NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
24505 | 2k2y | 15730 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ASN 1 H1 ASN 1 14.963 19.212 34.409 2 H2 ASN 1 H2 ASN 1 13.740 19.541 33.348 3 H3 ASN 1 H3 ASN 1 14.441 18.049 33.361 4 HA ASN 1 HA ASN 1 15.153 19.301 31.496 5 HB2 ASN 1 2HB ASN 1 16.825 21.204 32.069 6 HB3 ASN 1 3HB ASN 1 15.099 21.516 31.965 7 HD21 ASN 1 2HD2 ASN 1 15.361 23.240 35.026 8 HD22 ASN 1 1HD2 ASN 1 14.894 23.277 33.339 9 H GLU 2 H GLU 2 16.169 17.533 30.999 10 HA GLU 2 HA GLU 2 18.157 16.226 32.472 11 HB2 GLU 2 2HB GLU 2 16.572 15.502 30.480 12 HB3 GLU 2 3HB GLU 2 17.850 16.121 29.458 13 HG2 GLU 2 2HG GLU 2 18.252 13.775 29.660 14 HG3 GLU 2 3HG GLU 2 19.448 14.524 30.712 15 H CYS 3 H CYS 3 18.444 18.584 29.766 16 HA CYS 3 HA CYS 3 21.287 18.396 29.469 17 HB2 CYS 3 2HB CYS 3 19.268 20.508 28.634 18 HB3 CYS 3 3HB CYS 3 20.986 20.594 28.272 19 H VAL 4 H VAL 4 19.207 20.565 31.426 20 HA VAL 4 HA VAL 4 21.310 22.331 32.286 21 HB VAL 4 HB VAL 4 18.629 21.677 33.531 22 HG11 VAL 4 1HG1 VAL 4 18.857 23.864 34.684 23 HG12 VAL 4 2HG1 VAL 4 20.042 22.682 35.235 24 HG13 VAL 4 3HG1 VAL 4 20.540 23.965 34.117 25 HG21 VAL 4 3HG2 VAL 4 18.456 22.676 31.232 26 HG22 VAL 4 1HG2 VAL 4 17.874 23.791 32.471 27 HG23 VAL 4 2HG2 VAL 4 19.479 24.018 31.752 28 H SER 5 H SER 5 19.881 19.350 33.668 29 HA SER 5 HA SER 5 21.350 19.189 36.073 30 HB2 SER 5 2HB SER 5 19.468 17.695 35.450 31 HB3 SER 5 3HB SER 5 20.494 16.912 34.244 32 HG SER 5 HG SER 5 20.882 16.997 37.052 33 H LYS 6 H LYS 6 22.181 17.965 32.815 34 HA LYS 6 HA LYS 6 24.816 17.011 33.492 35 HB2 LYS 6 2HB LYS 6 23.307 17.510 30.909 36 HB3 LYS 6 3HB LYS 6 24.939 16.852 30.940 37 HG2 LYS 6 2HG LYS 6 22.685 15.522 32.483 38 HG3 LYS 6 3HG LYS 6 22.931 15.218 30.766 39 HD2 LYS 6 2HD LYS 6 25.160 14.843 32.813 40 HD3 LYS 6 3HD LYS 6 23.998 13.566 32.412 41 HE2 LYS 6 2HE LYS 6 24.644 13.631 30.060 42 HE3 LYS 6 3HE LYS 6 25.787 14.958 30.385 43 HZ1 LYS 6 3HZ LYS 6 26.838 12.839 30.276 44 HZ2 LYS 6 1HZ LYS 6 25.951 12.275 31.550 45 HZ3 LYS 6 2HZ LYS 6 27.021 13.513 31.773 46 H GLY 7 H GLY 7 23.761 20.216 33.198 47 HA2 GLY 7 2HA GLY 7 25.027 22.097 33.447 48 HA3 GLY 7 3HA GLY 7 26.495 21.181 33.128 49 H PHE 8 H PHE 8 24.389 20.553 30.561 50 HA PHE 8 HA PHE 8 25.888 22.171 28.690 51 HB2 PHE 8 2HB PHE 8 23.367 20.505 28.337 52 HB3 PHE 8 3HB PHE 8 24.329 21.181 27.034 53 HD1 PHE 8 HD1 PHE 8 26.981 20.587 27.245 54 HD2 PHE 8 HD2 PHE 8 23.691 18.218 28.695 55 HE1 PHE 8 HE1 PHE 8 28.396 18.527 27.117 56 HE2 PHE 8 HE2 PHE 8 25.089 16.179 28.539 57 HZ PHE 8 HZ PHE 8 27.435 16.335 27.757 58 H GLY 9 H GLY 9 24.813 23.470 27.054 59 HA2 GLY 9 2HA GLY 9 22.959 25.481 28.190 60 HA3 GLY 9 3HA GLY 9 24.039 25.677 26.805 61 H CYS 10 H CYS 10 22.234 26.514 25.661 62 HA CYS 10 HA CYS 10 20.570 24.468 24.349 63 HB2 CYS 10 2HB CYS 10 19.423 25.486 26.444 64 HB3 CYS 10 3HB CYS 10 19.256 26.942 25.454 65 H LEU 11 H LEU 11 20.925 24.837 22.239 66 HA LEU 11 HA LEU 11 21.659 27.552 21.245 67 HB2 LEU 11 2HB LEU 11 22.443 24.739 20.479 68 HB3 LEU 11 3HB LEU 11 22.586 26.034 19.320 69 HG LEU 11 HG LEU 11 24.071 27.265 20.730 70 HD11 LEU 11 1HD1 LEU 11 23.940 24.946 22.677 71 HD12 LEU 11 2HD1 LEU 11 23.596 26.665 22.962 72 HD13 LEU 11 3HD1 LEU 11 25.241 26.145 22.631 73 HD21 LEU 11 3HD2 LEU 11 24.903 25.643 19.038 74 HD22 LEU 11 1HD2 LEU 11 25.055 24.429 20.318 75 HD23 LEU 11 2HD2 LEU 11 26.028 25.899 20.380 76 HA PRO 12 HA PRO 12 18.064 27.430 18.637 77 HB2 PRO 12 3HB PRO 12 18.617 29.610 18.059 78 HB3 PRO 12 2HB PRO 12 18.787 28.879 16.436 79 HG2 PRO 12 2HG PRO 12 21.141 28.620 16.720 80 HG3 PRO 12 3HG PRO 12 20.867 30.210 17.500 81 HD2 PRO 12 2HD PRO 12 22.071 28.140 18.812 82 HD3 PRO 12 3HD PRO 12 20.960 29.246 19.666 83 H GLN 13 H GLN 13 17.270 26.816 16.457 84 HA GLN 13 HA GLN 13 18.060 24.156 15.851 85 HB2 GLN 13 2HB GLN 13 16.140 26.060 14.440 86 HB3 GLN 13 3HB GLN 13 16.238 24.321 14.151 87 HG2 GLN 13 2HG GLN 13 15.584 23.847 16.476 88 HG3 GLN 13 3HG GLN 13 15.520 25.575 16.844 89 HE21 GLN 13 2HE2 GLN 13 12.239 25.967 15.615 90 HE22 GLN 13 1HE2 GLN 13 13.594 26.666 16.474 91 H SER 14 H SER 14 19.438 27.042 14.677 92 HA SER 14 HA SER 14 20.233 25.875 12.074 93 HB2 SER 14 2HB SER 14 20.792 28.196 11.490 94 HB3 SER 14 3HB SER 14 19.096 28.006 11.949 95 HG SER 14 HG SER 14 21.182 29.020 13.618 96 H ASP 15 H ASP 15 21.600 26.989 15.174 97 HA ASP 15 HA ASP 15 24.322 27.105 14.054 98 HB2 ASP 15 2HB ASP 15 23.194 27.696 16.820 99 HB3 ASP 15 3HB ASP 15 24.895 27.768 16.409 100 H CYS 16 H CYS 16 22.379 24.871 15.934 101 HA CYS 16 HA CYS 16 24.625 23.289 16.879 102 HB2 CYS 16 2HB CYS 16 22.574 23.621 18.212 103 HB3 CYS 16 3HB CYS 16 21.631 22.797 16.974 104 HA PRO 17 HA PRO 17 24.228 20.981 12.894 105 HB2 PRO 17 3HB PRO 17 26.496 21.279 12.532 106 HB3 PRO 17 2HB PRO 17 26.570 19.560 13.003 107 HG2 PRO 17 2HG PRO 17 27.123 20.112 15.255 108 HG3 PRO 17 3HG PRO 17 28.040 21.361 14.357 109 HD2 PRO 17 2HD PRO 17 26.220 22.048 16.289 110 HD3 PRO 17 3HD PRO 17 26.415 23.017 14.804 111 H GLN 18 H GLN 18 24.187 18.618 12.398 112 HA GLN 18 HA GLN 18 22.608 17.200 14.302 113 HB2 GLN 18 2HB GLN 18 23.865 16.356 11.661 114 HB3 GLN 18 3HB GLN 18 22.692 15.393 12.570 115 HG2 GLN 18 2HG GLN 18 21.018 17.187 12.377 116 HG3 GLN 18 3HG GLN 18 22.163 18.180 11.465 117 HE21 GLN 18 2HE2 GLN 18 20.335 16.853 8.679 118 HE22 GLN 18 1HE2 GLN 18 20.456 18.209 9.780 119 H GLU 19 H GLU 19 25.993 17.458 14.135 120 HA GLU 19 HA GLU 19 26.559 14.808 15.321 121 HB2 GLU 19 2HB GLU 19 28.328 17.180 14.627 122 HB3 GLU 19 3HB GLU 19 28.912 15.621 15.210 123 HG2 GLU 19 2HG GLU 19 27.391 15.988 12.583 124 HG3 GLU 19 3HG GLU 19 29.141 16.010 12.739 125 H ALA 20 H ALA 20 26.143 18.188 16.252 126 HA ALA 20 HA ALA 20 27.292 17.773 18.943 127 HB1 ALA 20 1HB ALA 20 27.126 20.218 19.088 128 HB2 ALA 20 2HB ALA 20 27.942 19.742 17.590 129 HB3 ALA 20 3HB ALA 20 26.236 20.256 17.560 130 H ARG 21 H ARG 21 24.141 17.791 17.451 131 HA ARG 21 HA ARG 21 22.554 18.703 19.624 132 HB2 ARG 21 2HB ARG 21 20.717 17.536 18.535 133 HB3 ARG 21 3HB ARG 21 21.682 18.395 17.331 134 HG2 ARG 21 2HG ARG 21 22.771 16.317 16.674 135 HG3 ARG 21 3HG ARG 21 21.827 15.411 17.869 136 HD2 ARG 21 2HD ARG 21 19.739 15.955 16.746 137 HD3 ARG 21 3HD ARG 21 20.549 17.095 15.680 138 HE ARG 21 HE ARG 21 21.234 15.454 14.326 139 HH11 ARG 21 1HH1 ARG 21 20.238 13.838 17.333 140 HH12 ARG 21 2HH1 ARG 21 20.441 12.242 16.643 141 HH21 ARG 21 2HH2 ARG 21 21.079 11.974 14.519 142 HH22 ARG 21 1HH2 ARG 21 21.379 13.339 13.472 143 H LEU 22 H LEU 22 21.717 17.714 21.433 144 HA LEU 22 HA LEU 22 22.979 15.155 22.218 145 HB2 LEU 22 2HB LEU 22 21.504 17.329 23.732 146 HB3 LEU 22 3HB LEU 22 21.966 15.795 24.461 147 HG LEU 22 HG LEU 22 23.980 17.726 23.220 148 HD11 LEU 22 1HD1 LEU 22 23.178 17.262 26.115 149 HD12 LEU 22 2HD1 LEU 22 22.872 18.728 25.155 150 HD13 LEU 22 3HD1 LEU 22 24.532 18.274 25.554 151 HD21 LEU 22 3HD2 LEU 22 25.609 16.364 24.583 152 HD22 LEU 22 1HD2 LEU 22 24.871 15.441 23.276 153 HD23 LEU 22 2HD2 LEU 22 24.304 15.224 24.945 154 H SER 23 H SER 23 21.762 13.584 23.302 155 HA SER 23 HA SER 23 19.472 12.760 21.730 156 HB2 SER 23 2HB SER 23 21.453 11.349 22.410 157 HB3 SER 23 3HB SER 23 20.803 11.339 24.060 158 HG SER 23 HG SER 23 18.849 10.470 23.077 159 H TYR 24 H TYR 24 19.368 14.907 24.138 160 HA TYR 24 HA TYR 24 17.273 13.626 25.802 161 HB2 TYR 24 2HB TYR 24 18.977 16.040 26.420 162 HB3 TYR 24 3HB TYR 24 18.003 15.083 27.526 163 HD1 TYR 24 HD1 TYR 24 18.663 12.396 27.413 164 HD2 TYR 24 HD2 TYR 24 21.273 15.743 26.642 165 HE1 TYR 24 HE1 TYR 24 20.633 10.983 27.950 166 HE2 TYR 24 HE2 TYR 24 23.242 14.334 27.155 167 HH TYR 24 HH TYR 24 22.913 10.905 28.165 168 H GLY 25 H GLY 25 15.768 15.133 26.847 169 HA2 GLY 25 2HA GLY 25 14.553 17.089 24.956 170 HA3 GLY 25 3HA GLY 25 13.709 16.156 26.194 171 H GLY 26 H GLY 26 16.798 17.830 26.748 172 HA2 GLY 26 2HA GLY 26 15.816 19.065 29.157 173 HA3 GLY 26 3HA GLY 26 17.427 19.172 28.465 174 H CYS 27 H CYS 27 15.425 20.190 26.031 175 HA CYS 27 HA CYS 27 15.181 23.026 26.901 176 HB2 CYS 27 2HB CYS 27 16.241 21.886 24.309 177 HB3 CYS 27 3HB CYS 27 15.660 23.533 24.446 178 H SER 28 H SER 28 13.808 24.028 24.782 179 HA SER 28 HA SER 28 11.207 22.623 25.003 180 HB2 SER 28 2HB SER 28 11.553 24.909 26.043 181 HB3 SER 28 3HB SER 28 11.714 25.550 24.405 182 HG SER 28 HG SER 28 9.616 24.531 24.016 183 H THR 29 H THR 29 13.634 23.070 22.704 184 HA THR 29 HA THR 29 11.792 22.130 20.638 185 HB THR 29 HB THR 29 11.649 24.429 20.127 186 HG1 THR 29 1HG THR 29 11.998 22.833 18.458 187 HG21 THR 29 1HG2 THR 29 13.455 25.877 19.513 188 HG22 THR 29 2HG2 THR 29 14.663 24.620 19.821 189 HG23 THR 29 3HG2 THR 29 13.729 25.314 21.169 190 H VAL 30 H VAL 30 15.240 23.035 21.228 191 HA VAL 30 HA VAL 30 16.056 20.299 20.693 192 HB VAL 30 HB VAL 30 17.890 20.933 19.190 193 HG11 VAL 30 1HG1 VAL 30 15.786 20.016 18.233 194 HG12 VAL 30 2HG1 VAL 30 15.221 21.673 17.935 195 HG13 VAL 30 3HG1 VAL 30 16.659 21.063 17.108 196 HG21 VAL 30 3HG2 VAL 30 18.141 23.312 19.656 197 HG22 VAL 30 1HG2 VAL 30 17.919 23.017 17.935 198 HG23 VAL 30 2HG2 VAL 30 16.572 23.653 18.896 199 H CYS 31 H CYS 31 18.092 19.836 21.620 200 HA CYS 31 HA CYS 31 19.337 21.967 23.289 201 HB2 CYS 31 2HB CYS 31 18.111 20.410 24.721 202 HB3 CYS 31 3HB CYS 31 18.923 19.036 23.957 203 H CYS 32 H CYS 32 21.542 22.021 23.324 204 HA CYS 32 HA CYS 32 23.067 20.145 21.614 205 HB2 CYS 32 2HB CYS 32 22.307 22.547 20.621 206 HB3 CYS 32 3HB CYS 32 23.710 23.086 21.521 207 H ASP 33 H ASP 33 25.251 19.923 22.213 208 HA ASP 33 HA ASP 33 25.783 20.321 25.010 209 HB2 ASP 33 2HB ASP 33 27.533 18.865 24.693 210 HB3 ASP 33 3HB ASP 33 26.390 18.332 23.481 211 H LEU 34 H LEU 34 28.116 21.073 25.596 212 HA LEU 34 HA LEU 34 28.923 23.543 24.144 213 HB2 LEU 34 2HB LEU 34 28.853 23.070 27.142 214 HB3 LEU 34 3HB LEU 34 29.508 24.501 26.355 215 HG LEU 34 HG LEU 34 26.594 23.631 26.265 216 HD11 LEU 34 1HD1 LEU 34 28.022 25.812 27.847 217 HD12 LEU 34 2HD1 LEU 34 27.284 24.337 28.502 218 HD13 LEU 34 3HD1 LEU 34 26.270 25.592 27.776 219 HD21 LEU 34 3HD2 LEU 34 27.920 26.213 25.300 220 HD22 LEU 34 1HD2 LEU 34 26.175 25.907 25.355 221 HD23 LEU 34 2HD2 LEU 34 27.194 24.979 24.259 222 H SER 35 H SER 35 29.878 20.461 24.601 223 HA SER 35 HA SER 35 32.394 20.665 25.875 224 HB2 SER 35 2HB SER 35 30.901 18.611 25.486 225 HB3 SER 35 3HB SER 35 31.611 18.540 23.864 226 HG SER 35 HG SER 35 33.677 18.442 24.910 227 H LYS 36 H LYS 36 31.507 21.484 22.577 228 HA LYS 36 HA LYS 36 34.096 21.128 21.357 229 HB2 LYS 36 2HB LYS 36 31.785 22.965 20.609 230 HB3 LYS 36 3HB LYS 36 33.210 22.634 19.608 231 HG2 LYS 36 2HG LYS 36 32.625 20.198 19.632 232 HG3 LYS 36 3HG LYS 36 31.122 20.584 20.470 233 HD2 LYS 36 2HD LYS 36 31.923 21.650 17.722 234 HD3 LYS 36 3HD LYS 36 30.842 20.277 18.013 235 HE2 LYS 36 2HE LYS 36 29.269 21.759 19.224 236 HE3 LYS 36 3HE LYS 36 30.347 23.137 18.935 237 HZ1 LYS 36 3HZ LYS 36 30.031 22.779 16.577 238 HZ2 LYS 36 1HZ LYS 36 28.600 23.074 17.341 239 HZ3 LYS 36 2HZ LYS 36 28.993 21.540 16.879 240 H LEU 37 H LEU 37 32.727 23.660 23.386 241 HA LEU 37 HA LEU 37 34.684 25.700 22.763 242 HB2 LEU 37 2HB LEU 37 32.800 25.324 25.118 243 HB3 LEU 37 3HB LEU 37 33.769 26.763 24.851 244 HG LEU 37 HG LEU 37 31.752 25.762 22.806 245 HD11 LEU 37 1HD1 LEU 37 31.297 27.788 25.032 246 HD12 LEU 37 2HD1 LEU 37 30.559 26.186 24.913 247 HD13 LEU 37 3HD1 LEU 37 30.170 27.425 23.723 248 HD21 LEU 37 3HD2 LEU 37 33.432 27.381 21.943 249 HD22 LEU 37 1HD2 LEU 37 33.022 28.492 23.254 250 HD23 LEU 37 2HD2 LEU 37 31.822 28.091 22.014 251 H THR 38 H THR 38 34.387 23.147 25.303 252 HA THR 38 HA THR 38 36.873 23.894 26.598 253 HB THR 38 HB THR 38 36.434 21.798 27.881 254 HG1 THR 38 1HG THR 38 35.211 20.730 26.277 255 HG21 THR 38 1HG2 THR 38 34.521 22.638 29.125 256 HG22 THR 38 2HG2 THR 38 34.097 23.738 27.792 257 HG23 THR 38 3HG2 THR 38 35.617 23.966 28.695 258 H GLY 39 H GLY 39 36.133 22.055 23.766 259 HA2 GLY 39 2HA GLY 39 38.819 21.428 23.172 260 HA3 GLY 39 3HA GLY 39 38.083 20.000 23.908 Start of MODEL 2 1 H1 ASN 1 H1 ASN 1 15.493 26.101 33.090 2 H2 ASN 1 H2 ASN 1 15.310 24.696 33.931 3 H3 ASN 1 H3 ASN 1 16.803 25.385 33.800 4 HA ASN 1 HA ASN 1 15.213 24.280 31.601 5 HB2 ASN 1 2HB ASN 1 16.829 26.288 31.173 6 HB3 ASN 1 3HB ASN 1 18.111 25.108 31.432 7 HD21 ASN 1 2HD2 ASN 1 16.622 25.423 27.800 8 HD22 ASN 1 1HD2 ASN 1 16.624 26.642 29.063 9 H GLU 2 H GLU 2 15.278 22.131 31.480 10 HA GLU 2 HA GLU 2 16.733 20.562 33.347 11 HB2 GLU 2 2HB GLU 2 14.473 20.223 31.975 12 HB3 GLU 2 3HB GLU 2 15.525 19.382 30.848 13 HG2 GLU 2 2HG GLU 2 15.324 18.742 33.820 14 HG3 GLU 2 3HG GLU 2 14.356 17.964 32.570 15 H CYS 3 H CYS 3 17.365 21.443 29.925 16 HA CYS 3 HA CYS 3 19.454 19.512 29.518 17 HB2 CYS 3 2HB CYS 3 18.084 20.833 27.753 18 HB3 CYS 3 3HB CYS 3 19.257 22.119 28.005 19 H VAL 4 H VAL 4 19.468 22.990 30.454 20 HA VAL 4 HA VAL 4 22.311 23.268 30.493 21 HB VAL 4 HB VAL 4 20.190 24.914 31.930 22 HG11 VAL 4 1HG1 VAL 4 23.056 25.619 31.199 23 HG12 VAL 4 2HG1 VAL 4 21.838 26.783 31.761 24 HG13 VAL 4 3HG1 VAL 4 22.365 25.490 32.833 25 HG21 VAL 4 3HG2 VAL 4 19.778 24.834 29.462 26 HG22 VAL 4 1HG2 VAL 4 20.311 26.437 29.968 27 HG23 VAL 4 2HG2 VAL 4 21.453 25.332 29.177 28 H SER 5 H SER 5 20.036 21.981 32.829 29 HA SER 5 HA SER 5 21.579 22.091 35.176 30 HB2 SER 5 2HB SER 5 19.188 21.344 34.951 31 HB3 SER 5 3HB SER 5 19.789 19.783 34.342 32 HG SER 5 HG SER 5 19.370 19.864 36.624 33 H LYS 6 H LYS 6 21.904 19.843 32.415 34 HA LYS 6 HA LYS 6 23.989 18.208 33.654 35 HB2 LYS 6 2HB LYS 6 22.728 18.424 30.910 36 HB3 LYS 6 3HB LYS 6 24.150 17.428 31.154 37 HG2 LYS 6 2HG LYS 6 21.611 17.096 32.798 38 HG3 LYS 6 3HG LYS 6 21.863 16.289 31.254 39 HD2 LYS 6 2HD LYS 6 23.732 15.917 33.638 40 HD3 LYS 6 3HD LYS 6 22.368 14.866 33.243 41 HE2 LYS 6 2HE LYS 6 23.357 14.479 30.966 42 HE3 LYS 6 3HE LYS 6 24.791 15.387 31.473 43 HZ1 LYS 6 3HZ LYS 6 23.781 12.923 32.716 44 HZ2 LYS 6 1HZ LYS 6 25.097 13.777 33.232 45 HZ3 LYS 6 2HZ LYS 6 25.109 13.052 31.750 46 H GLY 7 H GLY 7 23.974 21.319 32.241 47 HA2 GLY 7 2HA GLY 7 25.921 22.661 32.405 48 HA3 GLY 7 3HA GLY 7 26.930 21.299 31.931 49 H PHE 8 H PHE 8 24.322 21.149 29.853 50 HA PHE 8 HA PHE 8 25.748 22.245 27.589 51 HB2 PHE 8 2HB PHE 8 22.925 21.171 27.918 52 HB3 PHE 8 3HB PHE 8 23.678 21.539 26.381 53 HD1 PHE 8 HD1 PHE 8 23.113 18.952 28.738 54 HD2 PHE 8 HD2 PHE 8 25.982 20.370 25.859 55 HE1 PHE 8 HE1 PHE 8 24.078 16.674 28.583 56 HE2 PHE 8 HE2 PHE 8 26.949 18.094 25.703 57 HZ PHE 8 HZ PHE 8 25.998 16.238 27.059 58 H GLY 9 H GLY 9 24.154 23.533 25.981 59 HA2 GLY 9 2HA GLY 9 22.893 25.841 27.386 60 HA3 GLY 9 3HA GLY 9 24.044 26.099 26.073 61 H CYS 10 H CYS 10 21.589 27.137 25.773 62 HA CYS 10 HA CYS 10 19.883 25.164 24.311 63 HB2 CYS 10 2HB CYS 10 19.354 25.855 26.716 64 HB3 CYS 10 3HB CYS 10 18.943 27.434 26.069 65 H LEU 11 H LEU 11 21.215 26.090 22.430 66 HA LEU 11 HA LEU 11 20.635 28.758 21.542 67 HB2 LEU 11 2HB LEU 11 21.871 26.306 20.298 68 HB3 LEU 11 3HB LEU 11 21.528 27.676 19.287 69 HG LEU 11 HG LEU 11 23.214 27.824 21.764 70 HD11 LEU 11 1HD1 LEU 11 25.201 27.818 20.355 71 HD12 LEU 11 2HD1 LEU 11 24.190 27.590 18.916 72 HD13 LEU 11 3HD1 LEU 11 24.266 26.329 20.154 73 HD21 LEU 11 3HD2 LEU 11 24.099 29.951 20.834 74 HD22 LEU 11 1HD2 LEU 11 22.413 30.015 21.323 75 HD23 LEU 11 2HD2 LEU 11 22.831 29.892 19.620 76 HA PRO 12 HA PRO 12 16.807 28.044 19.283 77 HB2 PRO 12 3HB PRO 12 16.739 30.366 19.127 78 HB3 PRO 12 2HB PRO 12 16.963 30.016 17.387 79 HG2 PRO 12 2HG PRO 12 19.321 30.375 17.536 80 HG3 PRO 12 3HG PRO 12 18.705 31.647 18.639 81 HD2 PRO 12 2HD PRO 12 20.507 29.774 19.473 82 HD3 PRO 12 3HD PRO 12 19.240 30.367 20.559 83 H GLN 13 H GLN 13 16.057 27.733 16.924 84 HA GLN 13 HA GLN 13 17.355 25.549 15.710 85 HB2 GLN 13 2HB GLN 13 15.318 27.558 14.668 86 HB3 GLN 13 3HB GLN 13 15.812 26.141 13.747 87 HG2 GLN 13 2HG GLN 13 14.680 25.850 16.559 88 HG3 GLN 13 3HG GLN 13 13.643 26.042 15.151 89 HE21 GLN 13 2HE2 GLN 13 13.605 22.533 14.869 90 HE22 GLN 13 1HE2 GLN 13 12.694 23.997 15.155 91 H SER 14 H SER 14 17.594 29.036 14.950 92 HA SER 14 HA SER 14 19.054 28.790 12.525 93 HB2 SER 14 2HB SER 14 19.478 31.197 12.843 94 HB3 SER 14 3HB SER 14 17.784 30.783 13.139 95 HG SER 14 HG SER 14 19.790 31.223 15.114 96 H ASP 15 H ASP 15 20.132 28.365 15.793 97 HA ASP 15 HA ASP 15 22.997 28.802 15.076 98 HB2 ASP 15 2HB ASP 15 21.462 29.099 17.673 99 HB3 ASP 15 3HB ASP 15 23.197 29.047 17.617 100 H CYS 16 H CYS 16 20.670 26.405 15.863 101 HA CYS 16 HA CYS 16 22.767 24.478 16.706 102 HB2 CYS 16 2HB CYS 16 21.167 25.157 18.484 103 HB3 CYS 16 3HB CYS 16 19.855 24.492 17.513 104 HA PRO 17 HA PRO 17 21.061 22.866 12.716 105 HB2 PRO 17 3HB PRO 17 23.050 23.483 11.660 106 HB3 PRO 17 2HB PRO 17 23.346 21.723 11.770 107 HG2 PRO 17 2HG PRO 17 24.618 21.995 13.799 108 HG3 PRO 17 3HG PRO 17 25.152 23.405 12.834 109 HD2 PRO 17 2HD PRO 17 24.111 23.701 15.313 110 HD3 PRO 17 3HD PRO 17 23.721 24.875 14.018 111 H GLN 18 H GLN 18 20.940 20.564 11.996 112 HA GLN 18 HA GLN 18 20.043 18.957 14.024 113 HB2 GLN 18 2HB GLN 18 20.956 18.004 11.281 114 HB3 GLN 18 3HB GLN 18 19.833 17.195 12.363 115 HG2 GLN 18 2HG GLN 18 18.373 18.188 10.895 116 HG3 GLN 18 3HG GLN 18 18.408 19.372 12.200 117 HE21 GLN 18 2HE2 GLN 18 20.171 20.248 8.520 118 HE22 GLN 18 1HE2 GLN 18 19.950 18.577 9.020 119 H GLU 19 H GLU 19 23.314 18.955 12.621 120 HA GLU 19 HA GLU 19 24.273 16.499 13.705 121 HB2 GLU 19 2HB GLU 19 25.764 19.073 13.014 122 HB3 GLU 19 3HB GLU 19 26.499 17.493 13.304 123 HG2 GLU 19 2HG GLU 19 25.198 16.582 11.356 124 HG3 GLU 19 3HG GLU 19 24.654 18.231 10.996 125 H ALA 20 H ALA 20 23.966 19.759 15.070 126 HA ALA 20 HA ALA 20 25.730 19.208 17.338 127 HB1 ALA 20 1HB ALA 20 24.140 21.675 16.558 128 HB2 ALA 20 2HB ALA 20 25.449 21.577 17.765 129 HB3 ALA 20 3HB ALA 20 25.801 21.324 16.048 130 H ARG 21 H ARG 21 22.385 18.781 16.698 131 HA ARG 21 HA ARG 21 21.262 19.258 19.318 132 HB2 ARG 21 2HB ARG 21 20.429 17.268 17.179 133 HB3 ARG 21 3HB ARG 21 19.473 17.761 18.578 134 HG2 ARG 21 2HG ARG 21 19.490 20.137 17.695 135 HG3 ARG 21 3HG ARG 21 20.325 19.549 16.260 136 HD2 ARG 21 2HD ARG 21 17.548 18.758 17.194 137 HD3 ARG 21 3HD ARG 21 17.959 19.801 15.815 138 HE ARG 21 HE ARG 21 19.198 17.247 15.499 139 HH11 ARG 21 1HH1 ARG 21 15.958 18.723 15.323 140 HH12 ARG 21 2HH1 ARG 21 15.413 17.573 14.114 141 HH21 ARG 21 2HH2 ARG 21 16.746 15.938 13.382 142 HH22 ARG 21 1HH2 ARG 21 18.384 15.756 13.981 143 H LEU 22 H LEU 22 21.022 17.850 21.081 144 HA LEU 22 HA LEU 22 22.908 15.639 21.280 145 HB2 LEU 22 2HB LEU 22 20.937 17.035 23.114 146 HB3 LEU 22 3HB LEU 22 21.767 15.573 23.643 147 HG LEU 22 HG LEU 22 23.351 17.892 22.492 148 HD11 LEU 22 1HD1 LEU 22 22.605 17.575 25.408 149 HD12 LEU 22 2HD1 LEU 22 21.981 18.826 24.307 150 HD13 LEU 22 3HD1 LEU 22 23.711 18.776 24.687 151 HD21 LEU 22 3HD2 LEU 22 24.539 15.730 22.796 152 HD22 LEU 22 1HD2 LEU 22 24.021 15.682 24.493 153 HD23 LEU 22 2HD2 LEU 22 25.137 16.934 23.941 154 H SER 23 H SER 23 21.954 13.650 22.528 155 HA SER 23 HA SER 23 20.125 12.314 20.682 156 HB2 SER 23 2HB SER 23 22.140 11.264 21.806 157 HB3 SER 23 3HB SER 23 21.218 11.273 23.321 158 HG SER 23 HG SER 23 21.102 9.310 22.014 159 H TYR 24 H TYR 24 19.626 14.374 23.297 160 HA TYR 24 HA TYR 24 16.814 13.547 23.623 161 HB2 TYR 24 2HB TYR 24 16.884 13.641 25.960 162 HB3 TYR 24 3HB TYR 24 18.300 12.713 25.551 163 HD1 TYR 24 HD1 TYR 24 20.587 14.144 25.345 164 HD2 TYR 24 HD2 TYR 24 17.036 15.470 27.414 165 HE1 TYR 24 HE1 TYR 24 21.956 15.689 26.715 166 HE2 TYR 24 HE2 TYR 24 18.383 17.049 28.726 167 HH TYR 24 HH TYR 24 20.512 17.697 29.309 168 H GLY 25 H GLY 25 15.637 15.404 24.868 169 HA2 GLY 25 2HA GLY 25 16.194 17.964 23.498 170 HA3 GLY 25 3HA GLY 25 14.742 17.494 24.390 171 H GLY 26 H GLY 26 14.675 17.884 26.568 172 HA2 GLY 26 2HA GLY 26 15.355 18.476 28.715 173 HA3 GLY 26 3HA GLY 26 16.960 18.905 28.129 174 H CYS 27 H CYS 27 15.920 20.656 25.923 175 HA CYS 27 HA CYS 27 15.173 23.068 27.455 176 HB2 CYS 27 2HB CYS 27 15.936 22.462 24.603 177 HB3 CYS 27 3HB CYS 27 15.247 24.004 25.030 178 H SER 28 H SER 28 13.485 24.407 25.897 179 HA SER 28 HA SER 28 10.909 23.095 26.338 180 HB2 SER 28 2HB SER 28 11.663 25.807 25.178 181 HB3 SER 28 3HB SER 28 10.014 25.263 25.517 182 HG SER 28 HG SER 28 11.062 26.554 27.168 183 H THR 29 H THR 29 13.105 23.904 23.641 184 HA THR 29 HA THR 29 11.334 22.499 21.735 185 HB THR 29 HB THR 29 11.889 24.189 20.042 186 HG1 THR 29 1HG THR 29 12.674 26.216 20.733 187 HG21 THR 29 1HG2 THR 29 10.343 25.952 20.798 188 HG22 THR 29 2HG2 THR 29 10.559 25.449 22.480 189 HG23 THR 29 3HG2 THR 29 9.750 24.364 21.321 190 H VAL 30 H VAL 30 14.643 23.971 22.113 191 HA VAL 30 HA VAL 30 15.871 21.654 20.770 192 HB VAL 30 HB VAL 30 16.039 24.546 20.076 193 HG11 VAL 30 1HG1 VAL 30 18.282 23.722 19.991 194 HG12 VAL 30 2HG1 VAL 30 17.774 22.267 19.102 195 HG13 VAL 30 3HG1 VAL 30 17.706 23.872 18.332 196 HG21 VAL 30 3HG2 VAL 30 15.199 22.140 18.404 197 HG22 VAL 30 1HG2 VAL 30 14.144 23.471 18.933 198 HG23 VAL 30 2HG2 VAL 30 15.429 23.781 17.774 199 H CYS 31 H CYS 31 17.784 21.166 21.601 200 HA CYS 31 HA CYS 31 19.291 23.099 23.288 201 HB2 CYS 31 2HB CYS 31 18.159 21.271 24.676 202 HB3 CYS 31 3HB CYS 31 19.203 20.113 23.838 203 H CYS 32 H CYS 32 21.589 22.819 23.196 204 HA CYS 32 HA CYS 32 22.646 21.155 20.978 205 HB2 CYS 32 2HB CYS 32 22.429 24.048 21.004 206 HB3 CYS 32 3HB CYS 32 24.131 23.594 21.101 207 H ASP 33 H ASP 33 24.973 20.820 21.104 208 HA ASP 33 HA ASP 33 25.471 20.025 23.818 209 HB2 ASP 33 2HB ASP 33 26.753 18.320 22.951 210 HB3 ASP 33 3HB ASP 33 25.435 18.505 21.807 211 H LEU 34 H LEU 34 25.973 22.676 23.620 212 HA LEU 34 HA LEU 34 28.842 23.173 23.286 213 HB2 LEU 34 2HB LEU 34 28.391 25.471 23.644 214 HB3 LEU 34 3HB LEU 34 27.359 24.793 22.410 215 HG LEU 34 HG LEU 34 26.102 24.822 25.109 216 HD11 LEU 34 1HD1 LEU 34 26.828 27.449 23.757 217 HD12 LEU 34 2HD1 LEU 34 27.418 26.873 25.327 218 HD13 LEU 34 3HD1 LEU 34 25.712 27.271 25.124 219 HD21 LEU 34 3HD2 LEU 34 25.293 25.851 22.350 220 HD22 LEU 34 1HD2 LEU 34 24.240 25.880 23.762 221 HD23 LEU 34 2HD2 LEU 34 24.790 24.331 23.115 222 H SER 35 H SER 35 27.690 21.587 25.635 223 HA SER 35 HA SER 35 28.578 22.723 28.102 224 HB2 SER 35 2HB SER 35 27.325 20.683 28.122 225 HB3 SER 35 3HB SER 35 28.485 19.873 27.051 226 HG SER 35 HG SER 35 29.160 20.850 29.623 227 H LYS 36 H LYS 36 30.382 21.055 25.480 228 HA LYS 36 HA LYS 36 32.890 20.990 26.813 229 HB2 LYS 36 2HB LYS 36 33.807 20.402 24.670 230 HB3 LYS 36 3HB LYS 36 32.306 19.530 24.935 231 HG2 LYS 36 2HG LYS 36 31.094 21.114 23.448 232 HG3 LYS 36 3HG LYS 36 32.584 22.022 23.172 233 HD2 LYS 36 2HD LYS 36 32.201 19.095 22.444 234 HD3 LYS 36 3HD LYS 36 32.007 20.455 21.333 235 HE2 LYS 36 2HE LYS 36 34.374 21.145 21.759 236 HE3 LYS 36 3HE LYS 36 34.571 19.760 22.834 237 HZ1 LYS 36 3HZ LYS 36 35.410 19.269 20.660 238 HZ2 LYS 36 1HZ LYS 36 33.965 19.638 19.956 239 HZ3 LYS 36 2HZ LYS 36 34.087 18.330 20.953 240 H LEU 37 H LEU 37 31.266 23.668 25.280 241 HA LEU 37 HA LEU 37 33.738 25.260 24.983 242 HB2 LEU 37 2HB LEU 37 30.798 25.829 24.416 243 HB3 LEU 37 3HB LEU 37 32.075 27.022 24.226 244 HG LEU 37 HG LEU 37 32.059 24.354 22.731 245 HD11 LEU 37 1HD1 LEU 37 31.103 27.092 21.809 246 HD12 LEU 37 2HD1 LEU 37 30.097 25.648 22.063 247 HD13 LEU 37 3HD1 LEU 37 31.299 25.664 20.768 248 HD21 LEU 37 3HD2 LEU 37 33.649 26.937 22.322 249 HD22 LEU 37 1HD2 LEU 37 33.675 25.533 21.235 250 HD23 LEU 37 2HD2 LEU 37 34.301 25.375 22.879 251 H THR 38 H THR 38 30.654 25.350 26.904 252 HA THR 38 HA THR 38 31.311 27.565 28.436 253 HB THR 38 HB THR 38 29.476 25.302 29.323 254 HG1 THR 38 1HG THR 38 28.890 25.624 27.206 255 HG21 THR 38 1HG2 THR 38 29.322 28.343 29.417 256 HG22 THR 38 2HG2 THR 38 29.700 27.281 30.798 257 HG23 THR 38 3HG2 THR 38 28.088 27.232 30.056 258 H GLY 39 H GLY 39 32.233 24.188 28.835 259 HA2 GLY 39 2HA GLY 39 33.773 23.171 30.144 260 HA3 GLY 39 3HA GLY 39 34.356 24.772 30.593 Start of MODEL 3 1 H1 ASN 1 H1 ASN 1 15.766 23.214 33.930 2 H2 ASN 1 H2 ASN 1 14.474 23.414 32.929 3 H3 ASN 1 H3 ASN 1 14.900 21.904 33.436 4 HA ASN 1 HA ASN 1 15.551 22.272 31.160 5 HB2 ASN 1 2HB ASN 1 17.284 24.442 32.385 6 HB3 ASN 1 3HB ASN 1 17.428 23.828 30.729 7 HD21 ASN 1 2HD2 ASN 1 15.453 27.025 30.764 8 HD22 ASN 1 1HD2 ASN 1 16.999 26.565 31.423 9 H GLU 2 H GLU 2 16.298 20.270 31.157 10 HA GLU 2 HA GLU 2 18.289 19.194 32.891 11 HB2 GLU 2 2HB GLU 2 16.494 17.940 31.713 12 HB3 GLU 2 3HB GLU 2 17.255 18.274 30.177 13 HG2 GLU 2 2HG GLU 2 17.768 15.992 30.932 14 HG3 GLU 2 3HG GLU 2 19.219 16.963 30.761 15 H CYS 3 H CYS 3 18.373 20.562 29.634 16 HA CYS 3 HA CYS 3 21.050 19.904 28.935 17 HB2 CYS 3 2HB CYS 3 19.098 20.876 27.500 18 HB3 CYS 3 3HB CYS 3 19.682 22.438 28.054 19 H VAL 4 H VAL 4 19.701 22.782 30.581 20 HA VAL 4 HA VAL 4 22.191 24.173 30.867 21 HB VAL 4 HB VAL 4 19.538 24.503 32.310 22 HG11 VAL 4 1HG1 VAL 4 21.280 25.617 33.603 23 HG12 VAL 4 2HG1 VAL 4 21.930 26.381 32.136 24 HG13 VAL 4 3HG1 VAL 4 20.328 26.836 32.757 25 HG21 VAL 4 3HG2 VAL 4 19.360 24.833 29.829 26 HG22 VAL 4 1HG2 VAL 4 19.105 26.331 30.720 27 HG23 VAL 4 2HG2 VAL 4 20.663 26.032 29.915 28 H SER 5 H SER 5 20.386 21.899 33.018 29 HA SER 5 HA SER 5 21.974 22.423 35.329 30 HB2 SER 5 2HB SER 5 20.938 20.498 36.303 31 HB3 SER 5 3HB SER 5 19.714 21.380 35.374 32 HG SER 5 HG SER 5 19.642 19.117 35.055 33 H LYS 6 H LYS 6 22.378 20.202 32.635 34 HA LYS 6 HA LYS 6 24.709 18.806 33.644 35 HB2 LYS 6 2HB LYS 6 23.331 19.103 30.959 36 HB3 LYS 6 3HB LYS 6 24.846 18.221 31.104 37 HG2 LYS 6 2HG LYS 6 22.365 17.516 32.728 38 HG3 LYS 6 3HG LYS 6 22.768 16.815 31.157 39 HD2 LYS 6 2HD LYS 6 24.996 16.098 32.105 40 HD3 LYS 6 3HD LYS 6 24.433 16.593 33.704 41 HE2 LYS 6 2HE LYS 6 23.038 14.543 31.931 42 HE3 LYS 6 3HE LYS 6 24.211 14.144 33.198 43 HZ1 LYS 6 3HZ LYS 6 21.996 13.951 34.009 44 HZ2 LYS 6 1HZ LYS 6 21.646 15.513 33.618 45 HZ3 LYS 6 2HZ LYS 6 22.765 15.186 34.790 46 H GLY 7 H GLY 7 24.401 22.035 32.747 47 HA2 GLY 7 2HA GLY 7 26.132 23.550 32.935 48 HA3 GLY 7 3HA GLY 7 27.319 22.305 32.554 49 H PHE 8 H PHE 8 25.040 21.923 30.183 50 HA PHE 8 HA PHE 8 26.527 23.434 28.172 51 HB2 PHE 8 2HB PHE 8 24.001 21.761 27.910 52 HB3 PHE 8 3HB PHE 8 25.020 22.324 26.603 53 HD1 PHE 8 HD1 PHE 8 24.470 19.679 28.968 54 HD2 PHE 8 HD2 PHE 8 27.441 21.543 26.498 55 HE1 PHE 8 HE1 PHE 8 25.800 17.566 28.989 56 HE2 PHE 8 HE2 PHE 8 28.766 19.425 26.491 57 HZ PHE 8 HZ PHE 8 27.938 17.440 27.741 58 H GLY 9 H GLY 9 24.765 24.298 26.427 59 HA2 GLY 9 2HA GLY 9 22.792 26.102 27.746 60 HA3 GLY 9 3HA GLY 9 23.887 26.709 26.495 61 H CYS 10 H CYS 10 21.541 27.175 25.751 62 HA CYS 10 HA CYS 10 20.744 25.103 23.778 63 HB2 CYS 10 2HB CYS 10 18.889 26.564 25.684 64 HB3 CYS 10 3HB CYS 10 18.359 25.687 24.237 65 H LEU 11 H LEU 11 21.894 26.233 22.277 66 HA LEU 11 HA LEU 11 21.793 28.992 21.710 67 HB2 LEU 11 2HB LEU 11 22.480 26.469 20.156 68 HB3 LEU 11 3HB LEU 11 22.445 27.989 19.317 69 HG LEU 11 HG LEU 11 24.657 27.579 19.811 70 HD11 LEU 11 1HD1 LEU 11 24.023 29.929 20.180 71 HD12 LEU 11 2HD1 LEU 11 25.430 29.437 21.128 72 HD13 LEU 11 3HD1 LEU 11 23.860 29.607 21.925 73 HD21 LEU 11 3HD2 LEU 11 24.032 27.224 22.776 74 HD22 LEU 11 1HD2 LEU 11 25.615 27.066 21.990 75 HD23 LEU 11 2HD2 LEU 11 24.338 25.894 21.632 76 HA PRO 12 HA PRO 12 17.970 29.515 19.566 77 HB2 PRO 12 3HB PRO 12 18.527 31.750 19.385 78 HB3 PRO 12 2HB PRO 12 18.486 31.376 17.632 79 HG2 PRO 12 2HG PRO 12 20.829 31.113 17.542 80 HG3 PRO 12 3HG PRO 12 20.715 32.439 18.742 81 HD2 PRO 12 2HD PRO 12 21.992 30.061 19.234 82 HD3 PRO 12 3HD PRO 12 21.179 30.961 20.530 83 H GLN 13 H GLN 13 16.847 29.297 17.506 84 HA GLN 13 HA GLN 13 17.556 26.828 16.245 85 HB2 GLN 13 2HB GLN 13 15.265 28.792 15.798 86 HB3 GLN 13 3HB GLN 13 15.395 27.208 15.037 87 HG2 GLN 13 2HG GLN 13 13.984 26.835 16.865 88 HG3 GLN 13 3HG GLN 13 15.549 26.170 17.335 89 HE21 GLN 13 2HE2 GLN 13 14.120 29.580 19.240 90 HE22 GLN 13 1HE2 GLN 13 13.593 29.226 17.603 91 H SER 14 H SER 14 18.845 29.703 15.593 92 HA SER 14 HA SER 14 19.131 29.289 12.651 93 HB2 SER 14 2HB SER 14 19.599 31.697 12.525 94 HB3 SER 14 3HB SER 14 18.001 31.372 13.214 95 HG SER 14 HG SER 14 20.362 31.960 14.701 96 H ASP 15 H ASP 15 20.852 28.821 15.531 97 HA ASP 15 HA ASP 15 23.472 29.166 14.136 98 HB2 ASP 15 2HB ASP 15 22.746 30.044 16.950 99 HB3 ASP 15 3HB ASP 15 24.390 29.920 16.353 100 H CYS 16 H CYS 16 21.576 27.249 16.441 101 HA CYS 16 HA CYS 16 23.537 25.560 17.508 102 HB2 CYS 16 2HB CYS 16 21.342 25.701 18.404 103 HB3 CYS 16 3HB CYS 16 20.593 25.295 16.881 104 HA PRO 17 HA PRO 17 24.393 23.621 13.444 105 HB2 PRO 17 3HB PRO 17 26.612 24.273 13.755 106 HB3 PRO 17 2HB PRO 17 26.813 22.504 13.943 107 HG2 PRO 17 2HG PRO 17 26.750 22.661 16.307 108 HG3 PRO 17 3HG PRO 17 27.646 24.159 15.914 109 HD2 PRO 17 2HD PRO 17 25.318 24.168 17.381 110 HD3 PRO 17 3HD PRO 17 25.774 25.496 16.292 111 H GLN 18 H GLN 18 24.418 21.450 12.631 112 HA GLN 18 HA GLN 18 22.977 19.569 14.230 113 HB2 GLN 18 2HB GLN 18 24.360 19.230 11.542 114 HB3 GLN 18 3HB GLN 18 23.255 18.064 12.289 115 HG2 GLN 18 2HG GLN 18 21.477 19.829 12.346 116 HG3 GLN 18 3HG GLN 18 22.551 20.905 11.442 117 HE21 GLN 18 2HE2 GLN 18 20.143 19.206 9.096 118 HE22 GLN 18 1HE2 GLN 18 19.979 20.168 10.553 119 H GLU 19 H GLU 19 26.388 20.154 13.936 120 HA GLU 19 HA GLU 19 27.315 17.505 14.675 121 HB2 GLU 19 2HB GLU 19 28.627 20.248 14.635 122 HB3 GLU 19 3HB GLU 19 29.473 18.741 15.024 123 HG2 GLU 19 2HG GLU 19 28.901 17.828 12.793 124 HG3 GLU 19 3HG GLU 19 28.076 19.336 12.377 125 H ALA 20 H ALA 20 26.425 20.478 16.473 126 HA ALA 20 HA ALA 20 27.622 19.523 18.953 127 HB1 ALA 20 1HB ALA 20 27.684 21.896 18.359 128 HB2 ALA 20 2HB ALA 20 25.906 21.959 18.372 129 HB3 ALA 20 3HB ALA 20 26.802 21.649 19.871 130 H ARG 21 H ARG 21 24.668 18.764 17.461 131 HA ARG 21 HA ARG 21 22.767 18.861 