.859 -4.638 34 HB2 GLN 5 2HB GLN 5 2.837 -4.487 -4.690 35 HB3 GLN 5 3HB GLN 5 2.279 -3.399 -5.958 36 HG2 GLN 5 2HG GLN 5 3.121 -2.654 -3.133 37 HG3 GLN 5 3HG GLN 5 3.950 -2.293 -4.647 38 HE21 GLN 5 2HE2 GLN 5 2.421 -0.949 -6.325 39 HE22 GLN 5 1HE2 GLN 5 1.560 0.356 -5.523 40 H CYS 6 H CYS 6 1.204 -6.336 -4.389 41 HA CYS 6 HA CYS 6 -0.058 -6.836 -7.011 42 HB2 CYS 6 2HB CYS 6 1.666 -8.479 -5.160 43 HB3 CYS 6 3HB CYS 6 1.119 -9.018 -6.745 44 H CYS 7 H CYS 7 -0.716 -7.915 -3.670 45 HA CYS 7 HA CYS 7 -2.542 -9.991 -4.612 46 HB2 CYS 7 2HB CYS 7 -1.206 -10.181 -2.547 47 HB3 CYS 7 3HB CYS 7 -2.176 -8.907 -1.805 48 H THR 8 H THR 8 -3.065 -6.768 -3.234 49 HA THR 8 HA THR 8 -5.952 -7.017 -3.084 50 HB THR 8 HB THR 8 -4.485 -5.567 -1.641 51 HG1 THR 8 HG1 THR 8 -6.638 -4.358 -3.049 52 HG21 THR 8 1HG2 THR 8 -3.111 -4.580 -3.497 53 HG22 THR 8 2HG2 THR 8 -4.531 -3.640 -4.001 54 HG23 THR 8 3HG2 THR 8 -3.821 -3.380 -2.395 55 H SER 9 H SER 9 -3.763 -5.907 -5.558 56 HA SER 9 HA SER 9 -5.809 -5.508 -7.619 57 HB2 SER 9 2HB SER 9 -4.031 -3.231 -6.646 58 HB3 SER 9 3HB SER 9 -4.968 -3.235 -8.148 59 HG SER 9 HG SER 9 -6.056 -2.117 -6.462 60 H ILE 10 H ILE 10 -4.598 -4.826 -9.707 61 HA ILE 10 HA ILE 10 -2.407 -6.704 -10.026 62 HB ILE 10 HB ILE 10 -3.724 -4.782 -11.980 63 HG12 ILE 10 2HG1 ILE 10 -3.976 -7.743 -11.276 64 HG13 ILE 10 3HG1 ILE 10 -5.192 -6.480 -11.106 65 HG21 ILE 10 1HG2 ILE 10 -2.524 -6.190 -13.714 66 HG22 ILE 10 2HG2 ILE 10 -1.454 -5.166 -12.767 67 HG23 ILE 10 3HG2 ILE 10 -1.567 -6.886 -12.381 68 HD11 ILE 10 3HD1 ILE 10 -5.345 -6.278 -13.540 69 HD12 ILE 10 1HD1 ILE 10 -4.228 -7.680 -13.696 70 HD13 ILE 10 2HD1 ILE 10 -5.800 -7.869 -12.884 71 H CYS 11 H CYS 11 -0.336 -6.400 -9.833 72 HA CYS 11 HA CYS 11 0.823 -3.655 -9.761 73 HB2 CYS 11 2HB CYS 11 2.708 -4.656 -8.646 74 HB3 CYS 11 3HB CYS 11 1.226 -5.107 -7.830 75 H SER 12 H SER 12 3.067 -3.520 -10.689 76 HA SER 12 HA SER 12 3.303 -4.931 -13.313 77 HB2 SER 12 2HB SER 12 3.681 -1.979 -12.689 78 HB3 SER 12 3HB SER 12 4.102 -2.768 -14.217 79 HG SER 12 HG SER 12 1.969 -1.767 -14.203 80 H LEU 13 H LEU 13 5.391 -5.079 -14.196 81 HA LEU 13 HA LEU 13 7.217 -6.187 -12.384 82 HB2 LEU 13 2HB LEU 13 8.743 -6.276 -14.274 83 HB3 LEU 13 3HB LEU 13 7.162 -6.924 -14.655 84 HG LEU 13 HG LEU 13 8.075 -4.141 -15.525 85 HD11 LEU 13 1HD1 LEU 13 9.652 -5.828 -16.362 86 HD12 LEU 13 2HD1 LEU 13 8.303 -6.772 -17.036 87 HD13 LEU 13 3HD1 LEU 13 8.679 -5.154 -17.676 88 HD21 LEU 13 3HD2 LEU 13 5.851 -5.969 -16.537 89 HD22 LEU 13 1HD2 LEU 13 5.661 -4.360 -15.794 90 HD23 LEU 13 2HD2 LEU 13 6.408 -4.508 -17.374 91 H TYR 14 H TYR 14 7.227 -3.004 -13.883 92 HA TYR 14 HA TYR 14 9.778 -2.200 -13.057 93 HB2 TYR 14 2HB TYR 14 9.079 -0.008 -13.777 94 HB3 TYR 14 3HB TYR 14 8.466 -1.249 -14.889 95 HD1 TYR 14 HD1 TYR 14 7.466 1.041 -12.079 96 HD2 TYR 14 HD2 TYR 14 6.171 -1.321 -15.451 97 HE1 TYR 14 HE1 TYR 14 5.186 1.996 -11.865 98 HE2 TYR 14 HE2 TYR 14 3.902 -0.322 -15.273 99 HH TYR 14 HH TYR 14 2.518 1.102 -14.092 100 H GLN 15 H GLN 15 7.083 -2.598 -11.037 101 HA GLN 15 HA GLN 15 8.203 -0.670 -9.022 102 HB2 GLN 15 2HB GLN 15 5.946 -0.391 -8.099 103 HB3 GLN 15 3HB GLN 15 6.095 0.255 -9.731 104 HG2 GLN 15 2HG GLN 15 4.842 -1.572 -10.670 105 HG3 GLN 15 3HG GLN 15 4.883 -2.481 -9.148 106 HE21 GLN 15 1HE2 GLN 15 3.462 0.448 -10.703 107 HE22 GLN 15 2HE2 GLN 15 2.140 0.540 -9.554 108 H LEU 16 H LEU 16 6.778 -3.887 -9.654 109 HA LEU 16 HA LEU 16 6.946 -4.765 -6.939 110 HB2 LEU 16 2HB LEU 16 5.760 -6.446 -7.766 111 HB3 LEU 16 3HB LEU 16 5.752 -5.603 -9.265 112 HG LEU 16 HG LEU 16 7.996 -6.879 -9.753 113 HD11 LEU 16 1HD1 LEU 16 8.441 -7.912 -7.666 114 HD12 LEU 16 2HD1 LEU 16 6.755 -8.440 -7.448 115 HD13 LEU 16 3HD1 LEU 16 7.788 -9.230 -8.638 116 HD21 LEU 16 3HD2 LEU 16 6.777 -8.703 -10.772 117 HD22 LEU 16 1HD2 LEU 16 5.366 -8.418 -9.718 118 HD23 LEU 16 2HD2 LEU 16 5.822 -7.223 -10.952 119 H GLU 17 H GLU 17 9.247 -4.823 -9.607 120 HA GLU 17 HA GLU 17 11.455 -6.253 -8.618 121 HB2 GLU 17 2HB GLU 17 11.202 -3.725 -10.286 122 HB3 GLU 17 3HB GLU 17 12.787 -4.188 -9.680 123 HG2 GLU 17 2HG GLU 17 12.551 -6.420 -10.712 124 HG3 GLU 17 3HG GLU 17 11.063 -5.865 -11.503 125 H ASN 18 H ASN 18 10.317 -3.052 -7.668 126 HA ASN 18 HA ASN 18 12.604 -2.102 -6.323 127 HB2 ASN 18 2HB ASN 18 10.203 -1.078 -6.988 128 HB3 ASN 18 3HB ASN 18 9.858 -1.393 -5.290 129 HD21 ASN 18 1HD2 ASN 18 11.735 0.437 -7.624 130 HD22 ASN 18 2HD2 ASN 18 12.432 1.572 -6.486 131 H TYR 19 H TYR 19 10.193 -4.399 -5.252 132 HA TYR 19 HA TYR 19 10.910 -4.299 -2.409 133 HB2 TYR 19 2HB TYR 19 9.013 -6.066 -4.001 134 HB3 TYR 19 3HB TYR 19 9.154 -6.034 -2.251 135 HD1 TYR 19 HD1 TYR 19 8.023 -4.083 -5.229 136 HD2 TYR 19 HD2 TYR 19 8.298 -4.199 -0.918 137 HE1 TYR 19 HE1 TYR 19 6.432 -2.182 -5.067 138 HE2 TYR 19 HE2 TYR 19 6.737 -2.269 -0.766 139 HH TYR 19 HH TYR 19 5.482 -0.729 -1.924 140 H CYS 20 H CYS 20 12.392 -5.755 -5.063 141 HA CYS 20 HA CYS 20 13.295 -8.227 -3.779 142 HB2 CYS 20 2HB CYS 20 13.177 -7.735 -6.273 143 HB3 CYS 20 3HB CYS 20 14.569 -6.674 -6.058 144 H ASN 21 H ASN 21 14.304 -4.876 -3.693 145 HA ASN 21 HA ASN 21 17.009 -5.227 -2.758 146 HB2 ASN 21 2HB ASN 21 16.184 -3.179 -3.904 147 HB3 ASN 21 3HB ASN 21 15.086 -2.860 -2.559 148 HD21 ASN 21 1HD2 ASN 21 18.592 -3.348 -3.246 149 HD22 ASN 21 2HD2 ASN 21 19.115 -2.184 -2.036 150 H1 PHE 1 1H PHE 1 7.921 -11.259 -17.522 151 H2 PHE 1 2H PHE 1 6.869 -10.435 -18.473 152 H3 PHE 1 3H PHE 1 6.737 -12.057 -18.327 153 HA PHE 1 HA PHE 1 6.157 -11.891 -16.019 154 HB2 PHE 1 2HB PHE 1 7.472 -9.840 -15.558 155 HB3 PHE 1 3HB PHE 1 6.333 -8.885 -16.498 156 HD1 PHE 1 HD2 PHE 1 6.438 -11.262 -13.564 157 HD2 PHE 1 HD1 PHE 1 4.550 -7.810 -15.352 158 HE1 PHE 1 HE2 PHE 1 4.997 -11.001 -11.563 159 HE2 PHE 1 HE1 PHE 1 3.158 -7.527 -13.316 160 HZ PHE 1 HZ PHE 1 3.370 -9.129 -11.430 161 H VAL 2 H VAL 2 3.895 -11.436 -15.279 162 HA VAL 2 HA VAL 2 2.005 -10.653 -17.465 163 HB VAL 2 HB VAL 2 1.575 -12.935 -15.483 164 HG11 VAL 2 1HG1 VAL 2 -0.539 -11.725 -15.911 165 HG12 VAL 2 2HG1 VAL 2 -0.254 -11.812 -17.663 166 HG13 VAL 2 3HG1 VAL 2 -0.562 -13.289 -16.725 167 HG21 VAL 2 3HG2 VAL 2 3.044 -13.648 -17.321 168 HG22 VAL 2 1HG2 VAL 2 1.446 -14.374 -17.504 169 HG23 VAL 2 2HG2 VAL 2 1.904 -12.987 -18.516 170 H ASN 3 H ASN 3 1.082 -8.813 -16.820 171 HA ASN 3 HA ASN 3 0.861 -7.962 -14.081 172 HB2 ASN 3 2HB ASN 3 -0.644 -6.942 -16.532 173 HB3 ASN 3 3HB ASN 3 -0.388 -6.101 -14.996 174 HD21 ASN 3 2HD2 ASN 3 1.415 -4.919 -14.647 175 HD22 ASN 3 1HD2 ASN 3 2.618 -4.743 -15.901 176 H GLN 4 H GLN 4 -0.319 -9.134 -12.692 177 HA GLN 4 HA GLN 4 -3.191 -9.370 -12.926 178 HB2 GLN 4 2HB GLN 4 -3.368 -11.786 -12.804 179 HB3 GLN 4 3HB GLN 4 -2.547 -11.303 -14.291 180 HG2 GLN 4 2HG GLN 4 -0.372 -11.750 -13.178 181 HG3 GLN 4 3HG GLN 4 -1.218 -12.382 -11.766 182 HE21 GLN 4 1HE2 GLN 4 0.653 -13.955 -13.285 183 HE22 GLN 4 2HE2 GLN 4 -0.271 -15.250 -14.032 184 H HIS 5 H HIS 5 -3.840 -10.978 -10.946 185 HA HIS 5 HA HIS 5 -2.788 -9.585 -8.568 186 HB2 HIS 5 2HB HIS 5 -5.070 -11.566 -8.895 187 HB3 HIS 5 3HB HIS 5 -4.661 -10.696 -7.420 188 HD2 HIS 5 HD2 HIS 5 -6.042 -10.026 -10.990 189 HE1 HIS 5 HE1 HIS 5 -7.165 -6.731 -8.565 190 HE2 HIS 5 HE2 HIS 5 -7.496 -7.851 -10.825 191 H LEU 6 H LEU 6 -1.311 -10.442 -7.225 192 HA LEU 6 HA LEU 6 -0.716 -13.376 -7.177 193 HB2 LEU 6 2HB LEU 6 1.313 -11.141 -7.558 194 HB3 LEU 6 3HB LEU 6 1.700 -12.846 -7.355 195 HG LEU 6 HG LEU 6 0.126 -11.688 -9.706 196 HD11 LEU 6 1HD1 LEU 6 2.509 -10.925 -9.612 197 HD12 LEU 6 2HD1 LEU 6 3.000 -12.634 -9.661 198 HD13 LEU 6 3HD1 LEU 6 2.123 -11.922 -11.027 199 HD21 LEU 6 3HD2 LEU 6 1.423 -14.436 -9.426 200 HD22 LEU 6 1HD2 LEU 6 -0.312 -14.147 -9.216 201 HD23 LEU 6 2HD2 LEU 6 0.452 -13.844 -10.782 202 H CYS 7 H CYS 7 -0.272 -14.157 -5.175 203 HA CYS 7 HA CYS 7 -0.031 -12.186 -2.919 204 HB2 CYS 7 2HB CYS 7 -2.444 -12.897 -3.672 205 HB3 CYS 7 3HB CYS 7 -2.076 -14.389 -2.818 206 H GLY 8 H GLY 8 -0.077 -15.679 -3.510 207 HA2 GLY 8 HA2 GLY 8 1.440 -16.100 -0.974 208 HA3 GLY 8 HA3 GLY 8 0.498 -17.254 -1.927 209 H SER 9 H SER 9 1.900 -18.822 -2.629 210 HA SER 9 HA SER 9 4.662 -18.552 -3.301 211 HB2 SER 9 2HB SER 9 3.390 -20.698 -3.025 212 HB3 SER 9 3HB SER 9 2.617 -20.396 -4.594 213 HG SER 9 HG SER 9 4.491 -21.762 -4.747 214 H HIS 10 H HIS 10 1.771 -17.981 -5.306 215 HA HIS 10 HA HIS 10 2.894 -17.376 -7.761 216 HB2 HIS 10 2HB HIS 10 0.453 -16.585 -6.207 217 HB3 HIS 10 3HB HIS 10 0.860 -15.533 -7.536 218 HD2 HIS 10 HD2 HIS 10 -1.049 -18.575 -6.875 219 HE1 HIS 10 HE1 HIS 10 -0.114 -18.870 -11.018 220 HE2 HIS 10 HE2 HIS 10 -1.567 -19.806 -9.144 221 H LEU 11 H LEU 11 3.006 -15.326 -4.887 222 HA LEU 11 HA LEU 11 4.012 -12.988 -6.351 223 HB2 LEU 11 2HB LEU 11 2.459 -13.050 -4.301 224 HB3 LEU 11 3HB LEU 11 3.856 -13.507 -3.351 225 HG LEU 11 HG LEU 11 4.970 -11.381 -3.956 226 HD11 LEU 11 1HD1 LEU 11 2.327 -10.774 -5.374 227 HD12 LEU 11 2HD1 LEU 11 3.570 -9.571 -5.006 228 HD13 LEU 11 3HD1 LEU 11 3.930 -10.867 -6.143 229 HD21 LEU 11 3HD2 LEU 11 2.137 -11.041 -2.854 230 HD22 LEU 11 1HD2 LEU 11 3.567 -11.531 -1.913 231 HD23 LEU 11 2HD2 LEU 11 3.473 -9.906 -2.619 232 H VAL 12 H VAL 12 5.365 -15.742 -4.797 233 HA VAL 12 HA VAL 12 8.099 -14.603 -4.434 234 HB VAL 12 HB VAL 12 7.044 -17.441 -4.046 235 HG11 VAL 12 1HG1 VAL 12 9.758 -16.232 -3.369 236 HG12 VAL 12 2HG1 VAL 12 9.188 -17.832 -2.841 237 HG13 VAL 12 3HG1 VAL 12 9.433 -17.515 -4.561 238 HG21 VAL 12 3HG2 VAL 12 6.112 -15.893 -2.372 239 HG22 VAL 12 1HG2 VAL 12 7.302 -16.961 -1.626 240 HG23 VAL 12 2HG2 VAL 12 7.739 -15.281 -2.008 241 H GLU 13 H GLU 13 6.259 -16.777 -6.542 242 HA GLU 13 HA GLU 13 8.100 -17.256 -8.629 243 HB2 GLU 13 3HB GLU 13 5.198 -17.214 -8.069 244 HB3 GLU 13 2HB GLU 13 5.509 -16.661 -9.631 245 HG2 GLU 13 2HG GLU 13 6.630 -19.267 -8.504 246 HG3 GLU 13 3HG GLU 13 5.090 -19.162 -9.357 247 H ALA 14 H ALA 14 5.840 -14.438 -8.074 248 HA ALA 14 HA ALA 14 6.560 -12.946 -10.303 249 HB1 ALA 14 3HB ALA 14 4.773 -12.533 -8.474 250 HB2 ALA 14 1HB ALA 14 6.030 -11.624 -7.623 251 HB3 ALA 14 2HB ALA 14 5.534 -11.115 -9.235 252 H LEU 15 H LEU 15 8.091 -12.607 -7.050 253 HA LEU 15 HA LEU 15 10.163 -10.855 -7.842 254 HB2 LEU 15 2HB LEU 15 9.810 -12.811 -5.563 255 HB3 LEU 15 3HB LEU 15 11.400 -12.141 -5.846 256 HG LEU 15 HG LEU 15 10.342 -10.873 -4.152 257 HD11 LEU 15 1HD1 LEU 15 11.806 -9.662 -5.774 258 HD12 LEU 15 2HD1 LEU 15 10.355 -9.108 -6.638 259 HD13 LEU 15 3HD1 LEU 15 10.620 -8.628 -4.957 260 HD21 LEU 15 3HD2 LEU 15 8.316 -9.516 -4.509 261 HD22 LEU 15 1HD2 LEU 15 8.070 -10.288 -6.088 262 HD23 LEU 15 2HD2 LEU 15 8.005 -11.255 -4.596 263 H TYR 16 H TYR 16 10.114 -14.412 -8.204 264 HA TYR 16 HA TYR 16 12.867 -14.568 -9.127 265 HB2 TYR 16 2HB TYR 16 11.671 -16.528 -8.301 266 HB3 TYR 16 3HB TYR 16 10.442 -16.355 -9.535 267 HD1 TYR 16 HD2 TYR 16 14.074 -17.123 -9.053 268 HD2 TYR 16 HD1 TYR 16 10.723 -17.179 -11.766 269 HE1 TYR 16 HE2 TYR 16 15.340 -18.615 -10.582 270 HE2 TYR 16 HE1 TYR 16 11.978 -18.675 -13.294 271 HH TYR 16 HH TYR 16 15.306 -19.814 -12.548 272 H LEU 17 H LEU 17 9.729 -14.230 -10.826 273 HA LEU 17 HA LEU 17 10.780 -14.385 -13.476 274 HB2 LEU 17 2HB LEU 17 8.230 -13.094 -12.388 275 HB3 LEU 17 3HB LEU 17 8.536 -13.385 -14.094 276 HG LEU 17 HG LEU 17 8.568 -15.607 -12.065 277 HD11 LEU 17 1HD1 LEU 17 6.174 -14.656 -13.688 278 HD12 LEU 17 2HD1 LEU 17 6.236 -16.132 -12.694 279 HD13 LEU 17 3HD1 LEU 17 6.359 -14.556 -11.920 280 HD21 LEU 17 3HD2 LEU 17 8.171 -15.628 -15.085 281 HD22 LEU 17 1HD2 LEU 17 9.629 -16.157 -14.216 282 HD23 LEU 17 2HD2 LEU 17 8.118 -17.053 -14.026 283 H VAL 18 H VAL 18 10.178 -11.578 -11.397 284 HA VAL 18 HA VAL 18 11.291 -9.713 -13.414 285 HB VAL 18 HB VAL 18 11.391 -8.213 -11.189 286 HG11 VAL 18 1HG1 VAL 18 10.192 -7.635 -13.226 287 HG12 VAL 18 2HG1 VAL 18 8.856 -8.726 -12.775 288 HG13 VAL 18 3HG1 VAL 18 9.224 -7.292 -11.781 289 HG21 VAL 18 3HG2 VAL 18 9.828 -8.575 -9.598 290 HG22 VAL 18 1HG2 VAL 18 8.950 -9.785 -10.578 291 HG23 VAL 18 2HG2 VAL 18 10.522 -10.186 -9.837 292 H CYS 19 H CYS 19 12.455 -10.720 -10.098 293 HA CYS 19 HA CYS 19 14.861 -9.133 -10.592 294 HB2 CYS 19 2HB CYS 19 13.400 -9.134 -8.509 295 HB3 CYS 19 3HB CYS 19 14.091 -10.712 -8.125 296 H GLY 20 H GLY 20 14.100 -12.554 -10.554 297 HA2 GLY 20 HA2 GLY 20 16.934 -13.418 -10.301 298 HA3 GLY 20 HA3 GLY 20 15.492 -14.452 -10.456 299 H GLU 21 H GLU 21 14.269 -13.847 -12.681 300 HA GLU 21 HA GLU 21 15.877 -15.040 -14.650 301 HB2 GLU 21 2HB GLU 21 13.118 -13.835 -14.519 302 HB3 GLU 21 3HB GLU 21 13.733 -14.420 -16.047 303 HG2 GLU 21 2HG GLU 21 13.742 -16.172 -13.570 304 HG3 GLU 21 3HG GLU 21 12.326 -16.027 -14.606 305 H ARG 22 H ARG 22 15.459 -11.608 -14.011 306 HA ARG 22 HA ARG 22 16.154 -10.615 -16.601 307 HB2 ARG 22 2HB ARG 22 16.745 -8.544 -15.512 308 HB3 ARG 22 3HB ARG 22 15.227 -9.173 -14.882 309 HG2 ARG 22 2HG ARG 22 16.488 -10.056 -12.883 310 HG3 ARG 22 3HG ARG 22 17.955 -9.294 -13.515 311 HD2 ARG 22 2HD ARG 22 16.835 -7.076 -13.411 312 HD3 ARG 22 3HD ARG 22 15.403 -7.845 -12.701 313 HE ARG 22 HE ARG 22 17.696 -8.606 -11.196 314 HH11 ARG 22 1HH2 ARG 22 15.575 -5.767 -11.582 315 HH12 ARG 22 2HH2 ARG 22 16.222 -5.017 -10.151 316 HH21 ARG 22 1HH1 ARG 22 18.404 -7.591 -9.344 317 HH22 ARG 22 2HH1 ARG 22 17.741 -6.056 -8.872 318 H GLY 23 H GLY 23 18.159 -11.885 -13.969 319 HA2 GLY 23 HA2 GLY 23 20.313 -12.697 -13.933 320 HA3 GLY 23 HA3 GLY 23 20.354 -12.548 -15.698 321 H HIS 24 H HIS 24 22.648 -12.167 -14.745 322 HA HIS 24 HA HIS 24 23.267 -9.298 -14.356 323 HB2 HIS 24 2HB HIS 24 25.079 -11.674 -14.933 324 HB3 HIS 24 3HB HIS 24 25.603 -10.046 -14.514 325 HD2 HIS 24 HD2 HIS 24 23.348 -9.759 -12.041 326 HE1 HIS 24 HE1 HIS 24 25.721 -12.815 -10.272 327 HE2 HIS 24 HE2 HIS 24 23.984 -11.007 -9.819 328 H PHE 25 H PHE 25 24.083 -7.950 -15.942 329 HA PHE 25 HA PHE 25 24.289 -6.988 -18.034 330 HB2 PHE 25 2HB PHE 25 24.521 -9.699 -19.327 331 HB3 PHE 25 3HB PHE 25 25.186 -8.164 -19.846 332 HD1 PHE 25 HD1 PHE 25 26.789 -7.020 -17.933 333 HD2 PHE 25 HD2 PHE 25 26.046 -11.238 -18.448 334 HE1 PHE 25 HE1 PHE 25 28.853 -7.534 -16.687 335 HE2 PHE 25 HE2 PHE 25 28.125 -11.759 -17.222 336 HZ PHE 25 HZ PHE 25 29.549 -9.909 -16.326 337 H TYR 26 H TYR 26 23.296 -7.234 -20.386 338 HA TYR 26 HA TYR 26 20.513 -8.293 -20.293 339 HB2 TYR 26 2HB TYR 26 21.060 -6.254 -21.689 340 HB3 TYR 26 3HB TYR 26 22.002 -7.321 -22.737 341 HD1 TYR 26 HD1 TYR 26 18.635 -6.705 -21.295 342 HD2 TYR 26 HD2 TYR 26 20.860 -8.751 -24.372 343 HE1 TYR 26 HE1 TYR 26 16.497 -7.358 -22.397 344 HE2 TYR 26 HE2 TYR 26 18.727 -9.346 -25.509 345 HH TYR 26 HH TYR 26 15.522 -8.454 -24.180 346 H THR 27 H THR 27 19.985 -10.212 -21.121 347 HA THR 27 HA THR 27 21.961 -11.914 -22.555 348 HB THR 27 HB THR 27 21.093 -13.913 -21.315 349 HG1 THR 27 HG1 THR 27 20.413 -13.421 -19.153 350 HG21 THR 27 1HG2 THR 27 22.669 -13.644 -19.461 351 HG22 THR 27 2HG2 THR 27 23.350 -12.926 -20.926 352 HG23 THR 27 3HG2 THR 27 22.668 -11.882 -19.662 353 HA PRO 28 HA PRO 28 18.307 -11.557 -25.125 354 HB2 PRO 28 2HB PRO 28 19.946 -13.502 -26.764 355 HB3 PRO 28 3HB PRO 28 18.924 -12.137 -27.335 356 HG2 PRO 28 2HG PRO 28 21.569 -11.777 -27.111 357 HG3 PRO 28 3HG PRO 28 20.455 -10.552 -26.405 358 HD2 PRO 28 2HD PRO 28 21.900 -12.816 -24.977 359 HD3 PRO 28 3HD PRO 28 21.787 -11.086 -24.525 360 H LYS 29 H LYS 29 16.491 -12.546 -25.270 361 HA LYS 29 HA LYS 29 15.869 -15.353 -25.093 362 HB2 LYS 29 2HB LYS 29 14.998 -15.313 -22.795 363 HB3 LYS 29 3HB LYS 29 16.733 -15.080 -22.861 364 HG2 LYS 29 2HG LYS 29 16.123 -12.500 -22.724 365 HG3 LYS 29 3HG LYS 29 14.570 -13.083 -22.125 366 HD2 LYS 29 2HD LYS 29 15.648 -14.196 -20.240 367 HD3 LYS 29 3HD LYS 29 17.250 -13.964 -20.967 368 HE2 LYS 29 2HE LYS 29 16.799 -11.446 -20.861 369 HE3 LYS 29 3HE LYS 29 15.440 -11.824 -19.788 370 HZ1 LYS 29 HZ1 LYS 29 17.533 -11.360 -18.579 371 HZ2 LYS 29 HZ2 LYS 29 17.028 -12.888 -18.280 372 HZ3 LYS 29 HZ3 LYS 29 18.274 -12.596 -19.330 373 H THR 30 H THR 30 13.564 -15.754 -24.748 374 HA THR 30 HA THR 30 11.722 -13.546 -25.570 375 HB THR 30 HB THR 30 11.845 -16.279 -26.902 376 HG1 THR 30 HG1 THR 30 12.653 -15.137 -28.659 377 HG21 THR 30 1HG2 THR 30 10.240 -13.756 -27.545 378 HG22 THR 30 2HG2 THR 30 10.302 -15.224 -28.548 379 HG23 THR 30 3HG2 THR 30 9.580 -15.291 -26.937 Start of MODEL 5 1 H1 GLY 1 1H GLY 1 4.668 -2.232 2.739 2 H2 GLY 1 2H GLY 1 3.255 -2.855 2.207 3 H3 GLY 1 3H GLY 1 4.169 -1.929 1.206 4 HA2 GLY 1 HA2 GLY 1 5.962 -3.580 1.279 5 HA3 GLY 1 HA3 GLY 1 4.879 -4.599 2.244 6 H ILE 2 H ILE 2 5.872 -5.682 -0.000 7 HA ILE 2 HA ILE 2 4.671 -5.113 -2.474 8 HB ILE 2 HB ILE 2 6.743 -6.347 -2.178 9 HG12 ILE 2 2HG1 ILE 2 6.507 -8.140 -3.815 10 HG13 ILE 2 3HG1 ILE 2 4.750 -8.084 -3.665 11 HG21 ILE 2 1HG2 ILE 2 6.190 -7.745 -0.205 12 HG22 ILE 2 2HG2 ILE 2 5.127 -8.742 -1.220 13 HG23 ILE 2 3HG2 ILE 2 6.866 -8.691 -1.528 14 HD11 ILE 2 3HD1 ILE 2 4.743 -5.802 -4.632 15 HD12 ILE 2 1HD1 ILE 2 6.521 -5.850 -4.719 16 HD13 ILE 2 2HD1 ILE 2 5.565 -6.971 -5.682 17 H VAL 3 H VAL 3 3.468 -7.339 -0.004 18 HA VAL 3 HA VAL 3 1.382 -8.514 -1.554 19 HB VAL 3 HB VAL 3 1.493 -8.018 1.449 20 HG11 VAL 3 1HG1 VAL 3 -0.111 -9.876 1.684 21 HG12 VAL 3 2HG1 VAL 3 -0.841 -8.561 0.764 22 HG13 VAL 3 3HG1 VAL 3 -0.239 -10.012 -0.077 23 HG21 VAL 3 3HG2 VAL 3 2.243 -10.480 -0.200 24 HG22 VAL 3 1HG2 VAL 3 3.382 -9.408 0.642 25 HG23 VAL 3 2HG2 VAL 3 2.246 -10.384 1.572 26 H GLU 4 H GLU 4 1.532 -5.422 0.171 27 HA GLU 4 HA GLU 4 -1.294 -4.768 -0.198 28 HB2 GLU 4 2HB GLU 4 1.062 -3.033 0.613 29 HB3 GLU 4 3HB GLU 4 -0.638 -2.585 0.725 30 HG2 GLU 4 2HG GLU 4 -1.062 -4.296 2.400 31 HG3 GLU 4 3HG GLU 4 0.581 -4.928 2.252 32 H GLN 5 H GLN 5 1.284 -4.897 -2.401 33 HA GLN 5 HA GLN 5 -0.046 -2.872 -4.179 34 HB2 GLN 5 2HB GLN 5 2.721 -4.136 -4.294 35 HB3 GLN 5 3HB GLN 5 2.048 -3.044 -5.507 36 HG2 GLN 5 2HG GLN 5 2.578 -2.331 -2.582 37 HG3 GLN 5 3HG GLN 5 3.584 -1.937 -3.967 38 HE21 GLN 5 2HE2 GLN 5 0.258 -1.291 -2.610 39 HE22 GLN 5 1HE2 GLN 5 0.165 0.282 -3.386 40 H CYS 6 H CYS 6 1.196 -6.256 -4.134 41 HA CYS 6 HA CYS 6 -0.044 -6.691 -6.795 42 HB2 CYS 6 2HB CYS 6 1.884 -8.259 -5.080 43 HB3 CYS 6 3HB CYS 6 1.332 -8.756 -6.678 44 H CYS 7 H CYS 7 -0.552 -7.914 -3.496 45 HA CYS 7 HA CYS 7 -2.319 -10.070 -4.451 46 HB2 CYS 7 2HB CYS 7 -0.806 -10.286 -2.496 47 HB3 CYS 7 3HB CYS 7 -1.782 -9.100 -1.632 48 H THR 8 H THR 8 -2.793 -6.848 -3.118 49 HA THR 8 HA THR 8 -5.666 -7.098 -2.729 50 HB THR 8 HB THR 8 -4.094 -5.544 -1.507 51 HG1 THR 8 HG1 THR 8 -5.706 -3.965 -1.394 52 HG21 THR 8 1HG2 THR 8 -3.559 -3.389 -2.482 53 HG22 THR 8 2HG2 THR 8 -2.928 -4.642 -3.570 54 HG23 THR 8 3HG2 THR 8 -4.427 -3.788 -3.979 55 H SER 9 H SER 9 -3.642 -6.059 -5.413 56 HA SER 9 HA SER 9 -5.711 -6.080 -7.400 57 HB2 SER 9 2HB SER 9 -5.789 -3.754 -7.949 58 HB3 SER 9 3HB SER 9 -6.276 -3.933 -6.266 59 HG SER 9 HG SER 9 -4.802 -2.183 -6.583 60 H ILE 10 H ILE 10 -4.682 -4.879 -9.484 61 HA ILE 10 HA ILE 10 -2.375 -6.557 -9.951 62 HB ILE 10 HB ILE 10 -3.875 -4.641 -11.778 63 HG12 ILE 10 2HG1 ILE 10 -3.938 -7.616 -11.135 64 HG13 ILE 10 3HG1 ILE 10 -5.238 -6.431 -11.034 65 HG21 ILE 10 1HG2 ILE 10 -1.604 -4.822 -12.647 66 HG22 ILE 10 2HG2 ILE 10 -1.608 -6.571 -12.381 67 HG23 ILE 10 3HG2 ILE 10 -2.644 -5.836 -13.628 68 HD11 ILE 10 3HD1 ILE 10 -5.303 -6.314 -13.500 69 HD12 ILE 10 1HD1 ILE 10 -4.075 -7.623 -13.556 70 HD13 ILE 10 2HD1 ILE 10 -5.663 -7.916 -12.815 71 H CYS 11 H CYS 11 -0.335 -6.157 -9.830 72 HA CYS 11 HA CYS 11 0.710 -3.360 -9.770 73 HB2 CYS 11 2HB CYS 11 2.623 -4.260 -8.615 74 HB3 CYS 11 3HB CYS 11 1.150 -4.734 -7.777 75 H SER 12 H SER 12 2.515 -2.824 -11.033 76 HA SER 12 HA SER 12 2.930 -4.489 -13.481 77 HB2 SER 12 2HB SER 12 3.795 -1.646 -12.883 78 HB3 SER 12 3HB SER 12 3.986 -2.517 -14.413 79 HG SER 12 HG SER 12 2.090 -1.105 -14.275 80 H LEU 13 H LEU 13 4.998 -4.978 -14.315 81 HA LEU 13 HA LEU 13 6.707 -6.178 -12.399 82 HB2 LEU 13 2HB LEU 13 8.166 -6.643 -14.254 83 HB3 LEU 13 3HB LEU 13 6.513 -7.085 -14.604 84 HG LEU 13 HG LEU 13 7.814 -4.546 -15.678 85 HD11 LEU 13 1HD1 LEU 13 7.607 -7.296 -16.979 86 HD12 LEU 13 2HD1 LEU 13 8.225 -5.820 -17.754 87 HD13 LEU 13 3HD1 LEU 13 9.099 -6.530 -16.391 88 HD21 LEU 13 3HD2 LEU 13 5.319 -6.067 -16.538 89 HD22 LEU 13 1HD2 LEU 13 5.407 -4.393 -15.934 90 HD23 LEU 13 2HD2 LEU 13 6.092 -4.792 -17.498 91 H TYR 14 H TYR 14 6.987 -3.126 -14.118 92 HA TYR 14 HA TYR 14 9.618 -2.496 -13.325 93 HB2 TYR 14 2HB TYR 14 9.104 -0.289 -14.188 94 HB3 TYR 14 3HB TYR 14 8.498 -1.577 -15.251 95 HD1 TYR 14 HD1 TYR 14 7.349 0.843 -12.582 96 HD2 TYR 14 HD2 TYR 14 6.321 -1.457 -16.086 97 HE1 TYR 14 HE1 TYR 14 5.120 1.928 -12.639 98 HE2 TYR 14 HE2 TYR 14 4.116 -0.324 -16.182 99 HH TYR 14 HH TYR 14 2.713 1.226 -15.210 100 H GLN 15 H GLN 15 6.935 -2.575 -11.311 101 HA GLN 15 HA GLN 15 8.168 -0.610 -9.405 102 HB2 GLN 15 2HB GLN 15 5.902 -0.199 -8.480 103 HB3 GLN 15 3HB GLN 15 6.116 0.400 -10.131 104 HG2 GLN 15 2HG GLN 15 4.894 -1.484 -11.036 105 HG3 GLN 15 3HG GLN 15 4.751 -2.233 -9.434 106 HE21 GLN 15 2HE2 GLN 15 4.173 1.245 -9.418 107 HE22 GLN 15 1HE2 GLN 15 2.427 1.077 -9.398 108 H LEU 16 H LEU 16 6.531 -3.789 -9.835 109 HA LEU 16 HA LEU 16 6.815 -4.567 -7.106 110 HB2 LEU 16 2HB LEU 16 5.658 -6.332 -7.828 111 HB3 LEU 16 3HB LEU 16 5.560 -5.521 -9.350 112 HG LEU 16 HG LEU 16 7.806 -6.741 -9.908 113 HD11 LEU 16 1HD1 LEU 16 6.757 -8.282 -7.502 114 HD12 LEU 16 2HD1 LEU 16 7.716 -9.086 -8.745 115 HD13 LEU 16 3HD1 LEU 16 8.418 -7.746 -7.845 116 HD21 LEU 16 3HD2 LEU 16 6.662 -8.609 -10.857 117 HD22 LEU 16 1HD2 LEU 16 5.309 -8.475 -9.698 118 HD23 LEU 16 2HD2 LEU 16 5.537 -7.239 -10.947 119 H GLU 17 H GLU 17 9.046 -4.695 -9.840 120 HA GLU 17 HA GLU 17 11.272 -6.098 -8.939 121 HB2 GLU 17 2HB GLU 17 10.912 -3.558 -10.552 122 HB3 GLU 17 3HB GLU 17 12.531 -3.952 -9.992 123 HG2 GLU 17 2HG GLU 17 12.425 -6.155 -11.060 124 HG3 GLU 17 3HG GLU 17 10.825 -5.767 -11.708 125 H ASN 18 H ASN 18 10.155 -2.941 -7.807 126 HA ASN 18 HA ASN 18 12.545 -2.024 -6.563 127 HB2 ASN 18 2HB ASN 18 9.627 -1.389 -6.031 128 HB3 ASN 18 3HB ASN 18 10.956 -0.521 -5.366 129 HD21 ASN 18 2HD2 ASN 18 9.101 0.837 -6.927 130 HD22 ASN 18 1HD2 ASN 18 9.937 1.344 -8.391 131 H TYR 19 H TYR 19 10.130 -4.314 -5.496 132 HA TYR 19 HA TYR 19 10.795 -4.170 -2.641 133 HB2 TYR 19 2HB TYR 19 8.884 -5.906 -4.248 134 HB3 TYR 19 3HB TYR 19 9.009 -5.880 -2.498 135 HD1 TYR 19 HD1 TYR 19 8.064 -3.771 -5.480 136 HD2 TYR 19 HD2 TYR 19 7.986 -4.185 -1.175 137 HE1 TYR 19 HE1 TYR 19 6.551 -1.824 -5.313 138 HE2 TYR 19 HE2 TYR 19 6.422 -2.253 -1.026 139 HH TYR 19 HH TYR 19 5.474 -0.341 -3.899 140 H CYS 20 H CYS 20 12.259 -5.706 -5.259 141 HA CYS 20 HA CYS 20 13.168 -8.141 -3.912 142 HB2 CYS 20 2HB CYS 20 13.068 -7.741 -6.407 143 HB3 CYS 20 3HB CYS 20 14.410 -6.610 -6.226 144 H ASN 21 H ASN 21 14.148 -4.775 -3.903 145 HA ASN 21 HA ASN 21 16.843 -5.104 -2.917 146 HB2 ASN 21 2HB ASN 21 15.802 -3.116 -4.188 147 HB3 ASN 21 3HB ASN 21 15.052 -2.652 -2.662 148 HD21 ASN 21 2HD2 ASN 21 17.575 -3.499 -1.120 149 HD22 ASN 21 1HD2 ASN 21 18.696 -2.175 -1.470 150 H1 PHE 1 1H PHE 1 7.141 -12.200 -18.724 151 H2 PHE 1 2H PHE 1 6.350 -11.048 -19.582 152 H3 PHE 1 3H PHE 1 5.761 -12.572 -19.523 153 HA PHE 1 HA PHE 1 5.310 -12.397 -17.184 154 HB2 PHE 1 2HB PHE 1 7.207 -10.763 -16.789 155 HB3 PHE 1 3HB PHE 1 6.202 -9.494 -17.467 156 HD1 PHE 1 HD1 PHE 1 6.511 -11.967 -14.685 157 HD2 PHE 1 HD2 PHE 1 4.521 -8.384 -16.066 158 HE1 PHE 1 HE1 PHE 1 5.576 -11.599 -12.419 159 HE2 PHE 1 HE2 PHE 1 3.622 -8.017 -13.795 160 HZ PHE 1 HZ PHE 1 4.138 -9.618 -11.967 161 H VAL 2 H VAL 2 3.248 -11.539 -16.408 162 HA VAL 2 HA VAL 2 1.865 -9.584 -18.138 163 HB VAL 2 HB VAL 2 -0.334 -10.647 -17.833 164 HG11 VAL 2 1HG1 VAL 2 0.922 -10.867 -19.952 165 HG12 VAL 2 2HG1 VAL 2 1.602 -12.410 -19.384 166 HG13 VAL 2 3HG1 VAL 2 -0.143 -12.247 -19.654 167 HG21 VAL 2 3HG2 VAL 2 -0.515 -13.097 -17.405 168 HG22 VAL 2 1HG2 VAL 2 1.183 -13.119 -16.888 169 HG23 VAL 2 2HG2 VAL 2 -0.032 -12.182 -15.983 170 H ASN 3 H ASN 3 1.021 -7.964 -16.989 171 HA ASN 3 HA ASN 3 1.168 -7.851 -14.124 172 HB2 ASN 3 2HB ASN 3 -0.446 -6.218 -16.130 173 HB3 ASN 3 3HB ASN 3 -0.247 -5.820 -14.426 174 HD21 ASN 3 2HD2 ASN 3 0.378 -3.917 -16.085 175 HD22 ASN 3 1HD2 ASN 3 2.109 -3.724 -16.124 176 H GLN 4 H GLN 4 -0.197 -8.665 -12.636 177 HA GLN 4 HA GLN 4 -2.979 -9.393 -13.117 178 HB2 GLN 4 2HB GLN 4 -2.694 -11.793 -12.959 179 HB3 GLN 4 3HB GLN 4 -1.745 -11.198 -14.315 180 HG2 GLN 4 2HG GLN 4 0.242 -11.121 -12.715 181 HG3 GLN 4 3HG GLN 4 -0.741 -12.019 -11.560 182 HE21 GLN 4 2HE2 GLN 4 1.721 -12.576 -13.589 183 HE22 GLN 4 1HE2 GLN 4 1.298 -14.204 -14.106 184 H HIS 5 H HIS 5 -3.551 -10.980 -11.184 185 HA HIS 5 HA HIS 5 -2.788 -9.591 -8.662 186 HB2 HIS 5 2HB HIS 5 -4.889 -11.708 -9.270 187 HB3 HIS 5 3HB HIS 5 -4.596 -10.991 -7.687 188 HD2 HIS 5 HD2 HIS 5 -5.928 -10.016 -11.198 189 HE1 HIS 5 HE1 HIS 5 -7.148 -6.971 -8.506 190 HE2 HIS 5 HE2 HIS 5 -7.440 -7.899 -10.862 191 H LEU 6 H LEU 6 -1.395 -10.441 -7.210 192 HA LEU 6 HA LEU 6 -0.429 -13.270 -7.495 193 HB2 LEU 6 2HB LEU 6 1.215 -10.725 -7.362 194 HB3 LEU 6 3HB LEU 6 1.883 -12.346 -7.255 195 HG LEU 6 HG LEU 6 0.403 -11.277 -9.701 196 HD11 LEU 6 1HD1 LEU 6 3.326 -11.295 -8.936 197 HD12 LEU 6 2HD1 LEU 6 2.775 -11.136 -10.624 198 HD13 LEU 6 3HD1 LEU 6 2.330 -9.914 -9.415 199 HD21 LEU 6 3HD2 LEU 6 2.177 -13.727 -9.274 200 HD22 LEU 6 1HD2 LEU 6 0.426 -13.753 -9.552 201 HD23 LEU 6 2HD2 LEU 6 1.517 -13.198 -10.829 202 H CYS 7 H CYS 7 -0.210 -14.307 -5.602 203 HA CYS 7 HA CYS 7 0.498 -12.850 -3.149 204 HB2 CYS 7 2HB CYS 7 -2.133 -12.993 -3.681 205 HB3 CYS 7 3HB CYS 7 -1.952 -14.567 -2.928 206 H GLY 8 H GLY 8 1.338 -14.184 -1.527 207 HA2 GLY 8 HA2 GLY 8 2.551 -15.984 -0.687 208 HA3 GLY 8 HA3 GLY 8 1.266 -16.986 -1.372 209 H SER 9 H SER 9 2.087 -18.577 -2.528 210 HA SER 9 HA SER 9 4.711 -18.788 -3.577 211 HB2 SER 9 2HB SER 9 3.051 -20.633 -3.091 212 HB3 SER 9 3HB SER 9 2.243 -20.223 -4.616 213 HG SER 9 HG SER 9 3.801 -21.925 -4.848 214 H HIS 10 H HIS 10 1.729 -17.590 -5.223 215 HA HIS 10 HA HIS 10 2.913 -17.364 -7.834 216 HB2 HIS 10 2HB HIS 10 0.377 -16.768 -6.589 217 HB3 HIS 10 3HB HIS 10 0.917 -15.318 -7.403 218 HD2 HIS 10 HD2 HIS 10 -1.085 -18.228 -8.117 219 HE1 HIS 10 HE1 HIS 10 0.627 -17.317 -11.907 220 HE2 HIS 10 HE2 HIS 10 -1.194 -18.641 -10.714 221 H LEU 11 H LEU 11 2.925 -15.226 -5.031 222 HA LEU 11 HA LEU 11 4.084 -12.957 -6.443 223 HB2 LEU 11 2HB LEU 11 2.570 -12.967 -4.348 224 HB3 LEU 11 3HB LEU 11 3.996 -13.451 -3.440 225 HG LEU 11 HG LEU 11 5.119 -11.322 -4.129 226 HD11 LEU 11 1HD1 LEU 11 2.384 -10.620 -5.302 227 HD12 LEU 11 2HD1 LEU 11 3.760 -9.519 -5.131 228 HD13 LEU 11 3HD1 LEU 11 3.868 -10.864 -6.257 229 HD21 LEU 11 3HD2 LEU 11 3.870 -11.466 -1.999 230 HD22 LEU 11 1HD2 LEU 11 3.669 -9.854 -2.710 231 HD23 LEU 11 2HD2 LEU 11 2.359 -11.033 -2.835 232 H VAL 12 H VAL 12 5.379 -15.525 -4.306 233 HA VAL 12 HA VAL 12 8.157 -14.800 -4.506 234 HB VAL 12 HB VAL 12 6.862 -17.541 -4.191 235 HG11 VAL 12 1HG1 VAL 12 9.767 -16.714 -3.767 236 HG12 VAL 12 2HG1 VAL 12 9.057 -18.258 -3.241 237 HG13 VAL 12 3HG1 VAL 12 9.161 -17.885 -4.962 238 HG21 VAL 12 3HG2 VAL 12 8.070 -15.643 -2.135 239 HG22 VAL 12 1HG2 VAL 12 6.341 -15.958 -2.363 240 HG23 VAL 12 2HG2 VAL 12 7.397 -17.258 -1.806 241 H GLU 13 H GLU 13 6.138 -16.860 -6.637 242 HA GLU 13 HA GLU 13 8.134 -17.413 -8.593 243 HB2 GLU 13 2HB GLU 13 5.115 -17.277 -8.647 244 HB3 GLU 13 3HB GLU 13 6.005 -17.352 -10.162 245 HG2 GLU 13 3HG GLU 13 7.202 -19.381 -9.345 246 HG3 GLU 13 2HG GLU 13 6.217 -19.353 -7.877 247 H ALA 14 H ALA 14 5.798 -14.580 -8.524 248 HA ALA 14 HA ALA 14 6.830 -13.381 -10.849 249 HB1 ALA 14 3HB ALA 14 5.751 -11.357 -9.968 250 HB2 ALA 14 1HB ALA 14 4.745 -12.808 -9.717 251 HB3 ALA 14 2HB ALA 14 5.650 -12.091 -8.355 252 H LEU 15 H LEU 15 7.921 -12.854 -7.441 253 HA LEU 15 HA LEU 15 9.972 -10.982 -8.038 254 HB2 LEU 15 2HB LEU 15 9.394 -12.879 -5.773 255 HB3 LEU 15 3HB LEU 15 11.026 -12.260 -5.896 256 HG LEU 15 HG LEU 15 9.758 -10.926 -4.358 257 HD11 LEU 15 1HD1 LEU 15 10.272 -9.232 -6.838 258 HD12 LEU 15 2HD1 LEU 15 10.285 -8.720 -5.146 259 HD13 LEU 15 3HD1 LEU 15 11.533 -9.830 -5.736 260 HD21 LEU 15 3HD2 LEU 15 7.845 -10.376 -6.657 261 HD22 LEU 15 1HD2 LEU 15 7.502 -11.143 -5.095 262 HD23 LEU 15 2HD2 LEU 15 7.908 -9.425 -5.161 263 H TYR 16 H TYR 16 10.059 -14.542 -8.336 264 HA TYR 16 HA TYR 16 12.862 -14.625 -9.052 265 HB2 TYR 16 2HB TYR 16 11.584 -16.631 -8.368 266 HB3 TYR 16 3HB TYR 16 10.623 -16.508 -9.843 267 HD1 TYR 16 HD1 TYR 16 14.088 -17.100 -8.587 268 HD2 TYR 16 HD2 TYR 16 11.442 -17.172 -11.992 269 HE1 TYR 16 HE1 TYR 16 15.856 -18.207 -9.939 270 HE2 TYR 16 HE2 TYR 16 13.205 -18.268 -13.349 271 HH TYR 16 HH TYR 16 16.424 -19.105 -11.978 272 H LEU 17 H LEU 17 9.854 -14.315 -11.037 273 HA LEU 17 HA LEU 17 11.211 -14.318 -13.561 274 HB2 LEU 17 2HB LEU 17 8.571 -12.962 -12.843 275 HB3 LEU 17 3HB LEU 17 9.142 -13.347 -14.461 276 HG LEU 17 HG LEU 17 8.505 -15.378 -12.327 277 HD11 LEU 17 1HD1 LEU 17 6.491 -14.190 -13.109 278 HD12 LEU 17 2HD1 LEU 17 6.911 -14.576 -14.793 279 HD13 LEU 17 3HD1 LEU 17 6.488 -15.874 -13.654 280 HD21 LEU 17 3HD2 LEU 17 8.602 -17.043 -14.178 281 HD22 LEU 17 1HD2 LEU 17 9.166 -15.766 -15.277 282 HD23 LEU 17 2HD2 LEU 17 10.168 -16.275 -13.900 283 H VAL 18 H VAL 18 10.214 -11.539 -11.529 284 HA VAL 18 HA VAL 18 11.383 -9.604 -13.370 285 HB VAL 18 HB VAL 18 11.299 -8.100 -11.194 286 HG11 VAL 18 1HG1 VAL 18 8.767 -8.906 -12.639 287 HG12 VAL 18 2HG1 VAL 18 9.061 -7.405 -11.719 288 HG13 VAL 18 3HG1 VAL 18 9.968 -7.718 -13.206 289 HG21 VAL 18 3HG2 VAL 18 9.934 -8.598 -9.502 290 HG22 VAL 18 1HG2 VAL 18 9.063 -9.851 -10.413 291 HG23 VAL 18 2HG2 VAL 18 10.712 -10.159 -9.802 292 H CYS 19 H CYS 19 12.617 -11.036 -10.279 293 HA CYS 19 HA CYS 19 15.150 -9.470 -10.686 294 HB2 CYS 19 2HB CYS 19 13.473 -8.920 -8.833 295 HB3 CYS 19 3HB CYS 19 13.907 -10.466 -8.107 296 H GLY 20 H GLY 20 13.992 -12.750 -10.017 297 HA2 GLY 20 HA2 GLY 20 16.595 -13.709 -9.028 298 HA3 GLY 20 HA3 GLY 20 15.139 -14.680 -9.344 299 H GLU 21 H GLU 21 14.666 -14.214 -12.000 300 HA GLU 21 HA GLU 21 16.361 -16.073 -13.237 301 HB2 GLU 21 2HB GLU 21 13.993 -15.519 -13.832 302 HB3 GLU 21 3HB GLU 21 14.562 -14.036 -14.610 303 HG2 GLU 21 2HG GLU 21 15.924 -15.391 -16.185 304 HG3 GLU 21 3HG GLU 21 15.426 -16.870 -15.357 305 H ARG 22 H ARG 22 16.500 -12.490 -13.409 306 HA ARG 22 HA ARG 22 18.592 -12.339 -15.357 307 HB2 ARG 22 2HB ARG 22 18.892 -10.036 -14.608 308 HB3 ARG 22 3HB ARG 22 17.201 -10.437 -14.909 309 HG2 ARG 22 2HG ARG 22 16.705 -10.534 -12.551 310 HG3 ARG 22 3HG ARG 22 18.422 -10.454 -12.120 311 HD2 ARG 22 2HD ARG 22 17.427 -8.325 -11.700 312 HD3 ARG 22 3HD ARG 22 18.563 -8.171 -13.046 313 HE ARG 22 HE ARG 22 16.350 -8.497 -14.465 314 HH11 ARG 22 2HH2 ARG 22 16.604 -6.455 -11.540 315 HH12 ARG 22 1HH2 ARG 22 15.267 -5.456 -12.111 316 HH21 ARG 22 1HH1 ARG 22 14.701 -7.040 -15.043 317 HH22 ARG 22 2HH1 ARG 22 14.319 -5.738 -13.920 318 H GLY 23 H GLY 23 18.753 -13.212 -11.999 319 HA2 GLY 23 HA2 GLY 23 21.688 -12.809 -11.756 320 HA3 GLY 23 HA3 GLY 23 20.563 -13.454 -10.529 321 H HIS 24 H HIS 24 19.314 -15.422 -12.158 322 HA HIS 24 HA HIS 24 21.230 -17.608 -12.032 323 HB2 HIS 24 2HB HIS 24 18.332 -17.310 -12.884 324 HB3 HIS 24 3HB HIS 24 19.210 -18.810 -13.132 325 HD2 HIS 24 HD2 HIS 24 19.176 -16.555 -9.913 326 HE1 HIS 24 HE1 HIS 24 18.003 -20.495 -8.824 327 HE2 HIS 24 HE2 HIS 24 18.513 -18.158 -7.944 328 H PHE 25 H PHE 25 20.017 -15.580 -14.663 329 HA PHE 25 HA PHE 25 20.877 -17.119 -16.887 330 HB2 PHE 25 2HB PHE 25 19.291 -15.263 -17.023 331 HB3 PHE 25 3HB PHE 25 20.533 -14.121 -16.524 332 HD1 PHE 25 HD1 PHE 25 19.806 -16.685 -19.189 333 HD2 PHE 25 HD2 PHE 25 21.767 -12.974 -18.190 334 HE1 PHE 25 HE1 PHE 25 20.481 -16.402 -21.558 335 HE2 PHE 25 HE2 PHE 25 22.422 -12.684 -20.566 336 HZ PHE 25 HZ PHE 25 21.790 -14.399 -22.254 337 H TYR 26 H TYR 26 22.689 -17.088 -18.182 338 HA TYR 26 HA TYR 26 25.135 -15.618 -17.408 339 HB2 TYR 26 2HB TYR 26 25.145 -17.693 -16.094 340 HB3 TYR 26 3HB TYR 26 24.842 -18.642 -17.549 341 HD1 TYR 26 HD2 TYR 26 27.237 -16.070 -16.232 342 HD2 TYR 26 HD1 TYR 26 26.682 -19.578 -18.660 343 HE1 TYR 26 HE2 TYR 26 29.679 -16.128 -16.685 344 HE2 TYR 26 HE1 TYR 26 29.142 -19.700 -19.060 345 HH TYR 26 HH TYR 26 31.193 -18.719 -18.676 346 H THR 27 H THR 27 26.697 -15.554 -19.041 347 HA THR 27 HA THR 27 25.876 -16.358 -21.816 348 HB THR 27 HB THR 27 27.194 -14.357 -22.568 349 HG1 THR 27 HG1 THR 27 28.246 -13.958 -20.579 350 HG21 THR 27 1HG2 THR 27 25.358 -12.786 -22.185 351 HG22 THR 27 2HG2 THR 27 24.713 -14.399 -22.536 352 HG23 THR 27 3HG2 THR 27 24.727 -13.791 -20.865 353 HA PRO 28 HA PRO 28 29.747 -18.701 -21.121 354 HB2 PRO 28 2HB PRO 28 28.635 -19.948 -23.635 355 HB3 PRO 28 3HB PRO 28 29.451 -20.744 -22.250 356 HG2 PRO 28 2HG PRO 28 26.767 -20.840 -22.464 357 HG3 PRO 28 3HG PRO 28 27.519 -20.462 -20.877 358 HD2 PRO 28 2HD PRO 28 26.357 -18.530 -22.913 359 HD3 PRO 28 3HD PRO 28 26.097 -18.595 -21.142 360 H LYS 29 H LYS 29 31.617 -19.106 -22.462 361 HA LYS 29 HA LYS 29 32.232 -16.828 -24.183 362 HB2 LYS 29 2HB LYS 29 33.649 -17.690 -22.261 363 HB3 LYS 29 3HB LYS 29 33.994 -19.127 -23.211 364 HG2 LYS 29 2HG LYS 29 35.842 -17.536 -23.178 365 HG3 LYS 29 3HG LYS 29 35.282 -17.798 -24.820 366 HD2 LYS 29 2HD LYS 29 34.047 -15.652 -24.769 367 HD3 LYS 29 3HD LYS 29 34.532 -15.386 -23.090 368 HE2 LYS 29 2HE LYS 29 36.448 -15.665 -25.457 369 HE3 LYS 29 3HE LYS 29 35.862 -14.122 -24.832 370 HZ1 LYS 29 HZ1 LYS 29 37.485 -16.066 -23.288 371 HZ2 LYS 29 HZ2 LYS 29 38.016 -14.650 -23.902 372 HZ3 LYS 29 HZ3 LYS 29 36.911 -14.649 -22.702 373 H THR 30 H THR 30 30.667 -19.361 -24.962 374 HA THR 30 HA THR 30 31.910 -20.720 -27.139 375 HB THR 30 HB THR 30 28.935 -20.256 -26.721 376 HG1 THR 30 HG1 THR 30 29.089 -22.183 -25.515 377 HG21 THR 30 1HG2 THR 30 29.454 -21.326 -28.890 378 HG22 THR 30 2HG2 THR 30 30.487 -22.519 -28.071 379 HG23 THR 30 3HG2 THR 30 28.732 -22.499 -27.782 Start of MODEL 6 1 H1 GLY 1 1H GLY 1 5.241 -2.860 3.080 2 H2 GLY 1 2H GLY 1 3.802 -3.240 2.396 3 H3 GLY 1 3H GLY 1 4.925 -2.419 1.534 4 HA2 GLY 1 HA2 GLY 1 6.424 -4.301 1.559 5 HA3 GLY 1 HA3 GLY 1 5.221 -5.191 2.509 6 H ILE 2 H ILE 2 6.264 -6.080 0.034 7 HA ILE 2 HA ILE 2 4.881 -5.342 -2.293 8 HB ILE 2 HB ILE 2 6.988 -6.534 -2.270 9 HG12 ILE 2 2HG1 ILE 2 6.727 -8.153 -3.993 10 HG13 ILE 2 3HG1 ILE 2 4.998 -8.340 -3.670 11 HG21 ILE 2 1HG2 ILE 2 5.512 -9.026 -1.321 12 HG22 ILE 2 2HG2 ILE 2 7.216 -8.916 -1.787 13 HG23 ILE 2 3HG2 ILE 2 6.654 -8.065 -0.352 14 HD11 ILE 2 3HD1 ILE 2 6.397 -5.889 -4.798 15 HD12 ILE 2 1HD1 ILE 2 5.412 -7.051 -5.688 16 HD13 ILE 2 2HD1 ILE 2 4.649 -6.000 -4.487 17 H VAL 3 H VAL 3 3.828 -7.738 0.086 18 HA VAL 3 HA VAL 3 1.698 -8.835 -1.467 19 HB VAL 3 HB VAL 3 1.956 -8.572 1.551 20 HG11 VAL 3 1HG1 VAL 3 0.310 -10.410 1.729 21 HG12 VAL 3 2HG1 VAL 3 -0.432 -8.994 0.985 22 HG13 VAL 3 3HG1 VAL 3 0.061 -10.375 -0.024 23 HG21 VAL 3 3HG2 VAL 3 3.739 -9.949 0.472 24 HG22 VAL 3 1HG2 VAL 3 2.655 -10.948 1.443 25 HG23 VAL 3 2HG2 VAL 3 2.491 -10.929 -0.324 26 H GLU 4 H GLU 4 1.862 -5.831 0.436 27 HA GLU 4 HA GLU 4 -0.999 -5.253 0.116 28 HB2 GLU 4 2HB GLU 4 1.286 -3.521 1.111 29 HB3 GLU 4 3HB GLU 4 -0.429 -3.118 1.197 30 HG2 GLU 4 2HG GLU 4 0.908 -5.445 2.645 31 HG3 GLU 4 3HG GLU 4 0.458 -3.903 3.356 32 H GLN 5 H GLN 5 1.501 -5.218 -2.086 33 HA GLN 5 HA GLN 5 0.286 -3.000 -3.695 34 HB2 GLN 5 2HB GLN 5 2.797 -3.049 -3.341 35 HB3 GLN 5 3HB GLN 5 2.836 -4.586 -4.196 36 HG2 GLN 5 2HG GLN 5 3.426 -2.908 -5.763 37 HG3 GLN 5 3HG GLN 5 1.807 -3.438 -6.205 38 HE21 GLN 5 2HE2 GLN 5 3.620 -0.828 -4.472 39 HE22 GLN 5 1HE2 GLN 5 2.390 0.397 -4.760 40 H CYS 6 H CYS 6 1.424 -6.416 -3.996 41 HA CYS 6 HA CYS 6 -0.076 -6.721 -6.503 42 HB2 CYS 6 2HB CYS 6 1.871 -8.398 -4.916 43 HB3 CYS 6 3HB CYS 6 1.086 -8.975 -6.378 44 H CYS 7 H CYS 7 -0.424 -8.146 -3.227 45 HA CYS 7 HA CYS 7 -2.331 -10.126 -4.154 46 HB2 CYS 7 2HB CYS 7 -0.860 -10.272 -2.109 47 HB3 CYS 7 3HB CYS 7 -1.952 -9.127 -1.320 48 H THR 8 H THR 8 -2.697 -6.851 -3.013 49 HA THR 8 HA THR 8 -5.608 -7.042 -2.642 50 HB THR 8 HB THR 8 -4.069 -5.740 -1.156 51 HG1 THR 8 HG1 THR 8 -6.162 -4.356 -2.489 52 HG21 THR 8 1HG2 THR 8 -3.989 -3.725 -3.439 53 HG22 THR 8 2HG2 THR 8 -3.335 -3.528 -1.805 54 HG23 THR 8 3HG2 THR 8 -2.622 -4.725 -2.906 55 H SER 9 H SER 9 -3.447 -5.911 -5.196 56 HA SER 9 HA SER 9 -5.725 -5.144 -6.920 57 HB2 SER 9 2HB SER 9 -3.497 -3.255 -6.107 58 HB3 SER 9 3HB SER 9 -4.618 -2.992 -7.457 59 HG SER 9 HG SER 9 -5.306 -1.903 -5.558 60 H ILE 10 H ILE 10 -4.885 -4.484 -9.168 61 HA ILE 10 HA ILE 10 -3.020 -6.347 -10.314 62 HB ILE 10 HB ILE 10 -3.899 -3.585 -11.269 63 HG12 ILE 10 2HG1 ILE 10 -5.795 -5.198 -11.074 64 HG13 ILE 10 3HG1 ILE 10 -5.502 -4.597 -12.695 65 HG21 ILE 10 1HG2 ILE 10 -3.184 -4.418 -13.555 66 HG22 ILE 10 2HG2 ILE 10 -1.859 -4.101 -12.436 67 HG23 ILE 10 3HG2 ILE 10 -2.375 -5.771 -12.734 68 HD11 ILE 10 3HD1 ILE 10 -4.438 -6.703 -13.359 69 HD12 ILE 10 1HD1 ILE 10 -4.597 -7.319 -11.694 70 HD13 ILE 10 2HD1 ILE 10 -6.043 -7.008 -12.671 71 H CYS 11 H CYS 11 -0.842 -6.413 -10.257 72 HA CYS 11 HA CYS 11 0.624 -3.829 -9.973 73 HB2 CYS 11 2HB CYS 11 2.306 -4.794 -8.652 74 HB3 CYS 11 3HB CYS 11 0.769 -5.177 -7.890 75 H SER 12 H SER 12 2.524 -3.600 -11.081 76 HA SER 12 HA SER 12 2.868 -5.373 -13.484 77 HB2 SER 12 2HB SER 12 3.422 -2.406 -13.177 78 HB3 SER 12 3HB SER 12 3.547 -3.377 -14.654 79 HG SER 12 HG SER 12 1.542 -2.162 -14.447 80 H LEU 13 H LEU 13 4.959 -5.605 -14.421 81 HA LEU 13 HA LEU 13 6.808 -6.532 -12.496 82 HB2 LEU 13 2HB LEU 13 8.256 -6.957 -14.357 83 HB3 LEU 13 3HB LEU 13 6.636 -7.528 -14.685 84 HG LEU 13 HG LEU 13 7.725 -4.919 -15.817 85 HD11 LEU 13 1HD1 LEU 13 7.783 -7.696 -17.068 86 HD12 LEU 13 2HD1 LEU 13 8.262 -6.184 -17.870 87 HD13 LEU 13 3HD1 LEU 13 9.194 -6.782 -16.492 88 HD21 LEU 13 3HD2 LEU 13 6.067 -5.275 -17.626 89 HD22 LEU 13 1HD2 LEU 13 5.409 -6.653 -16.733 90 HD23 LEU 13 2HD2 LEU 13 5.308 -5.004 -16.068 91 H TYR 14 H TYR 14 6.729 -3.542 -14.330 92 HA TYR 14 HA TYR 14 9.352 -2.657 -13.729 93 HB2 TYR 14 2HB TYR 14 8.592 -0.547 -14.677 94 HB3 TYR 14 3HB TYR 14 8.072 -1.942 -15.645 95 HD1 TYR 14 HD1 TYR 14 6.828 0.546 -13.095 96 HD2 TYR 14 HD2 TYR 14 5.833 -2.144 -16.320 97 HE1 TYR 14 HE1 TYR 14 4.497 1.397 -13.085 98 HE2 TYR 14 HE2 TYR 14 3.519 -1.251 -16.351 99 HH TYR 14 HH TYR 14 2.021 0.229 -15.408 100 H GLN 15 H GLN 15 6.713 -2.792 -11.658 101 HA GLN 15 HA GLN 15 7.865 -0.694 -9.847 102 HB2 GLN 15 2HB GLN 15 5.579 -0.416 -8.896 103 HB3 GLN 15 3HB GLN 15 5.731 0.136 -10.570 104 HG2 GLN 15 2HG GLN 15 4.632 -1.849 -11.405 105 HG3 GLN 15 3HG GLN 15 4.623 -2.590 -9.791 106 HE21 GLN 15 2HE2 GLN 15 3.688 0.848 -10.024 107 HE22 GLN 15 1HE2 GLN 15 1.982 0.498 -9.811 108 H LEU 16 H LEU 16 6.669 -4.039 -10.174 109 HA LEU 16 HA LEU 16 6.995 -4.590 -7.365 110 HB2 LEU 16 2HB LEU 16 5.916 -6.466 -7.829 111 HB3 LEU 16 3HB LEU 16 5.561 -5.685 -9.340 112 HG LEU 16 HG LEU 16 7.719 -6.823 -10.222 113 HD11 LEU 16 1HD1 LEU 16 7.365 -8.162 -7.548 114 HD12 LEU 16 2HD1 LEU 16 7.778 -9.206 -8.910 115 HD13 LEU 16 3HD1 LEU 16 8.842 -7.864 -8.497 116 HD21 LEU 16 3HD2 LEU 16 6.408 -8.848 -10.806 117 HD22 LEU 16 1HD2 LEU 16 5.262 -8.504 -9.491 118 HD23 LEU 16 2HD2 LEU 16 5.377 -7.413 -10.888 119 H GLU 17 H GLU 17 9.170 -4.657 -10.151 120 HA GLU 17 HA GLU 17 11.459 -5.949 -9.091 121 HB2 GLU 17 2HB GLU 17 11.141 -3.490 -10.868 122 HB3 GLU 17 3HB GLU 17 12.729 -4.010 -10.311 123 HG2 GLU 17 2HG GLU 17 12.229 -6.305 -11.271 124 HG3 GLU 17 3HG GLU 17 10.859 -5.535 -12.091 125 H ASN 18 H ASN 18 9.982 -2.923 -8.152 126 HA ASN 18 HA ASN 18 12.235 -1.609 -6.987 127 HB2 ASN 18 2HB ASN 18 9.289 -1.408 -6.308 128 HB3 ASN 18 3HB ASN 18 10.520 -0.337 -5.751 129 HD21 ASN 18 2HD2 ASN 18 8.507 0.853 -7.101 130 HD22 ASN 18 1HD2 ASN 18 9.133 1.388 -8.659 131 H TYR 19 H TYR 19 10.189 -4.198 -5.814 132 HA TYR 19 HA TYR 19 11.024 -4.036 -3.011 133 HB2 TYR 19 2HB TYR 19 9.246 -5.975 -4.544 134 HB3 TYR 19 3HB TYR 19 9.436 -5.915 -2.802 135 HD1 TYR 19 HD2 TYR 19 8.155 -3.944 -5.763 136 HD2 TYR 19 HD1 TYR 19 8.238 -4.348 -1.457 137 HE1 TYR 19 HE2 TYR 19 6.339 -2.279 -5.566 138 HE2 TYR 19 HE1 TYR 19 6.397 -2.690 -1.272 139 HH TYR 19 HH TYR 19 4.975 -1.284 -2.396 140 H CYS 20 H CYS 20 12.580 -5.163 -5.715 141 HA CYS 20 HA CYS 20 13.858 -7.576 -4.728 142 HB2 CYS 20 2HB CYS 20 13.652 -6.739 -7.117 143 HB3 CYS 20 3HB CYS 20 14.832 -5.495 -6.726 144 H ASN 21 H ASN 21 14.302 -4.179 -4.096 145 HA ASN 21 HA ASN 21 17.037 -4.217 -3.155 146 HB2 ASN 21 2HB ASN 21 14.759 -2.235 -2.687 147 HB3 ASN 21 3HB ASN 21 16.434 -1.970 -2.234 148 HD21 ASN 21 2HD2 ASN 21 14.152 -1.784 -4.825 149 HD22 ASN 21 1HD2 ASN 21 15.313 -1.260 -6.045 150 H1 PHE 1 1H PHE 1 5.155 -12.260 -19.704 151 H2 PHE 1 2H PHE 1 6.581 -11.830 -19.018 152 H3 PHE 1 3H PHE 1 5.681 -10.717 -19.819 153 HA PHE 1 HA PHE 1 4.889 -12.081 -17.339 154 HB2 PHE 1 2HB PHE 1 6.749 -10.366 -17.125 155 HB3 PHE 1 3HB PHE 1 5.626 -9.146 -17.697 156 HD1 PHE 1 HD2 PHE 1 6.470 -11.468 -14.921 157 HD2 PHE 1 HD1 PHE 1 3.870 -8.262 -16.198 158 HE1 PHE 1 HE2 PHE 1 5.719 -11.133 -12.581 159 HE2 PHE 1 HE1 PHE 1 3.145 -7.926 -13.852 160 HZ PHE 1 HZ PHE 1 4.054 -9.363 -12.045 161 H VAL 2 H VAL 2 2.881 -11.230 -16.378 162 HA VAL 2 HA VAL 2 1.108 -9.640 -18.179 163 HB VAL 2 HB VAL 2 0.224 -12.129 -16.650 164 HG11 VAL 2 1HG1 VAL 2 -1.411 -10.134 -18.287 165 HG12 VAL 2 2HG1 VAL 2 -2.018 -11.679 -17.652 166 HG13 VAL 2 3HG1 VAL 2 -1.533 -10.405 -16.535 167 HG21 VAL 2 3HG2 VAL 2 0.297 -11.565 -19.646 168 HG22 VAL 2 1HG2 VAL 2 1.311 -12.734 -18.768 169 HG23 VAL 2 2HG2 VAL 2 -0.431 -12.995 -18.882 170 H ASN 3 H ASN 3 0.463 -7.881 -17.133 171 HA ASN 3 HA ASN 3 0.949 -7.453 -14.308 172 HB2 ASN 3 2HB ASN 3 -0.730 -5.837 -16.259 173 HB3 ASN 3 3HB ASN 3 -0.173 -5.298 -14.681 174 HD21 ASN 3 1HD2 ASN 3 0.369 -4.120 -17.374 175 HD22 ASN 3 2HD2 ASN 3 2.116 -4.123 -17.531 176 H GLN 4 H GLN 4 -0.287 -8.152 -12.653 177 HA GLN 4 HA GLN 4 -3.174 -8.612 -12.907 178 HB2 GLN 4 2HB GLN 4 -3.107 -11.001 -12.778 179 HB3 GLN 4 3HB GLN 4 -2.141 -10.510 -14.156 180 HG2 GLN 4 2HG GLN 4 -0.082 -10.704 -12.588 181 HG3 GLN 4 3HG GLN 4 -1.166 -11.484 -11.445 182 HE21 GLN 4 2HE2 GLN 4 0.883 -11.999 -14.123 183 HE22 GLN 4 1HE2 GLN 4 0.419 -13.675 -14.412 184 H HIS 5 H HIS 5 -3.841 -10.070 -10.943 185 HA HIS 5 HA HIS 5 -2.735 -8.942 -8.434 186 HB2 HIS 5 2HB HIS 5 -4.983 -10.939 -8.935 187 HB3 HIS 5 3HB HIS 5 -4.536 -10.253 -7.377 188 HD2 HIS 5 HD2 HIS 5 -6.088 -9.187 -10.772 189 HE1 HIS 5 HE1 HIS 5 -7.211 -6.267 -7.882 190 HE2 HIS 5 HE2 HIS 5 -7.558 -7.060 -10.285 191 H LEU 6 H LEU 6 -1.191 -9.991 -7.267 192 HA LEU 6 HA LEU 6 -0.621 -12.897 -7.773 193 HB2 LEU 6 2HB LEU 6 1.406 -10.645 -7.563 194 HB3 LEU 6 3HB LEU 6 1.801 -12.354 -7.536 195 HG LEU 6 HG LEU 6 0.496 -10.907 -9.884 196 HD11 LEU 6 1HD1 LEU 6 3.362 -11.727 -9.324 197 HD12 LEU 6 2HD1 LEU 6 2.773 -11.181 -10.912 198 HD13 LEU 6 3HD1 LEU 6 2.750 -10.074 -9.524 199 HD21 LEU 6 3HD2 LEU 6 1.706 -13.706 -9.629 200 HD22 LEU 6 1HD2 LEU 6 -0.014 -13.334 -9.895 201 HD23 LEU 6 2HD2 LEU 6 1.177 -12.955 -11.146 202 H CYS 7 H CYS 7 -0.434 -14.106 -6.009 203 HA CYS 7 HA CYS 7 0.388 -13.040 -3.425 204 HB2 CYS 7 2HB CYS 7 -2.126 -12.452 -3.891 205 HB3 CYS 7 3HB CYS 7 -2.427 -14.144 -3.535 206 H GLY 8 H GLY 8 0.652 -14.724 -1.803 207 HA2 GLY 8 HA2 GLY 8 1.395 -16.823 -1.134 208 HA3 GLY 8 HA3 GLY 8 0.279 -17.521 -2.323 209 H SER 9 H SER 9 1.574 -19.041 -3.237 210 HA SER 9 HA SER 9 4.289 -18.901 -3.937 211 HB2 SER 9 3HB SER 9 2.091 -20.366 -5.443 212 HB3 SER 9 2HB SER 9 3.823 -20.742 -5.456 213 HG SER 9 HG SER 9 2.649 -22.094 -3.991 214 H HIS 10 H HIS 10 1.489 -17.807 -5.910 215 HA HIS 10 HA HIS 10 2.811 -17.398 -8.343 216 HB2 HIS 10 2HB HIS 10 0.253 -16.802 -7.179 217 HB3 HIS 10 3HB HIS 10 0.833 -15.302 -7.857 218 HD2 HIS 10 HD2 HIS 10 -1.202 -18.080 -8.872 219 HE1 HIS 10 HE1 HIS 10 0.710 -16.978 -12.512 220 HE2 HIS 10 HE2 HIS 10 -1.207 -18.313 -11.492 221 H LEU 11 H LEU 11 2.678 -15.265 -5.543 222 HA LEU 11 HA LEU 11 3.991 -12.992 -6.761 223 HB2 LEU 11 2HB LEU 11 2.442 -13.119 -4.680 224 HB3 LEU 11 3HB LEU 11 3.830 -13.756 -3.814 225 HG LEU 11 HG LEU 11 5.088 -11.651 -4.304 226 HD11 LEU 11 1HD1 LEU 11 3.902 -10.893 -6.362 227 HD12 LEU 11 2HD1 LEU 11 2.406 -10.705 -5.414 228 HD13 LEU 11 3HD1 LEU 11 3.803 -9.668 -5.098 229 HD21 LEU 11 3HD2 LEU 11 2.368 -11.263 -2.966 230 HD22 LEU 11 1HD2 LEU 11 3.827 -11.929 -2.193 231 HD23 LEU 11 2HD2 LEU 11 3.796 -10.239 -2.728 232 H VAL 12 H VAL 12 5.152 -15.941 -5.275 233 HA VAL 12 HA VAL 12 7.863 -14.870 -4.712 234 HB VAL 12 HB VAL 12 6.700 -17.674 -4.388 235 HG11 VAL 12 1HG1 VAL 12 9.403 -16.560 -3.522 236 HG12 VAL 12 2HG1 VAL 12 8.728 -18.123 -3.007 237 HG13 VAL 12 3HG1 VAL 12 9.116 -17.857 -4.707 238 HG21 VAL 12 3HG2 VAL 12 5.717 -16.038 -2.818 239 HG22 VAL 12 1HG2 VAL 12 6.773 -17.167 -1.968 240 HG23 VAL 12 2HG2 VAL 12 7.341 -15.520 -2.323 241 H GLU 13 H GLU 13 6.152 -17.026 -6.969 242 HA GLU 13 HA GLU 13 8.189 -17.704 -8.792 243 HB2 GLU 13 3HB GLU 13 5.275 -17.625 -8.594 244 HB3 GLU 13 2HB GLU 13 5.711 -16.938 -10.073 245 HG2 GLU 13 2HG GLU 13 7.123 -18.983 -10.587 246 HG3 GLU 13 3HG GLU 13 6.645 -19.639 -9.013 247 H ALA 14 H ALA 14 5.978 -14.799 -8.780 248 HA ALA 14 HA ALA 14 7.190 -13.514 -10.960 249 HB1 ALA 14 3HB ALA 14 5.755 -12.354 -8.545 250 HB2 ALA 14 1HB ALA 14 6.012 -11.535 -10.104 251 HB3 ALA 14 2HB ALA 14 5.010 -13.009 -10.024 252 H LEU 15 H LEU 15 7.945 -12.974 -7.434 253 HA LEU 15 HA LEU 15 10.068 -11.160 -7.980 254 HB2 LEU 15 2HB LEU 15 9.336 -12.900 -5.623 255 HB3 LEU 15 3HB LEU 15 10.944 -12.209 -5.674 256 HG LEU 15 HG LEU 15 9.522 -10.824 -4.349 257 HD11 LEU 15 1HD1 LEU 15 11.306 -9.712 -5.702 258 HD12 LEU 15 2HD1 LEU 15 10.091 -9.302 -6.932 259 HD13 LEU 15 3HD1 LEU 15 9.953 -8.644 -5.302 260 HD21 LEU 15 3HD2 LEU 15 7.651 -9.501 -5.395 261 HD22 LEU 15 1HD2 LEU 15 7.708 -10.595 -6.776 262 HD23 LEU 15 2HD2 LEU 15 7.337 -11.219 -5.152 263 H TYR 16 H TYR 16 10.200 -14.762 -8.006 264 HA TYR 16 HA TYR 16 13.063 -14.788 -8.438 265 HB2 TYR 16 2HB TYR 16 11.807 -16.824 -7.837 266 HB3 TYR 16 3HB TYR 16 10.909 -16.737 -9.350 267 HD1 TYR 16 HD2 TYR 16 14.301 -17.290 -7.894 268 HD2 TYR 16 HD1 TYR 16 11.867 -17.465 -11.451 269 HE1 TYR 16 HE2 TYR 16 16.121 -18.507 -9.081 270 HE2 TYR 16 HE1 TYR 16 13.678 -18.671 -12.641 271 HH TYR 16 HH TYR 16 15.802 -19.554 -12.503 272 H LEU 17 H LEU 17 10.304 -14.491 -10.675 273 HA LEU 17 HA LEU 17 11.915 -14.615 -13.044 274 HB2 LEU 17 2HB LEU 17 9.077 -13.590 -12.534 275 HB3 LEU 17 3HB LEU 17 9.752 -13.809 -14.139 276 HG LEU 17 HG LEU 17 9.694 -16.111 -12.183 277 HD11 LEU 17 1HD1 LEU 17 7.363 -15.349 -12.253 278 HD12 LEU 17 2HD1 LEU 17 7.399 -15.364 -14.033 279 HD13 LEU 17 3HD1 LEU 17 7.546 -16.873 -13.096 280 HD21 LEU 17 3HD2 LEU 17 9.638 -16.019 -15.221 281 HD22 LEU 17 1HD2 LEU 17 11.058 -16.383 -14.215 282 HD23 LEU 17 2HD2 LEU 17 9.673 -17.484 -14.216 283 H VAL 18 H VAL 18 10.638 -11.809 -11.251 284 HA VAL 18 HA VAL 18 11.983 -9.974 -13.148 285 HB VAL 18 HB VAL 18 11.058 -8.476 -10.867 286 HG11 VAL 18 1HG1 VAL 18 11.298 -7.662 -13.188 287 HG12 VAL 18 2HG1 VAL 18 9.902 -8.659 -13.661 288 HG13 VAL 18 3HG1 VAL 18 9.710 -7.341 -12.469 289 HG21 VAL 18 3HG2 VAL 18 8.632 -8.884 -11.124 290 HG22 VAL 18 1HG2 VAL 18 9.000 -10.446 -11.866 291 HG23 VAL 18 2HG2 VAL 18 9.555 -10.064 -10.194 292 H CYS 19 H CYS 19 12.526 -10.999 -9.751 293 HA CYS 19 HA CYS 19 14.827 -9.114 -9.558 294 HB2 CYS 19 2HB CYS 19 13.149 -8.946 -7.809 295 HB3 CYS 19 3HB CYS 19 13.289 -10.652 -7.445 296 H GLY 20 H GLY 20 14.025 -12.607 -9.155 297 HA2 GLY 20 HA2 GLY 20 16.679 -13.331 -8.246 298 HA3 GLY 20 HA3 GLY 20 15.387 -14.448 -8.748 299 H GLU 21 H GLU 21 15.117 -13.455 -11.429 300 HA GLU 21 HA GLU 21 17.213 -14.763 -12.828 301 HB2 GLU 21 2HB GLU 21 14.825 -14.388 -13.558 302 HB3 GLU 21 3HB GLU 21 15.254 -12.710 -13.930 303 HG2 GLU 21 2HG GLU 21 16.890 -13.487 -15.605 304 HG3 GLU 21 3HG GLU 21 16.598 -15.167 -15.146 305 H ARG 22 H ARG 22 16.986 -11.455 -11.675 306 HA ARG 22 HA ARG 22 19.247 -10.514 -13.335 307 HB2 ARG 22 2HB ARG 22 17.506 -9.051 -11.307 308 HB3 ARG 22 3HB ARG 22 18.825 -8.343 -12.241 309 HG2 ARG 22 2HG ARG 22 17.577 -9.042 -14.363 310 HG3 ARG 22 3HG ARG 22 16.221 -9.499 -13.326 311 HD2 ARG 22 2HD ARG 22 15.770 -7.298 -14.148 312 HD3 ARG 22 3HD ARG 22 16.182 -7.132 -12.434 313 HE ARG 22 HE ARG 22 18.534 -6.854 -14.066 314 HH11 ARG 22 2HH1 ARG 22 15.625 -4.964 -13.264 315 HH12 ARG 22 1HH1 ARG 22 16.459 -3.457 -13.528 316 HH21 ARG 22 1HH2 ARG 22 19.512 -4.873 -14.380 317 HH22 ARG 22 2HH2 ARG 22 18.609 -3.406 -14.158 318 H GLY 23 H GLY 23 18.426 -10.886 -9.856 319 HA2 GLY 23 HA2 GLY 23 21.272 -10.494 -9.045 320 HA3 GLY 23 HA3 GLY 23 19.839 -10.448 -7.998 321 H HIS 24 H HIS 24 22.244 -12.446 -9.481 322 HA HIS 24 HA HIS 24 20.999 -14.987 -8.891 323 HB2 HIS 24 2HB HIS 24 23.882 -14.375 -9.636 324 HB3 HIS 24 3HB HIS 24 23.043 -15.914 -9.825 325 HD2 HIS 24 HD2 HIS 24 20.320 -14.601 -11.165 326 HE1 HIS 24 HE1 HIS 24 22.951 -13.307 -14.243 327 HE2 HIS 24 HE2 HIS 24 20.505 -13.675 -13.606 328 H PHE 25 H PHE 25 22.886 -12.900 -6.932 329 HA PHE 25 HA PHE 25 22.956 -14.698 -4.656 330 HB2 PHE 25 2HB PHE 25 24.908 -15.525 -5.959 331 HB3 PHE 25 3HB PHE 25 25.567 -13.897 -6.012 332 HD1 PHE 25 HD1 PHE 25 24.389 -16.491 -3.538 333 HD2 PHE 25 HD2 PHE 25 27.167 -13.297 -4.375 334 HE1 PHE 25 HE1 PHE 25 25.546 -16.928 -1.386 335 HE2 PHE 25 HE2 PHE 25 28.332 -13.755 -2.234 336 HZ PHE 25 HZ PHE 25 27.519 -15.561 -0.729 337 H TYR 26 H TYR 26 23.632 -13.621 -2.704 338 HA TYR 26 HA TYR 26 24.045 -10.683 -2.769 339 HB2 TYR 26 2HB TYR 26 21.626 -11.034 -2.711 340 HB3 TYR 26 3HB TYR 26 21.794 -12.144 -1.347 341 HD1 TYR 26 HD2 TYR 26 22.683 -8.649 -2.378 342 HD2 TYR 26 HD1 TYR 26 21.578 -11.294 0.833 343 HE1 TYR 26 HE2 TYR 26 22.628 -6.716 -0.820 344 HE2 TYR 26 HE1 TYR 26 21.446 -9.355 2.395 345 HH TYR 26 HH TYR 26 21.693 -7.074 2.640 346 H THR 27 H THR 27 24.991 -9.853 -0.969 347 HA THR 27 HA THR 27 26.087 -11.720 1.103 348 HB THR 27 HB THR 27 27.977 -10.098 1.310 349 HG1 THR 27 HG1 THR 27 26.833 -8.427 0.113 350 HG21 THR 27 1HG2 THR 27 28.203 -12.247 0.084 351 HG22 THR 27 2HG2 THR 27 27.696 -11.438 -1.417 352 HG23 THR 27 3HG2 THR 27 29.208 -10.965 -0.614 353 HA PRO 28 HA PRO 28 23.612 -8.775 3.520 354 HB2 PRO 28 2HB PRO 28 23.270 -10.210 5.791 355 HB3 PRO 28 3HB PRO 28 22.440 -10.651 4.268 356 HG2 PRO 28 2HG PRO 28 25.016 -11.806 5.380 357 HG3 PRO 28 3HG PRO 28 23.576 -12.697 4.788 358 HD2 PRO 28 2HD PRO 28 25.766 -12.228 3.215 359 HD3 PRO 28 3HD PRO 28 24.108 -12.244 2.536 360 H LYS 29 H LYS 29 23.964 -7.435 5.295 361 HA LYS 29 HA LYS 29 25.062 -6.120 6.718 362 HB2 LYS 29 3HB LYS 29 25.174 -8.504 7.812 363 HB3 LYS 29 2HB LYS 29 26.907 -8.397 7.483 364 HG2 LYS 29 2HG LYS 29 27.029 -6.339 8.892 365 HG3 LYS 29 3HG LYS 29 25.274 -6.369 9.087 366 HD2 LYS 29 2HD LYS 29 26.319 -7.226 11.085 367 HD3 LYS 29 3HD LYS 29 25.442 -8.537 10.285 368 HE2 LYS 29 2HE LYS 29 27.572 -9.374 9.311 369 HE3 LYS 29 3HE LYS 29 28.450 -8.033 10.059 370 HZ1 LYS 29 HZ1 LYS 29 28.616 -10.052 11.385 371 HZ2 LYS 29 HZ2 LYS 29 27.810 -8.915 12.234 372 HZ3 LYS 29 HZ3 LYS 29 26.994 -10.153 11.542 373 H THR 30 H THR 30 26.304 -6.654 3.991 374 HA THR 30 HA THR 30 29.055 -5.637 4.185 375 HB THR 30 HB THR 30 27.227 -5.945 1.776 376 HG1 THR 30 HG1 THR 30 28.529 -7.789 1.469 377 HG21 THR 30 1HG2 THR 30 29.046 -4.356 1.270 378 HG22 THR 30 2HG2 THR 30 29.359 -5.902 0.478 379 HG23 THR 30 3HG2 THR 30 30.243 -5.474 1.962 Start of MODEL 7 1 H1 GLY 1 1H GLY 1 3.986 -1.849 1.192 2 H2 GLY 1 2H GLY 1 4.510 -2.105 2.726 3 H3 GLY 1 3H GLY 1 3.127 -2.809 2.208 4 HA2 GLY 1 HA2 GLY 1 5.864 -3.398 1.263 5 HA3 GLY 1 HA3 GLY 1 4.853 -4.460 2.260 6 H ILE 2 H ILE 2 5.878 -5.513 0.010 7 HA ILE 2 HA ILE 2 4.671 -5.063 -2.473 8 HB ILE 2 HB ILE 2 6.740 -6.253 -2.202 9 HG12 ILE 2 2HG1 ILE 2 6.471 -8.224 -3.654 10 HG13 ILE 2 3HG1 ILE 2 4.725 -8.147 -3.448 11 HG21 ILE 2 1HG2 ILE 2 6.967 -8.525 -1.370 12 HG22 ILE 2 2HG2 ILE 2 6.318 -7.495 -0.100 13 HG23 ILE 2 3HG2 ILE 2 5.242 -8.606 -0.986 14 HD11 ILE 2 3HD1 ILE 2 5.429 -7.230 -5.582 15 HD12 ILE 2 1HD1 ILE 2 4.695 -5.944 -4.606 16 HD13 ILE 2 2HD1 ILE 2 6.467 -6.052 -4.777 17 H VAL 3 H VAL 3 3.500 -7.267 0.037 18 HA VAL 3 HA VAL 3 1.462 -8.505 -1.517 19 HB VAL 3 HB VAL 3 1.577 -8.016 1.484 20 HG11 VAL 3 1HG1 VAL 3 -0.763 -8.577 0.847 21 HG12 VAL 3 2HG1 VAL 3 -0.167 -10.015 -0.022 22 HG13 VAL 3 3HG1 VAL 3 -0.003 -9.894 1.738 23 HG21 VAL 3 3HG2 VAL 3 2.355 -10.377 1.582 24 HG22 VAL 3 1HG2 VAL 3 2.311 -10.468 -0.191 25 HG23 VAL 3 2HG2 VAL 3 3.463 -9.391 0.628 26 H GLU 4 H GLU 4 1.517 -5.358 0.103 27 HA GLU 4 HA GLU 4 -1.357 -4.876 -0.267 28 HB2 GLU 4 2HB GLU 4 0.864 -2.991 0.566 29 HB3 GLU 4 3HB GLU 4 -0.874 -2.692 0.682 30 HG2 GLU 4 2HG GLU 4 -1.146 -4.405 2.370 31 HG3 GLU 4 3HG GLU 4 0.531 -4.932 2.202 32 H GLN 5 H GLN 5 1.230 -4.896 -2.418 33 HA GLN 5 HA GLN 5 -0.043 -2.838 -4.183 34 HB2 GLN 5 2HB GLN 5 2.435 -2.649 -3.691 35 HB3 GLN 5 3HB GLN 5 2.660 -4.213 -4.472 36 HG2 GLN 5 2HG GLN 5 3.194 -2.446 -6.038 37 HG3 GLN 5 3HG GLN 5 1.761 -3.288 -6.597 38 HE21 GLN 5 2HE2 GLN 5 1.496 -1.240 -7.954 39 HE22 GLN 5 1HE2 GLN 5 0.682 0.109 -7.168 40 H CYS 6 H CYS 6 1.126 -6.244 -4.099 41 HA CYS 6 HA CYS 6 -0.164 -6.773 -6.714 42 HB2 CYS 6 2HB CYS 6 1.722 -8.293 -4.911 43 HB3 CYS 6 3HB CYS 6 1.050 -8.947 -6.395 44 H CYS 7 H CYS 7 -0.568 -8.010 -3.356 45 HA CYS 7 HA CYS 7 -2.394 -10.083 -4.237 46 HB2 CYS 7 2HB CYS 7 -0.922 -10.104 -2.187 47 HB3 CYS 7 3HB CYS 7 -2.070 -8.998 -1.430 48 H THR 8 H THR 8 -2.887 -6.788 -3.313 49 HA THR 8 HA THR 8 -5.828 -7.064 -3.051 50 HB THR 8 HB THR 8 -4.320 -5.794 -1.435 51 HG1 THR 8 HG1 THR 8 -5.904 -4.204 -1.193 52 HG21 THR 8 1HG2 THR 8 -2.964 -4.641 -3.208 53 HG22 THR 8 2HG2 THR 8 -4.393 -3.659 -3.600 54 HG23 THR 8 3HG2 THR 8 -3.661 -3.552 -1.988 55 H SER 9 H SER 9 -3.570 -6.157 -5.534 56 HA SER 9 HA SER 9 -5.666 -5.215 -7.339 57 HB2 SER 9 2HB SER 9 -4.515 -3.021 -7.728 58 HB3 SER 9 3HB SER 9 -5.374 -3.168 -6.200 59 HG SER 9 HG SER 9 -2.564 -3.656 -6.359 60 H ILE 10 H ILE 10 -4.741 -4.580 -9.528 61 HA ILE 10 HA ILE 10 -2.754 -6.467 -10.487 62 HB ILE 10 HB ILE 10 -3.750 -3.869 -11.730 63 HG12 ILE 10 2HG1 ILE 10 -5.614 -5.469 -11.381 64 HG13 ILE 10 3HG1 ILE 10 -5.306 -5.051 -13.055 65 HG21 ILE 10 1HG2 ILE 10 -2.950 -4.925 -13.900 66 HG22 ILE 10 2HG2 ILE 10 -1.642 -4.511 -12.798 67 HG23 ILE 10 3HG2 ILE 10 -2.180 -6.195 -12.928 68 HD11 ILE 10 3HD1 ILE 10 -4.256 -7.203 -13.487 69 HD12 ILE 10 1HD1 ILE 10 -4.360 -7.631 -11.759 70 HD13 ILE 10 2HD1 ILE 10 -5.834 -7.454 -12.735 71 H CYS 11 H CYS 11 -0.610 -6.370 -10.125 72 HA CYS 11 HA CYS 11 0.676 -3.680 -9.815 73 HB2 CYS 11 2HB CYS 11 2.441 -4.719 -8.609 74 HB3 CYS 11 3HB CYS 11 0.897 -5.101 -7.860 75 H SER 12 H SER 12 2.496 -3.162 -10.965 76 HA SER 12 HA SER 12 2.903 -4.714 -13.491 77 HB2 SER 12 2HB SER 12 3.760 -1.885 -12.812 78 HB3 SER 12 3HB SER 12 3.990 -2.730 -14.343 79 HG SER 12 HG SER 12 1.500 -2.017 -13.130 80 H LEU 13 H LEU 13 4.982 -5.186 -14.320 81 HA LEU 13 HA LEU 13 6.573 -6.498 -12.376 82 HB2 LEU 13 2HB LEU 13 8.035 -7.041 -14.154 83 HB3 LEU 13 3HB LEU 13 6.382 -7.325 -14.615 84 HG LEU 13 HG LEU 13 7.858 -4.825 -15.521 85 HD11 LEU 13 1HD1 LEU 13 8.501 -6.051 -17.558 86 HD12 LEU 13 2HD1 LEU 13 9.224 -6.783 -16.116 87 HD13 LEU 13 3HD1 LEU 13 7.816 -7.549 -16.885 88 HD21 LEU 13 3HD2 LEU 13 6.323 -5.000 -17.482 89 HD22 LEU 13 1HD2 LEU 13 5.496 -6.356 -16.691 90 HD23 LEU 13 2HD2 LEU 13 5.460 -4.727 -15.975 91 H TYR 14 H TYR 14 7.000 -3.400 -13.921 92 HA TYR 14 HA TYR 14 9.696 -2.974 -13.107 93 HB2 TYR 14 2HB TYR 14 9.343 -0.732 -13.962 94 HB3 TYR 14 3HB TYR 14 8.649 -1.947 -15.051 95 HD1 TYR 14 HD1 TYR 14 7.772 0.615 -12.446 96 HD2 TYR 14 HD2 TYR 14 6.387 -1.800 -15.743 97 HE1 TYR 14 HE1 TYR 14 5.612 1.842 -12.435 98 HE2 TYR 14 HE2 TYR 14 4.241 -0.547 -15.758 99 HH TYR 14 HH TYR 14 2.980 1.099 -14.760 100 H GLN 15 H GLN 15 6.895 -2.856 -11.247 101 HA GLN 15 HA GLN 15 8.123 -0.968 -9.253 102 HB2 GLN 15 2HB GLN 15 5.813 -0.539 -8.420 103 HB3 GLN 15 3HB GLN 15 6.124 0.074 -10.049 104 HG2 GLN 15 2HG GLN 15 4.920 -1.757 -11.050 105 HG3 GLN 15 3HG GLN 15 4.718 -2.568 -9.483 106 HE21 GLN 15 2HE2 GLN 15 4.086 0.949 -10.128 107 HE22 GLN 15 1HE2 GLN 15 2.368 0.769 -9.825 108 H LEU 16 H LEU 16 6.428 -4.106 -9.744 109 HA LEU 16 HA LEU 16 6.438 -4.833 -6.993 110 HB2 LEU 16 2HB LEU 16 5.385 -6.703 -7.747 111 HB3 LEU 16 3HB LEU 16 5.220 -5.747 -9.194 112 HG LEU 16 HG LEU 16 7.477 -6.906 -9.897 113 HD11 LEU 16 1HD1 LEU 16 6.337 -8.902 -7.884 114 HD12 LEU 16 2HD1 LEU 16 7.627 -9.257 -9.050 115 HD13 LEU 16 3HD1 LEU 16 7.905 -8.101 -7.753 116 HD21 LEU 16 3HD2 LEU 16 6.334 -8.642 -11.035 117 HD22 LEU 16 1HD2 LEU 16 4.983 -8.648 -9.867 118 HD23 LEU 16 2HD2 LEU 16 5.194 -7.276 -10.964 119 H GLU 17 H GLU 17 8.913 -5.202 -9.526 120 HA GLU 17 HA GLU 17 10.607 -6.835 -7.881 121 HB2 GLU 17 2HB GLU 17 12.088 -6.850 -9.673 122 HB3 GLU 17 3HB GLU 17 10.440 -6.814 -10.311 123 HG2 GLU 17 2HG GLU 17 11.571 -5.461 -11.775 124 HG3 GLU 17 3HG GLU 17 10.729 -4.347 -10.715 125 H ASN 18 H ASN 18 10.082 -3.458 -7.984 126 HA ASN 18 HA ASN 18 12.504 -2.445 -6.930 127 HB2 ASN 18 2HB ASN 18 10.104 -1.369 -7.654 128 HB3 ASN 18 3HB ASN 18 9.894 -1.350 -5.907 129 HD21 ASN 18 1HD2 ASN 18 11.958 -0.314 -8.614 130 HD22 ASN 18 2HD2 ASN 18 12.704 1.029 -7.770 131 H TYR 19 H TYR 19 9.947 -4.312 -5.400 132 HA TYR 19 HA TYR 19 10.776 -3.884 -2.640 133 HB2 TYR 19 2HB TYR 19 8.892 -5.887 -3.945 134 HB3 TYR 19 3HB TYR 19 9.085 -5.662 -2.223 135 HD1 TYR 19 HD1 TYR 19 7.766 -4.077 -5.334 136 HD2 TYR 19 HD2 TYR 19 8.093 -3.824 -1.037 137 HE1 TYR 19 HE1 TYR 19 6.056 -2.299 -5.318 138 HE2 TYR 19 HE2 TYR 19 6.339 -2.056 -1.017 139 HH TYR 19 HH TYR 19 4.795 -0.854 -4.023 140 H CYS 20 H CYS 20 12.177 -5.728 -5.124 141 HA CYS 20 HA CYS 20 13.012 -8.070 -3.637 142 HB2 CYS 20 2HB CYS 20 12.892 -7.720 -6.166 143 HB3 CYS 20 3HB CYS 20 14.354 -6.749 -6.017 144 H ASN 21 H ASN 21 14.154 -4.784 -3.731 145 HA ASN 21 HA ASN 21 16.888 -5.160 -2.909 146 HB2 ASN 21 2HB ASN 21 15.034 -2.741 -2.698 147 HB3 ASN 21 3HB ASN 21 16.764 -2.714 -2.397 148 HD21 ASN 21 2HD2 ASN 21 14.326 -2.579 -4.847 149 HD22 ASN 21 1HD2 ASN 21 15.448 -2.500 -6.206 150 H1 PHE 1 1H PHE 1 6.951 -11.676 -19.339 151 H2 PHE 1 2H PHE 1 5.996 -10.499 -19.967 152 H3 PHE 1 3H PHE 1 5.513 -12.059 -20.023 153 HA PHE 1 HA PHE 1 5.326 -12.177 -17.646 154 HB2 PHE 1 2HB PHE 1 7.156 -10.464 -17.287 155 HB3 PHE 1 3HB PHE 1 5.995 -9.204 -17.667 156 HD1 PHE 1 HD2 PHE 1 6.939 -11.866 -15.244 157 HD2 PHE 1 HD1 PHE 1 4.315 -8.519 -16.008 158 HE1 PHE 1 HE2 PHE 1 6.229 -11.870 -12.866 159 HE2 PHE 1 HE1 PHE 1 3.613 -8.534 -13.631 160 HZ PHE 1 HZ PHE 1 4.558 -10.212 -12.061 161 H VAL 2 H VAL 2 3.350 -11.417 -16.481 162 HA VAL 2 HA VAL 2 1.439 -9.805 -18.124 163 HB VAL 2 HB VAL 2 0.739 -12.395 -16.667 164 HG11 VAL 2 1HG1 VAL 2 -1.054 -10.408 -18.143 165 HG12 VAL 2 2HG1 VAL 2 -1.560 -12.016 -17.580 166 HG13 VAL 2 3HG1 VAL 2 -1.099 -10.788 -16.407 167 HG21 VAL 2 3HG2 VAL 2 0.039 -13.198 -18.909 168 HG22 VAL 2 1HG2 VAL 2 0.662 -11.701 -19.636 169 HG23 VAL 2 2HG2 VAL 2 1.767 -12.852 -18.850 170 H ASN 3 H ASN 3 1.062 -8.011 -16.956 171 HA ASN 3 HA ASN 3 1.236 -7.760 -14.108 172 HB2 ASN 3 2HB ASN 3 -0.387 -6.205 -16.168 173 HB3 ASN 3 3HB ASN 3 -0.151 -5.723 -14.491 174 HD21 ASN 3 2HD2 ASN 3 0.460 -3.905 -16.202 175 HD22 ASN 3 1HD2 ASN 3 2.187 -3.729 -16.285 176 H GLN 4 H GLN 4 -0.098 -8.489 -12.551 177 HA GLN 4 HA GLN 4 -2.935 -9.004 -12.967 178 HB2 GLN 4 2HB GLN 4 -2.882 -11.393 -12.779 179 HB3 GLN 4 3HB GLN 4 -1.864 -10.930 -14.126 180 HG2 GLN 4 2HG GLN 4 0.124 -11.081 -12.434 181 HG3 GLN 4 3HG GLN 4 -1.027 -11.904 -11.380 182 HE21 GLN 4 2HE2 GLN 4 1.063 -12.234 -14.141 183 HE22 GLN 4 1HE2 GLN 4 0.715 -13.939 -14.412 184 H HIS 5 H HIS 5 -3.649 -10.451 -11.002 185 HA HIS 5 HA HIS 5 -2.712 -9.175 -8.491 186 HB2 HIS 5 2HB HIS 5 -4.921 -11.205 -9.015 187 HB3 HIS 5 3HB HIS 5 -4.551 -10.461 -7.461 188 HD2 HIS 5 HD2 HIS 5 -5.959 -9.544 -10.954 189 HE1 HIS 5 HE1 HIS 5 -7.140 -6.460 -8.271 190 HE2 HIS 5 HE2 HIS 5 -7.423 -7.385 -10.629 191 H LEU 6 H LEU 6 -1.238 -10.126 -7.179 192 HA LEU 6 HA LEU 6 -0.525 -13.022 -7.517 193 HB2 LEU 6 2HB LEU 6 1.383 -10.657 -7.488 194 HB3 LEU 6 3HB LEU 6 1.878 -12.335 -7.364 195 HG LEU 6 HG LEU 6 0.398 -11.175 -9.765 196 HD11 LEU 6 1HD1 LEU 6 2.481 -10.013 -9.594 197 HD12 LEU 6 2HD1 LEU 6 3.345 -11.504 -9.187 198 HD13 LEU 6 3HD1 LEU 6 2.693 -11.270 -10.831 199 HD21 LEU 6 3HD2 LEU 6 1.297 -13.216 -10.900 200 HD22 LEU 6 1HD2 LEU 6 1.957 -13.774 -9.356 201 HD23 LEU 6 2HD2 LEU 6 0.200 -13.639 -9.580 202 H CYS 7 H CYS 7 -0.147 -14.099 -5.673 203 HA CYS 7 HA CYS 7 0.543 -12.716 -3.180 204 HB2 CYS 7 2HB CYS 7 -2.039 -12.645 -3.714 205 HB3 CYS 7 3HB CYS 7 -2.021 -14.305 -3.146 206 H GLY 8 H GLY 8 1.304 -14.125 -1.563 207 HA2 GLY 8 HA2 GLY 8 2.412 -15.991 -0.734 208 HA3 GLY 8 HA3 GLY 8 1.138 -16.937 -1.514 209 H SER 9 H SER 9 2.083 -18.555 -2.580 210 HA SER 9 HA SER 9 4.685 -18.721 -3.613 211 HB2 SER 9 2HB SER 9 2.198 -20.117 -4.669 212 HB3 SER 9 3HB SER 9 3.878 -20.649 -4.857 213 HG SER 9 HG SER 9 2.809 -21.743 -3.121 214 H HIS 10 H HIS 10 1.729 -17.534 -5.300 215 HA HIS 10 HA HIS 10 2.915 -17.313 -7.894 216 HB2 HIS 10 2HB HIS 10 0.388 -16.740 -6.640 217 HB3 HIS 10 3HB HIS 10 0.902 -15.269 -7.435 218 HD2 HIS 10 HD2 HIS 10 -1.167 -18.066 -8.195 219 HE1 HIS 10 HE1 HIS 10 0.655 -17.275 -11.961 220 HE2 HIS 10 HE2 HIS 10 -1.255 -18.491 -10.790 221 H LEU 11 H LEU 11 2.890 -15.142 -5.124 222 HA LEU 11 HA LEU 11 4.055 -12.858 -6.494 223 HB2 LEU 11 2HB LEU 11 2.567 -12.927 -4.376 224 HB3 LEU 11 3HB LEU 11 3.999 -13.453 -3.504 225 HG LEU 11 HG LEU 11 5.127 -11.312 -4.084 226 HD11 LEU 11 1HD1 LEU 11 2.424 -10.605 -5.319 227 HD12 LEU 11 2HD1 LEU 11 3.734 -9.458 -5.012 228 HD13 LEU 11 3HD1 LEU 11 3.964 -10.736 -6.204 229 HD21 LEU 11 3HD2 LEU 11 2.345 -11.007 -2.842 230 HD22 LEU 11 1HD2 LEU 11 3.801 -11.576 -1.989 231 HD23 LEU 11 2HD2 LEU 11 3.712 -9.915 -2.591 232 H VAL 12 H VAL 12 5.346 -15.409 -4.333 233 HA VAL 12 HA VAL 12 8.103 -14.662 -4.472 234 HB VAL 12 HB VAL 12 6.839 -17.414 -4.144 235 HG11 VAL 12 1HG1 VAL 12 9.162 -17.750 -4.839 236 HG12 VAL 12 2HG1 VAL 12 9.721 -16.545 -3.653 237 HG13 VAL 12 3HG1 VAL 12 9.014 -18.085 -3.114 238 HG21 VAL 12 3HG2 VAL 12 7.301 -17.072 -1.750 239 HG22 VAL 12 1HG2 VAL 12 7.970 -15.459 -2.095 240 HG23 VAL 12 2HG2 VAL 12 6.250 -15.794 -2.363 241 H GLU 13 H GLU 13 6.201 -16.835 -6.602 242 HA GLU 13 HA GLU 13 8.246 -17.448 -8.477 243 HB2 GLU 13 2HB GLU 13 5.224 -17.314 -8.609 244 HB3 GLU 13 3HB GLU 13 6.155 -17.520 -10.086 245 HG2 GLU 13 2HG GLU 13 7.283 -19.502 -9.141 246 HG3 GLU 13 3HG GLU 13 6.384 -19.315 -7.632 247 H ALA 14 H ALA 14 5.910 -14.625 -8.555 248 HA ALA 14 HA ALA 14 6.957 -13.568 -10.965 249 HB1 ALA 14 3HB ALA 14 5.671 -12.155 -8.593 250 HB2 ALA 14 1HB ALA 14 5.816 -11.514 -10.244 251 HB3 ALA 14 2HB ALA 14 4.828 -12.966 -9.944 252 H LEU 15 H LEU 15 7.960 -12.834 -7.562 253 HA LEU 15 HA LEU 15 9.995 -10.962 -8.276 254 HB2 LEU 15 2HB LEU 15 9.476 -12.733 -5.872 255 HB3 LEU 15 3HB LEU 15 11.065 -12.023 -6.045 256 HG LEU 15 HG LEU 15 9.812 -10.652 -4.588 257 HD11 LEU 15 1HD1 LEU 15 11.362 -9.527 -6.191 258 HD12 LEU 15 2HD1 LEU 15 9.969 -9.131 -7.221 259 HD13 LEU 15 3HD1 LEU 15 10.070 -8.481 -5.578 260 HD21 LEU 15 3HD2 LEU 15 7.548 -11.133 -5.086 261 HD22 LEU 15 1HD2 LEU 15 7.763 -9.399 -5.365 262 HD23 LEU 15 2HD2 LEU 15 7.685 -10.518 -6.744 263 H TYR 16 H TYR 16 10.136 -14.527 -8.236 264 HA TYR 16 HA TYR 16 12.962 -14.657 -8.834 265 HB2 TYR 16 2HB TYR 16 11.625 -16.622 -8.078 266 HB3 TYR 16 3HB TYR 16 10.758 -16.599 -9.618 267 HD1 TYR 16 HD2 TYR 16 14.061 -17.228 -8.033 268 HD2 TYR 16 HD1 TYR 16 11.791 -17.316 -11.700 269 HE1 TYR 16 HE2 TYR 16 15.908 -18.464 -9.146 270 HE2 TYR 16 HE1 TYR 16 13.645 -18.512 -12.828 271 HH TYR 16 HH TYR 16 16.671 -19.415 -11.099 272 H LEU 17 H LEU 17 10.053 -14.533 -10.958 273 HA LEU 17 HA LEU 17 11.526 -14.637 -13.416 274 HB2 LEU 17 2HB LEU 17 8.810 -13.360 -12.827 275 HB3 LEU 17 3HB LEU 17 9.466 -13.664 -14.425 276 HG LEU 17 HG LEU 17 8.784 -15.812 -12.406 277 HD11 LEU 17 1HD1 LEU 17 6.883 -16.298 -13.892 278 HD12 LEU 17 2HD1 LEU 17 6.796 -14.642 -13.268 279 HD13 LEU 17 3HD1 LEU 17 7.338 -14.934 -14.936 280 HD21 LEU 17 3HD2 LEU 17 9.056 -17.377 -14.328 281 HD22 LEU 17 1HD2 LEU 17 9.673 -16.033 -15.314 282 HD23 LEU 17 2HD2 LEU 17 10.577 -16.595 -13.888 283 H VAL 18 H VAL 18 10.324 -11.735 -11.614 284 HA VAL 18 HA VAL 18 11.556 -10.045 -13.653 285 HB VAL 18 HB VAL 18 11.045 -8.568 -11.203 286 HG11 VAL 18 1HG1 VAL 18 9.907 -8.348 -14.001 287 HG12 VAL 18 2HG1 VAL 18 9.872 -7.094 -12.737 288 HG13 VAL 18 3HG1 VAL 18 11.411 -7.594 -13.436 289 HG21 VAL 18 3HG2 VAL 18 8.680 -10.087 -12.166 290 HG22 VAL 18 1HG2 VAL 18 9.406 -9.907 -10.528 291 HG23 VAL 18 2HG2 VAL 18 8.650 -8.512 -11.294 292 H CYS 19 H CYS 19 12.557 -10.981 -10.333 293 HA CYS 19 HA CYS 19 14.836 -9.086 -10.533 294 HB2 CYS 19 2HB CYS 19 13.264 -8.954 -8.606 295 HB3 CYS 19 3HB CYS 19 13.741 -10.587 -8.134 296 H GLY 20 H GLY 20 14.177 -12.554 -10.053 297 HA2 GLY 20 HA2 GLY 20 16.955 -13.244 -9.425 298 HA3 GLY 20 HA3 GLY 20 15.592 -14.362 -9.676 299 H GLU 21 H GLU 21 14.772 -13.975 -12.177 300 HA GLU 21 HA GLU 21 16.843 -15.176 -13.781 301 HB2 GLU 21 2HB GLU 21 14.416 -15.771 -13.793 302 HB3 GLU 21 3HB GLU 21 14.062 -14.208 -14.520 303 HG2 GLU 21 2HG GLU 21 14.045 -15.786 -16.262 304 HG3 GLU 21 3HG GLU 21 15.513 -14.849 -16.480 305 H ARG 22 H ARG 22 15.175 -11.991 -13.877 306 HA ARG 22 HA ARG 22 15.361 -10.201 -15.245 307 HB2 ARG 22 2HB ARG 22 17.980 -10.635 -13.874 308 HB3 ARG 22 3HB ARG 22 17.862 -9.276 -15.016 309 HG2 ARG 22 2HG ARG 22 15.871 -8.439 -13.847 310 HG3 ARG 22 3HG ARG 22 16.014 -9.773 -12.679 311 HD2 ARG 22 2HD ARG 22 18.166 -8.924 -11.923 312 HD3 ARG 22 3HD ARG 22 18.123 -7.630 -13.135 313 HE ARG 22 HE ARG 22 15.882 -7.000 -11.915 314 HH11 ARG 22 1HH1 ARG 22 18.785 -8.117 -10.230 315 HH12 ARG 22 2HH1 ARG 22 18.411 -7.198 -8.803 316 HH21 ARG 22 1HH2 ARG 22 15.446 -5.855 -10.056 317 HH22 ARG 22 2HH2 ARG 22 16.542 -5.959 -8.703 318 H GLY 23 H GLY 23 15.053 -12.129 -16.942 319 HA2 GLY 23 HA2 GLY 23 16.951 -11.783 -19.234 320 HA3 GLY 23 HA3 GLY 23 15.618 -12.956 -19.115 321 H HIS 24 H HIS 24 13.400 -11.896 -18.854 322 HA HIS 24 HA HIS 24 12.804 -10.242 -21.116 323 HB2 HIS 24 2HB HIS 24 10.530 -10.469 -20.389 324 HB3 HIS 24 3HB HIS 24 11.331 -12.009 -20.100 325 HD2 HIS 24 HD2 HIS 24 12.087 -12.450 -17.404 326 HE1 HIS 24 HE1 HIS 24 9.340 -9.645 -15.775 327 HE2 HIS 24 HE2 HIS 24 10.999 -11.517 -15.226 328 H PHE 25 H PHE 25 13.675 -9.394 -17.889 329 HA PHE 25 HA PHE 25 13.159 -6.496 -18.354 330 HB2 PHE 25 2HB PHE 25 11.363 -7.477 -16.913 331 HB3 PHE 25 3HB PHE 25 12.589 -8.019 -15.774 332 HD1 PHE 25 HD1 PHE 25 10.920 -5.052 -17.270 333 HD2 PHE 25 HD2 PHE 25 13.674 -6.430 -14.249 334 HE1 PHE 25 HE1 PHE 25 10.869 -2.816 -16.202 335 HE2 PHE 25 HE2 PHE 25 13.640 -4.181 -13.199 336 HZ PHE 25 HZ PHE 25 12.228 -2.373 -14.160 337 H TYR 26 H TYR 26 14.723 -5.124 -17.417 338 HA TYR 26 HA TYR 26 17.001 -6.293 -15.923 339 HB2 TYR 26 2HB TYR 26 17.537 -6.497 -18.310 340 HB3 TYR 26 3HB TYR 26 17.191 -4.782 -18.549 341 HD1 TYR 26 HD2 TYR 26 19.319 -7.101 -16.526 342 HD2 TYR 26 HD1 TYR 26 18.929 -3.208 -18.317 343 HE1 TYR 26 HE2 TYR 26 21.639 -6.557 -15.819 344 HE2 TYR 26 HE1 TYR 26 21.270 -2.657 -17.652 345 HH TYR 26 HH TYR 26 23.174 -3.390 -16.570 346 H THR 27 H THR 27 18.153 -4.837 -14.721 347 HA THR 27 HA THR 27 16.931 -2.167 -14.212 348 HB THR 27 HB THR 27 18.338 -2.295 -12.100 349 HG1 THR 27 HG1 THR 27 18.756 -4.517 -11.489 350 HG21 THR 27 1HG2 THR 27 16.179 -4.416 -12.489 351 HG22 THR 27 2HG2 THR 27 16.686 -3.677 -10.953 352 HG23 THR 27 3HG2 THR 27 15.881 -2.692 -12.180 353 HA PRO 28 HA PRO 28 20.756 -0.810 -16.250 354 HB2 PRO 28 2HB PRO 28 20.132 1.755 -16.812 355 HB3 PRO 28 3HB PRO 28 19.379 0.391 -17.701 356 HG2 PRO 28 2HG PRO 28 18.278 1.894 -15.315 357 HG3 PRO 28 3HG PRO 28 17.448 1.559 -16.874 358 HD2 PRO 28 2HD PRO 28 17.083 -0.011 -14.664 359 HD3 PRO 28 3HD PRO 28 17.124 -0.717 -16.310 360 H LYS 29 H LYS 29 22.521 0.239 -15.529 361 HA LYS 29 HA LYS 29 22.806 1.832 -13.148 362 HB2 LYS 29 2HB LYS 29 23.695 0.005 -11.731 363 HB3 LYS 29 3HB LYS 29 21.977 -0.145 -12.061 364 HG2 LYS 29 2HG LYS 29 22.517 -1.860 -13.835 365 HG3 LYS 29 3HG LYS 29 24.214 -1.770 -13.352 366 HD2 LYS 29 2HD LYS 29 23.680 -2.538 -11.110 367 HD3 LYS 29 3HD LYS 29 21.941 -2.462 -11.423 368 HE2 LYS 29 2HE LYS 29 23.842 -4.247 -13.002 369 HE3 LYS 29 3HE LYS 29 23.044 -4.778 -11.518 370 HZ1 LYS 29 HZ1 LYS 29 20.898 -4.429 -12.575 371 HZ2 LYS 29 HZ2 LYS 29 21.570 -3.830 -13.916 372 HZ3 LYS 29 HZ3 LYS 29 21.802 -5.409 -13.526 373 H THR 30 H THR 30 25.052 1.930 -12.391 374 HA THR 30 HA THR 30 26.934 2.225 -14.575 375 HB THR 30 HB THR 30 26.816 3.764 -12.667 376 HG1 THR 30 HG1 THR 30 28.669 3.669 -13.894 377 HG21 THR 30 1HG2 THR 30 26.524 2.148 -10.788 378 HG22 THR 30 2HG2 THR 30 28.202 1.608 -11.022 379 HG23 THR 30 3HG2 THR 30 27.861 3.279 -10.539 Start of MODEL 8 1 H1 GLY 1 1H GLY 1 5.170 -2.523 1.588 2 H2 GLY 1 2H GLY 1 5.550 -3.064 3.085 3 H3 GLY 1 3H GLY 1 4.041 -3.294 2.487 4 HA2 GLY 1 HA2 GLY 1 6.510 -4.504 1.401 5 HA3 GLY 1 HA3 GLY 1 5.331 -5.348 2.422 6 H ILE 2 H ILE 2 6.200 -5.919 -0.362 7 HA ILE 2 HA ILE 2 4.536 -5.034 -2.386 8 HB ILE 2 HB ILE 2 6.574 -6.273 -2.765 9 HG12 ILE 2 2HG1 ILE 2 5.968 -7.834 -4.544 10 HG13 ILE 2 3HG1 ILE 2 4.286 -7.817 -4.001 11 HG21 ILE 2 1HG2 ILE 2 6.555 -7.908 -0.961 12 HG22 ILE 2 2HG2 ILE 2 5.190 -8.760 -1.702 13 HG23 ILE 2 3HG2 ILE 2 6.764 -8.717 -2.510 14 HD11 ILE 2 3HD1 ILE 2 4.557 -6.418 -5.954 15 HD12 ILE 2 1HD1 ILE 2 4.185 -5.370 -4.580 16 HD13 ILE 2 2HD1 ILE 2 5.859 -5.505 -5.174 17 H VAL 3 H VAL 3 3.673 -7.525 -0.076 18 HA VAL 3 HA VAL 3 1.483 -8.673 -1.414 19 HB VAL 3 HB VAL 3 1.819 -8.219 1.578 20 HG11 VAL 3 1HG1 VAL 3 0.002 -10.205 0.137 21 HG12 VAL 3 2HG1 VAL 3 0.282 -10.137 1.887 22 HG13 VAL 3 3HG1 VAL 3 -0.546 -8.801 1.084 23 HG21 VAL 3 3HG2 VAL 3 2.485 -10.639 -0.165 24 HG22 VAL 3 1HG2 VAL 3 3.670 -9.545 0.581 25 HG23 VAL 3 2HG2 VAL 3 2.646 -10.557 1.600 26 H GLU 4 H GLU 4 1.568 -5.614 0.510 27 HA GLU 4 HA GLU 4 -1.332 -5.269 0.258 28 HB2 GLU 4 2HB GLU 4 -1.152 -3.494 1.695 29 HB3 GLU 4 3HB GLU 4 0.174 -4.523 2.213 30 HG2 GLU 4 2HG GLU 4 1.635 -2.992 0.629 31 HG3 GLU 4 3HG GLU 4 0.270 -1.893 0.702 32 H GLN 5 H GLN 5 1.015 -4.981 -2.036 33 HA GLN 5 HA GLN 5 -0.542 -2.916 -3.546 34 HB2 GLN 5 2HB GLN 5 1.829 -2.388 -3.394 35 HB3 GLN 5 3HB GLN 5 2.265 -3.991 -3.980 36 HG2 GLN 5 2HG GLN 5 2.481 -2.330 -5.742 37 HG3 GLN 5 3HG GLN 5 1.258 -3.512 -6.173 38 HE21 GLN 5 2HE2 GLN 5 -1.075 -2.815 -6.015 39 HE22 GLN 5 1HE2 GLN 5 -1.414 -1.093 -6.177 40 H CYS 6 H CYS 6 1.013 -6.190 -3.931 41 HA CYS 6 HA CYS 6 -0.566 -6.477 -6.408 42 HB2 CYS 6 2HB CYS 6 1.994 -6.829 -6.024 43 HB3 CYS 6 3HB CYS 6 1.488 -8.453 -5.549 44 H CYS 7 H CYS 7 -0.584 -8.025 -3.233 45 HA CYS 7 HA CYS 7 -2.334 -10.198 -4.081 46 HB2 CYS 7 2HB CYS 7 -0.870 -10.138 -2.010 47 HB3 CYS 7 3HB CYS 7 -2.061 -9.049 -1.295 48 H THR 8 H THR 8 -2.879 -6.886 -3.232 49 HA THR 8 HA THR 8 -5.816 -7.213 -2.996 50 HB THR 8 HB THR 8 -4.442 -5.884 -1.367 51 HG1 THR 8 HG1 THR 8 -6.032 -4.280 -1.279 52 HG21 THR 8 1HG2 THR 8 -2.927 -4.769 -2.960 53 HG22 THR 8 2HG2 THR 8 -4.293 -3.834 -3.612 54 HG23 THR 8 3HG2 THR 8 -3.795 -3.617 -1.927 55 H SER 9 H SER 9 -3.454 -5.815 -5.263 56 HA SER 9 HA SER 9 -5.610 -5.267 -7.237 57 HB2 SER 9 2HB SER 9 -3.521 -3.315 -6.230 58 HB3 SER 9 3HB SER 9 -4.452 -3.091 -7.722 59 HG SER 9 HG SER 9 -5.416 -2.000 -5.947 60 H ILE 10 H ILE 10 -4.510 -4.546 -9.424 61 HA ILE 10 HA ILE 10 -2.541 -6.469 -10.328 62 HB ILE 10 HB ILE 10 -3.280 -3.740 -11.472 63 HG12 ILE 10 2HG1 ILE 10 -5.268 -5.224 -11.350 64 HG13 ILE 10 3HG1 ILE 10 -4.818 -4.738 -12.969 65 HG21 ILE 10 1HG2 ILE 10 -1.168 -4.435 -12.461 66 HG22 ILE 10 2HG2 ILE 10 -1.779 -6.081 -12.713 67 HG23 ILE 10 3HG2 ILE 10 -2.419 -4.722 -13.659 68 HD11 ILE 10 3HD1 ILE 10 -5.525 -7.116 -12.815 69 HD12 ILE 10 1HD1 ILE 10 -3.897 -6.925 -13.471 70 HD13 ILE 10 2HD1 ILE 10 -4.119 -7.443 -11.779 71 H CYS 11 H CYS 11 -0.323 -6.431 -10.164 72 HA CYS 11 HA CYS 11 0.936 -3.740 -9.855 73 HB2 CYS 11 2HB CYS 11 2.832 -4.596 -8.784 74 HB3 CYS 11 3HB CYS 11 1.418 -5.064 -7.854 75 H SER 12 H SER 12 2.461 -3.142 -11.238 76 HA SER 12 HA SER 12 2.913 -4.816 -13.651 77 HB2 SER 12 2HB SER 12 3.802 -1.963 -13.164 78 HB3 SER 12 3HB SER 12 3.723 -2.839 -14.697 79 HG SER 12 HG SER 12 1.925 -1.372 -14.299 80 H LEU 13 H LEU 13 5.014 -5.173 -14.560 81 HA LEU 13 HA LEU 13 6.738 -6.371 -12.653 82 HB2 LEU 13 2HB LEU 13 8.234 -6.758 -14.494 83 HB3 LEU 13 3HB LEU 13 6.600 -7.252 -14.866 84 HG LEU 13 HG LEU 13 7.790 -4.641 -15.889 85 HD11 LEU 13 1HD1 LEU 13 7.787 -7.380 -17.226 86 HD12 LEU 13 2HD1 LEU 13 8.327 -5.858 -17.970 87 HD13 LEU 13 3HD1 LEU 13 9.215 -6.529 -16.597 88 HD21 LEU 13 3HD2 LEU 13 5.420 -6.300 -16.833 89 HD22 LEU 13 1HD2 LEU 13 5.385 -4.638 -16.191 90 HD23 LEU 13 2HD2 LEU 13 6.132 -4.956 -17.746 91 H TYR 14 H TYR 14 6.982 -3.298 -14.325 92 HA TYR 14 HA TYR 14 9.592 -2.625 -13.496 93 HB2 TYR 14 2HB TYR 14 9.027 -0.414 -14.355 94 HB3 TYR 14 3HB TYR 14 8.474 -1.715 -15.428 95 HD1 TYR 14 HD1 TYR 14 7.242 0.702 -12.808 96 HD2 TYR 14 HD2 TYR 14 6.275 -1.744 -16.231 97 HE1 TYR 14 HE1 TYR 14 4.967 1.688 -12.866 98 HE2 TYR 14 HE2 TYR 14 4.013 -0.718 -16.321 99 HH TYR 14 HH TYR 14 2.928 1.740 -13.941 100 H GLN 15 H GLN 15 6.829 -2.726 -11.553 101 HA GLN 15 HA GLN 15 7.979 -0.736 -9.619 102 HB2 GLN 15 2HB GLN 15 5.700 -0.369 -8.745 103 HB3 GLN 15 3HB GLN 15 5.927 0.212 -10.401 104 HG2 GLN 15 2HG GLN 15 4.763 -1.701 -11.301 105 HG3 GLN 15 3HG GLN 15 4.630 -2.455 -9.701 106 HE21 GLN 15 2HE2 GLN 15 3.943 1.032 -9.838 107 HE22 GLN 15 1HE2 GLN 15 2.206 0.800 -9.754 108 H LEU 16 H LEU 16 6.513 -3.978 -10.095 109 HA LEU 16 HA LEU 16 6.730 -4.719 -7.335 110 HB2 LEU 16 2HB LEU 16 5.647 -6.531 -8.040 111 HB3 LEU 16 3HB LEU 16 5.515 -5.716 -9.567 112 HG LEU 16 HG LEU 16 7.812 -6.864 -10.116 113 HD11 LEU 16 1HD1 LEU 16 6.751 -8.455 -7.746 114 HD12 LEU 16 2HD1 LEU 16 7.765 -9.216 -8.970 115 HD13 LEU 16 3HD1 LEU 16 8.401 -7.863 -8.038 116 HD21 LEU 16 3HD2 LEU 16 6.726 -8.736 -11.110 117 HD22 LEU 16 1HD2 LEU 16 5.354 -8.656 -9.967 118 HD23 LEU 16 2HD2 LEU 16 5.567 -7.393 -11.190 119 H GLU 17 H GLU 17 9.015 -4.818 -10.028 120 HA GLU 17 HA GLU 17 11.262 -6.152 -9.047 121 HB2 GLU 17 2HB GLU 17 10.878 -3.641 -10.710 122 HB3 GLU 17 3HB GLU 17 12.494 -4.030 -10.138 123 HG2 GLU 17 2HG GLU 17 12.409 -6.228 -11.196 124 HG3 GLU 17 3HG GLU 17 10.800 -5.870 -11.842 125 H ASN 18 H ASN 18 10.062 -2.982 -8.102 126 HA ASN 18 HA ASN 18 12.456 -2.100 -6.727 127 HB2 ASN 18 2HB ASN 18 9.660 -1.076 -7.119 128 HB3 ASN 18 3HB ASN 18 10.532 -0.476 -5.754 129 HD21 ASN 18 2HD2 ASN 18 10.555 -0.706 -9.332 130 HD22 ASN 18 1HD2 ASN 18 11.682 0.611 -9.552 131 H TYR 19 H TYR 19 10.134 -4.374 -5.765 132 HA TYR 19 HA TYR 19 10.596 -3.987 -2.854 133 HB2 TYR 19 2HB TYR 19 8.788 -5.852 -4.437 134 HB3 TYR 19 3HB TYR 19 8.892 -5.784 -2.692 135 HD1 TYR 19 HD2 TYR 19 7.896 -3.816 -5.715 136 HD2 TYR 19 HD1 TYR 19 7.779 -4.110 -1.411 137 HE1 TYR 19 HE2 TYR 19 6.180 -2.024 -5.636 138 HE2 TYR 19 HE1 TYR 19 5.989 -2.387 -1.336 139 HH TYR 19 HH TYR 19 4.755 -0.789 -4.309 140 H CYS 20 H CYS 20 12.193 -5.620 -5.363 141 HA CYS 20 HA CYS 20 12.806 -8.132 -4.069 142 HB2 CYS 20 2HB CYS 20 13.021 -7.628 -6.507 143 HB3 CYS 20 3HB CYS 20 14.386 -6.569 -6.148 144 H ASN 21 H ASN 21 14.235 -4.940 -3.839 145 HA ASN 21 HA ASN 21 16.650 -5.752 -2.399 146 HB2 ASN 21 2HB ASN 21 16.901 -3.222 -2.132 147 HB3 ASN 21 3HB ASN 21 16.953 -3.875 -3.764 148 HD21 ASN 21 2HD2 ASN 21 14.058 -3.159 -1.789 149 HD22 ASN 21 1HD2 ASN 21 13.378 -2.044 -2.989 150 H1 PHE 1 1H PHE 1 5.396 -13.003 -19.508 151 H2 PHE 1 2H PHE 1 6.810 -12.673 -18.750 152 H3 PHE 1 3H PHE 1 6.072 -11.523 -19.658 153 HA PHE 1 HA PHE 1 5.002 -12.681 -17.175 154 HB2 PHE 1 2HB PHE 1 6.988 -11.148 -16.885 155 HB3 PHE 1 3HB PHE 1 6.062 -9.858 -17.633 156 HD1 PHE 1 HD1 PHE 1 6.133 -12.230 -14.726 157 HD2 PHE 1 HD2 PHE 1 4.561 -8.514 -16.276 158 HE1 PHE 1 HE1 PHE 1 5.202 -11.682 -12.494 159 HE2 PHE 1 HE2 PHE 1 3.675 -7.960 -14.035 160 HZ PHE 1 HZ PHE 1 3.976 -9.543 -12.143 161 H VAL 2 H VAL 2 3.117 -11.367 -16.323 162 HA VAL 2 HA VAL 2 1.781 -9.585 -18.200 163 HB VAL 2 HB VAL 2 0.731 -11.708 -18.818 164 HG11 VAL 2 1HG1 VAL 2 0.917 -12.956 -16.668 165 HG12 VAL 2 2HG1 VAL 2 -0.386 -11.941 -16.004 166 HG13 VAL 2 3HG1 VAL 2 -0.701 -13.003 -17.382 167 HG21 VAL 2 3HG2 VAL 2 -1.579 -11.009 -18.669 168 HG22 VAL 2 1HG2 VAL 2 -1.221 -9.934 -17.307 169 HG23 VAL 2 2HG2 VAL 2 -0.549 -9.589 -18.916 170 H ASN 3 H ASN 3 1.043 -7.853 -17.108 171 HA ASN 3 HA ASN 3 1.312 -7.581 -14.284 172 HB2 ASN 3 2HB ASN 3 -0.391 -6.019 -16.274 173 HB3 ASN 3 3HB ASN 3 -0.058 -5.523 -14.616 174 HD21 ASN 3 2HD2 ASN 3 0.495 -3.729 -16.364 175 HD22 ASN 3 1HD2 ASN 3 2.218 -3.593 -16.560 176 H GLN 4 H GLN 4 0.067 -8.465 -12.704 177 HA GLN 4 HA GLN 4 -2.809 -8.935 -13.068 178 HB2 GLN 4 2HB GLN 4 -2.726 -11.318 -12.925 179 HB3 GLN 4 3HB GLN 4 -1.724 -10.817 -14.274 180 HG2 GLN 4 2HG GLN 4 0.301 -11.032 -12.705 181 HG3 GLN 4 3HG GLN 4 -0.796 -11.767 -11.539 182 HE21 GLN 4 1HE2 GLN 4 1.535 -12.677 -13.595 183 HE22 GLN 4 2HE2 GLN 4 0.876 -14.220 -14.117 184 H HIS 5 H HIS 5 -3.519 -10.385 -11.159 185 HA HIS 5 HA HIS 5 -2.612 -9.151 -8.606 186 HB2 HIS 5 2HB HIS 5 -4.868 -11.108 -9.216 187 HB3 HIS 5 3HB HIS 5 -4.512 -10.409 -7.639 188 HD2 HIS 5 HD2 HIS 5 -5.802 -9.350 -11.144 189 HE1 HIS 5 HE1 HIS 5 -6.992 -6.331 -8.393 190 HE2 HIS 5 HE2 HIS 5 -7.222 -7.170 -10.790 191 H LEU 6 H LEU 6 -1.322 -10.208 -7.155 192 HA LEU 6 HA LEU 6 -0.611 -13.093 -7.560 193 HB2 LEU 6 2HB LEU 6 1.291 -10.730 -7.391 194 HB3 LEU 6 3HB LEU 6 1.795 -12.409 -7.313 195 HG LEU 6 HG LEU 6 0.439 -11.152 -9.738 196 HD11 LEU 6 1HD1 LEU 6 2.508 -10.010 -9.449 197 HD12 LEU 6 2HD1 LEU 6 3.344 -11.494 -8.987 198 HD13 LEU 6 3HD1 LEU 6 2.811 -11.252 -10.672 199 HD21 LEU 6 3HD2 LEU 6 1.965 -13.774 -9.355 200 HD22 LEU 6 1HD2 LEU 6 0.217 -13.626 -9.637 201 HD23 LEU 6 2HD2 LEU 6 1.361 -13.154 -10.900 202 H CYS 7 H CYS 7 -0.238 -14.192 -5.674 203 HA CYS 7 HA CYS 7 0.516 -12.762 -3.227 204 HB2 CYS 7 2HB CYS 7 -2.069 -12.672 -3.635 205 HB3 CYS 7 3HB CYS 7 -2.055 -14.347 -3.103 206 H GLY 8 H GLY 8 1.341 -14.104 -1.599 207 HA2 GLY 8 HA2 GLY 8 2.475 -15.938 -0.741 208 HA3 GLY 8 HA3 GLY 8 1.203 -16.923 -1.476 209 H SER 9 H SER 9 2.131 -18.537 -2.554 210 HA SER 9 HA SER 9 4.712 -18.714 -3.618 211 HB2 SER 9 2HB SER 9 2.208 -20.099 -4.645 212 HB3 SER 9 3HB SER 9 3.884 -20.642 -4.846 213 HG SER 9 HG SER 9 2.823 -21.723 -3.098 214 H HIS 10 H HIS 10 1.748 -17.499 -5.278 215 HA HIS 10 HA HIS 10 2.937 -17.305 -7.878 216 HB2 HIS 10 2HB HIS 10 0.402 -16.737 -6.653 217 HB3 HIS 10 3HB HIS 10 0.920 -15.258 -7.432 218 HD2 HIS 10 HD2 HIS 10 -1.123 -18.072 -8.222 219 HE1 HIS 10 HE1 HIS 10 0.728 -17.259 -11.968 220 HE2 HIS 10 HE2 HIS 10 -1.182 -18.493 -10.818 221 H LEU 11 H LEU 11 2.943 -15.126 -5.114 222 HA LEU 11 HA LEU 11 4.121 -12.873 -6.543 223 HB2 LEU 11 2HB LEU 11 2.568 -12.893 -4.454 224 HB3 LEU 11 3HB LEU 11 4.004 -13.310 -3.531 225 HG LEU 11 HG LEU 11 5.062 -11.151 -4.298 226 HD11 LEU 11 1HD1 LEU 11 2.273 -10.545 -5.370 227 HD12 LEU 11 2HD1 LEU 11 3.632 -9.424 -5.320 228 HD13 LEU 11 3HD1 LEU 11 3.706 -10.806 -6.402 229 HD21 LEU 11 3HD2 LEU 11 2.332 -11.004 -2.917 230 HD22 LEU 11 1HD2 LEU 11 3.909 -11.271 -2.135 231 HD23 LEU 11 2HD2 LEU 11 3.530 -9.711 -2.893 232 H VAL 12 H VAL 12 5.356 -15.396 -4.323 233 HA VAL 12 HA VAL 12 8.134 -14.680 -4.451 234 HB VAL 12 HB VAL 12 6.824 -17.410 -4.114 235 HG11 VAL 12 1HG1 VAL 12 8.985 -18.113 -3.080 236 HG12 VAL 12 2HG1 VAL 12 9.143 -17.783 -4.806 237 HG13 VAL 12 3HG1 VAL 12 9.718 -16.586 -3.621 238 HG21 VAL 12 3HG2 VAL 12 7.288 -17.071 -1.721 239 HG22 VAL 12 1HG2 VAL 12 7.981 -15.469 -2.067 240 HG23 VAL 12 2HG2 VAL 12 6.257 -15.779 -2.339 241 H GLU 13 H GLU 13 6.203 -16.828 -6.579 242 HA GLU 13 HA GLU 13 8.240 -17.435 -8.467 243 HB2 GLU 13 2HB GLU 13 5.221 -17.287 -8.582 244 HB3 GLU 13 3HB GLU 13 6.134 -17.430 -10.078 245 HG2 GLU 13 3HG GLU 13 7.273 -19.442 -9.243 246 HG3 GLU 13 2HG GLU 13 6.413 -19.318 -7.703 247 H ALA 14 H ALA 14 5.922 -14.610 -8.514 248 HA ALA 14 HA ALA 14 6.962 -13.491 -10.885 249 HB1 ALA 14 3HB ALA 14 5.753 -12.098 -8.461 250 HB2 ALA 14 1HB ALA 14 5.875 -11.433 -10.104 251 HB3 ALA 14 2HB ALA 14 4.866 -12.871 -9.806 252 H LEU 15 H LEU 15 8.021 -12.816 -7.494 253 HA LEU 15 HA LEU 15 10.083 -10.975 -8.149 254 HB2 LEU 15 2HB LEU 15 9.506 -12.796 -5.816 255 HB3 LEU 15 3HB LEU 15 11.125 -12.150 -5.955 256 HG LEU 15 HG LEU 15 9.857 -10.788 -4.466 257 HD11 LEU 15 1HD1 LEU 15 10.305 -8.597 -5.339 258 HD12 LEU 15 2HD1 LEU 15 11.568 -9.696 -5.922 259 HD13 LEU 15 3HD1 LEU 15 10.265 -9.169 -7.012 260 HD21 LEU 15 3HD2 LEU 15 7.593 -11.095 -5.137 261 HD22 LEU 15 1HD2 LEU 15 7.944 -9.370 -5.269 262 HD23 LEU 15 2HD2 LEU 15 7.879 -10.374 -6.734 263 H TYR 16 H TYR 16 10.186 -14.546 -8.241 264 HA TYR 16 HA TYR 16 12.991 -14.715 -8.898 265 HB2 TYR 16 2HB TYR 16 11.670 -16.655 -8.148 266 HB3 TYR 16 3HB TYR 16 10.684 -16.549 -9.604 267 HD1 TYR 16 HD1 TYR 16 14.138 -17.305 -8.414 268 HD2 TYR 16 HD2 TYR 16 11.378 -17.355 -11.727 269 HE1 TYR 16 HE1 TYR 16 15.725 -18.711 -9.714 270 HE2 TYR 16 HE2 TYR 16 12.951 -18.759 -13.028 271 HH TYR 16 HH TYR 16 16.127 -19.809 -11.697 272 H LEU 17 H LEU 17 10.048 -14.379 -10.962 273 HA LEU 17 HA LEU 17 11.490 -14.550 -13.437 274 HB2 LEU 17 2HB LEU 17 8.848 -13.104 -12.898 275 HB3 LEU 17 3HB LEU 17 9.483 -13.589 -14.460 276 HG LEU 17 HG LEU 17 8.640 -15.484 -12.275 277 HD11 LEU 17 1HD1 LEU 17 6.739 -14.260 -13.231 278 HD12 LEU 17 2HD1 LEU 17 7.245 -14.732 -14.869 279 HD13 LEU 17 3HD1 LEU 17 6.699 -15.964 -13.711 280 HD21 LEU 17 3HD2 LEU 17 9.448 -16.052 -15.156 281 HD22 LEU 17 1HD2 LEU 17 10.368 -16.512 -13.708 282 HD23 LEU 17 2HD2 LEU 17 8.792 -17.247 -14.017 283 H VAL 18 H VAL 18 10.341 -11.656 -11.631 284 HA VAL 18 HA VAL 18 11.526 -9.789 -13.513 285 HB VAL 18 HB VAL 18 11.360 -8.183 -11.409 286 HG11 VAL 18 1HG1 VAL 18 8.865 -9.083 -12.852 287 HG12 VAL 18 2HG1 VAL 18 9.122 -7.548 -11.976 288 HG13 VAL 18 3HG1 VAL 18 10.052 -7.891 -13.442 289 HG21 VAL 18 3HG2 VAL 18 10.801 -10.160 -9.918 290 HG22 VAL 18 1HG2 VAL 18 9.963 -8.616 -9.730 291 HG23 VAL 18 2HG2 VAL 18 9.157 -9.948 -10.584 292 H CYS 19 H CYS 19 12.686 -11.012 -10.324 293 HA CYS 19 HA CYS 19 15.170 -9.362 -10.654 294 HB2 CYS 19 2HB CYS 19 13.464 -8.911 -8.826 295 HB3 CYS 19 3HB CYS 19 13.896 -10.477 -8.140 296 H GLY 20 H GLY 20 14.069 -12.665 -9.878 297 HA2 GLY 20 HA2 GLY 20 16.638 -13.617 -8.924 298 HA3 GLY 20 HA3 GLY 20 15.235 -14.614 -9.373 299 H GLU 21 H GLU 21 14.892 -14.116 -12.044 300 HA GLU 21 HA GLU 21 17.122 -15.368 -13.380 301 HB2 GLU 21 2HB GLU 21 14.511 -14.081 -14.302 302 HB3 GLU 21 3HB GLU 21 15.666 -14.862 -15.373 303 HG2 GLU 21 2HG GLU 21 15.440 -16.966 -13.985 304 HG3 GLU 21 3HG GLU 21 14.114 -16.167 -13.127 305 H ARG 22 H ARG 22 15.622 -12.122 -13.530 306 HA ARG 22 HA ARG 22 16.216 -10.100 -14.109 307 HB2 ARG 22 2HB ARG 22 18.406 -11.148 -12.693 308 HB3 ARG 22 3HB ARG 22 19.149 -10.315 -14.056 309 HG2 ARG 22 2HG ARG 22 17.025 -9.109 -12.225 310 HG3 ARG 22 3HG ARG 22 18.763 -8.960 -11.929 311 HD2 ARG 22 2HD ARG 22 19.082 -7.764 -14.039 312 HD3 ARG 22 3HD ARG 22 17.381 -7.951 -14.453 313 HE ARG 22 HE ARG 22 18.545 -6.108 -12.473 314 HH11 ARG 22 1HH1 ARG 22 15.474 -7.471 -13.705 315 HH12 ARG 22 2HH1 ARG 22 14.616 -6.017 -13.203 316 HH21 ARG 22 1HH2 ARG 22 17.206 -4.352 -11.831 317 HH22 ARG 22 2HH2 ARG 22 15.488 -4.447 -12.216 318 H GLY 23 H GLY 23 17.706 -12.569 -16.002 319 HA2 GLY 23 HA2 GLY 23 17.878 -10.855 -18.464 320 HA3 GLY 23 HA3 GLY 23 18.524 -12.498 -18.259 321 H HIS 24 H HIS 24 17.503 -13.377 -20.012 322 HA HIS 24 HA HIS 24 14.672 -13.226 -20.531 323 HB2 HIS 24 2HB HIS 24 15.106 -14.939 -22.191 324 HB3 HIS 24 3HB HIS 24 16.323 -13.673 -22.276 325 HD2 HIS 24 HD2 HIS 24 18.833 -14.311 -21.631 326 HE1 HIS 24 HE1 HIS 24 18.259 -18.504 -21.162 327 HE2 HIS 24 HE2 HIS 24 20.004 -16.655 -21.333 328 H PHE 25 H PHE 25 13.200 -15.086 -20.575 329 HA PHE 25 HA PHE 25 13.024 -16.536 -18.056 330 HB2 PHE 25 2HB PHE 25 11.034 -15.706 -19.181 331 HB3 PHE 25 3HB PHE 25 11.412 -16.634 -20.629 332 HD1 PHE 25 HD1 PHE 25 10.768 -17.087 -16.949 333 HD2 PHE 25 HD2 PHE 25 10.468 -18.793 -20.897 334 HE1 PHE 25 HE1 PHE 25 9.509 -19.008 -16.022 335 HE2 PHE 25 HE2 PHE 25 9.196 -20.711 -19.970 336 HZ PHE 25 HZ PHE 25 8.712 -20.826 -17.531 337 H TYR 26 H TYR 26 14.048 -18.377 -17.580 338 HA TYR 26 HA TYR 26 15.399 -19.970 -19.628 339 HB2 TYR 26 2HB TYR 26 16.377 -19.548 -17.405 340 HB3 TYR 26 3HB TYR 26 15.054 -20.443 -16.653 341 HD1 TYR 26 HD1 TYR 26 17.616 -20.879 -19.389 342 HD2 TYR 26 HD2 TYR 26 15.471 -22.716 -16.123 343 HE1 TYR 26 HE1 TYR 26 18.864 -22.989 -19.758 344 HE2 TYR 26 HE2 TYR 26 16.779 -24.799 -16.437 345 HH TYR 26 HH TYR 26 18.396 -25.881 -17.671 346 H THR 27 H THR 27 15.041 -22.057 -20.205 347 HA THR 27 HA THR 27 12.414 -23.354 -19.549 348 HB THR 27 HB THR 27 12.555 -24.366 -21.842 349 HG1 THR 27 HG1 THR 27 14.735 -23.798 -22.250 350 HG21 THR 27 1HG2 THR 27 11.592 -22.402 -22.951 351 HG22 THR 27 2HG2 THR 27 10.999 -22.518 -21.287 352 HG23 THR 27 3HG2 THR 27 12.254 -21.330 -21.700 353 HA PRO 28 HA PRO 28 15.577 -26.179 -17.890 354 HB2 PRO 28 2HB PRO 28 13.000 -27.419 -16.912 355 HB3 PRO 28 3HB PRO 28 14.573 -27.277 -16.059 356 HG2 PRO 28 2HG PRO 28 12.602 -25.531 -15.505 357 HG3 PRO 28 3HG PRO 28 14.270 -24.921 -15.777 358 HD2 PRO 28 2HD PRO 28 11.948 -24.981 -17.733 359 HD3 PRO 28 3HD PRO 28 13.083 -23.646 -17.369 360 H LYS 29 H LYS 29 16.144 -28.330 -18.168 361 HA LYS 29 HA LYS 29 15.320 -29.416 -20.770 362 HB2 LYS 29 2HB LYS 29 17.612 -30.144 -18.890 363 HB3 LYS 29 3HB LYS 29 17.395 -30.770 -20.530 364 HG2 LYS 29 2HG LYS 29 17.574 -28.470 -21.451 365 HG3 LYS 29 3HG LYS 29 17.849 -27.837 -19.817 366 HD2 LYS 29 2HD LYS 29 19.878 -29.258 -19.607 367 HD3 LYS 29 3HD LYS 29 19.624 -29.844 -21.267 368 HE2 LYS 29 2HE LYS 29 19.781 -27.506 -22.110 369 HE3 LYS 29 3HE LYS 29 20.028 -26.924 -20.458 370 HZ1 LYS 29 HZ1 LYS 29 22.082 -28.224 -20.376 371 HZ2 LYS 29 HZ2 LYS 29 21.856 -28.763 -21.904 372 HZ3 LYS 29 HZ3 LYS 29 22.132 -27.178 -21.629 373 H THR 30 H THR 30 13.738 -29.788 -18.230 374 HA THR 30 HA THR 30 13.639 -32.500 -17.371 375 HB THR 30 HB THR 30 11.338 -30.513 -17.452 376 HG1 THR 30 HG1 THR 30 13.388 -30.882 -15.519 377 HG21 THR 30 1HG2 THR 30 10.625 -32.750 -16.731 378 HG22 THR 30 2HG2 THR 30 11.966 -32.835 -15.570 379 HG23 THR 30 3HG2 THR 30 10.657 -31.651 -15.347 Start of MODEL 9 1 H1 GLY 1 1H GLY 1 4.471 -2.294 2.775 2 H2 GLY 1 2H GLY 1 3.376 -3.436 2.321 3 H3 GLY 1 3H GLY 1 3.526 -2.050 1.453 4 HA2 GLY 1 HA2 GLY 1 5.749 -2.658 0.768 5 HA3 GLY 1 HA3 GLY 1 5.580 -4.139 1.731 6 H ILE 2 H ILE 2 5.906 -5.431 -0.081 7 HA ILE 2 HA ILE 2 4.573 -5.126 -2.557 8 HB ILE 2 HB ILE 2 6.747 -6.212 -2.219 9 HG12 ILE 2 2HG1 ILE 2 6.602 -8.036 -3.794 10 HG13 ILE 2 3HG1 ILE 2 4.852 -8.141 -3.578 11 HG21 ILE 2 1HG2 ILE 2 5.272 -8.654 -1.163 12 HG22 ILE 2 2HG2 ILE 2 7.008 -8.495 -1.455 13 HG23 ILE 2 3HG2 ILE 2 6.252 -7.549 -0.172 14 HD11 ILE 2 3HD1 ILE 2 5.478 -7.044 -5.670 15 HD12 ILE 2 1HD1 ILE 2 4.590 -5.916 -4.633 16 HD13 ILE 2 2HD1 ILE 2 6.360 -5.794 -4.789 17 H VAL 3 H VAL 3 3.545 -7.145 0.189 18 HA VAL 3 HA VAL 3 1.672 -8.687 -1.399 19 HB VAL 3 HB VAL 3 1.836 -8.301 1.610 20 HG11 VAL 3 1HG1 VAL 3 -0.485 -8.939 1.069 21 HG12 VAL 3 2HG1 VAL 3 0.099 -10.243 0.010 22 HG13 VAL 3 3HG1 VAL 3 0.366 -10.318 1.765 23 HG21 VAL 3 3HG2 VAL 3 3.754 -9.515 0.577 24 HG22 VAL 3 1HG2 VAL 3 2.762 -10.603 1.554 25 HG23 VAL 3 2HG2 VAL 3 2.618 -10.630 -0.216 26 H GLU 4 H GLU 4 1.233 -5.815 0.747 27 HA GLU 4 HA GLU 4 -1.531 -5.492 -0.221 28 HB2 GLU 4 2HB GLU 4 -1.661 -3.558 1.239 29 HB3 GLU 4 3HB GLU 4 -1.240 -5.035 2.076 30 HG2 GLU 4 2HG GLU 4 0.879 -3.016 1.257 31 HG3 GLU 4 3HG GLU 4 -0.047 -2.856 2.747 32 H GLN 5 H GLN 5 0.984 -5.244 -1.997 33 HA GLN 5 HA GLN 5 -0.170 -2.946 -3.531 34 HB2 GLN 5 2HB GLN 5 2.317 -2.806 -3.060 35 HB3 GLN 5 3HB GLN 5 2.529 -4.302 -3.961 36 HG2 GLN 5 2HG GLN 5 3.026 -2.501 -5.441 37 HG3 GLN 5 3HG GLN 5 1.495 -3.180 -5.978 38 HE21 GLN 5 2HE2 GLN 5 2.888 -0.490 -3.976 39 HE22 GLN 5 1HE2 GLN 5 1.560 0.615 -4.307 40 H CYS 6 H CYS 6 1.332 -6.201 -4.019 41 HA CYS 6 HA CYS 6 -0.072 -6.541 -6.551 42 HB2 CYS 6 2HB CYS 6 1.913 -8.141 -4.927 43 HB3 CYS 6 3HB CYS 6 1.215 -8.741 -6.423 44 H CYS 7 H CYS 7 -0.503 -8.058 -3.325 45 HA CYS 7 HA CYS 7 -2.311 -10.064 -4.466 46 HB2 CYS 7 2HB CYS 7 -0.818 -10.477 -2.519 47 HB3 CYS 7 3HB CYS 7 -1.810 -9.377 -1.560 48 H THR 8 H THR 8 -2.745 -6.907 -3.060 49 HA THR 8 HA THR 8 -5.654 -7.199 -2.746 50 HB THR 8 HB THR 8 -4.221 -5.895 -1.180 51 HG1 THR 8 HG1 THR 8 -6.422 -5.505 -1.270 52 HG21 THR 8 1HG2 THR 8 -4.112 -3.804 -3.391 53 HG22 THR 8 2HG2 THR 8 -3.523 -3.644 -1.729 54 HG23 THR 8 3HG2 THR 8 -2.735 -4.783 -2.838 55 H SER 9 H SER 9 -3.462 -5.807 -5.160 56 HA SER 9 HA SER 9 -5.742 -5.199 -6.961 57 HB2 SER 9 2HB SER 9 -3.618 -3.238 -6.060 58 HB3 SER 9 3HB SER 9 -4.678 -3.007 -7.470 59 HG SER 9 HG SER 9 -5.498 -1.958 -5.593 60 H ILE 10 H ILE 10 -4.905 -4.535 -9.202 61 HA ILE 10 HA ILE 10 -2.989 -6.369 -10.300 62 HB ILE 10 HB ILE 10 -3.941 -3.659 -11.330 63 HG12 ILE 10 2HG1 ILE 10 -5.791 -5.329 -11.082 64 HG13 ILE 10 3HG1 ILE 10 -5.526 -4.743 -12.714 65 HG21 ILE 10 1HG2 ILE 10 -1.895 -4.153 -12.492 66 HG22 ILE 10 2HG2 ILE 10 -2.365 -5.848 -12.732 67 HG23 ILE 10 3HG2 ILE 10 -3.213 -4.544 -13.594 68 HD11 ILE 10 3HD1 ILE 10 -4.527 -7.422 -11.684 69 HD12 ILE 10 1HD1 ILE 10 -5.993 -7.171 -12.652 70 HD13 ILE 10 2HD1 ILE 10 -4.406 -6.826 -13.358 71 H CYS 11 H CYS 11 -0.803 -6.359 -10.334 72 HA CYS 11 HA CYS 11 0.586 -3.729 -10.139 73 HB2 CYS 11 2HB CYS 11 2.258 -4.537 -8.720 74 HB3 CYS 11 3HB CYS 11 0.733 -4.994 -7.977 75 H SER 12 H SER 12 2.628 -3.605 -11.116 76 HA SER 12 HA SER 12 2.941 -5.388 -13.516 77 HB2 SER 12 2HB SER 12 3.581 -2.440 -13.207 78 HB3 SER 12 3HB SER 12 3.677 -3.414 -14.683 79 HG SER 12 HG SER 12 1.720 -2.123 -14.482 80 H LEU 13 H LEU 13 5.035 -5.649 -14.453 81 HA LEU 13 HA LEU 13 6.868 -6.598 -12.511 82 HB2 LEU 13 2HB LEU 13 8.286 -7.110 -14.351 83 HB3 LEU 13 3HB LEU 13 6.651 -7.626 -14.685 84 HG LEU 13 HG LEU 13 7.812 -5.060 -15.838 85 HD11 LEU 13 1HD1 LEU 13 9.286 -6.937 -16.446 86 HD12 LEU 13 2HD1 LEU 13 7.885 -7.860 -17.035 87 HD13 LEU 13 3HD1 LEU 13 8.386 -6.366 -17.859 88 HD21 LEU 13 3HD2 LEU 13 5.393 -5.149 -16.124 89 HD22 LEU 13 1HD2 LEU 13 6.187 -5.416 -17.668 90 HD23 LEU 13 2HD2 LEU 13 5.511 -6.796 -16.789 91 H TYR 14 H TYR 14 6.826 -3.626 -14.359 92 HA TYR 14 HA TYR 14 9.486 -2.796 -13.807 93 HB2 TYR 14 2HB TYR 14 8.747 -0.665 -14.747 94 HB3 TYR 14 3HB TYR 14 8.218 -2.059 -15.714 95 HD1 TYR 14 HD1 TYR 14 6.981 0.420 -13.149 96 HD2 TYR 14 HD2 TYR 14 5.987 -2.232 -16.405 97 HE1 TYR 14 HE1 TYR 14 4.652 1.264 -13.118 98 HE2 TYR 14 HE2 TYR 14 3.668 -1.341 -16.417 99 HH TYR 14 HH TYR 14 2.560 1.153 -14.085 100 H GLN 15 H GLN 15 6.874 -2.870 -11.709 101 HA GLN 15 HA GLN 15 8.077 -0.780 -9.908 102 HB2 GLN 15 2HB GLN 15 5.829 -0.579 -8.853 103 HB3 GLN 15 3HB GLN 15 5.915 0.046 -10.505 104 HG2 GLN 15 2HG GLN 15 4.803 -1.931 -11.378 105 HG3 GLN 15 3HG GLN 15 4.800 -2.689 -9.769 106 HE21 GLN 15 2HE2 GLN 15 3.937 0.754 -9.835 107 HE22 GLN 15 1HE2 GLN 15 2.220 0.433 -9.665 108 H LEU 16 H LEU 16 6.571 -4.079 -10.117 109 HA LEU 16 HA LEU 16 6.982 -4.611 -7.381 110 HB2 LEU 16 2HB LEU 16 5.926 -6.527 -7.842 111 HB3 LEU 16 3HB LEU 16 5.597 -5.732 -9.355 112 HG LEU 16 HG LEU 16 7.826 -6.845 -10.156 113 HD11 LEU 16 1HD1 LEU 16 8.763 -7.932 -8.307 114 HD12 LEU 16 2HD1 LEU 16 7.178 -8.358 -7.616 115 HD13 LEU 16 3HD1 LEU 16 7.832 -9.259 -8.986 116 HD21 LEU 16 3HD2 LEU 16 5.488 -7.389 -10.973 117 HD22 LEU 16 1HD2 LEU 16 6.569 -8.793 -10.952 118 HD23 LEU 16 2HD2 LEU 16 5.349 -8.583 -9.671 119 H GLU 17 H GLU 17 9.316 -4.817 -10.036 120 HA GLU 17 HA GLU 17 11.490 -6.209 -8.916 121 HB2 GLU 17 2HB GLU 17 11.363 -3.592 -10.485 122 HB3 GLU 17 3HB GLU 17 12.897 -4.265 -9.939 123 HG2 GLU 17 2HG GLU 17 12.440 -6.355 -11.191 124 HG3 GLU 17 3HG GLU 17 10.976 -5.599 -11.833 125 H ASN 18 H ASN 18 10.223 -3.043 -8.051 126 HA ASN 18 HA ASN 18 12.559 -2.009 -6.777 127 HB2 ASN 18 2HB ASN 18 9.638 -1.194 -6.637 128 HB3 ASN 18 3HB ASN 18 10.870 -0.356 -5.820 129 HD21 ASN 18 2HD2 ASN 18 9.808 -1.283 -9.047 130 HD22 ASN 18 1HD2 ASN 18 10.722 -0.050 -9.913 131 H TYR 19 H TYR 19 10.141 -4.185 -5.625 132 HA TYR 19 HA TYR 19 10.556 -3.706 -2.755 133 HB2 TYR 19 2HB TYR 19 8.890 -5.721 -4.316 134 HB3 TYR 19 3HB TYR 19 8.863 -5.500 -2.575 135 HD1 TYR 19 HD1 TYR 19 8.175 -3.706 -5.823 136 HD2 TYR 19 HD2 TYR 19 7.483 -3.864 -1.565 137 HE1 TYR 19 HE1 TYR 19 6.516 -1.893 -6.031 138 HE2 TYR 19 HE2 TYR 19 5.699 -2.156 -1.793 139 HH TYR 19 HH TYR 19 4.992 -0.567 -4.948 140 H CYS 20 H CYS 20 12.163 -5.561 -5.135 141 HA CYS 20 HA CYS 20 12.888 -7.878 -3.538 142 HB2 CYS 20 2HB CYS 20 12.887 -7.653 -6.067 143 HB3 CYS 20 3HB CYS 20 14.331 -6.651 -5.912 144 H ASN 21 H ASN 21 14.124 -4.620 -3.748 145 HA ASN 21 HA ASN 21 16.706 -5.115 -2.454 146 HB2 ASN 21 2HB ASN 21 16.434 -3.361 -4.159 147 HB3 ASN 21 3HB ASN 21 15.190 -2.569 -3.194 148 HD21 ASN 21 2HD2 ASN 21 15.953 -1.969 -0.901 149 HD22 ASN 21 1HD2 ASN 21 17.545 -1.191 -0.833 150 H1 PHE 1 1H PHE 1 6.437 -11.725 -19.349 151 H2 PHE 1 2H PHE 1 5.457 -10.638 -20.087 152 H3 PHE 1 3H PHE 1 4.993 -12.202 -19.969 153 HA PHE 1 HA PHE 1 4.797 -12.073 -17.607 154 HB2 PHE 1 2HB PHE 1 6.670 -10.373 -17.408 155 HB3 PHE 1 3HB PHE 1 5.533 -9.130 -17.895 156 HD1 PHE 1 HD2 PHE 1 6.512 -11.522 -15.235 157 HD2 PHE 1 HD1 PHE 1 3.819 -8.313 -16.294 158 HE1 PHE 1 HE2 PHE 1 5.876 -11.258 -12.851 159 HE2 PHE 1 HE1 PHE 1 3.206 -8.051 -13.908 160 HZ PHE 1 HZ PHE 1 4.222 -9.522 -12.185 161 H VAL 2 H VAL 2 2.816 -11.263 -16.559 162 HA VAL 2 HA VAL 2 0.996 -9.610 -18.257 163 HB VAL 2 HB VAL 2 0.156 -12.142 -16.777 164 HG11 VAL 2 1HG1 VAL 2 -1.594 -10.424 -16.553 165 HG12 VAL 2 2HG1 VAL 2 -1.526 -10.095 -18.299 166 HG13 VAL 2 3HG1 VAL 2 -2.116 -11.660 -17.697 167 HG21 VAL 2 3HG2 VAL 2 -0.566 -12.941 -19.014 168 HG22 VAL 2 1HG2 VAL 2 0.138 -11.486 -19.755 169 HG23 VAL 2 2HG2 VAL 2 1.178 -12.680 -18.945 170 H ASN 3 H ASN 3 0.442 -7.868 -17.145 171 HA ASN 3 HA ASN 3 0.996 -7.521 -14.326 172 HB2 ASN 3 2HB ASN 3 -0.724 -5.841 -16.186 173 HB3 ASN 3 3HB ASN 3 -0.106 -5.344 -14.616 174 HD21 ASN 3 1HD2 ASN 3 0.359 -4.151 -17.340 175 HD22 ASN 3 2HD2 ASN 3 2.102 -4.162 -17.540 176 H GLN 4 H GLN 4 -0.219 -8.192 -12.636 177 HA GLN 4 HA GLN 4 -3.101 -8.707 -12.874 178 HB2 GLN 4 2HB GLN 4 -2.990 -11.088 -12.729 179 HB3 GLN 4 3HB GLN 4 -2.039 -10.588 -14.112 180 HG2 GLN 4 2HG GLN 4 0.040 -10.776 -12.599 181 HG3 GLN 4 3HG GLN 4 -1.014 -11.510 -11.395 182 HE21 GLN 4 1HE2 GLN 4 0.713 -12.027 -14.382 183 HE22 GLN 4 2HE2 GLN 4 0.282 -13.730 -14.547 184 H HIS 5 H HIS 5 -3.738 -10.176 -10.917 185 HA HIS 5 HA HIS 5 -2.680 -9.012 -8.410 186 HB2 HIS 5 2HB HIS 5 -4.904 -11.032 -8.917 187 HB3 HIS 5 3HB HIS 5 -4.478 -10.336 -7.357 188 HD2 HIS 5 HD2 HIS 5 -6.029 -9.314 -10.762 189 HE1 HIS 5 HE1 HIS 5 -7.181 -6.374 -7.904 190 HE2 HIS 5 HE2 HIS 5 -7.524 -7.201 -10.295 191 H LEU 6 H LEU 6 -1.204 -10.045 -7.152 192 HA LEU 6 HA LEU 6 -0.526 -12.932 -7.622 193 HB2 LEU 6 2HB LEU 6 1.384 -10.594 -7.366 194 HB3 LEU 6 3HB LEU 6 1.864 -12.282 -7.342 195 HG LEU 6 HG LEU 6 0.545 -10.882 -9.712 196 HD11 LEU 6 1HD1 LEU 6 2.872 -10.989 -10.664 197 HD12 LEU 6 2HD1 LEU 6 2.722 -9.908 -9.266 198 HD13 LEU 6 3HD1 LEU 6 3.442 -11.513 -9.061 199 HD21 LEU 6 3HD2 LEU 6 1.355 -12.867 -10.978 200 HD22 LEU 6 1HD2 LEU 6 1.921 -13.603 -9.465 201 HD23 LEU 6 2HD2 LEU 6 0.185 -13.340 -9.737 202 H CYS 7 H CYS 7 -0.516 -14.091 -5.834 203 HA CYS 7 HA CYS 7 0.013 -12.839 -3.165 204 HB2 CYS 7 2HB CYS 7 -2.171 -14.835 -3.870 205 HB3 CYS 7 3HB CYS 7 -1.826 -14.232 -2.257 206 H GLY 8 H GLY 8 1.148 -14.180 -1.737 207 HA2 GLY 8 HA2 GLY 8 2.434 -15.955 -0.973 208 HA3 GLY 8 HA3 GLY 8 1.137 -16.942 -1.648 209 H SER 9 H SER 9 1.926 -18.552 -2.833 210 HA SER 9 HA SER 9 4.503 -18.838 -3.896 211 HB2 SER 9 2HB SER 9 1.931 -20.076 -4.947 212 HB3 SER 9 3HB SER 9 3.579 -20.695 -5.162 213 HG SER 9 HG SER 9 2.471 -21.761 -3.435 214 H HIS 10 H HIS 10 1.597 -17.455 -5.531 215 HA HIS 10 HA HIS 10 2.805 -17.251 -8.133 216 HB2 HIS 10 2HB HIS 10 0.280 -16.631 -6.906 217 HB3 HIS 10 3HB HIS 10 0.856 -15.147 -7.624 218 HD2 HIS 10 HD2 HIS 10 -1.267 -17.868 -8.541 219 HE1 HIS 10 HE1 HIS 10 0.611 -16.919 -12.241 220 HE2 HIS 10 HE2 HIS 10 -1.332 -18.159 -11.155 221 H LEU 11 H LEU 11 2.739 -15.110 -5.330 222 HA LEU 11 HA LEU 11 4.027 -12.859 -6.621 223 HB2 LEU 11 2HB LEU 11 2.489 -12.891 -4.532 224 HB3 LEU 11 3HB LEU 11 3.882 -13.492 -3.646 225 HG LEU 11 HG LEU 11 5.131 -11.403 -4.225 226 HD11 LEU 11 1HD1 LEU 11 3.858 -9.469 -5.120 227 HD12 LEU 11 2HD1 LEU 11 3.920 -10.757 -6.320 228 HD13 LEU 11 3HD1 LEU 11 2.444 -10.506 -5.358 229 HD21 LEU 11 3HD2 LEU 11 3.868 -11.617 -2.106 230 HD22 LEU 11 1HD2 LEU 11 3.807 -9.951 -2.699 231 HD23 LEU 11 2HD2 LEU 11 2.400 -11.003 -2.908 232 H VAL 12 H VAL 12 5.199 -15.475 -4.473 233 HA VAL 12 HA VAL 12 7.967 -14.796 -4.516 234 HB VAL 12 HB VAL 12 6.597 -17.500 -4.258 235 HG11 VAL 12 1HG1 VAL 12 9.527 -16.808 -3.764 236 HG12 VAL 12 2HG1 VAL 12 8.730 -18.307 -3.233 237 HG13 VAL 12 3HG1 VAL 12 8.895 -17.969 -4.957 238 HG21 VAL 12 3HG2 VAL 12 6.123 -15.840 -2.462 239 HG22 VAL 12 1HG2 VAL 12 7.051 -17.218 -1.866 240 HG23 VAL 12 2HG2 VAL 12 7.861 -15.664 -2.178 241 H GLU 13 H GLU 13 6.100 -16.910 -6.735 242 HA GLU 13 HA GLU 13 8.188 -17.555 -8.551 243 HB2 GLU 13 2HB GLU 13 5.175 -17.362 -8.762 244 HB3 GLU 13 3HB GLU 13 6.127 -17.535 -10.228 245 HG2 GLU 13 2HG GLU 13 7.206 -19.558 -9.355 246 HG3 GLU 13 3HG GLU 13 6.328 -19.402 -7.828 247 H ALA 14 H ALA 14 5.957 -14.673 -8.633 248 HA ALA 14 HA ALA 14 7.090 -13.588 -11.003 249 HB1 ALA 14 3HB ALA 14 5.778 -12.190 -8.635 250 HB2 ALA 14 1HB ALA 14 5.989 -11.519 -10.268 251 HB3 ALA 14 2HB ALA 14 4.943 -12.940 -10.023 252 H LEU 15 H LEU 15 7.952 -12.908 -7.548 253 HA LEU 15 HA LEU 15 10.076 -11.110 -8.099 254 HB2 LEU 15 2HB LEU 15 9.345 -12.908 -5.784 255 HB3 LEU 15 3HB LEU 15 10.980 -12.291 -5.836 256 HG LEU 15 HG LEU 15 9.660 -10.900 -4.424 257 HD11 LEU 15 1HD1 LEU 15 11.462 -9.837 -5.779 258 HD12 LEU 15 2HD1 LEU 15 10.239 -9.312 -6.957 259 HD13 LEU 15 3HD1 LEU 15 10.178 -8.717 -5.293 260 HD21 LEU 15 3HD2 LEU 15 7.808 -10.484 -6.794 261 HD22 LEU 15 1HD2 LEU 15 7.434 -11.181 -5.206 262 HD23 LEU 15 2HD2 LEU 15 7.813 -9.462 -5.341 263 H TYR 16 H TYR 16 10.183 -14.696 -8.069 264 HA TYR 16 HA TYR 16 13.001 -14.882 -8.567 265 HB2 TYR 16 2HB TYR 16 11.566 -16.823 -7.952 266 HB3 TYR 16 3HB TYR 16 10.787 -16.727 -9.536 267 HD1 TYR 16 HD1 TYR 16 13.947 -17.538 -7.767 268 HD2 TYR 16 HD2 TYR 16 11.949 -17.401 -11.588 269 HE1 TYR 16 HE1 TYR 16 15.799 -18.848 -8.783 270 HE2 TYR 16 HE2 TYR 16 13.799 -18.688 -12.610 271 HH TYR 16 HH TYR 16 16.641 -19.800 -10.701 272 H LEU 17 H LEU 17 10.239 -14.579 -10.880 273 HA LEU 17 HA LEU 17 11.917 -14.690 -13.221 274 HB2 LEU 17 2HB LEU 17 9.138 -13.502 -12.812 275 HB3 LEU 17 3HB LEU 17 9.921 -13.722 -14.370 276 HG LEU 17 HG LEU 17 9.227 -15.987 -12.466 277 HD11 LEU 17 1HD1 LEU 17 7.423 -16.498 -14.060 278 HD12 LEU 17 2HD1 LEU 17 7.223 -14.878 -13.377 279 HD13 LEU 17 3HD1 LEU 17 7.855 -15.071 -15.028 280 HD21 LEU 17 3HD2 LEU 17 9.664 -17.445 -14.438 281 HD22 LEU 17 1HD2 LEU 17 10.257 -16.032 -15.338 282 HD23 LEU 17 2HD2 LEU 17 11.123 -16.614 -13.898 283 H VAL 18 H VAL 18 10.572 -11.836 -11.476 284 HA VAL 18 HA VAL 18 11.911 -10.056 -13.352 285 HB VAL 18 HB VAL 18 11.246 -8.556 -10.955 286 HG11 VAL 18 1HG1 VAL 18 9.826 -7.334 -12.471 287 HG12 VAL 18 2HG1 VAL 18 11.405 -7.639 -13.216 288 HG13 VAL 18 3HG1 VAL 18 9.994 -8.608 -13.712 289 HG21 VAL 18 3HG2 VAL 18 8.833 -8.821 -11.020 290 HG22 VAL 18 1HG2 VAL 18 9.027 -10.354 -11.886 291 HG23 VAL 18 2HG2 VAL 18 9.745 -10.117 -10.243 292 H CYS 19 H CYS 19 12.803 -11.210 -10.103 293 HA CYS 19 HA CYS 19 15.156 -9.375 -10.184 294 HB2 CYS 19 2HB CYS 19 13.393 -9.116 -8.392 295 HB3 CYS 19 3HB CYS 19 13.884 -10.694 -7.769 296 H GLY 20 H GLY 20 14.364 -12.807 -9.868 297 HA2 GLY 20 HA2 GLY 20 17.124 -13.590 -9.107 298 HA3 GLY 20 HA3 GLY 20 15.742 -14.663 -9.431 299 H GLU 21 H GLU 21 15.006 -14.760 -11.687 300 HA GLU 21 HA GLU 21 17.058 -15.419 -13.573 301 HB2 GLU 21 2HB GLU 21 14.768 -16.438 -13.315 302 HB3 GLU 21 3HB GLU 21 14.080 -14.953 -13.958 303 HG2 GLU 21 2HG GLU 21 14.130 -16.564 -15.695 304 HG3 GLU 21 3HG GLU 21 15.324 -15.345 -16.100 305 H ARG 22 H ARG 22 15.271 -12.458 -12.899 306 HA ARG 22 HA ARG 22 14.890 -10.503 -13.952 307 HB2 ARG 22 2HB ARG 22 17.808 -11.068 -14.320 308 HB3 ARG 22 3HB ARG 22 17.129 -9.500 -14.820 309 HG2 ARG 22 2HG ARG 22 16.602 -8.852 -12.668 310 HG3 ARG 22 3HG ARG 22 16.537 -10.503 -12.052 311 HD2 ARG 22 2HD ARG 22 19.108 -9.159 -12.941 312 HD3 ARG 22 3HD ARG 22 18.511 -9.142 -11.270 313 HE ARG 22 HE ARG 22 18.451 -11.784 -11.757 314 HH11 ARG 22 2HH2 ARG 22 21.129 -9.516 -12.239 315 HH12 ARG 22 1HH2 ARG 22 22.318 -10.768 -12.036 316 HH21 ARG 22 1HH1 ARG 22 19.963 -13.300 -11.548 317 HH22 ARG 22 2HH1 ARG 22 21.667 -12.912 -11.629 318 H GLY 23 H GLY 23 13.766 -12.390 -15.383 319 HA2 GLY 23 HA2 GLY 23 13.469 -11.351 -18.035 320 HA3 GLY 23 HA3 GLY 23 14.451 -12.802 -18.093 321 H HIS 24 H HIS 24 12.009 -12.632 -19.359 322 HA HIS 24 HA HIS 24 9.772 -13.552 -17.857 323 HB2 HIS 24 2HB HIS 24 10.324 -13.764 -20.839 324 HB3 HIS 24 3HB HIS 24 8.749 -13.919 -20.062 325 HD2 HIS 24 HD2 HIS 24 11.141 -11.348 -21.417 326 HE1 HIS 24 HE1 HIS 24 8.180 -9.092 -19.357 327 HE2 HIS 24 HE2 HIS 24 10.162 -8.951 -20.949 328 H PHE 25 H PHE 25 8.617 -15.551 -17.974 329 HA PHE 25 HA PHE 25 10.198 -17.887 -17.475 330 HB2 PHE 25 2HB PHE 25 8.031 -17.450 -16.405 331 HB3 PHE 25 3HB PHE 25 7.216 -17.540 -17.961 332 HD1 PHE 25 HD2 PHE 25 9.441 -19.584 -15.699 333 HD2 PHE 25 HD1 PHE 25 6.294 -19.606 -18.650 334 HE1 PHE 25 HE2 PHE 25 9.199 -22.037 -15.428 335 HE2 PHE 25 HE1 PHE 25 6.045 -22.057 -18.362 336 HZ PHE 25 HZ PHE 25 7.502 -23.280 -16.759 337 H TYR 26 H TYR 26 10.476 -19.784 -18.623 338 HA TYR 26 HA TYR 26 9.588 -20.051 -21.431 339 HB2 TYR 26 2HB TYR 26 11.658 -18.752 -21.524 340 HB3 TYR 26 3HB TYR 26 12.471 -19.920 -20.482 341 HD1 TYR 26 HD2 TYR 26 10.519 -19.787 -23.686 342 HD2 TYR 26 HD1 TYR 26 13.753 -21.597 -21.497 343 HE1 TYR 26 HE2 TYR 26 11.093 -21.147 -25.682 344 HE2 TYR 26 HE1 TYR 26 14.392 -22.914 -23.517 345 HH TYR 26 HH TYR 26 13.905 -23.399 -25.719 346 H THR 27 H THR 27 9.703 -22.132 -22.207 347 HA THR 27 HA THR 27 10.285 -24.360 -20.290 348 HB THR 27 HB THR 27 8.571 -25.663 -21.593 349 HG1 THR 27 HG1 THR 27 8.432 -24.185 -23.350 350 HG21 THR 27 1HG2 THR 27 6.675 -24.728 -20.354 351 HG22 THR 27 2HG2 THR 27 8.124 -24.739 -19.335 352 HG23 THR 27 3HG2 THR 27 7.566 -23.218 -20.069 353 HA PRO 28 HA PRO 28 13.176 -25.044 -23.718 354 HB2 PRO 28 2HB PRO 28 14.944 -26.713 -22.505 355 HB3 PRO 28 3HB PRO 28 14.850 -24.970 -22.107 356 HG2 PRO 28 2HG PRO 28 13.548 -27.283 -20.633 357 HG3 PRO 28 3HG PRO 28 14.540 -25.954 -19.946 358 HD2 PRO 28 2HD PRO 28 11.811 -25.883 -19.965 359 HD3 PRO 28 3HD PRO 28 12.784 -24.397 -20.194 360 H LYS 29 H LYS 29 13.792 -26.789 -25.085 361 HA LYS 29 HA LYS 29 11.711 -28.868 -25.256 362 HB2 LYS 29 2HB LYS 29 13.839 -27.927 -27.227 363 HB3 LYS 29 3HB LYS 29 12.571 -29.107 -27.588 364 HG2 LYS 29 2HG LYS 29 10.834 -27.393 -27.052 365 HG3 LYS 29 3HG LYS 29 12.105 -26.182 -26.844 366 HD2 LYS 29 2HD LYS 29 11.549 -27.736 -29.408 367 HD3 LYS 29 3HD LYS 29 11.018 -26.083 -29.067 368 HE2 LYS 29 2HE LYS 29 13.397 -25.371 -28.823 369 HE3 LYS 29 3HE LYS 29 13.923 -27.015 -29.215 370 HZ1 LYS 29 HZ1 LYS 29 12.861 -26.766 -31.389 371 HZ2 LYS 29 HZ2 LYS 29 12.378 -25.245 -31.028 372 HZ3 LYS 29 HZ3 LYS 29 13.968 -25.587 -31.167 373 H THR 30 H THR 30 14.119 -29.042 -23.435 374 HA THR 30 HA THR 30 14.872 -31.868 -23.946 375 HB THR 30 HB THR 30 17.254 -31.387 -23.339 376 HG1 THR 30 HG1 THR 30 16.522 -28.734 -24.042 377 HG21 THR 30 1HG2 THR 30 16.357 -30.108 -25.956 378 HG22 THR 30 2HG2 THR 30 17.968 -30.747 -25.567 379 HG23 THR 30 3HG2 THR 30 16.585 -31.848 -25.679 Start of MODEL 10 1 H1 GLY 1 1H GLY 1 3.546 -2.455 2.138 2 H2 GLY 1 2H GLY 1 4.530 -1.695 1.063 3 H3 GLY 1 3H GLY 1 5.024 -1.945 2.607 4 HA2 GLY 1 HA2 GLY 1 6.153 -3.517 1.265 5 HA3 GLY 1 HA3 GLY 1 4.955 -4.357 2.264 6 H ILE 2 H ILE 2 5.913 -5.596 0.076 7 HA ILE 2 HA ILE 2 4.624 -5.080 -2.395 8 HB ILE 2 HB ILE 2 6.762 -6.234 -2.127 9 HG12 ILE 2 2HG1 ILE 2 6.592 -7.986 -3.776 10 HG13 ILE 2 3HG1 ILE 2 4.835 -8.065 -3.579 11 HG21 ILE 2 1HG2 ILE 2 7.001 -8.544 -1.473 12 HG22 ILE 2 2HG2 ILE 2 6.249 -7.662 -0.146 13 HG23 ILE 2 3HG2 ILE 2 5.264 -8.709 -1.193 14 HD11 ILE 2 3HD1 ILE 2 6.423 -5.730 -4.690 15 HD12 ILE 2 1HD1 ILE 2 5.497 -6.902 -5.613 16 HD13 ILE 2 2HD1 ILE 2 4.649 -5.778 -4.531 17 H VAL 3 H VAL 3 3.625 -7.403 0.119 18 HA VAL 3 HA VAL 3 1.648 -8.711 -1.479 19 HB VAL 3 HB VAL 3 1.758 -8.442 1.551 20 HG11 VAL 3 1HG1 VAL 3 0.127 -10.369 -0.175 21 HG12 VAL 3 2HG1 VAL 3 0.324 -10.491 1.586 22 HG13 VAL 3 3HG1 VAL 3 -0.526 -9.109 0.897 23 HG21 VAL 3 3HG2 VAL 3 2.656 -10.716 -0.276 24 HG22 VAL 3 1HG2 VAL 3 3.742 -9.596 0.575 25 HG23 VAL 3 2HG2 VAL 3 2.728 -10.709 1.496 26 H GLU 4 H GLU 4 1.301 -5.982 0.838 27 HA GLU 4 HA GLU 4 -1.508 -5.595 0.308 28 HB2 GLU 4 2HB GLU 4 -1.332 -3.630 1.683 29 HB3 GLU 4 3HB GLU 4 -0.460 -4.970 2.433 30 HG2 GLU 4 2HG GLU 4 1.677 -4.060 1.559 31 HG3 GLU 4 3HG GLU 4 0.816 -2.678 0.867 32 H GLN 5 H GLN 5 0.861 -5.207 -1.902 33 HA GLN 5 HA GLN 5 -0.767 -3.154 -3.358 34 HB2 GLN 5 2HB GLN 5 2.194 -3.832 -3.599 35 HB3 GLN 5 3HB GLN 5 1.315 -2.820 -4.746 36 HG2 GLN 5 2HG GLN 5 1.602 -2.210 -1.761 37 HG3 GLN 5 3HG GLN 5 2.600 -1.541 -3.031 38 HE21 GLN 5 2HE2 GLN 5 -0.763 -1.541 -1.729 39 HE22 GLN 5 1HE2 GLN 5 -1.171 -0.011 -2.501 40 H CYS 6 H CYS 6 1.390 -5.977 -4.116 41 HA CYS 6 HA CYS 6 0.023 -6.411 -6.614 42 HB2 CYS 6 2HB CYS 6 2.024 -8.000 -5.001 43 HB3 CYS 6 3HB CYS 6 1.419 -8.540 -6.561 44 H CYS 7 H CYS 7 -0.502 -7.951 -3.441 45 HA CYS 7 HA CYS 7 -2.186 -10.039 -4.627 46 HB2 CYS 7 2HB CYS 7 -0.815 -10.398 -2.597 47 HB3 CYS 7 3HB CYS 7 -1.836 -9.255 -1.724 48 H THR 8 H THR 8 -2.827 -6.900 -3.187 49 HA THR 8 HA THR 8 -5.744 -7.346 -3.155 50 HB THR 8 HB THR 8 -4.557 -6.112 -1.343 51 HG1 THR 8 HG1 THR 8 -6.750 -5.784 -1.656 52 HG21 THR 8 1HG2 THR 8 -2.944 -4.852 -2.713 53 HG22 THR 8 2HG2 THR 8 -4.272 -3.907 -3.428 54 HG23 THR 8 3HG2 THR 8 -3.919 -3.780 -1.692 55 H SER 9 H SER 9 -3.380 -5.788 -5.289 56 HA SER 9 HA SER 9 -5.476 -5.419 -7.315 57 HB2 SER 9 2HB SER 9 -5.053 -3.108 -7.709 58 HB3 SER 9 3HB SER 9 -5.558 -3.318 -6.025 59 HG SER 9 HG SER 9 -3.154 -3.370 -5.593 60 H ILE 10 H ILE 10 -4.543 -4.581 -9.412 61 HA ILE 10 HA ILE 10 -2.377 -6.389 -10.020 62 HB ILE 10 HB ILE 10 -3.908 -4.447 -11.792 63 HG12 ILE 10 2HG1 ILE 10 -4.121 -7.385 -11.017 64 HG13 ILE 10 3HG1 ILE 10 -5.323 -6.107 -10.856 65 HG21 ILE 10 1HG2 ILE 10 -2.901 -5.822 -13.669 66 HG22 ILE 10 2HG2 ILE 10 -1.736 -4.817 -12.823 67 HG23 ILE 10 3HG2 ILE 10 -1.813 -6.544 -12.456 68 HD11 ILE 10 3HD1 ILE 10 -4.462 -7.472 -13.407 69 HD12 ILE 10 1HD1 ILE 10 -6.013 -7.585 -12.544 70 HD13 ILE 10 2HD1 ILE 10 -5.557 -6.046 -13.312 71 H CYS 11 H CYS 11 -0.321 -6.063 -9.939 72 HA CYS 11 HA CYS 11 0.818 -3.305 -10.044 73 HB2 CYS 11 2HB CYS 11 2.666 -4.172 -8.778 74 HB3 CYS 11 3HB CYS 11 1.159 -4.545 -7.949 75 H SER 12 H SER 12 2.656 -2.910 -11.282 76 HA SER 12 HA SER 12 3.064 -4.726 -13.632 77 HB2 SER 12 2HB SER 12 3.875 -1.836 -13.198 78 HB3 SER 12 3HB SER 12 4.137 -2.795 -14.666 79 HG SER 12 HG SER 12 2.202 -1.444 -14.690 80 H LEU 13 H LEU 13 5.133 -5.228 -14.438 81 HA LEU 13 HA LEU 13 6.763 -6.378 -12.433 82 HB2 LEU 13 2HB LEU 13 8.211 -7.005 -14.214 83 HB3 LEU 13 3HB LEU 13 6.549 -7.345 -14.626 84 HG LEU 13 HG LEU 13 8.026 -4.908 -15.702 85 HD11 LEU 13 1HD1 LEU 13 9.313 -6.927 -16.269 86 HD12 LEU 13 2HD1 LEU 13 7.849 -7.687 -16.933 87 HD13 LEU 13 3HD1 LEU 13 8.543 -6.245 -17.709 88 HD21 LEU 13 3HD2 LEU 13 5.622 -4.738 -16.089 89 HD22 LEU 13 1HD2 LEU 13 6.437 -5.099 -17.602 90 HD23 LEU 13 2HD2 LEU 13 5.585 -6.394 -16.744 91 H TYR 14 H TYR 14 7.139 -3.395 -14.233 92 HA TYR 14 HA TYR 14 9.840 -2.879 -13.511 93 HB2 TYR 14 2HB TYR 14 9.426 -0.685 -14.480 94 HB3 TYR 14 3HB TYR 14 8.754 -1.989 -15.477 95 HD1 TYR 14 HD2 TYR 14 7.773 0.653 -12.972 96 HD2 TYR 14 HD1 TYR 14 6.537 -1.886 -16.236 97 HE1 TYR 14 HE2 TYR 14 5.581 1.810 -13.037 98 HE2 TYR 14 HE1 TYR 14 4.360 -0.692 -16.336 99 HH TYR 14 HH TYR 14 3.527 1.968 -14.072 100 H GLN 15 H GLN 15 7.030 -2.594 -11.650 101 HA GLN 15 HA GLN 15 8.329 -0.667 -9.743 102 HB2 GLN 15 2HB GLN 15 6.065 -0.195 -8.867 103 HB3 GLN 15 3HB GLN 15 6.291 0.318 -10.546 104 HG2 GLN 15 2HG GLN 15 5.053 -1.593 -11.361 105 HG3 GLN 15 3HG GLN 15 4.913 -2.269 -9.724 106 HE21 GLN 15 2HE2 GLN 15 4.354 1.210 -9.848 107 HE22 GLN 15 1HE2 GLN 15 2.607 1.056 -9.826 108 H LEU 16 H LEU 16 6.896 -3.917 -10.127 109 HA LEU 16 HA LEU 16 7.020 -4.470 -7.309 110 HB2 LEU 16 2HB LEU 16 5.992 -6.385 -7.812 111 HB3 LEU 16 3HB LEU 16 5.668 -5.533 -9.304 112 HG LEU 16 HG LEU 16 7.806 -6.630 -10.196 113 HD11 LEU 16 1HD1 LEU 16 7.889 -9.076 -8.983 114 HD12 LEU 16 2HD1 LEU 16 8.973 -7.751 -8.584 115 HD13 LEU 16 3HD1 LEU 16 7.531 -8.053 -7.585 116 HD21 LEU 16 3HD2 LEU 16 6.522 -8.666 -10.858 117 HD22 LEU 16 1HD2 LEU 16 5.407 -8.426 -9.501 118 HD23 LEU 16 2HD2 LEU 16 5.435 -7.267 -10.847 119 H GLU 17 H GLU 17 9.439 -4.706 -9.902 120 HA GLU 17 HA GLU 17 11.482 -6.200 -8.624 121 HB2 GLU 17 2HB GLU 17 11.668 -3.695 -10.369 122 HB3 GLU 17 3HB GLU 17 13.088 -4.533 -9.741 123 HG2 GLU 17 2HG GLU 17 12.226 -6.644 -10.849 124 HG3 GLU 17 3HG GLU 17 11.076 -5.591 -11.695 125 H ASN 18 H ASN 18 10.362 -2.948 -8.046 126 HA ASN 18 HA ASN 18 12.641 -1.999 -6.545 127 HB2 ASN 18 2HB ASN 18 9.888 -0.991 -7.151 128 HB3 ASN 18 3HB ASN 18 10.676 -0.333 -5.762 129 HD21 ASN 18 2HD2 ASN 18 10.929 -0.744 -9.318 130 HD22 ASN 18 1HD2 ASN 18 12.066 0.566 -9.532 131 H TYR 19 H TYR 19 10.270 -4.234 -5.609 132 HA TYR 19 HA TYR 19 10.625 -3.763 -2.692 133 HB2 TYR 19 2HB TYR 19 8.899 -5.706 -4.270 134 HB3 TYR 19 3HB TYR 19 8.935 -5.545 -2.526 135 HD1 TYR 19 HD2 TYR 19 8.099 -3.682 -5.688 136 HD2 TYR 19 HD1 TYR 19 7.596 -3.951 -1.407 137 HE1 TYR 19 HE2 TYR 19 6.355 -1.914 -5.773 138 HE2 TYR 19 HE1 TYR 19 5.753 -2.280 -1.520 139 HH TYR 19 HH TYR 19 4.876 -0.633 -4.593 140 H CYS 20 H CYS 20 12.191 -5.532 -5.169 141 HA CYS 20 HA CYS 20 12.743 -8.012 -3.772 142 HB2 CYS 20 2HB CYS 20 12.822 -7.618 -6.253 143 HB3 CYS 20 3HB CYS 20 14.264 -6.631 -6.014 144 H ASN 21 H ASN 21 14.277 -4.873 -3.805 145 HA ASN 21 HA ASN 21 16.780 -5.656 -2.521 146 HB2 ASN 21 2HB ASN 21 17.062 -3.120 -2.355 147 HB3 ASN 21 3HB ASN 21 16.974 -3.824 -3.965 148 HD21 ASN 21 1HD2 ASN 21 14.249 -3.037 -1.786 149 HD22 ASN 21 2HD2 ASN 21 13.487 -1.933 -2.949 150 H1 PHE 1 1H PHE 1 6.953 -11.820 -18.463 151 H2 PHE 1 2H PHE 1 5.944 -10.983 -19.449 152 H3 PHE 1 3H PHE 1 5.636 -12.551 -19.106 153 HA PHE 1 HA PHE 1 5.233 -12.058 -16.806 154 HB2 PHE 1 2HB PHE 1 6.807 -10.127 -16.707 155 HB3 PHE 1 3HB PHE 1 5.679 -9.160 -17.641 156 HD1 PHE 1 HD1 PHE 1 6.169 -10.944 -14.387 157 HD2 PHE 1 HD2 PHE 1 3.826 -8.027 -16.551 158 HE1 PHE 1 HE1 PHE 1 5.100 -10.217 -12.271 159 HE2 PHE 1 HE2 PHE 1 2.812 -7.274 -14.421 160 HZ PHE 1 HZ PHE 1 3.430 -8.374 -12.282 161 H VAL 2 H VAL 2 3.096 -11.422 -16.044 162 HA VAL 2 HA VAL 2 1.217 -10.263 -18.040 163 HB VAL 2 HB VAL 2 0.597 -12.732 -16.354 164 HG11 VAL 2 1HG1 VAL 2 -1.653 -12.644 -17.436 165 HG12 VAL 2 2HG1 VAL 2 -1.371 -11.252 -16.392 166 HG13 VAL 2 3HG1 VAL 2 -1.232 -11.074 -18.154 167 HG21 VAL 2 3HG2 VAL 2 0.685 -12.363 -19.378 168 HG22 VAL 2 1HG2 VAL 2 1.814 -13.327 -18.399 169 HG23 VAL 2 2HG2 VAL 2 0.124 -13.821 -18.531 170 H ASN 3 H ASN 3 0.479 -8.453 -17.144 171 HA ASN 3 HA ASN 3 0.585 -7.809 -14.368 172 HB2 ASN 3 2HB ASN 3 -1.184 -6.587 -16.533 173 HB3 ASN 3 3HB ASN 3 -0.717 -5.862 -14.989 174 HD21 ASN 3 2HD2 ASN 3 1.004 -4.569 -14.904 175 HD22 ASN 3 1HD2 ASN 3 2.127 -4.427 -16.228 176 H GLN 4 H GLN 4 -0.599 -8.662 -12.782 177 HA GLN 4 HA GLN 4 -3.438 -9.316 -12.964 178 HB2 GLN 4 2HB GLN 4 -3.219 -11.703 -12.689 179 HB3 GLN 4 3HB GLN 4 -2.309 -11.237 -14.123 180 HG2 GLN 4 2HG GLN 4 -0.265 -11.093 -12.536 181 HG3 GLN 4 3HG GLN 4 -1.243 -11.959 -11.360 182 HE21 GLN 4 2HE2 GLN 4 1.001 -12.402 -13.814 183 HE22 GLN 4 1HE2 GLN 4 0.680 -14.108 -14.108 184 H HIS 5 H HIS 5 -3.864 -10.766 -10.867 185 HA HIS 5 HA HIS 5 -2.774 -9.290 -8.521 186 HB2 HIS 5 2HB HIS 5 -5.028 -11.322 -8.767 187 HB3 HIS 5 3HB HIS 5 -4.540 -10.499 -7.286 188 HD2 HIS 5 HD2 HIS 5 -6.152 -9.720 -10.735 189 HE1 HIS 5 HE1 HIS 5 -7.047 -6.467 -8.164 190 HE2 HIS 5 HE2 HIS 5 -7.556 -7.527 -10.421 191 H LEU 6 H LEU 6 -1.248 -10.152 -7.235 192 HA LEU 6 HA LEU 6 -0.450 -13.034 -7.550 193 HB2 LEU 6 2HB LEU 6 1.275 -10.540 -7.457 194 HB3 LEU 6 3HB LEU 6 1.894 -12.184 -7.341 195 HG LEU 6 HG LEU 6 0.412 -11.050 -9.757 196 HD11 LEU 6 1HD1 LEU 6 2.699 -11.118 -10.794 197 HD12 LEU 6 2HD1 LEU 6 2.558 -9.947 -9.467 198 HD13 LEU 6 3HD1 LEU 6 3.358 -11.505 -9.184 199 HD21 LEU 6 3HD2 LEU 6 1.320 -13.091 -10.897 200 HD22 LEU 6 1HD2 LEU 6 1.895 -13.689 -9.331 201 HD23 LEU 6 2HD2 LEU 6 0.154 -13.498 -9.636 202 H CYS 7 H CYS 7 -0.515 -14.113 -5.740 203 HA CYS 7 HA CYS 7 0.047 -12.791 -3.112 204 HB2 CYS 7 2HB CYS 7 -2.130 -14.818 -3.733 205 HB3 CYS 7 3HB CYS 7 -1.812 -14.102 -2.162 206 H GLY 8 H GLY 8 1.227 -14.069 -1.675 207 HA2 GLY 8 HA2 GLY 8 2.530 -15.812 -0.871 208 HA3 GLY 8 HA3 GLY 8 1.237 -16.837 -1.498 209 H SER 9 H SER 9 2.040 -18.469 -2.641 210 HA SER 9 HA SER 9 4.600 -18.746 -3.739 211 HB2 SER 9 2HB SER 9 2.031 -20.047 -4.717 212 HB3 SER 9 3HB SER 9 3.682 -20.651 -4.942 213 HG SER 9 HG SER 9 2.616 -21.684 -3.170 214 H HIS 10 H HIS 10 1.646 -17.466 -5.370 215 HA HIS 10 HA HIS 10 2.797 -17.337 -7.998 216 HB2 HIS 10 2HB HIS 10 0.292 -16.735 -6.756 217 HB3 HIS 10 3HB HIS 10 0.824 -15.238 -7.481 218 HD2 HIS 10 HD2 HIS 10 -1.242 -18.023 -8.360 219 HE1 HIS 10 HE1 HIS 10 0.539 -17.020 -12.095 220 HE2 HIS 10 HE2 HIS 10 -1.348 -18.315 -10.974 221 H LEU 11 H LEU 11 2.768 -15.099 -5.280 222 HA LEU 11 HA LEU 11 3.993 -12.868 -6.674 223 HB2 LEU 11 2HB LEU 11 2.460 -12.825 -4.622 224 HB3 LEU 11 3HB LEU 11 3.820 -13.426 -3.685 225 HG LEU 11 HG LEU 11 5.117 -11.369 -4.282 226 HD11 LEU 11 1HD1 LEU 11 3.918 -9.425 -5.214 227 HD12 LEU 11 2HD1 LEU 11 3.917 -10.735 -6.395 228 HD13 LEU 11 3HD1 LEU 11 2.459 -10.401 -5.430 229 HD21 LEU 11 3HD2 LEU 11 3.853 -11.553 -2.175 230 HD22 LEU 11 1HD2 LEU 11 3.793 -9.890 -2.775 231 HD23 LEU 11 2HD2 LEU 11 2.386 -10.945 -2.977 232 H VAL 12 H VAL 12 5.235 -15.376 -4.427 233 HA VAL 12 HA VAL 12 7.998 -14.653 -4.538 234 HB VAL 12 HB VAL 12 6.675 -17.369 -4.162 235 HG11 VAL 12 1HG1 VAL 12 9.595 -16.604 -3.726 236 HG12 VAL 12 2HG1 VAL 12 8.835 -18.098 -3.135 237 HG13 VAL 12 3HG1 VAL 12 8.974 -17.817 -4.870 238 HG21 VAL 12 3HG2 VAL 12 6.187 -15.658 -2.420 239 HG22 VAL 12 1HG2 VAL 12 7.154 -16.993 -1.786 240 HG23 VAL 12 2HG2 VAL 12 7.924 -15.433 -2.165 241 H GLU 13 H GLU 13 6.121 -16.858 -6.655 242 HA GLU 13 HA GLU 13 8.192 -17.515 -8.486 243 HB2 GLU 13 2HB GLU 13 5.174 -17.368 -8.679 244 HB3 GLU 13 3HB GLU 13 6.133 -17.597 -10.133 245 HG2 GLU 13 3HG GLU 13 7.231 -19.576 -9.139 246 HG3 GLU 13 2HG GLU 13 6.302 -19.364 -7.653 247 H ALA 14 H ALA 14 5.876 -14.674 -8.655 248 HA ALA 14 HA ALA 14 6.974 -13.656 -11.060 249 HB1 ALA 14 3HB ALA 14 5.657 -12.214 -8.723 250 HB2 ALA 14 1HB ALA 14 5.824 -11.597 -10.380 251 HB3 ALA 14 2HB ALA 14 4.817 -13.034 -10.071 252 H LEU 15 H LEU 15 7.848 -12.863 -7.640 253 HA LEU 15 HA LEU 15 9.887 -10.993 -8.252 254 HB2 LEU 15 2HB LEU 15 9.243 -12.768 -5.895 255 HB3 LEU 15 3HB LEU 15 10.862 -12.113 -5.977 256 HG LEU 15 HG LEU 15 9.527 -10.728 -4.576 257 HD11 LEU 15 1HD1 LEU 15 11.291 -9.648 -5.925 258 HD12 LEU 15 2HD1 LEU 15 10.094 -9.215 -7.159 259 HD13 LEU 15 3HD1 LEU 15 9.967 -8.541 -5.527 260 HD21 LEU 15 3HD2 LEU 15 7.300 -11.079 -5.319 261 HD22 LEU 15 1HD2 LEU 15 7.633 -9.354 -5.478 262 HD23 LEU 15 2HD2 LEU 15 7.623 -10.391 -6.922 263 H TYR 16 H TYR 16 10.123 -14.568 -8.183 264 HA TYR 16 HA TYR 16 12.952 -14.618 -8.739 265 HB2 TYR 16 2HB TYR 16 11.673 -16.614 -8.001 266 HB3 TYR 16 3HB TYR 16 10.813 -16.621 -9.545 267 HD1 TYR 16 HD1 TYR 16 14.205 -16.948 -7.999 268 HD2 TYR 16 HD2 TYR 16 11.830 -17.472 -11.562 269 HE1 TYR 16 HE1 TYR 16 16.129 -18.061 -9.120 270 HE2 TYR 16 HE2 TYR 16 13.746 -18.586 -12.682 271 HH TYR 16 HH TYR 16 15.937 -19.271 -12.495 272 H LEU 17 H LEU 17 10.093 -14.600 -10.949 273 HA LEU 17 HA LEU 17 11.645 -14.743 -13.351 274 HB2 LEU 17 2HB LEU 17 8.874 -13.547 -12.875 275 HB3 LEU 17 3HB LEU 17 9.578 -13.865 -14.452 276 HG LEU 17 HG LEU 17 8.976 -15.995 -12.385 277 HD11 LEU 17 1HD1 LEU 17 7.093 -16.605 -13.849 278 HD12 LEU 17 2HD1 LEU 17 6.927 -14.944 -13.256 279 HD13 LEU 17 3HD1 LEU 17 7.474 -15.239 -14.923 280 HD21 LEU 17 3HD2 LEU 17 9.855 -16.241 -15.293 281 HD22 LEU 17 1HD2 LEU 17 10.794 -16.724 -13.861 282 HD23 LEU 17 2HD2 LEU 17 9.310 -17.587 -14.269 283 H VAL 18 H VAL 18 10.396 -11.850 -11.625 284 HA VAL 18 HA VAL 18 11.599 -10.095 -13.614 285 HB VAL 18 HB VAL 18 11.170 -8.703 -11.057 286 HG11 VAL 18 1HG1 VAL 18 9.882 -7.213 -12.484 287 HG12 VAL 18 2HG1 VAL 18 11.450 -7.581 -13.218 288 HG13 VAL 18 3HG1 VAL 18 9.984 -8.379 -13.830 289 HG21 VAL 18 3HG2 VAL 18 9.495 -10.063 -10.445 290 HG22 VAL 18 1HG2 VAL 18 8.695 -8.728 -11.258 291 HG23 VAL 18 2HG2 VAL 18 8.844 -10.278 -12.115 292 H CYS 19 H CYS 19 12.557 -10.953 -10.236 293 HA CYS 19 HA CYS 19 14.907 -9.182 -10.533 294 HB2 CYS 19 2HB CYS 19 13.262 -8.941 -8.661 295 HB3 CYS 19 3HB CYS 19 13.746 -10.534 -8.077 296 H GLY 20 H GLY 20 14.167 -12.607 -9.894 297 HA2 GLY 20 HA2 GLY 20 16.883 -13.307 -9.048 298 HA3 GLY 20 HA3 GLY 20 15.519 -14.418 -9.332 299 H GLU 21 H GLU 21 14.876 -14.161 -11.893 300 HA GLU 21 HA GLU 21 16.836 -15.669 -13.233 301 HB2 GLU 21 2HB GLU 21 14.368 -15.673 -13.635 302 HB3 GLU 21 3HB GLU 21 14.531 -14.130 -14.487 303 HG2 GLU 21 2HG GLU 21 16.002 -15.187 -16.161 304 HG3 GLU 21 3HG GLU 21 15.983 -16.703 -15.254 305 H ARG 22 H ARG 22 16.260 -12.124 -13.387 306 HA ARG 22 HA ARG 22 18.142 -11.714 -15.523 307 HB2 ARG 22 2HB ARG 22 17.863 -9.462 -15.295 308 HB3 ARG 22 3HB ARG 22 