NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type |
5754 | 1hx2 | cing | recoord | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H ASN 1 HT1 ASN 1 30.653 20.013 -12.687 2 2H ASN 1 HT2 ASN 1 31.460 18.564 -12.325 3 3H ASN 1 HT3 ASN 1 32.185 19.704 -13.354 4 HA ASN 1 HA ASN 1 32.553 21.217 -11.629 5 1HB ASN 1 HB2 ASN 1 31.666 20.807 -9.320 6 2HB ASN 1 HB1 ASN 1 30.354 20.909 -10.482 7 1HD2 ASN 1 HD21 ASN 1 29.422 18.803 -11.250 8 2HD2 ASN 1 HD22 ASN 1 29.492 17.449 -10.227 9 H PHE 2 HN PHE 2 33.963 20.892 -9.661 10 HA PHE 2 HA PHE 2 35.213 18.294 -9.268 11 1HB PHE 2 HB2 PHE 2 36.311 19.027 -11.407 12 2HB PHE 2 HB1 PHE 2 36.796 20.534 -10.644 13 HD1 PHE 2 HD1 PHE 2 37.244 16.845 -10.556 14 HD2 PHE 2 HD2 PHE 2 38.692 20.599 -9.148 15 HE1 PHE 2 HE1 PHE 2 39.242 15.741 -9.658 16 HE2 PHE 2 HE2 PHE 2 40.682 19.495 -8.255 17 HZ PHE 2 HZ PHE 2 40.962 17.056 -8.505 18 H VAL 3 HN VAL 3 35.529 18.286 -7.198 19 HA VAL 3 HA VAL 3 36.587 20.696 -5.758 20 HB VAL 3 HB VAL 3 34.341 18.846 -4.792 21 1HG1 VAL 3 HG11 VAL 3 35.500 21.375 -3.534 22 2HG1 VAL 3 HG12 VAL 3 35.738 19.745 -2.930 23 3HG1 VAL 3 HG13 VAL 3 34.139 20.457 -2.908 24 1HG2 VAL 3 HG21 VAL 3 32.867 20.837 -5.025 25 2HG2 VAL 3 HG22 VAL 3 33.541 20.385 -6.578 26 3HG2 VAL 3 HG23 VAL 3 34.202 21.756 -5.702 27 H CYS 4 HN CYS 4 37.929 20.365 -4.234 28 HA CYS 4 HA CYS 4 39.445 17.882 -4.155 29 1HB CYS 4 HB2 CYS 4 39.603 20.448 -2.673 30 2HB CYS 4 HB1 CYS 4 40.839 19.236 -2.543 31 HA PRO 5 HA PRO 5 38.170 17.326 0.291 32 1HB PRO 5 HB2 PRO 5 40.631 16.200 1.138 33 2HB PRO 5 HB1 PRO 5 39.171 15.352 0.753 34 1HG PRO 5 HG2 PRO 5 41.494 15.137 -0.757 35 2HG PRO 5 HG1 PRO 5 39.871 14.753 -1.354 36 1HD PRO 5 HD2 PRO 5 41.444 17.292 -1.670 37 2HD PRO 5 HD1 PRO 5 40.512 16.430 -2.902 38 HA PRO 6 HA PRO 6 40.006 20.573 2.750 39 1HB PRO 6 HB2 PRO 6 40.897 19.113 4.961 40 2HB PRO 6 HB1 PRO 6 39.262 19.687 4.731 41 1HG PRO 6 HG2 PRO 6 40.380 16.987 3.978 42 2HG PRO 6 HG1 PRO 6 38.893 17.341 4.870 43 1HD PRO 6 HD2 PRO 6 38.721 16.747 2.408 44 2HD PRO 6 HD1 PRO 6 37.845 18.190 2.920 45 H GLY 7 HN GLY 7 41.965 21.527 2.958 46 1HA GLY 7 HA2 GLY 7 44.305 21.753 3.111 47 2HA GLY 7 HA1 GLY 7 44.448 20.010 3.130 48 H GLN 8 HN GLN 8 42.729 20.179 0.477 49 HA GLN 8 HA GLN 8 45.090 20.786 -1.273 50 1HB GLN 8 HB2 GLN 8 42.859 18.775 -1.804 51 2HB GLN 8 HB1 GLN 8 44.224 19.105 -2.845 52 1HG GLN 8 HG2 GLN 8 44.643 17.029 -1.739 53 2HG GLN 8 HG1 GLN 8 45.783 18.221 -1.162 54 1HE2 GLN 8 HE21 GLN 8 42.991 16.226 -0.224 55 2HE2 GLN 8 HE22 GLN 8 43.136 16.524 1.434 56 H THR 9 HN THR 9 44.808 21.832 -3.133 57 HA THR 9 HA THR 9 42.181 23.140 -3.705 58 HB THR 9 HB THR 9 43.513 25.172 -4.447 59 HG1 THR 9 HG1 THR 9 45.564 23.413 -3.585 60 1HG2 THR 9 HG21 THR 9 42.849 24.990 -1.988 61 2HG2 THR 9 HG22 THR 9 44.361 25.857 -2.237 62 3HG2 THR 9 HG23 THR 9 44.378 24.180 -1.711 63 H PHE 10 HN PHE 10 41.799 23.805 -5.844 64 HA PHE 10 HA PHE 10 42.487 21.854 -7.854 65 1HB PHE 10 HB2 PHE 10 40.328 22.957 -7.876 66 2HB PHE 10 HB1 PHE 10 41.073 24.543 -8.008 67 HD1 PHE 10 HD1 PHE 10 41.283 25.478 -10.127 68 HD2 PHE 10 HD2 PHE 10 40.980 21.238 -9.816 69 HE1 PHE 10 HE1 PHE 10 41.209 25.305 -12.569 70 HE2 PHE 10 HE2 PHE 10 40.906 21.068 -12.262 71 HZ PHE 10 HZ PHE 10 41.015 23.113 -13.639 72 H GLN 11 HN GLN 11 43.945 22.005 -9.537 73 HA GLN 11 HA GLN 11 45.522 24.445 -9.997 74 1HB GLN 11 HB2 GLN 11 46.750 21.724 -9.213 75 2HB GLN 11 HB1 GLN 11 47.680 23.114 -9.753 76 1HG GLN 11 HG2 GLN 11 46.883 24.419 -7.793 77 2HG GLN 11 HG1 GLN 11 45.923 23.051 -7.254 78 1HE2 GLN 11 HE21 GLN 11 47.256 23.693 -5.322 79 2HE2 GLN 11 HE22 GLN 11 48.707 22.860 -5.079 80 H THR 12 HN THR 12 46.147 24.599 -11.980 81 HA THR 12 HA THR 12 44.913 22.827 -13.934 82 HB THR 12 HB THR 12 46.717 25.294 -14.309 83 HG1 THR 12 HG1 THR 12 44.758 25.539 -13.105 84 1HG2 THR 12 HG21 THR 12 44.598 23.995 -16.099 85 2HG2 THR 12 HG22 THR 12 46.325 23.807 -16.379 86 3HG2 THR 12 HG23 THR 12 45.583 25.399 -16.498 87 H CYS 13 HN CYS 13 48.100 23.470 -12.661 88 HA CYS 13 HA CYS 13 49.179 21.275 -14.366 89 1HB CYS 13 HB2 CYS 13 50.233 23.446 -14.840 90 2HB CYS 13 HB1 CYS 13 50.703 23.621 -13.166 91 H ALA 14 HN ALA 14 48.672 19.628 -12.905 92 HA ALA 14 HA ALA 14 50.684 19.280 -10.875 93 1HB ALA 14 HB1 ALA 14 47.746 19.647 -10.064 94 2HB ALA 14 HB2 ALA 14 49.051 20.754 -9.671 95 3HB ALA 14 HB3 ALA 14 49.006 19.159 -8.942 96 H SER 15 HN SER 15 51.282 17.537 -11.710 97 HA SER 15 HA SER 15 49.981 15.342 -12.734 98 1HB SER 15 HB2 SER 15 52.434 15.759 -12.788 99 2HB SER 15 HB1 SER 15 52.512 15.302 -11.105 100 HG SER 15 HG SER 15 52.376 13.704 -13.240 101 H SER 16 HN SER 16 49.796 13.174 -11.983 102 HA SER 16 HA SER 16 48.367 12.961 -9.427 103 1HB SER 16 HB2 SER 16 48.909 10.910 -11.640 104 2HB SER 16 HB1 SER 16 47.816 10.653 -10.271 105 HG SER 16 HG SER 16 47.514 13.035 -11.651 106 H CYS 17 HN CYS 17 51.285 13.403 -9.493 107 HA CYS 17 HA CYS 17 52.260 10.993 -8.020 108 1HB CYS 17 HB2 CYS 17 54.525 11.942 -8.637 109 2HB CYS 17 HB1 CYS 17 53.565 11.273 -9.919 110 HA PRO 18 HA PRO 18 51.162 14.623 -5.388 111 1HB PRO 18 HB2 PRO 18 50.290 13.287 -3.176 112 2HB PRO 18 HB1 PRO 18 49.313 13.482 -4.608 113 1HG PRO 18 HG2 PRO 18 51.030 11.147 -3.857 114 2HG PRO 18 HG1 PRO 18 49.338 11.161 -4.398 115 1HD PRO 18 HD2 PRO 18 51.256 10.598 -6.109 116 2HD PRO 18 HD1 PRO 18 49.899 11.643 -6.592 117 H LYS 19 HN LYS 19 52.069 15.699 -3.699 118 HA LYS 19 HA LYS 19 54.626 14.599 -2.693 119 1HB LYS 19 HB2 LYS 19 55.083 16.916 -1.891 120 2HB LYS 19 HB1 LYS 19 54.708 16.917 -3.600 121 1HG LYS 19 HG2 LYS 19 52.407 17.632 -3.112 122 2HG LYS 19 HG1 LYS 19 52.718 17.551 -1.392 123 1HD LYS 19 HD2 LYS 19 54.389 19.305 -1.516 124 2HD LYS 19 HD1 LYS 19 54.330 19.342 -3.248 125 1HE LYS 19 HE2 LYS 19 51.896 19.999 -3.067 126 2HE LYS 19 HE1 LYS 19 52.056 19.958 -1.320 127 1HZ LYS 19 HZ1 LYS 19 54.094 21.569 -2.392 128 2HZ LYS 19 HZ2 LYS 19 52.818 22.017 -1.363 129 3HZ LYS 19 HZ3 LYS 19 52.610 22.065 -3.047 130 H THR 20 HN THR 20 55.028 14.554 -0.551 131 HA THR 20 HA THR 20 52.852 14.905 1.429 132 HB THR 20 HB THR 20 53.176 12.561 2.302 133 HG1 THR 20 HG1 THR 20 55.133 12.690 0.271 134 1HG2 THR 20 HG21 THR 20 52.966 12.439 -0.785 135 2HG2 THR 20 HG22 THR 20 51.585 12.771 0.241 136 3HG2 THR 20 HG23 THR 20 52.395 11.225 0.329 137 H CYS 21 HN CYS 21 53.919 14.085 3.684 138 HA CYS 21 HA CYS 21 55.975 15.961 4.274 139 1HB CYS 21 HB2 CYS 21 55.210 13.410 5.698 140 2HB CYS 21 HB1 CYS 21 56.330 14.567 6.348 141 H GLU 22 HN GLU 22 56.049 12.834 2.925 142 HA GLU 22 HA GLU 22 58.753 12.064 3.488 143 1HB GLU 22 HB2 GLU 22 57.006 10.529 2.542 144 2HB GLU 22 HB1 GLU 22 57.043 11.437 1.041 145 1HG GLU 22 HG2 GLU 22 59.465 10.853 0.748 146 2HG GLU 22 HG1 GLU 22 59.398 9.906 2.227 147 H THR 23 HN THR 23 57.284 13.783 0.757 148 HA THR 23 HA THR 23 59.868 14.404 -0.492 149 HB THR 23 HB THR 23 58.441 15.624 -2.169 150 HG1 THR 23 HG1 THR 23 56.725 16.303 -1.125 151 1HG2 THR 23 HG21 THR 23 57.168 13.653 -2.970 152 2HG2 THR 23 HG22 THR 23 57.268 12.900 -1.384 153 3HG2 THR 23 HG23 THR 23 58.719 13.085 -2.363 154 H ARG 24 HN ARG 24 57.283 16.757 0.188 155 HA ARG 24 HA ARG 24 57.343 18.924 0.977 156 1HB ARG 24 HB2 ARG 24 59.909 17.964 2.298 157 2HB ARG 24 HB1 ARG 24 59.145 19.504 2.591 158 1HG ARG 24 HG2 ARG 24 57.093 18.388 3.358 159 2HG ARG 24 HG1 ARG 24 57.746 16.817 2.924 160 1HD ARG 24 HD2 ARG 24 58.907 18.639 5.088 161 2HD ARG 24 HD1 ARG 24 57.884 17.239 5.395 162 HE ARG 24 HE ARG 24 59.967 16.286 3.814 163 1HH1 ARG 24 HH11 ARG 24 59.629 17.924 6.848 164 2HH1 ARG 24 HH12 ARG 24 61.056 17.212 7.522 165 1HH2 ARG 24 HH21 ARG 24 61.776 15.371 4.644 166 2HH2 ARG 24 HH22 ARG 24 62.293 15.742 6.255 167 H ASN 25 HN ASN 25 59.611 17.771 -0.963 168 HA ASN 25 HA ASN 25 61.346 19.962 -1.393 169 1HB ASN 25 HB2 ASN 25 60.619 17.627 -3.210 170 2HB ASN 25 HB1 ASN 25 62.045 18.622 -3.385 171 1HD2 ASN 25 HD21 ASN 25 62.365 18.723 -0.331 172 2HD2 ASN 25 HD22 ASN 25 63.033 17.209 0.048 173 H LYS 26 HN LYS 26 58.272 19.120 -2.985 174 HA LYS 26 HA LYS 26 58.527 21.465 -4.762 175 1HB LYS 26 HB2 LYS 26 56.546 19.144 -4.840 176 2HB LYS 26 HB1 LYS 26 56.518 20.508 -5.922 177 1HG LYS 26 HG2 LYS 26 57.548 18.678 -7.085 178 2HG LYS 26 HG1 LYS 26 58.756 19.900 -6.793 179 1HD LYS 26 HD2 LYS 26 59.674 17.657 -6.434 180 2HD LYS 26 HD1 LYS 26 59.712 18.556 -4.943 181 1HE LYS 26 HE2 LYS 26 57.634 17.366 -4.192 182 2HE LYS 26 HE1 LYS 26 57.564 16.521 -5.733 183 1HZ LYS 26 HZ1 LYS 26 58.592 15.047 -4.322 184 2HZ LYS 26 HZ2 LYS 26 59.523 16.241 -3.557 185 3HZ LYS 26 HZ3 LYS 26 59.904 15.754 -5.138 186 H LEU 27 HN LEU 27 57.118 22.930 -4.804 187 HA LEU 27 HA LEU 27 55.274 23.324 -2.488 188 1HB LEU 27 HB2 LEU 27 56.380 25.376 -4.479 189 2HB LEU 27 HB1 LEU 27 55.416 25.756 -3.067 190 HG LEU 27 HG LEU 27 58.186 24.453 -2.995 191 1HD1 LEU 27 HD11 LEU 27 58.924 26.643 -2.079 192 2HD1 LEU 27 HD12 LEU 27 57.302 27.285 -2.285 193 3HD1 LEU 27 HD13 LEU 27 58.255 26.836 -3.690 194 1HD2 LEU 27 HD21 LEU 27 58.064 24.850 -0.544 195 2HD2 LEU 27 HD22 LEU 27 56.755 23.797 -1.037 196 3HD2 LEU 27 HD23 LEU 27 56.440 25.494 -0.714 197 H VAL 28 HN VAL 28 54.738 21.765 -4.530 198 HA VAL 28 HA VAL 28 51.998 22.434 -5.293 199 HB VAL 28 HB VAL 28 52.335 21.781 -7.693 200 1HG1 VAL 28 HG11 VAL 28 52.124 24.236 -7.117 201 2HG1 VAL 28 HG12 VAL 28 53.206 24.030 -8.482 202 3HG1 VAL 28 HG13 VAL 28 53.863 24.345 -6.891 203 1HG2 VAL 28 HG21 VAL 28 54.652 22.025 -8.686 204 2HG2 VAL 28 HG22 VAL 28 54.613 20.750 -7.486 205 3HG2 VAL 28 HG23 VAL 28 55.303 22.308 -7.081 206 H LEU 29 HN LEU 29 50.886 20.642 -5.895 207 HA LEU 29 HA LEU 29 51.224 18.360 -4.586 208 1HB LEU 29 HB2 LEU 29 49.296 18.924 -5.980 209 2HB LEU 29 HB1 LEU 29 50.244 18.602 -7.412 210 HG LEU 29 HG LEU 29 50.460 16.184 -6.670 211 1HD1 LEU 29 HD11 LEU 29 48.577 17.066 -4.419 212 2HD1 LEU 29 HD12 LEU 29 50.244 16.577 -4.199 213 3HD1 LEU 29 HD13 LEU 29 49.055 15.420 -4.741 214 1HD2 LEU 29 HD21 LEU 29 47.594 17.138 -6.795 215 2HD2 LEU 29 HD22 LEU 29 48.142 15.496 -7.082 216 3HD2 LEU 29 HD23 LEU 29 48.613 16.786 -8.179 217 H CYS 30 HN CYS 30 52.513 18.947 -7.639 218 HA CYS 30 HA CYS 30 54.916 17.373 -7.346 219 1HB CYS 30 HB2 CYS 30 53.041 15.644 -7.763 220 2HB CYS 30 HB1 CYS 30 52.895 16.348 -9.341 221 H ASP 31 HN ASP 31 55.985 17.284 -9.732 222 HA ASP 31 HA ASP 31 55.101 19.715 -11.230 223 1HB ASP 31 HB2 ASP 31 56.844 20.343 -9.619 224 2HB ASP 31 HB1 ASP 31 57.929 19.146 -10.288 225 H LYS 32 HN LYS 32 56.445 16.571 -11.514 226 HA LYS 32 HA LYS 32 57.660 16.866 -14.084 227 1HB LYS 32 HB2 LYS 32 57.508 14.388 -14.216 228 2HB LYS 32 HB1 LYS 32 58.141 14.964 -12.703 229 1HG LYS 32 HG2 LYS 32 56.685 13.121 -12.218 230 2HG LYS 32 HG1 LYS 32 55.950 14.581 -11.613 231 1HD LYS 32 HD2 LYS 32 54.301 13.095 -12.662 232 2HD LYS 32 HD1 LYS 32 54.367 14.616 -13.507 233 1HE LYS 32 HE2 LYS 32 55.827 13.490 -15.253 234 2HE LYS 32 HE1 LYS 32 55.715 11.997 -14.334 235 1HZ LYS 32 HZ1 LYS 32 53.964 12.952 -16.241 236 2HZ LYS 32 HZ2 LYS 32 53.139 13.047 -14.760 237 3HZ LYS 32 HZ3 LYS 32 53.793 11.567 -15.274 238 H LYS 33 HN LYS 33 54.422 17.222 -13.426 239 HA LYS 33 HA LYS 33 53.704 17.359 -16.227 240 1HB LYS 33 HB2 LYS 33 53.540 14.936 -16.014 241 2HB LYS 33 HB1 LYS 33 52.526 15.043 -14.595 242 1HG LYS 33 HG2 LYS 33 50.782 16.121 -15.847 243 2HG LYS 33 HG1 LYS 33 51.766 16.209 -17.291 244 1HD LYS 33 HD2 LYS 33 51.867 13.626 -17.208 245 2HD LYS 33 HD1 LYS 33 50.737 13.688 -15.867 246 1HE LYS 33 HE2 LYS 33 49.069 14.856 -17.368 247 2HE LYS 33 HE1 LYS 33 50.223 14.735 -18.682 248 1HZ LYS 33 HZ1 LYS 33 49.033 12.465 -17.208 249 2HZ LYS 33 HZ2 LYS 33 50.183 12.336 -18.452 250 3HZ LYS 33 HZ3 LYS 33 48.639 12.964 -18.783 251 H CYS 34 HN CYS 34 51.807 18.201 -16.694 252 HA CYS 34 HA CYS 34 50.563 19.747 -14.515 253 1HB CYS 34 HB2 CYS 34 50.643 20.144 -17.445 254 2HB CYS 34 HB1 CYS 34 49.698 21.150 -16.395 255 H ASN 35 HN ASN 35 49.199 18.106 -13.891 256 HA ASN 35 HA ASN 35 46.876 17.425 -15.669 257 1HB ASN 35 HB2 ASN 35 47.157 16.601 -12.742 258 2HB ASN 35 HB1 ASN 35 46.007 16.017 -13.907 259 1HD2 ASN 35 HD21 ASN 35 47.295 14.063 -12.717 260 2HD2 ASN 35 HD22 ASN 35 48.506 13.387 -13.697 261 H GLN 36 HN GLN 36 44.936 18.369 -15.489 262 HA GLN 36 HA GLN 36 44.603 20.667 -13.622 263 1HB GLN 36 HB2 GLN 36 44.207 20.923 -16.100 264 2HB GLN 36 HB1 GLN 36 42.964 19.689 -16.024 265 1HG GLN 36 HG2 GLN 36 41.629 21.121 -14.492 266 2HG GLN 36 HG1 GLN 36 42.894 22.343 -14.526 267 1HE2 GLN 36 HE21 GLN 36 42.601 23.936 -16.066 268 2HE2 GLN 36 HE22 GLN 36 41.645 23.785 -17.461 269 H ARG 37 HN ARG 37 44.544 19.242 -11.904 270 HA ARG 37 HA ARG 37 41.808 18.309 -11.182 271 1HB ARG 37 HB2 ARG 37 44.410 16.811 -10.633 272 2HB ARG 37 HB1 ARG 37 42.816 16.264 -10.141 273 1HG ARG 37 HG2 ARG 37 42.142 15.981 -12.502 274 2HG ARG 37 HG1 ARG 37 43.725 16.522 -13.032 275 1HD ARG 37 HD2 ARG 37 43.220 14.046 -11.307 276 2HD ARG 37 HD1 ARG 37 43.628 14.050 -13.014 277 HE ARG 37 HE ARG 37 45.842 14.764 -12.499 278 1HH1 ARG 37 HH11 ARG 37 43.889 14.437 -9.641 279 2HH1 ARG 37 HH12 ARG 37 45.261 14.480 -8.588 280 1HH2 ARG 37 HH21 ARG 37 47.552 14.825 -11.190 281 2HH2 ARG 37 HH22 ARG 37 47.363 14.709 -9.472 282 H CYS 38 HN CYS 38 42.908 17.379 -8.622 283 HA CYS 38 HA CYS 38 43.257 20.075 -7.408 284 1HB CYS 38 HB2 CYS 38 41.491 18.501 -6.502 285 2HB CYS 38 HB1 CYS 38 42.778 17.423 -6.011 286 H GLY 39 HN GLY 39 44.677 19.920 -5.318 287 1HA GLY 39 HA2 GLY 39 46.895 18.219 -5.080 288 2HA GLY 39 HA1 GLY 39 47.380 19.564 -6.129 289 H CYS 40 HN CYS 40 48.104 18.775 -3.280 290 HA CYS 40 HA CYS 40 47.147 20.286 -1.251 291 1HB CYS 40 HB2 CYS 40 50.034 19.835 -1.916 292 2HB CYS 40 HB1 CYS 40 49.500 20.472 -0.402 293 H ILE 41 HN ILE 41 47.897 22.090 -0.122 294 HA ILE 41 HA ILE 41 47.698 24.507 -1.670 295 HB ILE 41 HB ILE 41 49.048 24.538 1.043 296 1HG1 ILE 41 HG12 ILE 41 47.151 23.022 1.492 297 2HG1 ILE 41 HG11 ILE 41 46.833 24.580 2.206 298 1HG2 ILE 41 HG21 ILE 41 48.751 26.636 -0.172 299 2HG2 ILE 41 HG22 ILE 41 47.745 26.637 1.266 300 3HG2 ILE 41 HG23 ILE 41 47.029 26.348 -0.313 301 1HD1 ILE 41 HD11 ILE 41 45.361 25.175 0.280 302 2HD1 ILE 41 HD12 ILE 41 44.820 23.719 1.091 303 3HD1 ILE 41 HD13 ILE 41 45.713 23.592 -0.414 304 H SER 42 HN SER 42 49.347 26.053 -1.991 305 HA SER 42 HA SER 42 51.935 24.870 -2.699 306 1HB SER 42 HB2 SER 42 50.863 26.611 -4.200 307 2HB SER 42 HB1 SER 42 50.975 27.801 -2.893 308 HG SER 42 HG SER 42 53.214 27.480 -2.877 309 H GLY 43 HN GLY 43 52.703 24.263 -0.791 310 1HA GLY 43 HA2 GLY 43 54.629 25.424 0.604 311 2HA GLY 43 HA1 GLY 43 53.250 26.221 1.371 312 H THR 44 HN THR 44 51.738 23.631 0.702 313 HA THR 44 HA THR 44 52.512 22.185 3.187 314 HB THR 44 HB THR 44 50.168 21.211 3.071 315 HG1 THR 44 HG1 THR 44 50.411 21.837 0.593 316 1HG2 THR 44 HG21 THR 44 50.194 24.229 2.705 317 2HG2 THR 44 HG22 THR 44 50.478 23.389 4.221 318 3HG2 THR 44 HG23 THR 44 48.910 23.272 3.437 319 H VAL 45 HN VAL 45 51.457 19.843 2.866 320 HA VAL 45 HA VAL 45 52.219 18.431 0.450 321 HB VAL 45 HB VAL 45 53.717 16.825 1.731 322 1HG1 VAL 45 HG11 VAL 45 54.832 19.632 1.562 323 2HG1 VAL 45 HG12 VAL 45 54.775 18.443 0.261 324 3HG1 VAL 45 HG13 VAL 45 55.727 18.125 1.695 325 1HG2 VAL 45 HG21 VAL 45 54.858 17.636 3.791 326 2HG2 VAL 45 HG22 VAL 45 53.139 17.507 4.088 327 3HG2 VAL 45 HG23 VAL 45 53.878 19.074 3.780 328 H LEU 46 HN LEU 46 51.019 16.622 0.285 329 HA LEU 46 HA LEU 46 48.792 16.204 2.008 330 1HB LEU 46 HB2 LEU 46 48.978 15.472 -0.428 331 2HB LEU 46 HB1 LEU 46 50.091 14.222 0.065 332 HG LEU 46 HG LEU 46 48.302 13.225 1.517 333 1HD1 LEU 46 HD11 LEU 46 46.534 15.306 0.144 334 2HD1 LEU 46 HD12 LEU 46 46.925 15.294 1.855 335 3HD1 LEU 46 HD13 LEU 46 45.953 14.014 1.170 336 1HD2 LEU 46 HD21 LEU 46 46.994 12.281 -0.376 337 2HD2 LEU 46 HD22 LEU 46 48.700 12.374 -0.776 338 3HD2 LEU 46 HD23 LEU 46 47.580 13.560 -1.427 339 H LYS 47 HN LYS 47 49.314 15.913 4.054 340 HA LYS 47 HA LYS 47 51.009 15.154 5.745 341 1HB LYS 47 HB2 LYS 47 48.638 15.162 6.282 342 2HB LYS 47 HB1 LYS 47 48.414 13.610 5.514 343 1HG LYS 47 HG2 LYS 47 49.909 12.554 7.198 344 2HG LYS 47 HG1 LYS 47 50.152 14.119 7.957 345 1HD LYS 47 HD2 LYS 47 47.696 14.254 8.414 346 2HD LYS 47 HD1 LYS 47 47.470 12.693 7.643 347 1HE LYS 47 HE2 LYS 47 48.952 11.635 9.343 348 2HE LYS 47 HE1 LYS 47 49.180 13.198 10.117 349 1HZ LYS 47 HZ1 LYS 47 47.486 11.903 11.212 350 2HZ LYS 47 HZ2 LYS 47 46.590 11.804 9.772 351 3HZ LYS 47 HZ3 LYS 47 46.817 13.307 10.530 352 H SER 48 HN SER 48 49.650 12.352 4.074 353 HA SER 48 HA SER 48 52.298 10.971 4.329 354 1HB SER 48 HB2 SER 48 49.528 9.737 4.867 355 2HB SER 48 HB1 SER 48 51.064 8.855 4.928 356 HG SER 48 HG SER 48 50.007 10.712 6.667 357 H LYS 49 HN LYS 49 52.196 8.908 3.140 358 HA LYS 49 HA LYS 49 52.589 9.171 0.489 359 1HB LYS 49 HB2 LYS 49 51.242 6.781 1.791 360 2HB LYS 49 HB1 LYS 49 52.051 6.734 0.244 361 1HG LYS 49 HG2 LYS 49 53.349 7.366 2.942 362 2HG LYS 49 HG1 LYS 49 53.519 5.876 2.051 363 1HD LYS 49 HD2 LYS 49 54.543 8.604 1.127 364 2HD LYS 49 HD1 LYS 49 55.507 7.298 1.772 365 1HE LYS 49 HE2 LYS 49 54.875 5.840 -0.136 366 2HE LYS 49 HE1 LYS 49 53.891 7.135 -0.807 367 1HZ LYS 49 HZ1 LYS 49 55.962 8.511 -0.771 368 2HZ LYS 49 HZ2 LYS 49 55.919 7.242 -1.899 369 3HZ LYS 49 HZ3 LYS 49 56.815 7.077 -0.466 370 H ASP 50 HN ASP 50 49.474 8.997 1.941 371 HA ASP 50 HA ASP 50 48.169 10.047 -0.410 372 1HB ASP 50 HB2 ASP 50 48.450 7.642 -1.152 373 2HB ASP 50 HB1 ASP 50 47.591 7.110 0.279 374 H SER 51 HN SER 51 48.086 11.211 1.863 375 HA SER 51 HA SER 51 45.891 10.356 3.613 376 1HB SER 51 HB2 SER 51 47.957 11.557 4.434 377 2HB SER 51 HB1 SER 51 47.462 12.990 3.526 378 HG SER 51 HG SER 51 45.420 11.985 4.992 379 H SER 52 HN SER 52 44.796 13.048 3.963 380 HA SER 52 HA SER 52 43.516 13.778 1.418 381 1HB SER 52 HB2 SER 52 41.928 12.804 3.866 382 2HB SER 52 HB1 SER 52 41.211 13.488 2.398 383 HG SER 52 HG SER 52 42.849 11.187 2.605 384 H GLU 53 HN GLU 53 45.342 14.859 3.519 385 HA GLU 53 HA GLU 53 44.174 17.543 3.710 386 1HB GLU 53 HB2 GLU 53 43.400 16.161 5.818 387 2HB GLU 53 HB1 GLU 53 45.086 16.160 6.283 388 1HG GLU 53 HG2 GLU 53 43.323 18.613 5.879 389 2HG GLU 53 HG1 GLU 53 43.914 18.006 7.409 390 H CYS 54 HN CYS 54 45.841 18.908 3.409 391 HA CYS 54 HA CYS 54 48.581 17.772 3.435 392 1HB CYS 54 HB2 CYS 54 47.570 20.305 2.169 393 2HB CYS 54 HB1 CYS 54 49.140 19.584 1.947 394 H VAL 55 HN VAL 55 49.962 18.306 4.826 395 HA VAL 55 HA VAL 55 49.646 20.654 6.641 396 HB VAL 55 HB VAL 55 51.235 19.311 8.151 397 1HG1 VAL 55 HG11 VAL 55 48.710 17.806 7.290 398 2HG1 VAL 55 HG12 VAL 55 48.713 19.138 8.438 399 3HG1 VAL 55 HG13 VAL 55 49.521 17.631 8.834 400 1HG2 VAL 55 HG21 VAL 55 50.750 17.148 6.088 401 2HG2 VAL 55 HG22 VAL 55 51.583 16.932 7.618 402 3HG2 VAL 55 HG23 VAL 55 52.279 17.956 6.374 403 H HIS 56 HN HIS 56 51.641 21.784 7.244 404 HA HIS 56 HA HIS 56 53.367 22.193 4.926 405 1HB HIS 56 HB2 HIS 56 53.446 23.357 7.726 406 2HB HIS 56 HB1 HIS 56 54.479 23.906 6.418 407 HD1 HIS 56 HD1 HIS 56 53.215 25.093 4.450 408 HD2 HIS 56 HD2 HIS 56 50.790 24.291 7.636 409 HE1 HIS 56 HE1 HIS 56 51.168 26.429 4.117 410 HA PRO 57 HA PRO 57 56.821 19.569 6.029 411 1HB PRO 57 HB2 PRO 57 58.909 21.390 5.638 412 2HB PRO 57 HB1 PRO 57 58.163 20.452 4.372 413 1HG PRO 57 HG2 PRO 57 57.598 23.264 5.182 414 2HG PRO 57 HG1 PRO 57 57.740 22.568 3.558 415 1HD PRO 57 HD2 PRO 57 55.376 23.104 4.607 416 2HD PRO 57 HD1 PRO 57 55.609 21.636 3.637 417 H SER 58 HN SER 58 56.496 22.764 7.335 418 HA SER 58 HA SER 58 58.299 22.525 9.555 419 1HB SER 58 HB2 SER 58 57.098 24.601 10.371 420 2HB SER 58 HB1 SER 58 57.521 24.729 8.657 421 HG SER 58 HG SER 58 55.389 23.705 8.305 422 H LYS 59 HN LYS 59 55.043 21.491 9.045 423 HA LYS 59 HA LYS 59 54.473 21.080 11.921 424 1HB LYS 59 HB2 LYS 59 52.906 20.101 9.506 425 2HB LYS 59 HB1 LYS 59 52.384 20.079 11.178 426 1HG LYS 59 HG2 LYS 59 52.357 22.534 11.223 427 2HG LYS 59 HG1 LYS 59 52.981 22.590 9.585 428 1HD LYS 59 HD2 LYS 59 50.570 22.815 9.415 429 2HD LYS 59 HD1 LYS 59 51.013 21.222 8.849 430 1HE LYS 59 HE2 LYS 59 49.002 21.129 10.295 431 2HE LYS 59 HE1 LYS 59 50.311 20.171 10.954 432 1HZ LYS 59 HZ1 LYS 59 49.821 22.975 11.753 433 2HZ LYS 59 HZ2 LYS 59 50.790 21.819 12.532 434 3HZ LYS 59 HZ3 LYS 59 49.100 21.654 12.541 435 H CYS 60 HN CYS 60 54.797 19.280 8.970 436 HA CYS 60 HA CYS 60 54.558 16.726 9.697 437 1HB CYS 60 HB2 CYS 60 56.603 17.949 7.867 438 2HB CYS 60 HB1 CYS 60 56.448 16.231 7.989 Start of MODEL 2 1 1H ASN 1 HT1 ASN 1 38.218 21.605 -13.615 2 2H ASN 1 HT2 ASN 1 37.075 22.783 -14.057 3 3H ASN 1 HT3 ASN 1 36.675 21.133 -14.145 4 HA ASN 1 HA ASN 1 37.222 22.690 -11.685 5 1HB ASN 1 HB2 ASN 1 34.677 21.334 -12.716 6 2HB ASN 1 HB1 ASN 1 34.828 22.158 -11.168 7 1HD2 ASN 1 HD21 ASN 1 34.996 24.500 -11.182 8 2HD2 ASN 1 HD22 ASN 1 34.624 25.407 -12.568 9 H PHE 2 HN PHE 2 38.042 21.510 -10.118 10 HA PHE 2 HA PHE 2 37.461 18.606 -9.926 11 1HB PHE 2 HB2 PHE 2 40.239 19.836 -9.953 12 2HB PHE 2 HB1 PHE 2 39.915 18.178 -9.460 13 HD1 PHE 2 HD1 PHE 2 39.854 20.522 -12.339 14 HD2 PHE 2 HD2 PHE 2 39.251 16.501 -11.064 15 HE1 PHE 2 HE1 PHE 2 39.814 19.789 -14.669 16 HE2 PHE 2 HE2 PHE 2 39.210 15.767 -13.392 17 HZ PHE 2 HZ PHE 2 39.494 17.408 -15.213 18 H VAL 3 HN VAL 3 36.459 18.513 -8.176 19 HA VAL 3 HA VAL 3 36.780 20.163 -5.850 20 HB VAL 3 HB VAL 3 34.658 19.012 -6.459 21 1HG1 VAL 3 HG11 VAL 3 36.141 16.414 -5.832 22 2HG1 VAL 3 HG12 VAL 3 35.615 16.931 -7.424 23 3HG1 VAL 3 HG13 VAL 3 34.429 16.547 -6.193 24 1HG2 VAL 3 HG21 VAL 3 35.762 18.004 -3.806 25 2HG2 VAL 3 HG22 VAL 3 34.064 18.086 -4.243 26 3HG2 VAL 3 HG23 VAL 3 35.000 19.564 -4.077 27 H CYS 4 HN CYS 4 37.563 19.690 -3.886 28 HA CYS 4 HA CYS 4 39.651 17.566 -3.716 29 1HB CYS 4 HB2 CYS 4 39.552 20.305 -2.584 30 2HB CYS 4 HB1 CYS 4 40.761 19.168 -2.104 31 HA PRO 5 HA PRO 5 38.091 17.212 0.626 32 1HB PRO 5 HB2 PRO 5 40.538 16.081 1.553 33 2HB PRO 5 HB1 PRO 5 39.080 15.229 1.142 34 1HG PRO 5 HG2 PRO 5 41.439 14.981 -0.271 35 2HG PRO 5 HG1 PRO 5 39.838 14.638 -0.953 36 1HD PRO 5 HD2 PRO 5 41.459 17.155 -1.123 37 2HD PRO 5 HD1 PRO 5 40.629 16.316 -2.440 38 HA PRO 6 HA PRO 6 40.013 20.405 3.183 39 1HB PRO 6 HB2 PRO 6 41.008 18.853 5.308 40 2HB PRO 6 HB1 PRO 6 39.387 19.499 5.205 41 1HG PRO 6 HG2 PRO 6 40.353 16.775 4.373 42 2HG PRO 6 HG1 PRO 6 38.900 17.204 5.299 43 1HD PRO 6 HD2 PRO 6 38.664 16.609 2.810 44 2HD PRO 6 HD1 PRO 6 37.823 18.052 3.374 45 H GLY 7 HN GLY 7 42.027 21.317 3.464 46 1HA GLY 7 HA2 GLY 7 44.376 21.493 3.443 47 2HA GLY 7 HA1 GLY 7 44.466 19.745 3.376 48 H GLN 8 HN GLN 8 42.508 20.340 0.839 49 HA GLN 8 HA GLN 8 44.761 20.885 -1.042 50 1HB GLN 8 HB2 GLN 8 42.572 18.809 -1.312 51 2HB GLN 8 HB1 GLN 8 43.792 19.149 -2.525 52 1HG GLN 8 HG2 GLN 8 45.568 18.412 -0.985 53 2HG GLN 8 HG1 GLN 8 44.390 18.143 0.296 54 1HE2 GLN 8 HE21 GLN 8 44.091 15.966 0.510 55 2HE2 GLN 8 HE22 GLN 8 43.921 14.849 -0.753 56 H THR 9 HN THR 9 44.285 21.878 -2.881 57 HA THR 9 HA THR 9 41.567 22.978 -3.353 58 HB THR 9 HB THR 9 42.844 24.676 -2.029 59 HG1 THR 9 HG1 THR 9 42.706 26.314 -3.603 60 1HG2 THR 9 HG21 THR 9 45.183 23.953 -2.837 61 2HG2 THR 9 HG22 THR 9 44.902 25.678 -3.010 62 3HG2 THR 9 HG23 THR 9 44.791 24.616 -4.406 63 H PHE 10 HN PHE 10 41.867 24.376 -5.474 64 HA PHE 10 HA PHE 10 42.325 22.512 -7.598 65 1HB PHE 10 HB2 PHE 10 40.750 24.455 -7.754 66 2HB PHE 10 HB1 PHE 10 42.115 25.559 -7.737 67 HD1 PHE 10 HD1 PHE 10 40.997 22.483 -9.600 68 HD2 PHE 10 HD2 PHE 10 42.875 26.305 -9.842 69 HE1 PHE 10 HE1 PHE 10 41.201 22.234 -12.027 70 HE2 PHE 10 HE2 PHE 10 43.074 26.046 -12.272 71 HZ PHE 10 HZ PHE 10 42.238 24.011 -13.371 72 H GLN 11 HN GLN 11 43.831 22.695 -9.321 73 HA GLN 11 HA GLN 11 46.426 24.044 -8.821 74 1HB GLN 11 HB2 GLN 11 46.202 21.078 -9.535 75 2HB GLN 11 HB1 GLN 11 47.677 21.967 -9.254 76 1HG GLN 11 HG2 GLN 11 45.564 21.378 -7.138 77 2HG GLN 11 HG1 GLN 11 47.091 20.544 -7.348 78 1HE2 GLN 11 HE21 GLN 11 45.915 22.405 -5.098 79 2HE2 GLN 11 HE22 GLN 11 47.213 23.437 -4.803 80 H THR 12 HN THR 12 47.813 23.745 -10.817 81 HA THR 12 HA THR 12 46.116 23.681 -13.283 82 HB THR 12 HB THR 12 47.647 25.505 -14.192 83 HG1 THR 12 HG1 THR 12 49.415 25.021 -12.908 84 1HG2 THR 12 HG21 THR 12 45.536 26.171 -12.917 85 2HG2 THR 12 HG22 THR 12 46.838 27.337 -12.734 86 3HG2 THR 12 HG23 THR 12 46.484 26.203 -11.438 87 H CYS 13 HN CYS 13 49.438 23.321 -12.063 88 HA CYS 13 HA CYS 13 49.822 21.256 -14.169 89 1HB CYS 13 HB2 CYS 13 51.025 23.243 -14.862 90 2HB CYS 13 HB1 CYS 13 51.874 23.334 -13.339 91 H ALA 14 HN ALA 14 49.403 19.623 -12.571 92 HA ALA 14 HA ALA 14 51.878 18.800 -11.308 93 1HB ALA 14 HB1 ALA 14 50.998 20.417 -9.646 94 2HB ALA 14 HB2 ALA 14 50.957 18.796 -8.983 95 3HB ALA 14 HB3 ALA 14 49.475 19.550 -9.576 96 H SER 15 HN SER 15 52.087 16.893 -11.770 97 HA SER 15 HA SER 15 50.265 14.995 -12.648 98 1HB SER 15 HB2 SER 15 52.695 14.878 -13.016 99 2HB SER 15 HB1 SER 15 52.952 14.575 -11.326 100 HG SER 15 HG SER 15 51.167 12.990 -12.816 101 H SER 16 HN SER 16 49.919 12.852 -11.789 102 HA SER 16 HA SER 16 48.572 12.917 -9.182 103 1HB SER 16 HB2 SER 16 47.509 11.878 -11.219 104 2HB SER 16 HB1 SER 16 48.808 10.680 -11.267 105 HG SER 16 HG SER 16 48.099 9.798 -9.455 106 H CYS 17 HN CYS 17 51.535 12.985 -9.418 107 HA CYS 17 HA CYS 17 52.270 10.550 -7.856 108 1HB CYS 17 HB2 CYS 17 54.619 11.328 -8.530 109 2HB CYS 17 HB1 CYS 17 53.595 10.605 -9.731 110 HA PRO 18 HA PRO 18 51.167 14.154 -5.289 111 1HB PRO 18 HB2 PRO 18 50.929 12.803 -2.866 112 2HB PRO 18 HB1 PRO 18 49.666 12.970 -4.057 113 1HG PRO 18 HG2 PRO 18 51.589 10.714 -3.690 114 2HG PRO 18 HG1 PRO 18 49.838 10.661 -3.980 115 1HD PRO 18 HD2 PRO 18 51.467 10.192 -5.964 116 2HD PRO 18 HD1 PRO 18 50.063 11.256 -6.226 117 H LYS 19 HN LYS 19 51.960 15.477 -3.737 118 HA LYS 19 HA LYS 19 54.778 15.095 -2.940 119 1HB LYS 19 HB2 LYS 19 54.282 17.104 -4.290 120 2HB LYS 19 HB1 LYS 19 52.953 17.502 -3.211 121 1HG LYS 19 HG2 LYS 19 54.728 17.634 -1.336 122 2HG LYS 19 HG1 LYS 19 55.932 17.448 -2.580 123 1HD LYS 19 HD2 LYS 19 55.555 19.823 -1.947 124 2HD LYS 19 HD1 LYS 19 55.356 19.513 -3.659 125 1HE LYS 19 HE2 LYS 19 53.547 20.992 -2.753 126 2HE LYS 19 HE1 LYS 19 52.850 19.490 -3.328 127 1HZ LYS 19 HZ1 LYS 19 51.867 19.919 -1.339 128 2HZ LYS 19 HZ2 LYS 19 53.332 20.296 -0.563 129 3HZ LYS 19 HZ3 LYS 19 52.992 18.691 -1.023 130 H THR 20 HN THR 20 54.949 14.457 -0.933 131 HA THR 20 HA THR 20 52.882 15.242 1.057 132 HB THR 20 HB THR 20 53.157 12.904 2.055 133 HG1 THR 20 HG1 THR 20 55.112 12.921 0.020 134 1HG2 THR 20 HG21 THR 20 52.964 12.686 -1.026 135 2HG2 THR 20 HG22 THR 20 51.582 13.076 -0.026 136 3HG2 THR 20 HG23 THR 20 52.361 11.523 0.125 137 H CYS 21 HN CYS 21 53.920 14.378 3.348 138 HA CYS 21 HA CYS 21 55.957 16.293 3.950 139 1HB CYS 21 HB2 CYS 21 55.149 13.781 5.422 140 2HB CYS 21 HB1 CYS 21 56.218 14.983 6.076 141 H GLU 22 HN GLU 22 55.989 13.139 2.705 142 HA GLU 22 HA GLU 22 58.664 12.301 3.317 143 1HB GLU 22 HB2 GLU 22 56.951 11.627 0.876 144 2HB GLU 22 HB1 GLU 22 58.324 10.705 1.452 145 1HG GLU 22 HG2 GLU 22 57.166 10.185 3.566 146 2HG GLU 22 HG1 GLU 22 55.798 11.185 3.107 147 H THR 23 HN THR 23 57.212 14.034 0.604 148 HA THR 23 HA THR 23 59.808 14.542 -0.698 149 HB THR 23 HB THR 23 58.374 15.775 -2.393 150 HG1 THR 23 HG1 THR 23 56.367 14.874 -0.613 151 1HG2 THR 23 HG21 THR 23 57.105 13.812 -3.197 152 2HG2 THR 23 HG22 THR 23 57.214 13.046 -1.618 153 3HG2 THR 23 HG23 THR 23 58.659 13.246 -2.603 154 H ARG 24 HN ARG 24 57.263 16.963 -0.140 155 HA ARG 24 HA ARG 24 57.328 19.125 0.640 156 1HB ARG 24 HB2 ARG 24 59.839 18.163 2.075 157 2HB ARG 24 HB1 ARG 24 59.099 19.722 2.308 158 1HG ARG 24 HG2 ARG 24 56.978 18.632 2.988 159 2HG ARG 24 HG1 ARG 24 57.680 17.053 2.678 160 1HD ARG 24 HD2 ARG 24 58.677 19.010 4.803 161 2HD ARG 24 HD1 ARG 24 57.657 17.615 5.132 162 HE ARG 24 HE ARG 24 59.824 16.565 3.779 163 1HH1 ARG 24 HH11 ARG 24 59.369 18.533 6.596 164 2HH1 ARG 24 HH12 ARG 24 60.786 17.930 7.385 165 1HH2 ARG 24 HH21 ARG 24 61.622 15.786 4.762 166 2HH2 ARG 24 HH22 ARG 24 62.083 16.350 6.333 167 H ASN 25 HN ASN 25 59.723 17.889 -1.164 168 HA ASN 25 HA ASN 25 61.526 20.003 -1.545 169 1HB ASN 25 HB2 ASN 25 60.705 17.752 -3.430 170 2HB ASN 25 HB1 ASN 25 62.191 18.668 -3.550 171 1HD2 ASN 25 HD21 ASN 25 62.423 18.658 -0.477 172 2HD2 ASN 25 HD22 ASN 25 63.002 17.101 -0.133 173 H LYS 26 HN LYS 26 58.663 19.117 -3.543 174 HA LYS 26 HA LYS 26 58.943 21.568 -5.113 175 1HB LYS 26 HB2 LYS 26 56.882 19.297 -5.251 176 2HB LYS 26 HB1 LYS 26 56.948 20.641 -6.355 177 1HG LYS 26 HG2 LYS 26 57.941 18.749 -7.437 178 2HG LYS 26 HG1 LYS 26 59.186 19.933 -7.127 179 1HD LYS 26 HD2 LYS 26 59.984 17.655 -6.702 180 2HD LYS 26 HD1 LYS 26 60.044 18.600 -5.241 181 1HE LYS 26 HE2 LYS 26 57.879 17.521 -4.503 182 2HE LYS 26 HE1 LYS 26 57.831 16.619 -6.011 183 1HZ LYS 26 HZ1 LYS 26 59.612 16.312 -3.711 184 2HZ LYS 26 HZ2 LYS 26 60.178 15.871 -5.249 185 3HZ LYS 26 HZ3 LYS 26 58.788 15.133 -4.610 186 H LEU 27 HN LEU 27 56.774 22.509 -5.542 187 HA LEU 27 HA LEU 27 55.231 23.058 -3.040 188 1HB LEU 27 HB2 LEU 27 56.016 25.148 -5.156 189 2HB LEU 27 HB1 LEU 27 54.987 25.459 -3.783 190 HG LEU 27 HG LEU 27 56.953 24.962 -2.266 191 1HD1 LEU 27 HD11 LEU 27 59.237 25.107 -3.197 192 2HD1 LEU 27 HD12 LEU 27 58.592 25.107 -4.828 193 3HD1 LEU 27 HD13 LEU 27 58.452 23.686 -3.818 194 1HD2 LEU 27 HD21 LEU 27 58.018 27.177 -2.666 195 2HD2 LEU 27 HD22 LEU 27 56.270 27.266 -2.797 196 3HD2 LEU 27 HD23 LEU 27 57.259 27.251 -4.249 197 H VAL 28 HN VAL 28 54.776 21.336 -4.980 198 HA VAL 28 HA VAL 28 51.987 21.881 -5.767 199 HB VAL 28 HB VAL 28 52.368 21.048 -8.102 200 1HG1 VAL 28 HG11 VAL 28 53.254 23.214 -9.034 201 2HG1 VAL 28 HG12 VAL 28 53.877 23.650 -7.457 202 3HG1 VAL 28 HG13 VAL 28 52.143 23.524 -7.712 203 1HG2 VAL 28 HG21 VAL 28 54.689 21.191 -9.058 204 2HG2 VAL 28 HG22 VAL 28 54.613 20.008 -7.766 205 3HG2 VAL 28 HG23 VAL 28 55.312 21.586 -7.467 206 H LEU 29 HN LEU 29 50.849 20.052 -6.317 207 HA LEU 29 HA LEU 29 51.251 17.849 -4.773 208 1HB LEU 29 HB2 LEU 29 49.163 18.383 -5.967 209 2HB LEU 29 HB1 LEU 29 49.910 18.020 -7.496 210 HG LEU 29 HG LEU 29 50.169 15.606 -6.738 211 1HD1 LEU 29 HD11 LEU 29 48.524 16.558 -4.339 212 2HD1 LEU 29 HD12 LEU 29 50.198 16.042 -4.263 213 3HD1 LEU 29 HD13 LEU 29 48.949 14.892 -4.687 214 1HD2 LEU 29 HD21 LEU 29 47.776 15.033 -6.922 215 2HD2 LEU 29 HD22 LEU 29 48.211 16.293 -8.066 216 3HD2 LEU 29 HD23 LEU 29 47.339 16.703 -6.598 217 H CYS 30 HN CYS 30 52.546 18.457 -7.806 218 HA CYS 30 HA CYS 30 54.851 16.814 -7.602 219 1HB CYS 30 HB2 CYS 30 52.961 14.995 -7.978 220 2HB CYS 30 HB1 CYS 30 52.862 15.649 -9.579 221 H ASP 31 HN ASP 31 55.891 16.678 -9.919 222 HA ASP 31 HA ASP 31 54.986 19.023 -11.553 223 1HB ASP 31 HB2 ASP 31 56.821 19.645 -10.036 224 2HB ASP 31 HB1 ASP 31 57.824 18.365 -10.674 225 H LYS 32 HN LYS 32 55.759 15.823 -11.560 226 HA LYS 32 HA LYS 32 57.121 15.431 -14.025 227 1HB LYS 32 HB2 LYS 32 55.080 13.612 -12.682 228 2HB LYS 32 HB1 LYS 32 56.221 13.105 -13.908 229 1HG LYS 32 HG2 LYS 32 56.963 14.187 -11.154 230 2HG LYS 32 HG1 LYS 32 57.013 12.506 -11.637 231 1HD LYS 32 HD2 LYS 32 58.735 13.056 -13.370 232 2HD LYS 32 HD1 LYS 32 58.709 14.736 -12.856 233 1HE LYS 32 HE2 LYS 32 59.423 14.080 -10.579 234 2HE LYS 32 HE1 LYS 32 59.468 12.393 -11.077 235 1HZ LYS 32 HZ1 LYS 32 61.641 13.412 -11.163 236 2HZ LYS 32 HZ2 LYS 32 61.076 14.578 -12.262 237 3HZ LYS 32 HZ3 LYS 32 61.130 12.942 -12.714 238 H LYS 33 HN LYS 33 53.937 16.511 -13.575 239 HA LYS 33 HA LYS 33 53.467 16.681 -16.415 240 1HB LYS 33 HB2 LYS 33 52.755 14.255 -15.924 241 2HB LYS 33 HB1 LYS 33 51.642 14.864 -14.728 242 1HG LYS 33 HG2 LYS 33 50.263 14.469 -16.484 243 2HG LYS 33 HG1 LYS 33 50.508 16.178 -16.591 244 1HD LYS 33 HD2 LYS 33 51.672 14.036 -18.402 245 2HD LYS 33 HD1 LYS 33 50.507 15.258 -18.830 246 1HE LYS 33 HE2 LYS 33 52.548 15.916 -19.852 247 2HE LYS 33 HE1 LYS 33 52.364 16.991 -18.478 248 1HZ LYS 33 HZ1 LYS 33 54.342 14.972 -18.991 249 2HZ LYS 33 HZ2 LYS 33 53.722 14.925 -17.414 250 3HZ LYS 33 HZ3 LYS 33 54.426 16.352 -18.007 251 H CYS 34 HN CYS 34 51.694 17.955 -16.970 252 HA CYS 34 HA CYS 34 50.904 19.728 -14.760 253 1HB CYS 34 HB2 CYS 34 50.757 20.038 -17.704 254 2HB CYS 34 HB1 CYS 34 50.038 21.193 -16.624 255 H ASN 35 HN ASN 35 49.401 18.373 -13.925 256 HA ASN 35 HA ASN 35 46.816 17.970 -15.369 257 1HB ASN 35 HB2 ASN 35 47.455 17.160 -12.494 258 2HB ASN 35 HB1 ASN 35 46.093 16.653 -13.456 259 1HD2 ASN 35 HD21 ASN 35 47.525 14.664 -12.348 260 2HD2 ASN 35 HD22 ASN 35 48.462 13.854 -13.509 261 H GLN 36 HN GLN 36 45.371 19.538 -15.246 262 HA GLN 36 HA GLN 36 45.492 21.570 -13.074 263 1HB GLN 36 HB2 GLN 36 43.887 22.869 -14.538 264 2HB GLN 36 HB1 GLN 36 45.417 22.570 -15.303 265 1HG GLN 36 HG2 GLN 36 42.874 20.965 -15.883 266 2HG GLN 36 HG1 GLN 36 43.477 22.288 -16.858 267 1HE2 GLN 36 HE21 GLN 36 46.260 21.705 -16.828 268 2HE2 GLN 36 HE22 GLN 36 46.514 20.243 -17.651 269 H ARG 37 HN ARG 37 44.836 19.977 -11.675 270 HA ARG 37 HA ARG 37 41.900 19.838 -11.280 271 1HB ARG 37 HB2 ARG 37 42.083 17.381 -10.746 272 2HB ARG 37 HB1 ARG 37 42.534 17.730 -12.388 273 1HG ARG 37 HG2 ARG 37 44.920 17.742 -11.806 274 2HG ARG 37 HG1 ARG 37 44.537 17.489 -10.118 275 1HD ARG 37 HD2 ARG 37 43.544 15.279 -10.661 276 2HD ARG 37 HD1 ARG 37 43.862 15.559 -12.374 277 HE ARG 37 HE ARG 37 46.102 15.075 -11.997 278 1HH1 ARG 37 HH11 ARG 37 44.551 15.790 -8.978 279 2HH1 ARG 37 HH12 ARG 37 45.946 15.376 -8.041 280 1HH2 ARG 37 HH21 ARG 37 47.861 14.557 -10.843 281 2HH2 ARG 37 HH22 ARG 37 47.854 14.669 -9.115 282 H CYS 38 HN CYS 38 42.437 17.988 -9.015 283 HA CYS 38 HA CYS 38 43.049 20.129 -7.082 284 1HB CYS 38 HB2 CYS 38 41.185 18.587 -6.599 285 2HB CYS 38 HB1 CYS 38 42.305 17.238 -6.528 286 H GLY 39 HN GLY 39 44.374 19.780 -5.238 287 1HA GLY 39 HA2 GLY 39 46.450 17.935 -4.839 288 2HA GLY 39 HA1 GLY 39 47.129 19.235 -5.814 289 H CYS 40 HN CYS 40 48.065 18.806 -3.192 290 HA CYS 40 HA CYS 40 46.735 20.245 -1.168 291 1HB CYS 40 HB2 CYS 40 49.721 19.942 -1.556 292 2HB CYS 40 HB1 CYS 40 48.947 20.540 -0.127 293 H ILE 41 HN ILE 41 47.468 22.182 -0.151 294 HA ILE 41 HA ILE 41 47.284 24.426 -1.972 295 HB ILE 41 HB ILE 41 48.349 24.730 0.857 296 1HG1 ILE 41 HG12 ILE 41 46.430 23.211 1.220 297 2HG1 ILE 41 HG11 ILE 41 46.011 24.812 1.760 298 1HG2 ILE 41 HG21 ILE 41 48.162 26.716 -0.571 299 2HG2 ILE 41 HG22 ILE 41 47.011 26.823 0.747 300 3HG2 ILE 41 HG23 ILE 41 46.468 26.382 -0.865 301 1HD1 ILE 41 HD11 ILE 41 44.140 23.799 0.538 302 2HD1 ILE 41 HD12 ILE 41 45.155 23.570 -0.869 303 3HD1 ILE 41 HD13 ILE 41 44.725 25.196 -0.347 304 H SER 42 HN SER 42 48.962 26.005 -2.249 305 HA SER 42 HA SER 42 51.595 24.771 -2.649 306 1HB SER 42 HB2 SER 42 50.671 26.428 -4.337 307 2HB SER 42 HB1 SER 42 50.706 27.695 -3.100 308 HG SER 42 HG SER 42 52.930 27.328 -2.880 309 H GLY 43 HN GLY 43 52.176 24.274 -0.654 310 1HA GLY 43 HA2 GLY 43 53.997 25.529 0.824 311 2HA GLY 43 HA1 GLY 43 52.541 26.314 1.457 312 H THR 44 HN THR 44 51.097 23.711 0.791 313 HA THR 44 HA THR 44 51.870 22.206 3.253 314 HB THR 44 HB THR 44 49.492 21.439 3.361 315 HG1 THR 44 HG1 THR 44 49.605 22.401 0.827 316 1HG2 THR 44 HG21 THR 44 48.382 23.576 3.776 317 2HG2 THR 44 HG22 THR 44 49.626 24.440 2.875 318 3HG2 THR 44 HG23 THR 44 50.028 23.647 4.398 319 H VAL 45 HN VAL 45 51.904 20.095 3.208 320 HA VAL 45 HA VAL 45 51.927 18.709 0.575 321 HB VAL 45 HB VAL 45 53.630 17.136 1.668 322 1HG1 VAL 45 HG11 VAL 45 55.539 18.609 1.403 323 2HG1 VAL 45 HG12 VAL 45 54.493 20.030 1.413 324 3HG1 VAL 45 HG13 VAL 45 54.398 18.855 0.121 325 1HG2 VAL 45 HG21 VAL 45 53.841 19.390 3.702 326 2HG2 VAL 45 HG22 VAL 45 54.898 18.008 3.623 327 3HG2 VAL 45 HG23 VAL 45 53.219 17.782 4.065 328 H LEU 46 HN LEU 46 50.856 16.925 0.350 329 HA LEU 46 HA LEU 46 48.731 16.213 2.059 330 1HB LEU 46 HB2 LEU 46 48.952 15.643 -0.399 331 2HB LEU 46 HB1 LEU 46 50.200 14.498 -0.011 332 HG LEU 46 HG LEU 46 48.501 13.231 1.397 333 1HD1 LEU 46 HD11 LEU 46 46.943 15.145 1.821 334 2HD1 LEU 46 HD12 LEU 46 46.094 13.824 1.058 335 3HD1 LEU 46 HD13 LEU 46 46.571 15.212 0.108 336 1HD2 LEU 46 HD21 LEU 46 47.770 13.647 -1.534 337 2HD2 LEU 46 HD22 LEU 46 47.299 12.268 -0.553 338 3HD2 LEU 46 HD23 LEU 46 48.992 12.536 -0.933 339 H LYS 47 HN LYS 47 49.260 15.848 4.090 340 HA LYS 47 HA LYS 47 51.092 15.124 5.684 341 1HB LYS 47 HB2 LYS 47 48.724 15.056 6.320 342 2HB LYS 47 HB1 LYS 47 48.527 13.503 5.547 343 1HG LYS 47 HG2 LYS 47 48.729 13.216 7.972 344 2HG LYS 47 HG1 LYS 47 50.103 12.473 7.184 345 1HD LYS 47 HD2 LYS 47 51.484 14.511 7.689 346 2HD LYS 47 HD1 LYS 47 50.093 15.247 8.467 347 1HE LYS 47 HE2 LYS 47 51.437 12.651 9.339 348 2HE LYS 47 HE1 LYS 47 51.621 14.211 10.129 349 1HZ LYS 47 HZ1 LYS 47 49.110 14.164 10.339 350 2HZ LYS 47 HZ2 LYS 47 50.002 13.122 11.343 351 3HZ LYS 47 HZ3 LYS 47 49.221 12.511 9.965 352 H SER 48 HN SER 48 49.760 12.405 3.839 353 HA SER 48 HA SER 48 52.391 10.998 4.034 354 1HB SER 48 HB2 SER 48 49.635 9.730 4.517 355 2HB SER 48 HB1 SER 48 51.179 8.864 4.528 356 HG SER 48 HG SER 48 51.762 10.677 6.088 357 H LYS 49 HN LYS 49 52.427 9.118 2.712 358 HA LYS 49 HA LYS 49 52.767 9.490 0.082 359 1HB LYS 49 HB2 LYS 49 53.240 7.423 1.390 360 2HB LYS 49 HB1 LYS 49 51.547 7.021 1.386 361 1HG LYS 49 HG2 LYS 49 53.268 7.158 -1.114 362 2HG LYS 49 HG1 LYS 49 52.946 5.691 -0.222 363 1HD LYS 49 HD2 LYS 49 50.478 5.995 -0.699 364 2HD LYS 49 HD1 LYS 49 50.877 7.365 -1.719 365 1HE LYS 49 HE2 LYS 49 52.293 5.988 -3.156 366 2HE LYS 49 HE1 LYS 49 51.907 4.571 -2.185 367 1HZ LYS 49 HZ1 LYS 49 49.885 6.249 -3.546 368 2HZ LYS 49 HZ2 LYS 49 49.629 4.766 -2.759 369 3HZ LYS 49 HZ3 LYS 49 50.537 4.821 -4.193 370 H ASP 50 HN ASP 50 49.714 8.847 1.576 371 HA ASP 50 HA ASP 50 48.269 10.118 -0.626 372 1HB ASP 50 HB2 ASP 50 48.629 7.803 -1.539 373 2HB ASP 50 HB1 ASP 50 47.863 7.119 -0.119 374 H SER 51 HN SER 51 48.166 11.211 1.578 375 HA SER 51 HA SER 51 46.103 10.181 3.427 376 1HB SER 51 HB2 SER 51 48.165 11.420 4.234 377 2HB SER 51 HB1 SER 51 47.598 12.869 3.396 378 HG SER 51 HG SER 51 46.110 13.134 4.848 379 H SER 52 HN SER 52 44.924 12.804 3.921 380 HA SER 52 HA SER 52 43.456 13.405 1.396 381 1HB SER 52 HB2 SER 52 42.054 11.841 2.797 382 2HB SER 52 HB1 SER 52 42.169 12.988 4.142 383 HG SER 52 HG SER 52 41.208 14.547 2.850 384 H GLU 53 HN GLU 53 44.839 14.356 4.373 385 HA GLU 53 HA GLU 53 44.122 17.243 3.951 386 1HB GLU 53 HB2 GLU 53 43.355 16.246 6.126 387 2HB GLU 53 HB1 GLU 53 45.010 15.794 6.489 388 1HG GLU 53 HG2 GLU 53 45.678 18.219 6.416 389 2HG GLU 53 HG1 GLU 53 44.014 18.655 6.064 390 H CYS 54 HN CYS 54 45.748 18.714 4.069 391 HA CYS 54 HA CYS 54 48.531 17.668 3.738 392 1HB CYS 54 HB2 CYS 54 47.344 20.205 2.623 393 2HB CYS 54 HB1 CYS 54 48.907 19.533 2.262 394 H VAL 55 HN VAL 55 50.106 18.628 4.809 395 HA VAL 55 HA VAL 55 49.569 20.883 6.674 396 HB VAL 55 HB VAL 55 51.053 19.626 8.345 397 1HG1 VAL 55 HG11 VAL 55 48.525 19.566 8.538 398 2HG1 VAL 55 HG12 VAL 55 49.229 18.049 9.068 399 3HG1 VAL 55 HG13 VAL 55 48.484 18.163 7.483 400 1HG2 VAL 55 HG21 VAL 55 52.145 18.077 6.770 401 2HG2 VAL 55 HG22 VAL 55 50.613 17.283 6.456 402 3HG2 VAL 55 HG23 VAL 55 51.343 17.195 8.050 403 H HIS 56 HN HIS 56 51.283 22.311 6.891 404 HA HIS 56 HA HIS 56 53.153 22.512 4.784 405 1HB HIS 56 HB2 HIS 56 53.280 23.695 7.579 406 2HB HIS 56 HB1 HIS 56 54.281 24.242 6.250 407 HD1 HIS 56 HD1 HIS 56 53.011 25.509 4.360 408 HD2 HIS 56 HD2 HIS 56 50.574 24.537 7.486 409 HE1 HIS 56 HE1 HIS 56 50.942 26.813 4.057 410 HA PRO 57 HA PRO 57 56.583 19.863 5.746 411 1HB PRO 57 HB2 PRO 57 58.709 21.619 5.325 412 2HB PRO 57 HB1 PRO 57 57.864 20.779 4.051 413 1HG PRO 57 HG2 PRO 57 57.421 23.557 5.052 414 2HG PRO 57 HG1 PRO 57 57.512 22.967 3.382 415 1HD PRO 57 HD2 PRO 57 55.181 23.477 4.480 416 2HD PRO 57 HD1 PRO 57 55.372 22.035 3.462 417 H SER 58 HN SER 58 56.328 22.990 7.201 418 HA SER 58 HA SER 58 58.219 22.594 9.350 419 1HB SER 58 HB2 SER 58 57.176 24.721 10.244 420 2HB SER 58 HB1 SER 58 57.581 24.867 8.527 421 HG SER 58 HG SER 58 55.406 24.085 8.122 422 H LYS 59 HN LYS 59 54.910 21.761 8.881 423 HA LYS 59 HA LYS 59 54.329 21.354 11.748 424 1HB LYS 59 HB2 LYS 59 52.736 20.491 9.315 425 2HB LYS 59 HB1 LYS 59 52.199 20.435 10.982 426 1HG LYS 59 HG2 LYS 59 52.259 22.884 11.103 427 2HG LYS 59 HG1 LYS 59 52.913 22.973 9.479 428 1HD LYS 59 HD2 LYS 59 50.502 23.301 9.308 429 2HD LYS 59 HD1 LYS 59 50.901 21.729 8.651 430 1HE LYS 59 HE2 LYS 59 48.871 21.626 10.075 431 2HE LYS 59 HE1 LYS 59 50.139 20.596 10.706 432 1HZ LYS 59 HZ1 LYS 59 49.705 23.374 11.625 433 2HZ LYS 59 HZ2 LYS 59 50.662 22.176 12.352 434 3HZ LYS 59 HZ3 LYS 59 48.970 22.028 12.353 435 H CYS 60 HN CYS 60 54.520 19.526 8.809 436 HA CYS 60 HA CYS 60 54.131 17.003 9.399 437 1HB CYS 60 HB2 CYS 60 56.398 18.169 7.825 438 2HB CYS 60 HB1 CYS 60 56.171 16.454 7.862 Start of MODEL 3 1 1H ASN 1 HT1 ASN 1 33.252 15.981 -9.282 2 2H ASN 1 HT2 ASN 1 33.553 14.477 -10.013 3 3H ASN 1 HT3 ASN 1 32.804 15.720 -10.899 4 HA ASN 1 HA ASN 1 35.072 15.561 -11.581 5 1HB ASN 1 HB2 ASN 1 34.601 17.968 -9.743 6 2HB ASN 1 HB1 ASN 1 35.791 17.908 -11.035 7 1HD2 ASN 1 HD21 ASN 1 32.299 17.912 -10.374 8 2HD2 ASN 1 HD22 ASN 1 31.834 18.377 -11.940 9 H PHE 2 HN PHE 2 37.261 16.700 -10.507 10 HA PHE 2 HA PHE 2 38.203 14.655 -8.645 11 1HB PHE 2 HB2 PHE 2 40.436 15.772 -9.031 12 2HB PHE 2 HB1 PHE 2 39.627 15.350 -10.525 13 HD1 PHE 2 HD1 PHE 2 38.765 17.077 -12.019 14 HD2 PHE 2 HD2 PHE 2 40.588 18.177 -8.327 15 HE1 PHE 2 HE1 PHE 2 38.896 19.406 -12.768 16 HE2 PHE 2 HE2 PHE 2 40.713 20.494 -9.076 17 HZ PHE 2 HZ PHE 2 39.869 21.123 -11.302 18 H VAL 3 HN VAL 3 36.239 16.492 -7.607 19 HA VAL 3 HA VAL 3 37.161 18.552 -5.964 20 HB VAL 3 HB VAL 3 34.974 16.520 -5.317 21 1HG1 VAL 3 HG11 VAL 3 35.576 17.915 -3.341 22 2HG1 VAL 3 HG12 VAL 3 33.987 18.345 -3.941 23 3HG1 VAL 3 HG13 VAL 3 35.366 19.371 -4.299 24 1HG2 VAL 3 HG21 VAL 3 34.811 19.184 -6.801 25 2HG2 VAL 3 HG22 VAL 3 33.439 18.169 -6.383 26 3HG2 VAL 3 HG23 VAL 3 34.634 17.598 -7.533 27 H CYS 4 HN CYS 4 38.169 18.713 -4.100 28 HA CYS 4 HA CYS 4 38.923 16.264 -2.604 29 1HB CYS 4 HB2 CYS 4 40.663 18.473 -3.640 30 2HB CYS 4 HB1 CYS 4 41.145 17.650 -2.217 31 HA PRO 5 HA PRO 5 38.016 18.001 1.224 32 1HB PRO 5 HB2 PRO 5 40.441 17.249 2.613 33 2HB PRO 5 HB1 PRO 5 38.918 16.433 2.608 34 1HG PRO 5 HG2 PRO 5 41.227 15.484 1.387 35 2HG PRO 5 HG1 PRO 5 39.586 14.894 1.106 36 1HD PRO 5 HD2 PRO 5 41.298 16.627 -0.538 37 2HD PRO 5 HD1 PRO 5 40.001 15.543 -1.036 38 HA PRO 6 HA PRO 6 39.498 22.008 2.425 39 1HB PRO 6 HB2 PRO 6 40.662 21.506 4.951 40 2HB PRO 6 HB1 PRO 6 38.992 21.905 4.636 41 1HG PRO 6 HG2 PRO 6 40.225 19.174 4.861 42 2HG PRO 6 HG1 PRO 6 38.733 19.765 5.605 43 1HD PRO 6 HD2 PRO 6 38.486 18.312 3.532 44 2HD PRO 6 HD1 PRO 6 37.628 19.863 3.497 45 H GLY 7 HN GLY 7 41.892 19.762 3.727 46 1HA GLY 7 HA2 GLY 7 44.198 21.322 3.529 47 2HA GLY 7 HA1 GLY 7 44.182 19.569 3.467 48 H GLN 8 HN GLN 8 42.513 19.759 0.963 49 HA GLN 8 HA GLN 8 44.708 20.355 -0.963 50 1HB GLN 8 HB2 GLN 8 42.519 18.286 -0.999 51 2HB GLN 8 HB1 GLN 8 43.624 18.533 -2.346 52 1HG GLN 8 HG2 GLN 8 45.519 17.939 -0.855 53 2HG GLN 8 HG1 GLN 8 44.415 17.732 0.502 54 1HE2 GLN 8 HE21 GLN 8 43.467 15.701 0.740 55 2HE2 GLN 8 HE22 GLN 8 43.551 14.459 -0.412 56 H THR 9 HN THR 9 44.084 20.976 -3.044 57 HA THR 9 HA THR 9 41.396 21.954 -3.601 58 HB THR 9 HB THR 9 42.303 23.798 -2.106 59 HG1 THR 9 HG1 THR 9 42.004 25.439 -3.652 60 1HG2 THR 9 HG21 THR 9 44.779 