19.539 132 HB2 ARG 21 2HB ARG 21 23.094 16.849 17.272 133 HB3 ARG 21 3HB ARG 21 21.662 16.995 18.302 134 HG2 ARG 21 2HG ARG 21 21.385 19.360 17.552 135 HG3 ARG 21 3HG ARG 21 22.739 19.160 16.446 136 HD2 ARG 21 2HD ARG 21 20.186 17.478 16.396 137 HD3 ARG 21 3HD ARG 21 20.470 18.904 15.396 138 HE ARG 21 HE ARG 21 22.160 17.831 14.201 139 HH11 ARG 21 1HH1 ARG 21 20.584 15.498 16.391 140 HH12 ARG 21 2HH1 ARG 21 21.187 14.130 15.488 141 HH21 ARG 21 2HH2 ARG 21 22.419 14.422 13.606 142 HH22 ARG 21 1HH2 ARG 21 22.825 16.023 13.047 143 H LEU 22 H LEU 22 22.779 17.937 21.527 144 HA LEU 22 HA LEU 22 24.560 15.737 22.180 145 HB2 LEU 22 2HB LEU 22 22.506 17.380 23.692 146 HB3 LEU 22 3HB LEU 22 23.344 16.024 24.439 147 HG LEU 22 HG LEU 22 24.895 18.271 23.112 148 HD11 LEU 22 1HD1 LEU 22 23.966 18.128 25.997 149 HD12 LEU 22 2HD1 LEU 22 23.520 19.348 24.778 150 HD13 LEU 22 3HD1 LEU 22 25.182 19.261 25.360 151 HD21 LEU 22 3HD2 LEU 22 26.157 16.172 23.623 152 HD22 LEU 22 1HD2 LEU 22 25.652 16.304 25.323 153 HD23 LEU 22 2HD2 LEU 22 26.712 17.531 24.607 154 H SER 23 H SER 23 23.545 13.946 23.575 155 HA SER 23 HA SER 23 21.969 12.318 21.807 156 HB2 SER 23 2HB SER 23 23.846 11.595 23.336 157 HB3 SER 23 3HB SER 23 22.731 11.779 24.703 158 HG SER 23 HG SER 23 22.329 10.124 22.424 159 H TYR 24 H TYR 24 20.889 14.741 23.838 160 HA TYR 24 HA TYR 24 18.194 13.583 24.182 161 HB2 TYR 24 2HB TYR 24 18.154 14.191 26.508 162 HB3 TYR 24 3HB TYR 24 19.520 13.130 26.235 163 HD1 TYR 24 HD1 TYR 24 18.452 16.226 27.655 164 HD2 TYR 24 HD2 TYR 24 21.906 14.341 25.848 165 HE1 TYR 24 HE1 TYR 24 19.939 17.874 28.738 166 HE2 TYR 24 HE2 TYR 24 23.374 15.949 26.961 167 HH TYR 24 HH TYR 24 23.507 17.786 28.315 168 H GLY 25 H GLY 25 16.607 15.208 24.794 169 HA2 GLY 25 2HA GLY 25 17.139 17.909 23.633 170 HA3 GLY 25 3HA GLY 25 15.593 17.050 23.619 171 H GLY 26 H GLY 26 18.019 18.513 25.790 172 HA2 GLY 26 2HA GLY 26 16.292 18.452 28.117 173 HA3 GLY 26 3HA GLY 26 17.926 19.089 28.005 174 H CYS 27 H CYS 27 16.047 20.498 25.577 175 HA CYS 27 HA CYS 27 14.879 22.665 27.221 176 HB2 CYS 27 2HB CYS 27 16.742 22.910 24.867 177 HB3 CYS 27 3HB CYS 27 15.600 24.190 25.237 178 H SER 28 H SER 28 13.669 24.092 25.223 179 HA SER 28 HA SER 28 11.439 22.242 24.671 180 HB2 SER 28 2HB SER 28 10.108 24.296 24.500 181 HB3 SER 28 3HB SER 28 10.992 24.233 26.032 182 HG SER 28 HG SER 28 11.131 26.274 25.028 183 H THR 29 H THR 29 14.042 23.608 22.991 184 HA THR 29 HA THR 29 12.730 23.093 20.380 185 HB THR 29 HB THR 29 14.086 24.939 19.411 186 HG1 THR 29 1HG THR 29 15.071 26.392 20.693 187 HG21 THR 29 1HG2 THR 29 11.691 25.283 19.997 188 HG22 THR 29 2HG2 THR 29 12.645 26.773 20.149 189 HG23 THR 29 3HG2 THR 29 12.194 25.861 21.606 190 H VAL 30 H VAL 30 15.933 23.732 21.854 191 HA VAL 30 HA VAL 30 17.082 21.326 20.576 192 HB VAL 30 HB VAL 30 18.875 22.580 19.481 193 HG11 VAL 30 1HG1 VAL 30 17.717 23.330 17.512 194 HG12 VAL 30 2HG1 VAL 30 16.867 21.917 18.160 195 HG13 VAL 30 3HG1 VAL 30 16.205 23.550 18.403 196 HG21 VAL 30 3HG2 VAL 30 18.905 24.681 20.751 197 HG22 VAL 30 1HG2 VAL 30 18.708 25.005 19.027 198 HG23 VAL 30 2HG2 VAL 30 17.309 25.121 20.104 199 H CYS 31 H CYS 31 19.120 20.742 21.345 200 HA CYS 31 HA CYS 31 20.240 22.160 23.701 201 HB2 CYS 31 2HB CYS 31 18.737 20.419 24.532 202 HB3 CYS 31 3HB CYS 31 19.532 19.219 23.511 203 H CYS 32 H CYS 32 21.459 22.868 21.704 204 HA CYS 32 HA CYS 32 23.612 21.110 20.778 205 HB2 CYS 32 2HB CYS 32 22.895 24.032 20.462 206 HB3 CYS 32 3HB CYS 32 24.547 23.495 20.193 207 H ASP 33 H ASP 33 25.503 20.800 21.813 208 HA ASP 33 HA ASP 33 25.953 21.739 24.475 209 HB2 ASP 33 2HB ASP 33 27.928 20.491 24.428 210 HB3 ASP 33 3HB ASP 33 26.842 19.599 23.381 211 H LEU 34 H LEU 34 27.636 23.154 25.270 212 HA LEU 34 HA LEU 34 29.187 24.619 23.271 213 HB2 LEU 34 2HB LEU 34 28.914 26.685 24.513 214 HB3 LEU 34 3HB LEU 34 27.372 25.985 24.002 215 HG LEU 34 HG LEU 34 27.003 25.131 26.319 216 HD11 LEU 34 1HD1 LEU 34 29.416 26.892 26.976 217 HD12 LEU 34 2HD1 LEU 34 29.216 25.170 27.372 218 HD13 LEU 34 3HD1 LEU 34 28.226 26.370 28.186 219 HD21 LEU 34 3HD2 LEU 34 25.951 27.185 25.437 220 HD22 LEU 34 1HD2 LEU 34 27.333 28.147 26.012 221 HD23 LEU 34 2HD2 LEU 34 26.270 27.320 27.176 222 H SER 35 H SER 35 29.306 22.539 25.881 223 HA SER 35 HA SER 35 31.647 23.465 27.241 224 HB2 SER 35 2HB SER 35 30.023 21.783 28.095 225 HB3 SER 35 3HB SER 35 30.631 20.621 26.895 226 HG SER 35 HG SER 35 32.646 20.722 27.885 227 H LYS 36 H LYS 36 31.140 21.665 24.220 228 HA LYS 36 HA LYS 36 33.968 20.918 23.944 229 HB2 LYS 36 2HB LYS 36 31.798 20.584 21.866 230 HB3 LYS 36 3HB LYS 36 33.288 19.672 22.068 231 HG2 LYS 36 2HG LYS 36 32.353 18.669 24.184 232 HG3 LYS 36 3HG LYS 36 30.863 19.589 23.927 233 HD2 LYS 36 2HD LYS 36 30.379 17.428 23.116 234 HD3 LYS 36 3HD LYS 36 30.590 18.456 21.702 235 HE2 LYS 36 2HE LYS 36 31.698 16.440 21.183 236 HE3 LYS 36 3HE LYS 36 32.988 17.594 21.553 237 HZ1 LYS 36 3HZ LYS 36 31.914 15.536 23.367 238 HZ2 LYS 36 1HZ LYS 36 33.088 16.623 23.765 239 HZ3 LYS 36 2HZ LYS 36 33.372 15.498 22.597 240 H LEU 37 H LEU 37 31.741 23.436 22.867 241 HA LEU 37 HA LEU 37 33.358 24.444 20.681 242 HB2 LEU 37 2HB LEU 37 31.179 25.783 22.339 243 HB3 LEU 37 3HB LEU 37 31.868 26.416 20.850 244 HG LEU 37 HG LEU 37 30.237 23.845 21.090 245 HD11 LEU 37 1HD1 LEU 37 29.540 26.546 19.855 246 HD12 LEU 37 2HD1 LEU 37 28.917 25.926 21.397 247 HD13 LEU 37 3HD1 LEU 37 28.507 25.099 19.887 248 HD21 LEU 37 3HD2 LEU 37 31.383 25.244 18.626 249 HD22 LEU 37 1HD2 LEU 37 30.213 23.909 18.592 250 HD23 LEU 37 2HD2 LEU 37 31.836 23.634 19.234 251 H THR 38 H THR 38 33.034 25.185 24.165 252 HA THR 38 HA THR 38 35.097 27.272 24.025 253 HB THR 38 HB THR 38 32.913 27.359 25.366 254 HG1 THR 38 1HG THR 38 34.456 28.872 25.648 255 HG21 THR 38 1HG2 THR 38 34.518 25.837 27.461 256 HG22 THR 38 2HG2 THR 38 33.203 25.109 26.519 257 HG23 THR 38 3HG2 THR 38 32.872 26.476 27.597 258 H GLY 39 H GLY 39 35.140 23.920 24.234 259 HA2 GLY 39 2HA GLY 39 37.471 23.669 26.045 260 HA3 GLY 39 3HA GLY 39 36.476 22.367 25.380 Start of MODEL 4 1 H1 ASN 1 H1 ASN 1 14.992 24.418 34.378 2 H2 ASN 1 H2 ASN 1 13.714 25.050 33.549 3 H3 ASN 1 H3 ASN 1 13.702 23.466 33.994 4 HA ASN 1 HA ASN 1 14.158 23.681 31.663 5 HB2 ASN 1 2HB ASN 1 16.475 25.346 32.683 6 HB3 ASN 1 3HB ASN 1 16.423 24.635 31.065 7 HD21 ASN 1 2HD2 ASN 1 15.266 28.064 30.558 8 HD22 ASN 1 1HD2 ASN 1 16.736 27.215 30.962 9 H GLU 2 H GLU 2 14.446 21.628 31.349 10 HA GLU 2 HA GLU 2 15.932 19.900 33.042 11 HB2 GLU 2 2HB GLU 2 13.815 19.546 31.583 12 HB3 GLU 2 3HB GLU 2 14.924 19.231 30.258 13 HG2 GLU 2 2HG GLU 2 14.800 17.733 32.912 14 HG3 GLU 2 3HG GLU 2 14.060 17.197 31.407 15 H CYS 3 H CYS 3 16.619 21.124 29.722 16 HA CYS 3 HA CYS 3 19.053 19.657 29.328 17 HB2 CYS 3 2HB CYS 3 17.627 20.627 27.526 18 HB3 CYS 3 3HB CYS 3 18.055 22.238 28.085 19 H VAL 4 H VAL 4 18.368 22.959 30.476 20 HA VAL 4 HA VAL 4 21.115 23.756 30.703 21 HB VAL 4 HB VAL 4 18.639 24.986 31.972 22 HG11 VAL 4 1HG1 VAL 4 21.355 26.167 31.282 23 HG12 VAL 4 2HG1 VAL 4 19.931 27.125 31.748 24 HG13 VAL 4 3HG1 VAL 4 20.633 25.995 32.899 25 HG21 VAL 4 3HG2 VAL 4 19.855 25.529 29.222 26 HG22 VAL 4 1HG2 VAL 4 18.272 24.786 29.520 27 HG23 VAL 4 2HG2 VAL 4 18.541 26.464 29.973 28 H SER 5 H SER 5 19.050 21.913 32.788 29 HA SER 5 HA SER 5 20.119 22.433 35.340 30 HB2 SER 5 2HB SER 5 18.100 21.055 34.844 31 HB3 SER 5 3HB SER 5 19.159 19.749 34.267 32 HG SER 5 HG SER 5 18.597 19.441 36.390 33 H LYS 6 H LYS 6 21.284 20.116 32.819 34 HA LYS 6 HA LYS 6 23.540 19.107 34.225 35 HB2 LYS 6 2HB LYS 6 22.857 19.391 31.274 36 HB3 LYS 6 3HB LYS 6 24.226 18.474 31.893 37 HG2 LYS 6 2HG LYS 6 22.692 16.849 31.505 38 HG3 LYS 6 3HG LYS 6 22.517 17.098 33.249 39 HD2 LYS 6 2HD LYS 6 20.445 18.301 32.917 40 HD3 LYS 6 3HD LYS 6 20.659 18.298 31.159 41 HE2 LYS 6 2HE LYS 6 20.245 15.855 32.937 42 HE3 LYS 6 3HE LYS 6 19.010 16.658 31.954 43 HZ1 LYS 6 3HZ LYS 6 20.261 16.082 30.008 44 HZ2 LYS 6 1HZ LYS 6 19.885 14.730 30.867 45 HZ3 LYS 6 2HZ LYS 6 21.418 15.331 30.913 46 H GLY 7 H GLY 7 23.002 22.158 32.608 47 HA2 GLY 7 2HA GLY 7 24.473 23.998 32.916 48 HA3 GLY 7 3HA GLY 7 25.862 22.918 32.872 49 H PHE 8 H PHE 8 23.898 21.818 30.406 50 HA PHE 8 HA PHE 8 25.482 22.981 28.295 51 HB2 PHE 8 2HB PHE 8 22.982 21.243 28.311 52 HB3 PHE 8 3HB PHE 8 23.834 21.705 26.849 53 HD1 PHE 8 HD1 PHE 8 23.556 19.136 29.222 54 HD2 PHE 8 HD2 PHE 8 26.467 21.235 26.858 55 HE1 PHE 8 HE1 PHE 8 25.073 17.181 29.371 56 HE2 PHE 8 HE2 PHE 8 27.969 19.268 26.957 57 HZ PHE 8 HZ PHE 8 27.279 17.233 28.221 58 H GLY 9 H GLY 9 24.380 23.864 26.311 59 HA2 GLY 9 2HA GLY 9 22.919 26.306 26.995 60 HA3 GLY 9 3HA GLY 9 23.644 25.867 25.443 61 H CYS 10 H CYS 10 21.451 26.935 24.958 62 HA CYS 10 HA CYS 10 19.607 24.816 24.115 63 HB2 CYS 10 2HB CYS 10 18.975 25.637 26.481 64 HB3 CYS 10 3HB CYS 10 18.560 27.166 25.719 65 H LEU 11 H LEU 11 21.338 26.137 22.504 66 HA LEU 11 HA LEU 11 20.757 28.688 21.607 67 HB2 LEU 11 2HB LEU 11 22.022 26.267 20.274 68 HB3 LEU 11 3HB LEU 11 21.780 27.724 19.357 69 HG LEU 11 HG LEU 11 23.965 27.756 20.017 70 HD11 LEU 11 1HD1 LEU 11 22.892 29.959 20.221 71 HD12 LEU 11 2HD1 LEU 11 24.291 29.775 21.278 72 HD13 LEU 11 3HD1 LEU 11 22.662 29.679 21.965 73 HD21 LEU 11 3HD2 LEU 11 23.842 26.105 21.869 74 HD22 LEU 11 1HD2 LEU 11 23.206 27.376 22.937 75 HD23 LEU 11 2HD2 LEU 11 24.840 27.516 22.256 76 HA PRO 12 HA PRO 12 17.055 28.464 19.343 77 HB2 PRO 12 3HB PRO 12 17.231 30.770 19.264 78 HB3 PRO 12 2HB PRO 12 17.264 30.465 17.501 79 HG2 PRO 12 2HG PRO 12 19.643 30.569 17.444 80 HG3 PRO 12 3HG PRO 12 19.275 31.846 18.650 81 HD2 PRO 12 2HD PRO 12 20.918 29.740 19.224 82 HD3 PRO 12 3HD PRO 12 19.858 30.433 20.459 83 H GLN 13 H GLN 13 16.034 28.296 17.162 84 HA GLN 13 HA GLN 13 16.889 25.947 15.888 85 HB2 GLN 13 2HB GLN 13 14.801 28.016 15.094 86 HB3 GLN 13 3HB GLN 13 14.919 26.398 14.401 87 HG2 GLN 13 2HG GLN 13 14.484 25.355 16.564 88 HG3 GLN 13 3HG GLN 13 14.425 26.930 17.368 89 HE21 GLN 13 2HE2 GLN 13 11.213 27.840 16.016 90 HE22 GLN 13 1HE2 GLN 13 12.742 28.520 16.555 91 H SER 14 H SER 14 18.180 29.010 15.286 92 HA SER 14 HA SER 14 18.894 28.346 12.466 93 HB2 SER 14 2HB SER 14 17.505 30.360 12.765 94 HB3 SER 14 3HB SER 14 18.729 31.045 13.851 95 HG SER 14 HG SER 14 20.193 30.969 12.107 96 H ASP 15 H ASP 15 20.212 28.537 15.658 97 HA ASP 15 HA ASP 15 22.963 28.992 14.570 98 HB2 ASP 15 2HB ASP 15 21.977 30.803 16.022 99 HB3 ASP 15 3HB ASP 15 21.996 29.638 17.354 100 H CYS 16 H CYS 16 20.962 26.894 16.595 101 HA CYS 16 HA CYS 16 22.995 25.331 17.816 102 HB2 CYS 16 2HB CYS 16 20.744 25.360 18.658 103 HB3 CYS 16 3HB CYS 16 20.086 24.868 17.110 104 HA PRO 17 HA PRO 17 23.963 23.428 13.767 105 HB2 PRO 17 3HB PRO 17 26.171 24.054 14.104 106 HB3 PRO 17 2HB PRO 17 26.360 22.290 14.352 107 HG2 PRO 17 2HG PRO 17 26.279 22.516 16.699 108 HG3 PRO 17 3HG PRO 17 27.151 24.015 16.280 109 HD2 PRO 17 2HD PRO 17 24.787 23.989 17.703 110 HD3 PRO 17 3HD PRO 17 25.257 25.328 16.631 111 H GLN 18 H GLN 18 23.911 21.277 13.006 112 HA GLN 18 HA GLN 18 22.187 19.544 14.428 113 HB2 GLN 18 2HB GLN 18 23.934 19.081 11.985 114 HB3 GLN 18 3HB GLN 18 22.643 18.002 12.504 115 HG2 GLN 18 2HG GLN 18 21.024 19.273 11.585 116 HG3 GLN 18 3HG GLN 18 21.658 20.767 12.256 117 HE21 GLN 18 2HE2 GLN 18 23.080 21.853 9.222 118 HE22 GLN 18 1HE2 GLN 18 22.594 22.233 10.860 119 H GLU 19 H GLU 19 25.702 19.664 14.340 120 HA GLU 19 HA GLU 19 26.158 16.970 15.310 121 HB2 GLU 19 2HB GLU 19 27.962 19.421 15.186 122 HB3 GLU 19 3HB GLU 19 28.483 17.772 15.568 123 HG2 GLU 19 2HG GLU 19 27.612 17.038 13.313 124 HG3 GLU 19 3HG GLU 19 27.329 18.739 12.918 125 H ALA 20 H ALA 20 25.726 20.166 16.860 126 HA ALA 20 HA ALA 20 26.725 19.209 19.428 127 HB1 ALA 20 1HB ALA 20 26.254 21.478 20.211 128 HB2 ALA 20 2HB ALA 20 27.166 21.494 18.694 129 HB3 ALA 20 3HB ALA 20 25.422 21.841 18.688 130 H ARG 21 H ARG 21 23.712 18.916 17.879 131 HA ARG 21 HA ARG 21 21.899 19.073 20.086 132 HB2 ARG 21 2HB ARG 21 21.849 17.359 17.560 133 HB3 ARG 21 3HB ARG 21 20.492 17.559 18.680 134 HG2 ARG 21 2HG ARG 21 20.511 20.011 18.241 135 HG3 ARG 21 3HG ARG 21 21.835 19.769 17.085 136 HD2 ARG 21 2HD ARG 21 20.344 18.171 15.824 137 HD3 ARG 21 3HD ARG 21 19.008 18.678 16.887 138 HE ARG 21 HE ARG 21 20.105 21.030 15.962 139 HH11 ARG 21 1HH1 ARG 21 18.691 18.197 14.333 140 HH12 ARG 21 2HH1 ARG 21 18.350 19.097 12.867 141 HH21 ARG 21 2HH2 ARG 21 18.811 21.284 12.719 142 HH22 ARG 21 1HH2 ARG 21 19.546 22.157 14.049 143 H LEU 22 H LEU 22 21.932 17.899 21.913 144 HA LEU 22 HA LEU 22 23.846 15.811 22.313 145 HB2 LEU 22 2HB LEU 22 21.659 17.126 23.953 146 HB3 LEU 22 3HB LEU 22 22.612 15.810 24.619 147 HG LEU 22 HG LEU 22 24.046 18.191 23.397 148 HD11 LEU 22 1HD1 LEU 22 23.026 18.040 26.246 149 HD12 LEU 22 2HD1 LEU 22 22.445 19.148 24.980 150 HD13 LEU 22 3HD1 LEU 22 24.106 19.279 25.566 151 HD21 LEU 22 3HD2 LEU 22 25.782 17.551 25.046 152 HD22 LEU 22 1HD2 LEU 22 25.382 16.195 23.981 153 HD23 LEU 22 2HD2 LEU 22 24.748 16.243 25.642 154 H SER 23 H SER 23 23.044 13.855 23.695 155 HA SER 23 HA SER 23 21.552 12.127 21.926 156 HB2 SER 23 2HB SER 23 23.507 11.440 23.280 157 HB3 SER 23 3HB SER 23 22.541 11.626 24.754 158 HG SER 23 HG SER 23 21.787 9.965 22.576 159 H TYR 24 H TYR 24 20.426 14.432 24.063 160 HA TYR 24 HA TYR 24 17.750 13.204 24.238 161 HB2 TYR 24 2HB TYR 24 17.511 13.766 26.535 162 HB3 TYR 24 3HB TYR 24 18.995 12.852 26.403 163 HD1 TYR 24 HD1 TYR 24 21.262 14.254 26.279 164 HD2 TYR 24 HD2 TYR 24 17.466 15.897 27.529 165 HE1 TYR 24 HE1 TYR 24 22.431 16.125 27.374 166 HE2 TYR 24 HE2 TYR 24 18.619 17.779 28.583 167 HH TYR 24 HH TYR 24 20.676 18.852 28.909 168 H GLY 25 H GLY 25 16.125 14.934 24.901 169 HA2 GLY 25 2HA GLY 25 16.755 17.594 23.676 170 HA3 GLY 25 3HA GLY 25 15.302 16.667 23.293 171 H GLY 26 H GLY 26 17.092 18.001 26.110 172 HA2 GLY 26 2HA GLY 26 14.800 17.996 27.866 173 HA3 GLY 26 3HA GLY 26 16.377 18.719 28.166 174 H CYS 27 H CYS 27 15.986 20.323 25.515 175 HA CYS 27 HA CYS 27 14.623 22.652 26.631 176 HB2 CYS 27 2HB CYS 27 15.995 22.014 24.011 177 HB3 CYS 27 3HB CYS 27 15.151 23.531 24.274 178 H SER 28 H SER 28 13.141 23.811 24.919 179 HA SER 28 HA SER 28 10.760 22.094 24.649 180 HB2 SER 28 2HB SER 28 11.065 25.100 24.283 181 HB3 SER 28 3HB SER 28 9.560 24.165 24.374 182 HG SER 28 HG SER 28 11.437 24.663 26.409 183 H THR 29 H THR 29 13.371 22.991 22.710 184 HA THR 29 HA THR 29 12.003 22.069 20.316 185 HB THR 29 HB THR 29 11.468 24.307 19.992 186 HG1 THR 29 1HG THR 29 13.869 23.903 18.561 187 HG21 THR 29 1HG2 THR 29 12.865 25.507 21.564 188 HG22 THR 29 2HG2 THR 29 13.066 26.182 19.945 189 HG23 THR 29 3HG2 THR 29 14.325 25.138 20.622 190 H VAL 30 H VAL 30 15.145 23.430 21.523 191 HA VAL 30 HA VAL 30 16.561 21.111 20.397 192 HB VAL 30 HB VAL 30 18.283 22.852 19.455 193 HG11 VAL 30 1HG1 VAL 30 17.150 21.122 18.134 194 HG12 VAL 30 2HG1 VAL 30 15.772 22.222 17.874 195 HG13 VAL 30 3HG1 VAL 30 17.376 22.633 17.234 196 HG21 VAL 30 3HG2 VAL 30 17.452 24.847 18.493 197 HG22 VAL 30 1HG2 VAL 30 15.770 24.450 18.880 198 HG23 VAL 30 2HG2 VAL 30 16.901 24.865 20.183 199 H CYS 31 H CYS 31 17.951 20.381 21.755 200 HA CYS 31 HA CYS 31 19.093 22.042 23.940 201 HB2 CYS 31 2HB CYS 31 17.633 20.226 24.653 202 HB3 CYS 31 3HB CYS 31 18.544 19.071 23.685 203 H CYS 32 H CYS 32 20.684 22.905 22.535 204 HA CYS 32 HA CYS 32 22.723 21.115 21.375 205 HB2 CYS 32 2HB CYS 32 21.817 23.903 20.992 206 HB3 CYS 32 3HB CYS 32 23.560 23.749 21.099 207 H ASP 33 H ASP 33 24.823 20.957 22.101 208 HA ASP 33 HA ASP 33 25.357 21.707 24.854 209 HB2 ASP 33 2HB ASP 33 27.193 20.289 24.753 210 HB3 ASP 33 3HB ASP 33 25.974 19.515 23.778 211 H LEU 34 H LEU 34 27.587 22.596 25.412 212 HA LEU 34 HA LEU 34 28.370 24.892 23.674 213 HB2 LEU 34 2HB LEU 34 28.218 24.737 26.707 214 HB3 LEU 34 3HB LEU 34 28.874 26.099 25.802 215 HG LEU 34 HG LEU 34 25.992 25.152 25.588 216 HD11 LEU 34 1HD1 LEU 34 25.460 27.113 27.013 217 HD12 LEU 34 2HD1 LEU 34 27.194 27.421 27.233 218 HD13 LEU 34 3HD1 LEU 34 26.463 25.935 27.872 219 HD21 LEU 34 3HD2 LEU 34 27.358 27.714 24.653 220 HD22 LEU 34 1HD2 LEU 34 25.612 27.384 24.593 221 HD23 LEU 34 2HD2 LEU 34 26.722 26.429 23.606 222 H SER 35 H SER 35 29.384 21.955 24.945 223 HA SER 35 HA SER 35 32.123 22.540 25.651 224 HB2 SER 35 2HB SER 35 30.750 20.586 26.429 225 HB3 SER 35 3HB SER 35 30.817 19.935 24.782 226 HG SER 35 HG SER 35 32.442 19.064 26.076 227 H LYS 36 H LYS 36 30.445 22.119 22.602 228 HA LYS 36 HA LYS 36 32.592 21.295 20.937 229 HB2 LYS 36 2HB LYS 36 31.239 22.210 19.115 230 HB3 LYS 36 3HB LYS 36 30.297 21.183 20.178 231 HG2 LYS 36 2HG LYS 36 28.949 22.879 20.927 232 HG3 LYS 36 3HG LYS 36 30.186 24.121 20.826 233 HD2 LYS 36 2HD LYS 36 28.923 22.892 18.353 234 HD3 LYS 36 3HD LYS 36 28.259 24.312 19.173 235 HE2 LYS 36 2HE LYS 36 30.352 25.542 18.855 236 HE3 LYS 36 3HE LYS 36 31.098 24.123 18.093 237 HZ1 LYS 36 3HZ LYS 36 29.490 24.265 16.349 238 HZ2 LYS 36 1HZ LYS 36 30.299 25.695 16.484 239 HZ3 LYS 36 2HZ LYS 36 28.759 25.570 17.048 240 H LEU 37 H LEU 37 32.027 24.404 22.444 241 HA LEU 37 HA LEU 37 33.406 26.066 20.561 242 HB2 LEU 37 2HB LEU 37 32.888 26.397 23.536 243 HB3 LEU 37 3HB LEU 37 33.516 27.665 22.489 244 HG LEU 37 HG LEU 37 30.791 26.327 22.131 245 HD11 LEU 37 1HD1 LEU 37 31.492 29.029 23.354 246 HD12 LEU 37 2HD1 LEU 37 30.910 27.605 24.242 247 HD13 LEU 37 3HD1 LEU 37 29.858 28.398 23.063 248 HD21 LEU 37 3HD2 LEU 37 30.336 28.301 20.659 249 HD22 LEU 37 1HD2 LEU 37 31.615 27.270 20.016 250 HD23 LEU 37 2HD2 LEU 37 32.029 28.796 20.825 251 H THR 38 H THR 38 34.511 24.717 23.732 252 HA THR 38 HA THR 38 37.292 25.296 23.195 253 HB THR 38 HB THR 38 36.272 25.240 25.458 254 HG1 THR 38 1HG THR 38 38.448 23.544 24.882 255 HG21 THR 38 1HG2 THR 38 36.004 23.115 26.647 256 HG22 THR 38 2HG2 THR 38 36.310 22.200 25.160 257 HG23 THR 38 3HG2 THR 38 34.858 23.214 25.307 258 H GLY 39 H GLY 39 35.237 22.849 22.021 259 HA2 GLY 39 2HA GLY 39 37.083 20.649 21.826 260 HA3 GLY 39 3HA GLY 39 35.555 20.847 20.959 Start of MODEL 5 1 H1 ASN 1 H1 ASN 1 13.729 21.706 35.082 2 H2 ASN 1 H2 ASN 1 14.680 23.059 35.117 3 H3 ASN 1 H3 ASN 1 13.164 23.130 34.460 4 HA ASN 1 HA ASN 1 13.754 21.653 32.721 5 HB2 ASN 1 2HB ASN 1 15.792 23.893 32.940 6 HB3 ASN 1 3HB ASN 1 15.234 23.113 31.453 7 HD21 ASN 1 2HD2 ASN 1 13.486 26.465 32.435 8 HD22 ASN 1 1HD2 ASN 1 15.136 25.971 32.722 9 H GLU 2 H GLU 2 14.813 19.792 32.410 10 HA GLU 2 HA GLU 2 16.947 18.857 34.004 11 HB2 GLU 2 2HB GLU 2 15.237 17.525 32.655 12 HB3 GLU 2 3HB GLU 2 16.183 17.891 31.221 13 HG2 GLU 2 2HG GLU 2 18.205 16.871 32.448 14 HG3 GLU 2 3HG GLU 2 17.054 16.290 33.656 15 H CYS 3 H CYS 3 16.934 20.291 30.726 16 HA CYS 3 HA CYS 3 19.635 19.822 30.068 17 HB2 CYS 3 2HB CYS 3 17.642 20.616 28.614 18 HB3 CYS 3 3HB CYS 3 18.077 22.242 29.127 19 H VAL 4 H VAL 4 18.117 22.692 31.611 20 HA VAL 4 HA VAL 4 20.515 24.219 31.912 21 HB VAL 4 HB VAL 4 17.946 24.383 33.543 22 HG11 VAL 4 1HG1 VAL 4 19.772 25.713 34.516 23 HG12 VAL 4 2HG1 VAL 4 20.099 26.459 32.938 24 HG13 VAL 4 3HG1 VAL 4 18.573 26.782 33.789 25 HG21 VAL 4 3HG2 VAL 4 18.621 25.826 30.933 26 HG22 VAL 4 1HG2 VAL 4 17.385 24.567 31.116 27 HG23 VAL 4 2HG2 VAL 4 17.180 26.109 31.940 28 H SER 5 H SER 5 18.914 21.751 33.950 29 HA SER 5 HA SER 5 20.487 22.149 36.315 30 HB2 SER 5 2HB SER 5 19.017 19.670 35.326 31 HB3 SER 5 3HB SER 5 19.688 19.902 36.948 32 HG SER 5 HG SER 5 17.636 21.404 35.708 33 H LYS 6 H LYS 6 20.938 20.106 33.399 34 HA LYS 6 HA LYS 6 23.428 18.910 34.300 35 HB2 LYS 6 2HB LYS 6 22.054 19.088 31.587 36 HB3 LYS 6 3HB LYS 6 23.613 18.293 31.867 37 HG2 LYS 6 2HG LYS 6 22.386 16.906 33.680 38 HG3 LYS 6 3HG LYS 6 20.893 17.489 32.907 39 HD2 LYS 6 2HD LYS 6 21.569 16.512 30.772 40 HD3 LYS 6 3HD LYS 6 23.141 16.052 31.445 41 HE2 LYS 6 2HE LYS 6 21.797 14.082 31.383 42 HE3 LYS 6 3HE LYS 6 22.019 14.558 33.073 43 HZ1 LYS 6 3HZ LYS 6 19.623 15.082 31.438 44 HZ2 LYS 6 1HZ LYS 6 19.826 15.521 33.016 45 HZ3 LYS 6 2HZ LYS 6 19.760 13.928 32.608 46 H GLY 7 H GLY 7 22.721 22.104 33.399 47 HA2 GLY 7 2HA GLY 7 24.212 23.857 33.351 48 HA3 GLY 7 3HA GLY 7 25.565 22.756 33.149 49 H PHE 8 H PHE 8 23.181 21.939 30.830 50 HA PHE 8 HA PHE 8 24.721 23.132 28.655 51 HB2 PHE 8 2HB PHE 8 22.279 21.311 28.732 52 HB3 PHE 8 3HB PHE 8 23.189 21.695 27.281 53 HD1 PHE 8 HD1 PHE 8 22.536 19.025 29.144 54 HD2 PHE 8 HD2 PHE 8 25.991 21.415 28.160 55 HE1 PHE 8 HE1 PHE 8 23.989 17.043 29.432 56 HE2 PHE 8 HE2 PHE 8 27.453 19.438 28.534 57 HZ PHE 8 HZ PHE 8 26.449 17.255 29.198 58 H GLY 9 H GLY 9 23.478 23.951 26.770 59 HA2 GLY 9 2HA GLY 9 21.845 26.246 27.670 60 HA3 GLY 9 3HA GLY 9 22.712 26.070 26.144 61 H CYS 10 H CYS 10 20.208 27.064 26.171 62 HA CYS 10 HA CYS 10 18.635 25.026 24.681 63 HB2 CYS 10 2HB CYS 10 17.543 27.146 26.560 64 HB3 CYS 10 3HB CYS 10 16.578 26.174 25.452 65 H LEU 11 H LEU 11 20.050 25.885 23.011 66 HA LEU 11 HA LEU 11 19.808 28.553 21.993 67 HB2 LEU 11 2HB LEU 11 20.765 25.869 20.952 68 HB3 LEU 11 3HB LEU 11 20.581 27.182 19.827 69 HG LEU 11 HG LEU 11 22.822 27.083 20.387 70 HD11 LEU 11 1HD1 LEU 11 23.392 29.252 21.257 71 HD12 LEU 11 2HD1 LEU 11 21.790 29.449 21.975 72 HD13 LEU 11 3HD1 LEU 11 21.981 29.379 20.206 73 HD21 LEU 11 3HD2 LEU 11 23.779 27.176 22.625 74 HD22 LEU 11 1HD2 LEU 11 22.641 25.825 22.535 75 HD23 LEU 11 2HD2 LEU 11 22.173 27.330 23.356 76 HA PRO 12 HA PRO 12 15.988 28.173 19.716 77 HB2 PRO 12 3HB PRO 12 16.310 30.450 19.282 78 HB3 PRO 12 2HB PRO 12 16.303 29.841 17.604 79 HG2 PRO 12 2HG PRO 12 18.680 29.804 17.525 80 HG3 PRO 12 3HG PRO 12 18.404 31.283 18.494 81 HD2 PRO 12 2HD PRO 12 19.912 29.152 19.365 82 HD3 PRO 12 3HD PRO 12 19.019 30.180 20.497 83 H GLN 13 H GLN 13 15.124 27.682 17.467 84 HA GLN 13 HA GLN 13 16.102 25.177 16.568 85 HB2 GLN 13 2HB GLN 13 14.018 27.108 15.471 86 HB3 GLN 13 3HB GLN 13 14.229 25.482 14.850 87 HG2 GLN 13 2HG GLN 13 13.529 26.088 17.755 88 HG3 GLN 13 3HG GLN 13 12.350 25.779 16.493 89 HE21 GLN 13 2HE2 GLN 13 12.587 22.520 18.086 90 HE22 GLN 13 1HE2 GLN 13 11.895 24.112 18.353 91 H SER 14 H SER 14 17.484 28.113 15.819 92 HA SER 14 HA SER 14 18.291 27.312 13.067 93 HB2 SER 14 2HB SER 14 18.333 29.703 12.527 94 HB3 SER 14 3HB SER 14 16.725 29.139 13.005 95 HG SER 14 HG SER 14 18.585 30.509 14.681 96 H ASP 15 H ASP 15 19.546 27.867 16.208 97 HA ASP 15 HA ASP 15 22.255 28.435 15.082 98 HB2 ASP 15 2HB ASP 15 20.997 29.633 17.566 99 HB3 ASP 15 3HB ASP 15 22.690 29.762 17.149 100 H CYS 16 H CYS 16 20.424 26.198 16.855 101 HA CYS 16 HA CYS 16 22.667 25.043 18.330 102 HB2 CYS 16 2HB CYS 16 20.455 24.651 19.188 103 HB3 CYS 16 3HB CYS 16 19.890 24.041 17.636 104 HA PRO 17 HA PRO 17 23.884 23.151 14.315 105 HB2 PRO 17 3HB PRO 17 26.048 23.880 14.739 106 HB3 PRO 17 2HB PRO 17 26.309 22.141 15.064 107 HG2 PRO 17 2HG PRO 17 26.091 22.461 17.407 108 HG3 PRO 17 3HG PRO 17 26.914 23.984 16.954 109 HD2 PRO 17 2HD PRO 17 24.495 23.899 18.271 110 HD3 PRO 17 3HD PRO 17 24.914 25.218 17.138 111 H GLN 18 H GLN 18 24.160 20.905 13.640 112 HA GLN 18 HA GLN 18 22.505 19.046 15.027 113 HB2 GLN 18 2HB GLN 18 24.512 18.711 12.760 114 HB3 GLN 18 3HB GLN 18 23.408 17.437 13.298 115 HG2 GLN 18 2HG GLN 18 21.465 18.741 12.691 116 HG3 GLN 18 3HG GLN 18 22.455 20.152 12.310 117 HE21 GLN 18 2HE2 GLN 18 23.147 19.142 9.005 118 HE22 GLN 18 1HE2 GLN 18 23.227 20.393 10.233 119 H GLU 19 H GLU 19 25.951 19.693 15.234 120 HA GLU 19 HA GLU 19 26.765 17.196 16.390 121 HB2 GLU 19 2HB GLU 19 28.061 19.946 16.548 122 HB3 GLU 19 3HB GLU 19 28.836 18.401 16.895 123 HG2 GLU 19 2HG GLU 19 27.888 19.434 14.190 124 HG3 GLU 19 3HG GLU 19 29.537 19.081 14.686 125 H ALA 20 H ALA 20 25.436 20.203 17.749 126 HA ALA 20 HA ALA 20 26.267 19.582 20.450 127 HB1 ALA 20 1HB ALA 20 26.139 21.892 19.680 128 HB2 ALA 20 2HB ALA 20 24.389 21.719 19.382 129 HB3 ALA 20 3HB ALA 20 25.035 21.625 21.036 130 H ARG 21 H ARG 21 23.489 18.709 18.552 131 HA ARG 21 HA ARG 21 21.433 18.653 20.483 132 HB2 ARG 21 2HB ARG 21 21.931 17.036 17.953 133 HB3 ARG 21 3HB ARG 21 20.446 16.917 18.911 134 HG2 ARG 21 2HG ARG 21 19.995 19.304 18.572 135 HG3 ARG 21 3HG ARG 21 21.510 19.473 17.654 136 HD2 ARG 21 2HD ARG 21 20.720 17.807 16.015 137 HD3 ARG 21 3HD ARG 21 19.203 17.624 16.908 138 HE ARG 21 HE ARG 21 20.142 19.946 15.347 139 HH11 ARG 21 1HH1 ARG 21 17.514 18.573 17.320 140 HH12 ARG 21 2HH1 ARG 21 16.343 19.747 16.761 141 HH21 ARG 21 2HH2 ARG 21 16.946 21.383 15.304 142 HH22 ARG 21 1HH2 ARG 21 18.582 21.451 14.676 143 H LEU 22 H LEU 22 21.177 17.499 22.306 144 HA LEU 22 HA LEU 22 22.928 15.246 22.913 145 HB2 LEU 22 2HB LEU 22 20.859 16.913 24.377 146 HB3 LEU 22 3HB LEU 22 21.500 15.466 25.125 147 HG LEU 22 HG LEU 22 23.442 17.514 24.005 148 HD11 LEU 22 1HD1 LEU 22 22.003 18.857 25.329 149 HD12 LEU 22 2HD1 LEU 22 23.474 18.567 26.269 150 HD13 LEU 22 3HD1 LEU 22 21.992 17.666 26.648 151 HD21 LEU 22 3HD2 LEU 22 24.322 15.324 24.760 152 HD22 LEU 22 1HD2 LEU 22 23.581 15.571 26.357 153 HD23 LEU 22 2HD2 LEU 22 24.889 16.635 25.805 154 H SER 23 H SER 23 21.931 13.428 24.141 155 HA SER 23 HA SER 23 20.152 11.873 22.462 156 HB2 SER 23 2HB SER 23 22.060 10.958 23.772 157 HB3 SER 23 3HB SER 23 21.196 11.340 25.274 158 HG SER 23 HG SER 23 20.370 9.572 23.205 159 H TYR 24 H TYR 24 19.586 14.209 24.887 160 HA TYR 24 HA TYR 24 16.752 13.423 25.225 161 HB2 TYR 24 2HB TYR 24 17.112 14.430 27.621 162 HB3 TYR 24 3HB TYR 24 17.493 12.765 27.268 163 HD1 TYR 24 HD1 TYR 24 19.533 11.871 27.905 164 HD2 TYR 24 HD2 TYR 24 19.211 16.157 27.416 165 HE1 TYR 24 HE1 TYR 24 21.819 12.136 28.765 166 HE2 TYR 24 HE2 TYR 24 21.488 16.417 28.332 167 HH TYR 24 HH TYR 24 23.526 13.622 29.278 168 H GLY 25 H GLY 25 15.495 15.284 26.154 169 HA2 GLY 25 2HA GLY 25 16.222 17.878 24.860 170 HA3 GLY 25 3HA GLY 25 14.683 17.067 24.574 171 H GLY 26 H GLY 26 16.777 18.217 27.244 172 HA2 GLY 26 2HA GLY 26 14.643 18.398 29.181 173 HA3 GLY 26 3HA GLY 26 16.308 18.945 29.350 174 H CYS 27 H CYS 27 15.524 20.511 26.640 175 HA CYS 27 HA CYS 27 14.564 23.005 27.885 176 HB2 CYS 27 2HB CYS 27 15.299 22.286 25.024 177 HB3 CYS 27 3HB CYS 27 14.954 23.913 25.608 178 H SER 28 H SER 28 12.987 24.007 25.850 179 HA SER 28 HA SER 28 10.611 22.212 25.773 180 HB2 SER 28 2HB SER 28 9.274 24.232 25.518 181 HB3 SER 28 3HB SER 28 10.229 24.310 27.003 182 HG SER 28 HG SER 28 10.310 26.262 25.874 183 H THR 29 H THR 29 13.162 23.366 23.936 184 HA THR 29 HA THR 29 11.786 22.921 21.338 185 HB THR 29 HB THR 29 13.444 24.599 20.442 186 HG1 THR 29 1HG THR 29 14.203 26.109 22.033 187 HG21 THR 29 1HG2 THR 29 11.059 25.165 20.806 188 HG22 THR 29 2HG2 THR 29 12.119 26.555 21.111 189 HG23 THR 29 3HG2 THR 29 11.430 25.647 22.475 190 H VAL 30 H VAL 30 15.159 23.303 22.520 191 HA VAL 30 HA VAL 30 15.933 20.642 21.578 192 HB VAL 30 HB VAL 30 17.731 21.541 20.110 193 HG11 VAL 30 1HG1 VAL 30 16.397 21.728 18.122 194 HG12 VAL 30 2HG1 VAL 30 15.679 20.513 19.196 195 HG13 VAL 30 3HG1 VAL 30 14.952 22.132 19.057 196 HG21 VAL 30 3HG2 VAL 30 17.809 23.931 20.694 197 HG22 VAL 30 1HG2 VAL 30 17.445 23.730 18.985 198 HG23 VAL 30 2HG2 VAL 30 16.144 24.151 20.112 199 H CYS 31 H CYS 31 17.244 19.867 23.056 200 HA CYS 31 HA CYS 31 18.766 21.645 24.864 201 HB2 CYS 31 2HB CYS 31 17.383 19.860 25.789 202 HB3 CYS 31 3HB CYS 31 18.309 18.665 24.865 203 H CYS 32 H CYS 32 20.595 22.349 24.100 204 HA CYS 32 HA CYS 32 22.275 20.627 22.386 205 HB2 CYS 32 2HB CYS 32 21.656 23.589 22.193 206 HB3 CYS 32 3HB CYS 32 22.777 22.698 21.173 207 H ASP 33 H ASP 33 24.086 20.138 23.346 208 HA ASP 33 HA ASP 33 24.878 21.214 25.839 209 HB2 ASP 33 2HB ASP 33 26.306 19.477 25.954 210 HB3 ASP 33 3HB ASP 33 25.179 18.850 24.774 211 H LEU 34 H LEU 34 27.265 21.721 26.273 212 HA LEU 34 HA LEU 34 28.173 23.916 24.470 213 HB2 LEU 34 2HB LEU 34 28.027 23.913 27.501 214 HB3 LEU 34 3HB LEU 34 28.646 25.223 26.510 215 HG LEU 34 HG LEU 34 25.751 24.244 26.477 216 HD11 LEU 34 1HD1 LEU 34 26.337 25.253 28.632 217 HD12 LEU 34 2HD1 LEU 34 25.260 26.320 27.720 218 HD13 LEU 34 3HD1 LEU 34 27.000 26.678 27.810 219 HD21 LEU 34 3HD2 LEU 34 26.405 25.338 24.336 220 HD22 LEU 34 1HD2 LEU 34 27.004 26.741 25.243 221 HD23 LEU 34 2HD2 LEU 34 25.276 26.335 25.256 222 H SER 35 H SER 35 29.085 20.931 25.350 223 HA SER 35 HA SER 35 31.642 21.227 26.517 224 HB2 SER 35 2HB SER 35 30.315 19.131 26.444 225 HB3 SER 35 3HB SER 35 30.663 18.997 24.705 226 HG SER 35 HG SER 35 32.809 18.797 25.156 227 H LYS 36 H LYS 36 30.647 21.640 23.128 228 HA LYS 36 HA LYS 36 33.213 21.350 21.898 229 HB2 LYS 36 2HB LYS 36 30.727 22.942 21.148 230 HB3 LYS 36 3HB LYS 36 32.126 22.809 20.100 231 HG2 LYS 36 2HG LYS 36 30.610 20.374 21.127 232 HG3 LYS 36 3HG LYS 36 30.158 21.198 19.638 233 HD2 LYS 36 2HD LYS 36 32.913 20.007 20.134 234 HD3 LYS 36 3HD LYS 36 31.584 19.158 19.334 235 HE2 LYS 36 2HE LYS 36 31.469 20.868 17.582 236 HE3 LYS 36 3HE LYS 36 32.749 21.804 18.365 237 HZ1 LYS 36 3HZ LYS 36 34.247 19.992 18.009 238 HZ2 LYS 36 1HZ LYS 36 33.599 20.449 16.567 239 HZ3 LYS 36 2HZ LYS 36 33.074 19.073 17.314 240 H LEU 37 H LEU 37 31.674 24.036 23.629 241 HA LEU 37 HA LEU 37 33.469 26.105 22.728 242 HB2 LEU 37 2HB LEU 37 31.775 25.991 25.244 243 HB3 LEU 37 3HB LEU 37 32.460 27.418 24.488 244 HG LEU 37 HG LEU 37 30.241 25.657 23.333 245 HD11 LEU 37 1HD1 LEU 37 30.218 28.521 24.374 246 HD12 LEU 37 2HD1 LEU 37 29.547 27.102 25.206 247 HD13 LEU 37 3HD1 LEU 37 28.836 27.647 23.680 248 HD21 LEU 37 3HD2 LEU 37 31.569 26.519 21.467 249 HD22 LEU 37 1HD2 LEU 37 31.561 28.150 22.172 250 HD23 LEU 37 2HD2 LEU 37 30.057 27.423 21.564 251 H THR 38 H THR 38 33.866 23.569 25.017 252 HA THR 38 HA THR 38 36.270 24.859 26.201 253 HB THR 38 HB THR 38 34.378 24.747 27.777 254 HG1 THR 38 1HG THR 38 35.540 23.701 29.413 255 HG21 THR 38 1HG2 THR 38 33.678 22.576 28.727 256 HG22 THR 38 2HG2 THR 38 34.583 21.726 27.457 257 HG23 THR 38 3HG2 THR 38 33.197 22.757 27.035 258 H GLY 39 H GLY 39 35.427 22.764 23.920 259 HA2 GLY 39 2HA GLY 39 