NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
618570 | 5t56 | 30165 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H GLY 1 H GLY 1 17.675 15.610 19.418 2 HA2 GLY 1 HA2 GLY 1 20.588 15.754 18.793 3 HA3 GLY 1 HA1 GLY 1 19.515 14.775 17.765 4 H GLY 2 H GLY 2 17.948 17.631 18.912 5 HA2 GLY 2 HA2 GLY 2 18.390 18.914 16.259 6 HA3 GLY 2 HA1 GLY 2 16.813 18.731 17.039 7 H ALA 3 H ALA 3 16.720 20.972 16.625 8 HA ALA 3 HA ALA 3 18.030 22.820 18.514 9 HB1 ALA 3 HB1 ALA 3 16.534 24.470 17.559 10 HB2 ALA 3 HB2 ALA 3 17.295 23.538 16.275 11 HB3 ALA 3 HB3 ALA 3 15.644 23.146 16.683 12 H GLY 4 H GLY 4 16.294 24.163 19.835 13 HA2 GLY 4 HA2 GLY 4 14.116 23.776 21.088 14 HA3 GLY 4 HA1 GLY 4 14.832 22.231 21.548 15 H HIS 5 H HIS 5 14.143 23.305 23.598 16 HA HIS 5 HA HIS 5 16.481 24.642 24.791 17 HB2 HIS 5 HB2 HIS 5 14.943 25.946 26.199 18 HB3 HIS 5 HB1 HIS 5 14.809 26.283 24.488 19 HD2 HIS 5 HD2 HIS 5 12.752 24.349 27.198 20 HE1 HIS 5 HE1 HIS 5 10.130 25.729 24.141 21 HE2 HIS 5 HE2 HIS 5 10.224 24.564 26.354 22 H VAL 6 H VAL 6 15.261 21.737 24.828 23 HA VAL 6 HA VAL 6 16.093 21.346 27.600 24 HB VAL 6 HB VAL 6 14.679 19.465 27.862 25 HG11 VAL 6 1HG1 VAL 6 12.585 20.510 28.273 26 HG12 VAL 6 2HG1 VAL 6 13.990 21.505 28.766 27 HG13 VAL 6 3HG1 VAL 6 13.056 21.854 27.234 28 HG21 VAL 6 1HG2 VAL 6 12.699 19.017 26.444 29 HG22 VAL 6 2HG2 VAL 6 13.232 20.258 25.348 30 HG23 VAL 6 3HG2 VAL 6 14.234 18.748 25.541 31 HA PRO 7 HA PRO 7 19.239 19.359 25.734 32 HB2 PRO 7 HB1 PRO 7 20.357 17.765 27.671 33 HB3 PRO 7 HB2 PRO 7 20.257 19.573 27.788 34 HG2 PRO 7 HG1 PRO 7 18.375 17.547 28.958 35 HG3 PRO 7 HG2 PRO 7 19.168 18.910 29.824 36 HD2 PRO 7 HD1 PRO 7 16.701 19.323 28.890 37 HD3 PRO 7 HD2 PRO 7 17.977 20.535 28.608 38 H GLU 8 H GLU 8 19.674 17.720 24.299 39 HA GLU 8 HA GLU 8 18.431 15.065 24.578 40 HB2 GLU 8 HB2 GLU 8 17.485 16.621 22.917 41 HB3 GLU 8 HB1 GLU 8 19.054 16.749 22.126 42 HG2 GLU 8 HG2 GLU 8 18.124 13.959 22.443 43 HG3 GLU 8 HG1 GLU 8 16.995 14.948 21.521 44 H TYR 9 H TYR 9 21.300 16.942 23.548 45 HA TYR 9 HA TYR 9 22.883 14.487 23.976 46 HB2 TYR 9 HB2 TYR 9 23.504 16.660 22.031 47 HB3 TYR 9 HB1 TYR 9 24.674 15.510 22.567 48 HD1 TYR 9 HD1 TYR 9 23.055 12.963 22.535 49 HD2 TYR 9 HD2 TYR 9 23.365 16.064 19.583 50 HE1 TYR 9 HE1 TYR 9 22.296 11.385 20.786 51 HE2 TYR 9 HE2 TYR 9 22.680 14.553 17.886 52 HH TYR 9 HH TYR 9 21.758 12.356 17.439 53 H PHE 10 H PHE 10 22.926 14.797 26.122 54 HA PHE 10 HA PHE 10 23.880 17.204 27.303 55 HB2 PHE 10 HB2 PHE 10 22.338 15.395 28.159 56 HB3 PHE 10 HB1 PHE 10 23.725 14.407 28.532 57 HD1 PHE 10 HD1 PHE 10 25.002 14.745 30.536 58 HD2 PHE 10 HD2 PHE 10 21.931 17.561 29.371 59 HE1 PHE 10 HE1 PHE 10 25.293 15.935 32.661 60 HE2 PHE 10 HE2 PHE 10 22.112 18.622 31.587 61 HZ PHE 10 HZ PHE 10 23.773 17.817 33.224 62 H VAL 11 H VAL 11 25.838 16.683 29.035 63 HA VAL 11 HA VAL 11 28.209 16.301 27.494 64 HB VAL 11 HB VAL 11 27.914 17.564 29.723 65 HG11 VAL 11 1HG1 VAL 11 28.424 16.436 31.733 66 HG12 VAL 11 2HG1 VAL 11 27.128 15.486 31.008 67 HG13 VAL 11 3HG1 VAL 11 28.752 14.902 30.859 68 HG21 VAL 11 1HG2 VAL 11 30.286 17.229 30.268 69 HG22 VAL 11 2HG2 VAL 11 30.335 15.870 29.078 70 HG23 VAL 11 3HG2 VAL 11 30.010 17.509 28.517 71 H ARG 12 H ARG 12 29.479 14.459 27.274 72 HA ARG 12 HA ARG 12 28.297 11.879 28.141 73 HB2 ARG 12 HB2 ARG 12 28.467 10.990 25.947 74 HB3 ARG 12 HB1 ARG 12 27.369 12.328 26.022 75 HG2 ARG 12 HG2 ARG 12 28.533 12.492 23.961 76 HG3 ARG 12 HG1 ARG 12 29.009 13.861 24.963 77 HD2 ARG 12 HD2 ARG 12 30.898 13.020 23.726 78 HD3 ARG 12 HD1 ARG 12 31.111 12.780 25.478 79 HE ARG 12 HE ARG 12 30.000 10.580 23.778 80 HH11 ARG 12 1HH1 ARG 12 32.984 11.512 25.427 81 HH12 ARG 12 2HH1 ARG 12 33.398 9.816 25.694 82 HH21 ARG 12 1HH2 ARG 12 30.685 8.515 23.997 83 HH22 ARG 12 2HH2 ARG 12 32.237 8.204 24.773 84 H1 CYS 13 H1 CYS 13 35.378 22.836 29.927 85 H2 CYS 13 H2 CYS 13 36.136 21.693 29.046 86 H3 CYS 13 H3 CYS 13 36.293 23.286 28.645 87 HA CYS 13 HA CYS 13 33.966 23.444 28.118 88 HB2 CYS 13 HB2 CYS 13 35.305 21.258 26.491 89 HB3 CYS 13 HB1 CYS 13 34.128 22.438 25.947 90 H GLY 14 H GLY 14 32.111 22.555 29.010 91 HA2 GLY 14 HA2 GLY 14 31.675 19.605 29.130 92 HA3 GLY 14 HA1 GLY 14 31.713 20.520 30.629 93 H THR 15 H THR 15 30.425 22.144 27.865 94 HA THR 15 HA THR 15 27.899 22.516 29.195 95 HB THR 15 HB THR 15 28.308 23.178 26.297 96 HG1 THR 15 HG1 THR 15 29.032 25.036 28.145 97 HG21 THR 15 1HG2 THR 15 27.141 25.327 27.140 98 HG22 THR 15 2HG2 THR 15 26.174 23.881 27.169 99 HG23 THR 15 3HG2 THR 15 26.913 24.503 28.669 100 HA PRO 16 HA PRO 16 25.868 19.064 26.955 101 HB2 PRO 16 HB1 PRO 16 23.311 19.422 27.738 102 HB3 PRO 16 HB2 PRO 16 24.518 18.847 28.911 103 HG2 PRO 16 HG1 PRO 16 23.522 21.687 28.615 104 HG3 PRO 16 HG2 PRO 16 23.703 20.733 30.083 105 HD2 PRO 16 HD1 PRO 16 25.662 22.487 29.184 106 HD3 PRO 16 HD2 PRO 16 26.084 20.958 30.029 107 H ILE 17 H ILE 17 24.985 19.021 24.883 108 HA ILE 17 HA ILE 17 24.718 21.708 23.794 109 HB ILE 17 HB ILE 17 26.660 19.838 23.506 110 HG12 ILE 17 2HG1 ILE 17 27.419 21.482 21.666 111 HG13 ILE 17 1HG1 ILE 17 25.931 22.354 22.039 112 HG21 ILE 17 1HG2 ILE 17 26.943 19.303 21.247 113 HG22 ILE 17 2HG2 ILE 17 25.480 18.489 21.913 114 HG23 ILE 17 3HG2 ILE 17 25.341 19.883 20.792 115 HD11 ILE 17 HD1 ILE 17 28.011 23.125 23.289 116 HD12 ILE 17 HD2 ILE 17 26.597 22.759 24.299 117 HD13 ILE 17 HD3 ILE 17 27.972 21.655 24.210 118 H SER 18 H SER 18 23.774 19.070 21.621 119 HA SER 18 HA SER 18 21.690 20.617 20.780 120 HB2 SER 18 HB2 SER 18 21.965 17.658 20.499 121 HB3 SER 18 HB1 SER 18 20.971 18.760 19.427 122 HG SER 18 HG SER 18 22.645 19.211 18.353 123 H PHE 19 H PHE 19 19.341 19.943 20.563 124 HA PHE 19 HA PHE 19 18.343 19.358 23.312 125 HB2 PHE 19 HB2 PHE 19 17.494 21.468 21.330 126 HB3 PHE 19 HB1 PHE 19 16.814 21.252 22.931 127 HD1 PHE 19 HD1 PHE 19 17.995 22.037 24.899 128 HD2 PHE 19 HD2 PHE 19 19.558 22.651 20.954 129 HE1 PHE 19 HE1 PHE 19 19.358 23.931 25.703 130 HE2 PHE 19 HE2 PHE 19 20.887 24.572 21.702 131 HZ PHE 19 HZ PHE 19 20.794 25.228 24.137 132 H TYR 20 H TYR 20 15.894 19.225 23.276 133 HA TYR 20 HA TYR 20 14.830 17.905 20.801 134 HB2 TYR 20 HB2 TYR 20 13.631 18.037 23.559 135 HB3 TYR 20 HB1 TYR 20 12.893 17.270 22.225 136 HD1 TYR 20 HD1 TYR 20 13.647 15.005 21.470 137 HD2 TYR 20 HD2 TYR 20 15.500 17.065 24.727 138 HE1 TYR 20 HE1 TYR 20 14.470 12.838 22.367 139 HE2 TYR 20 HE2 TYR 20 16.285 14.849 25.679 140 HH TYR 20 HH TYR 20 16.394 12.645 25.290 141 H CYS 21 H CYS 21 13.444 19.215 19.617 142 HA CYS 21 HA CYS 21 12.386 21.737 20.552 143 HB2 CYS 21 HB1 CYS 21 12.169 20.016 18.115 144 HB3 CYS 21 HB2 CYS 21 10.934 21.202 18.355 145 H GLY 22 H GLY 22 33.881 25.060 15.590 146 HA2 GLY 22 HA2 GLY 22 33.821 22.540 14.371 147 HA3 GLY 22 HA1 GLY 22 35.059 23.206 15.435 148 H GLY 23 H GLY 23 32.253 22.856 17.293 149 HA2 GLY 23 HA2 GLY 23 32.110 20.043 17.704 150 HA3 GLY 23 HA1 GLY 23 33.320 20.788 18.819 151 H ALA 24 H ALA 24 32.498 21.350 20.752 152 HA ALA 24 HA ALA 24 29.587 21.719 21.111 153 HB1 ALA 24 HB1 ALA 24 29.540 19.975 22.670 154 HB2 ALA 24 HB2 ALA 24 30.020 19.366 21.116 155 HB3 ALA 24 HB3 ALA 24 31.254 19.545 22.416 156 H GLY 25 H GLY 25 32.224 23.246 21.577 157 HA2 GLY 25 HA2 GLY 25 32.873 23.611 24.197 158 HA3 GLY 25 HA1 GLY 25 33.112 24.788 22.853 159 H HIS 26 H HIS 26 33.230 25.842 25.014 160 HA HIS 26 HA HIS 26 30.779 26.989 26.051 161 HB2 HIS 26 HB2 HIS 26 32.385 28.282 27.454 162 HB3 HIS 26 HB1 HIS 26 32.487 26.553 27.643 163 HD2 HIS 26 HD2 HIS 26 34.692 29.076 27.967 164 HE1 HIS 26 HE1 HIS 26 37.058 26.321 25.742 165 HE2 HIS 26 HE2 HIS 26 37.140 28.407 27.144 166 H VAL 27 H VAL 27 32.823 27.824 23.422 167 HA VAL 27 HA VAL 27 31.258 30.336 23.224 168 HB VAL 27 HB VAL 27 32.916 31.513 22.215 169 HG11 VAL 27 1HG1 VAL 27 34.906 31.491 23.551 170 HG12 VAL 27 2HG1 VAL 27 33.456 31.234 24.572 171 HG13 VAL 27 3HG1 VAL 27 34.517 29.869 24.185 172 HG21 VAL 27 1HG2 VAL 27 35.092 30.552 21.429 173 HG22 VAL 27 2HG2 VAL 27 34.444 28.936 21.750 174 HG23 VAL 27 3HG2 VAL 27 33.691 29.979 20.503 175 HA PRO 28 HA PRO 28 29.310 28.521 20.011 176 HB2 PRO 28 HB1 PRO 28 28.505 30.503 18.251 177 HB3 PRO 28 HB2 PRO 28 27.884 30.414 19.916 178 HG2 PRO 28 HG1 PRO 28 30.194 32.104 18.992 179 HG3 PRO 28 HG2 PRO 28 28.740 32.534 19.986 180 HD2 PRO 28 HD1 PRO 28 31.144 31.930 21.111 181 HD3 PRO 28 HD2 PRO 28 29.652 31.364 21.899 182 H GLU 29 H GLU 29 29.023 28.182 17.670 183 HA GLU 29 HA GLU 29 31.331 28.657 15.905 184 HB2 GLU 29 HB2 GLU 29 31.846 26.541 16.986 185 HB3 GLU 29 HB1 GLU 29 30.232 25.892 16.617 186 HG2 GLU 29 HG2 GLU 29 30.809 25.982 14.184 187 HG3 GLU 29 HG1 GLU 29 32.415 26.522 14.682 188 H TYR 30 H TYR 30 28.277 26.762 15.973 189 HA TYR 30 HA TYR 30 27.259 28.337 13.682 190 HB2 TYR 30 HB2 TYR 30 26.673 25.508 14.602 191 HB3 TYR 30 HB1 TYR 30 25.682 26.356 13.474 192 HD1 TYR 30 HD1 TYR 30 28.489 24.193 13.657 193 HD2 TYR 30 HD2 TYR 30 26.687 27.397 11.348 194 HE1 TYR 30 HE1 TYR 30 29.752 23.514 11.654 195 HE2 TYR 30 HE2 TYR 30 28.040 26.762 9.396 196 HH TYR 30 HH TYR 30 29.355 25.157 8.564 197 H PHE 31 H PHE 31 26.244 30.030 14.560 198 HA PHE 31 HA PHE 31 25.018 29.724 17.159 199 HB2 PHE 31 HB2 PHE 31 26.666 31.477 16.753 200 HB3 PHE 31 HB1 PHE 31 25.600 32.225 15.542 201 HD1 PHE 31 HD1 PHE 31 23.526 33.303 16.201 202 HD2 PHE 31 HD2 PHE 31 26.144 31.605 19.144 203 HE1 PHE 31 HE1 PHE 31 22.441 34.676 17.983 204 HE2 PHE 31 HE2 PHE 31 25.012 32.871 20.901 205 HZ PHE 31 HZ PHE 31 23.144 34.425 20.345 206 H VAL 32 H VAL 32 23.881 31.610 14.314 207 HA VAL 32 HA VAL 32 21.313 30.241 14.510 208 HB VAL 32 HB VAL 32 21.358 32.451 15.804 209 HG11 VAL 32 1HG1 VAL 32 21.077 34.512 14.570 210 HG12 VAL 32 2HG1 VAL 32 22.575 33.710 14.011 211 HG13 VAL 32 3HG1 VAL 32 21.117 33.662 13.029 212 HG21 VAL 32 1HG2 VAL 32 19.078 32.943 15.379 213 HG22 VAL 32 2HG2 VAL 32 19.136 32.136 13.811 214 HG23 VAL 32 3HG2 VAL 32 19.331 31.192 15.280 215 H ARG 33 H ARG 33 19.940 31.471 12.425 216 HA ARG 33 HA ARG 33 21.591 31.014 10.038 217 HB2 ARG 33 HB2 ARG 33 19.887 29.524 9.148 218 HB3 ARG 33 HB1 ARG 33 20.976 28.851 10.345 219 HG2 ARG 33 HG2 ARG 33 19.188 29.118 12.059 220 HG3 ARG 33 HG1 ARG 33 18.124 29.764 10.757 221 HD2 ARG 33 HD2 ARG 33 17.759 27.397 11.384 222 HD3 ARG 33 HD1 ARG 33 18.045 27.619 9.659 223 HE ARG 33 HE ARG 33 20.149 26.428 9.909 224 HH11 ARG 33 1HH1 ARG 33 18.864 26.830 13.206 225 HH12 ARG 33 2HH1 ARG 33 20.102 25.714 13.793 226 HH21 ARG 33 1HH2 ARG 33 21.669 25.441 10.693 227 HH22 ARG 33 2HH2 ARG 33 21.856 25.132 12.409 228 H1 CYS 34 H1 CYS 34 11.758 27.394 18.413 229 H2 CYS 34 H2 CYS 34 11.871 26.505 19.757 230 H3 CYS 34 H3 CYS 34 12.542 27.944 19.743 231 HA CYS 34 HA CYS 34 14.241 26.335 19.580 232 HB2 CYS 34 HB2 CYS 34 13.012 25.441 16.944 233 HB3 CYS 34 HB1 CYS 34 14.408 24.809 17.767 234 H GLY 35 H GLY 35 16.121 27.183 18.780 235 HA2 GLY 35 HA2 GLY 35 16.963 28.301 16.555 236 HA3 GLY 35 HA1 GLY 35 15.920 29.637 17.171 237 H THR 36 H THR 36 18.723 27.665 17.991 238 HA THR 36 HA THR 36 19.859 29.746 19.756 239 HB THR 36 HB THR 36 19.607 26.800 20.505 240 HG1 THR 36 HG1 THR 36 18.169 27.739 22.108 241 HG21 THR 36 1HG2 THR 36 20.126 27.403 22.776 242 HG22 THR 36 2HG2 THR 36 21.450 27.877 21.760 243 HG23 THR 36 3HG2 THR 36 20.326 29.117 22.343 244 HA PRO 37 HA PRO 37 23.688 27.920 17.962 245 HB2 PRO 37 HB1 PRO 37 25.277 27.936 20.266 246 HB3 PRO 37 HB2 PRO 37 25.126 29.261 19.108 247 HG2 PRO 37 HG1 PRO 37 23.538 28.863 21.732 248 HG3 PRO 37 HG2 PRO 37 24.334 30.364 21.116 249 HD2 PRO 37 HD1 PRO 37 21.725 29.977 20.811 250 HD3 PRO 37 HD2 PRO 37 22.720 30.670 19.503 251 H ILE 38 H ILE 38 24.160 25.861 17.741 252 HA ILE 38 HA ILE 38 23.341 23.927 19.861 253 HB ILE 38 HB ILE 38 22.749 23.706 16.938 254 HG12 ILE 38 2HG1 ILE 38 20.765 23.304 19.147 255 HG13 ILE 38 1HG1 ILE 38 21.231 24.910 18.902 256 HG21 ILE 38 1HG2 ILE 38 21.645 21.538 17.739 257 HG22 ILE 38 2HG2 ILE 38 23.406 21.507 17.497 258 HG23 ILE 38 3HG2 ILE 38 22.745 21.619 19.134 259 HD11 ILE 38 HD1 ILE 38 20.164 23.203 16.645 260 HD12 ILE 38 HD2 ILE 38 19.311 24.506 17.545 261 HD13 ILE 38 HD3 ILE 38 20.698 24.889 16.509 262 H SER 39 H SER 39 25.332 23.971 16.852 263 HA SER 39 HA SER 39 27.374 22.339 18.283 264 HB2 SER 39 HB2 SER 39 27.375 23.478 15.490 265 HB3 SER 39 HB1 SER 39 28.654 22.481 16.235 266 HG SER 39 HG SER 39 26.711 21.654 14.897 267 H PHE 40 H PHE 40 29.211 23.241 19.147 268 HA PHE 40 HA PHE 40 29.572 26.192 19.137 269 HB2 PHE 40 HB2 PHE 40 29.554 24.178 21.339 270 HB3 PHE 40 HB1 PHE 40 30.332 25.752 21.524 271 HD1 PHE 40 HD1 PHE 40 29.022 27.760 22.134 272 HD2 PHE 40 HD2 PHE 40 27.091 24.047 20.925 273 HE1 PHE 40 HE1 PHE 40 26.912 28.539 22.967 274 HE2 PHE 40 HE2 PHE 40 24.915 24.991 21.738 275 HZ PHE 40 HZ PHE 40 24.889 27.187 22.863 276 H TYR 41 H TYR 41 32.071 26.269 20.488 277 HA TYR 41 HA TYR 41 33.626 25.570 18.165 278 HB2 TYR 41 HB2 TYR 41 33.594 27.773 19.507 279 HB3 TYR 41 HB1 TYR 41 34.657 26.937 20.635 280 HD1 TYR 41 HD1 TYR 41 36.874 25.996 19.706 281 HD2 TYR 41 HD2 TYR 41 34.444 28.892 17.660 282 HE1 TYR 41 HE1 TYR 41 38.778 26.599 18.215 283 HE2 TYR 41 HE2 TYR 41 36.368 29.526 16.220 284 HH TYR 41 HH TYR 41 38.567 28.404 15.444 285 H CYS 42 H CYS 42 34.611 25.214 21.537 286 HA CYS 42 HA CYS 42 36.725 23.423 21.243 287 HB2 CYS 42 HB2 CYS 42 36.395 24.777 23.175 288 HB3 CYS 42 HB1 CYS 42 34.894 23.887 23.555 Start of MODEL 2 1 H GLY 1 H GLY 1 18.200 17.125 20.182 2 HA2 GLY 1 HA2 GLY 1 19.334 15.658 18.011 3 HA3 GLY 1 HA1 GLY 1 17.644 15.624 17.892 4 H GLY 2 H GLY 2 17.695 18.737 19.029 5 HA2 GLY 2 HA2 GLY 2 18.741 20.018 16.619 6 HA3 GLY 2 HA1 GLY 2 17.003 20.024 16.918 7 H ALA 3 H ALA 3 17.279 22.393 16.966 8 HA ALA 3 HA ALA 3 18.549 23.695 19.238 9 HB1 ALA 3 HB1 ALA 3 17.190 25.643 18.322 10 HB2 ALA 3 HB2 ALA 3 18.241 24.877 17.089 11 HB3 ALA 3 HB3 ALA 3 16.505 24.502 17.167 12 H GLY 4 H GLY 4 16.779 25.167 20.534 13 HA2 GLY 4 HA2 GLY 4 14.451 25.270 21.087 14 HA3 GLY 4 HA1 GLY 4 14.386 23.515 21.187 15 H HIS 5 H HIS 5 13.965 23.059 23.193 16 HA HIS 5 HA HIS 5 14.603 25.189 25.122 17 HB2 HIS 5 HB2 HIS 5 12.352 24.936 25.918 18 HB3 HIS 5 HB1 HIS 5 12.465 25.239 24.217 19 HD2 HIS 5 HD2 HIS 5 12.988 21.565 24.421 20 HE1 HIS 5 HE1 HIS 5 8.768 22.096 24.082 21 HE2 HIS 5 HE2 HIS 5 10.720 20.441 23.869 22 H VAL 6 H VAL 6 15.286 21.923 24.972 23 HA VAL 6 HA VAL 6 16.262 22.033 27.646 24 HB VAL 6 HB VAL 6 15.205 19.619 28.071 25 HG11 VAL 6 1HG1 VAL 6 13.582 20.607 29.576 26 HG12 VAL 6 2HG1 VAL 6 15.025 21.588 29.600 27 HG13 VAL 6 3HG1 VAL 6 13.628 22.134 28.655 28 HG21 VAL 6 1HG2 VAL 6 13.023 19.282 27.428 29 HG22 VAL 6 2HG2 VAL 6 12.885 20.899 26.650 30 HG23 VAL 6 3HG2 VAL 6 13.906 19.693 25.929 31 HA PRO 7 HA PRO 7 19.241 19.868 25.528 32 HB2 PRO 7 HB1 PRO 7 20.811 18.612 27.390 33 HB3 PRO 7 HB2 PRO 7 20.656 20.388 27.334 34 HG2 PRO 7 HG1 PRO 7 19.214 18.449 29.048 35 HG3 PRO 7 HG2 PRO 7 19.973 20.019 29.577 36 HD2 PRO 7 HD1 PRO 7 17.297 19.781 29.040 37 HD3 PRO 7 HD2 PRO 7 18.248 21.271 28.643 38 H GLU 8 H GLU 8 19.150 18.330 24.097 39 HA GLU 8 HA GLU 8 18.053 15.669 24.622 40 HB2 GLU 8 HB2 GLU 8 17.471 16.775 22.555 41 HB3 GLU 8 HB1 GLU 8 19.167 17.034 22.196 42 HG2 GLU 8 HG2 GLU 8 19.482 14.575 22.080 43 HG3 GLU 8 HG1 GLU 8 17.779 14.306 22.277 44 H TYR 9 H TYR 9 21.166 17.200 23.931 45 HA TYR 9 HA TYR 9 22.504 14.745 24.883 46 HB2 TYR 9 HB2 TYR 9 23.294 16.188 22.341 47 HB3 TYR 9 HB1 TYR 9 24.255 14.995 23.184 48 HD1 TYR 9 HD1 TYR 9 22.307 15.292 20.402 49 HD2 TYR 9 HD2 TYR 9 22.646 12.806 23.884 50 HE1 TYR 9 HE1 TYR 9 21.145 13.552 19.192 51 HE2 TYR 9 HE2 TYR 9 21.411 11.016 22.684 52 HH TYR 9 HH TYR 9 20.199 10.453 20.840 53 H PHE 10 H PHE 10 22.863 15.711 26.843 54 HA PHE 10 HA PHE 10 24.729 17.839 27.314 55 HB2 PHE 10 HB2 PHE 10 23.328 15.964 28.759 56 HB3 PHE 10 HB1 PHE 10 25.015 15.514 28.969 57 HD1 PHE 10 HD1 PHE 10 22.663 18.383 29.052 58 HD2 PHE 10 HD2 PHE 10 26.305 16.732 30.665 59 HE1 PHE 10 HE1 PHE 10 22.908 20.401 30.504 60 HE2 PHE 10 HE2 PHE 10 26.563 18.730 32.068 61 HZ PHE 10 HZ PHE 10 24.981 20.524 32.001 62 H VAL 11 H VAL 11 26.996 17.428 28.101 63 HA VAL 11 HA VAL 11 28.697 16.095 26.303 64 HB VAL 11 HB VAL 11 29.587 17.773 27.737 65 HG11 VAL 11 1HG1 VAL 11 30.002 17.557 30.079 66 HG12 VAL 11 2HG1 VAL 11 28.268 17.530 29.804 67 HG13 VAL 11 3HG1 VAL 11 29.172 16.017 30.178 68 HG21 VAL 11 1HG2 VAL 11 31.582 16.687 28.600 69 HG22 VAL 11 2HG2 VAL 11 30.826 15.120 28.606 70 HG23 VAL 11 3HG2 VAL 11 31.134 15.919 27.050 71 H ARG 12 H ARG 12 28.789 14.222 25.789 72 HA ARG 12 HA ARG 12 27.215 12.223 26.782 73 HB2 ARG 12 HB2 ARG 12 28.108 10.755 25.273 74 HB3 ARG 12 HB1 ARG 12 28.199 12.322 24.541 75 HG2 ARG 12 HG2 ARG 12 30.377 10.585 25.605 76 HG3 ARG 12 HG1 ARG 12 30.124 11.131 23.923 77 HD2 ARG 12 HD2 ARG 12 31.124 12.820 26.230 78 HD3 ARG 12 HD1 ARG 12 32.061 12.055 24.932 79 HE ARG 12 HE ARG 12 29.961 13.914 24.073 80 HH11 ARG 12 1HH1 ARG 12 33.403 13.776 24.975 81 HH12 ARG 12 2HH1 ARG 12 33.729 15.285 24.095 82 HH21 ARG 12 1HH2 ARG 12 30.645 15.796 22.796 83 HH22 ARG 12 2HH2 ARG 12 32.293 16.283 22.982 84 H1 CYS 13 H1 CYS 13 34.622 22.470 30.105 85 H2 CYS 13 H2 CYS 13 35.627 21.437 29.292 86 H3 CYS 13 H3 CYS 13 35.532 22.935 28.861 87 HA CYS 13 HA CYS 13 33.300 22.867 28.085 88 HB2 CYS 13 HB2 CYS 13 35.149 20.784 26.947 89 HB3 CYS 13 HB1 CYS 13 33.722 21.399 26.145 90 H GLY 14 H GLY 14 31.647 22.204 29.242 91 HA2 GLY 14 HA2 GLY 14 30.909 19.302 29.218 92 HA3 GLY 14 HA1 GLY 14 30.681 20.309 30.618 93 H THR 15 H THR 15 30.102 21.890 27.655 94 HA THR 15 HA THR 15 27.472 22.621 28.315 95 HB THR 15 HB THR 15 28.586 22.764 25.535 96 HG1 THR 15 HG1 THR 15 29.695 24.503 26.106 97 HG21 THR 15 1HG2 THR 15 27.484 24.969 25.517 98 HG22 THR 15 2HG2 THR 15 26.291 23.757 25.779 99 HG23 THR 15 3HG2 THR 15 26.869 24.668 27.199 100 HA PRO 16 HA PRO 16 25.321 19.305 26.044 101 HB2 PRO 16 HB1 PRO 16 22.745 20.464 25.900 102 HB3 PRO 16 HB2 PRO 16 23.365 19.626 27.333 103 HG2 PRO 16 HG1 PRO 16 23.265 22.525 26.857 104 HG3 PRO 16 HG2 PRO 16 22.942 21.629 28.353 105 HD2 PRO 16 HD1 PRO 16 25.346 22.921 27.851 106 HD3 PRO 16 HD2 PRO 16 25.272 21.464 28.882 107 H ILE 17 H ILE 17 25.616 19.075 24.035 108 HA ILE 17 HA ILE 17 25.994 21.268 22.176 109 HB ILE 17 HB ILE 17 26.094 18.283 21.705 110 HG12 ILE 17 2HG1 ILE 17 28.690 19.060 21.770 111 HG13 ILE 17 1HG1 ILE 17 28.056 20.201 22.901 112 HG21 ILE 17 1HG2 ILE 17 27.586 18.791 19.875 113 HG22 ILE 17 2HG2 ILE 17 25.951 19.443 19.618 114 HG23 ILE 17 3HG2 ILE 17 27.238 20.542 20.060 115 HD11 ILE 17 HD1 ILE 17 27.732 17.147 23.061 116 HD12 ILE 17 HD2 ILE 17 28.926 18.056 23.948 117 HD13 ILE 17 HD3 ILE 17 27.191 18.296 24.304 118 H SER 18 H SER 18 23.265 19.122 22.908 119 HA SER 18 HA SER 18 21.818 20.569 20.814 120 HB2 SER 18 HB2 SER 18 21.893 17.551 20.772 121 HB3 SER 18 HB1 SER 18 20.878 18.585 19.737 122 HG SER 18 HG SER 18 23.179 19.538 19.450 123 H PHE 19 H PHE 19 19.499 20.115 20.773 124 HA PHE 19 HA PHE 19 18.431 19.741 23.515 125 HB2 PHE 19 HB2 PHE 19 17.900 21.989 21.560 126 HB3 PHE 19 HB1 PHE 19 17.282 21.827 23.184 127 HD1 PHE 19 HD1 PHE 19 20.197 22.635 21.128 128 HD2 PHE 19 HD2 PHE 19 18.809 22.081 25.183 129 HE1 PHE 19 HE1 PHE 19 22.315 23.585 21.965 130 HE2 PHE 19 HE2 PHE 19 20.907 23.004 26.005 131 HZ PHE 19 HZ PHE 19 22.685 23.754 24.428 132 H TYR 20 H TYR 20 16.045 19.637 23.547 133 HA TYR 20 HA TYR 20 14.849 18.283 21.200 134 HB2 TYR 20 HB2 TYR 20 13.721 18.758 23.957 135 HB3 TYR 20 HB1 TYR 20 13.081 17.760 22.649 136 HD1 TYR 20 HD1 TYR 20 14.339 15.729 21.892 137 HD2 TYR 20 HD2 TYR 20 15.115 17.735 25.573 138 HE1 TYR 20 HE1 TYR 20 15.273 13.572 22.905 139 HE2 TYR 20 HE2 TYR 20 15.961 15.644 26.577 140 HH TYR 20 HH TYR 20 16.354 13.430 26.267 141 H CYS 21 H CYS 21 12.974 19.157 20.368 142 HA CYS 21 HA CYS 21 12.467 22.078 20.752 143 HB2 CYS 21 HB2 CYS 21 13.823 21.566 18.712 144 HB3 CYS 21 HB1 CYS 21 12.656 20.330 18.284 145 H GLY 22 H GLY 22 32.719 24.878 16.447 146 HA2 GLY 22 HA2 GLY 22 31.930 22.747 14.880 147 HA3 GLY 22 HA1 GLY 22 33.538 23.205 14.270 148 H GLY 23 H GLY 23 31.725 21.801 16.937 149 HA2 GLY 23 HA2 GLY 23 33.546 20.326 18.311 150 HA3 GLY 23 HA1 GLY 23 34.007 21.994 18.741 151 H ALA 24 H ALA 24 33.493 20.755 20.712 152 HA ALA 24 HA ALA 24 30.707 21.229 21.639 153 HB1 ALA 24 HB1 ALA 24 30.889 18.995 22.728 154 HB2 ALA 24 HB2 ALA 24 30.938 18.877 20.962 155 HB3 ALA 24 HB3 ALA 24 32.436 18.723 21.911 156 H GLY 25 H GLY 25 31.285 23.116 22.717 157 HA2 GLY 25 HA2 GLY 25 32.356 22.832 25.363 158 HA3 GLY 25 HA1 GLY 25 33.484 23.648 24.223 159 H HIS 26 H HIS 26 33.402 25.506 25.478 160 HA HIS 26 HA HIS 26 30.954 26.170 26.715 161 HB2 HIS 26 HB2 HIS 26 32.389 27.878 27.867 162 HB3 HIS 26 HB1 HIS 26 32.783 26.137 28.001 163 HD2 HIS 26 HD2 HIS 26 34.386 29.294 27.929 164 HE1 HIS 26 HE1 HIS 26 37.197 26.784 25.946 165 HE2 HIS 26 HE2 HIS 26 36.907 29.008 27.122 166 H VAL 27 H VAL 27 32.059 27.416 23.764 167 HA VAL 27 HA VAL 27 30.131 29.621 23.985 168 HB VAL 27 HB VAL 27 31.598 31.245 22.969 169 HG11 VAL 27 1HG1 VAL 27 33.072 31.730 24.721 170 HG12 VAL 27 2HG1 VAL 27 31.573 31.160 25.415 171 HG13 VAL 27 3HG1 VAL 27 32.985 30.076 25.404 172 HG21 VAL 27 1HG2 VAL 27 33.965 30.899 22.698 173 HG22 VAL 27 2HG2 VAL 27 33.816 29.180 23.205 174 HG23 VAL 27 3HG2 VAL 27 33.094 29.752 21.683 175 HA PRO 28 HA PRO 28 28.730 28.027 20.352 176 HB2 PRO 28 HB1 PRO 28 27.641 30.019 18.803 177 HB3 PRO 28 HB2 PRO 28 27.044 29.607 20.456 178 HG2 PRO 28 HG1 PRO 28 29.029 31.729 19.678 179 HG3 PRO 28 HG2 PRO 28 27.518 31.913 20.607 180 HD2 PRO 28 HD1 PRO 28 29.912 31.621 21.809 181 HD3 PRO 28 HD2 PRO 28 28.453 30.830 22.529 182 H GLU 29 H GLU 29 28.806 27.639 18.132 183 HA GLU 29 HA GLU 29 30.856 29.072 16.482 184 HB2 GLU 29 HB2 GLU 29 31.500 26.730 17.127 185 HB3 GLU 29 HB1 GLU 29 30.087 26.161 16.228 186 HG2 GLU 29 HG2 GLU 29 31.128 27.387 14.203 187 HG3 GLU 29 HG1 GLU 29 32.575 27.554 15.164 188 H TYR 30 H TYR 30 28.071 26.889 16.362 189 HA TYR 30 HA TYR 30 26.910 28.419 14.070 190 HB2 TYR 30 HB2 TYR 30 26.604 25.546 14.939 191 HB3 TYR 30 HB1 TYR 30 25.572 26.290 13.763 192 HD1 TYR 30 HD1 TYR 30 28.966 27.516 13.263 193 HD2 TYR 30 HD2 TYR 30 26.227 24.288 12.431 194 HE1 TYR 30 HE1 TYR 30 30.312 26.860 11.333 195 HE2 TYR 30 HE2 TYR 30 27.580 23.587 10.540 196 HH TYR 30 HH TYR 30 29.581 23.992 9.336 197 H PHE 31 H PHE 31 25.029 29.416 14.374 198 HA PHE 31 HA PHE 31 23.567 29.059 16.896 199 HB2 PHE 31 HB2 PHE 31 24.913 31.035 16.863 200 HB3 PHE 31 HB1 PHE 31 24.223 31.555 15.335 201 HD1 PHE 31 HD1 PHE 31 22.847 33.363 15.514 202 HD2 PHE 31 HD2 PHE 31 22.879 30.467 18.686 203 HE1 PHE 31 HE1 PHE 31 21.325 34.796 16.851 204 HE2 PHE 31 HE2 PHE 31 21.261 31.814 19.953 205 HZ PHE 31 HZ PHE 31 20.519 34.018 19.081 206 H VAL 32 H VAL 32 23.240 29.179 13.476 207 HA VAL 32 HA VAL 32 20.270 28.922 13.608 208 HB VAL 32 HB VAL 32 21.720 30.737 11.710 209 HG11 VAL 32 1HG1 VAL 32 19.492 31.296 10.913 210 HG12 VAL 32 2HG1 VAL 32 19.772 29.580 10.693 211 HG13 VAL 32 3HG1 VAL 32 18.744 30.132 12.059 212 HG21 VAL 32 1HG2 VAL 32 20.231 32.492 12.808 213 HG22 VAL 32 2HG2 VAL 32 19.874 31.302 14.040 214 HG23 VAL 32 3HG2 VAL 32 21.549 31.861 13.823 215 H ARG 33 H ARG 33 19.612 27.248 12.564 216 HA ARG 33 HA ARG 33 20.905 26.342 10.077 217 HB2 ARG 33 HB2 ARG 33 20.975 24.168 10.619 218 HB3 ARG 33 HB1 ARG 33 21.566 24.875 12.096 219 HG2 ARG 33 HG2 ARG 33 20.198 23.227 12.897 220 HG3 ARG 33 HG1 ARG 33 19.330 24.719 13.096 221 HD2 ARG 33 HD2 ARG 33 17.891 22.769 12.298 222 HD3 ARG 33 HD1 ARG 33 17.788 24.179 11.293 223 HE ARG 33 HE ARG 33 19.828 22.428 10.213 224 HH11 ARG 33 1HH1 ARG 33 16.253 22.576 10.500 225 HH12 ARG 33 2HH1 ARG 33 16.104 21.706 8.967 226 HH21 ARG 33 1HH2 ARG 33 19.428 21.138 8.392 227 HH22 ARG 33 2HH2 ARG 33 17.742 20.887 7.955 228 H1 CYS 34 H1 CYS 34 12.530 28.344 18.210 229 H2 CYS 34 H2 CYS 34 12.192 27.211 17.073 230 H3 CYS 34 H3 CYS 34 11.704 27.007 18.617 231 HA CYS 34 HA CYS 34 13.858 26.754 19.423 232 HB2 CYS 34 HB2 CYS 34 13.423 25.053 16.919 233 HB3 CYS 34 HB1 CYS 34 14.493 24.634 18.275 234 H GLY 35 H GLY 35 15.284 28.387 19.314 235 HA2 GLY 35 HA2 GLY 35 16.862 28.802 16.852 236 HA3 GLY 35 HA1 GLY 35 16.205 30.103 17.747 237 H THR 36 H THR 36 18.710 27.674 17.781 238 HA THR 36 HA THR 36 19.766 28.588 20.408 239 HB THR 36 HB THR 36 19.294 25.728 19.595 240 HG1 THR 36 HG1 THR 36 17.655 27.341 21.269 241 HG21 THR 36 1HG2 THR 36 19.335 25.264 21.960 242 HG22 THR 36 2HG2 THR 36 20.851 26.060 21.504 243 HG23 THR 36 3HG2 THR 36 19.593 26.982 22.368 244 HA PRO 37 HA PRO 37 23.446 27.276 17.972 245 HB2 PRO 37 HB1 PRO 37 25.495 27.593 19.768 246 HB3 PRO 37 HB2 PRO 37 24.685 28.912 18.915 247 HG2 PRO 37 HG1 PRO 37 24.277 27.937 21.749 248 HG3 PRO 37 HG2 PRO 37 24.307 29.590 21.171 249 HD2 PRO 37 HD1 PRO 37 21.968 28.125 21.626 250 HD3 PRO 37 HD2 PRO 37 22.081 29.561 20.568 251 H ILE 38 H ILE 38 24.405 25.503 17.587 252 HA ILE 38 HA ILE 38 24.140 23.210 19.524 253 HB ILE 38 HB ILE 38 23.766 23.313 16.559 254 HG12 ILE 38 2HG1 ILE 38 21.823 21.923 17.028 255 HG13 ILE 38 1HG1 ILE 38 22.214 21.932 18.764 256 HG21 ILE 38 1HG2 ILE 38 23.619 20.803 16.570 257 HG22 ILE 38 2HG2 ILE 38 25.211 21.446 16.683 258 HG23 ILE 38 3HG2 ILE 38 24.454 20.775 18.139 259 HD11 ILE 38 HD1 ILE 38 20.336 23.449 17.867 260 HD12 ILE 38 HD2 ILE 38 21.492 24.211 18.972 261 HD13 ILE 38 HD3 ILE 38 21.632 24.479 17.228 262 H SER 39 H SER 39 26.135 23.623 16.474 263 HA SER 39 HA SER 39 28.399 22.540 17.902 264 HB2 SER 39 HB2 SER 39 28.218 24.081 15.297 265 HB3 SER 39 HB1 SER 39 29.685 23.309 15.948 266 HG SER 39 HG SER 39 28.788 21.355 15.659 267 H PHE 40 H PHE 40 30.180 23.431 18.758 268 HA PHE 40 HA PHE 40 30.126 26.248 19.605 269 HB2 PHE 40 HB2 PHE 40 30.859 23.712 21.076 270 HB3 PHE 40 HB1 PHE 40 30.805 25.334 21.758 271 HD1 PHE 40 HD1 PHE 40 28.105 26.131 20.318 272 HD2 PHE 40 HD2 PHE 40 29.381 22.752 22.661 273 HE1 PHE 40 HE1 PHE 40 25.776 25.856 21.338 274 HE2 PHE 40 HE2 PHE 40 27.216 22.546 23.637 275 HZ PHE 40 HZ PHE 40 25.350 24.086 22.924 276 H TYR 41 H TYR 41 32.244 26.777 20.672 277 HA TYR 41 HA TYR 41 34.643 25.631 19.365 278 HB2 TYR 41 HB2 TYR 41 34.522 27.961 21.271 279 HB3 TYR 41 HB1 TYR 41 35.940 27.335 20.435 280 HD1 TYR 41 HD1 TYR 41 35.536 30.094 20.555 281 HD2 TYR 41 HD2 TYR 41 34.086 27.306 17.652 282 HE1 TYR 41 HE1 TYR 41 35.143 31.942 18.906 283 HE2 TYR 41 HE2 TYR 41 33.747 29.151 16.008 284 HH TYR 41 HH TYR 41 34.112 31.255 15.573 285 H CYS 42 H CYS 42 36.389 24.946 20.933 286 HA CYS 42 HA CYS 42 35.708 24.892 23.715 287 HB2 CYS 42 HB2 CYS 42 34.758 22.758 22.909 288 HB3 CYS 42 HB1 CYS 42 36.314 22.332 22.184 Start of MODEL 3 1 H GLY 1 H GLY 1 18.301 16.958 20.213 2 HA2 GLY 1 HA2 GLY 1 19.954 16.158 18.183 3 HA3 GLY 1 HA1 GLY 1 18.537 15.393 17.773 4 H GLY 2 H GLY 2 17.194 18.155 19.012 5 HA2 GLY 2 HA2 GLY 2 17.180 19.594 16.450 6 HA3 GLY 2 HA1 GLY 2 15.964 19.740 17.704 7 H ALA 3 H ALA 3 16.285 21.999 17.299 8 HA ALA 3 HA ALA 3 18.570 23.232 18.771 9 HB1 ALA 3 HB1 ALA 3 18.399 25.025 17.177 10 HB2 ALA 3 HB2 ALA 3 18.720 23.498 16.354 11 HB3 ALA 3 HB3 ALA 3 17.068 24.161 16.308 12 H GLY 4 H GLY 4 15.907 22.434 19.679 13 HA2 GLY 4 HA2 GLY 4 14.381 24.706 20.632 14 HA3 GLY 4 HA1 GLY 4 14.281 23.022 21.133 15 H HIS 5 H HIS 5 14.045 23.753 23.127 16 HA HIS 5 HA HIS 5 16.146 25.351 24.467 17 HB2 HIS 5 HB2 HIS 5 14.260 26.314 25.688 18 HB3 HIS 5 HB1 HIS 5 14.134 26.487 23.918 19 HD2 HIS 5 HD2 HIS 5 12.549 24.305 26.773 20 HE1 HIS 5 HE1 HIS 5 10.137 23.857 23.314 21 HE2 HIS 5 HE2 HIS 5 10.389 23.297 25.784 22 H VAL 6 H VAL 6 15.108 22.204 24.751 23 HA VAL 6 HA VAL 6 16.338 22.133 27.394 24 HB VAL 6 HB VAL 6 15.058 20.103 27.978 25 HG11 VAL 6 1HG1 VAL 6 13.371 21.379 29.150 26 HG12 VAL 6 2HG1 VAL 6 14.814 22.263 29.151 27 HG13 VAL 6 3HG1 VAL 6 13.514 22.701 27.944 28 HG21 VAL 6 1HG2 VAL 6 12.777 19.853 27.128 29 HG22 VAL 6 2HG2 VAL 6 12.957 21.211 26.065 30 HG23 VAL 6 3HG2 VAL 6 13.859 19.702 25.802 31 HA PRO 7 HA PRO 7 19.090 19.978 25.153 32 HB2 PRO 7 HB1 PRO 7 20.768 18.767 26.957 33 HB3 PRO 7 HB2 PRO 7 20.537 20.535 26.846 34 HG2 PRO 7 HG1 PRO 7 19.108 18.654 28.731 35 HG3 PRO 7 HG2 PRO 7 20.009 20.144 29.144 36 HD2 PRO 7 HD1 PRO 7 17.303 20.097 28.754 37 HD3 PRO 7 HD2 PRO 7 18.315 21.469 28.164 38 H GLU 8 H GLU 8 19.580 18.208 23.926 39 HA GLU 8 HA GLU 8 18.345 15.658 24.655 40 HB2 GLU 8 HB2 GLU 8 17.628 16.782 22.475 41 HB3 GLU 8 HB1 GLU 8 19.347 16.853 22.009 42 HG2 GLU 8 HG2 GLU 8 19.316 14.309 22.170 43 HG3 GLU 8 HG1 GLU 8 17.549 14.426 22.147 44 H TYR 9 H TYR 9 21.402 17.147 23.637 45 HA TYR 9 HA TYR 9 22.836 14.598 24.340 46 HB2 TYR 9 HB2 TYR 9 23.322 16.181 21.854 47 HB3 TYR 9 HB1 TYR 9 24.340 14.934 22.513 48 HD1 TYR 9 HD1 TYR 9 22.416 15.406 19.891 49 HD2 TYR 9 HD2 TYR 9 22.732 12.677 23.226 50 HE1 TYR 9 HE1 TYR 9 21.560 13.604 18.466 51 HE2 TYR 9 HE2 TYR 9 21.822 10.870 21.772 52 HH TYR 9 HH TYR 9 21.339 10.298 19.628 53 H PHE 10 H PHE 10 23.412 15.476 26.329 54 HA PHE 10 HA PHE 10 25.123 17.723 26.637 55 HB2 PHE 10 HB2 PHE 10 23.925 16.199 28.328 56 HB3 PHE 10 HB1 PHE 10 25.345 15.201 28.300 57 HD1 PHE 10 HD1 PHE 10 27.619 16.466 28.743 58 HD2 PHE 10 HD2 PHE 10 23.784 18.111 29.627 59 HE1 PHE 10 HE1 PHE 10 28.698 18.157 30.187 60 HE2 PHE 10 HE2 PHE 10 24.885 19.820 31.102 61 HZ PHE 10 HZ PHE 10 27.301 19.847 31.411 62 H VAL 11 H VAL 11 25.769 14.496 25.462 63 HA VAL 11 HA VAL 11 28.708 15.013 25.319 64 HB VAL 11 HB VAL 11 27.439 12.310 25.301 65 HG11 VAL 11 1HG1 VAL 11 29.709 11.710 26.184 66 HG12 VAL 11 2HG1 VAL 11 29.695 12.399 24.551 67 HG13 VAL 11 3HG1 VAL 11 30.176 13.398 25.935 68 HG21 VAL 11 1HG2 VAL 11 27.823 12.067 27.661 69 HG22 VAL 11 2HG2 VAL 11 28.299 13.784 27.828 70 HG23 VAL 11 3HG2 VAL 11 26.679 13.387 27.406 71 H ARG 12 H ARG 12 29.846 14.596 23.489 72 HA ARG 12 HA ARG 12 28.253 13.921 21.042 73 HB2 ARG 12 HB2 ARG 12 29.974 14.762 19.682 74 HB3 ARG 12 HB1 ARG 12 29.243 15.930 20.691 75 HG2 ARG 12 HG2 ARG 12 31.646 16.358 20.556 76 HG3 ARG 12 HG1 ARG 12 31.207 15.986 22.187 77 HD2 ARG 12 HD2 ARG 12 33.354 14.971 21.439 78 HD3 ARG 12 HD1 ARG 12 32.189 13.809 22.074 79 HE ARG 12 HE ARG 12 31.778 12.997 19.964 80 HH11 ARG 12 1HH1 ARG 12 34.143 15.665 19.585 81 HH12 ARG 12 2HH1 ARG 12 34.588 15.168 17.977 82 HH21 ARG 12 1HH2 ARG 12 32.545 12.371 17.898 83 HH22 ARG 12 2HH2 ARG 12 33.786 13.282 17.090 84 H1 CYS 13 H1 CYS 13 35.354 21.311 29.883 85 H2 CYS 13 H2 CYS 13 36.246 20.364 28.931 86 H3 CYS 13 H3 CYS 13 36.524 21.996 28.892 87 HA CYS 13 HA CYS 13 34.334 22.351 28.036 88 HB2 CYS 13 HB2 CYS 13 35.939 20.322 26.493 89 HB3 CYS 13 HB1 CYS 13 34.589 21.336 25.817 90 H GLY 14 H GLY 14 32.241 21.587 27.960 91 HA2 GLY 14 HA2 GLY 14 31.428 18.895 27.447 92 HA3 GLY 14 HA1 GLY 14 31.552 19.110 29.177 93 H THR 15 H THR 15 29.717 19.972 26.371 94 HA THR 15 HA THR 15 27.696 21.442 27.955 95 HB THR 15 HB THR 15 27.726 23.081 25.847 96 HG1 THR 15 HG1 THR 15 30.092 23.373 25.538 97 HG21 THR 15 1HG2 THR 15 29.103 24.622 27.118 98 HG22 THR 15 2HG2 THR 15 28.151 23.645 28.234 99 HG23 THR 15 3HG2 THR 15 29.833 23.262 28.045 100 HA PRO 16 HA PRO 16 25.110 19.173 25.204 101 HB2 PRO 16 HB1 PRO 16 22.655 20.488 25.553 102 HB3 PRO 16 HB2 PRO 16 23.426 19.320 26.684 103 HG2 PRO 16 HG1 PRO 16 23.602 22.361 26.854 104 HG3 PRO 16 HG2 PRO 16 23.155 21.159 28.105 105 HD2 PRO 16 HD1 PRO 16 25.692 22.169 27.767 106 HD3 PRO 16 HD2 PRO 16 25.461 20.513 28.294 107 H ILE 17 H ILE 17 25.759 19.458 23.142 108 HA ILE 17 HA ILE 17 25.729 21.896 21.627 109 HB ILE 17 HB ILE 17 25.947 18.988 20.859 110 HG12 ILE 17 2HG1 ILE 17 28.179 21.039 21.061 111 HG13 ILE 17 1HG1 ILE 17 27.699 20.036 22.414 112 HG21 ILE 17 1HG2 ILE 17 26.994 19.813 18.747 113 HG22 ILE 17 2HG2 ILE 17 25.290 20.133 18.859 114 HG23 ILE 17 3HG2 ILE 17 26.408 21.450 19.214 115 HD11 ILE 17 HD1 ILE 17 28.878 19.153 19.810 116 HD12 ILE 17 HD2 ILE 17 29.528 18.855 21.424 117 HD13 ILE 17 HD3 ILE 17 28.051 18.001 20.883 118 H SER 18 H SER 18 23.338 19.326 22.197 119 HA SER 18 HA SER 18 21.575 20.380 20.023 120 HB2 SER 18 HB2 SER 18 21.639 17.501 20.830 121 HB3 SER 18 HB1 SER 18 21.060 18.242 19.353 122 HG SER 18 HG SER 18 23.178 18.450 18.625 123 H PHE 19 H PHE 19 19.431 20.332 20.423 124 HA PHE 19 HA PHE 19 18.530 19.904 23.219 125 HB2 PHE 19 HB2 PHE 19 17.795 22.016 21.167 126 HB3 PHE 19 HB1 PHE 19 17.004 21.821 22.728 127 HD1 PHE 19 HD1 PHE 19 18.027 22.595 24.741 128 HD2 PHE 19 HD2 PHE 19 20.098 22.818 21.001 129 HE1 PHE 19 HE1 PHE 19 19.768 24.090 25.761 130 HE2 PHE 19 HE2 PHE 19 21.880 24.240 22.046 131 HZ PHE 19 HZ PHE 19 21.670 24.858 24.445 132 H TYR 20 H TYR 20 15.953 19.799 23.084 133 HA TYR 20 HA TYR 20 15.022 17.984 20.963 134 HB2 TYR 20 HB2 TYR 20 13.763 19.216 23.463 135 HB3 TYR 20 HB1 TYR 20 12.827 18.346 22.303 136 HD1 TYR 20 HD1 TYR 20 13.276 16.023 21.744 137 HD2 TYR 20 HD2 TYR 20 15.275 17.976 25.043 138 HE1 TYR 20 HE1 TYR 20 13.865 13.823 22.732 139 HE2 TYR 20 HE2 TYR 20 15.792 15.845 26.047 140 HH TYR 20 HH TYR 20 15.298 13.502 25.956 141 H CYS 21 H CYS 21 12.415 19.138 20.711 142 HA CYS 21 HA CYS 21 12.755 21.949 20.268 143 HB2 CYS 21 HB1 CYS 21 13.243 21.186 18.055 144 HB3 CYS 21 HB2 CYS 21 11.742 20.214 