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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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510947 |
2ky3 ![]() ![]() |
17227 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 9.351 12.149 30.390 2 H2 GLY 1 H2 GLY 1 10.749 11.471 30.945 3 H3 GLY 1 H3 GLY 1 10.417 11.451 29.338 4 HA2 GLY 1 HA2 GLY 1 10.933 13.853 30.936 5 HA3 GLY 1 HA3 GLY 1 12.084 13.094 29.830 6 H SER 2 H SER 2 12.310 14.474 28.172 7 HA SER 2 HA SER 2 11.892 15.846 26.444 8 HB2 SER 2 HB2 SER 2 9.834 13.696 25.979 9 HB3 SER 2 HB3 SER 2 10.184 14.958 24.789 10 HG SER 2 HG SER 2 11.422 12.815 24.836 11 H ALA 3 H ALA 3 10.833 16.957 28.755 12 HA ALA 3 HA ALA 3 8.298 18.256 27.935 13 HB1 ALA 3 HB1 ALA 3 9.725 18.325 30.605 14 HB2 ALA 3 HB2 ALA 3 8.110 18.938 30.236 15 HB3 ALA 3 HB3 ALA 3 8.423 17.197 30.154 16 H PHE 4 H PHE 4 7.968 20.400 27.944 17 HA PHE 4 HA PHE 4 8.195 22.554 27.636 18 HB2 PHE 4 HB2 PHE 4 10.791 22.452 29.153 19 HB3 PHE 4 HB3 PHE 4 9.747 23.848 28.922 20 HD1 PHE 4 HD1 PHE 4 7.239 23.566 29.792 21 HD2 PHE 4 HD2 PHE 4 10.569 21.168 31.125 22 HE1 PHE 4 HE1 PHE 4 5.987 22.962 31.851 23 HE2 PHE 4 HE2 PHE 4 9.312 20.564 33.175 24 HZ PHE 4 HZ PHE 4 7.018 21.456 33.544 25 H CYS 5 H CYS 5 11.328 21.047 26.711 26 HA CYS 5 HA CYS 5 11.840 23.217 24.778 27 HB2 CYS 5 HB2 CYS 5 13.632 21.926 26.038 28 HB3 CYS 5 HB3 CYS 5 13.243 20.558 24.995 29 H ASN 6 H ASN 6 11.203 23.253 22.671 30 HA ASN 6 HA ASN 6 10.334 20.684 21.371 31 HB2 ASN 6 HB2 ASN 6 8.713 22.629 21.300 32 HB3 ASN 6 HB3 ASN 6 9.888 23.506 20.311 33 HD21 ASN 6 HD21 ASN 6 7.291 22.954 19.415 34 HD22 ASN 6 HD22 ASN 6 7.442 21.812 18.075 35 H LEU 7 H LEU 7 11.766 19.752 19.923 36 HA LEU 7 HA LEU 7 14.365 20.872 19.457 37 HB2 LEU 7 HB2 LEU 7 14.039 18.515 19.147 38 HB3 LEU 7 HB3 LEU 7 12.843 18.767 17.876 39 HG LEU 7 HG LEU 7 15.608 19.967 17.469 40 HD11 LEU 7 HD11 LEU 7 16.100 17.703 18.307 41 HD12 LEU 7 HD12 LEU 7 14.915 17.010 17.188 42 HD13 LEU 7 HD13 LEU 7 16.370 17.780 16.547 43 HD21 LEU 7 HD21 LEU 7 13.755 18.397 15.593 44 HD22 LEU 7 HD22 LEU 7 13.752 20.160 15.693 45 HD23 LEU 7 HD23 LEU 7 15.202 19.321 15.139 46 H ARG 8 H ARG 8 11.305 21.265 17.678 47 HA ARG 8 HA ARG 8 12.285 22.617 15.388 48 HB2 ARG 8 HB2 ARG 8 9.807 21.870 16.410 49 HB3 ARG 8 HB3 ARG 8 9.711 23.622 16.546 50 HG2 ARG 8 HG2 ARG 8 10.400 22.004 14.046 51 HG3 ARG 8 HG3 ARG 8 8.804 22.654 14.442 52 HD2 ARG 8 HD2 ARG 8 9.416 24.339 13.124 53 HD3 ARG 8 HD3 ARG 8 10.227 24.949 14.572 54 HE ARG 8 HE ARG 8 12.095 23.252 13.321 55 HH11 ARG 8 HH11 ARG 8 10.356 26.087 12.166 56 HH12 ARG 8 HH12 ARG 8 11.467 26.274 10.824 57 HH21 ARG 8 HH21 ARG 8 13.460 23.632 11.709 58 HH22 ARG 8 HH22 ARG 8 13.321 25.068 10.709 59 H ARG 9 H ARG 9 11.821 23.827 18.647 60 HA ARG 9 HA ARG 9 12.276 26.635 17.809 61 HB2 ARG 9 HB2 ARG 9 10.485 26.053 19.374 62 HB3 ARG 9 HB3 ARG 9 11.668 25.458 20.551 63 HG2 ARG 9 HG2 ARG 9 12.502 27.628 20.977 64 HG3 ARG 9 HG3 ARG 9 11.927 28.248 19.417 65 HD2 ARG 9 HD2 ARG 9 10.614 29.151 21.285 66 HD3 ARG 9 HD3 ARG 9 9.667 28.243 20.125 67 HE ARG 9 HE ARG 9 10.376 27.364 22.888 68 HH11 ARG 9 HH11 ARG 9 8.255 26.860 20.082 69 HH12 ARG 9 HH12 ARG 9 7.409 25.563 20.886 70 HH21 ARG 9 HH21 ARG 9 8.994 26.000 23.910 71 HH22 ARG 9 HH22 ARG 9 7.811 25.099 23.018 72 H CYS 10 H CYS 10 14.016 24.041 19.516 73 HA CYS 10 HA CYS 10 16.427 25.602 19.926 74 HB2 CYS 10 HB2 CYS 10 16.133 23.529 21.064 75 HB3 CYS 10 HB3 CYS 10 15.915 22.660 19.545 76 H GLU 11 H GLU 11 15.170 23.760 17.029 77 HA GLU 11 HA GLU 11 17.383 23.919 15.397 78 HB2 GLU 11 HB2 GLU 11 14.499 24.285 14.637 79 HB3 GLU 11 HB3 GLU 11 15.842 24.342 13.484 80 HG2 GLU 11 HG2 GLU 11 16.448 22.064 14.007 81 HG3 GLU 11 HG3 GLU 11 15.046 21.933 15.086 82 H LEU 12 H LEU 12 14.894 26.410 15.874 83 HA LEU 12 HA LEU 12 16.210 28.428 14.256 84 HB2 LEU 12 HB2 LEU 12 13.793 28.254 16.050 85 HB3 LEU 12 HB3 LEU 12 14.193 29.744 15.163 86 HG LEU 12 HG LEU 12 13.634 27.019 13.879 87 HD11 LEU 12 HD11 LEU 12 11.942 29.544 14.099 88 HD12 LEU 12 HD12 LEU 12 11.523 28.101 13.156 89 HD13 LEU 12 HD13 LEU 12 11.642 27.993 14.918 90 HD21 LEU 12 HD21 LEU 12 15.095 28.386 12.423 91 HD22 LEU 12 HD22 LEU 12 13.462 28.317 11.766 92 HD23 LEU 12 HD23 LEU 12 14.014 29.775 12.623 93 H SER 13 H SER 13 16.686 27.595 17.560 94 HA SER 13 HA SER 13 17.932 30.203 18.225 95 HB2 SER 13 HB2 SER 13 17.678 27.524 19.549 96 HB3 SER 13 HB3 SER 13 19.166 28.423 19.859 97 HG SER 13 HG SER 13 16.493 29.266 20.353 98 H CYS 14 H CYS 14 18.742 27.301 16.478 99 HA CYS 14 HA CYS 14 21.657 27.809 16.618 100 HB2 CYS 14 HB2 CYS 14 19.839 25.510 15.972 101 HB3 CYS 14 HB3 CYS 14 21.573 25.424 15.752 102 H ARG 15 H ARG 15 19.077 27.800 14.226 103 HA ARG 15 HA ARG 15 20.766 27.212 11.962 104 HB2 ARG 15 HB2 ARG 15 18.060 28.169 12.578 105 HB3 ARG 15 HB3 ARG 15 18.530 28.176 10.857 106 HG2 ARG 15 HG2 ARG 15 19.152 25.813 10.950 107 HG3 ARG 15 HG3 ARG 15 18.708 25.685 12.639 108 HD2 ARG 15 HD2 ARG 15 16.349 26.204 12.089 109 HD3 ARG 15 HD3 ARG 15 16.759 26.513 10.407 110 HE ARG 15 HE ARG 15 16.205 23.957 11.574 111 HH11 ARG 15 HH11 ARG 15 18.046 25.342 8.915 112 HH12 ARG 15 HH12 ARG 15 18.484 23.741 8.337 113 HH21 ARG 15 HH21 ARG 15 16.399 22.145 10.558 114 HH22 ARG 15 HH22 ARG 15 17.347 21.991 9.079 115 H SER 16 H SER 16 19.589 30.200 13.373 116 HA SER 16 HA SER 16 20.441 32.287 11.799 117 HB2 SER 16 HB2 SER 16 20.874 31.822 14.785 118 HB3 SER 16 HB3 SER 16 20.810 33.417 13.984 119 HG SER 16 HG SER 16 18.827 32.870 14.922 120 H LEU 17 H LEU 17 22.433 29.793 12.836 121 HA LEU 17 HA LEU 17 24.973 31.305 12.975 122 HB2 LEU 17 HB2 LEU 17 24.459 28.499 13.929 123 HB3 LEU 17 HB3 LEU 17 25.648 29.649 14.498 124 HG LEU 17 HG LEU 17 22.619 29.776 15.075 125 HD11 LEU 17 HD11 LEU 17 23.338 29.238 17.370 126 HD12 LEU 17 HD12 LEU 17 23.861 27.960 16.259 127 HD13 LEU 17 HD13 LEU 17 25.031 29.155 16.848 128 HD21 LEU 17 HD21 LEU 17 24.909 31.484 16.140 129 HD22 LEU 17 HD22 LEU 17 23.655 32.052 15.026 130 HD23 LEU 17 HD23 LEU 17 23.214 31.548 16.659 131 H GLY 18 H GLY 18 23.241 29.271 10.826 132 HA2 GLY 18 HA2 GLY 18 23.942 28.254 8.832 133 HA3 GLY 18 HA3 GLY 18 25.635 28.524 9.246 134 H LEU 19 H LEU 19 23.537 27.065 11.585 135 HA LEU 19 HA LEU 19 24.724 24.343 11.235 136 HB2 LEU 19 HB2 LEU 19 23.821 25.686 13.818 137 HB3 LEU 19 HB3 LEU 19 24.684 24.175 13.669 138 HG LEU 19 HG LEU 19 25.837 26.938 13.088 139 HD11 LEU 19 HD11 LEU 19 26.374 24.957 15.341 140 HD12 LEU 19 HD12 LEU 19 27.182 26.515 15.089 141 HD13 LEU 19 HD13 LEU 19 25.460 26.478 15.485 142 HD21 LEU 19 HD21 LEU 19 26.905 25.188 11.674 143 HD22 LEU 19 HD22 LEU 19 28.004 25.770 12.927 144 HD23 LEU 19 HD23 LEU 19 27.194 24.203 13.125 145 H LEU 20 H LEU 20 23.304 22.761 12.561 146 HA LEU 20 HA LEU 20 20.374 23.299 12.242 147 HB2 LEU 20 HB2 LEU 20 20.863 21.240 11.204 148 HB3 LEU 20 HB3 LEU 20 22.012 20.768 12.450 149 HG LEU 20 HG LEU 20 20.074 20.564 14.065 150 HD11 LEU 20 HD11 LEU 20 17.825 20.414 13.165 151 HD12 LEU 20 HD12 LEU 20 18.453 21.991 12.660 152 HD13 LEU 20 HD13 LEU 20 18.409 20.654 11.507 153 HD21 LEU 20 HD21 LEU 20 19.358 18.446 13.439 154 HD22 LEU 20 HD22 LEU 20 19.710 18.722 11.736 155 HD23 LEU 20 HD23 LEU 20 21.040 18.582 12.913 156 H GLY 21 H GLY 21 19.126 22.702 14.172 157 HA2 GLY 21 HA2 GLY 21 20.592 22.806 16.768 158 HA3 GLY 21 HA3 GLY 21 19.065 23.640 16.603 159 H LYS 22 H LYS 22 20.119 21.215 18.133 160 HA LYS 22 HA LYS 22 17.874 19.332 17.558 161 HB2 LYS 22 HB2 LYS 22 19.999 18.728 16.407 162 HB3 LYS 22 HB3 LYS 22 20.800 18.571 17.966 163 HG2 LYS 22 HG2 LYS 22 19.525 16.622 18.522 164 HG3 LYS 22 HG3 LYS 22 18.297 16.978 17.312 165 HD2 LYS 22 HD2 LYS 22 19.627 15.130 16.524 166 HD3 LYS 22 HD3 LYS 22 19.894 16.538 15.492 167 HE2 LYS 22 HE2 LYS 22 22.007 17.023 16.772 168 HE3 LYS 22 HE3 LYS 22 21.741 15.537 17.699 169 HZ1 LYS 22 HZ1 LYS 22 21.876 14.300 15.587 170 HZ2 LYS 22 HZ2 LYS 22 22.172 15.696 14.758 171 HZ3 LYS 22 HZ3 LYS 22 23.241 15.165 15.876 172 H CYS 23 H CYS 23 16.704 19.906 19.343 173 HA CYS 23 HA CYS 23 17.921 19.452 22.053 174 HB2 CYS 23 HB2 CYS 23 17.043 21.695 21.833 175 HB3 CYS 23 HB3 CYS 23 15.489 21.080 21.307 176 H ILE 24 H ILE 24 17.789 17.257 21.616 177 HA ILE 24 HA ILE 24 15.166 15.937 21.903 178 HB ILE 24 HB ILE 24 17.890 14.644 22.230 179 HG12 ILE 24 HG12 ILE 24 16.430 14.909 19.559 180 HG13 ILE 24 HG13 ILE 24 17.836 15.885 20.002 181 HG21 ILE 24 HG21 ILE 24 15.890 13.348 22.922 182 HG22 ILE 24 HG22 ILE 24 15.147 13.620 21.332 183 HG23 ILE 24 HG23 ILE 24 16.602 12.627 21.488 184 HD11 ILE 24 HD11 ILE 24 17.864 12.888 19.707 185 HD12 ILE 24 HD12 ILE 24 18.575 14.115 18.637 186 HD13 ILE 24 HD13 ILE 24 19.217 13.897 20.275 187 H GLY 25 H GLY 25 14.393 15.168 23.810 188 HA2 GLY 25 HA2 GLY 25 14.054 15.076 26.108 189 HA3 GLY 25 HA3 GLY 25 15.769 15.431 26.378 190 H GLU 26 H GLU 26 16.189 17.354 27.193 191 HA GLU 26 HA GLU 26 14.618 19.711 26.356 192 HB2 GLU 26 HB2 GLU 26 14.292 20.602 28.504 193 HB3 GLU 26 HB3 GLU 26 13.647 18.974 28.486 194 HG2 GLU 26 HG2 GLU 26 16.292 19.826 29.732 195 HG3 GLU 26 HG3 GLU 26 14.794 19.553 30.600 196 H GLU 27 H GLU 27 17.394 18.527 25.900 197 HA GLU 27 HA GLU 27 19.072 20.810 26.857 198 HB2 GLU 27 HB2 GLU 27 20.880 19.169 26.989 199 HB3 GLU 27 HB3 GLU 27 19.557 18.897 28.106 200 HG2 GLU 27 HG2 GLU 27 18.672 17.070 26.684 201 HG3 GLU 27 HG3 GLU 27 20.007 17.289 25.554 202 H CYS 28 H CYS 28 18.895 22.146 25.092 203 HA CYS 28 HA CYS 28 19.120 21.327 22.400 204 HB2 CYS 28 HB2 CYS 28 17.992 23.347 23.226 205 HB3 CYS 28 HB3 CYS 28 19.529 24.026 23.698 206 H LYS 29 H LYS 29 20.680 20.822 21.115 207 HA LYS 29 HA LYS 29 23.488 21.817 21.455 208 HB2 LYS 29 HB2 LYS 29 23.381 19.387 21.531 209 HB3 LYS 29 HB3 LYS 29 22.296 19.333 20.142 210 HG2 LYS 29 HG2 LYS 29 24.071 20.155 18.664 211 HG3 LYS 29 HG3 LYS 29 25.195 20.246 20.021 212 HD2 LYS 29 HD2 LYS 29 23.831 17.693 19.057 213 HD3 LYS 29 HD3 LYS 29 25.402 18.227 18.473 214 HE2 LYS 29 HE2 LYS 29 24.783 17.646 21.397 215 HE3 LYS 29 HE3 LYS 29 25.475 16.475 20.264 216 HZ1 LYS 29 HZ1 LYS 29 27.369 17.926 19.958 217 HZ2 LYS 29 HZ2 LYS 29 26.769 19.049 21.001 218 HZ3 LYS 29 HZ3 LYS 29 27.184 17.571 21.560 219 H CYS 30 H CYS 30 24.441 22.804 19.590 220 HA CYS 30 HA CYS 30 22.744 22.850 17.149 221 HB2 CYS 30 HB2 CYS 30 24.862 24.939 17.402 222 HB3 CYS 30 HB3 CYS 30 23.457 24.858 16.318 223 H VAL 31 H VAL 31 23.762 22.285 15.285 224 HA VAL 31 HA VAL 31 26.325 20.821 15.680 225 HB VAL 31 HB VAL 31 24.376 19.488 16.345 226 HG11 VAL 31 HG11 VAL 31 23.581 19.407 13.423 227 HG12 VAL 31 HG12 VAL 31 22.851 18.520 14.767 228 HG13 VAL 31 HG13 VAL 31 22.690 20.281 14.703 229 HG21 VAL 31 HG21 VAL 31 26.449 18.468 15.636 230 HG22 VAL 31 HG22 VAL 31 25.063 17.485 15.138 231 HG23 VAL 31 HG23 VAL 31 25.911 18.466 13.935 232 HA PRO 32 HA PRO 32 27.006 22.347 11.526 233 HB2 PRO 32 HB2 PRO 32 29.173 20.255 11.413 234 HB3 PRO 32 HB3 PRO 32 29.243 21.999 11.017 235 HG2 PRO 32 HG2 PRO 32 30.262 21.066 13.347 236 HG3 PRO 32 HG3 PRO 32 29.296 22.582 13.336 237 HD2 PRO 32 HD2 PRO 32 28.363 19.775 14.031 238 HD3 PRO 32 HD3 PRO 32 28.144 21.304 14.934 239 H TYR 33 H TYR 33 24.965 21.561 10.803 240 HA TYR 33 HA TYR 33 24.328 19.072 9.823 241 HB2 TYR 33 HB2 TYR 33 22.932 21.225 10.109 242 HB3 TYR 33 HB3 TYR 33 23.397 21.610 8.463 243 HD1 TYR 33 HD2 TYR 33 21.752 19.101 10.639 244 HD2 TYR 33 HD1 TYR 33 22.304 20.487 6.609 245 HE1 TYR 33 HE2 TYR 33 19.908 17.572 9.857 246 HE2 TYR 33 HE1 TYR 33 20.469 18.972 5.827 247 HH TYR 33 HH TYR 33 18.568 16.982 8.137 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 6.507 16.567 35.881 2 H2 GLY 1 H2 GLY 1 5.649 17.936 35.583 3 H3 GLY 1 H3 GLY 1 6.845 17.949 36.718 4 HA2 GLY 1 HA2 GLY 1 8.542 17.646 35.084 5 HA3 GLY 1 HA3 GLY 1 7.280 17.484 33.848 6 H SER 2 H SER 2 9.411 19.646 35.323 7 HA SER 2 HA SER 2 7.855 22.030 34.386 8 HB2 SER 2 HB2 SER 2 9.667 22.049 36.796 9 HB3 SER 2 HB3 SER 2 8.547 23.287 36.264 10 HG SER 2 HG SER 2 7.721 22.120 38.000 11 H ALA 3 H ALA 3 10.333 20.380 33.277 12 HA ALA 3 HA ALA 3 11.902 22.809 32.508 13 HB1 ALA 3 HB1 ALA 3 12.995 20.030 33.107 14 HB2 ALA 3 HB2 ALA 3 13.921 21.385 32.445 15 HB3 ALA 3 HB3 ALA 3 13.233 21.495 34.073 16 H PHE 4 H PHE 4 12.332 23.089 30.375 17 HA PHE 4 HA PHE 4 11.090 21.206 28.434 18 HB2 PHE 4 HB2 PHE 4 10.141 24.072 28.720 19 HB3 PHE 4 HB3 PHE 4 9.502 22.836 27.657 20 HD1 PHE 4 HD1 PHE 4 8.206 20.865 28.674 21 HD2 PHE 4 HD2 PHE 4 9.367 24.343 30.930 22 HE1 PHE 4 HE1 PHE 4 6.466 20.347 30.380 23 HE2 PHE 4 HE2 PHE 4 7.590 23.862 32.598 24 HZ PHE 4 HZ PHE 4 6.141 21.870 32.317 25 H CYS 5 H CYS 5 11.737 21.362 26.446 26 HA CYS 5 HA CYS 5 12.472 23.765 25.090 27 HB2 CYS 5 HB2 CYS 5 14.671 23.461 25.952 28 HB3 CYS 5 HB3 CYS 5 14.621 21.724 25.731 29 H ASN 6 H ASN 6 12.258 23.405 22.760 30 HA ASN 6 HA ASN 6 11.486 20.609 21.994 31 HB2 ASN 6 HB2 ASN 6 9.444 21.949 22.095 32 HB3 ASN 6 HB3 ASN 6 10.181 23.186 21.059 33 HD21 ASN 6 HD22 ASN 6 9.331 19.669 21.081 34 HD22 ASN 6 HD21 ASN 6 9.097 19.608 19.342 35 H LEU 7 H LEU 7 12.283 19.788 20.136 36 HA LEU 7 HA LEU 7 14.710 20.784 19.154 37 HB2 LEU 7 HB2 LEU 7 13.884 18.453 18.969 38 HB3 LEU 7 HB3 LEU 7 12.835 18.930 17.649 39 HG LEU 7 HG LEU 7 15.772 19.688 17.456 40 HD11 LEU 7 HD11 LEU 7 15.846 17.357 18.272 41 HD12 LEU 7 HD12 LEU 7 14.633 16.875 17.076 42 HD13 LEU 7 HD13 LEU 7 16.237 17.377 16.543 43 HD21 LEU 7 HD21 LEU 7 13.794 18.567 15.410 44 HD22 LEU 7 HD22 LEU 7 14.245 20.275 15.576 45 HD23 LEU 7 HD23 LEU 7 15.456 19.107 15.089 46 H ARG 8 H ARG 8 11.480 21.214 17.626 47 HA ARG 8 HA ARG 8 12.501 22.238 15.194 48 HB2 ARG 8 HB2 ARG 8 9.863 22.909 16.560 49 HB3 ARG 8 HB3 ARG 8 10.204 23.132 14.858 50 HG2 ARG 8 HG2 ARG 8 10.235 20.781 14.409 51 HG3 ARG 8 HG3 ARG 8 10.366 20.365 16.129 52 HD2 ARG 8 HD2 ARG 8 8.096 19.949 15.329 53 HD3 ARG 8 HD3 ARG 8 8.147 21.182 16.597 54 HE ARG 8 HE ARG 8 8.068 21.943 13.705 55 HH11 ARG 8 HH11 ARG 8 6.250 21.891 16.738 56 HH12 ARG 8 HH12 ARG 8 5.145 23.120 16.123 57 HH21 ARG 8 HH21 ARG 8 6.949 23.898 13.403 58 HH22 ARG 8 HH22 ARG 8 5.537 24.189 14.364 59 H ARG 9 H ARG 9 11.661 23.969 18.149 60 HA ARG 9 HA ARG 9 12.287 26.579 16.987 61 HB2 ARG 9 HB2 ARG 9 10.468 26.164 18.693 62 HB3 ARG 9 HB3 ARG 9 11.740 25.952 19.916 63 HG2 ARG 9 HG2 ARG 9 12.568 28.219 19.489 64 HG3 ARG 9 HG3 ARG 9 11.489 28.392 18.090 65 HD2 ARG 9 HD2 ARG 9 9.535 28.189 19.640 66 HD3 ARG 9 HD3 ARG 9 10.656 28.163 21.019 67 HE ARG 9 HE ARG 9 11.371 30.425 19.513 68 HH11 ARG 9 HH11 ARG 9 8.500 29.567 21.365 69 HH12 ARG 9 HH12 ARG 9 7.934 31.228 21.310 70 HH21 ARG 9 HH21 ARG 9 10.635 32.397 19.587 71 HH22 ARG 9 HH22 ARG 9 9.056 32.757 20.313 72 H CYS 10 H CYS 10 14.094 24.215 18.997 73 HA CYS 10 HA CYS 10 16.325 26.070 19.371 74 HB2 CYS 10 HB2 CYS 10 16.081 23.926 20.678 75 HB3 CYS 10 HB3 CYS 10 16.453 23.044 19.176 76 H GLU 11 H GLU 11 15.302 23.744 16.857 77 HA GLU 11 HA GLU 11 17.501 23.663 15.291 78 HB2 GLU 11 HB2 GLU 11 15.064 22.550 15.023 79 HB3 GLU 11 HB3 GLU 11 14.976 23.773 13.754 80 HG2 GLU 11 HG2 GLU 11 17.360 22.866 13.126 81 HG3 GLU 11 HG3 GLU 11 16.914 21.466 14.076 82 H LEU 12 H LEU 12 14.786 25.879 14.868 83 HA LEU 12 HA LEU 12 15.929 27.534 12.831 84 HB2 LEU 12 HB2 LEU 12 13.626 27.695 14.781 85 HB3 LEU 12 HB3 LEU 12 13.919 29.008 13.622 86 HG LEU 12 HG LEU 12 13.606 26.098 12.750 87 HD11 LEU 12 HD11 LEU 12 11.479 28.263 12.938 88 HD12 LEU 12 HD12 LEU 12 11.281 26.670 12.173 89 HD13 LEU 12 HD13 LEU 12 11.564 26.785 13.918 90 HD21 LEU 12 HD21 LEU 12 13.040 27.109 10.576 91 HD22 LEU 12 HD22 LEU 12 13.281 28.735 11.246 92 HD23 LEU 12 HD23 LEU 12 14.653 27.626 11.073 93 H SER 13 H SER 13 15.770 27.975 16.389 94 HA SER 13 HA SER 13 16.937 30.579 16.426 95 HB2 SER 13 HB2 SER 13 17.163 28.352 18.495 96 HB3 SER 13 HB3 SER 13 17.538 30.069 18.756 97 HG SER 13 HG SER 13 15.055 28.821 18.299 98 H CYS 14 H CYS 14 18.405 27.356 16.221 99 HA CYS 14 HA CYS 14 21.126 28.419 16.243 100 HB2 CYS 14 HB2 CYS 14 19.861 25.692 16.183 101 HB3 CYS 14 HB3 CYS 14 21.523 25.898 15.677 102 H ARG 15 H ARG 15 18.827 27.719 13.683 103 HA ARG 15 HA ARG 15 20.874 27.382 11.689 104 HB2 ARG 15 HB2 ARG 15 18.025 28.153 11.853 105 HB3 ARG 15 HB3 ARG 15 18.779 28.238 10.243 106 HG2 ARG 15 HG2 ARG 15 19.411 25.905 10.262 107 HG3 ARG 15 HG3 ARG 15 18.881 25.682 11.927 108 HD2 ARG 15 HD2 ARG 15 16.553 26.140 11.287 109 HD3 ARG 15 HD3 ARG 15 17.028 26.551 9.643 110 HE ARG 15 HE ARG 15 16.682 23.881 10.810 111 HH11 ARG 15 HH11 ARG 15 18.088 25.545 8.013 112 HH12 ARG 15 HH12 ARG 15 17.898 24.112 7.031 113 HH21 ARG 15 HH21 ARG 15 16.427 22.267 9.548 114 HH22 ARG 15 HH22 ARG 15 16.888 22.346 7.834 115 H SER 16 H SER 16 19.384 30.237 13.081 116 HA SER 16 HA SER 16 20.365 32.376 11.599 117 HB2 SER 16 HB2 SER 16 20.382 32.021 14.625 118 HB3 SER 16 HB3 SER 16 20.318 33.566 13.753 119 HG SER 16 HG SER 16 18.259 32.562 14.593 120 H LEU 17 H LEU 17 22.280 29.934 12.825 121 HA LEU 17 HA LEU 17 24.778 31.523 13.195 122 HB2 LEU 17 HB2 LEU 17 24.284 28.758 14.253 123 HB3 LEU 17 HB3 LEU 17 25.348 29.989 14.867 124 HG LEU 17 HG LEU 17 22.273 30.017 15.155 125 HD11 LEU 17 HD11 LEU 17 22.781 29.489 17.508 126 HD12 LEU 17 HD12 LEU 17 23.423 28.221 16.453 127 HD13 LEU 17 HD13 LEU 17 24.519 29.429 17.149 128 HD21 LEU 17 HD21 LEU 17 24.425 31.767 16.430 129 HD22 LEU 17 HD22 LEU 17 23.279 32.303 15.193 130 HD23 LEU 17 HD23 LEU 17 22.678 31.806 16.775 131 H GLY 18 H GLY 18 23.257 29.483 10.974 132 HA2 GLY 18 HA2 GLY 18 24.027 28.139 9.250 133 HA3 GLY 18 HA3 GLY 18 25.694 28.337 9.795 134 H LEU 19 H LEU 19 23.369 27.293 12.214 135 HA LEU 19 HA LEU 19 24.527 24.536 12.161 136 HB2 LEU 19 HB2 LEU 19 23.794 26.201 14.594 137 HB3 LEU 19 HB3 LEU 19 24.542 24.607 14.589 138 HG LEU 19 HG LEU 19 25.840 27.166 13.567 139 HD11 LEU 19 HD11 LEU 19 25.567 27.092 16.018 140 HD12 LEU 19 HD12 LEU 19 26.362 25.503 16.065 141 HD13 LEU 19 HD13 LEU 19 27.264 26.944 15.547 142 HD21 LEU 19 HD21 LEU 19 26.960 24.342 13.928 143 HD22 LEU 19 HD22 LEU 19 26.723 25.177 12.372 144 HD23 LEU 19 HD23 LEU 19 27.914 25.785 13.516 145 H LEU 20 H LEU 20 23.242 22.972 13.488 146 HA LEU 20 HA LEU 20 20.300 23.341 13.012 147 HB2 LEU 20 HB2 LEU 20 21.516 21.913 11.441 148 HB3 LEU 20 HB3 LEU 20 22.080 20.899 12.765 149 HG LEU 20 HG LEU 20 19.471 20.638 13.253 150 HD11 LEU 20 HD11 LEU 20 18.129 20.793 11.206 151 HD12 LEU 20 HD12 LEU 20 18.841 22.389 11.522 152 HD13 LEU 20 HD13 LEU 20 19.526 21.350 10.273 153 HD21 LEU 20 HD21 LEU 20 20.956 18.808 12.503 154 HD22 LEU 20 HD22 LEU 20 19.383 18.752 11.671 155 HD23 LEU 20 HD23 LEU 20 20.811 19.364 10.825 156 H GLY 21 H GLY 21 19.524 23.767 14.929 157 HA2 GLY 21 HA2 GLY 21 20.310 22.593 17.436 158 HA3 GLY 21 HA3 GLY 21 18.843 23.510 17.162 159 H LYS 22 H LYS 22 20.198 20.522 17.788 160 HA LYS 22 HA LYS 22 17.806 18.870 17.174 161 HB2 LYS 22 HB2 LYS 22 20.704 18.189 17.786 162 HB3 LYS 22 HB3 LYS 22 19.436 16.970 17.732 163 HG2 LYS 22 HG2 LYS 22 20.167 18.720 15.349 164 HG3 LYS 22 HG3 LYS 22 20.835 17.128 15.692 165 HD2 LYS 22 HD2 LYS 22 18.391 16.272 15.732 166 HD3 LYS 22 HD3 LYS 22 17.975 17.821 14.951 167 HE2 LYS 22 HE2 LYS 22 19.591 17.304 13.131 168 HE3 LYS 22 HE3 LYS 22 20.028 15.798 13.932 169 HZ1 LYS 22 HZ1 LYS 22 17.334 16.430 12.861 170 HZ2 LYS 22 HZ2 LYS 22 18.423 15.422 12.172 171 HZ3 LYS 22 HZ3 LYS 22 17.774 15.016 13.622 172 H CYS 23 H CYS 23 16.893 20.300 19.103 173 HA CYS 23 HA CYS 23 17.808 19.473 21.755 174 HB2 CYS 23 HB2 CYS 23 17.004 21.706 21.496 175 HB3 CYS 23 HB3 CYS 23 15.471 21.158 20.922 176 H ILE 24 H ILE 24 17.703 17.327 21.791 177 HA ILE 24 HA ILE 24 15.094 15.948 21.949 178 HB ILE 24 HB ILE 24 17.903 14.859 22.351 179 HG12 ILE 24 HG12 ILE 24 16.136 14.991 19.855 180 HG13 ILE 24 HG13 ILE 24 17.719 15.738 20.084 181 HG21 ILE 24 HG21 ILE 24 15.253 13.412 21.821 182 HG22 ILE 24 HG22 ILE 24 16.848 12.652 22.040 183 HG23 ILE 24 HG23 ILE 24 16.099 13.477 23.388 184 HD11 ILE 24 HD11 ILE 24 17.988 13.867 18.649 185 HD12 ILE 24 HD12 ILE 24 18.758 13.474 20.195 186 HD13 ILE 24 HD13 ILE 24 17.173 12.772 19.773 187 H GLY 25 H GLY 25 14.016 15.481 23.786 188 HA2 GLY 25 HA2 GLY 25 13.545 15.287 26.046 189 HA3 GLY 25 HA3 GLY 25 15.257 15.465 26.428 190 H GLU 26 H GLU 26 15.945 17.365 27.211 191 HA GLU 26 HA GLU 26 14.248 19.819 26.971 192 HB2 GLU 26 HB2 GLU 26 14.535 20.277 29.365 193 HB3 GLU 26 HB3 GLU 26 13.583 18.830 29.059 194 HG2 GLU 26 HG2 GLU 26 16.574 18.613 29.635 195 HG3 GLU 26 HG3 GLU 26 15.417 18.836 30.936 196 H GLU 27 H GLU 27 17.277 18.736 26.249 197 HA GLU 27 HA GLU 27 18.319 21.473 26.445 198 HB2 GLU 27 HB2 GLU 27 20.531 20.790 27.206 199 HB3 GLU 27 HB3 GLU 27 19.275 20.556 28.426 200 HG2 GLU 27 HG2 GLU 27 19.280 18.123 27.973 201 HG3 GLU 27 HG3 GLU 27 20.496 18.346 26.712 202 H CYS 28 H CYS 28 19.901 22.037 24.928 203 HA CYS 28 HA CYS 28 19.495 20.416 22.471 204 HB2 CYS 28 HB2 CYS 28 18.459 22.726 22.775 205 HB3 CYS 28 HB3 CYS 28 20.089 23.369 22.610 206 H LYS 29 H LYS 29 20.953 20.110 20.942 207 HA LYS 29 HA LYS 29 23.769 21.082 21.196 208 HB2 LYS 29 HB2 LYS 29 23.551 18.547 21.275 209 HB3 LYS 29 HB3 LYS 29 22.706 18.610 19.718 210 HG2 LYS 29 HG2 LYS 29 24.724 19.630 18.677 211 HG3 LYS 29 HG3 LYS 29 25.552 19.603 20.231 212 HD2 LYS 29 HD2 LYS 29 26.236 17.804 18.686 213 HD3 LYS 29 HD3 LYS 29 25.638 17.206 20.245 214 HE2 LYS 29 HE2 LYS 29 23.524 16.543 19.277 215 HE3 LYS 29 HE3 LYS 29 23.909 17.320 17.739 216 HZ1 LYS 29 HZ1 LYS 29 25.335 15.007 18.910 217 HZ2 LYS 29 HZ2 LYS 29 24.331 14.950 17.612 218 HZ3 LYS 29 HZ3 LYS 29 25.759 15.737 17.497 219 H CYS 30 H CYS 30 24.485 22.208 19.225 220 HA CYS 30 HA CYS 30 22.542 22.152 16.996 221 HB2 CYS 30 HB2 CYS 30 23.885 24.754 17.630 222 HB3 CYS 30 HB3 CYS 30 22.706 24.390 16.331 223 H VAL 31 H VAL 31 23.250 21.453 15.335 224 HA VAL 31 HA VAL 31 26.039 20.652 15.362 225 HB VAL 31 HB VAL 31 23.681 19.586 13.750 226 HG11 VAL 31 HG11 VAL 31 25.058 17.506 13.811 227 HG12 VAL 31 HG12 VAL 31 25.916 18.820 13.004 228 HG13 VAL 31 HG13 VAL 31 26.321 18.394 14.688 229 HG21 VAL 31 HG21 VAL 31 24.693 18.773 16.509 230 HG22 VAL 31 HG22 VAL 31 23.078 19.443 16.152 231 HG23 VAL 31 HG23 VAL 31 23.521 17.850 15.541 232 HA PRO 32 HA PRO 32 26.945 22.871 11.460 233 HB2 PRO 32 HB2 PRO 32 29.289 20.980 11.397 234 HB3 PRO 32 HB3 PRO 32 29.242 22.746 11.177 235 HG2 PRO 32 HG2 PRO 32 30.134 21.649 13.499 236 HG3 PRO 32 HG3 PRO 32 29.119 23.120 13.524 237 HD2 PRO 32 HD2 PRO 32 28.274 20.235 13.949 238 HD3 PRO 32 HD3 PRO 32 27.871 21.694 14.916 239 H TYR 33 H TYR 33 25.090 22.002 10.511 240 HA TYR 33 HA TYR 33 24.798 19.245 9.957 241 HB2 TYR 33 HB2 TYR 33 22.644 19.729 9.170 242 HB3 TYR 33 HB3 TYR 33 23.020 20.621 10.619 243 HD1 TYR 33 HD2 TYR 33 23.147 23.123 10.566 244 HD2 TYR 33 HD1 TYR 33 22.135 20.799 7.078 245 HE1 TYR 33 HE2 TYR 33 22.179 25.151 9.481 246 HE2 TYR 33 HE1 TYR 33 21.137 22.809 6.020 247 HH TYR 33 HH TYR 33 20.549 24.982 6.289 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 21.974 25.694 27.898 2 H2 GLY 1 H2 GLY 1 21.790 25.367 26.299 3 H3 GLY 1 H3 GLY 1 23.300 25.515 26.921 4 HA2 GLY 1 HA2 GLY 1 22.791 23.219 26.519 5 HA3 GLY 1 HA3 GLY 1 23.006 23.531 28.253 6 H SER 2 H SER 2 21.156 23.443 29.652 7 HA SER 2 HA SER 2 19.025 21.764 28.594 8 HB2 SER 2 HB2 SER 2 18.255 21.653 30.954 9 HB3 SER 2 HB3 SER 2 19.943 21.118 30.660 10 HG SER 2 HG SER 2 20.051 22.354 32.402 11 H ALA 3 H ALA 3 16.824 22.115 28.559 12 HA ALA 3 HA ALA 3 15.772 24.810 29.104 13 HB1 ALA 3 HB1 ALA 3 14.991 25.089 26.758 14 HB2 ALA 3 HB2 ALA 3 16.764 24.960 26.827 15 HB3 ALA 3 HB3 ALA 3 15.803 23.565 26.318 16 H PHE 4 H PHE 4 13.508 25.015 28.822 17 HA PHE 4 HA PHE 4 11.809 22.607 29.184 18 HB2 PHE 4 HB2 PHE 4 11.590 24.652 30.585 19 HB3 PHE 4 HB3 PHE 4 11.221 25.575 29.157 20 HD1 PHE 4 HD1 PHE 4 10.020 22.876 31.397 21 HD2 PHE 4 HD2 PHE 4 8.991 25.628 28.240 22 HE1 PHE 4 HE1 PHE 4 7.605 22.431 31.814 23 HE2 PHE 4 HE2 PHE 4 6.580 25.186 28.629 24 HZ PHE 4 HZ PHE 4 5.890 23.599 30.434 25 H CYS 5 H CYS 5 12.148 21.624 27.068 26 HA CYS 5 HA CYS 5 12.639 23.627 25.010 27 HB2 CYS 5 HB2 CYS 5 14.172 21.736 25.992 28 HB3 CYS 5 HB3 CYS 5 13.345 20.716 24.817 29 H ASN 6 H ASN 6 