37.870 21.307 23.821 260 HA3 GLY 39 3HA GLY 39 36.622 20.273 24.541 Start of MODEL 6 1 H1 ASN 1 H1 ASN 1 14.766 21.073 33.938 2 H2 ASN 1 H2 ASN 1 13.296 20.583 33.363 3 H3 ASN 1 H3 ASN 1 14.337 19.487 34.021 4 HA ASN 1 HA ASN 1 14.313 19.298 31.642 5 HB2 ASN 1 2HB ASN 1 15.409 22.131 31.715 6 HB3 ASN 1 3HB ASN 1 15.214 21.124 30.277 7 HD21 ASN 1 2HD2 ASN 1 12.429 23.652 30.589 8 HD22 ASN 1 1HD2 ASN 1 14.163 23.778 30.703 9 H GLU 2 H GLU 2 15.913 17.801 31.545 10 HA GLU 2 HA GLU 2 18.279 17.985 33.089 11 HB2 GLU 2 2HB GLU 2 17.139 15.899 32.255 12 HB3 GLU 2 3HB GLU 2 17.837 16.209 30.667 13 HG2 GLU 2 2HG GLU 2 20.120 16.106 31.625 14 HG3 GLU 2 3HG GLU 2 19.442 15.847 33.238 15 H CYS 3 H CYS 3 17.768 18.495 29.565 16 HA CYS 3 HA CYS 3 20.458 18.900 28.886 17 HB2 CYS 3 2HB CYS 3 18.260 18.670 27.456 18 HB3 CYS 3 3HB CYS 3 18.327 20.437 27.418 19 H VAL 4 H VAL 4 18.163 21.218 30.269 20 HA VAL 4 HA VAL 4 19.816 23.580 29.953 21 HB VAL 4 HB VAL 4 17.471 23.019 31.819 22 HG11 VAL 4 1HG1 VAL 4 18.805 24.942 32.561 23 HG12 VAL 4 2HG1 VAL 4 18.710 25.654 30.937 24 HG13 VAL 4 3HG1 VAL 4 17.241 25.464 31.924 25 HG21 VAL 4 3HG2 VAL 4 16.819 22.775 29.424 26 HG22 VAL 4 1HG2 VAL 4 16.078 24.191 30.175 27 HG23 VAL 4 2HG2 VAL 4 17.480 24.389 29.096 28 H SER 5 H SER 5 19.102 21.261 32.619 29 HA SER 5 HA SER 5 20.655 22.522 34.634 30 HB2 SER 5 2HB SER 5 18.802 20.881 34.948 31 HB3 SER 5 3HB SER 5 19.864 19.598 34.346 32 HG SER 5 HG SER 5 21.252 20.031 36.094 33 H LYS 6 H LYS 6 21.522 20.227 32.097 34 HA LYS 6 HA LYS 6 24.210 19.606 32.977 35 HB2 LYS 6 2HB LYS 6 22.696 19.396 30.351 36 HB3 LYS 6 3HB LYS 6 24.371 18.894 30.515 37 HG2 LYS 6 2HG LYS 6 22.197 17.749 32.303 38 HG3 LYS 6 3HG LYS 6 22.531 17.094 30.701 39 HD2 LYS 6 2HD LYS 6 24.608 17.330 32.917 40 HD3 LYS 6 3HD LYS 6 23.623 15.889 32.605 41 HE2 LYS 6 2HE LYS 6 24.538 15.751 30.306 42 HE3 LYS 6 3HE LYS 6 25.567 17.158 30.639 43 HZ1 LYS 6 3HZ LYS 6 26.580 15.886 32.417 44 HZ2 LYS 6 1HZ LYS 6 26.774 15.153 30.952 45 HZ3 LYS 6 2HZ LYS 6 25.673 14.567 32.026 46 H GLY 7 H GLY 7 22.880 22.562 31.853 47 HA2 GLY 7 2HA GLY 7 23.969 24.533 31.588 48 HA3 GLY 7 3HA GLY 7 25.527 23.711 31.629 49 H PHE 8 H PHE 8 23.520 22.264 29.250 50 HA PHE 8 HA PHE 8 25.061 23.402 27.066 51 HB2 PHE 8 2HB PHE 8 22.672 21.515 27.064 52 HB3 PHE 8 3HB PHE 8 23.682 21.877 25.680 53 HD1 PHE 8 HD1 PHE 8 23.065 19.307 27.798 54 HD2 PHE 8 HD2 PHE 8 26.413 21.699 26.501 55 HE1 PHE 8 HE1 PHE 8 24.604 17.432 28.286 56 HE2 PHE 8 HE2 PHE 8 27.950 19.815 27.017 57 HZ PHE 8 HZ PHE 8 27.047 17.685 27.906 58 H GLY 9 H GLY 9 23.875 24.089 25.046 59 HA2 GLY 9 2HA GLY 9 22.352 26.491 25.787 60 HA3 GLY 9 3HA GLY 9 23.187 26.155 24.270 61 H CYS 10 H CYS 10 20.240 26.736 25.458 62 HA CYS 10 HA CYS 10 18.713 25.088 23.537 63 HB2 CYS 10 2HB CYS 10 17.866 27.396 25.337 64 HB3 CYS 10 3HB CYS 10 16.803 26.452 24.295 65 H LEU 11 H LEU 11 20.188 25.762 21.824 66 HA LEU 11 HA LEU 11 20.354 28.440 20.848 67 HB2 LEU 11 2HB LEU 11 20.888 25.654 19.786 68 HB3 LEU 11 3HB LEU 11 20.866 26.971 18.644 69 HG LEU 11 HG LEU 11 23.087 26.527 19.208 70 HD11 LEU 11 1HD1 LEU 11 23.967 28.639 19.998 71 HD12 LEU 11 2HD1 LEU 11 22.385 29.114 20.627 72 HD13 LEU 11 3HD1 LEU 11 22.635 28.895 18.874 73 HD21 LEU 11 3HD2 LEU 11 22.506 27.053 22.150 74 HD22 LEU 11 1HD2 LEU 11 24.069 26.615 21.434 75 HD23 LEU 11 2HD2 LEU 11 22.743 25.442 21.426 76 HA PRO 12 HA PRO 12 16.545 28.729 18.526 77 HB2 PRO 12 3HB PRO 12 17.214 30.915 18.104 78 HB3 PRO 12 2HB PRO 12 17.166 30.317 16.414 79 HG2 PRO 12 2HG PRO 12 19.510 29.940 16.393 80 HG3 PRO 12 3HG PRO 12 19.427 31.428 17.395 81 HD2 PRO 12 2HD PRO 12 20.579 29.074 18.225 82 HD3 PRO 12 3HD PRO 12 19.852 30.217 19.366 83 H GLN 13 H GLN 13 15.574 28.269 16.383 84 HA GLN 13 HA GLN 13 16.314 25.634 15.523 85 HB2 GLN 13 2HB GLN 13 14.175 27.453 14.358 86 HB3 GLN 13 3HB GLN 13 14.290 25.697 14.258 87 HG2 GLN 13 2HG GLN 13 12.683 25.940 15.897 88 HG3 GLN 13 3HG GLN 13 14.146 25.713 16.859 89 HE21 GLN 13 2HE2 GLN 13 13.565 28.751 18.584 90 HE22 GLN 13 1HE2 GLN 13 14.283 27.153 18.574 91 H SER 14 H SER 14 17.817 28.345 14.609 92 HA SER 14 HA SER 14 18.261 27.513 11.775 93 HB2 SER 14 2HB SER 14 16.736 29.502 12.078 94 HB3 SER 14 3HB SER 14 18.096 30.367 12.819 95 HG SER 14 HG SER 14 19.238 29.894 10.824 96 H ASP 15 H ASP 15 19.790 27.291 14.573 97 HA ASP 15 HA ASP 15 22.440 28.122 13.488 98 HB2 ASP 15 2HB ASP 15 21.559 29.789 15.147 99 HB3 ASP 15 3HB ASP 15 21.551 28.503 16.361 100 H CYS 16 H CYS 16 20.720 26.113 15.912 101 HA CYS 16 HA CYS 16 22.750 24.616 16.976 102 HB2 CYS 16 2HB CYS 16 20.515 24.737 17.827 103 HB3 CYS 16 3HB CYS 16 19.851 23.977 16.405 104 HA PRO 17 HA PRO 17 23.773 22.335 13.128 105 HB2 PRO 17 3HB PRO 17 25.948 23.122 13.344 106 HB3 PRO 17 2HB PRO 17 26.251 21.421 13.819 107 HG2 PRO 17 2HG PRO 17 26.189 21.953 16.121 108 HG3 PRO 17 3HG PRO 17 26.949 23.442 15.481 109 HD2 PRO 17 2HD PRO 17 24.634 23.473 16.956 110 HD3 PRO 17 3HD PRO 17 24.969 24.659 15.674 111 H GLN 18 H GLN 18 23.577 20.167 12.580 112 HA GLN 18 HA GLN 18 22.337 18.424 14.363 113 HB2 GLN 18 2HB GLN 18 22.514 16.721 12.648 114 HB3 GLN 18 3HB GLN 18 21.905 18.274 12.054 115 HG2 GLN 18 2HG GLN 18 24.111 18.815 11.157 116 HG3 GLN 18 3HG GLN 18 24.768 17.309 11.816 117 HE21 GLN 18 2HE2 GLN 18 22.211 17.119 8.536 118 HE22 GLN 18 1HE2 GLN 18 22.036 18.423 9.692 119 H GLU 19 H GLU 19 25.739 18.815 13.729 120 HA GLU 19 HA GLU 19 26.768 16.374 14.766 121 HB2 GLU 19 2HB GLU 19 27.939 19.179 14.575 122 HB3 GLU 19 3HB GLU 19 28.862 17.739 15.039 123 HG2 GLU 19 2HG GLU 19 28.341 16.675 12.871 124 HG3 GLU 19 3HG GLU 19 27.425 18.101 12.374 125 H ALA 20 H ALA 20 25.670 19.333 16.385 126 HA ALA 20 HA ALA 20 26.747 18.428 18.990 127 HB1 ALA 20 1HB ALA 20 26.290 20.701 19.732 128 HB2 ALA 20 2HB ALA 20 27.243 20.718 18.239 129 HB3 ALA 20 3HB ALA 20 25.502 21.076 18.186 130 H ARG 21 H ARG 21 23.769 18.138 17.293 131 HA ARG 21 HA ARG 21 21.892 18.541 19.397 132 HB2 ARG 21 2HB ARG 21 21.802 16.675 16.993 133 HB3 ARG 21 3HB ARG 21 20.446 16.962 18.095 134 HG2 ARG 21 2HG ARG 21 20.589 19.412 17.589 135 HG3 ARG 21 3HG ARG 21 21.805 19.057 16.368 136 HD2 ARG 21 2HD ARG 21 18.879 18.252 16.394 137 HD3 ARG 21 3HD ARG 21 19.729 19.313 15.251 138 HE ARG 21 HE ARG 21 20.863 16.683 15.205 139 HH11 ARG 21 1HH1 ARG 21 17.981 18.437 14.095 140 HH12 ARG 21 2HH1 ARG 21 17.714 17.358 12.747 141 HH21 ARG 21 2HH2 ARG 21 19.138 15.574 12.398 142 HH22 ARG 21 1HH2 ARG 21 20.473 15.300 13.493 143 H LEU 22 H LEU 22 21.659 17.524 21.252 144 HA LEU 22 HA LEU 22 23.159 15.148 21.926 145 HB2 LEU 22 2HB LEU 22 21.192 16.987 23.342 146 HB3 LEU 22 3HB LEU 22 21.795 15.552 24.154 147 HG LEU 22 HG LEU 22 23.778 17.473 22.883 148 HD11 LEU 22 1HD1 LEU 22 22.310 18.868 24.201 149 HD12 LEU 22 2HD1 LEU 22 23.909 18.715 24.954 150 HD13 LEU 22 3HD1 LEU 22 22.534 17.797 25.612 151 HD21 LEU 22 3HD2 LEU 22 23.903 15.703 25.367 152 HD22 LEU 22 1HD2 LEU 22 25.237 16.647 24.668 153 HD23 LEU 22 2HD2 LEU 22 24.557 15.274 23.770 154 H SER 23 H SER 23 21.967 13.468 23.293 155 HA SER 23 HA SER 23 20.159 11.958 21.584 156 HB2 SER 23 2HB SER 23 21.959 10.980 23.042 157 HB3 SER 23 3HB SER 23 21.011 11.452 24.463 158 HG SER 23 HG SER 23 20.158 9.723 22.377 159 H TYR 24 H TYR 24 19.689 14.464 23.807 160 HA TYR 24 HA TYR 24 16.792 13.985 24.066 161 HB2 TYR 24 2HB TYR 24 17.081 14.825 26.489 162 HB3 TYR 24 3HB TYR 24 17.517 13.175 26.125 163 HD1 TYR 24 HD1 TYR 24 19.268 16.557 26.154 164 HD2 TYR 24 HD2 TYR 24 19.406 12.366 27.119 165 HE1 TYR 24 HE1 TYR 24 21.440 16.900 27.298 166 HE2 TYR 24 HE2 TYR 24 21.649 12.699 28.200 167 HH TYR 24 HH TYR 24 23.256 15.884 28.256 168 H GLY 25 H GLY 25 15.773 16.049 25.042 169 HA2 GLY 25 2HA GLY 25 17.035 18.576 24.222 170 HA3 GLY 25 3HA GLY 25 15.662 18.026 23.240 171 H GLY 26 H GLY 26 16.671 18.653 26.603 172 HA2 GLY 26 2HA GLY 26 14.063 18.858 27.766 173 HA3 GLY 26 3HA GLY 26 15.586 19.434 28.449 174 H CYS 27 H CYS 27 15.798 21.036 25.727 175 HA CYS 27 HA CYS 27 14.591 23.545 26.471 176 HB2 CYS 27 2HB CYS 27 15.737 22.483 23.873 177 HB3 CYS 27 3HB CYS 27 15.391 24.176 24.197 178 H SER 28 H SER 28 13.276 24.605 24.451 179 HA SER 28 HA SER 28 10.755 23.054 24.436 180 HB2 SER 28 2HB SER 28 9.675 25.180 23.994 181 HB3 SER 28 3HB SER 28 10.720 25.290 25.419 182 HG SER 28 HG SER 28 10.942 27.070 24.004 183 H THR 29 H THR 29 13.321 23.847 22.290 184 HA THR 29 HA THR 29 11.688 22.972 19.967 185 HB THR 29 HB THR 29 12.763 24.606 18.520 186 HG1 THR 29 1HG THR 29 13.795 25.741 20.909 187 HG21 THR 29 1HG2 THR 29 11.529 26.583 19.191 188 HG22 THR 29 2HG2 THR 29 11.423 26.008 20.865 189 HG23 THR 29 3HG2 THR 29 10.564 25.144 19.567 190 H VAL 30 H VAL 30 15.046 23.739 20.943 191 HA VAL 30 HA VAL 30 15.992 21.097 20.080 192 HB VAL 30 HB VAL 30 17.830 22.049 18.701 193 HG11 VAL 30 1HG1 VAL 30 15.131 22.778 17.516 194 HG12 VAL 30 2HG1 VAL 30 16.623 22.370 16.650 195 HG13 VAL 30 3HG1 VAL 30 15.808 21.131 17.618 196 HG21 VAL 30 3HG2 VAL 30 16.318 24.684 18.799 197 HG22 VAL 30 1HG2 VAL 30 17.931 24.338 19.481 198 HG23 VAL 30 2HG2 VAL 30 17.683 24.296 17.731 199 H CYS 31 H CYS 31 18.078 20.579 20.884 200 HA CYS 31 HA CYS 31 19.355 22.504 22.731 201 HB2 CYS 31 2HB CYS 31 17.889 20.830 24.011 202 HB3 CYS 31 3HB CYS 31 19.030 19.589 23.469 203 H CYS 32 H CYS 32 21.220 22.868 21.750 204 HA CYS 32 HA CYS 32 22.828 20.600 20.662 205 HB2 CYS 32 2HB CYS 32 22.693 23.540 20.007 206 HB3 CYS 32 3HB CYS 32 24.226 22.676 19.871 207 H ASP 33 H ASP 33 24.702 20.069 21.621 208 HA ASP 33 HA ASP 33 25.297 21.016 24.245 209 HB2 ASP 33 2HB ASP 33 27.006 19.422 24.293 210 HB3 ASP 33 3HB ASP 33 25.708 18.707 23.380 211 H LEU 34 H LEU 34 27.485 21.734 24.878 212 HA LEU 34 HA LEU 34 28.673 23.771 23.053 213 HB2 LEU 34 2HB LEU 34 28.212 23.940 26.054 214 HB3 LEU 34 3HB LEU 34 29.052 25.145 25.084 215 HG LEU 34 HG LEU 34 26.106 24.406 24.754 216 HD11 LEU 34 1HD1 LEU 34 26.557 25.521 26.897 217 HD12 LEU 34 2HD1 LEU 34 25.657 26.581 25.803 218 HD13 LEU 34 3HD1 LEU 34 27.399 26.838 26.054 219 HD21 LEU 34 3HD2 LEU 34 27.050 25.272 22.640 220 HD22 LEU 34 1HD2 LEU 34 27.756 26.656 23.503 221 HD23 LEU 34 2HD2 LEU 34 25.992 26.476 23.379 222 H SER 35 H SER 35 29.228 20.822 24.128 223 HA SER 35 HA SER 35 31.538 20.798 25.709 224 HB2 SER 35 2HB SER 35 29.928 18.927 25.326 225 HB3 SER 35 3HB SER 35 30.505 18.789 23.661 226 HG SER 35 HG SER 35 31.957 18.357 26.056 227 H LYS 36 H LYS 36 31.231 21.213 22.195 228 HA LYS 36 HA LYS 36 33.915 20.553 21.485 229 HB2 LYS 36 2HB LYS 36 33.393 21.663 19.367 230 HB3 LYS 36 3HB LYS 36 32.147 20.532 19.874 231 HG2 LYS 36 2HG LYS 36 30.669 22.365 20.562 232 HG3 LYS 36 3HG LYS 36 31.960 23.542 20.308 233 HD2 LYS 36 2HD LYS 36 30.483 23.746 18.487 234 HD3 LYS 36 3HD LYS 36 31.948 23.007 17.861 235 HE2 LYS 36 2HE LYS 36 29.497 21.377 18.662 236 HE3 LYS 36 3HE LYS 36 29.659 22.118 17.063 237 HZ1 LYS 36 3HZ LYS 36 31.489 20.135 18.210 238 HZ2 LYS 36 1HZ LYS 36 31.692 20.884 16.755 239 HZ3 LYS 36 2HZ LYS 36 30.407 19.882 17.003 240 H LEU 37 H LEU 37 32.761 23.358 23.161 241 HA LEU 37 HA LEU 37 34.741 25.247 22.263 242 HB2 LEU 37 2HB LEU 37 33.131 25.083 24.840 243 HB3 LEU 37 3HB LEU 37 34.141 26.448 24.380 244 HG LEU 37 HG LEU 37 31.741 25.475 22.758 245 HD11 LEU 37 1HD1 LEU 37 30.557 27.413 23.679 246 HD12 LEU 37 2HD1 LEU 37 31.973 27.839 24.671 247 HD13 LEU 37 3HD1 LEU 37 31.083 26.333 24.983 248 HD21 LEU 37 3HD2 LEU 37 33.419 28.023 22.564 249 HD22 LEU 37 1HD2 LEU 37 31.924 27.695 21.656 250 HD23 LEU 37 2HD2 LEU 37 33.361 26.707 21.367 251 H THR 38 H THR 38 34.530 23.348 25.348 252 HA THR 38 HA THR 38 37.333 23.693 25.948 253 HB THR 38 HB THR 38 36.788 22.082 27.779 254 HG1 THR 38 1HG THR 38 34.097 22.293 27.025 255 HG21 THR 38 1HG2 THR 38 35.305 23.570 29.041 256 HG22 THR 38 2HG2 THR 38 34.872 24.433 27.550 257 HG23 THR 38 3HG2 THR 38 36.543 24.480 28.155 258 H GLY 39 H GLY 39 35.696 21.601 23.799 259 HA2 GLY 39 2HA GLY 39 37.818 19.502 23.923 260 HA3 GLY 39 3HA GLY 39 36.161 19.279 23.345 Start of MODEL 7 1 H1 ASN 1 H1 ASN 1 12.355 18.768 32.294 2 H2 ASN 1 H2 ASN 1 13.523 17.742 32.846 3 H3 ASN 1 H3 ASN 1 13.509 19.318 33.335 4 HA ASN 1 HA ASN 1 13.936 18.381 30.601 5 HB2 ASN 1 2HB ASN 1 14.757 20.765 30.256 6 HB3 ASN 1 3HB ASN 1 13.023 20.446 30.284 7 HD21 ASN 1 2HD2 ASN 1 12.933 23.420 32.224 8 HD22 ASN 1 1HD2 ASN 1 12.767 22.767 30.605 9 H GLU 2 H GLU 2 15.608 17.065 30.716 10 HA GLU 2 HA GLU 2 17.854 17.390 32.453 11 HB2 GLU 2 2HB GLU 2 17.132 15.231 31.526 12 HB3 GLU 2 3HB GLU 2 17.448 15.786 29.904 13 HG2 GLU 2 2HG GLU 2 19.233 14.353 30.510 14 HG3 GLU 2 3HG GLU 2 19.892 15.972 30.440 15 H CYS 3 H CYS 3 17.410 18.068 28.965 16 HA CYS 3 HA CYS 3 20.064 18.883 28.450 17 HB2 CYS 3 2HB CYS 3 17.845 18.480 26.950 18 HB3 CYS 3 3HB CYS 3 17.967 20.233 26.824 19 H VAL 4 H VAL 4 17.455 20.723 29.896 20 HA VAL 4 HA VAL 4 18.791 23.323 29.703 21 HB VAL 4 HB VAL 4 16.301 22.410 31.197 22 HG11 VAL 4 1HG1 VAL 4 15.761 24.847 31.295 23 HG12 VAL 4 2HG1 VAL 4 17.189 24.424 32.242 24 HG13 VAL 4 3HG1 VAL 4 17.386 25.208 30.657 25 HG21 VAL 4 3HG2 VAL 4 15.978 22.213 28.755 26 HG22 VAL 4 1HG2 VAL 4 15.078 23.608 29.361 27 HG23 VAL 4 2HG2 VAL 4 16.624 23.847 28.518 28 H SER 5 H SER 5 18.140 20.804 32.188 29 HA SER 5 HA SER 5 19.330 22.095 34.420 30 HB2 SER 5 2HB SER 5 17.850 20.087 34.504 31 HB3 SER 5 3HB SER 5 19.140 19.123 33.763 32 HG SER 5 HG SER 5 19.129 20.422 36.278 33 H LYS 6 H LYS 6 20.738 20.157 31.810 34 HA LYS 6 HA LYS 6 23.439 19.965 32.770 35 HB2 LYS 6 2HB LYS 6 22.049 19.736 30.083 36 HB3 LYS 6 3HB LYS 6 23.785 19.509 30.243 37 HG2 LYS 6 2HG LYS 6 21.872 17.886 31.954 38 HG3 LYS 6 3HG LYS 6 22.196 17.435 30.278 39 HD2 LYS 6 2HD LYS 6 24.608 17.295 30.738 40 HD3 LYS 6 3HD LYS 6 24.340 17.752 32.429 41 HE2 LYS 6 2HE LYS 6 23.085 15.315 31.093 42 HE3 LYS 6 3HE LYS 6 24.611 15.269 31.995 43 HZ1 LYS 6 3HZ LYS 6 23.457 16.008 33.931 44 HZ2 LYS 6 1HZ LYS 6 22.772 14.631 33.348 45 HZ3 LYS 6 2HZ LYS 6 22.020 16.083 33.117 46 H GLY 7 H GLY 7 21.675 22.689 31.498 47 HA2 GLY 7 2HA GLY 7 22.328 24.826 31.173 48 HA3 GLY 7 3HA GLY 7 23.943 24.404 31.744 49 H PHE 8 H PHE 8 22.769 22.592 28.982 50 HA PHE 8 HA PHE 8 24.892 23.379 27.288 51 HB2 PHE 8 2HB PHE 8 22.232 22.011 26.740 52 HB3 PHE 8 3HB PHE 8 23.468 22.216 25.521 53 HD1 PHE 8 HD1 PHE 8 22.191 19.792 27.610 54 HD2 PHE 8 HD2 PHE 8 25.975 21.501 26.438 55 HE1 PHE 8 HE1 PHE 8 23.313 17.658 28.100 56 HE2 PHE 8 HE2 PHE 8 27.103 19.376 26.977 57 HZ PHE 8 HZ PHE 8 25.774 17.431 27.800 58 H GLY 9 H GLY 9 24.614 24.214 25.052 59 HA2 GLY 9 2HA GLY 9 24.057 26.935 25.098 60 HA3 GLY 9 3HA GLY 9 24.291 25.958 23.643 61 H CYS 10 H CYS 10 21.969 24.288 23.983 62 HA CYS 10 HA CYS 10 19.808 24.146 23.324 63 HB2 CYS 10 2HB CYS 10 19.736 24.781 25.738 64 HB3 CYS 10 3HB CYS 10 19.444 26.443 25.243 65 H LEU 11 H LEU 11 21.385 25.630 21.510 66 HA LEU 11 HA LEU 11 20.476 28.168 20.820 67 HB2 LEU 11 2HB LEU 11 21.822 25.924 19.295 68 HB3 LEU 11 3HB LEU 11 21.435 27.406 18.466 69 HG LEU 11 HG LEU 11 23.054 27.349 20.987 70 HD11 LEU 11 1HD1 LEU 11 25.095 27.479 19.649 71 HD12 LEU 11 2HD1 LEU 11 24.147 27.277 18.163 72 HD13 LEU 11 3HD1 LEU 11 24.213 25.972 19.361 73 HD21 LEU 11 3HD2 LEU 11 22.169 29.543 20.576 74 HD22 LEU 11 1HD2 LEU 11 22.816 29.537 18.921 75 HD23 LEU 11 2HD2 LEU 11 23.914 29.533 20.314 76 HA PRO 12 HA PRO 12 16.676 27.561 18.573 77 HB2 PRO 12 3HB PRO 12 16.531 29.869 18.471 78 HB3 PRO 12 2HB PRO 12 16.760 29.587 16.721 79 HG2 PRO 12 2HG PRO 12 19.106 30.029 16.887 80 HG3 PRO 12 3HG PRO 12 18.453 31.222 18.055 81 HD2 PRO 12 2HD PRO 12 20.326 29.380 18.785 82 HD3 PRO 12 3HD PRO 12 19.033 29.851 19.907 83 H GLN 13 H GLN 13 15.845 27.222 16.285 84 HA GLN 13 HA GLN 13 17.254 25.124 15.043 85 HB2 GLN 13 2HB GLN 13 14.987 26.802 13.881 86 HB3 GLN 13 3HB GLN 13 15.517 25.215 13.337 87 HG2 GLN 13 2HG GLN 13 13.754 24.549 14.604 88 HG3 GLN 13 3HG GLN 13 14.989 24.497 15.853 89 HE21 GLN 13 2HE2 GLN 13 11.840 27.145 16.066 90 HE22 GLN 13 1HE2 GLN 13 12.089 26.123 14.659 91 H SER 14 H SER 14 17.495 28.570 14.508 92 HA SER 14 HA SER 14 18.745 28.447 11.891 93 HB2 SER 14 2HB SER 14 18.975 30.871 12.215 94 HB3 SER 14 3HB SER 14 17.332 30.322 12.571 95 HG SER 14 HG SER 14 19.376 30.915 14.459 96 H ASP 15 H ASP 15 19.952 27.636 14.933 97 HA ASP 15 HA ASP 15 22.741 28.479 14.264 98 HB2 ASP 15 2HB ASP 15 21.129 28.804 16.787 99 HB3 ASP 15 3HB ASP 15 22.843 28.502 16.938 100 H CYS 16 H CYS 16 20.739 26.069 16.024 101 HA CYS 16 HA CYS 16 22.875 24.376 16.777 102 HB2 CYS 16 2HB CYS 16 20.746 24.489 17.939 103 HB3 CYS 16 3HB CYS 16 19.877 23.966 16.508 104 HA PRO 17 HA PRO 17 23.084 22.536 12.563 105 HB2 PRO 17 3HB PRO 17 25.319 23.270 12.598 106 HB3 PRO 17 2HB PRO 17 25.578 21.501 12.631 107 HG2 PRO 17 2HG PRO 17 25.819 21.515 15.019 108 HG3 PRO 17 3HG PRO 17 26.677 23.019 14.564 109 HD2 PRO 17 2HD PRO 17 24.581 23.001 16.332 110 HD3 PRO 17 3HD PRO 17 24.891 24.353 15.226 111 H GLN 18 H GLN 18 23.494 20.312 11.725 112 HA GLN 18 HA GLN 18 22.245 18.211 13.214 113 HB2 GLN 18 2HB GLN 18 23.871 18.263 10.641 114 HB3 GLN 18 3HB GLN 18 23.057 16.827 11.245 115 HG2 GLN 18 2HG GLN 18 21.673 19.426 10.472 116 HG3 GLN 18 3HG GLN 18 21.753 17.963 9.495 117 HE21 GLN 18 2HE2 GLN 18 18.500 18.227 11.516 118 HE22 GLN 18 1HE2 GLN 18 19.403 19.465 10.659 119 H GLU 19 H GLU 19 25.495 19.375 13.325 120 HA GLU 19 HA GLU 19 26.669 16.748 13.986 121 HB2 GLU 19 2HB GLU 19 27.907 19.512 13.715 122 HB3 GLU 19 3HB GLU 19 28.793 17.999 13.933 123 HG2 GLU 19 2HG GLU 19 27.116 18.796 11.516 124 HG3 GLU 19 3HG GLU 19 28.868 18.643 11.593 125 H ALA 20 H ALA 20 25.722 19.746 15.623 126 HA ALA 20 HA ALA 20 27.046 18.868 18.131 127 HB1 ALA 20 1HB ALA 20 27.573 21.119 17.229 128 HB2 ALA 20 2HB ALA 20 25.859 21.557 17.415 129 HB3 ALA 20 3HB ALA 20 26.830 21.166 18.840 130 H ARG 21 H ARG 21 23.896 18.693 16.760 131 HA ARG 21 HA ARG 21 22.306 19.026 19.079 132 HB2 ARG 21 2HB ARG 21 20.741 17.504 17.869 133 HB3 ARG 21 3HB ARG 21 21.289 18.927 16.963 134 HG2 ARG 21 2HG ARG 21 22.705 17.657 15.559 135 HG3 ARG 21 3HG ARG 21 22.581 16.211 16.564 136 HD2 ARG 21 2HD ARG 21 21.253 16.024 14.499 137 HD3 ARG 21 3HD ARG 21 20.280 15.888 15.974 138 HE ARG 21 HE ARG 21 20.416 18.566 14.743 139 HH11 ARG 21 1HH1 ARG 21 18.534 15.556 15.006 140 HH12 ARG 21 2HH1 ARG 21 17.046 16.332 14.498 141 HH21 ARG 21 2HH2 ARG 21 17.019 18.541 13.975 142 HH22 ARG 21 1HH2 ARG 21 18.487 19.495 14.067 143 H LEU 22 H LEU 22 21.820 17.742 20.760 144 HA LEU 22 HA LEU 22 23.631 15.563 21.440 145 HB2 LEU 22 2HB LEU 22 21.365 17.048 22.788 146 HB3 LEU 22 3HB LEU 22 22.049 15.611 23.539 147 HG LEU 22 HG LEU 22 23.942 17.814 22.619 148 HD11 LEU 22 1HD1 LEU 22 22.414 17.763 25.227 149 HD12 LEU 22 2HD1 LEU 22 22.222 18.955 23.912 150 HD13 LEU 22 3HD1 LEU 22 23.746 18.867 24.813 151 HD21 LEU 22 3HD2 LEU 22 24.007 15.801 24.927 152 HD22 LEU 22 1HD2 LEU 22 25.292 16.952 24.507 153 HD23 LEU 22 2HD2 LEU 22 24.887 15.638 23.388 154 H SER 23 H SER 23 22.601 13.622 22.549 155 HA SER 23 HA SER 23 21.066 12.121 20.569 156 HB2 SER 23 2HB SER 23 22.933 11.208 21.991 157 HB3 SER 23 3HB SER 23 21.845 11.306 23.390 158 HG SER 23 HG SER 23 21.837 9.246 22.378 159 H TYR 24 H TYR 24 20.193 14.264 23.027 160 HA TYR 24 HA TYR 24 17.376 13.386 23.037 161 HB2 TYR 24 2HB TYR 24 17.339 13.993 25.509 162 HB3 TYR 24 3HB TYR 24 18.105 12.497 25.060 163 HD1 TYR 24 HD1 TYR 24 19.343 16.107 25.379 164 HD2 TYR 24 HD2 TYR 24 19.911 11.942 26.388 165 HE1 TYR 24 HE1 TYR 24 21.268 16.703 26.777 166 HE2 TYR 24 HE2 TYR 24 21.892 12.541 27.731 167 HH TYR 24 HH TYR 24 23.247 14.252 28.502 168 H GLY 25 H GLY 25 16.000 15.176 24.057 169 HA2 GLY 25 2HA GLY 25 16.894 17.909 23.310 170 HA3 GLY 25 3HA GLY 25 15.537 17.171 22.448 171 H GLY 26 H GLY 26 16.682 17.638 25.808 172 HA2 GLY 26 2HA GLY 26 14.050 17.748 26.976 173 HA3 GLY 26 3HA GLY 26 15.587 18.076 27.771 174 H CYS 27 H CYS 27 15.790 20.152 25.240 175 HA CYS 27 HA CYS 27 14.761 22.503 26.603 176 HB2 CYS 27 2HB CYS 27 15.898 21.967 23.848 177 HB3 CYS 27 3HB CYS 27 15.249 23.524 24.304 178 H SER 28 H SER 28 13.408 23.984 24.882 179 HA SER 28 HA SER 28 10.759 22.938 25.195 180 HB2 SER 28 2HB SER 28 11.457 25.322 25.511 181 HB3 SER 28 3HB SER 28 11.711 25.441 23.756 182 HG SER 28 HG SER 28 9.617 26.136 24.518 183 H THR 29 H THR 29 13.049 23.143 22.475 184 HA THR 29 HA THR 29 11.440 21.260 21.046 185 HB THR 29 HB THR 29 10.199 23.288 20.428 186 HG1 THR 29 1HG THR 29 10.201 22.905 18.251 187 HG21 THR 29 1HG2 THR 29 11.064 25.027 19.037 188 HG22 THR 29 2HG2 THR 29 12.637 24.230 18.895 189 HG23 THR 29 3HG2 THR 29 12.122 24.931 20.454 190 H VAL 30 H VAL 30 14.403 23.309 21.120 191 HA VAL 30 HA VAL 30 15.808 21.210 19.632 192 HB VAL 30 HB VAL 30 15.330 22.887 18.027 193 HG11 VAL 30 1HG1 VAL 30 16.016 25.271 18.269 194 HG12 VAL 30 2HG1 VAL 30 14.703 24.840 19.367 195 HG13 VAL 30 3HG1 VAL 30 16.349 24.995 19.989 196 HG21 VAL 30 3HG2 VAL 30 18.126 23.377 19.063 197 HG22 VAL 30 1HG2 VAL 30 17.611 21.978 18.093 198 HG23 VAL 30 2HG2 VAL 30 17.547 23.616 17.396 199 H CYS 31 H CYS 31 17.704 20.686 20.468 200 HA CYS 31 HA CYS 31 19.034 22.435 22.449 201 HB2 CYS 31 2HB CYS 31 17.706 20.545 23.574 202 HB3 CYS 31 3HB CYS 31 18.886 19.449 22.852 203 H CYS 32 H CYS 32 21.199 22.540 22.277 204 HA CYS 32 HA CYS 32 22.751 20.586 20.684 205 HB2 CYS 32 2HB CYS 32 22.268 23.464 19.986 206 HB3 CYS 32 3HB CYS 32 23.952 22.957 20.033 207 H ASP 33 H ASP 33 24.785 20.254 21.511 208 HA ASP 33 HA ASP 33 25.462 21.552 24.053 209 HB2 ASP 33 2HB ASP 33 26.978 19.848 24.383 210 HB3 ASP 33 3HB ASP 33 25.686 19.050 23.535 211 H LEU 34 H LEU 34 27.729 22.307 24.354 212 HA LEU 34 HA LEU 34 28.965 23.671 21.979 213 HB2 LEU 34 2HB LEU 34 28.517 24.740 24.776 214 HB3 LEU 34 3HB LEU 34 29.456 25.540 23.501 215 HG LEU 34 HG LEU 34 26.475 24.911 23.376 216 HD11 LEU 34 1HD1 LEU 34 26.961 26.635 25.077 217 HD12 LEU 34 2HD1 LEU 34 26.188 27.381 23.676 218 HD13 LEU 34 3HD1 LEU 34 27.937 27.536 23.899 219 HD21 LEU 34 3HD2 LEU 34 28.229 26.622 21.534 220 HD22 LEU 34 1HD2 LEU 34 26.467 26.475 21.409 221 HD23 LEU 34 2HD2 LEU 34 27.490 25.073 21.087 222 H SER 35 H SER 35 29.480 21.261 24.195 223 HA SER 35 HA SER 35 31.874 21.940 25.484 224 HB2 SER 35 2HB SER 35 30.272 20.111 26.053 225 HB3 SER 35 3HB SER 35 30.912 19.164 24.695 226 HG SER 35 HG SER 35 31.881 18.757 26.802 227 H LYS 36 H LYS 36 31.421 20.800 22.176 228 HA LYS 36 HA LYS 36 34.056 19.785 21.699 229 HB2 LYS 36 2HB LYS 36 32.084 21.013 19.746 230 HB3 LYS 36 3HB LYS 36 33.423 19.958 19.322 231 HG2 LYS 36 2HG LYS 36 31.053 19.065 21.042 232 HG3 LYS 36 3HG LYS 36 31.106 18.966 19.296 233 HD2 LYS 36 2HD LYS 36 31.627 16.818 20.046 234 HD3 LYS 36 3HD LYS 36 33.145 17.499 19.458 235 HE2 LYS 36 2HE LYS 36 33.858 17.928 21.775 236 HE3 LYS 36 3HE LYS 36 32.286 17.383 22.384 237 HZ1 LYS 36 3HZ LYS 36 33.969 15.678 22.532 238 HZ2 LYS 36 1HZ LYS 36 34.215 15.725 20.903 239 HZ3 LYS 36 2HZ LYS 36 32.774 15.214 21.502 240 H LEU 37 H LEU 37 32.917 23.060 21.986 241 HA LEU 37 HA LEU 37 34.919 24.380 20.414 242 HB2 LEU 37 2HB LEU 37 33.360 25.288 22.856 243 HB3 LEU 37 3HB LEU 37 34.369 26.337 21.881 244 HG LEU 37 HG LEU 37 31.948 24.834 20.788 245 HD11 LEU 37 1HD1 LEU 37 30.736 26.950 20.922 246 HD12 LEU 37 2HD1 LEU 37 32.153 27.756 21.634 247 HD13 LEU 37 3HD1 LEU 37 31.306 26.481 22.535 248 HD21 LEU 37 3HD2 LEU 37 32.100 26.430 18.900 249 HD22 LEU 37 1HD2 LEU 37 33.605 25.510 19.032 250 HD23 LEU 37 2HD2 LEU 37 33.539 27.180 19.627 251 H THR 38 H THR 38 35.019 22.937 23.650 252 HA THR 38 HA THR 38 37.736 24.016 24.139 253 HB THR 38 HB THR 38 37.089 23.572 26.532 254 HG1 THR 38 1HG THR 38 35.308 22.233 26.170 255 HG21 THR 38 1HG2 THR 38 35.824 25.654 26.784 256 HG22 THR 38 2HG2 THR 38 35.403 25.637 25.060 257 HG23 THR 38 3HG2 THR 38 37.092 25.849 25.563 258 H GLY 39 H GLY 39 36.295 21.281 23.014 259 HA2 GLY 39 2HA GLY 39 38.584 19.595 23.747 260 HA3 GLY 39 3HA GLY 39 37.034 19.051 24.425 Start of MODEL 8 1 H1 ASN 1 H1 ASN 1 15.789 21.896 34.502 2 H2 ASN 1 H2 ASN 1 14.226 22.218 34.101 3 H3 ASN 1 H3 ASN 1 14.652 20.706 34.605 4 HA ASN 1 HA ASN 1 14.324 20.722 32.257 5 HB2 ASN 1 2HB ASN 1 14.983 23.173 32.079 6 HB3 ASN 1 3HB ASN 1 16.666 22.642 32.153 7 HD21 ASN 1 2HD2 ASN 1 15.211 22.983 28.573 8 HD22 ASN 1 1HD2 ASN 1 14.891 23.960 29.993 9 H GLU 2 H GLU 2 15.077 18.844 31.605 10 HA GLU 2 HA GLU 2 17.076 17.376 32.905 11 HB2 GLU 2 2HB GLU 2 15.085 16.614 31.548 12 HB3 GLU 2 3HB GLU 2 15.993 16.977 30.085 13 HG2 GLU 2 2HG GLU 2 17.772 15.367 30.851 14 HG3 GLU 2 3HG GLU 2 16.773 14.974 32.256 15 H CYS 3 H CYS 3 17.235 19.280 29.895 16 HA CYS 3 HA CYS 3 19.858 18.312 29.129 17 HB2 CYS 3 2HB CYS 3 17.839 20.050 27.962 18 HB3 CYS 3 3HB CYS 3 19.413 20.828 27.911 19 H VAL 4 H VAL 4 18.710 21.200 30.911 20 HA VAL 4 HA VAL 4 21.301 22.453 31.120 21 HB VAL 4 HB VAL 4 18.801 22.799 32.822 22 HG11 VAL 4 1HG1 VAL 4 19.740 25.055 33.317 23 HG12 VAL 4 2HG1 VAL 4 20.739 23.755 33.967 24 HG13 VAL 4 3HG1 VAL 4 21.240 24.597 32.481 25 HG21 VAL 4 3HG2 VAL 4 18.338 24.756 31.393 26 HG22 VAL 4 1HG2 VAL 4 19.762 24.378 30.395 27 HG23 VAL 4 2HG2 VAL 4 18.365 23.284 30.416 28 H SER 5 H SER 5 19.457 20.158 33.141 29 HA SER 5 HA SER 5 21.212 20.077 35.389 30 HB2 SER 5 2HB SER 5 18.822 19.273 35.250 31 HB3 SER 5 3HB SER 5 19.398 17.883 34.309 32 HG SER 5 HG SER 5 19.969 18.598 36.985 33 H LYS 6 H LYS 6 21.261 18.439 32.245 34 HA LYS 6 HA LYS 6 23.536 16.700 32.850 35 HB2 LYS 6 2HB LYS 6 21.911 17.420 30.395 36 HB3 LYS 6 3HB LYS 6 23.397 16.500 30.259 37 HG2 LYS 6 2HG LYS 6 21.174 15.590 32.116 38 HG3 LYS 6 3HG LYS 6 21.127 15.227 30.391 39 HD2 LYS 6 2HD LYS 6 23.437 14.450 32.222 40 HD3 LYS 6 3HD LYS 6 22.068 13.397 31.821 41 HE2 LYS 6 2HE LYS 6 22.626 13.586 29.413 42 HE3 LYS 6 3HE LYS 6 24.040 14.577 29.826 43 HZ1 LYS 6 3HZ LYS 6 23.590 11.807 30.693 44 HZ2 LYS 6 1HZ LYS 6 24.909 12.725 31.052 45 HZ3 LYS 6 2HZ LYS 6 24.612 12.295 29.490 46 H GLY 7 H GLY 7 23.224 20.061 32.092 47 HA2 GLY 7 2HA GLY 7 24.997 21.545 32.167 48 HA3 GLY 7 3HA GLY 7 26.139 20.271 31.764 49 H PHE 8 H PHE 8 23.399 20.389 29.624 50 HA PHE 8 HA PHE 8 25.087 21.374 27.428 51 HB2 PHE 8 2HB PHE 8 22.252 20.274 27.456 52 HB3 PHE 8 3HB PHE 8 23.239 20.557 26.030 53 HD1 PHE 8 HD1 PHE 8 22.050 17.979 27.968 54 HD2 PHE 8 HD2 PHE 8 25.773 19.442 26.365 55 HE1 PHE 8 HE1 PHE 8 22.967 15.686 27.982 56 HE2 PHE 8 HE2 PHE 8 26.657 17.132 26.319 57 HZ PHE 8 HZ PHE 8 25.274 15.244 27.164 58 H GLY 9 H GLY 9 24.079 22.776 25.752 59 HA2 GLY 9 2HA GLY 9 22.835 25.193 26.884 60 HA3 GLY 9 3HA GLY 9 23.500 24.961 25.263 61 H CYS 10 H CYS 10 21.407 26.254 25.018 62 HA CYS 10 HA CYS 10 19.318 24.403 24.031 63 HB2 CYS 10 2HB CYS 10 18.797 25.364 26.361 64 HB3 CYS 10 3HB CYS 10 18.609 26.918 25.565 65 H LEU 11 H LEU 11 20.857 25.016 22.228 66 HA LEU 11 HA LEU 11 21.024 27.614 21.126 67 HB2 LEU 11 2HB LEU 11 21.366 24.810 20.038 68 HB3 LEU 11 3HB LEU 11 21.594 26.208 19.010 69 HG LEU 11 HG LEU 11 23.384 27.034 20.488 70 HD11 LEU 11 1HD1 LEU 11 24.475 25.319 22.032 71 HD12 LEU 11 2HD1 LEU 11 22.954 24.423 21.992 72 HD13 LEU 11 3HD1 LEU 11 23.005 26.077 22.643 73 HD21 LEU 11 3HD2 LEU 11 23.764 24.258 19.324 74 HD22 LEU 11 1HD2 LEU 11 25.071 25.374 19.763 75 HD23 LEU 11 2HD2 LEU 11 23.925 25.807 18.489 76 HA PRO 12 HA PRO 12 17.157 27.916 18.864 77 HB2 PRO 12 3HB PRO 12 17.771 30.098 18.375 78 HB3 PRO 12 2HB PRO 12 17.831 29.457 16.704 79 HG2 PRO 12 2HG PRO 12 20.186 29.124 16.829 80 HG3 PRO 12 3HG PRO 12 20.020 30.643 17.766 81 HD2 PRO 12 2HD PRO 12 21.203 28.411 18.805 82 HD3 PRO 12 3HD PRO 12 20.232 29.508 19.823 83 H GLN 13 H GLN 13 16.144 27.299 16.775 84 HA GLN 13 HA GLN 13 17.032 24.756 15.869 85 HB2 GLN 13 2HB GLN 13 14.936 26.668 14.773 86 HB3 GLN 13 3HB GLN 13 15.166 25.011 14.202 87 HG2 GLN 13 2HG GLN 13 14.705 24.133 16.458 88 HG3 GLN 13 3HG GLN 13 14.469 25.772 17.074 89 HE21 GLN 13 2HE2 GLN 13 11.263 26.233 15.482 90 HE22 GLN 13 1HE2 GLN 13 12.666 27.091 16.085 91 H SER 14 H SER 14 17.805 27.960 14.667 92 HA SER 14 HA SER 14 18.780 27.039 12.070 93 HB2 SER 14 2HB SER 14 18.937 29.705 13.522 94 HB3 SER 14 3HB SER 14 19.523 29.413 11.871 95 HG SER 14 HG SER 14 17.405 28.781 11.306 96 H ASP 15 H ASP 15 20.073 26.752 15.182 97 HA ASP 15 HA ASP 15 22.853 26.647 14.132 98 HB2 ASP 15 2HB ASP 15 22.280 28.689 15.580 99 HB3 ASP 15 3HB ASP 15 22.082 27.557 16.923 100 H CYS 16 H CYS 16 20.363 24.776 15.255 101 HA CYS 16 HA CYS 16 22.167 22.802 16.561 102 HB2 CYS 16 2HB CYS 16 20.786 24.031 18.156 103 HB3 CYS 16 3HB CYS 16 19.333 23.513 17.324 104 HA PRO 17 HA PRO 17 20.136 20.751 12.923 105 HB2 PRO 17 3HB PRO 17 22.030 21.260 11.645 106 HB3 PRO 17 2HB PRO 17 22.334 19.513 11.894 107 HG2 PRO 17 2HG PRO 17 23.755 19.978 13.801 108 HG3 PRO 17 3HG PRO 17 24.238 21.243 12.629 109 HD2 PRO 17 2HD PRO 17 23.411 21.906 15.104 110 HD3 PRO 17 3HD PRO 17 22.888 22.878 13.701 111 H GLN 18 H GLN 18 20.223 18.329 12.339 112 HA GLN 18 HA GLN 18 19.886 16.669 14.654 113 HB2 GLN 18 2HB GLN 18 19.996 16.046 11.676 114 HB3 GLN 18 3HB GLN 18 19.699 14.837 12.927 115 HG2 GLN 18 2HG GLN 18 17.737 16.227 13.731 116 HG3 GLN 18 3HG GLN 18 17.962 17.245 12.304 117 HE21 GLN 18 2HE2 GLN 18 15.715 15.135 10.572 118 HE22 GLN 18 1HE2 GLN 18 16.205 16.759 11.012 119 H GLU 19 H GLU 19 22.759 17.666 13.175 120 HA GLU 19 HA GLU 19 24.317 15.239 13.746 121 HB2 GLU 19 2HB GLU 19 25.077 18.053 12.857 122 HB3 GLU 19 3HB GLU 19 26.211 16.696 13.025 123 HG2 GLU 19 2HG GLU 19 24.842 15.393 11.381 124 HG3 GLU 19 3HG GLU 19 23.835 16.823 11.122 125 H ALA 20 H ALA 20 23.465 18.257 15.308 126 HA ALA 20 HA ALA 20 25.469 17.852 17.475 127 HB1 ALA 20 1HB ALA 20 25.633 19.929 16.185 128 HB2 ALA 20 2HB ALA 20 23.951 20.322 16.585 129 HB3 ALA 20 3HB ALA 20 25.180 20.249 17.873 130 H ARG 21 H ARG 21 22.129 17.377 16.916 131 HA ARG 21 HA ARG 21 21.019 18.168 19.404 132 HB2 ARG 21 2HB ARG 21 19.131 