17.980 145 H GLY 22 H GLY 22 32.262 24.288 16.732 146 HA2 GLY 22 HA2 GLY 22 31.097 22.108 15.345 147 HA3 GLY 22 HA1 GLY 22 32.770 22.283 14.845 148 H GLY 23 H GLY 23 30.671 20.902 17.110 149 HA2 GLY 23 HA2 GLY 23 31.186 19.269 18.641 150 HA3 GLY 23 HA1 GLY 23 32.873 19.860 18.813 151 H ALA 24 H ALA 24 32.574 19.416 21.029 152 HA ALA 24 HA ALA 24 30.731 20.952 22.645 153 HB1 ALA 24 HB1 ALA 24 32.052 19.880 24.470 154 HB2 ALA 24 HB2 ALA 24 31.489 18.689 23.283 155 HB3 ALA 24 HB3 ALA 24 33.178 19.171 23.293 156 H GLY 25 H GLY 25 31.716 22.270 24.531 157 HA2 GLY 25 HA2 GLY 25 34.058 23.440 24.877 158 HA3 GLY 25 HA1 GLY 25 33.617 24.177 23.337 159 H HIS 26 H HIS 26 33.876 26.193 24.596 160 HA HIS 26 HA HIS 26 31.883 26.625 26.660 161 HB2 HIS 26 HB2 HIS 26 33.662 28.895 26.189 162 HB3 HIS 26 HB1 HIS 26 33.418 27.926 27.619 163 HD2 HIS 26 HD2 HIS 26 35.612 28.293 24.510 164 HE1 HIS 26 HE1 HIS 26 37.426 25.319 27.007 165 HE2 HIS 26 HE2 HIS 26 37.716 26.640 24.892 166 H VAL 27 H VAL 27 32.880 28.209 23.679 167 HA VAL 27 HA VAL 27 30.541 30.073 23.691 168 HB VAL 27 HB VAL 27 32.003 31.560 22.387 169 HG11 VAL 27 1HG1 VAL 27 33.078 32.502 24.397 170 HG12 VAL 27 2HG1 VAL 27 31.432 32.036 24.692 171 HG13 VAL 27 3HG1 VAL 27 32.797 30.978 25.269 172 HG21 VAL 27 1HG2 VAL 27 34.437 31.471 22.706 173 HG22 VAL 27 2HG2 VAL 27 34.343 29.912 23.484 174 HG23 VAL 27 3HG2 VAL 27 33.845 30.064 21.798 175 HA PRO 28 HA PRO 28 29.108 28.040 20.376 176 HB2 PRO 28 HB1 PRO 28 27.360 29.804 19.121 177 HB3 PRO 28 HB2 PRO 28 27.222 29.020 20.732 178 HG2 PRO 28 HG1 PRO 28 28.388 31.794 20.030 179 HG3 PRO 28 HG2 PRO 28 27.042 31.378 21.177 180 HD2 PRO 28 HD1 PRO 28 29.691 31.669 21.960 181 HD3 PRO 28 HD2 PRO 28 28.629 30.477 22.740 182 H GLU 29 H GLU 29 29.700 27.353 18.564 183 HA GLU 29 HA GLU 29 31.383 28.628 16.540 184 HB2 GLU 29 HB2 GLU 29 31.386 26.177 17.310 185 HB3 GLU 29 HB1 GLU 29 29.843 26.054 16.476 186 HG2 GLU 29 HG2 GLU 29 30.999 26.734 14.407 187 HG3 GLU 29 HG1 GLU 29 32.555 26.704 15.243 188 H TYR 30 H TYR 30 27.986 28.144 17.028 189 HA TYR 30 HA TYR 30 27.225 29.689 14.661 190 HB2 TYR 30 HB2 TYR 30 26.472 26.776 15.044 191 HB3 TYR 30 HB1 TYR 30 25.525 27.844 14.056 192 HD1 TYR 30 HD1 TYR 30 26.554 29.036 12.046 193 HD2 TYR 30 HD2 TYR 30 28.387 25.716 14.041 194 HE1 TYR 30 HE1 TYR 30 27.799 28.491 10.006 195 HE2 TYR 30 HE2 TYR 30 29.766 25.236 12.070 196 HH TYR 30 HH TYR 30 30.418 26.059 9.933 197 H PHE 31 H PHE 31 25.212 30.581 14.810 198 HA PHE 31 HA PHE 31 23.871 30.395 17.461 199 HB2 PHE 31 HB2 PHE 31 25.042 32.474 16.825 200 HB3 PHE 31 HB1 PHE 31 23.942 32.687 15.475 201 HD1 PHE 31 HD1 PHE 31 21.818 33.849 15.862 202 HD2 PHE 31 HD2 PHE 31 24.182 32.424 19.155 203 HE1 PHE 31 HE1 PHE 31 20.500 35.238 17.407 204 HE2 PHE 31 HE2 PHE 31 22.716 33.665 20.731 205 HZ PHE 31 HZ PHE 31 20.899 35.069 19.893 206 H VAL 32 H VAL 32 23.288 30.528 14.007 207 HA VAL 32 HA VAL 32 20.520 29.517 14.280 208 HB VAL 32 HB VAL 32 20.499 31.995 14.466 209 HG11 VAL 32 1HG1 VAL 32 20.997 33.347 12.539 210 HG12 VAL 32 2HG1 VAL 32 22.456 32.537 13.052 211 HG13 VAL 32 3HG1 VAL 32 21.640 31.990 11.602 212 HG21 VAL 32 1HG2 VAL 32 18.678 32.400 13.239 213 HG22 VAL 32 2HG2 VAL 32 19.141 31.409 11.849 214 HG23 VAL 32 3HG2 VAL 32 18.580 30.660 13.359 215 H ARG 33 H ARG 33 19.574 29.400 12.026 216 HA ARG 33 HA ARG 33 21.430 29.009 9.790 217 HB2 ARG 33 HB2 ARG 33 20.522 27.010 9.017 218 HB3 ARG 33 HB1 ARG 33 21.263 26.785 10.577 219 HG2 ARG 33 HG2 ARG 33 18.750 27.071 11.457 220 HG3 ARG 33 HG1 ARG 33 18.345 26.827 9.724 221 HD2 ARG 33 HD2 ARG 33 18.158 24.780 10.907 222 HD3 ARG 33 HD1 ARG 33 19.514 24.650 9.737 223 HE ARG 33 HE ARG 33 21.094 24.601 11.488 224 HH11 ARG 33 1HH1 ARG 33 17.995 24.643 13.043 225 HH12 ARG 33 2HH1 ARG 33 18.620 25.356 14.538 226 HH21 ARG 33 1HH2 ARG 33 21.881 25.101 13.478 227 HH22 ARG 33 2HH2 ARG 33 20.782 25.516 14.801 228 H1 CYS 34 H1 CYS 34 12.087 28.229 19.212 229 H2 CYS 34 H2 CYS 34 11.560 27.677 17.764 230 H3 CYS 34 H3 CYS 34 11.164 26.905 19.149 231 HA CYS 34 HA CYS 34 13.526 26.426 19.527 232 HB2 CYS 34 HB2 CYS 34 12.395 25.338 16.910 233 HB3 CYS 34 HB1 CYS 34 13.785 24.686 17.770 234 H GLY 35 H GLY 35 15.045 27.972 19.492 235 HA2 GLY 35 HA2 GLY 35 16.565 28.542 17.150 236 HA3 GLY 35 HA1 GLY 35 15.706 29.961 17.761 237 H THR 36 H THR 36 18.083 27.495 18.736 238 HA THR 36 HA THR 36 19.127 29.324 20.818 239 HB THR 36 HB THR 36 19.019 26.263 20.840 240 HG1 THR 36 HG1 THR 36 17.352 26.287 22.012 241 HG21 THR 36 1HG2 THR 36 19.314 26.434 23.233 242 HG22 THR 36 2HG2 THR 36 20.694 27.116 22.392 243 HG23 THR 36 3HG2 THR 36 19.432 28.185 23.162 244 HA PRO 37 HA PRO 37 22.904 28.609 18.613 245 HB2 PRO 37 HB1 PRO 37 24.771 28.941 20.745 246 HB3 PRO 37 HB2 PRO 37 23.988 30.227 19.794 247 HG2 PRO 37 HG1 PRO 37 23.106 29.028 22.440 248 HG3 PRO 37 HG2 PRO 37 23.296 30.777 21.990 249 HD2 PRO 37 HD1 PRO 37 20.858 29.637 21.932 250 HD3 PRO 37 HD2 PRO 37 21.418 30.685 20.599 251 H ILE 38 H ILE 38 24.537 27.051 18.358 252 HA ILE 38 HA ILE 38 23.609 24.482 19.474 253 HB ILE 38 HB ILE 38 24.797 24.677 16.712 254 HG12 ILE 38 2HG1 ILE 38 22.296 24.659 16.034 255 HG13 ILE 38 1HG1 ILE 38 22.020 25.444 17.579 256 HG21 ILE 38 1HG2 ILE 38 23.384 22.717 16.392 257 HG22 ILE 38 2HG2 ILE 38 24.400 22.477 17.849 258 HG23 ILE 38 3HG2 ILE 38 22.692 22.872 17.974 259 HD11 ILE 38 HD1 ILE 38 22.258 27.034 15.588 260 HD12 ILE 38 HD2 ILE 38 23.526 27.334 16.781 261 HD13 ILE 38 HD3 ILE 38 23.870 26.404 15.342 262 H SER 39 H SER 39 26.387 24.343 17.358 263 HA SER 39 HA SER 39 27.921 22.995 19.369 264 HB2 SER 39 HB2 SER 39 28.716 23.984 16.611 265 HB3 SER 39 HB1 SER 39 29.694 22.898 17.635 266 HG SER 39 HG SER 39 28.511 21.488 16.457 267 H PHE 40 H PHE 40 30.233 23.480 19.654 268 HA PHE 40 HA PHE 40 30.977 26.319 19.986 269 HB2 PHE 40 HB2 PHE 40 31.522 24.088 21.948 270 HB3 PHE 40 HB1 PHE 40 31.789 25.809 22.197 271 HD1 PHE 40 HD1 PHE 40 29.306 23.066 22.087 272 HD2 PHE 40 HD2 PHE 40 30.065 27.127 23.165 273 HE1 PHE 40 HE1 PHE 40 27.210 23.126 23.439 274 HE2 PHE 40 HE2 PHE 40 28.071 27.152 24.612 275 HZ PHE 40 HZ PHE 40 26.609 25.129 24.732 276 H TYR 41 H TYR 41 33.527 26.049 20.873 277 HA TYR 41 HA TYR 41 34.768 24.502 18.652 278 HB2 TYR 41 HB2 TYR 41 35.998 26.804 20.156 279 HB3 TYR 41 HB1 TYR 41 36.594 26.127 18.697 280 HD1 TYR 41 HD1 TYR 41 35.241 26.520 16.569 281 HD2 TYR 41 HD2 TYR 41 34.548 28.653 20.244 282 HE1 TYR 41 HE1 TYR 41 34.241 28.346 15.316 283 HE2 TYR 41 HE2 TYR 41 33.323 30.410 19.023 284 HH TYR 41 HH TYR 41 33.035 30.405 15.468 285 H CYS 42 H CYS 42 35.294 25.459 21.938 286 HA CYS 42 HA CYS 42 36.291 24.648 23.756 287 HB2 CYS 42 HB2 CYS 42 35.481 22.397 23.304 288 HB3 CYS 42 HB1 CYS 42 36.837 22.143 22.213 Start of MODEL 4 1 H GLY 1 H GLY 1 17.255 17.278 19.812 2 HA2 GLY 1 HA2 GLY 1 17.202 15.573 17.573 3 HA3 GLY 1 HA1 GLY 1 15.554 15.715 18.138 4 H GLY 2 H GLY 2 17.553 18.625 18.488 5 HA2 GLY 2 HA2 GLY 2 17.144 19.808 15.987 6 HA3 GLY 2 HA1 GLY 2 15.793 20.175 17.095 7 H ALA 3 H ALA 3 16.178 22.219 17.369 8 HA ALA 3 HA ALA 3 18.563 23.173 18.856 9 HB1 ALA 3 HB1 ALA 3 18.896 25.049 17.309 10 HB2 ALA 3 HB2 ALA 3 19.115 23.441 16.493 11 HB3 ALA 3 HB3 ALA 3 17.652 24.345 16.253 12 H GLY 4 H GLY 4 16.618 22.831 20.252 13 HA2 GLY 4 HA2 GLY 4 14.858 25.200 20.544 14 HA3 GLY 4 HA1 GLY 4 14.459 23.585 21.066 15 H HIS 5 H HIS 5 14.007 24.286 23.066 16 HA HIS 5 HA HIS 5 15.877 25.964 24.575 17 HB2 HIS 5 HB2 HIS 5 13.848 26.307 25.987 18 HB3 HIS 5 HB1 HIS 5 13.768 26.887 24.317 19 HD2 HIS 5 HD2 HIS 5 12.181 24.370 26.695 20 HE1 HIS 5 HE1 HIS 5 9.989 24.205 23.033 21 HE2 HIS 5 HE2 HIS 5 10.081 23.402 25.439 22 H VAL 6 H VAL 6 15.271 22.641 24.696 23 HA VAL 6 HA VAL 6 16.621 22.540 27.288 24 HB VAL 6 HB VAL 6 15.325 20.422 27.850 25 HG11 VAL 6 1HG1 VAL 6 13.357 21.441 28.697 26 HG12 VAL 6 2HG1 VAL 6 14.814 22.356 29.054 27 HG13 VAL 6 3HG1 VAL 6 13.654 22.926 27.778 28 HG21 VAL 6 1HG2 VAL 6 13.176 20.018 26.884 29 HG22 VAL 6 2HG2 VAL 6 13.414 21.243 25.657 30 HG23 VAL 6 3HG2 VAL 6 14.473 19.821 25.702 31 HA PRO 7 HA PRO 7 19.244 20.277 24.833 32 HB2 PRO 7 HB1 PRO 7 20.642 18.607 26.546 33 HB3 PRO 7 HB2 PRO 7 20.757 20.388 26.599 34 HG2 PRO 7 HG1 PRO 7 19.001 18.602 28.274 35 HG3 PRO 7 HG2 PRO 7 20.045 19.900 28.880 36 HD2 PRO 7 HD1 PRO 7 17.456 20.350 28.486 37 HD3 PRO 7 HD2 PRO 7 18.654 21.587 27.966 38 H GLU 8 H GLU 8 19.732 18.406 23.720 39 HA GLU 8 HA GLU 8 18.056 16.018 24.249 40 HB2 GLU 8 HB2 GLU 8 17.188 17.185 22.355 41 HB3 GLU 8 HB1 GLU 8 18.808 17.294 21.620 42 HG2 GLU 8 HG2 GLU 8 18.894 14.915 21.242 43 HG3 GLU 8 HG1 GLU 8 17.493 14.643 22.247 44 H TYR 9 H TYR 9 21.207 17.186 22.938 45 HA TYR 9 HA TYR 9 22.328 14.456 23.344 46 HB2 TYR 9 HB2 TYR 9 22.607 16.267 20.972 47 HB3 TYR 9 HB1 TYR 9 23.879 15.184 21.432 48 HD1 TYR 9 HD1 TYR 9 23.077 12.679 21.903 49 HD2 TYR 9 HD2 TYR 9 20.976 15.497 19.405 50 HE1 TYR 9 HE1 TYR 9 21.920 10.819 20.751 51 HE2 TYR 9 HE2 TYR 9 19.828 13.705 18.299 52 HH TYR 9 HH TYR 9 19.387 11.476 18.330 53 H PHE 10 H PHE 10 23.642 14.643 25.040 54 HA PHE 10 HA PHE 10 24.887 17.206 25.692 55 HB2 PHE 10 HB2 PHE 10 23.181 15.913 27.080 56 HB3 PHE 10 HB1 PHE 10 24.397 14.690 27.323 57 HD1 PHE 10 HD1 PHE 10 25.487 14.809 29.430 58 HD2 PHE 10 HD2 PHE 10 24.173 18.435 27.485 59 HE1 PHE 10 HE1 PHE 10 26.030 16.075 31.433 60 HE2 PHE 10 HE2 PHE 10 24.787 19.723 29.491 61 HZ PHE 10 HZ PHE 10 25.762 18.532 31.486 62 H VAL 11 H VAL 11 26.909 16.567 27.414 63 HA VAL 11 HA VAL 11 29.070 15.480 25.872 64 HB VAL 11 HB VAL 11 29.539 17.174 27.339 65 HG11 VAL 11 1HG1 VAL 11 29.267 17.230 29.730 66 HG12 VAL 11 2HG1 VAL 11 27.754 17.176 28.880 67 HG13 VAL 11 3HG1 VAL 11 28.332 15.688 29.680 68 HG21 VAL 11 1HG2 VAL 11 31.335 16.365 28.684 69 HG22 VAL 11 2HG2 VAL 11 30.630 14.751 28.789 70 HG23 VAL 11 3HG2 VAL 11 31.251 15.323 27.244 71 H ARG 12 H ARG 12 28.800 13.556 25.174 72 HA ARG 12 HA ARG 12 27.257 11.637 26.445 73 HB2 ARG 12 HB2 ARG 12 28.125 9.972 24.723 74 HB3 ARG 12 HB1 ARG 12 27.089 11.335 24.294 75 HG2 ARG 12 HG2 ARG 12 28.750 10.919 22.623 76 HG3 ARG 12 HG1 ARG 12 28.921 12.525 23.343 77 HD2 ARG 12 HD2 ARG 12 31.044 11.538 22.874 78 HD3 ARG 12 HD1 ARG 12 30.861 11.752 24.603 79 HE ARG 12 HE ARG 12 30.146 9.158 24.404 80 HH11 ARG 12 1HH1 ARG 12 32.979 10.665 22.829 81 HH12 ARG 12 2HH1 ARG 12 33.682 9.034 22.655 82 HH21 ARG 12 1HH2 ARG 12 31.183 7.296 24.153 83 HH22 ARG 12 2HH2 ARG 12 32.771 7.264 23.331 84 H1 CYS 13 H1 CYS 13 35.439 20.934 29.176 85 H2 CYS 13 H2 CYS 13 35.802 19.883 28.020 86 H3 CYS 13 H3 CYS 13 36.326 21.447 27.870 87 HA CYS 13 HA CYS 13 33.970 22.123 27.828 88 HB2 CYS 13 HB2 CYS 13 34.716 20.085 25.675 89 HB3 CYS 13 HB1 CYS 13 33.438 21.207 25.532 90 H GLY 14 H GLY 14 31.820 21.604 28.316 91 HA2 GLY 14 HA2 GLY 14 31.013 18.803 28.425 92 HA3 GLY 14 HA1 GLY 14 30.887 19.807 29.909 93 H THR 15 H THR 15 29.510 19.062 26.837 94 HA THR 15 HA THR 15 28.048 21.621 26.725 95 HB THR 15 HB THR 15 29.079 19.783 24.561 96 HG1 THR 15 HG1 THR 15 30.184 22.198 25.447 97 HG21 THR 15 1HG2 THR 15 29.108 21.954 23.238 98 HG22 THR 15 2HG2 THR 15 27.486 21.380 23.608 99 HG23 THR 15 3HG2 THR 15 28.184 22.715 24.544 100 HA PRO 16 HA PRO 16 24.368 19.293 25.400 101 HB2 PRO 16 HB1 PRO 16 22.587 21.333 25.348 102 HB3 PRO 16 HB2 PRO 16 23.066 20.475 26.821 103 HG2 PRO 16 HG1 PRO 16 24.090 23.163 25.864 104 HG3 PRO 16 HG2 PRO 16 23.529 22.670 27.504 105 HD2 PRO 16 HD1 PRO 16 26.149 22.699 26.642 106 HD3 PRO 16 HD2 PRO 16 25.650 21.688 27.951 107 H ILE 17 H ILE 17 24.964 18.853 23.325 108 HA ILE 17 HA ILE 17 25.766 21.006 21.476 109 HB ILE 17 HB ILE 17 25.440 18.062 20.920 110 HG12 ILE 17 2HG1 ILE 17 28.132 18.423 20.872 111 HG13 ILE 17 1HG1 ILE 17 27.681 19.541 22.142 112 HG21 ILE 17 1HG2 ILE 17 26.887 18.567 18.964 113 HG22 ILE 17 2HG2 ILE 17 25.358 19.427 18.913 114 HG23 ILE 17 3HG2 ILE 17 26.804 20.310 19.383 115 HD11 ILE 17 HD1 ILE 17 28.214 17.394 23.098 116 HD12 ILE 17 HD2 ILE 17 26.493 17.658 23.346 117 HD13 ILE 17 HD3 ILE 17 27.068 16.536 22.059 118 H SER 18 H SER 18 23.467 18.409 20.978 119 HA SER 18 HA SER 18 21.681 20.287 19.504 120 HB2 SER 18 HB2 SER 18 20.905 17.431 20.095 121 HB3 SER 18 HB1 SER 18 20.367 18.553 18.815 122 HG SER 18 HG SER 18 22.439 18.311 17.894 123 H PHE 19 H PHE 19 19.554 20.610 20.020 124 HA PHE 19 HA PHE 19 18.650 20.147 22.828 125 HB2 PHE 19 HB2 PHE 19 18.615 22.632 21.082 126 HB3 PHE 19 HB1 PHE 19 17.472 22.373 22.380 127 HD1 PHE 19 HD1 PHE 19 21.281 22.183 22.007 128 HD2 PHE 19 HD2 PHE 19 17.878 23.338 24.387 129 HE1 PHE 19 HE1 PHE 19 22.758 23.276 23.559 130 HE2 PHE 19 HE2 PHE 19 19.425 24.286 26.073 131 HZ PHE 19 HZ PHE 19 21.821 24.393 25.632 132 H TYR 20 H TYR 20 16.143 20.741 22.729 133 HA TYR 20 HA TYR 20 15.072 18.468 21.352 134 HB2 TYR 20 HB2 TYR 20 14.124 20.296 23.402 135 HB3 TYR 20 HB1 TYR 20 12.851 19.810 22.356 136 HD1 TYR 20 HD1 TYR 20 15.753 18.291 24.175 137 HD2 TYR 20 HD2 TYR 20 11.746 17.902 22.706 138 HE1 TYR 20 HE1 TYR 20 15.571 16.102 25.344 139 HE2 TYR 20 HE2 TYR 20 11.462 15.783 24.012 140 HH TYR 20 HH TYR 20 14.132 14.353 25.856 141 H CYS 21 H CYS 21 13.596 21.713 21.143 142 HA CYS 21 HA CYS 21 11.943 20.926 19.154 143 HB2 CYS 21 HB2 CYS 21 11.046 22.949 19.195 144 HB3 CYS 21 HB1 CYS 21 11.924 22.968 20.703 145 H GLY 22 H GLY 22 33.691 24.592 15.296 146 HA2 GLY 22 HA2 GLY 22 32.177 22.716 13.653 147 HA3 GLY 22 HA1 GLY 22 33.876 22.649 14.059 148 H GLY 23 H GLY 23 32.210 22.826 17.012 149 HA2 GLY 23 HA2 GLY 23 31.707 19.858 17.176 150 HA3 GLY 23 HA1 GLY 23 32.999 20.498 18.034 151 H ALA 24 H ALA 24 32.145 19.698 19.836 152 HA ALA 24 HA ALA 24 29.966 21.065 21.259 153 HB1 ALA 24 HB1 ALA 24 30.792 19.740 23.109 154 HB2 ALA 24 HB2 ALA 24 30.459 18.684 21.726 155 HB3 ALA 24 HB3 ALA 24 32.150 19.082 22.136 156 H GLY 25 H GLY 25 30.936 21.930 23.569 157 HA2 GLY 25 HA2 GLY 25 33.166 23.243 24.051 158 HA3 GLY 25 HA1 GLY 25 32.568 24.178 22.673 159 H HIS 26 H HIS 26 32.702 25.845 24.102 160 HA HIS 26 HA HIS 26 30.260 26.310 25.780 161 HB2 HIS 26 HB2 HIS 26 31.657 27.421 27.460 162 HB3 HIS 26 HB1 HIS 26 31.818 25.649 27.350 163 HD2 HIS 26 HD2 HIS 26 33.854 28.873 26.522 164 HE1 HIS 26 HE1 HIS 26 36.565 25.608 26.687 165 HE2 HIS 26 HE2 HIS 26 36.369 28.104 26.439 166 H VAL 27 H VAL 27 32.453 27.635 23.443 167 HA VAL 27 HA VAL 27 30.786 30.080 23.479 168 HB VAL 27 HB VAL 27 32.784 31.029 22.074 169 HG11 VAL 27 1HG1 VAL 27 33.664 31.983 24.286 170 HG12 VAL 27 2HG1 VAL 27 31.874 32.046 24.089 171 HG13 VAL 27 3HG1 VAL 27 32.626 30.801 25.096 172 HG21 VAL 27 1HG2 VAL 27 34.923 30.477 22.921 173 HG22 VAL 27 2HG2 VAL 27 34.302 29.307 24.055 174 HG23 VAL 27 3HG2 VAL 27 34.182 28.955 22.316 175 HA PRO 28 HA PRO 28 29.233 28.151 20.025 176 HB2 PRO 28 HB1 PRO 28 27.695 30.034 18.766 177 HB3 PRO 28 HB2 PRO 28 27.390 29.405 20.410 178 HG2 PRO 28 HG1 PRO 28 28.975 31.888 19.675 179 HG3 PRO 28 HG2 PRO 28 27.531 31.829 20.726 180 HD2 PRO 28 HD1 PRO 28 30.038 31.688 21.804 181 HD3 PRO 28 HD2 PRO 28 28.824 30.611 22.440 182 H GLU 29 H GLU 29 29.177 27.863 17.844 183 HA GLU 29 HA GLU 29 31.278 29.114 16.204 184 HB2 GLU 29 HB2 GLU 29 32.015 27.008 17.129 185 HB3 GLU 29 HB1 GLU 29 30.506 26.213 16.580 186 HG2 GLU 29 HG2 GLU 29 31.680 27.041 14.270 187 HG3 GLU 29 HG1 GLU 29 33.111 26.685 15.224 188 H TYR 30 H TYR 30 28.065 27.494 16.393 189 HA TYR 30 HA TYR 30 27.384 28.559 13.768 190 HB2 TYR 30 HB2 TYR 30 28.263 26.168 13.694 191 HB3 TYR 30 HB1 TYR 30 26.626 25.718 14.211 192 HD1 TYR 30 HD1 TYR 30 24.724 26.371 12.745 193 HD2 TYR 30 HD2 TYR 30 28.778 27.045 11.564 194 HE1 TYR 30 HE1 TYR 30 23.982 26.695 10.358 195 HE2 TYR 30 HE2 TYR 30 28.136 27.318 9.250 196 HH TYR 30 HH TYR 30 26.328 27.583 7.849 197 H PHE 31 H PHE 31 25.602 29.757 14.193 198 HA PHE 31 HA PHE 31 24.076 29.166 16.615 199 HB2 PHE 31 HB2 PHE 31 24.900 31.479 15.832 200 HB3 PHE 31 HB1 PHE 31 23.436 31.539 14.889 201 HD1 PHE 31 HD1 PHE 31 21.202 31.016 16.282 202 HD2 PHE 31 HD2 PHE 31 24.960 32.322 17.941 203 HE1 PHE 31 HE1 PHE 31 20.037 31.903 18.257 204 HE2 PHE 31 HE2 PHE 31 23.787 33.266 19.875 205 HZ PHE 31 HZ PHE 31 21.342 32.985 20.109 206 H VAL 32 H VAL 32 22.892 30.080 13.321 207 HA VAL 32 HA VAL 32 20.780 28.034 13.630 208 HB VAL 32 HB VAL 32 20.080 30.404 14.105 209 HG11 VAL 32 1HG1 VAL 32 19.774 31.936 12.458 210 HG12 VAL 32 2HG1 VAL 32 21.447 31.408 12.197 211 HG13 VAL 32 3HG1 VAL 32 20.198 30.797 11.110 212 HG21 VAL 32 1HG2 VAL 32 18.005 30.234 12.889 213 HG22 VAL 32 2HG2 VAL 32 18.664 29.030 11.829 214 HG23 VAL 32 3HG2 VAL 32 18.513 28.654 13.582 215 H ARG 33 H ARG 33 20.138 26.972 11.932 216 HA ARG 33 HA ARG 33 21.769 26.837 9.516 217 HB2 ARG 33 HB2 ARG 33 20.262 25.066 8.833 218 HB3 ARG 33 HB1 ARG 33 20.911 24.768 10.454 219 HG2 ARG 33 HG2 ARG 33 18.305 26.111 10.552 220 HG3 ARG 33 HG1 ARG 33 18.307 24.560 9.670 221 HD2 ARG 33 HD2 ARG 33 17.700 24.144 11.870 222 HD3 ARG 33 HD1 ARG 33 19.263 23.449 11.568 223 HE ARG 33 HE ARG 33 20.259 24.883 13.078 224 HH11 ARG 33 1HH1 ARG 33 16.816 25.655 12.934 225 HH12 ARG 33 2HH1 ARG 33 16.848 26.629 14.385 226 HH21 ARG 33 1HH2 ARG 33 20.313 26.099 14.919 227 HH22 ARG 33 2HH2 ARG 33 18.815 26.769 15.584 228 H1 CYS 34 H1 CYS 34 11.252 29.029 18.386 229 H2 CYS 34 H2 CYS 34 11.001 27.729 19.407 230 H3 CYS 34 H3 CYS 34 11.939 28.992 19.887 231 HA CYS 34 HA CYS 34 13.341 27.157 19.226 232 HB2 CYS 34 HB2 CYS 34 11.821 27.496 16.630 233 HB3 CYS 34 HB1 CYS 34 13.354 26.638 16.785 234 H GLY 35 H GLY 35 15.217 28.266 19.449 235 HA2 GLY 35 HA2 GLY 35 16.419 29.612 17.320 236 HA3 GLY 35 HA1 GLY 35 15.743 30.814 18.396 237 H THR 36 H THR 36 18.128 28.232 18.128 238 HA THR 36 HA THR 36 19.467 29.061 20.617 239 HB THR 36 HB THR 36 18.593 26.260 19.809 240 HG1 THR 36 HG1 THR 36 17.416 26.418 21.767 241 HG21 THR 36 1HG2 THR 36 19.311 25.622 22.119 242 HG22 THR 36 2HG2 THR 36 20.625 26.207 21.108 243 HG23 THR 36 3HG2 THR 36 19.934 27.262 22.367 244 HA PRO 37 HA PRO 37 23.004 28.161 17.941 245 HB2 PRO 37 HB1 PRO 37 25.045 28.451 19.724 246 HB3 PRO 37 HB2 PRO 37 24.089 29.772 18.939 247 HG2 PRO 37 HG1 PRO 37 23.724 28.575 21.698 248 HG3 PRO 37 HG2 PRO 37 23.783 30.312 21.208 249 HD2 PRO 37 HD1 PRO 37 21.483 28.850 21.609 250 HD3 PRO 37 HD2 PRO 37 21.556 30.245 20.484 251 H ILE 38 H ILE 38 24.102 26.334 17.469 252 HA ILE 38 HA ILE 38 23.817 24.021 19.307 253 HB ILE 38 HB ILE 38 22.050 24.797 17.318 254 HG12 ILE 38 2HG1 ILE 38 21.143 22.529 17.384 255 HG13 ILE 38 1HG1 ILE 38 22.471 21.956 18.319 256 HG21 ILE 38 1HG2 ILE 38 22.202 23.411 15.449 257 HG22 ILE 38 2HG2 ILE 38 23.767 24.245 15.639 258 HG23 ILE 38 3HG2 ILE 38 23.550 22.507 16.159 259 HD11 ILE 38 HD1 ILE 38 20.516 22.572 19.781 260 HD12 ILE 38 HD2 ILE 38 21.928 23.540 20.191 261 HD13 ILE 38 HD3 ILE 38 20.643 24.261 19.245 262 H SER 39 H SER 39 26.136 25.508 17.487 263 HA SER 39 HA SER 39 27.727 23.293 18.505 264 HB2 SER 39 HB2 SER 39 27.930 24.094 15.598 265 HB3 SER 39 HB1 SER 39 29.235 23.277 16.477 266 HG SER 39 HG SER 39 26.770 22.127 16.777 267 H PHE 40 H PHE 40 30.012 23.807 18.553 268 HA PHE 40 HA PHE 40 30.523 26.565 19.424 269 HB2 PHE 40 HB2 PHE 40 30.838 24.114 21.145 270 HB3 PHE 40 HB1 PHE 40 31.008 25.781 21.648 271 HD1 PHE 40 HD1 PHE 40 29.069 27.207 21.991 272 HD2 PHE 40 HD2 PHE 40 28.707 23.078 20.879 273 HE1 PHE 40 HE1 PHE 40 26.699 27.313 22.507 274 HE2 PHE 40 HE2 PHE 40 26.247 23.159 21.431 275 HZ PHE 40 HZ PHE 40 25.240 25.302 22.224 276 H TYR 41 H TYR 41 32.795 26.758 20.335 277 HA TYR 41 HA TYR 41 34.681 25.571 18.429 278 HB2 TYR 41 HB2 TYR 41 35.166 27.377 20.773 279 HB3 TYR 41 HB1 TYR 41 36.361 26.975 19.530 280 HD1 TYR 41 HD1 TYR 41 34.407 27.362 17.105 281 HD2 TYR 41 HD2 TYR 41 35.332 29.745 20.594 282 HE1 TYR 41 HE1 TYR 41 33.692 29.401 15.951 283 HE2 TYR 41 HE2 TYR 41 34.710 31.776 19.412 284 HH TYR 41 HH TYR 41 33.275 31.610 16.126 285 H CYS 42 H CYS 42 34.147 25.340 21.844 286 HA CYS 42 HA CYS 42 35.135 24.227 23.551 287 HB2 CYS 42 HB2 CYS 42 34.667 22.186 22.364 288 HB3 CYS 42 HB1 CYS 42 36.208 22.310 21.495 Start of MODEL 5 1 H GLY 1 H GLY 1 17.536 16.525 20.846 2 HA2 GLY 1 HA2 GLY 1 18.664 15.513 18.587 3 HA3 GLY 1 HA1 GLY 1 17.069 14.779 18.536 4 H GLY 2 H GLY 2 18.637 17.976 18.921 5 HA2 GLY 2 HA2 GLY 2 17.411 19.311 16.840 6 HA3 GLY 2 HA1 GLY 2 16.278 19.469 18.210 7 H ALA 3 H ALA 3 16.737 21.716 17.758 8 HA ALA 3 HA ALA 3 19.018 22.775 19.274 9 HB1 ALA 3 HB1 ALA 3 19.425 24.489 17.622 10 HB2 ALA 3 HB2 ALA 3 19.405 22.894 16.795 11 HB3 ALA 3 HB3 ALA 3 18.037 23.935 16.646 12 H GLY 4 H GLY 4 18.174 23.870 20.994 13 HA2 GLY 4 HA2 GLY 4 15.388 24.965 20.854 14 HA3 GLY 4 HA1 GLY 4 15.735 23.405 21.625 15 H HIS 5 H HIS 5 14.909 24.150 23.542 16 HA HIS 5 HA HIS 5 16.630 26.103 24.993 17 HB2 HIS 5 HB2 HIS 5 14.880 27.035 26.027 18 HB3 HIS 5 HB1 HIS 5 14.262 26.754 24.434 19 HD2 HIS 5 HD2 HIS 5 12.970 26.806 27.681 20 HE1 HIS 5 HE1 HIS 5 11.153 23.249 26.247 21 HE2 HIS 5 HE2 HIS 5 11.084 25.036 28.046 22 H VAL 6 H VAL 6 15.843 22.710 25.144 23 HA VAL 6 HA VAL 6 17.376 22.650 27.633 24 HB VAL 6 HB VAL 6 15.972 20.757 28.453 25 HG11 VAL 6 1HG1 VAL 6 14.301 22.172 29.545 26 HG12 VAL 6 2HG1 VAL 6 15.824 23.120 29.409 27 HG13 VAL 6 3HG1 VAL 6 14.487 23.361 28.283 28 HG21 VAL 6 1HG2 VAL 6 13.629 20.682 27.732 29 HG22 VAL 6 2HG2 VAL 6 14.024 21.797 26.426 30 HG23 VAL 6 3HG2 VAL 6 14.715 20.129 26.464 31 HA PRO 7 HA PRO 7 19.531 19.714 25.348 32 HB2 PRO 7 HB1 PRO 7 21.067 18.404 27.162 33 HB3 PRO 7 HB2 PRO 7 21.110 20.218 26.968 34 HG2 PRO 7 HG1 PRO 7 19.628 18.657 29.018 35 HG3 PRO 7 HG2 PRO 7 20.708 20.053 29.287 36 HD2 PRO 7 HD1 PRO 7 18.008 20.318 29.075 37 HD3 PRO 7 HD2 PRO 7 19.144 21.562 28.454 38 H GLU 8 H GLU 8 19.194 17.964 24.268 39 HA GLU 8 HA GLU 8 17.549 15.735 25.187 40 HB2 GLU 8 HB2 GLU 8 17.422 16.653 22.902 41 HB3 GLU 8 HB1 GLU 8 19.122 16.223 22.629 42 HG2 GLU 8 HG2 GLU 8 18.555 13.825 22.860 43 HG3 GLU 8 HG1 GLU 8 16.875 14.222 23.132 44 H TYR 9 H TYR 9 20.899 16.090 23.923 45 HA TYR 9 HA TYR 9 21.752 13.746 25.547 46 HB2 TYR 9 HB2 TYR 9 22.918 14.898 23.016 47 HB3 TYR 9 HB1 TYR 9 23.599 13.521 23.909 48 HD1 TYR 9 HD1 TYR 9 22.017 14.264 20.981 49 HD2 TYR 9 HD2 TYR 9 21.442 11.676 24.390 50 HE1 TYR 9 HE1 TYR 9 20.920 12.606 19.504 51 HE2 TYR 9 HE2 TYR 9 20.430 10.043 22.934 52 HH TYR 9 HH TYR 9 19.869 9.465 20.812 53 H PHE 10 H PHE 10 22.475 14.630 27.419 54 HA PHE 10 HA PHE 10 23.317 17.322 27.582 55 HB2 PHE 10 HB2 PHE 10 22.383 15.940 29.457 56 HB3 PHE 10 HB1 PHE 10 23.882 15.014 29.498 57 HD1 PHE 10 HD1 PHE 10 25.747 15.875 30.785 58 HD2 PHE 10 HD2 PHE 10 22.303 18.361 30.037 59 HE1 PHE 10 HE1 PHE 10 26.614 17.540 32.399 60 HE2 PHE 10 HE2 PHE 10 23.151 19.967 31.683 61 HZ PHE 10 HZ PHE 10 25.272 19.571 32.872 62 H VAL 11 H VAL 11 25.234 14.427 27.227 63 HA VAL 11 HA VAL 11 27.384 16.030 26.148 64 HB VAL 11 HB VAL 11 27.744 15.547 28.663 65 HG11 VAL 11 1HG1 VAL 11 28.692 13.331 29.236 66 HG12 VAL 11 2HG1 VAL 11 26.981 13.254 28.801 67 HG13 VAL 11 3HG1 VAL 11 28.230 12.745 27.657 68 HG21 VAL 11 1HG2 VAL 11 30.101 15.283 28.485 69 HG22 VAL 11 2HG2 VAL 11 29.971 14.430 26.985 70 HG23 VAL 11 3HG2 VAL 11 29.616 16.186 27.013 71 H ARG 12 H ARG 12 29.061 14.256 25.233 72 HA ARG 12 HA ARG 12 27.563 11.923 24.155 73 HB2 ARG 12 HB2 ARG 12 28.756 11.984 22.150 74 HB3 ARG 12 HB1 ARG 12 28.146 13.597 22.419 75 HG2 ARG 12 HG2 ARG 12 30.364 14.305 23.326 76 HG3 ARG 12 HG1 ARG 12 30.981 12.688 22.957 77 HD2 ARG 12 HD2 ARG 12 31.533 13.418 20.956 78 HD3 ARG 12 HD1 ARG 12 29.869 13.370 20.545 79 HE ARG 12 HE ARG 12 29.671 15.766 20.972 80 HH11 ARG 12 1HH1 ARG 12 33.039 14.747 21.612 81 HH12 ARG 12 2HH1 ARG 12 33.667 16.201 20.891 82 HH21 ARG 12 1HH2 ARG 12 30.707 17.599 19.980 83 HH22 ARG 12 2HH2 ARG 12 32.375 17.928 20.541 84 H1 CYS 13 H1 CYS 13 34.410 22.339 30.267 85 H2 CYS 13 H2 CYS 13 35.448 21.077 30.007 86 H3 CYS 13 H3 CYS 13 35.895 22.580 29.548 87 HA CYS 13 HA CYS 13 34.183 22.574 27.836 88 HB2 CYS 13 HB2 CYS 13 36.472 21.577 27.565 89 HB3 CYS 13 HB1 CYS 13 35.752 20.008 27.619 90 H GLY 14 H GLY 14 33.267 19.952 26.702 91 HA2 GLY 14 HA2 GLY 14 31.590 18.427 26.928 92 HA3 GLY 14 HA1 GLY 14 31.824 18.545 28.651 93 H THR 15 H THR 15 29.937 19.546 25.889 94 HA THR 15 HA THR 15 27.915 20.834 27.602 95 HB THR 15 HB THR 15 29.053 21.983 25.029 96 HG1 THR 15 HG1 THR 15 29.370 22.759 27.742 97 HG21 THR 15 1HG2 THR 15 27.990 24.119 25.733 98 HG22 THR 15 2HG2 THR 15 26.764 22.951 25.392 99 HG23 THR 15 3HG2 THR 15 27.190 23.294 27.069 100 HA PRO 16 HA PRO 16 25.255 18.560 24.774 101 HB2 PRO 16 HB1 PRO 16 23.373 20.862 24.863 102 HB3 PRO 16 HB2 PRO 16 23.017 19.198 25.183 103 HG2 PRO 16 HG1 PRO 16 23.239 20.984 27.290 104 HG3 PRO 16 HG2 PRO 16 23.912 19.353 27.449 105 HD2 PRO 16 HD1 PRO 16 25.329 21.893 26.836 106 HD3 PRO 16 HD2 PRO 16 25.821 20.520 27.873 107 H ILE 17 H ILE 17 25.350 18.434 22.722 108 HA ILE 17 HA ILE 17 25.459 20.803 20.879 109 HB ILE 17 HB ILE 17 26.156 17.892 20.650 110 HG12 ILE 17 2HG1 ILE 17 28.261 18.741 19.724 111 HG13 ILE 17 1HG1 ILE 17 27.762 20.388 20.005 112 HG21 ILE 17 1HG2 ILE 17 26.651 18.312 18.213 113 HG22 ILE 17 2HG2 ILE 17 24.975 18.132 18.701 114 HG23 ILE 17 3HG2 ILE 17 25.673 19.785 18.389 115 HD11 ILE 17 HD1 ILE 17 29.357 19.232 21.660 116 HD12 ILE 17 HD2 ILE 17 28.015 20.234 22.304 117 HD13 ILE 17 HD3 ILE 17 27.925 18.448 22.311 118 H SER 18 H SER 18 23.422 18.157 21.931 119 HA SER 18 HA SER 18 21.384 18.884 19.887 120 HB2 SER 18 HB2 SER 18 21.821 16.277 21.304 121 HB3 SER 18 HB1 SER 18 20.352 16.719 20.352 122 HG SER 18 HG SER 18 21.606 16.876 18.565 123 H PHE 19 H PHE 19 19.985 20.279 20.766 124 HA PHE 19 HA PHE 19 18.985 20.047 23.523 125 HB2 PHE 19 HB2 PHE 19 18.257 21.759 21.172 126 HB3 PHE 19 HB1 PHE 19 17.507 21.921 22.719 127 HD1 PHE 19 HD1 PHE 19 20.673 22.341 20.924 128 HD2 PHE 19 HD2 PHE 19 18.449 23.270 24.392 129 HE1 PHE 19 HE1 PHE 19 22.427 23.997 21.555 130 HE2 PHE 19 HE2 PHE 19 20.132 24.996 25.042 131 HZ PHE 19 HZ PHE 19 22.116 25.406 23.611 132 H TYR 20 H TYR 20 16.525 20.128 23.574 133 HA TYR 20 HA TYR 20 15.024 18.531 21.617 134 HB2 TYR 20 HB2 TYR 20 14.342 20.181 24.106 135 HB3 TYR 20 HB1 TYR 20 13.119 19.573 23.010 136 HD1 TYR 20 HD1 TYR 20 12.268 17.392 23.265 137 HD2 TYR 20 HD2 TYR 20 15.904 18.504 25.274 138 HE1 TYR 20 HE1 TYR 20 12.195 15.300 24.602 139 HE2 TYR 20 HE2 TYR 20 15.801 16.464 26.616 140 HH TYR 20 HH TYR 20 14.838 14.210 26.530 141 H CYS 21 H CYS 21 12.837 20.295 21.313 142 HA CYS 21 HA CYS 21 13.863 22.393 19.565 143 HB2 CYS 21 HB2 CYS 21 11.773 20.948 19.198 144 HB3 CYS 21 HB1 CYS 21 11.037 21.866 20.546 145 H GLY 22 H GLY 22 33.334 24.285 17.921 146 HA2 GLY 22 HA2 GLY 22 33.360 22.159 15.844 147 HA3 GLY 22 HA1 GLY 22 34.708 22.445 16.903 148 H GLY 23 H GLY 23 32.077 22.865 18.960 149 HA2 GLY 23 HA2 GLY 23 30.411 20.840 18.791 150 HA3 GLY 23 HA1 GLY 23 31.761 20.001 19.598 151 H ALA 24 H ALA 24 32.242 20.400 21.792 152 HA ALA 24 HA ALA 24 30.100 21.684 23.308 153 HB1 ALA 24 HB1 ALA 24 31.451 20.972 25.232 154 HB2 ALA 24 HB2 ALA 24 31.125 19.671 24.064 155 HB3 ALA 24 HB3 ALA 24 32.755 20.410 24.090 156 H GLY 25 H GLY 25 30.696 23.289 25.063 157 HA2 GLY 25 HA2 GLY 25 32.712 24.854 25.581 158 HA3 GLY 25 HA1 GLY 25 32.405 25.393 23.935 159 H HIS 26 H HIS 26 32.566 26.999 26.003 160 HA HIS 26 HA HIS 26 29.938 27.951 26.859 161 HB2 HIS 26 HB2 HIS 26 31.148 29.635 27.990 162 HB3 HIS 26 HB1 HIS 26 31.775 28.056 28.410 163 HD2 HIS 26 HD2 HIS 26 33.118 31.360 27.496 164 HE1 HIS 26 HE1 HIS 26 36.243 28.641 26.492 165 HE2 HIS 26 HE2 HIS 26 35.590 31.090 26.715 166 H VAL 27 H VAL 27 31.996 28.678 24.132 167 HA VAL 27 HA VAL 27 30.193 30.899 23.523 168 HB VAL 27 HB VAL 27 32.126 31.938 22.198 169 HG11 VAL 27 1HG1 VAL 27 32.775 33.321 24.085 170 HG12 VAL 27 2HG1 VAL 27 31.031 32.960 24.108 171 HG13 VAL 27 3HG1 VAL 27 32.086 32.091 25.219 172 HG21 VAL 27 1HG2 VAL 27 34.334 31.635 23.088 173 HG22 VAL 27 2HG2 VAL 27 33.761 30.398 24.234 174 HG23 VAL 27 3HG2 VAL 27 33.689 30.121 22.466 175 HA PRO 28 HA PRO 28 29.125 28.514 20.245 176 HB2 PRO 28 HB1 PRO 28 27.815 30.231 18.549 177 HB3 PRO 28 HB2 PRO 28 27.401 29.768 20.237 178 HG2 PRO 28 HG1 PRO 28 28.961 32.216 19.236 179 HG3 PRO 28 HG2 PRO 28 27.455 32.220 20.263 180 HD2 PRO 28 HD1 PRO 28 30.028 32.323 21.283 181 HD3 PRO 28 HD2 PRO 28 28.711 31.528 22.148 182 H GLU 29 H GLU 29 29.521 27.648 18.312 183 HA GLU 29 HA GLU 29 31.717 28.520 16.577 184 HB2 GLU 29 HB2 GLU 29 32.096 26.554 18.132 185 HB3 GLU 29 HB1 GLU 29 30.899 25.676 17.150 186 HG2 GLU 29 HG2 GLU 29 32.480 26.595 15.171 187 HG3 GLU 29 HG1 GLU 29 33.663 26.670 16.448 188 H TYR 30 H TYR 30 28.522 26.937 16.859 189 HA TYR 30 HA TYR 30 27.963 27.739 14.082 190 HB2 TYR 30 HB2 TYR 30 27.790 24.958 15.177 191 HB3 TYR 30 HB1 TYR 30 26.423 25.508 14.284 192 HD1 TYR 30 HD1 TYR 30 26.347 25.296 11.967 193 HD2 TYR 30 HD2 TYR 30 30.165 25.468 13.971 194 HE1 TYR 30 HE1 TYR 30 27.537 24.776 9.860 195 HE2 TYR 30 HE2 TYR 30 31.336 24.969 11.876 196 HH TYR 30 HH TYR 30 31.028 24.818 9.542 197 H PHE 31 H PHE 31 26.288 29.014 14.026 198 HA PHE 31 HA PHE 31 24.544 29.225 16.382 199 HB2 PHE 31 HB2 PHE 31 26.169 31.091 15.385 200 HB3 PHE 31 HB1 PHE 31 24.889 31.332 14.256 201 HD1 PHE 31 HD1 PHE 31 25.616 31.029 17.881 202 HD2 PHE 31 HD2 PHE 31 23.069 32.814 14.938 203 HE1 PHE 31 HE1 PHE 31 24.591 32.518 19.641 204 HE2 PHE 31 HE2 PHE 31 22.022 34.238 16.643 205 HZ PHE 31 HZ PHE 31 22.764 34.045 19.025 206 H VAL 32 H VAL 32 22.406 30.447 15.768 207 HA VAL 32 HA VAL 32 20.912 28.579 14.241 208 HB VAL 32 HB VAL 32 19.922 29.464 16.099 209 HG11 VAL 32 1HG1 VAL 32 19.262 31.812 16.457 210 HG12 VAL 32 2HG1 VAL 32 20.998 31.434 16.620 211 HG13 VAL 32 3HG1 VAL 32 20.348 32.302 15.188 212 HG21 VAL 32 1HG2 VAL 32 17.820 30.371 15.359 213 HG22 VAL 32 2HG2 VAL 32 18.487 30.751 13.747 214 HG23 VAL 32 3HG2 VAL 32 18.354 29.062 14.259 215 H ARG 33 H ARG 33 20.480 28.524 12.248 216 HA ARG 33 HA ARG 33 21.565 30.226 10.312 217 HB2 ARG 33 HB2 ARG 33 20.383 28.913 8.665 218 HB3 ARG 33 HB1 ARG 33 21.146 27.916 9.851 219 HG2 ARG 33 HG2 ARG 33 19.089 26.806 9.827 220 HG3 ARG 33 HG1 ARG 33 18.681 28.065 10.963 221 HD2 ARG 33 HD2 ARG 33 16.924 28.135 9.385 222 HD3 ARG 33 HD1 ARG 33 18.018 29.437 8.821 223 HE ARG 33 HE ARG 33 18.626 26.965 7.524 224 HH11 ARG 33 1HH1 ARG 33 16.191 29.501 7.537 225 HH12 ARG 33 2HH1 ARG 33 15.961 29.420 5.777 226 HH21 ARG 33 1HH2 ARG 33 17.986 26.686 5.269 227 HH22 ARG 33 2HH2 ARG 33 16.754 27.738 4.622 228 H1 CYS 34 H1 CYS 34 12.626 26.593 19.650 229 H2 CYS 34 H2 CYS 34 11.917 26.655 18.162 230 H3 CYS 34 H3 CYS 34 11.842 25.310 19.154 231 HA CYS 34 HA CYS 34 14.130 24.941 18.976 232 HB2 CYS 34 HB2 CYS 34 12.879 25.284 16.216 233 HB3 CYS 34 HB1 CYS 34 14.411 24.464 16.541 234 H GLY 35 H GLY 35 15.413 26.067 16.282 235 HA2 GLY 35 HA2 GLY 35 16.601 27.739 15.646 236 HA3 GLY 35 HA1 GLY 35 15.493 28.811 16.443 237 H THR 36 H THR 36 18.482 26.927 17.032 238 HA THR 36 HA THR 36 19.376 28.927 19.009 239 HB THR 36 HB THR 36 19.024 25.933 19.504 240 HG1 THR 36 HG1 THR 36 17.721 26.805 21.154 241 HG21 THR 36 1HG2 THR 36 19.724 26.338 21.820 242 HG22 THR 36 2HG2 THR 36 21.021 26.809 20.805 243 HG23 THR 36 3HG2 THR 36 19.996 28.053 21.517 244 HA PRO 37 HA PRO 37 23.416 27.593 17.255 245 HB2 PRO 37 HB1 PRO 37 24.967 27.615 19.604 246 HB3 PRO 37 HB2 PRO 37 24.662 29.057 18.597 247 HG2 PRO 37 HG1 PRO 37 23.090 28.193 21.015 248 HG3 PRO 37 HG2 PRO 37 23.738 29.807 20.626 249 HD2 PRO 37 HD1 PRO 37 21.174 29.242 20.151 250 HD3 PRO 37 HD2 PRO 37 22.097 30.045 18.841 251 H ILE 38 H ILE 38 24.803 25.723 17.271 252 HA ILE 38 HA ILE 38 23.874 23.517 19.047 253 HB ILE 38 HB ILE 38 23.999 21.933 17.169 254 HG12 ILE 38 2HG1 ILE 38 23.363 22.953 14.915 255 HG13 ILE 38 1HG1 ILE 38 24.078 24.459 15.488 256 HG21 ILE 38 1HG2 ILE 38 21.744 22.459 16.415 257 HG22 ILE 38 2HG2 ILE 38 21.936 22.645 18.149 258 HG23 ILE 38 3HG2 ILE 38 21.906 24.090 17.135 259 HD11 ILE 38 HD1 ILE 38 25.499 21.755 15.327 260 HD12 ILE 38 HD2 ILE 38 25.594 23.041 14.094 261 HD13 ILE 38 HD3 ILE 38 26.263 23.287 15.736 262 H SER 39 H SER 39 26.644 25.135 17.864 263 HA SER 39 HA SER 39 28.196 23.142 19.308 264 HB2 SER 39 HB2 SER 39 29.046 24.031 16.553 265 HB3 SER 39 HB1 SER 39 30.043 23.111 17.690 266 HG SER 39 HG SER 39 28.910 21.931 15.981 267 H PHE 40 H PHE 40 30.155 23.895 19.966 268 HA PHE 40 HA PHE 40 30.643 26.795 20.247 269 HB2 PHE 40 HB2 PHE 40 30.395 24.738 22.418 270 HB3 PHE 40 HB1 PHE 40 30.666 26.455 22.705 271 HD1 PHE 40 HD1 PHE 40 28.279 23.752 22.129 272 HD2 PHE 40 HD2 PHE 40 28.800 28.016 22.362 273 HE1 PHE 40 HE1 PHE 40 25.812 24.089 22.357 274 HE2 PHE 40 HE2 PHE 40 26.368 28.348 22.472 275 HZ PHE 40 HZ PHE 40 24.859 26.345 22.508 276 H TYR 41 H TYR 41 32.836 26.886 21.827 277 HA TYR 41 HA TYR 41 34.580 26.013 19.727 278 HB2 TYR 41 HB2 TYR 41 34.472 28.150 21.734 279 HB3 TYR 41 HB1 TYR 41 36.089 27.600 21.412 280 HD1 TYR 41 HD1 TYR 41 37.085 27.463 19.091 281 HD2 TYR 41 HD2 TYR 41 33.521 29.632 20.093 282 HE1 TYR 41 HE1 TYR 41 37.292 28.703 17.055 283 HE2 TYR 41 HE2 TYR 41 33.728 30.996 18.018 284 HH TYR 41 HH TYR 41 34.932 31.284 16.088 285 H CYS 42 H CYS 42 34.506 24.746 23.073 286 HA CYS 42 HA CYS 42 37.315 24.837 23.283 287 HB2 CYS 42 