23.507 -2.761 61 2HG2 THR 9 HG22 THR 9 44.218 25.165 -2.920 62 3HG2 THR 9 HG23 THR 9 44.385 24.152 -4.341 63 H PHE 10 HN PHE 10 41.780 23.505 -5.641 64 HA PHE 10 HA PHE 10 42.588 21.830 -7.777 65 1HB PHE 10 HB2 PHE 10 41.066 23.716 -8.131 66 2HB PHE 10 HB1 PHE 10 42.305 24.869 -7.659 67 HD1 PHE 10 HD1 PHE 10 41.732 22.113 -10.162 68 HD2 PHE 10 HD2 PHE 10 43.583 25.862 -9.345 69 HE1 PHE 10 HE1 PHE 10 42.502 22.242 -12.480 70 HE2 PHE 10 HE2 PHE 10 44.352 25.987 -11.663 71 HZ PHE 10 HZ PHE 10 43.822 24.182 -13.240 72 H GLN 11 HN GLN 11 44.361 21.937 -9.165 73 HA GLN 11 HA GLN 11 46.807 23.394 -8.327 74 1HB GLN 11 HB2 GLN 11 46.589 20.895 -7.303 75 2HB GLN 11 HB1 GLN 11 46.901 20.390 -8.945 76 1HG GLN 11 HG2 GLN 11 49.002 20.404 -7.753 77 2HG GLN 11 HG1 GLN 11 49.028 21.692 -8.949 78 1HE2 GLN 11 HE21 GLN 11 47.257 21.908 -5.779 79 2HE2 GLN 11 HE22 GLN 11 48.255 23.109 -5.165 80 H THR 12 HN THR 12 47.374 24.349 -10.251 81 HA THR 12 HA THR 12 46.116 23.447 -12.723 82 HB THR 12 HB THR 12 46.391 25.889 -12.291 83 HG1 THR 12 HG1 THR 12 46.407 24.988 -14.401 84 1HG2 THR 12 HG21 THR 12 49.383 25.396 -12.742 85 2HG2 THR 12 HG22 THR 12 48.699 25.793 -11.172 86 3HG2 THR 12 HG23 THR 12 48.594 26.942 -12.501 87 H CYS 13 HN CYS 13 49.544 23.612 -11.642 88 HA CYS 13 HA CYS 13 50.135 21.761 -13.913 89 1HB CYS 13 HB2 CYS 13 51.322 23.842 -14.133 90 2HB CYS 13 HB1 CYS 13 52.063 23.658 -12.558 91 H ALA 14 HN ALA 14 49.770 19.865 -12.888 92 HA ALA 14 HA ALA 14 52.013 18.882 -11.346 93 1HB ALA 14 HB1 ALA 14 50.687 18.216 -9.410 94 2HB ALA 14 HB2 ALA 14 49.270 19.048 -10.063 95 3HB ALA 14 HB3 ALA 14 50.690 19.969 -9.578 96 H SER 15 HN SER 15 52.350 16.801 -11.661 97 HA SER 15 HA SER 15 50.649 15.319 -13.488 98 1HB SER 15 HB2 SER 15 53.244 15.142 -13.251 99 2HB SER 15 HB1 SER 15 52.902 14.180 -11.818 100 HG SER 15 HG SER 15 52.317 12.597 -12.981 101 H SER 16 HN SER 16 51.249 12.786 -11.932 102 HA SER 16 HA SER 16 48.940 12.923 -10.055 103 1HB SER 16 HB2 SER 16 48.563 10.508 -10.710 104 2HB SER 16 HB1 SER 16 48.512 11.562 -12.131 105 HG SER 16 HG SER 16 50.790 11.151 -12.346 106 H CYS 17 HN CYS 17 51.959 13.305 -9.683 107 HA CYS 17 HA CYS 17 52.430 10.994 -7.782 108 1HB CYS 17 HB2 CYS 17 54.722 11.322 -7.932 109 2HB CYS 17 HB1 CYS 17 54.159 11.535 -9.555 110 HA PRO 18 HA PRO 18 50.892 14.645 -5.345 111 1HB PRO 18 HB2 PRO 18 50.147 13.210 -3.099 112 2HB PRO 18 HB1 PRO 18 49.117 13.558 -4.464 113 1HG PRO 18 HG2 PRO 18 50.686 11.090 -3.893 114 2HG PRO 18 HG1 PRO 18 49.048 11.254 -4.552 115 1HD PRO 18 HD2 PRO 18 51.098 10.674 -6.118 116 2HD PRO 18 HD1 PRO 18 49.808 11.768 -6.670 117 H LYS 19 HN LYS 19 51.791 15.982 -3.959 118 HA LYS 19 HA LYS 19 54.354 15.158 -2.932 119 1HB LYS 19 HB2 LYS 19 54.553 17.500 -2.072 120 2HB LYS 19 HB1 LYS 19 54.114 17.483 -3.761 121 1HG LYS 19 HG2 LYS 19 51.765 17.975 -3.166 122 2HG LYS 19 HG1 LYS 19 52.158 17.873 -1.466 123 1HD LYS 19 HD2 LYS 19 53.749 19.754 -1.669 124 2HD LYS 19 HD1 LYS 19 53.491 19.842 -3.375 125 1HE LYS 19 HE2 LYS 19 51.386 20.249 -1.288 126 2HE LYS 19 HE1 LYS 19 52.234 21.546 -2.117 127 1HZ LYS 19 HZ1 LYS 19 51.013 19.586 -3.858 128 2HZ LYS 19 HZ2 LYS 19 51.023 21.279 -3.959 129 3HZ LYS 19 HZ3 LYS 19 49.914 20.498 -2.943 130 H THR 20 HN THR 20 54.843 15.280 -0.731 131 HA THR 20 HA THR 20 52.706 15.310 1.286 132 HB THR 20 HB THR 20 53.165 12.975 2.109 133 HG1 THR 20 HG1 THR 20 55.090 13.248 0.089 134 1HG2 THR 20 HG21 THR 20 52.875 12.796 -0.959 135 2HG2 THR 20 HG22 THR 20 51.503 13.033 0.103 136 3HG2 THR 20 HG23 THR 20 52.427 11.562 0.188 137 H CYS 21 HN CYS 21 53.801 14.404 3.476 138 HA CYS 21 HA CYS 21 55.849 16.287 4.134 139 1HB CYS 21 HB2 CYS 21 55.000 13.733 5.497 140 2HB CYS 21 HB1 CYS 21 56.172 14.819 6.175 141 H GLU 22 HN GLU 22 55.877 13.266 2.644 142 HA GLU 22 HA GLU 22 58.726 12.644 3.125 143 1HB GLU 22 HB2 GLU 22 56.850 10.869 2.712 144 2HB GLU 22 HB1 GLU 22 56.838 11.424 1.058 145 1HG GLU 22 HG2 GLU 22 59.261 10.209 2.429 146 2HG GLU 22 HG1 GLU 22 58.230 9.407 1.263 147 H THR 23 HN THR 23 56.577 13.288 0.462 148 HA THR 23 HA THR 23 58.661 14.174 -1.360 149 HB THR 23 HB THR 23 55.636 13.862 -1.696 150 HG1 THR 23 HG1 THR 23 56.852 12.002 -1.020 151 1HG2 THR 23 HG21 THR 23 57.972 13.691 -3.642 152 2HG2 THR 23 HG22 THR 23 56.914 15.097 -3.533 153 3HG2 THR 23 HG23 THR 23 56.259 13.542 -4.046 154 H ARG 24 HN ARG 24 58.783 15.895 0.540 155 HA ARG 24 HA ARG 24 57.087 18.246 0.266 156 1HB ARG 24 HB2 ARG 24 59.726 17.789 1.633 157 2HB ARG 24 HB1 ARG 24 58.835 19.298 1.742 158 1HG ARG 24 HG2 ARG 24 56.866 18.035 2.645 159 2HG ARG 24 HG1 ARG 24 57.791 16.555 2.500 160 1HD ARG 24 HD2 ARG 24 58.592 18.872 4.306 161 2HD ARG 24 HD1 ARG 24 57.715 17.455 4.866 162 HE ARG 24 HE ARG 24 59.971 16.479 3.542 163 1HH1 ARG 24 HH11 ARG 24 59.258 18.566 6.216 164 2HH1 ARG 24 HH12 ARG 24 60.710 18.167 7.069 165 1HH2 ARG 24 HH21 ARG 24 61.823 15.953 4.608 166 2HH2 ARG 24 HH22 ARG 24 62.186 16.662 6.147 167 H ASN 25 HN ASN 25 59.592 17.074 -1.434 168 HA ASN 25 HA ASN 25 61.340 18.944 -2.184 169 1HB ASN 25 HB2 ASN 25 59.845 17.110 -4.099 170 2HB ASN 25 HB1 ASN 25 61.409 17.876 -4.354 171 1HD2 ASN 25 HD21 ASN 25 59.746 15.545 -2.232 172 2HD2 ASN 25 HD22 ASN 25 61.153 14.713 -1.773 173 H LYS 26 HN LYS 26 57.962 19.247 -3.079 174 HA LYS 26 HA LYS 26 58.490 21.925 -4.119 175 1HB LYS 26 HB2 LYS 26 57.322 21.542 -6.268 176 2HB LYS 26 HB1 LYS 26 58.753 20.557 -6.162 177 1HG LYS 26 HG2 LYS 26 55.961 19.503 -5.636 178 2HG LYS 26 HG1 LYS 26 56.777 19.409 -7.180 179 1HD LYS 26 HD2 LYS 26 58.599 18.053 -6.090 180 2HD LYS 26 HD1 LYS 26 57.661 18.055 -4.600 181 1HE LYS 26 HE2 LYS 26 55.777 16.958 -5.699 182 2HE LYS 26 HE1 LYS 26 56.616 17.002 -7.243 183 1HZ LYS 26 HZ1 LYS 26 58.018 15.371 -6.647 184 2HZ LYS 26 HZ2 LYS 26 56.693 14.927 -5.682 185 3HZ LYS 26 HZ3 LYS 26 58.000 15.773 -4.999 186 H LEU 27 HN LEU 27 56.733 23.194 -4.195 187 HA LEU 27 HA LEU 27 54.525 22.463 -2.397 188 1HB LEU 27 HB2 LEU 27 55.301 25.097 -3.699 189 2HB LEU 27 HB1 LEU 27 53.921 24.919 -2.641 190 HG LEU 27 HG LEU 27 55.410 24.249 -0.767 191 1HD1 LEU 27 HD11 LEU 27 57.726 24.913 -2.638 192 2HD1 LEU 27 HD12 LEU 27 57.369 23.314 -2.003 193 3HD1 LEU 27 HD13 LEU 27 57.856 24.588 -0.918 194 1HD2 LEU 27 HD21 LEU 27 54.764 26.612 -1.051 195 2HD2 LEU 27 HD22 LEU 27 56.146 26.886 -2.097 196 3HD2 LEU 27 HD23 LEU 27 56.391 26.509 -0.401 197 H VAL 28 HN VAL 28 54.392 21.140 -4.611 198 HA VAL 28 HA VAL 28 51.706 21.746 -5.682 199 HB VAL 28 HB VAL 28 52.388 21.153 -7.977 200 1HG1 VAL 28 HG11 VAL 28 53.455 23.399 -8.572 201 2HG1 VAL 28 HG12 VAL 28 53.858 23.639 -6.883 202 3HG1 VAL 28 HG13 VAL 28 52.178 23.609 -7.389 203 1HG2 VAL 28 HG21 VAL 28 54.809 21.345 -8.656 204 2HG2 VAL 28 HG22 VAL 28 54.544 20.024 -7.536 205 3HG2 VAL 28 HG23 VAL 28 55.242 21.530 -6.965 206 H LEU 29 HN LEU 29 50.653 19.901 -6.366 207 HA LEU 29 HA LEU 29 51.143 17.589 -5.008 208 1HB LEU 29 HB2 LEU 29 49.069 18.120 -6.165 209 2HB LEU 29 HB1 LEU 29 49.812 17.971 -7.718 210 HG LEU 29 HG LEU 29 49.333 15.711 -5.719 211 1HD1 LEU 29 HD11 LEU 29 47.289 16.516 -6.652 212 2HD1 LEU 29 HD12 LEU 29 47.651 14.926 -7.296 213 3HD1 LEU 29 HD13 LEU 29 47.917 16.356 -8.294 214 1HD2 LEU 29 HD21 LEU 29 49.896 14.153 -7.606 215 2HD2 LEU 29 HD22 LEU 29 51.275 15.149 -7.288 216 3HD2 LEU 29 HD23 LEU 29 50.256 15.519 -8.652 217 H CYS 30 HN CYS 30 52.089 18.256 -8.198 218 HA CYS 30 HA CYS 30 54.583 16.695 -7.957 219 1HB CYS 30 HB2 CYS 30 52.801 15.055 -8.605 220 2HB CYS 30 HB1 CYS 30 52.480 15.972 -10.034 221 H ASP 31 HN ASP 31 55.753 16.885 -10.260 222 HA ASP 31 HA ASP 31 55.106 19.552 -11.437 223 1HB ASP 31 HB2 ASP 31 57.530 20.113 -11.366 224 2HB ASP 31 HB1 ASP 31 56.814 19.921 -9.773 225 H LYS 32 HN LYS 32 56.558 16.479 -11.954 226 HA LYS 32 HA LYS 32 57.829 16.798 -14.432 227 1HB LYS 32 HB2 LYS 32 57.435 14.378 -14.787 228 2HB LYS 32 HB1 LYS 32 57.906 14.728 -13.135 229 1HG LYS 32 HG2 LYS 32 55.480 14.671 -12.464 230 2HG LYS 32 HG1 LYS 32 55.052 14.281 -14.116 231 1HD LYS 32 HD2 LYS 32 55.072 12.237 -12.780 232 2HD LYS 32 HD1 LYS 32 56.339 12.174 -13.988 233 1HE LYS 32 HE2 LYS 32 58.028 12.809 -12.266 234 2HE LYS 32 HE1 LYS 32 56.756 12.922 -11.057 235 1HZ LYS 32 HZ1 LYS 32 56.317 10.619 -11.277 236 2HZ LYS 32 HZ2 LYS 32 57.992 10.810 -11.064 237 3HZ LYS 32 HZ3 LYS 32 57.365 10.475 -12.606 238 H LYS 33 HN LYS 33 54.466 17.014 -13.849 239 HA LYS 33 HA LYS 33 53.938 17.580 -16.679 240 1HB LYS 33 HB2 LYS 33 53.488 15.057 -16.297 241 2HB LYS 33 HB1 LYS 33 52.295 15.528 -15.113 242 1HG LYS 33 HG2 LYS 33 51.010 15.068 -16.971 243 2HG LYS 33 HG1 LYS 33 51.103 16.804 -16.986 244 1HD LYS 33 HD2 LYS 33 52.703 14.901 -18.751 245 2HD LYS 33 HD1 LYS 33 51.352 15.874 -19.264 246 1HE LYS 33 HE2 LYS 33 54.106 16.921 -18.486 247 2HE LYS 33 HE1 LYS 33 53.400 16.848 -20.075 248 1HZ LYS 33 HZ1 LYS 33 52.539 18.810 -19.767 249 2HZ LYS 33 HZ2 LYS 33 53.099 18.862 -18.164 250 3HZ LYS 33 HZ3 LYS 33 51.575 18.200 -18.508 251 H CYS 34 HN CYS 34 51.987 18.699 -16.996 252 HA CYS 34 HA CYS 34 51.089 20.105 -14.551 253 1HB CYS 34 HB2 CYS 34 51.080 20.944 -17.394 254 2HB CYS 34 HB1 CYS 34 50.314 21.859 -16.129 255 H ASN 35 HN ASN 35 49.601 18.475 -14.156 256 HA ASN 35 HA ASN 35 47.184 18.286 -15.922 257 1HB ASN 35 HB2 ASN 35 47.340 16.987 -13.153 258 2HB ASN 35 HB1 ASN 35 46.295 16.611 -14.486 259 1HD2 ASN 35 HD21 ASN 35 47.438 14.525 -13.451 260 2HD2 ASN 35 HD22 ASN 35 48.712 13.906 -14.386 261 H GLN 36 HN GLN 36 45.420 19.515 -15.536 262 HA GLN 36 HA GLN 36 45.442 21.373 -13.231 263 1HB GLN 36 HB2 GLN 36 43.611 21.146 -15.662 264 2HB GLN 36 HB1 GLN 36 43.507 22.420 -14.461 265 1HG GLN 36 HG2 GLN 36 45.848 23.107 -14.991 266 2HG GLN 36 HG1 GLN 36 45.951 21.836 -16.201 267 1HE2 GLN 36 HE21 GLN 36 46.110 23.154 -18.046 268 2HE2 GLN 36 HE22 GLN 36 44.896 24.234 -18.540 269 H ARG 37 HN ARG 37 45.198 19.597 -11.774 270 HA ARG 37 HA ARG 37 42.349 18.888 -11.265 271 1HB ARG 37 HB2 ARG 37 44.676 16.930 -11.012 272 2HB ARG 37 HB1 ARG 37 42.989 16.561 -10.718 273 1HG ARG 37 HG2 ARG 37 42.475 16.933 -13.127 274 2HG ARG 37 HG1 ARG 37 44.163 17.298 -13.431 275 1HD ARG 37 HD2 ARG 37 43.100 14.663 -12.334 276 2HD ARG 37 HD1 ARG 37 43.690 14.922 -13.975 277 HE ARG 37 HE ARG 37 45.845 15.716 -12.544 278 1HH1 ARG 37 HH11 ARG 37 43.802 12.925 -12.231 279 2HH1 ARG 37 HH12 ARG 37 45.066 11.945 -11.573 280 1HH2 ARG 37 HH21 ARG 37 47.447 14.484 -11.720 281 2HH2 ARG 37 HH22 ARG 37 47.156 12.835 -11.277 282 H CYS 38 HN CYS 38 42.616 17.470 -9.021 283 HA CYS 38 HA CYS 38 43.023 19.356 -6.965 284 1HB CYS 38 HB2 CYS 38 41.630 17.503 -6.530 285 2HB CYS 38 HB1 CYS 38 42.830 16.338 -7.009 286 H GLY 39 HN GLY 39 44.491 19.039 -5.085 287 1HA GLY 39 HA2 GLY 39 46.919 17.762 -4.920 288 2HA GLY 39 HA1 GLY 39 47.262 19.175 -5.932 289 H CYS 40 HN CYS 40 48.073 18.499 -3.083 290 HA CYS 40 HA CYS 40 46.688 20.062 -1.221 291 1HB CYS 40 HB2 CYS 40 49.612 19.459 -1.483 292 2HB CYS 40 HB1 CYS 40 48.961 20.280 -0.097 293 H ILE 41 HN ILE 41 47.386 22.082 -0.283 294 HA ILE 41 HA ILE 41 47.457 24.114 -2.363 295 HB ILE 41 HB ILE 41 47.911 24.707 0.593 296 1HG1 ILE 41 HG12 ILE 41 45.190 24.268 -0.822 297 2HG1 ILE 41 HG11 ILE 41 45.873 23.093 0.276 298 1HG2 ILE 41 HG21 ILE 41 46.449 26.076 -1.716 299 2HG2 ILE 41 HG22 ILE 41 48.032 26.542 -1.127 300 3HG2 ILE 41 HG23 ILE 41 46.631 26.763 -0.111 301 1HD1 ILE 41 HD11 ILE 41 45.096 25.933 1.042 302 2HD1 ILE 41 HD12 ILE 41 45.799 24.736 2.118 303 3HD1 ILE 41 HD13 ILE 41 44.209 24.471 1.422 304 H SER 42 HN SER 42 48.986 25.793 -2.474 305 HA SER 42 HA SER 42 51.722 24.819 -2.560 306 1HB SER 42 HB2 SER 42 52.174 27.152 -3.541 307 2HB SER 42 HB1 SER 42 50.817 26.360 -4.350 308 HG SER 42 HG SER 42 49.492 27.401 -2.675 309 H GLY 43 HN GLY 43 52.385 24.428 -0.633 310 1HA GLY 43 HA2 GLY 43 53.917 25.860 0.975 311 2HA GLY 43 HA1 GLY 43 52.340 26.439 1.549 312 H THR 44 HN THR 44 51.046 23.925 0.888 313 HA THR 44 HA THR 44 51.851 22.370 3.285 314 HB THR 44 HB THR 44 49.584 21.316 3.125 315 HG1 THR 44 HG1 THR 44 49.802 21.948 0.634 316 1HG2 THR 44 HG21 THR 44 49.400 24.334 2.716 317 2HG2 THR 44 HG22 THR 44 49.716 23.540 4.256 318 3HG2 THR 44 HG23 THR 44 48.176 23.301 3.445 319 H VAL 45 HN VAL 45 51.084 20.028 2.909 320 HA VAL 45 HA VAL 45 51.782 18.718 0.417 321 HB VAL 45 HB VAL 45 53.534 17.237 1.502 322 1HG1 VAL 45 HG11 VAL 45 54.352 20.135 1.336 323 2HG1 VAL 45 HG12 VAL 45 54.298 18.956 0.025 324 3HG1 VAL 45 HG13 VAL 45 55.425 18.750 1.342 325 1HG2 VAL 45 HG21 VAL 45 53.687 19.383 3.647 326 2HG2 VAL 45 HG22 VAL 45 54.776 18.034 3.489 327 3HG2 VAL 45 HG23 VAL 45 53.106 17.743 3.924 328 H LEU 46 HN LEU 46 50.739 16.815 0.331 329 HA LEU 46 HA LEU 46 48.659 16.220 2.152 330 1HB LEU 46 HB2 LEU 46 48.821 15.433 -0.261 331 2HB LEU 46 HB1 LEU 46 50.066 14.321 0.219 332 HG LEU 46 HG LEU 46 48.438 13.180 1.752 333 1HD1 LEU 46 HD11 LEU 46 46.015 13.726 1.470 334 2HD1 LEU 46 HD12 LEU 46 46.436 15.043 0.399 335 3HD1 LEU 46 HD13 LEU 46 46.878 15.111 2.095 336 1HD2 LEU 46 HD21 LEU 46 47.168 12.073 -0.081 337 2HD2 LEU 46 HD22 LEU 46 48.842 12.323 -0.543 338 3HD2 LEU 46 HD23 LEU 46 47.591 13.381 -1.172 339 H LYS 47 HN LYS 47 49.157 15.970 4.159 340 HA LYS 47 HA LYS 47 50.992 15.404 5.828 341 1HB LYS 47 HB2 LYS 47 48.667 15.438 6.383 342 2HB LYS 47 HB1 LYS 47 48.403 13.844 5.722 343 1HG LYS 47 HG2 LYS 47 49.885 12.868 7.456 344 2HG LYS 47 HG1 LYS 47 50.178 14.467 8.113 345 1HD LYS 47 HD2 LYS 47 47.461 13.070 7.950 346 2HD LYS 47 HD1 LYS 47 48.424 13.231 9.403 347 1HE LYS 47 HE2 LYS 47 48.214 15.721 9.273 348 2HE LYS 47 HE1 LYS 47 47.225 15.564 7.829 349 1HZ LYS 47 HZ1 LYS 47 45.712 14.151 9.176 350 2HZ LYS 47 HZ2 LYS 47 45.767 15.794 9.603 351 3HZ LYS 47 HZ3 LYS 47 46.582 14.642 10.549 352 H SER 48 HN SER 48 49.794 12.549 4.076 353 HA SER 48 HA SER 48 52.449 11.249 4.528 354 1HB SER 48 HB2 SER 48 49.705 9.896 4.911 355 2HB SER 48 HB1 SER 48 51.275 9.094 5.071 356 HG SER 48 HG SER 48 50.291 11.284 6.564 357 H LYS 49 HN LYS 49 52.471 9.167 3.268 358 HA LYS 49 HA LYS 49 52.841 9.602 0.603 359 1HB LYS 49 HB2 LYS 49 53.491 7.559 1.806 360 2HB LYS 49 HB1 LYS 49 51.816 7.045 1.880 361 1HG LYS 49 HG2 LYS 49 51.737 6.925 -0.613 362 2HG LYS 49 HG1 LYS 49 53.402 7.480 -0.691 363 1HD LYS 49 HD2 LYS 49 54.118 5.454 0.588 364 2HD LYS 49 HD1 LYS 49 52.449 4.919 0.675 365 1HE LYS 49 HE2 LYS 49 53.638 3.772 -1.175 366 2HE LYS 49 HE1 LYS 49 52.362 4.793 -1.817 367 1HZ LYS 49 HZ1 LYS 49 54.606 4.915 -2.921 368 2HZ LYS 49 HZ2 LYS 49 55.136 5.757 -1.545 369 3HZ LYS 49 HZ3 LYS 49 53.883 6.393 -2.498 370 H ASP 50 HN ASP 50 49.811 9.060 2.163 371 HA ASP 50 HA ASP 50 48.305 10.021 -0.117 372 1HB ASP 50 HB2 ASP 50 48.757 7.650 -0.859 373 2HB ASP 50 HB1 ASP 50 48.022 7.055 0.616 374 H SER 51 HN SER 51 48.221 11.225 2.135 375 HA SER 51 HA SER 51 46.206 10.193 4.005 376 1HB SER 51 HB2 SER 51 48.214 11.554 4.730 377 2HB SER 51 HB1 SER 51 47.573 12.936 3.834 378 HG SER 51 HG SER 51 46.097 13.206 5.299 379 H SER 52 HN SER 52 44.910 12.767 4.423 380 HA SER 52 HA SER 52 43.458 13.380 1.916 381 1HB SER 52 HB2 SER 52 42.196 11.476 3.010 382 2HB SER 52 HB1 SER 52 42.049 12.444 4.484 383 HG SER 52 HG SER 52 40.806 13.876 3.443 384 H GLU 53 HN GLU 53 45.245 14.488 4.219 385 HA GLU 53 HA GLU 53 43.949 17.161 4.331 386 1HB GLU 53 HB2 GLU 53 43.453 15.699 6.475 387 2HB GLU 53 HB1 GLU 53 45.165 15.820 6.805 388 1HG GLU 53 HG2 GLU 53 43.206 18.140 6.599 389 2HG GLU 53 HG1 GLU 53 43.940 17.538 8.069 390 H CYS 54 HN CYS 54 45.567 18.722 4.162 391 HA CYS 54 HA CYS 54 48.356 17.696 3.841 392 1HB CYS 54 HB2 CYS 54 47.193 20.203 2.669 393 2HB CYS 54 HB1 CYS 54 48.714 19.456 2.292 394 H VAL 55 HN VAL 55 49.935 18.509 4.926 395 HA VAL 55 HA VAL 55 49.573 20.891 6.694 396 HB VAL 55 HB VAL 55 51.310 19.737 8.168 397 1HG1 VAL 55 HG11 VAL 55 48.735 18.147 7.689 398 2HG1 VAL 55 HG12 VAL 55 48.824 19.581 8.704 399 3HG1 VAL 55 HG13 VAL 55 49.670 18.115 9.172 400 1HG2 VAL 55 HG21 VAL 55 51.616 17.295 7.864 401 2HG2 VAL 55 HG22 VAL 55 52.201 18.182 6.468 402 3HG2 VAL 55 HG23 VAL 55 50.653 17.361 6.398 403 H HIS 56 HN HIS 56 51.571 22.073 7.138 404 HA HIS 56 HA HIS 56 53.163 22.426 4.722 405 1HB HIS 56 HB2 HIS 56 53.373 23.689 7.486 406 2HB HIS 56 HB1 HIS 56 54.286 24.236 6.092 407 HD1 HIS 56 HD1 HIS 56 52.923 25.487 4.303 408 HD2 HIS 56 HD2 HIS 56 50.574 24.288 7.418 409 HE1 HIS 56 HE1 HIS 56 50.769 26.653 4.033 410 HA PRO 57 HA PRO 57 56.607 19.801 5.587 411 1HB PRO 57 HB2 PRO 57 58.733 21.446 4.918 412 2HB PRO 57 HB1 PRO 57 57.726 20.646 3.738 413 1HG PRO 57 HG2 PRO 57 57.509 23.447 4.765 414 2HG PRO 57 HG1 PRO 57 57.446 22.856 3.092 415 1HD PRO 57 HD2 PRO 57 55.227 23.458 4.378 416 2HD PRO 57 HD1 PRO 57 55.280 22.027 3.330 417 H SER 58 HN SER 58 56.464 22.969 6.930 418 HA SER 58 HA SER 58 58.515 22.684 8.942 419 1HB SER 58 HB2 SER 58 57.502 24.828 9.830 420 2HB SER 58 HB1 SER 58 57.764 24.911 8.082 421 HG SER 58 HG SER 58 55.580 24.070 7.885 422 H LYS 59 HN LYS 59 55.183 21.818 8.753 423 HA LYS 59 HA LYS 59 54.839 21.473 11.669 424 1HB LYS 59 HB2 LYS 59 53.051 20.503 9.409 425 2HB LYS 59 HB1 LYS 59 52.664 20.539 11.117 426 1HG LYS 59 HG2 LYS 59 52.716 22.990 11.103 427 2HG LYS 59 HG1 LYS 59 53.230 22.992 9.427 428 1HD LYS 59 HD2 LYS 59 50.818 23.301 9.427 429 2HD LYS 59 HD1 LYS 59 51.169 21.688 8.848 430 1HE LYS 59 HE2 LYS 59 49.260 21.672 10.426 431 2HE LYS 59 HE1 LYS 59 50.582 20.684 11.012 432 1HZ LYS 59 HZ1 LYS 59 49.525 22.215 12.656 433 2HZ LYS 59 HZ2 LYS 59 50.217 23.510 11.801 434 3HZ LYS 59 HZ3 LYS 59 51.214 22.344 12.527 435 H CYS 60 HN CYS 60 54.899 19.617 8.741 436 HA CYS 60 HA CYS 60 54.604 17.083 9.497 437 1HB CYS 60 HB2 CYS 60 56.614 18.217 7.574 438 2HB CYS 60 HB1 CYS 60 56.400 16.506 7.715 Start of MODEL 4 1 1H ASN 1 HT1 ASN 1 32.999 21.971 -10.661 2 2H ASN 1 HT2 ASN 1 32.302 21.442 -9.206 3 3H ASN 1 HT3 ASN 1 31.312 21.992 -10.474 4 HA ASN 1 HA ASN 1 31.230 19.618 -10.377 5 1HB ASN 1 HB2 ASN 1 32.918 20.631 -12.722 6 2HB ASN 1 HB1 ASN 1 31.989 19.138 -12.729 7 1HD2 ASN 1 HD21 ASN 1 29.707 19.278 -13.013 8 2HD2 ASN 1 HD22 ASN 1 28.908 20.739 -13.343 9 H PHE 2 HN PHE 2 33.943 20.763 -9.199 10 HA PHE 2 HA PHE 2 35.134 18.169 -8.717 11 1HB PHE 2 HB2 PHE 2 36.090 18.658 -10.992 12 2HB PHE 2 HB1 PHE 2 36.705 20.194 -10.404 13 HD1 PHE 2 HD1 PHE 2 38.663 20.276 -8.956 14 HD2 PHE 2 HD2 PHE 2 37.032 16.518 -10.135 15 HE1 PHE 2 HE1 PHE 2 40.660 19.147 -8.116 16 HE2 PHE 2 HE2 PHE 2 39.039 15.387 -9.292 17 HZ PHE 2 HZ PHE 2 40.854 16.689 -8.281 18 H VAL 3 HN VAL 3 35.656 18.320 -6.674 19 HA VAL 3 HA VAL 3 37.035 20.734 -5.589 20 HB VAL 3 HB VAL 3 34.576 19.432 -4.305 21 1HG1 VAL 3 HG11 VAL 3 36.187 21.875 -3.437 22 2HG1 VAL 3 HG12 VAL 3 36.181 20.324 -2.617 23 3HG1 VAL 3 HG13 VAL 3 34.723 21.292 -2.660 24 1HG2 VAL 3 HG21 VAL 3 33.427 21.590 -4.753 25 2HG2 VAL 3 HG22 VAL 3 33.923 20.834 -6.252 26 3HG2 VAL 3 HG23 VAL 3 34.846 22.180 -5.603 27 H CYS 4 HN CYS 4 38.266 20.416 -3.895 28 HA CYS 4 HA CYS 4 39.471 17.788 -3.545 29 1HB CYS 4 HB2 CYS 4 39.899 20.481 -2.394 30 2HB CYS 4 HB1 CYS 4 40.919 19.160 -1.922 31 HA PRO 5 HA PRO 5 38.031 17.659 0.865 32 1HB PRO 5 HB2 PRO 5 40.362 16.402 1.877 33 2HB PRO 5 HB1 PRO 5 38.866 15.634 1.445 34 1HG PRO 5 HG2 PRO 5 41.268 15.231 0.100 35 2HG PRO 5 HG1 PRO 5 39.665 14.879 -0.571 36 1HD PRO 5 HD2 PRO 5 41.381 17.311 -0.941 37 2HD PRO 5 HD1 PRO 5 40.453 16.434 -2.158 38 HA PRO 6 HA PRO 6 40.145 20.812 3.287 39 1HB PRO 6 HB2 PRO 6 40.944 19.287 5.512 40 2HB PRO 6 HB1 PRO 6 39.393 20.068 5.331 41 1HG PRO 6 HG2 PRO 6 40.117 17.222 4.666 42 2HG PRO 6 HG1 PRO 6 38.685 17.833 5.511 43 1HD PRO 6 HD2 PRO 6 38.501 17.124 3.050 44 2HD PRO 6 HD1 PRO 6 37.750 18.650 3.506 45 H GLY 7 HN GLY 7 42.199 21.582 3.465 46 1HA GLY 7 HA2 GLY 7 44.557 21.557 3.564 47 2HA GLY 7 HA1 GLY 7 44.519 19.807 3.535 48 H GLN 8 HN GLN 8 42.674 20.474 0.935 49 HA GLN 8 HA GLN 8 44.958 20.997 -0.907 50 1HB GLN 8 HB2 GLN 8 42.883 18.773 -1.198 51 2HB GLN 8 HB1 GLN 8 44.144 19.153 -2.358 52 1HG GLN 8 HG2 GLN 8 45.876 18.556 -0.772 53 2HG GLN 8 HG1 GLN 8 44.695 18.261 0.502 54 1HE2 GLN 8 HE21 GLN 8 43.305 16.387 0.286 55 2HE2 GLN 8 HE22 GLN 8 43.712 15.098 -0.736 56 H THR 9 HN THR 9 44.384 21.643 -2.947 57 HA THR 9 HA THR 9 41.644 22.652 -3.438 58 HB THR 9 HB THR 9 42.772 24.553 -2.367 59 HG1 THR 9 HG1 THR 9 42.626 25.969 -4.133 60 1HG2 THR 9 HG21 THR 9 44.840 25.538 -3.383 61 2HG2 THR 9 HG22 THR 9 44.864 24.283 -4.611 62 3HG2 THR 9 HG23 THR 9 45.188 23.874 -2.938 63 H PHE 10 HN PHE 10 41.556 23.582 -5.638 64 HA PHE 10 HA PHE 10 42.366 21.621 -7.572 65 1HB PHE 10 HB2 PHE 10 40.364 23.068 -7.916 66 2HB PHE 10 HB1 PHE 10 41.394 24.491 -8.006 67 HD1 PHE 10 HD1 PHE 10 42.374 25.108 -10.074 68 HD2 PHE 10 HD2 PHE 10 40.795 21.171 -9.642 69 HE1 PHE 10 HE1 PHE 10 42.736 24.699 -12.464 70 HE2 PHE 10 HE2 PHE 10 41.157 20.769 -12.034 71 HZ PHE 10 HZ PHE 10 42.127 22.537 -13.442 72 H GLN 11 HN GLN 11 43.850 22.017 -9.428 73 HA GLN 11 HA GLN 11 45.808 24.182 -9.105 74 1HB GLN 11 HB2 GLN 11 46.436 22.073 -7.586 75 2HB GLN 11 HB1 GLN 11 46.854 21.373 -9.149 76 1HG GLN 11 HG2 GLN 11 48.594 22.840 -9.586 77 2HG GLN 11 HG1 GLN 11 48.049 24.024 -8.400 78 1HE2 GLN 11 HE21 GLN 11 47.944 23.130 -6.085 79 2HE2 GLN 11 HE22 GLN 11 49.219 22.158 -5.554 80 H THR 12 HN THR 12 47.079 24.378 -10.828 81 HA THR 12 HA THR 12 45.848 23.390 -13.276 82 HB THR 12 HB THR 12 48.037 25.474 -12.765 83 HG1 THR 12 HG1 THR 12 45.911 25.830 -11.936 84 1HG2 THR 12 HG21 THR 12 47.470 26.191 -15.023 85 2HG2 THR 12 HG22 THR 12 46.249 24.922 -15.156 86 3HG2 THR 12 HG23 THR 12 47.961 24.496 -15.104 87 H CYS 13 HN CYS 13 49.207 23.522 -12.089 88 HA CYS 13 HA CYS 13 49.739 21.288 -13.977 89 1HB CYS 13 HB2 CYS 13 50.932 23.308 -14.479 90 2HB CYS 13 HB1 CYS 13 51.749 23.266 -12.935 91 H ALA 14 HN ALA 14 49.497 19.524 -12.865 92 HA ALA 14 HA ALA 14 51.651 18.745 -11.110 93 1HB ALA 14 HB1 ALA 14 50.159 19.935 -9.540 94 2HB ALA 14 HB2 ALA 14 50.165 18.218 -9.159 95 3HB ALA 14 HB3 ALA 14 48.807 18.927 -10.035 96 H SER 15 HN SER 15 52.130 16.665 -11.377 97 HA SER 15 HA SER 15 50.450 15.013 -13.094 98 1HB SER 15 HB2 SER 15 53.109 14.933 -12.953 99 2HB SER 15 HB1 SER 15 52.831 13.994 -11.492 100 HG SER 15 HG SER 15 51.222 12.841 -12.934 101 H SER 16 HN SER 16 51.341 12.639 -11.350 102 HA SER 16 HA SER 16 49.152 12.755 -9.317 103 1HB SER 16 HB2 SER 16 50.067 10.380 -11.044 104 2HB SER 16 HB1 SER 16 48.766 10.332 -9.840 105 HG SER 16 HG SER 16 47.522 11.285 -11.207 106 H CYS 17 HN CYS 17 52.006 13.455 -9.205 107 HA CYS 17 HA CYS 17 53.032 11.293 -7.371 108 1HB CYS 17 HB2 CYS 17 55.207 11.982 -7.800 109 2HB CYS 17 HB1 CYS 17 54.428 12.013 -9.348 110 HA PRO 18 HA PRO 18 51.281 14.758 -4.872 111 1HB PRO 18 HB2 PRO 18 50.992 13.292 -2.529 112 2HB PRO 18 HB1 PRO 18 49.786 13.463 -3.774 113 1HG PRO 18 HG2 PRO 18 51.729 11.238 -3.362 114 2HG PRO 18 HG1 PRO 18 50.020 11.166 -3.828 115 1HD PRO 18 HD2 PRO 18 51.950 10.836 -5.628 116 2HD PRO 18 HD1 PRO 18 50.460 11.720 -6.029 117 H LYS 19 HN LYS 19 52.212 16.180 -3.697 118 HA LYS 19 HA LYS 19 54.987 15.786 -2.718 119 1HB LYS 19 HB2 LYS 19 54.340 17.815 -4.049 120 2HB LYS 19 HB1 LYS 19 53.136 18.238 -2.847 121 1HG LYS 19 HG2 LYS 19 55.223 18.280 -1.186 122 2HG LYS 19 HG1 LYS 19 56.164 18.231 -2.638 123 1HD LYS 19 HD2 LYS 19 55.904 20.553 -1.842 124 2HD LYS 19 HD1 LYS 19 55.314 20.336 -3.471 125 1HE LYS 19 HE2 LYS 19 52.961 20.251 -2.585 126 2HE LYS 19 HE1 LYS 19 53.583 20.447 -0.958 127 1HZ LYS 19 HZ1 LYS 19 53.095 22.562 -1.465 128 2HZ LYS 19 HZ2 LYS 19 53.394 22.372 -3.125 129 3HZ LYS 19 HZ3 LYS 19 54.692 22.527 -2.037 130 H THR 20 HN THR 20 54.630 14.466 -1.101 131 HA THR 20 HA THR 20 52.790 15.203 1.095 132 HB THR 20 HB THR 20 53.250 12.908 1.891 133 HG1 THR 20 HG1 THR 20 55.235 12.426 1.271 134 1HG2 THR 20 HG21 THR 20 52.341 11.644 -0.102 135 2HG2 THR 20 HG22 THR 20 52.798 12.936 -1.174 136 3HG2 THR 20 HG23 THR 20 51.507 13.166 -0.017 137 H CYS 21 HN CYS 21 53.700 14.419 3.295 138 HA CYS 21 HA CYS 21 55.709 16.245 4.088 139 1HB CYS 21 HB2 CYS 21 54.745 13.712 5.391 140 2HB CYS 21 HB1 CYS 21 55.813 14.840 6.163 141 H GLU 22 HN GLU 22 55.946 13.183 2.650 142 HA GLU 22 HA GLU 22 58.781 12.768 3.448 143 1HB GLU 22 HB2 GLU 22 57.107 10.785 3.070 144 2HB GLU 22 HB1 GLU 22 57.241 11.183 1.367 145 1HG GLU 22 HG2 GLU 22 59.683 10.891 1.387 146 2HG GLU 22 HG1 GLU 22 59.665 10.556 3.107 147 H THR 23 HN THR 23 56.765 13.396 0.646 148 HA THR 23 HA THR 23 59.108 14.012 -1.048 149 HB THR 23 HB THR 23 56.150 13.573 -1.767 150 HG1 THR 23 HG1 THR 23 57.062 11.780 -0.774 151 1HG2 THR 23 HG21 THR 23 57.116 12.971 -3.929 152 2HG2 THR 23 HG22 THR 23 58.752 13.174 -3.301 153 3HG2 THR 23 HG23 THR 23 57.721 14.584 -3.545 154 H ARG 24 HN ARG 24 58.779 15.828 0.842 155 HA ARG 24 HA ARG 24 57.103 18.083 0.201 156 1HB ARG 24 HB2 ARG 24 59.625 17.897 1.854 157 2HB ARG 24 HB1 ARG 24 58.570 19.297 1.821 158 1HG ARG 24 HG2 ARG 24 56.664 17.768 2.563 159 2HG ARG 24 HG1 ARG 24 57.831 16.475 2.630 160 1HD ARG 24 HD2 ARG 24 58.024 18.991 4.301 161 2HD ARG 24 HD1 ARG 24 57.325 17.499 4.903 162 HE ARG 24 HE ARG 24 59.650 16.516 4.225 163 1HH1 ARG 24 HH11 ARG 24 59.080 19.694 5.539 164 2HH1 ARG 24 HH12 ARG 24 60.650 19.779 6.258 165 1HH2 ARG 24 HH21 ARG 24 61.624 16.631 5.139 166 2HH2 ARG 24 HH22 ARG 24 62.104 18.033 6.037 167 H ASN 25 HN ASN 25 59.928 16.984 -1.087 168 HA ASN 25 HA ASN 25 61.554 19.035 -1.755 169 1HB ASN 25 HB2 ASN 25 60.708 16.744 -3.566 170 2HB ASN 25 HB1 ASN 25 62.164 17.723 -3.721 171 1HD2 ASN 25 HD21 ASN 25 60.518 15.452 -1.518 172 2HD2 ASN 25 HD22 ASN 25 61.931 14.952 -0.720 173 H LYS 26 HN LYS 26 58.394 18.637 -3.315 174 HA LYS 26 HA LYS 26 59.070 20.641 -5.366 175 1HB LYS 26 HB2 LYS 26 56.446 19.152 -4.806 176 2HB LYS 26 HB1 LYS 26 56.732 20.186 -6.180 177 1HG LYS 26 HG2 LYS 26 56.879 17.897 -6.890 178 2HG LYS 26 HG1 LYS 26 58.467 18.624 -6.999 179 1HD LYS 26 HD2 LYS 26 59.200 17.469 -4.967 180 2HD LYS 26 HD1 LYS 26 57.577 16.862 -4.670 181 1HE LYS 26 HE2 LYS 26 59.043 15.143 -5.714 182 2HE LYS 26 HE1 LYS 26 57.744 15.566 -6.817 183 1HZ LYS 26 HZ1 LYS 26 60.435 16.796 -6.900 184 2HZ LYS 26 HZ2 LYS 26 59.197 16.944 -8.052 185 3HZ LYS 26 HZ3 LYS 26 59.977 15.453 -7.834 186 H LEU 27 HN LEU 27 56.800 21.945 -5.579 187 HA LEU 27 HA LEU 27 56.049 23.255 -3.051 188 1HB LEU 27 HB2 LEU 27 57.110 24.756 -5.523 189 2HB LEU 27 HB1 LEU 27 56.446 25.557 -4.116 190 HG LEU 27 HG LEU 27 58.969 23.817 -4.079 191 1HD1 LEU 27 HD11 LEU 27 60.155 25.985 -3.819 192 2HD1 LEU 27 HD12 LEU 27 58.635 26.852 -3.970 193 3HD1 LEU 27 HD13 LEU 27 59.273 25.950 -5.335 194 1HD2 LEU 27 HD21 LEU 27 59.267 24.770 -1.799 195 2HD2 LEU 27 HD22 LEU 27 57.738 23.920 -1.864 196 3HD2 LEU 27 HD23 LEU 27 57.767 25.669 -1.955 197 H VAL 28 HN VAL 28 55.045 21.584 -4.881 198 HA VAL 28 HA VAL 28 52.286 22.472 -5.261 199 HB VAL 28 HB VAL 28 52.266 21.735 -7.705 200 1HG1 VAL 28 HG11 VAL 28 52.313 24.199 -7.169 201 2HG1 VAL 28 HG12 VAL 28 53.183 23.849 -8.652 202 3HG1 VAL 28 HG13 VAL 28 54.071 24.163 -7.177 203 1HG2 VAL 28 HG21 VAL 28 55.297 21.993 -7.420 204 2HG2 VAL 28 HG22 VAL 28 54.442 21.724 -8.927 205 3HG2 VAL 28 HG23 VAL 28 54.423 20.497 -7.672 206 H LEU 29 HN LEU 29 50.969 20.676 -6.000 207 HA LEU 29 HA LEU 29 51.330 18.384 -4.510 208 1HB LEU 29 HB2 LEU 29 49.250 19.148 -5.504 209 2HB LEU 29 HB1 LEU 29 49.851 18.881 -7.107 210 HG LEU 29 HG LEU 29 48.155 17.158 -6.385 211 1HD1 LEU 29 HD11 LEU 29 49.319 15.074 -6.928 212 2HD1 LEU 29 HD12 LEU 29 50.875 15.827 -6.747 213 3HD1 LEU 29 HD13 LEU 29 49.803 16.350 -8.025 214 1HD2 LEU 29 HD21 LEU 29 48.632 17.174 -3.969 215 2HD2 LEU 29 HD22 LEU 29 50.194 16.439 -4.241 216 3HD2 LEU 29 HD23 LEU 29 48.728 15.537 -4.583 217 H CYS 30 HN CYS 30 52.171 18.978 -7.724 218 HA CYS 30 HA CYS 30 54.476 17.194 -7.742 219 1HB CYS 30 HB2 CYS 30 52.602 15.586 -8.149 220 2HB CYS 30 HB1 CYS 30 52.106 16.534 -9.521 221 H ASP 31 HN ASP 31 55.594 17.348 -9.868 222 HA ASP 31 HA ASP 31 54.819 19.777 -11.415 223 1HB ASP 31 HB2 ASP 31 56.435 20.410 -9.661 224 2HB ASP 31 HB1 ASP 31 57.569 19.220 -10.260 225 H LYS 32 HN LYS 32 55.922 16.662 -11.560 226 HA LYS 32 HA LYS 32 57.377 16.854 -14.060 227 1HB LYS 32 HB2 LYS 32 56.346 14.557 -12.378 228 2HB LYS 32 HB1 LYS 32 57.209 14.295 -13.879 229 1HG LYS 32 HG2 LYS 32 58.819 14.242 -12.017 230 2HG LYS 32 HG1 LYS 32 59.129 15.618 -13.054 231 1HD LYS 32 HD2 LYS 32 59.470 16.198 -10.725 232 2HD LYS 32 HD1 LYS 32 58.189 17.164 -11.387 233 1HE LYS 32 HE2 LYS 32 57.550 16.357 -9.157 234 2HE LYS 32 HE1 LYS 32 56.550 15.521 -10.331 235 1HZ LYS 32 HZ1 LYS 32 57.756 14.210 -8.486 236 2HZ LYS 32 HZ2 LYS 32 59.094 14.321 -9.525 237 3HZ LYS 32 HZ3 LYS 32 57.664 13.576 -10.059 238 H LYS 33 HN LYS 33 54.317 17.477 -13.747 239 HA LYS 33 HA LYS 33 53.574 17.172 -16.469 240 1HB LYS 33 HB2 LYS 33 53.312 14.680 -15.760 241 2HB LYS 33 HB1 LYS 33 52.075 15.239 -14.643 242 1HG LYS 33 HG2 LYS 33 50.717 16.128 -16.343 243 2HG LYS 33 HG1 LYS 33 51.926 15.844 -17.581 244 1HD LYS 33 HD2 LYS 33 51.714 13.348 -17.063 245 2HD LYS 33 HD1 LYS 33 50.420 13.728 -15.945 246 1HE LYS 33 HE2 LYS 33 50.411 14.316 -18.942 247 2HE LYS 33 HE1 LYS 33 49.506 13.040 -18.148 248 1HZ LYS 33 HZ1 LYS 33 49.151 15.881 -17.430 249 2HZ LYS 33 HZ2 LYS 33 48.129 14.566 -17.096 250 3HZ LYS 33 HZ3 LYS 33 48.280 15.143 -18.686 251 H CYS 34 HN CYS 34 51.604 18.124 -16.893 252 HA CYS 34 HA CYS 34 50.572 19.678 -14.598 253 1HB CYS 34 HB2 CYS 34 50.515 20.251 -17.509 254 2HB CYS 34 HB1 CYS 34 49.773 21.266 -16.303 255 H ASN 35 HN ASN 35 49.185 18.076 -14.008 256 HA ASN 35 HA ASN 35 46.786 17.511 -15.700 257 1HB ASN 35 HB2 ASN 35 47.063 16.623 -12.785 258 2HB ASN 35 HB1 ASN 35 46.007 16.006 -14.021 259 1HD2 ASN 35 HD21 ASN 35 47.504 14.184 -12.657 260 2HD2 ASN 35 HD22 ASN 35 48.722 13.551 -13.653 261 H GLN 36 HN GLN 36 44.873 18.484 -15.416 262 HA GLN 36 HA GLN 36 44.621 20.785 -13.533 263 1HB GLN 36 HB2 GLN 36 42.725 19.647 -15.683 264 2HB GLN 36 HB1 GLN 36 42.491 21.177 -14.884 265 1HG GLN 36 HG2 GLN 36 44.814 20.467 -16.734 266 2HG GLN 36 HG1 GLN 36 43.441 21.472 -17.157 267 1HE2 GLN 36 HE21 GLN 36 43.224 23.104 -14.861 268 2HE2 GLN 36 HE22 GLN 36 44.624 24.050 -14.723 269 H ARG 37 HN ARG 37 44.581 19.679 -11.640 270 HA ARG 37 HA ARG 37 41.981 18.544 -10.882 271 1HB ARG 37 HB2 ARG 37 42.946 16.380 -10.044 272 2HB ARG 37 HB1 ARG 37 43.101 16.542 -11.767 273 1HG ARG 37 HG2 ARG 37 45.472 17.329 -11.472 274 2HG ARG 37 HG1 ARG 37 45.305 17.187 -9.736 275 1HD ARG 37 HD2 ARG 37 46.448 15.202 -10.647 276 2HD ARG 37 HD1 ARG 37 44.885 14.737 -9.976 277 HE ARG 37 HE ARG 37 44.472 15.331 -12.708 278 1HH1 ARG 37 HH11 ARG 37 46.211 13.078 -10.738 279 2HH1 ARG 37 HH12 ARG 37 46.145 11.816 -11.919 280 1HH2 ARG 37 HH21 ARG 37 44.375 13.750 -14.225 281 2HH2 ARG 37 HH22 ARG 37 45.090 12.199 -13.926 282 H CYS 38 HN CYS 38 42.490 17.442 -8.547 283 HA CYS 38 HA CYS 38 43.066 19.749 -6.874 284 1HB CYS 38 HB2 CYS 38 41.336 18.102 -6.186 285 2HB CYS 38 HB1 CYS 38 42.567 16.860 -6.046 286 H GLY 39 HN GLY 39 44.518 19.652 -5.049 287 1HA GLY 39 HA2 GLY 39 46.725 17.926 -4.733 288 2HA GLY 39 HA1 GLY 39 47.218 19.232 -5.823 289 H CYS 40 HN CYS 40 48.226 18.764 -3.109 290 HA CYS 40 HA CYS 40 47.056 20.431 -1.169 291 1HB CYS 40 HB2 CYS 40 50.026 20.009 -1.625 292 2HB CYS 40 HB1 CYS 40 49.288 20.642 -0.189 293 H ILE 41 HN ILE 41 47.679 22.471 -0.453 294 HA ILE 41 HA ILE 41 47.828 24.396 -2.650 295 HB ILE 41 HB ILE 41 48.252 25.038 0.307 296 1HG1 ILE 41 HG12 ILE 41 45.833 25.708 0.450 297 2HG1 ILE 41 HG11 ILE 41 45.559 25.174 -1.185 298 1HG2 ILE 41 HG21 ILE 41 47.385 27.256 -0.374 299 2HG2 ILE 41 HG22 ILE 41 47.265 26.674 -2.030 300 3HG2 ILE 41 HG23 ILE 41 48.834 26.828 -1.254 301 1HD1 ILE 41 HD11 ILE 41 44.648 23.590 0.443 302 2HD1 ILE 41 HD12 ILE 41 46.234 23.385 1.169 303 3HD1 ILE 41 HD13 ILE 41 45.918 22.819 -0.466 304 H SER 42 HN SER 42 49.550 25.979 -2.753 305 HA SER 42 HA SER 42 52.185 24.723 -2.712 306 1HB SER 42 HB2 SER 42 52.915 26.972 -3.708 307 2HB SER 42 HB1 SER 42 51.517 26.308 -4.564 308 HG SER 42 HG SER 42 50.222 27.525 -3.023 309 H GLY 43 HN GLY 43 52.581 24.291 -0.665 310 1HA GLY 43 HA2 GLY 43 54.196 25.592 0.984 311 2HA GLY 43 HA1 GLY 43 52.690 26.417 1.403 312 H THR 44 HN THR 44 51.406 23.668 0.661 313 HA THR 44 HA THR 44 51.895 22.334 3.289 314 HB THR 44 HB THR 44 49.490 21.624 3.244 315 HG1 THR 44 HG1 THR 44 49.782 22.784 0.713 316 1HG2 THR 44 HG21 THR 44 49.748 24.608 2.656 317 2HG2 THR 44 HG22 THR 44 50.006 23.872 4.234 318 3HG2 THR 44 HG23 THR 44 48.413 23.818 3.488 319 H VAL 45 HN VAL 45 51.736 20.167 3.332 320 HA VAL 45 HA VAL 45 51.928 18.700 0.758 321 HB VAL 45 HB VAL 45 53.700 17.234 1.862 322 1HG1 VAL 45 HG11 VAL 45 55.491 18.879 1.439 323 2HG1 VAL 45 HG12 VAL 45 54.318 20.182 1.528 324 3HG1 VAL 45 HG13 VAL 45 54.197 18.970 0.264 325 1HG2 VAL 45 HG21 VAL 45 54.956 18.202 3.774 326 2HG2 VAL 45 HG22 VAL 45 53.292 17.938 4.252 327 3HG2 VAL 45 HG23 VAL 45 53.857 19.552 3.830 328 H LEU 46 HN LEU 46 50.836 16.993 0.561 329 HA LEU 46 HA LEU 46 48.785 16.184 2.316 330 1HB LEU 46 HB2 LEU 46 48.918 15.779 -0.172 331 2HB LEU 46 HB1 LEU 46 50.161 14.597 0.096 332 HG LEU 46 HG LEU 46 48.498 13.261 1.467 333 1HD1 LEU 46 HD11 LEU 46 46.084 13.939 1.280 334 2HD1 LEU 46 HD12 LEU 46 46.559 15.381 0.420 335 3HD1 LEU 46 HD13 LEU 46 46.998 15.176 2.104 336 1HD2 LEU 46 HD21 LEU 46 48.863 12.747 -0.933 337 2HD2 LEU 46 HD22 LEU 46 47.641 13.925 -1.383 338 3HD2 LEU 46 HD23 LEU 46 47.185 12.482 -0.495 339 H LYS 47 HN LYS 47 49.276 15.602 4.297 340 HA LYS 47 HA LYS 47 51.196 14.777 5.781 341 1HB LYS 47 HB2 LYS 47 48.872 14.690 6.521 342 2HB LYS 47 HB1 LYS 47 48.602 13.226 5.613 343 1HG LYS 47 HG2 LYS 47 48.924 12.736 8.021 344 2HG LYS 47 HG1 LYS 47 50.145 11.959 7.049 345 1HD LYS 47 HD2 LYS 47 51.152 12.942 9.066 346 2HD LYS 47 HD1 LYS 47 51.780 13.753 7.654 347 1HE LYS 47 HE2 LYS 47 50.174 15.636 8.035 348 2HE LYS 47 HE1 LYS 47 49.553 14.803 9.456 349 1HZ LYS 47 HZ1 LYS 47 51.224 16.488 9.970 350 2HZ LYS 47 HZ2 LYS 47 52.373 15.621 9.069 351 3HZ LYS 47 HZ3 LYS 47 51.701 14.936 10.469 352 H SER 48 HN SER 48 49.803 12.247 3.709 353 HA SER 48 HA SER 48 52.422 10.813 3.779 354 1HB SER 48 HB2 SER 48 49.661 9.523 4.194 355 2HB SER 48 HB1 SER 48 51.195 8.640 4.104 356 HG SER 48 HG SER 48 51.837 10.287 5.799 357 H LYS 49 HN LYS 49 52.360 8.979 2.254 358 HA LYS 49 HA LYS 49 52.555 9.725 -0.353 359 1HB LYS 49 HB2 LYS 49 51.600 7.032 0.665 360 2HB LYS 49 HB1 LYS 49 52.193 7.311 -0.959 361 1HG LYS 49 HG2 LYS 49 53.799 7.759 1.602 362 2HG LYS 49 HG1 LYS 49 53.976 6.397 0.515 363 1HD LYS 49 HD2 LYS 49 54.627 7.953 -1.338 364 2HD LYS 49 HD1 LYS 49 54.494 9.319 -0.245 365 1HE LYS 49 HE2 LYS 49 56.225 8.387 1.206 366 2HE LYS 49 HE1 LYS 49 56.422 7.018 0.114 367 1HZ LYS 49 HZ1 LYS 49 56.572 9.194 -1.513 368 2HZ LYS 49 HZ2 LYS 49 57.880 8.278 -0.935 369 3HZ LYS 49 HZ3 LYS 49 57.403 9.684 -0.115 370 H ASP 50 HN ASP 50 49.575 9.130 1.238 371 HA ASP 50 HA ASP 50 48.114 10.337 -0.928 372 1HB ASP 50 HB2 ASP 50 48.461 8.018 -1.906 373 2HB ASP 50 HB1 ASP 50 47.705 7.315 -0.490 374 H SER 51 HN SER 51 48.119 11.251 1.444 375 HA SER 51 HA SER 51 46.032 10.159 3.210 376 1HB SER 51 HB2 SER 51 48.111 11.342 4.073 377 2HB SER 51 HB1 SER 51 47.538 12.841 3.334 378 HG SER 51 HG SER 51 45.909 11.310 5.046 379 H SER 52 HN SER 52 44.886 12.781 3.848 380 HA SER 52 HA SER 52 43.369 13.454 1.362 381 1HB SER 52 HB2 SER 52 41.979 11.902 2.767 382 2HB SER 52 HB1 SER 52 42.152 13.016 4.132 383 HG SER 52 HG SER 52 41.231 13.842 1.592 384 H GLU 53 HN GLU 53 44.931 14.419 4.227 385 HA GLU 53 HA GLU 53 44.268 17.293 3.705 386 1HB GLU 53 HB2 GLU 53 44.694 15.941 6.405 387 2HB GLU 53 HB1 GLU 53 44.440 17.663 6.165 388 1HG GLU 53 HG2 GLU 53 42.220 17.184 5.124 389 2HG GLU 53 HG1 GLU 53 42.455 15.467 5.392 390 H CYS 54 HN CYS 54 45.859 18.660 3.677 391 HA CYS 54 HA CYS 54 48.636 17.617 3.809 392 1HB CYS 54 HB2 CYS 54 47.625 20.204 2.623 393 2HB CYS 54 HB1 CYS 54 49.185 19.479 2.369 394 H VAL 55 HN VAL 55 50.256 18.992 4.674 395 HA VAL 55 HA VAL 55 49.487 21.103 6.584 396 HB VAL 55 HB VAL 55 50.768 20.035 8.403 397 1HG1 VAL 55 HG11 VAL 55 48.631 18.120 7.339 398 2HG1 VAL 55 HG12 VAL 55 48.314 19.524 8.345 399 3HG1 VAL 55 HG13 VAL 55 49.205 18.159 8.995 400 1HG2 VAL 55 HG21 VAL 55 51.514 17.764 8.388 401 2HG2 VAL 55 HG22 VAL 55 52.382 18.803 7.279 402 3HG2 VAL 55 HG23 VAL 55 51.189 17.660 6.660 403 H HIS 56 HN HIS 56 51.240 22.521 6.963 404 HA HIS 56 HA HIS 56 53.118 22.814 4.911 405 1HB HIS 56 HB2 HIS 56 53.275 23.808 7.789 406 2HB HIS 56 HB1 HIS 56 54.270 24.428 6.482 407 HD1 HIS 56 HD1 HIS 56 52.976 25.762 4.647 408 HD2 HIS 56 HD2 HIS 56 50.568 24.642 7.748 409 HE1 HIS 56 HE1 HIS 56 50.890 27.057 4.410 410 HA PRO 57 HA PRO 57 56.428 19.985 5.582 411 1HB PRO 57 HB2 PRO 57 58.607 21.549 4.935 412 2HB PRO 57 HB1 PRO 57 57.514 20.897 3.737 413 1HG PRO 57 HG2 PRO 57 57.496 23.618 4.979 414 2HG PRO 57 HG1 PRO 57 57.356 23.164 3.269 415 1HD PRO 57 HD2 PRO 57 55.207 23.788 4.666 416 2HD PRO 57 HD1 PRO 57 55.157 22.448 3.503 417 H SER 58 HN SER 58 56.282 22.977 7.226 418 HA SER 58 HA SER 58 58.418 22.391 9.145 419 1HB SER 58 HB2 SER 58 57.768 24.651 10.077 420 2HB SER 58 HB1 SER 58 58.079 24.712 8.336 421 HG SER 58 HG SER 58 55.541 24.256 9.519 422 H LYS 59 HN LYS 59 55.125 21.594 8.977 423 HA LYS 59 HA LYS 59 54.993 21.290 11.958 424 1HB LYS 59 HB2 LYS 59 52.566 21.353 11.732 425 2HB LYS 59 HB1 LYS 59 53.300 22.841 11.140 426 1HG LYS 59 HG2 LYS 59 53.077 21.994 8.836 427 2HG LYS 59 HG1 LYS 59 52.324 20.541 9.450 428 1HD LYS 59 HD2 LYS 59 51.292 23.418 9.731 429 2HD LYS 59 HD1 LYS 59 50.596 22.206 8.686 430 1HE LYS 59 HE2 LYS 59 50.598 22.119 11.739 431 2HE LYS 59 HE1 LYS 59 49.226 22.424 10.696 432 1HZ LYS 59 HZ1 LYS 59 50.768 19.931 10.446 433 2HZ LYS 59 HZ2 LYS 59 49.178 20.267 9.953 434 3HZ LYS 59 HZ3 LYS 59 49.537 20.099 11.603 435 H CYS 60 HN CYS 60 54.761 19.620 8.956 436 HA CYS 60 HA CYS 60 53.299 17.361 9.402 437 1HB CYS 60 HB2 CYS 60 55.929 17.771 8.150 438 2HB CYS 60 HB1 CYS 60 55.353 16.130 8.219 Start of MODEL 5 1 1H ASN 1 HT1 ASN 1 33.979 17.178 -9.983 2 2H ASN 1 HT2 ASN 1 34.561 17.318 -11.573 3 3H ASN 1 HT3 ASN 1 33.026 17.928 -11.172 4 HA ASN 1 HA ASN 1 34.596 19.723 -11.369 5 1HB ASN 1 HB2 ASN 1 33.853 19.141 -8.458 6 2HB ASN 1 HB1 ASN 1 34.269 20.722 -9.110 7 1HD2 ASN 1 HD21 ASN 1 31.866 18.089 -9.416 8 2HD2 ASN 1 HD22 ASN 1 30.611 19.086 -9.977 9 H PHE 2 HN PHE 2 36.465 20.788 -10.444 10 HA PHE 2 HA PHE 2 38.660 18.880 -9.931 11 1HB PHE 2 HB2 PHE 2 38.728 21.910 -10.344 12 2HB PHE 2 HB1 PHE 2 40.118 20.837 -10.371 13 HD1 PHE 2 HD1 PHE 2 37.576 22.342 -12.350 14 HD2 PHE 2 HD2 PHE 2 40.037 18.866 -12.127 15 HE1 PHE 2 HE1 PHE 2 37.199 21.918 -14.735 16 HE2 PHE 2 HE2 PHE 2 39.658 18.450 -14.513 17 HZ PHE 2 HZ PHE 2 38.238 19.972 -15.822 18 H VAL 3 HN VAL 3 36.666 19.400 -7.901 19 HA VAL 3 HA VAL 3 37.828 21.022 -5.791 20 HB VAL 3 HB VAL 3 36.012 20.030 -4.376 21 1HG1 VAL 3 HG11 VAL 3 35.100 20.897 -7.147 22 2HG1 VAL 3 HG12 VAL 3 35.506 21.967 -5.817 23 3HG1 VAL 3 HG13 VAL 3 34.109 20.912 -5.697 24 1HG2 VAL 3 HG21 VAL 3 36.013 17.727 -5.331 25 2HG2 VAL 3 HG22 VAL 3 35.383 18.344 -6.848 26 3HG2 VAL 3 HG23 VAL 3 34.408 18.428 -5.392 27 H CYS 4 HN CYS 4 38.095 20.145 -3.652 28 HA CYS 4 HA CYS 4 39.670 17.616 -3.561 29 1HB CYS 4 HB2 CYS 4 40.247 20.276 -2.353 30 2HB CYS 4 HB1 CYS 4 41.128 18.856 -1.918 31 HA PRO 5 HA PRO 5 37.953 17.725 0.752 32 1HB PRO 5 HB2 PRO 5 40.177 16.360 1.917 33 2HB PRO 5 HB1 PRO 5 38.636 15.683 1.487 34 1HG PRO 5 HG2 PRO 5 41.014 15.019 0.240 35 2HG PRO 5 HG1 PRO 5 39.410 14.797 -0.484 36 1HD PRO 5 HD2 PRO 5 41.363 17.040 -0.853 37 2HD PRO 5 HD1 PRO 5 40.412 16.195 -2.087 38 HA PRO 6 HA PRO 6 40.077 20.865 3.194 39 1HB PRO 6 HB2 PRO 6 40.839 19.359 5.454 40 2HB PRO 6 HB1 PRO 6 39.320 20.193 5.251 41 1HG PRO 6 HG2 PRO 6 39.942 17.311 4.660 42 2HG PRO 6 HG1 PRO 6 38.519 18.000 5.462 43 1HD PRO 6 HD2 PRO 6 38.330 17.238 3.015 44 2HD PRO 6 HD1 PRO 6 37.656 18.814 3.423 45 H GLY 7 HN GLY 7 42.135 21.614 3.558 46 1HA GLY 7 HA2 GLY 7 44.491 21.579 3.715 47 2HA GLY 7 HA1 GLY 7 44.455 19.831 3.568 48 H GLN 8 HN GLN 8 42.779 20.055 1.087 49 HA GLN 8 HA GLN 8 44.903 20.888 -0.833 50 1HB GLN 8 HB2 GLN 8 42.849 18.652 -0.998 51 2HB GLN 8 HB1 GLN 8 43.930 19.092 -2.315 52 1HG GLN 8 HG2 GLN 8 45.850 18.529 -0.918 53 2HG GLN 8 HG1 GLN 8 44.801 18.135 0.447 54 1HE2 GLN 8 HE21 GLN 8 43.260 16.280 0.083 55 2HE2 GLN 8 HE22 GLN 8 43.716 15.036 -0.978 56 H THR 9 HN THR 9 44.177 21.596 -2.844 57 HA THR 9 HA THR 9 41.407 22.489 -3.238 58 HB THR 9 HB THR 9 42.382 24.327 -1.817 59 HG1 THR 9 HG1 THR 9 42.350 25.245 -4.462 60 1HG2 THR 9 HG21 THR 9 44.815 24.007 -2.550 61 2HG2 THR 9 HG22 THR 9 44.279 25.676 -2.699 62 3HG2 THR 9 HG23 THR 9 44.387 24.653 -4.121 63 H PHE 10 HN PHE 10 41.765 24.109 -5.359 64 HA PHE 10 HA PHE 10 42.388 22.345 -7.486 65 1HB PHE 10 HB2 PHE 10 41.027 24.379 -7.859 66 2HB PHE 10 HB1 PHE 10 42.407 25.408 -7.495 67 HD1 PHE 10 HD1 PHE 10 41.356 22.645 -9.821 68 HD2 PHE 10 HD2 PHE 10 43.822 26.076 -9.264 69 HE1 PHE 10 HE1 PHE 10 42.073 22.516 -12.164 70 HE2 PHE 10 HE2 PHE 10 44.535 25.942 -11.604 71 HZ PHE 10 HZ PHE 10 43.668 24.168 -13.058 72 H GLN 11 HN GLN 11 44.127 22.398 -8.987 73 HA GLN 11 HA GLN 11 46.687 23.608 -8.140 74 1HB GLN 11 HB2 GLN 11 46.416 21.171 -7.213 75 2HB GLN 11 HB1 GLN 11 46.475 20.698 -8.907 76 1HG GLN 11 HG2 GLN 11 48.703 20.446 -7.962 77 2HG GLN 11 HG1 GLN 11 48.707 21.715 -9.167 78 1HE2 GLN 11 HE21 GLN 11 47.422 22.190 -5.820 79 2HE2 GLN 11 HE22 GLN 11 48.655 23.240 -5.361 80 H THR 12 HN THR 12 48.031 23.828 -9.840 81 HA THR 12 HA THR 12 46.675 23.575 -12.463 82 HB THR 12 HB THR 12 49.225 25.127 -11.690 83 HG1 THR 12 HG1 THR 12 46.456 25.744 -11.939 84 1HG2 THR 12 HG21 THR 12 48.781 24.530 -14.131 85 2HG2 THR 12 HG22 THR 12 48.669 26.264 -13.798 86 3HG2 THR 12 HG23 THR 12 47.199 25.292 -13.958 87 H CYS 13 HN CYS 13 49.730 22.857 -10.821 88 HA CYS 13 HA CYS 13 50.249 20.888 -12.933 89 1HB CYS 13 HB2 CYS 13 52.167 22.499 -11.304 90 2HB CYS 13 HB1 CYS 13 52.691 21.085 -12.189 91 H ALA 14 HN ALA 14 49.684 19.089 -12.414 92 HA ALA 14 HA ALA 14 50.850 17.620 -10.157 93 1HB ALA 14 HB1 ALA 14 48.595 18.421 -9.382 94 2HB ALA 14 HB2 ALA 14 48.574 16.679 -9.573 95 3HB ALA 14 HB3 ALA 14 47.853 17.709 -10.791 96 H SER 15 HN SER 15 50.035 15.225 -10.295 97 HA SER 15 HA SER 15 49.791 14.178 -13.036 98 1HB SER 15 HB2 SER 15 52.331 14.665 -12.676 99 2HB SER 15 HB1 SER 15 52.248 13.464 -11.410 100 HG SER 15 HG SER 15 51.574 13.087 -14.109 101 H SER 16 HN SER 16 51.315 11.943 -11.170 102 HA SER 16 HA SER 16 48.865 11.124 -9.711 103 1HB SER 16 HB2 SER 16 50.790 9.324 -11.305 104 2HB SER 16 HB1 SER 16 49.406 8.739 -10.364 105 HG SER 16 HG SER 16 48.167 10.332 -11.629 106 H CYS 17 HN CYS 17 51.580 12.448 -9.364 107 HA CYS 17 HA CYS 17 52.823 10.887 -7.154 108 1HB CYS 17 HB2 CYS 17 54.780 12.526 -7.746 109 2HB CYS 17 HB1 CYS 17 54.442 11.154 -8.772 110 HA PRO 18 HA PRO 18 50.757 14.526 -5.104 111 1HB PRO 18 HB2 PRO 18 50.489 13.133 -2.694 112 2HB PRO 18 HB1 PRO 18 49.250 13.352 -3.901 113 1HG PRO 18 HG2 PRO 18 51.026 11.014 -3.452 114 2HG PRO 18 HG1 PRO 18 49.336 11.057 -3.982 115 1HD PRO 18 HD2 PRO 18 51.368 10.563 -5.667 116 2HD PRO 18 HD1 PRO 18 49.910 11.428 -6.189 117 H LYS 19 HN LYS 19 51.758 16.005 -3.921 118 HA LYS 19 HA LYS 19 54.535 15.483 -3.062 119 1HB LYS 19 HB2 LYS 19 53.943 17.599 -4.282 120 