16.282 -10.164 -14.964 309 HG2 ARG 22 2HG ARG 22 16.650 -9.807 -12.533 310 HG3 ARG 22 3HG ARG 22 18.231 -9.082 -12.869 311 HD2 ARG 22 2HD ARG 22 15.544 -8.045 -13.850 312 HD3 ARG 22 3HD ARG 22 16.497 -7.368 -12.518 313 HE ARG 22 HE ARG 22 18.056 -7.460 -14.937 314 HH11 ARG 22 1HH1 ARG 22 15.435 -5.540 -13.473 315 HH12 ARG 22 2HH1 ARG 22 15.779 -4.179 -14.501 316 HH21 ARG 22 1HH2 ARG 22 18.348 -5.737 -16.259 317 HH22 ARG 22 2HH2 ARG 22 17.447 -4.259 -16.023 318 H GLY 23 H GLY 23 18.780 -12.706 -12.413 319 HA2 GLY 23 HA2 GLY 23 21.525 -11.582 -12.212 320 HA3 GLY 23 HA3 GLY 23 20.713 -12.731 -11.107 321 H HIS 24 H HIS 24 19.825 -14.518 -13.187 322 HA HIS 24 HA HIS 24 22.301 -16.088 -13.570 323 HB2 HIS 24 2HB HIS 24 19.353 -16.711 -14.003 324 HB3 HIS 24 3HB HIS 24 20.670 -17.851 -14.268 325 HD2 HIS 24 HD2 HIS 24 18.412 -16.604 -11.570 326 HE1 HIS 24 HE1 HIS 24 21.473 -18.738 -9.526 327 HE2 HIS 24 HE2 HIS 24 19.183 -17.648 -9.282 328 H PHE 25 H PHE 25 20.025 -14.269 -15.554 329 HA PHE 25 HA PHE 25 21.642 -14.834 -18.003 330 HB2 PHE 25 2HB PHE 25 19.530 -16.164 -17.957 331 HB3 PHE 25 3HB PHE 25 18.608 -14.677 -17.786 332 HD1 PHE 25 HD1 PHE 25 21.062 -16.420 -20.041 333 HD2 PHE 25 HD2 PHE 25 17.904 -13.497 -19.739 334 HE1 PHE 25 HE1 PHE 25 21.037 -16.186 -22.514 335 HE2 PHE 25 HE2 PHE 25 17.884 -13.266 -22.208 336 HZ PHE 25 HZ PHE 25 19.450 -14.609 -23.601 337 H TYR 26 H TYR 26 21.669 -13.155 -19.573 338 HA TYR 26 HA TYR 26 21.954 -10.550 -18.416 339 HB2 TYR 26 2HB TYR 26 23.352 -11.503 -20.228 340 HB3 TYR 26 3HB TYR 26 21.978 -11.403 -21.329 341 HD1 TYR 26 HD2 TYR 26 23.926 -9.233 -18.941 342 HD2 TYR 26 HD1 TYR 26 21.859 -9.480 -22.725 343 HE1 TYR 26 HE2 TYR 26 24.561 -6.891 -19.440 344 HE2 TYR 26 HE1 TYR 26 22.552 -7.161 -23.253 345 HH TYR 26 HH TYR 26 23.685 -5.285 -22.539 346 H THR 27 H THR 27 20.959 -8.619 -18.842 347 HA THR 27 HA THR 27 18.401 -8.557 -20.370 348 HB THR 27 HB THR 27 17.646 -6.716 -18.806 349 HG1 THR 27 HG1 THR 27 19.813 -6.672 -17.786 350 HG21 THR 27 1HG2 THR 27 16.695 -8.287 -17.180 351 HG22 THR 27 2HG2 THR 27 16.627 -8.960 -18.816 352 HG23 THR 27 3HG2 THR 27 17.861 -9.539 -17.678 353 HA PRO 28 HA PRO 28 21.017 -5.395 -22.265 354 HB2 PRO 28 2HB PRO 28 19.641 -4.948 -24.548 355 HB3 PRO 28 3HB PRO 28 20.456 -6.508 -24.250 356 HG2 PRO 28 2HG PRO 28 17.531 -5.836 -23.775 357 HG3 PRO 28 3HG PRO 28 18.211 -7.226 -24.683 358 HD2 PRO 28 2HD PRO 28 17.469 -7.410 -22.056 359 HD3 PRO 28 3HD PRO 28 18.872 -8.316 -22.704 360 H LYS 29 H LYS 29 20.784 -3.131 -23.016 361 HA LYS 29 HA LYS 29 19.061 -1.616 -21.233 362 HB2 LYS 29 2HB LYS 29 20.386 0.294 -21.930 363 HB3 LYS 29 3HB LYS 29 21.444 -1.067 -21.569 364 HG2 LYS 29 2HG LYS 29 21.682 -1.537 -24.004 365 HG3 LYS 29 3HG LYS 29 20.605 -0.177 -24.373 366 HD2 LYS 29 2HD LYS 29 22.187 1.369 -23.227 367 HD3 LYS 29 3HD LYS 29 23.295 0.026 -22.937 368 HE2 LYS 29 2HE LYS 29 22.363 0.975 -25.691 369 HE3 LYS 29 3HE LYS 29 23.866 1.481 -24.917 370 HZ1 LYS 29 HZ1 LYS 29 24.271 -0.332 -26.441 371 HZ2 LYS 29 HZ2 LYS 29 24.585 -0.844 -24.923 372 HZ3 LYS 29 HZ3 LYS 29 23.209 -1.309 -25.680 373 H THR 30 H THR 30 18.017 -3.018 -23.727 374 HA THR 30 HA THR 30 16.923 -1.177 -25.602 375 HB THR 30 HB THR 30 15.775 -3.873 -24.791 376 HG1 THR 30 HG1 THR 30 17.151 -4.623 -26.459 377 HG21 THR 30 1HG2 THR 30 14.301 -2.615 -26.328 378 HG22 THR 30 2HG2 THR 30 15.673 -2.307 -27.415 379 HG23 THR 30 3HG2 THR 30 15.066 -3.963 -27.176 Start of MODEL 11 1 H1 GLY 1 1H GLY 1 3.354 -2.221 1.582 2 H2 GLY 1 2H GLY 1 4.202 -2.504 2.962 3 H3 GLY 1 3H GLY 1 3.128 -3.621 2.411 4 HA2 GLY 1 HA2 GLY 1 5.624 -2.848 1.054 5 HA3 GLY 1 HA3 GLY 1 5.352 -4.353 1.954 6 H ILE 2 H ILE 2 5.898 -5.491 0.011 7 HA ILE 2 HA ILE 2 4.639 -5.124 -2.495 8 HB ILE 2 HB ILE 2 6.791 -6.220 -2.162 9 HG12 ILE 2 2HG1 ILE 2 6.608 -8.141 -3.690 10 HG13 ILE 2 3HG1 ILE 2 4.851 -8.104 -3.534 11 HG21 ILE 2 1HG2 ILE 2 6.295 -7.555 -0.109 12 HG22 ILE 2 2HG2 ILE 2 5.336 -8.675 -1.104 13 HG23 ILE 2 3HG2 ILE 2 7.071 -8.493 -1.383 14 HD11 ILE 2 3HD1 ILE 2 6.636 -5.998 -4.799 15 HD12 ILE 2 1HD1 ILE 2 5.532 -7.097 -5.615 16 HD13 ILE 2 2HD1 ILE 2 4.880 -5.807 -4.585 17 H VAL 3 H VAL 3 3.651 -7.298 0.131 18 HA VAL 3 HA VAL 3 1.616 -8.673 -1.362 19 HB VAL 3 HB VAL 3 1.901 -8.225 1.634 20 HG11 VAL 3 1HG1 VAL 3 0.349 -10.129 1.943 21 HG12 VAL 3 2HG1 VAL 3 -0.471 -8.784 1.151 22 HG13 VAL 3 3HG1 VAL 3 0.060 -10.190 0.195 23 HG21 VAL 3 3HG2 VAL 3 3.734 -9.559 0.607 24 HG22 VAL 3 1HG2 VAL 3 2.718 -10.561 1.646 25 HG23 VAL 3 2HG2 VAL 3 2.529 -10.648 -0.116 26 H GLU 4 H GLU 4 1.502 -5.718 0.671 27 HA GLU 4 HA GLU 4 -1.324 -5.300 0.249 28 HB2 GLU 4 2HB GLU 4 0.802 -3.347 1.192 29 HB3 GLU 4 3HB GLU 4 -0.948 -3.173 1.327 30 HG2 GLU 4 2HG GLU 4 -0.260 -3.812 3.466 31 HG3 GLU 4 3HG GLU 4 -1.017 -5.238 2.761 32 H GLN 5 H GLN 5 1.211 -4.934 -1.972 33 HA GLN 5 HA GLN 5 -0.419 -3.017 -3.604 34 HB2 GLN 5 2HB GLN 5 2.369 -4.203 -4.027 35 HB3 GLN 5 3HB GLN 5 1.491 -3.277 -5.238 36 HG2 GLN 5 2HG GLN 5 2.396 -2.261 -2.514 37 HG3 GLN 5 3HG GLN 5 3.106 -1.904 -4.092 38 HE21 GLN 5 2HE2 GLN 5 1.374 -0.939 -5.768 39 HE22 GLN 5 1HE2 GLN 5 0.359 0.308 -5.064 40 H CYS 6 H CYS 6 1.133 -6.274 -3.890 41 HA CYS 6 HA CYS 6 -0.386 -6.685 -6.341 42 HB2 CYS 6 2HB CYS 6 1.589 -8.497 -4.963 43 HB3 CYS 6 3HB CYS 6 1.084 -8.535 -6.656 44 H CYS 7 H CYS 7 -0.569 -8.134 -3.108 45 HA CYS 7 HA CYS 7 -2.388 -10.238 -3.949 46 HB2 CYS 7 2HB CYS 7 -0.891 -10.210 -1.894 47 HB3 CYS 7 3HB CYS 7 -2.060 -9.115 -1.153 48 H THR 8 H THR 8 -2.859 -6.908 -3.100 49 HA THR 8 HA THR 8 -5.804 -7.192 -2.894 50 HB THR 8 HB THR 8 -4.447 -5.777 -1.286 51 HG1 THR 8 HG1 THR 8 -6.653 -5.454 -1.512 52 HG21 THR 8 1HG2 THR 8 -3.813 -3.539 -1.985 53 HG22 THR 8 2HG2 THR 8 -2.914 -4.761 -2.908 54 HG23 THR 8 3HG2 THR 8 -4.265 -3.880 -3.664 55 H SER 9 H SER 9 -3.392 -5.949 -5.236 56 HA SER 9 HA SER 9 -5.537 -5.664 -7.223 57 HB2 SER 9 2HB SER 9 -5.331 -3.506 -5.894 58 HB3 SER 9 3HB SER 9 -3.768 -3.300 -6.725 59 HG SER 9 HG SER 9 -5.619 -2.301 -7.797 60 H ILE 10 H ILE 10 -4.361 -4.423 -9.221 61 HA ILE 10 HA ILE 10 -2.600 -6.411 -10.386 62 HB ILE 10 HB ILE 10 -3.407 -3.620 -11.305 63 HG12 ILE 10 2HG1 ILE 10 -5.340 -5.152 -11.138 64 HG13 ILE 10 3HG1 ILE 10 -5.004 -4.633 -12.781 65 HG21 ILE 10 1HG2 ILE 10 -1.944 -5.840 -12.790 66 HG22 ILE 10 2HG2 ILE 10 -2.704 -4.464 -13.611 67 HG23 ILE 10 3HG2 ILE 10 -1.370 -4.188 -12.491 68 HD11 ILE 10 3HD1 ILE 10 -3.957 -6.791 -13.311 69 HD12 ILE 10 1HD1 ILE 10 -4.174 -7.314 -11.621 70 HD13 ILE 10 2HD1 ILE 10 -5.588 -7.028 -12.658 71 H CYS 11 H CYS 11 -0.486 -6.612 -10.274 72 HA CYS 11 HA CYS 11 1.234 -4.181 -9.855 73 HB2 CYS 11 2HB CYS 11 1.569 -7.078 -9.073 74 HB3 CYS 11 3HB CYS 11 2.983 -6.067 -9.379 75 H SER 12 H SER 12 2.384 -3.522 -11.504 76 HA SER 12 HA SER 12 2.966 -5.283 -13.848 77 HB2 SER 12 2HB SER 12 3.598 -2.347 -13.366 78 HB3 SER 12 3HB SER 12 3.892 -3.264 -14.851 79 HG SER 12 HG SER 12 1.390 -2.563 -13.686 80 H LEU 13 H LEU 13 5.144 -5.494 -14.640 81 HA LEU 13 HA LEU 13 6.876 -6.564 -12.677 82 HB2 LEU 13 2HB LEU 13 8.474 -6.742 -14.488 83 HB3 LEU 13 3HB LEU 13 6.915 -7.411 -14.908 84 HG LEU 13 HG LEU 13 7.883 -4.683 -15.877 85 HD11 LEU 13 1HD1 LEU 13 8.137 -7.400 -17.235 86 HD12 LEU 13 2HD1 LEU 13 8.565 -5.830 -17.953 87 HD13 LEU 13 3HD1 LEU 13 9.475 -6.439 -16.564 88 HD21 LEU 13 3HD2 LEU 13 5.691 -6.524 -16.918 89 HD22 LEU 13 1HD2 LEU 13 5.483 -4.889 -16.240 90 HD23 LEU 13 2HD2 LEU 13 6.306 -5.100 -17.775 91 H TYR 14 H TYR 14 6.923 -3.449 -14.299 92 HA TYR 14 HA TYR 14 9.526 -2.680 -13.491 93 HB2 TYR 14 2HB TYR 14 8.940 -0.527 -14.427 94 HB3 TYR 14 3HB TYR 14 8.359 -1.842 -15.460 95 HD1 TYR 14 HD1 TYR 14 7.262 0.721 -12.942 96 HD2 TYR 14 HD2 TYR 14 6.078 -1.952 -16.116 97 HE1 TYR 14 HE1 TYR 14 4.999 1.733 -12.942 98 HE2 TYR 14 HE2 TYR 14 3.819 -0.912 -16.141 99 HH TYR 14 HH TYR 14 2.905 1.740 -13.901 100 H GLN 15 H GLN 15 6.764 -2.807 -11.600 101 HA GLN 15 HA GLN 15 7.755 -0.693 -9.712 102 HB2 GLN 15 2HB GLN 15 5.447 -0.441 -8.916 103 HB3 GLN 15 3HB GLN 15 5.626 0.021 -10.613 104 HG2 GLN 15 2HG GLN 15 4.663 -2.099 -11.336 105 HG3 GLN 15 3HG GLN 15 4.506 -2.649 -9.656 106 HE21 GLN 15 2HE2 GLN 15 3.550 0.453 -9.192 107 HE22 GLN 15 1HE2 GLN 15 1.867 0.272 -9.655 108 H LEU 16 H LEU 16 6.669 -4.060 -10.106 109 HA LEU 16 HA LEU 16 6.767 -4.612 -7.277 110 HB2 LEU 16 2HB LEU 16 5.686 -6.473 -7.858 111 HB3 LEU 16 3HB LEU 16 5.478 -5.664 -9.386 112 HG LEU 16 HG LEU 16 7.719 -6.828 -10.058 113 HD11 LEU 16 1HD1 LEU 16 6.836 -8.403 -7.612 114 HD12 LEU 16 2HD1 LEU 16 7.711 -9.203 -8.919 115 HD13 LEU 16 3HD1 LEU 16 8.470 -7.866 -8.067 116 HD21 LEU 16 3HD2 LEU 16 5.460 -7.316 -11.040 117 HD22 LEU 16 1HD2 LEU 16 6.468 -8.764 -10.908 118 HD23 LEU 16 2HD2 LEU 16 5.163 -8.479 -9.731 119 H GLU 17 H GLU 17 9.107 -4.789 -9.916 120 HA GLU 17 HA GLU 17 11.292 -6.187 -8.806 121 HB2 GLU 17 2HB GLU 17 11.140 -3.646 -10.489 122 HB3 GLU 17 3HB GLU 17 12.689 -4.254 -9.913 123 HG2 GLU 17 2HG GLU 17 12.273 -6.425 -11.033 124 HG3 GLU 17 3HG GLU 17 10.793 -5.736 -11.709 125 H ASN 18 H ASN 18 10.074 -2.996 -8.069 126 HA ASN 18 HA ASN 18 12.265 -1.807 -6.750 127 HB2 ASN 18 2HB ASN 18 9.280 -1.476 -6.231 128 HB3 ASN 18 3HB ASN 18 10.513 -0.379 -5.723 129 HD21 ASN 18 2HD2 ASN 18 11.658 -1.179 -8.751 130 HD22 ASN 18 1HD2 ASN 18 10.783 0.022 -9.683 131 H TYR 19 H TYR 19 10.038 -4.227 -5.575 132 HA TYR 19 HA TYR 19 10.641 -3.834 -2.727 133 HB2 TYR 19 2HB TYR 19 8.889 -5.783 -4.268 134 HB3 TYR 19 3HB TYR 19 8.980 -5.669 -2.519 135 HD1 TYR 19 HD2 TYR 19 7.854 -3.830 -5.615 136 HD2 TYR 19 HD1 TYR 19 7.948 -3.910 -1.284 137 HE1 TYR 19 HE2 TYR 19 6.178 -1.994 -5.517 138 HE2 TYR 19 HE1 TYR 19 6.273 -2.076 -1.213 139 HH TYR 19 HH TYR 19 5.090 -0.535 -2.426 140 H CYS 20 H CYS 20 12.197 -5.507 -5.244 141 HA CYS 20 HA CYS 20 13.132 -7.812 -3.681 142 HB2 CYS 20 2HB CYS 20 12.910 -7.644 -6.220 143 HB3 CYS 20 3HB CYS 20 14.335 -6.604 -6.191 144 H ASN 21 H ASN 21 14.122 -4.486 -4.081 145 HA ASN 21 HA ASN 21 16.864 -4.699 -3.205 146 HB2 ASN 21 2HB ASN 21 15.986 -2.829 -4.592 147 HB3 ASN 21 3HB ASN 21 14.928 -2.334 -3.268 148 HD21 ASN 21 2HD2 ASN 21 18.416 -2.905 -3.987 149 HD22 ASN 21 1HD2 ASN 21 18.967 -1.580 -2.972 150 H1 PHE 1 1H PHE 1 5.872 -11.088 -20.026 151 H2 PHE 1 2H PHE 1 5.178 -12.566 -19.938 152 H3 PHE 1 3H PHE 1 6.629 -12.302 -19.224 153 HA PHE 1 HA PHE 1 4.899 -12.384 -17.572 154 HB2 PHE 1 2HB PHE 1 6.936 -10.830 -17.373 155 HB3 PHE 1 3HB PHE 1 5.876 -9.515 -17.857 156 HD1 PHE 1 HD2 PHE 1 6.386 -12.188 -15.267 157 HD2 PHE 1 HD1 PHE 1 4.508 -8.414 -16.207 158 HE1 PHE 1 HE2 PHE 1 5.717 -11.922 -12.893 159 HE2 PHE 1 HE1 PHE 1 3.850 -8.156 -13.825 160 HZ PHE 1 HZ PHE 1 4.452 -9.906 -12.171 161 H VAL 2 H VAL 2 3.108 -10.983 -16.538 162 HA VAL 2 HA VAL 2 1.665 -9.177 -18.311 163 HB VAL 2 HB VAL 2 0.612 -11.314 -18.910 164 HG11 VAL 2 1HG1 VAL 2 -0.366 -11.572 -16.045 165 HG12 VAL 2 2HG1 VAL 2 -0.757 -12.621 -17.414 166 HG13 VAL 2 3HG1 VAL 2 0.897 -12.580 -16.790 167 HG21 VAL 2 3HG2 VAL 2 -1.296 -9.570 -17.316 168 HG22 VAL 2 1HG2 VAL 2 -0.686 -9.205 -18.945 169 HG23 VAL 2 2HG2 VAL 2 -1.694 -10.638 -18.673 170 H ASN 3 H ASN 3 0.799 -7.514 -17.151 171 HA ASN 3 HA ASN 3 1.291 -7.386 -14.334 172 HB2 ASN 3 2HB ASN 3 -0.008 -5.303 -14.297 173 HB3 ASN 3 3HB ASN 3 1.353 -5.338 -15.438 174 HD21 ASN 3 2HD2 ASN 3 1.061 -5.329 -17.611 175 HD22 ASN 3 1HD2 ASN 3 -0.526 -5.048 -18.290 176 H GLN 4 H GLN 4 0.079 -8.114 -12.645 177 HA GLN 4 HA GLN 4 -2.760 -8.811 -12.980 178 HB2 GLN 4 2HB GLN 4 -2.452 -11.193 -12.888 179 HB3 GLN 4 3HB GLN 4 -1.521 -10.562 -14.239 180 HG2 GLN 4 2HG GLN 4 0.527 -10.592 -12.671 181 HG3 GLN 4 3HG GLN 4 -0.482 -11.479 -11.532 182 HE21 GLN 4 2HE2 GLN 4 1.904 -12.000 -13.705 183 HE22 GLN 4 1HE2 GLN 4 1.456 -13.624 -14.209 184 H HIS 5 H HIS 5 -3.467 -10.200 -11.149 185 HA HIS 5 HA HIS 5 -2.615 -9.085 -8.540 186 HB2 HIS 5 2HB HIS 5 -4.743 -11.142 -9.274 187 HB3 HIS 5 3HB HIS 5 -4.463 -10.482 -7.666 188 HD2 HIS 5 HD2 HIS 5 -5.739 -9.370 -11.164 189 HE1 HIS 5 HE1 HIS 5 -7.069 -6.465 -8.353 190 HE2 HIS 5 HE2 HIS 5 -7.251 -7.257 -10.771 191 H LEU 6 H LEU 6 -1.321 -10.139 -7.089 192 HA LEU 6 HA LEU 6 -0.449 -12.962 -7.580 193 HB2 LEU 6 2HB LEU 6 1.360 -10.543 -7.253 194 HB3 LEU 6 3HB LEU 6 1.908 -12.210 -7.228 195 HG LEU 6 HG LEU 6 0.630 -10.847 -9.635 196 HD11 LEU 6 1HD1 LEU 6 2.998 -10.853 -10.490 197 HD12 LEU 6 2HD1 LEU 6 2.726 -9.766 -9.115 198 HD13 LEU 6 3HD1 LEU 6 3.521 -11.330 -8.857 199 HD21 LEU 6 3HD2 LEU 6 0.388 -13.319 -9.682 200 HD22 LEU 6 1HD2 LEU 6 1.590 -12.787 -10.868 201 HD23 LEU 6 2HD2 LEU 6 2.117 -13.501 -9.333 202 H CYS 7 H CYS 7 -0.286 -14.113 -5.729 203 HA CYS 7 HA CYS 7 0.490 -12.813 -3.218 204 HB2 CYS 7 2HB CYS 7 -2.071 -12.574 -3.630 205 HB3 CYS 7 3HB CYS 7 -2.156 -14.278 -3.208 206 H GLY 8 H GLY 8 1.256 -14.250 -1.647 207 HA2 GLY 8 HA2 GLY 8 2.319 -16.160 -0.868 208 HA3 GLY 8 HA3 GLY 8 1.017 -17.067 -1.648 209 H SER 9 H SER 9 1.881 -18.651 -2.818 210 HA SER 9 HA SER 9 4.461 -18.875 -3.873 211 HB2 SER 9 2HB SER 9 1.911 -20.092 -4.998 212 HB3 SER 9 3HB SER 9 3.564 -20.693 -5.216 213 HG SER 9 HG SER 9 2.443 -21.825 -3.541 214 H HIS 10 H HIS 10 1.557 -17.467 -5.501 215 HA HIS 10 HA HIS 10 2.782 -17.187 -8.073 216 HB2 HIS 10 2HB HIS 10 0.263 -16.546 -6.843 217 HB3 HIS 10 3HB HIS 10 0.866 -15.065 -7.546 218 HD2 HIS 10 HD2 HIS 10 -1.294 -17.749 -8.496 219 HE1 HIS 10 HE1 HIS 10 0.609 -16.782 -12.180 220 HE2 HIS 10 HE2 HIS 10 -1.354 -18.010 -11.114 221 H LEU 11 H LEU 11 2.784 -15.098 -5.228 222 HA LEU 11 HA LEU 11 4.075 -12.835 -6.517 223 HB2 LEU 11 2HB LEU 11 2.536 -12.895 -4.425 224 HB3 LEU 11 3HB LEU 11 3.941 -13.475 -3.541 225 HG LEU 11 HG LEU 11 5.146 -11.350 -4.139 226 HD11 LEU 11 1HD1 LEU 11 3.894 -10.723 -6.213 227 HD12 LEU 11 2HD1 LEU 11 2.416 -10.534 -5.232 228 HD13 LEU 11 3HD1 LEU 11 3.787 -9.444 -5.004 229 HD21 LEU 11 3HD2 LEU 11 3.806 -9.923 -2.605 230 HD22 LEU 11 1HD2 LEU 11 2.416 -10.999 -2.802 231 HD23 LEU 11 2HD2 LEU 11 3.895 -11.588 -2.003 232 H VAL 12 H VAL 12 5.220 -15.494 -4.408 233 HA VAL 12 HA VAL 12 8.001 -14.841 -4.463 234 HB VAL 12 HB VAL 12 6.624 -17.548 -4.244 235 HG11 VAL 12 1HG1 VAL 12 8.938 -17.972 -4.926 236 HG12 VAL 12 2HG1 VAL 12 9.539 -16.831 -3.699 237 HG13 VAL 12 3HG1 VAL 12 8.754 -18.350 -3.213 238 HG21 VAL 12 3HG2 VAL 12 6.096 -15.948 -2.422 239 HG22 VAL 12 1HG2 VAL 12 7.068 -17.301 -1.837 240 HG23 VAL 12 2HG2 VAL 12 7.827 -15.718 -2.123 241 H GLU 13 H GLU 13 6.078 -16.895 -6.691 242 HA GLU 13 HA GLU 13 8.137 -17.538 -8.540 243 HB2 GLU 13 2HB GLU 13 5.122 -17.314 -8.717 244 HB3 GLU 13 3HB GLU 13 6.066 -17.509 -10.184 245 HG2 GLU 13 2HG GLU 13 7.125 -19.546 -9.274 246 HG3 GLU 13 3HG GLU 13 6.214 -19.369 -7.772 247 H ALA 14 H ALA 14 5.906 -14.643 -8.567 248 HA ALA 14 HA ALA 14 6.989 -13.567 -10.956 249 HB1 ALA 14 3HB ALA 14 5.911 -11.495 -10.197 250 HB2 ALA 14 1HB ALA 14 4.868 -12.911 -9.919 251 HB3 ALA 14 2HB ALA 14 5.746 -12.161 -8.557 252 H LEU 15 H LEU 15 7.949 -12.881 -7.524 253 HA LEU 15 HA LEU 15 10.054 -11.082 -8.141 254 HB2 LEU 15 2HB LEU 15 9.405 -12.889 -5.807 255 HB3 LEU 15 3HB LEU 15 11.030 -12.250 -5.911 256 HG LEU 15 HG LEU 15 9.752 -10.876 -4.455 257 HD11 LEU 15 1HD1 LEU 15 10.205 -8.688 -5.334 258 HD12 LEU 15 2HD1 LEU 15 11.477 -9.788 -5.889 259 HD13 LEU 15 3HD1 LEU 15 10.190 -9.271 -7.003 260 HD21 LEU 15 3HD2 LEU 15 7.497 -11.185 -5.135 261 HD22 LEU 15 1HD2 LEU 15 7.848 -9.461 -5.283 262 HD23 LEU 15 2HD2 LEU 15 7.787 -10.477 -6.736 263 H TYR 16 H TYR 16 10.160 -14.666 -8.158 264 HA TYR 16 HA TYR 16 12.972 -14.828 -8.740 265 HB2 TYR 16 2HB TYR 16 11.566 -16.757 -8.031 266 HB3 TYR 16 3HB TYR 16 10.709 -16.685 -9.570 267 HD1 TYR 16 HD2 TYR 16 11.781 -17.329 -11.684 268 HD2 TYR 16 HD1 TYR 16 13.863 -17.655 -7.922 269 HE1 TYR 16 HE2 TYR 16 13.535 -18.689 -12.784 270 HE2 TYR 16 HE1 TYR 16 15.592 -19.080 -8.999 271 HH TYR 16 HH TYR 16 16.305 -20.080 -10.953 272 H LEU 17 H LEU 17 10.125 -14.515 -10.920 273 HA LEU 17 HA LEU 17 11.704 -14.661 -13.334 274 HB2 LEU 17 2HB LEU 17 8.924 -13.494 -12.821 275 HB3 LEU 17 3HB LEU 17 9.625 -13.755 -14.410 276 HG LEU 17 HG LEU 17 9.065 -15.970 -12.417 277 HD11 LEU 17 1HD1 LEU 17 7.148 -16.524 -13.864 278 HD12 LEU 17 2HD1 LEU 17 6.988 -14.894 -13.189 279 HD13 LEU 17 3HD1 LEU 17 7.496 -15.106 -14.880 280 HD21 LEU 17 3HD2 LEU 17 10.853 -16.607 -13.977 281 HD22 LEU 17 1HD2 LEU 17 9.368 -17.474 -14.373 282 HD23 LEU 17 2HD2 LEU 17 9.863 -16.081 -15.357 283 H VAL 18 H VAL 18 10.408 -11.819 -11.544 284 HA VAL 18 HA VAL 18 11.628 -10.006 -13.482 285 HB VAL 18 HB VAL 18 11.131 -8.529 -11.050 286 HG11 VAL 18 1HG1 VAL 18 9.549 -7.333 -12.443 287 HG12 VAL 18 2HG1 VAL 18 11.072 -7.598 -13.308 288 HG13 VAL 18 3HG1 VAL 18 9.650 -8.604 -13.691 289 HG21 VAL 18 3HG2 VAL 18 8.825 -10.312 -11.802 290 HG22 VAL 18 1HG2 VAL 18 9.676 -10.115 -10.220 291 HG23 VAL 18 2HG2 VAL 18 8.728 -8.794 -10.892 292 H CYS 19 H CYS 19 12.615 -11.107 -10.212 293 HA CYS 19 HA CYS 19 15.016 -9.345 -10.406 294 HB2 CYS 19 2HB CYS 19 13.336 -9.035 -8.553 295 HB3 CYS 19 3HB CYS 19 13.812 -10.622 -7.940 296 H GLY 20 H GLY 20 14.059 -12.725 -9.632 297 HA2 GLY 20 HA2 GLY 20 16.707 -13.606 -8.884 298 HA3 GLY 20 HA3 GLY 20 15.330 -14.649 -9.316 299 H GLU 21 H GLU 21 14.964 -13.666 -11.976 300 HA GLU 21 HA GLU 21 16.789 -15.119 -13.543 301 HB2 GLU 21 2HB GLU 21 14.459 -14.377 -14.113 302 HB3 GLU 21 3HB GLU 21 15.090 -12.750 -14.392 303 HG2 GLU 21 2HG GLU 21 16.531 -13.659 -16.226 304 HG3 GLU 21 3HG GLU 21 15.891 -15.274 -15.908 305 H ARG 22 H ARG 22 17.196 -11.880 -12.250 306 HA ARG 22 HA ARG 22 19.287 -11.032 -14.090 307 HB2 ARG 22 2HB ARG 22 18.778 -9.926 -11.312 308 HB3 ARG 22 3HB ARG 22 19.526 -9.115 -12.681 309 HG2 ARG 22 2HG ARG 22 16.593 -9.869 -12.399 310 HG3 ARG 22 3HG ARG 22 17.264 -8.258 -12.245 311 HD2 ARG 22 2HD ARG 22 17.419 -7.931 -14.505 312 HD3 ARG 22 3HD ARG 22 17.839 -9.608 -14.842 313 HE ARG 22 HE ARG 22 15.065 -8.836 -14.029 314 HH11 ARG 22 1HH1 ARG 22 17.114 -10.505 -16.442 315 HH12 ARG 22 2HH1 ARG 22 15.718 -11.421 -17.004 316 HH21 ARG 22 1HH2 ARG 22 13.411 -10.092 -14.924 317 HH22 ARG 22 2HH2 ARG 22 13.807 -11.191 -16.230 318 H GLY 23 H GLY 23 19.293 -13.371 -11.699 319 HA2 GLY 23 HA2 GLY 23 21.314 -14.709 -11.432 320 HA3 GLY 23 HA3 GLY 23 22.261 -13.225 -11.216 321 H HIS 24 H HIS 24 21.764 -15.655 -9.535 322 HA HIS 24 HA HIS 24 20.128 -14.783 -7.279 323 HB2 HIS 24 2HB HIS 24 21.820 -17.283 -7.631 324 HB3 HIS 24 3HB HIS 24 20.510 -17.046 -6.475 325 HD2 HIS 24 HD2 HIS 24 18.200 -15.938 -8.303 326 HE1 HIS 24 HE1 HIS 24 18.847 -19.292 -10.840 327 HE2 HIS 24 HE2 HIS 24 17.213 -17.436 -10.222 328 H PHE 25 H PHE 25 23.370 -14.212 -7.998 329 HA PHE 25 HA PHE 25 24.641 -14.599 -5.457 330 HB2 PHE 25 2HB PHE 25 25.846 -14.489 -7.594 331 HB3 PHE 25 3HB PHE 25 25.353 -12.813 -7.812 332 HD1 PHE 25 HD1 PHE 25 27.180 -15.042 -5.381 333 HD2 PHE 25 HD2 PHE 25 26.792 -11.087 -7.062 334 HE1 PHE 25 HE1 PHE 25 29.170 -14.298 -4.100 335 HE2 PHE 25 HE2 PHE 25 28.796 -10.356 -5.796 336 HZ PHE 25 HZ PHE 25 29.983 -11.954 -4.304 337 H TYR 26 H TYR 26 25.250 -13.153 -3.856 338 HA TYR 26 HA TYR 26 24.137 -10.414 -3.746 339 HB2 TYR 26 2HB TYR 26 22.386 -11.845 -2.835 340 HB3 TYR 26 3HB TYR 26 23.550 -12.660 -1.789 341 HD1 TYR 26 HD1 TYR 26 22.340 -9.197 -2.597 342 HD2 TYR 26 HD2 TYR 26 23.751 -11.922 0.420 343 HE1 TYR 26 HE1 TYR 26 22.048 -7.428 -0.879 344 HE2 TYR 26 HE2 TYR 26 23.396 -10.178 2.170 345 HH TYR 26 HH TYR 26 22.735 -8.012 2.608 346 H THR 27 H THR 27 25.157 -9.089 -2.271 347 HA THR 27 HA THR 27 27.813 -9.974 -1.204 348 HB THR 27 HB THR 27 28.413 -7.540 -1.382 349 HG1 THR 27 HG1 THR 27 26.282 -6.756 -1.633 350 HG21 THR 27 1HG2 THR 27 29.179 -9.244 -3.021 351 HG22 THR 27 2HG2 THR 27 27.714 -8.963 -3.990 352 HG23 THR 27 3HG2 THR 27 28.906 -7.664 -3.775 353 HA PRO 28 HA PRO 28 25.480 -8.909 2.598 354 HB2 PRO 28 2HB PRO 28 26.723 -10.600 4.335 355 HB3 PRO 28 3HB PRO 28 25.486 -11.163 3.169 356 HG2 PRO 28 2HG PRO 28 28.504 -11.255 2.868 357 HG3 PRO 28 3HG PRO 28 27.326 -12.581 2.601 358 HD2 PRO 28 2HD PRO 28 28.293 -11.057 0.560 359 HD3 PRO 28 3HD PRO 28 26.604 -11.651 0.560 360 H LYS 29 H LYS 29 26.117 -7.873 4.581 361 HA LYS 29 HA LYS 29 28.892 -6.780 4.716 362 HB2 LYS 29 2HB LYS 29 26.297 -5.174 4.784 363 HB3 LYS 29 3HB LYS 29 27.892 -4.541 5.203 364 HG2 LYS 29 2HG LYS 29 28.696 -5.018 2.891 365 HG3 LYS 29 3HG LYS 29 27.100 -5.642 2.469 366 HD2 LYS 29 2HD LYS 29 27.275 -3.391 1.635 367 HD3 LYS 29 3HD LYS 29 26.071 -3.461 2.914 368 HE2 LYS 29 2HE LYS 29 27.324 -1.436 3.193 369 HE3 LYS 29 3HE LYS 29 27.736 -2.511 4.526 370 HZ1 LYS 29 HZ1 LYS 29 29.388 -2.086 2.091 371 HZ2 LYS 29 HZ2 LYS 29 29.701 -1.456 3.563 372 HZ3 LYS 29 HZ3 LYS 29 29.796 -3.068 3.334 373 H THR 30 H THR 30 29.502 -5.929 6.746 374 HA THR 30 HA THR 30 28.768 -7.452 9.043 375 HB THR 30 HB THR 30 30.247 -4.797 8.989 376 HG1 THR 30 HG1 THR 30 31.206 -7.446 8.612 377 HG21 THR 30 1HG2 THR 30 30.402 -7.189 10.883 378 HG22 THR 30 2HG2 THR 30 31.490 -5.781 10.908 379 HG23 THR 30 3HG2 THR 30 29.773 -5.574 11.270 Start of MODEL 12 1 H1 GLY 1 1H GLY 1 4.927 -2.098 2.739 2 H2 GLY 1 2H GLY 1 3.464 -2.586 2.203 3 H3 GLY 1 3H GLY 1 4.502 -1.831 1.178 4 HA2 GLY 1 HA2 GLY 1 6.095 -3.670 1.426 5 HA3 GLY 1 HA3 GLY 1 4.857 -4.504 2.380 6 H ILE 2 H ILE 2 5.881 -5.748 0.211 7 HA ILE 2 HA ILE 2 4.654 -5.206 -2.291 8 HB ILE 2 HB ILE 2 6.767 -6.373 -2.020 9 HG12 ILE 2 2HG1 ILE 2 6.583 -8.180 -3.619 10 HG13 ILE 2 3HG1 ILE 2 4.827 -8.232 -3.415 11 HG21 ILE 2 1HG2 ILE 2 6.288 -7.741 -0.008 12 HG22 ILE 2 2HG2 ILE 2 5.247 -8.799 -0.989 13 HG23 ILE 2 3HG2 ILE 2 6.981 -8.687 -1.321 14 HD11 ILE 2 3HD1 ILE 2 5.448 -7.140 -5.484 15 HD12 ILE 2 1HD1 ILE 2 4.694 -5.939 -4.416 16 HD13 ILE 2 2HD1 ILE 2 6.464 -5.987 -4.628 17 H VAL 3 H VAL 3 3.534 -7.456 0.230 18 HA VAL 3 HA VAL 3 1.569 -8.762 -1.383 19 HB VAL 3 HB VAL 3 1.608 -8.372 1.633 20 HG11 VAL 3 1HG1 VAL 3 -0.689 -8.972 0.962 21 HG12 VAL 3 2HG1 VAL 3 -0.068 -10.301 -0.043 22 HG13 VAL 3 3HG1 VAL 3 0.093 -10.356 1.724 23 HG21 VAL 3 3HG2 VAL 3 2.486 -10.678 1.683 24 HG22 VAL 3 1HG2 VAL 3 2.445 -10.750 -0.088 25 HG23 VAL 3 2HG2 VAL 3 3.561 -9.642 0.740 26 H GLU 4 H GLU 4 1.250 -5.871 0.736 27 HA GLU 4 HA GLU 4 -1.550 -5.488 0.083 28 HB2 GLU 4 2HB GLU 4 -1.416 -3.470 1.386 29 HB3 GLU 4 3HB GLU 4 -0.635 -4.803 2.239 30 HG2 GLU 4 2HG GLU 4 1.576 -3.987 1.493 31 HG3 GLU 4 3HG GLU 4 0.813 -2.612 0.681 32 H GLN 5 H GLN 5 1.068 -5.082 -1.912 33 HA GLN 5 HA GLN 5 -0.334 -2.990 -3.537 34 HB2 GLN 5 2HB GLN 5 2.021 -2.526 -3.234 35 HB3 GLN 5 3HB GLN 5 2.465 -4.155 -3.734 36 HG2 GLN 5 2HG GLN 5 2.873 -2.567 -5.518 37 HG3 GLN 5 3HG GLN 5 1.659 -3.729 -6.017 38 HE21 GLN 5 2HE2 GLN 5 -0.681 -2.942 -6.069 39 HE22 GLN 5 1HE2 GLN 5 -0.933 -1.226 -6.313 40 H CYS 6 H CYS 6 1.230 -6.237 -3.882 41 HA CYS 6 HA CYS 6 -0.052 -6.588 -6.482 42 HB2 CYS 6 2HB CYS 6 1.878 -8.170 -4.784 43 HB3 CYS 6 3HB CYS 6 1.255 -8.761 -6.318 44 H CYS 7 H CYS 7 -0.639 -8.076 -3.284 45 HA CYS 7 HA CYS 7 -2.354 -10.121 -4.471 46 HB2 CYS 7 2HB CYS 7 -0.981 -10.436 -2.419 47 HB3 CYS 7 3HB CYS 7 -2.051 -9.318 -1.568 48 H THR 8 H THR 8 -2.946 -6.922 -3.281 49 HA THR 8 HA THR 8 -5.872 -7.312 -3.152 50 HB THR 8 HB THR 8 -4.536 -6.002 -1.461 51 HG1 THR 8 HG1 THR 8 -6.679 -4.812 -2.885 52 HG21 THR 8 1HG2 THR 8 -3.948 -3.698 -1.968 53 HG22 THR 8 2HG2 THR 8 -3.077 -4.780 -3.077 54 HG23 THR 8 3HG2 THR 8 -4.494 -3.870 -3.648 55 H SER 9 H SER 9 -3.599 -6.277 -5.576 56 HA SER 9 HA SER 9 -5.712 -5.400 -7.379 57 HB2 SER 9 2HB SER 9 -4.966 -3.147 -7.688 58 HB3 SER 9 3HB SER 9 -5.392 -3.388 -5.994 59 HG SER 9 HG SER 9 -2.977 -3.818 -5.763 60 H ILE 10 H ILE 10 -4.742 -4.605 -9.528 61 HA ILE 10 HA ILE 10 -2.746 -6.434 -10.538 62 HB ILE 10 HB ILE 10 -3.752 -3.765 -11.619 63 HG12 ILE 10 2HG1 ILE 10 -5.542 -5.490 -11.474 64 HG13 ILE 10 3HG1 ILE 10 -5.199 -4.926 -13.099 65 HG21 ILE 10 1HG2 ILE 10 -2.854 -4.626 -13.840 66 HG22 ILE 10 2HG2 ILE 10 -1.615 -4.185 -12.665 67 HG23 ILE 10 3HG2 ILE 10 -2.009 -5.895 -12.923 68 HD11 ILE 10 3HD1 ILE 10 -3.956 -6.975 -13.622 69 HD12 ILE 10 1HD1 ILE 10 -4.170 -7.539 -11.944 70 HD13 ILE 10 2HD1 ILE 10 -5.574 -7.367 -13.015 71 H CYS 11 H CYS 11 -0.593 -6.394 -10.267 72 HA CYS 11 HA CYS 11 0.729 -3.725 -10.020 73 HB2 CYS 11 2HB CYS 11 2.330 -4.525 -8.527 74 HB3 CYS 11 3HB CYS 11 0.770 -5.021 -7.884 75 H SER 12 H SER 12 2.723 -3.468 -10.972 76 HA SER 12 HA SER 12 3.153 -5.213 -13.371 77 HB2 SER 12 2HB SER 12 3.685 -2.252 -13.001 78 HB3 SER 12 3HB SER 12 3.879 -3.193 -14.490 79 HG SER 12 HG SER 12 1.853 -2.007 -14.336 80 H LEU 13 H LEU 13 5.261 -5.362 -14.326 81 HA LEU 13 HA LEU 13 7.074 -6.420 -12.433 82 HB2 LEU 13 2HB LEU 13 8.564 -6.689 -14.310 83 HB3 LEU 13 3HB LEU 13 6.963 -7.290 -14.672 84 HG LEU 13 HG LEU 13 7.980 -4.592 -15.660 85 HD11 LEU 13 1HD1 LEU 13 8.626 -5.747 -17.747 86 HD12 LEU 13 2HD1 LEU 13 9.541 -6.357 -16.360 87 HD13 LEU 13 3HD1 LEU 13 8.190 -7.311 -17.018 88 HD21 LEU 13 3HD2 LEU 13 5.748 -6.392 -16.672 89 HD22 LEU 13 1HD2 LEU 13 5.585 -4.759 -15.976 90 HD23 LEU 13 2HD2 LEU 13 6.371 -4.973 -17.531 91 H TYR 14 H TYR 14 7.022 -3.320 -14.044 92 HA TYR 14 HA TYR 14 9.662 -2.496 -13.369 93 HB2 TYR 14 2HB TYR 14 8.920 -0.331 -14.231 94 HB3 TYR 14 3HB TYR 14 8.448 -1.682 -15.281 95 HD1 TYR 14 HD2 TYR 14 7.088 0.665 -12.661 96 HD2 TYR 14 HD1 TYR 14 6.240 -1.882 -16.040 97 HE1 TYR 14 HE2 TYR 14 4.744 1.474 -12.677 98 HE2 TYR 14 HE1 TYR 14 3.906 -1.031 -16.091 99 HH TYR 14 HH TYR 14 2.686 1.363 -13.711 100 H GLN 15 H GLN 15 6.981 -2.736 -11.361 101 HA GLN 15 HA GLN 15 8.068 -0.695 -9.445 102 HB2 GLN 15 2HB GLN 15 5.747 -0.443 -8.571 103 HB3 GLN 15 3HB GLN 15 5.971 0.170 -10.214 104 HG2 GLN 15 2HG GLN 15 4.886 -1.767 -11.169 105 HG3 GLN 15 3HG GLN 15 4.812 -2.575 -9.590 106 HE21 GLN 15 2HE2 GLN 15 3.914 0.882 -9.728 107 HE22 GLN 15 1HE2 GLN 15 2.199 0.537 -9.577 108 H LEU 16 H LEU 16 6.826 -4.012 -9.928 109 HA LEU 16 HA LEU 16 6.923 -4.624 -7.124 110 HB2 LEU 16 2HB LEU 16 5.825 -6.460 -7.686 111 HB3 LEU 16 3HB LEU 16 5.584 -5.616 -9.187 112 HG LEU 16 HG LEU 16 7.765 -6.829 -9.960 113 HD11 LEU 16 1HD1 LEU 16 7.748 -9.219 -8.849 114 HD12 LEU 16 2HD1 LEU 16 8.569 -7.915 -8.007 115 HD13 LEU 16 3HD1 LEU 16 6.939 -8.419 -7.501 116 HD21 LEU 16 3HD2 LEU 16 5.469 -7.269 -10.866 117 HD22 LEU 16 1HD2 LEU 16 6.386 -8.776 -10.723 118 HD23 LEU 16 2HD2 LEU 16 5.153 -8.381 -9.514 119 H GLU 17 H GLU 17 9.332 -4.819 -9.716 120 HA GLU 17 HA GLU 17 11.415 -6.271 -8.416 121 HB2 GLU 17 2HB GLU 17 11.490 -3.850 -10.280 122 HB3 GLU 17 3HB GLU 17 12.951 -4.534 -9.578 123 HG2 GLU 17 2HG GLU 17 12.230 -6.781 -10.586 124 HG3 GLU 17 3HG GLU 17 11.122 -5.811 -11.576 125 H ASN 18 H ASN 18 10.196 -3.028 -7.940 126 HA ASN 18 HA ASN 18 12.359 -1.866 -6.543 127 HB2 ASN 18 2HB ASN 18 9.973 -0.996 -7.468 128 HB3 ASN 18 3HB ASN 18 9.558 -1.093 -5.759 129 HD21 ASN 18 1HD2 ASN 18 11.650 0.395 -8.196 130 HD22 ASN 18 2HD2 ASN 18 12.211 1.713 -7.186 131 H TYR 19 H TYR 19 10.029 -4.188 -5.408 132 HA TYR 19 HA TYR 19 10.613 -3.801 -2.540 133 HB2 TYR 19 2HB TYR 19 8.933 -5.833 -4.056 134 HB3 TYR 19 3HB TYR 19 9.025 -5.665 -2.313 135 HD1 TYR 19 HD1 TYR 19 7.918 -3.930 -5.455 136 HD2 TYR 19 HD2 TYR 19 7.766 -4.002 -1.140 137 HE1 TYR 19 HE1 TYR 19 6.051 -2.294 -5.492 138 HE2 TYR 19 HE2 TYR 19 5.902 -2.354 -1.181 139 HH TYR 19 HH TYR 19 4.582 -1.031 -4.243 140 H CYS 20 H CYS 20 11.948 -5.598 -5.168 141 HA CYS 20 HA CYS 20 13.260 -7.680 -3.514 142 HB2 CYS 20 2HB CYS 20 12.555 -7.875 -5.998 143 HB3 CYS 20 3HB CYS 20 13.904 -6.800 -6.347 144 H ASN 21 H ASN 21 13.865 -4.471 -4.734 145 HA ASN 21 HA ASN 21 16.762 -4.424 -4.375 146 HB2 ASN 21 2HB ASN 21 14.649 -2.348 -5.089 147 HB3 ASN 21 3HB ASN 21 16.311 -1.895 -4.750 148 HD21 ASN 21 1HD2 ASN 21 14.364 -3.989 -6.973 149 HD22 ASN 21 2HD2 ASN 21 15.570 -3.889 -8.247 150 H1 PHE 1 1H PHE 1 6.573 -11.772 -18.949 151 H2 PHE 1 2H PHE 1 5.794 -13.207 -18.820 152 H3 PHE 1 3H PHE 1 7.134 -12.908 -17.919 153 HA PHE 1 HA PHE 1 5.197 -12.742 -16.539 154 HB2 PHE 1 2HB PHE 1 7.188 -11.233 -16.151 155 HB3 PHE 1 3HB PHE 1 6.370 -9.980 -17.076 156 HD1 PHE 1 HD1 PHE 1 5.919 -12.223 -14.079 157 HD2 PHE 1 HD2 PHE 1 4.925 -8.448 -15.938 158 HE1 PHE 1 HE1 PHE 1 4.733 -11.506 -12.028 159 HE2 PHE 1 HE2 PHE 1 3.818 -7.719 -13.855 160 HZ PHE 1 HZ PHE 1 3.701 -9.241 -11.900 161 H VAL 2 H VAL 2 3.305 -11.304 -15.945 162 HA VAL 2 HA VAL 2 2.207 -9.577 -17.996 163 HB VAL 2 HB VAL 2 1.138 -11.675 -18.664 164 HG11 VAL 2 1HG1 VAL 2 -0.466 -12.881 -17.319 165 HG12 VAL 2 2HG1 VAL 2 1.099 -12.888 -16.496 166 HG13 VAL 2 3HG1 VAL 2 -0.202 -11.806 -15.939 167 HG21 VAL 2 3HG2 VAL 2 -0.062 -9.520 -18.911 168 HG22 VAL 2 1HG2 VAL 2 -1.155 -10.904 -18.728 169 HG23 VAL 2 2HG2 VAL 2 -0.881 -9.811 -17.359 170 H ASN 3 H ASN 3 1.283 -7.839 -17.045 171 HA ASN 3 HA ASN 3 1.530 -7.440 -14.223 172 HB2 ASN 3 2HB ASN 3 -0.142 -5.874 -16.226 173 HB3 ASN 3 3HB ASN 3 0.347 -5.317 -14.631 174 HD21 ASN 3 1HD2 ASN 3 0.938 -4.126 -17.313 175 HD22 ASN 3 2HD2 ASN 3 2.689 -4.075 -17.411 176 H GLN 4 H GLN 4 0.241 -8.216 -12.610 177 HA GLN 4 HA GLN 4 -2.614 -8.769 -13.038 178 HB2 GLN 4 2HB GLN 4 -2.475 -11.143 -12.910 179 HB3 GLN 4 3HB GLN 4 -1.445 -10.609 -14.221 180 HG2 GLN 4 2HG GLN 4 0.531 -10.783 -12.572 181 HG3 GLN 4 3HG GLN 4 -0.586 -11.554 -11.456 182 HE21 GLN 4 1HE2 GLN 4 1.845 -12.398 -13.396 183 HE22 GLN 4 2HE2 GLN 4 1.250 -13.955 -13.959 184 H HIS 5 H HIS 5 -3.350 -10.280 -11.183 185 HA HIS 5 HA HIS 5 -2.581 -9.105 -8.565 186 HB2 HIS 5 2HB HIS 5 -4.704 -11.158 -9.316 187 HB3 HIS 5 3HB HIS 5 -4.441 -10.495 -7.707 188 HD2 HIS 5 HD2 HIS 5 -5.728 -9.444 -11.200 189 HE1 HIS 5 HE1 HIS 5 -7.167 -6.582 -8.392 190 HE2 HIS 5 HE2 HIS 5 -7.307 -7.373 -10.815 191 H LEU 6 H LEU 6 -1.314 -10.158 -7.091 192 HA LEU 6 HA LEU 6 -0.498 -13.011 -7.526 193 HB2 LEU 6 2HB LEU 6 1.320 -10.616 -7.178 194 HB3 LEU 6 3HB LEU 6 1.853 -12.288 -7.135 195 HG LEU 6 HG LEU 6 0.605 -10.942 -9.571 196 HD11 LEU 6 1HD1 LEU 6 2.654 -9.812 -9.050 197 HD12 LEU 6 2HD1 LEU 6 3.478 -11.338 -8.704 198 HD13 LEU 6 3HD1 LEU 6 3.001 -10.939 -10.374 199 HD21 LEU 6 3HD2 LEU 6 1.599 -12.881 -10.770 200 HD22 LEU 6 1HD2 LEU 6 2.123 -13.572 -9.224 201 HD23 LEU 6 2HD2 LEU 6 0.395 -13.419 -9.586 202 H CYS 7 H CYS 7 -0.568 -14.147 -5.723 203 HA CYS 7 HA CYS 7 -0.080 -12.866 -3.060 204 HB2 CYS 7 2HB CYS 7 -2.260 -14.871 -3.736 205 HB3 CYS 7 3HB CYS 7 -1.937 -14.210 -2.143 206 H GLY 8 H GLY 8 1.081 -14.170 -1.633 207 HA2 GLY 8 HA2 GLY 8 2.360 -15.934 -0.835 208 HA3 GLY 8 HA3 GLY 8 1.060 -16.935 -1.483 209 H SER 9 H SER 9 1.812 -18.552 -2.670 210 HA SER 9 HA SER 9 4.384 -18.890 -3.733 211 HB2 SER 9 2HB SER 9 1.789 -20.084 -4.777 212 HB3 SER 9 3HB SER 9 3.422 -20.733 -4.996 213 HG SER 9 HG SER 9 2.299 -21.776 -3.265 214 H HIS 10 H HIS 10 1.495 -17.475 -5.377 215 HA HIS 10 HA HIS 10 2.720 -17.289 -7.972 216 HB2 HIS 10 2HB HIS 10 0.192 -16.650 -6.784 217 HB3 HIS 10 3HB HIS 10 0.794 -15.159 -7.465 218 HD2 HIS 10 HD2 HIS 10 -1.317 -17.876 -8.462 219 HE1 HIS 10 HE1 HIS 10 0.605 -16.843 -12.117 220 HE2 HIS 10 HE2 HIS 10 -1.345 -18.115 -11.082 221 H LEU 11 H LEU 11 2.696 -15.163 -5.161 222 HA LEU 11 HA LEU 11 3.983 -12.914 -6.460 223 HB2 LEU 11 2HB LEU 11 2.432 -12.939 -4.402 224 HB3 LEU 11 3HB LEU 11 3.807 -13.539 -3.483 225 HG LEU 11 HG LEU 11 5.071 -11.450 -4.062 226 HD11 LEU 11 1HD1 LEU 11 2.381 -10.534 -5.176 227 HD12 LEU 11 2HD1 LEU 11 3.813 -9.518 -4.964 228 HD13 LEU 11 3HD1 LEU 11 3.841 -10.810 -6.159 229 HD21 LEU 11 3HD2 LEU 11 3.725 -9.999 -2.542 230 HD22 LEU 11 1HD2 LEU 11 2.331 -11.066 -2.753 231 HD23 LEU 11 2HD2 LEU 11 3.801 -11.665 -1.946 232 H VAL 12 H VAL 12 5.164 -15.557 -4.346 233 HA VAL 12 HA VAL 12 7.952 -14.899 -4.465 234 HB VAL 12 HB VAL 12 6.573 -17.600 -4.195 235 HG11 VAL 12 1HG1 VAL 12 9.506 -16.896 -3.742 236 HG12 VAL 12 2HG1 VAL 12 8.728 -18.408 -3.223 237 HG13 VAL 12 3HG1 VAL 12 8.862 -18.041 -4.944 238 HG21 VAL 12 3HG2 VAL 12 7.852 -15.769 -2.119 239 HG22 VAL 12 1HG2 VAL 12 6.110 -15.985 -2.367 240 HG23 VAL 12 2HG2 VAL 12 7.086 -17.345 -1.807 241 H GLU 13 H GLU 13 5.977 -16.955 -6.641 242 HA GLU 13 HA GLU 13 7.999 -17.605 -8.530 243 HB2 GLU 13 2HB GLU 13 4.984 -17.369 -8.651 244 HB3 GLU 13 3HB GLU 13 5.896 -17.555 -10.137 245 HG2 GLU 13 3HG GLU 13 6.968 -19.609 -9.242 246 HG3 GLU 13 2HG GLU 13 6.064 -19.432 -7.737 247 H ALA 14 H ALA 14 5.825 -14.676 -8.476 248 HA ALA 14 HA ALA 14 6.882 -13.573 -10.868 249 HB1 ALA 14 3HB ALA 14 5.863 -11.494 -9.996 250 HB2 ALA 14 1HB ALA 14 4.790 -12.913 -9.830 251 HB3 ALA 14 2HB ALA 14 5.652 -12.264 -8.411 252 H LEU 15 H LEU 15 7.886 -12.957 -7.427 253 HA LEU 15 HA LEU 15 9.992 -11.170 -8.073 254 HB2 LEU 15 2HB LEU 15 9.370 -12.961 -5.720 255 HB3 LEU 15 3HB LEU 15 10.992 -12.318 -5.847 256 HG LEU 15 HG LEU 15 9.713 -10.934 -4.387 257 HD11 LEU 15 1HD1 LEU 15 10.151 -8.743 -5.305 258 HD12 LEU 15 2HD1 LEU 15 11.431 -9.859 -5.824 259 HD13 LEU 15 3HD1 LEU 15 10.158 -9.364 -6.960 260 HD21 LEU 15 3HD2 LEU 15 7.808 -9.533 -5.212 261 HD22 LEU 15 1HD2 LEU 15 7.763 -10.532 -6.678 262 HD23 LEU 15 2HD2 LEU 15 7.456 -11.259 -5.086 263 H TYR 16 H TYR 16 10.084 -14.749 -8.084 264 HA TYR 16 HA TYR 16 12.868 -14.968 -8.786 265 HB2 TYR 16 2HB TYR 16 11.581 -16.918 -8.122 266 HB3 TYR 16 3HB TYR 16 10.464 -16.689 -9.459 267 HD1 TYR 16 HD2 TYR 16 14.033 -17.536 -8.700 268 HD2 TYR 16 HD1 TYR 16 10.885 -17.520 -11.646 269 HE1 TYR 16 HE2 TYR 16 15.395 -19.017 -10.159 270 HE2 TYR 16 HE1 TYR 16 12.238 -19.007 -13.106 271 HH TYR 16 HH TYR 16 15.499 -20.169 -12.153 272 H LEU 17 H LEU 17 9.946 -14.701 -10.901 273 HA LEU 17 HA LEU 17 11.408 -14.762 -13.354 274 HB2 LEU 17 2HB LEU 17 8.680 -13.571 -12.679 275 HB3 LEU 17 3HB LEU 17 9.306 -13.747 -14.308 276 HG LEU 17 HG LEU 17 8.862 -16.067 -12.424 277 HD11 LEU 17 1HD1 LEU 17 6.733 -14.962 -12.984 278 HD12 LEU 17 2HD1 LEU 17 7.126 -15.063 -14.716 279 HD13 LEU 17 3HD1 LEU 17 6.848 -16.543 -13.772 280 HD21 LEU 17 3HD2 LEU 17 10.534 -16.613 -14.137 281 HD22 LEU 17 1HD2 LEU 17 9.021 -17.449 -14.492 282 HD23 LEU 17 2HD2 LEU 17 9.461 -15.995 -15.413 283 H VAL 18 H VAL 18 10.346 -11.927 -11.434 284 HA VAL 18 HA VAL 18 11.491 -10.120 -13.440 285 HB VAL 18 HB VAL 18 11.041 -8.729 -10.906 286 HG11 VAL 18 1HG1 VAL 18 9.641 -7.321 -12.289 287 HG12 VAL 18 2HG1 VAL 18 11.175 -7.651 -13.102 288 HG13 VAL 18 3HG1 VAL 18 9.706 -8.517 -13.617 289 HG21 VAL 18 3HG2 VAL 18 8.584 -8.859 -10.979 290 HG22 VAL 18 1HG2 VAL 18 8.735 -10.401 -11.849 291 HG23 VAL 18 2HG2 VAL 18 9.467 -10.169 -10.213 292 H CYS 19 H CYS 19 12.589 -11.262 -10.224 293 HA CYS 19 HA CYS 19 14.873 -9.363 -10.412 294 HB2 CYS 19 2HB CYS 19 13.165 -9.214 -8.553 295 HB3 CYS 19 3HB CYS 19 13.774 -10.762 -7.960 296 H GLY 20 H GLY 20 14.206 -12.822 -10.039 297 HA2 GLY 20 HA2 GLY 20 17.020 -13.493 -9.360 298 HA3 GLY 20 HA3 GLY 20 15.642 -14.608 -9.500 299 H GLU 21 H GLU 21 14.722 -14.756 -11.763 300 HA GLU 21 HA GLU 21 16.798 -15.560 -13.639 301 HB2 GLU 21 2HB GLU 21 14.794 -16.894 -13.127 302 HB3 GLU 21 3HB GLU 21 13.762 -15.614 -13.746 303 HG2 GLU 21 2HG GLU 21 13.988 -17.465 -15.315 304 HG3 GLU 21 3HG GLU 21 14.563 -15.955 -15.999 305 H ARG 22 H ARG 22 14.891 -12.724 -13.129 306 HA ARG 22 HA ARG 22 14.274 -10.910 -14.294 307 HB2 ARG 22 2HB ARG 22 17.180 -11.204 -15.032 308 HB3 ARG 22 3HB ARG 22 16.241 -9.691 -15.033 309 HG2 ARG 22 2HG ARG 22 15.802 -10.371 -12.500 310 HG3 ARG 22 3HG ARG 22 17.246 -11.347 -12.730 311 HD2 ARG 22 2HD ARG 22 17.951 -9.282 -11.792 312 HD3 ARG 22 3HD ARG 22 18.449 -9.259 -13.482 313 HE ARG 22 HE ARG 22 15.972 -7.890 -12.423 314 HH11 ARG 22 1HH1 ARG 22 18.810 -7.680 -14.549 315 HH12 ARG 22 2HH1 ARG 22 18.392 -6.072 -15.056 316 HH21 ARG 22 1HH2 ARG 22 15.553 -5.856 -13.040 317 HH22 ARG 22 2HH2 ARG 22 16.554 -5.046 -14.228 318 H GLY 23 H GLY 23 13.014 -12.597 -15.639 319 HA2 GLY 23 HA2 GLY 23 13.653 -12.794 -18.509 320 HA3 GLY 23 HA3 GLY 23 12.181 -13.361 -17.656 321 H HIS 24 H HIS 24 11.486 -10.939 -16.473 322 HA HIS 24 HA HIS 24 10.103 -9.259 -16.778 323 HB2 HIS 24 2HB HIS 24 12.015 -8.486 -19.005 324 HB3 HIS 24 3HB HIS 24 10.886 -7.394 -18.198 325 HD2 HIS 24 HD2 HIS 24 14.351 -8.618 -17.957 326 HE1 HIS 24 HE1 HIS 24 13.531 -7.049 -14.091 327 HE2 HIS 24 HE2 HIS 24 15.376 -7.837 -15.659 328 H PHE 25 H PHE 25 9.921 -8.088 -19.781 329 HA PHE 25 HA PHE 25 7.987 -9.928 -21.002 330 HB2 PHE 25 2HB PHE 25 6.598 -8.698 -19.380 331 HB3 PHE 25 3HB PHE 25 7.228 -7.164 -19.967 332 HD1 PHE 25 HD2 PHE 25 5.422 -10.240 -21.189 333 HD2 PHE 25 HD1 PHE 25 6.032 -5.994 -21.639 334 HE1 PHE 25 HE2 PHE 25 3.645 -10.168 -22.912 335 HE2 PHE 25 HE1 PHE 25 4.242 -5.924 -23.355 336 HZ PHE 25 HZ PHE 25 3.047 -8.008 -24.000 337 H TYR 26 H TYR 26 7.691 -9.528 -23.201 338 HA TYR 26 HA TYR 26 9.058 -7.266 -24.533 339 HB2 TYR 26 2HB TYR 26 10.738 -9.049 -24.194 340 HB3 TYR 26 3HB TYR 26 9.664 -10.215 -24.968 341 HD1 TYR 26 HD1 TYR 26 11.272 -6.890 -25.576 342 HD2 TYR 26 HD2 TYR 26 9.892 -10.589 -27.290 343 HE1 TYR 26 HE1 TYR 26 12.194 -6.199 -27.777 344 HE2 TYR 26 HE2 TYR 26 10.893 -9.950 -29.483 345 HH TYR 26 HH TYR 26 12.546 -6.803 -29.984 346 H THR 27 H THR 27 8.389 -6.919 -26.627 347 HA THR 27 HA THR 27 6.241 -8.611 -27.803 348 HB THR 27 HB THR 27 5.293 -6.504 -28.826 349 HG1 THR 27 HG1 THR 27 5.710 -4.594 -27.679 350 HG21 THR 27 1HG2 THR 27 3.919 -5.994 -26.857 351 HG22 THR 27 2HG2 THR 27 4.192 -7.740 -26.967 352 HG23 THR 27 3HG2 THR 27 5.105 -6.775 -25.788 353 HA PRO 28 HA PRO 28 9.508 -8.531 -30.831 354 HB2 PRO 28 2HB PRO 28 8.678 -10.442 -32.539 355 HB3 PRO 28 3HB PRO 28 9.089 -10.831 -30.847 356 HG2 PRO 28 2HG PRO 28 6.322 -10.288 -31.987 357 HG3 PRO 28 3HG PRO 28 6.852 -11.691 -31.000 358 HD2 PRO 28 2HD PRO 28 5.655 -9.498 -29.886 359 HD3 PRO 28 3HD PRO 28 6.954 -10.395 -29.039 360 H LYS 29 H LYS 29 9.971 -7.993 -33.025 361 HA LYS 29 HA LYS 29 8.205 -5.930 -34.094 362 HB2 LYS 29 2HB LYS 29 10.811 -5.908 -33.754 363 HB3 LYS 29 3HB LYS 29 10.850 -6.816 -35.261 364 HG2 LYS 29 2HG LYS 29 9.265 -4.762 -36.080 365 HG3 LYS 29 3HG LYS 29 9.962 -3.971 -34.686 366 HD2 LYS 29 2HD LYS 29 11.209 -3.402 -36.701 367 HD3 LYS 29 3HD LYS 29 12.232 -4.301 -35.586 368 HE2 LYS 29 2HE LYS 29 12.575 -4.992 -37.934 369 HE3 LYS 29 3HE LYS 29 12.034 -6.330 -36.924 370 HZ1 LYS 29 HZ1 LYS 29 10.866 -6.246 -39.058 371 HZ2 LYS 29 HZ2 LYS 29 9.807 -6.067 -37.827 372 HZ3 LYS 29 HZ3 LYS 29 10.262 -4.765 -38.721 373 H THR 30 H THR 30 7.342 -8.744 -34.375 374 HA THR 30 HA THR 30 7.572 -9.779 -37.012 375 HB THR 30 HB THR 30 5.248 -10.143 -35.087 376 HG1 THR 30 HG1 THR 30 6.504 -11.908 -34.365 377 HG21 THR 30 1HG2 THR 30 6.394 -11.940 -37.280 378 HG22 THR 30 2HG2 THR 30 5.112 -12.398 -36.135 379 HG23 THR 30 3HG2 THR 30 4.818 -11.120 -37.318 Start of MODEL 13 1 H1 GLY 1 1H GLY 1 3.957 -3.516 2.585 2 H2 GLY 1 2H GLY 1 4.831 -2.480 1.655 3 H3 GLY 1 3H GLY 1 5.433 -3.021 3.084 4 HA2 GLY 1 HA2 GLY 1 6.547 -4.200 1.366 5 HA3 GLY 1 HA3 GLY 1 5.461 -5.299 2.239 6 H ILE 2 H ILE 2 6.151 -6.225 -0.078 7 HA ILE 2 HA ILE 2 4.762 -5.245 -2.372 8 HB ILE 2 HB ILE 2 6.878 -6.432 -2.500 9 HG12 ILE 2 2HG1 ILE 2 6.523 -7.929 -4.341 10 HG13 ILE 2 3HG1 ILE 2 4.808 -8.104 -3.950 11 HG21 ILE 2 1HG2 ILE 2 7.092 -8.856 -2.199 12 HG22 ILE 2 2HG2 ILE 2 6.622 -8.086 -0.686 13 HG23 ILE 2 3HG2 ILE 2 5.415 -8.964 -1.647 14 HD11 ILE 2 3HD1 ILE 2 4.543 -5.633 -4.500 15 HD12 ILE 2 1HD1 ILE 2 6.245 -5.662 -5.017 16 HD13 ILE 2 2HD1 ILE 2 5.032 -6.662 -5.841 17 H VAL 3 H VAL 3 3.730 -7.650 -0.004 18 HA VAL 3 HA VAL 3 1.677 -8.864 -1.619 19 HB VAL 3 HB VAL 3 1.758 -8.563 1.414 20 HG11 VAL 3 1HG1 VAL 3 0.230 -10.520 1.445 21 HG12 VAL 3 2HG1 VAL 3 -0.526 -9.134 0.657 22 HG13 VAL 3 3HG1 VAL 3 0.125 -10.466 -0.325 23 HG21 VAL 3 3HG2 VAL 3 3.728 -9.810 0.534 24 HG22 VAL 3 1HG2 VAL 3 2.633 -10.866 1.431 25 HG23 VAL 3 2HG2 VAL 3 2.631 -10.900 -0.342 26 H GLU 4 H GLU 4 1.636 -6.097 0.622 27 HA GLU 4 HA GLU 4 -1.096 -5.376 0.207 28 HB2 GLU 4 2HB GLU 4 1.155 -3.504 0.984 29 HB3 GLU 4 3HB GLU 4 -0.563 -3.385 1.371 30 HG2 GLU 4 2HG GLU 4 0.122 -4.171 3.379 31 HG3 GLU 4 3HG GLU 4 -0.063 -5.741 2.605 32 H GLN 5 H GLN 5 1.444 -5.172 -2.053 33 HA GLN 5 HA GLN 5 0.173 -2.887 -3.498 34 HB2 GLN 5 2HB GLN 5 2.555 -2.631 -2.958 35 HB3 GLN 5 3HB GLN 5 2.922 -4.132 -3.802 36 HG2 GLN 5 2HG GLN 5 3.485 -2.197 -5.168 37 HG3 GLN 5 3HG GLN 5 2.231 -3.140 -5.947 38 HE21 GLN 5 2HE2 GLN 5 -0.021 -2.249 -5.905 39 HE22 GLN 5 1HE2 GLN 5 -0.223 -0.504 -5.724 40 H CYS 6 H CYS 6 1.084 -6.357 -3.861 41 HA CYS 6 HA CYS 6 -0.227 -6.303 -6.554 42 HB2 CYS 6 2HB CYS 6 2.302 -6.955 -5.967 43 HB3 CYS 6 3HB CYS 6 1.538 -8.528 -5.753 44 H CYS 7 H CYS 7 -0.550 -7.943 -3.462 45 HA CYS 7 HA CYS 7 -2.341 -10.003 -4.532 46 HB2 CYS 7 2HB CYS 7 -0.857 -10.322 -2.565 47 HB3 CYS 7 3HB CYS 7 -1.830 -9.163 -1.661 48 H THR 8 H THR 8 -2.823 -6.875 -2.981 49 HA THR 8 HA THR 8 -5.717 -7.158 -2.697 50 HB THR 8 HB THR 8 -4.181 -5.808 -1.211 51 HG1 THR 8 HG1 THR 8 -5.775 -4.228 -0.951 52 HG21 THR 8 1HG2 THR 8 -4.376 -3.734 -3.440 53 HG22 THR 8 2HG2 THR 8 -3.579 -3.555 -1.864 54 HG23 THR 8 3HG2 THR 8 -2.911 -4.671 -3.075 55 H SER 9 H SER 9 -3.585 -5.843 -5.154 56 HA SER 9 HA SER 9 -5.648 -5.537 -7.150 57 HB2 SER 9 2HB SER 9 -5.396 -3.167 -7.522 58 HB3 SER 9 3HB SER 9 -6.001 -3.449 -5.888 59 HG SER 9 HG SER 9 -4.324 -1.863 -5.948 60 H ILE 10 H ILE 10 -4.594 -4.618 -9.230 61 HA ILE 10 HA ILE 10 -2.415 -6.437 -9.686 62 HB ILE 10 HB ILE 10 -3.724 -4.409 -11.536 63 HG12 ILE 10 2HG1 ILE 10 -4.116 -7.364 -10.897 64 HG13 ILE 10 3HG1 ILE 10 -5.270 -6.047 -10.710 65 HG21 ILE 10 1HG2 ILE 10 -2.658 -5.763 -13.366 66 HG22 ILE 10 2HG2 ILE 10 -1.483 -4.896 -12.399 67 HG23 ILE 10 3HG2 ILE 10 -1.723 -6.627 -12.123 68 HD11 ILE 10 3HD1 ILE 10 -5.932 -7.396 -12.530 69 HD12 ILE 10 1HD1 ILE 10 -5.403 -5.819 -13.163 70 HD13 ILE 10 2HD1 ILE 10 -4.346 -7.258 -13.317 71 H CYS 11 H CYS 11 -0.287 -6.157 -9.551 72 HA CYS 11 HA CYS 11 0.852 -3.412 -9.819 73 HB2 CYS 11 2HB CYS 11 2.735 -4.043 -8.669 74 HB3 CYS 11 3HB CYS 11 1.416 -4.697 -7.721 75 H SER 12 H SER 12 2.296 -2.957 -11.438 76 HA SER 12 HA SER 12 2.743 -4.926 -13.597 77 HB2 SER 12 2HB SER 12 4.027 -2.989 -14.599 78 HB3 SER 12 3HB SER 12 2.292 -2.748 -14.399 79 HG SER 12 HG SER 12 3.684 -0.975 -13.720 80 H LEU 13 H LEU 13 4.856 -5.363 -14.405 81 HA LEU 13 HA LEU 13 6.701 -6.335 -12.490 82 HB2 LEU 13 2HB LEU 13 8.229 -6.587 -14.311 83 HB3 LEU 13 3HB LEU 13 6.644 -7.202 -14.738 84 HG LEU 13 HG LEU 13 7.659 -4.484 -15.680 85 HD11 LEU 13 1HD1 LEU 13 9.235 -6.228 -16.403 86 HD12 LEU 13 2HD1 LEU 13 7.892 -7.163 -17.100 87 HD13 LEU 13 3HD1 LEU 13 8.325 -5.573 -17.771 88 HD21 LEU 13 3HD2 LEU 13 5.470 -6.288 -16.779 89 HD22 LEU 13 1HD2 LEU 13 5.245 -4.693 -16.018 90 HD23 LEU 13 2HD2 LEU 13 6.072 -4.818 -17.561 91 H TYR 14 H TYR 14 6.538 -3.200 -14.115 92 HA TYR 14 HA TYR 14 9.207 -2.453 -13.480 93 HB2 TYR 14 2HB TYR 14 8.638 -0.334 -14.405 94 HB3 TYR 14 3HB TYR 14 7.972 -1.658 -15.385 95 HD1 TYR 14 HD2 TYR 14 6.973 0.885 -12.778 96 HD2 TYR 14 HD1 TYR 14 5.809 -1.474 -16.201 97 HE1 TYR 14 HE2 TYR 14 4.834 2.124 -12.895 98 HE2 TYR 14 HE1 TYR 14 3.686 -0.189 -16.358 99 HH TYR 14 HH TYR 14 2.390 1.488 -15.455 100 H GLN 15 H GLN 15 6.568 -2.545 -11.462 101 HA GLN 15 HA GLN 15 7.753 -0.509 -9.596 102 HB2 GLN 15 2HB GLN 15 5.533 -0.348 -8.526 103 HB3 GLN 15 3HB GLN 15 5.513 0.184 -10.212 104 HG2 GLN 15 2HG GLN 15 4.561 -1.935 -10.916 105 HG3 GLN 15 3HG GLN 15 4.608 -2.579 -9.275 106 HE21 GLN 15 2HE2 GLN 15 2.712 -0.796 -11.544 107 HE22 GLN 15 1HE2 GLN 15 1.446 -0.324 -10.408 108 H LEU 16 H LEU 16 6.697 -3.887 -10.036 109 HA LEU 16 HA LEU 16 7.099 -4.562 -7.263 110 HB2 LEU 16 2HB LEU 16 6.082 -6.456 -7.778 111 HB3 LEU 16 3HB LEU 16 5.635 -5.600 -9.223 112 HG LEU 16 HG LEU 16 7.778 -6.616 -10.259 113 HD11 LEU 16 1HD1 LEU 16 7.702 -7.982 -7.611 114 HD12 LEU 16 2HD1 LEU 16 7.907 -9.070 -8.984 115 HD13 LEU 16 3HD1 LEU 16 9.049 -7.746 -8.744 116 HD21 LEU 16 3HD2 LEU 16 5.438 -8.444 -9.496 117 HD22 LEU 16 1HD2 LEU 16 5.423 -7.273 -10.832 118 HD23 LEU 16 2HD2 LEU 16 6.524 -8.659 -10.886 119 H GLU 17 H GLU 17 9.193 -4.456 -10.095 120 HA GLU 17 HA GLU 17 11.546 -5.763 -9.223 121 HB2 GLU 17 2HB GLU 17 11.088 -3.168 -10.763 122 HB3 GLU 17 3HB GLU 17 12.713 -3.700 -10.343 123 HG2 GLU 17 2HG GLU 17 12.320 -5.850 -11.521 124 HG3 GLU 17 3HG GLU 17 10.771 -5.209 -12.086 125 H ASN 18 H ASN 18 10.088 -2.795 -8.147 126 HA ASN 18 HA ASN 18 12.336 -1.573 -6.865 127 HB2 ASN 18 2HB ASN 18 9.813 -0.802 -7.526 128 HB3 ASN 18 3HB ASN 18 9.586 -1.024 -5.794 129 HD21 ASN 18 1HD2 ASN 18 11.286 0.735 -8.340 130 HD22 ASN 18 2HD2 ASN 18 11.900 2.018 -7.317 131 H TYR 19 H TYR 19 10.352 -4.186 -5.867 132 HA TYR 19 HA TYR 19 11.097 -4.052 -3.002 133 HB2 TYR 19 2HB TYR 19 9.280 -5.914 -4.583 134 HB3 TYR 19 3HB TYR 19 9.498 -5.944 -2.848 135 HD1 TYR 19 HD2 TYR 19 8.185 -3.870 -5.676 136 HD2 TYR 19 HD1 TYR 19 8.394 -4.389 -1.395 137 HE1 TYR 19 HE2 TYR 19 6.341 -2.227 -5.381 138 HE2 TYR 19 HE1 TYR 19 6.557 -2.742 -1.103 139 HH TYR 19 HH TYR 19 5.077 -1.322 -2.144 140 H CYS 20 H CYS 20 12.652 -5.162 -5.724 141 HA CYS 20 HA CYS 20 13.615 -7.756 -4.921 142 HB2 CYS 20 2HB CYS 20 13.626 -6.814 -7.220 143 HB3 CYS 20 3HB CYS 20 14.821 -5.621 -6.728 144 H ASN 21 H ASN 21 14.674 -4.505 -4.150 145 HA ASN 21 HA ASN 21 17.198 -5.321 -2.869 146 HB2 ASN 21 2HB ASN 21 17.289 -2.830 -2.302 147 HB3 ASN 21 3HB ASN 21 17.390 -3.283 -3.998 148 HD21 ASN 21 1HD2 ASN 21 14.449 -2.982 -1.989 149 HD22 ASN 21 2HD2 ASN 21 13.699 -1.790 -3.065 150 H1 PHE 1 1H PHE 1 7.084 -11.501 -18.153 151 H2 PHE 1 2H PHE 1 6.097 -10.663 -19.159 152 H3 PHE 1 3H PHE 1 5.817 -12.247 -18.872 153 HA PHE 1 HA PHE 1 5.301 -11.831 -16.579 154 HB2 PHE 1 2HB PHE 1 6.819 -9.860 -16.361 155 HB3 PHE 1 3HB PHE 1 5.700 -8.898 -17.314 156 HD1 PHE 1 HD1 PHE 1 6.084 -10.795 -14.105 157 HD2 PHE 1 HD2 PHE 1 3.784 -7.843 -16.265 158 HE1 PHE 1 HE1 PHE 1 4.870 -10.197 -12.025 159 HE2 PHE 1 HE2 PHE 1 2.620 -7.228 -14.166 160 HZ PHE 1 HZ PHE 1 3.154 -8.401 -12.047 161 H VAL 2 H VAL 2 3.120 -11.197 -15.874 162 HA VAL 2 HA VAL 2 1.286 -10.133 -17.970 163 HB VAL 2 HB VAL 2 0.667 -12.532 -16.186 164 HG11 VAL 2 1HG1 VAL 2 -1.328 -11.100 -16.382 165 HG12 VAL 2 2HG1 VAL 2 -1.128 -11.024 -18.146 166 HG13 VAL 2 3HG1 VAL 2 -1.542 -12.558 -17.349 167 HG21 VAL 2 3HG2 VAL 2 0.305 -13.746 -18.321 168 HG22 VAL 2 1HG2 VAL 2 0.865 -12.321 -19.221 169 HG23 VAL 2 2HG2 VAL 2 1.975 -13.206 -18.152 170 H ASN 3 H ASN 3 0.317 -8.381 -17.177 171 HA ASN 3 HA ASN 3 0.368 -7.633 -14.366 172 HB2 ASN 3 2HB ASN 3 -0.603 -6.462 -16.928 173 HB3 ASN 3 3HB ASN 3 -1.533 -6.015 -15.491 174 HD21 ASN 3 2HD2 ASN 3 1.621 -5.914 -17.066 175 HD22 ASN 3 1HD2 ASN 3 2.122 -4.510 -16.155 176 H GLN 4 H GLN 4 -0.748 -8.671 -12.892 177 HA GLN 4 HA GLN 4 -3.591 -9.258 -13.054 178 HB2 GLN 4 2HB GLN 4 -3.435 -11.659 -12.873 179 HB3 GLN 4 3HB GLN 4 -2.589 -11.158 -14.332 180 HG2 GLN 4 2HG GLN 4 -0.449 -11.212 -12.915 181 HG3 GLN 4 3HG GLN 4 -1.386 -12.019 -11.665 182 HE21 GLN 4 2HE2 GLN 4 0.910 -12.956 -13.526 183 HE22 GLN 4 1HE2 GLN 4 0.268 -14.465 -14.155 184 H HIS 5 H HIS 5 -4.116 -10.639 -10.992 185 HA HIS 5 HA HIS 5 -2.913 -9.277 -8.651 186 HB2 HIS 5 2HB HIS 5 -5.186 -11.289 -8.890 187 HB3 HIS 5 3HB HIS 5 -4.669 -10.494 -7.405 188 HD2 HIS 5 HD2 HIS 5 -6.304 -9.630 -10.824 189 HE1 HIS 5 HE1 HIS 5 -7.183 -6.445 -8.160 190 HE2 HIS 5 HE2 HIS 5 -7.692 -7.434 -10.453 191 H LEU 6 H LEU 6 -1.357 -10.169 -7.394 192 HA LEU 6 HA LEU 6 -0.659 -13.073 -7.724 193 HB2 LEU 6 2HB LEU 6 1.187 -10.660 -7.706 194 HB3 LEU 6 3HB LEU 6 1.735 -12.330 -7.594 195 HG LEU 6 HG LEU 6 0.228 -11.162 -9.980 196 HD11 LEU 6 1HD1 LEU 6 2.432 -10.144 -9.771 197 HD12 LEU 6 2HD1 LEU 6 3.174 -11.735 -9.513 198 HD13 LEU 6 3HD1 LEU 6 2.465 -11.324 -11.095 199 HD21 LEU 6 3HD2 LEU 6 -0.096 -13.622 -9.790 200 HD22 LEU 6 1HD2 LEU 6 0.987 -13.238 -11.127 201 HD23 LEU 6 2HD2 LEU 6 1.659 -13.838 -9.606 202 H CYS 7 H CYS 7 -0.335 -14.176 -5.919 203 HA CYS 7 HA CYS 7 0.411 -12.848 -3.401 204 HB2 CYS 7 2HB CYS 7 -2.207 -12.858 -3.939 205 HB3 CYS 7 3HB CYS 7 -2.106 -14.496 -3.321 206 H GLY 8 H GLY 8 1.202 -14.292 -1.841 207 HA2 GLY 8 HA2 GLY 8 2.341 -16.179 -1.088 208 HA3 GLY 8 HA3 GLY 8 1.031 -17.097 -1.838 209 H SER 9 H SER 9 1.813 -18.654 -3.064 210 HA SER 9 HA SER 9 4.408 -18.980 -4.124 211 HB2 SER 9 3HB SER 9 3.196 -20.640 -5.648 212 HB3 SER 9 2HB SER 9 3.042 -20.883 -3.900 213 HG SER 9 HG SER 9 1.020 -21.087 -5.008 214 H HIS 10 H HIS 10 1.512 -17.551 -5.716 215 HA HIS 10 HA HIS 10 2.740 -17.260 -8.296 216 HB2 HIS 10 2HB HIS 10 0.208 -16.621 -7.014 217 HB3 HIS 10 3HB HIS 10 0.757 -15.225 -7.917 218 HD2 HIS 10 HD2 HIS 10 -0.917 -18.493 -8.346 219 HE1 HIS 10 HE1 HIS 10 0.237 -17.395 -12.295 220 HE2 HIS 10 HE2 HIS 10 -1.189 -19.004 -10.921 221 H LEU 11 H LEU 11 2.681 -15.139 -5.473 222 HA LEU 11 HA LEU 11 3.966 -12.887 -6.804 223 HB2 LEU 11 2HB LEU 11 2.416 -12.889 -4.730 224 HB3 LEU 11 3HB LEU 11 3.809 -13.452 -3.817 225 HG LEU 11 HG LEU 11 5.020 -11.339 -4.479 226 HD11 LEU 11 1HD1 LEU 11 2.288 -10.571 -5.607 227 HD12 LEU 11 2HD1 LEU 11 3.639 -9.457 -5.379 228 HD13 LEU 11 3HD1 LEU 11 3.780 -10.760 -6.562 229 HD21 LEU 11 3HD2 LEU 11 2.302 -11.000 -3.116 230 HD22 LEU 11 1HD2 LEU 11 3.818 -11.509 -2.334 231 HD23 LEU 11 2HD2 LEU 11 3.656 -9.870 -2.988 232 H VAL 12 H VAL 12 5.098 -15.506 -4.630 233 HA VAL 12 HA VAL 12 7.869 -14.827 -4.644 234 HB VAL 12 HB VAL 12 6.488 -17.530 -4.404 235 HG11 VAL 12 1HG1 VAL 12 9.420 -16.857 -3.896 236 HG12 VAL 12 2HG1 VAL 12 8.611 -18.351 -3.373 237 HG13 VAL 12 3HG1 VAL 12 8.785 -18.010 -5.094 238 HG21 VAL 12 3HG2 VAL 12 7.758 -15.711 -2.313 239 HG22 VAL 12 1HG2 VAL 12 6.019 -15.862 -2.611 240 HG23 VAL 12 2HG2 VAL 12 6.926 -17.256 -2.012 241 H GLU 13 H GLU 13 6.005 -16.900 -6.901 242 HA GLU 13 HA GLU 13 8.125 -17.532 -8.693 243 HB2 GLU 13 2HB GLU 13 5.114 -17.403 -8.919 244 HB3 GLU 13 3HB GLU 13 6.066 -17.507 -10.394 245 HG2 GLU 13 3HG GLU 13 7.226 -19.503 -9.577 246 HG3 GLU 13 2HG GLU 13 6.328 -19.431 -8.054 247 H ALA 14 H ALA 14 5.876 -14.666 -8.795 248 HA ALA 14 HA ALA 14 7.053 -13.561 -11.138 249 HB1 ALA 14 3HB ALA 14 5.956 -11.482 -10.365 250 HB2 ALA 14 1HB ALA 14 4.898 -12.909 -10.257 251 HB3 ALA 14 2HB ALA 14 5.643 -12.234 -8.786 252 H LEU 15 H LEU 15 7.858 -12.915 -7.661 253 HA LEU 15 HA LEU 15 10.027 -11.149 -8.229 254 HB2 LEU 15 2HB LEU 15 9.240 -12.842 -5.852 255 HB3 LEU 15 3HB LEU 15 10.865 -12.196 -5.908 256 HG LEU 15 HG LEU 15 9.491 -10.772 -4.583 257 HD11 LEU 15 1HD1 LEU 15 9.953 -8.595 -5.563 258 HD12 LEU 15 2HD1 LEU 15 11.297 -9.699 -5.900 259 HD13 LEU 15 3HD1 LEU 15 10.128 -9.293 -7.173 260 HD21 LEU 15 3HD2 LEU 15 7.290 -11.151 -5.426 261 HD22 LEU 15 1HD2 LEU 15 7.634 -9.426 -5.549 262 HD23 LEU 15 2HD2 LEU 15 7.685 -10.434 -7.004 263 H TYR 16 H TYR 16 10.051 -14.757 -8.139 264 HA TYR 16 HA TYR 16 12.880 -14.967 -8.502 265 HB2 TYR 16 2HB TYR 16 11.427 -16.922 -8.028 266 HB3 TYR 16 3HB TYR 16 10.678 -16.748 -9.619 267 HD1 TYR 16 HD2 TYR 16 13.834 -17.625 -7.855 268 HD2 TYR 16 HD1 TYR 16 11.804 -17.429 -11.657 269 HE1 TYR 16 HE2 TYR 16 15.695 -18.893 -8.912 270 HE2 TYR 16 HE1 TYR 16 13.668 -18.679 -12.722 271 HH TYR 16 HH TYR 16 16.536 -19.788 -10.860 272 H LEU 17 H LEU 17 10.287 -14.440 -10.918 273 HA LEU 17 HA LEU 17 12.113 -14.542 -13.163 274 HB2 LEU 17 2HB LEU 17 9.296 -13.394 -12.900 275 HB3 LEU 17 3HB LEU 17 10.156 -13.612 -14.415 276 HG LEU 17 HG LEU 17 9.425 -15.904 -12.544 277 HD11 LEU 17 1HD1 LEU 17 7.651 -16.411 -14.173 278 HD12 LEU 17 2HD1 LEU 17 7.416 -14.810 -13.454 279 HD13 LEU 17 3HD1 LEU 17 8.069 -14.953 -15.102 280 HD21 LEU 17 3HD2 LEU 17 9.914 -17.328 -14.514 281 HD22 LEU 17 1HD2 LEU 17 10.470 -15.897 -15.410 282 HD23 LEU 17 2HD2 LEU 17 11.352 -16.459 -13.972 283 H VAL 18 H VAL 18 10.632 -11.752 -11.431 284 HA VAL 18 HA VAL 18 12.110 -9.895 -13.158 285 HB VAL 18 HB VAL 18 11.165 -8.464 -10.822 286 HG11 VAL 18 1HG1 VAL 18 9.921 -7.203 -12.431 287 HG12 VAL 18 2HG1 VAL 18 11.548 -7.528 -13.060 288 HG13 VAL 18 3HG1 VAL 18 10.160 -8.456 -13.679 289 HG21 VAL 18 3HG2 VAL 18 9.615 -10.062 -10.307 290 HG22 VAL 18 1HG2 VAL 18 8.759 -8.774 -11.165 291 HG23 VAL 18 2HG2 VAL 18 9.089 -10.289 -12.018 292 H CYS 19 H CYS 19 12.708 -11.207 -9.949 293 HA CYS 19 HA CYS 19 14.964 -9.291 -9.563 294 HB2 CYS 19 2HB CYS 19 13.159 -9.142 -7.922 295 HB3 CYS 19 3HB CYS 19 13.329 -10.848 -7.538 296 H GLY 20 H GLY 20 14.090 -12.760 -9.188 297 HA2 GLY 20 HA2 GLY 20 16.647 -13.512 -8.068 298 HA3 GLY 20 HA3 GLY 20 15.357 -14.611 -8.604 299 H GLU 21 H GLU 21 15.187 -14.239 -11.249 300 HA GLU 21 HA GLU 21 17.374 -15.696 -12.306 301 HB2 GLU 21 2HB GLU 21 14.971 -15.718 -13.036 302 HB3 GLU 21 3HB GLU 21 15.226 -14.154 -13.820 303 HG2 GLU 21 2HG GLU 21 16.875 -15.172 -15.344 304 HG3 GLU 21 3HG GLU 21 16.775 -16.703 -14.466 305 H ARG 22 H ARG 22 17.071 -12.278 -11.906 306 HA ARG 22 HA ARG 22 18.638 -11.267 -14.052 307 HB2 ARG 22 2HB ARG 22 18.484 -10.162 -11.222 308 HB3 ARG 22 3HB ARG 22 18.858 -9.264 -12.687 309 HG2 ARG 22 2HG ARG 22 16.170 -10.536 -12.021 310 HG3 ARG 22 3HG ARG 22 16.571 -8.843 -11.835 311 HD2 ARG 22 2HD ARG 22 16.657 -10.288 -14.517 312 HD3 ARG 22 3HD ARG 22 15.202 -9.536 -13.890 313 HE ARG 22 HE ARG 22 17.589 -8.195 -14.920 314 HH11 ARG 22 2HH1 ARG 22 14.685 -7.687 -12.949 315 HH12 ARG 22 1HH1 ARG 22 14.604 -5.984 -13.352 316 HH21 ARG 22 2HH2 ARG 22 17.423 -5.961 -15.346 317 HH22 ARG 22 1HH2 ARG 22 16.127 -5.050 -14.619 318 H GLY 23 H GLY 23 19.641 -13.000 -11.198 319 HA2 GLY 23 HA2 GLY 23 22.458 -12.121 -11.327 320 HA3 GLY 23 HA3 GLY 23 21.713 -13.189 -10.104 321 H HIS 24 H HIS 24 21.298 -13.809 -13.497 322 HA HIS 24 HA HIS 24 22.368 -16.455 -13.358 323 HB2 HIS 24 2HB HIS 24 21.860 -16.594 -15.694 324 HB3 HIS 24 3HB HIS 24 20.570 -15.701 -14.904 325 HD2 HIS 24 HD2 HIS 24 20.469 -13.007 -15.404 326 HE1 HIS 24 HE1 HIS 24 23.188 -13.006 -18.677 327 HE2 HIS 24 HE2 HIS 24 21.463 -11.622 -17.411 328 H PHE 25 H PHE 25 23.963 -13.440 -14.108 329 HA PHE 25 HA PHE 25 26.104 -14.503 -15.708 330 HB2 PHE 25 2HB PHE 25 25.235 -12.176 -15.811 331 HB3 PHE 25 3HB PHE 25 25.887 -11.868 -14.205 332 HD1 PHE 25 HD1 PHE 25 26.899 -12.968 -17.661 333 HD2 PHE 25 HD2 PHE 25 28.114 -11.052 -13.992 334 HE1 PHE 25 HE1 PHE 25 29.077 -12.366 -18.692 335 HE2 PHE 25 HE2 PHE 25 30.286 -10.454 -15.023 336 HZ PHE 25 HZ PHE 25 30.775 -11.110 -17.376 337 H TYR 26 H TYR 26 28.339 -14.651 -15.212 338 HA TYR 26 HA TYR 26 28.907 -16.060 -12.780 339 HB2 TYR 26 2HB TYR 26 29.952 -16.512 -14.972 340 HB3 TYR 26 3HB TYR 26 30.785 -14.960 -14.896 341 HD1 TYR 26 HD1 TYR 26 30.292 -18.101 -12.881 342 HD2 TYR 26 HD2 TYR 26 32.997 -14.927 -14.004 343 HE1 TYR 26 HE1 TYR 26 32.090 -19.166 -11.553 344 HE2 TYR 26 HE2 TYR 26 34.816 -16.031 -12.725 345 HH TYR 26 HH TYR 26 34.300 -19.067 -10.885 346 H THR 27 H THR 27 30.306 -15.620 -11.108 347 HA THR 27 HA THR 27 31.317 -12.847 -10.705 348 HB THR 27 HB THR 27 30.923 -13.174 -8.233 349 HG1 THR 27 HG1 THR 27 30.446 -15.432 -8.382 350 HG21 THR 27 1HG2 THR 27 29.527 -11.668 -9.628 351 HG22 THR 27 2HG2 THR 27 28.434 -13.022 -9.993 352 HG23 THR 27 3HG2 THR 27 28.596 -12.431 -8.327 353 HA PRO 28 HA PRO 28 34.903 -15.527 -10.249 354 HB2 PRO 28 2HB PRO 28 36.884 -13.743 -10.497 355 HB3 PRO 28 3HB PRO 28 35.732 -14.029 -11.828 356 HG2 PRO 28 2HG PRO 28 35.601 -11.817 -9.743 357 HG3 PRO 28 3HG PRO 28 35.551 -11.645 -11.529 358 HD2 PRO 28 2HD PRO 28 33.278 -11.793 -10.001 359 HD3 PRO 28 3HD PRO 28 33.366 -12.492 -11.647 360 H LYS 29 H LYS 29 33.580 -15.331 -7.981 361 HA LYS 29 HA LYS 29 35.579 -15.194 -5.834 362 HB2 LYS 29 2HB LYS 29 34.596 -12.834 -6.252 363 HB3 LYS 29 3HB LYS 29 33.093 -13.440 -5.596 364 HG2 LYS 29 2HG LYS 29 35.803 -13.350 -4.183 365 HG3 LYS 29 3HG LYS 29 34.529 -12.160 -4.002 366 HD2 LYS 29 2HD LYS 29 34.484 -15.041 -3.053 367 HD3 LYS 29 3HD LYS 29 34.583 -13.608 -2.062 368 HE2 LYS 29 2HE LYS 29 32.178 -14.352 -3.796 369 HE3 LYS 29 3HE LYS 29 32.329 -14.687 -2.072 370 HZ1 LYS 29 HZ1 LYS 29 32.313 -11.969 -3.267 371 HZ2 LYS 29 HZ2 LYS 29 31.081 -12.660 -2.446 372 HZ3 LYS 29 HZ3 LYS 29 32.469 -12.295 -1.670 373 H THR 30 H THR 30 35.279 -17.035 -4.750 374 HA THR 30 HA THR 30 32.916 -18.686 -4.977 375 HB THR 30 HB THR 30 34.162 -20.139 -3.312 376 HG1 THR 30 HG1 THR 30 35.395 -18.378 -2.457 377 HG21 THR 30 1HG2 THR 30 34.323 -20.483 -5.755 378 HG22 THR 30 2HG2 THR 30 35.661 -19.317 -5.842 379 HG23 THR 30 3HG2 THR 30 35.857 -20.838 -4.944 Start of MODEL 14 1 H1 GLY 1 1H GLY 1 3.394 -4.171 2.602 2 H2 GLY 1 2H GLY 1 3.560 -2.696 1.902 3 H3 GLY 1 3H GLY 1 4.501 -3.105 3.186 4 HA2 GLY 1 HA2 GLY 1 5.783 -3.236 1.151 5 HA3 GLY 1 HA3 GLY 1 5.598 -4.822 1.927 6 H ILE 2 H ILE 2 6.007 -5.771 -0.155 7 HA ILE 2 HA ILE 2 4.518 -5.205 -2.486 8 HB ILE 2 HB ILE 2 6.704 -6.279 -2.499 9 HG12 ILE 2 2HG1 ILE 2 6.387 -7.994 -4.203 10 HG13 ILE 2 3HG1 ILE 2 4.679 -8.106 -3.803 11 HG21 ILE 2 1HG2 ILE 2 6.486 -7.796 -0.547 12 HG22 ILE 2 2HG2 ILE 2 5.379 -8.824 -1.483 13 HG23 ILE 2 3HG2 ILE 2 7.063 -8.632 -1.987 14 HD11 ILE 2 3HD1 ILE 2 4.987 -6.856 -5.847 15 HD12 ILE 2 1HD1 ILE 2 4.355 -5.762 -4.617 16 HD13 ILE 2 2HD1 ILE 2 6.084 -5.721 -5.044 17 H VAL 3 H VAL 3 3.704 -7.554 0.052 18 HA VAL 3 HA VAL 3 1.625 -8.876 -1.430 19 HB VAL 3 HB VAL 3 1.896 -8.520 1.580 20 HG11 VAL 3 1HG1 VAL 3 -0.439 -9.109 1.054 21 HG12 VAL 3 2HG1 VAL 3 0.111 -10.427 -0.007 22 HG13 VAL 3 3HG1 VAL 3 0.384 -10.507 1.746 23 HG21 VAL 3 3HG2 VAL 3 2.614 -10.891 -0.200 24 HG22 VAL 3 1HG2 VAL 3 3.787 -9.777 0.538 25 HG23 VAL 3 2HG2 VAL 3 2.787 -10.812 1.563 26 H GLU 4 H GLU 4 1.549 -6.069 0.797 27 HA GLU 4 HA GLU 4 -1.248 -5.505 0.426 28 HB2 GLU 4 2HB GLU 4 1.003 -3.695 1.388 29 HB3 GLU 4 3HB GLU 4 -0.724 -3.418 1.570 30 HG2 GLU 4 2HG GLU 4 -0.045 -4.175 3.666 31 HG3 GLU 4 3HG GLU 4 -0.885 -5.536 2.930 32 H GLN 5 H GLN 5 1.246 -5.198 -1.821 33 HA GLN 5 HA GLN 5 -0.081 -2.933 -3.248 34 HB2 GLN 5 2HB GLN 5 2.433 -2.892 -2.853 35 HB3 GLN 5 3HB GLN 5 2.559 -4.313 -3.885 36 HG2 GLN 5 2HG GLN 5 3.047 -2.379 -5.218 37 HG3 GLN 5 3HG GLN 5 1.503 -3.019 -5.763 38 HE21 GLN 5 2HE2 GLN 5 2.810 -0.573 -3.384 39 HE22 GLN 5 1HE2 GLN 5 1.527 0.589 -3.700 40 H CYS 6 H CYS 6 1.207 -6.275 -3.913 41 HA CYS 6 HA CYS 6 -0.375 -6.250 -6.412 42 HB2 CYS 6 2HB CYS 6 2.156 -6.766 -6.111 43 HB3 CYS 6 3HB CYS 6 1.584 -8.373 -5.662 44 H CYS 7 H CYS 7 -0.549 -7.982 -3.345 45 HA CYS 7 HA CYS 7 -2.359 -9.999 -4.469 46 HB2 CYS 7 2HB CYS 7 -0.846 -10.406 -2.523 47 HB3 CYS 7 3HB CYS 7 -1.855 -9.320 -1.563 48 H THR 8 H THR 8 -2.796 -6.831 -3.089 49 HA THR 8 HA THR 8 -5.701 -7.136 -2.751 50 HB THR 8 HB THR 8 -4.215 -5.751 -1.257 51 HG1 THR 8 HG1 THR 8 -5.834 -4.191 -1.060 52 HG21 THR 8 1HG2 THR 8 -2.907 -4.630 -3.072 53 HG22 THR 8 2HG2 THR 8 -4.368 -3.736 -3.545 54 HG23 THR 8 3HG2 THR 8 -3.657 -3.485 -1.939 55 H SER 9 H SER 9 -3.532 -5.769 -5.221 56 HA SER 9 HA SER 9 -5.746 -5.525 -7.107 57 HB2 SER 9 2HB SER 9 -5.412 -3.194 -7.602 58 HB3 SER 9 3HB SER 9 -5.886 -3.413 -5.917 59 HG SER 9 HG SER 9 -4.167 -1.895 -6.162 60 H ILE 10 H ILE 10 -4.863 -4.618 -9.299 61 HA ILE 10 HA ILE 10 -2.891 -6.417 -10.293 62 HB ILE 10 HB ILE 10 -3.858 -3.753 -11.407 63 HG12 ILE 10 2HG1 ILE 10 -5.722 -5.377 -11.073 64 HG13 ILE 10 3HG1 ILE 10 -5.477 -4.842 -12.723 65 HG21 ILE 10 1HG2 ILE 10 -1.825 -4.323 -12.582 66 HG22 ILE 10 2HG2 ILE 10 -2.339 -6.010 -12.770 67 HG23 ILE 10 3HG2 ILE 10 -3.172 -4.711 -13.651 68 HD11 ILE 10 3HD1 ILE 10 -6.003 -7.260 -12.559 69 HD12 ILE 10 1HD1 ILE 10 -4.450 -6.961 -13.347 70 