NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
637392 | 6d8q | 30460 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 H1 ALA 1 11.784 23.824 13.672 2 H2 ALA 1 H2 ALA 1 12.869 24.730 14.537 3 H3 ALA 1 H3 ALA 1 12.842 23.093 14.713 4 HA ALA 1 HA ALA 1 13.571 22.714 12.536 5 HB1 ALA 1 HB1 ALA 1 12.504 24.607 11.416 6 HB2 ALA 1 HB2 ALA 1 13.601 25.739 12.234 7 HB3 ALA 1 HB3 ALA 1 14.244 24.571 11.069 8 H PHE 2 H PHE 2 14.940 25.621 14.227 9 HA PHE 2 HA PHE 2 17.368 24.077 14.878 10 HB2 PHE 2 HB2 PHE 2 17.450 26.606 13.197 11 HB3 PHE 2 HB3 PHE 2 18.851 25.803 13.909 12 HD1 PHE 2 HD1 PHE 2 17.018 26.163 10.924 13 HD2 PHE 2 HD2 PHE 2 19.038 23.188 13.301 14 HE1 PHE 2 HE1 PHE 2 17.290 24.735 8.923 15 HE2 PHE 2 HE2 PHE 2 19.264 21.751 11.312 16 HZ PHE 2 HZ PHE 2 18.432 22.528 9.091 17 H CYS 3 H CYS 3 18.312 24.772 16.736 18 HA CYS 3 HA CYS 3 16.933 26.431 18.540 19 HB2 CYS 3 HB2 CYS 3 19.730 26.140 19.265 20 HB3 CYS 3 HB3 CYS 3 18.287 25.537 20.041 21 H ASN 4 H ASN 4 18.069 28.192 19.875 22 HA ASN 4 HA ASN 4 18.594 30.459 18.029 23 HB2 ASN 4 HB2 ASN 4 17.601 30.229 20.912 24 HB3 ASN 4 HB3 ASN 4 17.984 31.737 20.138 25 HD21 ASN 4 HD21 ASN 4 14.907 32.096 18.579 26 HD22 ASN 4 HD22 ASN 4 16.518 32.737 18.864 27 H LEU 5 H LEU 5 20.810 29.887 17.616 28 HA LEU 5 HA LEU 5 22.640 28.887 19.371 29 HB2 LEU 5 HB2 LEU 5 22.762 28.856 17.046 30 HB3 LEU 5 HB3 LEU 5 23.159 30.567 16.973 31 HG LEU 5 HG LEU 5 25.089 30.228 18.102 32 HD11 LEU 5 HD11 LEU 5 26.027 27.991 18.919 33 HD12 LEU 5 HD12 LEU 5 24.695 28.544 19.911 34 HD13 LEU 5 HD13 LEU 5 24.410 27.297 18.682 35 HD21 LEU 5 HD21 LEU 5 25.051 29.447 15.771 36 HD22 LEU 5 HD22 LEU 5 26.278 28.545 16.710 37 HD23 LEU 5 HD23 LEU 5 24.667 27.816 16.395 38 H ARG 6 H ARG 6 22.243 32.327 18.457 39 HA ARG 6 HA ARG 6 24.279 33.423 20.148 40 HB2 ARG 6 HB2 ARG 6 23.189 34.667 18.327 41 HB3 ARG 6 HB3 ARG 6 21.698 34.788 19.263 42 HG2 ARG 6 HG2 ARG 6 22.794 36.157 20.962 43 HG3 ARG 6 HG3 ARG 6 24.367 35.887 20.201 44 HD2 ARG 6 HD2 ARG 6 23.682 38.062 19.536 45 HD3 ARG 6 HD3 ARG 6 23.500 37.008 18.125 46 HE ARG 6 HE ARG 6 21.031 37.289 19.681 47 HH11 ARG 6 HH11 ARG 6 22.884 38.931 17.144 48 HH12 ARG 6 HH12 ARG 6 21.492 39.927 16.737 49 HH21 ARG 6 HH21 ARG 6 19.391 38.422 18.996 50 HH22 ARG 6 HH22 ARG 6 19.520 39.531 17.632 51 H ARG 7 H ARG 7 20.784 32.909 21.022 52 HA ARG 7 HA ARG 7 21.111 33.801 23.757 53 HB2 ARG 7 HB2 ARG 7 19.108 31.952 22.390 54 HB3 ARG 7 HB3 ARG 7 18.996 32.485 24.058 55 HG2 ARG 7 HG2 ARG 7 18.887 34.864 23.308 56 HG3 ARG 7 HG3 ARG 7 18.927 34.311 21.620 57 HD2 ARG 7 HD2 ARG 7 16.890 32.929 22.079 58 HD3 ARG 7 HD3 ARG 7 16.808 33.631 23.706 59 HE ARG 7 HE ARG 7 16.783 35.884 22.194 60 HH11 ARG 7 HH11 ARG 7 14.811 32.984 21.916 61 HH12 ARG 7 HH12 ARG 7 13.520 33.865 21.123 62 HH21 ARG 7 HH21 ARG 7 15.185 36.877 21.235 63 HH22 ARG 7 HH22 ARG 7 13.733 36.029 20.697 64 H CYS 8 H CYS 8 21.399 30.604 22.234 65 HA CYS 8 HA CYS 8 21.858 29.082 24.599 66 HB2 CYS 8 HB2 CYS 8 21.145 28.180 22.399 67 HB3 CYS 8 HB3 CYS 8 22.677 28.675 21.704 68 H GLU 9 H GLU 9 24.206 30.619 22.355 69 HA GLU 9 HA GLU 9 26.608 29.863 23.691 70 HB2 GLU 9 HB2 GLU 9 25.873 32.146 21.818 71 HB3 GLU 9 HB3 GLU 9 27.460 32.062 22.585 72 HG2 GLU 9 HG2 GLU 9 27.758 29.738 21.675 73 HG3 GLU 9 HG3 GLU 9 26.295 29.969 20.709 74 H LEU 10 H LEU 10 24.488 32.716 24.184 75 HA LEU 10 HA LEU 10 26.098 33.866 26.288 76 HB2 LEU 10 HB2 LEU 10 23.198 34.184 25.438 77 HB3 LEU 10 HB3 LEU 10 23.901 35.115 26.754 78 HG LEU 10 HG LEU 10 24.985 35.157 23.910 79 HD11 LEU 10 HD11 LEU 10 23.118 37.115 25.318 80 HD12 LEU 10 HD12 LEU 10 23.848 37.334 23.710 81 HD13 LEU 10 HD13 LEU 10 22.686 36.029 23.975 82 HD21 LEU 10 HD21 LEU 10 26.074 37.254 24.667 83 HD22 LEU 10 HD22 LEU 10 25.465 36.979 26.313 84 HD23 LEU 10 HD23 LEU 10 26.641 35.860 25.586 85 H SER 11 H SER 11 23.436 31.501 26.316 86 HA SER 11 HA SER 11 23.117 31.355 29.154 87 HB2 SER 11 HB2 SER 11 21.480 30.344 27.655 88 HB3 SER 11 HB3 SER 11 22.692 29.227 27.021 89 HG SER 11 HG SER 11 21.495 29.302 29.585 90 H CYS 12 H CYS 12 25.217 29.375 26.956 91 HA CYS 12 HA CYS 12 26.490 28.035 29.169 92 HB2 CYS 12 HB2 CYS 12 27.411 28.410 26.312 93 HB3 CYS 12 HB3 CYS 12 28.068 27.241 27.472 94 H ARG 13 H ARG 13 27.312 31.078 27.460 95 HA ARG 13 HA ARG 13 29.884 31.540 28.517 96 HB2 ARG 13 HB2 ARG 13 28.729 32.957 26.798 97 HB3 ARG 13 HB3 ARG 13 27.701 33.618 28.082 98 HG2 ARG 13 HG2 ARG 13 29.829 34.423 29.229 99 HG3 ARG 13 HG3 ARG 13 30.723 33.926 27.800 100 HD2 ARG 13 HD2 ARG 13 28.402 35.915 27.769 101 HD3 ARG 13 HD3 ARG 13 30.093 36.380 27.972 102 HE ARG 13 HE ARG 13 30.013 34.837 25.620 103 HH11 ARG 13 HH11 ARG 13 28.783 38.001 26.601 104 HH12 ARG 13 HH12 ARG 13 28.891 38.615 24.971 105 HH21 ARG 13 HH21 ARG 13 30.151 35.625 23.715 106 HH22 ARG 13 HH22 ARG 13 29.782 37.303 23.347 107 H SER 14 H SER 14 26.727 32.135 30.122 108 HA SER 14 HA SER 14 27.687 33.326 32.507 109 HB2 SER 14 HB2 SER 14 25.342 31.426 32.140 110 HB3 SER 14 HB3 SER 14 25.586 32.489 33.503 111 HG SER 14 HG SER 14 24.186 33.341 31.881 112 H LEU 15 H LEU 15 27.761 29.924 31.566 113 HA LEU 15 HA LEU 15 28.586 29.042 34.268 114 HB2 LEU 15 HB2 LEU 15 28.101 27.426 31.731 115 HB3 LEU 15 HB3 LEU 15 28.314 26.793 33.379 116 HG LEU 15 HG LEU 15 25.961 28.396 32.310 117 HD11 LEU 15 HD11 LEU 15 26.190 25.533 33.312 118 HD12 LEU 15 HD12 LEU 15 24.706 26.330 32.747 119 HD13 LEU 15 HD13 LEU 15 26.030 26.038 31.613 120 HD21 LEU 15 HD21 LEU 15 26.418 27.327 35.125 121 HD22 LEU 15 HD22 LEU 15 26.291 29.035 34.653 122 HD23 LEU 15 HD23 LEU 15 24.883 27.980 34.507 123 H GLY 16 H GLY 16 30.066 30.105 31.399 124 HA2 GLY 16 HA2 GLY 16 32.304 30.497 30.995 125 HA3 GLY 16 HA3 GLY 16 32.775 29.415 32.318 126 H LEU 17 H LEU 17 30.424 28.479 29.913 127 HA LEU 17 HA LEU 17 32.308 26.535 28.699 128 HB2 LEU 17 HB2 LEU 17 29.292 26.333 28.849 129 HB3 LEU 17 HB3 LEU 17 30.414 25.052 28.392 130 HG LEU 17 HG LEU 17 29.938 26.254 31.114 131 HD11 LEU 17 HD11 LEU 17 29.113 24.024 31.724 132 HD12 LEU 17 HD12 LEU 17 28.162 24.768 30.433 133 HD13 LEU 17 HD13 LEU 17 29.349 23.485 30.047 134 HD21 LEU 17 HD21 LEU 17 31.451 24.529 32.029 135 HD22 LEU 17 HD22 LEU 17 31.782 23.938 30.390 136 HD23 LEU 17 HD23 LEU 17 32.342 25.548 30.895 137 H LEU 18 H LEU 18 31.500 25.874 26.378 138 HA LEU 18 HA LEU 18 30.604 28.338 24.888 139 HB2 LEU 18 HB2 LEU 18 31.741 25.829 23.664 140 HB3 LEU 18 HB3 LEU 18 31.407 27.379 22.891 141 HG LEU 18 HG LEU 18 33.587 26.781 24.945 142 HD11 LEU 18 HD11 LEU 18 35.109 27.210 23.108 143 HD12 LEU 18 HD12 LEU 18 33.976 25.935 22.640 144 HD13 LEU 18 HD13 LEU 18 33.761 27.586 22.012 145 HD21 LEU 18 HD21 LEU 18 32.902 29.409 23.552 146 HD22 LEU 18 HD22 LEU 18 32.843 29.084 25.298 147 HD23 LEU 18 HD23 LEU 18 34.397 29.096 24.468 148 H GLY 19 H GLY 19 28.667 28.347 23.851 149 HA2 GLY 19 HA2 GLY 19 26.883 25.991 24.209 150 HA3 GLY 19 HA3 GLY 19 26.372 27.621 23.798 151 H LYS 20 H LYS 20 25.934 24.842 22.648 152 HA LYS 20 HA LYS 20 26.157 25.637 19.793 153 HB2 LYS 20 HB2 LYS 20 27.268 23.063 20.998 154 HB3 LYS 20 HB3 LYS 20 26.717 23.157 19.338 155 HG2 LYS 20 HG2 LYS 20 28.842 23.673 18.899 156 HG3 LYS 20 HG3 LYS 20 28.302 25.302 19.235 157 HD2 LYS 20 HD2 LYS 20 29.112 24.724 21.708 158 HD3 LYS 20 HD3 LYS 20 30.021 23.439 20.915 159 HE2 LYS 20 HE2 LYS 20 30.131 26.402 20.185 160 HE3 LYS 20 HE3 LYS 20 31.277 25.628 21.268 161 HZ1 LYS 20 HZ1 LYS 20 32.213 24.425 19.510 162 HZ2 LYS 20 HZ2 LYS 20 30.943 24.644 18.489 163 HZ3 LYS 20 HZ3 LYS 20 31.948 25.893 18.855 164 H CYS 21 H CYS 21 24.550 24.946 18.492 165 HA CYS 21 HA CYS 21 22.099 23.874 19.768 166 HB2 CYS 21 HB2 CYS 21 21.847 25.754 18.287 167 HB3 CYS 21 HB3 CYS 21 22.786 24.963 17.024 168 H ILE 22 H ILE 22 21.708 21.760 19.870 169 HA ILE 22 HA ILE 22 22.793 19.864 17.818 170 HB ILE 22 HB ILE 22 22.755 19.540 20.839 171 HG12 ILE 22 HG12 ILE 22 24.578 21.056 20.184 172 HG13 ILE 22 HG13 ILE 22 25.149 19.551 20.860 173 HG21 ILE 22 HG21 ILE 22 23.715 17.630 18.672 174 HG22 ILE 22 HG22 ILE 22 24.020 17.421 20.406 175 HG23 ILE 22 HG23 ILE 22 22.369 17.379 19.787 176 HD11 ILE 22 HD11 ILE 22 25.842 18.719 18.689 177 HD12 ILE 22 HD12 ILE 22 25.078 20.095 17.864 178 HD13 ILE 22 HD13 ILE 22 26.479 20.355 18.913 179 H GLY 23 H GLY 23 20.889 19.404 16.752 180 HA2 GLY 23 HA2 GLY 23 18.853 18.408 16.363 181 HA3 GLY 23 HA3 GLY 23 19.147 17.495 17.846 182 H GLU 24 H GLU 24 18.271 20.889 17.061 183 HA GLU 24 HA GLU 24 16.820 22.364 17.931 184 HB2 GLU 24 HB2 GLU 24 14.971 20.035 18.534 185 HB3 GLU 24 HB3 GLU 24 14.545 21.742 18.399 186 HG2 GLU 24 HG2 GLU 24 15.486 21.640 16.007 187 HG3 GLU 24 HG3 GLU 24 15.441 19.887 16.187 188 H GLU 25 H GLU 25 18.712 20.895 19.910 189 HA GLU 25 HA GLU 25 17.547 22.026 22.416 190 HB2 GLU 25 HB2 GLU 25 17.292 19.669 22.524 191 HB3 GLU 25 HB3 GLU 25 18.901 19.383 21.867 192 HG2 GLU 25 HG2 GLU 25 19.926 20.180 23.949 193 HG3 GLU 25 HG3 GLU 25 18.334 20.545 24.613 194 H CYS 26 H CYS 26 18.890 23.291 23.652 195 HA CYS 26 HA CYS 26 21.508 24.053 22.516 196 HB2 CYS 26 HB2 CYS 26 20.024 25.797 23.359 197 HB3 CYS 26 HB3 CYS 26 19.907 24.984 24.919 198 H LYS 27 H LYS 27 23.458 23.299 23.215 199 HA LYS 27 HA LYS 27 23.678 21.973 25.878 200 HB2 LYS 27 HB2 LYS 27 24.764 20.797 23.282 201 HB3 LYS 27 HB3 LYS 27 24.964 20.138 24.908 202 HG2 LYS 27 HG2 LYS 27 22.428 19.914 25.044 203 HG3 LYS 27 HG3 LYS 27 22.359 20.415 23.350 204 HD2 LYS 27 HD2 LYS 27 22.168 18.104 23.287 205 HD3 LYS 27 HD3 LYS 27 23.840 18.420 22.795 206 HE2 LYS 27 HE2 LYS 27 24.650 17.812 25.028 207 HE3 LYS 27 HE3 LYS 27 22.987 17.673 25.628 208 HZ1 LYS 27 HZ1 LYS 27 23.942 15.494 25.040 209 HZ2 LYS 27 HZ2 LYS 27 22.616 15.832 24.141 210 HZ3 LYS 27 HZ3 LYS 27 24.122 15.962 23.481 211 H CYS 28 H CYS 28 25.752 22.005 26.803 212 HA CYS 28 HA CYS 28 27.579 24.080 25.669 213 HB2 CYS 28 HB2 CYS 28 27.312 23.321 28.576 214 HB3 CYS 28 HB3 CYS 28 28.186 24.678 27.906 215 H VAL 29 H VAL 29 29.836 23.799 25.835 216 HA VAL 29 HA VAL 29 30.891 21.213 26.929 217 HB VAL 29 HB VAL 29 32.496 21.053 25.067 218 HG11 VAL 29 HG11 VAL 29 29.600 20.969 24.103 219 HG12 VAL 29 HG12 VAL 29 30.982 20.074 23.441 220 HG13 VAL 29 HG13 VAL 29 30.407 19.720 25.072 221 HG21 VAL 29 HG21 VAL 29 32.472 23.381 24.227 222 HG22 VAL 29 HG22 VAL 29 32.113 22.225 22.945 223 HG23 VAL 29 HG23 VAL 29 30.799 23.178 23.667 224 H TYR 30 H TYR 30 32.985 21.250 27.776 225 HA TYR 30 HA TYR 30 33.664 23.635 29.117 226 HB2 TYR 30 HB2 TYR 30 35.117 21.005 28.753 227 HB3 TYR 30 HB3 TYR 30 35.858 22.334 29.632 228 HD1 TYR 30 HD1 TYR 30 34.283 23.524 31.438 229 HD2 TYR 30 HD2 TYR 30 33.934 19.432 30.115 230 HE1 TYR 30 HE1 TYR 30 33.004 22.972 33.490 231 HE2 TYR 30 HE2 TYR 30 32.678 18.886 32.191 232 HH TYR 30 HH TYR 30 31.660 21.449 34.468 233 H ASN 31 H ASN 31 35.735 22.121 26.637 234 HA ASN 31 HA ASN 31 37.413 22.906 25.312 235 HB2 ASN 31 HB2 ASN 31 35.198 24.890 24.808 236 HB3 ASN 31 HB3 ASN 31 36.695 24.908 23.880 237 HD21 ASN 31 HD21 ASN 31 34.981 21.309 23.221 238 HD22 ASN 31 HD22 ASN 31 35.634 21.696 24.798 Start of MODEL 2 1 H1 ALA 1 H1 ALA 1 11.633 20.728 15.948 2 H2 ALA 1 H2 ALA 1 10.431 21.765 16.361 3 H3 ALA 1 H3 ALA 1 10.673 20.398 17.250 4 HA ALA 1 HA ALA 1 11.486 22.507 18.261 5 HB1 ALA 1 HB1 ALA 1 13.591 21.490 19.071 6 HB2 ALA 1 HB2 ALA 1 12.261 20.324 19.075 7 HB3 ALA 1 HB3 ALA 1 13.493 20.258 17.795 8 H PHE 2 H PHE 2 13.031 24.170 18.198 9 HA PHE 2 HA PHE 2 14.639 24.499 15.716 10 HB2 PHE 2 HB2 PHE 2 12.830 26.590 16.968 11 HB3 PHE 2 HB3 PHE 2 13.899 26.835 15.599 12 HD1 PHE 2 HD1 PHE 2 10.551 26.223 16.473 13 HD2 PHE 2 HD2 PHE 2 13.542 25.024 13.609 14 HE1 PHE 2 HE1 PHE 2 8.763 25.497 14.904 15 HE2 PHE 2 HE2 PHE 2 11.769 24.281 12.055 16 HZ PHE 2 HZ PHE 2 9.369 24.520 12.696 17 H CYS 3 H CYS 3 16.572 25.537 16.016 18 HA CYS 3 HA CYS 3 17.615 25.674 18.768 19 HB2 CYS 3 HB2 CYS 3 19.036 24.573 17.259 20 HB3 CYS 3 HB3 CYS 3 18.689 25.711 15.958 21 H ASN 4 H ASN 4 18.593 27.522 19.684 22 HA ASN 4 HA ASN 4 18.413 30.109 18.207 23 HB2 ASN 4 HB2 ASN 4 17.611 29.674 21.120 24 HB3 ASN 4 HB3 ASN 4 17.804 31.246 20.330 25 HD21 ASN 4 HD21 ASN 4 14.757 30.758 18.372 26 HD22 ASN 4 HD22 ASN 4 16.433 30.972 17.897 27 H LEU 5 H LEU 5 20.740 29.399 17.716 28 HA LEU 5 HA LEU 5 22.568 28.698 19.639 29 HB2 LEU 5 HB2 LEU 5 22.665 28.353 17.317 30 HB3 LEU 5 HB3 LEU 5 23.028 30.040 17.030 31 HG LEU 5 HG LEU 5 25.001 29.875 18.065 32 HD11 LEU 5 HD11 LEU 5 24.317 27.157 19.299 33 HD12 LEU 5 HD12 LEU 5 25.960 27.824 19.268 34 HD13 LEU 5 HD13 LEU 5 24.722 28.637 20.194 35 HD21 LEU 5 HD21 LEU 5 26.151 27.925 17.034 36 HD22 LEU 5 HD22 LEU 5 24.535 27.140 16.944 37 HD23 LEU 5 HD23 LEU 5 24.894 28.585 15.957 38 H ARG 6 H ARG 6 21.773 31.878 18.276 39 HA ARG 6 HA ARG 6 23.782 33.431 19.574 40 HB2 ARG 6 HB2 ARG 6 22.253 34.095 17.661 41 HB3 ARG 6 HB3 ARG 6 21.003 34.445 18.869 42 HG2 ARG 6 HG2 ARG 6 22.468 36.138 19.917 43 HG3 ARG 6 HG3 ARG 6 23.794 35.674 18.827 44 HD2 ARG 6 HD2 ARG 6 22.893 37.668 17.948 45 HD3 ARG 6 HD3 ARG 6 22.354 36.372 16.885 46 HE ARG 6 HE ARG 6 20.403 36.933 18.977 47 HH11 ARG 6 HH11 ARG 6 21.510 38.260 15.889 48 HH12 ARG 6 HH12 ARG 6 19.901 38.877 15.539 49 HH21 ARG 6 HH21 ARG 6 18.581 37.901 18.539 50 HH22 ARG 6 HH22 ARG 6 18.416 38.982 17.154 51 H ARG 7 H ARG 7 20.589 32.503 20.894 52 HA ARG 7 HA ARG 7 21.017 33.808 23.479 53 HB2 ARG 7 HB2 ARG 7 18.749 33.303 22.661 54 HB3 ARG 7 HB3 ARG 7 19.122 31.570 22.597 55 HG2 ARG 7 HG2 ARG 7 19.387 31.514 25.067 56 HG3 ARG 7 HG3 ARG 7 19.129 33.257 25.127 57 HD2 ARG 7 HD2 ARG 7 17.072 32.317 25.748 58 HD3 ARG 7 HD3 ARG 7 16.851 32.868 24.094 59 HE ARG 7 HE ARG 7 17.505 30.000 24.714 60 HH11 ARG 7 HH11 ARG 7 15.156 32.222 23.264 61 HH12 ARG 7 HH12 ARG 7 13.983 30.961 23.062 62 HH21 ARG 7 HH21 ARG 7 15.958 28.417 24.253 63 HH22 ARG 7 HH22 ARG 7 14.379 28.952 23.750 64 H CYS 8 H CYS 8 21.366 30.515 22.218 65 HA CYS 8 HA CYS 8 22.077 29.129 24.519 66 HB2 CYS 8 HB2 CYS 8 21.497 28.188 22.266 67 HB3 CYS 8 HB3 CYS 8 23.046 28.767 21.674 68 H GLU 9 H GLU 9 24.349 30.791 22.255 69 HA GLU 9 HA GLU 9 26.769 30.136 23.588 70 HB2 GLU 9 HB2 GLU 9 25.945 32.442 21.795 71 HB3 GLU 9 HB3 GLU 9 27.581 32.300 22.457 72 HG2 GLU 9 HG2 GLU 9 27.762 30.000 21.426 73 HG3 GLU 9 HG3 GLU 9 26.237 30.271 20.610 74 H LEU 10 H LEU 10 24.546 32.870 24.204 75 HA LEU 10 HA LEU 10 26.232 34.098 26.237 76 HB2 LEU 10 HB2 LEU 10 23.238 34.343 25.713 77 HB3 LEU 10 HB3 LEU 10 24.169 35.382 26.784 78 HG LEU 10 HG LEU 10 24.623 35.166 23.781 79 HD11 LEU 10 HD11 LEU 10 23.163 37.288 25.414 80 HD12 LEU 10 HD12 LEU 10 23.505 37.364 23.672 81 HD13 LEU 10 HD13 LEU 10 22.412 36.122 24.298 82 HD21 LEU 10 HD21 LEU 10 25.900 37.257 24.064 83 HD22 LEU 10 HD22 LEU 10 25.655 37.182 25.821 84 HD23 LEU 10 HD23 LEU 10 26.634 35.944 24.991 85 H SER 11 H SER 11 23.585 31.719 26.291 86 HA SER 11 HA SER 11 23.147 31.705 29.097 87 HB2 SER 11 HB2 SER 11 21.689 30.682 27.308 88 HB3 SER 11 HB3 SER 11 22.822 29.324 27.235 89 HG SER 11 HG SER 11 21.781 28.555 28.906 90 H CYS 12 H CYS 12 25.300 29.567 27.152 91 HA CYS 12 HA CYS 12 26.371 28.222 29.471 92 HB2 CYS 12 HB2 CYS 12 27.417 28.448 26.636 93 HB3 CYS 12 HB3 CYS 12 27.990 27.306 27.858 94 H ARG 13 H ARG 13 27.338 31.226 27.867 95 HA ARG 13 HA ARG 13 30.003 31.472 28.757 96 HB2 ARG 13 HB2 ARG 13 28.734 32.980 27.171 97 HB3 ARG 13 HB3 ARG 13 27.919 33.681 28.572 98 HG2 ARG 13 HG2 ARG 13 30.199 34.398 29.434 99 HG3 ARG 13 HG3 ARG 13 30.907 33.756 27.943 100 HD2 ARG 13 HD2 ARG 13 30.622 36.146 27.713 101 HD3 ARG 13 HD3 ARG 13 29.485 35.326 26.629 102 HE ARG 13 HE ARG 13 28.237 35.890 29.182 103 HH11 ARG 13 HH11 ARG 13 29.147 37.676 26.238 104 HH12 ARG 13 HH12 ARG 13 27.843 38.819 26.556 105 HH21 ARG 13 HH21 ARG 13 26.682 37.318 29.354 106 HH22 ARG 13 HH22 ARG 13 26.506 38.610 28.139 107 H SER 14 H SER 14 27.032 31.963 30.633 108 HA SER 14 HA SER 14 28.243 33.088 32.985 109 HB2 SER 14 HB2 SER 14 25.757 31.398 32.573 110 HB3 SER 14 HB3 SER 14 26.135 32.292 34.056 111 HG SER 14 HG SER 14 25.596 34.084 33.165 112 H LEU 15 H LEU 15 28.062 29.750 31.818 113 HA LEU 15 HA LEU 15 28.815 28.584 34.432 114 HB2 LEU 15 HB2 LEU 15 28.399 27.297 31.698 115 HB3 LEU 15 HB3 LEU 15 28.607 26.452 33.227 116 HG LEU 15 HG LEU 15 26.243 28.225 32.462 117 HD11 LEU 15 HD11 LEU 15 26.293 26.040 31.333 118 HD12 LEU 15 HD12 LEU 15 26.488 25.219 32.898 119 HD13 LEU 15 HD13 LEU 15 24.992 26.106 32.528 120 HD21 LEU 15 HD21 LEU 15 26.611 28.424 34.859 121 HD22 LEU 15 HD22 LEU 15 25.248 27.344 34.586 122 HD23 LEU 15 HD23 LEU 15 26.825 26.661 35.021 123 H GLY 16 H GLY 16 30.454 29.851 31.712 124 HA2 GLY 16 HA2 GLY 16 32.802 30.071 31.472 125 HA3 GLY 16 HA3 GLY 16 33.062 28.681 32.539 126 H LEU 17 H LEU 17 30.615 28.472 30.039 127 HA LEU 17 HA LEU 17 32.297 26.544 28.528 128 HB2 LEU 17 HB2 LEU 17 29.326 26.359 29.047 129 HB3 LEU 17 HB3 LEU 17 30.335 25.141 28.255 130 HG LEU 17 HG LEU 17 30.335 25.979 31.149 131 HD11 LEU 17 HD11 LEU 17 29.442 23.386 29.867 132 HD12 LEU 17 HD12 LEU 17 29.489 23.724 31.608 133 HD13 LEU 17 HD13 LEU 17 28.394 24.648 30.577 134 HD21 LEU 17 HD21 LEU 17 32.629 25.222 30.470 135 HD22 LEU 17 HD22 LEU 17 31.872 24.043 31.542 136 HD23 LEU 17 HD23 LEU 17 31.925 23.741 29.792 137 H LEU 18 H LEU 18 31.278 26.028 26.331 138 HA LEU 18 HA LEU 18 30.450 28.559 24.954 139 HB2 LEU 18 HB2 LEU 18 31.410 25.951 23.763 140 HB3 LEU 18 HB3 LEU 18 31.076 27.446 22.888 141 HG LEU 18 HG LEU 18 33.326 27.000 24.901 142 HD11 LEU 18 HD11 LEU 18 33.372 27.376 21.886 143 HD12 LEU 18 HD12 LEU 18 34.788 27.176 22.938 144 HD13 LEU 18 HD13 LEU 18 33.635 25.844 22.745 145 HD21 LEU 18 HD21 LEU 18 32.617 29.356 24.968 146 HD22 LEU 18 HD22 LEU 18 34.162 29.217 24.129 147 HD23 LEU 18 HD23 LEU 18 32.673 29.443 23.191 148 H GLY 19 H GLY 19 28.515 28.611 23.802 149 HA2 GLY 19 HA2 GLY 19 26.576 26.393 24.332 150 HA3 GLY 19 HA3 GLY 19 26.171 28.002 23.764 151 H LYS 20 H LYS 20 25.999 24.980 22.837 152 HA LYS 20 HA LYS 20 26.212 25.462 19.915 153 HB2 LYS 20 HB2 LYS 20 27.123 23.036 21.557 154 HB3 LYS 20 HB3 LYS 20 27.035 23.062 19.798 155 HG2 LYS 20 HG2 LYS 20 28.846 24.873 21.483 156 HG3 LYS 20 HG3 LYS 20 29.347 23.402 20.609 157 HD2 LYS 20 HD2 LYS 20 28.468 24.491 18.496 158 HD3 LYS 20 HD3 LYS 20 28.196 25.944 19.480 159 HE2 LYS 20 HE2 LYS 20 30.684 25.896 20.052 160 HE3 LYS 20 HE3 LYS 20 30.856 24.613 18.841 161 HZ1 LYS 20 HZ1 LYS 20 31.271 26.701 17.758 162 HZ2 LYS 20 HZ2 LYS 20 29.777 26.226 17.256 163 HZ3 LYS 20 HZ3 LYS 20 29.898 27.383 18.397 164 H CYS 21 H CYS 21 24.646 24.545 18.661 165 HA CYS 21 HA CYS 21 22.363 23.252 20.088 166 HB2 CYS 21 HB2 CYS 21 22.605 24.499 17.355 167 HB3 CYS 21 HB3 CYS 21 21.222 23.541 17.865 168 H ILE 22 H ILE 22 21.949 21.170 19.935 169 HA ILE 22 HA ILE 22 22.892 19.513 17.671 170 HB ILE 22 HB ILE 22 23.525 18.924 20.589 171 HG12 ILE 22 HG12 ILE 22 25.256 19.380 18.111 172 HG13 ILE 22 HG13 ILE 22 25.159 20.401 19.544 173 HG21 ILE 22 HG21 ILE 22 24.408 16.753 19.830 174 HG22 ILE 22 HG22 ILE 22 22.696 16.864 19.480 175 HG23 ILE 22 HG23 ILE 22 23.880 17.098 18.170 176 HD11 ILE 22 HD11 ILE 22 27.231 19.242 19.598 177 HD12 ILE 22 HD12 ILE 22 26.213 18.585 20.894 178 HD13 ILE 22 HD13 ILE 22 26.452 17.676 19.382 179 H GLY 23 H GLY 23 21.362 17.967 17.076 180 HA2 GLY 23 HA2 GLY 23 19.243 17.088 16.903 181 HA3 GLY 23 HA3 GLY 23 19.133 17.149 18.675 182 H GLU 24 H GLU 24 19.651 20.089 16.804 183 HA GLU 24 HA GLU 24 18.547 22.015 16.627 184 HB2 GLU 24 HB2 GLU 24 15.934 20.489 16.665 185 HB3 GLU 24 HB3 GLU 24 16.220 22.121 16.065 186 HG2 GLU 24 HG2 GLU 24 17.764 21.251 14.340 187 HG3 GLU 24 HG3 GLU 24 17.481 19.600 14.904 188 H GLU 25 H GLU 25 19.092 20.916 19.445 189 HA GLU 25 HA GLU 25 17.846 23.276 20.741 190 HB2 GLU 25 HB2 GLU 25 16.450 21.392 21.347 191 HB3 GLU 25 HB3 GLU 25 17.864 20.444 21.809 192 HG2 GLU 25 HG2 GLU 25 16.720 21.163 23.754 193 HG3 GLU 25 HG3 GLU 25 18.280 21.934 23.728 194 H CYS 26 H CYS 26 18.975 24.067 22.547 195 HA CYS 26 HA CYS 26 21.833 24.149 22.153 196 HB2 CYS 26 HB2 CYS 26 20.513 26.111 22.688 197 HB3 CYS 26 HB3 CYS 26 19.915 25.349 24.160 198 H LYS 27 H LYS 27 23.472 23.367 23.333 199 HA LYS 27 HA LYS 27 23.193 22.668 26.144 200 HB2 LYS 27 HB2 LYS 27 24.394 20.588 25.941 201 HB3 LYS 27 HB3 LYS 27 22.842 20.501 25.108 202 HG2 LYS 27 HG2 LYS 27 24.068 20.853 22.925 203 HG3 LYS 27 HG3 LYS 27 25.601 20.806 23.803 204 HD2 LYS 27 HD2 LYS 27 23.523 18.573 23.735 205 HD3 LYS 27 HD3 LYS 27 24.983 18.625 22.743 206 HE2 LYS 27 HE2 LYS 27 26.409 18.540 24.748 207 HE3 LYS 27 HE3 LYS 27 24.983 18.592 25.788 208 HZ1 LYS 27 HZ1 LYS 27 24.249 16.509 24.707 209 HZ2 LYS 27 HZ2 LYS 27 25.667 16.397 23.910 210 HZ3 LYS 27 HZ3 LYS 27 25.627 16.336 25.573 211 H CYS 28 H CYS 28 25.346 22.466 27.169 212 HA CYS 28 HA CYS 28 27.214 24.396 25.912 213 HB2 CYS 28 HB2 CYS 28 27.249 23.357 28.744 214 HB3 CYS 28 HB3 CYS 28 28.129 24.721 28.089 215 H VAL 29 H VAL 29 29.410 24.050 25.730 216 HA VAL 29 HA VAL 29 30.506 21.309 26.160 217 HB VAL 29 HB VAL 29 31.643 21.328 24.037 218 HG11 VAL 29 HG11 VAL 29 28.669 21.807 23.559 219 HG12 VAL 29 HG12 VAL 29 29.784 20.870 22.545 220 HG13 VAL 29 HG13 VAL 29 29.381 20.295 24.170 221 HG21 VAL 29 HG21 VAL 29 31.101 22.909 22.236 222 HG22 VAL 29 HG22 VAL 29 30.155 23.893 23.376 223 HG23 VAL 29 HG23 VAL 29 31.915 23.695 23.583 224 H TYR 30 H TYR 30 32.818 21.220 26.401 225 HA TYR 30 HA TYR 30 33.689 23.421 28.036 226 HB2 TYR 30 HB2 TYR 30 35.036 20.852 27.169 227 HB3 TYR 30 HB3 TYR 30 35.806 22.022 28.231 228 HD1 TYR 30 HD1 TYR 30 33.660 19.165 28.164 229 HD2 TYR 30 HD2 TYR 30 34.539 22.765 30.371 230 HE1 TYR 30 HE1 TYR 30 32.683 18.152 30.212 231 HE2 TYR 30 HE2 TYR 30 33.557 21.749 32.418 232 HH TYR 30 HH TYR 30 32.953 18.380 32.619 233 H ASN 31 H ASN 31 34.661 22.519 24.720 234 HA ASN 31 HA ASN 31 35.670 25.143 24.184 235 HB2 ASN 31 HB2 ASN 31 38.029 24.569 23.705 236 HB3 ASN 31 HB3 ASN 31 37.670 24.416 25.406 237 HD21 ASN 31 HD21 ASN 31 38.938 21.152 23.357 238 HD22 ASN 31 HD22 ASN 31 38.618 22.665 22.519 Start of MODEL 3 1 H1 ALA 1 H1 ALA 1 11.709 20.948 15.881 2 H2 ALA 1 H2 ALA 1 10.470 22.030 16.036 3 H3 ALA 1 H3 ALA 1 10.500 20.661 16.960 4 HA ALA 1 HA ALA 1 11.122 22.732 18.140 5 HB1 ALA 1 HB1 ALA 1 13.060 21.708 19.310 6 HB2 ALA 1 HB2 ALA 1 11.741 20.547 19.070 7 HB3 ALA 1 HB3 ALA 1 13.180 20.481 18.024 8 H PHE 2 H PHE 2 12.912 24.369 18.485 9 HA PHE 2 HA PHE 2 14.956 24.590 16.340 10 HB2 PHE 2 HB2 PHE 2 13.198 25.615 15.247 11 HB3 PHE 2 HB3 PHE 2 12.424 26.164 16.735 12 HD1 PHE 2 HD1 PHE 2 12.822 28.250 17.659 13 HD2 PHE 2 HD2 PHE 2 15.499 26.669 14.667 14 HE1 PHE 2 HE1 PHE 2 14.109 30.305 17.745 15 HE2 PHE 2 HE2 PHE 2 16.855 28.702 14.819 16 HZ PHE 2 HZ PHE 2 16.158 30.598 16.289 17 H CYS 3 H CYS 3 16.762 25.629 17.015 18 HA CYS 3 HA CYS 3 16.909 26.539 19.856 19 HB2 CYS 3 HB2 CYS 3 17.907 24.461 19.713 20 HB3 CYS 3 HB3 CYS 3 18.675 24.796 18.164 21 H ASN 4 H ASN 4 18.174 28.206 20.412 22 HA ASN 4 HA ASN 4 18.817 30.166 18.233 23 HB2 ASN 4 HB2 ASN 4 17.933 30.619 21.117 24 HB3 ASN 4 HB3 ASN 4 18.425 31.886 19.995 25 HD21 ASN 4 HD21 ASN 4 15.319 32.017 18.345 26 HD22 ASN 4 HD22 ASN 4 17.006 32.476 18.251 27 H LEU 5 H LEU 5 20.905 29.424 17.885 28 HA LEU 5 HA LEU 5 22.855 28.533 19.567 29 HB2 LEU 5 HB2 LEU 5 22.674 28.620 17.107 30 HB3 LEU 5 HB3 LEU 5 23.114 30.309 17.114 31 HG LEU 5 HG LEU 5 24.786 28.676 16.471 32 HD11 LEU 5 HD11 LEU 5 25.447 30.966 17.170 33 HD12 LEU 5 HD12 LEU 5 25.750 30.350 18.813 34 HD13 LEU 5 HD13 LEU 5 26.715 29.762 17.458 35 HD21 LEU 5 HD21 LEU 5 25.091 28.007 19.414 36 HD22 LEU 5 HD22 LEU 5 24.377 26.942 18.167 37 HD23 LEU 5 HD23 LEU 5 26.087 27.407 18.080 38 H ARG 6 H ARG 6 22.376 31.955 18.649 39 HA ARG 6 HA ARG 6 24.646 32.939 20.137 40 HB2 ARG 6 HB2 ARG 6 23.485 34.022 18.190 41 HB3 ARG 6 HB3 ARG 6 22.168 34.491 19.253 42 HG2 ARG 6 HG2 ARG 6 25.088 35.277 19.712 43 HG3 ARG 6 HG3 ARG 6 24.003 36.208 18.695 44 HD2 ARG 6 HD2 ARG 6 23.625 35.747 21.682 45 HD3 ARG 6 HD3 ARG 6 24.237 37.188 20.908 46 HE ARG 6 HE ARG 6 21.460 36.167 20.369 47 HH11 ARG 6 HH11 ARG 6 23.482 39.010 21.138 48 HH12 ARG 6 HH12 ARG 6 22.080 40.037 20.867 49 HH21 ARG 6 HH21 ARG 6 19.891 37.544 20.161 50 HH22 ARG 6 HH22 ARG 6 20.148 39.265 20.403 51 H ARG 7 H ARG 7 21.200 32.753 21.031 52 HA ARG 7 HA ARG 7 21.595 33.911 23.678 53 HB2 ARG 7 HB2 ARG 7 19.422 33.887 22.383 54 HB3 ARG 7 HB3 ARG 7 19.322 32.157 22.657 55 HG2 ARG 7 HG2 ARG 7 17.896 33.347 24.234 56 HG3 ARG 7 HG3 ARG 7 19.198 32.526 25.103 57 HD2 ARG 7 HD2 ARG 7 18.826 34.697 26.084 58 HD3 ARG 7 HD3 ARG 7 20.404 34.708 25.309 59 HE ARG 7 HE ARG 7 18.153 35.746 23.680 60 HH11 ARG 7 HH11 ARG 7 20.496 36.840 26.077 61 HH12 ARG 7 HH12 ARG 7 20.461 38.455 25.360 62 HH21 ARG 7 HH21 ARG 7 18.088 37.796 23.087 63 HH22 ARG 7 HH22 ARG 7 19.135 38.988 23.859 64 H CYS 8 H CYS 8 21.587 30.610 22.408 65 HA CYS 8 HA CYS 8 21.935 29.179 24.852 66 HB2 CYS 8 HB2 CYS 8 21.287 28.180 22.693 67 HB3 CYS 8 HB3 CYS 8 22.837 28.618 22.010 68 H GLU 9 H GLU 9 24.431 30.452 22.545 69 HA GLU 9 HA GLU 9 26.740 29.825 24.020 70 HB2 GLU 9 HB2 GLU 9 26.055 32.004 22.050 71 HB3 GLU 9 HB3 GLU 9 27.620 32.019 22.841 72 HG2 GLU 9 HG2 GLU 9 26.666 29.501 21.459 73 HG3 GLU 9 HG3 GLU 9 27.313 30.840 20.514 74 H LEU 10 H LEU 10 24.834 32.900 24.258 75 HA LEU 10 HA LEU 10 26.460 34.022 26.346 76 HB2 LEU 10 HB2 LEU 10 23.558 34.477 25.529 77 HB3 LEU 10 HB3 LEU 10 24.379 35.449 26.741 78 HG LEU 10 HG LEU 10 25.274 35.231 23.835 79 HD11 LEU 10 HD11 LEU 10 24.344 37.512 23.622 80 HD12 LEU 10 HD12 LEU 10 23.080 36.345 24.050 81 HD13 LEU 10 HD13 LEU 10 23.742 37.433 25.289 82 HD21 LEU 10 HD21 LEU 10 27.133 35.843 25.327 83 HD22 LEU 10 HD22 LEU 10 26.622 37.244 24.386 84 HD23 LEU 10 HD23 LEU 10 26.136 37.104 26.090 85 H SER 11 H SER 11 23.685 31.834 26.467 86 HA SER 11 HA SER 11 23.296 31.974 29.312 87 HB2 SER 11 HB2 SER 11 22.560 29.745 27.376 88 HB3 SER 11 HB3 SER 11 21.980 29.927 29.041 89 HG SER 11 HG SER 11 21.512 31.623 26.815 90 H CYS 12 H CYS 12 25.170 29.699 27.230 91 HA CYS 12 HA CYS 12 26.247 28.184 29.447 92 HB2 CYS 12 HB2 CYS 12 27.202 28.545 26.590 93 HB3 CYS 12 HB3 CYS 12 27.811 27.341 27.719 94 H ARG 13 H ARG 13 27.377 31.099 27.714 95 HA ARG 13 HA ARG 13 30.000 31.283 28.683 96 HB2 ARG 13 HB2 ARG 13 28.660 32.704 26.951 97 HB3 ARG 13 HB3 ARG 13 28.200 33.715 28.303 98 HG2 ARG 13 HG2 ARG 13 30.488 34.329 28.696 99 HG3 ARG 13 HG3 ARG 13 31.106 33.068 27.618 100 HD2 ARG 13 HD2 ARG 13 29.354 35.384 26.700 101 HD3 ARG 13 HD3 ARG 13 31.128 35.406 26.652 102 HE ARG 13 HE ARG 13 30.396 33.053 25.329 103 HH11 ARG 13 HH11 ARG 13 29.560 36.429 24.672 104 HH12 ARG 13 HH12 ARG 13 29.553 36.101 22.933 105 HH21 ARG 13 HH21 ARG 13 30.441 32.830 23.164 106 HH22 ARG 13 HH22 ARG 13 29.843 34.117 22.144 107 H SER 14 H SER 14 27.018 32.196 30.301 108 HA SER 14 HA SER 14 28.087 33.432 32.628 109 HB2 SER 14 HB2 SER 14 25.584 31.715 32.395 110 HB3 SER 14 HB3 SER 14 25.961 32.876 33.682 111 HG SER 14 HG SER 14 25.239 33.354 31.002 112 H LEU 15 H LEU 15 27.867 29.973 31.797 113 HA LEU 15 HA LEU 15 28.922 29.100 34.433 114 HB2 LEU 15 HB2 LEU 15 28.552 27.460 31.905 115 HB3 LEU 15 HB3 LEU 15 28.710 26.883 33.550 116 HG LEU 15 HG LEU 15 26.325 28.340 32.328 117 HD11 LEU 15 HD11 LEU 15 26.554 26.017 31.617 118 HD12 LEU 15 HD12 LEU 15 26.676 25.477 33.306 119 HD13 LEU 15 HD13 LEU 15 25.172 26.202 32.699 120 HD21 LEU 15 HD21 LEU 15 26.696 27.279 