16.790 18.822 133 HB3 ARG 21 3HB ARG 21 19.698 17.642 17.380 134 HG2 ARG 21 2HG ARG 21 20.848 15.597 16.630 135 HG3 ARG 21 3HG ARG 21 20.269 14.719 18.053 136 HD2 ARG 21 2HD ARG 21 17.974 14.914 17.379 137 HD3 ARG 21 3HD ARG 21 18.366 16.093 16.129 138 HE ARG 21 HE ARG 21 19.323 14.441 14.772 139 HH11 ARG 21 1HH1 ARG 21 18.022 12.920 17.722 140 HH12 ARG 21 2HH1 ARG 21 18.079 11.320 17.006 141 HH21 ARG 21 2HH2 ARG 21 18.814 11.006 14.918 142 HH22 ARG 21 1HH2 ARG 21 19.376 12.343 13.935 143 H LEU 22 H LEU 22 20.072 16.654 21.040 144 HA LEU 22 HA LEU 22 21.884 14.385 21.709 145 HB2 LEU 22 2HB LEU 22 20.924 16.613 23.535 146 HB3 LEU 22 3HB LEU 22 21.889 15.218 24.022 147 HG LEU 22 HG LEU 22 22.878 17.341 22.062 148 HD11 LEU 22 1HD1 LEU 22 24.190 18.164 23.934 149 HD12 LEU 22 2HD1 LEU 22 23.394 16.973 24.996 150 HD13 LEU 22 3HD1 LEU 22 22.453 18.293 24.262 151 HD21 LEU 22 3HD2 LEU 22 24.356 15.134 23.572 152 HD22 LEU 22 1HD2 LEU 22 25.095 16.371 22.528 153 HD23 LEU 22 2HD2 LEU 22 24.039 15.143 21.826 154 H SER 23 H SER 23 21.039 13.065 23.499 155 HA SER 23 HA SER 23 18.372 12.153 22.803 156 HB2 SER 23 2HB SER 23 20.380 10.717 23.085 157 HB3 SER 23 3HB SER 23 20.389 11.088 24.820 158 HG SER 23 HG SER 23 18.429 10.065 25.012 159 H TYR 24 H TYR 24 19.481 14.346 25.153 160 HA TYR 24 HA TYR 24 17.480 13.615 27.190 161 HB2 TYR 24 2HB TYR 24 19.699 15.599 27.581 162 HB3 TYR 24 3HB TYR 24 18.954 14.546 28.778 163 HD1 TYR 24 HD1 TYR 24 19.695 12.123 28.928 164 HD2 TYR 24 HD2 TYR 24 21.425 14.884 26.132 165 HE1 TYR 24 HE1 TYR 24 21.546 10.527 28.528 166 HE2 TYR 24 HE2 TYR 24 23.320 13.318 25.723 167 HH TYR 24 HH TYR 24 23.449 10.076 27.303 168 H GLY 25 H GLY 25 17.606 15.484 24.795 169 HA2 GLY 25 2HA GLY 25 17.247 18.111 24.935 170 HA3 GLY 25 3HA GLY 25 16.206 17.146 23.900 171 H GLY 26 H GLY 26 16.480 18.790 27.006 172 HA2 GLY 26 2HA GLY 26 13.612 18.519 27.628 173 HA3 GLY 26 3HA GLY 26 14.877 19.176 28.657 174 H CYS 27 H CYS 27 15.329 20.645 25.680 175 HA CYS 27 HA CYS 27 14.174 23.189 26.380 176 HB2 CYS 27 2HB CYS 27 15.396 22.021 23.865 177 HB3 CYS 27 3HB CYS 27 14.852 23.689 23.968 178 H SER 28 H SER 28 12.837 24.301 24.489 179 HA SER 28 HA SER 28 10.261 22.858 24.480 180 HB2 SER 28 2HB SER 28 10.925 25.722 23.698 181 HB3 SER 28 3HB SER 28 9.310 25.013 23.855 182 HG SER 28 HG SER 28 9.874 24.573 26.079 183 H THR 29 H THR 29 12.872 23.545 22.320 184 HA THR 29 HA THR 29 11.317 22.443 20.058 185 HB THR 29 HB THR 29 12.501 23.915 18.497 186 HG1 THR 29 1HG THR 29 13.322 25.344 20.804 187 HG21 THR 29 1HG2 THR 29 10.231 24.548 19.346 188 HG22 THR 29 2HG2 THR 29 11.233 25.948 18.905 189 HG23 THR 29 3HG2 THR 29 11.011 25.516 20.614 190 H VAL 30 H VAL 30 14.674 23.280 21.062 191 HA VAL 30 HA VAL 30 15.623 20.567 20.439 192 HB VAL 30 HB VAL 30 17.374 21.387 18.889 193 HG11 VAL 30 1HG1 VAL 30 16.092 21.491 16.870 194 HG12 VAL 30 2HG1 VAL 30 15.291 20.366 17.975 195 HG13 VAL 30 3HG1 VAL 30 14.635 22.002 17.736 196 HG21 VAL 30 3HG2 VAL 30 17.134 23.538 17.718 197 HG22 VAL 30 1HG2 VAL 30 15.850 24.021 18.837 198 HG23 VAL 30 2HG2 VAL 30 17.503 23.737 19.429 199 H CYS 31 H CYS 31 17.726 20.134 21.205 200 HA CYS 31 HA CYS 31 19.036 22.154 22.960 201 HB2 CYS 31 2HB CYS 31 17.714 20.664 24.386 202 HB3 CYS 31 3HB CYS 31 18.408 19.257 23.573 203 H CYS 32 H CYS 32 21.245 22.194 22.746 204 HA CYS 32 HA CYS 32 22.646 20.011 21.316 205 HB2 CYS 32 2HB CYS 32 22.393 22.908 20.516 206 HB3 CYS 32 3HB CYS 32 23.914 22.071 20.278 207 H ASP 33 H ASP 33 24.915 20.016 21.633 208 HA ASP 33 HA ASP 33 25.512 20.326 24.422 209 HB2 ASP 33 2HB ASP 33 26.263 18.358 23.323 210 HB3 ASP 33 3HB ASP 33 26.995 19.257 22.020 211 H LEU 34 H LEU 34 26.375 21.989 25.465 212 HA LEU 34 HA LEU 34 28.448 23.668 24.150 213 HB2 LEU 34 2HB LEU 34 26.488 24.366 26.364 214 HB3 LEU 34 3HB LEU 34 27.831 25.391 25.862 215 HG LEU 34 HG LEU 34 25.440 24.616 24.174 216 HD11 LEU 34 1HD1 LEU 34 24.878 26.986 24.366 217 HD12 LEU 34 2HD1 LEU 34 26.394 27.321 25.240 218 HD13 LEU 34 3HD1 LEU 34 25.129 26.338 26.002 219 HD21 LEU 34 3HD2 LEU 34 27.264 24.813 22.621 220 HD22 LEU 34 1HD2 LEU 34 27.940 26.225 23.473 221 HD23 LEU 34 2HD2 LEU 34 26.422 26.364 22.564 222 H SER 35 H SER 35 28.389 21.011 26.040 223 HA SER 35 HA SER 35 30.131 21.769 28.203 224 HB2 SER 35 2HB SER 35 28.775 19.649 28.011 225 HB3 SER 35 3HB SER 35 29.948 19.076 26.805 226 HG SER 35 HG SER 35 31.542 19.167 28.342 227 H LYS 36 H LYS 36 30.612 21.425 24.767 228 HA LYS 36 HA LYS 36 33.408 20.908 24.695 229 HB2 LYS 36 2HB LYS 36 33.299 21.599 22.407 230 HB3 LYS 36 3HB LYS 36 31.924 20.569 22.783 231 HG2 LYS 36 2HG LYS 36 30.399 22.459 22.808 232 HG3 LYS 36 3HG LYS 36 31.742 23.614 22.680 233 HD2 LYS 36 2HD LYS 36 32.371 22.672 20.483 234 HD3 LYS 36 3HD LYS 36 31.006 21.549 20.556 235 HE2 LYS 36 2HE LYS 36 30.719 24.580 20.690 236 HE3 LYS 36 3HE LYS 36 30.682 23.660 19.175 237 HZ1 LYS 36 3HZ LYS 36 28.819 23.258 21.414 238 HZ2 LYS 36 1HZ LYS 36 28.796 22.462 19.979 239 HZ3 LYS 36 2HZ LYS 36 28.492 24.086 20.025 240 H LEU 37 H LEU 37 31.763 23.776 25.733 241 HA LEU 37 HA LEU 37 33.732 25.717 24.914 242 HB2 LEU 37 2HB LEU 37 31.701 25.751 27.173 243 HB3 LEU 37 3HB LEU 37 32.646 27.140 26.645 244 HG LEU 37 HG LEU 37 30.631 25.650 24.894 245 HD11 LEU 37 1HD1 LEU 37 29.198 27.618 25.231 246 HD12 LEU 37 2HD1 LEU 37 30.414 28.344 26.302 247 HD13 LEU 37 3HD1 LEU 37 29.577 26.853 26.784 248 HD21 LEU 37 3HD2 LEU 37 30.833 27.627 23.399 249 HD22 LEU 37 1HD2 LEU 37 32.343 26.720 23.502 250 HD23 LEU 37 2HD2 LEU 37 32.161 28.243 24.404 251 H THR 38 H THR 38 33.243 23.826 27.960 252 HA THR 38 HA THR 38 35.768 24.730 29.104 253 HB THR 38 HB THR 38 35.129 23.018 30.855 254 HG1 THR 38 1HG THR 38 33.717 21.823 29.465 255 HG21 THR 38 1HG2 THR 38 34.679 25.396 31.163 256 HG22 THR 38 2HG2 THR 38 33.372 24.408 31.843 257 HG23 THR 38 3HG2 THR 38 33.140 25.243 30.289 258 H GLY 39 H GLY 39 35.011 22.387 26.727 259 HA2 GLY 39 2HA GLY 39 37.594 21.421 26.434 260 HA3 GLY 39 3HA GLY 39 36.803 20.276 27.532 Start of MODEL 9 1 H1 ASN 1 H1 ASN 1 16.399 20.239 35.064 2 H2 ASN 1 H2 ASN 1 15.033 20.951 34.466 3 H3 ASN 1 H3 ASN 1 15.162 19.307 34.500 4 HA ASN 1 HA ASN 1 15.485 20.099 32.275 5 HB2 ASN 1 2HB ASN 1 17.789 21.655 33.525 6 HB3 ASN 1 3HB ASN 1 17.543 21.423 31.794 7 HD21 ASN 1 2HD2 ASN 1 15.732 24.421 31.647 8 HD22 ASN 1 1HD2 ASN 1 17.027 23.424 31.025 9 H GLU 2 H GLU 2 16.669 18.782 30.912 10 HA GLU 2 HA GLU 2 18.366 16.757 32.199 11 HB2 GLU 2 2HB GLU 2 16.501 16.175 30.688 12 HB3 GLU 2 3HB GLU 2 17.353 16.936 29.336 13 HG2 GLU 2 2HG GLU 2 19.212 15.323 29.599 14 HG3 GLU 2 3HG GLU 2 18.465 14.659 31.054 15 H CYS 3 H CYS 3 18.692 18.744 29.164 16 HA CYS 3 HA CYS 3 21.457 18.291 28.872 17 HB2 CYS 3 2HB CYS 3 19.636 20.483 27.803 18 HB3 CYS 3 3HB CYS 3 21.347 20.391 27.423 19 H VAL 4 H VAL 4 19.776 21.068 30.446 20 HA VAL 4 HA VAL 4 22.169 22.552 30.869 21 HB VAL 4 HB VAL 4 19.547 22.800 32.387 22 HG11 VAL 4 1HG1 VAL 4 21.347 24.116 33.403 23 HG12 VAL 4 2HG1 VAL 4 21.800 24.778 31.815 24 HG13 VAL 4 3HG1 VAL 4 20.242 25.200 32.556 25 HG21 VAL 4 3HG2 VAL 4 18.952 24.520 30.682 26 HG22 VAL 4 1HG2 VAL 4 20.387 24.069 29.735 27 HG23 VAL 4 2HG2 VAL 4 19.055 22.913 29.969 28 H SER 5 H SER 5 20.539 20.069 32.847 29 HA SER 5 HA SER 5 22.132 20.440 35.217 30 HB2 SER 5 2HB SER 5 19.974 19.274 35.212 31 HB3 SER 5 3HB SER 5 20.642 17.994 34.175 32 HG SER 5 HG SER 5 21.597 18.719 36.753 33 H LYS 6 H LYS 6 22.576 18.574 32.195 34 HA LYS 6 HA LYS 6 25.018 17.278 33.069 35 HB2 LYS 6 2HB LYS 6 23.527 17.568 30.456 36 HB3 LYS 6 3HB LYS 6 25.155 16.913 30.452 37 HG2 LYS 6 2HG LYS 6 23.106 15.711 32.319 38 HG3 LYS 6 3HG LYS 6 23.047 15.361 30.594 39 HD2 LYS 6 2HD LYS 6 24.246 13.612 31.681 40 HD3 LYS 6 3HD LYS 6 25.350 14.473 30.627 41 HE2 LYS 6 2HE LYS 6 25.187 15.151 33.583 42 HE3 LYS 6 3HE LYS 6 26.082 13.730 33.040 43 HZ1 LYS 6 3HZ LYS 6 27.499 15.643 33.231 44 HZ2 LYS 6 1HZ LYS 6 26.614 16.471 32.129 45 HZ3 LYS 6 2HZ LYS 6 27.434 15.119 31.669 46 H GLY 7 H GLY 7 24.380 20.515 32.191 47 HA2 GLY 7 2HA GLY 7 25.921 22.239 32.117 48 HA3 GLY 7 3HA GLY 7 27.242 21.102 31.844 49 H PHE 8 H PHE 8 24.886 20.195 29.653 50 HA PHE 8 HA PHE 8 26.013 21.586 27.354 51 HB2 PHE 8 2HB PHE 8 23.513 19.871 27.619 52 HB3 PHE 8 3HB PHE 8 24.270 20.363 26.115 53 HD1 PHE 8 HD1 PHE 8 23.815 17.599 28.073 54 HD2 PHE 8 HD2 PHE 8 26.980 19.803 26.163 55 HE1 PHE 8 HE1 PHE 8 25.192 15.534 27.986 56 HE2 PHE 8 HE2 PHE 8 28.344 17.718 26.033 57 HZ PHE 8 HZ PHE 8 27.456 15.593 26.960 58 H GLY 9 H GLY 9 24.266 22.507 25.804 59 HA2 GLY 9 2HA GLY 9 22.173 24.108 27.169 60 HA3 GLY 9 3HA GLY 9 23.412 24.986 26.276 61 H CYS 10 H CYS 10 21.343 25.699 25.265 62 HA CYS 10 HA CYS 10 20.347 23.882 23.122 63 HB2 CYS 10 2HB CYS 10 18.869 26.112 24.541 64 HB3 CYS 10 3HB CYS 10 18.226 25.025 23.314 65 H LEU 11 H LEU 11 22.101 24.607 21.805 66 HA LEU 11 HA LEU 11 22.392 27.304 20.849 67 HB2 LEU 11 2HB LEU 11 23.056 24.531 19.846 68 HB3 LEU 11 3HB LEU 11 23.301 25.891 18.797 69 HG LEU 11 HG LEU 11 25.155 26.582 19.788 70 HD11 LEU 11 1HD1 LEU 11 24.305 25.627 22.549 71 HD12 LEU 11 2HD1 LEU 11 24.247 27.308 21.965 72 HD13 LEU 11 3HD1 LEU 11 25.801 26.504 22.155 73 HD21 LEU 11 3HD2 LEU 11 26.595 24.845 20.545 74 HD22 LEU 11 1HD2 LEU 11 25.500 24.166 19.327 75 HD23 LEU 11 2HD2 LEU 11 25.228 23.851 21.068 76 HA PRO 12 HA PRO 12 18.737 27.758 18.550 77 HB2 PRO 12 3HB PRO 12 19.458 29.940 18.223 78 HB3 PRO 12 2HB PRO 12 19.403 29.446 16.502 79 HG2 PRO 12 2HG PRO 12 21.731 28.927 16.496 80 HG3 PRO 12 3HG PRO 12 21.699 30.413 17.503 81 HD2 PRO 12 2HD PRO 12 22.803 28.092 18.432 82 HD3 PRO 12 3HD PRO 12 21.862 29.166 19.509 83 H GLN 13 H GLN 13 17.659 27.506 16.410 84 HA GLN 13 HA GLN 13 18.215 24.948 15.285 85 HB2 GLN 13 2HB GLN 13 16.307 27.195 14.543 86 HB3 GLN 13 3HB GLN 13 16.292 25.613 13.754 87 HG2 GLN 13 2HG GLN 13 15.727 24.475 15.789 88 HG3 GLN 13 3HG GLN 13 16.021 25.907 16.772 89 HE21 GLN 13 2HE2 GLN 13 12.706 27.028 16.534 90 HE22 GLN 13 1HE2 GLN 13 14.229 26.997 17.405 91 H SER 14 H SER 14 19.636 27.965 14.512 92 HA SER 14 HA SER 14 20.312 27.238 11.727 93 HB2 SER 14 2HB SER 14 21.301 29.507 11.681 94 HB3 SER 14 3HB SER 14 19.585 29.512 12.105 95 HG SER 14 HG SER 14 21.792 29.786 13.882 96 H ASP 15 H ASP 15 21.633 26.836 14.898 97 HA ASP 15 HA ASP 15 24.344 26.308 13.805 98 HB2 ASP 15 2HB ASP 15 23.789 27.927 16.313 99 HB3 ASP 15 3HB ASP 15 25.366 27.505 15.666 100 H CYS 16 H CYS 16 21.961 24.636 14.821 101 HA CYS 16 HA CYS 16 23.600 22.875 16.551 102 HB2 CYS 16 2HB CYS 16 21.957 23.973 17.960 103 HB3 CYS 16 3HB CYS 16 20.648 23.450 16.912 104 HA PRO 17 HA PRO 17 22.209 20.764 12.660 105 HB2 PRO 17 3HB PRO 17 24.161 21.487 11.610 106 HB3 PRO 17 2HB PRO 17 24.608 19.768 11.839 107 HG2 PRO 17 2HG PRO 17 25.805 20.280 13.868 108 HG3 PRO 17 3HG PRO 17 26.236 21.669 12.815 109 HD2 PRO 17 2HD PRO 17 25.105 22.038 15.255 110 HD3 PRO 17 3HD PRO 17 24.676 23.081 13.866 111 H GLN 18 H GLN 18 22.400 18.420 12.031 112 HA GLN 18 HA GLN 18 21.890 16.645 14.120 113 HB2 GLN 18 2HB GLN 18 22.702 15.969 11.264 114 HB3 GLN 18 3HB GLN 18 21.809 14.964 12.394 115 HG2 GLN 18 2HG GLN 18 20.108 15.761 11.057 116 HG3 GLN 18 3HG GLN 18 20.046 16.857 12.445 117 HE21 GLN 18 2HE2 GLN 18 19.705 19.282 9.828 118 HE22 GLN 18 1HE2 GLN 18 18.813 18.288 10.970 119 H GLU 19 H GLU 19 24.960 17.706 12.995 120 HA GLU 19 HA GLU 19 26.434 15.270 13.684 121 HB2 GLU 19 2HB GLU 19 27.404 18.073 13.004 122 HB3 GLU 19 3HB GLU 19 28.391 16.601 13.081 123 HG2 GLU 19 2HG GLU 19 26.805 15.660 11.263 124 HG3 GLU 19 3HG GLU 19 26.269 17.326 11.029 125 H ALA 20 H ALA 20 25.520 18.283 15.226 126 HA ALA 20 HA ALA 20 27.401 17.842 17.489 127 HB1 ALA 20 1HB ALA 20 27.632 19.930 16.196 128 HB2 ALA 20 2HB ALA 20 25.948 20.346 16.580 129 HB3 ALA 20 3HB ALA 20 27.155 20.234 17.879 130 H ARG 21 H ARG 21 24.097 17.446 16.744 131 HA ARG 21 HA ARG 21 22.890 18.244 19.212 132 HB2 ARG 21 2HB ARG 21 20.959 16.994 18.470 133 HB3 ARG 21 3HB ARG 21 21.637 17.895 17.113 134 HG2 ARG 21 2HG ARG 21 22.731 15.859 16.284 135 HG3 ARG 21 3HG ARG 21 22.098 14.919 17.641 136 HD2 ARG 21 2HD ARG 21 19.832 15.182 16.908 137 HD3 ARG 21 3HD ARG 21 20.292 16.388 15.689 138 HE ARG 21 HE ARG 21 21.814 14.236 15.010 139 HH11 ARG 21 1HH1 ARG 21 18.285 14.648 15.358 140 HH12 ARG 21 2HH1 ARG 21 17.948 13.378 14.198 141 HH21 ARG 21 2HH2 ARG 21 19.597 12.255 13.195 142 HH22 ARG 21 1HH2 ARG 21 21.283 12.609 13.527 143 H LEU 22 H LEU 22 21.725 16.649 20.635 144 HA LEU 22 HA LEU 22 23.322 14.205 21.229 145 HB2 LEU 22 2HB LEU 22 22.244 16.209 23.241 146 HB3 LEU 22 3HB LEU 22 23.079 14.699 23.630 147 HG LEU 22 HG LEU 22 24.418 16.971 22.078 148 HD11 LEU 22 1HD1 LEU 22 24.584 16.335 25.024 149 HD12 LEU 22 2HD1 LEU 22 23.708 17.715 24.320 150 HD13 LEU 22 3HD1 LEU 22 25.464 17.611 24.142 151 HD21 LEU 22 3HD2 LEU 22 26.491 15.812 22.745 152 HD22 LEU 22 1HD2 LEU 22 25.472 14.722 21.799 153 HD23 LEU 22 2HD2 LEU 22 25.547 14.553 23.566 154 H SER 23 H SER 23 22.122 12.779 22.740 155 HA SER 23 HA SER 23 19.453 12.200 21.710 156 HB2 SER 23 2HB SER 23 21.181 10.475 22.292 157 HB3 SER 23 3HB SER 23 20.986 10.907 24.003 158 HG SER 23 HG SER 23 18.953 9.960 22.248 159 H TYR 24 H TYR 24 20.747 14.011 24.374 160 HA TYR 24 HA TYR 24 18.490 13.918 26.158 161 HB2 TYR 24 2HB TYR 24 20.718 15.959 25.911 162 HB3 TYR 24 3HB TYR 24 19.728 15.661 27.340 163 HD1 TYR 24 HD1 TYR 24 22.826 15.051 25.807 164 HD2 TYR 24 HD2 TYR 24 19.842 13.102 28.212 165 HE1 TYR 24 HE1 TYR 24 24.461 13.305 26.365 166 HE2 TYR 24 HE2 TYR 24 21.491 11.362 28.856 167 HH TYR 24 HH TYR 24 24.810 11.297 27.490 168 H GLY 25 H GLY 25 17.348 15.944 26.798 169 HA2 GLY 25 2HA GLY 25 16.900 17.982 24.718 170 HA3 GLY 25 3HA GLY 25 15.548 16.893 25.047 171 H GLY 26 H GLY 26 17.660 19.383 26.365 172 HA2 GLY 26 2HA GLY 26 16.071 19.765 28.824 173 HA3 GLY 26 3HA GLY 26 17.566 20.574 28.384 174 H CYS 27 H CYS 27 15.612 20.723 25.663 175 HA CYS 27 HA CYS 27 14.153 23.157 26.479 176 HB2 CYS 27 2HB CYS 27 16.103 22.808 24.187 177 HB3 CYS 27 3HB CYS 27 14.814 23.991 24.094 178 H SER 28 H SER 28 14.161 20.355 24.804 179 HA SER 28 HA SER 28 12.689 18.970 23.936 180 HB2 SER 28 2HB SER 28 10.430 19.092 24.178 181 HB3 SER 28 3HB SER 28 11.051 19.910 25.610 182 HG SER 28 HG SER 28 9.958 21.115 23.276 183 H THR 29 H THR 29 13.879 21.634 22.638 184 HA THR 29 HA THR 29 12.625 21.208 19.988 185 HB THR 29 HB THR 29 13.217 23.597 19.564 186 HG1 THR 29 1HG THR 29 13.809 24.866 21.324 187 HG21 THR 29 1HG2 THR 29 11.481 23.180 22.041 188 HG22 THR 29 2HG2 THR 29 10.941 22.967 20.360 189 HG23 THR 29 3HG2 THR 29 11.433 24.572 20.939 190 H VAL 30 H VAL 30 15.642 22.272 21.544 191 HA VAL 30 HA VAL 30 17.329 20.732 19.711 192 HB VAL 30 HB VAL 30 18.731 22.873 19.277 193 HG11 VAL 30 1HG1 VAL 30 17.622 21.539 17.524 194 HG12 VAL 30 2HG1 VAL 30 16.167 22.555 17.692 195 HG13 VAL 30 3HG1 VAL 30 17.697 23.266 17.148 196 HG21 VAL 30 3HG2 VAL 30 16.026 24.253 19.562 197 HG22 VAL 30 1HG2 VAL 30 17.426 24.487 20.637 198 HG23 VAL 30 2HG2 VAL 30 17.516 24.958 18.929 199 H CYS 31 H CYS 31 19.100 20.070 20.712 200 HA CYS 31 HA CYS 31 20.382 21.648 22.822 201 HB2 CYS 31 2HB CYS 31 18.928 20.178 24.066 202 HB3 CYS 31 3HB CYS 31 19.465 18.770 23.143 203 H CYS 32 H CYS 32 22.453 21.831 22.250 204 HA CYS 32 HA CYS 32 23.849 19.607 20.875 205 HB2 CYS 32 2HB CYS 32 23.697 22.543 20.131 206 HB3 CYS 32 3HB CYS 32 25.133 21.606 19.801 207 H ASP 33 H ASP 33 25.991 19.376 21.370 208 HA ASP 33 HA ASP 33 26.826 20.192 24.011 209 HB2 ASP 33 2HB ASP 33 27.375 17.990 23.313 210 HB3 ASP 33 3HB ASP 33 28.040 18.531 21.800 211 H LEU 34 H LEU 34 27.356 22.208 24.335 212 HA LEU 34 HA LEU 34 29.281 23.641 22.580 213 HB2 LEU 34 2HB LEU 34 28.555 25.647 23.712 214 HB3 LEU 34 3HB LEU 34 27.179 24.757 23.090 215 HG LEU 34 HG LEU 34 27.077 23.768 25.588 216 HD11 LEU 34 1HD1 LEU 34 28.373 26.500 26.021 217 HD12 LEU 34 2HD1 LEU 34 29.086 24.940 26.478 218 HD13 LEU 34 3HD1 LEU 34 27.620 25.492 27.271 219 HD21 LEU 34 3HD2 LEU 34 26.108 26.527 24.754 220 HD22 LEU 34 1HD2 LEU 34 25.530 25.624 26.170 221 HD23 LEU 34 2HD2 LEU 34 25.265 24.972 24.547 222 H SER 35 H SER 35 29.107 21.804 25.483 223 HA SER 35 HA SER 35 31.009 23.162 27.108 224 HB2 SER 35 2HB SER 35 29.277 21.530 27.865 225 HB3 SER 35 3HB SER 35 30.203 20.224 27.098 226 HG SER 35 HG SER 35 30.608 20.575 29.378 227 H LYS 36 H LYS 36 31.400 21.090 24.342 228 HA LYS 36 HA LYS 36 33.959 20.011 24.671 229 HB2 LYS 36 2HB LYS 36 33.984 19.923 22.207 230 HB3 LYS 36 3HB LYS 36 32.464 19.349 22.888 231 HG2 LYS 36 2HG LYS 36 31.319 21.420 22.279 232 HG3 LYS 36 3HG LYS 36 32.841 22.187 21.823 233 HD2 LYS 36 2HD LYS 36 31.691 21.570 19.821 234 HD3 LYS 36 3HD LYS 36 33.133 20.559 19.985 235 HE2 LYS 36 2HE LYS 36 31.692 18.721 20.892 236 HE3 LYS 36 3HE LYS 36 30.267 19.748 20.636 237 HZ1 LYS 36 3HZ LYS 36 30.605 18.252 18.804 238 HZ2 LYS 36 1HZ LYS 36 32.132 18.814 18.560 239 HZ3 LYS 36 2HZ LYS 36 30.844 19.805 18.293 240 H LEU 37 H LEU 37 33.158 23.382 24.232 241 HA LEU 37 HA LEU 37 35.550 24.283 22.967 242 HB2 LEU 37 2HB LEU 37 33.342 25.506 24.616 243 HB3 LEU 37 3HB LEU 37 34.761 26.473 24.272 244 HG LEU 37 HG LEU 37 33.215 25.085 22.038 245 HD11 LEU 37 1HD1 LEU 37 32.790 27.897 23.145 246 HD12 LEU 37 2HD1 LEU 37 31.628 26.551 23.192 247 HD13 LEU 37 3HD1 LEU 37 32.085 27.260 21.642 248 HD21 LEU 37 3HD2 LEU 37 35.499 25.871 21.455 249 HD22 LEU 37 1HD2 LEU 37 35.111 27.487 22.081 250 HD23 LEU 37 2HD2 LEU 37 34.278 26.859 20.646 251 H THR 38 H THR 38 34.850 23.630 26.443 252 HA THR 38 HA THR 38 37.532 24.628 27.189 253 HB THR 38 HB THR 38 34.788 24.678 28.500 254 HG1 THR 38 1HG THR 38 35.206 26.348 27.079 255 HG21 THR 38 1HG2 THR 38 36.354 24.106 30.220 256 HG22 THR 38 2HG2 THR 38 35.897 25.804 30.401 257 HG23 THR 38 3HG2 THR 38 37.484 25.385 29.696 258 H GLY 39 H GLY 39 34.978 22.183 27.735 259 HA2 GLY 39 2HA GLY 39 36.689 20.508 29.453 260 HA3 GLY 39 3HA GLY 39 34.994 20.235 29.021 Start of MODEL 10 1 H1 ASN 1 H1 ASN 1 16.382 22.516 34.193 2 H2 ASN 1 H2 ASN 1 14.858 22.743 33.606 3 H3 ASN 1 H3 ASN 1 15.285 21.286 34.241 4 HA ASN 1 HA ASN 1 15.213 21.168 31.866 5 HB2 ASN 1 2HB ASN 1 17.280 23.364 32.104 6 HB3 ASN 1 3HB ASN 1 17.038 22.413 30.628 7 HD21 ASN 1 2HD2 ASN 1 15.016 25.706 30.807 8 HD22 ASN 1 1HD2 ASN 1 16.586 25.378 31.501 9 H GLU 2 H GLU 2 16.128 19.365 31.258 10 HA GLU 2 HA GLU 2 18.052 17.956 32.750 11 HB2 GLU 2 2HB GLU 2 16.358 16.870 31.461 12 HB3 GLU 2 3HB GLU 2 16.861 17.645 29.983 13 HG2 GLU 2 2HG GLU 2 17.507 15.285 30.027 14 HG3 GLU 2 3HG GLU 2 18.887 16.359 29.871 15 H CYS 3 H CYS 3 18.435 19.360 29.454 16 HA CYS 3 HA CYS 3 21.205 18.775 29.248 17 HB2 CYS 3 2HB CYS 3 19.270 20.378 27.695 18 HB3 CYS 3 3HB CYS 3 20.885 21.050 27.681 19 H VAL 4 H VAL 4 19.624 21.664 30.615 20 HA VAL 4 HA VAL 4 22.021 23.237 30.841 21 HB VAL 4 HB VAL 4 19.403 23.438 32.364 22 HG11 VAL 4 1HG1 VAL 4 21.615 25.480 31.923 23 HG12 VAL 4 2HG1 VAL 4 20.019 25.852 32.605 24 HG13 VAL 4 3HG1 VAL 4 21.108 24.767 33.469 25 HG21 VAL 4 3HG2 VAL 4 18.703 25.106 30.684 26 HG22 VAL 4 1HG2 VAL 4 20.238 24.890 29.804 27 HG23 VAL 4 2HG2 VAL 4 19.050 23.578 29.869 28 H SER 5 H SER 5 20.327 20.940 33.023 29 HA SER 5 HA SER 5 22.004 21.348 35.318 30 HB2 SER 5 2HB SER 5 19.743 20.310 35.362 31 HB3 SER 5 3HB SER 5 20.382 18.908 34.479 32 HG SER 5 HG SER 5 21.850 18.622 36.238 33 H LYS 6 H LYS 6 22.293 19.355 32.387 34 HA LYS 6 HA LYS 6 24.727 17.996 33.278 35 HB2 LYS 6 2HB LYS 6 23.227 18.111 30.638 36 HB3 LYS 6 3HB LYS 6 24.708 17.187 30.872 37 HG2 LYS 6 2HG LYS 6 22.194 16.743 32.538 38 HG3 LYS 6 3HG LYS 6 22.558 15.880 31.042 39 HD2 LYS 6 2HD LYS 6 24.622 14.956 32.037 40 HD3 LYS 6 3HD LYS 6 24.341 15.870 33.523 41 HE2 LYS 6 2HE LYS 6 23.656 13.593 33.879 42 HE3 LYS 6 3HE LYS 6 22.228 14.642 33.903 43 HZ1 LYS 6 3HZ LYS 6 23.108 13.036 31.596 44 HZ2 LYS 6 1HZ LYS 6 21.734 13.959 31.691 45 HZ3 LYS 6 2HZ LYS 6 21.893 12.621 32.632 46 H GLY 7 H GLY 7 24.134 21.154 32.359 47 HA2 GLY 7 2HA GLY 7 25.688 22.821 32.327 48 HA3 GLY 7 3HA GLY 7 26.979 21.663 32.037 49 H PHE 8 H PHE 8 24.747 20.936 29.673 50 HA PHE 8 HA PHE 8 26.270 22.266 27.586 51 HB2 PHE 8 2HB PHE 8 23.745 20.570 27.454 52 HB3 PHE 8 3HB PHE 8 24.754 21.021 26.086 53 HD1 PHE 8 HD1 PHE 8 24.100 18.444 28.381 54 HD2 PHE 8 HD2 PHE 8 27.351 20.417 26.379 55 HE1 PHE 8 HE1 PHE 8 25.522 16.417 28.677 56 HE2 PHE 8 HE2 PHE 8 28.775 18.390 26.676 57 HZ PHE 8 HZ PHE 8 27.851 16.396 27.834 58 H GLY 9 H GLY 9 25.065 23.301 25.741 59 HA2 GLY 9 2HA GLY 9 23.411 25.540 26.747 60 HA3 GLY 9 3HA GLY 9 24.265 25.440 25.203 61 H CYS 10 H CYS 10 21.801 26.376 25.154 62 HA CYS 10 HA CYS 10 20.194 24.282 23.777 63 HB2 CYS 10 2HB CYS 10 19.153 26.463 25.619 64 HB3 CYS 10 3HB CYS 10 18.152 25.502 24.535 65 H LEU 11 H LEU 11 21.725 25.132 22.169 66 HA LEU 11 HA LEU 11 21.525 27.763 21.056 67 HB2 LEU 11 2HB LEU 11 22.664 25.081 20.241 68 HB3 LEU 11 3HB LEU 11 22.550 26.343 19.041 69 HG LEU 11 HG LEU 11 23.874 27.853 20.402 70 HD11 LEU 11 1HD1 LEU 11 24.212 25.553 22.365 71 HD12 LEU 11 2HD1 LEU 11 23.489 27.145 22.687 72 HD13 LEU 11 3HD1 LEU 11 25.210 27.023 22.337 73 HD21 LEU 11 3HD2 LEU 11 25.335 25.240 20.031 74 HD22 LEU 11 1HD2 LEU 11 26.023 26.866 20.027 75 HD23 LEU 11 2HD2 LEU 11 24.936 26.372 18.718 76 HA PRO 12 HA PRO 12 17.953 27.268 18.443 77 HB2 PRO 12 3HB PRO 12 18.271 29.486 17.828 78 HB3 PRO 12 2HB PRO 12 18.534 28.745 16.219 79 HG2 PRO 12 2HG PRO 12 20.882 28.774 16.498 80 HG3 PRO 12 3HG PRO 12 20.446 30.323 17.285 81 HD2 PRO 12 2HD PRO 12 21.875 28.403 18.589 82 HD3 PRO 12 3HD PRO 12 20.675 29.398 19.448 83 H GLN 13 H GLN 13 17.203 26.427 16.374 84 HA GLN 13 HA GLN 13 18.398 23.939 15.691 85 HB2 GLN 13 2HB GLN 13 16.166 25.533 14.368 86 HB3 GLN 13 3HB GLN 13 16.536 23.836 14.037 87 HG2 GLN 13 2HG GLN 13 16.082 23.264 16.406 88 HG3 GLN 13 3HG GLN 13 15.637 24.943 16.735 89 HE21 GLN 13 2HE2 GLN 13 12.510 24.781 14.916 90 HE22 GLN 13 1HE2 GLN 13 13.819 25.867 15.312 91 H SER 14 H SER 14 19.300 27.005 14.570 92 HA SER 14 HA SER 14 20.245 25.992 11.936 93 HB2 SER 14 2HB SER 14 19.955 28.302 11.141 94 HB3 SER 14 3HB SER 14 18.443 27.575 11.707 95 HG SER 14 HG SER 14 20.083 29.409 13.132 96 H ASP 15 H ASP 15 21.448 26.941 14.976 97 HA ASP 15 HA ASP 15 23.992 27.928 13.770 98 HB2 ASP 15 2HB ASP 15 22.913 29.384 15.479 99 HB3 ASP 15 3HB ASP 15 23.106 28.080 16.666 100 H CYS 16 H CYS 16 22.671 25.505 16.090 101 HA CYS 16 HA CYS 16 25.155 24.269 16.702 102 HB2 CYS 16 2HB CYS 16 23.112 24.067 18.078 103 HB3 CYS 16 3HB CYS 16 22.340 23.142 16.789 104 HA PRO 17 HA PRO 17 25.220 22.015 12.696 105 HB2 PRO 17 3HB PRO 17 27.400 22.835 12.461 106 HB3 PRO 17 2HB PRO 17 27.774 21.108 12.757 107 HG2 PRO 17 2HG PRO 17 28.215 21.521 15.069 108 HG3 PRO 17 3HG PRO 17 28.869 23.016 14.330 109 HD2 PRO 17 2HD PRO 17 26.904 23.011 16.274 110 HD3 PRO 17 3HD PRO 17 27.001 24.276 15.021 111 H GLN 18 H GLN 18 25.294 19.742 12.158 112 HA GLN 18 HA GLN 18 24.474 17.889 14.111 113 HB2 GLN 18 2HB GLN 18 25.653 17.360 11.353 114 HB3 GLN 18 3HB GLN 18 24.656 16.257 12.313 115 HG2 GLN 18 2HG GLN 18 22.820 18.027 12.241 116 HG3 GLN 18 3HG GLN 18 23.788 18.887 11.041 117 HE21 GLN 18 2HE2 GLN 18 21.218 16.478 9.501 118 HE22 GLN 18 1HE2 GLN 18 21.094 17.623 10.827 119 H GLU 19 H GLU 19 27.665 18.978 13.299 120 HA GLU 19 HA GLU 19 29.180 16.685 14.166 121 HB2 GLU 19 2HB GLU 19 29.911 19.641 14.090 122 HB3 GLU 19 3HB GLU 19 31.048 18.298 14.235 123 HG2 GLU 19 2HG GLU 19 29.340 19.013 11.822 124 HG3 GLU 19 3HG GLU 19 31.092 19.098 11.959 125 H ALA 20 H ALA 20 27.585 19.326 15.833 126 HA ALA 20 HA ALA 20 28.836 18.575 18.433 127 HB1 ALA 20 1HB ALA 20 29.490 20.794 17.546 128 HB2 ALA 20 2HB ALA 20 27.775 21.274 17.544 129 HB3 ALA 20 3HB ALA 20 28.593 20.895 19.072 130 H ARG 21 H ARG 21 25.968 18.124 16.824 131 HA ARG 21 HA ARG 21 24.017 18.760 18.824 132 HB2 ARG 21 2HB ARG 21 22.528 17.595 17.470 133 HB3 ARG 21 3HB ARG 21 23.745 18.119 16.313 134 HG2 ARG 21 2HG ARG 21 24.796 15.713 16.811 135 HG3 ARG 21 3HG ARG 21 23.180 15.370 17.432 136 HD2 ARG 21 2HD ARG 21 24.124 15.796 14.629 137 HD3 ARG 21 3HD ARG 21 23.087 14.546 15.297 138 HE ARG 21 HE ARG 21 21.922 17.227 15.299 139 HH11 ARG 21 1HH1 ARG 21 22.549 14.435 13.210 140 HH12 ARG 21 2HH1 ARG 21 21.189 14.758 12.161 141 HH21 ARG 21 2HH2 ARG 21 19.794 16.534 12.606 142 HH22 ARG 21 1HH2 ARG 21 20.086 17.552 14.002 143 H LEU 22 H LEU 22 23.024 17.301 20.493 144 HA LEU 22 HA LEU 22 24.809 15.089 21.318 145 HB2 LEU 22 2HB LEU 22 22.640 16.729 22.649 146 HB3 LEU 22 3HB LEU 22 23.193 15.207 23.342 147 HG LEU 22 HG LEU 22 25.182 17.389 22.611 148 HD11 LEU 22 1HD1 LEU 22 25.093 18.126 24.949 149 HD12 LEU 22 2HD1 LEU 22 23.712 17.032 25.240 150 HD13 LEU 22 3HD1 LEU 22 23.562 18.395 24.103 151 HD21 LEU 22 3HD2 LEU 22 25.265 15.067 24.601 152 HD22 LEU 22 1HD2 LEU 22 26.547 16.262 24.383 153 HD23 LEU 22 2HD2 LEU 22 26.146 15.159 23.063 154 H SER 23 H SER 23 23.647 13.187 22.170 155 HA SER 23 HA SER 23 22.000 12.020 20.060 156 HB2 SER 23 2HB SER 23 23.838 10.834 21.342 157 HB3 SER 23 3HB SER 23 22.749 10.810 22.746 158 HG SER 23 HG SER 23 21.228 9.732 21.344 159 H TYR 24 H TYR 24 21.227 14.038 22.590 160 HA TYR 24 HA TYR 24 18.414 13.202 22.705 161 HB2 TYR 24 2HB TYR 24 18.350 13.222 25.071 162 HB3 TYR 24 3HB TYR 24 19.687 12.176 24.639 163 HD1 TYR 24 HD1 TYR 24 22.110 13.380 24.570 164 HD2 TYR 24 HD2 TYR 24 18.665 14.903 26.686 165 HE1 TYR 24 HE1 TYR 24 23.601 14.592 26.135 166 HE2 TYR 24 HE2 TYR 24 20.162 16.174 28.187 167 HH TYR 24 HH TYR 24 23.729 15.990 27.947 168 H GLY 25 H GLY 25 17.119 14.903 23.841 169 HA2 GLY 25 2HA GLY 25 18.126 17.683 23.358 170 HA3 GLY 25 3HA GLY 25 16.536 17.112 22.838 171 H GLY 26 H GLY 26 18.624 17.551 25.703 172 HA2 GLY 26 2HA GLY 26 16.508 17.338 27.655 173 HA3 GLY 26 3HA GLY 26 18.159 17.900 27.912 174 H CYS 27 H CYS 27 17.120 19.782 25.440 175 HA CYS 27 HA CYS 27 16.199 22.078 27.039 176 HB2 CYS 27 2HB CYS 27 16.853 21.661 24.110 177 HB3 CYS 27 3HB CYS 27 16.464 23.220 24.813 178 H SER 28 H SER 28 14.518 23.272 25.100 179 HA SER 28 HA SER 28 12.054 21.650 25.418 180 HB2 SER 28 2HB SER 28 12.145 23.994 26.254 181 HB3 SER 28 3HB SER 28 12.397 24.558 24.590 182 HG SER 28 HG SER 28 10.380 23.569 24.079 183 H THR 29 H THR 29 14.350 22.604 22.973 184 HA THR 29 HA THR 29 12.548 21.608 20.812 185 HB THR 29 HB THR 29 13.476 23.376 19.333 186 HG1 THR 29 1HG THR 29 14.380 25.214 20.436 187 HG21 THR 29 1HG2 THR 29 11.257 23.655 20.444 188 HG22 THR 29 2HG2 THR 29 12.081 25.198 20.141 189 HG23 THR 29 3HG2 THR 29 12.063 24.514 21.779 190 H VAL 30 H VAL 30 15.932 22.616 21.392 191 HA VAL 30 HA VAL 30 16.979 20.005 20.624 192 HB VAL 30 HB VAL 30 18.589 20.910 18.980 193 HG11 VAL 30 1HG1 VAL 30 17.186 20.915 17.037 194 HG12 VAL 30 2HG1 VAL 30 16.542 19.748 18.204 195 HG13 VAL 30 3HG1 VAL 30 15.752 21.330 17.993 196 HG21 VAL 30 3HG2 VAL 30 18.220 23.041 17.831 197 HG22 VAL 30 1HG2 VAL 30 16.887 23.438 18.936 198 HG23 VAL 30 2HG2 VAL 30 18.553 23.295 19.541 199 H CYS 31 H CYS 31 19.240 19.802 21.143 200 HA CYS 31 HA CYS 31 20.321 21.852 23.023 201 HB2 CYS 31 2HB CYS 31 19.307 19.837 24.123 202 HB3 CYS 31 3HB CYS 31 20.489 18.829 23.259 203 H CYS 32 H CYS 32 22.615 22.000 23.102 204 HA CYS 32 HA CYS 32 24.118 20.626 20.952 205 HB2 CYS 32 2HB CYS 32 23.213 23.023 20.364 206 HB3 CYS 32 3HB CYS 32 24.535 23.589 21.367 207 H ASP 33 H ASP 33 25.922 19.835 21.629 208 HA ASP 33 HA ASP 33 27.075 20.391 24.244 209 HB2 ASP 33 2HB ASP 33 27.497 18.227 23.841 210 HB3 ASP 33 3HB ASP 33 27.352 18.373 22.100 211 H LEU 34 H LEU 34 29.025 21.366 24.637 212 HA LEU 34 HA LEU 34 30.144 23.137 22.511 213 HB2 LEU 34 2HB LEU 34 29.757 23.805 25.445 214 HB3 LEU 34 3HB LEU 34 30.338 24.884 24.186 215 HG LEU 34 HG LEU 34 27.507 23.727 24.319 216 HD11 LEU 34 1HD1 LEU 34 28.528 26.502 25.027 217 HD12 LEU 34 2HD1 LEU 34 27.956 25.272 26.176 218 HD13 LEU 34 3HD1 LEU 34 26.828 25.980 25.009 219 HD21 LEU 34 3HD2 LEU 34 26.972 25.439 22.617 220 HD22 LEU 34 1HD2 LEU 34 28.167 24.301 21.999 221 HD23 LEU 34 2HD2 LEU 34 28.685 25.910 22.538 222 H SER 35 H SER 35 30.881 20.537 24.538 223 HA SER 35 HA SER 35 33.421 21.325 25.579 224 HB2 SER 35 2HB SER 35 31.903 19.450 26.382 225 HB3 SER 35 3HB SER 35 32.457 18.501 24.991 226 HG SER 35 HG SER 35 34.621 18.849 25.805 227 H LYS 36 H LYS 36 32.458 20.318 22.382 228 HA LYS 36 HA LYS 36 34.951 19.312 21.424 229 HB2 LYS 36 2HB LYS 36 33.996 19.628 19.225 230 HB3 LYS 36 3HB LYS 36 32.825 18.930 20.325 231 HG2 LYS 36 2HG LYS 36 31.443 20.438 19.330 232 HG3 LYS 36 3HG LYS 36 32.025 21.464 20.629 233 HD2 LYS 36 2HD LYS 36 32.118 22.782 18.668 234 HD3 LYS 36 3HD LYS 36 33.797 22.337 18.967 235 HE2 LYS 36 2HE LYS 36 33.631 20.524 17.292 236 HE3 LYS 36 3HE LYS 36 31.923 20.922 17.023 237 HZ1 LYS 36 3HZ LYS 36 33.372 21.900 15.372 238 HZ2 LYS 36 1HZ LYS 36 34.180 22.744 16.540 239 HZ3 LYS 36 2HZ LYS 36 32.593 23.068 16.244 240 H LEU 37 H LEU 37 33.941 22.568 22.195 241 HA LEU 37 HA LEU 37 35.792 23.977 20.490 242 HB2 LEU 37 2HB LEU 37 34.395 24.823 23.054 243 HB3 LEU 37 3HB LEU 37 35.208 25.896 21.927 244 HG LEU 37 HG LEU 37 32.747 24.216 21.229 245 HD11 LEU 37 1HD1 LEU 37 32.254 25.948 22.928 246 HD12 LEU 37 2HD1 LEU 37 31.493 26.312 21.371 247 HD13 LEU 37 3HD1 LEU 37 32.959 27.188 21.868 248 HD21 LEU 37 3HD2 LEU 37 32.601 25.714 19.249 249 HD22 LEU 37 1HD2 LEU 37 34.087 24.757 19.229 250 HD23 LEU 37 2HD2 LEU 37 34.147 26.464 19.709 251 H THR 38 H THR 38 36.199 22.268 23.482 252 HA THR 38 HA THR 38 38.900 23.462 23.865 253 HB THR 38 HB THR 38 37.303 24.034 25.659 254 HG1 THR 38 1HG THR 38 39.491 22.362 26.273 255 HG21 THR 38 1HG2 THR 38 36.662 22.336 27.331 256 HG22 THR 38 2HG2 THR 38 37.275 21.045 26.277 257 HG23 THR 38 3HG2 THR 38 35.888 22.042 25.772 258 H GLY 39 H GLY 39 37.465 20.885 22.511 259 HA2 GLY 39 2HA GLY 39 39.651 19.329 22.054 260 HA3 GLY 39 3HA