12.152 23.503 22.818 30 HA ASN 6 HA ASN 6 10.468 21.230 21.891 31 HB2 ASN 6 HB2 ASN 6 9.019 23.252 22.020 32 HB3 ASN 6 HB3 ASN 6 10.163 24.127 20.983 33 HD21 ASN 6 HD22 ASN 6 7.771 24.209 19.865 34 HD22 ASN 6 HD21 ASN 6 7.504 22.858 18.748 35 H LEU 7 H LEU 7 11.728 20.038 20.503 36 HA LEU 7 HA LEU 7 14.217 21.009 19.489 37 HB2 LEU 7 HB2 LEU 7 13.787 18.641 19.737 38 HB3 LEU 7 HB3 LEU 7 12.551 18.667 18.497 39 HG LEU 7 HG LEU 7 15.340 19.643 17.785 40 HD11 LEU 7 HD11 LEU 7 14.441 16.721 17.793 41 HD12 LEU 7 HD12 LEU 7 16.024 17.334 17.296 42 HD13 LEU 7 HD13 LEU 7 15.523 17.382 18.998 43 HD21 LEU 7 HD21 LEU 7 13.223 18.091 16.208 44 HD22 LEU 7 HD22 LEU 7 13.629 19.799 15.984 45 HD23 LEU 7 HD23 LEU 7 14.821 18.576 15.604 46 H ARG 8 H ARG 8 10.971 21.061 17.958 47 HA ARG 8 HA ARG 8 11.706 21.984 15.393 48 HB2 ARG 8 HB2 ARG 8 9.438 21.248 16.298 49 HB3 ARG 8 HB3 ARG 8 9.276 22.858 17.009 50 HG2 ARG 8 HG2 ARG 8 9.433 23.862 14.729 51 HG3 ARG 8 HG3 ARG 8 9.592 22.231 14.048 52 HD2 ARG 8 HD2 ARG 8 7.359 21.653 15.004 53 HD3 ARG 8 HD3 ARG 8 7.223 23.285 15.657 54 HE ARG 8 HE ARG 8 7.028 24.188 13.475 55 HH11 ARG 8 HH11 ARG 8 7.102 20.667 13.251 56 HH12 ARG 8 HH12 ARG 8 6.847 20.709 11.527 57 HH21 ARG 8 HH21 ARG 8 6.352 24.106 11.390 58 HH22 ARG 8 HH22 ARG 8 6.544 22.639 10.481 59 H ARG 9 H ARG 9 11.894 23.734 18.369 60 HA ARG 9 HA ARG 9 12.230 26.377 17.011 61 HB2 ARG 9 HB2 ARG 9 10.507 25.882 18.876 62 HB3 ARG 9 HB3 ARG 9 11.890 25.867 19.982 63 HG2 ARG 9 HG2 ARG 9 12.416 28.206 19.355 64 HG3 ARG 9 HG3 ARG 9 11.177 28.164 18.093 65 HD2 ARG 9 HD2 ARG 9 10.203 29.279 19.968 66 HD3 ARG 9 HD3 ARG 9 9.441 27.711 19.834 67 HE ARG 9 HE ARG 9 11.621 28.395 21.800 68 HH11 ARG 9 HH11 ARG 9 8.647 26.465 21.248 69 HH12 ARG 9 HH12 ARG 9 8.739 25.907 22.912 70 HH21 ARG 9 HH21 ARG 9 11.360 27.772 23.859 71 HH22 ARG 9 HH22 ARG 9 10.189 26.498 24.234 72 H CYS 10 H CYS 10 13.914 24.098 19.186 73 HA CYS 10 HA CYS 10 16.419 25.523 19.334 74 HB2 CYS 10 HB2 CYS 10 15.860 23.501 20.641 75 HB3 CYS 10 HB3 CYS 10 15.824 22.557 19.151 76 H GLU 11 H GLU 11 15.106 23.238 16.886 77 HA GLU 11 HA GLU 11 17.192 23.097 15.077 78 HB2 GLU 11 HB2 GLU 11 15.249 21.733 15.208 79 HB3 GLU 11 HB3 GLU 11 14.240 23.025 14.517 80 HG2 GLU 11 HG2 GLU 11 16.634 22.145 12.959 81 HG3 GLU 11 HG3 GLU 11 15.446 20.892 13.230 82 H LEU 12 H LEU 12 15.282 25.847 15.703 83 HA LEU 12 HA LEU 12 15.840 27.009 13.059 84 HB2 LEU 12 HB2 LEU 12 13.448 26.500 13.963 85 HB3 LEU 12 HB3 LEU 12 13.645 27.957 14.920 86 HG LEU 12 HG LEU 12 13.894 27.756 11.878 87 HD11 LEU 12 HD11 LEU 12 11.611 27.291 12.668 88 HD12 LEU 12 HD12 LEU 12 11.620 28.796 13.614 89 HD13 LEU 12 HD13 LEU 12 11.685 28.847 11.838 90 HD21 LEU 12 HD21 LEU 12 15.111 29.718 12.580 91 HD22 LEU 12 HD22 LEU 12 13.564 30.253 11.952 92 HD23 LEU 12 HD23 LEU 12 13.815 30.191 13.710 93 H SER 13 H SER 13 15.634 27.873 16.570 94 HA SER 13 HA SER 13 17.010 30.363 16.387 95 HB2 SER 13 HB2 SER 13 17.284 30.146 18.806 96 HB3 SER 13 HB3 SER 13 15.651 29.727 18.299 97 HG SER 13 HG SER 13 16.022 27.645 18.624 98 H CYS 14 H CYS 14 18.317 27.123 16.292 99 HA CYS 14 HA CYS 14 21.144 27.868 16.575 100 HB2 CYS 14 HB2 CYS 14 19.584 25.482 15.587 101 HB3 CYS 14 HB3 CYS 14 21.320 25.564 15.535 102 H ARG 15 H ARG 15 18.944 28.220 13.879 103 HA ARG 15 HA ARG 15 21.033 27.798 11.855 104 HB2 ARG 15 HB2 ARG 15 18.237 28.750 11.974 105 HB3 ARG 15 HB3 ARG 15 19.079 28.716 10.397 106 HG2 ARG 15 HG2 ARG 15 19.581 26.327 10.681 107 HG3 ARG 15 HG3 ARG 15 18.727 26.282 12.221 108 HD2 ARG 15 HD2 ARG 15 16.616 26.931 11.010 109 HD3 ARG 15 HD3 ARG 15 17.498 26.979 9.488 110 HE ARG 15 HE ARG 15 16.590 24.625 10.976 111 HH11 ARG 15 HH11 ARG 15 18.992 25.559 8.518 112 HH12 ARG 15 HH12 ARG 15 19.251 23.856 8.131 113 HH21 ARG 15 HH21 ARG 15 16.818 22.675 10.162 114 HH22 ARG 15 HH22 ARG 15 18.144 22.322 9.013 115 H SER 16 H SER 16 19.810 30.529 13.546 116 HA SER 16 HA SER 16 20.747 32.829 12.316 117 HB2 SER 16 HB2 SER 16 21.166 31.899 15.198 118 HB3 SER 16 HB3 SER 16 21.006 33.580 14.647 119 HG SER 16 HG SER 16 19.082 32.639 15.586 120 H LEU 17 H LEU 17 22.522 30.134 13.453 121 HA LEU 17 HA LEU 17 25.177 31.369 13.708 122 HB2 LEU 17 HB2 LEU 17 24.402 28.531 14.346 123 HB3 LEU 17 HB3 LEU 17 25.583 29.557 15.140 124 HG LEU 17 HG LEU 17 22.520 29.785 15.439 125 HD11 LEU 17 HD11 LEU 17 24.708 28.858 17.348 126 HD12 LEU 17 HD12 LEU 17 22.971 28.965 17.701 127 HD13 LEU 17 HD13 LEU 17 23.564 27.797 16.501 128 HD21 LEU 17 HD21 LEU 17 23.618 31.998 15.710 129 HD22 LEU 17 HD22 LEU 17 23.067 31.354 17.263 130 HD23 LEU 17 HD23 LEU 17 24.783 31.273 16.824 131 H GLY 18 H GLY 18 23.486 29.926 11.214 132 HA2 GLY 18 HA2 GLY 18 24.066 28.799 9.307 133 HA3 GLY 18 HA3 GLY 18 25.775 28.888 9.754 134 H LEU 19 H LEU 19 23.548 27.440 12.066 135 HA LEU 19 HA LEU 19 24.647 24.725 11.485 136 HB2 LEU 19 HB2 LEU 19 23.773 25.902 14.148 137 HB3 LEU 19 HB3 LEU 19 24.467 24.313 13.891 138 HG LEU 19 HG LEU 19 25.861 26.972 13.567 139 HD11 LEU 19 HD11 LEU 19 26.233 24.732 15.579 140 HD12 LEU 19 HD12 LEU 19 27.244 26.185 15.446 141 HD13 LEU 19 HD13 LEU 19 25.543 26.354 15.874 142 HD21 LEU 19 HD21 LEU 19 26.805 25.368 11.921 143 HD22 LEU 19 HD22 LEU 19 27.944 25.599 13.253 144 HD23 LEU 19 HD23 LEU 19 26.948 24.134 13.193 145 H LEU 20 H LEU 20 23.334 22.994 12.459 146 HA LEU 20 HA LEU 20 20.395 23.247 12.012 147 HB2 LEU 20 HB2 LEU 20 21.437 21.246 11.111 148 HB3 LEU 20 HB3 LEU 20 22.276 20.928 12.633 149 HG LEU 20 HG LEU 20 20.098 20.397 13.715 150 HD11 LEU 20 HD11 LEU 20 18.982 20.557 10.874 151 HD12 LEU 20 HD12 LEU 20 18.099 20.111 12.350 152 HD13 LEU 20 HD13 LEU 20 18.655 21.776 12.113 153 HD21 LEU 20 HD21 LEU 20 21.445 18.609 12.790 154 HD22 LEU 20 HD22 LEU 20 19.722 18.278 12.525 155 HD23 LEU 20 HD23 LEU 20 20.729 18.855 11.183 156 H GLY 21 H GLY 21 19.067 22.471 13.882 157 HA2 GLY 21 HA2 GLY 21 20.443 22.513 16.519 158 HA3 GLY 21 HA3 GLY 21 18.918 23.354 16.378 159 H LYS 22 H LYS 22 19.718 21.037 18.015 160 HA LYS 22 HA LYS 22 17.395 19.318 17.496 161 HB2 LYS 22 HB2 LYS 22 20.260 18.328 17.766 162 HB3 LYS 22 HB3 LYS 22 18.846 17.331 18.144 163 HG2 LYS 22 HG2 LYS 22 18.020 17.805 15.756 164 HG3 LYS 22 HG3 LYS 22 19.653 18.450 15.450 165 HD2 LYS 22 HD2 LYS 22 20.608 16.269 16.285 166 HD3 LYS 22 HD3 LYS 22 18.952 15.658 16.444 167 HE2 LYS 22 HE2 LYS 22 18.604 16.129 14.003 168 HE3 LYS 22 HE3 LYS 22 20.318 16.566 13.901 169 HZ1 LYS 22 HZ1 LYS 22 20.042 14.297 13.270 170 HZ2 LYS 22 HZ2 LYS 22 20.847 14.296 14.686 171 HZ3 LYS 22 HZ3 LYS 22 19.227 13.901 14.647 172 H CYS 23 H CYS 23 16.419 18.811 19.440 173 HA CYS 23 HA CYS 23 17.924 19.320 21.954 174 HB2 CYS 23 HB2 CYS 23 16.650 21.324 21.376 175 HB3 CYS 23 HB3 CYS 23 15.174 20.393 21.386 176 H ILE 24 H ILE 24 18.101 17.010 21.533 177 HA ILE 24 HA ILE 24 15.710 15.367 22.129 178 HB ILE 24 HB ILE 24 18.504 14.455 21.386 179 HG12 ILE 24 HG12 ILE 24 16.131 15.005 19.552 180 HG13 ILE 24 HG13 ILE 24 17.631 15.954 19.601 181 HG21 ILE 24 HG21 ILE 24 15.782 13.097 21.144 182 HG22 ILE 24 HG22 ILE 24 17.366 12.349 20.822 183 HG23 ILE 24 HG23 ILE 24 16.924 12.787 22.466 184 HD11 ILE 24 HD11 ILE 24 18.924 14.106 18.755 185 HD12 ILE 24 HD12 ILE 24 17.487 13.046 18.724 186 HD13 ILE 24 HD13 ILE 24 17.561 14.465 17.682 187 H GLY 25 H GLY 25 15.314 14.633 24.134 188 HA2 GLY 25 HA2 GLY 25 15.591 14.206 26.400 189 HA3 GLY 25 HA3 GLY 25 17.343 14.105 26.171 190 H GLU 26 H GLU 26 15.195 16.823 25.385 191 HA GLU 26 HA GLU 26 15.131 18.999 25.993 192 HB2 GLU 26 HB2 GLU 26 15.368 17.764 28.740 193 HB3 GLU 26 HB3 GLU 26 14.710 19.349 28.382 194 HG2 GLU 26 HG2 GLU 26 13.524 16.733 27.374 195 HG3 GLU 26 HG3 GLU 26 12.967 17.648 28.773 196 H GLU 27 H GLU 27 17.932 18.231 25.417 197 HA GLU 27 HA GLU 27 19.091 20.748 26.550 198 HB2 GLU 27 HB2 GLU 27 20.545 18.154 25.933 199 HB3 GLU 27 HB3 GLU 27 21.351 19.711 26.152 200 HG2 GLU 27 HG2 GLU 27 20.531 19.892 28.442 201 HG3 GLU 27 HG3 GLU 27 19.607 18.390 28.271 202 H CYS 28 H CYS 28 19.307 22.258 25.006 203 HA CYS 28 HA CYS 28 18.863 21.480 22.204 204 HB2 CYS 28 HB2 CYS 28 17.593 23.348 23.033 205 HB3 CYS 28 HB3 CYS 28 19.055 24.174 23.565 206 H LYS 29 H LYS 29 20.457 20.824 21.032 207 HA LYS 29 HA LYS 29 23.214 21.926 21.251 208 HB2 LYS 29 HB2 LYS 29 22.444 19.323 21.295 209 HB3 LYS 29 HB3 LYS 29 22.418 19.546 19.542 210 HG2 LYS 29 HG2 LYS 29 24.823 20.549 19.831 211 HG3 LYS 29 HG3 LYS 29 24.751 19.914 21.461 212 HD2 LYS 29 HD2 LYS 29 24.767 18.416 18.841 213 HD3 LYS 29 HD3 LYS 29 25.936 18.303 20.161 214 HE2 LYS 29 HE2 LYS 29 23.062 17.280 20.150 215 HE3 LYS 29 HE3 LYS 29 24.513 16.297 19.995 216 HZ1 LYS 29 HZ1 LYS 29 23.697 16.190 22.201 217 HZ2 LYS 29 HZ2 LYS 29 25.110 17.025 22.289 218 HZ3 LYS 29 HZ3 LYS 29 23.682 17.821 22.408 219 H CYS 30 H CYS 30 23.924 23.287 19.598 220 HA CYS 30 HA CYS 30 22.456 23.062 17.007 221 HB2 CYS 30 HB2 CYS 30 24.482 25.198 17.473 222 HB3 CYS 30 HB3 CYS 30 23.188 25.109 16.271 223 H VAL 31 H VAL 31 23.513 22.569 15.188 224 HA VAL 31 HA VAL 31 25.876 20.845 15.728 225 HB VAL 31 HB VAL 31 23.664 19.840 13.976 226 HG11 VAL 31 HG11 VAL 31 24.379 17.733 15.006 227 HG12 VAL 31 HG12 VAL 31 25.774 18.611 14.378 228 HG13 VAL 31 HG13 VAL 31 25.428 18.617 16.125 229 HG21 VAL 31 HG21 VAL 31 22.462 18.840 15.890 230 HG22 VAL 31 HG22 VAL 31 23.413 19.836 17.013 231 HG23 VAL 31 HG23 VAL 31 22.282 20.595 15.862 232 HA PRO 32 HA PRO 32 27.019 22.237 11.545 233 HB2 PRO 32 HB2 PRO 32 29.413 20.794 11.381 234 HB3 PRO 32 HB3 PRO 32 29.212 22.446 12.012 235 HG2 PRO 32 HG2 PRO 32 29.778 20.007 13.526 236 HG3 PRO 32 HG3 PRO 32 29.824 21.719 14.048 237 HD2 PRO 32 HD2 PRO 32 27.774 19.735 14.554 238 HD3 PRO 32 HD3 PRO 32 27.927 21.400 15.186 239 H TYR 33 H TYR 33 25.271 21.226 10.721 240 HA TYR 33 HA TYR 33 24.891 18.417 10.297 241 HB2 TYR 33 HB2 TYR 33 23.090 19.011 8.856 242 HB3 TYR 33 HB3 TYR 33 23.085 20.014 10.285 243 HD1 TYR 33 HD1 TYR 33 23.866 19.917 6.654 244 HD2 TYR 33 HD2 TYR 33 23.279 22.405 10.113 245 HE1 TYR 33 HE1 TYR 33 24.008 21.944 5.203 246 HE2 TYR 33 HE2 TYR 33 23.428 24.459 8.657 247 HH TYR 33 HH TYR 33 23.828 25.256 6.500 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 14.346 19.019 35.276 2 H2 GLY 1 H2 GLY 1 14.105 18.082 33.944 3 H3 GLY 1 H3 GLY 1 14.679 17.414 35.347 4 HA2 GLY 1 HA2 GLY 1 12.376 16.849 35.080 5 HA3 GLY 1 HA3 GLY 1 12.640 17.896 36.491 6 H SER 2 H SER 2 10.912 17.456 33.667 7 HA SER 2 HA SER 2 9.291 18.498 32.584 8 HB2 SER 2 HB2 SER 2 8.891 20.076 35.125 9 HB3 SER 2 HB3 SER 2 7.705 19.833 33.832 10 HG SER 2 HG SER 2 7.304 18.365 35.421 11 H ALA 3 H ALA 3 12.012 20.237 32.720 12 HA ALA 3 HA ALA 3 10.914 22.793 31.753 13 HB1 ALA 3 HB1 ALA 3 13.220 23.526 31.746 14 HB2 ALA 3 HB2 ALA 3 12.879 22.706 33.278 15 HB3 ALA 3 HB3 ALA 3 13.794 21.871 31.999 16 H PHE 4 H PHE 4 9.920 20.865 30.199 17 HA PHE 4 HA PHE 4 11.464 19.763 28.150 18 HB2 PHE 4 HB2 PHE 4 8.522 20.492 27.968 19 HB3 PHE 4 HB3 PHE 4 9.356 19.247 27.053 20 HD1 PHE 4 HD1 PHE 4 10.753 17.536 28.810 21 HD2 PHE 4 HD2 PHE 4 7.065 19.638 29.569 22 HE1 PHE 4 HE1 PHE 4 10.130 15.839 30.514 23 HE2 PHE 4 HE2 PHE 4 6.442 17.939 31.267 24 HZ PHE 4 HZ PHE 4 7.966 16.025 31.729 25 H CYS 5 H CYS 5 11.915 20.209 26.060 26 HA CYS 5 HA CYS 5 11.417 22.970 25.042 27 HB2 CYS 5 HB2 CYS 5 13.541 22.873 23.925 28 HB3 CYS 5 HB3 CYS 5 13.783 22.549 25.626 29 H ASN 6 H ASN 6 11.372 23.150 22.689 30 HA ASN 6 HA ASN 6 10.443 20.697 21.236 31 HB2 ASN 6 HB2 ASN 6 8.836 22.583 21.152 32 HB3 ASN 6 HB3 ASN 6 10.103 23.646 20.522 33 HD21 ASN 6 HD22 ASN 6 8.191 23.827 18.846 34 HD22 ASN 6 HD21 ASN 6 8.310 22.639 17.548 35 H LEU 7 H LEU 7 12.005 19.754 19.962 36 HA LEU 7 HA LEU 7 14.581 20.833 19.439 37 HB2 LEU 7 HB2 LEU 7 14.126 18.514 19.061 38 HB3 LEU 7 HB3 LEU 7 12.946 18.860 17.807 39 HG LEU 7 HG LEU 7 15.747 19.961 17.364 40 HD11 LEU 7 HD11 LEU 7 16.447 17.734 16.454 41 HD12 LEU 7 HD12 LEU 7 16.107 17.605 18.194 42 HD13 LEU 7 HD13 LEU 7 14.929 17.026 17.009 43 HD21 LEU 7 HD21 LEU 7 15.307 19.243 15.046 44 HD22 LEU 7 HD22 LEU 7 13.726 18.595 15.530 45 HD23 LEU 7 HD23 LEU 7 14.056 20.337 15.605 46 H ARG 8 H ARG 8 11.615 21.133 17.437 47 HA ARG 8 HA ARG 8 12.858 22.466 15.275 48 HB2 ARG 8 HB2 ARG 8 10.469 21.351 15.678 49 HB3 ARG 8 HB3 ARG 8 9.972 22.983 16.118 50 HG2 ARG 8 HG2 ARG 8 11.300 22.225 13.488 51 HG3 ARG 8 HG3 ARG 8 9.554 22.205 13.738 52 HD2 ARG 8 HD2 ARG 8 9.410 24.345 13.229 53 HD3 ARG 8 HD3 ARG 8 10.392 24.773 14.624 54 HE ARG 8 HE ARG 8 12.418 24.342 13.119 55 HH11 ARG 8 HH22 ARG 8 9.452 25.321 11.452 56 HH12 ARG 8 HH21 ARG 8 10.359 25.407 9.936 57 HH21 ARG 8 HH11 ARG 8 13.366 24.664 11.269 58 HH22 ARG 8 HH12 ARG 8 12.429 25.200 9.858 59 H ARG 9 H ARG 9 11.640 23.796 18.261 60 HA ARG 9 HA ARG 9 11.922 26.575 17.360 61 HB2 ARG 9 HB2 ARG 9 10.152 25.641 18.900 62 HB3 ARG 9 HB3 ARG 9 11.395 25.534 20.156 63 HG2 ARG 9 HG2 ARG 9 11.689 27.957 20.124 64 HG3 ARG 9 HG3 ARG 9 10.702 28.096 18.662 65 HD2 ARG 9 HD2 ARG 9 9.347 28.699 20.637 66 HD3 ARG 9 HD3 ARG 9 8.736 27.234 19.860 67 HE ARG 9 HE ARG 9 10.538 27.091 22.263 68 HH11 ARG 9 HH11 ARG 9 7.269 26.530 21.086 69 HH12 ARG 9 HH12 ARG 9 6.970 25.318 22.315 70 HH21 ARG 9 HH21 ARG 9 10.021 25.591 23.824 71 HH22 ARG 9 HH22 ARG 9 8.519 24.727 23.746 72 H CYS 10 H CYS 10 13.969 24.259 19.098 73 HA CYS 10 HA CYS 10 15.950 26.363 19.739 74 HB2 CYS 10 HB2 CYS 10 15.723 24.267 21.135 75 HB3 CYS 10 HB3 CYS 10 16.360 23.372 19.729 76 H GLU 11 H GLU 11 15.426 23.834 17.267 77 HA GLU 11 HA GLU 11 17.657 23.875 15.690 78 HB2 GLU 11 HB2 GLU 11 15.775 22.476 15.372 79 HB3 GLU 11 HB3 GLU 11 14.767 23.825 14.923 80 HG2 GLU 11 HG2 GLU 11 17.177 23.587 13.258 81 HG3 GLU 11 HG3 GLU 11 16.206 22.128 13.252 82 H LEU 12 H LEU 12 14.933 26.159 15.441 83 HA LEU 12 HA LEU 12 16.148 27.819 13.544 84 HB2 LEU 12 HB2 LEU 12 13.927 28.084 15.565 85 HB3 LEU 12 HB3 LEU 12 14.285 29.432 14.473 86 HG LEU 12 HG LEU 12 13.615 26.598 13.538 87 HD11 LEU 12 HD11 LEU 12 11.698 27.621 14.669 88 HD12 LEU 12 HD12 LEU 12 11.881 29.103 13.698 89 HD13 LEU 12 HD13 LEU 12 11.422 27.569 12.923 90 HD21 LEU 12 HD21 LEU 12 13.848 29.255 12.036 91 HD22 LEU 12 HD22 LEU 12 14.875 27.816 11.820 92 HD23 LEU 12 HD23 LEU 12 13.184 27.759 11.356 93 H SER 13 H SER 13 16.469 27.954 17.055 94 HA SER 13 HA SER 13 17.766 30.565 17.209 95 HB2 SER 13 HB2 SER 13 16.696 29.550 19.178 96 HB3 SER 13 HB3 SER 13 17.783 28.162 19.081 97 HG SER 13 HG SER 13 18.646 29.453 20.578 98 H CYS 14 H CYS 14 18.858 27.175 17.064 99 HA CYS 14 HA CYS 14 21.683 27.656 16.840 100 HB2 CYS 14 HB2 CYS 14 19.786 25.436 16.071 101 HB3 CYS 14 HB3 CYS 14 21.518 25.331 15.838 102 H ARG 15 H ARG 15 19.088 27.755 14.374 103 HA ARG 15 HA ARG 15 20.929 27.578 12.140 104 HB2 ARG 15 HB2 ARG 15 18.177 28.508 12.675 105 HB3 ARG 15 HB3 ARG 15 18.752 28.515 10.998 106 HG2 ARG 15 HG2 ARG 15 19.204 25.899 12.378 107 HG3 ARG 15 HG3 ARG 15 17.492 26.364 12.249 108 HD2 ARG 15 HD2 ARG 15 17.785 26.813 9.830 109 HD3 ARG 15 HD3 ARG 15 19.423 26.153 9.918 110 HE ARG 15 HE ARG 15 16.856 24.701 10.524 111 HH11 ARG 15 HH21 ARG 15 20.231 24.300 9.730 112 HH12 ARG 15 HH22 ARG 15 19.897 22.853 8.757 113 HH21 ARG 15 HH11 ARG 15 16.525 22.855 9.367 114 HH22 ARG 15 HH12 ARG 15 17.896 21.856 8.943 115 H SER 16 H SER 16 19.912 30.244 14.141 116 HA SER 16 HA SER 16 20.543 32.489 12.505 117 HB2 SER 16 HB2 SER 16 19.585 32.343 14.911 118 HB3 SER 16 HB3 SER 16 21.265 32.228 15.441 119 HG SER 16 HG SER 16 20.593 34.405 15.391 120 H LEU 17 H LEU 17 22.482 29.991 13.735 121 HA LEU 17 HA LEU 17 25.109 31.261 13.525 122 HB2 LEU 17 HB2 LEU 17 24.547 28.398 14.238 123 HB3 LEU 17 HB3 LEU 17 25.792 29.459 14.857 124 HG LEU 17 HG LEU 17 22.803 29.559 15.623 125 HD11 LEU 17 HD11 LEU 17 24.025 27.562 16.454 126 HD12 LEU 17 HD12 LEU 17 25.284 28.615 17.122 127 HD13 LEU 17 HD13 LEU 17 23.635 28.685 17.775 128 HD21 LEU 17 HD21 LEU 17 23.537 31.093 17.388 129 HD22 LEU 17 HD22 LEU 17 25.199 31.056 16.761 130 HD23 LEU 17 HD23 LEU 17 23.902 31.791 15.808 131 H GLY 18 H GLY 18 23.136 29.989 11.203 132 HA2 GLY 18 HA2 GLY 18 23.487 29.005 9.145 133 HA3 GLY 18 HA3 GLY 18 25.229 29.025 9.440 134 H LEU 19 H LEU 19 23.429 27.426 11.915 135 HA LEU 19 HA LEU 19 24.428 24.788 10.956 136 HB2 LEU 19 HB2 LEU 19 23.761 25.678 13.783 137 HB3 LEU 19 HB3 LEU 19 24.532 24.183 13.310 138 HG LEU 19 HG LEU 19 25.742 26.944 13.142 139 HD11 LEU 19 HD11 LEU 19 27.321 26.018 14.769 140 HD12 LEU 19 HD12 LEU 19 25.665 25.929 15.380 141 HD13 LEU 19 HD13 LEU 19 26.466 24.464 14.751 142 HD21 LEU 19 HD21 LEU 19 26.547 25.706 11.200 143 HD22 LEU 19 HD22 LEU 19 27.813 25.748 12.421 144 HD23 LEU 19 HD23 LEU 19 26.848 24.274 12.207 145 H LEU 20 H LEU 20 23.203 23.089 12.479 146 HA LEU 20 HA LEU 20 20.240 23.281 12.183 147 HB2 LEU 20 HB2 LEU 20 21.230 21.325 11.113 148 HB3 LEU 20 HB3 LEU 20 22.159 20.956 12.578 149 HG LEU 20 HG LEU 20 20.179 20.273 13.761 150 HD11 LEU 20 HD11 LEU 20 18.007 20.101 12.646 151 HD12 LEU 20 HD12 LEU 20 18.505 21.796 12.586 152 HD13 LEU 20 HD13 LEU 20 18.672 20.783 11.151 153 HD21 LEU 20 HD21 LEU 20 19.641 18.308 12.337 154 HD22 LEU 20 HD22 LEU 20 20.395 19.099 10.951 155 HD23 LEU 20 HD23 LEU 20 21.395 18.648 12.339 156 H GLY 21 H GLY 21 19.144 22.453 14.137 157 HA2 GLY 21 HA2 GLY 21 20.737 22.377 16.628 158 HA3 GLY 21 HA3 GLY 21 19.320 23.384 16.670 159 H LYS 22 H LYS 22 20.019 21.035 18.157 160 HA LYS 22 HA LYS 22 17.739 19.227 17.593 161 HB2 LYS 22 HB2 LYS 22 20.639 18.428 18.033 162 HB3 LYS 22 HB3 LYS 22 19.261 17.313 18.143 163 HG2 LYS 22 HG2 LYS 22 18.684 18.067 15.733 164 HG3 LYS 22 HG3 LYS 22 20.292 18.811 15.718 165 HD2 LYS 22 HD2 LYS 22 21.241 16.526 16.346 166 HD3 LYS 22 HD3 LYS 22 19.603 15.870 16.097 167 HE2 LYS 22 HE2 LYS 22 19.603 16.707 13.769 168 HE3 LYS 22 HE3 LYS 22 21.188 17.457 14.032 169 HZ1 LYS 22 HZ1 LYS 22 22.072 15.183 14.404 170 HZ2 LYS 22 HZ2 LYS 22 20.607 14.564 13.940 171 HZ3 LYS 22 HZ3 LYS 22 21.530 15.454 12.893 172 H CYS 23 H CYS 23 16.526 19.904 19.285 173 HA CYS 23 HA CYS 23 17.722 19.718 22.002 174 HB2 CYS 23 HB2 CYS 23 16.866 21.923 21.443 175 HB3 CYS 23 HB3 CYS 23 15.257 21.280 21.323 176 H ILE 24 H ILE 24 17.684 17.510 21.766 177 HA ILE 24 HA ILE 24 15.094 16.112 22.056 178 HB ILE 24 HB ILE 24 17.886 14.937 22.127 179 HG12 ILE 24 HG12 ILE 24 16.101 15.481 19.718 180 HG13 ILE 24 HG13 ILE 24 17.724 16.135 20.024 181 HG21 ILE 24 HG21 ILE 24 15.990 13.541 23.025 182 HG22 ILE 24 HG22 ILE 24 15.175 13.693 21.453 183 HG23 ILE 24 HG23 ILE 24 16.725 12.839 21.595 184 HD11 ILE 24 HD11 ILE 24 17.907 14.445 18.367 185 HD12 ILE 24 HD12 ILE 24 18.662 13.836 19.857 186 HD13 ILE 24 HD13 ILE 24 17.049 13.252 19.356 187 H GLY 25 H GLY 25 14.238 16.504 24.021 188 HA2 GLY 25 HA2 GLY 25 13.799 16.095 26.224 189 HA3 GLY 25 HA3 GLY 25 15.199 15.039 26.231 190 H GLU 26 H GLU 26 14.053 18.300 26.761 191 HA GLU 26 HA GLU 26 14.752 20.099 27.936 192 HB2 GLU 26 HB2 GLU 26 16.078 18.074 29.755 193 HB3 GLU 26 HB3 GLU 26 15.684 19.741 30.160 194 HG2 GLU 26 HG2 GLU 26 13.266 19.242 29.848 195 HG3 GLU 26 HG3 GLU 26 13.669 17.545 29.576 196 H GLU 27 H GLU 27 16.951 18.943 25.898 197 HA GLU 27 HA GLU 27 19.068 20.876 26.717 198 HB2 GLU 27 HB2 GLU 27 19.583 18.832 27.920 199 HB3 GLU 27 HB3 GLU 27 19.472 17.874 26.440 200 HG2 GLU 27 HG2 GLU 27 21.439 19.100 25.524 201 HG3 GLU 27 HG3 GLU 27 21.523 20.054 27.016 202 H CYS 28 H CYS 28 19.926 21.870 25.008 203 HA CYS 28 HA CYS 28 19.464 20.734 22.310 204 HB2 CYS 28 HB2 CYS 28 18.340 22.880 23.034 205 HB3 CYS 28 HB3 CYS 28 19.930 23.625 23.023 206 H LYS 29 H LYS 29 20.960 20.302 20.951 207 HA LYS 29 HA LYS 29 23.751 21.361 21.233 208 HB2 LYS 29 HB2 LYS 29 23.234 18.781 21.225 209 HB3 LYS 29 HB3 LYS 29 22.848 19.002 19.524 210 HG2 LYS 29 HG2 LYS 29 25.234 20.099 19.370 211 HG3 LYS 29 HG3 LYS 29 25.510 19.383 20.958 212 HD2 LYS 29 HD2 LYS 29 24.870 17.952 18.349 213 HD3 LYS 29 HD3 LYS 29 26.411 17.949 19.180 214 HE2 LYS 29 HE2 LYS 29 23.854 16.731 20.331 215 HE3 LYS 29 HE3 LYS 29 25.000 15.849 19.317 216 HZ1 LYS 29 HZ1 LYS 29 25.528 15.429 21.596 217 HZ2 LYS 29 HZ2 LYS 29 26.737 16.339 20.985 218 HZ3 LYS 29 HZ3 LYS 29 25.602 17.008 21.983 219 H CYS 30 H CYS 30 24.512 22.631 19.466 220 HA CYS 30 HA CYS 30 22.749 22.740 17.041 221 HB2 CYS 30 HB2 CYS 30 24.846 24.832 17.474 222 HB3 CYS 30 HB3 CYS 30 23.447 24.839 16.379 223 H VAL 31 H VAL 31 23.655 22.420 15.107 224 HA VAL 31 HA VAL 31 26.021 20.609 15.309 225 HB VAL 31 HB VAL 31 23.452 19.783 13.961 226 HG11 VAL 31 HG11 VAL 31 25.555 18.517 13.580 227 HG12 VAL 31 HG12 VAL 31 25.722 18.297 15.338 228 HG13 VAL 31 HG13 VAL 31 24.363 17.559 14.465 229 HG21 VAL 31 HG21 VAL 31 22.630 20.252 16.181 230 HG22 VAL 31 HG22 VAL 31 22.889 18.508 16.050 231 HG23 VAL 31 HG23 VAL 31 24.069 19.512 16.918 232 HA PRO 32 HA PRO 32 26.752 22.307 11.144 233 HB2 PRO 32 HB2 PRO 32 29.251 20.665 11.554 234 HB3 PRO 32 HB3 PRO 32 29.064 22.316 10.882 235 HG2 PRO 32 HG2 PRO 32 29.950 22.022 13.414 236 HG3 PRO 32 HG3 PRO 32 28.698 23.242 13.072 237 HD2 PRO 32 HD2 PRO 32 28.300 20.409 14.096 238 HD3 PRO 32 HD3 PRO 32 27.691 21.950 14.778 239 H TYR 33 H TYR 33 25.051 21.178 10.369 240 HA TYR 33 HA TYR 33 24.700 18.392 10.241 241 HB2 TYR 33 HB2 TYR 33 22.779 18.879 8.833 242 HB3 TYR 33 HB3 TYR 33 22.872 19.903 10.245 243 HD1 TYR 33 HD1 TYR 33 23.295 19.781 6.571 244 HD2 TYR 33 HD2 TYR 33 23.085 22.308 10.043 245 HE1 TYR 33 HE1 TYR 33 23.258 21.786 5.087 246 HE2 TYR 33 HE2 TYR 33 23.104 24.346 8.545 247 HH TYR 33 HH TYR 33 23.210 24.046 4.969 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 13.612 17.070 23.218 2 H2 GLY 1 H2 GLY 1 12.279 17.763 23.893 3 H3 GLY 1 H3 GLY 1 12.505 17.830 22.256 4 HA2 GLY 1 HA2 GLY 1 12.210 15.495 22.021 5 HA3 GLY 1 HA3 GLY 1 12.080 15.361 23.789 6 H SER 2 H SER 2 10.091 15.335 24.574 7 HA SER 2 HA SER 2 8.003 17.105 23.430 8 HB2 SER 2 HB2 SER 2 7.673 14.118 23.906 9 HB3 SER 2 HB3 SER 2 6.306 15.232 23.739 10 HG SER 2 HG SER 2 7.126 15.872 21.734 11 H ALA 3 H ALA 3 9.774 16.589 26.066 12 HA ALA 3 HA ALA 3 7.492 16.770 27.986 13 HB1 ALA 3 HB1 ALA 3 10.384 16.004 28.505 14 HB2 ALA 3 HB2 ALA 3 9.014 15.908 29.625 15 HB3 ALA 3 HB3 ALA 3 9.057 14.852 28.209 16 H PHE 4 H PHE 4 10.476 18.496 26.999 17 HA PHE 4 HA PHE 4 9.619 20.822 28.641 18 HB2 PHE 4 HB2 PHE 4 10.992 19.272 30.046 19 HB3 PHE 4 HB3 PHE 4 12.330 19.480 28.922 20 HD1 PHE 4 HD1 PHE 4 10.062 21.327 31.263 21 HD2 PHE 4 HD2 PHE 4 13.847 21.310 29.197 22 HE1 PHE 4 HE1 PHE 4 10.791 23.311 32.560 23 HE2 PHE 4 HE2 PHE 4 14.552 23.302 30.498 24 HZ PHE 4 HZ PHE 4 13.034 24.310 32.177 25 H CYS 5 H CYS 5 11.282 19.680 25.782 26 HA CYS 5 HA CYS 5 11.658 22.520 24.942 27 HB2 CYS 5 HB2 CYS 5 13.795 21.596 25.905 28 HB3 CYS 5 HB3 CYS 5 13.740 20.318 24.699 29 H ASN 6 H ASN 6 10.989 22.871 22.849 30 HA ASN 6 HA ASN 6 10.533 20.583 21.004 31 HB2 ASN 6 HB2 ASN 6 10.243 23.603 20.655 32 HB3 ASN 6 HB3 ASN 6 9.971 22.423 19.373 33 HD21 ASN 6 HD22 ASN 6 8.042 21.191 19.357 34 HD22 ASN 6 HD21 ASN 6 6.803 21.394 20.595 35 H LEU 7 H LEU 7 12.079 19.834 19.644 36 HA LEU 7 HA LEU 7 14.721 20.981 19.421 37 HB2 LEU 7 HB2 LEU 7 14.577 18.709 18.941 38 HB3 LEU 7 HB3 LEU 7 13.227 18.907 17.823 39 HG LEU 7 HG LEU 7 15.981 20.057 17.193 40 HD11 LEU 7 HD11 LEU 7 16.129 17.573 17.693 41 HD12 LEU 7 HD12 LEU 7 14.819 17.292 16.542 42 HD13 LEU 7 HD13 LEU 7 16.372 17.908 15.968 43 HD21 LEU 7 HD21 LEU 7 15.287 19.632 14.833 44 HD22 LEU 7 HD22 LEU 7 13.679 19.138 15.403 45 HD23 LEU 7 HD23 LEU 7 14.245 20.804 15.590 46 H ARG 8 H ARG 8 11.820 21.330 17.262 47 HA ARG 8 HA ARG 8 12.830 22.982 15.338 48 HB2 ARG 8 HB2 ARG 8 10.562 22.246 15.297 49 HB3 ARG 8 HB3 ARG 8 10.174 23.075 16.802 50 HG2 ARG 8 HG2 ARG 8 9.186 24.169 14.829 51 HG3 ARG 8 HG3 ARG 8 10.232 25.231 15.759 52 HD2 ARG 8 HD2 ARG 8 10.620 25.658 13.440 53 HD3 ARG 8 HD3 ARG 8 12.055 24.896 14.077 54 HE ARG 8 HE ARG 8 11.568 22.871 12.900 55 HH11 ARG 8 HH11 ARG 8 9.013 25.218 12.232 56 HH12 ARG 8 HH12 ARG 8 8.834 24.586 10.588 57 HH21 ARG 8 HH21 ARG 8 11.380 22.424 10.719 58 HH22 ARG 8 HH22 ARG 8 9.999 23.050 9.854 59 H ARG 9 H ARG 9 11.897 24.214 18.579 60 HA ARG 9 HA ARG 9 12.635 26.947 17.767 61 HB2 ARG 9 HB2 ARG 9 11.438 25.766 20.277 62 HB3 