2HB LYS 19 HB1 LYS 19 52.833 18.026 -2.991 121 1HG LYS 19 HG2 LYS 19 54.904 17.841 -1.412 122 2HG LYS 19 HG1 LYS 19 55.853 17.675 -2.857 123 1HD LYS 19 HD2 LYS 19 55.890 19.977 -2.018 124 2HD LYS 19 HD1 LYS 19 55.290 19.887 -3.657 125 1HE LYS 19 HE2 LYS 19 52.934 20.071 -2.761 126 2HE LYS 19 HE1 LYS 19 53.586 20.166 -1.136 127 1HZ LYS 19 HZ1 LYS 19 54.934 22.105 -2.127 128 2HZ LYS 19 HZ2 LYS 19 53.312 22.337 -1.678 129 3HZ LYS 19 HZ3 LYS 19 53.718 22.109 -3.312 130 H THR 20 HN THR 20 54.486 14.356 -1.230 131 HA THR 20 HA THR 20 52.624 15.113 0.966 132 HB THR 20 HB THR 20 53.009 12.820 1.814 133 HG1 THR 20 HG1 THR 20 54.965 13.005 -0.212 134 1HG2 THR 20 HG21 THR 20 51.414 12.953 -0.274 135 2HG2 THR 20 HG22 THR 20 52.275 11.442 -0.158 136 3HG2 THR 20 HG23 THR 20 52.820 12.669 -1.270 137 H CYS 21 HN CYS 21 53.694 14.301 3.164 138 HA CYS 21 HA CYS 21 55.739 16.187 3.812 139 1HB CYS 21 HB2 CYS 21 55.021 13.599 5.212 140 2HB CYS 21 HB1 CYS 21 56.055 14.814 5.884 141 H GLU 22 HN GLU 22 55.780 13.101 2.437 142 HA GLU 22 HA GLU 22 58.478 12.273 3.023 143 1HB GLU 22 HB2 GLU 22 56.800 11.568 0.560 144 2HB GLU 22 HB1 GLU 22 58.132 10.643 1.215 145 1HG GLU 22 HG2 GLU 22 55.481 11.135 2.647 146 2HG GLU 22 HG1 GLU 22 55.965 9.645 1.880 147 H THR 23 HN THR 23 56.956 13.922 0.298 148 HA THR 23 HA THR 23 59.491 14.455 -1.066 149 HB THR 23 HB THR 23 57.991 15.749 -2.669 150 HG1 THR 23 HG1 THR 23 56.319 16.418 -1.554 151 1HG2 THR 23 HG21 THR 23 58.225 13.220 -2.936 152 2HG2 THR 23 HG22 THR 23 56.651 13.827 -3.435 153 3HG2 THR 23 HG23 THR 23 56.830 13.028 -1.879 154 H ARG 24 HN ARG 24 57.058 16.949 -0.409 155 HA ARG 24 HA ARG 24 57.211 19.096 0.418 156 1HB ARG 24 HB2 ARG 24 59.800 18.116 1.706 157 2HB ARG 24 HB1 ARG 24 59.016 19.633 2.040 158 1HG ARG 24 HG2 ARG 24 57.028 18.516 2.870 159 2HG ARG 24 HG1 ARG 24 57.661 16.945 2.401 160 1HD ARG 24 HD2 ARG 24 58.890 18.773 4.535 161 2HD ARG 24 HD1 ARG 24 57.921 17.349 4.851 162 HE ARG 24 HE ARG 24 59.674 15.963 4.031 163 1HH1 ARG 24 HH11 ARG 24 60.496 19.341 3.937 164 2HH1 ARG 24 HH12 ARG 24 62.187 19.027 3.752 165 1HH2 ARG 24 HH21 ARG 24 61.802 15.564 3.793 166 2HH2 ARG 24 HH22 ARG 24 62.938 16.867 3.667 167 H ASN 25 HN ASN 25 59.632 17.788 -1.421 168 HA ASN 25 HA ASN 25 61.425 19.858 -1.868 169 1HB ASN 25 HB2 ASN 25 60.500 17.608 -3.705 170 2HB ASN 25 HB1 ASN 25 61.985 18.511 -3.918 171 1HD2 ASN 25 HD21 ASN 25 62.142 18.470 -0.740 172 2HD2 ASN 25 HD22 ASN 25 62.822 16.942 -0.454 173 H LYS 26 HN LYS 26 58.428 19.161 -3.697 174 HA LYS 26 HA LYS 26 58.848 21.479 -5.420 175 1HB LYS 26 HB2 LYS 26 56.569 19.447 -5.262 176 2HB LYS 26 HB1 LYS 26 56.658 20.724 -6.438 177 1HG LYS 26 HG2 LYS 26 57.359 18.676 -7.489 178 2HG LYS 26 HG1 LYS 26 58.735 19.742 -7.368 179 1HD LYS 26 HD2 LYS 26 59.325 17.405 -6.839 180 2HD LYS 26 HD1 LYS 26 59.647 18.454 -5.488 181 1HE LYS 26 HE2 LYS 26 58.530 16.328 -4.786 182 2HE LYS 26 HE1 LYS 26 57.480 17.684 -4.424 183 1HZ LYS 26 HZ1 LYS 26 57.290 16.148 -6.943 184 2HZ LYS 26 HZ2 LYS 26 56.153 17.222 -6.281 185 3HZ LYS 26 HZ3 LYS 26 56.434 15.722 -5.538 186 H LEU 27 HN LEU 27 56.811 22.610 -5.815 187 HA LEU 27 HA LEU 27 55.444 23.535 -3.328 188 1HB LEU 27 HB2 LEU 27 56.358 25.325 -5.659 189 2HB LEU 27 HB1 LEU 27 55.432 25.878 -4.287 190 HG LEU 27 HG LEU 27 57.402 25.312 -2.800 191 1HD1 LEU 27 HD11 LEU 27 58.675 23.726 -4.263 192 2HD1 LEU 27 HD12 LEU 27 59.642 25.099 -3.820 193 3HD1 LEU 27 HD13 LEU 27 58.927 25.013 -5.419 194 1HD2 LEU 27 HD21 LEU 27 57.868 27.343 -5.018 195 2HD2 LEU 27 HD22 LEU 27 58.686 27.339 -3.463 196 3HD2 LEU 27 HD23 LEU 27 56.955 27.614 -3.542 197 H VAL 28 HN VAL 28 54.852 21.719 -5.180 198 HA VAL 28 HA VAL 28 52.067 22.306 -5.907 199 HB VAL 28 HB VAL 28 52.358 21.542 -8.307 200 1HG1 VAL 28 HG11 VAL 28 53.313 23.631 -9.227 201 2HG1 VAL 28 HG12 VAL 28 54.023 24.031 -7.679 202 3HG1 VAL 28 HG13 VAL 28 52.276 24.006 -7.864 203 1HG2 VAL 28 HG21 VAL 28 54.527 20.351 -8.008 204 2HG2 VAL 28 HG22 VAL 28 55.332 21.881 -7.715 205 3HG2 VAL 28 HG23 VAL 28 54.645 21.542 -9.292 206 H LEU 29 HN LEU 29 51.095 20.376 -6.919 207 HA LEU 29 HA LEU 29 51.410 18.141 -5.226 208 1HB LEU 29 HB2 LEU 29 49.372 18.902 -6.448 209 2HB LEU 29 HB1 LEU 29 50.135 18.487 -7.947 210 HG LEU 29 HG LEU 29 48.391 16.828 -7.250 211 1HD1 LEU 29 HD11 LEU 29 49.652 14.713 -7.347 212 2HD1 LEU 29 HD12 LEU 29 51.145 15.551 -7.014 213 3HD1 LEU 29 HD13 LEU 29 50.292 15.859 -8.510 214 1HD2 LEU 29 HD21 LEU 29 50.103 16.450 -4.765 215 2HD2 LEU 29 HD22 LEU 29 48.691 15.491 -5.176 216 3HD2 LEU 29 HD23 LEU 29 48.530 17.199 -4.824 217 H CYS 30 HN CYS 30 52.291 18.677 -8.460 218 HA CYS 30 HA CYS 30 54.704 16.943 -8.336 219 1HB CYS 30 HB2 CYS 30 52.719 16.671 -10.599 220 2HB CYS 30 HB1 CYS 30 54.249 15.882 -10.481 221 H ASP 31 HN ASP 31 56.198 17.425 -9.980 222 HA ASP 31 HA ASP 31 55.782 20.070 -11.318 223 1HB ASP 31 HB2 ASP 31 57.586 19.977 -9.613 224 2HB ASP 31 HB1 ASP 31 58.347 18.659 -10.489 225 H LYS 32 HN LYS 32 56.489 16.756 -11.777 226 HA LYS 32 HA LYS 32 57.732 16.741 -14.326 227 1HB LYS 32 HB2 LYS 32 55.846 14.707 -13.091 228 2HB LYS 32 HB1 LYS 32 56.904 14.384 -14.454 229 1HG LYS 32 HG2 LYS 32 58.895 14.909 -13.050 230 2HG LYS 32 HG1 LYS 32 57.859 15.234 -11.677 231 1HD LYS 32 HD2 LYS 32 58.086 12.550 -13.100 232 2HD LYS 32 HD1 LYS 32 58.844 12.951 -11.573 233 1HE LYS 32 HE2 LYS 32 56.591 13.319 -10.551 234 2HE LYS 32 HE1 LYS 32 55.830 12.875 -12.075 235 1HZ LYS 32 HZ1 LYS 32 57.593 11.138 -10.462 236 2HZ LYS 32 HZ2 LYS 32 56.874 10.720 -11.942 237 3HZ LYS 32 HZ3 LYS 32 55.902 11.024 -10.580 238 H LYS 33 HN LYS 33 54.330 16.253 -13.552 239 HA LYS 33 HA LYS 33 53.549 17.160 -16.308 240 1HB LYS 33 HB2 LYS 33 53.145 14.719 -15.943 241 2HB LYS 33 HB1 LYS 33 52.194 15.101 -14.527 242 1HG LYS 33 HG2 LYS 33 50.524 16.201 -15.746 243 2HG LYS 33 HG1 LYS 33 51.442 16.163 -17.243 244 1HD LYS 33 HD2 LYS 33 51.330 13.583 -17.050 245 2HD LYS 33 HD1 LYS 33 50.270 13.801 -15.670 246 1HE LYS 33 HE2 LYS 33 48.650 15.055 -17.161 247 2HE LYS 33 HE1 LYS 33 49.729 14.759 -18.509 248 1HZ LYS 33 HZ1 LYS 33 47.995 13.139 -18.463 249 2HZ LYS 33 HZ2 LYS 33 48.392 12.691 -16.873 250 3HZ LYS 33 HZ3 LYS 33 49.483 12.386 -18.138 251 H CYS 34 HN CYS 34 51.414 18.115 -16.435 252 HA CYS 34 HA CYS 34 50.725 19.458 -13.921 253 1HB CYS 34 HB2 CYS 34 50.970 20.676 -16.629 254 2HB CYS 34 HB1 CYS 34 50.213 21.507 -15.291 255 H ASN 35 HN ASN 35 49.206 17.966 -13.760 256 HA ASN 35 HA ASN 35 46.752 17.857 -15.345 257 1HB ASN 35 HB2 ASN 35 47.092 16.905 -12.444 258 2HB ASN 35 HB1 ASN 35 45.798 16.471 -13.531 259 1HD2 ASN 35 HD21 ASN 35 46.977 14.386 -12.349 260 2HD2 ASN 35 HD22 ASN 35 48.014 13.561 -13.387 261 H GLN 36 HN GLN 36 45.215 19.416 -15.232 262 HA GLN 36 HA GLN 36 45.244 21.408 -13.021 263 1HB GLN 36 HB2 GLN 36 43.560 21.194 -15.574 264 2HB GLN 36 HB1 GLN 36 43.527 22.561 -14.475 265 1HG GLN 36 HG2 GLN 36 45.975 22.942 -14.910 266 2HG GLN 36 HG1 GLN 36 45.976 21.588 -16.033 267 1HE2 GLN 36 HE21 GLN 36 44.721 21.821 -18.040 268 2HE2 GLN 36 HE22 GLN 36 44.305 23.362 -18.617 269 H ARG 37 HN ARG 37 44.733 19.926 -11.486 270 HA ARG 37 HA ARG 37 41.839 19.475 -11.079 271 1HB ARG 37 HB2 ARG 37 42.192 17.042 -10.535 272 2HB ARG 37 HB1 ARG 37 42.720 17.365 -12.161 273 1HG ARG 37 HG2 ARG 37 45.075 17.586 -11.413 274 2HG ARG 37 HG1 ARG 37 44.601 17.338 -9.750 275 1HD ARG 37 HD2 ARG 37 43.774 15.037 -10.365 276 2HD ARG 37 HD1 ARG 37 44.399 15.304 -11.989 277 HE ARG 37 HE ARG 37 46.593 15.084 -11.164 278 1HH1 ARG 37 HH11 ARG 37 44.321 15.427 -8.564 279 2HH1 ARG 37 HH12 ARG 37 45.490 15.045 -7.345 280 1HH2 ARG 37 HH21 ARG 37 48.089 14.607 -9.621 281 2HH2 ARG 37 HH22 ARG 37 47.642 14.570 -7.949 282 H CYS 38 HN CYS 38 42.386 17.748 -8.805 283 HA CYS 38 HA CYS 38 42.887 19.834 -6.846 284 1HB CYS 38 HB2 CYS 38 41.298 18.055 -6.303 285 2HB CYS 38 HB1 CYS 38 42.540 16.831 -6.483 286 H GLY 39 HN GLY 39 44.443 19.697 -5.146 287 1HA GLY 39 HA2 GLY 39 46.719 18.063 -5.022 288 2HA GLY 39 HA1 GLY 39 47.145 19.426 -6.057 289 H CYS 40 HN CYS 40 48.134 18.724 -3.341 290 HA CYS 40 HA CYS 40 47.034 20.340 -1.320 291 1HB CYS 40 HB2 CYS 40 49.979 19.782 -1.808 292 2HB CYS 40 HB1 CYS 40 49.318 20.469 -0.359 293 H ILE 41 HN ILE 41 47.560 22.345 -0.582 294 HA ILE 41 HA ILE 41 47.742 24.386 -2.589 295 HB ILE 41 HB ILE 41 48.522 24.845 0.327 296 1HG1 ILE 41 HG12 ILE 41 45.660 24.791 -0.827 297 2HG1 ILE 41 HG11 ILE 41 46.290 23.499 0.169 298 1HG2 ILE 41 HG21 ILE 41 48.749 26.721 -1.299 299 2HG2 ILE 41 HG22 ILE 41 47.468 27.070 -0.167 300 3HG2 ILE 41 HG23 ILE 41 47.077 26.505 -1.782 301 1HD1 ILE 41 HD11 ILE 41 45.931 26.389 1.069 302 2HD1 ILE 41 HD12 ILE 41 46.590 25.089 2.049 303 3HD1 ILE 41 HD13 ILE 41 44.921 25.027 1.510 304 H SER 42 HN SER 42 49.478 25.910 -2.799 305 HA SER 42 HA SER 42 52.081 24.590 -3.038 306 1HB SER 42 HB2 SER 42 51.230 27.494 -3.630 307 2HB SER 42 HB1 SER 42 52.774 26.777 -4.123 308 HG SER 42 HG SER 42 51.488 25.103 -5.129 309 H GLY 43 HN GLY 43 52.573 24.120 -1.014 310 1HA GLY 43 HA2 GLY 43 54.403 25.311 0.485 311 2HA GLY 43 HA1 GLY 43 52.988 26.223 1.032 312 H THR 44 HN THR 44 51.393 23.689 0.413 313 HA THR 44 HA THR 44 51.920 22.304 3.001 314 HB THR 44 HB THR 44 49.514 21.619 2.944 315 HG1 THR 44 HG1 THR 44 49.814 22.805 0.416 316 1HG2 THR 44 HG21 THR 44 48.449 23.826 3.110 317 2HG2 THR 44 HG22 THR 44 49.798 24.583 2.272 318 3HG2 THR 44 HG23 THR 44 50.031 23.888 3.873 319 H VAL 45 HN VAL 45 51.782 20.187 3.106 320 HA VAL 45 HA VAL 45 51.954 18.583 0.607 321 HB VAL 45 HB VAL 45 53.647 17.126 1.788 322 1HG1 VAL 45 HG11 VAL 45 54.356 18.776 0.161 323 2HG1 VAL 45 HG12 VAL 45 55.538 18.598 1.437 324 3HG1 VAL 45 HG13 VAL 45 54.483 20.009 1.405 325 1HG2 VAL 45 HG21 VAL 45 53.845 19.473 3.705 326 2HG2 VAL 45 HG22 VAL 45 54.915 18.095 3.686 327 3HG2 VAL 45 HG23 VAL 45 53.235 17.877 4.133 328 H LEU 46 HN LEU 46 50.848 16.815 0.536 329 HA LEU 46 HA LEU 46 48.763 16.203 2.303 330 1HB LEU 46 HB2 LEU 46 49.044 15.498 -0.112 331 2HB LEU 46 HB1 LEU 46 50.237 14.344 0.412 332 HG LEU 46 HG LEU 46 48.501 13.176 1.778 333 1HD1 LEU 46 HD11 LEU 46 47.008 15.168 2.201 334 2HD1 LEU 46 HD12 LEU 46 46.104 13.867 1.475 335 3HD1 LEU 46 HD13 LEU 46 46.612 15.220 0.494 336 1HD2 LEU 46 HD21 LEU 46 47.215 12.269 -0.160 337 2HD2 LEU 46 HD22 LEU 46 48.910 12.467 -0.571 338 3HD2 LEU 46 HD23 LEU 46 47.724 13.630 -1.138 339 H LYS 47 HN LYS 47 48.712 15.189 4.195 340 HA LYS 47 HA LYS 47 50.724 14.731 5.936 341 1HB LYS 47 HB2 LYS 47 48.257 14.507 6.438 342 2HB LYS 47 HB1 LYS 47 48.282 12.961 5.658 343 1HG LYS 47 HG2 LYS 47 48.380 12.647 8.076 344 2HG LYS 47 HG1 LYS 47 49.797 11.998 7.302 345 1HD LYS 47 HD2 LYS 47 50.482 13.130 9.329 346 2HD LYS 47 HD1 LYS 47 51.084 14.059 7.981 347 1HE LYS 47 HE2 LYS 47 48.571 14.716 9.582 348 2HE LYS 47 HE1 LYS 47 50.123 15.512 9.763 349 1HZ LYS 47 HZ1 LYS 47 49.688 15.803 7.149 350 2HZ LYS 47 HZ2 LYS 47 49.271 16.942 8.333 351 3HZ LYS 47 HZ3 LYS 47 48.099 15.862 7.751 352 H SER 48 HN SER 48 49.646 12.248 3.652 353 HA SER 48 HA SER 48 52.274 10.895 3.892 354 1HB SER 48 HB2 SER 48 49.595 9.458 4.353 355 2HB SER 48 HB1 SER 48 51.173 8.657 4.282 356 HG SER 48 HG SER 48 50.344 10.673 6.084 357 H LYS 49 HN LYS 49 52.170 8.869 2.537 358 HA LYS 49 HA LYS 49 52.531 9.387 -0.096 359 1HB LYS 49 HB2 LYS 49 51.248 6.853 0.986 360 2HB LYS 49 HB1 LYS 49 52.032 6.989 -0.570 361 1HG LYS 49 HG2 LYS 49 53.402 7.352 2.127 362 2HG LYS 49 HG1 LYS 49 53.499 5.928 1.115 363 1HD LYS 49 HD2 LYS 49 54.555 7.315 -0.700 364 2HD LYS 49 HD1 LYS 49 54.513 8.709 0.362 365 1HE LYS 49 HE2 LYS 49 56.741 7.652 0.464 366 2HE LYS 49 HE1 LYS 49 55.936 7.484 2.018 367 1HZ LYS 49 HZ1 LYS 49 55.646 5.368 0.011 368 2HZ LYS 49 HZ2 LYS 49 55.566 5.274 1.704 369 3HZ LYS 49 HZ3 LYS 49 57.068 5.465 0.936 370 H ASP 50 HN ASP 50 49.472 8.978 1.422 371 HA ASP 50 HA ASP 50 48.049 10.203 -0.775 372 1HB ASP 50 HB2 ASP 50 48.390 7.904 -1.762 373 2HB ASP 50 HB1 ASP 50 47.601 7.195 -0.368 374 H SER 51 HN SER 51 47.973 11.156 1.569 375 HA SER 51 HA SER 51 45.819 10.065 3.277 376 1HB SER 51 HB2 SER 51 47.904 11.182 4.210 377 2HB SER 51 HB1 SER 51 47.360 12.707 3.501 378 HG SER 51 HG SER 51 45.864 12.858 4.950 379 H SER 52 HN SER 52 44.760 12.738 3.916 380 HA SER 52 HA SER 52 43.268 13.424 1.421 381 1HB SER 52 HB2 SER 52 41.190 13.613 2.835 382 2HB SER 52 HB1 SER 52 41.849 11.972 2.897 383 HG SER 52 HG SER 52 43.121 12.837 4.746 384 H GLU 53 HN GLU 53 44.719 14.465 4.372 385 HA GLU 53 HA GLU 53 44.150 17.325 3.678 386 1HB GLU 53 HB2 GLU 53 44.555 16.088 6.427 387 2HB GLU 53 HB1 GLU 53 44.337 17.803 6.115 388 1HG GLU 53 HG2 GLU 53 42.118 17.342 5.099 389 2HG GLU 53 HG1 GLU 53 42.317 15.625 5.408 390 H CYS 54 HN CYS 54 45.734 18.638 3.444 391 HA CYS 54 HA CYS 54 48.518 17.657 3.700 392 1HB CYS 54 HB2 CYS 54 47.491 20.185 2.397 393 2HB CYS 54 HB1 CYS 54 49.064 19.470 2.193 394 H VAL 55 HN VAL 55 50.102 19.081 4.461 395 HA VAL 55 HA VAL 55 49.435 21.284 6.274 396 HB VAL 55 HB VAL 55 50.820 20.188 8.126 397 1HG1 VAL 55 HG11 VAL 55 48.961 18.696 8.946 398 2HG1 VAL 55 HG12 VAL 55 48.278 18.630 7.335 399 3HG1 VAL 55 HG13 VAL 55 48.276 20.140 8.230 400 1HG2 VAL 55 HG21 VAL 55 51.106 17.739 8.099 401 2HG2 VAL 55 HG22 VAL 55 51.986 18.506 6.797 402 3HG2 VAL 55 HG23 VAL 55 50.479 17.676 6.460 403 H HIS 56 HN HIS 56 51.216 22.662 6.558 404 HA HIS 56 HA HIS 56 53.220 22.582 4.539 405 1HB HIS 56 HB2 HIS 56 53.239 24.046 7.212 406 2HB HIS 56 HB1 HIS 56 54.330 24.410 5.894 407 HD1 HIS 56 HD1 HIS 56 53.277 25.653 3.901 408 HD2 HIS 56 HD2 HIS 56 50.527 24.863 6.811 409 HE1 HIS 56 HE1 HIS 56 51.275 26.979 3.341 410 HA PRO 57 HA PRO 57 56.394 19.863 6.006 411 1HB PRO 57 HB2 PRO 57 58.645 21.511 5.731 412 2HB PRO 57 HB1 PRO 57 57.921 20.574 4.454 413 1HG PRO 57 HG2 PRO 57 57.496 23.453 5.106 414 2HG PRO 57 HG1 PRO 57 57.723 22.680 3.527 415 1HD PRO 57 HD2 PRO 57 55.324 23.402 4.326 416 2HD PRO 57 HD1 PRO 57 55.543 21.860 3.479 417 H SER 58 HN SER 58 56.003 23.018 7.372 418 HA SER 58 HA SER 58 57.708 22.702 9.666 419 1HB SER 58 HB2 SER 58 56.410 24.737 10.504 420 2HB SER 58 HB1 SER 58 57.039 24.944 8.866 421 HG SER 58 HG SER 58 54.938 23.980 8.219 422 H LYS 59 HN LYS 59 54.556 21.547 8.993 423 HA LYS 59 HA LYS 59 54.000 20.964 11.860 424 1HB LYS 59 HB2 LYS 59 52.377 20.327 9.376 425 2HB LYS 59 HB1 LYS 59 51.856 19.988 11.010 426 1HG LYS 59 HG2 LYS 59 50.728 21.989 10.354 427 2HG LYS 59 HG1 LYS 59 51.995 22.463 11.479 428 1HD LYS 59 HD2 LYS 59 53.402 23.230 9.722 429 2HD LYS 59 HD1 LYS 59 52.305 22.640 8.485 430 1HE LYS 59 HE2 LYS 59 51.714 24.810 10.560 431 2HE LYS 59 HE1 LYS 59 52.053 25.104 8.863 432 1HZ LYS 59 HZ1 LYS 59 49.689 23.862 10.086 433 2HZ LYS 59 HZ2 LYS 59 50.093 23.524 8.471 434 3HZ LYS 59 HZ3 LYS 59 49.778 25.123 8.952 435 H CYS 60 HN CYS 60 54.432 19.425 8.731 436 HA CYS 60 HA CYS 60 54.299 16.725 9.401 437 1HB CYS 60 HB2 CYS 60 56.029 18.216 7.503 438 2HB CYS 60 HB1 CYS 60 56.119 16.474 7.544 Start of MODEL 6 1 1H ASN 1 HT1 ASN 1 34.654 15.302 -10.902 2 2H ASN 1 HT2 ASN 1 35.574 15.874 -12.210 3 3H ASN 1 HT3 ASN 1 33.938 16.311 -12.064 4 HA ASN 1 HA ASN 1 35.346 18.136 -11.414 5 1HB ASN 1 HB2 ASN 1 33.968 16.795 -9.033 6 2HB ASN 1 HB1 ASN 1 34.402 18.498 -9.120 7 1HD2 ASN 1 HD21 ASN 1 32.322 16.011 -10.612 8 2HD2 ASN 1 HD22 ASN 1 31.193 17.106 -11.253 9 H PHE 2 HN PHE 2 36.986 18.948 -10.131 10 HA PHE 2 HA PHE 2 38.939 16.927 -9.129 11 1HB PHE 2 HB2 PHE 2 39.281 19.891 -9.823 12 2HB PHE 2 HB1 PHE 2 40.587 18.770 -9.425 13 HD1 PHE 2 HD1 PHE 2 40.495 16.470 -10.779 14 HD2 PHE 2 HD2 PHE 2 38.718 20.110 -12.102 15 HE1 PHE 2 HE1 PHE 2 40.471 15.618 -13.055 16 HE2 PHE 2 HE2 PHE 2 38.690 19.264 -14.387 17 HZ PHE 2 HZ PHE 2 39.573 17.012 -14.893 18 H VAL 3 HN VAL 3 36.707 17.399 -7.743 19 HA VAL 3 HA VAL 3 36.914 19.235 -5.575 20 HB VAL 3 HB VAL 3 34.797 18.288 -6.340 21 1HG1 VAL 3 HG11 VAL 3 35.603 16.053 -7.095 22 2HG1 VAL 3 HG12 VAL 3 34.239 15.877 -6.015 23 3HG1 VAL 3 HG13 VAL 3 35.863 15.566 -5.433 24 1HG2 VAL 3 HG21 VAL 3 33.835 17.559 -4.187 25 2HG2 VAL 3 HG22 VAL 3 34.909 18.935 -3.982 26 3HG2 VAL 3 HG23 VAL 3 35.451 17.323 -3.536 27 H CYS 4 HN CYS 4 37.700 19.021 -3.589 28 HA CYS 4 HA CYS 4 38.743 16.527 -2.538 29 1HB CYS 4 HB2 CYS 4 40.536 18.632 -3.676 30 2HB CYS 4 HB1 CYS 4 41.107 17.804 -2.277 31 HA PRO 5 HA PRO 5 38.134 17.997 1.395 32 1HB PRO 5 HB2 PRO 5 40.580 17.076 2.637 33 2HB PRO 5 HB1 PRO 5 39.031 16.300 2.605 34 1HG PRO 5 HG2 PRO 5 41.298 15.422 1.250 35 2HG PRO 5 HG1 PRO 5 39.643 14.867 0.990 36 1HD PRO 5 HD2 PRO 5 41.307 16.679 -0.627 37 2HD PRO 5 HD1 PRO 5 39.939 15.671 -1.104 38 HA PRO 6 HA PRO 6 39.745 21.844 2.935 39 1HB PRO 6 HB2 PRO 6 41.204 20.993 5.237 40 2HB PRO 6 HB1 PRO 6 39.559 21.566 5.173 41 1HG PRO 6 HG2 PRO 6 40.545 18.744 5.047 42 2HG PRO 6 HG1 PRO 6 39.140 19.387 5.906 43 1HD PRO 6 HD2 PRO 6 38.726 18.101 3.727 44 2HD PRO 6 HD1 PRO 6 37.929 19.674 3.891 45 H GLY 7 HN GLY 7 42.259 19.477 3.667 46 1HA GLY 7 HA2 GLY 7 44.503 21.157 3.296 47 2HA GLY 7 HA1 GLY 7 44.525 19.407 3.249 48 H GLN 8 HN GLN 8 42.536 20.060 0.791 49 HA GLN 8 HA GLN 8 44.658 20.704 -1.186 50 1HB GLN 8 HB2 GLN 8 42.825 18.253 -1.297 51 2HB GLN 8 HB1 GLN 8 43.932 18.717 -2.578 52 1HG GLN 8 HG2 GLN 8 45.847 18.338 -1.070 53 2HG GLN 8 HG1 GLN 8 44.760 17.965 0.265 54 1HE2 GLN 8 HE21 GLN 8 43.838 15.911 0.364 55 2HE2 GLN 8 HE22 GLN 8 44.204 14.661 -0.720 56 H THR 9 HN THR 9 43.964 21.503 -3.080 57 HA THR 9 HA THR 9 41.090 21.888 -3.612 58 HB THR 9 HB THR 9 41.713 23.789 -2.032 59 HG1 THR 9 HG1 THR 9 41.535 24.874 -4.604 60 1HG2 THR 9 HG21 THR 9 43.625 24.628 -4.287 61 2HG2 THR 9 HG22 THR 9 44.167 23.992 -2.744 62 3HG2 THR 9 HG23 THR 9 43.311 25.525 -2.813 63 H PHE 10 HN PHE 10 41.354 23.749 -5.588 64 HA PHE 10 HA PHE 10 42.202 22.261 -7.817 65 1HB PHE 10 HB2 PHE 10 40.729 24.234 -8.060 66 2HB PHE 10 HB1 PHE 10 42.023 25.301 -7.531 67 HD1 PHE 10 HD1 PHE 10 41.243 22.736 -10.172 68 HD2 PHE 10 HD2 PHE 10 43.492 26.209 -9.137 69 HE1 PHE 10 HE1 PHE 10 42.082 22.884 -12.469 70 HE2 PHE 10 HE2 PHE 10 44.326 26.350 -11.436 71 HZ PHE 10 HZ PHE 10 43.630 24.695 -13.106 72 H GLN 11 HN GLN 11 43.982 22.306 -9.086 73 HA GLN 11 HA GLN 11 46.449 23.697 -8.207 74 1HB GLN 11 HB2 GLN 11 46.257 21.263 -7.188 75 2HB GLN 11 HB1 GLN 11 46.380 20.687 -8.830 76 1HG GLN 11 HG2 GLN 11 48.599 20.612 -7.869 77 2HG GLN 11 HG1 GLN 11 48.564 21.876 -9.093 78 1HE2 GLN 11 HE21 GLN 11 47.270 21.992 -5.726 79 2HE2 GLN 11 HE22 GLN 11 48.259 23.252 -5.226 80 H THR 12 HN THR 12 47.188 24.624 -10.078 81 HA THR 12 HA THR 12 45.959 23.853 -12.624 82 HB THR 12 HB THR 12 46.489 26.281 -12.138 83 HG1 THR 12 HG1 THR 12 46.468 25.364 -14.253 84 1HG2 THR 12 HG21 THR 12 48.735 25.880 -10.948 85 2HG2 THR 12 HG22 THR 12 48.828 27.039 -12.267 86 3HG2 THR 12 HG23 THR 12 49.408 25.399 -12.501 87 H CYS 13 HN CYS 13 49.040 23.497 -10.986 88 HA CYS 13 HA CYS 13 49.929 21.725 -13.176 89 1HB CYS 13 HB2 CYS 13 51.542 23.522 -11.394 90 2HB CYS 13 HB1 CYS 13 52.298 22.182 -12.220 91 H ALA 14 HN ALA 14 49.479 19.842 -12.674 92 HA ALA 14 HA ALA 14 50.664 18.509 -10.315 93 1HB ALA 14 HB1 ALA 14 48.495 17.291 -9.938 94 2HB ALA 14 HB2 ALA 14 47.750 18.228 -11.216 95 3HB ALA 14 HB3 ALA 14 48.275 19.022 -9.745 96 H SER 15 HN SER 15 49.879 15.982 -10.730 97 HA SER 15 HA SER 15 50.091 15.164 -13.525 98 1HB SER 15 HB2 SER 15 52.534 15.806 -12.864 99 2HB SER 15 HB1 SER 15 52.394 14.486 -11.698 100 HG SER 15 HG SER 15 52.991 14.218 -14.185 101 H SER 16 HN SER 16 51.558 12.782 -12.074 102 HA SER 16 HA SER 16 49.126 11.622 -10.819 103 1HB SER 16 HB2 SER 16 51.162 10.247 -12.659 104 2HB SER 16 HB1 SER 16 49.790 9.441 -11.877 105 HG SER 16 HG SER 16 49.648 11.707 -13.578 106 H CYS 17 HN CYS 17 51.847 12.974 -10.008 107 HA CYS 17 HA CYS 17 52.631 10.800 -8.046 108 1HB CYS 17 HB2 CYS 17 54.875 11.286 -8.204 109 2HB CYS 17 HB1 CYS 17 54.344 11.365 -9.849 110 HA PRO 18 HA PRO 18 51.161 14.400 -5.513 111 1HB PRO 18 HB2 PRO 18 50.373 12.217 -3.672 112 2HB PRO 18 HB1 PRO 18 49.419 13.541 -4.290 113 1HG PRO 18 HG2 PRO 18 49.020 11.058 -5.154 114 2HG PRO 18 HG1 PRO 18 48.882 12.441 -6.255 115 1HD PRO 18 HD2 PRO 18 51.157 10.517 -5.915 116 2HD PRO 18 HD1 PRO 18 50.414 11.148 -7.404 117 H LYS 19 HN LYS 19 52.353 15.396 -3.997 118 HA LYS 19 HA LYS 19 54.614 13.939 -2.751 119 1HB LYS 19 HB2 LYS 19 55.366 16.315 -2.212 120 2HB LYS 19 HB1 LYS 19 55.330 15.885 -3.901 121 1HG LYS 19 HG2 LYS 19 54.503 18.139 -3.534 122 2HG LYS 19 HG1 LYS 19 53.262 17.107 -4.194 123 1HD LYS 19 HD2 LYS 19 52.086 16.964 -2.173 124 2HD LYS 19 HD1 LYS 19 53.378 17.683 -1.236 125 1HE LYS 19 HE2 LYS 19 51.643 18.966 -3.420 126 2HE LYS 19 HE1 LYS 19 51.549 19.265 -1.695 127 1HZ LYS 19 HZ1 LYS 19 52.737 21.034 -2.634 128 2HZ LYS 19 HZ2 LYS 19 53.754 19.994 -3.509 129 3HZ LYS 19 HZ3 LYS 19 53.874 20.072 -1.817 130 H THR 20 HN THR 20 55.176 14.393 -0.694 131 HA THR 20 HA THR 20 53.057 15.142 1.245 132 HB THR 20 HB THR 20 53.389 13.023 2.506 133 HG1 THR 20 HG1 THR 20 55.561 12.795 1.773 134 1HG2 THR 20 HG21 THR 20 52.525 11.360 0.824 135 2HG2 THR 20 HG22 THR 20 53.061 12.348 -0.503 136 3HG2 THR 20 HG23 THR 20 51.723 12.874 0.495 137 H CYS 21 HN CYS 21 54.103 14.553 3.542 138 HA CYS 21 HA CYS 21 56.148 16.497 3.990 139 1HB CYS 21 HB2 CYS 21 55.277 14.139 5.682 140 2HB CYS 21 HB1 CYS 21 56.265 15.446 6.255 141 H GLU 22 HN GLU 22 56.150 13.191 3.109 142 HA GLU 22 HA GLU 22 58.838 12.477 3.835 143 1HB GLU 22 HB2 GLU 22 57.090 10.815 3.164 144 2HB GLU 22 HB1 GLU 22 57.123 11.454 1.529 145 1HG GLU 22 HG2 GLU 22 59.537 10.822 1.321 146 2HG GLU 22 HG1 GLU 22 59.504 10.181 2.956 147 H THR 23 HN THR 23 57.439 13.604 0.716 148 HA THR 23 HA THR 23 60.092 14.031 -0.464 149 HB THR 23 HB THR 23 58.746 14.902 -2.420 150 HG1 THR 23 HG1 THR 23 56.421 14.568 -2.036 151 1HG2 THR 23 HG21 THR 23 57.499 12.813 -2.884 152 2HG2 THR 23 HG22 THR 23 57.516 12.378 -1.181 153 3HG2 THR 23 HG23 THR 23 59.014 12.372 -2.105 154 H ARG 24 HN ARG 24 57.445 16.398 -0.256 155 HA ARG 24 HA ARG 24 57.389 18.623 0.292 156 1HB ARG 24 HB2 ARG 24 60.161 18.199 1.534 157 2HB ARG 24 HB1 ARG 24 59.133 19.596 1.721 158 1HG ARG 24 HG2 ARG 24 57.448 18.350 2.873 159 2HG ARG 24 HG1 ARG 24 58.271 16.834 2.528 160 1HD ARG 24 HD2 ARG 24 60.170 17.462 3.926 161 2HD ARG 24 HD1 ARG 24 59.556 19.087 4.157 162 HE ARG 24 HE ARG 24 57.778 16.900 5.041 163 1HH1 ARG 24 HH11 ARG 24 60.227 19.211 5.899 164 2HH1 ARG 24 HH12 ARG 24 59.840 19.149 7.585 165 1HH2 ARG 24 HH21 ARG 24 57.290 16.815 7.168 166 2HH2 ARG 24 HH22 ARG 24 58.163 17.778 8.313 167 H ASN 25 HN ASN 25 59.875 17.300 -1.428 168 HA ASN 25 HA ASN 25 61.444 19.378 -2.330 169 1HB ASN 25 HB2 ASN 25 60.526 16.845 -3.774 170 2HB ASN 25 HB1 ASN 25 61.977 17.744 -4.162 171 1HD2 ASN 25 HD21 ASN 25 62.723 18.278 -1.343 172 2HD2 ASN 25 HD22 ASN 25 63.247 16.789 -0.717 173 H LYS 26 HN LYS 26 58.254 18.460 -3.357 174 HA LYS 26 HA LYS 26 58.201 20.608 -5.418 175 1HB LYS 26 HB2 LYS 26 56.481 18.091 -5.190 176 2HB LYS 26 HB1 LYS 26 56.235 19.356 -6.361 177 1HG LYS 26 HG2 LYS 26 57.353 17.472 -7.406 178 2HG LYS 26 HG1 LYS 26 58.438 18.844 -7.383 179 1HD LYS 26 HD2 LYS 26 59.701 17.895 -5.535 180 2HD LYS 26 HD1 LYS 26 58.563 16.567 -5.360 181 1HE LYS 26 HE2 LYS 26 60.323 17.167 -7.790 182 2HE LYS 26 HE1 LYS 26 60.643 15.925 -6.590 183 1HZ LYS 26 HZ1 LYS 26 59.356 15.476 -8.845 184 2HZ LYS 26 HZ2 LYS 26 58.030 15.828 -7.849 185 3HZ LYS 26 HZ3 LYS 26 59.095 14.574 -7.431 186 H LEU 27 HN LEU 27 56.967 22.226 -4.992 187 HA LEU 27 HA LEU 27 55.124 22.192 -2.655 188 1HB LEU 27 HB2 LEU 27 56.223 24.518 -4.314 189 2HB LEU 27 HB1 LEU 27 55.116 24.713 -2.976 190 HG LEU 27 HG LEU 27 56.812 23.751 -1.420 191 1HD1 LEU 27 HD11 LEU 27 58.183 22.348 -2.963 192 2HD1 LEU 27 HD12 LEU 27 59.172 23.507 -2.120 193 3HD1 LEU 27 HD13 LEU 27 58.726 23.796 -3.793 194 1HD2 LEU 27 HD21 LEU 27 57.784 26.113 -3.072 195 2HD2 LEU 27 HD22 LEU 27 58.332 25.721 -1.450 196 3HD2 LEU 27 HD23 LEU 27 56.662 26.186 -1.722 197 H VAL 28 HN VAL 28 54.512 20.887 -4.826 198 HA VAL 28 HA VAL 28 51.776 21.670 -5.494 199 HB VAL 28 HB VAL 28 52.157 21.252 -7.983 200 1HG1 VAL 28 HG11 VAL 28 53.684 23.707 -6.886 201 2HG1 VAL 28 HG12 VAL 28 51.947 23.656 -7.130 202 3HG1 VAL 28 HG13 VAL 28 53.032 23.564 -8.504 203 1HG2 VAL 28 HG21 VAL 28 54.326 20.199 -7.796 204 2HG2 VAL 28 HG22 VAL 28 55.079 21.679 -7.240 205 3HG2 VAL 28 HG23 VAL 28 54.452 21.572 -8.879 206 H LEU 29 HN LEU 29 50.698 19.964 -6.529 207 HA LEU 29 HA LEU 29 50.832 17.545 -5.368 208 1HB LEU 29 HB2 LEU 29 49.045 18.417 -6.827 209 2HB LEU 29 HB1 LEU 29 50.064 18.191 -8.210 210 HG LEU 29 HG LEU 29 48.255 16.445 -8.019 211 1HD1 LEU 29 HD11 LEU 29 49.526 14.356 -8.197 212 2HD1 LEU 29 HD12 LEU 29 50.952 15.105 -7.538 213 3HD1 LEU 29 HD13 LEU 29 50.333 15.632 -9.085 214 1HD2 LEU 29 HD21 LEU 29 48.260 14.825 -6.149 215 2HD2 LEU 29 HD22 LEU 29 47.980 16.464 -5.603 216 3HD2 LEU 29 HD23 LEU 29 49.549 15.728 -5.372 217 H CYS 30 HN CYS 30 52.229 18.097 -8.448 218 HA CYS 30 HA CYS 30 54.337 16.018 -7.899 219 1HB CYS 30 HB2 CYS 30 52.486 15.074 -9.261 220 2HB CYS 30 HB1 CYS 30 52.772 16.313 -10.452 221 H ASP 31 HN ASP 31 54.759 16.841 -11.085 222 HA ASP 31 HA ASP 31 55.785 19.471 -10.998 223 1HB ASP 31 HB2 ASP 31 58.245 19.057 -10.811 224 2HB ASP 31 HB1 ASP 31 57.440 18.661 -9.329 225 H LYS 32 HN LYS 32 56.428 16.315 -12.278 226 HA LYS 32 HA LYS 32 57.596 17.227 -14.766 227 1HB LYS 32 HB2 LYS 32 56.370 14.518 -14.082 228 2HB LYS 32 HB1 LYS 32 57.453 14.819 -15.417 229 1HG LYS 32 HG2 LYS 32 58.245 15.145 -12.502 230 2HG LYS 32 HG1 LYS 32 58.491 13.690 -13.413 231 1HD LYS 32 HD2 LYS 32 60.577 14.924 -13.233 232 2HD LYS 32 HD1 LYS 32 60.081 14.817 -14.901 233 1HE LYS 32 HE2 LYS 32 59.462 17.142 -14.956 234 2HE LYS 32 HE1 LYS 32 59.661 17.326 -13.212 235 1HZ LYS 32 HZ1 LYS 32 62.004 16.823 -13.538 236 2HZ LYS 32 HZ2 LYS 32 61.529 18.152 -14.481 237 3HZ LYS 32 HZ3 LYS 32 61.748 16.631 -15.205 238 H LYS 33 HN LYS 33 54.631 17.836 -13.945 239 HA LYS 33 HA LYS 33 53.682 18.171 -16.650 240 1HB LYS 33 HB2 LYS 33 53.229 15.721 -16.387 241 2HB LYS 33 HB1 LYS 33 52.385 16.036 -14.898 242 1HG LYS 33 HG2 LYS 33 50.805 15.606 -16.663 243 2HG LYS 33 HG1 LYS 33 50.615 17.243 -16.100 244 1HD LYS 33 HD2 LYS 33 52.013 18.031 -18.085 245 2HD LYS 33 HD1 LYS 33 52.097 16.368 -18.628 246 1HE LYS 33 HE2 LYS 33 49.524 17.958 -18.248 247 2HE LYS 33 HE1 LYS 33 50.278 17.592 -19.792 248 1HZ LYS 33 HZ1 LYS 33 48.657 15.985 -19.533 249 2HZ LYS 33 HZ2 LYS 33 49.005 15.741 -17.888 250 3HZ LYS 33 HZ3 LYS 33 50.083 15.183 -19.076 251 H CYS 34 HN CYS 34 51.440 19.060 -16.655 252 HA CYS 34 HA CYS 34 50.765 20.342 -14.095 253 1HB CYS 34 HB2 CYS 34 51.044 21.675 -16.756 254 2HB CYS 34 HB1 CYS 34 50.133 22.394 -15.451 255 H ASN 35 HN ASN 35 49.316 18.706 -14.126 256 HA ASN 35 HA ASN 35 46.909 18.695 -15.805 257 1HB ASN 35 HB2 ASN 35 47.290 17.386 -13.063 258 2HB ASN 35 HB1 ASN 35 45.973 17.070 -14.168 259 1HD2 ASN 35 HD21 ASN 35 47.317 14.977 -13.198 260 2HD2 ASN 35 HD22 ASN 35 48.314 14.248 -14.356 261 H GLN 36 HN GLN 36 45.179 20.014 -15.458 262 HA GLN 36 HA GLN 36 45.208 21.831 -13.123 263 1HB GLN 36 HB2 GLN 36 43.375 21.689 -15.560 264 2HB GLN 36 HB1 GLN 36 43.344 22.965 -14.356 265 1HG GLN 36 HG2 GLN 36 45.727 23.520 -14.897 266 2HG GLN 36 HG1 GLN 36 45.726 22.272 -16.136 267 1HE2 GLN 36 HE21 GLN 36 44.655 25.499 -15.341 268 2HE2 GLN 36 HE22 GLN 36 43.985 25.864 -16.858 269 H ARG 37 HN ARG 37 44.906 20.085 -11.687 270 HA ARG 37 HA ARG 37 42.070 19.401 -11.186 271 1HB ARG 37 HB2 ARG 37 42.719 16.978 -10.810 272 2HB ARG 37 HB1 ARG 37 42.989 17.493 -12.448 273 1HG ARG 37 HG2 ARG 37 45.404 17.927 -11.921 274 2HG ARG 37 HG1 ARG 37 45.136 17.430 -10.267 275 1HD ARG 37 HD2 ARG 37 44.769 15.628 -12.692 276 2HD ARG 37 HD1 ARG 37 46.151 15.621 -11.597 277 HE ARG 37 HE ARG 37 43.570 15.270 -10.259 278 1HH1 ARG 37 HH11 ARG 37 46.250 13.731 -11.843 279 2HH1 ARG 37 HH12 ARG 37 45.977 12.210 -11.064 280 1HH2 ARG 37 HH21 ARG 37 43.213 13.355 -9.269 281 2HH2 ARG 37 HH22 ARG 37 44.233 11.992 -9.586 282 H CYS 38 HN CYS 38 42.437 17.699 -9.104 283 HA CYS 38 HA CYS 38 42.808 19.418 -6.874 284 1HB CYS 38 HB2 CYS 38 41.407 17.527 -6.631 285 2HB CYS 38 HB1 CYS 38 42.639 16.416 -7.157 286 H GLY 39 HN GLY 39 44.316 19.367 -5.190 287 1HA GLY 39 HA2 GLY 39 46.705 17.941 -4.980 288 2HA GLY 39 HA1 GLY 39 47.073 19.332 -6.000 289 H CYS 40 HN CYS 40 48.003 18.694 -3.267 290 HA CYS 40 HA CYS 40 46.729 20.231 -1.276 291 1HB CYS 40 HB2 CYS 40 49.676 19.836 -1.724 292 2HB CYS 40 HB1 CYS 40 48.992 20.447 -0.252 293 H ILE 41 HN ILE 41 47.419 22.295 -0.460 294 HA ILE 41 HA ILE 41 47.463 24.256 -2.607 295 HB ILE 41 HB ILE 41 48.001 24.843 0.344 296 1HG1 ILE 41 HG12 ILE 41 45.553 25.414 0.582 297 2HG1 ILE 41 HG11 ILE 41 45.249 24.914 -1.060 298 1HG2 ILE 41 HG21 ILE 41 46.819 26.448 -1.924 299 2HG2 ILE 41 HG22 ILE 41 48.422 26.674 -1.236 300 3HG2 ILE 41 HG23 ILE 41 47.002 27.023 -0.271 301 1HD1 ILE 41 HD11 ILE 41 44.412 23.279 0.550 302 2HD1 ILE 41 HD12 ILE 41 46.022 23.070 1.221 303 3HD1 ILE 41 HD13 ILE 41 45.658 22.552 -0.422 304 H SER 42 HN SER 42 49.125 25.894 -2.749 305 HA SER 42 HA SER 42 51.758 24.724 -3.003 306 1HB SER 42 HB2 SER 42 50.929 26.454 -4.634 307 2HB SER 42 HB1 SER 42 50.896 27.660 -3.337 308 HG SER 42 HG SER 42 53.159 26.119 -4.081 309 H GLY 43 HN GLY 43 52.690 24.233 -1.263 310 1HA GLY 43 HA2 GLY 43 54.396 25.327 0.326 311 2HA GLY 43 HA1 GLY 43 52.991 26.157 1.011 312 H THR 44 HN THR 44 51.288 23.810 0.466 313 HA THR 44 HA THR 44 52.003 22.221 2.858 314 HB THR 44 HB THR 44 49.590 21.492 2.810 315 HG1 THR 44 HG1 THR 44 49.789 22.136 0.323 316 1HG2 THR 44 HG21 THR 44 49.866 24.503 2.410 317 2HG2 THR 44 HG22 THR 44 50.154 23.669 3.934 318 3HG2 THR 44 HG23 THR 44 48.545 23.677 3.226 319 H VAL 45 HN VAL 45 51.904 20.118 2.868 320 HA VAL 45 HA VAL 45 52.031 18.602 0.312 321 HB VAL 45 HB VAL 45 53.813 17.148 1.441 322 1HG1 VAL 45 HG11 VAL 45 54.541 20.068 1.130 323 2HG1 VAL 45 HG12 VAL 45 54.505 18.881 -0.163 324 3HG1 VAL 45 HG13 VAL 45 55.647 18.699 1.151 325 1HG2 VAL 45 HG21 VAL 45 55.074 18.120 3.350 326 2HG2 VAL 45 HG22 VAL 45 53.414 17.850 3.842 327 3HG2 VAL 45 HG23 VAL 45 53.972 19.466 3.423 328 H LEU 46 HN LEU 46 51.042 16.613 0.317 329 HA LEU 46 HA LEU 46 48.910 16.221 2.155 330 1HB LEU 46 HB2 LEU 46 49.018 15.353 -0.204 331 2HB LEU 46 HB1 LEU 46 50.236 14.207 0.280 332 HG LEU 46 HG LEU 46 48.569 13.185 1.893 333 1HD1 LEU 46 HD11 LEU 46 46.167 13.826 1.611 334 2HD1 LEU 46 HD12 LEU 46 46.632 15.072 0.474 335 3HD1 LEU 46 HD13 LEU 46 47.096 15.200 2.157 336 1HD2 LEU 46 HD21 LEU 46 48.912 12.221 -0.367 337 2HD2 LEU 46 HD22 LEU 46 47.694 13.301 -1.025 338 3HD2 LEU 46 HD23 LEU 46 47.236 12.057 0.125 339 H LYS 47 HN LYS 47 49.264 15.903 4.206 340 HA LYS 47 HA LYS 47 50.986 15.332 5.974 341 1HB LYS 47 HB2 LYS 47 48.545 15.070 6.425 342 2HB LYS 47 HB1 LYS 47 48.589 13.504 5.697 343 1HG LYS 47 HG2 LYS 47 48.619 13.236 8.117 344 2HG LYS 47 HG1 LYS 47 50.087 12.610 7.425 345 1HD LYS 47 HD2 LYS 47 50.700 13.791 9.422 346 2HD LYS 47 HD1 LYS 47 51.249 14.776 8.089 347 1HE LYS 47 HE2 LYS 47 48.690 15.232 9.682 348 2HE LYS 47 HE1 LYS 47 50.173 16.154 9.848 349 1HZ LYS 47 HZ1 LYS 47 48.114 16.325 7.852 350 2HZ LYS 47 HZ2 LYS 47 49.698 16.381 7.236 351 3HZ LYS 47 HZ3 LYS 47 49.206 17.496 8.417 352 H SER 48 HN SER 48 49.815 12.393 4.408 353 HA SER 48 HA SER 48 52.543 11.177 4.603 354 1HB SER 48 HB2 SER 48 49.869 9.806 5.249 355 2HB SER 48 HB1 SER 48 51.454 9.017 5.274 356 HG SER 48 HG SER 48 50.322 10.679 7.086 357 H LYS 49 HN LYS 49 52.590 9.141 3.455 358 HA LYS 49 HA LYS 49 52.898 9.325 0.803 359 1HB LYS 49 HB2 LYS 49 51.736 6.903 2.210 360 2HB LYS 49 HB1 LYS 49 52.500 6.852 0.641 361 1HG LYS 49 HG2 LYS 49 53.833 7.668 3.268 362 2HG LYS 49 HG1 LYS 49 54.066 6.152 2.439 363 1HD LYS 49 HD2 LYS 49 54.894 8.900 1.377 364 2HD LYS 49 HD1 LYS 49 55.948 7.670 2.025 365 1HE LYS 49 HE2 LYS 49 54.263 7.321 -0.493 366 2HE LYS 49 HE1 LYS 49 55.986 7.625 -0.455 367 1HZ LYS 49 HZ1 LYS 49 56.183 5.572 0.922 368 2HZ LYS 49 HZ2 LYS 49 55.720 5.334 -0.695 369 3HZ LYS 49 HZ3 LYS 49 54.561 5.244 0.543 370 H ASP 50 HN ASP 50 49.823 8.949 2.293 371 HA ASP 50 HA ASP 50 48.417 9.850 -0.064 372 1HB ASP 50 HB2 ASP 50 48.880 7.459 -0.768 373 2HB ASP 50 HB1 ASP 50 48.082 6.888 0.684 374 H SER 51 HN SER 51 48.287 11.039 2.152 375 HA SER 51 HA SER 51 46.142 10.070 3.933 376 1HB SER 51 HB2 SER 51 48.209 11.274 4.778 377 2HB SER 51 HB1 SER 51 47.678 12.720 3.909 378 HG SER 51 HG SER 51 47.014 12.365 6.221 379 H SER 52 HN SER 52 45.004 12.716 4.368 380 HA SER 52 HA SER 52 43.550 13.255 1.816 381 1HB SER 52 HB2 SER 52 41.459 13.504 3.211 382 2HB SER 52 HB1 SER 52 42.123 11.873 3.375 383 HG SER 52 HG SER 52 43.397 12.902 5.169 384 H GLU 53 HN GLU 53 44.802 14.350 4.850 385 HA GLU 53 HA GLU 53 44.234 17.192 4.187 386 1HB GLU 53 HB2 GLU 53 43.533 16.384 6.435 387 2HB GLU 53 HB1 GLU 53 45.167 15.857 6.770 388 1HG GLU 53 HG2 GLU 53 44.668 18.045 7.854 389 2HG GLU 53 HG1 GLU 53 45.989 18.182 6.716 390 H CYS 54 HN CYS 54 45.849 18.707 4.147 391 HA CYS 54 HA CYS 54 48.650 17.691 3.865 392 1HB CYS 54 HB2 CYS 54 47.450 20.069 2.446 393 2HB CYS 54 HB1 CYS 54 49.012 19.370 2.177 394 H VAL 55 HN VAL 55 50.249 18.972 4.629 395 HA VAL 55 HA VAL 55 49.670 21.487 6.067 396 HB VAL 55 HB VAL 55 50.995 20.609 8.070 397 1HG1 VAL 55 HG11 VAL 55 49.114 19.275 9.029 398 2HG1 VAL 55 HG12 VAL 55 48.445 19.028 7.425 399 3HG1 VAL 55 HG13 VAL 55 48.478 20.637 8.127 400 1HG2 VAL 55 HG21 VAL 55 51.266 18.174 8.330 401 2HG2 VAL 55 HG22 VAL 55 52.172 18.777 6.956 402 3HG2 VAL 55 HG23 VAL 55 50.663 17.925 6.699 403 H HIS 56 HN HIS 56 51.534 22.776 6.329 404 HA HIS 56 HA HIS 56 53.491 22.483 4.255 405 1HB HIS 56 HB2 HIS 56 53.716 24.141 6.810 406 2HB HIS 56 HB1 HIS 56 54.648 24.403 5.362 407 HD1 HIS 56 HD1 HIS 56 53.404 25.531 3.407 408 HD2 HIS 56 HD2 HIS 56 50.988 24.998 6.654 409 HE1 HIS 56 HE1 HIS 56 51.371 26.863 2.985 410 HA PRO 57 HA PRO 57 56.521 19.760 5.976 411 1HB PRO 57 HB2 PRO 57 58.871 21.161 5.531 412 2HB PRO 57 HB1 PRO 57 57.981 20.284 4.309 413 1HG PRO 57 HG2 PRO 57 57.814 23.205 4.946 414 2HG PRO 57 HG1 PRO 57 58.054 22.419 3.371 415 1HD PRO 57 HD2 PRO 57 55.664 23.235 4.023 416 2HD PRO 57 HD1 PRO 57 55.846 21.630 3.291 417 H SER 58 HN SER 58 56.204 22.981 7.101 418 HA SER 58 HA SER 58 57.897 22.673 9.462 419 1HB SER 58 HB2 SER 58 57.033 25.023 9.953 420 2HB SER 58 HB1 SER 58 57.778 24.862 8.358 421 HG SER 58 HG SER 58 55.269 25.503 8.965 422 H LYS 59 HN LYS 59 54.577 22.011 8.794 423 HA LYS 59 HA LYS 59 53.950 21.970 11.725 424 1HB LYS 59 HB2 LYS 59 52.061 21.748 9.355 425 2HB LYS 59 HB1 LYS 59 51.559 21.621 11.024 426 1HG LYS 59 HG2 LYS 59 51.031 23.842 10.339 427 2HG LYS 59 HG1 LYS 59 52.454 23.978 11.358 428 1HD LYS 59 HD2 LYS 59 53.891 24.127 9.399 429 2HD LYS 59 HD1 LYS 59 52.500 23.906 8.350 430 1HE LYS 59 HE2 LYS 59 52.924 26.236 10.279 431 2HE LYS 59 HE1 LYS 59 53.154 26.311 8.539 432 1HZ LYS 59 HZ1 LYS 59 51.048 26.995 8.579 433 2HZ LYS 59 HZ2 LYS 59 50.710 26.274 10.081 434 3HZ LYS 59 HZ3 LYS 59 50.691 25.337 8.665 435 H CYS 60 HN CYS 60 54.467 20.017 8.947 436 HA CYS 60 HA CYS 60 53.171 17.643 9.389 437 1HB CYS 60 HB2 CYS 60 55.973 18.183 8.567 438 2HB CYS 60 HB1 CYS 60 55.363 16.553 8.518 Start of MODEL 7 1 1H ASN 1 HT1 ASN 1 34.483 20.076 -12.843 2 2H ASN 1 HT2 ASN 1 34.243 21.756 -12.935 3 3H ASN 1 HT3 ASN 1 34.348 20.994 -11.420 4 HA ASN 1 HA ASN 1 36.544 21.215 -13.405 5 1HB ASN 1 HB2 ASN 1 35.903 23.348 -12.170 6 2HB ASN 1 HB1 ASN 1 36.154 22.511 -10.649 7 1HD2 ASN 1 HD21 ASN 1 38.058 22.704 -13.718 8 2HD2 ASN 1 HD22 ASN 1 39.510 23.146 -12.959 9 H PHE 2 HN PHE 2 37.831 21.176 -10.465 10 HA PHE 2 HA PHE 2 37.800 18.214 -10.116 11 1HB PHE 2 HB2 PHE 2 40.254 20.017 -10.269 12 2HB PHE 2 HB1 PHE 2 40.303 18.329 -9.757 13 HD1 PHE 2 HD1 PHE 2 39.629 20.601 -12.596 14 HD2 PHE 2 HD2 PHE 2 39.840 16.538 -11.333 15 HE1 PHE 2 HE1 PHE 2 39.545 19.876 -14.923 16 HE2 PHE 2 HE2 PHE 2 39.756 15.806 -13.656 17 HZ PHE 2 HZ PHE 2 39.615 17.471 -15.478 18 H VAL 3 HN VAL 3 36.787 18.040 -8.404 19 HA VAL 3 HA VAL 3 36.839 19.775 -6.098 20 HB VAL 3 HB VAL 3 35.828 16.909 -6.452 21 1HG1 VAL 3 HG11 VAL 3 35.969 17.566 -4.074 22 2HG1 VAL 3 HG12 VAL 3 34.297 17.437 -4.586 23 3HG1 VAL 3 HG13 VAL 3 35.043 19.021 -4.412 24 1HG2 VAL 3 HG21 VAL 3 34.830 18.441 -8.131 25 2HG2 VAL 3 HG22 VAL 3 34.365 19.557 -6.860 26 3HG2 VAL 3 HG23 VAL 3 33.626 17.964 -6.954 27 H CYS 4 HN CYS 4 37.570 19.369 -4.105 28 HA CYS 4 HA CYS 4 39.896 17.517 -3.866 29 1HB CYS 4 HB2 CYS 4 39.407 20.174 -2.665 30 2HB CYS 4 HB1 CYS 4 40.796 19.218 -2.276 31 HA PRO 5 HA PRO 5 38.214 17.046 0.423 32 1HB PRO 5 HB2 PRO 5 40.629 16.093 1.499 33 2HB PRO 5 HB1 PRO 5 39.298 15.136 0.941 34 1HG PRO 5 HG2 PRO 5 41.823 15.197 -0.271 35 2HG PRO 5 HG1 PRO 5 40.345 14.569 -1.021 36 1HD PRO 5 HD2 PRO 5 41.612 17.275 -1.311 37 2HD PRO 5 HD1 PRO 5 40.866 16.280 -2.560 38 HA PRO 6 HA PRO 6 39.980 20.317 3.017 39 1HB PRO 6 HB2 PRO 6 40.635 18.863 5.272 40 2HB PRO 6 HB1 PRO 6 39.054 19.504 4.888 41 1HG PRO 6 HG2 PRO 6 40.088 16.727 4.318 42 2HG PRO 6 HG1 PRO 6 38.544 17.183 5.059 43 1HD PRO 6 HD2 PRO 6 38.641 16.500 2.584 44 2HD PRO 6 HD1 PRO 6 37.683 17.918 3.000 45 H GLY 7 HN GLY 7 41.863 21.150 2.956 46 1HA GLY 7 HA2 GLY 7 44.235 21.283 3.433 47 2HA GLY 7 HA1 GLY 7 44.334 19.535 3.336 48 H GLN 8 HN GLN 8 42.559 20.266 0.690 49 HA GLN 8 HA GLN 8 44.930 20.924 -1.018 50 1HB GLN 8 HB2 GLN 8 42.811 18.872 -1.836 51 2HB GLN 8 HB1 GLN 8 44.277 19.267 -2.685 52 1HG GLN 8 HG2 GLN 8 44.626 17.115 -1.715 53 2HG GLN 8 HG1 GLN 8 45.598 18.240 -0.790 54 1HE2 GLN 8 HE21 GLN 8 45.275 16.119 0.740 55 2HE2 GLN 8 HE22 GLN 8 43.986 16.266 1.826 56 H THR 9 HN THR 9 44.387 21.694 -3.066 57 HA THR 9 HA THR 9 41.664 22.778 -3.485 58 HB THR 9 HB THR 9 42.797 24.573 -2.261 59 HG1 THR 9 HG1 THR 9 42.731 26.125 -3.950 60 1HG2 THR 9 HG21 THR 9 44.907 24.462 -4.502 61 2HG2 THR 9 HG22 THR 9 45.211 23.919 -2.861 62 3HG2 THR 9 HG23 THR 9 44.882 25.616 -3.177 63 H PHE 10 HN PHE 10 41.548 23.853 -5.577 64 HA PHE 10 HA PHE 10 42.339 22.084 -7.687 65 1HB PHE 10 HB2 PHE 10 40.333 23.535 -7.859 66 2HB PHE 10 HB1 PHE 10 41.345 24.973 -7.823 67 HD1 PHE 10 HD1 PHE 10 41.571 25.964 -9.932 68 HD2 PHE 10 HD2 PHE 10 41.377 21.714 -9.704 69 HE1 PHE 10 HE1 PHE 10 41.815 25.819 -12.366 70 HE2 PHE 10 HE2 PHE 10 41.616 21.577 -12.132 71 HZ PHE 10 HZ PHE 10 41.836 23.629 -13.473 72 H GLN 11 HN GLN 11 43.884 22.499 -9.411 73 HA GLN 11 HA GLN 11 45.785 24.703 -9.051 74 1HB GLN 11 HB2 GLN 11 46.412 22.914 -7.367 75 2HB GLN 11 HB1 GLN 11 46.621 21.784 -8.683 76 1HG GLN 11 HG2 GLN 11 48.497 23.061 -9.580 77 2HG GLN 11 HG1 GLN 11 48.228 24.354 -8.413 78 1HE2 GLN 11 HE21 GLN 11 47.914 23.145 -6.014 79 2HE2 GLN 11 HE22 GLN 11 49.247 22.192 -5.599 80 H THR 12 HN THR 12 46.974 25.055 -10.885 81 HA THR 12 HA THR 12 45.847 23.968 -13.346 82 HB THR 12 HB THR 12 47.399 25.641 -14.464 83 HG1 THR 12 HG1 THR 12 49.128 25.401 -13.077 84 1HG2 THR 12 HG21 THR 12 46.214 26.796 -11.880 85 2HG2 THR 12 HG22 THR 12 45.269 26.537 -13.341 86 3HG2 THR 12 HG23 THR 12 46.597 27.691 -13.343 87 H CYS 13 HN CYS 13 48.997 23.896 -11.760 88 HA CYS 13 HA CYS 13 49.842 21.779 -13.664 89 1HB CYS 13 HB2 CYS 13 51.304 23.701 -13.570 90 2HB CYS 13 HB1 CYS 13 51.516 23.536 -11.845 91 H ALA 14 HN ALA 14 49.213 19.968 -12.879 92 HA ALA 14 HA ALA 14 50.430 18.985 -10.432 93 1HB ALA 14 HB1 ALA 14 48.408 20.184 -9.610 94 2HB ALA 14 HB2 ALA 14 48.171 18.462 -9.371 95 3HB ALA 14 HB3 ALA 14 47.401 19.272 -10.721 96 H SER 15 HN SER 15 51.216 17.119 -10.950 97 HA SER 15 HA SER 15 50.236 15.531 -13.173 98 1HB SER 15 HB2 SER 15 52.705 15.683 -12.394 99 2HB SER 15 HB1 SER 15 52.210 14.718 -11.000 100 HG SER 15 HG SER 15 52.208 13.032 -12.167 101 H SER 16 HN SER 16 50.861 13.035 -11.491 102 HA SER 16 HA SER 16 48.332 12.736 -9.986 103 1HB SER 16 HB2 SER 16 48.072 11.718 -12.280 104 2HB SER 16 HB1 SER 16 49.504 10.720 -11.986 105 HG SER 16 HG SER 16 48.470 9.669 -10.402 106 H CYS 17 HN CYS 17 51.340 13.147 -9.652 107 HA CYS 17 HA CYS 17 52.032 10.876 -7.854 108 1HB CYS 17 HB2 CYS 17 54.409 11.651 -8.391 109 2HB CYS 17 HB1 CYS 17 53.510 10.815 -9.617 110 HA PRO 18 HA PRO 18 51.036 14.845 -5.550 111 1HB PRO 18 HB2 PRO 18 50.086 13.551 -3.289 112 2HB PRO 18 HB1 PRO 18 49.110 14.034 -4.647 113 1HG PRO 18 HG2 PRO 18 50.329 11.372 -4.077 114 2HG PRO 18 HG1 PRO 18 48.709 11.759 -4.689 115 1HD PRO 18 HD2 PRO 18 50.578 10.893 -6.331 116 2HD PRO 18 HD1 PRO 18 49.487 12.200 -6.835 117 H LYS 19 HN LYS 19 52.125 15.969 -4.096 118 HA LYS 19 HA LYS 19 54.567 14.813 -2.881 119 1HB LYS 19 HB2 LYS 19 55.024 17.163 -2.177 120 2HB LYS 19 HB1 LYS 19 54.680 17.109 -3.895 121 1HG LYS 19 HG2 LYS 19 52.384 17.845 -3.510 122 2HG LYS 19 HG1 LYS 19 52.606 17.792 -1.772 123 1HD LYS 19 HD2 LYS 19 54.266 19.556 -1.842 124 2HD LYS 19 HD1 LYS 19 54.223 19.622 -3.583 125 1HE LYS 19 HE2 LYS 19 51.788 20.181 -3.459 126 2HE LYS 19 HE1 LYS 19 51.893 20.067 -1.714 127 1HZ LYS 19 HZ1 LYS 19 52.370 22.217 -1.743 128 2HZ LYS 19 HZ2 LYS 19 52.588 22.230 -3.427 129 3HZ LYS 19 HZ3 LYS 19 53.878 21.805 -2.406 130 H THR 20 HN THR 20 54.903 14.730 -0.852 131 HA THR 20 HA THR 20 52.732 15.114 1.129 132 HB THR 20 HB THR 20 53.236 12.826 2.040 133 HG1 THR 20 HG1 THR 20 54.642 11.599 0.598 134 1HG2 THR 20 HG21 THR 20 52.869 12.664 -1.037 135 2HG2 THR 20 HG22 THR 20 51.520 12.917 0.046 136 3HG2 THR 20 HG23 THR 20 52.404 11.426 0.098 137 H CYS 21 HN CYS 21 53.728 14.493 3.385 138 HA CYS 21 HA CYS 21 55.763 16.419 3.910 139 1HB CYS 21 HB2 CYS 21 54.899 14.004 5.519 140 2HB CYS 21 HB1 CYS 21 55.933 15.257 6.131 141 H GLU 22 HN GLU 22 56.014 13.055 2.962 142 HA GLU 22 HA GLU 22 58.838 12.980 3.759 143 1HB GLU 22 HB2 GLU 22 58.867 10.756 2.642 144 2HB GLU 22 HB1 GLU 22 57.602 10.907 3.818 145 1HG GLU 22 HG2 GLU 22 56.747 9.639 2.034 146 2HG GLU 22 HG1 GLU 22 55.946 11.182 1.995 147 H THR 23 HN THR 23 57.062 13.984 0.790 148 HA THR 23 HA THR 23 59.622 14.020 -0.726 149 HB THR 23 HB THR 23 58.291 14.991 -2.602 150 HG1 THR 23 HG1 THR 23 56.323 15.061 -0.583 151 1HG2 THR 23 HG21 THR 23 57.994 12.472 -2.255 152 2HG2 THR 23 HG22 THR 23 56.578 13.242 -2.955 153 3HG2 THR 23 HG23 THR 23 56.599 12.850 -1.246 154 H ARG 24 HN ARG 24 57.181 16.611 -0.182 155 HA ARG 24 HA ARG 24 57.388 18.851 0.302 156 1HB ARG 24 HB2 ARG 24 59.901 17.853 1.638 157 2HB ARG 24 HB1 ARG 24 59.325 19.505 1.761 158 1HG ARG 24 HG2 ARG 24 57.226 18.723 2.728 159 2HG ARG 24 HG1 ARG 24 57.729 17.052 2.529 160 1HD ARG 24 HD2 ARG 24 59.155 19.109 4.313 161 2HD ARG 24 HD1 ARG 24 58.034 17.892 4.896 162 HE ARG 24 HE ARG 24 59.629 16.215 4.458 163 1HH1 ARG 24 HH11 ARG 24 60.768 19.345 3.470 164 2HH1 ARG 24 HH12 ARG 24 62.410 18.819 3.329 165 1HH2 ARG 24 HH21 ARG 24 61.700 15.541 4.276 166 2HH2 ARG 24 HH22 ARG 24 62.947 16.641 3.788 167 H ASN 25 HN ASN 25 59.535 17.364 -1.575 168 HA ASN 25 HA ASN 25 61.407 19.332 -2.277 169 1HB ASN 25 HB2 ASN 25 60.330 16.946 -3.855 170 2HB ASN 25 HB1 ASN 25 61.837 17.769 -4.194 171 1HD2 ASN 25 HD21 ASN 25 62.419 18.076 -1.224 172 2HD2 ASN 25 HD22 ASN 25 62.937 16.533 -0.744 173 H LYS 26 HN LYS 26 58.169 18.716 -3.463 174 HA LYS 26 HA LYS 26 58.396 20.904 -5.444 175 1HB LYS 26 HB2 LYS 26 56.395 18.610 -5.248 176 2HB LYS 26 HB1 LYS 26 56.274 19.912 -6.401 177 1HG LYS 26 HG2 LYS 26 57.189 17.967 -7.511 178 2HG LYS 26 HG1 LYS 26 58.425 19.204 -7.428 179 1HD LYS 26 