35.174 121 HD22 LEU 15 HD22 LEU 15 26.503 28.976 34.705 122 HD23 LEU 15 HD23 LEU 15 25.165 27.852 34.479 123 H GLY 16 H GLY 16 30.106 30.095 31.350 124 HA2 GLY 16 HA2 GLY 16 32.414 30.655 30.923 125 HA3 GLY 16 HA3 GLY 16 32.914 29.290 31.935 126 H LEU 17 H LEU 17 30.329 28.117 30.280 127 HA LEU 17 HA LEU 17 32.060 26.621 28.447 128 HB2 LEU 17 HB2 LEU 17 29.085 26.321 28.914 129 HB3 LEU 17 HB3 LEU 17 30.161 25.147 28.146 130 HG LEU 17 HG LEU 17 30.042 25.988 31.036 131 HD11 LEU 17 HD11 LEU 17 28.206 24.557 30.423 132 HD12 LEU 17 HD12 LEU 17 29.332 23.355 29.725 133 HD13 LEU 17 HD13 LEU 17 29.325 23.683 31.470 134 HD21 LEU 17 HD21 LEU 17 32.393 25.422 30.467 135 HD22 LEU 17 HD22 LEU 17 31.687 24.152 31.474 136 HD23 LEU 17 HD23 LEU 17 31.845 23.901 29.721 137 H LEU 18 H LEU 18 31.139 26.136 26.227 138 HA LEU 18 HA LEU 18 30.154 28.629 24.888 139 HB2 LEU 18 HB2 LEU 18 31.297 26.079 23.694 140 HB3 LEU 18 HB3 LEU 18 30.650 27.456 22.803 141 HG LEU 18 HG LEU 18 32.485 28.889 23.826 142 HD11 LEU 18 HD11 LEU 18 34.583 27.638 24.476 143 HD12 LEU 18 HD12 LEU 18 33.317 27.574 25.693 144 HD13 LEU 18 HD13 LEU 18 33.600 26.166 24.638 145 HD21 LEU 18 HD21 LEU 18 32.531 27.994 21.520 146 HD22 LEU 18 HD22 LEU 18 34.155 28.066 22.223 147 HD23 LEU 18 HD23 LEU 18 33.307 26.508 22.117 148 H GLY 19 H GLY 19 28.342 28.272 23.366 149 HA2 GLY 19 HA2 GLY 19 26.522 25.992 24.147 150 HA3 GLY 19 HA3 GLY 19 25.940 27.598 23.740 151 H LYS 20 H LYS 20 25.731 24.726 22.534 152 HA LYS 20 HA LYS 20 25.836 25.530 19.683 153 HB2 LYS 20 HB2 LYS 20 26.798 22.880 20.863 154 HB3 LYS 20 HB3 LYS 20 26.754 23.281 19.146 155 HG2 LYS 20 HG2 LYS 20 28.488 24.685 21.238 156 HG3 LYS 20 HG3 LYS 20 29.048 23.447 20.106 157 HD2 LYS 20 HD2 LYS 20 28.609 24.905 18.206 158 HD3 LYS 20 HD3 LYS 20 27.765 26.043 19.251 159 HE2 LYS 20 HE2 LYS 20 30.075 26.122 20.561 160 HE3 LYS 20 HE3 LYS 20 30.718 25.550 19.014 161 HZ1 LYS 20 HZ1 LYS 20 29.355 27.522 18.070 162 HZ2 LYS 20 HZ2 LYS 20 29.361 28.102 19.632 163 HZ3 LYS 20 HZ3 LYS 20 30.760 27.863 18.832 164 H CYS 21 H CYS 21 24.329 24.613 18.313 165 HA CYS 21 HA CYS 21 21.944 23.465 19.681 166 HB2 CYS 21 HB2 CYS 21 22.346 24.609 16.905 167 HB3 CYS 21 HB3 CYS 21 20.840 23.916 17.491 168 H ILE 22 H ILE 22 21.970 21.324 19.895 169 HA ILE 22 HA ILE 22 23.041 19.594 17.681 170 HB ILE 22 HB ILE 22 23.132 19.042 20.659 171 HG12 ILE 22 HG12 ILE 22 24.724 20.822 20.198 172 HG13 ILE 22 HG13 ILE 22 25.517 19.323 20.624 173 HG21 ILE 22 HG21 ILE 22 22.963 16.979 19.388 174 HG22 ILE 22 HG22 ILE 22 24.247 17.498 18.283 175 HG23 ILE 22 HG23 ILE 22 24.612 17.148 19.984 176 HD11 ILE 22 HD11 ILE 22 26.118 18.920 18.258 177 HD12 ILE 22 HD12 ILE 22 25.278 20.415 17.786 178 HD13 ILE 22 HD13 ILE 22 26.709 20.487 18.825 179 H GLY 23 H GLY 23 21.310 18.754 16.638 180 HA2 GLY 23 HA2 GLY 23 19.329 17.638 16.269 181 HA3 GLY 23 HA3 GLY 23 19.354 17.079 17.947 182 H GLU 24 H GLU 24 19.122 20.355 16.480 183 HA GLU 24 HA GLU 24 17.939 22.171 16.982 184 HB2 GLU 24 HB2 GLU 24 15.540 20.383 17.250 185 HB3 GLU 24 HB3 GLU 24 15.641 22.017 16.600 186 HG2 GLU 24 HG2 GLU 24 16.731 19.455 15.335 187 HG3 GLU 24 HG3 GLU 24 15.362 20.387 14.813 188 H GLU 25 H GLU 25 19.042 20.831 19.437 189 HA GLU 25 HA GLU 25 17.540 22.472 21.425 190 HB2 GLU 25 HB2 GLU 25 16.925 20.117 21.699 191 HB3 GLU 25 HB3 GLU 25 18.617 19.663 21.828 192 HG2 GLU 25 HG2 GLU 25 18.840 20.988 23.907 193 HG3 GLU 25 HG3 GLU 25 17.172 21.547 23.743 194 H CYS 26 H CYS 26 18.758 23.698 22.795 195 HA CYS 26 HA CYS 26 21.539 24.186 22.255 196 HB2 CYS 26 HB2 CYS 26 20.069 25.932 23.071 197 HB3 CYS 26 HB3 CYS 26 19.630 24.965 24.482 198 H LYS 27 H LYS 27 23.323 23.222 23.025 199 HA LYS 27 HA LYS 27 23.315 21.972 25.738 200 HB2 LYS 27 HB2 LYS 27 23.164 20.252 23.842 201 HB3 LYS 27 HB3 LYS 27 24.774 20.762 23.354 202 HG2 LYS 27 HG2 LYS 27 25.571 20.195 25.703 203 HG3 LYS 27 HG3 LYS 27 23.943 19.575 26.040 204 HD2 LYS 27 HD2 LYS 27 25.870 18.539 23.930 205 HD3 LYS 27 HD3 LYS 27 25.570 17.797 25.498 206 HE2 LYS 27 HE2 LYS 27 23.190 17.404 24.868 207 HE3 LYS 27 HE3 LYS 27 23.502 18.136 23.282 208 HZ1 LYS 27 HZ1 LYS 27 24.740 15.637 24.322 209 HZ2 LYS 27 HZ2 LYS 27 23.692 15.758 23.080 210 HZ3 LYS 27 HZ3 LYS 27 25.219 16.370 22.950 211 H CYS 28 H CYS 28 25.280 22.289 26.896 212 HA CYS 28 HA CYS 28 27.045 24.333 25.699 213 HB2 CYS 28 HB2 CYS 28 27.087 23.367 28.552 214 HB3 CYS 28 HB3 CYS 28 27.922 24.748 27.889 215 H VAL 29 H VAL 29 29.304 24.148 25.632 216 HA VAL 29 HA VAL 29 30.520 21.449 25.993 217 HB VAL 29 HB VAL 29 31.524 21.430 23.833 218 HG11 VAL 29 HG11 VAL 29 28.579 22.083 23.366 219 HG12 VAL 29 HG12 VAL 29 29.642 21.051 22.390 220 HG13 VAL 29 HG13 VAL 29 29.185 20.545 24.017 221 HG21 VAL 29 HG21 VAL 29 31.000 23.062 22.054 222 HG22 VAL 29 HG22 VAL 29 30.126 24.071 23.228 223 HG23 VAL 29 HG23 VAL 29 31.882 23.805 23.379 224 H TYR 30 H TYR 30 32.828 21.430 26.217 225 HA TYR 30 HA TYR 30 33.746 23.839 27.633 226 HB2 TYR 30 HB2 TYR 30 35.026 21.137 27.209 227 HB3 TYR 30 HB3 TYR 30 35.719 22.401 28.195 228 HD1 TYR 30 HD1 TYR 30 33.349 19.657 28.107 229 HD2 TYR 30 HD2 TYR 30 34.604 23.134 30.320 230 HE1 TYR 30 HE1 TYR 30 32.264 18.740 30.149 231 HE2 TYR 30 HE2 TYR 30 33.506 22.213 32.368 232 HH TYR 30 HH TYR 30 32.191 18.941 32.518 233 H ASN 31 H ASN 31 34.504 22.473 24.464 234 HA ASN 31 HA ASN 31 36.777 24.390 24.119 235 HB2 ASN 31 HB2 ASN 31 36.793 21.429 23.379 236 HB3 ASN 31 HB3 ASN 31 38.045 22.586 22.969 237 HD21 ASN 31 HD21 ASN 31 37.996 20.916 26.658 238 HD22 ASN 31 HD22 ASN 31 36.687 20.620 25.519 Start of MODEL 4 1 H1 ALA 1 H1 ALA 1 11.646 23.157 20.727 2 H2 ALA 1 H2 ALA 1 11.847 21.722 19.881 3 H3 ALA 1 H3 ALA 1 10.452 22.032 20.668 4 HA ALA 1 HA ALA 1 10.196 22.241 18.339 5 HB1 ALA 1 HB1 ALA 1 8.700 23.525 19.781 6 HB2 ALA 1 HB2 ALA 1 9.837 24.879 19.799 7 HB3 ALA 1 HB3 ALA 1 9.050 24.398 18.278 8 H PHE 2 H PHE 2 12.026 25.227 19.312 9 HA PHE 2 HA PHE 2 13.885 24.789 17.049 10 HB2 PHE 2 HB2 PHE 2 12.278 27.315 17.547 11 HB3 PHE 2 HB3 PHE 2 13.627 27.178 16.423 12 HD1 PHE 2 HD1 PHE 2 10.097 26.295 17.040 13 HD2 PHE 2 HD2 PHE 2 13.442 25.849 14.356 14 HE1 PHE 2 HE1 PHE 2 8.618 25.226 15.367 15 HE2 PHE 2 HE2 PHE 2 11.956 24.817 12.670 16 HZ PHE 2 HZ PHE 2 9.534 24.485 13.170 17 H CYS 3 H CYS 3 15.898 26.007 17.268 18 HA CYS 3 HA CYS 3 16.498 26.820 20.073 19 HB2 CYS 3 HB2 CYS 3 18.679 25.956 19.741 20 HB3 CYS 3 HB3 CYS 3 17.526 24.715 19.335 21 H ASN 4 H ASN 4 18.449 28.265 20.269 22 HA ASN 4 HA ASN 4 19.058 29.920 17.948 23 HB2 ASN 4 HB2 ASN 4 17.242 31.092 19.346 24 HB3 ASN 4 HB3 ASN 4 18.389 31.132 20.664 25 HD21 ASN 4 HD21 ASN 4 19.352 33.113 17.284 26 HD22 ASN 4 HD22 ASN 4 18.151 31.836 17.233 27 H LEU 5 H LEU 5 21.092 29.315 17.738 28 HA LEU 5 HA LEU 5 22.875 28.428 19.718 29 HB2 LEU 5 HB2 LEU 5 22.829 28.491 17.021 30 HB3 LEU 5 HB3 LEU 5 23.958 29.813 17.261 31 HG LEU 5 HG LEU 5 24.293 27.054 18.527 32 HD11 LEU 5 HD11 LEU 5 25.796 26.489 16.660 33 HD12 LEU 5 HD12 LEU 5 24.146 26.792 16.081 34 HD13 LEU 5 HD13 LEU 5 25.399 28.030 15.868 35 HD21 LEU 5 HD21 LEU 5 25.722 28.773 19.517 36 HD22 LEU 5 HD22 LEU 5 26.704 27.684 18.535 37 HD23 LEU 5 HD23 LEU 5 26.278 29.293 17.907 38 H ARG 6 H ARG 6 22.480 31.752 18.417 39 HA ARG 6 HA ARG 6 24.460 33.042 19.985 40 HB2 ARG 6 HB2 ARG 6 23.378 34.212 18.168 41 HB3 ARG 6 HB3 ARG 6 21.800 33.984 18.876 42 HG2 ARG 6 HG2 ARG 6 22.213 36.228 19.216 43 HG3 ARG 6 HG3 ARG 6 22.527 35.542 20.793 44 HD2 ARG 6 HD2 ARG 6 24.540 36.472 18.716 45 HD3 ARG 6 HD3 ARG 6 24.169 37.244 20.251 46 HE ARG 6 HE ARG 6 25.563 34.614 19.896 47 HH11 ARG 6 HH11 ARG 6 25.243 37.518 21.957 48 HH12 ARG 6 HH12 ARG 6 26.677 37.015 22.839 49 HH21 ARG 6 HH21 ARG 6 27.264 34.125 21.204 50 HH22 ARG 6 HH22 ARG 6 27.700 35.294 22.463 51 H ARG 7 H ARG 7 20.982 32.546 20.926 52 HA ARG 7 HA ARG 7 21.389 33.714 23.525 53 HB2 ARG 7 HB2 ARG 7 19.225 33.411 22.253 54 HB3 ARG 7 HB3 ARG 7 19.300 31.683 22.646 55 HG2 ARG 7 HG2 ARG 7 19.267 32.323 25.103 56 HG3 ARG 7 HG3 ARG 7 19.012 34.008 24.603 57 HD2 ARG 7 HD2 ARG 7 17.266 31.618 23.894 58 HD3 ARG 7 HD3 ARG 7 16.909 32.802 25.150 59 HE ARG 7 HE ARG 7 16.927 34.537 23.252 60 HH11 ARG 7 HH11 ARG 7 15.858 31.181 22.573 61 HH12 ARG 7 HH12 ARG 7 14.761 31.808 21.353 62 HH21 ARG 7 HH21 ARG 7 15.604 35.033 21.445 63 HH22 ARG 7 HH22 ARG 7 14.573 33.741 20.844 64 H CYS 8 H CYS 8 21.664 30.396 22.372 65 HA CYS 8 HA CYS 8 22.007 29.105 24.906 66 HB2 CYS 8 HB2 CYS 8 21.407 28.061 22.736 67 HB3 CYS 8 HB3 CYS 8 23.028 28.414 22.136 68 H GLU 9 H GLU 9 24.429 30.561 22.634 69 HA GLU 9 HA GLU 9 26.748 30.020 24.214 70 HB2 GLU 9 HB2 GLU 9 26.050 32.264 22.280 71 HB3 GLU 9 HB3 GLU 9 27.608 32.183 23.124 72 HG2 GLU 9 HG2 GLU 9 28.054 29.947 22.160 73 HG3 GLU 9 HG3 GLU 9 26.570 30.039 21.264 74 H LEU 10 H LEU 10 24.499 32.844 24.400 75 HA LEU 10 HA LEU 10 25.899 34.199 26.519 76 HB2 LEU 10 HB2 LEU 10 22.963 34.147 25.721 77 HB3 LEU 10 HB3 LEU 10 23.617 35.246 26.927 78 HG LEU 10 HG LEU 10 24.584 35.165 24.044 79 HD11 LEU 10 HD11 LEU 10 22.123 35.747 24.294 80 HD12 LEU 10 HD12 LEU 10 22.639 37.149 25.254 81 HD13 LEU 10 HD13 LEU 10 23.131 36.985 23.560 82 HD21 LEU 10 HD21 LEU 10 26.195 36.238 25.539 83 HD22 LEU 10 HD22 LEU 10 25.352 37.510 24.640 84 HD23 LEU 10 HD23 LEU 10 24.902 37.180 26.313 85 H SER 11 H SER 11 23.324 31.743 26.558 86 HA SER 11 HA SER 11 22.993 31.612 29.377 87 HB2 SER 11 HB2 SER 11 22.696 29.367 27.339 88 HB3 SER 11 HB3 SER 11 22.078 29.364 28.995 89 HG SER 11 HG SER 11 21.348 31.132 26.877 90 H CYS 12 H CYS 12 25.155 29.632 27.258 91 HA CYS 12 HA CYS 12 26.407 28.287 29.467 92 HB2 CYS 12 HB2 CYS 12 27.387 28.721 26.631 93 HB3 CYS 12 HB3 CYS 12 28.046 27.571 27.796 94 H ARG 13 H ARG 13 27.115 31.442 27.992 95 HA ARG 13 HA ARG 13 29.785 31.816 28.865 96 HB2 ARG 13 HB2 ARG 13 28.526 33.333 27.329 97 HB3 ARG 13 HB3 ARG 13 27.552 33.886 28.693 98 HG2 ARG 13 HG2 ARG 13 29.627 34.768 29.784 99 HG3 ARG 13 HG3 ARG 13 30.577 34.192 28.402 100 HD2 ARG 13 HD2 ARG 13 30.178 36.561 28.199 101 HD3 ARG 13 HD3 ARG 13 29.283 35.719 26.923 102 HE ARG 13 HE ARG 13 27.592 36.108 29.230 103 HH11 ARG 13 HH11 ARG 13 29.134 38.131 26.818 104 HH12 ARG 13 HH12 ARG 13 27.855 39.322 26.867 105 HH21 ARG 13 HH21 ARG 13 25.920 37.595 29.132 106 HH22 ARG 13 HH22 ARG 13 26.091 39.012 28.114 107 H SER 14 H SER 14 26.788 32.010 30.749 108 HA SER 14 HA SER 14 27.832 33.224 33.091 109 HB2 SER 14 HB2 SER 14 25.932 32.309 34.199 110 HB3 SER 14 HB3 SER 14 25.447 32.868 32.580 111 HG SER 14 HG SER 14 25.177 30.786 31.930 112 H LEU 15 H LEU 15 27.961 29.899 31.994 113 HA LEU 15 HA LEU 15 29.347 28.876 34.402 114 HB2 LEU 15 HB2 LEU 15 28.652 27.503 31.778 115 HB3 LEU 15 HB3 LEU 15 29.140 26.725 33.281 116 HG LEU 15 HG LEU 15 26.512 28.180 32.728 117 HD11 LEU 15 HD11 LEU 15 27.142 25.248 33.214 118 HD12 LEU 15 HD12 LEU 15 25.520 25.956 32.989 119 HD13 LEU 15 HD13 LEU 15 26.691 25.988 31.667 120 HD21 LEU 15 HD21 LEU 15 27.087 28.538 35.060 121 HD22 LEU 15 HD22 LEU 15 25.809 27.331 34.960 122 HD23 LEU 15 HD23 LEU 15 27.489 26.813 35.273 123 H GLY 16 H GLY 16 30.143 30.420 31.492 124 HA2 GLY 16 HA2 GLY 16 32.261 31.052 30.687 125 HA3 GLY 16 HA3 GLY 16 33.044 29.891 31.765 126 H LEU 17 H LEU 17 30.361 28.783 29.860 127 HA LEU 17 HA LEU 17 32.198 27.067 28.323 128 HB2 LEU 17 HB2 LEU 17 29.300 26.568 29.052 129 HB3 LEU 17 HB3 LEU 17 30.371 25.427 28.235 130 HG LEU 17 HG LEU 17 30.481 26.419 31.062 131 HD11 LEU 17 HD11 LEU 17 29.970 23.655 29.907 132 HD12 LEU 17 HD12 LEU 17 30.066 24.055 31.636 133 HD13 LEU 17 HD13 LEU 17 28.768 24.740 30.656 134 HD21 LEU 17 HD21 LEU 17 32.381 24.470 29.672 135 HD22 LEU 17 HD22 LEU 17 32.817 26.076 30.306 136 HD23 LEU 17 HD23 LEU 17 32.342 24.794 31.420 137 H LEU 18 H LEU 18 31.135 26.092 26.303 138 HA LEU 18 HA LEU 18 30.207 28.331 24.545 139 HB2 LEU 18 HB2 LEU 18 31.590 25.721 23.828 140 HB3 LEU 18 HB3 LEU 18 31.239 27.063 22.741 141 HG LEU 18 HG LEU 18 33.210 27.086 25.080 142 HD11 LEU 18 HD11 LEU 18 33.628 27.252 22.080 143 HD12 LEU 18 HD12 LEU 18 34.891 27.341 23.327 144 HD13 LEU 18 HD13 LEU 18 33.968 25.839 23.105 145 HD21 LEU 18 HD21 LEU 18 32.236 29.332 24.852 146 HD22 LEU 18 HD22 LEU 18 33.873 29.317 24.212 147 HD23 LEU 18 HD23 LEU 18 32.492 29.286 23.093 148 H GLY 19 H GLY 19 28.241 28.194 23.593 149 HA2 GLY 19 HA2 GLY 19 26.563 25.784 24.071 150 HA3 GLY 19 HA3 GLY 19 25.999 27.373 23.574 151 H LYS 20 H LYS 20 26.167 24.316 22.474 152 HA LYS 20 HA LYS 20 26.180 25.203 19.593 153 HB2 LYS 20 HB2 LYS 20 27.124 22.590 20.813 154 HB3 LYS 20 HB3 LYS 20 27.039 22.924 19.082 155 HG2 LYS 20 HG2 LYS 20 28.844 24.493 19.177 156 HG3 LYS 20 HG3 LYS 20 28.751 24.646 20.935 157 HD2 LYS 20 HD2 LYS 20 30.630 23.255 20.430 158 HD3 LYS 20 HD3 LYS 20 29.362 22.292 21.217 159 HE2 LYS 20 HE2 LYS 20 28.701 21.298 19.088 160 HE3 LYS 20 HE3 LYS 20 29.732 22.424 18.191 161 HZ1 LYS 20 HZ1 LYS 20 30.745 20.326 20.030 162 HZ2 LYS 20 HZ2 LYS 20 30.764 20.259 18.394 163 HZ3 LYS 20 HZ3 LYS 20 31.669 21.380 19.153 164 H CYS 21 H CYS 21 24.295 24.847 18.553 165 HA CYS 21 HA CYS 21 22.237 23.099 19.775 166 HB2 CYS 21 HB2 CYS 21 21.504 25.303 19.087 167 HB3 CYS 21 HB3 CYS 21 22.072 25.027 17.439 168 H ILE 22 H ILE 22 21.456 21.297 19.001 169 HA ILE 22 HA ILE 22 22.151 20.341 16.245 170 HB ILE 22 HB ILE 22 22.020 18.652 18.769 171 HG12 ILE 22 HG12 ILE 22 24.231 19.077 16.711 172 HG13 ILE 22 HG13 ILE 22 24.189 19.807 18.320 173 HG21 ILE 22 HG21 ILE 22 22.152 17.768 15.861 174 HG22 ILE 22 HG22 ILE 22 22.309 16.689 17.278 175 HG23 ILE 22 HG23 ILE 22 20.794 17.498 16.968 176 HD11 ILE 22 HD11 ILE 22 24.481 16.838 17.704 177 HD12 ILE 22 HD12 ILE 22 25.671 17.934 18.399 178 HD13 ILE 22 HD13 ILE 22 24.228 17.517 19.334 179 H GLY 23 H GLY 23 20.375 20.447 15.114 180 HA2 GLY 23 HA2 GLY 23 18.199 20.253 14.389 181 HA3 GLY 23 HA3 GLY 23 17.866 19.209 15.779 182 H GLU 24 H GLU 24 17.506 20.259 17.803 183 HA GLU 24 HA GLU 24 16.514 23.039 17.891 184 HB2 GLU 24 HB2 GLU 24 14.278 22.471 18.596 185 HB3 GLU 24 HB3 GLU 24 14.619 21.768 17.024 186 HG2 GLU 24 HG2 GLU 24 15.153 19.573 18.279 187 HG3 GLU 24 HG3 GLU 24 14.419 20.347 19.691 188 H GLU 25 H GLU 25 18.201 20.602 19.415 189 HA GLU 25 HA GLU 25 17.680 21.681 22.154 190 HB2 GLU 25 HB2 GLU 25 17.219 19.344 22.173 191 HB3 GLU 25 HB3 GLU 25 18.624 18.983 21.177 192 HG2 GLU 25 HG2 GLU 25 19.091 18.229 23.357 193 HG3 GLU 25 HG3 GLU 25 20.138 19.600 23.059 194 H CYS 26 H CYS 26 19.344 22.638 23.208 195 HA CYS 26 HA CYS 26 22.003 22.697 21.869 196 HB2 CYS 26 HB2 CYS 26 20.616 24.707 21.316 197 HB3 CYS 26 HB3 CYS 26 20.615 25.130 23.032 198 H LYS 27 H LYS 27 23.702 22.463 23.106 199 HA LYS 27 HA LYS 27 23.404 22.567 26.077 200 HB2 LYS 27 HB2 LYS 27 24.634 20.494 26.314 201 HB3 LYS 27 HB3 LYS 27 23.139 20.250 25.419 202 HG2 LYS 27 HG2 LYS 27 24.386 20.127 23.296 203 HG3 LYS 27 HG3 LYS 27 25.891 20.538 24.126 204 HD2 LYS 27 HD2 LYS 27 25.907 18.174 23.740 205 HD3 LYS 27 HD3 LYS 27 25.718 18.461 25.466 206 HE2 LYS 27 HE2 LYS 27 23.121 18.236 24.926 207 HE3 LYS 27 HE3 LYS 27 23.690 17.455 23.438 208 HZ1 LYS 27 HZ1 LYS 27 23.367 15.772 25.111 209 HZ2 LYS 27 HZ2 LYS 27 24.985 15.930 24.958 210 HZ3 LYS 27 HZ3 LYS 27 24.259 16.619 26.235 211 H CYS 28 H CYS 28 25.342 22.691 27.287 212 HA CYS 28 HA CYS 28 27.361 24.407 26.006 213 HB2 CYS 28 HB2 CYS 28 27.163 23.546 28.895 214 HB3 CYS 28 HB3 CYS 28 28.141 24.846 28.245 215 H VAL 29 H VAL 29 29.495 23.912 25.808 216 HA VAL 29 HA VAL 29 30.611 21.391 26.911 217 HB VAL 29 HB VAL 29 31.792 20.900 24.841 218 HG11 VAL 29 HG11 VAL 29 29.997 19.900 23.625 219 HG12 VAL 29 HG12 VAL 29 29.597 19.828 25.339 220 HG13 VAL 29 HG13 VAL 29 28.807 21.032 24.291 221 HG21 VAL 29 HG21 VAL 29 31.867 23.135 23.795 222 HG22 VAL 29 HG22 VAL 29 31.232 21.902 22.709 223 HG23 VAL 29 HG23 VAL 29 30.119 23.050 23.495 224 H TYR 30 H TYR 30 33.011 21.387 26.888 225 HA TYR 30 HA TYR 30 34.017 24.002 27.771 226 HB2 TYR 30 HB2 TYR 30 35.304 21.251 27.576 227 HB3 TYR 30 HB3 TYR 30 36.106 22.681 28.209 228 HD1 TYR 30 HD1 TYR 30 35.318 23.798 30.286 229 HD2 TYR 30 HD2 TYR 30 33.685 20.030 28.963 230 HE1 TYR 30 HE1 TYR 30 34.381 23.409 32.553 231 HE2 TYR 30 HE2 TYR 30 32.726 19.655 31.236 232 HH TYR 30 HH TYR 30 33.235 21.991 33.906 233 H ASN 31 H ASN 31 34.297 22.075 24.786 234 HA ASN 31 HA ASN 31 35.952 24.152 23.532 235 HB2 ASN 31 HB2 ASN 31 37.523 22.655 24.752 236 HB3 ASN 31 HB3 ASN 31 36.798 21.253 23.974 237 HD21 ASN 31 HD21 ASN 31 38.262 21.965 20.775 238 HD22 ASN 31 HD22 ASN 31 36.837 21.285 21.529 Start of MODEL 5 1 H1 ALA 1 H1 ALA 1 9.107 23.488 23.191 2 H2 ALA 1 H2 ALA 1 10.194 22.407 22.576 3 H3 ALA 1 H3 ALA 1 9.305 23.353 21.567 4 HA ALA 1 HA ALA 1 10.352 25.333 22.395 5 HB1 ALA 1 HB1 ALA 1 11.998 23.339 24.007 6 HB2 ALA 1 HB2 ALA 1 12.400 25.057 23.820 7 HB3 ALA 1 HB3 ALA 1 10.901 24.592 24.638 8 H PHE 2 H PHE 2 12.252 26.187 21.387 9 HA PHE 2 HA PHE 2 13.656 24.390 19.447 10 HB2 PHE 2 HB2 PHE 2 12.406 27.094 18.835 11 HB3 PHE 2 HB3 PHE 2 13.411 26.173 17.733 12 HD1 PHE 2 HD1 PHE 2 10.367 27.241 17.702 13 HD2 PHE 2 HD2 PHE 2 12.281 23.397 18.021 14 HE1 PHE 2 HE1 PHE 2 8.332 26.143 16.795 15 HE2 PHE 2 HE2 PHE 2 10.251 22.317 17.146 16 HZ PHE 2 HZ PHE 2 8.253 23.674 16.530 17 H CYS 3 H CYS 3 15.693 25.349 18.622 18 HA CYS 3 HA CYS 3 17.003 26.850 20.831 19 HB2 CYS 3 HB2 CYS 3 19.026 25.901 20.057 20 HB3 CYS 3 HB3 CYS 3 17.820 24.634 20.226 21 H ASN 4 H ASN 4 18.480 28.475 20.509 22 HA ASN 4 HA ASN 4 18.706 29.855 17.898 23 HB2 ASN 4 HB2 ASN 4 18.123 31.308 20.517 24 HB3 ASN 4 HB3 ASN 4 18.292 32.009 18.914 25 HD21 ASN 4 HD21 ASN 4 14.912 31.413 18.025 26 HD22 ASN 4 HD22 ASN 4 16.508 31.753 17.376 27 H LEU 5 H LEU 5 20.839 29.555 17.566 28 HA LEU 5 HA LEU 5 22.648 28.545 19.422 29 HB2 LEU 5 HB2 LEU 5 22.622 28.816 16.758 30 HB3 LEU 5 HB3 LEU 5 23.718 30.140 17.101 31 HG LEU 5 HG LEU 5 24.065 27.210 17.883 32 HD11 LEU 5 HD11 LEU 5 24.343 27.733 15.456 33 HD12 LEU 5 HD12 LEU 5 25.607 28.910 15.883 34 HD13 LEU 5 HD13 LEU 5 25.849 27.187 16.218 35 HD21 LEU 5 HD21 LEU 5 25.259 28.468 19.566 36 HD22 LEU 5 HD22 LEU 5 26.451 27.879 18.411 37 HD23 LEU 5 HD23 LEU 5 25.935 29.570 18.343 38 H ARG 6 H ARG 6 22.352 31.986 18.455 39 HA ARG 6 HA ARG 6 24.567 32.940 20.024 40 HB2 ARG 6 HB2 ARG 6 23.555 34.046 18.078 41 HB3 ARG 6 HB3 ARG 6 22.094 34.377 18.984 42 HG2 ARG 6 HG2 ARG 6 24.851 35.453 19.742 43 HG3 ARG 6 HG3 ARG 6 23.775 36.258 18.616 44 HD2 ARG 6 HD2 ARG 6 23.320 35.830 21.572 45 HD3 ARG 6 HD3 ARG 6 23.545 37.355 20.710 46 HE ARG 6 HE ARG 6 21.259 36.054 19.603 47 HH11 ARG 6 HH11 ARG 6 22.086 38.102 22.323 48 HH12 ARG 6 HH12 ARG 6 20.427 38.190 22.851 49 HH21 ARG 6 HH21 ARG 6 19.245 36.005 20.471 50 HH22 ARG 6 HH22 ARG 6 18.870 36.952 21.894 51 H ARG 7 H ARG 7 21.102 32.613 20.870 52 HA ARG 7 HA ARG 7 21.462 33.583 23.595 53 HB2 ARG 7 HB2 ARG 7 19.279 33.104 21.988 54 HB3 ARG 7 HB3 ARG 7 19.200 31.704 23.031 55 HG2 ARG 7 HG2 ARG 7 19.291 34.638 23.870 56 HG3 ARG 7 HG3 ARG 7 17.849 33.624 23.837 57 HD2 ARG 7 HD2 ARG 7 20.231 33.308 25.707 58 HD3 ARG 7 HD3 ARG 7 18.670 33.980 26.120 59 HE ARG 7 HE ARG 7 19.255 31.108 25.508 60 HH11 ARG 7 HH11 ARG 7 16.890 33.414 26.866 61 HH12 ARG 7 HH12 ARG 7 15.841 32.067 27.275 62 HH21 ARG 7 HH21 ARG 7 17.856 29.597 26.128 63 HH22 ARG 7 HH22 ARG 7 16.382 30.018 26.977 64 H CYS 8 H CYS 8 21.716 30.365 22.111 65 HA CYS 8 HA CYS 8 22.047 28.878 24.542 66 HB2 CYS 8 HB2 CYS 8 21.528 27.819 22.440 67 HB3 CYS 8 HB3 CYS 8 23.008 28.422 21.713 68 H GLU 9 H GLU 9 24.553 30.344 22.363 69 HA GLU 9 HA GLU 9 26.819 29.847 23.986 70 HB2 GLU 9 HB2 GLU 9 26.055 31.739 21.801 71 HB3 GLU 9 HB3 GLU 9 27.344 32.347 22.877 72 HG2 GLU 9 HG2 GLU 9 27.591 29.571 21.735 73 HG3 GLU 9 HG3 GLU 9 27.924 30.930 20.733 74 H LEU 10 H LEU 10 24.603 32.716 24.153 75 HA LEU 10 HA LEU 10 25.957 33.948 26.353 76 HB2 LEU 10 HB2 LEU 10 23.061 34.030 25.417 77 HB3 LEU 10 HB3 LEU 10 23.669 35.044 26.715 78 HG LEU 10 HG LEU 10 24.788 35.090 23.884 79 HD11 LEU 10 HD11 LEU 10 22.429 35.808 23.934 80 HD12 LEU 10 HD12 LEU 10 22.792 36.948 25.249 81 HD13 LEU 10 HD13 LEU 10 23.521 37.173 23.642 82 HD21 LEU 10 HD21 LEU 10 26.375 35.950 25.550 83 HD22 LEU 10 HD22 LEU 10 25.721 37.271 24.588 84 HD23 LEU 10 HD23 LEU 10 25.108 37.001 26.236 85 H SER 11 H SER 11 23.531 31.364 26.303 86 HA SER 11 HA SER 11 23.043 31.455 29.151 87 HB2 SER 11 HB2 SER 11 22.525 29.203 27.165 88 HB3 SER 11 HB3 SER 11 21.902 29.306 28.824 89 HG SER 11 HG SER 11 21.397 31.063 26.650 90 H CYS 12 H CYS 12 25.265 29.575 27.089 91 HA CYS 12 HA CYS 12 26.441 28.095 29.303 92 HB2 CYS 12 HB2 CYS 12 27.470 28.643 26.496 93 HB3 CYS 12 HB3 CYS 12 28.097 27.438 27.627 94 H ARG 13 H ARG 13 27.166 31.216 27.731 95 HA ARG 13 HA ARG 13 29.725 31.768 28.655 96 HB2 ARG 13 HB2 ARG 13 28.226 33.107 27.084 97 HB3 ARG 13 HB3 ARG 13 27.424 33.756 28.516 98 HG2 ARG 13 HG2 ARG 13 29.684 34.691 29.242 99 HG3 ARG 13 HG3 ARG 13 30.319 34.123 27.689 100 HD2 ARG 13 HD2 ARG 13 29.778 36.421 27.378 101 HD3 ARG 13 HD3 ARG 13 28.514 35.505 26.546 102 HE ARG 13 HE ARG 13 27.682 36.027 29.238 103 HH11 ARG 13 HH11 ARG 13 28.100 37.952 26.314 104 HH12 ARG 13 HH12 ARG 13 27.093 39.232 26.987 105 HH21 ARG 13 HH21 ARG 13 26.430 37.564 29.905 106 HH22 ARG 13 HH22 ARG 13 26.127 39.005 28.957 107 H SER 14 H SER 14 26.689 32.294 30.495 108 HA SER 14 HA SER 14 27.947 33.336 32.879 109 HB2 SER 14 HB2 SER 14 25.370 31.783 32.589 110 HB3 SER 14 HB3 SER 14 25.847 32.721 33.982 111 HG SER 14 HG SER 14 24.488 33.928 32.574 112 H LEU 15 H LEU 15 27.578 29.998 31.713 113 HA LEU 15 HA LEU 15 28.389 28.779 34.260 114 HB2 LEU 15 HB2 LEU 15 28.167 27.505 31.512 115 HB3 LEU 15 HB3 LEU 15 28.265 26.681 33.061 116 HG LEU 15 HG LEU 15 25.933 28.329 32.032 117 HD11 LEU 15 HD11 LEU 15 24.755 26.188 32.010 118 HD12 LEU 15 HD12 LEU 15 26.198 26.114 30.986 119 HD13 LEU 15 HD13 LEU 15 26.214 25.355 32.597 120 HD21 LEU 15 HD21 LEU 15 26.056 28.575 34.480 121 HD22 LEU 15 HD22 LEU 15 24.713 27.513 34.041 122 HD23 LEU 15 HD23 LEU 15 26.220 26.817 34.662 123 H GLY 16 H GLY 16 29.950 30.083 31.481 124 HA2 GLY 16 HA2 GLY 16 32.255 30.599 31.295 125 HA3 GLY 16 HA3 GLY 16 32.665 29.268 32.381 126 H LEU 17 H LEU 17 30.296 28.511 29.993 127 HA LEU 17 HA LEU 17 32.250 26.759 28.611 128 HB2 LEU 17 HB2 LEU 17 29.273 26.338 28.901 129 HB3 LEU 17 HB3 LEU 17 30.456 25.163 28.315 130 HG LEU 17 HG LEU 17 30.090 26.215 31.114 131 HD11 LEU 17 HD11 LEU 17 29.539 23.474 29.960 132 HD12 LEU 17 HD12 LEU 17 29.393 23.934 31.668 133 HD13 LEU 17 HD13 LEU 17 28.337 24.694 30.475 134 HD21 LEU 17 HD21 LEU 17 32.496 25.673 30.748 135 HD22 LEU 17 HD22 LEU 17 31.748 24.487 31.821 136 HD23 LEU 17 HD23 LEU 17 32.035 24.076 30.117 137 H LEU 18 H LEU 18 31.548 26.094 26.347 138 HA LEU 18 HA LEU 18 30.600 28.478 24.798 139 HB2 LEU 18 HB2 LEU 18 31.900 25.931 23.819 140 HB3 LEU 18 HB3 LEU 18 31.470 27.336 22.840 141 HG LEU 18 HG LEU 18 33.565 27.357 25.082 142 HD11 LEU 18 HD11 LEU 18 35.218 27.427 23.268 143 HD12 LEU 18 HD12 LEU 18 34.267 25.934 23.204 144 HD13 LEU 18 HD13 LEU 18 33.928 27.253 22.061 145 HD21 LEU 18 HD21 LEU 18 32.876 29.408 22.924 146 HD22 LEU 18 HD22 LEU 18 32.599 29.589 24.670 147 HD23 LEU 18 HD23 LEU 18 34.251 29.511 24.053 148 H GLY 19 H GLY 19 28.763 28.350 23.525 149 HA2 GLY 19 HA2 GLY 19 27.023 25.940 23.941 150 HA3 GLY 19 HA3 GLY 19 26.461 27.560 23.581 151 H LYS 20 H LYS 20 26.000 24.868 22.347 152 HA LYS 20 HA LYS 20 25.781 25.906 19.606 153 HB2 LYS 20 HB2 LYS 20 26.991 23.136 20.079 154 HB3 LYS 20 HB3 LYS 20 26.375 23.745 18.563 155 HG2 LYS 20 HG2 LYS 20 28.551 24.144 18.175 156 HG3 LYS 20 HG3 LYS 20 28.135 25.685 18.907 157 HD2 LYS 20 HD2 LYS 20 28.929 24.556 21.154 158 HD3 LYS 20 HD3 LYS 20 29.613 23.306 20.125 159 HE2 LYS 20 HE2 LYS 20 30.246 26.290 20.033 160 HE3 LYS 20 HE3 LYS 20 31.257 25.047 20.773 161 HZ1 LYS 20 HZ1 LYS 20 32.055 25.622 18.615 162 HZ2 LYS 20 HZ2 LYS 20 31.520 24.049 18.566 163 HZ3 LYS 20 HZ3 LYS 20 30.638 25.263 17.873 164 H CYS 21 H CYS 21 24.003 24.913 18.449 165 HA CYS 21 HA CYS 21 22.073 23.444 20.194 166 HB2 CYS 21 HB2 CYS 21 21.179 25.334 18.958 167 HB3 CYS 21 HB3 CYS 21 21.753 24.659 17.431 168 H ILE 22 H ILE 22 21.579 21.284 19.820 169 HA ILE 22 HA ILE 22 23.266 19.917 17.765 170 HB ILE 22 HB ILE 22 22.336 18.835 20.414 171 HG12 ILE 22 HG12 ILE 22 24.048 20.530 20.788 172 HG13 ILE 22 HG13 ILE 22 24.657 18.930 21.142 173 HG21 ILE 22 HG21 ILE 22 24.108 17.588 18.286 174 HG22 ILE 22 HG22 ILE 22 23.944 16.971 19.942 175 HG23 ILE 22 HG23 ILE 22 22.542 16.995 18.872 176 HD11 ILE 22 HD11 ILE 22 25.307 20.537 18.632 177 HD12 ILE 22 HD12 ILE 22 26.360 20.270 20.028 178 HD13 ILE 22 HD13 ILE 22 25.913 18.907 18.994 179 H GLY 23 H GLY 23 20.221 19.830 19.139 180 HA2 GLY 23 HA2 GLY 23 18.893 18.937 16.652 181 HA3 GLY 23 HA3 GLY 23 18.847 17.752 17.966 182 H GLU 24 H GLU 24 17.997 21.077 17.090 183 HA GLU 24 HA GLU 24 16.531 22.598 17.851 184 HB2 GLU 24 HB2 GLU 24 14.791 20.267 18.721 185 HB3 GLU 24 HB3 GLU 24 14.278 21.936 18.484 186 HG2 GLU 24 HG2 GLU 24 14.987 21.764 16.071 187 HG3 GLU 24 HG3 GLU 24 15.266 20.040 16.324 188 H GLU 25 H GLU 25 18.353 21.105 20.037 189 HA GLU 25 HA GLU 25 17.507 22.908 22.234 190 HB2 GLU 25 HB2 GLU 25 16.545 20.814 22.807 191 HB3 GLU 25 HB3 GLU 25 17.990 19.931 22.357 192 HG2 GLU 25 HG2 GLU 25 17.774 19.875 24.704 193 HG3 GLU 25 HG3 GLU 25 19.181 20.848 24.324 194 H CYS 26 H CYS 26 19.077 23.599 23.597 195 HA CYS 26 HA CYS 26 21.724 23.988 22.433 196 HB2 CYS 26 HB2 CYS 26 20.471 25.782 23.540 197 HB3 CYS 26 HB3 CYS 26 20.403 24.840 25.026 198 H LYS 27 H LYS 27 23.662 23.176 23.058 199 HA LYS 27 HA LYS 27 23.917 21.637 25.602 200 HB2 LYS 27 HB2 LYS 27 23.764 20.041 23.672 201 HB3 LYS 27 HB3 LYS 27 25.163 20.832 22.939 202 HG2 LYS 27 HG2 LYS 27 26.494 20.238 25.001 203 HG3 LYS 27 HG3 LYS 27 25.098 19.333 25.600 204 HD2 LYS 27 HD2 LYS 27 26.592 18.777 22.993 205 HD3 LYS 27 HD3 LYS 27 26.893 17.954 24.522 206 HE2 LYS 27 HE2 LYS 27 24.585 17.064 24.540 207 HE3 LYS 27 HE3 LYS 27 24.239 17.894 23.018 208 HZ1 LYS 27 HZ1 LYS 27 26.304 15.786 23.389 209 HZ2 LYS 27 HZ2 LYS 27 24.874 15.579 22.608 210 HZ3 LYS 27 HZ3 LYS 27 26.029 16.560 21.987 211 H CYS 28 H CYS 28 25.646 22.289 26.806 212 HA CYS 28 HA CYS 28 27.573 24.211 25.605 213 HB2 CYS 28 HB2 CYS 28 27.365 23.397 28.503 214 HB3 CYS 28 HB3 CYS 28 28.252 24.749 27.845 215 H VAL 29 H VAL 29 29.794 23.913 25.670 216 HA VAL 29 HA VAL 29 30.951 21.337 26.639 217 HB VAL 29 HB VAL 29 32.442 21.281 24.635 218 HG11 VAL 29 HG11 VAL 29 29.489 20.888 24.020 219 HG12 VAL 29 HG12 VAL 29 30.864 20.126 23.196 220 HG13 VAL 29 HG13 VAL 29 30.531 19.747 24.892 221 HG21 VAL 29 HG21 VAL 29 31.765 22.346 22.551 222 HG22 VAL 29 HG22 VAL 29 30.445 23.204 23.369 223 HG23 VAL 29 HG23 VAL 29 32.142 23.560 23.774 224 H TYR 30 H TYR 30 33.240 21.424 27.076 225 HA TYR 30 HA TYR 30 34.018 23.969 28.257 226 HB2 TYR 30 HB2 TYR 30 35.317 21.235 28.090 227 HB3 TYR 30 HB3 TYR 30 36.142 22.619 28.787 228 HD1 TYR 30 HD1 TYR 30 35.421 23.656 30.886 229 HD2 TYR 30 HD2 TYR 30 33.414 20.184 29.306 230 HE1 TYR 30 HE1 TYR 30 34.360 23.268 33.096 231 HE2 TYR 30 HE2 TYR 30 32.356 19.788 31.528 232 HH TYR 30 HH TYR 30 33.140 21.814 34.370 233 H ASN 31 H ASN 31 35.185 22.088 25.437 234 HA ASN 31 HA ASN 31 36.489 24.406 24.173 235 HB2 ASN 31 HB2 ASN 31 38.120 23.738 25.903 236 HB3 ASN 31 HB3 ASN 31 37.939 22.045 25.488 237 HD21 ASN 31 HD21 ASN 31 39.979 