ARG 9 HB3 ARG 9 12.049 27.437 20.236 63 HG2 ARG 9 HG2 ARG 9 10.683 27.933 18.281 64 HG3 ARG 9 HG3 ARG 9 10.063 26.278 18.213 65 HD2 ARG 9 HD2 ARG 9 9.637 28.062 20.631 66 HD3 ARG 9 HD3 ARG 9 8.607 28.159 19.209 67 HE ARG 9 HE ARG 9 8.577 26.096 21.237 68 HH11 ARG 9 HH11 ARG 9 7.636 26.706 17.845 69 HH12 ARG 9 HH12 ARG 9 6.284 25.606 18.005 70 HH21 ARG 9 HH21 ARG 9 7.026 24.562 21.170 71 HH22 ARG 9 HH22 ARG 9 5.833 24.598 19.892 72 H CYS 10 H CYS 10 14.356 24.366 19.299 73 HA CYS 10 HA CYS 10 16.683 26.045 19.983 74 HB2 CYS 10 HB2 CYS 10 16.461 24.014 21.185 75 HB3 CYS 10 HB3 CYS 10 16.042 23.120 19.735 76 H GLU 11 H GLU 11 15.566 23.989 17.273 77 HA GLU 11 HA GLU 11 17.767 24.098 15.594 78 HB2 GLU 11 HB2 GLU 11 15.567 22.747 15.390 79 HB3 GLU 11 HB3 GLU 11 14.994 24.137 14.452 80 HG2 GLU 11 HG2 GLU 11 17.306 23.732 13.188 81 HG3 GLU 11 HG3 GLU 11 17.163 22.143 13.905 82 H LEU 12 H LEU 12 14.986 26.358 15.626 83 HA LEU 12 HA LEU 12 16.134 27.998 13.608 84 HB2 LEU 12 HB2 LEU 12 13.814 28.078 15.457 85 HB3 LEU 12 HB3 LEU 12 14.283 29.637 14.748 86 HG LEU 12 HG LEU 12 13.895 27.136 13.044 87 HD11 LEU 12 HD11 LEU 12 11.659 27.966 12.503 88 HD12 LEU 12 HD12 LEU 12 11.790 27.665 14.247 89 HD13 LEU 12 HD13 LEU 12 11.865 29.325 13.629 90 HD21 LEU 12 HD21 LEU 12 15.157 28.994 11.952 91 HD22 LEU 12 HD22 LEU 12 13.549 28.822 11.238 92 HD23 LEU 12 HD23 LEU 12 13.867 30.124 12.394 93 H SER 13 H SER 13 16.414 28.275 17.165 94 HA SER 13 HA SER 13 17.904 30.762 17.044 95 HB2 SER 13 HB2 SER 13 17.765 28.591 19.172 96 HB3 SER 13 HB3 SER 13 18.586 30.156 19.369 97 HG SER 13 HG SER 13 16.373 30.127 20.132 98 H CYS 14 H CYS 14 18.821 27.342 16.870 99 HA CYS 14 HA CYS 14 21.672 27.757 16.687 100 HB2 CYS 14 HB2 CYS 14 19.758 25.539 15.946 101 HB3 CYS 14 HB3 CYS 14 21.495 25.433 15.720 102 H ARG 15 H ARG 15 19.088 27.985 14.327 103 HA ARG 15 HA ARG 15 20.893 27.749 12.032 104 HB2 ARG 15 HB2 ARG 15 18.055 28.277 12.647 105 HB3 ARG 15 HB3 ARG 15 18.547 28.544 10.962 106 HG2 ARG 15 HG2 ARG 15 19.256 26.281 10.662 107 HG3 ARG 15 HG3 ARG 15 19.108 25.905 12.377 108 HD2 ARG 15 HD2 ARG 15 17.306 24.905 11.069 109 HD3 ARG 15 HD3 ARG 15 16.657 26.082 12.226 110 HE ARG 15 HE ARG 15 17.128 27.237 9.596 111 HH11 ARG 15 HH11 ARG 15 14.824 25.058 11.094 112 HH12 ARG 15 HH12 ARG 15 13.494 25.735 10.181 113 HH21 ARG 15 HH21 ARG 15 15.358 28.057 8.510 114 HH22 ARG 15 HH22 ARG 15 13.762 27.478 8.907 115 H SER 16 H SER 16 19.742 30.374 14.013 116 HA SER 16 HA SER 16 20.406 32.696 12.527 117 HB2 SER 16 HB2 SER 16 21.148 31.894 15.376 118 HB3 SER 16 HB3 SER 16 21.135 33.557 14.751 119 HG SER 16 HG SER 16 18.893 33.367 14.436 120 H LEU 17 H LEU 17 22.358 30.006 13.375 121 HA LEU 17 HA LEU 17 24.977 31.362 13.289 122 HB2 LEU 17 HB2 LEU 17 24.482 28.504 14.048 123 HB3 LEU 17 HB3 LEU 17 25.684 29.619 14.657 124 HG LEU 17 HG LEU 17 22.692 29.664 15.388 125 HD11 LEU 17 HD11 LEU 17 23.522 28.863 17.572 126 HD12 LEU 17 HD12 LEU 17 23.956 27.715 16.289 127 HD13 LEU 17 HD13 LEU 17 25.182 28.817 16.944 128 HD21 LEU 17 HD21 LEU 17 23.768 31.921 15.531 129 HD22 LEU 17 HD22 LEU 17 23.353 31.251 17.114 130 HD23 LEU 17 HD23 LEU 17 25.037 31.223 16.547 131 H GLY 18 H GLY 18 23.064 29.903 11.018 132 HA2 GLY 18 HA2 GLY 18 23.481 28.843 9.002 133 HA3 GLY 18 HA3 GLY 18 25.208 28.820 9.360 134 H LEU 19 H LEU 19 23.658 27.413 12.009 135 HA LEU 19 HA LEU 19 24.470 24.706 11.113 136 HB2 LEU 19 HB2 LEU 19 23.831 25.725 13.899 137 HB3 LEU 19 HB3 LEU 19 24.587 24.202 13.492 138 HG LEU 19 HG LEU 19 25.819 26.954 13.087 139 HD11 LEU 19 HD11 LEU 19 27.359 26.229 14.849 140 HD12 LEU 19 HD12 LEU 19 25.691 26.241 15.434 141 HD13 LEU 19 HD13 LEU 19 26.479 24.698 15.017 142 HD21 LEU 19 HD21 LEU 19 26.981 24.171 12.587 143 HD22 LEU 19 HD22 LEU 19 26.647 25.409 11.346 144 HD23 LEU 19 HD23 LEU 19 27.894 25.694 12.556 145 H LEU 20 H LEU 20 23.214 22.985 12.536 146 HA LEU 20 HA LEU 20 20.255 23.240 12.217 147 HB2 LEU 20 HB2 LEU 20 21.212 21.243 11.211 148 HB3 LEU 20 HB3 LEU 20 22.159 20.912 12.668 149 HG LEU 20 HG LEU 20 20.016 20.396 13.875 150 HD11 LEU 20 HD11 LEU 20 18.819 20.381 11.065 151 HD12 LEU 20 HD12 LEU 20 17.977 20.105 12.604 152 HD13 LEU 20 HD13 LEU 20 18.563 21.725 12.171 153 HD21 LEU 20 HD21 LEU 20 20.588 18.806 11.365 154 HD22 LEU 20 HD22 LEU 20 21.405 18.624 12.930 155 HD23 LEU 20 HD23 LEU 20 19.675 18.246 12.777 156 H GLY 21 H GLY 21 19.054 22.409 14.197 157 HA2 GLY 21 HA2 GLY 21 20.664 22.355 16.674 158 HA3 GLY 21 HA3 GLY 21 19.163 23.233 16.753 159 H LYS 22 H LYS 22 19.937 20.986 18.270 160 HA LYS 22 HA LYS 22 17.799 19.031 17.732 161 HB2 LYS 22 HB2 LYS 22 20.738 18.324 18.005 162 HB3 LYS 22 HB3 LYS 22 19.416 17.187 18.291 163 HG2 LYS 22 HG2 LYS 22 18.610 17.795 15.896 164 HG3 LYS 22 HG3 LYS 22 20.218 18.508 15.675 165 HD2 LYS 22 HD2 LYS 22 21.205 16.302 16.377 166 HD3 LYS 22 HD3 LYS 22 19.560 15.648 16.500 167 HE2 LYS 22 HE2 LYS 22 19.200 16.169 14.093 168 HE3 LYS 22 HE3 LYS 22 20.897 16.697 13.977 169 HZ1 LYS 22 HZ1 LYS 22 20.489 14.315 13.308 170 HZ2 LYS 22 HZ2 LYS 22 21.580 14.454 14.575 171 HZ3 LYS 22 HZ3 LYS 22 20.043 13.991 14.834 172 H CYS 23 H CYS 23 16.649 19.651 19.473 173 HA CYS 23 HA CYS 23 17.936 19.749 22.137 174 HB2 CYS 23 HB2 CYS 23 16.581 21.651 21.221 175 HB3 CYS 23 HB3 CYS 23 15.174 20.655 21.460 176 H ILE 24 H ILE 24 17.953 17.361 21.264 177 HA ILE 24 HA ILE 24 15.908 15.805 22.741 178 HB ILE 24 HB ILE 24 17.018 13.852 21.492 179 HG12 ILE 24 HG12 ILE 24 17.631 16.096 19.530 180 HG13 ILE 24 HG13 ILE 24 18.847 15.357 20.517 181 HG21 ILE 24 HG21 ILE 24 15.186 15.815 20.039 182 HG22 ILE 24 HG22 ILE 24 15.361 14.085 19.671 183 HG23 ILE 24 HG23 ILE 24 14.679 14.587 21.217 184 HD11 ILE 24 HD11 ILE 24 17.276 14.030 18.293 185 HD12 ILE 24 HD12 ILE 24 19.020 14.354 18.385 186 HD13 ILE 24 HD13 ILE 24 18.293 13.123 19.439 187 H GLY 25 H GLY 25 18.499 14.629 24.950 188 HA2 GLY 25 HA2 GLY 25 15.889 13.775 24.232 189 HA3 GLY 25 HA3 GLY 25 16.535 13.918 25.870 190 H GLU 26 H GLU 26 16.729 16.450 26.553 191 HA GLU 26 HA GLU 26 14.624 18.107 25.232 192 HB2 GLU 26 HB2 GLU 26 14.863 18.039 28.243 193 HB3 GLU 26 HB3 GLU 26 13.723 18.955 27.271 194 HG2 GLU 26 HG3 GLU 26 13.770 15.936 27.610 195 HG3 GLU 26 HG2 GLU 26 12.694 17.051 28.428 196 H GLU 27 H GLU 27 17.582 17.969 25.171 197 HA GLU 27 HA GLU 27 18.362 20.630 26.323 198 HB2 GLU 27 HB2 GLU 27 20.528 19.512 26.874 199 HB3 GLU 27 HB3 GLU 27 19.125 18.961 27.784 200 HG2 GLU 27 HG2 GLU 27 19.415 17.223 25.471 201 HG3 GLU 27 HG3 GLU 27 20.980 17.428 26.212 202 H CYS 28 H CYS 28 19.366 22.026 25.037 203 HA CYS 28 HA CYS 28 19.261 21.386 22.202 204 HB2 CYS 28 HB2 CYS 28 18.259 23.386 23.177 205 HB3 CYS 28 HB3 CYS 28 19.812 23.957 23.678 206 H LYS 29 H LYS 29 20.886 20.488 21.125 207 HA LYS 29 HA LYS 29 23.632 21.691 21.278 208 HB2 LYS 29 HB2 LYS 29 23.370 19.149 21.266 209 HB3 LYS 29 HB3 LYS 29 22.703 19.266 19.627 210 HG2 LYS 29 HG2 LYS 29 24.881 20.458 18.998 211 HG3 LYS 29 HG3 LYS 29 25.497 20.137 20.598 212 HD2 LYS 29 HD2 LYS 29 24.890 18.155 18.353 213 HD3 LYS 29 HD3 LYS 29 26.436 18.557 19.103 214 HE2 LYS 29 HE2 LYS 29 25.373 17.650 21.296 215 HE3 LYS 29 HE3 LYS 29 24.136 16.973 20.223 216 HZ1 LYS 29 HZ1 LYS 29 25.880 15.738 19.075 217 HZ2 LYS 29 HZ2 LYS 29 27.059 16.441 20.002 218 HZ3 LYS 29 HZ3 LYS 29 25.990 15.411 20.673 219 H CYS 30 H CYS 30 24.417 22.857 19.457 220 HA CYS 30 HA CYS 30 22.644 22.924 17.062 221 HB2 CYS 30 HB2 CYS 30 24.813 24.966 17.428 222 HB3 CYS 30 HB3 CYS 30 23.443 24.949 16.283 223 H VAL 31 H VAL 31 23.466 22.276 15.193 224 HA VAL 31 HA VAL 31 25.845 20.522 15.578 225 HB VAL 31 HB VAL 31 23.399 19.671 14.052 226 HG11 VAL 31 HG11 VAL 31 25.493 18.329 13.976 227 HG12 VAL 31 HG12 VAL 31 25.440 18.183 15.747 228 HG13 VAL 31 HG13 VAL 31 24.165 17.457 14.746 229 HG21 VAL 31 HG21 VAL 31 22.591 18.535 16.146 230 HG22 VAL 31 HG22 VAL 31 23.675 19.584 17.071 231 HG23 VAL 31 HG23 VAL 31 22.346 20.286 16.123 232 HA PRO 32 HA PRO 32 26.898 21.939 11.382 233 HB2 PRO 32 HB2 PRO 32 29.057 19.879 11.634 234 HB3 PRO 32 HB3 PRO 32 29.170 21.599 11.164 235 HG2 PRO 32 HG2 PRO 32 29.996 20.746 13.621 236 HG3 PRO 32 HG3 PRO 32 29.103 22.297 13.440 237 HD2 PRO 32 HD2 PRO 32 27.983 19.584 14.218 238 HD3 PRO 32 HD3 PRO 32 27.767 21.174 15.022 239 H TYR 33 H TYR 33 25.009 21.090 10.488 240 HA TYR 33 HA TYR 33 24.531 18.268 10.200 241 HB2 TYR 33 HB2 TYR 33 22.626 18.766 8.903 242 HB3 TYR 33 HB3 TYR 33 22.706 19.767 10.329 243 HD1 TYR 33 HD1 TYR 33 22.930 19.715 6.638 244 HD2 TYR 33 HD2 TYR 33 22.953 22.175 10.161 245 HE1 TYR 33 HE1 TYR 33 22.585 21.739 5.215 246 HE2 TYR 33 HE2 TYR 33 22.562 24.210 8.748 247 HH TYR 33 HH TYR 33 22.224 25.011 6.618 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 10.267 22.566 32.688 2 H2 GLY 1 H2 GLY 1 9.554 23.754 31.794 3 H3 GLY 1 H3 GLY 1 9.742 23.957 33.422 4 HA2 GLY 1 HA2 GLY 1 12.070 24.110 33.269 5 HA3 GLY 1 HA3 GLY 1 11.974 23.674 31.549 6 H SER 2 H SER 2 12.919 26.155 33.073 7 HA SER 2 HA SER 2 11.156 28.314 32.368 8 HB2 SER 2 HB2 SER 2 13.132 29.730 33.063 9 HB3 SER 2 HB3 SER 2 12.552 28.575 34.261 10 HG SER 2 HG SER 2 14.249 27.313 33.980 11 H ALA 3 H ALA 3 12.929 26.546 30.176 12 HA ALA 3 HA ALA 3 13.094 28.871 28.307 13 HB1 ALA 3 HB1 ALA 3 14.968 26.483 28.479 14 HB2 ALA 3 HB2 ALA 3 15.077 27.826 27.327 15 HB3 ALA 3 HB3 ALA 3 15.323 28.126 29.055 16 H PHE 4 H PHE 4 11.378 26.027 28.815 17 HA PHE 4 HA PHE 4 10.106 24.659 27.496 18 HB2 PHE 4 HB2 PHE 4 9.722 27.274 26.012 19 HB3 PHE 4 HB3 PHE 4 8.632 25.899 25.994 20 HD1 PHE 4 HD2 PHE 4 7.235 25.335 27.946 21 HD2 PHE 4 HD1 PHE 4 9.814 28.792 27.950 22 HE1 PHE 4 HE2 PHE 4 5.985 26.266 29.876 23 HE2 PHE 4 HE1 PHE 4 8.571 29.711 29.894 24 HZ PHE 4 HZ PHE 4 6.645 28.464 30.844 25 H CYS 5 H CYS 5 12.447 23.800 26.810 26 HA CYS 5 HA CYS 5 13.201 24.270 24.049 27 HB2 CYS 5 HB2 CYS 5 14.743 23.799 26.002 28 HB3 CYS 5 HB3 CYS 5 14.278 22.111 25.884 29 H ASN 6 H ASN 6 12.125 23.506 22.434 30 HA ASN 6 HA ASN 6 11.626 20.563 22.178 31 HB2 ASN 6 HB2 ASN 6 10.312 22.919 20.710 32 HB3 ASN 6 HB3 ASN 6 10.148 21.253 20.219 33 HD21 ASN 6 HD22 ASN 6 7.885 22.647 20.718 34 HD22 ASN 6 HD21 ASN 6 7.154 21.980 22.187 35 H LEU 7 H LEU 7 12.504 19.654 20.107 36 HA LEU 7 HA LEU 7 14.973 20.813 19.243 37 HB2 LEU 7 HB2 LEU 7 14.484 18.467 18.964 38 HB3 LEU 7 HB3 LEU 7 13.200 18.813 17.809 39 HG LEU 7 HG LEU 7 15.965 19.911 17.257 40 HD11 LEU 7 HD11 LEU 7 16.373 17.573 17.948 41 HD12 LEU 7 HD12 LEU 7 15.115 17.020 16.834 42 HD13 LEU 7 HD13 LEU 7 16.595 17.753 16.195 43 HD21 LEU 7 HD21 LEU 7 13.809 18.710 15.463 44 HD22 LEU 7 HD22 LEU 7 14.211 20.436 15.604 45 HD23 LEU 7 HD23 LEU 7 15.381 19.324 14.913 46 H ARG 8 H ARG 8 11.778 20.959 17.636 47 HA ARG 8 HA ARG 8 12.395 22.470 15.432 48 HB2 ARG 8 HB2 ARG 8 10.132 21.521 16.162 49 HB3 ARG 8 HB3 ARG 8 9.981 22.851 17.293 50 HG2 ARG 8 HG2 ARG 8 8.631 23.377 15.443 51 HG3 ARG 8 HG3 ARG 8 10.001 24.466 15.300 52 HD2 ARG 8 HD2 ARG 8 9.978 21.754 13.949 53 HD3 ARG 8 HD3 ARG 8 9.078 23.096 13.235 54 HE ARG 8 HE ARG 8 12.025 22.829 13.358 55 HH11 ARG 8 HH21 ARG 8 9.378 24.955 12.384 56 HH12 ARG 8 HH22 ARG 8 10.430 25.745 11.228 57 HH21 ARG 8 HH11 ARG 8 13.151 23.813 11.918 58 HH22 ARG 8 HH12 ARG 8 12.537 25.163 10.980 59 H ARG 9 H ARG 9 11.817 23.812 18.621 60 HA ARG 9 HA ARG 9 12.223 26.568 17.609 61 HB2 ARG 9 HB2 ARG 9 10.195 25.826 18.846 62 HB3 ARG 9 HB3 ARG 9 11.196 25.615 20.290 63 HG2 ARG 9 HG2 ARG 9 11.701 28.038 20.305 64 HG3 ARG 9 HG3 ARG 9 10.908 28.239 18.729 65 HD2 ARG 9 HD2 ARG 9 9.471 28.968 20.640 66 HD3 ARG 9 HD3 ARG 9 8.763 27.682 19.646 67 HE ARG 9 HE ARG 9 10.242 26.944 22.128 68 HH11 ARG 9 HH11 ARG 9 7.071 27.084 20.542 69 HH12 ARG 9 HH12 ARG 9 6.468 25.792 21.583 70 HH21 ARG 9 HH21 ARG 9 9.256 25.396 23.448 71 HH22 ARG 9 HH22 ARG 9 7.594 24.931 23.077 72 H CYS 10 H CYS 10 14.152 24.192 19.159 73 HA CYS 10 HA CYS 10 16.193 26.220 19.899 74 HB2 CYS 10 HB2 CYS 10 16.122 23.912 20.930 75 HB3 CYS 10 HB3 CYS 10 16.519 23.262 19.326 76 H GLU 11 H GLU 11 15.239 24.103 17.203 77 HA GLU 11 HA GLU 11 17.353 24.060 15.616 78 HB2 GLU 11 HB2 GLU 11 14.925 23.093 15.313 79 HB3 GLU 11 HB3 GLU 11 14.747 24.495 14.231 80 HG2 GLU 11 HG2 GLU 11 16.958 23.598 13.177 81 HG3 GLU 11 HG3 GLU 11 16.597 22.126 14.054 82 H LEU 12 H LEU 12 14.969 26.634 15.518 83 HA LEU 12 HA LEU 12 16.057 28.080 13.320 84 HB2 LEU 12 HB2 LEU 12 14.025 28.581 15.493 85 HB3 LEU 12 HB3 LEU 12 14.263 29.734 14.161 86 HG LEU 12 HG LEU 12 13.622 26.778 13.674 87 HD11 LEU 12 HD11 LEU 12 11.293 27.459 13.348 88 HD12 LEU 12 HD12 LEU 12 11.808 27.778 15.008 89 HD13 LEU 12 HD13 LEU 12 11.689 29.118 13.848 90 HD21 LEU 12 HD21 LEU 12 14.530 27.994 11.715 91 HD22 LEU 12 HD22 LEU 12 12.804 27.659 11.511 92 HD23 LEU 12 HD23 LEU 12 13.330 29.281 11.971 93 H SER 13 H SER 13 16.366 28.684 16.853 94 HA SER 13 HA SER 13 17.884 31.133 16.573 95 HB2 SER 13 HB2 SER 13 18.104 29.139 18.856 96 HB3 SER 13 HB3 SER 13 18.383 30.890 18.894 97 HG SER 13 HG SER 13 16.050 30.999 18.220 98 H CYS 14 H CYS 14 18.703 27.714 16.538 99 HA CYS 14 HA CYS 14 21.598 28.079 16.420 100 HB2 CYS 14 HB2 CYS 14 19.614 25.861 16.044 101 HB3 CYS 14 HB3 CYS 14 21.322 25.622 15.707 102 H ARG 15 H ARG 15 19.016 28.079 13.985 103 HA ARG 15 HA ARG 15 20.842 27.532 11.786 104 HB2 ARG 15 HB2 ARG 15 18.090 28.459 12.235 105 HB3 ARG 15 HB3 ARG 15 18.683 28.499 10.560 106 HG2 ARG 15 HG2 ARG 15 19.252 26.158 10.580 107 HG3 ARG 15 HG3 ARG 15 18.799 25.958 12.256 108 HD2 ARG 15 HD2 ARG 15 16.451 26.350 11.757 109 HD3 ARG 15 HD3 ARG 15 16.815 26.867 10.116 110 HE ARG 15 HE ARG 15 16.524 24.139 11.055 111 HH11 ARG 15 HH12 ARG 15 18.018 25.980 8.450 112 HH12 ARG 15 HH11 ARG 15 18.388 24.515 7.563 113 HH21 ARG 15 HH21 ARG 15 16.951 22.461 9.957 114 HH22 ARG 15 HH22 ARG 15 17.975 22.488 8.526 115 H SER 16 H SER 16 19.856 30.480 13.381 116 HA SER 16 HA SER 16 20.806 32.545 11.753 117 HB2 SER 16 HB2 SER 16 21.314 31.976 14.717 118 HB3 SER 16 HB3 SER 16 21.504 33.566 13.952 119 HG SER 16 HG SER 16 19.488 33.094 15.093 120 H LEU 17 H LEU 17 22.580 29.840 12.717 121 HA LEU 17 HA LEU 17 25.257 31.120 12.758 122 HB2 LEU 17 HB2 LEU 17 24.529 28.419 13.865 123 HB3 LEU 17 HB3 LEU 17 25.768 29.530 14.404 124 HG LEU 17 HG LEU 17 22.739 29.832 14.922 125 HD11 LEU 17 HD11 LEU 17 23.879 27.968 16.126 126 HD12 LEU 17 HD12 LEU 17 25.106 29.106 16.715 127 HD13 LEU 17 HD13 LEU 17 23.418 29.277 17.228 128 HD21 LEU 17 HD21 LEU 17 23.908 32.042 14.815 129 HD22 LEU 17 HD22 LEU 17 23.424 31.628 16.457 130 HD23 LEU 17 HD23 LEU 17 25.112 31.439 15.943 131 H GLY 18 H GLY 18 23.360 29.325 10.654 132 HA2 GLY 18 HA2 GLY 18 23.841 27.877 8.895 133 HA3 GLY 18 HA3 GLY 18 25.560 27.972 9.277 134 H LEU 19 H LEU 19 23.372 27.069 11.872 135 HA LEU 19 HA LEU 19 24.272 24.223 11.732 136 HB2 LEU 19 HB2 LEU 19 23.864 25.878 14.236 137 HB3 LEU 19 HB3 LEU 19 24.479 24.240 14.136 138 HG LEU 19 HG LEU 19 25.905 26.735 13.156 139 HD11 LEU 19 HD11 LEU 19 26.397 24.922 15.550 140 HD12 LEU 19 HD12 LEU 19 27.417 26.270 15.036 141 HD13 LEU 19 HD13 LEU 19 25.776 26.593 15.598 142 HD21 LEU 19 HD21 LEU 19 27.863 25.303 12.881 143 HD22 LEU 19 HD22 LEU 19 26.959 23.894 13.416 144 HD23 LEU 19 HD23 LEU 19 26.563 24.678 11.862 145 H LEU 20 H LEU 20 22.956 22.844 13.261 146 HA LEU 20 HA LEU 20 20.014 23.358 12.986 147 HB2 LEU 20 HB2 LEU 20 20.810 21.519 11.595 148 HB3 LEU 20 HB3 LEU 20 21.730 20.856 12.939 149 HG LEU 20 HG LEU 20 19.324 20.643 14.089 150 HD11 LEU 20 HD11 LEU 20 18.248 21.908 12.180 151 HD12 LEU 20 HD12 LEU 20 18.652 20.548 11.124 152 HD13 LEU 20 HD13 LEU 20 17.551 20.302 12.492 153 HD21 LEU 20 HD21 LEU 20 20.738 18.731 13.582 154 HD22 LEU 20 HD22 LEU 20 19.072 18.408 13.068 155 HD23 LEU 20 HD23 LEU 20 20.309 18.826 11.865 156 H GLY 21 H GLY 21 19.200 23.917 14.912 157 HA2 GLY 21 HA2 GLY 21 20.373 23.180 17.495 158 HA3 GLY 21 HA3 GLY 21 18.826 23.983 17.247 159 H LYS 22 H LYS 22 20.367 21.136 18.129 160 HA LYS 22 HA LYS 22 18.082 19.359 17.485 161 HB2 LYS 22 HB2 LYS 22 20.192 18.983 16.361 162 HB3 LYS 22 HB3 LYS 22 21.040 18.820 17.905 163 HG2 LYS 22 HG2 LYS 22 20.031 16.766 18.386 164 HG3 LYS 22 HG3 LYS 22 18.667 17.038 17.295 165 HD2 LYS 22 HD2 LYS 22 20.161 15.333 16.409 166 HD3 LYS 22 HD3 LYS 22 20.077 16.745 15.348 167 HE2 LYS 22 HE2 LYS 22 22.237 17.548 16.132 168 HE3 LYS 22 HE3 LYS 22 22.306 16.305 17.388 169 HZ1 LYS 22 HZ1 LYS 22 22.587 14.638 15.803 170 HZ2 LYS 22 HZ2 LYS 22 22.164 15.581 14.518 171 HZ3 LYS 22 HZ3 LYS 22 23.601 15.810 15.260 172 H CYS 23 H CYS 23 16.921 20.135 19.298 173 HA CYS 23 HA CYS 23 17.919 19.458 22.003 174 HB2 CYS 23 HB2 CYS 23 17.041 21.650 21.737 175 HB3 CYS 23 HB3 CYS 23 15.544 21.073 21.111 176 H ILE 24 H ILE 24 17.939 17.209 21.479 177 HA ILE 24 HA ILE 24 15.487 15.701 21.141 178 HB ILE 24 HB ILE 24 18.172 14.585 22.009 179 HG12 ILE 24 HG12 ILE 24 17.359 15.429 19.200 180 HG13 ILE 24 HG13 ILE 24 18.739 16.007 20.159 181 HG21 ILE 24 HG21 ILE 24 16.146 13.080 21.998 182 HG22 ILE 24 HG22 ILE 24 15.957 13.411 20.262 183 HG23 ILE 24 HG23 ILE 24 17.391 12.562 20.880 184 HD11 ILE 24 HD11 ILE 24 18.428 13.255 18.933 185 HD12 ILE 24 HD12 ILE 24 19.591 14.515 18.520 186 HD13 ILE 24 HD13 ILE 24 19.716 13.708 20.088 187 H GLY 25 H GLY 25 17.833 15.880 23.856 188 HA2 GLY 25 HA2 GLY 25 16.128 14.378 25.665 189 HA3 GLY 25 HA3 GLY 25 17.710 15.082 26.012 190 H GLU 26 H GLU 26 15.153 17.133 24.781 191 HA GLU 26 HA GLU 26 14.432 19.148 25.541 192 HB2 GLU 26 HB2 GLU 26 13.966 17.646 28.130 193 HB3 GLU 26 HB3 GLU 26 13.298 19.233 27.711 194 HG2 GLU 26 HG2 GLU 26 12.024 18.357 25.888 195 HG3 GLU 26 HG3 GLU 26 12.833 16.792 25.957 196 H GLU 27 H GLU 27 17.118 18.821 25.424 197 HA GLU 27 HA GLU 27 18.002 21.279 26.597 198 HB2 GLU 27 HB2 GLU 27 20.168 20.332 27.460 199 HB3 GLU 27 HB3 GLU 27 18.749 20.074 28.448 200 HG2 GLU 27 HG2 GLU 27 19.917 18.092 28.637 201 HG3 GLU 27 HG3 GLU 27 18.616 17.700 27.536 202 H CYS 28 H CYS 28 19.916 22.081 25.306 203 HA CYS 28 HA CYS 28 19.812 20.717 22.638 204 HB2 CYS 28 HB2 CYS 28 18.315 22.754 23.034 205 HB3 CYS 28 HB3 CYS 28 19.797 23.701 22.982 206 H LYS 29 H LYS 29 21.454 20.457 21.419 207 HA LYS 29 HA LYS 29 23.856 22.212 21.461 208 HB2 LYS 29 HB2 LYS 29 24.154 19.748 21.862 209 HB3 LYS 29 HB3 LYS 29 23.293 19.398 20.366 210 HG2 LYS 29 HG2 LYS 29 25.060 20.722 19.137 211 HG3 LYS 29 HG3 LYS 29 25.950 20.883 20.647 212 HD2 LYS 29 HD2 LYS 29 25.168 18.152 19.490 213 HD3 LYS 29 HD3 LYS 29 26.587 19.057 18.957 214 HE2 LYS 29 HE2 LYS 29 27.507 17.710 20.379 215 HE3 LYS 29 HE3 LYS 29 27.343 19.211 21.316 216 HZ1 LYS 29 HZ1 LYS 29 26.783 17.010 22.434 217 HZ2 LYS 29 HZ2 LYS 29 25.672 18.198 22.649 218 HZ3 LYS 29 HZ3 LYS 29 25.416 16.950 21.566 219 H CYS 30 H CYS 30 24.024 23.616 19.636 220 HA CYS 30 HA CYS 30 22.473 22.989 17.175 221 HB2 CYS 30 HB2 CYS 30 24.677 25.004 17.189 222 HB3 CYS 30 HB3 CYS 30 23.224 24.898 16.175 223 H VAL 31 H VAL 31 23.326 21.898 15.467 224 HA VAL 31 HA VAL 31 26.239 21.205 15.547 225 HB VAL 31 HB VAL 31 25.604 19.059 14.571 226 HG11 VAL 31 HG11 VAL 31 24.237 19.559 17.229 227 HG12 VAL 31 HG12 VAL 31 24.846 18.008 16.595 228 HG13 VAL 31 HG13 VAL 31 25.985 19.315 16.947 229 HG21 VAL 31 HG21 VAL 31 22.722 19.706 15.251 230 HG22 VAL 31 HG22 VAL 31 23.401 19.636 13.597 231 HG23 VAL 31 HG23 VAL 31 23.383 18.195 14.582 232 HA PRO 32 HA PRO 32 26.329 22.422 11.222 233 HB2 PRO 32 HB2 PRO 32 28.721 21.393 10.425 234 HB3 PRO 32 HB3 PRO 32 28.565 22.823 11.477 235 HG2 PRO 32 HG2 PRO 32 29.177 19.979 12.282 236 HG3 PRO 32 HG3 PRO 32 29.889 21.514 12.880 237 HD2 PRO 32 HD2 PRO 32 27.890 20.106 14.190 238 HD3 PRO 32 HD3 PRO 32 28.147 21.871 14.351 239 H TYR 33 H TYR 33 24.533 21.280 10.716 240 HA TYR 33 HA TYR 33 24.154 18.534 10.428 241 HB2 TYR 33 HB2 TYR 33 22.148 19.144 9.180 242 HB3 TYR 33 HB3 TYR 33 22.363 19.980 10.703 243 HD1 TYR 33 HD1 TYR 33 22.365 20.379 7.015 244 HD2 TYR 33 HD2 TYR 33 22.720 22.352 10.824 245 HE1 TYR 33 HE1 TYR 33 21.938 22.578 5.906 246 HE2 TYR 33 HE2 TYR 33 22.216 24.567 9.715 247 HH TYR 33 HH TYR 33 21.711 25.643 7.741 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 13.914 13.634 23.224 2 H2 GLY 1 H2 GLY 1 12.929 14.700 23.994 3 H3 GLY 1 H3 GLY 1 13.103 14.767 22.364 4 HA2 GLY 1 HA2 GLY 1 12.020 12.702 22.037 5 HA3 GLY 1 HA3 GLY 1 11.941 12.477 23.789 6 H SER 2 H SER 2 11.331 15.688 22.382 7 HA SER 2 HA SER 2 9.610 17.067 22.679 8 HB2 SER 2 HB2 SER 2 7.955 14.711 21.717 9 HB3 SER 2 HB3 SER 2 7.448 16.408 21.729 10 HG SER 2 HG SER 2 8.204 16.113 19.744 11 H ALA 3 H ALA 3 10.378 15.735 25.182 12 HA ALA 3 HA ALA 3 7.860 15.117 26.556 13 HB1 ALA 3 HB1 ALA 3 10.013 13.944 27.072 14 HB2 ALA 3 HB2 ALA 3 10.619 15.459 27.767 15 HB3 ALA 3 HB3 ALA 3 9.216 14.662 28.475 16 H PHE 4 H PHE 4 10.220 17.815 26.554 17 HA PHE 4 HA PHE 4 7.963 19.628 26.907 18 HB2 PHE 4 HB2 PHE 4 8.936 20.940 28.732 19 HB3 PHE 4 HB3 PHE 4 8.444 19.333 29.219 20 HD1 PHE 4 HD1 PHE 4 11.384 21.522 28.559 21 HD2 PHE 4 HD2 PHE 4 10.032 17.709 30.062 22 HE1 PHE 4 HE1 PHE 4 13.596 21.148 29.614 23 HE2 PHE 4 HE2 PHE 4 12.249 17.346 31.124 24 HZ PHE 4 HZ PHE 4 14.029 19.067 30.907 25 H CYS 5 H CYS 5 11.291 19.115 25.848 26 HA CYS 5 HA CYS 5 11.529 21.893 24.886 27 HB2 CYS 5 HB2 CYS 5 13.461 20.555 25.791 28 HB3 CYS 5 HB3 CYS 5 13.338 19.533 24.346 29 H ASN 6 H ASN 6 10.769 22.575 22.945 30 HA ASN 6 HA ASN 6 9.963 20.641 20.845 31 HB2 ASN 6 HB2 ASN 6 9.893 23.690 21.017 32 HB3 ASN 6 HB3 ASN 6 9.557 22.798 19.542 33 HD21 ASN 6 HD22 ASN 6 7.506 23.976 19.659 34 HD22 ASN 6 HD21 ASN 6 6.211 23.330 20.665 35 H LEU 7 H LEU 7 11.618 19.713 19.717 36 HA LEU 7 HA LEU 7 14.247 20.768 19.513 37 HB2 LEU 7 HB2 LEU 7 13.897 18.483 18.985 38 HB3 LEU 7 HB3 LEU 7 12.750 18.851 17.700 39 HG LEU 7 HG LEU 7 15.573 19.959 17.398 40 HD11 LEU 7 HD11 LEU 7 15.946 17.621 18.141 41 HD12 LEU 7 HD12 LEU 7 14.732 17.048 16.987 42 HD13 LEU 7 HD13 LEU 7 16.229 17.765 16.390 43 HD21 LEU 7 HD21 LEU 7 13.839 20.378 15.619 44 HD22 LEU 7 HD22 LEU 7 15.201 19.429 15.049 45 HD23 LEU 7 HD23 LEU 7 13.662 18.629 15.421 46 H ARG 8 H ARG 8 11.436 21.425 17.367 47 HA ARG 8 HA ARG 8 12.817 22.840 15.386 48 HB2 ARG 8 HB2 ARG 8 10.195 22.159 15.849 49 HB3 ARG 8 HB3 ARG 8 10.122 23.896 16.074 50 HG2 ARG 8 HG2 ARG 8 11.083 22.375 13.619 51 HG3 ARG 8 HG3 ARG 8 9.577 23.276 13.801 52 HD2 ARG 8 HD2 ARG 8 11.107 25.324 14.225 53 HD3 ARG 8 HD3 ARG 8 12.405 24.345 13.519 54 HE ARG 8 HE ARG 8 10.152 25.628 12.170 55 HH11 ARG 8 HH11 ARG 8 12.563 23.052 11.571 56 HH12 ARG 8 HH12 ARG 8 12.026 22.952 9.913 57 HH21 ARG 8 HH21 ARG 8 9.762 25.532 10.175 58 HH22 ARG 8 HH22 ARG 8 10.581 24.426 9.073 59 H ARG 9 H ARG 9 11.969 24.051 18.607 60 HA ARG 9 HA ARG 9 12.611 26.851 17.857 61 HB2 ARG 9 HB2 ARG 9 11.805 25.578 20.498 62 HB3 ARG 9 HB3 ARG 9 12.288 27.271 20.310 63 HG2 ARG 9 HG2 ARG 9 10.511 27.468 18.472 64 HG3 ARG 9 HG3 ARG 9 9.934 25.875 18.967 65 HD2 ARG 9 HD2 ARG 9 8.568 27.544 20.027 66 HD3 ARG 9 HD3 ARG 9 9.543 26.772 21.287 67 HE ARG 9 HE ARG 9 11.128 28.847 20.804 68 HH11 ARG 9 HH11 ARG 9 7.619 29.028 21.157 69 HH12 ARG 9 HH12 ARG 9 7.676 30.782 21.182 70 HH21 ARG 9 HH21 ARG 9 11.134 30.934 21.258 71 HH22 ARG 9 HH22 ARG 9 9.643 31.802 21.550 72 H CYS 10 H CYS 10 14.279 24.170 19.470 73 HA CYS 10 HA CYS 10 16.722 25.720 19.930 74 HB2 CYS 10 HB2 CYS 10 16.357 23.665 21.131 75 HB3 CYS 10 HB3 CYS 10 16.115 22.772 19.629 76 H GLU 11 H GLU 11 15.459 23.665 17.276 77 HA GLU 11 HA GLU 11 17.520 23.699 15.453 78 HB2 GLU 11 HB2 GLU 11 15.338 22.443 15.402 79 HB3 GLU 11 HB3 GLU 11 14.627 23.893 14.687 80 HG2 GLU 11 HG2 GLU 11 16.822 23.407 13.099 81 HG3 GLU 11 HG3 GLU 11 16.334 21.788 13.565 82 H LEU 12 H LEU 12 14.800 26.037 15.461 83 HA LEU 12 HA LEU 12 15.950 27.673 13.462 84 HB2 LEU 12 HB2 LEU 12 13.800 27.918 15.542 85 HB3 LEU 12 HB3 LEU 12 14.227 29.373 14.621 86 HG LEU 12 HG LEU 12 13.495 26.736 13.272 87 HD11 LEU 12 HD11 LEU 12 11.604 27.560 14.652 88 HD12 LEU 12 HD12 LEU 12 11.739 29.158 13.892 89 HD13 LEU 12 HD13 LEU 12 11.269 27.748 12.921 90 HD21 LEU 12 HD21 LEU 12 14.733 28.398 11.846 91 HD22 LEU 12 HD22 LEU 12 13.053 28.200 11.328 92 HD23 LEU 12 HD23 LEU 12 13.529 29.627 12.267 93 H SER 13 H SER 13 16.142 