GLY 39 39.063 18.688 23.601 Start of MODEL 11 1 H1 ASN 1 H1 ASN 1 15.722 22.255 33.534 2 H2 ASN 1 H2 ASN 1 14.311 22.364 32.678 3 H3 ASN 1 H3 ASN 1 14.790 20.912 33.305 4 HA ASN 1 HA ASN 1 15.149 20.939 30.982 5 HB2 ASN 1 2HB ASN 1 17.021 23.249 31.581 6 HB3 ASN 1 3HB ASN 1 16.819 22.468 30.005 7 HD21 ASN 1 2HD2 ASN 1 14.873 25.682 30.161 8 HD22 ASN 1 1HD2 ASN 1 16.551 25.256 30.420 9 H GLU 2 H GLU 2 16.355 19.170 30.642 10 HA GLU 2 HA GLU 2 18.388 18.210 32.344 11 HB2 GLU 2 2HB GLU 2 16.883 16.999 30.615 12 HB3 GLU 2 3HB GLU 2 18.043 17.501 29.399 13 HG2 GLU 2 2HG GLU 2 18.524 15.222 30.122 14 HG3 GLU 2 3HG GLU 2 19.851 16.287 30.573 15 H CYS 3 H CYS 3 18.523 20.225 29.451 16 HA CYS 3 HA CYS 3 21.285 20.138 28.840 17 HB2 CYS 3 2HB CYS 3 19.449 22.548 28.594 18 HB3 CYS 3 3HB CYS 3 20.907 22.222 27.663 19 H VAL 4 H VAL 4 19.444 22.412 30.915 20 HA VAL 4 HA VAL 4 21.699 23.865 31.885 21 HB VAL 4 HB VAL 4 18.902 23.554 33.051 22 HG11 VAL 4 1HG1 VAL 4 19.357 25.800 34.094 23 HG12 VAL 4 2HG1 VAL 4 20.416 24.541 34.729 24 HG13 VAL 4 3HG1 VAL 4 21.037 25.681 33.523 25 HG21 VAL 4 3HG2 VAL 4 19.966 25.735 31.192 26 HG22 VAL 4 1HG2 VAL 4 18.849 24.454 30.692 27 HG23 VAL 4 2HG2 VAL 4 18.333 25.661 31.868 28 H SER 5 H SER 5 19.876 21.060 33.171 29 HA SER 5 HA SER 5 20.970 21.019 35.755 30 HB2 SER 5 2HB SER 5 18.939 19.784 34.997 31 HB3 SER 5 3HB SER 5 19.975 18.662 34.094 32 HG SER 5 HG SER 5 19.385 17.956 36.235 33 H LYS 6 H LYS 6 22.129 19.428 32.752 34 HA LYS 6 HA LYS 6 24.505 18.318 34.070 35 HB2 LYS 6 2HB LYS 6 23.506 18.359 31.204 36 HB3 LYS 6 3HB LYS 6 25.059 17.663 31.693 37 HG2 LYS 6 2HG LYS 6 23.792 16.182 33.325 38 HG3 LYS 6 3HG LYS 6 22.290 16.739 32.560 39 HD2 LYS 6 2HD LYS 6 23.041 15.859 30.392 40 HD3 LYS 6 3HD LYS 6 24.617 15.429 31.084 41 HE2 LYS 6 2HE LYS 6 23.377 13.421 30.940 42 HE3 LYS 6 3HE LYS 6 23.457 13.863 32.661 43 HZ1 LYS 6 3HZ LYS 6 21.241 14.768 32.426 44 HZ2 LYS 6 1HZ LYS 6 21.321 13.153 32.078 45 HZ3 LYS 6 2HZ LYS 6 21.187 14.253 30.857 46 H GLY 7 H GLY 7 23.720 21.436 32.932 47 HA2 GLY 7 2HA GLY 7 25.092 23.273 33.128 48 HA3 GLY 7 3HA GLY 7 26.521 22.247 33.155 49 H PHE 8 H PHE 8 24.759 21.277 30.448 50 HA PHE 8 HA PHE 8 26.498 22.539 28.531 51 HB2 PHE 8 2HB PHE 8 23.835 21.088 28.201 52 HB3 PHE 8 3HB PHE 8 24.888 21.552 26.880 53 HD1 PHE 8 HD1 PHE 8 27.358 20.689 26.953 54 HD2 PHE 8 HD2 PHE 8 24.074 18.915 29.108 55 HE1 PHE 8 HE1 PHE 8 28.573 18.521 27.038 56 HE2 PHE 8 HE2 PHE 8 25.310 16.773 29.227 57 HZ PHE 8 HZ PHE 8 27.546 16.561 28.191 58 H GLY 9 H GLY 9 25.695 23.808 26.694 59 HA2 GLY 9 2HA GLY 9 23.946 26.046 27.412 60 HA3 GLY 9 3HA GLY 9 24.820 25.794 25.897 61 H CYS 10 H CYS 10 22.470 26.695 25.510 62 HA CYS 10 HA CYS 10 21.069 24.549 24.107 63 HB2 CYS 10 2HB CYS 10 19.947 24.446 26.216 64 HB3 CYS 10 3HB CYS 10 19.760 26.197 26.289 65 H LEU 11 H LEU 11 22.269 25.738 22.519 66 HA LEU 11 HA LEU 11 21.858 28.501 21.961 67 HB2 LEU 11 2HB LEU 11 22.978 26.125 20.441 68 HB3 LEU 11 3HB LEU 11 22.862 27.676 19.646 69 HG LEU 11 HG LEU 11 24.226 27.319 22.287 70 HD11 LEU 11 1HD1 LEU 11 25.665 27.121 19.642 71 HD12 LEU 11 2HD1 LEU 11 25.328 25.781 20.750 72 HD13 LEU 11 3HD1 LEU 11 26.388 27.105 21.254 73 HD21 LEU 11 3HD2 LEU 11 24.597 29.517 20.238 74 HD22 LEU 11 1HD2 LEU 11 25.486 29.356 21.758 75 HD23 LEU 11 2HD2 LEU 11 23.747 29.653 21.784 76 HA PRO 12 HA PRO 12 18.089 28.448 19.587 77 HB2 PRO 12 3HB PRO 12 18.327 30.746 19.441 78 HB3 PRO 12 2HB PRO 12 18.521 30.399 17.698 79 HG2 PRO 12 2HG PRO 12 20.915 30.430 17.888 80 HG3 PRO 12 3HG PRO 12 20.448 31.765 18.991 81 HD2 PRO 12 2HD PRO 12 21.976 29.688 19.865 82 HD3 PRO 12 3HD PRO 12 20.721 30.379 20.916 83 H GLN 13 H GLN 13 17.289 28.270 17.207 84 HA GLN 13 HA GLN 13 18.336 25.956 15.966 85 HB2 GLN 13 2HB GLN 13 16.453 28.159 15.050 86 HB3 GLN 13 3HB GLN 13 16.781 26.751 14.050 87 HG2 GLN 13 2HG GLN 13 15.847 26.332 16.910 88 HG3 GLN 13 3HG GLN 13 14.700 26.840 15.677 89 HE21 GLN 13 2HE2 GLN 13 16.404 23.221 14.694 90 HE22 GLN 13 1HE2 GLN 13 17.459 24.573 15.057 91 H SER 14 H SER 14 19.453 29.242 15.690 92 HA SER 14 HA SER 14 20.741 28.909 13.079 93 HB2 SER 14 2HB SER 14 20.879 31.177 15.104 94 HB3 SER 14 3HB SER 14 21.446 31.216 13.423 95 HG SER 14 HG SER 14 19.204 30.713 12.855 96 H ASP 15 H ASP 15 21.581 28.141 16.322 97 HA ASP 15 HA ASP 15 24.472 27.960 15.647 98 HB2 ASP 15 2HB ASP 15 23.139 29.309 17.982 99 HB3 ASP 15 3HB ASP 15 24.610 28.434 18.301 100 H CYS 16 H CYS 16 21.759 26.195 16.384 101 HA CYS 16 HA CYS 16 23.373 24.021 17.620 102 HB2 CYS 16 2HB CYS 16 21.720 24.967 19.151 103 HB3 CYS 16 3HB CYS 16 20.436 24.660 17.995 104 HA PRO 17 HA PRO 17 21.996 22.550 13.438 105 HB2 PRO 17 3HB PRO 17 23.995 23.302 12.496 106 HB3 PRO 17 2HB PRO 17 24.378 21.553 12.575 107 HG2 PRO 17 2HG PRO 17 25.545 21.831 14.659 108 HG3 PRO 17 3HG PRO 17 26.045 23.300 13.760 109 HD2 PRO 17 2HD PRO 17 24.879 23.460 16.199 110 HD3 PRO 17 3HD PRO 17 24.503 24.652 14.925 111 H GLN 18 H GLN 18 22.171 20.254 12.618 112 HA GLN 18 HA GLN 18 21.411 18.391 14.569 113 HB2 GLN 18 2HB GLN 18 22.338 18.061 11.689 114 HB3 GLN 18 3HB GLN 18 21.663 16.733 12.646 115 HG2 GLN 18 2HG GLN 18 19.555 17.924 12.953 116 HG3 GLN 18 3HG GLN 18 20.180 19.345 12.107 117 HE21 GLN 18 2HE2 GLN 18 19.892 17.931 8.824 118 HE22 GLN 18 1HE2 GLN 18 20.818 19.063 9.787 119 H GLU 19 H GLU 19 24.611 19.172 13.357 120 HA GLU 19 HA GLU 19 26.024 16.818 14.139 121 HB2 GLU 19 2HB GLU 19 26.930 19.699 13.744 122 HB3 GLU 19 3HB GLU 19 28.006 18.313 13.961 123 HG2 GLU 19 2HG GLU 19 27.114 17.275 11.904 124 HG3 GLU 19 3HG GLU 19 26.034 18.651 11.666 125 H ALA 20 H ALA 20 25.421 19.957 15.796 126 HA ALA 20 HA ALA 20 27.129 19.294 18.042 127 HB1 ALA 20 1HB ALA 20 26.444 21.540 18.826 128 HB2 ALA 20 2HB ALA 20 26.986 21.557 17.131 129 HB3 ALA 20 3HB ALA 20 25.252 21.625 17.501 130 H ARG 21 H ARG 21 23.952 18.342 17.382 131 HA ARG 21 HA ARG 21 22.601 18.715 19.837 132 HB2 ARG 21 2HB ARG 21 22.403 16.506 17.750 133 HB3 ARG 21 3HB ARG 21 21.287 16.668 19.108 134 HG2 ARG 21 2HG ARG 21 20.676 18.958 18.333 135 HG3 ARG 21 3HG ARG 21 21.686 18.715 16.900 136 HD2 ARG 21 2HD ARG 21 19.278 17.027 17.693 137 HD3 ARG 21 3HD ARG 21 19.314 18.266 16.428 138 HE ARG 21 HE ARG 21 21.365 16.373 15.896 139 HH11 ARG 21 1HH1 ARG 21 17.818 16.538 15.811 140 HH12 ARG 21 2HH1 ARG 21 17.702 15.321 14.560 141 HH21 ARG 21 2HH2 ARG 21 19.581 14.378 13.690 142 HH22 ARG 21 1HH2 ARG 21 21.164 14.805 14.314 143 H LEU 22 H LEU 22 22.358 17.503 21.663 144 HA LEU 22 HA LEU 22 24.426 15.529 22.373 145 HB2 LEU 22 2HB LEU 22 22.273 17.129 23.782 146 HB3 LEU 22 3HB LEU 22 22.964 15.733 24.598 147 HG LEU 22 HG LEU 22 24.823 17.800 23.382 148 HD11 LEU 22 1HD1 LEU 22 24.837 19.022 25.482 149 HD12 LEU 22 2HD1 LEU 22 23.520 18.003 26.114 150 HD13 LEU 22 3HD1 LEU 22 23.243 19.079 24.722 151 HD21 LEU 22 3HD2 LEU 22 25.769 15.651 24.208 152 HD22 LEU 22 1HD2 LEU 22 25.025 15.928 25.796 153 HD23 LEU 22 2HD2 LEU 22 26.306 16.997 25.216 154 H SER 23 H SER 23 23.578 13.695 23.740 155 HA SER 23 HA SER 23 21.966 11.861 22.220 156 HB2 SER 23 2HB SER 23 23.853 11.244 23.697 157 HB3 SER 23 3HB SER 23 22.944 11.810 25.107 158 HG SER 23 HG SER 23 22.204 9.702 23.352 159 H TYR 24 H TYR 24 21.117 14.397 24.354 160 HA TYR 24 HA TYR 24 18.313 13.531 24.662 161 HB2 TYR 24 2HB TYR 24 18.642 14.488 27.117 162 HB3 TYR 24 3HB TYR 24 18.990 12.820 26.718 163 HD1 TYR 24 HD1 TYR 24 20.776 16.154 26.891 164 HD2 TYR 24 HD2 TYR 24 21.010 11.871 27.328 165 HE1 TYR 24 HE1 TYR 24 23.121 16.357 27.694 166 HE2 TYR 24 HE2 TYR 24 23.348 12.065 28.109 167 HH TYR 24 HH TYR 24 25.105 13.475 28.526 168 H GLY 25 H GLY 25 17.023 15.389 25.613 169 HA2 GLY 25 2HA GLY 25 17.856 18.038 24.579 170 HA3 GLY 25 3HA GLY 25 16.497 17.209 23.809 171 H GLY 26 H GLY 26 17.706 18.636 26.798 172 HA2 GLY 26 2HA GLY 26 15.238 18.366 28.307 173 HA3 GLY 26 3HA GLY 26 16.714 19.224 28.753 174 H CYS 27 H CYS 27 16.333 20.708 25.978 175 HA CYS 27 HA CYS 27 14.696 22.920 27.002 176 HB2 CYS 27 2HB CYS 27 16.489 22.486 24.620 177 HB3 CYS 27 3HB CYS 27 15.368 23.826 24.646 178 H SER 28 H SER 28 13.427 23.927 24.911 179 HA SER 28 HA SER 28 11.142 22.058 24.698 180 HB2 SER 28 2HB SER 28 10.971 24.336 25.796 181 HB3 SER 28 3HB SER 28 11.227 25.055 24.194 182 HG SER 28 HG SER 28 9.359 23.898 23.502 183 H THR 29 H THR 29 13.715 23.235 22.783 184 HA THR 29 HA THR 29 12.319 22.525 20.249 185 HB THR 29 HB THR 29 13.566 24.364 19.141 186 HG1 THR 29 1HG THR 29 14.261 26.076 20.551 187 HG21 THR 29 1HG2 THR 29 11.177 24.633 19.824 188 HG22 THR 29 2HG2 THR 29 12.077 26.161 19.823 189 HG23 THR 29 3HG2 THR 29 11.726 25.344 21.362 190 H VAL 30 H VAL 30 15.560 23.380 21.497 191 HA VAL 30 HA VAL 30 16.734 20.889 20.440 192 HB VAL 30 HB VAL 30 18.446 22.073 19.151 193 HG11 VAL 30 1HG1 VAL 30 15.721 22.783 18.039 194 HG12 VAL 30 2HG1 VAL 30 17.236 22.543 17.152 195 HG13 VAL 30 3HG1 VAL 30 16.473 21.168 17.971 196 HG21 VAL 30 3HG2 VAL 30 16.765 24.595 19.510 197 HG22 VAL 30 1HG2 VAL 30 18.386 24.307 20.184 198 HG23 VAL 30 2HG2 VAL 30 18.162 24.420 18.433 199 H CYS 31 H CYS 31 18.930 20.542 21.161 200 HA CYS 31 HA CYS 31 19.898 22.193 23.432 201 HB2 CYS 31 2HB CYS 31 18.306 20.413 24.232 202 HB3 CYS 31 3HB CYS 31 19.367 19.207 23.520 203 H CYS 32 H CYS 32 21.997 22.622 22.929 204 HA CYS 32 HA CYS 32 23.636 20.536 21.587 205 HB2 CYS 32 2HB CYS 32 23.310 23.482 20.969 206 HB3 CYS 32 3HB CYS 32 24.779 22.595 20.587 207 H ASP 33 H ASP 33 25.574 20.187 22.288 208 HA ASP 33 HA ASP 33 26.577 21.348 24.779 209 HB2 ASP 33 2HB ASP 33 26.913 19.048 24.589 210 HB3 ASP 33 3HB ASP 33 27.364 19.123 22.900 211 H LEU 34 H LEU 34 27.766 23.090 24.859 212 HA LEU 34 HA LEU 34 29.510 23.864 22.596 213 HB2 LEU 34 2HB LEU 34 29.102 26.169 23.112 214 HB3 LEU 34 3HB LEU 34 27.612 25.290 22.813 215 HG LEU 34 HG LEU 34 27.259 25.182 25.326 216 HD11 LEU 34 1HD1 LEU 34 29.454 27.308 25.308 217 HD12 LEU 34 2HD1 LEU 34 29.451 25.785 26.229 218 HD13 LEU 34 3HD1 LEU 34 28.309 27.055 26.639 219 HD21 LEU 34 3HD2 LEU 34 26.014 26.674 23.840 220 HD22 LEU 34 1HD2 LEU 34 27.313 27.889 23.918 221 HD23 LEU 34 2HD2 LEU 34 26.358 27.503 25.364 222 H SER 35 H SER 35 29.523 22.667 25.716 223 HA SER 35 HA SER 35 31.889 23.937 26.783 224 HB2 SER 35 2HB SER 35 30.095 22.850 28.135 225 HB3 SER 35 3HB SER 35 30.576 21.277 27.470 226 HG SER 35 HG SER 35 32.630 21.605 28.403 227 H LYS 36 H LYS 36 31.359 21.502 24.344 228 HA LYS 36 HA LYS 36 33.882 20.162 24.403 229 HB2 LYS 36 2HB LYS 36 33.445 19.730 22.015 230 HB3 LYS 36 3HB LYS 36 32.114 19.267 23.060 231 HG2 LYS 36 2HG LYS 36 30.758 21.132 22.340 232 HG3 LYS 36 3HG LYS 36 32.146 21.949 21.629 233 HD2 LYS 36 2HD LYS 36 30.933 21.105 19.797 234 HD3 LYS 36 3HD LYS 36 32.365 20.095 19.962 235 HE2 LYS 36 2HE LYS 36 30.697 18.529 19.576 236 HE3 LYS 36 3HE LYS 36 30.828 18.495 21.342 237 HZ1 LYS 36 3HZ LYS 36 28.827 19.948 19.746 238 HZ2 LYS 36 1HZ LYS 36 28.938 20.021 21.390 239 HZ3 LYS 36 2HZ LYS 36 28.555 18.596 20.651 240 H LEU 37 H LEU 37 33.057 23.450 23.554 241 HA LEU 37 HA LEU 37 35.707 23.948 22.322 242 HB2 LEU 37 2HB LEU 37 33.224 25.687 22.555 243 HB3 LEU 37 3HB LEU 37 34.722 26.148 21.771 244 HG LEU 37 HG LEU 37 32.865 23.899 20.864 245 HD11 LEU 37 1HD1 LEU 37 33.345 26.659 19.691 246 HD12 LEU 37 2HD1 LEU 37 31.885 26.112 20.543 247 HD13 LEU 37 3HD1 LEU 37 32.322 25.389 18.988 248 HD21 LEU 37 3HD2 LEU 37 35.170 23.381 20.203 249 HD22 LEU 37 1HD2 LEU 37 35.375 25.020 19.542 250 HD23 LEU 37 2HD2 LEU 37 34.238 23.882 18.790 251 H THR 38 H THR 38 33.437 25.349 24.784 252 HA THR 38 HA THR 38 35.625 26.687 26.166 253 HB THR 38 HB THR 38 33.707 27.519 27.578 254 HG1 THR 38 1HG THR 38 31.661 27.218 26.846 255 HG21 THR 38 1HG2 THR 38 32.913 29.115 25.886 256 HG22 THR 38 2HG2 THR 38 33.568 28.088 24.591 257 HG23 THR 38 3HG2 THR 38 34.664 28.863 25.756 258 H GLY 39 H GLY 39 36.562 24.485 26.494 259 HA2 GLY 39 2HA GLY 39 35.934 23.601 29.263 260 HA3 GLY 39 3HA GLY 39 35.983 22.384 27.981 Start of MODEL 12 1 H1 ASN 1 H1 ASN 1 15.316 25.372 34.146 2 H2 ASN 1 H2 ASN 1 14.360 25.978 32.946 3 H3 ASN 1 H3 ASN 1 13.902 24.621 33.761 4 HA ASN 1 HA ASN 1 14.733 24.110 31.565 5 HB2 ASN 1 2HB ASN 1 17.349 25.165 32.674 6 HB3 ASN 1 3HB ASN 1 17.107 24.395 31.100 7 HD21 ASN 1 2HD2 ASN 1 17.124 28.237 30.914 8 HD22 ASN 1 1HD2 ASN 1 18.154 27.131 31.795 9 H GLU 2 H GLU 2 15.975 22.163 31.150 10 HA GLU 2 HA GLU 2 16.342 20.471 33.577 11 HB2 GLU 2 2HB GLU 2 14.195 20.218 32.306 12 HB3 GLU 2 3HB GLU 2 15.127 19.723 30.898 13 HG2 GLU 2 2HG GLU 2 16.097 17.835 32.248 14 HG3 GLU 2 3HG GLU 2 15.075 18.313 33.605 15 H CYS 3 H CYS 3 17.159 20.698 30.048 16 HA CYS 3 HA CYS 3 19.388 18.891 30.234 17 HB2 CYS 3 2HB CYS 3 18.039 19.736 28.144 18 HB3 CYS 3 3HB CYS 3 19.180 21.078 28.176 19 H VAL 4 H VAL 4 19.001 22.328 30.893 20 HA VAL 4 HA VAL 4 21.820 22.990 30.957 21 HB VAL 4 HB VAL 4 19.412 24.422 32.121 22 HG11 VAL 4 1HG1 VAL 4 21.462 25.289 33.131 23 HG12 VAL 4 2HG1 VAL 4 22.209 25.465 31.527 24 HG13 VAL 4 3HG1 VAL 4 20.814 26.462 31.988 25 HG21 VAL 4 3HG2 VAL 4 19.561 25.851 30.073 26 HG22 VAL 4 1HG2 VAL 4 20.807 24.763 29.429 27 HG23 VAL 4 2HG2 VAL 4 19.150 24.179 29.696 28 H SER 5 H SER 5 19.525 21.583 33.265 29 HA SER 5 HA SER 5 21.110 22.001 35.627 30 HB2 SER 5 2HB SER 5 19.065 19.825 35.046 31 HB3 SER 5 3HB SER 5 19.731 20.243 36.630 32 HG SER 5 HG SER 5 17.710 21.221 36.201 33 H LYS 6 H LYS 6 21.143 19.478 33.067 34 HA LYS 6 HA LYS 6 23.177 17.833 34.279 35 HB2 LYS 6 2HB LYS 6 21.890 18.156 31.573 36 HB3 LYS 6 3HB LYS 6 23.442 17.346 31.636 37 HG2 LYS 6 2HG LYS 6 21.167 16.493 33.468 38 HG3 LYS 6 3HG LYS 6 21.287 15.927 31.797 39 HD2 LYS 6 2HD LYS 6 23.571 15.074 32.217 40 HD3 LYS 6 3HD LYS 6 23.461 15.566 33.914 41 HE2 LYS 6 2HE LYS 6 21.589 13.579 32.552 42 HE3 LYS 6 3HE LYS 6 23.028 13.141 33.492 43 HZ1 LYS 6 3HZ LYS 6 21.072 13.026 34.832 44 HZ2 LYS 6 1HZ LYS 6 20.694 14.596 34.519 45 HZ3 LYS 6 2HZ LYS 6 22.050 14.231 35.386 46 H GLY 7 H GLY 7 23.265 20.936 32.713 47 HA2 GLY 7 2HA GLY 7 25.203 22.284 33.149 48 HA3 GLY 7 3HA GLY 7 26.244 20.927 32.741 49 H PHE 8 H PHE 8 23.771 20.840 30.467 50 HA PHE 8 HA PHE 8 25.523 21.830 28.388 51 HB2 PHE 8 2HB PHE 8 22.692 20.751 28.252 52 HB3 PHE 8 3HB PHE 8 23.780 21.000 26.885 53 HD1 PHE 8 HD1 PHE 8 22.593 18.500 29.076 54 HD2 PHE 8 HD2 PHE 8 26.217 19.916 27.227 55 HE1 PHE 8 HE1 PHE 8 23.586 16.253 29.323 56 HE2 PHE 8 HE2 PHE 8 27.225 17.646 27.502 57 HZ PHE 8 HZ PHE 8 25.912 15.827 28.542 58 H GLY 9 H GLY 9 24.353 23.095 26.490 59 HA2 GLY 9 2HA GLY 9 23.760 25.748 27.622 60 HA3 GLY 9 3HA GLY 9 24.168 25.316 25.955 61 H CYS 10 H CYS 10 21.975 23.196 26.002 62 HA CYS 10 HA CYS 10 19.951 23.002 25.057 63 HB2 CYS 10 2HB CYS 10 19.435 23.359 27.468 64 HB3 CYS 10 3HB CYS 10 19.099 25.050 27.118 65 H LEU 11 H LEU 11 21.466 24.466 23.412 66 HA LEU 11 HA LEU 11 20.551 27.037 22.701 67 HB2 LEU 11 2HB LEU 11 22.085 24.880 21.260 68 HB3 LEU 11 3HB LEU 11 21.640 26.330 20.430 69 HG LEU 11 HG LEU 11 22.890 27.706 21.909 70 HD11 LEU 11 1HD1 LEU 11 22.797 26.596 24.053 71 HD12 LEU 11 2HD1 LEU 11 24.466 26.833 23.598 72 HD13 LEU 11 3HD1 LEU 11 23.740 25.231 23.436 73 HD21 LEU 11 3HD2 LEU 11 24.571 25.380 20.946 74 HD22 LEU 11 1HD2 LEU 11 25.131 27.038 21.230 75 HD23 LEU 11 2HD2 LEU 11 23.970 26.711 19.938 76 HA PRO 12 HA PRO 12 16.876 26.158 20.385 77 HB2 PRO 12 3HB PRO 12 16.615 28.486 20.345 78 HB3 PRO 12 2HB PRO 12 16.750 28.216 18.588 79 HG2 PRO 12 2HG PRO 12 19.097 28.726 18.629 80 HG3 PRO 12 3HG PRO 12 18.435 29.930 19.784 81 HD2 PRO 12 2HD PRO 12 20.408 28.201 20.502 82 HD3 PRO 12 3HD PRO 12 19.109 28.633 21.650 83 H GLN 13 H GLN 13 15.992 25.812 18.201 84 HA GLN 13 HA GLN 13 17.562 24.078 16.551 85 HB2 GLN 13 2HB GLN 13 15.507 23.881 15.248 86 HB3 GLN 13 3HB GLN 13 15.206 23.666 16.967 87 HG2 GLN 13 2HG GLN 13 14.280 25.888 17.174 88 HG3 GLN 13 3HG GLN 13 14.769 26.303 15.524 89 HE21 GLN 13 2HE2 GLN 13 11.925 24.849 14.007 90 HE22 GLN 13 1HE2 GLN 13 13.422 25.745 13.811 91 H SER 14 H SER 14 17.996 27.260 16.690 92 HA SER 14 HA SER 14 18.354 27.683 13.762 93 HB2 SER 14 2HB SER 14 17.991 30.059 14.217 94 HB3 SER 14 3HB SER 14 16.594 29.080 14.698 95 HG SER 14 HG SER 14 18.636 30.055 16.430 96 H ASP 15 H ASP 15 20.088 27.177 16.655 97 HA ASP 15 HA ASP 15 22.505 28.498 15.515 98 HB2 ASP 15 2HB ASP 15 21.496 28.720 18.374 99 HB3 ASP 15 3HB ASP 15 23.100 29.211 17.840 100 H CYS 16 H CYS 16 21.150 25.687 17.112 101 HA CYS 16 HA CYS 16 23.764 24.582 17.855 102 HB2 CYS 16 2HB CYS 16 21.728 24.132 19.191 103 HB3 CYS 16 3HB CYS 16 20.983 23.352 17.798 104 HA PRO 17 HA PRO 17 23.892 22.930 13.563 105 HB2 PRO 17 3HB PRO 17 26.015 23.804 13.384 106 HB3 PRO 17 2HB PRO 17 26.475 22.077 13.510 107 HG2 PRO 17 2HG PRO 17 26.929 22.277 15.820 108 HG3 PRO 17 3HG PRO 17 27.505 23.872 15.249 109 HD2 PRO 17 2HD PRO 17 25.595 23.623 17.204 110 HD3 PRO 17 3HD PRO 17 25.567 24.964 16.031 111 H GLN 18 H GLN 18 24.255 20.777 12.643 112 HA GLN 18 HA GLN 18 22.921 18.823 14.199 113 HB2 GLN 18 2HB GLN 18 24.156 18.774 11.423 114 HB3 GLN 18 3HB GLN 18 23.244 17.424 12.101 115 HG2 GLN 18 2HG GLN 18 21.261 18.837 12.394 116 HG3 GLN 18 3HG GLN 18 22.137 20.223 11.737 117 HE21 GLN 18 2HE2 GLN 18 21.110 19.453 8.467 118 HE22 GLN 18 1HE2 GLN 18 21.473 20.655 9.691 119 H GLU 19 H GLU 19 26.254 19.461 14.189 120 HA GLU 19 HA GLU 19 26.992 16.664 14.875 121 HB2 GLU 19 2HB GLU 19 28.685 19.144 14.375 122 HB3 GLU 19 3HB GLU 19 29.309 17.551 14.818 123 HG2 GLU 19 2HG GLU 19 28.321 16.581 12.759 124 HG3 GLU 19 3HG GLU 19 27.756 18.188 12.275 125 H ALA 20 H ALA 20 26.664 19.931 16.271 126 HA ALA 20 HA ALA 20 27.956 19.221 18.775 127 HB1 ALA 20 1HB ALA 20 27.262 21.479 19.465 128 HB2 ALA 20 2HB ALA 20 28.051 21.509 17.871 129 HB3 ALA 20 3HB ALA 20 26.278 21.633 18.002 130 H ARG 21 H ARG 21 24.680 19.030 17.559 131 HA ARG 21 HA ARG 21 23.251 19.098 20.015 132 HB2 ARG 21 2HB ARG 21 21.434 18.038 18.789 133 HB3 ARG 21 3HB ARG 21 22.159 19.346 17.846 134 HG2 ARG 21 2HG ARG 21 23.392 17.747 16.492 135 HG3 ARG 21 3HG ARG 21 22.716 16.388 17.419 136 HD2 ARG 21 2HD ARG 21 20.455 16.966 16.737 137 HD3 ARG 21 3HD ARG 21 21.020 18.437 15.923 138 HE ARG 21 HE ARG 21 22.472 16.429 14.741 139 HH11 ARG 21 1HH1 ARG 21 18.986 17.086 15.074 140 HH12 ARG 21 2HH1 ARG 21 18.607 16.340 13.529 141 HH21 ARG 21 2HH2 ARG 21 20.226 15.425 12.257 142 HH22 ARG 21 1HH2 ARG 21 21.904 15.468 12.755 143 H LEU 22 H LEU 22 22.224 17.310 21.160 144 HA LEU 22 HA LEU 22 23.970 14.944 21.437 145 HB2 LEU 22 2HB LEU 22 21.914 16.297 23.210 146 HB3 LEU 22 3HB LEU 22 22.798 14.837 23.642 147 HG LEU 22 HG LEU 22 24.101 17.552 23.118 148 HD11 LEU 22 1HD1 LEU 22 23.549 16.063 25.709 149 HD12 LEU 22 2HD1 LEU 22 22.697 17.520 25.140 150 HD13 LEU 22 3HD1 LEU 22 24.425 17.609 25.535 151 HD21 LEU 22 3HD2 LEU 22 25.673 15.739 22.621 152 HD22 LEU 22 1HD2 LEU 22 25.245 14.907 24.139 153 HD23 LEU 22 2HD2 LEU 22 26.107 16.453 24.177 154 H SER 23 H SER 23 22.917 12.964 22.029 155 HA SER 23 HA SER 23 20.581 12.317 20.332 156 HB2 SER 23 2HB SER 23 22.641 10.882 20.432 157 HB3 SER 23 3HB SER 23 22.254 10.516 22.120 158 HG SER 23 HG SER 23 20.169 9.804 21.278 159 H TYR 24 H TYR 24 20.979 13.590 23.389 160 HA TYR 24 HA TYR 24 18.383 12.681 24.395 161 HB2 TYR 24 2HB TYR 24 19.146 11.836 26.382 162 HB3 TYR 24 3HB TYR 24 20.194 11.094 25.194 163 HD1 TYR 24 HD1 TYR 24 22.438 12.957 24.757 164 HD2 TYR 24 HD2 TYR 24 20.210 12.180 28.406 165 HE1 TYR 24 HE1 TYR 24 24.422 13.576 26.149 166 HE2 TYR 24 HE2 TYR 24 22.211 12.806 29.737 167 HH TYR 24 HH TYR 24 24.412 13.406 29.645 168 H GLY 25 H GLY 25 18.020 13.875 26.612 169 HA2 GLY 25 2HA GLY 25 19.135 16.037 27.676 170 HA3 GLY 25 3HA GLY 25 18.524 16.753 26.177 171 H GLY 26 H GLY 26 17.360 18.074 27.739 172 HA2 GLY 26 2HA GLY 26 14.704 16.945 28.493 173 HA3 GLY 26 3HA GLY 26 15.659 17.903 29.619 174 H CYS 27 H CYS 27 16.101 19.081 26.430 175 HA CYS 27 HA CYS 27 14.643 21.529 26.906 176 HB2 CYS 27 2HB CYS 27 15.981 20.404 24.428 177 HB3 CYS 27 3HB CYS 27 15.437 22.063 24.612 178 H SER 28 H SER 28 13.271 22.374 24.973 179 HA SER 28 HA SER 28 10.953 20.558 24.725 180 HB2 SER 28 2HB SER 28 10.765 22.796 25.838 181 HB3 SER 28 3HB SER 28 11.163 23.568 24.285 182 HG SER 28 HG SER 28 9.306 22.574 23.419 183 H THR 29 H THR 29 13.596 21.475 22.829 184 HA THR 29 HA THR 29 12.255 20.594 20.380 185 HB THR 29 HB THR 29 11.801 22.894 20.192 186 HG1 THR 29 1HG THR 29 12.929 23.342 18.308 187 HG21 THR 29 1HG2 THR 29 14.726 23.547 20.668 188 HG22 THR 29 2HG2 THR 29 13.366 23.925 21.746 189 HG23 THR 29 3HG2 THR 29 13.458 24.672 20.147 190 H VAL 30 H VAL 30 15.460 21.764 21.716 191 HA VAL 30 HA VAL 30 16.799 19.383 20.834 192 HB VAL 30 HB VAL 30 16.954 20.366 18.724 193 HG11 VAL 30 1HG1 VAL 30 17.213 23.114 20.016 194 HG12 VAL 30 2HG1 VAL 30 17.513 22.783 18.299 195 HG13 VAL 30 3HG1 VAL 30 15.908 22.514 18.962 196 HG21 VAL 30 3HG2 VAL 30 19.312 21.642 20.133 197 HG22 VAL 30 1HG2 VAL 30 19.226 19.924 19.645 198 HG23 VAL 30 2HG2 VAL 30 19.205 21.212 18.413 199 H CYS 31 H CYS 31 18.711 19.147 21.993 200 HA CYS 31 HA CYS 31 19.608 21.415 23.689 201 HB2 CYS 31 2HB CYS 31 18.705 19.414 24.946 202 HB3 CYS 31 3HB CYS 31 20.052 18.485 24.299 203 H CYS 32 H CYS 32 21.844 21.703 23.893 204 HA CYS 32 HA CYS 32 23.573 20.476 21.822 205 HB2 CYS 32 2HB CYS 32 22.273 22.801 21.371 206 HB3 CYS 32 3HB CYS 32 23.686 23.452 22.173 207 H ASP 33 H ASP 33 25.520 20.064 22.552 208 HA ASP 33 HA ASP 33 26.314 20.944 25.280 209 HB2 ASP 33 2HB ASP 33 26.409 18.599 25.064 210 HB3 ASP 33 3HB ASP 33 27.144 18.661 23.478 211 H LEU 34 H LEU 34 27.994 22.147 25.687 212 HA LEU 34 HA LEU 34 29.512 23.354 23.423 213 HB2 LEU 34 2HB LEU 34 29.035 24.567 26.154 214 HB3 LEU 34 3HB LEU 34 29.689 25.357 24.732 215 HG LEU 34 HG LEU 34 26.819 24.381 25.072 216 HD11 LEU 34 1HD1 LEU 34 27.369 26.315 26.479 217 HD12 LEU 34 2HD1 LEU 34 26.270 26.772 25.170 218 HD13 LEU 34 3HD1 LEU 34 27.991 27.195 25.064 219 HD21 LEU 34 3HD2 LEU 34 28.085 25.980 22.800 220 HD22 LEU 34 1HD2 LEU 34 26.360 25.617 22.982 221 HD23 LEU 34 2HD2 LEU 34 27.497 24.307 22.683 222 H SER 35 H SER 35 30.023 21.033 25.755 223 HA SER 35 HA SER 35 32.501 21.738 26.933 224 HB2 SER 35 2HB SER 35 31.491 18.977 26.133 225 HB3 SER 35 3HB SER 35 32.821 19.323 27.250 226 HG SER 35 HG SER 35 30.076 19.863 27.547 227 H LYS 36 H LYS 36 31.714 20.471 23.726 228 HA LYS 36 HA LYS 36 34.340 19.687 22.919 229 HB2 LYS 36 2HB LYS 36 31.888 20.501 21.302 230 HB3 LYS 36 3HB LYS 36 33.329 19.699 20.654 231 HG2 LYS 36 2HG LYS 36 32.932 17.763 22.151 232 HG3 LYS 36 3HG LYS 36 31.454 18.516 22.748 233 HD2 LYS 36 2HD LYS 36 31.957 17.795 19.840 234 HD3 LYS 36 3HD LYS 36 31.101 16.779 21.001 235 HE2 LYS 36 2HE LYS 36 30.231 19.607 20.287 236 HE3 LYS 36 3HE LYS 36 29.664 18.145 19.452 237 HZ1 LYS 36 3HZ LYS 36 29.353 18.649 22.331 238 HZ2 LYS 36 1HZ LYS 36 28.740 17.375 21.471 239 HZ3 LYS 36 2HZ LYS 36 28.191 18.905 21.183 240 H LEU 37 H LEU 37 32.656 22.827 22.866 241 HA LEU 37 HA LEU 37 34.471 24.136 21.045 242 HB2 LEU 37 2HB LEU 37 32.630 25.314 23.168 243 HB3 LEU 37 3HB LEU 37 33.434 26.213 21.891 244 HG LEU 37 HG LEU 37 31.300 24.076 21.487 245 HD11 LEU 37 1HD1 LEU 37 30.471 26.184 22.478 246 HD12 LEU 37 2HD1 LEU 37 29.872 25.966 20.825 247 HD13 LEU 37 3HD1 LEU 37 31.197 27.105 21.145 248 HD21 LEU 37 3HD2 LEU 37 32.696 25.878 19.449 249 HD22 LEU 37 1HD2 LEU 37 31.270 24.872 19.115 250 HD23 LEU 37 2HD2 LEU 37 32.802 24.107 19.537 251 H THR 38 H THR 38 34.185 24.102 24.627 252 HA THR 38 HA THR 38 36.648 25.583 25.010 253 HB THR 38 HB THR 38 34.720 25.753 26.538 254 HG1 THR 38 1HG THR 38 37.117 24.765 27.650 255 HG21 THR 38 1HG2 THR 38 34.301 24.026 28.237 256 HG22 THR 38 2HG2 THR 38 35.419 22.918 27.421 257 HG23 THR 38 3HG2 THR 38 33.925 23.442 26.615 258 H GLY 39 H GLY 39 36.142 22.416 24.046 259 HA2 GLY 39 2HA GLY 39 38.345 21.106 25.453 260 HA3 GLY 39 3HA GLY 39 37.424 20.480 24.079 Start of MODEL 13 1 H1 ASN 1 H1 ASN 1 14.734 21.963 33.509 2 H2 ASN 1 H2 ASN 1 13.174 21.894 32.975 3 H3 ASN 1 H3 ASN 1 13.871 20.569 33.663 4 HA ASN 1 HA ASN 1 13.738 20.309 31.308 5 HB2 ASN 1 2HB ASN 1 13.857 22.760 30.826 6 HB3 ASN 1 3HB ASN 1 15.579 22.722 31.232 7 HD21 ASN 1 2HD2 ASN 1 15.392 22.629 27.564 8 HD22 ASN 1 1HD2 ASN 1 15.015 23.751 28.858 9 H GLU 2 H GLU 2 14.846 18.487 31.109 10 HA GLU 2 HA GLU 2 17.084 17.824 32.670 11 HB2 GLU 2 2HB GLU 2 15.282 16.386 31.408 12 HB3 GLU 2 3HB GLU 2 16.378 16.476 30.047 13 HG2 GLU 2 2HG GLU 2 16.873 14.431 31.114 14 HG3 GLU 2 3HG GLU 2 18.194 15.494 31.572 15 H CYS 3 H CYS 3 16.911 19.254 29.471 16 HA CYS 3 HA CYS 3 19.643 18.688 28.696 17 HB2 CYS 3 2HB CYS 3 17.366 19.881 27.441 18 HB3 CYS 3 3HB CYS 3 18.654 21.078 27.409 19 H VAL 4 H VAL 4 18.032 21.606 30.054 20 HA VAL 4 HA VAL 4 20.441 23.157 30.305 21 HB VAL 4 HB VAL 4 17.697 23.432 31.582 22 HG11 VAL 4 1HG1 VAL 4 19.969 25.459 31.452 23 HG12 VAL 4 2HG1 VAL 4 18.295 25.813 31.931 24 HG13 VAL 4 3HG1 VAL 4 19.270 24.731 32.916 25 HG21 VAL 4 3HG2 VAL 4 18.951 24.836 29.173 26 HG22 VAL 4 1HG2 VAL 4 17.713 23.574 29.084 27 HG23 VAL 4 2HG2 VAL 4 17.325 25.126 29.832 28 H SER 5 H SER 5 18.745 20.893 32.479 29 HA SER 5 HA SER 5 20.213 21.428 34.875 30 HB2 SER 5 2HB SER 5 18.100 20.170 34.786 31 HB3 SER 5 3HB SER 5 18.910 18.866 33.888 32 HG SER 5 HG SER 5 19.516 19.763 36.525 33 H LYS 6 H LYS 6 20.831 19.215 32.102 34 HA LYS 6 HA LYS 6 23.379 18.231 33.100 35 HB2 LYS 6 2HB LYS 6 21.857 18.131 30.490 36 HB3 LYS 6 3HB LYS 6 23.531 17.583 30.562 37 HG2 LYS 6 2HG LYS 6 21.414 16.505 32.446 38 HG3 LYS 6 3HG LYS 6 21.716 15.828 30.841 39 HD2 LYS 6 2HD LYS 6 24.074 15.374 31.412 40 HD3 LYS 6 3HD LYS 6 23.843 16.071 33.029 41 HE2 LYS 6 2HE LYS 6 22.156 14.370 33.538 42 HE3 LYS 6 3HE LYS 6 22.383 13.647 31.927 43 HZ1 LYS 6 3HZ LYS 6 24.653 13.209 32.516 44 HZ2 LYS 6 1HZ LYS 6 23.623 12.506 33.598 45 HZ3 LYS 6 2HZ LYS 6 24.435 13.879 34.019 46 H GLY 7 H GLY 7 22.506 21.319 31.972 47 HA2 GLY 7 2HA GLY 7 23.941 23.109 32.000 48 HA3 GLY 7 3HA GLY 7 25.336 22.068 31.730 49 H PHE 8 H PHE 8 22.929 21.263 29.451 50 HA PHE 8 HA PHE 8 24.439 22.445 27.267 51 HB2 PHE 8 2HB PHE 8 21.840 20.860 27.266 52 HB3 PHE 8 3HB PHE 8 22.842 21.209 25.868 53 HD1 PHE 8 HD1 PHE 8 25.480 20.571 26.302 54 HD2 PHE 8 HD2 PHE 8 22.067 18.628 28.089 55 HE1 PHE 8 HE1 PHE 8 26.803 18.495 26.578 56 HE2 PHE 8 HE2 PHE 8 23.390 16.560 28.350 57 HZ PHE 8 HZ PHE 8 25.740 16.471 27.610 58 H GLY 9 H GLY 9 23.122 23.395 25.412 59 HA2 GLY 9 2HA GLY 9 21.786 25.842 26.412 60 HA3 GLY 9 3HA GLY 9 22.559 25.604 24.844 61 H CYS 10 H CYS 10 20.335 26.813 24.613 62 HA CYS 10 HA CYS 10 18.472 24.892 23.365 63 HB2 CYS 10 2HB CYS 10 17.619 27.197 25.151 64 HB3 CYS 10 3HB CYS 10 16.551 26.318 24.071 65 H LEU 11 H LEU 11 20.091 25.605 21.746 66 HA LEU 11 HA LEU 11 20.343 28.246 20.772 67 HB2 LEU 11 2HB LEU 11 20.865 25.456 19.719 68 HB3 LEU 11 3HB LEU 11 21.044 26.826 18.644 69 HG LEU 11 HG LEU 11 22.689 27.844 20.143 70 HD11 LEU 11 1HD1 LEU 11 23.834 26.454 21.873 71 HD12 LEU 11 2HD1 LEU 11 22.534 25.249 21.742 72 HD13 LEU 11 3HD1 LEU 11 22.187 26.894 22.332 73 HD21 LEU 11 3HD2 LEU 11 23.403 26.560 18.248 74 HD22 LEU 11 1HD2 LEU 11 23.364 25.054 19.192 75 HD23 LEU 11 2HD2 LEU 11 24.530 26.333 19.590 76 HA PRO 12 HA PRO 12 16.705 28.660 18.183 77 HB2 PRO 12 3HB PRO 12 17.459 30.852 17.821 78 HB3 PRO 12 2HB PRO 12 17.541 30.243 16.136 79 HG2 PRO 12 2HG PRO 12 19.852 29.771 16.327 80 HG3 PRO 12 3HG PRO 12 19.749 31.295 17.266 81 HD2 PRO 12 2HD PRO 12 20.783 29.011 18.367 82 HD3 PRO 12 3HD PRO 12 19.813 30.148 19.333 83 H GLN 13 H GLN 13 15.853 28.186 15.993 84 HA GLN 13 HA GLN 13 16.627 25.607 15.168 85 HB2 GLN 13 2HB GLN 13 14.707 27.657 13.957 86 HB3 GLN 13 3HB GLN 13 14.798 25.955 13.475 87 HG2 GLN 13 2HG GLN 13 14.189 25.227 15.718 88 HG3 GLN 13 3HG GLN 13 14.186 26.889 16.309 89 HE21 GLN 13 2HE2 GLN 13 10.921 25.472 14.243 90 HE22 GLN 13 1HE2 GLN 13 12.391 24.523 14.391 91 H SER 14 H SER 14 17.726 28.737 14.037 92 HA SER 14 HA SER 14 18.674 27.788 11.452 93 HB2 SER 14 2HB SER 14 17.870 30.115 11.859 94 HB3 SER 14 3HB SER 14 19.239 30.381 12.956 95 HG SER 14 HG SER 14 20.597 29.866 11.137 96 H ASP 15 H ASP 15 19.947 27.712 14.697 97 HA ASP 15 HA ASP 15 22.709 27.261 13.686 98 HB2 ASP 15 2HB ASP 15 21.876 28.651 16.251 99 HB3 ASP 15 3HB ASP 15 23.513 28.290 15.775 100 H CYS 16 H CYS 16 20.196 25.539 14.847 101 HA CYS 16 HA CYS 16 21.980 23.712 16.377 102 HB2 CYS 16 2HB CYS 16 20.286 24.819 17.749 103 HB3 CYS 16 3HB CYS 16 19.016 24.165 16.732 104 HA PRO 17 HA PRO 17 20.622 21.458 12.564 105 HB2 PRO 17 3HB PRO 17 22.552 22.157 11.445 106 HB3 PRO 17 2HB PRO 17 23.061 20.470 11.799 107 HG2 PRO 17 2HG PRO 17 24.253 21.170 13.764 108 HG3 PRO 17 3HG PRO 17 24.616 22.505 12.609 109 HD2 PRO 17 2HD PRO 17 23.504 23.015 15.031 110 HD3 PRO 17 3HD PRO 17 22.998 23.921 13.578 111 H GLN 18 H GLN 18 20.953 19.078 12.050 112 HA GLN 18 HA GLN 18 20.397 17.454 14.296 113 HB2 GLN 18 2HB GLN 18 21.174 16.745 11.435 114 HB3 GLN 18 3HB GLN 18 20.514 15.593 12.609 115 HG2 GLN 18 2HG GLN 18 18.461 16.935 12.811 116 HG3 GLN 18 3HG GLN 18 19.064 18.074 11.604 117 HE21 GLN 18 2HE2 GLN 18 18.634 15.801 8.812 118 HE22 GLN 18 1HE2 GLN 18 19.713 17.050 9.405 119 H GLU 19 H GLU 19 23.467 18.484 13.113 120 HA GLU 19 HA GLU 19 24.997 16.180 14.108 121 HB2 GLU 19 2HB GLU 19 25.783 18.898 12.959 122 HB3 GLU 19 3HB GLU 19 26.936 17.630 13.424 123 HG2 GLU 19 2HG GLU 19 25.941 16.084 11.777 124 HG3 GLU 19 3HG GLU 19 24.767 17.318 11.295 125 H ALA 20 H ALA 20 24.058 19.442 15.203 126 HA ALA 20 HA ALA 20 25.895 19.339 17.510 127 HB1 ALA 20 1HB ALA 20 25.724 21.401 16.206 128 HB2 ALA 20 2HB ALA 20 23.985 21.478 16.547 129 HB3 ALA 20 3HB ALA 20 25.158 21.640 17.871 130 H ARG 21 H ARG 21 22.520 18.621 16.818 131 HA ARG 21 HA ARG 21 21.545 19.109 19.491 132 HB2 ARG 21 2HB ARG 21 19.545 18.020 18.827 133 HB3 ARG 21 3HB ARG 