HD2 LYS 26 59.536 18.052 -5.585 180 2HD LYS 26 HD1 LYS 26 58.251 16.853 -5.492 181 1HE LYS 26 HE2 LYS 26 58.860 16.147 -7.829 182 2HE LYS 26 HE1 LYS 26 60.131 17.364 -7.850 183 1HZ LYS 26 HZ1 LYS 26 61.107 15.322 -7.263 184 2HZ LYS 26 HZ2 LYS 26 59.928 15.002 -6.084 185 3HZ LYS 26 HZ3 LYS 26 61.050 16.254 -5.844 186 H LEU 27 HN LEU 27 56.911 22.361 -5.495 187 HA LEU 27 HA LEU 27 55.229 22.835 -3.067 188 1HB LEU 27 HB2 LEU 27 56.359 24.861 -5.078 189 2HB LEU 27 HB1 LEU 27 55.321 25.278 -3.736 190 HG LEU 27 HG LEU 27 57.082 24.497 -2.137 191 1HD1 LEU 27 HD11 LEU 27 58.873 24.217 -4.588 192 2HD1 LEU 27 HD12 LEU 27 58.372 22.893 -3.552 193 3HD1 LEU 27 HD13 LEU 27 59.403 24.142 -2.917 194 1HD2 LEU 27 HD21 LEU 27 57.976 26.611 -4.136 195 2HD2 LEU 27 HD22 LEU 27 58.602 26.434 -2.505 196 3HD2 LEU 27 HD23 LEU 27 56.923 26.874 -2.755 197 H VAL 28 HN VAL 28 54.643 21.260 -5.092 198 HA VAL 28 HA VAL 28 51.930 22.016 -5.910 199 HB VAL 28 HB VAL 28 52.340 21.337 -8.336 200 1HG1 VAL 28 HG11 VAL 28 52.207 23.798 -7.747 201 2HG1 VAL 28 HG12 VAL 28 53.316 23.519 -9.077 202 3HG1 VAL 28 HG13 VAL 28 53.942 23.818 -7.468 203 1HG2 VAL 28 HG21 VAL 28 55.272 21.672 -7.589 204 2HG2 VAL 28 HG22 VAL 28 54.655 21.431 -9.214 205 3HG2 VAL 28 HG23 VAL 28 54.481 20.166 -8.015 206 H LEU 29 HN LEU 29 50.827 20.264 -6.865 207 HA LEU 29 HA LEU 29 50.774 17.932 -5.494 208 1HB LEU 29 HB2 LEU 29 49.149 18.709 -7.206 209 2HB LEU 29 HB1 LEU 29 50.317 18.382 -8.445 210 HG LEU 29 HG LEU 29 48.495 16.672 -8.406 211 1HD1 LEU 29 HD11 LEU 29 51.095 15.363 -7.547 212 2HD1 LEU 29 HD12 LEU 29 50.657 15.819 -9.176 213 3HD1 LEU 29 HD13 LEU 29 49.750 14.582 -8.329 214 1HD2 LEU 29 HD21 LEU 29 48.222 15.151 -6.485 215 2HD2 LEU 29 HD22 LEU 29 47.878 16.819 -6.078 216 3HD2 LEU 29 HD23 LEU 29 49.390 16.096 -5.575 217 H CYS 30 HN CYS 30 52.485 18.515 -8.360 218 HA CYS 30 HA CYS 30 54.870 17.045 -7.663 219 1HB CYS 30 HB2 CYS 30 53.138 15.245 -8.165 220 2HB CYS 30 HB1 CYS 30 53.128 15.873 -9.773 221 H ASP 31 HN ASP 31 56.401 17.000 -9.429 222 HA ASP 31 HA ASP 31 56.056 19.343 -11.237 223 1HB ASP 31 HB2 ASP 31 57.961 19.380 -9.679 224 2HB ASP 31 HB1 ASP 31 58.555 17.863 -10.325 225 H LYS 32 HN LYS 32 56.228 15.939 -11.372 226 HA LYS 32 HA LYS 32 57.411 15.521 -13.919 227 1HB LYS 32 HB2 LYS 32 55.277 13.888 -12.496 228 2HB LYS 32 HB1 LYS 32 56.222 13.336 -13.869 229 1HG LYS 32 HG2 LYS 32 58.327 13.672 -12.550 230 2HG LYS 32 HG1 LYS 32 57.384 14.222 -11.183 231 1HD LYS 32 HD2 LYS 32 58.013 11.875 -10.858 232 2HD LYS 32 HD1 LYS 32 56.277 12.002 -11.022 233 1HE LYS 32 HE2 LYS 32 57.172 10.092 -12.331 234 2HE LYS 32 HE1 LYS 32 56.440 11.266 -13.409 235 1HZ LYS 32 HZ1 LYS 32 58.658 10.392 -14.083 236 2HZ LYS 32 HZ2 LYS 32 59.329 11.236 -12.772 237 3HZ LYS 32 HZ3 LYS 32 58.545 12.085 -14.017 238 H LYS 33 HN LYS 33 54.282 16.752 -13.182 239 HA LYS 33 HA LYS 33 53.712 17.255 -15.983 240 1HB LYS 33 HB2 LYS 33 53.001 14.878 -15.872 241 2HB LYS 33 HB1 LYS 33 52.011 15.223 -14.483 242 1HG LYS 33 HG2 LYS 33 50.582 15.053 -16.372 243 2HG LYS 33 HG1 LYS 33 50.572 16.700 -15.806 244 1HD LYS 33 HD2 LYS 33 52.246 17.300 -17.636 245 2HD LYS 33 HD1 LYS 33 52.183 15.639 -18.182 246 1HE LYS 33 HE2 LYS 33 50.672 17.068 -19.530 247 2HE LYS 33 HE1 LYS 33 49.747 15.872 -18.637 248 1HZ LYS 33 HZ1 LYS 33 48.816 18.126 -18.542 249 2HZ LYS 33 HZ2 LYS 33 50.207 18.649 -17.719 250 3HZ LYS 33 HZ3 LYS 33 49.184 17.498 -17.008 251 H CYS 34 HN CYS 34 51.940 18.526 -16.353 252 HA CYS 34 HA CYS 34 50.883 19.959 -13.978 253 1HB CYS 34 HB2 CYS 34 51.501 20.920 -16.714 254 2HB CYS 34 HB1 CYS 34 50.602 21.858 -15.565 255 H ASN 35 HN ASN 35 49.204 18.445 -14.001 256 HA ASN 35 HA ASN 35 47.110 18.677 -16.141 257 1HB ASN 35 HB2 ASN 35 46.602 17.146 -13.539 258 2HB ASN 35 HB1 ASN 35 45.844 16.972 -15.087 259 1HD2 ASN 35 HD21 ASN 35 47.579 15.250 -13.131 260 2HD2 ASN 35 HD22 ASN 35 48.547 14.337 -14.171 261 H GLN 36 HN GLN 36 45.179 19.759 -15.757 262 HA GLN 36 HA GLN 36 45.135 21.663 -13.480 263 1HB GLN 36 HB2 GLN 36 43.149 22.584 -14.720 264 2HB GLN 36 HB1 GLN 36 44.552 22.476 -15.749 265 1HG GLN 36 HG2 GLN 36 43.653 20.382 -16.778 266 2HG GLN 36 HG1 GLN 36 42.219 20.481 -15.770 267 1HE2 GLN 36 HE21 GLN 36 41.108 22.772 -15.888 268 2HE2 GLN 36 HE22 GLN 36 40.958 23.416 -17.452 269 H ARG 37 HN ARG 37 45.078 20.058 -11.969 270 HA ARG 37 HA ARG 37 42.359 19.075 -11.296 271 1HB ARG 37 HB2 ARG 37 44.936 17.429 -11.155 272 2HB ARG 37 HB1 ARG 37 43.372 16.898 -10.564 273 1HG ARG 37 HG2 ARG 37 42.444 16.976 -12.855 274 2HG ARG 37 HG1 ARG 37 43.962 17.592 -13.477 275 1HD ARG 37 HD2 ARG 37 43.727 15.146 -13.856 276 2HD ARG 37 HD1 ARG 37 45.123 15.503 -12.862 277 HE ARG 37 HE ARG 37 42.557 14.303 -11.940 278 1HH1 ARG 37 HH11 ARG 37 45.811 15.333 -11.226 279 2HH1 ARG 37 HH12 ARG 37 45.857 14.463 -9.733 280 1HH2 ARG 37 HH21 ARG 37 42.623 13.217 -10.054 281 2HH2 ARG 37 HH22 ARG 37 44.039 13.258 -9.057 282 H CYS 38 HN CYS 38 42.584 18.047 -8.952 283 HA CYS 38 HA CYS 38 43.403 20.287 -7.285 284 1HB CYS 38 HB2 CYS 38 41.403 18.888 -6.722 285 2HB CYS 38 HB1 CYS 38 42.460 17.524 -6.415 286 H GLY 39 HN GLY 39 44.648 19.914 -5.313 287 1HA GLY 39 HA2 GLY 39 46.562 17.920 -4.837 288 2HA GLY 39 HA1 GLY 39 47.344 19.137 -5.862 289 H CYS 40 HN CYS 40 48.104 18.626 -3.136 290 HA CYS 40 HA CYS 40 46.943 20.315 -1.222 291 1HB CYS 40 HB2 CYS 40 49.886 19.746 -1.598 292 2HB CYS 40 HB1 CYS 40 49.178 20.445 -0.178 293 H ILE 41 HN ILE 41 47.599 22.325 -0.457 294 HA ILE 41 HA ILE 41 47.814 24.299 -2.571 295 HB ILE 41 HB ILE 41 48.371 24.821 0.383 296 1HG1 ILE 41 HG12 ILE 41 45.984 25.585 0.628 297 2HG1 ILE 41 HG11 ILE 41 45.640 25.133 -1.020 298 1HG2 ILE 41 HG21 ILE 41 47.384 26.582 -1.855 299 2HG2 ILE 41 HG22 ILE 41 48.979 26.639 -1.119 300 3HG2 ILE 41 HG23 ILE 41 47.574 27.090 -0.181 301 1HD1 ILE 41 HD11 ILE 41 45.891 22.739 -0.413 302 2HD1 ILE 41 HD12 ILE 41 44.694 23.533 0.567 303 3HD1 ILE 41 HD13 ILE 41 46.285 23.211 1.236 304 H SER 42 HN SER 42 49.540 25.813 -2.727 305 HA SER 42 HA SER 42 52.160 24.521 -2.824 306 1HB SER 42 HB2 SER 42 52.856 26.747 -3.900 307 2HB SER 42 HB1 SER 42 51.413 26.071 -4.670 308 HG SER 42 HG SER 42 51.659 28.192 -2.866 309 H GLY 43 HN GLY 43 52.604 24.114 -0.781 310 1HA GLY 43 HA2 GLY 43 54.372 25.389 0.739 311 2HA GLY 43 HA1 GLY 43 52.910 26.257 1.238 312 H THR 44 HN THR 44 51.392 23.714 0.620 313 HA THR 44 HA THR 44 51.924 22.295 3.192 314 HB THR 44 HB THR 44 49.516 21.624 3.149 315 HG1 THR 44 HG1 THR 44 49.849 22.366 0.571 316 1HG2 THR 44 HG21 THR 44 50.041 23.887 4.075 317 2HG2 THR 44 HG22 THR 44 48.452 23.825 3.322 318 3HG2 THR 44 HG23 THR 44 49.797 24.582 2.474 319 H VAL 45 HN VAL 45 52.001 20.185 3.212 320 HA VAL 45 HA VAL 45 52.069 18.696 0.633 321 HB VAL 45 HB VAL 45 53.779 17.190 1.841 322 1HG1 VAL 45 HG11 VAL 45 54.637 20.032 1.244 323 2HG1 VAL 45 HG12 VAL 45 54.482 18.712 0.080 324 3HG1 VAL 45 HG13 VAL 45 55.676 18.614 1.356 325 1HG2 VAL 45 HG21 VAL 45 55.120 18.289 3.639 326 2HG2 VAL 45 HG22 VAL 45 53.458 18.067 4.149 327 3HG2 VAL 45 HG23 VAL 45 54.029 19.648 3.626 328 H LEU 46 HN LEU 46 51.013 16.851 0.524 329 HA LEU 46 HA LEU 46 48.925 16.228 2.296 330 1HB LEU 46 HB2 LEU 46 49.096 15.501 -0.089 331 2HB LEU 46 HB1 LEU 46 50.379 14.414 0.341 332 HG LEU 46 HG LEU 46 48.740 13.203 1.877 333 1HD1 LEU 46 HD11 LEU 46 46.747 15.040 0.489 334 2HD1 LEU 46 HD12 LEU 46 47.155 15.117 2.193 335 3HD1 LEU 46 HD13 LEU 46 46.319 13.722 1.556 336 1HD2 LEU 46 HD21 LEU 46 47.522 12.075 0.036 337 2HD2 LEU 46 HD22 LEU 46 49.196 12.355 -0.407 338 3HD2 LEU 46 HD23 LEU 46 47.933 13.390 -1.054 339 H LYS 47 HN LYS 47 49.342 15.909 4.328 340 HA LYS 47 HA LYS 47 51.066 15.271 6.066 341 1HB LYS 47 HB2 LYS 47 48.745 15.191 6.603 342 2HB LYS 47 HB1 LYS 47 48.513 13.678 5.757 343 1HG LYS 47 HG2 LYS 47 49.984 12.538 7.409 344 2HG LYS 47 HG1 LYS 47 50.241 14.064 8.240 345 1HD LYS 47 HD2 LYS 47 47.808 14.210 8.713 346 2HD LYS 47 HD1 LYS 47 47.527 12.710 7.844 347 1HE LYS 47 HE2 LYS 47 49.248 13.011 10.347 348 2HE LYS 47 HE1 LYS 47 47.639 12.307 10.290 349 1HZ LYS 47 HZ1 LYS 47 50.135 11.265 9.123 350 2HZ LYS 47 HZ2 LYS 47 48.615 10.724 8.592 351 3HZ LYS 47 HZ3 LYS 47 49.073 10.512 10.214 352 H SER 48 HN SER 48 49.885 12.394 4.341 353 HA SER 48 HA SER 48 52.560 11.108 4.782 354 1HB SER 48 HB2 SER 48 49.816 9.746 5.008 355 2HB SER 48 HB1 SER 48 51.382 8.950 5.209 356 HG SER 48 HG SER 48 51.707 10.856 6.753 357 H LYS 49 HN LYS 49 52.685 9.088 3.440 358 HA LYS 49 HA LYS 49 53.025 9.689 0.767 359 1HB LYS 49 HB2 LYS 49 52.425 6.997 2.013 360 2HB LYS 49 HB1 LYS 49 53.046 7.214 0.384 361 1HG LYS 49 HG2 LYS 49 55.018 8.427 1.286 362 2HG LYS 49 HG1 LYS 49 54.411 8.225 2.921 363 1HD LYS 49 HD2 LYS 49 54.553 5.753 2.671 364 2HD LYS 49 HD1 LYS 49 55.135 5.948 1.027 365 1HE LYS 49 HE2 LYS 49 57.026 5.579 2.597 366 2HE LYS 49 HE1 LYS 49 57.132 7.176 1.875 367 1HZ LYS 49 HZ1 LYS 49 57.426 6.902 4.394 368 2HZ LYS 49 HZ2 LYS 49 55.729 6.813 4.431 369 3HZ LYS 49 HZ3 LYS 49 56.493 8.195 3.807 370 H ASP 50 HN ASP 50 50.045 8.963 2.305 371 HA ASP 50 HA ASP 50 48.534 9.568 -0.096 372 1HB ASP 50 HB2 ASP 50 49.161 7.162 -0.538 373 2HB ASP 50 HB1 ASP 50 48.437 6.698 0.989 374 H SER 51 HN SER 51 48.415 10.957 2.114 375 HA SER 51 HA SER 51 46.241 10.016 3.888 376 1HB SER 51 HB2 SER 51 48.287 11.241 4.778 377 2HB SER 51 HB1 SER 51 47.789 12.668 3.862 378 HG SER 51 HG SER 51 46.117 11.299 5.687 379 H SER 52 HN SER 52 45.073 12.656 4.236 380 HA SER 52 HA SER 52 43.958 13.458 1.628 381 1HB SER 52 HB2 SER 52 41.590 13.081 2.461 382 2HB SER 52 HB1 SER 52 42.511 11.576 2.346 383 HG SER 52 HG SER 52 43.075 11.902 4.574 384 H GLU 53 HN GLU 53 45.567 14.472 3.829 385 HA GLU 53 HA GLU 53 44.294 17.105 4.180 386 1HB GLU 53 HB2 GLU 53 44.816 17.092 6.637 387 2HB GLU 53 HB1 GLU 53 43.626 15.867 6.247 388 1HG GLU 53 HG2 GLU 53 45.463 14.144 6.209 389 2HG GLU 53 HG1 GLU 53 46.611 15.386 6.678 390 H CYS 54 HN CYS 54 45.809 18.640 3.971 391 HA CYS 54 HA CYS 54 48.659 17.751 3.765 392 1HB CYS 54 HB2 CYS 54 47.406 20.211 2.569 393 2HB CYS 54 HB1 CYS 54 48.975 19.550 2.227 394 H VAL 55 HN VAL 55 50.192 18.844 4.788 395 HA VAL 55 HA VAL 55 49.547 21.223 6.431 396 HB VAL 55 HB VAL 55 50.751 20.181 8.355 397 1HG1 VAL 55 HG11 VAL 55 48.947 18.578 9.054 398 2HG1 VAL 55 HG12 VAL 55 48.387 18.487 7.395 399 3HG1 VAL 55 HG13 VAL 55 48.248 19.993 8.287 400 1HG2 VAL 55 HG21 VAL 55 52.175 18.645 7.300 401 2HG2 VAL 55 HG22 VAL 55 50.816 17.642 6.793 402 3HG2 VAL 55 HG23 VAL 55 51.197 17.829 8.504 403 H HIS 56 HN HIS 56 51.285 22.577 6.710 404 HA HIS 56 HA HIS 56 53.278 22.631 4.740 405 1HB HIS 56 HB2 HIS 56 53.302 23.930 7.510 406 2HB HIS 56 HB1 HIS 56 54.370 24.389 6.197 407 HD1 HIS 56 HD1 HIS 56 53.205 25.599 4.205 408 HD2 HIS 56 HD2 HIS 56 50.623 24.788 7.261 409 HE1 HIS 56 HE1 HIS 56 51.169 26.917 3.760 410 HA PRO 57 HA PRO 57 56.480 19.852 5.974 411 1HB PRO 57 HB2 PRO 57 58.728 21.311 5.323 412 2HB PRO 57 HB1 PRO 57 57.700 20.539 4.139 413 1HG PRO 57 HG2 PRO 57 57.640 23.387 5.049 414 2HG PRO 57 HG1 PRO 57 57.637 22.740 3.396 415 1HD PRO 57 HD2 PRO 57 55.391 23.528 4.526 416 2HD PRO 57 HD1 PRO 57 55.417 22.060 3.529 417 H SER 58 HN SER 58 56.290 23.034 7.232 418 HA SER 58 HA SER 58 58.274 22.753 9.335 419 1HB SER 58 HB2 SER 58 57.344 24.986 10.074 420 2HB SER 58 HB1 SER 58 57.715 24.971 8.343 421 HG SER 58 HG SER 58 55.500 24.258 8.045 422 H LYS 59 HN LYS 59 54.970 21.880 9.040 423 HA LYS 59 HA LYS 59 54.720 21.536 12.002 424 1HB LYS 59 HB2 LYS 59 52.278 21.453 11.575 425 2HB LYS 59 HB1 LYS 59 52.999 23.005 11.156 426 1HG LYS 59 HG2 LYS 59 53.040 22.324 8.797 427 2HG LYS 59 HG1 LYS 59 52.335 20.786 9.226 428 1HD LYS 59 HD2 LYS 59 51.086 23.568 9.613 429 2HD LYS 59 HD1 LYS 59 50.595 22.426 8.387 430 1HE LYS 59 HE2 LYS 59 49.851 20.833 10.203 431 2HE LYS 59 HE1 LYS 59 50.265 22.057 11.393 432 1HZ LYS 59 HZ1 LYS 59 48.011 22.296 10.980 433 2HZ LYS 59 HZ2 LYS 59 48.208 22.219 9.295 434 3HZ LYS 59 HZ3 LYS 59 48.756 23.578 10.152 435 H CYS 60 HN CYS 60 54.744 19.878 9.000 436 HA CYS 60 HA CYS 60 53.356 17.532 9.416 437 1HB CYS 60 HB2 CYS 60 55.973 18.090 8.171 438 2HB CYS 60 HB1 CYS 60 55.440 16.436 8.197 Start of MODEL 8 1 1H ASN 1 HT1 ASN 1 40.209 23.736 -13.019 2 2H ASN 1 HT2 ASN 1 40.017 25.366 -12.582 3 3H ASN 1 HT3 ASN 1 38.786 24.564 -13.435 4 HA ASN 1 HA ASN 1 39.582 24.290 -10.620 5 1HB ASN 1 HB2 ASN 1 37.719 25.839 -11.210 6 2HB ASN 1 HB1 ASN 1 36.877 24.523 -12.017 7 1HD2 ASN 1 HD21 ASN 1 38.452 25.079 -8.811 8 2HD2 ASN 1 HD22 ASN 1 37.209 24.356 -7.909 9 H PHE 2 HN PHE 2 38.773 22.502 -9.443 10 HA PHE 2 HA PHE 2 37.739 20.120 -10.825 11 1HB PHE 2 HB2 PHE 2 40.302 20.152 -11.084 12 2HB PHE 2 HB1 PHE 2 40.423 20.121 -9.335 13 HD1 PHE 2 HD1 PHE 2 38.649 18.212 -12.057 14 HD2 PHE 2 HD2 PHE 2 40.783 18.021 -8.381 15 HE1 PHE 2 HE1 PHE 2 38.528 15.764 -12.109 16 HE2 PHE 2 HE2 PHE 2 40.667 15.573 -8.434 17 HZ PHE 2 HZ PHE 2 39.535 14.437 -10.299 18 H VAL 3 HN VAL 3 38.672 18.684 -8.427 19 HA VAL 3 HA VAL 3 37.253 19.963 -6.173 20 HB VAL 3 HB VAL 3 35.495 18.734 -7.458 21 1HG1 VAL 3 HG11 VAL 3 37.197 16.246 -6.985 22 2HG1 VAL 3 HG12 VAL 3 36.925 17.021 -8.536 23 3HG1 VAL 3 HG13 VAL 3 35.591 16.264 -7.687 24 1HG2 VAL 3 HG21 VAL 3 36.193 17.346 -4.833 25 2HG2 VAL 3 HG22 VAL 3 34.625 17.312 -5.618 26 3HG2 VAL 3 HG23 VAL 3 35.262 18.826 -5.000 27 H CYS 4 HN CYS 4 37.814 19.243 -4.225 28 HA CYS 4 HA CYS 4 39.858 17.099 -3.940 29 1HB CYS 4 HB2 CYS 4 39.955 19.882 -2.875 30 2HB CYS 4 HB1 CYS 4 41.023 18.644 -2.319 31 HA PRO 5 HA PRO 5 37.963 17.090 0.300 32 1HB PRO 5 HB2 PRO 5 40.310 16.061 1.560 33 2HB PRO 5 HB1 PRO 5 38.897 15.168 1.088 34 1HG PRO 5 HG2 PRO 5 41.386 14.822 -0.059 35 2HG PRO 5 HG1 PRO 5 39.858 14.388 -0.848 36 1HD PRO 5 HD2 PRO 5 41.494 16.883 -1.138 37 2HD PRO 5 HD1 PRO 5 40.754 15.906 -2.412 38 HA PRO 6 HA PRO 6 39.663 20.493 2.765 39 1HB PRO 6 HB2 PRO 6 40.514 19.113 5.070 40 2HB PRO 6 HB1 PRO 6 38.914 19.757 4.812 41 1HG PRO 6 HG2 PRO 6 39.890 16.965 4.284 42 2HG PRO 6 HG1 PRO 6 38.376 17.491 5.046 43 1HD PRO 6 HD2 PRO 6 38.343 16.675 2.599 44 2HD PRO 6 HD1 PRO 6 37.463 18.155 2.974 45 H GLY 7 HN GLY 7 41.651 21.420 3.243 46 1HA GLY 7 HA2 GLY 7 43.985 21.634 3.354 47 2HA GLY 7 HA1 GLY 7 44.121 19.885 3.337 48 H GLN 8 HN GLN 8 42.321 20.215 0.713 49 HA GLN 8 HA GLN 8 44.547 20.983 -1.112 50 1HB GLN 8 HB2 GLN 8 42.719 18.567 -1.340 51 2HB GLN 8 HB1 GLN 8 43.915 19.048 -2.536 52 1HG GLN 8 HG2 GLN 8 45.707 18.650 -0.920 53 2HG GLN 8 HG1 GLN 8 44.540 18.246 0.337 54 1HE2 GLN 8 HE21 GLN 8 43.378 16.230 0.133 55 2HE2 GLN 8 HE22 GLN 8 43.916 14.991 -0.892 56 H THR 9 HN THR 9 43.944 21.709 -3.112 57 HA THR 9 HA THR 9 41.102 22.255 -3.727 58 HB THR 9 HB THR 9 41.854 24.238 -2.369 59 HG1 THR 9 HG1 THR 9 40.646 24.267 -4.529 60 1HG2 THR 9 HG21 THR 9 43.636 25.720 -3.274 61 2HG2 THR 9 HG22 THR 9 43.879 24.650 -4.644 62 3HG2 THR 9 HG23 THR 9 44.342 24.129 -3.041 63 H PHE 10 HN PHE 10 41.290 23.716 -5.896 64 HA PHE 10 HA PHE 10 42.203 21.985 -7.938 65 1HB PHE 10 HB2 PHE 10 40.523 23.741 -8.390 66 2HB PHE 10 HB1 PHE 10 41.697 25.001 -8.045 67 HD1 PHE 10 HD1 PHE 10 41.482 21.922 -10.219 68 HD2 PHE 10 HD2 PHE 10 42.677 25.999 -9.919 69 HE1 PHE 10 HE1 PHE 10 42.222 21.879 -12.553 70 HE2 PHE 10 HE2 PHE 10 43.419 25.950 -12.253 71 HZ PHE 10 HZ PHE 10 43.196 23.896 -13.576 72 H GLN 11 HN GLN 11 43.959 22.279 -9.475 73 HA GLN 11 HA GLN 11 46.173 24.058 -8.787 74 1HB GLN 11 HB2 GLN 11 46.190 21.888 -7.221 75 2HB GLN 11 HB1 GLN 11 46.643 21.035 -8.664 76 1HG GLN 11 HG2 GLN 11 48.705 21.579 -7.414 77 2HG GLN 11 HG1 GLN 11 48.699 22.618 -8.830 78 1HE2 GLN 11 HE21 GLN 11 47.435 22.587 -5.422 79 2HE2 GLN 11 HE22 GLN 11 47.753 24.202 -5.136 80 H THR 12 HN THR 12 47.171 24.448 -10.747 81 HA THR 12 HA THR 12 46.022 23.187 -13.121 82 HB THR 12 HB THR 12 46.514 25.622 -13.169 83 HG1 THR 12 HG1 THR 12 47.022 25.263 -15.150 84 1HG2 THR 12 HG21 THR 12 49.445 24.850 -12.939 85 2HG2 THR 12 HG22 THR 12 48.521 25.591 -11.631 86 3HG2 THR 12 HG23 THR 12 48.779 26.462 -13.145 87 H CYS 13 HN CYS 13 49.319 23.406 -11.736 88 HA CYS 13 HA CYS 13 50.040 21.046 -13.362 89 1HB CYS 13 HB2 CYS 13 51.710 23.107 -11.918 90 2HB CYS 13 HB1 CYS 13 52.412 21.619 -12.513 91 H ALA 14 HN ALA 14 48.990 19.532 -12.222 92 HA ALA 14 HA ALA 14 50.390 18.488 -9.913 93 1HB ALA 14 HB1 ALA 14 48.330 18.614 -8.410 94 2HB ALA 14 HB2 ALA 14 47.500 19.456 -9.698 95 3HB ALA 14 HB3 ALA 14 48.888 20.189 -8.904 96 H SER 15 HN SER 15 50.708 16.653 -10.895 97 HA SER 15 HA SER 15 48.467 15.239 -12.155 98 1HB SER 15 HB2 SER 15 50.561 15.564 -13.364 99 2HB SER 15 HB1 SER 15 51.468 14.698 -12.163 100 HG SER 15 HG SER 15 50.499 12.839 -12.720 101 H SER 16 HN SER 16 48.959 12.738 -12.089 102 HA SER 16 HA SER 16 47.901 11.782 -9.698 103 1HB SER 16 HB2 SER 16 48.382 9.502 -10.725 104 2HB SER 16 HB1 SER 16 47.646 10.626 -11.877 105 HG SER 16 HG SER 16 50.432 10.255 -11.498 106 H CYS 17 HN CYS 17 50.904 12.895 -10.033 107 HA CYS 17 HA CYS 17 52.303 10.988 -8.233 108 1HB CYS 17 HB2 CYS 17 54.271 12.512 -9.057 109 2HB CYS 17 HB1 CYS 17 53.584 11.301 -10.106 110 HA PRO 18 HA PRO 18 50.872 14.504 -5.583 111 1HB PRO 18 HB2 PRO 18 50.446 13.143 -3.285 112 2HB PRO 18 HB1 PRO 18 49.304 13.156 -4.609 113 1HG PRO 18 HG2 PRO 18 51.415 11.113 -4.015 114 2HG PRO 18 HG1 PRO 18 49.692 10.864 -4.365 115 1HD PRO 18 HD2 PRO 18 51.498 10.542 -6.268 116 2HD PRO 18 HD1 PRO 18 49.935 11.324 -6.617 117 H LYS 19 HN LYS 19 51.484 15.511 -3.700 118 HA LYS 19 HA LYS 19 54.361 15.230 -2.891 119 1HB LYS 19 HB2 LYS 19 54.239 17.618 -2.351 120 2HB LYS 19 HB1 LYS 19 53.601 17.446 -3.977 121 1HG LYS 19 HG2 LYS 19 51.243 17.396 -2.967 122 2HG LYS 19 HG1 LYS 19 51.966 17.791 -1.435 123 1HD LYS 19 HD2 LYS 19 52.099 19.575 -3.877 124 2HD LYS 19 HD1 LYS 19 50.999 19.763 -2.564 125 1HE LYS 19 HE2 LYS 19 52.836 21.334 -2.305 126 2HE LYS 19 HE1 LYS 19 52.957 20.134 -1.032 127 1HZ LYS 19 HZ1 LYS 19 54.921 19.523 -1.744 128 2HZ LYS 19 HZ2 LYS 19 54.883 20.838 -2.820 129 3HZ LYS 19 HZ3 LYS 19 54.371 19.309 -3.337 130 H THR 20 HN THR 20 54.750 14.978 -0.783 131 HA THR 20 HA THR 20 52.524 15.159 1.134 132 HB THR 20 HB THR 20 52.854 12.835 1.924 133 HG1 THR 20 HG1 THR 20 54.894 13.059 -0.019 134 1HG2 THR 20 HG21 THR 20 52.224 11.470 -0.078 135 2HG2 THR 20 HG22 THR 20 52.805 12.708 -1.163 136 3HG2 THR 20 HG23 THR 20 51.356 12.962 -0.231 137 H CYS 21 HN CYS 21 53.393 14.298 3.298 138 HA CYS 21 HA CYS 21 55.438 16.071 4.172 139 1HB CYS 21 HB2 CYS 21 54.060 13.644 5.367 140 2HB CYS 21 HB1 CYS 21 55.234 14.568 6.271 141 H GLU 22 HN GLU 22 55.527 13.084 2.688 142 HA GLU 22 HA GLU 22 58.161 12.212 3.602 143 1HB GLU 22 HB2 GLU 22 56.471 11.302 1.217 144 2HB GLU 22 HB1 GLU 22 57.966 10.546 1.706 145 1HG GLU 22 HG2 GLU 22 56.055 9.270 2.595 146 2HG GLU 22 HG1 GLU 22 56.989 9.951 3.909 147 H THR 23 HN THR 23 56.856 13.746 0.570 148 HA THR 23 HA THR 23 59.580 14.076 -0.466 149 HB THR 23 HB THR 23 58.405 15.425 -2.282 150 HG1 THR 23 HG1 THR 23 56.250 14.759 -0.576 151 1HG2 THR 23 HG21 THR 23 57.052 12.752 -1.709 152 2HG2 THR 23 HG22 THR 23 58.592 12.933 -2.546 153 3HG2 THR 23 HG23 THR 23 57.123 13.578 -3.260 154 H ARG 24 HN ARG 24 57.218 16.712 -0.245 155 HA ARG 24 HA ARG 24 57.370 18.885 0.512 156 1HB ARG 24 HB2 ARG 24 59.657 17.818 2.234 157 2HB ARG 24 HB1 ARG 24 58.906 19.384 2.384 158 1HG ARG 24 HG2 ARG 24 56.740 18.353 2.842 159 2HG ARG 24 HG1 ARG 24 57.424 16.749 2.604 160 1HD ARG 24 HD2 ARG 24 58.281 18.713 4.760 161 2HD ARG 24 HD1 ARG 24 57.263 17.302 5.011 162 HE ARG 24 HE ARG 24 59.222 15.944 4.110 163 1HH1 ARG 24 HH11 ARG 24 59.715 19.003 5.715 164 2HH1 ARG 24 HH12 ARG 24 61.317 18.583 6.203 165 1HH2 ARG 24 HH21 ARG 24 61.229 15.431 4.736 166 2HH2 ARG 24 HH22 ARG 24 62.184 16.546 5.654 167 H ASN 25 HN ASN 25 59.982 17.362 -0.868 168 HA ASN 25 HA ASN 25 61.900 19.395 -1.127 169 1HB ASN 25 HB2 ASN 25 61.321 16.965 -2.873 170 2HB ASN 25 HB1 ASN 25 62.820 17.865 -2.897 171 1HD2 ASN 25 HD21 ASN 25 62.250 18.070 0.279 172 2HD2 ASN 25 HD22 ASN 25 62.928 16.610 0.816 173 H LYS 26 HN LYS 26 58.959 18.925 -2.798 174 HA LYS 26 HA LYS 26 59.622 21.163 -4.656 175 1HB LYS 26 HB2 LYS 26 58.566 20.023 -6.514 176 2HB LYS 26 HB1 LYS 26 59.643 18.852 -5.795 177 1HG LYS 26 HG2 LYS 26 56.646 18.917 -5.443 178 2HG LYS 26 HG1 LYS 26 57.572 17.849 -6.466 179 1HD LYS 26 HD2 LYS 26 58.638 16.795 -4.513 180 2HD LYS 26 HD1 LYS 26 57.724 17.849 -3.439 181 1HE LYS 26 HE2 LYS 26 56.548 15.687 -3.690 182 2HE LYS 26 HE1 LYS 26 55.603 17.009 -4.342 183 1HZ LYS 26 HZ1 LYS 26 55.698 16.181 -6.371 184 2HZ LYS 26 HZ2 LYS 26 56.173 14.730 -5.628 185 3HZ LYS 26 HZ3 LYS 26 57.345 15.783 -6.263 186 H LEU 27 HN LEU 27 58.125 22.686 -4.623 187 HA LEU 27 HA LEU 27 55.830 22.437 -2.788 188 1HB LEU 27 HB2 LEU 27 57.009 24.791 -4.268 189 2HB LEU 27 HB1 LEU 27 55.592 24.905 -3.239 190 HG LEU 27 HG LEU 27 56.894 24.034 -1.358 191 1HD1 LEU 27 HD11 LEU 27 58.786 22.854 -2.433 192 2HD1 LEU 27 HD12 LEU 27 59.392 24.101 -1.378 193 3HD1 LEU 27 HD13 LEU 27 59.362 24.369 -3.112 194 1HD2 LEU 27 HD21 LEU 27 56.569 26.458 -1.596 195 2HD2 LEU 27 HD22 LEU 27 57.984 26.582 -2.629 196 3HD2 LEU 27 HD23 LEU 27 58.167 26.172 -0.931 197 H VAL 28 HN VAL 28 55.396 20.925 -4.805 198 HA VAL 28 HA VAL 28 52.869 21.933 -5.992 199 HB VAL 28 HB VAL 28 54.770 20.542 -7.804 200 1HG1 VAL 28 HG11 VAL 28 52.477 22.358 -8.369 201 2HG1 VAL 28 HG12 VAL 28 52.543 20.605 -8.512 202 3HG1 VAL 28 HG13 VAL 28 53.494 21.609 -9.593 203 1HG2 VAL 28 HG21 VAL 28 56.101 22.577 -7.154 204 2HG2 VAL 28 HG22 VAL 28 54.733 23.605 -7.553 205 3HG2 VAL 28 HG23 VAL 28 55.576 22.726 -8.818 206 H LEU 29 HN LEU 29 51.643 20.183 -6.794 207 HA LEU 29 HA LEU 29 51.750 17.953 -5.139 208 1HB LEU 29 HB2 LEU 29 49.756 18.766 -6.464 209 2HB LEU 29 HB1 LEU 29 50.576 18.237 -7.908 210 HG LEU 29 HG LEU 29 50.477 15.849 -6.977 211 1HD1 LEU 29 HD11 LEU 29 48.760 17.184 -4.811 212 2HD1 LEU 29 HD12 LEU 29 50.346 16.499 -4.552 213 3HD1 LEU 29 HD13 LEU 29 49.002 15.456 -4.961 214 1HD2 LEU 29 HD21 LEU 29 48.639 16.499 -8.472 215 2HD2 LEU 29 HD22 LEU 29 47.738 17.122 -7.096 216 3HD2 LEU 29 HD23 LEU 29 48.083 15.409 -7.220 217 H CYS 30 HN CYS 30 52.896 18.393 -8.279 218 HA CYS 30 HA CYS 30 54.668 15.965 -8.110 219 1HB CYS 30 HB2 CYS 30 53.369 17.170 -10.575 220 2HB CYS 30 HB1 CYS 30 54.472 15.819 -10.581 221 H ASP 31 HN ASP 31 55.597 17.292 -10.899 222 HA ASP 31 HA ASP 31 56.948 19.689 -10.016 223 1HB ASP 31 HB2 ASP 31 59.265 18.746 -10.178 224 2HB ASP 31 HB1 ASP 31 58.358 17.980 -8.883 225 H LYS 32 HN LYS 32 56.669 17.145 -12.334 226 HA LYS 32 HA LYS 32 57.503 19.002 -14.527 227 1HB LYS 32 HB2 LYS 32 58.122 16.969 -15.800 228 2HB LYS 32 HB1 LYS 32 59.004 17.137 -14.297 229 1HG LYS 32 HG2 LYS 32 57.434 15.492 -13.207 230 2HG LYS 32 HG1 LYS 32 56.565 15.333 -14.718 231 1HD LYS 32 HD2 LYS 32 58.095 13.457 -14.471 232 2HD LYS 32 HD1 LYS 32 58.596 14.448 -15.825 233 1HE LYS 32 HE2 LYS 32 60.348 15.519 -14.386 234 2HE LYS 32 HE1 LYS 32 59.825 14.521 -13.033 235 1HZ LYS 32 HZ1 LYS 32 60.359 12.565 -14.359 236 2HZ LYS 32 HZ2 LYS 32 61.712 13.558 -14.099 237 3HZ LYS 32 HZ3 LYS 32 60.930 13.565 -15.607 238 H LYS 33 HN LYS 33 55.086 16.528 -13.734 239 HA LYS 33 HA LYS 33 53.641 17.040 -16.258 240 1HB LYS 33 HB2 LYS 33 53.660 14.745 -15.188 241 2HB LYS 33 HB1 LYS 33 52.769 15.419 -13.839 242 1HG LYS 33 HG2 LYS 33 51.229 14.290 -15.369 243 2HG LYS 33 HG1 LYS 33 50.882 16.001 -15.365 244 1HD LYS 33 HD2 LYS 33 52.183 16.261 -17.502 245 2HD LYS 33 HD1 LYS 33 52.529 14.541 -17.483 246 1HE LYS 33 HE2 LYS 33 50.078 14.072 -17.612 247 2HE LYS 33 HE1 LYS 33 49.758 15.804 -17.627 248 1HZ LYS 33 HZ1 LYS 33 49.758 14.878 -19.839 249 2HZ LYS 33 HZ2 LYS 33 51.356 14.338 -19.640 250 3HZ LYS 33 HZ3 LYS 33 51.019 16.002 -19.652 251 H CYS 34 HN CYS 34 51.560 17.858 -16.398 252 HA CYS 34 HA CYS 34 50.651 19.422 -14.072 253 1HB CYS 34 HB2 CYS 34 51.013 20.384 -16.864 254 2HB CYS 34 HB1 CYS 34 50.125 21.291 -15.657 255 H ASN 35 HN ASN 35 49.183 17.800 -13.923 256 HA ASN 35 HA ASN 35 46.917 17.660 -15.860 257 1HB ASN 35 HB2 ASN 35 46.997 16.450 -13.047 258 2HB ASN 35 HB1 ASN 35 45.822 16.100 -14.279 259 1HD2 ASN 35 HD21 ASN 35 47.041 14.075 -13.024 260 2HD2 ASN 35 HD22 ASN 35 48.112 13.225 -14.001 261 H GLN 36 HN GLN 36 45.220 19.065 -15.673 262 HA GLN 36 HA GLN 36 45.157 21.079 -13.485 263 1HB GLN 36 HB2 GLN 36 43.013 20.688 -15.643 264 2HB GLN 36 HB1 GLN 36 43.477 22.146 -14.787 265 1HG GLN 36 HG2 GLN 36 45.254 20.809 -16.840 266 2HG GLN 36 HG1 GLN 36 44.164 22.136 -17.184 267 1HE2 GLN 36 HE21 GLN 36 47.327 21.474 -16.418 268 2HE2 GLN 36 HE22 GLN 36 47.761 22.975 -15.760 269 H ARG 37 HN ARG 37 44.885 19.583 -11.812 270 HA ARG 37 HA ARG 37 42.056 18.872 -11.317 271 1HB ARG 37 HB2 ARG 37 42.719 16.543 -10.605 272 2HB ARG 37 HB1 ARG 37 43.029 16.843 -12.282 273 1HG ARG 37 HG2 ARG 37 45.394 17.315 -11.833 274 2HG ARG 37 HG1 ARG 37 45.151 17.087 -10.113 275 1HD ARG 37 HD2 ARG 37 44.694 14.945 -12.238 276 2HD ARG 37 HD1 ARG 37 46.108 15.030 -11.200 277 HE ARG 37 HE ARG 37 43.426 14.151 -10.422 278 1HH1 ARG 37 HH11 ARG 37 46.489 15.398 -9.358 279 2HH1 ARG 37 HH12 ARG 37 46.300 14.782 -7.751 280 1HH2 ARG 37 HH21 ARG 37 43.177 13.371 -8.393 281 2HH2 ARG 37 HH22 ARG 37 44.404 13.622 -7.194 282 H CYS 38 HN CYS 38 42.812 17.369 -8.933 283 HA CYS 38 HA CYS 38 42.995 19.616 -7.124 284 1HB CYS 38 HB2 CYS 38 41.743 17.555 -6.525 285 2HB CYS 38 HB1 CYS 38 43.237 16.644 -6.510 286 H GLY 39 HN GLY 39 44.519 19.743 -5.365 287 1HA GLY 39 HA2 GLY 39 47.155 18.642 -5.325 288 2HA GLY 39 HA1 GLY 39 47.187 20.187 -6.160 289 H CYS 40 HN CYS 40 48.150 19.259 -3.357 290 HA CYS 40 HA CYS 40 46.536 20.496 -1.382 291 1HB CYS 40 HB2 CYS 40 49.557 20.381 -1.441 292 2HB CYS 40 HB1 CYS 40 48.595 20.778 -0.064 293 H ILE 41 HN ILE 41 47.288 22.470 -0.182 294 HA ILE 41 HA ILE 41 47.160 24.690 -2.051 295 HB ILE 41 HB ILE 41 48.018 25.059 0.842 296 1HG1 ILE 41 HG12 ILE 41 46.108 23.482 1.051 297 2HG1 ILE 41 HG11 ILE 41 45.606 25.077 1.538 298 1HG2 ILE 41 HG21 ILE 41 47.879 26.991 -0.694 299 2HG2 ILE 41 HG22 ILE 41 46.629 27.113 0.531 300 3HG2 ILE 41 HG23 ILE 41 46.227 26.581 -1.095 301 1HD1 ILE 41 HD11 ILE 41 43.875 24.007 0.155 302 2HD1 ILE 41 HD12 ILE 41 45.025 23.810 -1.154 303 3HD1 ILE 41 HD13 ILE 41 44.499 25.420 -0.676 304 H SER 42 HN SER 42 48.786 26.330 -2.214 305 HA SER 42 HA SER 42 51.443 25.250 -2.667 306 1HB SER 42 HB2 SER 42 50.416 28.144 -2.783 307 2HB SER 42 HB1 SER 42 51.972 27.593 -3.431 308 HG SER 42 HG SER 42 50.746 26.021 -4.632 309 H GLY 43 HN GLY 43 52.240 24.563 -0.792 310 1HA GLY 43 HA2 GLY 43 54.034 25.564 0.773 311 2HA GLY 43 HA1 GLY 43 52.691 26.485 1.453 312 H THR 44 HN THR 44 51.222 23.788 0.611 313 HA THR 44 HA THR 44 51.801 22.329 3.153 314 HB THR 44 HB THR 44 49.355 21.701 3.186 315 HG1 THR 44 HG1 THR 44 49.509 22.335 0.697 316 1HG2 THR 44 HG21 THR 44 49.743 24.701 2.774 317 2HG2 THR 44 HG22 THR 44 50.054 23.858 4.288 318 3HG2 THR 44 HG23 THR 44 48.420 23.929 3.640 319 H VAL 45 HN VAL 45 51.746 20.209 3.126 320 HA VAL 45 HA VAL 45 51.718 18.795 0.519 321 HB VAL 45 HB VAL 45 53.382 17.165 1.656 322 1HG1 VAL 45 HG11 VAL 45 54.142 18.740 -0.036 323 2HG1 VAL 45 HG12 VAL 45 55.345 18.551 1.218 324 3HG1 VAL 45 HG13 VAL 45 54.344 20.001 1.181 325 1HG2 VAL 45 HG21 VAL 45 53.704 19.528 3.572 326 2HG2 VAL 45 HG22 VAL 45 54.717 18.104 3.556 327 3HG2 VAL 45 HG23 VAL 45 53.037 17.967 4.019 328 H LEU 46 HN LEU 46 50.786 16.831 0.424 329 HA LEU 46 HA LEU 46 48.563 16.259 2.038 330 1HB LEU 46 HB2 LEU 46 49.223 15.303 -0.283 331 2HB LEU 46 HB1 LEU 46 50.286 14.240 0.604 332 HG LEU 46 HG LEU 46 48.296 13.278 1.806 333 1HD1 LEU 46 HD11 LEU 46 46.741 14.935 -0.235 334 2HD1 LEU 46 HD12 LEU 46 46.748 15.246 1.483 335 3HD1 LEU 46 HD13 LEU 46 46.035 13.774 0.871 336 1HD2 LEU 46 HD21 LEU 46 48.188 13.164 -1.244 337 2HD2 LEU 46 HD22 LEU 46 47.467 11.995 -0.155 338 3HD2 LEU 46 HD23 LEU 46 49.214 12.166 -0.229 339 H LYS 47 HN LYS 47 48.439 15.469 4.024 340 HA LYS 47 HA LYS 47 50.399 15.271 5.909 341 1HB LYS 47 HB2 LYS 47 47.855 13.643 5.757 342 2HB LYS 47 HB1 LYS 47 48.805 13.773 7.231 343 1HG LYS 47 HG2 LYS 47 48.608 16.278 6.888 344 2HG LYS 47 HG1 LYS 47 47.432 15.898 5.647 345 1HD LYS 47 HD2 LYS 47 47.192 15.157 8.593 346 2HD LYS 47 HD1 LYS 47 46.251 16.382 7.773 347 1HE LYS 47 HE2 LYS 47 45.290 14.535 6.277 348 2HE LYS 47 HE1 LYS 47 46.176 13.386 7.270 349 1HZ LYS 47 HZ1 LYS 47 44.515 15.270 8.700 350 2HZ LYS 47 HZ2 LYS 47 44.816 13.623 8.990 351 3HZ LYS 47 HZ3 LYS 47 43.711 14.088 7.785 352 H SER 48 HN SER 48 49.471 12.610 3.821 353 HA SER 48 HA SER 48 51.990 11.277 4.571 354 1HB SER 48 HB2 SER 48 49.246 9.866 4.675 355 2HB SER 48 HB1 SER 48 50.802 9.073 4.955 356 HG SER 48 HG SER 48 49.699 11.237 6.408 357 H LYS 49 HN LYS 49 52.016 9.107 3.281 358 HA LYS 49 HA LYS 49 52.624 9.653 0.653 359 1HB LYS 49 HB2 LYS 49 53.236 7.584 1.839 360 2HB LYS 49 HB1 LYS 49 51.571 7.051 1.814 361 1HG LYS 49 HG2 LYS 49 52.865 5.916 0.051 362 2HG LYS 49 HG1 LYS 49 51.622 6.913 -0.668 363 1HD LYS 49 HD2 LYS 49 53.332 8.701 -1.111 364 2HD LYS 49 HD1 LYS 49 54.565 7.691 -0.373 365 1HE LYS 49 HE2 LYS 49 54.160 5.953 -2.114 366 2HE LYS 49 HE1 LYS 49 52.916 6.969 -2.835 367 1HZ LYS 49 HZ1 LYS 49 54.567 8.661 -3.241 368 2HZ LYS 49 HZ2 LYS 49 55.022 7.194 -3.966 369 3HZ LYS 49 HZ3 LYS 49 55.770 7.699 -2.528 370 H ASP 50 HN ASP 50 49.538 9.088 2.033 371 HA ASP 50 HA ASP 50 48.129 10.024 -0.322 372 1HB ASP 50 HB2 ASP 50 48.605 7.658 -1.017 373 2HB ASP 50 HB1 ASP 50 47.817 7.074 0.436 374 H SER 51 HN SER 51 47.909 11.308 1.925 375 HA SER 51 HA SER 51 45.764 10.207 3.631 376 1HB SER 51 HB2 SER 51 47.774 11.446 4.573 377 2HB SER 51 HB1 SER 51 47.207 12.904 3.745 378 HG SER 51 HG SER 51 45.603 13.055 5.092 379 H SER 52 HN SER 52 44.515 12.788 4.119 380 HA SER 52 HA SER 52 43.087 13.282 1.543 381 1HB SER 52 HB2 SER 52 41.020 13.601 2.947 382 2HB SER 52 HB1 SER 52 41.690 11.975 3.149 383 HG SER 52 HG SER 52 42.967 13.012 4.909 384 H GLU 53 HN GLU 53 44.561 14.608 4.376 385 HA GLU 53 HA GLU 53 43.902 17.373 3.451 386 1HB GLU 53 HB2 GLU 53 44.675 16.477 6.256 387 2HB GLU 53 HB1 GLU 53 44.266 18.105 5.775 388 1HG GLU 53 HG2 GLU 53 41.995 17.363 5.103 389 2HG GLU 53 HG1 GLU 53 42.378 15.719 5.587 390 H CYS 54 HN CYS 54 45.638 18.962 4.307 391 HA CYS 54 HA CYS 54 48.355 17.827 3.848 392 1HB CYS 54 HB2 CYS 54 47.298 20.308 2.493 393 2HB CYS 54 HB1 CYS 54 48.863 19.590 2.262 394 H VAL 55 HN VAL 55 49.948 18.813 4.913 395 HA VAL 55 HA VAL 55 49.379 21.281 6.485 396 HB VAL 55 HB VAL 55 50.514 20.360 8.403 397 1HG1 VAL 55 HG11 VAL 55 48.336 18.460 7.470 398 2HG1 VAL 55 HG12 VAL 55 48.112 19.967 8.345 399 3HG1 VAL 55 HG13 VAL 55 48.902 18.607 9.127 400 1HG2 VAL 55 HG21 VAL 55 51.224 17.954 8.546 401 2HG2 VAL 55 HG22 VAL 55 52.133 18.819 7.328 402 3HG2 VAL 55 HG23 VAL 55 50.830 17.744 6.850 403 H HIS 56 HN HIS 56 51.243 22.468 6.989 404 HA HIS 56 HA HIS 56 53.107 22.706 4.903 405 1HB HIS 56 HB2 HIS 56 53.172 23.685 7.743 406 2HB HIS 56 HB1 HIS 56 54.292 24.277 6.527 407 HD1 HIS 56 HD1 HIS 56 53.162 25.696 4.622 408 HD2 HIS 56 HD2 HIS 56 50.527 24.626 7.550 409 HE1 HIS 56 HE1 HIS 56 51.145 27.073 4.276 410 HA PRO 57 HA PRO 57 56.625 20.159 6.044 411 1HB PRO 57 HB2 PRO 57 58.633 21.687 4.989 412 2HB PRO 57 HB1 PRO 57 57.578 20.709 4.001 413 1HG PRO 57 HG2 PRO 57 57.406 23.634 4.567 414 2HG PRO 57 HG1 PRO 57 57.204 22.773 3.031 415 1HD PRO 57 HD2 PRO 57 55.123 23.637 4.503 416 2HD PRO 57 HD1 PRO 57 55.035 22.175 3.502 417 H SER 58 HN SER 58 55.644 22.902 7.475 418 HA SER 58 HA SER 58 57.955 23.756 8.970 419 1HB SER 58 HB2 SER 58 56.220 24.912 10.418 420 2HB SER 58 HB1 SER 58 55.864 25.173 8.705 421 HG SER 58 HG SER 58 54.656 23.063 8.986 422 H LYS 59 HN LYS 59 55.396 21.447 9.374 423 HA LYS 59 HA LYS 59 56.580 20.381 11.899 424 1HB LYS 59 HB2 LYS 59 54.386 19.268 12.191 425 2HB LYS 59 HB1 LYS 59 54.191 21.004 12.050 426 1HG LYS 59 HG2 LYS 59 53.559 20.718 9.644 427 2HG LYS 59 HG1 LYS 59 53.672 18.978 9.832 428 1HD LYS 59 HD2 LYS 59 51.805 20.814 11.385 429 2HD LYS 59 HD1 LYS 59 51.337 19.757 10.079 430 1HE LYS 59 HE2 LYS 59 52.426 18.803 12.760 431 2HE LYS 59 HE1 LYS 59 50.765 18.710 12.211 432 1HZ LYS 59 HZ1 LYS 59 51.448 17.293 10.402 433 2HZ LYS 59 HZ2 LYS 59 51.905 16.630 11.897 434 3HZ LYS 59 HZ3 LYS 59 53.067 17.381 10.912 435 H CYS 60 HN CYS 60 55.436 19.516 8.679 436 HA CYS 60 HA CYS 60 56.334 16.752 8.915 437 1HB CYS 60 HB2 CYS 60 55.050 18.385 6.758 438 2HB CYS 60 HB1 CYS 60 55.765 16.849 6.369 Start of MODEL 9 1 1H ASN 1 HT1 ASN 1 32.921 16.568 -9.680 2 2H ASN 1 HT2 ASN 1 33.225 16.562 -11.352 3 3H ASN 1 HT3 ASN 1 31.828 17.315 -10.745 4 HA ASN 1 HA ASN 1 33.625 18.867 -11.400 5 1HB ASN 1 HB2 ASN 1 31.859 19.522 -9.745 6 2HB ASN 1 HB1 ASN 1 32.820 18.838 -8.443 7 1HD2 ASN 1 HD21 ASN 1 32.964 21.347 -11.013 8 2HD2 ASN 1 HD22 ASN 1 33.993 22.387 -10.153 9 H PHE 2 HN PHE 2 35.541 19.907 -10.580 10 HA PHE 2 HA PHE 2 37.623 17.971 -9.894 11 1HB PHE 2 HB2 PHE 2 39.148 19.946 -10.353 12 2HB PHE 2 HB1 PHE 2 38.032 19.648 -11.671 13 HD1 PHE 2 HD1 PHE 2 38.757 21.909 -8.810 14 HD2 PHE 2 HD2 PHE 2 36.234 21.205 -12.173 15 HE1 PHE 2 HE1 PHE 2 37.869 24.179 -8.620 16 HE2 PHE 2 HE2 PHE 2 35.348 23.481 -11.975 17 HZ PHE 2 HZ PHE 2 36.161 24.973 -10.201 18 H VAL 3 HN VAL 3 35.613 18.786 -7.939 19 HA VAL 3 HA VAL 3 36.607 20.445 -5.872 20 HB VAL 3 HB VAL 3 34.268 19.614 -6.002 21 1HG1 VAL 3 HG11 VAL 3 35.394 16.878 -5.256 22 2HG1 VAL 3 HG12 VAL 3 34.693 17.308 -6.807 23 3HG1 VAL 3 HG13 VAL 3 33.694 17.287 -5.368 24 1HG2 VAL 3 HG21 VAL 3 35.079 20.360 -3.797 25 2HG2 VAL 3 HG22 VAL 3 35.641 18.737 -3.432 26 3HG2 VAL 3 HG23 VAL 3 33.925 19.051 -3.613 27 H CYS 4 HN CYS 4 37.895 20.260 -4.308 28 HA CYS 4 HA CYS 4 39.853 18.103 -4.251 29 1HB CYS 4 HB2 CYS 4 39.515 20.608 -2.695 30 2HB CYS 4 HB1 CYS 4 40.910 19.586 -2.521 31 HA PRO 5 HA PRO 5 38.595 16.967 0.049 32 1HB PRO 5 HB2 PRO 5 41.195 15.949 0.654 33 2HB PRO 5 HB1 PRO 5 39.786 15.029 0.227 34 1HG PRO 5 HG2 PRO 5 42.017 15.163 -1.376 35 2HG PRO 5 HG1 PRO 5 40.389 14.835 -1.997 36 1HD PRO 5 HD2 PRO 5 41.832 17.464 -1.828 37 2HD PRO 5 HD1 PRO 5 41.011 16.786 -3.239 38 HA PRO 6 HA PRO 6 40.234 19.967 2.941 39 1HB PRO 6 HB2 PRO 6 41.620 18.287 4.740 40 2HB PRO 6 HB1 PRO 6 39.931 18.718 4.843 41 1HG PRO 6 HG2 PRO 6 41.148 16.291 3.551 42 2HG PRO 6 HG1 PRO 6 39.728 16.390 4.609 43 1HD PRO 6 HD2 PRO 6 39.370 16.129 2.086 44 2HD PRO 6 HD1 PRO 6 38.423 17.377 2.897 45 H GLY 7 HN GLY 7 42.120 21.097 3.396 46 1HA GLY 7 HA2 GLY 7 44.338 21.767 3.159 47 2HA GLY 7 HA1 GLY 7 44.742 20.071 3.092 48 H GLN 8 HN GLN 8 42.704 20.526 0.462 49 HA GLN 8 HA GLN 8 45.050 21.222 -1.281 50 1HB GLN 8 HB2 GLN 8 42.921 19.143 -1.824 51 2HB GLN 8 HB1 GLN 8 44.304 19.520 -2.845 52 1HG GLN 8 HG2 GLN 8 45.876 18.803 -1.163 53 2HG GLN 8 HG1 GLN 8 44.588 18.492 -0.006 54 1HE2 GLN 8 HE21 GLN 8 44.066 16.374 0.127 55 2HE2 GLN 8 HE22 GLN 8 44.166 15.225 -1.115 56 H THR 9 HN THR 9 44.749 22.248 -3.126 57 HA THR 9 HA THR 9 42.130 23.559 -3.713 58 HB THR 9 HB THR 9 43.511 25.593 -4.433 59 HG1 THR 9 HG1 THR 9 45.350 24.241 -4.870 60 1HG2 THR 9 HG21 THR 9 44.276 24.599 -1.667 61 2HG2 THR 9 HG22 THR 9 42.766 25.424 -2.000 62 3HG2 THR 9 HG23 THR 9 44.294 26.273 -2.203 63 H PHE 10 HN PHE 10 41.764 24.130 -5.933 64 HA PHE 10 HA PHE 10 42.588 22.104 -7.809 65 1HB PHE 10 HB2 PHE 10 40.397 23.250 -8.013 66 2HB PHE 10 HB1 PHE 10 41.214 24.774 -8.340 67 HD1 PHE 10 HD1 PHE 10 40.838 21.277 -9.596 68 HD2 PHE 10 HD2 PHE 10 41.977 25.269 -10.560 69 HE1 PHE 10 HE1 PHE 10 41.019 20.658 -11.957 70 HE2 PHE 10 HE2 PHE 10 42.162 24.643 -12.924 71 HZ PHE 10 HZ PHE 10 41.681 22.337 -13.627 72 H GLN 11 HN GLN 11 44.049 22.246 -9.523 73 HA GLN 11 HA GLN 11 45.602 24.702 -9.970 74 1HB GLN 11 HB2 GLN 11 46.919 22.071 -9.085 75 2HB GLN 11 HB1 GLN 11 47.785 23.503 -9.610 76 1HG GLN 11 HG2 GLN 11 46.823 24.788 -7.696 77 2HG GLN 11 HG1 GLN 11 45.958 23.354 -7.172 78 1HE2 GLN 11 HE21 GLN 11 47.129 23.895 -5.163 79 2HE2 GLN 11 HE22 GLN 11 48.669 23.234 -4.928 80 H THR 12 HN THR 12 46.633 24.652 -11.981 81 HA THR 12 HA THR 12 45.404 22.813 -13.896 82 HB THR 12 HB THR 12 45.782 25.241 -14.514 83 HG1 THR 12 HG1 THR 12 45.792 23.663 -16.112 84 1HG2 THR 12 HG21 THR 12 48.079 26.029 -14.988 85 2HG2 THR 12 HG22 THR 12 48.762 24.484 -14.513 86 3HG2 THR 12 HG23 THR 12 48.035 25.532 -13.304 87 H CYS 13 HN CYS 13 48.438 23.301 -12.283 88 HA CYS 13 HA CYS 13 49.542 20.880 -13.587 89 1HB CYS 13 HB2 CYS 13 50.953 23.295 -12.461 90 2HB CYS 13 HB1 CYS 13 51.804 21.801 -12.762 91 H ALA 14 HN ALA 14 49.051 19.318 -12.410 92 HA ALA 14 HA ALA 14 50.150 18.990 -9.694 93 1HB ALA 14 HB1 ALA 14 47.930 18.109 -8.883 94 2HB ALA 14 HB2 ALA 14 47.221 18.466 -10.448 95 3HB ALA 14 HB3 ALA 14 47.753 19.772 -9.404 96 H SER 15 HN SER 15 49.138 16.347 -9.319 97 HA SER 15 HA SER 15 49.299 14.872 -11.778 98 1HB SER 15 HB2 SER 15 51.733 15.678 -11.575 99 2HB SER 15 HB1 SER 15 51.790 14.699 -10.108 100 HG SER 15 HG SER 15 50.832 13.594 -12.492 101 H SER 16 HN SER 16 49.854 12.560 -11.443 102 HA SER 16 HA SER 16 48.260 11.498 -9.260 103 1HB SER 16 HB2 SER 16 48.140 10.521 -11.569 104 2HB SER 16 HB1 SER 16 49.845 10.056 -11.455 105 HG SER 16 HG SER 16 49.375 8.702 -9.808 106 H CYS 17 HN CYS 17 51.262 12.661 -9.429 107 HA CYS 17 HA CYS 17 52.630 10.717 -7.647 108 1HB CYS 17 HB2 CYS 17 54.689 12.000 -8.402 109 2HB CYS 17 HB1 CYS 17 53.890 11.009 -9.579 110 HA PRO 18 HA PRO 18 50.944 14.297 -5.249 111 1HB PRO 18 HB2 PRO 18 50.689 13.004 -2.826 112 2HB PRO 18 HB1 PRO 18 49.484 12.971 -4.089 113 1HG PRO 18 HG2 PRO 18 51.627 10.965 -3.515 114 2HG PRO 18 HG1 PRO 18 49.906 10.700 -3.865 115 1HD PRO 18 HD2 PRO 18 51.707 10.341 -5.752 116 2HD PRO 18 HD1 PRO 18 50.163 11.138 -6.127 117 H LYS 19 HN LYS 19 51.639 15.662 -3.673 118 HA LYS 19 HA LYS 19 54.491 15.527 -2.933 119 1HB LYS 19 HB2 LYS 19 53.552 17.545 -4.115 120 2HB LYS 19 HB1 LYS 19 52.363 17.767 -2.845 121 1HG LYS 19 HG2 LYS 19 53.922 19.179 -1.955 122 2HG LYS 19 HG1 LYS 19 54.640 17.683 -1.386 123 1HD LYS 19 HD2 LYS 19 55.528 19.322 -3.713 124 2HD LYS 19 HD1 LYS 19 56.401 18.937 -2.243 125 1HE LYS 19 HE2 LYS 19 56.227 16.459 -3.110 126 2HE LYS 19 HE1 LYS 19 55.854 17.224 -4.617 127 1HZ LYS 19 HZ1 LYS 19 58.250 17.772 -2.986 128 2HZ LYS 19 HZ2 LYS 19 57.841 18.547 -4.433 129 3HZ LYS 19 HZ3 LYS 19 58.196 16.883 -4.432 130 H THR 20 HN THR 20 54.792 14.611 -1.043 131 HA THR 20 HA THR 20 52.807 15.079 1.146 132 HB THR 20 HB THR 20 53.205 12.734 1.873 133 HG1 THR 20 HG1 THR 20 55.296 12.521 1.188 134 1HG2 THR 20 HG21 THR 20 52.821 12.799 -1.200 135 2HG2 THR 20 HG22 THR 20 51.500 13.055 -0.078 136 3HG2 THR 20 HG23 THR 20 52.313 11.509 -0.141 137 H CYS 21 HN CYS 21 53.912 14.221 3.285 138 HA CYS 21 HA CYS 21 55.994 16.063 3.916 139 1HB CYS 21 HB2 CYS 21 55.196 13.484 5.271 140 2HB CYS 21 HB1 CYS 21 56.271 14.657 5.967 141 H GLU 22 HN GLU 22 55.995 13.023 2.467 142 HA GLU 22 HA GLU 22 58.684 12.134 2.973 143 1HB GLU 22 HB2 GLU 22 56.909 11.588 0.537 144 2HB GLU 22 HB1 GLU 22 58.282 10.631 1.049 145 1HG GLU 22 HG2 GLU 22 57.170 10.012 3.148 146 2HG GLU 22 HG1 GLU 22 55.809 11.059 2.793 147 H THR 23 HN THR 23 57.174 13.903 0.279 148 HA THR 23 HA THR 23 59.700 14.524 -1.062 149 HB THR 23 HB THR 23 58.201 15.883 -2.516 150 HG1 THR 23 HG1 THR 23 56.291 14.677 -0.780 151 1HG2 THR 23 HG21 THR 23 58.529 13.475 -3.089 152 2HG2 THR 23 HG22 THR 23 56.928 14.076 -3.498 153 3HG2 THR 23 HG23 THR 23 57.146 13.071 -2.069 154 H ARG 24 HN ARG 24 57.220 16.947 -0.271 155 HA ARG 24 HA ARG 24 57.341 19.085 0.580 156 1HB ARG 24 HB2 ARG 24 59.953 18.105 1.786 157 2HB ARG 24 HB1 ARG 24 59.172 19.617 2.154 158 1HG ARG 24 HG2 ARG 24 57.173 18.457 2.971 159 2HG ARG 24 HG1 ARG 24 57.825 16.906 2.469 160 1HD ARG 24 HD2 ARG 24 59.041 18.671 4.662 161 2HD ARG 24 HD1 ARG 24 58.078 17.233 4.920 162 HE ARG 24 HE ARG 24 59.825 15.893 4.014 163 1HH1 ARG 24 HH11 ARG 24 60.652 19.270 4.156 164 2HH1 ARG 24 HH12 ARG 24 62.345 18.964 3.983 165 1HH2 ARG 24 HH21 ARG 24 61.961 15.509 3.786 166 2HH2 ARG 24 HH22 ARG 24 63.098 16.817 3.766 167 H ASN 25 HN ASN 25 59.632 17.873 -1.395 168 HA ASN 25 HA ASN 25 61.412 19.978 -1.848 169 1HB ASN 25 HB2 ASN 25 60.470 17.745 -3.700 170 2HB ASN 25 HB1 ASN 25 61.933 18.688 -3.927 171 1HD2 ASN 25 HD21 ASN 25 62.426 18.684 -0.895 172 2HD2 ASN 25 HD22 ASN 25 63.019 17.124 -0.583 173 H LYS 26 HN LYS 26 58.144 19.639 -3.078 174 HA LYS 26 HA LYS 26 58.517 22.121 -4.650 175 1HB LYS 26 HB2 LYS 26 56.862 19.657 -5.411 176 2HB LYS 26 HB1 LYS 26 56.730 21.178 -6.241 177 1HG LYS 26 HG2 LYS 26 58.264 20.104 -7.634 178 2HG LYS 26 HG1 LYS 26 59.362 20.918 -6.560 179 1HD LYS 26 HD2 LYS 26 60.225 18.684 -6.757 180 2HD LYS 26 HD1 LYS 26 59.473 18.738 -5.190 181 1HE LYS 26 HE2 LYS 26 58.780 16.676 -6.364 182 2HE LYS 26 HE1 LYS 26 57.372 17.716 -6.202 183 1HZ LYS 26 HZ1 LYS 26 57.974 16.635 -8.454 184 2HZ LYS 26 HZ2 LYS 26 58.982 17.994 -8.604 185 3HZ LYS 26 HZ3 LYS 26 57.312 18.196 -8.369 186 H LEU 27 HN LEU 27 56.553 23.217 -4.978 187 HA LEU 27 HA LEU 27 54.726 23.155 -2.602 188 1HB LEU 27 HB2 LEU 27 55.474 25.524 -4.383 189 2HB LEU 27 HB1 LEU 27 54.301 25.593 -3.092 190 HG LEU 27 HG LEU 27 56.095 25.044 -1.438 191 1HD1 LEU 27 HD11 LEU 27 58.472 25.303 -2.069 192 2HD1 LEU 27 HD12 LEU 27 58.026 25.430 -3.761 193 3HD1 LEU 27 HD13 LEU 27 57.789 23.928 -2.889 194 1HD2 LEU 27 HD21 LEU 27 56.572 27.506 -3.161 195 2HD2 LEU 27 HD22 LEU 27 57.139 27.304 -1.510 196 3HD2 LEU 27 HD23 LEU 27 55.418 27.372 -1.845 197 H VAL 28 HN VAL 28 54.321 21.590 -4.634 198 HA VAL 28 HA VAL 28 51.530 22.114 -5.476 199 HB VAL 28 HB VAL 28 52.002 21.437 -7.844 200 1HG1 VAL 28 HG11 VAL 28 53.532 23.965 -7.015 201 2HG1 VAL 28 HG12 VAL 28 51.806 23.880 -7.334 202 3HG1 VAL 28 HG13 VAL 28 52.956 23.612 -8.632 203 1HG2 VAL 28 HG21 VAL 28 54.928 21.895 -7.065 204 2HG2 VAL 28 HG22 VAL 28 54.366 21.561 -8.692 205 3HG2 VAL 28 HG23 VAL 28 54.228 20.334 -7.444 206 H LEU 29 HN LEU 29 50.614 20.184 -6.412 207 HA LEU 29 HA LEU 29 51.081 17.996 -4.742 208 1HB LEU 29 HB2 LEU 29 48.988 18.492 -5.943 209 2HB LEU 29 HB1 LEU 29 49.768 18.162 -7.461 210 HG LEU 29 HG LEU 29 50.044 15.716 -6.656 211 1HD1 LEU 29 HD11 LEU 29 50.063 16.248 -4.181 212 2HD1 LEU 29 HD12 LEU 29 48.846 15.048 -4.560 213 3HD1 LEU 29 HD13 LEU 29 48.379 16.714 -4.282 214 1HD2 LEU 29 HD21 LEU 29 47.177 16.713 -6.445 215 2HD2 LEU 29 HD22 LEU 29 47.664 15.055 -6.739 216 3HD2 LEU 29 HD23 LEU 29 47.978 16.281 -7.945 217 H CYS 30 HN CYS 30 52.473 18.839 -7.664 218 HA CYS 30 HA CYS 30 54.784 17.183 -7.498 219 1HB CYS 30 HB2 CYS 30 52.924 15.454 -8.158 220 2HB CYS 30 HB1 CYS 30 52.893 16.307 -9.661 221 H ASP 31 HN ASP 31 56.095 17.442 -9.453 222 HA ASP 31 HA ASP 31 55.284 19.850 -11.062 223 1HB ASP 31 HB2 ASP 31 57.033 20.376 -9.408 224 2HB ASP 31 HB1 ASP 31 58.061 19.115 -10.068 225 H LYS 32 HN LYS 32 56.584 16.679 -11.227 226 HA LYS 32 HA LYS 32 57.626 16.946 -13.916 227 1HB LYS 32 HB2 LYS 32 56.951 14.473 -12.242 228 2HB LYS 32 HB1 LYS 32 57.853 14.399 -13.736 229 1HG LYS 32 HG2 LYS 32 58.803 16.061 -11.381 230 2HG LYS 32 HG1 LYS 32 59.163 14.367 -11.507 231 1HD LYS 32 HD2 LYS 32 61.054 15.788 -12.216 232 2HD LYS 32 HD1 LYS 32 60.531 14.699 -13.468 233 1HE LYS 32 HE2 LYS 32 59.740 17.627 -13.434 234 2HE LYS 32 HE1 LYS 32 61.183 17.030 -14.232 235 1HZ LYS 32 HZ1 LYS 32 60.020 16.164 -15.895 236 2HZ LYS 32 HZ2 LYS 32 58.796 17.227 -15.391 237 3HZ LYS 32 HZ3 LYS 32 58.768 15.600 -14.901 238 H LYS 33 HN LYS 33 54.676 17.390 -13.193 239 HA LYS 33 HA LYS 33 53.566 16.603 -15.731 240 1HB LYS 33 HB2 LYS 33 53.452 14.409 -14.621 241 2HB LYS 33 HB1 LYS 33 52.724 15.137 -13.225 242 1HG LYS 33 HG2 LYS 33 51.001 13.990 -14.532 243 2HG LYS 33 HG1 LYS 33 50.702 15.704 -14.565 244 1HD LYS 33 HD2 LYS 33 50.383 14.759 -16.821 245 2HD LYS 33 HD1 LYS 33 51.759 15.837 -16.854 246 1HE LYS 33 HE2 LYS 33 53.303 13.886 -16.671 247 2HE LYS 33 HE1 LYS 33 51.918 12.803 -16.622 248 1HZ LYS 33 HZ1 LYS 33 52.856 12.970 -18.823 249 2HZ LYS 33 HZ2 LYS 33 52.598 14.648 -18.836 250 3HZ LYS 33 HZ3 LYS 33 51.273 13.587 -18.798 251 H CYS 34 HN CYS 34 51.565 17.472 -16.116 252 HA CYS 34 HA CYS 34 50.546 19.345 -14.070 253 1HB CYS 34 HB2 CYS 34 51.045 19.779 -16.956 254 2HB CYS 34 HB1 CYS 34 49.948 20.829 -16.089 255 H ASN 35 HN ASN 35 49.119 17.853 -13.601 256 HA ASN 35 HA ASN 35 46.846 17.203 -15.404 257 1HB ASN 35 HB2 ASN 35 47.336 16.421 -12.482 258 2HB ASN 35 HB1 ASN 35 45.966 15.888 -13.437 259 1HD2 ASN 35 HD21 ASN 35 47.446 13.958 -12.323 260 2HD2 ASN 35 HD22 ASN 35 48.397 13.124 -13.442 261 H GLN 36 HN GLN 36 44.968 18.265 -15.298 262 HA GLN 36 HA GLN 36 44.726 20.638 -13.507 263 1HB GLN 36 HB2 GLN 36 42.994 19.673 -15.852 264 2HB GLN 36 HB1 GLN 36 42.840 21.227 -15.052 265 1HG GLN 36 HG2 GLN 36 45.191 21.792 -15.747 266 2HG GLN 36 HG1 GLN 36 45.293 20.259 -16.595 267 1HE2 GLN 36 HE21 GLN 36 44.486 23.511 -16.974 268 2HE2 GLN 36 HE22 GLN 36 43.609 23.385 -18.422 269 H ARG 37 HN ARG 37 44.664 19.207 -11.824 270 HA ARG 37 HA ARG 37 41.916 18.392 -11.011 271 1HB ARG 37 HB2 ARG 37 42.965 16.398 -9.841 272 2HB ARG 37 HB1 ARG 37 43.194 16.329 -11.560 273 1HG ARG 37 HG2 ARG 37 45.489 17.230 -11.351 274 2HG ARG 37 HG1 ARG 37 45.284 17.434 -9.626 275 1HD ARG 37 HD2 ARG 37 46.566 15.389 -10.145 276 2HD ARG 37 HD1 ARG 37 45.045 14.982 -9.348 277 HE ARG 37 HE ARG 37 44.533 14.919 -12.112 278 1HH1 ARG 37 HH11 ARG 37 46.568 13.316 -9.807 279 2HH1 ARG 37 HH12 ARG 37 46.600 11.832 -10.697 280 1HH2 ARG 37 HH21 ARG 37 44.562 13.050 -13.255 281 2HH2 ARG 37 HH22 ARG 37 45.449 11.677 -12.679 282 H CYS 38 HN CYS 38 43.011 17.623 -8.418 283 HA CYS 38 HA CYS 38 43.436 20.387 -7.371 284 1HB CYS 38 HB2 CYS 38 41.590 18.952 -6.446 285 2HB CYS 38 HB1 CYS 38 42.809 17.858 -5.828 286 H GLY 39 HN GLY 39 44.801 20.337 -5.249 287 1HA GLY 39 HA2 GLY 39 46.991 18.552 -4.939 288 2HA GLY 39 HA1 GLY 39 47.505 19.923 -5.940 289 H CYS 40 HN CYS 40 48.264 19.142 -3.147 290 HA CYS 40 HA CYS 40 47.177 20.639 -1.123 291 1HB CYS 40 HB2 CYS 40 50.106 20.148 -1.657 292 2HB CYS 40 HB1 CYS 40 49.486 20.776 -0.165 293 H ILE 41 HN ILE 41 47.850 22.460 -0.021 294 HA ILE 41 HA ILE 41 47.706 24.860 -1.566 295 HB ILE 41 HB ILE 41 48.932 24.867 1.218 296 1HG1 ILE 41 HG12 ILE 41 47.048 23.307 1.534 297 2HG1 ILE 41 HG11 ILE 41 46.655 24.845 2.252 298 1HG2 ILE 41 HG21 ILE 41 48.655 27.004 0.026 299 2HG2 ILE 41 HG22 ILE 41 47.589 26.950 1.416 300 3HG2 ILE 41 HG23 ILE 41 46.948 26.687 -0.196 301 1HD1 ILE 41 HD11 ILE 41 45.274 25.435 0.269 302 2HD1 ILE 41 HD12 ILE 41 44.731 23.945 1.020 303 3HD1 ILE 41 HD13 ILE 41 45.694 23.880 -0.446 304 H SER 42 HN SER 42 49.360 26.483 -1.731 305 HA SER 42 HA SER 42 51.955 25.353 -2.486 306 1HB SER 42 HB2 SER 42 50.920 27.247 -3.819 307 2HB SER 42 HB1 SER 42 51.037 28.301 -2.401 308 HG SER 42 HG SER 42 53.278 27.906 -2.388 309 H GLY 43 HN GLY 43 52.738 24.565 -0.647 310 1HA GLY 43 HA2 GLY 43 54.639 25.457 0.882 311 2HA GLY 43 HA1 GLY 43 53.344 26.380 1.646 312 H THR 44 HN THR 44 51.801 23.695 0.727 313 HA THR 44 HA THR 44 52.422 22.197 3.233 314 HB THR 44 HB THR 44 50.006 21.509 3.270 315 HG1 THR 44 HG1 THR 44 50.226 22.579 0.772 316 1HG2 THR 44 HG21 THR 44 48.981 23.698 3.731 317 2HG2 THR 44 HG22 THR 44 50.283 24.529 2.889 318 3HG2 THR 44 HG23 THR 44 50.611 23.667 4.385 319 H VAL 45 HN VAL 45 51.854 20.026 3.186 320 HA VAL 45 HA VAL 45 52.052 18.635 0.570 321 HB VAL 45 HB VAL 45 53.690 17.023 1.600 322 1HG1 VAL 45 HG11 VAL 45 54.643 19.891 1.490 323 2HG1 VAL 45 HG12 VAL 45 54.454 18.816 0.127 324 3HG1 VAL 45 HG13 VAL 45 55.628 18.432 1.367 325 1HG2 VAL 45 HG21 VAL 45 53.996 19.204 3.714 326 2HG2 VAL 45 HG22 VAL 45 55.007 17.794 3.578 327 3HG2 VAL 45 HG23 VAL 45 53.331 17.609 4.044 328 H LEU 46 HN LEU 46 50.821 16.998 0.351 329 HA LEU 46 HA LEU 46 48.723 16.273 2.061 330 1HB LEU 46 HB2 LEU 46 48.896 15.787 -0.415 331 2HB LEU 46 HB1 LEU 46 50.108 14.581 -0.082 332 HG LEU 46 HG LEU 46 48.394 13.319 1.295 333 1HD1 LEU 46 HD11 LEU 46 46.900 15.253 1.823 334 2HD1 LEU 46 HD12 LEU 46 46.002 13.988 1.016 335 3HD1 LEU 46 HD13 LEU 46 46.505 15.404 0.121 336 1HD2 LEU 46 HD21 LEU 46 48.830 12.705 -1.067 337 2HD2 LEU 46 HD22 LEU 46 47.634 13.872 -1.606 338 3HD2 LEU 46 HD23 LEU 46 47.137 12.471 -0.674 339 H LYS 47 HN LYS 47 49.287 15.831 4.073 340 HA LYS 47 HA LYS 47 51.045 14.981 5.657 341 1HB LYS 47 HB2 LYS 47 48.702 14.903 6.261 342 2HB LYS 47 HB1 LYS 47 48.465 13.426 5.360 343 1HG LYS 47 HG2 LYS 47 50.000 12.223 6.893 344 2HG LYS 47 HG1 LYS 47 50.280 13.711 7.785 345 1HD LYS 47 HD2 LYS 47 47.839 13.806 8.337 346 2HD LYS 47 HD1 LYS 47 47.583 12.319 7.438 347 1HE LYS 47 HE2 LYS 47 49.125 11.117 8.982 348 2HE LYS 47 HE1 LYS 47 49.382 12.607 9.883 349 1HZ LYS 47 HZ1 LYS 47 47.030 12.673 10.383 350 2HZ LYS 47 HZ2 LYS 47 47.730 11.224 10.927 351 3HZ LYS 47 HZ3 LYS 47 46.783 11.234 9.517 352 H SER 48 HN SER 48 49.711 12.308 3.735 353 HA SER 48 HA SER 48 52.375 10.946 3.834 354 1HB SER 48 HB2 SER 48 49.653 9.615 4.361 355 2HB SER 48 HB1 SER 48 51.221 8.788 4.343 356 HG SER 48 HG SER 48 51.791 10.597 5.898 357 H LYS 49 HN LYS 49 52.299 8.991 2.467 358 HA LYS 49 HA LYS 49 52.598 9.460 -0.159 359 1HB LYS 49 HB2 LYS 49 52.271 7.122 -0.630 360 2HB LYS 49 HB1 LYS 49 52.976 7.256 0.965 361 1HG LYS 49 HG2 LYS 49 50.034 6.714 0.362 362 2HG LYS 49 HG1 LYS 49 51.203 5.538 0.897 363 1HD LYS 49 HD2 LYS 49 51.457 6.707 3.067 364 2HD LYS 49 HD1 LYS 49 50.296 7.923 2.559 365 1HE LYS 49 HE2 LYS 49 49.641 4.980 2.796 366 2HE LYS 49 HE1 LYS 49 49.191 6.230 3.948 367 1HZ LYS 49 HZ1 LYS 49 48.248 7.332 1.770 368 2HZ LYS 49 HZ2 LYS 49 47.347 6.215 2.677 369 3HZ LYS 49 HZ3 LYS 49 48.160 5.712 1.274 370 H ASP 50 HN ASP 50 49.558 9.051 1.359 371 HA ASP 50 HA ASP 50 48.115 10.287 -0.828 372 1HB ASP 50 HB2 ASP 50 48.425 7.971 -1.781 373 2HB ASP 50 HB1 ASP 50 47.652 7.289 -0.364 374 H SER 51 HN SER 51 48.103 11.286 1.506 375 HA SER 51 HA SER 51 45.994 10.240 3.282 376 1HB SER 51 HB2 SER 51 48.087 11.393 4.126 377 2HB SER 51 HB1 SER 51 47.540 12.889 3.355 378 HG SER 51 HG SER 51 46.080 13.116 4.842 379 H SER 52 HN SER 52 44.935 12.930 3.841 380 HA SER 52 HA SER 52 43.396 13.519 1.351 381 1HB SER 52 HB2 SER 52 41.341 13.752 2.794 382 2HB SER 52 HB1 SER 52 42.004 12.114 2.889 383 HG SER 52 HG SER 52 43.292 13.008 4.700 384 H GLU 53 HN GLU 53 44.750 14.620 4.347 385 HA GLU 53 HA GLU 53 44.226 17.501 3.624 386 1HB GLU 53 HB2 GLU 53 43.256 16.711 5.801 387 2HB GLU 53 HB1 GLU 53 44.865 16.259 6.331 388 1HG GLU 53 HG2 GLU 53 45.616 18.635 6.112 389 2HG GLU 53 HG1 GLU 53 44.014 19.091 5.554 390 H CYS 54 HN CYS 54 45.864 18.911 3.752 391 HA CYS 54 HA CYS 54 48.616 17.783 3.572 392 1HB CYS 54 HB2 CYS 54 47.550 20.412 2.528 393 2HB CYS 54 HB1 CYS 54 49.118 19.724 2.208 394 H VAL 55 HN VAL 55 50.223 18.690 4.668 395 HA VAL 55 HA VAL 55 49.739 20.863 6.633 396 HB VAL 55 HB VAL 55 51.146 19.482 8.281 397 1HG1 VAL 55 HG11 VAL 55 49.232 17.976 8.933 398 2HG1 VAL 55 HG12 VAL 55 48.516 18.176 7.342 399 3HG1 VAL 55 HG13 VAL 55 48.610 19.542 8.441 400 1HG2 VAL 55 HG21 VAL 55 50.596 17.231 6.304 401 2HG2 VAL 55 HG22 VAL 55 51.308 17.043 7.897 402 3HG2 VAL 55 HG23 VAL 55 52.168 17.928 6.653 403 H HIS 56 HN HIS 56 51.542 22.142 7.011 404 HA HIS 56 HA HIS 56 53.444 22.370 4.923 405 1HB HIS 56 HB2 HIS 56 53.553 23.376 7.775 406 2HB HIS 56 HB1 HIS 56 54.646 23.933 6.518 407 HD1 HIS 56 HD1 HIS 56 53.692 25.644 4.932 408 HD2 HIS 56 HD2 HIS 56 50.744 24.113 7.305 409 HE1 HIS 56 HE1 HIS 56 51.685 27.018 4.522 410 HA PRO 57 HA PRO 57 56.735 19.509 5.853 411 1HB PRO 57 HB2 PRO 57 58.930 21.197 5.491 412 2HB PRO 57 HB1 PRO 57 58.071 20.404 4.196 413 1HG PRO 57 HG2 PRO 57 57.729 23.186 5.215 414 2HG PRO 57 HG1 PRO 57 57.803 22.601 3.544 415 1HD PRO 57 HD2 PRO 57 55.495 23.209 4.660 416 2HD PRO 57 HD1 PRO 57 55.622 21.793 3.599 417 H SER 58 HN SER 58 56.582 22.625 7.357 418 HA SER 58 HA SER 58 58.392 22.067 9.556 419 1HB SER 58 HB2 SER 58 57.520 24.277 10.424 420 2HB SER 58 HB1 SER 58 57.985 24.390 8.720 421 HG SER 58 HG SER 58 55.735 23.751 8.290 422 H LYS 59 HN LYS 59 55.115 21.374 8.938 423 HA LYS 59 HA LYS 59 54.413 21.011 11.801 424 1HB LYS 59 HB2 LYS 59 52.773 20.751 9.264 425 2HB LYS 59 HB1 LYS 59 52.141 20.484 10.880 426 1HG LYS 59 HG2 LYS 59 52.704 22.804 11.505 427 2HG LYS 59 HG1 LYS 59 53.391 23.086 9.913 428 1HD LYS 59 HD2 LYS 59 51.204 22.576 8.874 429 2HD LYS 59 HD1 LYS 59 50.521 22.228 10.448 430 1HE LYS 59 HE2 LYS 59 49.948 24.558 9.718 431 2HE LYS 59 HE1 LYS 59 50.929 24.580 11.174 432 1HZ LYS 59 HZ1 LYS 59 51.443 25.925 8.881 433 2HZ LYS 59 HZ2 LYS 59 52.500 24.601 8.786 434 3HZ LYS 59 HZ3 LYS 59 52.553 25.630 10.133 435 H CYS 60 HN CYS 60 54.887 19.272 8.836 436 HA CYS 60 HA CYS 60 53.963 16.759 9.427 437 1HB CYS 60 HB2 CYS 60 56.404 17.667 7.967 438 2HB CYS 60 HB1 CYS 60 56.016 15.978 8.010 Start of MODEL 10 1 1H ASN 1 HT1 ASN 1 35.683 15.565 -12.450 2 2H ASN 1 HT2 ASN 1 34.857 16.972 -12.921 3 3H ASN 1 HT3 ASN 1 33.988 15.627 -12.350 4 HA ASN 1 HA ASN 1 34.205 17.450 -10.716 5 1HB ASN 1 HB2 ASN 1 34.858 15.925 -8.837 6 2HB ASN 1 HB1 ASN 1 33.812 15.096 -9.976 7 1HD2 ASN 1 HD21 ASN 1 35.108 13.865 -11.787 8 2HD2 ASN 1 HD22 ASN 1 36.495 13.033 -11.266 9 H PHE 2 HN PHE 2 35.517 18.867 -9.708 10 HA PHE 2 HA PHE 2 38.482 18.551 -9.891 11 1HB PHE 2 HB2 PHE 2 36.925 21.081 -10.660 12 2HB PHE 2 HB1 PHE 2 38.675 20.885 -10.739 13 HD1 PHE 2 HD1 PHE 2 35.543 20.256 -12.403 14 HD2 PHE 2 HD2 PHE 2 39.620 19.036 -12.248 15 HE1 PHE 2 HE1 PHE 2 35.291 19.170 -14.571 16 HE2 PHE 2 HE2 PHE 2 39.376 17.947 -14.421 17 HZ PHE 2 HZ PHE 2 37.212 18.007 -15.604 18 H VAL 3 HN VAL 3 36.388 18.297 -7.929 19 HA VAL 3 HA VAL 3 36.858 20.426 -5.938 20 HB VAL 3 HB VAL 3 34.569 19.536 -6.324 21 1HG1 VAL 3 HG11 VAL 3 33.992 17.189 -5.746 22 2HG1 VAL 3 HG12 VAL 3 35.681 16.831 -5.438 23 3HG1 VAL 3 HG13 VAL 3 35.148 17.239 -7.058 24 1HG2 VAL 3 HG21 VAL 3 35.116 20.321 -4.063 25 2HG2 VAL 3 HG22 VAL 3 35.671 18.714 -3.615 26 3HG2 VAL 3 HG23 VAL 3 33.977 18.984 -3.990 27 H CYS 4 HN CYS 4 37.915 20.221 -4.156 28 HA CYS 4 HA CYS 4 39.826 17.984 -3.906 29 1HB CYS 4 HB2 CYS 4 39.644 20.653 -2.655 30 2HB CYS 4 HB1 CYS 4 40.940 19.557 -2.296 31 HA PRO 5 HA PRO 5 38.433 17.443 0.482 32 1HB PRO 5 HB2 PRO 5 41.111 16.636 1.217 33 2HB PRO 5 HB1 PRO 5 39.702 15.632 1.100 34 1HG PRO 5 HG2 PRO 5 41.774 15.339 -0.628 35 2HG PRO 5 HG1 PRO 5 40.098 15.032 -1.107 36 1HD PRO 5 HD2 PRO 5 41.695 17.551 -1.480 37 2HD PRO 5 HD1 PRO 5 40.788 16.658 -2.710 38 HA PRO 6 HA PRO 6 39.418 20.925 2.905 39 1HB PRO 6 HB2 PRO 6 41.061 19.880 4.968 40 2HB PRO 6 HB1 PRO 6 39.320 19.982 4.948 41 1HG PRO 6 HG2 PRO 6 41.028 17.678 4.021 42 2HG PRO 6 HG1 PRO 6 39.600 17.634 5.072 43 1HD PRO 6 HD2 PRO 6 39.249 16.988 2.663 44 2HD PRO 6 HD1 PRO 6 38.177 18.263 3.267 45 H GLY 7 HN GLY 7 42.489 19.363 3.582 46 1HA GLY 7 HA2 GLY 7 44.077 21.676 3.401 47 2HA GLY 7 HA1 GLY 7 44.665 20.038 3.376 48 H GLN 8 HN GLN 8 42.779 20.312 0.656 49 HA GLN 8 HA GLN 8 45.161 21.087 -0.979 50 1HB GLN 8 HB2 GLN 8 42.961 19.124 -1.702 51 2HB GLN 8 HB1 GLN 8 44.290 19.597 -2.733 52 1HG GLN 8 HG2 GLN 8 44.830 17.453 -1.846 53 2HG GLN 8 HG1 GLN 8 45.898 18.640 -1.137 54 1HE2 GLN 8 HE21 GLN 8 43.251 16.387 -0.419 55 2HE2 GLN 8 HE22 GLN 8 43.376 16.525 1.263 56 H THR 9 HN THR 9 44.581 21.656 -3.176 57 HA THR 9 HA THR 9 42.081 23.150 -3.600 58 HB THR 9 HB THR 9 43.416 24.832 -2.530 59 HG1 THR 9 HG1 THR 9 43.789 26.212 -4.387 60 1HG2 THR 9 HG21 THR 9 45.693 23.727 -2.889 61 2HG2 THR 9 HG22 THR 9 45.711 25.418 -3.361 62 3HG2 THR 9 HG23 THR 9 45.604 24.159 -4.587 63 H PHE 10 HN PHE 10 41.951 24.007 -5.736 64 HA PHE 10 HA PHE 10 42.655 22.016 -7.726 65 1HB PHE 10 HB2 PHE 10 40.531 23.317 -7.852 66 2HB PHE 10 HB1 PHE 10 41.453 24.786 -8.148 67 HD1 PHE 10 HD1 PHE 10 40.727 21.392 -9.492 68 HD2 PHE 10 HD2 PHE 10 42.319 25.252 -10.358 69 HE1 PHE 10 HE1 PHE 10 40.843 20.816 -11.870 70 HE2 PHE 10 HE2 PHE 10 42.433 24.665 -12.739 71 HZ PHE 10 HZ PHE 10 41.693 22.447 -13.496 72 H GLN 11 HN GLN 11 44.010 22.211 -9.516 73 HA GLN 11 HA GLN 11 45.740 24.528 -9.926 74 1HB GLN 11 HB2 GLN 11 46.943 21.832 -9.129 75 2HB GLN 11 HB1 GLN 11 47.859 23.210 -9.702 76 1HG GLN 11 HG2 GLN 11 47.128 24.493 -7.667 77 2HG GLN 11 HG1 GLN 11 46.309 23.045 -7.089 78 1HE2 GLN 11 HE21 GLN 11 47.909 23.506 -5.259 79 2HE2 GLN 11 HE22 GLN 11 49.437 22.780 -5.366 80 H THR 12 HN THR 12 46.941 24.406 -11.703 81 HA THR 12 HA THR 12 45.711 22.860 -13.853 82 HB THR 12 HB THR 12 48.078 24.858 -13.849 83 HG1 THR 12 HG1 THR 12 46.015 25.603 -13.117 84 1HG2 THR 12 HG21 THR 12 47.846 23.390 -15.930 85 2HG2 THR 12 HG22 THR 12 47.533 25.098 -16.231 86 3HG2 THR 12 HG23 THR 12 46.189 23.969 -16.078 87 H CYS 13 HN CYS 13 48.767 23.189 -12.179 88 HA CYS 13 HA CYS 13 49.702 20.640 -13.336 89 1HB CYS 13 HB2 CYS 13 51.218 22.972 -12.207 90 2HB CYS 13 HB1 CYS 13 51.977 21.430 -12.529 91 H ALA 14 HN ALA 14 48.798 19.256 -12.118 92 HA ALA 14 HA ALA 14 50.031 18.480 -9.619 93 1HB ALA 14 HB1 ALA 14 48.200 20.092 -8.843 94 2HB ALA 14 HB2 ALA 14 47.820 18.459 -8.345 95 3HB ALA 14 HB3 ALA 14 47.018 19.153 -9.741 96 H SER 15 HN SER 15 49.753 16.201 -9.387 97 HA SER 15 HA SER 15 47.843 14.868 -11.156 98 1HB SER 15 HB2 SER 15 49.686 15.464 -12.690 99 2HB SER 15 HB1 SER 15 50.860 14.709 -11.660 100 HG SER 15 HG SER 15 50.126 12.759 -12.179 101 H SER 16 HN SER 16 48.696 12.409 -11.345 102 HA SER 16 HA SER 16 48.063 11.198 -8.932 103 1HB SER 16 HB2 SER 16 47.751 10.120 -11.136 104 2HB SER 16 HB1 SER 16 49.504 10.010 -11.350 105 HG SER 16 HG SER 16 48.183 8.987 -9.072 106 H CYS 17 HN CYS 17 50.839 12.757 -9.597 107 HA CYS 17 HA CYS 17 52.716 11.097 -8.000 108 1HB CYS 17 HB2 CYS 17 54.332 12.869 -9.069 109 2HB CYS 17 HB1 CYS 17 53.671 11.584 -10.050 110 HA PRO 18 HA PRO 18 51.163 14.573 -5.315 111 1HB PRO 18 HB2 PRO 18 50.886 13.253 -2.977 112 2HB PRO 18 HB1 PRO 18 49.694 13.141 -4.251 113 1HG PRO 18 HG2 PRO 18 51.953 11.253 -3.672 114 2HG PRO 18 HG1 PRO 18 50.236 10.887 -3.938 115 1HD PRO 18 HD2 PRO 18 51.987 10.613 -5.922 116 2HD PRO 18 HD1 PRO 18 50.353 11.265 -6.198 117 H LYS 19 HN LYS 19 52.070 15.847 -3.817 118 HA LYS 19 HA LYS 19 54.931 15.373 -3.119 119 1HB LYS 19 HB2 LYS 19 54.232 17.521 -4.315 120 2HB LYS 19 HB1 LYS 19 53.174 17.860 -2.953 121 1HG LYS 19 HG2 LYS 19 55.261 17.717 -1.470 122 2HG LYS 19 HG1 LYS 19 56.199 17.545 -2.925 123 1HD LYS 19 HD2 LYS 19 56.369 19.798 -2.171 124 2HD LYS 19 HD1 LYS 19 55.533 19.781 -3.702 125 1HE LYS 19 HE2 LYS 19 54.198 20.120 -0.982 126 2HE LYS 19 HE1 LYS 19 54.516 21.397 -2.118 127 1HZ LYS 19 HZ1 LYS 19 53.099 19.548 -3.538 128 2HZ LYS 19 HZ2 LYS 19 52.531 21.018 -2.913 129 3HZ LYS 19 HZ3 LYS 19 52.355 19.588 -2.013 130 H THR 20 HN THR 20 55.018 14.394 -1.226 131 HA THR 20 HA THR 20 52.998 15.032 0.890 132 HB THR 20 HB THR 20 53.342 12.677 1.686 133 HG1 THR 20 HG1 THR 20 55.528 12.632 0.994 134 1HG2 THR 20 HG21 THR 20 52.513 11.450 -0.337 135 2HG2 THR 20 HG22 THR 20 53.084 12.718 -1.395 136 3HG2 THR 20 HG23 THR 20 51.727 13.007 -0.327 137 H CYS 21 HN CYS 21 53.986 14.151 3.106 138 HA CYS 21 HA CYS 21 56.002 16.015 3.858 139 1HB CYS 21 HB2 CYS 21 55.207 13.403 5.155 140 2HB CYS 21 HB1 CYS 21 56.251 14.572 5.899 141 H GLU 22 HN GLU 22 56.134 12.952 2.394 142 HA GLU 22 HA GLU 22 58.840 12.212 3.043 143 1HB GLU 22 HB2 GLU 22 57.173 10.604 2.065 144 2HB GLU 22 HB1 GLU 22 57.165 11.523 0.574 145 1HG GLU 22 HG2 GLU 22 58.628 9.533 0.371 146 2HG GLU 22 HG1 GLU 22 59.557 11.006 0.189 147 H THR 23 HN THR 23 57.379 13.971 0.324 148 HA THR 23 HA THR 23 59.964 14.616 -0.904 149 HB THR 23 HB THR 23 58.513 15.935 -2.521 150 HG1 THR 23 HG1 THR 23 56.818 16.561 -1.375 151 1HG2 THR 23 HG21 THR 23 58.778 13.415 -2.846 152 2HG2 THR 23 HG22 THR 23 57.223 14.023 -3.398 153 3HG2 THR 23 HG23 THR 23 57.341 13.184 -1.857 154 H ARG 24 HN ARG 24 57.432 16.996 -0.158 155 HA ARG 24 HA ARG 24 57.509 19.101 0.779 156 1HB ARG 24 HB2 ARG 24 60.077 18.103 2.079 157 2HB ARG 24 HB1 ARG 24 59.246 19.577 2.487 158 1HG ARG 24 HG2 ARG 24 57.257 18.352 3.174 159 2HG ARG 24 HG1 ARG 24 57.952 16.836 2.623 160 1HD ARG 24 HD2 ARG 24 59.048 18.538 4.931 161 2HD ARG 24 HD1 ARG 24 58.121 17.063 5.099 162 HE ARG 24 HE ARG 24 59.957 15.803 4.257 163 1HH1 ARG 24 HH11 ARG 24 60.645 19.208 4.413 164 2HH1 ARG 24 HH12 ARG 24 62.352 18.969 4.267 165 1HH2 ARG 24 HH21 ARG 24 62.103 15.500 4.066 166 2HH2 ARG 24 HH22 ARG 24 63.189 16.849 4.064 167 H ASN 25 HN ASN 25 59.973 17.994 -1.085 168 HA ASN 25 HA ASN 25 61.751 20.114 -1.330 169 1HB ASN 25 HB2 ASN 25 60.874 18.021 -3.368 170 2HB ASN 25 HB1 ASN 25 62.362 18.936 -3.466 171 1HD2 ASN 25 HD21 ASN 25 62.530 18.665 -0.336 172 2HD2 ASN 25 HD22 ASN 25 63.172 17.105 -0.147 173 H LYS 26 HN LYS 26 58.758 19.547 -3.160 174 HA LYS 26 HA LYS 26 59.095 22.078 -4.630 175 1HB LYS 26 HB2 LYS 26 57.218 19.703 -4.930 176 2HB LYS 26 HB1 LYS 26 57.053 21.146 -5.897 177 1HG LYS 26 HG2 LYS 26 58.211 19.395 -7.119 178 2HG LYS 26 HG1 LYS 26 59.279 20.760 -6.879 179 1HD LYS 26 HD2 LYS 26 60.461 19.525 -5.103 180 2HD LYS 26 HD1 LYS 26 59.314 18.196 -5.216 181 1HE LYS 26 HE2 LYS 26 61.413 17.718 -6.467 182 2HE LYS 26 HE1 LYS 26 60.068 17.842 -7.592 183 1HZ LYS 26 HZ1 LYS 26 62.096 19.052 -8.264 184 2HZ LYS 26 HZ2 LYS 26 61.876 20.093 -6.939 185 3HZ LYS 26 HZ3 LYS 26 60.709 20.028 -8.171 186 H LEU 27 HN LEU 27 56.764 22.873 -5.093 187 HA LEU 27 HA LEU 27 55.222 23.295 -2.582 188 1HB LEU 27 HB2 LEU 27 55.941 25.540 -4.559 189 2HB LEU 27 HB1 LEU 27 54.918 25.714 -3.157 190 HG LEU 27 HG LEU 27 56.941 25.177 -1.709 191 1HD1 LEU 27 HD11 LEU 27 59.189 25.548 -2.668 192 2HD1 LEU 27 HD12 LEU 27 58.500 25.665 -4.278 193 3HD1 LEU 27 HD13 LEU 27 58.477 24.149 -3.413 194 1HD2 LEU 27 HD21 LEU 27 56.103 27.472 -2.010 195 2HD2 LEU 27 HD22 LEU 27 57.056 27.654 -3.474 196 3HD2 LEU 27 HD23 LEU 27 57.855 27.483 -1.919 197 H VAL 28 HN VAL 28 54.865 21.682 -4.653 198 HA VAL 28 HA VAL 28 52.073 22.185 -5.463 199 HB VAL 28 HB VAL 28 52.516 21.598 -7.861 200 1HG1 VAL 28 HG11 VAL 28 53.324 23.866 -8.571 201 2HG1 VAL 28 HG12 VAL 28 53.912 24.183 -6.953 202 3HG1 VAL 28 HG13 VAL 28 52.188 24.010 -7.242 203 1HG2 VAL 28 HG21 VAL 28 55.433 22.194 -7.106 204 2HG2 VAL 28 HG22 VAL 28 54.862 21.923 -8.742 205 3HG2 VAL 28 HG23 VAL 28 54.814 20.622 -7.567 206 H LEU 29 HN LEU 29 51.003 20.397 -6.172 207 HA LEU 29 HA LEU 29 51.572 18.042 -4.862 208 1HB LEU 29 HB2 LEU 29 49.369 18.722 -5.831 209 2HB LEU 29 HB1 LEU 29 49.997 18.410 -7.426 210 HG LEU 29 HG LEU 29 50.356 15.958 -6.645 211 1HD1 LEU 29 HD11 LEU 29 48.699 16.929 -4.266 212 2HD1 LEU 29 HD12 LEU 29 50.378 16.438 -4.181 213 3HD1 LEU 29 HD13 LEU 29 49.139 15.262 -4.568 214 1HD2 LEU 29 HD21 LEU 29 48.365 16.474 -7.985 215 2HD2 LEU 29 HD22 LEU 29 47.480 16.908 -6.541 216 3HD2 LEU 29 HD23 LEU 29 48.006 15.258 -6.780 217 H CYS 30 HN CYS 30 52.209 18.822 -8.094 218 HA CYS 30 HA CYS 30 54.355 16.746 -8.329 219 1HB CYS 30 HB2 CYS 30 52.319 17.344 -10.478 220 2HB CYS 30 HB1 CYS 30 53.695 16.304 -10.665 221 H ASP 31 HN ASP 31 55.957 17.231 -9.832 222 HA ASP 31 HA ASP 31 56.003 19.959 -11.019 223 1HB ASP 31 HB2 ASP 31 57.029 19.883 -8.786 224 2HB ASP 31 HB1 ASP 31 58.105 18.597 -9.347 225 H LYS 32 HN LYS 32 55.449 17.622 -11.997 226 HA LYS 32 HA LYS 32 57.417 17.451 -14.211 227 1HB LYS 32 HB2 LYS 32 57.993 15.663 -12.533 228 2HB LYS 32 HB1 LYS 32 56.377 14.993 -12.726 229 1HG LYS 32 HG2 LYS 32 56.790 14.742 -15.146 230 2HG LYS 32 HG1 LYS 32 58.400 15.415 -14.917 231 1HD LYS 32 HD2 LYS 32 58.982 13.504 -13.405 232 2HD LYS 32 HD1 LYS 32 57.372 12.839 -13.616 233 1HE LYS 32 HE2 LYS 32 58.990 11.695 -15.107 234 2HE LYS 32 HE1 LYS 32 57.805 12.575 -16.062 235 1HZ LYS 32 HZ1 LYS 32 60.383 13.788 -15.301 236 2HZ LYS 32 HZ2 LYS 32 59.321 14.241 -16.546 237 3HZ LYS 32 HZ3 LYS 32 60.228 12.812 -16.682 238 H LYS 33 HN LYS 33 54.355 16.190 -12.969 239 HA LYS 33 HA LYS 33 53.192 16.287 -15.729 240 1HB LYS 33 HB2 LYS 33 53.058 14.084 -14.556 241 2HB LYS 33 HB1 LYS 33 52.210 14.858 -13.236 242 1HG LYS 33 HG2 LYS 33 50.630 13.710 -14.711 243 2HG LYS 33 HG1 LYS 33 50.330 15.428 -14.751 244 1HD LYS 33 HD2 LYS 33 51.645 15.552 -16.929 245 2HD LYS 33 HD1 LYS 33 51.888 13.818 -16.838 246 1HE LYS 33 HE2 LYS 33 49.421 13.477 -16.928 247 2HE LYS 33 HE1 LYS 33 49.188 15.221 -17.002 248 1HZ LYS 33 HZ1 LYS 33 49.104 14.247 -19.179 249 2HZ LYS 33 HZ2 LYS 33 50.655 13.583 -18.983 250 3HZ LYS 33 HZ3 LYS 33 50.455 15.268 -19.048 251 H CYS 34 HN CYS 34 51.107 17.104 -16.017 252 HA CYS 34 HA CYS 34 50.171 18.925 -13.904 253 1HB CYS 34 HB2 CYS 34 50.639 19.585 -16.772 254 2HB CYS 34 HB1 CYS 34 49.738 20.626 -15.693 255 H ASN 35 HN ASN 35 48.669 17.350 -13.647 256 HA ASN 35 HA ASN 35 46.438 17.063 -15.612 257 1HB ASN 35 HB2 ASN 35 46.253 16.167 -12.661 258 2HB ASN 35 HB1 ASN 35 45.274 15.668 -14.002 259 1HD2 ASN 35 HD21 ASN 35 46.455 13.859 -12.269 260 2HD2 ASN 35 HD22 ASN 35 47.588 12.914 -13.082 261 H GLN 36 HN GLN 36 44.690 18.485 -15.547 262 HA GLN 36 HA GLN 36 44.737 20.653 -13.512 263 1HB GLN 36 HB2 GLN 36 42.846 20.152 -15.901 264 2HB GLN 36 HB1 GLN 36 42.952 21.651 -14.993 265 1HG GLN 36 HG2 GLN 36 45.331 21.924 -15.739 266 2HG GLN 36 HG1 GLN 36 45.195 20.444 -16.675 267 1HE2 GLN 36 HE21 GLN 36 44.121 23.805 -16.477 268 2HE2 GLN 36 HE22 GLN 36 43.480 23.877 -18.047 269 H ARG 37 HN ARG 37 44.497 19.276 -11.933 270 HA ARG 37 HA ARG 37 41.698 18.596 -11.177 271 1HB ARG 37 HB2 ARG 37 44.172 16.847 -10.744 272 2HB ARG 37 HB1 ARG 37 42.539 16.431 -10.269 273 1HG ARG 37 HG2 ARG 37 43.406 16.903 -13.158 274 2HG ARG 37 HG1 ARG 37 43.336 15.346 -12.428 275 1HD ARG 37 HD2 ARG 37 40.945 17.241 -12.752 276 2HD ARG 37 HD1 ARG 37 41.282 15.843 -13.766 277 HE ARG 37 HE ARG 37 41.169 15.100 -10.980 278 1HH1 ARG 37 HH11 ARG 37 39.236 15.941 -13.735 279 2HH1 ARG 37 HH12 ARG 37 37.862 15.043 -13.183 280 1HH2 ARG 37 HH21 ARG 37 39.442 13.959 -10.268 281 2HH2 ARG 37 HH22 ARG 37 37.981 13.904 -11.195 282 H CYS 38 HN CYS 38 42.647 17.544 -8.633 283 HA CYS 38 HA CYS 38 43.273 20.134 -7.336 284 1HB CYS 38 HB2 CYS 38 41.406 18.731 -6.462 285 2HB CYS 38 HB1 CYS 38 42.559 17.469 -6.074 286 H GLY 39 HN GLY 39 44.712 19.980 -5.375 287 1HA GLY 39 HA2 GLY 39 46.797 18.108 -5.047 288 2HA GLY 39 HA1 GLY 39 47.383 19.387 -6.123 289 H CYS 40 HN CYS 40 48.330 18.765 -3.435 290 HA CYS 40 HA CYS 40 47.345 20.339 -1.375 291 1HB CYS 40 HB2 CYS 40 50.271 19.883 -2.014 292 2HB CYS 40 HB1 CYS 40 49.651 20.500 -0.522 293 H ILE 41 HN ILE 41 47.803 22.254 -0.527 294 HA ILE 41 HA ILE 41 47.866 24.482 -2.355 295 HB ILE 41 HB ILE 41 48.338 24.534 0.657 296 1HG1 ILE 41 HG12 ILE 41 45.661 24.661 -0.880 297 2HG1 ILE 41 HG11 ILE 41 46.208 23.194 -0.108 298 1HG2 ILE 41 HG21 ILE 41 48.710 26.703 -0.489 299 2HG2 ILE 41 HG22 ILE 41 47.276 26.785 0.499 300 3HG2 ILE 41 HG23 ILE 41 47.128 26.586 -1.239 301 1HD1 ILE 41 HD11 ILE 41 45.573 25.800 1.319 302 2HD1 ILE 41 HD12 ILE 41 46.160 24.330 2.088 303 3HD1 ILE 41 HD13 ILE 41 44.591 24.345 1.299 304 H SER 42 HN SER 42 49.429 26.212 -2.167 305 HA SER 42 HA SER 42 52.131 25.228 -2.614 306 1HB SER 42 HB2 SER 42 51.197 27.138 -3.966 307 2HB SER 42 HB1 SER 42 51.099 28.126 -2.500 308 HG SER 42 HG SER 42 53.410 26.923 -3.617 309 H GLY 43 HN GLY 43 53.009 24.475 -0.879 310 1HA GLY 43 HA2 GLY 43 54.647 25.324 0.874 311 2HA GLY 43 HA1 GLY 43 53.266 26.170 1.578 312 H THR 44 HN THR 44 51.632 23.718 0.625 313 HA THR 44 HA THR 44 52.190 22.065 3.039 314 HB THR 44 HB THR 44 49.823 21.327 2.923 315 HG1 THR 44 HG1 THR 44 50.125 22.076 0.418 316 1HG2 THR 44 HG21 THR 44 50.250 23.522 4.022 317 2HG2 THR 44 HG22 THR 44 48.672 23.460 3.248 318 3HG2 THR 44 HG23 THR 44 49.993 24.334 2.478 319 H VAL 45 HN VAL 45 52.022 19.984 2.970 320 HA VAL 45 HA VAL 45 52.331 18.531 0.391 321 HB VAL 45 HB VAL 45 53.885 16.965 1.637 322 1HG1 VAL 45 HG11 VAL 45 54.851 19.830 1.475 323 2HG1 VAL 45 HG12 VAL 45 54.825 18.646 0.174 324 3HG1 VAL 45 HG13 VAL 45 55.848 18.379 1.564 325 1HG2 VAL 45 HG21 VAL 45 54.001 19.195 3.696 326 2HG2 VAL 45 HG22 VAL 45 55.028 17.791 3.681 327 3HG2 VAL 45 HG23 VAL 45 53.317 17.599 3.998 328 H LEU 46 HN LEU 46 51.133 16.774 0.196 329 HA LEU 46 HA LEU 46 48.931 16.250 1.885 330 1HB LEU 46 HB2 LEU 46 49.151 15.574 -0.539 331 2HB LEU 46 HB1 LEU 46 50.340 14.388 -0.087 332 HG LEU 46 HG LEU 46 48.593 13.240 1.328 333 1HD1 LEU 46 HD11 LEU 46 46.727 15.287 0.032 334 2HD1 LEU 46 HD12 LEU 46 47.123 15.232 1.741 335 3HD1 LEU 46 HD13 LEU 46 46.209 13.935 1.011 336 1HD2 LEU 46 HD21 LEU 46 47.844 13.647 -1.600 337 2HD2 LEU 46 HD22 LEU 46 47.317 12.308 -0.593 338 3HD2 LEU 46 HD23 LEU 46 49.017 12.488 -0.995 339 H LYS 47 HN LYS 47 49.189 15.738 3.893 340 HA LYS 47 HA LYS 47 50.968 15.062 5.622 341 1HB LYS 47 HB2 LYS 47 48.602 15.029 6.126 342 2HB LYS 47 HB1 LYS 47 48.391 13.508 5.294 343 1HG LYS 47 HG2 LYS 47 49.839 12.380 6.954 344 2HG LYS 47 HG1 LYS 47 50.104 13.914 7.769 345 1HD LYS 47 HD2 LYS 47 47.637 14.063 8.213 346 2HD LYS 47 HD1 LYS 47 47.402 12.532 7.388 347 1HE LYS 47 HE2 LYS 47 47.487 12.195 9.841 348 2HE LYS 47 HE1 LYS 47 48.855 11.403 9.074 349 1HZ LYS 47 HZ1 LYS 47 49.056 14.155 10.112 350 2HZ LYS 47 HZ2 LYS 47 50.302 13.052 9.771 351 3HZ LYS 47 HZ3 LYS 47 49.293 12.805 11.116 352 H SER 48 HN SER 48 49.854 12.409 3.539 353 HA SER 48 HA SER 48 52.465 11.041 3.951 354 1HB SER 48 HB2 SER 48 49.711 9.696 4.303 355 2HB SER 48 HB1 SER 48 51.270 8.859 4.393 356 HG SER 48 HG SER 48 50.138 10.737 6.117 357 H LYS 49 HN LYS 49 52.409 8.991 2.642 358 HA LYS 49 HA LYS 49 52.857 9.473 0.006 359 1HB LYS 49 HB2 LYS 49 53.367 7.365 1.174 360 2HB LYS 49 HB1 LYS 49 51.667 6.939 1.183 361 1HG LYS 49 HG2 LYS 49 51.656 6.893 -1.309 362 2HG LYS 49 HG1 LYS 49 53.350 7.353 -1.330 363 1HD LYS 49 HD2 LYS 49 53.916 5.267 -0.075 364 2HD LYS 49 HD1 LYS 49 52.221 4.817 -0.060 365 1HE LYS 49 HE2 LYS 49 53.910 5.207 -2.569 366 2HE LYS 49 HE1 LYS 49 53.427 3.658 -1.895 367 1HZ LYS 49 HZ1 LYS 49 51.730 5.725 -3.130 368 2HZ LYS 49 HZ2 LYS 49 51.075 4.522 -2.126 369 3HZ LYS 49 HZ3 LYS 49 51.893 4.087 -3.549 370 H ASP 50 HN ASP 50 49.759 9.048 1.467 371 HA ASP 50 HA ASP 50 48.374 10.148 -0.828 372 1HB ASP 50 HB2 ASP 50 48.752 7.791 -1.647 373 2HB ASP 50 HB1 ASP 50 47.935 7.173 -0.225 374 H SER 51 HN SER 51 48.256 11.257 1.480 375 HA SER 51 HA SER 51 46.098 10.261 3.217 376 1HB SER 51 HB2 SER 51 48.135 11.520 4.055 377 2HB SER 51 HB1 SER 51 47.542 12.962 3.219 378 HG SER 51 HG SER 51 46.742 11.892 5.546 379 H SER 52 HN SER 52 44.994 12.980 3.600 380 HA SER 52 HA SER 52 43.666 13.702 1.091 381 1HB SER 52 HB2 SER 52 41.365 13.282 2.066 382 2HB SER 52 HB1 SER 52 42.289 11.775 1.955 383 HG SER 52 HG SER 52 42.044 13.477 4.208 384 H GLU 53 HN GLU 53 45.381 14.805 3.247 385 HA GLU 53 HA GLU 53 44.136 17.451 3.467 386 1HB GLU 53 HB2 GLU 53 43.238 15.984 5.461 387 2HB GLU 53 HB1 GLU 53 44.885 15.976 6.046 388 1HG GLU 53 HG2 GLU 53 43.160 18.446 5.604 389 2HG GLU 53 HG1 GLU 53 43.567 17.749 7.157 390 H CYS 54 HN CYS 54 45.842 18.760 3.116 391 HA CYS 54 HA CYS 54 48.584 17.664 3.390 392 1HB CYS 54 HB2 CYS 54 47.668 20.197 2.034 393 2HB CYS 54 HB1 CYS 54 49.239 19.461 1.918 394 H VAL 55 HN VAL 55 50.062 18.463 4.597 395 HA VAL 55 HA VAL 55 49.573 20.806 6.377 396 HB VAL 55 HB VAL 55 51.038 19.546 8.040 397 1HG1 VAL 55 HG11 VAL 55 49.204 17.993 8.786 398 2HG1 VAL 55 HG12 VAL 55 48.492 18.088 7.187 399 3HG1 VAL 55 HG13 VAL 55 48.496 19.502 8.236 400 1HG2 VAL 55 HG21 VAL 55 50.511 17.203 6.166 401 2HG2 VAL 55 HG22 VAL 55 51.251 17.085 7.751 402 3HG2 VAL 55 HG23 VAL 55 52.075 17.940 6.463 403 H HIS 56 HN HIS 56 51.380 22.142 6.776 404 HA HIS 56 HA HIS 56 53.351 22.212 4.674 405 1HB HIS 56 HB2 HIS 56 53.397 23.593 7.398 406 2HB HIS 56 HB1 HIS 56 54.420 24.028 6.053 407 HD1 HIS 56 HD1 HIS 56 53.268 25.322 4.151 408 HD2 HIS 56 HD2 HIS 56 50.653 24.361 7.136 409 HE1 HIS 56 HE1 HIS 56 51.219 26.628 3.726 410 HA PRO 57 HA PRO 57 56.585 19.510 6.123 411 1HB PRO 57 HB2 PRO 57 58.787 21.243 6.017 412 2HB PRO 57 HB1 PRO 57 58.152 20.345 4.666 413 1HG PRO 57 HG2 PRO 57 57.588 23.171 5.443 414 2HG PRO 57 HG1 PRO 57 57.923 22.492 3.839 415 1HD PRO 57 HD2 PRO 57 55.462 23.073 4.530 416 2HD PRO 57 HD1 PRO 57 55.785 21.565 3.652 417 H SER 58 HN SER 58 56.156 22.638 7.560 418 HA SER 58 HA SER 58 57.737 22.230 9.925 419 1HB SER 58 HB2 SER 58 56.476 24.307 10.717 420 2HB SER 58 HB1 SER 58 57.214 24.496 9.121 421 HG SER 58 HG SER 58 55.190 23.773 8.249 422 H LYS 59 HN LYS 59 54.597 21.121 9.120 423 HA LYS 59 HA LYS 59 53.951 20.584 11.988 424 1HB LYS 59 HB2 LYS 59 52.259 20.238 9.493 425 2HB LYS 59 HB1 LYS 59 51.724 19.795 11.098 426 1HG LYS 59 HG2 LYS 59 50.762 21.937 10.609 427 2HG LYS 59 HG1 LYS 59 52.047 22.198 11.781 428 1HD LYS 59 HD2 LYS 59 53.542 22.967 10.076 429 2HD LYS 59 HD1 LYS 59 52.369 22.593 8.818 430 1HE LYS 59 HE2 LYS 59 50.818 24.291 9.851 431 2HE LYS 59 HE1 LYS 59 52.013 24.617 11.099 432 1HZ LYS 59 HZ1 LYS 59 53.515 25.442 9.469 433 2HZ LYS 59 HZ2 LYS 59 52.022 26.230 9.283 434 3HZ LYS 59 HZ3 LYS 59 52.473 25.003 8.202 435 H CYS 60 HN CYS 60 54.615 19.099 8.901 436 HA CYS 60 HA CYS 60 53.995 16.441 9.389 437 1HB CYS 60 HB2 CYS 60 56.281 17.673 7.910 438 2HB CYS 60 HB1 CYS 60 56.055 15.948 7.884 Start of MODEL 11 1 1H ASN 1 HT1 ASN 1 31.594 14.594 -9.756 2 2H ASN 1 HT2 ASN 1 33.122 13.911 -10.046 3 3H ASN 1 HT3 ASN 1 32.877 15.574 -10.286 4 HA ASN 1 HA ASN 1 32.450 15.871 -7.930 5 1HB ASN 1 HB2 ASN 1 31.628 13.542 -7.485 6 2HB ASN 1 HB1 ASN 1 33.235 12.906 -7.796 7 1HD2 ASN 1 HD21 ASN 1 31.654 15.391 -5.705 8 2HD2 ASN 1 HD22 ASN 1 32.616 15.071 -4.344 9 H PHE 2 HN PHE 2 34.110 17.079 -9.106 10 HA PHE 2 HA PHE 2 36.901 16.138 -8.797 11 1HB PHE 2 HB2 PHE 2 37.440 18.192 -10.154 12 2HB PHE 2 HB1 PHE 2 36.237 17.200 -10.952 13 HD1 PHE 2 HD1 PHE 2 36.853 20.410 -9.296 14 HD2 PHE 2 HD2 PHE 2 33.834 17.893 -10.949 15 HE1 PHE 2 HE1 PHE 2 35.296 22.300 -9.341 16 HE2 PHE 2 HE2 PHE 2 32.283 19.789 -10.992 17 HZ PHE 2 HZ PHE 2 33.009 21.997 -10.189 18 H VAL 3 HN VAL 3 35.152 16.831 -6.581 19 HA VAL 3 HA VAL 3 36.395 19.236 -5.376 20 HB VAL 3 HB VAL 3 34.187 17.387 -4.352 21 1HG1 VAL 3 HG11 VAL 3 35.340 18.608 -2.503 22 2HG1 VAL 3 HG12 VAL 3 33.714 19.218 -2.736 23 3HG1 VAL 3 HG13 VAL 3 35.086 20.126 -3.347 24 1HG2 VAL 3 HG21 VAL 3 32.656 19.233 -5.018 25 2HG2 VAL 3 HG22 VAL 3 33.524 18.620 -6.412 26 3HG2 VAL 3 HG23 VAL 3 34.014 20.134 -5.672 27 H CYS 4 HN CYS 4 37.659 19.189 -3.606 28 HA CYS 4 HA CYS 4 38.496 16.584 -2.474 29 1HB CYS 4 HB2 CYS 4 40.257 18.685 -3.748 30 2HB CYS 4 HB1 CYS 4 40.909 17.639 -2.540 31 HA PRO 5 HA PRO 5 38.258 17.998 1.453 32 1HB PRO 5 HB2 PRO 5 40.865 17.111 2.435 33 2HB PRO 5 HB1 PRO 5 39.317 16.371 2.642 34 1HG PRO 5 HG2 PRO 5 41.289 15.315 1.039 35 2HG PRO 5 HG1 PRO 5 39.569 14.942 0.919 36 1HD PRO 5 HD2 PRO 5 41.260 16.675 -0.778 37 2HD PRO 5 HD1 PRO 5 39.842 15.712 -1.199 38 HA PRO 6 HA PRO 6 39.845 21.890 2.787 39 1HB PRO 6 HB2 PRO 6 41.352 21.273 5.083 40 2HB PRO 6 HB1 PRO 6 39.637 21.586 5.014 41 1HG PRO 6 HG2 PRO 6 41.018 18.923 4.843 42 2HG PRO 6 HG1 PRO 6 39.647 19.363 5.867 43 1HD PRO 6 HD2 PRO 6 39.100 18.085 3.752 44 2HD PRO 6 HD1 PRO 6 38.213 19.601 3.973 45 H GLY 7 HN GLY 7 42.398 19.584 3.525 46 1HA GLY 7 HA2 GLY 7 44.616 21.265 3.084 47 2HA GLY 7 HA1 GLY 7 44.650 19.521 3.058 48 H GLN 8 HN GLN 8 42.615 19.814 0.674 49 HA GLN 8 HA GLN 8 44.689 20.460 -1.391 50 1HB GLN 8 HB2 GLN 8 42.620 18.231 -1.425 51 2HB GLN 8 HB1 GLN 8 43.693 18.606 -2.764 52 1HG GLN 8 HG2 GLN 8 45.659 18.120 -1.314 53 2HG GLN 8 HG1 GLN 8 44.587 17.752 0.033 54 1HE2 GLN 8 HE21 GLN 8 43.716 15.689 0.135 55 2HE2 GLN 8 HE22 GLN 8 43.924 14.490 -1.043 56 H THR 9 HN THR 9 44.072 21.294 -3.252 57 HA THR 9 HA THR 9 41.279 22.131 -3.742 58 HB THR 9 HB THR 9 41.984 24.563 -4.014 59 HG1 THR 9 HG1 THR 9 44.093 24.027 -4.681 60 1HG2 THR 9 HG21 THR 9 43.238 23.488 -1.434 61 2HG2 THR 9 HG22 THR 9 41.522 23.829 -1.587 62 3HG2 THR 9 HG23 THR 9 42.698 25.132 -1.728 63 H PHE 10 HN PHE 10 41.560 23.630 -5.855 64 HA PHE 10 HA PHE 10 42.301 21.864 -7.962 65 1HB PHE 10 HB2 PHE 10 40.732 23.745 -8.367 66 2HB PHE 10 HB1 PHE 10 41.983 24.913 -7.966 67 HD1 PHE 10 HD1 PHE 10 41.372 22.037 -10.336 68 HD2 PHE 10 HD2 PHE 10 43.265 25.805 -9.701 69 HE1 PHE 10 HE1 PHE 10 42.154 22.044 -12.658 70 HE2 PHE 10 HE2 PHE 10 44.042 25.806 -12.021 71 HZ PHE 10 HZ PHE 10 43.496 23.936 -13.506 72 H GLN 11 HN GLN 11 44.153 21.815 -9.246 73 HA GLN 11 HA GLN 11 46.482 23.499 -8.464 74 1HB GLN 11 HB2 GLN 11 46.210 20.966 -7.348 75 2HB GLN 11 HB1 GLN 11 46.926 20.525 -8.875 76 1HG GLN 11 HG2 GLN 11 48.723 20.806 -7.287 77 2HG GLN 11 HG1 GLN 11 48.810 22.134 -8.434 78 1HE2 GLN 11 HE21 GLN 11 46.430 21.910 -5.693 79 2HE2 GLN 11 HE22 GLN 11 47.055 23.233 -4.866 80 H THR 12 HN THR 12 47.108 24.329 -10.426 81 HA THR 12 HA THR 12 46.047 23.160 -12.881 82 HB THR 12 HB THR 12 46.159 25.631 -12.647 83 HG1 THR 12 HG1 THR 12 46.327 24.702 -14.675 84 1HG2 THR 12 HG21 THR 12 49.206 25.322 -12.841 85 2HG2 THR 12 HG22 THR 12 48.377 25.794 -11.364 86 3HG2 THR 12 HG23 THR 12 48.299 26.818 -12.789 87 H CYS 13 HN CYS 13 49.393 23.708 -11.687 88 HA CYS 13 HA CYS 13 50.268 21.727 -13.698 89 1HB CYS 13 HB2 CYS 13 51.666 24.051 -12.504 90 2HB CYS 13 HB1 CYS 13 52.612 22.729 -13.148 91 H ALA 14 HN ALA 14 49.773 19.953 -12.559 92 HA ALA 14 HA ALA 14 51.951 18.869 -11.018 93 1HB ALA 14 HB1 ALA 14 49.163 19.147 -9.735 94 2HB ALA 14 HB2 ALA 14 50.586 20.025 -9.208 95 3HB ALA 14 HB3 ALA 14 50.510 18.284 -9.013 96 H SER 15 HN SER 15 52.158 16.829 -11.561 97 HA SER 15 HA SER 15 50.275 15.625 -13.388 98 1HB SER 15 HB2 SER 15 52.843 15.301 -13.358 99 2HB SER 15 HB1 SER 15 52.584 14.203 -12.014 100 HG SER 15 HG SER 15 51.210 13.998 -14.460 101 H SER 16 HN SER 16 51.005 12.960 -11.931 102 HA SER 16 HA SER 16 48.749 12.993 -9.973 103 1HB SER 16 HB2 SER 16 49.710 10.727 -11.812 104 2HB SER 16 HB1 SER 16 48.348 10.627 -10.682 105 HG SER 16 HG SER 16 47.219 11.584 -12.147 106 H CYS 17 HN CYS 17 51.673 13.565 -9.704 107 HA CYS 17 HA CYS 17 52.492 11.263 -7.944 108 1HB CYS 17 HB2 CYS 17 54.721 11.905 -8.203 109 2HB CYS 17 HB1 CYS 17 54.020 11.987 -9.785 110 HA PRO 18 HA PRO 18 50.807 14.604 -5.219 111 1HB PRO 18 HB2 PRO 18 50.431 12.937 -3.014 112 2HB PRO 18 HB1 PRO 18 49.237 13.320 -4.224 113 1HG PRO 18 HG2 PRO 18 51.002 10.934 -4.033 114 2HG PRO 18 HG1 PRO 18 49.309 11.045 -4.545 115 1HD PRO 18 HD2 PRO 18 51.277 10.748 -6.300 116 2HD PRO 18 HD1 PRO 18 49.860 11.753 -6.674 117 H LYS 19 HN LYS 19 51.788 15.898 -3.906 118 HA LYS 19 HA LYS 19 54.492 15.213 -2.889 119 1HB LYS 19 HB2 LYS 19 54.058 17.397 -4.121 120 2HB LYS 19 HB1 LYS 19 52.956 17.835 -2.823 121 1HG LYS 19 HG2 LYS 19 54.928 17.578 -1.206 122 2HG LYS 19 HG1 LYS 19 55.940 17.223 -2.578 123 1HD LYS 19 HD2 LYS 19 56.329 19.475 -1.981 124 2HD LYS 19 HD1 LYS 19 55.511 19.486 -3.519 125 1HE LYS 19 HE2 LYS 19 54.285 20.184 -0.806 126 2HE LYS 19 HE1 LYS 19 54.644 21.278 -2.100 127 1HZ LYS 19 HZ1 LYS 19 52.364 19.622 -1.719 128 2HZ LYS 19 HZ2 LYS 19 53.000 19.519 -3.287 129 3HZ LYS 19 HZ3 LYS 19 52.557 21.026 -2.654 130 H THR 20 HN THR 20 54.495 14.350 -0.961 131 HA THR 20 HA THR 20 52.452 15.207 1.051 132 HB THR 20 HB THR 20 52.379 12.862 1.859 133 HG1 THR 20 HG1 THR 20 54.419 12.207 1.591 134 1HG2 THR 20 HG21 THR 20 52.614 12.691 -1.225 135 2HG2 THR 20 HG22 THR 20 51.134 13.227 -0.490 136 3HG2 THR 20 HG23 THR 20 51.701 11.603 -0.204 137 H CYS 21 HN CYS 21 53.257 14.195 3.239 138 HA CYS 21 HA CYS 21 55.394 15.804 4.156 139 1HB CYS 21 HB2 CYS 21 53.980 13.360 5.272 140 2HB CYS 21 HB1 CYS 21 55.133 14.288 6.204 141 H GLU 22 HN GLU 22 55.312 12.844 2.614 142 HA GLU 22 HA GLU 22 57.851 11.699 3.372 143 1HB GLU 22 HB2 GLU 22 55.945 10.402 2.358 144 2HB GLU 22 HB1 GLU 22 56.144 11.310 0.872 145 1HG GLU 22 HG2 GLU 22 58.432 10.387 0.581 146 2HG GLU 22 HG1 GLU 22 58.242 9.458 2.062 147 H THR 23 HN THR 23 56.682 13.566 0.588 148 HA THR 23 HA THR 23 59.372 13.947 -0.523 149 HB THR 23 HB THR 23 58.132 15.331 -2.265 150 HG1 THR 23 HG1 THR 23 55.976 14.525 -0.608 151 1HG2 THR 23 HG21 THR 23 56.788 13.498 -3.208 152 2HG2 THR 23 HG22 THR 23 56.749 12.668 -1.659 153 3HG2 THR 23 HG23 THR 23 58.263 12.804 -2.550 154 H ARG 24 HN ARG 24 57.019 16.570 -0.133 155 HA ARG 24 HA ARG 24 57.181 18.708 0.706 156 1HB ARG 24 HB2 ARG 24 59.557 17.606 2.267 157 2HB ARG 24 HB1 ARG 24 58.845 19.178 2.487 158 1HG ARG 24 HG2 ARG 24 56.673 18.145 3.046 159 2HG ARG 24 HG1 ARG 24 57.343 16.545 2.767 160 1HD ARG 24 HD2 ARG 24 58.291 18.504 4.893 161 2HD ARG 24 HD1 ARG 24 57.260 17.109 5.190 162 HE ARG 24 HE ARG 24 59.238 15.793 4.102 163 1HH1 ARG 24 HH11 ARG 24 59.549 18.588 6.155 164 2HH1 ARG 24 HH12 ARG 24 61.110 18.113 6.726 165 1HH2 ARG 24 HH21 ARG 24 61.197 15.196 4.827 166 2HH2 ARG 24 HH22 ARG 24 62.054 16.171 5.972 167 H ASN 25 HN ASN 25 59.639 17.286 -0.915 168 HA ASN 25 HA ASN 25 61.644 19.185 -1.159 169 1HB ASN 25 HB2 ASN 25 60.636 17.152 -3.205 170 2HB ASN 25 HB1 ASN 25 62.235 17.872 -3.192 171 1HD2 ASN 25 HD21 ASN 25 62.416 17.704 -0.170 172 2HD2 ASN 25 HD22 ASN 25 62.708 16.062 0.145 173 H LYS 26 HN LYS 26 58.720 18.821 -3.172 174 HA LYS 26 HA LYS 26 59.371 21.251 -4.684 175 1HB LYS 26 HB2 LYS 26 57.196 19.107 -4.954 176 2HB LYS 26 HB1 LYS 26 57.247 20.524 -5.965 177 1HG LYS 26 HG2 LYS 26 58.237 18.623 -7.111 178 2HG LYS 26 HG1 LYS 26 59.468 19.833 -6.827 179 1HD LYS 26 HD2 LYS 26 60.376 18.528 -4.957 180 2HD LYS 26 HD1 LYS 26 59.096 17.331 -5.116 181 1HE LYS 26 HE2 LYS 26 61.236 18.036 -7.188 182 2HE LYS 26 HE1 LYS 26 61.225 16.598 -6.179 183 1HZ LYS 26 HZ1 LYS 26 60.163 15.665 -7.857 184 2HZ LYS 26 HZ2 LYS 26 59.788 17.152 -8.587 185 3HZ LYS 26 HZ3 LYS 26 58.795 16.538 -7.355 186 H LEU 27 HN LEU 27 57.094 22.322 -5.159 187 HA LEU 27 HA LEU 27 55.742 22.986 -2.587 188 1HB LEU 27 HB2 LEU 27 56.589 25.072 -4.677 189 2HB LEU 27 HB1 LEU 27 55.682 25.404 -3.223 190 HG LEU 27 HG LEU 27 57.687 24.579 -1.915 191 1HD1 LEU 27 HD11 LEU 27 59.011 23.422 -3.703 192 2HD1 LEU 27 HD12 LEU 27 59.921 24.726 -3.002 193 3HD1 LEU 27 HD13 LEU 27 59.146 24.935 -4.562 194 1HD2 LEU 27 HD21 LEU 27 57.992 27.078 -3.634 195 2HD2 LEU 27 HD22 LEU 27 58.873 26.779 -2.143 196 3HD2 LEU 27 HD23 LEU 27 57.128 26.971 -2.107 197 H VAL 28 HN VAL 28 54.977 21.364 -4.545 198 HA VAL 28 HA VAL 28 52.231 22.314 -5.079 199 HB VAL 28 HB VAL 28 53.723 21.220 -7.411 200 1HG1 VAL 28 HG11 VAL 28 51.966 22.350 -8.759 201 2HG1 VAL 28 HG12 VAL 28 51.228 22.892 -7.263 202 3HG1 VAL 28 HG13 VAL 28 51.340 21.178 -7.619 203 1HG2 VAL 28 HG21 VAL 28 53.529 24.240 -6.887 204 2HG2 VAL 28 HG22 VAL 28 54.084 23.530 -8.392 205 3HG2 VAL 28 HG23 VAL 28 55.018 23.306 -6.929 206 H LEU 29 HN LEU 29 50.901 20.591 -5.835 207 HA LEU 29 HA LEU 29 51.268 18.232 -4.519 208 1HB LEU 29 HB2 LEU 29 49.123 19.067 -5.444 209 2HB LEU 29 HB1 LEU 29 49.715 18.877 -7.063 210 HG LEU 29 HG LEU 29 47.997 17.170 -6.455 211 1HD1 LEU 29 HD11 LEU 29 49.088 15.106 -7.155 212 2HD1 LEU 29 HD12 LEU 29 50.666 15.806 -6.954 213 3HD1 LEU 29 HD13 LEU 29 49.581 16.450 -8.163 214 1HD2 LEU 29 HD21 LEU 29 48.449 16.992 -4.051 215 2HD2 LEU 29 HD22 LEU 29 50.001 16.262 -4.360 216 3HD2 LEU 29 HD23 LEU 29 48.525 15.408 -4.784 217 H CYS 30 HN CYS 30 52.140 18.944 -7.699 218 HA CYS 30 HA CYS 30 54.244 16.894 -7.731 219 1HB CYS 30 HB2 CYS 30 52.232 15.608 -8.409 220 2HB CYS 30 HB1 CYS 30 51.902 16.757 -9.662 221 H ASP 31 HN ASP 31 55.311 17.001 -10.085 222 HA ASP 31 HA ASP 31 55.117 19.760 -11.154 223 1HB ASP 31 HB2 ASP 31 57.563 20.121 -10.844 224 2HB ASP 31 HB1 ASP 31 56.764 19.814 -9.318 225 H LYS 32 HN LYS 32 56.335 16.565 -11.625 226 HA LYS 32 HA LYS 32 57.720 16.782 -14.042 227 1HB LYS 32 HB2 LYS 32 57.093 14.422 -14.464 228 2HB LYS 32 HB1 LYS 32 57.580 14.678 -12.800 229 1HG LYS 32 HG2 LYS 32 55.187 14.856 -12.124 230 2HG LYS 32 HG1 LYS 32 54.707 14.570 -13.784 231 1HD LYS 32 HD2 LYS 32 56.264 12.593 -12.081 232 2HD LYS 32 HD1 LYS 32 54.542 12.512 -12.387 233 1HE LYS 32 HE2 LYS 32 56.716 12.323 -14.530 234 2HE LYS 32 HE1 LYS 32 55.739 11.000 -13.920 235 1HZ LYS 32 HZ1 LYS 32 53.772 12.440 -14.622 236 2HZ LYS 32 HZ2 LYS 32 54.656 11.631 -15.827 237 3HZ LYS 32 HZ3 LYS 32 54.904 13.290 -15.560 238 H LYS 33 HN LYS 33 54.302 17.082 -13.621 239 HA LYS 33 HA LYS 33 53.953 17.913 -16.413 240 1HB LYS 33 HB2 LYS 33 53.646 15.469 -16.610 241 2HB LYS 33 HB1 LYS 33 52.495 15.464 -15.294 242 1HG LYS 33 HG2 LYS 33 50.938 16.812 -16.525 243 2HG LYS 33 HG1 LYS 33 52.074 17.026 -17.846 244 1HD LYS 33 HD2 LYS 33 51.999 14.506 -18.199 245 2HD LYS 33 HD1 LYS 33 50.841 14.381 -16.887 246 1HE LYS 33 HE2 LYS 33 49.678 14.391 -19.079 247 2HE LYS 33 HE1 LYS 33 49.249 15.831 -18.169 248 1HZ LYS 33 HZ1 LYS 33 51.480 15.838 -20.093 249 2HZ LYS 33 HZ2 LYS 33 50.612 17.155 -19.463 250 3HZ LYS 33 HZ3 LYS 33 49.876 16.111 -20.582 251 H CYS 34 HN CYS 34 51.959 18.900 -16.839 252 HA CYS 34 HA CYS 34 50.802 20.081 -14.400 253 1HB CYS 34 HB2 CYS 34 50.739 20.994 -17.242 254 2HB CYS 34 HB1 CYS 34 49.901 21.818 -15.957 255 H ASN 35 HN ASN 35 49.474 18.348 -14.040 256 HA ASN 35 HA ASN 35 47.093 17.965 -15.827 257 1HB ASN 35 HB2 ASN 35 47.442 16.673 -13.047 258 2HB ASN 35 HB1 ASN 35 46.275 16.274 -14.268 259 1HD2 ASN 35 HD21 ASN 35 47.743 14.256 -13.236 260 2HD2 ASN 35 HD22 ASN 35 48.865 13.675 -14.364 261 H GLN 36 HN GLN 36 45.450 19.355 -15.574 262 HA GLN 36 HA GLN 36 45.329 21.165 -13.274 263 1HB GLN 36 HB2 GLN 36 43.502 20.807 -15.690 264 2HB GLN 36 HB1 GLN 36 43.368 22.123 -14.542 265 1HG GLN 36 HG2 GLN 36 45.732 22.807 -15.103 266 2HG GLN 36 HG1 GLN 36 45.794 21.523 -16.301 267 1HE2 GLN 36 HE21 GLN 36 44.489 24.691 -15.581 268 2HE2 GLN 36 HE22 GLN 36 43.811 24.971 -17.112 269 H ARG 37 HN ARG 37 45.006 19.746 -11.599 270 HA ARG 37 HA ARG 37 42.225 18.978 -11.091 271 1HB ARG 37 HB2 ARG 37 42.813 16.574 -10.615 272 2HB ARG 37 HB1 ARG 37 43.056 16.998 -12.290 273 1HG ARG 37 HG2 ARG 37 45.498 17.364 -11.862 274 2HG ARG 37 HG1 ARG 37 45.269 16.977 -10.170 275 1HD ARG 37 HD2 ARG 37 44.760 15.048 -12.472 276 2HD ARG 37 HD1 ARG 37 46.184 15.062 -11.431 277 HE ARG 37 HE ARG 37 43.619 14.868 -10.011 278 1HH1 ARG 37 HH11 ARG 37 46.284 13.178 -11.466 279 2HH1 ARG 37 HH12 ARG 37 46.009 11.739 -10.546 280 1HH2 ARG 37 HH21 ARG 37 43.262 13.057 -8.848 281 2HH2 ARG 37 HH22 ARG 37 44.275 11.666 -9.046 282 H CYS 38 HN CYS 38 42.323 17.507 -9.039 283 HA CYS 38 HA CYS 38 42.665 19.062 -6.767 284 1HB CYS 38 HB2 CYS 38 41.313 17.107 -6.873 285 2HB CYS 38 HB1 CYS 38 42.674 16.083 -7.203 286 H GLY 39 HN GLY 39 44.185 19.140 -5.070 287 1HA GLY 39 HA2 GLY 39 46.561 17.705 -4.813 288 2HA GLY 39 HA1 GLY 39 46.942 19.019 -5.917 289 H CYS 40 HN CYS 40 48.030 18.488 -3.279 290 HA CYS 40 HA CYS 40 46.997 20.095 -1.239 291 1HB CYS 40 HB2 CYS 40 49.929 19.651 -1.910 292 2HB CYS 40 HB1 CYS 40 49.333 20.300 -0.421 293 H ILE 41 HN ILE 41 47.394 22.134 -0.594 294 HA ILE 41 HA ILE 41 47.472 24.114 -2.705 295 