HD13 ILE 10 2HD1 ILE 10 -4.496 -7.509 -11.651 71 H CYS 11 H CYS 11 -0.676 -6.369 -10.382 72 HA CYS 11 HA CYS 11 0.617 -3.687 -10.319 73 HB2 CYS 11 2HB CYS 11 2.333 -4.244 -8.935 74 HB3 CYS 11 3HB CYS 11 0.939 -4.915 -8.112 75 H SER 12 H SER 12 2.681 -3.536 -11.264 76 HA SER 12 HA SER 12 3.036 -5.284 -13.684 77 HB2 SER 12 2HB SER 12 3.611 -2.332 -13.269 78 HB3 SER 12 3HB SER 12 3.884 -3.253 -14.757 79 HG SER 12 HG SER 12 1.810 -2.018 -14.541 80 H LEU 13 H LEU 13 5.189 -5.512 -14.564 81 HA LEU 13 HA LEU 13 6.963 -6.551 -12.635 82 HB2 LEU 13 2HB LEU 13 8.471 -6.878 -14.482 83 HB3 LEU 13 3HB LEU 13 6.864 -7.462 -14.846 84 HG LEU 13 HG LEU 13 7.910 -4.796 -15.891 85 HD11 LEU 13 1HD1 LEU 13 8.093 -7.541 -17.201 86 HD12 LEU 13 2HD1 LEU 13 8.537 -5.994 -17.956 87 HD13 LEU 13 3HD1 LEU 13 9.457 -6.592 -16.569 88 HD21 LEU 13 3HD2 LEU 13 6.297 -5.184 -17.746 89 HD22 LEU 13 1HD2 LEU 13 5.679 -6.607 -16.892 90 HD23 LEU 13 2HD2 LEU 13 5.494 -4.975 -16.200 91 H TYR 14 H TYR 14 7.033 -3.500 -14.367 92 HA TYR 14 HA TYR 14 9.628 -2.697 -13.628 93 HB2 TYR 14 2HB TYR 14 8.948 -0.538 -14.534 94 HB3 TYR 14 3HB TYR 14 8.427 -1.889 -15.558 95 HD1 TYR 14 HD2 TYR 14 7.167 0.554 -12.975 96 HD2 TYR 14 HD1 TYR 14 6.204 -2.021 -16.301 97 HE1 TYR 14 HE2 TYR 14 4.857 1.464 -13.010 98 HE2 TYR 14 HE1 TYR 14 3.912 -1.073 -16.372 99 HH TYR 14 HH TYR 14 2.421 0.412 -15.429 100 H GLN 15 H GLN 15 6.960 -2.862 -11.605 101 HA GLN 15 HA GLN 15 8.051 -0.771 -9.750 102 HB2 GLN 15 2HB GLN 15 5.714 -0.475 -8.905 103 HB3 GLN 15 3HB GLN 15 5.983 0.115 -10.551 104 HG2 GLN 15 2HG GLN 15 4.894 -1.832 -11.502 105 HG3 GLN 15 3HG GLN 15 4.743 -2.588 -9.902 106 HE21 GLN 15 2HE2 GLN 15 3.948 0.883 -10.157 107 HE22 GLN 15 1HE2 GLN 15 2.220 0.593 -10.079 108 H LEU 16 H LEU 16 6.627 -4.046 -10.117 109 HA LEU 16 HA LEU 16 6.817 -4.692 -7.336 110 HB2 LEU 16 2HB LEU 16 5.725 -6.516 -7.982 111 HB3 LEU 16 3HB LEU 16 5.593 -5.744 -9.524 112 HG LEU 16 HG LEU 16 7.891 -6.939 -10.039 113 HD11 LEU 16 1HD1 LEU 16 7.805 -9.254 -8.854 114 HD12 LEU 16 2HD1 LEU 16 8.423 -7.892 -7.920 115 HD13 LEU 16 3HD1 LEU 16 6.763 -8.477 -7.663 116 HD21 LEU 16 3HD2 LEU 16 6.760 -8.813 -10.996 117 HD22 LEU 16 1HD2 LEU 16 5.372 -8.641 -9.883 118 HD23 LEU 16 2HD2 LEU 16 5.664 -7.424 -11.138 119 H GLU 17 H GLU 17 9.125 -4.902 -9.998 120 HA GLU 17 HA GLU 17 11.377 -6.191 -8.948 121 HB2 GLU 17 2HB GLU 17 10.999 -3.713 -10.668 122 HB3 GLU 17 3HB GLU 17 12.608 -4.090 -10.068 123 HG2 GLU 17 2HG GLU 17 12.552 -6.297 -11.111 124 HG3 GLU 17 3HG GLU 17 10.946 -5.953 -11.776 125 H ASN 18 H ASN 18 10.144 -2.996 -8.173 126 HA ASN 18 HA ASN 18 12.401 -1.918 -6.839 127 HB2 ASN 18 2HB ASN 18 10.011 -1.000 -7.729 128 HB3 ASN 18 3HB ASN 18 9.646 -1.041 -6.013 129 HD21 ASN 18 1HD2 ASN 18 11.636 0.383 -8.555 130 HD22 ASN 18 2HD2 ASN 18 12.286 1.689 -7.584 131 H TYR 19 H TYR 19 10.113 -4.213 -5.709 132 HA TYR 19 HA TYR 19 10.606 -3.773 -2.824 133 HB2 TYR 19 2HB TYR 19 8.891 -5.774 -4.347 134 HB3 TYR 19 3HB TYR 19 8.979 -5.625 -2.604 135 HD1 TYR 19 HD2 TYR 19 7.944 -3.803 -5.720 136 HD2 TYR 19 HD1 TYR 19 7.724 -3.997 -1.411 137 HE1 TYR 19 HE2 TYR 19 6.157 -2.082 -5.729 138 HE2 TYR 19 HE1 TYR 19 5.891 -2.321 -1.425 139 HH TYR 19 HH TYR 19 4.794 -0.754 -4.470 140 H CYS 20 H CYS 20 12.235 -5.473 -5.285 141 HA CYS 20 HA CYS 20 12.838 -7.937 -3.892 142 HB2 CYS 20 2HB CYS 20 13.029 -7.551 -6.352 143 HB3 CYS 20 3HB CYS 20 14.428 -6.514 -6.057 144 H ASN 21 H ASN 21 14.316 -4.764 -3.787 145 HA ASN 21 HA ASN 21 16.741 -5.594 -2.360 146 HB2 ASN 21 2HB ASN 21 17.096 -3.071 -2.220 147 HB3 ASN 21 3HB ASN 21 17.095 -3.801 -3.820 148 HD21 ASN 21 2HD2 ASN 21 14.267 -2.873 -1.838 149 HD22 ASN 21 1HD2 ASN 21 13.607 -1.803 -3.086 150 H1 PHE 1 1H PHE 1 5.894 -10.700 -19.708 151 H2 PHE 1 2H PHE 1 5.513 -12.279 -19.516 152 H3 PHE 1 3H PHE 1 6.880 -11.681 -18.838 153 HA PHE 1 HA PHE 1 5.190 -12.004 -17.168 154 HB2 PHE 1 2HB PHE 1 6.874 -10.135 -16.983 155 HB3 PHE 1 3HB PHE 1 5.694 -9.043 -17.687 156 HD1 PHE 1 HD2 PHE 1 6.448 -11.230 -14.753 157 HD2 PHE 1 HD1 PHE 1 3.922 -8.087 -16.306 158 HE1 PHE 1 HE2 PHE 1 5.530 -10.837 -12.484 159 HE2 PHE 1 HE1 PHE 1 3.026 -7.695 -14.024 160 HZ PHE 1 HZ PHE 1 3.819 -9.068 -12.117 161 H VAL 2 H VAL 2 3.103 -11.230 -16.257 162 HA VAL 2 HA VAL 2 1.214 -9.978 -18.195 163 HB VAL 2 HB VAL 2 0.548 -12.423 -16.496 164 HG11 VAL 2 1HG1 VAL 2 -1.370 -10.872 -16.538 165 HG12 VAL 2 2HG1 VAL 2 -1.239 -10.728 -18.304 166 HG13 VAL 2 3HG1 VAL 2 -1.705 -12.271 -17.557 167 HG21 VAL 2 3HG2 VAL 2 0.632 -12.075 -19.524 168 HG22 VAL 2 1HG2 VAL 2 1.733 -13.072 -18.545 169 HG23 VAL 2 2HG2 VAL 2 0.028 -13.510 -18.666 170 H ASN 3 H ASN 3 0.416 -8.220 -17.316 171 HA ASN 3 HA ASN 3 0.800 -7.421 -14.590 172 HB2 ASN 3 2HB ASN 3 -1.172 -6.253 -16.595 173 HB3 ASN 3 3HB ASN 3 -0.432 -5.447 -15.216 174 HD21 ASN 3 1HD2 ASN 3 1.584 -4.370 -15.574 175 HD22 ASN 3 2HD2 ASN 3 2.440 -4.491 -17.101 176 H GLN 4 H GLN 4 -0.290 -8.326 -12.865 177 HA GLN 4 HA GLN 4 -3.173 -8.911 -13.017 178 HB2 GLN 4 2HB GLN 4 -2.972 -11.281 -12.777 179 HB3 GLN 4 3HB GLN 4 -2.041 -10.809 -14.185 180 HG2 GLN 4 2HG GLN 4 0.030 -10.807 -12.614 181 HG3 GLN 4 3HG GLN 4 -1.004 -11.603 -11.440 182 HE21 GLN 4 2HE2 GLN 4 1.190 -12.167 -13.919 183 HE22 GLN 4 1HE2 GLN 4 0.768 -13.851 -14.218 184 H HIS 5 H HIS 5 -3.730 -10.320 -10.988 185 HA HIS 5 HA HIS 5 -2.675 -9.020 -8.537 186 HB2 HIS 5 2HB HIS 5 -4.878 -11.090 -8.939 187 HB3 HIS 5 3HB HIS 5 -4.458 -10.304 -7.421 188 HD2 HIS 5 HD2 HIS 5 -6.043 -9.490 -10.868 189 HE1 HIS 5 HE1 HIS 5 -7.303 -6.483 -8.128 190 HE2 HIS 5 HE2 HIS 5 -7.622 -7.422 -10.483 191 H LEU 6 H LEU 6 -1.250 -10.049 -7.180 192 HA LEU 6 HA LEU 6 -0.580 -12.943 -7.617 193 HB2 LEU 6 2HB LEU 6 1.333 -10.600 -7.401 194 HB3 LEU 6 3HB LEU 6 1.822 -12.288 -7.360 195 HG LEU 6 HG LEU 6 0.480 -10.931 -9.744 196 HD11 LEU 6 1HD1 LEU 6 2.808 -11.099 -10.726 197 HD12 LEU 6 2HD1 LEU 6 2.644 -9.927 -9.407 198 HD13 LEU 6 3HD1 LEU 6 3.380 -11.503 -9.087 199 HD21 LEU 6 3HD2 LEU 6 0.132 -13.388 -9.725 200 HD22 LEU 6 1HD2 LEU 6 1.296 -12.931 -10.976 201 HD23 LEU 6 2HD2 LEU 6 1.870 -13.637 -9.454 202 H CYS 7 H CYS 7 -0.459 -14.085 -5.814 203 HA CYS 7 HA CYS 7 0.025 -12.776 -3.167 204 HB2 CYS 7 2HB CYS 7 -2.145 -14.800 -3.836 205 HB3 CYS 7 3HB CYS 7 -1.804 -14.169 -2.234 206 H GLY 8 H GLY 8 1.182 -14.068 -1.722 207 HA2 GLY 8 HA2 GLY 8 2.491 -15.808 -0.922 208 HA3 GLY 8 HA3 GLY 8 1.205 -16.829 -1.567 209 H SER 9 H SER 9 2.002 -18.452 -2.721 210 HA SER 9 HA SER 9 4.575 -18.746 -3.785 211 HB2 SER 9 2HB SER 9 2.006 -20.012 -4.809 212 HB3 SER 9 3HB SER 9 3.654 -20.632 -5.013 213 HG SER 9 HG SER 9 2.547 -21.664 -3.264 214 H HIS 10 H HIS 10 1.663 -17.403 -5.442 215 HA HIS 10 HA HIS 10 2.877 -17.261 -8.047 216 HB2 HIS 10 2HB HIS 10 0.336 -16.683 -6.873 217 HB3 HIS 10 3HB HIS 10 0.882 -15.176 -7.570 218 HD2 HIS 10 HD2 HIS 10 -1.156 -17.947 -8.527 219 HE1 HIS 10 HE1 HIS 10 0.758 -16.957 -12.199 220 HE2 HIS 10 HE2 HIS 10 -1.173 -18.242 -11.143 221 H LEU 11 H LEU 11 2.834 -15.088 -5.284 222 HA LEU 11 HA LEU 11 4.075 -12.839 -6.649 223 HB2 LEU 11 2HB LEU 11 2.478 -12.839 -4.624 224 HB3 LEU 11 3HB LEU 11 3.850 -13.359 -3.655 225 HG LEU 11 HG LEU 11 5.051 -11.241 -4.289 226 HD11 LEU 11 1HD1 LEU 11 2.351 -10.442 -5.451 227 HD12 LEU 11 2HD1 LEU 11 3.754 -9.391 -5.298 228 HD13 LEU 11 3HD1 LEU 11 3.812 -10.735 -6.433 229 HD21 LEU 11 3HD2 LEU 11 2.272 -10.945 -3.037 230 HD22 LEU 11 1HD2 LEU 11 3.767 -11.422 -2.191 231 HD23 LEU 11 2HD2 LEU 11 3.591 -9.788 -2.854 232 H VAL 12 H VAL 12 5.254 -15.393 -4.428 233 HA VAL 12 HA VAL 12 8.042 -14.703 -4.500 234 HB VAL 12 HB VAL 12 6.670 -17.402 -4.176 235 HG11 VAL 12 1HG1 VAL 12 8.808 -18.176 -3.139 236 HG12 VAL 12 2HG1 VAL 12 8.972 -17.864 -4.868 237 HG13 VAL 12 3HG1 VAL 12 9.595 -16.681 -3.693 238 HG21 VAL 12 3HG2 VAL 12 7.916 -15.514 -2.132 239 HG22 VAL 12 1HG2 VAL 12 6.178 -15.723 -2.409 240 HG23 VAL 12 2HG2 VAL 12 7.131 -17.074 -1.788 241 H GLU 13 H GLU 13 6.140 -16.845 -6.664 242 HA GLU 13 HA GLU 13 8.210 -17.468 -8.507 243 HB2 GLU 13 2HB GLU 13 5.198 -17.287 -8.693 244 HB3 GLU 13 3HB GLU 13 6.140 -17.417 -10.171 245 HG2 GLU 13 3HG GLU 13 7.250 -19.445 -9.341 246 HG3 GLU 13 2HG GLU 13 6.351 -19.341 -7.822 247 H ALA 14 H ALA 14 5.934 -14.616 -8.595 248 HA ALA 14 HA ALA 14 7.054 -13.482 -10.925 249 HB1 ALA 14 3HB ALA 14 4.933 -12.843 -9.901 250 HB2 ALA 14 1HB ALA 14 5.790 -12.101 -8.519 251 HB3 ALA 14 2HB ALA 14 5.973 -11.419 -10.147 252 H LEU 15 H LEU 15 8.006 -12.846 -7.488 253 HA LEU 15 HA LEU 15 10.105 -11.027 -8.052 254 HB2 LEU 15 2HB LEU 15 9.438 -12.867 -5.762 255 HB3 LEU 15 3HB LEU 15 11.074 -12.255 -5.846 256 HG LEU 15 HG LEU 15 9.801 -10.876 -4.382 257 HD11 LEU 15 1HD1 LEU 15 11.562 -9.795 -5.794 258 HD12 LEU 15 2HD1 LEU 15 10.288 -9.236 -6.902 259 HD13 LEU 15 3HD1 LEU 15 10.304 -8.687 -5.221 260 HD21 LEU 15 3HD2 LEU 15 7.878 -10.443 -6.692 261 HD22 LEU 15 1HD2 LEU 15 7.552 -11.136 -5.092 262 HD23 LEU 15 2HD2 LEU 15 7.934 -9.418 -5.243 263 H TYR 16 H TYR 16 10.188 -14.596 -8.182 264 HA TYR 16 HA TYR 16 13.010 -14.768 -8.757 265 HB2 TYR 16 2HB TYR 16 11.636 -16.718 -8.086 266 HB3 TYR 16 3HB TYR 16 10.756 -16.609 -9.613 267 HD1 TYR 16 HD2 TYR 16 14.117 -17.308 -8.152 268 HD2 TYR 16 HD1 TYR 16 11.664 -17.356 -11.698 269 HE1 TYR 16 HE2 TYR 16 15.899 -18.552 -9.371 270 HE2 TYR 16 HE1 TYR 16 13.433 -18.589 -12.919 271 HH TYR 16 HH TYR 16 15.540 -19.522 -12.810 272 H LEU 17 H LEU 17 10.138 -14.420 -10.926 273 HA LEU 17 HA LEU 17 11.675 -14.532 -13.356 274 HB2 LEU 17 2HB LEU 17 9.007 -13.124 -12.871 275 HB3 LEU 17 3HB LEU 17 9.697 -13.558 -14.426 276 HG LEU 17 HG LEU 17 8.808 -15.515 -12.312 277 HD11 LEU 17 1HD1 LEU 17 7.508 -14.734 -14.948 278 HD12 LEU 17 2HD1 LEU 17 6.931 -15.993 -13.832 279 HD13 LEU 17 3HD1 LEU 17 6.929 -14.296 -13.325 280 HD21 LEU 17 3HD2 LEU 17 9.757 -16.008 -15.169 281 HD22 LEU 17 1HD2 LEU 17 10.608 -16.495 -13.687 282 HD23 LEU 17 2HD2 LEU 17 9.057 -17.237 -14.093 283 H VAL 18 H VAL 18 10.457 -11.695 -11.523 284 HA VAL 18 HA VAL 18 11.659 -9.800 -13.361 285 HB VAL 18 HB VAL 18 11.387 -8.202 -11.270 286 HG11 VAL 18 1HG1 VAL 18 10.149 -7.973 -13.356 287 HG12 VAL 18 2HG1 VAL 18 8.965 -9.180 -12.790 288 HG13 VAL 18 3HG1 VAL 18 9.157 -7.625 -11.931 289 HG21 VAL 18 3HG2 VAL 18 9.983 -8.664 -9.620 290 HG22 VAL 18 1HG2 VAL 18 9.187 -9.987 -10.498 291 HG23 VAL 18 2HG2 VAL 18 10.820 -10.210 -9.807 292 H CYS 19 H CYS 19 12.773 -11.063 -10.173 293 HA CYS 19 HA CYS 19 15.217 -9.336 -10.425 294 HB2 CYS 19 2HB CYS 19 13.488 -8.979 -8.602 295 HB3 CYS 19 3HB CYS 19 13.965 -10.547 -7.947 296 H GLY 20 H GLY 20 14.212 -12.690 -9.768 297 HA2 GLY 20 HA2 GLY 20 16.840 -13.576 -8.858 298 HA3 GLY 20 HA3 GLY 20 15.449 -14.606 -9.273 299 H GLU 21 H GLU 21 14.949 -14.419 -11.765 300 HA GLU 21 HA GLU 21 17.229 -15.430 -13.254 301 HB2 GLU 21 2HB GLU 21 14.906 -16.285 -13.464 302 HB3 GLU 21 3HB GLU 21 14.391 -14.733 -14.136 303 HG2 GLU 21 2HG GLU 21 15.897 -15.051 -16.064 304 HG3 GLU 21 3HG GLU 21 16.526 -16.542 -15.352 305 H ARG 22 H ARG 22 15.334 -12.366 -13.225 306 HA ARG 22 HA ARG 22 15.600 -10.401 -14.132 307 HB2 ARG 22 2HB ARG 22 17.641 -11.047 -12.511 308 HB3 ARG 22 3HB ARG 22 18.599 -10.629 -13.932 309 HG2 ARG 22 2HG ARG 22 17.696 -8.388 -13.944 310 HG3 ARG 22 3HG ARG 22 16.362 -8.862 -12.883 311 HD2 ARG 22 2HD ARG 22 18.040 -7.497 -11.706 312 HD3 ARG 22 3HD ARG 22 17.750 -9.068 -10.978 313 HE ARG 22 HE ARG 22 20.171 -8.207 -12.491 314 HH11 ARG 22 1HH1 ARG 22 18.710 -10.707 -10.403 315 HH12 ARG 22 2HH1 ARG 22 20.252 -11.462 -10.125 316 HH21 ARG 22 1HH2 ARG 22 22.092 -9.233 -12.046 317 HH22 ARG 22 2HH2 ARG 22 22.128 -10.645 -11.035 318 H GLY 23 H GLY 23 15.342 -12.313 -16.177 319 HA2 GLY 23 HA2 GLY 23 15.024 -12.031 -18.481 320 HA3 GLY 23 HA3 GLY 23 16.174 -10.683 -18.491 321 H HIS 24 H HIS 24 16.466 -12.091 -20.573 322 HA HIS 24 HA HIS 24 18.046 -14.477 -20.434 323 HB2 HIS 24 2HB HIS 24 18.332 -14.185 -22.810 324 HB3 HIS 24 3HB HIS 24 16.667 -13.828 -22.368 325 HD2 HIS 24 HD2 HIS 24 15.850 -11.268 -22.575 326 HE1 HIS 24 HE1 HIS 24 19.289 -9.760 -24.582 327 HE2 HIS 24 HE2 HIS 24 16.895 -9.234 -23.887 328 H PHE 25 H PHE 25 18.935 -11.149 -20.142 329 HA PHE 25 HA PHE 25 21.681 -11.732 -19.419 330 HB2 PHE 25 2HB PHE 25 21.908 -11.667 -21.880 331 HB3 PHE 25 3HB PHE 25 21.101 -10.107 -21.931 332 HD1 PHE 25 HD2 PHE 25 24.091 -11.848 -20.458 333 HD2 PHE 25 HD1 PHE 25 22.395 -8.111 -21.789 334 HE1 PHE 25 HE2 PHE 25 26.279 -10.731 -20.119 335 HE2 PHE 25 HE1 PHE 25 24.591 -7.002 -21.466 336 HZ PHE 25 HZ PHE 25 26.537 -8.307 -20.626 337 H TYR 26 H TYR 26 22.390 -10.222 -17.978 338 HA TYR 26 HA TYR 26 20.616 -7.890 -17.397 339 HB2 TYR 26 2HB TYR 26 20.781 -9.643 -15.672 340 HB3 TYR 26 3HB TYR 26 22.531 -9.424 -15.615 341 HD1 TYR 26 HD1 TYR 26 19.387 -7.367 -15.421 342 HD2 TYR 26 HD2 TYR 26 23.372 -8.018 -13.904 343 HE1 TYR 26 HE1 TYR 26 19.052 -5.542 -13.768 344 HE2 TYR 26 HE2 TYR 26 23.010 -6.250 -12.196 345 HH TYR 26 HH TYR 26 21.561 -4.676 -11.340 346 H THR 27 H THR 27 21.434 -5.917 -16.944 347 HA THR 27 HA THR 27 24.340 -5.351 -17.343 348 HB THR 27 HB THR 27 23.638 -3.102 -18.242 349 HG1 THR 27 HG1 THR 27 21.421 -3.298 -17.626 350 HG21 THR 27 1HG2 THR 27 22.889 -5.537 -19.925 351 HG22 THR 27 2HG2 THR 27 23.320 -3.923 -20.526 352 HG23 THR 27 3HG2 THR 27 24.535 -4.906 -19.690 353 HA PRO 28 HA PRO 28 23.322 -3.850 -13.206 354 HB2 PRO 28 2HB PRO 28 25.812 -3.546 -12.182 355 HB3 PRO 28 3HB PRO 28 25.130 -5.158 -12.531 356 HG2 PRO 28 2HG PRO 28 26.980 -3.516 -14.290 357 HG3 PRO 28 3HG PRO 28 27.159 -5.232 -13.799 358 HD2 PRO 28 2HD PRO 28 26.038 -4.504 -16.182 359 HD3 PRO 28 3HD PRO 28 25.451 -5.928 -15.267 360 H LYS 29 H LYS 29 23.571 -1.890 -11.940 361 HA LYS 29 HA LYS 29 23.522 0.504 -13.542 362 HB2 LYS 29 2HB LYS 29 22.117 0.045 -11.547 363 HB3 LYS 29 3HB LYS 29 23.554 0.176 -10.512 364 HG2 LYS 29 2HG LYS 29 23.863 2.528 -11.322 365 HG3 LYS 29 3HG LYS 29 22.392 2.380 -12.284 366 HD2 LYS 29 2HD LYS 29 22.565 2.208 -9.233 367 HD3 LYS 29 3HD LYS 29 22.103 3.619 -10.172 368 HE2 LYS 29 2HE LYS 29 20.031 2.858 -9.602 369 HE3 LYS 29 3HE LYS 29 20.224 2.106 -11.185 370 HZ1 LYS 29 HZ1 LYS 29 20.684 0.776 -8.561 371 HZ2 LYS 29 HZ2 LYS 29 19.386 0.546 -9.521 372 HZ3 LYS 29 HZ3 LYS 29 20.857 0.043 -10.013 373 H THR 30 H THR 30 24.999 2.054 -13.899 374 HA THR 30 HA THR 30 27.820 1.587 -13.429 375 HB THR 30 HB THR 30 28.044 3.868 -14.521 376 HG1 THR 30 HG1 THR 30 25.908 4.546 -13.939 377 HG21 THR 30 1HG2 THR 30 26.439 1.749 -16.022 378 HG22 THR 30 2HG2 THR 30 27.419 3.042 -16.747 379 HG23 THR 30 3HG2 THR 30 28.202 1.763 -15.804 Start of MODEL 15 1 H1 GLY 1 1H GLY 1 4.388 -2.411 2.586 2 H2 GLY 1 2H GLY 1 3.033 -2.915 1.815 3 H3 GLY 1 3H GLY 1 4.203 -2.134 0.981 4 HA2 GLY 1 HA2 GLY 1 5.759 -3.942 1.344 5 HA3 GLY 1 HA3 GLY 1 4.488 -4.790 2.243 6 H ILE 2 H ILE 2 5.750 -5.961 0.045 7 HA ILE 2 HA ILE 2 4.618 -5.443 -2.484 8 HB ILE 2 HB ILE 2 6.732 -6.572 -2.130 9 HG12 ILE 2 2HG1 ILE 2 6.691 -8.311 -3.770 10 HG13 ILE 2 3HG1 ILE 2 4.950 -8.515 -3.617 11 HG21 ILE 2 1HG2 ILE 2 6.942 -8.906 -1.453 12 HG22 ILE 2 2HG2 ILE 2 6.196 -7.974 -0.159 13 HG23 ILE 2 3HG2 ILE 2 5.196 -9.029 -1.187 14 HD11 ILE 2 3HD1 ILE 2 4.620 -6.251 -4.613 15 HD12 ILE 2 1HD1 ILE 2 6.388 -6.095 -4.759 16 HD13 ILE 2 2HD1 ILE 2 5.522 -7.350 -5.660 17 H VAL 3 H VAL 3 3.393 -7.669 -0.014 18 HA VAL 3 HA VAL 3 1.350 -8.875 -1.625 19 HB VAL 3 HB VAL 3 1.385 -8.370 1.376 20 HG11 VAL 3 1HG1 VAL 3 -0.943 -8.828 0.647 21 HG12 VAL 3 2HG1 VAL 3 -0.385 -10.276 -0.223 22 HG13 VAL 3 3HG1 VAL 3 -0.285 -10.195 1.545 23 HG21 VAL 3 3HG2 VAL 3 3.252 -9.818 0.594 24 HG22 VAL 3 1HG2 VAL 3 2.076 -10.741 1.534 25 HG23 VAL 3 2HG2 VAL 3 2.084 -10.869 -0.236 26 H GLU 4 H GLU 4 1.329 -5.878 0.357 27 HA GLU 4 HA GLU 4 -1.411 -5.182 -0.324 28 HB2 GLU 4 2HB GLU 4 -0.248 -4.588 1.776 29 HB3 GLU 4 3HB GLU 4 0.826 -3.511 0.874 30 HG2 GLU 4 2HG GLU 4 -1.062 -2.054 0.315 31 HG3 GLU 4 3HG GLU 4 -2.205 -3.221 1.000 32 H GLN 5 H GLN 5 1.473 -5.085 -2.165 33 HA GLN 5 HA GLN 5 0.494 -2.863 -3.873 34 HB2 GLN 5 2HB GLN 5 2.944 -3.085 -3.218 35 HB3 GLN 5 3HB GLN 5 3.007 -4.539 -4.212 36 HG2 GLN 5 2HG GLN 5 3.842 -2.642 -5.489 37 HG3 GLN 5 3HG GLN 5 2.357 -3.223 -6.211 38 HE21 GLN 5 2HE2 GLN 5 2.017 -1.108 -7.272 39 HE22 GLN 5 1HE2 GLN 5 1.490 0.257 -6.294 40 H CYS 6 H CYS 6 1.062 -6.436 -4.064 41 HA CYS 6 HA CYS 6 -0.322 -6.367 -6.719 42 HB2 CYS 6 2HB CYS 6 2.224 -7.056 -6.259 43 HB3 CYS 6 3HB CYS 6 1.446 -8.623 -6.036 44 H CYS 7 H CYS 7 -0.666 -7.935 -3.604 45 HA CYS 7 HA CYS 7 -2.441 -10.020 -4.691 46 HB2 CYS 7 2HB CYS 7 -0.985 -10.408 -2.734 47 HB3 CYS 7 3HB CYS 7 -1.905 -9.219 -1.815 48 H THR 8 H THR 8 -2.906 -6.941 -3.012 49 HA THR 8 HA THR 8 -5.788 -7.203 -2.748 50 HB THR 8 HB THR 8 -4.214 -5.825 -1.292 51 HG1 THR 8 HG1 THR 8 -6.431 -5.545 -1.164 52 HG21 THR 8 1HG2 THR 8 -3.002 -4.705 -3.195 53 HG22 THR 8 2HG2 THR 8 -4.479 -3.779 -3.532 54 HG23 THR 8 3HG2 THR 8 -3.651 -3.583 -1.976 55 H SER 9 H SER 9 -3.691 -5.909 -5.236 56 HA SER 9 HA SER 9 -5.740 -5.654 -7.235 57 HB2 SER 9 2HB SER 9 -5.590 -3.281 -7.615 58 HB3 SER 9 3HB SER 9 -6.174 -3.571 -5.975 59 HG SER 9 HG SER 9 -4.560 -1.922 -6.057 60 H ILE 10 H ILE 10 -4.695 -4.683 -9.303 61 HA ILE 10 HA ILE 10 -2.461 -6.431 -9.752 62 HB ILE 10 HB ILE 10 -3.860 -4.451 -11.590 63 HG12 ILE 10 2HG1 ILE 10 -4.128 -7.413 -10.941 64 HG13 ILE 10 3HG1 ILE 10 -5.335 -6.141 -10.787 65 HG21 ILE 10 1HG2 ILE 10 -2.755 -5.755 -13.439 66 HG22 ILE 10 2HG2 ILE 10 -1.629 -4.808 -12.489 67 HG23 ILE 10 3HG2 ILE 10 -1.751 -6.551 -12.203 68 HD11 ILE 10 3HD1 ILE 10 -5.921 -7.551 -12.592 69 HD12 ILE 10 1HD1 ILE 10 -5.455 -5.966 -13.249 70 HD13 ILE 10 2HD1 ILE 10 -4.336 -7.360 -13.365 71 H CYS 11 H CYS 11 -0.341 -6.112 -9.727 72 HA CYS 11 HA CYS 11 0.757 -3.337 -9.705 73 HB2 CYS 11 2HB CYS 11 2.701 -4.162 -8.710 74 HB3 CYS 11 3HB CYS 11 1.365 -4.854 -7.816 75 H SER 12 H SER 12 2.927 -3.136 -10.773 76 HA SER 12 HA SER 12 3.117 -4.617 -13.377 77 HB2 SER 12 2HB SER 12 3.833 -1.719 -12.784 78 HB3 SER 12 3HB SER 12 4.169 -2.591 -14.280 79 HG SER 12 HG SER 12 1.628 -1.896 -13.191 80 H LEU 13 H LEU 13 5.208 -4.995 -14.195 81 HA LEU 13 HA LEU 13 6.907 -6.214 -12.316 82 HB2 LEU 13 2HB LEU 13 8.463 -6.458 -14.144 83 HB3 LEU 13 3HB LEU 13 6.845 -6.952 -14.591 84 HG LEU 13 HG LEU 13 8.062 -4.282 -15.424 85 HD11 LEU 13 1HD1 LEU 13 8.610 -5.346 -17.565 86 HD12 LEU 13 2HD1 LEU 13 9.456 -6.147 -16.233 87 HD13 LEU 13 3HD1 LEU 13 8.018 -6.908 -16.953 88 HD21 LEU 13 3HD2 LEU 13 6.430 -4.427 -17.314 89 HD22 LEU 13 1HD2 LEU 13 5.681 -5.825 -16.524 90 HD23 LEU 13 2HD2 LEU 13 5.653 -4.218 -15.755 91 H TYR 14 H TYR 14 7.184 -3.053 -13.851 92 HA TYR 14 HA TYR 14 9.807 -2.495 -12.996 93 HB2 TYR 14 2HB TYR 14 9.376 -0.271 -13.795 94 HB3 TYR 14 3HB TYR 14 8.634 -1.462 -14.884 95 HD1 TYR 14 HD1 TYR 14 7.915 1.080 -12.229 96 HD2 TYR 14 HD2 TYR 14 6.308 -1.363 -15.403 97 HE1 TYR 14 HE1 TYR 14 5.771 2.321 -12.091 98 HE2 TYR 14 HE2 TYR 14 4.165 -0.104 -15.280 99 HH TYR 14 HH TYR 14 3.643 2.573 -12.945 100 H GLN 15 H GLN 15 6.937 -2.442 -11.182 101 HA GLN 15 HA GLN 15 8.128 -0.635 -9.097 102 HB2 GLN 15 2HB GLN 15 5.826 -0.315 -8.242 103 HB3 GLN 15 3HB GLN 15 6.090 0.358 -9.853 104 HG2 GLN 15 2HG GLN 15 4.897 -1.455 -10.897 105 HG3 GLN 15 3HG GLN 15 4.803 -2.356 -9.367 106 HE21 GLN 15 1HE2 GLN 15 3.938 1.098 -10.211 107 HE22 GLN 15 2HE2 GLN 15 2.298 0.902 -9.619 108 H LEU 16 H LEU 16 6.828 -3.879 -9.794 109 HA LEU 16 HA LEU 16 6.944 -4.699 -7.025 110 HB2 LEU 16 2HB LEU 16 5.894 -6.520 -7.723 111 HB3 LEU 16 3HB LEU 16 5.641 -5.595 -9.176 112 HG LEU 16 HG LEU 16 7.783 -6.658 -10.063 113 HD11 LEU 16 1HD1 LEU 16 7.551 -8.079 -7.469 114 HD12 LEU 16 2HD1 LEU 16 7.825 -9.143 -8.855 115 HD13 LEU 16 3HD1 LEU 16 8.962 -7.839 -8.524 116 HD21 LEU 16 3HD2 LEU 16 5.455 -7.293 -10.784 117 HD22 LEU 16 1HD2 LEU 16 6.534 -8.695 -10.794 118 HD23 LEU 16 2HD2 LEU 16 5.386 -8.484 -9.463 119 H GLU 17 H GLU 17 9.265 -4.699 -9.694 120 HA GLU 17 HA GLU 17 11.443 -6.182 -8.648 121 HB2 GLU 17 2HB GLU 17 11.278 -3.624 -10.302 122 HB3 GLU 17 3HB GLU 17 12.839 -4.259 -9.773 123 HG2 GLU 17 2HG GLU 17 12.472 -6.357 -10.935 124 HG3 GLU 17 3HG GLU 17 10.852 -5.827 -11.393 125 H ASN 18 H ASN 18 10.275 -2.997 -7.902 126 HA ASN 18 HA ASN 18 12.544 -2.038 -6.401 127 HB2 ASN 18 2HB ASN 18 9.761 -1.114 -6.949 128 HB3 ASN 18 3HB ASN 18 10.480 -0.514 -5.486 129 HD21 ASN 18 2HD2 ASN 18 10.684 -0.510 -9.053 130 HD22 ASN 18 1HD2 ASN 18 11.815 0.813 -9.122 131 H TYR 19 H TYR 19 10.198 -4.380 -5.488 132 HA TYR 19 HA TYR 19 10.717 -4.054 -2.579 133 HB2 TYR 19 2HB TYR 19 8.992 -5.997 -4.161 134 HB3 TYR 19 3HB TYR 19 9.157 -5.970 -2.416 135 HD1 TYR 19 HD2 TYR 19 7.936 -4.009 -5.355 136 HD2 TYR 19 HD1 TYR 19 8.046 -4.333 -1.050 137 HE1 TYR 19 HE2 TYR 19 6.215 -2.217 -5.165 138 HE2 TYR 19 HE1 TYR 19 6.333 -2.534 -0.868 139 HH TYR 19 HH TYR 19 4.953 -0.902 -3.741 140 H CYS 20 H CYS 20 12.017 -5.795 -5.286 141 HA CYS 20 HA CYS 20 13.421 -7.838 -3.668 142 HB2 CYS 20 2HB CYS 20 12.727 -8.053 -6.138 143 HB3 CYS 20 3HB CYS 20 14.001 -6.889 -6.493 144 H ASN 21 H ASN 21 13.922 -4.604 -4.891 145 HA ASN 21 HA ASN 21 16.796 -4.420 -4.483 146 HB2 ASN 21 2HB ASN 21 14.588 -2.417 -5.106 147 HB3 ASN 21 3HB ASN 21 16.223 -1.900 -4.740 148 HD21 ASN 21 2HD2 ASN 21 14.393 -3.985 -7.070 149 HD22 ASN 21 1HD2 ASN 21 15.592 -3.752 -8.334 150 H1 PHE 1 1H PHE 1 7.396 -10.468 -18.297 151 H2 PHE 1 2H PHE 1 6.224 -9.769 -19.208 152 H3 PHE 1 3H PHE 1 6.264 -11.399 -19.038 153 HA PHE 1 HA PHE 1 5.713 -11.293 -16.745 154 HB2 PHE 1 2HB PHE 1 6.974 -9.215 -16.277 155 HB3 PHE 1 3HB PHE 1 5.778 -8.275 -17.153 156 HD1 PHE 1 HD1 PHE 1 6.166 -10.601 -14.212 157 HD2 PHE 1 HD2 PHE 1 3.941 -7.333 -15.958 158 HE1 PHE 1 HE1 PHE 1 4.902 -10.314 -12.096 159 HE2 PHE 1 HE2 PHE 1 2.736 -7.020 -13.813 160 HZ PHE 1 HZ PHE 1 3.198 -8.518 -11.889 161 H VAL 2 H VAL 2 3.468 -10.985 -15.933 162 HA VAL 2 HA VAL 2 1.492 -9.976 -17.935 163 HB VAL 2 HB VAL 2 1.168 -12.508 -16.270 164 HG11 VAL 2 1HG1 VAL 2 -0.971 -11.268 -16.310 165 HG12 VAL 2 2HG1 VAL 2 -0.845 -11.077 -18.072 166 HG13 VAL 2 3HG1 VAL 2 -1.076 -12.686 -17.352 167 HG21 VAL 2 3HG2 VAL 2 0.849 -13.625 -18.458 168 HG22 VAL 2 1HG2 VAL 2 1.217 -12.097 -19.288 169 HG23 VAL 2 2HG2 VAL 2 2.460 -12.916 -18.316 170 H ASN 3 H ASN 3 0.690 -8.205 -17.034 171 HA ASN 3 HA ASN 3 0.614 -7.643 -14.226 172 HB2 ASN 3 2HB ASN 3 -1.053 -6.384 -16.445 173 HB3 ASN 3 3HB ASN 3 -0.668 -5.707 -14.854 174 HD21 ASN 3 2HD2 ASN 3 1.136 -4.572 -14.528 175 HD22 ASN 3 1HD2 ASN 3 2.239 -4.228 -15.835 176 H GLN 4 H GLN 4 -0.600 -8.627 -12.770 177 HA GLN 4 HA GLN 4 -3.424 -9.264 -13.094 178 HB2 GLN 4 2HB GLN 4 -3.237 -11.656 -12.911 179 HB3 GLN 4 3HB GLN 4 -2.299 -11.140 -14.305 180 HG2 GLN 4 2HG GLN 4 -0.267 -11.129 -12.712 181 HG3 GLN 4 3HG GLN 4 -1.278 -11.995 -11.563 182 HE21 GLN 4 2HE2 GLN 4 1.058 -12.541 -13.828 183 HE22 GLN 4 1HE2 GLN 4 0.599 -14.176 -14.283 184 H HIS 5 H HIS 5 -3.906 -10.823 -11.082 185 HA HIS 5 HA HIS 5 -2.927 -9.404 -8.650 186 HB2 HIS 5 2HB HIS 5 -5.146 -11.447 -9.051 187 HB3 HIS 5 3HB HIS 5 -4.705 -10.703 -7.514 188 HD2 HIS 5 HD2 HIS 5 -6.230 -9.746 -10.953 189 HE1 HIS 5 HE1 HIS 5 -7.222 -6.646 -8.226 190 HE2 HIS 5 HE2 HIS 5 -7.658 -7.578 -10.557 191 H LEU 6 H LEU 6 -1.355 -10.248 -7.423 192 HA LEU 6 HA LEU 6 -0.592 -13.145 -7.701 193 HB2 LEU 6 2HB LEU 6 1.184 -10.679 -7.602 194 HB3 LEU 6 3HB LEU 6 1.769 -12.335 -7.482 195 HG LEU 6 HG LEU 6 0.355 -11.154 -9.918 196 HD11 LEU 6 1HD1 LEU 6 3.274 -11.709 -9.289 197 HD12 LEU 6 2HD1 LEU 6 2.663 -11.310 -10.915 198 HD13 LEU 6 3HD1 LEU 6 2.538 -10.130 -9.600 199 HD21 LEU 6 3HD2 LEU 6 1.748 -13.841 -9.483 200 HD22 LEU 6 1HD2 LEU 6 0.016 -13.598 -9.801 201 HD23 LEU 6 2HD2 LEU 6 1.202 -13.221 -11.051 202 H CYS 7 H CYS 7 -0.401 -14.223 -5.843 203 HA CYS 7 HA CYS 7 0.243 -12.812 -3.329 204 HB2 CYS 7 2HB CYS 7 -2.363 -13.017 -3.970 205 HB3 CYS 7 3HB CYS 7 -2.160 -14.609 -3.262 206 H GLY 8 H GLY 8 1.041 -14.165 -1.701 207 HA2 GLY 8 HA2 GLY 8 2.260 -15.954 -0.849 208 HA3 GLY 8 HA3 GLY 8 0.995 -16.955 -1.567 209 H SER 9 H SER 9 1.886 -18.572 -2.665 210 HA SER 9 HA SER 9 4.475 -18.798 -3.698 211 HB2 SER 9 3HB SER 9 1.953 -20.122 -4.765 212 HB3 SER 9 2HB SER 9 3.618 -20.700 -4.947 213 HG SER 9 HG SER 9 2.512 -21.768 -3.220 214 H HIS 10 H HIS 10 1.551 -17.531 -5.404 215 HA HIS 10 HA HIS 10 2.789 -17.381 -7.987 216 HB2 HIS 10 2HB HIS 10 0.234 -16.801 -6.826 217 HB3 HIS 10 3HB HIS 10 0.770 -15.317 -7.579 218 HD2 HIS 10 HD2 HIS 10 -1.272 -18.101 -8.446 219 HE1 HIS 10 HE1 HIS 10 0.677 -17.272 -12.139 220 HE2 HIS 10 HE2 HIS 10 -1.273 -18.497 -11.048 221 H LEU 11 H LEU 11 2.687 -15.153 -5.269 222 HA LEU 11 HA LEU 11 3.911 -12.899 -6.644 223 HB2 LEU 11 2HB LEU 11 2.335 -12.915 -4.614 224 HB3 LEU 11 3HB LEU 11 3.706 -13.441 -3.650 225 HG LEU 11 HG LEU 11 4.887 -11.312 -4.186 226 HD11 LEU 11 1HD1 LEU 11 2.273 -10.607 -5.588 227 HD12 LEU 11 2HD1 LEU 11 3.546 -9.445 -5.208 228 HD13 LEU 11 3HD1 LEU 11 3.866 -10.737 -6.373 229 HD21 LEU 11 3HD2 LEU 11 3.364 -9.874 -2.820 230 HD22 LEU 11 1HD2 LEU 11 2.037 -11.000 -3.108 231 HD23 LEU 11 2HD2 LEU 11 3.460 -11.517 -2.169 232 H VAL 12 H VAL 12 5.114 -15.405 -4.374 233 HA VAL 12 HA VAL 12 7.872 -14.669 -4.434 234 HB VAL 12 HB VAL 12 6.564 -17.395 -4.073 235 HG11 VAL 12 1HG1 VAL 12 8.706 -18.091 -2.988 236 HG12 VAL 12 2HG1 VAL 12 8.888 -17.816 -4.720 237 HG13 VAL 12 3HG1 VAL 12 9.463 -16.590 -3.565 238 HG21 VAL 12 3HG2 VAL 12 6.005 -15.688 -2.351 239 HG22 VAL 12 1HG2 VAL 12 6.984 -17.000 -1.687 240 HG23 VAL 12 2HG2 VAL 12 7.733 -15.428 -2.056 241 H GLU 13 H GLU 13 6.046 -16.898 -6.571 242 HA GLU 13 HA GLU 13 8.144 -17.593 -8.349 243 HB2 GLU 13 2HB GLU 13 5.131 -17.439 -8.588 244 HB3 GLU 13 3HB GLU 13 6.100 -17.684 -10.030 245 HG2 GLU 13 2HG GLU 13 7.186 -19.653 -9.019 246 HG3 GLU 13 3HG GLU 13 6.264 -19.422 -7.531 247 H ALA 14 H ALA 14 5.887 -14.723 -8.554 248 HA ALA 14 HA ALA 14 7.000 -13.764 -10.984 249 HB1 ALA 14 3HB ALA 14 4.854 -13.091 -10.046 250 HB2 ALA 14 1HB ALA 14 5.667 -12.278 -8.680 251 HB3 ALA 14 2HB ALA 14 5.887 -11.668 -10.336 252 H LEU 15 H LEU 15 7.842 -12.904 -7.569 253 HA LEU 15 HA LEU 15 9.927 -11.094 -8.147 254 HB2 LEU 15 2HB LEU 15 9.231 -12.889 -5.822 255 HB3 LEU 15 3HB LEU 15 10.860 -12.255 -5.872 256 HG LEU 15 HG LEU 15 9.482 -10.874 -4.477 257 HD11 LEU 15 1HD1 LEU 15 11.330 -9.832 -5.761 258 HD12 LEU 15 2HD1 LEU 15 10.170 -9.320 -7.007 259 HD13 LEU 15 3HD1 LEU 15 10.033 -8.694 -5.357 260 HD21 LEU 15 3HD2 LEU 15 7.708 -10.481 -6.911 261 HD22 LEU 15 1HD2 LEU 15 7.278 -11.131 -5.315 262 HD23 LEU 15 2HD2 LEU 15 7.683 -9.423 -5.490 263 H TYR 16 H TYR 16 10.135 -14.656 -8.015 264 HA TYR 16 HA TYR 16 12.953 -14.814 -8.531 265 HB2 TYR 16 2HB TYR 16 11.590 -16.737 -7.777 266 HB3 TYR 16 3HB TYR 16 10.712 -16.720 -9.307 267 HD1 TYR 16 HD1 TYR 16 14.032 -17.369 -7.752 268 HD2 TYR 16 HD2 TYR 16 11.653 -17.614 -11.342 269 HE1 TYR 16 HE1 TYR 16 15.795 -18.760 -8.828 270 HE2 TYR 16 HE2 TYR 16 13.406 -18.997 -12.418 271 HH TYR 16 HH TYR 16 15.531 -19.875 -12.227 272 H LEU 17 H LEU 17 10.161 -14.715 -10.820 273 HA LEU 17 HA LEU 17 11.808 -14.909 -13.175 274 HB2 LEU 17 2HB LEU 17 9.000 -13.774 -12.780 275 HB3 LEU 17 3HB LEU 17 9.753 -14.074 -14.336 276 HG LEU 17 HG LEU 17 9.166 -16.220 -12.288 277 HD11 LEU 17 1HD1 LEU 17 7.332 -16.876 -13.804 278 HD12 LEU 17 2HD1 LEU 17 7.107 -15.226 -13.203 279 HD13 LEU 17 3HD1 LEU 17 7.700 -15.491 -14.859 280 HD21 LEU 17 3HD2 LEU 17 11.035 -16.891 -13.736 281 HD22 LEU 17 1HD2 LEU 17 9.584 -17.791 -14.186 282 HD23 LEU 17 2HD2 LEU 17 10.114 -16.417 -15.182 283 H VAL 18 H VAL 18 10.464 -12.032 -11.493 284 HA VAL 18 HA VAL 18 11.521 -10.238 -13.525 285 HB VAL 18 HB VAL 18 11.161 -8.842 -10.958 286 HG11 VAL 18 1HG1 VAL 18 11.249 -7.705 -13.115 287 HG12 VAL 18 2HG1 VAL 18 9.764 -8.543 -13.633 288 HG13 VAL 18 3HG1 VAL 18 9.727 -7.399 -12.266 289 HG21 VAL 18 3HG2 VAL 18 8.840 -10.502 -11.894 290 HG22 VAL 18 1HG2 VAL 18 9.585 -10.288 -10.261 291 HG23 VAL 18 2HG2 VAL 18 8.691 -8.972 -11.000 292 H CYS 19 H CYS 19 12.677 -11.220 -10.269 293 HA CYS 19 HA CYS 19 14.971 -9.354 -10.593 294 HB2 CYS 19 2HB CYS 19 13.336 -9.164 -8.691 295 HB3 CYS 19 3HB CYS 19 13.916 -10.724 -8.103 296 H GLY 20 H GLY 20 14.310 -12.767 -9.744 297 HA2 GLY 20 HA2 GLY 20 17.080 -13.324 -8.973 298 HA3 GLY 20 HA3 GLY 20 15.737 -14.487 -9.072 299 H GLU 21 H GLU 21 14.983 -14.818 -11.429 300 HA GLU 21 HA GLU 21 17.142 -15.812 -13.100 301 HB2 GLU 21 2HB GLU 21 14.847 -16.821 -12.752 302 HB3 GLU 21 3HB GLU 21 14.168 -15.472 -13.651 303 HG2 GLU 21 2HG GLU 21 14.306 -17.281 -15.143 304 HG3 GLU 21 3HG GLU 21 15.589 -16.188 -15.629 305 H ARG 22 H ARG 22 15.121 -12.884 -12.938 306 HA ARG 22 HA ARG 22 14.839 -11.081 -14.176 307 HB2 ARG 22 2HB ARG 22 17.590 -11.436 -13.866 308 HB3 ARG 22 3HB ARG 22 17.454 -11.070 -15.579 309 HG2 ARG 22 2HG ARG 22 16.258 -9.463 -13.283 310 HG3 ARG 22 3HG ARG 22 17.801 -9.102 -14.070 311 HD2 ARG 22 2HD ARG 22 16.600 -8.791 -16.244 312 HD3 ARG 22 3HD ARG 22 15.064 -9.017 -15.411 313 HE ARG 22 HE ARG 22 17.002 -6.769 -15.022 314 HH11 ARG 22 1HH2 ARG 22 13.721 -7.966 -14.383 315 HH12 ARG 22 2HH2 ARG 22 13.119 -6.340 -14.105 316 HH21 ARG 22 1HH1 ARG 22 16.174 -4.786 -14.349 317 HH22 ARG 22 2HH1 ARG 22 14.525 -4.701 -13.772 318 H GLY 23 H GLY 23 14.105 -13.648 -15.358 319 HA2 GLY 23 HA2 GLY 23 14.202 -13.139 -18.311 320 HA3 GLY 23 HA3 GLY 23 14.270 -14.751 -17.552 321 H HIS 24 H HIS 24 12.119 -12.161 -16.560 322 HA HIS 24 HA HIS 24 9.784 -13.755 -16.579 323 HB2 HIS 24 2HB HIS 24 8.615 -11.695 -16.037 324 HB3 HIS 24 3HB HIS 24 10.146 -11.751 -15.175 325 HD2 HIS 24 HD2 HIS 24 12.005 -9.977 -15.809 326 HE1 HIS 24 HE1 HIS 24 9.836 -7.830 -18.777 327 HE2 HIS 24 HE2 HIS 24 11.956 -7.845 -17.368 328 H PHE 25 H PHE 25 11.242 -12.293 -19.318 329 HA PHE 25 HA PHE 25 8.776 -12.325 -20.973 330 HB2 PHE 25 2HB PHE 25 10.390 -10.514 -21.310 331 HB3 PHE 25 3HB PHE 25 11.670 -11.677 -21.638 332 HD1 PHE 25 HD2 PHE 25 8.341 -10.458 -22.860 333 HD2 PHE 25 HD1 PHE 25 11.968 -12.572 -23.851 334 HE1 PHE 25 HE2 PHE 25 7.660 -10.512 -25.243 335 HE2 PHE 25 HE1 PHE 25 11.290 -12.611 -26.238 336 HZ PHE 25 HZ PHE 25 9.134 -11.586 -26.939 337 H TYR 26 H TYR 26 8.069 -14.323 -21.436 338 HA TYR 26 HA TYR 26 9.912 -16.572 -21.883 339 HB2 TYR 26 2HB TYR 26 7.588 -16.565 -20.685 340 HB3 TYR 26 3HB TYR 26 6.923 -16.636 -22.310 341 HD1 TYR 26 HD1 TYR 26 9.345 -18.278 -19.978 342 HD2 TYR 26 HD2 TYR 26 6.782 -18.808 -23.415 343 HE1 TYR 26 HE1 TYR 26 9.678 -20.737 -19.849 344 HE2 TYR 26 HE2 TYR 26 7.034 -21.263 -23.223 345 HH TYR 26 HH TYR 26 8.012 -23.009 -22.080 346 H THR 27 H THR 27 10.161 -17.684 -23.823 347 HA THR 27 HA THR 27 8.977 -16.694 -26.310 348 HB THR 27 HB THR 27 10.764 -15.087 -25.743 349 HG1 THR 27 HG1 THR 27 10.122 -15.378 -27.876 350 HG21 THR 27 1HG2 THR 27 12.459 -16.584 -24.772 351 HG22 THR 27 2HG2 THR 27 12.692 -17.354 -26.364 352 HG23 THR 27 3HG2 THR 27 13.100 -15.645 -26.126 353 HA PRO 28 HA PRO 28 9.699 -19.440 -23.840 354 HB2 PRO 28 2HB PRO 28 11.014 -21.768 -23.399 355 HB3 PRO 28 3HB PRO 28 9.396 -21.708 -24.162 356 HG2 PRO 28 2HG PRO 28 12.073 -21.822 -25.577 357 HG3 PRO 28 3HG PRO 28 10.660 -22.918 -25.787 358 HD2 PRO 28 2HD PRO 28 10.952 -20.842 -27.453 359 HD3 PRO 28 3HD PRO 28 9.337 -21.165 -26.739 360 H LYS 29 H LYS 29 11.030 -19.273 -21.992 361 HA LYS 29 HA LYS 29 13.670 -18.054 -22.427 362 HB2 LYS 29 2HB LYS 29 12.046 -17.139 -20.775 363 HB3 LYS 29 3HB LYS 29 12.091 -18.655 -19.890 364 HG2 LYS 29 2HG LYS 29 13.459 -16.975 -18.787 365 HG3 LYS 29 3HG LYS 29 14.446 -18.325 -19.315 366 HD2 LYS 29 2HD LYS 29 15.563 -16.159 -19.647 367 HD3 LYS 29 3HD LYS 29 15.353 -17.014 -21.174 368 HE2 LYS 29 2HE LYS 29 13.369 -15.605 -21.701 369 HE3 LYS 29 3HE LYS 29 13.528 -14.783 -20.152 370 HZ1 LYS 29 HZ1 LYS 29 15.548 -14.730 -22.334 371 HZ2 LYS 29 HZ2 LYS 29 14.541 -13.505 -21.947 372 HZ3 LYS 29 HZ3 LYS 29 15.711 -13.963 -20.900 373 H THR 30 H THR 30 15.533 -19.118 -22.400 374 HA THR 30 HA THR 30 16.184 -21.450 -20.833 375 HB THR 30 HB THR 30 14.779 -22.543 -22.498 376 HG1 THR 30 HG1 THR 30 16.284 -24.089 -23.046 377 HG21 THR 30 1HG2 THR 30 15.124 -21.036 -24.453 378 HG22 THR 30 2HG2 THR 30 16.781 -21.661 -24.617 379 HG23 THR 30 3HG2 THR 30 15.391 -22.742 -24.832 Start of MODEL 16 1 H1 GLY 1 1H GLY 1 3.682 -2.666 2.301 2 H2 GLY 1 2H GLY 1 4.664 -1.847 1.269 3 H3 GLY 1 3H GLY 1 5.164 -2.191 2.793 4 HA2 GLY 1 HA2 GLY 1 6.281 -3.682 1.347 5 HA3 GLY 1 HA3 GLY 1 5.095 -4.575 2.313 6 H ILE 2 H ILE 2 5.983 -5.744 0.085 7 HA ILE 2 HA ILE 2 4.659 -5.106 -2.355 8 HB ILE 2 HB ILE 2 6.795 -6.290 -2.175 9 HG12 ILE 2 2HG1 ILE 2 6.536 -8.037 -3.853 10 HG13 ILE 2 3HG1 ILE 2 4.775 -8.002 -3.654 11 HG21 ILE 2 1HG2 ILE 2 7.018 -8.625 -1.601 12 HG22 ILE 2 2HG2 ILE 2 6.317 -7.771 -0.228 13 HG23 ILE 2 3HG2 ILE 2 5.287 -8.774 -1.277 14 HD11 ILE 2 3HD1 ILE 2 4.821 -5.623 -4.507 15 HD12 ILE 2 1HD1 ILE 2 6.578 -5.814 -4.739 16 HD13 ILE 2 2HD1 ILE 2 5.468 -6.816 -5.653 17 H VAL 3 H VAL 3 3.709 -7.477 0.117 18 HA VAL 3 HA VAL 3 1.665 -8.759 -1.397 19 HB VAL 3 HB VAL 3 1.975 -8.454 1.612 20 HG11 VAL 3 1HG1 VAL 3 -0.406 -8.992 1.177 21 HG12 VAL 3 2HG1 VAL 3 0.089 -10.337 0.121 22 HG13 VAL 3 3HG1 VAL 3 0.436 -10.383 1.859 23 HG21 VAL 3 3HG2 VAL 3 2.528 -10.804 -0.255 24 HG22 VAL 3 1HG2 VAL 3 3.772 -9.744 0.446 25 HG23 VAL 3 2HG2 VAL 3 2.797 -10.776 1.498 26 H GLU 4 H GLU 4 1.415 -5.943 0.829 27 HA GLU 4 HA GLU 4 -1.432 -5.595 0.336 28 HB2 GLU 4 2HB GLU 4 -1.257 -3.632 1.716 29 HB3 GLU 4 3HB GLU 4 -0.376 -4.965 2.466 30 HG2 GLU 4 2HG GLU 4 1.751 -4.043 1.565 31 HG3 GLU 4 3HG GLU 4 0.874 -2.657 0.903 32 H GLN 5 H GLN 5 1.009 -5.151 -1.838 33 HA GLN 5 HA GLN 5 -0.720 -3.203 -3.304 34 HB2 GLN 5 2HB GLN 5 2.034 -3.117 -3.145 35 HB3 GLN 5 3HB GLN 5 1.830 -4.108 -4.578 36 HG2 GLN 5 2HG GLN 5 0.760 -1.301 -4.072 37 HG3 GLN 5 3HG GLN 5 2.005 -1.776 -5.219 38 HE21 GLN 5 2HE2 GLN 5 1.328 -2.594 -7.341 39 HE22 GLN 5 1HE2 GLN 5 -0.364 -2.741 -7.762 40 H CYS 6 H CYS 6 1.166 -6.258 -3.908 41 HA CYS 6 HA CYS 6 -0.381 -6.701 -6.279 42 HB2 CYS 6 2HB CYS 6 1.490 -8.610 -4.876 43 HB3 CYS 6 3HB CYS 6 1.015 -8.616 -6.579 44 H CYS 7 H CYS 7 -0.604 -8.254 -3.098 45 HA CYS 7 HA CYS 7 -2.414 -10.330 -3.993 46 HB2 CYS 7 2HB CYS 7 -0.913 -10.322 -1.939 47 HB3 CYS 7 3HB CYS 7 -2.092 -9.254 -1.175 48 H THR 8 H THR 8 -2.925 -7.015 -3.243 49 HA THR 8 HA THR 8 -5.876 -7.373 -2.968 50 HB THR 8 HB THR 8 -4.617 -6.246 -1.142 51 HG1 THR 8 HG1 THR 8 -6.167 -4.616 -0.981 52 HG21 THR 8 1HG2 THR 8 -4.194 -4.018 -3.169 53 HG22 THR 8 2HG2 THR 8 -3.930 -3.916 -1.417 54 HG23 THR 8 3HG2 THR 8 -2.947 -5.022 -2.388 55 H SER 9 H SER 9 -3.429 -5.810 -5.031 56 HA SER 9 HA SER 9 -5.522 -5.120 -7.021 57 HB2 SER 9 2HB SER 9 -3.563 -3.241 -5.715 58 HB3 SER 9 3HB SER 9 -4.288 -2.921 -7.305 59 HG SER 9 HG SER 9 -5.785 -3.410 -4.928 60 H ILE 10 H ILE 10 -4.403 -4.251 -9.112 61 HA ILE 10 HA ILE 10 -2.694 -6.296 -10.168 62 HB ILE 10 HB ILE 10 -3.324 -3.494 -11.177 63 HG12 ILE 10 2HG1 ILE 10 -5.295 -5.042 -11.040 64 HG13 ILE 10 3HG1 ILE 10 -4.937 -4.416 -12.638 65 HG21 ILE 10 1HG2 ILE 10 -2.575 -4.365 -13.438 66 HG22 ILE 10 2HG2 ILE 10 -1.272 -4.119 -12.277 67 HG23 ILE 10 3HG2 ILE 10 -1.866 -5.761 -12.596 68 HD11 ILE 10 3HD1 ILE 10 -3.956 -6.549 -13.337 69 HD12 ILE 10 1HD1 ILE 10 -4.157 -7.199 -11.691 70 HD13 ILE 10 2HD1 ILE 10 -5.577 -6.810 -12.679 71 H CYS 11 H CYS 11 -0.582 -6.581 -10.200 72 HA CYS 11 HA CYS 11 1.278 -4.289 -9.678 73 HB2 CYS 11 2HB CYS 11 1.379 -7.193 -8.892 74 HB3 CYS 11 3HB CYS 11 2.891 -6.369 -9.278 75 H SER 12 H SER 12 3.168 -4.191 -10.889 76 HA SER 12 HA SER 12 3.298 -5.626 -13.494 77 HB2 SER 12 2HB SER 12 3.513 -2.623 -13.048 78 HB3 SER 12 3HB SER 12 3.719 -3.489 -14.573 79 HG SER 12 HG SER 12 1.597 -2.514 -14.276 80 H LEU 13 H LEU 13 5.416 -5.600 -14.456 81 HA LEU 13 HA LEU 13 7.354 -6.361 -12.560 82 HB2 LEU 13 2HB LEU 13 8.856 -6.535 -14.432 83 HB3 LEU 13 3HB LEU 13 7.323 -7.308 -14.774 84 HG LEU 13 HG LEU 13 8.037 -4.538 -15.814 85 HD11 LEU 13 1HD1 LEU 13 9.793 -6.120 -16.506 86 HD12 LEU 13 2HD1 LEU 13 8.557 -7.229 -17.143 87 HD13 LEU 13 3HD1 LEU 13 8.805 -5.634 -17.890 88 HD21 LEU 13 3HD2 LEU 13 6.475 -5.107 -17.668 89 HD22 LEU 13 1HD2 LEU 13 6.045 -6.605 -16.825 90 HD23 LEU 13 2HD2 LEU 13 5.660 -5.016 -16.116 91 H TYR 14 H TYR 14 6.938 -3.330 -14.251 92 HA TYR 14 HA TYR 14 9.445 -2.178 -13.618 93 HB2 TYR 14 2HB TYR 14 8.458 -0.139 -14.472 94 HB3 TYR 14 3HB TYR 14 8.047 -1.533 -15.493 95 HD1 TYR 14 HD1 TYR 14 6.666 0.771 -12.858 96 HD2 TYR 14 HD2 TYR 14 5.804 -1.970 -16.079 97 HE1 TYR 14 HE1 TYR 14 4.277 1.411 -12.753 98 HE2 TYR 14 HE2 TYR 14 3.413 -1.291 -16.008 99 HH TYR 14 HH TYR 14 2.169 1.118 -13.658 100 H GLN 15 H GLN 15 6.862 -2.740 -11.519 101 HA GLN 15 HA GLN 15 7.830 -0.604 -9.645 102 HB2 GLN 15 2HB GLN 15 5.578 -0.520 -8.655 103 HB3 GLN 15 3HB GLN 15 5.620 0.084 -10.310 104 HG2 GLN 15 2HG GLN 15 4.495 -1.834 -11.164 105 HG3 GLN 15 3HG GLN 15 4.774 -2.769 -9.687 106 HE21 GLN 15 2HE2 GLN 15 3.048 0.272 -10.707 107 HE22 GLN 15 1HE2 GLN 15 1.728 -0.014 -9.586 108 H LEU 16 H LEU 16 6.749 -3.995 -10.060 109 HA LEU 16 HA LEU 16 6.936 -4.582 -7.272 110 HB2 LEU 16 2HB LEU 16 5.913 -6.463 -7.885 111 HB3 LEU 16 3HB LEU 16 5.707 -5.674 -9.409 112 HG LEU 16 HG LEU 16 8.052 -6.776 -9.996 113 HD11 LEU 16 1HD1 LEU 16 7.031 -8.328 -7.591 114 HD12 LEU 16 2HD1 LEU 16 7.981 -9.138 -8.831 115 HD13 LEU 16 3HD1 LEU 16 8.680 -7.772 -7.959 116 HD21 LEU 16 3HD2 LEU 16 5.873 -7.298 -11.114 117 HD22 LEU 16 1HD2 LEU 16 6.957 -8.689 -10.947 118 HD23 LEU 16 2HD2 LEU 16 5.553 -8.510 -9.854 119 H GLU 17 H GLU 17 9.320 -4.686 -9.881 120 HA GLU 17 HA GLU 17 11.506 -5.981 -8.635 121 HB2 GLU 17 2HB GLU 17 11.330 -3.617 -10.552 122 HB3 GLU 17 3HB GLU 17 12.883 -4.137 -9.892 123 HG2 GLU 17 2HG GLU 17 12.421 -6.444 -10.691 124 HG3 GLU 17 3HG GLU 17 11.034 -5.810 -11.603 125 H ASN 18 H ASN 18 10.096 -2.852 -7.909 126 HA ASN 18 HA ASN 18 12.316 -1.617 -6.617 127 HB2 ASN 18 2HB ASN 18 9.334 -1.231 -6.221 128 HB3 ASN 18 3HB ASN 18 10.552 -0.208 -5.590 129 HD21 ASN 18 2HD2 ASN 18 8.730 1.009 -7.186 130 HD22 ASN 18 1HD2 ASN 18 9.521 1.444 -8.699 131 H TYR 19 H TYR 19 10.120 -4.105 -5.552 132 HA TYR 19 HA TYR 19 10.769 -3.847 -2.688 133 HB2 TYR 19 2HB TYR 19 8.999 -5.770 -4.244 134 HB3 TYR 19 3HB TYR 19 9.109 -5.632 -2.500 135 HD1 TYR 19 HD1 TYR 19 8.071 -3.737 -5.613 136 HD2 TYR 19 HD2 TYR 19 7.831 -4.019 -1.301 137 HE1 TYR 19 HE1 TYR 19 6.298 -2.019 -5.593 138 HE2 TYR 19 HE2 TYR 19 5.986 -2.355 -1.304 139 HH TYR 19 HH TYR 19 4.663 -0.961 -2.575 140 H CYS 20 H CYS 20 12.095 -5.447 -5.422 141 HA CYS 20 HA CYS 20 13.463 -7.575 -3.850 142 HB2 CYS 20 2HB CYS 20 12.791 -7.788 -6.322 143 HB3 CYS 20 3HB CYS 20 14.065 -6.616 -6.667 144 H ASN 21 H ASN 21 13.918 -4.291 -4.923 145 HA ASN 21 HA ASN 21 16.806 -4.119 -4.530 146 HB2 ASN 21 2HB ASN 21 14.596 -2.110 -5.126 147 HB3 ASN 21 3HB ASN 21 16.222 -1.593 -4.720 148 HD21 ASN 21 2HD2 ASN 21 14.420 -3.586 -7.142 149 HD22 ASN 21 1HD2 ASN 21 15.640 -3.323 -8.379 150 H1 PHE 1 1H PHE 1 6.321 -10.825 -19.771 151 H2 PHE 1 2H PHE 1 5.985 -12.415 -19.599 152 H3 PHE 1 3H PHE 1 7.395 -11.813 -19.021 153 HA PHE 1 HA PHE 1 5.870 -12.219 -17.223 154 HB2 PHE 1 2HB PHE 1 7.526 -10.289 -17.175 155 HB3 PHE 1 3HB PHE 1 6.214 -9.222 -17.656 156 HD1 PHE 1 HD1 PHE 1 7.298 -11.670 -15.020 157 HD2 PHE 1 HD2 PHE 1 4.734 -8.323 -15.972 158 HE1 PHE 1 HE1 PHE 1 6.573 -11.539 -12.651 159 HE2 PHE 1 HE2 PHE 1 4.028 -8.198 -13.601 160 HZ PHE 1 HZ PHE 1 4.909 -9.829 -11.949 161 H VAL 2 H VAL 2 3.902 -11.126 -16.044 162 HA VAL 2 HA VAL 2 1.810 -10.148 -17.886 163 HB VAL 2 HB VAL 2 1.294 -12.464 -17.896 164 HG11 VAL 2 1HG1 VAL 2 2.486 -13.284 -15.911 165 HG12 VAL 2 2HG1 VAL 2 1.271 -12.537 -14.855 166 HG13 VAL 2 3HG1 VAL 2 0.815 -13.847 -15.957 167 HG21 VAL 2 3HG2 VAL 2 -0.597 -10.877 -17.726 168 HG22 VAL 2 1HG2 VAL 2 -0.978 -12.476 -17.064 169 HG23 VAL 2 2HG2 VAL 2 -0.638 -11.126 -15.967 170 H ASN 3 H ASN 3 0.960 -8.377 -17.095 171 HA ASN 3 HA ASN 3 1.351 -7.602 -14.290 172 HB2 ASN 3 2HB ASN 3 -0.161 -6.235 -16.547 173 HB3 ASN 3 3HB ASN 3 0.143 -5.546 -14.958 174 HD21 ASN 3 1HD2 ASN 3 0.943 -4.264 -17.352 175 HD22 ASN 3 2HD2 ASN 3 2.697 -4.259 -17.406 176 H GLN 4 H GLN 4 -0.025 -8.201 -12.695 177 HA GLN 4 HA GLN 4 -2.876 -8.505 -13.012 178 HB2 GLN 4 2HB GLN 4 -3.066 -10.913 -12.717 179 HB3 GLN 4 3HB GLN 4 -2.286 -10.530 -14.234 180 HG2 GLN 4 2HG GLN 4 -0.134 -11.178 -13.401 181 HG3 GLN 4 3HG GLN 4 -0.700 -11.236 -11.736 182 HE21 GLN 4 1HE2 GLN 4 -1.893 -13.061 -10.973 183 HE22 GLN 4 2HE2 GLN 4 -2.058 -14.510 -11.964 184 H HIS 5 H HIS 5 -3.642 -10.005 -11.063 185 HA HIS 5 HA HIS 5 -2.579 -8.899 -8.526 186 HB2 HIS 5 2HB HIS 5 -4.850 -10.848 -9.108 187 HB3 HIS 5 3HB HIS 5 -4.436 -10.188 -7.527 188 HD2 HIS 5 HD2 HIS 5 -5.874 -9.041 -10.951 189 HE1 HIS 5 HE1 HIS 5 -6.970 -6.111 -8.069 190 HE2 HIS 5 HE2 HIS 5 -7.285 -6.877 -10.482 191 H LEU 6 H LEU 6 -1.389 -10.101 -7.058 192 HA LEU 6 HA LEU 6 -0.596 -12.912 -7.689 193 HB2 LEU 6 2HB LEU 6 1.303 -10.560 -7.389 194 HB3 LEU 6 3HB LEU 6 1.800 -12.243 -7.426 195 HG LEU 6 HG LEU 6 0.429 -10.819 -9.750 196 HD11 LEU 6 1HD1 LEU 6 3.342 -11.276 -9.079 197 HD12 LEU 6 2HD1 LEU 6 2.769 -10.823 -10.707 198 HD13 LEU 6 3HD1 LEU 6 2.522 -9.726 -9.333 199 HD21 LEU 6 3HD2 LEU 6 0.207 -13.311 -9.783 200 HD22 LEU 6 1HD2 LEU 6 1.270 -12.731 -11.070 201 HD23 LEU 6 2HD2 LEU 6 1.967 -13.458 -9.609 202 H CYS 7 H CYS 7 -0.357 -14.124 -5.888 203 HA CYS 7 HA CYS 7 0.481 -12.924 -3.348 204 HB2 CYS 7 2HB CYS 7 -2.092 -12.656 -3.722 205 HB3 CYS 7 3HB CYS 7 -2.175 -14.368 -3.337 206 H GLY 8 H GLY 8 1.214 -14.461 -1.821 207 HA2 GLY 8 HA2 GLY 8 2.248 -16.423 -1.141 208 HA3 GLY 8 HA3 GLY 8 0.946 -17.271 -1.987 209 H SER 9 H SER 9 1.863 -18.820 -3.175 210 HA SER 9 HA SER 9 4.454 -18.957 -4.222 211 HB2 SER 9 2HB SER 9 1.941 -20.226 -5.371 212 HB3 SER 9 3HB SER 9 3.610 -20.778 -5.596 213 HG SER 9 HG SER 9 2.520 -21.967 -3.941 214 H HIS 10 H HIS 10 1.547 -17.524 -5.787 215 HA HIS 10 HA HIS 10 2.751 -17.161 -8.370 216 HB2 HIS 10 2HB HIS 10 0.230 -16.594 -7.092 217 HB3 HIS 10 3HB HIS 10 0.807 -15.089 -7.771 218 HD2 HIS 10 HD2 HIS 10 -1.321 -17.796 -8.750 219 HE1 HIS 10 HE1 HIS 10 0.527 -16.730 -12.436 220 HE2 HIS 10 HE2 HIS 10 -1.399 -18.019 -11.371 221 H LEU 11 H LEU 11 2.740 -15.186 -5.443 222 HA LEU 11 HA LEU 11 4.037 -12.876 -6.659 223 HB2 LEU 11 2HB LEU 11 2.458 -12.955 -4.610 224 HB3 LEU 11 3HB LEU 11 3.826 -13.583 -3.700 225 HG LEU 11 HG LEU 11 5.098 -11.470 -4.290 226 HD11 LEU 11 1HD1 LEU 11 3.823 -10.769 -6.317 227 HD12 LEU 11 2HD1 LEU 11 2.359 -10.595 -5.319 228 HD13 LEU 11 3HD1 LEU 11 3.745 -9.524 -5.069 229 HD21 LEU 11 3HD2 LEU 11 3.820 -10.050 -2.699 230 HD22 LEU 11 1HD2 LEU 11 2.417 -11.119 -2.863 231 HD23 LEU 11 2HD2 LEU 11 3.921 -11.725 -2.129 232 H VAL 12 H VAL 12 5.129 -15.581 -4.585 233 HA VAL 12 HA VAL 12 7.911 -14.927 -4.532 234 HB VAL 12 HB VAL 12 6.521 -17.639 -4.467 235 HG11 VAL 12 1HG1 VAL 12 9.424 -16.967 -3.811 236 HG12 VAL 12 2HG1 VAL 12 8.615 -18.499 -3.409 237 HG13 VAL 12 3HG1 VAL 12 8.849 -18.053 -5.099 238 HG21 VAL 12 3HG2 VAL 12 7.682 -15.916 -2.234 239 HG22 VAL 12 1HG2 VAL 12 5.958 -16.102 -2.596 240 HG23 VAL 12 2HG2 VAL 12 6.887 -17.498 -2.044 241 H GLU 13 H GLU 13 6.049 -16.861 -6.922 242 HA GLU 13 HA GLU 13 8.219 -17.315 -8.729 243 HB2 GLU 13 2HB GLU 13 5.220 -17.273 -8.994 244 HB3 GLU 13 3HB GLU 13 6.170 -17.167 -10.464 245 HG2 GLU 13 2HG GLU 13 6.546 -19.337 -8.388 246 HG3 GLU 13 3HG GLU 13 5.532 -19.480 -9.836 247 H ALA 14 H ALA 14 5.797 -14.545 -8.752 248 HA ALA 14 HA ALA 14 6.921 -13.290 -10.980 249 HB1 ALA 14 3HB ALA 14 4.813 -12.675 -9.951 250 HB2 ALA 14 1HB ALA 14 5.652 -12.046 -8.507 251 HB3 ALA 14 2HB ALA 14 5.867 -11.247 -10.080 252 H LEU 15 H LEU 15 7.906 -12.775 -7.536 253 HA LEU 15 HA LEU 15 10.048 -10.977 -8.076 254 HB2 LEU 15 2HB LEU 15 9.374 -12.865 -5.817 255 HB3 LEU 15 3HB LEU 15 10.996 -12.215 -5.894 256 HG LEU 15 HG LEU 15 9.669 -10.912 -4.394 257 HD11 LEU 15 1HD1 LEU 15 10.126 -8.663 -5.206 258 HD12 LEU 15 2HD1 LEU 15 11.442 -9.745 -5.691 259 HD13 LEU 15 3HD1 LEU 15 10.228 -9.220 -6.876 260 HD21 LEU 15 3HD2 LEU 15 7.793 -9.472 -5.210 261 HD22 LEU 15 1HD2 LEU 15 7.808 -10.386 -6.730 262 HD23 LEU 15 2HD2 LEU 15 7.443 -11.205 -5.199 263 H TYR 16 H TYR 16 10.034 -14.559 -8.264 264 HA TYR 16 HA TYR 16 12.846 -14.748 -8.870 265 HB2 TYR 16 2HB TYR 16 11.516 -16.707 -8.192 266 HB3 TYR 16 3HB TYR 16 10.588 -16.600 -9.686 267 HD1 TYR 16 HD1 TYR 16 14.042 -17.146 -8.361 268 HD2 TYR 16 HD2 TYR 16 11.412 -17.410 -11.767 269 HE1 TYR 16 HE1 TYR 16 15.835 -18.296 -9.654 270 HE2 TYR 16 HE2 TYR 16 13.195 -18.566 -13.061 271 HH TYR 16 HH TYR 16 15.356 -19.358 -13.051 272 H LEU 17 H LEU 17 9.944 -14.376 -10.972 273 HA LEU 17 HA LEU 17 11.432 -14.557 -13.398 274 HB2 LEU 17 2HB LEU 17 8.754 -13.154 -12.897 275 HB3 LEU 17 3HB LEU 17 9.393 -13.605 -14.468 276 HG LEU 17 HG LEU 17 8.554 -15.547 -12.303 277 HD11 LEU 17 1HD1 LEU 17 7.218 -14.791 -14.928 278 HD12 LEU 17 2HD1 LEU 17 6.661 -16.038 -13.791 279 HD13 LEU 17 3HD1 LEU 17 6.664 -14.336 -13.301 280 HD21 LEU 17 3HD2 LEU 17 8.791 -17.281 -14.068 281 HD22 LEU 17 1HD2 LEU 17 9.459 -16.061 -15.173 282 HD23 LEU 17 2HD2 LEU 17 10.345 -16.523 -13.704 283 H VAL 18 H VAL 18 10.351 -11.666 -11.617 284 HA VAL 18 HA VAL 18 11.594 -9.804 -13.497 285 HB VAL 18 HB VAL 18 11.583 -8.301 -11.282 286 HG11 VAL 18 1HG1 VAL 18 9.066 -8.846 -12.858 287 HG12 VAL 18 2HG1 VAL 18 9.418 -7.416 -11.847 288 HG13 VAL 18 3HG1 VAL 18 10.384 -7.729 -13.299 289 HG21 VAL 18 3HG2 VAL 18 10.760 -10.315 -9.948 290 HG22 VAL 18 1HG2 VAL 18 10.111 -8.696 -9.664 291 HG23 VAL 18 2HG2 VAL 18 9.176 -9.861 -10.633 292 H CYS 19 H CYS 19 12.637 -11.107 -10.298 293 HA CYS 19 HA CYS 19 15.251 -9.678 -10.643 294 HB2 CYS 19 2HB CYS 19 13.451 -9.006 -8.923 295 HB3 CYS 19 3HB CYS 19 13.863 -10.496 -8.079 296 H GLY 20 H GLY 20 13.865 -12.813 -9.536 297 HA2 GLY 20 HA2 GLY 20 16.357 -13.641 -8.282 298 HA3 GLY 20 HA3 GLY 20 14.928 -14.657 -8.538 299 H GLU 21 H GLU 21 14.913 -14.304 -11.440 300 HA GLU 21 HA GLU 21 16.776 -16.280 -12.328 301 HB2 GLU 21 2HB GLU 21 14.538 -15.740 -13.316 302 HB3 GLU 21 3HB GLU 21 15.201 -14.231 -13.950 303 HG2 GLU 21 2HG GLU 21 16.809 -15.508 -15.330 304 HG3 GLU 21 3HG GLU 21 16.254 -17.022 -14.609 305 H ARG 22 H ARG 22 16.935 -12.720 -12.249 306 HA ARG 22 HA ARG 22 19.422 -12.541 -13.787 307 HB2 ARG 22 2HB ARG 22 18.078 -10.472 -12.007 308 HB3 ARG 22 3HB ARG 22 19.396 -10.206 -13.153 309 HG2 ARG 22 2HG ARG 22 17.810 -10.960 -14.990 310 HG3 ARG 22 3HG ARG 22 16.503 -10.883 -13.802 311 HD2 ARG 22 2HD ARG 22 18.364 -8.544 -14.467 312 HD3 ARG 22 3HD ARG 22 16.817 -8.826 -15.249 313 HE ARG 22 HE ARG 22 15.648 -8.178 -13.365 314 HH11 ARG 22 1HH1 ARG 22 19.068 -8.296 -12.320 315 HH12 ARG 22 2HH1 ARG 22 18.721 -7.286 -10.959 316 HH21 ARG 22 1HH2 ARG 22 15.412 -6.688 -11.779 317 HH22 ARG 22 2HH2 ARG 22 16.685 -6.451 -10.609 318 H GLY 23 H GLY 23 18.457 -12.345 -10.372 319 HA2 GLY 23 HA2 GLY 23 19.807 -12.663 -8.410 320 HA3 GLY 23 HA3 GLY 23 21.279 -12.434 -9.380 321 H HIS 24 H HIS 24 21.691 -10.928 -7.531 322 HA HIS 24 HA HIS 24 20.192 -8.553 -7.113 323 HB2 HIS 24 2HB HIS 24 22.079 -7.847 -5.770 324 HB3 HIS 24 3HB HIS 24 21.736 -9.548 -5.485 325 HD2 HIS 24 HD2 HIS 24 23.554 -11.340 -6.323 326 HE1 HIS 24 HE1 HIS 24 26.588 -8.574 -7.452 327 HE2 HIS 24 HE2 HIS 24 26.072 -11.037 -7.042 328 H PHE 25 H PHE 25 22.385 -9.253 -9.666 329 HA PHE 25 HA PHE 25 22.732 -6.382 -10.431 330 HB2 PHE 25 2HB PHE 25 24.790 -7.592 -9.836 331 HB3 PHE 25 3HB PHE 25 24.409 -8.854 -10.998 332 HD1 PHE 25 HD2 PHE 25 24.776 -5.082 -10.931 333 HD2 PHE 25 HD1 PHE 25 25.569 -8.772 -13.021 334 HE1 PHE 25 HE2 PHE 25 25.966 -3.825 -12.711 335 HE2 PHE 25 HE1 PHE 25 26.734 -7.519 -14.802 336 HZ PHE 25 HZ PHE 25 26.945 -5.036 -14.654 337 H TYR 26 H TYR 26 22.856 -5.991 -12.800 338 HA TYR 26 HA TYR 26 20.594 -7.107 -14.241 339 HB2 TYR 26 2HB TYR 26 21.323 -4.763 -14.469 340 HB3 TYR 26 3HB TYR 26 22.857 -5.298 -15.156 341 HD1 TYR 26 HD1 TYR 26 19.148 -5.743 -15.669 342 HD2 TYR 26 HD2 TYR 26 23.029 -5.384 -17.527 343 HE1 TYR 26 HE1 TYR 26 18.090 -5.892 -17.906 344 HE2 TYR 26 HE2 TYR 26 21.965 -5.463 -19.764 345 HH TYR 26 HH TYR 26 19.995 -5.657 -20.946 346 H THR 27 H THR 27 20.633 -8.253 -16.229 347 HA THR 27 HA THR 27 23.120 -9.779 -16.879 348 HB THR 27 HB THR 27 21.625 -11.703 -17.490 349 HG1 THR 27 HG1 THR 27 19.666 -10.499 -17.414 350 HG21 THR 27 1HG2 THR 27 21.662 -10.901 -14.542 351 HG22 THR 27 2HG2 THR 27 21.521 -12.544 -15.201 352 HG23 THR 27 3HG2 THR 27 23.024 -11.625 -15.419 353 HA PRO 28 HA PRO 28 21.926 -7.663 -20.673 354 HB2 PRO 28 2HB PRO 28 24.225 -7.909 -22.096 355 HB3 PRO 28 3HB PRO 28 24.093 -6.831 -20.673 356 HG2 PRO 28 2HG PRO 28 25.189 -9.662 -20.759 357 HG3 PRO 28 3HG PRO 28 25.953 -8.205 -20.043 358 HD2 PRO 28 2HD PRO 28 24.523 -9.980 -18.546 359 HD3 PRO 28 3HD PRO 28 24.475 -8.223 -18.202 360 H LYS 29 H LYS 29 21.528 -8.188 -22.884 361 HA LYS 29 HA LYS 29 20.586 -10.973 -23.050 362 HB2 LYS 29 2HB LYS 29 19.870 -8.626 -24.836 363 HB3 LYS 29 3HB LYS 29 18.970 -10.122 -24.612 364 HG2 LYS 29 2HG LYS 29 19.313 -7.863 -22.592 365 HG3 LYS 29 3HG LYS 29 17.860 -8.283 -23.487 366 HD2 LYS 29 2HD LYS 29 17.632 -10.391 -22.248 367 HD3 LYS 29 3HD LYS 29 19.185 -10.131 -21.449 368 HE2 LYS 29 2HE LYS 29 17.462 -9.566 -19.892 369 HE3 LYS 29 3HE LYS 29 18.343 -8.106 -20.340 370 HZ1 LYS 29 HZ1 LYS 29 15.704 -8.906 -21.452 371 HZ2 LYS 29 HZ2 LYS 29 15.937 -7.756 -20.315 372 HZ3 LYS 29 HZ3 LYS 29 16.508 -7.529 -21.827 373 H THR 30 H THR 30 20.544 -12.180 -25.004 374 HA THR 30 HA THR 30 23.101 -12.143 -26.508 375 HB THR 30 HB THR 30 20.816 -14.150 -26.551 376 HG1 THR 30 HG1 THR 30 21.955 -13.998 -24.570 377 HG21 THR 30 1HG2 THR 30 23.654 -14.290 -27.677 378 HG22 THR 30 2HG2 THR 30 22.529 -15.661 -27.552 379 HG23 THR 30 3HG2 THR 30 22.146 -14.305 -28.618 Start of MODEL 17 1 H1 GLY 1 1H GLY 1 5.301 -1.717 2.446 2 H2 GLY 1 2H GLY 1 3.796 -2.249 2.092 3 H3 GLY 1 3H GLY 1 4.692 -1.489 0.938 4 HA2 GLY 1 HA2 GLY 1 6.334 -3.309 1.056 5 HA3 GLY 1 HA3 GLY 1 5.198 -4.133 2.141 6 H ILE 2 H ILE 2 5.964 -5.450 -0.003 7 HA ILE 2 HA ILE 2 4.601 -4.962 -2.452 8 HB ILE 2 HB ILE 2 6.766 -6.096 -2.221 9 HG12 ILE 2 2HG1 ILE 2 6.555 -7.891 -3.827 10 HG13 ILE 2 3HG1 ILE 2 4.800 -7.952 -3.589 11 HG21 ILE 2 1HG2 ILE 2 6.315 -7.487 -0.200 12 HG22 ILE 2 2HG2 ILE 2 5.300 -8.554 -1.197 13 HG23 ILE 2 3HG2 ILE 2 7.028 -8.396 -1.532 14 HD11 ILE 2 3HD1 ILE 2 6.387 -5.643 -4.757 15 HD12 ILE 2 1HD1 ILE 2 5.447 -6.819 -5.661 16 HD13 ILE 2 2HD1 ILE 2 4.615 -5.680 -4.579 17 H VAL 3 H VAL 3 3.647 -7.118 0.208 18 HA VAL 3 HA VAL 3 1.740 -8.615 -1.357 19 HB VAL 3 HB VAL 3 2.018 -8.292 1.652 20 HG11 VAL 3 1HG1 VAL 3 0.195 -10.215 0.129 21 HG12 VAL 3 2HG1 VAL 3 0.543 -10.286 1.866 22 HG13 VAL 3 3HG1 VAL 3 -0.337 -8.907 1.212 23 HG21 VAL 3 3HG2 VAL 3 3.866 -9.505 0.500 24 HG22 VAL 3 1HG2 VAL 3 2.916 -10.596 1.514 25 HG23 VAL 3 2HG2 VAL 3 2.673 -10.596 -0.244 26 H GLU 4 H GLU 4 1.299 -5.866 0.942 27 HA GLU 4 HA GLU 4 -1.514 -5.586 0.379 28 HB2 GLU 4 2HB GLU 4 -1.403 -3.610 1.720 29 HB3 GLU 4 3HB GLU 4 -0.526 -4.898 2.517 30 HG2 GLU 4 2HG GLU 4 0.990 -2.880 0.822 31 HG3 GLU 4 3HG GLU 4 0.389 -2.428 2.406 32 H GLN 5 H GLN 5 0.806 -5.196 -1.841 33 HA GLN 5 HA GLN 5 -0.867 -3.202 -3.324 34 HB2 GLN 5 2HB GLN 5 2.098 -3.852 -3.602 35 HB3 GLN 5 3HB GLN 5 1.184 -2.885 -4.761 36 HG2 GLN 5 2HG GLN 5 1.518 -2.183 -1.801 37 HG3 GLN 5 3HG GLN 5 2.482 -1.537 -3.108 38 HE21 GLN 5 2HE2 GLN 5 -0.853 -1.545 -1.740 39 HE22 GLN 5 1HE2 GLN 5 -1.298 -0.045 -2.550 40 H CYS 6 H CYS 6 1.301 -6.039 -4.023 41 HA CYS 6 HA CYS 6 -0.115 -6.614 -6.462 42 HB2 CYS 6 2HB CYS 6 1.877 -8.150 -4.786 43 HB3 CYS 6 3HB CYS 6 1.254 -8.732 -6.322 44 H CYS 7 H CYS 7 -0.458 -8.068 -3.215 45 HA CYS 7 HA CYS 7 -2.157 -10.223 -4.141 46 HB2 CYS 7 2HB CYS 7 -0.752 -10.212 -2.048 47 HB3 CYS 7 3HB CYS 7 -1.924 -9.113 -1.327 48 H THR 8 H THR 8 -2.855 -6.952 -3.185 49 HA THR 8 HA THR 8 -5.790 -7.458 -3.076 50 HB THR 8 HB THR 8 -4.586 -6.264 -1.228 51 HG1 THR 8 HG1 THR 8 -6.637 -4.956 -2.689 52 HG21 THR 8 1HG2 THR 8 -4.015 -3.907 -1.524 53 HG22 THR 8 2HG2 THR 8 -3.017 -4.938 -2.565 54 HG23 THR 8 3HG2 THR 8 -4.360 -4.007 -3.265 55 H SER 9 H SER 9 -3.409 -6.050 -5.237 56 HA SER 9 HA SER 9 -5.483 -5.434 -7.211 57 HB2 SER 9 2HB SER 9 -4.877 -3.134 -7.515 58 HB3 SER 9 3HB SER 9 -5.454 -3.379 -5.863 59 HG SER 9 HG SER 9 -2.980 -3.700 -5.491 60 H ILE 10 H ILE 10 -4.491 -4.543 -9.262 61 HA ILE 10 HA ILE 10 -2.377 -6.390 -9.955 62 HB ILE 10 HB ILE 10 -3.874 -4.325 -11.612 63 HG12 ILE 10 2HG1 ILE 10 -4.103 -7.299 -10.999 64 HG13 ILE 10 3HG1 ILE 10 -5.299 -6.025 -10.779 65 HG21 ILE 10 1HG2 ILE 10 -1.718 -4.625 -12.680 66 HG22 ILE 10 2HG2 ILE 10 -1.777 -6.369 -12.412 67 HG23 ILE 10 3HG2 ILE 10 -2.882 -5.591 -13.574 68 HD11 ILE 10 3HD1 ILE 10 -5.993 -7.412 -12.527 69 HD12 ILE 10 1HD1 ILE 10 -5.517 -5.848 -13.232 70 HD13 ILE 10 2HD1 ILE 10 -4.435 -7.283 -13.379 71 H CYS 11 H CYS 11 -0.324 -6.139 -9.895 72 HA CYS 11 HA CYS 11 0.911 -3.418 -9.866 73 HB2 CYS 11 2HB CYS 11 2.733 -4.424 -8.625 74 HB3 CYS 11 3HB CYS 11 1.200 -4.664 -7.793 75 H SER 12 H SER 12 2.585 -2.967 -11.236 76 HA SER 12 HA SER 12 2.911 -4.779 -13.589 77 HB2 SER 12 2HB SER 12 3.808 -1.909 -13.186 78 HB3 SER 12 3HB SER 12 3.879 -2.854 -14.684 79 HG SER 12 HG SER 12 1.995 -1.434 -14.462 80 H LEU 13 H LEU 13 4.945 -5.315 -14.497 81 HA LEU 13 HA LEU 13 6.671 -6.446 -12.555 82 HB2 LEU 13 2HB LEU 13 8.024 -7.129 -14.378 83 HB3 LEU 13 3HB LEU 13 6.346 -7.445 -14.732 84 HG LEU 13 HG LEU 13 7.775 -5.010 -15.869 85 HD11 LEU 13 1HD1 LEU 13 9.124 -6.988 -16.415 86 HD12 LEU 13 2HD1 LEU 13 7.680 -7.817 -17.046 87 HD13 LEU 13 3HD1 LEU 13 8.313 -6.366 -17.860 88 HD21 LEU 13 3HD2 LEU 13 5.347 -4.949 -16.203 89 HD22 LEU 13 1HD2 LEU 13 6.165 -5.250 -17.729 90 HD23 LEU 13 2HD2 LEU 13 5.385 -6.594 -16.881 91 H TYR 14 H TYR 14 6.944 -3.490 -14.401 92 HA TYR 14 HA TYR 14 9.656 -2.913 -13.789 93 HB2 TYR 14 2HB TYR 14 9.155 -0.739 -14.765 94 HB3 TYR 14 3HB TYR 14 8.495 -2.076 -15.726 95 HD1 TYR 14 HD2 TYR 14 7.486 0.544 -13.199 96 HD2 TYR 14 HD1 TYR 14 6.276 -2.005 -16.466 97 HE1 TYR 14 HE2 TYR 14 5.271 1.661 -13.249 98 HE2 TYR 14 HE1 TYR 14 4.082 -0.848 -16.554 99 HH TYR 14 HH TYR 14 2.741 0.791 -15.645 100 H GLN 15 H GLN 15 7.011 -2.760 -11.730 101 HA GLN 15 HA GLN 15 8.353 -0.745 -9.955 102 HB2 GLN 15 2HB GLN 15 6.125 -0.248 -8.984 103 HB3 GLN 15 3HB GLN 15 6.287 0.246 -10.674 104 HG2 GLN 15 2HG GLN 15 5.014 -1.667 -11.422 105 HG3 GLN 15 3HG GLN 15 4.925 -2.325 -9.775 106 HE21 GLN 15 2HE2 GLN 15 4.384 1.161 -9.962 107 HE22 GLN 15 1HE2 GLN 15 2.638 1.018 -9.857 108 H LEU 16 H LEU 16 6.802 -3.966 -10.220 109 HA LEU 16 HA LEU 16 7.008 -4.506 -7.419 110 HB2 LEU 16 2HB LEU 16 5.894 -6.369 -7.898 111 HB3 LEU 16 3HB LEU 16 5.615 -5.561 -9.416 112 HG LEU 16 HG LEU 16 7.785 -6.785 -10.202 113 HD11 LEU 16 1HD1 LEU 16 7.000 -8.352 -7.714 114 HD12 LEU 16 2HD1 LEU 16 7.795 -9.159 -9.070 115 HD13 LEU 16 3HD1 LEU 16 8.622 -7.850 -8.242 116 HD21 LEU 16 3HD2 LEU 16 5.400 -7.246 -10.986 117 HD22 LEU 16 1HD2 LEU 16 6.439 -8.682 -10.981 118 HD23 LEU 16 2HD2 LEU 16 5.251 -8.435 -9.682 119 H GLU 17 H GLU 17 9.345 -4.820 -10.060 120 HA GLU 17 HA GLU 17 11.469 -6.275 -8.892 121 HB2 GLU 17 2HB GLU 17 11.452 -3.716 -10.562 122 HB3 GLU 17 3HB GLU 17 12.952 -4.458 -10.010 123 HG2 GLU 17 2HG GLU 17 12.398 -6.541 -11.196 124 HG3 GLU 17 3HG GLU 17 10.926 -5.772 -11.808 125 H ASN 18 H ASN 18 10.370 -3.020 -8.301 126 HA ASN 18 HA ASN 18 12.607 -1.971 -6.919 127 HB2 ASN 18 2HB ASN 18 10.285 -0.991 -7.909 128 HB3 ASN 18 3HB ASN 18 9.875 -0.947 -6.201 129 HD21 ASN 18 1HD2 ASN 18 11.970 0.296 -8.749 130 HD22 ASN 18 2HD2 ASN 18 12.662 1.606 -7.814 131 H TYR 19 H TYR 19 10.181 -4.115 -5.733 132 HA TYR 19 HA TYR 19 10.646 -3.574 -2.864 133 HB2 TYR 19 2HB TYR 19 8.952 -5.626 -4.334 134 HB3 TYR 19 3HB TYR 19 8.989 -5.380 -2.599 135 HD1 TYR 19 HD1 TYR 19 8.129 -3.683 -5.839 136 HD2 TYR 19 HD2 TYR 19 7.602 -3.773 -1.560 137 HE1 TYR 19 HE1 TYR 19 6.258 -2.058 -6.036 138 HE2 TYR 19 HE2 TYR 19 5.664 -2.219 -1.769 139 HH TYR 19 HH TYR 19 4.688 -0.820 -4.933 140 H CYS 20 H CYS 20 12.221 -5.455 -5.251 141 HA CYS 20 HA CYS 20 12.718 -7.886 -3.772 142 HB2 CYS 20 2HB CYS 20 12.859 -7.555 -6.258 143 HB3 CYS 20 3HB CYS 20 14.332 -6.617 -6.012 144 H ASN 21 H ASN 21 14.358 -4.798 -3.817 145 HA ASN 21 HA ASN 21 16.788 -5.697 -2.439 146 HB2 ASN 21 2HB ASN 21 17.267 -3.189 -2.412 147 HB3 ASN 21 3HB ASN 21 17.183 -3.983 -3.978 148 HD21 ASN 21 1HD2 ASN 21 14.463 -2.840 -1.963 149 HD22 ASN 21 2HD2 ASN 21 13.816 -1.788 -3.232 150 H1 PHE 1 1H PHE 1 5.619 -11.521 -19.534 151 H2 PHE 1 2H PHE 1 5.087 -13.013 -19.130 152 H3 PHE 1 3H PHE 1 6.462 -12.428 -18.458 153 HA PHE 1 HA PHE 1 4.659 -12.343 -16.879 154 HB2 PHE 1 2HB PHE 1 6.495 -10.602 -16.885 155 HB3 PHE 1 3HB PHE 1 5.443 -9.548 -17.811 156 HD1 PHE 1 HD1 PHE 1 5.926 -11.251 -14.527 157 HD2 PHE 1 HD2 PHE 1 3.671 -8.265 -16.691 158 HE1 PHE 1 HE1 PHE 1 5.008 -10.382 -12.394 159 HE2 PHE 1 HE2 PHE 1 2.791 -7.390 -14.551 160 HZ PHE 1 HZ PHE 1 3.445 -8.445 -12.399 161 H VAL 2 H VAL 2 2.630 -11.220 -16.238 162 HA VAL 2 HA VAL 2 1.181 -9.737 -18.275 163 HB VAL 2 HB VAL 2 0.322 -11.983 -18.736 164 HG11 VAL 2 1HG1 VAL 2 0.571 -13.042 -16.501 165 HG12 VAL 2 2HG1 VAL 2 -0.808 -12.075 -15.920 166 HG13 VAL 2 3HG1 VAL 2 -1.035 -13.266 -17.209 167 HG21 VAL 2 3HG2 VAL 2 -2.042 -11.472 -18.670 168 HG22 VAL 2 1HG2 VAL 2 -1.800 -10.267 -17.392 169 HG23 VAL 2 2HG2 VAL 2 -1.129 -9.993 -19.015 170 H ASN 3 H ASN 3 0.175 -8.040 -17.354 171 HA ASN 3 HA ASN 3 0.463 -7.462 -14.584 172 HB2 ASN 3 2HB ASN 3 -1.456 -6.206 -16.599 173 HB3 ASN 3 3HB ASN 3 -0.912 -5.512 -15.063 174 HD21 ASN 3 2HD2 ASN 3 0.883 -4.286 -14.985 175 HD22 ASN 3 1HD2 ASN 3 1.918 -4.092 -16.368 176 H GLN 4 H GLN 4 -0.548 -8.497 -12.970 177 HA GLN 4 HA GLN 4 -3.415 -9.159 -13.013 178 HB2 GLN 4 2HB GLN 4 -3.094 -11.541 -12.798 179 HB3 GLN 4 3HB GLN 4 -2.262 -11.005 -14.255 180 HG2 GLN 4 2HG GLN 4 -0.152 -10.859 -12.819 181 HG3 GLN 4 3HG GLN 4 -1.027 -11.688 -11.544 182 HE21 GLN 4 2HE2 GLN 4 1.324 -12.456 -13.493 183 HE22 GLN 4 1HE2 GLN 4 0.829 -14.071 -13.982 184 H HIS 5 H HIS 5 -3.749 -10.630 -10.978 185 HA HIS 5 HA HIS 5 -2.659 -9.193 -8.601 186 HB2 HIS 5 2HB HIS 5 -4.866 -11.275 -8.868 187 HB3 HIS 5 3HB HIS 5 -4.377 -10.479 -7.374 188 HD2 HIS 5 HD2 HIS 5 -6.063 -9.648 -10.774 189 HE1 HIS 5 HE1 HIS 5 -7.033 -6.511 -8.091 190 HE2 HIS 5 HE2 HIS 5 -7.531 -7.511 -10.377 191 H LEU 6 H LEU 6 -1.206 -10.119 -7.222 192 HA LEU 6 HA LEU 6 -0.350 -12.965 -7.647 193 HB2 LEU 6 2HB LEU 6 1.418 -10.499 -7.478 194 HB3 LEU 6 3HB LEU 6 2.000 -12.156 -7.419 195 HG LEU 6 HG LEU 6 0.571 -10.897 -9.807 196 HD11 LEU 6 1HD1 LEU 6 2.887 -10.956 -10.798 197 HD12 LEU 6 2HD1 LEU 6 2.721 -9.830 -9.437 198 HD13 LEU 6 3HD1 LEU 6 3.501 -11.403 -9.186 199 HD21 LEU 6 3HD2 LEU 6 2.028 -13.565 -9.473 200 HD22 LEU 6 1HD2 LEU 6 0.291 -13.350 -9.782 201 HD23 LEU 6 2HD2 LEU 6 1.469 -12.892 -11.014 202 H CYS 7 H CYS 7 -0.174 -14.092 -5.810 203 HA CYS 7 HA CYS 7 0.608 -12.783 -3.297 204 HB2 CYS 7 2HB CYS 7 -1.959 -12.595 -3.748 205 HB3 CYS 7 3HB CYS 7 -2.011 -14.297 -3.311 206 H GLY 8 H GLY 8 1.374 -14.224 -1.726 207 HA2 GLY 8 HA2 GLY 8 2.459 -16.129 -0.954 208 HA3 GLY 8 HA3 GLY 8 1.149 -17.038 -1.722 209 