22.338 22.534 238 HD22 ASN 31 HD22 ASN 31 38.431 21.634 23.025 Start of MODEL 6 1 H1 ALA 1 H1 ALA 1 10.567 21.869 22.386 2 H2 ALA 1 H2 ALA 1 11.156 20.334 22.595 3 H3 ALA 1 H3 ALA 1 10.903 20.937 21.077 4 HA ALA 1 HA ALA 1 12.886 21.903 23.009 5 HB1 ALA 1 HB1 ALA 1 13.288 20.403 20.373 6 HB2 ALA 1 HB2 ALA 1 14.565 20.999 21.443 7 HB3 ALA 1 HB3 ALA 1 13.489 19.717 22.002 8 H PHE 2 H PHE 2 14.157 23.719 22.336 9 HA PHE 2 HA PHE 2 13.567 25.141 19.833 10 HB2 PHE 2 HB2 PHE 2 11.825 26.169 21.006 11 HB3 PHE 2 HB3 PHE 2 12.616 26.005 22.565 12 HD1 PHE 2 HD1 PHE 2 12.686 27.907 19.356 13 HD2 PHE 2 HD2 PHE 2 14.266 27.529 23.349 14 HE1 PHE 2 HE1 PHE 2 14.130 29.864 18.977 15 HE2 PHE 2 HE2 PHE 2 15.764 29.412 22.941 16 HZ PHE 2 HZ PHE 2 15.685 30.656 20.765 17 H CYS 3 H CYS 3 15.411 26.281 19.207 18 HA CYS 3 HA CYS 3 17.307 27.169 21.224 19 HB2 CYS 3 HB2 CYS 3 17.923 24.778 20.868 20 HB3 CYS 3 HB3 CYS 3 18.314 25.152 19.193 21 H ASN 4 H ASN 4 18.795 28.677 20.523 22 HA ASN 4 HA ASN 4 18.981 29.536 17.726 23 HB2 ASN 4 HB2 ASN 4 18.010 31.298 20.029 24 HB3 ASN 4 HB3 ASN 4 18.935 31.947 18.687 25 HD21 ASN 4 HD21 ASN 4 15.660 30.647 16.894 26 HD22 ASN 4 HD22 ASN 4 16.826 29.499 17.560 27 H LEU 5 H LEU 5 21.101 29.536 17.369 28 HA LEU 5 HA LEU 5 22.917 28.542 19.087 29 HB2 LEU 5 HB2 LEU 5 22.808 28.806 16.571 30 HB3 LEU 5 HB3 LEU 5 23.567 30.368 16.758 31 HG LEU 5 HG LEU 5 24.974 28.542 16.072 32 HD11 LEU 5 HD11 LEU 5 26.927 29.065 17.399 33 HD12 LEU 5 HD12 LEU 5 25.946 30.530 17.256 34 HD13 LEU 5 HD13 LEU 5 25.934 29.584 18.765 35 HD21 LEU 5 HD21 LEU 5 24.018 26.721 17.423 36 HD22 LEU 5 HD22 LEU 5 25.787 26.807 17.532 37 HD23 LEU 5 HD23 LEU 5 24.795 27.417 18.879 38 H ARG 6 H ARG 6 22.860 32.041 18.242 39 HA ARG 6 HA ARG 6 24.917 32.680 20.157 40 HB2 ARG 6 HB2 ARG 6 22.927 34.321 18.583 41 HB3 ARG 6 HB3 ARG 6 23.932 35.092 19.805 42 HG2 ARG 6 HG2 ARG 6 24.901 33.575 17.353 43 HG3 ARG 6 HG3 ARG 6 24.982 35.314 17.630 44 HD2 ARG 6 HD2 ARG 6 26.612 33.099 18.888 45 HD3 ARG 6 HD3 ARG 6 27.177 34.506 17.987 46 HE ARG 6 HE ARG 6 25.890 35.573 20.234 47 HH11 ARG 6 HH11 ARG 6 28.652 33.449 19.831 48 HH12 ARG 6 HH12 ARG 6 29.395 34.058 21.287 49 HH21 ARG 6 HH21 ARG 6 26.818 36.213 21.992 50 HH22 ARG 6 HH22 ARG 6 28.202 35.325 22.681 51 H ARG 7 H ARG 7 21.363 32.729 20.682 52 HA ARG 7 HA ARG 7 21.640 33.763 23.365 53 HB2 ARG 7 HB2 ARG 7 19.461 32.170 21.933 54 HB3 ARG 7 HB3 ARG 7 19.338 32.739 23.594 55 HG2 ARG 7 HG2 ARG 7 19.689 35.095 22.810 56 HG3 ARG 7 HG3 ARG 7 19.689 34.505 21.148 57 HD2 ARG 7 HD2 ARG 7 17.496 35.288 21.499 58 HD3 ARG 7 HD3 ARG 7 17.381 33.521 21.629 59 HE ARG 7 HE ARG 7 17.748 35.074 24.136 60 HH11 ARG 7 HH11 ARG 7 15.248 33.553 22.129 61 HH12 ARG 7 HH12 ARG 7 14.220 33.389 23.546 62 HH21 ARG 7 HH21 ARG 7 16.420 34.765 25.729 63 HH22 ARG 7 HH22 ARG 7 14.967 33.795 25.553 64 H CYS 8 H CYS 8 21.745 30.471 22.010 65 HA CYS 8 HA CYS 8 22.033 29.089 24.519 66 HB2 CYS 8 HB2 CYS 8 21.444 27.961 22.474 67 HB3 CYS 8 HB3 CYS 8 22.939 28.432 21.700 68 H GLU 9 H GLU 9 24.525 30.427 22.276 69 HA GLU 9 HA GLU 9 26.824 29.854 23.824 70 HB2 GLU 9 HB2 GLU 9 26.124 32.106 21.937 71 HB3 GLU 9 HB3 GLU 9 27.678 32.079 22.741 72 HG2 GLU 9 HG2 GLU 9 26.895 29.526 21.386 73 HG3 GLU 9 HG3 GLU 9 27.149 30.911 20.331 74 H LEU 10 H LEU 10 24.717 32.761 24.131 75 HA LEU 10 HA LEU 10 26.191 33.761 26.425 76 HB2 LEU 10 HB2 LEU 10 23.461 34.442 25.263 77 HB3 LEU 10 HB3 LEU 10 24.193 35.305 26.612 78 HG LEU 10 HG LEU 10 25.400 35.126 23.816 79 HD11 LEU 10 HD11 LEU 10 23.347 36.463 23.872 80 HD12 LEU 10 HD12 LEU 10 23.965 37.394 25.258 81 HD13 LEU 10 HD13 LEU 10 24.756 37.510 23.673 82 HD21 LEU 10 HD21 LEU 10 27.176 35.460 25.471 83 HD22 LEU 10 HD22 LEU 10 26.871 36.979 24.640 84 HD23 LEU 10 HD23 LEU 10 26.228 36.733 26.278 85 H SER 11 H SER 11 23.691 31.357 26.148 86 HA SER 11 HA SER 11 22.932 31.430 28.984 87 HB2 SER 11 HB2 SER 11 22.507 29.262 26.888 88 HB3 SER 11 HB3 SER 11 21.818 29.289 28.516 89 HG SER 11 HG SER 11 21.379 31.221 26.460 90 H CYS 12 H CYS 12 25.137 29.494 26.928 91 HA CYS 12 HA CYS 12 26.162 27.881 29.110 92 HB2 CYS 12 HB2 CYS 12 27.267 28.503 26.354 93 HB3 CYS 12 HB3 CYS 12 27.899 27.282 27.454 94 H ARG 13 H ARG 13 27.175 31.017 27.679 95 HA ARG 13 HA ARG 13 29.645 31.284 28.989 96 HB2 ARG 13 HB2 ARG 13 28.871 32.827 27.266 97 HB3 ARG 13 HB3 ARG 13 27.562 33.385 28.304 98 HG2 ARG 13 HG2 ARG 13 29.297 35.051 28.321 99 HG3 ARG 13 HG3 ARG 13 29.235 34.306 29.905 100 HD2 ARG 13 HD2 ARG 13 31.548 34.455 29.471 101 HD3 ARG 13 HD3 ARG 13 31.184 32.787 29.118 102 HE ARG 13 HE ARG 13 31.708 33.138 26.904 103 HH11 ARG 13 HH11 ARG 13 31.444 36.317 28.408 104 HH12 ARG 13 HH12 ARG 13 32.028 37.138 26.982 105 HH21 ARG 13 HH21 ARG 13 32.417 34.245 25.138 106 HH22 ARG 13 HH22 ARG 13 32.566 36.001 25.182 107 H SER 14 H SER 14 26.384 31.736 30.430 108 HA SER 14 HA SER 14 27.115 32.749 32.955 109 HB2 SER 14 HB2 SER 14 25.040 30.620 32.340 110 HB3 SER 14 HB3 SER 14 25.067 31.674 33.760 111 HG SER 14 HG SER 14 24.465 33.371 32.559 112 H LEU 15 H LEU 15 27.579 29.504 31.638 113 HA LEU 15 HA LEU 15 28.479 28.382 34.235 114 HB2 LEU 15 HB2 LEU 15 28.142 27.040 31.523 115 HB3 LEU 15 HB3 LEU 15 28.439 26.251 33.069 116 HG LEU 15 HG LEU 15 25.905 27.717 32.216 117 HD11 LEU 15 HD11 LEU 15 24.888 25.490 32.417 118 HD12 LEU 15 HD12 LEU 15 26.203 25.475 31.240 119 HD13 LEU 15 HD13 LEU 15 26.455 24.788 32.861 120 HD21 LEU 15 HD21 LEU 15 26.198 28.122 34.589 121 HD22 LEU 15 HD22 LEU 15 24.982 26.866 34.381 122 HD23 LEU 15 HD23 LEU 15 26.620 26.416 34.883 123 H GLY 16 H GLY 16 29.880 29.951 31.544 124 HA2 GLY 16 HA2 GLY 16 32.154 30.502 31.302 125 HA3 GLY 16 HA3 GLY 16 32.618 29.156 32.356 126 H LEU 17 H LEU 17 30.297 28.730 29.766 127 HA LEU 17 HA LEU 17 32.187 26.980 28.288 128 HB2 LEU 17 HB2 LEU 17 29.236 26.562 28.786 129 HB3 LEU 17 HB3 LEU 17 30.324 25.417 28.009 130 HG LEU 17 HG LEU 17 30.225 26.281 30.892 131 HD11 LEU 17 HD11 LEU 17 29.576 23.612 29.610 132 HD12 LEU 17 HD12 LEU 17 29.566 23.953 31.348 133 HD13 LEU 17 HD13 LEU 17 28.418 24.778 30.300 134 HD21 LEU 17 HD21 LEU 17 32.006 24.131 29.641 135 HD22 LEU 17 HD22 LEU 17 32.586 25.699 30.243 136 HD23 LEU 17 HD23 LEU 17 31.901 24.531 31.366 137 H LEU 18 H LEU 18 31.299 26.405 26.054 138 HA LEU 18 HA LEU 18 30.153 28.823 24.676 139 HB2 LEU 18 HB2 LEU 18 31.814 26.532 23.562 140 HB3 LEU 18 HB3 LEU 18 31.006 27.779 22.620 141 HG LEU 18 HG LEU 18 32.406 29.535 23.732 142 HD11 LEU 18 HD11 LEU 18 33.226 28.537 25.762 143 HD12 LEU 18 HD12 LEU 18 33.863 27.120 24.897 144 HD13 LEU 18 HD13 LEU 18 34.613 28.726 24.714 145 HD21 LEU 18 HD21 LEU 18 33.921 27.311 22.290 146 HD22 LEU 18 HD22 LEU 18 32.938 28.572 21.514 147 HD23 LEU 18 HD23 LEU 18 34.402 29.021 22.390 148 H GLY 19 H GLY 19 28.423 28.534 23.297 149 HA2 GLY 19 HA2 GLY 19 26.754 26.133 23.935 150 HA3 GLY 19 HA3 GLY 19 26.145 27.690 23.387 151 H LYS 20 H LYS 20 25.868 24.801 22.481 152 HA LYS 20 HA LYS 20 25.836 25.517 19.596 153 HB2 LYS 20 HB2 LYS 20 26.892 22.848 20.636 154 HB3 LYS 20 HB3 LYS 20 26.398 23.170 18.982 155 HG2 LYS 20 HG2 LYS 20 28.623 23.524 18.718 156 HG3 LYS 20 HG3 LYS 20 28.128 25.165 19.119 157 HD2 LYS 20 HD2 LYS 20 28.731 24.491 21.594 158 HD3 LYS 20 HD3 LYS 20 29.534 23.104 20.873 159 HE2 LYS 20 HE2 LYS 20 30.094 26.030 20.163 160 HE3 LYS 20 HE3 LYS 20 31.013 25.097 21.348 161 HZ1 LYS 20 HZ1 LYS 20 30.860 24.531 18.440 162 HZ2 LYS 20 HZ2 LYS 20 32.132 25.102 19.280 163 HZ3 LYS 20 HZ3 LYS 20 31.611 23.552 19.542 164 H CYS 21 H CYS 21 23.946 24.979 18.605 165 HA CYS 21 HA CYS 21 21.827 23.665 20.181 166 HB2 CYS 21 HB2 CYS 21 21.825 24.806 17.363 167 HB3 CYS 21 HB3 CYS 21 20.419 24.158 18.224 168 H ILE 22 H ILE 22 21.490 21.534 20.121 169 HA ILE 22 HA ILE 22 22.426 19.890 17.785 170 HB ILE 22 HB ILE 22 22.501 19.148 20.735 171 HG12 ILE 22 HG12 ILE 22 24.246 20.831 20.336 172 HG13 ILE 22 HG13 ILE 22 24.882 19.256 20.746 173 HG21 ILE 22 HG21 ILE 22 23.839 17.193 19.914 174 HG22 ILE 22 HG22 ILE 22 22.176 17.199 19.336 175 HG23 ILE 22 HG23 ILE 22 23.480 17.683 18.245 176 HD11 ILE 22 HD11 ILE 22 26.195 20.399 18.982 177 HD12 ILE 22 HD12 ILE 22 25.560 18.836 18.437 178 HD13 ILE 22 HD13 ILE 22 24.792 20.348 17.904 179 H GLY 23 H GLY 23 20.487 19.394 16.752 180 HA2 GLY 23 HA2 GLY 23 18.322 18.670 16.459 181 HA3 GLY 23 HA3 GLY 23 18.504 17.730 17.942 182 H GLU 24 H GLU 24 18.601 21.255 17.488 183 HA GLU 24 HA GLU 24 17.707 22.970 18.545 184 HB2 GLU 24 HB2 GLU 24 15.089 21.473 18.598 185 HB3 GLU 24 HB3 GLU 24 15.350 23.213 18.786 186 HG2 GLU 24 HG2 GLU 24 16.517 23.121 16.483 187 HG3 GLU 24 HG3 GLU 24 15.765 21.530 16.293 188 H GLU 25 H GLU 25 18.810 20.733 20.340 189 HA GLU 25 HA GLU 25 17.825 21.976 22.874 190 HB2 GLU 25 HB2 GLU 25 17.657 19.510 22.795 191 HB3 GLU 25 HB3 GLU 25 19.374 19.414 22.444 192 HG2 GLU 25 HG2 GLU 25 19.181 18.916 24.719 193 HG3 GLU 25 HG3 GLU 25 19.831 20.549 24.668 194 H CYS 26 H CYS 26 19.130 23.393 23.941 195 HA CYS 26 HA CYS 26 21.737 24.058 22.809 196 HB2 CYS 26 HB2 CYS 26 20.302 25.803 23.732 197 HB3 CYS 26 HB3 CYS 26 20.288 24.989 25.299 198 H LYS 27 H LYS 27 23.615 23.162 23.290 199 HA LYS 27 HA LYS 27 24.083 21.980 25.984 200 HB2 LYS 27 HB2 LYS 27 24.743 20.673 23.314 201 HB3 LYS 27 HB3 LYS 27 25.503 20.218 24.851 202 HG2 LYS 27 HG2 LYS 27 23.225 19.829 25.832 203 HG3 LYS 27 HG3 LYS 27 22.523 20.084 24.223 204 HD2 LYS 27 HD2 LYS 27 23.682 18.180 23.322 205 HD3 LYS 27 HD3 LYS 27 24.637 17.977 24.810 206 HE2 LYS 27 HE2 LYS 27 22.565 17.526 26.094 207 HE3 LYS 27 HE3 LYS 27 21.609 17.720 24.614 208 HZ1 LYS 27 HZ1 LYS 27 23.652 15.591 25.081 209 HZ2 LYS 27 HZ2 LYS 27 22.034 15.402 25.055 210 HZ3 LYS 27 HZ3 LYS 27 22.819 15.815 23.680 211 H CYS 28 H CYS 28 26.229 21.966 26.695 212 HA CYS 28 HA CYS 28 27.740 24.280 25.585 213 HB2 CYS 28 HB2 CYS 28 27.416 23.528 28.485 214 HB3 CYS 28 HB3 CYS 28 28.125 24.994 27.822 215 H VAL 29 H VAL 29 29.830 24.030 25.181 216 HA VAL 29 HA VAL 29 31.338 21.729 26.376 217 HB VAL 29 HB VAL 29 32.769 21.760 24.423 218 HG11 VAL 29 HG11 VAL 29 31.221 20.791 22.814 219 HG12 VAL 29 HG12 VAL 29 30.768 20.302 24.455 220 HG13 VAL 29 HG13 VAL 29 29.841 21.563 23.609 221 HG21 VAL 29 HG21 VAL 29 32.620 24.104 23.711 222 HG22 VAL 29 HG22 VAL 29 32.196 23.013 22.388 223 HG23 VAL 29 HG23 VAL 29 30.912 23.874 23.267 224 H TYR 30 H TYR 30 33.523 22.109 27.095 225 HA TYR 30 HA TYR 30 33.884 24.685 28.348 226 HB2 TYR 30 HB2 TYR 30 35.806 22.374 27.878 227 HB3 TYR 30 HB3 TYR 30 36.225 23.820 28.780 228 HD1 TYR 30 HD1 TYR 30 34.972 24.444 30.876 229 HD2 TYR 30 HD2 TYR 30 34.549 20.602 28.951 230 HE1 TYR 30 HE1 TYR 30 33.965 23.506 32.960 231 HE2 TYR 30 HE2 TYR 30 33.565 19.670 31.044 232 HH TYR 30 HH TYR 30 33.562 20.149 33.464 233 H ASN 31 H ASN 31 35.206 23.335 25.357 234 HA ASN 31 HA ASN 31 35.635 25.864 24.068 235 HB2 ASN 31 HB2 ASN 31 38.217 25.432 23.874 236 HB3 ASN 31 HB3 ASN 31 37.586 26.247 25.298 237 HD21 ASN 31 HD21 ASN 31 38.691 22.322 25.880 238 HD22 ASN 31 HD22 ASN 31 37.749 22.779 24.453 Start of MODEL 7 1 H1 ALA 1 H1 ALA 1 8.742 24.086 19.747 2 H2 ALA 1 H2 ALA 1 9.510 23.108 18.651 3 H3 ALA 1 H3 ALA 1 9.153 24.662 18.268 4 HA ALA 1 HA ALA 1 10.665 25.566 19.760 5 HB1 ALA 1 HB1 ALA 1 11.164 22.713 20.691 6 HB2 ALA 1 HB2 ALA 1 12.070 24.147 21.219 7 HB3 ALA 1 HB3 ALA 1 10.350 23.997 21.615 8 H PHE 2 H PHE 2 12.573 26.191 18.957 9 HA PHE 2 HA PHE 2 14.156 24.403 17.195 10 HB2 PHE 2 HB2 PHE 2 13.616 27.349 16.695 11 HB3 PHE 2 HB3 PHE 2 14.586 26.267 15.697 12 HD1 PHE 2 HD1 PHE 2 11.865 28.083 15.319 13 HD2 PHE 2 HD2 PHE 2 12.858 23.886 15.383 14 HE1 PHE 2 HE1 PHE 2 9.880 27.583 13.919 15 HE2 PHE 2 HE2 PHE 2 10.873 23.392 14.034 16 HZ PHE 2 HZ PHE 2 9.359 25.232 13.281 17 H CYS 3 H CYS 3 16.463 25.218 17.096 18 HA CYS 3 HA CYS 3 17.441 26.049 19.648 19 HB2 CYS 3 HB2 CYS 3 18.677 25.902 16.877 20 HB3 CYS 3 HB3 CYS 3 19.618 26.384 18.297 21 H ASN 4 H ASN 4 18.490 27.962 20.329 22 HA ASN 4 HA ASN 4 18.260 30.418 18.649 23 HB2 ASN 4 HB2 ASN 4 17.733 30.290 21.654 24 HB3 ASN 4 HB3 ASN 4 17.769 31.728 20.648 25 HD21 ASN 4 HD21 ASN 4 14.547 31.058 19.149 26 HD22 ASN 4 HD22 ASN 4 16.102 31.841 18.857 27 H LEU 5 H LEU 5 20.444 29.460 18.092 28 HA LEU 5 HA LEU 5 22.368 28.632 19.796 29 HB2 LEU 5 HB2 LEU 5 22.184 28.506 17.358 30 HB3 LEU 5 HB3 LEU 5 22.670 30.168 17.192 31 HG LEU 5 HG LEU 5 24.280 28.317 16.749 32 HD11 LEU 5 HD11 LEU 5 26.250 29.559 17.433 33 HD12 LEU 5 HD12 LEU 5 24.978 30.693 16.941 34 HD13 LEU 5 HD13 LEU 5 25.327 30.431 18.666 35 HD21 LEU 5 HD21 LEU 5 23.944 26.961 18.764 36 HD22 LEU 5 HD22 LEU 5 25.650 27.404 18.525 37 HD23 LEU 5 HD23 LEU 5 24.694 28.243 19.751 38 H ARG 6 H ARG 6 22.115 32.036 18.676 39 HA ARG 6 HA ARG 6 24.422 32.802 20.225 40 HB2 ARG 6 HB2 ARG 6 23.396 34.066 18.220 41 HB3 ARG 6 HB3 ARG 6 22.356 34.863 19.416 42 HG2 ARG 6 HG2 ARG 6 24.429 35.546 20.679 43 HG3 ARG 6 HG3 ARG 6 25.424 34.696 19.488 44 HD2 ARG 6 HD2 ARG 6 25.563 36.956 18.936 45 HD3 ARG 6 HD3 ARG 6 24.493 36.247 17.716 46 HE ARG 6 HE ARG 6 22.767 37.201 19.706 47 HH11 ARG 6 HH11 ARG 6 25.285 38.819 17.773 48 HH12 ARG 6 HH12 ARG 6 24.365 40.332 17.872 49 HH21 ARG 6 HH21 ARG 6 21.895 39.163 19.835 50 HH22 ARG 6 HH22 ARG 6 22.580 40.523 18.942 51 H ARG 7 H ARG 7 20.935 32.917 21.170 52 HA ARG 7 HA ARG 7 21.398 34.095 23.767 53 HB2 ARG 7 HB2 ARG 7 19.261 32.174 22.726 54 HB3 ARG 7 HB3 ARG 7 19.239 32.961 24.289 55 HG2 ARG 7 HG2 ARG 7 19.160 35.199 23.215 56 HG3 ARG 7 HG3 ARG 7 19.180 34.409 21.626 57 HD2 ARG 7 HD2 ARG 7 17.089 33.126 22.405 58 HD3 ARG 7 HD3 ARG 7 17.015 34.260 23.749 59 HE ARG 7 HE ARG 7 17.208 35.888 21.483 60 HH11 ARG 7 HH11 ARG 7 14.868 33.393 22.440 61 HH12 ARG 7 HH12 ARG 7 13.645 34.111 21.395 62 HH21 ARG 7 HH21 ARG 7 15.610 36.590 20.216 63 HH22 ARG 7 HH22 ARG 7 14.020 35.791 20.226 64 H CYS 8 H CYS 8 21.457 30.725 22.576 65 HA CYS 8 HA CYS 8 22.027 29.472 25.076 66 HB2 CYS 8 HB2 CYS 8 21.237 28.299 23.059 67 HB3 CYS 8 HB3 CYS 8 22.730 28.694 22.230 68 H GLU 9 H GLU 9 24.315 30.634 22.529 69 HA GLU 9 HA GLU 9 26.755 30.031 23.862 70 HB2 GLU 9 HB2 GLU 9 25.865 31.969 21.746 71 HB3 GLU 9 HB3 GLU 9 27.423 32.260 22.470 72 HG2 GLU 9 HG2 GLU 9 26.804 29.477 21.460 73 HG3 GLU 9 HG3 GLU 9 27.191 30.766 20.309 74 H LEU 10 H LEU 10 24.728 32.979 24.174 75 HA LEU 10 HA LEU 10 26.459 34.258 26.112 76 HB2 LEU 10 HB2 LEU 10 23.551 34.581 25.289 77 HB3 LEU 10 HB3 LEU 10 24.276 35.596 26.536 78 HG LEU 10 HG LEU 10 25.457 35.358 23.745 79 HD11 LEU 10 HD11 LEU 10 23.146 36.131 23.508 80 HD12 LEU 10 HD12 LEU 10 23.424 37.388 24.737 81 HD13 LEU 10 HD13 LEU 10 24.283 37.447 23.180 82 HD21 LEU 10 HD21 LEU 10 25.639 37.563 25.852 83 HD22 LEU 10 HD22 LEU 10 26.896 36.351 25.548 84 HD23 LEU 10 HD23 LEU 10 26.477 37.521 24.287 85 H SER 11 H SER 11 23.773 31.965 26.408 86 HA SER 11 HA SER 11 23.498 32.107 29.268 87 HB2 SER 11 HB2 SER 11 21.761 31.215 27.759 88 HB3 SER 11 HB3 SER 11 22.802 29.863 27.334 89 HG SER 11 HG SER 11 22.168 28.887 29.044 90 H CYS 12 H CYS 12 25.196 29.663 27.206 91 HA CYS 12 HA CYS 12 26.361 28.216 29.339 92 HB2 CYS 12 HB2 CYS 12 27.475 28.651 26.561 93 HB3 CYS 12 HB3 CYS 12 27.913 27.361 27.672 94 H ARG 13 H ARG 13 27.486 31.192 27.755 95 HA ARG 13 HA ARG 13 30.143 31.280 28.760 96 HB2 ARG 13 HB2 ARG 13 29.008 32.694 26.999 97 HB3 ARG 13 HB3 ARG 13 28.286 33.637 28.306 98 HG2 ARG 13 HG2 ARG 13 30.569 34.220 29.160 99 HG3 ARG 13 HG3 ARG 13 31.244 33.284 27.811 100 HD2 ARG 13 HD2 ARG 13 29.460 35.712 27.605 101 HD3 ARG 13 HD3 ARG 13 31.204 35.689 27.302 102 HE ARG 13 HE ARG 13 30.106 33.836 25.496 103 HH11 ARG 13 HH11 ARG 13 29.902 37.298 26.031 104 HH12 ARG 13 HH12 ARG 13 29.223 37.611 24.444 105 HH21 ARG 13 HH21 ARG 13 29.296 34.244 23.552 106 HH22 ARG 13 HH22 ARG 13 28.883 35.872 23.021 107 H SER 14 H SER 14 27.112 32.155 30.436 108 HA SER 14 HA SER 14 28.387 33.272 32.767 109 HB2 SER 14 HB2 SER 14 26.025 33.659 32.154 110 HB3 SER 14 HB3 SER 14 25.672 31.932 32.467 111 HG SER 14 HG SER 14 25.240 33.537 34.196 112 H LEU 15 H LEU 15 27.531 29.998 31.774 113 HA LEU 15 HA LEU 15 28.157 28.728 34.343 114 HB2 LEU 15 HB2 LEU 15 27.952 27.323 31.652 115 HB3 LEU 15 HB3 LEU 15 27.656 26.690 33.252 116 HG LEU 15 HG LEU 15 25.904 28.609 31.678 117 HD11 LEU 15 HD11 LEU 15 24.296 26.766 31.729 118 HD12 LEU 15 HD12 LEU 15 25.820 26.227 31.018 119 HD13 LEU 15 HD13 LEU 15 25.415 25.772 32.686 120 HD21 LEU 15 HD21 LEU 15 25.711 29.243 34.052 121 HD22 LEU 15 HD22 LEU 15 24.255 28.407 33.525 122 HD23 LEU 15 HD23 LEU 15 25.460 27.547 34.502 123 H GLY 16 H GLY 16 30.065 29.804 31.677 124 HA2 GLY 16 HA2 GLY 16 32.425 29.966 31.697 125 HA3 GLY 16 HA3 GLY 16 32.525 28.537 32.743 126 H LEU 17 H LEU 17 30.471 28.688 29.868 127 HA LEU 17 HA LEU 17 32.137 26.717 28.444 128 HB2 LEU 17 HB2 LEU 17 29.166 26.556 28.999 129 HB3 LEU 17 HB3 LEU 17 30.095 25.344 28.073 130 HG LEU 17 HG LEU 17 30.297 25.995 31.002 131 HD11 LEU 17 HD11 LEU 17 29.096 23.574 29.654 132 HD12 LEU 17 HD12 LEU 17 29.294 23.798 31.402 133 HD13 LEU 17 HD13 LEU 17 28.215 24.875 30.508 134 HD21 LEU 17 HD21 LEU 17 31.698 23.933 31.189 135 HD22 LEU 17 HD22 LEU 17 31.573 23.694 29.436 136 HD23 LEU 17 HD23 LEU 17 32.474 25.070 30.072 137 H LEU 18 H LEU 18 30.799 26.184 26.262 138 HA LEU 18 HA LEU 18 29.927 28.718 24.924 139 HB2 LEU 18 HB2 LEU 18 31.447 26.377 23.744 140 HB3 LEU 18 HB3 LEU 18 30.905 27.822 22.867 141 HG LEU 18 HG LEU 18 33.009 27.814 25.094 142 HD11 LEU 18 HD11 LEU 18 33.312 28.006 22.071 143 HD12 LEU 18 HD12 LEU 18 34.614 28.210 23.267 144 HD13 LEU 18 HD13 LEU 18 33.806 26.645 23.103 145 HD21 LEU 18 HD21 LEU 18 31.876 29.976 24.963 146 HD22 LEU 18 HD22 LEU 18 33.492 30.118 24.260 147 HD23 LEU 18 HD23 LEU 18 32.058 30.012 23.209 148 H GLY 19 H GLY 19 28.273 28.507 23.407 149 HA2 GLY 19 HA2 GLY 19 26.476 26.167 23.848 150 HA3 GLY 19 HA3 GLY 19 26.017 27.710 23.162 151 H LYS 20 H LYS 20 25.908 24.710 22.331 152 HA LYS 20 HA LYS 20 26.134 25.349 19.443 153 HB2 LYS 20 HB2 LYS 20 27.378 22.859 20.692 154 HB3 LYS 20 HB3 LYS 20 26.938 22.998 18.995 155 HG2 LYS 20 HG2 LYS 20 29.080 23.630 18.766 156 HG3 LYS 20 HG3 LYS 20 28.398 25.218 19.078 157 HD2 LYS 20 HD2 LYS 20 29.006 24.691 21.597 158 HD3 LYS 20 HD3 LYS 20 30.016 23.403 20.923 159 HE2 LYS 20 HE2 LYS 20 30.156 26.319 20.053 160 HE3 LYS 20 HE3 LYS 20 31.141 25.675 21.361 161 HZ1 LYS 20 HZ1 LYS 20 31.218 24.395 18.690 162 HZ2 LYS 20 HZ2 LYS 20 32.108 25.715 19.003 163 HZ3 LYS 20 HZ3 LYS 20 32.336 24.357 19.911 164 H CYS 21 H CYS 21 24.471 24.704 18.257 165 HA CYS 21 HA CYS 21 22.129 23.458 19.506 166 HB2 CYS 21 HB2 CYS 21 21.933 25.243 17.837 167 HB3 CYS 21 HB3 CYS 21 22.765 24.266 16.671 168 H ILE 22 H ILE 22 21.644 21.375 19.577 169 HA ILE 22 HA ILE 22 22.731 19.335 17.729 170 HB ILE 22 HB ILE 22 23.139 19.272 20.753 171 HG12 ILE 22 HG12 ILE 22 25.145 19.351 18.464 172 HG13 ILE 22 HG13 ILE 22 24.846 20.630 19.642 173 HG21 ILE 22 HG21 ILE 22 23.792 17.120 18.695 174 HG22 ILE 22 HG22 ILE 22 24.109 17.035 20.438 175 HG23 ILE 22 HG23 ILE 22 22.456 17.044 19.866 176 HD11 ILE 22 HD11 ILE 22 25.683 19.146 21.454 177 HD12 ILE 22 HD12 ILE 22 26.152 17.958 20.212 178 HD13 ILE 22 HD13 ILE 22 26.886 19.562 20.225 179 H GLY 23 H GLY 23 20.807 18.590 16.967 180 HA2 GLY 23 HA2 GLY 23 18.914 17.312 16.948 181 HA3 GLY 23 HA3 GLY 23 19.134 17.027 18.681 182 H GLU 24 H GLU 24 18.509 20.091 16.969 183 HA GLU 24 HA GLU 24 17.120 21.825 17.392 184 HB2 GLU 24 HB2 GLU 24 14.990 19.690 17.708 185 HB3 GLU 24 HB3 GLU 24 14.743 21.412 17.371 186 HG2 GLU 24 HG2 GLU 24 16.032 21.184 15.251 187 HG3 GLU 24 HG3 GLU 24 16.176 19.448 15.547 188 H GLU 25 H GLU 25 18.591 20.934 19.583 189 HA GLU 25 HA GLU 25 17.419 22.549 21.715 190 HB2 GLU 25 HB2 GLU 25 18.532 19.744 22.148 191 HB3 GLU 25 HB3 GLU 25 18.305 20.906 23.440 192 HG2 GLU 25 HG2 GLU 25 16.009 19.864 21.732 193 HG3 GLU 25 HG3 GLU 25 16.568 19.091 23.202 194 H CYS 26 H CYS 26 19.305 23.175 23.247 195 HA CYS 26 HA CYS 26 21.885 23.115 21.724 196 HB2 CYS 26 HB2 CYS 26 20.661 25.245 21.512 197 HB3 CYS 26 HB3 CYS 26 20.767 25.457 23.256 198 H LYS 27 H LYS 27 23.714 22.725 22.712 199 HA LYS 27 HA LYS 27 23.656 22.024 25.634 200 HB2 LYS 27 HB2 LYS 27 25.111 20.727 23.296 201 HB3 LYS 27 HB3 LYS 27 25.550 20.456 24.986 202 HG2 LYS 27 HG2 LYS 27 23.220 19.681 25.448 203 HG3 LYS 27 HG3 LYS 27 22.853 19.788 23.713 204 HD2 LYS 27 HD2 LYS 27 24.527 18.089 23.198 205 HD3 LYS 27 HD3 LYS 27 25.161 18.164 24.849 206 HE2 LYS 27 HE2 LYS 27 22.869 17.426 25.669 207 HE3 LYS 27 HE3 LYS 27 22.461 17.098 23.978 208 HZ1 LYS 27 HZ1 LYS 27 23.248 15.132 25.093 209 HZ2 LYS 27 HZ2 LYS 27 24.338 15.516 23.932 210 HZ3 LYS 27 HZ3 LYS 27 24.689 15.841 25.488 211 H CYS 28 H CYS 28 25.366 22.509 26.909 212 HA CYS 28 HA CYS 28 27.285 24.540 25.890 213 HB2 CYS 28 HB2 CYS 28 26.721 23.692 28.734 214 HB3 CYS 28 HB3 CYS 28 27.715 25.028 28.207 215 H VAL 29 H VAL 29 29.371 24.083 25.591 216 HA VAL 29 HA VAL 29 30.685 21.739 26.892 217 HB VAL 29 HB VAL 29 31.703 21.051 24.788 218 HG11 VAL 29 HG11 VAL 29 29.805 19.949 23.755 219 HG12 VAL 29 HG12 VAL 29 29.631 19.931 25.515 220 HG13 VAL 29 HG13 VAL 29 28.671 21.062 24.529 221 HG21 VAL 29 HG21 VAL 29 30.920 21.829 22.614 222 HG22 VAL 29 HG22 VAL 29 29.836 23.008 23.394 223 HG23 VAL 29 HG23 VAL 29 31.600 23.182 23.519 224 H TYR 30 H TYR 30 33.134 21.804 26.484 225 HA TYR 30 HA TYR 30 34.089 24.553 26.987 226 HB2 TYR 30 HB2 TYR 30 35.489 21.863 26.922 227 HB3 TYR 30 HB3 TYR 30 36.299 23.383 27.230 228 HD1 TYR 30 HD1 TYR 30 36.069 24.573 29.341 229 HD2 TYR 30 HD2 TYR 30 33.852 20.945 28.612 230 HE1 TYR 30 HE1 TYR 30 35.511 24.417 31.765 231 HE2 TYR 30 HE2 TYR 30 33.315 20.783 31.034 232 HH TYR 30 HH TYR 30 33.725 21.654 33.144 233 H ASN 31 H ASN 31 34.180 22.214 24.316 234 HA ASN 31 HA ASN 31 35.205 24.313 22.470 235 HB2 ASN 31 HB2 ASN 31 36.423 21.523 22.718 236 HB3 ASN 31 HB3 ASN 31 36.835 22.718 21.505 237 HD21 ASN 31 HD21 ASN 31 38.692 22.830 25.070 238 HD22 ASN 31 HD22 ASN 31 37.564 21.560 24.640 Start of MODEL 8 1 H1 ALA 1 H1 ALA 1 13.912 21.201 18.297 2 H2 ALA 1 H2 ALA 1 13.635 21.040 16.683 3 H3 ALA 1 H3 ALA 1 12.368 21.195 17.732 4 HA ALA 1 HA ALA 1 14.371 23.230 17.087 5 HB1 ALA 1 HB1 ALA 1 12.513 24.422 16.010 6 HB2 ALA 1 HB2 ALA 1 12.835 22.863 15.234 7 HB3 ALA 1 HB3 ALA 1 11.434 23.044 16.316 8 H PHE 2 H PHE 2 14.880 23.569 19.314 9 HA PHE 2 HA PHE 2 12.868 25.222 20.738 10 HB2 PHE 2 HB2 PHE 2 14.505 22.977 21.979 11 HB3 PHE 2 HB3 PHE 2 13.480 24.095 22.865 12 HD1 PHE 2 HD1 PHE 2 13.566 20.868 21.434 13 HD2 PHE 2 HD2 PHE 2 10.964 24.254 22.013 14 HE1 PHE 2 HE1 PHE 2 11.579 19.396 21.170 15 HE2 PHE 2 HE2 PHE 2 8.995 22.789 21.769 16 HZ PHE 2 HZ PHE 2 9.288 20.345 21.359 17 H CYS 3 H CYS 3 15.661 25.524 19.286 18 HA CYS 3 HA CYS 3 16.993 27.118 21.445 19 HB2 CYS 3 HB2 CYS 3 17.835 24.870 21.443 20 HB3 CYS 3 HB3 CYS 3 18.175 24.939 19.712 21 H ASN 4 H ASN 4 18.559 28.632 20.840 22 HA ASN 4 HA ASN 4 18.828 29.417 18.037 23 HB2 ASN 4 HB2 ASN 4 17.988 31.335 20.259 24 HB3 ASN 4 HB3 ASN 4 18.585 31.811 18.665 25 HD21 ASN 4 HD21 ASN 4 15.653 30.866 16.886 26 HD22 ASN 4 HD22 ASN 4 17.411 30.938 16.766 27 H LEU 5 H LEU 5 20.877 29.575 17.641 28 HA LEU 5 HA LEU 5 22.832 28.695 19.255 29 HB2 LEU 5 HB2 LEU 5 22.639 28.952 16.793 30 HB3 LEU 5 HB3 LEU 5 23.199 30.600 16.923 31 HG LEU 5 HG LEU 5 24.766 28.918 16.173 32 HD11 LEU 5 HD11 LEU 5 25.748 30.207 18.750 33 HD12 LEU 5 HD12 LEU 5 26.733 29.720 17.364 34 HD13 LEU 5 HD13 LEU 5 25.584 31.051 17.198 35 HD21 LEU 5 HD21 LEU 5 24.119 27.057 17.672 36 HD22 LEU 5 HD22 LEU 5 25.868 27.346 17.618 37 HD23 LEU 5 HD23 LEU 5 24.935 27.905 19.020 38 H ARG 6 H ARG 6 22.512 32.212 18.504 39 HA ARG 6 HA ARG 6 24.574 32.976 20.332 40 HB2 ARG 6 HB2 ARG 6 23.691 34.304 18.412 41 HB3 ARG 6 HB3 ARG 6 22.294 34.754 19.372 42 HG2 ARG 6 HG2 ARG 6 25.105 35.220 20.433 43 HG3 ARG 6 HG3 ARG 6 24.487 36.267 19.172 44 HD2 ARG 6 HD2 ARG 6 23.114 35.836 21.857 45 HD3 ARG 6 HD3 ARG 6 24.196 37.172 21.483 46 HE ARG 6 HE ARG 6 21.402 36.916 20.709 47 HH11 ARG 6 HH11 ARG 6 24.416 38.537 19.744 48 HH12 ARG 6 HH12 ARG 6 23.542 39.538 18.608 49 HH21 ARG 6 HH21 ARG 6 20.467 38.690 19.763 50 HH22 ARG 6 HH22 ARG 6 21.455 39.839 18.906 51 H ARG 7 H ARG 7 21.028 32.838 20.919 52 HA ARG 7 HA ARG 7 21.074 33.646 23.649 53 HB2 ARG 7 HB2 ARG 7 19.033 33.284 22.205 54 HB3 ARG 7 HB3 ARG 7 19.282 31.552 22.340 55 HG2 ARG 7 HG2 ARG 7 17.554 32.132 23.871 56 HG3 ARG 7 HG3 ARG 7 18.971 31.727 24.828 57 HD2 ARG 7 HD2 ARG 7 17.955 33.657 25.818 58 HD3 ARG 7 HD3 ARG 7 19.451 34.198 25.047 59 HE ARG 7 HE ARG 7 17.060 34.454 23.355 60 HH11 ARG 7 HH11 ARG 7 18.868 36.207 25.863 61 HH12 ARG 7 HH12 ARG 7 18.235 37.730 25.241 62 HH21 ARG 7 HH21 ARG 7 16.315 36.400 22.800 63 HH22 ARG 7 HH22 ARG 7 16.884 37.845 23.640 64 H CYS 8 H CYS 8 21.664 30.406 22.273 65 HA CYS 8 HA CYS 8 22.107 29.107 24.807 66 HB2 CYS 8 HB2 CYS 8 21.412 27.992 22.723 67 HB3 CYS 8 HB3 CYS 8 22.977 28.350 22.004 68 H GLU 9 H GLU 9 24.422 30.504 22.409 69 HA GLU 9 HA GLU 9 26.831 29.971 23.846 70 HB2 GLU 9 HB2 GLU 9 25.987 32.086 21.857 71 HB3 GLU 9 HB3 GLU 9 27.563 32.195 22.613 72 HG2 GLU 9 HG2 GLU 9 26.720 29.618 21.266 73 HG3 GLU 9 HG3 GLU 9 27.311 30.987 20.320 74 H LEU 10 H LEU 10 24.616 32.799 24.162 75 HA LEU 10 HA LEU 10 26.138 34.054 26.277 76 HB2 LEU 10 HB2 LEU 10 23.206 34.224 25.474 77 HB3 LEU 10 HB3 LEU 10 23.928 35.221 26.731 78 HG LEU 10 HG LEU 10 24.753 35.277 23.796 79 HD11 LEU 10 HD11 LEU 10 22.481 36.167 24.218 80 HD12 LEU 10 HD12 LEU 10 23.122 37.222 25.492 81 HD13 LEU 10 HD13 LEU 10 23.606 37.466 23.799 82 HD21 LEU 10 HD21 LEU 10 25.963 37.333 24.401 83 HD22 LEU 10 HD22 LEU 10 25.556 37.073 26.120 84 HD23 LEU 10 HD23 LEU 10 26.623 35.944 25.249 85 H SER 11 H SER 11 23.602 31.576 26.287 86 HA SER 11 HA SER 11 23.149 31.520 29.120 87 HB2 SER 11 HB2 SER 11 21.632 30.524 27.401 88 HB3 SER 11 HB3 SER 11 22.832 29.261 27.099 89 HG SER 11 HG SER 11 21.084 28.761 28.586 90 H CYS 12 H CYS 12 25.256 29.492 27.022 91 HA CYS 12 HA CYS 12 26.461 28.077 29.211 92 HB2 CYS 12 HB2 CYS 12 27.316 28.487 26.332 93 HB3 CYS 12 HB3 CYS 12 28.050 27.338 27.446 94 H ARG 13 H ARG 13 27.394 31.127 27.546 95 HA ARG 13 HA ARG 13 29.966 31.456 28.642 96 HB2 ARG 13 HB2 ARG 13 28.941 32.921 26.931 97 HB3 ARG 13 HB3 ARG 13 27.846 33.596 28.150 98 HG2 ARG 13 HG2 ARG 13 29.808 34.450 29.400 99 HG3 ARG 13 HG3 ARG 13 30.894 33.713 28.213 100 HD2 ARG 13 HD2 ARG 13 30.763 36.030 27.744 101 HD3 ARG 13 HD3 ARG 13 29.889 35.191 26.449 102 HE ARG 13 HE ARG 13 27.891 35.865 28.274 103 HH11 ARG 13 HH11 ARG 13 30.322 37.857 26.620 104 HH12 ARG 13 HH12 ARG 13 29.201 39.226 26.651 105 HH21 ARG 13 HH21 ARG 13 26.740 37.698 28.367 106 HH22 ARG 13 HH22 ARG 13 27.366 39.174 27.623 107 H SER 14 H SER 14 26.835 32.139 30.221 108 HA SER 14 HA SER 14 27.848 33.162 32.690 109 HB2 SER 14 HB2 SER 14 25.363 31.487 32.265 110 HB3 SER 14 HB3 SER 14 25.640 32.689 33.538 111 HG SER 14 HG SER 14 25.694 34.308 31.886 112 H LEU 15 H LEU 15 27.909 29.906 31.480 113 HA LEU 15 HA LEU 15 28.506 28.758 34.168 114 HB2 LEU 15 HB2 LEU 15 28.225 27.327 31.503 115 HB3 LEU 15 HB3 LEU 15 28.327 26.600 33.101 116 HG LEU 15 HG LEU 15 26.007 28.219 31.967 117 HD11 LEU 15 HD11 LEU 15 26.282 25.287 32.734 118 HD12 LEU 15 HD12 LEU 15 24.807 26.078 32.147 119 HD13 LEU 15 HD13 LEU 15 26.218 25.939 31.082 120 HD21 LEU 15 HD21 LEU 15 26.158 28.645 34.392 121 HD22 LEU 15 HD22 LEU 15 24.788 