HB ILE 41 HB ILE 41 47.820 24.628 0.275 296 1HG1 ILE 41 HG12 ILE 41 45.223 24.347 -1.366 297 2HG1 ILE 41 HG11 ILE 41 45.762 23.130 -0.231 298 1HG2 ILE 41 HG21 ILE 41 46.693 26.783 -0.279 299 2HG2 ILE 41 HG22 ILE 41 46.600 26.287 -1.962 300 3HG2 ILE 41 HG23 ILE 41 48.157 26.587 -1.206 301 1HD1 ILE 41 HD11 ILE 41 45.549 24.751 1.637 302 2HD1 ILE 41 HD12 ILE 41 44.027 24.516 0.795 303 3HD1 ILE 41 HD13 ILE 41 44.960 25.971 0.518 304 H SER 42 HN SER 42 48.983 25.833 -2.761 305 HA SER 42 HA SER 42 51.735 24.902 -2.889 306 1HB SER 42 HB2 SER 42 50.573 27.736 -3.220 307 2HB SER 42 HB1 SER 42 52.215 27.252 -3.685 308 HG SER 42 HG SER 42 49.799 26.065 -4.581 309 H GLY 43 HN GLY 43 52.431 24.365 -0.973 310 1HA GLY 43 HA2 GLY 43 53.913 25.395 0.802 311 2HA GLY 43 HA1 GLY 43 52.528 26.393 1.233 312 H THR 44 HN THR 44 51.666 23.229 0.298 313 HA THR 44 HA THR 44 51.743 22.177 3.075 314 HB THR 44 HB THR 44 49.338 21.449 2.928 315 HG1 THR 44 HG1 THR 44 49.795 22.031 0.364 316 1HG2 THR 44 HG21 THR 44 49.776 23.765 3.825 317 2HG2 THR 44 HG22 THR 44 48.232 23.642 2.993 318 3HG2 THR 44 HG23 THR 44 49.601 24.403 2.194 319 H VAL 45 HN VAL 45 51.420 19.986 3.227 320 HA VAL 45 HA VAL 45 51.774 18.339 0.793 321 HB VAL 45 HB VAL 45 53.513 16.989 2.029 322 1HG1 VAL 45 HG11 VAL 45 54.102 18.584 0.327 323 2HG1 VAL 45 HG12 VAL 45 55.333 18.572 1.572 324 3HG1 VAL 45 HG13 VAL 45 54.181 19.897 1.500 325 1HG2 VAL 45 HG21 VAL 45 53.074 17.795 4.369 326 2HG2 VAL 45 HG22 VAL 45 53.620 19.396 3.893 327 3HG2 VAL 45 HG23 VAL 45 54.739 18.053 3.907 328 H LEU 46 HN LEU 46 50.652 16.610 0.752 329 HA LEU 46 HA LEU 46 48.519 15.926 2.356 330 1HB LEU 46 HB2 LEU 46 49.337 14.971 0.063 331 2HB LEU 46 HB1 LEU 46 50.296 13.903 1.069 332 HG LEU 46 HG LEU 46 48.313 12.920 2.085 333 1HD1 LEU 46 HD11 LEU 46 46.786 14.923 1.913 334 2HD1 LEU 46 HD12 LEU 46 46.054 13.520 1.173 335 3HD1 LEU 46 HD13 LEU 46 46.781 14.749 0.167 336 1HD2 LEU 46 HD21 LEU 46 48.196 12.994 -0.969 337 2HD2 LEU 46 HD22 LEU 46 47.475 11.752 0.036 338 3HD2 LEU 46 HD23 LEU 46 49.217 11.928 -0.022 339 H LYS 47 HN LYS 47 48.297 15.046 4.315 340 HA LYS 47 HA LYS 47 50.184 14.924 6.295 341 1HB LYS 47 HB2 LYS 47 47.789 14.700 6.742 342 2HB LYS 47 HB1 LYS 47 47.744 13.136 5.975 343 1HG LYS 47 HG2 LYS 47 47.732 12.890 8.404 344 2HG LYS 47 HG1 LYS 47 49.213 12.215 7.769 345 1HD LYS 47 HD2 LYS 47 50.427 14.337 8.366 346 2HD LYS 47 HD1 LYS 47 48.933 14.999 9.005 347 1HE LYS 47 HE2 LYS 47 50.337 12.488 10.025 348 2HE LYS 47 HE1 LYS 47 50.348 14.057 10.815 349 1HZ LYS 47 HZ1 LYS 47 47.842 13.860 10.797 350 2HZ LYS 47 HZ2 LYS 47 48.696 12.865 11.878 351 3HZ LYS 47 HZ3 LYS 47 48.080 12.217 10.433 352 H SER 48 HN SER 48 49.456 12.298 4.092 353 HA SER 48 HA SER 48 52.031 10.990 4.799 354 1HB SER 48 HB2 SER 48 49.343 9.484 4.678 355 2HB SER 48 HB1 SER 48 50.927 8.757 4.965 356 HG SER 48 HG SER 48 49.739 10.804 6.521 357 H LYS 49 HN LYS 49 52.349 9.119 3.283 358 HA LYS 49 HA LYS 49 52.778 10.005 0.690 359 1HB LYS 49 HB2 LYS 49 53.754 7.987 1.789 360 2HB LYS 49 HB1 LYS 49 52.231 7.149 1.560 361 1HG LYS 49 HG2 LYS 49 52.458 7.424 -0.919 362 2HG LYS 49 HG1 LYS 49 53.985 8.257 -0.673 363 1HD LYS 49 HD2 LYS 49 54.866 6.177 0.477 364 2HD LYS 49 HD1 LYS 49 53.344 5.383 0.135 365 1HE LYS 49 HE2 LYS 49 55.021 4.782 -1.575 366 2HE LYS 49 HE1 LYS 49 53.723 5.710 -2.312 367 1HZ LYS 49 HZ1 LYS 49 55.048 7.642 -2.321 368 2HZ LYS 49 HZ2 LYS 49 56.014 6.388 -2.939 369 3HZ LYS 49 HZ3 LYS 49 56.238 6.928 -1.344 370 H ASP 50 HN ASP 50 49.849 8.830 2.066 371 HA ASP 50 HA ASP 50 48.337 9.551 -0.335 372 1HB ASP 50 HB2 ASP 50 49.109 7.222 -0.841 373 2HB ASP 50 HB1 ASP 50 48.378 6.655 0.648 374 H SER 51 HN SER 51 48.090 10.870 1.934 375 HA SER 51 HA SER 51 45.835 9.778 3.550 376 1HB SER 51 HB2 SER 51 47.853 10.908 4.654 377 2HB SER 51 HB1 SER 51 47.357 12.414 3.876 378 HG SER 51 HG SER 51 45.749 10.782 5.538 379 H SER 52 HN SER 52 44.938 12.587 3.975 380 HA SER 52 HA SER 52 43.682 13.258 1.359 381 1HB SER 52 HB2 SER 52 41.434 13.413 2.489 382 2HB SER 52 HB1 SER 52 42.086 11.770 2.580 383 HG SER 52 HG SER 52 41.714 13.635 4.550 384 H GLU 53 HN GLU 53 44.628 14.281 4.555 385 HA GLU 53 HA GLU 53 43.996 17.126 3.809 386 1HB GLU 53 HB2 GLU 53 44.420 15.914 6.569 387 2HB GLU 53 HB1 GLU 53 44.040 17.597 6.240 388 1HG GLU 53 HG2 GLU 53 41.891 16.885 5.149 389 2HG GLU 53 HG1 GLU 53 42.270 15.214 5.527 390 H CYS 54 HN CYS 54 45.624 18.136 3.050 391 HA CYS 54 HA CYS 54 48.398 17.480 3.630 392 1HB CYS 54 HB2 CYS 54 47.292 19.890 2.174 393 2HB CYS 54 HB1 CYS 54 48.903 19.255 2.057 394 H VAL 55 HN VAL 55 49.810 18.668 4.726 395 HA VAL 55 HA VAL 55 48.965 21.052 6.282 396 HB VAL 55 HB VAL 55 50.062 20.148 8.269 397 1HG1 VAL 55 HG11 VAL 55 47.655 19.658 8.028 398 2HG1 VAL 55 HG12 VAL 55 48.447 18.321 8.844 399 3HG1 VAL 55 HG13 VAL 55 48.016 18.181 7.150 400 1HG2 VAL 55 HG21 VAL 55 50.837 17.757 8.384 401 2HG2 VAL 55 HG22 VAL 55 51.776 18.664 7.221 402 3HG2 VAL 55 HG23 VAL 55 50.517 17.575 6.669 403 H HIS 56 HN HIS 56 50.694 22.457 6.714 404 HA HIS 56 HA HIS 56 52.587 22.885 4.801 405 1HB HIS 56 HB2 HIS 56 52.810 23.547 7.750 406 2HB HIS 56 HB1 HIS 56 53.801 24.280 6.489 407 HD1 HIS 56 HD1 HIS 56 52.514 25.839 4.849 408 HD2 HIS 56 HD2 HIS 56 50.110 24.402 7.817 409 HE1 HIS 56 HE1 HIS 56 50.445 27.179 4.775 410 HA PRO 57 HA PRO 57 55.917 19.937 5.312 411 1HB PRO 57 HB2 PRO 57 57.824 21.221 3.850 412 2HB PRO 57 HB1 PRO 57 56.464 20.421 3.099 413 1HG PRO 57 HG2 PRO 57 56.794 23.324 3.724 414 2HG PRO 57 HG1 PRO 57 56.196 22.559 2.241 415 1HD PRO 57 HD2 PRO 57 54.551 23.602 4.094 416 2HD PRO 57 HD1 PRO 57 54.103 22.186 3.120 417 H SER 58 HN SER 58 55.596 22.837 6.769 418 HA SER 58 HA SER 58 58.281 23.104 7.934 419 1HB SER 58 HB2 SER 58 57.185 25.002 9.208 420 2HB SER 58 HB1 SER 58 56.831 25.143 7.481 421 HG SER 58 HG SER 58 54.978 23.640 8.144 422 H LYS 59 HN LYS 59 55.216 21.690 8.525 423 HA LYS 59 HA LYS 59 55.700 21.012 11.359 424 1HB LYS 59 HB2 LYS 59 53.477 20.129 9.441 425 2HB LYS 59 HB1 LYS 59 53.480 19.918 11.181 426 1HG LYS 59 HG2 LYS 59 53.423 22.358 11.505 427 2HG LYS 59 HG1 LYS 59 53.508 22.615 9.766 428 1HD LYS 59 HD2 LYS 59 51.416 21.340 9.463 429 2HD LYS 59 HD1 LYS 59 51.307 21.068 11.192 430 1HE LYS 59 HE2 LYS 59 51.254 23.801 9.816 431 2HE LYS 59 HE1 LYS 59 49.860 22.984 10.506 432 1HZ LYS 59 HZ1 LYS 59 52.197 24.112 11.902 433 2HZ LYS 59 HZ2 LYS 59 51.176 22.981 12.649 434 3HZ LYS 59 HZ3 LYS 59 50.551 24.471 12.122 435 H CYS 60 HN CYS 60 54.939 19.402 8.341 436 HA CYS 60 HA CYS 60 55.946 16.853 9.128 437 1HB CYS 60 HB2 CYS 60 54.884 18.059 6.624 438 2HB CYS 60 HB1 CYS 60 55.739 16.558 6.494 Start of MODEL 12 1 1H ASN 1 HT1 ASN 1 33.891 18.925 -12.754 2 2H ASN 1 HT2 ASN 1 32.389 19.387 -12.106 3 3H ASN 1 HT3 ASN 1 33.233 18.074 -11.438 4 HA ASN 1 HA ASN 1 34.399 20.773 -11.497 5 1HB ASN 1 HB2 ASN 1 33.506 21.078 -9.163 6 2HB ASN 1 HB1 ASN 1 32.214 20.974 -10.344 7 1HD2 ASN 1 HD21 ASN 1 31.280 18.668 -10.639 8 2HD2 ASN 1 HD22 ASN 1 31.126 17.722 -9.238 9 H PHE 2 HN PHE 2 36.417 20.634 -10.901 10 HA PHE 2 HA PHE 2 37.535 18.135 -9.801 11 1HB PHE 2 HB2 PHE 2 38.859 20.717 -10.716 12 2HB PHE 2 HB1 PHE 2 39.717 19.249 -10.267 13 HD1 PHE 2 HD1 PHE 2 37.582 20.844 -12.807 14 HD2 PHE 2 HD2 PHE 2 39.658 17.275 -11.742 15 HE1 PHE 2 HE1 PHE 2 37.324 20.009 -15.097 16 HE2 PHE 2 HE2 PHE 2 39.397 16.445 -14.035 17 HZ PHE 2 HZ PHE 2 38.230 17.809 -15.716 18 H VAL 3 HN VAL 3 36.202 18.658 -7.826 19 HA VAL 3 HA VAL 3 37.391 20.640 -5.981 20 HB VAL 3 HB VAL 3 35.540 19.961 -4.460 21 1HG1 VAL 3 HG11 VAL 3 34.659 20.495 -7.328 22 2HG1 VAL 3 HG12 VAL 3 35.137 21.713 -6.160 23 3HG1 VAL 3 HG13 VAL 3 33.678 20.774 -5.897 24 1HG2 VAL 3 HG21 VAL 3 33.821 18.346 -5.243 25 2HG2 VAL 3 HG22 VAL 3 35.377 17.552 -5.089 26 3HG2 VAL 3 HG23 VAL 3 34.773 17.999 -6.676 27 H CYS 4 HN CYS 4 38.193 20.217 -4.045 28 HA CYS 4 HA CYS 4 39.641 17.651 -3.730 29 1HB CYS 4 HB2 CYS 4 39.922 20.356 -2.545 30 2HB CYS 4 HB1 CYS 4 40.878 19.032 -1.982 31 HA PRO 5 HA PRO 5 37.825 17.489 0.538 32 1HB PRO 5 HB2 PRO 5 40.108 16.162 1.636 33 2HB PRO 5 HB1 PRO 5 38.603 15.435 1.163 34 1HG PRO 5 HG2 PRO 5 40.993 14.933 -0.112 35 2HG PRO 5 HG1 PRO 5 39.407 14.738 -0.883 36 1HD PRO 5 HD2 PRO 5 41.275 17.076 -0.976 37 2HD PRO 5 HD1 PRO 5 40.464 16.302 -2.337 38 HA PRO 6 HA PRO 6 39.850 20.562 3.140 39 1HB PRO 6 HB2 PRO 6 40.603 19.002 5.348 40 2HB PRO 6 HB1 PRO 6 39.050 19.769 5.139 41 1HG PRO 6 HG2 PRO 6 39.828 16.950 4.428 42 2HG PRO 6 HG1 PRO 6 38.369 17.521 5.259 43 1HD PRO 6 HD2 PRO 6 38.219 16.884 2.775 44 2HD PRO 6 HD1 PRO 6 37.474 18.407 3.260 45 H GLY 7 HN GLY 7 41.874 21.340 3.468 46 1HA GLY 7 HA2 GLY 7 44.204 21.446 3.500 47 2HA GLY 7 HA1 GLY 7 44.243 19.702 3.666 48 H GLN 8 HN GLN 8 42.444 20.406 0.850 49 HA GLN 8 HA GLN 8 44.879 20.524 -0.851 50 1HB GLN 8 HB2 GLN 8 42.568 18.563 -1.102 51 2HB GLN 8 HB1 GLN 8 43.868 18.727 -2.271 52 1HG GLN 8 HG2 GLN 8 45.492 18.010 -0.548 53 2HG GLN 8 HG1 GLN 8 44.207 17.868 0.645 54 1HE2 GLN 8 HE21 GLN 8 44.638 15.576 0.884 55 2HE2 GLN 8 HE22 GLN 8 44.176 14.460 -0.308 56 H THR 9 HN THR 9 44.437 21.523 -2.821 57 HA THR 9 HA THR 9 41.700 22.610 -3.220 58 HB THR 9 HB THR 9 44.240 24.361 -3.082 59 HG1 THR 9 HG1 THR 9 42.105 23.694 -1.337 60 1HG2 THR 9 HG21 THR 9 42.596 26.168 -2.936 61 2HG2 THR 9 HG22 THR 9 41.262 25.016 -2.947 62 3HG2 THR 9 HG23 THR 9 42.216 25.280 -4.405 63 H PHE 10 HN PHE 10 41.626 23.868 -5.342 64 HA PHE 10 HA PHE 10 42.619 22.120 -7.461 65 1HB PHE 10 HB2 PHE 10 40.319 23.018 -7.556 66 2HB PHE 10 HB1 PHE 10 40.937 24.660 -7.572 67 HD1 PHE 10 HD1 PHE 10 40.464 21.611 -9.545 68 HD2 PHE 10 HD2 PHE 10 42.139 25.527 -9.580 69 HE1 PHE 10 HE1 PHE 10 40.672 21.508 -11.989 70 HE2 PHE 10 HE2 PHE 10 42.353 25.415 -12.019 71 HZ PHE 10 HZ PHE 10 41.619 23.403 -13.229 72 H GLN 11 HN GLN 11 44.403 22.426 -8.631 73 HA GLN 11 HA GLN 11 45.621 25.121 -8.911 74 1HB GLN 11 HB2 GLN 11 46.968 22.511 -8.046 75 2HB GLN 11 HB1 GLN 11 47.888 23.774 -8.819 76 1HG GLN 11 HG2 GLN 11 48.207 23.922 -6.415 77 2HG GLN 11 HG1 GLN 11 47.334 25.330 -6.958 78 1HE2 GLN 11 HE21 GLN 11 46.869 22.208 -5.255 79 2HE2 GLN 11 HE22 GLN 11 45.518 22.731 -4.379 80 H THR 12 HN THR 12 46.919 25.294 -10.690 81 HA THR 12 HA THR 12 45.776 23.938 -12.992 82 HB THR 12 HB THR 12 48.007 26.066 -12.810 83 HG1 THR 12 HG1 THR 12 45.973 26.587 -11.876 84 1HG2 THR 12 HG21 THR 12 47.270 26.603 -15.098 85 2HG2 THR 12 HG22 THR 12 46.003 25.384 -15.021 86 3HG2 THR 12 HG23 THR 12 47.692 24.895 -15.091 87 H CYS 13 HN CYS 13 48.695 23.675 -11.107 88 HA CYS 13 HA CYS 13 49.654 21.601 -13.025 89 1HB CYS 13 HB2 CYS 13 51.137 23.507 -12.915 90 2HB CYS 13 HB1 CYS 13 51.380 23.300 -11.192 91 H ALA 14 HN ALA 14 49.298 19.814 -12.325 92 HA ALA 14 HA ALA 14 50.064 18.949 -9.616 93 1HB ALA 14 HB1 ALA 14 47.717 19.675 -9.509 94 2HB ALA 14 HB2 ALA 14 47.781 17.931 -9.312 95 3HB ALA 14 HB3 ALA 14 47.304 18.629 -10.852 96 H SER 15 HN SER 15 49.125 16.337 -9.741 97 HA SER 15 HA SER 15 49.662 15.020 -12.244 98 1HB SER 15 HB2 SER 15 52.032 15.859 -11.712 99 2HB SER 15 HB1 SER 15 51.948 14.894 -10.237 100 HG SER 15 HG SER 15 51.373 13.803 -12.765 101 H SER 16 HN SER 16 50.375 12.605 -11.638 102 HA SER 16 HA SER 16 48.435 11.673 -9.604 103 1HB SER 16 HB2 SER 16 49.946 10.169 -11.808 104 2HB SER 16 HB1 SER 16 48.694 9.465 -10.770 105 HG SER 16 HG SER 16 48.434 11.722 -12.468 106 H CYS 17 HN CYS 17 51.444 12.653 -9.532 107 HA CYS 17 HA CYS 17 52.528 10.561 -7.707 108 1HB CYS 17 HB2 CYS 17 54.755 11.595 -8.429 109 2HB CYS 17 HB1 CYS 17 53.899 10.576 -9.542 110 HA PRO 18 HA PRO 18 51.250 14.326 -5.335 111 1HB PRO 18 HB2 PRO 18 50.792 13.027 -2.954 112 2HB PRO 18 HB1 PRO 18 49.618 13.197 -4.235 113 1HG PRO 18 HG2 PRO 18 51.427 10.892 -3.664 114 2HG PRO 18 HG1 PRO 18 49.703 10.887 -4.085 115 1HD PRO 18 HD2 PRO 18 51.539 10.315 -5.892 116 2HD PRO 18 HD1 PRO 18 50.119 11.283 -6.339 117 H LYS 19 HN LYS 19 52.210 15.688 -4.079 118 HA LYS 19 HA LYS 19 54.933 15.069 -3.096 119 1HB LYS 19 HB2 LYS 19 54.618 17.161 -4.467 120 2HB LYS 19 HB1 LYS 19 53.411 17.722 -3.323 121 1HG LYS 19 HG2 LYS 19 55.287 17.628 -1.536 122 2HG LYS 19 HG1 LYS 19 56.380 17.219 -2.820 123 1HD LYS 19 HD2 LYS 19 56.532 19.607 -2.327 124 2HD LYS 19 HD1 LYS 19 55.991 19.341 -3.966 125 1HE LYS 19 HE2 LYS 19 53.601 19.768 -3.204 126 2HE LYS 19 HE1 LYS 19 54.211 20.086 -1.592 127 1HZ LYS 19 HZ1 LYS 19 53.842 21.972 -3.304 128 2HZ LYS 19 HZ2 LYS 19 55.405 21.531 -3.796 129 3HZ LYS 19 HZ3 LYS 19 55.129 22.018 -2.193 130 H THR 20 HN THR 20 54.603 13.982 -1.295 131 HA THR 20 HA THR 20 52.750 15.067 0.773 132 HB THR 20 HB THR 20 52.834 12.818 1.745 133 HG1 THR 20 HG1 THR 20 54.994 12.403 1.346 134 1HG2 THR 20 HG21 THR 20 52.896 12.480 -1.341 135 2HG2 THR 20 HG22 THR 20 51.446 12.986 -0.536 136 3HG2 THR 20 HG23 THR 20 52.086 11.403 -0.231 137 H CYS 21 HN CYS 21 53.670 14.329 3.051 138 HA CYS 21 HA CYS 21 55.798 16.082 3.690 139 1HB CYS 21 HB2 CYS 21 54.767 13.660 5.175 140 2HB CYS 21 HB1 CYS 21 55.834 14.848 5.867 141 H GLU 22 HN GLU 22 55.770 12.855 2.581 142 HA GLU 22 HA GLU 22 58.324 11.920 3.391 143 1HB GLU 22 HB2 GLU 22 56.525 10.517 2.385 144 2HB GLU 22 HB1 GLU 22 56.757 11.331 0.847 145 1HG GLU 22 HG2 GLU 22 59.079 10.461 0.704 146 2HG GLU 22 HG1 GLU 22 58.893 9.679 2.267 147 H THR 23 HN THR 23 57.332 13.644 0.419 148 HA THR 23 HA THR 23 60.181 14.062 -0.342 149 HB THR 23 HB THR 23 58.857 13.184 -2.094 150 HG1 THR 23 HG1 THR 23 60.148 14.701 -2.868 151 1HG2 THR 23 HG21 THR 23 56.833 15.450 -1.787 152 2HG2 THR 23 HG22 THR 23 56.545 13.783 -1.334 153 3HG2 THR 23 HG23 THR 23 56.853 14.201 -3.007 154 H ARG 24 HN ARG 24 57.374 16.335 -0.485 155 HA ARG 24 HA ARG 24 57.229 18.576 0.079 156 1HB ARG 24 HB2 ARG 24 59.712 18.027 1.786 157 2HB ARG 24 HB1 ARG 24 58.740 19.468 1.830 158 1HG ARG 24 HG2 ARG 24 56.771 18.195 2.507 159 2HG ARG 24 HG1 ARG 24 57.639 16.682 2.340 160 1HD ARG 24 HD2 ARG 24 58.309 18.880 4.336 161 2HD ARG 24 HD1 ARG 24 57.417 17.422 4.734 162 HE ARG 24 HE ARG 24 59.480 16.159 3.945 163 1HH1 ARG 24 HH11 ARG 24 59.711 19.406 5.218 164 2HH1 ARG 24 HH12 ARG 24 61.345 19.175 5.731 165 1HH2 ARG 24 HH21 ARG 24 61.531 15.892 4.601 166 2HH2 ARG 24 HH22 ARG 24 62.385 17.178 5.386 167 H ASN 25 HN ASN 25 59.942 17.359 -1.304 168 HA ASN 25 HA ASN 25 61.675 19.415 -1.741 169 1HB ASN 25 HB2 ASN 25 60.940 17.007 -3.425 170 2HB ASN 25 HB1 ASN 25 62.375 17.968 -3.683 171 1HD2 ASN 25 HD21 ASN 25 61.248 15.270 -2.029 172 2HD2 ASN 25 HD22 ASN 25 62.472 15.165 -0.859 173 H LYS 26 HN LYS 26 58.580 19.280 -3.417 174 HA LYS 26 HA LYS 26 59.614 21.393 -5.273 175 1HB LYS 26 HB2 LYS 26 57.161 19.636 -5.773 176 2HB LYS 26 HB1 LYS 26 57.918 20.739 -6.883 177 1HG LYS 26 HG2 LYS 26 58.642 18.639 -7.632 178 2HG LYS 26 HG1 LYS 26 60.014 19.324 -6.810 179 1HD LYS 26 HD2 LYS 26 59.777 16.948 -6.262 180 2HD LYS 26 HD1 LYS 26 59.526 17.867 -4.807 181 1HE LYS 26 HE2 LYS 26 57.030 17.685 -5.156 182 2HE LYS 26 HE1 LYS 26 57.340 16.739 -6.604 183 1HZ LYS 26 HZ1 LYS 26 57.698 16.036 -3.799 184 2HZ LYS 26 HZ2 LYS 26 58.736 15.330 -4.943 185 3HZ LYS 26 HZ3 LYS 26 57.054 15.123 -5.078 186 H LEU 27 HN LEU 27 57.310 22.361 -6.142 187 HA LEU 27 HA LEU 27 55.864 23.439 -3.775 188 1HB LEU 27 HB2 LEU 27 56.797 24.996 -6.242 189 2HB LEU 27 HB1 LEU 27 55.844 25.683 -4.943 190 HG LEU 27 HG LEU 27 58.666 24.540 -4.609 191 1HD1 LEU 27 HD11 LEU 27 58.621 26.663 -5.909 192 2HD1 LEU 27 HD12 LEU 27 59.325 26.920 -4.323 193 3HD1 LEU 27 HD13 LEU 27 57.674 27.427 -4.643 194 1HD2 LEU 27 HD21 LEU 27 56.905 26.097 -2.649 195 2HD2 LEU 27 HD22 LEU 27 58.552 25.570 -2.347 196 3HD2 LEU 27 HD23 LEU 27 57.271 24.388 -2.513 197 H VAL 28 HN VAL 28 55.266 21.461 -5.473 198 HA VAL 28 HA VAL 28 52.424 21.927 -6.054 199 HB VAL 28 HB VAL 28 52.489 21.130 -8.405 200 1HG1 VAL 28 HG11 VAL 28 53.383 23.136 -9.533 201 2HG1 VAL 28 HG12 VAL 28 54.234 23.607 -8.076 202 3HG1 VAL 28 HG13 VAL 28 52.475 23.576 -8.098 203 1HG2 VAL 28 HG21 VAL 28 54.556 19.864 -8.342 204 2HG2 VAL 28 HG22 VAL 28 55.511 21.329 -8.179 205 3HG2 VAL 28 HG23 VAL 28 54.620 21.011 -9.663 206 H LEU 29 HN LEU 29 51.429 19.944 -6.845 207 HA LEU 29 HA LEU 29 51.851 17.848 -5.108 208 1HB LEU 29 HB2 LEU 29 49.799 18.349 -6.366 209 2HB LEU 29 HB1 LEU 29 50.595 17.944 -7.856 210 HG LEU 29 HG LEU 29 50.078 15.925 -5.599 211 1HD1 LEU 29 HD11 LEU 29 48.403 16.429 -8.088 212 2HD1 LEU 29 HD12 LEU 29 47.936 16.815 -6.444 213 3HD1 LEU 29 HD13 LEU 29 48.142 15.143 -6.925 214 1HD2 LEU 29 HD21 LEU 29 50.316 14.221 -7.428 215 2HD2 LEU 29 HD22 LEU 29 51.771 15.155 -7.380 216 3HD2 LEU 29 HD23 LEU 29 50.586 15.506 -8.592 217 H CYS 30 HN CYS 30 53.403 18.329 -8.094 218 HA CYS 30 HA CYS 30 55.348 16.187 -7.443 219 1HB CYS 30 HB2 CYS 30 53.410 15.080 -8.639 220 2HB CYS 30 HB1 CYS 30 53.769 16.065 -10.021 221 H ASP 31 HN ASP 31 55.492 16.614 -10.739 222 HA ASP 31 HA ASP 31 56.625 19.213 -11.020 223 1HB ASP 31 HB2 ASP 31 58.449 18.346 -9.585 224 2HB ASP 31 HB1 ASP 31 58.646 16.951 -10.620 225 H LYS 32 HN LYS 32 57.024 15.935 -12.053 226 HA LYS 32 HA LYS 32 57.671 16.499 -14.805 227 1HB LYS 32 HB2 LYS 32 56.612 13.927 -13.562 228 2HB LYS 32 HB1 LYS 32 57.441 14.050 -15.100 229 1HG LYS 32 HG2 LYS 32 58.641 14.700 -12.371 230 2HG LYS 32 HG1 LYS 32 58.983 13.281 -13.331 231 1HD LYS 32 HD2 LYS 32 59.980 14.687 -15.120 232 2HD LYS 32 HD1 LYS 32 59.633 16.139 -14.197 233 1HE LYS 32 HE2 LYS 32 61.444 13.885 -13.256 234 2HE LYS 32 HE1 LYS 32 61.978 15.447 -13.862 235 1HZ LYS 32 HZ1 LYS 32 61.812 16.197 -11.818 236 2HZ LYS 32 HZ2 LYS 32 61.114 14.748 -11.271 237 3HZ LYS 32 HZ3 LYS 32 60.130 15.986 -11.888 238 H LYS 33 HN LYS 33 54.829 17.153 -13.437 239 HA LYS 33 HA LYS 33 53.418 17.171 -15.981 240 1HB LYS 33 HB2 LYS 33 53.071 14.802 -15.252 241 2HB LYS 33 HB1 LYS 33 52.445 15.366 -13.727 242 1HG LYS 33 HG2 LYS 33 50.603 14.709 -15.182 243 2HG LYS 33 HG1 LYS 33 50.520 16.430 -14.908 244 1HD LYS 33 HD2 LYS 33 51.665 16.826 -17.134 245 2HD LYS 33 HD1 LYS 33 51.739 15.095 -17.381 246 1HE LYS 33 HE2 LYS 33 49.176 16.718 -17.086 247 2HE LYS 33 HE1 LYS 33 49.833 16.112 -18.598 248 1HZ LYS 33 HZ1 LYS 33 49.587 13.874 -17.813 249 2HZ LYS 33 HZ2 LYS 33 48.100 14.688 -17.710 250 3HZ LYS 33 HZ3 LYS 33 49.018 14.418 -16.309 251 H CYS 34 HN CYS 34 51.409 18.214 -15.896 252 HA CYS 34 HA CYS 34 50.819 19.767 -13.454 253 1HB CYS 34 HB2 CYS 34 51.351 20.855 -16.153 254 2HB CYS 34 HB1 CYS 34 50.458 21.757 -14.965 255 H ASN 35 HN ASN 35 49.172 18.307 -13.421 256 HA ASN 35 HA ASN 35 46.897 18.367 -15.259 257 1HB ASN 35 HB2 ASN 35 46.973 17.310 -12.385 258 2HB ASN 35 HB1 ASN 35 45.711 17.001 -13.556 259 1HD2 ASN 35 HD21 ASN 35 47.091 14.963 -12.228 260 2HD2 ASN 35 HD22 ASN 35 47.998 14.069 -13.342 261 H GLN 36 HN GLN 36 44.961 19.428 -14.942 262 HA GLN 36 HA GLN 36 44.928 21.675 -12.931 263 1HB GLN 36 HB2 GLN 36 43.319 21.276 -15.533 264 2HB GLN 36 HB1 GLN 36 43.291 22.714 -14.529 265 1HG GLN 36 HG2 GLN 36 45.693 23.114 -15.022 266 2HG GLN 36 HG1 GLN 36 45.743 21.667 -16.017 267 1HE2 GLN 36 HE21 GLN 36 44.799 21.765 -18.123 268 2HE2 GLN 36 HE22 GLN 36 44.208 23.209 -18.793 269 H ARG 37 HN ARG 37 44.469 20.221 -11.414 270 HA ARG 37 HA ARG 37 41.614 19.785 -10.960 271 1HB ARG 37 HB2 ARG 37 41.837 17.326 -10.561 272 2HB ARG 37 HB1 ARG 37 42.233 17.727 -12.200 273 1HG ARG 37 HG2 ARG 37 44.667 17.655 -11.665 274 2HG ARG 37 HG1 ARG 37 44.292 17.262 -9.996 275 1HD ARG 37 HD2 ARG 37 43.113 15.205 -10.725 276 2HD ARG 37 HD1 ARG 37 43.494 15.572 -12.407 277 HE ARG 37 HE ARG 37 45.964 15.585 -11.172 278 1HH1 ARG 37 HH11 ARG 37 43.311 13.357 -11.350 279 2HH1 ARG 37 HH12 ARG 37 44.325 11.963 -11.203 280 1HH2 ARG 37 HH21 ARG 37 47.260 13.832 -10.994 281 2HH2 ARG 37 HH22 ARG 37 46.595 12.231 -10.992 282 H CYS 38 HN CYS 38 42.172 17.905 -8.805 283 HA CYS 38 HA CYS 38 42.949 19.882 -6.812 284 1HB CYS 38 HB2 CYS 38 41.186 18.231 -6.315 285 2HB CYS 38 HB1 CYS 38 42.358 16.930 -6.436 286 H GLY 39 HN GLY 39 44.524 19.704 -5.295 287 1HA GLY 39 HA2 GLY 39 46.701 17.857 -5.168 288 2HA GLY 39 HA1 GLY 39 47.191 19.279 -6.113 289 H CYS 40 HN CYS 40 48.447 18.833 -3.623 290 HA CYS 40 HA CYS 40 47.120 20.064 -1.435 291 1HB CYS 40 HB2 CYS 40 50.083 19.900 -2.056 292 2HB CYS 40 HB1 CYS 40 49.441 20.505 -0.561 293 H ILE 41 HN ILE 41 47.550 22.037 -0.471 294 HA ILE 41 HA ILE 41 47.196 24.284 -2.250 295 HB ILE 41 HB ILE 41 47.933 24.391 0.709 296 1HG1 ILE 41 HG12 ILE 41 45.164 24.131 -0.611 297 2HG1 ILE 41 HG11 ILE 41 45.940 22.828 0.256 298 1HG2 ILE 41 HG21 ILE 41 46.339 26.299 -1.053 299 2HG2 ILE 41 HG22 ILE 41 47.964 26.585 -0.456 300 3HG2 ILE 41 HG23 ILE 41 46.635 26.523 0.663 301 1HD1 ILE 41 HD11 ILE 41 45.879 24.146 2.350 302 2HD1 ILE 41 HD12 ILE 41 44.273 23.900 1.685 303 3HD1 ILE 41 HD13 ILE 41 45.060 25.455 1.512 304 H SER 42 HN SER 42 48.572 26.170 -2.176 305 HA SER 42 HA SER 42 51.308 25.512 -2.877 306 1HB SER 42 HB2 SER 42 51.473 28.035 -3.286 307 2HB SER 42 HB1 SER 42 50.052 27.329 -4.066 308 HG SER 42 HG SER 42 50.242 28.861 -1.734 309 H GLY 43 HN GLY 43 52.328 24.724 -1.182 310 1HA GLY 43 HA2 GLY 43 54.087 25.559 0.411 311 2HA GLY 43 HA1 GLY 43 52.812 26.490 1.192 312 H THR 44 HN THR 44 51.635 23.524 0.113 313 HA THR 44 HA THR 44 52.195 22.189 2.723 314 HB THR 44 HB THR 44 49.804 21.427 2.847 315 HG1 THR 44 HG1 THR 44 49.917 22.129 0.298 316 1HG2 THR 44 HG21 THR 44 49.936 24.430 2.284 317 2HG2 THR 44 HG22 THR 44 50.337 23.692 3.829 318 3HG2 THR 44 HG23 THR 44 48.695 23.594 3.205 319 H VAL 45 HN VAL 45 51.765 20.034 2.782 320 HA VAL 45 HA VAL 45 51.970 18.479 0.263 321 HB VAL 45 HB VAL 45 53.678 17.012 1.411 322 1HG1 VAL 45 HG11 VAL 45 54.439 19.917 1.037 323 2HG1 VAL 45 HG12 VAL 45 54.287 18.681 -0.209 324 3HG1 VAL 45 HG13 VAL 45 55.521 18.530 1.021 325 1HG2 VAL 45 HG21 VAL 45 54.914 17.965 3.359 326 2HG2 VAL 45 HG22 VAL 45 53.236 17.749 3.785 327 3HG2 VAL 45 HG23 VAL 45 53.847 19.345 3.379 328 H LEU 46 HN LEU 46 51.009 16.500 0.323 329 HA LEU 46 HA LEU 46 48.853 16.073 2.086 330 1HB LEU 46 HB2 LEU 46 49.359 14.962 -0.202 331 2HB LEU 46 HB1 LEU 46 50.461 13.951 0.707 332 HG LEU 46 HG LEU 46 48.645 13.015 2.044 333 1HD1 LEU 46 HD11 LEU 46 47.100 15.012 2.002 334 2HD1 LEU 46 HD12 LEU 46 46.270 13.579 1.453 335 3HD1 LEU 46 HD13 LEU 46 46.839 14.752 0.286 336 1HD2 LEU 46 HD21 LEU 46 48.097 12.939 -0.960 337 2HD2 LEU 46 HD22 LEU 46 47.525 11.755 0.198 338 3HD2 LEU 46 HD23 LEU 46 49.245 11.921 -0.108 339 H LYS 47 HN LYS 47 48.782 15.330 4.080 340 HA LYS 47 HA LYS 47 50.827 15.232 5.901 341 1HB LYS 47 HB2 LYS 47 48.494 15.246 6.568 342 2HB LYS 47 HB1 LYS 47 48.245 13.641 5.911 343 1HG LYS 47 HG2 LYS 47 49.763 12.674 7.572 344 2HG LYS 47 HG1 LYS 47 50.207 14.261 8.156 345 1HD LYS 47 HD2 LYS 47 48.591 13.157 9.681 346 2HD LYS 47 HD1 LYS 47 47.885 14.600 8.986 347 1HE LYS 47 HE2 LYS 47 46.302 12.673 8.992 348 2HE LYS 47 HE1 LYS 47 46.617 13.241 7.365 349 1HZ LYS 47 HZ1 LYS 47 48.129 11.447 7.019 350 2HZ LYS 47 HZ2 LYS 47 46.693 10.796 7.649 351 3HZ LYS 47 HZ3 LYS 47 48.052 10.982 8.651 352 H SER 48 HN SER 48 49.830 12.496 3.936 353 HA SER 48 HA SER 48 52.359 11.108 4.672 354 1HB SER 48 HB2 SER 48 49.588 9.756 4.728 355 2HB SER 48 HB1 SER 48 51.133 8.958 5.047 356 HG SER 48 HG SER 48 49.912 11.051 6.491 357 H LYS 49 HN LYS 49 52.448 9.048 3.293 358 HA LYS 49 HA LYS 49 52.851 9.765 0.628 359 1HB LYS 49 HB2 LYS 49 52.312 7.014 1.797 360 2HB LYS 49 HB1 LYS 49 52.824 7.270 0.149 361 1HG LYS 49 HG2 LYS 49 54.785 6.726 1.491 362 2HG LYS 49 HG1 LYS 49 54.902 8.366 0.916 363 1HD LYS 49 HD2 LYS 49 55.674 8.178 3.241 364 2HD LYS 49 HD1 LYS 49 54.305 9.247 3.154 365 1HE LYS 49 HE2 LYS 49 54.096 7.686 5.074 366 2HE LYS 49 HE1 LYS 49 52.831 7.311 3.917 367 1HZ LYS 49 HZ1 LYS 49 55.446 5.934 3.940 368 2HZ LYS 49 HZ2 LYS 49 54.032 5.481 3.114 369 3HZ LYS 49 HZ3 LYS 49 54.095 5.382 4.809 370 H ASP 50 HN ASP 50 49.893 8.984 2.178 371 HA ASP 50 HA ASP 50 48.372 9.602 -0.215 372 1HB ASP 50 HB2 ASP 50 48.980 7.190 -0.625 373 2HB ASP 50 HB1 ASP 50 48.255 6.752 0.908 374 H SER 51 HN SER 51 48.343 10.947 2.175 375 HA SER 51 HA SER 51 46.144 10.025 3.887 376 1HB SER 51 HB2 SER 51 48.143 11.360 4.739 377 2HB SER 51 HB1 SER 51 47.556 12.748 3.814 378 HG SER 51 HG SER 51 46.034 13.017 5.202 379 H SER 52 HN SER 52 44.935 12.688 4.159 380 HA SER 52 HA SER 52 43.563 13.079 1.541 381 1HB SER 52 HB2 SER 52 41.360 13.138 2.770 382 2HB SER 52 HB1 SER 52 42.153 11.567 2.963 383 HG SER 52 HG SER 52 43.144 12.504 4.879 384 H GLU 53 HN GLU 53 45.104 14.445 4.155 385 HA GLU 53 HA GLU 53 44.171 17.187 3.415 386 1HB GLU 53 HB2 GLU 53 44.674 16.166 6.249 387 2HB GLU 53 HB1 GLU 53 44.267 17.819 5.824 388 1HG GLU 53 HG2 GLU 53 42.080 17.049 4.907 389 2HG GLU 53 HG1 GLU 53 42.482 15.392 5.317 390 H CYS 54 HN CYS 54 45.787 18.597 3.122 391 HA CYS 54 HA CYS 54 48.551 17.588 3.501 392 1HB CYS 54 HB2 CYS 54 47.675 20.093 2.047 393 2HB CYS 54 HB1 CYS 54 49.219 19.324 1.970 394 H VAL 55 HN VAL 55 50.055 18.630 4.562 395 HA VAL 55 HA VAL 55 49.453 20.977 6.281 396 HB VAL 55 HB VAL 55 50.923 19.799 8.025 397 1HG1 VAL 55 HG11 VAL 55 49.113 18.201 8.753 398 2HG1 VAL 55 HG12 VAL 55 48.410 18.248 7.145 399 3HG1 VAL 55 HG13 VAL 55 48.385 19.682 8.157 400 1HG2 VAL 55 HG21 VAL 55 52.078 18.247 6.506 401 2HG2 VAL 55 HG22 VAL 55 50.572 17.406 6.186 402 3HG2 VAL 55 HG23 VAL 55 51.277 17.366 7.793 403 H HIS 56 HN HIS 56 51.285 22.320 6.648 404 HA HIS 56 HA HIS 56 53.061 22.608 4.466 405 1HB HIS 56 HB2 HIS 56 53.370 23.636 7.312 406 2HB HIS 56 HB1 HIS 56 54.275 24.238 5.937 407 HD1 HIS 56 HD1 HIS 56 53.005 25.827 4.407 408 HD2 HIS 56 HD2 HIS 56 50.528 24.220 7.225 409 HE1 HIS 56 HE1 HIS 56 50.879 27.067 4.251 410 HA PRO 57 HA PRO 57 56.550 19.917 5.249 411 1HB PRO 57 HB2 PRO 57 58.622 21.737 4.778 412 2HB PRO 57 HB1 PRO 57 57.801 20.836 3.530 413 1HG PRO 57 HG2 PRO 57 57.300 23.631 4.445 414 2HG PRO 57 HG1 PRO 57 57.333 22.976 2.798 415 1HD PRO 57 HD2 PRO 57 55.042 23.499 4.017 416 2HD PRO 57 HD1 PRO 57 55.198 22.065 2.982 417 H SER 58 HN SER 58 56.231 23.058 6.632 418 HA SER 58 HA SER 58 57.819 22.322 9.045 419 1HB SER 58 HB2 SER 58 57.766 24.858 9.451 420 2HB SER 58 HB1 SER 58 58.406 24.517 7.837 421 HG SER 58 HG SER 58 56.188 24.649 7.103 422 H LYS 59 HN LYS 59 55.632 21.024 8.693 423 HA LYS 59 HA LYS 59 54.104 21.739 11.086 424 1HB LYS 59 HB2 LYS 59 52.966 22.995 9.257 425 2HB LYS 59 HB1 LYS 59 52.734 21.495 8.366 426 1HG LYS 59 HG2 LYS 59 51.464 20.589 10.263 427 2HG LYS 59 HG1 LYS 59 51.727 22.096 11.135 428 1HD LYS 59 HD2 LYS 59 50.484 23.346 9.383 429 2HD LYS 59 HD1 LYS 59 50.256 21.875 8.455 430 1HE LYS 59 HE2 LYS 59 48.946 20.903 10.350 431 2HE LYS 59 HE1 LYS 59 49.164 22.397 11.253 432 1HZ LYS 59 HZ1 LYS 59 47.211 22.868 10.295 433 2HZ LYS 59 HZ2 LYS 59 47.467 21.838 8.968 434 3HZ LYS 59 HZ3 LYS 59 48.197 23.370 9.007 435 H CYS 60 HN CYS 60 54.573 19.540 8.360 436 HA CYS 60 HA CYS 60 53.151 17.300 9.049 437 1HB CYS 60 HB2 CYS 60 55.976 17.484 8.023 438 2HB CYS 60 HB1 CYS 60 55.088 15.987 8.054 Start of MODEL 13 1 1H ASN 1 HT1 ASN 1 30.834 18.280 -9.930 2 2H ASN 1 HT2 ASN 1 29.734 19.372 -9.237 3 3H ASN 1 HT3 ASN 1 30.582 18.279 -8.251 4 HA ASN 1 HA ASN 1 31.861 20.399 -9.872 5 1HB ASN 1 HB2 ASN 1 30.453 21.369 -8.035 6 2HB ASN 1 HB1 ASN 1 31.261 20.333 -6.869 7 1HD2 ASN 1 HD21 ASN 1 31.515 23.289 -8.683 8 2HD2 ASN 1 HD22 ASN 1 33.037 23.761 -8.099 9 H PHE 2 HN PHE 2 34.046 20.375 -9.757 10 HA PHE 2 HA PHE 2 35.328 17.927 -8.747 11 1HB PHE 2 HB2 PHE 2 35.926 18.823 -11.018 12 2HB PHE 2 HB1 PHE 2 36.506 20.311 -10.280 13 HD1 PHE 2 HD1 PHE 2 38.707 20.394 -9.303 14 HD2 PHE 2 HD2 PHE 2 37.028 16.621 -10.359 15 HE1 PHE 2 HE1 PHE 2 40.853 19.313 -8.855 16 HE2 PHE 2 HE2 PHE 2 39.183 15.541 -9.913 17 HZ PHE 2 HZ PHE 2 41.095 16.876 -9.160 18 H VAL 3 HN VAL 3 35.063 18.259 -6.600 19 HA VAL 3 HA VAL 3 36.712 20.408 -5.294 20 HB VAL 3 HB VAL 3 34.255 20.576 -4.883 21 1HG1 VAL 3 HG11 VAL 3 33.078 18.844 -3.561 22 2HG1 VAL 3 HG12 VAL 3 34.499 17.816 -3.615 23 3HG1 VAL 3 HG13 VAL 3 33.631 18.194 -5.094 24 1HG2 VAL 3 HG21 VAL 3 34.338 20.676 -2.410 25 2HG2 VAL 3 HG22 VAL 3 35.788 21.357 -3.126 26 3HG2 VAL 3 HG23 VAL 3 35.830 19.755 -2.413 27 H CYS 4 HN CYS 4 38.073 19.941 -3.817 28 HA CYS 4 HA CYS 4 39.231 17.263 -3.655 29 1HB CYS 4 HB2 CYS 4 39.791 19.865 -2.338 30 2HB CYS 4 HB1 CYS 4 40.840 18.495 -2.145 31 HA PRO 5 HA PRO 5 37.835 16.930 0.764 32 1HB PRO 5 HB2 PRO 5 40.228 15.754 1.752 33 2HB PRO 5 HB1 PRO 5 38.753 14.944 1.341 34 1HG PRO 5 HG2 PRO 5 41.129 14.616 -0.055 35 2HG PRO 5 HG1 PRO 5 39.520 14.240 -0.694 36 1HD PRO 5 HD2 PRO 5 41.201 16.679 -1.114 37 2HD PRO 5 HD1 PRO 5 40.213 15.805 -2.284 38 HA PRO 6 HA PRO 6 39.598 20.150 3.322 39 1HB PRO 6 HB2 PRO 6 40.435 18.691 5.554 40 2HB PRO 6 HB1 PRO 6 38.814 19.288 5.277 41 1HG PRO 6 HG2 PRO 6 39.916 16.571 4.575 42 2HG PRO 6 HG1 PRO 6 38.404 16.955 5.415 43 1HD PRO 6 HD2 PRO 6 38.286 16.351 2.945 44 2HD PRO 6 HD1 PRO 6 37.436 17.821 3.434 45 H GLY 7 HN GLY 7 41.488 21.144 3.450 46 1HA GLY 7 HA2 GLY 7 43.821 21.446 3.747 47 2HA GLY 7 HA1 GLY 7 44.030 19.707 3.763 48 H GLN 8 HN GLN 8 42.468 19.533 1.160 49 HA GLN 8 HA GLN 8 44.680 20.316 -0.650 50 1HB GLN 8 HB2 GLN 8 42.480 18.249 -1.034 51 2HB GLN 8 HB1 GLN 8 43.770 18.560 -2.171 52 1HG GLN 8 HG2 GLN 8 44.288 16.518 -0.986 53 2HG GLN 8 HG1 GLN 8 45.406 17.738 -0.421 54 1HE2 GLN 8 HE21 GLN 8 42.397 16.012 0.447 55 2HE2 GLN 8 HE22 GLN 8 42.543 16.250 2.117 56 H THR 9 HN THR 9 44.159 21.223 -2.583 57 HA THR 9 HA THR 9 41.418 22.274 -3.039 58 HB THR 9 HB THR 9 42.623 24.024 -1.743 59 HG1 THR 9 HG1 THR 9 42.523 25.639 -3.350 60 1HG2 THR 9 HG21 THR 9 44.976 23.306 -2.450 61 2HG2 THR 9 HG22 THR 9 44.697 25.030 -2.668 62 3HG2 THR 9 HG23 THR 9 44.645 23.938 -4.044 63 H PHE 10 HN PHE 10 41.863 23.727 -5.259 64 HA PHE 10 HA PHE 10 42.338 21.706 -7.253 65 1HB PHE 10 HB2 PHE 10 40.908 23.811 -7.535 66 2HB PHE 10 HB1 PHE 10 42.402 24.730 -7.693 67 HD1 PHE 10 HD1 PHE 10 43.507 24.809 -9.855 68 HD2 PHE 10 HD2 PHE 10 40.538 21.848 -9.073 69 HE1 PHE 10 HE1 PHE 10 43.548 24.128 -12.215 70 HE2 PHE 10 HE2 PHE 10 40.585 21.175 -11.427 71 HZ PHE 10 HZ PHE 10 42.072 22.311 -12.992 72 H GLN 11 HN GLN 11 44.079 22.180 -9.066 73 HA GLN 11 HA GLN 11 46.551 23.437 -8.188 74 1HB GLN 11 HB2 GLN 11 46.320 21.133 -6.903 75 2HB GLN 11 HB1 GLN 11 46.533 20.384 -8.461 76 1HG GLN 11 HG2 GLN 11 48.656 20.400 -7.366 77 2HG GLN 11 HG1 GLN 11 48.742 21.570 -8.676 78 1HE2 GLN 11 HE21 GLN 11 47.227 22.048 -5.355 79 2HE2 GLN 11 HE22 GLN 11 48.309 23.248 -4.941 80 H THR 12 HN THR 12 47.198 24.254 -10.140 81 HA THR 12 HA THR 12 46.173 23.099 -12.621 82 HB THR 12 HB THR 12 46.328 25.564 -12.402 83 HG1 THR 12 HG1 THR 12 46.574 25.172 -14.446 84 1HG2 THR 12 HG21 THR 12 48.492 26.713 -12.456 85 2HG2 THR 12 HG22 THR 12 49.373 25.201 -12.459 86 3HG2 THR 12 HG23 THR 12 48.486 25.695 -11.023 87 H CYS 13 HN CYS 13 49.474 23.615 -11.306 88 HA CYS 13 HA CYS 13 50.410 21.520 -13.186 89 1HB CYS 13 HB2 CYS 13 51.823 23.860 -12.008 90 2HB CYS 13 HB1 CYS 13 52.740 22.483 -12.567 91 H ALA 14 HN ALA 14 50.055 19.800 -12.197 92 HA ALA 14 HA ALA 14 51.932 18.750 -10.249 93 1HB ALA 14 HB1 ALA 14 50.168 19.772 -8.765 94 2HB ALA 14 HB2 ALA 14 50.143 18.023 -8.640 95 3HB ALA 14 HB3 ALA 14 48.927 18.849 -9.606 96 H SER 15 HN SER 15 49.803 16.562 -9.907 97 HA SER 15 HA SER 15 49.003 15.679 -12.487 98 1HB SER 15 HB2 SER 15 51.571 15.369 -12.703 99 2HB SER 15 HB1 SER 15 51.438 14.211 -11.382 100 HG SER 15 HG SER 15 50.529 12.828 -12.645 101 H SER 16 HN SER 16 49.203 12.835 -11.920 102 HA SER 16 HA SER 16 47.030 12.524 -10.139 103 1HB SER 16 HB2 SER 16 47.629 10.810 -11.870 104 2HB SER 16 HB1 SER 16 49.117 10.436 -10.987 105 HG SER 16 HG SER 16 46.522 10.359 -9.852 106 H CYS 17 HN CYS 17 50.224 13.166 -9.692 107 HA CYS 17 HA CYS 17 50.496 12.334 -6.874 108 1HB CYS 17 HB2 CYS 17 53.020 12.645 -7.601 109 2HB CYS 17 HB1 CYS 17 52.125 11.256 -8.112 110 HA PRO 18 HA PRO 18 50.179 16.914 -5.889 111 1HB PRO 18 HB2 PRO 18 48.863 15.249 -3.789 112 2HB PRO 18 HB1 PRO 18 48.464 16.854 -4.312 113 1HG PRO 18 HG2 PRO 18 46.962 14.931 -5.151 114 2HG PRO 18 HG1 PRO 18 47.562 16.067 -6.383 115 1HD PRO 18 HD2 PRO 18 48.636 13.341 -5.683 116 2HD PRO 18 HD1 PRO 18 48.238 14.042 -7.271 117 H LYS 19 HN LYS 19 51.897 17.638 -4.661 118 HA LYS 19 HA LYS 19 53.828 16.030 -3.362 119 1HB LYS 19 HB2 LYS 19 54.595 17.994 -2.193 120 2HB LYS 19 HB1 LYS 19 54.294 18.385 -3.847 121 1HG LYS 19 HG2 LYS 19 52.514 19.075 -1.506 122 2HG LYS 19 HG1 LYS 19 53.589 20.171 -2.333 123 1HD LYS 19 HD2 LYS 19 52.165 19.626 -4.469 124 2HD LYS 19 HD1 LYS 19 51.034 18.902 -3.344 125 1HE LYS 19 HE2 LYS 19 50.871 20.969 -2.053 126 2HE LYS 19 HE1 LYS 19 52.039 21.728 -3.110 127 1HZ LYS 19 HZ1 LYS 19 49.872 22.352 -3.808 128 2HZ LYS 19 HZ2 LYS 19 49.359 20.733 -3.878 129 3HZ LYS 19 HZ3 LYS 19 50.519 21.305 -4.980 130 H THR 20 HN THR 20 54.327 15.711 -1.419 131 HA THR 20 HA THR 20 52.375 15.965 0.777 132 HB THR 20 HB THR 20 52.453 13.551 1.317 133 HG1 THR 20 HG1 THR 20 54.437 12.961 0.737 134 1HG2 THR 20 HG21 THR 20 51.564 12.447 -0.771 135 2HG2 THR 20 HG22 THR 20 52.292 13.678 -1.771 136 3HG2 THR 20 HG23 THR 20 50.895 14.056 -0.805 137 H CYS 21 HN CYS 21 53.429 14.874 2.785 138 HA CYS 21 HA CYS 21 55.727 16.362 3.494 139 1HB CYS 21 HB2 CYS 21 54.626 13.788 4.634 140 2HB CYS 21 HB1 CYS 21 55.794 14.786 5.430 141 H GLU 22 HN GLU 22 55.361 13.504 1.772 142 HA GLU 22 HA GLU 22 57.852 12.186 2.161 143 1HB GLU 22 HB2 GLU 22 55.886 11.180 0.973 144 2HB GLU 22 HB1 GLU 22 56.120 12.316 -0.344 145 1HG GLU 22 HG2 GLU 22 57.097 10.118 -0.926 146 2HG GLU 22 HG1 GLU 22 58.341 11.348 -0.854 147 H THR 23 HN THR 23 56.884 14.506 -0.447 148 HA THR 23 HA THR 23 59.690 14.780 -1.310 149 HB THR 23 HB THR 23 57.976 14.745 -3.032 150 HG1 THR 23 HG1 THR 23 59.888 16.319 -2.818 151 1HG2 THR 23 HG21 THR 23 56.402 16.559 -3.411 152 2HG2 THR 23 HG22 THR 23 56.894 17.427 -1.994 153 3HG2 THR 23 HG23 THR 23 56.044 15.897 -1.830 154 H ARG 24 HN ARG 24 57.403 17.399 -0.435 155 HA ARG 24 HA ARG 24 57.667 19.370 0.742 156 1HB ARG 24 HB2 ARG 24 60.220 18.135 1.886 157 2HB ARG 24 HB1 ARG 24 59.384 19.549 2.475 158 1HG ARG 24 HG2 ARG 24 57.381 18.176 2.962 159 2HG ARG 24 HG1 ARG 24 58.244 16.767 2.364 160 1HD ARG 24 HD2 ARG 24 59.998 17.065 4.106 161 2HD ARG 24 HD1 ARG 24 59.181 18.512 4.690 162 HE ARG 24 HE ARG 24 57.457 16.168 4.723 163 1HH1 ARG 24 HH11 ARG 24 59.948 17.926 6.380 164 2HH1 ARG 24 HH12 ARG 24 59.523 17.292 7.933 165 1HH2 ARG 24 HH21 ARG 24 56.911 15.349 6.711 166 2HH2 ARG 24 HH22 ARG 24 57.791 15.823 8.123 167 H ASN 25 HN ASN 25 60.200 18.156 -1.132 168 HA ASN 25 HA ASN 25 61.949 20.359 -1.329 169 1HB ASN 25 HB2 ASN 25 61.408 17.898 -2.989 170 2HB ASN 25 HB1 ASN 25 62.731 18.926 -3.412 171 1HD2 ASN 25 HD21 ASN 25 62.013 16.142 -1.817 172 2HD2 ASN 25 HD22 ASN 25 63.235 16.119 -0.638 173 H LYS 26 HN LYS 26 58.937 19.800 -2.640 174 HA LYS 26 HA LYS 26 58.912 22.215 -4.201 175 1HB LYS 26 HB2 LYS 26 58.345 20.801 -6.370 176 2HB LYS 26 HB1 LYS 26 60.026 20.923 -5.893 177 1HG LYS 26 HG2 LYS 26 59.807 18.711 -4.662 178 2HG LYS 26 HG1 LYS 26 58.139 18.627 -5.137 179 1HD LYS 26 HD2 LYS 26 59.632 17.195 -6.445 180 2HD LYS 26 HD1 LYS 26 58.857 18.377 -7.492 181 1HE LYS 26 HE2 LYS 26 60.972 19.756 -7.389 182 2HE LYS 26 HE1 LYS 26 61.696 18.526 -6.361 183 1HZ LYS 26 HZ1 LYS 26 61.163 18.510 -9.207 184 2HZ LYS 26 HZ2 LYS 26 60.880 17.045 -8.399 185 3HZ LYS 26 HZ3 LYS 26 62.413 17.773 -8.324 186 H LEU 27 HN LEU 27 56.837 22.707 -4.943 187 HA LEU 27 HA LEU 27 54.721 21.658 -3.230 188 1HB LEU 27 HB2 LEU 27 54.755 23.908 -5.293 189 2HB LEU 27 HB1 LEU 27 53.342 23.506 -4.347 190 HG LEU 27 HG LEU 27 54.543 24.064 -2.249 191 1HD1 LEU 27 HD11 LEU 27 56.852 24.968 -4.027 192 2HD1 LEU 27 HD12 LEU 27 56.913 23.623 -2.900 193 3HD1 LEU 27 HD13 LEU 27 56.716 25.246 -2.299 194 1HD2 LEU 27 HD21 LEU 27 53.240 25.805 -3.409 195 2HD2 LEU 27 HD22 LEU 27 54.643 26.255 -4.361 196 3HD2 LEU 27 HD23 LEU 27 54.635 26.524 -2.626 197 H VAL 28 HN VAL 28 55.624 19.921 -4.979 198 HA VAL 28 HA VAL 28 53.225 18.785 -6.179 199 HB VAL 28 HB VAL 28 54.294 18.366 -8.389 200 1HG1 VAL 28 HG11 VAL 28 53.950 20.618 -9.380 201 2HG1 VAL 28 HG12 VAL 28 53.995 21.354 -7.793 202 3HG1 VAL 28 HG13 VAL 28 52.687 20.255 -8.215 203 1HG2 VAL 28 HG21 VAL 28 56.666 18.722 -7.772 204 2HG2 VAL 28 HG22 VAL 28 56.346 20.419 -7.446 205 3HG2 VAL 28 HG23 VAL 28 56.239 19.802 -9.080 206 H LEU 29 HN LEU 29 53.401 16.571 -6.400 207 HA LEU 29 HA LEU 29 55.692 15.372 -5.009 208 1HB LEU 29 HB2 LEU 29 53.249 14.753 -4.748 209 2HB LEU 29 HB1 LEU 29 53.302 14.104 -6.344 210 HG LEU 29 HG LEU 29 54.941 12.376 -5.538 211 1HD1 LEU 29 HD11 LEU 29 55.873 13.782 -3.644 212 2HD1 LEU 29 HD12 LEU 29 55.290 12.237 -3.057 213 3HD1 LEU 29 HD13 LEU 29 54.321 13.684 -2.835 214 1HD2 LEU 29 HD21 LEU 29 52.347 12.649 -3.913 215 2HD2 LEU 29 HD22 LEU 29 53.202 11.150 -4.181 216 3HD2 LEU 29 HD23 LEU 29 52.442 11.975 -5.523 217 H CYS 30 HN CYS 30 54.811 16.256 -8.015 218 HA CYS 30 HA CYS 30 57.087 15.072 -9.381 219 1HB CYS 30 HB2 CYS 30 55.596 14.237 -11.204 220 2HB CYS 30 HB1 CYS 30 55.546 13.360 -9.708 221 H ASP 31 HN ASP 31 57.853 16.575 -10.419 222 HA ASP 31 HA ASP 31 56.423 19.109 -10.989 223 1HB ASP 31 HB2 ASP 31 58.674 20.047 -11.359 224 2HB ASP 31 HB1 ASP 31 58.599 19.169 -9.840 225 H LYS 32 HN LYS 32 57.790 16.539 -12.785 226 HA LYS 32 HA LYS 32 57.865 17.921 -15.343 227 1HB LYS 32 HB2 LYS 32 57.989 14.965 -14.680 228 2HB LYS 32 HB1 LYS 32 58.378 15.651 -16.250 229 1HG LYS 32 HG2 LYS 32 60.162 17.064 -15.172 230 2HG LYS 32 HG1 LYS 32 59.815 16.293 -13.637 231 1HD LYS 32 HD2 LYS 32 60.801 14.844 -16.120 232 2HD LYS 32 HD1 LYS 32 61.790 15.283 -14.743 233 1HE LYS 32 HE2 LYS 32 60.381 13.832 -13.271 234 2HE LYS 32 HE1 LYS 32 59.418 13.362 -14.666 235 1HZ LYS 32 HZ1 LYS 32 62.267 12.807 -14.163 236 2HZ LYS 32 HZ2 LYS 32 61.559 12.627 -15.696 237 3HZ LYS 32 HZ3 LYS 32 60.996 11.702 -14.388 238 H LYS 33 HN LYS 33 55.236 18.068 -14.145 239 HA LYS 33 HA LYS 33 53.614 17.444 -16.456 240 1HB LYS 33 HB2 LYS 33 53.755 15.162 -15.359 241 2HB LYS 33 HB1 LYS 33 53.101 15.878 -13.910 242 1HG LYS 33 HG2 LYS 33 51.343 14.693 -15.191 243 2HG LYS 33 HG1 LYS 33 50.974 16.393 -15.067 244 1HD LYS 33 HD2 LYS 33 50.528 15.570 -17.349 245 2HD LYS 33 HD1 LYS 33 51.839 16.723 -17.414 246 1HE LYS 33 HE2 LYS 33 53.486 14.834 -17.461 247 2HE LYS 33 HE1 LYS 33 52.155 13.687 -17.394 248 1HZ LYS 33 HZ1 LYS 33 51.603 15.463 -19.449 249 2HZ LYS 33 HZ2 LYS 33 52.032 13.823 -19.568 250 3HZ LYS 33 HZ3 LYS 33 53.234 15.022 -19.611 251 H CYS 34 HN CYS 34 51.602 18.277 -16.396 252 HA CYS 34 HA CYS 34 50.834 19.880 -14.050 253 1HB CYS 34 HB2 CYS 34 51.093 20.825 -16.857 254 2HB CYS 34 HB1 CYS 34 50.167 21.732 -15.687 255 H ASN 35 HN ASN 35 49.352 18.360 -13.763 256 HA ASN 35 HA ASN 35 47.039 18.126 -15.650 257 1HB ASN 35 HB2 ASN 35 47.372 16.809 -12.911 258 2HB ASN 35 HB1 ASN 35 46.059 16.518 -14.022 259 1HD2 ASN 35 HD21 ASN 35 47.305 14.369 -13.150 260 2HD2 ASN 35 HD22 ASN 35 48.292 13.642 -14.308 261 H GLN 36 HN GLN 36 45.405 19.509 -15.423 262 HA GLN 36 HA GLN 36 45.242 21.308 -13.094 263 1HB GLN 36 HB2 GLN 36 43.619 21.090 -15.685 264 2HB GLN 36 HB1 GLN 36 43.337 22.327 -14.483 265 1HG GLN 36 HG2 GLN 36 44.693 23.237 -16.283 266 2HG GLN 36 HG1 GLN 36 45.593 23.227 -14.786 267 1HE2 GLN 36 HE21 GLN 36 47.698 22.991 -15.456 268 2HE2 GLN 36 HE22 GLN 36 48.265 21.764 -16.480 269 H ARG 37 HN ARG 37 44.912 19.650 -11.642 270 HA ARG 37 HA ARG 37 42.069 18.938 -11.187 271 1HB ARG 37 HB2 ARG 37 42.772 16.584 -10.577 272 2HB ARG 37 HB1 ARG 37 43.147 16.939 -12.231 273 1HG ARG 37 HG2 ARG 37 45.506 17.437 -11.645 274 2HG ARG 37 HG1 ARG 37 45.169 17.152 -9.951 275 1HD ARG 37 HD2 ARG 37 44.864 15.074 -12.160 276 2HD ARG 37 HD1 ARG 37 46.209 15.146 -11.036 277 HE ARG 37 HE ARG 37 43.517 14.171 -10.466 278 1HH1 ARG 37 HH11 ARG 37 46.416 15.518 -9.121 279 2HH1 ARG 37 HH12 ARG 37 46.126 14.857 -7.548 280 1HH2 ARG 37 HH21 ARG 37 43.129 13.339 -8.481 281 2HH2 ARG 37 HH22 ARG 37 44.237 13.612 -7.177 282 H CYS 38 HN CYS 38 42.874 17.344 -8.862 283 HA CYS 38 HA CYS 38 43.291 19.657 -7.057 284 1HB CYS 38 HB2 CYS 38 41.487 18.004 -6.540 285 2HB CYS 38 HB1 CYS 38 42.703 16.764 -6.315 286 H GLY 39 HN GLY 39 44.670 19.555 -5.295 287 1HA GLY 39 HA2 GLY 39 46.888 17.826 -4.845 288 2HA GLY 39 HA1 GLY 39 47.445 19.202 -5.778 289 H CYS 40 HN CYS 40 48.160 18.690 -2.982 290 HA CYS 40 HA CYS 40 46.588 20.025 -1.104 291 1HB CYS 40 HB2 CYS 40 49.565 19.732 -1.328 292 2HB CYS 40 HB1 CYS 40 48.838 20.531 0.034 293 H ILE 41 HN ILE 41 47.288 22.083 0.013 294 HA ILE 41 HA ILE 41 46.886 24.224 -1.886 295 HB ILE 41 HB ILE 41 48.189 24.828 0.782 296 1HG1 ILE 41 HG12 ILE 41 46.413 23.219 1.463 297 2HG1 ILE 41 HG11 ILE 41 45.985 24.839 1.934 298 1HG2 ILE 41 HG21 ILE 41 47.706 26.595 -0.857 299 2HG2 ILE 41 HG22 ILE 41 46.674 26.800 0.546 300 3HG2 ILE 41 HG23 ILE 41 46.031 26.103 -0.936 301 1HD1 ILE 41 HD11 ILE 41 44.031 23.663 1.035 302 2HD1 ILE 41 HD12 ILE 41 44.873 23.360 -0.465 303 3HD1 ILE 41 HD13 ILE 41 44.432 25.004 -0.019 304 H SER 42 HN SER 42 48.362 25.835 -2.464 305 HA SER 42 HA SER 42 51.033 24.826 -3.060 306 1HB SER 42 HB2 SER 42 51.257 27.087 -4.267 307 2HB SER 42 HB1 SER 42 49.772 26.246 -4.727 308 HG SER 42 HG SER 42 50.145 28.419 -3.007 309 H GLY 43 HN GLY 43 51.921 24.518 -1.163 310 1HA GLY 43 HA2 GLY 43 53.817 25.979 -0.020 311 2HA GLY 43 HA1 GLY 43 52.406 26.718 0.762 312 H THR 44 HN THR 44 50.968 24.123 0.509 313 HA THR 44 HA THR 44 52.069 22.822 2.941 314 HB THR 44 HB THR 44 49.774 21.796 3.171 315 HG1 THR 44 HG1 THR 44 49.696 22.325 0.626 316 1HG2 THR 44 HG21 THR 44 48.463 23.843 3.548 317 2HG2 THR 44 HG22 THR 44 49.591 24.789 2.586 318 3HG2 THR 44 HG23 THR 44 50.105 24.093 4.117 319 H VAL 45 HN VAL 45 51.573 20.547 3.050 320 HA VAL 45 HA VAL 45 51.841 18.987 0.558 321 HB VAL 45 HB VAL 45 53.726 17.672 1.574 322 1HG1 VAL 45 HG11 VAL 45 54.354 20.591 1.107 323 2HG1 VAL 45 HG12 VAL 45 54.236 19.330 -0.116 324 3HG1 VAL 45 HG13 VAL 45 55.518 19.271 1.077 325 1HG2 VAL 45 HG21 VAL 45 55.120 18.661 3.364 326 2HG2 VAL 45 HG22 VAL 45 53.514 18.300 3.958 327 3HG2 VAL 45 HG23 VAL 45 53.956 19.955 3.556 328 H LEU 46 HN LEU 46 50.738 17.240 0.645 329 HA LEU 46 HA LEU 46 48.774 16.657 2.504 330 1HB LEU 46 HB2 LEU 46 49.181 15.720 0.106 331 2HB LEU 46 HB1 LEU 46 50.250 14.597 0.914 332 HG LEU 46 HG LEU 46 48.457 13.599 2.178 333 1HD1 LEU 46 HD11 LEU 46 46.082 14.321 1.783 334 2HD1 LEU 46 HD12 LEU 46 46.639 15.597 0.722 335 3HD1 LEU 46 HD13 LEU 46 46.993 15.658 2.439 336 1HD2 LEU 46 HD21 LEU 46 47.194 12.629 0.238 337 2HD2 LEU 46 HD22 LEU 46 48.903 12.770 -0.135 338 3HD2 LEU 46 HD23 LEU 46 47.764 13.937 -0.780 339 H LYS 47 HN LYS 47 48.660 15.579 4.339 340 HA LYS 47 HA LYS 47 50.686 15.322 6.185 341 1HB LYS 47 HB2 LYS 47 48.352 15.163 6.795 342 2HB LYS 47 HB1 LYS 47 48.145 13.676 5.901 343 1HG LYS 47 HG2 LYS 47 49.690 12.532 7.460 344 2HG LYS 47 HG1 LYS 47 49.940 14.037 8.333 345 1HD LYS 47 HD2 LYS 47 47.487 14.096 8.867 346 2HD LYS 47 HD1 LYS 47 47.264 12.594 7.985 347 1HE LYS 47 HE2 LYS 47 49.035 12.936 10.446 348 2HE LYS 47 HE1 LYS 47 47.455 12.167 10.425 349 1HZ LYS 47 HZ1 LYS 47 48.964 10.436 10.282 350 2HZ LYS 47 HZ2 LYS 47 49.955 11.247 9.167 351 3HZ LYS 47 HZ3 LYS 47 48.443 10.648 8.679 352 H SER 48 HN SER 48 49.753 12.932 3.817 353 HA SER 48 HA SER 48 52.322 11.507 4.202 354 1HB SER 48 