H SER 9 H SER 9 2.010 -18.631 -2.886 210 HA SER 9 HA SER 9 4.579 -18.853 -3.970 211 HB2 SER 9 2HB SER 9 2.020 -20.089 -5.053 212 HB3 SER 9 3HB SER 9 3.673 -20.684 -5.289 213 HG SER 9 HG SER 9 2.578 -21.810 -3.592 214 H HIS 10 H HIS 10 1.650 -17.467 -5.570 215 HA HIS 10 HA HIS 10 2.841 -17.197 -8.159 216 HB2 HIS 10 2HB HIS 10 0.334 -16.561 -6.889 217 HB3 HIS 10 3HB HIS 10 0.915 -15.089 -7.633 218 HD2 HIS 10 HD2 HIS 10 -1.270 -17.773 -8.487 219 HE1 HIS 10 HE1 HIS 10 0.580 -16.913 -12.224 220 HE2 HIS 10 HE2 HIS 10 -1.376 -18.095 -11.096 221 H LEU 11 H LEU 11 2.858 -15.094 -5.327 222 HA LEU 11 HA LEU 11 4.135 -12.831 -6.638 223 HB2 LEU 11 2HB LEU 11 2.611 -12.857 -4.548 224 HB3 LEU 11 3HB LEU 11 4.002 -13.463 -3.661 225 HG LEU 11 HG LEU 11 5.250 -11.364 -4.289 226 HD11 LEU 11 1HD1 LEU 11 3.952 -10.717 -6.334 227 HD12 LEU 11 2HD1 LEU 11 2.515 -10.465 -5.312 228 HD13 LEU 11 3HD1 LEU 11 3.938 -9.433 -5.125 229 HD21 LEU 11 3HD2 LEU 11 4.061 -11.592 -2.126 230 HD22 LEU 11 1HD2 LEU 11 3.978 -9.924 -2.714 231 HD23 LEU 11 2HD2 LEU 11 2.566 -10.980 -2.874 232 H VAL 12 H VAL 12 5.292 -15.473 -4.508 233 HA VAL 12 HA VAL 12 8.069 -14.808 -4.565 234 HB VAL 12 HB VAL 12 6.699 -17.517 -4.329 235 HG11 VAL 12 1HG1 VAL 12 8.833 -18.317 -3.305 236 HG12 VAL 12 2HG1 VAL 12 9.006 -17.953 -5.021 237 HG13 VAL 12 3HG1 VAL 12 9.619 -16.803 -3.809 238 HG21 VAL 12 3HG2 VAL 12 6.192 -15.893 -2.515 239 HG22 VAL 12 1HG2 VAL 12 7.150 -17.255 -1.929 240 HG23 VAL 12 2HG2 VAL 12 7.927 -15.682 -2.225 241 H GLU 13 H GLU 13 6.159 -16.878 -6.788 242 HA GLU 13 HA GLU 13 8.223 -17.514 -8.633 243 HB2 GLU 13 2HB GLU 13 5.208 -17.300 -8.823 244 HB3 GLU 13 3HB GLU 13 6.162 -17.504 -10.282 245 HG2 GLU 13 3HG GLU 13 7.219 -19.534 -9.354 246 HG3 GLU 13 2HG GLU 13 6.300 -19.349 -7.858 247 H ALA 14 H ALA 14 5.967 -14.626 -8.691 248 HA ALA 14 HA ALA 14 7.084 -13.549 -11.065 249 HB1 ALA 14 3HB ALA 14 4.946 -12.911 -10.069 250 HB2 ALA 14 1HB ALA 14 5.788 -12.166 -8.681 251 HB3 ALA 14 2HB ALA 14 5.985 -11.484 -10.312 252 H LEU 15 H LEU 15 7.982 -12.864 -7.616 253 HA LEU 15 HA LEU 15 10.088 -11.054 -8.219 254 HB2 LEU 15 2HB LEU 15 9.409 -12.832 -5.868 255 HB3 LEU 15 3HB LEU 15 11.032 -12.189 -5.957 256 HG LEU 15 HG LEU 15 9.738 -10.794 -4.540 257 HD11 LEU 15 1HD1 LEU 15 10.175 -8.616 -5.465 258 HD12 LEU 15 2HD1 LEU 15 11.465 -9.718 -5.975 259 HD13 LEU 15 3HD1 LEU 15 10.192 -9.241 -7.120 260 HD21 LEU 15 3HD2 LEU 15 7.492 -11.145 -5.242 261 HD22 LEU 15 1HD2 LEU 15 7.822 -9.418 -5.389 262 HD23 LEU 15 2HD2 LEU 15 7.788 -10.441 -6.843 263 H TYR 16 H TYR 16 10.208 -14.648 -8.178 264 HA TYR 16 HA TYR 16 13.023 -14.775 -8.723 265 HB2 TYR 16 2HB TYR 16 11.712 -16.761 -8.067 266 HB3 TYR 16 3HB TYR 16 10.804 -16.665 -9.581 267 HD1 TYR 16 HD2 TYR 16 14.215 -17.235 -8.161 268 HD2 TYR 16 HD1 TYR 16 11.703 -17.464 -11.660 269 HE1 TYR 16 HE2 TYR 16 16.048 -18.380 -9.404 270 HE2 TYR 16 HE1 TYR 16 13.517 -18.624 -12.895 271 HH TYR 16 HH TYR 16 15.671 -19.389 -12.835 272 H LEU 17 H LEU 17 10.217 -14.481 -10.955 273 HA LEU 17 HA LEU 17 11.863 -14.641 -13.314 274 HB2 LEU 17 2HB LEU 17 9.052 -13.514 -12.897 275 HB3 LEU 17 3HB LEU 17 9.800 -13.772 -14.466 276 HG LEU 17 HG LEU 17 9.247 -15.988 -12.471 277 HD11 LEU 17 1HD1 LEU 17 7.700 -15.176 -14.965 278 HD12 LEU 17 2HD1 LEU 17 7.372 -16.596 -13.948 279 HD13 LEU 17 3HD1 LEU 17 7.159 -14.970 -13.283 280 HD21 LEU 17 3HD2 LEU 17 10.097 -16.094 -15.396 281 HD22 LEU 17 1HD2 LEU 17 11.077 -16.589 -13.998 282 HD23 LEU 17 2HD2 LEU 17 9.619 -17.494 -14.412 283 H VAL 18 H VAL 18 10.475 -11.782 -11.638 284 HA VAL 18 HA VAL 18 11.751 -10.002 -13.576 285 HB VAL 18 HB VAL 18 11.107 -8.486 -11.192 286 HG11 VAL 18 1HG1 VAL 18 9.647 -7.304 -12.703 287 HG12 VAL 18 2HG1 VAL 18 11.209 -7.610 -13.475 288 HG13 VAL 18 3HG1 VAL 18 9.797 -8.602 -13.922 289 HG21 VAL 18 3HG2 VAL 18 9.641 -10.037 -10.404 290 HG22 VAL 18 1HG2 VAL 18 8.691 -8.776 -11.187 291 HG23 VAL 18 2HG2 VAL 18 8.886 -10.331 -12.018 292 H CYS 19 H CYS 19 12.641 -11.112 -10.314 293 HA CYS 19 HA CYS 19 15.024 -9.312 -10.398 294 HB2 CYS 19 2HB CYS 19 13.288 -8.950 -8.622 295 HB3 CYS 19 3HB CYS 19 13.683 -10.546 -7.979 296 H GLY 20 H GLY 20 14.015 -12.644 -9.484 297 HA2 GLY 20 HA2 GLY 20 16.548 -13.448 -8.453 298 HA3 GLY 20 HA3 GLY 20 15.238 -14.540 -8.965 299 H GLU 21 H GLU 21 15.112 -13.997 -11.631 300 HA GLU 21 HA GLU 21 17.051 -15.440 -13.014 301 HB2 GLU 21 2HB GLU 21 14.784 -14.756 -13.792 302 HB3 GLU 21 3HB GLU 21 15.343 -13.086 -13.935 303 HG2 GLU 21 2HG GLU 21 16.972 -13.818 -15.696 304 HG3 GLU 21 3HG GLU 21 16.342 -15.465 -15.556 305 H ARG 22 H ARG 22 17.150 -12.036 -12.049 306 HA ARG 22 HA ARG 22 19.357 -11.331 -13.830 307 HB2 ARG 22 2HB ARG 22 18.130 -9.606 -11.660 308 HB3 ARG 22 3HB ARG 22 18.991 -9.088 -13.102 309 HG2 ARG 22 2HG ARG 22 16.226 -10.377 -13.007 310 HG3 ARG 22 3HG ARG 22 16.573 -8.681 -13.290 311 HD2 ARG 22 2HD ARG 22 17.399 -9.055 -15.468 312 HD3 ARG 22 3HD ARG 22 17.751 -10.751 -15.159 313 HE ARG 22 HE ARG 22 15.672 -11.340 -15.848 314 HH11 ARG 22 2HH1 ARG 22 15.338 -7.910 -14.991 315 HH12 ARG 22 1HH1 ARG 22 13.718 -7.863 -15.617 316 HH21 ARG 22 2HH2 ARG 22 13.735 -11.250 -16.514 317 HH22 ARG 22 1HH2 ARG 22 12.768 -9.777 -16.484 318 H GLY 23 H GLY 23 19.447 -13.122 -11.158 319 HA2 GLY 23 HA2 GLY 23 21.713 -13.798 -10.483 320 HA3 GLY 23 HA3 GLY 23 22.095 -12.078 -10.214 321 H HIS 24 H HIS 24 19.338 -11.799 -9.015 322 HA HIS 24 HA HIS 24 20.182 -11.974 -6.296 323 HB2 HIS 24 2HB HIS 24 17.460 -11.402 -7.515 324 HB3 HIS 24 3HB HIS 24 17.836 -11.222 -5.807 325 HD2 HIS 24 HD2 HIS 24 18.477 -9.530 -9.188 326 HE1 HIS 24 HE1 HIS 24 20.207 -7.016 -6.225 327 HE2 HIS 24 HE2 HIS 24 19.600 -7.206 -8.692 328 H PHE 25 H PHE 25 18.689 -14.437 -8.186 329 HA PHE 25 HA PHE 25 18.799 -16.167 -5.811 330 HB2 PHE 25 2HB PHE 25 16.403 -16.023 -7.674 331 HB3 PHE 25 3HB PHE 25 16.760 -17.458 -6.732 332 HD1 PHE 25 HD1 PHE 25 17.189 -17.190 -4.196 333 HD2 PHE 25 HD2 PHE 25 15.034 -14.322 -6.593 334 HE1 PHE 25 HE1 PHE 25 16.129 -16.291 -2.153 335 HE2 PHE 25 HE2 PHE 25 13.956 -13.431 -4.546 336 HZ PHE 25 HZ PHE 25 14.496 -14.405 -2.321 337 H TYR 26 H TYR 26 20.786 -15.791 -7.322 338 HA TYR 26 HA TYR 26 21.210 -18.627 -8.132 339 HB2 TYR 26 2HB TYR 26 22.083 -16.866 -9.765 340 HB3 TYR 26 3HB TYR 26 23.190 -16.361 -8.484 341 HD1 TYR 26 HD2 TYR 26 22.166 -19.132 -10.700 342 HD2 TYR 26 HD1 TYR 26 25.096 -17.796 -7.842 343 HE1 TYR 26 HE2 TYR 26 23.676 -20.979 -11.403 344 HE2 TYR 26 HE1 TYR 26 26.664 -19.575 -8.614 345 HH TYR 26 HH TYR 26 25.761 -21.943 -11.163 346 H THR 27 H THR 27 22.480 -19.778 -6.829 347 HA THR 27 HA THR 27 22.985 -18.601 -4.146 348 HB THR 27 HB THR 27 21.921 -21.354 -4.188 349 HG1 THR 27 HG1 THR 27 20.068 -19.318 -4.765 350 HG21 THR 27 1HG2 THR 27 22.224 -19.981 -2.205 351 HG22 THR 27 2HG2 THR 27 21.106 -18.753 -2.870 352 HG23 THR 27 3HG2 THR 27 20.502 -20.378 -2.448 353 HA PRO 28 HA PRO 28 24.210 -20.720 -7.306 354 HB2 PRO 28 2HB PRO 28 25.034 -23.230 -7.921 355 HB3 PRO 28 3HB PRO 28 26.182 -21.879 -7.660 356 HG2 PRO 28 2HG PRO 28 25.267 -23.931 -5.634 357 HG3 PRO 28 3HG PRO 28 26.958 -23.500 -6.076 358 HD2 PRO 28 2HD PRO 28 25.773 -22.337 -3.928 359 HD3 PRO 28 3HD PRO 28 26.750 -21.332 -5.055 360 H LYS 29 H LYS 29 22.578 -21.611 -8.513 361 HA LYS 29 HA LYS 29 20.290 -22.299 -6.880 362 HB2 LYS 29 2HB LYS 29 20.425 -20.695 -8.901 363 HB3 LYS 29 3HB LYS 29 20.379 -22.146 -9.910 364 HG2 LYS 29 2HG LYS 29 18.180 -22.747 -8.714 365 HG3 LYS 29 3HG LYS 29 18.296 -21.201 -7.880 366 HD2 LYS 29 2HD LYS 29 16.789 -20.933 -9.731 367 HD3 LYS 29 3HD LYS 29 18.260 -20.035 -10.089 368 HE2 LYS 29 2HE LYS 29 17.578 -21.143 -12.099 369 HE3 LYS 29 3HE LYS 29 19.043 -21.943 -11.533 370 HZ1 LYS 29 HZ1 LYS 29 17.649 -23.745 -10.650 371 HZ2 LYS 29 HZ2 LYS 29 16.284 -22.959 -11.105 372 HZ3 LYS 29 HZ3 LYS 29 17.323 -23.521 -12.231 373 H THR 30 H THR 30 18.966 -24.089 -6.922 374 HA THR 30 HA THR 30 19.947 -26.723 -7.609 375 HB THR 30 HB THR 30 17.525 -27.367 -7.184 376 HG1 THR 30 HG1 THR 30 16.669 -25.287 -7.669 377 HG21 THR 30 1HG2 THR 30 17.670 -26.994 -4.764 378 HG22 THR 30 2HG2 THR 30 19.248 -27.469 -5.413 379 HG23 THR 30 3HG2 THR 30 18.937 -25.769 -4.998 Start of MODEL 18 1 H1 GLY 1 1H GLY 1 4.636 -1.797 1.224 2 H2 GLY 1 2H GLY 1 5.096 -2.157 2.755 3 H3 GLY 1 3H GLY 1 3.640 -2.657 2.206 4 HA2 GLY 1 HA2 GLY 1 6.290 -3.588 1.296 5 HA3 GLY 1 HA3 GLY 1 5.116 -4.528 2.234 6 H ILE 2 H ILE 2 5.989 -5.726 0.065 7 HA ILE 2 HA ILE 2 4.716 -5.086 -2.408 8 HB ILE 2 HB ILE 2 6.823 -6.298 -2.217 9 HG12 ILE 2 2HG1 ILE 2 6.558 -8.026 -3.885 10 HG13 ILE 2 3HG1 ILE 2 4.807 -8.057 -3.640 11 HG21 ILE 2 1HG2 ILE 2 6.346 -7.739 -0.244 12 HG22 ILE 2 2HG2 ILE 2 5.284 -8.741 -1.259 13 HG23 ILE 2 3HG2 ILE 2 7.013 -8.633 -1.608 14 HD11 ILE 2 3HD1 ILE 2 5.467 -6.872 -5.676 15 HD12 ILE 2 1HD1 ILE 2 4.648 -5.762 -4.560 16 HD13 ILE 2 2HD1 ILE 2 6.421 -5.732 -4.736 17 H VAL 3 H VAL 3 3.673 -7.426 0.073 18 HA VAL 3 HA VAL 3 1.704 -8.713 -1.516 19 HB VAL 3 HB VAL 3 1.775 -8.362 1.503 20 HG11 VAL 3 1HG1 VAL 3 0.257 -10.341 1.600 21 HG12 VAL 3 2HG1 VAL 3 -0.538 -8.951 0.861 22 HG13 VAL 3 3HG1 VAL 3 0.069 -10.273 -0.164 23 HG21 VAL 3 3HG2 VAL 3 2.570 -10.712 -0.277 24 HG22 VAL 3 1HG2 VAL 3 3.707 -9.620 0.546 25 HG23 VAL 3 2HG2 VAL 3 2.652 -10.672 1.494 26 H GLU 4 H GLU 4 1.313 -5.879 0.678 27 HA GLU 4 HA GLU 4 -1.478 -5.538 0.037 28 HB2 GLU 4 2HB GLU 4 -1.388 -3.560 1.370 29 HB3 GLU 4 3HB GLU 4 -0.444 -4.821 2.162 30 HG2 GLU 4 2HG GLU 4 1.629 -3.796 1.140 31 HG3 GLU 4 3HG GLU 4 0.638 -2.442 0.585 32 H GLN 5 H GLN 5 1.038 -5.125 -2.086 33 HA GLN 5 HA GLN 5 -0.477 -3.029 -3.611 34 HB2 GLN 5 2HB GLN 5 2.502 -3.632 -3.551 35 HB3 GLN 5 3HB GLN 5 1.726 -2.529 -4.690 36 HG2 GLN 5 2HG GLN 5 1.643 -2.180 -1.652 37 HG3 GLN 5 3HG GLN 5 2.791 -1.406 -2.716 38 HE21 GLN 5 2HE2 GLN 5 -0.724 -1.522 -1.904 39 HE22 GLN 5 1HE2 GLN 5 -1.038 0.068 -2.593 40 H CYS 6 H CYS 6 0.996 -6.274 -3.810 41 HA CYS 6 HA CYS 6 -0.028 -6.511 -6.620 42 HB2 CYS 6 2HB CYS 6 1.909 -8.088 -4.927 43 HB3 CYS 6 3HB CYS 6 1.265 -8.696 -6.444 44 H CYS 7 H CYS 7 -0.584 -7.981 -3.418 45 HA CYS 7 HA CYS 7 -2.262 -10.098 -4.493 46 HB2 CYS 7 2HB CYS 7 -0.874 -10.286 -2.447 47 HB3 CYS 7 3HB CYS 7 -1.929 -9.135 -1.632 48 H THR 8 H THR 8 -3.006 -6.986 -2.996 49 HA THR 8 HA THR 8 -5.886 -7.468 -2.876 50 HB THR 8 HB THR 8 -4.558 -6.085 -1.247 51 HG1 THR 8 HG1 THR 8 -6.781 -5.867 -1.345 52 HG21 THR 8 1HG2 THR 8 -3.997 -3.792 -1.783 53 HG22 THR 8 2HG2 THR 8 -3.179 -4.846 -2.957 54 HG23 THR 8 3HG2 THR 8 -4.642 -3.956 -3.428 55 H SER 9 H SER 9 -3.726 -5.973 -5.200 56 HA SER 9 HA SER 9 -5.780 -5.697 -7.221 57 HB2 SER 9 2HB SER 9 -5.564 -3.319 -7.565 58 HB3 SER 9 3HB SER 9 -6.203 -3.648 -5.951 59 HG SER 9 HG SER 9 -4.562 -2.019 -5.938 60 H ILE 10 H ILE 10 -4.792 -4.718 -9.269 61 HA ILE 10 HA ILE 10 -2.566 -6.446 -9.791 62 HB ILE 10 HB ILE 10 -4.019 -4.464 -11.586 63 HG12 ILE 10 2HG1 ILE 10 -4.231 -7.432 -10.934 64 HG13 ILE 10 3HG1 ILE 10 -5.457 -6.178 -10.776 65 HG21 ILE 10 1HG2 ILE 10 -1.795 -4.784 -12.530 66 HG22 ILE 10 2HG2 ILE 10 -1.889 -6.527 -12.251 67 HG23 ILE 10 3HG2 ILE 10 -2.926 -5.743 -13.467 68 HD11 ILE 10 3HD1 ILE 10 -6.043 -7.609 -12.560 69 HD12 ILE 10 1HD1 ILE 10 -5.595 -6.028 -13.245 70 HD13 ILE 10 2HD1 ILE 10 -4.464 -7.419 -13.348 71 H CYS 11 H CYS 11 -0.492 -6.151 -9.882 72 HA CYS 11 HA CYS 11 0.678 -3.401 -9.819 73 HB2 CYS 11 2HB CYS 11 2.568 -4.365 -8.671 74 HB3 CYS 11 3HB CYS 11 1.086 -4.742 -7.812 75 H SER 12 H SER 12 2.908 -3.295 -10.824 76 HA SER 12 HA SER 12 2.995 -4.797 -13.424 77 HB2 SER 12 2HB SER 12 3.647 -1.882 -12.864 78 HB3 SER 12 3HB SER 12 3.840 -2.732 -14.405 79 HG SER 12 HG SER 12 1.839 -1.490 -14.172 80 H LEU 13 H LEU 13 5.000 -5.199 -14.342 81 HA LEU 13 HA LEU 13 6.838 -6.297 -12.514 82 HB2 LEU 13 2HB LEU 13 8.191 -6.767 -14.426 83 HB3 LEU 13 3HB LEU 13 6.523 -7.182 -14.740 84 HG LEU 13 HG LEU 13 7.821 -4.633 -15.797 85 HD11 LEU 13 1HD1 LEU 13 8.227 -5.861 -17.894 86 HD12 LEU 13 2HD1 LEU 13 9.121 -6.580 -16.547 87 HD13 LEU 13 3HD1 LEU 13 7.635 -7.359 -17.139 88 HD21 LEU 13 3HD2 LEU 13 5.393 -4.518 -15.995 89 HD22 LEU 13 1HD2 LEU 13 6.100 -4.786 -17.580 90 HD23 LEU 13 2HD2 LEU 13 5.351 -6.144 -16.724 91 H TYR 14 H TYR 14 6.936 -3.259 -14.261 92 HA TYR 14 HA TYR 14 9.603 -2.557 -13.673 93 HB2 TYR 14 2HB TYR 14 8.956 -0.369 -14.527 94 HB3 TYR 14 3HB TYR 14 8.328 -1.699 -15.525 95 HD1 TYR 14 HD2 TYR 14 7.256 0.714 -12.817 96 HD2 TYR 14 HD1 TYR 14 6.110 -1.671 -16.228 97 HE1 TYR 14 HE2 TYR 14 4.976 1.677 -12.719 98 HE2 TYR 14 HE1 TYR 14 3.845 -0.652 -16.174 99 HH TYR 14 HH TYR 14 2.879 1.733 -13.670 100 H GLN 15 H GLN 15 7.009 -2.620 -11.523 101 HA GLN 15 HA GLN 15 8.368 -0.672 -9.692 102 HB2 GLN 15 2HB GLN 15 6.179 -0.193 -8.666 103 HB3 GLN 15 3HB GLN 15 6.303 0.363 -10.334 104 HG2 GLN 15 2HG GLN 15 4.941 -1.490 -11.117 105 HG3 GLN 15 3HG GLN 15 4.861 -2.179 -9.484 106 HE21 GLN 15 2HE2 GLN 15 3.752 -0.777 -7.768 107 HE22 GLN 15 1HE2 GLN 15 2.461 0.269 -8.332 108 H LEU 16 H LEU 16 6.773 -3.859 -10.060 109 HA LEU 16 HA LEU 16 7.042 -4.545 -7.297 110 HB2 LEU 16 2HB LEU 16 5.868 -6.342 -7.869 111 HB3 LEU 16 3HB LEU 16 5.634 -5.502 -9.371 112 HG LEU 16 HG LEU 16 7.788 -6.743 -10.158 113 HD11 LEU 16 1HD1 LEU 16 7.036 -8.258 -7.641 114 HD12 LEU 16 2HD1 LEU 16 7.704 -9.149 -9.011 115 HD13 LEU 16 3HD1 LEU 16 8.650 -7.864 -8.280 116 HD21 LEU 16 3HD2 LEU 16 5.230 -8.362 -9.683 117 HD22 LEU 16 1HD2 LEU 16 5.440 -7.177 -10.991 118 HD23 LEU 16 2HD2 LEU 16 6.446 -8.635 -10.950 119 H GLU 17 H GLU 17 9.302 -4.758 -10.015 120 HA GLU 17 HA GLU 17 11.437 -6.303 -9.009 121 HB2 GLU 17 2HB GLU 17 11.361 -3.677 -10.564 122 HB3 GLU 17 3HB GLU 17 12.894 -4.369 -10.043 123 HG2 GLU 17 2HG GLU 17 12.418 -6.446 -11.278 124 HG3 GLU 17 3HG GLU 17 10.921 -5.715 -11.872 125 H ASN 18 H ASN 18 10.437 -3.057 -8.184 126 HA ASN 18 HA ASN 18 12.734 -2.123 -6.858 127 HB2 ASN 18 2HB ASN 18 10.388 -1.044 -7.622 128 HB3 ASN 18 3HB ASN 18 10.022 -1.205 -5.908 129 HD21 ASN 18 1HD2 ASN 18 11.947 0.379 -8.364 130 HD22 ASN 18 2HD2 ASN 18 12.710 1.554 -7.312 131 H TYR 19 H TYR 19 10.212 -4.215 -5.622 132 HA TYR 19 HA TYR 19 10.825 -3.871 -2.788 133 HB2 TYR 19 2HB TYR 19 9.078 -5.840 -4.315 134 HB3 TYR 19 3HB TYR 19 9.147 -5.695 -2.569 135 HD1 TYR 19 HD2 TYR 19 8.231 -3.817 -5.698 136 HD2 TYR 19 HD1 TYR 19 7.868 -4.072 -1.402 137 HE1 TYR 19 HE2 TYR 19 6.472 -2.072 -5.741 138 HE2 TYR 19 HE1 TYR 19 6.048 -2.379 -1.459 139 HH TYR 19 HH TYR 19 5.030 -0.782 -4.514 140 H CYS 20 H CYS 20 12.339 -5.652 -5.282 141 HA CYS 20 HA CYS 20 13.174 -7.981 -3.747 142 HB2 CYS 20 2HB CYS 20 13.052 -7.713 -6.278 143 HB3 CYS 20 3HB CYS 20 14.509 -6.724 -6.165 144 H ASN 21 H ASN 21 14.338 -4.691 -3.962 145 HA ASN 21 HA ASN 21 17.030 -5.129 -2.963 146 HB2 ASN 21 2HB ASN 21 16.418 -3.239 -4.429 147 HB3 ASN 21 3HB ASN 21 15.304 -2.623 -3.212 148 HD21 ASN 21 1HD2 ASN 21 16.405 -2.255 -0.993 149 HD22 ASN 21 2HD2 ASN 21 17.948 -1.380 -1.080 150 H1 PHE 1 1H PHE 1 6.849 -11.542 -18.653 151 H2 PHE 1 2H PHE 1 5.840 -10.653 -19.592 152 H3 PHE 1 3H PHE 1 5.523 -12.234 -19.321 153 HA PHE 1 HA PHE 1 5.139 -11.847 -16.997 154 HB2 PHE 1 2HB PHE 1 6.728 -9.928 -16.828 155 HB3 PHE 1 3HB PHE 1 5.585 -8.914 -17.694 156 HD1 PHE 1 HD1 PHE 1 6.135 -10.853 -14.542 157 HD2 PHE 1 HD2 PHE 1 3.738 -7.855 -16.525 158 HE1 PHE 1 HE1 PHE 1 5.083 -10.250 -12.378 159 HE2 PHE 1 HE2 PHE 1 2.735 -7.228 -14.347 160 HZ PHE 1 HZ PHE 1 3.391 -8.431 -12.274 161 H VAL 2 H VAL 2 3.013 -11.219 -16.187 162 HA VAL 2 HA VAL 2 1.121 -9.984 -18.127 163 HB VAL 2 HB VAL 2 0.504 -12.507 -16.520 164 HG11 VAL 2 1HG1 VAL 2 -1.461 -11.024 -16.506 165 HG12 VAL 2 2HG1 VAL 2 -1.325 -10.788 -18.263 166 HG13 VAL 2 3HG1 VAL 2 -1.748 -12.380 -17.594 167 HG21 VAL 2 3HG2 VAL 2 1.714 -13.041 -18.586 168 HG22 VAL 2 1HG2 VAL 2 0.024 -13.526 -18.729 169 HG23 VAL 2 2HG2 VAL 2 0.586 -12.043 -19.531 170 H ASN 3 H ASN 3 0.355 -8.217 -17.165 171 HA ASN 3 HA ASN 3 0.489 -7.661 -14.364 172 HB2 ASN 3 2HB ASN 3 -1.310 -6.398 -16.479 173 HB3 ASN 3 3HB ASN 3 -0.864 -5.721 -14.904 174 HD21 ASN 3 2HD2 ASN 3 0.975 -4.587 -14.643 175 HD22 ASN 3 1HD2 ASN 3 2.039 -4.281 -15.989 176 H GLN 4 H GLN 4 -0.661 -8.572 -12.795 177 HA GLN 4 HA GLN 4 -3.485 -9.296 -12.992 178 HB2 GLN 4 2HB GLN 4 -3.205 -11.673 -12.780 179 HB3 GLN 4 3HB GLN 4 -2.293 -11.154 -14.194 180 HG2 GLN 4 2HG GLN 4 -0.260 -11.015 -12.593 181 HG3 GLN 4 3HG GLN 4 -1.232 -11.925 -11.444 182 HE21 GLN 4 2HE2 GLN 4 0.973 -12.238 -13.997 183 HE22 GLN 4 1HE2 GLN 4 0.707 -13.953 -14.299 184 H HIS 5 H HIS 5 -3.916 -10.756 -10.937 185 HA HIS 5 HA HIS 5 -2.872 -9.315 -8.553 186 HB2 HIS 5 2HB HIS 5 -5.038 -11.434 -8.855 187 HB3 HIS 5 3HB HIS 5 -4.598 -10.614 -7.358 188 HD2 HIS 5 HD2 HIS 5 -6.205 -9.845 -10.814 189 HE1 HIS 5 HE1 HIS 5 -7.304 -6.701 -8.185 190 HE2 HIS 5 HE2 HIS 5 -7.717 -7.727 -10.479 191 H LEU 6 H LEU 6 -1.246 -10.132 -7.356 192 HA LEU 6 HA LEU 6 -0.426 -13.008 -7.678 193 HB2 LEU 6 2HB LEU 6 1.309 -10.515 -7.582 194 HB3 LEU 6 3HB LEU 6 1.923 -12.160 -7.473 195 HG LEU 6 HG LEU 6 0.444 -11.015 -9.887 196 HD11 LEU 6 1HD1 LEU 6 2.581 -9.902 -9.589 197 HD12 LEU 6 2HD1 LEU 6 3.389 -11.453 -9.295 198 HD13 LEU 6 3HD1 LEU 6 2.743 -11.076 -10.911 199 HD21 LEU 6 3HD2 LEU 6 1.359 -13.050 -11.033 200 HD22 LEU 6 1HD2 LEU 6 1.937 -13.649 -9.469 201 HD23 LEU 6 2HD2 LEU 6 0.196 -13.467 -9.771 202 H CYS 7 H CYS 7 -0.212 -14.112 -5.850 203 HA CYS 7 HA CYS 7 0.472 -12.764 -3.320 204 HB2 CYS 7 2HB CYS 7 -2.118 -12.795 -3.908 205 HB3 CYS 7 3HB CYS 7 -2.028 -14.450 -3.331 206 H GLY 8 H GLY 8 1.269 -14.166 -1.740 207 HA2 GLY 8 HA2 GLY 8 2.430 -16.014 -0.937 208 HA3 GLY 8 HA3 GLY 8 1.140 -16.967 -1.677 209 H SER 9 H SER 9 1.981 -18.552 -2.831 210 HA SER 9 HA SER 9 4.613 -18.757 -3.850 211 HB2 SER 9 2HB SER 9 2.932 -20.601 -3.423 212 HB3 SER 9 3HB SER 9 2.155 -20.158 -4.955 213 HG SER 9 HG SER 9 3.707 -21.865 -5.191 214 H HIS 10 H HIS 10 1.663 -17.514 -5.519 215 HA HIS 10 HA HIS 10 2.855 -17.277 -8.119 216 HB2 HIS 10 2HB HIS 10 0.332 -16.676 -6.865 217 HB3 HIS 10 3HB HIS 10 0.881 -15.204 -7.632 218 HD2 HIS 10 HD2 HIS 10 -1.143 -18.078 -8.435 219 HE1 HIS 10 HE1 HIS 10 0.550 -17.037 -12.201 220 HE2 HIS 10 HE2 HIS 10 -1.272 -18.394 -11.043 221 H LEU 11 H LEU 11 2.829 -15.124 -5.327 222 HA LEU 11 HA LEU 11 4.060 -12.859 -6.678 223 HB2 LEU 11 2HB LEU 11 2.525 -12.869 -4.610 224 HB3 LEU 11 3HB LEU 11 3.908 -13.451 -3.694 225 HG LEU 11 HG LEU 11 5.144 -11.347 -4.317 226 HD11 LEU 11 1HD1 LEU 11 3.861 -10.738 -6.392 227 HD12 LEU 11 2HD1 LEU 11 2.420 -10.463 -5.382 228 HD13 LEU 11 3HD1 LEU 11 3.849 -9.439 -5.201 229 HD21 LEU 11 3HD2 LEU 11 2.430 -11.003 -2.948 230 HD22 LEU 11 1HD2 LEU 11 3.931 -11.566 -2.174 231 HD23 LEU 11 2HD2 LEU 11 3.808 -9.907 -2.779 232 H VAL 12 H VAL 12 5.266 -15.449 -4.511 233 HA VAL 12 HA VAL 12 8.031 -14.731 -4.579 234 HB VAL 12 HB VAL 12 6.714 -17.462 -4.306 235 HG11 VAL 12 1HG1 VAL 12 9.027 -17.862 -5.002 236 HG12 VAL 12 2HG1 VAL 12 9.621 -16.685 -3.807 237 HG13 VAL 12 3HG1 VAL 12 8.868 -18.206 -3.280 238 HG21 VAL 12 3HG2 VAL 12 7.915 -15.578 -2.230 239 HG22 VAL 12 1HG2 VAL 12 6.184 -15.824 -2.513 240 HG23 VAL 12 2HG2 VAL 12 7.167 -17.162 -1.912 241 H GLU 13 H GLU 13 6.148 -16.850 -6.782 242 HA GLU 13 HA GLU 13 8.222 -17.463 -8.625 243 HB2 GLU 13 2HB GLU 13 5.204 -17.281 -8.834 244 HB3 GLU 13 3HB GLU 13 6.172 -17.457 -10.289 245 HG2 GLU 13 2HG GLU 13 7.286 -19.464 -9.281 246 HG3 GLU 13 3HG GLU 13 6.184 -19.352 -7.904 247 H ALA 14 H ALA 14 5.941 -14.591 -8.696 248 HA ALA 14 HA ALA 14 7.055 -13.505 -11.063 249 HB1 ALA 14 3HB ALA 14 5.947 -11.448 -10.308 250 HB2 ALA 14 1HB ALA 14 4.919 -12.882 -10.056 251 HB3 ALA 14 2HB ALA 14 5.761 -12.124 -8.674 252 H LEU 15 H LEU 15 7.944 -12.810 -7.617 253 HA LEU 15 HA LEU 15 10.045 -10.993 -8.185 254 HB2 LEU 15 2HB LEU 15 9.369 -12.821 -5.875 255 HB3 LEU 15 3HB LEU 15 10.995 -12.182 -5.947 256 HG LEU 15 HG LEU 15 9.681 -10.822 -4.501 257 HD11 LEU 15 1HD1 LEU 15 10.208 -9.206 -7.029 258 HD12 LEU 15 2HD1 LEU 15 10.159 -8.624 -5.359 259 HD13 LEU 15 3HD1 LEU 15 11.449 -9.724 -5.868 260 HD21 LEU 15 3HD2 LEU 15 7.803 -9.395 -5.373 261 HD22 LEU 15 1HD2 LEU 15 7.780 -10.404 -6.834 262 HD23 LEU 15 2HD2 LEU 15 7.446 -11.120 -5.245 263 H TYR 16 H TYR 16 10.184 -14.584 -8.192 264 HA TYR 16 HA TYR 16 13.000 -14.693 -8.740 265 HB2 TYR 16 2HB TYR 16 11.648 -16.667 -8.066 266 HB3 TYR 16 3HB TYR 16 10.830 -16.622 -9.634 267 HD1 TYR 16 HD1 TYR 16 14.134 -17.120 -7.968 268 HD2 TYR 16 HD2 TYR 16 11.917 -17.390 -11.658 269 HE1 TYR 16 HE1 TYR 16 16.086 -18.216 -9.061 270 HE2 TYR 16 HE2 TYR 16 13.860 -18.479 -12.752 271 HH TYR 16 HH TYR 16 16.056 -19.098 -12.541 272 H LEU 17 H LEU 17 10.184 -14.419 -10.972 273 HA LEU 17 HA LEU 17 11.838 -14.578 -13.331 274 HB2 LEU 17 2HB LEU 17 9.018 -13.466 -12.930 275 HB3 LEU 17 3HB LEU 17 9.770 -13.740 -14.495 276 HG LEU 17 HG LEU 17 9.207 -15.927 -12.469 277 HD11 LEU 17 1HD1 LEU 17 7.697 -15.166 -15.000 278 HD12 LEU 17 2HD1 LEU 17 7.356 -16.568 -13.962 279 HD13 LEU 17 3HD1 LEU 17 7.129 -14.929 -13.332 280 HD21 LEU 17 3HD2 LEU 17 10.106 -16.082 -15.378 281 HD22 LEU 17 1HD2 LEU 17 11.061 -16.554 -13.954 282 HD23 LEU 17 2HD2 LEU 17 9.612 -17.467 -14.380 283 H VAL 18 H VAL 18 10.470 -11.740 -11.624 284 HA VAL 18 HA VAL 18 11.687 -9.925 -13.573 285 HB VAL 18 HB VAL 18 11.113 -8.418 -11.181 286 HG11 VAL 18 1HG1 VAL 18 9.557 -7.268 -12.604 287 HG12 VAL 18 2HG1 VAL 18 11.066 -7.568 -13.480 288 HG13 VAL 18 3HG1 VAL 18 9.635 -8.576 -13.819 289 HG21 VAL 18 3HG2 VAL 18 8.861 -10.275 -11.902 290 HG22 VAL 18 1HG2 VAL 18 9.704 -10.019 -10.323 291 HG23 VAL 18 2HG2 VAL 18 8.718 -8.741 -11.029 292 H CYS 19 H CYS 19 12.628 -11.053 -10.327 293 HA CYS 19 HA CYS 19 15.065 -9.331 -10.492 294 HB2 CYS 19 2HB CYS 19 13.446 -8.923 -8.637 295 HB3 CYS 19 3HB CYS 19 13.777 -10.550 -8.039 296 H GLY 20 H GLY 20 14.029 -12.640 -9.483 297 HA2 GLY 20 HA2 GLY 20 16.632 -13.303 -8.488 298 HA3 GLY 20 HA3 GLY 20 15.282 -14.437 -8.707 299 H GLU 21 H GLU 21 15.120 -14.097 -11.584 300 HA GLU 21 HA GLU 21 17.326 -15.736 -12.548 301 HB2 GLU 21 2HB GLU 21 14.923 -15.953 -13.219 302 HB3 GLU 21 3HB GLU 21 15.015 -14.372 -13.985 303 HG2 GLU 21 2HG GLU 21 15.197 -16.051 -15.667 304 HG3 GLU 21 3HG GLU 21 16.751 -15.244 -15.546 305 H ARG 22 H ARG 22 16.334 -12.311 -12.827 306 HA ARG 22 HA ARG 22 18.205 -11.630 -14.925 307 HB2 ARG 22 2HB ARG 22 16.709 -9.800 -13.000 308 HB3 ARG 22 3HB ARG 22 17.491 -9.322 -14.502 309 HG2 ARG 22 2HG ARG 22 15.038 -11.092 -14.183 310 HG3 ARG 22 3HG ARG 22 15.095 -9.460 -14.833 311 HD2 ARG 22 2HD ARG 22 16.266 -11.967 -16.106 312 HD3 ARG 22 3HD ARG 22 14.808 -11.130 -16.609 313 HE ARG 22 HE ARG 22 17.587 -10.361 -17.118 314 HH11 ARG 22 1HH1 ARG 22 14.269 -9.133 -17.145 315 HH12 ARG 22 2HH1 ARG 22 14.658 -7.844 -18.246 316 HH21 ARG 22 2HH2 ARG 22 18.020 -8.679 -18.533 317 HH22 ARG 22 1HH2 ARG 22 16.754 -7.591 -19.012 318 H GLY 23 H GLY 23 18.176 -10.997 -11.411 319 HA2 GLY 23 HA2 GLY 23 21.137 -10.503 -11.373 320 HA3 GLY 23 HA3 GLY 23 19.985 -10.155 -10.053 321 H HIS 24 H HIS 24 21.493 -12.733 -11.932 322 HA HIS 24 HA HIS 24 20.202 -14.917 -10.919 323 HB2 HIS 24 2HB HIS 24 21.946 -16.265 -11.830 324 HB3 HIS 24 3HB HIS 24 21.671 -14.888 -12.887 325 HD2 HIS 24 HD2 HIS 24 23.617 -12.958 -12.923 326 HE1 HIS 24 HE1 HIS 24 26.621 -15.309 -11.032 327 HE2 HIS 24 HE2 HIS 24 26.177 -13.170 -12.344 328 H PHE 25 H PHE 25 20.496 -16.523 -9.462 329 HA PHE 25 HA PHE 25 20.731 -17.424 -7.436 330 HB2 PHE 25 2HB PHE 25 23.054 -17.733 -8.383 331 HB3 PHE 25 3HB PHE 25 23.572 -16.330 -7.461 332 HD1 PHE 25 HD2 PHE 25 21.884 -19.676 -7.050 333 HD2 PHE 25 HD1 PHE 25 24.406 -16.670 -5.256 334 HE1 PHE 25 HE2 PHE 25 22.285 -21.168 -5.108 335 HE2 PHE 25 HE1 PHE 25 24.806 -18.167 -3.318 336 HZ PHE 25 HZ PHE 25 23.744 -20.416 -3.238 337 H TYR 26 H TYR 26 19.223 -15.446 -7.242 338 HA TYR 26 HA TYR 26 19.861 -13.468 -5.199 339 HB2 TYR 26 2HB TYR 26 18.126 -13.075 -6.822 340 HB3 TYR 26 3HB TYR 26 17.229 -14.501 -6.283 341 HD1 TYR 26 HD2 TYR 26 18.739 -11.365 -4.828 342 HD2 TYR 26 HD1 TYR 26 15.400 -14.102 -4.839 343 HE1 TYR 26 HE2 TYR 26 17.609 -9.991 -3.111 344 HE2 TYR 26 HE1 TYR 26 14.231 -12.682 -3.181 345 HH TYR 26 HH TYR 26 14.312 -10.798 -1.885 346 H THR 27 H THR 27 19.358 -13.424 -3.088 347 HA THR 27 HA THR 27 18.526 -15.939 -1.688 348 HB THR 27 HB THR 27 19.848 -15.059 0.264 349 HG1 THR 27 HG1 THR 27 20.106 -12.932 -0.591 350 HG21 THR 27 1HG2 THR 27 20.657 -16.917 -1.162 351 HG22 THR 27 2HG2 THR 27 21.428 -15.750 -2.259 352 HG23 THR 27 3HG2 THR 27 21.990 -15.906 -0.581 353 HA PRO 28 HA PRO 28 15.289 -12.921 -0.769 354 HB2 PRO 28 2HB PRO 28 13.320 -14.571 0.100 355 HB3 PRO 28 3HB PRO 28 13.819 -14.511 -1.615 356 HG2 PRO 28 2HG PRO 28 14.732 -16.477 0.509 357 HG3 PRO 28 3HG PRO 28 14.096 -16.840 -1.130 358 HD2 PRO 28 2HD PRO 28 16.771 -16.717 -0.609 359 HD3 PRO 28 3HD PRO 28 16.100 -16.133 -2.164 360 H LYS 29 H LYS 29 14.237 -12.047 1.076 361 HA LYS 29 HA LYS 29 14.879 -12.920 3.770 362 HB2 LYS 29 2HB LYS 29 16.192 -10.977 4.357 363 HB3 LYS 29 3HB LYS 29 17.023 -11.945 3.162 364 HG2 LYS 29 2HG LYS 29 15.433 -9.474 2.352 365 HG3 LYS 29 3HG LYS 29 17.058 -9.351 3.017 366 HD2 LYS 29 2HD LYS 29 17.928 -10.830 1.222 367 HD3 LYS 29 3HD LYS 29 16.337 -10.846 0.457 368 HE2 LYS 29 2HE LYS 29 17.903 -8.302 1.061 369 HE3 LYS 29 3HE LYS 29 18.036 -9.178 -0.467 370 HZ1 LYS 29 HZ1 LYS 29 15.776 -8.734 -0.955 371 HZ2 LYS 29 HZ2 LYS 29 15.458 -8.145 0.550 372 HZ3 LYS 29 HZ3 LYS 29 16.410 -7.305 -0.472 373 H THR 30 H THR 30 14.016 -11.531 5.435 374 HA THR 30 HA THR 30 11.349 -10.530 4.850 375 HB THR 30 HB THR 30 11.392 -9.944 7.321 376 HG1 THR 30 HG1 THR 30 13.698 -9.843 7.445 377 HG21 THR 30 1HG2 THR 30 11.229 -12.284 8.044 378 HG22 THR 30 2HG2 THR 30 10.435 -12.060 6.477 379 HG23 THR 30 3HG2 THR 30 12.037 -12.828 6.556 Start of MODEL 19 1 H1 GLY 1 1H GLY 1 4.605 -1.781 0.802 2 H2 GLY 1 2H GLY 1 4.920 -1.978 2.399 3 H3 GLY 1 3H GLY 1 3.465 -2.410 1.801 4 HA2 GLY 1 HA2 GLY 1 6.066 -3.692 1.255 5 HA3 GLY 1 HA3 GLY 1 4.724 -4.394 2.173 6 H ILE 2 H ILE 2 5.839 -5.789 0.105 7 HA ILE 2 HA ILE 2 4.725 -5.305 -2.465 8 HB ILE 2 HB ILE 2 6.801 -6.509 -2.046 9 HG12 ILE 2 2HG1 ILE 2 6.678 -8.275 -3.662 10 HG13 ILE 2 3HG1 ILE 2 4.923 -8.359 -3.531 11 HG21 ILE 2 1HG2 ILE 2 5.137 -8.874 -1.090 12 HG22 ILE 2 2HG2 ILE 2 6.890 -8.834 -1.326 13 HG23 ILE 2 3HG2 ILE 2 6.162 -7.849 -0.059 14 HD11 ILE 2 3HD1 ILE 2 4.740 -6.115 -4.572 15 HD12 ILE 2 1HD1 ILE 2 6.513 -6.030 -4.662 16 HD13 ILE 2 2HD1 ILE 2 5.640 -7.254 -5.586 17 H VAL 3 H VAL 3 3.401 -7.339 0.127 18 HA VAL 3 HA VAL 3 1.445 -8.647 -1.526 19 HB VAL 3 HB VAL 3 1.433 -8.146 1.469 20 HG11 VAL 3 1HG1 VAL 3 -0.896 -8.600 0.739 21 HG12 VAL 3 2HG1 VAL 3 -0.336 -10.039 -0.148 22 HG13 VAL 3 3HG1 VAL 3 -0.234 -9.977 1.622 23 HG21 VAL 3 3HG2 VAL 3 2.130 -10.530 1.576 24 HG22 VAL 3 1HG2 VAL 3 2.137 -10.615 -0.197 25 HG23 VAL 3 2HG2 VAL 3 3.300 -9.579 0.657 26 H GLU 4 H GLU 4 1.185 -5.625 0.448 27 HA GLU 4 HA GLU 4 -1.508 -5.085 -0.513 28 HB2 GLU 4 2HB GLU 4 -1.333 -2.979 0.642 29 HB3 GLU 4 3HB GLU 4 -0.778 -4.301 1.672 30 HG2 GLU 4 2HG GLU 4 1.566 -3.736 1.142 31 HG3 GLU 4 3HG GLU 4 1.031 -2.378 0.139 32 H GLN 5 H GLN 5 1.422 -4.927 -2.162 33 HA GLN 5 HA GLN 5 0.537 -2.750 -3.988 34 HB2 GLN 5 2HB GLN 5 2.869 -2.729 -3.349 35 HB3 GLN 5 3HB GLN 5 3.071 -4.402 -3.854 36 HG2 GLN 5 2HG GLN 5 4.026 -2.940 -5.491 37 HG3 GLN 5 3HG GLN 5 2.679 -3.800 -6.200 38 HE21 GLN 5 2HE2 GLN 5 0.570 -2.516 -6.443 39 HE22 GLN 5 1HE2 GLN 5 0.744 -0.780 -6.706 40 H CYS 6 H CYS 6 1.199 -6.303 -4.024 41 HA CYS 6 HA CYS 6 0.037 -6.450 -6.778 42 HB2 CYS 6 2HB CYS 6 1.946 -8.156 -5.184 43 HB3 CYS 6 3HB CYS 6 1.339 -8.605 -6.774 44 H CYS 7 H CYS 7 -0.571 -7.857 -3.573 45 HA CYS 7 HA CYS 7 -2.247 -9.998 -4.683 46 HB2 CYS 7 2HB CYS 7 -0.845 -10.298 -2.676 47 HB3 CYS 7 3HB CYS 7 -1.825 -9.117 -1.813 48 H THR 8 H THR 8 -2.916 -6.951 -3.001 49 HA THR 8 HA THR 8 -5.799 -7.357 -2.901 50 HB THR 8 HB THR 8 -4.417 -6.023 -1.282 51 HG1 THR 8 HG1 THR 8 -6.067 -4.500 -1.042 52 HG21 THR 8 1HG2 THR 8 -3.084 -4.768 -3.037 53 HG22 THR 8 2HG2 THR 8 -4.555 -3.844 -3.407 54 HG23 THR 8 3HG2 THR 8 -3.821 -3.738 -1.792 55 H SER 9 H SER 9 -3.629 -5.897 -5.236 56 HA SER 9 HA SER 9 -5.682 -5.656 -7.244 57 HB2 SER 9 2HB SER 9 -5.578 -3.311 -7.648 58 HB3 SER 9 3HB SER 9 -6.078 -3.556 -5.973 59 HG SER 9 HG SER 9 -3.909 -3.082 -5.333 60 H ILE 10 H ILE 10 -4.695 -4.712 -9.322 61 HA ILE 10 HA ILE 10 -2.432 -6.417 -9.790 62 HB ILE 10 HB ILE 10 -3.909 -4.513 -11.648 63 HG12 ILE 10 2HG1 ILE 10 -4.088 -7.465 -10.916 64 HG13 ILE 10 3HG1 ILE 10 -5.328 -6.221 -10.787 65 HG21 ILE 10 1HG2 ILE 10 -2.786 -5.820 -13.482 66 HG22 ILE 10 2HG2 ILE 10 -1.660 -4.850 -12.557 67 HG23 ILE 10 3HG2 ILE 10 -1.767 -6.590 -12.244 68 HD11 ILE 10 3HD1 ILE 10 -5.475 -6.126 -13.249 69 HD12 ILE 10 1HD1 ILE 10 -4.316 -7.493 -13.334 70 HD13 ILE 10 2HD1 ILE 10 -5.890 -7.704 -12.540 71 H CYS 11 H CYS 11 -0.361 -6.052 -9.794 72 HA CYS 11 HA CYS 11 0.718 -3.267 -9.830 73 HB2 CYS 11 2HB CYS 11 2.682 -4.170 -8.778 74 HB3 CYS 11 3HB CYS 11 1.252 -4.626 -7.862 75 H SER 12 H SER 12 2.520 -2.796 -11.136 76 HA SER 12 HA SER 12 2.840 -4.501 -13.580 77 HB2 SER 12 2HB SER 12 3.747 -1.661 -13.021 78 HB3 SER 12 3HB SER 12 4.052 -2.585 -14.501 79 HG SER 12 HG SER 12 1.508 -1.810 -13.457 80 H LEU 13 H LEU 13 4.911 -5.063 -14.386 81 HA LEU 13 HA LEU 13 6.564 -6.270 -12.426 82 HB2 LEU 13 2HB LEU 13 8.027 -6.810 -14.253 83 HB3 LEU 13 3HB LEU 13 6.368 -7.215 -14.615 84 HG LEU 13 HG LEU 13 7.727 -4.720 -15.722 85 HD11 LEU 13 1HD1 LEU 13 7.538 -7.491 -16.969 86 HD12 LEU 13 2HD1 LEU 13 8.170 -6.028 -17.759 87 HD13 LEU 13 3HD1 LEU 13 9.020 -6.712 -16.367 88 HD21 LEU 13 3HD2 LEU 13 6.037 -4.992 -17.566 89 HD22 LEU 13 1HD2 LEU 13 5.240 -6.248 -16.600 90 HD23 LEU 13 2HD2 LEU 13 5.321 -4.566 -16.022 91 H TYR 14 H TYR 14 6.931 -3.247 -14.175 92 HA TYR 14 HA TYR 14 9.627 -2.753 -13.453 93 HB2 TYR 14 2HB TYR 14 9.241 -0.548 -14.365 94 HB3 TYR 14 3HB TYR 14 8.511 -1.805 -15.384 95 HD1 TYR 14 HD2 TYR 14 7.687 0.821 -12.816 96 HD2 TYR 14 HD1 TYR 14 6.260 -1.643 -16.059 97 HE1 TYR 14 HE2 TYR 14 5.542 2.065 -12.808 98 HE2 TYR 14 HE1 TYR 14 4.124 -0.367 -16.080 99 HH TYR 14 HH TYR 14 3.474 2.317 -13.785 100 H GLN 15 H GLN 15 6.901 -2.556 -11.498 101 HA GLN 15 HA GLN 15 8.241 -0.669 -9.588 102 HB2 GLN 15 2HB GLN 15 6.006 -0.237 -8.615 103 HB3 GLN 15 3HB GLN 15 6.183 0.350 -10.276 104 HG2 GLN 15 2HG GLN 15 4.928 -1.537 -11.139 105 HG3 GLN 15 3HG GLN 15 4.815 -2.264 -9.522 106 HE21 GLN 15 2HE2 GLN 15 4.275 1.188 -9.390 107 HE22 GLN 15 1HE2 GLN 15 2.527 1.054 -9.405 108 H LEU 16 H LEU 16 6.665 -3.879 -10.007 109 HA LEU 16 HA LEU 16 6.936 -4.565 -7.245 110 HB2 LEU 16 2HB LEU 16 5.825 -6.408 -7.816 111 HB3 LEU 16 3HB LEU 16 5.535 -5.538 -9.302 112 HG LEU 16 HG LEU 16 7.675 -6.675 -10.176 113 HD11 LEU 16 1HD1 LEU 16 7.647 -9.135 -8.970 114 HD12 LEU 16 2HD1 LEU 16 8.769 -7.851 -8.548 115 HD13 LEU 16 3HD1 LEU 16 7.300 -8.100 -7.577 116 HD21 LEU 16 3HD2 LEU 16 5.301 -7.241 -10.882 117 HD22 LEU 16 1HD2 LEU 16 6.389 -8.640 -10.919 118 HD23 LEU 16 2HD2 LEU 16 5.241 -8.445 -9.577 119 H GLU 17 H GLU 17 9.228 -4.691 -9.941 120 HA GLU 17 HA GLU 17 11.362 -6.230 -8.935 121 HB2 GLU 17 2HB GLU 17 11.316 -3.559 -10.415 122 HB3 GLU 17 3HB GLU 17 12.833 -4.301 -9.914 123 HG2 GLU 17 2HG GLU 17 12.263 -6.347 -11.205 124 HG3 GLU 17 3HG GLU 17 10.835 -5.498 -11.816 125 H ASN 18 H ASN 18 10.249 -3.067 -7.933 126 HA ASN 18 HA ASN 18 12.553 -2.086 -6.589 127 HB2 ASN 18 2HB ASN 18 9.606 -1.536 -6.033 128 HB3 ASN 18 3HB ASN 18 10.929 -0.571 -5.507 129 HD21 ASN 18 2HD2 ASN 18 12.086 -1.249 -8.505 130 HD22 ASN 18 1HD2 ASN 18 11.293 0.032 -9.402 131 H TYR 19 H TYR 19 10.160 -4.394 -5.541 132 HA TYR 19 HA TYR 19 10.724 -4.163 -2.674 133 HB2 TYR 19 2HB TYR 19 8.932 -5.988 -4.322 134 HB3 TYR 19 3HB TYR 19 8.985 -5.933 -2.569 135 HD1 TYR 19 HD1 TYR 19 8.131 -3.880 -5.616 136 HD2 TYR 19 HD2 TYR 19 7.859 -4.251 -1.317 137 HE1 TYR 19 HE1 TYR 19 6.529 -1.998 -5.551 138 HE2 TYR 19 HE2 TYR 19 6.196 -2.405 -1.270 139 HH TYR 19 HH TYR 19 5.138 -0.695 -4.241 140 H CYS 20 H CYS 20 12.272 -5.796 -5.216 141 HA CYS 20 HA CYS 20 13.073 -8.224 -3.823 142 HB2 CYS 20 2HB CYS 20 13.064 -7.793 -6.320 143 HB3 CYS 20 3HB CYS 20 14.467 -6.751 -6.085 144 H ASN 21 H ASN 21 14.182 -4.914 -3.747 145 HA ASN 21 HA ASN 21 16.783 -5.421 -2.497 146 HB2 ASN 21 2HB ASN 21 16.442 -3.539 -4.044 147 HB3 ASN 21 3HB ASN 21 15.170 -2.880 -3.016 148 HD21 ASN 21 2HD2 ASN 21 15.913 -2.453 -0.678 149 HD22 ASN 21 1HD2 ASN 21 17.474 -1.623 -0.541 150 H1 PHE 1 1H PHE 1 6.834 -11.837 -19.220 151 H2 PHE 1 2H PHE 1 5.837 -10.740 -19.921 152 H3 PHE 1 3H PHE 1 5.397 -12.311 -19.848 153 HA PHE 1 HA PHE 1 5.252 -12.247 -17.465 154 HB2 PHE 1 2HB PHE 1 7.028 -10.458 -17.250 155 HB3 PHE 1 3HB PHE 1 5.832 -9.268 -17.736 156 HD1 PHE 1 HD1 PHE 1 6.801 -11.722 -15.101 157 HD2 PHE 1 HD2 PHE 1 4.167 -8.455 -16.132 158 HE1 PHE 1 HE1 PHE 1 6.083 -11.545 -12.735 159 HE2 PHE 1 HE2 PHE 1 3.456 -8.288 -13.765 160 HZ PHE 1 HZ PHE 1 4.402 -9.834 -12.064 161 H VAL 2 H VAL 2 3.262 -11.501 -16.345 162 HA VAL 2 HA VAL 2 1.291 -10.024 -18.035 163 HB VAL 2 HB VAL 2 0.682 -12.620 -16.546 164 HG11 VAL 2 1HG1 VAL 2 -1.184 -10.722 -18.048 165 HG12 VAL 2 2HG1 VAL 2 -1.629 -12.341 -17.464 166 HG13 VAL 2 3HG1 VAL 2 -1.215 -11.080 -16.307 167 HG21 VAL 2 3HG2 VAL 2 0.584 -11.970 -19.522 168 HG22 VAL 2 1HG2 VAL 2 1.726 -13.071 -18.720 169 HG23 VAL 2 2HG2 VAL 2 0.011 -13.477 -18.775 170 H ASN 3 H ASN 3 0.833 -8.229 -16.892 171 HA ASN 3 HA ASN 3 0.928 -7.993 -14.031 172 HB2 ASN 3 2HB ASN 3 -0.591 -6.421 -16.156 173 HB3 ASN 3 3HB ASN 3 -0.457 -5.954 -14.464 174 HD21 ASN 3 2HD2 ASN 3 0.261 -4.117 -16.132 175 HD22 ASN 3 1HD2 ASN 3 1.995 -3.956 -16.130 176 H GLN 4 H GLN 4 -0.443 -8.735 -12.544 177 HA GLN 4 HA GLN 4 -3.268 -9.297 -12.953 178 HB2 GLN 4 2HB GLN 4 -3.158 -11.702 -12.754 179 HB3 GLN 4 3HB GLN 4 -2.170 -11.218 -14.126 180 HG2 GLN 4 2HG GLN 4 -0.193 -11.211 -12.446 181 HG3 GLN 4 3HG GLN 4 -1.256 -12.110 -11.367 182 HE21 GLN 4 2HE2 GLN 4 0.948 -12.387 -13.993 183 HE22 GLN 4 1HE2 GLN 4 0.666 -14.099 -14.291 184 H HIS 5 H HIS 5 -3.839 -10.854 -10.932 185 HA HIS 5 HA HIS 5 -2.894 -9.442 -8.487 186 HB2 HIS 5 2HB HIS 5 -5.093 -11.498 -8.923 187 HB3 HIS 5 3HB HIS 5 -4.688 -10.743 -7.382 188 HD2 HIS 5 HD2 HIS 5 -6.166 -9.830 -10.852 189 HE1 HIS 5 HE1 HIS 5 -7.174 -6.681 -8.190 190 HE2 HIS 5 HE2 HIS 5 -7.594 -7.655 -10.505 191 H LEU 6 H LEU 6 -1.287 -10.255 -7.291 192 HA LEU 6 HA LEU 6 -0.487 -13.144 -7.565 193 HB2 LEU 6 2HB LEU 6 1.234 -10.644 -7.499 194 HB3 LEU 6 3HB LEU 6 1.858 -12.286 -7.391 195 HG LEU 6 HG LEU 6 0.326 -11.177 -9.789 196 HD11 LEU 6 1HD1 LEU 6 2.424 -10.002 -9.562 197 HD12 LEU 6 2HD1 LEU 6 3.285 -11.515 -9.232 198 HD13 LEU 6 3HD1 LEU 6 2.611 -11.207 -10.854 199 HD21 LEU 6 3HD2 LEU 6 1.899 -13.766 -9.383 200 HD22 LEU 6 1HD2 LEU 6 0.147 -13.634 -9.651 201 HD23 LEU 6 2HD2 LEU 6 1.274 -13.194 -10.938 202 H CYS 7 H CYS 7 -0.292 -14.230 -5.728 203 HA CYS 7 HA CYS 7 0.428 -12.876 -3.206 204 HB2 CYS 7 2HB CYS 7 -2.223 -13.089 -3.839 205 HB3 CYS 7 3HB CYS 7 -1.986 -14.619 -3.018 206 H GLY 8 H GLY 8 1.181 -14.313 -1.596 207 HA2 GLY 8 HA2 GLY 8 2.330 -16.176 -0.801 208 HA3 GLY 8 HA3 GLY 8 1.086 -17.122 -1.624 209 H SER 9 H SER 9 2.042 -18.682 -2.739 210 HA SER 9 HA SER 9 4.688 -18.776 -3.737 211 HB2 SER 9 2HB SER 9 3.070 -20.695 -3.438 212 HB3 SER 9 3HB SER 9 2.289 -20.203 -4.949 213 HG SER 9 HG SER 9 4.197 -20.672 -6.067 214 H HIS 10 H HIS 10 1.703 -17.635 -5.427 215 HA HIS 10 HA HIS 10 2.896 -17.295 -7.994 216 HB2 HIS 10 2HB HIS 10 0.357 -16.782 -6.730 217 HB3 HIS 10 3HB HIS 10 0.854 -15.296 -7.506 218 HD2 HIS 10 HD2 HIS 10 -1.156 -18.141 -8.296 219 HE1 HIS 10 HE1 HIS 10 0.612 -17.223 -12.058 220 HE2 HIS 10 HE2 HIS 10 -1.252 -18.517 -10.899 221 H LEU 11 H LEU 11 2.845 -15.181 -5.175 222 HA LEU 11 HA LEU 11 3.975 -12.873 -6.543 223 HB2 LEU 11 2HB LEU 11 2.452 -12.919 -4.473 224 HB3 LEU 11 3HB LEU 11 3.851 -13.454 -3.555 225 HG LEU 11 HG LEU 11 5.012 -11.323 -4.091 226 HD11 LEU 11 1HD1 LEU 11 3.927 -10.766 -6.272 227 HD12 LEU 11 2HD1 LEU 11 2.375 -10.545 -5.426 228 HD13 LEU 11 3HD1 LEU 11 3.736 -9.460 -5.109 229 HD21 LEU 11 3HD2 LEU 11 2.186 -11.014 -2.955 230 HD22 LEU 11 1HD2 LEU 11 3.628 -11.530 -2.049 231 HD23 LEU 11 2HD2 LEU 11 3.518 -9.884 -2.693 232 H VAL 12 H VAL 12 5.302 -15.388 -4.357 233 HA VAL 12 HA VAL 12 8.042 -14.533 -4.465 234 HB VAL 12 HB VAL 12 6.860 -17.316 -4.089 235 HG11 VAL 12 1HG1 VAL 12 9.044 -17.895 -3.019 236 HG12 VAL 12 2HG1 VAL 12 9.201 -17.596 -4.750 237 HG13 VAL 12 3HG1 VAL 12 9.709 -16.348 -3.588 238 HG21 VAL 12 3HG2 VAL 12 7.286 -16.905 -1.696 239 HG22 VAL 12 1HG2 VAL 12 7.907 -15.281 -2.073 240 HG23 VAL 12 2HG2 VAL 12 6.200 -15.677 -2.350 241 H GLU 13 H GLU 13 6.203 -16.763 -6.564 242 HA GLU 13 HA GLU 13 8.238 -17.424 -8.429 243 HB2 GLU 13 2HB GLU 13 5.216 -17.260 -8.535 244 HB3 GLU 13 3HB GLU 13 6.128 -17.565 -10.004 245 HG2 GLU 13 2HG GLU 13 7.122 -19.558 -9.105 246 HG3 GLU 13 3HG GLU 13 6.561 -19.202 -7.471 247 H ALA 14 H ALA 14 5.874 -14.615 -8.567 248 HA ALA 14 HA ALA 14 6.933 -13.578 -10.981 249 HB1 ALA 14 3HB ALA 14 5.771 -11.528 -10.271 250 HB2 ALA 14 1HB ALA 14 4.790 -12.987 -9.976 251 HB3 ALA 14 2HB ALA 14 5.620 -12.169 -8.620 252 H LEU 15 H LEU 15 7.838 -12.778 -7.568 253 HA LEU 15 HA LEU 15 9.870 -10.907 -8.189 254 HB2 LEU 15 2HB LEU 15 9.262 -12.707 -5.843 255 HB3 LEU 15 3HB LEU 15 10.881 -12.050 -5.941 256 HG LEU 15 HG LEU 15 9.540 -10.681 -4.511 257 HD11 LEU 15 1HD1 LEU 15 11.314 -9.595 -5.863 258 HD12 LEU 15 2HD1 LEU 15 10.097 -9.122 -7.068 259 HD13 LEU 15 3HD1 LEU 15 10.003 -8.492 -5.417 260 HD21 LEU 15 3HD2 LEU 15 7.668 -9.272 -5.465 261 HD22 LEU 15 1HD2 LEU 15 7.648 -10.360 -6.864 262 HD23 LEU 15 2HD2 LEU 15 7.311 -10.986 -5.239 263 H TYR 16 H TYR 16 10.125 -14.487 -8.128 264 HA TYR 16 HA TYR 16 12.933 -14.525 -8.742 265 HB2 TYR 16 2HB TYR 16 11.655 -16.511 -7.976 266 HB3 TYR 16 3HB TYR 16 10.795 -16.536 -9.519 267 HD1 TYR 16 HD1 TYR 16 14.161 -16.895 -7.946 268 HD2 TYR 16 HD2 TYR 16 11.834 -17.335 -11.552 269 HE1 TYR 16 HE1 TYR 16 16.089 -18.011 -9.051 270 HE2 TYR 16 HE2 TYR 16 13.757 -18.445 -12.662 271 HH TYR 16 HH TYR 16 16.891 -18.977 -10.978 272 H LEU 17 H LEU 17 10.048 -14.425 -10.915 273 HA LEU 17 HA LEU 17 11.621 -14.592 -13.323 274 HB2 LEU 17 2HB LEU 17 8.802 -13.507 -12.851 275 HB3 LEU 17 3HB LEU 17 9.502 -13.827 -14.430 276 HG LEU 17 HG LEU 17 9.017 -15.946 -12.317 277 HD11 LEU 17 1HD1 LEU 17 7.450 -15.288 -14.844 278 HD12 LEU 17 2HD1 LEU 17 7.140 -16.654 -13.748 279 HD13 LEU 17 3HD1 LEU 17 6.914 -14.994 -13.174 280 HD21 LEU 17 3HD2 LEU 17 9.860 -16.196 -15.236 281 HD22 LEU 17 1HD2 LEU 17 10.847 -16.609 -13.815 282 HD23 LEU 17 2HD2 LEU 17 9.397 -17.549 -14.182 283 H VAL 18 H VAL 18 10.415 -11.746 -11.525 284 HA VAL 18 HA VAL 18 11.526 -9.945 -13.564 285 HB VAL 18 HB VAL 18 11.061 -8.498 -11.080 286 HG11 VAL 18 1HG1 VAL 18 9.616 -7.170 -12.488 287 HG12 VAL 18 2HG1 VAL 18 11.146 -7.490 -13.319 288 HG13 VAL 18 3HG1 VAL 18 9.686 -8.399 -13.780 289 HG21 VAL 18 3HG2 VAL 18 9.535 -9.998 -10.343 290 HG22 VAL 18 1HG2 VAL 18 8.613 -8.702 -11.099 291 HG23 VAL 18 2HG2 VAL 18 8.779 -10.240 -11.967 292 H CYS 19 H CYS 19 12.579 -10.987 -10.293 293 HA CYS 19 HA CYS 19 14.943 -9.214 -10.553 294 HB2 CYS 19 2HB CYS 19 13.386 -9.059 -8.601 295 HB3 CYS 19 3HB CYS 19 13.909 -10.673 -8.113 296 H GLY 20 H GLY 20 14.169 -12.633 -9.770 297 HA2 GLY 20 HA2 GLY 20 16.885 -13.296 -9.011 298 HA3 GLY 20 HA3 GLY 20 15.518 -14.421 -9.180 299 H GLU 21 H GLU 21 14.862 -14.498 -11.705 300 HA GLU 21 HA GLU 21 16.759 -16.017 -13.115 301 HB2 GLU 21 2HB GLU 21 14.274 -15.969 -13.410 302 HB3 GLU 21 3HB GLU 21 14.416 -14.381 -14.152 303 HG2 GLU 21 2HG GLU 21 14.156 -15.944 -15.891 304 HG3 GLU 21 3HG GLU 21 15.825 -15.411 -15.972 305 H ARG 22 H ARG 22 16.096 -12.530 -13.208 306 HA ARG 22 HA ARG 22 17.908 -12.001 -15.438 307 HB2 ARG 22 2HB ARG 22 16.554 -9.929 -13.686 308 HB3 ARG 22 3HB ARG 22 17.112 -9.781 -15.359 309 HG2 ARG 22 2HG ARG 22 15.347 -11.605 -15.918 310 HG3 ARG 22 3HG ARG 22 14.719 -11.315 -14.291 311 HD2 ARG 22 2HD ARG 22 14.520 -8.847 -14.961 312 HD3 ARG 22 3HD ARG 22 14.840 -9.384 -16.622 313 HE ARG 22 HE ARG 22 12.765 -10.947 -15.322 314 HH11 ARG 22 1HH1 ARG 22 13.187 -7.834 -16.951 315 HH12 ARG 22 2HH1 ARG 22 11.507 -7.735 -17.388 316 HH21 ARG 22 1HH2 ARG 22 10.662 -10.786 -15.926 317 HH22 ARG 22 2HH2 ARG 22 10.080 -9.399 -16.806 318 H GLY 23 H GLY 23 18.491 -12.605 -12.232 319 HA2 GLY 23 HA2 GLY 23 20.590 -10.563 -11.738 320 HA3 GLY 23 HA3 GLY 23 19.918 -11.751 -10.593 321 H HIS 24 H HIS 24 20.295 -14.166 -11.667 322 HA HIS 24 HA HIS 24 23.137 -14.550 -11.362 323 HB2 HIS 24 2HB HIS 24 22.686 -16.833 -11.336 324 HB3 HIS 24 3HB HIS 24 21.251 -16.110 -10.622 325 HD2 HIS 24 HD2 HIS 24 19.072 -15.891 -12.423 326 HE1 HIS 24 HE1 HIS 24 20.378 -19.053 -14.944 327 HE2 HIS 24 HE2 HIS 24 18.405 -17.548 -14.359 328 H PHE 25 H PHE 25 21.212 -14.022 -14.166 329 HA PHE 25 HA PHE 25 23.477 -14.158 -15.997 330 HB2 PHE 25 2HB PHE 25 22.699 -16.531 -15.866 331 HB3 PHE 25 3HB PHE 25 21.084 -16.017 -16.329 332 HD1 PHE 25 HD1 PHE 25 24.662 -15.833 -17.516 333 HD2 PHE 25 HD2 PHE 25 20.502 -16.122 -18.617 334 HE1 PHE 25 HE1 PHE 25 25.306 -16.059 -19.904 335 HE2 PHE 25 HE2 PHE 25 21.147 -16.344 -20.999 336 HZ PHE 25 HZ PHE 25 23.552 -16.313 -21.650 337 H TYR 26 H TYR 26 22.887 -13.301 -18.152 338 HA TYR 26 HA TYR 26 21.166 -10.985 -17.902 339 HB2 TYR 26 2HB TYR 26 23.299 -11.037 -19.175 340 HB3 TYR 26 3HB TYR 26 22.558 -12.125 -20.348 341 HD1 TYR 26 HD2 TYR 26 21.994 -8.796 -18.690 342 HD2 TYR 26 HD1 TYR 26 21.541 -11.151 -22.281 343 HE1 TYR 26 HE2 TYR 26 21.067 -6.821 -19.867 344 HE2 TYR 26 HE1 TYR 26 20.667 -9.165 -23.473 345 HH TYR 26 HH TYR 26 20.091 -6.933 -23.325 346 H THR 27 H THR 27 19.334 -10.434 -19.040 347 HA THR 27 HA THR 27 17.903 -12.518 -20.619 348 HB THR 27 HB THR 27 15.742 -11.545 -19.774 349 HG1 THR 27 HG1 THR 27 16.740 -9.678 -18.826 350 HG21 THR 27 1HG2 THR 27 15.705 -12.927 -17.785 351 HG22 THR 27 2HG2 THR 27 16.688 -13.739 -19.010 352 HG23 THR 27 3HG2 THR 27 17.478 -12.896 -17.660 353 HA PRO 28 HA PRO 28 18.344 -9.022 -23.372 354 HB2 PRO 28 2HB PRO 28 17.552 -10.120 -25.718 355 HB3 PRO 28 3HB PRO 28 19.053 -10.630 -24.896 356 HG2 PRO 28 2HG PRO 28 16.325 -11.962 -24.755 357 HG3 PRO 28 3HG PRO 28 17.908 -12.726 -25.119 358 HD2 PRO 28 2HD PRO 28 16.836 -12.735 -22.608 359 HD3 PRO 28 3HD PRO 28 18.600 -12.581 -22.871 360 H LYS 29 H LYS 29 17.084 -7.576 -24.675 361 HA LYS 29 HA LYS 29 14.338 -7.307 -23.579 362 HB2 LYS 29 2HB LYS 29 16.065 -5.212 -24.940 363 HB3 LYS 29 3HB LYS 29 14.617 -4.944 -23.978 364 HG2 LYS 29 2HG LYS 29 17.344 -5.860 -22.990 365 HG3 LYS 29 3HG LYS 29 16.565 -4.309 -22.704 366 HD2 LYS 29 2HD LYS 29 14.787 -5.427 -21.380 367 HD3 LYS 29 3HD LYS 29 15.574 -6.992 -21.614 368 HE2 LYS 29 2HE LYS 29 16.848 -4.586 -20.239 369 HE3 LYS 29 3HE LYS 29 16.061 -5.930 -19.407 370 HZ1 LYS 29 HZ1 LYS 29 18.485 -6.153 -21.104 371 HZ2 LYS 29 HZ2 LYS 29 18.421 -6.298 -19.477 372 HZ3 LYS 29 HZ3 LYS 29 17.716 -7.430 -20.429 373 H THR 30 H THR 30 12.668 -6.304 -24.852 374 HA THR 30 HA THR 30 12.390 -7.467 -27.567 375 HB THR 30 HB THR 30 10.395 -5.926 -25.866 376 HG1 THR 30 HG1 THR 30 11.030 -7.967 -25.041 377 HG21 THR 30 1HG2 THR 30 8.715 -6.940 -27.405 378 HG22 THR 30 2HG2 THR 30 9.777 -5.807 -28.247 379 HG23 THR 30 3HG2 THR 30 10.035 -7.557 -28.426 Start of MODEL 20 1 H1 GLY 1 1H GLY 1 4.107 -2.883 2.421 2 H2 GLY 1 2H GLY 1 5.062 -2.050 1.373 3 H3 GLY 1 3H GLY 1 5.650 -2.527 2.831 4 HA2 GLY 1 HA2 GLY 1 6.547 -3.984 1.200 5 HA3 GLY 1 HA3 GLY 1 5.383 -4.859 2.212 6 H ILE 2 H ILE 2 6.039 -5.892 -0.175 7 HA ILE 2 HA ILE 2 4.447 -5.049 -2.391 8 HB ILE 2 HB ILE 2 6.585 -6.207 -2.610 9 HG12 ILE 2 2HG1 ILE 2 6.133 -7.762 -4.391 10 HG13 ILE 2 3HG1 ILE 2 4.441 -7.907 -3.902 11 HG21 ILE 2 1HG2 ILE 2 6.462 -7.810 -0.746 12 HG22 ILE 2 2HG2 ILE 2 5.214 -8.731 -1.608 13 HG23 ILE 2 3HG2 ILE 2 6.854 -8.612 -2.265 14 HD11 ILE 2 3HD1 ILE 2 5.798 -5.428 -5.007 15 HD12 ILE 2 1HD1 ILE 2 4.691 -6.500 -5.879 16 HD13 ILE 2 2HD1 ILE 2 4.083 -5.520 -4.539 17 H VAL 3 H VAL 3 3.636 -7.403 0.132 18 HA VAL 3 HA VAL 3 1.635 -8.792 -1.396 19 HB VAL 3 HB VAL 3 1.955 -8.511 1.614 20 HG11 VAL 3 1HG1 VAL 3 0.436 -10.483 1.803 21 HG12 VAL 3 2HG1 VAL 3 -0.415 -9.068 1.184 22 HG13 VAL 3 3HG1 VAL 3 0.076 -10.362 0.069 23 HG21 VAL 3 3HG2 VAL 3 2.541 -10.812 -0.305 24 HG22 VAL 3 1HG2 VAL 3 3.769 -9.745 0.415 25 HG23 VAL 3 2HG2 VAL 3 2.817 -10.819 1.449 26 H GLU 4 H GLU 4 1.289 -6.100 0.989 27 HA GLU 4 HA GLU 4 -1.513 -5.701 0.435 28 HB2 GLU 4 2HB GLU 4 -1.314 -3.760 1.832 29 HB3 GLU 4 3HB GLU 4 -0.504 -5.114 2.590 30 HG2 GLU 4 2HG GLU 4 1.121 -3.133 0.958 31 HG3 GLU 4 3HG GLU 4 0.532 -2.684 2.548 32 H GLN 5 H GLN 5 0.950 -5.197 -1.696 33 HA GLN 5 HA GLN 5 -0.602 -3.071 -3.118 34 HB2 GLN 5 2HB GLN 5 1.733 -2.481 -2.958 35 HB3 GLN 5 3HB GLN 5 2.234 -4.061 -3.554 36 HG2 GLN 5 2HG GLN 5 2.412 -2.384 -5.300 37 HG3 GLN 5 3HG GLN 5 1.237 -3.603 -5.755 38 HE21 GLN 5 2HE2 GLN 5 -1.165 -2.968 -5.552 39 HE22 GLN 5 1HE2 GLN 5 -1.524 -1.265 -5.745 40 H CYS 6 H CYS 6 1.124 -6.211 -3.826 41 HA CYS 6 HA CYS 6 -0.450 -6.331 -6.279 42 HB2 CYS 6 2HB CYS 6 2.075 -6.757 -5.901 43 HB3 CYS 6 3HB CYS 6 1.550 -8.396 -5.512 44 H CYS 7 H CYS 7 -0.598 -8.064 -3.237 45 HA CYS 7 HA CYS 7 -2.331 -10.182 -4.227 46 HB2 CYS 7 2HB CYS 7 -0.888 -10.285 -2.169 47 HB3 CYS 7 3HB CYS 7 -2.011 -9.181 -1.382 48 H THR 8 H THR 8 -2.942 -6.914 -3.207 49 HA THR 8 HA THR 8 -5.875 -7.363 -3.009 50 HB THR 8 HB THR 8 -4.612 -6.117 -1.247 51 HG1 THR 8 HG1 THR 8 -6.248 -4.568 -1.098 52 HG21 THR 8 1HG2 THR 8 -3.077 -4.856 -2.685 53 HG22 THR 8 2HG2 THR 8 -4.437 -3.928 -3.362 54 HG23 THR 8 3HG2 THR 8 -4.021 -3.781 -1.641 55 H SER 9 H SER 9 -3.534 -5.662 -5.108 56 HA SER 9 HA SER 9 -5.558 -5.438 -7.223 57 HB2 SER 9 2HB SER 9 -5.286 -3.084 -7.553 58 HB3 SER 9 3HB SER 9 -5.869 -3.386 -5.913 59 HG SER 9 HG SER 9 -4.219 -1.819 -5.921 60 H ILE 10 H ILE 10 -4.473 -4.441 -9.272 61 HA ILE 10 HA ILE 10 -2.391 -6.357 -9.799 62 HB ILE 10 HB ILE 10 -3.636 -4.206 -11.557 63 HG12 ILE 10 2HG1 ILE 10 -4.087 -7.170 -11.028 64 HG13 ILE 10 3HG1 ILE 10 -5.218 -5.841 -10.823 65 HG21 ILE 10 1HG2 ILE 10 -1.665 -6.411 -12.242 66 HG22 ILE 10 2HG2 ILE 10 -2.599 -5.504 -13.457 67 HG23 ILE 10 3HG2 ILE 10 -1.424 -4.672 -12.456 68 HD11 ILE 10 3HD1 ILE 10 -4.278 -6.991 -13.465 69 HD12 ILE 10 1HD1 ILE 10 -5.856 -7.180 -12.669 70 HD13 ILE 10 2HD1 ILE 10 -5.358 -5.576 -13.260 71 H CYS 11 H CYS 11 -0.261 -6.229 -9.709 72 HA CYS 11 HA CYS 11 1.048 -3.550 -9.847 73 HB2 CYS 11 2HB CYS 11 2.921 -4.368 -8.731 74 HB3 CYS 11 3HB CYS 11 1.529 -4.815 -7.762 75 H SER 12 H SER 12 2.709 -3.207 -11.256 76 HA SER 12 HA SER 12 3.015 -5.140 -13.528 77 HB2 SER 12 2HB SER 12 3.671 -2.185 -13.351 78 HB3 SER 12 3HB SER 12 3.859 -3.223 -14.776 79 HG SER 12 HG SER 12 1.860 -1.986 -14.732 80 H LEU 13 H LEU 13 5.132 -5.443 -14.503 81 HA LEU 13 HA LEU 13 6.922 -6.434 -12.551 82 HB2 LEU 13 2HB LEU 13 8.378 -6.917 -14.395 83 HB3 LEU 13 3HB LEU 13 6.754 -7.471 -14.703 84 HG LEU 13 HG LEU 13 7.813 -4.882 -15.906 85 HD11 LEU 13 1HD1 LEU 13 8.477 -6.194 -17.891 86 HD12 LEU 13 2HD1 LEU 13 9.397 -6.680 -16.460 87 HD13 LEU 13 3HD1 LEU 13 8.060 -7.700 -17.040 88 HD21 LEU 13 3HD2 LEU 13 5.397 -5.133 -16.200 89 HD22 LEU 13 1HD2 LEU 13 6.209 -5.399 -17.735 90 HD23 LEU 13 2HD2 LEU 13 5.619 -6.790 -16.810 91 H TYR 14 H TYR 14 6.989 -3.457 -14.386 92 HA TYR 14 HA TYR 14 9.662 -2.707 -13.805 93 HB2 TYR 14 2HB TYR 14 8.992 -0.557 -14.757 94 HB3 TYR 14 3HB TYR 14 8.429 -1.937 -15.722 95 HD1 TYR 14 HD1 TYR 14 7.254 0.603 -13.193 96 HD2 TYR 14 HD2 TYR 14 6.196 -2.066 -16.415 97 HE1 TYR 14 HE1 TYR 14 4.954 1.530 -13.200 98 HE2 TYR 14 HE2 TYR 14 3.907 -1.099 -16.460 99 HH TYR 14 HH TYR 14 2.869 1.474 -14.182 100 H GLN 15 H GLN 15 6.997 -2.674 -11.755 101 HA GLN 15 HA GLN 15 8.243 -0.635 -9.937 102 HB2 GLN 15 2HB GLN 15 5.954 -0.244 -9.027 103 HB3 GLN 15 3HB GLN 15 6.170 0.288 -10.700 104 HG2 GLN 15 2HG GLN 15 4.988 -1.656 -11.544 105 HG3 GLN 15 3HG GLN 15 4.891 -2.361 -9.915 106 HE21 GLN 15 2HE2 GLN 15 4.180 1.118 -10.169 107 HE22 GLN 15 1HE2 GLN 15 2.446 0.879 -10.042 108 H LEU 16 H LEU 16 6.891 -3.926 -10.253 109 HA LEU 16 HA LEU 16 7.014 -4.441 -7.435 110 HB2 LEU 16 2HB LEU 16 6.008 -6.368 -7.905 111 HB3 LEU 16 3HB LEU 16 5.673 -5.542 -9.407 112 HG LEU 16 HG LEU 16 7.855 -6.655 -10.269 113 HD11 LEU 16 1HD1 LEU 16 8.922 -7.753 -8.524 114 HD12 LEU 16 2HD1 LEU 16 7.402 -8.125 -7.676 115 HD13 LEU 16 3HD1 LEU 16 7.911 -9.081 -9.072 116 HD21 LEU 16 3HD2 LEU 16 5.419 -8.415 -9.655 117 HD22 LEU 16 1HD2 LEU 16 5.503 -7.245 -10.991 118 HD23 LEU 16 2HD2 LEU 16 6.588 -8.647 -10.974 119 H GLU 17 H GLU 17 9.426 -4.674 -10.017 120 HA GLU 17 HA GLU 17 11.489 -6.166 -8.756 121 HB2 GLU 17 2HB GLU 17 11.617 -3.667 -10.513 122 HB3 GLU 17 3HB GLU 17 13.065 -4.472 -9.900 123 HG2 GLU 17 2HG GLU 17 12.302 -6.594 -10.967 124 HG3 GLU 17 3HG GLU 17 11.008 -5.662 -11.740 125 H ASN 18 H ASN 18 10.379 -2.912 -8.244 126 HA ASN 18 HA ASN 18 12.510 -1.793 -6.784 127 HB2 ASN 18 2HB ASN 18 10.145 -0.898 -7.714 128 HB3 ASN 18 3HB ASN 18 9.688 -1.058 -6.021 129 HD21 ASN 18 1HD2 ASN 18 11.666 0.609 -8.389 130 HD22 ASN 18 2HD2 ASN 18 12.268 1.857 -7.316 131 H TYR 19 H TYR 19 10.066 -4.050 -5.679 132 HA TYR 19 HA TYR 19 10.553 -3.691 -2.811 133 HB2 TYR 19 2HB TYR 19 8.935 -5.700 -4.428 134 HB3 TYR 19 3HB TYR 19 8.942 -5.594 -2.684 135 HD1 TYR 19 HD2 TYR 19 8.007 -3.708 -5.793 136 HD2 TYR 19 HD1 TYR 19 7.638 -4.008 -1.505 137 HE1 TYR 19 HE2 TYR 19 6.095 -2.117 -5.842 138 HE2 TYR 19 HE1 TYR 19 5.704 -2.466 -1.553 139 HH TYR 19 HH TYR 19 4.335 -1.146 -2.865 140 H CYS 20 H CYS 20 12.169 -5.431 -5.295 141 HA CYS 20 HA CYS 20 13.025 -7.730 -3.700 142 HB2 CYS 20 2HB CYS 20 12.843 -7.557 -6.247 143 HB3 CYS 20 3HB CYS 20 14.308 -6.575 -6.194 144 H ASN 21 H ASN 21 14.119 -4.447 -4.054 145 HA ASN 21 HA ASN 21 16.829 -4.799 -3.022 146 HB2 ASN 21 2HB ASN 21 16.271 -3.042 -4.649 147 HB3 ASN 21 3HB ASN 21 15.089 -2.344 -3.544 148 HD21 ASN 21 2HD2 ASN 21 16.047 -1.722 -1.334 149 HD22 ASN 21 1HD2 ASN 21 17.585 -0.844 -1.417 150 H1 PHE 1 1H PHE 1 5.610 -10.811 -19.977 151 H2 PHE 1 2H PHE 1 5.455 -12.434 -19.818 152 H3 PHE 1 3H PHE 1 6.842 -11.701 -19.356 153 HA PHE 1 HA PHE 1 5.474 -12.318 -17.454 154 HB2 PHE 1 2HB PHE 1 7.066 -10.348 -17.424 155 HB3 PHE 1 3HB PHE 1 5.708 -9.297 -17.792 156 HD1 PHE 1 HD2 PHE 1 7.080 -11.715 -15.276 157 HD2 PHE 1 HD1 PHE 1 4.245 -8.538 -16.016 158 HE1 PHE 1 HE2 PHE 1 6.549 -11.613 -12.855 159 HE2 PHE 1 HE1 PHE 1 3.732 -8.438 -13.596 160 HZ PHE 1 HZ PHE 1 4.856 -9.990 -12.017 161 H VAL 2 H VAL 2 3.543 -11.433 -16.084 162 HA VAL 2 HA VAL 2 1.270 -10.504 -17.770 163 HB VAL 2 HB VAL 2 -0.266 -11.951 -16.356 164 HG11 VAL 2 1HG1 VAL 2 -0.098 -13.842 -17.898 165 HG12 VAL 2 2HG1 VAL 2 0.165 -12.317 -18.757 166 HG13 VAL 2 3HG1 VAL 2 1.548 -13.361 -18.357 167 HG21 VAL 2 3HG2 VAL 2 1.323 -12.804 -14.637 168 HG22 VAL 2 1HG2 VAL 2 0.597 -14.122 -15.556 169 HG23 VAL 2 2HG2 VAL 2 2.258 -13.625 -15.905 170 H ASN 3 H ASN 3 0.577 -8.663 -17.034 171 HA ASN 3 HA ASN 3 0.969 -7.825 -14.227 172 HB2 ASN 3 2HB ASN 3 -0.408 -6.462 -16.569 173 HB3 ASN 3 3HB ASN 3 -0.182 -5.754 -14.972 174 HD21 ASN 3 1HD2 ASN 3 0.777 -4.581 -17.392 175 HD22 ASN 3 2HD2 ASN 3 2.530 -4.571 -17.311 176 H GLN 4 H GLN 4 -0.308 -8.623 -12.729 177 HA GLN 4 HA GLN 4 -3.199 -8.647 -12.889 178 HB2 GLN 4 2HB GLN 4 -3.460 -11.093 -12.566 179 HB3 GLN 4 3HB GLN 4 -2.872 -10.661 -14.167 180 HG2 GLN 4 2HG GLN 4 -0.698 -11.349 -13.707 181 HG3 GLN 4 3HG GLN 4 -0.932 -11.413 -11.956 182 HE21 GLN 4 1HE2 GLN 4 -2.179 -13.179 -11.005 183 HE22 GLN 4 2HE2 GLN 4 -2.428 -14.654 -11.936 184 H HIS 5 H HIS 5 -3.969 -10.079 -10.908 185 HA HIS 5 HA HIS 5 -2.737 -9.042 -8.461 186 HB2 HIS 5 2HB HIS 5 -4.965 -11.081 -8.879 187 HB3 HIS 5 3HB HIS 5 -4.544 -10.279 -7.368 188 HD2 HIS 5 HD2 HIS 5 -6.117 -9.500 -10.836 189 HE1 HIS 5 HE1 HIS 5 -7.143 -6.292 -8.261 190 HE2 HIS 5 HE2 HIS 5 -7.567 -7.339 -10.543 191 H LEU 6 H LEU 6 -1.365 -10.163 -7.133 192 HA LEU 6 HA LEU 6 -0.680 -13.020 -7.685 193 HB2 LEU 6 2HB LEU 6 1.265 -10.689 -7.556 194 HB3 LEU 6 3HB LEU 6 1.739 -12.383 -7.555 195 HG LEU 6 HG LEU 6 0.291 -10.998 -9.860 196 HD11 LEU 6 1HD1 LEU 6 2.492 -10.026 -9.566 197 HD12 LEU 6 2HD1 LEU 6 3.217 -11.633 -9.386 198 HD13 LEU 6 3HD1 LEU 6 2.546 -11.125 -10.956 199 HD21 LEU 6 3HD2 LEU 6 -0.057 -13.476 -9.805 200 HD22 LEU 6 1HD2 LEU 6 0.960 -12.983 -11.162 201 HD23 LEU 6 2HD2 LEU 6 1.701 -13.704 -9.716 202 H CYS 7 H CYS 7 -0.303 -14.176 -5.859 203 HA CYS 7 HA CYS 7 0.460 -12.849 -3.352 204 HB2 CYS 7 2HB CYS 7 -2.120 -12.712 -3.809 205 HB3 CYS 7 3HB CYS 7 -2.133 -14.401 -3.330 206 H GLY 8 H GLY 8 1.247 -14.270 -1.779 207 HA2 GLY 8 HA2 GLY 8 2.379 -16.150 -1.011 208 HA3 GLY 8 HA3 GLY 8 1.084 -17.089 -1.768 209 H SER 9 H SER 9 1.978 -18.665 -2.929 210 HA SER 9 HA SER 9 4.540 -18.835 -4.030 211 HB2 SER 9 3HB SER 9 2.001 -20.123 -5.100 212 HB3 SER 9 2HB SER 9 3.666 -20.686 -5.339 213 HG SER 9 HG SER 9 2.598 -21.829 -3.635 214 H HIS 10 H HIS 10 1.577 -17.514 -5.622 215 HA HIS 10 HA HIS 10 2.749 -17.249 -8.219 216 HB2 HIS 10 2HB HIS 10 0.235 -16.667 -6.945 217 HB3 HIS 10 3HB HIS 10 0.771 -15.183 -7.704 218 HD2 HIS 10 HD2 HIS 10 -1.361 -17.906 -8.526 219 HE1 HIS 10 HE1 HIS 10 0.489 -17.094 -12.275 220 HE2 HIS 10 HE2 HIS 10 -1.455 -18.283 -11.129 221 H LEU 11 H LEU 11 2.765 -15.126 -5.408 222 HA LEU 11 HA LEU 11 3.998 -12.857 -6.764 223 HB2 LEU 11 2HB LEU 11 2.448 -12.884 -4.687 224 HB3 LEU 11 3HB LEU 11 3.853 -13.412 -3.774 225 HG LEU 11 HG LEU 11 5.026 -11.278 -4.467 226 HD11 LEU 11 1HD1 LEU 11 3.674 -10.756 -6.524 227 HD12 LEU 11 2HD1 LEU 11 2.253 -10.503 -5.481 228 HD13 LEU 11 3HD1 LEU 11 3.650 -9.429 -5.363 229 HD21 LEU 11 3HD2 LEU 11 3.655 -9.845 -2.939 230 HD22 LEU 11 1HD2 LEU 11 2.334 -11.015 -3.035 231 HD23 LEU 11 2HD2 LEU 11 3.884 -11.478 -2.291 232 H VAL 12 H VAL 12 5.171 -15.449 -4.582 233 HA VAL 12 HA VAL 12 7.940 -14.747 -4.617 234 HB VAL 12 HB VAL 12 6.597 -17.468 -4.367 235 HG11 VAL 12 1HG1 VAL 12 8.732 -18.239 -3.320 236 HG12 VAL 12 2HG1 VAL 12 8.913 -17.891 -5.040 237 HG13 VAL 12 3HG1 VAL 12 9.508 -16.724 -3.835 238 HG21 VAL 12 3HG2 VAL 12 7.797 -15.605 -2.272 239 HG22 VAL 12 1HG2 VAL 12 6.066 -15.829 -2.573 240 HG23 VAL 12 2HG2 VAL 12 7.027 -17.180 -1.968 241 H GLU 13 H GLU 13 6.079 -16.856 -6.840 242 HA GLU 13 HA GLU 13 8.162 -17.482 -8.669 243 HB2 GLU 13 2HB GLU 13 5.146 -17.283 -8.883 244 HB3 GLU 13 3HB GLU 13 6.115 -17.492 -10.332 245 HG2 GLU 13 2HG GLU 13 7.165 -19.517 -9.387 246 HG3 GLU 13 3HG GLU 13 6.243 -19.323 -7.895 247 H ALA 14 H ALA 14 5.876 -14.626 -8.758 248 HA ALA 14 HA ALA 14 6.997 -13.523 -11.114 249 HB1 ALA 14 3HB ALA 14 4.854 -12.905 -10.149 250 HB2 ALA 14 1HB ALA 14 5.661 -12.169 -8.734 251 HB3 ALA 14 2HB ALA 14 5.881 -11.463 -10.348 252 H LEU 15 H LEU 15 7.883 -12.845 -7.667 253 HA LEU 15 HA LEU 15 9.978 -11.015 -8.258 254 HB2 LEU 15 2HB LEU 15 9.290 -12.797 -5.914 255 HB3 LEU 15 3HB LEU 15 10.911 -12.147 -5.988 256 HG LEU 15 HG LEU 15 9.579 -10.766 -4.580 257 HD11 LEU 15 1HD1 LEU 15 10.030 -8.575 -5.503 258 HD12 LEU 15 2HD1 LEU 15 11.347 -9.680 -5.935 259 HD13 LEU 15 3HD1 LEU 15 10.135 -9.222 -7.147 260 HD21 LEU 15 3HD2 LEU 15 7.351 -11.113 -5.348 261 HD22 LEU 15 1HD2 LEU 15 7.690 -9.385 -5.461 262 HD23 LEU 15 2HD2 LEU 15 7.689 -10.385 -6.930 263 H TYR 16 H TYR 16 10.106 -14.601 -8.214 264 HA TYR 16 HA TYR 16 12.925 -14.744 -8.759 265 HB2 TYR 16 2HB TYR 16 11.571 -16.716 -8.100 266 HB3 TYR 16 3HB TYR 16 10.724 -16.638 -9.651 267 HD1 TYR 16 HD2 TYR 16 14.092 -17.136 -8.101 268 HD2 TYR 16 HD1 TYR 16 11.702 -17.482 -11.677 269 HE1 TYR 16 HE2 TYR 16 15.967 -18.307 -9.237 270 HE2 TYR 16 HE1 TYR 16 13.570 -18.664 -12.812 271 HH TYR 16 HH TYR 16 16.707 -19.295 -11.180 272 H LEU 17 H LEU 17 10.100 -14.559 -11.007 273 HA LEU 17 HA LEU 17 11.679 -14.690 -13.382 274 HB2 LEU 17 2HB LEU 17 8.957 -13.385 -12.892 275 HB3 LEU 17 3HB LEU 17 9.664 -13.649 -14.473 276 HG LEU 17 HG LEU 17 8.959 -15.883 -12.549 277 HD11 LEU 17 1HD1 LEU 17 7.037 -16.275 -14.066 278 HD12 LEU 17 2HD1 LEU 17 6.950 -14.688 -13.287 279 HD13 LEU 17 3HD1 LEU 17 7.471 -14.811 -14.980 280 HD21 LEU 17 3HD2 LEU 17 9.818 -15.932 -15.469 281 HD22 LEU 17 1HD2 LEU 17 10.718 -16.589 -14.082 282 HD23 LEU 17 2HD2 LEU 17 9.190 -17.329 -14.567 283 H VAL 18 H VAL 18 10.455 -11.775 -11.664 284 HA VAL 18 HA VAL 18 11.772 -10.052 -13.603 285 HB VAL 18 HB VAL 18 11.243 -8.567 -11.153 286 HG11 VAL 18 1HG1 VAL 18 9.871 -7.228 -12.651 287 HG12 VAL 18 2HG1 VAL 18 11.444 -7.572 -13.385 288 HG13 VAL 18 3HG1 VAL 18 10.006 -8.473 -13.922 289 HG21 VAL 18 3HG2 VAL 18 8.802 -8.682 -11.244 290 HG22 VAL 18 1HG2 VAL 18 8.933 -10.230 -12.101 291 HG23 VAL 18 2HG2 VAL 18 9.647 -10.008 -10.455 292 H CYS 19 H CYS 19 12.643 -11.077 -10.278 293 HA CYS 19 HA CYS 19 15.056 -9.340 -10.428 294 HB2 CYS 19 2HB CYS 19 13.322 -9.000 -8.642 295 HB3 CYS 19 3HB CYS 19 13.757 -10.583 -7.994 296 H GLY 20 H GLY 20 14.091 -12.718 -9.713 297 HA2 GLY 20 HA2 GLY 20 16.714 -13.453 -8.652 298 HA3 GLY 20 HA3 GLY 20 15.322 -14.527 -8.922 299 H GLU 21 H GLU 21 15.001 -14.093 -11.697 300 HA GLU 21 HA GLU 21 17.019 -15.871 -12.738 301 HB2 GLU 21 2HB GLU 21 14.538 -15.938 -13.133 302 HB3 GLU 21 3HB GLU 21 14.703 -14.539 -14.201 303 HG2 GLU 21 2HG GLU 21 15.955 -15.806 -15.798 304 HG3 GLU 21 3HG GLU 21 16.346 -17.054 -14.603 305 H ARG 22 H ARG 22 17.299 -12.630 -12.331 306 HA ARG 22 HA ARG 22 18.119 -11.521 -14.767 307 HB2 ARG 22 2HB ARG 22 18.749 -10.923 -11.863 308 HB3 ARG 22 3HB ARG 22 19.464 -9.950 -13.134 309 HG2 ARG 22 2HG ARG 22 16.453 -10.339 -12.881 310 HG3 ARG 22 3HG ARG 22 17.356 -9.010 -12.135 311 HD2 ARG 22 2HD ARG 22 18.221 -8.357 -14.390 312 HD3 ARG 22 3HD ARG 22 17.196 -9.603 -15.116 313 HE ARG 22 HE ARG 22 15.599 -7.889 -13.468 314 HH11 ARG 22 1HH2 ARG 22 17.179 -7.908 -16.642 315 HH12 ARG 22 2HH2 ARG 22 16.153 -6.646 -17.250 316 HH21 ARG 22 2HH1 ARG 22 14.469 -6.162 -14.241 317 HH22 ARG 22 1HH1 ARG 22 14.589 -5.700 -15.925 318 H GLY 23 H GLY 23 19.783 -14.055 -13.327 319 HA2 GLY 23 HA2 GLY 23 22.520 -13.482 -14.087 320 HA3 GLY 23 HA3 GLY 23 21.773 -15.085 -13.855 321 H HIS 24 H HIS 24 19.697 -14.531 -15.855 322 HA HIS 24 HA HIS 24 21.151 -14.060 -18.404 323 HB2 HIS 24 2HB HIS 24 20.341 -16.073 -19.458 324 HB3 HIS 24 3HB HIS 24 21.290 -16.484 -18.037 325 HD2 HIS 24 HD2 HIS 24 19.989 -17.550 -15.936 326 HE1 HIS 24 HE1 HIS 24 16.289 -18.250 -17.923 327 HE2 HIS 24 HE2 HIS 24 17.646 -18.762 -15.833 328 H PHE 25 H PHE 25 18.140 -14.135 -16.659 329 HA PHE 25 HA PHE 25 16.155 -13.215 -16.897 330 HB2 PHE 25 2HB PHE 25 17.694 -11.225 -16.949 331 HB3 PHE 25 3HB PHE 25 17.507 -11.179 -18.693 332 HD1 PHE 25 HD2 PHE 25 15.366 -11.376 -15.574 333 HD2 PHE 25 HD1 PHE 25 15.822 -9.746 -19.544 334 HE1 PHE 25 HE2 PHE 25 13.294 -10.059 -15.275 335 HE2 PHE 25 HE1 PHE 25 13.741 -8.429 -19.237 336 HZ PHE 25 HZ PHE 25 12.472 -8.581 -17.100 337 H TYR 26 H TYR 26 15.735 -15.288 -18.088 338 HA TYR 26 HA TYR 26 14.523 -14.979 -20.739 339 HB2 TYR 26 2HB TYR 26 15.071 -17.194 -19.832 340 HB3 TYR 26 3HB TYR 26 13.956 -16.937 -18.490 341 HD1 TYR 26 HD1 TYR 26 14.066 -16.911 -22.246 342 HD2 TYR 26 HD2 TYR 26 11.698 -17.699 -18.722 