27.589 34.035 122 HD23 LEU 15 HD23 LEU 15 26.283 26.897 34.707 123 H GLY 16 H GLY 16 30.075 30.022 31.388 124 HA2 GLY 16 HA2 GLY 16 32.415 30.407 31.209 125 HA3 GLY 16 HA3 GLY 16 32.743 29.063 32.307 126 H LEU 17 H LEU 17 30.414 28.561 29.772 127 HA LEU 17 HA LEU 17 32.306 26.812 28.299 128 HB2 LEU 17 HB2 LEU 17 29.348 26.326 28.660 129 HB3 LEU 17 HB3 LEU 17 30.550 25.186 28.055 130 HG LEU 17 HG LEU 17 30.182 26.201 30.879 131 HD11 LEU 17 HD11 LEU 17 29.517 23.899 31.412 132 HD12 LEU 17 HD12 LEU 17 28.433 24.675 30.261 133 HD13 LEU 17 HD13 LEU 17 29.628 23.473 29.693 134 HD21 LEU 17 HD21 LEU 17 32.582 25.668 30.488 135 HD22 LEU 17 HD22 LEU 17 31.851 24.430 31.513 136 HD23 LEU 17 HD23 LEU 17 32.110 24.115 29.779 137 H LEU 18 H LEU 18 31.359 26.209 26.020 138 HA LEU 18 HA LEU 18 30.208 28.661 24.716 139 HB2 LEU 18 HB2 LEU 18 31.257 26.210 23.320 140 HB3 LEU 18 HB3 LEU 18 30.890 27.791 22.626 141 HG LEU 18 HG LEU 18 33.192 27.157 24.552 142 HD11 LEU 18 HD11 LEU 18 34.656 27.440 22.652 143 HD12 LEU 18 HD12 LEU 18 33.457 26.195 22.277 144 HD13 LEU 18 HD13 LEU 18 33.284 27.832 21.600 145 HD21 LEU 18 HD21 LEU 18 32.426 29.501 24.794 146 HD22 LEU 18 HD22 LEU 18 34.013 29.417 24.026 147 HD23 LEU 18 HD23 LEU 18 32.562 29.730 23.039 148 H GLY 19 H GLY 19 28.406 28.279 23.213 149 HA2 GLY 19 HA2 GLY 19 26.683 25.932 24.026 150 HA3 GLY 19 HA3 GLY 19 26.058 27.535 23.690 151 H LYS 20 H LYS 20 25.638 24.723 22.511 152 HA LYS 20 HA LYS 20 25.258 25.775 19.779 153 HB2 LYS 20 HB2 LYS 20 26.724 23.170 20.345 154 HB3 LYS 20 HB3 LYS 20 25.810 23.442 18.866 155 HG2 LYS 20 HG2 LYS 20 27.705 24.162 18.016 156 HG3 LYS 20 HG3 LYS 20 27.292 25.688 18.761 157 HD2 LYS 20 HD2 LYS 20 28.722 25.077 20.737 158 HD3 LYS 20 HD3 LYS 20 29.113 23.545 19.965 159 HE2 LYS 20 HE2 LYS 20 29.839 26.331 18.945 160 HE3 LYS 20 HE3 LYS 20 30.926 25.162 19.694 161 HZ1 LYS 20 HZ1 LYS 20 29.614 24.915 17.053 162 HZ2 LYS 20 HZ2 LYS 20 31.227 24.959 17.361 163 HZ3 LYS 20 HZ3 LYS 20 30.300 23.647 17.779 164 H CYS 21 H CYS 21 23.521 24.928 18.652 165 HA CYS 21 HA CYS 21 21.424 23.760 20.350 166 HB2 CYS 21 HB2 CYS 21 21.374 24.836 17.536 167 HB3 CYS 21 HB3 CYS 21 19.967 24.266 18.430 168 H ILE 22 H ILE 22 23.052 21.796 20.331 169 HA ILE 22 HA ILE 22 23.149 20.055 18.015 170 HB ILE 22 HB ILE 22 23.760 19.637 20.950 171 HG12 ILE 22 HG12 ILE 22 25.743 19.671 18.644 172 HG13 ILE 22 HG13 ILE 22 25.209 21.173 19.385 173 HG21 ILE 22 HG21 ILE 22 24.244 17.702 18.642 174 HG22 ILE 22 HG22 ILE 22 24.907 17.521 20.272 175 HG23 ILE 22 HG23 ILE 22 23.167 17.430 20.032 176 HD11 ILE 22 HD11 ILE 22 26.018 20.462 21.588 177 HD12 ILE 22 HD12 ILE 22 26.587 18.924 20.898 178 HD13 ILE 22 HD13 ILE 22 27.310 20.453 20.373 179 H GLY 23 H GLY 23 21.534 18.828 17.219 180 HA2 GLY 23 HA2 GLY 23 19.571 17.588 17.101 181 HA3 GLY 23 HA3 GLY 23 19.519 17.501 18.865 182 H GLU 24 H GLU 24 19.790 20.658 17.524 183 HA GLU 24 HA GLU 24 18.516 22.514 17.571 184 HB2 GLU 24 HB2 GLU 24 16.059 20.798 17.287 185 HB3 GLU 24 HB3 GLU 24 16.216 22.526 17.001 186 HG2 GLU 24 HG2 GLU 24 17.750 22.119 15.116 187 HG3 GLU 24 HG3 GLU 24 17.584 20.367 15.362 188 H GLU 25 H GLU 25 19.293 21.130 19.966 189 HA GLU 25 HA GLU 25 17.538 22.510 21.945 190 HB2 GLU 25 HB2 GLU 25 18.962 19.862 22.269 191 HB3 GLU 25 HB3 GLU 25 17.984 20.661 23.499 192 HG2 GLU 25 HG2 GLU 25 15.955 20.295 22.141 193 HG3 GLU 25 HG3 GLU 25 16.917 19.550 20.862 194 H CYS 26 H CYS 26 18.748 23.507 23.663 195 HA CYS 26 HA CYS 26 21.481 24.191 22.892 196 HB2 CYS 26 HB2 CYS 26 19.995 25.897 23.806 197 HB3 CYS 26 HB3 CYS 26 19.831 24.984 25.304 198 H LYS 27 H LYS 27 23.227 23.099 23.350 199 HA LYS 27 HA LYS 27 23.619 21.950 26.070 200 HB2 LYS 27 HB2 LYS 27 24.444 20.597 23.469 201 HB3 LYS 27 HB3 LYS 27 25.057 20.172 25.060 202 HG2 LYS 27 HG2 LYS 27 23.361 18.757 25.343 203 HG3 LYS 27 HG3 LYS 27 22.257 20.122 25.406 204 HD2 LYS 27 HD2 LYS 27 22.183 19.994 22.824 205 HD3 LYS 27 HD3 LYS 27 23.044 18.444 22.998 206 HE2 LYS 27 HE2 LYS 27 21.152 17.773 24.623 207 HE3 LYS 27 HE3 LYS 27 20.303 19.227 24.064 208 HZ1 LYS 27 HZ1 LYS 27 19.556 17.504 22.695 209 HZ2 LYS 27 HZ2 LYS 27 20.668 18.242 21.750 210 HZ3 LYS 27 HZ3 LYS 27 21.040 16.818 22.542 211 H CYS 28 H CYS 28 25.611 22.258 26.933 212 HA CYS 28 HA CYS 28 27.269 24.258 25.533 213 HB2 CYS 28 HB2 CYS 28 27.504 23.311 28.388 214 HB3 CYS 28 HB3 CYS 28 28.296 24.698 27.674 215 H VAL 29 H VAL 29 29.490 24.075 25.286 216 HA VAL 29 HA VAL 29 30.721 21.370 25.528 217 HB VAL 29 HB VAL 29 31.785 21.602 23.346 218 HG11 VAL 29 HG11 VAL 29 29.882 21.022 21.955 219 HG12 VAL 29 HG12 VAL 29 29.679 20.314 23.566 220 HG13 VAL 29 HG13 VAL 29 28.754 21.762 23.106 221 HG21 VAL 29 HG21 VAL 29 29.994 24.025 22.921 222 HG22 VAL 29 HG22 VAL 29 31.776 24.002 22.994 223 HG23 VAL 29 HG23 VAL 29 30.939 23.195 21.668 224 H TYR 30 H TYR 30 32.941 21.317 25.759 225 HA TYR 30 HA TYR 30 33.839 23.560 27.386 226 HB2 TYR 30 HB2 TYR 30 35.105 20.861 26.796 227 HB3 TYR 30 HB3 TYR 30 35.654 21.998 28.025 228 HD1 TYR 30 HD1 TYR 30 33.972 22.728 29.845 229 HD2 TYR 30 HD2 TYR 30 33.435 19.242 27.374 230 HE1 TYR 30 HE1 TYR 30 32.246 21.881 31.424 231 HE2 TYR 30 HE2 TYR 30 31.716 18.393 28.952 232 HH TYR 30 HH TYR 30 30.918 20.117 31.982 233 H ASN 31 H ASN 31 34.522 22.598 24.131 234 HA ASN 31 HA ASN 31 36.468 24.714 23.722 235 HB2 ASN 31 HB2 ASN 31 38.227 23.128 22.835 236 HB3 ASN 31 HB3 ASN 31 38.031 23.106 24.579 237 HD21 ASN 31 HD21 ASN 31 36.351 19.773 22.955 238 HD22 ASN 31 HD22 ASN 31 35.782 21.377 22.484 Start of MODEL 9 1 H1 ALA 1 H1 ALA 1 10.737 20.421 17.806 2 H2 ALA 1 H2 ALA 1 10.605 19.549 19.183 3 H3 ALA 1 H3 ALA 1 11.985 19.477 18.255 4 HA ALA 1 HA ALA 1 10.973 21.844 19.686 5 HB1 ALA 1 HB1 ALA 1 13.414 20.138 20.314 6 HB2 ALA 1 HB2 ALA 1 12.934 21.618 21.159 7 HB3 ALA 1 HB3 ALA 1 11.906 20.180 21.250 8 H PHE 2 H PHE 2 12.422 23.677 19.708 9 HA PHE 2 HA PHE 2 14.335 23.890 17.450 10 HB2 PHE 2 HB2 PHE 2 12.156 25.889 18.114 11 HB3 PHE 2 HB3 PHE 2 13.424 26.123 16.955 12 HD1 PHE 2 HD1 PHE 2 10.055 25.377 17.177 13 HD2 PHE 2 HD2 PHE 2 13.635 24.009 15.184 14 HE1 PHE 2 HE1 PHE 2 8.660 24.498 15.299 15 HE2 PHE 2 HE2 PHE 2 12.265 23.032 13.358 16 HZ PHE 2 HZ PHE 2 9.785 23.309 13.413 17 H CYS 3 H CYS 3 15.870 25.575 17.727 18 HA CYS 3 HA CYS 3 16.372 26.391 20.538 19 HB2 CYS 3 HB2 CYS 3 17.410 24.263 20.059 20 HB3 CYS 3 HB3 CYS 3 18.126 24.872 18.570 21 H ASN 4 H ASN 4 18.252 27.937 20.652 22 HA ASN 4 HA ASN 4 18.346 29.897 18.422 23 HB2 ASN 4 HB2 ASN 4 17.724 30.420 21.357 24 HB3 ASN 4 HB3 ASN 4 18.120 31.680 20.183 25 HD21 ASN 4 HD21 ASN 4 14.963 31.615 18.604 26 HD22 ASN 4 HD22 ASN 4 16.662 31.919 18.291 27 H LEU 5 H LEU 5 20.342 29.643 17.807 28 HA LEU 5 HA LEU 5 22.409 28.474 19.206 29 HB2 LEU 5 HB2 LEU 5 21.906 28.948 16.679 30 HB3 LEU 5 HB3 LEU 5 22.936 30.351 16.892 31 HG LEU 5 HG LEU 5 23.679 27.434 17.397 32 HD11 LEU 5 HD11 LEU 5 23.330 27.987 15.031 33 HD12 LEU 5 HD12 LEU 5 24.441 29.370 15.166 34 HD13 LEU 5 HD13 LEU 5 25.038 27.704 15.349 35 HD21 LEU 5 HD21 LEU 5 25.099 28.696 18.845 36 HD22 LEU 5 HD22 LEU 5 26.057 28.426 17.387 37 HD23 LEU 5 HD23 LEU 5 25.292 29.994 17.647 38 H ARG 6 H ARG 6 22.440 32.000 18.432 39 HA ARG 6 HA ARG 6 24.660 32.634 20.120 40 HB2 ARG 6 HB2 ARG 6 23.875 34.210 18.397 41 HB3 ARG 6 HB3 ARG 6 22.295 34.299 19.152 42 HG2 ARG 6 HG2 ARG 6 23.155 36.283 19.799 43 HG3 ARG 6 HG3 ARG 6 23.516 35.341 21.212 44 HD2 ARG 6 HD2 ARG 6 25.366 36.297 19.021 45 HD3 ARG 6 HD3 ARG 6 25.382 36.712 20.746 46 HE ARG 6 HE ARG 6 25.915 33.908 20.388 47 HH11 ARG 6 HH11 ARG 6 27.514 37.055 20.152 48 HH12 ARG 6 HH12 ARG 6 29.095 36.252 20.180 49 HH21 ARG 6 HH21 ARG 6 28.002 33.081 20.131 50 HH22 ARG 6 HH22 ARG 6 29.336 34.230 20.222 51 H ARG 7 H ARG 7 21.153 32.570 20.869 52 HA ARG 7 HA ARG 7 21.366 33.579 23.533 53 HB2 ARG 7 HB2 ARG 7 19.261 33.297 22.162 54 HB3 ARG 7 HB3 ARG 7 19.373 31.563 22.431 55 HG2 ARG 7 HG2 ARG 7 17.714 32.629 23.883 56 HG3 ARG 7 HG3 ARG 7 18.971 31.811 24.803 57 HD2 ARG 7 HD2 ARG 7 18.276 33.993 25.756 58 HD3 ARG 7 HD3 ARG 7 20.006 33.883 25.414 59 HE ARG 7 HE ARG 7 19.330 35.117 23.191 60 HH11 ARG 7 HH11 ARG 7 17.737 35.897 26.292 61 HH12 ARG 7 HH12 ARG 7 17.662 37.572 25.835 62 HH21 ARG 7 HH21 ARG 7 19.109 37.112 22.748 63 HH22 ARG 7 HH22 ARG 7 18.314 38.254 23.816 64 H CYS 8 H CYS 8 21.473 30.205 22.397 65 HA CYS 8 HA CYS 8 21.986 28.930 24.886 66 HB2 CYS 8 HB2 CYS 8 21.327 27.790 22.820 67 HB3 CYS 8 HB3 CYS 8 22.815 28.272 22.042 68 H GLU 9 H GLU 9 24.363 30.166 22.440 69 HA GLU 9 HA GLU 9 26.726 29.595 23.924 70 HB2 GLU 9 HB2 GLU 9 26.059 31.674 21.836 71 HB3 GLU 9 HB3 GLU 9 27.655 31.569 22.552 72 HG2 GLU 9 HG2 GLU 9 27.883 29.263 21.842 73 HG3 GLU 9 HG3 GLU 9 26.279 29.241 21.103 74 H LEU 10 H LEU 10 24.720 32.587 24.058 75 HA LEU 10 HA LEU 10 26.462 33.918 25.944 76 HB2 LEU 10 HB2 LEU 10 23.547 34.317 25.164 77 HB3 LEU 10 HB3 LEU 10 24.382 35.363 26.302 78 HG LEU 10 HG LEU 10 25.235 34.968 23.399 79 HD11 LEU 10 HD11 LEU 10 23.746 37.265 24.751 80 HD12 LEU 10 HD12 LEU 10 24.307 37.234 23.065 81 HD13 LEU 10 HD13 LEU 10 23.050 36.107 23.598 82 HD21 LEU 10 HD21 LEU 10 27.133 35.657 24.793 83 HD22 LEU 10 HD22 LEU 10 26.595 37.010 23.802 84 HD23 LEU 10 HD23 LEU 10 26.158 36.958 25.523 85 H SER 11 H SER 11 23.589 31.834 26.373 86 HA SER 11 HA SER 11 23.447 32.159 29.206 87 HB2 SER 11 HB2 SER 11 21.612 31.299 27.810 88 HB3 SER 11 HB3 SER 11 22.548 29.807 27.503 89 HG SER 11 HG SER 11 20.968 29.722 29.207 90 H CYS 12 H CYS 12 25.129 29.667 27.213 91 HA CYS 12 HA CYS 12 26.344 28.296 29.409 92 HB2 CYS 12 HB2 CYS 12 27.319 28.630 26.550 93 HB3 CYS 12 HB3 CYS 12 27.903 27.440 27.708 94 H ARG 13 H ARG 13 27.361 31.292 27.721 95 HA ARG 13 HA ARG 13 30.004 31.486 28.687 96 HB2 ARG 13 HB2 ARG 13 28.691 33.013 27.024 97 HB3 ARG 13 HB3 ARG 13 28.158 33.883 28.462 98 HG2 ARG 13 HG2 ARG 13 30.640 34.118 29.067 99 HG3 ARG 13 HG3 ARG 13 31.019 33.514 27.453 100 HD2 ARG 13 HD2 ARG 13 29.196 35.908 27.958 101 HD3 ARG 13 HD3 ARG 13 30.952 36.057 27.872 102 HE ARG 13 HE ARG 13 30.149 34.756 25.493 103 HH11 ARG 13 HH11 ARG 13 29.837 37.924 27.000 104 HH12 ARG 13 HH12 ARG 13 30.110 38.741 25.475 105 HH21 ARG 13 HH21 ARG 13 30.253 35.882 23.596 106 HH22 ARG 13 HH22 ARG 13 29.930 37.618 23.574 107 H SER 14 H SER 14 26.986 32.265 30.420 108 HA SER 14 HA SER 14 28.184 33.396 32.789 109 HB2 SER 14 HB2 SER 14 25.562 31.905 32.375 110 HB3 SER 14 HB3 SER 14 25.998 32.793 33.843 111 HG SER 14 HG SER 14 25.796 34.639 32.882 112 H LEU 15 H LEU 15 27.708 30.047 31.750 113 HA LEU 15 HA LEU 15 28.386 28.897 34.377 114 HB2 LEU 15 HB2 LEU 15 28.159 27.545 31.670 115 HB3 LEU 15 HB3 LEU 15 28.186 26.773 33.245 116 HG LEU 15 HG LEU 15 25.978 28.559 32.124 117 HD11 LEU 15 HD11 LEU 15 26.089 26.297 31.158 118 HD12 LEU 15 HD12 LEU 15 26.044 25.587 32.789 119 HD13 LEU 15 HD13 LEU 15 24.655 26.503 32.167 120 HD21 LEU 15 HD21 LEU 15 26.076 28.892 34.560 121 HD22 LEU 15 HD22 LEU 15 24.682 27.900 34.136 122 HD23 LEU 15 HD23 LEU 15 26.130 27.132 34.819 123 H GLY 16 H GLY 16 30.147 30.129 31.674 124 HA2 GLY 16 HA2 GLY 16 32.486 30.499 31.653 125 HA3 GLY 16 HA3 GLY 16 32.736 29.129 32.746 126 H LEU 17 H LEU 17 30.507 28.756 30.064 127 HA LEU 17 HA LEU 17 32.392 26.840 28.789 128 HB2 LEU 17 HB2 LEU 17 29.375 26.654 28.917 129 HB3 LEU 17 HB3 LEU 17 30.479 25.410 28.347 130 HG LEU 17 HG LEU 17 30.060 26.371 31.171 131 HD11 LEU 17 HD11 LEU 17 29.427 23.725 29.845 132 HD12 LEU 17 HD12 LEU 17 29.260 24.074 31.580 133 HD13 LEU 17 HD13 LEU 17 28.270 24.962 30.421 134 HD21 LEU 17 HD21 LEU 17 32.452 25.695 30.876 135 HD22 LEU 17 HD22 LEU 17 31.589 24.505 31.851 136 HD23 LEU 17 HD23 LEU 17 31.915 24.176 30.134 137 H LEU 18 H LEU 18 31.366 26.125 26.621 138 HA LEU 18 HA LEU 18 30.756 28.456 24.844 139 HB2 LEU 18 HB2 LEU 18 31.720 25.637 24.226 140 HB3 LEU 18 HB3 LEU 18 31.405 26.869 23.025 141 HG LEU 18 HG LEU 18 33.567 27.089 25.174 142 HD11 LEU 18 HD11 LEU 18 33.965 25.219 23.611 143 HD12 LEU 18 HD12 LEU 18 33.802 26.337 22.237 144 HD13 LEU 18 HD13 LEU 18 35.131 26.532 23.408 145 HD21 LEU 18 HD21 LEU 18 32.869 29.284 24.332 146 HD22 LEU 18 HD22 LEU 18 34.441 28.857 23.638 147 HD23 LEU 18 HD23 LEU 18 32.974 28.703 22.652 148 H GLY 19 H GLY 19 29.070 27.770 23.090 149 HA2 GLY 19 HA2 GLY 19 27.138 25.726 24.058 150 HA3 GLY 19 HA3 GLY 19 26.557 27.374 23.917 151 H LYS 20 H LYS 20 25.697 24.953 22.512 152 HA LYS 20 HA LYS 20 25.609 26.073 19.758 153 HB2 LYS 20 HB2 LYS 20 26.212 23.734 18.949 154 HB3 LYS 20 HB3 LYS 20 27.513 24.731 19.590 155 HG2 LYS 20 HG2 LYS 20 27.276 23.597 21.815 156 HG3 LYS 20 HG3 LYS 20 26.082 22.487 21.093 157 HD2 LYS 20 HD2 LYS 20 28.956 22.975 20.325 158 HD3 LYS 20 HD3 LYS 20 28.346 21.606 21.276 159 HE2 LYS 20 HE2 LYS 20 26.956 20.918 19.247 160 HE3 LYS 20 HE3 LYS 20 27.775 22.191 18.334 161 HZ1 LYS 20 HZ1 LYS 20 28.927 20.214 17.922 162 HZ2 LYS 20 HZ2 LYS 20 29.899 21.050 18.916 163 HZ3 LYS 20 HZ3 LYS 20 29.021 19.769 19.502 164 H CYS 21 H CYS 21 23.849 25.399 18.542 165 HA CYS 21 HA CYS 21 21.722 23.825 19.914 166 HB2 CYS 21 HB2 CYS 21 21.765 25.346 17.286 167 HB3 CYS 21 HB3 CYS 21 20.419 24.362 17.829 168 H ILE 22 H ILE 22 21.709 21.683 19.691 169 HA ILE 22 HA ILE 22 23.100 20.369 17.425 170 HB ILE 22 HB ILE 22 21.771 19.038 19.802 171 HG12 ILE 22 HG12 ILE 22 24.625 20.058 19.424 172 HG13 ILE 22 HG13 ILE 22 23.479 20.540 20.677 173 HG21 ILE 22 HG21 ILE 22 23.942 18.061 17.878 174 HG22 ILE 22 HG22 ILE 22 23.127 17.114 19.143 175 HG23 ILE 22 HG23 ILE 22 22.232 17.628 17.727 176 HD11 ILE 22 HD11 ILE 22 25.154 19.118 21.633 177 HD12 ILE 22 HD12 ILE 22 23.597 18.260 21.656 178 HD13 ILE 22 HD13 ILE 22 24.849 17.844 20.455 179 H GLY 23 H GLY 23 21.370 21.748 16.248 180 HA2 GLY 23 HA2 GLY 23 19.562 21.818 14.824 181 HA3 GLY 23 HA3 GLY 23 19.252 20.115 15.156 182 H GLU 24 H GLU 24 18.305 19.688 17.376 183 HA GLU 24 HA GLU 24 15.841 21.296 17.605 184 HB2 GLU 24 HB2 GLU 24 16.732 18.546 18.552 185 HB3 GLU 24 HB3 GLU 24 15.190 19.253 19.010 186 HG2 GLU 24 HG2 GLU 24 14.882 17.741 17.162 187 HG3 GLU 24 HG3 GLU 24 14.463 19.382 16.702 188 H GLU 25 H GLU 25 18.691 20.697 19.621 189 HA GLU 25 HA GLU 25 17.485 22.309 21.796 190 HB2 GLU 25 HB2 GLU 25 16.987 19.832 22.144 191 HB3 GLU 25 HB3 GLU 25 18.721 19.603 22.391 192 HG2 GLU 25 HG2 GLU 25 18.615 21.320 24.231 193 HG3 GLU 25 HG3 GLU 25 16.872 21.450 23.972 194 H CYS 26 H CYS 26 18.850 23.368 23.167 195 HA CYS 26 HA CYS 26 21.544 23.977 22.324 196 HB2 CYS 26 HB2 CYS 26 20.144 25.645 23.364 197 HB3 CYS 26 HB3 CYS 26 19.845 24.609 24.747 198 H LYS 27 H LYS 27 23.502 23.405 23.276 199 HA LYS 27 HA LYS 27 23.567 21.916 25.815 200 HB2 LYS 27 HB2 LYS 27 23.432 20.196 23.959 201 HB3 LYS 27 HB3 LYS 27 24.989 20.784 23.366 202 HG2 LYS 27 HG2 LYS 27 26.104 20.117 25.411 203 HG3 LYS 27 HG3 LYS 27 24.568 19.792 26.219 204 HD2 LYS 27 HD2 LYS 27 25.589 18.213 23.822 205 HD3 LYS 27 HD3 LYS 27 25.823 17.740 25.512 206 HE2 LYS 27 HE2 LYS 27 23.365 17.701 25.863 207 HE3 LYS 27 HE3 LYS 27 23.115 18.165 24.178 208 HZ1 LYS 27 HZ1 LYS 27 24.378 15.618 25.040 209 HZ2 LYS 27 HZ2 LYS 27 22.854 15.814 24.467 210 HZ3 LYS 27 HZ3 LYS 27 24.158 16.094 23.492 211 H CYS 28 H CYS 28 25.381 22.413 27.037 212 HA CYS 28 HA CYS 28 27.227 24.400 25.850 213 HB2 CYS 28 HB2 CYS 28 27.083 23.559 28.740 214 HB3 CYS 28 HB3 CYS 28 27.965 24.926 28.075 215 H VAL 29 H VAL 29 29.487 24.140 25.847 216 HA VAL 29 HA VAL 29 30.609 21.446 26.425 217 HB VAL 29 HB VAL 29 31.593 21.226 24.255 218 HG11 VAL 29 HG11 VAL 29 29.712 20.605 22.943 219 HG12 VAL 29 HG12 VAL 29 29.301 20.299 24.638 220 HG13 VAL 29 HG13 VAL 29 28.643 21.730 23.813 221 HG21 VAL 29 HG21 VAL 29 30.152 23.773 23.454 222 HG22 VAL 29 HG22 VAL 29 31.914 23.499 23.517 223 HG23 VAL 29 HG23 VAL 29 30.928 22.642 22.330 224 H TYR 30 H TYR 30 32.990 21.379 26.428 225 HA TYR 30 HA TYR 30 33.910 23.817 27.787 226 HB2 TYR 30 HB2 TYR 30 35.350 21.184 27.353 227 HB3 TYR 30 HB3 TYR 30 35.818 22.460 28.456 228 HD1 TYR 30 HD1 TYR 30 33.942 19.421 28.132 229 HD2 TYR 30 HD2 TYR 30 34.140 23.125 30.338 230 HE1 TYR 30 HE1 TYR 30 32.580 18.415 29.924 231 HE2 TYR 30 HE2 TYR 30 32.730 22.119 32.126 232 HH TYR 30 HH TYR 30 31.618 18.707 31.964 233 H ASN 31 H ASN 31 34.799 22.208 24.725 234 HA ASN 31 HA ASN 31 36.882 24.292 24.206 235 HB2 ASN 31 HB2 ASN 31 37.229 21.283 23.799 236 HB3 ASN 31 HB3 ASN 31 38.387 22.534 23.356 237 HD21 ASN 31 HD21 ASN 31 38.691 22.915 27.218 238 HD22 ASN 31 HD22 ASN 31 37.660 23.852 26.144 Start of MODEL 10 1 H1 ALA 1 H1 ALA 1 10.259 21.094 18.188 2 H2 ALA 1 H2 ALA 1 10.402 20.096 19.472 3 H3 ALA 1 H3 ALA 1 11.597 20.131 18.326 4 HA ALA 1 HA ALA 1 10.814 22.355 20.087 5 HB1 ALA 1 HB1 ALA 1 11.984 20.499 21.248 6 HB2 ALA 1 HB2 ALA 1 13.360 20.679 20.158 7 HB3 ALA 1 HB3 ALA 1 12.917 22.000 21.264 8 H PHE 2 H PHE 2 12.723 23.995 20.169 9 HA PHE 2 HA PHE 2 14.028 24.409 17.541 10 HB2 PHE 2 HB2 PHE 2 12.504 26.555 19.054 11 HB3 PHE 2 HB3 PHE 2 13.408 26.771 17.564 12 HD1 PHE 2 HD1 PHE 2 12.666 25.107 15.578 13 HD2 PHE 2 HD2 PHE 2 10.170 26.315 18.881 14 HE1 PHE 2 HE1 PHE 2 10.660 24.469 14.294 15 HE2 PHE 2 HE2 PHE 2 8.151 25.733 17.561 16 HZ PHE 2 HZ PHE 2 8.385 24.798 15.270 17 H CYS 3 H CYS 3 15.861 25.937 17.706 18 HA CYS 3 HA CYS 3 16.776 26.680 20.395 19 HB2 CYS 3 HB2 CYS 3 17.650 24.444 20.076 20 HB3 CYS 3 HB3 CYS 3 18.347 24.876 18.521 21 H ASN 4 H ASN 4 18.585 28.241 20.317 22 HA ASN 4 HA ASN 4 18.995 29.699 17.772 23 HB2 ASN 4 HB2 ASN 4 17.816 30.841 20.328 24 HB3 ASN 4 HB3 ASN 4 18.843 31.815 19.279 25 HD21 ASN 4 HD21 ASN 4 15.746 30.919 16.981 26 HD22 ASN 4 HD22 ASN 4 16.887 29.648 17.436 27 H LEU 5 H LEU 5 21.064 29.455 17.481 28 HA LEU 5 HA LEU 5 22.992 28.569 19.164 29 HB2 LEU 5 HB2 LEU 5 22.792 28.846 16.658 30 HB3 LEU 5 HB3 LEU 5 23.396 30.474 16.833 31 HG LEU 5 HG LEU 5 24.957 28.792 16.082 32 HD11 LEU 5 HD11 LEU 5 25.914 29.902 18.752 33 HD12 LEU 5 HD12 LEU 5 26.899 29.488 17.345 34 HD13 LEU 5 HD13 LEU 5 25.776 30.856 17.257 35 HD21 LEU 5 HD21 LEU 5 24.977 27.633 18.883 36 HD22 LEU 5 HD22 LEU 5 24.211 26.881 17.449 37 HD23 LEU 5 HD23 LEU 5 25.966 27.127 17.500 38 H ARG 6 H ARG 6 22.456 32.037 18.437 39 HA ARG 6 HA ARG 6 24.581 33.023 20.167 40 HB2 ARG 6 HB2 ARG 6 23.735 34.409 18.397 41 HB3 ARG 6 HB3 ARG 6 22.097 34.401 19.071 42 HG2 ARG 6 HG2 ARG 6 22.764 35.736 20.961 43 HG3 ARG 6 HG3 ARG 6 24.477 35.515 20.601 44 HD2 ARG 6 HD2 ARG 6 23.700 37.776 20.022 45 HD3 ARG 6 HD3 ARG 6 24.342 36.883 18.637 46 HE ARG 6 HE ARG 6 21.417 36.712 18.894 47 HH11 ARG 6 HH11 ARG 6 23.971 38.759 17.617 48 HH12 ARG 6 HH12 ARG 6 23.110 39.051 16.129 49 HH21 ARG 6 HH21 ARG 6 20.300 37.312 17.141 50 HH22 ARG 6 HH22 ARG 6 21.011 38.294 15.871 51 H ARG 7 H ARG 7 21.097 32.593 20.736 52 HA ARG 7 HA ARG 7 21.016 33.569 23.428 53 HB2 ARG 7 HB2 ARG 7 19.071 33.114 21.926 54 HB3 ARG 7 HB3 ARG 7 19.317 31.380 22.162 55 HG2 ARG 7 HG2 ARG 7 18.928 31.636 24.591 56 HG3 ARG 7 HG3 ARG 7 18.694 33.384 24.380 57 HD2 ARG 7 HD2 ARG 7 17.030 31.200 23.066 58 HD3 ARG 7 HD3 ARG 7 16.562 32.080 24.528 59 HE ARG 7 HE ARG 7 16.812 34.191 22.998 60 HH11 ARG 7 HH11 ARG 7 15.295 31.164 21.916 61 HH12 ARG 7 HH12 ARG 7 14.457 32.069 20.654 62 HH21 ARG 7 HH21 ARG 7 15.604 35.116 21.471 63 HH22 ARG 7 HH22 ARG 7 14.536 34.114 20.477 64 H CYS 8 H CYS 8 21.726 30.343 22.124 65 HA CYS 8 HA CYS 8 22.161 29.029 24.620 66 HB2 CYS 8 HB2 CYS 8 21.648 27.937 22.454 67 HB3 CYS 8 HB3 CYS 8 23.232 28.408 21.842 68 H GLU 9 H GLU 9 24.573 30.446 22.306 69 HA GLU 9 HA GLU 9 26.922 30.005 23.823 70 HB2 GLU 9 HB2 GLU 9 26.041 32.061 21.794 71 HB3 GLU 9 HB3 GLU 9 27.553 32.326 22.637 72 HG2 GLU 9 HG2 GLU 9 27.091 29.633 21.359 73 HG3 GLU 9 HG3 GLU 9 27.467 31.022 20.335 74 H LEU 10 H LEU 10 24.559 32.683 24.143 75 HA LEU 10 HA LEU 10 26.019 34.017 26.251 76 HB2 LEU 10 HB2 LEU 10 23.120 34.107 25.343 77 HB3 LEU 10 HB3 LEU 10 23.763 35.149 26.615 78 HG LEU 10 HG LEU 10 24.852 35.100 23.768 79 HD11 LEU 10 HD11 LEU 10 22.863 37.018 25.040 80 HD12 LEU 10 HD12 LEU 10 23.593 37.185 23.429 81 HD13 LEU 10 HD13 LEU 10 22.509 35.827 23.764 82 HD21 LEU 10 HD21 LEU 10 26.458 36.001 25.403 83 HD22 LEU 10 HD22 LEU 10 25.815 37.293 24.384 84 HD23 LEU 10 HD23 LEU 10 25.208 37.098 26.039 85 H SER 11 H SER 11 23.360 31.605 26.315 86 HA SER 11 HA SER 11 23.041 31.603 29.148 87 HB2 SER 11 HB2 SER 11 21.396 30.591 27.635 88 HB3 SER 11 HB3 SER 11 22.563 29.342 27.170 89 HG SER 11 HG SER 11 21.510 29.798 29.790 90 H CYS 12 H CYS 12 25.154 29.564 27.084 91 HA CYS 12 HA CYS 12 26.284 28.039 29.220 92 HB2 CYS 12 HB2 CYS 12 27.420 28.718 26.488 93 HB3 CYS 12 HB3 CYS 12 27.976 27.431 27.547 94 H ARG 13 H ARG 13 27.115 31.267 28.020 95 HA ARG 13 HA ARG 13 29.776 31.413 28.991 96 HB2 ARG 13 HB2 ARG 13 28.488 32.944 27.413 97 HB3 ARG 13 HB3 ARG 13 27.825 33.744 28.839 98 HG2 ARG 13 HG2 ARG 13 30.037 34.429 29.567 99 HG3 ARG 13 HG3 ARG 13 30.823 33.425 28.336 100 HD2 ARG 13 HD2 ARG 13 29.003 35.794 27.771 101 HD3 ARG 13 HD3 ARG 13 30.776 35.830 27.716 102 HE ARG 13 HE ARG 13 30.045 33.752 25.992 103 HH11 ARG 13 HH11 ARG 13 29.361 37.193 26.036 104 HH12 ARG 13 HH12 ARG 13 29.272 37.270 24.286 105 HH21 ARG 13 HH21 ARG 13 29.803 33.866 23.878 106 HH22 ARG 13 HH22 ARG 13 29.467 35.394 23.074 107 H SER 14 H SER 14 26.745 31.829 30.790 108 HA SER 14 HA SER 14 28.028 32.797 33.235 109 HB2 SER 14 HB2 SER 14 25.322 31.581 32.637 110 HB3 SER 14 HB3 SER 14 25.853 32.001 34.278 111 HG SER 14 HG SER 14 25.629 33.812 32.064 112 H LEU 15 H LEU 15 27.807 29.644 31.787 113 HA LEU 15 HA LEU 15 28.617 28.248 34.282 114 HB2 LEU 15 HB2 LEU 15 28.235 27.156 31.470 115 HB3 LEU 15 HB3 LEU 15 28.442 26.225 32.945 116 HG LEU 15 HG LEU 15 26.041 27.995 32.280 117 HD11 LEU 15 HD11 LEU 15 26.302 24.973 32.377 118 HD12 LEU 15 HD12 LEU 15 24.820 25.894 32.056 119 HD13 LEU 15 HD13 LEU 15 26.165 25.958 30.907 120 HD21 LEU 15 HD21 LEU 15 26.363 27.923 34.699 121 HD22 LEU 15 HD22 LEU 15 25.010 26.878 34.265 122 HD23 LEU 15 HD23 LEU 15 26.584 26.157 34.653 123 H GLY 16 H GLY 16 30.061 29.942 31.701 124 HA2 GLY 16 HA2 GLY 16 32.334 30.424 31.398 125 HA3 GLY 16 HA3 GLY 16 32.791 29.041 32.406 126 H LEU 17 H LEU 17 30.368 28.653 29.903 127 HA LEU 17 HA LEU 17 32.222 26.920 28.364 128 HB2 LEU 17 HB2 LEU 17 29.251 26.577 28.847 129 HB3 LEU 17 HB3 LEU 17 30.273 25.463 27.944 130 HG LEU 17 HG LEU 17 30.283 26.090 30.881 131 HD11 LEU 17 HD11 LEU 17 29.551 23.552 29.389 132 HD12 LEU 17 HD12 LEU 17 29.614 23.733 31.152 133 HD13 LEU 17 HD13 LEU 17 28.442 24.673 30.232 134 HD21 LEU 17 HD21 LEU 17 32.624 25.564 30.179 135 HD22 LEU 17 HD22 LEU 17 31.955 24.234 31.127 136 HD23 LEU 17 HD23 LEU 17 32.048 24.098 29.359 137 H LEU 18 H LEU 18 31.203 26.346 26.165 138 HA LEU 18 HA LEU 18 30.276 28.799 24.707 139 HB2 LEU 18 HB2 LEU 18 31.584 26.280 23.637 140 HB3 LEU 18 HB3 LEU 18 31.075 27.678 22.682 141 HG LEU 18 HG LEU 18 33.276 27.777 24.811 142 HD11 LEU 18 HD11 LEU 18 33.921 26.321 22.946 143 HD12 LEU 18 HD12 LEU 18 33.498 27.600 21.783 144 HD13 LEU 18 HD13 LEU 18 34.843 27.832 22.923 145 HD21 LEU 18 HD21 LEU 18 32.213 29.965 24.349 146 HD22 LEU 18 HD22 LEU 18 33.867 29.909 23.713 147 HD23 LEU 18 HD23 LEU 18 32.478 29.736 22.612 148 H GLY 19 H GLY 19 28.569 28.465 23.179 149 HA2 GLY 19 HA2 GLY 19 26.795 26.113 23.823 150 HA3 GLY 19 HA3 GLY 19 26.231 27.692 23.316 151 H LYS 20 H LYS 20 26.056 24.771 22.295 152 HA LYS 20 HA LYS 20 25.948 25.579 19.420 153 HB2 LYS 20 HB2 LYS 20 27.064 23.032 20.630 154 HB3 LYS 20 HB3 LYS 20 26.410 23.046 18.994 155 HG2 LYS 20 HG2 LYS 20 28.148 24.178 18.100 156 HG3 LYS 20 HG3 LYS 20 28.331 25.254 19.476 157 HD2 LYS 20 HD2 LYS 20 29.449 23.471 20.764 158 HD3 LYS 20 HD3 LYS 20 29.357 22.400 19.333 159 HE2 LYS 20 HE2 LYS 20 30.485 24.316 18.028 160 HE3 LYS 20 HE3 LYS 20 30.811 25.077 19.584 161 HZ1 LYS 20 HZ1 LYS 20 32.671 23.724 18.644 162 HZ2 LYS 20 HZ2 LYS 20 32.275 23.201 20.136 163 HZ3 LYS 20 HZ3 LYS 20 31.781 22.379 18.786 164 H CYS 21 H CYS 21 24.108 24.873 18.302 165 HA CYS 21 HA CYS 21 21.899 23.734 19.944 166 HB2 CYS 21 HB2 CYS 21 21.988 24.939 17.172 167 HB3 CYS 21 HB3 CYS 21 20.572 24.144 17.841 168 H ILE 22 H ILE 22 21.652 21.605 20.050 169 HA ILE 22 HA ILE 22 22.348 19.862 17.726 170 HB ILE 22 HB ILE 22 23.320 19.416 20.564 171 HG12 ILE 22 HG12 ILE 22 24.934 20.167 18.084 172 HG13 ILE 22 HG13 ILE 22 24.625 21.208 19.476 173 HG21 ILE 22 HG21 ILE 22 23.850 17.812 18.014 174 HG22 ILE 22 HG22 ILE 22 24.467 17.439 19.638 175 HG23 ILE 22 HG23 ILE 22 22.755 17.315 19.324 176 HD11 ILE 22 HD11 ILE 22 26.839 20.373 19.689 177 HD12 ILE 22 HD12 ILE 22 25.839 19.616 20.949 178 HD13 ILE 22 HD13 ILE 22 26.307 18.698 19.495 179 H GLY 23 H GLY 23 20.713 18.442 17.342 180 HA2 GLY 23 HA2 GLY 23 18.803 17.184 17.641 181 HA3 GLY 23 HA3 GLY 23 19.288 16.949 19.326 182 H GLU 24 H GLU 24 18.537 19.980 17.625 183 HA GLU 24 HA GLU 24 17.143 21.701 18.006 184 HB2 GLU 24 HB2 GLU 24 15.171 19.653 18.997 185 HB3 GLU 24 HB3 GLU 24 14.798 21.279 18.429 186 HG2 GLU 24 HG2 GLU 24 15.150 20.745 16.190 187 HG3 GLU 24 HG3 GLU 24 16.140 19.327 16.547 188 H GLU 25 H GLU 25 18.816 20.628 20.426 189 HA GLU 25 HA GLU 25 17.539 22.427 22.435 190 HB2 GLU 25 HB2 GLU 25 17.323 19.975 23.004 191 HB3 GLU 25 HB3 GLU 25 19.086 19.892 23.070 192 HG2 GLU 25 HG2 GLU 25 19.020 21.700 24.845 193 HG3 GLU 25 HG3 GLU 25 17.263 21.601 24.819 194 H CYS 26 H CYS 26 18.896 23.797 23.581 195 HA CYS 26 HA CYS 26 21.548 24.385 22.510 196 HB2 CYS 26 HB2 CYS 26 20.289 26.202 23.422 197 HB3 CYS 26 HB3 CYS 26 19.937 25.316 24.901 198 H LYS 27 H LYS 27 23.406 23.399 23.030 199 HA LYS 27 HA LYS 27 23.694 22.044 25.678 200 HB2 LYS 27 HB2 LYS 27 24.760 20.965 23.034 201 HB3 LYS 27 HB3 LYS 27 24.905 20.228 24.638 202 HG2 LYS 27 HG2 LYS 27 22.317 20.234 24.692 203 HG3 LYS 27 HG3 LYS 27 22.398 20.609 22.963 204 HD2 LYS 27 HD2 LYS 27 23.672 18.463 22.611 205 HD3 LYS 27 HD3 LYS 27 23.457 18.116 24.339 206 HE2 LYS 27 HE2 LYS 27 20.963 18.469 24.021 207 HE3 LYS 27 HE3 LYS 27 21.251 18.599 22.278 208 HZ1 LYS 27 HZ1 LYS 27 20.583 16.385 22.862 209 HZ2 LYS 27 HZ2 LYS 27 22.165 16.301 22.394 210 HZ3 LYS 27 HZ3 LYS 27 21.786 16.239 23.978 211 H CYS 28 H CYS 28 25.527 22.374 26.739 212 HA CYS 28 HA CYS 28 27.366 24.409 25.591 213 HB2 CYS 28 HB2 CYS 28 27.097 23.630 28.490 214 HB3 CYS 28 HB3 CYS 28 27.970 24.988 27.839 215 H VAL 29 H VAL 29 29.531 24.188 25.586 216 HA VAL 29 HA VAL 29 30.819 21.631 26.420 217 HB VAL 29 HB VAL 29 31.949 21.480 24.260 218 HG11 VAL 29 HG11 VAL 29 30.173 20.559 22.930 219 HG12 VAL 29 HG12 VAL 29 29.871 20.186 24.635 220 HG13 VAL 29 HG13 VAL 29 28.952 21.478 23.829 221 HG21 VAL 29 HG21 VAL 29 31.865 23.810 23.487 222 HG22 VAL 29 HG22 VAL 29 31.219 22.691 22.282 223 HG23 VAL 29 HG23 VAL 29 30.106 23.674 23.265 224 H TYR 30 H TYR 30 33.184 21.798 26.578 225 HA TYR 30 HA TYR 30 34.137 24.445 27.419 226 HB2 TYR 30 HB2 TYR 30 35.753 21.944 26.802 227 HB3 TYR 30 HB3 TYR 30 36.249 23.323 27.774 228 HD1 TYR 30 HD1 TYR 30 35.027 23.744 30.008 229 HD2 TYR 30 HD2 TYR 30 34.654 20.082 27.769 230 HE1 TYR 30 HE1 TYR 30 34.203 22.579 32.044 231 HE2 TYR 30 HE2 TYR 30 33.848 18.921 29.817 232 HH TYR 30 HH TYR 30 33.277 20.656 32.877 233 H ASN 31 H ASN 31 34.469 22.294 24.703 234 HA ASN 31 HA ASN 31 35.138 24.368 22.730 235 HB2 ASN 31 HB2 ASN 31 36.854 21.852 23.057 236 HB3 ASN 31 HB3 ASN 31 37.086 23.147 21.885 237 HD21 ASN 31 HD21 ASN 31 38.729 23.443 25.575 238 HD22 ASN 31 HD22 