HB2 CYS 42 37.006 23.601 25.335 288 HB3 CYS 42 HB1 CYS 42 36.023 25.054 25.219 Start of MODEL 6 1 H GLY 1 H GLY 1 18.317 15.813 18.133 2 HA2 GLY 1 HA2 GLY 1 15.879 15.483 18.738 3 HA3 GLY 1 HA1 GLY 1 16.278 16.512 20.094 4 H GLY 2 H GLY 2 17.900 18.554 18.716 5 HA2 GLY 2 HA2 GLY 2 16.882 19.754 16.463 6 HA3 GLY 2 HA1 GLY 2 15.802 20.108 17.842 7 H ALA 3 H ALA 3 16.460 22.336 17.506 8 HA ALA 3 HA ALA 3 18.885 23.071 19.060 9 HB1 ALA 3 HB1 ALA 3 19.266 24.847 17.406 10 HB2 ALA 3 HB2 ALA 3 19.437 23.174 16.684 11 HB3 ALA 3 HB3 ALA 3 18.013 24.118 16.373 12 H GLY 4 H GLY 4 16.733 22.965 20.445 13 HA2 GLY 4 HA2 GLY 4 15.317 25.508 20.450 14 HA3 GLY 4 HA1 GLY 4 14.774 24.016 21.198 15 H HIS 5 H HIS 5 15.421 23.523 23.297 16 HA HIS 5 HA HIS 5 16.816 25.604 24.847 17 HB2 HIS 5 HB2 HIS 5 14.803 26.285 26.095 18 HB3 HIS 5 HB1 HIS 5 14.776 26.735 24.438 19 HD2 HIS 5 HD2 HIS 5 13.266 23.993 26.730 20 HE1 HIS 5 HE1 HIS 5 10.627 24.426 23.398 21 HE2 HIS 5 HE2 HIS 5 10.992 23.247 25.608 22 H VAL 6 H VAL 6 15.818 22.380 24.823 23 HA VAL 6 HA VAL 6 17.121 22.104 27.444 24 HB VAL 6 HB VAL 6 15.606 19.994 27.729 25 HG11 VAL 6 1HG1 VAL 6 13.993 21.371 29.159 26 HG12 VAL 6 2HG1 VAL 6 15.707 21.762 29.380 27 HG13 VAL 6 3HG1 VAL 6 14.696 22.823 28.448 28 HG21 VAL 6 1HG2 VAL 6 13.380 20.103 26.983 29 HG22 VAL 6 2HG2 VAL 6 13.471 21.737 26.463 30 HG23 VAL 6 3HG2 VAL 6 14.345 20.470 25.559 31 HA PRO 7 HA PRO 7 19.619 19.574 25.131 32 HB2 PRO 7 HB1 PRO 7 20.889 17.946 26.917 33 HB3 PRO 7 HB2 PRO 7 21.132 19.734 26.942 34 HG2 PRO 7 HG1 PRO 7 19.257 18.079 28.651 35 HG3 PRO 7 HG2 PRO 7 20.355 19.315 29.214 36 HD2 PRO 7 HD1 PRO 7 17.710 19.801 28.657 37 HD3 PRO 7 HD2 PRO 7 18.949 21.024 28.307 38 H GLU 8 H GLU 8 19.388 18.141 23.775 39 HA GLU 8 HA GLU 8 18.060 15.525 24.180 40 HB2 GLU 8 HB2 GLU 8 17.573 16.844 22.246 41 HB3 GLU 8 HB1 GLU 8 19.252 16.803 21.726 42 HG2 GLU 8 HG2 GLU 8 18.648 14.124 21.840 43 HG3 GLU 8 HG1 GLU 8 17.067 14.822 21.411 44 H TYR 9 H TYR 9 21.277 16.895 23.529 45 HA TYR 9 HA TYR 9 22.497 14.488 24.683 46 HB2 TYR 9 HB2 TYR 9 23.516 15.846 22.150 47 HB3 TYR 9 HB1 TYR 9 24.485 14.844 23.204 48 HD1 TYR 9 HD1 TYR 9 23.272 12.555 23.833 49 HD2 TYR 9 HD2 TYR 9 22.960 14.697 20.141 50 HE1 TYR 9 HE1 TYR 9 22.692 10.428 22.706 51 HE2 TYR 9 HE2 TYR 9 22.302 12.625 18.982 52 HH TYR 9 HH TYR 9 22.267 10.271 19.189 53 H PHE 10 H PHE 10 23.159 15.186 26.470 54 HA PHE 10 HA PHE 10 24.202 17.847 27.012 55 HB2 PHE 10 HB2 PHE 10 23.021 16.098 28.608 56 HB3 PHE 10 HB1 PHE 10 24.651 15.539 28.845 57 HD1 PHE 10 HD1 PHE 10 26.435 17.332 29.523 58 HD2 PHE 10 HD2 PHE 10 22.198 17.938 29.831 59 HE1 PHE 10 HE1 PHE 10 26.846 19.215 31.080 60 HE2 PHE 10 HE2 PHE 10 22.612 19.851 31.353 61 HZ PHE 10 HZ PHE 10 24.859 20.523 31.963 62 H VAL 11 H VAL 11 25.516 14.546 26.475 63 HA VAL 11 HA VAL 11 27.945 15.488 25.401 64 HB VAL 11 HB VAL 11 28.095 15.736 27.946 65 HG11 VAL 11 1HG1 VAL 11 28.546 12.722 27.833 66 HG12 VAL 11 2HG1 VAL 11 28.784 13.773 29.220 67 HG13 VAL 11 3HG1 VAL 11 27.173 13.569 28.664 68 HG21 VAL 11 1HG2 VAL 11 30.370 15.264 28.005 69 HG22 VAL 11 2HG2 VAL 11 30.300 14.121 26.656 70 HG23 VAL 11 3HG2 VAL 11 29.975 15.833 26.345 71 H ARG 12 H ARG 12 29.414 13.775 24.938 72 HA ARG 12 HA ARG 12 28.067 11.503 23.674 73 HB2 ARG 12 HB2 ARG 12 30.083 11.293 22.346 74 HB3 ARG 12 HB1 ARG 12 29.410 12.922 22.324 75 HG2 ARG 12 HG2 ARG 12 31.271 13.428 24.147 76 HG3 ARG 12 HG1 ARG 12 31.891 11.849 23.637 77 HD2 ARG 12 HD2 ARG 12 33.118 13.465 22.377 78 HD3 ARG 12 HD1 ARG 12 31.988 12.696 21.274 79 HE ARG 12 HE ARG 12 30.855 15.067 22.518 80 HH11 ARG 12 1HH1 ARG 12 33.130 14.211 19.887 81 HH12 ARG 12 2HH1 ARG 12 32.920 15.756 19.135 82 HH21 ARG 12 1HH2 ARG 12 30.416 16.826 21.363 83 HH22 ARG 12 2HH2 ARG 12 31.279 17.115 19.831 84 H1 CYS 13 H1 CYS 13 35.374 20.828 29.107 85 H2 CYS 13 H2 CYS 13 35.971 19.554 28.197 86 H3 CYS 13 H3 CYS 13 36.164 21.091 27.650 87 HA CYS 13 HA CYS 13 33.859 21.416 27.532 88 HB2 CYS 13 HB2 CYS 13 34.926 19.050 25.925 89 HB3 CYS 13 HB1 CYS 13 33.462 19.913 25.525 90 H GLY 14 H GLY 14 32.036 21.076 28.401 91 HA2 GLY 14 HA2 GLY 14 30.874 18.457 28.860 92 HA3 GLY 14 HA1 GLY 14 31.404 19.272 30.347 93 H THR 15 H THR 15 29.715 19.971 27.353 94 HA THR 15 HA THR 15 27.421 21.270 28.730 95 HB THR 15 HB THR 15 29.050 22.701 26.679 96 HG1 THR 15 HG1 THR 15 29.283 24.144 28.547 97 HG21 THR 15 1HG2 THR 15 27.627 24.592 27.130 98 HG22 THR 15 2HG2 THR 15 26.588 23.295 26.651 99 HG23 THR 15 3HG2 THR 15 26.724 23.686 28.393 100 HA PRO 16 HA PRO 16 25.118 19.178 25.503 101 HB2 PRO 16 HB1 PRO 16 23.603 21.797 25.670 102 HB3 PRO 16 HB2 PRO 16 22.944 20.135 25.356 103 HG2 PRO 16 HG1 PRO 16 22.914 21.292 27.856 104 HG3 PRO 16 HG2 PRO 16 23.356 19.547 27.632 105 HD2 PRO 16 HD1 PRO 16 25.071 22.059 27.982 106 HD3 PRO 16 HD2 PRO 16 25.306 20.464 28.709 107 H ILE 17 H ILE 17 24.725 19.242 23.343 108 HA ILE 17 HA ILE 17 25.436 21.579 21.680 109 HB ILE 17 HB ILE 17 26.062 18.695 21.166 110 HG12 ILE 17 2HG1 ILE 17 28.052 20.968 20.937 111 HG13 ILE 17 1HG1 ILE 17 27.641 20.296 22.498 112 HG21 ILE 17 1HG2 ILE 17 26.988 19.526 18.915 113 HG22 ILE 17 2HG2 ILE 17 25.239 19.507 19.010 114 HG23 ILE 17 3HG2 ILE 17 26.119 21.038 19.269 115 HD11 ILE 17 HD1 ILE 17 29.564 19.145 21.630 116 HD12 ILE 17 HD2 ILE 17 28.193 18.060 21.931 117 HD13 ILE 17 HD3 ILE 17 28.607 18.512 20.273 118 H SER 18 H SER 18 23.857 18.355 21.147 119 HA SER 18 HA SER 18 21.679 19.578 19.696 120 HB2 SER 18 HB2 SER 18 21.705 16.811 20.952 121 HB3 SER 18 HB1 SER 18 20.683 17.461 19.663 122 HG SER 18 HG SER 18 22.263 16.740 18.402 123 H PHE 19 H PHE 19 20.085 20.584 20.462 124 HA PHE 19 HA PHE 19 18.983 20.177 23.197 125 HB2 PHE 19 HB2 PHE 19 18.449 22.271 21.057 126 HB3 PHE 19 HB1 PHE 19 17.520 22.129 22.521 127 HD1 PHE 19 HD1 PHE 19 18.516 22.721 24.668 128 HD2 PHE 19 HD2 PHE 19 20.662 23.247 21.036 129 HE1 PHE 19 HE1 PHE 19 20.203 24.152 25.861 130 HE2 PHE 19 HE2 PHE 19 22.313 24.673 22.151 131 HZ PHE 19 HZ PHE 19 22.117 25.126 24.593 132 H TYR 20 H TYR 20 16.463 20.111 23.082 133 HA TYR 20 HA TYR 20 15.475 18.439 20.938 134 HB2 TYR 20 HB2 TYR 20 14.175 19.680 23.404 135 HB3 TYR 20 HB1 TYR 20 13.312 18.638 22.256 136 HD1 TYR 20 HD1 TYR 20 14.238 16.291 21.735 137 HD2 TYR 20 HD2 TYR 20 15.197 18.580 25.240 138 HE1 TYR 20 HE1 TYR 20 14.919 14.201 22.949 139 HE2 TYR 20 HE2 TYR 20 15.808 16.472 26.444 140 HH TYR 20 HH TYR 20 16.252 14.294 26.183 141 H CYS 21 H CYS 21 12.927 19.641 20.509 142 HA CYS 21 HA CYS 21 13.368 22.517 20.423 143 HB2 CYS 21 HB1 CYS 21 13.819 21.933 18.192 144 HB3 CYS 21 HB2 CYS 21 12.284 21.061 17.982 145 H GLY 22 H GLY 22 33.145 24.507 17.062 146 HA2 GLY 22 HA2 GLY 22 32.576 21.751 16.029 147 HA3 GLY 22 HA1 GLY 22 34.190 22.421 16.217 148 H GLY 23 H GLY 23 31.379 21.231 17.957 149 HA2 GLY 23 HA2 GLY 23 31.762 19.591 19.679 150 HA3 GLY 23 HA1 GLY 23 33.050 20.567 20.370 151 H ALA 24 H ALA 24 31.857 20.274 22.306 152 HA ALA 24 HA ALA 24 29.761 22.191 22.914 153 HB1 ALA 24 HB1 ALA 24 30.112 21.347 25.228 154 HB2 ALA 24 HB2 ALA 24 29.938 20.028 24.077 155 HB3 ALA 24 HB3 ALA 24 31.541 20.417 24.698 156 H GLY 25 H GLY 25 30.474 23.578 25.056 157 HA2 GLY 25 HA2 GLY 25 32.823 24.611 25.770 158 HA3 GLY 25 HA1 GLY 25 32.760 25.184 24.101 159 H HIS 26 H HIS 26 33.088 27.094 25.595 160 HA HIS 26 HA HIS 26 30.719 28.115 26.999 161 HB2 HIS 26 HB2 HIS 26 32.199 29.672 28.003 162 HB3 HIS 26 HB1 HIS 26 33.025 28.115 27.978 163 HD2 HIS 26 HD2 HIS 26 33.499 31.667 27.234 164 HE1 HIS 26 HE1 HIS 26 36.717 29.745 25.213 165 HE2 HIS 26 HE2 HIS 26 35.840 31.963 26.106 166 H VAL 27 H VAL 27 32.172 28.649 23.972 167 HA VAL 27 HA VAL 27 30.264 30.804 23.416 168 HB VAL 27 HB VAL 27 32.031 31.741 21.799 169 HG11 VAL 27 1HG1 VAL 27 32.826 33.304 23.490 170 HG12 VAL 27 2HG1 VAL 27 31.159 32.905 23.818 171 HG13 VAL 27 3HG1 VAL 27 32.425 32.142 24.793 172 HG21 VAL 27 1HG2 VAL 27 34.331 31.512 22.354 173 HG22 VAL 27 2HG2 VAL 27 33.979 30.498 23.743 174 HG23 VAL 27 3HG2 VAL 27 33.676 29.882 22.094 175 HA PRO 28 HA PRO 28 28.928 28.256 20.416 176 HB2 PRO 28 HB1 PRO 28 27.451 29.843 18.749 177 HB3 PRO 28 HB2 PRO 28 27.159 29.737 20.474 178 HG2 PRO 28 HG1 PRO 28 28.798 31.835 19.043 179 HG3 PRO 28 HG2 PRO 28 27.416 32.048 20.142 180 HD2 PRO 28 HD1 PRO 28 30.002 32.092 21.082 181 HD3 PRO 28 HD2 PRO 28 28.681 31.388 22.057 182 H GLU 29 H GLU 29 29.000 27.460 18.316 183 HA GLU 29 HA GLU 29 31.002 28.359 16.336 184 HB2 GLU 29 HB2 GLU 29 31.618 26.333 17.550 185 HB3 GLU 29 HB1 GLU 29 30.078 25.594 17.164 186 HG2 GLU 29 HG2 GLU 29 30.800 25.843 14.696 187 HG3 GLU 29 HG1 GLU 29 32.400 26.211 15.301 188 H TYR 30 H TYR 30 27.814 26.832 16.950 189 HA TYR 30 HA TYR 30 26.894 27.700 14.268 190 HB2 TYR 30 HB2 TYR 30 26.071 25.275 15.875 191 HB3 TYR 30 HB1 TYR 30 25.121 25.966 14.591 192 HD1 TYR 30 HD1 TYR 30 25.128 23.459 14.110 193 HD2 TYR 30 HD2 TYR 30 28.531 26.038 13.484 194 HE1 TYR 30 HE1 TYR 30 26.103 21.785 12.580 195 HE2 TYR 30 HE2 TYR 30 29.510 24.303 11.986 196 HH TYR 30 HH TYR 30 29.123 22.416 10.839 197 H PHE 31 H PHE 31 24.909 28.712 14.239 198 HA PHE 31 HA PHE 31 23.249 28.832 16.692 199 HB2 PHE 31 HB2 PHE 31 24.509 31.013 15.381 200 HB3 PHE 31 HB1 PHE 31 22.805 31.091 15.049 201 HD1 PHE 31 HD1 PHE 31 21.308 32.083 16.621 202 HD2 PHE 31 HD2 PHE 31 25.138 30.597 17.866 203 HE1 PHE 31 HE1 PHE 31 20.923 32.969 18.903 204 HE2 PHE 31 HE2 PHE 31 24.829 31.674 20.111 205 HZ PHE 31 HZ PHE 31 22.685 32.742 20.657 206 H VAL 32 H VAL 32 20.981 29.595 15.840 207 HA VAL 32 HA VAL 32 19.852 27.702 14.053 208 HB VAL 32 HB VAL 32 18.666 29.134 15.679 209 HG11 VAL 32 1HG1 VAL 32 17.919 31.368 15.057 210 HG12 VAL 32 2HG1 VAL 32 19.668 31.343 15.255 211 HG13 VAL 32 3HG1 VAL 32 18.964 31.300 13.595 212 HG21 VAL 32 1HG2 VAL 32 16.629 29.350 14.462 213 HG22 VAL 32 2HG2 VAL 32 17.453 29.501 12.950 214 HG23 VAL 32 3HG2 VAL 32 17.447 27.932 13.782 215 H ARG 33 H ARG 33 18.827 27.993 11.949 216 HA ARG 33 HA ARG 33 20.385 29.739 10.144 217 HB2 ARG 33 HB2 ARG 33 20.788 27.841 8.642 218 HB3 ARG 33 HB1 ARG 33 21.527 27.685 10.224 219 HG2 ARG 33 HG2 ARG 33 20.720 25.542 9.487 220 HG3 ARG 33 HG1 ARG 33 19.782 26.051 10.851 221 HD2 ARG 33 HD2 ARG 33 18.408 24.976 9.252 222 HD3 ARG 33 HD1 ARG 33 17.926 26.662 9.334 223 HE ARG 33 HE ARG 33 18.432 26.896 7.072 224 HH11 ARG 33 1HH1 ARG 33 20.173 23.902 8.161 225 HH12 ARG 33 2HH1 ARG 33 20.542 23.549 6.486 226 HH21 ARG 33 1HH2 ARG 33 18.880 26.124 4.981 227 HH22 ARG 33 2HH2 ARG 33 19.807 24.653 4.838 228 H1 CYS 34 H1 CYS 34 12.512 28.890 19.506 229 H2 CYS 34 H2 CYS 34 12.014 28.268 18.094 230 H3 CYS 34 H3 CYS 34 11.817 27.424 19.513 231 HA CYS 34 HA CYS 34 14.287 27.390 19.687 232 HB2 CYS 34 HB2 CYS 34 13.032 26.169 17.197 233 HB3 CYS 34 HB1 CYS 34 14.576 25.699 17.847 234 H GLY 35 H GLY 35 16.083 28.460 19.117 235 HA2 GLY 35 HA2 GLY 35 16.816 29.636 16.719 236 HA3 GLY 35 HA1 GLY 35 15.961 30.894 17.693 237 H THR 36 H THR 36 18.641 28.664 17.688 238 HA THR 36 HA THR 36 19.597 29.616 20.360 239 HB THR 36 HB THR 36 19.074 26.756 19.488 240 HG1 THR 36 HG1 THR 36 17.362 27.212 21.188 241 HG21 THR 36 1HG2 THR 36 18.937 26.280 21.864 242 HG22 THR 36 2HG2 THR 36 20.502 26.927 21.526 243 HG23 THR 36 3HG2 THR 36 19.294 27.994 22.276 244 HA PRO 37 HA PRO 37 23.583 28.318 18.640 245 HB2 PRO 37 HB1 PRO 37 24.909 27.481 20.920 246 HB3 PRO 37 HB2 PRO 37 24.800 29.179 20.381 247 HG2 PRO 37 HG1 PRO 37 23.033 27.678 22.346 248 HG3 PRO 37 HG2 PRO 37 23.788 29.286 22.582 249 HD2 PRO 37 HD1 PRO 37 21.210 29.071 21.837 250 HD3 PRO 37 HD2 PRO 37 22.228 30.313 21.104 251 H ILE 38 H ILE 38 24.730 26.236 18.498 252 HA ILE 38 HA ILE 38 23.314 23.907 19.586 253 HB ILE 38 HB ILE 38 24.269 23.901 16.708 254 HG12 ILE 38 2HG1 ILE 38 21.804 23.471 16.245 255 HG13 ILE 38 1HG1 ILE 38 21.473 24.324 17.772 256 HG21 ILE 38 1HG2 ILE 38 23.088 21.721 16.680 257 HG22 ILE 38 2HG2 ILE 38 24.375 21.727 17.853 258 HG23 ILE 38 3HG2 ILE 38 22.696 21.904 18.384 259 HD11 ILE 38 HD1 ILE 38 21.287 25.796 15.812 260 HD12 ILE 38 HD2 ILE 38 22.608 26.366 16.807 261 HD13 ILE 38 HD3 ILE 38 22.956 25.393 15.363 262 H SER 39 H SER 39 26.091 24.080 17.291 263 HA SER 39 HA SER 39 27.880 22.897 19.239 264 HB2 SER 39 HB2 SER 39 28.213 24.123 16.443 265 HB3 SER 39 HB1 SER 39 29.457 23.203 17.358 266 HG SER 39 HG SER 39 28.494 21.450 16.875 267 H PHE 40 H PHE 40 29.911 23.774 19.813 268 HA PHE 40 HA PHE 40 30.270 26.694 20.154 269 HB2 PHE 40 HB2 PHE 40 30.142 24.511 22.195 270 HB3 PHE 40 HB1 PHE 40 30.832 26.087 22.517 271 HD1 PHE 40 HD1 PHE 40 29.397 27.891 23.248 272 HD2 PHE 40 HD2 PHE 40 27.773 24.159 21.850 273 HE1 PHE 40 HE1 PHE 40 27.136 28.543 24.042 274 HE2 PHE 40 HE2 PHE 40 25.524 24.875 22.551 275 HZ PHE 40 HZ PHE 40 25.229 27.005 23.829 276 H TYR 41 H TYR 41 32.514 26.826 21.373 277 HA TYR 41 HA TYR 41 34.495 25.514 19.640 278 HB2 TYR 41 HB2 TYR 41 34.705 27.704 21.678 279 HB3 TYR 41 HB1 TYR 41 36.049 27.104 20.745 280 HD1 TYR 41 HD1 TYR 41 35.735 29.812 20.821 281 HD2 TYR 41 HD2 TYR 41 33.621 27.081 18.290 282 HE1 TYR 41 HE1 TYR 41 35.266 31.663 19.230 283 HE2 TYR 41 HE2 TYR 41 33.200 28.867 16.652 284 HH TYR 41 HH TYR 41 33.149 31.241 16.469 285 H CYS 42 H CYS 42 34.742 23.442 20.387 286 HA CYS 42 HA CYS 42 36.012 23.163 23.031 287 HB2 CYS 42 HB1 CYS 42 34.159 21.635 22.336 288 HB3 CYS 42 HB2 CYS 42 35.269 20.979 21.105 Start of MODEL 7 1 H GLY 1 H GLY 1 19.167 16.571 19.629 2 HA2 GLY 1 HA2 GLY 1 18.073 15.540 17.507 3 HA3 GLY 1 HA1 GLY 1 16.643 16.360 18.139 4 H GLY 2 H GLY 2 16.507 18.726 18.062 5 HA2 GLY 2 HA2 GLY 2 18.262 19.870 16.031 6 HA3 GLY 2 HA1 GLY 2 16.649 20.366 16.472 7 H ALA 3 H ALA 3 16.536 22.131 17.852 8 HA ALA 3 HA ALA 3 18.751 23.065 19.490 9 HB1 ALA 3 HB1 ALA 3 19.226 25.066 18.121 10 HB2 ALA 3 HB2 ALA 3 19.483 23.614 17.164 11 HB3 ALA 3 HB3 ALA 3 18.018 24.532 16.917 12 H GLY 4 H GLY 4 17.766 24.013 21.260 13 HA2 GLY 4 HA2 GLY 4 15.373 25.635 21.121 14 HA3 GLY 4 HA1 GLY 4 15.077 23.925 21.462 15 H HIS 5 H HIS 5 14.419 24.273 23.509 16 HA HIS 5 HA HIS 5 15.993 25.834 25.471 17 HB2 HIS 5 HB2 HIS 5 13.835 26.177 26.617 18 HB3 HIS 5 HB1 HIS 5 13.886 26.803 25.018 19 HD2 HIS 5 HD2 HIS 5 11.784 24.568 27.129 20 HE1 HIS 5 HE1 HIS 5 10.410 23.876 23.148 21 HE2 HIS 5 HE2 HIS 5 9.965 23.408 25.577 22 H VAL 6 H VAL 6 14.809 22.668 24.986 23 HA VAL 6 HA VAL 6 15.873 21.850 27.622 24 HB VAL 6 HB VAL 6 14.401 19.821 27.375 25 HG11 VAL 6 1HG1 VAL 6 12.552 21.034 28.620 26 HG12 VAL 6 2HG1 VAL 6 14.198 21.370 29.191 27 HG13 VAL 6 3HG1 VAL 6 13.358 22.548 28.173 28 HG21 VAL 6 1HG2 VAL 6 12.256 20.141 26.300 29 HG22 VAL 6 2HG2 VAL 6 12.703 21.769 25.787 30 HG23 VAL 6 3HG2 VAL 6 13.533 20.369 25.080 31 HA PRO 7 HA PRO 7 18.712 20.201 24.905 32 HB2 PRO 7 HB1 PRO 7 20.655 19.241 26.633 33 HB3 PRO 7 HB2 PRO 7 20.209 20.964 26.417 34 HG2 PRO 7 HG1 PRO 7 19.196 19.060 28.533 35 HG3 PRO 7 HG2 PRO 7 19.939 20.684 28.787 36 HD2 PRO 7 HD1 PRO 7 17.227 20.283 28.644 37 HD3 PRO 7 HD2 PRO 7 17.992 21.748 27.950 38 H GLU 8 H GLU 8 19.609 18.318 23.990 39 HA GLU 8 HA GLU 8 18.064 15.846 24.495 40 HB2 GLU 8 HB2 GLU 8 17.411 16.949 22.465 41 HB3 GLU 8 HB1 GLU 8 19.093 17.209 21.991 42 HG2 GLU 8 HG2 GLU 8 19.382 14.832 21.499 43 HG3 GLU 8 HG1 GLU 8 17.831 14.501 22.277 44 H TYR 9 H TYR 9 21.254 17.015 23.660 45 HA TYR 9 HA TYR 9 22.330 14.624 25.054 46 HB2 TYR 9 HB2 TYR 9 23.287 15.847 22.485 47 HB3 TYR 9 HB1 TYR 9 24.339 14.869 23.500 48 HD1 TYR 9 HD1 TYR 9 23.816 12.486 23.944 49 HD2 TYR 9 HD2 TYR 9 21.700 14.740 20.960 50 HE1 TYR 9 HE1 TYR 9 23.057 10.339 22.843 51 HE2 TYR 9 HE2 TYR 9 20.977 12.746 19.875 52 HH TYR 9 HH TYR 9 21.172 10.360 19.877 53 H PHE 10 H PHE 10 23.014 15.412 26.957 54 HA PHE 10 HA PHE 10 24.387 17.993 27.034 55 HB2 PHE 10 HB2 PHE 10 22.896 16.974 28.877 56 HB3 PHE 10 HB1 PHE 10 24.343 16.039 29.312 57 HD1 PHE 10 HD1 PHE 10 22.507 19.113 29.623 58 HD2 PHE 10 HD2 PHE 10 26.491 17.478 29.909 59 HE1 PHE 10 HE1 PHE 10 23.255 21.139 30.784 60 HE2 PHE 10 HE2 PHE 10 27.221 19.539 31.010 61 HZ PHE 10 HZ PHE 10 25.596 21.387 31.477 62 H VAL 11 H VAL 11 25.207 14.556 27.101 63 HA VAL 11 HA VAL 11 27.876 15.148 26.076 64 HB VAL 11 HB VAL 11 27.877 13.110 28.254 65 HG11 VAL 11 1HG1 VAL 11 30.144 14.012 28.552 66 HG12 VAL 11 2HG1 VAL 11 29.857 13.461 26.887 67 HG13 VAL 11 3HG1 VAL 11 29.838 15.209 27.302 68 HG21 VAL 11 1HG2 VAL 11 28.515 14.651 29.975 69 HG22 VAL 11 2HG2 VAL 11 28.156 16.044 28.990 70 HG23 VAL 11 3HG2 VAL 11 26.837 14.969 29.511 71 H ARG 12 H ARG 12 28.803 13.207 25.132 72 HA ARG 12 HA ARG 12 27.083 11.218 24.011 73 HB2 ARG 12 HB2 ARG 12 29.105 10.310 23.119 74 HB3 ARG 12 HB1 ARG 12 28.953 11.996 22.791 75 HG2 ARG 12 HG2 ARG 12 30.555 11.621 25.192 76 HG3 ARG 12 HG1 ARG 12 31.115 10.523 23.949 77 HD2 ARG 12 HD2 ARG 12 32.349 12.624 23.820 78 HD3 ARG 12 HD1 ARG 12 31.370 12.410 22.373 79 HE ARG 12 HE ARG 12 29.935 14.158 22.974 80 HH11 ARG 12 1HH1 ARG 12 32.386 13.938 25.626 81 HH12 ARG 12 2HH1 ARG 12 31.874 15.542 26.101 82 HH21 ARG 12 1HH2 ARG 12 29.413 15.994 23.740 83 HH22 ARG 12 2HH2 ARG 12 30.191 16.698 25.138 84 H1 CYS 13 H1 CYS 13 36.025 20.594 28.768 85 H2 CYS 13 H2 CYS 13 36.595 19.714 27.506 86 H3 CYS 13 H3 CYS 13 37.025 21.264 27.654 87 HA CYS 13 HA CYS 13 34.823 21.996 27.238 88 HB2 CYS 13 HB2 CYS 13 35.614 19.913 25.173 89 HB3 CYS 13 HB1 CYS 13 34.532 21.309 24.947 90 H GLY 14 H GLY 14 32.952 21.638 28.140 91 HA2 GLY 14 HA2 GLY 14 31.290 19.376 27.285 92 HA3 GLY 14 HA1 GLY 14 31.486 19.489 29.033 93 H THR 15 H THR 15 29.517 20.248 26.558 94 HA THR 15 HA THR 15 27.859 21.926 28.212 95 HB THR 15 HB THR 15 29.528 23.461 26.989 96 HG1 THR 15 HG1 THR 15 26.963 24.175 26.152 97 HG21 THR 15 1HG2 THR 15 29.120 24.026 24.725 98 HG22 THR 15 2HG2 THR 15 29.527 22.312 24.811 99 HG23 THR 15 3HG2 THR 15 27.849 22.760 24.552 100 HA PRO 16 HA PRO 16 25.106 19.389 25.785 101 HB2 PRO 16 HB1 PRO 16 22.724 20.756 25.693 102 HB3 PRO 16 HB2 PRO 16 23.390 19.973 27.155 103 HG2 PRO 16 HG1 PRO 16 23.656 22.905 26.445 104 HG3 PRO 16 HG2 PRO 16 23.101 22.179 27.956 105 HD2 PRO 16 HD1 PRO 16 25.624 22.995 27.637 106 HD3 PRO 16 HD2 PRO 16 25.307 21.495 28.535 107 H ILE 17 H ILE 17 24.397 19.095 23.719 108 HA ILE 17 HA ILE 17 25.418 21.128 21.808 109 HB ILE 17 HB ILE 17 25.197 18.194 21.301 110 HG12 ILE 17 2HG1 ILE 17 27.825 18.644 21.360 111 HG13 ILE 17 1HG1 ILE 17 27.383 19.889 22.509 112 HG21 ILE 17 1HG2 ILE 17 26.592 18.647 19.410 113 HG22 ILE 17 2HG2 ILE 17 25.130 19.615 19.296 114 HG23 ILE 17 3HG2 ILE 17 26.676 20.353 19.845 115 HD11 ILE 17 HD1 ILE 17 28.042 17.791 23.584 116 HD12 ILE 17 HD2 ILE 17 26.372 18.183 24.012 117 HD13 ILE 17 HD3 ILE 17 26.653 16.935 22.827 118 H SER 18 H SER 18 23.099 18.416 21.295 119 HA SER 18 HA SER 18 21.326 20.384 19.942 120 HB2 SER 18 HB2 SER 18 20.187 18.567 19.035 121 HB3 SER 18 HB1 SER 18 21.924 18.289 18.784 122 HG SER 18 HG SER 18 21.577 16.472 19.709 123 H PHE 19 H PHE 19 19.037 19.877 20.158 124 HA PHE 19 HA PHE 19 18.086 19.551 22.968 125 HB2 PHE 19 HB2 PHE 19 17.485 21.826 21.059 126 HB3 PHE 19 HB1 PHE 19 16.697 21.619 22.602 127 HD1 PHE 19 HD1 PHE 19 20.168 22.329 21.161 128 HD2 PHE 19 HD2 PHE 19 17.477 22.595 24.549 129 HE1 PHE 19 HE1 PHE 19 21.848 23.558 22.441 130 HE2 PHE 19 HE2 PHE 19 19.267 23.832 25.796 131 HZ PHE 19 HZ PHE 19 21.444 24.281 24.672 132 H TYR 20 H TYR 20 15.677 19.491 23.191 133 HA TYR 20 HA TYR 20 14.875 17.429 21.317 134 HB2 TYR 20 HB2 TYR 20 13.370 18.650 23.644 135 HB3 TYR 20 HB1 TYR 20 12.839 17.299 22.657 136 HD1 TYR 20 HD1 TYR 20 13.793 17.861 25.732 137 HD2 TYR 20 HD2 TYR 20 14.952 15.483 22.367 138 HE1 TYR 20 HE1 TYR 20 14.779 16.206 27.264 139 HE2 TYR 20 HE2 TYR 20 16.156 13.894 23.882 140 HH TYR 20 HH TYR 20 16.692 13.354 26.097 141 H CYS 21 H CYS 21 14.481 20.802 21.212 142 HA CYS 21 HA CYS 21 12.069 20.715 19.624 143 HB2 CYS 21 HB2 CYS 21 12.892 22.702 20.866 144 HB3 CYS 21 HB1 CYS 21 14.081 22.955 19.556 145 H GLY 22 H GLY 22 32.079 24.520 17.810 146 HA2 GLY 22 HA2 GLY 22 31.774 22.858 15.657 147 HA3 GLY 22 HA1 GLY 22 33.390 23.420 15.407 148 H GLY 23 H GLY 23 33.010 23.179 18.780 149 HA2 GLY 23 HA2 GLY 23 33.153 20.242 18.981 150 HA3 GLY 23 HA1 GLY 23 34.243 21.388 19.926 151 H ALA 24 H ALA 24 33.155 20.728 21.934 152 HA ALA 24 HA ALA 24 30.681 22.254 22.311 153 HB1 ALA 24 HB1 ALA 24 29.669 20.298 23.506 154 HB2 ALA 24 HB2 ALA 24 29.833 20.067 21.781 155 HB3 ALA 24 HB3 ALA 24 30.970 19.282 22.952 156 H GLY 25 H GLY 25 32.223 23.728 23.244 157 HA2 GLY 25 HA2 GLY 25 32.958 23.033 25.971 158 HA3 GLY 25 HA1 GLY 25 34.107 23.833 24.911 159 H HIS 26 H HIS 26 33.821 26.175 24.544 160 HA HIS 26 HA HIS 26 32.579 27.190 26.988 161 HB2 HIS 26 HB2 HIS 26 34.359 28.710 27.043 162 HB3 HIS 26 HB1 HIS 26 34.839 27.047 27.037 163 HD2 HIS 26 HD2 HIS 26 35.912 30.195 25.612 164 HE1 HIS 26 HE1 HIS 26 37.416 27.274 22.883 165 HE2 HIS 26 HE2 HIS 26 37.540 29.687 23.594 166 H VAL 27 H VAL 27 32.738 28.475 23.580 167 HA VAL 27 HA VAL 27 30.431 30.124 24.249 168 HB VAL 27 HB VAL 27 31.376 31.963 22.965 169 HG11 VAL 27 1HG1 VAL 27 32.873 32.861 24.540 170 HG12 VAL 27 2HG1 VAL 27 31.546 31.974 25.353 171 HG13 VAL 27 3HG1 VAL 27 33.139 31.216 25.260 172 HG21 VAL 27 1HG2 VAL 27 33.813 32.043 22.457 173 HG22 VAL 27 2HG2 VAL 27 33.998 30.370 22.939 174 HG23 VAL 27 3HG2 VAL 27 33.011 30.791 21.521 175 HA PRO 28 HA PRO 28 28.743 28.149 21.109 176 HB2 PRO 28 HB1 PRO 28 26.997 29.766 19.718 177 HB3 PRO 28 HB2 PRO 28 26.775 29.287 21.403 178 HG2 PRO 28 HG1 PRO 28 28.034 31.840 20.380 179 HG3 PRO 28 HG2 PRO 28 26.742 31.619 21.612 180 HD2 PRO 28 HD1 PRO 28 29.418 31.981 22.191 181 HD3 PRO 28 HD2 PRO 28 28.373 30.903 23.189 182 H GLU 29 H GLU 29 28.560 27.390 18.999 183 HA GLU 29 HA GLU 29 29.649 28.839 16.688 184 HB2 GLU 29 HB2 GLU 29 29.735 25.854 17.257 185 HB3 GLU 29 HB1 GLU 29 29.976 26.591 15.667 186 HG2 GLU 29 HG2 GLU 29 31.976 27.785 16.583 187 HG3 GLU 29 HG1 GLU 29 31.791 26.754 18.031 188 H TYR 30 H TYR 30 28.579 28.014 14.782 189 HA TYR 30 HA TYR 30 26.796 27.790 13.405 190 HB2 TYR 30 HB2 TYR 30 26.399 25.262 14.954 191 HB3 TYR 30 HB1 TYR 30 25.828 25.703 13.341 192 HD1 TYR 30 HD1 TYR 30 28.231 26.788 12.022 193 HD2 TYR 30 HD2 TYR 30 27.869 23.549 14.812 194 HE1 TYR 30 HE1 TYR 30 30.433 25.968 11.357 195 HE2 TYR 30 HE2 TYR 30 30.093 22.671 14.075 196 HH TYR 30 HH TYR 30 32.021 24.287 11.600 197 H PHE 31 H PHE 31 25.976 29.686 15.002 198 HA PHE 31 HA PHE 31 24.058 29.225 16.870 199 HB2 PHE 31 HB2 PHE 31 25.273 31.327 16.273 200 HB3 PHE 31 HB1 PHE 31 23.952 31.717 15.171 201 HD1 PHE 31 HD1 PHE 31 21.590 31.987 16.205 202 HD2 PHE 31 HD2 PHE 31 25.149 31.586 18.566 203 HE1 PHE 31 HE1 PHE 31 20.421 32.978 18.169 204 HE2 PHE 31 HE2 PHE 31 23.976 32.537 20.539 205 HZ PHE 31 HZ PHE 31 21.623 33.229 20.331 206 H VAL 32 H VAL 32 23.424 29.597 13.452 207 HA VAL 32 HA VAL 32 20.842 28.362 13.641 208 HB VAL 32 HB VAL 32 20.281 30.642 14.244 209 HG11 VAL 32 1HG1 VAL 32 20.533 32.535 12.798 210 HG12 VAL 32 2HG1 VAL 32 22.074 31.937 13.325 211 HG13 VAL 32 3HG1 VAL 32 21.546 31.608 11.653 212 HG21 VAL 32 1HG2 VAL 32 18.569 31.210 12.742 213 HG22 VAL 32 2HG2 VAL 32 19.315 30.242 11.424 214 HG23 VAL 32 3HG2 VAL 32 18.617 29.444 12.824 215 H ARG 33 H ARG 33 20.014 27.839 11.617 216 HA ARG 33 HA ARG 33 21.510 28.502 9.197 217 HB2 ARG 33 HB2 ARG 33 21.307 26.172 8.333 218 HB3 ARG 33 HB1 ARG 33 22.514 26.445 9.595 219 HG2 ARG 33 HG2 ARG 33 21.398 24.251 9.690 220 HG3 ARG 33 HG1 ARG 33 21.295 25.228 11.159 221 HD2 ARG 33 HD2 ARG 33 19.260 23.985 10.681 222 HD3 ARG 33 HD1 ARG 33 18.923 25.718 10.632 223 HE ARG 33 HE ARG 33 18.333 25.516 8.465 224 HH11 ARG 33 1HH1 ARG 33 19.895 22.334 9.173 225 HH12 ARG 33 2HH1 ARG 33 19.340 21.772 7.598 226 HH21 ARG 33 1HH2 ARG 33 17.872 24.600 6.490 227 HH22 ARG 33 2HH2 ARG 33 18.222 22.846 6.276 228 H1 CYS 34 H1 CYS 34 12.137 29.285 20.214 229 H2 CYS 34 H2 CYS 34 11.479 28.558 18.902 230 H3 CYS 34 H3 CYS 34 11.335 27.890 20.402 231 HA CYS 34 HA CYS 34 13.681 27.471 20.485 232 HB2 CYS 34 HB2 CYS 34 12.510 26.474 17.886 233 HB3 CYS 34 HB1 CYS 34 13.821 25.728 18.777 234 H GLY 35 H GLY 35 15.335 28.633 20.346 235 HA2 GLY 35 HA2 GLY 35 16.544 29.484 17.810 236 HA3 GLY 35 HA1 GLY 35 16.012 30.801 18.853 237 H THR 36 H THR 36 18.088 27.965 18.830 238 HA THR 36 HA THR 36 19.897 29.223 20.838 239 HB THR 36 HB THR 36 19.144 26.338 20.755 240 HG1 THR 36 HG1 THR 36 18.092 26.816 22.676 241 HG21 THR 36 1HG2 THR 36 20.155 26.102 22.915 242 HG22 THR 36 2HG2 THR 36 21.393 26.657 21.827 243 HG23 THR 36 3HG2 THR 36 20.609 27.820 22.954 244 HA PRO 37 HA PRO 37 23.079 27.634 17.941 245 HB2 PRO 37 HB1 PRO 37 25.226 27.454 19.652 246 HB3 PRO 37 HB2 PRO 37 24.667 28.950 18.926 247 HG2 PRO 37 HG1 PRO 37 23.972 27.919 21.661 248 HG3 PRO 37 HG2 PRO 37 24.535 29.559 21.233 249 HD2 PRO 37 HD1 PRO 37 21.887 29.087 21.554 250 HD3 PRO 37 HD2 PRO 37 22.439 30.071 20.191 251 H ILE 38 H ILE 38 24.763 25.871 18.077 252 HA ILE 38 HA ILE 38 23.629 23.484 19.452 253 HB ILE 38 HB ILE 38 24.559 23.529 16.598 254 HG12 ILE 38 2HG1 ILE 38 22.033 22.448 16.579 255 HG13 ILE 38 1HG1 ILE 38 21.843 23.545 17.910 256 HG21 ILE 38 1HG2 ILE 38 23.889 21.158 16.543 257 HG22 ILE 38 2HG2 ILE 38 25.288 21.434 17.563 258 HG23 ILE 38 3HG2 ILE 38 23.671 21.186 18.262 259 HD11 ILE 38 HD1 ILE 38 21.166 24.577 15.755 260 HD12 ILE 38 HD2 ILE 38 22.539 25.444 16.458 261 HD13 ILE 38 HD3 ILE 38 22.775 24.327 15.121 262 H SER 39 H SER 39 26.471 23.513 17.377 263 HA SER 39 HA SER 39 28.177 22.409 19.403 264 HB2 SER 39 HB2 SER 39 28.893 23.960 16.895 265 HB3 SER 39 HB1 SER 39 30.016 22.971 17.812 266 HG SER 39 HG SER 39 29.126 21.211 16.973 267 H PHE 40 H PHE 40 30.107 23.443 20.281 268 HA PHE 40 HA PHE 40 30.018 26.422 20.560 269 HB2 PHE 40 HB2 PHE 40 30.219 24.307 22.697 270 HB3 PHE 40 HB1 PHE 40 31.098 25.817 22.864 271 HD1 PHE 40 HD1 PHE 40 30.114 27.227 24.291 272 HD2 PHE 40 HD2 PHE 40 27.542 24.854 21.831 273 HE1 PHE 40 HE1 PHE 40 28.145 28.664 24.901 274 HE2 PHE 40 HE2 PHE 40 25.644 26.275 22.390 275 HZ PHE 40 HZ PHE 40 25.927 28.207 23.996 276 H TYR 41 H TYR 41 32.242 27.124 21.414 277 HA TYR 41 HA TYR 41 34.465 26.166 19.734 278 HB2 TYR 41 HB2 TYR 41 34.120 28.146 21.954 279 HB3 TYR 41 HB1 TYR 41 35.714 27.758 21.311 280 HD1 TYR 41 HD1 TYR 41 36.468 29.808 20.506 281 HD2 TYR 41 HD2 TYR 41 32.565 28.431 19.350 282 HE1 TYR 41 HE1 TYR 41 36.202 31.716 18.878 283 HE2 TYR 41 HE2 TYR 41 32.360 30.222 17.719 284 HH TYR 41 HH TYR 41 33.337 32.144 16.923 285 H CYS 42 H CYS 42 36.506 25.456 20.828 286 HA CYS 42 HA CYS 42 36.245 24.345 23.466 287 HB2 CYS 42 HB2 CYS 42 35.234 22.481 22.201 288 HB3 CYS 42 HB1 CYS 42 36.578 22.519 21.044 Start of MODEL 8 1 H GLY 1 H GLY 1 18.058 16.593 20.337 2 HA2 GLY 1 HA2 GLY 1 19.152 15.857 18.107 3 HA3 GLY 1 HA1 GLY 1 17.600 15.027 17.919 4 H GLY 2 H GLY 2 19.164 18.225 18.153 5 HA2 GLY 2 HA2 GLY 2 18.043 19.755 16.437 6 HA3 GLY 2 HA1 GLY 2 16.683 19.672 17.544 7 H ALA 3 H ALA 3 17.053 21.946 17.651 8 HA ALA 3 HA ALA 3 18.693 22.712 19.995 9 HB1 ALA 3 HB1 ALA 3 19.317 24.823 19.014 10 HB2 ALA 3 HB2 ALA 3 19.943 23.433 18.074 11 HB3 ALA 3 HB3 ALA 3 18.602 24.377 17.435 12 H GLY 4 H GLY 4 17.631 24.002 21.413 13 HA2 GLY 4 HA2 GLY 4 15.238 25.473 20.789 14 HA3 GLY 4 HA1 GLY 4 14.877 23.895 21.468 15 H HIS 5 H HIS 5 14.651 23.676 23.444 16 HA HIS 5 HA HIS 5 15.769 25.572 25.433 17 HB2 HIS 5 HB2 HIS 5 13.564 25.851 26.362 18 HB3 HIS 5 HB1 HIS 5 13.558 26.321 24.677 19 HD2 HIS 5 HD2 HIS 5 11.670 24.248 27.077 20 HE1 HIS 5 HE1 HIS 5 10.487 22.745 23.282 21 HE2 HIS 5 HE2 HIS 5 9.910 22.766 25.736 22 H VAL 6 H VAL 6 14.628 22.196 24.956 23 HA VAL 6 HA VAL 6 15.671 21.672 27.658 24 HB VAL 6 HB VAL 6 14.217 19.629 27.715 25 HG11 VAL 6 1HG1 VAL 6 12.199 20.980 28.404 26 HG12 VAL 6 2HG1 VAL 6 13.761 21.547 29.092 27 HG13 VAL 6 3HG1 VAL 6 13.001 22.394 27.773 28 HG21 VAL 6 1HG2 VAL 6 12.216 19.550 26.406 29 HG22 VAL 6 2HG2 VAL 6 12.608 21.020 25.598 30 HG23 VAL 6 3HG2 VAL 6 13.628 19.555 25.304 31 HA PRO 7 HA PRO 7 18.712 19.638 25.441 32 HB2 PRO 7 HB1 PRO 7 19.858 17.904 27.277 33 HB3 PRO 7 HB2 PRO 7 20.074 19.686 27.290 34 HG2 PRO 7 HG1 PRO 7 18.164 18.053 28.872 35 HG3 PRO 7 HG2 PRO 7 19.163 19.418 29.467 36 HD2 PRO 7 HD1 PRO 7 16.616 19.866 28.871 37 HD3 PRO 7 HD2 PRO 7 17.884 21.034 28.348 38 H GLU 8 H GLU 8 19.568 17.683 24.555 39 HA GLU 8 HA GLU 8 17.992 15.261 24.744 40 HB2 GLU 8 HB2 GLU 8 17.275 16.570 22.671 41 HB3 GLU 8 HB1 GLU 8 18.960 16.491 22.126 42 HG2 GLU 8 HG2 GLU 8 18.558 13.900 22.294 43 HG3 GLU 8 HG1 GLU 8 16.881 14.330 22.496 44 H TYR 9 H TYR 9 21.012 16.751 23.551 45 HA TYR 9 HA TYR 9 22.565 14.363 24.359 46 HB2 TYR 9 HB2 TYR 9 23.310 15.975 21.956 47 HB3 TYR 9 HB1 TYR 9 24.033 14.639 22.551 48 HD1 TYR 9 HD1 TYR 9 22.210 15.367 19.827 49 HD2 TYR 9 HD2 TYR 9 22.027 12.573 23.111 50 HE1 TYR 9 HE1 TYR 9 20.774 13.959 18.517 51 HE2 TYR 9 HE2 TYR 9 20.513 11.168 21.831 52 HH TYR 9 HH TYR 9 19.957 10.722 19.609 53 H PHE 10 H PHE 10 22.658 15.151 26.235 54 HA PHE 10 HA PHE 10 23.997 17.547 27.060 55 HB2 PHE 10 HB2 PHE 10 22.288 16.092 28.299 56 HB3 PHE 10 HB1 PHE 10 23.647 15.069 28.735 57 HD1 PHE 10 HD1 PHE 10 21.836 18.133 29.418 58 HD2 PHE 10 HD2 PHE 10 25.532 16.072 30.110 59 HE1 PHE 10 HE1 PHE 10 22.318 19.697 31.298 60 HE2 PHE 10 HE2 PHE 10 26.036 17.652 31.916 61 HZ PHE 10 HZ PHE 10 24.446 19.490 32.507 62 H VAL 11 H VAL 11 25.155 14.327 26.232 63 HA VAL 11 HA VAL 11 27.937 15.262 26.684 64 HB VAL 11 HB VAL 11 27.165 13.952 28.633 65 HG11 VAL 11 1HG1 VAL 11 26.753 11.512 28.397 66 HG12 VAL 11 2HG1 VAL 11 25.432 12.540 27.741 67 HG13 VAL 11 3HG1 VAL 11 26.562 11.746 26.656 68 HG21 VAL 11 1HG2 VAL 11 28.897 12.593 28.919 69 HG22 VAL 11 2HG2 VAL 11 29.111 12.197 27.203 70 HG23 VAL 11 3HG2 VAL 11 29.538 13.824 27.864 71 H ARG 12 H ARG 12 29.434 13.551 25.795 72 HA ARG 12 HA ARG 12 29.069 13.167 22.956 73 HB2 ARG 12 HB2 ARG 12 31.071 11.942 24.821 74 HB3 ARG 12 HB1 ARG 12 31.198 12.005 23.062 75 HG2 ARG 12 HG2 ARG 12 31.141 14.551 24.729 76 HG3 ARG 12 HG1 ARG 12 32.590 13.616 24.366 77 HD2 ARG 12 HD2 ARG 12 32.616 15.268 22.838 78 HD3 ARG 12 HD1 ARG 12 32.078 13.859 21.905 79 HE ARG 12 HE ARG 12 29.688 14.870 22.356 80 HH11 ARG 12 1HH1 ARG 12 32.627 16.860 21.489 81 HH12 ARG 12 2HH1 ARG 12 31.617 17.742 20.354 82 HH21 ARG 12 1HH2 ARG 12 28.585 16.424 21.089 83 HH22 ARG 12 2HH2 ARG 12 29.527 17.593 20.229 84 H1 CYS 13 H1 CYS 13 36.868 21.520 29.534 85 H2 CYS 13 H2 CYS 13 37.461 20.667 28.236 86 H3 CYS 13 H3 CYS 13 37.819 22.279 28.469 87 HA CYS 13 HA CYS 13 35.575 22.942 28.161 88 HB2 CYS 13 HB2 CYS 13 36.692 21.087 26.057 89 HB3 CYS 13 HB1 CYS 13 35.217 22.023 25.785 90 H GLY 14 H GLY 14 33.596 21.454 26.723 91 HA2 GLY 14 HA2 GLY 14 32.387 19.326 27.766 92 HA3 GLY 14 HA1 GLY 14 32.362 20.447 29.148 93 H THR 15 H THR 15 30.234 20.840 29.168 94 HA THR 15 HA THR 15 28.433 22.060 28.958 95 HB THR 15 HB THR 15 30.040 23.504 27.296 96 HG1 THR 15 HG1 THR 15 28.553 24.251 28.690 97 HG21 THR 15 1HG2 THR 15 29.185 24.020 25.263 98 HG22 THR 15 2HG2 THR 15 29.242 22.284 25.227 99 HG23 THR 15 3HG2 THR 15 27.696 23.026 25.508 100 HA PRO 16 HA PRO 16 25.873 19.193 26.681 101 HB2 PRO 16 HB1 PRO 16 23.387 20.249 27.071 102 HB3 PRO 16 HB2 PRO 16 24.299 19.449 28.384 103 HG2 PRO 16 HG1 PRO 16 24.166 22.454 27.837 104 HG3 PRO 16 HG2 PRO 16 23.850 21.512 29.379 105 HD2 PRO 16 HD1 PRO 16 26.279 22.629 28.894 106 HD3 PRO 16 HD2 PRO 16 26.099 20.978 29.605 107 H ILE 17 H ILE 17 24.867 19.028 24.685 108 HA ILE 17 HA ILE 17 25.404 21.351 22.943 109 HB ILE 17 HB ILE 17 25.502 18.425 22.305 110 HG12 ILE 17 2HG1 ILE 17 28.109 19.148 22.096 111 HG13 ILE 17 1HG1 ILE 17 27.624 20.324 23.305 112 HG21 ILE 17 1HG2 ILE 17 26.593 19.014 20.295 113 HG22 ILE 17 2HG2 ILE 17 25.104 19.917 20.370 114 HG23 ILE 17 3HG2 ILE 17 26.633 20.732 20.770 115 HD11 ILE 17 HD1 ILE 17 28.630 18.225 24.217 116 HD12 ILE 17 HD2 ILE 17 26.969 18.412 24.828 117 HD13 ILE 17 HD3 ILE 17 27.294 17.302 23.525 118 H SER 18 H SER 18 23.526 18.448 21.941 119 HA SER 18 HA SER 18 21.568 20.208 20.756 120 HB2 SER 18 HB2 SER 18 21.531 17.186 21.081 121 HB3 SER 18 HB1 SER 18 20.560 18.106 20.004 122 HG SER 18 HG SER 18 22.105 18.187 18.661 123 H PHE 19 H PHE 19 19.417 20.077 20.890 124 HA PHE 19 HA PHE 19 18.142 19.510 23.518 125 HB2 PHE 19 HB2 PHE 19 17.471 21.642 21.445 126 HB3 PHE 19 HB1 PHE 19 16.686 21.427 22.970 127 HD1 PHE 19 HD1 PHE 19 17.328 22.435 24.950 128 HD2 PHE 19 HD2 PHE 19 19.993 22.458 21.572 129 HE1 PHE 19 HE1 PHE 19 18.656 24.220 26.005 130 HE2 PHE 19 HE2 PHE 19 21.352 24.197 22.665 131 HZ PHE 19 HZ PHE 19 20.643 25.164 24.844 132 H TYR 20 H TYR 20 15.651 19.409 23.141 133 HA TYR 20 HA TYR 20 14.878 18.027 20.619 134 HB2 TYR 20 HB2 TYR 20 13.415 18.918 23.106 135 HB3 TYR 20 HB1 TYR 20 12.608 18.277 21.684 136 HD1 TYR 20 HD1 TYR 20 12.663 15.951 21.185 137 HD2 TYR 20 HD2 TYR 20 14.861 17.458 24.513 138 HE1 TYR 20 HE1 TYR 20 12.991 13.643 21.960 139 HE2 TYR 20 HE2 TYR 20 15.380 15.140 25.246 140 HH TYR 20 HH TYR 20 15.167 12.907 24.750 141 H CYS 21 H CYS 21 13.048 18.991 19.536 142 HA CYS 21 HA CYS 21 12.026 21.419 20.187 143 HB2 CYS 21 HB2 CYS 21 14.005 22.417 18.922 144 HB3 CYS 21 HB1 CYS 21 13.359 21.698 17.472 145 H GLY 22 H GLY 22 32.567 24.197 