343 HE1 TYR 26 HE1 TYR 26 12.200 -17.684 -23.677 344 HE2 TYR 26 HE2 TYR 26 9.854 -18.536 -20.154 345 HH TYR 26 HH TYR 26 10.060 -18.556 -23.736 346 H THR 27 H THR 27 12.321 -14.648 -21.170 347 HA THR 27 HA THR 27 10.594 -13.581 -18.985 348 HB THR 27 HB THR 27 9.587 -12.024 -20.666 349 HG1 THR 27 HG1 THR 27 11.065 -11.465 -22.396 350 HG21 THR 27 1HG2 THR 27 11.309 -10.312 -20.404 351 HG22 THR 27 2HG2 THR 27 11.204 -11.270 -18.920 352 HG23 THR 27 3HG2 THR 27 12.541 -11.542 -20.057 353 HA PRO 28 HA PRO 28 8.181 -16.864 -20.938 354 HB2 PRO 28 2HB PRO 28 6.348 -17.335 -19.016 355 HB3 PRO 28 3HB PRO 28 8.069 -17.753 -18.779 356 HG2 PRO 28 2HG PRO 28 6.625 -15.255 -17.841 357 HG3 PRO 28 3HG PRO 28 7.667 -16.359 -16.882 358 HD2 PRO 28 2HD PRO 28 8.617 -14.045 -18.015 359 HD3 PRO 28 3HD PRO 28 9.632 -15.513 -17.868 360 H LYS 29 H LYS 29 6.146 -17.084 -21.920 361 HA LYS 29 HA LYS 29 4.075 -15.076 -21.792 362 HB2 LYS 29 2HB LYS 29 4.249 -14.321 -24.072 363 HB3 LYS 29 3HB LYS 29 5.677 -13.862 -23.178 364 HG2 LYS 29 2HG LYS 29 5.676 -16.368 -24.910 365 HG3 LYS 29 3HG LYS 29 5.810 -14.788 -25.652 366 HD2 LYS 29 2HD LYS 29 7.761 -15.841 -23.563 367 HD3 LYS 29 3HD LYS 29 7.988 -15.912 -25.311 368 HE2 LYS 29 2HE LYS 29 7.820 -13.426 -25.442 369 HE3 LYS 29 3HE LYS 29 7.655 -13.354 -23.682 370 HZ1 LYS 29 HZ1 LYS 29 10.020 -14.432 -25.110 371 HZ2 LYS 29 HZ2 LYS 29 9.945 -12.979 -24.356 372 HZ3 LYS 29 HZ3 LYS 29 9.841 -14.346 -23.477 373 H THR 30 H THR 30 2.355 -15.480 -23.343 374 HA THR 30 HA THR 30 0.863 -16.638 -24.594 375 HB THR 30 HB THR 30 2.704 -19.051 -24.663 376 HG1 THR 30 HG1 THR 30 3.323 -18.172 -26.647 377 HG21 THR 30 1HG2 THR 30 0.365 -18.176 -26.420 378 HG22 THR 30 2HG2 THR 30 1.427 -19.571 -26.719 379 HG23 THR 30 3HG2 THR 30 0.373 -19.559 -25.302 Start of MODEL 21 1 H1 GLY 1 1H GLY 1 5.009 -2.815 1.710 2 H2 GLY 1 2H GLY 1 5.650 -3.387 3.106 3 H3 GLY 1 3H GLY 1 4.146 -3.843 2.650 4 HA2 GLY 1 HA2 GLY 1 6.669 -4.523 1.269 5 HA3 GLY 1 HA3 GLY 1 5.687 -5.639 2.237 6 H ILE 2 H ILE 2 6.360 -6.242 -0.383 7 HA ILE 2 HA ILE 2 4.731 -5.292 -2.448 8 HB ILE 2 HB ILE 2 6.792 -6.510 -2.815 9 HG12 ILE 2 2HG1 ILE 2 6.237 -7.988 -4.637 10 HG13 ILE 2 3HG1 ILE 2 4.558 -8.103 -4.095 11 HG21 ILE 2 1HG2 ILE 2 5.395 -9.044 -1.871 12 HG22 ILE 2 2HG2 ILE 2 7.008 -8.941 -2.592 13 HG23 ILE 2 3HG2 ILE 2 6.706 -8.196 -1.025 14 HD11 ILE 2 3HD1 ILE 2 5.990 -5.689 -5.236 15 HD12 ILE 2 1HD1 ILE 2 4.717 -6.655 -6.005 16 HD13 ILE 2 2HD1 ILE 2 4.320 -5.638 -4.618 17 H VAL 3 H VAL 3 3.899 -7.863 -0.197 18 HA VAL 3 HA VAL 3 1.612 -8.877 -1.527 19 HB VAL 3 HB VAL 3 2.102 -8.603 1.467 20 HG11 VAL 3 1HG1 VAL 3 -0.306 -9.069 1.062 21 HG12 VAL 3 2HG1 VAL 3 0.144 -10.450 0.029 22 HG13 VAL 3 3HG1 VAL 3 0.506 -10.468 1.763 23 HG21 VAL 3 3HG2 VAL 3 2.838 -10.961 1.344 24 HG22 VAL 3 1HG2 VAL 3 2.574 -10.966 -0.409 25 HG23 VAL 3 2HG2 VAL 3 3.845 -9.950 0.307 26 H GLU 4 H GLU 4 1.992 -5.923 0.413 27 HA GLU 4 HA GLU 4 -0.865 -5.321 0.512 28 HB2 GLU 4 2HB GLU 4 1.544 -3.595 1.150 29 HB3 GLU 4 3HB GLU 4 -0.139 -3.246 1.565 30 HG2 GLU 4 2HG GLU 4 -0.240 -5.124 3.096 31 HG3 GLU 4 3HG GLU 4 1.371 -5.675 2.626 32 H GLN 5 H GLN 5 1.279 -5.221 -2.047 33 HA GLN 5 HA GLN 5 -0.267 -3.029 -3.391 34 HB2 GLN 5 2HB GLN 5 2.122 -2.559 -3.323 35 HB3 GLN 5 3HB GLN 5 2.494 -4.144 -3.998 36 HG2 GLN 5 2HG GLN 5 2.667 -2.411 -5.697 37 HG3 GLN 5 3HG GLN 5 1.398 -3.545 -6.119 38 HE21 GLN 5 2HE2 GLN 5 -0.895 -2.801 -5.889 39 HE22 GLN 5 1HE2 GLN 5 -1.206 -1.067 -5.921 40 H CYS 6 H CYS 6 1.174 -6.321 -3.923 41 HA CYS 6 HA CYS 6 -0.491 -6.522 -6.356 42 HB2 CYS 6 2HB CYS 6 2.077 -6.928 -6.044 43 HB3 CYS 6 3HB CYS 6 1.550 -8.544 -5.572 44 H CYS 7 H CYS 7 -0.443 -8.101 -3.190 45 HA CYS 7 HA CYS 7 -2.360 -10.151 -4.073 46 HB2 CYS 7 2HB CYS 7 -0.737 -10.426 -2.166 47 HB3 CYS 7 3HB CYS 7 -1.733 -9.301 -1.236 48 H THR 8 H THR 8 -2.587 -6.918 -2.752 49 HA THR 8 HA THR 8 -5.493 -7.038 -2.338 50 HB THR 8 HB THR 8 -3.870 -5.687 -0.933 51 HG1 THR 8 HG1 THR 8 -5.402 -4.043 -0.735 52 HG21 THR 8 1HG2 THR 8 -3.252 -3.469 -1.720 53 HG22 THR 8 2HG2 THR 8 -2.565 -4.704 -2.798 54 HG23 THR 8 3HG2 THR 8 -3.989 -3.765 -3.304 55 H SER 9 H SER 9 -3.324 -5.904 -4.928 56 HA SER 9 HA SER 9 -5.617 -5.498 -6.703 57 HB2 SER 9 2HB SER 9 -5.210 -3.348 -5.402 58 HB3 SER 9 3HB SER 9 -3.699 -3.218 -6.337 59 HG SER 9 HG SER 9 -5.573 -2.127 -7.281 60 H ILE 10 H ILE 10 -4.435 -4.261 -8.796 61 HA ILE 10 HA ILE 10 -2.719 -6.272 -10.026 62 HB ILE 10 HB ILE 10 -3.375 -3.408 -10.836 63 HG12 ILE 10 2HG1 ILE 10 -5.412 -4.802 -10.735 64 HG13 ILE 10 3HG1 ILE 10 -5.034 -4.232 -12.349 65 HG21 ILE 10 1HG2 ILE 10 -1.374 -4.056 -12.035 66 HG22 ILE 10 2HG2 ILE 10 -2.047 -5.657 -12.408 67 HG23 ILE 10 3HG2 ILE 10 -2.718 -4.198 -13.168 68 HD11 ILE 10 3HD1 ILE 10 -5.803 -6.585 -12.312 69 HD12 ILE 10 1HD1 ILE 10 -4.183 -6.416 -13.009 70 HD13 ILE 10 2HD1 ILE 10 -4.379 -7.014 -11.340 71 H CYS 11 H CYS 11 -0.514 -6.391 -10.151 72 HA CYS 11 HA CYS 11 0.918 -3.811 -9.913 73 HB2 CYS 11 2HB CYS 11 2.802 -4.633 -8.834 74 HB3 CYS 11 3HB CYS 11 1.428 -5.104 -7.850 75 H SER 12 H SER 12 2.596 -3.464 -11.253 76 HA SER 12 HA SER 12 2.899 -5.290 -13.613 77 HB2 SER 12 2HB SER 12 3.551 -2.337 -13.359 78 HB3 SER 12 3HB SER 12 3.586 -3.325 -14.826 79 HG SER 12 HG SER 12 1.637 -2.032 -14.562 80 H LEU 13 H LEU 13 4.996 -5.569 -14.578 81 HA LEU 13 HA LEU 13 6.806 -6.532 -12.628 82 HB2 LEU 13 2HB LEU 13 8.259 -7.024 -14.470 83 HB3 LEU 13 3HB LEU 13 6.627 -7.556 -14.801 84 HG LEU 13 HG LEU 13 7.766 -4.981 -15.957 85 HD11 LEU 13 1HD1 LEU 13 8.326 -6.278 -17.986 86 HD12 LEU 13 2HD1 LEU 13 9.236 -6.862 -16.588 87 HD13 LEU 13 3HD1 LEU 13 7.827 -7.777 -17.170 88 HD21 LEU 13 3HD2 LEU 13 6.132 -5.351 -17.785 89 HD22 LEU 13 1HD2 LEU 13 5.456 -6.717 -16.884 90 HD23 LEU 13 2HD2 LEU 13 5.353 -5.060 -16.240 91 H TYR 14 H TYR 14 6.839 -3.562 -14.501 92 HA TYR 14 HA TYR 14 9.466 -2.734 -13.868 93 HB2 TYR 14 2HB TYR 14 8.758 -0.607 -14.823 94 HB3 TYR 14 3HB TYR 14 8.216 -1.992 -15.792 95 HD1 TYR 14 HD2 TYR 14 7.012 0.535 -13.267 96 HD2 TYR 14 HD1 TYR 14 5.975 -2.162 -16.472 97 HE1 TYR 14 HE2 TYR 14 4.701 1.440 -13.278 98 HE2 TYR 14 HE1 TYR 14 3.679 -1.220 -16.521 99 HH TYR 14 HH TYR 14 2.212 0.303 -15.602 100 H GLN 15 H GLN 15 6.809 -2.800 -11.809 101 HA GLN 15 HA GLN 15 7.991 -0.712 -10.003 102 HB2 GLN 15 2HB GLN 15 5.696 -0.363 -9.092 103 HB3 GLN 15 3HB GLN 15 5.900 0.175 -10.765 104 HG2 GLN 15 2HG GLN 15 4.759 -1.782 -11.612 105 HG3 GLN 15 3HG GLN 15 4.686 -2.508 -9.992 106 HE21 GLN 15 2HE2 GLN 15 3.870 0.962 -10.341 107 HE22 GLN 15 1HE2 GLN 15 2.151 0.672 -10.141 108 H LEU 16 H LEU 16 6.682 -4.014 -10.330 109 HA LEU 16 HA LEU 16 6.948 -4.585 -7.521 110 HB2 LEU 16 2HB LEU 16 5.826 -6.419 -8.007 111 HB3 LEU 16 3HB LEU 16 5.545 -5.658 -9.542 112 HG LEU 16 HG LEU 16 7.712 -6.867 -10.318 113 HD11 LEU 16 1HD1 LEU 16 8.725 -7.883 -8.508 114 HD12 LEU 16 2HD1 LEU 16 7.197 -8.141 -7.632 115 HD13 LEU 16 3HD1 LEU 16 7.663 -9.216 -8.952 116 HD21 LEU 16 3HD2 LEU 16 5.214 -8.514 -9.673 117 HD22 LEU 16 1HD2 LEU 16 5.373 -7.415 -11.060 118 HD23 LEU 16 2HD2 LEU 16 6.404 -8.849 -10.950 119 H GLU 17 H GLU 17 9.161 -4.737 -10.271 120 HA GLU 17 HA GLU 17 11.427 -6.056 -9.210 121 HB2 GLU 17 2HB GLU 17 11.126 -3.573 -10.951 122 HB3 GLU 17 3HB GLU 17 12.718 -4.099 -10.406 123 HG2 GLU 17 2HG GLU 17 12.334 -6.332 -11.409 124 HG3 GLU 17 3HG GLU 17 10.835 -5.712 -12.106 125 H ASN 18 H ASN 18 10.046 -2.973 -8.369 126 HA ASN 18 HA ASN 18 12.303 -1.765 -7.100 127 HB2 ASN 18 2HB ASN 18 9.844 -0.915 -7.836 128 HB3 ASN 18 3HB ASN 18 9.536 -1.116 -6.112 129 HD21 ASN 18 1HD2 ASN 18 11.472 0.505 -8.593 130 HD22 ASN 18 2HD2 ASN 18 12.059 1.796 -7.568 131 H TYR 19 H TYR 19 10.088 -4.190 -5.972 132 HA TYR 19 HA TYR 19 10.758 -3.952 -3.124 133 HB2 TYR 19 2HB TYR 19 9.072 -5.923 -4.711 134 HB3 TYR 19 3HB TYR 19 9.201 -5.891 -2.968 135 HD1 TYR 19 HD2 TYR 19 8.030 -3.877 -5.919 136 HD2 TYR 19 HD1 TYR 19 7.961 -4.360 -1.629 137 HE1 TYR 19 HE2 TYR 19 6.149 -2.270 -5.767 138 HE2 TYR 19 HE1 TYR 19 6.057 -2.767 -1.480 139 HH TYR 19 HH TYR 19 4.672 -1.171 -4.383 140 H CYS 20 H CYS 20 12.435 -5.200 -5.729 141 HA CYS 20 HA CYS 20 13.735 -7.493 -4.479 142 HB2 CYS 20 2HB CYS 20 13.532 -6.917 -6.960 143 HB3 CYS 20 3HB CYS 20 14.741 -5.669 -6.686 144 H ASN 21 H ASN 21 14.070 -4.034 -4.226 145 HA ASN 21 HA ASN 21 16.810 -3.972 -3.225 146 HB2 ASN 21 2HB ASN 21 14.586 -1.877 -3.312 147 HB3 ASN 21 3HB ASN 21 16.240 -1.559 -2.807 148 HD21 ASN 21 2HD2 ASN 21 17.986 -2.172 -4.476 149 HD22 ASN 21 1HD2 ASN 21 17.584 -1.795 -6.146 150 H1 PHE 1 1H PHE 1 6.415 -11.778 -19.267 151 H2 PHE 1 2H PHE 1 5.551 -10.601 -20.016 152 H3 PHE 1 3H PHE 1 4.974 -12.131 -19.961 153 HA PHE 1 HA PHE 1 4.722 -12.041 -17.590 154 HB2 PHE 1 2HB PHE 1 6.642 -10.397 -17.319 155 HB3 PHE 1 3HB PHE 1 5.554 -9.118 -17.826 156 HD1 PHE 1 HD2 PHE 1 6.325 -11.608 -15.174 157 HD2 PHE 1 HD1 PHE 1 3.861 -8.230 -16.261 158 HE1 PHE 1 HE2 PHE 1 5.613 -11.357 -12.812 159 HE2 PHE 1 HE1 PHE 1 3.182 -7.973 -13.891 160 HZ PHE 1 HZ PHE 1 4.043 -9.538 -12.167 161 H VAL 2 H VAL 2 2.747 -11.168 -16.586 162 HA VAL 2 HA VAL 2 1.030 -9.432 -18.304 163 HB VAL 2 HB VAL 2 0.061 -11.963 -16.902 164 HG11 VAL 2 1HG1 VAL 2 -1.510 -9.823 -18.415 165 HG12 VAL 2 2HG1 VAL 2 -2.168 -11.377 -17.863 166 HG13 VAL 2 3HG1 VAL 2 -1.633 -10.186 -16.680 167 HG21 VAL 2 3HG2 VAL 2 -0.636 -12.683 -19.172 168 HG22 VAL 2 1HG2 VAL 2 0.138 -11.239 -19.862 169 HG23 VAL 2 2HG2 VAL 2 1.115 -12.488 -19.056 170 H ASN 3 H ASN 3 0.481 -7.703 -17.175 171 HA ASN 3 HA ASN 3 1.018 -7.396 -14.353 172 HB2 ASN 3 2HB ASN 3 -0.679 -5.665 -16.189 173 HB3 ASN 3 3HB ASN 3 -0.021 -5.192 -14.628 174 HD21 ASN 3 1HD2 ASN 3 0.407 -3.951 -17.302 175 HD22 ASN 3 2HD2 ASN 3 2.142 -3.997 -17.553 176 H GLN 4 H GLN 4 -0.225 -8.127 -12.688 177 HA GLN 4 HA GLN 4 -3.133 -8.460 -12.928 178 HB2 GLN 4 2HB GLN 4 -3.165 -10.843 -12.917 179 HB3 GLN 4 3HB GLN 4 -2.145 -10.348 -14.258 180 HG2 GLN 4 2HG GLN 4 -0.126 -10.727 -12.705 181 HG3 GLN 4 3HG GLN 4 -1.254 -11.454 -11.567 182 HE21 GLN 4 1HE2 GLN 4 0.551 -11.943 -14.501 183 HE22 GLN 4 2HE2 GLN 4 0.014 -13.602 -14.772 184 H HIS 5 H HIS 5 -3.833 -9.989 -11.036 185 HA HIS 5 HA HIS 5 -2.751 -8.961 -8.473 186 HB2 HIS 5 2HB HIS 5 -5.051 -10.868 -9.096 187 HB3 HIS 5 3HB HIS 5 -4.624 -10.253 -7.504 188 HD2 HIS 5 HD2 HIS 5 -6.051 -8.983 -10.895 189 HE1 HIS 5 HE1 HIS 5 -7.139 -6.152 -7.917 190 HE2 HIS 5 HE2 HIS 5 -7.458 -6.837 -10.352 191 H LEU 6 H LEU 6 -1.323 -10.116 -7.240 192 HA LEU 6 HA LEU 6 -0.818 -13.021 -7.790 193 HB2 LEU 6 2HB LEU 6 1.256 -10.820 -7.556 194 HB3 LEU 6 3HB LEU 6 1.623 -12.536 -7.598 195 HG LEU 6 HG LEU 6 0.336 -10.984 -9.888 196 HD11 LEU 6 1HD1 LEU 6 2.604 -11.201 -10.928 197 HD12 LEU 6 2HD1 LEU 6 2.600 -10.179 -9.481 198 HD13 LEU 6 3HD1 LEU 6 3.206 -11.841 -9.378 199 HD21 LEU 6 3HD2 LEU 6 1.549 -13.789 -9.760 200 HD22 LEU 6 1HD2 LEU 6 -0.178 -13.418 -9.961 201 HD23 LEU 6 2HD2 LEU 6 0.975 -12.979 -11.229 202 H CYS 7 H CYS 7 -0.462 -14.236 -5.979 203 HA CYS 7 HA CYS 7 0.415 -12.986 -3.477 204 HB2 CYS 7 2HB CYS 7 -2.169 -12.727 -3.805 205 HB3 CYS 7 3HB CYS 7 -2.237 -14.431 -3.380 206 H GLY 8 H GLY 8 1.164 -14.476 -1.920 207 HA2 GLY 8 HA2 GLY 8 2.208 -16.415 -1.195 208 HA3 GLY 8 HA3 GLY 8 0.904 -17.292 -2.012 209 H SER 9 H SER 9 1.830 -18.866 -3.155 210 HA SER 9 HA SER 9 4.408 -19.020 -4.221 211 HB2 SER 9 2HB SER 9 1.892 -20.316 -5.332 212 HB3 SER 9 3HB SER 9 3.561 -20.871 -5.551 213 HG SER 9 HG SER 9 2.477 -22.024 -3.866 214 H HIS 10 H HIS 10 1.476 -17.663 -5.820 215 HA HIS 10 HA HIS 10 2.659 -17.364 -8.411 216 HB2 HIS 10 2HB HIS 10 0.151 -16.767 -7.121 217 HB3 HIS 10 3HB HIS 10 0.705 -15.286 -7.867 218 HD2 HIS 10 HD2 HIS 10 -1.448 -17.997 -8.708 219 HE1 HIS 10 HE1 HIS 10 0.382 -17.139 -12.455 220 HE2 HIS 10 HE2 HIS 10 -1.558 -18.338 -11.314 221 H LEU 11 H LEU 11 2.633 -15.262 -5.571 222 HA LEU 11 HA LEU 11 3.936 -13.005 -6.871 223 HB2 LEU 11 2HB LEU 11 2.375 -13.034 -4.791 224 HB3 LEU 11 3HB LEU 11 3.775 -13.594 -3.887 225 HG LEU 11 HG LEU 11 4.980 -11.464 -4.575 226 HD11 LEU 11 1HD1 LEU 11 3.613 -10.914 -6.613 227 HD12 LEU 11 2HD1 LEU 11 2.210 -10.650 -5.547 228 HD13 LEU 11 3HD1 LEU 11 3.624 -9.596 -5.446 229 HD21 LEU 11 3HD2 LEU 11 3.870 -11.657 -2.389 230 HD22 LEU 11 1HD2 LEU 11 3.639 -10.020 -3.032 231 HD23 LEU 11 2HD2 LEU 11 2.311 -11.185 -3.108 232 H VAL 12 H VAL 12 5.042 -15.658 -4.730 233 HA VAL 12 HA VAL 12 7.812 -14.974 -4.712 234 HB VAL 12 HB VAL 12 6.454 -17.695 -4.524 235 HG11 VAL 12 1HG1 VAL 12 8.778 -18.123 -5.158 236 HG12 VAL 12 2HG1 VAL 12 9.357 -16.972 -3.929 237 HG13 VAL 12 3HG1 VAL 12 8.564 -18.489 -3.446 238 HG21 VAL 12 3HG2 VAL 12 5.897 -16.076 -2.722 239 HG22 VAL 12 1HG2 VAL 12 6.837 -17.442 -2.115 240 HG23 VAL 12 2HG2 VAL 12 7.623 -15.867 -2.382 241 H GLU 13 H GLU 13 5.978 -17.033 -7.013 242 HA GLU 13 HA GLU 13 8.118 -17.648 -8.787 243 HB2 GLU 13 2HB GLU 13 5.111 -17.515 -9.038 244 HB3 GLU 13 3HB GLU 13 6.069 -17.581 -10.510 245 HG2 GLU 13 2HG GLU 13 7.232 -19.590 -9.739 246 HG3 GLU 13 3HG GLU 13 6.333 -19.558 -8.214 247 H ALA 14 H ALA 14 5.903 -14.774 -8.839 248 HA ALA 14 HA ALA 14 7.107 -13.618 -11.154 249 HB1 ALA 14 3HB ALA 14 4.931 -12.979 -10.291 250 HB2 ALA 14 1HB ALA 14 5.660 -12.330 -8.801 251 HB3 ALA 14 2HB ALA 14 5.997 -11.554 -10.363 252 H LEU 15 H LEU 15 7.837 -13.020 -7.640 253 HA LEU 15 HA LEU 15 10.026 -11.268 -8.148 254 HB2 LEU 15 2HB LEU 15 9.207 -12.976 -5.796 255 HB3 LEU 15 3HB LEU 15 10.824 -12.306 -5.825 256 HG LEU 15 HG LEU 15 9.428 -10.904 -4.517 257 HD11 LEU 15 1HD1 LEU 15 10.013 -9.397 -7.109 258 HD12 LEU 15 2HD1 LEU 15 9.830 -8.711 -5.496 259 HD13 LEU 15 3HD1 LEU 15 11.201 -9.775 -5.841 260 HD21 LEU 15 3HD2 LEU 15 7.543 -9.601 -5.457 261 HD22 LEU 15 1HD2 LEU 15 7.617 -10.578 -6.934 262 HD23 LEU 15 2HD2 LEU 15 7.239 -11.335 -5.368 263 H TYR 16 H TYR 16 10.060 -14.877 -8.157 264 HA TYR 16 HA TYR 16 12.900 -15.057 -8.465 265 HB2 TYR 16 2HB TYR 16 11.450 -17.017 -8.051 266 HB3 TYR 16 3HB TYR 16 10.686 -16.802 -9.624 267 HD1 TYR 16 HD1 TYR 16 11.849 -17.343 -11.714 268 HD2 TYR 16 HD2 TYR 16 13.729 -17.969 -7.886 269 HE1 TYR 16 HE1 TYR 16 13.609 -18.701 -12.812 270 HE2 TYR 16 HE2 TYR 16 15.470 -19.378 -8.972 271 HH TYR 16 HH TYR 16 16.271 -20.245 -10.949 272 H LEU 17 H LEU 17 10.369 -14.415 -10.903 273 HA LEU 17 HA LEU 17 12.260 -14.475 -13.120 274 HB2 LEU 17 2HB LEU 17 9.377 -13.490 -12.902 275 HB3 LEU 17 3HB LEU 17 10.262 -13.659 -14.409 276 HG LEU 17 HG LEU 17 9.656 -15.995 -12.545 277 HD11 LEU 17 1HD1 LEU 17 7.908 -16.595 -14.172 278 HD12 LEU 17 2HD1 LEU 17 7.582 -15.018 -13.435 279 HD13 LEU 17 3HD1 LEU 17 8.234 -15.105 -15.088 280 HD21 LEU 17 3HD2 LEU 17 10.671 -15.916 -15.422 281 HD22 LEU 17 1HD2 LEU 17 11.611 -16.410 -13.998 282 HD23 LEU 17 2HD2 LEU 17 10.228 -17.378 -14.518 283 H VAL 18 H VAL 18 10.760 -11.829 -11.256 284 HA VAL 18 HA VAL 18 12.219 -9.858 -12.922 285 HB VAL 18 HB VAL 18 11.046 -8.387 -10.819 286 HG11 VAL 18 1HG1 VAL 18 9.627 -7.515 -12.548 287 HG12 VAL 18 2HG1 VAL 18 11.257 -7.766 -13.197 288 HG13 VAL 18 3HG1 VAL 18 9.968 -8.923 -13.603 289 HG21 VAL 18 3HG2 VAL 18 9.078 -10.465 -11.777 290 HG22 VAL 18 1HG2 VAL 18 9.658 -10.152 -10.095 291 HG23 VAL 18 2HG2 VAL 18 8.698 -8.951 -10.972 292 H CYS 19 H CYS 19 12.646 -11.207 -9.721 293 HA CYS 19 HA CYS 19 14.855 -9.251 -9.171 294 HB2 CYS 19 2HB CYS 19 12.977 -9.143 -7.608 295 HB3 CYS 19 3HB CYS 19 13.130 -10.855 -7.258 296 H GLY 20 H GLY 20 13.983 -12.720 -8.995 297 HA2 GLY 20 HA2 GLY 20 16.511 -13.574 -7.880 298 HA3 GLY 20 HA3 GLY 20 15.274 -14.622 -8.611 299 H GLU 21 H GLU 21 15.192 -13.838 -11.176 300 HA GLU 21 HA GLU 21 17.287 -15.053 -12.506 301 HB2 GLU 21 2HB GLU 21 15.032 -14.602 -13.348 302 HB3 GLU 21 3HB GLU 21 15.383 -12.891 -13.500 303 HG2 GLU 21 2HG GLU 21 16.914 -15.071 -14.991 304 HG3 GLU 21 3HG GLU 21 15.426 -14.359 -15.606 305 H ARG 22 H ARG 22 17.164 -11.689 -11.444 306 HA ARG 22 HA ARG 22 19.322 -10.644 -13.019 307 HB2 ARG 22 2HB ARG 22 18.376 -9.685 -10.294 308 HB3 ARG 22 3HB ARG 22 19.233 -8.749 -11.508 309 HG2 ARG 22 2HG ARG 22 16.376 -9.787 -11.735 310 HG3 ARG 22 3HG ARG 22 16.877 -8.135 -11.397 311 HD2 ARG 22 2HD ARG 22 17.972 -8.006 -13.628 312 HD3 ARG 22 3HD ARG 22 17.419 -9.641 -13.994 313 HE ARG 22 HE ARG 22 15.768 -7.183 -13.762 314 HH11 ARG 22 1HH1 ARG 22 15.718 -10.662 -14.557 315 HH12 ARG 22 2HH1 ARG 22 13.976 -10.676 -14.598 316 HH21 ARG 22 2HH2 ARG 22 13.637 -7.224 -14.189 317 HH22 ARG 22 1HH2 ARG 22 12.871 -8.695 -14.762 318 H GLY 23 H GLY 23 19.494 -12.981 -10.623 319 HA2 GLY 23 HA2 GLY 23 21.531 -14.058 -10.080 320 HA3 GLY 23 HA3 GLY 23 22.401 -12.491 -10.050 321 H HIS 24 H HIS 24 19.311 -13.238 -8.592 322 HA HIS 24 HA HIS 24 18.536 -13.120 -6.528 323 HB2 HIS 24 2HB HIS 24 20.823 -15.076 -6.148 324 HB3 HIS 24 3HB HIS 24 19.427 -14.935 -5.073 325 HD2 HIS 24 HD2 HIS 24 20.481 -16.504 -8.347 326 HE1 HIS 24 HE1 HIS 24 16.319 -17.302 -7.945 327 HE2 HIS 24 HE2 HIS 24 18.422 -17.847 -9.282 328 H PHE 25 H PHE 25 20.894 -13.754 -4.326 329 HA PHE 25 HA PHE 25 21.671 -12.657 -2.547 330 HB2 PHE 25 2HB PHE 25 23.297 -12.024 -4.401 331 HB3 PHE 25 3HB PHE 25 22.484 -10.470 -4.503 332 HD1 PHE 25 HD2 PHE 25 24.174 -12.758 -2.029 333 HD2 PHE 25 HD1 PHE 25 23.302 -8.687 -3.154 334 HE1 PHE 25 HE2 PHE 25 25.650 -11.937 -0.209 335 HE2 PHE 25 HE1 PHE 25 24.782 -7.870 -1.337 336 HZ PHE 25 HZ PHE 25 25.955 -9.492 0.141 337 H TYR 26 H TYR 26 19.156 -12.539 -2.488 338 HA TYR 26 HA TYR 26 18.087 -9.825 -2.080 339 HB2 TYR 26 2HB TYR 26 16.728 -11.712 -2.998 340 HB3 TYR 26 3HB TYR 26 16.841 -12.515 -1.431 341 HD1 TYR 26 HD2 TYR 26 15.797 -9.296 -3.047 342 HD2 TYR 26 HD1 TYR 26 15.201 -12.017 0.247 343 HE1 TYR 26 HE2 TYR 26 13.883 -7.930 -2.264 344 HE2 TYR 26 HE1 TYR 26 13.257 -10.659 1.013 345 HH TYR 26 HH TYR 26 12.142 -7.756 -0.798 346 H THR 27 H THR 27 17.431 -8.943 -0.130 347 HA THR 27 HA THR 27 18.680 -10.024 2.369 348 HB THR 27 HB THR 27 18.506 -7.659 3.191 349 HG1 THR 27 HG1 THR 27 17.047 -6.953 1.566 350 HG21 THR 27 1HG2 THR 27 20.638 -8.650 2.407 351 HG22 THR 27 2HG2 THR 27 20.268 -8.148 0.742 352 HG23 THR 27 3HG2 THR 27 20.530 -6.928 2.007 353 HA PRO 28 HA PRO 28 14.237 -10.574 3.168 354 HB2 PRO 28 2HB PRO 28 14.368 -12.419 5.163 355 HB3 PRO 28 3HB PRO 28 14.678 -12.833 3.447 356 HG2 PRO 28 2HG PRO 28 16.712 -12.179 5.603 357 HG3 PRO 28 3HG PRO 28 16.707 -13.579 4.480 358 HD2 PRO 28 2HD PRO 28 18.161 -11.331 3.984 359 HD3 PRO 28 3HD PRO 28 17.368 -12.233 2.655 360 H LYS 29 H LYS 29 12.815 -10.051 4.884 361 HA LYS 29 HA LYS 29 13.909 -8.276 7.031 362 HB2 LYS 29 2HB LYS 29 11.929 -7.602 4.817 363 HB3 LYS 29 3HB LYS 29 12.117 -6.621 6.271 364 HG2 LYS 29 2HG LYS 29 14.405 -6.087 5.764 365 HG3 LYS 29 3HG LYS 29 14.461 -7.208 4.406 366 HD2 LYS 29 2HD LYS 29 12.592 -4.816 4.515 367 HD3 LYS 29 3HD LYS 29 14.201 -4.751 3.802 368 HE2 LYS 29 2HE LYS 29 12.054 -6.723 2.893 369 HE3 LYS 29 3HE LYS 29 12.256 -5.119 2.186 370 HZ1 LYS 29 HZ1 LYS 29 14.394 -7.185 2.208 371 HZ2 LYS 29 HZ2 LYS 29 13.425 -6.852 0.938 372 HZ3 LYS 29 HZ3 LYS 29 14.460 -5.712 1.478 373 H THR 30 H THR 30 12.525 -7.845 8.760 374 HA THR 30 HA THR 30 10.694 -9.988 9.512 375 HB THR 30 HB THR 30 10.461 -8.583 11.618 376 HG1 THR 30 HG1 THR 30 11.992 -6.952 11.865 377 HG21 THR 30 1HG2 THR 30 13.281 -9.400 10.782 378 HG22 THR 30 2HG2 THR 30 12.689 -9.188 12.446 379 HG23 THR 30 3HG2 THR 30 12.035 -10.485 11.435 Start of MODEL 22 1 H1 GLY 1 1H GLY 1 5.272 -2.607 2.952 2 H2 GLY 1 2H GLY 1 3.833 -3.165 2.415 3 H3 GLY 1 3H GLY 1 4.768 -2.240 1.435 4 HA2 GLY 1 HA2 GLY 1 6.502 -3.945 1.420 5 HA3 GLY 1 HA3 GLY 1 5.415 -4.958 2.388 6 H ILE 2 H ILE 2 6.384 -5.918 0.019 7 HA ILE 2 HA ILE 2 5.066 -5.272 -2.371 8 HB ILE 2 HB ILE 2 7.149 -6.485 -2.252 9 HG12 ILE 2 2HG1 ILE 2 6.903 -8.215 -3.881 10 HG13 ILE 2 3HG1 ILE 2 5.164 -8.344 -3.585 11 HG21 ILE 2 1HG2 ILE 2 7.359 -8.833 -1.630 12 HG22 ILE 2 2HG2 ILE 2 6.776 -7.900 -0.258 13 HG23 ILE 2 3HG2 ILE 2 5.646 -8.910 -1.191 14 HD11 ILE 2 3HD1 ILE 2 6.658 -6.028 -4.860 15 HD12 ILE 2 1HD1 ILE 2 5.595 -7.191 -5.654 16 HD13 ILE 2 2HD1 ILE 2 4.909 -6.016 -4.520 17 H VAL 3 H VAL 3 3.953 -7.572 0.071 18 HA VAL 3 HA VAL 3 1.821 -8.698 -1.451 19 HB VAL 3 HB VAL 3 2.090 -8.327 1.555 20 HG11 VAL 3 1HG1 VAL 3 -0.306 -8.730 1.036 21 HG12 VAL 3 2HG1 VAL 3 0.151 -10.156 0.070 22 HG13 VAL 3 3HG1 VAL 3 0.423 -10.131 1.820 23 HG21 VAL 3 3HG2 VAL 3 3.845 -9.768 0.523 24 HG22 VAL 3 1HG2 VAL 3 2.750 -10.717 1.529 25 HG23 VAL 3 2HG2 VAL 3 2.580 -10.756 -0.237 26 H GLU 4 H GLU 4 2.018 -5.614 0.302 27 HA GLU 4 HA GLU 4 -0.843 -5.031 0.100 28 HB2 GLU 4 2HB GLU 4 1.521 -3.244 0.769 29 HB3 GLU 4 3HB GLU 4 -0.177 -2.816 0.955 30 HG2 GLU 4 2HG GLU 4 -0.505 -4.531 2.653 31 HG3 GLU 4 3HG GLU 4 1.143 -5.130 2.439 32 H GLN 5 H GLN 5 1.712 -4.977 -2.164 33 HA GLN 5 HA GLN 5 0.451 -2.876 -3.871 34 HB2 GLN 5 2HB GLN 5 2.961 -2.960 -3.474 35 HB3 GLN 5 3HB GLN 5 2.987 -4.509 -4.309 36 HG2 GLN 5 2HG GLN 5 3.634 -2.836 -5.874 37 HG3 GLN 5 3HG GLN 5 2.035 -3.389 -6.355 38 HE21 GLN 5 2HE2 GLN 5 3.710 -0.755 -4.493 39 HE22 GLN 5 1HE2 GLN 5 2.506 0.464 -4.898 40 H CYS 6 H CYS 6 1.421 -6.340 -3.922 41 HA CYS 6 HA CYS 6 0.013 -6.713 -6.500 42 HB2 CYS 6 2HB CYS 6 2.040 -8.254 -4.878 43 HB3 CYS 6 3HB CYS 6 1.303 -8.880 -6.344 44 H CYS 7 H CYS 7 -0.325 -8.037 -3.191 45 HA CYS 7 HA CYS 7 -2.213 -10.080 -4.081 46 HB2 CYS 7 2HB CYS 7 -0.698 -10.201 -2.066 47 HB3 CYS 7 3HB CYS 7 -1.774 -9.055 -1.266 48 H THR 8 H THR 8 -2.558 -6.767 -3.041 49 HA THR 8 HA THR 8 -5.403 -6.867 -2.464 50 HB THR 8 HB THR 8 -3.717 -5.245 -1.508 51 HG1 THR 8 HG1 THR 8 -5.282 -3.622 -1.460 52 HG21 THR 8 1HG2 THR 8 -2.642 -4.576 -3.684 53 HG22 THR 8 2HG2 THR 8 -4.152 -3.756 -4.144 54 HG23 THR 8 3HG2 THR 8 -3.232 -3.196 -2.735 55 H SER 9 H SER 9 -3.538 -6.176 -5.396 56 HA SER 9 HA SER 9 -5.874 -6.152 -7.080 57 HB2 SER 9 2HB SER 9 -5.877 -3.856 -5.967 58 HB3 SER 9 3HB SER 9 -4.421 -3.524 -6.933 59 HG SER 9 HG SER 9 -6.464 -2.887 -7.932 60 H ILE 10 H ILE 10 -4.960 -4.893 -9.292 61 HA ILE 10 HA ILE 10 -2.940 -6.608 -10.452 62 HB ILE 10 HB ILE 10 -3.962 -3.872 -11.337 63 HG12 ILE 10 2HG1 ILE 10 -5.801 -5.527 -11.225 64 HG13 ILE 10 3HG1 ILE 10 -5.470 -4.954 -12.851 65 HG21 ILE 10 1HG2 ILE 10 -3.168 -4.629 -13.633 66 HG22 ILE 10 2HG2 ILE 10 -1.874 -4.294 -12.483 67 HG23 ILE 10 3HG2 ILE 10 -2.337 -5.973 -12.823 68 HD11 ILE 10 3HD1 ILE 10 -5.906 -7.389 -12.778 69 HD12 ILE 10 1HD1 ILE 10 -4.287 -7.030 -13.408 70 HD13 ILE 10 2HD1 ILE 10 -4.487 -7.602 -11.731 71 H CYS 11 H CYS 11 -0.772 -6.535 -10.295 72 HA CYS 11 HA CYS 11 0.498 -3.849 -10.021 73 HB2 CYS 11 2HB CYS 11 2.234 -4.651 -8.661 74 HB3 CYS 11 3HB CYS 11 0.725 -5.141 -7.904 75 H SER 12 H SER 12 2.336 -3.475 -11.177 76 HA SER 12 HA SER 12 2.836 -5.280 -13.525 77 HB2 SER 12 2HB SER 12 3.403 -2.321 -13.153 78 HB3 SER 12 3HB SER 12 3.669 -3.277 -14.621 79 HG SER 12 HG SER 12 1.645 -2.071 -14.576 80 H LEU 13 H LEU 13 4.952 -5.557 -14.362 81 HA LEU 13 HA LEU 13 6.764 -6.477 -12.390 82 HB2 LEU 13 2HB LEU 13 8.234 -6.916 -14.238 83 HB3 LEU 13 3HB LEU 13 6.620 -7.508 -14.558 84 HG LEU 13 HG LEU 13 7.736 -4.932 -15.747 85 HD11 LEU 13 1HD1 LEU 13 7.680 -7.738 -16.939 86 HD12 LEU 13 2HD1 LEU 13 8.208 -6.261 -17.777 87 HD13 LEU 13 3HD1 LEU 13 9.131 -6.866 -16.396 88 HD21 LEU 13 3HD2 LEU 13 5.329 -6.610 -16.544 89 HD22 LEU 13 1HD2 LEU 13 5.330 -4.916 -15.990 90 HD23 LEU 13 2HD2 LEU 13 6.034 -5.327 -17.544 91 H TYR 14 H TYR 14 6.700 -3.503 -14.253 92 HA TYR 14 HA TYR 14 9.312 -2.600 -13.596 93 HB2 TYR 14 2HB TYR 14 8.575 -0.502 -14.577 94 HB3 TYR 14 3HB TYR 14 8.084 -1.903 -15.550 95 HD1 TYR 14 HD1 TYR 14 6.748 0.568 -13.022 96 HD2 TYR 14 HD2 TYR 14 5.887 -2.066 -16.332 97 HE1 TYR 14 HE1 TYR 14 4.422 1.427 -13.100 98 HE2 TYR 14 HE2 TYR 14 3.579 -1.163 -16.450 99 HH TYR 14 HH TYR 14 2.048 0.310 -15.551 100 H GLN 15 H GLN 15 6.605 -2.733 -11.597 101 HA GLN 15 HA GLN 15 7.721 -0.625 -9.773 102 HB2 GLN 15 2HB GLN 15 5.451 -0.382 -8.822 103 HB3 GLN 15 3HB GLN 15 5.570 0.155 -10.506 104 HG2 GLN 15 2HG GLN 15 4.511 -1.875 -11.292 105 HG3 GLN 15 3HG GLN 15 4.501 -2.569 -9.659 106 HE21 GLN 15 2HE2 GLN 15 3.568 0.789 -9.552 107 HE22 GLN 15 1HE2 GLN 15 1.846 0.450 -9.540 108 H LEU 16 H LEU 16 6.660 -3.988 -10.111 109 HA LEU 16 HA LEU 16 6.924 -4.520 -7.285 110 HB2 LEU 16 2HB LEU 16 5.853 -6.404 -7.753 111 HB3 LEU 16 3HB LEU 16 5.493 -5.608 -9.254 112 HG LEU 16 HG LEU 16 7.645 -6.740 -10.155 113 HD11 LEU 16 1HD1 LEU 16 7.714 -9.133 -8.875 114 HD12 LEU 16 2HD1 LEU 16 8.770 -7.795 -8.438 115 HD13 LEU 16 3HD1 LEU 16 7.293 -8.112 -7.499 116 HD21 LEU 16 3HD2 LEU 16 5.198 -8.443 -9.430 117 HD22 LEU 16 1HD2 LEU 16 5.289 -7.332 -10.813 118 HD23 LEU 16 2HD2 LEU 16 6.334 -8.760 -10.759 119 H GLU 17 H GLU 17 9.152 -4.581 -10.034 120 HA GLU 17 HA GLU 17 11.402 -5.900 -8.908 121 HB2 GLU 17 2HB GLU 17 11.168 -3.446 -10.711 122 HB3 GLU 17 3HB GLU 17 12.728 -3.997 -10.110 123 HG2 GLU 17 2HG GLU 17 12.166 -6.296 -11.075 124 HG3 GLU 17 3HG GLU 17 10.884 -5.453 -11.963 125 H ASN 18 H ASN 18 9.909 -2.882 -8.026 126 HA ASN 18 HA ASN 18 12.139 -1.528 -6.843 127 HB2 ASN 18 2HB ASN 18 9.167 -1.308 -6.305 128 HB3 ASN 18 3HB ASN 18 10.369 -0.240 -5.694 129 HD21 ASN 18 2HD2 ASN 18 8.399 0.902 -7.201 130 HD22 ASN 18 1HD2 ASN 18 9.112 1.417 -8.727 131 H TYR 19 H TYR 19 10.268 -4.186 -5.729 132 HA TYR 19 HA TYR 19 10.996 -3.922 -2.876 133 HB2 TYR 19 2HB TYR 19 9.229 -5.875 -4.404 134 HB3 TYR 19 3HB TYR 19 9.414 -5.794 -2.660 135 HD1 TYR 19 HD2 TYR 19 8.073 -3.911 -5.657 136 HD2 TYR 19 HD1 TYR 19 8.271 -4.156 -1.339 137 HE1 TYR 19 HE2 TYR 19 6.239 -2.264 -5.468 138 HE2 TYR 19 HE1 TYR 19 6.446 -2.477 -1.167 139 HH TYR 19 HH TYR 19 4.992 -1.117 -2.306 140 H CYS 20 H CYS 20 12.559 -5.103 -5.560 141 HA CYS 20 HA CYS 20 13.610 -7.642 -4.636 142 HB2 CYS 20 2HB CYS 20 13.456 -6.828 -6.998 143 HB3 CYS 20 3HB CYS 20 14.686 -5.620 -6.642 144 H ASN 21 H ASN 21 14.540 -4.313 -4.096 145 HA ASN 21 HA ASN 21 17.203 -4.955 -2.987 146 HB2 ASN 21 2HB ASN 21 17.299 -2.431 -2.679 147 HB3 ASN 21 3HB ASN 21 17.235 -3.031 -4.331 148 HD21 ASN 21 1HD2 ASN 21 14.485 -2.613 -2.087 149 HD22 ASN 21 2HD2 ASN 21 13.623 -1.513 -3.173 150 H1 PHE 1 1H PHE 1 5.739 -10.946 -20.117 151 H2 PHE 1 2H PHE 1 4.964 -12.385 -20.084 152 H3 PHE 1 3H PHE 1 6.433 -12.234 -19.375 153 HA PHE 1 HA PHE 1 4.706 -12.288 -17.712 154 HB2 PHE 1 2HB PHE 1 6.846 -10.830 -17.509 155 HB3 PHE 1 3HB PHE 1 5.804 -9.457 -17.850 156 HD1 PHE 1 HD2 PHE 1 6.617 -12.153 -15.424 157 HD2 PHE 1 HD1 PHE 1 4.264 -8.603 -16.134 158 HE1 PHE 1 HE2 PHE 1 6.092 -12.010 -13.004 159 HE2 PHE 1 HE1 PHE 1 3.743 -8.470 -13.711 160 HZ PHE 1 HZ PHE 1 4.661 -10.165 -12.144 161 H VAL 2 H VAL 2 2.846 -11.162 -16.721 162 HA VAL 2 HA VAL 2 1.578 -9.006 -18.295 163 HB VAL 2 HB VAL 2 -0.705 -9.860 -17.869 164 HG11 VAL 2 1HG1 VAL 2 0.365 -10.081 -20.087 165 HG12 VAL 2 2HG1 VAL 2 0.927 -11.711 -19.648 166 HG13 VAL 2 3HG1 VAL 2 -0.809 -11.368 -19.769 167 HG21 VAL 2 3HG2 VAL 2 0.619 -12.527 -17.195 168 HG22 VAL 2 1HG2 VAL 2 -0.367 -11.522 -16.107 169 HG23 VAL 2 2HG2 VAL 2 -1.109 -12.279 -17.513 170 H ASN 3 H ASN 3 0.749 -7.414 -17.052 171 HA ASN 3 HA ASN 3 1.128 -7.410 -14.208 172 HB2 ASN 3 2HB ASN 3 -0.315 -5.407 -14.147 173 HB3 ASN 3 3HB ASN 3 1.116 -5.303 -15.197 174 HD21 ASN 3 2HD2 ASN 3 0.950 -5.203 -17.391 175 HD22 ASN 3 1HD2 ASN 3 -0.608 -4.993 -18.153 176 H GLN 4 H GLN 4 -0.180 -8.153 -12.584 177 HA GLN 4 HA GLN 4 -2.962 -8.917 -13.019 178 HB2 GLN 4 2HB GLN 4 -2.663 -11.300 -12.936 179 HB3 GLN 4 3HB GLN 4 -1.724 -10.665 -14.276 180 HG2 GLN 4 2HG GLN 4 0.316 -10.712 -12.696 181 HG3 GLN 4 3HG GLN 4 -0.704 -11.623 -11.582 182 HE21 GLN 4 2HE2 GLN 4 1.617 -12.017 -13.941 183 HE22 GLN 4 1HE2 GLN 4 1.199 -13.658 -14.420 184 H HIS 5 H HIS 5 -3.643 -10.385 -11.156 185 HA HIS 5 HA HIS 5 -2.825 -9.231 -8.556 186 HB2 HIS 5 2HB HIS 5 -4.839 -11.403 -9.297 187 HB3 HIS 5 3HB HIS 5 -4.588 -10.746 -7.682 188 HD2 HIS 5 HD2 HIS 5 -5.951 -9.670 -11.158 189 HE1 HIS 5 HE1 HIS 5 -7.389 -6.861 -8.302 190 HE2 HIS 5 HE2 HIS 5 -7.552 -7.629 -10.735 191 H LEU 6 H LEU 6 -1.300 -10.147 -7.241 192 HA LEU 6 HA LEU 6 -0.458 -12.996 -7.671 193 HB2 LEU 6 2HB LEU 6 1.365 -10.586 -7.443 194 HB3 LEU 6 3HB LEU 6 1.897 -12.256 -7.403 195 HG LEU 6 HG LEU 6 0.547 -10.922 -9.788 196 HD11 LEU 6 1HD1 LEU 6 3.455 -11.425 -9.096 197 HD12 LEU 6 2HD1 LEU 6 2.888 -10.970 -10.724 198 HD13 LEU 6 3HD1 LEU 6 2.674 -9.858 -9.359 199 HD21 LEU 6 3HD2 LEU 6 0.279 -13.389 -9.799 200 HD22 LEU 6 1HD2 LEU 6 1.453 -12.888 -11.025 201 HD23 LEU 6 2HD2 LEU 6 2.016 -13.589 -9.495 202 H CYS 7 H CYS 7 -0.351 -14.127 -5.844 203 HA CYS 7 HA CYS 7 0.515 -12.877 -3.337 204 HB2 CYS 7 2HB CYS 7 -2.049 -12.549 -3.734 205 HB3 CYS 7 3HB CYS 7 -2.179 -14.241 -3.278 206 H GLY 8 H GLY 8 1.227 -14.377 -1.787 207 HA2 GLY 8 HA2 GLY 8 2.214 -16.348 -1.054 208 HA3 GLY 8 HA3 GLY 8 0.882 -17.188 -1.861 209 H SER 9 H SER 9 1.698 -18.762 -3.057 210 HA SER 9 HA SER 9 4.327 -19.002 -4.070 211 HB2 SER 9 2HB SER 9 2.587 -20.810 -3.725 212 HB3 SER 9 3HB SER 9 1.842 -20.289 -5.248 213 HG SER 9 HG SER 9 3.346 -22.031 -5.530 214 H HIS 10 H HIS 10 1.429 -17.615 -5.703 215 HA HIS 10 HA HIS 10 2.632 -17.292 -8.283 216 HB2 HIS 10 2HB HIS 10 0.139 -16.609 -6.981 217 HB3 HIS 10 3HB HIS 10 0.758 -15.156 -7.730 218 HD2 HIS 10 HD2 HIS 10 -1.419 -17.902 -8.567 219 HE1 HIS 10 HE1 HIS 10 0.302 -16.883 -12.325 220 HE2 HIS 10 HE2 HIS 10 -1.581 -18.164 -11.181 221 H LEU 11 H LEU 11 2.640 -15.227 -5.409 222 HA LEU 11 HA LEU 11 3.978 -12.977 -6.661 223 HB2 LEU 11 2HB LEU 11 2.476 -13.001 -4.556 224 HB3 LEU 11 3HB LEU 11 3.854 -13.681 -3.701 225 HG LEU 11 HG LEU 11 5.168 -11.618 -4.255 226 HD11 LEU 11 1HD1 LEU 11 2.486 -10.624 -5.325 227 HD12 LEU 11 2HD1 LEU 11 3.919 -9.617 -5.061 228 HD13 LEU 11 3HD1 LEU 11 3.954 -10.868 -6.302 229 HD21 LEU 11 3HD2 LEU 11 3.948 -10.153 -2.671 230 HD22 LEU 11 1HD2 LEU 11 2.488 -11.136 -2.870 231 HD23 LEU 11 2HD2 LEU 11 3.941 -11.835 -2.114 232 H VAL 12 H VAL 12 5.095 -15.693 -4.603 233 HA VAL 12 HA VAL 12 7.872 -15.044 -4.644 234 HB VAL 12 HB VAL 12 6.498 -17.758 -4.471 235 HG11 VAL 12 1HG1 VAL 12 8.813 -18.176 -5.152 236 HG12 VAL 12 2HG1 VAL 12 9.412 -17.049 -3.911 237 HG13 VAL 12 3HG1 VAL 12 8.625 -18.575 -3.444 238 HG21 VAL 12 3HG2 VAL 12 7.702 -15.963 -2.322 239 HG22 VAL 12 1HG2 VAL 12 5.971 -16.176 -2.633 240 HG23 VAL 12 2HG2 VAL 12 6.930 -17.545 -2.063 241 H GLU 13 H GLU 13 5.953 -17.035 -6.938 242 HA GLU 13 HA GLU 13 8.053 -17.633 -8.768 243 HB2 GLU 13 2HB GLU 13 5.040 -17.465 -8.979 244 HB3 GLU 13 3HB GLU 13 5.994 -17.538 -10.456 245 HG2 GLU 13 2HG GLU 13 7.162 -19.556 -9.617 246 HG3 GLU 13 3HG GLU 13 6.108 -19.561 -8.193 247 H ALA 14 H ALA 14 5.816 -14.742 -8.771 248 HA ALA 14 HA ALA 14 6.987 -13.612 -11.108 249 HB1 ALA 14 3HB ALA 14 5.613 -12.298 -8.731 250 HB2 ALA 14 1HB ALA 14 5.887 -11.548 -10.319 251 HB3 ALA 14 2HB ALA 14 4.821 -12.967 -10.181 252 H LEU 15 H LEU 15 7.795 -13.050 -7.618 253 HA LEU 15 HA LEU 15 9.932 -11.234 -8.156 254 HB2 LEU 15 2HB LEU 15 9.181 -12.974 -5.805 255 HB3 LEU 15 3HB LEU 15 10.790 -12.288 -5.853 256 HG LEU 15 HG LEU 15 9.359 -10.918 -4.512 257 HD11 LEU 15 1HD1 LEU 15 9.805 -8.712 -5.454 258 HD12 LEU 15 2HD1 LEU 15 11.174 -9.787 -5.769 259 HD13 LEU 15 3HD1 LEU 15 10.030 -9.385 -7.067 260 HD21 LEU 15 3HD2 LEU 15 7.510 -9.566 -5.517 261 HD22 LEU 15 1HD2 LEU 15 7.601 -10.573 -6.966 262 HD23 LEU 15 2HD2 LEU 15 7.182 -11.293 -5.397 263 H TYR 16 H TYR 16 10.006 -14.845 -8.190 264 HA TYR 16 HA TYR 16 12.849 -14.957 -8.589 265 HB2 TYR 16 2HB TYR 16 11.493 -16.972 -8.137 266 HB3 TYR 16 3HB TYR 16 10.656 -16.763 -9.677 267 HD1 TYR 16 HD2 TYR 16 13.973 -17.551 -8.148 268 HD2 TYR 16 HD1 TYR 16 11.650 -17.407 -11.779 269 HE1 TYR 16 HE2 TYR 16 15.763 -18.801 -9.344 270 HE2 TYR 16 HE1 TYR 16 13.428 -18.655 -12.975 271 HH TYR 16 HH TYR 16 15.488 -19.670 -12.820 272 H LEU 17 H LEU 17 10.184 -14.457 -10.926 273 HA LEU 17 HA LEU 17 11.945 -14.476 -13.213 274 HB2 LEU 17 2HB LEU 17 9.119 -13.370 -12.858 275 HB3 LEU 17 3HB LEU 17 9.942 -13.541 -14.398 276 HG LEU 17 HG LEU 17 9.273 -15.888 -12.573 277 HD11 LEU 17 1HD1 LEU 17 7.475 -16.365 -14.183 278 HD12 LEU 17 2HD1 LEU 17 7.239 -14.784 -13.421 279 HD13 LEU 17 3HD1 LEU 17 7.867 -14.881 -15.082 280 HD21 LEU 17 3HD2 LEU 17 10.267 -15.796 -15.456 281 HD22 LEU 17 1HD2 LEU 17 11.181 -16.384 -14.049 282 HD23 LEU 17 2HD2 LEU 17 9.742 -17.255 -14.587 283 H VAL 18 H VAL 18 10.486 -11.744 -11.386 284 HA VAL 18 HA VAL 18 11.954 -9.841 -13.078 285 HB VAL 18 HB VAL 18 10.982 -8.423 -10.774 286 HG11 VAL 18 1HG1 VAL 18 9.672 -7.242 -12.373 287 HG12 VAL 18 2HG1 VAL 18 11.268 -7.566 -13.077 288 HG13 VAL 18 3HG1 VAL 18 9.870 -8.542 -13.587 289 HG21 VAL 18 3HG2 VAL 18 8.582 -8.799 -11.024 290 HG22 VAL 18 1HG2 VAL 18 8.904 -10.307 -11.883 291 HG23 VAL 18 2HG2 VAL 18 9.473 -10.074 -10.186 292 H CYS 19 H CYS 19 12.454 -11.109 -9.800 293 HA CYS 19 HA CYS 19 14.743 -9.231 -9.401 294 HB2 CYS 19 2HB CYS 19 12.939 -9.094 -7.752 295 HB3 CYS 19 3HB CYS 19 13.086 -10.807 -7.403 296 H GLY 20 H GLY 20 13.833 -12.701 -9.152 297 HA2 GLY 20 HA2 GLY 20 16.371 -13.602 -8.153 298 HA3 GLY 20 HA3 GLY 20 15.116 -14.620 -8.892 299 H GLU 21 H GLU 21 15.035 -13.594 -11.480 300 HA GLU 21 HA GLU 21 17.183 -14.831 -12.768 301 HB2 GLU 21 2HB GLU 21 14.922 -14.293 -13.708 302 HB3 GLU 21 3HB GLU 21 15.441 -12.611 -13.912 303 HG2 GLU 21 2HG GLU 21 17.235 -13.348 -15.450 304 HG3 GLU 21 3HG GLU 21 16.795 -15.036 -15.177 305 H ARG 22 H ARG 22 16.879 -11.404 -11.819 306 HA ARG 22 HA ARG 22 19.479 -10.698 -13.001 307 HB2 ARG 22 2HB ARG 22 18.991 -8.428 -12.399 308 HB3 ARG 22 3HB ARG 22 17.657 -9.139 -13.296 309 HG2 ARG 22 2HG ARG 22 16.343 -9.405 -11.269 310 HG3 ARG 22 3HG ARG 22 17.677 -8.822 -10.258 311 HD2 ARG 22 2HD ARG 22 16.333 -7.177 -12.442 312 HD3 ARG 22 3HD ARG 22 15.872 -7.126 -10.733 313 HE ARG 22 HE ARG 22 18.627 -6.683 -10.767 314 HH11 ARG 22 2HH1 ARG 22 15.779 -4.930 -12.010 315 HH12 ARG 22 1HH1 ARG 22 16.614 -3.406 -11.931 316 HH21 ARG 22 1HH2 ARG 22 19.598 -4.676 -10.696 317 HH22 ARG 22 2HH2 ARG 22 18.722 -3.260 -11.188 318 H GLY 23 H GLY 23 18.770 -12.328 -10.273 319 HA2 GLY 23 HA2 GLY 23 21.233 -12.365 -9.086 320 HA3 GLY 23 HA3 GLY 23 20.473 -10.995 -8.291 321 H HIS 24 H HIS 24 20.786 -14.382 -8.365 322 HA HIS 24 HA HIS 24 18.210 -15.197 -7.530 323 HB2 HIS 24 2HB HIS 24 20.921 -16.568 -7.420 324 HB3 HIS 24 3HB HIS 24 19.402 -17.371 -7.026 325 HD2 HIS 24 HD2 HIS 24 21.417 -16.143 -10.029 326 HE1 HIS 24 HE1 HIS 24 17.871 -17.894 -11.603 327 HE2 HIS 24 HE2 HIS 24 20.154 -16.929 -12.196 328 H PHE 25 H PHE 25 20.755 -13.934 -5.512 329 HA PHE 25 HA PHE 25 19.633 -14.987 -3.003 330 HB2 PHE 25 2HB PHE 25 22.033 -14.528 -3.177 331 HB3 PHE 25 3HB PHE 25 21.711 -12.836 -3.542 332 HD1 PHE 25 HD1 PHE 25 21.286 -15.476 -0.915 333 HD2 PHE 25 HD2 PHE 25 21.330 -11.249 -1.773 334 HE1 PHE 25 HE1 PHE 25 21.176 -14.980 1.513 335 HE2 PHE 25 HE2 PHE 25 21.226 -10.758 0.658 336 HZ PHE 25 HZ PHE 25 21.147 -12.620 2.306 337 H TYR 26 H TYR 26 17.920 -14.168 -1.981 338 HA TYR 26 HA TYR 26 17.245 -11.295 -2.102 339 HB2 TYR 26 2HB TYR 26 16.004 -12.333 -3.938 340 HB3 TYR 26 3HB TYR 26 15.402 -13.591 -2.856 341 HD1 TYR 26 HD1 TYR 26 15.579 -9.841 -3.018 342 HD2 TYR 26 HD2 TYR 26 13.240 -13.309 -2.009 343 HE1 TYR 26 HE1 TYR 26 13.708 -8.365 -2.331 344 HE2 TYR 26 HE2 TYR 26 11.310 -11.834 -1.406 345 HH TYR 26 HH TYR 26 11.529 -8.252 -1.627 346 H THR 27 H THR 27 15.994 -10.585 -0.392 347 HA THR 27 HA THR 27 15.752 -12.376 2.001 348 HB THR 27 HB THR 27 16.214 -10.306 3.345 349 HG1 THR 27 HG1 THR 27 15.953 -8.806 1.649 350 HG21 THR 27 1HG2 THR 27 17.894 -12.100 3.021 351 HG22 THR 27 2HG2 THR 27 18.463 -11.304 1.537 352 HG23 THR 27 3HG2 THR 27 18.646 -10.499 3.109 353 HA PRO 28 HA PRO 28 11.510 -10.709 1.430 354 HB2 PRO 28 2HB PRO 28 10.118 -12.870 2.310 355 HB3 PRO 28 3HB PRO 28 10.854 -12.821 0.684 356 HG2 PRO 28 2HG PRO 28 11.990 -14.081 3.199 357 HG3 PRO 28 3HG PRO 28 11.831 -14.815 1.570 358 HD2 PRO 28 2HD PRO 28 14.146 -13.663 2.449 359 HD3 PRO 28 3HD PRO 28 13.648 -13.573 0.732 360 H LYS 29 H LYS 29 9.736 -10.486 3.116 361 HA LYS 29 HA LYS 29 9.025 -9.596 5.076 362 HB2 LYS 29 2HB LYS 29 10.696 -11.846 6.240 363 HB3 LYS 29 3HB LYS 29 9.357 -11.000 7.030 364 HG2 LYS 29 2HG LYS 29 7.792 -11.821 5.307 365 HG3 LYS 29 3HG LYS 29 9.110 -12.737 4.548 366 HD2 LYS 29 2HD LYS 29 9.471 -13.980 6.664 367 HD3 LYS 29 3HD LYS 29 8.115 -13.129 7.410 368 HE2 LYS 29 2HE LYS 29 7.925 -14.883 4.911 369 HE3 LYS 29 3HE LYS 29 7.598 -15.447 6.551 370 HZ1 LYS 29 HZ1 LYS 29 5.801 -13.816 6.698 371 HZ2 LYS 29 HZ2 LYS 29 6.078 -13.310 5.166 372 HZ3 LYS 29 HZ3 LYS 29 5.553 -14.830 5.444 373 H THR 30 H THR 30 10.524 -9.682 7.647 374 HA THR 30 HA THR 30 12.808 -7.937 7.496 375 HB THR 30 HB THR 30 11.105 -6.308 6.836 376 HG1 THR 30 HG1 THR 30 12.852 -5.611 8.032 377 HG21 THR 30 1HG2 THR 30 9.826 -6.715 9.568 378 HG22 THR 30 2HG2 THR 30 9.396 -5.502 8.347 379 HG23 THR 30 3HG2 THR 30 9.114 -7.217 8.017 Start of MODEL 23 1 H1 GLY 1 1H GLY 1 5.043 -2.219 2.714 2 H2 GLY 1 2H GLY 1 3.601 -2.811 2.222 3 H3 GLY 1 3H GLY 1 4.517 -1.924 1.190 4 HA2 GLY 1 HA2 GLY 1 6.261 -3.618 1.229 5 HA3 GLY 1 HA3 GLY 1 5.193 -4.593 2.253 6 H ILE 2 H ILE 2 6.152 -5.624 -0.098 7 HA ILE 2 HA ILE 2 4.841 -5.087 -2.506 8 HB ILE 2 HB ILE 2 6.902 -6.331 -2.340 9 HG12 ILE 2 2HG1 ILE 2 6.566 -8.210 -3.855 10 HG13 ILE 2 3HG1 ILE 2 4.823 -8.148 -3.582 11 HG21 ILE 2 1HG2 ILE 2 5.387 -8.686 -1.154 12 HG22 ILE 2 2HG2 ILE 2 7.098 -8.633 -1.595 13 HG23 ILE 2 3HG2 ILE 2 6.518 -7.632 -0.271 14 HD11 ILE 2 3HD1 ILE 2 5.405 -7.163 -5.702 15 HD12 ILE 2 1HD1 ILE 2 4.795 -5.872 -4.651 16 HD13 ILE 2 2HD1 ILE 2 6.547 -6.059 -4.944 17 H VAL 3 H VAL 3 3.745 -7.327 -0.007 18 HA VAL 3 HA VAL 3 1.625 -8.523 -1.468 19 HB VAL 3 HB VAL 3 1.869 -8.040 1.528 20 HG11 VAL 3 1HG1 VAL 3 -0.496 -8.585 0.994 21 HG12 VAL 3 2HG1 VAL 3 0.048 -10.019 0.087 22 HG13 VAL 3 3HG1 VAL 3 0.291 -9.917 1.839 23 HG21 VAL 3 3HG2 VAL 3 2.517 -10.501 -0.165 24 HG22 VAL 3 1HG2 VAL 3 3.710 -9.424 0.594 25 HG23 VAL 3 2HG2 VAL 3 2.640 -10.398 1.602 26 H GLU 4 H GLU 4 1.771 -5.389 0.189 27 HA GLU 4 HA GLU 4 -1.106 -4.904 0.089 28 HB2 GLU 4 2HB GLU 4 1.216 -3.018 0.613 29 HB3 GLU 4 3HB GLU 4 -0.489 -2.654 0.871 30 HG2 GLU 4 2HG GLU 4 -0.665 -4.360 2.608 31 HG3 GLU 4 3HG GLU 4 1.004 -4.874 2.336 32 H GLN 5 H GLN 5 1.308 -4.841 -2.319 33 HA GLN 5 HA GLN 5 -0.263 -2.918 -4.001 34 HB2 GLN 5 2HB GLN 5 2.088 -2.344 -3.760 35 HB3 GLN 5 3HB GLN 5 2.576 -3.962 -4.263 36 HG2 GLN 5 2HG GLN 5 2.861 -2.352 -6.062 37 HG3 GLN 5 3HG GLN 5 1.699 -3.582 -6.514 38 HE21 GLN 5 2HE2 GLN 5 -0.684 -2.923 -6.471 39 HE22 GLN 5 1HE2 GLN 5 -1.028 -1.222 -6.779 40 H CYS 6 H CYS 6 1.229 -6.218 -4.032 41 HA CYS 6 HA CYS 6 -0.118 -6.821 -6.588 42 HB2 CYS 6 2HB CYS 6 1.846 -8.251 -4.798 43 HB3 CYS 6 3HB CYS 6 1.148 -8.977 -6.234 44 H CYS 7 H CYS 7 -0.483 -8.002 -3.227 45 HA CYS 7 HA CYS 7 -2.348 -10.075 -4.055 46 HB2 CYS 7 2HB CYS 7 -0.822 -10.069 -2.026 47 HB3 CYS 7 3HB CYS 7 -1.972 -8.971 -1.261 48 H THR 8 H THR 8 -2.770 -6.735 -3.209 49 HA THR 8 HA THR 8 -5.648 -6.907 -2.694 50 HB THR 8 HB THR 8 -4.035 -5.265 -1.635 51 HG1 THR 8 HG1 THR 8 -5.641 -3.682 -1.636 52 HG21 THR 8 1HG2 THR 8 -2.886 -4.550 -3.753 53 HG22 THR 8 2HG2 THR 8 -4.388 -3.754 -4.270 54 HG23 THR 8 3HG2 THR 8 -3.548 -3.193 -2.816 55 H SER 9 H SER 9 -3.648 -6.181 -5.536 56 HA SER 9 HA SER 9 -5.934 -6.103 -7.309 57 HB2 SER 9 2HB SER 9 -5.917 -3.829 -6.168 58 HB3 SER 9 3HB SER 9 -4.409 -3.522 -7.058 59 HG SER 9 HG SER 9 -6.383 -2.805 -8.138 60 H ILE 10 H ILE 10 -4.929 -4.872 -9.485 61 HA ILE 10 HA ILE 10 -2.850 -6.610 -10.544 62 HB ILE 10 HB ILE 10 -3.850 -3.912 -11.550 63 HG12 ILE 10 2HG1 ILE 10 -5.712 -5.510 -11.445 64 HG13 ILE 10 3HG1 ILE 10 -5.309 -5.042 -13.085 65 HG21 ILE 10 1HG2 ILE 10 -2.206 -6.088 -12.914 66 HG22 ILE 10 2HG2 ILE 10 -2.956 -4.739 -13.789 67 HG23 ILE 10 3HG2 ILE 10 -1.696 -4.418 -12.606 68 HD11 ILE 10 3HD1 ILE 10 -5.829 -7.456 -12.862 69 HD12 ILE 10 1HD1 ILE 10 -4.209 -7.172 -13.510 70 HD13 ILE 10 2HD1 ILE 10 -4.415 -7.645 -11.803 71 H CYS 11 H CYS 11 -0.709 -6.492 -10.224 72 HA CYS 11 HA CYS 11 0.499 -3.790 -9.756 73 HB2 CYS 11 2HB CYS 11 2.257 -4.760 -8.504 74 HB3 CYS 11 3HB CYS 11 0.718 -5.216 -7.787 75 H SER 12 H SER 12 2.436 -3.311 -10.756 76 HA SER 12 HA SER 12 2.792 -4.724 -13.367 77 HB2 SER 12 2HB SER 12 3.593 -1.901 -12.629 78 HB3 SER 12 3HB SER 12 3.564 -2.645 -14.231 79 HG SER 12 HG SER 12 1.699 -1.286 -13.714 80 H LEU 13 H LEU 13 4.813 -5.094 -14.298 81 HA LEU 13 HA LEU 13 6.663 -6.280 -12.502 82 HB2 LEU 13 2HB LEU 13 8.072 -6.595 -14.414 83 HB3 LEU 13 3HB LEU 13 6.428 -7.076 -14.758 84 HG LEU 13 HG LEU 13 7.634 -4.442 -15.703 85 HD11 LEU 13 1HD1 LEU 13 8.939 -6.352 -16.566 86 HD12 LEU 13 2HD1 LEU 13 7.447 -7.103 -17.175 87 HD13 LEU 13 3HD1 LEU 13 8.026 -5.567 -17.861 88 HD21 LEU 13 3HD2 LEU 13 5.231 -4.308 -15.882 89 HD22 LEU 13 1HD2 LEU 13 5.871 -4.601 -17.487 90 HD23 LEU 13 2HD2 LEU 13 5.144 -5.944 -16.583 91 H TYR 14 H TYR 14 6.696 -3.143 -14.069 92 HA TYR 14 HA TYR 14 9.337 -2.403 -13.401 93 HB2 TYR 14 2HB TYR 14 8.653 -0.191 -14.135 94 HB3 TYR 14 3HB TYR 14 8.056 -1.467 -15.213 95 HD1 TYR 14 HD1 TYR 14 6.923 0.767 -12.382 96 HD2 TYR 14 HD2 TYR 14 5.845 -1.436 -15.935 97 HE1 TYR 14 HE1 TYR 14 4.641 1.733 -12.287 98 HE2 TYR 14 HE2 TYR 14 3.583 -0.415 -15.879 99 HH TYR 14 HH TYR 14 2.152 1.016 -14.775 100 H GLN 15 H GLN 15 6.729 -2.672 -11.282 101 HA GLN 15 HA GLN 15 8.001 -0.761 -9.339 102 HB2 GLN 15 2HB GLN 15 5.805 -0.629 -8.190 103 HB3 GLN 15 3HB GLN 15 5.817 0.137 -9.786 104 HG2 GLN 15 2HG GLN 15 4.597 -1.650 -10.776 105 HG3 GLN 15 3HG GLN 15 4.790 -2.684 -9.347 106 HE21 GLN 15 2HE2 GLN 15 3.901 0.522 -8.352 107 HE22 GLN 15 1HE2 GLN 15 2.245 0.044 -8.013 108 H LEU 16 H LEU 16 6.581 -4.012 -9.900 109 HA LEU 16 HA LEU 16 6.884 -4.828 -7.188 110 HB2 LEU 16 2HB LEU 16 5.701 -6.584 -7.847 111 HB3 LEU 16 3HB LEU 16 5.478 -5.685 -9.309 112 HG LEU 16 HG LEU 16 7.631 -6.894 -10.139 113 HD11 LEU 16 1HD1 LEU 16 6.873 -8.483 -7.672 114 HD12 LEU 16 2HD1 LEU 16 7.535 -9.341 -9.064 115 HD13 LEU 16 3HD1 LEU 16 8.488 -8.075 -8.301 116 HD21 LEU 16 3HD2 LEU 16 5.059 -8.514 -9.724 117 HD22 LEU 16 1HD2 LEU 16 5.292 -7.300 -11.002 118 HD23 LEU 16 2HD2 LEU 16 6.278 -8.772 -10.990 119 H GLU 17 H GLU 17 9.118 -4.902 -9.922 120 HA GLU 17 HA GLU 17 11.302 -6.428 -8.952 121 HB2 GLU 17 2HB GLU 17 11.157 -3.803 -10.508 122 HB3 GLU 17 3HB GLU 17 12.703 -4.502 -10.037 123 HG2 GLU 17 2HG GLU 17 12.189 -6.565 -11.275 124 HG3 GLU 17 3HG GLU 17 10.671 -5.832 -11.814 125 H ASN 18 H ASN 18 10.246 -3.181 -8.171 126 HA ASN 18 HA ASN 18 12.559 -2.193 -6.928 127 HB2 ASN 18 2HB ASN 18 10.187 -1.146 -7.655 128 HB3 ASN 18 3HB ASN 18 9.875 -1.258 -5.926 129 HD21 ASN 18 1HD2 ASN 18 11.725 0.257 -8.484 130 HD22 ASN 18 2HD2 ASN 18 12.512 1.464 -7.489 131 H TYR 19 H TYR 19 10.077 -4.246 -5.544 132 HA TYR 19 HA TYR 19 10.814 -3.846 -2.748 133 HB2 TYR 19 2HB TYR 19 9.054 -5.900 -4.141 134 HB3 TYR 19 3HB TYR 19 9.180 -5.674 -2.404 135 HD1 TYR 19 HD2 TYR 19 7.992 -4.109 -5.571 136 HD2 TYR 19 HD1 TYR 19 8.044 -3.878 -1.264 137 HE1 TYR 19 HE2 TYR 19 6.139 -2.454 -5.639 138 HE2 TYR 19 HE1 TYR 19 6.203 -2.197 -1.334 139 HH TYR 19 HH TYR 19 4.741 -1.090 -4.415 140 H CYS 20 H CYS 20 12.247 -5.669 -5.268 141 HA CYS 20 HA CYS 20 13.151 -7.968 -3.747 142 HB2 CYS 20 2HB CYS 20 12.956 -7.705 -6.275 143 HB3 CYS 20 3HB CYS 20 14.406 -6.706 -6.204 144 H ASN 21 H ASN 21 14.267 -4.676 -3.985 145 HA ASN 21 HA ASN 21 16.970 -5.110 -2.938 146 HB2 ASN 21 2HB ASN 21 16.488 -3.330 -4.567 147 HB3 ASN 21 3HB ASN 21 15.310 -2.604 -3.476 148 HD21 ASN 21 2HD2 ASN 21 16.257 -2.031 -1.244 149 HD22 ASN 21 1HD2 ASN 21 17.820 -1.196 -1.299 150 H1 PHE 1 1H PHE 1 5.296 -12.656 -19.655 151 H2 PHE 1 2H PHE 1 6.706 -12.425 -18.845 152 H3 PHE 1 3H PHE 1 6.040 -11.194 -19.698 153 HA PHE 1 HA PHE 1 4.913 -12.439 -17.287 154 HB2 PHE 1 2HB PHE 1 6.895 -10.903 -16.958 155 HB3 PHE 1 3HB PHE 1 5.958 -9.598 -17.668 156 HD1 PHE 1 HD1 PHE 1 6.023 -12.060 -14.830 157 HD2 PHE 1 HD2 PHE 1 4.472 -8.289 -16.271 158 HE1 PHE 1 HE1 PHE 1 5.085 -11.574 -12.586 159 HE2 PHE 1 HE2 PHE 1 3.580 -7.802 -14.020 160 HZ PHE 1 HZ PHE 1 3.866 -9.442 -12.176 161 H VAL 2 H VAL 2 3.073 -11.048 -16.389 162 HA VAL 2 HA VAL 2 1.731 -9.243 -18.205 163 HB VAL 2 HB VAL 2 0.677 -11.324 -18.944 164 HG11 VAL 2 1HG1 VAL 2 -0.444 -11.720 -16.148 165 HG12 VAL 2 2HG1 VAL 2 -0.762 -12.697 -17.586 166 HG13 VAL 2 3HG1 VAL 2 0.857 -12.695 -16.874 167 HG21 VAL 2 3HG2 VAL 2 -0.605 -9.204 -18.927 168 HG22 VAL 2 1HG2 VAL 2 -1.633 -10.639 -18.771 169 HG23 VAL 2 2HG2 VAL 2 -1.287 -9.644 -17.346 170 H ASN 3 H ASN 3 0.964 -7.560 -17.020 171 HA ASN 3 HA ASN 3 1.241 -7.439 -14.194 172 HB2 ASN 3 2HB ASN 3 -0.513 -5.807 -16.084 173 HB3 ASN 3 3HB ASN 3 -0.197 -5.402 -14.398 174 HD21 ASN 3 2HD2 ASN 3 0.309 -3.495 -16.033 175 HD22 ASN 3 1HD2 ASN 3 2.027 -3.302 -16.229 176 H GLN 4 H GLN 4 0.003 -8.353 -12.617 177 HA GLN 4 HA GLN 4 -2.843 -8.954 -13.038 178 HB2 GLN 4 2HB GLN 4 -2.637 -11.330 -12.996 179 HB3 GLN 4 3HB GLN 4 -1.606 -10.732 -14.285 180 HG2 GLN 4 2HG GLN 4 0.349 -10.883 -12.609 181 HG3 GLN 4 3HG GLN 4 -0.762 -11.756 -11.552 182 HE21 GLN 4 1HE2 GLN 4 1.615 -12.217 -13.867 183 HE22 GLN 4 2HE2 GLN 4 1.150 -13.842 -14.359 184 H HIS 5 H HIS 5 -3.537 -10.474 -11.207 185 HA HIS 5 HA HIS 5 -2.817 -9.270 -8.595 186 HB2 HIS 5 2HB HIS 5 -4.818 -11.443 -9.360 187 HB3 HIS 5 3HB HIS 5 -4.619 -10.751 -7.753 188 HD2 HIS 5 HD2 HIS 5 -5.866 -9.751 -11.299 189 HE1 HIS 5 HE1 HIS 5 -7.383 -6.866 -8.570 190 HE2 HIS 5 HE2 HIS 5 -7.476 -7.706 -10.977 191 H LEU 6 H LEU 6 -1.321 -10.167 -7.231 192 HA LEU 6 HA LEU 6 -0.480 -13.024 -7.578 193 HB2 LEU 6 2HB LEU 6 1.361 -10.611 -7.462 194 HB3 LEU 6 3HB LEU 6 1.890 -12.280 -7.345 195 HG LEU 6 HG LEU 6 0.519 -11.069 -9.784 196 HD11 LEU 6 1HD1 LEU 6 2.870 -11.167 -10.725 197 HD12 LEU 6 2HD1 LEU 6 2.626 -9.962 -9.447 198 HD13 LEU 6 3HD1 LEU 6 3.432 -11.491 -9.066 199 HD21 LEU 6 3HD2 LEU 6 1.402 -13.085 -10.939 200 HD22 LEU 6 1HD2 LEU 6 2.026 -13.704 -9.403 201 HD23 LEU 6 2HD2 LEU 6 0.277 -13.553 -9.658 202 H CYS 7 H CYS 7 -0.208 -14.100 -5.726 203 HA CYS 7 HA CYS 7 0.579 -12.751 -3.254 204 HB2 CYS 7 2HB CYS 7 -1.989 -12.510 -3.669 205 HB3 CYS 7 3HB CYS 7 -2.076 -14.195 -3.177 206 H GLY 8 H GLY 8 1.351 -14.189 -1.677 207 HA2 GLY 8 HA2 GLY 8 2.362 -16.120 -0.874 208 HA3 GLY 8 HA3 GLY 8 1.040 -17.002 -1.647 209 H SER 9 H SER 9 1.787 -18.576 -2.868 210 HA SER 9 HA SER 9 4.396 -18.991 -3.876 211 HB2 SER 9 2HB SER 9 3.134 -20.585 -5.449 212 HB3 SER 9 3HB SER 9 2.973 -20.854 -3.705 213 HG SER 9 HG SER 9 0.946 -20.972 -4.813 214 H HIS 10 H HIS 10 1.560 -17.505 -5.519 215 HA HIS 10 HA HIS 10 2.849 -17.202 -8.065 216 HB2 HIS 10 2HB HIS 10 0.304 -16.510 -6.838 217 HB3 HIS 10 3HB HIS 10 0.915 -15.117 -7.710 218 HD2 HIS 10 HD2 HIS 10 -0.847 -18.320 -8.240 219 HE1 HIS 10 HE1 HIS 10 0.477 -17.212 -12.131 220 HE2 HIS 10 HE2 HIS 10 -1.048 -18.787 -10.829 221 H LEU 11 H LEU 11 2.835 -15.148 -5.200 222 HA LEU 11 HA LEU 11 4.109 -12.873 -6.483 223 HB2 LEU 11 2HB LEU 11 2.605 -12.957 -4.354 224 HB3 LEU 11 3HB LEU 11 4.043 -13.516 -3.507 225 HG LEU 11 HG LEU 11 5.193 -11.375 -4.146 226 HD11 LEU 11 1HD1 LEU 11 3.765 -9.510 -5.000 227 HD12 LEU 11 2HD1 LEU 11 3.918 -10.784 -6.204 228 HD13 LEU 11 3HD1 LEU 11 2.431 -10.647 -5.234 229 HD21 LEU 11 3HD2 LEU 11 3.855 -9.957 -2.598 230 HD22 LEU 11 1HD2 LEU 11 2.483 -11.061 -2.757 231 HD23 LEU 11 2HD2 LEU 11 3.990 -11.612 -1.983 232 H VAL 12 H VAL 12 5.279 -15.536 -4.391 233 HA VAL 12 HA VAL 12 8.059 -14.872 -4.475 234 HB VAL 12 HB VAL 12 6.690 -17.581 -4.227 235 HG11 VAL 12 1HG1 VAL 12 8.996 -18.006 -4.933 236 HG12 VAL 12 2HG1 VAL 12 9.610 -16.856 -3.720 237 HG13 VAL 12 3HG1 VAL 12 8.833 -18.374 -3.215 238 HG21 VAL 12 3HG2 VAL 12 7.160 -17.319 -1.827 239 HG22 VAL 12 1HG2 VAL 12 7.916 -15.737 -2.130 240 HG23 VAL 12 2HG2 VAL 12 6.181 -15.969 -2.408 241 H GLU 13 H GLU 13 6.109 -16.928 -6.675 242 HA GLU 13 HA GLU 13 8.158 -17.585 -8.533 243 HB2 GLU 13 2HB GLU 13 5.143 -17.369 -8.690 244 HB3 GLU 13 3HB GLU 13 6.077 -17.571 -10.165 245 HG2 GLU 13 2HG GLU 13 7.154 -19.595 -9.249 246 HG3 GLU 13 3HG GLU 13 6.250 -19.415 -7.742 247 H ALA 14 H ALA 14 5.929 -14.683 -8.569 248 HA ALA 14 HA ALA 14 6.999 -13.630 -10.975 249 HB1 ALA 14 3HB ALA 14 5.926 -11.550 -10.207 250 HB2 ALA 14 1HB ALA 14 4.884 -12.973 -9.962 251 HB3 ALA 14 2HB ALA 14 5.737 -12.236 -8.578 252 H LEU 15 H LEU 15 7.950 -12.901 -7.547 253 HA LEU 15 HA LEU 15 10.033 -11.086 -8.188 254 HB2 LEU 15 2HB LEU 15 9.416 -12.880 -5.834 255 HB3 LEU 15 3HB LEU 15 11.035 -12.230 -5.950 256 HG LEU 15 HG LEU 15 9.747 -10.850 -4.503 257 HD11 LEU 15 1HD1 LEU 15 11.469 -9.768 -5.948 258 HD12 LEU 15 2HD1 LEU 15 10.184 -9.276 -7.073 259 HD13 LEU 15 3HD1 LEU 15 10.188 -8.668 -5.412 260 HD21 LEU 15 3HD2 LEU 15 7.837 -9.457 -5.368 261 HD22 LEU 15 1HD2 LEU 15 7.790 -10.506 -6.798 262 HD23 LEU 15 2HD2 LEU 15 7.497 -11.182 -5.184 263 H TYR 16 H TYR 16 10.179 -14.670 -8.147 264 HA TYR 16 HA TYR 16 12.983 -14.790 -8.751 265 HB2 TYR 16 2HB TYR 16 11.629 -16.760 -8.041 266 HB3 TYR 16 3HB TYR 16 10.792 -16.720 -9.598 267 HD1 TYR 16 HD2 TYR 16 14.091 -17.269 -7.957 268 HD2 TYR 16 HD1 TYR 16 11.864 -17.483 -11.644 269 HE1 TYR 16 HE2 TYR 16 16.002 -18.434 -9.040 270 HE2 TYR 16 HE1 TYR 16 13.778 -18.619 -12.741 271 HH TYR 16 HH TYR 16 16.800 -19.408 -10.950 272 H LEU 17 H LEU 17 10.123 -14.584 -10.951 273 HA LEU 17 HA LEU 17 11.733 -14.705 -13.340 274 HB2 LEU 17 2HB LEU 17 8.927 -13.591 -12.868 275 HB3 LEU 17 3HB LEU 17 9.647 -13.852 -14.448 276 HG LEU 17 HG LEU 17 9.110 -16.062 -12.433 277 HD11 LEU 17 1HD1 LEU 17 7.232 -16.674 -13.904 278 HD12 LEU 17 2HD1 LEU 17 7.025 -15.040 -13.252 279 HD13 LEU 17 3HD1 LEU 17 7.564 -15.262 -14.933 280 HD21 LEU 17 3HD2 LEU 17 9.478 -17.578 -14.368 281 HD22 LEU 17 1HD2 LEU 17 9.963 -16.185 -15.358 282 HD23 LEU 17 2HD2 LEU 17 10.938 -16.678 -13.953 283 H VAL 18 H VAL 18 10.372 -11.871 -11.600 284 HA VAL 18 HA VAL 18 11.514 -10.059 -13.590 285 HB VAL 18 HB VAL 18 10.938 -8.548 -11.190 286 HG11 VAL 18 1HG1 VAL 18 10.893 -7.681 -13.478 287 HG12 VAL 18 2HG1 VAL 18 9.466 -8.692 -13.831 288 HG13 VAL 18 3HG1 VAL 18 9.379 -7.397 -12.606 289 HG21 VAL 18 3HG2 VAL 18 9.548 -10.132 -10.327 290 HG22 VAL 18 1HG2 VAL 18 8.540 -8.893 -11.068 291 HG23 VAL 18 2HG2 VAL 18 8.723 -10.441 -11.908 292 H CYS 19 H CYS 19 12.584 -11.158 -10.383 293 HA CYS 19 HA CYS 19 14.912 -9.294 -10.577 294 HB2 CYS 19 2HB CYS 19 13.307 -9.010 -8.686 295 HB3 CYS 19 3HB CYS 19 13.759 -10.617 -8.111 296 H GLY 20 H GLY 20 14.097 -12.686 -9.691 297 HA2 GLY 20 HA2 GLY 20 16.780 -13.252 -8.756 298 HA3 GLY 20 HA3 GLY 20 15.445 -14.412 -8.926 299 H GLU 21 H GLU 21 14.969 -14.455 -11.580 300 HA GLU 21 HA GLU 21 16.921 -16.203 -12.633 301 HB2 GLU 21 2HB GLU 21 14.443 -16.035 -13.180 302 HB3 GLU 21 3HB GLU 21 14.813 -14.605 -14.142 303 HG2 GLU 21 2HG GLU 21 16.383 -16.077 -15.527 304 HG3 GLU 21 3HG GLU 21 15.785 -17.459 -14.601 305 H ARG 22 H ARG 22 16.528 -12.730 -12.988 306 HA ARG 22 HA ARG 22 17.874 -12.133 -15.355 307 HB2 ARG 22 2HB ARG 22 17.963 -10.493 -12.805 308 HB3 ARG 22 3HB ARG 22 18.105 -9.891 -14.447 309 HG2 ARG 22 2HG ARG 22 15.563 -11.102 -13.236 310 HG3 ARG 22 3HG ARG 22 15.967 -9.400 -13.342 311 HD2 ARG 22 2HD ARG 22 14.480 -9.739 -15.076 312 HD3 ARG 22 3HD ARG 22 16.059 -9.616 -15.852 313 HE ARG 22 HE ARG 22 15.512 -12.378 -15.421 314 HH11 ARG 22 1HH2 ARG 22 14.190 -9.722 -17.371 315 HH12 ARG 22 2HH2 ARG 22 13.487 -10.819 -18.531 316 HH21 ARG 22 1HH1 ARG 22 14.421 -13.744 -16.982 317 HH22 ARG 22 2HH1 ARG 22 13.683 -12.946 -18.341 318 H GLY 23 H GLY 23 19.312 -13.181 -12.360 319 HA2 GLY 23 HA2 GLY 23 21.991 -12.144 -12.701 320 HA3 GLY 23 HA3 GLY 23 21.456 -13.470 -11.629 321 H HIS 24 H HIS 24 20.358 -14.984 -13.934 322 HA HIS 24 HA HIS 24 22.916 -15.875 -15.226 323 HB2 HIS 24 2HB HIS 24 22.306 -18.138 -15.018 324 HB3 HIS 24 3HB HIS 24 22.171 -17.400 -13.429 325 HD2 HIS 24 HD2 HIS 24 19.723 -17.174 -12.379 326 HE1 HIS 24 HE1 HIS 24 17.688 -19.567 -15.258 327 HE2 HIS 24 HE2 HIS 24 17.494 -18.477 -12.967 328 H PHE 25 H PHE 25 19.536 -15.094 -15.813 329 HA PHE 25 HA PHE 25 20.016 -15.240 -18.719 330 HB2 PHE 25 2HB PHE 25 19.255 -17.505 -18.142 331 HB3 PHE 25 3HB PHE 25 17.846 -16.848 -17.324 332 HD1 PHE 25 HD1 PHE 25 19.566 -16.792 -20.681 333 HD2 PHE 25 HD2 PHE 25 15.823 -16.682 -18.540 334 HE1 PHE 25 HE1 PHE 25 18.330 -16.858 -22.833 335 HE2 PHE 25 HE2 PHE 25 14.592 -16.775 -20.692 336 HZ PHE 25 HZ PHE 25 15.841 -16.851 -22.843 337 H TYR 26 H TYR 26 19.259 -13.477 -19.628 338 HA TYR 26 HA TYR 26 17.113 -11.880 -18.323 339 HB2 TYR 26 2HB TYR 26 19.394 -10.890 -18.794 340 HB3 TYR 26 3HB TYR 26 19.047 -11.055 -20.513 341 HD1 TYR 26 HD1 TYR 26 17.861 -9.548 -17.328 342 HD2 TYR 26 HD2 TYR 26 17.685 -9.362 -21.633 343 HE1 TYR 26 HE1 TYR 26 16.587 -7.410 -17.182 344 HE2 TYR 26 HE2 TYR 26 16.463 -7.208 -21.492 345 HH TYR 26 HH TYR 26 15.539 -5.613 -20.111 346 H THR 27 H THR 27 15.401 -11.070 -19.492 347 HA THR 27 HA THR 27 15.024 -11.789 -22.332 348 HB THR 27 HB THR 27 12.584 -12.147 -21.962 349 HG1 THR 27 HG1 THR 27 11.852 -12.568 -19.948 350 HG21 THR 27 1HG2 THR 27 12.778 -14.485 -21.304 351 HG22 THR 27 2HG2 THR 27 14.159 -14.050 -22.325 352 HG23 THR 27 3HG2 THR 27 14.365 -14.189 -20.565 353 HA PRO 28 HA PRO 28 14.061 -7.394 -21.971 354 HB2 PRO 28 2HB PRO 28 14.071 -6.677 -24.565 355 HB3 PRO 28 3HB PRO 28 15.570 -7.213 -23.757 356 HG2 PRO 28 2HG PRO 28 13.698 -8.874 -25.478 357 HG3 PRO 28 3HG PRO 28 15.481 -8.723 -25.617 358 HD2 PRO 28 2HD PRO 28 14.262 -10.773 -24.249 359 HD3 PRO 28 3HD PRO 28 15.838 -10.092 -23.743 360 H LYS 29 H LYS 29 12.299 -6.022 -22.313 361 HA LYS 29 HA LYS 29 10.165 -5.341 -22.507 362 HB2 LYS 29 2HB LYS 29 10.631 -6.186 -24.910 363 HB3 LYS 29 3HB LYS 29 9.581 -7.546 -24.500 364 HG2 LYS 29 2HG LYS 29 7.695 -6.005 -24.125 365 HG3 LYS 29 3HG LYS 29 8.769 -4.610 -24.298 366 HD2 LYS 29 2HD LYS 29 7.478 -4.906 -26.321 367 HD3 LYS 29 3HD LYS 29 9.184 -5.223 -26.664 368 HE2 LYS 29 2HE LYS 29 8.759 -7.670 -26.530 369 HE3 LYS 29 3HE LYS 29 7.064 -7.362 -26.130 370 HZ1 LYS 29 HZ1 LYS 29 8.380 -6.597 -28.680 371 HZ2 LYS 29 HZ2 LYS 29 7.348 -7.847 -28.486 372 HZ3 LYS 29 HZ3 LYS 29 6.812 -6.315 -28.312 373 H THR 30 H THR 30 7.821 -5.911 -22.146 374 HA THR 30 HA THR 30 7.422 -7.490 -19.797 375 HB THR 30 HB THR 30 5.285 -6.597 -21.764 376 HG1 THR 30 HG1 THR 30 6.569 -5.164 -19.680 377 HG21 THR 30 1HG2 THR 30 3.941 -6.330 -19.665 378 HG22 THR 30 2HG2 THR 30 4.404 -8.009 -19.979 379 HG23 THR 30 3HG2 THR 30 5.274 -7.073 -18.748 Start of MODEL 24 1 H1 GLY 1 1H GLY 1 3.473 -1.783 0.988 2 H2 GLY 1 2H GLY 1 3.483 -1.072 -0.487 3 H3 GLY 1 3H GLY 1 4.894 -1.375 0.293 4 HA2 GLY 1 HA2 GLY 1 3.054 -3.501 -0.689 5 HA3 GLY 1 HA3 GLY 1 4.563 -3.025 -1.491 6 H ILE 2 H ILE 2 6.004 -5.567 0.043 7 HA ILE 2 HA ILE 2 4.814 -4.928 -2.465 8 HB ILE 2 HB ILE 2 6.830 -6.235 -2.232 9 HG12 ILE 2 2HG1 ILE 2 6.417 -8.128 -3.734 10 HG13 ILE 2 3HG1 ILE 2 4.675 -7.954 -3.496 11 HG21 ILE 2 1HG2 ILE 2 5.227 -8.545 -1.081 12 HG22 ILE 2 2HG2 ILE 2 6.951 -8.516 -1.462 13 HG23 ILE 2 3HG2 ILE 2 6.340 -7.512 -0.153 14 HD11 ILE 2 3HD1 ILE 2 6.546 -5.977 -4.823 15 HD12 ILE 2 1HD1 ILE 2 5.384 -7.025 -5.620 16 HD13 ILE 2 2HD1 ILE 2 4.798 -5.703 -4.587 17 H VAL 3 H VAL 3 3.664 -7.138 0.093 18 HA VAL 3 HA VAL 3 1.693 -8.458 -1.441 19 HB VAL 3 HB VAL 3 1.791 -7.942 1.553 20 HG11 VAL 3 1HG1 VAL 3 -0.559 -8.493 0.982 21 HG12 VAL 3 2HG1 VAL 3 -0.003 -9.920 0.074 22 HG13 VAL 3 3HG1 VAL 3 0.214 -9.831 1.831 23 HG21 VAL 3 3HG2 VAL 3 2.584 -10.288 1.648 24 HG22 VAL 3 1HG2 VAL 3 2.470 -10.408 -0.119 25 HG23 VAL 3 2HG2 VAL 3 3.655 -9.318 0.633 26 H GLU 4 H GLU 4 1.286 -5.507 0.582 27 HA GLU 4 HA GLU 4 -1.475 -5.146 -0.132 28 HB2 GLU 4 2HB GLU 4 -1.283 -2.975 0.946 29 HB3 GLU 4 3HB GLU 4 -0.531 -4.244 1.922 30 HG2 GLU 4 2HG GLU 4 1.698 -3.576 1.103 31 HG3 GLU 4 3HG GLU 4 0.968 -2.321 0.093 32 H GLN 5 H GLN 5 1.246 -4.704 -2.204 33 HA GLN 5 HA GLN 5 -0.329 -2.848 -3.933 34 HB2 GLN 5 2HB GLN 5 2.124 -2.456 -3.647 35 HB3 GLN 5 3HB GLN 5 2.440 -4.052 -4.323 36 HG2 GLN 5 2HG GLN 5 2.761 -2.384 -6.033 37 HG3 GLN 5 3HG GLN 5 1.376 -3.370 -6.459 38 HE21 GLN 5 2HE2 GLN 5 1.084 -1.372 -7.952 39 HE22 GLN 5 1HE2 GLN 5 0.116 -0.070 -7.259 40 H CYS 6 H CYS 6 1.179 -6.131 -4.030 41 HA CYS 6 HA CYS 6 -0.147 -6.693 -6.585 42 HB2 CYS 6 2HB CYS 6 1.795 -8.161 -4.797 43 HB3 CYS 6 3HB CYS 6 1.166 -8.829 -6.293 44 H CYS 7 H CYS 7 -0.589 -7.962 -3.284 45 HA CYS 7 HA CYS 7 -2.263 -10.162 -4.141 46 HB2 CYS 7 2HB CYS 7 -0.866 -10.003 -2.049 47 HB3 CYS 7 3HB CYS 7 -2.073 -8.903 -1.387 48 H THR 8 H THR 8 -2.988 -6.851 -3.452 49 HA THR 8 HA THR 8 -5.903 -7.318 -3.187 50 HB THR 8 HB THR 8 -4.589 -5.853 -1.637 51 HG1 THR 8 HG1 THR 8 -6.247 -4.318 -1.604 52 HG21 THR 8 1HG2 THR 8 -3.150 -4.737 -3.347 53 HG22 THR 8 2HG2 THR 8 -4.582 -3.878 -3.957 54 HG23 THR 8 3HG2 THR 8 -4.019 -3.598 -2.299 55 H SER 9 H SER 9 -3.644 -6.010 -5.580 56 HA SER 9 HA SER 9 -5.843 -5.550 -7.516 57 HB2 SER 9 2HB SER 9 -3.839 -3.463 -6.609 58 HB3 SER 9 3HB SER 9 -4.829 -3.337 -8.074 59 HG SER 9 HG SER 9 -5.788 -2.237 -6.302 60 H ILE 10 H ILE 10 -4.880 -4.903 -9.732 61 HA ILE 10 HA ILE 10 -2.770 -6.646 -10.639 62 HB ILE 10 HB ILE 10 -3.751 -4.009 -11.819 63 HG12 ILE 10 2HG1 ILE 10 -5.595 -5.655 -11.658 64 HG13 ILE 10 3HG1 ILE 10 -5.191 -5.186 -13.296 65 HG21 ILE 10 1HG2 ILE 10 -2.809 -4.937 -13.991 66 HG22 ILE 10 2HG2 ILE 10 -1.580 -4.535 -12.801 67 HG23 ILE 10 3HG2 ILE 10 -2.055 -6.226 -13.034 68 HD11 ILE 10 3HD1 ILE 10 -4.267 -7.781 -12.008 69 HD12 ILE 10 1HD1 ILE 10 -5.683 -7.610 -13.066 70 HD13 ILE 10 2HD1 ILE 10 -4.068 -7.307 -13.713 71 H CYS 11 H CYS 11 -0.625 -6.506 -10.282 72 HA CYS 11 HA CYS 11 0.560 -3.775 -9.952 73 HB2 CYS 11 2HB CYS 11 2.246 -4.610 -8.545 74 HB3 CYS 11 3HB CYS 11 0.695 -5.112 -7.885 75 H SER 12 H SER 12 2.476 -3.330 -10.952 76 HA SER 12 HA SER 12 2.896 -4.891 -13.458 77 HB2 SER 12 2HB SER 12 3.633 -2.008 -12.906 78 HB3 SER 12 3HB SER 12 3.583 -2.844 -14.461 79 HG SER 12 HG SER 12 1.698 -1.510 -13.999 80 H LEU 13 H LEU 13 4.976 -5.103 -14.429 81 HA LEU 13 HA LEU 13 6.816 -6.270 -12.609 82 HB2 LEU 13 2HB LEU 13 8.277 -6.516 -14.499 83 HB3 LEU 13 3HB LEU 13 6.659 -7.065 -14.866 84 HG LEU 13 HG LEU 13 7.700 -4.351 -15.779 85 HD11 LEU 13 1HD1 LEU 13 9.237 -6.109 -16.572 86 HD12 LEU 13 2HD1 LEU 13 7.864 -7.022 -17.238 87 HD13 LEU 13 3HD1 LEU 13 8.300 -5.436 -17.914 88 HD21 LEU 13 3HD2 LEU 13 5.295 -4.494 -16.061 89 HD22 LEU 13 1HD2 LEU 13 6.048 -4.677 -17.636 90 HD23 LEU 13 2HD2 LEU 13 5.434 -6.113 -16.794 91 H TYR 14 H TYR 14 6.794 -3.110 -14.117 92 HA TYR 14 HA TYR 14 9.411 -2.324 -13.346 93 HB2 TYR 14 2HB TYR 14 8.714 -0.132 -14.120 94 HB3 TYR 14 3HB TYR 14 8.198 -1.415 -15.231 95 HD1 TYR 14 HD1 TYR 14 6.932 0.858 -12.503 96 HD2 TYR 14 HD2 TYR 14 5.972 -1.519 -15.975 97 HE1 TYR 14 HE1 TYR 14 4.623 1.765 -12.482 98 HE2 TYR 14 HE2 TYR 14 3.678 -0.571 -15.988 99 HH TYR 14 HH TYR 14 2.188 0.860 -14.962 100 H GLN 15 H GLN 15 6.758 -2.717 -11.328 101 HA GLN 15 HA GLN 15 7.827 -0.726 -9.355 102 HB2 GLN 15 2HB GLN 15 5.533 -0.522 -8.423 103 HB3 GLN 15 3HB GLN 15 5.720 0.158 -10.044 104 HG2 GLN 15 2HG GLN 15 4.622 -1.740 -11.048 105 HG3 GLN 15 3HG GLN 15 4.563 -2.609 -9.502 106 HE21 GLN 15 2HE2 GLN 15 3.633 0.862 -10.070 107 HE22 GLN 15 1HE2 GLN 15 