HB2 SER 48 49.594 10.062 4.249 355 2HB SER 48 HB1 SER 48 51.177 9.282 4.326 356 HG SER 48 HG SER 48 50.093 11.150 6.153 357 H LYS 49 HN LYS 49 52.436 9.742 2.551 358 HA LYS 49 HA LYS 49 52.638 10.797 0.002 359 1HB LYS 49 HB2 LYS 49 53.665 8.700 0.858 360 2HB LYS 49 HB1 LYS 49 52.110 7.907 0.760 361 1HG LYS 49 HG2 LYS 49 53.445 7.276 -1.180 362 2HG LYS 49 HG1 LYS 49 52.099 8.253 -1.726 363 1HD LYS 49 HD2 LYS 49 53.590 10.254 -1.842 364 2HD LYS 49 HD1 LYS 49 54.929 9.298 -1.229 365 1HE LYS 49 HE2 LYS 49 54.749 7.811 -3.237 366 2HE LYS 49 HE1 LYS 49 53.433 8.808 -3.843 367 1HZ LYS 49 HZ1 LYS 49 54.859 10.289 -4.611 368 2HZ LYS 49 HZ2 LYS 49 56.098 9.179 -4.277 369 3HZ LYS 49 HZ3 LYS 49 55.700 10.372 -3.139 370 H ASP 50 HN ASP 50 49.821 9.586 1.561 371 HA ASP 50 HA ASP 50 48.122 10.489 -0.646 372 1HB ASP 50 HB2 ASP 50 48.808 8.187 -1.376 373 2HB ASP 50 HB1 ASP 50 48.177 7.527 0.120 374 H SER 51 HN SER 51 48.219 11.479 1.947 375 HA SER 51 HA SER 51 46.066 10.297 3.565 376 1HB SER 51 HB2 SER 51 48.101 11.495 4.558 377 2HB SER 51 HB1 SER 51 47.478 13.003 3.881 378 HG SER 51 HG SER 51 45.997 13.045 5.341 379 H SER 52 HN SER 52 44.884 12.888 4.280 380 HA SER 52 HA SER 52 43.628 13.969 1.859 381 1HB SER 52 HB2 SER 52 42.271 11.889 2.379 382 2HB SER 52 HB1 SER 52 41.972 12.511 4.009 383 HG SER 52 HG SER 52 40.799 14.126 3.199 384 H GLU 53 HN GLU 53 45.356 14.909 3.867 385 HA GLU 53 HA GLU 53 43.986 17.336 4.735 386 1HB GLU 53 HB2 GLU 53 43.407 15.639 6.534 387 2HB GLU 53 HB1 GLU 53 45.107 15.329 6.779 388 1HG GLU 53 HG2 GLU 53 43.711 17.994 7.266 389 2HG GLU 53 HG1 GLU 53 44.165 16.850 8.513 390 H CYS 54 HN CYS 54 45.484 18.778 4.101 391 HA CYS 54 HA CYS 54 48.354 18.012 3.972 392 1HB CYS 54 HB2 CYS 54 46.994 20.423 2.822 393 2HB CYS 54 HB1 CYS 54 48.596 19.845 2.464 394 H VAL 55 HN VAL 55 49.923 18.974 4.869 395 HA VAL 55 HA VAL 55 49.627 21.395 6.556 396 HB VAL 55 HB VAL 55 51.085 20.223 8.300 397 1HG1 VAL 55 HG11 VAL 55 48.417 18.882 7.691 398 2HG1 VAL 55 HG12 VAL 55 48.580 20.381 8.590 399 3HG1 VAL 55 HG13 VAL 55 49.196 18.881 9.264 400 1HG2 VAL 55 HG21 VAL 55 51.183 17.754 8.266 401 2HG2 VAL 55 HG22 VAL 55 51.994 18.430 6.867 402 3HG2 VAL 55 HG23 VAL 55 50.395 17.727 6.701 403 H HIS 56 HN HIS 56 51.516 22.617 6.726 404 HA HIS 56 HA HIS 56 53.314 22.524 4.526 405 1HB HIS 56 HB2 HIS 56 53.626 23.879 7.246 406 2HB HIS 56 HB1 HIS 56 54.640 24.233 5.859 407 HD1 HIS 56 HD1 HIS 56 53.477 25.530 3.946 408 HD2 HIS 56 HD2 HIS 56 50.977 24.912 7.113 409 HE1 HIS 56 HE1 HIS 56 51.523 26.990 3.583 410 HA PRO 57 HA PRO 57 56.379 19.506 5.538 411 1HB PRO 57 HB2 PRO 57 58.719 20.896 4.973 412 2HB PRO 57 HB1 PRO 57 57.694 20.147 3.775 413 1HG PRO 57 HG2 PRO 57 57.729 23.002 4.658 414 2HG PRO 57 HG1 PRO 57 57.664 22.337 3.014 415 1HD PRO 57 HD2 PRO 57 55.471 23.240 4.157 416 2HD PRO 57 HD1 PRO 57 55.417 21.745 3.206 417 H SER 58 HN SER 58 56.529 22.637 6.952 418 HA SER 58 HA SER 58 58.417 21.911 9.085 419 1HB SER 58 HB2 SER 58 58.059 24.322 9.776 420 2HB SER 58 HB1 SER 58 58.469 24.194 8.060 421 HG SER 58 HG SER 58 56.172 24.075 7.671 422 H LYS 59 HN LYS 59 55.496 20.900 8.689 423 HA LYS 59 HA LYS 59 54.658 21.190 11.554 424 1HB LYS 59 HB2 LYS 59 52.846 20.822 9.162 425 2HB LYS 59 HB1 LYS 59 52.347 20.950 10.837 426 1HG LYS 59 HG2 LYS 59 53.165 23.280 10.899 427 2HG LYS 59 HG1 LYS 59 53.744 23.131 9.249 428 1HD LYS 59 HD2 LYS 59 51.547 24.171 9.135 429 2HD LYS 59 HD1 LYS 59 51.414 22.529 8.538 430 1HE LYS 59 HE2 LYS 59 49.516 23.098 10.026 431 2HE LYS 59 HE1 LYS 59 50.433 21.742 10.648 432 1HZ LYS 59 HZ1 LYS 59 50.933 24.534 11.485 433 2HZ LYS 59 HZ2 LYS 59 51.469 23.107 12.232 434 3HZ LYS 59 HZ3 LYS 59 49.821 23.520 12.275 435 H CYS 60 HN CYS 60 54.246 19.346 8.637 436 HA CYS 60 HA CYS 60 53.143 17.082 9.031 437 1HB CYS 60 HB2 CYS 60 55.909 17.449 8.022 438 2HB CYS 60 HB1 CYS 60 55.170 15.870 7.889 Start of MODEL 14 1 1H ASN 1 HT1 ASN 1 35.641 14.123 -11.503 2 2H ASN 1 HT2 ASN 1 34.847 15.284 -10.552 3 3H ASN 1 HT3 ASN 1 34.158 13.745 -10.764 4 HA ASN 1 HA ASN 1 35.126 13.870 -8.598 5 1HB ASN 1 HB2 ASN 1 36.811 12.200 -10.534 6 2HB ASN 1 HB1 ASN 1 36.706 11.924 -8.799 7 1HD2 ASN 1 HD21 ASN 1 34.634 11.173 -7.925 8 2HD2 ASN 1 HD22 ASN 1 33.479 10.449 -8.936 9 H PHE 2 HN PHE 2 36.275 16.072 -10.324 10 HA PHE 2 HA PHE 2 39.105 16.170 -9.566 11 1HB PHE 2 HB2 PHE 2 39.050 18.374 -10.811 12 2HB PHE 2 HB1 PHE 2 38.362 17.078 -11.773 13 HD1 PHE 2 HD1 PHE 2 35.894 16.912 -12.077 14 HD2 PHE 2 HD2 PHE 2 37.619 20.176 -9.942 15 HE1 PHE 2 HE1 PHE 2 33.786 18.148 -12.255 16 HE2 PHE 2 HE2 PHE 2 35.508 21.405 -10.124 17 HZ PHE 2 HZ PHE 2 33.586 20.396 -11.280 18 H VAL 3 HN VAL 3 36.903 16.188 -7.624 19 HA VAL 3 HA VAL 3 37.419 18.731 -6.148 20 HB VAL 3 HB VAL 3 35.252 16.612 -5.751 21 1HG1 VAL 3 HG11 VAL 3 35.577 19.362 -4.459 22 2HG1 VAL 3 HG12 VAL 3 35.793 17.827 -3.635 23 3HG1 VAL 3 HG13 VAL 3 34.210 18.283 -4.229 24 1HG2 VAL 3 HG21 VAL 3 35.093 19.408 -6.969 25 2HG2 VAL 3 HG22 VAL 3 33.726 18.338 -6.698 26 3HG2 VAL 3 HG23 VAL 3 34.962 17.902 -7.863 27 H CYS 4 HN CYS 4 38.150 18.690 -4.086 28 HA CYS 4 HA CYS 4 38.905 16.142 -2.822 29 1HB CYS 4 HB2 CYS 4 40.819 18.251 -3.775 30 2HB CYS 4 HB1 CYS 4 41.275 17.276 -2.446 31 HA PRO 5 HA PRO 5 38.012 17.740 0.959 32 1HB PRO 5 HB2 PRO 5 40.289 16.909 2.482 33 2HB PRO 5 HB1 PRO 5 38.798 16.071 2.283 34 1HG PRO 5 HG2 PRO 5 41.265 15.285 1.204 35 2HG PRO 5 HG1 PRO 5 39.682 14.603 0.836 36 1HD PRO 5 HD2 PRO 5 41.367 16.406 -0.744 37 2HD PRO 5 HD1 PRO 5 40.061 15.351 -1.274 38 HA PRO 6 HA PRO 6 39.365 21.660 2.488 39 1HB PRO 6 HB2 PRO 6 40.509 20.887 4.995 40 2HB PRO 6 HB1 PRO 6 38.902 21.479 4.687 41 1HG PRO 6 HG2 PRO 6 39.834 18.649 4.839 42 2HG PRO 6 HG1 PRO 6 38.321 19.339 5.406 43 1HD PRO 6 HD2 PRO 6 38.302 17.933 3.264 44 2HD PRO 6 HD1 PRO 6 37.451 19.481 3.228 45 H GLY 7 HN GLY 7 41.806 19.381 3.633 46 1HA GLY 7 HA2 GLY 7 44.046 21.082 3.562 47 2HA GLY 7 HA1 GLY 7 44.129 19.338 3.472 48 H GLN 8 HN GLN 8 42.457 19.736 0.860 49 HA GLN 8 HA GLN 8 44.730 20.421 -0.939 50 1HB GLN 8 HB2 GLN 8 42.587 18.293 -1.243 51 2HB GLN 8 HB1 GLN 8 43.786 18.669 -2.472 52 1HG GLN 8 HG2 GLN 8 45.591 18.027 -0.911 53 2HG GLN 8 HG1 GLN 8 44.418 17.672 0.352 54 1HE2 GLN 8 HE21 GLN 8 43.831 15.527 0.458 55 2HE2 GLN 8 HE22 GLN 8 43.919 14.412 -0.814 56 H THR 9 HN THR 9 44.081 21.111 -3.017 57 HA THR 9 HA THR 9 41.373 22.150 -3.447 58 HB THR 9 HB THR 9 42.417 23.980 -2.120 59 HG1 THR 9 HG1 THR 9 42.492 24.692 -4.839 60 1HG2 THR 9 HG21 THR 9 44.518 24.082 -4.358 61 2HG2 THR 9 HG22 THR 9 44.862 23.488 -2.743 62 3HG2 THR 9 HG23 THR 9 44.428 25.173 -2.987 63 H PHE 10 HN PHE 10 41.446 23.429 -5.542 64 HA PHE 10 HA PHE 10 42.309 21.648 -7.638 65 1HB PHE 10 HB2 PHE 10 40.328 23.238 -7.770 66 2HB PHE 10 HB1 PHE 10 41.457 24.577 -7.870 67 HD1 PHE 10 HD1 PHE 10 40.355 21.467 -9.562 68 HD2 PHE 10 HD2 PHE 10 42.530 25.110 -9.985 69 HE1 PHE 10 HE1 PHE 10 40.499 21.100 -11.979 70 HE2 PHE 10 HE2 PHE 10 42.670 24.735 -12.407 71 HZ PHE 10 HZ PHE 10 41.649 22.728 -13.405 72 H GLN 11 HN GLN 11 43.909 22.097 -9.263 73 HA GLN 11 HA GLN 11 46.025 24.078 -8.538 74 1HB GLN 11 HB2 GLN 11 46.621 21.214 -9.413 75 2HB GLN 11 HB1 GLN 11 47.783 22.421 -8.933 76 1HG GLN 11 HG2 GLN 11 45.740 21.142 -7.084 77 2HG GLN 11 HG1 GLN 11 47.445 20.751 -7.181 78 1HE2 GLN 11 HE21 GLN 11 45.688 21.955 -4.988 79 2HE2 GLN 11 HE22 GLN 11 46.580 23.283 -4.450 80 H THR 12 HN THR 12 47.484 24.456 -10.314 81 HA THR 12 HA THR 12 46.075 24.340 -12.939 82 HB THR 12 HB THR 12 47.719 26.199 -13.579 83 HG1 THR 12 HG1 THR 12 48.660 25.430 -11.038 84 1HG2 THR 12 HG21 THR 12 46.978 27.934 -11.970 85 2HG2 THR 12 HG22 THR 12 46.513 26.708 -10.800 86 3HG2 THR 12 HG23 THR 12 45.611 26.881 -12.298 87 H CYS 13 HN CYS 13 49.152 23.816 -11.322 88 HA CYS 13 HA CYS 13 49.966 21.931 -13.483 89 1HB CYS 13 HB2 CYS 13 51.509 23.819 -13.238 90 2HB CYS 13 HB1 CYS 13 51.746 23.465 -11.541 91 H ALA 14 HN ALA 14 49.386 20.036 -12.814 92 HA ALA 14 HA ALA 14 50.598 18.901 -10.436 93 1HB ALA 14 HB1 ALA 14 48.624 20.073 -9.500 94 2HB ALA 14 HB2 ALA 14 48.368 18.341 -9.373 95 3HB ALA 14 HB3 ALA 14 47.576 19.250 -10.644 96 H SER 15 HN SER 15 51.291 17.018 -10.992 97 HA SER 15 HA SER 15 50.273 15.577 -13.302 98 1HB SER 15 HB2 SER 15 52.732 15.598 -12.497 99 2HB SER 15 HB1 SER 15 52.192 14.604 -11.145 100 HG SER 15 HG SER 15 51.146 13.497 -13.248 101 H SER 16 HN SER 16 50.760 12.984 -11.702 102 HA SER 16 HA SER 16 48.205 12.790 -10.212 103 1HB SER 16 HB2 SER 16 47.893 11.874 -12.559 104 2HB SER 16 HB1 SER 16 49.239 10.758 -12.275 105 HG SER 16 HG SER 16 46.865 10.985 -10.741 106 H CYS 17 HN CYS 17 51.188 13.020 -9.839 107 HA CYS 17 HA CYS 17 51.781 10.630 -8.169 108 1HB CYS 17 HB2 CYS 17 54.186 11.408 -8.607 109 2HB CYS 17 HB1 CYS 17 53.299 10.629 -9.879 110 HA PRO 18 HA PRO 18 50.801 14.219 -5.359 111 1HB PRO 18 HB2 PRO 18 50.547 12.411 -3.163 112 2HB PRO 18 HB1 PRO 18 49.273 13.202 -4.049 113 1HG PRO 18 HG2 PRO 18 50.338 10.476 -4.347 114 2HG PRO 18 HG1 PRO 18 48.721 11.102 -4.698 115 1HD PRO 18 HD2 PRO 18 50.476 10.433 -6.594 116 2HD PRO 18 HD1 PRO 18 49.306 11.746 -6.842 117 H LYS 19 HN LYS 19 52.084 15.369 -4.215 118 HA LYS 19 HA LYS 19 54.762 14.335 -3.332 119 1HB LYS 19 HB2 LYS 19 54.178 16.627 -4.789 120 2HB LYS 19 HB1 LYS 19 53.848 17.211 -3.168 121 1HG LYS 19 HG2 LYS 19 56.009 17.825 -3.461 122 2HG LYS 19 HG1 LYS 19 56.143 16.371 -2.522 123 1HD LYS 19 HD2 LYS 19 56.612 16.710 -5.535 124 2HD LYS 19 HD1 LYS 19 57.818 16.296 -4.345 125 1HE LYS 19 HE2 LYS 19 56.745 14.030 -4.082 126 2HE LYS 19 HE1 LYS 19 55.576 14.492 -5.311 127 1HZ LYS 19 HZ1 LYS 19 57.330 14.783 -6.877 128 2HZ LYS 19 HZ2 LYS 19 57.408 13.226 -6.204 129 3HZ LYS 19 HZ3 LYS 19 58.500 14.424 -5.699 130 H THR 20 HN THR 20 55.107 14.140 -1.230 131 HA THR 20 HA THR 20 52.989 15.173 0.616 132 HB THR 20 HB THR 20 53.025 13.028 1.797 133 HG1 THR 20 HG1 THR 20 55.114 12.434 1.583 134 1HG2 THR 20 HG21 THR 20 51.712 12.934 -0.544 135 2HG2 THR 20 HG22 THR 20 52.355 11.400 -0.046 136 3HG2 THR 20 HG23 THR 20 53.193 12.354 -1.239 137 H CYS 21 HN CYS 21 53.877 14.482 2.962 138 HA CYS 21 HA CYS 21 55.929 16.354 3.585 139 1HB CYS 21 HB2 CYS 21 54.870 13.984 5.113 140 2HB CYS 21 HB1 CYS 21 55.933 15.176 5.787 141 H GLU 22 HN GLU 22 56.027 13.257 2.377 142 HA GLU 22 HA GLU 22 58.640 12.418 3.343 143 1HB GLU 22 HB2 GLU 22 57.117 11.627 0.849 144 2HB GLU 22 HB1 GLU 22 58.468 10.743 1.560 145 1HG GLU 22 HG2 GLU 22 57.129 10.312 3.612 146 2HG GLU 22 HG1 GLU 22 55.779 11.220 2.954 147 H THR 23 HN THR 23 57.342 13.839 0.351 148 HA THR 23 HA THR 23 60.057 14.712 -0.548 149 HB THR 23 HB THR 23 58.842 14.971 -2.772 150 HG1 THR 23 HG1 THR 23 56.779 13.902 -1.116 151 1HG2 THR 23 HG21 THR 23 58.415 12.591 -3.113 152 2HG2 THR 23 HG22 THR 23 58.276 12.327 -1.372 153 3HG2 THR 23 HG23 THR 23 59.840 12.746 -2.077 154 H ARG 24 HN ARG 24 59.774 16.252 1.254 155 HA ARG 24 HA ARG 24 57.911 18.374 0.969 156 1HB ARG 24 HB2 ARG 24 60.589 18.272 2.409 157 2HB ARG 24 HB1 ARG 24 59.432 19.569 2.631 158 1HG ARG 24 HG2 ARG 24 57.727 17.837 3.349 159 2HG ARG 24 HG1 ARG 24 58.968 16.620 3.098 160 1HD ARG 24 HD2 ARG 24 60.338 17.548 4.906 161 2HD ARG 24 HD1 ARG 24 59.173 18.844 5.162 162 HE ARG 24 HE ARG 24 57.937 16.223 5.296 163 1HH1 ARG 24 HH11 ARG 24 59.791 18.579 7.043 164 2HH1 ARG 24 HH12 ARG 24 59.251 18.024 8.591 165 1HH2 ARG 24 HH21 ARG 24 57.244 15.505 7.259 166 2HH2 ARG 24 HH22 ARG 24 57.789 16.266 8.717 167 H ASN 25 HN ASN 25 60.710 17.673 -0.591 168 HA ASN 25 HA ASN 25 62.007 20.019 -1.227 169 1HB ASN 25 HB2 ASN 25 61.452 17.577 -2.964 170 2HB ASN 25 HB1 ASN 25 62.724 18.752 -3.253 171 1HD2 ASN 25 HD21 ASN 25 61.602 16.302 -0.929 172 2HD2 ASN 25 HD22 ASN 25 63.119 16.052 -0.208 173 H LYS 26 HN LYS 26 58.986 18.844 -2.492 174 HA LYS 26 HA LYS 26 58.615 21.316 -4.103 175 1HB LYS 26 HB2 LYS 26 57.537 18.518 -4.628 176 2HB LYS 26 HB1 LYS 26 57.098 19.920 -5.558 177 1HG LYS 26 HG2 LYS 26 58.655 18.657 -6.851 178 2HG LYS 26 HG1 LYS 26 59.493 20.095 -6.296 179 1HD LYS 26 HD2 LYS 26 60.684 18.810 -4.606 180 2HD LYS 26 HD1 LYS 26 59.760 17.363 -4.970 181 1HE LYS 26 HE2 LYS 26 61.996 17.324 -6.042 182 2HE LYS 26 HE1 LYS 26 60.759 17.427 -7.287 183 1HZ LYS 26 HZ1 LYS 26 61.199 19.654 -7.652 184 2HZ LYS 26 HZ2 LYS 26 62.741 18.975 -7.441 185 3HZ LYS 26 HZ3 LYS 26 62.018 19.850 -6.178 186 H LEU 27 HN LEU 27 56.665 22.218 -3.850 187 HA LEU 27 HA LEU 27 54.856 21.194 -1.675 188 1HB LEU 27 HB2 LEU 27 55.431 24.083 -2.410 189 2HB LEU 27 HB1 LEU 27 54.431 23.507 -1.088 190 HG LEU 27 HG LEU 27 57.450 23.030 -1.355 191 1HD1 LEU 27 HD11 LEU 27 57.665 24.567 0.571 192 2HD1 LEU 27 HD12 LEU 27 55.935 24.851 0.556 193 3HD1 LEU 27 HD13 LEU 27 56.923 25.381 -0.796 194 1HD2 LEU 27 HD21 LEU 27 55.582 22.348 0.953 195 2HD2 LEU 27 HD22 LEU 27 57.327 22.142 0.949 196 3HD2 LEU 27 HD23 LEU 27 56.335 21.183 -0.122 197 H VAL 28 HN VAL 28 54.462 20.383 -4.053 198 HA VAL 28 HA VAL 28 51.809 21.477 -4.967 199 HB VAL 28 HB VAL 28 52.523 21.015 -7.359 200 1HG1 VAL 28 HG11 VAL 28 52.734 23.347 -6.433 201 2HG1 VAL 28 HG12 VAL 28 53.995 23.011 -7.606 202 3HG1 VAL 28 HG13 VAL 28 54.363 22.981 -5.890 203 1HG2 VAL 28 HG21 VAL 28 54.328 19.379 -6.842 204 2HG2 VAL 28 HG22 VAL 28 55.282 20.670 -6.133 205 3HG2 VAL 28 HG23 VAL 28 54.922 20.686 -7.850 206 H LEU 29 HN LEU 29 51.175 19.779 -6.790 207 HA LEU 29 HA LEU 29 50.603 17.373 -5.286 208 1HB LEU 29 HB2 LEU 29 49.011 18.456 -6.809 209 2HB LEU 29 HB1 LEU 29 50.145 18.312 -8.107 210 HG LEU 29 HG LEU 29 48.189 16.642 -8.257 211 1HD1 LEU 29 HD11 LEU 29 50.775 15.114 -7.755 212 2HD1 LEU 29 HD12 LEU 29 50.309 15.855 -9.271 213 3HD1 LEU 29 HD13 LEU 29 49.371 14.535 -8.599 214 1HD2 LEU 29 HD21 LEU 29 49.273 15.544 -5.650 215 2HD2 LEU 29 HD22 LEU 29 48.000 14.816 -6.613 216 3HD2 LEU 29 HD23 LEU 29 47.758 16.384 -5.878 217 H CYS 30 HN CYS 30 52.465 18.341 -7.956 218 HA CYS 30 HA CYS 30 54.686 16.570 -7.476 219 1HB CYS 30 HB2 CYS 30 52.799 15.012 -8.423 220 2HB CYS 30 HB1 CYS 30 53.059 15.884 -9.890 221 H ASP 31 HN ASP 31 56.220 16.608 -9.372 222 HA ASP 31 HA ASP 31 56.049 19.237 -10.795 223 1HB ASP 31 HB2 ASP 31 57.838 19.076 -9.089 224 2HB ASP 31 HB1 ASP 31 58.484 17.650 -9.877 225 H LYS 32 HN LYS 32 56.114 15.895 -11.245 226 HA LYS 32 HA LYS 32 57.493 15.670 -13.737 227 1HB LYS 32 HB2 LYS 32 55.296 13.929 -12.566 228 2HB LYS 32 HB1 LYS 32 56.330 13.472 -13.908 229 1HG LYS 32 HG2 LYS 32 58.339 13.717 -12.448 230 2HG LYS 32 HG1 LYS 32 57.308 14.159 -11.098 231 1HD LYS 32 HD2 LYS 32 56.158 11.946 -11.256 232 2HD LYS 32 HD1 LYS 32 57.207 11.504 -12.591 233 1HE LYS 32 HE2 LYS 32 59.196 11.735 -11.112 234 2HE LYS 32 HE1 LYS 32 58.148 12.188 -9.773 235 1HZ LYS 32 HZ1 LYS 32 58.714 9.870 -9.680 236 2HZ LYS 32 HZ2 LYS 32 58.082 9.615 -11.235 237 3HZ LYS 32 HZ3 LYS 32 57.048 10.053 -9.962 238 H LYS 33 HN LYS 33 54.285 16.787 -13.078 239 HA LYS 33 HA LYS 33 53.887 17.468 -15.886 240 1HB LYS 33 HB2 LYS 33 53.165 15.073 -15.872 241 2HB LYS 33 HB1 LYS 33 52.068 15.415 -14.570 242 1HG LYS 33 HG2 LYS 33 50.792 15.314 -16.580 243 2HG LYS 33 HG1 LYS 33 50.758 16.935 -15.960 244 1HD LYS 33 HD2 LYS 33 51.079 16.988 -18.412 245 2HD LYS 33 HD1 LYS 33 52.507 17.632 -17.637 246 1HE LYS 33 HE2 LYS 33 53.116 16.079 -19.460 247 2HE LYS 33 HE1 LYS 33 53.667 15.438 -17.925 248 1HZ LYS 33 HZ1 LYS 33 51.882 13.931 -17.861 249 2HZ LYS 33 HZ2 LYS 33 52.517 13.843 -19.434 250 3HZ LYS 33 HZ3 LYS 33 51.076 14.696 -19.145 251 H CYS 34 HN CYS 34 52.127 18.759 -16.296 252 HA CYS 34 HA CYS 34 50.999 20.122 -13.914 253 1HB CYS 34 HB2 CYS 34 51.642 21.164 -16.613 254 2HB CYS 34 HB1 CYS 34 50.744 22.059 -15.428 255 H ASN 35 HN ASN 35 49.315 18.597 -14.011 256 HA ASN 35 HA ASN 35 47.226 18.953 -16.146 257 1HB ASN 35 HB2 ASN 35 46.722 17.291 -13.628 258 2HB ASN 35 HB1 ASN 35 45.962 17.177 -15.178 259 1HD2 ASN 35 HD21 ASN 35 47.574 15.325 -13.322 260 2HD2 ASN 35 HD22 ASN 35 48.595 14.471 -14.360 261 H GLN 36 HN GLN 36 45.368 20.186 -15.685 262 HA GLN 36 HA GLN 36 45.458 21.844 -13.238 263 1HB GLN 36 HB2 GLN 36 43.436 21.789 -15.548 264 2HB GLN 36 HB1 GLN 36 43.523 23.019 -14.297 265 1HG GLN 36 HG2 GLN 36 45.797 23.661 -15.044 266 2HG GLN 36 HG1 GLN 36 45.743 22.431 -16.299 267 1HE2 GLN 36 HE21 GLN 36 45.565 23.623 -18.196 268 2HE2 GLN 36 HE22 GLN 36 44.396 24.821 -18.480 269 H ARG 37 HN ARG 37 45.043 20.459 -11.605 270 HA ARG 37 HA ARG 37 42.284 19.625 -11.145 271 1HB ARG 37 HB2 ARG 37 42.822 17.174 -10.888 272 2HB ARG 37 HB1 ARG 37 43.015 17.731 -12.529 273 1HG ARG 37 HG2 ARG 37 45.487 18.043 -12.115 274 2HG ARG 37 HG1 ARG 37 45.281 17.466 -10.479 275 1HD ARG 37 HD2 ARG 37 44.697 15.803 -12.958 276 2HD ARG 37 HD1 ARG 37 46.151 15.709 -11.970 277 HE ARG 37 HE ARG 37 43.570 15.328 -10.578 278 1HH1 ARG 37 HH11 ARG 37 46.420 13.910 -11.991 279 2HH1 ARG 37 HH12 ARG 37 46.215 12.416 -11.145 280 1HH2 ARG 37 HH21 ARG 37 43.313 13.437 -9.515 281 2HH2 ARG 37 HH22 ARG 37 44.442 12.141 -9.733 282 H CYS 38 HN CYS 38 42.393 17.948 -9.203 283 HA CYS 38 HA CYS 38 42.935 19.370 -6.871 284 1HB CYS 38 HB2 CYS 38 41.513 17.533 -6.667 285 2HB CYS 38 HB1 CYS 38 42.637 16.411 -7.387 286 H GLY 39 HN GLY 39 44.378 19.211 -5.221 287 1HA GLY 39 HA2 GLY 39 46.692 17.738 -4.940 288 2HA GLY 39 HA1 GLY 39 47.175 19.091 -5.957 289 H CYS 40 HN CYS 40 48.340 18.708 -3.539 290 HA CYS 40 HA CYS 40 47.100 19.974 -1.335 291 1HB CYS 40 HB2 CYS 40 50.021 19.726 -2.095 292 2HB CYS 40 HB1 CYS 40 49.476 20.335 -0.558 293 H ILE 41 HN ILE 41 47.363 21.973 -0.482 294 HA ILE 41 HA ILE 41 47.042 24.158 -2.308 295 HB ILE 41 HB ILE 41 47.876 24.385 0.620 296 1HG1 ILE 41 HG12 ILE 41 45.037 24.120 -0.570 297 2HG1 ILE 41 HG11 ILE 41 45.843 22.821 0.275 298 1HG2 ILE 41 HG21 ILE 41 47.876 26.529 -0.627 299 2HG2 ILE 41 HG22 ILE 41 46.578 26.517 0.532 300 3HG2 ILE 41 HG23 ILE 41 46.233 26.227 -1.163 301 1HD1 ILE 41 HD11 ILE 41 44.261 23.955 1.765 302 2HD1 ILE 41 HD12 ILE 41 45.067 25.490 1.521 303 3HD1 ILE 41 HD13 ILE 41 45.902 24.185 2.347 304 H SER 42 HN SER 42 48.388 26.018 -2.386 305 HA SER 42 HA SER 42 51.095 25.378 -3.163 306 1HB SER 42 HB2 SER 42 51.225 27.895 -3.639 307 2HB SER 42 HB1 SER 42 49.773 27.164 -4.336 308 HG SER 42 HG SER 42 50.064 28.736 -2.036 309 H GLY 43 HN GLY 43 52.289 24.702 -1.601 310 1HA GLY 43 HA2 GLY 43 54.102 25.686 -0.121 311 2HA GLY 43 HA1 GLY 43 52.795 26.428 0.798 312 H THR 44 HN THR 44 51.231 23.858 0.125 313 HA THR 44 HA THR 44 52.230 22.306 2.451 314 HB THR 44 HB THR 44 49.901 21.363 2.581 315 HG1 THR 44 HG1 THR 44 49.861 22.059 0.101 316 1HG2 THR 44 HG21 THR 44 49.843 24.396 2.202 317 2HG2 THR 44 HG22 THR 44 50.328 23.582 3.686 318 3HG2 THR 44 HG23 THR 44 48.678 23.437 3.103 319 H VAL 45 HN VAL 45 51.928 20.166 2.476 320 HA VAL 45 HA VAL 45 52.133 18.587 -0.038 321 HB VAL 45 HB VAL 45 53.911 17.175 1.125 322 1HG1 VAL 45 HG11 VAL 45 54.672 20.046 0.623 323 2HG1 VAL 45 HG12 VAL 45 54.561 18.770 -0.590 324 3HG1 VAL 45 HG13 VAL 45 55.780 18.674 0.671 325 1HG2 VAL 45 HG21 VAL 45 54.090 19.576 3.007 326 2HG2 VAL 45 HG22 VAL 45 55.206 18.230 2.983 327 3HG2 VAL 45 HG23 VAL 45 53.544 17.973 3.473 328 H LEU 46 HN LEU 46 51.222 16.577 0.141 329 HA LEU 46 HA LEU 46 49.097 16.213 1.953 330 1HB LEU 46 HB2 LEU 46 49.538 15.060 -0.300 331 2HB LEU 46 HB1 LEU 46 50.696 14.077 0.561 332 HG LEU 46 HG LEU 46 48.927 13.128 1.984 333 1HD1 LEU 46 HD11 LEU 46 46.533 13.657 1.471 334 2HD1 LEU 46 HD12 LEU 46 47.039 14.828 0.272 335 3HD1 LEU 46 HD13 LEU 46 47.360 15.110 1.974 336 1HD2 LEU 46 HD21 LEU 46 47.753 11.851 0.180 337 2HD2 LEU 46 HD22 LEU 46 49.460 12.026 -0.193 338 3HD2 LEU 46 HD23 LEU 46 48.274 13.035 -1.002 339 H LYS 47 HN LYS 47 49.035 15.465 3.978 340 HA LYS 47 HA LYS 47 51.122 15.460 5.755 341 1HB LYS 47 HB2 LYS 47 48.771 15.403 6.442 342 2HB LYS 47 HB1 LYS 47 48.606 13.758 5.880 343 1HG LYS 47 HG2 LYS 47 48.842 13.799 8.308 344 2HG LYS 47 HG1 LYS 47 50.233 13.004 7.612 345 1HD LYS 47 HD2 LYS 47 51.548 15.147 7.824 346 2HD LYS 47 HD1 LYS 47 50.139 15.922 8.526 347 1HE LYS 47 HE2 LYS 47 51.604 13.516 9.698 348 2HE LYS 47 HE1 LYS 47 51.722 15.170 10.280 349 1HZ LYS 47 HZ1 LYS 47 49.195 15.010 10.493 350 2HZ LYS 47 HZ2 LYS 47 50.164 14.235 11.653 351 3HZ LYS 47 HZ3 LYS 47 49.436 13.331 10.412 352 H SER 48 HN SER 48 50.100 12.678 3.875 353 HA SER 48 HA SER 48 52.682 11.339 4.452 354 1HB SER 48 HB2 SER 48 49.954 9.981 4.896 355 2HB SER 48 HB1 SER 48 51.528 9.188 5.052 356 HG SER 48 HG SER 48 50.560 11.404 6.518 357 H LYS 49 HN LYS 49 52.668 9.199 3.275 358 HA LYS 49 HA LYS 49 52.995 9.572 0.572 359 1HB LYS 49 HB2 LYS 49 53.741 7.590 1.884 360 2HB LYS 49 HB1 LYS 49 52.087 7.019 1.949 361 1HG LYS 49 HG2 LYS 49 52.032 6.826 -0.527 362 2HG LYS 49 HG1 LYS 49 53.677 7.438 -0.618 363 1HD LYS 49 HD2 LYS 49 54.464 5.490 0.731 364 2HD LYS 49 HD1 LYS 49 52.819 4.885 0.822 365 1HE LYS 49 HE2 LYS 49 54.400 5.285 -1.755 366 2HE LYS 49 HE1 LYS 49 54.083 3.739 -0.981 367 1HZ LYS 49 HZ1 LYS 49 51.655 4.361 -1.189 368 2HZ LYS 49 HZ2 LYS 49 52.474 3.931 -2.614 369 3HZ LYS 49 HZ3 LYS 49 52.166 5.566 -2.271 370 H ASP 50 HN ASP 50 50.029 9.026 2.239 371 HA ASP 50 HA ASP 50 48.469 9.800 -0.079 372 1HB ASP 50 HB2 ASP 50 48.949 7.396 -0.654 373 2HB ASP 50 HB1 ASP 50 48.252 6.892 0.872 374 H SER 51 HN SER 51 48.376 11.163 2.079 375 HA SER 51 HA SER 51 46.330 10.231 3.994 376 1HB SER 51 HB2 SER 51 48.386 11.551 4.710 377 2HB SER 51 HB1 SER 51 47.777 12.933 3.795 378 HG SER 51 HG SER 51 46.300 13.253 5.240 379 H SER 52 HN SER 52 45.125 12.858 4.333 380 HA SER 52 HA SER 52 43.542 13.254 1.827 381 1HB SER 52 HB2 SER 52 41.515 13.496 3.306 382 2HB SER 52 HB1 SER 52 42.224 11.883 3.468 383 HG SER 52 HG SER 52 42.883 14.110 5.094 384 H GLU 53 HN GLU 53 45.027 14.508 4.675 385 HA GLU 53 HA GLU 53 44.371 17.304 3.852 386 1HB GLU 53 HB2 GLU 53 45.156 16.216 6.591 387 2HB GLU 53 HB1 GLU 53 44.888 17.911 6.243 388 1HG GLU 53 HG2 GLU 53 42.791 15.702 5.990 389 2HG GLU 53 HG1 GLU 53 42.873 16.901 7.266 390 H CYS 54 HN CYS 54 45.923 18.632 3.332 391 HA CYS 54 HA CYS 54 48.732 17.647 3.408 392 1HB CYS 54 HB2 CYS 54 47.573 20.016 1.930 393 2HB CYS 54 HB1 CYS 54 49.169 19.367 1.749 394 H VAL 55 HN VAL 55 50.249 18.695 4.470 395 HA VAL 55 HA VAL 55 49.653 21.246 5.882 396 HB VAL 55 HB VAL 55 50.814 20.290 7.908 397 1HG1 VAL 55 HG11 VAL 55 49.025 18.718 8.620 398 2HG1 VAL 55 HG12 VAL 55 48.503 18.536 6.955 399 3HG1 VAL 55 HG13 VAL 55 48.325 20.083 7.767 400 1HG2 VAL 55 HG21 VAL 55 51.308 17.953 8.115 401 2HG2 VAL 55 HG22 VAL 55 52.278 18.724 6.876 402 3HG2 VAL 55 HG23 VAL 55 50.925 17.694 6.417 403 H HIS 56 HN HIS 56 51.473 22.560 6.182 404 HA HIS 56 HA HIS 56 53.453 22.449 4.147 405 1HB HIS 56 HB2 HIS 56 53.498 23.960 6.805 406 2HB HIS 56 HB1 HIS 56 54.572 24.295 5.462 407 HD1 HIS 56 HD1 HIS 56 53.475 25.477 3.446 408 HD2 HIS 56 HD2 HIS 56 50.795 24.793 6.446 409 HE1 HIS 56 HE1 HIS 56 51.467 26.800 2.897 410 HA PRO 57 HA PRO 57 56.559 19.674 5.689 411 1HB PRO 57 HB2 PRO 57 58.863 21.108 5.139 412 2HB PRO 57 HB1 PRO 57 57.937 20.229 3.945 413 1HG PRO 57 HG2 PRO 57 57.789 23.141 4.614 414 2HG PRO 57 HG1 PRO 57 57.916 22.368 3.024 415 1HD PRO 57 HD2 PRO 57 55.577 23.207 3.882 416 2HD PRO 57 HD1 PRO 57 55.695 21.636 3.067 417 H SER 58 HN SER 58 56.551 22.982 6.701 418 HA SER 58 HA SER 58 58.337 22.781 8.934 419 1HB SER 58 HB2 SER 58 57.348 25.030 9.543 420 2HB SER 58 HB1 SER 58 57.783 24.947 7.830 421 HG SER 58 HG SER 58 55.598 24.195 7.474 422 H LYS 59 HN LYS 59 55.060 21.865 8.568 423 HA LYS 59 HA LYS 59 54.738 21.576 11.529 424 1HB LYS 59 HB2 LYS 59 52.277 21.624 11.053 425 2HB LYS 59 HB1 LYS 59 53.159 23.106 10.687 426 1HG LYS 59 HG2 LYS 59 53.156 22.571 8.326 427 2HG LYS 59 HG1 LYS 59 52.465 21.001 8.635 428 1HD LYS 59 HD2 LYS 59 50.699 22.539 7.812 429 2HD LYS 59 HD1 LYS 59 50.374 22.155 9.479 430 1HE LYS 59 HE2 LYS 59 51.754 24.711 8.568 431 2HE LYS 59 HE1 LYS 59 50.042 24.583 8.929 432 1HZ LYS 59 HZ1 LYS 59 52.275 24.807 10.699 433 2HZ LYS 59 HZ2 LYS 59 51.204 23.561 11.137 434 3HZ LYS 59 HZ3 LYS 59 50.633 25.149 10.961 435 H CYS 60 HN CYS 60 54.762 19.893 8.553 436 HA CYS 60 HA CYS 60 53.253 17.611 8.952 437 1HB CYS 60 HB2 CYS 60 55.938 18.018 7.823 438 2HB CYS 60 HB1 CYS 60 55.295 16.399 7.816 Start of MODEL 15 1 1H ASN 1 HT1 ASN 1 33.306 19.878 -13.151 2 2H ASN 1 HT2 ASN 1 34.632 18.840 -13.378 3 3H ASN 1 HT3 ASN 1 34.877 20.516 -13.258 4 HA ASN 1 HA ASN 1 34.216 20.538 -10.994 5 1HB ASN 1 HB2 ASN 1 32.492 18.743 -11.137 6 2HB ASN 1 HB1 ASN 1 33.744 17.540 -11.399 7 1HD2 ASN 1 HD21 ASN 1 33.622 20.264 -9.026 8 2HD2 ASN 1 HD22 ASN 1 33.786 19.269 -7.661 9 H PHE 2 HN PHE 2 35.719 20.212 -9.396 10 HA PHE 2 HA PHE 2 37.976 18.410 -9.655 11 1HB PHE 2 HB2 PHE 2 39.685 20.310 -9.846 12 2HB PHE 2 HB1 PHE 2 38.705 20.115 -11.283 13 HD1 PHE 2 HD1 PHE 2 37.228 21.834 -12.016 14 HD2 PHE 2 HD2 PHE 2 39.086 22.215 -8.195 15 HE1 PHE 2 HE1 PHE 2 36.459 24.155 -11.865 16 HE2 PHE 2 HE2 PHE 2 38.313 24.527 -8.053 17 HZ PHE 2 HZ PHE 2 36.998 25.508 -9.884 18 H VAL 3 HN VAL 3 35.910 19.225 -7.786 19 HA VAL 3 HA VAL 3 36.896 20.693 -5.566 20 HB VAL 3 HB VAL 3 34.514 20.042 -5.891 21 1HG1 VAL 3 HG11 VAL 3 33.743 17.742 -5.366 22 2HG1 VAL 3 HG12 VAL 3 35.400 17.214 -5.156 23 3HG1 VAL 3 HG13 VAL 3 34.839 17.731 -6.735 24 1HG2 VAL 3 HG21 VAL 3 33.987 19.439 -3.542 25 2HG2 VAL 3 HG22 VAL 3 35.236 20.670 -3.618 26 3HG2 VAL 3 HG23 VAL 3 35.663 19.004 -3.269 27 H CYS 4 HN CYS 4 38.038 20.293 -3.903 28 HA CYS 4 HA CYS 4 39.744 17.894 -3.829 29 1HB CYS 4 HB2 CYS 4 39.736 20.461 -2.352 30 2HB CYS 4 HB1 CYS 4 40.938 19.250 -2.060 31 HA PRO 5 HA PRO 5 38.254 17.200 0.512 32 1HB PRO 5 HB2 PRO 5 40.700 16.039 1.369 33 2HB PRO 5 HB1 PRO 5 39.249 15.203 0.920 34 1HG PRO 5 HG2 PRO 5 41.605 15.047 -0.532 35 2HG PRO 5 HG1 PRO 5 40.001 14.701 -1.199 36 1HD PRO 5 HD2 PRO 5 41.589 17.248 -1.335 37 2HD PRO 5 HD1 PRO 5 40.706 16.445 -2.642 38 HA PRO 6 HA PRO 6 40.040 20.333 3.159 39 1HB PRO 6 HB2 PRO 6 40.958 18.768 5.293 40 2HB PRO 6 HB1 PRO 6 39.324 19.354 5.096 41 1HG PRO 6 HG2 PRO 6 40.431 16.686 4.225 42 2HG PRO 6 HG1 PRO 6 38.939 17.015 5.123 43 1HD PRO 6 HD2 PRO 6 38.786 16.524 2.631 44 2HD PRO 6 HD1 PRO 6 37.904 17.940 3.205 45 H GLY 7 HN GLY 7 41.985 21.310 3.429 46 1HA GLY 7 HA2 GLY 7 44.322 21.549 3.613 47 2HA GLY 7 HA1 GLY 7 44.488 19.814 3.501 48 H GLN 8 HN GLN 8 42.759 20.173 0.849 49 HA GLN 8 HA GLN 8 45.107 20.920 -0.841 50 1HB GLN 8 HB2 GLN 8 42.913 18.908 -1.502 51 2HB GLN 8 HB1 GLN 8 44.256 19.365 -2.527 52 1HG GLN 8 HG2 GLN 8 44.747 17.212 -1.600 53 2HG GLN 8 HG1 GLN 8 45.856 18.384 -0.935 54 1HE2 GLN 8 HE21 GLN 8 43.174 16.202 -0.149 55 2HE2 GLN 8 HE22 GLN 8 43.305 16.387 1.526 56 H THR 9 HN THR 9 44.672 21.785 -2.835 57 HA THR 9 HA THR 9 42.062 23.127 -3.292 58 HB THR 9 HB THR 9 43.431 24.749 -2.084 59 HG1 THR 9 HG1 THR 9 43.616 26.293 -3.788 60 1HG2 THR 9 HG21 THR 9 45.694 23.697 -2.706 61 2HG2 THR 9 HG22 THR 9 45.657 25.429 -2.998 62 3HG2 THR 9 HG23 THR 9 45.477 24.293 -4.334 63 H PHE 10 HN PHE 10 42.158 24.301 -5.426 64 HA PHE 10 HA PHE 10 42.732 22.356 -7.506 65 1HB PHE 10 HB2 PHE 10 40.767 23.874 -7.622 66 2HB PHE 10 HB1 PHE 10 41.841 25.258 -7.768 67 HD1 PHE 10 HD1 PHE 10 41.085 21.970 -9.360 68 HD2 PHE 10 HD2 PHE 10 42.585 25.912 -9.951 69 HE1 PHE 10 HE1 PHE 10 41.199 21.561 -11.760 70 HE2 PHE 10 HE2 PHE 10 42.709 25.495 -12.366 71 HZ PHE 10 HZ PHE 10 42.019 23.318 -13.280 72 H GLN 11 HN GLN 11 44.149 22.516 -9.240 73 HA GLN 11 HA GLN 11 46.190 24.620 -9.384 74 1HB GLN 11 HB2 GLN 11 46.903 21.659 -8.913 75 2HB GLN 11 HB1 GLN 11 48.067 22.920 -9.294 76 1HG GLN 11 HG2 GLN 11 47.301 24.158 -7.214 77 2HG GLN 11 HG1 GLN 11 46.302 22.771 -6.812 78 1HE2 GLN 11 HE21 GLN 11 48.215 23.767 -5.136 79 2HE2 GLN 11 HE22 GLN 11 49.453 22.642 -4.905 80 H THR 12 HN THR 12 47.555 24.243 -11.253 81 HA THR 12 HA THR 12 45.870 23.177 -13.455 82 HB THR 12 HB THR 12 48.074 25.305 -13.527 83 HG1 THR 12 HG1 THR 12 46.125 25.759 -12.371 84 1HG2 THR 12 HG21 THR 12 47.541 24.113 -15.760 85 2HG2 THR 12 HG22 THR 12 47.072 25.808 -15.729 86 3HG2 THR 12 HG23 THR 12 45.856 24.554 -15.509 87 H CYS 13 HN CYS 13 49.287 23.108 -12.362 88 HA CYS 13 HA CYS 13 49.595 20.840 -14.270 89 1HB CYS 13 HB2 CYS 13 50.809 22.743 -15.033 90 2HB CYS 13 HB1 CYS 13 51.738 22.832 -13.555 91 H ALA 14 HN ALA 14 49.465 19.112 -13.079 92 HA ALA 14 HA ALA 14 51.765 18.372 -11.492 93 1HB ALA 14 HB1 ALA 14 50.454 17.952 -9.398 94 2HB ALA 14 HB2 ALA 14 49.034 18.654 -10.175 95 3HB ALA 14 HB3 ALA 14 50.437 19.656 -9.838 96 H SER 15 HN SER 15 52.189 16.257 -11.650 97 HA SER 15 HA SER 15 50.307 14.554 -13.121 98 1HB SER 15 HB2 SER 15 52.969 14.403 -13.238 99 2HB SER 15 HB1 SER 15 52.816 13.508 -11.742 100 HG SER 15 HG SER 15 51.988 11.908 -12.687 101 H SER 16 HN SER 16 50.816 12.102 -11.755 102 HA SER 16 HA SER 16 49.033 12.420 -9.420 103 1HB SER 16 HB2 SER 16 48.418 10.783 -11.246 104 2HB SER 16 HB1 SER 16 49.917 9.899 -10.929 105 HG SER 16 HG SER 16 49.173 9.266 -9.038 106 H CYS 17 HN CYS 17 51.940 13.149 -9.332 107 HA CYS 17 HA CYS 17 52.928 11.066 -7.393 108 1HB CYS 17 HB2 CYS 17 55.118 11.761 -7.811 109 2HB CYS 17 HB1 CYS 17 54.361 11.649 -9.364 110 HA PRO 18 HA PRO 18 51.038 14.652 -5.167 111 1HB PRO 18 HB2 PRO 18 50.663 13.352 -2.745 112 2HB PRO 18 HB1 PRO 18 49.527 13.332 -4.070 113 1HG PRO 18 HG2 PRO 18 51.618 11.308 -3.385 114 2HG PRO 18 HG1 PRO 18 49.926 11.055 -3.859 115 1HD PRO 18 HD2 PRO 18 51.854 10.700 -5.624 116 2HD PRO 18 HD1 PRO 18 50.348 11.522 -6.096 117 H LYS 19 HN LYS 19 51.790 16.157 -3.799 118 HA LYS 19 HA LYS 19 54.580 15.918 -2.896 119 1HB LYS 19 HB2 LYS 19 53.678 18.002 -3.979 120 2HB LYS 19 HB1 LYS 19 52.609 18.245 -2.611 121 1HG LYS 19 HG2 LYS 19 54.811 18.087 -1.167 122 2HG LYS 19 HG1 LYS 19 55.638 18.272 -2.689 123 1HD LYS 19 HD2 LYS 19 54.433 20.405 -3.149 124 2HD LYS 19 HD1 LYS 19 53.616 20.256 -1.617 125 1HE LYS 19 HE2 LYS 19 55.727 20.343 -0.375 126 2HE LYS 19 HE1 LYS 19 56.651 20.382 -1.852 127 1HZ LYS 19 HZ1 LYS 19 56.457 22.565 -1.798 128 2HZ LYS 19 HZ2 LYS 19 55.432 22.492 -0.445 129 3HZ LYS 19 HZ3 LYS 19 54.778 22.422 -2.011 130 H THR 20 HN THR 20 54.793 14.861 -1.066 131 HA THR 20 HA THR 20 52.860 15.357 1.152 132 HB THR 20 HB THR 20 53.346 12.996 1.858 133 HG1 THR 20 HG1 THR 20 55.039 13.256 -0.401 134 1HG2 THR 20 HG21 THR 20 52.391 11.790 -0.136 135 2HG2 THR 20 HG22 THR 20 52.814 13.109 -1.191 136 3HG2 THR 20 HG23 THR 20 51.551 13.305 0.001 137 H CYS 21 HN CYS 21 53.925 14.548 3.279 138 HA CYS 21 HA CYS 21 55.978 16.400 3.958 139 1HB CYS 21 HB2 CYS 21 55.204 13.792 5.291 140 2HB CYS 21 HB1 CYS 21 56.167 15.029 6.033 141 H GLU 22 HN GLU 22 56.014 13.311 2.552 142 HA GLU 22 HA GLU 22 58.758 12.567 3.065 143 1HB GLU 22 HB2 GLU 22 56.952 10.981 2.329 144 2HB GLU 22 HB1 GLU 22 56.884 11.792 0.783 145 1HG GLU 22 HG2 GLU 22 59.334 10.338 1.858 146 2HG GLU 22 HG1 GLU 22 58.218 9.661 0.696 147 H THR 23 HN THR 23 57.109 14.195 0.318 148 HA THR 23 HA THR 23 59.642 14.775 -1.037 149 HB THR 23 HB THR 23 58.171 16.136 -2.620 150 HG1 THR 23 HG1 THR 23 56.487 16.796 -1.542 151 1HG2 THR 23 HG21 THR 23 56.973 13.404 -1.990 152 2HG2 THR 23 HG22 THR 23 58.386 13.652 -3.014 153 3HG2 THR 23 HG23 THR 23 56.825 14.299 -3.497 154 H ARG 24 HN ARG 24 57.163 17.209 -0.244 155 HA ARG 24 HA ARG 24 57.290 19.311 0.688 156 1HB ARG 24 HB2 ARG 24 60.009 18.440 1.742 157 2HB ARG 24 HB1 ARG 24 59.125 19.874 2.185 158 1HG ARG 24 HG2 ARG 24 57.304 18.552 3.109 159 2HG ARG 24 HG1 ARG 24 58.069 17.071 2.549 160 1HD ARG 24 HD2 ARG 24 59.993 17.432 4.035 161 2HD ARG 24 HD1 ARG 24 59.383 19.005 4.523 162 HE ARG 24 HE ARG 24 57.584 16.719 5.024 163 1HH1 ARG 24 HH11 ARG 24 60.038 18.847 6.262 164 2HH1 ARG 24 HH12 ARG 24 59.631 18.522 7.912 165 1HH2 ARG 24 HH21 ARG 24 57.072 16.303 7.109 166 2HH2 ARG 24 HH22 ARG 24 57.940 17.067 8.399 167 H ASN 25 HN ASN 25 59.604 18.176 -1.381 168 HA ASN 25 HA ASN 25 61.307 20.320 -1.855 169 1HB ASN 25 HB2 ASN 25 60.353 17.961 -3.513 170 2HB ASN 25 HB1 ASN 25 61.676 18.952 -4.048 171 1HD2 ASN 25 HD21 ASN 25 60.947 16.158 -2.405 172 2HD2 ASN 25 HD22 ASN 25 62.349 16.000 -1.462 173 H LYS 26 HN LYS 26 59.348 19.272 -4.430 174 HA LYS 26 HA LYS 26 59.077 21.701 -5.805 175 1HB LYS 26 HB2 LYS 26 57.578 20.259 -7.237 176 2HB LYS 26 HB1 LYS 26 59.110 19.489 -6.868 177 1HG LYS 26 HG2 LYS 26 57.814 18.369 -4.862 178 2HG LYS 26 HG1 LYS 26 56.375 18.908 -5.699 179 1HD LYS 26 HD2 LYS 26 58.555 17.170 -6.847 180 2HD LYS 26 HD1 LYS 26 56.983 16.610 -6.315 181 1HE LYS 26 HE2 LYS 26 55.942 18.128 -8.087 182 2HE LYS 26 HE1 LYS 26 57.563 18.503 -8.638 183 1HZ LYS 26 HZ1 LYS 26 57.296 16.776 -9.964 184 2HZ LYS 26 HZ2 LYS 26 56.021 16.126 -9.056 185 3HZ LYS 26 HZ3 LYS 26 57.628 15.832 -8.591 186 H LEU 27 HN LEU 27 57.817 23.209 -5.563 187 HA LEU 27 HA LEU 27 55.727 23.372 -3.535 188 1HB LEU 27 HB2 LEU 27 56.584 25.426 -5.612 189 2HB LEU 27 HB1 LEU 27 55.447 25.748 -4.323 190 HG LEU 27 HG LEU 27 57.241 25.274 -2.635 191 1HD1 LEU 27 HD11 LEU 27 59.125 25.239 -5.028 192 2HD1 LEU 27 HD12 LEU 27 58.794 23.871 -3.985 193 3HD1 LEU 27 HD13 LEU 27 59.611 25.269 -3.341 194 1HD2 LEU 27 HD21 LEU 27 58.442 27.424 -3.006 195 2HD2 LEU 27 HD22 LEU 27 56.725 27.584 -3.325 196 3HD2 LEU 27 HD23 LEU 27 57.857 27.461 -4.661 197 H VAL 28 HN VAL 28 55.013 21.595 -5.293 198 HA VAL 28 HA VAL 28 52.272 22.335 -6.041 199 HB VAL 28 HB VAL 28 52.485 21.352 -8.336 200 1HG1 VAL 28 HG11 VAL 28 54.307 23.793 -7.931 201 2HG1 VAL 28 HG12 VAL 28 52.561 23.852 -8.117 202 3HG1 VAL 28 HG13 VAL 28 53.573 23.319 -9.447 203 1HG2 VAL 28 HG21 VAL 28 54.785 21.158 -9.354 204 2HG2 VAL 28 HG22 VAL 28 54.608 20.074 -7.988 205 3HG2 VAL 28 HG23 VAL 28 55.500 21.572 -7.807 206 H LEU 29 HN LEU 29 51.015 20.519 -6.557 207 HA LEU 29 HA LEU 29 51.348 18.374 -4.832 208 1HB LEU 29 HB2 LEU 29 49.225 18.959 -5.875 209 2HB LEU 29 HB1 LEU 29 49.840 18.569 -7.457 210 HG LEU 29 HG LEU 29 50.117 16.133 -6.598 211 1HD1 LEU 29 HD11 LEU 29 48.866 15.501 -4.551 212 2HD1 LEU 29 HD12 LEU 29 48.472 17.183 -4.256 213 3HD1 LEU 29 HD13 LEU 29 50.132 16.646 -4.164 214 1HD2 LEU 29 HD21 LEU 29 48.211 16.722 -8.016 215 2HD2 LEU 29 HD22 LEU 29 47.294 17.223 -6.608 216 3HD2 LEU 29 HD23 LEU 29 47.740 15.541 -6.804 217 H CYS 30 HN CYS 30 52.129 18.697 -8.085 218 HA CYS 30 HA CYS 30 54.368 16.838 -8.037 219 1HB CYS 30 HB2 CYS 30 52.471 15.263 -8.278 220 2HB CYS 30 HB1 CYS 30 51.918 16.138 -9.668 221 H ASP 31 HN ASP 31 55.294 16.691 -10.365 222 HA ASP 31 HA ASP 31 54.632 19.110 -11.975 223 1HB ASP 31 HB2 ASP 31 56.453 19.718 -10.436 224 2HB ASP 31 HB1 ASP 31 57.417 18.378 -11.028 225 H LYS 32 HN LYS 32 55.641 15.852 -11.898 226 HA LYS 32 HA LYS 32 56.983 15.504 -14.348 227 1HB LYS 32 HB2 LYS 32 55.035 13.579 -13.006 228 2HB LYS 32 HB1 LYS 32 56.258 13.134 -14.175 229 1HG LYS 32 HG2 LYS 32 56.789 14.315 -11.412 230 2HG LYS 32 HG1 LYS 32 57.003 12.642 -11.871 231 1HD LYS 32 HD2 LYS 32 58.760 13.308 -13.516 232 2HD LYS 32 HD1 LYS 32 58.564 14.989 -13.044 233 1HE LYS 32 HE2 LYS 32 59.202 14.435 -10.713 234 2HE LYS 32 HE1 LYS 32 59.417 12.750 -11.172 235 1HZ LYS 32 HZ1 LYS 32 61.518 13.704 -11.255 236 2HZ LYS 32 HZ2 LYS 32 60.969 15.096 -12.060 237 3HZ LYS 32 HZ3 LYS 32 61.029 13.609 -12.879 238 H LYS 33 HN LYS 33 53.695 16.212 -13.859 239 HA LYS 33 HA LYS 33 53.152 16.349 -16.734 240 1HB LYS 33 HB2 LYS 33 52.550 13.969 -16.216 241 2HB LYS 33 HB1 LYS 33 51.560 14.507 -14.880 242 1HG LYS 33 HG2 LYS 33 50.150 13.950 -16.743 243 2HG LYS 33 HG1 LYS 33 50.012 15.642 -16.363 244 1HD LYS 33 HD2 LYS 33 51.663 16.117 -18.288 245 2HD LYS 33 HD1 LYS 33 51.621 14.405 -18.652 246 1HE LYS 33 HE2 LYS 33 50.014 15.663 -20.073 247 2HE LYS 33 HE1 LYS 33 49.163 14.536 -19.026 248 1HZ LYS 33 HZ1 LYS 33 49.628 17.287 -18.112 249 2HZ LYS 33 HZ2 LYS 33 48.385 16.209 -17.699 250 3HZ LYS 33 HZ3 LYS 33 48.377 16.971 -19.217 251 H CYS 34 HN CYS 34 51.055 17.380 -17.134 252 HA CYS 34 HA CYS 34 50.423 19.225 -14.912 253 1HB CYS 34 HB2 CYS 34 50.204 19.593 -17.847 254 2HB CYS 34 HB1 CYS 34 49.590 20.729 -16.675 255 H ASN 35 HN ASN 35 48.980 17.688 -14.157 256 HA ASN 35 HA ASN 35 46.356 17.392 -15.559 257 1HB ASN 35 HB2 ASN 35 46.979 16.428 -12.712 258 2HB ASN 35 HB1 ASN 35 45.655 15.952 -13.737 259 1HD2 ASN 35 HD21 ASN 35 47.845 14.357 -12.472 260 2HD2 ASN 35 HD22 ASN 35 48.521 13.440 -13.725 261 H GLN 36 HN GLN 36 45.065 19.106 -15.402 262 HA GLN 36 HA GLN 36 45.256 21.048 -13.185 263 1HB GLN 36 HB2 GLN 36 43.484 22.240 -14.655 264 2HB GLN 36 HB1 GLN 36 45.063 22.028 -15.357 265 1HG GLN 36 HG2 GLN 36 43.311 21.575 -17.017 266 2HG GLN 36 HG1 GLN 36 44.255 20.137 -16.734 267 1HE2 GLN 36 HE21 GLN 36 41.115 21.663 -16.048 268 2HE2 GLN 36 HE22 GLN 36 40.298 20.212 -15.720 269 H ARG 37 HN ARG 37 44.737 19.505 -11.684 270 HA ARG 37 HA ARG 37 41.822 19.411 -11.056 271 1HB ARG 37 HB2 ARG 37 42.144 17.081 -10.197 272 2HB ARG 37 HB1 ARG 37 42.494 17.190 -11.892 273 1HG ARG 37 HG2 ARG 37 44.949 17.344 -11.383 274 2HG ARG 37 HG1 ARG 37 44.590 17.205 -9.671 275 1HD ARG 37 HD2 ARG 37 43.542 14.977 -10.076 276 2HD ARG 37 HD1 ARG 37 43.914 15.139 -11.793 277 HE ARG 37 HE ARG 37 46.218 15.434 -9.998 278 1HH1 ARG 37 HH11 ARG 37 44.280 13.292 -11.931 279 2HH1 ARG 37 HH12 ARG 37 45.541 12.117 -12.076 280 1HH2 ARG 37 HH21 ARG 37 47.804 13.957 -10.172 281 2HH2 ARG 37 HH22 ARG 37 47.564 12.496 -11.071 282 H CYS 38 HN CYS 38 42.421 18.006 -8.581 283 HA CYS 38 HA CYS 38 43.089 20.334 -6.975 284 1HB CYS 38 HB2 CYS 38 41.421 18.650 -6.256 285 2HB CYS 38 HB1 CYS 38 42.697 17.457 -6.101 286 H GLY 39 HN GLY 39 44.614 20.000 -5.032 287 1HA GLY 39 HA2 GLY 39 46.888 18.412 -4.943 288 2HA GLY 39 HA1 GLY 39 47.318 19.793 -5.961 289 H CYS 40 HN CYS 40 48.131 18.949 -3.117 290 HA CYS 40 HA CYS 40 47.119 20.469 -1.075 291 1HB CYS 40 HB2 CYS 40 50.091 20.153 -1.569 292 2HB CYS 40 HB1 CYS 40 49.334 20.624 -0.095 293 H ILE 41 HN ILE 41 47.730 22.355 -0.051 294 HA ILE 41 HA ILE 41 47.777 24.653 -1.800 295 HB ILE 41 HB ILE 41 48.753 24.853 1.067 296 1HG1 ILE 41 HG12 ILE 41 46.722 23.454 1.334 297 2HG1 ILE 41 HG11 ILE 41 46.423 25.067 1.918 298 1HG2 ILE 41 HG21 ILE 41 48.759 26.834 -0.360 299 2HG2 ILE 41 HG22 ILE 41 47.561 27.028 0.906 300 3HG2 ILE 41 HG23 ILE 41 47.060 26.615 -0.729 301 1HD1 ILE 41 HD11 ILE 41 45.522 23.973 -0.754 302 2HD1 ILE 41 HD12 ILE 41 45.209 25.612 -0.197 303 3HD1 ILE 41 HD13 ILE 41 44.501 24.241 0.638 304 H SER 42 HN SER 42 49.536 26.136 -1.996 305 HA SER 42 HA SER 42 52.140 24.801 -2.261 306 1HB SER 42 HB2 SER 42 51.300 27.720 -2.813 307 2HB SER 42 HB1 SER 42 52.851 27.007 -3.297 308 HG SER 42 HG SER 42 51.737 25.487 -4.501 309 H GLY 43 HN GLY 43 52.576 24.295 -0.238 310 1HA GLY 43 HA2 GLY 43 54.381 25.497 1.322 311 2HA GLY 43 HA1 GLY 43 52.912 26.305 1.898 312 H THR 44 HN THR 44 51.390 23.819 1.154 313 HA THR 44 HA THR 44 51.955 22.246 3.618 314 HB THR 44 HB THR 44 49.568 21.493 3.461 315 HG1 THR 44 HG1 THR 44 49.923 22.161 0.971 316 1HG2 THR 44 HG21 THR 44 49.757 24.502 3.009 317 2HG2 THR 44 HG22 THR 44 49.982 23.709 4.564 318 3HG2 THR 44 HG23 THR 44 48.420 23.636 3.759 319 H VAL 45 HN VAL 45 51.605 20.063 3.511 320 HA VAL 45 HA VAL 45 51.866 18.727 0.877 321 HB VAL 45 HB VAL 45 53.684 17.278 1.802 322 1HG1 VAL 45 HG11 VAL 45 54.112 19.118 0.318 323 2HG1 VAL 45 HG12 VAL 45 55.440 18.927 1.457 324 3HG1 VAL 45 HG13 VAL 45 54.278 20.237 1.657 325 1HG2 VAL 45 HG21 VAL 45 55.060 18.153 3.688 326 2HG2 VAL 45 HG22 VAL 45 53.448 17.781 4.268 327 3HG2 VAL 45 HG23 VAL 45 53.920 19.446 3.942 328 H LEU 46 HN LEU 46 50.729 17.092 0.667 329 HA LEU 46 HA LEU 46 48.740 16.161 2.386 330 1HB LEU 46 HB2 LEU 46 48.893 15.806 -0.093 331 2HB LEU 46 HB1 LEU 46 50.168 14.654 0.152 332 HG LEU 46 HG LEU 46 48.532 13.256 1.507 333 1HD1 LEU 46 HD11 LEU 46 46.537 15.333 0.473 334 2HD1 LEU 46 HD12 LEU 46 46.975 15.118 2.159 335 3HD1 LEU 46 HD13 LEU 46 46.105 13.864 1.311 336 1HD2 LEU 46 HD21 LEU 46 47.247 12.458 -0.463 337 2HD2 LEU 46 HD22 LEU 46 48.922 12.768 -0.890 338 3HD2 LEU 46 HD23 LEU 46 47.675 13.919 -1.340 339 H LYS 47 HN LYS 47 49.258 15.633 4.346 340 HA LYS 47 HA LYS 47 51.106 14.877 5.870 341 1HB LYS 47 HB2 LYS 47 48.787 14.678 6.528 342 2HB LYS 47 HB1 LYS 47 48.571 13.256 5.556 343 1HG LYS 47 HG2 LYS 47 48.597 12.584 7.852 344 2HG LYS 47 HG1 LYS 47 50.046 11.973 7.118 345 1HD LYS 47 HD2 LYS 47 49.929 14.442 8.887 346 2HD LYS 47 HD1 LYS 47 50.354 12.846 9.449 347 1HE LYS 47 HE2 LYS 47 52.354 12.875 7.923 348 2HE LYS 47 HE1 LYS 47 51.965 14.536 7.498 349 1HZ LYS 47 HZ1 LYS 47 52.014 15.063 9.881 350 2HZ LYS 47 HZ2 LYS 47 53.506 14.652 9.187 351 3HZ LYS 47 HZ3 LYS 47 52.678 13.523 10.148 352 H SER 48 HN SER 48 49.860 12.243 3.860 353 HA SER 48 HA SER 48 52.552 10.946 3.908 354 1HB SER 48 HB2 SER 48 49.837 9.545 4.303 355 2HB SER 48 HB1 SER 48 51.396 8.712 4.185 356 HG SER 48 HG SER 48 50.971 10.827 6.001 357 H LYS 49 HN LYS 49 52.504 9.077 2.393 358 HA LYS 49 HA LYS 49 52.710 9.869 -0.200 359 1HB LYS 49 HB2 LYS 49 51.824 7.128 0.769 360 2HB LYS 49 HB1 LYS 49 52.470 7.438 -0.824 361 1HG LYS 49 HG2 LYS 49 54.041 7.988 1.725 362 2HG LYS 49 HG1 LYS 49 54.091 6.460 0.894 363 1HD LYS 49 HD2 LYS 49 56.068 7.782 0.339 364 2HD LYS 49 HD1 LYS 49 55.103 7.513 -1.089 365 1HE LYS 49 HE2 LYS 49 54.345 9.808 -1.106 366 2HE LYS 49 HE1 LYS 49 55.082 10.137 0.467 367 1HZ LYS 49 HZ1 LYS 49 56.245 9.810 -2.191 368 2HZ LYS 49 HZ2 LYS 49 57.172 9.284 -0.870 369 3HZ LYS 49 HZ3 LYS 49 56.653 10.899 -0.954 370 H ASP 50 HN ASP 50 49.754 9.187 1.365 371 HA ASP 50 HA ASP 50 48.257 10.320 -0.825 372 1HB ASP 50 HB2 ASP 50 48.681 8.006 -1.768 373 2HB ASP 50 HB1 ASP 50 47.940 7.298 -0.347 374 H SER 51 HN SER 51 48.212 11.273 1.530 375 HA SER 51 HA SER 51 46.150 10.155 3.315 376 1HB SER 51 HB2 SER 51 48.188 11.410 4.131 377 2HB SER 51 HB1 SER 51 47.548 12.883 3.389 378 HG SER 51 HG SER 51 46.128 13.024 4.911 379 H SER 52 HN SER 52 45.032 12.844 3.869 380 HA SER 52 HA SER 52 43.487 13.566 1.472 381 1HB SER 52 HB2 SER 52 41.299 13.211 2.707 382 2HB SER 52 HB1 SER 52 42.182 11.685 2.551 383 HG SER 52 HG SER 52 43.155 12.224 4.610 384 H GLU 53 HN GLU 53 45.359 14.547 3.761 385 HA GLU 53 HA GLU 53 44.261 17.281 3.928 386 1HB GLU 53 HB2 GLU 53 44.990 15.676 6.428 387 2HB GLU 53 HB1 GLU 53 44.597 17.386 6.403 388 1HG GLU 53 HG2 GLU 53 42.310 16.825 5.529 389 2HG GLU 53 HG1 GLU 53 42.703 15.115 5.640 390 H CYS 54 HN CYS 54 45.841 18.602 3.535 391 HA CYS 54 HA CYS 54 48.649 17.654 3.684 392 1HB CYS 54 HB2 CYS 54 47.540 20.172 2.442 393 2HB CYS 54 HB1 CYS 54 49.138 19.524 2.223 394 H VAL 55 HN VAL 55 50.050 18.430 5.024 395 HA VAL 55 HA VAL 55 49.422 20.821 6.697 396 HB VAL 55 HB VAL 55 50.517 19.657 8.584 397 1HG1 VAL 55 HG11 VAL 55 48.757 17.936 9.047 398 2HG1 VAL 55 HG12 VAL 55 48.291 17.965 7.354 399 3HG1 VAL 55 HG13 VAL 55 48.048 19.386 8.357 400 1HG2 VAL 55 HG21 VAL 55 51.084 17.320 8.579 401 2HG2 VAL 55 HG22 VAL 55 52.088 18.271 7.508 402 3HG2 VAL 55 HG23 VAL 55 50.820 17.249 6.839 403 H HIS 56 HN HIS 56 51.178 22.146 7.137 404 HA HIS 56 HA HIS 56 53.240 22.299 5.217 405 1HB HIS 56 HB2 HIS 56 53.188 23.442 8.054 406 2HB HIS 56 HB1 HIS 56 54.294 23.959 6.796 407 HD1 HIS 56 HD1 HIS 56 53.198 25.300 4.850 408 HD2 HIS 56 HD2 HIS 56 50.530 24.359 7.792 409 HE1 HIS 56 HE1 HIS 56 51.195 26.678 4.434 410 HA PRO 57 HA PRO 57 56.312 19.369 6.457 411 1HB PRO 57 HB2 PRO 57 58.628 20.804 6.026 412 2HB PRO 57 HB1 PRO 57 57.653 20.111 4.749 413 1HG PRO 57 HG2 PRO 57 57.601 22.919 5.785 414 2HG PRO 57 HG1 PRO 57 57.683 