ASN 31 37.788 22.018 25.112 Start of MODEL 11 1 H1 ALA 1 H1 ALA 1 10.018 22.436 17.398 2 H2 ALA 1 H2 ALA 1 9.756 21.538 18.749 3 H3 ALA 1 H3 ALA 1 11.080 21.248 17.789 4 HA ALA 1 HA ALA 1 10.543 23.659 19.375 5 HB1 ALA 1 HB1 ALA 1 12.579 22.976 20.661 6 HB2 ALA 1 HB2 ALA 1 11.253 21.810 20.796 7 HB3 ALA 1 HB3 ALA 1 12.630 21.462 19.733 8 H PHE 2 H PHE 2 12.396 25.206 19.384 9 HA PHE 2 HA PHE 2 14.169 25.030 16.987 10 HB2 PHE 2 HB2 PHE 2 12.538 27.456 17.772 11 HB3 PHE 2 HB3 PHE 2 13.796 27.428 16.542 12 HD1 PHE 2 HD1 PHE 2 13.265 25.078 14.925 13 HD2 PHE 2 HD2 PHE 2 10.497 27.862 16.706 14 HE1 PHE 2 HE1 PHE 2 11.588 24.507 13.201 15 HE2 PHE 2 HE2 PHE 2 8.825 27.302 14.965 16 HZ PHE 2 HZ PHE 2 9.357 25.616 13.208 17 H CYS 3 H CYS 3 16.209 25.184 17.618 18 HA CYS 3 HA CYS 3 16.966 26.281 20.228 19 HB2 CYS 3 HB2 CYS 3 19.173 25.526 19.673 20 HB3 CYS 3 HB3 CYS 3 18.011 24.271 19.271 21 H ASN 4 H ASN 4 18.705 27.977 20.452 22 HA ASN 4 HA ASN 4 18.718 30.034 18.285 23 HB2 ASN 4 HB2 ASN 4 18.018 30.520 21.219 24 HB3 ASN 4 HB3 ASN 4 18.235 31.763 19.986 25 HD21 ASN 4 HD21 ASN 4 15.090 31.078 18.405 26 HD22 ASN 4 HD22 ASN 4 16.709 31.693 18.082 27 H LEU 5 H LEU 5 20.815 29.110 17.938 28 HA LEU 5 HA LEU 5 22.737 28.368 19.725 29 HB2 LEU 5 HB2 LEU 5 22.545 28.393 17.077 30 HB3 LEU 5 HB3 LEU 5 23.502 29.856 17.190 31 HG LEU 5 HG LEU 5 24.209 26.993 17.887 32 HD11 LEU 5 HD11 LEU 5 25.634 29.084 16.185 33 HD12 LEU 5 HD12 LEU 5 25.946 27.334 16.237 34 HD13 LEU 5 HD13 LEU 5 24.434 27.956 15.545 35 HD21 LEU 5 HD21 LEU 5 26.466 27.769 18.561 36 HD22 LEU 5 HD22 LEU 5 25.871 29.443 18.612 37 HD23 LEU 5 HD23 LEU 5 25.224 28.213 19.730 38 H ARG 6 H ARG 6 22.521 31.729 18.416 39 HA ARG 6 HA ARG 6 24.736 32.653 20.067 40 HB2 ARG 6 HB2 ARG 6 22.679 34.010 18.299 41 HB3 ARG 6 HB3 ARG 6 23.673 34.974 19.371 42 HG2 ARG 6 HG2 ARG 6 24.651 33.133 17.168 43 HG3 ARG 6 HG3 ARG 6 24.685 34.901 17.181 44 HD2 ARG 6 HD2 ARG 6 26.415 32.927 18.659 45 HD3 ARG 6 HD3 ARG 6 26.904 34.259 17.617 46 HE ARG 6 HE ARG 6 25.686 35.571 19.725 47 HH11 ARG 6 HH11 ARG 6 28.301 33.185 19.697 48 HH12 ARG 6 HH12 ARG 6 28.811 33.733 21.294 49 HH21 ARG 6 HH21 ARG 6 26.443 36.092 21.704 50 HH22 ARG 6 HH22 ARG 6 27.901 35.284 22.314 51 H ARG 7 H ARG 7 21.180 32.874 20.582 52 HA ARG 7 HA ARG 7 21.520 34.287 23.096 53 HB2 ARG 7 HB2 ARG 7 19.384 34.117 21.775 54 HB3 ARG 7 HB3 ARG 7 19.244 32.436 22.270 55 HG2 ARG 7 HG2 ARG 7 17.815 33.930 23.603 56 HG3 ARG 7 HG3 ARG 7 18.979 33.074 24.605 57 HD2 ARG 7 HD2 ARG 7 18.676 35.429 25.292 58 HD3 ARG 7 HD3 ARG 7 20.348 35.078 24.839 59 HE ARG 7 HE ARG 7 18.947 36.078 22.541 60 HH11 ARG 7 HH11 ARG 7 20.027 37.483 25.618 61 HH12 ARG 7 HH12 ARG 7 20.379 38.997 24.785 62 HH21 ARG 7 HH21 ARG 7 19.320 38.018 21.730 63 HH22 ARG 7 HH22 ARG 7 19.984 39.299 22.752 64 H CYS 8 H CYS 8 21.558 30.842 22.272 65 HA CYS 8 HA CYS 8 21.702 29.719 24.864 66 HB2 CYS 8 HB2 CYS 8 22.208 28.971 21.972 67 HB3 CYS 8 HB3 CYS 8 22.751 27.928 23.218 68 H GLU 9 H GLU 9 24.305 30.700 22.536 69 HA GLU 9 HA GLU 9 26.552 29.908 24.075 70 HB2 GLU 9 HB2 GLU 9 25.999 32.096 22.071 71 HB3 GLU 9 HB3 GLU 9 27.525 32.108 22.924 72 HG2 GLU 9 HG2 GLU 9 26.759 29.461 21.742 73 HG3 GLU 9 HG3 GLU 9 27.095 30.762 20.588 74 H LEU 10 H LEU 10 24.481 32.783 24.544 75 HA LEU 10 HA LEU 10 26.104 33.885 26.685 76 HB2 LEU 10 HB2 LEU 10 23.170 34.345 26.041 77 HB3 LEU 10 HB3 LEU 10 24.149 35.304 27.132 78 HG LEU 10 HG LEU 10 24.616 35.070 24.135 79 HD11 LEU 10 HD11 LEU 10 23.786 37.394 24.079 80 HD12 LEU 10 HD12 LEU 10 22.549 36.284 24.687 81 HD13 LEU 10 HD13 LEU 10 23.447 37.325 25.820 82 HD21 LEU 10 HD21 LEU 10 25.927 36.850 26.234 83 HD22 LEU 10 HD22 LEU 10 26.720 35.556 25.297 84 HD23 LEU 10 HD23 LEU 10 26.135 37.008 24.478 85 H SER 11 H SER 11 23.533 31.428 26.598 86 HA SER 11 HA SER 11 23.077 31.320 29.455 87 HB2 SER 11 HB2 SER 11 22.911 28.955 27.544 88 HB3 SER 11 HB3 SER 11 22.084 29.169 29.084 89 HG SER 11 HG SER 11 20.795 29.503 27.203 90 H CYS 12 H CYS 12 25.289 29.609 27.218 91 HA CYS 12 HA CYS 12 26.530 28.022 29.276 92 HB2 CYS 12 HB2 CYS 12 27.535 28.757 26.509 93 HB3 CYS 12 HB3 CYS 12 28.100 27.426 27.511 94 H ARG 13 H ARG 13 27.407 31.174 27.819 95 HA ARG 13 HA ARG 13 29.921 31.609 29.025 96 HB2 ARG 13 HB2 ARG 13 28.915 33.008 27.269 97 HB3 ARG 13 HB3 ARG 13 27.685 33.572 28.391 98 HG2 ARG 13 HG2 ARG 13 29.534 34.571 29.801 99 HG3 ARG 13 HG3 ARG 13 30.680 34.115 28.545 100 HD2 ARG 13 HD2 ARG 13 28.251 35.859 27.991 101 HD3 ARG 13 HD3 ARG 13 29.778 36.525 28.584 102 HE ARG 13 HE ARG 13 30.504 35.002 26.358 103 HH11 ARG 13 HH11 ARG 13 28.403 37.788 26.814 104 HH12 ARG 13 HH12 ARG 13 28.845 38.438 25.251 105 HH21 ARG 13 HH21 ARG 13 31.054 35.954 24.490 106 HH22 ARG 13 HH22 ARG 13 30.109 37.306 23.884 107 H SER 14 H SER 14 26.704 31.886 30.592 108 HA SER 14 HA SER 14 27.432 33.173 32.970 109 HB2 SER 14 HB2 SER 14 25.513 30.819 32.813 110 HB3 SER 14 HB3 SER 14 25.462 32.203 33.919 111 HG SER 14 HG SER 14 23.969 32.464 32.246 112 H LEU 15 H LEU 15 27.824 29.793 32.043 113 HA LEU 15 HA LEU 15 28.961 28.968 34.648 114 HB2 LEU 15 HB2 LEU 15 28.502 27.388 32.089 115 HB3 LEU 15 HB3 LEU 15 28.858 26.736 33.683 116 HG LEU 15 HG LEU 15 26.286 28.089 32.768 117 HD11 LEU 15 HD11 LEU 15 26.912 25.260 33.720 118 HD12 LEU 15 HD12 LEU 15 25.313 25.880 33.258 119 HD13 LEU 15 HD13 LEU 15 26.594 25.756 32.043 120 HD21 LEU 15 HD21 LEU 15 25.392 27.508 35.016 121 HD22 LEU 15 HD22 LEU 15 27.032 27.071 35.548 122 HD23 LEU 15 HD23 LEU 15 26.638 28.747 35.090 123 H GLY 16 H GLY 16 30.113 30.039 31.546 124 HA2 GLY 16 HA2 GLY 16 32.378 30.586 31.067 125 HA3 GLY 16 HA3 GLY 16 32.942 29.387 32.231 126 H LEU 17 H LEU 17 30.362 28.589 29.989 127 HA LEU 17 HA LEU 17 32.154 26.760 28.471 128 HB2 LEU 17 HB2 LEU 17 29.172 26.509 28.925 129 HB3 LEU 17 HB3 LEU 17 30.224 25.317 28.156 130 HG LEU 17 HG LEU 17 30.078 26.157 31.043 131 HD11 LEU 17 HD11 LEU 17 29.413 23.522 29.684 132 HD12 LEU 17 HD12 LEU 17 29.355 23.830 31.430 133 HD13 LEU 17 HD13 LEU 17 28.258 24.703 30.365 134 HD21 LEU 17 HD21 LEU 17 31.903 24.056 29.776 135 HD22 LEU 17 HD22 LEU 17 32.440 25.578 30.521 136 HD23 LEU 17 HD23 LEU 17 31.696 24.328 31.521 137 H LEU 18 H LEU 18 31.081 26.183 26.255 138 HA LEU 18 HA LEU 18 30.132 28.651 24.841 139 HB2 LEU 18 HB2 LEU 18 31.464 26.221 23.619 140 HB3 LEU 18 HB3 LEU 18 31.025 27.730 22.806 141 HG LEU 18 HG LEU 18 33.159 27.511 25.000 142 HD11 LEU 18 HD11 LEU 18 34.799 27.673 23.166 143 HD12 LEU 18 HD12 LEU 18 33.835 26.193 23.061 144 HD13 LEU 18 HD13 LEU 18 33.484 27.562 21.978 145 HD21 LEU 18 HD21 LEU 18 32.587 29.705 22.972 146 HD22 LEU 18 HD22 LEU 18 32.175 29.780 24.692 147 HD23 LEU 18 HD23 LEU 18 33.875 29.711 24.188 148 H GLY 19 H GLY 19 28.382 28.384 23.417 149 HA2 GLY 19 HA2 GLY 19 26.693 25.949 23.882 150 HA3 GLY 19 HA3 GLY 19 26.109 27.513 23.335 151 H LYS 20 H LYS 20 26.325 24.480 22.282 152 HA LYS 20 HA LYS 20 26.299 25.375 19.413 153 HB2 LYS 20 HB2 LYS 20 27.242 22.748 20.614 154 HB3 LYS 20 HB3 LYS 20 27.139 23.093 18.889 155 HG2 LYS 20 HG2 LYS 20 28.948 24.654 18.951 156 HG3 LYS 20 HG3 LYS 20 28.932 24.752 20.723 157 HD2 LYS 20 HD2 LYS 20 29.521 22.424 20.933 158 HD3 LYS 20 HD3 LYS 20 29.564 22.238 19.165 159 HE2 LYS 20 HE2 LYS 20 31.368 24.099 19.161 160 HE3 LYS 20 HE3 LYS 20 31.419 23.903 20.919 161 HZ1 LYS 20 HZ1 LYS 20 32.283 22.017 18.831 162 HZ2 LYS 20 HZ2 LYS 20 33.053 22.404 20.239 163 HZ3 LYS 20 HZ3 LYS 20 31.764 21.401 20.259 164 H CYS 21 H CYS 21 24.573 24.508 18.139 165 HA CYS 21 HA CYS 21 22.306 23.383 19.702 166 HB2 CYS 21 HB2 CYS 21 21.804 25.260 18.298 167 HB3 CYS 21 HB3 CYS 21 22.471 24.447 16.880 168 H ILE 22 H ILE 22 21.576 21.353 19.610 169 HA ILE 22 HA ILE 22 22.259 19.565 17.353 170 HB ILE 22 HB ILE 22 22.603 18.680 20.235 171 HG12 ILE 22 HG12 ILE 22 24.781 19.189 18.158 172 HG13 ILE 22 HG13 ILE 22 24.469 20.174 19.594 173 HG21 ILE 22 HG21 ILE 22 23.435 16.575 19.190 174 HG22 ILE 22 HG22 ILE 22 21.792 16.906 18.681 175 HG23 ILE 22 HG23 ILE 22 23.144 17.256 17.582 176 HD11 ILE 22 HD11 ILE 22 26.283 18.816 20.164 177 HD12 ILE 22 HD12 ILE 22 24.888 18.130 21.017 178 HD13 ILE 22 HD13 ILE 22 25.521 17.345 19.545 179 H GLY 23 H GLY 23 20.353 18.832 16.613 180 HA2 GLY 23 HA2 GLY 23 18.274 17.852 16.537 181 HA3 GLY 23 HA3 GLY 23 18.649 17.194 18.130 182 H GLU 24 H GLU 24 18.050 20.601 17.170 183 HA GLU 24 HA GLU 24 16.623 22.169 17.871 184 HB2 GLU 24 HB2 GLU 24 14.571 20.097 18.655 185 HB3 GLU 24 HB3 GLU 24 14.348 21.783 18.177 186 HG2 GLU 24 HG2 GLU 24 15.328 21.136 15.900 187 HG3 GLU 24 HG3 GLU 24 15.162 19.456 16.408 188 H GLU 25 H GLU 25 18.546 21.068 19.829 189 HA GLU 25 HA GLU 25 17.596 22.667 22.122 190 HB2 GLU 25 HB2 GLU 25 17.016 20.321 22.655 191 HB3 GLU 25 HB3 GLU 25 18.641 19.825 22.223 192 HG2 GLU 25 HG2 GLU 25 18.503 19.777 24.558 193 HG3 GLU 25 HG3 GLU 25 19.563 21.110 24.142 194 H CYS 26 H CYS 26 19.302 23.767 23.193 195 HA CYS 26 HA CYS 26 21.948 23.681 21.874 196 HB2 CYS 26 HB2 CYS 26 20.910 25.439 24.107 197 HB3 CYS 26 HB3 CYS 26 22.438 25.616 23.270 198 H LYS 27 H LYS 27 23.731 22.749 22.648 199 HA LYS 27 HA LYS 27 23.835 21.682 25.448 200 HB2 LYS 27 HB2 LYS 27 23.926 19.991 23.596 201 HB3 LYS 27 HB3 LYS 27 25.390 20.775 22.979 202 HG2 LYS 27 HG2 LYS 27 26.562 20.258 25.120 203 HG3 LYS 27 HG3 LYS 27 25.067 19.578 25.764 204 HD2 LYS 27 HD2 LYS 27 26.409 17.746 25.145 205 HD3 LYS 27 HD3 LYS 27 25.120 17.844 23.940 206 HE2 LYS 27 HE2 LYS 27 26.688 18.959 22.364 207 HE3 LYS 27 HE3 LYS 27 27.961 18.933 23.591 208 HZ1 LYS 27 HZ1 LYS 27 28.150 17.098 22.008 209 HZ2 LYS 27 HZ2 LYS 27 27.934 16.529 23.535 210 HZ3 LYS 27 HZ3 LYS 27 26.685 16.490 22.484 211 H CYS 28 H CYS 28 25.496 22.319 26.768 212 HA CYS 28 HA CYS 28 27.376 24.366 25.709 213 HB2 CYS 28 HB2 CYS 28 26.909 23.607 28.582 214 HB3 CYS 28 HB3 CYS 28 27.899 24.917 27.990 215 H VAL 29 H VAL 29 29.558 24.122 25.681 216 HA VAL 29 HA VAL 29 30.849 21.675 26.822 217 HB VAL 29 HB VAL 29 31.972 21.168 24.749 218 HG11 VAL 29 HG11 VAL 29 29.730 20.136 25.171 219 HG12 VAL 29 HG12 VAL 29 29.000 21.361 24.106 220 HG13 VAL 29 HG13 VAL 29 30.192 20.207 23.476 221 HG21 VAL 29 HG21 VAL 29 32.101 23.391 23.695 222 HG22 VAL 29 HG22 VAL 29 31.417 22.190 22.613 223 HG23 VAL 29 HG23 VAL 29 30.346 23.374 23.409 224 H TYR 30 H TYR 30 33.214 21.788 26.904 225 HA TYR 30 HA TYR 30 34.265 24.545 27.319 226 HB2 TYR 30 HB2 TYR 30 35.748 21.869 27.374 227 HB3 TYR 30 HB3 TYR 30 36.317 23.403 27.965 228 HD1 TYR 30 HD1 TYR 30 35.288 24.448 30.040 229 HD2 TYR 30 HD2 TYR 30 34.312 20.462 28.680 230 HE1 TYR 30 HE1 TYR 30 34.287 23.923 32.262 231 HE2 TYR 30 HE2 TYR 30 33.230 19.983 30.878 232 HH TYR 30 HH TYR 30 33.067 22.425 33.484 233 H ASN 31 H ASN 31 34.626 21.856 25.062 234 HA ASN 31 HA ASN 31 35.763 23.481 22.889 235 HB2 ASN 31 HB2 ASN 31 37.084 20.937 23.976 236 HB3 ASN 31 HB3 ASN 31 37.620 21.867 22.580 237 HD21 ASN 31 HD21 ASN 31 39.317 24.300 24.558 238 HD22 ASN 31 HD22 ASN 31 38.435 24.103 23.035 Start of MODEL 12 1 H1 ALA 1 H1 ALA 1 16.071 24.035 13.385 2 H2 ALA 1 H2 ALA 1 14.472 23.928 12.990 3 H3 ALA 1 H3 ALA 1 15.405 22.571 13.117 4 HA ALA 1 HA ALA 1 13.920 22.863 15.001 5 HB1 ALA 1 HB1 ALA 1 15.596 22.515 16.757 6 HB2 ALA 1 HB2 ALA 1 16.027 21.600 15.299 7 HB3 ALA 1 HB3 ALA 1 16.879 23.111 15.696 8 H PHE 2 H PHE 2 13.500 24.012 16.992 9 HA PHE 2 HA PHE 2 13.339 26.894 16.544 10 HB2 PHE 2 HB2 PHE 2 12.048 24.871 18.378 11 HB3 PHE 2 HB3 PHE 2 11.950 26.571 18.781 12 HD1 PHE 2 HD1 PHE 2 11.102 24.125 16.071 13 HD2 PHE 2 HD2 PHE 2 10.471 28.054 17.738 14 HE1 PHE 2 HE1 PHE 2 9.219 24.501 14.503 15 HE2 PHE 2 HE2 PHE 2 8.578 28.410 16.183 16 HZ PHE 2 HZ PHE 2 7.938 26.629 14.565 17 H CYS 3 H CYS 3 15.976 25.561 17.392 18 HA CYS 3 HA CYS 3 16.460 26.696 20.029 19 HB2 CYS 3 HB2 CYS 3 18.751 25.849 19.706 20 HB3 CYS 3 HB3 CYS 3 17.507 24.622 19.524 21 H ASN 4 H ASN 4 18.216 28.379 20.370 22 HA ASN 4 HA ASN 4 18.584 30.246 18.036 23 HB2 ASN 4 HB2 ASN 4 17.885 31.035 20.883 24 HB3 ASN 4 HB3 ASN 4 18.345 32.135 19.586 25 HD21 ASN 4 HD21 ASN 4 14.795 30.820 18.387 26 HD22 ASN 4 HD22 ASN 4 16.310 29.983 18.019 27 H LEU 5 H LEU 5 20.664 29.562 17.625 28 HA LEU 5 HA LEU 5 22.526 28.709 19.520 29 HB2 LEU 5 HB2 LEU 5 22.376 28.676 16.853 30 HB3 LEU 5 HB3 LEU 5 23.478 30.030 16.983 31 HG LEU 5 HG LEU 5 23.858 27.171 17.982 32 HD11 LEU 5 HD11 LEU 5 25.678 27.167 16.288 33 HD12 LEU 5 HD12 LEU 5 24.112 27.518 15.547 34 HD13 LEU 5 HD13 LEU 5 25.274 28.828 15.840 35 HD21 LEU 5 HD21 LEU 5 26.206 27.850 18.477 36 HD22 LEU 5 HD22 LEU 5 25.750 29.552 18.267 37 HD23 LEU 5 HD23 LEU 5 25.043 28.569 19.578 38 H ARG 6 H ARG 6 22.217 32.023 18.147 39 HA ARG 6 HA ARG 6 24.437 33.229 19.432 40 HB2 ARG 6 HB2 ARG 6 23.129 34.300 17.662 41 HB3 ARG 6 HB3 ARG 6 21.727 34.433 18.732 42 HG2 ARG 6 HG2 ARG 6 22.896 36.023 20.175 43 HG3 ARG 6 HG3 ARG 6 24.409 35.745 19.306 44 HD2 ARG 6 HD2 ARG 6 23.501 37.854 18.619 45 HD3 ARG 6 HD3 ARG 6 23.441 36.731 17.260 46 HE ARG 6 HE ARG 6 20.919 36.646 18.612 47 HH11 ARG 6 HH11 ARG 6 22.763 39.049 16.753 48 HH12 ARG 6 HH12 ARG 6 21.293 39.748 16.108 49 HH21 ARG 6 HH21 ARG 6 19.142 37.662 17.693 50 HH22 ARG 6 HH22 ARG 6 19.378 39.254 17.014 51 H ARG 7 H ARG 7 21.195 32.699 20.770 52 HA ARG 7 HA ARG 7 21.798 33.944 23.346 53 HB2 ARG 7 HB2 ARG 7 19.523 33.949 22.404 54 HB3 ARG 7 HB3 ARG 7 19.476 32.195 22.416 55 HG2 ARG 7 HG2 ARG 7 18.200 33.276 24.263 56 HG3 ARG 7 HG3 ARG 7 19.395 32.104 24.800 57 HD2 ARG 7 HD2 ARG 7 19.324 34.055 26.244 58 HD3 ARG 7 HD3 ARG 7 20.912 33.886 25.502 59 HE ARG 7 HE ARG 7 19.856 35.657 23.780 60 HH11 ARG 7 HH11 ARG 7 20.038 35.769 27.287 61 HH12 ARG 7 HH12 ARG 7 19.577 37.481 27.291 62 HH21 ARG 7 HH21 ARG 7 19.450 37.889 23.978 63 HH22 ARG 7 HH22 ARG 7 19.303 38.537 25.609 64 H CYS 8 H CYS 8 21.631 30.590 22.123 65 HA CYS 8 HA CYS 8 22.102 29.209 24.538 66 HB2 CYS 8 HB2 CYS 8 21.465 28.184 22.408 67 HB3 CYS 8 HB3 CYS 8 23.015 28.614 21.712 68 H GLU 9 H GLU 9 24.535 30.683 22.326 69 HA GLU 9 HA GLU 9 26.879 30.035 23.822 70 HB2 GLU 9 HB2 GLU 9 26.209 32.539 22.228 71 HB3 GLU 9 HB3 GLU 9 27.766 32.242 23.002 72 HG2 GLU 9 HG2 GLU 9 27.891 30.075 21.680 73 HG3 GLU 9 HG3 GLU 9 26.541 30.690 20.708 74 H LEU 10 H LEU 10 24.740 32.899 24.265 75 HA LEU 10 HA LEU 10 26.279 34.073 26.398 76 HB2 LEU 10 HB2 LEU 10 23.337 34.338 25.628 77 HB3 LEU 10 HB3 LEU 10 24.145 35.367 26.794 78 HG LEU 10 HG LEU 10 24.919 35.177 23.852 79 HD11 LEU 10 HD11 LEU 10 23.827 37.373 23.643 80 HD12 LEU 10 HD12 LEU 10 22.670 36.136 24.150 81 HD13 LEU 10 HD13 LEU 10 23.309 37.292 25.342 82 HD21 LEU 10 HD21 LEU 10 26.131 37.306 24.336 83 HD22 LEU 10 HD22 LEU 10 25.760 37.112 26.056 84 HD23 LEU 10 HD23 LEU 10 26.803 35.934 25.222 85 H SER 11 H SER 11 23.513 31.851 26.350 86 HA SER 11 HA SER 11 23.115 31.711 29.165 87 HB2 SER 11 HB2 SER 11 21.507 31.035 27.354 88 HB3 SER 11 HB3 SER 11 22.492 29.585 27.077 89 HG SER 11 HG SER 11 21.192 30.399 29.475 90 H CYS 12 H CYS 12 25.067 29.560 26.999 91 HA CYS 12 HA CYS 12 26.106 27.962 29.167 92 HB2 CYS 12 HB2 CYS 12 27.142 28.500 26.370 93 HB3 CYS 12 HB3 CYS 12 27.838 27.323 27.484 94 H ARG 13 H ARG 13 27.164 31.127 27.864 95 HA ARG 13 HA ARG 13 29.789 30.992 29.000 96 HB2 ARG 13 HB2 ARG 13 29.064 32.549 27.180 97 HB3 ARG 13 HB3 ARG 13 28.157 33.469 28.373 98 HG2 ARG 13 HG2 ARG 13 30.363 34.470 27.818 99 HG3 ARG 13 HG3 ARG 13 30.212 34.103 29.523 100 HD2 ARG 13 HD2 ARG 13 32.437 33.572 28.683 101 HD3 ARG 13 HD3 ARG 13 31.621 32.136 29.302 102 HE ARG 13 HE ARG 13 31.263 32.453 26.432 103 HH11 ARG 13 HH11 ARG 13 33.682 31.363 28.765 104 HH12 ARG 13 HH12 ARG 13 34.480 30.384 27.538 105 HH21 ARG 13 HH21 ARG 13 32.437 31.184 24.966 106 HH22 ARG 13 HH22 ARG 13 33.817 30.281 25.594 107 H SER 14 H SER 14 26.701 31.845 30.519 108 HA SER 14 HA SER 14 27.794 32.822 32.984 109 HB2 SER 14 HB2 SER 14 25.261 31.196 32.567 110 HB3 SER 14 HB3 SER 14 25.636 32.237 33.949 111 HG SER 14 HG SER 14 25.744 34.020 32.450 112 H LEU 15 H LEU 15 27.252 29.489 31.799 113 HA LEU 15 HA LEU 15 28.350 28.188 34.170 114 HB2 LEU 15 HB2 LEU 15 28.030 27.006 31.400 115 HB3 LEU 15 HB3 LEU 15 28.137 26.154 32.937 116 HG LEU 15 HG LEU 15 25.817 27.877 31.974 117 HD11 LEU 15 HD11 LEU 15 26.059 24.882 32.379 118 HD12 LEU 15 HD12 LEU 15 24.589 25.758 31.901 119 HD13 LEU 15 HD13 LEU 15 25.996 25.734 30.824 120 HD21 LEU 15 HD21 LEU 15 24.614 27.012 33.976 121 HD22 LEU 15 HD22 LEU 15 26.126 26.282 34.554 122 HD23 LEU 15 HD23 LEU 15 25.974 28.048 34.422 123 H GLY 16 H GLY 16 29.737 29.828 31.519 124 HA2 GLY 16 HA2 GLY 16 31.954 30.532 31.388 125 HA3 GLY 16 HA3 GLY 16 32.478 29.171 32.379 126 H LEU 17 H LEU 17 30.276 28.571 29.758 127 HA LEU 17 HA LEU 17 32.384 27.059 28.333 128 HB2 LEU 17 HB2 LEU 17 29.438 26.421 28.540 129 HB3 LEU 17 HB3 LEU 17 30.700 25.350 27.930 130 HG LEU 17 HG LEU 17 30.242 26.252 30.778 131 HD11 LEU 17 HD11 LEU 17 28.576 24.681 30.123 132 HD12 LEU 17 HD12 LEU 17 29.813 23.555 29.480 133 HD13 LEU 17 HD13 LEU 17 29.702 23.891 31.222 134 HD21 LEU 17 HD21 LEU 17 32.681 25.835 30.382 135 HD22 LEU 17 HD22 LEU 17 31.987 24.577 31.409 136 HD23 LEU 17 HD23 LEU 17 32.285 24.250 29.687 137 H LEU 18 H LEU 18 31.615 26.338 26.086 138 HA LEU 18 HA LEU 18 30.641 28.660 24.478 139 HB2 LEU 18 HB2 LEU 18 31.651 25.934 23.584 140 HB3 LEU 18 HB3 LEU 18 31.111 27.242 22.559 141 HG LEU 18 HG LEU 18 33.041 28.640 23.663 142 HD11 LEU 18 HD11 LEU 18 35.030 27.177 24.168 143 HD12 LEU 18 HD12 LEU 18 33.768 27.019 25.384 144 HD13 LEU 18 HD13 LEU 18 33.961 25.763 24.145 145 HD21 LEU 18 HD21 LEU 18 32.940 27.939 21.297 146 HD22 LEU 18 HD22 LEU 18 34.574 27.806 21.929 147 HD23 LEU 18 HD23 LEU 18 33.592 26.340 21.725 148 H GLY 19 H GLY 19 28.672 28.415 23.240 149 HA2 GLY 19 HA2 GLY 19 26.896 26.133 24.077 150 HA3 GLY 19 HA3 GLY 19 26.305 27.767 23.821 151 H LYS 20 H LYS 20 25.883 24.990 22.547 152 HA LYS 20 HA LYS 20 25.622 25.967 19.765 153 HB2 LYS 20 HB2 LYS 20 27.147 23.434 20.532 154 HB3 LYS 20 HB3 LYS 20 26.406 23.669 18.956 155 HG2 LYS 20 HG2 LYS 20 28.343 24.569 18.328 156 HG3 LYS 20 HG3 LYS 20 27.777 26.013 19.130 157 HD2 LYS 20 HD2 LYS 20 28.983 25.043 21.239 158 HD3 LYS 20 HD3 LYS 20 29.769 23.936 20.105 159 HE2 LYS 20 HE2 LYS 20 29.836 26.989 20.023 160 HE3 LYS 20 HE3 LYS 20 31.138 25.949 20.594 161 HZ1 LYS 20 HZ1 LYS 20 31.444 25.110 18.395 162 HZ2 LYS 20 HZ2 LYS 20 30.167 25.975 17.777 163 HZ3 LYS 20 HZ3 LYS 20 31.473 26.748 18.347 164 H CYS 21 H CYS 21 24.063 24.850 18.518 165 HA CYS 21 HA CYS 21 21.926 23.584 20.166 166 HB2 CYS 21 HB2 CYS 21 21.220 25.380 18.735 167 HB3 CYS 21 HB3 CYS 21 21.959 24.625 17.319 168 H ILE 22 H ILE 22 21.621 21.429 20.176 169 HA ILE 22 HA ILE 22 22.896 19.737 18.047 170 HB ILE 22 HB ILE 22 22.944 19.219 21.028 171 HG12 ILE 22 HG12 ILE 22 25.150 19.948 19.052 172 HG13 ILE 22 HG13 ILE 22 24.601 20.893 20.435 173 HG21 ILE 22 HG21 ILE 22 24.192 17.160 20.455 174 HG22 ILE 22 HG22 ILE 22 22.614 17.132 19.707 175 HG23 ILE 22 HG23 ILE 22 24.040 17.535 18.722 176 HD11 ILE 22 HD11 ILE 22 26.191 18.311 20.505 177 HD12 ILE 22 HD12 ILE 22 26.685 19.925 21.032 178 HD13 ILE 22 HD13 ILE 22 25.445 19.042 21.946 179 H GLY 23 H GLY 23 21.266 18.996 16.927 180 HA2 GLY 23 HA2 GLY 23 19.339 17.835 16.371 181 HA3 GLY 23 HA3 GLY 23 19.063 17.460 18.078 182 H GLU 24 H GLU 24 18.025 18.891 19.366 183 HA GLU 24 HA GLU 24 16.581 21.200 18.144 184 HB2 GLU 24 HB2 GLU 24 15.207 18.878 19.568 185 HB3 GLU 24 HB3 GLU 24 14.437 20.337 18.950 186 HG2 GLU 24 HG2 GLU 24 15.342 19.660 16.639 187 HG3 GLU 24 HG3 GLU 24 15.638 18.067 17.355 188 H GLU 25 H GLU 25 18.649 20.765 20.405 189 HA GLU 25 HA GLU 25 17.379 22.585 22.361 190 HB2 GLU 25 HB2 GLU 25 17.912 21.183 24.250 191 HB3 GLU 25 HB3 GLU 25 16.925 20.257 23.126 192 HG2 GLU 25 HG2 GLU 25 19.166 19.329 22.208 193 HG3 GLU 25 HG3 GLU 25 19.915 20.026 23.650 194 H CYS 26 H CYS 26 18.905 23.520 23.883 195 HA CYS 26 HA CYS 26 21.530 24.075 22.655 196 HB2 CYS 26 HB2 CYS 26 20.235 25.927 23.502 197 HB3 CYS 26 HB3 CYS 26 20.084 25.163 25.071 198 H LYS 27 H LYS 27 23.437 23.337 23.311 199 HA LYS 27 HA LYS 27 23.828 22.000 25.935 200 HB2 LYS 27 HB2 LYS 27 24.404 20.805 23.202 201 HB3 LYS 27 HB3 LYS 27 25.323 20.325 24.634 202 HG2 LYS 27 HG2 LYS 27 23.263 19.671 25.797 203 HG3 LYS 27 HG3 LYS 27 22.290 20.137 24.385 204 HD2 LYS 27 HD2 LYS 27 23.241 18.389 23.039 205 HD3 LYS 27 HD3 LYS 27 24.444 17.982 24.281 206 HE2 LYS 27 HE2 LYS 27 22.771 17.233 25.797 207 HE3 LYS 27 HE3 LYS 27 21.459 17.923 24.834 208 HZ1 LYS 27 HZ1 LYS 27 23.150 15.766 23.693 209 HZ2 LYS 27 HZ2 LYS 27 21.893 15.423 24.675 210 HZ3 LYS 27 HZ3 LYS 27 21.667 16.247 23.244 211 H CYS 28 H CYS 28 25.974 22.016 26.674 212 HA CYS 28 HA CYS 28 27.547 24.230 25.475 213 HB2 CYS 28 HB2 CYS 28 27.596 23.477 28.374 214 HB3 CYS 28 HB3 CYS 28 28.227 24.926 27.627 215 H VAL 29 H VAL 29 29.738 24.100 25.282 216 HA VAL 29 HA VAL 29 31.100 21.526 25.904 217 HB VAL 29 HB VAL 29 32.065 21.437 23.700 218 HG11 VAL 29 HG11 VAL 29 29.924 20.257 24.116 219 HG12 VAL 29 HG12 VAL 29 29.060 21.654 23.424 220 HG13 VAL 29 HG13 VAL 29 30.169 20.713 22.412 221 HG21 VAL 29 HG21 VAL 29 30.365 23.841 22.994 222 HG22 VAL 29 HG22 VAL 29 32.151 23.762 23.033 223 HG23 VAL 29 HG23 VAL 29 31.251 22.830 21.832 224 H TYR 30 H TYR 30 33.433 21.592 25.787 225 HA TYR 30 HA TYR 30 34.442 24.093 26.980 226 HB2 TYR 30 HB2 TYR 30 35.627 21.312 26.691 227 HB3 TYR 30 HB3 TYR 30 36.431 22.659 27.474 228 HD1 TYR 30 HD1 TYR 30 35.698 23.563 29.619 229 HD2 TYR 30 HD2 TYR 30 33.676 20.206 27.793 230 HE1 TYR 30 HE1 TYR 30 34.508 23.117 31.755 231 HE2 TYR 30 HE2 TYR 30 32.482 19.768 29.937 232 HH TYR 30 HH TYR 30 32.856 21.939 32.773 233 H ASN 31 H ASN 31 34.797 22.456 23.884 234 HA ASN 31 HA ASN 31 35.897 24.795 22.634 235 HB2 ASN 31 HB2 ASN 31 37.999 23.900 23.506 236 HB3 ASN 31 HB3 ASN 31 37.604 22.272 22.949 237 HD21 ASN 31 HD21 ASN 31 38.525 22.950 19.598 238 HD22 ASN 31 HD22 ASN 31 37.790 21.788 20.708 Start of MODEL 13 1 H1 ALA 1 H1 ALA 1 10.732 21.700 17.504 2 H2 ALA 1 H2 ALA 1 10.701 23.332 17.592 3 H3 ALA 1 H3 ALA 1 10.188 22.440 18.866 4 HA ALA 1 HA ALA 1 12.391 21.618 19.288 5 HB1 ALA 1 HB1 ALA 1 14.265 22.557 17.873 6 HB2 ALA 1 HB2 ALA 1 13.162 21.469 16.988 7 HB3 ALA 1 HB3 ALA 1 13.035 23.231 16.784 8 H PHE 2 H PHE 2 14.019 22.832 20.498 9 HA PHE 2 HA PHE 2 13.171 25.627 21.153 10 HB2 PHE 2 HB2 PHE 2 13.709 23.369 23.112 11 HB3 PHE 2 HB3 PHE 2 13.274 25.021 23.529 12 HD1 PHE 2 HD1 PHE 2 11.044 25.936 22.376 13 HD2 PHE 2 HD2 PHE 2 11.949 21.776 23.068 14 HE1 PHE 2 HE1 PHE 2 8.636 25.397 22.281 15 HE2 PHE 2 HE2 PHE 2 9.524 21.239 22.987 16 HZ PHE 2 HZ PHE 2 7.860 23.052 22.608 17 H CYS 3 H CYS 3 15.708 24.610 19.716 18 HA CYS 3 HA CYS 3 17.703 25.773 21.573 19 HB2 CYS 3 HB2 CYS 3 19.361 24.978 20.274 20 HB3 CYS 3 HB3 CYS 3 18.157 23.712 20.125 21 H ASN 4 H ASN 4 18.656 27.752 21.282 22 HA ASN 4 HA ASN 4 18.175 29.360 18.827 23 HB2 ASN 4 HB2 ASN 4 17.918 30.381 21.695 24 HB3 ASN 4 HB3 ASN 4 17.843 31.373 20.248 25 HD21 ASN 4 HD21 ASN 4 14.362 30.933 19.984 26 HD22 ASN 4 HD22 ASN 4 15.797 31.640 19.261 27 H LEU 5 H LEU 5 20.301 29.236 18.075 28 HA LEU 5 HA LEU 5 22.451 28.442 19.659 29 HB2 LEU 5 HB2 LEU 5 22.034 28.662 17.034 30 HB3 LEU 5 HB3 LEU 5 23.020 30.107 17.217 31 HG LEU 5 HG LEU 5 23.734 27.213 17.748 32 HD11 LEU 5 HD11 LEU 5 25.380 27.592 15.981 33 HD12 LEU 5 HD12 LEU 5 23.780 28.130 15.413 34 HD13 LEU 5 HD13 LEU 5 24.976 29.313 15.957 35 HD21 LEU 5 HD21 LEU 5 24.886 28.381 19.541 36 HD22 LEU 5 HD22 LEU 5 26.052 27.966 18.286 37 HD23 LEU 5 HD23 LEU 5 25.446 29.627 18.404 38 H ARG 6 H ARG 6 21.810 31.863 18.692 39 HA ARG 6 HA ARG 6 24.245 32.879 19.920 40 HB2 ARG 6 HB2 ARG 6 22.965 34.021 18.108 41 HB3 ARG 6 HB3 ARG 6 21.662 34.366 19.260 42 HG2 ARG 6 HG2 ARG 6 23.158 35.783 20.593 43 HG3 ARG 6 HG3 ARG 6 24.547 35.293 19.623 44 HD2 ARG 6 HD2 ARG 6 23.810 37.516 18.955 45 HD3 ARG 6 HD3 ARG 6 23.591 36.360 17.636 46 HE ARG 6 HE ARG 6 21.214 36.726 19.308 47 HH11 ARG 6 HH11 ARG 6 22.917 38.150 16.580 48 HH12 ARG 6 HH12 ARG 6 21.443 38.705 15.827 49 HH21 ARG 6 HH21 ARG 6 19.363 37.537 18.303 50 HH22 ARG 6 HH22 ARG 6 19.527 38.507 16.852 51 H ARG 7 H ARG 7 20.908 32.578 21.125 52 HA ARG 7 HA ARG 7 21.362 33.654 23.773 53 HB2 ARG 7 HB2 ARG 7 19.430 31.609 22.615 54 HB3 ARG 7 HB3 ARG 7 19.382 32.145 24.264 55 HG2 ARG 7 HG2 ARG 7 18.919 33.875 21.798 56 HG3 ARG 7 HG3 ARG 7 17.691 33.288 22.918 57 HD2 ARG 7 HD2 ARG 7 19.869 35.324 23.491 58 HD3 ARG 7 HD3 ARG 7 18.130 35.614 23.384 59 HE ARG 7 HE ARG 7 18.289 33.746 25.396 60 HH11 ARG 7 HH11 ARG 7 19.468 37.014 25.017 61 HH12 ARG 7 HH12 ARG 7 19.980 37.153 26.674 62 HH21 ARG 7 HH21 ARG 7 18.937 34.007 27.590 63 HH22 ARG 7 HH22 ARG 7 19.514 35.571 28.080 64 H CYS 8 H CYS 8 21.629 30.333 22.452 65 HA CYS 8 HA CYS 8 22.316 29.048 24.876 66 HB2 CYS 8 HB2 CYS 8 21.597 27.960 22.777 67 HB3 CYS 8 HB3 CYS 8 23.126 28.394 22.026 68 H GLU 9 H GLU 9 24.485 30.590 22.441 69 HA GLU 9 HA GLU 9 26.916 30.071 23.866 70 HB2 GLU 9 HB2 GLU 9 26.132 32.182 21.842 71 HB3 GLU 9 HB3 GLU 9 27.720 32.184 22.626 72 HG2 GLU 9 HG2 GLU 9 28.129 29.867 21.876 73 HG3 GLU 9 HG3 GLU 9 26.574 29.852 21.035 74 H LEU 10 H LEU 10 24.667 32.881 24.192 75 HA LEU 10 HA LEU 10 26.241 34.202 26.224 76 HB2 LEU 10 HB2 LEU 10 23.292 34.337 25.481 77 HB3 LEU 10 HB3 LEU 10 24.046 35.408 26.657 78 HG LEU 10 HG LEU 10 24.911 35.233 23.741 79 HD11 LEU 10 HD11 LEU 10 23.673 37.352 23.456 80 HD12 LEU 10 HD12 LEU 10 22.592 36.024 23.906 81 HD13 LEU 10 HD13 LEU 10 23.072 37.229 25.126 82 HD21 LEU 10 HD21 LEU 10 26.668 36.143 25.214 83 HD22 LEU 10 HD22 LEU 10 25.970 37.424 24.216 84 HD23 LEU 10 HD23 LEU 10 25.497 37.285 25.922 85 H SER 11 H SER 11 23.587 31.860 26.410 86 HA SER 11 HA SER 11 23.260 31.853 29.241 87 HB2 SER 11 HB2 SER 11 21.566 31.023 27.688 88 HB3 SER 11 HB3 SER 11 22.656 29.754 27.124 89 HG SER 11 HG SER 11 21.231 28.913 28.595 90 H CYS 12 H CYS 12 25.126 29.591 27.111 91 HA CYS 12 HA CYS 12 26.315 28.168 29.308 92 HB2 CYS 12 HB2 CYS 12 27.267 28.507 26.452 93 HB3 CYS 12 HB3 CYS 12 27.885 27.329 27.611 94 H ARG 13 H ARG 13 27.272 31.215 27.675 95 HA ARG 13 HA ARG 13 29.923 31.395 28.718 96 HB2 ARG 13 HB2 ARG 13 28.976 32.892 26.979 97 HB3 ARG 13 HB3 ARG 13 27.908 33.622 28.168 98 HG2 ARG 13 HG2 ARG 13 29.791 35.048 27.672 99 HG3 ARG 13 HG3 ARG 13 29.842 34.576 29.368 100 HD2 ARG 13 HD2 ARG 13 31.345 32.856 27.405 101 HD3 ARG 13 HD3 ARG 13 31.959 34.488 27.670 102 HE ARG 13 HE ARG 13 31.478 33.179 30.196 103 HH11 ARG 13 HH11 ARG 13 33.781 33.073 27.542 104 HH12 ARG 13 HH12 ARG 13 35.156 32.989 28.611 105 HH21 ARG 13 HH21 ARG 13 33.288 33.039 31.502 106 HH22 ARG 13 HH22 ARG 13 34.876 32.923 30.755 107 H SER 14 H SER 14 26.808 32.168 30.305 108 HA SER 14 HA SER 14 27.961 33.162 32.747 109 HB2 SER 14 HB2 SER 14 25.302 31.779 32.316 110 HB3 SER 14 HB3 SER 14 25.743 32.850 33.658 111 HG SER 14 HG SER 14 26.052 34.532 32.029 112 H LEU 15 H LEU 15 27.754 29.914 31.534 113 HA LEU 15 HA LEU 15 28.333 28.722 34.208 114 HB2 LEU 15 HB2 LEU 15 28.060 27.335 31.517 115 HB3 LEU 15 HB3 LEU 15 28.127 26.585 33.107 116 HG LEU 15 HG LEU 15 25.845 28.265 31.991 117 HD11 LEU 15 HD11 LEU 15 26.011 25.316 32.716 118 HD12 LEU 15 HD12 LEU 15 24.597 26.169 32.054 119 HD13 LEU 15 HD13 LEU 15 26.057 25.981 31.068 120 HD21 LEU 15 HD21 LEU 15 24.601 27.562 34.043 121 HD22 LEU 15 HD22 LEU 15 26.108 26.898 34.702 122 HD23 LEU 15 