27.983 17.019 94 HA SER 13 HA SER 13 17.573 30.480 17.033 95 HB2 SER 13 HB2 SER 13 17.711 28.233 19.076 96 HB3 SER 13 HB3 SER 13 18.082 29.948 19.309 97 HG SER 13 HG SER 13 15.629 28.625 19.058 98 H CYS 14 H CYS 14 18.622 27.175 16.555 99 HA CYS 14 HA CYS 14 21.496 27.740 16.556 100 HB2 CYS 14 HB2 CYS 14 19.682 25.403 15.951 101 HB3 CYS 14 HB3 CYS 14 21.402 25.339 15.672 102 H ARG 15 H ARG 15 18.939 27.792 14.123 103 HA ARG 15 HA ARG 15 20.774 27.494 11.864 104 HB2 ARG 15 HB2 ARG 15 17.982 28.279 12.409 105 HB3 ARG 15 HB3 ARG 15 18.571 28.407 10.739 106 HG2 ARG 15 HG2 ARG 15 19.104 26.060 10.599 107 HG3 ARG 15 HG3 ARG 15 18.811 25.793 12.301 108 HD2 ARG 15 HD2 ARG 15 16.993 24.959 10.767 109 HD3 ARG 15 HD3 ARG 15 16.415 26.065 12.008 110 HE ARG 15 HE ARG 15 17.019 27.617 9.690 111 HH11 ARG 15 HH11 ARG 15 14.596 25.130 10.491 112 HH12 ARG 15 HH12 ARG 15 13.475 25.887 9.341 113 HH21 ARG 15 HH21 ARG 15 15.462 28.460 8.493 114 HH22 ARG 15 HH22 ARG 15 13.928 27.580 8.258 115 H SER 16 H SER 16 19.669 30.195 13.770 116 HA SER 16 HA SER 16 20.401 32.504 12.365 117 HB2 SER 16 HB2 SER 16 21.111 31.714 15.225 118 HB3 SER 16 HB3 SER 16 21.046 33.378 14.590 119 HG SER 16 HG SER 16 19.186 32.703 15.766 120 H LEU 17 H LEU 17 22.379 29.848 12.861 121 HA LEU 17 HA LEU 17 24.973 31.262 13.065 122 HB2 LEU 17 HB2 LEU 17 24.352 28.430 13.894 123 HB3 LEU 17 HB3 LEU 17 25.599 29.496 14.511 124 HG LEU 17 HG LEU 17 22.582 29.709 15.130 125 HD11 LEU 17 HD11 LEU 17 24.982 28.842 16.810 126 HD12 LEU 17 HD12 LEU 17 23.303 28.980 17.368 127 HD13 LEU 17 HD13 LEU 17 23.738 27.761 16.154 128 HD21 LEU 17 HD21 LEU 17 24.976 31.206 16.296 129 HD22 LEU 17 HD22 LEU 17 23.779 31.933 15.224 130 HD23 LEU 17 HD23 LEU 17 23.289 31.346 16.814 131 H GLY 18 H GLY 18 23.137 29.552 10.810 132 HA2 GLY 18 HA2 GLY 18 23.648 28.416 8.878 133 HA3 GLY 18 HA3 GLY 18 25.371 28.681 9.151 134 H LEU 19 H LEU 19 23.289 27.086 11.522 135 HA LEU 19 HA LEU 19 24.582 24.422 11.030 136 HB2 LEU 19 HB2 LEU 19 23.732 25.610 13.703 137 HB3 LEU 19 HB3 LEU 19 24.606 24.121 13.450 138 HG LEU 19 HG LEU 19 25.703 26.918 12.985 139 HD11 LEU 19 HD11 LEU 19 27.129 26.408 14.919 140 HD12 LEU 19 HD12 LEU 19 25.419 26.370 15.348 141 HD13 LEU 19 HD13 LEU 19 26.312 24.845 15.125 142 HD21 LEU 19 HD21 LEU 19 26.775 25.275 11.454 143 HD22 LEU 19 HD22 LEU 19 27.891 25.791 12.718 144 HD23 LEU 19 HD23 LEU 19 27.100 24.207 12.836 145 H LEU 20 H LEU 20 23.281 22.761 12.416 146 HA LEU 20 HA LEU 20 20.338 23.084 12.101 147 HB2 LEU 20 HB2 LEU 20 21.183 20.987 11.205 148 HB3 LEU 20 HB3 LEU 20 22.085 20.658 12.699 149 HG LEU 20 HG LEU 20 19.954 20.375 13.925 150 HD11 LEU 20 HD11 LEU 20 17.823 20.249 12.686 151 HD12 LEU 20 HD12 LEU 20 18.499 21.867 12.452 152 HD13 LEU 20 HD13 LEU 20 18.647 20.666 11.170 153 HD21 LEU 20 HD21 LEU 20 19.226 18.325 13.018 154 HD22 LEU 20 HD22 LEU 20 19.929 18.671 11.452 155 HD23 LEU 20 HD23 LEU 20 20.998 18.416 12.860 156 H GLY 21 H GLY 21 19.162 22.336 14.104 157 HA2 GLY 21 HA2 GLY 21 20.696 22.492 16.619 158 HA3 GLY 21 HA3 GLY 21 19.199 23.382 16.583 159 H LYS 22 H LYS 22 19.988 21.161 18.233 160 HA LYS 22 HA LYS 22 17.903 19.111 17.706 161 HB2 LYS 22 HB2 LYS 22 20.866 18.744 18.377 162 HB3 LYS 22 HB3 LYS 22 19.684 17.471 18.582 163 HG2 LYS 22 HG2 LYS 22 20.506 18.734 15.939 164 HG3 LYS 22 HG3 LYS 22 20.966 17.154 16.572 165 HD2 LYS 22 HD2 LYS 22 18.329 16.749 16.622 166 HD3 LYS 22 HD3 LYS 22 18.332 18.062 15.425 167 HE2 LYS 22 HE2 LYS 22 20.093 16.737 14.156 168 HE3 LYS 22 HE3 LYS 22 19.855 15.411 15.300 169 HZ1 LYS 22 HZ1 LYS 22 17.532 15.286 14.585 170 HZ2 LYS 22 HZ2 LYS 22 17.698 16.546 13.582 171 HZ3 LYS 22 HZ3 LYS 22 18.507 15.155 13.262 172 H CYS 23 H CYS 23 16.684 18.895 19.522 173 HA CYS 23 HA CYS 23 17.953 19.304 22.168 174 HB2 CYS 23 HB2 CYS 23 16.795 21.362 21.549 175 HB3 CYS 23 HB3 CYS 23 15.297 20.485 21.400 176 H ILE 24 H ILE 24 17.931 17.019 21.189 177 HA ILE 24 HA ILE 24 15.620 15.313 21.372 178 HB ILE 24 HB ILE 24 18.569 14.561 21.414 179 HG12 ILE 24 HG12 ILE 24 16.820 15.245 19.007 180 HG13 ILE 24 HG13 ILE 24 18.278 16.094 19.550 181 HG21 ILE 24 HG21 ILE 24 17.805 12.455 20.420 182 HG22 ILE 24 HG22 ILE 24 16.862 12.744 21.875 183 HG23 ILE 24 HG23 ILE 24 16.153 13.079 20.285 184 HD11 ILE 24 HD11 ILE 24 19.629 14.065 19.053 185 HD12 ILE 24 HD12 ILE 24 18.170 13.324 18.325 186 HD13 ILE 24 HD13 ILE 24 18.855 14.803 17.641 187 H GLY 25 H GLY 25 18.490 15.839 23.505 188 HA2 GLY 25 HA2 GLY 25 17.583 13.958 25.530 189 HA3 GLY 25 HA3 GLY 25 18.926 15.097 25.664 190 H GLU 26 H GLU 26 15.916 16.566 24.838 191 HA GLU 26 HA GLU 26 14.918 18.350 25.731 192 HB2 GLU 26 HB2 GLU 26 15.087 17.217 28.500 193 HB3 GLU 26 HB3 GLU 26 13.888 18.307 27.824 194 HG2 GLU 26 HG2 GLU 26 14.232 15.358 27.145 195 HG3 GLU 26 HG3 GLU 26 13.050 16.026 28.248 196 H GLU 27 H GLU 27 17.851 18.260 25.532 197 HA GLU 27 HA GLU 27 18.183 20.948 26.639 198 HB2 GLU 27 HB2 GLU 27 20.456 20.684 27.310 199 HB3 GLU 27 HB3 GLU 27 19.438 19.629 28.277 200 HG2 GLU 27 HG2 GLU 27 20.232 17.653 27.168 201 HG3 GLU 27 HG3 GLU 27 20.982 18.580 25.867 202 H CYS 28 H CYS 28 19.442 22.327 25.286 203 HA CYS 28 HA CYS 28 19.197 21.437 22.509 204 HB2 CYS 28 HB2 CYS 28 18.169 23.495 23.290 205 HB3 CYS 28 HB3 CYS 28 19.737 24.132 23.757 206 H LYS 29 H LYS 29 20.707 21.372 20.955 207 HA LYS 29 HA LYS 29 23.501 22.286 21.371 208 HB2 LYS 29 HB2 LYS 29 23.355 19.744 21.745 209 HB3 LYS 29 HB3 LYS 29 22.771 19.602 20.086 210 HG2 LYS 29 HG2 LYS 29 24.927 20.918 19.422 211 HG3 LYS 29 HG3 LYS 29 25.483 20.614 21.059 212 HD2 LYS 29 HD2 LYS 29 24.733 18.508 18.982 213 HD3 LYS 29 HD3 LYS 29 26.372 19.090 19.268 214 HE2 LYS 29 HE2 LYS 29 24.628 17.603 21.259 215 HE3 LYS 29 HE3 LYS 29 25.914 16.914 20.274 216 HZ1 LYS 29 HZ1 LYS 29 27.495 18.441 21.419 217 HZ2 LYS 29 HZ2 LYS 29 26.279 18.925 22.427 218 HZ3 LYS 29 HZ3 LYS 29 26.786 17.375 22.416 219 H CYS 30 H CYS 30 24.329 23.255 19.477 220 HA CYS 30 HA CYS 30 22.696 22.983 16.980 221 HB2 CYS 30 HB2 CYS 30 24.773 25.124 17.227 222 HB3 CYS 30 HB3 CYS 30 23.360 25.016 16.159 223 H VAL 31 H VAL 31 23.661 22.371 15.140 224 HA VAL 31 HA VAL 31 26.129 20.765 15.628 225 HB VAL 31 HB VAL 31 23.691 19.616 14.284 226 HG11 VAL 31 HG11 VAL 31 25.878 18.419 14.280 227 HG12 VAL 31 HG12 VAL 31 25.891 18.473 16.060 228 HG13 VAL 31 HG13 VAL 31 24.649 17.542 15.200 229 HG21 VAL 31 HG21 VAL 31 23.023 18.638 16.511 230 HG22 VAL 31 HG22 VAL 31 24.061 19.842 17.289 231 HG23 VAL 31 HG23 VAL 31 22.656 20.356 16.333 232 HA PRO 32 HA PRO 32 27.018 22.280 11.471 233 HB2 PRO 32 HB2 PRO 32 29.276 20.277 11.575 234 HB3 PRO 32 HB3 PRO 32 29.296 22.002 11.104 235 HG2 PRO 32 HG2 PRO 32 30.180 21.228 13.535 236 HG3 PRO 32 HG3 PRO 32 29.139 22.686 13.395 237 HD2 PRO 32 HD2 PRO 32 28.311 19.855 14.138 238 HD3 PRO 32 HD3 PRO 32 27.944 21.406 14.962 239 H TYR 33 H TYR 33 25.012 21.296 10.816 240 HA TYR 33 HA TYR 33 24.295 18.873 9.996 241 HB2 TYR 33 HB2 TYR 33 23.081 21.129 9.883 242 HB3 TYR 33 HB3 TYR 33 23.774 21.339 8.293 243 HD1 TYR 33 HD2 TYR 33 21.803 18.942 10.340 244 HD2 TYR 33 HD1 TYR 33 22.494 20.590 6.434 245 HE1 TYR 33 HE2 TYR 33 19.926 17.538 9.409 246 HE2 TYR 33 HE1 TYR 33 20.595 19.254 5.515 247 HH TYR 33 HH TYR 33 18.893 17.745 5.996 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 10.365 21.711 32.529 2 H2 GLY 1 H2 GLY 1 9.494 20.357 32.946 3 H3 GLY 1 H3 GLY 1 9.307 21.800 33.758 4 HA2 GLY 1 HA2 GLY 1 8.589 21.292 30.954 5 HA3 GLY 1 HA3 GLY 1 7.451 21.443 32.313 6 H SER 2 H SER 2 6.370 23.314 31.950 7 HA SER 2 HA SER 2 5.844 25.347 31.164 8 HB2 SER 2 HB2 SER 2 8.472 26.196 32.417 9 HB3 SER 2 HB3 SER 2 7.201 27.280 31.837 10 HG SER 2 HG SER 2 6.856 26.983 33.965 11 H ALA 3 H ALA 3 6.830 23.639 29.276 12 HA ALA 3 HA ALA 3 7.716 23.419 27.226 13 HB1 ALA 3 HB1 ALA 3 5.642 24.648 26.888 14 HB2 ALA 3 HB2 ALA 3 6.505 26.196 27.010 15 HB3 ALA 3 HB3 ALA 3 6.831 25.092 25.654 16 H PHE 4 H PHE 4 9.902 23.908 28.790 17 HA PHE 4 HA PHE 4 11.347 26.281 28.157 18 HB2 PHE 4 HB2 PHE 4 11.627 24.955 30.200 19 HB3 PHE 4 HB3 PHE 4 12.285 23.615 29.272 20 HD1 PHE 4 HD1 PHE 4 12.878 27.224 30.137 21 HD2 PHE 4 HD2 PHE 4 14.633 23.492 28.849 22 HE1 PHE 4 HE1 PHE 4 15.153 28.183 30.436 23 HE2 PHE 4 HE2 PHE 4 16.901 24.444 29.180 24 HZ PHE 4 HZ PHE 4 17.158 26.790 29.966 25 H CYS 5 H CYS 5 11.311 23.164 26.480 26 HA CYS 5 HA CYS 5 12.791 24.382 24.281 27 HB2 CYS 5 HB2 CYS 5 14.540 23.336 25.899 28 HB3 CYS 5 HB3 CYS 5 13.868 21.787 25.420 29 H ASN 6 H ASN 6 12.106 23.646 22.347 30 HA ASN 6 HA ASN 6 11.433 20.761 22.091 31 HB2 ASN 6 HB2 ASN 6 9.291 22.154 21.723 32 HB3 ASN 6 HB3 ASN 6 10.082 22.825 20.284 33 HD21 ASN 6 HD22 ASN 6 8.585 19.898 21.642 34 HD22 ASN 6 HD21 ASN 6 8.927 18.915 20.227 35 H LEU 7 H LEU 7 12.454 19.766 20.257 36 HA LEU 7 HA LEU 7 14.807 20.944 19.258 37 HB2 LEU 7 HB2 LEU 7 14.248 18.536 19.254 38 HB3 LEU 7 HB3 LEU 7 13.151 18.795 17.898 39 HG LEU 7 HG LEU 7 16.011 19.789 17.647 40 HD11 LEU 7 HD11 LEU 7 16.667 17.481 16.868 41 HD12 LEU 7 HD12 LEU 7 16.251 17.501 18.596 42 HD13 LEU 7 HD13 LEU 7 15.100 16.881 17.402 43 HD21 LEU 7 HD21 LEU 7 15.740 19.070 15.314 44 HD22 LEU 7 HD22 LEU 7 14.180 18.314 15.687 45 HD23 LEU 7 HD23 LEU 7 14.351 20.071 15.728 46 H ARG 8 H ARG 8 11.516 21.228 17.939 47 HA ARG 8 HA ARG 8 12.057 22.440 15.464 48 HB2 ARG 8 HB2 ARG 8 9.808 21.745 16.467 49 HB3 ARG 8 HB3 ARG 8 9.870 23.185 17.474 50 HG2 ARG 8 HG2 ARG 8 8.439 23.633 15.632 51 HG3 ARG 8 HG3 ARG 8 9.883 24.605 15.362 52 HD2 ARG 8 HD2 ARG 8 9.765 21.831 14.232 53 HD3 ARG 8 HD3 ARG 8 8.723 23.058 13.500 54 HE ARG 8 HE ARG 8 10.684 24.402 12.916 55 HH11 ARG 8 HH11 ARG 8 11.320 20.931 13.279 56 HH12 ARG 8 HH12 ARG 8 13.007 21.145 12.884 57 HH21 ARG 8 HH21 ARG 8 12.707 24.434 11.968 58 HH22 ARG 8 HH22 ARG 8 13.668 22.975 11.934 59 H ARG 9 H ARG 9 12.069 23.905 18.640 60 HA ARG 9 HA ARG 9 12.539 26.623 17.512 61 HB2 ARG 9 HB2 ARG 9 10.569 26.101 18.916 62 HB3 ARG 9 HB3 ARG 9 11.636 25.731 20.271 63 HG2 ARG 9 HG2 ARG 9 12.490 28.116 20.169 64 HG3 ARG 9 HG3 ARG 9 11.380 28.414 18.824 65 HD2 ARG 9 HD2 ARG 9 10.240 29.245 20.710 66 HD3 ARG 9 HD3 ARG 9 9.477 27.701 20.382 67 HE ARG 9 HE ARG 9 10.581 26.733 22.309 68 HH11 ARG 9 HH11 ARG 9 11.124 30.238 22.182 69 HH12 ARG 9 HH12 ARG 9 11.660 30.244 23.843 70 HH21 ARG 9 HH21 ARG 9 11.255 26.862 24.277 71 HH22 ARG 9 HH22 ARG 9 11.813 28.373 24.998 72 H CYS 10 H CYS 10 14.152 24.117 19.358 73 HA CYS 10 HA CYS 10 16.587 25.628 19.864 74 HB2 CYS 10 HB2 CYS 10 16.226 23.532 20.965 75 HB3 CYS 10 HB3 CYS 10 15.936 22.716 19.421 76 H GLU 11 H GLU 11 15.320 23.721 17.038 77 HA GLU 11 HA GLU 11 17.536 23.890 15.435 78 HB2 GLU 11 HB2 GLU 11 14.647 23.655 14.800 79 HB3 GLU 11 HB3 GLU 11 15.704 24.263 13.526 80 HG2 GLU 11 HG2 GLU 11 17.210 22.283 13.885 81 HG3 GLU 11 HG3 GLU 11 15.942 21.608 14.934 82 H LEU 12 H LEU 12 14.849 26.268 15.483 83 HA LEU 12 HA LEU 12 16.159 28.236 13.885 84 HB2 LEU 12 HB2 LEU 12 13.830 28.101 15.778 85 HB3 LEU 12 HB3 LEU 12 14.301 29.686 15.133 86 HG LEU 12 HG LEU 12 13.825 27.290 13.307 87 HD11 LEU 12 HD11 LEU 12 11.563 28.206 12.919 88 HD12 LEU 12 HD12 LEU 12 11.769 27.672 14.590 89 HD13 LEU 12 HD13 LEU 12 11.822 29.409 14.204 90 HD21 LEU 12 HD21 LEU 12 13.746 30.315 12.842 91 HD22 LEU 12 HD22 LEU 12 15.039 29.218 12.306 92 HD23 LEU 12 HD23 LEU 12 13.421 29.065 11.626 93 H SER 13 H SER 13 16.293 27.753 17.407 94 HA SER 13 HA SER 13 17.745 30.208 17.955 95 HB2 SER 13 HB2 SER 13 17.653 27.593 19.513 96 HB3 SER 13 HB3 SER 13 18.295 29.133 20.097 97 HG SER 13 HG SER 13 15.623 28.443 19.467 98 H CYS 14 H CYS 14 18.689 27.294 16.413 99 HA CYS 14 HA CYS 14 21.601 27.799 16.784 100 HB2 CYS 14 HB2 CYS 14 19.873 25.454 16.012 101 HB3 CYS 14 HB3 CYS 14 21.616 25.464 15.771 102 H ARG 15 H ARG 15 19.095 27.675 14.266 103 HA ARG 15 HA ARG 15 20.864 27.205 12.050 104 HB2 ARG 15 HB2 ARG 15 18.161 28.284 12.559 105 HB3 ARG 15 HB3 ARG 15 18.754 28.244 10.871 106 HG2 ARG 15 HG2 ARG 15 19.087 25.900 10.854 107 HG3 ARG 15 HG3 ARG 15 18.770 25.710 12.568 108 HD2 ARG 15 HD2 ARG 15 16.405 26.325 12.234 109 HD3 ARG 15 HD3 ARG 15 16.712 26.855 10.585 110 HE ARG 15 HE ARG 15 16.272 24.109 11.482 111 HH11 ARG 15 HH12 ARG 15 17.429 26.015 8.714 112 HH12 ARG 15 HH11 ARG 15 17.529 24.538 7.769 113 HH21 ARG 15 HH21 ARG 15 16.096 22.559 10.130 114 HH22 ARG 15 HH22 ARG 15 16.495 22.766 8.418 115 H SER 16 H SER 16 19.643 30.169 13.480 116 HA SER 16 HA SER 16 20.526 32.221 11.819 117 HB2 SER 16 HB2 SER 16 20.562 31.841 14.846 118 HB3 SER 16 HB3 SER 16 20.758 33.428 14.045 119 HG SER 16 HG SER 16 18.624 33.332 14.293 120 H LEU 17 H LEU 17 22.460 29.894 13.366 121 HA LEU 17 HA LEU 17 24.988 31.409 13.441 122 HB2 LEU 17 HB2 LEU 17 24.542 28.575 14.340 123 HB3 LEU 17 HB3 LEU 17 25.666 29.761 14.960 124 HG LEU 17 HG LEU 17 22.616 29.775 15.459 125 HD11 LEU 17 HD11 LEU 17 23.865 27.966 16.624 126 HD12 LEU 17 HD12 LEU 17 24.996 29.172 17.272 127 HD13 LEU 17 HD13 LEU 17 23.283 29.205 17.753 128 HD21 LEU 17 HD21 LEU 17 23.542 32.071 15.469 129 HD22 LEU 17 HD22 LEU 17 23.133 31.527 17.097 130 HD23 LEU 17 HD23 LEU 17 24.828 31.545 16.568 131 H GLY 18 H GLY 18 23.326 29.643 11.157 132 HA2 GLY 18 HA2 GLY 18 23.964 28.673 9.172 133 HA3 GLY 18 HA3 GLY 18 25.666 28.812 9.623 134 H LEU 19 H LEU 19 23.262 27.232 11.683 135 HA LEU 19 HA LEU 19 24.568 24.567 11.240 136 HB2 LEU 19 HB2 LEU 19 23.636 25.763 13.870 137 HB3 LEU 19 HB3 LEU 19 24.462 24.249 13.665 138 HG LEU 19 HG LEU 19 25.696 26.975 13.152 139 HD11 LEU 19 HD11 LEU 19 25.250 26.453 15.544 140 HD12 LEU 19 HD12 LEU 19 26.214 24.963 15.374 141 HD13 LEU 19 HD13 LEU 19 26.971 26.553 15.164 142 HD21 LEU 19 HD21 LEU 19 26.741 25.215 11.734 143 HD22 LEU 19 HD22 LEU 19 27.830 25.739 13.019 144 HD23 LEU 19 HD23 LEU 19 26.965 24.196 13.174 145 H LEU 20 H LEU 20 23.225 22.921 12.628 146 HA LEU 20 HA LEU 20 20.268 23.151 12.266 147 HB2 LEU 20 HB2 LEU 20 21.575 20.996 11.534 148 HB3 LEU 20 HB3 LEU 20 21.936 20.789 13.230 149 HG LEU 20 HG LEU 20 19.442 20.618 13.676 150 HD11 LEU 20 HD11 LEU 20 19.363 20.613 10.618 151 HD12 LEU 20 HD12 LEU 20 18.009 20.172 11.680 152 HD13 LEU 20 HD13 LEU 20 18.605 21.833 11.662 153 HD21 LEU 20 HD21 LEU 20 19.257 18.368 12.736 154 HD22 LEU 20 HD22 LEU 20 20.599 18.699 11.617 155 HD23 LEU 20 HD23 LEU 20 20.898 18.636 13.362 156 H GLY 21 H GLY 21 19.040 22.557 14.310 157 HA2 GLY 21 HA2 GLY 21 20.645 22.623 16.826 158 HA3 GLY 21 HA3 GLY 21 19.042 23.309 16.779 159 H LYS 22 H LYS 22 20.359 20.912 18.147 160 HA LYS 22 HA LYS 22 18.057 19.083 17.728 161 HB2 LYS 22 HB2 LYS 22 20.935 18.194 18.074 162 HB3 LYS 22 HB3 LYS 22 19.523 17.160 18.345 163 HG2 LYS 22 HG2 LYS 22 18.788 17.774 15.954 164 HG3 LYS 22 HG3 LYS 22 20.414 18.423 15.727 165 HD2 LYS 22 HD2 LYS 22 21.374 16.183 16.257 166 HD3 LYS 22 HD3 LYS 22 19.747 15.581 16.615 167 HE2 LYS 22 HE2 LYS 22 19.202 16.415 14.168 168 HE3 LYS 22 HE3 LYS 22 20.962 16.302 13.933 169 HZ1 LYS 22 HZ1 LYS 22 20.784 13.936 14.611 170 HZ2 LYS 22 HZ2 LYS 22 19.170 14.131 14.867 171 HZ3 LYS 22 HZ3 LYS 22 19.771 14.234 13.350 172 H CYS 23 H CYS 23 16.857 19.577 19.401 173 HA CYS 23 HA CYS 23 18.003 19.400 22.153 174 HB2 CYS 23 HB2 CYS 23 17.167 21.607 21.749 175 HB3 CYS 23 HB3 CYS 23 15.630 20.981 21.178 176 H ILE 24 H ILE 24 17.935 17.192 21.950 177 HA ILE 24 HA ILE 24 15.353 15.780 21.848 178 HB ILE 24 HB ILE 24 18.136 14.677 22.384 179 HG12 ILE 24 HG12 ILE 24 16.705 15.092 19.702 180 HG13 ILE 24 HG13 ILE 24 18.196 15.876 20.228 181 HG21 ILE 24 HG21 ILE 24 15.611 13.357 21.266 182 HG22 ILE 24 HG22 ILE 24 17.139 12.553 21.681 183 HG23 ILE 24 HG23 ILE 24 16.143 13.229 22.955 184 HD11 ILE 24 HD11 ILE 24 17.876 12.966 19.522 185 HD12 ILE 24 HD12 ILE 24 18.797 14.208 18.672 186 HD13 ILE 24 HD13 ILE 24 19.338 13.655 20.276 187 H GLY 25 H GLY 25 14.148 15.439 23.645 188 HA2 GLY 25 HA2 GLY 25 13.576 15.328 25.917 189 HA3 GLY 25 HA3 GLY 25 15.272 15.422 26.377 190 H GLU 26 H GLU 26 16.142 17.431 26.905 191 HA GLU 26 HA GLU 26 14.438 19.867 26.538 192 HB2 GLU 26 HB2 GLU 26 14.083 18.531 28.654 193 HB3 GLU 26 HB3 GLU 26 15.711 18.988 29.156 194 HG2 GLU 26 HG3 GLU 26 15.077 21.181 29.598 195 HG3 GLU 26 HG2 GLU 26 13.852 21.203 28.313 196 H GLU 27 H GLU 27 17.554 18.674 26.166 197 HA GLU 27 HA GLU 27 18.851 21.314 26.717 198 HB2 GLU 27 HB2 GLU 27 19.654 19.438 28.048 199 HB3 GLU 27 HB3 GLU 27 20.042 18.528 26.587 200 HG2 GLU 27 HG2 GLU 27 21.685 20.237 25.919 201 HG3 GLU 27 HG3 GLU 27 21.230 21.232 27.308 202 H CYS 28 H CYS 28 19.098 22.538 24.974 203 HA CYS 28 HA CYS 28 19.202 21.488 22.278 204 HB2 CYS 28 HB2 CYS 28 18.042 23.565 22.963 205 HB3 CYS 28 HB3 CYS 28 19.587 24.275 23.399 206 H LYS 29 H LYS 29 20.873 20.655 21.317 207 HA LYS 29 HA LYS 29 23.605 21.865 21.528 208 HB2 LYS 29 HB2 LYS 29 23.111 19.229 21.593 209 HB3 LYS 29 HB3 LYS 29 22.882 19.442 19.853 210 HG2 LYS 29 HG2 LYS 29 25.253 20.654 20.029 211 HG3 LYS 29 HG3 LYS 29 25.393 19.731 21.521 212 HD2 LYS 29 HD2 LYS 29 24.866 18.634 18.725 213 HD3 LYS 29 HD3 LYS 29 26.426 18.641 19.511 214 HE2 LYS 29 HE2 LYS 29 24.004 17.126 20.605 215 HE3 LYS 29 HE3 LYS 29 25.159 16.447 19.455 216 HZ1 LYS 29 HZ1 LYS 29 25.781 17.281 22.240 217 HZ2 LYS 29 HZ2 LYS 29 25.863 15.785 21.598 218 HZ3 LYS 29 HZ3 LYS 29 26.935 16.975 21.155 219 H CYS 30 H CYS 30 24.553 22.601 19.460 220 HA CYS 30 HA CYS 30 22.671 22.623 17.127 221 HB2 CYS 30 HB2 CYS 30 24.918 24.608 17.312 222 HB3 CYS 30 HB3 CYS 30 23.486 24.627 16.245 223 H VAL 31 H VAL 31 23.751 22.383 15.057 224 HA VAL 31 HA VAL 31 26.094 20.557 15.285 225 HB VAL 31 HB VAL 31 23.794 19.632 13.598 226 HG11 VAL 31 HG11 VAL 31 25.837 18.287 15.419 227 HG12 VAL 31 HG12 VAL 31 24.696 17.458 14.343 228 HG13 VAL 31 HG13 VAL 31 25.960 18.458 13.648 229 HG21 VAL 31 HG21 VAL 31 22.820 18.341 15.468 230 HG22 VAL 31 HG22 VAL 31 23.812 19.251 16.624 231 HG23 VAL 31 HG23 VAL 31 22.549 20.075 15.674 232 HA PRO 32 HA PRO 32 27.068 22.516 11.335 233 HB2 PRO 32 HB2 PRO 32 28.940 20.202 10.994 234 HB3 PRO 32 HB3 PRO 32 29.261 21.955 10.792 235 HG2 PRO 32 HG2 PRO 32 30.089 20.670 13.018 236 HG3 PRO 32 HG3 PRO 32 29.291 22.276 13.165 237 HD2 PRO 32 HD2 PRO 32 28.050 19.529 13.513 238 HD3 PRO 32 HD3 PRO 32 27.953 20.969 14.575 239 H TYR 33 H TYR 33 24.764 20.936 11.271 240 HA TYR 33 HA TYR 33 23.285 19.766 10.009 241 HB2 TYR 33 HB2 TYR 33 24.646 21.671 8.367 242 HB3 TYR 33 HB3 TYR 33 24.358 20.283 7.367 243 HD1 TYR 33 HD2 TYR 33 22.423 22.128 9.977 244 HD2 TYR 33 HD1 TYR 33 22.568 20.587 5.968 245 HE1 TYR 33 HE2 TYR 33 20.167 23.164 9.483 246 HE2 TYR 33 HE1 TYR 33 20.357 21.602 5.472 247 HH TYR 33 HH TYR 33 18.783 23.017 6.177 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 11.474 15.496 25.306 2 H2 GLY 1 H2 GLY 1 12.212 16.083 23.971 3 H3 GLY 1 H3 GLY 1 10.631 15.613 23.890 4 HA2 GLY 1 HA2 GLY 1 11.688 17.864 25.486 5 HA3 GLY 1 HA3 GLY 1 10.850 18.025 23.925 6 H SER 2 H SER 2 10.507 17.728 27.312 7 HA SER 2 HA SER 2 7.520 17.680 27.136 8 HB2 SER 2 HB2 SER 2 9.220 15.710 28.711 9 HB3 SER 2 HB3 SER 2 7.473 15.897 28.899 10 HG SER 2 HG SER 2 7.232 15.366 26.720 11 H ALA 3 H ALA 3 10.233 19.113 28.596 12 HA ALA 3 HA ALA 3 8.622 19.921 31.003 13 HB1 ALA 3 HB1 ALA 3 10.499 18.452 31.591 14 HB2 ALA 3 HB2 ALA 3 11.631 19.540 30.754 15 HB3 ALA 3 HB3 ALA 3 10.753 20.100 32.193 16 H PHE 4 H PHE 4 10.956 20.996 28.532 17 HA PHE 4 HA PHE 4 10.005 23.785 28.829 18 HB2 PHE 4 HB2 PHE 4 11.845 23.248 30.554 19 HB3 PHE 4 HB3 PHE 4 12.941 23.069 29.196 20 HD1 PHE 4 HD1 PHE 4 10.446 25.477 30.675 21 HD2 PHE 4 HD2 PHE 4 14.149 24.997 28.519 22 HE1 PHE 4 HE1 PHE 4 10.831 27.924 30.790 23 HE2 PHE 4 HE2 PHE 4 14.535 27.441 28.642 24 HZ PHE 4 HZ PHE 4 12.871 28.915 29.777 25 H CYS 5 H CYS 5 11.277 21.303 26.792 26 HA CYS 5 HA CYS 5 12.025 23.309 24.706 27 HB2 CYS 5 HB2 CYS 5 13.814 21.844 25.999 28 HB3 CYS 5 HB3 CYS 5 13.254 20.578 24.916 29 H ASN 6 H ASN 6 11.735 22.876 22.612 30 HA ASN 6 HA ASN 6 10.598 20.311 21.649 31 HB2 ASN 6 HB2 ASN 6 8.822 22.150 21.677 32 HB3 ASN 6 HB3 ASN 6 9.825 23.072 20.550 33 HD21 ASN 6 HD22 ASN 6 7.175 22.337 20.071 34 HD22 ASN 6 HD21 ASN 6 7.249 21.361 18.601 35 H LEU 7 H LEU 7 11.948 19.506 19.949 36 HA LEU 7 HA LEU 7 14.441 20.839 19.420 37 HB2 LEU 7 HB2 LEU 7 14.293 18.450 19.152 38 HB3 LEU 7 HB3 LEU 7 13.062 18.603 17.895 39 HG LEU 7 HG LEU 7 15.785 19.915 17.493 40 HD11 LEU 7 HD11 LEU 7 15.086 16.960 17.136 41 HD12 LEU 7 HD12 LEU 7 16.537 17.742 16.505 42 HD13 LEU 7 HD13 LEU 7 16.281 17.618 18.264 43 HD21 LEU 7 HD21 LEU 7 13.991 18.349 15.557 44 HD22 LEU 7 HD22 LEU 7 13.895 20.098 15.718 45 HD23 LEU 7 HD23 LEU 7 15.391 19.356 15.145 46 H ARG 8 H ARG 8 11.311 21.060 17.824 47 HA ARG 8 HA ARG 8 11.817 22.449 15.487 48 HB2 ARG 8 HB2 ARG 8 9.569 21.785 16.485 49 HB3 ARG 8 HB3 ARG 8 9.749 23.083 17.656 50 HG2 ARG 8 HG2 ARG 8 8.303 23.992 16.117 51 HG3 ARG 8 HG3 ARG 8 9.832 24.712 15.621 52 HD2 ARG 8 HD2 ARG 8 8.578 22.209 14.486 53 HD3 ARG 8 HD3 ARG 8 8.392 23.809 13.764 54 HE ARG 8 HE ARG 8 10.723 22.024 13.606 55 HH11 ARG 8 HH21 ARG 8 9.715 25.349 13.038 56 HH12 ARG 8 HH22 ARG 8 11.042 25.638 11.944 57 HH21 ARG 8 HH11 ARG 8 12.514 22.544 12.420 58 HH22 ARG 8 HH12 ARG 8 12.598 24.123 11.652 59 H ARG 9 H ARG 9 11.701 23.879 18.725 60 HA ARG 9 HA ARG 9 12.210 26.581 17.653 61 HB2 ARG 9 HB2 ARG 9 10.465 26.091 19.301 62 HB3 ARG 9 HB3 ARG 9 11.690 25.572 20.475 63 HG2 ARG 9 HG2 ARG 9 12.638 27.835 20.544 64 HG3 ARG 9 HG3 ARG 9 11.557 28.363 19.237 65 HD2 ARG 9 HD2 ARG 9 10.677 29.163 21.314 66 HD3 ARG 9 HD3 ARG 9 9.588 27.934 20.667 67 HE ARG 9 HE ARG 9 11.377 26.583 22.397 68 HH11 ARG 9 HH11 ARG 9 9.062 29.202 22.893 69 HH12 ARG 9 HH12 ARG 9 9.097 28.965 24.622 70 HH21 ARG 9 HH21 ARG 9 10.919 26.082 24.473 71 HH22 ARG 9 HH22 ARG 9 10.287 27.337 25.523 72 H CYS 10 H CYS 10 13.984 24.070 19.366 73 HA CYS 10 HA CYS 10 16.413 25.587 19.786 74 HB2 CYS 10 HB2 CYS 10 16.010 23.464 20.879 75 HB3 CYS 10 HB3 CYS 10 15.879 22.644 19.316 76 H GLU 11 H GLU 11 15.159 23.708 16.917 77 HA GLU 11 HA GLU 11 17.389 23.884 15.291 78 HB2 GLU 11 HB2 GLU 11 14.499 24.090 14.481 79 HB3 GLU 11 HB3 GLU 11 15.846 24.217 13.342 80 HG2 GLU 11 HG2 GLU 11 16.660 22.007 14.106 81 HG3 GLU 11 HG3 GLU 11 15.147 21.819 15.003 82 H LEU 12 H LEU 12 14.988 26.409 15.907 83 HA LEU 12 HA LEU 12 16.177 28.264 14.021 84 HB2 LEU 12 HB2 LEU 12 13.906 28.262 15.990 85 HB3 LEU 12 HB3 LEU 12 14.285 29.718 15.044 86 HG LEU 12 HG LEU 12 13.712 26.976 13.790 87 HD11 LEU 12 HD11 LEU 12 11.772 27.819 15.052 88 HD12 LEU 12 HD12 LEU 12 11.879 29.373 14.191 89 HD13 LEU 12 HD13 LEU 12 11.481 27.880 13.318 90 HD21 LEU 12 HD21 LEU 12 13.840 29.786 12.602 91 HD22 LEU 12 HD22 LEU 12 14.979 28.462 12.271 92 HD23 LEU 12 HD23 LEU 12 13.309 28.335 11.742 93 H SER 13 H SER 13 16.402 27.997 17.603 94 HA SER 13 HA SER 13 18.014 30.374 17.940 95 HB2 SER 13 HB2 SER 13 18.211 27.678 19.346 96 HB3 SER 13 HB3 SER 13 18.994 29.173 19.875 97 HG SER 13 HG SER 13 16.940 30.100 20.206 98 H CYS 14 H CYS 14 18.685 27.236 16.514 99 HA CYS 14 HA CYS 14 21.596 27.600 16.549 100 HB2 CYS 14 HB2 CYS 14 19.677 25.418 15.778 101 HB3 CYS 14 HB3 CYS 14 21.418 25.289 15.578 102 H ARG 15 H ARG 15 19.079 27.922 14.126 103 HA ARG 15 HA ARG 15 20.865 27.465 11.882 104 HB2 ARG 15 HB2 ARG 15 18.146 28.445 12.425 105 HB3 ARG 15 HB3 ARG 15 18.700 28.482 10.723 106 HG2 ARG 15 HG2 ARG 15 19.187 26.128 10.691 107 HG3 ARG 15 HG3 ARG 15 18.849 25.922 12.393 108 HD2 ARG 15 HD2 ARG 15 16.456 26.429 12.001 109 HD3 ARG 15 HD3 ARG 15 16.775 26.769 10.296 110 HE ARG 15 HE ARG 15 16.407 24.163 11.504 111 HH11 ARG 15 HH11 ARG 15 17.863 25.716 8.680 112 HH12 ARG 15 HH12 ARG 15 18.001 24.142 7.887 113 HH21 ARG 15 HH21 ARG 15 16.574 22.367 10.384 114 HH22 ARG 15 HH22 ARG 15 17.323 22.373 8.774 115 H SER 16 H SER 16 19.807 30.362 13.537 116 HA SER 16 HA SER 16 20.769 32.514 12.027 117 HB2 SER 16 HB2 SER 16 21.094 31.757 14.968 118 HB3 SER 16 HB3 SER 16 21.375 33.401 14.323 119 HG SER 16 HG SER 16 19.304 33.080 15.209 120 H LEU 17 H LEU 17 22.534 29.858 13.303 121 HA LEU 17 HA LEU 17 25.175 31.136 13.445 122 HB2 LEU 17 HB2 LEU 17 24.501 28.312 14.212 123 HB3 LEU 17 HB3 LEU 17 25.673 29.395 14.916 124 HG LEU 17 HG LEU 17 22.632 