16.433 146 HA2 GLY 22 HA2 GLY 22 30.403 22.367 15.857 147 HA3 GLY 22 HA1 GLY 22 31.773 22.116 14.762 148 H GLY 23 H GLY 23 32.895 23.100 17.760 149 HA2 GLY 23 HA2 GLY 23 33.313 20.340 18.699 150 HA3 GLY 23 HA1 GLY 23 34.182 21.768 19.271 151 H ALA 24 H ALA 24 33.569 20.704 21.307 152 HA ALA 24 HA ALA 24 31.096 21.929 22.400 153 HB1 ALA 24 HB1 ALA 24 30.733 20.140 23.847 154 HB2 ALA 24 HB2 ALA 24 30.801 19.448 22.225 155 HB3 ALA 24 HB3 ALA 24 32.210 19.297 23.266 156 H GLY 25 H GLY 25 31.632 23.546 23.700 157 HA2 GLY 25 HA2 GLY 25 33.446 23.496 25.824 158 HA3 GLY 25 HA1 GLY 25 34.238 24.406 24.501 159 H HIS 26 H HIS 26 33.471 26.511 24.164 160 HA HIS 26 HA HIS 26 31.855 27.390 26.465 161 HB2 HIS 26 HB2 HIS 26 33.719 28.797 27.109 162 HB3 HIS 26 HB1 HIS 26 33.919 27.075 27.182 163 HD2 HIS 26 HD2 HIS 26 36.641 27.487 27.135 164 HE1 HIS 26 HE1 HIS 26 36.840 28.433 22.984 165 HE2 HIS 26 HE2 HIS 26 38.180 27.838 25.104 166 H VAL 27 H VAL 27 32.364 28.239 23.121 167 HA VAL 27 HA VAL 27 30.275 30.176 23.587 168 HB VAL 27 HB VAL 27 31.223 31.779 21.906 169 HG11 VAL 27 1HG1 VAL 27 32.567 32.981 23.543 170 HG12 VAL 27 2HG1 VAL 27 31.146 32.285 24.301 171 HG13 VAL 27 3HG1 VAL 27 32.764 31.540 24.502 172 HG21 VAL 27 1HG2 VAL 27 33.656 31.925 21.687 173 HG22 VAL 27 2HG2 VAL 27 33.832 30.330 22.448 174 HG23 VAL 27 3HG2 VAL 27 33.014 30.547 20.847 175 HA PRO 28 HA PRO 28 28.633 27.761 20.504 176 HB2 PRO 28 HB1 PRO 28 26.688 29.279 19.259 177 HB3 PRO 28 HB2 PRO 28 26.670 28.664 20.977 178 HG2 PRO 28 HG1 PRO 28 27.518 31.342 19.900 179 HG3 PRO 28 HG2 PRO 28 26.329 31.034 21.212 180 HD2 PRO 28 HD1 PRO 28 28.938 31.573 21.821 181 HD3 PRO 28 HD2 PRO 28 28.039 30.300 22.702 182 H GLU 29 H GLU 29 28.537 27.165 18.329 183 HA GLU 29 HA GLU 29 29.861 28.699 16.172 184 HB2 GLU 29 HB2 GLU 29 31.624 27.428 17.244 185 HB3 GLU 29 HB1 GLU 29 30.593 26.013 17.346 186 HG2 GLU 29 HG2 GLU 29 31.237 26.977 14.610 187 HG3 GLU 29 HG1 GLU 29 32.578 26.415 15.569 188 H TYR 30 H TYR 30 29.001 28.229 14.173 189 HA TYR 30 HA TYR 30 27.164 28.030 12.931 190 HB2 TYR 30 HB2 TYR 30 27.398 25.157 13.652 191 HB3 TYR 30 HB1 TYR 30 26.338 25.805 12.420 192 HD1 TYR 30 HD1 TYR 30 28.151 27.689 10.980 193 HD2 TYR 30 HD2 TYR 30 28.704 23.659 12.414 194 HE1 TYR 30 HE1 TYR 30 29.895 27.195 9.169 195 HE2 TYR 30 HE2 TYR 30 30.483 23.296 10.741 196 HH TYR 30 HH TYR 30 31.532 24.097 8.949 197 H PHE 31 H PHE 31 26.065 29.392 14.407 198 HA PHE 31 HA PHE 31 24.300 28.465 16.462 199 HB2 PHE 31 HB2 PHE 31 25.358 30.813 16.050 200 HB3 PHE 31 HB1 PHE 31 24.014 31.068 14.949 201 HD1 PHE 31 HD1 PHE 31 21.596 30.794 15.841 202 HD2 PHE 31 HD2 PHE 31 25.055 31.173 18.380 203 HE1 PHE 31 HE1 PHE 31 20.194 31.748 17.633 204 HE2 PHE 31 HE2 PHE 31 23.617 32.132 20.155 205 HZ PHE 31 HZ PHE 31 21.189 32.359 19.815 206 H VAL 32 H VAL 32 24.159 28.990 13.071 207 HA VAL 32 HA VAL 32 21.497 27.724 12.872 208 HB VAL 32 HB VAL 32 21.248 30.134 12.826 209 HG11 VAL 32 1HG1 VAL 32 21.861 31.529 10.963 210 HG12 VAL 32 2HG1 VAL 32 23.302 30.711 11.486 211 HG13 VAL 32 3HG1 VAL 32 22.457 30.129 10.026 212 HG21 VAL 32 1HG2 VAL 32 19.582 30.267 11.333 213 HG22 VAL 32 2HG2 VAL 32 20.305 29.133 10.180 214 HG23 VAL 32 3HG2 VAL 32 19.587 28.549 11.720 215 H ARG 33 H ARG 33 21.116 27.376 10.324 216 HA ARG 33 HA ARG 33 23.588 26.931 8.872 217 HB2 ARG 33 HB2 ARG 33 23.252 24.724 8.209 218 HB3 ARG 33 HB1 ARG 33 23.278 24.749 9.931 219 HG2 ARG 33 HG2 ARG 33 21.638 23.219 9.502 220 HG3 ARG 33 HG1 ARG 33 20.718 24.669 9.952 221 HD2 ARG 33 HD2 ARG 33 19.836 23.311 8.132 222 HD3 ARG 33 HD1 ARG 33 20.020 25.012 7.701 223 HE ARG 33 HE ARG 33 21.505 24.391 6.036 224 HH11 ARG 33 1HH1 ARG 33 21.039 21.386 7.814 225 HH12 ARG 33 2HH1 ARG 33 22.380 20.622 6.973 226 HH21 ARG 33 1HH2 ARG 33 23.324 23.345 5.149 227 HH22 ARG 33 2HH2 ARG 33 23.633 21.660 5.588 228 H1 CYS 34 H1 CYS 34 12.245 29.194 18.732 229 H2 CYS 34 H2 CYS 34 12.055 28.153 17.483 230 H3 CYS 34 H3 CYS 34 11.522 27.741 18.987 231 HA CYS 34 HA CYS 34 13.764 27.675 19.811 232 HB2 CYS 34 HB2 CYS 34 13.230 26.045 17.321 233 HB3 CYS 34 HB1 CYS 34 14.699 25.879 18.274 234 H GLY 35 H GLY 35 15.048 29.423 19.747 235 HA2 GLY 35 HA2 GLY 35 16.633 30.075 17.296 236 HA3 GLY 35 HA1 GLY 35 15.942 31.266 18.413 237 H THR 36 H THR 36 17.720 28.293 18.655 238 HA THR 36 HA THR 36 19.754 29.369 20.615 239 HB THR 36 HB THR 36 18.096 26.827 20.615 240 HG1 THR 36 HG1 THR 36 17.289 27.753 22.481 241 HG21 THR 36 1HG2 THR 36 18.963 26.189 22.684 242 HG22 THR 36 2HG2 THR 36 20.402 26.401 21.694 243 HG23 THR 36 3HG2 THR 36 19.971 27.635 22.862 244 HA PRO 37 HA PRO 37 22.549 27.247 17.822 245 HB2 PRO 37 HB1 PRO 37 24.817 27.095 19.349 246 HB3 PRO 37 HB2 PRO 37 24.162 28.647 18.740 247 HG2 PRO 37 HG1 PRO 37 23.731 27.416 21.496 248 HG3 PRO 37 HG2 PRO 37 24.275 29.075 21.060 249 HD2 PRO 37 HD1 PRO 37 21.647 28.524 21.644 250 HD3 PRO 37 HD2 PRO 37 22.103 29.704 20.432 251 H ILE 38 H ILE 38 24.073 25.527 17.757 252 HA ILE 38 HA ILE 38 23.089 23.168 19.331 253 HB ILE 38 HB ILE 38 24.455 23.043 16.622 254 HG12 ILE 38 2HG1 ILE 38 22.476 21.943 15.810 255 HG13 ILE 38 1HG1 ILE 38 21.571 22.363 17.261 256 HG21 ILE 38 1HG2 ILE 38 23.849 20.627 16.820 257 HG22 ILE 38 2HG2 ILE 38 24.931 21.109 18.143 258 HG23 ILE 38 3HG2 ILE 38 23.217 20.908 18.418 259 HD11 ILE 38 HD1 ILE 38 21.085 23.812 15.252 260 HD12 ILE 38 HD2 ILE 38 21.539 24.671 16.721 261 HD13 ILE 38 HD3 ILE 38 22.710 24.447 15.386 262 H SER 39 H SER 39 26.047 24.028 17.526 263 HA SER 39 HA SER 39 27.645 22.608 19.545 264 HB2 SER 39 HB2 SER 39 28.497 23.544 16.776 265 HB3 SER 39 HB1 SER 39 29.198 22.277 17.762 266 HG SER 39 HG SER 39 27.511 21.991 15.909 267 H PHE 40 H PHE 40 30.112 23.468 19.425 268 HA PHE 40 HA PHE 40 30.127 26.328 20.079 269 HB2 PHE 40 HB2 PHE 40 30.947 23.957 21.750 270 HB3 PHE 40 HB1 PHE 40 31.309 25.618 22.187 271 HD1 PHE 40 HD1 PHE 40 28.603 23.145 21.823 272 HD2 PHE 40 HD2 PHE 40 29.637 27.114 23.080 273 HE1 PHE 40 HE1 PHE 40 26.385 23.429 22.822 274 HE2 PHE 40 HE2 PHE 40 27.377 27.407 24.130 275 HZ PHE 40 HZ PHE 40 25.785 25.523 24.042 276 H TYR 41 H TYR 41 32.275 27.035 20.706 277 HA TYR 41 HA TYR 41 34.613 26.024 19.219 278 HB2 TYR 41 HB2 TYR 41 34.160 28.255 21.225 279 HB3 TYR 41 HB1 TYR 41 35.714 27.849 20.587 280 HD1 TYR 41 HD1 TYR 41 36.626 29.479 19.362 281 HD2 TYR 41 HD2 TYR 41 32.381 28.645 18.905 282 HE1 TYR 41 HE1 TYR 41 36.344 31.392 17.836 283 HE2 TYR 41 HE2 TYR 41 32.173 30.443 17.300 284 HH TYR 41 HH TYR 41 34.813 32.776 16.881 285 H CYS 42 H CYS 42 36.379 25.197 20.343 286 HA CYS 42 HA CYS 42 36.504 25.449 23.258 287 HB2 CYS 42 HB2 CYS 42 35.711 23.136 23.120 288 HB3 CYS 42 HB1 CYS 42 36.874 22.801 21.838 Start of MODEL 9 1 H GLY 1 H GLY 1 18.422 17.072 20.537 2 HA2 GLY 1 HA2 GLY 1 19.723 15.775 18.543 3 HA3 GLY 1 HA1 GLY 1 18.077 15.304 18.272 4 H GLY 2 H GLY 2 17.546 18.413 19.290 5 HA2 GLY 2 HA2 GLY 2 18.247 19.604 16.654 6 HA3 GLY 2 HA1 GLY 2 16.616 19.704 17.310 7 H ALA 3 H ALA 3 17.645 21.971 16.597 8 HA ALA 3 HA ALA 3 19.219 23.337 18.593 9 HB1 ALA 3 HB1 ALA 3 18.815 25.291 17.093 10 HB2 ALA 3 HB2 ALA 3 19.440 23.856 16.251 11 HB3 ALA 3 HB3 ALA 3 17.732 24.263 16.127 12 H GLY 4 H GLY 4 17.477 22.474 20.202 13 HA2 GLY 4 HA2 GLY 4 15.329 24.518 20.602 14 HA3 GLY 4 HA1 GLY 4 15.256 22.808 21.073 15 H HIS 5 H HIS 5 14.523 23.547 23.036 16 HA HIS 5 HA HIS 5 15.917 25.665 24.511 17 HB2 HIS 5 HB2 HIS 5 13.772 25.707 25.851 18 HB3 HIS 5 HB1 HIS 5 13.771 26.239 24.192 19 HD2 HIS 5 HD2 HIS 5 12.911 22.827 26.033 20 HE1 HIS 5 HE1 HIS 5 10.398 23.192 22.613 21 HE2 HIS 5 HE2 HIS 5 11.091 21.716 24.566 22 H VAL 6 H VAL 6 15.458 22.253 25.103 23 HA VAL 6 HA VAL 6 17.016 22.570 27.531 24 HB VAL 6 HB VAL 6 15.639 21.026 28.793 25 HG11 VAL 6 1HG1 VAL 6 13.857 22.450 29.391 26 HG12 VAL 6 2HG1 VAL 6 15.293 23.432 29.019 27 HG13 VAL 6 3HG1 VAL 6 13.960 23.348 27.843 28 HG21 VAL 6 1HG2 VAL 6 13.796 20.951 26.439 29 HG22 VAL 6 2HG2 VAL 6 14.688 19.636 27.296 30 HG23 VAL 6 3HG2 VAL 6 13.370 20.405 28.092 31 HA PRO 7 HA PRO 7 19.531 19.931 25.655 32 HB2 PRO 7 HB1 PRO 7 20.981 18.665 27.537 33 HB3 PRO 7 HB2 PRO 7 20.947 20.488 27.373 34 HG2 PRO 7 HG1 PRO 7 19.333 18.720 29.250 35 HG3 PRO 7 HG2 PRO 7 20.315 20.172 29.655 36 HD2 PRO 7 HD1 PRO 7 17.661 20.360 29.204 37 HD3 PRO 7 HD2 PRO 7 18.774 21.640 28.669 38 H GLU 8 H GLU 8 19.865 18.202 24.505 39 HA GLU 8 HA GLU 8 18.448 15.679 24.984 40 HB2 GLU 8 HB2 GLU 8 18.084 17.167 22.968 41 HB3 GLU 8 HB1 GLU 8 19.712 16.754 22.423 42 HG2 GLU 8 HG2 GLU 8 18.736 14.302 22.854 43 HG3 GLU 8 HG1 GLU 8 17.210 15.139 22.626 44 H TYR 9 H TYR 9 21.508 16.922 23.673 45 HA TYR 9 HA TYR 9 22.860 14.372 24.443 46 HB2 TYR 9 HB2 TYR 9 23.334 16.248 22.176 47 HB3 TYR 9 HB1 TYR 9 24.430 15.023 22.621 48 HD1 TYR 9 HD1 TYR 9 21.332 13.451 23.155 49 HD2 TYR 9 HD2 TYR 9 23.706 14.943 19.907 50 HE1 TYR 9 HE1 TYR 9 20.205 11.889 21.615 51 HE2 TYR 9 HE2 TYR 9 22.635 13.379 18.396 52 HH TYR 9 HH TYR 9 21.371 11.307 18.412 53 H PHE 10 H PHE 10 23.690 14.943 26.488 54 HA PHE 10 HA PHE 10 25.358 17.255 26.966 55 HB2 PHE 10 HB2 PHE 10 24.625 14.760 28.486 56 HB3 PHE 10 HB1 PHE 10 26.006 15.720 28.955 57 HD1 PHE 10 HD1 PHE 10 22.384 15.711 28.892 58 HD2 PHE 10 HD2 PHE 10 25.888 18.066 29.695 59 HE1 PHE 10 HE1 PHE 10 21.014 17.184 30.348 60 HE2 PHE 10 HE2 PHE 10 24.516 19.617 31.006 61 HZ PHE 10 HZ PHE 10 22.156 19.129 31.467 62 H VAL 11 H VAL 11 25.990 13.884 26.023 63 HA VAL 11 HA VAL 11 28.923 14.501 25.883 64 HB VAL 11 HB VAL 11 27.593 12.015 27.031 65 HG11 VAL 11 1HG1 VAL 11 29.906 11.292 27.486 66 HG12 VAL 11 2HG1 VAL 11 29.605 11.371 25.761 67 HG13 VAL 11 3HG1 VAL 11 30.509 12.680 26.528 68 HG21 VAL 11 1HG2 VAL 11 28.945 12.779 29.028 69 HG22 VAL 11 2HG2 VAL 11 29.290 14.297 28.187 70 HG23 VAL 11 3HG2 VAL 11 27.643 13.884 28.586 71 H ARG 12 H ARG 12 29.666 14.361 23.960 72 HA ARG 12 HA ARG 12 28.275 12.961 21.785 73 HB2 ARG 12 HB2 ARG 12 29.851 14.045 20.325 74 HB3 ARG 12 HB1 ARG 12 28.814 15.098 21.228 75 HG2 ARG 12 HG2 ARG 12 30.976 16.061 21.066 76 HG3 ARG 12 HG1 ARG 12 30.560 15.768 22.761 77 HD2 ARG 12 HD2 ARG 12 32.922 15.261 22.322 78 HD3 ARG 12 HD1 ARG 12 32.051 13.814 22.805 79 HE ARG 12 HE ARG 12 32.217 12.970 20.636 80 HH11 ARG 12 1HH1 ARG 12 33.854 16.236 20.540 81 HH12 ARG 12 2HH1 ARG 12 34.487 15.792 18.959 82 HH21 ARG 12 1HH2 ARG 12 33.245 12.658 18.699 83 HH22 ARG 12 2HH2 ARG 12 34.222 13.928 17.993 84 H1 CYS 13 H1 CYS 13 35.587 21.979 29.369 85 H2 CYS 13 H2 CYS 13 36.344 21.129 28.113 86 H3 CYS 13 H3 CYS 13 36.159 22.766 28.061 87 HA CYS 13 HA CYS 13 33.894 22.691 27.751 88 HB2 CYS 13 HB2 CYS 13 34.839 20.469 25.969 89 HB3 CYS 13 HB1 CYS 13 33.756 21.777 25.632 90 H GLY 14 H GLY 14 31.996 21.619 27.804 91 HA2 GLY 14 HA2 GLY 14 31.329 18.962 28.023 92 HA3 GLY 14 HA1 GLY 14 31.727 19.388 29.679 93 H THR 15 H THR 15 29.672 20.061 26.919 94 HA THR 15 HA THR 15 27.485 21.393 28.409 95 HB THR 15 HB THR 15 29.172 22.694 26.238 96 HG1 THR 15 HG1 THR 15 28.632 23.357 28.935 97 HG21 THR 15 1HG2 THR 15 27.729 24.693 26.590 98 HG22 THR 15 2HG2 THR 15 26.939 23.398 25.748 99 HG23 THR 15 3HG2 THR 15 26.601 23.716 27.515 100 HA PRO 16 HA PRO 16 25.742 18.759 25.590 101 HB2 PRO 16 HB1 PRO 16 23.067 19.735 25.531 102 HB3 PRO 16 HB2 PRO 16 23.723 18.571 26.755 103 HG2 PRO 16 HG1 PRO 16 23.229 21.507 26.894 104 HG3 PRO 16 HG2 PRO 16 23.188 20.240 28.196 105 HD2 PRO 16 HD1 PRO 16 25.305 21.965 27.856 106 HD3 PRO 16 HD2 PRO 16 25.453 20.314 28.590 107 H ILE 17 H ILE 17 25.324 18.509 23.435 108 HA ILE 17 HA ILE 17 26.183 20.639 21.728 109 HB ILE 17 HB ILE 17 25.283 17.782 21.172 110 HG12 ILE 17 2HG1 ILE 17 27.848 17.587 20.721 111 HG13 ILE 17 1HG1 ILE 17 27.955 18.965 21.833 112 HG21 ILE 17 1HG2 ILE 17 26.516 18.045 19.027 113 HG22 ILE 17 2HG2 ILE 17 25.162 19.100 19.151 114 HG23 ILE 17 3HG2 ILE 17 26.812 19.757 19.475 115 HD11 ILE 17 HD1 ILE 17 28.447 16.816 22.877 116 HD12 ILE 17 HD2 ILE 17 27.087 17.702 23.656 117 HD13 ILE 17 HD3 ILE 17 26.779 16.291 22.598 118 H SER 18 H SER 18 23.209 18.714 22.187 119 HA SER 18 HA SER 18 21.690 20.774 20.799 120 HB2 SER 18 HB2 SER 18 20.577 19.219 19.252 121 HB3 SER 18 HB1 SER 18 22.307 19.244 19.032 122 HG SER 18 HG SER 18 22.074 17.224 19.213 123 H PHE 19 H PHE 19 19.279 19.942 20.776 124 HA PHE 19 HA PHE 19 18.569 19.549 23.638 125 HB2 PHE 19 HB2 PHE 19 17.722 21.763 21.842 126 HB3 PHE 19 HB1 PHE 19 17.450 21.647 23.547 127 HD1 PHE 19 HD1 PHE 19 19.799 22.523 20.871 128 HD2 PHE 19 HD2 PHE 19 19.344 22.030 25.110 129 HE1 PHE 19 HE1 PHE 19 22.086 23.452 21.219 130 HE2 PHE 19 HE2 PHE 19 21.667 22.969 25.438 131 HZ PHE 19 HZ PHE 19 22.996 23.656 23.444 132 H TYR 20 H TYR 20 16.128 19.878 23.832 133 HA TYR 20 HA TYR 20 14.484 18.463 21.791 134 HB2 TYR 20 HB2 TYR 20 13.945 19.347 24.644 135 HB3 TYR 20 HB1 TYR 20 12.773 18.552 23.592 136 HD1 TYR 20 HD1 TYR 20 13.343 16.320 22.633 137 HD2 TYR 20 HD2 TYR 20 15.427 17.992 25.970 138 HE1 TYR 20 HE1 TYR 20 14.296 14.051 23.180 139 HE2 TYR 20 HE2 TYR 20 16.239 15.779 26.614 140 HH TYR 20 HH TYR 20 16.043 13.527 26.200 141 H CYS 21 H CYS 21 13.070 19.491 20.534 142 HA CYS 21 HA CYS 21 13.065 22.468 20.568 143 HB2 CYS 21 HB1 CYS 21 14.479 21.852 18.860 144 HB3 CYS 21 HB2 CYS 21 13.545 20.362 18.516 145 H GLY 22 H GLY 22 33.057 25.065 16.583 146 HA2 GLY 22 HA2 GLY 22 32.366 22.702 15.084 147 HA3 GLY 22 HA1 GLY 22 34.077 23.048 14.955 148 H GLY 23 H GLY 23 31.550 22.304 17.441 149 HA2 GLY 23 HA2 GLY 23 33.011 20.302 18.731 150 HA3 GLY 23 HA1 GLY 23 33.524 21.867 19.409 151 H ALA 24 H ALA 24 32.616 20.181 21.161 152 HA ALA 24 HA ALA 24 29.794 20.938 21.755 153 HB1 ALA 24 HB1 ALA 24 29.783 18.987 23.155 154 HB2 ALA 24 HB2 ALA 24 30.257 18.507 21.544 155 HB3 ALA 24 HB3 ALA 24 31.537 18.667 22.809 156 H GLY 25 H GLY 25 29.858 22.782 22.961 157 HA2 GLY 25 HA2 GLY 25 31.667 23.147 25.205 158 HA3 GLY 25 HA1 GLY 25 32.282 23.769 23.685 159 H HIS 26 H HIS 26 32.289 25.664 25.100 160 HA HIS 26 HA HIS 26 29.965 26.476 26.492 161 HB2 HIS 26 HB2 HIS 26 31.712 28.243 27.312 162 HB3 HIS 26 HB1 HIS 26 31.872 26.581 27.788 163 HD2 HIS 26 HD2 HIS 26 33.697 29.228 25.803 164 HE1 HIS 26 HE1 HIS 26 35.902 25.613 25.282 165 HE2 HIS 26 HE2 HIS 26 35.924 28.142 24.867 166 H VAL 27 H VAL 27 31.382 27.826 23.639 167 HA VAL 27 HA VAL 27 29.372 29.974 23.652 168 HB VAL 27 HB VAL 27 30.967 31.676 22.844 169 HG11 VAL 27 1HG1 VAL 27 31.932 32.241 24.926 170 HG12 VAL 27 2HG1 VAL 27 30.283 31.648 25.208 171 HG13 VAL 27 3HG1 VAL 27 31.719 30.607 25.541 172 HG21 VAL 27 1HG2 VAL 27 33.312 31.398 23.118 173 HG22 VAL 27 2HG2 VAL 27 33.159 29.696 23.662 174 HG23 VAL 27 3HG2 VAL 27 32.718 30.208 21.998 175 HA PRO 28 HA PRO 28 28.467 28.434 19.883 176 HB2 PRO 28 HB1 PRO 28 27.534 30.470 18.303 177 HB3 PRO 28 HB2 PRO 28 26.695 29.931 19.809 178 HG2 PRO 28 HG1 PRO 28 28.601 32.209 19.436 179 HG3 PRO 28 HG2 PRO 28 26.985 32.214 20.192 180 HD2 PRO 28 HD1 PRO 28 29.248 31.981 21.713 181 HD3 PRO 28 HD2 PRO 28 27.789 30.995 22.091 182 H GLU 29 H GLU 29 29.460 27.567 18.214 183 HA GLU 29 HA GLU 29 31.285 29.125 16.450 184 HB2 GLU 29 HB2 GLU 29 31.960 26.851 17.152 185 HB3 GLU 29 HB1 GLU 29 30.430 26.219 16.455 186 HG2 GLU 29 HG2 GLU 29 31.264 27.132 14.246 187 HG3 GLU 29 HG1 GLU 29 32.836 27.393 14.989 188 H TYR 30 H TYR 30 28.363 27.007 16.424 189 HA TYR 30 HA TYR 30 27.269 28.624 14.209 190 HB2 TYR 30 HB2 TYR 30 26.624 25.876 15.191 191 HB3 TYR 30 HB1 TYR 30 25.731 26.714 13.937 192 HD1 TYR 30 HD1 TYR 30 26.417 24.159 13.391 193 HD2 TYR 30 HD2 TYR 30 29.027 27.576 13.120 194 HE1 TYR 30 HE1 TYR 30 27.657 23.081 11.540 195 HE2 TYR 30 HE2 TYR 30 30.313 26.407 11.296 196 HH TYR 30 HH TYR 30 30.657 24.379 10.238 197 H PHE 31 H PHE 31 26.073 30.221 14.965 198 HA PHE 31 HA PHE 31 24.192 29.882 17.171 199 HB2 PHE 31 HB2 PHE 31 25.143 32.120 16.624 200 HB3 PHE 31 HB1 PHE 31 24.492 31.998 14.994 201 HD1 PHE 31 HD1 PHE 31 22.637 33.386 14.756 202 HD2 PHE 31 HD2 PHE 31 23.301 31.527 18.573 203 HE1 PHE 31 HE1 PHE 31 20.518 34.437 15.673 204 HE2 PHE 31 HE2 PHE 31 21.232 32.599 19.441 205 HZ PHE 31 HZ PHE 31 19.821 33.987 17.924 206 H VAL 32 H VAL 32 24.219 29.628 13.738 207 HA VAL 32 HA VAL 32 21.812 27.989 13.669 208 HB VAL 32 HB VAL 32 22.000 29.981 11.466 209 HG11 VAL 32 1HG1 VAL 32 19.462 29.782 11.623 210 HG12 VAL 32 2HG1 VAL 32 20.275 28.253 11.296 211 HG13 VAL 32 3HG1 VAL 32 19.698 28.601 12.920 212 HG21 VAL 32 1HG2 VAL 32 20.450 31.581 12.566 213 HG22 VAL 32 2HG2 VAL 32 20.687 30.741 14.061 214 HG23 VAL 32 3HG2 VAL 32 22.076 31.554 13.293 215 H ARG 33 H ARG 33 21.864 26.847 11.355 216 HA ARG 33 HA ARG 33 23.972 27.611 9.627 217 HB2 ARG 33 HB2 ARG 33 25.016 25.389 9.349 218 HB3 ARG 33 HB1 ARG 33 25.393 26.191 10.810 219 HG2 ARG 33 HG2 ARG 33 25.134 23.819 11.168 220 HG3 ARG 33 HG1 ARG 33 23.910 24.721 12.088 221 HD2 ARG 33 HD2 ARG 33 22.914 22.762 11.154 222 HD3 ARG 33 HD1 ARG 33 22.204 24.228 10.471 223 HE ARG 33 HE ARG 33 23.911 23.664 8.513 224 HH11 ARG 33 1HH1 ARG 33 22.056 21.120 10.312 225 HH12 ARG 33 2HH1 ARG 33 21.874 20.252 8.769 226 HH21 ARG 33 1HH2 ARG 33 23.861 22.295 6.854 227 HH22 ARG 33 2HH2 ARG 33 22.949 20.767 7.060 228 H1 CYS 34 H1 CYS 34 12.870 27.704 19.412 229 H2 CYS 34 H2 CYS 34 12.136 27.159 18.046 230 H3 CYS 34 H3 CYS 34 12.106 26.265 19.441 231 HA CYS 34 HA CYS 34 14.387 25.801 19.318 232 HB2 CYS 34 HB2 CYS 34 13.516 25.445 16.482 233 HB3 CYS 34 HB1 CYS 34 14.543 24.414 17.481 234 H GLY 35 H GLY 35 15.724 27.506 19.607 235 HA2 GLY 35 HA2 GLY 35 16.982 28.790 17.259 236 HA3 GLY 35 HA1 GLY 35 15.959 29.835 18.267 237 H THR 36 H THR 36 18.360 27.275 18.525 238 HA THR 36 HA THR 36 19.887 28.673 20.620 239 HB THR 36 HB THR 36 19.269 25.665 20.493 240 HG1 THR 36 HG1 THR 36 17.837 26.058 22.034 241 HG21 THR 36 1HG2 THR 36 20.027 25.564 22.749 242 HG22 THR 36 2HG2 THR 36 21.319 26.297 21.794 243 HG23 THR 36 3HG2 THR 36 20.279 27.335 22.852 244 HA PRO 37 HA PRO 37 23.236 27.552 17.847 245 HB2 PRO 37 HB1 PRO 37 25.424 27.596 19.548 246 HB3 PRO 37 HB2 PRO 37 24.602 29.083 18.986 247 HG2 PRO 37 HG1 PRO 37 24.111 27.654 21.637 248 HG3 PRO 37 HG2 PRO 37 24.430 29.378 21.333 249 HD2 PRO 37 HD1 PRO 37 21.944 28.503 21.631 250 HD3 PRO 37 HD2 PRO 37 22.334 29.675 20.344 251 H ILE 38 H ILE 38 24.387 25.676 17.371 252 HA ILE 38 HA ILE 38 24.307 23.333 19.198 253 HB ILE 38 HB ILE 38 23.514 22.008 17.130 254 HG12 ILE 38 2HG1 ILE 38 22.122 23.106 15.583 255 HG13 ILE 38 1HG1 ILE 38 22.351 24.661 16.363 256 HG21 ILE 38 1HG2 ILE 38 21.164 22.398 17.719 257 HG22 ILE 38 2HG2 ILE 38 22.233 22.268 19.152 258 HG23 ILE 38 3HG2 ILE 38 21.658 23.841 18.645 259 HD11 ILE 38 HD1 ILE 38 23.544 24.259 14.189 260 HD12 ILE 38 HD2 ILE 38 24.578 24.824 15.491 261 HD13 ILE 38 HD3 ILE 38 24.560 23.055 15.069 262 H SER 39 H SER 39 26.429 25.090 17.692 263 HA SER 39 HA SER 39 28.318 22.933 17.992 264 HB2 SER 39 HB2 SER 39 27.960 22.960 15.484 265 HB3 SER 39 HB1 SER 39 28.521 24.628 15.511 266 HG SER 39 HG SER 39 30.028 22.565 15.228 267 H PHE 40 H PHE 40 30.301 23.793 18.811 268 HA PHE 40 HA PHE 40 30.108 26.619 19.694 269 HB2 PHE 40 HB2 PHE 40 30.710 24.090 21.276 270 HB3 PHE 40 HB1 PHE 40 30.702 25.728 21.925 271 HD1 PHE 40 HD1 PHE 40 28.670 22.861 20.877 272 HD2 PHE 40 HD2 PHE 40 28.616 26.959 22.085 273 HE1 PHE 40 HE1 PHE 40 26.204 22.744 21.117 274 HE2 PHE 40 HE2 PHE 40 26.154 26.853 22.425 275 HZ PHE 40 HZ PHE 40 24.951 24.707 21.902 276 H TYR 41 H TYR 41 32.183 27.269 20.865 277 HA TYR 41 HA TYR 41 34.666 26.209 19.644 278 HB2 TYR 41 HB2 TYR 41 34.342 28.270 21.822 279 HB3 TYR 41 HB1 TYR 41 35.845 27.871 21.015 280 HD1 TYR 41 HD1 TYR 41 33.950 27.883 18.195 281 HD2 TYR 41 HD2 TYR 41 35.227 30.552 21.314 282 HE1 TYR 41 HE1 TYR 41 33.458 29.822 16.764 283 HE2 TYR 41 HE2 TYR 41 34.833 32.497 19.843 284 HH TYR 41 HH TYR 41 32.929 32.302 17.145 285 H CYS 42 H CYS 42 36.116 24.915 20.829 286 HA CYS 42 HA CYS 42 35.466 24.311 23.618 287 HB2 CYS 42 HB1 CYS 42 34.568 22.505 22.440 288 HB3 CYS 42 HB2 CYS 42 36.054 22.247 21.494 Start of MODEL 10 1 H GLY 1 H GLY 1 17.081 16.203 20.476 2 HA2 GLY 1 HA2 GLY 1 17.461 14.528 18.138 3 HA3 GLY 1 HA1 GLY 1 15.801 14.592 18.720 4 H GLY 2 H GLY 2 18.030 17.282 18.752 5 HA2 GLY 2 HA2 GLY 2 17.101 18.825 16.517 6 HA3 GLY 2 HA1 GLY 2 16.102 19.133 17.947 7 H ALA 3 H ALA 3 16.987 21.339 17.697 8 HA ALA 3 HA ALA 3 19.717 21.715 18.687 9 HB1 ALA 3 HB1 ALA 3 20.241 23.205 16.788 10 HB2 ALA 3 HB2 ALA 3 19.974 21.497 16.338 11 HB3 ALA 3 HB3 ALA 3 18.696 22.672 16.030 12 H GLY 4 H GLY 4 19.642 23.169 20.357 13 HA2 GLY 4 HA2 GLY 4 19.471 25.688 20.316 14 HA3 GLY 4 HA1 GLY 4 17.764 25.437 20.277 15 H HIS 5 H HIS 5 16.669 24.662 22.232 16 HA HIS 5 HA HIS 5 18.171 25.965 24.356 17 HB2 HIS 5 HB2 HIS 5 16.303 27.046 24.891 18 HB3 HIS 5 HB1 HIS 5 16.429 27.169 23.191 19 HD2 HIS 5 HD2 HIS 5 13.996 27.039 25.715 20 HE1 HIS 5 HE1 HIS 5 12.076 24.741 22.690 21 HE2 HIS 5 HE2 HIS 5 11.717 26.169 24.752 22 H VAL 6 H VAL 6 16.660 22.844 24.292 23 HA VAL 6 HA VAL 6 17.733 22.663 27.003 24 HB VAL 6 HB VAL 6 15.945 21.186 27.796 25 HG11 VAL 6 1HG1 VAL 6 14.480 22.863 28.606 26 HG12 VAL 6 2HG1 VAL 6 16.078 23.497 28.484 27 HG13 VAL 6 3HG1 VAL 6 14.926 23.965 27.240 28 HG21 VAL 6 1HG2 VAL 6 13.720 21.408 26.833 29 HG22 VAL 6 2HG2 VAL 6 14.345 22.287 25.443 30 HG23 VAL 6 3HG2 VAL 6 14.778 20.553 25.662 31 HA PRO 7 HA PRO 7 19.815 19.588 25.016 32 HB2 PRO 7 HB1 PRO 7 20.609 17.842 27.125 33 HB3 PRO 7 HB2 PRO 7 21.385 19.407 26.747 34 HG2 PRO 7 HG1 PRO 7 19.268 18.753 28.747 35 HG3 PRO 7 HG2 PRO 7 20.721 19.788 28.988 36 HD2 PRO 7 HD1 PRO 7 18.249 20.841 28.510 37 HD3 PRO 7 HD2 PRO 7 19.713 21.497 27.670 38 H GLU 8 H GLU 8 19.571 17.813 23.947 39 HA GLU 8 HA GLU 8 17.722 15.640 24.796 40 HB2 GLU 8 HB2 GLU 8 17.245 16.410 22.654 41 HB3 GLU 8 HB1 GLU 8 18.961 16.257 22.147 42 HG2 GLU 8 HG2 GLU 8 18.841 13.872 22.372 43 HG3 GLU 8 HG1 GLU 8 17.121 13.982 22.882 44 H TYR 9 H TYR 9 21.160 16.262 23.827 45 HA TYR 9 HA TYR 9 21.888 13.874 25.379 46 HB2 TYR 9 HB2 TYR 9 23.314 14.535 22.781 47 HB3 TYR 9 HB1 TYR 9 23.600 13.211 23.845 48 HD1 TYR 9 HD1 TYR 9 21.103 11.871 24.197 49 HD2 TYR 9 HD2 TYR 9 22.544 13.952 20.704 50 HE1 TYR 9 HE1 TYR 9 19.632 10.482 22.744 51 HE2 TYR 9 HE2 TYR 9 21.070 12.682 19.288 52 HH TYR 9 HH TYR 9 19.254 11.143 19.272 53 H PHE 10 H PHE 10 22.621 15.067 27.119 54 HA PHE 10 HA PHE 10 23.864 17.626 26.970 55 HB2 PHE 10 HB2 PHE 10 22.533 16.774 28.853 56 HB3 PHE 10 HB1 PHE 10 23.735 15.519 29.151 57 HD1 PHE 10 HD1 PHE 10 25.793 16.012 30.323 58 HD2 PHE 10 HD2 PHE 10 23.096 19.189 29.285 59 HE1 PHE 10 HE1 PHE 10 27.126 17.505 31.633 60 HE2 PHE 10 HE2 PHE 10 24.399 20.739 30.702 61 HZ PHE 10 HZ PHE 10 26.437 19.945 31.879 62 H VAL 11 H VAL 11 25.160 14.427 26.737 63 HA VAL 11 HA VAL 11 27.808 15.533 26.233 64 HB VAL 11 HB VAL 11 27.725 14.820 28.610 65 HG11 VAL 11 1HG1 VAL 11 27.810 12.494 29.187 66 HG12 VAL 11 2HG1 VAL 11 26.274 12.807 28.322 67 HG13 VAL 11 3HG1 VAL 11 27.658 11.986 27.529 68 HG21 VAL 11 1HG2 VAL 11 29.844 13.807 28.611 69 HG22 VAL 11 2HG2 VAL 11 29.721 13.199 26.953 70 HG23 VAL 11 3HG2 VAL 11 29.861 14.934 27.275 71 H ARG 12 H ARG 12 29.125 13.877 25.080 72 HA ARG 12 HA ARG 12 27.804 11.564 23.942 73 HB2 ARG 12 HB2 ARG 12 28.335 12.076 21.619 74 HB3 ARG 12 HB1 ARG 12 27.146 13.108 22.289 75 HG2 ARG 12 HG2 ARG 12 28.602 14.330 20.817 76 HG3 ARG 12 HG1 ARG 12 28.661 14.959 22.474 77 HD2 ARG 12 HD2 ARG 12 30.822 14.910 21.290 78 HD3 ARG 12 HD1 ARG 12 30.815 14.068 22.840 79 HE ARG 12 HE ARG 12 30.717 11.942 21.670 80 HH11 ARG 12 1HH1 ARG 12 31.873 14.537 19.455 81 HH12 ARG 12 2HH1 ARG 12 32.926 13.348 18.685 82 HH21 ARG 12 1HH2 ARG 12 31.947 10.595 20.373 83 HH22 ARG 12 2HH2 ARG 12 32.883 11.327 19.068 84 H1 CYS 13 H1 CYS 13 34.281 22.728 30.407 85 H2 CYS 13 H2 CYS 13 35.574 22.175 29.672 86 H3 CYS 13 H3 CYS 13 35.329 23.775 29.689 87 HA CYS 13 HA CYS 13 33.466 23.591 28.204 88 HB2 CYS 13 HB2 CYS 13 35.887 22.056 27.234 89 HB3 CYS 13 HB1 CYS 13 34.549 22.616 26.235 90 H GLY 14 H GLY 14 31.607 22.518 28.647 91 HA2 GLY 14 HA2 GLY 14 31.332 19.623 28.226 92 HA3 GLY 14 HA1 GLY 14 31.267 20.223 29.888 93 H THR 15 H THR 15 29.780 20.440 26.691 94 HA THR 15 HA THR 15 27.214 21.421 27.836 95 HB THR 15 HB THR 15 28.630 22.340 25.307 96 HG1 THR 15 HG1 THR 15 29.007 24.150 26.369 97 HG21 THR 15 1HG2 THR 15 27.084 24.233 25.355 98 HG22 THR 15 2HG2 THR 15 26.182 22.731 25.164 99 HG23 THR 15 3HG2 THR 15 26.231 23.572 26.756 100 HA PRO 16 HA PRO 16 25.444 18.455 24.778 101 HB2 PRO 16 HB1 PRO 16 23.277 20.005 23.906 102 HB3 PRO 16 HB2 PRO 16 23.273 18.959 25.313 103 HG2 PRO 16 HG1 PRO 16 23.831 21.932 25.196 104 HG3 PRO 16 HG2 PRO 16 22.738 21.117 26.319 105 HD2 PRO 16 HD1 PRO 16 25.211 21.753 27.173 106 HD3 PRO 16 HD2 PRO 16 24.649 20.098 27.507 107 H ILE 17 H ILE 17 25.291 18.227 22.583 108 HA ILE 17 HA ILE 17 25.438 20.648 20.939 109 HB ILE 17 HB ILE 17 26.598 18.134 19.849 110 HG12 ILE 17 2HG1 ILE 17 28.219 20.332 21.251 111 HG13 ILE 17 1HG1 ILE 17 27.994 18.721 21.871 112 HG21 ILE 17 1HG2 ILE 17 27.621 19.771 18.306 113 HG22 ILE 17 2HG2 ILE 17 25.919 20.260 18.430 114 HG23 ILE 17 3HG2 ILE 17 27.150 21.098 19.370 115 HD11 ILE 17 HD1 ILE 17 30.185 18.721 20.866 116 HD12 ILE 17 HD2 ILE 17 29.083 17.837 19.798 117 HD13 ILE 17 HD3 ILE 17 29.577 19.484 19.405 118 H SER 18 H SER 18 23.427 18.729 22.169 119 HA SER 18 HA SER 18 21.670 18.627 19.776 120 HB2 SER 18 HB2 SER 18 22.342 16.237 21.497 121 HB3 SER 18 HB1 SER 18 20.911 16.355 20.431 122 HG SER 18 HG SER 18 22.189 16.618 18.663 123 H PHE 19 H PHE 19 19.654 19.001 20.290 124 HA PHE 19 HA PHE 19 18.745 19.363 23.133 125 HB2 PHE 19 HB2 PHE 19 18.392 21.278 20.842 126 HB3 PHE 19 HB1 PHE 19 17.797 21.528 22.427 127 HD1 PHE 19 HD1 PHE 19 20.994 21.328 20.449 128 HD2 PHE 19 HD2 PHE 19 19.284 22.182 24.275 129 HE1 PHE 19 HE1 PHE 19 23.098 22.356 21.166 130 HE2 PHE 19 HE2 PHE 19 21.306 23.396 24.914 131 HZ PHE 19 HZ PHE 19 23.273 23.510 23.331 132 H TYR 20 H TYR 20 16.221 19.796 23.150 133 HA TYR 20 HA TYR 20 14.955 17.589 21.861 134 HB2 TYR 20 HB2 TYR 20 14.150 19.881 23.584 135 HB3 TYR 20 HB1 TYR 20 12.861 19.137 22.681 136 HD1 TYR 20 HD1 TYR 20 11.782 17.227 23.554 137 HD2 TYR 20 HD2 TYR 20 15.741 18.241 24.932 138 HE1 TYR 20 HE1 TYR 20 11.685 15.402 25.208 139 HE2 TYR 20 HE2 TYR 20 15.627 16.410 26.594 140 HH TYR 20 HH TYR 20 14.311 14.743 27.522 141 H CYS 21 H CYS 21 13.566 20.862 21.275 142 HA CYS 21 HA CYS 21 13.273 20.141 18.463 143 HB2 CYS 21 HB2 CYS 21 11.876 21.837 18.252 144 HB3 CYS 21 HB1 CYS 21 11.634 21.458 19.910 145 H GLY 22 H GLY 22 32.370 24.094 17.330 146 HA2 GLY 22 HA2 GLY 22 31.687 21.794 15.963 147 HA3 GLY 22 HA1 GLY 22 33.361 22.101 15.507 148 H GLY 23 H GLY 23 31.281 21.862 18.514 149 HA2 GLY 23 HA2 GLY 23 32.730 20.065 20.021 150 HA3 GLY 23 HA1 GLY 23 33.577 21.571 20.160 151 H ALA 24 H ALA 24 32.918 21.114 22.393 152 HA ALA 24 HA ALA 24 30.102 21.828 23.122 153 HB1 ALA 24 HB1 ALA 24 30.258 19.859 24.791 154 HB2 ALA 24 HB2 ALA 24 30.353 19.331 23.098 155 HB3 ALA 24 HB3 ALA 24 31.814 19.527 24.045 156 H GLY 25 H GLY 25 30.302 23.758 24.037 157 HA2 GLY 25 HA2 GLY 25 31.833 24.025 26.482 158 HA3 GLY 25 HA1 GLY 25 32.615 24.779 25.105 159 H HIS 26 H HIS 26 32.445 26.666 26.313 160 HA HIS 26 HA HIS 26 30.032 27.907 27.261 161 HB2 HIS 26 HB2 HIS 26 31.740 29.615 27.987 162 HB3 HIS 26 HB1 HIS 26 32.073 28.007 28.539 163 HD2 HIS 26 HD2 HIS 26 34.081 30.712 27.543 164 HE1 HIS 26 HE1 HIS 26 36.171 27.345 25.947 165 HE2 HIS 26 HE2 HIS 26 36.354 29.771 26.638 166 H VAL 27 H VAL 27 31.640 28.085 24.160 167 HA VAL 27 HA VAL 27 30.342 30.625 23.564 168 HB VAL 27 HB VAL 27 32.520 31.160 22.310 169 HG11 VAL 27 1HG1 VAL 27 33.541 32.130 24.318 170 HG12 VAL 27 2HG1 VAL 27 31.798 32.412 24.228 171 HG13 VAL 27 3HG1 VAL 27 32.412 31.167 25.345 172 HG21 VAL 27 1HG2 VAL 27 34.597 30.251 23.131 173 HG22 VAL 27 2HG2 VAL 27 33.763 29.225 24.303 174 HG23 VAL 27 3HG2 VAL 27 33.568 28.918 22.574 175 HA PRO 28 HA PRO 28 29.010 28.132 20.428 176 HB2 PRO 28 HB1 PRO 28 27.348 29.837 18.936 177 HB3 PRO 28 HB2 PRO 28 27.097 29.193 20.572 178 HG2 PRO 28 HG1 PRO 28 28.292 31.833 19.731 179 HG3 PRO 28 HG2 PRO 28 26.965 31.569 20.904 180 HD2 PRO 28 HD1 PRO 28 29.610 31.885 21.647 181 HD3 PRO 28 HD2 PRO 28 28.522 30.857 22.585 182 H GLU 29 H GLU 29 29.819 27.225 18.666 183 HA GLU 29 HA GLU 29 31.437 28.586 16.661 184 HB2 GLU 29 HB2 GLU 29 32.194 26.391 17.553 185 HB3 GLU 29 HB1 GLU 29 30.641 25.666 17.098 186 HG2 GLU 29 HG2 GLU 29 31.412 26.300 14.676 187 HG3 GLU 29 HG1 GLU 29 32.994 26.576 15.417 188 H TYR 30 H TYR 30 28.150 27.248 17.158 189 HA TYR 30 HA TYR 30 27.470 28.158 14.434 190 HB2 TYR 30 HB2 TYR 30 27.284 25.366 15.500 191 HB3 TYR 30 HB1 TYR 30 25.995 25.977 14.471 192 HD1 TYR 30 HD1 TYR 30 29.304 24.429 14.491 193 HD2 TYR 30 HD2 TYR 30 26.650 26.981 12.201 194 HE1 TYR 30 HE1 TYR 30 30.561 23.982 12.478 195 HE2 TYR 30 HE2 TYR 30 28.066 26.601 10.184 196 HH TYR 30 HH TYR 30 29.924 25.511 9.391 197 H PHE 31 H PHE 31 25.901 29.396 14.471 198 HA PHE 31 HA PHE 31 24.128 29.759 16.764 199 HB2 PHE 31 HB2 PHE 31 25.282 31.445 15.013 200 HB3 PHE 31 HB1 PHE 31 23.760 31.172 14.153 201 HD1 PHE 31 HD1 PHE 31 25.202 32.124 17.406 202 HD2 PHE 31 HD2 PHE 31 21.824 32.405 14.823 203 HE1 PHE 31 HE1 PHE 31 24.183 33.900 18.902 204 HE2 PHE 31 HE2 PHE 31 20.774 34.096 16.364 205 HZ PHE 31 HZ PHE 31 21.995 34.819 18.387 206 H VAL 32 H VAL 32 21.790 30.309 15.882 207 HA VAL 32 HA VAL 32 20.651 27.917 14.575 208 HB VAL 32 HB VAL 32 19.605 29.067 16.549 209 HG11 VAL 32 1HG1 VAL 32 18.359 31.105 16.274 210 HG12 VAL 32 2HG1 VAL 32 20.051 31.388 15.942 211 HG13 VAL 32 3HG1 VAL 32 18.853 31.240 14.573 212 HG21 VAL 32 1HG2 VAL 32 17.382 28.869 15.868 213 HG22 VAL 32 2HG2 VAL 32 17.781 29.060 14.118 214 HG23 VAL 32 3HG2 VAL 32 18.271 27.619 15.040 215 H ARG 33 H ARG 33 19.529 27.918 12.617 216 HA ARG 33 HA ARG 33 20.727 29.651 10.653 217 HB2 ARG 33 HB2 ARG 33 19.916 28.202 9.061 218 HB3 ARG 33 HB1 ARG 33 20.551 27.162 10.271 219 HG2 ARG 33 HG2 ARG 33 18.561 26.091 10.151 220 HG3 ARG 33 HG1 ARG 33 17.834 27.495 10.952 221 HD2 ARG 33 HD2 ARG 33 16.492 27.094 9.033 222 HD3 ARG 33 HD1 ARG 33 17.427 28.543 8.697 223 HE ARG 33 HE ARG 33 18.851 26.263 7.610 224 HH11 ARG 33 1HH1 ARG 33 15.939 28.207 6.903 225 HH12 ARG 33 2HH1 ARG 33 15.937 27.650 5.261 226 HH21 ARG 33 1HH2 ARG 33 18.745 25.584 5.596 227 HH22 ARG 33 2HH2 ARG 33 17.599 26.271 4.468 228 H1 CYS 34 H1 CYS 34 14.447 27.344 20.854 229 H2 CYS 34 H2 CYS 34 12.880 27.149 20.432 230 H3 CYS 34 H3 CYS 34 13.869 25.830 20.541 231 HA CYS 34 HA CYS 34 15.225 26.514 18.763 232 HB2 CYS 34 HB2 CYS 34 12.249 26.548 18.127 233 HB3 CYS 34 HB1 CYS 34 13.510 26.565 16.924 234 H GLY 35 H GLY 35 16.324 28.191 18.165 235 HA2 GLY 35 HA2 GLY 35 16.244 30.654 17.410 236 HA3 GLY 35 HA1 GLY 35 15.274 30.834 18.865 237 H THR 36 H THR 36 17.813 28.489 19.091 238 HA THR 36 HA THR 36 19.662 30.339 20.427 239 HB THR 36 HB THR 36 18.788 27.577 21.357 240 HG1 THR 36 HG1 THR 36 18.555 29.477 23.108 241 HG21 THR 36 1HG2 THR 36 19.904 27.999 23.436 242 HG22 THR 36 2HG2 THR 36 21.064 27.935 22.133 243 HG23 THR 36 3HG2 THR 36 20.533 29.536 22.823 244 HA PRO 37 HA PRO 37 22.901 28.249 17.999 245 HB2 PRO 37 HB1 PRO 37 24.231 28.196 20.708 246 HB3 PRO 37 HB2 PRO 37 24.945 28.549 19.138 247 HG2 PRO 37 HG1 PRO 37 24.291 30.611 20.695 248 HG3 PRO 37 HG2 PRO 37 23.911 30.659 18.956 249 HD2 PRO 37 HD1 PRO 37 22.053 30.041 21.292 250 HD3 PRO 37 HD2 PRO 37 21.709 30.981 19.816 251 H ILE 38 H ILE 38 24.229 26.446 17.954 252 HA ILE 38 HA ILE 38 23.052 24.078 19.241 253 HB ILE 38 HB ILE 38 22.290 24.140 17.049 254 HG12 ILE 38 2HG1 ILE 38 22.982 22.107 16.066 255 HG13 ILE 38 1HG1 ILE 38 24.453 22.047 17.045 256 HG21 ILE 38 1HG2 ILE 38 23.632 24.182 15.026 257 HG22 ILE 38 2HG2 ILE 38 24.033 25.585 16.019 258 HG23 ILE 38 3HG2 ILE 38 25.133 24.187 15.985 259 HD11 ILE 38 HD1 ILE 38 22.367 20.676 17.720 260 HD12 ILE 38 HD2 ILE 38 23.306 21.485 19.000 261 HD13 ILE 38 HD3 ILE 38 21.786 22.174 18.466 262 H SER 39 H SER 39 26.070 25.053 17.669 263 HA SER 39 HA SER 39 27.542 23.146 19.461 264 HB2 SER 39 HB2 SER 39 28.542 24.127 16.755 265 HB3 SER 39 HB1 SER 39 29.081 22.721 17.689 266 HG SER 39 HG SER 39 27.853 21.960 16.108 267 H PHE 40 H PHE 40 29.750 23.643 19.888 268 HA PHE 40 HA PHE 40 30.216 26.525 20.318 269 HB2 PHE 40 HB2 PHE 40 30.804 24.190 22.112 270 HB3 PHE 40 HB1 PHE 40 31.089 25.856 22.542 271 HD1 PHE 40 HD1 PHE 40 29.163 27.444 22.945 272 HD2 PHE 40 HD2 PHE 40 28.475 23.257 22.147 273 HE1 PHE 40 HE1 PHE 40 26.769 27.747 23.291 274 HE2 PHE 40 HE2 PHE 40 26.000 23.661 22.520 275 HZ PHE 40 HZ PHE 40 25.191 25.824 23.091 276 H TYR 41 H TYR 41 32.438 27.099 20.733 277 HA TYR 41 HA TYR 41 34.168 26.048 18.660 278 HB2 TYR 41 HB2 TYR 41 34.665 28.112 20.872 279 HB3 TYR 41 HB1 TYR 41 35.849 27.641 19.699 280 HD1 TYR 41 HD1 TYR 41 35.022 27.582 17.192 281 HD2 TYR 41 HD2 TYR 41 33.296 29.985 20.306 282 HE1 TYR 41 HE1 TYR 41 34.284 29.260 15.501 283 HE2 TYR 41 HE2 TYR 41 32.552 31.640 18.644 284 HH TYR 41 HH TYR 41 32.553 32.252 16.378 285 H CYS 42 H CYS 42 34.183 25.735 22.144 286 HA CYS 42 HA CYS 42 36.859 24.735 22.362 287 HB2 CYS 42 HB2 CYS 42 35.519 25.853 24.112 288 