21 20.092 18.987 17.452 134 HG2 ARG 21 2HG ARG 21 21.037 16.955 16.416 135 HG3 ARG 21 3HG ARG 21 20.471 15.974 17.777 136 HD2 ARG 21 2HD ARG 21 18.153 16.507 17.295 137 HD3 ARG 21 3HD ARG 21 18.640 17.611 15.993 138 HE ARG 21 HE ARG 21 19.864 15.251 15.349 139 HH11 ARG 21 1HH1 ARG 21 16.465 16.137 15.882 140 HH12 ARG 21 2HH1 ARG 21 15.867 14.967 14.726 141 HH21 ARG 21 2HH2 ARG 21 17.336 13.587 13.623 142 HH22 ARG 21 1HH2 ARG 21 19.048 13.680 13.954 143 H LEU 22 H LEU 22 20.919 17.512 21.063 144 HA LEU 22 HA LEU 22 22.756 15.201 21.253 145 HB2 LEU 22 2HB LEU 22 20.837 16.621 23.134 146 HB3 LEU 22 3HB LEU 22 21.642 15.124 23.595 147 HG LEU 22 HG LEU 22 23.308 17.480 22.598 148 HD11 LEU 22 1HD1 LEU 22 21.851 18.381 24.296 149 HD12 LEU 22 2HD1 LEU 22 23.516 18.233 24.890 150 HD13 LEU 22 3HD1 LEU 22 22.275 17.055 25.411 151 HD21 LEU 22 3HD2 LEU 22 25.010 16.470 24.043 152 HD22 LEU 22 1HD2 LEU 22 24.400 15.274 22.879 153 HD23 LEU 22 2HD2 LEU 22 23.859 15.222 24.580 154 H SER 23 H SER 23 21.560 13.263 22.392 155 HA SER 23 HA SER 23 19.563 12.181 20.574 156 HB2 SER 23 2HB SER 23 21.304 10.819 21.751 157 HB3 SER 23 3HB SER 23 20.505 11.183 23.293 158 HG SER 23 HG SER 23 19.803 9.205 22.452 159 H TYR 24 H TYR 24 19.500 14.101 23.471 160 HA TYR 24 HA TYR 24 16.589 13.726 23.898 161 HB2 TYR 24 2HB TYR 24 17.242 13.745 26.386 162 HB3 TYR 24 3HB TYR 24 17.521 12.289 25.456 163 HD1 TYR 24 HD1 TYR 24 19.424 11.132 26.060 164 HD2 TYR 24 HD2 TYR 24 19.554 15.459 26.128 165 HE1 TYR 24 HE1 TYR 24 21.776 11.055 26.812 166 HE2 TYR 24 HE2 TYR 24 21.907 15.356 26.906 167 HH TYR 24 HH TYR 24 23.616 12.285 27.447 168 H GLY 25 H GLY 25 15.774 15.362 25.548 169 HA2 GLY 25 2HA GLY 25 16.851 17.640 26.426 170 HA3 GLY 25 3HA GLY 25 16.553 18.073 24.729 171 H GLY 26 H GLY 26 15.337 19.636 26.340 172 HA2 GLY 26 2HA GLY 26 12.467 19.034 26.151 173 HA3 GLY 26 3HA GLY 26 13.127 19.283 27.772 174 H CYS 27 H CYS 27 14.560 21.069 25.110 175 HA CYS 27 HA CYS 27 13.978 23.666 26.185 176 HB2 CYS 27 2HB CYS 27 14.996 22.674 23.518 177 HB3 CYS 27 3HB CYS 27 14.927 24.375 23.947 178 H SER 28 H SER 28 13.150 25.356 24.400 179 HA SER 28 HA SER 28 10.298 24.984 24.365 180 HB2 SER 28 2HB SER 28 11.471 27.140 24.827 181 HB3 SER 28 3HB SER 28 12.023 27.173 23.138 182 HG SER 28 HG SER 28 10.113 28.379 23.471 183 H THR 29 H THR 29 12.911 24.680 21.966 184 HA THR 29 HA THR 29 10.974 23.390 20.214 185 HB THR 29 HB THR 29 10.812 25.574 19.332 186 HG1 THR 29 1HG THR 29 10.899 23.995 17.790 187 HG21 THR 29 1HG2 THR 29 12.843 26.673 20.129 188 HG22 THR 29 2HG2 THR 29 12.668 26.857 18.380 189 HG23 THR 29 3HG2 THR 29 13.837 25.688 19.026 190 H VAL 30 H VAL 30 14.464 24.016 20.905 191 HA VAL 30 HA VAL 30 15.087 21.293 20.143 192 HB VAL 30 HB VAL 30 16.900 21.869 18.574 193 HG11 VAL 30 1HG1 VAL 30 15.677 22.145 16.586 194 HG12 VAL 30 2HG1 VAL 30 14.703 21.170 17.702 195 HG13 VAL 30 3HG1 VAL 30 14.297 22.894 17.418 196 HG21 VAL 30 3HG2 VAL 30 17.400 24.145 19.100 197 HG22 VAL 30 1HG2 VAL 30 16.916 24.046 17.393 198 HG23 VAL 30 2HG2 VAL 30 15.776 24.693 18.591 199 H CYS 31 H CYS 31 17.119 20.646 20.932 200 HA CYS 31 HA CYS 31 18.546 22.529 22.751 201 HB2 CYS 31 2HB CYS 31 17.275 20.801 23.984 202 HB3 CYS 31 3HB CYS 31 18.131 19.540 23.083 203 H CYS 32 H CYS 32 20.686 22.709 22.429 204 HA CYS 32 HA CYS 32 22.143 20.681 20.850 205 HB2 CYS 32 2HB CYS 32 21.897 23.637 20.290 206 HB3 CYS 32 3HB CYS 32 23.454 22.855 20.092 207 H ASP 33 H ASP 33 24.295 20.436 21.394 208 HA ASP 33 HA ASP 33 24.758 20.862 24.210 209 HB2 ASP 33 2HB ASP 33 26.554 19.368 23.999 210 HB3 ASP 33 3HB ASP 33 25.341 18.787 22.877 211 H LEU 34 H LEU 34 26.920 21.642 25.029 212 HA LEU 34 HA LEU 34 27.960 24.012 23.546 213 HB2 LEU 34 2HB LEU 34 27.403 23.744 26.522 214 HB3 LEU 34 3HB LEU 34 28.166 25.130 25.750 215 HG LEU 34 HG LEU 34 25.312 24.201 25.203 216 HD11 LEU 34 1HD1 LEU 34 24.653 26.202 26.500 217 HD12 LEU 34 2HD1 LEU 34 26.361 26.530 26.866 218 HD13 LEU 34 3HD1 LEU 34 25.579 25.064 27.488 219 HD21 LEU 34 3HD2 LEU 34 26.225 25.417 23.262 220 HD22 LEU 34 1HD2 LEU 34 26.809 26.715 24.323 221 HD23 LEU 34 2HD2 LEU 34 25.065 26.433 24.119 222 H SER 35 H SER 35 28.817 21.027 24.128 223 HA SER 35 HA SER 35 31.129 21.051 25.747 224 HB2 SER 35 2HB SER 35 29.745 19.079 25.076 225 HB3 SER 35 3HB SER 35 30.421 19.201 23.440 226 HG SER 35 HG SER 35 31.802 18.708 25.870 227 H LYS 36 H LYS 36 30.697 22.187 22.472 228 HA LYS 36 HA LYS 36 33.379 21.989 21.507 229 HB2 LYS 36 2HB LYS 36 32.699 23.685 19.904 230 HB3 LYS 36 3HB LYS 36 31.530 22.370 20.002 231 HG2 LYS 36 2HG LYS 36 29.970 23.742 21.281 232 HG3 LYS 36 3HG LYS 36 31.151 25.051 21.430 233 HD2 LYS 36 2HD LYS 36 30.074 24.065 18.761 234 HD3 LYS 36 3HD LYS 36 29.342 25.378 19.709 235 HE2 LYS 36 2HE LYS 36 31.434 26.659 19.630 236 HE3 LYS 36 3HE LYS 36 32.221 25.353 18.721 237 HZ1 LYS 36 3HZ LYS 36 29.934 26.947 17.791 238 HZ2 LYS 36 1HZ LYS 36 30.637 25.706 16.964 239 HZ3 LYS 36 2HZ LYS 36 31.502 27.072 17.282 240 H LEU 37 H LEU 37 31.927 24.184 23.836 241 HA LEU 37 HA LEU 37 34.001 26.234 23.652 242 HB2 LEU 37 2HB LEU 37 31.927 25.655 25.805 243 HB3 LEU 37 3HB LEU 37 32.922 27.103 25.690 244 HG LEU 37 HG LEU 37 30.806 26.266 23.640 245 HD11 LEU 37 1HD1 LEU 37 29.514 28.147 24.534 246 HD12 LEU 37 2HD1 LEU 37 30.764 28.451 25.763 247 HD13 LEU 37 3HD1 LEU 37 29.828 26.935 25.781 248 HD21 LEU 37 3HD2 LEU 37 32.550 27.585 22.546 249 HD22 LEU 37 1HD2 LEU 37 32.502 28.797 23.855 250 HD23 LEU 37 2HD2 LEU 37 31.111 28.588 22.772 251 H THR 38 H THR 38 33.248 23.469 25.822 252 HA THR 38 HA THR 38 35.612 23.867 27.461 253 HB THR 38 HB THR 38 34.740 21.768 28.555 254 HG1 THR 38 1HG THR 38 33.553 21.011 26.763 255 HG21 THR 38 1HG2 THR 38 32.779 24.088 28.357 256 HG22 THR 38 2HG2 THR 38 34.205 24.011 29.424 257 HG23 THR 38 3HG2 THR 38 32.857 22.881 29.664 258 H GLY 39 H GLY 39 36.946 23.790 25.485 259 HA2 GLY 39 2HA GLY 39 38.330 21.230 25.362 260 HA3 GLY 39 3HA GLY 39 37.610 21.738 23.826 Start of MODEL 14 1 H1 ASN 1 H1 ASN 1 14.039 22.762 34.507 2 H2 ASN 1 H2 ASN 1 12.591 22.898 33.729 3 H3 ASN 1 H3 ASN 1 13.118 21.421 34.239 4 HA ASN 1 HA ASN 1 13.387 21.608 31.897 5 HB2 ASN 1 2HB ASN 1 13.667 24.155 32.075 6 HB3 ASN 1 3HB ASN 1 15.369 23.828 32.420 7 HD21 ASN 1 2HD2 ASN 1 14.376 24.233 28.662 8 HD22 ASN 1 1HD2 ASN 1 13.566 24.909 30.058 9 H GLU 2 H GLU 2 14.350 19.702 31.786 10 HA GLU 2 HA GLU 2 16.494 18.868 33.437 11 HB2 GLU 2 2HB GLU 2 14.695 17.516 32.236 12 HB3 GLU 2 3HB GLU 2 15.623 17.690 30.764 13 HG2 GLU 2 2HG GLU 2 16.049 15.515 31.870 14 HG3 GLU 2 3HG GLU 2 17.511 16.479 31.708 15 H CYS 3 H CYS 3 16.441 20.381 30.284 16 HA CYS 3 HA CYS 3 19.100 19.460 29.479 17 HB2 CYS 3 2HB CYS 3 17.315 20.070 27.854 18 HB3 CYS 3 3HB CYS 3 17.500 21.760 28.337 19 H VAL 4 H VAL 4 17.781 22.503 30.828 20 HA VAL 4 HA VAL 4 20.284 23.881 31.102 21 HB VAL 4 HB VAL 4 17.615 24.214 32.538 22 HG11 VAL 4 1HG1 VAL 4 20.015 26.083 32.419 23 HG12 VAL 4 2HG1 VAL 4 18.404 26.521 33.039 24 HG13 VAL 4 3HG1 VAL 4 19.359 25.289 33.866 25 HG21 VAL 4 3HG2 VAL 4 17.270 26.095 30.972 26 HG22 VAL 4 1HG2 VAL 4 18.799 25.702 30.150 27 HG23 VAL 4 2HG2 VAL 4 17.431 24.568 30.105 28 H SER 5 H SER 5 18.405 21.708 33.268 29 HA SER 5 HA SER 5 19.986 22.139 35.601 30 HB2 SER 5 2HB SER 5 17.660 21.257 35.565 31 HB3 SER 5 3HB SER 5 18.249 19.749 34.845 32 HG SER 5 HG SER 5 19.414 19.359 36.692 33 H LYS 6 H LYS 6 20.304 19.872 32.889 34 HA LYS 6 HA LYS 6 22.546 18.367 33.975 35 HB2 LYS 6 2HB LYS 6 21.258 18.689 31.247 36 HB3 LYS 6 3HB LYS 6 22.686 17.687 31.491 37 HG2 LYS 6 2HG LYS 6 20.214 17.214 33.179 38 HG3 LYS 6 3HG LYS 6 20.306 16.600 31.528 39 HD2 LYS 6 2HD LYS 6 22.350 15.361 32.045 40 HD3 LYS 6 3HD LYS 6 22.327 15.971 33.716 41 HE2 LYS 6 2HE LYS 6 20.206 14.861 34.148 42 HE3 LYS 6 3HE LYS 6 20.046 14.399 32.446 43 HZ1 LYS 6 3HZ LYS 6 22.182 13.462 34.238 44 HZ2 LYS 6 1HZ LYS 6 21.950 13.003 32.675 45 HZ3 LYS 6 2HZ LYS 6 20.842 12.593 33.831 46 H GLY 7 H GLY 7 22.265 21.571 32.755 47 HA2 GLY 7 2HA GLY 7 23.987 23.115 32.794 48 HA3 GLY 7 3HA GLY 7 25.190 21.839 32.649 49 H PHE 8 H PHE 8 22.934 21.175 30.250 50 HA PHE 8 HA PHE 8 24.613 22.270 28.134 51 HB2 PHE 8 2HB PHE 8 21.989 20.762 28.002 52 HB3 PHE 8 3HB PHE 8 23.057 21.095 26.646 53 HD1 PHE 8 HD1 PHE 8 22.222 18.757 29.177 54 HD2 PHE 8 HD2 PHE 8 25.509 20.184 26.824 55 HE1 PHE 8 HE1 PHE 8 23.379 16.567 29.489 56 HE2 PHE 8 HE2 PHE 8 26.677 17.993 27.128 57 HZ PHE 8 HZ PHE 8 25.601 16.191 28.448 58 H GLY 9 H GLY 9 23.423 23.293 26.202 59 HA2 GLY 9 2HA GLY 9 22.132 25.758 27.211 60 HA3 GLY 9 3HA GLY 9 22.888 25.500 25.637 61 H CYS 10 H CYS 10 20.408 26.751 26.078 62 HA CYS 10 HA CYS 10 18.600 25.023 24.464 63 HB2 CYS 10 2HB CYS 10 17.857 26.982 26.668 64 HB3 CYS 10 3HB CYS 10 16.717 26.292 25.516 65 H LEU 11 H LEU 11 20.175 26.053 22.919 66 HA LEU 11 HA LEU 11 19.886 28.799 22.140 67 HB2 LEU 11 2HB LEU 11 20.911 26.232 20.897 68 HB3 LEU 11 3HB LEU 11 20.762 27.649 19.882 69 HG LEU 11 HG LEU 11 22.317 27.497 22.444 70 HD11 LEU 11 1HD1 LEU 11 23.254 26.010 20.713 71 HD12 LEU 11 2HD1 LEU 11 24.362 27.295 21.247 72 HD13 LEU 11 3HD1 LEU 11 23.546 27.424 19.691 73 HD21 LEU 11 3HD2 LEU 11 21.774 29.816 22.044 74 HD22 LEU 11 1HD2 LEU 11 22.420 29.722 20.394 75 HD23 LEU 11 2HD2 LEU 11 23.497 29.542 21.788 76 HA PRO 12 HA PRO 12 16.217 28.506 19.525 77 HB2 PRO 12 3HB PRO 12 16.475 30.804 19.225 78 HB3 PRO 12 2HB PRO 12 16.753 30.284 17.540 79 HG2 PRO 12 2HG PRO 12 19.130 30.365 17.821 80 HG3 PRO 12 3HG PRO 12 18.624 31.776 18.800 81 HD2 PRO 12 2HD PRO 12 20.112 29.733 19.843 82 HD3 PRO 12 3HD PRO 12 18.915 30.605 20.828 83 H GLN 13 H GLN 13 15.634 27.972 17.193 84 HA GLN 13 HA GLN 13 16.971 25.661 16.237 85 HB2 GLN 13 2HB GLN 13 14.918 27.557 15.045 86 HB3 GLN 13 3HB GLN 13 15.475 26.139 14.171 87 HG2 GLN 13 2HG GLN 13 14.305 25.897 16.976 88 HG3 GLN 13 3HG GLN 13 13.297 25.962 15.536 89 HE21 GLN 13 2HE2 GLN 13 13.470 22.412 15.748 90 HE22 GLN 13 1HE2 GLN 13 12.506 23.830 16.119 91 H SER 14 H SER 14 17.487 29.072 15.497 92 HA SER 14 HA SER 14 19.015 28.676 13.079 93 HB2 SER 14 2HB SER 14 18.800 31.044 14.976 94 HB3 SER 14 3HB SER 14 19.613 31.059 13.395 95 HG SER 14 HG SER 14 17.586 31.758 13.021 96 H ASP 15 H ASP 15 19.851 28.090 16.354 97 HA ASP 15 HA ASP 15 22.753 28.233 15.710 98 HB2 ASP 15 2HB ASP 15 21.367 29.800 17.609 99 HB3 ASP 15 3HB ASP 15 22.146 28.552 18.559 100 H CYS 16 H CYS 16 20.233 26.136 16.452 101 HA CYS 16 HA CYS 16 22.076 24.113 17.616 102 HB2 CYS 16 2HB CYS 16 20.520 24.938 19.256 103 HB3 CYS 16 3HB CYS 16 19.160 24.594 18.201 104 HA PRO 17 HA PRO 17 20.551 22.414 13.584 105 HB2 PRO 17 3HB PRO 17 22.525 23.204 12.582 106 HB3 PRO 17 2HB PRO 17 22.910 21.454 12.634 107 HG2 PRO 17 2HG PRO 17 24.118 21.723 14.716 108 HG3 PRO 17 3HG PRO 17 24.624 23.164 13.783 109 HD2 PRO 17 2HD PRO 17 23.514 23.407 16.235 110 HD3 PRO 17 3HD PRO 17 23.102 24.565 14.939 111 H GLN 18 H GLN 18 20.759 20.115 12.758 112 HA GLN 18 HA GLN 18 20.339 18.144 14.740 113 HB2 GLN 18 2HB GLN 18 21.106 17.711 11.818 114 HB3 GLN 18 3HB GLN 18 20.315 16.578 12.897 115 HG2 GLN 18 2HG GLN 18 18.461 17.314 11.807 116 HG3 GLN 18 3HG GLN 18 18.488 18.511 13.103 117 HE21 GLN 18 2HE2 GLN 18 19.285 19.583 9.181 118 HE22 GLN 18 1HE2 GLN 18 19.247 17.899 9.666 119 H GLU 19 H GLU 19 23.328 19.429 13.549 120 HA GLU 19 HA GLU 19 24.970 17.083 14.005 121 HB2 GLU 19 2HB GLU 19 25.752 20.028 13.819 122 HB3 GLU 19 3HB GLU 19 26.835 18.649 13.665 123 HG2 GLU 19 2HG GLU 19 24.668 19.507 11.718 124 HG3 GLU 19 3HG GLU 19 26.409 19.570 11.486 125 H ALA 20 H ALA 20 23.846 19.780 15.980 126 HA ALA 20 HA ALA 20 25.837 19.166 18.096 127 HB1 ALA 20 1HB ALA 20 25.888 21.420 17.137 128 HB2 ALA 20 2HB ALA 20 24.174 21.646 17.540 129 HB3 ALA 20 3HB ALA 20 25.375 21.470 18.839 130 H ARG 21 H ARG 21 22.539 18.584 17.440 131 HA ARG 21 HA ARG 21 21.453 19.039 20.062 132 HB2 ARG 21 2HB ARG 21 19.504 17.867 19.265 133 HB3 ARG 21 3HB ARG 21 20.080 18.984 18.022 134 HG2 ARG 21 2HG ARG 21 21.032 17.179 16.743 135 HG3 ARG 21 3HG ARG 21 20.648 15.991 17.997 136 HD2 ARG 21 2HD ARG 21 18.296 16.195 17.645 137 HD3 ARG 21 3HD ARG 21 18.487 17.702 16.730 138 HE ARG 21 HE ARG 21 18.796 16.547 14.846 139 HH11 ARG 21 1HH1 ARG 21 19.503 14.216 17.444 140 HH12 ARG 21 2HH1 ARG 21 19.780 12.908 16.309 141 HH21 ARG 21 2HH2 ARG 21 19.541 13.218 14.108 142 HH22 ARG 21 1HH2 ARG 21 19.067 14.760 13.444 143 H LEU 22 H LEU 22 20.600 17.405 21.506 144 HA LEU 22 HA LEU 22 22.433 15.095 21.869 145 HB2 LEU 22 2HB LEU 22 20.590 16.668 23.700 146 HB3 LEU 22 3HB LEU 22 21.347 15.165 24.215 147 HG LEU 22 HG LEU 22 23.021 17.461 23.128 148 HD11 LEU 22 1HD1 LEU 22 22.301 16.976 26.037 149 HD12 LEU 22 2HD1 LEU 22 21.715 18.320 25.026 150 HD13 LEU 22 3HD1 LEU 22 23.433 18.189 25.399 151 HD21 LEU 22 3HD2 LEU 22 23.660 15.087 24.943 152 HD22 LEU 22 1HD2 LEU 22 24.803 16.359 24.482 153 HD23 LEU 22 2HD2 LEU 22 24.159 15.274 23.248 154 H SER 23 H SER 23 21.255 13.251 23.116 155 HA SER 23 HA SER 23 19.398 12.021 21.298 156 HB2 SER 23 2HB SER 23 21.216 10.897 22.638 157 HB3 SER 23 3HB SER 23 20.203 11.102 24.082 158 HG SER 23 HG SER 23 19.960 9.056 22.986 159 H TYR 24 H TYR 24 18.793 14.335 23.666 160 HA TYR 24 HA TYR 24 15.935 13.630 23.858 161 HB2 TYR 24 2HB TYR 24 15.843 13.882 26.190 162 HB3 TYR 24 3HB TYR 24 17.191 12.806 25.911 163 HD1 TYR 24 HD1 TYR 24 19.604 13.930 25.833 164 HD2 TYR 24 HD2 TYR 24 16.105 15.798 27.544 165 HE1 TYR 24 HE1 TYR 24 21.051 15.390 27.190 166 HE2 TYR 24 HE2 TYR 24 17.558 17.291 28.885 167 HH TYR 24 HH TYR 24 21.139 17.075 28.723 168 H GLY 25 H GLY 25 14.795 15.581 25.028 169 HA2 GLY 25 2HA GLY 25 15.826 18.195 24.041 170 HA3 GLY 25 3HA GLY 25 14.278 17.560 23.477 171 H GLY 26 H GLY 26 16.065 18.273 26.518 172 HA2 GLY 26 2HA GLY 26 13.690 18.479 28.143 173 HA3 GLY 26 3HA GLY 26 15.326 18.954 28.588 174 H CYS 27 H CYS 27 15.287 20.768 26.011 175 HA CYS 27 HA CYS 27 14.482 23.204 27.295 176 HB2 CYS 27 2HB CYS 27 15.247 22.605 24.434 177 HB3 CYS 27 3HB CYS 27 15.102 24.221 25.118 178 H SER 28 H SER 28 13.264 24.801 25.644 179 HA SER 28 HA SER 28 10.483 23.837 25.615 180 HB2 SER 28 2HB SER 28 11.658 26.610 25.195 181 HB3 SER 28 3HB SER 28 9.933 26.213 25.304 182 HG SER 28 HG SER 28 10.580 25.226 27.415 183 H THR 29 H THR 29 13.050 24.037 23.376 184 HA THR 29 HA THR 29 11.204 23.249 21.312 185 HB THR 29 HB THR 29 11.076 25.540 20.813 186 HG1 THR 29 1HG THR 29 11.341 24.131 19.072 187 HG21 THR 29 1HG2 THR 29 14.104 25.748 20.697 188 HG22 THR 29 2HG2 THR 29 13.049 26.483 21.923 189 HG23 THR 29 3HG2 THR 29 12.948 27.003 20.238 190 H VAL 30 H VAL 30 14.694 23.990 21.966 191 HA VAL 30 HA VAL 30 15.386 21.293 21.036 192 HB VAL 30 HB VAL 30 17.191 22.119 19.531 193 HG11 VAL 30 1HG1 VAL 30 14.429 22.807 18.490 194 HG12 VAL 30 2HG1 VAL 30 15.853 22.289 17.565 195 HG13 VAL 30 3HG1 VAL 30 15.074 21.155 18.666 196 HG21 VAL 30 3HG2 VAL 30 17.354 24.473 20.139 197 HG22 VAL 30 1HG2 VAL 30 16.983 24.298 18.417 198 HG23 VAL 30 2HG2 VAL 30 15.707 24.774 19.534 199 H CYS 31 H CYS 31 17.315 20.512 21.749 200 HA CYS 31 HA CYS 31 18.697 22.021 23.924 201 HB2 CYS 31 2HB CYS 31 17.092 20.371 24.781 202 HB3 CYS 31 3HB CYS 31 17.786 19.139 23.737 203 H CYS 32 H CYS 32 20.709 22.438 23.336 204 HA CYS 32 HA CYS 32 22.247 20.472 21.705 205 HB2 CYS 32 2HB CYS 32 21.922 23.462 21.425 206 HB3 CYS 32 3HB CYS 32 23.496 22.745 21.115 207 H ASP 33 H ASP 33 24.288 20.054 22.204 208 HA ASP 33 HA ASP 33 25.371 20.970 24.800 209 HB2 ASP 33 2HB ASP 33 25.407 18.610 24.566 210 HB3 ASP 33 3HB ASP 33 25.982 18.676 22.915 211 H LEU 34 H LEU 34 27.128 22.148 24.976 212 HA LEU 34 HA LEU 34 28.335 23.419 22.572 213 HB2 LEU 34 2HB LEU 34 27.702 24.724 25.233 214 HB3 LEU 34 3HB LEU 34 28.223 25.516 23.752 215 HG LEU 34 HG LEU 34 25.529 24.134 24.179 216 HD11 LEU 34 1HD1 LEU 34 25.710 26.189 25.471 217 HD12 LEU 34 2HD1 LEU 34 24.606 26.418 24.106 218 HD13 LEU 34 3HD1 LEU 34 26.251 27.084 24.031 219 HD21 LEU 34 3HD2 LEU 34 26.295 24.083 21.775 220 HD22 LEU 34 1HD2 LEU 34 26.434 25.849 21.822 221 HD23 LEU 34 2HD2 LEU 34 24.857 25.050 22.052 222 H SER 35 H SER 35 29.254 21.188 24.590 223 HA SER 35 HA SER 35 31.296 22.094 26.253 224 HB2 SER 35 2HB SER 35 30.168 19.884 26.324 225 HB3 SER 35 3HB SER 35 31.016 19.410 24.844 226 HG SER 35 HG SER 35 32.980 19.888 26.086 227 H LYS 36 H LYS 36 31.470 21.837 22.756 228 HA LYS 36 HA LYS 36 34.324 21.540 22.475 229 HB2 LYS 36 2HB LYS 36 32.214 22.851 20.708 230 HB3 LYS 36 3HB LYS 36 33.920 22.710 20.258 231 HG2 LYS 36 2HG LYS 36 33.760 20.225 20.582 232 HG3 LYS 36 3HG LYS 36 32.021 20.405 20.799 233 HD2 LYS 36 2HD LYS 36 33.635 21.193 18.330 234 HD3 LYS 36 3HD LYS 36 32.635 19.753 18.472 235 HE2 LYS 36 2HE LYS 36 31.593 22.615 18.613 236 HE3 LYS 36 3HE LYS 36 31.577 21.598 17.167 237 HZ1 LYS 36 3HZ LYS 36 29.474 21.540 18.289 238 HZ2 LYS 36 1HZ LYS 36 30.167 21.002 19.678 239 HZ3 LYS 36 2HZ LYS 36 30.172 20.048 18.334 240 H LEU 37 H LEU 37 32.330 24.179 23.478 241 HA LEU 37 HA LEU 37 34.561 26.137 23.347 242 HB2 LEU 37 2HB LEU 37 31.542 26.505 23.277 243 HB3 LEU 37 3HB LEU 37 32.706 27.819 23.367 244 HG LEU 37 HG LEU 37 32.539 25.817 21.060 245 HD11 LEU 37 1HD1 LEU 37 30.502 27.193 21.206 246 HD12 LEU 37 2HD1 LEU 37 31.474 27.634 19.794 247 HD13 LEU 37 3HD1 LEU 37 31.490 28.672 21.238 248 HD21 LEU 37 3HD2 LEU 37 34.068 28.448 21.339 249 HD22 LEU 37 1HD2 LEU 37 33.924 27.494 19.847 250 HD23 LEU 37 2HD2 LEU 37 34.781 26.822 21.237 251 H THR 38 H THR 38 31.482 25.825 25.226 252 HA THR 38 HA THR 38 32.828 26.635 27.685 253 HB THR 38 HB THR 38 30.487 26.641 28.537 254 HG1 THR 38 1HG THR 38 28.851 26.608 26.880 255 HG21 THR 38 1HG2 THR 38 29.808 28.661 27.361 256 HG22 THR 38 2HG2 THR 38 30.873 28.278 25.994 257 HG23 THR 38 3HG2 THR 38 31.565 28.679 27.580 258 H GLY 39 H GLY 39 34.144 24.630 27.417 259 HA2 GLY 39 2HA GLY 39 33.306 22.719 29.429 260 HA3 GLY 39 3HA GLY 39 33.395 21.998 27.811 Start of MODEL 15 1 H1 ASN 1 H1 ASN 1 15.202 23.182 33.684 2 H2 ASN 1 H2 ASN 1 13.650 23.232 33.097 3 H3 ASN 1 H3 ASN 1 14.280 21.843 33.801 4 HA ASN 1 HA ASN 1 14.272 21.651 31.353 5 HB2 ASN 1 2HB ASN 1 16.299 23.895 31.431 6 HB3 ASN 1 3HB ASN 1 15.568 23.135 30.001 7 HD21 ASN 1 2HD2 ASN 1 14.061 26.515 30.720 8 HD22 ASN 1 1HD2 ASN 1 15.703 25.981 30.739 9 H GLU 2 H GLU 2 15.378 19.782 31.122 10 HA GLU 2 HA GLU 2 17.507 19.039 32.788 11 HB2 GLU 2 2HB GLU 2 15.991 17.451 31.588 12 HB3 GLU 2 3HB GLU 2 16.762 17.910 30.070 13 HG2 GLU 2 2HG GLU 2 18.919 17.035 30.839 14 HG3 GLU 2 3HG GLU 2 18.266 16.752 32.449 15 H CYS 3 H CYS 3 17.516 20.257 29.439 16 HA CYS 3 HA CYS 3 20.232 19.901 28.840 17 HB2 CYS 3 2HB CYS 3 18.253 20.557 27.318 18 HB3 CYS 3 3HB CYS 3 18.547 22.223 27.828 19 H VAL 4 H VAL 4 18.625 22.788 30.258 20 HA VAL 4 HA VAL 4 21.032 24.343 30.513 21 HB VAL 4 HB VAL 4 18.388 24.660 31.995 22 HG11 VAL 4 1HG1 VAL 4 19.060 27.078 32.040 23 HG12 VAL 4 2HG1 VAL 4 20.175 26.047 32.945 24 HG13 VAL 4 3HG1 VAL 4 20.623 26.627 31.329 25 HG21 VAL 4 3HG2 VAL 4 19.198 25.821 29.287 26 HG22 VAL 4 1HG2 VAL 4 17.917 24.625 29.559 27 HG23 VAL 4 2HG2 VAL 4 17.737 26.253 30.201 28 H SER 5 H SER 5 19.230 22.188 32.751 29 HA SER 5 HA SER 5 20.679 22.838 35.115 30 HB2 SER 5 2HB SER 5 18.434 21.814 35.057 31 HB3 SER 5 3HB SER 5 19.132 20.313 34.393 32 HG SER 5 HG SER 5 18.812 20.394 36.726 33 H LYS 6 H LYS 6 21.272 20.440 32.549 34 HA LYS 6 HA LYS 6 23.529 19.138 33.806 35 HB2 LYS 6 2HB LYS 6 22.519 19.375 30.951 36 HB3 LYS 6 3HB LYS 6 23.954 18.442 31.362 37 HG2 LYS 6 2HG LYS 6 21.213 17.899 32.544 38 HG3 LYS 6 3HG LYS 6 21.828 17.141 31.071 39 HD2 LYS 6 2HD LYS 6 23.792 16.274 32.438 40 HD3 LYS 6 3HD LYS 6 22.962 16.877 33.889 41 HE2 LYS 6 2HE LYS 6 21.878 14.842 31.896 42 HE3 LYS 6 3HE LYS 6 22.586 14.472 33.482 43 HZ1 LYS 6 3HZ LYS 6 20.798 15.765 34.470 44 HZ2 LYS 6 1HZ LYS 6 20.225 14.488 33.591 45 HZ3 LYS 6 2HZ LYS 6 20.136 16.014 32.985 46 H GLY 7 H GLY 7 23.147 22.299 32.459 47 HA2 GLY 7 2HA GLY 7 24.756 23.951 32.625 48 HA3 GLY 7 3HA GLY 7 26.059 22.767 32.559 49 H PHE 8 H PHE 8 23.891 21.978 30.075 50 HA PHE 8 HA PHE 8 25.634 23.087 28.009 51 HB2 PHE 8 2HB PHE 8 23.080 21.438 27.822 52 HB3 PHE 8 3HB PHE 8 24.146 21.821 26.486 53 HD1 PHE 8 HD1 PHE 8 26.722 21.201 26.883 54 HD2 PHE 8 HD2 PHE 8 23.372 19.332 28.827 55 HE1 PHE 8 HE1 PHE 8 28.095 19.171 27.286 56 HE2 PHE 8 HE2 PHE 8 24.774 17.322 29.288 57 HZ PHE 8 HZ PHE 8 27.121 17.233 28.497 58 H GLY 9 H GLY 9 24.467 23.974 26.009 59 HA2 GLY 9 2HA GLY 9 23.069 26.439 26.795 60 HA3 GLY 9 3HA GLY 9 23.841 26.053 25.246 61 H CYS 10 H CYS 10 21.565 27.257 25.011 62 HA CYS 10 HA CYS 10 19.743 25.210 23.900 63 HB2 CYS 10 2HB CYS 10 19.083 26.018 26.309 64 HB3 CYS 10 3HB CYS 10 18.651 27.526 25.526 65 H LEU 11 H LEU 11 21.475 26.295 22.340 66 HA LEU 11 HA LEU 11 21.216 28.902 21.381 67 HB2 LEU 11 2HB LEU 11 22.157 26.269 20.195 68 HB3 LEU 11 3HB LEU 11 22.142 27.698 19.186 69 HG LEU 11 HG LEU 11 23.549 27.514 21.829 70 HD11 LEU 11 1HD1 LEU 11 25.660 27.124 20.732 71 HD12 LEU 11 2HD1 LEU 11 24.889 27.197 19.141 72 HD13 LEU 11 3HD1 LEU 11 24.514 25.865 20.254 73 HD21 LEU 11 3HD2 LEU 11 23.928 29.612 19.680 74 HD22 LEU 11 1HD2 LEU 11 24.905 29.452 21.147 75 HD23 LEU 11 2HD2 LEU 11 23.191 29.854 21.273 76 HA PRO 12 HA PRO 12 17.603 28.870 18.792 77 HB2 PRO 12 3HB PRO 12 18.036 31.148 18.392 78 HB3 PRO 12 2HB PRO 12 18.355 30.571 16.711 79 HG2 PRO 12 2HG PRO 12 20.628 30.484 17.066 80 HG3 PRO 12 3HG PRO 12 20.139 31.954 17.991 81 HD2 PRO 12 2HD PRO 12 21.546 29.806 19.099 82 HD3 PRO 12 3HD PRO 12 20.391 30.750 20.075 83 H GLN 13 H GLN 13 16.905 28.323 16.494 84 HA GLN 13 HA GLN 13 17.955 25.777 15.780 85 HB2 GLN 13 2HB GLN 13 16.126 27.668 14.261 86 HB3 GLN 13 3HB GLN 13 16.409 25.968 13.867 87 HG2 GLN 13 2HG GLN 13 15.471 25.258 16.042 88 HG3 GLN 13 3HG GLN 13 15.219 26.938 16.515 89 HE21 GLN 13 2HE2 GLN 13 12.424 25.123 14.221 90 HE22 GLN 13 1HE2 GLN 13 13.800 24.240 14.871 91 H SER 14 H SER 14 18.903 28.988 14.753 92 HA SER 14 HA SER 14 20.308 28.171 12.324 93 HB2 SER 14 2HB SER 14 20.899 30.540 12.228 94 HB3 SER 14 3HB SER 14 19.155 30.265 12.419 95 HG SER 14 HG SER 14 21.025 31.271 14.261 96 H ASP 15 H ASP 15 21.130 28.182 15.703 97 HA ASP 15 HA ASP 15 24.033 28.032 15.032 98 HB2 ASP 15 2HB ASP 15 22.731 29.693 16.974 99 HB3 ASP 15 3HB ASP 15 23.643 28.485 17.857 100 H CYS 16 H CYS 16 21.396 26.156 15.856 101 HA CYS 16 HA CYS 16 23.077 24.089 17.193 102 HB2 CYS 16 2HB CYS 16 21.330 25.020 18.599 103 HB3 CYS 16 3HB CYS 16 20.107 24.649 17.393 104 HA PRO 17 HA PRO 17 22.014 22.435 12.978 105 HB2 PRO 17 3HB PRO 17 24.075 23.102 12.158 106 HB3 PRO 17 2HB PRO 17 24.461 21.364 12.382 107 HG2 PRO 17 2HG PRO 17 25.465 21.772 14.494 108 HG3 PRO 17 3HG PRO 17 26.006 23.198 13.540 109 HD2 PRO 17 2HD PRO 17 24.679 23.480 15.904 110 HD3 PRO 17 3HD PRO 17 24.359 24.590 14.541 111 H GLN 18 H GLN 18 22.206 20.153 12.213 112 HA GLN 18 HA GLN 18 21.250 18.271 14.038 113 HB2 GLN 18 2HB GLN 18 22.610 17.695 11.371 114 HB3 GLN 18 3HB GLN 18 21.460 16.693 12.245 115 HG2 GLN 18 2HG GLN 18 20.102 17.602 10.651 116 HG3 GLN 18 3HG GLN 18 19.811 18.701 12.002 117 HE21 GLN 18 2HE2 GLN 18 20.109 20.932 9.121 118 HE22 GLN 18 1HE2 GLN 18 18.959 19.826 9.846 119 H GLU 19 H GLU 19 24.581 19.008 13.138 120 HA GLU 19 HA GLU 19 25.790 16.603 14.172 121 HB2 GLU 19 2HB GLU 19 26.932 19.382 13.614 122 HB3 GLU 19 3HB GLU 19 27.894 17.942 13.981 123 HG2 GLU 19 2HG GLU 19 27.023 16.829 11.950 124 HG3 GLU 19 3HG GLU 19 26.085 18.276 11.554 125 H ALA 20 H ALA 20 25.123 19.852 15.565 126 HA ALA 20 HA ALA 20 26.738 19.357 17.913 127 HB1 ALA 20 1HB ALA 20 24.844 21.609 17.168 128 HB2 ALA 20 2HB ALA 20 25.977 21.627 18.540 129 HB3 ALA 20 3HB ALA 20 26.594 21.590 16.881 130 H ARG 21 H ARG 21 23.606 18.286 17.164 131 HA ARG 21 HA ARG 21 22.148 18.768 19.584 132 HB2 ARG 21 2HB ARG 21 22.035 16.385 17.671 133 HB3 ARG 21 3HB ARG 21 20.800 16.867 18.829 134 HG2 ARG 21 2HG ARG 21 20.624 19.092 17.602 135 HG3 ARG 21 3HG ARG 21 21.643 18.393 16.338 136 HD2 ARG 21 2HD ARG 21 20.020 16.630 15.908 137 HD3 ARG 21 3HD ARG 21 19.030 17.182 17.285 138 HE ARG 21 HE ARG 21 19.389 19.383 15.640 139 HH11 ARG 21 1HH1 ARG 21 17.719 16.259 15.388 140 HH12 ARG 21 2HH1 ARG 21 16.509 16.883 14.290 141 HH21 ARG 21 2HH2 ARG 21 16.575 19.067 13.617 142 HH22 ARG 21 1HH2 ARG 21 17.824 20.137 14.230 143 H LEU 22 H LEU 22 22.021 17.727 21.512 144 HA LEU 22 HA LEU 22 24.159 15.897 22.284 145 HB2 LEU 22 2HB LEU 22 21.843 17.342 23.584 146 HB3 LEU 22 3HB LEU 22 22.495 15.930 24.428 147 HG LEU 22 HG LEU 22 24.438 18.013 23.363 148 HD11 LEU 22 1HD1 LEU 22 22.796 19.353 24.651 149 HD12 LEU 22 2HD1 LEU 22 24.316 19.198 25.542 150 HD13 LEU 22 3HD1 LEU 22 22.911 18.186 25.999 151 HD21 LEU 22 3HD2 LEU 22 25.804 17.250 25.272 152 HD22 LEU 22 1HD2 LEU 22 25.350 15.868 24.250 153 HD23 LEU 22 2HD2 LEU 22 24.495 16.151 25.797 154 H SER 23 H SER 23 23.446 13.951 23.617 155 HA SER 23 HA SER 23 22.059 12.007 21.985 156 HB2 SER 23 2HB SER 23 23.955 11.523 23.454 157 HB3 SER 23 3HB SER 23 22.942 11.859 24.882 158 HG SER 23 HG SER 23 22.450 9.865 22.904 159 H TYR 24 H TYR 24 20.900 14.392 24.185 160 HA TYR 24 HA TYR 24 18.187 13.262 24.222 161 HB2 TYR 24 2HB TYR 24 18.136 14.167 26.663 162 HB3 TYR 24 3HB TYR 24 18.804 12.579 26.309 163 HD1 TYR 24 HD1 TYR 24 20.123 16.148 26.507 164 HD2 TYR 24 HD2 TYR 24 20.697 11.964 27.456 165 HE1 TYR 24 HE1 TYR 24 22.188 16.702 27.718 166 HE2 TYR 24 HE2 TYR 24 22.777 12.514 28.638 167 HH TYR 24 HH TYR 24 24.209 14.204 29.318 168 H GLY 25 H GLY 25 16.628 14.914 24.934 169 HA2 GLY 25 2HA GLY 25 17.240 17.609 23.771 170 HA3 GLY 25 3HA GLY 25 15.781 16.684 23.416 171 H GLY 26 H GLY 26 17.541 18.488 25.877 172 HA2 GLY 26 2HA GLY 26 15.359 18.280 27.858 173 HA3 GLY 26 3HA GLY 26 16.992 18.871 28.106 174 H CYS 27 H CYS 27 15.898 20.400 25.344 175 HA CYS 27 HA CYS 27 14.803 22.764 26.801 176 HB2 CYS 27 2HB CYS 27 16.107 22.407 24.086 177 HB3 CYS 27 3HB CYS 27 15.172 23.842 24.460 178 H SER 28 H SER 28 13.197 23.974 25.258 179 HA SER 28 HA SER 28 10.897 22.142 24.883 180 HB2 SER 28 2HB SER 28 11.105 25.178 24.956 181 HB3 SER 28 3HB SER 28 9.596 24.242 24.773 182 HG SER 28 HG SER 28 9.991 24.841 26.920 183 H THR 29 H THR 29 13.347 23.385 22.958 184 HA THR 29 HA THR 29 11.848 22.750 20.523 185 HB THR 29 HB THR 29 11.626 25.106 20.472 186 HG1 THR 29 1HG THR 29 12.327 24.155 18.580 187 HG21 THR 29 1HG2 THR 29 14.587 25.429 21.067 188 HG22 THR 29 2HG2 THR 29 13.240 25.876 22.131 189 HG23 THR 29 3HG2 THR 29 13.479 26.719 20.597 190 H VAL 30 H VAL 30 15.142 23.677 21.667 191 HA VAL 30 HA VAL 30 16.303 21.264 20.396 192 HB VAL 30 HB VAL 30 17.954 22.638 19.149 193 HG11 VAL 30 1HG1 VAL 30 16.121 21.463 18.018 194 HG12 VAL 30 2HG1 VAL 30 15.132 22.946 18.082 195 HG13 VAL 30 3HG1 VAL 30 16.654 22.932 17.181 196 HG21 VAL 30 3HG2 VAL 30 15.978 24.942 19.314 197 HG22 VAL 30 1HG2 VAL 30 17.515 24.862 20.208 198 HG23 VAL 30 2HG2 VAL 30 17.520 24.862 18.441 199 H CYS 31 H CYS 31 18.006 20.528 21.387 200 HA CYS 31 HA CYS 31 19.403 22.165 23.446 201 HB2 CYS 31 2HB CYS 31 17.921 20.331 24.388 202 HB3 CYS 31 3HB CYS 31 18.770 19.159 23.390 203 H CYS 32 H CYS 32 21.382 22.647 22.805 204 HA CYS 32 HA CYS 32 23.060 20.634 21.428 205 HB2 CYS 32 2HB CYS 32 22.639 23.575 20.794 206 HB3 CYS 32 3HB CYS 32 24.199 22.814 20.547 207 H ASP 33 H ASP 33 25.202 20.588 22.100 208 HA ASP 33 HA ASP 33 25.660 21.492 24.840 209 HB2 ASP 33 2HB ASP 33 27.540 20.116 24.834 210 HB3 ASP 33 3HB ASP 33 26.318 19.245 23.980 211 H LEU 34 H LEU 34 27.696 22.534 25.497 212 HA LEU 34 HA LEU 34 28.651 24.629 23.607 213 HB2 LEU 34 2HB LEU 34 28.190 24.801 26.601 214 HB3 LEU 34 3HB LEU 34 28.959 26.051 25.626 215 HG LEU 34 HG LEU 34 26.097 25.098 25.285 216 HD11 LEU 34 1HD1 LEU 34 26.428 26.292 27.398 217 HD12 LEU 34 2HD1 LEU 34 25.542 27.333 26.267 218 HD13 LEU 34 3HD1 LEU 34 27.269 27.616 26.556 219 HD21 LEU 34 3HD2 LEU 34 26.962 25.964 23.156 220 HD22 LEU 34 1HD2 LEU 34 27.577 27.424 23.974 221 HD23 LEU 34 2HD2 LEU 34 25.825 27.114 23.866 222 H SER 35 H SER 35 29.619 21.768 24.813 223 HA SER 35 HA SER 35 32.069 22.416 26.135 224 HB2 SER 35 2HB SER 35 30.668 20.335 26.375 225 HB3 SER 35 3HB SER 35 31.326 19.789 24.820 226 HG SER 35 HG SER 35 33.422 20.014 25.779 227 H LYS 36 H LYS 36 31.292 22.592 22.761 228 HA LYS 36 HA LYS 36 33.942 22.043 21.727 229 HB2 LYS 36 2HB LYS 36 31.743 23.823 20.579 230 HB3 LYS 36 3HB LYS 36 33.208 23.292 19.755 231 HG2 LYS 36 2HG LYS 36 32.393 20.883 20.220 232 HG3 LYS 36 3HG LYS 36 30.822 21.615 20.547 233 HD2 LYS 36 2HD LYS 36 32.454 21.817 17.969 234 HD3 LYS 36 3HD LYS 36 31.023 20.838 18.178 235 HE2 LYS 36 2HE LYS 36 31.118 23.890 18.268 236 HE3 LYS 36 3HE LYS 36 30.579 22.918 16.898 237 HZ1 LYS 36 3HZ LYS 36 28.868 21.992 18.374 238 HZ2 LYS 36 1HZ LYS 36 28.679 23.606 18.072 239 HZ3 LYS 36 2HZ LYS 36 29.281 23.099 19.520 240 H LEU 37 H LEU 37 32.432 24.829 23.334 241 HA LEU 37 HA LEU 37 34.311 26.823 22.494 242 HB2 LEU 37 2HB LEU 37 32.655 26.661 25.058 243 HB3 LEU 37 3HB LEU 37 33.469 28.102 24.437 244 HG LEU 37 HG LEU 37 31.153 26.643 23.061 245 HD11 LEU 37 1HD1 LEU 37 30.524 27.808 25.149 246 HD12 LEU 37 2HD1 LEU 37 29.834 28.596 23.706 247 HD13 LEU 37 3HD1 LEU 37 31.246 29.323 24.528 248 HD21 LEU 37 3HD2 LEU 37 32.545 27.711 21.378 249 HD22 LEU 37 1HD2 LEU 37 32.623 29.224 22.337 250 HD23 LEU 37 2HD2 LEU 37 31.073 28.687 21.627 251 H THR 38 H THR 38 34.172 24.642 25.355 252 HA THR 38 HA THR 38 36.775 25.472 26.366 253 HB THR 38 HB THR 38 36.339 23.534 27.931 254 HG1 THR 38 1HG THR 38 34.923 22.312 26.718 255 HG21 THR 38 1HG2 THR 38 35.735 25.877 28.506 256 HG22 THR 38 2HG2 THR 38 34.595 24.711 29.198 257 HG23 THR 38 3HG2 THR 38 34.134 25.644 27.764 258 H GLY 39 H GLY 39 35.750 23.340 23.891 259 HA2 GLY 39 2HA GLY 39 37.176 22.340 22.327 260 HA3 GLY 39 3HA GLY 39 38.530 22.424 23.489 Start of MODEL 