29.550 15.337 125 HD11 LEU 17 HD11 LEU 17 23.838 27.658 16.451 126 HD12 LEU 17 HD12 LEU 17 24.961 28.818 17.181 127 HD13 LEU 17 HD13 LEU 17 23.244 28.856 17.618 128 HD21 LEU 17 HD21 LEU 17 23.697 31.813 15.452 129 HD22 LEU 17 HD22 LEU 17 23.174 31.235 17.036 130 HD23 LEU 17 HD23 LEU 17 24.891 31.173 16.594 131 H GLY 18 H GLY 18 23.467 29.492 11.049 132 HA2 GLY 18 HA2 GLY 18 24.168 28.402 9.116 133 HA3 GLY 18 HA3 GLY 18 25.860 28.583 9.604 134 H LEU 19 H LEU 19 23.479 27.121 11.730 135 HA LEU 19 HA LEU 19 24.621 24.390 11.307 136 HB2 LEU 19 HB2 LEU 19 23.832 25.658 13.958 137 HB3 LEU 19 HB3 LEU 19 24.527 24.073 13.735 138 HG LEU 19 HG LEU 19 25.946 26.703 13.203 139 HD11 LEU 19 HD11 LEU 19 27.276 26.131 15.175 140 HD12 LEU 19 HD12 LEU 19 25.565 26.290 15.581 141 HD13 LEU 19 HD13 LEU 19 26.297 24.672 15.436 142 HD21 LEU 19 HD21 LEU 19 26.831 24.844 11.764 143 HD22 LEU 19 HD22 LEU 19 27.990 25.360 12.987 144 HD23 LEU 19 HD23 LEU 19 27.070 23.864 13.226 145 H LEU 20 H LEU 20 23.166 22.808 12.573 146 HA LEU 20 HA LEU 20 20.245 23.307 12.191 147 HB2 LEU 20 HB2 LEU 20 20.922 21.305 11.065 148 HB3 LEU 20 HB3 LEU 20 21.990 20.847 12.390 149 HG LEU 20 HG LEU 20 19.987 20.362 13.808 150 HD11 LEU 20 HD11 LEU 20 17.796 20.195 12.749 151 HD12 LEU 20 HD12 LEU 20 18.362 21.849 12.478 152 HD13 LEU 20 HD13 LEU 20 18.464 20.660 11.175 153 HD21 LEU 20 HD21 LEU 20 21.113 18.561 12.597 154 HD22 LEU 20 HD22 LEU 20 19.363 18.299 12.653 155 HD23 LEU 20 HD23 LEU 20 20.122 18.887 11.161 156 H GLY 21 H GLY 21 18.976 22.573 14.073 157 HA2 GLY 21 HA2 GLY 21 20.449 22.650 16.685 158 HA3 GLY 21 HA3 GLY 21 18.860 23.347 16.553 159 H LYS 22 H LYS 22 20.088 21.127 18.097 160 HA LYS 22 HA LYS 22 18.052 19.004 17.660 161 HB2 LYS 22 HB2 LYS 22 21.040 18.875 18.098 162 HB3 LYS 22 HB3 LYS 22 20.026 17.512 18.482 163 HG2 LYS 22 HG2 LYS 22 20.264 18.777 15.718 164 HG3 LYS 22 HG3 LYS 22 21.237 17.444 16.299 165 HD2 LYS 22 HD2 LYS 22 18.522 16.653 16.742 166 HD3 LYS 22 HD3 LYS 22 18.584 17.394 15.126 167 HE2 LYS 22 HE2 LYS 22 20.655 15.947 14.711 168 HE3 LYS 22 HE3 LYS 22 20.287 15.121 16.229 169 HZ1 LYS 22 HZ1 LYS 22 18.645 15.177 13.763 170 HZ2 LYS 22 HZ2 LYS 22 19.346 13.883 14.414 171 HZ3 LYS 22 HZ3 LYS 22 18.047 14.574 15.175 172 H CYS 23 H CYS 23 16.729 19.621 19.347 173 HA CYS 23 HA CYS 23 17.910 19.443 22.097 174 HB2 CYS 23 HB2 CYS 23 16.940 21.635 21.697 175 HB3 CYS 23 HB3 CYS 23 15.405 20.900 21.264 176 H ILE 24 H ILE 24 17.964 17.261 21.669 177 HA ILE 24 HA ILE 24 15.753 15.897 20.543 178 HB ILE 24 HB ILE 24 18.194 14.545 21.731 179 HG12 ILE 24 HG12 ILE 24 18.033 16.213 19.195 180 HG13 ILE 24 HG13 ILE 24 19.205 16.374 20.517 181 HG21 ILE 24 HG21 ILE 24 16.486 13.962 19.260 182 HG22 ILE 24 HG22 ILE 24 17.783 12.939 19.927 183 HG23 ILE 24 HG23 ILE 24 16.297 13.166 20.839 184 HD11 ILE 24 HD11 ILE 24 20.064 14.070 19.880 185 HD12 ILE 24 HD12 ILE 24 19.070 14.234 18.394 186 HD13 ILE 24 HD13 ILE 24 20.370 15.388 18.742 187 H GLY 25 H GLY 25 17.312 15.226 23.717 188 HA2 GLY 25 HA2 GLY 25 14.754 14.320 24.876 189 HA3 GLY 25 HA3 GLY 25 16.266 14.632 25.733 190 H GLU 26 H GLU 26 16.901 16.887 25.993 191 HA GLU 26 HA GLU 26 14.721 18.902 26.021 192 HB2 GLU 26 HB2 GLU 26 14.755 17.175 28.126 193 HB3 GLU 26 HB3 GLU 26 15.939 18.335 28.698 194 HG2 GLU 26 HG2 GLU 26 13.909 19.069 29.603 195 HG3 GLU 26 HG3 GLU 26 14.160 20.159 28.244 196 H GLU 27 H GLU 27 18.010 18.252 25.818 197 HA GLU 27 HA GLU 27 18.848 20.966 26.671 198 HB2 GLU 27 HB2 GLU 27 21.057 20.129 26.885 199 HB3 GLU 27 HB3 GLU 27 19.947 19.222 27.886 200 HG2 GLU 27 HG2 GLU 27 21.140 18.223 25.257 201 HG3 GLU 27 HG3 GLU 27 21.755 17.893 26.855 202 H CYS 28 H CYS 28 19.110 22.444 25.091 203 HA CYS 28 HA CYS 28 19.047 21.572 22.297 204 HB2 CYS 28 HB2 CYS 28 17.771 23.515 23.064 205 HB3 CYS 28 HB3 CYS 28 19.262 24.310 23.552 206 H LYS 29 H LYS 29 20.761 20.880 21.242 207 HA LYS 29 HA LYS 29 23.342 22.388 21.460 208 HB2 LYS 29 HB2 LYS 29 24.506 20.476 20.632 209 HB3 LYS 29 HB3 LYS 29 23.549 19.971 22.047 210 HG2 LYS 29 HG2 LYS 29 22.016 18.759 20.716 211 HG3 LYS 29 HG3 LYS 29 22.701 19.442 19.213 212 HD2 LYS 29 HD2 LYS 29 24.746 18.290 19.455 213 HD3 LYS 29 HD3 LYS 29 24.379 17.849 21.136 214 HE2 LYS 29 HE2 LYS 29 22.598 16.346 20.422 215 HE3 LYS 29 HE3 LYS 29 22.851 16.782 18.719 216 HZ1 LYS 29 HZ1 LYS 29 24.983 15.751 18.761 217 HZ2 LYS 29 HZ2 LYS 29 25.033 15.684 20.378 218 HZ3 LYS 29 HZ3 LYS 29 24.008 14.682 19.558 219 H CYS 30 H CYS 30 24.298 23.139 19.540 220 HA CYS 30 HA CYS 30 22.626 22.819 17.065 221 HB2 CYS 30 HB2 CYS 30 24.702 24.974 17.371 222 HB3 CYS 30 HB3 CYS 30 23.350 24.844 16.208 223 H VAL 31 H VAL 31 23.512 22.090 15.299 224 HA VAL 31 HA VAL 31 26.192 20.815 15.558 225 HB VAL 31 HB VAL 31 25.223 18.794 14.677 226 HG11 VAL 31 HG11 VAL 31 24.093 18.047 16.664 227 HG12 VAL 31 HG12 VAL 31 25.366 19.182 17.128 228 HG13 VAL 31 HG13 VAL 31 23.663 19.712 17.118 229 HG21 VAL 31 HG21 VAL 31 23.333 19.458 13.395 230 HG22 VAL 31 HG22 VAL 31 22.786 18.392 14.673 231 HG23 VAL 31 HG23 VAL 31 22.505 20.142 14.828 232 HA PRO 32 HA PRO 32 26.567 22.114 11.237 233 HB2 PRO 32 HB2 PRO 32 28.980 20.915 10.652 234 HB3 PRO 32 HB3 PRO 32 28.786 22.482 11.487 235 HG2 PRO 32 HG2 PRO 32 29.492 19.823 12.658 236 HG3 PRO 32 HG3 PRO 32 29.944 21.475 13.196 237 HD2 PRO 32 HD2 PRO 32 27.921 19.847 14.309 238 HD3 PRO 32 HD3 PRO 32 28.130 21.600 14.567 239 H TYR 33 H TYR 33 24.819 21.018 10.613 240 HA TYR 33 HA TYR 33 24.554 18.176 10.350 241 HB2 TYR 33 HB2 TYR 33 22.466 18.515 9.334 242 HB3 TYR 33 HB3 TYR 33 22.656 19.525 10.738 243 HD1 TYR 33 HD2 TYR 33 23.322 22.010 10.327 244 HD2 TYR 33 HD1 TYR 33 21.565 19.429 7.374 245 HE1 TYR 33 HE2 TYR 33 22.761 24.014 8.907 246 HE2 TYR 33 HE1 TYR 33 20.881 21.417 6.029 247 HH TYR 33 HH TYR 33 21.941 24.719 6.881 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 14.335 16.218 32.171 2 H2 GLY 1 H2 GLY 1 13.193 16.169 30.989 3 H3 GLY 1 H3 GLY 1 13.111 15.118 32.258 4 HA2 GLY 1 HA2 GLY 1 12.710 16.900 33.780 5 HA3 GLY 1 HA3 GLY 1 12.797 18.038 32.417 6 H SER 2 H SER 2 10.849 18.680 31.789 7 HA SER 2 HA SER 2 8.505 16.852 31.954 8 HB2 SER 2 HB2 SER 2 7.167 18.699 32.843 9 HB3 SER 2 HB3 SER 2 8.512 18.274 33.914 10 HG SER 2 HG SER 2 8.291 20.514 33.646 11 H ALA 3 H ALA 3 10.044 17.360 29.646 12 HA ALA 3 HA ALA 3 9.911 17.858 27.471 13 HB1 ALA 3 HB1 ALA 3 7.940 16.408 27.630 14 HB2 ALA 3 HB2 ALA 3 6.902 17.828 27.892 15 HB3 ALA 3 HB3 ALA 3 7.761 17.622 26.353 16 H PHE 4 H PHE 4 10.578 20.065 28.982 17 HA PHE 4 HA PHE 4 9.008 22.320 27.867 18 HB2 PHE 4 HB2 PHE 4 9.345 21.995 30.358 19 HB3 PHE 4 HB3 PHE 4 11.014 22.503 30.109 20 HD1 PHE 4 HD1 PHE 4 7.535 23.596 29.079 21 HD2 PHE 4 HD2 PHE 4 11.410 24.804 30.538 22 HE1 PHE 4 HE1 PHE 4 6.789 25.958 29.107 23 HE2 PHE 4 HE2 PHE 4 10.646 27.162 30.582 24 HZ PHE 4 HZ PHE 4 8.338 27.746 29.853 25 H CYS 5 H CYS 5 11.005 20.922 26.212 26 HA CYS 5 HA CYS 5 11.944 23.412 24.981 27 HB2 CYS 5 HB2 CYS 5 13.941 22.644 26.255 28 HB3 CYS 5 HB3 CYS 5 13.785 21.075 25.474 29 H ASN 6 H ASN 6 11.543 23.322 22.826 30 HA ASN 6 HA ASN 6 10.666 20.715 21.642 31 HB2 ASN 6 HB2 ASN 6 8.932 22.448 21.761 32 HB3 ASN 6 HB3 ASN 6 9.988 23.601 20.934 33 HD21 ASN 6 HD22 ASN 6 8.099 20.599 20.501 34 HD22 ASN 6 HD21 ASN 6 8.211 20.629 18.746 35 H LEU 7 H LEU 7 12.022 19.774 20.141 36 HA LEU 7 HA LEU 7 14.501 20.971 19.472 37 HB2 LEU 7 HB2 LEU 7 14.121 18.557 19.461 38 HB3 LEU 7 HB3 LEU 7 13.086 18.695 18.042 39 HG LEU 7 HG LEU 7 15.907 19.777 17.857 40 HD11 LEU 7 HD11 LEU 7 15.066 16.841 17.657 41 HD12 LEU 7 HD12 LEU 7 16.646 17.461 17.179 42 HD13 LEU 7 HD13 LEU 7 16.143 17.521 18.882 43 HD21 LEU 7 HD21 LEU 7 14.143 18.319 15.842 44 HD22 LEU 7 HD22 LEU 7 14.479 20.062 15.854 45 HD23 LEU 7 HD23 LEU 7 15.781 18.930 15.550 46 H ARG 8 H ARG 8 11.571 20.682 17.416 47 HA ARG 8 HA ARG 8 12.557 21.961 15.100 48 HB2 ARG 8 HB2 ARG 8 10.379 20.731 15.464 49 HB3 ARG 8 HB3 ARG 8 9.738 22.165 16.244 50 HG2 ARG 8 HG2 ARG 8 10.678 22.021 13.349 51 HG3 ARG 8 HG3 ARG 8 9.020 21.814 13.919 52 HD2 ARG 8 HD2 ARG 8 9.410 24.180 15.049 53 HD3 ARG 8 HD3 ARG 8 10.658 24.339 13.802 54 HE ARG 8 HE ARG 8 7.733 24.235 13.444 55 HH11 ARG 8 HH11 ARG 8 10.758 23.854 11.601 56 HH12 ARG 8 HH12 ARG 8 9.897 24.305 10.139 57 HH21 ARG 8 HH21 ARG 8 6.875 24.804 11.559 58 HH22 ARG 8 HH22 ARG 8 7.878 24.805 10.100 59 H ARG 9 H ARG 9 11.208 23.507 18.011 60 HA ARG 9 HA ARG 9 11.514 26.168 16.918 61 HB2 ARG 9 HB2 ARG 9 9.881 25.265 18.720 62 HB3 ARG 9 HB3 ARG 9 11.199 25.563 19.873 63 HG2 ARG 9 HG2 ARG 9 11.220 27.943 19.266 64 HG3 ARG 9 HG3 ARG 9 10.141 27.634 17.893 65 HD2 ARG 9 HD2 ARG 9 8.614 28.420 19.400 66 HD3 ARG 9 HD3 ARG 9 8.492 26.695 19.690 67 HE ARG 9 HE ARG 9 9.464 26.965 21.810 68 HH11 ARG 9 HH11 ARG 9 9.467 30.083 20.150 69 HH12 ARG 9 HH12 ARG 9 9.411 30.950 21.654 70 HH21 ARG 9 HH21 ARG 9 9.749 28.127 23.630 71 HH22 ARG 9 HH22 ARG 9 9.534 29.867 23.601 72 H CYS 10 H CYS 10 13.677 24.156 18.895 73 HA CYS 10 HA CYS 10 15.621 26.325 19.214 74 HB2 CYS 10 HB2 CYS 10 15.497 24.249 20.689 75 HB3 CYS 10 HB3 CYS 10 16.155 23.346 19.307 76 H GLU 11 H GLU 11 14.945 23.837 16.795 77 HA GLU 11 HA GLU 11 17.236 23.629 15.414 78 HB2 GLU 11 HB2 GLU 11 14.796 22.647 14.976 79 HB3 GLU 11 HB3 GLU 11 14.775 23.903 13.737 80 HG2 GLU 11 HG2 GLU 11 17.212 22.741 13.285 81 HG3 GLU 11 HG3 GLU 11 16.348 21.376 13.948 82 H LEU 12 H LEU 12 14.990 26.247 15.146 83 HA LEU 12 HA LEU 12 16.236 27.576 12.887 84 HB2 LEU 12 HB2 LEU 12 14.073 28.280 14.883 85 HB3 LEU 12 HB3 LEU 12 14.376 29.208 13.392 86 HG LEU 12 HG LEU 12 13.522 26.266 13.516 87 HD11 LEU 12 HD11 LEU 12 11.342 27.079 12.783 88 HD12 LEU 12 HD12 LEU 12 11.783 27.785 14.341 89 HD13 LEU 12 HD13 LEU 12 11.919 28.762 12.863 90 HD21 LEU 12 HD21 LEU 12 12.996 26.523 11.137 91 HD22 LEU 12 HD22 LEU 12 13.663 28.171 11.149 92 HD23 LEU 12 HD23 LEU 12 14.718 26.758 11.426 93 H SER 13 H SER 13 16.221 28.080 16.432 94 HA SER 13 HA SER 13 17.464 30.690 16.401 95 HB2 SER 13 HB2 SER 13 17.706 28.608 18.601 96 HB3 SER 13 HB3 SER 13 17.768 30.376 18.747 97 HG SER 13 HG SER 13 15.498 30.090 17.697 98 H CYS 14 H CYS 14 18.650 27.387 16.376 99 HA CYS 14 HA CYS 14 21.475 27.950 16.445 100 HB2 CYS 14 HB2 CYS 14 19.739 25.661 15.513 101 HB3 CYS 14 HB3 CYS 14 21.490 25.623 15.452 102 H ARG 15 H ARG 15 19.093 28.092 13.741 103 HA ARG 15 HA ARG 15 21.213 27.732 11.783 104 HB2 ARG 15 HB2 ARG 15 18.383 28.540 11.828 105 HB3 ARG 15 HB3 ARG 15 19.238 28.589 10.258 106 HG2 ARG 15 HG2 ARG 15 19.901 26.223 10.498 107 HG3 ARG 15 HG3 ARG 15 19.066 26.115 12.033 108 HD2 ARG 15 HD2 ARG 15 16.915 26.586 10.932 109 HD3 ARG 15 HD3 ARG 15 17.732 26.751 9.371 110 HE ARG 15 HE ARG 15 17.020 24.283 10.773 111 HH11 ARG 15 HH21 ARG 15 19.182 25.521 8.262 112 HH12 ARG 15 HH22 ARG 15 19.294 23.938 7.524 113 HH21 ARG 15 HH12 ARG 15 17.146 22.457 9.757 114 HH22 ARG 15 HH11 ARG 15 18.163 22.271 8.304 115 H SER 16 H SER 16 20.014 30.562 13.396 116 HA SER 16 HA SER 16 21.096 32.732 11.948 117 HB2 SER 16 HB2 SER 16 21.320 32.007 14.893 118 HB3 SER 16 HB3 SER 16 21.528 33.646 14.230 119 HG SER 16 HG SER 16 19.449 33.053 15.167 120 H LEU 17 H LEU 17 22.737 29.968 13.104 121 HA LEU 17 HA LEU 17 25.409 31.225 13.367 122 HB2 LEU 17 HB2 LEU 17 24.637 28.488 14.329 123 HB3 LEU 17 HB3 LEU 17 25.803 29.600 14.998 124 HG LEU 17 HG LEU 17 22.739 29.898 15.273 125 HD11 LEU 17 HD11 LEU 17 23.709 27.964 16.508 126 HD12 LEU 17 HD12 LEU 17 24.885 29.055 17.268 127 HD13 LEU 17 HD13 LEU 17 23.148 29.249 17.596 128 HD21 LEU 17 HD21 LEU 17 25.008 31.391 16.634 129 HD22 LEU 17 HD22 LEU 17 23.964 32.076 15.384 130 HD23 LEU 17 HD23 LEU 17 23.269 31.591 16.934 131 H GLY 18 H GLY 18 23.657 29.533 11.074 132 HA2 GLY 18 HA2 GLY 18 24.212 28.200 9.270 133 HA3 GLY 18 HA3 GLY 18 25.924 28.304 9.705 134 H LEU 19 H LEU 19 23.373 27.114 11.912 135 HA LEU 19 HA LEU 19 24.396 24.300 11.747 136 HB2 LEU 19 HB2 LEU 19 23.769 25.890 14.273 137 HB3 LEU 19 HB3 LEU 19 24.400 24.255 14.195 138 HG LEU 19 HG LEU 19 25.923 26.753 13.345 139 HD11 LEU 19 HD11 LEU 19 25.499 26.652 15.798 140 HD12 LEU 19 HD12 LEU 19 26.288 25.053 15.839 141 HD13 LEU 19 HD13 LEU 19 27.204 26.498 15.372 142 HD21 LEU 19 HD21 LEU 19 26.669 24.625 12.235 143 HD22 LEU 19 HD22 LEU 19 27.882 25.268 13.351 144 HD23 LEU 19 HD23 LEU 19 26.873 23.889 13.833 145 H LEU 20 H LEU 20 23.030 22.739 12.496 146 HA LEU 20 HA LEU 20 20.108 23.140 12.428 147 HB2 LEU 20 HB2 LEU 20 21.342 21.102 11.623 148 HB3 LEU 20 HB3 LEU 20 21.908 20.813 13.261 149 HG LEU 20 HG LEU 20 19.419 20.622 13.938 150 HD11 LEU 20 HD11 LEU 20 17.844 20.041 12.196 151 HD12 LEU 20 HD12 LEU 20 18.517 21.643 11.813 152 HD13 LEU 20 HD13 LEU 20 19.080 20.221 10.943 153 HD21 LEU 20 HD21 LEU 20 20.966 18.718 13.736 154 HD22 LEU 20 HD22 LEU 20 19.263 18.341 13.376 155 HD23 LEU 20 HD23 LEU 20 20.437 18.486 12.066 156 H GLY 21 H GLY 21 18.858 22.534 14.410 157 HA2 GLY 21 HA2 GLY 21 20.354 22.746 17.000 158 HA3 GLY 21 HA3 GLY 21 18.748 23.419 16.846 159 H LYS 22 H LYS 22 20.080 21.133 18.397 160 HA LYS 22 HA LYS 22 17.948 19.102 18.001 161 HB2 LYS 22 HB2 LYS 22 20.905 18.539 18.379 162 HB3 LYS 22 HB3 LYS 22 19.617 17.364 18.651 163 HG2 LYS 22 HG2 LYS 22 18.833 17.884 16.236 164 HG3 LYS 22 HG3 LYS 22 20.409 18.674 16.030 165 HD2 LYS 22 HD2 LYS 22 21.516 16.523 16.729 166 HD3 LYS 22 HD3 LYS 22 19.910 15.807 16.929 167 HE2 LYS 22 HE2 LYS 22 19.484 16.369 14.477 168 HE3 LYS 22 HE3 LYS 22 21.221 16.713 14.340 169 HZ1 LYS 22 HZ1 LYS 22 20.087 14.174 15.326 170 HZ2 LYS 22 HZ2 LYS 22 20.540 14.385 13.784 171 HZ3 LYS 22 HZ3 LYS 22 21.685 14.446 14.984 172 H CYS 23 H CYS 23 16.722 19.607 19.651 173 HA CYS 23 HA CYS 23 17.845 19.453 22.419 174 HB2 CYS 23 HB2 CYS 23 16.894 21.678 21.677 175 HB3 CYS 23 HB3 CYS 23 15.347 20.908 21.532 176 H ILE 24 H ILE 24 17.725 17.153 22.128 177 HA ILE 24 HA ILE 24 15.160 15.816 21.582 178 HB ILE 24 HB ILE 24 17.916 14.706 22.261 179 HG12 ILE 24 HG12 ILE 24 16.669 15.188 19.515 180 HG13 ILE 24 HG13 ILE 24 18.027 16.088 20.208 181 HG21 ILE 24 HG21 ILE 24 17.065 12.600 21.250 182 HG22 ILE 24 HG22 ILE 24 16.092 13.068 22.623 183 HG23 ILE 24 HG23 ILE 24 15.484 13.366 20.976 184 HD11 ILE 24 HD11 ILE 24 19.355 13.957 20.278 185 HD12 ILE 24 HD12 ILE 24 18.055 13.190 19.328 186 HD13 ILE 24 HD13 ILE 24 18.945 14.560 18.662 187 H GLY 25 H GLY 25 17.484 16.088 24.251 188 HA2 GLY 25 HA2 GLY 25 15.551 14.898 26.208 189 HA3 GLY 25 HA3 GLY 25 17.307 14.856 26.344 190 H GLU 26 H GLU 26 15.060 17.504 25.562 191 HA GLU 26 HA GLU 26 14.770 19.560 26.266 192 HB2 GLU 26 HB2 GLU 26 14.994 18.374 29.021 193 HB3 GLU 26 HB3 GLU 26 14.234 19.915 28.606 194 HG2 GLU 26 HG2 GLU 26 12.555 18.832 27.244 195 HG3 GLU 26 HG3 GLU 26 13.310 17.251 27.502 196 H GLU 27 H GLU 27 17.640 18.946 25.831 197 HA GLU 27 HA GLU 27 18.521 21.628 26.632 198 HB2 GLU 27 HB2 GLU 27 20.721 20.850 27.424 199 HB3 GLU 27 HB3 GLU 27 19.373 20.336 28.441 200 HG2 GLU 27 HG2 GLU 27 19.475 18.063 27.254 201 HG3 GLU 27 HG3 GLU 27 20.984 18.619 26.532 202 H CYS 28 H CYS 28 19.857 22.608 25.059 203 HA CYS 28 HA CYS 28 19.537 21.123 22.499 204 HB2 CYS 28 HB2 CYS 28 18.067 23.097 22.962 205 HB3 CYS 28 HB3 CYS 28 19.501 24.112 22.840 206 H LYS 29 H LYS 29 21.284 20.368 21.604 207 HA LYS 29 HA LYS 29 23.843 21.798 21.397 208 HB2 LYS 29 HB2 LYS 29 23.396 19.250 21.503 209 HB3 LYS 29 HB3 LYS 29 22.766 19.384 19.857 210 HG2 LYS 29 HG2 LYS 29 25.013 20.296 19.149 211 HG3 LYS 29 HG3 LYS 29 25.553 20.129 20.826 212 HD2 LYS 29 HD2 LYS 29 24.815 17.606 20.558 213 HD3 LYS 29 HD3 LYS 29 24.895 17.953 18.805 214 HE2 LYS 29 HE2 LYS 29 27.199 18.742 19.045 215 HE3 LYS 29 HE3 LYS 29 27.076 18.622 20.807 216 HZ1 LYS 29 HZ1 LYS 29 28.304 16.758 19.934 217 HZ2 LYS 29 HZ2 LYS 29 26.915 16.189 20.577 218 HZ3 LYS 29 HZ3 LYS 29 27.072 16.272 18.955 219 H CYS 30 H CYS 30 24.444 23.009 19.516 220 HA CYS 30 HA CYS 30 22.549 22.812 17.211 221 HB2 CYS 30 HB2 CYS 30 24.618 24.984 17.355 222 HB3 CYS 30 HB3 CYS 30 23.261 24.835 16.228 223 H VAL 31 H VAL 31 23.413 22.232 15.250 224 HA VAL 31 HA VAL 31 25.967 20.704 15.533 225 HB VAL 31 HB VAL 31 23.623 19.437 14.174 226 HG11 VAL 31 HG11 VAL 31 25.802 18.414 16.062 227 HG12 VAL 31 HG12 VAL 31 24.679 17.426 15.101 228 HG13 VAL 31 HG13 VAL 31 25.902 18.403 14.292 229 HG21 VAL 31 HG21 VAL 31 22.877 18.407 16.304 230 HG22 VAL 31 HG22 VAL 31 23.857 19.572 17.207 231 HG23 VAL 31 HG23 VAL 31 22.481 20.123 16.214 232 HA PRO 32 HA PRO 32 26.635 22.350 11.412 233 HB2 PRO 32 HB2 PRO 32 28.798 20.233 11.229 234 HB3 PRO 32 HB3 PRO 32 28.874 21.983 10.874 235 HG2 PRO 32 HG2 PRO 32 29.882 21.000 13.178 236 HG3 PRO 32 HG3 PRO 32 28.934 22.523 13.207 237 HD2 PRO 32 HD2 PRO 32 27.993 19.708 13.840 238 HD3 PRO 32 HD3 PRO 32 27.774 21.215 14.774 239 H TYR 33 H TYR 33 24.618 21.628 10.493 240 HA TYR 33 HA TYR 33 23.979 19.087 9.635 241 HB2 TYR 33 HB2 TYR 33 22.644 21.363 9.560 242 HB3 TYR 33 HB3 TYR 33 23.190 21.428 7.903 243 HD1 TYR 33 HD2 TYR 33 21.362 19.491 10.391 244 HD2 TYR 33 HD1 TYR 33 22.214 19.872 6.207 245 HE1 TYR 33 HE2 TYR 33 19.488 17.880 9.896 246 HE2 TYR 33 HE1 TYR 33 20.401 18.218 5.689 247 HH TYR 33 HH TYR 33 18.794 16.761 6.580 Start of MODEL 11 1 H1 GLY 1 H1 GLY 1 12.269 19.048 26.937 2 H2 GLY 1 H2 GLY 1 11.385 20.171 26.043 3 H3 GLY 1 H3 GLY 1 12.562 19.263 25.342 4 HA2 GLY 1 HA2 GLY 1 10.518 18.340 24.688 5 HA3 GLY 1 HA3 GLY 1 11.376 17.235 25.761 6 H SER 2 H SER 2 10.779 17.289 28.096 7 HA SER 2 HA SER 2 7.942 18.002 28.587 8 HB2 SER 2 HB2 SER 2 8.129 16.838 30.621 9 HB3 SER 2 HB3 SER 2 8.838 15.819 29.369 10 HG SER 2 HG SER 2 10.882 16.391 30.079 11 H ALA 3 H ALA 3 11.240 18.951 29.449 12 HA ALA 3 HA ALA 3 10.450 21.385 30.863 13 HB1 ALA 3 HB1 ALA 3 13.120 20.477 29.724 14 HB2 ALA 3 HB2 ALA 3 12.855 21.836 30.847 15 HB3 ALA 3 HB3 ALA 3 12.549 20.167 31.385 16 H PHE 4 H PHE 4 11.196 23.475 30.023 17 HA PHE 4 HA PHE 4 9.489 24.148 27.959 18 HB2 PHE 4 HB2 PHE 4 10.236 25.543 29.862 19 HB3 PHE 4 HB3 PHE 4 11.804 25.768 29.102 20 HD1 PHE 4 HD2 PHE 4 8.119 26.287 28.494 21 HD2 PHE 4 HD1 PHE 4 12.129 27.660 27.719 22 HE1 PHE 4 HE2 PHE 4 7.220 28.284 27.330 23 HE2 PHE 4 HE1 PHE 4 11.215 29.650 26.554 24 HZ PHE 4 HZ PHE 4 8.757 29.968 26.350 25 H CYS 5 H CYS 5 12.852 23.255 27.364 26 HA CYS 5 HA CYS 5 13.168 24.525 24.805 27 HB2 CYS 5 HB2 CYS 5 14.947 23.326 26.179 28 HB3 CYS 5 HB3 CYS 5 14.215 21.802 25.674 29 H ASN 6 H ASN 6 12.733 23.790 22.683 30 HA ASN 6 HA ASN 6 11.609 21.071 22.355 31 HB2 ASN 6 HB2 ASN 6 9.651 22.777 22.302 32 HB3 ASN 6 HB3 ASN 6 10.340 23.377 20.814 33 HD21 ASN 6 HD22 ASN 6 8.881 20.596 22.400 34 HD22 ASN 6 HD21 ASN 6 8.754 19.607 20.936 35 H LEU 7 H LEU 7 12.510 20.033 20.501 36 HA LEU 7 HA LEU 7 14.785 21.229 19.287 37 HB2 LEU 7 HB2 LEU 7 14.453 18.806 19.421 38 HB3 LEU 7 HB3 LEU 7 13.084 18.906 18.299 39 HG LEU 7 HG LEU 7 15.807 19.954 17.453 40 HD11 LEU 7 HD11 LEU 7 16.317 17.652 16.615 41 HD12 LEU 7 HD12 LEU 7 16.164 17.649 18.387 42 HD13 LEU 7 HD13 LEU 7 14.839 17.059 17.377 43 HD21 LEU 7 HD21 LEU 7 15.100 19.101 15.224 44 HD22 LEU 7 HD22 LEU 7 13.568 18.546 15.918 45 HD23 LEU 7 HD23 LEU 7 13.935 20.275 15.808 46 H ARG 8 H ARG 8 11.380 21.174 18.138 47 HA ARG 8 HA ARG 8 12.011 22.229 15.569 48 HB2 ARG 8 HB2 ARG 8 9.783 21.116 16.517 49 HB3 ARG 8 HB3 ARG 8 9.365 22.762 17.027 50 HG2 ARG 8 HG2 ARG 8 9.673 23.423 14.567 51 HG3 ARG 8 HG3 ARG 8 9.876 21.710 14.191 52 HD2 ARG 8 HD2 ARG 8 7.586 21.295 15.098 53 HD3 ARG 8 HD3 ARG 8 7.402 23.033 15.403 54 HE ARG 8 HE ARG 8 8.164 22.350 12.639 55 HH11 ARG 8 HH12 ARG 8 5.224 22.794 14.580 56 HH12 ARG 8 HH11 ARG 8 4.375 23.421 13.197 57 HH21 ARG 8 HH21 ARG 8 7.023 22.972 11.032 58 HH22 ARG 8 HH22 ARG 8 5.345 23.502 11.216 59 H ARG 9 H ARG 9 11.808 23.775 18.564 60 HA ARG 9 HA ARG 9 11.711 26.525 17.435 61 HB2 ARG 9 HB2 ARG 9 10.288 25.611 19.416 62 HB3 ARG 9 HB3 ARG 9 11.780 25.718 20.364 63 HG2 ARG 9 HG2 ARG 9 11.896 28.179 19.761 64 HG3 ARG 9 HG3 ARG 9 10.402 27.971 18.836 65 HD2 ARG 9 HD2 ARG 9 9.672 28.793 20.942 66 HD3 ARG 9 HD3 ARG 9 9.337 27.056 20.982 67 HE ARG 9 HE ARG 9 11.824 28.261 22.170 68 HH11 ARG 9 HH11 ARG 9 9.150 25.995 22.734 69 HH12 ARG 9 HH12 ARG 9 9.803 25.637 24.325 70 HH21 ARG 9 HH21 ARG 9 12.493 27.657 24.162 71 HH22 ARG 9 HH22 ARG 9 11.505 26.532 25.075 72 H CYS 10 H CYS 10 13.879 24.306 19.196 73 HA CYS 10 HA CYS 10 15.970 26.268 19.508 74 HB2 CYS 10 HB2 CYS 10 15.646 24.125 20.871 75 HB3 CYS 10 HB3 CYS 10 16.308 23.268 19.454 76 H GLU 11 H GLU 11 15.141 23.927 16.910 77 HA GLU 11 HA GLU 11 17.385 23.956 15.358 78 HB2 GLU 11 HB2 GLU 11 14.486 24.024 14.633 79 HB3 GLU 11 HB3 GLU 11 15.668 24.459 13.382 80 HG2 GLU 11 HG2 GLU 11 16.883 22.325 13.825 81 HG3 GLU 11 HG3 GLU 11 15.511 21.819 14.822 82 H LEU 12 H LEU 12 14.989 26.544 15.601 83 HA LEU 12 HA LEU 12 16.285 28.335 13.739 84 HB2 LEU 12 HB2 LEU 12 14.040 28.509 15.737 85 HB3 LEU 12 HB3 LEU 12 14.449 29.862 14.656 86 HG LEU 12 HG LEU 12 13.647 27.052 13.731 87 HD11 LEU 12 HD11 LEU 12 11.531 28.070 13.140 88 HD12 LEU 12 HD12 LEU 12 11.814 28.229 14.876 89 HD13 LEU 12 HD13 LEU 12 12.042 29.635 13.805 90 HD21 LEU 12 HD21 LEU 12 14.990 28.200 12.009 91 HD22 LEU 12 HD22 LEU 12 13.295 28.184 11.533 92 HD23 LEU 12 HD23 LEU 12 14.010 29.664 12.201 93 H SER 13 H SER 13 16.256 28.193 17.347 94 HA SER 13 HA SER 13 17.830 30.524 17.819 95 HB2 SER 13 HB2 SER 13 17.947 27.846 19.279 96 HB3 SER 13 HB3 SER 13 18.552 29.401 19.881 97 HG SER 13 HG SER 13 16.522 29.039 20.749 98 H CYS 14 H CYS 14 18.708 27.375 16.547 99 HA CYS 14 HA CYS 14 21.613 27.866 16.663 100 HB2 CYS 14 HB2 CYS 14 19.801 25.598 15.868 101 HB3 CYS 14 HB3 CYS 14 21.538 25.553 15.679 102 H ARG 15 H ARG 15 19.097 28.067 14.194 103 HA ARG 15 HA ARG 15 20.892 27.533 11.976 104 HB2 ARG 15 HB2 ARG 15 18.163 28.484 12.485 105 HB3 ARG 15 HB3 ARG 15 18.726 28.585 10.797 106 HG2 ARG 15 HG2 ARG 15 19.253 26.245 10.668 107 HG3 ARG 15 HG3 ARG 15 18.908 25.971 12.363 108 HD2 ARG 15 HD2 ARG 15 16.519 26.527 11.979 109 HD3 ARG 15 HD3 ARG 15 16.852 26.946 10.300 110 HE ARG 15 HE ARG 15 16.380 24.301 11.374 111 HH11 ARG 15 HH11 ARG 15 18.005 25.901 8.655 112 HH12 ARG 15 HH12 ARG 15 18.108 24.375 7.809 113 HH21 ARG 15 HH21 ARG 15 16.428 22.582 10.197 114 HH22 ARG 15 HH22 ARG 15 17.293 22.519 8.661 115 H SER 16 H SER 16 19.888 30.464 13.560 116 HA SER 16 HA SER 16 20.855 32.561 11.970 117 HB2 SER 16 HB2 SER 16 21.176 31.971 14.945 118 HB3 SER 16 HB3 SER 16 21.353 33.593 14.186 119 HG SER 16 HG SER 16 19.269 33.481 14.899 120 H LEU 17 H LEU 17 22.585 29.888 13.228 121 HA LEU 17 HA LEU 17 25.238 31.158 13.266 122 HB2 LEU 17 HB2 LEU 17 24.568 28.406 14.218 123 HB3 LEU 17 HB3 LEU 17 25.782 29.491 14.813 124 HG LEU 17 HG LEU 17 22.743 29.771 15.319 125 HD11 LEU 17 HD11 LEU 17 25.061 28.975 17.143 126 HD12 LEU 17 HD12 LEU 17 23.356 29.142 17.608 127 HD13 LEU 17 HD13 LEU 17 23.850 27.859 16.484 128 HD21 LEU 17 HD21 LEU 17 23.414 31.465 16.946 129 HD22 LEU 17 HD22 LEU 17 25.116 31.319 16.456 130 HD23 LEU 17 HD23 LEU 17 23.911 31.976 15.333 131 H GLY 18 H GLY 18 23.429 29.473 10.973 132 HA2 GLY 18 HA2 GLY 18 24.049 28.295 9.057 133 HA3 GLY 18 HA3 GLY 18 25.752 28.457 9.482 134 H LEU 19 H LEU 19 23.458 27.120 11.742 135 HA LEU 19 HA LEU 19 24.587 24.368 11.441 136 HB2 LEU 19 HB2 LEU 19 23.768 25.807 13.999 137 HB3 LEU 19 HB3 LEU 19 24.453 24.211 13.895 138 HG LEU 19 HG LEU 19 25.882 26.808 13.249 139 HD11 LEU 19 HD11 LEU 19 26.283 24.820 15.516 140 HD12 LEU 19 HD12 LEU 19 27.196 26.315 15.236 141 HD13 LEU 19 HD13 LEU 19 25.488 26.411 15.647 142 HD21 LEU 19 HD21 LEU 19 26.986 23.959 13.302 143 HD22 LEU 19 HD22 LEU 19 26.788 24.960 11.847 144 HD23 LEU 19 HD23 LEU 19 27.935 25.447 13.091 145 H LEU 20 H LEU 20 23.190 22.758 12.563 146 HA LEU 20 HA LEU 20 20.265 23.157 12.278 147 HB2 LEU 20 HB2 LEU 20 21.523 20.940 11.643 148 HB3 LEU 20 HB3 LEU 20 21.792 20.761 13.364 149 HG LEU 20 HG LEU 20 19.294 20.683 13.712 150 HD11 LEU 20 HD11 LEU 20 19.317 20.742 10.655 151 HD12 LEU 20 HD12 LEU 20 17.914 20.330 11.648 152 HD13 LEU 20 HD13 LEU 20 18.560 21.967 11.707 153 HD21 LEU 20 HD21 LEU 20 19.019 18.461 12.753 154 HD22 LEU 20 HD22 LEU 20 20.367 18.739 11.629 155 HD23 