HB3 CYS 42 HB1 CYS 42 34.650 24.329 24.364 Start of MODEL 11 1 H GLY 1 H GLY 1 17.191 16.949 20.247 2 HA2 GLY 1 HA2 GLY 1 18.443 15.331 18.303 3 HA3 GLY 1 HA1 GLY 1 16.752 15.153 18.049 4 H GLY 2 H GLY 2 16.750 18.222 19.011 5 HA2 GLY 2 HA2 GLY 2 17.200 19.325 16.267 6 HA3 GLY 2 HA1 GLY 2 15.904 19.693 17.384 7 H ALA 3 H ALA 3 16.344 21.874 17.303 8 HA ALA 3 HA ALA 3 18.873 22.883 18.469 9 HB1 ALA 3 HB1 ALA 3 19.052 24.619 16.636 10 HB2 ALA 3 HB2 ALA 3 19.129 22.909 16.097 11 HB3 ALA 3 HB3 ALA 3 17.670 23.809 15.859 12 H GLY 4 H GLY 4 17.897 23.496 20.372 13 HA2 GLY 4 HA2 GLY 4 15.886 25.571 20.592 14 HA3 GLY 4 HA1 GLY 4 15.260 23.901 20.694 15 H HIS 5 H HIS 5 14.607 23.880 22.806 16 HA HIS 5 HA HIS 5 15.893 25.566 24.719 17 HB2 HIS 5 HB2 HIS 5 13.941 25.143 26.040 18 HB3 HIS 5 HB1 HIS 5 13.613 25.707 24.409 19 HD2 HIS 5 HD2 HIS 5 12.123 23.621 26.804 20 HE1 HIS 5 HE1 HIS 5 11.232 21.489 23.269 21 HE2 HIS 5 HE2 HIS 5 10.829 21.615 25.752 22 H VAL 6 H VAL 6 14.633 22.416 25.499 23 HA VAL 6 HA VAL 6 16.753 22.061 27.524 24 HB VAL 6 HB VAL 6 15.510 20.203 28.377 25 HG11 VAL 6 1HG1 VAL 6 13.714 21.401 29.344 26 HG12 VAL 6 2HG1 VAL 6 15.137 22.455 29.199 27 HG13 VAL 6 3HG1 VAL 6 13.779 22.693 28.109 28 HG21 VAL 6 1HG2 VAL 6 13.252 19.691 27.665 29 HG22 VAL 6 2HG2 VAL 6 13.363 20.812 26.279 30 HG23 VAL 6 3HG2 VAL 6 14.419 19.379 26.382 31 HA PRO 7 HA PRO 7 19.000 19.716 24.747 32 HB2 PRO 7 HB1 PRO 7 20.792 18.377 26.352 33 HB3 PRO 7 HB2 PRO 7 20.738 20.159 26.238 34 HG2 PRO 7 HG1 PRO 7 19.583 18.464 28.415 35 HG3 PRO 7 HG2 PRO 7 20.541 19.979 28.547 36 HD2 PRO 7 HD1 PRO 7 17.779 19.928 28.585 37 HD3 PRO 7 HD2 PRO 7 18.719 21.314 27.954 38 H GLU 8 H GLU 8 19.080 17.865 23.617 39 HA GLU 8 HA GLU 8 18.124 15.342 24.801 40 HB2 GLU 8 HB2 GLU 8 19.001 16.078 21.972 41 HB3 GLU 8 HB1 GLU 8 18.834 14.387 22.546 42 HG2 GLU 8 HG2 GLU 8 16.470 14.731 22.854 43 HG3 GLU 8 HG1 GLU 8 16.648 16.473 22.362 44 H TYR 9 H TYR 9 20.891 16.403 22.728 45 HA TYR 9 HA TYR 9 22.457 14.210 23.806 46 HB2 TYR 9 HB2 TYR 9 23.184 16.119 21.534 47 HB3 TYR 9 HB1 TYR 9 23.881 14.579 21.901 48 HD1 TYR 9 HD1 TYR 9 21.099 13.192 22.370 49 HD2 TYR 9 HD2 TYR 9 22.795 15.561 19.279 50 HE1 TYR 9 HE1 TYR 9 19.411 12.246 20.793 51 HE2 TYR 9 HE2 TYR 9 21.144 14.677 17.642 52 HH TYR 9 HH TYR 9 18.817 12.148 18.723 53 H PHE 10 H PHE 10 22.868 14.927 25.832 54 HA PHE 10 HA PHE 10 24.335 17.397 26.430 55 HB2 PHE 10 HB2 PHE 10 22.698 16.168 27.930 56 HB3 PHE 10 HB1 PHE 10 23.919 14.907 28.070 57 HD1 PHE 10 HD1 PHE 10 25.384 15.098 29.876 58 HD2 PHE 10 HD2 PHE 10 23.402 18.634 28.485 59 HE1 PHE 10 HE1 PHE 10 26.281 16.347 31.833 60 HE2 PHE 10 HE2 PHE 10 24.260 19.874 30.342 61 HZ PHE 10 HZ PHE 10 25.913 18.757 31.992 62 H VAL 11 H VAL 11 26.315 17.064 27.832 63 HA VAL 11 HA VAL 11 28.578 16.059 26.611 64 HB VAL 11 HB VAL 11 28.045 16.154 29.594 65 HG11 VAL 11 1HG1 VAL 11 30.082 14.941 29.053 66 HG12 VAL 11 2HG1 VAL 11 30.595 16.163 27.867 67 HG13 VAL 11 3HG1 VAL 11 30.494 16.544 29.618 68 HG21 VAL 11 1HG2 VAL 11 29.283 18.335 29.366 69 HG22 VAL 11 2HG2 VAL 11 29.062 18.247 27.589 70 HG23 VAL 11 3HG2 VAL 11 27.658 18.389 28.652 71 H ARG 12 H ARG 12 29.551 14.258 26.447 72 HA ARG 12 HA ARG 12 28.138 12.001 26.001 73 HB2 ARG 12 HB2 ARG 12 30.378 10.894 25.644 74 HB3 ARG 12 HB1 ARG 12 30.017 12.327 24.722 75 HG2 ARG 12 HG2 ARG 12 32.315 12.364 25.356 76 HG3 ARG 12 HG1 ARG 12 31.459 13.695 26.120 77 HD2 ARG 12 HD2 ARG 12 33.034 12.855 27.635 78 HD3 ARG 12 HD1 ARG 12 31.429 12.521 28.256 79 HE ARG 12 HE ARG 12 31.822 10.159 27.739 80 HH11 ARG 12 1HH1 ARG 12 34.687 12.126 27.006 81 HH12 ARG 12 2HH1 ARG 12 35.683 10.717 26.735 82 HH21 ARG 12 1HH2 ARG 12 33.185 8.420 27.637 83 HH22 ARG 12 2HH2 ARG 12 34.889 8.667 27.223 84 H1 CYS 13 H1 CYS 13 34.278 23.920 29.425 85 H2 CYS 13 H2 CYS 13 35.483 22.835 29.269 86 H3 CYS 13 H3 CYS 13 35.662 24.360 28.655 87 HA CYS 13 HA CYS 13 33.833 23.931 27.152 88 HB2 CYS 13 HB2 CYS 13 36.048 21.805 27.025 89 HB3 CYS 13 HB1 CYS 13 35.109 22.401 25.661 90 H GLY 14 H GLY 14 31.854 22.802 26.968 91 HA2 GLY 14 HA2 GLY 14 31.779 19.903 27.210 92 HA3 GLY 14 HA1 GLY 14 31.061 20.721 28.561 93 H THR 15 H THR 15 29.088 21.344 28.374 94 HA THR 15 HA THR 15 27.032 21.731 27.842 95 HB THR 15 HB THR 15 28.635 23.551 26.800 96 HG1 THR 15 HG1 THR 15 26.085 23.990 26.014 97 HG21 THR 15 1HG2 THR 15 27.967 24.315 24.604 98 HG22 THR 15 2HG2 THR 15 28.726 22.712 24.507 99 HG23 THR 15 3HG2 THR 15 27.024 22.828 24.340 100 HA PRO 16 HA PRO 16 25.083 18.943 24.991 101 HB2 PRO 16 HB1 PRO 16 22.585 20.114 24.748 102 HB3 PRO 16 HB2 PRO 16 23.131 19.147 26.153 103 HG2 PRO 16 HG1 PRO 16 23.204 22.143 25.829 104 HG3 PRO 16 HG2 PRO 16 22.524 21.231 27.210 105 HD2 PRO 16 HD1 PRO 16 25.006 22.273 27.292 106 HD3 PRO 16 HD2 PRO 16 24.786 20.617 27.895 107 H ILE 17 H ILE 17 24.598 18.765 22.855 108 HA ILE 17 HA ILE 17 25.086 21.075 21.077 109 HB ILE 17 HB ILE 17 25.667 18.153 20.857 110 HG12 ILE 17 2HG1 ILE 17 27.773 19.079 19.933 111 HG13 ILE 17 1HG1 ILE 17 27.179 20.736 20.235 112 HG21 ILE 17 1HG2 ILE 17 26.211 18.436 18.480 113 HG22 ILE 17 2HG2 ILE 17 24.476 18.421 18.802 114 HG23 ILE 17 3HG2 ILE 17 25.294 19.954 18.495 115 HD11 ILE 17 HD1 ILE 17 28.839 19.696 21.889 116 HD12 ILE 17 HD2 ILE 17 27.370 20.367 22.598 117 HD13 ILE 17 HD3 ILE 17 27.552 18.585 22.332 118 H SER 18 H SER 18 22.601 18.580 21.659 119 HA SER 18 HA SER 18 20.907 20.122 19.809 120 HB2 SER 18 HB2 SER 18 20.913 17.073 19.771 121 HB3 SER 18 HB1 SER 18 19.874 18.151 18.895 122 HG SER 18 HG SER 18 21.310 18.022 17.436 123 H PHE 19 H PHE 19 18.639 19.771 20.132 124 HA PHE 19 HA PHE 19 17.947 19.449 23.013 125 HB2 PHE 19 HB2 PHE 19 17.437 21.730 21.106 126 HB3 PHE 19 HB1 PHE 19 16.901 21.712 22.799 127 HD1 PHE 19 HD1 PHE 19 19.677 22.076 20.464 128 HD2 PHE 19 HD2 PHE 19 18.583 22.038 24.617 129 HE1 PHE 19 HE1 PHE 19 21.960 22.959 21.059 130 HE2 PHE 19 HE2 PHE 19 20.818 22.916 25.212 131 HZ PHE 19 HZ PHE 19 22.492 23.315 23.432 132 H TYR 20 H TYR 20 15.422 19.993 23.280 133 HA TYR 20 HA TYR 20 14.172 17.805 21.882 134 HB2 TYR 20 HB2 TYR 20 13.401 19.656 24.077 135 HB3 TYR 20 HB1 TYR 20 12.128 18.825 23.187 136 HD1 TYR 20 HD1 TYR 20 11.435 16.745 23.995 137 HD2 TYR 20 HD2 TYR 20 15.477 17.970 24.728 138 HE1 TYR 20 HE1 TYR 20 11.819 14.661 25.270 139 HE2 TYR 20 HE2 TYR 20 15.904 15.830 25.896 140 HH TYR 20 HH TYR 20 15.039 13.920 26.734 141 H CYS 21 H CYS 21 13.489 21.332 21.774 142 HA CYS 21 HA CYS 21 12.344 21.113 19.105 143 HB2 CYS 21 HB1 CYS 21 11.654 22.897 20.668 144 HB3 CYS 21 HB2 CYS 21 13.292 23.504 20.713 145 H GLY 22 H GLY 22 32.339 24.666 16.862 146 HA2 GLY 22 HA2 GLY 22 30.983 22.666 15.282 147 HA3 GLY 22 HA1 GLY 22 32.722 22.743 14.942 148 H GLY 23 H GLY 23 30.397 21.454 16.952 149 HA2 GLY 23 HA2 GLY 23 30.633 19.781 18.450 150 HA3 GLY 23 HA1 GLY 23 32.384 20.044 18.607 151 H ALA 24 H ALA 24 31.817 19.492 20.694 152 HA ALA 24 HA ALA 24 30.448 21.045 22.632 153 HB1 ALA 24 HB1 ALA 24 31.988 19.840 24.224 154 HB2 ALA 24 HB2 ALA 24 31.258 18.746 23.015 155 HB3 ALA 24 HB3 ALA 24 32.915 19.335 22.747 156 H GLY 25 H GLY 25 31.244 22.273 24.401 157 HA2 GLY 25 HA2 GLY 25 33.555 23.649 24.772 158 HA3 GLY 25 HA1 GLY 25 32.832 24.499 23.385 159 H HIS 26 H HIS 26 33.051 26.261 24.821 160 HA HIS 26 HA HIS 26 30.520 26.748 26.254 161 HB2 HIS 26 HB2 HIS 26 31.731 27.934 28.020 162 HB3 HIS 26 HB1 HIS 26 32.031 26.177 28.020 163 HD2 HIS 26 HD2 HIS 26 33.756 29.532 27.476 164 HE1 HIS 26 HE1 HIS 26 36.741 26.515 26.918 165 HE2 HIS 26 HE2 HIS 26 36.274 29.068 26.993 166 H VAL 27 H VAL 27 32.714 27.878 23.860 167 HA VAL 27 HA VAL 27 30.956 30.240 23.873 168 HB VAL 27 HB VAL 27 32.706 31.506 22.688 169 HG11 VAL 27 1HG1 VAL 27 33.692 32.297 24.762 170 HG12 VAL 27 2HG1 VAL 27 32.018 31.886 25.053 171 HG13 VAL 27 3HG1 VAL 27 33.259 30.770 25.594 172 HG21 VAL 27 1HG2 VAL 27 35.046 30.975 23.072 173 HG22 VAL 27 2HG2 VAL 27 34.626 29.493 23.935 174 HG23 VAL 27 3HG2 VAL 27 34.283 29.617 22.209 175 HA PRO 28 HA PRO 28 29.487 28.442 20.479 176 HB2 PRO 28 HB1 PRO 28 27.833 30.280 19.396 177 HB3 PRO 28 HB2 PRO 28 27.682 29.707 21.084 178 HG2 PRO 28 HG1 PRO 28 29.060 32.224 20.062 179 HG3 PRO 28 HG2 PRO 28 27.861 32.093 21.364 180 HD2 PRO 28 HD1 PRO 28 30.496 32.060 22.045 181 HD3 PRO 28 HD2 PRO 28 29.310 31.038 22.839 182 H GLU 29 H GLU 29 29.433 27.943 18.432 183 HA GLU 29 HA GLU 29 31.221 29.233 16.460 184 HB2 GLU 29 HB2 GLU 29 31.737 27.014 17.461 185 HB3 GLU 29 HB1 GLU 29 30.245 26.416 16.691 186 HG2 GLU 29 HG2 GLU 29 31.371 27.328 14.478 187 HG3 GLU 29 HG1 GLU 29 32.822 27.137 15.449 188 H TYR 30 H TYR 30 28.087 27.568 16.917 189 HA TYR 30 HA TYR 30 27.033 28.642 14.379 190 HB2 TYR 30 HB2 TYR 30 26.589 25.859 15.434 191 HB3 TYR 30 HB1 TYR 30 25.661 26.616 14.080 192 HD1 TYR 30 HD1 TYR 30 28.503 27.695 12.880 193 HD2 TYR 30 HD2 TYR 30 26.719 23.984 14.055 194 HE1 TYR 30 HE1 TYR 30 29.806 26.482 11.116 195 HE2 TYR 30 HE2 TYR 30 28.054 22.750 12.410 196 HH TYR 30 HH TYR 30 29.568 22.953 10.730 197 H PHE 31 H PHE 31 24.855 29.044 14.397 198 HA PHE 31 HA PHE 31 23.278 28.600 16.871 199 HB2 PHE 31 HB2 PHE 31 23.471 31.185 15.258 200 HB3 PHE 31 HB1 PHE 31 22.198 30.806 16.421 201 HD1 PHE 31 HD1 PHE 31 22.475 31.064 18.714 202 HD2 PHE 31 HD2 PHE 31 25.882 31.393 16.128 203 HE1 PHE 31 HE1 PHE 31 23.726 32.307 20.472 204 HE2 PHE 31 HE2 PHE 31 27.108 32.602 17.821 205 HZ PHE 31 HZ PHE 31 26.072 33.030 20.081 206 H VAL 32 H VAL 32 20.937 29.821 15.566 207 HA VAL 32 HA VAL 32 19.711 27.824 14.035 208 HB VAL 32 HB VAL 32 19.353 30.813 14.017 209 HG11 VAL 32 1HG1 VAL 32 17.132 30.503 13.166 210 HG12 VAL 32 2HG1 VAL 32 18.359 30.143 12.002 211 HG13 VAL 32 3HG1 VAL 32 17.471 28.774 12.761 212 HG21 VAL 32 1HG2 VAL 32 17.515 30.343 15.474 213 HG22 VAL 32 2HG2 VAL 32 17.751 28.581 15.412 214 HG23 VAL 32 3HG2 VAL 32 18.925 29.553 16.208 215 H ARG 33 H ARG 33 19.432 27.411 11.959 216 HA ARG 33 HA ARG 33 21.055 28.876 9.909 217 HB2 ARG 33 HB2 ARG 33 20.856 27.006 8.456 218 HB3 ARG 33 HB1 ARG 33 21.873 26.713 9.862 219 HG2 ARG 33 HG2 ARG 33 19.096 25.860 10.270 220 HG3 ARG 33 HG1 ARG 33 19.728 25.085 8.916 221 HD2 ARG 33 HD2 ARG 33 20.191 23.650 10.751 222 HD3 ARG 33 HD1 ARG 33 21.682 24.265 10.128 223 HE ARG 33 HE ARG 33 21.756 25.873 11.983 224 HH11 ARG 33 1HH1 ARG 33 19.736 23.038 12.651 225 HH12 ARG 33 2HH1 ARG 33 20.563 22.678 14.171 226 HH21 ARG 33 1HH2 ARG 33 22.276 25.764 14.102 227 HH22 ARG 33 2HH2 ARG 33 21.765 24.434 15.134 228 H1 CYS 34 H1 CYS 34 12.726 29.252 17.039 229 H2 CYS 34 H2 CYS 34 13.339 27.860 16.470 230 H3 CYS 34 H3 CYS 34 11.928 27.840 17.371 231 HA CYS 34 HA CYS 34 13.173 28.678 19.244 232 HB2 CYS 34 HB2 CYS 34 14.183 26.041 18.106 233 HB3 CYS 34 HB1 CYS 34 14.230 26.549 19.833 234 H GLY 35 H GLY 35 15.153 29.589 19.943 235 HA2 GLY 35 HA2 GLY 35 17.303 30.021 17.876 236 HA3 GLY 35 HA1 GLY 35 16.641 31.190 18.947 237 H THR 36 H THR 36 18.841 28.549 18.571 238 HA THR 36 HA THR 36 20.084 29.058 21.251 239 HB THR 36 HB THR 36 19.362 26.408 19.998 240 HG1 THR 36 HG1 THR 36 18.075 26.376 21.928 241 HG21 THR 36 1HG2 THR 36 20.015 25.454 22.091 242 HG22 THR 36 2HG2 THR 36 21.383 26.377 21.520 243 HG23 THR 36 3HG2 THR 36 20.345 27.077 22.806 244 HA PRO 37 HA PRO 37 23.905 28.523 18.907 245 HB2 PRO 37 HB1 PRO 37 25.640 28.319 21.026 246 HB3 PRO 37 HB2 PRO 37 25.083 29.850 20.359 247 HG2 PRO 37 HG1 PRO 37 24.074 28.278 22.773 248 HG3 PRO 37 HG2 PRO 37 24.280 30.050 22.656 249 HD2 PRO 37 HD1 PRO 37 21.851 28.869 22.415 250 HD3 PRO 37 HD2 PRO 37 22.286 30.339 21.494 251 H ILE 38 H ILE 38 24.531 26.630 18.157 252 HA ILE 38 HA ILE 38 23.762 24.158 19.585 253 HB ILE 38 HB ILE 38 23.241 25.199 16.954 254 HG12 ILE 38 2HG1 ILE 38 21.455 23.431 17.045 255 HG13 ILE 38 1HG1 ILE 38 22.148 22.901 18.564 256 HG21 ILE 38 1HG2 ILE 38 23.374 23.041 15.671 257 HG22 ILE 38 2HG2 ILE 38 24.927 23.800 16.015 258 HG23 ILE 38 3HG2 ILE 38 24.432 22.435 16.949 259 HD11 ILE 38 HD1 ILE 38 20.263 24.388 18.904 260 HD12 ILE 38 HD2 ILE 38 21.695 25.221 19.470 261 HD13 ILE 38 HD3 ILE 38 20.975 25.641 17.855 262 H SER 39 H SER 39 26.476 25.701 18.224 263 HA SER 39 HA SER 39 28.227 23.381 18.804 264 HB2 SER 39 HB2 SER 39 28.460 24.995 16.239 265 HB3 SER 39 HB1 SER 39 29.517 23.715 16.772 266 HG SER 39 HG SER 39 27.736 22.293 16.766 267 H PHE 40 H PHE 40 30.441 23.957 19.243 268 HA PHE 40 HA PHE 40 30.850 26.754 20.035 269 HB2 PHE 40 HB2 PHE 40 31.116 24.236 21.710 270 HB3 PHE 40 HB1 PHE 40 31.497 25.850 22.211 271 HD1 PHE 40 HD1 PHE 40 29.591 27.467 22.696 272 HD2 PHE 40 HD2 PHE 40 28.927 23.380 21.506 273 HE1 PHE 40 HE1 PHE 40 27.200 27.751 23.102 274 HE2 PHE 40 HE2 PHE 40 26.449 23.708 21.882 275 HZ PHE 40 HZ PHE 40 25.647 25.858 22.821 276 H TYR 41 H TYR 41 33.184 26.628 21.183 277 HA TYR 41 HA TYR 41 34.991 25.698 18.992 278 HB2 TYR 41 HB2 TYR 41 34.882 28.212 20.658 279 HB3 TYR 41 HB1 TYR 41 36.344 27.749 19.803 280 HD1 TYR 41 HD1 TYR 41 35.701 26.996 17.162 281 HD2 TYR 41 HD2 TYR 41 33.876 30.003 19.660 282 HE1 TYR 41 HE1 TYR 41 35.009 28.287 15.147 283 HE2 TYR 41 HE2 TYR 41 33.225 31.271 17.580 284 HH TYR 41 HH TYR 41 33.491 31.376 15.185 285 H CYS 42 H CYS 42 34.409 24.386 21.706 286 HA CYS 42 HA CYS 42 35.203 23.868 23.665 287 HB2 CYS 42 HB2 CYS 42 37.428 23.432 22.314 288 HB3 CYS 42 HB1 CYS 42 37.932 24.913 23.106 Start of MODEL 12 1 H GLY 1 H GLY 1 17.358 16.498 19.158 2 HA2 GLY 1 HA2 GLY 1 14.911 16.591 19.957 3 HA3 GLY 1 HA1 GLY 1 15.519 17.604 21.219 4 H GLY 2 H GLY 2 17.340 18.455 18.560 5 HA2 GLY 2 HA2 GLY 2 16.836 20.151 16.915 6 HA3 GLY 2 HA1 GLY 2 15.467 20.692 17.874 7 H ALA 3 H ALA 3 16.063 22.718 18.138 8 HA ALA 3 HA ALA 3 18.381 23.336 19.930 9 HB1 ALA 3 HB1 ALA 3 18.883 25.263 18.464 10 HB2 ALA 3 HB2 ALA 3 19.004 23.657 17.659 11 HB3 ALA 3 HB3 ALA 3 17.651 24.686 17.311 12 H GLY 4 H GLY 4 16.382 23.291 21.404 13 HA2 GLY 4 HA2 GLY 4 15.098 25.959 21.539 14 HA3 GLY 4 HA1 GLY 4 14.190 24.516 21.989 15 H HIS 5 H HIS 5 13.881 24.717 24.167 16 HA HIS 5 HA HIS 5 15.681 26.481 25.625 17 HB2 HIS 5 HB2 HIS 5 13.778 26.712 27.144 18 HB3 HIS 5 HB1 HIS 5 13.342 26.902 25.438 19 HD2 HIS 5 HD2 HIS 5 12.102 25.380 28.456 20 HE1 HIS 5 HE1 HIS 5 10.369 23.002 25.359 21 HE2 HIS 5 HE2 HIS 5 10.194 23.639 27.753 22 H VAL 6 H VAL 6 15.067 23.045 25.770 23 HA VAL 6 HA VAL 6 16.618 22.919 28.299 24 HB VAL 6 HB VAL 6 15.275 20.821 28.808 25 HG11 VAL 6 1HG1 VAL 6 13.556 22.113 29.920 26 HG12 VAL 6 2HG1 VAL 6 15.013 23.109 30.033 27 HG13 VAL 6 3HG1 VAL 6 13.749 23.479 28.833 28 HG21 VAL 6 1HG2 VAL 6 13.030 20.702 28.038 29 HG22 VAL 6 2HG2 VAL 6 13.296 22.058 26.931 30 HG23 VAL 6 3HG2 VAL 6 14.174 20.484 26.719 31 HA PRO 7 HA PRO 7 19.355 20.563 26.107 32 HB2 PRO 7 HB1 PRO 7 20.521 18.834 27.893 33 HB3 PRO 7 HB2 PRO 7 20.699 20.611 27.965 34 HG2 PRO 7 HG1 PRO 7 18.800 18.826 29.473 35 HG3 PRO 7 HG2 PRO 7 19.806 20.093 30.177 36 HD2 PRO 7 HD1 PRO 7 17.268 20.738 29.626 37 HD3 PRO 7 HD2 PRO 7 18.539 21.850 29.208 38 H GLU 8 H GLU 8 19.731 18.809 24.871 39 HA GLU 8 HA GLU 8 18.089 16.374 25.151 40 HB2 GLU 8 HB2 GLU 8 17.272 18.035 23.523 41 HB3 GLU 8 HB1 GLU 8 18.773 17.876 22.576 42 HG2 GLU 8 HG2 GLU 8 17.711 15.245 22.946 43 HG3 GLU 8 HG1 GLU 8 16.308 16.261 22.647 44 H TYR 9 H TYR 9 21.316 17.692 24.484 45 HA TYR 9 HA TYR 9 22.218 14.864 24.542 46 HB2 TYR 9 HB2 TYR 9 23.198 17.097 22.780 47 HB3 TYR 9 HB1 TYR 9 24.310 15.940 23.324 48 HD1 TYR 9 HD1 TYR 9 24.234 13.598 22.655 49 HD2 TYR 9 HD2 TYR 9 21.538 16.497 21.085 50 HE1 TYR 9 HE1 TYR 9 23.769 12.065 20.754 51 HE2 TYR 9 HE2 TYR 9 21.116 15.067 19.097 52 HH TYR 9 HH TYR 9 21.843 13.187 17.973 53 H PHE 10 H PHE 10 23.826 14.502 25.856 54 HA PHE 10 HA PHE 10 24.915 16.661 27.554 55 HB2 PHE 10 HB2 PHE 10 22.744 16.066 28.452 56 HB3 PHE 10 HB1 PHE 10 23.295 14.391 28.657 57 HD1 PHE 10 HD1 PHE 10 23.227 14.046 31.026 58 HD2 PHE 10 HD2 PHE 10 25.091 17.659 29.472 59 HE1 PHE 10 HE1 PHE 10 24.005 14.605 33.219 60 HE2 PHE 10 HE2 PHE 10 25.761 18.247 31.751 61 HZ PHE 10 HZ PHE 10 25.201 16.679 33.669 62 H VAL 11 H VAL 11 25.701 14.582 29.662 63 HA VAL 11 HA VAL 11 28.395 14.186 28.767 64 HB VAL 11 HB VAL 11 26.783 13.246 31.168 65 HG11 VAL 11 1HG1 VAL 11 28.978 12.676 32.177 66 HG12 VAL 11 2HG1 VAL 11 28.692 11.653 30.744 67 HG13 VAL 11 3HG1 VAL 11 29.781 13.084 30.661 68 HG21 VAL 11 1HG2 VAL 11 28.094 14.935 32.341 69 HG22 VAL 11 2HG2 VAL 11 28.965 15.294 30.843 70 HG23 VAL 11 3HG2 VAL 11 27.248 15.687 30.994 71 H ARG 12 H ARG 12 29.257 12.758 27.703 72 HA ARG 12 HA ARG 12 28.589 9.945 27.739 73 HB2 ARG 12 HB2 ARG 12 28.500 9.575 25.432 74 HB3 ARG 12 HB1 ARG 12 27.266 10.777 25.840 75 HG2 ARG 12 HG2 ARG 12 27.970 11.550 23.877 76 HG3 ARG 12 HG1 ARG 12 28.988 12.508 24.970 77 HD2 ARG 12 HD2 ARG 12 30.561 11.915 23.444 78 HD3 ARG 12 HD1 ARG 12 30.760 10.639 24.585 79 HE ARG 12 HE ARG 12 28.979 10.013 22.283 80 HH11 ARG 12 1HH1 ARG 12 32.200 9.575 23.728 81 HH12 ARG 12 2HH1 ARG 12 32.377 8.044 22.829 82 HH21 ARG 12 1HH2 ARG 12 29.413 8.233 21.124 83 HH22 ARG 12 2HH2 ARG 12 31.032 7.470 21.341 84 H1 CYS 13 H1 CYS 13 33.590 21.062 28.811 85 H2 CYS 13 H2 CYS 13 34.991 20.278 28.877 86 H3 CYS 13 H3 CYS 13 34.328 20.717 27.415 87 HA CYS 13 HA CYS 13 32.549 19.235 27.697 88 HB2 CYS 13 HB2 CYS 13 35.245 17.934 28.119 89 HB3 CYS 13 HB1 CYS 13 33.745 16.995 27.982 90 H GLY 14 H GLY 14 31.244 17.996 29.005 91 HA2 GLY 14 HA2 GLY 14 30.751 17.135 31.324 92 HA3 GLY 14 HA1 GLY 14 31.552 18.599 31.921 93 H THR 15 H THR 15 29.467 19.130 29.195 94 HA THR 15 HA THR 15 27.380 20.243 30.886 95 HB THR 15 HB THR 15 29.060 22.011 30.748 96 HG1 THR 15 HG1 THR 15 27.255 22.904 28.867 97 HG21 THR 15 1HG2 THR 15 29.554 23.041 28.578 98 HG22 THR 15 2HG2 THR 15 30.095 21.306 28.581 99 HG23 THR 15 3HG2 THR 15 28.677 21.790 27.697 100 HA PRO 16 HA PRO 16 24.890 18.870 27.461 101 HB2 PRO 16 HB1 PRO 16 23.577 21.580 27.537 102 HB3 PRO 16 HB2 PRO 16 22.767 19.992 27.403 103 HG2 PRO 16 HG1 PRO 16 22.913 21.252 29.774 104 HG3 PRO 16 HG2 PRO 16 23.290 19.469 29.739 105 HD2 PRO 16 HD1 PRO 16 25.141 21.918 29.764 106 HD3 PRO 16 HD2 PRO 16 25.220 20.409 30.674 107 H ILE 17 H ILE 17 24.128 19.170 25.353 108 HA ILE 17 HA ILE 17 25.690 21.063 23.681 109 HB ILE 17 HB ILE 17 25.167 18.202 22.853 110 HG12 ILE 17 2HG1 ILE 17 27.795 18.164 23.096 111 HG13 ILE 17 1HG1 ILE 17 27.529 19.425 24.242 112 HG21 ILE 17 1HG2 ILE 17 26.836 18.732 21.177 113 HG22 ILE 17 2HG2 ILE 17 25.458 19.779 20.995 114 HG23 ILE 17 3HG2 ILE 17 26.954 20.383 21.830 115 HD11 ILE 17 HD1 ILE 17 27.771 17.096 25.190 116 HD12 ILE 17 HD2 ILE 17 26.316 17.949 25.713 117 HD13 ILE 17 HD3 ILE 17 26.191 16.750 24.411 118 H SER 18 H SER 18 23.538 18.989 21.821 119 HA SER 18 HA SER 18 21.957 21.165 21.207 120 HB2 SER 18 HB2 SER 18 20.836 18.416 20.756 121 HB3 SER 18 HB1 SER 18 20.928 19.827 19.697 122 HG SER 18 HG SER 18 22.235 18.114 19.053 123 H PHE 19 H PHE 19 19.456 21.015 21.159 124 HA PHE 19 HA PHE 19 18.483 20.571 23.920 125 HB2 PHE 19 HB2 PHE 19 18.245 22.938 22.057 126 HB3 PHE 19 HB1 PHE 19 17.253 22.805 23.480 127 HD1 PHE 19 HD1 PHE 19 18.018 23.662 25.538 128 HD2 PHE 19 HD2 PHE 19 20.763 23.243 22.276 129 HE1 PHE 19 HE1 PHE 19 19.659 24.896 26.809 130 HE2 PHE 19 HE2 PHE 19 22.458 24.550 23.572 131 HZ PHE 19 HZ PHE 19 21.978 25.307 25.819 132 H TYR 20 H TYR 20 16.027 20.808 24.068 133 HA TYR 20 HA TYR 20 14.675 19.651 21.683 134 HB2 TYR 20 HB2 TYR 20 13.652 20.159 24.527 135 HB3 TYR 20 HB1 TYR 20 12.703 19.537 23.198 136 HD1 TYR 20 HD1 TYR 20 15.218 18.821 25.645 137 HD2 TYR 20 HD2 TYR 20 12.935 17.231 22.422 138 HE1 TYR 20 HE1 TYR 20 15.682 16.478 26.501 139 HE2 TYR 20 HE2 TYR 20 13.410 14.920 23.179 140 HH TYR 20 HH TYR 20 14.905 13.725 24.551 141 H CYS 21 H CYS 21 13.668 20.836 20.343 142 HA CYS 21 HA CYS 21 12.374 23.391 21.119 143 HB2 CYS 21 HB2 CYS 21 14.066 24.083 19.706 144 HB3 CYS 21 HB1 CYS 21 13.873 22.675 18.630 145 H GLY 22 H GLY 22 31.411 23.070 19.181 146 HA2 GLY 22 HA2 GLY 22 31.278 20.816 17.221 147 HA3 GLY 22 HA1 GLY 22 32.787 21.160 18.075 148 H GLY 23 H GLY 23 30.760 21.677 20.551 149 HA2 GLY 23 HA2 GLY 23 29.849 19.112 21.353 150 HA3 GLY 23 HA1 GLY 23 31.532 19.312 21.789 151 H ALA 24 H ALA 24 31.663 19.878 23.873 152 HA ALA 24 HA ALA 24 29.395 21.332 25.172 153 HB1 ALA 24 HB1 ALA 24 29.737 19.669 26.914 154 HB2 ALA 24 HB2 ALA 24 29.476 18.868 25.339 155 HB3 ALA 24 HB3 ALA 24 31.097 18.958 26.038 156 H GLY 25 H GLY 25 30.174 23.357 25.776 157 HA2 GLY 25 HA2 GLY 25 31.944 23.538 27.972 158 HA3 GLY 25 HA1 GLY 25 32.889 23.905 26.576 159 H HIS 26 H HIS 26 33.256 25.851 27.406 160 HA HIS 26 HA HIS 26 31.552 27.614 28.744 161 HB2 HIS 26 HB2 HIS 26 33.561 28.994 28.766 162 HB3 HIS 26 HB1 HIS 26 33.693 27.376 29.360 163 HD2 HIS 26 HD2 HIS 26 35.272 29.664 26.775 164 HE1 HIS 26 HE1 HIS 26 36.973 25.807 26.129 165 HE2 HIS 26 HE2 HIS 26 37.133 28.223 25.510 166 H VAL 27 H VAL 27 31.873 27.498 25.366 167 HA VAL 27 HA VAL 27 30.396 30.018 25.075 168 HB VAL 27 HB VAL 27 31.898 30.634 23.108 169 HG11 VAL 27 1HG1 VAL 27 33.504 31.856 24.432 170 HG12 VAL 27 2HG1 VAL 27 32.010 31.847 25.345 171 HG13 VAL 27 3HG1 VAL 27 33.293 30.741 25.831 172 HG21 VAL 27 1HG2 VAL 27 34.261 29.971 23.208 173 HG22 VAL 27 2HG2 VAL 27 33.876 28.763 24.432 174 HG23 VAL 27 3HG2 VAL 27 33.192 28.574 22.853 175 HA PRO 28 HA PRO 28 28.381 27.533 22.049 176 HB2 PRO 28 HB1 PRO 28 27.330 29.358 20.297 177 HB3 PRO 28 HB2 PRO 28 26.819 29.180 21.991 178 HG2 PRO 28 HG1 PRO 28 28.825 31.112 20.887 179 HG3 PRO 28 HG2 PRO 28 27.343 31.482 21.871 180 HD2 PRO 28 HD1 PRO 28 29.795 31.224 23.068 181 HD3 PRO 28 HD2 PRO 28 28.374 30.530 23.837 182 H GLU 29 H GLU 29 28.306 26.892 19.829 183 HA GLU 29 HA GLU 29 30.748 27.438 18.238 184 HB2 GLU 29 HB2 GLU 29 30.773 25.323 19.371 185 HB3 GLU 29 HB1 GLU 29 29.278 24.841 18.521 186 HG2 GLU 29 HG2 GLU 29 30.534 25.238 16.363 187 HG3 GLU 29 HG1 GLU 29 32.024 25.248 17.305 188 H TYR 30 H TYR 30 27.533 25.949 17.722 189 HA TYR 30 HA TYR 30 27.118 27.662 15.365 190 HB2 TYR 30 HB2 TYR 30 26.893 24.656 15.550 191 HB3 TYR 30 HB1 TYR 30 26.025 25.560 14.318 192 HD1 TYR 30 HD1 TYR 30 27.617 27.467 13.177 193 HD2 TYR 30 HD2 TYR 30 28.794 23.592 14.618 194 HE1 TYR 30 HE1 TYR 30 29.589 27.449 11.609 195 HE2 TYR 30 HE2 TYR 30 30.774 23.612 13.082 196 HH TYR 30 HH TYR 30 31.767 24.712 11.300 197 H PHE 31 H PHE 31 25.054 27.938 14.642 198 HA PHE 31 HA PHE 31 22.973 27.786 16.765 199 HB2 PHE 31 HB2 PHE 31 24.582 29.971 16.238 200 HB3 PHE 31 HB1 PHE 31 23.147 30.339 15.311 201 HD1 PHE 31 HD1 PHE 31 24.682 30.469 18.433 202 HD2 PHE 31 HD2 PHE 31 20.873 30.049 16.543 203 HE1 PHE 31 HE1 PHE 31 23.594 31.300 20.511 204 HE2 PHE 31 HE2 PHE 31 19.760 31.030 18.588 205 HZ PHE 31 HZ PHE 31 21.111 31.627 20.544 206 H VAL 32 H VAL 32 23.479 28.633 13.269 207 HA VAL 32 HA VAL 32 20.738 27.734 12.766 208 HB VAL 32 HB VAL 32 20.707 30.082 13.350 209 HG11 VAL 32 1HG1 VAL 32 21.517 31.793 12.016 210 HG12 VAL 32 2HG1 VAL 32 22.941 30.850 12.454 211 HG13 VAL 32 3HG1 VAL 32 22.256 30.688 10.819 212 HG21 VAL 32 1HG2 VAL 32 19.415 30.918 11.471 213 HG22 VAL 32 2HG2 VAL 32 19.927 29.512 10.507 214 HG23 VAL 32 3HG2 VAL 32 18.974 29.245 11.963 215 H ARG 33 H ARG 33 20.392 26.642 11.025 216 HA ARG 33 HA ARG 33 21.633 27.151 8.513 217 HB2 ARG 33 HB2 ARG 33 22.305 24.725 8.213 218 HB3 ARG 33 HB1 ARG 33 23.443 25.743 9.105 219 HG2 ARG 33 HG2 ARG 33 23.351 23.546 9.975 220 HG3 ARG 33 HG1 ARG 33 22.818 24.714 11.170 221 HD2 ARG 33 HD2 ARG 33 21.464 22.751 11.348 222 HD3 ARG 33 HD1 ARG 33 20.417 23.985 10.676 223 HE ARG 33 HE ARG 33 21.807 21.780 9.156 224 HH11 ARG 33 1HH1 ARG 33 18.927 23.882 9.182 225 HH12 ARG 33 2HH1 ARG 33 18.264 22.957 7.841 226 HH21 ARG 33 1HH2 ARG 33 20.712 20.590 7.725 227 HH22 ARG 33 2HH2 ARG 33 19.177 21.196 7.056 228 H1 CYS 34 H1 CYS 34 12.322 30.167 19.640 229 H2 CYS 34 H2 CYS 34 11.974 29.336 18.273 230 H3 CYS 34 H3 CYS 34 11.478 28.755 19.716 231 HA CYS 34 HA CYS 34 13.638 28.324 20.459 232 HB2 CYS 34 HB2 CYS 34 13.283 27.298 17.641 233 HB3 CYS 34 HB1 CYS 34 14.281 26.562 18.888 234 H GLY 35 H GLY 35 15.583 29.156 20.641 235 HA2 GLY 35 HA2 GLY 35 17.067 30.345 18.379 236 HA3 GLY 35 HA1 GLY 35 16.498 31.486 19.581 237 H THR 36 H THR 36 18.122 28.324 19.606 238 HA THR 36 HA THR 36 19.861 29.330 21.762 239 HB THR 36 HB THR 36 18.649 26.548 21.615 240 HG1 THR 36 HG1 THR 36 17.306 27.202 23.176 241 HG21 THR 36 1HG2 THR 36 19.144 26.495 24.061 242 HG22 THR 36 2HG2 THR 36 20.595 26.663 23.132 243 HG23 THR 36 3HG2 THR 36 19.903 28.112 23.951 244 HA PRO 37 HA PRO 37 23.052 27.543 19.184 245 HB2 PRO 37 HB1 PRO 37 25.034 26.853 20.990 246 HB3 PRO 37 HB2 PRO 37 24.639 28.497 20.370 247 HG2 PRO 37 HG1 PRO 37 23.672 27.154 22.929 248 HG3 PRO 37 HG2 PRO 37 24.512 28.758 22.764 249 HD2 PRO 37 HD1 PRO 37 21.837 28.505 22.958 250 HD3 PRO 37 HD2 PRO 37 22.490 29.643 21.808 251 H ILE 38 H ILE 38 23.614 25.589 18.297 252 HA ILE 38 HA ILE 38 22.301 23.210 19.304 253 HB ILE 38 HB ILE 38 23.988 23.866 16.892 254 HG12 ILE 38 2HG1 ILE 38 21.930 23.129 15.716 255 HG13 ILE 38 1HG1 ILE 38 21.096 22.967 17.238 256 HG21 ILE 38 1HG2 ILE 38 23.584 21.619 16.081 257 HG22 ILE 38 2HG2 ILE 38 24.696 21.670 17.400 258 HG23 ILE 38 3HG2 ILE 38 23.001 21.135 17.709 259 HD11 ILE 38 HD1 ILE 38 22.327 25.599 16.369 260 HD12 ILE 38 HD2 ILE 38 20.643 25.107 15.991 261 HD13 ILE 38 HD3 ILE 38 21.175 25.295 17.670 262 H SER 39 H SER 39 25.631 24.362 19.144 263 HA SER 39 HA SER 39 26.398 22.589 21.324 264 HB2 SER 39 HB2 SER 39 28.114 21.461 20.242 265 HB3 SER 39 HB1 SER 39 26.693 21.243 19.219 266 HG SER 39 HG SER 39 28.446 21.610 18.052 267 H PHE 40 H PHE 40 28.834 22.837 21.609 268 HA PHE 40 HA PHE 40 29.528 25.714 21.827 269 HB2 PHE 40 HB2 PHE 40 29.677 23.504 23.898 270 HB3 PHE 40 HB1 PHE 40 30.112 25.155 24.186 271 HD1 PHE 40 HD1 PHE 40 27.322 22.749 23.839 272 HD2 PHE 40 HD2 PHE 40 28.377 26.854 24.495 273 HE1 PHE 40 HE1 PHE 40 24.955 23.272 24.363 274 HE2 PHE 40 HE2 PHE 40 25.992 27.372 25.064 275 HZ PHE 40 HZ PHE 40 24.308 25.569 24.996 276 H TYR 41 H TYR 41 31.927 25.794 22.839 277 HA TYR 41 HA TYR 41 33.663 24.133 21.166 278 HB2 TYR 41 HB2 TYR 41 34.249 26.059 23.461 279 HB3 TYR 41 HB1 TYR 41 35.453 25.182 22.560 280 HD1 TYR 41 HD1 TYR 41 36.357 27.524 22.536 281 HD2 TYR 41 HD2 TYR 41 32.996 26.228 20.157 282 HE1 TYR 41 HE1 TYR 41 36.671 29.418 21.044 283 HE2 TYR 41 HE2 TYR 41 33.393 27.969 18.568 284 HH TYR 41 HH TYR 41 35.492 30.793 19.261 285 H CYS 42 H CYS 42 35.278 22.649 22.026 286 HA CYS 42 HA CYS 42 35.352 22.326 24.899 287 HB2 CYS 42 HB2 CYS 42 33.749 20.619 24.403 288 HB3 CYS 42 HB1 CYS 42 34.833 19.829 23.261 Start of MODEL 13 1 H GLY 1 H GLY 1 16.154 16.837 22.128 2 HA2 GLY 1 HA2 GLY 1 16.782 15.971 19.394 3 HA3 GLY 1 HA1 GLY 1 15.324 15.309 20.037 4 H GLY 2 H GLY 2 17.088 18.387 19.521 5 HA2 GLY 2 HA2 GLY 2 15.279 19.916 18.181 6 HA3 GLY 2 HA1 GLY 2 14.735 20.019 19.859 7 H ALA 3 H ALA 3 15.190 22.298 18.989 8 HA ALA 3 HA ALA 3 17.614 23.216 20.402 9 HB1 ALA 3 HB1 ALA 3 17.882 25.008 18.751 10 HB2 ALA 3 HB2 ALA 3 18.237 23.406 18.158 11 HB3 ALA 3 HB3 ALA 3 16.715 24.220 17.670 12 H GLY 4 H GLY 4 16.904 24.412 22.111 13 HA2 GLY 4 HA2 GLY 4 14.806 26.225 22.172 14 HA3 GLY 4 HA1 GLY 4 14.069 24.692 22.569 15 H HIS 5 H HIS 5 14.152 24.128 24.562 16 HA HIS 5 HA HIS 5 15.165 26.207 26.393 17 HB2 HIS 5 HB2 HIS 5 12.817 26.192 27.370 18 HB3 HIS 5 HB1 HIS 5 13.052 26.790 25.748 19 HD2 HIS 5 HD2 HIS 5 12.838 23.082 25.263 20 HE1 HIS 5 HE1 HIS 5 8.864 24.478 25.024 21 HE2 HIS 5 HE2 HIS 5 10.405 22.633 24.397 22 H VAL 6 H VAL 6 15.318 22.967 26.305 23 HA VAL 6 HA VAL 6 16.493 22.887 28.926 24 HB VAL 6 HB VAL 6 15.173 20.484 29.191 25 HG11 VAL 6 1HG1 VAL 6 14.342 21.358 31.202 26 HG12 VAL 6 2HG1 VAL 6 15.943 22.027 30.971 27 HG13 VAL 6 3HG1 VAL 6 14.494 23.021 30.656 28 HG21 VAL 6 1HG2 VAL 6 12.849 20.760 29.209 29 HG22 VAL 6 2HG2 VAL 6 12.964 22.470 28.737 30 HG23 VAL 6 3HG2 VAL 6 13.476 21.139 27.616 31 HA PRO 7 HA PRO 7 19.107 20.623 26.441 32 HB2 PRO 7 HB1 PRO 7 20.708 19.166 28.197 33 HB3 PRO 7 HB2 PRO 7 20.630 20.958 28.212 34 HG2 PRO 7 HG1 PRO 7 19.103 19.049 29.980 35 HG3 PRO 7 HG2 PRO 7 20.096 20.450 30.464 36 HD2 PRO 7 HD1 PRO 7 17.428 20.628 30.140 37 HD3 PRO 7 HD2 PRO 7 18.485 21.973 29.713 38 H GLU 8 H GLU 8 19.594 18.636 25.339 39 HA GLU 8 HA GLU 8 18.023 16.294 26.057 40 HB2 GLU 8 HB2 GLU 8 17.222 17.339 23.977 41 HB3 GLU 8 HB1 GLU 8 18.854 17.183 23.280 42 HG2 GLU 8 HG2 GLU 8 18.656 14.673 23.623 43 HG3 GLU 8 HG1 GLU 8 16.975 14.948 23.994 44 H TYR 9 H TYR 9 20.713 16.697 23.771 45 HA TYR 9 HA TYR 9 22.218 14.553 25.152 46 HB2 TYR 9 HB2 TYR 9 22.828 16.155 22.724 47 HB3 TYR 9 HB1 TYR 9 23.897 14.934 23.364 48 HD1 TYR 9 HD1 TYR 9 20.571 13.649 23.714 49 HD2 TYR 9 HD2 TYR 9 23.746 14.310 20.925 50 HE1 TYR 9 HE1 TYR 9 19.549 12.007 22.184 51 HE2 TYR 9 HE2 TYR 9 22.715 12.560 19.392 52 HH TYR 9 HH TYR 9 21.266 10.975 19.298 53 H PHE 10 H PHE 10 22.376 15.549 27.082 54 HA PHE 10 HA PHE 10 24.344 17.554 27.699 55 HB2 PHE 10 HB2 PHE 10 22.486 16.957 29.123 56 HB3 PHE 10 HB1 PHE 10 23.057 15.282 29.195 57 HD1 PHE 10 HD1 PHE 10 24.900 18.574 29.585 58 HD2 PHE 10 HD2 PHE 10 23.638 14.897 31.459 59 HE1 PHE 10 HE1 PHE 10 26.121 19.194 31.612 60 HE2 PHE 10 HE2 PHE 10 24.792 15.549 33.498 61 HZ PHE 10 HZ PHE 10 26.129 17.602 33.579 62 H VAL 11 H VAL 11 26.075 16.291 29.400 63 HA VAL 11 HA VAL 11 28.072 15.327 27.692 64 HB VAL 11 HB VAL 11 28.288 16.239 30.081 65 HG11 VAL 11 1HG1 VAL 11 28.444 14.733 31.972 66 HG12 VAL 11 2HG1 VAL 11 26.823 14.625 31.268 67 HG13 VAL 11 3HG1 VAL 11 27.984 13.368 30.920 68 HG21 VAL 11 1HG2 VAL 11 30.352 15.133 30.528 69 HG22 VAL 11 2HG2 VAL 11 29.940 13.776 29.501 70 HG23 VAL 11 3HG2 VAL 11 30.198 15.371 28.737 71 H ARG 12 H ARG 12 28.836 13.476 27.065 72 HA ARG 12 HA ARG 12 27.312 11.476 26.216 73 HB2 ARG 12 HB2 ARG 12 29.337 10.336 25.632 74 HB3 ARG 12 HB1 ARG 12 29.451 12.035 25.373 75 HG2 ARG 12 HG2 ARG 12 31.528 11.692 26.234 76 HG3 ARG 12 HG1 ARG 12 30.695 12.124 27.688 77 HD2 ARG 12 HD2 ARG 12 32.175 10.189 28.008 78 HD3 ARG 12 HD1 ARG 12 30.460 9.681 28.228 79 HE ARG 12 HE ARG 12 30.591 8.391 26.315 80 HH11 ARG 12 1HH1 ARG 12 33.668 10.254 26.578 81 HH12 ARG 12 2HH1 ARG 12 34.390 9.278 25.328 82 HH21 ARG 12 1HH2 ARG 12 31.769 7.111 24.800 83 HH22 ARG 12 2HH2 ARG 12 33.446 7.589 24.525 84 H1 CYS 13 H1 CYS 13 34.891 21.070 30.459 85 H2 CYS 13 H2 CYS 13 35.635 20.455 29.117 86 H3 CYS 13 H3 CYS 13 35.712 22.086 29.462 87 HA CYS 13 HA CYS 13 33.399 22.363 29.105 88 HB2 CYS 13 HB2 CYS 13 34.634 20.794 26.843 89 HB3 CYS 13 HB1 CYS 13 33.262 21.863 26.767 90 H GLY 14 H GLY 14 31.445 21.470 29.485 91 HA2 GLY 14 HA2 GLY 14 30.960 18.553 29.204 92 HA3 GLY 14 HA1 GLY 14 30.705 19.319 30.742 93 H THR 15 H THR 15 30.035 21.395 28.095 94 HA THR 15 HA THR 15 27.454 21.851 28.671 95 HB THR 15 HB THR 15 28.492 22.223 25.881 96 HG1 THR 15 HG1 THR 15 29.271 23.746 28.109 97 HG21 THR 15 1HG2 THR 15 27.507 24.438 26.105 98 HG22 THR 15 2HG2 THR 15 26.284 23.231 26.467 99 HG23 THR 15 3HG2 THR 15 26.981 24.106 27.791 100 HA PRO 16 HA PRO 16 25.129 18.924 26.133 101 HB2 PRO 16 HB1 PRO 16 22.683 20.338 26.027 102 HB3 PRO 16 HB2 PRO 16 23.220 19.320 27.398 103 HG2 PRO 16 HG1 PRO 16 23.460 22.267 27.134 104 HG3 PRO 16 HG2 PRO 16 22.907 21.330 28.547 105 HD2 PRO 16 HD1 PRO 16 25.423 22.272 28.317 106 HD3 PRO 16 HD2 PRO 16 25.088 20.733 29.161 107 H ILE 17 H ILE 17 24.309 18.979 23.938 108 HA ILE 17 HA ILE 17 24.881 21.484 22.432 109 HB ILE 17 HB ILE 17 25.044 18.636 21.432 110 HG12 ILE 17 2HG1 ILE 17 27.210 19.628 20.504 111 HG13 ILE 17 1HG1 ILE 17 26.984 20.972 21.565 112 HG21 ILE 17 1HG2 ILE 17 25.421 19.585 19.229 113 HG22 ILE 17 2HG2 ILE 17 23.804 19.942 19.741 114 HG23 ILE 17 3HG2 ILE 17 25.017 21.210 19.839 115 HD11 ILE 17 HD1 ILE 17 28.546 19.337 22.469 116 HD12 ILE 17 HD2 ILE 17 27.178 19.484 23.552 117 HD13 ILE 17 HD3 ILE 17 27.298 18.064 22.458 118 H SER 18 H SER 18 22.709 18.701 21.697 119 HA SER 18 HA SER 18 20.659 20.489 20.863 120 HB2 SER 18 HB2 SER 18 19.351 18.430 20.541 121 HB3 SER 18 HB1 SER 18 20.966 18.275 19.886 122 HG SER 18 HG SER 18 20.695 16.589 20.865 123 H PHE 19 H PHE 19 18.472 20.350 21.593 124 HA PHE 19 HA PHE 19 18.007 20.317 24.522 125 HB2 PHE 19 HB2 PHE 19 17.127 22.265 22.350 126 HB3 PHE 19 HB1 PHE 19 16.490 22.318 23.964 127 HD1 PHE 19 HD1 PHE 19 17.322 23.741 25.534 128 HD2 PHE 19 HD2 PHE 19 19.687 22.821 22.076 129 HE1 PHE 19 HE1 PHE 19 18.852 25.503 26.147 130 HE2 PHE 19 HE2 PHE 19 21.309 24.522 22.750 131 HZ PHE 19 HZ PHE 19 20.892 25.931 24.787 132 H TYR 20 H TYR 20 15.606 20.542 24.833 133 HA TYR 20 HA TYR 20 13.842 19.000 23.009 134 HB2 TYR 20 HB2 TYR 20 13.242 20.713 25.445 135 HB3 TYR 20 HB1 TYR 20 12.024 19.932 24.497 136 HD1 TYR 20 HD1 TYR 20 11.124 18.012 25.306 137 HD2 TYR 20 HD2 TYR 20 15.150 19.045 26.417 138 HE1 TYR 20 HE1 TYR 20 11.205 16.042 26.844 139 HE2 TYR 20 HE2 TYR 20 15.227 17.192 27.984 140 HH TYR 20 HH TYR 20 14.218 15.300 28.623 141 H CYS 21 H CYS 21 12.361 20.022 21.638 142 HA CYS 21 HA CYS 21 11.870 22.905 21.995 143 HB2 CYS 21 HB1 CYS 21 13.019 22.762 19.812 144 HB3 CYS 21 HB2 CYS 21 12.040 21.372 19.372 145 H GLY 22 H GLY 22 31.396 25.091 17.968 146 HA2 GLY 22 HA2 GLY 22 30.578 