16 1 H1 ASN 1 H1 ASN 1 14.180 25.054 33.546 2 H2 ASN 1 H2 ASN 1 13.099 25.714 32.488 3 H3 ASN 1 H3 ASN 1 12.898 24.166 33.012 4 HA ASN 1 HA ASN 1 13.706 24.210 30.787 5 HB2 ASN 1 2HB ASN 1 16.031 25.706 32.038 6 HB3 ASN 1 3HB ASN 1 16.075 24.937 30.452 7 HD21 ASN 1 2HD2 ASN 1 15.182 28.611 30.176 8 HD22 ASN 1 1HD2 ASN 1 16.365 27.817 31.187 9 H GLU 2 H GLU 2 13.766 22.074 30.734 10 HA GLU 2 HA GLU 2 15.067 20.479 32.719 11 HB2 GLU 2 2HB GLU 2 12.945 19.997 31.383 12 HB3 GLU 2 3HB GLU 2 13.986 19.545 30.034 13 HG2 GLU 2 2HG GLU 2 15.056 17.799 31.421 14 HG3 GLU 2 3HG GLU 2 14.090 18.297 32.817 15 H CYS 3 H CYS 3 15.844 21.163 29.268 16 HA CYS 3 HA CYS 3 18.110 19.376 29.201 17 HB2 CYS 3 2HB CYS 3 16.665 20.400 27.236 18 HB3 CYS 3 3HB CYS 3 17.860 21.703 27.321 19 H VAL 4 H VAL 4 17.707 22.747 30.145 20 HA VAL 4 HA VAL 4 20.521 23.453 30.089 21 HB VAL 4 HB VAL 4 18.177 24.664 31.602 22 HG11 VAL 4 1HG1 VAL 4 20.260 25.355 32.647 23 HG12 VAL 4 2HG1 VAL 4 20.966 25.760 31.071 24 HG13 VAL 4 3HG1 VAL 4 19.603 26.707 31.716 25 HG21 VAL 4 3HG2 VAL 4 17.989 24.714 29.030 26 HG22 VAL 4 1HG2 VAL 4 18.018 26.310 29.807 27 HG23 VAL 4 2HG2 VAL 4 19.467 25.677 29.023 28 H SER 5 H SER 5 18.270 22.027 32.467 29 HA SER 5 HA SER 5 20.069 22.063 34.704 30 HB2 SER 5 2HB SER 5 17.617 20.346 34.146 31 HB3 SER 5 3HB SER 5 18.450 20.464 35.702 32 HG SER 5 HG SER 5 17.145 22.548 34.292 33 H LYS 6 H LYS 6 20.052 20.070 31.870 34 HA LYS 6 HA LYS 6 21.422 17.760 32.963 35 HB2 LYS 6 2HB LYS 6 21.321 18.886 30.151 36 HB3 LYS 6 3HB LYS 6 22.011 17.339 30.582 37 HG2 LYS 6 2HG LYS 6 19.109 18.044 31.171 38 HG3 LYS 6 3HG LYS 6 19.620 17.383 29.626 39 HD2 LYS 6 2HD LYS 6 20.149 15.952 32.268 40 HD3 LYS 6 3HD LYS 6 18.662 15.761 31.326 41 HE2 LYS 6 2HE LYS 6 20.089 15.148 29.330 42 HE3 LYS 6 3HE LYS 6 21.494 15.114 30.415 43 HZ1 LYS 6 3HZ LYS 6 19.065 13.469 30.624 44 HZ2 LYS 6 1HZ LYS 6 20.339 13.411 31.678 45 HZ3 LYS 6 2HZ LYS 6 20.537 12.953 30.107 46 H GLY 7 H GLY 7 22.363 21.026 32.559 47 HA2 GLY 7 2HA GLY 7 24.381 21.844 33.443 48 HA3 GLY 7 3HA GLY 7 25.198 20.342 33.032 49 H PHE 8 H PHE 8 23.431 21.039 30.313 50 HA PHE 8 HA PHE 8 25.688 22.389 28.961 51 HB2 PHE 8 2HB PHE 8 23.147 21.123 27.855 52 HB3 PHE 8 3HB PHE 8 24.459 21.807 26.898 53 HD1 PHE 8 HD1 PHE 8 26.603 20.634 26.699 54 HD2 PHE 8 HD2 PHE 8 23.352 19.046 29.001 55 HE1 PHE 8 HE1 PHE 8 27.695 18.417 26.672 56 HE2 PHE 8 HE2 PHE 8 24.477 16.817 29.066 57 HZ PHE 8 HZ PHE 8 26.671 16.505 27.869 58 H GLY 9 H GLY 9 22.459 22.779 27.876 59 HA2 GLY 9 2HA GLY 9 21.663 25.314 28.818 60 HA3 GLY 9 3HA GLY 9 22.768 25.564 27.459 61 H CYS 10 H CYS 10 21.072 26.474 26.243 62 HA CYS 10 HA CYS 10 19.577 24.520 24.676 63 HB2 CYS 10 2HB CYS 10 18.121 25.340 26.672 64 HB3 CYS 10 3HB CYS 10 18.111 26.899 25.850 65 H LEU 11 H LEU 11 19.202 25.288 22.580 66 HA LEU 11 HA LEU 11 20.322 27.951 21.839 67 HB2 LEU 11 2HB LEU 11 20.940 25.183 20.883 68 HB3 LEU 11 3HB LEU 11 20.759 26.395 19.630 69 HG LEU 11 HG LEU 11 22.570 27.622 20.246 70 HD11 LEU 11 1HD1 LEU 11 22.680 26.192 22.921 71 HD12 LEU 11 2HD1 LEU 11 22.399 27.930 22.636 72 HD13 LEU 11 3HD1 LEU 11 23.978 27.236 22.297 73 HD21 LEU 11 3HD2 LEU 11 23.070 25.311 19.314 74 HD22 LEU 11 1HD2 LEU 11 23.621 24.904 20.965 75 HD23 LEU 11 2HD2 LEU 11 24.403 26.206 20.057 76 HA PRO 12 HA PRO 12 16.558 28.570 19.633 77 HB2 PRO 12 3HB PRO 12 17.410 30.720 19.364 78 HB3 PRO 12 2HB PRO 12 17.248 30.282 17.636 79 HG2 PRO 12 2HG PRO 12 19.548 29.620 17.519 80 HG3 PRO 12 3HG PRO 12 19.638 31.092 18.541 81 HD2 PRO 12 2HD PRO 12 20.630 28.697 19.404 82 HD3 PRO 12 3HD PRO 12 19.807 29.817 20.527 83 H GLN 13 H GLN 13 15.516 28.536 17.483 84 HA GLN 13 HA GLN 13 15.702 26.004 16.217 85 HB2 GLN 13 2HB GLN 13 14.144 28.554 15.642 86 HB3 GLN 13 3HB GLN 13 13.853 27.028 14.799 87 HG2 GLN 13 2HG GLN 13 13.136 25.918 16.774 88 HG3 GLN 13 3HG GLN 13 13.720 27.202 17.833 89 HE21 GLN 13 2HE2 GLN 13 10.651 28.903 17.831 90 HE22 GLN 13 1HE2 GLN 13 12.165 28.522 18.629 91 H SER 14 H SER 14 17.712 28.617 15.617 92 HA SER 14 HA SER 14 18.190 27.835 12.778 93 HB2 SER 14 2HB SER 14 18.137 30.640 13.953 94 HB3 SER 14 3HB SER 14 18.665 30.226 12.311 95 HG SER 14 HG SER 14 16.097 29.709 13.392 96 H ASP 15 H ASP 15 19.537 27.624 15.762 97 HA ASP 15 HA ASP 15 22.269 27.717 14.635 98 HB2 ASP 15 2HB ASP 15 21.663 29.809 16.054 99 HB3 ASP 15 3HB ASP 15 21.693 28.701 17.436 100 H CYS 16 H CYS 16 20.019 25.696 15.720 101 HA CYS 16 HA CYS 16 21.979 23.944 17.117 102 HB2 CYS 16 2HB CYS 16 20.169 24.604 18.578 103 HB3 CYS 16 3HB CYS 16 18.973 24.044 17.420 104 HA PRO 17 HA PRO 17 21.047 22.013 13.003 105 HB2 PRO 17 3HB PRO 17 22.977 22.964 12.106 106 HB3 PRO 17 2HB PRO 17 23.581 21.292 12.320 107 HG2 PRO 17 2HG PRO 17 24.608 21.859 14.421 108 HG3 PRO 17 3HG PRO 17 24.931 23.336 13.456 109 HD2 PRO 17 2HD PRO 17 23.631 23.435 15.843 110 HD3 PRO 17 3HD PRO 17 23.174 24.512 14.491 111 H GLN 18 H GLN 18 21.286 19.743 12.413 112 HA GLN 18 HA GLN 18 20.669 17.980 14.481 113 HB2 GLN 18 2HB GLN 18 21.576 17.494 11.624 114 HB3 GLN 18 3HB GLN 18 20.983 16.211 12.688 115 HG2 GLN 18 2HG GLN 18 18.819 17.268 12.916 116 HG3 GLN 18 3HG GLN 18 19.348 18.701 12.033 117 HE21 GLN 18 2HE2 GLN 18 19.004 17.255 8.798 118 HE22 GLN 18 1HE2 GLN 18 19.660 18.591 9.733 119 H GLU 19 H GLU 19 23.851 18.713 13.119 120 HA GLU 19 HA GLU 19 25.309 16.472 14.130 121 HB2 GLU 19 2HB GLU 19 26.133 19.321 13.421 122 HB3 GLU 19 3HB GLU 19 27.265 18.027 13.840 123 HG2 GLU 19 2HG GLU 19 26.425 16.683 11.921 124 HG3 GLU 19 3HG GLU 19 25.359 18.019 11.461 125 H ALA 20 H ALA 20 24.614 19.734 15.493 126 HA ALA 20 HA ALA 20 26.244 19.278 17.858 127 HB1 ALA 20 1HB ALA 20 24.390 21.551 17.055 128 HB2 ALA 20 2HB ALA 20 25.518 21.569 18.429 129 HB3 ALA 20 3HB ALA 20 26.139 21.470 16.770 130 H ARG 21 H ARG 21 23.026 18.335 17.095 131 HA ARG 21 HA ARG 21 21.700 18.829 19.568 132 HB2 ARG 21 2HB ARG 21 21.294 16.582 17.549 133 HB3 ARG 21 3HB ARG 21 20.219 16.936 18.907 134 HG2 ARG 21 2HG ARG 21 19.942 19.281 17.975 135 HG3 ARG 21 3HG ARG 21 20.791 18.727 16.535 136 HD2 ARG 21 2HD ARG 21 18.145 17.722 17.622 137 HD3 ARG 21 3HD ARG 21 18.420 18.661 16.138 138 HE ARG 21 HE ARG 21 19.893 16.261 15.918 139 HH11 ARG 21 1HH1 ARG 21 16.477 17.255 16.063 140 HH12 ARG 21 2HH1 ARG 21 15.939 15.847 15.164 141 HH21 ARG 21 2HH2 ARG 21 17.411 14.351 14.367 142 HH22 ARG 21 1HH2 ARG 21 19.121 14.479 14.742 143 H LEU 22 H LEU 22 21.497 17.647 21.471 144 HA LEU 22 HA LEU 22 23.604 15.739 22.113 145 HB2 LEU 22 2HB LEU 22 21.256 17.009 23.543 146 HB3 LEU 22 3HB LEU 22 22.115 15.667 24.293 147 HG LEU 22 HG LEU 22 23.637 18.077 23.242 148 HD11 LEU 22 1HD1 LEU 22 21.950 18.956 24.769 149 HD12 LEU 22 2HD1 LEU 22 23.579 19.057 25.467 150 HD13 LEU 22 3HD1 LEU 22 22.453 17.789 26.012 151 HD21 LEU 22 3HD2 LEU 22 24.212 15.995 25.410 152 HD22 LEU 22 1HD2 LEU 22 25.258 17.368 25.022 153 HD23 LEU 22 2HD2 LEU 22 24.994 16.107 23.817 154 H SER 23 H SER 23 22.937 13.719 23.276 155 HA SER 23 HA SER 23 21.541 11.935 21.484 156 HB2 SER 23 2HB SER 23 23.495 11.340 22.934 157 HB3 SER 23 3HB SER 23 22.449 11.493 24.359 158 HG SER 23 HG SER 23 22.068 9.726 22.164 159 H TYR 24 H TYR 24 20.415 14.098 23.833 160 HA TYR 24 HA TYR 24 17.713 12.930 23.985 161 HB2 TYR 24 2HB TYR 24 17.856 13.598 26.506 162 HB3 TYR 24 3HB TYR 24 18.527 12.076 25.972 163 HD1 TYR 24 HD1 TYR 24 20.644 11.457 26.686 164 HD2 TYR 24 HD2 TYR 24 19.710 15.668 26.446 165 HE1 TYR 24 HE1 TYR 24 22.852 11.994 27.648 166 HE2 TYR 24 HE2 TYR 24 21.900 16.203 27.457 167 HH TYR 24 HH TYR 24 24.239 13.662 28.438 168 H GLY 25 H GLY 25 16.195 14.512 24.918 169 HA2 GLY 25 2HA GLY 25 16.815 17.328 24.119 170 HA3 GLY 25 3HA GLY 25 15.263 16.520 23.881 171 H GLY 26 H GLY 26 14.637 18.559 25.001 172 HA2 GLY 26 2HA GLY 26 13.349 18.244 27.301 173 HA3 GLY 26 3HA GLY 26 14.948 18.652 27.933 174 H CYS 27 H CYS 27 14.915 20.355 25.125 175 HA CYS 27 HA CYS 27 14.375 22.896 26.380 176 HB2 CYS 27 2HB CYS 27 15.311 21.894 23.709 177 HB3 CYS 27 3HB CYS 27 14.774 23.549 23.833 178 H SER 28 H SER 28 13.256 24.512 24.749 179 HA SER 28 HA SER 28 10.423 24.086 24.941 180 HB2 SER 28 2HB SER 28 11.596 26.279 25.182 181 HB3 SER 28 3HB SER 28 12.038 26.213 23.466 182 HG SER 28 HG SER 28 9.411 26.231 24.556 183 H THR 29 H THR 29 12.855 23.697 22.371 184 HA THR 29 HA THR 29 11.043 21.951 20.994 185 HB THR 29 HB THR 29 10.234 23.945 19.965 186 HG1 THR 29 1HG THR 29 10.747 23.445 17.805 187 HG21 THR 29 1HG2 THR 29 13.062 24.621 19.065 188 HG22 THR 29 2HG2 THR 29 12.136 25.500 20.301 189 HG23 THR 29 3HG2 THR 29 11.565 25.468 18.631 190 H VAL 30 H VAL 30 14.278 23.519 21.044 191 HA VAL 30 HA VAL 30 15.448 20.968 20.083 192 HB VAL 30 HB VAL 30 16.913 22.064 18.525 193 HG11 VAL 30 1HG1 VAL 30 15.402 22.513 16.715 194 HG12 VAL 30 2HG1 VAL 30 14.708 21.223 17.710 195 HG13 VAL 30 3HG1 VAL 30 14.069 22.875 17.823 196 HG21 VAL 30 3HG2 VAL 30 15.452 24.675 19.115 197 HG22 VAL 30 1HG2 VAL 30 17.171 24.315 19.392 198 HG23 VAL 30 2HG2 VAL 30 16.550 24.404 17.748 199 H CYS 31 H CYS 31 17.389 20.437 20.956 200 HA CYS 31 HA CYS 31 18.728 22.371 22.780 201 HB2 CYS 31 2HB CYS 31 17.297 20.638 23.982 202 HB3 CYS 31 3HB CYS 31 18.403 19.409 23.343 203 H CYS 32 H CYS 32 20.837 22.557 22.505 204 HA CYS 32 HA CYS 32 22.434 20.440 21.199 205 HB2 CYS 32 2HB CYS 32 22.154 23.378 20.475 206 HB3 CYS 32 3HB CYS 32 23.661 22.520 20.216 207 H ASP 33 H ASP 33 24.593 20.353 21.907 208 HA ASP 33 HA ASP 33 24.935 20.944 24.699 209 HB2 ASP 33 2HB ASP 33 26.868 19.686 24.561 210 HB3 ASP 33 3HB ASP 33 25.785 18.942 23.406 211 H LEU 34 H LEU 34 26.407 22.349 25.730 212 HA LEU 34 HA LEU 34 27.537 24.564 24.088 213 HB2 LEU 34 2HB LEU 34 27.230 24.439 27.097 214 HB3 LEU 34 3HB LEU 34 27.703 25.811 26.103 215 HG LEU 34 HG LEU 34 24.955 24.593 26.456 216 HD11 LEU 34 1HD1 LEU 34 25.759 26.353 28.012 217 HD12 LEU 34 2HD1 LEU 34 24.408 26.946 27.031 218 HD13 LEU 34 3HD1 LEU 34 26.063 27.434 26.639 219 HD21 LEU 34 3HD2 LEU 34 24.089 26.211 24.787 220 HD22 LEU 34 1HD2 LEU 34 25.015 24.904 24.059 221 HD23 LEU 34 2HD2 LEU 34 25.757 26.514 24.237 222 H SER 35 H SER 35 28.511 21.620 25.446 223 HA SER 35 HA SER 35 30.990 22.279 26.653 224 HB2 SER 35 2HB SER 35 29.684 20.145 26.880 225 HB3 SER 35 3HB SER 35 30.214 19.698 25.247 226 HG SER 35 HG SER 35 32.378 19.870 26.025 227 H LYS 36 H LYS 36 30.075 21.782 23.258 228 HA LYS 36 HA LYS 36 32.648 21.558 22.104 229 HB2 LYS 36 2HB LYS 36 31.532 22.115 20.028 230 HB3 LYS 36 3HB LYS 36 30.577 20.975 20.972 231 HG2 LYS 36 2HG LYS 36 29.169 22.962 21.767 232 HG3 LYS 36 3HG LYS 36 30.021 23.951 20.583 233 HD2 LYS 36 2HD LYS 36 28.321 21.489 20.016 234 HD3 LYS 36 3HD LYS 36 27.843 23.156 19.733 235 HE2 LYS 36 2HE LYS 36 30.129 21.700 18.333 236 HE3 LYS 36 3HE LYS 36 28.516 21.980 17.657 237 HZ1 LYS 36 3HZ LYS 36 30.418 24.082 18.428 238 HZ2 LYS 36 1HZ LYS 36 28.918 24.323 17.775 239 HZ3 LYS 36 2HZ LYS 36 30.105 23.582 16.891 240 H LEU 37 H LEU 37 30.850 24.428 23.197 241 HA LEU 37 HA LEU 37 32.460 26.375 21.818 242 HB2 LEU 37 2HB LEU 37 30.762 26.690 24.328 243 HB3 LEU 37 3HB LEU 37 31.366 27.986 23.314 244 HG LEU 37 HG LEU 37 29.348 25.868 22.434 245 HD11 LEU 37 1HD1 LEU 37 28.970 28.793 23.201 246 HD12 LEU 37 2HD1 LEU 37 28.418 27.376 24.123 247 HD13 LEU 37 3HD1 LEU 37 27.714 27.728 22.537 248 HD21 LEU 37 3HD2 LEU 37 30.330 28.392 21.018 249 HD22 LEU 37 1HD2 LEU 37 28.984 27.365 20.480 250 HD23 LEU 37 2HD2 LEU 37 30.625 26.715 20.506 251 H THR 38 H THR 38 32.492 25.021 25.162 252 HA THR 38 HA THR 38 34.770 26.588 25.993 253 HB THR 38 HB THR 38 34.582 25.050 28.011 254 HG1 THR 38 1HG THR 38 33.523 23.296 27.164 255 HG21 THR 38 1HG2 THR 38 33.517 27.282 27.919 256 HG22 THR 38 2HG2 THR 38 32.552 26.123 28.847 257 HG23 THR 38 3HG2 THR 38 32.063 26.558 27.196 258 H GLY 39 H GLY 39 34.393 23.541 24.353 259 HA2 GLY 39 2HA GLY 39 35.862 22.064 23.467 260 HA3 GLY 39 3HA GLY 39 37.057 23.362 23.557 Start of MODEL 17 1 H1 ASN 1 H1 ASN 1 17.879 22.104 34.161 2 H2 ASN 1 H2 ASN 1 16.384 22.403 33.537 3 H3 ASN 1 H3 ASN 1 16.767 20.889 34.073 4 HA ASN 1 HA ASN 1 16.794 20.945 31.701 5 HB2 ASN 1 2HB ASN 1 17.399 23.418 31.663 6 HB3 ASN 1 3HB ASN 1 19.072 22.935 31.976 7 HD21 ASN 1 2HD2 ASN 1 18.632 23.388 28.294 8 HD22 ASN 1 1HD2 ASN 1 18.483 24.408 29.713 9 H GLU 2 H GLU 2 17.561 18.940 31.444 10 HA GLU 2 HA GLU 2 19.661 17.806 32.938 11 HB2 GLU 2 2HB GLU 2 17.638 16.782 31.588 12 HB3 GLU 2 3HB GLU 2 18.769 16.743 30.249 13 HG2 GLU 2 2HG GLU 2 18.796 14.591 31.323 14 HG3 GLU 2 3HG GLU 2 20.346 15.367 31.624 15 H CYS 3 H CYS 3 19.702 19.529 29.907 16 HA CYS 3 HA CYS 3 22.287 18.776 28.903 17 HB2 CYS 3 2HB CYS 3 20.834 21.433 28.642 18 HB3 CYS 3 3HB CYS 3 22.183 20.894 27.649 19 H VAL 4 H VAL 4 21.294 21.709 30.738 20 HA VAL 4 HA VAL 4 23.907 22.595 31.388 21 HB VAL 4 HB VAL 4 21.244 23.230 32.715 22 HG11 VAL 4 1HG1 VAL 4 22.328 25.420 33.265 23 HG12 VAL 4 2HG1 VAL 4 23.064 24.060 34.107 24 HG13 VAL 4 3HG1 VAL 4 23.877 24.766 32.692 25 HG21 VAL 4 3HG2 VAL 4 22.656 24.612 30.385 26 HG22 VAL 4 1HG2 VAL 4 21.155 23.673 30.275 27 HG23 VAL 4 2HG2 VAL 4 21.176 25.180 31.188 28 H SER 5 H SER 5 21.774 20.317 33.048 29 HA SER 5 HA SER 5 23.045 20.211 35.567 30 HB2 SER 5 2HB SER 5 20.860 19.147 34.952 31 HB3 SER 5 3HB SER 5 21.743 17.938 34.008 32 HG SER 5 HG SER 5 21.152 17.406 36.244 33 H LYS 6 H LYS 6 23.822 18.388 32.540 34 HA LYS 6 HA LYS 6 26.335 17.348 33.691 35 HB2 LYS 6 2HB LYS 6 24.889 17.007 31.041 36 HB3 LYS 6 3HB LYS 6 26.546 16.457 31.297 37 HG2 LYS 6 2HG LYS 6 25.608 15.217 33.388 38 HG3 LYS 6 3HG LYS 6 24.019 15.475 32.639 39 HD2 LYS 6 2HD LYS 6 24.834 14.321 30.574 40 HD3 LYS 6 3HD LYS 6 26.420 14.119 31.315 41 HE2 LYS 6 2HE LYS 6 25.289 12.025 31.517 42 HE3 LYS 6 3HE LYS 6 25.393 12.750 33.128 43 HZ1 LYS 6 3HZ LYS 6 23.237 11.809 32.660 44 HZ2 LYS 6 1HZ LYS 6 23.028 12.807 31.368 45 HZ3 LYS 6 2HZ LYS 6 23.111 13.433 32.898 46 H GLY 7 H GLY 7 25.401 20.296 32.353 47 HA2 GLY 7 2HA GLY 7 26.880 22.103 32.318 48 HA3 GLY 7 3HA GLY 7 28.224 21.043 31.922 49 H PHE 8 H PHE 8 25.907 20.039 29.809 50 HA PHE 8 HA PHE 8 26.899 21.460 27.500 51 HB2 PHE 8 2HB PHE 8 24.382 19.756 27.833 52 HB3 PHE 8 3HB PHE 8 25.110 20.176 26.307 53 HD1 PHE 8 HD1 PHE 8 27.490 19.361 25.818 54 HD2 PHE 8 HD2 PHE 8 25.043 17.756 28.976 55 HE1 PHE 8 HE1 PHE 8 28.823 17.227 25.795 56 HE2 PHE 8 HE2 PHE 8 26.397 15.665 28.958 57 HZ PHE 8 HZ PHE 8 28.283 15.422 27.362 58 H GLY 9 H GLY 9 25.310 22.473 25.936 59 HA2 GLY 9 2HA GLY 9 23.267 24.202 27.297 60 HA3 GLY 9 3HA GLY 9 24.295 24.770 25.991 61 H CYS 10 H CYS 10 22.190 25.363 25.114 62 HA CYS 10 HA CYS 10 21.107 23.332 23.285 63 HB2 CYS 10 2HB CYS 10 19.360 25.104 25.033 64 HB3 CYS 10 3HB CYS 10 18.802 24.139 23.668 65 H LEU 11 H LEU 11 22.507 24.437 21.848 66 HA LEU 11 HA LEU 11 22.364 27.245 21.251 67 HB2 LEU 11 2HB LEU 11 23.466 24.772 19.909 68 HB3 LEU 11 3HB LEU 11 23.425 26.264 19.027 69 HG LEU 11 HG LEU 11 24.878 27.364 20.476 70 HD11 LEU 11 1HD1 LEU 11 24.184 26.785 22.694 71 HD12 LEU 11 2HD1 LEU 11 25.889 26.390 22.529 72 HD13 LEU 11 3HD1 LEU 11 24.671 25.095 22.459 73 HD21 LEU 11 3HD2 LEU 11 26.910 26.116 20.319 74 HD22 LEU 11 1HD2 LEU 11 25.903 25.715 18.915 75 HD23 LEU 11 2HD2 LEU 11 26.031 24.582 20.282 76 HA PRO 12 HA PRO 12 18.770 27.352 18.692 77 HB2 PRO 12 3HB PRO 12 19.112 29.613 18.430 78 HB3 PRO 12 2HB PRO 12 19.356 29.158 16.717 79 HG2 PRO 12 2HG PRO 12 21.721 29.120 16.985 80 HG3 PRO 12 3HG PRO 12 21.289 30.499 18.040 81 HD2 PRO 12 2HD PRO 12 22.712 28.365 18.968 82 HD3 PRO 12 3HD PRO 12 21.509 29.177 20.004 83 H GLN 13 H GLN 13 17.905 26.850 16.585 84 HA GLN 13 HA GLN 13 19.081 24.524 15.393 85 HB2 GLN 13 2HB GLN 13 16.615 26.201 14.781 86 HB3 GLN 13 3HB GLN 13 17.024 24.719 13.914 87 HG2 GLN 13 2HG GLN 13 17.063 23.479 16.098 88 HG3 GLN 13 3HG GLN 13 16.512 24.946 16.912 89 HE21 GLN 13 2HE2 GLN 13 13.120 24.245 16.219 90 HE22 GLN 13 1HE2 GLN 13 14.302 25.077 17.211 91 H SER 14 H SER 14 20.078 27.593 14.903 92 HA SER 14 HA SER 14 20.746 27.245 12.025 93 HB2 SER 14 2HB SER 14 19.292 29.162 12.584 94 HB3 SER 14 3HB SER 14 20.520 29.766 13.709 95 HG SER 14 HG SER 14 21.926 29.977 11.947 96 H ASP 15 H ASP 15 22.117 26.778 15.062 97 HA ASP 15 HA ASP 15 24.853 27.444 14.100 98 HB2 ASP 15 2HB ASP 15 23.794 29.202 15.622 99 HB3 ASP 15 3HB ASP 15 23.836 27.989 16.904 100 H CYS 16 H CYS 16 22.937 24.896 15.097 101 HA CYS 16 HA CYS 16 25.161 23.536 16.534 102 HB2 CYS 16 2HB CYS 16 23.049 23.797 17.792 103 HB3 CYS 16 3HB CYS 16 22.219 22.858 16.549 104 HA PRO 17 HA PRO 17 25.217 21.296 12.545 105 HB2 PRO 17 3HB PRO 17 27.503 21.654 12.489 106 HB3 PRO 17 2HB PRO 17 27.539 19.904 12.864 107 HG2 PRO 17 2HG PRO 17 27.825 20.338 15.199 108 HG3 PRO 17 3HG PRO 17 28.812 21.652 14.492 109 HD2 PRO 17 2HD PRO 17 26.766 22.138 16.226 110 HD3 PRO 17 3HD PRO 17 27.112 23.253 14.871 111 H GLN 18 H GLN 18 25.020 19.035 11.920 112 HA GLN 18 HA GLN 18 23.153 17.702 13.507 113 HB2 GLN 18 2HB GLN 18 24.798 16.627 11.175 114 HB3 GLN 18 3HB GLN 18 23.322 15.900 11.800 115 HG2 GLN 18 2HG GLN 18 23.550 18.627 10.457 116 HG3 GLN 18 3HG GLN 18 22.844 17.169 9.776 117 HE21 GLN 18 2HE2 GLN 18 19.837 17.336 11.834 118 HE22 GLN 18 1HE2 GLN 18 20.944 16.183 11.123 119 H GLU 19 H GLU 19 26.631 17.321 13.536 120 HA GLU 19 HA GLU 19 26.654 14.686 14.771 121 HB2 GLU 19 2HB GLU 19 28.801 16.784 14.262 122 HB3 GLU 19 3HB GLU 19 29.117 15.163 14.904 123 HG2 GLU 19 2HG GLU 19 28.252 14.123 12.868 124 HG3 GLU 19 3HG GLU 19 27.831 15.706 12.191 125 H ALA 20 H ALA 20 26.788 18.065 15.886 126 HA ALA 20 HA ALA 20 27.623 17.382 18.603 127 HB1 ALA 20 1HB ALA 20 26.648 19.994 17.390 128 HB2 ALA 20 2HB ALA 20 27.408 19.794 18.984 129 HB3 ALA 20 3HB ALA 20 28.345 19.471 17.517 130 H ARG 21 H ARG 21 24.626 17.375 16.919 131 HA ARG 21 HA ARG 21 22.836 17.981 19.119 132 HB2 ARG 21 2HB ARG 21 22.502 16.603 16.423 133 HB3 ARG 21 3HB ARG 21 21.169 16.828 17.562 134 HG2 ARG 21 2HG ARG 21 21.494 19.277 17.494 135 HG3 ARG 21 3HG ARG 21 22.873 19.064 16.407 136 HD2 ARG 21 2HD ARG 21 21.279 17.916 14.782 137 HD3 ARG 21 3HD ARG 21 19.962 18.471 15.835 138 HE ARG 21 HE ARG 21 21.964 20.423 14.822 139 HH11 ARG 21 1HH1 ARG 21 18.594 19.276 14.609 140 HH12 ARG 21 2HH1 ARG 21 18.093 20.691 13.700 141 HH21 ARG 21 2HH2 ARG 21 19.556 22.330 13.196 142 HH22 ARG 21 1HH2 ARG 21 21.239 22.212 13.674 143 H LEU 22 H LEU 22 22.901 16.735 20.960 144 HA LEU 22 HA LEU 22 23.710 13.954 20.849 145 HB2 LEU 22 2HB LEU 22 22.821 15.771 23.127 146 HB3 LEU 22 3HB LEU 22 23.476 14.149 23.319 147 HG LEU 22 HG LEU 22 24.971 16.550 22.175 148 HD11 LEU 22 1HD1 LEU 22 25.219 15.069 24.811 149 HD12 LEU 22 2HD1 LEU 22 24.632 16.731 24.560 150 HD13 LEU 22 3HD1 LEU 22 26.326 16.328 24.224 151 HD21 LEU 22 3HD2 LEU 22 25.930 13.698 22.704 152 HD22 LEU 22 1HD2 LEU 22 26.988 15.068 22.314 153 HD23 LEU 22 2HD2 LEU 22 25.834 14.491 21.117 154 H SER 23 H SER 23 22.486 12.314 21.938 155 HA SER 23 HA SER 23 19.829 12.123 20.787 156 HB2 SER 23 2HB SER 23 21.598 10.309 20.830 157 HB3 SER 23 3HB SER 23 21.275 10.123 22.564 158 HG SER 23 HG SER 23 19.066 9.731 21.960 159 H TYR 24 H TYR 24 20.730 13.623 23.571 160 HA TYR 24 HA TYR 24 18.193 13.131 24.991 161 HB2 TYR 24 2HB TYR 24 19.280 12.559 27.028 162 HB3 TYR 24 3HB TYR 24 19.880 11.467 25.802 163 HD1 TYR 24 HD1 TYR 24 20.809 13.466 28.525 164 HD2 TYR 24 HD2 TYR 24 22.225 12.381 24.575 165 HE1 TYR 24 HE1 TYR 24 23.133 13.942 29.209 166 HE2 TYR 24 HE2 TYR 24 24.529 12.779 25.292 167 HH TYR 24 HH TYR 24 25.920 13.444 26.996 168 H GLY 25 H GLY 25 18.058 14.631 26.943 169 HA2 GLY 25 2HA GLY 25 19.502 16.776 27.640 170 HA3 GLY 25 3HA GLY 25 18.766 17.350 26.132 171 H GLY 26 H GLY 26 18.239 18.753 28.329 172 HA2 GLY 26 2HA GLY 26 15.588 17.986 29.407 173 HA3 GLY 26 3HA GLY 26 16.629 19.295 29.955 174 H CYS 27 H CYS 27 16.970 20.025 26.914 175 HA CYS 27 HA CYS 27 14.676 21.797 26.632 176 HB2 CYS 27 2HB CYS 27 16.937 21.098 24.730 177 HB3 CYS 27 3HB CYS 27 15.771 22.390 24.486 178 H SER 28 H SER 28 13.683 21.748 24.274 179 HA SER 28 HA SER 28 12.558 19.021 23.842 180 HB2 SER 28 2HB SER 28 11.213 20.597 25.321 181 HB3 SER 28 3HB SER 28 10.953 21.587 23.876 182 HG SER 28 HG SER 28 10.282 18.844 24.227 183 H THR 29 H THR 29 14.455 21.178 22.390 184 HA THR 29 HA THR 29 13.392 20.572 19.673 185 HB THR 29 HB THR 29 14.375 22.726 18.911 186 HG1 THR 29 1HG THR 29 14.826 24.296 20.423 187 HG21 THR 29 1HG2 THR 29 11.939 22.508 19.357 188 HG22 THR 29 2HG2 THR 29 12.538 24.149 19.672 189 HG23 THR 29 3HG2 THR 29 12.213 23.051 21.031 190 H VAL 30 H VAL 30 16.345 21.799 21.288 191 HA VAL 30 HA VAL 30 17.946 19.551 20.281 192 HB VAL 30 HB VAL 30 19.714 21.195 19.450 193 HG11 VAL 30 1HG1 VAL 30 18.869 21.291 17.198 194 HG12 VAL 30 2HG1 VAL 30 18.392 19.750 17.929 195 HG13 VAL 30 3HG1 VAL 30 17.201 21.061 17.751 196 HG21 VAL 30 3HG2 VAL 30 19.027 23.360 18.609 197 HG22 VAL 30 1HG2 VAL 30 17.368 23.126 19.178 198 HG23 VAL 30 2HG2 VAL 30 18.692 23.282 20.351 199 H CYS 31 H CYS 31 20.011 19.420 21.265 200 HA CYS 31 HA CYS 31 20.618 21.039 23.659 201 HB2 CYS 31 2HB CYS 31 19.226 19.111 24.407 202 HB3 CYS 31 3HB CYS 31 20.336 18.014 23.605 203 H CYS 32 H CYS 32 22.230 21.885 22.249 204 HA CYS 32 HA CYS 32 23.952 20.178 20.728 205 HB2 CYS 32 2HB CYS 32 23.221 22.724 20.453 206 HB3 CYS 32 3HB CYS 32 24.695 23.041 21.352 207 H ASP 33 H ASP 33 26.198 19.823 20.953 208 HA ASP 33 HA ASP 33 27.231 19.923 23.722 209 HB2 ASP 33 2HB ASP 33 27.140 17.752 22.916 210 HB3 ASP 33 3HB ASP 33 27.839 18.126 21.379 211 H LEU 34 H LEU 34 28.067 21.810 24.043 212 HA LEU 34 HA LEU 34 30.416 22.696 22.506 213 HB2 LEU 34 2HB LEU 34 29.999 24.876 23.509 214 HB3 LEU 34 3HB LEU 34 28.720 24.337 22.427 215 HG LEU 34 HG LEU 34 28.408 23.964 25.418 216 HD11 LEU 34 1HD1 LEU 34 27.817 26.512 23.853 217 HD12 LEU 34 2HD1 LEU 34 29.041 26.316 25.123 218 HD13 LEU 34 3HD1 LEU 34 27.327 26.194 25.534 219 HD21 LEU 34 3HD2 LEU 34 26.627 22.915 24.447 220 HD22 LEU 34 1HD2 LEU 34 26.581 23.992 23.041 221 HD23 LEU 34 2HD2 LEU 34 25.963 24.538 24.610 222 H SER 35 H SER 35 29.659 20.836 25.073 223 HA SER 35 HA SER 35 31.621 21.629 27.043 224 HB2 SER 35 2HB SER 35 29.764 20.074 27.524 225 HB3 SER 35 3HB SER 35 30.418 18.924 26.348 226 HG SER 35 HG SER 35 31.274 19.551 28.902 227 H LYS 36 H LYS 36 31.710 20.046 23.897 228 HA LYS 36 HA LYS 36 34.413 19.051 24.041 229 HB2 LYS 36 2HB LYS 36 34.162 18.662 21.680 230 HB3 LYS 36 3HB LYS 36 32.686 18.184 22.516 231 HG2 LYS 36 2HG LYS 36 31.733 20.486 21.850 232 HG3 LYS 36 3HG LYS 36 33.131 20.651 20.788 233 HD2 LYS 36 2HD LYS 36 31.031 18.438 20.702 234 HD3 LYS 36 3HD LYS 36 31.125 19.803 19.597 235 HE2 LYS 36 2HE LYS 36 33.260 17.644 19.883 236 HE3 LYS 36 3HE LYS 36 31.994 17.670 18.647 237 HZ1 LYS 36 3HZ LYS 36 34.108 19.684 18.981 238 HZ2 LYS 36 1HZ LYS 36 32.869 19.779 17.892 239 HZ3 LYS 36 2HZ LYS 36 33.981 18.572 17.769 240 H LEU 37 H LEU 37 33.089 22.254 23.566 241 HA LEU 37 HA LEU 37 35.482 23.282 22.208 242 HB2 LEU 37 2HB LEU 37 32.951 24.688 23.153 243 HB3 LEU 37 3HB LEU 37 34.225 25.406 22.193 244 HG LEU 37 HG LEU 37 32.419 23.115 21.307 245 HD11 LEU 37 1HD1 LEU 37 31.247 25.285 21.499 246 HD12 LEU 37 2HD1 LEU 37 31.417 24.799 19.807 247 HD13 LEU 37 3HD1 LEU 37 32.480 26.049 20.483 248 HD21 LEU 37 3HD2 LEU 37 34.600 22.956 20.171 249 HD22 LEU 37 1HD2 LEU 37 34.523 24.676 19.741 250 HD23 LEU 37 2HD2 LEU 37 33.367 23.523 19.044 251 H THR 38 H THR 38 33.856 23.610 25.385 252 HA THR 38 HA THR 38 36.327 24.805 26.512 253 HB THR 38 HB THR 38 34.912 26.649 25.744 254 HG1 THR 38 1HG THR 38 34.943 26.373 28.557 255 HG21 THR 38 1HG2 THR 38 32.795 25.649 27.699 256 HG22 THR 38 2HG2 THR 38 32.650 25.659 25.930 257 HG23 THR 38 3HG2 THR 38 32.770 27.182 26.815 258 H GLY 39 H GLY 39 33.458 22.865 27.000 259 HA2 GLY 39 2HA GLY 39 33.262 21.197 28.673 260 HA3 GLY 39 3HA GLY 39 34.433 22.044 29.677 Start of MODEL 18 1 H1 ASN 1 H1 ASN 1 15.271 22.520 34.804 2 H2 ASN 1 H2 ASN 1 14.045 23.179 33.922 3 H3 ASN 1 H3 ASN 1 14.203 21.538 34.019 4 HA ASN 1 HA ASN 1 14.930 22.316 31.904 5 HB2 ASN 1 2HB ASN 1 16.868 23.953 33.567 6 HB3 ASN 1 3HB ASN 1 17.015 23.682 31.828 7 HD21 ASN 1 2HD2 ASN 1 15.339 26.985 32.407 8 HD22 ASN 1 1HD2 ASN 1 16.809 26.273 33.022 9 H GLU 2 H GLU 2 15.506 20.301 31.371 10 HA GLU 2 HA GLU 2 17.250 18.646 32.894 11 HB2 GLU 2 2HB GLU 2 15.442 17.898 31.296 12 HB3 GLU 2 3HB GLU 2 16.515 18.339 29.961 13 HG2 GLU 2 2HG GLU 2 18.233 16.752 30.825 14 HG3 GLU 2 3HG GLU 2 17.148 16.317 32.151 15 H CYS 3 H CYS 3 17.804 20.376 29.766 16 HA CYS 3 HA CYS 3 20.478 19.433 29.457 17 HB2 CYS 3 2HB CYS 3 18.935 21.713 28.193 18 HB3 CYS 3 3HB CYS 3 20.647 21.449 27.872 19 H VAL 4 H VAL 4 19.213 22.391 31.018 20 HA VAL 4 HA VAL 4 21.765 23.618 31.423 21 HB VAL 4 HB VAL 4 19.187 23.992 32.996 22 HG11 VAL 4 1HG1 VAL 4 21.112 24.936 34.159 23 HG12 VAL 4 2HG1 VAL 4 21.656 25.748 32.679 24 HG13 VAL 4 3HG1 VAL 4 20.141 26.240 33.472 25 HG21 VAL 4 3HG2 VAL 4 18.860 24.394 30.536 26 HG22 VAL 4 1HG2 VAL 4 18.728 25.875 31.493 27 HG23 VAL 4 2HG2 VAL 4 20.214 25.530 30.569 28 H SER 5 H SER 5 19.804 21.358 33.425 29 HA SER 5 HA SER 5 21.498 21.297 35.715 30 HB2 SER 5 2HB SER 5 19.160 20.473 35.632 31 HB3 SER 5 3HB SER 5 19.669 19.148 34.571 32 HG SER 5 HG SER 5 20.515 19.652 37.231 33 H LYS 6 H LYS 6 21.575 19.544 32.614 34 HA LYS 6 HA LYS 6 23.802 17.811 33.333 35 HB2 LYS 6 2HB LYS 6 22.304 18.381 30.754 36 HB3 LYS 6 3HB LYS 6 23.618 17.219 30.869 37 HG2 LYS 6 2HG LYS 6 21.095 17.053 32.568 38 HG3 LYS 6 3HG LYS 6 21.263 16.293 30.993 39 HD2 LYS 6 2HD LYS 6 23.050 15.712 33.401 40 HD3 LYS 6 3HD LYS 6 21.642 14.760 32.937 41 HE2 LYS 6 2HE LYS 6 24.065 15.204 31.142 42 HE3 LYS 6 3HE LYS 6 23.844 13.809 32.219 43 HZ1 LYS 6 3HZ LYS 6 23.181 13.346 29.999 44 HZ2 LYS 6 1HZ LYS 6 22.022 14.533 30.041 45 HZ3 LYS 6 2HZ LYS 6 21.909 13.221 31.037 46 H GLY 7 H GLY 7 23.716 21.127 32.528 47 HA2 GLY 7 2HA GLY 7 25.532 22.523 32.325 48 HA3 GLY 7 3HA GLY 7 26.596 21.154 32.008 49 H PHE 8 H PHE 8 24.090 20.682 29.908 50 HA PHE 8 HA PHE 8 25.382 21.870 27.576 51 HB2 PHE 8 2HB PHE 8 22.742 20.385 27.885 52 HB3 PHE 8 3HB PHE 8 23.540 20.760 26.364 53 HD1 PHE 8 HD1 PHE 8 22.874 18.099 28.385 54 HD2 PHE 8 HD2 PHE 8 26.244 20.038 26.536 55 HE1 PHE 8 HE1 PHE 8 24.152 15.961 28.464 56 HE2 PHE 8 HE2 PHE 8 27.507 17.891 26.594 57 HZ PHE 8 HZ PHE 8 26.456 15.859 27.566 58 H GLY 9 H GLY 9 23.752 22.910 25.980 59 HA2 GLY 9 2HA GLY 9 22.394 25.190 27.390 60 HA3 GLY 9 3HA GLY 9 23.423 25.367 25.978 61 H CYS 10 H CYS 10 21.097 26.518 25.881 62 HA CYS 10 HA CYS 10 19.336 24.895 24.103 63 HB2 CYS 10 2HB CYS 10 18.555 26.973 26.174 64 HB3 CYS 10 3HB CYS 10 17.455 26.195 25.043 65 H LEU 11 H LEU 11 20.914 25.784 22.520 66 HA LEU 11 HA LEU 11 20.894 28.570 21.784 67 HB2 LEU 11 2HB LEU 11 21.735 25.946 20.557 68 HB3 LEU 11 3HB LEU 11 21.696 27.349 19.525 69 HG LEU 11 HG LEU 11 23.220 27.152 22.101 70 HD11 LEU 11 1HD1 LEU 11 25.269 26.819 20.799 71 HD12 LEU 11 2HD1 LEU 11 24.303 26.770 19.314 72 HD13 LEU 11 3HD1 LEU 11 24.097 25.515 20.548 73 HD21 LEU 11 3HD2 LEU 11 22.821 29.504 21.530 74 HD22 LEU 11 1HD2 LEU 11 23.626 29.256 19.975 75 HD23 LEU 11 2HD2 LEU 11 24.529 29.070 21.479 76 HA PRO 12 HA PRO 12 17.215 28.647 19.178 77 HB2 PRO 12 3HB PRO 12 17.687 30.906 18.832 78 HB3 PRO 12 2HB PRO 12 17.938 30.341 17.154 79 HG2 PRO 12 2HG PRO 12 20.298 30.178 17.483 80 HG3 PRO 12 3HG PRO 12 19.917 31.660 18.417 81 HD2 PRO 12 2HD PRO 12 21.195 29.517 19.525 82 HD3 PRO 12 3HD PRO 12 20.050 30.474 20.484 83 H GLN 13 H GLN 13 16.558 28.161 16.837 84 HA GLN 13 HA GLN 13 17.698 25.691 15.962 85 HB2 GLN 13 2HB GLN 13 15.789 27.620 14.582 86 HB3 GLN 13 3HB GLN 13 16.205 26.010 13.984 87 HG2 GLN 13 2HG GLN 13 15.357 25.024 16.148 88 HG3 GLN 13 3HG GLN 13 14.820 26.637 16.632 89 HE21 GLN 13 2HE2 GLN 13 12.788 24.565 13.678 90 HE22 GLN 13 1HE2 GLN 13 14.430 24.120 14.086 91 H SER 14 H SER 14 18.561 28.990 15.198 92 HA SER 14 HA SER 14 19.978 28.582 12.744 93 HB2 SER 14 2HB SER 14 19.271 30.792 13.519 94 HB3 SER 14 3HB SER 14 20.268 30.636 14.975 95 HG SER 14 HG SER 14 21.251 30.585 12.311 96 H ASP 15 H ASP 15 21.103 28.728 16.180 97 HA ASP 15 HA ASP 15 23.816 27.977 15.372 98 HB2 ASP 15 2HB ASP 15 22.656 28.593 18.108 99 HB3 ASP 15 3HB ASP 15 24.357 28.391 17.757 100 H CYS 16 H CYS 16 21.063 26.147 16.217 101 HA CYS 16 HA CYS 16 22.720 23.926 17.293 102 HB2 CYS 16 2HB CYS 16 21.119 24.873 18.853 103 HB3 CYS 16 3HB CYS 16 19.797 24.541 17.749 104 HA PRO 17 HA PRO 17 21.278 22.496 13.133 105 HB2 PRO 17 3HB PRO 17 23.318 23.152 12.225 106 HB3 PRO 17 2HB PRO 17 23.614 21.390 12.251 107 HG2 PRO 17 2HG PRO 17 24.779 21.556 14.358 108 HG3 PRO 17 3HG PRO 17 25.354 23.018 13.488 109 HD2 PRO 17 2HD PRO 17 24.190 23.215 15.915 110 HD3 PRO 17 3HD PRO 17 23.857 24.417 14.634 111 H GLN 18 H GLN 18 21.401 20.269 12.172 112 HA GLN 18 HA GLN 18 20.648 18.208 14.008 113 HB2 GLN 18 2HB GLN 18 21.311 18.180 11.037 114 HB3 GLN 18 3HB GLN 18 20.641 16.804 11.921 115 HG2 GLN 18 2HG GLN 18 18.629 18.106 12.502 116 HG3 GLN 18 3HG GLN 18 19.267 19.514 11.641 117 HE21 GLN 18 2HE2 GLN 18 18.259 18.374 8.447 118 HE22 GLN 18 1HE2 GLN 18 18.931 19.668 9.413 119 H GLU 19 H GLU 19 23.764 19.290 13.195 120 HA GLU 19 HA GLU 19 25.116 16.676 13.482 121 HB2 GLU 19 2HB GLU 19 26.056 19.520 12.964 122 HB3 GLU 19 3HB GLU 19 27.152 18.143 13.158 123 HG2 GLU 19 2HG GLU 19 26.130 16.992 11.237 124 HG3 GLU 19 3HG GLU 19 24.983 18.317 11.020 125 H ALA 20 H ALA 20 24.392 19.588 15.359 126 HA ALA 20 HA ALA 20 26.201 18.760 17.555 127 HB1 ALA 20 1HB ALA 20 25.822 21.035 18.390 128 HB2 ALA 20 2HB ALA 20 26.383 21.054 16.709 129 HB3 ALA 20 3HB ALA 20 24.667 21.331 17.072 130 H ARG 21 H ARG 21 22.857 18.488 16.765 131 HA ARG 21 HA ARG 21 21.626 18.867 19.264 132 HB2 ARG 21 2HB ARG 21 19.788 17.530 18.388 133 HB3 ARG 21 3HB ARG 21 20.377 18.676 17.179 134 HG2 ARG 21 