LEU 20 HD23 LEU 20 20.678 18.634 13.372 156 H GLY 21 H GLY 21 18.958 22.641 14.307 157 HA2 GLY 21 HA2 GLY 21 20.515 22.723 16.853 158 HA3 GLY 21 HA3 GLY 21 18.958 23.516 16.746 159 H LYS 22 H LYS 22 20.147 21.028 18.175 160 HA LYS 22 HA LYS 22 17.795 19.271 17.763 161 HB2 LYS 22 HB2 LYS 22 20.688 18.387 18.036 162 HB3 LYS 22 HB3 LYS 22 19.297 17.352 18.342 163 HG2 LYS 22 HG2 LYS 22 18.510 17.925 15.935 164 HG3 LYS 22 HG3 LYS 22 20.167 18.535 15.707 165 HD2 LYS 22 HD2 LYS 22 21.056 16.305 16.485 166 HD3 LYS 22 HD3 LYS 22 19.388 15.763 16.656 167 HE2 LYS 22 HE2 LYS 22 19.042 16.207 14.199 168 HE3 LYS 22 HE3 LYS 22 20.803 16.485 14.096 169 HZ1 LYS 22 HZ1 LYS 22 21.038 14.207 15.098 170 HZ2 LYS 22 HZ2 LYS 22 19.430 13.989 14.967 171 HZ3 LYS 22 HZ3 LYS 22 20.344 14.177 13.598 172 H CYS 23 H CYS 23 16.662 19.355 19.569 173 HA CYS 23 HA CYS 23 18.050 19.449 22.210 174 HB2 CYS 23 HB2 CYS 23 16.994 21.587 21.617 175 HB3 CYS 23 HB3 CYS 23 15.463 20.782 21.430 176 H ILE 24 H ILE 24 18.026 17.152 21.553 177 HA ILE 24 HA ILE 24 15.615 15.594 21.786 178 HB ILE 24 HB ILE 24 18.492 14.686 22.098 179 HG12 ILE 24 HG12 ILE 24 16.870 15.179 19.552 180 HG13 ILE 24 HG13 ILE 24 18.384 15.963 20.034 181 HG21 ILE 24 HG21 ILE 24 15.988 13.219 21.119 182 HG22 ILE 24 HG22 ILE 24 17.605 12.503 21.320 183 HG23 ILE 24 HG23 ILE 24 16.709 13.032 22.729 184 HD11 ILE 24 HD11 ILE 24 19.565 13.787 19.835 185 HD12 ILE 24 HD12 ILE 24 18.063 13.092 19.149 186 HD13 ILE 24 HD13 ILE 24 18.881 14.415 18.322 187 H GLY 25 H GLY 25 14.540 15.128 23.589 188 HA2 GLY 25 HA2 GLY 25 14.119 14.691 25.855 189 HA3 GLY 25 HA3 GLY 25 15.848 14.754 26.219 190 H GLU 26 H GLU 26 16.640 16.613 27.129 191 HA GLU 26 HA GLU 26 14.697 18.897 27.427 192 HB2 GLU 26 HB2 GLU 26 16.326 17.726 29.679 193 HB3 GLU 26 HB3 GLU 26 15.000 18.872 29.786 194 HG2 GLU 26 HG2 GLU 26 14.819 15.917 29.091 195 HG3 GLU 26 HG3 GLU 26 14.340 16.679 30.584 196 H GLU 27 H GLU 27 17.649 18.493 26.125 197 HA GLU 27 HA GLU 27 18.455 21.252 26.850 198 HB2 GLU 27 HB2 GLU 27 19.543 19.813 28.546 199 HB3 GLU 27 HB3 GLU 27 20.309 18.876 27.279 200 HG2 GLU 27 HG2 GLU 27 21.610 20.828 26.551 201 HG3 GLU 27 HG3 GLU 27 20.706 21.870 27.675 202 H CYS 28 H CYS 28 19.523 22.320 25.206 203 HA CYS 28 HA CYS 28 19.462 20.883 22.644 204 HB2 CYS 28 HB2 CYS 28 18.226 23.029 23.108 205 HB3 CYS 28 HB3 CYS 28 19.781 23.848 23.032 206 H LYS 29 H LYS 29 20.911 20.976 21.039 207 HA LYS 29 HA LYS 29 23.660 22.036 21.436 208 HB2 LYS 29 HB2 LYS 29 23.488 19.446 21.702 209 HB3 LYS 29 HB3 LYS 29 23.009 19.420 20.005 210 HG2 LYS 29 HG2 LYS 29 25.285 20.872 19.746 211 HG3 LYS 29 HG3 LYS 29 25.680 20.072 21.257 212 HD2 LYS 29 HD2 LYS 29 24.928 18.747 18.616 213 HD3 LYS 29 HD3 LYS 29 26.550 18.847 19.290 214 HE2 LYS 29 HE2 LYS 29 24.227 17.402 20.651 215 HE3 LYS 29 HE3 LYS 29 25.369 16.620 19.554 216 HZ1 LYS 29 HZ1 LYS 29 27.169 17.186 21.066 217 HZ2 LYS 29 HZ2 LYS 29 26.115 17.955 22.101 218 HZ3 LYS 29 HZ3 LYS 29 26.032 16.355 21.863 219 H CYS 30 H CYS 30 24.431 23.040 19.492 220 HA CYS 30 HA CYS 30 22.670 22.804 17.076 221 HB2 CYS 30 HB2 CYS 30 24.796 24.912 17.360 222 HB3 CYS 30 HB3 CYS 30 23.402 24.874 16.244 223 H VAL 31 H VAL 31 23.635 22.420 15.092 224 HA VAL 31 HA VAL 31 26.007 20.630 15.400 225 HB VAL 31 HB VAL 31 23.734 19.706 13.688 226 HG11 VAL 31 HG11 VAL 31 25.798 18.398 13.988 227 HG12 VAL 31 HG12 VAL 31 25.589 18.440 15.760 228 HG13 VAL 31 HG13 VAL 31 24.444 17.554 14.741 229 HG21 VAL 31 HG21 VAL 31 23.552 19.590 16.740 230 HG22 VAL 31 HG22 VAL 31 22.399 20.408 15.658 231 HG23 VAL 31 HG23 VAL 31 22.566 18.653 15.602 232 HA PRO 32 HA PRO 32 27.208 22.282 11.374 233 HB2 PRO 32 HB2 PRO 32 28.863 19.768 11.229 234 HB3 PRO 32 HB3 PRO 32 29.335 21.460 10.858 235 HG2 PRO 32 HG2 PRO 32 30.050 20.352 13.211 236 HG3 PRO 32 HG3 PRO 32 29.359 22.013 13.202 237 HD2 PRO 32 HD2 PRO 32 27.928 19.393 13.760 238 HD3 PRO 32 HD3 PRO 32 27.931 20.905 14.717 239 H TYR 33 H TYR 33 24.763 20.885 11.375 240 HA TYR 33 HA TYR 33 23.203 19.809 10.186 241 HB2 TYR 33 HB2 TYR 33 24.498 21.678 8.598 242 HB3 TYR 33 HB3 TYR 33 24.406 20.292 7.561 243 HD1 TYR 33 HD2 TYR 33 22.242 22.076 10.010 244 HD2 TYR 33 HD1 TYR 33 22.560 20.319 6.099 245 HE1 TYR 33 HE2 TYR 33 19.947 22.930 9.427 246 HE2 TYR 33 HE1 TYR 33 20.265 21.103 5.538 247 HH TYR 33 HH TYR 33 18.398 22.240 6.263 Start of MODEL 12 1 H1 GLY 1 H1 GLY 1 11.667 15.601 27.316 2 H2 GLY 1 H2 GLY 1 11.834 17.187 26.894 3 H3 GLY 1 H3 GLY 1 10.340 16.482 26.953 4 HA2 GLY 1 HA2 GLY 1 10.443 16.206 29.295 5 HA3 GLY 1 HA3 GLY 1 12.093 16.851 29.286 6 H SER 2 H SER 2 12.034 18.768 30.276 7 HA SER 2 HA SER 2 9.889 20.484 30.679 8 HB2 SER 2 HB2 SER 2 12.850 21.150 30.502 9 HB3 SER 2 HB3 SER 2 11.615 22.180 31.244 10 HG SER 2 HG SER 2 12.513 19.609 32.069 11 H ALA 3 H ALA 3 9.114 22.412 29.794 12 HA ALA 3 HA ALA 3 9.110 22.499 26.961 13 HB1 ALA 3 HB1 ALA 3 7.578 24.420 27.291 14 HB2 ALA 3 HB2 ALA 3 7.166 23.030 28.308 15 HB3 ALA 3 HB3 ALA 3 7.994 24.433 29.017 16 H PHE 4 H PHE 4 11.241 24.334 29.129 17 HA PHE 4 HA PHE 4 12.063 26.300 27.250 18 HB2 PHE 4 HB2 PHE 4 13.967 26.628 28.512 19 HB3 PHE 4 HB3 PHE 4 12.777 26.118 29.684 20 HD1 PHE 4 HD1 PHE 4 15.847 25.175 27.823 21 HD2 PHE 4 HD2 PHE 4 13.088 23.995 30.915 22 HE1 PHE 4 HE1 PHE 4 17.422 23.396 28.546 23 HE2 PHE 4 HE2 PHE 4 14.688 22.240 31.660 24 HZ PHE 4 HZ PHE 4 16.845 21.933 30.464 25 H CYS 5 H CYS 5 12.625 22.835 27.232 26 HA CYS 5 HA CYS 5 14.274 23.063 24.768 27 HB2 CYS 5 HB2 CYS 5 15.088 21.493 26.406 28 HB3 CYS 5 HB3 CYS 5 13.514 20.717 26.521 29 H ASN 6 H ASN 6 13.165 23.308 22.960 30 HA ASN 6 HA ASN 6 11.174 21.234 22.304 31 HB2 ASN 6 HB2 ASN 6 9.884 23.346 22.851 32 HB3 ASN 6 HB3 ASN 6 10.727 24.167 21.540 33 HD21 ASN 6 HD22 ASN 6 7.899 23.789 21.830 34 HD22 ASN 6 HD21 ASN 6 7.410 22.981 20.340 35 H LEU 7 H LEU 7 12.186 20.135 20.679 36 HA LEU 7 HA LEU 7 14.490 21.035 19.327 37 HB2 LEU 7 HB2 LEU 7 13.781 18.691 19.432 38 HB3 LEU 7 HB3 LEU 7 12.413 19.013 18.365 39 HG LEU 7 HG LEU 7 15.168 19.781 17.405 40 HD11 LEU 7 HD11 LEU 7 15.559 17.483 16.570 41 HD12 LEU 7 HD12 LEU 7 15.455 17.471 18.341 42 HD13 LEU 7 HD13 LEU 7 14.078 16.939 17.370 43 HD21 LEU 7 HD21 LEU 7 14.300 18.983 15.219 44 HD22 LEU 7 HD22 LEU 7 12.777 18.517 15.992 45 HD23 LEU 7 HD23 LEU 7 13.243 20.222 15.880 46 H ARG 8 H ARG 8 11.087 21.462 18.410 47 HA ARG 8 HA ARG 8 11.503 22.424 15.796 48 HB2 ARG 8 HB2 ARG 8 9.382 21.636 17.132 49 HB3 ARG 8 HB3 ARG 8 9.280 23.320 17.704 50 HG2 ARG 8 HG2 ARG 8 9.033 24.110 15.418 51 HG3 ARG 8 HG3 ARG 8 9.372 22.486 14.774 52 HD2 ARG 8 HD2 ARG 8 7.371 21.632 15.945 53 HD3 ARG 8 HD3 ARG 8 7.013 23.268 16.540 54 HE ARG 8 HE ARG 8 7.059 23.885 14.009 55 HH11 ARG 8 HH11 ARG 8 5.569 20.889 15.176 56 HH12 ARG 8 HH12 ARG 8 4.907 20.581 13.565 57 HH21 ARG 8 HH21 ARG 8 6.290 23.275 12.066 58 HH22 ARG 8 HH22 ARG 8 5.149 21.919 11.974 59 H ARG 9 H ARG 9 12.125 24.022 18.706 60 HA ARG 9 HA ARG 9 12.200 26.759 17.480 61 HB2 ARG 9 HB2 ARG 9 10.867 26.289 19.552 62 HB3 ARG 9 HB3 ARG 9 12.364 25.853 20.383 63 HG2 ARG 9 HG2 ARG 9 13.222 28.143 20.116 64 HG3 ARG 9 HG3 ARG 9 11.852 28.555 19.070 65 HD2 ARG 9 HD2 ARG 9 11.388 29.373 21.333 66 HD3 ARG 9 HD3 ARG 9 10.275 28.062 20.910 67 HE ARG 9 HE ARG 9 12.755 27.505 22.517 68 HH11 ARG 9 HH11 ARG 9 9.219 27.127 22.334 69 HH12 ARG 9 HH12 ARG 9 9.174 26.545 23.981 70 HH21 ARG 9 HH21 ARG 9 12.565 26.367 24.379 71 HH22 ARG 9 HH22 ARG 9 10.975 25.883 24.950 72 H CYS 10 H CYS 10 14.181 24.331 19.215 73 HA CYS 10 HA CYS 10 16.652 25.813 19.127 74 HB2 CYS 10 HB2 CYS 10 15.910 22.883 19.297 75 HB3 CYS 10 HB3 CYS 10 17.592 23.450 19.413 76 H GLU 11 H GLU 11 15.127 23.501 16.848 77 HA GLU 11 HA GLU 11 16.994 23.267 14.802 78 HB2 GLU 11 HB2 GLU 11 14.931 22.086 15.073 79 HB3 GLU 11 HB3 GLU 11 13.978 23.545 14.687 80 HG2 GLU 11 HG2 GLU 11 15.948 22.469 12.669 81 HG3 GLU 11 HG3 GLU 11 14.530 21.492 13.005 82 H LEU 12 H LEU 12 15.474 26.168 15.775 83 HA LEU 12 HA LEU 12 15.783 27.347 13.096 84 HB2 LEU 12 HB2 LEU 12 13.464 26.895 13.838 85 HB3 LEU 12 HB3 LEU 12 13.723 27.928 15.249 86 HG LEU 12 HG LEU 12 13.980 29.890 13.855 87 HD11 LEU 12 HD11 LEU 12 15.095 29.038 11.857 88 HD12 LEU 12 HD12 LEU 12 13.720 27.971 11.486 89 HD13 LEU 12 HD13 LEU 12 13.557 29.732 11.370 90 HD21 LEU 12 HD21 LEU 12 11.612 28.220 12.884 91 HD22 LEU 12 HD22 LEU 12 11.677 29.126 14.409 92 HD23 LEU 12 HD23 LEU 12 11.741 29.993 12.874 93 H SER 13 H SER 13 15.847 28.165 16.647 94 HA SER 13 HA SER 13 17.163 30.672 16.469 95 HB2 SER 13 HB2 SER 13 17.603 28.504 18.565 96 HB3 SER 13 HB3 SER 13 17.966 30.227 18.733 97 HG SER 13 HG SER 13 16.080 29.801 19.721 98 H CYS 14 H CYS 14 18.511 27.378 16.428 99 HA CYS 14 HA CYS 14 21.281 28.034 16.494 100 HB2 CYS 14 HB2 CYS 14 19.654 25.707 15.476 101 HB3 CYS 14 HB3 CYS 14 21.404 25.705 15.501 102 H ARG 15 H ARG 15 19.067 28.321 13.777 103 HA ARG 15 HA ARG 15 21.101 27.631 11.781 104 HB2 ARG 15 HB2 ARG 15 18.406 28.851 11.861 105 HB3 ARG 15 HB3 ARG 15 19.213 28.622 10.272 106 HG2 ARG 15 HG2 ARG 15 19.498 26.171 10.847 107 HG3 ARG 15 HG3 ARG 15 18.501 26.411 12.266 108 HD2 ARG 15 HD2 ARG 15 16.644 27.240 10.737 109 HD3 ARG 15 HD3 ARG 15 17.680 26.966 9.339 110 HE ARG 15 HE ARG 15 16.367 24.941 11.064 111 HH11 ARG 15 HH21 ARG 15 18.494 25.323 8.234 112 HH12 ARG 15 HH22 ARG 15 18.443 23.578 7.987 113 HH21 ARG 15 HH11 ARG 15 16.099 22.953 10.300 114 HH22 ARG 15 HH12 ARG 15 17.140 22.310 9.027 115 H SER 16 H SER 16 19.975 30.639 13.156 116 HA SER 16 HA SER 16 21.240 32.642 11.608 117 HB2 SER 16 HB2 SER 16 20.713 32.158 14.561 118 HB3 SER 16 HB3 SER 16 21.568 33.621 14.025 119 HG SER 16 HG SER 16 18.964 32.771 13.236 120 H LEU 17 H LEU 17 22.711 30.025 13.248 121 HA LEU 17 HA LEU 17 25.329 31.293 13.682 122 HB2 LEU 17 HB2 LEU 17 24.501 28.494 14.427 123 HB3 LEU 17 HB3 LEU 17 25.662 29.548 15.217 124 HG LEU 17 HG LEU 17 22.599 29.854 15.347 125 HD11 LEU 17 HD11 LEU 17 24.690 29.019 17.408 126 HD12 LEU 17 HD12 LEU 17 22.943 29.172 17.683 127 HD13 LEU 17 HD13 LEU 17 23.561 27.920 16.594 128 HD21 LEU 17 HD21 LEU 17 23.744 32.054 15.516 129 HD22 LEU 17 HD22 LEU 17 23.082 31.535 17.072 130 HD23 LEU 17 HD23 LEU 17 24.821 31.383 16.754 131 H GLY 18 H GLY 18 23.858 29.646 11.160 132 HA2 GLY 18 HA2 GLY 18 24.734 28.625 9.271 133 HA3 GLY 18 HA3 GLY 18 26.352 28.698 9.939 134 H LEU 19 H LEU 19 23.570 27.194 11.594 135 HA LEU 19 HA LEU 19 24.802 24.469 11.351 136 HB2 LEU 19 HB2 LEU 19 23.640 25.743 13.865 137 HB3 LEU 19 HB3 LEU 19 24.432 24.191 13.762 138 HG LEU 19 HG LEU 19 25.803 26.885 13.448 139 HD11 LEU 19 HD11 LEU 19 26.844 26.318 15.600 140 HD12 LEU 19 HD12 LEU 19 25.087 26.421 15.744 141 HD13 LEU 19 HD13 LEU 19 25.891 24.828 15.680 142 HD21 LEU 19 HD21 LEU 19 26.985 24.072 13.629 143 HD22 LEU 19 HD22 LEU 19 26.946 25.051 12.154 144 HD23 LEU 19 HD23 LEU 19 27.900 25.592 13.539 145 H LEU 20 H LEU 20 23.285 22.869 12.475 146 HA LEU 20 HA LEU 20 20.388 23.401 11.966 147 HB2 LEU 20 HB2 LEU 20 20.973 21.301 10.976 148 HB3 LEU 20 HB3 LEU 20 21.945 20.827 12.370 149 HG LEU 20 HG LEU 20 19.872 20.613 13.725 150 HD11 LEU 20 HD11 LEU 20 18.411 22.189 12.287 151 HD12 LEU 20 HD12 LEU 20 18.434 20.942 11.044 152 HD13 LEU 20 HD13 LEU 20 17.683 20.610 12.616 153 HD21 LEU 20 HD21 LEU 20 20.824 18.648 12.583 154 HD22 LEU 20 HD22 LEU 20 19.072 18.578 12.859 155 HD23 LEU 20 HD23 LEU 20 19.675 18.945 11.249 156 H GLY 21 H GLY 21 19.068 22.642 13.837 157 HA2 GLY 21 HA2 GLY 21 20.416 22.700 16.478 158 HA3 GLY 21 HA3 GLY 21 18.924 23.592 16.288 159 H LYS 22 H LYS 22 19.621 21.237 17.978 160 HA LYS 22 HA LYS 22 17.216 19.667 17.377 161 HB2 LYS 22 HB2 LYS 22 19.963 18.407 17.661 162 HB3 LYS 22 HB3 LYS 22 18.461 17.533 17.994 163 HG2 LYS 22 HG2 LYS 22 17.665 18.164 15.672 164 HG3 LYS 22 HG3 LYS 22 19.303 18.755 15.340 165 HD2 LYS 22 HD2 LYS 22 18.640 15.888 16.166 166 HD3 LYS 22 HD3 LYS 22 18.797 16.443 14.502 167 HE2 LYS 22 HE2 LYS 22 21.125 17.218 15.003 168 HE3 LYS 22 HE3 LYS 22 20.983 16.505 16.626 169 HZ1 LYS 22 HZ1 LYS 22 20.811 15.015 14.049 170 HZ2 LYS 22 HZ2 LYS 22 22.078 15.026 15.048 171 HZ3 LYS 22 HZ3 LYS 22 20.688 14.333 15.555 172 H CYS 23 H CYS 23 16.283 18.773 19.304 173 HA CYS 23 HA CYS 23 17.607 19.224 21.850 174 HB2 CYS 23 HB2 CYS 23 16.677 21.426 21.259 175 HB3 CYS 23 HB3 CYS 23 15.062 20.781 21.356 176 H ILE 24 H ILE 24 17.448 17.018 21.421 177 HA ILE 24 HA ILE 24 14.954 15.616 22.134 178 HB ILE 24 HB ILE 24 17.783 14.532 21.891 179 HG12 ILE 24 HG12 ILE 24 15.685 14.624 19.660 180 HG13 ILE 24 HG13 ILE 24 17.090 15.685 19.737 181 HG21 ILE 24 HG21 ILE 24 15.047 13.182 21.629 182 HG22 ILE 24 HG22 ILE 24 16.618 12.363 21.507 183 HG23 ILE 24 HG23 ILE 24 16.120 13.056 23.039 184 HD11 ILE 24 HD11 ILE 24 17.575 13.946 18.194 185 HD12 ILE 24 HD12 ILE 24 18.613 13.761 19.618 186 HD13 ILE 24 HD13 ILE 24 17.213 12.689 19.383 187 H GLY 25 H GLY 25 14.530 14.734 24.172 188 HA2 GLY 25 HA2 GLY 25 14.703 14.459 26.470 189 HA3 GLY 25 HA3 GLY 25 16.420 14.839 26.382 190 H GLU 26 H GLU 26 17.074 16.744 27.139 191 HA GLU 26 HA GLU 26 15.175 19.029 27.422 192 HB2 GLU 26 HB2 GLU 26 16.909 17.987 29.691 193 HB3 GLU 26 HB3 GLU 26 15.921 19.449 29.716 194 HG2 GLU 26 HG2 GLU 26 13.915 17.938 29.198 195 HG3 GLU 26 HG3 GLU 26 14.957 16.577 29.642 196 H GLU 27 H GLU 27 18.064 18.231 26.015 197 HA GLU 27 HA GLU 27 19.332 20.849 26.773 198 HB2 GLU 27 HB2 GLU 27 20.617 18.834 27.422 199 HB3 GLU 27 HB3 GLU 27 20.730 18.378 25.716 200 HG2 GLU 27 HG2 GLU 27 21.918 20.518 25.236 201 HG3 GLU 27 HG3 GLU 27 21.747 20.992 26.927 202 H CYS 28 H CYS 28 19.359 22.397 25.341 203 HA CYS 28 HA CYS 28 18.543 21.963 22.558 204 HB2 CYS 28 HB2 CYS 28 17.710 23.787 24.079 205 HB3 CYS 28 HB3 CYS 28 19.309 24.504 24.014 206 H LYS 29 H LYS 29 20.024 21.022 21.371 207 HA LYS 29 HA LYS 29 22.864 21.811 21.343 208 HB2 LYS 29 HB2 LYS 29 22.096 19.406 21.383 209 HB3 LYS 29 HB3 LYS 29 21.335 19.636 19.817 210 HG2 LYS 29 HG2 LYS 29 23.553 20.211 18.827 211 HG3 LYS 29 HG3 LYS 29 24.316 19.966 20.395 212 HD2 LYS 29 HD2 LYS 29 22.844 17.869 18.752 213 HD3 LYS 29 HD3 LYS 29 24.592 18.055 18.832 214 HE2 LYS 29 HE2 LYS 29 22.765 17.251 21.140 215 HE3 LYS 29 HE3 LYS 29 23.825 16.184 20.210 216 HZ1 LYS 29 HZ1 LYS 29 24.673 18.367 22.019 217 HZ2 LYS 29 HZ2 LYS 29 24.920 16.770 22.232 218 HZ3 LYS 29 HZ3 LYS 29 25.722 17.555 21.035 219 H CYS 30 H CYS 30 23.865 22.811 19.610 220 HA CYS 30 HA CYS 30 22.354 22.892 17.058 221 HB2 CYS 30 HB2 CYS 30 24.417 25.007 17.482 222 HB3 CYS 30 HB3 CYS 30 23.108 24.915 16.276 223 H VAL 31 H VAL 31 23.485 22.314 15.296 224 HA VAL 31 HA VAL 31 25.970 20.806 15.913 225 HB VAL 31 HB VAL 31 23.942 19.534 16.455 226 HG11 VAL 31 HG11 VAL 31 22.538 18.583 14.745 227 HG12 VAL 31 HG12 VAL 31 22.414 20.341 14.674 228 HG13 VAL 31 HG13 VAL 31 23.382 19.450 13.461 229 HG21 VAL 31 HG21 VAL 31 26.053 18.440 15.870 230 HG22 VAL 31 HG22 VAL 31 24.657 17.479 15.387 231 HG23 VAL 31 HG23 VAL 31 25.571 18.368 14.155 232 HA PRO 32 HA PRO 32 27.059 22.194 11.820 233 HB2 PRO 32 HB2 PRO 32 29.079 19.949 11.881 234 HB3 PRO 32 HB3 PRO 32 29.295 21.681 11.480 235 HG2 PRO 32 HG2 PRO 32 30.064 20.734 13.887 236 HG3 PRO 32 HG3 PRO 32 29.199 22.302 13.780 237 HD2 PRO 32 HD2 PRO 32 28.035 19.569 14.400 238 HD3 PRO 32 HD3 PRO 32 27.858 21.104 15.301 239 H TYR 33 H TYR 33 25.063 21.568 10.901 240 HA TYR 33 HA TYR 33 24.371 19.078 9.925 241 HB2 TYR 33 HB2 TYR 33 23.064 21.313 10.086 242 HB3 TYR 33 HB3 TYR 33 23.655 21.642 8.474 243 HD1 TYR 33 HD2 TYR 33 21.992 18.979 10.491 244 HD2 TYR 33 HD1 TYR 33 22.302 20.912 6.673 245 HE1 TYR 33 HE2 TYR 33 20.241 17.419 9.559 246 HE2 TYR 33 HE1 TYR 33 20.495 19.448 5.757 247 HH TYR 33 HH TYR 33 18.941 17.839 6.253 Start of MODEL 13 1 H1 GLY 1 H1 GLY 1 18.237 19.946 34.319 2 H2 GLY 1 H2 GLY 1 17.001 19.456 33.336 3 H3 GLY 1 H3 GLY 1 16.965 19.119 34.957 4 HA2 GLY 1 HA2 GLY 1 16.775 21.432 35.486 5 HA3 GLY 1 HA3 GLY 1 16.843 21.808 33.760 6 H SER 2 H SER 2 14.975 21.674 32.538 7 HA SER 2 HA SER 2 12.433 21.280 33.973 8 HB2 SER 2 HB2 SER 2 11.444 22.279 31.998 9 HB3 SER 2 HB3 SER 2 12.860 23.239 32.484 10 HG SER 2 HG SER 2 12.815 22.779 30.223 11 H ALA 3 H ALA 3 14.417 19.316 31.962 12 HA ALA 3 HA ALA 3 14.174 17.547 30.651 13 HB1 ALA 3 HB1 ALA 3 11.666 16.907 32.236 14 HB2 ALA 3 HB2 ALA 3 12.611 15.777 31.250 15 HB3 ALA 3 HB3 ALA 3 13.320 16.468 32.702 16 H PHE 4 H PHE 4 12.817 20.129 29.849 17 HA PHE 4 HA PHE 4 11.119 19.025 27.657 18 HB2 PHE 4 HB2 PHE 4 9.685 20.006 29.370 19 HB3 PHE 4 HB3 PHE 4 10.617 21.500 29.347 20 HD1 PHE 4 HD2 PHE 4 10.489 23.050 27.400 21 HD2 PHE 4 HD1 PHE 4 8.060 19.495 27.602 22 HE1 PHE 4 HE2 PHE 4 9.096 23.899 25.537 23 HE2 PHE 4 HE1 PHE 4 6.656 20.359 25.742 24 HZ PHE 4 HZ PHE 4 7.173 22.559 24.705 25 H CYS 5 H CYS 5 11.224 19.969 25.727 26 HA CYS 5 HA CYS 5 12.317 22.575 25.242 27 HB2 CYS 5 HB2 CYS 5 14.414 21.161 25.288 28 HB3 CYS 5 HB3 CYS 5 13.731 20.150 24.022 29 H ASN 6 H ASN 6 11.688 23.230 22.938 30 HA ASN 6 HA ASN 6 10.026 21.147 21.546 31 HB2 ASN 6 HB2 ASN 6 8.740 23.236 21.994 32 HB3 ASN 6 HB3 ASN 6 9.941 24.140 21.053 33 HD21 ASN 6 HD22 ASN 6 7.485 21.557 20.879 34 HD22 ASN 6 HD21 ASN 6 7.358 21.601 19.121 35 H LEU 7 H LEU 7 11.274 20.041 20.118 36 HA LEU 7 HA LEU 7 13.864 20.918 19.557 37 HB2 LEU 7 HB2 LEU 7 13.148 18.575 19.415 38 HB3 LEU 7 HB3 LEU 7 12.355 18.893 17.879 39 HG LEU 7 HG LEU 7 15.276 19.664 18.198 40 HD11 LEU 7 HD11 LEU 7 15.951 17.376 17.567 41 HD12 LEU 7 HD12 LEU 7 15.097 17.362 19.102 42 HD13 LEU 7 HD13 LEU 7 14.269 16.850 17.634 43 HD21 LEU 7 HD21 LEU 7 13.727 18.472 15.856 44 HD22 LEU 7 HD22 LEU 7 14.179 20.169 16.007 45 HD23 LEU 7 HD23 LEU 7 15.423 18.961 15.832 46 H ARG 8 H ARG 8 11.032 21.277 17.361 47 HA ARG 8 HA ARG 8 12.455 22.492 15.238 48 HB2 ARG 8 HB2 ARG 8 10.076 21.695 15.207 49 HB3 ARG 8 HB3 ARG 8 9.589 23.107 16.147 50 HG2 ARG 8 HG2 ARG 8 11.111 23.470 13.568 51 HG3 ARG 8 HG3 ARG 8 9.412 23.008 13.484 52 HD2 ARG 8 HD2 ARG 8 8.687 25.004 14.594 53 HD3 ARG 8 HD3 ARG 8 10.338 25.473 15.013 54 HE ARG 8 HE ARG 8 10.284 25.163 12.213 55 HH11 ARG 8 HH11 ARG 8 8.803 27.453 14.512 56 HH12 ARG 8 HH12 ARG 8 8.905 28.739 13.362 57 HH21 ARG 8 HH21 ARG 8 10.046 26.778 10.772 58 HH22 ARG 8 HH22 ARG 8 9.447 28.350 11.284 59 H ARG 9 H ARG 9 11.208 24.002 18.178 60 HA ARG 9 HA ARG 9 11.773 26.708 17.374 61 HB2 ARG 9 HB2 ARG 9 10.225 25.650 19.251 62 HB3 ARG 9 HB3 ARG 9 11.652 25.839 20.273 63 HG2 ARG 9 HG2 ARG 9 11.650 28.261 19.863 64 HG3 ARG 9 HG3 ARG 9 10.453 28.077 18.579 65 HD2 ARG 9 HD2 ARG 9 9.271 28.834 20.504 66 HD3 ARG 9 HD3 ARG 9 8.821 27.149 20.229 67 HE ARG 9 HE ARG 9 10.880 27.985 22.254 68 HH11 ARG 9 HH11 ARG 9 7.785 26.303 21.770 69 HH12 ARG 9 HH12 ARG 9 7.646 26.080 23.509 70 HH21 ARG 9 HH21 ARG 9 10.623 27.398 24.383 71 HH22 ARG 9 HH22 ARG 9 9.122 26.633 24.858 72 H CYS 10 H CYS 10 13.674 24.283 19.137 73 HA CYS 10 HA CYS 10 15.962 26.101 19.440 74 HB2 CYS 10 HB2 CYS 10 15.282 23.339 20.200 75 HB3 CYS 10 HB3 CYS 10 16.980 23.610 19.775 76 H GLU 11 H GLU 11 14.913 23.702 17.000 77 HA GLU 11 HA GLU 11 17.188 23.375 15.528 78 HB2 GLU 11 HB2 GLU 11 14.821 22.498 15.125 79 HB3 GLU 11 HB3 GLU 11 14.620 23.897 14.065 80 HG2 GLU 11 HG2 GLU 11 17.056 22.126 13.757 81 HG3 GLU 11 HG3 GLU 11 15.502 21.503 13.242 82 H LEU 12 H LEU 12 14.788 25.883 15.140 83 HA LEU 12 HA LEU 12 16.120 27.627 13.388 84 HB2 LEU 12 HB2 LEU 12 13.710 27.290 13.692 85 HB3 LEU 12 HB3 LEU 12 13.800 27.889 15.343 86 HG LEU 12 HG LEU 12 14.234 30.132 14.626 87 HD11 LEU 12 HD11 LEU 12 14.240 30.771 12.223 88 HD12 LEU 12 HD12 LEU 12 15.656 29.824 12.658 89 HD13 LEU 12 HD13 LEU 12 14.309 29.055 11.777 90 HD21 LEU 12 HD21 LEU 12 11.881 29.270 14.580 91 HD22 LEU 12 HD22 LEU 12 12.155 30.598 13.443 92 HD23 LEU 12 HD23 LEU 12 12.065 28.927 12.849 93 H SER 13 H SER 13 15.956 27.618 16.990 94 HA SER 13 HA SER 13 17.262 30.154 17.397 95 HB2 SER 13 HB2 SER 13 17.433 27.668 19.148 96 HB3 SER 13 HB3 SER 13 17.834 29.322 19.623 97 HG SER 13 HG SER 13 15.250 28.391 18.810 98 H CYS 14 H CYS 14 18.541 26.897 16.848 99 HA CYS 14 HA CYS 14 21.362 27.495 17.106 100 HB2 CYS 14 HB2 CYS 14 19.598 25.291 16.068 101 HB3 CYS 14 HB3 CYS 14 21.332 25.210 15.885 102 H ARG 15 H ARG 15 19.251 28.322 14.526 103 HA ARG 15 HA ARG 15 21.261 27.919 12.399 104 HB2 ARG 15 HB2 ARG 15 18.642 29.243 12.749 105 HB3 ARG 15 HB3 ARG 15 19.470 29.323 11.162 106 HG2 ARG 15 HG2 ARG 15 19.523 26.821 11.088 107 HG3 ARG 15 HG3 ARG 15 18.621 26.764 12.595 108 HD2 ARG 15 HD2 ARG 15 16.970 28.440 11.363 109 HD3 ARG 15 HD3 ARG 15 17.804 27.947 9.887 110 HE ARG 15 HE ARG 15 16.844 25.607 11.265 111 HH11 ARG 15 HH21 ARG 15 15.618 28.449 9.526 112 HH12 ARG 15 HH22 ARG 15 14.154 27.584 9.075 113 HH21 ARG 15 HH11 ARG 15 14.915 24.634 10.573 114 HH22 ARG 15 HH12 ARG 15 13.735 25.619 9.716 115 H SER 16 H SER 16 20.401 30.494 14.537 116 HA SER 16 HA SER 16 21.444 32.846 13.497 117 HB2 SER 16 HB2 SER 16 21.601 31.586 16.271 118 HB3 SER 16 HB3 SER 16 21.856 33.308 15.936 119 HG SER 16 HG SER 16 19.790 33.049 16.560 120 H LEU 17 H LEU 17 23.183 30.202 13.394 121 HA LEU 17 HA LEU 17 25.846 31.041 14.400 122 HB2 LEU 17 HB2 LEU 17 24.627 28.283 14.664 123 HB3 LEU 17 HB3 LEU 17 25.928 28.987 15.606 124 HG LEU 17 HG LEU 17 22.921 29.586 15.893 125 HD11 LEU 17 HD11 LEU 17 23.703 27.335 16.688 126 HD12 LEU 17 HD12 LEU 17 24.935 28.123 17.677 127 HD13 LEU 17 HD13 LEU 17 23.224 28.389 18.035 128 HD21 LEU 17 HD21 LEU 17 24.403 31.548 16.590 129 HD22 LEU 17 HD22 LEU 17 23.560 30.788 17.942 130 HD23 LEU 17 HD23 LEU 17 25.278 30.455 17.651 131 H GLY 18 H GLY 18 24.021 29.904 11.756 132 HA2 GLY 18 HA2 GLY 18 24.582 28.935 9.739 133 HA3 GLY 18 HA3 GLY 18 26.230 28.650 10.299 134 H LEU 19 H LEU 19 23.781 27.402 12.445 135 HA LEU 19 HA LEU 19 24.506 24.631 11.591 136 HB2 LEU 19 HB2 LEU 19 23.858 25.588 14.393 137 HB3 LEU 19 HB3 LEU 19 24.507 24.042 13.928 138 HG LEU 19 HG LEU 19 25.918 26.706 13.835 139 HD11 LEU 19 HD11 LEU 19 25.734 25.821 16.061 140 HD12 LEU 19 HD12 LEU 19 26.329 24.220 15.533 141 HD13 LEU 19 HD13 LEU 19 27.400 25.630 15.511 142 HD21 LEU 19 HD21 LEU 19 26.746 25.286 11.946 143 HD22 LEU 19 HD22 LEU 19 27.961 25.421 13.210 144 HD23 LEU 19 HD23 LEU 19 26.988 23.943 13.080 145 H LEU 20 H LEU 20 23.050 23.033 12.916 146 HA LEU 20 HA LEU 20 20.129 23.623 12.602 147 HB2 LEU 20 HB2 LEU 20 20.673 21.951 11.016 148 HB3 LEU 20 HB3 LEU 20 21.792 21.128 12.104 149 HG LEU 20 HG LEU 20 18.922 21.228 12.961 150 HD11 LEU 20 HD11 LEU 20 19.919 19.424 10.734 151 HD12 LEU 20 HD12 LEU 20 18.352 19.297 11.568 152 HD13 LEU 20 HD13 LEU 20 18.713 20.720 10.585 153 HD21 LEU 20 HD21 LEU 20 19.372 18.948 13.714 154 HD22 LEU 20 HD22 LEU 20 20.965 18.955 12.921 155 HD23 LEU 20 HD23 LEU 20 20.658 19.985 14.327 156 H GLY 21 H GLY 21 18.902 23.239 14.384 157 HA2 GLY 21 HA2 GLY 21 20.298 22.459 16.889 158 HA3 GLY 21 HA3 GLY 21 18.722 23.174 16.831 159 H LYS 22 H LYS 22 20.040 20.594 17.923 160 HA LYS 22 HA LYS 22 17.814 18.749 17.156 161 HB2 LYS 22 HB2 LYS 22 20.062 18.107 16.129 162 HB3 LYS 22 HB3 LYS 22 20.655 17.855 17.765 163 HG2 LYS 22 HG2 LYS 22 20.015 15.700 17.040 164 HG3 LYS 22 HG3 LYS 22 18.701 16.201 18.074 165 HD2 LYS 22 HD2 LYS 22 17.544 15.311 16.268 166 HD3 LYS 22 HD3 LYS 22 17.520 17.022 15.880 167 HE2 LYS 22 HE2 LYS 22 18.044 15.828 13.886 168 HE3 LYS 22 HE3 LYS 22 19.514 16.683 14.383 169 HZ1 LYS 22 HZ1 LYS 22 20.432 14.641 15.166 170 HZ2 LYS 22 HZ2 LYS 22 18.986 13.840 15.065 171 HZ3 LYS 22 HZ3 LYS 22 19.784 14.314 13.703 172 H CYS 23 H CYS 23 17.054 20.175 18.991 173 HA CYS 23 HA CYS 23 18.016 19.642 21.659 174 HB2 CYS 23 HB2 CYS 23 16.969 21.747 20.794 175 HB3 CYS 23 HB3 CYS 23 15.407 20.931 20.880 176 H ILE 24 H ILE 24 17.908 17.416 21.878 177 HA ILE 24 HA ILE 24 15.209 16.160 22.164 178 HB ILE 24 HB ILE 24 17.956 14.876 21.995 179 HG12 ILE 24 HG12 ILE 24 15.630 14.988 20.006 180 HG13 ILE 24 HG13 ILE 24 17.133 15.903 19.864 181 HG21 ILE 24 HG21 ILE 24 15.174 13.610 22.110 182 HG22 ILE 24 HG22 ILE 24 16.714 12.735 21.906 183 HG23 ILE 24 HG23 ILE 24 16.383 13.557 23.415 184 HD11 ILE 24 HD11 ILE 24 18.419 13.800 19.695 185 HD12 ILE 24 HD12 ILE 24 16.880 12.895 19.694 186 HD13 