22.699 16.724 147 HA3 GLY 22 HA1 GLY 22 32.242 23.005 16.252 148 H GLY 23 H GLY 23 30.175 21.680 18.471 149 HA2 GLY 23 HA2 GLY 23 30.870 20.064 19.969 150 HA3 GLY 23 HA1 GLY 23 32.305 21.018 20.472 151 H ALA 24 H ALA 24 31.481 20.299 22.578 152 HA ALA 24 HA ALA 24 29.483 21.935 23.815 153 HB1 ALA 24 HB1 ALA 24 30.684 21.265 25.863 154 HB2 ALA 24 HB2 ALA 24 30.050 19.920 24.841 155 HB3 ALA 24 HB3 ALA 24 31.795 20.226 24.890 156 H GLY 25 H GLY 25 30.374 23.599 25.648 157 HA2 GLY 25 HA2 GLY 25 32.741 24.492 26.020 158 HA3 GLY 25 HA1 GLY 25 32.443 25.282 24.419 159 H HIS 26 H HIS 26 33.142 26.986 25.917 160 HA HIS 26 HA HIS 26 31.543 27.992 27.931 161 HB2 HIS 26 HB2 HIS 26 33.662 29.266 26.110 162 HB3 HIS 26 HB1 HIS 26 33.063 30.027 27.580 163 HD2 HIS 26 HD2 HIS 26 35.464 27.391 26.243 164 HE1 HIS 26 HE1 HIS 26 36.162 27.695 30.428 165 HE2 HIS 26 HE2 HIS 26 37.024 26.734 28.246 166 H VAL 27 H VAL 27 31.585 28.879 24.492 167 HA VAL 27 HA VAL 27 29.307 30.694 24.798 168 HB VAL 27 HB VAL 27 30.685 32.326 23.269 169 HG11 VAL 27 1HG1 VAL 27 31.454 33.567 25.155 170 HG12 VAL 27 2HG1 VAL 27 29.878 32.904 25.543 171 HG13 VAL 27 3HG1 VAL 27 31.371 32.156 26.225 172 HG21 VAL 27 1HG2 VAL 27 33.037 32.442 23.655 173 HG22 VAL 27 2HG2 VAL 27 32.986 31.001 24.690 174 HG23 VAL 27 3HG2 VAL 27 32.601 30.831 22.971 175 HA PRO 28 HA PRO 28 27.904 28.686 21.485 176 HB2 PRO 28 HB1 PRO 28 26.319 30.398 20.112 177 HB3 PRO 28 HB2 PRO 28 25.989 29.804 21.790 178 HG2 PRO 28 HG1 PRO 28 27.324 32.421 20.963 179 HG3 PRO 28 HG2 PRO 28 25.934 32.193 22.051 180 HD2 PRO 28 HD1 PRO 28 28.498 32.395 22.950 181 HD3 PRO 28 HD2 PRO 28 27.432 31.166 23.742 182 H GLU 29 H GLU 29 28.344 27.907 19.554 183 HA GLU 29 HA GLU 29 30.140 29.226 17.671 184 HB2 GLU 29 HB2 GLU 29 30.633 27.008 18.349 185 HB3 GLU 29 HB1 GLU 29 29.007 26.427 17.904 186 HG2 GLU 29 HG2 GLU 29 29.547 26.975 15.481 187 HG3 GLU 29 HG1 GLU 29 31.217 27.325 15.993 188 H TYR 30 H TYR 30 26.817 27.932 17.919 189 HA TYR 30 HA TYR 30 26.046 29.538 15.545 190 HB2 TYR 30 HB2 TYR 30 25.332 26.634 16.140 191 HB3 TYR 30 HB1 TYR 30 24.364 27.648 15.105 192 HD1 TYR 30 HD1 TYR 30 27.042 25.326 15.135 193 HD2 TYR 30 HD2 TYR 30 25.534 28.791 13.080 194 HE1 TYR 30 HE1 TYR 30 28.470 24.810 13.176 195 HE2 TYR 30 HE2 TYR 30 27.050 28.364 11.214 196 HH TYR 30 HH TYR 30 28.626 26.906 10.341 197 H PHE 31 H PHE 31 25.031 31.157 16.584 198 HA PHE 31 HA PHE 31 23.401 30.773 18.895 199 HB2 PHE 31 HB2 PHE 31 24.520 32.939 18.175 200 HB3 PHE 31 HB1 PHE 31 23.326 33.081 16.917 201 HD1 PHE 31 HD1 PHE 31 23.904 33.031 20.574 202 HD2 PHE 31 HD2 PHE 31 21.072 33.804 17.463 203 HE1 PHE 31 HE1 PHE 31 22.475 34.221 22.193 204 HE2 PHE 31 HE2 PHE 31 19.569 34.955 19.103 205 HZ PHE 31 HZ PHE 31 20.245 35.074 21.497 206 H VAL 32 H VAL 32 22.887 30.700 15.451 207 HA VAL 32 HA VAL 32 20.788 28.871 15.857 208 HB VAL 32 HB VAL 32 19.658 31.215 15.784 209 HG11 VAL 32 1HG1 VAL 32 19.280 32.212 13.650 210 HG12 VAL 32 2HG1 VAL 32 21.009 32.274 14.068 211 HG13 VAL 32 3HG1 VAL 32 20.470 31.109 12.889 212 HG21 VAL 32 1HG2 VAL 32 17.823 30.517 14.419 213 HG22 VAL 32 2HG2 VAL 32 18.794 29.306 13.557 214 HG23 VAL 32 3HG2 VAL 32 18.408 29.071 15.258 215 H ARG 33 H ARG 33 20.304 27.827 13.692 216 HA ARG 33 HA ARG 33 22.705 27.287 12.203 217 HB2 ARG 33 HB2 ARG 33 21.412 25.797 10.938 218 HB3 ARG 33 HB1 ARG 33 21.040 25.574 12.634 219 HG2 ARG 33 HG2 ARG 33 18.937 25.500 11.959 220 HG3 ARG 33 HG1 ARG 33 19.044 27.259 12.117 221 HD2 ARG 33 HD2 ARG 33 17.955 26.623 9.970 222 HD3 ARG 33 HD1 ARG 33 19.469 27.491 9.758 223 HE ARG 33 HE ARG 33 20.335 24.975 9.639 224 HH11 ARG 33 1HH1 ARG 33 17.280 26.018 8.080 225 HH12 ARG 33 2HH1 ARG 33 17.480 24.779 6.835 226 HH21 ARG 33 1HH2 ARG 33 20.415 23.496 8.199 227 HH22 ARG 33 2HH2 ARG 33 19.095 23.191 7.056 228 H1 CYS 34 H1 CYS 34 11.434 28.929 21.427 229 H2 CYS 34 H2 CYS 34 10.662 28.716 19.994 230 H3 CYS 34 H3 CYS 34 10.399 27.685 21.253 231 HA CYS 34 HA CYS 34 12.703 26.965 21.187 232 HB2 CYS 34 HB2 CYS 34 11.347 26.672 18.517 233 HB3 CYS 34 HB1 CYS 34 12.746 25.735 19.099 234 H GLY 35 H GLY 35 14.808 27.425 20.629 235 HA2 GLY 35 HA2 GLY 35 15.881 28.954 18.647 236 HA3 GLY 35 HA1 GLY 35 15.261 30.106 19.771 237 H THR 36 H THR 36 17.414 30.664 20.044 238 HA THR 36 HA THR 36 19.263 30.932 21.306 239 HB THR 36 HB THR 36 17.685 29.719 23.108 240 HG1 THR 36 HG1 THR 36 19.674 30.170 24.400 241 HG21 THR 36 1HG2 THR 36 18.918 28.193 24.508 242 HG22 THR 36 2HG2 THR 36 18.887 27.418 22.946 243 HG23 THR 36 3HG2 THR 36 20.334 28.194 23.424 244 HA PRO 37 HA PRO 37 22.414 28.638 19.370 245 HB2 PRO 37 HB1 PRO 37 23.568 27.906 22.085 246 HB3 PRO 37 HB2 PRO 37 24.455 28.524 20.616 247 HG2 PRO 37 HG1 PRO 37 23.813 30.134 22.721 248 HG3 PRO 37 HG2 PRO 37 23.760 30.714 21.008 249 HD2 PRO 37 HD1 PRO 37 21.624 29.956 22.883 250 HD3 PRO 37 HD2 PRO 37 21.548 31.119 21.477 251 H ILE 38 H ILE 38 23.572 26.617 19.065 252 HA ILE 38 HA ILE 38 22.406 24.280 20.507 253 HB ILE 38 HB ILE 38 23.370 23.655 17.801 254 HG12 ILE 38 2HG1 ILE 38 20.887 24.026 17.055 255 HG13 ILE 38 1HG1 ILE 38 20.874 25.360 18.170 256 HG21 ILE 38 1HG2 ILE 38 21.492 22.078 18.027 257 HG22 ILE 38 2HG2 ILE 38 22.526 22.005 19.425 258 HG23 ILE 38 3HG2 ILE 38 21.009 22.869 19.547 259 HD11 ILE 38 HD1 ILE 38 21.456 26.032 15.847 260 HD12 ILE 38 HD2 ILE 38 22.773 26.389 16.928 261 HD13 ILE 38 HD3 ILE 38 22.875 24.970 15.868 262 H SER 39 H SER 39 25.274 24.984 18.424 263 HA SER 39 HA SER 39 26.822 23.498 20.419 264 HB2 SER 39 HB2 SER 39 28.560 23.071 18.751 265 HB3 SER 39 HB1 SER 39 26.964 22.460 18.252 266 HG SER 39 HG SER 39 26.887 23.781 16.714 267 H PHE 40 H PHE 40 29.027 24.151 20.685 268 HA PHE 40 HA PHE 40 29.308 27.085 21.120 269 HB2 PHE 40 HB2 PHE 40 29.621 24.721 22.985 270 HB3 PHE 40 HB1 PHE 40 30.112 26.366 23.401 271 HD1 PHE 40 HD1 PHE 40 28.531 28.040 24.044 272 HD2 PHE 40 HD2 PHE 40 27.218 24.122 22.829 273 HE1 PHE 40 HE1 PHE 40 26.220 28.675 24.595 274 HE2 PHE 40 HE2 PHE 40 24.872 24.821 23.380 275 HZ PHE 40 HZ PHE 40 24.376 27.054 24.228 276 H TYR 41 H TYR 41 31.510 27.423 22.230 277 HA TYR 41 HA TYR 41 33.650 26.031 20.697 278 HB2 TYR 41 HB2 TYR 41 33.521 28.791 21.885 279 HB3 TYR 41 HB1 TYR 41 34.931 28.125 21.063 280 HD1 TYR 41 HD1 TYR 41 34.086 26.946 18.604 281 HD2 TYR 41 HD2 TYR 41 32.929 30.602 20.569 282 HE1 TYR 41 HE1 TYR 41 33.410 27.910 16.455 283 HE2 TYR 41 HE2 TYR 41 32.260 31.570 18.352 284 HH TYR 41 HH TYR 41 32.419 31.261 16.075 285 H CYS 42 H CYS 42 34.578 24.528 21.950 286 HA CYS 42 HA CYS 42 35.249 25.020 24.781 287 HB2 CYS 42 HB1 CYS 42 34.332 22.838 24.183 288 HB3 CYS 42 HB2 CYS 42 35.683 22.580 23.061 Start of MODEL 14 1 H GLY 1 H GLY 1 16.842 16.612 18.923 2 HA2 GLY 1 HA2 GLY 1 19.470 17.389 17.689 3 HA3 GLY 1 HA1 GLY 1 18.371 16.489 16.760 4 H GLY 2 H GLY 2 16.753 18.711 18.837 5 HA2 GLY 2 HA2 GLY 2 16.516 20.828 16.762 6 HA3 GLY 2 HA1 GLY 2 15.381 20.518 18.057 7 H ALA 3 H ALA 3 15.803 22.853 18.563 8 HA ALA 3 HA ALA 3 18.048 23.094 20.498 9 HB1 ALA 3 HB1 ALA 3 18.304 25.451 19.828 10 HB2 ALA 3 HB2 ALA 3 18.720 24.328 18.551 11 HB3 ALA 3 HB3 ALA 3 17.130 25.172 18.499 12 H GLY 4 H GLY 4 17.436 24.337 22.426 13 HA2 GLY 4 HA2 GLY 4 15.031 25.672 22.936 14 HA3 GLY 4 HA1 GLY 4 14.605 23.973 22.906 15 H HIS 5 H HIS 5 14.360 23.282 24.978 16 HA HIS 5 HA HIS 5 15.736 24.665 27.124 17 HB2 HIS 5 HB2 HIS 5 13.852 24.142 28.423 18 HB3 HIS 5 HB1 HIS 5 13.355 24.963 26.996 19 HD2 HIS 5 HD2 HIS 5 11.709 22.765 28.945 20 HE1 HIS 5 HE1 HIS 5 11.204 20.749 25.216 21 HE2 HIS 5 HE2 HIS 5 10.390 20.899 27.592 22 H VAL 6 H VAL 6 14.701 21.313 26.520 23 HA VAL 6 HA VAL 6 16.736 20.460 28.544 24 HB VAL 6 HB VAL 6 15.506 18.492 28.993 25 HG11 VAL 6 1HG1 VAL 6 13.526 19.405 30.072 26 HG12 VAL 6 2HG1 VAL 6 14.889 20.500 30.313 27 HG13 VAL 6 3HG1 VAL 6 13.622 20.818 29.067 28 HG21 VAL 6 1HG2 VAL 6 13.297 18.011 28.035 29 HG22 VAL 6 2HG2 VAL 6 13.399 19.473 27.053 30 HG23 VAL 6 3HG2 VAL 6 14.516 18.095 26.776 31 HA PRO 7 HA PRO 7 19.096 19.159 25.436 32 HB2 PRO 7 HB1 PRO 7 20.838 17.339 26.514 33 HB3 PRO 7 HB2 PRO 7 20.786 19.052 27.000 34 HG2 PRO 7 HG1 PRO 7 19.497 16.660 28.359 35 HG3 PRO 7 HG2 PRO 7 20.419 17.971 29.129 36 HD2 PRO 7 HD1 PRO 7 17.687 17.953 29.047 37 HD3 PRO 7 HD2 PRO 7 18.619 19.462 28.920 38 H GLU 8 H GLU 8 19.629 17.811 23.852 39 HA GLU 8 HA GLU 8 18.499 15.094 23.653 40 HB2 GLU 8 HB2 GLU 8 17.230 16.736 22.355 41 HB3 GLU 8 HB1 GLU 8 18.727 17.201 21.522 42 HG2 GLU 8 HG2 GLU 8 18.232 14.389 21.229 43 HG3 GLU 8 HG1 GLU 8 16.804 15.280 20.717 44 H TYR 9 H TYR 9 21.181 17.262 22.852 45 HA TYR 9 HA TYR 9 22.883 14.896 22.990 46 HB2 TYR 9 HB2 TYR 9 23.261 17.171 21.044 47 HB3 TYR 9 HB1 TYR 9 24.594 16.160 21.566 48 HD1 TYR 9 HD1 TYR 9 22.713 16.621 18.738 49 HD2 TYR 9 HD2 TYR 9 23.726 13.445 21.521 50 HE1 TYR 9 HE1 TYR 9 22.358 15.069 17.041 51 HE2 TYR 9 HE2 TYR 9 23.452 11.826 19.683 52 HH TYR 9 HH TYR 9 23.270 11.671 17.397 53 H PHE 10 H PHE 10 23.740 15.073 24.900 54 HA PHE 10 HA PHE 10 24.787 17.685 25.848 55 HB2 PHE 10 HB2 PHE 10 22.776 16.766 27.121 56 HB3 PHE 10 HB1 PHE 10 23.755 15.358 27.467 57 HD1 PHE 10 HD1 PHE 10 24.327 15.351 29.799 58 HD2 PHE 10 HD2 PHE 10 24.502 19.081 27.580 59 HE1 PHE 10 HE1 PHE 10 25.098 16.448 31.753 60 HE2 PHE 10 HE2 PHE 10 25.212 20.211 29.641 61 HZ PHE 10 HZ PHE 10 25.547 18.916 31.742 62 H VAL 11 H VAL 11 26.368 16.347 28.033 63 HA VAL 11 HA VAL 11 28.561 15.306 26.529 64 HB VAL 11 HB VAL 11 28.753 16.329 28.698 65 HG11 VAL 11 1HG1 VAL 11 28.515 14.818 30.714 66 HG12 VAL 11 2HG1 VAL 11 26.975 15.266 29.953 67 HG13 VAL 11 3HG1 VAL 11 27.670 13.651 29.676 68 HG21 VAL 11 1HG2 VAL 11 30.614 14.906 29.429 69 HG22 VAL 11 2HG2 VAL 11 29.885 13.531 28.680 70 HG23 VAL 11 3HG2 VAL 11 30.481 14.834 27.625 71 H ARG 12 H ARG 12 29.211 13.249 26.267 72 HA ARG 12 HA ARG 12 27.396 11.192 25.558 73 HB2 ARG 12 HB2 ARG 12 29.371 9.959 25.031 74 HB3 ARG 12 HB1 ARG 12 29.547 11.610 24.517 75 HG2 ARG 12 HG2 ARG 12 31.597 11.246 25.375 76 HG3 ARG 12 HG1 ARG 12 30.788 11.918 26.813 77 HD2 ARG 12 HD2 ARG 12 31.975 10.105 27.670 78 HD3 ARG 12 HD1 ARG 12 30.392 9.433 27.450 79 HE ARG 12 HE ARG 12 31.147 8.118 25.675 80 HH11 ARG 12 1HH1 ARG 12 33.831 10.237 26.627 81 HH12 ARG 12 2HH1 ARG 12 35.042 9.111 26.007 82 HH21 ARG 12 1HH2 ARG 12 32.799 6.777 24.757 83 HH22 ARG 12 2HH2 ARG 12 34.442 7.369 24.811 84 H1 CYS 13 H1 CYS 13 33.525 23.155 29.981 85 H2 CYS 13 H2 CYS 13 34.894 22.389 29.726 86 H3 CYS 13 H3 CYS 13 34.724 23.853 29.072 87 HA CYS 13 HA CYS 13 33.080 23.048 27.512 88 HB2 CYS 13 HB2 CYS 13 35.460 21.194 27.628 89 HB3 CYS 13 HB1 CYS 13 34.404 21.566 26.214 90 H GLY 14 H GLY 14 31.240 22.388 28.421 91 HA2 GLY 14 HA2 GLY 14 30.730 19.463 28.448 92 HA3 GLY 14 HA1 GLY 14 30.488 20.290 29.952 93 H THR 15 H THR 15 29.784 22.215 27.239 94 HA THR 15 HA THR 15 27.161 22.737 27.811 95 HB THR 15 HB THR 15 28.633 23.064 25.151 96 HG1 THR 15 HG1 THR 15 28.671 24.949 27.186 97 HG21 THR 15 1HG2 THR 15 27.631 25.253 25.057 98 HG22 THR 15 2HG2 THR 15 26.360 24.021 24.975 99 HG23 THR 15 3HG2 THR 15 26.659 24.986 26.467 100 HA PRO 16 HA PRO 16 24.966 19.733 25.102 101 HB2 PRO 16 HB1 PRO 16 22.676 21.155 24.386 102 HB3 PRO 16 HB2 PRO 16 22.964 20.396 25.952 103 HG2 PRO 16 HG1 PRO 16 23.446 23.305 25.213 104 HG3 PRO 16 HG2 PRO 16 22.533 22.616 26.619 105 HD2 PRO 16 HD1 PRO 16 25.127 23.417 26.891 106 HD3 PRO 16 HD2 PRO 16 24.499 21.900 27.655 107 H ILE 17 H ILE 17 24.398 19.430 23.010 108 HA ILE 17 HA ILE 17 25.435 21.331 20.937 109 HB ILE 17 HB ILE 17 25.517 18.294 21.172 110 HG12 ILE 17 2HG1 ILE 17 27.829 20.201 20.756 111 HG13 ILE 17 1HG1 ILE 17 27.272 19.700 22.353 112 HG21 ILE 17 1HG2 ILE 17 26.658 18.264 18.944 113 HG22 ILE 17 2HG2 ILE 17 25.046 18.924 18.787 114 HG23 ILE 17 3HG2 ILE 17 26.385 20.038 18.841 115 HD11 ILE 17 HD1 ILE 17 29.149 18.287 21.731 116 HD12 ILE 17 HD2 ILE 17 27.632 17.343 21.740 117 HD13 ILE 17 HD3 ILE 17 28.407 17.831 20.225 118 H SER 18 H SER 18 22.744 19.599 22.111 119 HA SER 18 HA SER 18 21.058 20.867 20.212 120 HB2 SER 18 HB2 SER 18 21.103 17.850 20.066 121 HB3 SER 18 HB1 SER 18 19.876 18.863 19.327 122 HG SER 18 HG SER 18 22.349 19.699 18.664 123 H PHE 19 H PHE 19 18.767 20.478 20.765 124 HA PHE 19 HA PHE 19 18.213 19.396 23.460 125 HB2 PHE 19 HB2 PHE 19 17.218 22.007 22.291 126 HB3 PHE 19 HB1 PHE 19 16.712 21.303 23.787 127 HD1 PHE 19 HD1 PHE 19 17.933 21.722 25.757 128 HD2 PHE 19 HD2 PHE 19 19.647 22.905 22.019 129 HE1 PHE 19 HE1 PHE 19 19.540 23.201 26.975 130 HE2 PHE 19 HE2 PHE 19 21.214 24.358 23.168 131 HZ PHE 19 HZ PHE 19 21.180 24.537 25.651 132 H TYR 20 H TYR 20 15.681 19.161 23.731 133 HA TYR 20 HA TYR 20 14.325 18.401 21.237 134 HB2 TYR 20 HB2 TYR 20 13.133 19.087 23.919 135 HB3 TYR 20 HB1 TYR 20 12.352 18.262 22.620 136 HD1 TYR 20 HD1 TYR 20 14.867 16.312 22.036 137 HD2 TYR 20 HD2 TYR 20 12.473 17.416 25.443 138 HE1 TYR 20 HE1 TYR 20 15.403 14.116 23.133 139 HE2 TYR 20 HE2 TYR 20 13.106 15.213 26.535 140 HH TYR 20 HH TYR 20 14.384 13.445 26.391 141 H CYS 21 H CYS 21 12.388 19.368 20.510 142 HA CYS 21 HA CYS 21 11.982 22.252 20.847 143 HB2 CYS 21 HB1 CYS 21 13.714 22.081 19.100 144 HB3 CYS 21 HB2 CYS 21 12.671 20.859 18.275 145 H GLY 22 H GLY 22 32.501 21.997 16.117 146 HA2 GLY 22 HA2 GLY 22 34.338 23.342 17.015 147 HA3 GLY 22 HA1 GLY 22 33.152 24.425 17.698 148 H GLY 23 H GLY 23 31.504 21.691 18.212 149 HA2 GLY 23 HA2 GLY 23 31.685 19.922 19.636 150 HA3 GLY 23 HA1 GLY 23 33.122 20.657 20.369 151 H ALA 24 H ALA 24 32.568 21.061 22.442 152 HA ALA 24 HA ALA 24 29.939 22.250 23.126 153 HB1 ALA 24 HB1 ALA 24 29.774 20.644 24.988 154 HB2 ALA 24 HB2 ALA 24 29.419 19.964 23.386 155 HB3 ALA 24 HB3 ALA 24 30.947 19.572 24.262 156 H GLY 25 H GLY 25 31.082 24.149 23.443 157 HA2 GLY 25 HA2 GLY 25 32.096 24.421 26.180 158 HA3 GLY 25 HA1 GLY 25 33.223 24.859 24.854 159 H HIS 26 H HIS 26 33.356 26.873 25.830 160 HA HIS 26 HA HIS 26 31.096 28.356 26.679 161 HB2 HIS 26 HB2 HIS 26 32.634 29.880 27.479 162 HB3 HIS 26 HB1 HIS 26 33.133 28.227 27.851 163 HD2 HIS 26 HD2 HIS 26 34.809 27.761 24.987 164 HE1 HIS 26 HE1 HIS 26 37.356 30.641 26.819 165 HE2 HIS 26 HE2 HIS 26 37.210 28.844 25.068 166 H VAL 27 H VAL 27 32.060 28.311 23.497 167 HA VAL 27 HA VAL 27 30.720 30.907 22.964 168 HB VAL 27 HB VAL 27 32.495 31.302 21.151 169 HG11 VAL 27 1HG1 VAL 27 33.699 32.777 22.555 170 HG12 VAL 27 2HG1 VAL 27 32.040 32.784 23.118 171 HG13 VAL 27 3HG1 VAL 27 33.290 31.857 24.003 172 HG21 VAL 27 1HG2 VAL 27 34.758 30.642 21.654 173 HG22 VAL 27 2HG2 VAL 27 34.311 29.908 23.182 174 HG23 VAL 27 3HG2 VAL 27 33.793 29.138 21.671 175 HA PRO 28 HA PRO 28 28.772 28.363 20.011 176 HB2 PRO 28 HB1 PRO 28 27.525 30.116 18.377 177 HB3 PRO 28 HB2 PRO 28 27.213 29.881 20.129 178 HG2 PRO 28 HG1 PRO 28 28.873 31.934 18.763 179 HG3 PRO 28 HG2 PRO 28 27.606 32.222 20.018 180 HD2 PRO 28 HD1 PRO 28 30.256 32.063 20.744 181 HD3 PRO 28 HD2 PRO 28 28.954 31.519 21.791 182 H GLU 29 H GLU 29 29.580 27.087 18.600 183 HA GLU 29 HA GLU 29 31.575 27.702 16.543 184 HB2 GLU 29 HB2 GLU 29 31.026 25.451 17.725 185 HB3 GLU 29 HB1 GLU 29 29.686 25.335 16.588 186 HG2 GLU 29 HG2 GLU 29 31.327 25.602 14.700 187 HG3 GLU 29 HG1 GLU 29 32.639 25.595 15.851 188 H TYR 30 H TYR 30 28.093 27.213 16.553 189 HA TYR 30 HA TYR 30 27.814 28.686 14.043 190 HB2 TYR 30 HB2 TYR 30 26.621 25.914 14.589 191 HB3 TYR 30 HB1 TYR 30 26.033 26.990 13.377 192 HD1 TYR 30 HD1 TYR 30 28.281 24.312 14.025 193 HD2 TYR 30 HD2 TYR 30 27.712 27.834 11.619 194 HE1 TYR 30 HE1 TYR 30 29.783 23.385 12.295 195 HE2 TYR 30 HE2 TYR 30 29.307 26.935 9.911 196 HH TYR 30 HH TYR 30 31.067 23.956 10.534 197 H PHE 31 H PHE 31 26.436 30.205 14.366 198 HA PHE 31 HA PHE 31 24.022 29.998 16.064 199 HB2 PHE 31 HB2 PHE 31 25.319 32.102 14.350 200 HB3 PHE 31 HB1 PHE 31 23.585 32.199 14.638 201 HD1 PHE 31 HD1 PHE 31 22.674 32.127 16.938 202 HD2 PHE 31 HD2 PHE 31 26.816 32.834 16.114 203 HE1 PHE 31 HE1 PHE 31 22.939 33.220 19.157 204 HE2 PHE 31 HE2 PHE 31 27.112 33.854 18.399 205 HZ PHE 31 HZ PHE 31 25.140 33.946 19.915 206 H VAL 32 H VAL 32 21.955 30.572 14.696 207 HA VAL 32 HA VAL 32 21.664 28.117 13.323 208 HB VAL 32 HB VAL 32 19.583 30.289 13.671 209 HG11 VAL 32 1HG1 VAL 32 18.018 28.247 13.842 210 HG12 VAL 32 2HG1 VAL 32 18.791 28.410 12.287 211 HG13 VAL 32 3HG1 VAL 32 19.407 27.246 13.449 212 HG21 VAL 32 1HG2 VAL 32 18.925 28.973 15.681 213 HG22 VAL 32 2HG2 VAL 32 20.446 28.130 15.613 214 HG23 VAL 32 3HG2 VAL 32 20.415 29.903 15.931 215 H ARG 33 H ARG 33 21.712 27.739 11.287 216 HA ARG 33 HA ARG 33 21.912 29.283 8.954 217 HB2 ARG 33 HB2 ARG 33 21.199 27.224 7.848 218 HB3 ARG 33 HB1 ARG 33 22.444 26.903 9.070 219 HG2 ARG 33 HG2 ARG 33 21.106 25.258 9.717 220 HG3 ARG 33 HG1 ARG 33 20.197 26.520 10.542 221 HD2 ARG 33 HD2 ARG 33 18.538 25.404 9.380 222 HD3 ARG 33 HD1 ARG 33 18.878 26.774 8.316 223 HE ARG 33 HE ARG 33 20.574 24.614 7.506 224 HH11 ARG 33 1HH1 ARG 33 17.045 24.891 7.671 225 HH12 ARG 33 2HH1 ARG 33 16.899 24.149 6.075 226 HH21 ARG 33 1HH2 ARG 33 20.284 23.542 5.690 227 HH22 ARG 33 2HH2 ARG 33 18.696 23.024 5.191 228 H1 CYS 34 H1 CYS 34 13.355 28.342 20.416 229 H2 CYS 34 H2 CYS 34 12.178 27.773 19.422 230 H3 CYS 34 H3 CYS 34 12.584 26.961 20.792 231 HA CYS 34 HA CYS 34 14.678 26.384 20.011 232 HB2 CYS 34 HB2 CYS 34 12.918 26.043 17.583 233 HB3 CYS 34 HB1 CYS 34 14.204 24.965 18.153 234 H GLY 35 H GLY 35 16.197 28.122 19.749 235 HA2 GLY 35 HA2 GLY 35 16.737 29.023 17.047 236 HA3 GLY 35 HA1 GLY 35 16.094 30.226 18.190 237 H THR 36 H THR 36 18.161 27.607 19.244 238 HA THR 36 HA THR 36 20.046 29.444 20.425 239 HB THR 36 HB THR 36 20.217 26.443 20.444 240 HG1 THR 36 HG1 THR 36 19.046 27.100 22.618 241 HG21 THR 36 1HG2 THR 36 21.128 26.676 22.601 242 HG22 THR 36 2HG2 THR 36 22.057 27.777 21.607 243 HG23 THR 36 3HG2 THR 36 20.778 28.412 22.693 244 HA PRO 37 HA PRO 37 23.330 28.233 17.379 245 HB2 PRO 37 HB1 PRO 37 25.462 28.431 19.165 246 HB3 PRO 37 HB2 PRO 37 24.874 29.755 18.113 247 HG2 PRO 37 HG1 PRO 37 24.327 29.311 20.967 248 HG3 PRO 37 HG2 PRO 37 24.515 30.881 20.111 249 HD2 PRO 37 HD1 PRO 37 22.063 29.915 20.842 250 HD3 PRO 37 HD2 PRO 37 22.366 30.862 19.345 251 H ILE 38 H ILE 38 24.735 26.417 17.244 252 HA ILE 38 HA ILE 38 23.212 24.238 18.478 253 HB ILE 38 HB ILE 38 24.803 24.268 15.912 254 HG12 ILE 38 2HG1 ILE 38 22.442 23.990 14.969 255 HG13 ILE 38 1HG1 ILE 38 21.839 24.570 16.516 256 HG21 ILE 38 1HG2 ILE 38 23.714 22.166 15.440 257 HG22 ILE 38 2HG2 ILE 38 24.535 22.030 17.037 258 HG23 ILE 38 3HG2 ILE 38 22.763 22.275 16.917 259 HD11 ILE 38 HD1 ILE 38 21.890 26.244 14.668 260 HD12 ILE 38 HD2 ILE 38 22.710 26.778 16.078 261 HD13 ILE 38 HD3 ILE 38 23.685 26.180 14.705 262 H SER 39 H SER 39 26.539 24.006 17.121 263 HA SER 39 HA SER 39 27.403 22.775 19.663 264 HB2 SER 39 HB2 SER 39 29.436 22.127 18.415 265 HB3 SER 39 HB1 SER 39 27.941 21.441 17.770 266 HG SER 39 HG SER 39 28.321 22.458 15.961 267 H PHE 40 H PHE 40 29.595 23.509 20.414 268 HA PHE 40 HA PHE 40 30.052 26.433 20.191 269 HB2 PHE 40 HB2 PHE 40 29.525 24.874 22.737 270 HB3 PHE 40 HB1 PHE 40 30.116 26.525 22.550 271 HD1 PHE 40 HD1 PHE 40 27.185 24.223 22.007 272 HD2 PHE 40 HD2 PHE 40 28.619 28.195 22.450 273 HE1 PHE 40 HE1 PHE 40 24.861 25.019 22.164 274 HE2 PHE 40 HE2 PHE 40 26.239 29.076 22.474 275 HZ PHE 40 HZ PHE 40 24.364 27.443 22.466 276 H TYR 41 H TYR 41 32.224 26.957 20.179 277 HA TYR 41 HA TYR 41 34.255 24.932 20.047 278 HB2 TYR 41 HB2 TYR 41 34.909 27.753 20.621 279 HB3 TYR 41 HB1 TYR 41 35.808 26.548 19.757 280 HD1 TYR 41 HD1 TYR 41 35.191 25.846 17.332 281 HD2 TYR 41 HD2 TYR 41 33.491 29.263 19.434 282 HE1 TYR 41 HE1 TYR 41 34.690 26.962 15.203 283 HE2 TYR 41 HE2 TYR 41 33.118 30.368 17.283 284 HH TYR 41 HH TYR 41 32.944 29.974 15.043 285 H CYS 42 H CYS 42 35.985 24.655 21.435 286 HA CYS 42 HA CYS 42 35.626 25.199 24.316 287 HB2 CYS 42 HB1 CYS 42 34.985 22.918 23.777 288 HB3 CYS 42 HB2 CYS 42 36.408 22.726 22.726 Start of MODEL 15 1 H GLY 1 H GLY 1 19.024 16.098 18.061 2 HA2 GLY 1 HA2 GLY 1 16.582 15.497 18.065 3 HA3 GLY 1 HA1 GLY 1 16.457 16.651 19.426 4 H GLY 2 H GLY 2 17.754 18.847 18.843 5 HA2 GLY 2 HA2 GLY 2 17.973 19.870 16.292 6 HA3 GLY 2 HA1 GLY 2 16.324 20.212 16.902 7 H ALA 3 H ALA 3 17.164 22.425 16.719 8 HA ALA 3 HA ALA 3 18.498 23.390 19.179 9 HB1 ALA 3 HB1 ALA 3 17.806 25.622 18.311 10 HB2 ALA 3 HB2 ALA 3 18.650 24.729 17.044 11 HB3 ALA 3 HB3 ALA 3 16.881 24.815 17.034 12 H GLY 4 H GLY 4 17.315 24.511 20.876 13 HA2 GLY 4 HA2 GLY 4 14.586 24.544 21.319 14 HA3 GLY 4 HA1 GLY 4 15.074 22.854 21.576 15 H HIS 5 H HIS 5 14.198 23.298 23.778 16 HA HIS 5 HA HIS 5 15.895 25.174 25.358 17 HB2 HIS 5 HB2 HIS 5 13.977 25.690 26.584 18 HB3 HIS 5 HB1 HIS 5 13.594 25.823 24.850 19 HD2 HIS 5 HD2 HIS 5 12.486 24.037 28.003 20 HE1 HIS 5 HE1 HIS 5 10.336 22.178 24.830 21 HE2 HIS 5 HE2 HIS 5 10.581 22.323 27.351 22 H VAL 6 H VAL 6 15.419 21.886 25.143 23 HA VAL 6 HA VAL 6 16.483 21.436 27.801 24 HB VAL 6 HB VAL 6 15.000 19.380 27.914 25 HG11 VAL 6 1HG1 VAL 6 13.231 20.568 29.073 26 HG12 VAL 6 2HG1 VAL 6 14.775 21.273 29.472 27 HG13 VAL 6 3HG1 VAL 6 13.675 22.067 28.244 28 HG21 VAL 6 1HG2 VAL 6 12.841 19.415 26.941 29 HG22 VAL 6 2HG2 VAL 6 13.128 21.040 26.206 30 HG23 VAL 6 3HG2 VAL 6 14.024 19.619 25.612 31 HA PRO 7 HA PRO 7 19.211 19.505 25.286 32 HB2 PRO 7 HB1 PRO 7 20.746 17.892 27.004 33 HB3 PRO 7 HB2 PRO 7 20.578 19.667 27.146 34 HG2 PRO 7 HG1 PRO 7 19.094 17.482 28.605 35 HG3 PRO 7 HG2 PRO 7 19.919 18.879 29.324 36 HD2 PRO 7 HD1 PRO 7 17.260 18.934 28.820 37 HD3 PRO 7 HD2 PRO 7 18.241 20.401 28.567 38 H GLU 8 H GLU 8 19.602 17.979 23.872 39 HA GLU 8 HA GLU 8 18.424 15.239 23.982 40 HB2 GLU 8 HB2 GLU 8 17.388 16.786 22.476 41 HB3 GLU 8 HB1 GLU 8 18.925 17.186 21.704 42 HG2 GLU 8 HG2 GLU 8 18.387 14.304 21.601 43 HG3 GLU 8 HG1 GLU 8 17.079 15.202 20.940 44 H TYR 9 H TYR 9 21.336 17.196 23.425 45 HA TYR 9 HA TYR 9 22.803 14.720 24.087 46 HB2 TYR 9 HB2 TYR 9 23.517 16.556 21.800 47 HB3 TYR 9 HB1 TYR 9 24.734 15.685 22.705 48 HD1 TYR 9 HD1 TYR 9 22.972 15.486 19.687 49 HD2 TYR 9 HD2 TYR 9 24.073 13.056 23.062 50 HE1 TYR 9 HE1 TYR 9 22.485 13.612 18.416 51 HE2 TYR 9 HE2 TYR 9 23.748 11.060 21.736 52 HH TYR 9 HH TYR 9 23.136 10.200 19.613 53 H PHE 10 H PHE 10 23.804 14.919 25.741 54 HA PHE 10 HA PHE 10 24.599 17.510 26.929 55 HB2 PHE 10 HB2 PHE 10 22.923 15.829 27.996 56 HB3 PHE 10 HB1 PHE 10 24.385 14.981 28.468 57 HD1 PHE 10 HD1 PHE 10 22.874 18.430 28.402 58 HD2 PHE 10 HD2 PHE 10 25.410 15.685 30.505 59 HE1 PHE 10 HE1 PHE 10 23.034 20.083 30.266 60 HE2 PHE 10 HE2 PHE 10 25.569 17.242 32.327 61 HZ PHE 10 HZ PHE 10 24.323 19.477 32.258 62 H VAL 11 H VAL 11 26.569 16.645 28.654 63 HA VAL 11 HA VAL 11 28.761 15.616 26.974 64 HB VAL 11 HB VAL 11 28.971 17.410 28.729 65 HG11 VAL 11 1HG1 VAL 11 29.553 16.768 30.955 66 HG12 VAL 11 2HG1 VAL 11 27.842 16.384 30.595 67 HG13 VAL 11 3HG1 VAL 11 29.073 15.095 30.683 68 HG21 VAL 11 1HG2 VAL 11 31.216 16.660 29.348 69 HG22 VAL 11 2HG2 VAL 11 30.830 15.027 28.785 70 HG23 VAL 11 3HG2 VAL 11 30.850 16.389 27.610 71 H ARG 12 H ARG 12 29.787 13.669 27.427 72 HA ARG 12 HA ARG 12 28.634 11.766 29.334 73 HB2 ARG 12 HB2 ARG 12 28.705 9.908 27.963 74 HB3 ARG 12 HB1 ARG 12 27.756 11.119 27.140 75 HG2 ARG 12 HG2 ARG 12 29.054 10.402 25.372 76 HG3 ARG 12 HG1 ARG 12 30.084 11.686 25.953 77 HD2 ARG 12 HD2 ARG 12 31.502 9.882 25.494 78 HD3 ARG 12 HD1 ARG 12 31.364 9.956 27.261 79 HE ARG 12 HE ARG 12 29.615 8.080 25.723 80 HH11 ARG 12 1HH1 ARG 12 32.384 8.404 27.897 81 HH12 ARG 12 2HH1 ARG 12 32.648 6.681 27.987 82 HH21 ARG 12 1HH2 ARG 12 29.551 6.075 26.503 83 HH22 ARG 12 2HH2 ARG 12 30.942 5.300 27.291 84 H1 CYS 13 H1 CYS 13 32.600 23.977 27.805 85 H2 CYS 13 H2 CYS 13 33.896 23.753 28.714 86 H3 CYS 13 H3 CYS 13 34.051 24.620 27.340 87 HA CYS 13 HA CYS 13 33.490 22.556 26.092 88 HB2 CYS 13 HB2 CYS 13 35.747 22.013 28.030 89 HB3 CYS 13 HB1 CYS 13 35.576 21.363 26.416 90 H GLY 14 H GLY 14 32.973 20.261 26.223 91 HA2 GLY 14 HA2 GLY 14 32.131 18.350 27.198 92 HA3 GLY 14 HA1 GLY 14 32.779 18.872 28.729 93 H THR 15 H THR 15 30.216 19.966 26.416 94 HA THR 15 HA THR 15 28.474 20.617 28.678 95 HB THR 15 HB THR 15 27.844 22.589 27.112 96 HG1 THR 15 HG1 THR 15 29.168 23.032 25.586 97 HG21 THR 15 1HG2 THR 15 29.664 23.943 27.822 98 HG22 THR 15 2HG2 THR 15 29.319 22.807 29.126 99 HG23 THR 15 3HG2 THR 15 30.729 22.543 28.038 100 HA PRO 16 HA PRO 16 24.938 19.356 26.027 101 HB2 PRO 16 HB1 PRO 16 23.311 21.633 26.254 102 HB3 PRO 16 HB2 PRO 16 23.436 20.275 27.403 103 HG2 PRO 16 HG1 PRO 16 24.918 22.922 27.590 104 HG3 PRO 16 HG2 PRO 16 23.929 22.090 28.831 105 HD2 PRO 16 HD1 PRO 16 26.643 21.820 28.710 106 HD3 PRO 16 HD2 PRO 16 25.660 20.426 29.111 107 H ILE 17 H ILE 17 24.625 19.533 23.944 108 HA ILE 17 HA ILE 17 25.723 21.859 22.459 109 HB ILE 17 HB ILE 17 27.254 19.979 22.306 110 HG12 ILE 17 2HG1 ILE 17 25.812 20.219 19.688 111 HG13 ILE 17 1HG1 ILE 17 26.700 21.544 20.407 112 HG21 ILE 17 1HG2 ILE 17 26.692 17.897 21.268 113 HG22 ILE 17 2HG2 ILE 17 25.610 18.088 22.661 114 HG23 ILE 17 3HG2 ILE 17 25.032 18.355 20.986 115 HD11 ILE 17 HD1 ILE 17 28.017 20.394 18.719 116 HD12 ILE 17 HD2 ILE 17 28.759 20.191 20.296 117 HD13 ILE 17 HD3 ILE 17 27.827 18.833 19.557 118 H SER 18 H SER 18 23.198 19.390 22.611 119 HA SER 18 HA SER 18 21.616 20.864 20.593 120 HB2 SER 18 HB2 SER 18 22.113 17.873 20.535 121 HB3 SER 18 HB1 SER 18 21.066 18.804 19.449 122 HG SER 18 HG SER 18 23.062 18.412 18.466 123 H PHE 19 H PHE 19 19.313 20.187 20.582 124 HA PHE 19 HA PHE 19 18.393 19.633 23.326 125 HB2 PHE 19 HB2 PHE 19 17.885 21.985 21.492 126 HB3 PHE 19 HB1 PHE 19 17.198 21.754 23.124 127 HD1 PHE 19 HD1 PHE 19 20.209 22.733 21.229 128 HD2 PHE 19 HD2 PHE 19 18.504 22.030 25.125 129 HE1 PHE 19 HE1 PHE 19 22.256 23.647 22.268 130 HE2 PHE 19 HE2 PHE 19 20.552 23.003 26.152 131 HZ PHE 19 HZ PHE 19 22.397 23.815 24.732 132 H TYR 20 H TYR 20 15.869 19.941 23.271 133 HA TYR 20 HA TYR 20 14.666 18.911 20.742 134 HB2 TYR 20 HB2 TYR 20 13.485 18.806 23.537 135 HB3 TYR 20 HB1 TYR 20 12.838 18.078 22.046 136 HD1 TYR 20 HD1 TYR 20 14.859 17.664 24.945 137 HD2 TYR 20 HD2 TYR 20 14.097 16.037 21.040 138 HE1 TYR 20 HE1 TYR 20 15.767 15.505 25.696 139 HE2 TYR 20 HE2 TYR 20 15.153 13.897 21.752 140 HH TYR 20 HH TYR 20 16.608 13.517 24.998 141 H CYS 21 H CYS 21 13.555 20.271 19.666 142 HA CYS 21 HA CYS 21 12.574 22.865 20.470 143 HB2 CYS 21 HB2 CYS 21 13.115 22.400 18.272 144 HB3 CYS 21 HB1 CYS 21 11.963 21.025 18.212 145 H GLY 22 H GLY 22 32.048 23.790 17.067 146 HA2 GLY 22 HA2 GLY 22 30.492 21.905 15.500 147 HA3 GLY 22 HA1 GLY 22 32.251 21.665 15.247 148 H GLY 23 H GLY 23 32.146 22.501 18.463 149 HA2 GLY 23 HA2 GLY 23 32.019 19.659 19.188 150 HA3 GLY 23 HA1 GLY 23 33.269 20.755 19.758 151 H ALA 24 H ALA 24 32.083 19.464 21.594 152 HA ALA 24 HA ALA 24 29.798 20.860 22.839 153 HB1 ALA 24 HB1 ALA 24 30.120 19.227 24.628 154 HB2 ALA 24 HB2 ALA 24 30.094 18.510 23.031 155 HB3 ALA 24 HB3 ALA 24 31.653 18.672 23.871 156 H GLY 25 H GLY 25 30.928 22.843 22.536 157 HA2 GLY 25 HA2 GLY 25 33.376 23.439 24.070 158 HA3 GLY 25 HA1 GLY 25 32.587 24.440 22.806 159 H HIS 26 H HIS 26 32.174 26.330 23.721 160 HA HIS 26 HA HIS 26 30.061 26.556 25.652 161 HB2 HIS 26 HB2 HIS 26 31.330 28.079 27.167 162 HB3 HIS 26 HB1 HIS 26 31.654 26.354 27.342 163 HD2 HIS 26 HD2 HIS 26 33.393 29.642 26.642 164 HE1 HIS 26 HE1 HIS 26 36.409 26.615 26.682 165 HE2 HIS 26 HE2 HIS 26 35.963 29.135 26.708 166 H VAL 27 H VAL 27 32.406 28.201 23.576 167 HA VAL 27 HA VAL 27 30.491 30.387 23.219 168 HB VAL 27 HB VAL 27 32.071 31.648 22.261 169 HG11 VAL 27 1HG1 VAL 27 33.719 31.997 23.865 170 HG12 VAL 27 2HG1 VAL 27 32.286 31.439 24.722 171 HG13 VAL 27 3HG1 VAL 27 33.663 30.322 24.458 172 HG21 VAL 27 1HG2 VAL 27 34.426 31.022 21.803 173 HG22 VAL 27 2HG2 VAL 27 33.979 29.335 22.124 174 HG23 VAL 27 3HG2 VAL 27 33.269 30.167 20.742 175 HA PRO 28 HA PRO 28 28.858 28.267 19.961 176 HB2 PRO 28 HB1 PRO 28 27.453 30.177 18.487 177 HB3 PRO 28 HB2 PRO 28 27.095 29.677 20.168 178 HG2 PRO 28 HG1 PRO 28 28.737 32.020 19.260 179 HG3 PRO 28 HG2 PRO 28 27.323 31.995 20.382 180 HD2 PRO 28 HD1 PRO 28 29.897 31.937 21.263 181 HD3 PRO 28 HD2 PRO 28 28.626 30.969 22.078 182 H GLU 29 H GLU 29 29.017 27.529 18.065 183 HA GLU 29 HA GLU 29 31.020 28.393 15.991 184 HB2 GLU 29 HB2 GLU 29 31.301 26.230 17.540 185 HB3 GLU 29 HB1 GLU 29 29.993 25.591 16.583 186 HG2 GLU 29 HG2 GLU 29 31.834 26.390 14.619 187 HG3 GLU 29 HG1 GLU 29 32.848 25.891 15.999 188 H TYR 30 H TYR 30 27.769 27.232 16.508 189 HA TYR 30 HA TYR 30 27.039 28.101 13.845 190 HB2 TYR 30 HB2 TYR 30 26.429 25.312 14.855 191 HB3 TYR 30 HB1 TYR 30 25.448 26.146 13.661 192 HD1 TYR 30 HD1 TYR 30 26.755 27.231 11.671 193 HD2 TYR 30 HD2 TYR 30 28.049 23.829 13.925 194 HE1 TYR 30 HE1 TYR 30 28.238 26.547 9.782 195 HE2 TYR 30 HE2 TYR 30 29.615 23.204 12.121 196 HH TYR 30 HH TYR 30 30.488 23.737 10.217 197 H PHE 31 H PHE 31 26.173 29.850 14.862 198 HA PHE 31 HA PHE 31 24.136 29.738 16.904 199 HB2 PHE 31 HB2 PHE 31 25.669 31.626 16.151 200 HB3 PHE 31 HB1 PHE 31 24.447 31.959 14.935 201 HD1 PHE 31 HD1 PHE 31 22.015 32.455 15.659 202 HD2 PHE 31 HD2 PHE 31 25.304 32.318 18.426 203 HE1 PHE 31 HE1 PHE 31 20.630 33.511 17.365 204 HE2 PHE 31 HE2 PHE 31 23.854 33.346 20.171 205 HZ PHE 31 HZ PHE 31 21.594 34.060 19.635 206 H VAL 32 H VAL 32 24.115 29.684 13.357 207 HA VAL 32 HA VAL 32 21.463 28.430 13.368 208 HB VAL 32 HB VAL 32 22.225 30.616 11.359 209 HG11 VAL 32 1HG1 VAL 32 19.839 30.485 10.749 210 HG12 VAL 32 2HG1 VAL 32 20.729 28.978 10.428 211 HG13 VAL 32 3HG1 VAL 32 19.646 29.069 11.828 212 HG21 VAL 32 1HG2 VAL 32 20.429 31.992 12.430 213 HG22 VAL 32 2HG2 VAL 32 20.385 30.803 13.726 214 HG23 VAL 32 3HG2 VAL 32 21.862 31.707 13.493 215 H ARG 33 H ARG 33 21.246 26.837 11.887 216 HA ARG 33 HA ARG 33 23.096 26.649 9.635 217 HB2 ARG 33 HB2 ARG 33 23.649 24.363 9.954 218 HB3 ARG 33 HB1 ARG 33 24.338 25.414 11.160 219 HG2 ARG 33 HG2 ARG 33 23.712 23.392 12.242 220 HG3 ARG 33 HG1 ARG 33 22.708 24.693 12.795 221 HD2 ARG 33 HD2 ARG 33 21.525 22.484 12.490 222 HD3 ARG 33 HD1 ARG 33 20.822 23.895 11.663 223 HE ARG 33 HE ARG 33 22.157 22.997 9.633 224 HH11 ARG 33 1HH1 ARG 33 20.762 20.585 11.912 225 HH12 ARG 33 2HH1 ARG 33 20.225 19.629 10.559 226 HH21 ARG 33 1HH2 ARG 33 21.764 21.551 8.110 227 HH22 ARG 33 2HH2 ARG 33 20.864 20.062 8.486 228 H1 CYS 34 H1 CYS 34 12.503 28.788 18.958 229 H2 CYS 34 H2 CYS 34 11.668 28.157 17.712 230 H3 CYS 34 H3 CYS 34 11.444 27.584 19.255 231 HA CYS 34 HA CYS 34 13.630 26.762 19.359 232 HB2 CYS 34 HB2 CYS 34 12.281 25.716 16.845 233 HB3 CYS 34 HB1 CYS 34 13.467 24.878 17.806 234 H GLY 35 H GLY 35 15.175 28.179 19.103 235 HA2 GLY 35 HA2 GLY 35 16.879 28.181 16.815 236 HA3 GLY 35 HA1 GLY 35 16.061 29.752 16.943 237 H THR 36 H THR 36 18.417 27.566 18.433 238 HA THR 36 HA THR 36 19.659 29.929 19.542 239 HB THR 36 HB THR 36 20.213 27.458 21.063 240 HG1 THR 36 HG1 THR 36 18.540 27.368 22.177 241 HG21 THR 36 1HG2 THR 36 20.118 28.898 23.019 242 HG22 THR 36 2HG2 THR 36 21.317 29.398 21.851 243 HG23 THR 36 3HG2 THR 36 19.797 30.309 21.953 244 HA PRO 37 HA PRO 37 23.148 27.828 17.556 245 HB2 PRO 37 HB1 PRO 37 24.860 27.592 19.922 246 HB3 PRO 37 HB2 PRO 37 25.008 28.678 18.513 247 HG2 PRO 37 HG1 PRO 37 23.650 29.122 21.125 248 HG3 PRO 37 HG2 PRO 37 24.446 30.351 20.083 249 HD2 PRO 37 HD1 PRO 37 21.815 30.339 20.129 250 HD3 PRO 37 HD2 PRO 37 22.600 30.383 18.546 251 H ILE 38 H ILE 38 24.056 25.901 17.290 252 HA ILE 38 HA ILE 38 23.077 23.625 18.898 253 HB ILE 38 HB ILE 38 21.971 24.247 16.690 254 HG12 ILE 38 2HG1 ILE 38 21.768 21.943 15.901 255 HG13 ILE 38 1HG1 ILE 38 23.025 21.408 17.061 256 HG21 ILE 38 1HG2 ILE 38 22.931 23.615 14.652 257 HG22 ILE 38 2HG2 ILE 38 24.078 24.679 15.483 258 HG23 ILE 38 3HG2 ILE 38 24.381 22.929 15.422 259 HD11 ILE 38 HD1 ILE 38 20.759 20.972 17.849 260 HD12 ILE 38 HD2 ILE 38 21.596 22.156 18.908 261 HD13 ILE 38 HD3 ILE 38 20.369 22.702 17.723 262 H SER 39 H SER 39 25.817 25.086 18.248 263 HA SER 39 HA SER 39 27.494 22.847 18.848 264 HB2 SER 39 HB2 SER 39 28.100 24.177 16.200 265 HB3 SER 39 HB1 SER 39 28.999 22.886 16.943 266 HG SER 39 HG SER 39 26.533 22.002 16.757 267 H PHE 40 H PHE 40 29.740 23.480 19.336 268 HA PHE 40 HA PHE 40 30.168 26.349 19.650 269 HB2 PHE 40 HB2 PHE 40 30.203 24.350 21.911 270 HB3 PHE 40 HB1 PHE 40 30.590 26.071 22.091 271 HD1 PHE 40 HD1 PHE 40 28.782 27.727 22.279 272 HD2 PHE 40 HD2 PHE 40 27.975 23.535 21.642 273 HE1 PHE 40 HE1 PHE 40 26.382 28.090 22.754 274 HE2 PHE 40 HE2 PHE 40 25.485 24.028 21.892 275 HZ PHE 40 HZ PHE 40 24.764 26.256 22.467 276 H TYR 41 H TYR 41 32.561 26.466 21.010 277 HA TYR 41 HA TYR 41 34.145 25.579 18.830 278 HB2 TYR 41 HB2 TYR 41 34.833 27.126 21.256 279 HB3 TYR 41 HB1 TYR 41 36.065 26.588 20.113 280 HD1 TYR 41 HD1 TYR 41 33.078 27.333 18.202 281 HD2 TYR 41 HD2 TYR 41 36.456 29.154 20.240 282 HE1 TYR 41 HE1 TYR 41 32.820 29.341 16.900 283 HE2 TYR 41 HE2 TYR 41 36.214 31.120 18.927 284 HH TYR 41 HH TYR 41 33.463 31.399 16.560 285 H CYS 42 H CYS 42 34.861 24.808 22.184 286 HA CYS 42 HA CYS 42 37.189 23.736 21.964 287 HB2 CYS 42 HB2 CYS 42 35.240 22.205 23.661 288 HB3 CYS 42 HB1 CYS 42 36.987 22.345 23.832 Start of