1.954 0.560 -9.667 108 H LEU 16 H LEU 16 6.467 -4.001 -9.897 109 HA LEU 16 HA LEU 16 6.723 -4.807 -7.168 110 HB2 LEU 16 2HB LEU 16 5.601 -6.579 -7.921 111 HB3 LEU 16 3HB LEU 16 5.460 -5.714 -9.412 112 HG LEU 16 HG LEU 16 7.752 -6.884 -10.023 113 HD11 LEU 16 1HD1 LEU 16 8.291 -7.960 -7.974 114 HD12 LEU 16 2HD1 LEU 16 6.628 -8.544 -7.727 115 HD13 LEU 16 3HD1 LEU 16 7.647 -9.270 -8.965 116 HD21 LEU 16 3HD2 LEU 16 5.536 -7.287 -11.152 117 HD22 LEU 16 1HD2 LEU 16 6.612 -8.696 -11.080 118 HD23 LEU 16 2HD2 LEU 16 5.218 -8.568 -9.966 119 H GLU 17 H GLU 17 8.963 -4.834 -9.887 120 HA GLU 17 HA GLU 17 11.223 -6.200 -8.976 121 HB2 GLU 17 2HB GLU 17 10.806 -3.677 -10.605 122 HB3 GLU 17 3HB GLU 17 12.424 -4.015 -10.010 123 HG2 GLU 17 2HG GLU 17 12.375 -6.252 -11.060 124 HG3 GLU 17 3HG GLU 17 10.800 -5.860 -11.770 125 H ASN 18 H ASN 18 10.009 -3.080 -7.875 126 HA ASN 18 HA ASN 18 12.333 -2.023 -6.655 127 HB2 ASN 18 2HB ASN 18 9.389 -1.595 -6.059 128 HB3 ASN 18 3HB ASN 18 10.663 -0.653 -5.398 129 HD21 ASN 18 2HD2 ASN 18 8.828 0.751 -6.792 130 HD22 ASN 18 1HD2 ASN 18 9.546 1.276 -8.312 131 H TYR 19 H TYR 19 10.252 -4.549 -5.568 132 HA TYR 19 HA TYR 19 10.990 -4.332 -2.713 133 HB2 TYR 19 2HB TYR 19 8.992 -6.053 -4.230 134 HB3 TYR 19 3HB TYR 19 9.176 -5.977 -2.485 135 HD1 TYR 19 HD1 TYR 19 8.456 -4.046 -1.196 136 HD2 TYR 19 HD2 TYR 19 7.944 -4.102 -5.493 137 HE1 TYR 19 HE1 TYR 19 6.854 -2.164 -1.034 138 HE2 TYR 19 HE2 TYR 19 6.274 -2.279 -5.301 139 HH TYR 19 HH TYR 19 5.551 -0.628 -2.218 140 H CYS 20 H CYS 20 12.445 -5.784 -5.337 141 HA CYS 20 HA CYS 20 13.062 -8.419 -4.309 142 HB2 CYS 20 2HB CYS 20 13.265 -7.694 -6.679 143 HB3 CYS 20 3HB CYS 20 14.611 -6.644 -6.239 144 H ASN 21 H ASN 21 14.504 -5.267 -3.764 145 HA ASN 21 HA ASN 21 16.869 -6.265 -2.334 146 HB2 ASN 21 2HB ASN 21 17.205 -3.771 -1.893 147 HB3 ASN 21 3HB ASN 21 17.297 -4.319 -3.561 148 HD21 ASN 21 2HD2 ASN 21 14.345 -3.627 -1.667 149 HD22 ASN 21 1HD2 ASN 21 13.758 -2.415 -2.820 150 H1 PHE 1 1H PHE 1 6.375 -11.380 -19.496 151 H2 PHE 1 2H PHE 1 5.715 -12.872 -19.396 152 H3 PHE 1 3H PHE 1 7.104 -12.538 -18.590 153 HA PHE 1 HA PHE 1 5.253 -12.604 -17.069 154 HB2 PHE 1 2HB PHE 1 7.205 -11.058 -16.679 155 HB3 PHE 1 3HB PHE 1 6.298 -9.763 -17.442 156 HD1 PHE 1 HD1 PHE 1 6.262 -12.183 -14.571 157 HD2 PHE 1 HD2 PHE 1 4.749 -8.440 -16.122 158 HE1 PHE 1 HE1 PHE 1 5.233 -11.672 -12.372 159 HE2 PHE 1 HE2 PHE 1 3.771 -7.926 -13.913 160 HZ PHE 1 HZ PHE 1 3.990 -9.541 -12.041 161 H VAL 2 H VAL 2 3.335 -11.321 -16.238 162 HA VAL 2 HA VAL 2 2.002 -9.545 -18.125 163 HB VAL 2 HB VAL 2 1.013 -11.689 -18.776 164 HG11 VAL 2 1HG1 VAL 2 -0.428 -13.016 -17.377 165 HG12 VAL 2 2HG1 VAL 2 1.174 -12.944 -16.630 166 HG13 VAL 2 3HG1 VAL 2 -0.162 -11.957 -15.987 167 HG21 VAL 2 3HG2 VAL 2 -1.009 -9.960 -17.306 168 HG22 VAL 2 1HG2 VAL 2 -0.306 -9.596 -18.899 169 HG23 VAL 2 2HG2 VAL 2 -1.313 -11.038 -18.680 170 H ASN 3 H ASN 3 1.190 -7.838 -17.030 171 HA ASN 3 HA ASN 3 1.421 -7.579 -14.205 172 HB2 ASN 3 2HB ASN 3 -0.337 -6.069 -16.189 173 HB3 ASN 3 3HB ASN 3 -0.037 -5.578 -14.523 174 HD21 ASN 3 2HD2 ASN 3 0.440 -3.752 -16.270 175 HD22 ASN 3 1HD2 ASN 3 2.155 -3.533 -16.454 176 H GLN 4 H GLN 4 0.149 -8.429 -12.605 177 HA GLN 4 HA GLN 4 -2.678 -9.075 -13.050 178 HB2 GLN 4 2HB GLN 4 -2.471 -11.453 -12.892 179 HB3 GLN 4 3HB GLN 4 -1.459 -10.901 -14.213 180 HG2 GLN 4 2HG GLN 4 0.514 -10.973 -12.540 181 HG3 GLN 4 3HG GLN 4 -0.588 -11.817 -11.453 182 HE21 GLN 4 2HE2 GLN 4 1.857 -12.404 -13.587 183 HE22 GLN 4 1HE2 GLN 4 1.382 -14.024 -14.081 184 H HIS 5 H HIS 5 -3.380 -10.549 -11.167 185 HA HIS 5 HA HIS 5 -2.643 -9.261 -8.589 186 HB2 HIS 5 2HB HIS 5 -4.727 -11.379 -9.266 187 HB3 HIS 5 3HB HIS 5 -4.484 -10.644 -7.684 188 HD2 HIS 5 HD2 HIS 5 -5.753 -9.748 -11.233 189 HE1 HIS 5 HE1 HIS 5 -7.198 -6.747 -8.583 190 HE2 HIS 5 HE2 HIS 5 -7.326 -7.660 -10.962 191 H LEU 6 H LEU 6 -1.279 -10.199 -7.130 192 HA LEU 6 HA LEU 6 -0.397 -13.047 -7.475 193 HB2 LEU 6 2HB LEU 6 1.375 -10.587 -7.321 194 HB3 LEU 6 3HB LEU 6 1.955 -12.238 -7.201 195 HG LEU 6 HG LEU 6 0.561 -11.103 -9.661 196 HD11 LEU 6 1HD1 LEU 6 2.519 -9.815 -9.399 197 HD12 LEU 6 2HD1 LEU 6 3.452 -11.197 -8.817 198 HD13 LEU 6 3HD1 LEU 6 2.981 -11.100 -10.534 199 HD21 LEU 6 3HD2 LEU 6 0.490 -13.579 -9.525 200 HD22 LEU 6 1HD2 LEU 6 1.628 -13.062 -10.778 201 HD23 LEU 6 2HD2 LEU 6 2.238 -13.619 -9.213 202 H CYS 7 H CYS 7 -0.150 -14.115 -5.598 203 HA CYS 7 HA CYS 7 0.603 -12.721 -3.135 204 HB2 CYS 7 2HB CYS 7 -1.991 -12.606 -3.600 205 HB3 CYS 7 3HB CYS 7 -1.988 -14.259 -3.008 206 H GLY 8 H GLY 8 1.358 -14.127 -1.504 207 HA2 GLY 8 HA2 GLY 8 2.454 -16.001 -0.680 208 HA3 GLY 8 HA3 GLY 8 1.190 -16.948 -1.473 209 H SER 9 H SER 9 2.165 -18.552 -2.535 210 HA SER 9 HA SER 9 4.774 -18.673 -3.556 211 HB2 SER 9 2HB SER 9 2.319 -20.128 -4.606 212 HB3 SER 9 3HB SER 9 4.011 -20.629 -4.784 213 HG SER 9 HG SER 9 2.957 -21.726 -3.041 214 H HIS 10 H HIS 10 1.825 -17.468 -5.226 215 HA HIS 10 HA HIS 10 3.031 -17.246 -7.828 216 HB2 HIS 10 2HB HIS 10 0.484 -16.673 -6.602 217 HB3 HIS 10 3HB HIS 10 1.019 -15.205 -7.388 218 HD2 HIS 10 HD2 HIS 10 -0.997 -18.068 -8.173 219 HE1 HIS 10 HE1 HIS 10 0.815 -17.176 -11.922 220 HE2 HIS 10 HE2 HIS 10 -1.058 -18.468 -10.773 221 H LEU 11 H LEU 11 2.965 -15.095 -5.030 222 HA LEU 11 HA LEU 11 4.166 -12.819 -6.392 223 HB2 LEU 11 2HB LEU 11 2.612 -12.849 -4.324 224 HB3 LEU 11 3HB LEU 11 4.012 -13.366 -3.396 225 HG LEU 11 HG LEU 11 5.179 -11.236 -4.060 226 HD11 LEU 11 1HD1 LEU 11 3.800 -9.398 -4.995 227 HD12 LEU 11 2HD1 LEU 11 3.907 -10.715 -6.158 228 HD13 LEU 11 3HD1 LEU 11 2.432 -10.503 -5.182 229 HD21 LEU 11 3HD2 LEU 11 3.785 -9.807 -2.566 230 HD22 LEU 11 1HD2 LEU 11 2.438 -10.940 -2.730 231 HD23 LEU 11 2HD2 LEU 11 3.941 -11.448 -1.921 232 H VAL 12 H VAL 12 5.391 -15.379 -4.214 233 HA VAL 12 HA VAL 12 8.160 -14.652 -4.286 234 HB VAL 12 HB VAL 12 6.865 -17.401 -4.056 235 HG11 VAL 12 1HG1 VAL 12 9.013 -18.123 -3.004 236 HG12 VAL 12 2HG1 VAL 12 9.199 -17.739 -4.716 237 HG13 VAL 12 3HG1 VAL 12 9.746 -16.574 -3.485 238 HG21 VAL 12 3HG2 VAL 12 7.283 -17.134 -1.645 239 HG22 VAL 12 1HG2 VAL 12 7.974 -15.519 -1.929 240 HG23 VAL 12 2HG2 VAL 12 6.257 -15.828 -2.242 241 H GLU 13 H GLU 13 6.279 -16.753 -6.517 242 HA GLU 13 HA GLU 13 8.406 -17.222 -8.369 243 HB2 GLU 13 2HB GLU 13 5.404 -17.298 -8.525 244 HB3 GLU 13 3HB GLU 13 6.286 -17.205 -10.040 245 HG2 GLU 13 2HG GLU 13 6.845 -19.276 -7.903 246 HG3 GLU 13 3HG GLU 13 5.764 -19.516 -9.290 247 H ALA 14 H ALA 14 5.919 -14.523 -8.423 248 HA ALA 14 HA ALA 14 6.898 -13.325 -10.743 249 HB1 ALA 14 3HB ALA 14 4.831 -12.746 -9.585 250 HB2 ALA 14 1HB ALA 14 5.753 -11.986 -8.259 251 HB3 ALA 14 2HB ALA 14 5.816 -11.295 -9.895 252 H LEU 15 H LEU 15 8.035 -12.642 -7.370 253 HA LEU 15 HA LEU 15 10.091 -10.812 -8.078 254 HB2 LEU 15 2HB LEU 15 9.598 -12.669 -5.746 255 HB3 LEU 15 3HB LEU 15 11.201 -11.989 -5.931 256 HG LEU 15 HG LEU 15 9.961 -10.667 -4.388 257 HD11 LEU 15 1HD1 LEU 15 10.332 -8.460 -5.263 258 HD12 LEU 15 2HD1 LEU 15 11.589 -9.526 -5.916 259 HD13 LEU 15 3HD1 LEU 15 10.229 -9.015 -6.937 260 HD21 LEU 15 3HD2 LEU 15 7.902 -10.261 -6.581 261 HD22 LEU 15 1HD2 LEU 15 7.681 -11.034 -4.999 262 HD23 LEU 15 2HD2 LEU 15 7.990 -9.294 -5.096 263 H TYR 16 H TYR 16 10.188 -14.388 -8.159 264 HA TYR 16 HA TYR 16 12.975 -14.518 -8.923 265 HB2 TYR 16 2HB TYR 16 11.707 -16.453 -8.027 266 HB3 TYR 16 3HB TYR 16 10.716 -16.469 -9.486 267 HD1 TYR 16 HD1 TYR 16 14.171 -17.012 -8.217 268 HD2 TYR 16 HD2 TYR 16 11.501 -17.279 -11.592 269 HE1 TYR 16 HE1 TYR 16 15.919 -18.242 -9.500 270 HE2 TYR 16 HE2 TYR 16 13.238 -18.490 -12.882 271 HH TYR 16 HH TYR 16 15.420 -19.227 -12.913 272 H LEU 17 H LEU 17 9.935 -14.280 -10.833 273 HA LEU 17 HA LEU 17 11.252 -14.535 -13.373 274 HB2 LEU 17 2HB LEU 17 8.570 -13.219 -12.711 275 HB3 LEU 17 3HB LEU 17 9.124 -13.686 -14.309 276 HG LEU 17 HG LEU 17 8.523 -15.601 -12.048 277 HD11 LEU 17 1HD1 LEU 17 6.561 -16.222 -13.391 278 HD12 LEU 17 2HD1 LEU 17 6.515 -14.509 -12.948 279 HD13 LEU 17 3HD1 LEU 17 6.981 -14.986 -14.597 280 HD21 LEU 17 3HD2 LEU 17 8.718 -17.372 -13.789 281 HD22 LEU 17 1HD2 LEU 17 9.274 -16.152 -14.955 282 HD23 LEU 17 2HD2 LEU 17 10.258 -16.547 -13.529 283 H VAL 18 H VAL 18 10.184 -11.610 -11.594 284 HA VAL 18 HA VAL 18 11.224 -9.783 -13.626 285 HB VAL 18 HB VAL 18 11.247 -8.170 -11.466 286 HG11 VAL 18 1HG1 VAL 18 8.701 -8.886 -12.931 287 HG12 VAL 18 2HG1 VAL 18 9.035 -7.398 -12.003 288 HG13 VAL 18 3HG1 VAL 18 9.954 -7.743 -13.479 289 HG21 VAL 18 3HG2 VAL 18 9.780 -8.553 -9.814 290 HG22 VAL 18 1HG2 VAL 18 8.946 -9.851 -10.702 291 HG23 VAL 18 2HG2 VAL 18 10.570 -10.124 -10.006 292 H CYS 19 H CYS 19 12.519 -10.865 -10.425 293 HA CYS 19 HA CYS 19 15.016 -9.319 -10.988 294 HB2 CYS 19 2HB CYS 19 13.498 -8.855 -9.008 295 HB3 CYS 19 3HB CYS 19 13.954 -10.435 -8.378 296 H GLY 20 H GLY 20 13.972 -12.591 -9.916 297 HA2 GLY 20 HA2 GLY 20 16.609 -13.452 -9.148 298 HA3 GLY 20 HA3 GLY 20 15.199 -14.500 -9.403 299 H GLU 21 H GLU 21 14.766 -13.954 -12.151 300 HA GLU 21 HA GLU 21 16.447 -15.701 -13.543 301 HB2 GLU 21 2HB GLU 21 14.446 -13.539 -14.227 302 HB3 GLU 21 3HB GLU 21 15.345 -14.287 -15.524 303 HG2 GLU 21 2HG GLU 21 13.805 -15.950 -13.508 304 HG3 GLU 21 3HG GLU 21 13.051 -15.269 -14.944 305 H ARG 22 H ARG 22 17.089 -12.331 -12.793 306 HA ARG 22 HA ARG 22 18.944 -11.870 -14.990 307 HB2 ARG 22 2HB ARG 22 18.490 -10.325 -12.405 308 HB3 ARG 22 3HB ARG 22 19.479 -9.791 -13.769 309 HG2 ARG 22 2HG ARG 22 17.493 -9.888 -15.264 310 HG3 ARG 22 3HG ARG 22 16.481 -10.361 -13.888 311 HD2 ARG 22 2HD ARG 22 17.010 -8.248 -12.749 312 HD3 ARG 22 3HD ARG 22 18.020 -7.746 -14.123 313 HE ARG 22 HE ARG 22 15.648 -8.339 -15.332 314 HH11 ARG 22 1HH2 ARG 22 16.347 -6.163 -12.620 315 HH12 ARG 22 2HH2 ARG 22 14.878 -5.245 -12.887 316 HH21 ARG 22 1HH1 ARG 22 13.820 -7.087 -15.614 317 HH22 ARG 22 2HH1 ARG 22 13.464 -5.786 -14.508 318 H GLY 23 H GLY 23 19.227 -13.556 -12.017 319 HA2 GLY 23 HA2 GLY 23 20.990 -14.896 -11.324 320 HA3 GLY 23 HA3 GLY 23 22.086 -14.097 -12.465 321 H HIS 24 H HIS 24 21.921 -14.752 -9.420 322 HA HIS 24 HA HIS 24 23.071 -12.164 -8.428 323 HB2 HIS 24 2HB HIS 24 21.060 -14.005 -7.064 324 HB3 HIS 24 3HB HIS 24 21.878 -12.657 -6.278 325 HD2 HIS 24 HD2 HIS 24 19.165 -13.371 -8.917 326 HE1 HIS 24 HE1 HIS 24 19.055 -9.186 -8.152 327 HE2 HIS 24 HE2 HIS 24 17.924 -11.104 -9.391 328 H PHE 25 H PHE 25 23.856 -15.304 -9.037 329 HA PHE 25 HA PHE 25 26.205 -15.358 -7.338 330 HB2 PHE 25 2HB PHE 25 24.516 -16.110 -5.700 331 HB3 PHE 25 3HB PHE 25 23.935 -17.327 -6.829 332 HD1 PHE 25 HD1 PHE 25 27.090 -16.231 -5.083 333 HD2 PHE 25 HD2 PHE 25 24.795 -19.522 -6.670 334 HE1 PHE 25 HE1 PHE 25 28.768 -17.831 -4.201 335 HE2 PHE 25 HE2 PHE 25 26.463 -21.119 -5.765 336 HZ PHE 25 HZ PHE 25 28.456 -20.279 -4.533 337 H TYR 26 H TYR 26 27.742 -16.824 -8.097 338 HA TYR 26 HA TYR 26 27.007 -18.877 -10.063 339 HB2 TYR 26 2HB TYR 26 27.730 -16.518 -11.050 340 HB3 TYR 26 3HB TYR 26 29.343 -17.035 -10.601 341 HD1 TYR 26 HD2 TYR 26 26.282 -18.012 -12.443 342 HD2 TYR 26 HD1 TYR 26 30.529 -18.584 -12.071 343 HE1 TYR 26 HE2 TYR 26 26.292 -19.269 -14.613 344 HE2 TYR 26 HE1 TYR 26 30.569 -19.783 -14.258 345 HH TYR 26 HH TYR 26 27.588 -20.350 -16.182 346 H THR 27 H THR 27 28.424 -20.597 -10.147 347 HA THR 27 HA THR 27 30.967 -20.623 -8.753 348 HB THR 27 HB THR 27 29.312 -20.779 -6.917 349 HG1 THR 27 HG1 THR 27 31.178 -22.829 -7.391 350 HG21 THR 27 1HG2 THR 27 28.751 -23.571 -7.989 351 HG22 THR 27 2HG2 THR 27 28.241 -22.913 -6.423 352 HG23 THR 27 3HG2 THR 27 27.597 -22.215 -7.914 353 HA PRO 28 HA PRO 28 28.886 -21.092 -11.815 354 HB2 PRO 28 2HB PRO 28 27.869 -22.889 -13.582 355 HB3 PRO 28 3HB PRO 28 29.492 -22.158 -13.765 356 HG2 PRO 28 2HG PRO 28 28.827 -24.836 -12.501 357 HG3 PRO 28 3HG PRO 28 30.011 -24.487 -13.810 358 HD2 PRO 28 2HD PRO 28 30.850 -24.620 -11.267 359 HD3 PRO 28 3HD PRO 28 31.437 -23.290 -12.317 360 H LYS 29 H LYS 29 26.562 -21.000 -12.080 361 HA LYS 29 HA LYS 29 25.154 -22.071 -9.772 362 HB2 LYS 29 2HB LYS 29 25.070 -19.686 -10.930 363 HB3 LYS 29 3HB LYS 29 23.904 -20.451 -11.995 364 HG2 LYS 29 2HG LYS 29 22.812 -21.198 -9.618 365 HG3 LYS 29 3HG LYS 29 23.785 -19.876 -9.017 366 HD2 LYS 29 2HD LYS 29 21.508 -19.129 -9.471 367 HD3 LYS 29 3HD LYS 29 22.646 -18.299 -10.527 368 HE2 LYS 29 2HE LYS 29 20.570 -18.949 -11.706 369 HE3 LYS 29 3HE LYS 29 22.004 -19.669 -12.431 370 HZ1 LYS 29 HZ1 LYS 29 21.471 -21.758 -11.338 371 HZ2 LYS 29 HZ2 LYS 29 20.169 -21.095 -10.582 372 HZ3 LYS 29 HZ3 LYS 29 20.178 -21.263 -12.207 373 H THR 30 H THR 30 25.900 -23.947 -11.929 374 HA THR 30 HA THR 30 25.167 -26.014 -12.614 375 HB THR 30 HB THR 30 22.258 -25.180 -12.349 376 HG1 THR 30 HG1 THR 30 23.134 -25.185 -10.335 377 HG21 THR 30 1HG2 THR 30 22.596 -27.107 -13.840 378 HG22 THR 30 2HG2 THR 30 23.625 -27.894 -12.622 379 HG23 THR 30 3HG2 THR 30 21.896 -27.628 -12.303 Start of MODEL 25 1 H1 GLY 1 1H GLY 1 4.064 -4.659 2.701 2 H2 GLY 1 2H GLY 1 5.531 -4.152 3.228 3 H3 GLY 1 3H GLY 1 5.410 -5.525 2.342 4 HA2 GLY 1 HA2 GLY 1 4.847 -2.784 1.405 5 HA3 GLY 1 HA3 GLY 1 6.272 -3.732 0.967 6 H ILE 2 H ILE 2 5.925 -5.681 -0.366 7 HA ILE 2 HA ILE 2 4.340 -4.988 -2.588 8 HB ILE 2 HB ILE 2 6.458 -6.172 -2.746 9 HG12 ILE 2 2HG1 ILE 2 5.969 -7.821 -4.473 10 HG13 ILE 2 3HG1 ILE 2 4.267 -7.833 -4.008 11 HG21 ILE 2 1HG2 ILE 2 6.311 -7.711 -0.834 12 HG22 ILE 2 2HG2 ILE 2 5.062 -8.650 -1.673 13 HG23 ILE 2 3HG2 ILE 2 6.705 -8.567 -2.323 14 HD11 ILE 2 3HD1 ILE 2 5.799 -5.483 -5.179 15 HD12 ILE 2 1HD1 ILE 2 4.625 -6.510 -6.024 16 HD13 ILE 2 2HD1 ILE 2 4.075 -5.449 -4.727 17 H VAL 3 H VAL 3 3.488 -7.294 -0.044 18 HA VAL 3 HA VAL 3 1.368 -8.580 -1.506 19 HB VAL 3 HB VAL 3 1.718 -8.249 1.503 20 HG11 VAL 3 1HG1 VAL 3 0.194 -10.162 1.760 21 HG12 VAL 3 2HG1 VAL 3 -0.648 -8.825 0.973 22 HG13 VAL 3 3HG1 VAL 3 -0.076 -10.211 0.011 23 HG21 VAL 3 3HG2 VAL 3 3.571 -9.513 0.422 24 HG22 VAL 3 1HG2 VAL 3 2.571 -10.574 1.418 25 HG23 VAL 3 2HG2 VAL 3 2.384 -10.588 -0.347 26 H GLU 4 H GLU 4 1.434 -5.743 0.633 27 HA GLU 4 HA GLU 4 -1.336 -5.066 0.353 28 HB2 GLU 4 2HB GLU 4 0.931 -3.176 1.029 29 HB3 GLU 4 3HB GLU 4 -0.776 -3.060 1.466 30 HG2 GLU 4 2HG GLU 4 -0.023 -3.810 3.461 31 HG3 GLU 4 3HG GLU 4 -0.243 -5.390 2.715 32 H GLN 5 H GLN 5 0.910 -5.056 -2.105 33 HA GLN 5 HA GLN 5 -0.569 -2.904 -3.579 34 HB2 GLN 5 2HB GLN 5 1.803 -2.389 -3.390 35 HB3 GLN 5 3HB GLN 5 2.238 -3.981 -4.007 36 HG2 GLN 5 2HG GLN 5 2.481 -2.280 -5.727 37 HG3 GLN 5 3HG GLN 5 1.262 -3.451 -6.200 38 HE21 GLN 5 2HE2 GLN 5 -1.069 -2.751 -6.081 39 HE22 GLN 5 1HE2 GLN 5 -1.404 -1.025 -6.199 40 H CYS 6 H CYS 6 0.967 -6.171 -4.007 41 HA CYS 6 HA CYS 6 -0.614 -6.457 -6.487 42 HB2 CYS 6 2HB CYS 6 1.957 -6.777 -6.111 43 HB3 CYS 6 3HB CYS 6 1.473 -8.403 -5.628 44 H CYS 7 H CYS 7 -0.592 -7.981 -3.297 45 HA CYS 7 HA CYS 7 -2.412 -10.116 -4.168 46 HB2 CYS 7 2HB CYS 7 -0.857 -10.262 -2.200 47 HB3 CYS 7 3HB CYS 7 -1.910 -9.127 -1.352 48 H THR 8 H THR 8 -2.799 -6.847 -2.990 49 HA THR 8 HA THR 8 -5.723 -7.061 -2.700 50 HB THR 8 HB THR 8 -4.239 -5.686 -1.196 51 HG1 THR 8 HG1 THR 8 -5.795 -4.057 -1.101 52 HG21 THR 8 1HG2 THR 8 -2.806 -4.678 -2.951 53 HG22 THR 8 2HG2 THR 8 -4.200 -3.757 -3.563 54 HG23 THR 8 3HG2 THR 8 -3.591 -3.457 -1.927 55 H SER 9 H SER 9 -3.458 -5.876 -5.185 56 HA SER 9 HA SER 9 -5.699 -5.505 -7.045 57 HB2 SER 9 2HB SER 9 -5.329 -3.347 -5.779 58 HB3 SER 9 3HB SER 9 -3.771 -3.241 -6.636 59 HG SER 9 HG SER 9 -5.576 -2.145 -7.694 60 H ILE 10 H ILE 10 -4.515 -4.397 -9.161 61 HA ILE 10 HA ILE 10 -2.679 -6.429 -10.212 62 HB ILE 10 HB ILE 10 -3.464 -3.702 -11.321 63 HG12 ILE 10 2HG1 ILE 10 -5.478 -5.086 -11.055 64 HG13 ILE 10 3HG1 ILE 10 -5.105 -4.734 -12.729 65 HG21 ILE 10 1HG2 ILE 10 -2.787 -4.752 -13.548 66 HG22 ILE 10 2HG2 ILE 10 -1.439 -4.479 -12.446 67 HG23 ILE 10 3HG2 ILE 10 -2.116 -6.111 -12.621 68 HD11 ILE 10 3HD1 ILE 10 -4.425 -7.353 -11.364 69 HD12 ILE 10 1HD1 ILE 10 -5.859 -7.064 -12.376 70 HD13 ILE 10 2HD1 ILE 10 -4.250 -6.977 -13.100 71 H CYS 11 H CYS 11 -0.458 -6.376 -10.288 72 HA CYS 11 HA CYS 11 0.835 -3.709 -10.001 73 HB2 CYS 11 2HB CYS 11 2.692 -4.503 -8.847 74 HB3 CYS 11 3HB CYS 11 1.282 -5.022 -7.943 75 H SER 12 H SER 12 2.694 -3.343 -11.158 76 HA SER 12 HA SER 12 3.012 -4.982 -13.653 77 HB2 SER 12 2HB SER 12 3.797 -2.099 -13.127 78 HB3 SER 12 3HB SER 12 3.819 -2.964 -14.670 79 HG SER 12 HG SER 12 1.926 -1.577 -14.274 80 H LEU 13 H LEU 13 5.103 -5.378 -14.526 81 HA LEU 13 HA LEU 13 6.866 -6.435 -12.577 82 HB2 LEU 13 2HB LEU 13 8.306 -6.964 -14.396 83 HB3 LEU 13 3HB LEU 13 6.659 -7.408 -14.778 84 HG LEU 13 HG LEU 13 7.923 -4.853 -15.850 85 HD11 LEU 13 1HD1 LEU 13 8.544 -6.125 -17.873 86 HD12 LEU 13 2HD1 LEU 13 9.390 -6.739 -16.445 87 HD13 LEU 13 3HD1 LEU 13 7.997 -7.629 -17.100 88 HD21 LEU 13 3HD2 LEU 13 5.651 -6.557 -16.932 89 HD22 LEU 13 1HD2 LEU 13 5.493 -4.939 -16.202 90 HD23 LEU 13 2HD2 LEU 13 6.348 -5.136 -17.725 91 H TYR 14 H TYR 14 6.963 -3.419 -14.340 92 HA TYR 14 HA TYR 14 9.643 -2.701 -13.717 93 HB2 TYR 14 2HB TYR 14 9.013 -0.533 -14.636 94 HB3 TYR 14 3HB TYR 14 8.439 -1.882 -15.638 95 HD1 TYR 14 HD1 TYR 14 7.265 0.596 -13.038 96 HD2 TYR 14 HD2 TYR 14 6.222 -1.920 -16.388 97 HE1 TYR 14 HE1 TYR 14 4.983 1.569 -13.057 98 HE2 TYR 14 HE2 TYR 14 3.960 -0.900 -16.447 99 HH TYR 14 HH TYR 14 2.519 0.624 -15.493 100 H GLN 15 H GLN 15 6.968 -2.722 -11.693 101 HA GLN 15 HA GLN 15 8.214 -0.730 -9.820 102 HB2 GLN 15 2HB GLN 15 5.962 -0.418 -8.820 103 HB3 GLN 15 3HB GLN 15 6.085 0.177 -10.483 104 HG2 GLN 15 2HG GLN 15 4.923 -1.761 -11.334 105 HG3 GLN 15 3HG GLN 15 4.903 -2.528 -9.734 106 HE21 GLN 15 2HE2 GLN 15 4.095 0.929 -9.791 107 HE22 GLN 15 1HE2 GLN 15 2.374 0.637 -9.618 108 H LEU 16 H LEU 16 6.762 -4.011 -10.198 109 HA LEU 16 HA LEU 16 6.976 -4.588 -7.419 110 HB2 LEU 16 2HB LEU 16 5.931 -6.495 -7.933 111 HB3 LEU 16 3HB LEU 16 5.615 -5.641 -9.423 112 HG LEU 16 HG LEU 16 7.806 -6.746 -10.271 113 HD11 LEU 16 1HD1 LEU 16 7.751 -9.215 -9.080 114 HD12 LEU 16 2HD1 LEU 16 8.851 -7.927 -8.602 115 HD13 LEU 16 3HD1 LEU 16 7.349 -8.202 -7.691 116 HD21 LEU 16 3HD2 LEU 16 5.344 -8.503 -9.748 117 HD22 LEU 16 1HD2 LEU 16 5.460 -7.297 -11.048 118 HD23 LEU 16 2HD2 LEU 16 6.530 -8.711 -11.055 119 H GLU 17 H GLU 17 9.385 -4.756 -9.998 120 HA GLU 17 HA GLU 17 11.471 -6.265 -8.833 121 HB2 GLU 17 2HB GLU 17 11.514 -3.630 -10.380 122 HB3 GLU 17 3HB GLU 17 12.991 -4.399 -9.804 123 HG2 GLU 17 2HG GLU 17 12.406 -6.458 -11.083 124 HG3 GLU 17 3HG GLU 17 11.047 -5.565 -11.786 125 H ASN 18 H ASN 18 10.277 -3.071 -8.009 126 HA ASN 18 HA ASN 18 12.493 -2.015 -6.610 127 HB2 ASN 18 2HB ASN 18 9.531 -1.443 -6.275 128 HB3 ASN 18 3HB ASN 18 10.797 -0.482 -5.645 129 HD21 ASN 18 2HD2 ASN 18 9.207 0.939 -7.182 130 HD22 ASN 18 1HD2 ASN 18 9.996 1.264 -8.721 131 H TYR 19 H TYR 19 10.099 -4.312 -5.574 132 HA TYR 19 HA TYR 19 10.502 -3.965 -2.685 133 HB2 TYR 19 2HB TYR 19 8.797 -5.850 -4.362 134 HB3 TYR 19 3HB TYR 19 8.751 -5.730 -2.614 135 HD1 TYR 19 HD1 TYR 19 8.066 -3.825 -5.778 136 HD2 TYR 19 HD2 TYR 19 7.556 -3.992 -1.495 137 HE1 TYR 19 HE1 TYR 19 6.417 -1.979 -5.900 138 HE2 TYR 19 HE2 TYR 19 5.815 -2.229 -1.628 139 HH TYR 19 HH TYR 19 4.668 -0.768 -3.001 140 H CYS 20 H CYS 20 12.164 -5.693 -5.096 141 HA CYS 20 HA CYS 20 12.786 -8.130 -3.655 142 HB2 CYS 20 2HB CYS 20 12.983 -7.698 -6.139 143 HB3 CYS 20 3HB CYS 20 14.400 -6.705 -5.798 144 H ASN 21 H ASN 21 14.110 -4.893 -3.579 145 HA ASN 21 HA ASN 21 15.652 -3.800 -2.344 146 HB2 ASN 21 2HB ASN 21 14.058 -4.715 -0.599 147 HB3 ASN 21 3HB ASN 21 15.234 -5.981 -0.265 148 HD21 ASN 21 2HD2 ASN 21 17.561 -4.963 0.059 149 HD22 ASN 21 1HD2 ASN 21 17.590 -3.621 1.228 150 H1 PHE 1 1H PHE 1 5.403 -12.505 -19.220 151 H2 PHE 1 2H PHE 1 6.762 -11.913 -18.525 152 H3 PHE 1 3H PHE 1 5.849 -10.957 -19.498 153 HA PHE 1 HA PHE 1 4.993 -12.065 -16.912 154 HB2 PHE 1 2HB PHE 1 6.724 -10.279 -16.710 155 HB3 PHE 1 3HB PHE 1 5.698 -9.185 -17.623 156 HD1 PHE 1 HD1 PHE 1 6.021 -11.087 -14.422 157 HD2 PHE 1 HD2 PHE 1 3.865 -7.999 -16.540 158 HE1 PHE 1 HE1 PHE 1 4.943 -10.373 -12.304 159 HE2 PHE 1 HE2 PHE 1 2.836 -7.268 -14.409 160 HZ PHE 1 HZ PHE 1 3.358 -8.456 -12.291 161 H VAL 2 H VAL 2 2.904 -11.264 -16.161 162 HA VAL 2 HA VAL 2 1.160 -9.902 -18.150 163 HB VAL 2 HB VAL 2 0.307 -12.372 -16.570 164 HG11 VAL 2 1HG1 VAL 2 -1.541 -10.748 -16.622 165 HG12 VAL 2 2HG1 VAL 2 -1.328 -10.526 -18.373 166 HG13 VAL 2 3HG1 VAL 2 -1.891 -12.081 -17.719 167 HG21 VAL 2 3HG2 VAL 2 -0.174 -13.359 -18.794 168 HG22 VAL 2 1HG2 VAL 2 0.525 -11.925 -19.576 169 HG23 VAL 2 2HG2 VAL 2 1.543 -13.004 -18.594 170 H ASN 3 H ASN 3 0.409 -8.122 -17.215 171 HA ASN 3 HA ASN 3 0.613 -7.465 -14.451 172 HB2 ASN 3 2HB ASN 3 -1.266 -6.286 -16.551 173 HB3 ASN 3 3HB ASN 3 -0.755 -5.540 -15.032 174 HD21 ASN 3 2HD2 ASN 3 1.011 -4.260 -15.002 175 HD22 ASN 3 1HD2 ASN 3 2.043 -4.099 -16.389 176 H GLN 4 H GLN 4 -0.452 -8.472 -12.832 177 HA GLN 4 HA GLN 4 -3.331 -9.033 -12.982 178 HB2 GLN 4 2HB GLN 4 -3.170 -11.399 -12.819 179 HB3 GLN 4 3HB GLN 4 -2.192 -10.920 -14.197 180 HG2 GLN 4 2HG GLN 4 -0.167 -10.990 -12.560 181 HG3 GLN 4 3HG GLN 4 -1.255 -11.808 -11.445 182 HE21 GLN 4 2HE2 GLN 4 0.882 -12.236 -14.080 183 HE22 GLN 4 1HE2 GLN 4 0.502 -13.931 -14.376 184 H HIS 5 H HIS 5 -3.926 -10.360 -10.985 185 HA HIS 5 HA HIS 5 -2.813 -9.126 -8.529 186 HB2 HIS 5 2HB HIS 5 -5.096 -11.103 -8.945 187 HB3 HIS 5 3HB HIS 5 -4.649 -10.345 -7.421 188 HD2 HIS 5 HD2 HIS 5 -6.103 -9.370 -10.905 189 HE1 HIS 5 HE1 HIS 5 -7.185 -6.296 -8.182 190 HE2 HIS 5 HE2 HIS 5 -7.523 -7.197 -10.539 191 H LEU 6 H LEU 6 -1.334 -10.147 -7.257 192 HA LEU 6 HA LEU 6 -0.713 -13.058 -7.657 193 HB2 LEU 6 2HB LEU 6 1.233 -10.731 -7.517 194 HB3 LEU 6 3HB LEU 6 1.702 -12.423 -7.463 195 HG LEU 6 HG LEU 6 0.332 -11.084 -9.838 196 HD11 LEU 6 1HD1 LEU 6 2.541 -10.125 -9.503 197 HD12 LEU 6 2HD1 LEU 6 3.243 -11.736 -9.279 198 HD13 LEU 6 3HD1 LEU 6 2.613 -11.248 -10.873 199 HD21 LEU 6 3HD2 LEU 6 1.684 -13.809 -9.521 200 HD22 LEU 6 1HD2 LEU 6 -0.053 -13.531 -9.785 201 HD23 LEU 6 2HD2 LEU 6 1.111 -13.125 -11.053 202 H CYS 7 H CYS 7 -0.359 -14.186 -5.802 203 HA CYS 7 HA CYS 7 0.417 -12.807 -3.327 204 HB2 CYS 7 2HB CYS 7 -2.171 -12.697 -3.745 205 HB3 CYS 7 3HB CYS 7 -2.161 -14.379 -3.235 206 H GLY 8 H GLY 8 1.213 -14.193 -1.715 207 HA2 GLY 8 HA2 GLY 8 2.335 -16.052 -0.895 208 HA3 GLY 8 HA3 GLY 8 1.066 -17.014 -1.666 209 H SER 9 H SER 9 2.024 -18.608 -2.750 210 HA SER 9 HA SER 9 4.610 -18.749 -3.801 211 HB2 SER 9 2HB SER 9 2.123 -20.134 -4.871 212 HB3 SER 9 3HB SER 9 3.804 -20.663 -5.065 213 HG SER 9 HG SER 9 2.739 -21.778 -3.343 214 H HIS 10 H HIS 10 1.648 -17.545 -5.475 215 HA HIS 10 HA HIS 10 2.841 -17.316 -8.063 216 HB2 HIS 10 2HB HIS 10 0.309 -16.757 -6.825 217 HB3 HIS 10 3HB HIS 10 0.821 -15.273 -7.596 218 HD2 HIS 10 HD2 HIS 10 -1.233 -18.069 -8.398 219 HE1 HIS 10 HE1 HIS 10 0.609 -17.241 -12.145 220 HE2 HIS 10 HE2 HIS 10 -1.305 -18.472 -10.997 221 H LEU 11 H LEU 11 2.778 -15.122 -5.305 222 HA LEU 11 HA LEU 11 3.991 -12.870 -6.698 223 HB2 LEU 11 2HB LEU 11 2.419 -12.872 -4.632 224 HB3 LEU 11 3HB LEU 11 3.825 -13.355 -3.695 225 HG LEU 11 HG LEU 11 4.970 -11.224 -4.412 226 HD11 LEU 11 1HD1 LEU 11 3.598 -9.421 -5.399 227 HD12 LEU 11 2HD1 LEU 11 3.650 -10.780 -6.516 228 HD13 LEU 11 3HD1 LEU 11 2.212 -10.507 -5.500 229 HD21 LEU 11 3HD2 LEU 11 2.238 -10.968 -3.054 230 HD22 LEU 11 1HD2 LEU 11 3.780 -11.369 -2.260 231 HD23 LEU 11 2HD2 LEU 11 3.526 -9.763 -2.968 232 H VAL 12 H VAL 12 5.187 -15.390 -4.449 233 HA VAL 12 HA VAL 12 7.940 -14.636 -4.468 234 HB VAL 12 HB VAL 12 6.653 -17.377 -4.174 235 HG11 VAL 12 1HG1 VAL 12 8.987 -17.763 -4.803 236 HG12 VAL 12 2HG1 VAL 12 9.537 -16.555 -3.617 237 HG13 VAL 12 3HG1 VAL 12 8.788 -18.076 -3.079 238 HG21 VAL 12 3HG2 VAL 12 7.777 -15.440 -2.105 239 HG22 VAL 12 1HG2 VAL 12 6.056 -15.715 -2.426 240 HG23 VAL 12 2HG2 VAL 12 7.042 -17.027 -1.775 241 H GLU 13 H GLU 13 6.150 -16.833 -6.666 242 HA GLU 13 HA GLU 13 8.269 -17.469 -8.447 243 HB2 GLU 13 2HB GLU 13 5.255 -17.331 -8.699 244 HB3 GLU 13 3HB GLU 13 6.236 -17.536 -10.142 245 HG2 GLU 13 3HG GLU 13 7.330 -19.519 -9.167 246 HG3 GLU 13 2HG GLU 13 6.390 -19.331 -7.684 247 H ALA 14 H ALA 14 5.974 -14.638 -8.609 248 HA ALA 14 HA ALA 14 7.095 -13.581 -10.993 249 HB1 ALA 14 3HB ALA 14 5.732 -12.167 -8.663 250 HB2 ALA 14 1HB ALA 14 5.947 -11.520 -10.304 251 HB3 ALA 14 2HB ALA 14 4.934 -12.962 -10.049 252 H LEU 15 H LEU 15 7.928 -12.809 -7.552 253 HA LEU 15 HA LEU 15 10.016 -10.981 -8.145 254 HB2 LEU 15 2HB LEU 15 9.324 -12.739 -5.785 255 HB3 LEU 15 3HB LEU 15 10.941 -12.078 -5.852 256 HG LEU 15 HG LEU 15 9.593 -10.685 -4.476 257 HD11 LEU 15 1HD1 LEU 15 11.354 -9.608 -5.860 258 HD12 LEU 15 2HD1 LEU 15 10.124 -9.166 -7.063 259 HD13 LEU 15 3HD1 LEU 15 10.033 -8.510 -5.422 260 HD21 LEU 15 3HD2 LEU 15 7.372 -11.066 -5.244 261 HD22 LEU 15 1HD2 LEU 15 7.693 -9.337 -5.400 262 HD23 LEU 15 2HD2 LEU 15 7.712 -10.377 -6.843 263 H TYR 16 H TYR 16 10.202 -14.561 -8.009 264 HA TYR 16 HA TYR 16 13.026 -14.699 -8.493 265 HB2 TYR 16 2HB TYR 16 11.666 -16.663 -7.822 266 HB3 TYR 16 3HB TYR 16 10.826 -16.607 -9.374 267 HD1 TYR 16 HD1 TYR 16 14.143 -17.214 -7.776 268 HD2 TYR 16 HD2 TYR 16 11.825 -17.442 -11.407 269 HE1 TYR 16 HE1 TYR 16 15.969 -18.512 -8.862 270 HE2 TYR 16 HE2 TYR 16 13.643 -18.731 -12.496 271 HH TYR 16 HH TYR 16 15.739 -19.656 -12.260 272 H LEU 17 H LEU 17 10.269 -14.528 -10.815 273 HA LEU 17 HA LEU 17 11.937 -14.689 -13.154 274 HB2 LEU 17 2HB LEU 17 9.157 -13.499 -12.761 275 HB3 LEU 17 3HB LEU 17 9.926 -13.762 -14.317 276 HG LEU 17 HG LEU 17 9.285 -15.985 -12.348 277 HD11 LEU 17 1HD1 LEU 17 7.812 -15.115 -14.869 278 HD12 LEU 17 2HD1 LEU 17 7.429 -16.536 -13.870 279 HD13 LEU 17 3HD1 LEU 17 7.239 -14.909 -13.198 280 HD21 LEU 17 3HD2 LEU 17 11.130 -16.622 -13.834 281 HD22 LEU 17 1HD2 LEU 17 9.659 -17.480 -14.297 282 HD23 LEU 17 2HD2 LEU 17 10.201 -16.083 -15.253 283 H VAL 18 H VAL 18 10.559 -11.799 -11.503 284 HA VAL 18 HA VAL 18 11.837 -10.050 -13.444 285 HB VAL 18 HB VAL 18 11.198 -8.553 -11.014 286 HG11 VAL 18 1HG1 VAL 18 9.997 -8.491 -13.797 287 HG12 VAL 18 2HG1 VAL 18 9.850 -7.247 -12.526 288 HG13 VAL 18 3HG1 VAL 18 11.427 -7.577 -13.258 289 HG21 VAL 18 3HG2 VAL 18 8.994 -10.330 -12.011 290 HG22 VAL 18 1HG2 VAL 18 9.638 -10.038 -10.347 291 HG23 VAL 18 2HG2 VAL 18 8.757 -8.774 -11.200 292 H CYS 19 H CYS 19 12.743 -11.047 -10.114 293 HA CYS 19 HA CYS 19 15.015 -9.137 -10.237 294 HB2 CYS 19 2HB CYS 19 13.389 -9.097 -8.344 295 HB3 CYS 19 3HB CYS 19 13.937 -10.709 -7.883 296 H GLY 20 H GLY 20 14.383 -12.618 -9.801 297 HA2 GLY 20 HA2 GLY 20 17.174 -13.264 -9.155 298 HA3 GLY 20 HA3 GLY 20 15.813 -14.395 -9.339 299 H GLU 21 H GLU 21 14.961 -14.234 -11.805 300 HA GLU 21 HA GLU 21 17.059 -15.446 -13.372 301 HB2 GLU 21 2HB GLU 21 14.681 -16.186 -13.327 302 HB3 GLU 21 3HB GLU 21 14.217 -14.707 -14.182 303 HG2 GLU 21 2HG GLU 21 15.655 -15.351 -16.091 304 HG3 GLU 21 3HG GLU 21 16.195 -16.787 -15.213 305 H ARG 22 H ARG 22 15.135 -12.397 -13.759 306 HA ARG 22 HA ARG 22 15.356 -10.673 -15.121 307 HB2 ARG 22 2HB ARG 22 16.602 -10.533 -12.846 308 HB3 ARG 22 3HB ARG 22 18.079 -10.417 -13.813 309 HG2 ARG 22 2HG ARG 22 17.147 -8.452 -14.990 310 HG3 ARG 22 3HG ARG 22 15.580 -8.726 -14.206 311 HD2 ARG 22 2HD ARG 22 16.647 -8.328 -11.983 312 HD3 ARG 22 3HD ARG 22 18.163 -7.925 -12.792 313 HE ARG 22 HE ARG 22 15.669 -6.323 -12.666 314 HH11 ARG 22 2HH1 ARG 22 18.844 -6.503 -14.258 315 HH12 ARG 22 1HH1 ARG 22 18.742 -4.841 -14.763 316 HH21 ARG 22 1HH2 ARG 22 15.595 -4.361 -13.305 317 HH22 ARG 22 2HH2 ARG 22 16.887 -3.588 -14.225 318 H GLY 23 H GLY 23 15.496 -12.208 -16.996 319 HA2 GLY 23 HA2 GLY 23 17.861 -12.545 -18.549 320 HA3 GLY 23 HA3 GLY 23 16.209 -12.622 -19.178 321 H HIS 24 H HIS 24 18.480 -11.628 -20.552 322 HA HIS 24 HA HIS 24 18.890 -8.845 -20.351 323 HB2 HIS 24 2HB HIS 24 19.365 -10.730 -22.687 324 HB3 HIS 24 3HB HIS 24 20.015 -9.098 -22.554 325 HD2 HIS 24 HD2 HIS 24 20.764 -12.635 -21.559 326 HE1 HIS 24 HE1 HIS 24 23.493 -10.259 -19.317 327 HE2 HIS 24 HE2 HIS 24 22.906 -12.633 -20.031 328 H PHE 25 H PHE 25 18.289 -7.074 -21.488 329 HA PHE 25 HA PHE 25 16.372 -7.015 -23.653 330 HB2 PHE 25 2HB PHE 25 14.860 -7.482 -21.731 331 HB3 PHE 25 3HB PHE 25 15.504 -6.084 -20.883 332 HD1 PHE 25 HD1 PHE 25 13.836 -7.035 -24.131 333 HD2 PHE 25 HD2 PHE 25 14.372 -4.017 -21.096 334 HE1 PHE 25 HE1 PHE 25 12.147 -5.602 -25.253 335 HE2 PHE 25 HE2 PHE 25 12.691 -2.588 -22.219 336 HZ PHE 25 HZ PHE 25 11.571 -3.375 -24.302 337 H TYR 26 H TYR 26 16.028 -4.818 -24.438 338 HA TYR 26 HA TYR 26 18.429 -3.238 -24.337 339 HB2 TYR 26 2HB TYR 26 16.986 -3.503 -26.330 340 HB3 TYR 26 3HB TYR 26 15.710 -2.589 -25.525 341 HD1 TYR 26 HD1 TYR 26 19.354 -2.326 -26.438 342 HD2 TYR 26 HD2 TYR 26 15.613 -0.236 -25.906 343 HE1 TYR 26 HE1 TYR 26 20.422 -0.220 -27.195 344 HE2 TYR 26 HE2 TYR 26 16.667 1.856 -26.722 345 HH TYR 26 HH TYR 26 18.594 2.864 -27.483 346 H THR 27 H THR 27 18.778 -1.138 -23.671 347 HA THR 27 HA THR 27 16.839 0.153 -21.804 348 HB THR 27 HB THR 27 18.846 1.010 -20.526 349 HG1 THR 27 HG1 THR 27 20.399 0.310 -22.093 350 HG21 THR 27 1HG2 THR 27 18.318 -1.994 -20.421 351 HG22 THR 27 2HG2 THR 27 18.995 -0.987 -19.123 352 HG23 THR 27 3HG2 THR 27 17.320 -0.742 -19.650 353 HA PRO 28 HA PRO 28 17.859 3.334 -24.884 354 HB2 PRO 28 2HB PRO 28 15.740 4.959 -24.596 355 HB3 PRO 28 3HB PRO 28 15.546 3.305 -25.240 356 HG2 PRO 28 2HG PRO 28 15.217 4.184 -22.344 357 HG3 PRO 28 3HG PRO 28 14.004 3.326 -23.365 358 HD2 PRO 28 2HD PRO 28 15.666 1.983 -21.706 359 HD3 PRO 28 3HD PRO 28 15.283 1.328 -23.326 360 H LYS 29 H LYS 29 19.585 3.426 -23.149 361 HA LYS 29 HA LYS 29 21.148 4.651 -22.064 362 HB2 LYS 29 2HB LYS 29 20.338 6.334 -23.898 363 HB3 LYS 29 3HB LYS 29 19.628 7.225 -22.547 364 HG2 LYS 29 2HG LYS 29 21.905 7.358 -21.493 365 HG3 LYS 29 3HG LYS 29 22.568 6.441 -22.855 366 HD2 LYS 29 2HD LYS 29 21.864 8.241 -24.410 367 HD3 LYS 29 3HD LYS 29 21.186 9.155 -23.045 368 HE2 LYS 29 2HE LYS 29 23.436 9.238 -21.986 369 HE3 LYS 29 3HE LYS 29 24.112 8.332 -23.347 370 HZ1 LYS 29 HZ1 LYS 29 24.463 10.713 -23.609 371 HZ2 LYS 29 HZ2 LYS 29 23.486 10.179 -24.803 372 HZ3 LYS 29 HZ3 LYS 29 22.860 11.017 -23.544 373 H THR 30 H THR 30 18.743 3.645 -20.677 374 HA THR 30 HA THR 30 17.854 5.094 -18.486 375 HB THR 30 HB THR 30 18.519 2.134 -18.392 376 HG1 THR 30 HG1 THR 30 16.355 1.976 -19.281 377 HG21 THR 30 1HG2 THR 30 16.437 2.021 -17.052 378 HG22 THR 30 2HG2 THR 30 17.622 3.085 -16.287 379 HG23 THR 30 3HG2 THR 30 16.253 3.787 -17.177 Start of MODEL 26 1 H1 GLY 1 1H GLY 1 3.384 -3.134 2.356 2 H2 GLY 1 2H GLY 1 4.391 -2.225 1.435 3 H3 GLY 1 3H GLY 1 4.822 -2.640 2.961 4 HA2 GLY 1 HA2 GLY 1 6.059 -3.987 1.432 5 HA3 GLY 1 HA3 GLY 1 4.920 -4.978 2.360 6 H ILE 2 H ILE 2 5.915 -5.933 -0.007 7 HA ILE 2 HA ILE 2 4.658 -5.221 -2.407 8 HB ILE 2 HB ILE 2 6.691 -6.515 -2.278 9 HG12 ILE 2 2HG1 ILE 2 6.305 -8.311 -3.927 10 HG13 ILE 2 3HG1 ILE 2 4.575 -8.154 -3.689 11 HG21 ILE 2 1HG2 ILE 2 6.245 -7.941 -0.318 12 HG22 ILE 2 2HG2 ILE 2 5.066 -8.881 -1.260 13 HG23 ILE 2 3HG2 ILE 2 6.782 -8.892 -1.696 14 HD11 ILE 2 3HD1 ILE 2 6.442 -6.123 -4.925 15 HD12 ILE 2 1HD1 ILE 2 5.168 -7.063 -5.715 16 HD13 ILE 2 2HD1 ILE 2 4.728 -5.791 -4.572 17 H VAL 3 H VAL 3 3.383 -7.433 0.019 18 HA VAL 3 HA VAL 3 1.272 -8.542 -1.539 19 HB VAL 3 HB VAL 3 1.326 -8.004 1.459 20 HG11 VAL 3 1HG1 VAL 3 -0.992 -8.519 0.696 21 HG12 VAL 3 2HG1 VAL 3 -0.384 -9.992 -0.102 22 HG13 VAL 3 3HG1 VAL 3 -0.319 -9.833 1.662 23 HG21 VAL 3 3HG2 VAL 3 3.217 -9.437 0.741 24 HG22 VAL 3 1HG2 VAL 3 2.031 -10.384 1.638 25 HG23 VAL 3 2HG2 VAL 3 2.091 -10.500 -0.131 26 H GLU 4 H GLU 4 1.506 -5.419 0.145 27 HA GLU 4 HA GLU 4 -1.292 -4.677 -0.293 28 HB2 GLU 4 2HB GLU 4 1.124 -3.018 0.510 29 HB3 GLU 4 3HB GLU 4 -0.554 -2.484 0.565 30 HG2 GLU 4 2HG GLU 4 -1.103 -4.104 2.288 31 HG3 GLU 4 3HG GLU 4 0.498 -4.843 2.190 32 H GLN 5 H GLN 5 1.413 -4.876 -2.363 33 HA GLN 5 HA GLN 5 0.457 -2.693 -4.156 34 HB2 GLN 5 2HB GLN 5 2.814 -2.649 -3.598 35 HB3 GLN 5 3HB GLN 5 3.012 -4.317 -4.119 36 HG2 GLN 5 2HG GLN 5 3.882 -2.815 -5.785 37 HG3 GLN 5 3HG GLN 5 2.527 -3.700 -6.446 38 HE21 GLN 5 1HE2 GLN 5 0.399 -2.465 -6.637 39 HE22 GLN 5 2HE2 GLN 5 0.516 -0.721 -6.876 40 H CYS 6 H CYS 6 1.051 -6.278 -4.136 41 HA CYS 6 HA CYS 6 -0.386 -6.363 -6.769 42 HB2 CYS 6 2HB CYS 6 2.167 -7.097 -6.249 43 HB3 CYS 6 3HB CYS 6 1.314 -8.627 -6.015 44 H CYS 7 H CYS 7 -0.688 -7.711 -3.556 45 HA CYS 7 HA CYS 7 -2.519 -9.831 -4.503 46 HB2 CYS 7 2HB CYS 7 -0.904 -10.163 -2.645 47 HB3 CYS 7 3HB CYS 7 -1.831 -9.022 -1.671 48 H THR 8 H THR 8 -2.866 -6.646 -2.999 49 HA THR 8 HA THR 8 -5.716 -6.833 -2.512 50 HB THR 8 HB THR 8 -4.122 -5.221 -1.421 51 HG1 THR 8 HG1 THR 8 -5.737 -3.644 -1.346 52 HG21 THR 8 1HG2 THR 8 -3.625 -3.106 -2.500 53 HG22 THR 8 2HG2 THR 8 -3.004 -4.401 -3.544 54 HG23 THR 8 3HG2 THR 8 -4.517 -3.569 -3.963 55 H SER 9 H SER 9 -3.797 -5.688 -5.234 56 HA SER 9 HA SER 9 -5.677 -6.397 -7.175 57 HB2 SER 9 2HB SER 9 -6.722 -4.188 -6.406 58 HB3 SER 9 3HB SER 9 -5.303 -3.412 -7.152 59 HG SER 9 HG SER 9 -7.168 -3.632 -8.560 60 H ILE 10 H ILE 10 -4.818 -5.011 -9.325 61 HA ILE 10 HA ILE 10 -2.542 -6.654 -9.783 62 HB ILE 10 HB ILE 10 -3.974 -4.649 -11.568 63 HG12 ILE 10 2HG1 ILE 10 -4.208 -7.627 -10.979 64 HG13 ILE 10 3HG1 ILE 10 -5.425 -6.371 -10.784 65 HG21 ILE 10 1HG2 ILE 10 -1.850 -6.701 -12.257 66 HG22 ILE 10 2HG2 ILE 10 -2.887 -5.903 -13.467 67 HG23 ILE 10 3HG2 ILE 10 -1.765 -4.951 -12.513 68 HD11 ILE 10 3HD1 ILE 10 -6.024 -7.720 -12.621 69 HD12 ILE 10 1HD1 ILE 10 -5.539 -6.122 -13.237 70 HD13 ILE 10 2HD1 ILE 10 -4.434 -7.534 -13.387 71 H CYS 11 H CYS 11 -0.420 -6.329 -10.058 72 HA CYS 11 HA CYS 11 0.644 -3.537 -10.091 73 HB2 CYS 11 2HB CYS 11 2.558 -4.193 -8.939 74 HB3 CYS 11 3HB CYS 11 1.212 -4.842 -8.018 75 H SER 12 H SER 12 2.640 -3.243 -11.227 76 HA SER 12 HA SER 12 3.004 -5.013 -13.632 77 HB2 SER 12 2HB SER 12 3.701 -2.086 -13.225 78 HB3 SER 12 3HB SER 12 4.004 -3.047 -14.679 79 HG SER 12 HG SER 12 1.499 -2.268 -13.571 80 H LEU 13 H LEU 13 5.170 -5.290 -14.475 81 HA LEU 13 HA LEU 13 6.813 -6.469 -12.504 82 HB2 LEU 13 2HB LEU 13 8.346 -6.900 -14.258 83 HB3 LEU 13 3HB LEU 13 6.724 -7.324 -14.742 84 HG LEU 13 HG LEU 13 7.965 -4.691 -15.626 85 HD11 LEU 13 1HD1 LEU 13 9.580 -6.455 -16.190 86 HD12 LEU 13 2HD1 LEU 13 8.295 -7.404 -16.971 87 HD13 LEU 13 3HD1 LEU 13 8.794 -5.838 -17.651 88 HD21 LEU 13 3HD2 LEU 13 6.529 -4.984 -17.612 89 HD22 LEU 13 1HD2 LEU 13 5.880 -6.484 -16.930 90 HD23 LEU 13 2HD2 LEU 13 5.565 -4.920 -16.141 91 H TYR 14 H TYR 14 7.046 -3.348 -14.051 92 HA TYR 14 HA TYR 14 9.696 -2.734 -13.234 93 HB2 TYR 14 2HB TYR 14 9.170 -0.515 -14.080 94 HB3 TYR 14 3HB TYR 14 8.595 -1.786 -15.174 95 HD1 TYR 14 HD2 TYR 14 7.455 0.672 -12.562 96 HD2 TYR 14 HD1 TYR 14 6.355 -1.796 -15.927 97 HE1 TYR 14 HE2 TYR 14 5.203 1.718 -12.593 98 HE2 TYR 14 HE1 TYR 14 4.119 -0.717 -15.986 99 HH TYR 14 HH TYR 14 2.705 0.809 -15.005 100 H GLN 15 H GLN 15 6.925 -2.827 -11.349 101 HA GLN 15 HA GLN 15 8.039 -0.879 -9.351 102 HB2 GLN 15 2HB GLN 15 5.685 -0.447 -8.639 103 HB3 GLN 15 3HB GLN 15 6.073 0.142 -10.260 104 HG2 GLN 15 2HG GLN 15 4.919 -1.718 -11.295 105 HG3 GLN 15 3HG GLN 15 4.666 -2.505 -9.723 106 HE21 GLN 15 1HE2 GLN 15 4.046 1.000 -9.861 107 HE22 GLN 15 2HE2 GLN 15 2.304 0.794 -9.889 108 H LEU 16 H LEU 16 6.622 -4.098 -9.893 109 HA LEU 16 HA LEU 16 6.534 -4.791 -7.106 110 HB2 LEU 16 2HB LEU 16 5.548 -6.683 -7.875 111 HB3 LEU 16 3HB LEU 16 5.398 -5.733 -9.329 112 HG LEU 16 HG LEU 16 7.702 -6.836 -9.970 113 HD11 LEU 16 1HD1 LEU 16 7.909 -9.159 -9.115 114 HD12 LEU 16 2HD1 LEU 16 8.023 -8.011 -7.781 115 HD13 LEU 16 3HD1 LEU 16 6.517 -8.893 -8.046 116 HD21 LEU 16 3HD2 LEU 16 5.455 -7.245 -11.105 117 HD22 LEU 16 1HD2 LEU 16 6.627 -8.586 -11.154 118 HD23 LEU 16 2HD2 LEU 16 5.241 -8.626 -10.027 119 H GLU 17 H GLU 17 9.063 -4.988 -9.607 120 HA GLU 17 HA GLU 17 10.795 -6.651 -8.056 121 HB2 GLU 17 2HB GLU 17 12.418 -6.310 -9.767 122 HB3 GLU 17 3HB GLU 17 10.807 -6.539 -10.439 123 HG2 GLU 17 2HG GLU 17 11.699 -4.915 -11.812 124 HG3 GLU 17 3HG GLU 17 10.666 -4.016 -10.715 125 H ASN 18 H ASN 18 10.167 -3.305 -7.828 126 HA ASN 18 HA ASN 18 12.550 -2.336 -6.532 127 HB2 ASN 18 2HB ASN 18 9.606 -1.640 -6.531 128 HB3 ASN 18 3HB ASN 18 10.602 -0.976 -5.279 129 HD21 ASN 18 2HD2 ASN 18 11.743 -1.417 -8.728 130 HD22 ASN 18 1HD2 ASN 18 11.777 0.307 -9.008 131 H TYR 19 H TYR 19 10.015 -4.520 -5.447 132 HA TYR 19 HA TYR 19 10.745 -4.339 -2.601 133 HB2 TYR 19 2HB TYR 19 8.761 -6.094 -4.098 134 HB3 TYR 19 3HB TYR 19 8.955 -5.995 -2.364 135 HD1 TYR 19 HD1 TYR 19 7.784 -4.055 -5.379 136 HD2 TYR 19 HD2 TYR 19 8.017 -4.247 -1.062 137 HE1 TYR 19 HE1 TYR 19 6.143 -2.220 -5.200 138 HE2 TYR 19 HE2 TYR 19 6.343 -2.421 -0.896 139 HH TYR 19 HH TYR 19 4.996 -0.944 -2.047 140 H CYS 20 H CYS 20 12.233 -5.878 -5.162 141 HA CYS 20 HA CYS 20 12.559 -8.573 -4.347 142 HB2 CYS 20 2HB CYS 20 13.191 -7.643 -6.545 143 HB3 CYS 20 3HB CYS 20 14.493 -6.720 -5.799 144 H ASN 21 H ASN 21 14.414 -5.704 -3.350 145 HA ASN 21 HA ASN 21 16.157 -7.393 -1.602 146 HB2 ASN 21 2HB ASN 21 16.610 -4.559 -2.624 147 HB3 ASN 21 3HB ASN 21 17.750 -5.560 -1.736 148 HD21 ASN 21 2HD2 ASN 21 17.487 -8.053 -3.195 149 HD22 ASN 21 1HD2 ASN 21 18.103 -7.714 -4.801 150 H1 PHE 1 1H PHE 1 5.709 -12.301 -19.320 151 H2 PHE 1 2H PHE 1 7.021 -11.593 -18.639 152 H3 PHE 1 3H PHE 1 6.016 -10.720 -19.599 153 HA PHE 1 HA PHE 1 5.290 -11.902 -17.005 154 HB2 PHE 1 2HB PHE 1 6.860 -9.977 -16.809 155 HB3 PHE 1 3HB PHE 1 5.744 -8.974 -17.722 156 HD1 PHE 1 HD1 PHE 1 6.160 -10.909 -14.539 157 HD2 PHE 1 HD2 PHE 1 3.896 -7.866 -16.613 158 HE1 PHE 1 HE1 PHE 1 5.029 -10.291 -12.419 159 HE2 PHE 1 HE2 PHE 1 2.810 -7.234 -14.480 160 HZ PHE 1 HZ PHE 1 3.360 -8.447 -12.383 161 H VAL 2 H VAL 2 3.146 -11.286 -16.228 162 HA VAL 2 HA VAL 2 1.273 -10.077 -18.198 163 HB VAL 2 HB VAL 2 0.655 -12.610 -16.613 164 HG11 VAL 2 1HG1 VAL 2 -1.581 -12.501 -17.716 165 HG12 VAL 2 2HG1 VAL 2 -1.324 -11.139 -16.627 166 HG13 VAL 2 3HG1 VAL 2 -1.162 -10.908 -18.382 167 HG21 VAL 2 3HG2 VAL 2 0.220 -13.625 -18.834 168 HG22 VAL 2 1HG2 VAL 2 0.782 -12.134 -19.620 169 HG23 VAL 2 2HG2 VAL 2 1.904 -13.126 -18.659 170 H ASN 3 H ASN 3 0.406 -8.366 -17.272 171 HA ASN 3 HA ASN 3 0.613 -7.727 -14.488 172 HB2 ASN 3 2HB ASN 3 -1.267 -6.468 -16.525 173 HB3 ASN 3 3HB ASN 3 -0.606 -5.741 -15.061 174 HD21 ASN 3 1HD2 ASN 3 1.325 -4.533 -15.290 175 HD22 ASN 3 2HD2 ASN 3 2.278 -4.557 -16.756 176 H GLN 4 H GLN 4 -0.518 -8.739 -12.909 177 HA GLN 4 HA GLN 4 -3.381 -9.366 -13.131 178 HB2 GLN 4 2HB GLN 4 -3.140 -11.754 -12.944 179 HB3 GLN 4 3HB GLN 4 -2.225 -11.215 -14.348 180 HG2 GLN 4 2HG GLN 4 -0.193 -11.134 -12.742 181 HG3 GLN 4 3HG GLN 4 -1.178 -12.050 -11.610 182 HE21 GLN 4 2HE2 GLN 4 1.091 -12.398 -14.061 183 HE22 GLN 4 1HE2 GLN 4 0.759 -14.086 -14.443 184 H HIS 5 H HIS 5 -3.905 -10.864 -11.149 185 HA HIS 5 HA HIS 5 -3.016 -9.500 -8.679 186 HB2 HIS 5 2HB HIS 5 -5.058 -11.698 -9.233 187 HB3 HIS 5 3HB HIS 5 -4.727 -11.005 -7.647 188 HD2 HIS 5 HD2 HIS 5 -6.275 -10.021 -11.067 189 HE1 HIS 5 HE1 HIS 5 -7.320 -6.984 -8.274 190 HE2 HIS 5 HE2 HIS 5 -7.746 -7.885 -10.632 191 H LEU 6 H LEU 6 -1.448 -10.281 -7.361 192 HA LEU 6 HA LEU 6 -0.571 -13.142 -7.585 193 HB2 LEU 6 2HB LEU 6 1.180 -10.655 -7.584 194 HB3 LEU 6 3HB LEU 6 1.782 -12.301 -7.440 195 HG LEU 6 HG LEU 6 0.303 -11.215 -9.883 196 HD11 LEU 6 1HD1 LEU 6 2.629 -11.327 -10.900 197 HD12 LEU 6 2HD1 LEU 6 2.404 -10.062 -9.683 198 HD13 LEU 6 3HD1 LEU 6 3.243 -11.553 -9.242 199 HD21 LEU 6 3HD2 LEU 6 0.104 -13.683 -9.666 200 HD22 LEU 6 1HD2 LEU 6 1.187 -13.253 -10.992 201 HD23 LEU 6 2HD2 LEU 6 1.861 -13.808 -9.445 202 H CYS 7 H CYS 7 -0.107 -14.123 -5.690 203 HA CYS 7 HA CYS 7 0.453 -12.577 -3.258 204 HB2 CYS 7 2HB CYS 7 -2.148 -12.861 -3.805 205 HB3 CYS 7 3HB CYS 7 -1.901 -14.436 -3.071 206 H GLY 8 H GLY 8 1.338 -13.827 -1.584 207 HA2 GLY 8 HA2 GLY 8 2.603 -15.541 -0.658 208 HA3 GLY 8 HA3 GLY 8 1.380 -16.614 -1.342 209 H SER 9 H SER 9 2.297 -18.217 -2.405 210 HA SER 9 HA SER 9 4.955 -18.350 -3.381 211 HB2 SER 9 2HB SER 9 3.368 -20.252 -2.866 212 HB3 SER 9 3HB SER 9 2.581 -19.934 -4.423 213 HG SER 9 HG SER 9 4.222 -21.569 -4.556 214 H HIS 10 H HIS 10 1.962 -17.369 -5.147 215 HA HIS 10 HA HIS 10 3.191 -17.204 -7.739 216 HB2 HIS 10 2HB HIS 10 0.602 -16.721 -6.577 217 HB3 HIS 10 3HB HIS 10 1.060 -15.260 -7.422 218 HD2 HIS 10 HD2 HIS 10 -0.761 -18.284 -8.083 219 HE1 HIS 10 HE1 HIS 10 1.017 -17.448 -11.860 220 HE2 HIS 10 HE2 HIS 10 -0.776 -18.807 -10.662 221 H LEU 11 H LEU 11 3.070 -14.969 -5.041 222 HA LEU 11 HA LEU 11 4.093 -12.657 -6.488 223 HB2 LEU 11 2HB LEU 11 2.588 -12.796 -4.371 224 HB3 LEU 11 3HB LEU 11 4.066 -13.127 -3.480 225 HG LEU 11 HG LEU 11 4.949 -10.901 -4.117 226 HD11 LEU 11 1HD1 LEU 11 2.248 -10.594 -5.501 227 HD12 LEU 11 2HD1 LEU 11 3.340 -9.252 -5.164 228 HD13 LEU 11 3HD1 LEU 11 3.844 -10.517 -6.289 229 HD21 LEU 11 3HD2 LEU 11 3.600 -11.190 -2.051 230 HD22 LEU 11 1HD2 LEU 11 3.258 -9.604 -2.762 231 HD23 LEU 11 2HD2 LEU 11 2.102 -10.910 -2.971 232 H VAL 12 H VAL 12 5.511 -15.077 -4.256 233 HA VAL 12 HA VAL 12 8.240 -14.194 -4.446 234 HB VAL 12 HB VAL 12 7.096 -16.977 -3.967 235 HG11 VAL 12 1HG1 VAL 12 9.429 -17.233 -4.696 236 HG12 VAL 12 2HG1 VAL 12 9.949 -15.980 -3.545 237 HG13 VAL 12 3HG1 VAL 12 9.301 -17.533 -2.966 238 HG21 VAL 12 3HG2 VAL 12 7.575 -16.499 -1.600 239 HG22 VAL 12 1HG2 VAL 12 8.176 -14.880 -2.033 240 HG23 VAL 12 2HG2 VAL 12 6.467 -15.296 -2.261 241 H GLU 13 H GLU 13 6.405 -16.540 -6.452 242 HA GLU 13 HA GLU 13 8.450 -17.150 -8.323 243 HB2 GLU 13 2HB GLU 13 5.423 -17.079 -8.473 244 HB3 GLU 13 3HB GLU 13 6.372 -17.310 -9.930 245 HG2 GLU 13 2HG GLU 13 7.559 -19.231 -8.811 246 HG3 GLU 13 3HG GLU 13 6.462 -19.064 -7.439 247 H ALA 14 H ALA 14 6.039 -14.402 -8.474 248 HA ALA 14 HA ALA 14 7.029 -13.364 -10.909 249 HB1 ALA 14 3HB ALA 14 4.917 -12.788 -9.834 250 HB2 ALA 14 1HB ALA 14 5.783 -11.897 -8.547 251 HB3 ALA 14 2HB ALA 14 5.856 -11.326 -10.228 252 H LEU 15 H LEU 15 8.087 -12.537 -7.547 253 HA LEU 15 HA LEU 15 10.100 -10.680 -8.329 254 HB2 LEU 15 2HB LEU 15 9.657 -12.433 -5.890 255 HB3 LEU 15 3HB LEU 15 11.236 -11.711 -6.115 256 HG LEU 15 HG LEU 15 10.040 -10.324 -4.645 257 HD11 LEU 15 1HD1 LEU 15 11.494 -9.229 -6.361 258 HD12 LEU 15 2HD1 LEU 15 10.051 -8.857 -7.315 259 HD13 LEU 15 3HD1 LEU 15 10.230 -8.175 -5.693 260 HD21 LEU 15 3HD2 LEU 15 7.811 -10.308 -6.696 261 HD22 LEU 15 1HD2 LEU 15 7.765 -10.835 -5.005 262 HD23 LEU 15 2HD2 LEU 15 7.937 -9.114 -5.387 263 H TYR 16 H TYR 16 10.278 -14.236 -8.235 264 HA TYR 16 HA TYR 16 13.092 -14.341 -8.886 265 HB2 TYR 16 2HB TYR 16 11.787 -16.268 -8.003 266 HB3 TYR 16 3HB TYR 16 10.889 -16.332 -9.523 267 HD1 TYR 16 HD1 TYR 16 14.206 -16.901 -7.967 268 HD2 TYR 16 HD2 TYR 16 11.889 -17.108 -11.598 269 HE1 TYR 16 HE1 TYR 16 16.021 -18.213 -9.048 270 HE2 TYR 16 HE2 TYR 16 13.704 -18.379 -12.696 271 HH TYR 16 HH TYR 16 16.737 -19.271 -10.960 272 H LEU 17 H LEU 17 10.127 -14.283 -10.928 273 HA LEU 17 HA LEU 17 11.532 -14.536 -13.411 274 HB2 LEU 17 2HB LEU 17 8.823 -13.241 -12.834 275 HB3 LEU 17 3HB LEU 17 9.436 -13.643 -14.430 276 HG LEU 17 HG LEU 17 8.849 -15.645 -12.254 277 HD11 LEU 17 1HD1 LEU 17 7.297 -14.977 -14.784 278 HD12 LEU 17 2HD1 LEU 17 6.902 -16.269 -13.628 279 HD13 LEU 17 3HD1 LEU 17 6.811 -14.575 -13.121 280 HD21 LEU 17 3HD2 LEU 17 10.597 -16.519 -13.738 281 HD22 LEU 17 1HD2 LEU 17 9.074 -17.348 -14.065 282 HD23 LEU 17 2HD2 LEU 17 9.636 -16.072 -15.167 283 H VAL 18 H VAL 18 10.451 -11.551 -11.692 284 HA VAL 18 HA VAL 18 11.654 -9.910 -13.783 285 HB VAL 18 HB VAL 18 11.347 -8.505 -11.200 286 HG11 VAL 18 1HG1 VAL 18 10.334 -8.020 -14.017 287 HG12 VAL 18 2HG1 VAL 18 10.292 -6.850 -12.676 288 HG13 VAL 18 3HG1 VAL 18 11.844 -7.387 -13.326 289 HG21 VAL 18 3HG2 VAL 18 9.578 -9.713 -10.649 290 HG22 VAL 18 1HG2 VAL 18 8.928 -8.260 -11.403 291 HG23 VAL 18 2HG2 VAL 18 8.913 -9.813 -12.313 292 H CYS 19 H CYS 19 12.650 -10.682 -10.399 293 HA CYS 19 HA CYS 19 15.068 -9.056 -10.779 294 HB2 CYS 19 2HB CYS 19 13.498 -8.794 -8.852 295 HB3 CYS 19 3HB CYS 19 13.960 -10.403 -8.307 296 H GLY 20 H GLY 20 14.232 -12.460 -10.047 297 HA2 GLY 20 HA2 GLY 20 16.938 -13.226 -9.302 298 HA3 GLY 20 HA3 GLY 20 15.537 -14.304 -9.502 299 H GLU 21 H GLU 21 14.989 -13.707 -12.249 300 HA GLU 21 HA GLU 21 16.726 -15.387 -13.689 301 HB2 GLU 21 2HB GLU 21 14.593 -13.344 -14.335 302 HB3 GLU 21 3HB GLU 21 15.473 -14.095 -15.641 303 HG2 GLU 21 2HG GLU 21 14.087 -15.772 -13.524 304 HG3 GLU 21 3HG GLU 21 13.243 -15.154 -14.940 305 H ARG 22 H ARG 22 17.283 -12.078 -12.840 306 HA ARG 22 HA ARG 22 18.917 -11.254 -15.064 307 HB2 ARG 22 2HB ARG 22 18.904 -10.343 -12.154 308 HB3 ARG 22 3HB ARG 22 19.714 -9.511 -13.483 309 HG2 ARG 22 2HG ARG 22 17.569 -9.129 -14.621 310 HG3 ARG 22 3HG ARG 22 16.705 -10.000 -13.342 311 HD2 ARG 22 2HD ARG 22 17.462 -8.347 -11.677 312 HD3 ARG 22 3HD ARG 22 18.308 -7.443 -12.953 313 HE ARG 22 HE ARG 22 15.745 -7.692 -13.922 314 HH11 ARG 22 2HH1 ARG 22 16.926 -6.310 -10.842 315 HH12 ARG 22 1HH1 ARG 22 15.507 -5.267 -10.758 316 HH21 ARG 22 1HH2 ARG 22 14.050 -6.216 -13.660 317 HH22 ARG 22 2HH2 ARG 22 14.052 -5.203 -12.214 318 H GLY 23 H GLY 23 19.572 -13.304 -12.294 319 HA2 GLY 23 HA2 GLY 23 21.449 -14.549 -11.711 320 HA3 GLY 23 HA3 GLY 23 22.288 -13.946 -13.154 321 H HIS 24 H HIS 24 23.901 -14.160 -11.296 322 HA HIS 24 HA HIS 24 25.634 -13.188 -10.269 323 HB2 HIS 24 2HB HIS 24 24.413 -10.493 -10.966 324 HB3 HIS 24 3HB HIS 24 26.063 -10.811 -10.462 325 HD2 HIS 24 HD2 HIS 24 23.850 -10.819 -13.522 326 HE1 HIS 24 HE1 HIS 24 27.584 -12.396 -14.821 327 HE2 HIS 24 HE2 HIS 24 25.316 -11.522 -15.591 328 H PHE 25 H PHE 25 22.586 -11.667 -9.222 329 HA PHE 25 HA PHE 25 23.066 -12.360 -6.441 330 HB2 PHE 25 2HB PHE 25 24.398 -10.276 -6.594 331 HB3 PHE 25 3HB PHE 25 23.000 -9.419 -7.229 332 HD1 PHE 25 HD1 PHE 25 24.255 -11.326 -4.256 333 HD2 PHE 25 HD2 PHE 25 21.389 -8.457 -5.725 334 HE1 PHE 25 HE1 PHE 25 23.526 -10.862 -1.931 335 HE2 PHE 25 HE2 PHE 25 20.669 -7.988 -3.395 336 HZ PHE 25 HZ PHE 25 21.738 -9.186 -1.494 337 H TYR 26 H TYR 26 21.176 -12.771 -5.477 338 HA TYR 26 HA TYR 26 18.683 -11.344 -6.084 339 HB2 TYR 26 2HB TYR 26 18.751 -13.106 -7.768 340 HB3 TYR 26 3HB TYR 26 19.156 -14.304 -6.540 341 HD1 TYR 26 HD1 TYR 26 16.552 -11.626 -6.997 342 HD2 TYR 26 HD2 TYR 26 17.401 -15.713 -5.961 343 HE1 TYR 26 HE1 TYR 26 14.135 -12.006 -6.580 344 HE2 TYR 26 HE2 TYR 26 14.963 -16.137 -5.635 345 HH TYR 26 HH TYR 26 12.506 -13.556 -5.987 346 H THR 27 H THR 27 17.146 -11.605 -4.476 347 HA THR 27 HA THR 27 17.955 -12.931 -1.917 348 HB THR 27 HB THR 27 16.717 -10.965 -0.817 349 HG1 THR 27 HG1 THR 27 15.939 -9.880 -2.571 350 HG21 THR 27 1HG2 THR 27 18.794 -9.637 -0.774 351 HG22 THR 27 2HG2 THR 27 19.146 -11.366 -0.621 352 HG23 THR 27 3HG2 THR 27 19.419 -10.540 -2.170 353 HA PRO 28 HA PRO 28 13.832 -14.596 -3.014 354 HB2 PRO 28 2HB PRO 28 14.104 -17.079 -1.929 355 HB3 PRO 28 3HB PRO 28 14.893 -16.624 -3.458 356 HG2 PRO 28 2HG PRO 28 16.105 -16.626 -0.680 357 HG3 PRO 28 3HG PRO 28 16.771 -17.356 -2.177 358 HD2 PRO 28 2HD PRO 28 17.528 -14.896 -1.292 359 HD3 PRO 28 3HD PRO 28 17.385 -15.252 -3.041 360 H LYS 29 H LYS 29 12.095 -15.629 -1.609 361 HA LYS 29 HA LYS 29 12.248 -15.009 1.283 362 HB2 LYS 29 2HB LYS 29 11.411 -12.944 0.244 363 HB3 LYS 29 3HB LYS 29 10.161 -13.851 -0.622 364 HG2 LYS 29 2HG LYS 29 9.138 -14.512 1.496 365 HG3 LYS 29 3HG LYS 29 10.401 -13.669 2.416 366 HD2 LYS 29 2HD LYS 29 9.596 -11.523 1.437 367 HD3 LYS 29 3HD LYS 29 8.331 -12.400 0.559 368 HE2 LYS 29 2HE LYS 29 8.686 -12.313 3.597 369 HE3 LYS 29 3HE LYS 29 7.503 -11.375 2.683 370 HZ1 LYS 29 HZ1 LYS 29 6.469 -13.476 1.997 371 HZ2 LYS 29 HZ2 LYS 29 7.548 -14.355 2.865 372 HZ3 LYS 29 HZ3 LYS 29 6.501 -13.360 3.625 373 H THR 30 H THR 30 10.981 -16.253 2.573 374 HA THR 30 HA THR 30 9.542 -18.602 1.519 375 HB THR 30 HB THR 30 9.808 -17.621 4.386 376 HG1 THR 30 HG1 THR 30 11.385 -19.454 2.890 377 HG21 THR 30 1HG2 THR 30 9.442 -20.023 4.934 378 HG22 THR 30 2HG2 THR 30 8.042 -19.308 4.126 379 HG23 THR 30 3HG2 THR 30 9.141 -20.364 3.213 Start of MODEL 27 1 H1 GLY 1 1H GLY 1 4.154 -2.234 1.465 2 H2 GLY 1 2H GLY 1 4.597 -2.602 2.999 3 H3 GLY 1 3H GLY 1 3.202 -3.197 2.389 4 HA2 GLY 1 HA2 GLY 1 5.940 -3.884 1.517 5 HA3 GLY 1 HA3 GLY 1 4.840 -4.941 2.420 6 H ILE 2 H ILE 2 5.915 -5.903 0.138 7 HA ILE 2 HA ILE 2 4.755 -5.279 -2.337 8 HB ILE 2 HB ILE 2 6.818 -6.517 -2.057 9 HG12 ILE 2 2HG1 ILE 2 6.644 -8.253 -3.725 10 HG13 ILE 2 3HG1 ILE 2 4.888 -8.298 -3.564 11 HG21 ILE 2 1HG2 ILE 2 6.263 -7.941 -0.111 12 HG22 ILE 2 2HG2 ILE 2 5.191 -8.921 -1.137 13 HG23 ILE 2 3HG2 ILE 2 6.933 -8.876 -1.444 14 HD11 ILE 2 3HD1 ILE 2 5.570 -7.153 -5.583 15 HD12 ILE 2 1HD1 ILE 2 4.769 -5.993 -4.511 16 HD13 ILE 2 2HD1 ILE 2 6.544 -6.006 -4.667 17 H VAL 3 H VAL 3 3.452 -7.521 0.064 18 HA VAL 3 HA VAL 3 1.413 -8.658 -1.574 19 HB VAL 3 HB VAL 3 1.451 -8.195 1.432 20 HG11 VAL 3 1HG1 VAL 3 -0.350 -10.086 -0.148 21 HG12 VAL 3 2HG1 VAL 3 -0.234 -9.988 1.617 22 HG13 VAL 3 3HG1 VAL 3 -0.892 -8.624 0.715 23 HG21 VAL 3 3HG2 VAL 3 2.106 -10.591 1.535 24 HG22 VAL 3 1HG2 VAL 3 2.115 -10.668 -0.238 25 HG23 VAL 3 2HG2 VAL 3 3.292 -9.654 0.625 26 H GLU 4 H GLU 4 1.516 -5.567 0.177 27 HA GLU 4 HA GLU 4 -1.296 -4.913 -0.315 28 HB2 GLU 4 2HB GLU 4 1.025 -3.195 0.622 29 HB3 GLU 4 3HB GLU 4 -0.677 -2.736 0.649 30 HG2 GLU 4 2HG GLU 4 -1.201 -4.433 2.300 31 HG3 GLU 4 3HG GLU 4 0.430 -5.107 2.217 32 H GLN 5 H GLN 5 1.492 -4.919 -2.284 33 HA GLN 5 HA GLN 5 0.474 -2.761 -4.074 34 HB2 GLN 5 2HB GLN 5 2.822 -2.644 -3.506 35 HB3 GLN 5 3HB GLN 5 3.079 -4.310 -4.014 36 HG2 GLN 5 2HG GLN 5 3.916 -2.778 -5.677 37 HG3 GLN 5 3HG GLN 5 2.607 -3.728 -6.345 38 HE21 GLN 5 2HE2 GLN 5 0.409 -2.575 -6.532 39 HE22 GLN 5 1HE2 GLN 5 0.474 -0.835 -6.817 40 H CYS 6 H CYS 6 1.273 -6.283 -4.077 41 HA CYS 6 HA CYS 6 0.069 -6.506 -6.805 42 HB2 CYS 6 2HB CYS 6 2.032 -8.154 -5.209 43 HB3 CYS 6 3HB CYS 6 1.412 -8.628 -6.788 44 H CYS 7 H CYS 7 -0.482 -7.893 -3.563 45 HA CYS 7 HA CYS 7 -2.194 -10.008 -4.693 46 HB2 CYS 7 2HB CYS 7 -0.762 -10.388 -2.713 47 HB3 CYS 7 3HB CYS 7 -1.714 -9.211 -1.816 48 H THR 8 H THR 8 -2.765 -6.925 -3.064 49 HA THR 8 HA THR 8 -5.641 -7.270 -2.836 50 HB THR 8 HB THR 8 -4.135 -5.836 -1.384 51 HG1 THR 8 HG1 THR 8 -6.451 -4.730 -2.605 52 HG21 THR 8 1HG2 THR 8 -3.639 -3.576 -2.080 53 HG22 THR 8 2HG2 THR 8 -2.939 -4.686 -3.280 54 HG23 THR 8 3HG2 THR 8 -4.440 -3.815 -3.648 55 H SER 9 H SER 9 -3.571 -6.048 -5.377 56 HA SER 9 HA SER 9 -5.659 -5.775 -7.329 57 HB2 SER 9 2HB SER 9 -5.490 -3.411 -7.751 58 HB3 SER 9 3HB SER 9 -6.082 -3.681 -6.112 59 HG SER 9 HG SER 9 -4.460 -2.038 -6.205 60 H ILE 10 H ILE 10 -4.696 -4.800 -9.415 61 HA ILE 10 HA ILE 10 -2.431 -6.500 -9.924 62 HB ILE 10 HB ILE 10 -3.926 -4.590 -11.762 63 HG12 ILE 10 2HG1 ILE 10 -4.096 -7.542 -11.038 64 HG13 ILE 10 3HG1 ILE 10 -5.342 -6.308 -10.908 65 HG21 ILE 10 1HG2 ILE 10 -2.804 -5.881 -13.607 66 HG22 ILE 10 2HG2 ILE 10 -1.666 -4.931 -12.673 67 HG23 ILE 10 3HG2 ILE 10 -1.796 -6.672 -12.374 68 HD11 ILE 10 3HD1 ILE 10 -5.870 -7.824 -12.655 69 HD12 ILE 10 1HD1 ILE 10 -5.528 -6.222 -13.352 70 HD13 ILE 10 2HD1 ILE 10 -4.323 -7.545 -13.477 71 H CYS 11 H CYS 11 -0.362 -6.111 -9.901 72 HA CYS 11 HA CYS 11 0.676 -3.311 -9.903 73 HB2 CYS 11 2HB CYS 11 2.624 -4.185 -8.806 74 HB3 CYS 11 3HB CYS 11 1.179 -4.669 -7.927 75 H SER 12 H SER 12 2.474 -2.789 -11.169 76 HA SER 12 HA SER 12 2.890 -4.452 -13.616 77 HB2 SER 12 2HB SER 12 3.778 -1.628 -12.969 78 HB3 SER 12 3HB SER 12 4.096 -2.505 -14.477 79 HG SER 12 HG SER 12 2.207 -1.097 -14.528 80 H LEU 13 H LEU 13 5.000 -4.963 -14.389 81 HA LEU 13 HA LEU 13 6.576 -6.272 -12.436 82 HB2 LEU 13 2HB LEU 13 8.120 -6.682 -14.254 83 HB3 LEU 13 3HB LEU 13 6.480 -7.112 -14.658 84 HG LEU 13 HG LEU 13 7.819 -4.561 -15.654 85 HD11 LEU 13 1HD1 LEU 13 8.292 -5.805 -17.731 86 HD12 LEU 13 2HD1 LEU 13 9.126 -6.531 -16.351 87 HD13 LEU 13 3HD1 LEU 13 7.654 -7.291 -16.995 88 HD21 LEU 13 3HD2 LEU 13 5.420 -4.400 -15.987 89 HD22 LEU 13 1HD2 LEU 13 6.149 -4.794 -17.533 90 HD23 LEU 13 2HD2 LEU 13 5.345 -6.073 -16.600 91 H TYR 14 H TYR 14 7.052 -3.191 -14.053 92 HA TYR 14 HA TYR 14 9.717 -2.758 -13.204 93 HB2 TYR 14 2HB TYR 14 9.379 -0.513 -14.091 94 HB3 TYR 14 3HB TYR 14 8.711 -1.762 -15.158 95 HD1 TYR 14 HD1 TYR 14 7.695 0.783 -12.565 96 HD2 TYR 14 HD2 TYR 14 6.528 -1.575 -15.987 97 HE1 TYR 14 HE1 TYR 14 5.524 1.978 -12.644 98 HE2 TYR 14 HE2 TYR 14 4.374 -0.341 -16.098 99 HH TYR 14 HH TYR 14 3.507 2.218 -13.735 100 H GLN 15 H GLN 15 6.917 -2.562 -11.344 101 HA GLN 15 HA GLN 15 8.160 -0.640 -9.393 102 HB2 GLN 15 2HB GLN 15 5.871 -0.206 -8.546 103 HB3 GLN 15 3HB GLN 15 6.128 0.350 -10.207 104 HG2 GLN 15 2HG GLN 15 4.922 -1.542 -11.098 105 HG3 GLN 15 3HG GLN 15 4.759 -2.273 -9.489 106 HE21 GLN 15 2HE2 GLN 15 4.173 1.217 -9.581 107 HE22 GLN 15 1HE2 GLN 15 2.428 1.044 -9.558 108 H LEU 16 H LEU 16 6.769 -3.872 -9.902 109 HA LEU 16 HA LEU 16 6.894 -4.549 -7.098 110 HB2 LEU 16 2HB LEU 16 5.741 -6.332 -7.708 111 HB3 LEU 16 3HB LEU 16 5.533 -5.483 -9.215 112 HG LEU 16 HG LEU 16 7.674 -6.729 -9.980 113 HD11 LEU 16 1HD1 LEU 16 8.512 -7.819 -8.053 114 HD12 LEU 16 2HD1 LEU 16 6.889 -8.292 -7.498 115 HD13 LEU 16 3HD1 LEU 16 7.652 -9.115 -8.863 116 HD21 LEU 16 3HD2 LEU 16 5.319 -7.167 -10.810 117 HD22 LEU 16 1HD2 LEU 16 6.284 -8.650 -10.731 118 HD23 LEU 16 2HD2 LEU 16 5.088 -8.310 -9.469 119 H GLU 17 H GLU 17 9.194 -4.732 -9.791 120 HA GLU 17 HA GLU 17 11.300 -6.284 -8.721 121 HB2 GLU 17 2HB GLU 17 11.323 -3.702 -10.353 122 HB3 GLU 17 3HB GLU 17 12.820 -4.470 -9.822 123 HG2 GLU 17 2HG GLU 17 12.159 -6.566 -10.967 124 HG3 GLU 17 3HG GLU 17 10.753 -5.706 -11.616 125 H ASN 18 H ASN 18 10.289 -3.038 -7.946 126 HA ASN 18 HA ASN 18 12.635 -2.175 -6.534 127 HB2 ASN 18 2HB ASN 18 9.848 -1.167 -6.924 128 HB3 ASN 18 3HB ASN 18 10.695 -0.564 -5.536 129 HD21 ASN 18 2HD2 ASN 18 10.791 -0.771 -9.124 130 HD22 ASN 18 1HD2 ASN 18 11.909 0.558 -9.302 131 H TYR 19 H TYR 19 10.182 -4.371 -5.503 132 HA TYR 19 HA TYR 19 10.669 -3.970 -2.613 133 HB2 TYR 19 2HB TYR 19 8.934 -5.905 -4.191 134 HB3 TYR 19 3HB TYR 19 9.033 -5.841 -2.442 135 HD1 TYR 19 HD2 TYR 19 8.011 -3.843 -5.461 136 HD2 TYR 19 HD1 TYR 19 7.851 -4.233 -1.159 137 HE1 TYR 19 HE2 TYR 19 6.320 -2.023 -5.344 138 HE2 TYR 19 HE1 TYR 19 6.118 -2.457 -1.057 139 HH TYR 19 HH TYR 19 4.870 -0.930 -2.250 140 H CYS 20 H CYS 20 12.228 -5.666 -5.136 141 HA CYS 20 HA CYS 20 13.148 -7.969 -3.574 142 HB2 CYS 20 2HB CYS 20 12.904 -7.769 -6.118 143 HB3 CYS 20 3HB CYS 20 14.355 -6.768 -6.084 144 H ASN 21 H ASN 21 14.173 -4.658 -3.970 145 HA ASN 21 HA ASN 21 16.930 -4.882 -3.180 146 HB2 ASN 21 2HB ASN 21 14.978 -2.529 -3.117 147 HB3 ASN 21 3HB ASN 21 16.714 -2.400 -2.864 148 HD21 ASN 21 2HD2 ASN 21 18.115 -3.307 -4.720 149 HD22 ASN 21 1HD2 ASN 21 17.515 -2.967 -6.337 150 H1 PHE 1 1H PHE 1 5.726 -12.244 -19.671 151 H2 PHE 1 2H PHE 1 7.131 -11.669 -19.053 152 H3 PHE 1 3H PHE 1 6.055 -10.646 -19.751 153 HA PHE 1 HA PHE 1 5.592 -12.185 -17.290 154 HB2 PHE 1 2HB PHE 1 7.243 -10.280 -17.086 155 HB3 PHE 1 3HB PHE 1 5.968 -9.174 -17.571 156 HD1 PHE 1 HD2 PHE 1 7.028 -11.634 -14.958 157 HD2 PHE 1 HD1 PHE 1 4.332 -8.400 -15.941 158 HE1 PHE 1 HE2 PHE 1 6.277 -11.530 -12.598 159 HE2 PHE 1 HE1 PHE 1 3.600 -8.300 -13.579 160 HZ PHE 1 HZ PHE 1 4.547 -9.877 -11.908 161 H VAL 2 H VAL 2 3.571 -11.500 -16.129 162 HA VAL 2 HA VAL 2 1.470 -10.274 -17.872 163 HB VAL 2 HB VAL 2 1.069 -12.728 -16.091 164 HG11 VAL 2 1HG1 VAL 2 -0.937 -11.124 -17.751 165 HG12 VAL 2 2HG1 VAL 2 -1.273 -12.686 -16.974 166 HG13 VAL 2 3HG1 VAL 2 -0.914 -11.277 -15.980 167 HG21 VAL 2 3HG2 VAL 2 2.099 -13.355 -18.235 168 HG22 VAL 2 1HG2 VAL 2 0.412 -13.869 -18.197 169 HG23 VAL 2 2HG2 VAL 2 0.871 -12.422 -19.121 170 H ASN 3 H ASN 3 0.946 -8.379 -16.863 171 HA ASN 3 HA ASN 3 0.986 -8.021 -13.992 172 HB2 ASN 3 2HB ASN 3 -0.473 -6.542 -16.219 173 HB3 ASN 3 3HB ASN 3 -0.417 -6.027 -14.536 174 HD21 ASN 3 2HD2 ASN 3 0.336 -4.211 -16.197 175 HD22 ASN 3 1HD2 ASN 3 2.072 -4.051 -16.188 176 H GLN 4 H GLN 4 -0.349 -8.855 -12.567 177 HA GLN 4 HA GLN 4 -3.199 -9.177 -12.920 178 HB2 GLN 4 2HB GLN 4 -3.249 -11.627 -12.543 179 HB3 GLN 4 3HB GLN 4 -2.580 -11.191 -14.111 180 HG2 GLN 4 2HG GLN 4 -0.380 -11.611 -13.433 181 HG3 GLN 4 3HG GLN 4 -0.776 -11.690 -11.716 182 HE21 GLN 4 1HE2 GLN 4 -1.908 -13.569 -10.857 183 HE22 GLN 4 2HE2 GLN 4 -1.882 -15.074 -11.772 184 H HIS 5 H HIS 5 -3.874 -10.687 -10.919 185 HA HIS 5 HA HIS 5 -2.833 -9.413 -8.469 186 HB2 HIS 5 2HB HIS 5 -4.981 -11.528 -8.896 187 HB3 HIS 5 3HB HIS 5 -4.600 -10.729 -7.371 188 HD2 HIS 5 HD2 HIS 5 -6.121 -9.946 -10.860 189 HE1 HIS 5 HE1 HIS 5 -7.172 -6.729 -8.307 190 HE2 HIS 5 HE2 HIS 5 -7.581 -7.788 -10.585 191 H LEU 6 H LEU 6 -1.389 -10.337 -7.123 192 HA LEU 6 HA LEU 6 -0.488 -13.169 -7.527 193 HB2 LEU 6 2HB LEU 6 1.205 -10.656 -7.417 194 HB3 LEU 6 3HB LEU 6 1.847 -12.292 -7.337 195 HG LEU 6 HG LEU 6 0.326 -11.148 -9.722 196 HD11 LEU 6 1HD1 LEU 6 2.623 -11.103 -10.755 197 HD12 LEU 6 2HD1 LEU 6 2.389 -9.936 -9.438 198 HD13 LEU 6 3HD1 LEU 6 3.283 -11.437 -9.132 199 HD21 LEU 6 3HD2 LEU 6 0.213 -13.635 -9.580 200 HD22 LEU 6 1HD2 LEU 6 1.237 -13.113 -10.922 201 HD23 LEU 6 2HD2 LEU 6 1.978 -13.700 -9.419 202 H CYS 7 H CYS 7 -0.562 -14.226 -5.698 203 HA CYS 7 HA CYS 7 0.039 -12.871 -3.095 204 HB2 CYS 7 2HB CYS 7 -2.216 -14.830 -3.655 205 HB3 CYS 7 3HB CYS 7 -1.860 -14.084 -2.104 206 H GLY 8 H GLY 8 1.217 -14.147 -1.666 207 HA2 GLY 8 HA2 GLY 8 2.486 -15.910 -0.853 208 HA3 GLY 8 HA3 GLY 8 1.186 -16.930 -1.473 209 H SER 9 H SER 9 1.930 -18.530 -2.671 210 HA SER 9 HA SER 9 4.541 -18.798 -3.733 211 HB2 SER 9 2HB SER 9 2.846 -20.606 -3.233 212 HB3 SER 9 3HB SER 9 2.042 -20.184 -4.757 213 HG SER 9 HG SER 9 3.564 -21.919 -4.990 214 H HIS 10 H HIS 10 1.578 -17.547 -5.365 215 HA HIS 10 HA HIS 10 2.745 -17.355 -7.990 216 HB2 HIS 10 2HB HIS 10 0.226 -16.755 -6.735 217 HB3 HIS 10 3HB HIS 10 0.766 -15.283 -7.508 218 HD2 HIS 10 HD2 HIS 10 -1.237 -18.180 -8.296 219 HE1 HIS 10 HE1 HIS 10 0.461 -17.169 -12.067 220 HE2 HIS 10 HE2 HIS 10 -1.350 -18.533 -10.901 221 H LEU 11 H LEU 11 2.727 -15.185 -5.213 222 HA LEU 11 HA LEU 11 3.935 -12.931 -6.590 223 HB2 LEU 11 2HB LEU 11 2.406 -12.916 -4.525 224 HB3 LEU 11 3HB LEU 11 3.780 -13.499 -3.598 225 HG LEU 11 HG LEU 11 5.032 -11.423 -4.141 226 HD11 LEU 11 1HD1 LEU 11 3.957 -10.822 -6.316 227 HD12 LEU 11 2HD1 LEU 11 2.425 -10.536 -5.459 228 HD13 LEU 11 3HD1 LEU 11 3.832 -9.507 -5.155 229 HD21 LEU 11 3HD2 LEU 11 3.607 -9.932 -2.727 230 HD22 LEU 11 1HD2 LEU 11 2.230 -11.010 -2.982 231 HD23 LEU 11 2HD2 LEU 11 3.660 -11.584 -2.091 232 H VAL 12 H VAL 12 5.186 -15.499 -4.430 233 HA VAL 12 HA VAL 12 7.948 -14.778 -4.552 234 HB VAL 12 HB VAL 12 6.632 -17.507 -4.259 235 HG11 VAL 12 1HG1 VAL 12 8.809 -18.270 -3.299 236 HG12 VAL 12 2HG1 VAL 12 8.919 -17.921 -5.024 237 HG13 VAL 12 3HG1 VAL 12 9.558 -16.752 -3.843 238 HG21 VAL 12 3HG2 VAL 12 7.910 -15.644 -2.211 239 HG22 VAL 12 1HG2 VAL 12 6.168 -15.868 -2.445 240 HG23 VAL 12 2HG2 VAL 12 7.153 -17.221 -1.880 241 H GLU 13 H GLU 13 6.024 -16.896 -6.723 242 HA GLU 13 HA GLU 13 8.059 -17.499 -8.608 243 HB2 GLU 13 2HB GLU 13 5.041 -17.338 -8.742 244 HB3 GLU 13 3HB GLU 13 5.960 -17.467 -10.233 245 HG2 GLU 13 2HG GLU 13 7.133 -19.476 -9.316 246 HG3 GLU 13 3HG GLU 13 6.091 -19.405 -7.890 247 H