HD23 LEU 15 25.956 28.642 34.410 123 H GLY 16 H GLY 16 29.957 30.037 31.507 124 HA2 GLY 16 HA2 GLY 16 32.278 30.394 31.309 125 HA3 GLY 16 HA3 GLY 16 32.611 29.044 32.394 126 H LEU 17 H LEU 17 30.279 28.569 29.847 127 HA LEU 17 HA LEU 17 32.151 26.702 28.509 128 HB2 LEU 17 HB2 LEU 17 29.164 26.438 28.899 129 HB3 LEU 17 HB3 LEU 17 30.212 25.233 28.149 130 HG LEU 17 HG LEU 17 30.148 26.140 31.021 131 HD11 LEU 17 HD11 LEU 17 28.278 24.705 30.449 132 HD12 LEU 17 HD12 LEU 17 29.390 23.476 29.770 133 HD13 LEU 17 HD13 LEU 17 29.402 23.849 31.505 134 HD21 LEU 17 HD21 LEU 17 32.482 25.499 30.441 135 HD22 LEU 17 HD22 LEU 17 31.758 24.240 31.436 136 HD23 LEU 17 HD23 LEU 17 31.894 23.996 29.684 137 H LEU 18 H LEU 18 31.261 25.924 26.326 138 HA LEU 18 HA LEU 18 30.650 28.290 24.601 139 HB2 LEU 18 HB2 LEU 18 31.697 25.583 23.790 140 HB3 LEU 18 HB3 LEU 18 31.513 27.020 22.773 141 HG LEU 18 HG LEU 18 33.466 26.748 25.113 142 HD11 LEU 18 HD11 LEU 18 33.957 26.678 22.113 143 HD12 LEU 18 HD12 LEU 18 35.196 26.613 23.388 144 HD13 LEU 18 HD13 LEU 18 34.034 25.283 23.216 145 HD21 LEU 18 HD21 LEU 18 32.819 29.103 24.727 146 HD22 LEU 18 HD22 LEU 18 34.481 28.811 24.203 147 HD23 LEU 18 HD23 LEU 18 33.186 28.924 22.994 148 H GLY 19 H GLY 19 28.601 28.440 23.801 149 HA2 GLY 19 HA2 GLY 19 26.719 26.173 24.116 150 HA3 GLY 19 HA3 GLY 19 26.317 27.807 23.620 151 H LYS 20 H LYS 20 25.736 25.026 22.517 152 HA LYS 20 HA LYS 20 25.924 25.813 19.654 153 HB2 LYS 20 HB2 LYS 20 26.809 23.090 20.751 154 HB3 LYS 20 HB3 LYS 20 26.431 23.414 19.073 155 HG2 LYS 20 HG2 LYS 20 28.638 23.684 18.886 156 HG3 LYS 20 HG3 LYS 20 28.246 25.345 19.332 157 HD2 LYS 20 HD2 LYS 20 28.683 24.414 21.811 158 HD3 LYS 20 HD3 LYS 20 29.534 23.128 20.966 159 HE2 LYS 20 HE2 LYS 20 30.060 26.117 20.669 160 HE3 LYS 20 HE3 LYS 20 30.998 25.033 21.700 161 HZ1 LYS 20 HZ1 LYS 20 32.051 25.451 19.538 162 HZ2 LYS 20 HZ2 LYS 20 31.768 23.871 19.772 163 HZ3 LYS 20 HZ3 LYS 20 30.799 24.735 18.753 164 H CYS 21 H CYS 21 24.211 24.935 18.364 165 HA CYS 21 HA CYS 21 21.936 23.747 19.892 166 HB2 CYS 21 HB2 CYS 21 21.384 25.432 18.195 167 HB3 CYS 21 HB3 CYS 21 22.158 24.454 16.954 168 H ILE 22 H ILE 22 21.861 21.590 20.198 169 HA ILE 22 HA ILE 22 22.854 19.684 18.144 170 HB ILE 22 HB ILE 22 23.825 19.696 21.038 171 HG12 ILE 22 HG12 ILE 22 25.334 19.985 18.396 172 HG13 ILE 22 HG13 ILE 22 25.097 21.235 19.621 173 HG21 ILE 22 HG21 ILE 22 23.287 17.379 20.308 174 HG22 ILE 22 HG22 ILE 22 24.290 17.600 18.860 175 HG23 ILE 22 HG23 ILE 22 25.011 17.588 20.476 176 HD11 ILE 22 HD11 ILE 22 27.335 20.465 19.800 177 HD12 ILE 22 HD12 ILE 22 26.453 19.909 21.236 178 HD13 ILE 22 HD13 ILE 22 26.836 18.772 19.911 179 H GLY 23 H GLY 23 21.492 17.978 17.968 180 HA2 GLY 23 HA2 GLY 23 19.623 16.672 18.255 181 HA3 GLY 23 HA3 GLY 23 19.927 16.769 19.994 182 H GLU 24 H GLU 24 18.904 19.251 17.590 183 HA GLU 24 HA GLU 24 17.535 21.038 17.784 184 HB2 GLU 24 HB2 GLU 24 15.516 19.153 18.973 185 HB3 GLU 24 HB3 GLU 24 15.253 20.515 17.893 186 HG2 GLU 24 HG2 GLU 24 16.549 17.853 17.179 187 HG3 GLU 24 HG3 GLU 24 14.957 18.395 16.760 188 H GLU 25 H GLU 25 19.088 20.456 20.384 189 HA GLU 25 HA GLU 25 17.581 22.346 22.144 190 HB2 GLU 25 HB2 GLU 25 18.969 19.713 22.762 191 HB3 GLU 25 HB3 GLU 25 18.828 20.949 23.998 192 HG2 GLU 25 HG2 GLU 25 16.479 19.717 22.503 193 HG3 GLU 25 HG3 GLU 25 17.022 19.257 24.115 194 H CYS 26 H CYS 26 18.963 23.546 23.684 195 HA CYS 26 HA CYS 26 21.566 24.318 22.562 196 HB2 CYS 26 HB2 CYS 26 20.276 26.004 23.694 197 HB3 CYS 26 HB3 CYS 26 20.080 24.978 25.112 198 H LYS 27 H LYS 27 23.487 23.362 23.017 199 HA LYS 27 HA LYS 27 23.778 21.770 25.534 200 HB2 LYS 27 HB2 LYS 27 23.569 20.332 23.454 201 HB3 LYS 27 HB3 LYS 27 25.103 21.037 22.898 202 HG2 LYS 27 HG2 LYS 27 26.233 20.217 24.941 203 HG3 LYS 27 HG3 LYS 27 24.704 19.605 25.571 204 HD2 LYS 27 HD2 LYS 27 26.244 18.579 23.159 205 HD3 LYS 27 HD3 LYS 27 26.061 17.777 24.711 206 HE2 LYS 27 HE2 LYS 27 23.833 18.298 22.691 207 HE3 LYS 27 HE3 LYS 27 24.651 16.762 22.968 208 HZ1 LYS 27 HZ1 LYS 27 23.726 16.726 25.212 209 HZ2 LYS 27 HZ2 LYS 27 22.956 18.182 24.950 210 HZ3 LYS 27 HZ3 LYS 27 22.534 16.877 24.080 211 H CYS 28 H CYS 28 25.341 22.454 26.808 212 HA CYS 28 HA CYS 28 27.359 24.377 25.760 213 HB2 CYS 28 HB2 CYS 28 27.066 23.376 28.589 214 HB3 CYS 28 HB3 CYS 28 27.976 24.755 28.024 215 H VAL 29 H VAL 29 29.513 23.883 25.578 216 HA VAL 29 HA VAL 29 30.520 21.257 26.566 217 HB VAL 29 HB VAL 29 31.788 20.891 24.571 218 HG11 VAL 29 HG11 VAL 29 29.479 19.983 24.662 219 HG12 VAL 29 HG12 VAL 29 28.925 21.399 23.740 220 HG13 VAL 29 HG13 VAL 29 30.072 20.258 23.009 221 HG21 VAL 29 HG21 VAL 29 30.510 23.375 23.420 222 HG22 VAL 29 HG22 VAL 29 32.240 23.152 23.789 223 HG23 VAL 29 HG23 VAL 29 31.476 22.195 22.509 224 H TYR 30 H TYR 30 32.814 21.180 26.953 225 HA TYR 30 HA TYR 30 33.851 23.700 28.027 226 HB2 TYR 30 HB2 TYR 30 35.079 20.922 27.872 227 HB3 TYR 30 HB3 TYR 30 35.741 22.298 28.768 228 HD1 TYR 30 HD1 TYR 30 33.009 19.774 28.660 229 HD2 TYR 30 HD2 TYR 30 34.771 23.016 30.891 230 HE1 TYR 30 HE1 TYR 30 31.578 19.220 30.608 231 HE2 TYR 30 HE2 TYR 30 33.346 22.450 32.841 232 HH TYR 30 HH TYR 30 31.507 21.225 33.555 233 H ASN 31 H ASN 31 34.601 21.507 25.385 234 HA ASN 31 HA ASN 31 35.764 23.585 23.669 235 HB2 ASN 31 HB2 ASN 31 37.341 21.313 24.883 236 HB3 ASN 31 HB3 ASN 31 37.521 21.538 23.146 237 HD21 ASN 31 HD21 ASN 31 38.695 24.935 25.034 238 HD22 ASN 31 HD22 ASN 31 37.103 24.277 25.380 Start of MODEL 14 1 H1 ALA 1 H1 ALA 1 11.069 23.414 18.477 2 H2 ALA 1 H2 ALA 1 11.843 22.156 17.749 3 H3 ALA 1 H3 ALA 1 10.204 22.192 17.803 4 HA ALA 1 HA ALA 1 11.063 22.725 15.629 5 HB1 ALA 1 HB1 ALA 1 8.842 23.591 16.322 6 HB2 ALA 1 HB2 ALA 1 9.607 25.067 16.932 7 HB3 ALA 1 HB3 ALA 1 9.677 24.673 15.204 8 H PHE 2 H PHE 2 11.917 25.441 17.961 9 HA PHE 2 HA PHE 2 14.037 26.218 15.999 10 HB2 PHE 2 HB2 PHE 2 12.119 28.064 17.433 11 HB3 PHE 2 HB3 PHE 2 13.399 28.532 16.318 12 HD1 PHE 2 HD1 PHE 2 13.276 27.315 13.925 13 HD2 PHE 2 HD2 PHE 2 9.929 27.893 16.587 14 HE1 PHE 2 HE1 PHE 2 11.713 27.018 12.025 15 HE2 PHE 2 HE2 PHE 2 8.364 27.599 14.681 16 HZ PHE 2 HZ PHE 2 9.252 27.160 12.401 17 H CYS 3 H CYS 3 15.980 26.103 16.940 18 HA CYS 3 HA CYS 3 16.265 26.708 19.810 19 HB2 CYS 3 HB2 CYS 3 18.473 25.778 19.610 20 HB3 CYS 3 HB3 CYS 3 17.264 24.641 19.066 21 H ASN 4 H ASN 4 18.157 28.115 20.415 22 HA ASN 4 HA ASN 4 18.624 30.336 18.483 23 HB2 ASN 4 HB2 ASN 4 17.704 30.382 21.377 24 HB3 ASN 4 HB3 ASN 4 18.578 31.732 20.660 25 HD21 ASN 4 HD21 ASN 4 15.776 32.974 18.979 26 HD22 ASN 4 HD22 ASN 4 17.412 33.251 19.609 27 H LEU 5 H LEU 5 20.616 29.426 17.894 28 HA LEU 5 HA LEU 5 22.558 28.360 19.584 29 HB2 LEU 5 HB2 LEU 5 22.263 28.594 16.950 30 HB3 LEU 5 HB3 LEU 5 23.339 29.988 17.166 31 HG LEU 5 HG LEU 5 23.862 27.062 17.830 32 HD11 LEU 5 HD11 LEU 5 25.572 27.279 16.047 33 HD12 LEU 5 HD12 LEU 5 23.942 27.632 15.442 34 HD13 LEU 5 HD13 LEU 5 25.078 28.958 15.780 35 HD21 LEU 5 HD21 LEU 5 25.699 29.445 18.256 36 HD22 LEU 5 HD22 LEU 5 25.113 28.300 19.489 37 HD23 LEU 5 HD23 LEU 5 26.236 27.753 18.245 38 H ARG 6 H ARG 6 22.070 31.775 18.647 39 HA ARG 6 HA ARG 6 24.354 32.816 20.040 40 HB2 ARG 6 HB2 ARG 6 23.122 34.148 18.341 41 HB3 ARG 6 HB3 ARG 6 21.677 34.092 19.327 42 HG2 ARG 6 HG2 ARG 6 22.388 36.216 19.647 43 HG3 ARG 6 HG3 ARG 6 23.000 35.442 21.096 44 HD2 ARG 6 HD2 ARG 6 24.532 36.303 18.616 45 HD3 ARG 6 HD3 ARG 6 24.596 36.979 20.249 46 HE ARG 6 HE ARG 6 25.457 34.163 19.922 47 HH11 ARG 6 HH11 ARG 6 26.599 37.492 20.171 48 HH12 ARG 6 HH12 ARG 6 28.221 36.906 20.558 49 HH21 ARG 6 HH21 ARG 6 27.525 33.632 20.221 50 HH22 ARG 6 HH22 ARG 6 28.697 34.885 20.657 51 H ARG 7 H ARG 7 20.936 32.546 21.146 52 HA ARG 7 HA ARG 7 21.492 33.591 23.761 53 HB2 ARG 7 HB2 ARG 7 19.202 33.258 22.580 54 HB3 ARG 7 HB3 ARG 7 19.290 31.586 23.140 55 HG2 ARG 7 HG2 ARG 7 19.551 32.460 25.506 56 HG3 ARG 7 HG3 ARG 7 19.341 34.104 24.884 57 HD2 ARG 7 HD2 ARG 7 17.374 31.819 24.633 58 HD3 ARG 7 HD3 ARG 7 17.242 33.142 25.810 59 HE ARG 7 HE ARG 7 17.262 34.606 23.598 60 HH11 ARG 7 HH11 ARG 7 15.430 31.658 24.108 61 HH12 ARG 7 HH12 ARG 7 14.407 31.937 22.718 62 HH21 ARG 7 HH21 ARG 7 15.872 34.979 21.929 63 HH22 ARG 7 HH22 ARG 7 14.592 33.824 21.595 64 H CYS 8 H CYS 8 21.541 30.303 22.472 65 HA CYS 8 HA CYS 8 22.107 28.889 24.858 66 HB2 CYS 8 HB2 CYS 8 21.332 27.914 22.751 67 HB3 CYS 8 HB3 CYS 8 22.825 28.397 21.954 68 H GLU 9 H GLU 9 24.431 30.253 22.425 69 HA GLU 9 HA GLU 9 26.848 29.694 23.803 70 HB2 GLU 9 HB2 GLU 9 26.000 31.968 21.984 71 HB3 GLU 9 HB3 GLU 9 27.619 31.881 22.661 72 HG2 GLU 9 HG2 GLU 9 28.047 29.734 21.596 73 HG3 GLU 9 HG3 GLU 9 26.407 29.667 20.968 74 H LEU 10 H LEU 10 24.752 32.617 24.137 75 HA LEU 10 HA LEU 10 26.438 33.764 26.190 76 HB2 LEU 10 HB2 LEU 10 23.591 34.381 25.320 77 HB3 LEU 10 HB3 LEU 10 24.547 35.380 26.419 78 HG LEU 10 HG LEU 10 25.308 34.780 23.519 79 HD11 LEU 10 HD11 LEU 10 23.291 36.191 23.696 80 HD12 LEU 10 HD12 LEU 10 24.183 37.321 24.743 81 HD13 LEU 10 HD13 LEU 10 24.674 37.085 23.053 82 HD21 LEU 10 HD21 LEU 10 26.524 36.685 25.550 83 HD22 LEU 10 HD22 LEU 10 27.300 35.251 24.830 84 HD23 LEU 10 HD23 LEU 10 26.917 36.643 23.817 85 H SER 11 H SER 11 23.656 31.594 26.328 86 HA SER 11 HA SER 11 23.297 31.720 29.180 87 HB2 SER 11 HB2 SER 11 22.642 29.457 27.245 88 HB3 SER 11 HB3 SER 11 22.067 29.596 28.914 89 HG SER 11 HG SER 11 21.508 31.255 26.698 90 H CYS 12 H CYS 12 25.255 29.533 27.076 91 HA CYS 12 HA CYS 12 26.483 28.121 29.271 92 HB2 CYS 12 HB2 CYS 12 27.443 28.591 26.434 93 HB3 CYS 12 HB3 CYS 12 28.116 27.424 27.559 94 H ARG 13 H ARG 13 27.345 31.191 27.619 95 HA ARG 13 HA ARG 13 29.900 31.595 28.752 96 HB2 ARG 13 HB2 ARG 13 28.804 32.883 26.911 97 HB3 ARG 13 HB3 ARG 13 27.820 33.727 28.113 98 HG2 ARG 13 HG2 ARG 13 29.790 34.736 29.117 99 HG3 ARG 13 HG3 ARG 13 30.866 33.780 28.086 100 HD2 ARG 13 HD2 ARG 13 28.842 35.824 27.060 101 HD3 ARG 13 HD3 ARG 13 30.562 36.149 27.333 102 HE ARG 13 HE ARG 13 30.432 33.877 25.663 103 HH11 ARG 13 HH11 ARG 13 29.665 37.344 25.303 104 HH12 ARG 13 HH12 ARG 13 30.358 37.323 23.694 105 HH21 ARG 13 HH21 ARG 13 30.747 33.964 23.436 106 HH22 ARG 13 HH22 ARG 13 30.606 35.500 22.639 107 H SER 14 H SER 14 26.749 32.152 30.283 108 HA SER 14 HA SER 14 27.715 33.423 32.686 109 HB2 SER 14 HB2 SER 14 25.361 33.431 31.990 110 HB3 SER 14 HB3 SER 14 25.287 31.672 32.185 111 HG SER 14 HG SER 14 25.580 33.682 34.172 112 H LEU 15 H LEU 15 27.435 29.999 31.735 113 HA LEU 15 HA LEU 15 28.370 28.956 34.319 114 HB2 LEU 15 HB2 LEU 15 28.300 27.558 31.623 115 HB3 LEU 15 HB3 LEU 15 28.396 26.817 33.212 116 HG LEU 15 HG LEU 15 25.999 28.277 32.018 117 HD11 LEU 15 HD11 LEU 15 24.964 26.056 32.042 118 HD12 LEU 15 HD12 LEU 15 26.442 26.050 31.070 119 HD13 LEU 15 HD13 LEU 15 26.449 25.346 32.704 120 HD21 LEU 15 HD21 LEU 15 24.763 27.478 34.019 121 HD22 LEU 15 HD22 LEU 15 26.287 26.902 34.726 122 HD23 LEU 15 HD23 LEU 15 26.019 28.639 34.449 123 H GLY 16 H GLY 16 29.807 30.052 31.314 124 HA2 GLY 16 HA2 GLY 16 32.069 30.725 31.042 125 HA3 GLY 16 HA3 GLY 16 32.576 29.641 32.341 126 H LEU 17 H LEU 17 30.299 28.587 29.900 127 HA LEU 17 HA LEU 17 32.300 26.762 28.649 128 HB2 LEU 17 HB2 LEU 17 29.301 26.375 28.855 129 HB3 LEU 17 HB3 LEU 17 30.476 25.199 28.285 130 HG LEU 17 HG LEU 17 30.039 26.206 31.089 131 HD11 LEU 17 HD11 LEU 17 28.330 24.653 30.368 132 HD12 LEU 17 HD12 LEU 17 29.572 23.471 29.866 133 HD13 LEU 17 HD13 LEU 17 29.364 23.891 31.578 134 HD21 LEU 17 HD21 LEU 17 32.470 25.657 30.725 135 HD22 LEU 17 HD22 LEU 17 31.694 24.529 31.837 136 HD23 LEU 17 HD23 LEU 17 31.979 24.054 30.147 137 H LEU 18 H LEU 18 31.521 26.103 26.344 138 HA LEU 18 HA LEU 18 30.544 28.523 24.858 139 HB2 LEU 18 HB2 LEU 18 31.824 26.012 23.774 140 HB3 LEU 18 HB3 LEU 18 31.267 27.382 22.824 141 HG LEU 18 HG LEU 18 33.628 27.326 24.746 142 HD11 LEU 18 HD11 LEU 18 34.936 27.777 22.752 143 HD12 LEU 18 HD12 LEU 18 33.894 26.377 22.406 144 HD13 LEU 18 HD13 LEU 18 33.471 27.970 21.771 145 HD21 LEU 18 HD21 LEU 18 34.051 29.676 24.022 146 HD22 LEU 18 HD22 LEU 18 32.465 29.701 23.220 147 HD23 LEU 18 HD23 LEU 18 32.582 29.529 24.986 148 H GLY 19 H GLY 19 28.764 28.229 23.347 149 HA2 GLY 19 HA2 GLY 19 26.986 25.902 24.034 150 HA3 GLY 19 HA3 GLY 19 26.391 27.521 23.750 151 H LYS 20 H LYS 20 26.013 24.784 22.498 152 HA LYS 20 HA LYS 20 26.055 25.536 19.611 153 HB2 LYS 20 HB2 LYS 20 26.671 22.829 20.904 154 HB3 LYS 20 HB3 LYS 20 26.658 23.160 19.175 155 HG2 LYS 20 HG2 LYS 20 28.621 24.394 21.176 156 HG3 LYS 20 HG3 LYS 20 28.954 22.998 20.134 157 HD2 LYS 20 HD2 LYS 20 28.564 24.417 18.134 158 HD3 LYS 20 HD3 LYS 20 28.194 25.769 19.219 159 HE2 LYS 20 HE2 LYS 20 30.513 25.585 20.182 160 HE3 LYS 20 HE3 LYS 20 30.880 24.316 18.999 161 HZ1 LYS 20 HZ1 LYS 20 30.461 25.946 17.241 162 HZ2 LYS 20 HZ2 LYS 20 30.092 27.103 18.364 163 HZ3 LYS 20 HZ3 LYS 20 31.616 26.542 18.254 164 H CYS 21 H CYS 21 24.281 24.819 18.400 165 HA CYS 21 HA CYS 21 22.005 23.623 19.934 166 HB2 CYS 21 HB2 CYS 21 21.376 25.554 18.639 167 HB3 CYS 21 HB3 CYS 21 22.077 24.863 17.170 168 H ILE 22 H ILE 22 21.551 21.519 19.745 169 HA ILE 22 HA ILE 22 22.422 19.957 17.365 170 HB ILE 22 HB ILE 22 23.004 19.132 20.237 171 HG12 ILE 22 HG12 ILE 22 24.918 19.719 17.944 172 HG13 ILE 22 HG13 ILE 22 24.665 20.732 19.369 173 HG21 ILE 22 HG21 ILE 22 22.213 17.221 18.850 174 HG22 ILE 22 HG22 ILE 22 23.471 17.586 17.653 175 HG23 ILE 22 HG23 ILE 22 23.894 17.045 19.291 176 HD11 ILE 22 HD11 ILE 22 26.686 19.542 19.710 177 HD12 ILE 22 HD12 ILE 22 25.479 18.858 20.818 178 HD13 ILE 22 HD13 ILE 22 25.942 17.985 19.332 179 H GLY 23 H GLY 23 20.588 19.107 16.566 180 HA2 GLY 23 HA2 GLY 23 18.461 18.282 16.386 181 HA3 GLY 23 HA3 GLY 23 18.735 17.460 17.917 182 H GLU 24 H GLU 24 18.196 20.777 16.766 183 HA GLU 24 HA GLU 24 17.046 22.557 17.497 184 HB2 GLU 24 HB2 GLU 24 14.884 20.535 18.123 185 HB3 GLU 24 HB3 GLU 24 14.665 22.268 17.824 186 HG2 GLU 24 HG2 GLU 24 15.605 21.966 15.528 187 HG3 GLU 24 HG3 GLU 24 15.677 20.221 15.809 188 H GLU 25 H GLU 25 18.676 21.175 19.666 189 HA GLU 25 HA GLU 25 17.527 22.661 21.956 190 HB2 GLU 25 HB2 GLU 25 16.827 20.246 21.927 191 HB3 GLU 25 HB3 GLU 25 18.524 19.777 21.984 192 HG2 GLU 25 HG2 GLU 25 17.446 19.654 24.170 193 HG3 GLU 25 HG3 GLU 25 18.767 20.825 24.196 194 H CYS 26 H CYS 26 18.924 23.488 23.444 195 HA CYS 26 HA CYS 26 21.620 24.026 22.540 196 HB2 CYS 26 HB2 CYS 26 20.201 25.707 23.631 197 HB3 CYS 26 HB3 CYS 26 20.099 24.713 25.076 198 H LYS 27 H LYS 27 23.515 23.178 23.149 199 HA LYS 27 HA LYS 27 23.777 21.793 25.749 200 HB2 LYS 27 HB2 LYS 27 23.511 19.948 24.250 201 HB3 LYS 27 HB3 LYS 27 24.666 20.618 23.090 202 HG2 LYS 27 HG2 LYS 27 26.523 20.223 24.529 203 HG3 LYS 27 HG3 LYS 27 25.502 19.893 25.933 204 HD2 LYS 27 HD2 LYS 27 25.494 18.115 23.462 205 HD3 LYS 27 HD3 LYS 27 26.633 17.910 24.797 206 HE2 LYS 27 HE2 LYS 27 24.681 17.751 26.388 207 HE3 LYS 27 HE3 LYS 27 23.595 17.791 25.002 208 HZ1 LYS 27 HZ1 LYS 27 24.677 15.756 24.190 209 HZ2 LYS 27 HZ2 LYS 27 25.628 15.687 25.549 210 HZ3 LYS 27 HZ3 LYS 27 24.005 15.532 25.670 211 H CYS 28 H CYS 28 25.620 22.242 26.842 212 HA CYS 28 HA CYS 28 27.481 24.197 25.598 213 HB2 CYS 28 HB2 CYS 28 27.376 23.362 28.496 214 HB3 CYS 28 HB3 CYS 28 28.248 24.718 27.823 215 H VAL 29 H VAL 29 29.734 24.025 25.808 216 HA VAL 29 HA VAL 29 30.907 21.336 26.385 217 HB VAL 29 HB VAL 29 32.295 21.437 24.399 218 HG11 VAL 29 HG11 VAL 29 30.636 20.887 22.713 219 HG12 VAL 29 HG12 VAL 29 30.146 20.229 24.280 220 HG13 VAL 29 HG13 VAL 29 29.359 21.690 23.636 221 HG21 VAL 29 HG21 VAL 29 32.413 23.843 23.975 222 HG22 VAL 29 HG22 VAL 29 31.842 22.988 22.544 223 HG23 VAL 29 HG23 VAL 29 30.682 23.876 23.552 224 H TYR 30 H TYR 30 33.029 21.320 27.083 225 HA TYR 30 HA TYR 30 33.616 23.585 28.812 226 HB2 TYR 30 HB2 TYR 30 34.969 20.866 28.555 227 HB3 TYR 30 HB3 TYR 30 35.182 22.012 29.856 228 HD1 TYR 30 HD1 TYR 30 32.954 19.454 28.436 229 HD2 TYR 30 HD2 TYR 30 33.401 22.459 31.516 230 HE1 TYR 30 HE1 TYR 30 30.991 18.511 29.660 231 HE2 TYR 30 HE2 TYR 30 31.431 21.514 32.722 232 HH TYR 30 HH TYR 30 29.475 20.131 32.353 233 H ASN 31 H ASN 31 34.276 23.977 25.955 234 HA ASN 31 HA ASN 31 37.094 23.777 25.548 235 HB2 ASN 31 HB2 ASN 31 34.876 25.193 24.077 236 HB3 ASN 31 HB3 ASN 31 36.541 25.222 23.519 237 HD21 ASN 31 HD21 ASN 31 36.161 22.136 21.885 238 HD22 ASN 31 HD22 ASN 31 36.994 23.685 21.990 Start of MODEL 15 1 H1 ALA 1 H1 ALA 1 12.986 20.459 18.722 2 H2 ALA 1 H2 ALA 1 12.270 20.367 20.196 3 H3 ALA 1 H3 ALA 1 13.533 21.368 19.991 4 HA ALA 1 HA ALA 1 11.011 21.604 18.536 5 HB1 ALA 1 HB1 ALA 1 10.358 23.434 20.044 6 HB2 ALA 1 HB2 ALA 1 10.510 21.897 20.901 7 HB3 ALA 1 HB3 ALA 1 11.783 23.123 21.060 8 H PHE 2 H PHE 2 13.478 23.933 19.827 9 HA PHE 2 HA PHE 2 13.855 25.017 17.088 10 HB2 PHE 2 HB2 PHE 2 12.756 26.658 19.394 11 HB3 PHE 2 HB3 PHE 2 13.260 27.286 17.829 12 HD1 PHE 2 HD1 PHE 2 12.079 26.336 15.719 13 HD2 PHE 2 HD2 PHE 2 10.495 25.973 19.714 14 HE1 PHE 2 HE1 PHE 2 9.842 25.838 14.786 15 HE2 PHE 2 HE2 PHE 2 8.244 25.512 18.771 16 HZ PHE 2 HZ PHE 2 7.909 25.441 16.312 17 H CYS 3 H CYS 3 15.745 26.106 16.801 18 HA CYS 3 HA CYS 3 17.757 25.989 18.982 19 HB2 CYS 3 HB2 CYS 3 18.441 24.965 16.941 20 HB3 CYS 3 HB3 CYS 3 17.887 26.355 15.985 21 H ASN 4 H ASN 4 18.901 27.737 19.662 22 HA ASN 4 HA ASN 4 18.656 30.370 18.418 23 HB2 ASN 4 HB2 ASN 4 17.957 30.048 21.370 24 HB3 ASN 4 HB3 ASN 4 18.088 31.558 20.487 25 HD21 ASN 4 HD21 ASN 4 14.874 31.212 18.938 26 HD22 ASN 4 HD22 ASN 4 16.406 32.050 18.842 27 H LEU 5 H LEU 5 20.793 29.533 17.853 28 HA LEU 5 HA LEU 5 22.594 28.418 19.685 29 HB2 LEU 5 HB2 LEU 5 22.444 28.557 17.041 30 HB3 LEU 5 HB3 LEU 5 23.592 29.877 17.242 31 HG LEU 5 HG LEU 5 23.879 26.968 18.111 32 HD11 LEU 5 HD11 LEU 5 25.286 28.598 15.954 33 HD12 LEU 5 HD12 LEU 5 25.624 26.910 16.366 34 HD13 LEU 5 HD13 LEU 5 24.051 27.344 15.683 35 HD21 LEU 5 HD21 LEU 5 25.808 29.291 18.439 36 HD22 LEU 5 HD22 LEU 5 25.172 28.213 19.702 37 HD23 LEU 5 HD23 LEU 5 26.303 27.586 18.502 38 H ARG 6 H ARG 6 22.543 31.839 18.548 39 HA ARG 6 HA ARG 6 24.691 32.735 20.251 40 HB2 ARG 6 HB2 ARG 6 24.000 34.058 18.383 41 HB3 ARG 6 HB3 ARG 6 22.347 34.193 18.989 42 HG2 ARG 6 HG2 ARG 6 23.068 35.594 20.853 43 HG3 ARG 6 HG3 ARG 6 24.772 35.328 20.451 44 HD2 ARG 6 HD2 ARG 6 23.980 37.535 19.711 45 HD3 ARG 6 HD3 ARG 6 24.531 36.539 18.373 46 HE ARG 6 HE ARG 6 21.613 36.835 19.080 47 HH11 ARG 6 HH11 ARG 6 24.025 36.562 16.497 48 HH12 ARG 6 HH12 ARG 6 22.793 36.784 15.273 49 HH21 ARG 6 HH21 ARG 6 20.282 37.501 17.510 50 HH22 ARG 6 HH22 ARG 6 20.795 37.469 15.831 51 H ARG 7 H ARG 7 21.163 32.589 20.925 52 HA ARG 7 HA ARG 7 21.330 33.698 23.590 53 HB2 ARG 7 HB2 ARG 7 19.240 33.300 22.130 54 HB3 ARG 7 HB3 ARG 7 19.344 31.608 22.634 55 HG2 ARG 7 HG2 ARG 7 19.274 32.466 25.056 56 HG3 ARG 7 HG3 ARG 7 18.874 34.054 24.396 57 HD2 ARG 7 HD2 ARG 7 17.321 31.479 23.902 58 HD3 ARG 7 HD3 ARG 7 16.897 32.678 25.125 59 HE ARG 7 HE ARG 7 16.850 34.251 22.941 60 HH11 ARG 7 HH11 ARG 7 15.351 31.070 23.406 61 HH12 ARG 7 HH12 ARG 7 14.030 31.529 22.324 62 HH21 ARG 7 HH21 ARG 7 15.108 34.590 21.508 63 HH22 ARG 7 HH22 ARG 7 13.947 33.284 21.334 64 H CYS 8 H CYS 8 21.626 30.388 22.368 65 HA CYS 8 HA CYS 8 22.036 29.053 24.834 66 HB2 CYS 8 HB2 CYS 8 21.466 28.025 22.610 67 HB3 CYS 8 HB3 CYS 8 23.099 28.372 22.075 68 H GLU 9 H GLU 9 24.545 30.398 22.537 69 HA GLU 9 HA GLU 9 26.796 29.895 24.223 70 HB2 GLU 9 HB2 GLU 9 26.275 32.050 22.131 71 HB3 GLU 9 HB3 GLU 9 27.775 31.932 23.043 72 HG2 GLU 9 HG2 GLU 9 27.849 29.450 22.207 73 HG3 GLU 9 HG3 GLU 9 26.716 29.996 20.978 74 H LEU 10 H LEU 10 24.686 32.823 24.162 75 HA LEU 10 HA LEU 10 26.141 34.186 26.255 76 HB2 LEU 10 HB2 LEU 10 23.329 34.489 25.138 77 HB3 LEU 10 HB3 LEU 10 24.016 35.591 26.332 78 HG LEU 10 HG LEU 10 25.237 35.105 23.579 79 HD11 LEU 10 HD11 LEU 10 22.997 36.132 23.406 80 HD12 LEU 10 HD12 LEU 10 23.492 37.406 24.542 81 HD13 LEU 10 HD13 LEU 10 24.276 37.268 22.951 82 HD21 LEU 10 HD21 LEU 10 25.761 37.242 25.689 83 HD22 LEU 10 HD22 LEU 10 26.885 35.962 25.185 84 HD23 LEU 10 HD23 LEU 10 26.432 37.235 24.044 85 H SER 11 H SER 11 23.819 31.619 26.361 86 HA SER 11 HA SER 11 23.277 31.875 29.233 87 HB2 SER 11 HB2 SER 11 22.844 29.493 27.377 88 HB3 SER 11 HB3 SER 11 22.248 29.665 29.021 89 HG SER 11 HG SER 11 21.566 31.259 26.761 90 H CYS 12 H CYS 12 25.291 29.725 27.140 91 HA CYS 12 HA CYS 12 26.517 28.304 29.278 92 HB2 CYS 12 HB2 CYS 12 27.550 28.818 26.476 93 HB3 CYS 12 HB3 CYS 12 28.072 27.536 27.561 94 H ARG 13 H ARG 13 27.437 31.422 27.815 95 HA ARG 13 HA ARG 13 30.045 31.649 28.909 96 HB2 ARG 13 HB2 ARG 13 28.955 33.087 27.167 97 HB3 ARG 13 HB3 ARG 13 28.047 33.903 28.444 98 HG2 ARG 13 HG2 ARG 13 30.126 34.713 29.456 99 HG3 ARG 13 HG3 ARG 13 31.103 33.761 28.335 100 HD2 ARG 13 HD2 ARG 13 29.207 35.989 27.472 101 HD3 ARG 13 HD3 ARG 13 30.929 36.218 27.781 102 HE ARG 13 HE ARG 13 30.623 34.070 25.923 103 HH11 ARG 13 HH11 ARG 13 30.715 37.624 25.973 104 HH12 ARG 13 HH12 ARG 13 31.017 37.630 24.241 105 HH21 ARG 13 HH21 ARG 13 30.892 34.328 23.703 106 HH22 ARG 13 HH22 ARG 13 31.111 35.959 23.087 107 H SER 14 H SER 14 26.945 32.077 30.570 108 HA SER 14 HA SER 14 27.982 33.113 33.065 109 HB2 SER 14 HB2 SER 14 25.594 33.169 32.639 110 HB3 SER 14 HB3 SER 14 25.563 31.411 32.395 111 HG SER 14 HG SER 14 24.804 31.946 34.427 112 H LEU 15 H LEU 15 27.467 29.805 31.818 113 HA LEU 15 HA LEU 15 28.416 28.456 34.175 114 HB2 LEU 15 HB2 LEU 15 28.281 27.368 31.344 115 HB3 LEU 15 HB3 LEU 15 28.297 26.446 32.843 116 HG LEU 15 HG LEU 15 26.031 28.211 31.816 117 HD11 LEU 15 HD11 LEU 15 26.211 25.206 32.249 118 HD12 LEU 15 HD12 LEU 15 24.824 26.103 31.599 119 HD13 LEU 15 HD13 LEU 15 26.339 26.023 30.681 120 HD21 LEU 15 HD21 LEU 15 26.196 26.542 34.360 121 HD22 LEU 15 HD22 LEU 15 26.058 28.315 34.269 122 HD23 LEU 15 HD23 LEU 15 24.723 27.302 33.719 123 H GLY 16 H GLY 16 30.097 29.898 31.481 124 HA2 GLY 16 HA2 GLY 16 32.441 30.382 31.514 125 HA3 GLY 16 HA3 GLY 16 32.739 28.977 32.542 126 H LEU 17 H LEU 17 30.587 28.709 29.817 127 HA LEU 17 HA LEU 17 32.502 26.937 28.384 128 HB2 LEU 17 HB2 LEU 17 29.501 26.605 28.669 129 HB3 LEU 17 HB3 LEU 17 30.609 25.451 27.941 130 HG LEU 17 HG LEU 17 30.352 26.198 30.844 131 HD11 LEU 17 HD11 LEU 17 29.636 23.867 31.128 132 HD12 LEU 17 HD12 LEU 17 28.548 24.803 30.110 133 HD13 LEU 17 HD13 LEU 17 29.686 23.641 29.367 134 HD21 LEU 17 HD21 LEU 17 32.187 24.109 29.548 135 HD22 LEU 17 HD22 LEU 17 32.740 25.600 30.336 136 HD23 LEU 17 HD23 LEU 17 31.968 24.341 31.296 137 H LEU 18 H LEU 18 31.149 26.302 26.231 138 HA LEU 18 HA LEU 18 30.355 28.749 24.704 139 HB2 LEU 18 HB2 LEU 18 31.542 26.146 23.675 140 HB3 LEU 18 HB3 LEU 18 31.112 27.547 22.698 141 HG LEU 18 HG LEU 18 33.363 27.432 24.765 142 HD11 LEU 18 HD11 LEU 18 33.799 26.193 22.669 143 HD12 LEU 18 HD12 LEU 18 33.469 27.682 21.742 144 HD13 LEU 18 HD13 LEU 18 34.853 27.607 22.850 145 HD21 LEU 18 HD21 LEU 18 32.467 29.711 24.688 146 HD22 LEU 18 HD22 LEU 18 34.013 29.660 23.840 147 HD23 LEU 18 HD23 LEU 18 32.501 29.698 22.908 148 H GLY 19 H GLY 19 28.728 28.063 22.922 149 HA2 GLY 19 HA2 GLY 19 26.852 25.948 23.916 150 HA3 GLY 19 HA3 GLY 19 26.286 27.576 23.587 151 H LYS 20 H LYS 20 25.709 24.891 22.464 152 HA LYS 20 HA LYS 20 25.813 25.380 19.527 153 HB2 LYS 20 HB2 LYS 20 26.357 22.826 21.133 154 HB3 LYS 20 HB3 LYS 20 26.275 22.908 19.382 155 HG2 LYS 20 HG2 LYS 20 28.358 24.329 21.112 156 HG3 LYS 20 HG3 LYS 20 28.594 22.818 20.211 157 HD2 LYS 20 HD2 LYS 20 27.962 24.136 18.101 158 HD3 LYS 20 HD3 LYS 20 27.998 25.577 19.133 159 HE2 LYS 20 HE2 LYS 20 30.378 24.851 19.797 160 HE3 LYS 20 HE3 LYS 20 30.282 23.649 18.505 161 HZ1 LYS 20 HZ1 LYS 20 31.359 25.614 17.701 162 HZ2 LYS 20 HZ2 LYS 20 29.897 25.532 16.949 163 HZ3 LYS 20 HZ3 LYS 20 30.115 26.582 18.186 164 H CYS 21 H CYS 21 24.094 24.518 18.342 165 HA CYS 21 HA CYS 21 21.727 23.459 19.861 166 HB2 CYS 21 HB2 CYS 21 22.060 24.594 17.068 167 HB3 CYS 21 HB3 CYS 21 20.590 23.817 17.643 168 H ILE 22 H ILE 22 21.857 21.254 20.041 169 HA ILE 22 HA ILE 22 22.705 19.665 17.630 170 HB ILE 22 HB ILE 22 23.125 18.977 20.549 171 HG12 ILE 22 HG12 ILE 22 25.188 19.576 18.376 172 HG13 ILE 22 HG13 ILE 22 24.688 20.726 19.611 173 HG21 ILE 22 HG21 ILE 22 24.287 16.959 19.687 174 HG22 ILE 22 HG22 ILE 22 22.607 16.959 19.187 175 HG23 ILE 22 HG23 ILE 22 23.870 17.419 18.024 176 HD11 ILE 22 HD11 ILE 22 26.165 18.129 20.106 177 HD12 ILE 22 HD12 ILE 22 26.738 19.785 20.340 178 HD13 ILE 22 HD13 ILE 22 25.461 19.144 21.391 179 H GLY 23 H GLY 23 21.057 18.642 16.700 180 HA2 GLY 23 HA2 GLY 23 19.055 17.522 16.400 181 HA3 GLY 23 HA3 GLY 23 19.021 17.142 18.124 182 H GLU 24 H GLU 24 19.150 20.423 16.846 183 HA GLU 24 HA GLU 24 17.902 22.244 17.036 184 HB2 GLU 24 HB2 GLU 24 15.417 20.570 17.425 185 HB3 GLU 24 HB3 GLU 24 15.495 22.278 17.026 186 HG2 GLU 24 HG2 GLU 24 16.500 21.815 14.867 187 HG3 GLU 24 HG3 GLU 24 16.590 20.084 15.225 188 H GLU 25 H GLU 25 18.823 20.603 19.609 189 HA GLU 25 HA GLU 25 17.486 22.469 21.535 190 HB2 GLU 25 HB2 GLU 25 16.814 20.112 21.792 191 HB3 GLU 25 HB3 GLU 25 18.494 19.644 21.984 192 HG2 GLU 25 HG2 GLU 25 17.390 19.739 24.147 193 HG3 GLU 25 HG3 GLU 25 18.663 20.951 24.069 194 H CYS 26 H CYS 26 18.682 23.738 22.834 195 HA CYS 26 HA CYS 26 21.425 24.207 22.385 196 HB2 CYS 26 HB2 CYS 26 19.978 25.907 23.242 197 HB3 CYS 26 HB3 CYS 26 19.564 24.932 24.648 198 H LYS 27 H LYS 27 23.285 23.472 23.169 199 HA LYS 27 HA LYS 27 23.459 22.091 25.774 200 HB2 LYS 27 HB2 LYS 27 23.143 20.420 23.827 201 HB3 LYS 27 HB3 LYS 27 24.786 20.863 23.334 202 HG2 LYS 27 HG2 LYS 27 25.592 20.212 25.625 203 HG3 LYS 27 HG3 LYS 27 23.937 19.780 26.061 204 HD2 LYS 27 HD2 LYS 27 25.698 18.408 23.991 205 HD3 LYS 27 HD3 LYS 27 25.218 17.802 25.576 206 HE2 LYS 27 HE2 LYS 27 22.750 18.121 24.599 207 HE3 LYS 27 HE3 LYS 27 23.584 18.046 23.043 208 HZ1 LYS 27 HZ1 LYS 27 24.626 15.915 24.028 209 HZ2 LYS 27 HZ2 LYS 27 23.464 15.987 25.163 210 HZ3 LYS 27 HZ3 LYS 27 23.039 15.811 23.581 211 H CYS 28 H CYS 28 25.261 22.663 26.910 212 HA CYS 28 HA CYS 28 27.204 24.470 25.610 213 HB2 CYS 28 HB2 CYS 28 26.999 23.717 28.528 214 HB3 CYS 28 HB3 CYS 28 27.959 25.018 27.854 215 H VAL 29 H VAL 29 29.335 24.216 25.437 216 HA VAL 29 HA VAL 29 30.617 21.611 26.115 217 HB VAL 29 HB VAL 29 31.558 21.419 23.899 218 HG11 VAL 29 HG11 VAL 29 29.633 20.719 22.649 219 HG12 VAL 29 HG12 VAL 29 29.325 20.375 24.362 220 HG13 VAL 29 HG13 VAL 29 28.556 21.773 23.583 221 HG21 VAL 29 HG21 VAL 29 29.921 23.858 23.098 222 HG22 VAL 29 HG22 VAL 29 31.696 23.754 23.173 223 HG23 VAL 29 HG23 VAL 29 30.812 22.790 21.992 224 H TYR 30 H TYR 30 32.993 21.672 26.025 225 HA TYR 30 HA TYR 30 34.102 24.273 26.882 226 HB2 TYR 30 HB2 TYR 30 35.472 21.590 26.479 227 HB3 TYR 30 HB3 TYR 30 36.155 23.006 27.243 228 HD1 TYR 30 HD1 TYR 30 33.795 20.179 27.668 229 HD2 TYR 30 HD2 TYR 30 35.543 23.651 29.537 230 HE1 TYR 30 HE1 TYR 30 33.018 19.377 29.894 231 HE2 TYR 30 HE2 TYR 30 34.778 22.840 31.759 232 HH TYR 30 HH TYR 30 33.811 21.124 32.919 233 H ASN 31 H ASN 31 34.214 22.105 24.057 234 HA ASN 31 HA ASN 31 35.135 24.303 22.329 235 HB2 ASN 31 HB2 ASN 31 36.911 22.806 21.307 236 HB3 ASN 31 HB3 ASN 31 37.278 23.509 22.869 237 HD21 ASN 31 HD21 ASN 31 36.733 19.439 22.721 238 HD22 ASN 31 HD22 ASN 31 35.576 20.503 21.908 Start of