2HG ARG 21 21.585 16.865 16.038 135 HG3 ARG 21 3HG ARG 21 20.989 15.690 17.225 136 HD2 ARG 21 2HD ARG 21 18.705 15.995 16.540 137 HD3 ARG 21 3HD ARG 21 19.110 17.434 15.598 138 HE ARG 21 HE ARG 21 19.910 16.180 13.878 139 HH11 ARG 21 1HH1 ARG 21 19.274 13.922 16.562 140 HH12 ARG 21 2HH1 ARG 21 19.582 12.516 15.570 141 HH21 ARG 21 2HH2 ARG 21 20.107 12.742 13.371 142 HH22 ARG 21 1HH2 ARG 21 20.217 14.315 12.629 143 H LEU 22 H LEU 22 21.230 17.597 21.062 144 HA LEU 22 HA LEU 22 22.833 15.149 21.375 145 HB2 LEU 22 2HB LEU 22 21.181 16.936 23.177 146 HB3 LEU 22 3HB LEU 22 21.753 15.366 23.735 147 HG LEU 22 HG LEU 22 23.715 17.361 22.528 148 HD11 LEU 22 1HD1 LEU 22 22.798 17.200 25.406 149 HD12 LEU 22 2HD1 LEU 22 22.525 18.547 24.276 150 HD13 LEU 22 3HD1 LEU 22 24.175 18.159 24.787 151 HD21 LEU 22 3HD2 LEU 22 23.999 15.075 24.539 152 HD22 LEU 22 1HD2 LEU 22 25.311 16.137 23.999 153 HD23 LEU 22 2HD2 LEU 22 24.530 15.056 22.843 154 H SER 23 H SER 23 21.753 13.336 22.466 155 HA SER 23 HA SER 23 19.519 12.405 20.817 156 HB2 SER 23 2HB SER 23 21.535 11.030 21.483 157 HB3 SER 23 3HB SER 23 20.881 10.976 23.131 158 HG SER 23 HG SER 23 19.501 10.142 20.783 159 H TYR 24 H TYR 24 19.709 14.187 23.644 160 HA TYR 24 HA TYR 24 16.931 13.655 24.465 161 HB2 TYR 24 2HB TYR 24 17.845 13.793 26.886 162 HB3 TYR 24 3HB TYR 24 18.013 12.300 25.998 163 HD1 TYR 24 HD1 TYR 24 20.175 15.462 26.169 164 HD2 TYR 24 HD2 TYR 24 19.928 11.156 26.585 165 HE1 TYR 24 HE1 TYR 24 22.570 15.363 26.710 166 HE2 TYR 24 HE2 TYR 24 22.341 11.077 27.096 167 HH TYR 24 HH TYR 24 24.264 12.302 27.431 168 H GLY 25 H GLY 25 16.295 15.375 26.159 169 HA2 GLY 25 2HA GLY 25 17.711 17.506 26.878 170 HA3 GLY 25 3HA GLY 25 17.092 18.064 25.309 171 H GLY 26 H GLY 26 16.495 19.525 27.388 172 HA2 GLY 26 2HA GLY 26 13.583 19.159 27.848 173 HA3 GLY 26 3HA GLY 26 14.661 19.434 29.218 174 H CYS 27 H CYS 27 15.466 21.010 26.192 175 HA CYS 27 HA CYS 27 14.980 23.700 27.174 176 HB2 CYS 27 2HB CYS 27 15.628 22.605 24.422 177 HB3 CYS 27 3HB CYS 27 15.682 24.306 24.867 178 H SER 28 H SER 28 13.755 25.130 25.284 179 HA SER 28 HA SER 28 10.965 24.231 25.515 180 HB2 SER 28 2HB SER 28 11.785 26.580 26.107 181 HB3 SER 28 3HB SER 28 12.017 26.839 24.368 182 HG SER 28 HG SER 28 9.612 26.129 25.693 183 H THR 29 H THR 29 13.499 24.430 23.112 184 HA THR 29 HA THR 29 11.625 23.531 20.992 185 HB THR 29 HB THR 29 12.866 24.956 19.373 186 HG1 THR 29 1HG THR 29 14.111 26.660 20.222 187 HG21 THR 29 1HG2 THR 29 10.710 25.733 20.351 188 HG22 THR 29 2HG2 THR 29 11.803 27.069 19.933 189 HG23 THR 29 3HG2 THR 29 11.622 26.577 21.628 190 H VAL 30 H VAL 30 15.120 24.021 21.677 191 HA VAL 30 HA VAL 30 15.759 21.288 20.752 192 HB VAL 30 HB VAL 30 17.469 22.102 19.178 193 HG11 VAL 30 1HG1 VAL 30 16.072 22.605 17.293 194 HG12 VAL 30 2HG1 VAL 30 15.214 21.452 18.326 195 HG13 VAL 30 3HG1 VAL 30 14.756 23.170 18.334 196 HG21 VAL 30 3HG2 VAL 30 17.438 24.394 18.279 197 HG22 VAL 30 1HG2 VAL 30 16.276 24.878 19.526 198 HG23 VAL 30 2HG2 VAL 30 17.914 24.350 19.978 199 H CYS 31 H CYS 31 17.874 20.604 21.324 200 HA CYS 31 HA CYS 31 19.398 22.312 23.224 201 HB2 CYS 31 2HB CYS 31 17.958 20.729 24.473 202 HB3 CYS 31 3HB CYS 31 18.697 19.383 23.604 203 H CYS 32 H CYS 32 21.517 22.345 22.862 204 HA CYS 32 HA CYS 32 22.812 20.235 21.228 205 HB2 CYS 32 2HB CYS 32 22.797 23.244 20.833 206 HB3 CYS 32 3HB CYS 32 24.215 22.290 20.434 207 H ASP 33 H ASP 33 24.842 19.711 21.801 208 HA ASP 33 HA ASP 33 25.842 20.466 24.428 209 HB2 ASP 33 2HB ASP 33 26.224 18.226 23.898 210 HB3 ASP 33 3HB ASP 33 26.717 18.574 22.253 211 H LEU 34 H LEU 34 26.445 22.516 24.544 212 HA LEU 34 HA LEU 34 28.650 23.471 22.806 213 HB2 LEU 34 2HB LEU 34 27.959 25.715 23.272 214 HB3 LEU 34 3HB LEU 34 26.652 24.752 22.593 215 HG LEU 34 HG LEU 34 25.776 24.489 25.009 216 HD11 LEU 34 1HD1 LEU 34 27.655 25.355 26.329 217 HD12 LEU 34 2HD1 LEU 34 26.285 26.441 26.497 218 HD13 LEU 34 3HD1 LEU 34 27.626 26.885 25.425 219 HD21 LEU 34 3HD2 LEU 34 24.632 25.776 23.343 220 HD22 LEU 34 1HD2 LEU 34 25.769 27.135 23.506 221 HD23 LEU 34 2HD2 LEU 34 24.655 26.747 24.823 222 H SER 35 H SER 35 28.167 21.980 25.641 223 HA SER 35 HA SER 35 29.524 23.457 27.621 224 HB2 SER 35 2HB SER 35 28.028 21.546 28.022 225 HB3 SER 35 3HB SER 35 29.210 20.448 27.288 226 HG SER 35 HG SER 35 30.632 20.921 28.951 227 H LYS 36 H LYS 36 30.839 21.598 24.933 228 HA LYS 36 HA LYS 36 33.467 21.093 25.921 229 HB2 LYS 36 2HB LYS 36 32.438 21.546 23.091 230 HB3 LYS 36 3HB LYS 36 34.067 20.989 23.498 231 HG2 LYS 36 2HG LYS 36 33.019 19.037 24.736 232 HG3 LYS 36 3HG LYS 36 31.450 19.534 24.081 233 HD2 LYS 36 2HD LYS 36 33.898 18.764 22.434 234 HD3 LYS 36 3HD LYS 36 32.517 17.713 22.778 235 HE2 LYS 36 2HE LYS 36 31.003 19.310 21.620 236 HE3 LYS 36 3HE LYS 36 32.395 20.351 21.252 237 HZ1 LYS 36 3HZ LYS 36 31.871 18.957 19.418 238 HZ2 LYS 36 1HZ LYS 36 32.009 17.590 20.336 239 HZ3 LYS 36 2HZ LYS 36 33.340 18.515 20.030 240 H LEU 37 H LEU 37 32.132 23.837 24.052 241 HA LEU 37 HA LEU 37 34.595 25.402 24.154 242 HB2 LEU 37 2HB LEU 37 31.749 25.942 23.229 243 HB3 LEU 37 3HB LEU 37 33.028 27.151 23.141 244 HG LEU 37 HG LEU 37 33.263 24.421 21.796 245 HD11 LEU 37 1HD1 LEU 37 31.282 25.592 20.890 246 HD12 LEU 37 2HD1 LEU 37 32.588 25.531 19.697 247 HD13 LEU 37 3HD1 LEU 37 32.270 27.036 20.583 248 HD21 LEU 37 3HD2 LEU 37 34.964 25.561 20.409 249 HD22 LEU 37 1HD2 LEU 37 35.410 25.657 22.118 250 HD23 LEU 37 2HD2 LEU 37 34.708 27.068 21.308 251 H THR 38 H THR 38 31.307 25.729 25.518 252 HA THR 38 HA THR 38 30.404 27.096 27.030 253 HB THR 38 HB THR 38 30.982 25.090 28.203 254 HG1 THR 38 1HG THR 38 31.194 27.417 29.770 255 HG21 THR 38 1HG2 THR 38 33.432 25.078 28.219 256 HG22 THR 38 2HG2 THR 38 32.787 24.982 29.861 257 HG23 THR 38 3HG2 THR 38 33.460 26.512 29.269 258 H GLY 39 H GLY 39 31.787 28.747 25.467 259 HA2 GLY 39 2HA GLY 39 33.438 30.578 27.114 260 HA3 GLY 39 3HA GLY 39 33.279 30.555 25.359 Start of MODEL 19 1 H1 ASN 1 H1 ASN 1 14.629 22.036 33.881 2 H2 ASN 1 H2 ASN 1 13.259 22.274 32.986 3 H3 ASN 1 H3 ASN 1 13.643 20.762 33.511 4 HA ASN 1 HA ASN 1 14.118 20.942 31.207 5 HB2 ASN 1 2HB ASN 1 16.056 23.117 32.031 6 HB3 ASN 1 3HB ASN 1 15.788 22.519 30.390 7 HD21 ASN 1 2HD2 ASN 1 13.868 25.765 31.439 8 HD22 ASN 1 1HD2 ASN 1 15.452 25.225 31.909 9 H GLU 2 H GLU 2 15.136 19.052 30.988 10 HA GLU 2 HA GLU 2 17.015 18.048 32.879 11 HB2 GLU 2 2HB GLU 2 15.346 16.808 31.378 12 HB3 GLU 2 3HB GLU 2 16.510 16.979 30.074 13 HG2 GLU 2 2HG GLU 2 18.203 15.758 31.389 14 HG3 GLU 2 3HG GLU 2 17.104 15.683 32.772 15 H CYS 3 H CYS 3 17.416 19.529 29.680 16 HA CYS 3 HA CYS 3 20.237 19.054 29.396 17 HB2 CYS 3 2HB CYS 3 18.335 21.049 28.139 18 HB3 CYS 3 3HB CYS 3 20.073 21.159 27.899 19 H VAL 4 H VAL 4 18.439 21.663 31.057 20 HA VAL 4 HA VAL 4 20.784 23.281 31.565 21 HB VAL 4 HB VAL 4 18.055 23.288 32.903 22 HG11 VAL 4 1HG1 VAL 4 18.627 25.633 33.521 23 HG12 VAL 4 2HG1 VAL 4 19.648 24.439 34.322 24 HG13 VAL 4 3HG1 VAL 4 20.283 25.357 32.939 25 HG21 VAL 4 3HG2 VAL 4 17.970 23.762 30.422 26 HG22 VAL 4 1HG2 VAL 4 17.514 25.155 31.404 27 HG23 VAL 4 2HG2 VAL 4 19.130 25.076 30.672 28 H SER 5 H SER 5 18.993 20.763 33.389 29 HA SER 5 HA SER 5 20.448 20.942 35.827 30 HB2 SER 5 2HB SER 5 18.285 19.741 35.526 31 HB3 SER 5 3HB SER 5 19.120 18.516 34.550 32 HG SER 5 HG SER 5 20.521 18.272 36.457 33 H LYS 6 H LYS 6 21.116 19.208 32.786 34 HA LYS 6 HA LYS 6 23.548 17.910 33.770 35 HB2 LYS 6 2HB LYS 6 22.144 18.134 31.087 36 HB3 LYS 6 3HB LYS 6 23.696 17.320 31.269 37 HG2 LYS 6 2HG LYS 6 21.240 16.504 32.880 38 HG3 LYS 6 3HG LYS 6 21.642 15.828 31.301 39 HD2 LYS 6 2HD LYS 6 23.839 15.066 32.156 40 HD3 LYS 6 3HD LYS 6 23.423 15.695 33.764 41 HE2 LYS 6 2HE LYS 6 21.466 14.195 33.860 42 HE3 LYS 6 3HE LYS 6 21.852 13.570 32.246 43 HZ1 LYS 6 3HZ LYS 6 22.643 12.161 34.019 44 HZ2 LYS 6 1HZ LYS 6 23.614 13.369 34.591 45 HZ3 LYS 6 2HZ LYS 6 23.892 12.717 33.103 46 H GLY 7 H GLY 7 22.887 21.103 32.880 47 HA2 GLY 7 2HA GLY 7 24.326 22.858 32.828 48 HA3 GLY 7 3HA GLY 7 25.699 21.754 32.857 49 H PHE 8 H PHE 8 23.701 20.873 30.256 50 HA PHE 8 HA PHE 8 25.535 21.866 28.269 51 HB2 PHE 8 2HB PHE 8 22.879 20.405 28.104 52 HB3 PHE 8 3HB PHE 8 23.848 20.803 26.702 53 HD1 PHE 8 HD1 PHE 8 26.457 20.097 26.886 54 HD2 PHE 8 HD2 PHE 8 23.168 18.228 28.938 55 HE1 PHE 8 HE1 PHE 8 27.727 17.979 26.995 56 HE2 PHE 8 HE2 PHE 8 24.448 16.102 29.054 57 HZ PHE 8 HZ PHE 8 26.735 15.978 28.085 58 H GLY 9 H GLY 9 24.492 22.807 26.180 59 HA2 GLY 9 2HA GLY 9 23.343 25.421 26.811 60 HA3 GLY 9 3HA GLY 9 23.956 24.850 25.259 61 H CYS 10 H CYS 10 21.841 26.162 24.840 62 HA CYS 10 HA CYS 10 19.739 24.256 24.144 63 HB2 CYS 10 2HB CYS 10 19.322 25.110 26.543 64 HB3 CYS 10 3HB CYS 10 19.015 26.680 25.824 65 H LEU 11 H LEU 11 21.283 25.255 22.265 66 HA LEU 11 HA LEU 11 20.531 27.844 21.289 67 HB2 LEU 11 2HB LEU 11 21.925 25.446 20.075 68 HB3 LEU 11 3HB LEU 11 21.535 26.830 19.078 69 HG LEU 11 HG LEU 11 23.104 27.027 21.625 70 HD11 LEU 11 1HD1 LEU 11 25.181 27.066 20.417 71 HD12 LEU 11 2HD1 LEU 11 24.348 26.871 18.872 72 HD13 LEU 11 3HD1 LEU 11 24.309 25.566 20.067 73 HD21 LEU 11 3HD2 LEU 11 23.949 29.173 20.830 74 HD22 LEU 11 1HD2 LEU 11 22.197 29.188 21.019 75 HD23 LEU 11 2HD2 LEU 11 22.908 29.067 19.403 76 HA PRO 12 HA PRO 12 16.750 26.910 19.115 77 HB2 PRO 12 3HB PRO 12 16.599 29.226 18.859 78 HB3 PRO 12 2HB PRO 12 16.758 28.795 17.132 79 HG2 PRO 12 2HG PRO 12 19.122 29.224 17.173 80 HG3 PRO 12 3HG PRO 12 18.496 30.535 18.227 81 HD2 PRO 12 2HD PRO 12 20.392 28.776 19.116 82 HD3 PRO 12 3HD PRO 12 19.110 29.365 20.195 83 H GLN 13 H GLN 13 15.935 26.444 16.818 84 HA GLN 13 HA GLN 13 17.352 24.270 15.735 85 HB2 GLN 13 2HB GLN 13 15.578 24.110 14.134 86 HB3 GLN 13 3HB GLN 13 14.934 24.485 15.736 87 HG2 GLN 13 2HG GLN 13 14.797 26.902 15.063 88 HG3 GLN 13 3HG GLN 13 15.314 26.448 13.435 89 HE21 GLN 13 2HE2 GLN 13 11.425 26.434 14.133 90 HE22 GLN 13 1HE2 GLN 13 12.628 27.414 14.942 91 H SER 14 H SER 14 17.894 27.594 15.043 92 HA SER 14 HA SER 14 19.119 27.080 12.397 93 HB2 SER 14 2HB SER 14 18.682 29.655 13.952 94 HB3 SER 14 3HB SER 14 19.349 29.529 12.313 95 HG SER 14 HG SER 14 17.353 28.447 11.746 96 H ASP 15 H ASP 15 20.113 27.070 15.665 97 HA ASP 15 HA ASP 15 22.977 27.364 14.884 98 HB2 ASP 15 2HB ASP 15 21.430 28.576 17.115 99 HB3 ASP 15 3HB ASP 15 22.899 27.790 17.622 100 H CYS 16 H CYS 16 20.633 25.144 15.719 101 HA CYS 16 HA CYS 16 22.560 23.332 17.059 102 HB2 CYS 16 2HB CYS 16 20.785 24.119 18.525 103 HB3 CYS 16 3HB CYS 16 19.563 23.535 17.398 104 HA PRO 17 HA PRO 17 21.518 21.332 13.017 105 HB2 PRO 17 3HB PRO 17 23.529 22.130 12.158 106 HB3 PRO 17 2HB PRO 17 24.009 20.426 12.372 107 HG2 PRO 17 2HG PRO 17 25.020 20.913 14.518 108 HG3 PRO 17 3HG PRO 17 25.485 22.352 13.554 109 HD2 PRO 17 2HD PRO 17 24.145 22.596 15.883 110 HD3 PRO 17 3HD PRO 17 23.789 23.666 14.498 111 H GLN 18 H GLN 18 22.044 19.023 12.289 112 HA GLN 18 HA GLN 18 21.333 17.081 14.252 113 HB2 GLN 18 2HB GLN 18 22.395 16.837 11.410 114 HB3 GLN 18 3HB GLN 18 21.818 15.477 12.381 115 HG2 GLN 18 2HG GLN 18 19.591 16.555 12.590 116 HG3 GLN 18 3HG GLN 18 20.149 17.897 11.583 117 HE21 GLN 18 2HE2 GLN 18 19.103 16.207 8.675 118 HE22 GLN 18 1HE2 GLN 18 19.320 17.722 9.529 119 H GLU 19 H GLU 19 24.416 18.458 13.552 120 HA GLU 19 HA GLU 19 25.982 16.107 14.339 121 HB2 GLU 19 2HB GLU 19 26.725 18.997 13.710 122 HB3 GLU 19 3HB GLU 19 27.889 17.720 14.100 123 HG2 GLU 19 2HG GLU 19 27.154 16.414 12.135 124 HG3 GLU 19 3HG GLU 19 25.967 17.663 11.728 125 H ALA 20 H ALA 20 24.948 19.216 15.791 126 HA ALA 20 HA ALA 20 26.586 18.714 18.183 127 HB1 ALA 20 1HB ALA 20 24.945 21.116 17.335 128 HB2 ALA 20 2HB ALA 20 26.072 21.039 18.706 129 HB3 ALA 20 3HB ALA 20 26.682 20.888 17.048 130 H ARG 21 H ARG 21 23.311 18.095 17.272 131 HA ARG 21 HA ARG 21 21.972 18.667 19.715 132 HB2 ARG 21 2HB ARG 21 20.235 17.164 18.882 133 HB3 ARG 21 3HB ARG 21 20.777 18.330 17.671 134 HG2 ARG 21 2HG ARG 21 22.017 16.643 16.473 135 HG3 ARG 21 3HG ARG 21 21.785 15.457 17.759 136 HD2 ARG 21 2HD ARG 21 20.349 15.019 15.823 137 HD3 ARG 21 3HD ARG 21 19.428 15.291 17.314 138 HE ARG 21 HE ARG 21 19.560 17.781 16.073 139 HH11 ARG 21 1HH1 ARG 21 18.190 14.606 15.214 140 HH12 ARG 21 2HH1 ARG 21 16.893 15.330 14.283 141 HH21 ARG 21 2HH2 ARG 21 16.726 17.593 14.081 142 HH22 ARG 21 1HH2 ARG 21 17.881 18.633 14.889 143 H LEU 22 H LEU 22 21.318 17.289 21.478 144 HA LEU 22 HA LEU 22 23.270 15.178 22.119 145 HB2 LEU 22 2HB LEU 22 21.108 16.690 23.607 146 HB3 LEU 22 3HB LEU 22 21.863 15.266 24.312 147 HG LEU 22 HG LEU 22 23.582 17.544 23.264 148 HD11 LEU 22 1HD1 LEU 22 23.658 18.477 25.508 149 HD12 LEU 22 2HD1 LEU 22 22.456 17.286 26.071 150 HD13 LEU 22 3HD1 LEU 22 22.008 18.521 24.876 151 HD21 LEU 22 3HD2 LEU 22 24.748 15.446 23.767 152 HD22 LEU 22 1HD2 LEU 22 24.021 15.393 25.385 153 HD23 LEU 22 2HD2 LEU 22 25.173 16.669 24.964 154 H SER 23 H SER 23 22.299 13.265 23.263 155 HA SER 23 HA SER 23 20.719 11.707 21.429 156 HB2 SER 23 2HB SER 23 22.552 10.857 22.902 157 HB3 SER 23 3HB SER 23 21.504 11.120 24.310 158 HG SER 23 HG SER 23 19.986 9.706 23.190 159 H TYR 24 H TYR 24 19.697 14.060 23.588 160 HA TYR 24 HA TYR 24 16.939 13.066 23.753 161 HB2 TYR 24 2HB TYR 24 16.821 13.309 26.119 162 HB3 TYR 24 3HB TYR 24 18.187 12.262 25.799 163 HD1 TYR 24 HD1 TYR 24 20.605 13.475 25.684 164 HD2 TYR 24 HD2 TYR 24 17.066 15.185 27.518 165 HE1 TYR 24 HE1 TYR 24 22.026 14.965 27.110 166 HE2 TYR 24 HE2 TYR 24 18.522 16.653 28.897 167 HH TYR 24 HH TYR 24 20.647 17.164 29.455 168 H GLY 25 H GLY 25 15.471 14.760 24.501 169 HA2 GLY 25 2HA GLY 25 16.331 17.490 23.662 170 HA3 GLY 25 3HA GLY 25 14.724 16.790 23.446 171 H GLY 26 H GLY 26 17.096 17.700 25.954 172 HA2 GLY 26 2HA GLY 26 15.153 17.820 28.106 173 HA3 GLY 26 3HA GLY 26 16.861 18.234 28.164 174 H CYS 27 H CYS 27 15.394 19.914 25.606 175 HA CYS 27 HA CYS 27 14.869 22.372 27.206 176 HB2 CYS 27 2HB CYS 27 15.766 21.897 24.355 177 HB3 CYS 27 3HB CYS 27 15.077 23.426 24.863 178 H SER 28 H SER 28 13.279 23.739 25.465 179 HA SER 28 HA SER 28 10.693 22.532 25.958 180 HB2 SER 28 2HB SER 28 11.507 25.087 24.511 181 HB3 SER 28 3HB SER 28 9.848 24.632 24.945 182 HG SER 28 HG SER 28 10.548 24.585 27.143 183 H THR 29 H THR 29 12.863 22.801 23.161 184 HA THR 29 HA THR 29 11.278 20.791 21.860 185 HB THR 29 HB THR 29 10.038 22.802 21.156 186 HG1 THR 29 1HG THR 29 10.056 22.275 18.964 187 HG21 THR 29 1HG2 THR 29 10.892 24.414 19.611 188 HG22 THR 29 2HG2 THR 29 12.445 23.577 19.480 189 HG23 THR 29 3HG2 THR 29 11.994 24.402 20.995 190 H VAL 30 H VAL 30 14.200 22.941 21.705 191 HA VAL 30 HA VAL 30 15.634 20.762 20.367 192 HB VAL 30 HB VAL 30 14.989 22.246 18.655 193 HG11 VAL 30 1HG1 VAL 30 15.480 24.625 18.533 194 HG12 VAL 30 2HG1 VAL 30 14.492 24.353 19.971 195 HG13 VAL 30 3HG1 VAL 30 16.233 24.603 20.136 196 HG21 VAL 30 3HG2 VAL 30 17.160 22.929 17.801 197 HG22 VAL 30 1HG2 VAL 30 17.831 22.895 19.448 198 HG23 VAL 30 2HG2 VAL 30 17.300 21.381 18.674 199 H CYS 31 H CYS 31 17.478 20.293 21.222 200 HA CYS 31 HA CYS 31 18.888 22.157 23.069 201 HB2 CYS 31 2HB CYS 31 17.576 20.502 24.397 202 HB3 CYS 31 3HB CYS 31 18.450 19.194 23.570 203 H CYS 32 H CYS 32 21.079 22.127 22.923 204 HA CYS 32 HA CYS 32 22.510 20.037 21.400 205 HB2 CYS 32 2HB CYS 32 22.370 22.992 20.800 206 HB3 CYS 32 3HB CYS 32 23.935 22.204 20.730 207 H ASP 33 H ASP 33 24.783 19.916 21.948 208 HA ASP 33 HA ASP 33 25.246 20.474 24.775 209 HB2 ASP 33 2HB ASP 33 26.979 18.977 24.656 210 HB3 ASP 33 3HB ASP 33 25.869 18.337 23.465 211 H LEU 34 H LEU 34 27.154 21.567 25.588 212 HA LEU 34 HA LEU 34 28.510 23.452 23.762 213 HB2 LEU 34 2HB LEU 34 28.569 25.064 25.559 214 HB3 LEU 34 3HB LEU 34 26.928 24.578 25.113 215 HG LEU 34 HG LEU 34 26.770 23.167 27.105 216 HD11 LEU 34 1HD1 LEU 34 29.451 24.372 27.895 217 HD12 LEU 34 2HD1 LEU 34 29.034 22.644 27.761 218 HD13 LEU 34 3HD1 LEU 34 28.319 23.616 29.038 219 HD21 LEU 34 3HD2 LEU 34 25.941 25.517 27.030 220 HD22 LEU 34 1HD2 LEU 34 27.493 26.074 27.681 221 HD23 LEU 34 2HD2 LEU 34 26.430 25.042 28.662 222 H SER 35 H SER 35 29.038 20.668 25.179 223 HA SER 35 HA SER 35 31.318 20.946 26.834 224 HB2 SER 35 2HB SER 35 29.872 18.947 26.629 225 HB3 SER 35 3HB SER 35 30.589 18.604 25.037 226 HG SER 35 HG SER 35 31.519 17.543 26.937 227 H LYS 36 H LYS 36 31.030 21.043 23.309 228 HA LYS 36 HA LYS 36 33.852 20.750 22.730 229 HB2 LYS 36 2HB LYS 36 31.552 21.903 21.095 230 HB3 LYS 36 3HB LYS 36 33.197 21.626 20.504 231 HG2 LYS 36 2HG LYS 36 32.948 19.190 21.114 232 HG3 LYS 36 3HG LYS 36 31.236 19.509 21.476 233 HD2 LYS 36 2HD LYS 36 30.860 20.260 19.178 234 HD3 LYS 36 3HD LYS 36 32.570 20.053 18.779 235 HE2 LYS 36 2HE LYS 36 30.696 17.808 19.635 236 HE3 LYS 36 3HE LYS 36 31.081 18.222 17.957 237 HZ1 LYS 36 3HZ LYS 36 32.956 17.249 19.995 238 HZ2 LYS 36 1HZ LYS 36 33.419 17.810 18.518 239 HZ3 LYS 36 2HZ LYS 36 32.471 16.467 18.628 240 H LEU 37 H LEU 37 31.712 23.540 23.439 241 HA LEU 37 HA LEU 37 33.606 25.567 22.651 242 HB2 LEU 37 2HB LEU 37 31.229 25.727 24.548 243 HB3 LEU 37 3HB LEU 37 32.115 27.090 23.889 244 HG LEU 37 HG LEU 37 30.462 25.112 22.262 245 HD11 LEU 37 1HD1 LEU 37 29.105 26.618 23.674 246 HD12 LEU 37 2HD1 LEU 37 28.937 27.050 21.966 247 HD13 LEU 37 3HD1 LEU 37 29.968 28.026 23.025 248 HD21 LEU 37 3HD2 LEU 37 30.788 26.733 20.393 249 HD22 LEU 37 1HD2 LEU 37 32.299 25.966 20.877 250 HD23 LEU 37 2HD2 LEU 37 31.951 27.632 21.389 251 H THR 38 H THR 38 32.754 24.038 25.810 252 HA THR 38 HA THR 38 34.725 25.513 27.315 253 HB THR 38 HB THR 38 34.091 23.813 29.077 254 HG1 THR 38 1HG THR 38 33.420 22.112 27.815 255 HG21 THR 38 1HG2 THR 38 31.843 24.689 29.440 256 HG22 THR 38 2HG2 THR 38 31.783 25.308 27.775 257 HG23 THR 38 3HG2 THR 38 32.955 25.978 28.938 258 H GLY 39 H GLY 39 35.020 22.918 25.120 259 HA2 GLY 39 2HA GLY 39 37.122 22.096 24.435 260 HA3 GLY 39 3HA GLY 39 37.770 22.327 26.060 Start of MODEL 20 1 H1 ASN 1 H1 ASN 1 14.677 19.787 33.202 2 H2 ASN 1 H2 ASN 1 13.437 19.794 32.115 3 H3 ASN 1 H3 ASN 1 14.172 18.371 32.519 4 HA ASN 1 HA ASN 1 14.849 19.062 30.385 5 HB2 ASN 1 2HB ASN 1 16.382 21.110 30.288 6 HB3 ASN 1 3HB ASN 1 14.632 21.327 30.275 7 HD21 ASN 1 2HD2 ASN 1 15.392 23.992 32.499 8 HD22 ASN 1 1HD2 ASN 1 15.070 23.554 30.834 9 H GLU 2 H GLU 2 16.054 17.315 30.325 10 HA GLU 2 HA GLU 2 18.113 16.666 32.157 11 HB2 GLU 2 2HB GLU 2 16.640 15.238 30.484 12 HB3 GLU 2 3HB GLU 2 17.968 15.504 29.365 13 HG2 GLU 2 2HG GLU 2 18.076 14.203 32.120 14 HG3 GLU 2 3HG GLU 2 18.174 13.370 30.570 15 H CYS 3 H CYS 3 18.286 17.978 28.794 16 HA CYS 3 HA CYS 3 21.082 17.916 28.525 17 HB2 CYS 3 2HB CYS 3 19.120 18.338 26.816 18 HB3 CYS 3 3HB CYS 3 19.398 20.039 27.187 19 H VAL 4 H VAL 4 18.952 20.515 29.777 20 HA VAL 4 HA VAL 4 21.040 22.460 30.188 21 HB VAL 4 HB VAL 4 18.270 22.223 31.421 22 HG11 VAL 4 1HG1 VAL 4 18.461 24.679 31.778 23 HG12 VAL 4 2HG1 VAL 4 19.641 23.775 32.728 24 HG13 VAL 4 3HG1 VAL 4 20.158 24.613 31.247 25 HG21 VAL 4 3HG2 VAL 4 19.213 23.808 28.982 26 HG22 VAL 4 1HG2 VAL 4 18.169 22.371 28.938 27 HG23 VAL 4 2HG2 VAL 4 17.584 23.854 29.696 28 H SER 5 H SER 5 19.524 19.934 32.244 29 HA SER 5 HA SER 5 20.796 20.662 34.687 30 HB2 SER 5 2HB SER 5 18.813 19.260 34.600 31 HB3 SER 5 3HB SER 5 19.689 17.997 33.715 32 HG SER 5 HG SER 5 20.835 17.528 35.484 33 H LYS 6 H LYS 6 21.866 18.572 31.992 34 HA LYS 6 HA LYS 6 24.335 17.689 33.196 35 HB2 LYS 6 2HB LYS 6 23.266 17.910 30.368 36 HB3 LYS 6 3HB LYS 6 24.911 17.379 30.674 37 HG2 LYS 6 2HG LYS 6 22.484 16.027 31.910 38 HG3 LYS 6 3HG LYS 6 23.129 15.575 30.335 39 HD2 LYS 6 2HD LYS 6 24.758 15.482 32.911 40 HD3 LYS 6 3HD LYS 6 23.895 14.108 32.207 41 HE2 LYS 6 2HE LYS 6 25.217 14.333 30.118 42 HE3 LYS 6 3HE LYS 6 26.109 15.688 30.834 43 HZ1 LYS 6 3HZ LYS 6 27.326 13.689 31.041 44 HZ2 LYS 6 1HZ LYS 6 26.085 12.920 31.809 45 HZ3 LYS 6 2HZ LYS 6 26.864 14.179 32.548 46 H GLY 7 H GLY 7 23.333 20.763 31.921 47 HA2 GLY 7 2HA GLY 7 24.581 22.695 32.444 48 HA3 GLY 7 3HA GLY 7 26.091 21.820 32.220 49 H PHE 8 H PHE 8 24.219 20.874 29.606 50 HA PHE 8 HA PHE 8 25.709 22.472 27.739 51 HB2 PHE 8 2HB PHE 8 23.290 20.691 27.302 52 HB3 PHE 8 3HB PHE 8 24.360 21.292 26.053 53 HD1 PHE 8 HD1 PHE 8 23.713 18.530 28.194 54 HD2 PHE 8 HD2 PHE 8 26.919 20.681 26.277 55 HE1 PHE 8 HE1 PHE 8 25.160 16.528 28.362 56 HE2 PHE 8 HE2 PHE 8 28.318 18.628 26.344 57 HZ PHE 8 HZ PHE 8 27.455 16.564 27.414 58 H GLY 9 H GLY 9 24.568 23.566 25.882 59 HA2 GLY 9 2HA GLY 9 23.070 25.835 26.910 60 HA3 GLY 9 3HA GLY 9 23.728 25.606 25.285 61 H CYS 10 H CYS 10 21.736 26.582 24.579 62 HA CYS 10 HA CYS 10 19.841 24.550 23.767 63 HB2 CYS 10 2HB CYS 10 19.058 25.446 26.068 64 HB3 CYS 10 3HB CYS 10 18.675 26.936 25.225 65 H LEU 11 H LEU 11 21.196 25.237 21.940 66 HA LEU 11 HA LEU 11 21.071 27.827 20.735 67 HB2 LEU 11 2HB LEU 11 21.892 25.040 19.912 68 HB3 LEU 11 3HB LEU 11 21.653 26.228 18.655 69 HG LEU 11 HG LEU 11 23.255 27.756 19.746 70 HD11 LEU 11 1HD1 LEU 11 23.887 25.391 21.563 71 HD12 LEU 11 2HD1 LEU 11 23.257 26.977 22.062 72 HD13 LEU 11 3HD1 LEU 11 24.886 26.851 21.391 73 HD21 LEU 11 3HD2 LEU 11 25.247 26.620 18.971 74 HD22 LEU 11 1HD2 LEU 11 23.890 26.327 17.869 75 HD23 LEU 11 2HD2 LEU 11 24.405 25.061 18.998 76 HA PRO 12 HA PRO 12 17.229 27.441 18.410 77 HB2 PRO 12 3HB PRO 12 17.589 29.641 17.744 78 HB3 PRO 12 2HB PRO 12 17.725 28.859 16.137 79 HG2 PRO 12 2HG PRO 12 20.100 28.837 16.257 80 HG3 PRO 12 3HG PRO 12 19.743 30.399 17.061 81 HD2 PRO 12 2HD PRO 12 21.192 28.387 18.251 82 HD3 PRO 12 3HD PRO 12 20.150 29.482 19.200 83 H GLN 13 H GLN 13 16.321 26.362 16.589 84 HA GLN 13 HA GLN 13 17.653 24.025 15.653 85 HB2 GLN 13 2HB GLN 13 15.668 23.612 14.394 86 HB3 GLN 13 3HB GLN 13 15.242 24.203 16.003 87 HG2 GLN 13 2HG GLN 13 14.932 26.501 15.023 88 HG3 GLN 13 3HG GLN 13 15.238 25.824 13.424 89 HE21 GLN 13 2HE2 GLN 13 11.489 25.878 14.668 90 HE22 GLN 13 1HE2 GLN 13 12.782 26.919 15.244 91 H SER 14 H SER 14 17.701 27.268 14.436 92 HA SER 14 HA SER 14 18.484 26.554 11.707 93 HB2 SER 14 2HB SER 14 18.241 29.209 13.158 94 HB3 SER 14 3HB SER 14 18.599 29.016 11.431 95 HG SER 14 HG SER 14 16.437 29.345 11.652 96 H ASP 15 H ASP 15 20.254 26.531 14.587 97 HA ASP 15 HA ASP 15 22.758 27.181 13.099 98 HB2 ASP 15 2HB ASP 15 22.095 29.003 14.718 99 HB3 ASP 15 3HB ASP 15 22.319 27.835 16.031 100 H CYS 16 H CYS 16 21.252 25.212 15.693 101 HA CYS 16 HA CYS 16 23.644 23.597 16.071 102 HB2 CYS 16 2HB CYS 16 22.032 24.071 17.878 103 HB3 CYS 16 3HB CYS 16 20.792 23.178 17.003 104 HA PRO 17 HA PRO 17 22.210 21.165 12.455 105 HB2 PRO 17 3HB PRO 17 24.342 21.489 11.591 106 HB3 PRO 17 2HB PRO 17 24.463 19.734 11.948 107 HG2 PRO 17 2HG PRO 17 25.537 20.153 14.034 108 HG3 PRO 17 3HG PRO 17 26.280 21.413 12.990 109 HD2 PRO 17 2HD PRO 17 24.992 22.060 15.316 110 HD3 PRO 17 3HD PRO 17 24.893 23.097 13.875 111 H GLN 18 H GLN 18 22.023 18.828 11.954 112 HA GLN 18 HA GLN 18 21.073 17.318 14.194 113 HB2 GLN 18 2HB GLN 18 21.395 16.570 11.264 114 HB3 GLN 18 3HB GLN 18 20.522 15.622 12.479 115 HG2 GLN 18 2HG GLN 18 19.041 17.609 12.907 116 HG3 GLN 18 3HG GLN 18 19.810 18.437 11.552 117 HE21 GLN 18 2HE2 GLN 18 16.722 16.017 10.796 118 HE22 GLN 18 1HE2 GLN 18 17.112 16.660 12.376 119 H GLU 19 H GLU 19 24.251 17.665 13.099 120 HA GLU 19 HA GLU 19 25.134 14.976 13.976 121 HB2 GLU 19 2HB GLU 19 26.612 17.404 12.875 122 HB3 GLU 19 3HB GLU 19 27.403 15.922 13.406 123 HG2 GLU 19 2HG GLU 19 25.392 16.151 11.128 124 HG3 GLU 19 3HG GLU 19 27.134 15.957 10.968 125 H ALA 20 H ALA 20 25.093 18.373 15.090 126 HA ALA 20 HA ALA 20 26.909 17.881 17.326 127 HB1 ALA 20 1HB ALA 20 25.247 20.291 16.550 128 HB2 ALA 20 2HB ALA 20 26.540 20.259 17.767 129 HB3 ALA 20 3HB ALA 20 26.934 19.990 16.059 130 H ARG 21 H ARG 21 23.411 17.730 16.873 131 HA ARG 21 HA ARG 21 22.599 18.316 19.508 132 HB2 ARG 21 2HB ARG 21 20.576 17.014 18.930 133 HB3 ARG 21 3HB ARG 21 21.021 18.259 17.751 134 HG2 ARG 21 2HG ARG 21 21.868 16.586 16.217 135 HG3 ARG 21 3HG ARG 21 21.646 15.297 17.402 136 HD2 ARG 21 2HD ARG 21 19.882 15.276 15.695 137 HD3 ARG 21 3HD ARG 21 19.229 15.543 17.322 138 HE ARG 21 HE ARG 21 19.680 18.074 16.153 139 HH11 ARG 21 1HH1 ARG 21 17.500 15.313 15.583 140 HH12 ARG 21 2HH1 ARG 21 16.246 16.342 14.923 141 HH21 ARG 21 2HH2 ARG 21 16.535 18.588 14.792 142 HH22 ARG 21 1HH2 ARG 21 18.049 19.323 15.274 143 H LEU 22 H LEU 22 22.021 17.056 21.220 144 HA LEU 22 HA LEU 22 23.583 14.574 21.631 145 HB2 LEU 22 2HB LEU 22 22.145 16.521 23.478 146 HB3 LEU 22 3HB LEU 22 22.916 15.046 24.055 147 HG LEU 22 HG LEU 22 24.460 17.206 22.535 148 HD11 LEU 22 1HD1 LEU 22 25.263 17.911 24.774 149 HD12 LEU 22 2HD1 LEU 22 24.074 16.824 25.523 150 HD13 LEU 22 3HD1 LEU 22 23.539 18.207 24.534 151 HD21 LEU 22 3HD2 LEU 22 26.414 16.115 23.651 152 HD22 LEU 22 1HD2 LEU 22 25.581 15.018 22.547 153 HD23 LEU 22 2HD2 LEU 22 25.334 14.871 24.306 154 H SER 23 H SER 23 22.451 12.982 23.128 155 HA SER 23 HA SER 23 20.131 11.928 21.774 156 HB2 SER 23 2HB SER 23 22.098 10.654 22.773 157 HB3 SER 23 3HB SER 23 21.406 10.985 24.370 158 HG SER 23 HG SER 23 20.181 9.602 22.204 159 H TYR 24 H TYR 24 20.341 14.285 24.188 160 HA TYR 24 HA TYR 24 18.177 13.411 25.905 161 HB2 TYR 24 2HB TYR 24 19.703 16.032 25.822 162 HB3 TYR 24 3HB TYR 24 18.763 15.408 27.173 163 HD1 TYR 24 HD1 TYR 24 21.984 16.022 26.361 164 HD2 TYR 24 HD2 TYR 24 19.554 12.660 27.564 165 HE1 TYR 24 HE1 TYR 24 24.000 14.868 27.230 166 HE2 TYR 24 HE2 TYR 24 21.560 11.523 28.453 167 HH TYR 24 HH TYR 24 23.824 11.649 28.791 168 H GLY 25 H GLY 25 16.684 15.337 26.635 169 HA2 GLY 25 2HA GLY 25 15.353 16.663 24.320 170 HA3 GLY 25 3HA GLY 25 14.446 15.647 25.446 171 H GLY 26 H GLY 26 17.117 17.816 26.370 172 HA2 GLY 26 2HA GLY 26 15.563 19.036 28.474 173 HA3 GLY 26 3HA GLY 26 17.235 19.377 28.063 174 H CYS 27 H CYS 27 15.477 19.842 25.226 175 HA CYS 27 HA CYS 27 14.672 22.634 25.854 176 HB2 CYS 27 2HB CYS 27 16.269 21.622 23.489 177 HB3 CYS 27 3HB CYS 27 15.488 23.189 23.535 178 H SER 28 H SER 28 13.327 23.448 23.884 179 HA SER 28 HA SER 28 11.098 21.512 23.631 180 HB2 SER 28 2HB SER 28 9.702 23.409 23.171 181 HB3 SER 28 3HB SER 28 10.633 23.706 24.648 182 HG SER 28 HG SER 28 10.587 25.507 23.225 183 H THR 29 H THR 29 13.661 22.798 21.752 184 HA THR 29 HA THR 29 12.475 21.612 19.310 185 HB THR 29 HB THR 29 13.634 23.326 17.951 186 HG1 THR 29 1HG THR 29 13.786 24.884 20.300 187 HG21 THR 29 1HG2 THR 29 11.211 23.516 18.454 188 HG22 THR 29 2HG2 THR 29 11.981 25.111 18.294 189 HG23 THR 29 3HG2 THR 29 11.600 24.466 19.908 190 H VAL 30 H VAL 30 15.605 22.894 20.587 191 HA VAL 30 HA VAL 30 16.902 20.325 20.109 192 HB VAL 30 HB VAL 30 18.637 21.138 18.627 193 HG11 VAL 30 1HG1 VAL 30 16.651 20.171 17.532 194 HG12 VAL 30 2HG1 VAL 30 15.985 21.811 17.313 195 HG13 VAL 30 3HG1 VAL 30 17.500 21.352 16.522 196 HG21 VAL 30 3HG2 VAL 30 18.776 23.485 19.221 197 HG22 VAL 30 1HG2 VAL 30 18.550 23.310 17.491 198 HG23 VAL 30 2HG2 VAL 30 17.172 23.800 18.505 199 H CYS 31 H CYS 31 19.067 20.239 20.878 200 HA CYS 31 HA CYS 31 20.071 22.441 22.599 201 HB2 CYS 31 2HB CYS 31 18.898 20.696 23.965 202 HB3 CYS 31 3HB CYS 31 19.982 19.484 23.274 203 H CYS 32 H CYS 32 22.384 22.499 22.654 204 HA CYS 32 HA CYS 32 23.841 20.659 20.830 205 HB2 CYS 32 2HB CYS 32 23.309 23.483 20.367 206 HB3 CYS 32 3HB CYS 32 25.021 23.241 20.626 207 H ASP 33 H ASP 33 26.001 20.329 21.271 208 HA ASP 33 HA ASP 33 26.493 20.382 24.107 209 HB2 ASP 33 2HB ASP 33 28.013 18.616 23.697 210 HB3 ASP 33 3HB ASP 33 26.530 18.338 22.806 211 H LEU 34 H LEU 34 26.980 22.678 24.323 212 HA LEU 34 HA LEU 34 29.379 23.778 23.217 213 HB2 LEU 34 2HB LEU 34 28.974 25.684 24.628 214 HB3 LEU 34 3HB LEU 34 27.556 25.158 23.746 215 HG LEU 34 HG LEU 34 26.745 24.044 25.897 216 HD11 LEU 34 1HD1 LEU 34 28.814 24.049 27.256 217 HD12 LEU 34 2HD1 LEU 34 27.579 25.036 28.027 218 HD13 LEU 34 3HD1 LEU 34 28.906 25.817 27.140 219 HD21 LEU 34 3HD2 LEU 34 25.880 26.199 24.983 220 HD22 LEU 34 1HD2 LEU 34 27.126 27.074 25.891 221 HD23 LEU 34 2HD2 LEU 34 25.861 26.181 26.756 222 H SER 35 H SER 35 29.190 21.407 25.525 223 HA SER 35 HA SER 35 31.221 22.126 27.398 224 HB2 SER 35 2HB SER 35 29.520 20.255 27.562 225 HB3 SER 35 3HB SER 35 30.526 19.334 26.428 226 HG SER 35 HG SER 35 30.954 18.907 28.653 227 H LYS 36 H LYS 36 31.472 21.293 24.039 228 HA LYS 36 HA LYS 36 34.135 20.233 23.921 229 HB2 LYS 36 2HB LYS 36 32.462 21.825 21.938 230 HB3 LYS 36 3HB LYS 36 34.003 21.038 21.567 231 HG2 LYS 36 2HG LYS 36 33.051 18.831 22.088 232 HG3 LYS 36 3HG LYS 36 31.529 19.573 22.576 233 HD2 LYS 36 2HD LYS 36 31.253 18.646 20.392 234 HD3 LYS 36 3HD LYS 36 31.154 20.398 20.272 235 HE2 LYS 36 2HE LYS 36 33.768 18.930 19.746 236 HE3 LYS 36 3HE LYS 36 32.495 18.976 18.510 237 HZ1 LYS 36 3HZ LYS 36 32.568 21.345 18.567 238 HZ2 LYS 36 1HZ LYS 36 34.044 20.702 18.194 239 HZ3 LYS 36 2HZ LYS 36 33.772 21.327 19.698 240 H LEU 37 H LEU 37 32.898 23.487 24.392 241 HA LEU 37 HA LEU 37 35.240 24.959 23.611 242 HB2 LEU 37 2HB LEU 37 32.996 25.659 25.536 243 HB3 LEU 37 3HB LEU 37 34.182 26.790 24.909 244 HG LEU 37 HG LEU 37 32.175 25.281 23.171 245 HD11 LEU 37 1HD1 LEU 37 32.162 28.181 24.128 246 HD12 LEU 37 2HD1 LEU 37 31.082 26.899 24.710 247 HD13 LEU 37 3HD1 LEU 37 30.985 27.435 23.024 248 HD21 LEU 37 3HD2 LEU 37 32.808 26.930 21.432 249 HD22 LEU 37 1HD2 LEU 37 34.186 25.925 21.897 250 HD23 LEU 37 2HD2 LEU 37 34.062 27.590 22.507 251 H THR 38 H THR 38 34.583 23.053 26.437 252 HA THR 38 HA THR 38 36.996 24.148 27.794 253 HB THR 38 HB THR 38 34.841 24.676 28.931 254 HG1 THR 38 1HG THR 38 35.627 23.914 30.965 255 HG21 THR 38 1HG2 THR 38 33.533 22.649 28.535 256 HG22 THR 38 2HG2 THR 38 33.750 22.913 30.269 257 HG23 THR 38 3HG2 THR 38 34.710 21.672 29.446 258 H GLY 39 H GLY 39 36.113 21.723 25.880 259 HA2 GLY 39 2HA GLY 39 37.930 19.720 27.159 260 HA3 GLY 39 3HA GLY 39 36.378 19.245 26.448
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