ILE 24 HD13 ILE 24 17.237 14.031 18.389 187 H GLY 25 H GLY 25 14.411 15.643 24.125 188 HA2 GLY 25 HA2 GLY 25 14.202 15.690 26.435 189 HA3 GLY 25 HA3 GLY 25 15.963 15.660 26.603 190 H GLU 26 H GLU 26 17.111 17.609 26.700 191 HA GLU 26 HA GLU 26 15.514 20.138 26.977 192 HB2 GLU 26 HB2 GLU 26 15.947 18.751 29.080 193 HB3 GLU 26 HB3 GLU 26 17.659 19.132 28.881 194 HG2 GLU 26 HG2 GLU 26 17.091 21.567 29.079 195 HG3 GLU 26 HG3 GLU 26 15.393 21.127 29.303 196 H GLU 27 H GLU 27 18.465 18.739 25.678 197 HA GLU 27 HA GLU 27 20.002 20.820 26.745 198 HB2 GLU 27 HB2 GLU 27 21.814 19.567 26.417 199 HB3 GLU 27 HB3 GLU 27 20.620 18.308 26.239 200 HG2 GLU 27 HG2 GLU 27 22.116 19.722 23.984 201 HG3 GLU 27 HG3 GLU 27 22.472 18.142 24.648 202 H CYS 28 H CYS 28 18.509 21.023 23.793 203 HA CYS 28 HA CYS 28 18.738 22.271 21.922 204 HB2 CYS 28 HB2 CYS 28 18.222 23.886 23.870 205 HB3 CYS 28 HB3 CYS 28 19.864 24.455 23.639 206 H LYS 29 H LYS 29 20.703 20.466 21.923 207 HA LYS 29 HA LYS 29 23.329 21.413 21.324 208 HB2 LYS 29 HB2 LYS 29 22.648 18.972 21.492 209 HB3 LYS 29 HB3 LYS 29 21.813 19.152 19.926 210 HG2 LYS 29 HG2 LYS 29 23.900 19.716 18.833 211 HG3 LYS 29 HG3 LYS 29 24.778 19.682 20.348 212 HD2 LYS 29 HD2 LYS 29 25.099 17.692 18.875 213 HD3 LYS 29 HD3 LYS 29 24.603 17.334 20.537 214 HE2 LYS 29 HE2 LYS 29 22.286 16.943 19.790 215 HE3 LYS 29 HE3 LYS 29 22.735 17.340 18.118 216 HZ1 LYS 29 HZ1 LYS 29 22.694 14.899 18.593 217 HZ2 LYS 29 HZ2 LYS 29 24.140 15.408 18.067 218 HZ3 LYS 29 HZ3 LYS 29 23.916 15.105 19.669 219 H CYS 30 H CYS 30 24.196 22.381 19.517 220 HA CYS 30 HA CYS 30 22.513 22.500 17.085 221 HB2 CYS 30 HB2 CYS 30 24.566 24.633 17.550 222 HB3 CYS 30 HB3 CYS 30 23.181 24.621 16.418 223 H VAL 31 H VAL 31 23.500 21.996 15.286 224 HA VAL 31 HA VAL 31 26.090 20.553 15.473 225 HB VAL 31 HB VAL 31 23.602 19.580 14.015 226 HG11 VAL 31 HG11 VAL 31 25.999 18.218 15.322 227 HG12 VAL 31 HG12 VAL 31 24.721 17.401 14.400 228 HG13 VAL 31 HG13 VAL 31 25.817 18.512 13.579 229 HG21 VAL 31 HG21 VAL 31 23.039 18.141 15.907 230 HG22 VAL 31 HG22 VAL 31 24.302 18.910 16.883 231 HG23 VAL 31 HG23 VAL 31 22.849 19.825 16.375 232 HA PRO 32 HA PRO 32 26.602 22.296 11.263 233 HB2 PRO 32 HB2 PRO 32 28.873 20.346 11.117 234 HB3 PRO 32 HB3 PRO 32 28.846 22.087 10.755 235 HG2 PRO 32 HG2 PRO 32 29.996 21.148 13.027 236 HG3 PRO 32 HG3 PRO 32 29.065 22.670 13.046 237 HD2 PRO 32 HD2 PRO 32 28.142 19.883 13.850 238 HD3 PRO 32 HD3 PRO 32 27.946 21.439 14.721 239 H TYR 33 H TYR 33 24.765 21.470 10.408 240 HA TYR 33 HA TYR 33 24.196 18.673 10.009 241 HB2 TYR 33 HB2 TYR 33 22.363 19.439 8.570 242 HB3 TYR 33 HB3 TYR 33 22.386 20.185 10.150 243 HD1 TYR 33 HD1 TYR 33 22.874 20.731 6.530 244 HD2 TYR 33 HD2 TYR 33 22.872 22.545 10.428 245 HE1 TYR 33 HE1 TYR 33 22.761 22.982 5.466 246 HE2 TYR 33 HE2 TYR 33 22.716 24.825 9.361 247 HH TYR 33 HH TYR 33 22.495 25.974 7.410 Start of MODEL 14 1 H1 GLY 1 H1 GLY 1 14.437 18.095 34.384 2 H2 GLY 1 H2 GLY 1 13.277 18.585 33.300 3 H3 GLY 1 H3 GLY 1 13.622 19.506 34.602 4 HA2 GLY 1 HA2 GLY 1 15.894 19.842 33.792 5 HA3 GLY 1 HA3 GLY 1 15.397 18.991 32.318 6 H SER 2 H SER 2 16.314 21.531 31.912 7 HA SER 2 HA SER 2 14.762 23.730 32.380 8 HB2 SER 2 HB2 SER 2 16.323 23.090 29.861 9 HB3 SER 2 HB3 SER 2 15.661 24.712 30.259 10 HG SER 2 HG SER 2 17.766 24.605 30.959 11 H ALA 3 H ALA 3 13.046 24.856 31.583 12 HA ALA 3 HA ALA 3 10.926 23.132 30.774 13 HB1 ALA 3 HB1 ALA 3 10.947 26.147 31.167 14 HB2 ALA 3 HB2 ALA 3 9.518 25.086 31.177 15 HB3 ALA 3 HB3 ALA 3 10.747 24.938 32.449 16 H PHE 4 H PHE 4 9.450 23.259 29.097 17 HA PHE 4 HA PHE 4 8.889 23.146 26.907 18 HB2 PHE 4 HB2 PHE 4 9.309 26.123 27.262 19 HB3 PHE 4 HB3 PHE 4 8.353 25.385 25.998 20 HD1 PHE 4 HD2 PHE 4 6.396 23.828 26.662 21 HD2 PHE 4 HD1 PHE 4 8.218 26.691 29.325 22 HE1 PHE 4 HE2 PHE 4 4.369 23.784 28.094 23 HE2 PHE 4 HE1 PHE 4 6.175 26.668 30.738 24 HZ PHE 4 HZ PHE 4 4.255 25.209 30.135 25 H CYS 5 H CYS 5 11.742 22.562 27.002 26 HA CYS 5 HA CYS 5 12.979 23.905 24.749 27 HB2 CYS 5 HB2 CYS 5 14.205 22.851 26.644 28 HB3 CYS 5 HB3 CYS 5 13.776 21.272 26.015 29 H ASN 6 H ASN 6 11.980 23.777 22.853 30 HA ASN 6 HA ASN 6 10.876 21.200 21.830 31 HB2 ASN 6 HB2 ASN 6 9.467 23.254 21.820 32 HB3 ASN 6 HB3 ASN 6 10.659 24.070 20.810 33 HD21 ASN 6 HD22 ASN 6 8.343 24.195 19.636 34 HD22 ASN 6 HD21 ASN 6 8.083 22.863 18.508 35 H LEU 7 H LEU 7 11.998 20.059 20.197 36 HA LEU 7 HA LEU 7 14.619 20.948 19.369 37 HB2 LEU 7 HB2 LEU 7 14.042 18.595 19.287 38 HB3 LEU 7 HB3 LEU 7 12.804 18.886 18.071 39 HG LEU 7 HG LEU 7 15.584 19.900 17.375 40 HD11 LEU 7 HD11 LEU 7 16.270 17.618 16.661 41 HD12 LEU 7 HD12 LEU 7 16.046 17.653 18.422 42 HD13 LEU 7 HD13 LEU 7 14.805 16.938 17.385 43 HD21 LEU 7 HD21 LEU 7 14.995 19.044 15.174 44 HD22 LEU 7 HD22 LEU 7 13.546 18.256 15.811 45 HD23 LEU 7 HD23 LEU 7 13.658 20.026 15.754 46 H ARG 8 H ARG 8 11.371 21.402 17.912 47 HA ARG 8 HA ARG 8 12.303 22.451 15.421 48 HB2 ARG 8 HB2 ARG 8 9.924 21.716 16.357 49 HB3 ARG 8 HB3 ARG 8 9.753 23.418 16.771 50 HG2 ARG 8 HG2 ARG 8 10.400 22.305 14.020 51 HG3 ARG 8 HG3 ARG 8 8.773 22.712 14.591 52 HD2 ARG 8 HD2 ARG 8 9.101 24.726 13.637 53 HD3 ARG 8 HD3 ARG 8 10.074 25.092 15.052 54 HE ARG 8 HE ARG 8 12.035 24.890 13.774 55 HH11 ARG 8 HH11 ARG 8 9.346 23.625 11.825 56 HH12 ARG 8 HH12 ARG 8 10.391 23.475 10.428 57 HH21 ARG 8 HH21 ARG 8 13.250 24.504 11.827 58 HH22 ARG 8 HH22 ARG 8 12.328 24.057 10.416 59 H ARG 9 H ARG 9 11.743 24.097 18.506 60 HA ARG 9 HA ARG 9 12.436 26.733 17.376 61 HB2 ARG 9 HB2 ARG 9 10.578 26.234 19.069 62 HB3 ARG 9 HB3 ARG 9 11.861 26.112 20.287 63 HG2 ARG 9 HG2 ARG 9 12.518 28.438 19.861 64 HG3 ARG 9 HG3 ARG 9 11.459 28.519 18.455 65 HD2 ARG 9 HD2 ARG 9 10.379 29.678 20.239 66 HD3 ARG 9 HD3 ARG 9 9.465 28.213 19.928 67 HE ARG 9 HE ARG 9 11.187 28.832 22.281 68 HH11 ARG 9 HH11 ARG 9 8.811 26.568 20.931 69 HH12 ARG 9 HH12 ARG 9 8.646 25.767 22.474 70 HH21 ARG 9 HH21 ARG 9 10.970 27.681 24.096 71 HH22 ARG 9 HH22 ARG 9 10.043 26.193 24.112 72 H CYS 10 H CYS 10 14.047 24.234 19.294 73 HA CYS 10 HA CYS 10 16.477 25.753 19.788 74 HB2 CYS 10 HB2 CYS 10 16.011 23.723 21.019 75 HB3 CYS 10 HB3 CYS 10 15.817 22.809 19.526 76 H GLU 11 H GLU 11 15.286 23.654 17.070 77 HA GLU 11 HA GLU 11 17.562 23.648 15.518 78 HB2 GLU 11 HB2 GLU 11 15.558 22.280 15.177 79 HB3 GLU 11 HB3 GLU 11 14.748 23.665 14.444 80 HG2 GLU 11 HG2 GLU 11 17.301 23.285 13.179 81 HG3 GLU 11 HG3 GLU 11 16.612 21.700 13.381 82 H LEU 12 H LEU 12 14.851 25.950 15.349 83 HA LEU 12 HA LEU 12 16.146 27.633 13.472 84 HB2 LEU 12 HB2 LEU 12 13.792 27.827 15.318 85 HB3 LEU 12 HB3 LEU 12 14.268 29.272 14.402 86 HG LEU 12 HG LEU 12 13.743 26.579 13.067 87 HD11 LEU 12 HD11 LEU 12 11.534 27.470 12.460 88 HD12 LEU 12 HD12 LEU 12 11.700 27.366 14.223 89 HD13 LEU 12 HD13 LEU 12 11.844 28.935 13.413 90 HD21 LEU 12 HD21 LEU 12 13.788 29.430 11.961 91 HD22 LEU 12 HD22 LEU 12 15.061 28.226 11.709 92 HD23 LEU 12 HD23 LEU 12 13.450 27.953 11.038 93 H SER 13 H SER 13 16.112 27.824 17.053 94 HA SER 13 HA SER 13 17.418 30.384 17.228 95 HB2 SER 13 HB2 SER 13 17.523 28.078 19.209 96 HB3 SER 13 HB3 SER 13 17.925 29.776 19.532 97 HG SER 13 HG SER 13 15.435 28.561 19.021 98 H CYS 14 H CYS 14 18.680 27.107 16.859 99 HA CYS 14 HA CYS 14 21.524 27.807 16.870 100 HB2 CYS 14 HB2 CYS 14 19.821 25.424 16.128 101 HB3 CYS 14 HB3 CYS 14 21.549 25.455 15.907 102 H ARG 15 H ARG 15 19.002 27.720 14.340 103 HA ARG 15 HA ARG 15 20.969 27.630 12.202 104 HB2 ARG 15 HB2 ARG 15 18.105 28.195 12.553 105 HB3 ARG 15 HB3 ARG 15 18.792 28.431 10.930 106 HG2 ARG 15 HG2 ARG 15 19.464 26.147 10.722 107 HG3 ARG 15 HG3 ARG 15 19.114 25.777 12.403 108 HD2 ARG 15 HD2 ARG 15 17.383 24.911 10.832 109 HD3 ARG 15 HD3 ARG 15 16.713 26.040 12.014 110 HE ARG 15 HE ARG 15 17.277 27.675 9.859 111 HH11 ARG 15 HH12 ARG 15 15.169 24.889 10.224 112 HH12 ARG 15 HH11 ARG 15 14.310 25.342 8.728 113 HH21 ARG 15 HH21 ARG 15 16.035 28.236 8.283 114 HH22 ARG 15 HH22 ARG 15 14.691 27.247 7.744 115 H SER 16 H SER 16 19.902 30.193 14.178 116 HA SER 16 HA SER 16 20.552 32.546 12.774 117 HB2 SER 16 HB2 SER 16 21.505 31.740 15.558 118 HB3 SER 16 HB3 SER 16 21.232 33.383 14.966 119 HG SER 16 HG SER 16 19.552 31.908 16.247 120 H LEU 17 H LEU 17 22.532 29.809 13.100 121 HA LEU 17 HA LEU 17 25.115 31.224 13.172 122 HB2 LEU 17 HB2 LEU 17 24.461 28.401 14.024 123 HB3 LEU 17 HB3 LEU 17 25.802 29.408 14.555 124 HG LEU 17 HG LEU 17 22.847 29.797 15.371 125 HD11 LEU 17 HD11 LEU 17 25.222 28.748 16.950 126 HD12 LEU 17 HD12 LEU 17 23.573 28.985 17.555 127 HD13 LEU 17 HD13 LEU 17 23.900 27.748 16.328 128 HD21 LEU 17 HD21 LEU 17 25.367 31.107 16.426 129 HD22 LEU 17 HD22 LEU 17 24.178 31.914 15.400 130 HD23 LEU 17 HD23 LEU 17 23.713 31.357 17.015 131 H GLY 18 H GLY 18 23.129 29.788 10.960 132 HA2 GLY 18 HA2 GLY 18 23.471 28.925 8.853 133 HA3 GLY 18 HA3 GLY 18 25.219 29.025 9.092 134 H LEU 19 H LEU 19 23.379 27.193 11.448 135 HA LEU 19 HA LEU 19 24.025 24.606 10.216 136 HB2 LEU 19 HB2 LEU 19 25.430 23.933 12.087 137 HB3 LEU 19 HB3 LEU 19 26.069 25.273 11.176 138 HG LEU 19 HG LEU 19 25.416 26.843 12.969 139 HD11 LEU 19 HD11 LEU 19 23.615 25.646 14.095 140 HD12 LEU 19 HD12 LEU 19 24.729 24.320 14.494 141 HD13 LEU 19 HD13 LEU 19 24.951 25.935 15.208 142 HD21 LEU 19 HD21 LEU 19 27.689 25.851 12.866 143 HD22 LEU 19 HD22 LEU 19 27.183 26.165 14.527 144 HD23 LEU 19 HD23 LEU 19 27.144 24.507 13.886 145 H LEU 20 H LEU 20 23.527 22.898 12.345 146 HA LEU 20 HA LEU 20 20.581 23.062 12.245 147 HB2 LEU 20 HB2 LEU 20 22.157 20.980 11.807 148 HB3 LEU 20 HB3 LEU 20 22.296 20.928 13.528 149 HG LEU 20 HG LEU 20 19.854 20.521 13.766 150 HD11 LEU 20 HD11 LEU 20 19.859 20.291 10.726 151 HD12 LEU 20 HD12 LEU 20 18.509 19.941 11.808 152 HD13 LEU 20 HD13 LEU 20 19.069 21.606 11.626 153 HD21 LEU 20 HD21 LEU 20 19.900 18.245 12.879 154 HD22 LEU 20 HD22 LEU 20 21.286 18.643 11.850 155 HD23 LEU 20 HD23 LEU 20 21.463 18.671 13.613 156 H GLY 21 H GLY 21 19.285 22.537 14.149 157 HA2 GLY 21 HA2 GLY 21 20.700 22.527 16.757 158 HA3 GLY 21 HA3 GLY 21 19.217 23.422 16.677 159 H LYS 22 H LYS 22 20.014 21.090 18.230 160 HA LYS 22 HA LYS 22 17.635 19.397 17.726 161 HB2 LYS 22 HB2 LYS 22 20.424 18.369 18.397 162 HB3 LYS 22 HB3 LYS 22 18.937 17.415 18.506 163 HG2 LYS 22 HG2 LYS 22 18.529 17.892 16.062 164 HG3 LYS 22 HG3 LYS 22 20.146 18.610 15.982 165 HD2 LYS 22 HD2 LYS 22 21.100 16.427 16.769 166 HD3 LYS 22 HD3 LYS 22 19.455 15.743 16.776 167 HE2 LYS 22 HE2 LYS 22 19.276 16.396 14.325 168 HE3 LYS 22 HE3 LYS 22 20.986 16.839 14.379 169 HZ1 LYS 22 HZ1 LYS 22 21.506 14.550 14.974 170 HZ2 LYS 22 HZ2 LYS 22 19.904 14.123 14.857 171 HZ3 LYS 22 HZ3 LYS 22 20.709 14.632 13.542 172 H CYS 23 H CYS 23 16.376 19.381 19.476 173 HA CYS 23 HA CYS 23 17.650 19.189 22.141 174 HB2 CYS 23 HB2 CYS 23 16.968 21.453 22.157 175 HB3 CYS 23 HB3 CYS 23 15.394 21.082 21.488 176 H ILE 24 H ILE 24 17.455 17.038 21.829 177 HA ILE 24 HA ILE 24 14.846 15.707 21.568 178 HB ILE 24 HB ILE 24 17.598 14.541 22.136 179 HG12 ILE 24 HG12 ILE 24 16.222 15.018 19.447 180 HG13 ILE 24 HG13 ILE 24 17.687 15.816 20.031 181 HG21 ILE 24 HG21 ILE 24 16.612 12.428 21.307 182 HG22 ILE 24 HG22 ILE 24 15.669 13.027 22.655 183 HG23 ILE 24 HG23 ILE 24 15.067 13.246 21.000 184 HD11 ILE 24 HD11 ILE 24 18.860 13.606 20.053 185 HD12 ILE 24 HD12 ILE 24 17.435 12.900 19.244 186 HD13 ILE 24 HD13 ILE 24 18.359 14.180 18.450 187 H GLY 25 H GLY 25 17.349 16.095 24.107 188 HA2 GLY 25 HA2 GLY 25 15.475 14.998 26.190 189 HA3 GLY 25 HA3 GLY 25 17.223 14.794 26.180 190 H GLU 26 H GLU 26 14.807 17.445 26.104 191 HA GLU 26 HA GLU 26 14.695 19.494 27.056 192 HB2 GLU 26 HB2 GLU 26 16.082 18.170 29.404 193 HB3 GLU 26 HB3 GLU 26 15.085 19.625 29.449 194 HG2 GLU 26 HG2 GLU 26 13.112 18.338 28.717 195 HG3 GLU 26 HG3 GLU 26 14.073 16.860 28.645 196 H GLU 27 H GLU 27 17.455 18.730 25.775 197 HA GLU 27 HA GLU 27 19.112 21.009 26.780 198 HB2 GLU 27 HB2 GLU 27 19.630 18.767 27.725 199 HB3 GLU 27 HB3 GLU 27 19.860 18.140 26.092 200 HG2 GLU 27 HG2 GLU 27 21.729 19.812 25.797 201 HG3 GLU 27 HG3 GLU 27 21.533 20.252 27.499 202 H CYS 28 H CYS 28 19.455 22.414 25.139 203 HA CYS 28 HA CYS 28 19.106 21.587 22.347 204 HB2 CYS 28 HB2 CYS 28 17.948 23.550 23.233 205 HB3 CYS 28 HB3 CYS 28 19.493 24.298 23.640 206 H LYS 29 H LYS 29 20.711 20.698 21.376 207 HA LYS 29 HA LYS 29 23.533 21.675 21.493 208 HB2 LYS 29 HB2 LYS 29 22.940 19.194 21.622 209 HB3 LYS 29 HB3 LYS 29 22.224 19.331 20.023 210 HG2 LYS 29 HG2 LYS 29 24.582 20.183 19.274 211 HG3 LYS 29 HG3 LYS 29 25.157 19.554 20.811 212 HD2 LYS 29 HD2 LYS 29 23.730 18.012 18.597 213 HD3 LYS 29 HD3 LYS 29 25.458 17.952 18.917 214 HE2 LYS 29 HE2 LYS 29 23.344 17.090 20.936 215 HE3 LYS 29 HE3 LYS 29 23.975 16.012 19.693 216 HZ1 LYS 29 HZ1 LYS 29 25.156 15.800 21.819 217 HZ2 LYS 29 HZ2 LYS 29 26.177 16.223 20.609 218 HZ3 LYS 29 HZ3 LYS 29 25.684 17.338 21.727 219 H CYS 30 H CYS 30 24.361 22.865 19.717 220 HA CYS 30 HA CYS 30 22.722 22.797 17.219 221 HB2 CYS 30 HB2 CYS 30 24.863 24.842 17.430 222 HB3 CYS 30 HB3 CYS 30 23.412 24.795 16.433 223 H VAL 31 H VAL 31 23.755 22.354 15.289 224 HA VAL 31 HA VAL 31 26.077 20.516 15.704 225 HB VAL 31 HB VAL 31 23.844 19.529 13.990 226 HG11 VAL 31 HG11 VAL 31 25.939 18.301 14.354 227 HG12 VAL 31 HG12 VAL 31 25.622 18.268 16.104 228 HG13 VAL 31 HG13 VAL 31 24.546 17.421 14.978 229 HG21 VAL 31 HG21 VAL 31 22.432 20.267 15.846 230 HG22 VAL 31 HG22 VAL 31 22.667 18.517 15.952 231 HG23 VAL 31 HG23 VAL 31 23.581 19.602 17.021 232 HA PRO 32 HA PRO 32 27.161 22.101 11.567 233 HB2 PRO 32 HB2 PRO 32 29.357 20.049 11.816 234 HB3 PRO 32 HB3 PRO 32 29.444 21.767 11.316 235 HG2 PRO 32 HG2 PRO 32 30.236 21.004 13.791 236 HG3 PRO 32 HG3 PRO 32 29.245 22.491 13.591 237 HD2 PRO 32 HD2 PRO 32 28.283 19.702 14.330 238 HD3 PRO 32 HD3 PRO 32 27.964 21.265 15.148 239 H TYR 33 H TYR 33 25.032 20.519 11.598 240 HA TYR 33 HA TYR 33 23.784 18.770 10.872 241 HB2 TYR 33 HB2 TYR 33 25.274 19.401 8.315 242 HB3 TYR 33 HB3 TYR 33 23.716 18.611 8.433 243 HD1 TYR 33 HD2 TYR 33 21.923 19.982 9.880 244 HD2 TYR 33 HD1 TYR 33 25.288 21.727 7.843 245 HE1 TYR 33 HE2 TYR 33 20.659 22.122 9.608 246 HE2 TYR 33 HE1 TYR 33 24.052 23.890 7.657 247 HH TYR 33 HH TYR 33 20.654 24.187 8.784 Start of MODEL 15 1 H1 GLY 1 H1 GLY 1 11.358 17.339 23.692 2 H2 GLY 1 H2 GLY 1 10.604 17.602 22.244 3 H3 GLY 1 H3 GLY 1 9.846 16.730 23.418 4 HA2 GLY 1 HA2 GLY 1 10.546 19.583 23.545 5 HA3 GLY 1 HA3 GLY 1 8.916 18.924 23.304 6 H SER 2 H SER 2 9.749 20.700 25.367 7 HA SER 2 HA SER 2 8.811 19.351 27.802 8 HB2 SER 2 HB2 SER 2 10.827 20.102 29.076 9 HB3 SER 2 HB3 SER 2 11.186 18.835 27.899 10 HG SER 2 HG SER 2 12.156 20.274 26.596 11 H ALA 3 H ALA 3 8.850 21.061 29.667 12 HA ALA 3 HA ALA 3 7.638 23.533 28.868 13 HB1 ALA 3 HB1 ALA 3 9.014 22.753 31.479 14 HB2 ALA 3 HB2 ALA 3 7.884 24.107 31.256 15 HB3 ALA 3 HB3 ALA 3 7.315 22.437 31.060 16 H PHE 4 H PHE 4 11.003 22.664 29.012 17 HA PHE 4 HA PHE 4 11.981 25.470 29.022 18 HB2 PHE 4 HB2 PHE 4 12.996 23.929 30.584 19 HB3 PHE 4 HB3 PHE 4 13.285 22.745 29.319 20 HD1 PHE 4 HD1 PHE 4 14.221 26.262 30.318 21 HD2 PHE 4 HD2 PHE 4 15.366 22.664 28.231 22 HE1 PHE 4 HE1 PHE 4 16.478 27.213 29.905 23 HE2 PHE 4 HE2 PHE 4 17.621 23.607 27.836 24 HZ PHE 4 HZ PHE 4 18.182 25.890 28.660 25 H CYS 5 H CYS 5 11.540 22.780 26.733 26 HA CYS 5 HA CYS 5 12.759 24.437 24.600 27 HB2 CYS 5 HB2 CYS 5 14.495 22.955 25.744 28 HB3 CYS 5 HB3 CYS 5 13.581 21.569 25.154 29 H ASN 6 H ASN 6 12.186 23.899 22.491 30 HA ASN 6 HA ASN 6 10.755 21.322 22.042 31 HB2 ASN 6 HB2 ASN 6 9.095 23.206 21.804 32 HB3 ASN 6 HB3 ASN 6 10.131 23.943 20.594 33 HD21 ASN 6 HD22 ASN 6 7.699 23.566 19.588 34 HD22 ASN 6 HD21 ASN 6 7.610 22.049 18.695 35 H LEU 7 H LEU 7 11.988 20.047 20.606 36 HA LEU 7 HA LEU 7 14.375 21.018 19.452 37 HB2 LEU 7 HB2 LEU 7 13.830 18.619 19.679 38 HB3 LEU 7 HB3 LEU 7 12.692 18.737 18.339 39 HG LEU 7 HG LEU 7 15.571 19.652 17.932 40 HD11 LEU 7 HD11 LEU 7 14.571 16.766 17.804 41 HD12 LEU 7 HD12 LEU 7 16.177 17.314 17.319 42 HD13 LEU 7 HD13 LEU 7 15.681 17.392 19.024 43 HD21 LEU 7 HD21 LEU 7 15.281 18.820 15.661 44 HD22 LEU 7 HD22 LEU 7 13.689 18.152 16.056 45 HD23 LEU 7 HD23 LEU 7 13.942 19.903 16.004 46 H ARG 8 H ARG 8 11.062 21.137 18.035 47 HA ARG 8 HA ARG 8 11.870 22.130 15.477 48 HB2 ARG 8 HB2 ARG 8 9.589 21.286 16.170 49 HB3 ARG 8 HB3 ARG 8 9.295 22.825 16.977 50 HG2 ARG 8 HG2 ARG 8 10.119 22.767 14.078 51 HG3 ARG 8 HG3 ARG 8 8.466 22.349 14.497 52 HD2 ARG 8 HD2 ARG 8 7.970 24.484 15.371 53 HD3 ARG 8 HD3 ARG 8 9.645 24.990 15.445 54 HE ARG 8 HE ARG 8 7.875 25.180 13.183 55 HH11 ARG 8 HH11 ARG 8 11.329 24.759 13.852 56 HH12 ARG 8 HH12 ARG 8 11.717 25.053 12.167 57 HH21 ARG 8 HH21 ARG 8 8.598 26.080 11.285 58 HH22 ARG 8 HH22 ARG 8 10.301 26.012 10.886 59 H ARG 9 H ARG 9 11.767 23.832 18.543 60 HA ARG 9 HA ARG 9 12.177 26.489 17.249 61 HB2 ARG 9 HB2 ARG 9 11.762 25.629 20.141 62 HB3 ARG 9 HB3 ARG 9 12.267 27.254 19.686 63 HG2 ARG 9 HG2 ARG 9 10.264 27.392 18.157 64 HG3 ARG 9 HG3 ARG 9 9.683 25.874 18.852 65 HD2 ARG 9 HD2 ARG 9 10.192 28.482 20.350 66 HD3 ARG 9 HD3 ARG 9 8.623 27.874 19.852 67 HE ARG 9 HE ARG 9 8.793 26.050 21.446 68 HH11 ARG 9 HH11 ARG 9 11.080 28.691 22.088 69 HH12 ARG 9 HH12 ARG 9 11.105 28.277 23.787 70 HH21 ARG 9 HH21 ARG 9 9.010 25.576 23.534 71 HH22 ARG 9 HH22 ARG 9 10.055 26.520 24.551 72 H CYS 10 H CYS 10 14.006 24.163 19.292 73 HA CYS 10 HA CYS 10 16.471 25.586 19.308 74 HB2 CYS 10 HB2 CYS 10 15.998 23.578 20.646 75 HB3 CYS 10 HB3 CYS 10 15.893 22.613 19.173 76 H GLU 11 H GLU 11 15.115 23.357 16.832 77 HA GLU 11 HA GLU 11 17.245 23.179 15.087 78 HB2 GLU 11 HB2 GLU 11 14.949 22.020 15.153 79 HB3 GLU 11 HB3 GLU 11 14.409 23.301 14.077 80 HG2 GLU 11 HG2 GLU 11 16.910 22.155 13.156 81 HG3 GLU 11 HG3 GLU 11 15.834 20.846 13.580 82 H LEU 12 H LEU 12 15.602 25.953 15.778 83 HA LEU 12 HA LEU 12 15.855 27.255 13.152 84 HB2 LEU 12 HB2 LEU 12 13.597 26.562 13.648 85 HB3 LEU 12 HB3 LEU 12 13.677 27.297 15.246 86 HG LEU 12 HG LEU 12 13.772 29.534 14.270 87 HD11 LEU 12 HD11 LEU 12 13.188 29.804 11.829 88 HD12 LEU 12 HD12 LEU 12 14.817 29.217 12.118 89 HD13 LEU 12 HD13 LEU 12 13.544 28.079 11.599 90 HD21 LEU 12 HD21 LEU 12 11.468 29.598 13.505 91 HD22 LEU 12 HD22 LEU 12 11.491 27.856 13.164 92 HD23 LEU 12 HD23 LEU 12 11.626 28.451 14.841 93 H SER 13 H SER 13 15.926 27.808 16.764 94 HA SER 13 HA SER 13 17.054 30.478 16.503 95 HB2 SER 13 HB2 SER 13 17.589 30.203 18.916 96 HB3 SER 13 HB3 SER 13 15.895 29.884 18.507 97 HG SER 13 HG SER 13 17.905 28.101 19.332 98 H CYS 14 H CYS 14 18.462 27.225 16.865 99 HA CYS 14 HA CYS 14 21.238 27.842 16.913 100 HB2 CYS 14 HB2 CYS 14 19.581 25.585 15.745 101 HB3 CYS 14 HB3 CYS 14 21.319 25.604 15.678 102 H ARG 15 H ARG 15 19.013 28.383 14.269 103 HA ARG 15 HA ARG 15 21.026 28.095 12.179 104 HB2 ARG 15 HB2 ARG 15 18.421 29.477 12.482 105 HB3 ARG 15 HB3 ARG 15 19.193 29.291 10.877 106 HG2 ARG 15 HG2 ARG 15 19.178 26.766 11.258 107 HG3 ARG 15 HG3 ARG 15 18.191 27.030 12.683 108 HD2 ARG 15 HD2 ARG 15 16.550 28.356 11.206 109 HD3 ARG 15 HD3 ARG 15 17.546 27.953 9.814 110 HE ARG 15 HE ARG 15 16.577 25.628 11.313 111 HH11 ARG 15 HH11 ARG 15 15.593 27.874 8.757 112 HH12 ARG 15 HH12 ARG 15 14.944 26.554 7.790 113 HH21 ARG 15 HH21 ARG 15 15.471 24.094 10.070 114 HH22 ARG 15 HH22 ARG 15 14.700 24.604 8.585 115 H SER 16 H SER 16 20.200 30.713 14.320 116 HA SER 16 HA SER 16 21.175 33.057 13.114 117 HB2 SER 16 HB2 SER 16 21.573 31.925 15.922 118 HB3 SER 16 HB3 SER 16 21.965 33.593 15.462 119 HG SER 16 HG SER 16 19.473 32.360 15.773 120 H LEU 17 H LEU 17 22.823 30.201 13.652 121 HA LEU 17 HA LEU 17 25.577 31.212 13.955 122 HB2 LEU 17 HB2 LEU 17 24.550 28.462 14.644 123 HB3 LEU 17 HB3 LEU 17 25.824 29.377 15.420 124 HG LEU 17 HG LEU 17 22.795 29.887 15.752 125 HD11 LEU 17 HD11 LEU 17 24.853 28.642 17.623 126 HD12 LEU 17 HD12 LEU 17 23.142 28.941 17.980 127 HD13 LEU 17 HD13 LEU 17 23.596 27.756 16.740 128 HD21 LEU 17 HD21 LEU 17 24.231 31.939 16.110 129 HD22 LEU 17 HD22 LEU 17 23.507 31.341 17.608 130 HD23 LEU 17 HD23 LEU 17 25.210 31.012 17.251 131 H GLY 18 H GLY 18 23.643 29.942 11.535 132 HA2 GLY 18 HA2 GLY 18 24.053 28.812 9.570 133 HA3 GLY 18 HA3 GLY 18 25.770 28.749 9.975 134 H LEU 19 H LEU 19 23.337 27.339 12.145 135 HA LEU 19 HA LEU 19 24.384 24.610 11.489 136 HB2 LEU 19 HB2 LEU 19 23.566 25.680 14.201 137 HB3 LEU 19 HB3 LEU 19 24.325 24.137 13.843 138 HG LEU 19 HG LEU 19 25.634 26.844 13.554 139 HD11 LEU 19 HD11 LEU 19 25.337 26.271 15.874 140 HD12 LEU 19 HD12 LEU 19 26.071 24.663 15.610 141 HD13 LEU 19 HD13 LEU 19 27.037 26.142 15.435 142 HD21 LEU 19 HD21 LEU 19 26.817 24.038 13.277 143 HD22 LEU 19 HD22 LEU 19 26.589 25.189 11.944 144 HD23 LEU 19 HD23 LEU 19 27.735 25.557 13.229 145 H LEU 20 H LEU 20 23.094 22.905 12.588 146 HA LEU 20 HA LEU 20 20.139 23.050 12.271 147 HB2 LEU 20 HB2 LEU 20 21.521 20.984 11.570 148 HB3 LEU 20 HB3 LEU 20 21.995 20.838 13.242 149 HG LEU 20 HG LEU 20 19.570 20.378 13.832 150 HD11 LEU 20 HD11 LEU 20 18.551 21.504 11.819 151 HD12 LEU 20 HD12 LEU 20 19.259 20.251 10.797 152 HD13 LEU 20 HD13 LEU 20 18.031 19.825 12.006 153 HD21 LEU 20 HD21 LEU 20 19.564 18.140 12.836 154 HD22 LEU 20 HD22 LEU 20 20.860 18.626 11.730 155 HD23 LEU 20 HD23 LEU 20 21.167 18.567 13.479 156 H GLY 21 H GLY 21 18.922 22.278 14.244 157 HA2 GLY 21 HA2 GLY 21 20.407 22.417 16.807 158 HA3 GLY 21 HA3 GLY 21 18.841 23.185 16.721 159 H LYS 22 H LYS 22 19.949 20.799 18.215 160 HA LYS 22 HA LYS 22 17.664 18.978 17.807 161 HB2 LYS 22 HB2 LYS 22 20.571 18.092 17.991 162 HB3 LYS 22 HB3 LYS 22 19.195 17.045 18.335 163 HG2 LYS 22 HG2 LYS 22 18.322 17.649 15.975 164 HG3 LYS 22 HG3 LYS 22 19.950 18.293 15.675 165 HD2 LYS 22 HD2 LYS 22 20.907 16.060 16.293 166 HD3 LYS 22 HD3 LYS 22 19.258 15.466 16.580 167 HE2 LYS 22 HE2 LYS 22 18.702 16.000 14.194 168 HE3 LYS 22 HE3 LYS 22 20.407 16.413 13.935 169 HZ1 LYS 22 HZ1 LYS 22 19.900 14.071 13.315 170 HZ2 LYS 22 HZ2 LYS 22 20.987 14.117 14.563 171 HZ3 LYS 22 HZ3 LYS 22 19.426 13.737 14.830 172 H CYS 23 H CYS 23 16.601 19.024 19.626 173 HA CYS 23 HA CYS 23 18.012 19.455 22.218 174 HB2 CYS 23 HB2 CYS 23 16.735 21.366 21.296 175 HB3 CYS 23 HB3 CYS 23 15.275 20.408 21.385 176 H ILE 24 H ILE 24 18.026 16.933 21.673 177 HA ILE 24 HA ILE 24 15.512 15.514 22.061 178 HB ILE 24 HB ILE 24 18.356 14.467 21.868 179 HG12 ILE 24 HG12 ILE 24 16.294 15.011 19.669 180 HG13 ILE 24 HG13 ILE 24 17.837 15.849 19.889 181 HG21 ILE 24 HG21 ILE 24 15.665 13.109 21.314 182 HG22 ILE 24 HG22 ILE 24 17.264 12.349 21.172 183 HG23 ILE 24 HG23 ILE 24 16.671 12.823 22.751 184 HD11 ILE 24 HD11 ILE 24 19.055 13.748 19.416 185 HD12 ILE 24 HD12 ILE 24 17.496 12.966 19.027 186 HD13 ILE 24 HD13 ILE 24 18.054 14.338 18.072 187 H GLY 25 H GLY 25 18.477 16.028 24.002 188 HA2 GLY 25 HA2 GLY 25 17.419 14.621 26.369 189 HA3 GLY 25 HA3 GLY 25 18.916 15.551 26.248 190 H GLU 26 H GLU 26 16.290 17.264 24.950 191 HA GLU 26 HA GLU 26 15.488 19.296 25.397 192 HB2 GLU 26 HB2 GLU 26 15.298 18.576 28.311 193 HB3 GLU 26 HB3 GLU 26 14.397 19.801 27.440 194 HG2 GLU 26 HG2 GLU 26 14.186 16.772 27.027 195 HG3 GLU 26 HG3 GLU 26 13.045 17.797 27.864 196 H GLU 27 H GLU 27 18.255 18.954 25.200 197 HA GLU 27 HA GLU 27 19.472 20.890 27.104 198 HB2 GLU 27 HB2 GLU 27 21.467 19.778 26.820 199 HB3 GLU 27 HB3 GLU 27 20.287 18.488 26.945 200 HG2 GLU 27 HG2 GLU 27 21.552 19.475 24.334 201 HG3 GLU 27 HG3 GLU 27 22.118 18.118 25.284 202 H CYS 28 H CYS 28 18.623 20.569 23.838 203 HA CYS 28 HA CYS 28 19.066 21.538 21.887 204 HB2 CYS 28 HB2 CYS 28 17.813 23.340 22.991 205 HB3 CYS 28 HB3 CYS 28 19.335 24.082 23.483 206 H LYS 29 H LYS 29 20.831 20.408 21.325 207 HA LYS 29 HA LYS 29 23.493 21.729 21.327 208 HB2 LYS 29 HB2 LYS 29 23.104 19.172 21.411 209 HB3 LYS 29 HB3 LYS 29 22.523 19.276 19.753 210 HG2 LYS 29 HG2 LYS 29 24.749 20.385 19.135 211 HG3 LYS 29 HG3 LYS 29 25.290 20.094 20.780 212 HD2 LYS 29 HD2 LYS 29 24.755 18.108 18.572 213 HD3 LYS 29 HD3 LYS 29 26.243 18.372 19.477 214 HE2 LYS 29 HE2 LYS 29 23.663 17.121 20.487 215 HE3 LYS 29 HE3 LYS 29 25.157 16.266 20.111 216 HZ1 LYS 29 HZ1 LYS 29 24.795 16.742 22.518 217 HZ2 LYS 29 HZ2 LYS 29 