MODEL 16 1 H GLY 1 H GLY 1 17.482 16.541 20.403 2 HA2 GLY 1 HA2 GLY 1 19.890 15.317 19.245 3 HA3 GLY 1 HA1 GLY 1 18.382 14.883 18.526 4 H GLY 2 H GLY 2 17.209 17.543 18.939 5 HA2 GLY 2 HA2 GLY 2 18.250 18.819 16.455 6 HA3 GLY 2 HA1 GLY 2 16.640 19.018 17.187 7 H ALA 3 H ALA 3 16.536 21.154 17.342 8 HA ALA 3 HA ALA 3 18.521 22.560 19.024 9 HB1 ALA 3 HB1 ALA 3 18.696 24.329 17.431 10 HB2 ALA 3 HB2 ALA 3 19.148 22.816 16.659 11 HB3 ALA 3 HB3 ALA 3 17.551 23.532 16.306 12 H GLY 4 H GLY 4 17.392 23.524 20.707 13 HA2 GLY 4 HA2 GLY 4 14.891 24.877 20.455 14 HA3 GLY 4 HA1 GLY 4 14.694 23.156 20.879 15 H HIS 5 H HIS 5 13.631 24.434 22.621 16 HA HIS 5 HA HIS 5 15.283 26.092 24.308 17 HB2 HIS 5 HB2 HIS 5 13.419 26.747 25.469 18 HB3 HIS 5 HB1 HIS 5 12.827 26.406 23.838 19 HD2 HIS 5 HD2 HIS 5 12.072 23.397 23.924 20 HE1 HIS 5 HE1 HIS 5 9.729 24.438 27.339 21 HE2 HIS 5 HE2 HIS 5 10.028 22.744 25.507 22 H VAL 6 H VAL 6 14.931 22.799 24.554 23 HA VAL 6 HA VAL 6 16.250 22.879 27.189 24 HB VAL 6 HB VAL 6 14.946 20.830 27.917 25 HG11 VAL 6 1HG1 VAL 6 13.042 22.151 28.794 26 HG12 VAL 6 2HG1 VAL 6 14.583 22.944 28.961 27 HG13 VAL 6 3HG1 VAL 6 13.443 23.433 27.653 28 HG21 VAL 6 1HG2 VAL 6 12.732 20.577 27.147 29 HG22 VAL 6 2HG2 VAL 6 12.863 21.745 25.908 30 HG23 VAL 6 3HG2 VAL 6 13.802 20.204 25.739 31 HA PRO 7 HA PRO 7 19.005 20.347 25.136 32 HB2 PRO 7 HB1 PRO 7 20.468 19.199 27.222 33 HB3 PRO 7 HB2 PRO 7 20.515 20.925 26.796 34 HG2 PRO 7 HG1 PRO 7 18.969 19.539 28.954 35 HG3 PRO 7 HG2 PRO 7 19.872 21.088 29.005 36 HD2 PRO 7 HD1 PRO 7 17.133 20.850 28.715 37 HD3 PRO 7 HD2 PRO 7 18.083 22.203 28.063 38 H GLU 8 H GLU 8 19.803 18.377 24.531 39 HA GLU 8 HA GLU 8 18.347 15.910 25.274 40 HB2 GLU 8 HB2 GLU 8 17.121 17.108 23.574 41 HB3 GLU 8 HB1 GLU 8 18.466 17.189 22.509 42 HG2 GLU 8 HG2 GLU 8 17.518 14.462 23.341 43 HG3 GLU 8 HG1 GLU 8 16.432 15.443 22.402 44 H TYR 9 H TYR 9 21.418 17.328 24.119 45 HA TYR 9 HA TYR 9 22.666 14.704 24.465 46 HB2 TYR 9 HB2 TYR 9 23.164 16.480 22.059 47 HB3 TYR 9 HB1 TYR 9 24.298 15.335 22.652 48 HD1 TYR 9 HD1 TYR 9 22.593 15.678 19.945 49 HD2 TYR 9 HD2 TYR 9 22.896 12.936 23.207 50 HE1 TYR 9 HE1 TYR 9 21.846 13.864 18.442 51 HE2 TYR 9 HE2 TYR 9 22.097 11.076 21.692 52 HH TYR 9 HH TYR 9 22.075 10.605 19.302 53 H PHE 10 H PHE 10 24.387 14.790 25.576 54 HA PHE 10 HA PHE 10 25.467 17.379 26.485 55 HB2 PHE 10 HB2 PHE 10 23.906 16.031 27.931 56 HB3 PHE 10 HB1 PHE 10 25.102 14.738 27.899 57 HD1 PHE 10 HD1 PHE 10 25.487 14.559 30.193 58 HD2 PHE 10 HD2 PHE 10 25.783 18.413 28.335 59 HE1 PHE 10 HE1 PHE 10 26.301 15.511 32.310 60 HE2 PHE 10 HE2 PHE 10 26.489 19.404 30.461 61 HZ PHE 10 HZ PHE 10 26.768 17.968 32.490 62 H VAL 11 H VAL 11 27.599 16.699 27.980 63 HA VAL 11 HA VAL 11 29.702 15.958 26.278 64 HB VAL 11 HB VAL 11 29.800 17.091 28.564 65 HG11 VAL 11 1HG1 VAL 11 30.121 15.822 30.595 66 HG12 VAL 11 2HG1 VAL 11 28.532 15.515 29.977 67 HG13 VAL 11 3HG1 VAL 11 29.770 14.305 29.733 68 HG21 VAL 11 1HG2 VAL 11 31.980 16.266 29.142 69 HG22 VAL 11 2HG2 VAL 11 31.771 14.790 28.194 70 HG23 VAL 11 3HG2 VAL 11 31.792 16.377 27.376 71 H ARG 12 H ARG 12 30.831 14.054 25.959 72 HA ARG 12 HA ARG 12 29.345 11.694 25.966 73 HB2 ARG 12 HB2 ARG 12 31.084 10.632 24.965 74 HB3 ARG 12 HB1 ARG 12 31.179 12.277 24.479 75 HG2 ARG 12 HG2 ARG 12 33.355 11.595 24.706 76 HG3 ARG 12 HG1 ARG 12 33.102 12.593 26.118 77 HD2 ARG 12 HD2 ARG 12 34.506 10.612 26.526 78 HD3 ARG 12 HD1 ARG 12 33.030 10.573 27.534 79 HE ARG 12 HE ARG 12 32.567 9.089 25.152 80 HH11 ARG 12 1HH1 ARG 12 34.870 8.798 27.842 81 HH12 ARG 12 2HH1 ARG 12 34.980 7.065 27.561 82 HH21 ARG 12 1HH2 ARG 12 32.532 6.991 25.073 83 HH22 ARG 12 2HH2 ARG 12 33.583 6.006 26.115 84 H1 CYS 13 H1 CYS 13 32.820 23.742 28.650 85 H2 CYS 13 H2 CYS 13 34.209 23.120 29.265 86 H3 CYS 13 H3 CYS 13 34.237 24.159 27.960 87 HA CYS 13 HA CYS 13 33.180 22.607 26.572 88 HB2 CYS 13 HB2 CYS 13 35.463 21.270 28.034 89 HB3 CYS 13 HB1 CYS 13 34.948 20.868 26.398 90 H GLY 14 H GLY 14 31.682 21.023 26.398 91 HA2 GLY 14 HA2 GLY 14 30.688 18.981 27.035 92 HA3 GLY 14 HA1 GLY 14 31.122 19.298 28.693 93 H THR 15 H THR 15 29.799 22.125 27.759 94 HA THR 15 HA THR 15 27.242 21.944 28.909 95 HB THR 15 HB THR 15 28.298 23.701 26.683 96 HG1 THR 15 HG1 THR 15 28.201 23.911 29.494 97 HG21 THR 15 1HG2 THR 15 26.681 25.391 27.390 98 HG22 THR 15 2HG2 THR 15 25.882 23.947 26.739 99 HG23 THR 15 3HG2 THR 15 25.924 24.247 28.514 100 HA PRO 16 HA PRO 16 24.971 19.445 26.064 101 HB2 PRO 16 HB1 PRO 16 22.701 21.373 26.360 102 HB3 PRO 16 HB2 PRO 16 22.716 19.577 26.427 103 HG2 PRO 16 HG1 PRO 16 22.681 20.966 28.753 104 HG3 PRO 16 HG2 PRO 16 23.706 19.503 28.561 105 HD2 PRO 16 HD1 PRO 16 24.551 22.432 28.385 106 HD3 PRO 16 HD2 PRO 16 25.330 21.041 29.178 107 H ILE 17 H ILE 17 24.888 19.209 24.066 108 HA ILE 17 HA ILE 17 25.522 21.497 22.306 109 HB ILE 17 HB ILE 17 26.057 18.722 21.511 110 HG12 ILE 17 2HG1 ILE 17 27.804 20.024 23.585 111 HG13 ILE 17 1HG1 ILE 17 26.766 18.609 23.781 112 HG21 ILE 17 1HG2 ILE 17 27.999 19.742 20.425 113 HG22 ILE 17 2HG2 ILE 17 26.613 20.712 20.055 114 HG23 ILE 17 3HG2 ILE 17 27.747 21.262 21.287 115 HD11 ILE 17 HD1 ILE 17 28.919 17.781 23.580 116 HD12 ILE 17 HD2 ILE 17 28.089 17.433 22.080 117 HD13 ILE 17 HD3 ILE 17 29.304 18.749 22.157 118 H SER 18 H SER 18 22.975 19.357 22.821 119 HA SER 18 HA SER 18 21.606 20.399 20.496 120 HB2 SER 18 HB2 SER 18 21.589 17.400 20.849 121 HB3 SER 18 HB1 SER 18 20.747 18.358 19.609 122 HG SER 18 HG SER 18 23.282 19.049 19.563 123 H PHE 19 H PHE 19 19.335 19.698 20.510 124 HA PHE 19 HA PHE 19 18.161 19.727 23.234 125 HB2 PHE 19 HB2 PHE 19 17.719 21.627 20.917 126 HB3 PHE 19 HB1 PHE 19 17.033 21.787 22.517 127 HD1 PHE 19 HD1 PHE 19 18.494 22.563 24.404 128 HD2 PHE 19 HD2 PHE 19 20.119 22.112 20.488 129 HE1 PHE 19 HE1 PHE 19 20.652 23.593 25.138 130 HE2 PHE 19 HE2 PHE 19 22.197 23.244 21.206 131 HZ PHE 19 HZ PHE 19 22.464 24.008 23.542 132 H TYR 20 H TYR 20 15.700 20.057 23.062 133 HA TYR 20 HA TYR 20 14.541 18.267 20.997 134 HB2 TYR 20 HB2 TYR 20 13.467 19.611 23.499 135 HB3 TYR 20 HB1 TYR 20 12.444 18.682 22.416 136 HD1 TYR 20 HD1 TYR 20 13.016 16.240 21.947 137 HD2 TYR 20 HD2 TYR 20 14.837 18.461 25.166 138 HE1 TYR 20 HE1 TYR 20 13.688 14.157 22.985 139 HE2 TYR 20 HE2 TYR 20 15.520 16.348 26.225 140 HH TYR 20 HH TYR 20 15.391 13.950 26.116 141 H CYS 21 H CYS 21 12.072 20.230 21.276 142 HA CYS 21 HA CYS 21 13.169 22.428 19.627 143 HB2 CYS 21 HB2 CYS 21 11.636 20.708 18.468 144 HB3 CYS 21 HB1 CYS 21 10.326 21.545 19.357 145 H GLY 22 H GLY 22 32.303 24.592 16.754 146 HA2 GLY 22 HA2 GLY 22 30.941 22.481 15.229 147 HA3 GLY 22 HA1 GLY 22 32.630 22.810 14.749 148 H GLY 23 H GLY 23 32.392 23.156 18.205 149 HA2 GLY 23 HA2 GLY 23 33.088 20.334 18.615 150 HA3 GLY 23 HA1 GLY 23 34.108 21.733 19.073 151 H ALA 24 H ALA 24 33.690 20.089 20.970 152 HA ALA 24 HA ALA 24 31.181 20.482 22.457 153 HB1 ALA 24 HB1 ALA 24 32.068 18.787 23.882 154 HB2 ALA 24 HB2 ALA 24 32.211 18.234 22.171 155 HB3 ALA 24 HB3 ALA 24 33.636 18.801 23.014 156 H GLY 25 H GLY 25 32.074 22.832 22.353 157 HA2 GLY 25 HA2 GLY 25 33.764 23.609 24.651 158 HA3 GLY 25 HA1 GLY 25 33.427 24.498 23.176 159 H HIS 26 H HIS 26 33.175 26.178 24.650 160 HA HIS 26 HA HIS 26 30.651 26.543 26.185 161 HB2 HIS 26 HB2 HIS 26 32.141 27.769 27.795 162 HB3 HIS 26 HB1 HIS 26 32.258 26.057 27.801 163 HD2 HIS 26 HD2 HIS 26 34.443 29.103 27.454 164 HE1 HIS 26 HE1 HIS 26 36.956 25.792 26.587 165 HE2 HIS 26 HE2 HIS 26 36.944 28.188 26.956 166 H VAL 27 H VAL 27 32.092 27.692 23.529 167 HA VAL 27 HA VAL 27 30.498 30.133 23.806 168 HB VAL 27 HB VAL 27 31.923 31.537 22.678 169 HG11 VAL 27 1HG1 VAL 27 33.817 31.793 24.154 170 HG12 VAL 27 2HG1 VAL 27 32.426 31.292 25.123 171 HG13 VAL 27 3HG1 VAL 27 33.685 30.125 24.702 172 HG21 VAL 27 1HG2 VAL 27 33.936 29.300 22.238 173 HG22 VAL 27 2HG2 VAL 27 32.985 30.213 21.023 174 HG23 VAL 27 3HG2 VAL 27 34.241 31.014 21.989 175 HA PRO 28 HA PRO 28 28.599 27.909 20.828 176 HB2 PRO 28 HB1 PRO 28 26.719 29.648 19.719 177 HB3 PRO 28 HB2 PRO 28 26.716 28.954 21.372 178 HG2 PRO 28 HG1 PRO 28 27.752 31.642 20.418 179 HG3 PRO 28 HG2 PRO 28 26.655 31.314 21.813 180 HD2 PRO 28 HD1 PRO 28 29.306 31.652 22.226 181 HD3 PRO 28 HD2 PRO 28 28.401 30.430 23.145 182 H GLU 29 H GLU 29 28.118 27.311 18.646 183 HA GLU 29 HA GLU 29 29.487 28.732 16.487 184 HB2 GLU 29 HB2 GLU 29 31.078 27.295 17.638 185 HB3 GLU 29 HB1 GLU 29 30.048 25.899 17.417 186 HG2 GLU 29 HG2 GLU 29 30.696 27.184 14.850 187 HG3 GLU 29 HG1 GLU 29 32.141 26.926 15.819 188 H TYR 30 H TYR 30 28.366 28.625 14.724 189 HA TYR 30 HA TYR 30 26.779 28.338 13.212 190 HB2 TYR 30 HB2 TYR 30 27.202 25.493 13.968 191 HB3 TYR 30 HB1 TYR 30 25.903 26.023 12.881 192 HD1 TYR 30 HD1 TYR 30 26.581 24.825 11.033 193 HD2 TYR 30 HD2 TYR 30 29.312 27.605 12.918 194 HE1 TYR 30 HE1 TYR 30 28.197 24.662 9.093 195 HE2 TYR 30 HE2 TYR 30 30.822 27.448 10.943 196 HH TYR 30 HH TYR 30 31.006 26.663 8.829 197 H PHE 31 H PHE 31 25.561 29.764 14.378 198 HA PHE 31 HA PHE 31 23.383 28.828 16.042 199 HB2 PHE 31 HB2 PHE 31 24.597 31.130 15.943 200 HB3 PHE 31 HB1 PHE 31 23.552 31.455 14.542 201 HD1 PHE 31 HD1 PHE 31 24.009 31.704 18.084 202 HD2 PHE 31 HD2 PHE 31 20.985 31.042 15.169 203 HE1 PHE 31 HE1 PHE 31 22.319 32.438 19.704 204 HE2 PHE 31 HE2 PHE 31 19.220 31.678 16.841 205 HZ PHE 31 HZ PHE 31 19.940 32.334 19.207 206 H VAL 32 H VAL 32 23.737 29.678 12.633 207 HA VAL 32 HA VAL 32 21.133 28.355 12.112 208 HB VAL 32 HB VAL 32 22.248 30.795 10.700 209 HG11 VAL 32 1HG1 VAL 32 20.164 30.680 9.300 210 HG12 VAL 32 2HG1 VAL 32 21.134 29.268 8.990 211 HG13 VAL 32 3HG1 VAL 32 19.724 29.184 10.083 212 HG21 VAL 32 1HG2 VAL 32 20.191 31.841 11.363 213 HG22 VAL 32 2HG2 VAL 32 19.853 30.403 12.394 214 HG23 VAL 32 3HG2 VAL 32 21.274 31.480 12.706 215 H ARG 33 H ARG 33 21.308 26.710 10.777 216 HA ARG 33 HA ARG 33 23.353 26.686 8.656 217 HB2 ARG 33 HB2 ARG 33 23.669 24.318 8.862 218 HB3 ARG 33 HB1 ARG 33 24.326 25.217 10.175 219 HG2 ARG 33 HG2 ARG 33 23.254 23.072 10.860 220 HG3 ARG 33 HG1 ARG 33 22.684 24.549 11.685 221 HD2 ARG 33 HD2 ARG 33 20.858 22.975 11.290 222 HD3 ARG 33 HD1 ARG 33 20.595 24.471 10.403 223 HE ARG 33 HE ARG 33 21.194 23.282 8.320 224 HH11 ARG 33 1HH1 ARG 33 20.938 20.955 10.955 225 HH12 ARG 33 2HH1 ARG 33 20.503 19.699 9.796 226 HH21 ARG 33 1HH2 ARG 33 20.547 21.743 7.018 227 HH22 ARG 33 2HH2 ARG 33 20.479 20.103 7.657 228 H1 CYS 34 H1 CYS 34 11.745 28.429 19.688 229 H2 CYS 34 H2 CYS 34 11.069 27.566 18.491 230 H3 CYS 34 H3 CYS 34 11.031 27.027 20.061 231 HA CYS 34 HA CYS 34 13.215 26.633 20.117 232 HB2 CYS 34 HB2 CYS 34 12.942 25.538 17.355 233 HB3 CYS 34 HB1 CYS 34 13.372 24.731 18.839 234 H GLY 35 H GLY 35 14.935 28.015 19.889 235 HA2 GLY 35 HA2 GLY 35 16.038 28.889 17.349 236 HA3 GLY 35 HA1 GLY 35 15.431 30.161 18.408 237 H THR 36 H THR 36 17.572 27.364 18.273 238 HA THR 36 HA THR 36 19.289 28.565 20.378 239 HB THR 36 HB THR 36 18.661 25.642 20.109 240 HG1 THR 36 HG1 THR 36 17.454 26.083 22.047 241 HG21 THR 36 1HG2 THR 36 19.418 25.573 22.505 242 HG22 THR 36 2HG2 THR 36 20.733 26.090 21.465 243 HG23 THR 36 3HG2 THR 36 19.832 27.285 22.394 244 HA PRO 37 HA PRO 37 22.532 27.392 17.458 245 HB2 PRO 37 HB1 PRO 37 24.799 27.754 18.983 246 HB3 PRO 37 HB2 PRO 37 23.849 29.097 18.258 247 HG2 PRO 37 HG1 PRO 37 23.740 27.954 21.050 248 HG3 PRO 37 HG2 PRO 37 23.871 29.666 20.556 249 HD2 PRO 37 HD1 PRO 37 21.446 28.345 21.217 250 HD3 PRO 37 HD2 PRO 37 21.503 29.653 20.011 251 H ILE 38 H ILE 38 24.344 25.698 17.396 252 HA ILE 38 HA ILE 38 23.385 23.336 18.952 253 HB ILE 38 HB ILE 38 24.488 23.478 16.179 254 HG12 ILE 38 2HG1 ILE 38 22.241 22.296 15.773 255 HG13 ILE 38 1HG1 ILE 38 21.768 22.926 17.373 256 HG21 ILE 38 1HG2 ILE 38 24.132 21.089 16.023 257 HG22 ILE 38 2HG2 ILE 38 25.231 21.395 17.354 258 HG23 ILE 38 3HG2 ILE 38 23.541 21.027 17.678 259 HD11 ILE 38 HD1 ILE 38 22.508 24.677 15.005 260 HD12 ILE 38 HD2 ILE 38 20.858 24.252 15.515 261 HD13 ILE 38 HD3 ILE 38 21.900 25.193 16.592 262 H SER 39 H SER 39 26.373 23.857 17.099 263 HA SER 39 HA SER 39 27.926 22.520 19.096 264 HB2 SER 39 HB2 SER 39 28.697 24.138 16.608 265 HB3 SER 39 HB1 SER 39 29.795 23.101 17.531 266 HG SER 39 HG SER 39 28.554 21.318 16.978 267 H PHE 40 H PHE 40 30.086 23.452 19.753 268 HA PHE 40 HA PHE 40 30.179 26.362 20.154 269 HB2 PHE 40 HB2 PHE 40 31.165 24.272 22.087 270 HB3 PHE 40 HB1 PHE 40 31.031 26.016 22.372 271 HD1 PHE 40 HD1 PHE 40 29.382 22.797 22.524 272 HD2 PHE 40 HD2 PHE 40 28.809 27.039 22.738 273 HE1 PHE 40 HE1 PHE 40 27.091 22.436 23.500 274 HE2 PHE 40 HE2 PHE 40 26.437 26.658 23.453 275 HZ PHE 40 HZ PHE 40 25.647 24.398 23.931 276 H TYR 41 H TYR 41 32.814 26.014 21.429 277 HA TYR 41 HA TYR 41 34.402 24.698 19.272 278 HB2 TYR 41 HB2 TYR 41 34.941 27.259 20.824 279 HB3 TYR 41 HB1 TYR 41 36.161 26.436 19.861 280 HD1 TYR 41 HD1 TYR 41 36.247 26.609 17.449 281 HD2 TYR 41 HD2 TYR 41 33.051 28.465 19.711 282 HE1 TYR 41 HE1 TYR 41 35.683 27.995 15.545 283 HE2 TYR 41 HE2 TYR 41 32.510 29.912 17.860 284 HH TYR 41 HH TYR 41 33.906 30.816 15.994 285 H CYS 42 H CYS 42 35.773 25.888 22.188 286 HA CYS 42 HA CYS 42 36.085 24.785 24.179 287 HB2 CYS 42 HB2 CYS 42 35.298 22.549 23.549 288 HB3 CYS 42 HB1 CYS 42 36.680 22.274 22.583 Start of MODEL 17 1 H GLY 1 H GLY 1 17.485 17.249 19.883 2 HA2 GLY 1 HA2 GLY 1 18.109 16.648 17.206 3 HA3 GLY 1 HA1 GLY 1 16.729 15.748 17.610 4 H GLY 2 H GLY 2 17.796 18.749 16.649 5 HA2 GLY 2 HA2 GLY 2 16.137 20.348 15.774 6 HA3 GLY 2 HA1 GLY 2 15.216 20.143 17.278 7 H ALA 3 H ALA 3 15.279 22.332 17.831 8 HA ALA 3 HA ALA 3 17.719 23.274 19.144 9 HB1 ALA 3 HB1 ALA 3 17.777 25.369 17.998 10 HB2 ALA 3 HB2 ALA 3 17.922 24.075 16.813 11 HB3 ALA 3 HB3 ALA 3 16.387 24.866 16.924 12 H GLY 4 H GLY 4 17.171 24.348 21.005 13 HA2 GLY 4 HA2 GLY 4 14.913 25.939 21.481 14 HA3 GLY 4 HA1 GLY 4 14.450 24.295 21.893 15 H HIS 5 H HIS 5 14.462 24.143 24.026 16 HA HIS 5 HA HIS 5 16.453 25.584 25.748 17 HB2 HIS 5 HB2 HIS 5 14.437 26.218 27.064 18 HB3 HIS 5 HB1 HIS 5 14.600 26.913 25.427 19 HD2 HIS 5 HD2 HIS 5 12.878 23.522 26.472 20 HE1 HIS 5 HE1 HIS 5 10.069 25.900 24.333 21 HE2 HIS 5 HE2 HIS 5 10.462 23.656 25.417 22 H VAL 6 H VAL 6 15.784 22.651 25.034 23 HA VAL 6 HA VAL 6 16.826 21.835 27.669 24 HB VAL 6 HB VAL 6 15.742 19.581 27.404 25 HG11 VAL 6 1HG1 VAL 6 13.793 20.181 28.816 26 HG12 VAL 6 2HG1 VAL 6 15.235 21.095 29.249 27 HG13 VAL 6 3HG1 VAL 6 13.958 21.865 28.288 28 HG21 VAL 6 1HG2 VAL 6 13.646 19.357 26.313 29 HG22 VAL 6 2HG2 VAL 6 13.482 21.082 26.020 30 HG23 VAL 6 3HG2 VAL 6 14.655 20.210 25.100 31 HA PRO 7 HA PRO 7 19.777 20.334 24.837 32 HB2 PRO 7 HB1 PRO 7 21.408 18.872 26.465 33 HB3 PRO 7 HB2 PRO 7 21.320 20.675 26.424 34 HG2 PRO 7 HG1 PRO 7 19.959 18.797 28.315 35 HG3 PRO 7 HG2 PRO 7 20.920 20.243 28.740 36 HD2 PRO 7 HD1 PRO 7 18.186 20.313 28.552 37 HD3 PRO 7 HD2 PRO 7 19.155 21.678 27.928 38 H GLU 8 H GLU 8 19.919 18.724 23.506 39 HA GLU 8 HA GLU 8 18.537 16.143 23.784 40 HB2 GLU 8 HB2 GLU 8 18.315 17.405 21.774 41 HB3 GLU 8 HB1 GLU 8 20.043 17.365 21.468 42 HG2 GLU 8 HG2 GLU 8 19.978 14.917 21.248 43 HG3 GLU 8 HG1 GLU 8 18.261 14.921 21.570 44 H TYR 9 H TYR 9 21.784 17.499 23.921 45 HA TYR 9 HA TYR 9 22.843 14.889 24.790 46 HB2 TYR 9 HB2 TYR 9 24.073 16.778 22.824 47 HB3 TYR 9 HB1 TYR 9 25.026 15.591 23.679 48 HD1 TYR 9 HD1 TYR 9 22.450 16.046 21.082 49 HD2 TYR 9 HD2 TYR 9 24.895 13.173 23.172 50 HE1 TYR 9 HE1 TYR 9 21.894 14.279 19.384 51 HE2 TYR 9 HE2 TYR 9 24.265 11.465 21.571 52 HH TYR 9 HH TYR 9 23.329 11.116 19.327 53 H PHE 10 H PHE 10 22.755 15.350 26.921 54 HA PHE 10 HA PHE 10 23.785 17.605 28.278 55 HB2 PHE 10 HB2 PHE 10 22.296 16.020 29.305 56 HB3 PHE 10 HB1 PHE 10 23.430 14.703 28.991 57 HD1 PHE 10 HD1 PHE 10 25.148 14.150 30.569 58 HD2 PHE 10 HD2 PHE 10 22.864 17.788 31.006 59 HE1 PHE 10 HE1 PHE 10 26.126 14.503 32.726 60 HE2 PHE 10 HE2 PHE 10 23.855 18.130 33.246 61 HZ PHE 10 HZ PHE 10 25.501 16.493 34.138 62 H VAL 11 H VAL 11 25.265 14.603 27.145 63 HA VAL 11 HA VAL 11 27.959 15.740 27.010 64 HB VAL 11 HB VAL 11 27.606 14.783 29.312 65 HG11 VAL 11 1HG1 VAL 11 27.352 12.498 29.734 66 HG12 VAL 11 2HG1 VAL 11 26.085 12.852 28.544 67 HG13 VAL 11 3HG1 VAL 11 27.606 12.057 28.095 68 HG21 VAL 11 1HG2 VAL 11 29.730 13.729 29.408 69 HG22 VAL 11 2HG2 VAL 11 29.616 13.216 27.737 70 HG23 VAL 11 3HG2 VAL 11 29.867 14.942 28.109 71 H ARG 12 H ARG 12 29.306 14.515 25.690 72 HA ARG 12 HA ARG 12 28.231 12.138 24.358 73 HB2 ARG 12 HB2 ARG 12 28.540 12.920 22.125 74 HB3 ARG 12 HB1 ARG 12 27.289 13.803 22.965 75 HG2 ARG 12 HG2 ARG 12 28.412 15.366 21.630 76 HG3 ARG 12 HG1 ARG 12 28.730 15.690 23.312 77 HD2 ARG 12 HD2 ARG 12 30.653 15.927 21.640 78 HD3 ARG 12 HD1 ARG 12 30.987 15.144 23.204 79 HE ARG 12 HE ARG 12 30.572 12.990 21.741 80 HH11 ARG 12 1HH1 ARG 12 32.760 15.764 20.932 81 HH12 ARG 12 2HH1 ARG 12 33.733 14.606 20.006 82 HH21 ARG 12 1HH2 ARG 12 31.834 11.838 20.346 83 HH22 ARG 12 2HH2 ARG 12 33.228 12.633 19.611 84 H1 CYS 13 H1 CYS 13 35.851 19.879 28.705 85 H2 CYS 13 H2 CYS 13 36.112 18.724 27.643 86 H3 CYS 13 H3 CYS 13 36.916 20.190 27.555 87 HA CYS 13 HA CYS 13 35.024 21.420 27.035 88 HB2 CYS 13 HB2 CYS 13 35.281 18.955 25.261 89 HB3 CYS 13 HB1 CYS 13 34.420 20.459 24.831 90 H GLY 14 H GLY 14 33.224 21.676 28.128 91 HA2 GLY 14 HA2 GLY 14 31.234 19.522 28.362 92 HA3 GLY 14 HA1 GLY 14 31.840 20.309 29.843 93 H THR 15 H THR 15 29.723 20.755 30.243 94 HA THR 15 HA THR 15 27.727 21.797 30.353 95 HB THR 15 HB THR 15 28.736 23.767 28.304 96 HG1 THR 15 HG1 THR 15 29.621 23.846 30.296 97 HG21 THR 15 1HG2 THR 15 26.838 25.164 28.870 98 HG22 THR 15 2HG2 THR 15 26.275 23.712 28.103 99 HG23 THR 15 3HG2 THR 15 26.120 23.901 29.868 100 HA PRO 16 HA PRO 16 25.746 19.282 27.238 101 HB2 PRO 16 HB1 PRO 16 23.606 21.413 27.429 102 HB3 PRO 16 HB2 PRO 16 23.413 19.589 27.235 103 HG2 PRO 16 HG1 PRO 16 23.165 20.747 29.691 104 HG3 PRO 16 HG2 PRO 16 24.245 19.313 29.557 105 HD2 PRO 16 HD1 PRO 16 24.979 22.150 29.617 106 HD3 PRO 16 HD2 PRO 16 25.760 20.776 30.470 107 H ILE 17 H ILE 17 25.084 19.336 25.044 108 HA ILE 17 HA ILE 17 26.184 21.669 23.565 109 HB ILE 17 HB ILE 17 26.048 18.831 22.535 110 HG12 ILE 17 2HG1 ILE 17 28.329 20.288 23.823 111 HG13 ILE 17 1HG1 ILE 17 27.539 18.812 24.396 112 HG21 ILE 17 1HG2 ILE 17 27.532 19.679 20.780 113 HG22 ILE 17 2HG2 ILE 17 26.076 20.684 20.806 114 HG23 ILE 17 3HG2 ILE 17 27.581 21.263 21.523 115 HD11 ILE 17 HD1 ILE 17 29.389 19.101 22.029 116 HD12 ILE 17 HD2 ILE 17 29.521 18.000 23.429 117 HD13 ILE 17 HD3 ILE 17 28.320 17.723 22.148 118 H SER 18 H SER 18 24.432 19.139 21.983 119 HA SER 18 HA SER 18 22.830 20.941 20.543 120 HB2 SER 18 HB2 SER 18 22.134 18.064 20.647 121 HB3 SER 18 HB1 SER 18 22.387 19.080 19.268 122 HG SER 18 HG SER 18 24.503 18.733 19.363 123 H PHE 19 H PHE 19 20.438 20.592 20.229 124 HA PHE 19 HA PHE 19 19.067 20.410 22.839 125 HB2 PHE 19 HB2 PHE 19 18.866 22.406 20.590 126 HB3 PHE 19 HB1 PHE 19 17.700 22.328 21.921 127 HD1 PHE 19 HD1 PHE 19 18.241 23.142 24.154 128 HD2 PHE 19 HD2 PHE 19 21.116 23.291 20.950 129 HE1 PHE 19 HE1 PHE 19 19.709 24.649 25.466 130 HE2 PHE 19 HE2 PHE 19 22.575 24.756 22.301 131 HZ PHE 19 HZ PHE 19 21.851 25.486 24.526 132 H TYR 20 H TYR 20 16.772 20.090 22.864 133 HA TYR 20 HA TYR 20 15.709 18.625 20.554 134 HB2 TYR 20 HB2 TYR 20 14.509 19.222 23.247 135 HB3 TYR 20 HB1 TYR 20 13.726 18.329 21.997 136 HD1 TYR 20 HD1 TYR 20 15.719 18.101 24.949 137 HD2 TYR 20 HD2 TYR 20 14.946 16.141 21.201 138 HE1 TYR 20 HE1 TYR 20 16.562 15.989 25.900 139 HE2 TYR 20 HE2 TYR 20 15.900 14.039 22.115 140 HH TYR 20 HH TYR 20 16.574 12.951 24.097 141 H CYS 21 H CYS 21 13.745 19.269 19.532 142 HA CYS 21 HA CYS 21 13.044 22.162 19.821 143 HB2 CYS 21 HB1 CYS 21 13.344 21.670 17.558 144 HB3 CYS 21 HB2 CYS 21 12.437 20.198 17.614 145 H GLY 22 H GLY 22 32.243 23.651 17.363 146 HA2 GLY 22 HA2 GLY 22 31.465 20.957 16.395 147 HA3 GLY 22 HA1 GLY 22 33.040 21.618 15.945 148 H GLY 23 H GLY 23 30.974 21.458 18.976 149 HA2 GLY 23 HA2 GLY 23 32.447 19.797 20.518 150 HA3 GLY 23 HA1 GLY 23 33.338 21.313 20.592 151 H ALA 24 H ALA 24 32.848 21.167 22.834 152 HA ALA 24 HA ALA 24 30.169 22.072 23.745 153 HB1 ALA 24 HB1 ALA 24 30.401 20.562 25.676 154 HB2 ALA 24 HB2 ALA 24 30.668 19.556 24.211 155 HB3 ALA 24 HB3 ALA 24 32.015 20.137 25.172 156 H GLY 25 H GLY 25 30.578 24.238 24.551 157 HA2 GLY 25 HA2 GLY 25 32.682 24.791 26.287 158 HA3 GLY 25 HA1 GLY 25 33.264 25.098 24.682 159 H HIS 26 H HIS 26 33.461 27.113 25.976 160 HA HIS 26 HA HIS 26 31.292 28.784 26.772 161 HB2 HIS 26 HB2 HIS 26 32.996 30.298 27.402 162 HB3 HIS 26 HB1 HIS 26 33.398 28.661 27.907 163 HD2 HIS 26 HD2 HIS 26 34.819 31.530 25.885 164 HE1 HIS 26 HE1 HIS 26 37.415 28.209 25.204 165 HE2 HIS 26 HE2 HIS 26 37.140 30.723 24.971 166 H VAL 27 H VAL 27 31.985 28.284 23.696 167 HA VAL 27 HA VAL 27 30.909 30.884 22.758 168 HB VAL 27 HB VAL 27 33.275 29.587 21.406 169 HG11 VAL 27 1HG1 VAL 27 33.276 31.691 20.101 170 HG12 VAL 27 2HG1 VAL 27 31.805 30.849 19.945 171 HG13 VAL 27 3HG1 VAL 27 31.885 32.259 21.066 172 HG21 VAL 27 1HG2 VAL 27 34.580 31.623 22.037 173 HG22 VAL 27 2HG2 VAL 27 33.311 32.034 23.207 174 HG23 VAL 27 3HG2 VAL 27 34.265 30.564 23.422 175 HA PRO 28 HA PRO 28 28.575 27.810 20.544 176 HB2 PRO 28 HB1 PRO 28 27.014 29.401 18.953 177 HB3 PRO 28 HB2 PRO 28 26.737 29.164 20.689 178 HG2 PRO 28 HG1 PRO 28 28.180 31.463 19.381 179 HG3 PRO 28 HG2 PRO 28 26.933 31.508 20.685 180 HD2 PRO 28 HD1 PRO 28 29.668 31.636 21.094 181 HD3 PRO 28 HD2 PRO 28 28.537 30.928 22.274 182 H GLU 29 H GLU 29 28.190 27.009 18.382 183 HA GLU 29 HA GLU 29 30.394 27.568 16.498 184 HB2 GLU 29 HB2 GLU 29 30.287 25.392 17.803 185 HB3 GLU 29 HB1 GLU 29 28.873 24.961 16.858 186 HG2 GLU 29 HG2 GLU 29 30.231 25.311 14.816 187 HG3 GLU 29 HG1 GLU 29 31.658 25.548 15.838 188 H TYR 30 H TYR 30 27.425 25.744 15.635 189 HA TYR 30 HA TYR 30 26.830 27.767 13.611 190 HB2 TYR 30 HB2 TYR 30 25.649 25.073 14.198 191 HB3 TYR 30 HB1 TYR 30 24.964 26.224 13.090 192 HD1 TYR 30 HD1 TYR 30 25.767 26.523 10.922 193 HD2 TYR 30 HD2 TYR 30 28.186 24.350 13.726 194 HE1 TYR 30 HE1 TYR 30 27.244 25.663 9.047 195 HE2 TYR 30 HE2 TYR 30 29.600 23.528 11.912 196 HH TYR 30 HH TYR 30 30.178 23.903 9.799 197 H PHE 31 H PHE 31 25.948 29.551 14.542 198 HA PHE 31 HA PHE 31 23.753 29.489 16.457 199 HB2 PHE 31 HB2 PHE 31 25.177 31.522 14.779 200 HB3 PHE 31 HB1 PHE 31 23.527 31.898 15.153 201 HD1 PHE 31 HD1 PHE 31 23.081 30.972 17.923 202 HD2 PHE 31 HD2 PHE 31 26.422 32.978 16.105 203 HE1 PHE 31 HE1 PHE 31 23.660 31.983 20.100 204 HE2 PHE 31 HE2 PHE 31 26.936 34.054 18.280 205 HZ PHE 31 HZ PHE 31 25.563 33.560 20.269 206 H VAL 32 H VAL 32 21.738 30.943 15.455 207 HA VAL 32 HA VAL 32 20.310 28.788 14.185 208 HB VAL 32 HB VAL 32 19.337 31.586 14.682 209 HG11 VAL 32 1HG1 VAL 32 17.115 30.341 14.814 210 HG12 VAL 32 2HG1 VAL 32 17.867 30.141 13.219 211 HG13 VAL 32 3HG1 VAL 32 17.997 28.839 14.361 212 HG21 VAL 32 1HG2 VAL 32 18.379 30.629 16.825 213 HG22 VAL 32 2HG2 VAL 32 19.278 29.156 16.416 214 HG23 VAL 32 3HG2 VAL 32 20.140 30.644 16.840 215 H ARG 33 H ARG 33 19.761 28.478 12.180 216 HA ARG 33 HA ARG 33 21.216 29.696 10.142 217 HB2 ARG 33 HB2 ARG 33 20.198 28.041 8.754 218 HB3 ARG 33 HB1 ARG 33 20.792 27.346 10.229 219 HG2 ARG 33 HG2 ARG 33 18.857 26.266 10.117 220 HG3 ARG 33 HG1 ARG 33 18.270 27.678 11.030 221 HD2 ARG 33 HD2 ARG 33 16.687 27.048 9.250 222 HD3 ARG 33 HD1 ARG 33 17.380 28.674 8.971 223 HE ARG 33 HE ARG 33 18.854 26.579 7.592 224 HH11 ARG 33 1HH1 ARG 33 15.841 28.317 7.307 225 HH12 ARG 33 2HH1 ARG 33 15.825 28.233 5.554 226 HH21 ARG 33 1HH2 ARG 33 19.081 26.880 5.481 227 HH22 ARG 33 2HH2 ARG 33 17.861 27.619 4.499 228 H1 CYS 34 H1 CYS 34 11.719 28.033 18.701 229 H2 CYS 34 H2 CYS 34 10.895 27.245 17.507 230 H3 CYS 34 H3 CYS 34 10.807 26.730 19.057 231 HA CYS 34 HA CYS 34 13.041 25.999 19.078 232 HB2 CYS 34 HB2 CYS 34 11.581 25.207 16.525 233 HB3 CYS 34 HB1 CYS 34 13.047 24.430 17.164 234 H GLY 35 H GLY 35 14.674 27.385 18.987 235 HA2 GLY 35 HA2 GLY 35 16.208 27.668 16.588 236 HA3 GLY 35 HA1 GLY 35 15.402 29.183 17.021 237 H THR 36 H THR 36 18.070 27.199 17.695 238 HA THR 36 HA THR 36 19.159 28.988 19.764 239 HB THR 36 HB THR 36 18.825 25.987 20.114 240 HG1 THR 36 HG1 THR 36 17.488 26.846 21.882 241 HG21 THR 36 1HG2 THR 36 19.407 26.395 22.461 242 HG22 THR 36 2HG2 THR 36 20.740 26.837 21.395 243 HG23 THR 36 3HG2 THR 36 19.674 28.094 22.164 244 HA PRO 37 HA PRO 37 22.889 27.693 17.594 245 HB2 PRO 37 HB1 PRO 37 24.691 27.430 19.814 246 HB3 PRO 37 HB2 PRO 37 24.375 28.883 18.791 247 HG2 PRO 37 HG1 PRO 37 23.171 28.071 21.429 248 HG3 PRO 37 HG2 PRO 37 23.801 29.679 20.955 249 HD2 PRO 37 HD1 PRO 37 21.102 29.114 20.908 250 HD3 PRO 37 HD2 PRO 37 21.833 30.036 19.554 251 H ILE 38 H ILE 38 23.975 25.859 17.166 252 HA ILE 38 HA ILE 38 22.629 23.451 18.210 253 HB ILE 38 HB ILE 38 24.247 23.957 15.699 254 HG12 ILE 38 2HG1 ILE 38 21.307 23.214 16.173 255 HG13 ILE 38 1HG1 ILE 38 21.887 24.885 16.062 256 HG21 ILE 38 1HG2 ILE 38 23.459 21.632 15.077 257 HG22 ILE 38 2HG2 ILE 38 24.645 21.656 16.371 258 HG23 ILE 38 3HG2 ILE 38 22.931 21.456 16.756 259 HD11 ILE 38 HD1 ILE 38 21.019 24.189 13.905 260 HD12 ILE 38 HD2 ILE 38 22.724 24.552 13.801 261 HD13 ILE 38 HD3 ILE 38 22.144 22.862 13.792 262 H SER 39 H SER 39 25.862 24.595 17.993 263 HA SER 39 HA SER 39 26.749 22.752 20.098 264 HB2 SER 39 HB2 SER 39 28.479 22.950 17.620 265 HB3 SER 39 HB1 SER 39 28.617 21.811 18.940 266 HG SER 39 HG SER 39 27.850 20.863 17.131 267 H PHE 40 H PHE 40 29.356 23.203 20.301 268 HA PHE 40 HA PHE 40 29.734 26.100 20.398 269 HB2 PHE 40 HB2 PHE 40 30.187 24.022 22.541 270 HB3 PHE 40 HB1 PHE 40 30.546 25.743 22.712 271 HD1 PHE 40 HD1 PHE 40 27.935 23.248 22.853 272 HD2 PHE 40 HD2 PHE 40 28.769 27.425 22.715 273 HE1 PHE 40 HE1 PHE 40 25.577 23.699 23.422 274 HE2 PHE 40 HE2 PHE 40 26.358 27.937 23.216 275 HZ PHE 40 HZ PHE 40 24.792 26.093 23.628 276 H TYR 41 H TYR 41 32.268 26.269 21.308 277 HA TYR 41 HA TYR 41 33.934 24.701 19.490 278 HB2 TYR 41 HB2 TYR 41 34.615 26.833 21.565 279 HB3 TYR 41 HB1 TYR 41 35.781 26.150 20.457 280 HD1 TYR 41 HD1 TYR 41 33.168 26.419 18.174 281 HD2 TYR 41 HD2 TYR 41 35.804 28.832 20.581 282 HE1 TYR 41 HE1 TYR 41 32.775 28.283 16.731 283 HE2 TYR 41 HE2 TYR 41 35.409 30.764 19.124 284 HH TYR 41 HH TYR 41 33.940 31.585 17.432 285 H CYS 42 H CYS 42 36.107 23.987 20.591 286 HA CYS 42 HA CYS 42 35.771 22.881 23.328 287 HB2 CYS 42 HB1 CYS 42 35.148 21.073 21.799 288 HB3 CYS 42 HB2 CYS 42 36.545 21.255 20.891 Start of MODEL 18 1 H GLY 1 H GLY 1 19.394 18.752 21.462 2 HA2 GLY 1 HA2 GLY 1 18.330 17.183 19.314 3 HA3 GLY 1 HA1 GLY 1 17.065 18.249 19.864 4 H GLY 2 H GLY 2 17.443 20.574 19.791 5 HA2 GLY 2 HA2 GLY 2 19.326 21.508 17.690 6 HA3 GLY 2 HA1 GLY 2 17.611 21.851 17.570 7 H ALA 3 H ALA 3 16.976 23.821 18.518 8 HA ALA 3 HA ALA 3 18.711 25.173 20.511 9 HB1 ALA 3 HB1 ALA 3 18.683 27.106 19.048 10 HB2 ALA 3 HB2 ALA 3 19.428 25.669 18.265 11 HB3 ALA 3 HB3 ALA 3 17.770 26.182 17.813 12 H GLY 4 H GLY 4 17.344 25.831 22.183 13 HA2 GLY 4 HA2 GLY 4 14.751 26.997 21.867 14 HA3 GLY 4 HA1 GLY 4 14.654 25.257 22.140 15 H HIS 5 H HIS 5 13.377 26.455 23.896 16 HA HIS 5 HA HIS 5 14.869 27.611 25.981 17 HB2 HIS 5 HB2 HIS 5 12.866 28.185 26.926 18 HB3 HIS 5 HB1 HIS 5 12.475 28.007 25.199 19 HD2 HIS 5 HD2 HIS 5 11.668 26.623 28.661 20 HE1 HIS 5 HE1 HIS 5 9.120 24.622 25.915 21 HE2 HIS 5 HE2 HIS 5 9.596 25.003 28.320 22 H VAL 6 H VAL 6 15.074 24.484 25.558 23 HA VAL 6 HA VAL 6 15.652 24.041 28.430 24 HB VAL 6 HB VAL 6 14.309 21.885 26.817 25 HG11 VAL 6 1HG1 VAL 6 13.909 20.879 29.063 26 HG12 VAL 6 2HG1 VAL 6 15.620 21.003 28.561 27 HG13 VAL 6 3HG1 VAL 6 14.896 22.153 29.747 28 HG21 VAL 6 1HG2 VAL 6 12.995 23.688 28.834 29 HG22 VAL 6 2HG2 VAL 6 12.669 23.571 27.070 30 HG23 VAL 6 3HG2 VAL 6 12.258 22.211 28.182 31 HA PRO 7 HA PRO 7 19.295 22.574 26.290 32 HB2 PRO 7 HB1 PRO 7 20.619 21.367 28.411 33 HB3 PRO 7 HB2 PRO 7 20.583 23.168 28.089 34 HG2 PRO 7 HG1 PRO 7 18.874 21.570 30.024 35 HG3 PRO 7 HG2 PRO 7 19.700 23.124 30.282 36 HD2 PRO 7 HD1 PRO 7 17.091 23.178 29.654 37 HD3 PRO 7 HD2 PRO 7 18.226 24.307 28.903 38 H GLU 8 H GLU 8 20.288 20.707 25.618 39 HA GLU 8 HA GLU 8 19.222 17.964 26.192 40 HB2 GLU 8 HB2 GLU 8 17.884 18.793 24.539 41 HB3 GLU 8 HB1 GLU 8 19.256 19.389 23.555 42 HG2 GLU 8 HG2 GLU 8 19.968 16.988 23.304 43 HG3 GLU 8 HG1 GLU 8 18.483 16.504 24.066 44 H TYR 9 H TYR 9 20.673 16.357 25.849 45 HA TYR 9 HA TYR 9 22.626 15.285 25.656 46 HB2 TYR 9 HB2 TYR 9 23.246 17.198 23.462 47 HB3 TYR 9 HB1 TYR 9 24.041 15.683 23.654 48 HD1 TYR 9 HD1 TYR 9 21.326 14.109 24.250 49 HD2 TYR 9 HD2 TYR 9 22.564 16.837 21.179 50 HE1 TYR 9 HE1 TYR 9 19.763 13.024 22.685 51 HE2 TYR 9 HE2 TYR 9 20.980 15.813 19.624 52 HH TYR 9 HH TYR 9 19.190 12.901 20.412 53 H PHE 10 H PHE 10 22.718 16.494 27.716 54 HA PHE 10 HA PHE 10 24.947 18.007 28.500 55 HB2 PHE 10 HB2 PHE 10 23.654 15.662 29.939 56 HB3 PHE 10 HB1 PHE 10 24.527 16.954 30.670 57 HD1 PHE 10 HD1 PHE 10 21.415 15.914 29.166 58 HD2 PHE 10 HD2 PHE 10 23.468 19.332 30.785 59 HE1 PHE 10 HE1 PHE 10 19.258 17.119 29.312 60 HE2 PHE 10 HE2 PHE 10 21.358 20.543 30.837 61 HZ PHE 10 HZ PHE 10 19.224 19.446 30.211 62 H VAL 11 H VAL 11 26.578 16.866 30.093 63 HA VAL 11 HA VAL 11 28.543 15.237 29.068 64 HB VAL 11 HB VAL 11 28.712 16.489 31.068 65 HG11 VAL 11 1HG1 VAL 11 27.807 15.735 33.228 66 HG12 VAL 11 2HG1 VAL 11 26.497 16.045 32.131 67 HG13 VAL 11 3HG1 VAL 11 26.987 14.369 32.408 68 HG21 VAL 11 1HG2 VAL 11 29.933 14.884 32.409 69 HG22 VAL 11 2HG2 VAL 11 29.248 13.535 31.471 70 HG23 VAL 11 3HG2 VAL 11 30.263 14.732 30.647 71 H ARG 12 H ARG 12 28.830 13.043 28.784 72 HA ARG 12 HA ARG 12 26.397 11.375 29.038 73 HB2 ARG 12 HB2 ARG 12 27.631 9.799 27.514 74 HB3 ARG 12 HB1 ARG 12 26.910 11.244 26.865 75 HG2 ARG 12 HG2 ARG 12 29.028 10.836 25.803 76 HG3 ARG 12 HG1 ARG 12 29.079 12.370 26.698 77 HD2 ARG 12 HD2 ARG 12 31.138 11.379 27.115 78 HD3 ARG 12 HD1 ARG 12 30.201 11.070 28.562 79 HE ARG 12 HE ARG 12 30.246 9.028 26.372 80 HH11 ARG 12 1HH1 ARG 12 31.309 9.876 29.664 81 HH12 ARG 12 2HH1 ARG 12 31.822 8.191 29.928 82 HH21 ARG 12 1HH2 ARG 12 31.180 6.951 26.829 83 HH22 ARG 12 2HH2 ARG 12 31.627 6.640 28.495 84 H1 CYS 13 H1 CYS 13 36.094 21.126 30.667 85 H2 CYS 13 H2 CYS 13 36.569 21.579 29.193 86 H3 CYS 13 H3 CYS 13 36.723 22.639 30.388 87 HA CYS 13 HA CYS 13 34.439 23.079 30.441 88 HB2 CYS 13 HB2 CYS 13 34.909 22.220 27.563 89 HB3 CYS 13 HB1 CYS 13 33.717 23.404 28.080 90 H GLY 14 H GLY 14 32.188 22.406 29.655 91 HA2 GLY 14 HA2 GLY 14 31.446 19.723 29.170 92 HA3 GLY 14 HA1 GLY 14 31.481 19.967 30.886 93 H THR 15 H THR 15 29.475 20.122 28.196 94 HA THR 15 HA THR 15 27.672 22.092 29.363 95 HB THR 15 HB THR 15 28.522 22.324 26.457 96 HG1 THR 15 HG1 THR 15 29.555 23.987 28.518 97 HG21 THR 15 1HG2 THR 15 27.848 24.717 26.790 98 HG22 THR 15 2HG2 THR 15 26.536 23.636 26.975 99 HG23 THR 15 3HG2 THR 15 27.332 24.323 28.436 100 HA PRO 16 HA PRO 16 24.818 19.392 26.981 101 HB2 PRO 16 HB1 PRO 16 22.716 21.171 26.660 102 HB3 PRO 16 HB2 PRO 16 22.984 20.089 28.091 103 HG2 PRO 16 HG1 PRO 16 23.807 22.998 27.853 104 HG3 PRO 16 HG2 PRO 16 22.977 22.165 29.233 105 HD2 PRO 16 HD1 PRO 16 25.591 22.657 29.226 106 HD3 PRO 16 HD2 PRO 16 24.977 21.118 29.875 107 H ILE 17 H ILE 17 24.958 19.113 24.939 108 HA ILE 17 HA ILE 17 26.285 21.079 23.314 109 HB ILE 17 HB ILE 17 26.202 18.312 23.522 110 HG12 ILE 17 2HG1 ILE 17 27.913 18.425 21.571 111 HG13 ILE 17 1HG1 ILE 17 27.588 20.162 21.631 112 HG21 ILE 17 1HG2 ILE 17 25.773 17.284 21.526 113 HG22 ILE 17 2HG2 ILE 17 24.292 18.217 21.926 114 HG23 ILE 17 3HG2 ILE 17 25.408 18.769 20.654 115 HD11 ILE 17 HD1 ILE 17 29.611 19.464 22.900 116 HD12 ILE 17 HD2 ILE 17 28.375 20.291 23.897 117 HD13 ILE 17 HD3 ILE 17 28.582 18.508 23.966 118 H SER 18 H SER 18 23.127 20.732 23.820 119 HA SER 18 HA SER 18 22.312 22.348 21.563 120 HB2 SER 18 HB2 SER 18 20.743 20.653 20.544 121 HB3 SER 18 HB1 SER 18 22.446 20.099 20.504 122 HG SER 18 HG SER 18 21.870 19.072 22.579 123 H PHE 19 H PHE 19 19.649 22.026 21.542 124 HA PHE 19 HA PHE 19 18.570 21.961 24.271 125 HB2 PHE 19 HB2 PHE 19 18.296 24.192 22.268 126 HB3 PHE 19 HB1 PHE 19 17.315 24.144 23.656 127 HD1 PHE 19 HD1 PHE 19 20.713 24.705 22.358 128 HD2 PHE 19 HD2 PHE 19 18.274 24.775 25.934 129 HE1 PHE 19 HE1 PHE 19 22.524 25.911 23.625 130 HE2 PHE 19 HE2 PHE 19 20.051 25.863 27.125 131 HZ PHE 19 HZ PHE 19 22.218 26.417 25.970 132 H TYR 20 H TYR 20 16.055 22.308 23.984 133 HA TYR 20 HA TYR 20 15.028 20.536 21.882 134 HB2 TYR 20 HB2 TYR 20 13.609 22.231 23.993 135 HB3 TYR 20 HB1 TYR 20 12.854 20.989 22.970 136 HD1 TYR 20 HD1 TYR 20 12.165 20.877 25.554 137 HD2 TYR 20 HD2 TYR 20 15.739 19.340 23.838 138 HE1 TYR 20 HE1 TYR 20 12.343 19.216 27.450 139 HE2 TYR 20 HE2 TYR 20 15.988 17.730 25.647 140 HH TYR 20 HH TYR 20 15.105 17.005 27.683 141 H CYS 21 H CYS 21 12.752 22.788 22.306 142 HA CYS 21 HA CYS 21 13.542 24.790 20.363 143 HB2 CYS 21 HB2 CYS 21 12.393 22.819 19.058 144 HB3 CYS 21 HB1 CYS 21 10.955 23.382 19.773 145 H GLY 22 H GLY 22 32.305 25.833 19.346 146 HA2 GLY 22 HA2 GLY 22 32.624 23.381 17.719 147 HA3 GLY 22 HA1 GLY 22 33.303 23.715 