ALA 14 H ALA 14 5.810 -14.613 -8.604 248 HA ALA 14 HA ALA 14 6.875 -13.516 -10.990 249 HB1 ALA 14 3HB ALA 14 5.633 -12.163 -8.557 250 HB2 ALA 14 1HB ALA 14 5.811 -11.446 -10.172 251 HB3 ALA 14 2HB ALA 14 4.770 -12.875 -9.948 252 H LEU 15 H LEU 15 7.860 -12.872 -7.558 253 HA LEU 15 HA LEU 15 9.968 -11.077 -8.172 254 HB2 LEU 15 2HB LEU 15 9.327 -12.903 -5.851 255 HB3 LEU 15 3HB LEU 15 10.954 -12.271 -5.957 256 HG LEU 15 HG LEU 15 9.679 -10.906 -4.483 257 HD11 LEU 15 1HD1 LEU 15 10.149 -9.287 -7.018 258 HD12 LEU 15 2HD1 LEU 15 10.149 -8.712 -5.346 259 HD13 LEU 15 3HD1 LEU 15 11.419 -9.818 -5.894 260 HD21 LEU 15 3HD2 LEU 15 7.791 -9.467 -5.314 261 HD22 LEU 15 1HD2 LEU 15 7.725 -10.477 -6.770 262 HD23 LEU 15 2HD2 LEU 15 7.423 -11.188 -5.172 263 H TYR 16 H TYR 16 10.070 -14.663 -8.209 264 HA TYR 16 HA TYR 16 12.882 -14.821 -8.792 265 HB2 TYR 16 2HB TYR 16 11.469 -16.764 -8.114 266 HB3 TYR 16 3HB TYR 16 10.605 -16.658 -9.647 267 HD1 TYR 16 HD2 TYR 16 11.686 -17.251 -11.789 268 HD2 TYR 16 HD1 TYR 16 13.730 -17.722 -8.021 269 HE1 TYR 16 HE2 TYR 16 13.401 -18.634 -12.909 270 HE2 TYR 16 HE1 TYR 16 15.428 -19.168 -9.128 271 HH TYR 16 HH TYR 16 15.322 -19.894 -12.644 272 H LEU 17 H LEU 17 10.050 -14.442 -10.966 273 HA LEU 17 HA LEU 17 11.649 -14.565 -13.379 274 HB2 LEU 17 2HB LEU 17 8.857 -13.431 -12.861 275 HB3 LEU 17 3HB LEU 17 9.570 -13.655 -14.450 276 HG LEU 17 HG LEU 17 9.028 -15.923 -12.501 277 HD11 LEU 17 1HD1 LEU 17 7.116 -16.459 -13.959 278 HD12 LEU 17 2HD1 LEU 17 6.940 -14.848 -13.243 279 HD13 LEU 17 3HD1 LEU 17 7.445 -15.014 -14.941 280 HD21 LEU 17 3HD2 LEU 17 9.818 -15.953 -15.447 281 HD22 LEU 17 1HD2 LEU 17 10.821 -16.498 -14.084 282 HD23 LEU 17 2HD2 LEU 17 9.344 -17.375 -14.492 283 H VAL 18 H VAL 18 10.300 -11.769 -11.554 284 HA VAL 18 HA VAL 18 11.484 -9.919 -13.475 285 HB VAL 18 HB VAL 18 10.918 -8.499 -11.007 286 HG11 VAL 18 1HG1 VAL 18 10.963 -7.520 -13.262 287 HG12 VAL 18 2HG1 VAL 18 9.523 -8.476 -13.698 288 HG13 VAL 18 3HG1 VAL 18 9.434 -7.233 -12.418 289 HG21 VAL 18 3HG2 VAL 18 9.439 -10.066 -10.266 290 HG22 VAL 18 1HG2 VAL 18 8.490 -8.775 -10.991 291 HG23 VAL 18 2HG2 VAL 18 8.673 -10.293 -11.886 292 H CYS 19 H CYS 19 12.498 -11.059 -10.228 293 HA CYS 19 HA CYS 19 14.804 -9.172 -10.360 294 HB2 CYS 19 2HB CYS 19 13.245 -9.094 -8.411 295 HB3 CYS 19 3HB CYS 19 13.757 -10.728 -7.981 296 H GLY 20 H GLY 20 14.032 -12.614 -9.705 297 HA2 GLY 20 HA2 GLY 20 16.707 -13.412 -9.070 298 HA3 GLY 20 HA3 GLY 20 15.365 -14.499 -9.500 299 H GLU 21 H GLU 21 14.813 -14.051 -12.051 300 HA GLU 21 HA GLU 21 16.900 -15.264 -13.500 301 HB2 GLU 21 2HB GLU 21 14.452 -15.341 -14.008 302 HB3 GLU 21 3HB GLU 21 14.561 -13.691 -14.642 303 HG2 GLU 21 2HG GLU 21 16.155 -14.435 -16.367 304 HG3 GLU 21 3HG GLU 21 16.178 -16.061 -15.675 305 H ARG 22 H ARG 22 16.027 -11.772 -13.324 306 HA ARG 22 HA ARG 22 17.971 -10.883 -15.249 307 HB2 ARG 22 2HB ARG 22 16.756 -9.380 -12.889 308 HB3 ARG 22 3HB ARG 22 17.720 -8.667 -14.186 309 HG2 ARG 22 2HG ARG 22 15.964 -9.593 -15.830 310 HG3 ARG 22 3HG ARG 22 14.978 -9.960 -14.417 311 HD2 ARG 22 2HD ARG 22 14.222 -7.837 -15.160 312 HD3 ARG 22 3HD ARG 22 15.232 -7.496 -13.748 313 HE ARG 22 HE ARG 22 16.526 -7.409 -16.412 314 HH11 ARG 22 1HH2 ARG 22 15.035 -5.384 -13.874 315 HH12 ARG 22 2HH2 ARG 22 15.878 -3.974 -14.440 316 HH21 ARG 22 2HH1 ARG 22 17.533 -5.537 -17.053 317 HH22 ARG 22 1HH1 ARG 22 17.246 -4.050 -16.202 318 H GLY 23 H GLY 23 18.211 -11.625 -11.792 319 HA2 GLY 23 HA2 GLY 23 20.906 -10.629 -11.380 320 HA3 GLY 23 HA3 GLY 23 20.001 -11.777 -10.357 321 H HIS 24 H HIS 24 19.548 -13.791 -12.320 322 HA HIS 24 HA HIS 24 22.052 -15.224 -12.359 323 HB2 HIS 24 2HB HIS 24 19.491 -15.750 -13.919 324 HB3 HIS 24 3HB HIS 24 20.813 -16.883 -13.679 325 HD2 HIS 24 HD2 HIS 24 21.103 -16.207 -10.419 326 HE1 HIS 24 HE1 HIS 24 17.239 -17.975 -10.275 327 HE2 HIS 24 HE2 HIS 24 19.275 -17.315 -8.893 328 H PHE 25 H PHE 25 20.153 -13.776 -15.029 329 HA PHE 25 HA PHE 25 22.343 -12.601 -16.391 330 HB2 PHE 25 2HB PHE 25 23.005 -14.874 -17.031 331 HB3 PHE 25 3HB PHE 25 21.377 -15.224 -17.592 332 HD1 PHE 25 HD1 PHE 25 24.157 -12.724 -18.128 333 HD2 PHE 25 HD2 PHE 25 20.968 -15.017 -19.911 334 HE1 PHE 25 HE1 PHE 25 24.796 -11.874 -20.368 335 HE2 PHE 25 HE2 PHE 25 21.627 -14.183 -22.153 336 HZ PHE 25 HZ PHE 25 23.534 -12.603 -22.388 337 H TYR 26 H TYR 26 21.236 -10.808 -16.873 338 HA TYR 26 HA TYR 26 18.532 -10.889 -18.054 339 HB2 TYR 26 2HB TYR 26 19.078 -9.163 -16.418 340 HB3 TYR 26 3HB TYR 26 20.421 -8.606 -17.417 341 HD1 TYR 26 HD1 TYR 26 16.768 -9.417 -18.002 342 HD2 TYR 26 HD2 TYR 26 19.976 -6.569 -18.485 343 HE1 TYR 26 HE1 TYR 26 15.243 -7.920 -19.239 344 HE2 TYR 26 HE2 TYR 26 18.434 -5.049 -19.708 345 HH TYR 26 HH TYR 26 15.008 -5.903 -20.344 346 H THR 27 H THR 27 17.993 -10.224 -20.078 347 HA THR 27 HA THR 27 20.112 -10.041 -22.189 348 HB THR 27 HB THR 27 18.281 -10.813 -23.741 349 HG1 THR 27 HG1 THR 27 16.547 -10.488 -22.295 350 HG21 THR 27 1HG2 THR 27 19.182 -12.750 -21.560 351 HG22 THR 27 2HG2 THR 27 18.594 -13.184 -23.179 352 HG23 THR 27 3HG2 THR 27 20.114 -12.291 -23.004 353 HA PRO 28 HA PRO 28 18.121 -5.914 -22.195 354 HB2 PRO 28 2HB PRO 28 20.204 -4.444 -23.154 355 HB3 PRO 28 3HB PRO 28 20.140 -5.022 -21.461 356 HG2 PRO 28 2HG PRO 28 21.576 -6.299 -23.809 357 HG3 PRO 28 3HG PRO 28 22.231 -5.934 -22.179 358 HD2 PRO 28 2HD PRO 28 21.295 -8.401 -22.848 359 HD3 PRO 28 3HD PRO 28 21.053 -7.733 -21.205 360 H LYS 29 H LYS 29 17.474 -4.468 -23.882 361 HA LYS 29 HA LYS 29 17.895 -5.094 -26.692 362 HB2 LYS 29 2HB LYS 29 15.588 -5.719 -27.144 363 HB3 LYS 29 3HB LYS 29 16.348 -6.884 -26.068 364 HG2 LYS 29 2HG LYS 29 15.207 -5.826 -24.115 365 HG3 LYS 29 3HG LYS 29 14.415 -4.678 -25.200 366 HD2 LYS 29 2HD LYS 29 14.086 -7.710 -25.290 367 HD3 LYS 29 3HD LYS 29 12.967 -6.576 -24.519 368 HE2 LYS 29 2HE LYS 29 12.603 -5.450 -26.720 369 HE3 LYS 29 3HE LYS 29 13.667 -6.634 -27.490 370 HZ1 LYS 29 HZ1 LYS 29 11.343 -7.263 -27.717 371 HZ2 LYS 29 HZ2 LYS 29 12.115 -8.377 -26.806 372 HZ3 LYS 29 HZ3 LYS 29 11.128 -7.281 -26.098 373 H THR 30 H THR 30 16.593 -3.736 -28.134 374 HA THR 30 HA THR 30 16.684 -0.960 -27.486 375 HB THR 30 HB THR 30 15.175 -2.274 -29.774 376 HG1 THR 30 HG1 THR 30 17.144 -2.094 -30.863 377 HG21 THR 30 1HG2 THR 30 15.780 -0.184 -30.982 378 HG22 THR 30 2HG2 THR 30 14.754 0.155 -29.583 379 HG23 THR 30 3HG2 THR 30 16.502 0.466 -29.492 Start of MODEL 28 1 H1 GLY 1 1H GLY 1 3.159 -2.208 1.497 2 H2 GLY 1 2H GLY 1 4.072 -1.456 0.353 3 H3 GLY 1 3H GLY 1 4.570 -1.503 1.916 4 HA2 GLY 1 HA2 GLY 1 5.873 -3.080 0.753 5 HA3 GLY 1 HA3 GLY 1 4.736 -3.937 1.802 6 H ILE 2 H ILE 2 5.887 -5.225 -0.334 7 HA ILE 2 HA ILE 2 4.698 -5.067 -2.849 8 HB ILE 2 HB ILE 2 6.782 -6.230 -2.361 9 HG12 ILE 2 2HG1 ILE 2 6.560 -8.271 -3.700 10 HG13 ILE 2 3HG1 ILE 2 4.801 -8.158 -3.594 11 HG21 ILE 2 1HG2 ILE 2 6.972 -8.403 -1.360 12 HG22 ILE 2 2HG2 ILE 2 6.180 -7.338 -0.203 13 HG23 ILE 2 3HG2 ILE 2 5.226 -8.525 -1.126 14 HD11 ILE 2 3HD1 ILE 2 4.916 -5.998 -4.872 15 HD12 ILE 2 1HD1 ILE 2 6.681 -6.238 -4.993 16 HD13 ILE 2 2HD1 ILE 2 5.579 -7.394 -5.739 17 H VAL 3 H VAL 3 3.592 -7.084 -0.145 18 HA VAL 3 HA VAL 3 1.509 -8.407 -1.575 19 HB VAL 3 HB VAL 3 1.725 -7.812 1.404 20 HG11 VAL 3 1HG1 VAL 3 -0.012 -9.907 0.025 21 HG12 VAL 3 2HG1 VAL 3 0.194 -9.710 1.773 22 HG13 VAL 3 3HG1 VAL 3 -0.620 -8.448 0.849 23 HG21 VAL 3 3HG2 VAL 3 3.615 -9.177 0.558 24 HG22 VAL 3 1HG2 VAL 3 2.550 -10.152 1.568 25 HG23 VAL 3 2HG2 VAL 3 2.469 -10.306 -0.198 26 H GLU 4 H GLU 4 1.592 -5.253 0.036 27 HA GLU 4 HA GLU 4 -1.280 -4.782 -0.160 28 HB2 GLU 4 2HB GLU 4 0.973 -2.831 0.363 29 HB3 GLU 4 3HB GLU 4 -0.752 -2.563 0.645 30 HG2 GLU 4 2HG GLU 4 -0.796 -4.221 2.422 31 HG3 GLU 4 3HG GLU 4 0.885 -4.675 2.119 32 H GLN 5 H GLN 5 1.215 -4.728 -2.501 33 HA GLN 5 HA GLN 5 -0.428 -2.944 -4.274 34 HB2 GLN 5 2HB GLN 5 2.444 -3.956 -4.500 35 HB3 GLN 5 3HB GLN 5 1.540 -3.183 -5.813 36 HG2 GLN 5 2HG GLN 5 1.091 -1.304 -3.951 37 HG3 GLN 5 3HG GLN 5 2.547 -1.987 -3.227 38 HE21 GLN 5 2HE2 GLN 5 1.253 -0.681 -6.360 39 HE22 GLN 5 1HE2 GLN 5 2.784 0.021 -6.844 40 H CYS 6 H CYS 6 1.220 -6.164 -4.281 41 HA CYS 6 HA CYS 6 -0.166 -6.877 -6.747 42 HB2 CYS 6 2HB CYS 6 1.782 -8.295 -4.923 43 HB3 CYS 6 3HB CYS 6 1.183 -8.950 -6.440 44 H CYS 7 H CYS 7 -0.517 -7.998 -3.364 45 HA CYS 7 HA CYS 7 -2.316 -10.148 -4.148 46 HB2 CYS 7 2HB CYS 7 -0.807 -10.080 -2.120 47 HB3 CYS 7 3HB CYS 7 -1.956 -8.959 -1.387 48 H THR 8 H THR 8 -2.827 -6.813 -3.350 49 HA THR 8 HA THR 8 -5.738 -7.109 -2.958 50 HB THR 8 HB THR 8 -4.221 -5.581 -1.601 51 HG1 THR 8 HG1 THR 8 -5.852 -4.025 -1.525 52 HG21 THR 8 1HG2 THR 8 -4.408 -3.807 -4.075 53 HG22 THR 8 2HG2 THR 8 -3.717 -3.388 -2.502 54 HG23 THR 8 3HG2 THR 8 -2.940 -4.634 -3.507 55 H SER 9 H SER 9 -3.583 -6.185 -5.602 56 HA SER 9 HA SER 9 -5.813 -5.737 -7.457 57 HB2 SER 9 2HB SER 9 -4.015 -3.514 -6.468 58 HB3 SER 9 3HB SER 9 -4.802 -3.449 -8.046 59 HG SER 9 HG SER 9 -6.305 -3.945 -5.692 60 H ILE 10 H ILE 10 -4.864 -4.962 -9.677 61 HA ILE 10 HA ILE 10 -2.728 -6.682 -10.602 62 HB ILE 10 HB ILE 10 -3.783 -4.079 -11.793 63 HG12 ILE 10 2HG1 ILE 10 -5.614 -5.733 -11.574 64 HG13 ILE 10 3HG1 ILE 10 -5.244 -5.274 -13.223 65 HG21 ILE 10 1HG2 ILE 10 -2.876 -5.031 -13.964 66 HG22 ILE 10 2HG2 ILE 10 -1.623 -4.616 -12.798 67 HG23 ILE 10 3HG2 ILE 10 -2.102 -6.311 -13.008 68 HD11 ILE 10 3HD1 ILE 10 -5.719 -7.698 -12.971 69 HD12 ILE 10 1HD1 ILE 10 -4.116 -7.389 -13.648 70 HD13 ILE 10 2HD1 ILE 10 -4.284 -7.853 -11.935 71 H CYS 11 H CYS 11 -0.575 -6.461 -10.251 72 HA CYS 11 HA CYS 11 0.521 -3.701 -9.828 73 HB2 CYS 11 2HB CYS 11 2.275 -4.597 -8.518 74 HB3 CYS 11 3HB CYS 11 0.740 -5.126 -7.847 75 H SER 12 H SER 12 2.334 -3.069 -10.901 76 HA SER 12 HA SER 12 2.908 -4.542 -13.423 77 HB2 SER 12 2HB SER 12 3.606 -1.701 -12.637 78 HB3 SER 12 3HB SER 12 3.831 -2.453 -14.223 79 HG SER 12 HG SER 12 1.867 -1.178 -14.025 80 H LEU 13 H LEU 13 5.041 -4.805 -14.266 81 HA LEU 13 HA LEU 13 6.736 -6.110 -12.421 82 HB2 LEU 13 2HB LEU 13 8.318 -6.251 -14.244 83 HB3 LEU 13 3HB LEU 13 6.720 -6.800 -14.695 84 HG LEU 13 HG LEU 13 7.819 -4.068 -15.489 85 HD11 LEU 13 1HD1 LEU 13 7.896 -6.693 -17.037 86 HD12 LEU 13 2HD1 LEU 13 8.401 -5.103 -17.653 87 HD13 LEU 13 3HD1 LEU 13 9.298 -5.859 -16.330 88 HD21 LEU 13 3HD2 LEU 13 5.414 -4.105 -15.823 89 HD22 LEU 13 1HD2 LEU 13 6.182 -4.296 -17.388 90 HD23 LEU 13 2HD2 LEU 13 5.500 -5.718 -16.577 91 H TYR 14 H TYR 14 6.998 -2.891 -13.845 92 HA TYR 14 HA TYR 14 9.555 -2.282 -12.877 93 HB2 TYR 14 2HB TYR 14 9.027 -0.018 -13.549 94 HB3 TYR 14 3HB TYR 14 8.418 -1.192 -14.729 95 HD1 TYR 14 HD2 TYR 14 7.341 1.041 -11.896 96 HD2 TYR 14 HD1 TYR 14 6.177 -1.111 -15.451 97 HE1 TYR 14 HE2 TYR 14 5.102 2.113 -11.810 98 HE2 TYR 14 HE1 TYR 14 3.957 -0.001 -15.396 99 HH TYR 14 HH TYR 14 2.578 1.475 -14.283 100 H GLN 15 H GLN 15 6.735 -2.530 -11.012 101 HA GLN 15 HA GLN 15 7.805 -0.678 -8.896 102 HB2 GLN 15 2HB GLN 15 5.465 -0.482 -8.063 103 HB3 GLN 15 3HB GLN 15 5.754 0.273 -9.636 104 HG2 GLN 15 2HG GLN 15 4.697 -1.575 -10.787 105 HG3 GLN 15 3HG GLN 15 4.498 -2.476 -9.270 106 HE21 GLN 15 2HE2 GLN 15 3.745 1.030 -9.334 107 HE22 GLN 15 1HE2 GLN 15 2.011 0.760 -9.318 108 H LEU 16 H LEU 16 6.439 -3.897 -9.653 109 HA LEU 16 HA LEU 16 6.687 -4.892 -6.975 110 HB2 LEU 16 2HB LEU 16 5.552 -6.580 -7.869 111 HB3 LEU 16 3HB LEU 16 5.491 -5.678 -9.336 112 HG LEU 16 HG LEU 16 7.757 -6.834 -9.922 113 HD11 LEU 16 1HD1 LEU 16 7.700 -9.223 -8.868 114 HD12 LEU 16 2HD1 LEU 16 8.338 -7.908 -7.884 115 HD13 LEU 16 3HD1 LEU 16 6.685 -8.507 -7.620 116 HD21 LEU 16 3HD2 LEU 16 5.258 -8.578 -9.834 117 HD22 LEU 16 1HD2 LEU 16 5.538 -7.303 -11.038 118 HD23 LEU 16 2HD2 LEU 16 6.640 -8.691 -10.958 119 H GLU 17 H GLU 17 8.886 -4.749 -9.724 120 HA GLU 17 HA GLU 17 11.161 -6.177 -8.918 121 HB2 GLU 17 2HB GLU 17 10.731 -3.622 -10.501 122 HB3 GLU 17 3HB GLU 17 12.365 -4.019 -9.999 123 HG2 GLU 17 2HG GLU 17 12.249 -6.195 -11.099 124 HG3 GLU 17 3HG GLU 17 10.624 -5.821 -11.688 125 H ASN 18 H ASN 18 10.055 -3.033 -7.821 126 HA ASN 18 HA ASN 18 12.501 -2.133 -6.614 127 HB2 ASN 18 2HB ASN 18 9.645 -1.270 -6.665 128 HB3 ASN 18 3HB ASN 18 10.530 -0.783 -5.252 129 HD21 ASN 18 2HD2 ASN 18 10.406 -0.520 -8.837 130 HD22 ASN 18 1HD2 ASN 18 11.431 0.891 -8.896 131 H TYR 19 H TYR 19 10.181 -4.459 -5.485 132 HA TYR 19 HA TYR 19 11.029 -4.285 -2.667 133 HB2 TYR 19 2HB TYR 19 9.064 -6.078 -4.137 134 HB3 TYR 19 3HB TYR 19 9.317 -6.048 -2.398 135 HD1 TYR 19 HD1 TYR 19 8.746 -4.061 -1.043 136 HD2 TYR 19 HD2 TYR 19 7.806 -4.232 -5.262 137 HE1 TYR 19 HE1 TYR 19 7.126 -2.193 -0.762 138 HE2 TYR 19 HE2 TYR 19 6.111 -2.449 -4.942 139 HH TYR 19 HH TYR 19 5.101 -1.013 -3.473 140 H CYS 20 H CYS 20 12.373 -5.737 -5.401 141 HA CYS 20 HA CYS 20 13.383 -8.194 -4.200 142 HB2 CYS 20 2HB CYS 20 13.205 -7.684 -6.659 143 HB3 CYS 20 3HB CYS 20 14.523 -6.523 -6.472 144 H ASN 21 H ASN 21 14.333 -4.833 -4.043 145 HA ASN 21 HA ASN 21 17.024 -5.239 -2.981 146 HB2 ASN 21 2HB ASN 21 16.453 -3.288 -4.365 147 HB3 ASN 21 3HB ASN 21 15.213 -2.792 -3.216 148 HD21 ASN 21 2HD2 ASN 21 16.068 -2.443 -0.913 149 HD22 ASN 21 1HD2 ASN 21 17.581 -1.526 -0.813 150 H1 PHE 1 1H PHE 1 7.487 -11.482 -18.908 151 H2 PHE 1 2H PHE 1 6.583 -10.306 -19.607 152 H3 PHE 1 3H PHE 1 6.102 -11.866 -19.696 153 HA PHE 1 HA PHE 1 5.743 -11.977 -17.339 154 HB2 PHE 1 2HB PHE 1 7.520 -10.314 -16.768 155 HB3 PHE 1 3HB PHE 1 6.488 -9.019 -17.359 156 HD1 PHE 1 HD2 PHE 1 6.771 -11.721 -14.774 157 HD2 PHE 1 HD1 PHE 1 4.794 -8.058 -15.931 158 HE1 PHE 1 HE2 PHE 1 5.705 -11.580 -12.538 159 HE2 PHE 1 HE1 PHE 1 3.762 -7.910 -13.684 160 HZ PHE 1 HZ PHE 1 4.197 -9.678 -11.993 161 H VAL 2 H VAL 2 3.693 -11.238 -16.327 162 HA VAL 2 HA VAL 2 1.884 -9.630 -18.080 163 HB VAL 2 HB VAL 2 1.128 -12.269 -16.745 164 HG11 VAL 2 1HG1 VAL 2 -1.119 -11.898 -17.785 165 HG12 VAL 2 2HG1 VAL 2 -0.753 -10.707 -16.541 166 HG13 VAL 2 3HG1 VAL 2 -0.609 -10.262 -18.257 167 HG21 VAL 2 3HG2 VAL 2 0.578 -13.012 -19.046 168 HG22 VAL 2 1HG2 VAL 2 1.215 -11.483 -19.689 169 HG23 VAL 2 2HG2 VAL 2 2.293 -12.639 -18.874 170 H ASN 3 H ASN 3 1.328 -7.897 -16.912 171 HA ASN 3 HA ASN 3 1.403 -7.651 -14.068 172 HB2 ASN 3 2HB ASN 3 -0.256 -6.175 -16.156 173 HB3 ASN 3 3HB ASN 3 -0.074 -5.687 -14.473 174 HD21 ASN 3 2HD2 ASN 3 0.469 -3.830 -16.166 175 HD22 ASN 3 1HD2 ASN 3 2.190 -3.575 -16.248 176 H GLN 4 H GLN 4 0.094 -8.527 -12.553 177 HA GLN 4 HA GLN 4 -2.720 -9.123 -13.040 178 HB2 GLN 4 2HB GLN 4 -2.599 -11.505 -12.925 179 HB3 GLN 4 3HB GLN 4 -1.553 -10.973 -14.226 180 HG2 GLN 4 2HG GLN 4 0.395 -11.145 -12.506 181 HG3 GLN 4 3HG GLN 4 -0.763 -11.999 -11.483 182 HE21 GLN 4 1HE2 GLN 4 1.257 -12.211 -14.346 183 HE22 GLN 4 2HE2 GLN 4 0.933 -13.918 -14.654 184 H HIS 5 H HIS 5 -3.451 -10.631 -11.154 185 HA HIS 5 HA HIS 5 -2.684 -9.374 -8.575 186 HB2 HIS 5 2HB HIS 5 -4.787 -11.472 -9.259 187 HB3 HIS 5 3HB HIS 5 -4.531 -10.753 -7.672 188 HD2 HIS 5 HD2 HIS 5 -5.819 -9.823 -11.204 189 HE1 HIS 5 HE1 HIS 5 -7.213 -6.823 -8.527 190 HE2 HIS 5 HE2 HIS 5 -7.375 -7.726 -10.907 191 H LEU 6 H LEU 6 -1.296 -10.318 -7.151 192 HA LEU 6 HA LEU 6 -0.453 -13.176 -7.485 193 HB2 LEU 6 2HB LEU 6 1.366 -10.749 -7.381 194 HB3 LEU 6 3HB LEU 6 1.917 -12.409 -7.286 195 HG LEU 6 HG LEU 6 0.466 -11.257 -9.709 196 HD11 LEU 6 1HD1 LEU 6 2.420 -9.951 -9.472 197 HD12 LEU 6 2HD1 LEU 6 3.384 -11.340 -8.959 198 HD13 LEU 6 3HD1 LEU 6 2.845 -11.206 -10.654 199 HD21 LEU 6 3HD2 LEU 6 1.501 -13.209 -10.858 200 HD22 LEU 6 1HD2 LEU 6 2.177 -13.758 -9.318 201 HD23 LEU 6 2HD2 LEU 6 0.419 -13.736 -9.561 202 H CYS 7 H CYS 7 -0.132 -14.219 -5.587 203 HA CYS 7 HA CYS 7 0.618 -12.776 -3.153 204 HB2 CYS 7 2HB CYS 7 -1.966 -12.644 -3.606 205 HB3 CYS 7 3HB CYS 7 -1.986 -14.296 -3.013 206 H GLY 8 H GLY 8 1.410 -14.128 -1.519 207 HA2 GLY 8 HA2 GLY 8 2.510 -15.982 -0.652 208 HA3 GLY 8 HA3 GLY 8 1.220 -16.947 -1.384 209 H SER 9 H SER 9 2.107 -18.574 -2.480 210 HA SER 9 HA SER 9 4.687 -18.803 -3.542 211 HB2 SER 9 2HB SER 9 2.161 -20.124 -4.603 212 HB3 SER 9 3HB SER 9 3.826 -20.713 -4.761 213 HG SER 9 HG SER 9 2.690 -21.760 -3.039 214 H HIS 10 H HIS 10 1.740 -17.542 -5.202 215 HA HIS 10 HA HIS 10 2.936 -17.324 -7.794 216 HB2 HIS 10 2HB HIS 10 0.408 -16.704 -6.551 217 HB3 HIS 10 3HB HIS 10 0.957 -15.254 -7.364 218 HD2 HIS 10 HD2 HIS 10 -1.179 -17.997 -8.100 219 HE1 HIS 10 HE1 HIS 10 0.698 -17.319 -11.860 220 HE2 HIS 10 HE2 HIS 10 -1.259 -18.456 -10.688 221 H LEU 11 H LEU 11 2.995 -15.195 -4.992 222 HA LEU 11 HA LEU 11 4.165 -12.925 -6.393 223 HB2 LEU 11 2HB LEU 11 2.673 -12.977 -4.255 224 HB3 LEU 11 3HB LEU 11 4.134 -13.438 -3.392 225 HG LEU 11 HG LEU 11 5.194 -11.286 -4.087 226 HD11 LEU 11 1HD1 LEU 11 3.739 -9.507 -5.050 227 HD12 LEU 11 2HD1 LEU 11 3.940 -10.827 -6.196 228 HD13 LEU 11 3HD1 LEU 11 2.434 -10.682 -5.256 229 HD21 LEU 11 3HD2 LEU 11 2.439 -11.030 -2.775 230 HD22 LEU 11 1HD2 LEU 11 3.947 -11.488 -1.946 231 HD23 LEU 11 2HD2 LEU 11 3.756 -9.864 -2.624 232 H VAL 12 H VAL 12 5.429 -15.513 -4.275 233 HA VAL 12 HA VAL 12 8.221 -14.838 -4.461 234 HB VAL 12 HB VAL 12 6.864 -17.548 -4.141 235 HG11 VAL 12 1HG1 VAL 12 9.785 -16.798 -3.687 236 HG12 VAL 12 2HG1 VAL 12 9.025 -18.318 -3.163 237 HG13 VAL 12 3HG1 VAL 12 9.158 -17.957 -4.884 238 HG21 VAL 12 3HG2 VAL 12 7.360 -17.262 -1.756 239 HG22 VAL 12 1HG2 VAL 12 8.095 -15.674 -2.078 240 HG23 VAL 12 2HG2 VAL 12 6.359 -15.931 -2.332 241 H GLU 13 H GLU 13 6.175 -16.874 -6.582 242 HA GLU 13 HA GLU 13 8.165 -17.476 -8.535 243 HB2 GLU 13 2HB GLU 13 5.146 -17.287 -8.581 244 HB3 GLU 13 3HB GLU 13 6.039 -17.442 -10.088 245 HG2 GLU 13 2HG GLU 13 7.155 -19.478 -9.251 246 HG3 GLU 13 3HG GLU 13 6.286 -19.345 -7.720 247 H ALA 14 H ALA 14 5.834 -14.632 -8.498 248 HA ALA 14 HA ALA 14 6.855 -13.490 -10.852 249 HB1 ALA 14 3HB ALA 14 4.770 -12.891 -9.738 250 HB2 ALA 14 1HB ALA 14 5.674 -12.138 -8.392 251 HB3 ALA 14 2HB ALA 14 5.771 -11.446 -10.025 252 H LEU 15 H LEU 15 7.967 -12.867 -7.465 253 HA LEU 15 HA LEU 15 9.980 -10.972 -8.127 254 HB2 LEU 15 2HB LEU 15 9.463 -12.837 -5.817 255 HB3 LEU 15 3HB LEU 15 11.083 -12.197 -5.972 256 HG LEU 15 HG LEU 15 9.823 -10.851 -4.442 257 HD11 LEU 15 1HD1 LEU 15 11.551 -9.751 -5.875 258 HD12 LEU 15 2HD1 LEU 15 10.259 -9.199 -6.965 259 HD13 LEU 15 3HD1 LEU 15 10.295 -8.651 -5.285 260 HD21 LEU 15 3HD2 LEU 15 7.929 -9.395 -5.269 261 HD22 LEU 15 1HD2 LEU 15 7.856 -10.425 -6.713 262 HD23 LEU 15 2HD2 LEU 15 7.562 -11.118 -5.109 263 H TYR 16 H TYR 16 10.105 -14.525 -8.359 264 HA TYR 16 HA TYR 16 12.905 -14.586 -9.108 265 HB2 TYR 16 2HB TYR 16 11.705 -16.590 -8.337 266 HB3 TYR 16 3HB TYR 16 10.670 -16.521 -9.763 267 HD1 TYR 16 HD2 TYR 16 14.239 -16.939 -8.728 268 HD2 TYR 16 HD1 TYR 16 11.344 -17.305 -11.901 269 HE1 TYR 16 HE2 TYR 16 15.934 -18.086 -10.143 270 HE2 TYR 16 HE1 TYR 16 13.013 -18.485 -13.300 271 HH TYR 16 HH TYR 16 15.181 -19.263 -13.452 272 H LEU 17 H LEU 17 9.848 -14.383 -11.029 273 HA LEU 17 HA LEU 17 11.161 -14.463 -13.564 274 HB2 LEU 17 2HB LEU 17 8.518 -13.088 -12.881 275 HB3 LEU 17 3HB LEU 17 9.074 -13.549 -14.481 276 HG LEU 17 HG LEU 17 8.409 -15.463 -12.256 277 HD11 LEU 17 1HD1 LEU 17 6.407 -16.004 -13.590 278 HD12 LEU 17 2HD1 LEU 17 6.424 -14.294 -13.129 279 HD13 LEU 17 3HD1 LEU 17 6.864 -14.769 -14.784 280 HD21 LEU 17 3HD2 LEU 17 9.099 -16.016 -15.175 281 HD22 LEU 17 1HD2 LEU 17 10.092 -16.450 -13.767 282 HD23 LEU 17 2HD2 LEU 17 8.524 -17.227 -14.008 283 H VAL 18 H VAL 18 10.153 -11.623 -11.619 284 HA VAL 18 HA VAL 18 11.225 -9.718 -13.549 285 HB VAL 18 HB VAL 18 11.252 -8.177 -11.391 286 HG11 VAL 18 1HG1 VAL 18 9.834 -7.792 -13.341 287 HG12 VAL 18 2HG1 VAL 18 8.646 -8.961 -12.714 288 HG13 VAL 18 3HG1 VAL 18 8.996 -7.457 -11.818 289 HG21 VAL 18 3HG2 VAL 18 10.709 -10.175 -9.923 290 HG22 VAL 18 1HG2 VAL 18 9.903 -8.622 -9.652 291 HG23 VAL 18 2HG2 VAL 18 9.043 -9.920 -10.509 292 H CYS 19 H CYS 19 12.562 -11.045 -10.457 293 HA CYS 19 HA CYS 19 15.091 -9.530 -11.022 294 HB2 CYS 19 2HB CYS 19 13.462 -8.871 -9.149 295 HB3 CYS 19 3HB CYS 19 13.937 -10.370 -8.350 296 H GLY 20 H GLY 20 13.936 -12.749 -10.032 297 HA2 GLY 20 HA2 GLY 20 16.551 -13.587 -9.001 298 HA3 GLY 20 HA3 GLY 20 15.112 -14.605 -9.204 299 H GLU 21 H GLU 21 14.680 -14.309 -11.953 300 HA GLU 21 HA GLU 21 16.426 -16.257 -13.041 301 HB2 GLU 21 2HB GLU 21 14.028 -15.790 -13.658 302 HB3 GLU 21 3HB GLU 21 14.567 -14.353 -14.532 303 HG2 GLU 21 2HG GLU 21 15.937 -15.781 -16.032 304 HG3 GLU 21 3HG GLU 21 15.480 -17.212 -15.104 305 H ARG 22 H ARG 22 16.477 -12.710 -13.308 306 HA ARG 22 HA ARG 22 18.646 -12.673 -15.263 307 HB2 ARG 22 2HB ARG 22 18.497 -10.293 -15.151 308 HB3 ARG 22 3HB ARG 22 16.874 -10.968 -15.259 309 HG2 ARG 22 2HG ARG 22 16.506 -10.570 -12.863 310 HG3 ARG 22 3HG ARG 22 18.170 -9.965 -12.680 311 HD2 ARG 22 2HD ARG 22 17.650 -8.169 -14.348 312 HD3 ARG 22 3HD ARG 22 15.980 -8.765 -14.414 313 HE ARG 22 HE ARG 22 17.010 -8.049 -11.740 314 HH11 ARG 22 2HH1 ARG 22 15.193 -6.829 -14.556 315 HH12 ARG 22 1HH1 ARG 22 14.437 -5.581 -13.568 316 HH21 ARG 22 1HH2 ARG 22 15.914 -6.352 -10.620 317 HH22 ARG 22 2HH2 ARG 22 14.807 -5.344 -11.548 318 H GLY 23 H GLY 23 18.715 -13.378 -12.008 319 HA2 GLY 23 HA2 GLY 23 21.041 -11.841 -11.142 320 HA3 GLY 23 HA3 GLY 23 20.267 -13.189 -10.288 321 H HIS 24 H HIS 24 22.959 -12.941 -10.235 322 HA HIS 24 HA HIS 24 24.351 -14.410 -12.277 323 HB2 HIS 24 2HB HIS 24 26.246 -14.268 -10.773 324 HB3 HIS 24 3HB HIS 24 25.408 -12.723 -10.851 325 HD2 HIS 24 HD2 HIS 24 24.181 -11.861 -8.643 326 HE1 HIS 24 HE1 HIS 24 25.516 -14.923 -6.002 327 HE2 HIS 24 HE2 HIS 24 24.352 -12.659 -6.135 328 H PHE 25 H PHE 25 22.381 -15.544 -9.722 329 HA PHE 25 HA PHE 25 23.010 -18.357 -10.199 330 HB2 PHE 25 2HB PHE 25 24.745 -17.714 -8.563 331 HB3 PHE 25 3HB PHE 25 23.517 -17.047 -7.496 332 HD1 PHE 25 HD1 PHE 25 24.446 -20.267 -9.231 333 HD2 PHE 25 HD2 PHE 25 22.653 -18.410 -5.776 334 HE1 PHE 25 HE1 PHE 25 24.133 -22.498 -8.190 335 HE2 PHE 25 HE2 PHE 25 22.331 -20.634 -4.743 336 HZ PHE 25 HZ PHE 25 23.074 -22.690 -5.944 337 H TYR 26 H TYR 26 21.458 -19.786 -9.233 338 HA TYR 26 HA TYR 26 18.760 -18.854 -9.377 339 HB2 TYR 26 2HB TYR 26 19.567 -21.125 -9.975 340 HB3 TYR 26 3HB TYR 26 19.872 -21.456 -8.270 341 HD1 TYR 26 HD2 TYR 26 17.138 -20.301 -10.579 342 HD2 TYR 26 HD1 TYR 26 18.141 -22.523 -7.017 343 HE1 TYR 26 HE2 TYR 26 14.769 -20.975 -10.335 344 HE2 TYR 26 HE1 TYR 26 15.782 -23.256 -6.810 345 HH TYR 26 HH TYR 26 13.656 -23.153 -7.698 346 H THR 27 H THR 27 17.119 -18.789 -7.838 347 HA THR 27 HA THR 27 17.857 -18.769 -4.947 348 HB THR 27 HB THR 27 16.164 -16.969 -4.603 349 HG1 THR 27 HG1 THR 27 15.186 -17.234 -6.681 350 HG21 THR 27 1HG2 THR 27 17.660 -15.148 -5.231 351 HG22 THR 27 2HG2 THR 27 18.619 -16.518 -4.640 352 HG23 THR 27 3HG2 THR 27 18.521 -16.190 -6.382 353 HA PRO 28 HA PRO 28 14.623 -21.823 -5.371 354 HB2 PRO 28 2HB PRO 28 14.712 -23.006 -2.931 355 HB3 PRO 28 3HB PRO 28 16.047 -23.158 -4.112 356 HG2 PRO 28 2HG PRO 28 15.837 -21.201 -1.796 357 HG3 PRO 28 3HG PRO 28 17.207 -22.285 -2.203 358 HD2 PRO 28 2HD PRO 28 17.143 -19.673 -2.993 359 HD3 PRO 28 3HD PRO 28 17.845 -20.947 -4.037 360 H LYS 29 H LYS 29 12.526 -22.354 -4.582 361 HA LYS 29 HA LYS 29 11.107 -19.943 -3.609 362 HB2 LYS 29 2HB LYS 29 9.834 -22.407 -4.817 363 HB3 LYS 29 3HB LYS 29 9.219 -20.759 -4.780 364 HG2 LYS 29 2HG LYS 29 11.510 -21.839 -6.480 365 HG3 LYS 29 3HG LYS 29 9.898 -21.429 -7.034 366 HD2 LYS 29 2HD LYS 29 10.273 -19.087 -6.838 367 HD3 LYS 29 3HD LYS 29 11.673 -19.302 -5.787 368 HE2 LYS 29 2HE LYS 29 12.433 -18.643 -7.981 369 HE3 LYS 29 3HE LYS 29 12.998 -20.260 -7.588 370 HZ1 LYS 29 HZ1 LYS 29 12.158 -20.100 -9.866 371 HZ2 LYS 29 HZ2 LYS 29 11.284 -21.178 -9.012 372 HZ3 LYS 29 HZ3 LYS 29 10.662 -19.695 -9.338 373 H THR 30 H THR 30 9.772 -19.893 -1.852 374 HA THR 30 HA THR 30 8.884 -22.152 -0.309 375 HB THR 30 HB THR 30 11.220 -22.299 0.318 376 HG1 THR 30 HG1 THR 30 10.860 -22.283 2.514 377 HG21 THR 30 1HG2 THR 30 10.992 -19.525 1.548 378 HG22 THR 30 2HG2 THR 30 12.375 -20.632 1.630 379 HG23 THR 30 3HG2 THR 30 11.917 -19.915 0.081 Start of MODEL 29 1 H1 GLY 1 1H GLY 1 4.563 -0.709 0.830 2 H2 GLY 1 2H GLY 1 3.254 -1.224 -0.015 3 H3 GLY 1 3H GLY 1 4.678 -0.996 -0.783 4 HA2 GLY 1 HA2 GLY 1 5.708 -2.794 0.462 5 HA3 GLY 1 HA3 GLY 1 4.165 -3.039 1.288 6 H ILE 2 H ILE 2 5.664 -4.950 -0.375 7 HA ILE 2 HA ILE 2 4.605 -5.057 -3.019 8 HB ILE 2 HB ILE 2 6.727 -6.045 -2.369 9 HG12 ILE 2 2HG1 ILE 2 6.647 -8.206 -3.513 10 HG13 ILE 2 3HG1 ILE 2 4.883 -8.195 -3.440 11 HG21 ILE 2 1HG2 ILE 2 5.246 -8.267 -0.937 12 HG22 ILE 2 2HG2 ILE 2 6.994 -8.088 -1.142 13 HG23 ILE 2 3HG2 ILE 2 6.122 -6.942 -0.126 14 HD11 ILE 2 3HD1 ILE 2 6.664 -6.286 -4.986 15 HD12 ILE 2 1HD1 ILE 2 5.652 -7.578 -5.643 16 HD13 ILE 2 2HD1 ILE 2 4.886 -6.158 -4.910 17 H VAL 3 H VAL 3 3.424 -6.711 -0.091 18 HA VAL 3 HA VAL 3 1.509 -8.352 -1.571 19 HB VAL 3 HB VAL 3 1.738 -7.736 1.402 20 HG11 VAL 3 1HG1 VAL 3 0.245 -9.647 1.800 21 HG12 VAL 3 2HG1 VAL 3 -0.608 -8.417 0.868 22 HG13 VAL 3 3HG1 VAL 3 0.025 -9.873 0.058 23 HG21 VAL 3 3HG2 VAL 3 3.634 -9.055 0.509 24 HG22 VAL 3 1HG2 VAL 3 2.611 -10.067 1.528 25 HG23 VAL 3 2HG2 VAL 3 2.500 -10.204 -0.238 26 H GLU 4 H GLU 4 1.343 -5.316 0.298 27 HA GLU 4 HA GLU 4 -1.458 -4.855 -0.386 28 HB2 GLU 4 2HB GLU 4 -1.157 -2.707 0.785 29 HB3 GLU 4 3HB GLU 4 -0.832 -4.129 1.750 30 HG2 GLU 4 2HG GLU 4 1.439 -2.611 0.442 31 HG3 GLU 4 3HG GLU 4 0.717 -2.054 1.944 32 H GLN 5 H GLN 5 1.056 -4.819 -2.464 33 HA GLN 5 HA GLN 5 -0.652 -3.050 -4.188 34 HB2 GLN 5 2HB GLN 5 2.234 -3.945 -4.557 35 HB3 GLN 5 3HB GLN 5 1.260 -3.188 -5.820 36 HG2 GLN 5 2HG GLN 5 1.939 -1.889 -3.141 37 HG3 GLN 5 3HG GLN 5 2.779 -1.604 -4.657 38 HE21 GLN 5 2HE2 GLN 5 -0.394 -1.138 -2.984 39 HE22 GLN 5 1HE2 GLN 5 -0.865 0.196 -4.032 40 H CYS 6 H CYS 6 1.265 -6.122 -4.384 41 HA CYS 6 HA CYS 6 -0.191 -6.931 -6.730 42 HB2 CYS 6 2HB CYS 6 1.746 -8.325 -4.868 43 HB3 CYS 6 3HB CYS 6 1.137 -9.026 -6.356 44 H CYS 7 H CYS 7 -0.485 -8.049 -3.334 45 HA CYS 7 HA CYS 7 -2.313 -10.189 -4.077 46 HB2 CYS 7 2HB CYS 7 -0.774 -10.127 -2.069 47 HB3 CYS 7 3HB CYS 7 -1.905 -8.994 -1.324 48 H THR 8 H THR 8 -2.773 -6.852 -3.157 49 HA THR 8 HA THR 8 -5.691 -7.142 -2.802 50 HB THR 8 HB THR 8 -4.298 -5.699 -1.318 51 HG1 THR 8 HG1 THR 8 -6.495 -5.315 -1.497 52 HG21 THR 8 1HG2 THR 8 -3.608 -3.487 -2.095 53 HG22 THR 8 2HG2 THR 8 -2.776 -4.748 -3.024 54 HG23 THR 8 3HG2 THR 8 -4.136 -3.860 -3.749 55 H SER 9 H SER 9 -3.468 -5.916 -5.331 56 HA SER 9 HA SER 9 -5.765 -5.735 -7.157 57 HB2 SER 9 2HB SER 9 -5.411 -3.505 -5.970 58 HB3 SER 9 3HB SER 9 -3.938 -3.378 -6.969 59 HG SER 9 HG SER 9 -5.878 -2.420 -7.914 60 H ILE 10 H ILE 10 -4.754 -4.658 -9.315 61 HA ILE 10 HA ILE 10 -2.845 -6.538 -10.464 62 HB ILE 10 HB ILE 10 -3.812 -3.799 -11.399 63 HG12 ILE 10 2HG1 ILE 10 -5.680 -5.399 -11.256 64 HG13 ILE 10 3HG1 ILE 10 -5.335 -4.886 -12.899 65 HG21 ILE 10 1HG2 ILE 10 -2.219 -5.954 -12.855 66 HG22 ILE 10 2HG2 ILE 10 -3.032 -4.609 -13.684 67 HG23 ILE 10 3HG2 ILE 10 -1.727 -4.278 -12.540 68 HD11 ILE 10 3HD1 ILE 10 -5.829 -7.311 -12.736 69 HD12 ILE 10 1HD1 ILE 10 -4.209 -7.002 -13.395 70 HD13 ILE 10 2HD1 ILE 10 -4.405 -7.514 -11.696 71 H CYS 11 H CYS 11 -0.671 -6.508 -10.341 72 HA CYS 11 HA CYS 11 0.659 -3.861 -9.964 73 HB2 CYS 11 2HB CYS 11 2.354 -4.777 -8.610 74 HB3 CYS 11 3HB CYS 11 0.808 -5.209 -7.897 75 H SER 12 H SER 12 2.510 -3.473 -11.070 76 HA SER 12 HA SER 12 3.045 -5.216 -13.452 77 HB2 SER 12 2HB SER 12 3.585 -2.260 -13.024 78 HB3 SER 12 3HB SER 12 3.882 -3.182 -14.503 79 HG SER 12 HG SER 12 1.366 -2.580 -13.293 80 H LEU 13 H LEU 13 5.231 -5.319 -14.295 81 HA LEU 13 HA LEU 13 6.990 -6.398 -12.380 82 HB2 LEU 13 2HB LEU 13 8.615 -6.448 -14.184 83 HB3 LEU 13 3HB LEU 13 7.088 -7.175 -14.621 84 HG LEU 13 HG LEU 13 7.914 -4.379 -15.515 85 HD11 LEU 13 1HD1 LEU 13 8.624 -5.419 -17.623 86 HD12 LEU 13 2HD1 LEU 13 9.578 -6.037 -16.269 87 HD13 LEU 13 3HD1 LEU 13 8.279 -7.034 -16.963 88 HD21 LEU 13 3HD2 LEU 13 5.787 -6.285 -16.568 89 HD22 LEU 13 1HD2 LEU 13 5.533 -4.663 -15.877 90 HD23 LEU 13 2HD2 LEU 13 6.342 -4.835 -17.422 91 H TYR 14 H TYR 14 7.034 -3.233 -13.939 92 HA TYR 14 HA TYR 14 9.540 -2.407 -13.021 93 HB2 TYR 14 2HB TYR 14 8.865 -0.221 -13.793 94 HB3 TYR 14 3HB TYR 14 8.300 -1.477 -14.909 95 HD1 TYR 14 HD1 TYR 14 7.196 0.880 -12.205 96 HD2 TYR 14 HD2 TYR 14 6.007 -1.610 -15.522 97 HE1 TYR 14 HE1 TYR 14 4.912 1.843 -12.102 98 HE2 TYR 14 HE2 TYR 14 3.727 -0.617 -15.444 99 HH TYR 14 HH TYR 14 2.801 1.864 -13.021 100 H GLN 15 H GLN 15 6.745 -2.731 -11.140 101 HA GLN 15 HA GLN 15 7.706 -0.746 -9.098 102 HB2 GLN 15 2HB GLN 15 5.336 -0.554 -8.359 103 HB3 GLN 15 3HB GLN 15 5.666 0.125 -9.958 104 HG2 GLN 15 2HG GLN 15 4.682 -1.814 -11.052 105 HG3 GLN 15 3HG GLN 15 4.447 -2.626 -9.490 106 HE21 GLN 15 2HE2 GLN 15 3.605 0.776 -9.325 107 HE22 GLN 15 1HE2 GLN 15 1.885 0.490 -9.521 108 H LEU 16 H LEU 16 6.520 -4.047 -9.745 109 HA LEU 16 HA LEU 16 6.669 -4.879 -6.995 110 HB2 LEU 16 2HB LEU 16 5.641 -6.669 -7.798 111 HB3 LEU 16 3HB LEU 16 5.537 -5.821 -9.299 112 HG LEU 16 HG LEU 16 7.864 -6.916 -9.838 113 HD11 LEU 16 1HD1 LEU 16 6.810 -8.569 -7.511 114 HD12 LEU 16 2HD1 LEU 16 7.877 -9.267 -8.726 115 HD13 LEU 16 3HD1 LEU 16 8.445 -7.911 -7.752 116 HD21 LEU 16 3HD2 LEU 16 5.405 -8.703 -9.735 117 HD22 LEU 16 1HD2 LEU 16 5.685 -7.459 -10.969 118 HD23 LEU 16 2HD2 LEU 16 6.815 -8.820 -10.828 119 H GLU 17 H GLU 17 8.941 -4.800 -9.674 120 HA GLU 17 HA GLU 17 11.220 -6.170 -8.772 121 HB2 GLU 17 2HB GLU 17 10.792 -3.680 -10.456 122 HB3 GLU 17 3HB GLU 17 12.419 -4.033 -9.905 123 HG2 GLU 17 2HG GLU 17 12.381 -6.234 -10.940 124 HG3 GLU 17 3HG GLU 17 10.746 -5.936 -11.548 125 H ASN 18 H ASN 18 10.046 -3.011 -7.853 126 HA ASN 18 HA ASN 18 12.396 -1.967 -6.594 127 HB2 ASN 18 2HB ASN 18 9.499 -1.267 -6.759 128 HB3 ASN 18 3HB ASN 18 10.302 -0.688 -5.330 129 HD21 ASN 18 2HD2 ASN 18 10.340 -0.556 -8.929 130 HD22 ASN 18 1HD2 ASN 18 11.273 0.918 -8.990 131 H TYR 19 H TYR 19 10.130 -4.343 -5.438 132 HA TYR 19 HA TYR 19 10.867 -4.005 -2.602 133 HB2 TYR 19 2HB TYR 19 8.977 -5.889 -4.059 134 HB3 TYR 19 3HB TYR 19 9.166 -5.781 -2.315 135 HD1 TYR 19 HD2 TYR 19 8.670 -3.645 -1.112 136 HD2 TYR 19 HD1 TYR 19 7.607 -4.212 -5.263 137 HE1 TYR 19 HE2 TYR 19 7.067 -1.755 -0.962 138 HE2 TYR 19 HE1 TYR 19 5.835 -2.474 -5.031 139 HH TYR 19 HH TYR 19 4.912 -0.850 -3.681 140 H CYS 20 H CYS 20 12.279 -5.653 -5.219 141 HA CYS 20 HA CYS 20 13.245 -7.999 -3.759 142 HB2 CYS 20 2HB CYS 20 13.051 -7.752 -6.275 143 HB3 CYS 20 3HB CYS 20 14.430 -6.652 -6.208 144 H ASN 21 H ASN 21 14.226 -4.657 -3.976 145 HA ASN 21 HA ASN 21 16.936 -4.956 -2.941 146 HB2 ASN 21 2HB ASN 21 16.312 -3.144 -4.486 147 HB3 ASN 21 3HB ASN 21 15.107 -2.545 -3.349 148 HD21 ASN 21 2HD2 ASN 21 16.044 -1.992 -1.113 149 HD22 ASN 21 1HD2 ASN 21 17.551 -1.059 -1.152 150 H1 PHE 1 1H PHE 1 5.941 -11.477 -19.853 151 H2 PHE 1 2H PHE 1 7.352 -11.004 -19.165 152 H3 PHE 1 3H PHE 1 6.303 -9.884 -19.761 153 HA PHE 1 HA PHE 1 5.807 -11.663 -17.475 154 HB2 PHE 1 2HB PHE 1 7.469 -9.767 -17.106 155 HB3 PHE 1 3HB PHE 1 6.161 -8.639 -17.422 156 HD1 PHE 1 HD1 PHE 1 7.352 -11.367 -15.157 157 HD2 PHE 1 HD2 PHE 1 4.553 -8.114 -15.666 158 HE1 PHE 1 HE1 PHE 1 6.645 -11.594 -12.788 159 HE2 PHE 1 HE2 PHE 1 3.877 -8.335 -13.293 160 HZ PHE 1 HZ PHE 1 4.883 -10.101 -11.867 161 H VAL 2 H VAL 2 3.775 -11.075 -16.258 162 HA VAL 2 HA VAL 2 1.638 -9.900 -18.013 163 HB VAL 2 HB VAL 2 1.336 -12.247 -16.087 164 HG11 VAL 2 1HG1 VAL 2 -0.999 -12.355 -16.965 165 HG12 VAL 2 2HG1 VAL 2 -0.700 -10.839 -16.114 166 HG13 VAL 2 3HG1 VAL 2 -0.713 -10.865 -17.889 167 HG21 VAL 2 3HG2 VAL 2 0.748 -13.556 -18.120 168 HG22 VAL 2 1HG2 VAL 2 1.164 -12.157 -19.133 169 HG23 VAL 2 2HG2 VAL 2 2.415 -12.979 -18.174 170 H ASN 3 H ASN 3 0.714 -8.157 -17.100 171 HA ASN 3 HA ASN 3 1.186 -7.494 -14.265 172 HB2 ASN 3 2HB ASN 3 -0.467 -6.069 -16.381 173 HB3 ASN 3 3HB ASN 3 -0.077 -5.447 -14.784 174 HD21 ASN 3 1HD2 ASN 3 0.572 -4.214 -17.374 175 HD22 ASN 3 2HD2 ASN 3 2.322 -4.109 -17.433 176 H GLN 4 H GLN 4 -0.049 -8.445 -12.718 177 HA GLN 4 HA GLN 4 -2.953 -8.797 -13.027 178 HB2 GLN 4 2HB GLN 4 -2.804 -11.261 -12.640 179 HB3 GLN 4 3HB GLN 4 -2.229 -10.772 -14.218 180 HG2 GLN 4 2HG GLN 4 0.050 -11.031 -13.621 181 HG3 GLN 4 3HG GLN 4 -0.308 -11.137 -11.905 182 HE21 GLN 4 2HE2 GLN 4 -1.549 -13.075 -11.138 183 HE22 GLN 4 1HE2 GLN 4 -1.162 -14.564 -11.981 184 H HIS 5 H HIS 5 -3.666 -10.260 -11.073 185 HA HIS 5 HA HIS 5 -2.657 -9.153 -8.535 186 HB2 HIS 5 2HB HIS 5 -4.777 -11.262 -9.136 187 HB3 HIS 5 3HB HIS 5 -4.431 -10.562 -7.557 188 HD2 HIS 5 HD2 HIS 5 -5.886 -9.525 -11.016 189 HE1 HIS 5 HE1 HIS 5 -7.226 -6.664 -8.172 190 HE2 HIS 5 HE2 HIS 5 -7.444 -7.458 -10.587 191 H LEU 6 H LEU 6 -1.356 -10.260 -7.106 192 HA LEU 6 HA LEU 6 -0.505 -13.071 -7.591 193 HB2 LEU 6 2HB LEU 6 1.377 -10.681 -7.561 194 HB3 LEU 6 3HB LEU 6 1.900 -12.351 -7.438 195 HG LEU 6 HG LEU 6 0.383 -11.236 -9.831 196 HD11 LEU 6 1HD1 LEU 6 2.639 -11.291 -10.938 197 HD12 LEU 6 2HD1 LEU 6 2.393 -9.997 -9.744 198 HD13 LEU 6 3HD1 LEU 6 3.331 -11.433 -9.296 199 HD21 LEU 6 3HD2 LEU 6 1.303 -13.204 -10.990 200 HD22 LEU 6 1HD2 LEU 6 2.082 -13.750 -9.493 201 HD23 LEU 6 2HD2 LEU 6 0.309 -13.718 -9.614 202 H CYS 7 H CYS 7 -0.208 -14.152 -5.711 203 HA CYS 7 HA CYS 7 0.577 -12.745 -3.257 204 HB2 CYS 7 2HB CYS 7 -1.979 -12.529 -3.674 205 HB3 CYS 7 3HB CYS 7 -2.062 -14.218 -3.194 206 H GLY 8 H GLY 8 1.350 -14.125 -1.628 207 HA2 GLY 8 HA2 GLY 8 2.379 -16.014 -0.757 208 HA3 GLY 8 HA3 GLY 8 1.076 -16.937 -1.516 209 H SER 9 H SER 9 1.911 -18.563 -2.631 210 HA SER 9 HA SER 9 4.553 -18.808 -3.632 211 HB2 SER 9 2HB SER 9 2.860 -20.634 -3.190 212 HB3 SER 9 3HB SER 9 2.086 -20.203 -4.726 213 HG SER 9 HG SER 9 3.627 -21.923 -4.942 214 H HIS 10 H HIS 10 1.618 -17.561 -5.318 215 HA HIS 10 HA HIS 10 2.840 -17.288 -7.903 216 HB2 HIS 10 2HB HIS 10 0.309 -16.628 -6.626 217 HB3 HIS 10 3HB HIS 10 0.876 -15.237 -7.530 218 HD2 HIS 10 HD2 HIS 10 -1.181 -18.163 -8.053 219 HE1 HIS 10 HE1 HIS 10 0.477 -17.463 -11.911 220 HE2 HIS 10 HE2 HIS 10 -1.332 -18.713 -10.622 221 H LEU 11 H LEU 11 2.870 -15.203 -5.056 222 HA LEU 11 HA LEU 11 4.080 -12.923 -6.409 223 HB2 LEU 11 2HB LEU 11 2.599 -12.965 -4.266 224 HB3 LEU 11 3HB LEU 11 4.042 -13.495 -3.417 225 HG LEU 11 HG LEU 11 5.175 -11.368 -4.054 226 HD11 LEU 11 1HD1 LEU 11 2.471 -10.718 -5.323 227 HD12 LEU 11 2HD1 LEU 11 3.733 -9.522 -4.985 228 HD13 LEU 11 3HD1 LEU 11 4.035 -10.798 -6.165 229 HD21 LEU 11 3HD2 LEU 11 3.793 -9.929 -2.575 230 HD22 LEU 11 1HD2 LEU 11 2.410 -11.009 -2.790 231 HD23 LEU 11 2HD2 LEU 11 3.867 -11.578 -1.940 232 H VAL 12 H VAL 12 5.301 -15.554 -4.311 233 HA VAL 12 HA VAL 12 8.087 -14.889 -4.450 234 HB VAL 12 HB VAL 12 6.735 -17.606 -4.183 235 HG11 VAL 12 1HG1 VAL 12 9.648 -16.842 -3.699 236 HG12 VAL 12 2HG1 VAL 12 8.897 -18.373 -3.195 237 HG13 VAL 12 3HG1 VAL 12 9.040 -17.994 -4.912 238 HG21 VAL 12 3HG2 VAL 12 7.227 -17.346 -1.787 239 HG22 VAL 12 1HG2 VAL 12 7.948 -15.748 -2.092 240 HG23 VAL 12 2HG2 VAL 12 6.214 -16.017 -2.354 241 H GLU 13 H GLU 13 6.085 -16.918 -6.631 242 HA GLU 13 HA GLU 13 8.097 -17.503 -8.551 243 HB2 GLU 13 2HB GLU 13 5.082 -17.297 -8.656 244 HB3 GLU 13 3HB GLU 13 5.995 -17.391 -10.159 245 HG2 GLU 13 2HG GLU 13 7.140 -19.436 -9.345 246 HG3 GLU 13 3HG GLU 13 6.145 -19.402 -7.882 247 H ALA 14 H ALA 14 5.838 -14.604 -8.509 248 HA ALA 14 HA ALA 14 6.941 -13.460 -10.833 249 HB1 ALA 14 3HB ALA 14 4.859 -12.831 -9.757 250 HB2 ALA 14 1HB ALA 14 5.741 -12.105 -8.383 251 HB3 ALA 14 2HB ALA 14 5.896 -11.404 -10.010 252 H LEU 15 H LEU 15 7.994 -12.923 -7.410 253 HA LEU 15 HA LEU 15 10.102 -11.112 -8.015 254 HB2 LEU 15 2HB LEU 15 9.479 -12.968 -5.721 255 HB3 LEU 15 3HB LEU 15 11.110 -12.352 -5.842 256 HG LEU 15 HG LEU 15 9.871 -10.991 -4.331 257 HD11 LEU 15 1HD1 LEU 15 11.596 -9.893 -5.770 258 HD12 LEU 15 2HD1 LEU 15 10.299 -9.330 -6.847 259 HD13 LEU 15 3HD1 LEU 15 10.348 -8.791 -5.166 260 HD21 LEU 15 3HD2 LEU 15 7.604 -11.259 -5.011 261 HD22 LEU 15 1HD2 LEU 15 7.977 -9.535 -5.115 262 HD23 LEU 15 2HD2 LEU 15 7.904 -10.516 -6.593 263 H TYR 16 H TYR 16 10.106 -14.676 -8.212 264 HA TYR 16 HA TYR 16 12.912 -14.898 -8.873 265 HB2 TYR 16 2HB TYR 16 11.531 -16.842 -8.212 266 HB3 TYR 16 3HB TYR 16 10.578 -16.658 -9.684 267 HD1 TYR 16 HD1 TYR 16 13.997 -17.488 -8.441 268 HD2 TYR 16 HD2 TYR 16 11.319 -17.397 -11.821 269 HE1 TYR 16 HE1 TYR 16 15.641 -18.795 -9.782 270 HE2 TYR 16 HE2 TYR 16 12.947 -18.702 -13.160 271 HH TYR 16 HH TYR 16 15.011 -19.735 -13.192 272 H LEU 17 H LEU 17 9.971 -14.470 -10.941 273 HA LEU 17 HA LEU 17 11.400 -14.536 -13.423 274 HB2 LEU 17 2HB LEU 17 8.814 -13.034 -12.798 275 HB3 LEU 17 3HB LEU 17 9.433 -13.448 -14.385 276 HG LEU 17 HG LEU 17 8.515 -15.420 -12.299 277 HD11 LEU 17 1HD1 LEU 17 6.669 -14.105 -13.244 278 HD12 LEU 17 2HD1 LEU 17 7.195 -14.524 -14.889 279 HD13 LEU 17 3HD1 LEU 17 6.591 -15.786 -13.793 280 HD21 LEU 17 3HD2 LEU 17 8.656 -17.112 -14.120 281 HD22 LEU 17 1HD2 LEU 17 9.377 -15.891 -15.190 282 HD23 LEU 17 2HD2 LEU 17 10.246 -16.443 -13.741 283 H VAL 18 H VAL 18 10.335 -11.690 -11.497 284 HA VAL 18 HA VAL 18 11.555 -9.801 -13.320 285 HB VAL 18 HB VAL 18 11.421 -8.237 -11.204 286 HG11 VAL 18 1HG1 VAL 18 9.159 -7.603 -11.713 287 HG12 VAL 18 2HG1 VAL 18 10.058 -7.939 -13.203 288 HG13 VAL 18 3HG1 VAL 18 8.888 -9.135 -12.590 289 HG21 VAL 18 3HG2 VAL 18 9.234 -10.002 -10.340 290 HG22 VAL 18 1HG2 VAL 18 10.893 -10.234 -9.721 291 HG23 VAL 18 2HG2 VAL 18 10.066 -8.686 -9.488 292 H CYS 19 H CYS 19 12.730 -11.162 -10.183 293 HA CYS 19 HA CYS 19 15.198 -9.496 -10.494 294 HB2 CYS 19 2HB CYS 19 13.483 -9.207 -8.601 295 HB3 CYS 19 3HB CYS 19 14.075 -10.745 -7.974 296 H GLY 20 H GLY 20 14.261 -12.861 -10.324 297 HA2 GLY 20 HA2 GLY 20 17.008 -13.773 -9.586 298 HA3 GLY 20 HA3 GLY 20 15.551 -14.774 -9.784 299 H GLU 21 H GLU 21 14.637 -14.387 -12.183 300 HA GLU 21 HA GLU 21 16.607 -15.604 -13.953 301 HB2 GLU 21 2HB GLU 21 14.211 -16.308 -13.527 302 HB3 GLU 21 3HB GLU 21 13.675 -14.926 -14.459 303 HG2 GLU 21 2HG GLU 21 15.519 -17.142 -15.475 304 HG3 GLU 21 3HG GLU 21 13.767 -17.162 -15.648 305 H ARG 22 H ARG 22 14.753 -12.570 -13.851 306 HA ARG 22 HA ARG 22 14.942 -10.554 -14.696 307 HB2 ARG 22 2HB ARG 22 17.808 -11.433 -14.922 308 HB3 ARG 22 3HB ARG 22 17.250 -9.746 -14.822 309 HG2 ARG 22 2HG ARG 22 16.422 -10.168 -12.533 310 HG3 ARG 22 3HG ARG 22 16.969 -11.843 -12.650 311 HD2 ARG 22 2HD ARG 22 18.724 -10.881 -11.500 312 HD3 ARG 22 3HD ARG 22 19.311 -10.909 -13.150 313 HE ARG 22 HE ARG 22 19.075 -8.572 -13.310 314 HH11 ARG 22 1HH1 ARG 22 17.911 -9.638 -10.132 315 HH12 ARG 22 2HH1 ARG 22 18.019 -8.032 -9.464 316 HH21 ARG 22 1HH2 ARG 22 19.151 -6.529 -12.383 317 HH22 ARG 22 2HH2 ARG 22 18.676 -6.298 -10.728 318 H GLY 23 H GLY 23 14.897 -12.887 -16.934 319 HA2 GLY 23 HA2 GLY 23 16.221 -11.696 -19.210 320 HA3 GLY 23 HA3 GLY 23 15.110 -13.096 -19.182 321 H HIS 24 H HIS 24 13.107 -11.232 -17.890 322 HA HIS 24 HA HIS 24 12.295 -9.554 -20.183 323 HB2 HIS 24 2HB HIS 24 10.083 -10.555 -20.304 324 HB3 HIS 24 3HB HIS 24 11.339 -11.736 -20.644 325 HD2 HIS 24 HD2 HIS 24 11.920 -13.505 -18.536 326 HE1 HIS 24 HE1 HIS 24 8.065 -13.167 -16.778 327 HE2 HIS 24 HE2 HIS 24 10.214 -14.536 -16.836 328 H PHE 25 H PHE 25 10.523 -7.395 -17.911 329 HA PHE 25 HA PHE 25 10.785 -8.007 -20.747 330 HB2 PHE 25 2HB PHE 25 9.146 -6.392 -19.889 331 HB3 PHE 25 3HB PHE 25 10.448 -5.396 -19.234 332 HD1 PHE 25 HD2 PHE 25 9.150 -6.824 -22.461 333 HD2 PHE 25 HD1 PHE 25 11.441 -3.701 -20.560 334 HE1 PHE 25 HE2 PHE 25 9.365 -5.652 -24.636 335 HE2 PHE 25 HE1 PHE 25 11.638 -2.524 -22.734 336 HZ PHE 25 HZ PHE 25 10.606 -3.498 -24.779 337 H TYR 26 H TYR 26 12.411 -7.368 -22.170 338 HA TYR 26 HA TYR 26 14.698 -5.780 -21.177 339 HB2 TYR 26 2HB TYR 26 15.292 -8.206 -21.114 340 HB3 TYR 26 3HB TYR 26 14.919 -8.322 -22.833 341 HD1 TYR 26 HD1 TYR 26 16.998 -6.433 -20.376 342 HD2 TYR 26 HD2 TYR 26 16.636 -7.811 -24.441 343 HE1 TYR 26 HE1 TYR 26 19.303 -5.613 -20.851 344 HE2 TYR 26 HE2 TYR 26 18.970 -7.084 -24.897 345 HH TYR 26 HH TYR 26 20.987 -5.446 -22.423 346 H THR 27 H THR 27 15.690 -4.550 -22.718 347 HA THR 27 HA THR 27 14.837 -4.634 -25.527 348 HB THR 27 HB THR 27 13.344 -2.989 -24.743 349 HG1 THR 27 HG1 THR 27 14.082 -1.293 -26.042 350 HG21 THR 27 1HG2 THR 27 14.009 -0.886 -23.678 351 HG22 THR 27 2HG2 THR 27 14.402 -2.254 -22.634 352 HG23 THR 27 3HG2 THR 27 15.690 -1.441 -23.556 353 HA PRO 28 HA PRO 28 19.167 -4.759 -25.390 354 HB2 PRO 28 2HB PRO 28 19.828 -5.187 -27.963 355 HB3 PRO 28 3HB PRO 28 18.763 -6.314 -27.087 356 HG2 PRO 28 2HG PRO 28 17.905 -4.033 -28.904 357 HG3 PRO 28 3HG PRO 28 17.409 -5.756 -28.992 358 HD2 PRO 28 2HD PRO 28 15.897 -3.905 -27.677 359 HD3 PRO 28 3HD PRO 28 16.078 -5.575 -27.057 360 H LYS 29 H LYS 29 21.138 -3.781 -25.811 361 HA LYS 29 HA LYS 29 21.273 -1.140 -27.110 362 HB2 LYS 29 2HB LYS 29 21.934 0.000 -25.065 363 HB3 LYS 29 3HB LYS 29 20.319 -0.673 -24.895 364 HG2 LYS 29 2HG LYS 29 21.210 -2.579 -23.589 365 HG3 LYS 29 3HG LYS 29 22.851 -1.964 -23.763 366 HD2 LYS 29 2HD LYS 29 20.540 -0.594 -22.328 367 HD3 LYS 29 3HD LYS 29 21.877 -1.433 -21.554 368 HE2 LYS 29 2HE LYS 29 22.092 1.112 -23.232 369 HE3 LYS 29 3HE LYS 29 22.123 1.028 -21.472 370 HZ1 LYS 29 HZ1 LYS 29 24.165 -0.293 -21.632 371 HZ2 LYS 29 HZ2 LYS 29 24.158 -0.175 -23.266 372 HZ3 LYS 29 HZ3 LYS 29 24.357 1.160 -22.350 373 H THR 30 H THR 30 22.587 -3.801 -27.382 374 HA THR 30 HA THR 30 25.401 -3.523 -26.652 375 HB THR 30 HB THR 30 25.638 -5.559 -28.151 376 HG1 THR 30 HG1 THR 30 23.716 -6.567 -28.737 377 HG21 THR 30 1HG2 THR 30 25.364 -5.723 -25.692 378 HG22 THR 30 2HG2 THR 30 23.598 -5.736 -25.884 379 HG23 THR 30 3HG2 THR 30 24.580 -7.069 -26.533 Start of MODEL 30 1 H1 GLY 1 1H GLY 1 7.073 -4.190 3.383 2 H2 GLY 1 2H GLY 1 7.955 -4.286 2.003 3 H3 GLY 1 3H GLY 1 7.402 -5.651 2.716 4 HA2 GLY 1 HA2 GLY 1 5.119 -5.042 2.275 5 HA3 GLY 1 HA3 GLY 1 5.710 -3.556 1.509 6 H ILE 2 H ILE 2 4.104 -5.211 0.224 7 HA ILE 2 HA ILE 2 4.485 -5.135 -2.305 8 HB ILE 2 HB ILE 2 6.558 -6.400 -2.276 9 HG12 ILE 2 2HG1 ILE 2 6.227 -7.919 -4.072 10 HG13 ILE 2 3HG1 ILE 2 4.508 -8.103 -3.701 11 HG21 ILE 2 1HG2 ILE 2 6.778 -8.635 -1.547 12 HG22 ILE 2 2HG2 ILE 2 5.762 -7.866 -0.298 13 HG23 ILE 2 3HG2 ILE 2 5.021 -8.903 -1.514 14 HD11 ILE 2 3HD1 ILE 2 4.857 -6.702 -5.677 15 HD12 ILE 2 1HD1 ILE 2 4.099 -5.760 -4.385 16 HD13 ILE 2 2HD1 ILE 2 5.829 -5.569 -4.724 17 H VAL 3 H VAL 3 3.502 -7.513 0.123 18 HA VAL 3 HA VAL 3 1.393 -8.745 -1.376 19 HB VAL 3 HB VAL 3 1.775 -8.487 1.636 20 HG11 VAL 3 1HG1 VAL 3 0.265 -10.433 1.864 21 HG12 VAL 3 2HG1 VAL 3 -0.597 -9.058 1.176 22 HG13 VAL 3 3HG1 VAL 3 -0.069 -10.392 0.124 23 HG21 VAL 3 3HG2 VAL 3 2.633 -10.799 1.489 24 HG22 VAL 3 1HG2 VAL 3 2.396 -10.791 -0.269 25 HG23 VAL 3 2HG2 VAL 3 3.604 -9.725 0.480 26 H GLU 4 H GLU 4 1.410 -5.926 0.830 27 HA GLU 4 HA GLU 4 -1.449 -5.435 0.607 28 HB2 GLU 4 2HB GLU 4 -1.028 -3.455 1.890 29 HB3 GLU 4 3HB GLU 4 -0.228 -4.824 2.633 30 HG2 GLU 4 2HG GLU 4 1.305 -2.903 0.828 31 HG3 GLU 4 3HG GLU 4 0.979 -2.524 2.511 32 H GLN 5 H GLN 5 0.654 -5.300 -1.825 33 HA GLN 5 HA GLN 5 -0.888 -3.113 -3.169 34 HB2 GLN 5 2HB GLN 5 2.025 -3.893 -3.580 35 HB3 GLN 5 3HB GLN 5 1.118 -2.832 -4.654 36 HG2 GLN 5 2HG GLN 5 1.586 -2.262 -1.685 37 HG3 GLN 5 3HG GLN 5 2.570 -1.648 -2.993 38 HE21 GLN 5 1HE2 GLN 5 -0.718 -1.444 -1.547 39 HE22 GLN 5 2HE2 GLN 5 -1.081 0.100 -2.319 40 H CYS 6 H CYS 6 1.004 -6.167 -3.832 41 HA CYS 6 HA CYS 6 -0.594 -6.450 -6.278 42 HB2 CYS 6 2HB CYS 6 1.944 -6.796 -5.942 43 HB3 CYS 6 3HB CYS 6 1.482 -8.411 -5.397 44 H CYS 7 H CYS 7 -0.630 -8.075 -3.126 45 HA CYS 7 HA CYS 7 -2.443 -10.175 -4.054 46 HB2 CYS 7 2HB CYS 7 -0.966 -10.262 -1.994 47 HB3 CYS 7 3HB CYS 7 -2.123 -9.178 -1.217 48 H THR 8 H THR 8 -2.884 -6.884 -3.016 49 HA THR 8 HA THR 8 -5.833 -7.152 -2.830 50 HB THR 8 HB THR 8 -4.507 -5.926 -1.089 51 HG1 THR 8 HG1 THR 8 -6.688 -5.485 -1.358 52 HG21 THR 8 1HG2 THR 8 -4.155 -3.832 -3.275 53 HG22 THR 8 2HG2 THR 8 -3.757 -3.653 -1.554 54 HG23 THR 8 3HG2 THR 8 -2.870 -4.824 -2.544 55 H SER 9 H SER 9 -3.406 -5.697 -5.026 56 HA SER 9 HA SER 9 -5.562 -5.255 -6.993 57 HB2 SER 9 2HB SER 9 -5.101 -3.158 -5.648 58 HB3 SER 9 3HB SER 9 -3.533 -3.114 -6.500 59 HG SER 9 HG SER 9 -5.278 -1.902 -7.534 60 H ILE 10 H ILE 10 -4.226 -4.116 -9.004 61 HA ILE 10 HA ILE 10 -2.553 -6.240 -10.124 62 HB ILE 10 HB ILE 10 -3.159 -3.406 -11.061 63 HG12 ILE 10 2HG1 ILE 10 -5.204 -4.782 -10.957 64 HG13 ILE 10 3HG1 ILE 10 -4.785 -4.276 -12.582 65 HG21 ILE 10 1HG2 ILE 10 -2.446 -4.281 -13.345 66 HG22 ILE 10 2HG2 ILE 10 -1.129 -4.117 -12.185 67 HG23 ILE 10 3HG2 ILE 10 -1.809 -5.721 -12.523 68 HD11 ILE 10 3HD1 ILE 10 -5.565 -6.624 -12.474 69 HD12 ILE 10 1HD1 ILE 10 -3.923 -6.485 -13.134 70 HD13 ILE 10 2HD1 ILE 10 -4.170 -7.017 -11.445 71 H CYS 11 H CYS 11 -0.366 -6.431 -10.140 72 HA CYS 11 HA CYS 11 1.176 -3.903 -9.951 73 HB2 CYS 11 2HB CYS 11 2.995 -4.817 -8.806 74 HB3 CYS 11 3HB CYS 11 1.568 -5.133 -7.841 75 H SER 12 H SER 12 3.196 -3.909 -11.076 76 HA SER 12 HA SER 12 3.225 -5.596 -13.546 77 HB2 SER 12 2HB SER 12 3.644 -2.589 -13.319 78 HB3 SER 12 3HB SER 12 3.682 -3.560 -14.789 79 HG SER 12 HG SER 12 1.646 -2.445 -14.434 80 H LEU 13 H LEU 13 5.294 -5.752 -14.588 81 HA LEU 13 HA LEU 13 7.249 -6.528 -12.735 82 HB2 LEU 13 2HB LEU 13 8.694 -6.812 -14.660 83 HB3 LEU 13 3HB LEU 13 7.126 -7.543 -14.915 84 HG LEU 13 HG LEU 13 7.919 -4.849 -16.099 85 HD11 LEU 13 1HD1 LEU 13 8.283 -7.639 -17.265 86 HD12 LEU 13 2HD1 LEU 13 8.521 -6.120 -18.154 87 HD13 LEU 13 3HD1 LEU 13 9.573 -6.512 -16.783 88 HD21 LEU 13 3HD2 LEU 13 5.520 -5.200 -16.292 89 HD22 LEU 13 1HD2 LEU 13 6.266 -5.412 -17.867 90 HD23 LEU 13 2HD2 LEU 13 5.780 -6.840 -16.936 91 H TYR 14 H TYR 14 6.961 -3.552 -14.551 92 HA TYR 14 HA TYR 14 9.559 -2.547 -14.058 93 HB2 TYR 14 2HB TYR 14 8.694 -0.501 -14.989 94 HB3 TYR 14 3HB TYR 14 8.115 -1.908 -15.908 95 HD1 TYR 14 HD2 TYR 14 7.112 0.707 -13.422 96 HD2 TYR 14 HD1 TYR 14 5.798 -2.222 -16.305 97 HE1 TYR 14 HE2 TYR 14 4.799 1.586 -13.250 98 HE2 TYR 14 HE1 TYR 14 3.484 -1.322 -16.160 99 HH TYR 14 HH TYR 14 2.085 0.221 -15.160 100 H GLN 15 H GLN 15 6.978 -2.791 -11.900 101 HA GLN 15 HA GLN 15 8.154 -0.694 -10.113 102 HB2 GLN 15 2HB GLN 15 5.909 -0.258 -9.208 103 HB3 GLN 15 3HB GLN 15 6.046 0.193 -10.906 104 HG2 GLN 15 2HG GLN 15 4.801 -1.788 -11.591 105 HG3 GLN 15 3HG GLN 15 4.763 -2.397 -9.930 106 HE21 GLN 15 2HE2 GLN 15 3.417 0.104 -12.136 107 HE22 GLN 15 1HE2 GLN 15 2.104 0.520 -11.049 108 H LEU 16 H LEU 16 6.792 -3.987 -10.406 109 HA LEU 16 HA LEU 16 6.925 -4.448 -7.574 110 HB2 LEU 16 2HB LEU 16 5.798 -6.309 -8.014 111 HB3 LEU 16 3HB LEU 16 5.548 -5.552 -9.568 112 HG LEU 16 HG LEU 16 7.710 -6.800 -10.291 113 HD11 LEU 16 1HD1 LEU 16 8.635 -7.855 -8.435 114 HD12 LEU 16 2HD1 LEU 16 7.055 -8.142 -7.665 115 HD13 LEU 16 3HD1 LEU 16 7.606 -9.164 -8.995 116 HD21 LEU 16 3HD2 LEU 16 6.348 -8.785 -10.933 117 HD22 LEU 16 1HD2 LEU 16 5.141 -8.379 -9.709 118 HD23 LEU 16 2HD2 LEU 16 5.387 -7.310 -11.115 119 H GLU 17 H GLU 17 9.322 -4.764 -10.164 120 HA GLU 17 HA GLU 17 11.357 -6.280 -8.906 121 HB2 GLU 17 2HB GLU 17 11.452 -3.816 -10.703 122 HB3 GLU 17 3HB GLU 17 12.918 -4.464 -9.979 123 HG2 GLU 17 2HG GLU 17 12.303 -6.720 -11.007 124 HG3 GLU 17 3HG GLU 17 11.144 -5.814 -11.996 125 H ASN 18 H ASN 18 10.223 -3.033 -8.241 126 HA ASN 18 HA ASN 18 12.419 -1.943 -6.845 127 HB2 ASN 18 2HB ASN 18 9.455 -1.385 -6.542 128 HB3 ASN 18 3HB ASN 18 10.718 -0.402 -5.931 129 HD21 ASN 18 2HD2 ASN 18 9.170 1.022 -7.468 130 HD22 ASN 18 1HD2 ASN 18 9.934 1.294 -9.029 131 H TYR 19 H TYR 19 10.018 -4.244 -5.791 132 HA TYR 19 HA TYR 19 10.392 -3.851 -2.906 133 HB2 TYR 19 2HB TYR 19 8.730 -5.787 -4.571 134 HB3 TYR 19 3HB TYR 19 8.693 -5.662 -2.826 135 HD1 TYR 19 HD2 TYR 19 8.031 -3.651 -5.965 136 HD2 TYR 19 HD1 TYR 19 7.315 -4.119 -1.749 137 HE1 TYR 19 HE2 TYR 19 6.344 -1.838 -6.042 138 HE2 TYR 19 HE1 TYR 19 5.487 -2.451 -1.840 139 HH TYR 19 HH TYR 19 4.782 -0.627 -4.884 140 H CYS 20 H CYS 20 12.099 -5.595 -5.281 141 HA CYS 20 HA CYS 20 12.657 -8.047 -3.856 142 HB2 CYS 20 2HB CYS 20 12.901 -7.632 -6.317 143 HB3 CYS 20 3HB CYS 20 14.295 -6.606 -5.973 144 H ASN 21 H ASN 21 14.080 -4.837 -3.673 145 HA ASN 21 HA ASN 21 15.686 -5.500 -1.322 146 HB2 ASN 21 2HB ASN 21 17.158 -6.283 -3.161 147 HB3 ASN 21 3HB ASN 21 17.065 -4.701 -3.928 148 HD21 ASN 21 2HD2 ASN 21 17.741 -2.847 -2.376 149 HD22 ASN 21 1HD2 ASN 21 19.249 -3.150 -1.488 150 H1 PHE 1 1H PHE 1 5.608 -12.197 -19.857 151 H2 PHE 1 2H PHE 1 7.059 -11.785 -19.217 152 H3 PHE 1 3H PHE 1 6.086 -10.635 -19.867 153 HA PHE 1 HA PHE 1 5.476 -12.230 -17.476 154 HB2 PHE 1 2HB PHE 1 7.299 -10.458 -17.238 155 HB3 PHE 1 3HB PHE 1 6.075 -9.247 -17.589 156 HD1 PHE 1 HD2 PHE 1 7.039 -11.991 -15.224 157 HD2 PHE 1 HD1 PHE 1 4.598 -8.475 -15.820 158 HE1 PHE 1 HE2 PHE 1 6.375 -12.036 -12.836 159 HE2 PHE 1 HE1 PHE 1 3.966 -8.516 -13.425 160 HZ PHE 1 HZ PHE 1 4.817 -10.312 -11.942 161 H VAL 2 H VAL 2 3.539 -11.309 -16.251 162 HA VAL 2 HA VAL 2 1.510 -10.011 -18.034 163 HB VAL 2 HB VAL 2 0.974 -12.316 -16.106 164 HG11 VAL 2 1HG1 VAL 2 -0.934 -10.724 -17.889 165 HG12 VAL 2 2HG1 VAL 2 -1.365 -12.188 -16.979 166 HG13 VAL 2 3HG1 VAL 2 -0.912 -10.720 -16.113 167 HG21 VAL 2 3HG2 VAL 2 0.793 -12.205 -19.151 168 HG22 VAL 2 1HG2 VAL 2 1.957 -13.155 -18.199 169 HG23 VAL 2 2HG2 VAL 2 0.239 -13.555 -18.136 170 H ASN 3 H ASN 3 0.711 -8.215 -17.128 171 HA ASN 3 HA ASN 3 1.266 -7.546 -14.310 172 HB2 ASN 3 2HB ASN 3 -0.295 -6.041 -16.442 173 HB3 ASN 3 3HB ASN 3 0.151 -5.418 -14.860 174 HD21 ASN 3 1HD2 ASN 3 0.861 -4.208 -17.388 175 HD22 ASN 3 2HD2 ASN 3 2.609 -4.269 -17.517 176 H GLN 4 H GLN 4 -0.048 -8.301 -12.709 177 HA GLN 4 HA GLN 4 -2.964 -8.459 -12.993 178 HB2 GLN 4 2HB GLN 4 -3.015 -10.923 -12.619 179 HB3 GLN 4 3HB GLN 4 -2.399 -10.477 -14.194 180 HG2 GLN 4 2HG GLN 4 -0.141 -10.923 -13.588 181 HG3 GLN 4 3HG GLN 4 -0.525 -11.020 -11.875 182 HE21 GLN 4 2HE2 GLN 4 -1.916 -12.859 -11.140 183 HE22 GLN 4 1HE2 GLN 4 -1.633 -14.364 -11.996 184 H HIS 5 H HIS 5 -3.758 -9.879 -11.026 185 HA HIS 5 HA HIS 5 -2.621 -8.864 -8.499 186 HB2 HIS 5 2HB HIS 5 -4.918 -10.792 -9.066 187 HB3 HIS 5 3HB HIS 5 -4.501 -10.101 -7.501 188 HD2 HIS 5 HD2 HIS 5 -5.874 -8.964 -10.974 189 HE1 HIS 5 HE1 HIS 5 -7.031 -6.027 -8.130 190 HE2 HIS 5 HE2 HIS 5 -7.289 -6.800 -10.545 191 H LEU 6 H LEU 6 -1.403 -10.120 -7.087 192 HA LEU 6 HA LEU 6 -0.846 -12.989 -7.648 193 HB2 LEU 6 2HB LEU 6 1.269 -10.810 -7.522 194 HB3 LEU 6 3HB LEU 6 1.620 -12.529 -7.471 195 HG LEU 6 HG LEU 6 0.257 -11.153 -9.821 196 HD11 LEU 6 1HD1 LEU 6 2.436 -11.384 -10.959 197 HD12 LEU 6 2HD1 LEU 6 2.469 -10.220 -9.615 198 HD13 LEU 6 3HD1 LEU 6 3.162 -11.842 -9.393 199 HD21 LEU 6 3HD2 LEU 6 -0.111 -13.629 -9.686 200 HD22 LEU 6 1HD2 LEU 6 0.929 -13.177 -11.051 201 HD23 LEU 6 2HD2 LEU 6 1.647 -13.863 -9.581 202 H CYS 7 H CYS 7 -0.414 -14.170 -5.822 203 HA CYS 7 HA CYS 7 0.352 -12.836 -3.322 204 HB2 CYS 7 2HB CYS 7 -2.220 -12.671 -3.740 205 HB3 CYS 7 3HB CYS 7 -2.252 -14.370 -3.291 206 H GLY 8 H GLY 8 1.124 -14.253 -1.722 207 HA2 GLY 8 HA2 GLY 8 2.198 -16.138 -0.907 208 HA3 GLY 8 HA3 GLY 8 0.931 -17.072 -1.715 209 H SER 9 H SER 9 1.898 -18.669 -2.784 210 HA SER 9 HA SER 9 4.504 -18.817 -3.801 211 HB2 SER 9 2HB SER 9 2.033 -20.180 -4.930 212 HB3 SER 9 3HB SER 9 3.706 -20.739 -5.065 213 HG SER 9 HG SER 9 3.724 -21.148 -2.836 214 H HIS 10 H HIS 10 1.562 -17.610 -5.504 215 HA HIS 10 HA HIS 10 2.776 -17.364 -8.078 216 HB2 HIS 10 2HB HIS 10 0.236 -16.819 -6.850 217 HB3 HIS 10 3HB HIS 10 0.747 -15.328 -7.610 218 HD2 HIS 10 HD2 HIS 10 -1.317 -18.095 -8.441 219 HE1 HIS 10 HE1 HIS 10 0.579 -17.301 -12.169 220 HE2 HIS 10 HE2 HIS 10 -1.361 -18.507 -11.039 221 H LEU 11 H LEU 11 2.702 -15.190 -5.309 222 HA LEU 11 HA LEU 11 3.909 -12.913 -6.669 223 HB2 LEU 11 2HB LEU 11 2.335 -12.948 -4.620 224 HB3 LEU 11 3HB LEU 11 3.725 -13.466 -3.677 225 HG LEU 11 HG LEU 11 4.893 -11.326 -4.324 226 HD11 LEU 11 1HD1 LEU 11 2.150 -10.570 -5.430 227 HD12 LEU 11 2HD1 LEU 11 3.528 -9.479 -5.250 228 HD13 LEU 11 3HD1 LEU 11 3.612 -10.797 -6.420 229 HD21 LEU 11 3HD2 LEU 11 3.699 -11.537 -2.189 230 HD22 LEU 11 1HD2 LEU 11 3.435 -9.910 -2.840 231 HD23 LEU 11 2HD2 LEU 11 2.156 -11.118 -2.972 232 H VAL 12 H VAL 12 5.109 -15.450 -4.439 233 HA VAL 12 HA VAL 12 7.861 -14.682 -4.452 234 HB VAL 12 HB VAL 12 6.589 -17.432 -4.157 235 HG11 VAL 12 1HG1 VAL 12 9.464 -16.584 -3.586 236 HG12 VAL 12 2HG1 VAL 12 8.725 -18.109 -3.050 237 HG13 VAL 12 3HG1 VAL 12 8.930 -17.797 -4.774 238 HG21 VAL 12 3HG2 VAL 12 5.966 -15.776 -2.413 239 HG22 VAL 12 1HG2 VAL 12 6.967 -17.072 -1.756 240 HG23 VAL 12 2HG2 VAL 12 7.683 -15.477 -2.088 241 H GLU 13 H GLU 13 6.071 -16.875 -6.649 242 HA GLU 13 HA GLU 13 8.189 -17.533 -8.423 243 HB2 GLU 13 2HB GLU 13 5.175 -17.385 -8.674 244 HB3 GLU 13 3HB GLU 13 6.150 -17.589 -10.120 245 HG2 GLU 13 2HG GLU 13 7.244 -19.575 -9.157 246 HG3 GLU 13 3HG GLU 13 6.316 -19.389 -7.666 247 H ALA 14 H ALA 14 5.922 -14.673 -8.583 248 HA ALA 14 HA ALA 14 7.050 -13.640 -10.971 249 HB1 ALA 14 3HB ALA 14 5.942 -11.552 -10.244 250 HB2 ALA 14 1HB ALA 14 4.903 -12.989 -10.066 251 HB3 ALA 14 2HB ALA 14 5.671 -12.248 -8.635 252 H LEU 15 H LEU 15 7.879 -12.837 -7.526 253 HA LEU 15 HA LEU 15 9.973 -11.031 -8.131 254 HB2 LEU 15 2HB LEU 15 9.286 -12.779 -5.766 255 HB3 LEU 15 3HB LEU 15 10.904 -12.117 -5.836 256 HG LEU 15 HG LEU 15 9.515 -10.726 -4.468 257 HD11 LEU 15 1HD1 LEU 15 10.123 -9.201 -7.036 258 HD12 LEU 15 2HD1 LEU 15 10.007 -8.555 -5.393 259 HD13 LEU 15 3HD1 LEU 15 11.326 -9.661 -5.811 260 HD21 LEU 15 3HD2 LEU 15 7.656 -9.364 -5.440 261 HD22 LEU 15 1HD2 LEU 15 7.723 -10.377 -6.898 262 HD23 LEU 15 2HD2 LEU 15 7.314 -11.094 -5.327 263 H TYR 16 H TYR 16 10.159 -14.605 -7.987 264 HA TYR 16 HA TYR 16 12.986 -14.756 -8.463 265 HB2 TYR 16 2HB TYR 16 11.590 -16.702 -7.776 266 HB3 TYR 16 3HB TYR 16 10.792 -16.669 -9.351 267 HD1 TYR 16 HD1 TYR 16 11.919 -17.423 -11.385 268 HD2 TYR 16 HD2 TYR 16 13.987 -17.378 -7.600 269 HE1 TYR 16 HE1 TYR 16 13.781 -18.711 -12.395 270 HE2 TYR 16 HE2 TYR 16 15.844 -18.696 -8.597 271 HH TYR 16 HH TYR 16 16.671 -19.703 -10.493 272 H LEU 17 H LEU 17 10.234 -14.612 -10.791 273 HA LEU 17 HA LEU 17 11.922 -14.734 -13.129 274 HB2 LEU 17 2HB LEU 17 9.108 -13.621 -12.743 275 HB3 LEU 17 3HB LEU 17 9.892 -13.851 -14.297 276 HG LEU 17 HG LEU 17 9.286 -16.102 -12.348 277 HD11 LEU 17 1HD1 LEU 17 7.831 -15.249 -14.885 278 HD12 LEU 17 2HD1 LEU 17 7.464 -16.683 -13.902 279 HD13 LEU 17 3HD1 LEU 17 7.229 -15.065 -13.222 280 HD21 LEU 17 3HD2 LEU 17 10.250 -16.155 -15.242 281 HD22 LEU 17 1HD2 LEU 17 11.168 -16.687 -13.814 282 HD23 LEU 17 2HD2 LEU 17 9.723 -17.572 -14.309 283 H VAL 18 H VAL 18 10.431 -11.903 -11.471 284 HA VAL 18 HA VAL 18 11.602 -10.115 -13.427 285 HB VAL 18 HB VAL 18 10.975 -8.609 -11.012 286 HG11 VAL 18 1HG1 VAL 18 9.609 -8.695 -13.711 287 HG12 VAL 18 2HG1 VAL 18 9.569 -7.381 -12.495 288 HG13 VAL 18 3HG1 VAL 18 11.077 -7.758 -13.344 289 HG21 VAL 18 3HG2 VAL 18 9.506 -10.155 -10.256 290 HG22 VAL 18 1HG2 VAL 18 8.548 -8.930 -11.085 291 HG23 VAL 18 2HG2 VAL 18 8.803 -10.485 -11.892 292 H CYS 19 H CYS 19 12.700 -11.164 -10.219 293 HA CYS 19 HA CYS 19 14.913 -9.180 -10.423 294 HB2 CYS 19 2HB CYS 19 13.306 -9.093 -8.492 295 HB3 CYS 19 3HB CYS 19 13.909 -10.671 -7.982 296 H GLY 20 H GLY 20 14.337 -12.653 -9.920 297 HA2 GLY 20 HA2 GLY 20 17.172 -13.240 -9.357 298 HA3 GLY 20 HA3 GLY 20 15.826 -14.400 -9.481 299 H GLU 21 H GLU 21 14.853 -14.178 -11.922 300 HA GLU 21 HA GLU 21 16.870 -15.386 -13.597 301 HB2 GLU 21 2HB GLU 21 14.510 -16.144 -13.403 302 HB3 GLU 21 3HB GLU 21 13.981 -14.647 -14.162 303 HG2 GLU 21 2HG GLU 21 13.951 -16.326 -15.819 304 HG3 GLU 21 3HG GLU 21 15.286 -15.252 -16.210 305 H ARG 22 H ARG 22 14.837 -12.424 -13.950 306 HA ARG 22 HA ARG 22 14.928 -10.593 -15.217 307 HB2 ARG 22 2HB ARG 22 17.616 -11.003 -14.005 308 HB3 ARG 22 3HB ARG 22 17.505 -9.704 -15.210 309 HG2 ARG 22 2HG ARG 22 15.588 -8.744 -13.996 310 HG3 ARG 22 3HG ARG 22 15.714 -10.050 -12.790 311 HD2 ARG 22 2HD ARG 22 17.889 -9.287 -12.095 312 HD3 ARG 22 3HD ARG 22 17.949 -8.086 -13.396 313 HE ARG 22 HE ARG 22 15.815 -7.121 -12.253 314 HH11 ARG 22 1HH2 ARG 22 18.435 -8.540 -10.324 315 HH12 ARG 22 2HH2 ARG 22 18.161 -7.423 -9.020 316 HH21 ARG 22 1HH1 ARG 22 15.498 -5.839 -10.644 317 HH22 ARG 22 2HH1 ARG 22 16.455 -5.894 -9.164 318 H GLY 23 H GLY 23 16.034 -13.227 -16.813 319 HA2 GLY 23 HA2 GLY 23 17.535 -12.263 -18.979 320 HA3 GLY 23 HA3 GLY 23 16.528 -13.735 -18.988 321 H HIS 24 H HIS 24 14.080 -12.190 -18.582 322 HA HIS 24 HA HIS 24 13.254 -11.592 -21.259 323 HB2 HIS 24 2HB HIS 24 11.230 -10.674 -20.100 324 HB3 HIS 24 3HB HIS 24 11.668 -12.310 -19.626 325 HD2 HIS 24 HD2 HIS 24 12.411 -12.748 -17.115 326 HE1 HIS 24 HE1 HIS 24 11.891 -8.796 -15.626 327 HE2 HIS 24 HE2 HIS 24 12.358 -11.227 -14.983 328 H PHE 25 H PHE 25 14.640 -9.546 -18.769 329 HA PHE 25 HA PHE 25 15.519 -7.502 -18.700 330 HB2 PHE 25 2HB PHE 25 16.654 -8.315 -20.738 331 HB3 PHE 25 3HB PHE 25 15.395 -7.607 -21.737 332 HD1 PHE 25 HD2 PHE 25 17.785 -6.575 -18.998 333 HD2 PHE 25 HD1 PHE 25 15.851 -5.529 -22.711 334 HE1 PHE 25 HE2 PHE 25 19.060 -4.446 -19.069 335 HE2 PHE 25 HE1 PHE 25 17.142 -3.415 -22.787 336 HZ PHE 25 HZ PHE 25 18.741 -2.863 -20.962 337 H TYR 26 H TYR 26 15.167 -5.177 -18.839 338 HA TYR 26 HA TYR 26 12.756 -4.185 -20.149 339 HB2 TYR 26 2HB TYR 26 12.397 -4.983 -17.649 340 HB3 TYR 26 3HB TYR 26 13.232 -3.496 -17.247 341 HD1 TYR 26 HD1 TYR 26 10.450 -4.930 -19.226 342 HD2 TYR 26 HD2 TYR 26 11.977 -1.398 -17.316 343 HE1 TYR 26 HE1 TYR 26 8.234 -3.797 -19.575 344 HE2 TYR 26 HE2 TYR 26 9.778 -0.264 -17.623 345 HH TYR 26 HH TYR 26 7.625 -0.449 -18.430 346 H THR 27 H THR 27 12.814 -1.973 -20.591 347 HA THR 27 HA THR 27 14.947 -0.268 -19.605 348 HB THR 27 HB THR 27 16.083 -1.662 -21.289 349 HG1 THR 27 HG1 THR 27 16.875 0.370 -20.783 350 HG21 THR 27 1HG2 THR 27 14.295 -1.873 -22.988 351 HG22 THR 27 2HG2 THR 27 14.465 -0.134 -23.354 352 HG23 THR 27 3HG2 THR 27 15.808 -1.248 -23.657 353 HA PRO 28 HA PRO 28 11.339 -1.157 -20.465 354 HB2 PRO 28 2HB PRO 28 9.113 -0.381 -21.765 355 HB3 PRO 28 3HB PRO 28 9.559 0.295 -20.172 356 HG2 PRO 28 2HG PRO 28 10.129 1.514 -22.890 357 HG3 PRO 28 3HG PRO 28 9.314 2.275 -21.480 358 HD2 PRO 28 2HD PRO 28 11.956 2.634 -21.876 359 HD3 PRO 28 3HD PRO 28 11.327 2.333 -20.226 360 H LYS 29 H LYS 29 10.459 -2.802 -21.879 361 HA LYS 29 HA LYS 29 11.847 -3.211 -24.389 362 HB2 LYS 29 2HB LYS 29 9.410 -4.605 -23.200 363 HB3 LYS 29 3HB LYS 29 10.330 -5.188 -24.579 364 HG2 LYS 29 2HG LYS 29 11.395 -4.865 -21.742 365 HG3 LYS 29 3HG LYS 29 10.855 -6.369 -22.448 366 HD2 LYS 29 2HD LYS 29 13.222 -4.723 -23.462 367 HD3 LYS 29 3HD LYS 29 13.345 -6.109 -22.403 368 HE2 LYS 29 2HE LYS 29 12.219 -6.197 -25.235 369 HE3 LYS 29 3HE LYS 29 13.857 -6.649 -24.764 370 HZ1 LYS 29 HZ1 LYS 29 12.862 -8.361 -23.292 371 HZ2 LYS 29 HZ2 LYS 29 11.377 -8.006 -23.876 372 HZ3 LYS 29 HZ3 LYS 29 12.516 -8.614 -24.875 373 H THR 30 H THR 30 11.181 -3.032 -26.462 374 HA THR 30 HA THR 30 8.589 -2.251 -27.407 375 HB THR 30 HB THR 30 9.257 -0.124 -26.310 376 HG1 THR 30 HG1 THR 30 8.938 -0.313 -29.090 377 HG21 THR 30 1HG2 THR 30 11.702 -0.180 -26.663 378 HG22 THR 30 2HG2 THR 30 11.458 0.026 -28.411 379 HG23 THR 30 3HG2 THR 30 10.965 1.304 -27.281
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