26.240 17.308 21.970 218 HZ3 LYS 29 HZ3 LYS 29 24.990 18.340 22.254 219 H CYS 30 H CYS 30 24.180 22.984 19.537 220 HA CYS 30 HA CYS 30 22.463 22.822 17.109 221 HB2 CYS 30 HB2 CYS 30 24.481 25.000 17.485 222 HB3 CYS 30 HB3 CYS 30 23.119 24.909 16.316 223 H VAL 31 H VAL 31 23.412 22.334 15.193 224 HA VAL 31 HA VAL 31 25.870 20.672 15.599 225 HB VAL 31 HB VAL 31 23.607 19.601 13.968 226 HG11 VAL 31 HG11 VAL 31 24.437 17.490 14.898 227 HG12 VAL 31 HG12 VAL 31 25.750 18.407 14.148 228 HG13 VAL 31 HG13 VAL 31 25.585 18.377 15.922 229 HG21 VAL 31 HG21 VAL 31 22.597 18.516 15.966 230 HG22 VAL 31 HG22 VAL 31 23.568 19.563 17.011 231 HG23 VAL 31 HG23 VAL 31 22.323 20.261 15.948 232 HA PRO 32 HA PRO 32 27.031 22.185 11.495 233 HB2 PRO 32 HB2 PRO 32 28.888 19.795 11.641 234 HB3 PRO 32 HB3 PRO 32 29.233 21.471 11.091 235 HG2 PRO 32 HG2 PRO 32 29.973 20.738 13.563 236 HG3 PRO 32 HG3 PRO 32 29.106 22.294 13.358 237 HD2 PRO 32 HD2 PRO 32 27.933 19.600 14.143 238 HD3 PRO 32 HD3 PRO 32 27.765 21.178 14.957 239 H TYR 33 H TYR 33 24.690 20.873 11.429 240 HA TYR 33 HA TYR 33 23.197 19.611 10.301 241 HB2 TYR 33 HB2 TYR 33 24.697 21.349 8.612 242 HB3 TYR 33 HB3 TYR 33 24.245 19.961 7.644 243 HD1 TYR 33 HD2 TYR 33 22.825 22.249 10.213 244 HD2 TYR 33 HD1 TYR 33 22.118 20.143 6.542 245 HE1 TYR 33 HE2 TYR 33 20.569 23.331 10.030 246 HE2 TYR 33 HE1 TYR 33 19.865 21.181 6.366 247 HH TYR 33 HH TYR 33 18.597 23.296 8.984 Start of MODEL 16 1 H1 GLY 1 H1 GLY 1 16.302 29.480 28.423 2 H2 GLY 1 H2 GLY 1 16.786 29.690 29.979 3 H3 GLY 1 H3 GLY 1 15.417 28.815 29.651 4 HA2 GLY 1 HA2 GLY 1 18.148 28.076 28.859 5 HA3 GLY 1 HA3 GLY 1 17.251 27.366 30.224 6 H SER 2 H SER 2 17.102 25.313 29.499 7 HA SER 2 HA SER 2 15.857 24.756 26.834 8 HB2 SER 2 HB2 SER 2 17.434 22.834 28.558 9 HB3 SER 2 HB3 SER 2 17.041 22.703 26.833 10 HG SER 2 HG SER 2 19.247 23.378 27.634 11 H ALA 3 H ALA 3 14.773 25.075 29.907 12 HA ALA 3 HA ALA 3 13.705 22.543 30.585 13 HB1 ALA 3 HB1 ALA 3 12.768 25.327 31.392 14 HB2 ALA 3 HB2 ALA 3 12.313 23.814 32.182 15 HB3 ALA 3 HB3 ALA 3 13.999 24.346 32.204 16 H PHE 4 H PHE 4 11.972 21.450 30.024 17 HA PHE 4 HA PHE 4 10.546 20.616 28.483 18 HB2 PHE 4 HB2 PHE 4 9.027 23.146 29.139 19 HB3 PHE 4 HB3 PHE 4 8.350 21.671 28.435 20 HD1 PHE 4 HD1 PHE 4 8.778 19.427 29.780 21 HD2 PHE 4 HD2 PHE 4 9.057 23.369 31.508 22 HE1 PHE 4 HE1 PHE 4 8.551 18.455 32.043 23 HE2 PHE 4 HE2 PHE 4 8.817 22.377 33.760 24 HZ PHE 4 HZ PHE 4 8.561 19.925 34.048 25 H CYS 5 H CYS 5 12.557 21.314 27.078 26 HA CYS 5 HA CYS 5 12.403 23.198 25.086 27 HB2 CYS 5 HB2 CYS 5 14.346 21.725 25.684 28 HB3 CYS 5 HB3 CYS 5 13.566 20.409 24.803 29 H ASN 6 H ASN 6 11.725 23.351 22.982 30 HA ASN 6 HA ASN 6 10.330 21.023 21.703 31 HB2 ASN 6 HB2 ASN 6 8.739 22.884 22.044 32 HB3 ASN 6 HB3 ASN 6 9.842 23.995 21.221 33 HD21 ASN 6 HD22 ASN 6 7.573 24.167 20.056 34 HD22 ASN 6 HD21 ASN 6 7.341 23.023 18.732 35 H LEU 7 H LEU 7 11.637 20.126 20.164 36 HA LEU 7 HA LEU 7 14.139 21.337 19.454 37 HB2 LEU 7 HB2 LEU 7 13.771 18.912 19.388 38 HB3 LEU 7 HB3 LEU 7 12.629 19.089 18.063 39 HG LEU 7 HG LEU 7 15.493 20.116 17.736 40 HD11 LEU 7 HD11 LEU 7 15.986 17.798 16.816 41 HD12 LEU 7 HD12 LEU 7 15.656 17.773 18.568 42 HD13 LEU 7 HD13 LEU 7 14.424 17.262 17.417 43 HD21 LEU 7 HD21 LEU 7 15.129 19.504 15.385 44 HD22 LEU 7 HD22 LEU 7 13.576 18.739 15.771 45 HD23 LEU 7 HD23 LEU 7 13.754 20.485 15.870 46 H ARG 8 H ARG 8 10.975 21.537 17.847 47 HA ARG 8 HA ARG 8 11.823 22.690 15.412 48 HB2 ARG 8 HB2 ARG 8 9.504 21.914 15.907 49 HB3 ARG 8 HB3 ARG 8 9.308 23.228 17.082 50 HG2 ARG 8 HG2 ARG 8 9.322 24.910 15.360 51 HG3 ARG 8 HG3 ARG 8 9.743 23.723 14.111 52 HD2 ARG 8 HD2 ARG 8 7.197 23.561 15.772 53 HD3 ARG 8 HD3 ARG 8 7.288 24.450 14.253 54 HE ARG 8 HE ARG 8 8.109 22.241 13.227 55 HH11 ARG 8 HH11 ARG 8 5.566 22.238 15.687 56 HH12 ARG 8 HH12 ARG 8 5.435 20.490 15.558 57 HH21 ARG 8 HH21 ARG 8 7.702 20.216 12.995 58 HH22 ARG 8 HH22 ARG 8 6.376 19.419 13.854 59 H ARG 9 H ARG 9 11.571 24.165 18.541 60 HA ARG 9 HA ARG 9 11.887 26.909 17.467 61 HB2 ARG 9 HB2 ARG 9 10.298 26.179 19.335 62 HB3 ARG 9 HB3 ARG 9 11.719 26.008 20.374 63 HG2 ARG 9 HG2 ARG 9 12.262 28.396 20.051 64 HG3 ARG 9 HG3 ARG 9 10.976 28.539 18.831 65 HD2 ARG 9 HD2 ARG 9 10.093 29.409 20.889 66 HD3 ARG 9 HD3 ARG 9 9.301 27.866 20.567 67 HE ARG 9 HE ARG 9 11.594 28.198 22.506 68 HH11 ARG 9 HH11 ARG 9 8.609 26.405 21.793 69 HH12 ARG 9 HH12 ARG 9 8.501 25.897 23.460 70 HH21 ARG 9 HH21 ARG 9 11.208 27.634 24.553 71 HH22 ARG 9 HH22 ARG 9 10.010 26.418 24.939 72 H CYS 10 H CYS 10 13.764 24.531 19.388 73 HA CYS 10 HA CYS 10 16.125 26.184 19.672 74 HB2 CYS 10 HB2 CYS 10 15.418 23.288 19.876 75 HB3 CYS 10 HB3 CYS 10 17.126 23.696 19.700 76 H GLU 11 H GLU 11 14.943 24.089 16.986 77 HA GLU 11 HA GLU 11 17.178 24.101 15.338 78 HB2 GLU 11 HB2 GLU 11 14.263 24.329 14.701 79 HB3 GLU 11 HB3 GLU 11 15.487 24.477 13.427 80 HG2 GLU 11 HG2 GLU 11 16.398 22.288 14.008 81 HG3 GLU 11 HG3 GLU 11 15.116 22.077 15.209 82 H LEU 12 H LEU 12 14.761 26.680 15.731 83 HA LEU 12 HA LEU 12 15.882 28.276 13.576 84 HB2 LEU 12 HB2 LEU 12 13.543 28.430 15.475 85 HB3 LEU 12 HB3 LEU 12 13.828 29.698 14.257 86 HG LEU 12 HG LEU 12 13.483 26.730 13.601 87 HD11 LEU 12 HD11 LEU 12 11.433 27.668 14.602 88 HD12 LEU 12 HD12 LEU 12 11.480 29.020 13.449 89 HD13 LEU 12 HD13 LEU 12 11.217 27.362 12.873 90 HD21 LEU 12 HD21 LEU 12 13.370 29.206 11.819 91 HD22 LEU 12 HD22 LEU 12 14.671 28.009 11.814 92 HD23 LEU 12 HD23 LEU 12 13.049 27.535 11.313 93 H SER 13 H SER 13 16.179 28.425 17.068 94 HA SER 13 HA SER 13 17.522 31.048 16.952 95 HB2 SER 13 HB2 SER 13 17.621 28.905 19.092 96 HB3 SER 13 HB3 SER 13 18.234 30.567 19.235 97 HG SER 13 HG SER 13 16.184 31.352 19.275 98 H CYS 14 H CYS 14 18.349 27.742 16.155 99 HA CYS 14 HA CYS 14 21.231 28.336 16.348 100 HB2 CYS 14 HB2 CYS 14 19.602 25.828 16.290 101 HB3 CYS 14 HB3 CYS 14 21.305 25.802 15.887 102 H ARG 15 H ARG 15 18.903 27.681 13.745 103 HA ARG 15 HA ARG 15 20.926 26.879 11.859 104 HB2 ARG 15 HB2 ARG 15 18.276 28.190 11.783 105 HB3 ARG 15 HB3 ARG 15 19.047 27.777 10.238 106 HG2 ARG 15 HG2 ARG 15 19.082 25.409 10.703 107 HG3 ARG 15 HG3 ARG 15 18.489 25.628 12.349 108 HD2 ARG 15 HD2 ARG 15 16.363 26.507 11.506 109 HD3 ARG 15 HD3 ARG 15 16.960 26.560 9.864 110 HE ARG 15 HE ARG 15 16.197 24.089 11.398 111 HH11 ARG 15 HH11 ARG 15 17.145 25.295 8.171 112 HH12 ARG 15 HH12 ARG 15 16.038 24.131 7.446 113 HH21 ARG 15 HH21 ARG 15 15.043 22.653 10.273 114 HH22 ARG 15 HH22 ARG 15 15.095 22.693 8.496 115 H SER 16 H SER 16 19.634 30.046 12.692 116 HA SER 16 HA SER 16 20.885 31.868 11.013 117 HB2 SER 16 HB2 SER 16 20.363 31.911 14.013 118 HB3 SER 16 HB3 SER 16 20.668 33.366 13.021 119 HG SER 16 HG SER 16 18.829 32.940 11.837 120 H LEU 17 H LEU 17 22.618 29.600 12.510 121 HA LEU 17 HA LEU 17 25.060 31.190 13.167 122 HB2 LEU 17 HB2 LEU 17 24.343 28.477 14.259 123 HB3 LEU 17 HB3 LEU 17 25.475 29.642 14.894 124 HG LEU 17 HG LEU 17 22.406 29.893 15.019 125 HD11 LEU 17 HD11 LEU 17 23.408 28.139 16.498 126 HD12 LEU 17 HD12 LEU 17 24.545 29.331 17.135 127 HD13 LEU 17 HD13 LEU 17 22.812 29.522 17.439 128 HD21 LEU 17 HD21 LEU 17 24.613 31.615 16.232 129 HD22 LEU 17 HD22 LEU 17 23.508 32.117 14.948 130 HD23 LEU 17 HD23 LEU 17 22.878 31.762 16.556 131 H GLY 18 H GLY 18 23.711 29.143 10.848 132 HA2 GLY 18 HA2 GLY 18 24.699 27.880 9.141 133 HA3 GLY 18 HA3 GLY 18 26.279 28.024 9.932 134 H LEU 19 H LEU 19 24.233 27.119 12.341 135 HA LEU 19 HA LEU 19 25.067 24.278 12.240 136 HB2 LEU 19 HB2 LEU 19 23.803 25.884 14.501 137 HB3 LEU 19 HB3 LEU 19 24.543 24.296 14.625 138 HG LEU 19 HG LEU 19 26.015 26.903 14.061 139 HD11 LEU 19 HD11 LEU 19 26.971 26.546 16.285 140 HD12 LEU 19 HD12 LEU 19 25.209 26.630 16.393 141 HD13 LEU 19 HD13 LEU 19 26.027 25.055 16.483 142 HD21 LEU 19 HD21 LEU 19 27.163 25.032 12.941 143 HD22 LEU 19 HD22 LEU 19 28.073 25.582 14.353 144 HD23 LEU 19 HD23 LEU 19 27.110 24.097 14.460 145 H LEU 20 H LEU 20 23.185 22.993 13.609 146 HA LEU 20 HA LEU 20 20.448 23.767 12.733 147 HB2 LEU 20 HB2 LEU 20 20.962 22.114 11.100 148 HB3 LEU 20 HB3 LEU 20 21.838 21.113 12.273 149 HG LEU 20 HG LEU 20 19.663 20.627 13.441 150 HD11 LEU 20 HD11 LEU 20 17.561 21.087 12.293 151 HD12 LEU 20 HD12 LEU 20 18.364 22.652 12.530 152 HD13 LEU 20 HD13 LEU 20 18.409 21.874 10.955 153 HD21 LEU 20 HD21 LEU 20 20.608 19.061 11.800 154 HD22 LEU 20 HD22 LEU 20 18.842 19.033 11.895 155 HD23 LEU 20 HD23 LEU 20 19.623 19.846 10.534 156 H GLY 21 H GLY 21 18.857 22.910 14.179 157 HA2 GLY 21 HA2 GLY 21 19.902 22.480 16.973 158 HA3 GLY 21 HA3 GLY 21 18.279 22.989 16.617 159 H LYS 22 H LYS 22 19.897 20.586 17.826 160 HA LYS 22 HA LYS 22 17.983 18.440 17.029 161 HB2 LYS 22 HB2 LYS 22 20.336 18.183 16.116 162 HB3 LYS 22 HB3 LYS 22 20.903 18.067 17.767 163 HG2 LYS 22 HG2 LYS 22 20.789 15.861 16.913 164 HG3 LYS 22 HG3 LYS 22 19.483 16.006 18.074 165 HD2 LYS 22 HD2 LYS 22 18.732 14.742 16.169 166 HD3 LYS 22 HD3 LYS 22 17.857 16.281 16.177 167 HE2 LYS 22 HE2 LYS 22 19.424 17.149 14.452 168 HE3 LYS 22 HE3 LYS 22 20.314 15.619 14.486 169 HZ1 LYS 22 HZ1 LYS 22 18.748 15.718 12.656 170 HZ2 LYS 22 HZ2 LYS 22 18.303 14.510 13.638 171 HZ3 LYS 22 HZ3 LYS 22 17.470 15.940 13.663 172 H CYS 23 H CYS 23 17.070 19.989 18.943 173 HA CYS 23 HA CYS 23 18.054 19.467 21.590 174 HB2 CYS 23 HB2 CYS 23 16.847 21.559 20.947 175 HB3 CYS 23 HB3 CYS 23 15.354 20.606 20.905 176 H ILE 24 H ILE 24 17.993 17.043 21.263 177 HA ILE 24 HA ILE 24 15.345 15.776 21.624 178 HB ILE 24 HB ILE 24 18.106 14.581 21.410 179 HG12 ILE 24 HG12 ILE 24 15.798 15.005 19.425 180 HG13 ILE 24 HG13 ILE 24 17.401 15.727 19.333 181 HG21 ILE 24 HG21 ILE 24 16.482 13.100 22.641 182 HG22 ILE 24 HG22 ILE 24 15.314 13.308 21.312 183 HG23 ILE 24 HG23 ILE 24 16.845 12.429 21.066 184 HD11 ILE 24 HD11 ILE 24 16.731 12.799 18.870 185 HD12 ILE 24 HD12 ILE 24 17.170 14.006 17.671 186 HD13 ILE 24 HD13 ILE 24 18.378 13.491 18.871 187 H GLY 25 H GLY 25 18.405 15.909 23.568 188 HA2 GLY 25 HA2 GLY 25 17.181 14.565 25.842 189 HA3 GLY 25 HA3 GLY 25 18.802 15.258 25.755 190 H GLU 26 H GLU 26 16.026 17.229 24.998 191 HA GLU 26 HA GLU 26 15.470 19.320 25.708 192 HB2 GLU 26 HB2 GLU 26 15.775 18.233 28.517 193 HB3 GLU 26 HB3 GLU 26 14.824 19.621 28.022 194 HG2 GLU 26 HG2 GLU 26 13.123 18.352 27.107 195 HG3 GLU 26 HG3 GLU 26 14.119 16.919 26.854 196 H GLU 27 H GLU 27 18.237 18.901 25.070 197 HA GLU 27 HA GLU 27 19.716 20.517 27.086 198 HB2 GLU 27 HB2 GLU 27 21.647 19.395 26.479 199 HB3 GLU 27 HB3 GLU 27 20.417 18.145 26.539 200 HG2 GLU 27 HG2 GLU 27 21.584 19.404 24.023 201 HG3 GLU 27 HG3 GLU 27 22.020 17.850 24.703 202 H CYS 28 H CYS 28 18.242 21.019 24.229 203 HA CYS 28 HA CYS 28 18.410 22.246 22.380 204 HB2 CYS 28 HB2 CYS 28 18.114 23.962 24.272 205 HB3 CYS 28 HB3 CYS 28 19.768 24.428 23.900 206 H LYS 29 H LYS 29 20.193 20.327 22.283 207 HA LYS 29 HA LYS 29 22.895 20.987 21.604 208 HB2 LYS 29 HB2 LYS 29 21.123 18.684 21.363 209 HB3 LYS 29 HB3 LYS 29 21.789 19.000 19.773 210 HG2 LYS 29 HG2 LYS 29 24.091 19.125 21.054 211 HG3 LYS 29 HG3 LYS 29 23.223 18.204 22.290 212 HD2 LYS 29 HD2 LYS 29 23.771 17.486 19.387 213 HD3 LYS 29 HD3 LYS 29 24.368 16.654 20.805 214 HE2 LYS 29 HE2 LYS 29 21.459 16.705 19.848 215 HE3 LYS 29 HE3 LYS 29 22.627 15.407 19.584 216 HZ1 LYS 29 HZ1 LYS 29 21.365 16.165 22.152 217 HZ2 LYS 29 HZ2 LYS 29 21.432 14.709 21.402 218 HZ3 LYS 29 HZ3 LYS 29 22.771 15.319 22.117 219 H CYS 30 H CYS 30 23.790 21.991 19.791 220 HA CYS 30 HA CYS 30 22.153 21.840 17.364 221 HB2 CYS 30 HB2 CYS 30 23.482 24.480 17.994 222 HB3 CYS 30 HB3 CYS 30 22.475 24.059 16.561 223 H VAL 31 H VAL 31 23.085 21.132 15.776 224 HA VAL 31 HA VAL 31 25.800 20.093 16.080 225 HB VAL 31 HB VAL 31 25.107 18.439 14.465 226 HG11 VAL 31 HG11 VAL 31 24.555 18.160 16.892 227 HG12 VAL 31 HG12 VAL 31 22.926 18.787 16.569 228 HG13 VAL 31 HG13 VAL 31 23.476 17.275 15.810 229 HG21 VAL 31 HG21 VAL 31 22.384 19.799 14.351 230 HG22 VAL 31 HG22 VAL 31 23.565 19.697 13.019 231 HG23 VAL 31 HG23 VAL 31 22.816 18.230 13.645 232 HA PRO 32 HA PRO 32 27.340 22.661 12.699 233 HB2 PRO 32 HB2 PRO 32 29.341 20.405 12.398 234 HB3 PRO 32 HB3 PRO 32 29.614 22.179 12.417 235 HG2 PRO 32 HG2 PRO 32 30.107 20.711 14.620 236 HG3 PRO 32 HG3 PRO 32 29.224 22.270 14.788 237 HD2 PRO 32 HD2 PRO 32 28.075 19.449 14.672 238 HD3 PRO 32 HD3 PRO 32 27.715 20.801 15.804 239 H TYR 33 H TYR 33 25.185 21.936 11.698 240 HA TYR 33 HA TYR 33 24.561 20.095 9.924 241 HB2 TYR 33 HB2 TYR 33 23.300 22.146 10.625 242 HB3 TYR 33 HB3 TYR 33 24.121 23.046 9.356 243 HD1 TYR 33 HD2 TYR 33 21.935 20.118 10.070 244 HD2 TYR 33 HD1 TYR 33 23.300 22.932 7.099 245 HE1 TYR 33 HE2 TYR 33 20.413 19.071 8.342 246 HE2 TYR 33 HE1 TYR 33 21.702 21.980 5.443 247 HH TYR 33 HH TYR 33 20.037 20.505 5.095 Start of MODEL 17 1 H1 GLY 1 H1 GLY 1 7.819 17.561 24.796 2 H2 GLY 1 H2 GLY 1 7.800 17.444 23.160 3 H3 GLY 1 H3 GLY 1 6.773 16.516 24.074 4 HA2 GLY 1 HA2 GLY 1 5.510 18.275 23.106 5 HA3 GLY 1 HA3 GLY 1 5.638 18.501 24.860 6 H SER 2 H SER 2 5.603 20.694 25.025 7 HA SER 2 HA SER 2 7.879 22.242 23.834 8 HB2 SER 2 HB2 SER 2 4.982 23.138 24.157 9 HB3 SER 2 HB3 SER 2 6.327 24.133 23.573 10 HG SER 2 HG SER 2 5.129 21.864 22.362 11 H ALA 3 H ALA 3 6.356 21.326 26.735 12 HA ALA 3 HA ALA 3 6.109 23.642 28.212 13 HB1 ALA 3 HB1 ALA 3 6.875 20.848 29.174 14 HB2 ALA 3 HB2 ALA 3 6.135 22.127 30.158 15 HB3 ALA 3 HB3 ALA 3 5.229 21.418 28.816 16 H PHE 4 H PHE 4 9.156 21.992 27.577 17 HA PHE 4 HA PHE 4 10.614 24.183 29.014 18 HB2 PHE 4 HB2 PHE 4 10.455 22.101 30.389 19 HB3 PHE 4 HB3 PHE 4 11.314 21.226 29.129 20 HD1 PHE 4 HD2 PHE 4 11.585 24.107 31.523 21 HD2 PHE 4 HD1 PHE 4 13.729 21.227 29.131 22 HE1 PHE 4 HE2 PHE 4 13.704 24.736 32.648 23 HE2 PHE 4 HE1 PHE 4 15.825 21.837 30.279 24 HZ PHE 4 HZ PHE 4 15.828 23.595 32.036 25 H CYS 5 H CYS 5 10.655 21.749 26.420 26 HA CYS 5 HA CYS 5 12.062 23.649 24.732 27 HB2 CYS 5 HB2 CYS 5 13.904 22.254 25.875 28 HB3 CYS 5 HB3 CYS 5 13.274 20.873 24.975 29 H ASN 6 H ASN 6 11.564 23.328 22.548 30 HA ASN 6 HA ASN 6 10.710 20.610 21.738 31 HB2 ASN 6 HB2 ASN 6 8.705 22.157 21.563 32 HB3 ASN 6 HB3 ASN 6 9.620 23.132 20.407 33 HD21 ASN 6 HD22 ASN 6 7.975 20.106 20.954 34 HD22 ASN 6 HD21 ASN 6 8.062 19.552 19.263 35 H LEU 7 H LEU 7 11.964 19.804 20.055 36 HA LEU 7 HA LEU 7 14.430 20.998 19.476 37 HB2 LEU 7 HB2 LEU 7 14.101 18.692 19.128 38 HB3 LEU 7 HB3 LEU 7 12.854 18.925 17.905 39 HG LEU 7 HG LEU 7 15.638 20.055 17.384 40 HD11 LEU 7 HD11 LEU 7 16.320 17.855 16.489 41 HD12 LEU 7 HD12 LEU 7 15.938 17.675 18.212 42 HD13 LEU 7 HD13 LEU 7 14.778 17.143 16.990 43 HD21 LEU 7 HD21 LEU 7 13.619 18.690 15.552 44 HD22 LEU 7 HD22 LEU 7 13.851 20.443 15.674 45 HD23 LEU 7 HD23 LEU 7 15.166 19.441 15.086 46 H ARG 8 H ARG 8 11.403 21.400 17.541 47 HA ARG 8 HA ARG 8 12.654 22.733 15.363 48 HB2 ARG 8 HB2 ARG 8 10.328 21.787 15.501 49 HB3 ARG 8 HB3 ARG 8 9.849 23.184 16.484 50 HG2 ARG 8 HG2 ARG 8 10.476 24.686 14.569 51 HG3 ARG 8 HG3 ARG 8 10.875 23.254 13.610 52 HD2 ARG 8 HD2 ARG 8 8.158 23.923 14.810 53 HD3 ARG 8 HD3 ARG 8 8.594 24.138 13.119 54 HE ARG 8 HE ARG 8 7.989 21.615 14.542 55 HH11 ARG 8 HH11 ARG 8 9.478 22.804 11.600 56 HH12 ARG 8 HH12 ARG 8 8.899 21.470 10.641 57 HH21 ARG 8 HH21 ARG 8 7.263 19.945 13.278 58 HH22 ARG 8 HH22 ARG 8 7.695 19.880 11.587 59 H ARG 9 H ARG 9 11.438 24.068 18.412 60 HA ARG 9 HA ARG 9 11.956 26.811 17.589 61 HB2 ARG 9 HB2 ARG 9 10.125 25.952 19.169 62 HB3 ARG 9 HB3 ARG 9 11.364 25.910 20.434 63 HG2 ARG 9 HG2 ARG 9 11.715 28.308 20.247 64 HG3 ARG 9 HG3 ARG 9 10.853 28.366 18.703 65 HD2 ARG 9 HD2 ARG 9 9.352 29.286 20.203 66 HD3 ARG 9 HD3 ARG 9 8.749 27.650 19.951 67 HE ARG 9 HE ARG 9 10.026 27.130 22.179 68 HH11 ARG 9 HH11 ARG 9 8.535 30.330 21.623 69 HH12 ARG 9 HH12 ARG 9 8.141 30.440 23.325 70 HH21 ARG 9 HH21 ARG 9 9.370 27.488 24.336 71 HH22 ARG 9 HH22 ARG 9 8.649 29.038 24.716 72 H CYS 10 H CYS 10 13.972 24.370 18.990 73 HA CYS 10 HA CYS 10 16.087 26.384 19.560 74 HB2 CYS 10 HB2 CYS 10 15.826 24.330 21.020 75 HB3 CYS 10 HB3 CYS 10 16.373 23.386 19.613 76 H GLU 11 H GLU 11 15.334 23.825 17.166 77 HA GLU 11 HA GLU 11 17.533 23.811 15.516 78 HB2 GLU 11 HB2 GLU 11 15.301 22.553 15.310 79 HB3 GLU 11 HB3 GLU 11 14.747 23.944 14.368 80 HG2 GLU 11 HG2 GLU 11 16.989 23.425 13.043 81 HG3 GLU 11 HG3 GLU 11 16.840 21.864 13.809 82 H LEU 12 H LEU 12 14.882 26.182 15.478 83 HA LEU 12 HA LEU 12 15.974 27.802 13.440 84 HB2 LEU 12 HB2 LEU 12 13.917 28.087 15.617 85 HB3 LEU 12 HB3 LEU 12 14.266 29.483 14.578 86 HG LEU 12 HG LEU 12 13.631 26.749 13.374 87 HD11 LEU 12 HD11 LEU 12 11.748 27.364 14.839 88 HD12 LEU 12 HD12 LEU 12 11.672 28.973 14.090 89 HD13 LEU 12 HD13 LEU 12 11.305 27.518 13.133 90 HD21 LEU 12 HD21 LEU 12 14.618 28.514 11.875 91 HD22 LEU 12 HD22 LEU 12 12.943 28.124 11.448 92 HD23 LEU 12 HD23 LEU 12 13.306 29.605 12.345 93 H SER 13 H SER 13 16.395 28.191 17.027 94 HA SER 13 HA SER 13 17.918 30.660 16.665 95 HB2 SER 13 HB2 SER 13 18.429 30.448 19.067 96 HB3 SER 13 HB3 SER 13 16.710 30.406 18.681 97 HG SER 13 HG SER 13 18.387 28.318 19.569 98 H CYS 14 H CYS 14 18.644 27.294 16.560 99 HA CYS 14 HA CYS 14 21.544 27.591 16.503 100 HB2 CYS 14 HB2 CYS 14 19.539 25.426 15.883 101 HB3 CYS 14 HB3 CYS 14 21.261 25.212 15.666 102 H ARG 15 H ARG 15 18.974 27.662 14.042 103 HA ARG 15 HA ARG 15 20.790 27.242 11.793 104 HB2 ARG 15 HB2 ARG 15 18.019 28.099 12.339 105 HB3 ARG 15 HB3 ARG 15 18.580 28.190 10.649 106 HG2 ARG 15 HG2 ARG 15 19.026 25.857 10.512 107 HG3 ARG 15 HG3 ARG 15 18.874 25.608 12.239 108 HD2 ARG 15 HD2 ARG 15 16.966 24.703 10.911 109 HD3 ARG 15 HD3 ARG 15 16.469 25.873 12.138 110 HE ARG 15 HE ARG 15 16.810 27.301 9.701 111 HH11 ARG 15 HH11 ARG 15 14.620 24.812 10.930 112 HH12 ARG 15 HH12 ARG 15 13.255 25.561 10.131 113 HH21 ARG 15 HH21 ARG 15 15.115 28.070 8.691 114 HH22 ARG 15 HH22 ARG 15 13.545 27.260 8.749 115 H SER 16 H SER 16 19.504 30.099 13.416 116 HA SER 16 HA SER 16 20.501 32.230 11.926 117 HB2 SER 16 HB2 SER 16 20.564 31.689 14.926 118 HB3 SER 16 HB3 SER 16 20.693 33.309 14.172 119 HG SER 16 HG SER 16 18.498 32.661 14.834 120 H LEU 17 H LEU 17 22.327 29.677 13.260 121 HA LEU 17 HA LEU 17 24.919 31.099 13.374 122 HB2 LEU 17 HB2 LEU 17 24.421 28.235 14.122 123 HB3 LEU 17 HB3 LEU 17 25.593 29.357 14.767 124 HG LEU 17 HG LEU 17 22.571 29.391 15.352 125 HD11 LEU 17 HD11 LEU 17 23.868 27.525 16.378 126 HD12 LEU 17 HD12 LEU 17 25.011 28.696 17.062 127 HD13 LEU 17 HD13 LEU 17 23.320 28.695 17.594 128 HD21 LEU 17 HD21 LEU 17 23.139 31.059 17.058 129 HD22 LEU 17 HD22 LEU 17 24.831 31.075 16.519 130 HD23 LEU 17 HD23 LEU 17 23.544 31.684 15.460 131 H GLY 18 H GLY 18 23.197 29.513 10.982 132 HA2 GLY 18 HA2 GLY 18 23.856 28.525 8.978 133 HA3 GLY 18 HA3 GLY 18 25.553 28.646 9.455 134 H LEU 19 H LEU 19 23.562 27.150 11.841 135 HA LEU 19 HA LEU 19 24.632 24.444 11.150 136 HB2 LEU 19 HB2 LEU 19 23.832 25.592 13.851 137 HB3 LEU 19 HB3 LEU 19 24.577 24.043 13.563 138 HG LEU 19 HG LEU 19 25.876 26.750 13.152 139 HD11 LEU 19 HD11 LEU 19 26.431 24.522 15.149 140 HD12 LEU 19 HD12 LEU 19 27.321 26.052 14.996 141 HD13 LEU 19 HD13 LEU 19 25.630 26.077 15.495 142 HD21 LEU 19 HD21 LEU 19 26.781 25.179 11.479 143 HD22 LEU 19 HD22 LEU 19 27.967 25.491 12.742 144 HD23 LEU 19 HD23 LEU 19 27.056 23.971 12.755 145 H LEU 20 H LEU 20 23.265 22.811 12.591 146 HA LEU 20 HA LEU 20 20.318 23.133 12.175 147 HB2 LEU 20 HB2 LEU 20 21.188 21.070 11.191 148 HB3 LEU 20 HB3 LEU 20 22.091 20.713 12.662 149 HG LEU 20 HG LEU 20 19.913 20.334 13.865 150 HD11 LEU 20 HD11 LEU 20 18.518 21.726 12.215 151 HD12 LEU 20 HD12 LEU 20 18.749 20.435 11.038 152 HD13 LEU 20 HD13 LEU 20 17.878 20.102 12.545 153 HD21 LEU 20 HD21 LEU 20 20.402 18.680 11.366 154 HD22 LEU 20 HD22 LEU 20 21.184 18.462 12.946 155 HD23 LEU 20 HD23 LEU 20 19.441 18.191 12.774 156 H GLY 21 H GLY 21 19.105 22.396 14.155 157 HA2 GLY 21 HA2 GLY 21 20.651 22.434 16.697 158 HA3 GLY 21 HA3 GLY 21 19.160 23.339 16.634 159 H LYS 22 H LYS 22 20.070 20.929 18.185 160 HA LYS 22 HA LYS 22 17.677 19.253 17.740 161 HB2 LYS 22 HB2 LYS 22 20.505 18.171 18.048 162 HB3 LYS 22 HB3 LYS 22 19.022 17.208 18.087 163 HG2 LYS 22 HG2 LYS 22 18.526 18.112 15.735 164 HG3 LYS 22 HG3 LYS 22 20.184 18.719 15.722 165 HD2 LYS 22 HD2 LYS 22 19.307 15.809 15.977 166 HD3 LYS 22 HD3 LYS 22 20.030 16.578 14.566 167 HE2 LYS 22 HE2 LYS 22 22.079 17.079 15.955 168 HE3 LYS 22 HE3 LYS 22 21.356 16.159 17.272 169 HZ1 LYS 22 HZ1 LYS 22 21.955 15.053 14.586 170 HZ2 LYS 22 HZ2 LYS 22 22.913 14.856 15.912 171 HZ3 LYS 22 HZ3 LYS 22 21.420 14.190 15.901 172 H CYS 23 H CYS 23 16.603 19.032 19.582 173 HA CYS 23 HA CYS 23 17.990 19.475 22.182 174 HB2 CYS 23 HB2 CYS 23 16.763 21.453 21.374 175 HB3 CYS 23 HB3 CYS 23 15.298 20.509 21.340 176 H ILE 24 H ILE 24 17.857 17.026 21.248 177 HA ILE 24 HA ILE 24 15.502 15.541 21.429 178 HB ILE 24 HB ILE 24 18.334 14.493 21.745 179 HG12 ILE 24 HG12 ILE 24 16.806 15.343 19.243 180 HG13 ILE 24 HG13 ILE 24 18.347 15.968 19.839 181 HG21 ILE 24 HG21 ILE 24 17.452 12.451 20.720 182 HG22 ILE 24 HG22 ILE 24 16.466 12.835 22.119 183 HG23 ILE 24 HG23 ILE 24 15.863 13.207 20.489 184 HD11 ILE 24 HD11 ILE 24 17.879 13.251 18.593 185 HD12 ILE 24 HD12 ILE 24 18.789 14.615 17.942 186 HD13 ILE 24 HD13 ILE 24 19.406 13.759 19.370 187 H GLY 25 H GLY 25 18.115 15.782 23.882 188 HA2 GLY 25 HA2 GLY 25 16.656 14.165 25.846 189 HA3 GLY 25 HA3 GLY 25 18.208 14.975 26.074 190 H GLU 26 H GLU 26 15.479 16.831 24.916 191 HA GLU 26 HA GLU 26 14.527 18.713 25.643 192 HB2 GLU 26 HB2 GLU 26 13.909 16.990 27.667 193 HB3 GLU 26 HB3 GLU 26 14.811 18.207 28.561 194 HG2 GLU 26 HG2 GLU 26 12.679 19.032 28.735 195 HG3 GLU 26 HG3 GLU 26 13.205 19.911 27.306 196 H GLU 27 H GLU 27 17.669 18.239 25.814 197 HA GLU 27 HA GLU 27 18.206 21.059 26.593 198 HB2 GLU 27 HB2 GLU 27 20.181 20.618 27.630 199 HB3 GLU 27 HB3 GLU 27 19.121 19.390 28.280 200 HG2 GLU 27 HG2 GLU 27 21.230 18.953 26.106 201 HG3 GLU 27 HG3 GLU 27 21.482 18.692 27.815 202 H CYS 28 H CYS 28 19.634 22.233 25.179 203 HA CYS 28 HA CYS 28 19.506 20.922 22.532 204 HB2 CYS 28 HB2 CYS 28 18.203 22.988 23.062 205 HB3 CYS 28 HB3 CYS 28 19.740 23.859 23.002 206 H LYS 29 H LYS 29 20.929 20.740 21.061 207 HA LYS 29 HA LYS 29 23.681 21.909 21.263 208 HB2 LYS 29 HB2 LYS 29 23.725 19.459 21.533 209 HB3 LYS 29 HB3 LYS 29 22.696 19.255 20.112 210 HG2 LYS 29 HG2 LYS 29 24.503 20.256 18.698 211 HG3 LYS 29 HG3 LYS 29 25.543 20.345 20.108 212 HD2 LYS 29 HD2 LYS 29 24.318 17.811 18.938 213 HD3 LYS 29 HD3 LYS 29 25.962 18.357 18.627 214 HE2 LYS 29 HE2 LYS 29 24.914 17.723 21.427 215 HE3 LYS 29 HE3 LYS 29 25.670 16.529 20.372 216 HZ1 LYS 29 HZ1 LYS 29 27.668 17.789 20.331 217 HZ2 LYS 29 HZ2 LYS 29 27.021 19.050 21.176 218 HZ3 LYS 29 HZ3 LYS 29 27.286 17.605 21.907 219 H CYS 30 H CYS 30 24.179 23.230 19.564 220 HA CYS 30 HA CYS 30 22.635 22.907 17.031 221 HB2 CYS 30 HB2 CYS 30 24.586 25.150 17.425 222 HB3 CYS 30 HB3 CYS 30 23.232 25.004 16.282 223 H VAL 31 H VAL 31 23.748 22.417 15.199 224 HA VAL 31 HA VAL 31 26.409 21.187 15.695 225 HB VAL 31 HB VAL 31 24.539 19.790 16.509 226 HG11 VAL 31 HG11 VAL 31 23.782 19.378 13.601 227 HG12 VAL 31 HG12 VAL 31 23.138 18.531 15.008 228 HG13 VAL 31 HG13 VAL 31 22.810 20.257 14.818 229 HG21 VAL 31 HG21 VAL 31 25.382 17.728 15.558 230 HG22 VAL 31 HG22 VAL 31 26.171 18.618 14.238 231 HG23 VAL 31 HG23 VAL 31 26.689 18.858 15.929 232 HA PRO 32 HA PRO 32 26.859 21.999 11.239 233 HB2 PRO 32 HB2 PRO 32 29.424 21.107 10.930 234 HB3 PRO 32 HB3 PRO 32 28.998 22.687 11.640 235 HG2 PRO 32 HG2 PRO 32 29.767 20.140 13.054 236 HG3 PRO 32 HG3 PRO 32 30.261 21.823 13.421 237 HD2 PRO 32 HD2 PRO 32 28.244 20.478 14.753 238 HD3 PRO 32 HD3 PRO 32 28.306 22.257 14.581 239 H TYR 33 H TYR 33 25.197 20.562 11.162 240 HA TYR 33 HA TYR 33 24.858 17.925 11.493 241 HB2 TYR 33 HB2 TYR 33 23.110 17.978 9.702 242 HB3 TYR 33 HB3 TYR 33 23.008 19.165 10.976 243 HD1 TYR 33 HD2 TYR 33 23.399 21.547 10.559 244 HD2 TYR 33 HD1 TYR 33 23.469 18.670 7.367 245 HE1 TYR 33 HE2 TYR 33 23.265 23.396 8.898 246 HE2 TYR 33 HE1 TYR 33 23.284 20.522 5.696 247 HH TYR 33 HH TYR 33 23.176 23.955 6.697
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