MODEL 16 1 H1 ALA 1 H1 ALA 1 8.676 26.210 21.866 2 H2 ALA 1 H2 ALA 1 8.929 25.598 23.374 3 H3 ALA 1 H3 ALA 1 9.334 24.710 22.053 4 HA ALA 1 HA ALA 1 10.541 27.322 22.602 5 HB1 ALA 1 HB1 ALA 1 12.460 26.159 23.607 6 HB2 ALA 1 HB2 ALA 1 10.986 25.862 24.544 7 HB3 ALA 1 HB3 ALA 1 11.616 24.600 23.458 8 H PHE 2 H PHE 2 12.399 27.749 21.255 9 HA PHE 2 HA PHE 2 13.034 25.819 19.076 10 HB2 PHE 2 HB2 PHE 2 12.197 28.696 18.569 11 HB3 PHE 2 HB3 PHE 2 12.783 27.553 17.365 12 HD1 PHE 2 HD1 PHE 2 9.874 28.801 19.104 13 HD2 PHE 2 HD2 PHE 2 11.440 25.366 17.036 14 HE1 PHE 2 HE1 PHE 2 7.586 27.909 18.855 15 HE2 PHE 2 HE2 PHE 2 9.149 24.451 16.805 16 HZ PHE 2 HZ PHE 2 7.207 25.716 17.735 17 H CYS 3 H CYS 3 15.191 25.874 18.487 18 HA CYS 3 HA CYS 3 17.065 27.056 20.221 19 HB2 CYS 3 HB2 CYS 3 17.158 25.696 17.545 20 HB3 CYS 3 HB3 CYS 3 18.579 26.592 18.022 21 H ASN 4 H ASN 4 18.516 28.695 20.167 22 HA ASN 4 HA ASN 4 18.947 30.251 17.732 23 HB2 ASN 4 HB2 ASN 4 17.306 31.606 19.036 24 HB3 ASN 4 HB3 ASN 4 18.386 31.587 20.402 25 HD21 ASN 4 HD21 ASN 4 19.878 33.150 17.054 26 HD22 ASN 4 HD22 ASN 4 18.303 32.340 17.009 27 H LEU 5 H LEU 5 21.001 29.806 17.396 28 HA LEU 5 HA LEU 5 22.785 28.661 19.215 29 HB2 LEU 5 HB2 LEU 5 22.786 29.068 16.564 30 HB3 LEU 5 HB3 LEU 5 23.905 30.357 16.989 31 HG LEU 5 HG LEU 5 24.170 27.379 17.588 32 HD11 LEU 5 HD11 LEU 5 24.525 28.036 15.220 33 HD12 LEU 5 HD12 LEU 5 25.762 29.207 15.734 34 HD13 LEU 5 HD13 LEU 5 26.019 27.466 15.973 35 HD21 LEU 5 HD21 LEU 5 25.311 28.515 19.390 36 HD22 LEU 5 HD22 LEU 5 26.521 27.921 18.261 37 HD23 LEU 5 HD23 LEU 5 26.093 29.644 18.250 38 H ARG 6 H ARG 6 22.538 32.160 18.359 39 HA ARG 6 HA ARG 6 24.591 32.956 20.222 40 HB2 ARG 6 HB2 ARG 6 22.387 34.415 18.736 41 HB3 ARG 6 HB3 ARG 6 23.255 35.251 20.013 42 HG2 ARG 6 HG2 ARG 6 24.527 33.959 17.557 43 HG3 ARG 6 HG3 ARG 6 24.286 35.684 17.834 44 HD2 ARG 6 HD2 ARG 6 26.189 33.837 19.333 45 HD3 ARG 6 HD3 ARG 6 26.585 35.174 18.267 46 HE ARG 6 HE ARG 6 25.036 36.362 20.254 47 HH11 ARG 6 HH11 ARG 6 27.945 34.362 20.624 48 HH12 ARG 6 HH12 ARG 6 28.644 35.552 21.706 49 HH21 ARG 6 HH21 ARG 6 26.049 37.731 21.601 50 HH22 ARG 6 HH22 ARG 6 27.626 37.330 22.253 51 H ARG 7 H ARG 7 21.025 32.768 20.821 52 HA ARG 7 HA ARG 7 21.302 33.686 23.509 53 HB2 ARG 7 HB2 ARG 7 19.127 33.412 22.343 54 HB3 ARG 7 HB3 ARG 7 19.341 31.653 22.337 55 HG2 ARG 7 HG2 ARG 7 19.089 31.476 24.676 56 HG3 ARG 7 HG3 ARG 7 19.281 33.200 24.933 57 HD2 ARG 7 HD2 ARG 7 16.952 32.545 25.236 58 HD3 ARG 7 HD3 ARG 7 17.153 33.685 23.904 59 HE ARG 7 HE ARG 7 16.293 32.135 22.445 60 HH11 ARG 7 HH11 ARG 7 17.196 30.186 25.278 61 HH12 ARG 7 HH12 ARG 7 16.334 28.816 24.583 62 HH21 ARG 7 HH21 ARG 7 15.346 30.374 21.757 63 HH22 ARG 7 HH22 ARG 7 15.341 28.906 22.746 64 H CYS 8 H CYS 8 21.835 30.493 22.090 65 HA CYS 8 HA CYS 8 22.235 29.079 24.553 66 HB2 CYS 8 HB2 CYS 8 21.653 28.055 22.372 67 HB3 CYS 8 HB3 CYS 8 23.249 28.464 21.761 68 H GLU 9 H GLU 9 24.642 30.602 22.309 69 HA GLU 9 HA GLU 9 26.970 29.998 23.847 70 HB2 GLU 9 HB2 GLU 9 26.338 32.415 22.092 71 HB3 GLU 9 HB3 GLU 9 27.904 32.130 22.861 72 HG2 GLU 9 HG2 GLU 9 27.956 29.866 21.717 73 HG3 GLU 9 HG3 GLU 9 26.583 30.402 20.747 74 H LEU 10 H LEU 10 24.737 32.776 24.188 75 HA LEU 10 HA LEU 10 26.151 33.966 26.423 76 HB2 LEU 10 HB2 LEU 10 23.325 34.265 25.323 77 HB3 LEU 10 HB3 LEU 10 23.968 35.257 26.629 78 HG LEU 10 HG LEU 10 25.152 35.153 23.822 79 HD11 LEU 10 HD11 LEU 10 22.887 36.130 23.844 80 HD12 LEU 10 HD12 LEU 10 23.366 37.234 25.151 81 HD13 LEU 10 HD13 LEU 10 24.115 37.365 23.545 82 HD21 LEU 10 HD21 LEU 10 25.693 36.972 26.213 83 HD22 LEU 10 HD22 LEU 10 26.835 35.828 25.469 84 HD23 LEU 10 HD23 LEU 10 26.298 37.245 24.569 85 H SER 11 H SER 11 23.681 31.453 26.212 86 HA SER 11 HA SER 11 23.034 31.417 29.038 87 HB2 SER 11 HB2 SER 11 21.491 30.418 27.470 88 HB3 SER 11 HB3 SER 11 22.736 29.308 26.865 89 HG SER 11 HG SER 11 21.291 28.383 28.452 90 H CYS 12 H CYS 12 25.178 29.344 27.003 91 HA CYS 12 HA CYS 12 26.277 27.872 29.152 92 HB2 CYS 12 HB2 CYS 12 27.406 28.532 26.410 93 HB3 CYS 12 HB3 CYS 12 28.051 27.299 27.498 94 H ARG 13 H ARG 13 27.271 31.073 27.947 95 HA ARG 13 HA ARG 13 29.784 31.214 29.297 96 HB2 ARG 13 HB2 ARG 13 28.973 32.741 27.515 97 HB3 ARG 13 HB3 ARG 13 27.851 33.470 28.650 98 HG2 ARG 13 HG2 ARG 13 29.811 34.201 30.061 99 HG3 ARG 13 HG3 ARG 13 30.894 33.368 28.937 100 HD2 ARG 13 HD2 ARG 13 31.028 35.617 28.317 101 HD3 ARG 13 HD3 ARG 13 29.960 34.896 27.101 102 HE ARG 13 HE ARG 13 28.346 35.917 29.230 103 HH11 ARG 13 HH11 ARG 13 30.331 37.174 26.597 104 HH12 ARG 13 HH12 ARG 13 29.543 38.739 26.660 105 HH21 ARG 13 HH21 ARG 13 27.659 38.032 29.434 106 HH22 ARG 13 HH22 ARG 13 28.219 39.233 28.300 107 H SER 14 H SER 14 26.557 31.374 30.665 108 HA SER 14 HA SER 14 27.189 32.541 33.226 109 HB2 SER 14 HB2 SER 14 24.893 32.160 32.278 110 HB3 SER 14 HB3 SER 14 25.142 30.420 32.496 111 HG SER 14 HG SER 14 24.681 32.417 34.368 112 H LEU 15 H LEU 15 27.469 29.237 31.956 113 HA LEU 15 HA LEU 15 28.568 28.137 34.461 114 HB2 LEU 15 HB2 LEU 15 28.565 26.932 31.669 115 HB3 LEU 15 HB3 LEU 15 28.813 26.093 33.196 116 HG LEU 15 HG LEU 15 26.218 27.327 32.172 117 HD11 LEU 15 HD11 LEU 15 25.437 25.009 32.097 118 HD12 LEU 15 HD12 LEU 15 26.869 25.222 31.080 119 HD13 LEU 15 HD13 LEU 15 27.018 24.434 32.670 120 HD21 LEU 15 HD21 LEU 15 26.751 25.846 34.788 121 HD22 LEU 15 HD22 LEU 15 26.269 27.553 34.617 122 HD23 LEU 15 HD23 LEU 15 25.149 26.277 34.145 123 H GLY 16 H GLY 16 29.700 29.481 31.425 124 HA2 GLY 16 HA2 GLY 16 31.873 30.598 31.294 125 HA3 GLY 16 HA3 GLY 16 32.572 29.311 32.278 126 H LEU 17 H LEU 17 30.276 28.465 29.758 127 HA LEU 17 HA LEU 17 32.453 27.098 28.238 128 HB2 LEU 17 HB2 LEU 17 29.557 26.278 28.531 129 HB3 LEU 17 HB3 LEU 17 30.856 25.323 27.813 130 HG LEU 17 HG LEU 17 30.447 26.046 30.715 131 HD11 LEU 17 HD11 LEU 17 30.181 23.607 31.020 132 HD12 LEU 17 HD12 LEU 17 28.946 24.314 29.982 133 HD13 LEU 17 HD13 LEU 17 30.295 23.387 29.262 134 HD21 LEU 17 HD21 LEU 17 32.662 24.361 29.450 135 HD22 LEU 17 HD22 LEU 17 32.895 25.935 30.245 136 HD23 LEU 17 HD23 LEU 17 32.376 24.546 31.196 137 H LEU 18 H LEU 18 31.570 26.327 26.054 138 HA LEU 18 HA LEU 18 30.504 28.639 24.479 139 HB2 LEU 18 HB2 LEU 18 31.914 26.056 23.712 140 HB3 LEU 18 HB3 LEU 18 31.159 27.118 22.529 141 HG LEU 18 HG LEU 18 33.412 27.989 24.393 142 HD11 LEU 18 HD11 LEU 18 34.851 27.798 22.412 143 HD12 LEU 18 HD12 LEU 18 34.135 26.235 22.804 144 HD13 LEU 18 HD13 LEU 18 33.488 27.190 21.452 145 HD21 LEU 18 HD21 LEU 18 32.074 29.901 23.613 146 HD22 LEU 18 HD22 LEU 18 33.625 29.868 22.779 147 HD23 LEU 18 HD23 LEU 18 32.169 29.308 21.936 148 H GLY 19 H GLY 19 28.778 28.132 22.937 149 HA2 GLY 19 HA2 GLY 19 27.016 25.863 23.785 150 HA3 GLY 19 HA3 GLY 19 26.377 27.481 23.546 151 H LYS 20 H LYS 20 25.774 24.908 22.230 152 HA LYS 20 HA LYS 20 25.575 25.958 19.475 153 HB2 LYS 20 HB2 LYS 20 26.877 23.278 20.142 154 HB3 LYS 20 HB3 LYS 20 26.026 23.554 18.637 155 HG2 LYS 20 HG2 LYS 20 27.998 24.144 17.822 156 HG3 LYS 20 HG3 LYS 20 27.641 25.715 18.526 157 HD2 LYS 20 HD2 LYS 20 28.923 24.919 20.605 158 HD3 LYS 20 HD3 LYS 20 29.409 23.501 19.677 159 HE2 LYS 20 HE2 LYS 20 29.912 26.388 18.819 160 HE3 LYS 20 HE3 LYS 20 31.073 25.425 19.744 161 HZ1 LYS 20 HZ1 LYS 20 31.577 25.382 17.403 162 HZ2 LYS 20 HZ2 LYS 20 31.147 23.860 17.879 163 HZ3 LYS 20 HZ3 LYS 20 30.101 24.771 17.012 164 H CYS 21 H CYS 21 23.818 25.041 18.299 165 HA CYS 21 HA CYS 21 21.703 23.801 20.001 166 HB2 CYS 21 HB2 CYS 21 20.990 25.670 18.590 167 HB3 CYS 21 HB3 CYS 21 21.603 24.832 17.161 168 H ILE 22 H ILE 22 21.734 21.629 20.145 169 HA ILE 22 HA ILE 22 22.428 19.964 17.763 170 HB ILE 22 HB ILE 22 23.542 19.539 20.560 171 HG12 ILE 22 HG12 ILE 22 24.952 20.368 17.978 172 HG13 ILE 22 HG13 ILE 22 24.689 21.391 19.391 173 HG21 ILE 22 HG21 ILE 22 23.012 17.408 19.379 174 HG22 ILE 22 HG22 ILE 22 23.973 17.948 17.982 175 HG23 ILE 22 HG23 ILE 22 24.738 17.625 19.552 176 HD11 ILE 22 HD11 ILE 22 26.097 19.849 20.760 177 HD12 ILE 22 HD12 ILE 22 26.515 18.982 19.258 178 HD13 ILE 22 HD13 ILE 22 26.953 20.683 19.447 179 H GLY 23 H GLY 23 20.647 18.915 17.301 180 HA2 GLY 23 HA2 GLY 23 18.953 17.329 17.531 181 HA3 GLY 23 HA3 GLY 23 19.249 17.219 19.273 182 H GLU 24 H GLU 24 18.717 20.243 17.507 183 HA GLU 24 HA GLU 24 17.420 22.031 17.998 184 HB2 GLU 24 HB2 GLU 24 15.120 20.074 18.110 185 HB3 GLU 24 HB3 GLU 24 15.054 21.822 17.860 186 HG2 GLU 24 HG2 GLU 24 16.797 21.219 15.879 187 HG3 GLU 24 HG3 GLU 24 15.964 19.664 15.970 188 H GLU 25 H GLU 25 18.887 21.147 20.085 189 HA GLU 25 HA GLU 25 17.501 22.453 22.353 190 HB2 GLU 25 HB2 GLU 25 19.045 19.821 22.378 191 HB3 GLU 25 HB3 GLU 25 18.931 20.815 23.817 192 HG2 GLU 25 HG2 GLU 25 16.583 19.592 22.340 193 HG3 GLU 25 HG3 GLU 25 17.304 18.993 23.835 194 H CYS 26 H CYS 26 18.862 23.802 23.566 195 HA CYS 26 HA CYS 26 21.538 24.378 22.530 196 HB2 CYS 26 HB2 CYS 26 20.244 26.171 23.516 197 HB3 CYS 26 HB3 CYS 26 20.026 25.255 25.007 198 H LYS 27 H LYS 27 23.405 23.445 23.109 199 HA LYS 27 HA LYS 27 23.687 22.149 25.767 200 HB2 LYS 27 HB2 LYS 27 24.440 20.884 23.096 201 HB3 LYS 27 HB3 LYS 27 25.199 20.436 24.625 202 HG2 LYS 27 HG2 LYS 27 22.864 19.943 25.542 203 HG3 LYS 27 HG3 LYS 27 22.248 20.170 23.912 204 HD2 LYS 27 HD2 LYS 27 22.598 17.782 24.502 205 HD3 LYS 27 HD3 LYS 27 23.504 18.291 23.081 206 HE2 LYS 27 HE2 LYS 27 24.824 16.786 24.511 207 HE3 LYS 27 HE3 LYS 27 25.583 18.362 24.327 208 HZ1 LYS 27 HZ1 LYS 27 24.673 18.954 26.554 209 HZ2 LYS 27 HZ2 LYS 27 24.097 17.426 26.736 210 HZ3 LYS 27 HZ3 LYS 27 25.695 17.680 26.616 211 H CYS 28 H CYS 28 25.757 22.163 26.642 212 HA CYS 28 HA CYS 28 27.513 24.243 25.441 213 HB2 CYS 28 HB2 CYS 28 27.550 23.422 28.335 214 HB3 CYS 28 HB3 CYS 28 28.285 24.823 27.607 215 H VAL 29 H VAL 29 29.727 24.039 25.352 216 HA VAL 29 HA VAL 29 30.863 21.289 25.674 217 HB VAL 29 HB VAL 29 31.800 21.427 23.420 218 HG11 VAL 29 HG11 VAL 29 29.818 20.871 22.180 219 HG12 VAL 29 HG12 VAL 29 29.635 20.273 23.834 220 HG13 VAL 29 HG13 VAL 29 28.777 21.744 23.323 221 HG21 VAL 29 HG21 VAL 29 30.100 23.930 23.068 222 HG22 VAL 29 HG22 VAL 29 31.878 23.822 23.001 223 HG23 VAL 29 HG23 VAL 29 30.893 23.030 21.766 224 H TYR 30 H TYR 30 33.089 21.052 25.624 225 HA TYR 30 HA TYR 30 34.655 23.426 26.513 226 HB2 TYR 30 HB2 TYR 30 35.176 20.444 26.802 227 HB3 TYR 30 HB3 TYR 30 36.201 21.724 27.410 228 HD1 TYR 30 HD1 TYR 30 32.895 20.045 27.838 229 HD2 TYR 30 HD2 TYR 30 35.723 22.858 29.485 230 HE1 TYR 30 HE1 TYR 30 31.600 20.110 29.968 231 HE2 TYR 30 HE2 TYR 30 34.451 22.880 31.623 232 HH TYR 30 HH TYR 30 32.726 21.951 32.813 233 H ASN 31 H ASN 31 34.395 21.185 23.820 234 HA ASN 31 HA ASN 31 36.983 22.168 22.664 235 HB2 ASN 31 HB2 ASN 31 35.869 19.354 22.368 236 HB3 ASN 31 HB3 ASN 31 37.378 19.976 21.731 237 HD21 ASN 31 HD21 ASN 31 38.259 19.867 25.561 238 HD22 ASN 31 HD22 ASN 31 37.650 21.269 24.674 Start of MODEL 17 1 H1 ALA 1 H1 ALA 1 9.705 22.399 20.553 2 H2 ALA 1 H2 ALA 1 9.118 23.053 19.158 3 H3 ALA 1 H3 ALA 1 8.459 23.465 20.603 4 HA ALA 1 HA ALA 1 9.806 25.224 19.792 5 HB1 ALA 1 HB1 ALA 1 11.195 25.586 21.776 6 HB2 ALA 1 HB2 ALA 1 9.656 24.860 22.267 7 HB3 ALA 1 HB3 ALA 1 11.124 23.862 22.184 8 H PHE 2 H PHE 2 11.999 26.066 19.415 9 HA PHE 2 HA PHE 2 13.913 24.083 18.299 10 HB2 PHE 2 HB2 PHE 2 13.161 26.733 17.029 11 HB3 PHE 2 HB3 PHE 2 14.303 25.551 16.405 12 HD1 PHE 2 HD1 PHE 2 13.018 22.990 16.460 13 HD2 PHE 2 HD2 PHE 2 11.251 26.845 15.667 14 HE1 PHE 2 HE1 PHE 2 11.192 21.895 15.223 15 HE2 PHE 2 HE2 PHE 2 9.428 25.740 14.394 16 HZ PHE 2 HZ PHE 2 9.396 23.258 14.150 17 H CYS 3 H CYS 3 16.142 24.906 18.250 18 HA CYS 3 HA CYS 3 16.696 26.530 20.643 19 HB2 CYS 3 HB2 CYS 3 17.752 24.405 20.413 20 HB3 CYS 3 HB3 CYS 3 18.374 24.787 18.814 21 H ASN 4 H ASN 4 18.415 28.206 20.596 22 HA ASN 4 HA ASN 4 18.681 29.686 18.039 23 HB2 ASN 4 HB2 ASN 4 18.159 31.174 20.617 24 HB3 ASN 4 HB3 ASN 4 18.054 31.748 18.954 25 HD21 ASN 4 HD21 ASN 4 14.756 30.181 18.567 26 HD22 ASN 4 HD22 ASN 4 16.260 30.330 17.643 27 H LEU 5 H LEU 5 20.741 29.481 17.687 28 HA LEU 5 HA LEU 5 22.659 28.579 19.492 29 HB2 LEU 5 HB2 LEU 5 22.467 28.838 16.821 30 HB3 LEU 5 HB3 LEU 5 23.554 30.178 17.106 31 HG LEU 5 HG LEU 5 24.005 27.262 17.916 32 HD11 LEU 5 HD11 LEU 5 24.019 27.642 15.490 33 HD12 LEU 5 HD12 LEU 5 25.166 28.983 15.693 34 HD13 LEU 5 HD13 LEU 5 25.651 27.310 16.071 35 HD21 LEU 5 HD21 LEU 5 25.875 29.663 18.085 36 HD22 LEU 5 HD22 LEU 5 25.299 28.664 19.435 37 HD23 LEU 5 HD23 LEU 5 26.394 27.972 18.242 38 H ARG 6 H ARG 6 22.148 31.982 18.484 39 HA ARG 6 HA ARG 6 24.412 33.089 19.857 40 HB2 ARG 6 HB2 ARG 6 23.116 34.238 18.072 41 HB3 ARG 6 HB3 ARG 6 21.736 34.393 19.169 42 HG2 ARG 6 HG2 ARG 6 23.041 35.840 20.670 43 HG3 ARG 6 HG3 ARG 6 24.504 35.547 19.717 44 HD2 ARG 6 HD2 ARG 6 23.595 37.722 19.222 45 HD3 ARG 6 HD3 ARG 6 23.520 36.691 17.787 46 HE ARG 6 HE ARG 6 20.994 36.411 18.942 47 HH11 ARG 6 HH11 ARG 6 22.804 39.265 17.832 48 HH12 ARG 6 HH12 ARG 6 21.311 39.965 17.219 49 HH21 ARG 6 HH21 ARG 6 19.245 37.481 18.221 50 HH22 ARG 6 HH22 ARG 6 19.441 39.064 17.464 51 H ARG 7 H ARG 7 21.082 32.561 20.954 52 HA ARG 7 HA ARG 7 21.547 33.720 23.600 53 HB2 ARG 7 HB2 ARG 7 19.305 33.702 22.518 54 HB3 ARG 7 HB3 ARG 7 19.286 31.941 22.585 55 HG2 ARG 7 HG2 ARG 7 17.927 32.953 24.383 56 HG3 ARG 7 HG3 ARG 7 19.235 31.964 25.018 57 HD2 ARG 7 HD2 ARG 7 19.054 33.940 26.367 58 HD3 ARG 7 HD3 ARG 7 20.568 34.016 25.490 59 HE ARG 7 HE ARG 7 18.481 35.422 24.035 60 HH11 ARG 7 HH11 ARG 7 20.498 35.852 26.911 61 HH12 ARG 7 HH12 ARG 7 20.332 37.610 26.771 62 HH21 ARG 7 HH21 ARG 7 18.401 37.629 24.012 63 HH22 ARG 7 HH22 ARG 7 19.231 38.528 25.293 64 H CYS 8 H CYS 8 21.514 30.407 22.286 65 HA CYS 8 HA CYS 8 22.026 28.987 24.684 66 HB2 CYS 8 HB2 CYS 8 21.437 27.930 22.577 67 HB3 CYS 8 HB3 CYS 8 22.901 28.528 21.815 68 H GLU 9 H GLU 9 24.404 30.471 22.403 69 HA GLU 9 HA GLU 9 26.756 29.970 23.921 70 HB2 GLU 9 HB2 GLU 9 25.922 32.044 21.902 71 HB3 GLU 9 HB3 GLU 9 27.439 32.263 22.762 72 HG2 GLU 9 HG2 GLU 9 26.963 29.550 21.566 73 HG3 GLU 9 HG3 GLU 9 27.242 30.887 20.450 74 H LEU 10 H LEU 10 24.497 32.785 24.260 75 HA LEU 10 HA LEU 10 26.077 34.049 26.308 76 HB2 LEU 10 HB2 LEU 10 23.123 34.249 25.608 77 HB3 LEU 10 HB3 LEU 10 23.910 35.275 26.802 78 HG LEU 10 HG LEU 10 24.727 35.165 23.879 79 HD11 LEU 10 HD11 LEU 10 22.978 37.190 25.322 80 HD12 LEU 10 HD12 LEU 10 23.546 37.299 23.640 81 HD13 LEU 10 HD13 LEU 10 22.429 36.009 24.109 82 HD21 LEU 10 HD21 LEU 10 25.399 37.162 26.078 83 HD22 LEU 10 HD22 LEU 10 26.523 35.990 25.353 84 HD23 LEU 10 HD23 LEU 10 25.862 37.297 24.369 85 H SER 11 H SER 11 23.360 31.728 26.506 86 HA SER 11 HA SER 11 23.301 31.686 29.366 87 HB2 SER 11 HB2 SER 11 22.410 29.589 27.350 88 HB3 SER 11 HB3 SER 11 22.108 29.503 29.096 89 HG SER 11 HG SER 11 21.129 31.651 28.849 90 H CYS 12 H CYS 12 25.128 29.606 27.048 91 HA CYS 12 HA CYS 12 26.349 28.027 29.133 92 HB2 CYS 12 HB2 CYS 12 27.280 28.619 26.312 93 HB3 CYS 12 HB3 CYS 12 27.956 27.390 27.379 94 H ARG 13 H ARG 13 27.350 31.112 27.540 95 HA ARG 13 HA ARG 13 29.921 31.321 28.596 96 HB2 ARG 13 HB2 ARG 13 28.589 32.883 26.948 97 HB3 ARG 13 HB3 ARG 13 28.018 33.694 28.395 98 HG2 ARG 13 HG2 ARG 13 29.887 34.920 27.573 99 HG3 ARG 13 HG3 ARG 13 30.432 34.090 29.025 100 HD2 ARG 13 HD2 ARG 13 32.173 33.889 27.412 101 HD3 ARG 13 HD3 ARG 13 31.448 32.293 27.502 102 HE ARG 13 HE ARG 13 31.241 34.277 25.290 103 HH11 ARG 13 HH11 ARG 13 30.325 30.921 26.238 104 HH12 ARG 13 HH12 ARG 13 29.848 30.663 24.565 105 HH21 ARG 13 HH21 ARG 13 30.509 33.604 23.275 106 HH22 ARG 13 HH22 ARG 13 30.096 31.900 23.100 107 H SER 14 H SER 14 26.880 32.059 30.246 108 HA SER 14 HA SER 14 28.046 33.123 32.652 109 HB2 SER 14 HB2 SER 14 25.680 33.454 31.994 110 HB3 SER 14 HB3 SER 14 25.386 31.723 32.240 111 HG SER 14 HG SER 14 26.038 33.715 34.171 112 H LEU 15 H LEU 15 27.477 29.787 31.574 113 HA LEU 15 HA LEU 15 28.185 28.606 34.173 114 HB2 LEU 15 HB2 LEU 15 27.963 27.289 31.441 115 HB3 LEU 15 HB3 LEU 15 28.003 26.484 33.002 116 HG LEU 15 HG LEU 15 25.762 28.237 31.924 117 HD11 LEU 15 HD11 LEU 15 25.893 25.246 32.474 118 HD12 LEU 15 HD12 LEU 15 24.486 26.150 31.874 119 HD13 LEU 15 HD13 LEU 15 25.936 26.014 30.871 120 HD21 LEU 15 HD21 LEU 15 25.960 26.728 34.564 121 HD22 LEU 15 HD22 LEU 15 25.852 28.490 34.342 122 HD23 LEU 15 HD23 LEU 15 24.480 27.469 33.909 123 H GLY 16 H GLY 16 29.975 29.997 31.634 124 HA2 GLY 16 HA2 GLY 16 32.314 30.300 31.599 125 HA3 GLY 16 HA3 GLY 16 32.548 28.834 32.566 126 H LEU 17 H LEU 17 30.278 28.613 29.961 127 HA LEU 17 HA LEU 17 32.137 26.831 28.493 128 HB2 LEU 17 HB2 LEU 17 29.140 26.595 28.829 129 HB3 LEU 17 HB3 LEU 17 30.200 25.394 28.108 130 HG LEU 17 HG LEU 17 29.929 26.233 30.976 131 HD11 LEU 17 HD11 LEU 17 29.239 23.903 31.362 132 HD12 LEU 17 HD12 LEU 17 28.188 24.740 30.219 133 HD13 LEU 17 HD13 LEU 17 29.407 23.576 29.630 134 HD21 LEU 17 HD21 LEU 17 31.927 24.235 29.807 135 HD22 LEU 17 HD22 LEU 17 32.312 25.719 30.693 136 HD23 LEU 17 HD23 LEU 17 31.557 24.376 31.539 137 H LEU 18 H LEU 18 31.293 26.289 26.227 138 HA LEU 18 HA LEU 18 30.289 28.735 24.802 139 HB2 LEU 18 HB2 LEU 18 31.599 26.338 23.534 140 HB3 LEU 18 HB3 LEU 18 31.151 27.867 22.772 141 HG LEU 18 HG LEU 18 33.387 27.419 24.809 142 HD11 LEU 18 HD11 LEU 18 33.841 26.603 22.505 143 HD12 LEU 18 HD12 LEU 18 33.470 28.221 21.874 144 HD13 LEU 18 HD13 LEU 18 34.865 27.977 22.945 145 HD21 LEU 18 HD21 LEU 18 32.479 29.991 23.459 146 HD22 LEU 18 HD22 LEU 18 32.502 29.642 25.202 147 HD23 LEU 18 HD23 LEU 18 34.021 29.791 24.320 148 H GLY 19 H GLY 19 28.541 28.533 23.406 149 HA2 GLY 19 HA2 GLY 19 26.806 26.139 23.920 150 HA3 GLY 19 HA3 GLY 19 26.243 27.726 23.432 151 H LYS 20 H LYS 20 25.885 24.953 22.369 152 HA LYS 20 HA LYS 20 25.843 25.809 19.542 153 HB2 LYS 20 HB2 LYS 20 26.986 23.122 20.454 154 HB3 LYS 20 HB3 LYS 20 26.364 23.434 18.842 155 HG2 LYS 20 HG2 LYS 20 28.461 23.925 18.305 156 HG3 LYS 20 HG3 LYS 20 28.110 25.508 18.983 157 HD2 LYS 20 HD2 LYS 20 29.096 24.656 21.189 158 HD3 LYS 20 HD3 LYS 20 29.497 23.154 20.330 159 HE2 LYS 20 HE2 LYS 20 30.757 24.596 18.633 160 HE3 LYS 20 HE3 LYS 20 30.529 25.958 19.739 161 HZ1 LYS 20 HZ1 LYS 20 31.969 23.440 20.283 162 HZ2 LYS 20 HZ2 LYS 20 32.663 24.924 20.164 163 HZ3 LYS 20 HZ3 LYS 20 31.673 24.529 21.450 164 H CYS 21 H CYS 21 24.028 25.014 18.445 165 HA CYS 21 HA CYS 21 21.895 23.774 20.125 166 HB2 CYS 21 HB2 CYS 21 21.889 24.893 17.301 167 HB3 CYS 21 HB3 CYS 21 20.514 24.098 18.060 168 H ILE 22 H ILE 22 21.593 21.633 20.110 169 HA ILE 22 HA ILE 22 22.565 19.908 17.867 170 HB ILE 22 HB ILE 22 22.974 19.530 20.859 171 HG12 ILE 22 HG12 ILE 22 24.603 21.131 19.954 172 HG13 ILE 22 HG13 ILE 22 25.335 19.653 20.519 173 HG21 ILE 22 HG21 ILE 22 23.636 17.658 18.555 174 HG22 ILE 22 HG22 ILE 22 24.260 17.476 20.208 175 HG23 ILE 22 HG23 ILE 22 22.527 17.368 19.912 176 HD11 ILE 22 HD11 ILE 22 24.811 20.263 17.573 177 HD12 ILE 22 HD12 ILE 22 26.349 20.494 18.421 178 HD13 ILE 22 HD13 ILE 22 25.687 18.863 18.229 179 H GLY 23 H GLY 23 20.946 18.509 17.199 180 HA2 GLY 23 HA2 GLY 23 18.812 17.600 17.099 181 HA3 GLY 23 HA3 GLY 23 19.083 17.150 18.785 182 H GLU 24 H GLU 24 18.504 20.288 17.139 183 HA GLU 24 HA GLU 24 17.432 22.133 17.734 184 HB2 GLU 24 HB2 GLU 24 15.111 20.282 18.237 185 HB3 GLU 24 HB3 GLU 24 15.047 21.952 17.677 186 HG2 GLU 24 HG2 GLU 24 16.213 19.603 16.099 187 HG3 GLU 24 HG3 GLU 24 14.627 20.275 15.905 188 H GLU 25 H GLU 25 18.767 20.886 20.147 189 HA GLU 25 HA GLU 25 17.583 22.853 22.026 190 HB2 GLU 25 HB2 GLU 25 16.650 20.716 22.677 191 HB3 GLU 25 HB3 GLU 25 18.259 19.984 22.756 192 HG2 GLU 25 HG2 GLU 25 18.899 21.386 24.622 193 HG3 GLU 25 HG3 GLU 25 17.454 22.387 24.440 194 H CYS 26 H CYS 26 19.008 23.908 23.387 195 HA CYS 26 HA CYS 26 21.703 24.184 22.551 196 HB2 CYS 26 HB2 CYS 26 20.375 25.923 23.664 197 HB3 CYS 26 HB3 CYS 26 20.317 24.950 25.131 198 H LYS 27 H LYS 27 23.570 23.315 23.119 199 HA LYS 27 HA LYS 27 23.912 21.731 25.610 200 HB2 LYS 27 HB2 LYS 27 23.526 20.107 23.791 201 HB3 LYS 27 HB3 LYS 27 24.725 20.920 22.798 202 HG2 LYS 27 HG2 LYS 27 25.740 18.937 23.569 203 HG3 LYS 27 HG3 LYS 27 26.509 20.289 24.384 204 HD2 LYS 27 HD2 LYS 27 26.247 18.618 26.017 205 HD3 LYS 27 HD3 LYS 27 24.991 19.812 26.377 206 HE2 LYS 27 HE2 LYS 27 23.296 18.375 25.284 207 HE3 LYS 27 HE3 LYS 27 24.556 17.241 24.799 208 HZ1 LYS 27 HZ1 LYS 27 25.000 16.823 27.186 209 HZ2 LYS 27 HZ2 LYS 27 23.747 17.817 27.606 210 HZ3 LYS 27 HZ3 LYS 27 23.492 16.432 26.785 211 H CYS 28 H CYS 28 25.711 22.326 26.691 212 HA CYS 28 HA CYS 28 27.425 24.392 25.468 213 HB2 CYS 28 HB2 CYS 28 27.271 23.454 28.335 214 HB3 CYS 28 HB3 CYS 28 28.108 24.871 27.735 215 H VAL 29 H VAL 29 29.184 23.651 24.401 216 HA VAL 29 HA VAL 29 31.081 21.825 25.696 217 HB VAL 29 HB VAL 29 31.396 20.436 23.671 218 HG11 VAL 29 HG11 VAL 29 28.716 20.051 25.039 219 HG12 VAL 29 HG12 VAL 29 29.683 18.817 24.214 220 HG13 VAL 29 HG13 VAL 29 30.295 19.569 25.694 221 HG21 VAL 29 HG21 VAL 29 28.639 21.441 22.848 222 HG22 VAL 29 HG22 VAL 29 30.174 21.712 21.987 223 HG23 VAL 29 HG23 VAL 29 29.522 20.081 22.123 224 H TYR 30 H TYR 30 33.154 22.238 25.232 225 HA TYR 30 HA TYR 30 33.836 24.567 23.663 226 HB2 TYR 30 HB2 TYR 30 35.623 22.402 24.821 227 HB3 TYR 30 HB3 TYR 30 36.160 23.946 24.182 228 HD1 TYR 30 HD1 TYR 30 35.112 22.212 27.153 229 HD2 TYR 30 HD2 TYR 30 35.239 26.118 25.323 230 HE1 TYR 30 HE1 TYR 30 34.920 23.274 29.391 231 HE2 TYR 30 HE2 TYR 30 34.980 27.174 27.572 232 HH TYR 30 HH TYR 30 34.432 26.730 29.863 233 H ASN 31 H ASN 31 33.612 21.151 22.900 234 HA ASN 31 HA ASN 31 35.175 20.992 20.562 235 HB2 ASN 31 HB2 ASN 31 34.324 19.110 22.004 236 HB3 ASN 31 HB3 ASN 31 32.675 19.440 21.444 237 HD21 ASN 31 HD21 ASN 31 35.206 17.984 18.565 238 HD22 ASN 31 HD22 ASN 31 35.719 19.350 19.531 Start of MODEL 18 1 H1 ALA 1 H1 ALA 1 11.430 20.642 17.935 2 H2 ALA 1 H2 ALA 1 10.154 21.549 17.515 3 H3 ALA 1 H3 ALA 1 10.096 20.702 18.930 4 HA ALA 1 HA ALA 1 10.437 23.032 19.316 5 HB1 ALA 1 HB1 ALA 1 12.330 22.807 20.835 6 HB2 ALA 1 HB2 ALA 1 11.372 21.337 20.868 7 HB3 ALA 1 HB3 ALA 1 12.913 21.364 19.976 8 H PHE 2 H PHE 2 12.336 24.652 19.539 9 HA PHE 2 HA PHE 2 13.861 24.973 16.999 10 HB2 PHE 2 HB2 PHE 2 12.026 26.981 18.347 11 HB3 PHE 2 HB3 PHE 2 13.149 27.360 17.055 12 HD1 PHE 2 HD1 PHE 2 12.820 26.535 14.766 13 HD2 PHE 2 HD2 PHE 2 9.971 25.657 17.883 14 HE1 PHE 2 HE1 PHE 2 11.204 25.754 13.072 15 HE2 PHE 2 HE2 PHE 2 8.339 24.901 16.168 16 HZ PHE 2 HZ PHE 2 8.948 24.956 13.759 17 H CYS 3 H CYS 3 15.772 26.257 17.214 18 HA CYS 3 HA CYS 3 16.553 27.080 19.955 19 HB2 CYS 3 HB2 CYS 3 18.709 26.053 19.557 20 HB3 CYS 3 HB3 CYS 3 17.421 24.868 19.529 21 H ASN 4 H ASN 4 18.562 28.393 19.960 22 HA ASN 4 HA ASN 4 19.050 30.152 17.619 23 HB2 ASN 4 HB2 ASN 4 18.111 31.093 20.358 24 HB3 ASN 4 HB3 ASN 4 18.757 32.143 19.104 25 HD21 ASN 4 HD21 ASN 4 15.697 32.350 17.373 26 HD22 ASN 4 HD22 ASN 4 17.369 32.842 17.420 27 H LEU 5 H LEU 5 21.147 29.527 17.432 28 HA LEU 5 HA LEU 5 22.881 28.620 19.379 29 HB2 LEU 5 HB2 LEU 5 22.943 28.903 16.675 30 HB3 LEU 5 HB3 LEU 5 24.084 30.178 17.105 31 HG LEU 5 HG LEU 5 24.267 27.233 17.891 32 HD11 LEU 5 HD11 LEU 5 25.888 28.849 15.895 33 HD12 LEU 5 HD12 LEU 5 26.106 27.128 16.288 34 HD13 LEU 5 HD13 LEU 5 24.620 27.672 15.480 35 HD21 LEU 5 HD21 LEU 5 25.432 28.505 19.592 36 HD22 LEU 5 HD22 LEU 5 26.635 27.789 18.512 37 HD23 LEU 5 HD23 LEU 5 26.226 29.505 18.354 38 H ARG 6 H ARG 6 22.508 32.020 18.341 39 HA ARG 6 HA ARG 6 24.640 33.161 19.877 40 HB2 ARG 6 HB2 ARG 6 23.427 34.344 18.074 41 HB3 ARG 6 HB3 ARG 6 21.943 34.300 19.012 42 HG2 ARG 6 HG2 ARG 6 22.744 36.491 19.133 43 HG3 ARG 6 HG3 ARG 6 23.039 35.805 20.729 44 HD2 ARG 6 HD2 ARG 6 25.124 36.052 18.517 45 HD3 ARG 6 HD3 ARG 6 24.842 37.294 19.725 46 HE ARG 6 HE ARG 6 25.957 34.563 20.224 47 HH11 ARG 6 HH11 ARG 6 25.347 37.723 21.649 48 HH12 ARG 6 HH12 ARG 6 26.777 37.586 22.642 49 HH21 ARG 6 HH21 ARG 6 27.568 34.416 21.537 50 HH22 ARG 6 HH22 ARG 6 27.836 35.617 22.808 51 H ARG 7 H ARG 7 21.250 32.502 20.796 52 HA ARG 7 HA ARG 7 21.471 33.671 23.433 53 HB2 ARG 7 HB2 ARG 7 19.464 31.684 22.257 54 HB3 ARG 7 HB3 ARG 7 19.260 32.638 23.720 55 HG2 ARG 7 HG2 ARG 7 19.314 34.739 22.321 56 HG3 ARG 7 HG3 ARG 7 19.389 33.708 20.880 57 HD2 ARG 7 HD2 ARG 7 17.267 32.546 21.881 58 HD3 ARG 7 HD3 ARG 7 17.140 33.999 22.888 59 HE ARG 7 HE ARG 7 17.456 34.861 20.201 60 HH11 ARG 7 HH11 ARG 7 15.065 32.846 21.826 61 HH12 ARG 7 HH12 ARG 7 13.805 33.356 20.705 62 HH21 ARG 7 HH21 ARG 7 15.801 35.589 19.038 63 HH22 ARG 7 HH22 ARG 7 14.227 34.819 19.105 64 H CYS 8 H CYS 8 21.641 30.377 22.110 65 HA CYS 8 HA CYS 8 22.012 28.953 24.542 66 HB2 CYS 8 HB2 CYS 8 21.518 27.940 22.369 67 HB3 CYS 8 HB3 CYS 8 23.058 28.472 21.732 68 H GLU 9 H GLU 9 24.498 30.485 22.409 69 HA GLU 9 HA GLU 9 26.798 29.902 24.012 70 HB2 GLU 9 HB2 GLU 9 26.064 32.062 22.029 71 HB3 GLU 9 HB3 GLU 9 27.595 32.141 22.884 72 HG2 GLU 9 HG2 GLU 9 26.954 29.503 21.611 73 HG3 GLU 9 HG3 GLU 9 27.242 30.834 20.506 74 H LEU 10 H LEU 10 24.529 32.683 24.242 75 HA LEU 10 HA LEU 10 25.908 33.908 26.467 76 HB2 LEU 10 HB2 LEU 10 23.090 34.140 25.350 77 HB3 LEU 10 HB3 LEU 10 23.647 35.103 26.707 78 HG LEU 10 HG LEU 10 24.974 35.114 23.962 79 HD11 LEU 10 HD11 LEU 10 23.866 37.312 23.715 80 HD12 LEU 10 HD12 LEU 10 22.694 35.993 23.835 81 HD13 LEU 10 HD13 LEU 10 22.997 37.049 25.237 82 HD21 LEU 10 HD21 LEU 10 25.972 37.253 24.814 83 HD22 LEU 10 HD22 LEU 10 25.288 36.904 26.410 84 HD23 LEU 10 HD23 LEU 10 26.526 35.840 25.712 85 H SER 11 H SER 11 23.408 31.400 26.314 86 HA SER 11 HA SER 11 22.846 31.351 29.127 87 HB2 SER 11 HB2 SER 11 21.379 30.302 27.427 88 HB3 SER 11 HB3 SER 11 22.640 29.097 27.096 89 HG SER 11 HG SER 11 21.067 29.483 29.403 90 H CYS 12 H CYS 12 25.182 29.543 27.115 91 HA CYS 12 HA CYS 12 26.353 28.062 29.302 92 HB2 CYS 12 HB2 CYS 12 27.400 28.684 26.522 93 HB3 CYS 12 HB3 CYS 12 28.048 27.471 27.619 94 H ARG 13 H ARG 13 27.066 31.245 27.901 95 HA ARG 13 HA ARG 13 29.624 31.764 28.847 96 HB2 ARG 13 HB2 ARG 13 27.835 33.252 27.545 97 HB3 ARG 13 HB3 ARG 13 27.421 33.828 29.141 98 HG2 ARG 13 HG2 ARG 13 29.051 35.364 28.772 99 HG3 ARG 13 HG3 ARG 13 30.180 34.083 29.222 100 HD2 ARG 13 HD2 ARG 13 29.306 34.945 26.447 101 HD3 ARG 13 HD3 ARG 13 30.923 35.081 27.148 102 HE ARG 13 HE ARG 13 30.964 32.547 27.159 103 HH11 ARG 13 HH11 ARG 13 29.465 34.354 24.569 104 HH12 ARG 13 HH12 ARG 13 29.619 33.009 23.466 105 HH21 ARG 13 HH21 ARG 13 30.563 30.752 25.893 106 HH22 ARG 13 HH22 ARG 13 30.019 30.968 24.245 107 H SER 14 H SER 14 26.626 31.947 30.761 108 HA SER 14 HA SER 14 27.684 32.907 33.205 109 HB2 SER 14 HB2 SER 14 25.469 30.860 32.819 110 HB3 SER 14 HB3 SER 14 25.680 31.958 34.198 111 HG SER 14 HG SER 14 25.331 33.706 32.823 112 H LEU 15 H LEU 15 27.742 29.650 31.865 113 HA LEU 15 HA LEU 15 28.722 28.361 34.311 114 HB2 LEU 15 HB2 LEU 15 28.601 27.266 31.483 115 HB3 LEU 15 HB3 LEU 15 28.669 26.349 32.989 116 HG LEU 15 HG LEU 15 26.312 28.015 31.983 117 HD11 LEU 15 HD11 LEU 15 25.212 25.855 31.697 118 HD12 LEU 15 HD12 LEU 15 26.685 25.955 30.716 119 HD13 LEU 15 HD13 LEU 15 26.690 25.016 32.228 120 HD21 LEU 15 HD21 LEU 15 26.494 26.199 34.414 121 HD22 LEU 15 HD22 LEU 15 26.398 27.974 34.471 122 HD23 LEU 15 HD23 LEU 15 25.049 27.032 33.821 123 H GLY 16 H