19.298 148 H GLY 23 H GLY 23 32.464 22.238 20.576 149 HA2 GLY 23 HA2 GLY 23 29.642 21.401 20.374 150 HA3 GLY 23 HA1 GLY 23 31.005 20.513 21.109 151 H ALA 24 H ALA 24 31.862 21.264 23.140 152 HA ALA 24 HA ALA 24 29.941 22.713 24.884 153 HB1 ALA 24 HB1 ALA 24 31.075 21.492 26.675 154 HB2 ALA 24 HB2 ALA 24 30.465 20.389 25.421 155 HB3 ALA 24 HB3 ALA 24 32.210 20.758 25.521 156 H GLY 25 H GLY 25 30.991 24.049 26.569 157 HA2 GLY 25 HA2 GLY 25 33.443 25.137 26.741 158 HA3 GLY 25 HA1 GLY 25 32.841 25.899 25.241 159 H HIS 26 H HIS 26 33.678 27.490 26.849 160 HA HIS 26 HA HIS 26 32.044 28.385 29.053 161 HB2 HIS 26 HB2 HIS 26 34.135 29.817 27.400 162 HB3 HIS 26 HB1 HIS 26 33.631 30.340 29.010 163 HD2 HIS 26 HD2 HIS 26 36.384 28.528 27.379 164 HE1 HIS 26 HE1 HIS 26 36.199 26.788 31.260 165 HE2 HIS 26 HE2 HIS 26 37.621 27.120 29.211 166 H VAL 27 H VAL 27 32.251 29.352 25.641 167 HA VAL 27 HA VAL 27 29.982 31.206 26.029 168 HB VAL 27 HB VAL 27 31.216 32.731 24.448 169 HG11 VAL 27 1HG1 VAL 27 32.375 33.834 26.251 170 HG12 VAL 27 2HG1 VAL 27 30.955 33.131 26.920 171 HG13 VAL 27 3HG1 VAL 27 32.529 32.290 27.147 172 HG21 VAL 27 1HG2 VAL 27 33.620 32.698 24.387 173 HG22 VAL 27 2HG2 VAL 27 33.697 31.139 25.245 174 HG23 VAL 27 3HG2 VAL 27 32.958 31.271 23.627 175 HA PRO 28 HA PRO 28 28.203 29.483 22.522 176 HB2 PRO 28 HB1 PRO 28 27.120 31.636 21.127 177 HB3 PRO 28 HB2 PRO 28 26.505 30.889 22.673 178 HG2 PRO 28 HG1 PRO 28 28.245 33.323 22.265 179 HG3 PRO 28 HG2 PRO 28 26.775 33.172 23.262 180 HD2 PRO 28 HD1 PRO 28 29.151 32.883 24.441 181 HD3 PRO 28 HD2 PRO 28 27.865 31.701 24.843 182 H GLU 29 H GLU 29 29.077 28.487 20.807 183 HA GLU 29 HA GLU 29 31.014 29.758 19.025 184 HB2 GLU 29 HB2 GLU 29 31.392 27.513 19.655 185 HB3 GLU 29 HB1 GLU 29 29.786 26.961 19.270 186 HG2 GLU 29 HG2 GLU 29 30.150 27.372 16.893 187 HG3 GLU 29 HG1 GLU 29 31.773 27.946 17.216 188 H TYR 30 H TYR 30 27.673 28.434 18.986 189 HA TYR 30 HA TYR 30 27.141 29.956 16.444 190 HB2 TYR 30 HB2 TYR 30 26.197 27.259 17.470 191 HB3 TYR 30 HB1 TYR 30 25.345 28.174 16.256 192 HD1 TYR 30 HD1 TYR 30 26.332 28.825 14.120 193 HD2 TYR 30 HD2 TYR 30 27.955 25.722 16.630 194 HE1 TYR 30 HE1 TYR 30 27.434 27.759 12.151 195 HE2 TYR 30 HE2 TYR 30 29.010 24.677 14.658 196 HH TYR 30 HH TYR 30 28.185 24.687 12.155 197 H PHE 31 H PHE 31 25.893 31.547 16.849 198 HA PHE 31 HA PHE 31 23.845 31.736 18.920 199 HB2 PHE 31 HB2 PHE 31 24.828 33.563 16.729 200 HB3 PHE 31 HB1 PHE 31 23.365 33.894 17.578 201 HD1 PHE 31 HD1 PHE 31 23.262 34.480 19.911 202 HD2 PHE 31 HD2 PHE 31 27.013 33.717 17.958 203 HE1 PHE 31 HE1 PHE 31 24.441 35.687 21.706 204 HE2 PHE 31 HE2 PHE 31 28.206 34.951 19.860 205 HZ PHE 31 HZ PHE 31 26.902 35.846 21.724 206 H VAL 32 H VAL 32 24.111 31.098 15.475 207 HA VAL 32 HA VAL 32 21.286 30.280 15.284 208 HB VAL 32 HB VAL 32 21.448 32.703 14.752 209 HG11 VAL 32 1HG1 VAL 32 22.357 33.400 12.613 210 HG12 VAL 32 2HG1 VAL 32 23.634 32.859 13.716 211 HG13 VAL 32 3HG1 VAL 32 23.126 31.813 12.365 212 HG21 VAL 32 1HG2 VAL 32 20.054 32.711 12.914 213 HG22 VAL 32 2HG2 VAL 32 20.661 31.133 12.340 214 HG23 VAL 32 3HG2 VAL 32 19.673 31.214 13.803 215 H ARG 33 H ARG 33 20.824 29.028 13.397 216 HA ARG 33 HA ARG 33 22.889 27.190 12.721 217 HB2 ARG 33 HB2 ARG 33 21.348 25.952 11.651 218 HB3 ARG 33 HB1 ARG 33 20.390 26.777 12.881 219 HG2 ARG 33 HG2 ARG 33 19.152 27.971 11.378 220 HG3 ARG 33 HG1 ARG 33 20.448 28.050 10.220 221 HD2 ARG 33 HD2 ARG 33 18.575 25.723 10.874 222 HD3 ARG 33 HD1 ARG 33 18.631 26.685 9.406 223 HE ARG 33 HE ARG 33 21.097 25.203 9.915 224 HH11 ARG 33 1HH1 ARG 33 18.166 25.244 7.975 225 HH12 ARG 33 2HH1 ARG 33 18.876 24.293 6.681 226 HH21 ARG 33 1HH2 ARG 33 21.966 23.965 8.401 227 HH22 ARG 33 2HH2 ARG 33 21.015 23.502 7.009 228 H1 CYS 34 H1 CYS 34 11.576 30.598 20.404 229 H2 CYS 34 H2 CYS 34 11.293 30.071 18.881 230 H3 CYS 34 H3 CYS 34 10.708 29.229 20.181 231 HA CYS 34 HA CYS 34 12.884 28.681 20.937 232 HB2 CYS 34 HB2 CYS 34 12.804 28.071 17.967 233 HB3 CYS 34 HB1 CYS 34 13.589 27.181 19.231 234 H GLY 35 H GLY 35 14.884 29.529 21.189 235 HA2 GLY 35 HA2 GLY 35 16.292 30.932 19.095 236 HA3 GLY 35 HA1 GLY 35 15.685 31.989 20.374 237 H THR 36 H THR 36 17.825 32.545 20.789 238 HA THR 36 HA THR 36 19.836 32.581 21.712 239 HB THR 36 HB THR 36 18.247 30.783 23.332 240 HG1 THR 36 HG1 THR 36 19.125 32.269 24.913 241 HG21 THR 36 1HG2 THR 36 19.694 30.330 25.091 242 HG22 THR 36 2HG2 THR 36 20.349 29.477 23.691 243 HG23 THR 36 3HG2 THR 36 21.136 30.963 24.289 244 HA PRO 37 HA PRO 37 22.894 30.050 19.852 245 HB2 PRO 37 HB1 PRO 37 23.763 29.619 22.741 246 HB3 PRO 37 HB2 PRO 37 24.835 29.777 21.348 247 HG2 PRO 37 HG1 PRO 37 24.314 31.998 22.820 248 HG3 PRO 37 HG2 PRO 37 24.333 32.054 21.015 249 HD2 PRO 37 HD1 PRO 37 22.066 32.130 22.936 250 HD3 PRO 37 HD2 PRO 37 22.098 32.758 21.270 251 H ILE 38 H ILE 38 24.003 28.019 19.840 252 HA ILE 38 HA ILE 38 22.270 25.755 20.688 253 HB ILE 38 HB ILE 38 24.048 25.781 18.205 254 HG12 ILE 38 2HG1 ILE 38 21.625 25.830 17.110 255 HG13 ILE 38 1HG1 ILE 38 21.296 26.791 18.584 256 HG21 ILE 38 1HG2 ILE 38 22.648 23.796 17.641 257 HG22 ILE 38 2HG2 ILE 38 23.451 23.596 19.193 258 HG23 ILE 38 3HG2 ILE 38 21.762 24.024 19.178 259 HD11 ILE 38 HD1 ILE 38 23.155 28.326 17.863 260 HD12 ILE 38 HD2 ILE 38 23.285 27.354 16.366 261 HD13 ILE 38 HD3 ILE 38 21.825 28.312 16.758 262 H SER 39 H SER 39 25.574 26.392 19.652 263 HA SER 39 HA SER 39 26.660 24.393 21.571 264 HB2 SER 39 HB2 SER 39 28.038 24.923 18.986 265 HB3 SER 39 HB1 SER 39 27.887 23.442 19.968 266 HG SER 39 HG SER 39 26.786 23.249 18.038 267 H PHE 40 H PHE 40 29.113 24.649 21.786 268 HA PHE 40 HA PHE 40 29.688 27.488 22.347 269 HB2 PHE 40 HB2 PHE 40 29.871 25.093 24.173 270 HB3 PHE 40 HB1 PHE 40 30.218 26.776 24.606 271 HD1 PHE 40 HD1 PHE 40 27.596 24.305 23.993 272 HD2 PHE 40 HD2 PHE 40 28.429 28.443 24.731 273 HE1 PHE 40 HE1 PHE 40 25.151 24.756 24.309 274 HE2 PHE 40 HE2 PHE 40 25.987 28.904 24.930 275 HZ PHE 40 HZ PHE 40 24.362 27.063 24.638 276 H TYR 41 H TYR 41 31.840 28.044 23.009 277 HA TYR 41 HA TYR 41 33.932 26.489 21.610 278 HB2 TYR 41 HB2 TYR 41 33.891 29.383 22.590 279 HB3 TYR 41 HB1 TYR 41 35.242 28.540 21.884 280 HD1 TYR 41 HD1 TYR 41 34.518 27.217 19.439 281 HD2 TYR 41 HD2 TYR 41 33.147 30.999 21.057 282 HE1 TYR 41 HE1 TYR 41 34.281 28.085 17.249 283 HE2 TYR 41 HE2 TYR 41 32.894 31.872 18.795 284 HH TYR 41 HH TYR 41 33.345 31.478 16.576 285 H CYS 42 H CYS 42 35.404 25.462 22.895 286 HA CYS 42 HA CYS 42 35.683 26.067 25.802 287 HB2 CYS 42 HB2 CYS 42 35.196 23.734 25.089 288 HB3 CYS 42 HB1 CYS 42 36.674 23.727 24.150 Start of MODEL 19 1 H GLY 1 H GLY 1 17.236 16.200 21.352 2 HA2 GLY 1 HA2 GLY 1 18.355 14.399 19.352 3 HA3 GLY 1 HA1 GLY 1 16.592 14.404 19.559 4 H GLY 2 H GLY 2 17.216 17.601 20.050 5 HA2 GLY 2 HA2 GLY 2 17.012 18.377 17.211 6 HA3 GLY 2 HA1 GLY 2 15.753 18.682 18.440 7 H ALA 3 H ALA 3 16.166 20.872 17.591 8 HA ALA 3 HA ALA 3 18.685 22.156 18.431 9 HB1 ALA 3 HB1 ALA 3 18.425 23.472 16.428 10 HB2 ALA 3 HB2 ALA 3 18.188 21.734 16.080 11 HB3 ALA 3 HB3 ALA 3 16.772 22.841 16.187 12 H GLY 4 H GLY 4 15.962 22.123 19.989 13 HA2 GLY 4 HA2 GLY 4 15.486 24.992 20.300 14 HA3 GLY 4 HA1 GLY 4 14.460 23.705 20.938 15 H HIS 5 H HIS 5 14.536 23.897 23.036 16 HA HIS 5 HA HIS 5 16.942 25.311 24.037 17 HB2 HIS 5 HB2 HIS 5 15.513 27.060 24.868 18 HB3 HIS 5 HB1 HIS 5 15.353 26.774 23.131 19 HD2 HIS 5 HD2 HIS 5 13.214 24.727 25.717 20 HE1 HIS 5 HE1 HIS 5 10.635 27.151 23.370 21 HE2 HIS 5 HE2 HIS 5 10.741 25.486 25.226 22 H VAL 6 H VAL 6 15.986 22.553 24.851 23 HA VAL 6 HA VAL 6 17.009 22.953 27.479 24 HB VAL 6 HB VAL 6 15.586 21.214 28.494 25 HG11 VAL 6 1HG1 VAL 6 13.737 22.649 28.999 26 HG12 VAL 6 2HG1 VAL 6 15.178 23.655 28.708 27 HG13 VAL 6 3HG1 VAL 6 13.926 23.532 27.432 28 HG21 VAL 6 1HG2 VAL 6 13.521 20.514 27.560 29 HG22 VAL 6 2HG2 VAL 6 13.773 21.494 26.115 30 HG23 VAL 6 3HG2 VAL 6 14.859 20.084 26.457 31 HA PRO 7 HA PRO 7 19.740 20.104 25.902 32 HB2 PRO 7 HB1 PRO 7 20.544 18.473 28.076 33 HB3 PRO 7 HB2 PRO 7 21.052 20.129 27.808 34 HG2 PRO 7 HG1 PRO 7 18.803 19.182 29.560 35 HG3 PRO 7 HG2 PRO 7 20.069 20.321 29.991 36 HD2 PRO 7 HD1 PRO 7 17.703 21.294 29.181 37 HD3 PRO 7 HD2 PRO 7 19.214 22.001 28.538 38 H GLU 8 H GLU 8 20.049 17.960 25.009 39 HA GLU 8 HA GLU 8 18.231 15.888 25.982 40 HB2 GLU 8 HB2 GLU 8 17.408 16.756 23.816 41 HB3 GLU 8 HB1 GLU 8 18.996 16.433 23.092 42 HG2 GLU 8 HG2 GLU 8 18.457 13.977 23.985 43 HG3 GLU 8 HG1 GLU 8 16.827 14.586 23.904 44 H TYR 9 H TYR 9 21.267 16.535 24.259 45 HA TYR 9 HA TYR 9 22.529 14.209 25.645 46 HB2 TYR 9 HB2 TYR 9 23.019 15.460 22.960 47 HB3 TYR 9 HB1 TYR 9 24.218 14.505 23.734 48 HD1 TYR 9 HD1 TYR 9 21.255 12.724 24.555 49 HD2 TYR 9 HD2 TYR 9 23.867 13.665 21.255 50 HE1 TYR 9 HE1 TYR 9 20.594 10.619 23.413 51 HE2 TYR 9 HE2 TYR 9 23.129 11.674 20.093 52 HH TYR 9 HH TYR 9 21.478 9.170 21.618 53 H PHE 10 H PHE 10 23.118 15.371 27.547 54 HA PHE 10 HA PHE 10 24.638 17.725 27.649 55 HB2 PHE 10 HB2 PHE 10 23.434 16.405 29.464 56 HB3 PHE 10 HB1 PHE 10 24.771 15.302 29.439 57 HD1 PHE 10 HD1 PHE 10 27.006 16.021 30.390 58 HD2 PHE 10 HD2 PHE 10 23.564 18.602 30.429 59 HE1 PHE 10 HE1 PHE 10 28.107 17.432 32.053 60 HE2 PHE 10 HE2 PHE 10 24.673 19.958 32.235 61 HZ PHE 10 HZ PHE 10 26.916 19.353 33.032 62 H VAL 11 H VAL 11 25.686 14.424 26.964 63 HA VAL 11 HA VAL 11 28.322 15.359 25.986 64 HB VAL 11 HB VAL 11 28.198 14.417 28.476 65 HG11 VAL 11 1HG1 VAL 11 28.261 12.075 28.723 66 HG12 VAL 11 2HG1 VAL 11 26.733 12.497 27.934 67 HG13 VAL 11 3HG1 VAL 11 28.021 11.769 26.994 68 HG21 VAL 11 1HG2 VAL 11 30.323 13.440 28.319 69 HG22 VAL 11 2HG2 VAL 11 30.218 13.096 26.609 70 HG23 VAL 11 3HG2 VAL 11 30.302 14.777 27.131 71 H ARG 12 H ARG 12 29.329 13.349 24.896 72 HA ARG 12 HA ARG 12 27.501 11.278 24.106 73 HB2 ARG 12 HB2 ARG 12 28.178 11.329 21.718 74 HB3 ARG 12 HB1 ARG 12 27.193 12.663 22.214 75 HG2 ARG 12 HG2 ARG 12 28.930 13.380 20.680 76 HG3 ARG 12 HG1 ARG 12 28.925 14.214 22.194 77 HD2 ARG 12 HD2 ARG 12 31.159 13.752 21.284 78 HD3 ARG 12 HD1 ARG 12 30.926 13.077 22.897 79 HE ARG 12 HE ARG 12 30.534 10.884 21.749 80 HH11 ARG 12 1HH1 ARG 12 32.733 13.278 20.208 81 HH12 ARG 12 2HH1 ARG 12 33.820 12.002 19.685 82 HH21 ARG 12 1HH2 ARG 12 31.805 9.358 20.648 83 HH22 ARG 12 2HH2 ARG 12 33.263 9.916 19.800 84 H1 CYS 13 H1 CYS 13 33.936 22.456 30.845 85 H2 CYS 13 H2 CYS 13 35.003 21.497 30.036 86 H3 CYS 13 H3 CYS 13 35.019 23.110 29.751 87 HA CYS 13 HA CYS 13 32.846 23.036 28.791 88 HB2 CYS 13 HB2 CYS 13 34.796 21.052 27.556 89 HB3 CYS 13 HB1 CYS 13 33.389 21.743 26.769 90 H GLY 14 H GLY 14 30.889 22.227 29.113 91 HA2 GLY 14 HA2 GLY 14 30.414 19.306 29.012 92 HA3 GLY 14 HA1 GLY 14 29.874 20.171 30.423 93 H THR 15 H THR 15 29.894 21.221 27.030 94 HA THR 15 HA THR 15 27.234 22.358 27.341 95 HB THR 15 HB THR 15 29.376 22.579 25.171 96 HG1 THR 15 HG1 THR 15 28.427 24.673 26.710 97 HG21 THR 15 1HG2 THR 15 28.041 24.493 24.344 98 HG22 THR 15 2HG2 THR 15 27.135 22.972 24.192 99 HG23 THR 15 3HG2 THR 15 26.735 24.072 25.484 100 HA PRO 16 HA PRO 16 25.509 18.977 24.815 101 HB2 PRO 16 HB1 PRO 16 22.926 19.783 24.695 102 HB3 PRO 16 HB2 PRO 16 23.655 19.121 26.185 103 HG2 PRO 16 HG1 PRO 16 23.369 22.050 25.553 104 HG3 PRO 16 HG2 PRO 16 22.851 21.216 27.044 105 HD2 PRO 16 HD1 PRO 16 25.206 22.464 26.841 106 HD3 PRO 16 HD2 PRO 16 25.106 20.922 27.733 107 H ILE 17 H ILE 17 25.415 18.736 22.691 108 HA ILE 17 HA ILE 17 25.254 21.029 20.854 109 HB ILE 17 HB ILE 17 26.209 18.193 20.734 110 HG12 ILE 17 2HG1 ILE 17 28.094 19.208 19.673 111 HG13 ILE 17 1HG1 ILE 17 27.396 20.776 19.666 112 HG21 ILE 17 1HG2 ILE 17 26.476 18.308 18.310 113 HG22 ILE 17 2HG2 ILE 17 24.827 18.181 18.808 114 HG23 ILE 17 3HG2 ILE 17 25.507 19.781 18.248 115 HD11 ILE 17 HD1 ILE 17 29.105 20.490 21.405 116 HD12 ILE 17 HD2 ILE 17 27.520 20.968 22.071 117 HD13 ILE 17 HD3 ILE 17 28.090 19.243 22.142 118 H SER 18 H SER 18 23.302 18.398 22.089 119 HA SER 18 HA SER 18 21.172 19.155 20.193 120 HB2 SER 18 HB2 SER 18 21.948 16.332 21.006 121 HB3 SER 18 HB1 SER 18 20.426 16.827 20.254 122 HG SER 18 HG SER 18 21.969 16.164 18.780 123 H PHE 19 H PHE 19 19.197 19.326 20.854 124 HA PHE 19 HA PHE 19 18.614 19.515 23.736 125 HB2 PHE 19 HB2 PHE 19 17.800 21.237 21.367 126 HB3 PHE 19 HB1 PHE 19 17.491 21.615 23.020 127 HD1 PHE 19 HD1 PHE 19 19.853 21.757 20.303 128 HD2 PHE 19 HD2 PHE 19 19.459 22.221 24.548 129 HE1 PHE 19 HE1 PHE 19 22.047 22.927 20.388 130 HE2 PHE 19 HE2 PHE 19 21.599 23.413 24.642 131 HZ PHE 19 HZ PHE 19 22.966 23.676 22.525 132 H TYR 20 H TYR 20 16.120 20.053 23.852 133 HA TYR 20 HA TYR 20 14.537 18.177 22.107 134 HB2 TYR 20 HB2 TYR 20 13.715 19.903 24.431 135 HB3 TYR 20 HB1 TYR 20 12.588 19.195 23.306 136 HD1 TYR 20 HD1 TYR 20 11.623 17.230 23.931 137 HD2 TYR 20 HD2 TYR 20 15.509 18.131 25.430 138 HE1 TYR 20 HE1 TYR 20 11.662 15.026 25.111 139 HE2 TYR 20 HE2 TYR 20 15.612 16.011 26.600 140 HH TYR 20 HH TYR 20 14.434 14.044 27.157 141 H CYS 21 H CYS 21 12.524 19.346 21.204 142 HA CYS 21 HA CYS 21 13.094 22.120 20.344 143 HB2 CYS 21 HB2 CYS 21 13.898 21.039 18.500 144 HB3 CYS 21 HB1 CYS 21 12.492 19.913 18.415 145 H GLY 22 H GLY 22 33.567 24.836 16.106 146 HA2 GLY 22 HA2 GLY 22 31.718 22.567 15.502 147 HA3 GLY 22 HA1 GLY 22 33.326 22.612 14.753 148 H GLY 23 H GLY 23 31.593 21.620 17.611 149 HA2 GLY 23 HA2 GLY 23 33.114 20.372 19.056 150 HA3 GLY 23 HA1 GLY 23 33.927 21.960 19.351 151 H ALA 24 H ALA 24 33.297 21.283 21.533 152 HA ALA 24 HA ALA 24 30.472 21.787 22.251 153 HB1 ALA 24 HB1 ALA 24 30.506 19.814 23.595 154 HB2 ALA 24 HB2 ALA 24 31.052 19.312 22.019 155 HB3 ALA 24 HB3 ALA 24 32.281 19.573 23.286 156 H GLY 25 H GLY 25 30.757 23.807 23.210 157 HA2 GLY 25 HA2 GLY 25 31.666 23.811 25.918 158 HA3 GLY 25 HA1 GLY 25 32.877 24.554 24.928 159 H HIS 26 H HIS 26 32.425 26.138 26.357 160 HA HIS 26 HA HIS 26 29.971 27.482 26.819 161 HB2 HIS 26 HB2 HIS 26 31.518 29.041 28.073 162 HB3 HIS 26 HB1 HIS 26 31.595 27.328 28.508 163 HD2 HIS 26 HD2 HIS 26 33.848 29.994 26.768 164 HE1 HIS 26 HE1 HIS 26 35.995 26.284 26.895 165 HE2 HIS 26 HE2 HIS 26 36.143 28.758 26.339 166 H VAL 27 H VAL 27 31.634 27.894 23.964 167 HA VAL 27 HA VAL 27 30.343 30.508 23.634 168 HB VAL 27 HB VAL 27 32.262 31.296 22.196 169 HG11 VAL 27 1HG1 VAL 27 33.433 32.351 24.067 170 HG12 VAL 27 2HG1 VAL 27 31.707 32.372 24.328 171 HG13 VAL 27 3HG1 VAL 27 32.698 31.195 25.214 172 HG21 VAL 27 1HG2 VAL 27 34.480 30.529 22.646 173 HG22 VAL 27 2HG2 VAL 27 33.943 29.502 23.982 174 HG23 VAL 27 3HG2 VAL 27 33.553 29.052 22.334 175 HA PRO 28 HA PRO 28 28.874 28.398 20.196 176 HB2 PRO 28 HB1 PRO 28 27.578 30.407 18.803 177 HB3 PRO 28 HB2 PRO 28 27.101 29.779 20.394 178 HG2 PRO 28 HG1 PRO 28 28.888 32.118 19.667 179 HG3 PRO 28 HG2 PRO 28 27.360 32.163 20.629 180 HD2 PRO 28 HD1 PRO 28 29.753 31.933 21.942 181 HD3 PRO 28 HD2 PRO 28 28.371 30.955 22.477 182 H GLU 29 H GLU 29 29.338 27.760 18.152 183 HA GLU 29 HA GLU 29 31.249 29.182 16.413 184 HB2 GLU 29 HB2 GLU 29 32.060 27.034 17.373 185 HB3 GLU 29 HB1 GLU 29 30.596 26.267 16.760 186 HG2 GLU 29 HG2 GLU 29 31.608 27.263 14.421 187 HG3 GLU 29 HG1 GLU 29 33.085 26.950 15.340 188 H TYR 30 H TYR 30 28.195 27.442 16.726 189 HA TYR 30 HA TYR 30 27.298 28.505 14.125 190 HB2 TYR 30 HB2 TYR 30 26.823 25.754 15.326 191 HB3 TYR 30 HB1 TYR 30 25.819 26.413 14.044 192 HD1 TYR 30 HD1 TYR 30 28.279 27.681 12.458 193 HD2 TYR 30 HD2 TYR 30 27.309 23.760 14.013 194 HE1 TYR 30 HE1 TYR 30 29.447 26.601 10.575 195 HE2 TYR 30 HE2 TYR 30 28.550 22.713 12.232 196 HH TYR 30 HH TYR 30 29.619 23.047 10.273 197 H PHE 31 H PHE 31 26.291 30.248 15.018 198 HA PHE 31 HA PHE 31 24.323 29.992 17.087 199 HB2 PHE 31 HB2 PHE 31 25.944 31.909 16.597 200 HB3 PHE 31 HB1 PHE 31 24.983 32.222 15.146 201 HD1 PHE 31 HD1 PHE 31 24.376 31.628 18.770 202 HD2 PHE 31 HD2 PHE 31 23.741 34.135 15.396 203 HE1 PHE 31 HE1 PHE 31 22.977 33.170 20.168 204 HE2 PHE 31 HE2 PHE 31 22.271 35.651 16.744 205 HZ PHE 31 HZ PHE 31 21.861 35.120 19.153 206 H VAL 32 H VAL 32 22.225 31.493 16.430 207 HA VAL 32 HA VAL 32 20.559 29.765 14.998 208 HB VAL 32 HB VAL 32 19.864 31.280 16.778 209 HG11 VAL 32 1HG1 VAL 32 19.235 33.525 16.458 210 HG12 VAL 32 2HG1 VAL 32 20.880 33.463 15.931 211 HG13 VAL 32 3HG1 VAL 32 19.563 33.436 14.729 212 HG21 VAL 32 1HG2 VAL 32 17.661 31.611 15.882 213 HG22 VAL 32 2HG2 VAL 32 18.267 31.322 14.193 214 HG23 VAL 32 3HG2 VAL 32 18.246 30.048 15.427 215 H ARG 33 H ARG 33 20.551 29.357 12.943 216 HA ARG 33 HA ARG 33 22.281 30.672 11.178 217 HB2 ARG 33 HB2 ARG 33 21.785 28.953 9.666 218 HB3 ARG 33 HB1 ARG 33 21.749 28.197 11.220 219 HG2 ARG 33 HG2 ARG 33 19.902 27.259 10.366 220 HG3 ARG 33 HG1 ARG 33 19.128 28.684 11.049 221 HD2 ARG 33 HD2 ARG 33 18.303 28.192 8.743 222 HD3 ARG 33 HD1 ARG 33 19.163 29.717 8.753 223 HE ARG 33 HE ARG 33 21.179 27.967 8.157 224 HH11 ARG 33 1HH1 ARG 33 17.998 28.378 6.570 225 HH12 ARG 33 2HH1 ARG 33 18.680 28.097 4.984 226 HH21 ARG 33 1HH2 ARG 33 21.914 27.544 6.214 227 HH22 ARG 33 2HH2 ARG 33 20.858 27.460 4.806 228 H1 CYS 34 H1 CYS 34 12.900 27.795 18.265 229 H2 CYS 34 H2 CYS 34 12.602 27.094 16.803 230 H3 CYS 34 H3 CYS 34 11.928 26.515 18.158 231 HA CYS 34 HA CYS 34 14.147 25.931 19.008 232 HB2 CYS 34 HB2 CYS 34 13.404 24.696 16.364 233 HB3 CYS 34 HB1 CYS 34 14.554 24.013 17.523 234 H GLY 35 H GLY 35 15.564 27.618 19.033 235 HA2 GLY 35 HA2 GLY 35 17.088 28.361 16.569 236 HA3 GLY 35 HA1 GLY 35 16.235 29.525 17.635 237 H THR 36 H THR 36 17.842 26.859 19.099 238 HA THR 36 HA THR 36 19.607 28.612 20.588 239 HB THR 36 HB THR 36 19.540 25.605 20.540 240 HG1 THR 36 HG1 THR 36 18.026 25.781 21.924 241 HG21 THR 36 1HG2 THR 36 20.279 25.832 22.887 242 HG22 THR 36 2HG2 THR 36 21.494 26.513 21.837 243 HG23 THR 36 3HG2 THR 36 20.400 27.577 22.725 244 HA PRO 37 HA PRO 37 23.315 27.919 17.957 245 HB2 PRO 37 HB1 PRO 37 25.312 27.791 19.890 246 HB3 PRO 37 HB2 PRO 37 24.655 29.280 19.149 247 HG2 PRO 37 HG1 PRO 37 23.792 27.903 21.730 248 HG3 PRO 37 HG2 PRO 37 24.283 29.627 21.501 249 HD2 PRO 37 HD1 PRO 37 21.659 28.876 21.522 250 HD3 PRO 37 HD2 PRO 37 22.183 29.989 20.243 251 H ILE 38 H ILE 38 24.453 26.133 17.402 252 HA ILE 38 HA ILE 38 23.622 23.633 18.780 253 HB ILE 38 HB ILE 38 24.288 23.982 15.821 254 HG12 ILE 38 2HG1 ILE 38 21.633 23.557 15.762 255 HG13 ILE 38 1HG1 ILE 38 21.735 24.378 17.324 256 HG21 ILE 38 1HG2 ILE 38 23.143 21.854 15.588 257 HG22 ILE 38 2HG2 ILE 38 24.423 21.678 16.764 258 HG23 ILE 38 3HG2 ILE 38 22.735 21.853 17.337 259 HD11 ILE 38 HD1 ILE 38 21.257 25.944 15.552 260 HD12 ILE 38 HD2 ILE 38 22.814 26.341 16.250 261 HD13 ILE 38 HD3 ILE 38 22.700 25.465 14.665 262 H SER 39 H SER 39 26.339 25.171 17.328 263 HA SER 39 HA SER 39 28.121 23.080 18.540 264 HB2 SER 39 HB2 SER 39 28.380 24.325 15.779 265 HB3 SER 39 HB1 SER 39 29.656 23.402 16.537 266 HG SER 39 HG SER 39 28.406 21.600 16.549 267 H PHE 40 H PHE 40 30.180 23.793 18.937 268 HA PHE 40 HA PHE 40 30.381 26.657 19.734 269 HB2 PHE 40 HB2 PHE 40 30.689 24.133 21.370 270 HB3 PHE 40 HB1 PHE 40 30.770 25.785 21.973 271 HD1 PHE 40 HD1 PHE 40 28.660 27.180 22.005 272 HD2 PHE 40 HD2 PHE 40 28.640 23.001 21.118 273 HE1 PHE 40 HE1 PHE 40 26.193 27.153 22.220 274 HE2 PHE 40 HE2 PHE 40 26.163 22.952 21.333 275 HZ PHE 40 HZ PHE 40 24.933 25.068 21.880 276 H TYR 41 H TYR 41 32.508 27.080 20.967 277 HA TYR 41 HA TYR 41 34.706 25.316 19.981 278 HB2 TYR 41 HB2 TYR 41 35.188 27.930 21.338 279 HB3 TYR 41 HB1 TYR 41 36.315 26.976 20.412 280 HD1 TYR 41 HD1 TYR 41 35.168 26.678 17.750 281 HD2 TYR 41 HD2 TYR 41 35.032 30.029 20.442 282 HE1 TYR 41 HE1 TYR 41 34.827 28.225 15.852 283 HE2 TYR 41 HE2 TYR 41 34.747 31.572 18.592 284 HH TYR 41 HH TYR 41 34.869 31.740 16.379 285 H CYS 42 H CYS 42 36.321 24.997 21.671 286 HA CYS 42 HA CYS 42 35.507 25.263 24.498 287 HB2 CYS 42 HB1 CYS 42 34.746 23.091 23.825 288 HB3 CYS 42 HB2 CYS 42 36.344 22.690 23.142 Start of MODEL 20 1 H GLY 1 H GLY 1 16.679 16.182 21.456 2 HA2 GLY 1 HA2 GLY 1 17.429 14.581 19.179 3 HA3 GLY 1 HA1 GLY 1 15.736 14.647 19.379 4 H GLY 2 H GLY 2 16.783 17.684 20.370 5 HA2 GLY 2 HA2 GLY 2 16.742 18.913 17.664 6 HA3 GLY 2 HA1 GLY 2 15.489 19.261 18.892 7 H ALA 3 H ALA 3 16.210 21.474 18.660 8 HA ALA 3 HA ALA 3 18.376 22.091 20.590 9 HB1 ALA 3 HB1 ALA 3 18.946 24.116 19.358 10 HB2 ALA 3 HB2 ALA 3 19.190 22.697 18.291 11 HB3 ALA 3 HB3 ALA 3 17.794 23.742 18.101 12 H GLY 4 H GLY 4 17.642 23.042 22.320 13 HA2 GLY 4 HA2 GLY 4 15.044 24.405 22.390 14 HA3 GLY 4 HA1 GLY 4 15.208 22.789 23.130 15 H HIS 5 H HIS 5 14.577 23.822 25.051 16 HA HIS 5 HA HIS 5 16.703 25.411 26.388 17 HB2 HIS 5 HB2 HIS 5 15.013 26.411 27.789 18 HB3 HIS 5 HB1 HIS 5 14.759 26.698 26.081 19 HD2 HIS 5 HD2 HIS 5 13.189 24.481 28.937 20 HE1 HIS 5 HE1 HIS 5 10.257 25.178 25.917 21 HE2 HIS 5 HE2 HIS 5 10.681 24.158 28.198 22 H VAL 6 H VAL 6 15.610 22.266 26.398 23 HA VAL 6 HA VAL 6 16.801 21.769 29.016 24 HB VAL 6 HB VAL 6 15.088 19.881 29.174 25 HG11 VAL 6 1HG1 VAL 6 13.868 21.082 30.779 26 HG12 VAL 6 2HG1 VAL 6 15.505 21.774 30.778 27 HG13 VAL 6 3HG1 VAL 6 14.201 22.660 29.933 28 HG21 VAL 6 1HG2 VAL 6 12.844 20.387 28.500 29 HG22 VAL 6 2HG2 VAL 6 13.352 21.988 27.869 30 HG23 VAL 6 3HG2 VAL 6 13.843 20.526 27.044 31 HA PRO 7 HA PRO 7 18.971 19.226 26.515 32 HB2 PRO 7 HB1 PRO 7 20.179 17.345 28.204 33 HB3 PRO 7 HB2 PRO 7 20.452 19.118 28.263 34 HG2 PRO 7 HG1 PRO 7 18.582 17.487 29.928 35 HG3 PRO 7 HG2 PRO 7 19.784 18.689 30.507 36 HD2 PRO 7 HD1 PRO 7 17.186 19.329 30.135 37 HD3 PRO 7 HD2 PRO 7 18.494 20.495 29.736 38 H GLU 8 H GLU 8 19.355 17.354 25.446 39 HA GLU 8 HA GLU 8 17.643 14.919 25.814 40 HB2 GLU 8 HB2 GLU 8 16.754 16.313 24.011 41 HB3 GLU 8 HB1 GLU 8 18.321 16.063 23.141 42 HG2 GLU 8 HG2 GLU 8 17.771 13.531 23.630 43 HG3 GLU 8 HG1 GLU 8 16.111 14.128 23.784 44 H TYR 9 H TYR 9 20.674 16.416 24.534 45 HA TYR 9 HA TYR 9 22.064 14.120 25.783 46 HB2 TYR 9 HB2 TYR 9 22.996 15.836 23.494 47 HB3 TYR 9 HB1 TYR 9 24.018 14.764 24.377 48 HD1 TYR 9 HD1 TYR 9 23.386 14.993 21.386 49 HD2 TYR 9 HD2 TYR 9 21.913 12.361 24.430 50 HE1 TYR 9 HE1 TYR 9 23.134 13.239 19.696 51 HE2 TYR 9 HE2 TYR 9 21.646 10.594 22.759 52 HH TYR 9 HH TYR 9 22.973 10.912 19.439 53 H PHE 10 H PHE 10 22.421 14.844 27.666 54 HA PHE 10 HA PHE 10 23.652 17.416 28.352 55 HB2 PHE 10 HB2 PHE 10 22.055 16.006 29.802 56 HB3 PHE 10 HB1 PHE 10 23.408 14.878 29.978 57 HD1 PHE 10 HD1 PHE 10 22.611 18.623 30.296 58 HD2 PHE 10 HD2 PHE 10 24.619 15.162 31.926 59 HE1 PHE 10 HE1 PHE 10 23.443 19.985 32.154 60 HE2 PHE 10 HE2 PHE 10 25.461 16.526 33.745 61 HZ PHE 10 HZ PHE 10 24.812 18.996 33.896 62 H VAL 11 H VAL 11 25.693 16.118 30.079 63 HA VAL 11 HA VAL 11 27.872 15.910 28.270 64 HB VAL 11 HB VAL 11 27.945 16.284 30.760 65 HG11 VAL 11 1HG1 VAL 11 27.997 14.426 32.278 66 HG12 VAL 11 2HG1 VAL 11 26.448 14.397 31.418 67 HG13 VAL 11 3HG1 VAL 11 27.759 13.309 30.926 68 HG21 VAL 11 1HG2 VAL 11 30.078 15.214 31.062 69 HG22 VAL 11 2HG2 VAL 11 29.751 14.049 29.772 70 HG23 VAL 11 3HG2 VAL 11 29.974 15.755 29.362 71 H ARG 12 H ARG 12 29.039 14.117 27.515 72 HA ARG 12 HA ARG 12 27.443 12.022 26.457 73 HB2 ARG 12 HB2 ARG 12 29.512 11.040 25.710 74 HB3 ARG 12 HB1 ARG 12 29.337 12.715 25.283 75 HG2 ARG 12 HG2 ARG 12 31.694 12.156 25.858 76 HG3 ARG 12 HG1 ARG 12 31.056 13.395 26.898 77 HD2 ARG 12 HD2 ARG 12 32.410 11.790 28.116 78 HD3 ARG 12 HD1 ARG 12 30.842 11.884 28.743 79 HE ARG 12 HE ARG 12 30.286 9.805 27.425 80 HH11 ARG 12 1HH1 ARG 12 33.750 10.217 28.280 81 HH12 ARG 12 2HH1 ARG 12 33.895 8.505 28.580 82 HH21 ARG 12 1HH2 ARG 12 30.755 7.569 27.652 83 HH22 ARG 12 2HH2 ARG 12 32.326 7.097 28.224 84 H1 CYS 13 H1 CYS 13 33.092 22.347 29.952 85 H2 CYS 13 H2 CYS 13 34.353 21.948 30.891 86 H3 CYS 13 H3 CYS 13 34.523 22.865 29.509 87 HA CYS 13 HA CYS 13 34.006 21.039 28.135 88 HB2 CYS 13 HB2 CYS 13 36.171 20.597 30.190 89 HB3 CYS 13 HB1 CYS 13 35.789 19.305 29.145 90 H GLY 14 H GLY 14 32.417 19.700 27.845 91 HA2 GLY 14 HA2 GLY 14 31.118 17.736 28.312 92 HA3 GLY 14 HA1 GLY 14 31.553 17.820 30.022 93 H THR 15 H THR 15 29.229 18.704 27.569 94 HA THR 15 HA THR 15 27.511 20.080 29.458 95 HB THR 15 HB THR 15 29.456 21.565 28.151 96 HG1 THR 15 HG1 THR 15 28.284 23.283 28.844 97 HG21 THR 15 1HG2 THR 15 28.268 23.176 26.779 98 HG22 THR 15 2HG2 THR 15 28.059 21.571 25.992 99 HG23 THR 15 3HG2 THR 15 26.752 22.332 26.943 100 HA PRO 16 HA PRO 16 24.585 18.516 26.584 101 HB2 PRO 16 HB1 PRO 16 22.568 20.444 26.552 102 HB3 PRO 16 HB2 PRO 16 22.816 19.197 27.804 103 HG2 PRO 16 HG1 PRO 16 23.743 22.066 27.804 104 HG3 PRO 16 HG2 PRO 16 22.948 21.182 29.134 105 HD2 PRO 16 HD1 PRO 16 25.627 21.594 28.967 106 HD3 PRO 16 HD2 PRO 16 25.012 20.070 29.637 107 H ILE 17 H ILE 17 24.282 18.524 24.494 108 HA ILE 17 HA ILE 17 24.885 20.876 22.765 109 HB ILE 17 HB ILE 17 25.756 18.049 22.493 110 HG12 ILE 17 2HG1 ILE 17 27.641 19.132 21.266 111 HG13 ILE 17 1HG1 ILE 17 26.836 20.699 21.513 112 HG21 ILE 17 1HG2 ILE 17 26.023 18.335 20.029 113 HG22 ILE 17 2HG2 ILE 17 24.376 18.071 20.542 114 HG23 ILE 17 3HG2 ILE 17 24.901 19.728 20.116 115 HD11 ILE 17 HD1 ILE 17 28.618 20.332 23.059 116 HD12 ILE 17 HD2 ILE 17 27.101 20.372 24.003 117 HD13 ILE 17 HD3 ILE 17 27.905 18.831 23.699 118 H SER 18 H SER 18 22.916 17.934 23.114 119 HA SER 18 HA SER 18 20.980 19.126 21.226 120 HB2 SER 18 HB2 SER 18 21.387 16.237 22.087 121 HB3 SER 18 HB1 SER 18 20.121 16.869 20.971 122 HG SER 18 HG SER 18 21.642 17.370 19.536 123 H PHE 19 H PHE 19 18.779 19.067 21.674 124 HA PHE 19 HA PHE 19 17.931 18.979 24.512 125 HB2 PHE 19 HB2 PHE 19 17.614 21.119 22.402 126 HB3 PHE 19 HB1 PHE 19 16.885 21.257 23.981 127 HD1 PHE 19 HD1 PHE 19 20.013 21.614 21.997 128 HD2 PHE 19 HD2 PHE 19 18.219 22.053 25.920 129 HE1 PHE 19 HE1 PHE 19 21.958 22.906 22.805 130 HE2 PHE 19 HE2 PHE 19 20.201 23.194 26.687 131 HZ PHE 19 HZ PHE 19 22.072 23.694 25.058 132 H TYR 20 H TYR 20 15.462 19.675 24.477 133 HA TYR 20 HA TYR 20 13.897 18.185 22.438 134 HB2 TYR 20 HB2 TYR 20 12.964 20.252 24.451 135 HB3 TYR 20 HB1 TYR 20 11.981 19.103 23.536 136 HD1 TYR 20 HD1 TYR 20 11.565 19.465 26.327 137 HD2 TYR 20 HD2 TYR 20 14.378 16.890 24.388 138 HE1 TYR 20 HE1 TYR 20 11.693 18.122 28.381 139 HE2 TYR 20 HE2 TYR 20 14.519 15.515 26.444 140 HH TYR 20 HH TYR 20 14.132 15.580 28.705 141 H CYS 21 H CYS 21 11.962 19.935 21.679 142 HA CYS 21 HA CYS 21 12.993 22.566 21.827 143 HB2 CYS 21 HB1 CYS 21 13.717 22.320 19.614 144 HB3 CYS 21 HB2 CYS 21 12.265 21.512 19.074 145 H GLY 22 H GLY 22 32.648 24.467 19.024 146 HA2 GLY 22 HA2 GLY 22 31.949 22.114 17.811 147 HA3 GLY 22 HA1 GLY 22 33.623 22.350 17.273 148 H GLY 23 H GLY 23 31.548 21.709 19.963 149 HA2 GLY 23 HA2 GLY 23 33.022 20.017 21.447 150 HA3 GLY 23 HA1 GLY 23 33.701 21.576 21.964 151 H ALA 24 H ALA 24 32.782 20.792 24.017 152 HA ALA 24 HA ALA 24 29.917 21.448 24.456 153 HB1 ALA 24 HB1 ALA 24 29.752 19.496 25.898 154 HB2 ALA 24 HB2 ALA 24 30.230 19.017 24.291 155 HB3 ALA 24 HB3 ALA 24 31.466 19.075 25.561 156 H GLY 25 H GLY 25 30.274 23.406 25.441 157 HA2 GLY 25 HA2 GLY 25 31.319 23.476 28.159 158 HA3 GLY 25 HA1 GLY 25 32.373 24.224 26.912 159 H HIS 26 H HIS 26 31.989 26.001 28.440 160 HA HIS 26 HA HIS 26 29.471 26.985 29.157 161 HB2 HIS 26 HB2 HIS 26 30.710 28.756 30.133 162 HB3 HIS 26 HB1 HIS 26 31.450 27.215 30.502 163 HD2 HIS 26 HD2 HIS 26 32.641 30.538 29.728 164 HE1 HIS 26 HE1 HIS 26 35.622 27.924 28.113 165 HE2 HIS 26 HE2 HIS 26 35.083 30.317 28.715 166 H VAL 27 H VAL 27 31.008 27.614 26.122 167 HA VAL 27 HA VAL 27 29.294 29.959 25.648 168 HB VAL 27 HB VAL 27 31.324 31.070 24.578 169 HG11 VAL 27 1HG1 VAL 27 31.943 32.150 26.666 170 HG12 VAL 27 2HG1 VAL 27 30.201 31.861 26.606 171 HG13 VAL 27 3HG1 VAL 27 31.267 30.791 27.578 172 HG21 VAL 27 1HG2 VAL 27 33.510 30.592 25.327 173 HG22 VAL 27 2HG2 VAL 27 32.940 29.319 26.420 174 HG23 VAL 27 3HG2 VAL 27 32.811 29.117 24.643 175 HA PRO 28 HA PRO 28 28.579 27.878 22.045 176 HB2 PRO 28 HB1 PRO 28 27.501 29.753 20.356 177 HB3 PRO 28 HB2 PRO 28 26.824 29.133 21.896 178 HG2 PRO 28 HG1 PRO 28 28.492 31.595 21.349 179 HG3 PRO 28 HG2 PRO 28 26.895 31.566 22.157 180 HD2 PRO 28 HD1 PRO 28 29.134 31.548 23.676 181 HD3 PRO 28 HD2 PRO 28 27.783 30.532 24.181 182 H GLU 29 H GLU 29 29.139 27.260 20.071 183 HA GLU 29 HA GLU 29 31.315 28.635 18.520 184 HB2 GLU 29 HB2 GLU 29 31.853 26.434 19.362 185 HB3 GLU 29 HB1 GLU 29 30.410 25.745 18.557 186 HG2 GLU 29 HG2 GLU 29 31.371 26.565 16.391 187 HG3 GLU 29 HG1 GLU 29 32.878 26.891 17.245 188 H TYR 30 H TYR 30 28.164 26.920 18.317 189 HA TYR 30 HA TYR 30 27.594 28.292 15.749 190 HB2 TYR 30 HB2 TYR 30 27.104 25.416 16.633 191 HB3 TYR 30 HB1 TYR 30 26.110 26.191 15.419 192 HD1 TYR 30 HD1 TYR 30 27.634 27.659 13.599 193 HD2 TYR 30 HD2 TYR 30 28.496 23.943 15.531 194 HE1 TYR 30 HE1 TYR 30 29.196 27.106 11.809 195 HE2 TYR 30 HE2 TYR 30 30.138 23.364 13.674 196 HH TYR 30 HH TYR 30 30.717 23.858 11.604 197 H PHE 31 H PHE 31 26.191 29.796 16.196 198 HA PHE 31 HA PHE 31 24.049 29.760 18.158 199 HB2 PHE 31 HB2 PHE 31 24.973 31.462 15.860 200 HB3 PHE 31 HB1 PHE 31 23.308 31.603 16.290 201 HD1 PHE 31 HD1 PHE 31 26.621 31.361 18.191 202 HD2 PHE 31 HD2 PHE 31 22.712 33.259 17.840 203 HE1 PHE 31 HE1 PHE 31 27.216 32.921 19.893 204 HE2 PHE 31 HE2 PHE 31 23.347 34.818 19.533 205 HZ PHE 31 HZ PHE 31 25.609 34.752 20.593 206 H VAL 32 H VAL 32 21.792 30.365 17.159 207 HA VAL 32 HA VAL 32 20.301 28.319 16.104 208 HB VAL 32 HB VAL 32 19.482 30.463 16.987 209 HG11 VAL 32 1HG1 VAL 32 19.285 32.398 15.682 210 HG12 VAL 32 2HG1 VAL 32 20.995 31.990 15.782 211 HG13 VAL 32 3HG1 VAL 32 20.081 31.669 14.264 212 HG21 VAL 32 1HG2 VAL 32 17.572 30.747 15.652 213 HG22 VAL 32 2HG2 VAL 32 18.343 30.046 14.229 214 HG23 VAL 32 3HG2 VAL 32 17.974 28.990 15.601 215 H ARG 33 H ARG 33 19.639 27.598 14.239 216 HA ARG 33 HA ARG 33 21.404 27.384 12.006 217 HB2 ARG 33 HB2 ARG 33 19.529 26.083 11.021 218 HB3 ARG 33 HB1 ARG 33 20.181 25.556 12.566 219 HG2 ARG 33 HG2 ARG 33 17.799 25.262 12.407 220 HG3 ARG 33 HG1 ARG 33 18.197 26.353 13.734 221 HD2 ARG 33 HD2 ARG 33 16.244 27.093 12.538 222 HD3 ARG 33 HD1 ARG 33 17.572 28.254 12.273 223 HE ARG 33 HE ARG 33 17.521 26.299 10.173 224 HH11 ARG 33 1HH1 ARG 33 15.620 29.169 11.207 225 HH12 ARG 33 2HH1 ARG 33 15.143 29.479 9.520 226 HH21 ARG 33 1HH2 ARG 33 16.908 26.900 8.123 227 HH22 ARG 33 2HH2 ARG 33 15.700 28.179 7.901 228 H1 CYS 34 H1 CYS 34 12.383 29.126 21.206 229 H2 CYS 34 H2 CYS 34 11.868 28.871 19.682 230 H3 CYS 34 H3 CYS 34 11.589 27.738 20.814 231 HA CYS 34 HA CYS 34 14.079 27.568 21.054 232 HB2 CYS 34 HB2 CYS 34 12.646 26.700 18.510 233 HB3 CYS 34 HB1 CYS 34 14.216 26.107 19.013 234 H GLY 35 H GLY 35 16.057 27.956 20.113 235 HA2 GLY 35 HA2 GLY 35 16.909 29.407 17.989 236 HA3 GLY 35 HA1 GLY 35 16.447 30.648 19.154 237 H THR 36 H THR 36 17.617 27.647 20.570 238 HA THR 36 HA THR 36 19.787 28.916 21.873 239 HB THR 36 HB THR 36 19.082 25.964 21.557 240 HG1 THR 36 HG1 THR 36 17.892 26.198 23.364 241 HG21 THR 36 1HG2 THR 36 19.887 25.691 23.848 242 HG22 THR 36 2HG2 THR 36 21.210 26.248 22.856 243 HG23 THR 36 3HG2 THR 36 20.361 27.417 23.927 244 HA PRO 37 HA PRO 37 23.098 27.713 19.026 245 HB2 PRO 37 HB1 PRO 37 25.156 27.294 20.780 246 HB3 PRO 37 HB2 PRO 37 24.568 28.918 20.322 247 HG2 PRO 37 HG1 PRO 37 23.687 27.300 22.749 248 HG3 PRO 37 HG2 PRO 37 24.307 29.008 22.706 249 HD2 PRO 37 HD1 PRO 37 21.706 28.586 22.730 250 HD3 PRO 37 HD2 PRO 37 22.382 29.770 21.574 251 H ILE 38 H ILE 38 24.388 25.844 18.597 252 HA ILE 38 HA ILE 38 23.411 23.275 19.717 253 HB ILE 38 HB ILE 38 22.349 24.065 17.601 254 HG12 ILE 38 2HG1 ILE 38 22.350 22.136 16.354 255 HG13 ILE 38 1HG1 ILE 38 23.874 21.520 17.048 256 HG21 ILE 38 1HG2 ILE 38 23.506 24.013 15.562 257 HG22 ILE 38 2HG2 ILE 38 24.275 25.199 16.602 258 HG23 ILE 38 3HG2 ILE 38 25.040 23.575 16.326 259 HD11 ILE 38 HD1 ILE 38 21.788 20.399 17.897 260 HD12 ILE 38 HD2 ILE 38 22.831 21.083 19.174 261 HD13 ILE 38 HD3 ILE 38 21.336 21.872 18.703 262 H SER 39 H SER 39 26.177 25.019 19.411 263 HA SER 39 HA SER 39 27.651 22.691 20.234 264 HB2 SER 39 HB2 SER 39 28.511 24.091 17.661 265 HB3 SER 39 HB1 SER 39 29.605 23.106 18.643 266 HG SER 39 HG SER 39 27.207 21.873 18.099 267 H PHE 40 H PHE 40 29.678 23.312 21.186 268 HA PHE 40 HA PHE 40 29.935 26.165 21.964 269 HB2 PHE 40 HB2 PHE 40 30.279 23.665 23.588 270 HB3 PHE 40 HB1 PHE 40 30.446 25.303 24.185 271 HD1 PHE 40 HD1 PHE 40 28.410 26.890 24.152 272 HD2 PHE 40 HD2 PHE 40 28.148 22.678 23.350 273 HE1 PHE 40 HE1 PHE 40 25.943 27.028 24.116 274 HE2 PHE 40 HE2 PHE 40 25.639 22.822 23.335 275 HZ PHE 40 HZ PHE 40 24.576 25.066 23.675 276 H TYR 41 H TYR 41 32.012 26.520 23.189 277 HA TYR 41 HA TYR 41 34.344 25.086 21.961 278 HB2 TYR 41 HB2 TYR 41 34.263 27.246 24.057 279 HB3 TYR 41 HB1 TYR 41 35.674 26.658 23.304 280 HD1 TYR 41 HD1 TYR 41 34.138 26.720 20.317 281 HD2 TYR 41 HD2 TYR 41 34.920 29.527 23.494 282 HE1 TYR 41 HE1 TYR 41 33.961 28.539 18.755 283 HE2 TYR 41 HE2 TYR 41 34.556 31.397 21.949 284 HH TYR 41 HH TYR 41 34.245 31.951 19.715 285 H CYS 42 H CYS 42 35.988 24.613 23.897 286 HA CYS 42 HA CYS 42 34.617 23.248 26.160 287 HB2 CYS 42 HB2 CYS 42 35.635 21.788 24.147 288 HB3 CYS 42 HB1 CYS 42 37.118 22.194 24.932
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