GLY 16 30.075 29.900 31.486 124 HA2 GLY 16 HA2 GLY 16 32.349 30.506 31.211 125 HA3 GLY 16 HA3 GLY 16 32.869 29.191 32.272 126 H LEU 17 H LEU 17 30.438 28.690 29.766 127 HA LEU 17 HA LEU 17 32.330 26.925 28.277 128 HB2 LEU 17 HB2 LEU 17 29.376 26.509 28.800 129 HB3 LEU 17 HB3 LEU 17 30.432 25.402 27.938 130 HG LEU 17 HG LEU 17 30.449 26.132 30.852 131 HD11 LEU 17 HD11 LEU 17 29.790 23.518 29.476 132 HD12 LEU 17 HD12 LEU 17 29.819 23.797 31.228 133 HD13 LEU 17 HD13 LEU 17 28.634 24.643 30.234 134 HD21 LEU 17 HD21 LEU 17 32.225 24.108 29.402 135 HD22 LEU 17 HD22 LEU 17 32.796 25.630 30.129 136 HD23 LEU 17 HD23 LEU 17 32.164 24.348 31.160 137 H LEU 18 H LEU 18 31.392 26.272 26.104 138 HA LEU 18 HA LEU 18 30.367 28.668 24.624 139 HB2 LEU 18 HB2 LEU 18 31.610 26.153 23.471 140 HB3 LEU 18 HB3 LEU 18 31.044 27.567 22.598 141 HG LEU 18 HG LEU 18 33.366 27.653 22.564 142 HD11 LEU 18 HD11 LEU 18 32.629 29.591 24.783 143 HD12 LEU 18 HD12 LEU 18 33.938 29.748 23.596 144 HD13 LEU 18 HD13 LEU 18 32.248 29.828 23.062 145 HD21 LEU 18 HD21 LEU 18 33.829 26.108 24.469 146 HD22 LEU 18 HD22 LEU 18 34.892 27.522 24.374 147 HD23 LEU 18 HD23 LEU 18 33.609 27.479 25.583 148 H GLY 19 H GLY 19 28.505 28.494 23.461 149 HA2 GLY 19 HA2 GLY 19 26.765 26.114 24.012 150 HA3 GLY 19 HA3 GLY 19 26.201 27.701 23.526 151 H LYS 20 H LYS 20 25.783 24.943 22.456 152 HA LYS 20 HA LYS 20 25.780 25.778 19.623 153 HB2 LYS 20 HB2 LYS 20 26.796 23.018 20.464 154 HB3 LYS 20 HB3 LYS 20 26.383 23.518 18.834 155 HG2 LYS 20 HG2 LYS 20 28.624 23.790 18.680 156 HG3 LYS 20 HG3 LYS 20 28.207 25.406 19.234 157 HD2 LYS 20 HD2 LYS 20 28.656 24.416 21.646 158 HD3 LYS 20 HD3 LYS 20 29.400 23.076 20.800 159 HE2 LYS 20 HE2 LYS 20 30.218 26.016 20.605 160 HE3 LYS 20 HE3 LYS 20 31.029 24.774 21.565 161 HZ1 LYS 20 HZ1 LYS 20 32.247 24.957 19.600 162 HZ2 LYS 20 HZ2 LYS 20 31.381 23.571 19.400 163 HZ3 LYS 20 HZ3 LYS 20 30.936 24.972 18.627 164 H CYS 21 H CYS 21 23.947 24.978 18.506 165 HA CYS 21 HA CYS 21 21.827 23.726 20.182 166 HB2 CYS 21 HB2 CYS 21 21.102 25.510 18.729 167 HB3 CYS 21 HB3 CYS 21 21.816 24.731 17.316 168 H ILE 22 H ILE 22 21.551 21.593 20.252 169 HA ILE 22 HA ILE 22 22.779 19.784 18.211 170 HB ILE 22 HB ILE 22 22.823 19.519 21.245 171 HG12 ILE 22 HG12 ILE 22 24.502 21.156 20.547 172 HG13 ILE 22 HG13 ILE 22 25.211 19.695 21.193 173 HG21 ILE 22 HG21 ILE 22 24.211 17.494 20.840 174 HG22 ILE 22 HG22 ILE 22 22.563 17.322 20.247 175 HG23 ILE 22 HG23 ILE 22 23.882 17.632 19.101 176 HD11 ILE 22 HD11 ILE 22 25.050 20.318 18.226 177 HD12 ILE 22 HD12 ILE 22 26.464 20.561 19.256 178 HD13 ILE 22 HD13 ILE 22 25.856 18.919 18.973 179 H GLY 23 H GLY 23 20.923 19.156 17.205 180 HA2 GLY 23 HA2 GLY 23 18.944 18.031 16.845 181 HA3 GLY 23 HA3 GLY 23 19.145 17.297 18.444 182 H GLU 24 H GLU 24 18.240 20.395 16.948 183 HA GLU 24 HA GLU 24 16.756 22.013 17.365 184 HB2 GLU 24 HB2 GLU 24 15.028 19.944 18.750 185 HB3 GLU 24 HB3 GLU 24 14.530 21.475 18.041 186 HG2 GLU 24 HG2 GLU 24 15.260 20.631 15.788 187 HG3 GLU 24 HG3 GLU 24 15.539 19.043 16.526 188 H GLU 25 H GLU 25 18.567 21.023 19.901 189 HA GLU 25 HA GLU 25 17.471 23.085 21.745 190 HB2 GLU 25 HB2 GLU 25 16.336 20.941 22.191 191 HB3 GLU 25 HB3 GLU 25 17.903 20.159 22.445 192 HG2 GLU 25 HG2 GLU 25 18.316 21.485 24.432 193 HG3 GLU 25 HG3 GLU 25 16.930 22.533 24.078 194 H CYS 26 H CYS 26 18.907 24.056 23.087 195 HA CYS 26 HA CYS 26 21.624 24.152 22.424 196 HB2 CYS 26 HB2 CYS 26 20.330 25.949 23.453 197 HB3 CYS 26 HB3 CYS 26 20.146 24.997 24.932 198 H LYS 27 H LYS 27 23.515 23.412 23.224 199 HA LYS 27 HA LYS 27 23.699 21.896 25.764 200 HB2 LYS 27 HB2 LYS 27 23.541 20.290 23.715 201 HB3 LYS 27 HB3 LYS 27 25.107 20.956 23.239 202 HG2 LYS 27 HG2 LYS 27 25.897 20.250 25.639 203 HG3 LYS 27 HG3 LYS 27 24.380 19.362 25.726 204 HD2 LYS 27 HD2 LYS 27 26.058 17.806 25.090 205 HD3 LYS 27 HD3 LYS 27 25.120 18.107 23.621 206 HE2 LYS 27 HE2 LYS 27 26.852 19.680 22.824 207 HE3 LYS 27 HE3 LYS 27 27.741 19.513 24.351 208 HZ1 LYS 27 HZ1 LYS 27 27.272 17.255 22.476 209 HZ2 LYS 27 HZ2 LYS 27 28.607 18.164 22.464 210 HZ3 LYS 27 HZ3 LYS 27 28.280 17.259 23.791 211 H CYS 28 H CYS 28 25.702 22.268 26.822 212 HA CYS 28 HA CYS 28 27.477 24.300 25.573 213 HB2 CYS 28 HB2 CYS 28 27.395 23.483 28.468 214 HB3 CYS 28 HB3 CYS 28 28.224 24.861 27.782 215 H VAL 29 H VAL 29 29.731 24.099 25.682 216 HA VAL 29 HA VAL 29 30.970 21.541 26.516 217 HB VAL 29 HB VAL 29 32.308 21.408 24.447 218 HG11 VAL 29 HG11 VAL 29 29.333 21.269 23.823 219 HG12 VAL 29 HG12 VAL 29 30.653 20.391 23.029 220 HG13 VAL 29 HG13 VAL 29 30.255 20.031 24.714 221 HG21 VAL 29 HG21 VAL 29 32.154 23.718 23.636 222 HG22 VAL 29 HG22 VAL 29 31.610 22.574 22.409 223 HG23 VAL 29 HG23 VAL 29 30.413 23.515 23.337 224 H TYR 30 H TYR 30 33.254 21.640 26.834 225 HA TYR 30 HA TYR 30 34.191 24.110 27.988 226 HB2 TYR 30 HB2 TYR 30 35.719 21.585 27.302 227 HB3 TYR 30 HB3 TYR 30 36.250 22.833 28.411 228 HD1 TYR 30 HD1 TYR 30 34.513 23.318 30.446 229 HD2 TYR 30 HD2 TYR 30 34.934 19.631 28.240 230 HE1 TYR 30 HE1 TYR 30 33.640 22.042 32.395 231 HE2 TYR 30 HE2 TYR 30 34.023 18.372 30.171 232 HH TYR 30 HH TYR 30 33.162 19.982 33.255 233 H ASN 31 H ASN 31 34.446 22.879 24.764 234 HA ASN 31 HA ASN 31 36.526 24.847 23.984 235 HB2 ASN 31 HB2 ASN 31 36.610 21.880 23.238 236 HB3 ASN 31 HB3 ASN 31 37.780 23.102 22.785 237 HD21 ASN 31 HD21 ASN 31 38.200 21.139 26.273 238 HD22 ASN 31 HD22 ASN 31 36.857 20.821 25.176 Start of MODEL 19 1 H1 ALA 1 H1 ALA 1 10.499 22.354 17.549 2 H2 ALA 1 H2 ALA 1 10.407 21.595 19.017 3 H3 ALA 1 H3 ALA 1 11.763 21.470 18.104 4 HA ALA 1 HA ALA 1 10.720 23.933 19.323 5 HB1 ALA 1 HB1 ALA 1 12.691 23.838 20.795 6 HB2 ALA 1 HB2 ALA 1 11.708 22.383 20.983 7 HB3 ALA 1 HB3 ALA 1 13.207 22.309 20.049 8 H PHE 2 H PHE 2 12.082 25.806 19.070 9 HA PHE 2 HA PHE 2 13.882 25.758 16.668 10 HB2 PHE 2 HB2 PHE 2 11.899 27.884 17.505 11 HB3 PHE 2 HB3 PHE 2 13.024 28.016 16.166 12 HD1 PHE 2 HD1 PHE 2 9.720 27.788 16.656 13 HD2 PHE 2 HD2 PHE 2 12.831 25.545 14.679 14 HE1 PHE 2 HE1 PHE 2 8.044 26.842 15.088 15 HE2 PHE 2 HE2 PHE 2 11.151 24.575 13.139 16 HZ PHE 2 HZ PHE 2 8.755 25.225 13.335 17 H CYS 3 H CYS 3 15.792 25.642 17.829 18 HA CYS 3 HA CYS 3 16.407 27.295 20.134 19 HB2 CYS 3 HB2 CYS 3 18.648 26.323 19.851 20 HB3 CYS 3 HB3 CYS 3 17.392 25.096 19.790 21 H ASN 4 H ASN 4 18.389 28.730 20.154 22 HA ASN 4 HA ASN 4 18.978 30.147 17.644 23 HB2 ASN 4 HB2 ASN 4 17.871 31.529 20.129 24 HB3 ASN 4 HB3 ASN 4 18.730 32.371 18.836 25 HD21 ASN 4 HD21 ASN 4 16.058 31.846 16.436 26 HD22 ASN 4 HD22 ASN 4 17.818 31.841 16.522 27 H LEU 5 H LEU 5 21.028 29.855 17.467 28 HA LEU 5 HA LEU 5 22.695 28.831 19.420 29 HB2 LEU 5 HB2 LEU 5 22.790 29.090 16.752 30 HB3 LEU 5 HB3 LEU 5 23.996 30.303 17.156 31 HG LEU 5 HG LEU 5 23.992 27.346 17.942 32 HD11 LEU 5 HD11 LEU 5 24.402 27.743 15.547 33 HD12 LEU 5 HD12 LEU 5 25.695 28.894 15.950 34 HD13 LEU 5 HD13 LEU 5 25.875 27.178 16.351 35 HD21 LEU 5 HD21 LEU 5 26.072 29.495 18.465 36 HD22 LEU 5 HD22 LEU 5 25.222 28.500 19.671 37 HD23 LEU 5 HD23 LEU 5 26.398 27.757 18.586 38 H ARG 6 H ARG 6 22.598 32.322 18.465 39 HA ARG 6 HA ARG 6 24.709 33.154 20.221 40 HB2 ARG 6 HB2 ARG 6 23.714 34.607 18.447 41 HB3 ARG 6 HB3 ARG 6 22.262 34.809 19.421 42 HG2 ARG 6 HG2 ARG 6 23.509 35.958 21.162 43 HG3 ARG 6 HG3 ARG 6 25.058 35.490 20.449 44 HD2 ARG 6 HD2 ARG 6 24.635 37.836 20.039 45 HD3 ARG 6 HD3 ARG 6 24.646 36.940 18.513 46 HE ARG 6 HE ARG 6 21.953 37.166 19.516 47 HH11 ARG 6 HH11 ARG 6 24.378 39.489 18.365 48 HH12 ARG 6 HH12 ARG 6 23.099 40.467 17.652 49 HH21 ARG 6 HH21 ARG 6 20.514 38.423 18.233 50 HH22 ARG 6 HH22 ARG 6 21.134 39.970 17.691 51 H ARG 7 H ARG 7 21.192 33.002 20.927 52 HA ARG 7 HA ARG 7 21.448 33.791 23.691 53 HB2 ARG 7 HB2 ARG 7 19.334 33.910 22.459 54 HB3 ARG 7 HB3 ARG 7 19.299 32.165 22.261 55 HG2 ARG 7 HG2 ARG 7 17.743 32.962 24.017 56 HG3 ARG 7 HG3 ARG 7 18.924 31.804 24.604 57 HD2 ARG 7 HD2 ARG 7 18.649 33.487 26.278 58 HD3 ARG 7 HD3 ARG 7 20.261 33.653 25.591 59 HE ARG 7 HE ARG 7 18.114 35.411 24.501 60 HH11 ARG 7 HH11 ARG 7 20.888 35.292 26.762 61 HH12 ARG 7 HH12 ARG 7 20.971 37.055 26.694 62 HH21 ARG 7 HH21 ARG 7 18.288 37.533 24.729 63 HH22 ARG 7 HH22 ARG 7 19.596 38.217 25.715 64 H CYS 8 H CYS 8 21.610 30.615 22.113 65 HA CYS 8 HA CYS 8 21.984 29.060 24.488 66 HB2 CYS 8 HB2 CYS 8 21.434 28.052 22.376 67 HB3 CYS 8 HB3 CYS 8 22.887 28.677 21.624 68 H GLU 9 H GLU 9 24.501 30.479 22.309 69 HA GLU 9 HA GLU 9 26.780 29.758 23.844 70 HB2 GLU 9 HB2 GLU 9 26.183 31.946 21.858 71 HB3 GLU 9 HB3 GLU 9 27.700 31.948 22.688 72 HG2 GLU 9 HG2 GLU 9 26.990 29.288 21.540 73 HG3 GLU 9 HG3 GLU 9 27.167 30.602 20.347 74 H LEU 10 H LEU 10 24.742 32.698 24.189 75 HA LEU 10 HA LEU 10 26.253 33.802 26.392 76 HB2 LEU 10 HB2 LEU 10 23.378 34.130 25.459 77 HB3 LEU 10 HB3 LEU 10 24.071 35.062 26.787 78 HG LEU 10 HG LEU 10 25.179 35.100 23.950 79 HD11 LEU 10 HD11 LEU 10 23.314 37.072 25.326 80 HD12 LEU 10 HD12 LEU 10 24.052 37.273 23.725 81 HD13 LEU 10 HD13 LEU 10 22.876 35.977 23.992 82 HD21 LEU 10 HD21 LEU 10 26.834 35.811 25.620 83 HD22 LEU 10 HD22 LEU 10 26.247 37.209 24.717 84 HD23 LEU 10 HD23 LEU 10 25.646 36.910 26.360 85 H SER 11 H SER 11 23.479 31.571 26.241 86 HA SER 11 HA SER 11 23.073 31.463 29.093 87 HB2 SER 11 HB2 SER 11 22.335 29.377 27.005 88 HB3 SER 11 HB3 SER 11 21.711 29.486 28.661 89 HG SER 11 HG SER 11 21.377 31.311 26.517 90 H CYS 12 H CYS 12 25.200 29.591 26.934 91 HA CYS 12 HA CYS 12 26.278 27.969 29.119 92 HB2 CYS 12 HB2 CYS 12 27.331 28.528 26.325 93 HB3 CYS 12 HB3 CYS 12 27.967 27.326 27.459 94 H ARG 13 H ARG 13 27.159 31.111 27.603 95 HA ARG 13 HA ARG 13 29.722 31.397 28.780 96 HB2 ARG 13 HB2 ARG 13 28.714 32.875 27.005 97 HB3 ARG 13 HB3 ARG 13 27.677 33.604 28.214 98 HG2 ARG 13 HG2 ARG 13 29.662 34.960 27.595 99 HG3 ARG 13 HG3 ARG 13 29.519 34.645 29.318 100 HD2 ARG 13 HD2 ARG 13 31.860 34.475 28.368 101 HD3 ARG 13 HD3 ARG 13 31.316 33.086 29.317 102 HE ARG 13 HE ARG 13 30.736 32.641 26.535 103 HH11 ARG 13 HH11 ARG 13 33.619 32.757 28.584 104 HH12 ARG 13 HH12 ARG 13 34.291 31.386 27.714 105 HH21 ARG 13 HH21 ARG 13 31.699 30.966 25.573 106 HH22 ARG 13 HH22 ARG 13 33.347 30.512 26.039 107 H SER 14 H SER 14 26.516 32.151 30.191 108 HA SER 14 HA SER 14 27.382 33.033 32.730 109 HB2 SER 14 HB2 SER 14 25.015 31.267 32.002 110 HB3 SER 14 HB3 SER 14 25.201 32.153 33.531 111 HG SER 14 HG SER 14 25.279 34.078 32.353 112 H LEU 15 H LEU 15 27.473 29.740 31.456 113 HA LEU 15 HA LEU 15 28.086 28.560 34.105 114 HB2 LEU 15 HB2 LEU 15 27.994 27.178 31.409 115 HB3 LEU 15 HB3 LEU 15 27.929 26.436 33.000 116 HG LEU 15 HG LEU 15 25.774 28.166 31.717 117 HD11 LEU 15 HD11 LEU 15 24.453 26.155 31.609 118 HD12 LEU 15 HD12 LEU 15 25.999 25.896 30.768 119 HD13 LEU 15 HD13 LEU 15 25.746 25.218 32.394 120 HD21 LEU 15 HD21 LEU 15 25.738 26.719 34.400 121 HD22 LEU 15 HD22 LEU 15 25.722 28.482 34.168 122 HD23 LEU 15 HD23 LEU 15 24.347 27.514 33.637 123 H GLY 16 H GLY 16 29.763 29.855 31.382 124 HA2 GLY 16 HA2 GLY 16 32.086 30.377 31.372 125 HA3 GLY 16 HA3 GLY 16 32.411 29.006 32.450 126 H LEU 17 H LEU 17 30.284 28.674 29.655 127 HA LEU 17 HA LEU 17 32.236 26.895 28.337 128 HB2 LEU 17 HB2 LEU 17 29.277 26.436 28.719 129 HB3 LEU 17 HB3 LEU 17 30.417 25.295 27.962 130 HG LEU 17 HG LEU 17 30.263 26.142 30.849 131 HD11 LEU 17 HD11 LEU 17 29.537 23.511 29.544 132 HD12 LEU 17 HD12 LEU 17 29.539 23.836 31.286 133 HD13 LEU 17 HD13 LEU 17 28.413 24.720 30.252 134 HD21 LEU 17 HD21 LEU 17 32.623 25.496 30.207 135 HD22 LEU 17 HD22 LEU 17 31.905 24.315 31.308 136 HD23 LEU 17 HD23 LEU 17 31.998 23.962 29.575 137 H LEU 18 H LEU 18 31.538 26.275 26.084 138 HA LEU 18 HA LEU 18 30.453 28.643 24.599 139 HB2 LEU 18 HB2 LEU 18 31.724 26.127 23.447 140 HB3 LEU 18 HB3 LEU 18 31.140 27.545 22.583 141 HG LEU 18 HG LEU 18 32.913 28.855 24.072 142 HD11 LEU 18 HD11 LEU 18 34.968 27.503 24.437 143 HD12 LEU 18 HD12 LEU 18 33.653 26.895 25.437 144 HD13 LEU 18 HD13 LEU 18 34.090 26.032 23.956 145 HD21 LEU 18 HD21 LEU 18 34.565 28.538 22.299 146 HD22 LEU 18 HD22 LEU 18 33.737 27.065 21.741 147 HD23 LEU 18 HD23 LEU 18 32.947 28.650 21.601 148 H GLY 19 H GLY 19 28.666 28.376 23.229 149 HA2 GLY 19 HA2 GLY 19 26.875 26.073 23.928 150 HA3 GLY 19 HA3 GLY 19 26.332 27.626 23.325 151 H LYS 20 H LYS 20 25.852 24.843 22.443 152 HA LYS 20 HA LYS 20 25.973 25.447 19.537 153 HB2 LYS 20 HB2 LYS 20 26.992 22.856 20.792 154 HB3 LYS 20 HB3 LYS 20 26.376 22.946 19.157 155 HG2 LYS 20 HG2 LYS 20 28.451 23.306 18.523 156 HG3 LYS 20 HG3 LYS 20 28.180 24.981 19.008 157 HD2 LYS 20 HD2 LYS 20 29.191 24.464 21.239 158 HD3 LYS 20 HD3 LYS 20 29.448 22.792 20.736 159 HE2 LYS 20 HE2 LYS 20 30.660 25.242 19.377 160 HE3 LYS 20 HE3 LYS 20 31.493 24.229 20.560 161 HZ1 LYS 20 HZ1 LYS 20 31.217 22.341 19.020 162 HZ2 LYS 20 HZ2 LYS 20 30.543 23.336 17.893 163 HZ3 LYS 20 HZ3 LYS 20 32.098 23.546 18.343 164 H CYS 21 H CYS 21 23.970 25.081 18.605 165 HA CYS 21 HA CYS 21 21.911 23.713 20.240 166 HB2 CYS 21 HB2 CYS 21 21.178 25.637 19.022 167 HB3 CYS 21 HB3 CYS 21 21.747 24.956 17.490 168 H ILE 22 H ILE 22 21.790 21.609 20.324 169 HA ILE 22 HA ILE 22 22.393 19.890 17.959 170 HB ILE 22 HB ILE 22 23.551 19.547 20.744 171 HG12 ILE 22 HG12 ILE 22 24.937 19.959 18.059 172 HG13 ILE 22 HG13 ILE 22 24.761 21.188 19.311 173 HG21 ILE 22 HG21 ILE 22 24.574 17.462 19.895 174 HG22 ILE 22 HG22 ILE 22 22.822 17.361 19.783 175 HG23 ILE 22 HG23 ILE 22 23.783 17.702 18.330 176 HD11 ILE 22 HD11 ILE 22 26.108 19.797 20.871 177 HD12 ILE 22 HD12 ILE 22 26.431 18.663 19.531 178 HD13 ILE 22 HD13 ILE 22 26.980 20.341 19.435 179 H GLY 23 H GLY 23 20.675 18.713 17.568 180 HA2 GLY 23 HA2 GLY 23 18.726 17.517 17.827 181 HA3 GLY 23 HA3 GLY 23 19.117 17.306 19.539 182 H GLU 24 H GLU 24 18.602 20.378 17.809 183 HA GLU 24 HA GLU 24 17.294 22.160 18.142 184 HB2 GLU 24 HB2 GLU 24 15.153 20.326 19.228 185 HB3 GLU 24 HB3 GLU 24 14.956 21.968 18.608 186 HG2 GLU 24 HG2 GLU 24 15.756 21.220 16.394 187 HG3 GLU 24 HG3 GLU 24 15.786 19.541 16.979 188 H GLU 25 H GLU 25 18.646 20.745 20.737 189 HA GLU 25 HA GLU 25 17.701 22.890 22.598 190 HB2 GLU 25 HB2 GLU 25 18.563 20.050 23.208 191 HB3 GLU 25 HB3 GLU 25 18.416 21.300 24.432 192 HG2 GLU 25 HG2 GLU 25 16.109 20.416 22.640 193 HG3 GLU 25 HG3 GLU 25 16.453 19.729 24.225 194 H CYS 26 H CYS 26 19.253 23.741 24.052 195 HA CYS 26 HA CYS 26 21.833 24.216 22.754 196 HB2 CYS 26 HB2 CYS 26 20.517 26.043 23.715 197 HB3 CYS 26 HB3 CYS 26 20.555 25.263 25.295 198 H LYS 27 H LYS 27 23.447 22.791 23.001 199 HA LYS 27 HA LYS 27 24.018 21.583 25.688 200 HB2 LYS 27 HB2 LYS 27 25.229 20.982 22.956 201 HB3 LYS 27 HB3 LYS 27 25.759 20.286 24.501 202 HG2 LYS 27 HG2 LYS 27 23.355 19.384 24.750 203 HG3 LYS 27 HG3 LYS 27 23.130 19.815 23.048 204 HD2 LYS 27 HD2 LYS 27 25.314 18.461 22.617 205 HD3 LYS 27 HD3 LYS 27 25.142 17.868 24.284 206 HE2 LYS 27 HE2 LYS 27 22.819 17.058 23.638 207 HE3 LYS 27 HE3 LYS 27 23.171 17.531 21.981 208 HZ1 LYS 27 HZ1 LYS 27 23.794 15.304 22.051 209 HZ2 LYS 27 HZ2 LYS 27 25.250 16.029 22.304 210 HZ3 LYS 27 HZ3 LYS 27 24.411 15.394 23.571 211 H CYS 28 H CYS 28 26.029 21.937 26.650 212 HA CYS 28 HA CYS 28 27.626 24.168 25.487 213 HB2 CYS 28 HB2 CYS 28 27.489 23.468 28.409 214 HB3 CYS 28 HB3 CYS 28 28.218 24.885 27.671 215 H VAL 29 H VAL 29 29.858 24.028 25.461 216 HA VAL 29 HA VAL 29 31.154 21.472 26.322 217 HB VAL 29 HB VAL 29 32.522 21.444 24.340 218 HG11 VAL 29 HG11 VAL 29 30.411 20.143 24.393 219 HG12 VAL 29 HG12 VAL 29 29.588 21.490 23.572 220 HG13 VAL 29 HG13 VAL 29 30.895 20.618 22.751 221 HG21 VAL 29 HG21 VAL 29 32.545 23.803 23.679 222 HG22 VAL 29 HG22 VAL 29 32.001 22.777 22.342 223 HG23 VAL 29 HG23 VAL 29 30.813 23.713 23.273 224 H TYR 30 H TYR 30 33.350 21.564 26.888 225 HA TYR 30 HA TYR 30 34.049 24.001 28.288 226 HB2 TYR 30 HB2 TYR 30 35.445 21.348 27.817 227 HB3 TYR 30 HB3 TYR 30 36.234 22.661 28.649 228 HD1 TYR 30 HD1 TYR 30 35.676 23.325 30.880 229 HD2 TYR 30 HD2 TYR 30 33.349 20.298 28.848 230 HE1 TYR 30 HE1 TYR 30 34.569 22.729 33.025 231 HE2 TYR 30 HE2 TYR 30 32.233 19.729 31.002 232 HH TYR 30 HH TYR 30 31.757 20.686 33.132 233 H ASN 31 H ASN 31 35.140 22.651 25.207 234 HA ASN 31 HA ASN 31 36.227 25.189 24.299 235 HB2 ASN 31 HB2 ASN 31 38.019 22.722 24.494 236 HB3 ASN 31 HB3 ASN 31 38.378 24.146 23.531 237 HD21 ASN 31 HD21 ASN 31 39.215 26.157 26.421 238 HD22 ASN 31 HD22 ASN 31 38.243 26.293 24.954 Start of MODEL 20 1 H1 ALA 1 H1 ALA 1 12.948 19.623 17.188 2 H2 ALA 1 H2 ALA 1 11.394 20.148 17.228 3 H3 ALA 1 H3 ALA 1 11.852 18.899 18.194 4 HA ALA 1 HA ALA 1 11.543 20.987 19.379 5 HB1 ALA 1 HB1 ALA 1 14.382 19.884 19.423 6 HB2 ALA 1 HB2 ALA 1 13.608 20.840 20.693 7 HB3 ALA 1 HB3 ALA 1 12.995 19.241 20.316 8 H PHE 2 H PHE 2 13.285 22.941 20.080 9 HA PHE 2 HA PHE 2 14.088 24.368 17.585 10 HB2 PHE 2 HB2 PHE 2 12.254 25.487 19.741 11 HB3 PHE 2 HB3 PHE 2 12.924 26.388 18.391 12 HD1 PHE 2 HD1 PHE 2 12.475 25.162 15.982 13 HD2 PHE 2 HD2 PHE 2 9.992 24.922 19.500 14 HE1 PHE 2 HE1 PHE 2 10.527 24.599 14.570 15 HE2 PHE 2 HE2 PHE 2 8.029 24.398 18.077 16 HZ PHE 2 HZ PHE 2 8.290 24.233 15.607 17 H CYS 3 H CYS 3 16.091 25.307 17.845 18 HA CYS 3 HA CYS 3 16.871 26.211 20.571 19 HB2 CYS 3 HB2 CYS 3 17.941 24.153 20.154 20 HB3 CYS 3 HB3 CYS 3 18.503 24.667 18.568 21 H ASN 4 H ASN 4 18.198 27.982 20.758 22 HA ASN 4 HA ASN 4 18.412 29.790 18.375 23 HB2 ASN 4 HB2 ASN 4 17.570 30.451 21.213 24 HB3 ASN 4 HB3 ASN 4 17.982 31.658 19.995 25 HD21 ASN 4 HD21 ASN 4 14.979 31.257 18.154 26 HD22 ASN 4 HD22 ASN 4 16.568 32.026 18.217 27 H LEU 5 H LEU 5 20.372 29.471 17.847 28 HA LEU 5 HA LEU 5 22.460 28.562 19.392 29 HB2 LEU 5 HB2 LEU 5 21.905 28.733 16.825 30 HB3 LEU 5 HB3 LEU 5 22.931 30.159 16.852 31 HG LEU 5 HG LEU 5 23.818 27.437 17.908 32 HD11 LEU 5 HD11 LEU 5 23.999 28.506 15.070 33 HD12 LEU 5 HD12 LEU 5 24.807 27.040 15.672 34 HD13 LEU 5 HD13 LEU 5 23.041 27.120 15.622 35 HD21 LEU 5 HD21 LEU 5 25.303 29.393 18.440 36 HD22 LEU 5 HD22 LEU 5 26.048 28.232 17.349 37 HD23 LEU 5 HD23 LEU 5 25.401 29.763 16.703 38 H ARG 6 H ARG 6 21.911 31.963 18.432 39 HA ARG 6 HA ARG 6 24.382 32.962 19.615 40 HB2 ARG 6 HB2 ARG 6 22.948 34.025 17.753 41 HB3 ARG 6 HB3 ARG 6 21.858 34.558 19.035 42 HG2 ARG 6 HG2 ARG 6 23.817 35.786 20.092 43 HG3 ARG 6 HG3 ARG 6 24.809 35.272 18.720 44 HD2 ARG 6 HD2 ARG 6 24.053 37.535 18.316 45 HD3 ARG 6 HD3 ARG 6 23.246 36.455 17.167 46 HE ARG 6 HE ARG 6 21.705 36.880 19.611 47 HH11 ARG 6 HH11 ARG 6 22.353 38.426 16.488 48 HH12 ARG 6 HH12 ARG 6 20.824 39.265 16.521 49 HH21 ARG 6 HH21 ARG 6 19.758 37.881 19.493 50 HH22 ARG 6 HH22 ARG 6 19.450 39.062 18.244 51 H ARG 7 H ARG 7 21.056 32.651 20.775 52 HA ARG 7 HA ARG 7 21.424 33.954 23.333 53 HB2 ARG 7 HB2 ARG 7 19.271 33.659 22.106 54 HB3 ARG 7 HB3 ARG 7 19.330 31.921 22.424 55 HG2 ARG 7 HG2 ARG 7 19.148 32.346 24.859 56 HG3 ARG 7 HG3 ARG 7 19.251 34.089 24.559 57 HD2 ARG 7 HD2 ARG 7 16.944 33.667 24.851 58 HD3 ARG 7 HD3 ARG 7 17.172 33.878 23.116 59 HE ARG 7 HE ARG 7 17.123 31.120 24.294 60 HH11 ARG 7 HH11 ARG 7 15.190 33.531 22.596 61 HH12 ARG 7 HH12 ARG 7 14.145 32.297 21.921 62 HH21 ARG 7 HH21 ARG 7 15.670 29.731 23.633 63 HH22 ARG 7 HH22 ARG 7 14.326 30.219 22.603 64 H CYS 8 H CYS 8 21.454 30.528 22.356 65 HA CYS 8 HA CYS 8 21.900 29.323 24.874 66 HB2 CYS 8 HB2 CYS 8 21.262 28.149 22.827 67 HB3 CYS 8 HB3 CYS 8 22.768 28.580 22.061 68 H GLU 9 H GLU 9 24.300 30.640 22.536 69 HA GLU 9 HA GLU 9 26.641 29.976 24.018 70 HB2 GLU 9 HB2 GLU 9 25.997 32.197 22.080 71 HB3 GLU 9 HB3 GLU 9 27.586 32.083 22.854 72 HG2 GLU 9 HG2 GLU 9 27.885 29.808 21.953 73 HG3 GLU 9 HG3 GLU 9 26.323 29.914 21.131 74 H LEU 10 H LEU 10 24.428 32.790 24.508 75 HA LEU 10 HA LEU 10 26.098 34.038 26.522 76 HB2 LEU 10 HB2 LEU 10 23.065 34.147 26.282 77 HB3 LEU 10 HB3 LEU 10 24.092 35.240 27.187 78 HG LEU 10 HG LEU 10 24.005 34.988 24.153 79 HD11 LEU 10 HD11 LEU 10 22.948 37.198 24.273 80 HD12 LEU 10 HD12 LEU 10 22.001 36.015 25.179 81 HD13 LEU 10 HD13 LEU 10 23.036 37.172 26.044 82 HD21 LEU 10 HD21 LEU 10 25.555 36.906 25.946 83 HD22 LEU 10 HD22 LEU 10 26.253 35.675 24.859 84 HD23 LEU 10 HD23 LEU 10 25.381 37.053 24.173 85 H SER 11 H SER 11 23.396 31.712 26.677 86 HA SER 11 HA SER 11 23.302 31.458 29.503 87 HB2 SER 11 HB2 SER 11 22.540 29.426 27.363 88 HB3 SER 11 HB3 SER 11 22.013 29.406 29.059 89 HG SER 11 HG SER 11 21.047 31.437 28.724 90 H CYS 12 H CYS 12 25.326 29.679 27.132 91 HA CYS 12 HA CYS 12 26.534 28.055 29.241 92 HB2 CYS 12 HB2 CYS 12 27.408 28.560 26.392 93 HB3 CYS 12 HB3 CYS 12 28.077 27.351 27.489 94 H ARG 13 H ARG 13 27.473 31.157 27.631 95 HA ARG 13 HA ARG 13 30.060 31.402 28.795 96 HB2 ARG 13 HB2 ARG 13 29.183 32.805 26.944 97 HB3 ARG 13 HB3 ARG 13 28.008 33.517 28.036 98 HG2 ARG 13 HG2 ARG 13 29.634 35.139 27.800 99 HG3 ARG 13 HG3 ARG 13 29.981 34.467 29.383 100 HD2 ARG 13 HD2 ARG 13 31.428 33.789 26.785 101 HD3 ARG 13 HD3 ARG 13 31.983 34.959 27.967 102 HE ARG 13 HE ARG 13 32.222 33.118 29.612 103 HH11 ARG 13 HH11 ARG 13 32.229 32.070 26.185 104 HH12 ARG 13 HH12 ARG 13 33.281 30.730 26.635 105 HH21 ARG 13 HH21 ARG 13 33.706 31.507 29.861 106 HH22 ARG 13 HH22 ARG 13 34.009 30.415 28.504 107 H SER 14 H SER 14 26.860 32.197 30.149 108 HA SER 14 HA SER 14 27.653 33.268 32.655 109 HB2 SER 14 HB2 SER 14 25.319 31.517 31.828 110 HB3 SER 14 HB3 SER 14 25.432 32.313 33.405 111 HG SER 14 HG SER 14 25.403 34.288 32.450 112 H LEU 15 H LEU 15 27.908 29.933 31.549 113 HA LEU 15 HA LEU 15 28.473 28.974 34.325 114 HB2 LEU 15 HB2 LEU 15 28.284 27.362 31.753 115 HB3 LEU 15 HB3 LEU 15 28.369 26.750 33.399 116 HG LEU 15 HG LEU 15 26.042 28.233 32.111 117 HD11 LEU 15 HD11 LEU 15 26.300 25.878 31.441 118 HD12 LEU 15 HD12 LEU 15 26.317 25.387 33.152 119 HD13 LEU 15 HD13 LEU 15 24.858 26.110 32.442 120 HD21 LEU 15 HD21 LEU 15 26.301 27.188 34.964 121 HD22 LEU 15 HD22 LEU 15 26.132 28.891 34.474 122 HD23 LEU 15 HD23 LEU 15 24.799 27.764 34.210 123 H GLY 16 H GLY 16 29.993 29.792 31.310 124 HA2 GLY 16 HA2 GLY 16 32.386 30.303 31.250 125 HA3 GLY 16 HA3 GLY 16 32.702 28.924 32.294 126 H LEU 17 H LEU 17 30.351 28.450 29.784 127 HA LEU 17 HA LEU 17 32.237 26.635 28.349 128 HB2 LEU 17 HB2 LEU 17 29.262 26.309 28.775 129 HB3 LEU 17 HB3 LEU 17 30.364 25.116 28.080 130 HG LEU 17 HG LEU 17 30.225 26.100 30.931 131 HD11 LEU 17 HD11 LEU 17 29.472 23.416 29.741 132 HD12 LEU 17 HD12 LEU 17 29.473 23.826 31.469 133 HD13 LEU 17 HD13 LEU 17 28.364 24.661 30.382 134 HD21 LEU 17 HD21 LEU 17 32.566 25.448 30.385 135 HD22 LEU 17 HD22 LEU 17 31.836 24.231 31.431 136 HD23 LEU 17 HD23 LEU 17 31.985 23.921 29.685 137 H LEU 18 H LEU 18 31.361 25.930 26.179 138 HA LEU 18 HA LEU 18 30.542 28.291 24.547 139 HB2 LEU 18 HB2 LEU 18 31.687 25.647 23.659 140 HB3 LEU 18 HB3 LEU 18 31.324 27.051 22.645 141 HG LEU 18 HG LEU 18 33.474 26.890 24.812 142 HD11 LEU 18 HD11 LEU 18 35.028 27.083 22.934 143 HD12 LEU 18 HD12 LEU 18 33.953 25.696 22.716 144 HD13 LEU 18 HD13 LEU 18 33.670 27.176 21.787 145 HD21 LEU 18 HD21 LEU 18 32.591 29.200 24.714 146 HD22 LEU 18 HD22 LEU 18 34.210 29.096 24.026 147 HD23 LEU 18 HD23 LEU 18 32.795 29.207 22.947 148 H GLY 19 H GLY 19 28.501 28.364 23.737 149 HA2 GLY 19 HA2 GLY 19 26.717 26.001 24.048 150 HA3 GLY 19 HA3 GLY 19 26.228 27.636 23.639 151 H LYS 20 H LYS 20 26.036 24.692 22.442 152 HA LYS 20 HA LYS 20 25.934 25.746 19.645 153 HB2 LYS 20 HB2 LYS 20 27.153 23.074 20.466 154 HB3 LYS 20 HB3 LYS 20 26.485 23.389 18.865 155 HG2 LYS 20 HG2 LYS 20 28.658 23.842 18.437 156 HG3 LYS 20 HG3 LYS 20 28.075 25.446 18.802 157 HD2 LYS 20 HD2 LYS 20 29.003 25.142 21.154 158 HD3 LYS 20 HD3 LYS 20 29.672 23.587 20.629 159 HE2 LYS 20 HE2 LYS 20 30.265 26.142 19.097 160 HE3 LYS 20 HE3 LYS 20 31.131 25.797 20.585 161 HZ1 LYS 20 HZ1 LYS 20 32.035 23.832 19.686 162 HZ2 LYS 20 HZ2 LYS 20 31.074 23.881 18.312 163 HZ3 LYS 20 HZ3 LYS 20 32.242 24.988 18.566 164 H CYS 21 H CYS 21 24.141 25.207 18.491 165 HA CYS 21 HA CYS 21 21.966 23.786 19.902 166 HB2 CYS 21 HB2 CYS 21 22.160 24.965 17.118 167 HB3 CYS 21 HB3 CYS 21 20.779 24.093 17.697 168 H ILE 22 H ILE 22 22.102 21.670 20.102 169 HA ILE 22 HA ILE 22 23.078 19.935 17.847 170 HB ILE 22 HB ILE 22 23.780 19.840 20.801 171 HG12 ILE 22 HG12 ILE 22 25.466 20.080 18.292 172 HG13 ILE 22 HG13 ILE 22 25.112 21.399 19.419 173 HG21 ILE 22 HG21 ILE 22 23.252 17.528 19.996 174 HG22 ILE 22 HG22 ILE 22 24.470 17.750 18.720 175 HG23 ILE 22 HG23 ILE 22 24.957 17.740 20.414 176 HD11 ILE 22 HD11 ILE 22 27.331 20.630 19.845 177 HD12 ILE 22 HD12 ILE 22 26.338 20.097 21.183 178 HD13 ILE 22 HD13 ILE 22 26.846 18.917 19.938 179 H GLY 23 H GLY 23 21.580 18.494 17.252 180 HA2 GLY 23 HA2 GLY 23 19.648 17.229 17.213 181 HA3 GLY 23 HA3 GLY 23 19.795 17.115 18.995 182 H GLU 24 H GLU 24 19.379 20.158 17.187 183 HA GLU 24 HA GLU 24 17.905 21.848 17.381 184 HB2 GLU 24 HB2 GLU 24 15.792 19.730 17.805 185 HB3 GLU 24 HB3 GLU 24 15.525 21.425 17.412 186 HG2 GLU 24 HG2 GLU 24 16.630 21.129 15.238 187 HG3 GLU 24 HG3 GLU 24 16.915 19.419 15.614 188 H GLU 25 H GLU 25 19.289 20.856 19.837 189 HA GLU 25 HA GLU 25 17.702 22.407 21.807 190 HB2 GLU 25 HB2 GLU 25 17.192 20.114 22.257 191 HB3 GLU 25 HB3 GLU 25 18.868 19.626 22.045 192 HG2 GLU 25 HG2 GLU 25 18.273 19.509 24.358 193 HG3 GLU 25 HG3 GLU 25 19.525 20.708 24.117 194 H CYS 26 H CYS 26 18.857 23.489 23.436 195 HA CYS 26 HA CYS 26 21.567 24.303 22.656 196 HB2 CYS 26 HB2 CYS 26 20.026 25.958 23.548 197 HB3 CYS 26 HB3 CYS 26 19.782 24.994 25.001 198 H LYS 27 H LYS 27 23.368 23.250 23.199 199 HA LYS 27 HA LYS 27 23.579 21.929 25.867 200 HB2 LYS 27 HB2 LYS 27 24.697 20.760 23.289 201 HB3 LYS 27 HB3 LYS 27 24.753 20.062 24.910 202 HG2 LYS 27 HG2 LYS 27 22.193 19.967 24.841 203 HG3 LYS 27 HG3 LYS 27 22.305 20.437 23.135 204 HD2 LYS 27 HD2 LYS 27 23.821 18.403 22.801 205 HD3 LYS 27 HD3 LYS 27 23.344 17.901 24.440 206 HE2 LYS 27 HE2 LYS 27 20.938 17.976 23.720 207 HE3 LYS 27 HE3 LYS 27 21.464 18.448 22.101 208 HZ1 LYS 27 HZ1 LYS 27 21.115 16.111 22.045 209 HZ2 LYS 27 HZ2 LYS 27 22.758 16.260 22.112 210 HZ3 LYS 27 HZ3 LYS 27 21.918 15.849 23.440 211 H CYS 28 H CYS 28 25.388 22.427 26.968 212 HA CYS 28 HA CYS 28 27.365 24.207 25.681 213 HB2 CYS 28 HB2 CYS 28 27.217 23.406 28.577 214 HB3 CYS 28 HB3 CYS 28 28.117 24.723 27.873 215 H VAL 29 H VAL 29 29.494 23.844 25.487 216 HA VAL 29 HA VAL 29 30.772 21.272 26.255 217 HB VAL 29 HB VAL 29 31.533 20.921 23.947 218 HG11 VAL 29 HG11 VAL 29 29.553 19.971 23.018 219 HG12 VAL 29 HG12 VAL 29 29.495 19.749 24.769 220 HG13 VAL 29 HG13 VAL 29 28.500 21.003 23.990 221 HG21 VAL 29 HG21 VAL 29 31.329 23.243 23.079 222 HG22 VAL 29 HG22 VAL 29 30.531 22.047 22.052 223 HG23 VAL 29 HG23 VAL 29 29.560 23.084 23.117 224 H TYR 30 H TYR 30 33.190 21.386 25.230 225 HA TYR 30 HA TYR 30 34.291 23.929 26.327 226 HB2 TYR 30 HB2 TYR 30 35.649 21.257 25.892 227 HB3 TYR 30 HB3 TYR 30 36.322 22.657 26.711 228 HD1 TYR 30 HD1 TYR 30 34.895 23.564 28.803 229 HD2 TYR 30 HD2 TYR 30 34.722 19.553 27.221 230 HE1 TYR 30 HE1 TYR 30 34.109 22.722 31.009 231 HE2 TYR 30 HE2 TYR 30 33.925 18.720 29.423 232 HH TYR 30 HH TYR 30 33.214 20.868 32.177 233 H ASN 31 H ASN 31 33.944 22.371 23.257 234 HA ASN 31 HA ASN 31 35.780 24.330 21.944 235 HB2 ASN 31 HB2 ASN 31 35.642 21.317 21.495 236 HB3 ASN 31 HB3 ASN 31 36.258 22.425 20.277 237 HD21 ASN 31 HD21 ASN 31 38.824 22.576 23.371 238 HD22 ASN 31 HD22 ASN 31 37.283 23.445 23.406
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