22.348 4.107 415 1HD PRO 57 HD2 PRO 57 55.385 23.132 5.132 416 2HD PRO 57 HD1 PRO 57 55.445 21.705 4.079 417 H SER 58 HN SER 58 56.204 22.510 7.841 418 HA SER 58 HA SER 58 58.034 22.077 10.034 419 1HB SER 58 HB2 SER 58 57.085 24.279 10.849 420 2HB SER 58 HB1 SER 58 57.542 24.351 9.139 421 HG SER 58 HG SER 58 55.339 23.678 8.696 422 H LYS 59 HN LYS 59 54.698 21.342 9.553 423 HA LYS 59 HA LYS 59 54.324 20.824 12.475 424 1HB LYS 59 HB2 LYS 59 51.907 20.788 11.942 425 2HB LYS 59 HB1 LYS 59 52.656 22.349 11.615 426 1HG LYS 59 HG2 LYS 59 52.781 21.777 9.235 427 2HG LYS 59 HG1 LYS 59 52.061 20.219 9.562 428 1HD LYS 59 HD2 LYS 59 50.791 22.978 10.036 429 2HD LYS 59 HD1 LYS 59 50.356 21.901 8.732 430 1HE LYS 59 HE2 LYS 59 49.540 20.215 10.424 431 2HE LYS 59 HE1 LYS 59 49.903 21.370 11.696 432 1HZ LYS 59 HZ1 LYS 59 47.616 21.495 11.084 433 2HZ LYS 59 HZ2 LYS 59 48.021 21.800 9.463 434 3HZ LYS 59 HZ3 LYS 59 48.405 22.939 10.663 435 H CYS 60 HN CYS 60 54.500 19.326 9.403 436 HA CYS 60 HA CYS 60 53.090 16.957 9.611 437 1HB CYS 60 HB2 CYS 60 55.755 17.617 8.591 438 2HB CYS 60 HB1 CYS 60 55.283 15.948 8.455 Start of MODEL 16 1 1H ASN 1 HT1 ASN 1 32.573 16.573 -11.680 2 2H ASN 1 HT2 ASN 1 33.188 17.465 -12.988 3 3H ASN 1 HT3 ASN 1 31.682 17.871 -12.314 4 HA ASN 1 HA ASN 1 33.271 19.445 -11.559 5 1HB ASN 1 HB2 ASN 1 33.067 19.070 -9.083 6 2HB ASN 1 HB1 ASN 1 31.562 18.680 -9.898 7 1HD2 ASN 1 HD21 ASN 1 34.526 17.168 -8.572 8 2HD2 ASN 1 HD22 ASN 1 33.810 15.661 -8.262 9 H PHE 2 HN PHE 2 35.003 19.468 -9.628 10 HA PHE 2 HA PHE 2 37.086 17.423 -9.895 11 1HB PHE 2 HB2 PHE 2 38.805 19.097 -10.700 12 2HB PHE 2 HB1 PHE 2 37.526 18.870 -11.875 13 HD1 PHE 2 HD1 PHE 2 35.737 20.608 -12.129 14 HD2 PHE 2 HD2 PHE 2 39.088 21.243 -9.574 15 HE1 PHE 2 HE1 PHE 2 35.250 23.009 -12.081 16 HE2 PHE 2 HE2 PHE 2 38.596 23.644 -9.531 17 HZ PHE 2 HZ PHE 2 36.678 24.533 -10.782 18 H VAL 3 HN VAL 3 35.384 18.541 -7.854 19 HA VAL 3 HA VAL 3 36.835 20.280 -6.078 20 HB VAL 3 HB VAL 3 34.363 19.887 -5.973 21 1HG1 VAL 3 HG11 VAL 3 34.312 17.460 -6.432 22 2HG1 VAL 3 HG12 VAL 3 33.463 17.820 -4.943 23 3HG1 VAL 3 HG13 VAL 3 35.072 17.127 -4.887 24 1HG2 VAL 3 HG21 VAL 3 35.490 20.785 -3.975 25 2HG2 VAL 3 HG22 VAL 3 35.808 19.161 -3.392 26 3HG2 VAL 3 HG23 VAL 3 34.159 19.744 -3.504 27 H CYS 4 HN CYS 4 38.074 19.954 -4.470 28 HA CYS 4 HA CYS 4 39.754 17.583 -4.380 29 1HB CYS 4 HB2 CYS 4 39.600 20.074 -2.775 30 2HB CYS 4 HB1 CYS 4 40.917 18.952 -2.614 31 HA PRO 5 HA PRO 5 38.180 16.696 -0.087 32 1HB PRO 5 HB2 PRO 5 40.657 15.733 0.901 33 2HB PRO 5 HB1 PRO 5 39.308 14.787 0.365 34 1HG PRO 5 HG2 PRO 5 41.753 14.848 -0.950 35 2HG PRO 5 HG1 PRO 5 40.225 14.353 -1.698 36 1HD PRO 5 HD2 PRO 5 41.591 17.025 -1.779 37 2HD PRO 5 HD1 PRO 5 40.826 16.150 -3.115 38 HA PRO 6 HA PRO 6 39.573 19.934 2.670 39 1HB PRO 6 HB2 PRO 6 40.462 18.421 4.853 40 2HB PRO 6 HB1 PRO 6 38.805 18.888 4.559 41 1HG PRO 6 HG2 PRO 6 40.157 16.317 3.751 42 2HG PRO 6 HG1 PRO 6 38.592 16.528 4.550 43 1HD PRO 6 HD2 PRO 6 38.638 16.046 2.052 44 2HD PRO 6 HD1 PRO 6 37.614 17.384 2.575 45 H GLY 7 HN GLY 7 41.429 21.039 3.047 46 1HA GLY 7 HA2 GLY 7 43.724 21.452 3.350 47 2HA GLY 7 HA1 GLY 7 44.023 19.729 3.295 48 H GLN 8 HN GLN 8 42.425 19.951 0.536 49 HA GLN 8 HA GLN 8 44.833 20.855 -1.018 50 1HB GLN 8 HB2 GLN 8 42.915 18.625 -1.800 51 2HB GLN 8 HB1 GLN 8 44.318 19.168 -2.695 52 1HG GLN 8 HG2 GLN 8 44.901 17.112 -1.648 53 2HG GLN 8 HG1 GLN 8 45.826 18.407 -0.930 54 1HE2 GLN 8 HE21 GLN 8 43.146 16.114 -0.321 55 2HE2 GLN 8 HE22 GLN 8 43.172 16.310 1.357 56 H THR 9 HN THR 9 44.573 21.930 -2.869 57 HA THR 9 HA THR 9 41.876 22.975 -3.633 58 HB THR 9 HB THR 9 43.065 25.162 -4.203 59 HG1 THR 9 HG1 THR 9 45.078 23.940 -4.465 60 1HG2 THR 9 HG21 THR 9 43.713 24.184 -1.397 61 2HG2 THR 9 HG22 THR 9 42.150 24.843 -1.843 62 3HG2 THR 9 HG23 THR 9 43.583 25.861 -1.900 63 H PHE 10 HN PHE 10 41.613 23.667 -5.831 64 HA PHE 10 HA PHE 10 42.655 21.846 -7.797 65 1HB PHE 10 HB2 PHE 10 40.443 22.801 -8.037 66 2HB PHE 10 HB1 PHE 10 41.100 24.432 -8.107 67 HD1 PHE 10 HD1 PHE 10 41.531 25.348 -10.219 68 HD2 PHE 10 HD2 PHE 10 41.433 21.101 -9.841 69 HE1 PHE 10 HE1 PHE 10 41.802 25.124 -12.642 70 HE2 PHE 10 HE2 PHE 10 41.701 20.886 -12.266 71 HZ PHE 10 HZ PHE 10 41.886 22.901 -13.672 72 H GLN 11 HN GLN 11 44.225 22.152 -9.378 73 HA GLN 11 HA GLN 11 45.652 24.719 -9.630 74 1HB GLN 11 HB2 GLN 11 47.053 22.131 -8.723 75 2HB GLN 11 HB1 GLN 11 47.888 23.621 -9.144 76 1HG GLN 11 HG2 GLN 11 46.671 24.793 -7.290 77 2HG GLN 11 HG1 GLN 11 45.898 23.275 -6.863 78 1HE2 GLN 11 HE21 GLN 11 46.982 24.278 -4.837 79 2HE2 GLN 11 HE22 GLN 11 48.476 23.611 -4.414 80 H THR 12 HN THR 12 47.021 24.816 -11.331 81 HA THR 12 HA THR 12 46.066 23.317 -13.642 82 HB THR 12 HB THR 12 48.248 25.487 -13.399 83 HG1 THR 12 HG1 THR 12 46.115 26.024 -12.708 84 1HG2 THR 12 HG21 THR 12 47.750 25.817 -15.787 85 2HG2 THR 12 HG22 THR 12 46.501 24.572 -15.737 86 3HG2 THR 12 HG23 THR 12 48.198 24.126 -15.575 87 H CYS 13 HN CYS 13 49.243 23.872 -12.126 88 HA CYS 13 HA CYS 13 50.239 21.444 -13.457 89 1HB CYS 13 HB2 CYS 13 51.624 23.658 -11.948 90 2HB CYS 13 HB1 CYS 13 52.466 22.192 -12.392 91 H ALA 14 HN ALA 14 49.202 19.898 -12.391 92 HA ALA 14 HA ALA 14 50.444 18.958 -9.969 93 1HB ALA 14 HB1 ALA 14 47.457 19.715 -9.991 94 2HB ALA 14 HB2 ALA 14 48.686 20.543 -9.045 95 3HB ALA 14 HB3 ALA 14 48.244 18.888 -8.664 96 H SER 15 HN SER 15 51.038 17.338 -11.109 97 HA SER 15 HA SER 15 49.202 15.692 -12.605 98 1HB SER 15 HB2 SER 15 51.553 16.083 -13.219 99 2HB SER 15 HB1 SER 15 52.058 15.159 -11.828 100 HG SER 15 HG SER 15 51.224 13.354 -12.641 101 H SER 16 HN SER 16 49.415 13.352 -12.416 102 HA SER 16 HA SER 16 48.059 12.415 -10.168 103 1HB SER 16 HB2 SER 16 47.933 11.381 -12.416 104 2HB SER 16 HB1 SER 16 49.612 10.847 -12.277 105 HG SER 16 HG SER 16 47.715 10.246 -10.284 106 H CYS 17 HN CYS 17 51.328 13.238 -10.060 107 HA CYS 17 HA CYS 17 51.916 10.965 -8.157 108 1HB CYS 17 HB2 CYS 17 54.160 11.215 -8.505 109 2HB CYS 17 HB1 CYS 17 53.518 11.539 -10.079 110 HA PRO 18 HA PRO 18 50.714 14.565 -5.511 111 1HB PRO 18 HB2 PRO 18 50.095 13.072 -3.282 112 2HB PRO 18 HB1 PRO 18 48.968 13.407 -4.561 113 1HG PRO 18 HG2 PRO 18 50.638 10.979 -4.144 114 2HG PRO 18 HG1 PRO 18 48.939 11.102 -4.635 115 1HD PRO 18 HD2 PRO 18 50.857 10.593 -6.391 116 2HD PRO 18 HD1 PRO 18 49.469 11.621 -6.825 117 H LYS 19 HN LYS 19 51.756 15.661 -3.824 118 HA LYS 19 HA LYS 19 54.296 14.363 -3.003 119 1HB LYS 19 HB2 LYS 19 55.270 16.490 -2.556 120 2HB LYS 19 HB1 LYS 19 54.428 16.698 -4.063 121 1HG LYS 19 HG2 LYS 19 53.375 17.624 -1.370 122 2HG LYS 19 HG1 LYS 19 54.218 18.643 -2.517 123 1HD LYS 19 HD2 LYS 19 52.524 18.111 -4.165 124 2HD LYS 19 HD1 LYS 19 51.577 17.236 -2.972 125 1HE LYS 19 HE2 LYS 19 51.443 19.279 -1.580 126 2HE LYS 19 HE1 LYS 19 52.340 20.176 -2.798 127 1HZ LYS 19 HZ1 LYS 19 49.983 20.518 -3.042 128 2HZ LYS 19 HZ2 LYS 19 49.726 18.848 -3.212 129 3HZ LYS 19 HZ3 LYS 19 50.602 19.702 -4.390 130 H THR 20 HN THR 20 54.842 14.423 -0.850 131 HA THR 20 HA THR 20 52.686 15.110 1.077 132 HB THR 20 HB THR 20 52.962 12.909 2.160 133 HG1 THR 20 HG1 THR 20 55.070 12.509 1.669 134 1HG2 THR 20 HG21 THR 20 52.177 11.366 0.307 135 2HG2 THR 20 HG22 THR 20 52.799 12.450 -0.905 136 3HG2 THR 20 HG23 THR 20 51.397 12.890 0.040 137 H CYS 21 HN CYS 21 53.586 14.296 3.314 138 HA CYS 21 HA CYS 21 55.508 16.186 4.145 139 1HB CYS 21 HB2 CYS 21 54.291 13.704 5.361 140 2HB CYS 21 HB1 CYS 21 55.437 14.674 6.258 141 H GLU 22 HN GLU 22 55.825 13.211 2.693 142 HA GLU 22 HA GLU 22 58.603 12.665 3.524 143 1HB GLU 22 HB2 GLU 22 56.815 11.286 1.477 144 2HB GLU 22 HB1 GLU 22 58.403 10.729 1.959 145 1HG GLU 22 HG2 GLU 22 56.667 9.442 3.148 146 2HG GLU 22 HG1 GLU 22 57.603 10.385 4.287 147 H THR 23 HN THR 23 56.879 13.328 0.464 148 HA THR 23 HA THR 23 59.413 14.221 -0.870 149 HB THR 23 HB THR 23 58.068 14.028 -2.950 150 HG1 THR 23 HG1 THR 23 56.081 14.562 -1.896 151 1HG2 THR 23 HG21 THR 23 59.119 11.939 -1.952 152 2HG2 THR 23 HG22 THR 23 57.631 11.600 -2.841 153 3HG2 THR 23 HG23 THR 23 57.614 11.657 -1.078 154 H ARG 24 HN ARG 24 58.731 15.912 0.946 155 HA ARG 24 HA ARG 24 56.912 17.919 0.181 156 1HB ARG 24 HB2 ARG 24 59.437 18.130 1.886 157 2HB ARG 24 HB1 ARG 24 58.193 19.370 1.849 158 1HG ARG 24 HG2 ARG 24 56.515 17.695 2.627 159 2HG ARG 24 HG1 ARG 24 57.768 16.473 2.634 160 1HD ARG 24 HD2 ARG 24 57.838 18.980 4.332 161 2HD ARG 24 HD1 ARG 24 57.330 17.398 4.898 162 HE ARG 24 HE ARG 24 59.622 16.576 4.196 163 1HH1 ARG 24 HH11 ARG 24 59.103 19.923 5.066 164 2HH1 ARG 24 HH12 ARG 24 60.753 20.149 5.521 165 1HH2 ARG 24 HH21 ARG 24 61.692 16.883 4.783 166 2HH2 ARG 24 HH22 ARG 24 62.232 18.422 5.368 167 H ASN 25 HN ASN 25 59.940 17.214 -0.945 168 HA ASN 25 HA ASN 25 61.036 19.627 -1.796 169 1HB ASN 25 HB2 ASN 25 61.151 16.877 -3.076 170 2HB ASN 25 HB1 ASN 25 62.231 18.201 -3.456 171 1HD2 ASN 25 HD21 ASN 25 61.136 16.134 -0.745 172 2HD2 ASN 25 HD22 ASN 25 62.571 16.263 0.154 173 H LYS 26 HN LYS 26 58.212 18.257 -2.949 174 HA LYS 26 HA LYS 26 58.314 19.548 -5.614 175 1HB LYS 26 HB2 LYS 26 56.046 17.915 -4.445 176 2HB LYS 26 HB1 LYS 26 56.371 18.243 -6.119 177 1HG LYS 26 HG2 LYS 26 57.973 16.406 -4.304 178 2HG LYS 26 HG1 LYS 26 56.964 15.934 -5.651 179 1HD LYS 26 HD2 LYS 26 58.517 17.255 -7.164 180 2HD LYS 26 HD1 LYS 26 59.554 17.492 -5.774 181 1HE LYS 26 HE2 LYS 26 59.860 15.083 -5.487 182 2HE LYS 26 HE1 LYS 26 58.785 14.761 -6.843 183 1HZ LYS 26 HZ1 LYS 26 60.637 14.790 -8.028 184 2HZ LYS 26 HZ2 LYS 26 61.528 15.607 -6.834 185 3HZ LYS 26 HZ3 LYS 26 60.545 16.481 -7.909 186 H LEU 27 HN LEU 27 57.610 21.523 -5.717 187 HA LEU 27 HA LEU 27 55.975 22.693 -3.593 188 1HB LEU 27 HB2 LEU 27 57.249 23.937 -6.094 189 2HB LEU 27 HB1 LEU 27 56.364 24.895 -4.931 190 HG LEU 27 HG LEU 27 58.012 24.307 -3.163 191 1HD1 LEU 27 HD11 LEU 27 58.903 22.139 -3.996 192 2HD1 LEU 27 HD12 LEU 27 60.188 23.290 -3.753 193 3HD1 LEU 27 HD13 LEU 27 59.613 22.958 -5.379 194 1HD2 LEU 27 HD21 LEU 27 58.286 26.371 -4.473 195 2HD2 LEU 27 HD22 LEU 27 59.212 25.507 -5.690 196 3HD2 LEU 27 HD23 LEU 27 59.859 25.709 -4.069 197 H VAL 28 HN VAL 28 54.957 20.964 -5.466 198 HA VAL 28 HA VAL 28 52.177 21.905 -5.754 199 HB VAL 28 HB VAL 28 51.908 21.538 -8.100 200 1HG1 VAL 28 HG11 VAL 28 54.219 23.501 -7.758 201 2HG1 VAL 28 HG12 VAL 28 52.507 23.863 -7.591 202 3HG1 VAL 28 HG13 VAL 28 53.169 23.428 -9.156 203 1HG2 VAL 28 HG21 VAL 28 54.885 20.976 -8.344 204 2HG2 VAL 28 HG22 VAL 28 53.784 21.151 -9.703 205 3HG2 VAL 28 HG23 VAL 28 53.550 19.845 -8.567 206 H LEU 29 HN LEU 29 50.860 20.225 -6.572 207 HA LEU 29 HA LEU 29 50.920 17.963 -5.165 208 1HB LEU 29 HB2 LEU 29 49.127 18.674 -6.574 209 2HB LEU 29 HB1 LEU 29 50.091 18.227 -7.964 210 HG LEU 29 HG LEU 29 50.071 15.798 -7.110 211 1HD1 LEU 29 HD11 LEU 29 48.632 15.249 -5.129 212 2HD1 LEU 29 HD12 LEU 29 48.273 16.936 -4.894 213 3HD1 LEU 29 HD13 LEU 29 49.896 16.344 -4.638 214 1HD2 LEU 29 HD21 LEU 29 48.221 16.433 -8.599 215 2HD2 LEU 29 HD22 LEU 29 47.275 16.905 -7.194 216 3HD2 LEU 29 HD23 LEU 29 47.742 15.230 -7.406 217 H CYS 30 HN CYS 30 52.261 18.199 -8.280 218 HA CYS 30 HA CYS 30 54.095 15.859 -7.791 219 1HB CYS 30 HB2 CYS 30 52.158 15.350 -9.333 220 2HB CYS 30 HB1 CYS 30 52.705 16.635 -10.373 221 H ASP 31 HN ASP 31 55.043 16.744 -10.724 222 HA ASP 31 HA ASP 31 56.100 19.359 -10.494 223 1HB ASP 31 HB2 ASP 31 58.463 18.920 -9.837 224 2HB ASP 31 HB1 ASP 31 57.417 18.443 -8.547 225 H LYS 32 HN LYS 32 56.606 16.142 -11.629 226 HA LYS 32 HA LYS 32 58.126 16.980 -14.021 227 1HB LYS 32 HB2 LYS 32 57.056 14.232 -13.240 228 2HB LYS 32 HB1 LYS 32 58.224 14.556 -14.511 229 1HG LYS 32 HG2 LYS 32 59.794 15.511 -12.807 230 2HG LYS 32 HG1 LYS 32 58.602 15.150 -11.569 231 1HD LYS 32 HD2 LYS 32 58.739 12.738 -12.081 232 2HD LYS 32 HD1 LYS 32 59.945 13.068 -13.314 233 1HE LYS 32 HE2 LYS 32 61.036 12.389 -11.187 234 2HE LYS 32 HE1 LYS 32 61.450 14.051 -11.577 235 1HZ LYS 32 HZ1 LYS 32 60.583 14.704 -9.679 236 2HZ LYS 32 HZ2 LYS 32 60.258 13.089 -9.270 237 3HZ LYS 32 HZ3 LYS 32 59.079 14.018 -10.063 238 H LYS 33 HN LYS 33 55.047 17.309 -13.290 239 HA LYS 33 HA LYS 33 54.119 17.418 -16.037 240 1HB LYS 33 HB2 LYS 33 53.849 15.053 -15.728 241 2HB LYS 33 HB1 LYS 33 53.153 15.248 -14.156 242 1HG LYS 33 HG2 LYS 33 51.333 14.742 -15.675 243 2HG LYS 33 HG1 LYS 33 51.175 16.420 -15.281 244 1HD LYS 33 HD2 LYS 33 50.836 16.148 -17.703 245 2HD LYS 33 HD1 LYS 33 52.299 17.068 -17.446 246 1HE LYS 33 HE2 LYS 33 52.633 15.355 -19.183 247 2HE LYS 33 HE1 LYS 33 53.678 15.026 -17.815 248 1HZ LYS 33 HZ1 LYS 33 51.008 13.792 -18.122 249 2HZ LYS 33 HZ2 LYS 33 52.264 13.325 -17.078 250 3HZ LYS 33 HZ3 LYS 33 52.423 13.095 -18.754 251 H CYS 34 HN CYS 34 52.217 18.408 -16.330 252 HA CYS 34 HA CYS 34 51.080 19.810 -13.987 253 1HB CYS 34 HB2 CYS 34 51.547 20.731 -16.774 254 2HB CYS 34 HB1 CYS 34 50.546 21.631 -15.662 255 H ASN 35 HN ASN 35 49.582 18.210 -13.846 256 HA ASN 35 HA ASN 35 47.418 18.051 -15.927 257 1HB ASN 35 HB2 ASN 35 47.442 16.586 -13.249 258 2HB ASN 35 HB1 ASN 35 46.328 16.336 -14.559 259 1HD2 ASN 35 HD21 ASN 35 47.740 14.283 -13.353 260 2HD2 ASN 35 HD22 ASN 35 48.810 13.575 -14.447 261 H GLN 36 HN GLN 36 45.461 19.002 -15.622 262 HA GLN 36 HA GLN 36 45.147 20.993 -13.462 263 1HB GLN 36 HB2 GLN 36 43.342 20.128 -15.790 264 2HB GLN 36 HB1 GLN 36 42.948 21.432 -14.697 265 1HG GLN 36 HG2 GLN 36 43.930 22.308 -16.794 266 2HG GLN 36 HG1 GLN 36 44.960 22.688 -15.432 267 1HE2 GLN 36 HE21 GLN 36 47.107 22.336 -15.854 268 2HE2 GLN 36 HE22 GLN 36 47.727 21.187 -16.938 269 H ARG 37 HN ARG 37 45.288 19.580 -11.838 270 HA ARG 37 HA ARG 37 42.751 18.262 -11.021 271 1HB ARG 37 HB2 ARG 37 45.591 17.133 -10.688 272 2HB ARG 37 HB1 ARG 37 44.144 16.403 -10.025 273 1HG ARG 37 HG2 ARG 37 43.247 15.994 -12.277 274 2HG ARG 37 HG1 ARG 37 44.593 16.843 -13.011 275 1HD ARG 37 HD2 ARG 37 44.870 14.374 -13.111 276 2HD ARG 37 HD1 ARG 37 46.176 15.129 -12.228 277 HE ARG 37 HE ARG 37 43.930 13.562 -11.043 278 1HH1 ARG 37 HH11 ARG 37 46.987 15.208 -10.675 279 2HH1 ARG 37 HH12 ARG 37 47.281 14.502 -9.127 280 1HH2 ARG 37 HH21 ARG 37 44.312 12.693 -9.078 281 2HH2 ARG 37 HH22 ARG 37 45.759 13.079 -8.207 282 H CYS 38 HN CYS 38 43.214 17.649 -8.517 283 HA CYS 38 HA CYS 38 43.497 20.237 -7.257 284 1HB CYS 38 HB2 CYS 38 41.962 18.400 -6.480 285 2HB CYS 38 HB1 CYS 38 43.371 17.511 -5.938 286 H GLY 39 HN GLY 39 44.872 20.046 -5.015 287 1HA GLY 39 HA2 GLY 39 47.355 18.788 -4.852 288 2HA GLY 39 HA1 GLY 39 47.632 20.279 -5.773 289 H CYS 40 HN CYS 40 48.254 19.359 -2.882 290 HA CYS 40 HA CYS 40 46.896 20.576 -0.881 291 1HB CYS 40 HB2 CYS 40 49.889 20.681 -1.205 292 2HB CYS 40 HB1 CYS 40 49.015 20.948 0.261 293 H ILE 41 HN ILE 41 47.360 22.424 0.415 294 HA ILE 41 HA ILE 41 46.866 24.860 -1.014 295 HB ILE 41 HB ILE 41 48.059 24.892 1.789 296 1HG1 ILE 41 HG12 ILE 41 46.366 23.123 1.994 297 2HG1 ILE 41 HG11 ILE 41 45.785 24.572 2.767 298 1HG2 ILE 41 HG21 ILE 41 47.554 27.032 0.671 299 2HG2 ILE 41 HG22 ILE 41 46.476 26.797 2.031 300 3HG2 ILE 41 HG23 ILE 41 45.904 26.523 0.392 301 1HD1 ILE 41 HD11 ILE 41 44.985 23.622 0.013 302 2HD1 ILE 41 HD12 ILE 41 44.376 25.091 0.773 303 3HD1 ILE 41 HD13 ILE 41 43.991 23.522 1.455 304 H SER 42 HN SER 42 48.240 26.713 -1.065 305 HA SER 42 HA SER 42 50.939 26.100 -1.950 306 1HB SER 42 HB2 SER 42 49.605 28.004 -2.958 307 2HB SER 42 HB1 SER 42 49.627 28.839 -1.397 308 HG SER 42 HG SER 42 51.859 28.868 -1.479 309 H GLY 43 HN GLY 43 52.069 25.272 -0.366 310 1HA GLY 43 HA2 GLY 43 53.845 25.995 1.247 311 2HA GLY 43 HA1 GLY 43 52.592 26.879 2.113 312 H THR 44 HN THR 44 51.662 23.851 0.787 313 HA THR 44 HA THR 44 52.190 22.387 3.316 314 HB THR 44 HB THR 44 49.777 21.583 3.392 315 HG1 THR 44 HG1 THR 44 49.805 22.518 0.980 316 1HG2 THR 44 HG21 THR 44 48.725 23.689 4.117 317 2HG2 THR 44 HG22 THR 44 49.951 24.637 3.288 318 3HG2 THR 44 HG23 THR 44 50.386 23.673 4.693 319 H VAL 45 HN VAL 45 51.643 20.193 3.197 320 HA VAL 45 HA VAL 45 51.826 18.861 0.565 321 HB VAL 45 HB VAL 45 53.473 17.221 1.696 322 1HG1 VAL 45 HG11 VAL 45 55.393 18.670 1.292 323 2HG1 VAL 45 HG12 VAL 45 54.364 20.095 1.315 324 3HG1 VAL 45 HG13 VAL 45 54.186 18.888 0.046 325 1HG2 VAL 45 HG21 VAL 45 53.045 17.995 4.077 326 2HG2 VAL 45 HG22 VAL 45 53.709 19.565 3.677 327 3HG2 VAL 45 HG23 VAL 45 54.738 18.156 3.671 328 H LEU 46 HN LEU 46 50.947 16.825 0.457 329 HA LEU 46 HA LEU 46 48.703 16.315 2.110 330 1HB LEU 46 HB2 LEU 46 49.058 15.460 -0.223 331 2HB LEU 46 HB1 LEU 46 50.312 14.413 0.373 332 HG LEU 46 HG LEU 46 48.591 13.245 1.817 333 1HD1 LEU 46 HD11 LEU 46 46.958 15.140 1.972 334 2HD1 LEU 46 HD12 LEU 46 46.184 13.709 1.336 335 3HD1 LEU 46 HD13 LEU 46 46.643 15.004 0.252 336 1HD2 LEU 46 HD21 LEU 46 47.961 13.323 -1.165 337 2HD2 LEU 46 HD22 LEU 46 47.493 12.041 -0.059 338 3HD2 LEU 46 HD23 LEU 46 49.189 12.323 -0.407 339 H LYS 47 HN LYS 47 48.823 15.903 4.120 340 HA LYS 47 HA LYS 47 50.518 15.509 6.031 341 1HB LYS 47 HB2 LYS 47 48.157 15.435 6.354 342 2HB LYS 47 HB1 LYS 47 48.022 13.852 5.630 343 1HG LYS 47 HG2 LYS 47 49.351 12.889 7.495 344 2HG LYS 47 HG1 LYS 47 49.498 14.477 8.220 345 1HD LYS 47 HD2 LYS 47 46.905 12.924 7.733 346 2HD LYS 47 HD1 LYS 47 47.685 13.130 9.284 347 1HE LYS 47 HE2 LYS 47 46.479 15.389 7.612 348 2HE LYS 47 HE1 LYS 47 45.799 14.701 9.072 349 1HZ LYS 47 HZ1 LYS 47 46.985 16.740 9.511 350 2HZ LYS 47 HZ2 LYS 47 48.417 16.067 8.894 351 3HZ LYS 47 HZ3 LYS 47 47.717 15.428 10.304 352 H SER 48 HN SER 48 49.724 12.682 4.047 353 HA SER 48 HA SER 48 52.338 11.476 4.737 354 1HB SER 48 HB2 SER 48 49.654 10.026 5.180 355 2HB SER 48 HB1 SER 48 51.248 9.277 5.357 356 HG SER 48 HG SER 48 50.284 11.543 6.750 357 H LYS 49 HN LYS 49 52.489 9.339 3.624 358 HA LYS 49 HA LYS 49 52.844 9.639 0.925 359 1HB LYS 49 HB2 LYS 49 52.155 7.089 2.397 360 2HB LYS 49 HB1 LYS 49 52.853 7.170 0.785 361 1HG LYS 49 HG2 LYS 49 54.806 8.449 1.705 362 2HG LYS 49 HG1 LYS 49 54.108 8.368 3.308 363 1HD LYS 49 HD2 LYS 49 55.824 6.672 3.092 364 2HD LYS 49 HD1 LYS 49 54.256 5.908 3.279 365 1HE LYS 49 HE2 LYS 49 54.158 5.498 0.816 366 2HE LYS 49 HE1 LYS 49 55.717 6.293 0.625 367 1HZ LYS 49 HZ1 LYS 49 56.685 4.616 2.071 368 2HZ LYS 49 HZ2 LYS 49 55.958 3.921 0.703 369 3HZ LYS 49 HZ3 LYS 49 55.176 3.850 2.209 370 H ASP 50 HN ASP 50 49.812 9.102 2.464 371 HA ASP 50 HA ASP 50 48.372 9.495 -0.024 372 1HB ASP 50 HB2 ASP 50 49.007 7.063 -0.246 373 2HB ASP 50 HB1 ASP 50 48.230 6.725 1.287 374 H SER 51 HN SER 51 48.189 11.047 2.132 375 HA SER 51 HA SER 51 45.950 10.234 3.867 376 1HB SER 51 HB2 SER 51 47.926 11.598 4.687 377 2HB SER 51 HB1 SER 51 47.416 12.917 3.629 378 HG SER 51 HG SER 51 45.821 13.337 4.914 379 H SER 52 HN SER 52 44.728 12.884 3.915 380 HA SER 52 HA SER 52 43.622 13.438 1.266 381 1HB SER 52 HB2 SER 52 42.195 11.516 2.127 382 2HB SER 52 HB1 SER 52 41.838 12.460 3.581 383 HG SER 52 HG SER 52 41.465 13.537 1.003 384 H GLU 53 HN GLU 53 45.162 14.539 3.561 385 HA GLU 53 HA GLU 53 43.937 17.211 3.730 386 1HB GLU 53 HB2 GLU 53 44.745 15.630 6.219 387 2HB GLU 53 HB1 GLU 53 44.253 17.313 6.207 388 1HG GLU 53 HG2 GLU 53 41.998 16.623 5.357 389 2HG GLU 53 HG1 GLU 53 42.497 14.939 5.441 390 H CYS 54 HN CYS 54 45.542 18.730 3.802 391 HA CYS 54 HA CYS 54 48.348 17.704 3.809 392 1HB CYS 54 HB2 CYS 54 47.264 20.216 2.551 393 2HB CYS 54 HB1 CYS 54 48.895 19.638 2.434 394 H VAL 55 HN VAL 55 49.899 18.701 4.955 395 HA VAL 55 HA VAL 55 49.164 20.973 6.743 396 HB VAL 55 HB VAL 55 50.391 19.993 8.542 397 1HG1 VAL 55 HG11 VAL 55 48.453 17.937 7.460 398 2HG1 VAL 55 HG12 VAL 55 48.072 19.318 8.482 399 3HG1 VAL 55 HG13 VAL 55 49.046 18.001 9.113 400 1HG2 VAL 55 HG21 VAL 55 51.396 17.682 8.449 401 2HG2 VAL 55 HG22 VAL 55 52.181 18.771 7.328 402 3HG2 VAL 55 HG23 VAL 55 51.015 17.601 6.738 403 H HIS 56 HN HIS 56 51.076 22.078 7.550 404 HA HIS 56 HA HIS 56 52.771 22.916 5.476 405 1HB HIS 56 HB2 HIS 56 53.022 23.157 8.455 406 2HB HIS 56 HB1 HIS 56 54.009 24.099 7.347 407 HD1 HIS 56 HD1 HIS 56 52.419 25.520 5.589 408 HD2 HIS 56 HD2 HIS 56 50.583 24.311 9.028 409 HE1 HIS 56 HE1 HIS 56 50.388 26.900 5.812 410 HA PRO 57 HA PRO 57 56.418 20.274 5.838 411 1HB PRO 57 HB2 PRO 57 58.190 21.839 4.527 412 2HB PRO 57 HB1 PRO 57 56.910 21.012 3.672 413 1HG PRO 57 HG2 PRO 57 56.993 23.858 4.584 414 2HG PRO 57 HG1 PRO 57 56.484 23.197 3.019 415 1HD PRO 57 HD2 PRO 57 54.740 23.906 4.972 416 2HD PRO 57 HD1 PRO 57 54.408 22.624 3.789 417 H SER 58 HN SER 58 55.586 22.698 7.695 418 HA SER 58 HA SER 58 58.176 23.484 8.843 419 1HB SER 58 HB2 SER 58 56.708 24.767 10.467 420 2HB SER 58 HB1 SER 58 56.216 25.099 8.800 421 HG SER 58 HG SER 58 55.098 23.214 10.593 422 H LYS 59 HN LYS 59 55.433 21.442 9.482 423 HA LYS 59 HA LYS 59 56.647 20.272 11.928 424 1HB LYS 59 HB2 LYS 59 54.412 19.178 12.181 425 2HB LYS 59 HB1 LYS 59 54.241 20.911 11.985 426 1HG LYS 59 HG2 LYS 59 53.681 20.558 9.580 427 2HG LYS 59 HG1 LYS 59 53.830 18.822 9.807 428 1HD LYS 59 HD2 LYS 59 51.500 19.361 9.984 429 2HD LYS 59 HD1 LYS 59 52.066 18.941 11.573 430 1HE LYS 59 HE2 LYS 59 52.220 21.334 12.207 431 2HE LYS 59 HE1 LYS 59 51.715 21.801 10.587 432 1HZ LYS 59 HZ1 LYS 59 49.863 21.845 12.058 433 2HZ LYS 59 HZ2 LYS 59 50.149 20.249 12.562 434 3HZ LYS 59 HZ3 LYS 59 49.653 20.559 10.968 435 H CYS 60 HN CYS 60 55.621 19.563 8.668 436 HA CYS 60 HA CYS 60 56.555 16.786 8.760 437 1HB CYS 60 HB2 CYS 60 55.128 18.474 6.747 438 2HB CYS 60 HB1 CYS 60 55.854 16.972 6.275 Start of MODEL 17 1 1H ASN 1 HT1 ASN 1 32.378 20.081 -11.752 2 2H ASN 1 HT2 ASN 1 32.834 18.966 -10.555 3 3H ASN 1 HT3 ASN 1 33.535 18.886 -12.099 4 HA ASN 1 HA ASN 1 34.640 20.959 -11.786 5 1HB ASN 1 HB2 ASN 1 32.901 22.041 -10.354 6 2HB ASN 1 HB1 ASN 1 33.288 20.942 -9.038 7 1HD2 ASN 1 HD21 ASN 1 34.548 23.653 -10.962 8 2HD2 ASN 1 HD22 ASN 1 35.769 24.090 -9.867 9 H PHE 2 HN PHE 2 36.659 21.056 -10.792 10 HA PHE 2 HA PHE 2 37.682 18.463 -9.847 11 1HB PHE 2 HB2 PHE 2 39.061 21.098 -10.471 12 2HB PHE 2 HB1 PHE 2 39.908 19.603 -10.097 13 HD1 PHE 2 HD1 PHE 2 38.358 21.562 -12.685 14 HD2 PHE 2 HD2 PHE 2 39.477 17.579 -11.652 15 HE1 PHE 2 HE1 PHE 2 38.232 20.910 -15.046 16 HE2 PHE 2 HE2 PHE 2 39.349 16.934 -14.014 17 HZ PHE 2 HZ PHE 2 38.727 18.597 -15.716 18 H VAL 3 HN VAL 3 36.201 18.923 -7.918 19 HA VAL 3 HA VAL 3 37.073 20.772 -5.865 20 HB VAL 3 HB VAL 3 35.482 19.526 -4.406 21 1HG1 VAL 3 HG11 VAL 3 34.395 19.951 -7.218 22 2HG1 VAL 3 HG12 VAL 3 34.555 21.187 -5.980 23 3HG1 VAL 3 HG13 VAL 3 33.431 19.859 -5.754 24 1HG2 VAL 3 HG21 VAL 3 35.248 17.557 -6.730 25 2HG2 VAL 3 HG22 VAL 3 34.271 17.540 -5.271 26 3HG2 VAL 3 HG23 VAL 3 35.990 17.213 -5.176 27 H CYS 4 HN CYS 4 37.517 19.949 -3.684 28 HA CYS 4 HA CYS 4 39.518 17.748 -3.643 29 1HB CYS 4 HB2 CYS 4 39.747 20.491 -2.515 30 2HB CYS 4 HB1 CYS 4 40.887 19.238 -2.144 31 HA PRO 5 HA PRO 5 38.029 17.701 0.731 32 1HB PRO 5 HB2 PRO 5 40.366 16.395 1.704 33 2HB PRO 5 HB1 PRO 5 38.837 15.661 1.331 34 1HG PRO 5 HG2 PRO 5 41.167 15.154 -0.075 35 2HG PRO 5 HG1 PRO 5 39.536 14.902 -0.727 36 1HD PRO 5 HD2 PRO 5 41.359 17.264 -1.064 37 2HD PRO 5 HD1 PRO 5 40.415 16.428 -2.307 38 HA PRO 6 HA PRO 6 40.225 20.829 3.149 39 1HB PRO 6 HB2 PRO 6 41.160 19.264 5.303 40 2HB PRO 6 HB1 PRO 6 39.607 20.057 5.223 41 1HG PRO 6 HG2 PRO 6 40.285 17.225 4.483 42 2HG PRO 6 HG1 PRO 6 38.894 17.835 5.404 43 1HD PRO 6 HD2 PRO 6 38.575 17.150 2.944 44 2HD PRO 6 HD1 PRO 6 37.871 18.683 3.450 45 H GLY 7 HN GLY 7 42.301 21.597 3.434 46 1HA GLY 7 HA2 GLY 7 44.648 21.636 3.374 47 2HA GLY 7 HA1 GLY 7 44.645 19.886 3.312 48 H GLN 8 HN GLN 8 42.744 20.319 0.830 49 HA GLN 8 HA GLN 8 44.927 20.881 -1.132 50 1HB GLN 8 HB2 GLN 8 42.710 18.816 -1.295 51 2HB GLN 8 HB1 GLN 8 43.887 19.146 -2.557 52 1HG GLN 8 HG2 GLN 8 45.705 18.476 -1.106 53 2HG GLN 8 HG1 GLN 8 44.611 18.189 0.247 54 1HE2 GLN 8 HE21 GLN 8 43.271 16.282 0.169 55 2HE2 GLN 8 HE22 GLN 8 43.523 15.050 -0.971 56 H THR 9 HN THR 9 44.300 21.683 -3.123 57 HA THR 9 HA THR 9 41.584 22.806 -3.452 58 HB THR 9 HB THR 9 42.758 24.596 -2.262 59 HG1 THR 9 HG1 THR 9 41.494 24.921 -4.282 60 1HG2 THR 9 HG21 THR 9 45.149 23.918 -2.922 61 2HG2 THR 9 HG22 THR 9 44.832 25.620 -3.225 62 3HG2 THR 9 HG23 THR 9 44.812 24.469 -4.553 63 H PHE 10 HN PHE 10 41.423 23.916 -5.550 64 HA PHE 10 HA PHE 10 42.181 22.111 -7.663 65 1HB PHE 10 HB2 PHE 10 40.133 23.531 -7.848 66 2HB PHE 10 HB1 PHE 10 41.130 24.983 -7.867 67 HD1 PHE 10 HD1 PHE 10 41.565 25.865 -10.018 68 HD2 PHE 10 HD2 PHE 10 41.030 21.658 -9.617 69 HE1 PHE 10 HE1 PHE 10 41.863 25.592 -12.437 70 HE2 PHE 10 HE2 PHE 10 41.322 21.391 -12.030 71 HZ PHE 10 HZ PHE 10 41.743 23.355 -13.450 72 H GLN 11 HN GLN 11 43.639 22.493 -9.410 73 HA GLN 11 HA GLN 11 45.465 24.755 -9.346 74 1HB GLN 11 HB2 GLN 11 46.227 23.269 -7.438 75 2HB GLN 11 HB1 GLN 11 46.458 21.964 -8.576 76 1HG GLN 11 HG2 GLN 11 48.251 23.177 -9.711 77 2HG GLN 11 HG1 GLN 11 47.955 24.614 -8.736 78 1HE2 GLN 11 HE21 GLN 11 47.639 23.532 -6.181 79 2HE2 GLN 11 HE22 GLN 11 49.068 22.776 -5.682 80 H THR 12 HN THR 12 46.596 24.892 -11.270 81 HA THR 12 HA THR 12 45.486 23.326 -13.468 82 HB THR 12 HB THR 12 45.945 25.786 -13.754 83 HG1 THR 12 HG1 THR 12 46.016 24.460 -15.544 84 1HG2 THR 12 HG21 THR 12 48.905 24.952 -13.676 85 2HG2 THR 12 HG22 THR 12 48.132 25.867 -12.393 86 3HG2 THR 12 HG23 THR 12 48.284 26.561 -13.998 87 H CYS 13 HN CYS 13 48.434 23.429 -11.622 88 HA CYS 13 HA CYS 13 49.528 21.258 -13.301 89 1HB CYS 13 HB2 CYS 13 50.929 23.361 -11.683 90 2HB CYS 13 HB1 CYS 13 51.767 21.907 -12.166 91 H ALA 14 HN ALA 14 48.550 19.618 -12.372 92 HA ALA 14 HA ALA 14 49.508 18.768 -9.675 93 1HB ALA 14 HB1 ALA 14 47.276 17.591 -9.456 94 2HB ALA 14 HB2 ALA 14 46.826 18.201 -11.030 95 3HB ALA 14 HB3 ALA 14 47.049 19.313 -9.697 96 H SER 15 HN SER 15 48.833 16.139 -9.713 97 HA SER 15 HA SER 15 49.460 14.812 -12.180 98 1HB SER 15 HB2 SER 15 51.741 15.857 -11.705 99 2HB SER 15 HB1 SER 15 51.749 14.942 -10.199 100 HG SER 15 HG SER 15 51.052 13.450 -12.386 101 H SER 16 HN SER 16 50.088 12.538 -11.818 102 HA SER 16 HA SER 16 48.394 11.369 -9.761 103 1HB SER 16 HB2 SER 16 49.013 9.201 -10.940 104 2HB SER 16 HB1 SER 16 48.450 10.426 -12.087 105 HG SER 16 HG SER 16 51.133 9.855 -11.372 106 H CYS 17 HN CYS 17 51.318 12.655 -9.652 107 HA CYS 17 HA CYS 17 52.639 10.688 -7.857 108 1HB CYS 17 HB2 CYS 17 54.703 12.046 -8.454 109 2HB CYS 17 HB1 CYS 17 53.999 11.063 -9.699 110 HA PRO 18 HA PRO 18 50.981 14.234 -5.302 111 1HB PRO 18 HB2 PRO 18 50.422 12.714 -3.066 112 2HB PRO 18 HB1 PRO 18 49.298 12.979 -4.375 113 1HG PRO 18 HG2 PRO 18 51.118 10.651 -3.929 114 2HG PRO 18 HG1 PRO 18 49.416 10.664 -4.425 115 1HD PRO 18 HD2 PRO 18 51.343 10.279 -6.202 116 2HD PRO 18 HD1 PRO 18 49.918 11.261 -6.608 117 H LYS 19 HN LYS 19 51.919 15.402 -3.726 118 HA LYS 19 HA LYS 19 54.625 14.586 -2.825 119 1HB LYS 19 HB2 LYS 19 53.400 17.052 -3.647 120 2HB LYS 19 HB1 LYS 19 53.785 17.253 -1.963 121 1HG LYS 19 HG2 LYS 19 55.707 18.038 -3.085 122 2HG LYS 19 HG1 LYS 19 56.149 16.456 -2.514 123 1HD LYS 19 HD2 LYS 19 55.342 17.174 -5.349 124 2HD LYS 19 HD1 LYS 19 56.961 16.793 -4.820 125 1HE LYS 19 HE2 LYS 19 56.282 14.472 -4.302 126 2HE LYS 19 HE1 LYS 19 54.675 14.832 -4.926 127 1HZ LYS 19 HZ1 LYS 19 55.341 14.850 -7.016 128 2HZ LYS 19 HZ2 LYS 19 56.582 13.855 -6.422 129 3HZ LYS 19 HZ3 LYS 19 56.867 15.512 -6.671 130 H THR 20 HN THR 20 55.152 14.625 -0.712 131 HA THR 20 HA THR 20 53.006 14.949 1.290 132 HB THR 20 HB THR 20 53.414 12.702 2.254 133 HG1 THR 20 HG1 THR 20 55.592 12.626 1.555 134 1HG2 THR 20 HG21 THR 20 52.667 11.215 0.411 135 2HG2 THR 20 HG22 THR 20 53.144 12.344 -0.814 136 3HG2 THR 20 HG23 THR 20 51.766 12.686 0.211 137 H CYS 21 HN CYS 21 54.038 14.121 3.528 138 HA CYS 21 HA CYS 21 55.982 16.057 4.240 139 1HB CYS 21 HB2 CYS 21 55.286 13.434 5.569 140 2HB CYS 21 HB1 CYS 21 56.332 14.617 6.290 141 H GLU 22 HN GLU 22 56.238 12.971 2.814 142 HA GLU 22 HA GLU 22 59.017 12.428 3.454 143 1HB GLU 22 HB2 GLU 22 57.408 10.687 2.747 144 2HB GLU 22 HB1 GLU 22 57.275 11.448 1.169 145 1HG GLU 22 HG2 GLU 22 59.717 11.032 0.767 146 2HG GLU 22 HG1 GLU 22 59.832 10.253 2.337 147 H THR 23 HN THR 23 57.359 13.712 0.577 148 HA THR 23 HA THR 23 59.948 14.699 -0.536 149 HB THR 23 HB THR 23 58.614 14.950 -2.651 150 HG1 THR 23 HG1 THR 23 56.477 13.971 -2.434 151 1HG2 THR 23 HG21 THR 23 59.650 12.712 -2.043 152 2HG2 THR 23 HG22 THR 23 58.167 12.554 -2.989 153 3HG2 THR 23 HG23 THR 23 58.136 12.282 -1.246 154 H ARG 24 HN ARG 24 59.466 16.176 1.450 155 HA ARG 24 HA ARG 24 57.734 18.378 0.939 156 1HB ARG 24 HB2 ARG 24 60.051 17.928 2.819 157 2HB ARG 24 HB1 ARG 24 59.206 19.468 2.817 158 1HG ARG 24 HG2 ARG 24 57.071 18.338 3.232 159 2HG ARG 24 HG1 ARG 24 57.821 16.768 3.081 160 1HD ARG 24 HD2 ARG 24 58.465 18.803 5.274 161 2HD ARG 24 HD1 ARG 24 57.391 17.423 5.473 162 HE ARG 24 HE ARG 24 59.832 16.426 4.491 163 1HH1 ARG 24 HH11 ARG 24 58.586 18.106 7.262 164 2HH1 ARG 24 HH12 ARG 24 59.754 17.433 8.347 165 1HH2 ARG 24 HH21 ARG 24 61.329 15.555 5.857 166 2HH2 ARG 24 HH22 ARG 24 61.333 15.965 7.541 167 H ASN 25 HN ASN 25 60.594 17.598 -0.342 168 HA ASN 25 HA ASN 25 61.977 20.004 -0.683 169 1HB ASN 25 HB2 ASN 25 61.744 17.604 -2.558 170 2HB ASN 25 HB1 ASN 25 63.012 18.818 -2.604 171 1HD2 ASN 25 HD21 ASN 25 61.596 16.293 -0.520 172 2HD2 ASN 25 HD22 ASN 25 63.004 16.029 0.391 173 H LYS 26 HN LYS 26 59.049 18.963 -2.150 174 HA LYS 26 HA LYS 26 59.010 21.301 -4.003 175 1HB LYS 26 HB2 LYS 26 57.546 18.647 -4.250 176 2HB LYS 26 HB1 LYS 26 57.307 19.994 -5.329 177 1HG LYS 26 HG2 LYS 26 58.693 18.391 -6.455 178 2HG LYS 26 HG1 LYS 26 59.686 19.780 -6.074 179 1HD LYS 26 HD2 LYS 26 60.711 18.584 -4.190 180 2HD LYS 26 HD1 LYS 26 59.638 17.214 -4.418 181 1HE LYS 26 HE2 LYS 26 61.875 16.808 -5.411 182 2HE LYS 26 HE1 LYS 26 60.677 16.895 -6.694 183 1HZ LYS 26 HZ1 LYS 26 62.796 18.184 -7.012 184 2HZ LYS 26 HZ2 LYS 26 62.218 19.259 -5.831 185 3HZ LYS 26 HZ3 LYS 26 61.347 19.033 -7.271 186 H LEU 27 HN LEU 27 57.476 22.672 -3.628 187 HA LEU 27 HA LEU 27 55.465 22.164 -1.488 188 1HB LEU 27 HB2 LEU 27 56.366 24.759 -2.803 189 2HB LEU 27 HB1 LEU 27 55.239 24.639 -1.471 190 HG LEU 27 HG LEU 27 58.172 23.747 -1.393 191 1HD1 LEU 27 HD11 LEU 27 58.477 25.697 0.118 192 2HD1 LEU 27 HD12 LEU 27 56.793 26.144 -0.107 193 3HD1 LEU 27 HD13 LEU 27 57.910 26.213 -1.460 194 1HD2 LEU 27 HD21 LEU 27 57.815 23.466 1.045 195 2HD2 LEU 27 HD22 LEU 27 56.736 22.404 0.169 196 3HD2 LEU 27 HD23 LEU 27 56.121 23.890 0.872 197 H VAL 28 HN VAL 28 55.051 20.986 -3.750 198 HA VAL 28 HA VAL 28 52.356 21.886 -4.608 199 HB VAL 28 HB VAL 28 52.889 21.465 -7.015 200 1HG1 VAL 28 HG11 VAL 28 54.629 23.670 -5.780 201 2HG1 VAL 28 HG12 VAL 28 52.927 23.825 -6.187 202 3HG1 VAL 28 HG13 VAL 28 54.117 23.604 -7.457 203 1HG2 VAL 28 HG21 VAL 28 55.278 21.409 -7.754 204 2HG2 VAL 28 HG22 VAL 28 54.917 20.051 -6.704 205 3HG2 VAL 28 HG23 VAL 28 55.797 21.435 -6.078 206 H LEU 29 HN LEU 29 51.273 20.235 -5.790 207 HA LEU 29 HA LEU 29 51.399 17.788 -4.456 208 1HB LEU 29 HB2 LEU 29 49.420 18.670 -5.651 209 2HB LEU 29 HB1 LEU 29 50.261 18.486 -7.167 210 HG LEU 29 HG LEU 29 50.357 15.941 -6.650 211 1HD1 LEU 29 HD11 LEU 29 48.490 16.727 -4.368 212 2HD1 LEU 29 HD12 LEU 29 50.121 16.114 -4.168 213 3HD1 LEU 29 HD13 LEU 29 48.876 15.084 -4.845 214 1HD2 LEU 29 HD21 LEU 29 47.576 17.123 -6.784 215 2HD2 LEU 29 HD22 LEU 29 48.015 15.471 -7.180 216 3HD2 LEU 29 HD23 LEU 29 48.652 16.806 -8.126 217 H CYS 30 HN CYS 30 52.849 18.812 -7.311 218 HA CYS 30 HA CYS 30 55.028 16.949 -7.340 219 1HB CYS 30 HB2 CYS 30 53.001 15.468 -8.153 220 2HB CYS 30 HB1 CYS 30 53.057 16.458 -9.572 221 H ASP 31 HN ASP 31 56.259 17.195 -9.447 222 HA ASP 31 HA ASP 31 55.719 19.871 -10.687 223 1HB ASP 31 HB2 ASP 31 57.520 20.016 -9.014 224 2HB ASP 31 HB1 ASP 31 58.392 18.720 -9.804 225 H LYS 32 HN LYS 32 56.519 16.599 -11.257 226 HA LYS 32 HA LYS 32 57.629 17.013 -13.930 227 1HB LYS 32 HB2 LYS 32 56.656 14.472 -12.560 228 2HB LYS 32 HB1 LYS 32 57.608 14.524 -14.029 229 1HG LYS 32 HG2 LYS 32 58.514 15.546 -11.299 230 2HG LYS 32 HG1 LYS 32 59.023 14.052 -12.055 231 1HD LYS 32 HD2 LYS 32 60.053 15.351 -13.934 232 2HD LYS 32 HD1 LYS 32 59.561 16.850 -13.166 233 1HE LYS 32 HE2 LYS 32 61.911 16.359 -12.628 234 2HE LYS 32 HE1 LYS 32 60.931 16.306 -11.171 235 1HZ LYS 32 HZ1 LYS 32 62.570 14.442 -11.550 236 2HZ LYS 32 HZ2 LYS 32 61.500 13.875 -12.742 237 3HZ LYS 32 HZ3 LYS 32 60.984 14.001 -11.129 238 H LYS 33 HN LYS 33 54.595 17.521 -13.006 239 HA LYS 33 HA LYS 33 53.502 17.202 -15.681 240 1HB LYS 33 HB2 LYS 33 53.334 14.916 -14.992 241 2HB LYS 33 HB1 LYS 33 52.631 15.346 -13.457 242 1HG LYS 33 HG2 LYS 33 50.589 16.103 -14.541 243 2HG LYS 33 HG1 LYS 33 51.269 15.897 -16.141 244 1HD LYS 33 HD2 LYS 33 50.604 13.707 -14.087 245 2HD LYS 33 HD1 LYS 33 49.778 13.988 -15.596 246 1HE LYS 33 HE2 LYS 33 52.646 13.011 -15.385 247 2HE LYS 33 HE1 LYS 33 51.242 12.073 -15.844 248 1HZ LYS 33 HZ1 LYS 33 52.388 14.370 -17.304 249 2HZ LYS 33 HZ2 LYS 33 50.897 13.652 -17.690 250 3HZ LYS 33 HZ3 LYS 33 52.330 12.746 -17.802 251 H CYS 34 HN CYS 34 51.525 18.076 -16.016 252 HA CYS 34 HA CYS 34 50.468 19.718 -13.809 253 1HB CYS 34 HB2 CYS 34 51.087 20.525 -16.596 254 2HB CYS 34 HB1 CYS 34 50.009 21.492 -15.620 255 H ASN 35 HN ASN 35 48.958 18.258 -13.587 256 HA ASN 35 HA ASN 35 46.743 17.906 -15.529 257 1HB ASN 35 HB2 ASN 35 46.946 16.936 -12.638 258 2HB ASN 35 HB1 ASN 35 45.666 16.507 -13.755 259 1HD2 ASN 35 HD21 ASN 35 47.014 14.523 -12.523 260 2HD2 ASN 35 HD22 ASN 35 48.041 13.695 -13.580 261 H GLN 36 HN GLN 36 44.829 19.012 -15.415 262 HA GLN 36 HA GLN 36 44.615 21.232 -13.423 263 1HB GLN 36 HB2 GLN 36 42.975 20.605 -15.937 264 2HB GLN 36 HB1 GLN 36 42.844 22.069 -14.974 265 1HG GLN 36 HG2 GLN 36 45.254 22.589 -15.479 266 2HG GLN 36 HG1 GLN 36 45.336 21.156 -16.490 267 1HE2 GLN 36 HE21 GLN 36 44.662 24.469 -16.518 268 2HE2 GLN 36 HE22 GLN 36 43.878 24.550 -18.023 269 H ARG 37 HN ARG 37 44.377 19.662 -11.873 270 HA ARG 37 HA ARG 37 41.567 18.950 -11.283 271 1HB ARG 37 HB2 ARG 37 42.357 16.666 -10.464 272 2HB ARG 37 HB1 ARG 37 42.585 16.875 -12.172 273 1HG ARG 37 HG2 ARG 37 44.948 17.537 -11.816 274 2HG ARG 37 HG1 ARG 37 44.755 17.387 -10.085 275 1HD ARG 37 HD2 ARG 37 44.478 15.080 -12.049 276 2HD ARG 37 HD1 ARG 37 45.896 15.435 -11.065 277 HE ARG 37 HE ARG 37 43.315 15.071 -9.651 278 1HH1 ARG 37 HH11 ARG 37 46.423 13.788 -10.563 279 2HH1 ARG 37 HH12 ARG 37 46.386 12.566 -9.341 280 1HH2 ARG 37 HH21 ARG 37 43.270 13.525 -8.113 281 2HH2 ARG 37 HH22 ARG 37 44.585 12.410 -7.941 282 H CYS 38 HN CYS 38 42.303 17.633 -8.860 283 HA CYS 38 HA CYS 38 42.865 20.013 -7.228 284 1HB CYS 38 HB2 CYS 38 41.161 18.388 -6.464 285 2HB CYS 38 HB1 CYS 38 42.386 17.137 -6.352 286 H GLY 39 HN GLY 39 44.443 19.967 -5.503 287 1HA GLY 39 HA2 GLY 39 46.644 18.179 -5.324 288 2HA GLY 39 HA1 GLY 39 47.104 19.526 -6.375 289 H CYS 40 HN CYS 40 48.247 18.890 -3.833 290 HA CYS 40 HA CYS 40 47.286 20.326 -1.646 291 1HB CYS 40 HB2 CYS 40 50.162 19.912 -2.501 292 2HB CYS 40 HB1 CYS 40 49.686 20.514 -0.948 293 H ILE 41 HN ILE 41 47.676 22.276 -0.803 294 HA ILE 41 HA ILE 41 47.586 24.518 -2.599 295 HB ILE 41 HB ILE 41 48.338 24.605 0.358 296 1HG1 ILE 41 HG12 ILE 41 45.525 24.663 -0.902 297 2HG1 ILE 41 HG11 ILE 41 46.173 23.258 -0.091 298 1HG2 ILE 41 HG21 ILE 41 48.598 26.760 -0.839 299 2HG2 ILE 41 HG22 ILE 41 47.265 26.862 0.271 300 3HG2 ILE 41 HG23 ILE 41 46.955 26.634 -1.441 301 1HD1 ILE 41 HD11 ILE 41 45.651 25.958 1.225 302 2HD1 ILE 41 HD12 ILE 41 46.332 24.551 2.027 303 3HD1 ILE 41 HD13 ILE 41 44.688 24.508 1.410 304 H SER 42 HN SER 42 49.144 26.269 -2.554 305 HA SER 42 HA SER 42 51.828 25.318 -3.178 306 1HB SER 42 HB2 SER 42 50.781 27.204 -4.484 307 2HB SER 42 HB1 SER 42 50.752 28.202 -3.023 308 HG SER 42 HG SER 42 52.985 28.006 -2.896 309 H GLY 43 HN GLY 43 52.704 24.534 -1.387 310 1HA GLY 43 HA2 GLY 43 54.445 25.504 0.267 311 2HA GLY 43 HA1 GLY 43 53.053 26.288 1.008 312 H THR 44 HN THR 44 51.629 23.647 0.017 313 HA THR 44 HA THR 44 52.282 22.094 2.475 314 HB THR 44 HB THR 44 49.913 21.277 2.410 315 HG1 THR 44 HG1 THR 44 50.155 22.128 -0.074 316 1HG2 THR 44 HG21 THR 44 48.758 23.397 2.840 317 2HG2 THR 44 HG22 THR 44 50.039 24.302 2.043 318 3HG2 THR 44 HG23 THR 44 50.363 23.461 3.556 319 H VAL 45 HN VAL 45 51.903 19.972 2.463 320 HA VAL 45 HA VAL 45 52.299 18.427 -0.048 321 HB VAL 45 HB VAL 45 53.860 16.918 1.273 322 1HG1 VAL 45 HG11 VAL 45 54.820 18.564 -0.262 323 2HG1 VAL 45 HG12 VAL 45 55.810 18.340 1.170 324 3HG1 VAL 45 HG13 VAL 45 54.812 19.780 1.018 325 1HG2 VAL 45 HG21 VAL 45 53.235 17.696 3.621 326 2HG2 VAL 45 HG22 VAL 45 53.929 19.264 3.236 327 3HG2 VAL 45 HG23 VAL 45 54.951 17.855 3.330 328 H LEU 46 HN LEU 46 51.059 16.647 -0.159 329 HA LEU 46 HA LEU 46 48.860 16.245 1.587 330 1HB LEU 46 HB2 LEU 46 49.042 15.420 -0.821 331 2HB LEU 46 HB1 LEU 46 50.136 14.174 -0.271 332 HG LEU 46 HG LEU 46 48.374 13.242 1.209 333 1HD1 LEU 46 HD11 LEU 46 47.004 15.322 1.514 334 2HD1 LEU 46 HD12 LEU 46 46.021 14.023 0.882 335 3HD1 LEU 46 HD13 LEU 46 46.586 15.287 -0.188 336 1HD2 LEU 46 HD21 LEU 46 47.036 12.257 -0.646 337 2HD2 LEU 46 HD22 LEU 46 48.736 12.338 -1.069 338 3HD2 LEU 46 HD23 LEU 46 47.610 13.513 -1.730 339 H LYS 47 HN LYS 47 49.363 16.016 3.634 340 HA LYS 47 HA LYS 47 51.009 15.332 5.381 341 1HB LYS 47 HB2 LYS 47 48.660 15.359 5.813 342 2HB LYS 47 HB1 LYS 47 48.423 13.782 5.097 343 1HG LYS 47 HG2 LYS 47 49.805 12.762 6.890 344 2HG LYS 47 HG1 LYS 47 50.059 14.346 7.603 345 1HD LYS 47 HD2 LYS 47 47.358 12.950 7.250 346 2HD LYS 47 HD1 LYS 47 48.231 13.092 8.761 347 1HE LYS 47 HE2 LYS 47 48.018 15.588 8.652 348 2HE LYS 47 HE1 LYS 47 47.110 15.444 7.153 349 1HZ LYS 47 HZ1 LYS 47 45.538 14.001 8.406 350 2HZ LYS 47 HZ2 LYS 47 45.550 15.644 8.833 351 3HZ LYS 47 HZ3 LYS 47 46.322 14.502 9.827 352 H SER 48 HN SER 48 49.748 12.467 3.722 353 HA SER 48 HA SER 48 52.411 11.134 4.048 354 1HB SER 48 HB2 SER 48 49.663 9.854 4.607 355 2HB SER 48 HB1 SER 48 51.221 9.018 4.711 356 HG SER 48 HG SER 48 51.765 10.934 6.131 357 H LYS 49 HN LYS 49 52.493 9.151 2.835 358 HA LYS 49 HA LYS 49 52.847 9.325 0.204 359 1HB LYS 49 HB2 LYS 49 52.390 6.952 -0.010 360 2HB LYS 49 HB1 LYS 49 53.316 7.343 1.429 361 1HG LYS 49 HG2 LYS 49 51.191 7.296 2.784 362 2HG LYS 49 HG1 LYS 49 50.308 6.812 1.351 363 1HD LYS 49 HD2 LYS 49 52.615 5.320 2.564 364 2HD LYS 49 HD1 LYS 49 50.919 4.927 2.810 365 1HE LYS 49 HE2 LYS 49 52.411 4.832 0.127 366 2HE LYS 49 HE1 LYS 49 51.882 3.449 1.062 367 1HZ LYS 49 HZ1 LYS 49 50.303 3.811 -0.616 368 2HZ LYS 49 HZ2 LYS 49 50.173 5.466 -0.253 369 3HZ LYS 49 HZ3 LYS 49 49.585 4.307 0.841 370 H ASP 50 HN ASP 50 49.716 9.023 1.607 371 HA ASP 50 HA ASP 50 48.392 10.022 -0.763 372 1HB ASP 50 HB2 ASP 50 48.800 7.625 -1.478 373 2HB ASP 50 HB1 ASP 50 47.947 7.063 -0.056 374 H SER 51 HN SER 51 48.256 11.172 1.539 375 HA SER 51 HA SER 51 46.056 10.233 3.238 376 1HB SER 51 HB2 SER 51 48.082 11.484 4.120 377 2HB SER 51 HB1 SER 51 47.568 12.908 3.212 378 HG SER 51 HG SER 51 45.522 11.849 4.627 379 H SER 52 HN SER 52 44.869 12.873 3.598 380 HA SER 52 HA SER 52 43.572 13.455 0.982 381 1HB SER 52 HB2 SER 52 41.320 13.398 2.138 382 2HB SER 52 HB1 SER 52 42.112 11.817 2.227 383 HG SER 52 HG SER 52 43.016 12.551 4.247 384 H GLU 53 HN GLU 53 45.282 14.582 3.436 385 HA GLU 53 HA GLU 53 44.317 17.371 3.119 386 1HB GLU 53 HB2 GLU 53 43.316 16.467 5.229 387 2HB GLU 53 HB1 GLU 53 44.915 16.010 5.786 388 1HG GLU 53 HG2 GLU 53 45.605 18.434 5.721 389 2HG GLU 53 HG1 GLU 53 43.981 18.858 5.201 390 H CYS 54 HN CYS 54 45.919 18.708 2.772 391 HA CYS 54 HA CYS 54 48.693 17.681 3.030 392 1HB CYS 54 HB2 CYS 54 47.744 20.162 1.593 393 2HB CYS 54 HB1 CYS 54 49.300 19.408 1.473 394 H VAL 55 HN VAL 55 50.146 18.631 4.197 395 HA VAL 55 HA VAL 55 49.518 21.037 5.840 396 HB VAL 55 HB VAL 55 50.908 19.885 7.665 397 1HG1 VAL 55 HG11 VAL 55 48.364 19.812 7.711 398 2HG1 VAL 55 HG12 VAL 55 49.045 18.335 8.370 399 3HG1 VAL 55 HG13 VAL 55 48.398 18.352 6.738 400 1HG2 VAL 55 HG21 VAL 55 50.575 17.444 5.880 401 2HG2 VAL 55 HG22 VAL 55 51.222 17.437 7.512 402 3HG2 VAL 55 HG23 VAL 55 52.087 18.263 6.230 403 H HIS 56 HN HIS 56 51.304 22.387 6.239 404 HA HIS 56 HA HIS 56 53.290 22.419 4.161 405 1HB HIS 56 HB2 HIS 56 53.262 23.843 6.826 406 2HB HIS 56 HB1 HIS 56 54.311 24.290 5.501 407 HD1 HIS 56 HD1 HIS 56 53.187 25.586 3.591 408 HD2 HIS 56 HD2 HIS 56 50.488 24.506 6.458 409 HE1 HIS 56 HE1 HIS 56 51.112 26.821 3.091 410 HA PRO 57 HA PRO 57 56.566 19.888 5.770 411 1HB PRO 57 HB2 PRO 57 58.741 21.604 5.404 412 2HB PRO 57 HB1 PRO 57 58.055 20.577 4.179 413 1HG PRO 57 HG2 PRO 57 57.535 23.468 4.677 414 2HG PRO 57 HG1 PRO 57 57.776 22.613 3.144 415 1HD PRO 57 HD2 PRO 57 55.365 23.318 3.953 416 2HD PRO 57 HD1 PRO 57 55.617 21.765 3.132 417 H SER 58 HN SER 58 55.984 23.076 6.975 418 HA SER 58 HA SER 58 57.723 22.964 9.271 419 1HB SER 58 HB2 SER 58 56.344 24.968 10.026 420 2HB SER 58 HB1 SER 58 56.928 25.133 8.367 421 HG SER 58 HG SER 58 54.875 24.049 7.803 422 H LYS 59 HN LYS 59 54.592 21.653 8.665 423 HA LYS 59 HA LYS 59 54.096 21.186 11.562 424 1HB LYS 59 HB2 LYS 59 52.453 20.324 9.134 425 2HB LYS 59 HB1 LYS 59 51.986 20.066 10.800 426 1HG LYS 59 HG2 LYS 59 50.765 21.991 10.113 427 2HG LYS 59 HG1 LYS 59 52.090 22.588 11.101 428 1HD LYS 59 HD2 LYS 59 53.354 23.194 9.103 429 2HD LYS 59 HD1 LYS 59 52.085 22.553 8.083 430 1HE LYS 59 HE2 LYS 59 51.907 25.025 8.305 431 2HE LYS 59 HE1 LYS 59 50.512 24.254 9.046 432 1HZ LYS 59 HZ1 LYS 59 51.385 24.595 11.173 433 2HZ LYS 59 HZ2 LYS 59 51.627 26.060 10.349 434 3HZ LYS 59 HZ3 LYS 59 52.927 24.992 10.581 435 H CYS 60 HN CYS 60 54.715 19.553 8.528 436 HA CYS 60 HA CYS 60 54.743 16.875 9.408 437 1HB CYS 60 HB2 CYS 60 56.248 18.331 7.298 438 2HB CYS 60 HB1 CYS 60 56.456 16.609 7.475 Start of MODEL 18 1 1H ASN 1 HT1 ASN 1 38.050 23.685 -10.642 2 2H ASN 1 HT2 ASN 1 37.621 24.749 -11.897 3 3H ASN 1 HT3 ASN 1 38.652 23.435 -12.212 4 HA ASN 1 HA ASN 1 35.805 23.260 -11.403 5 1HB ASN 1 HB2 ASN 1 37.207 22.656 -14.063 6 2HB ASN 1 HB1 ASN 1 35.503 22.366 -13.740 7 1HD2 ASN 1 HD21 ASN 1 34.070 24.170 -13.758 8 2HD2 ASN 1 HD22 ASN 1 34.564 25.735 -14.189 9 H PHE 2 HN PHE 2 37.600 22.106 -9.802 10 HA PHE 2 HA PHE 2 37.052 19.246 -10.148 11 1HB PHE 2 HB2 PHE 2 39.236 19.655 -11.413 12 2HB PHE 2 HB1 PHE 2 39.949 20.241 -9.922 13 HD1 PHE 2 HD1 PHE 2 39.182 17.331 -11.878 14 HD2 PHE 2 HD2 PHE 2 39.980 18.620 -7.904 15 HE1 PHE 2 HE1 PHE 2 39.720 15.027 -11.239 16 HE2 PHE 2 HE2 PHE 2 40.519 16.312 -7.263 17 HZ PHE 2 HZ PHE 2 40.386 14.512 -8.930 18 H VAL 3 HN VAL 3 36.233 18.804 -8.248 19 HA VAL 3 HA VAL 3 36.648 20.363 -5.853 20 HB VAL 3 HB VAL 3 34.509 19.219 -6.409 21 1HG1 VAL 3 HG11 VAL 3 36.023 16.617 -5.914 22 2HG1 VAL 3 HG12 VAL 3 35.410 17.166 -7.464 23 3HG1 VAL 3 HG13 VAL 3 34.295 16.756 -6.175 24 1HG2 VAL 3 HG21 VAL 3 35.733 18.166 -3.823 25 2HG2 VAL 3 HG22 VAL 3 34.020 18.240 -4.184 26 3HG2 VAL 3 HG23 VAL 3 34.946 19.723 -4.029 27 H CYS 4 HN CYS 4 37.491 19.822 -3.956 28 HA CYS 4 HA CYS 4 39.697 17.830 -3.973 29 1HB CYS 4 HB2 CYS 4 39.350 20.394 -2.524 30 2HB CYS 4 HB1 CYS 4 40.656 19.315 -2.158 31 HA PRO 5 HA PRO 5 38.287 16.755 0.294 32 1HB PRO 5 HB2 PRO 5 40.862 15.721 0.977 33 2HB PRO 5 HB1 PRO 5 39.458 14.810 0.516 34 1HG PRO 5 HG2 PRO 5 41.736 14.920 -1.023 35 2HG PRO 5 HG1 PRO 5 40.123 14.596 -1.687 36 1HD PRO 5 HD2 PRO 5 41.577 17.212 -1.498 37 2HD PRO 5 HD1 PRO 5 40.793 16.531 -2.924 38 HA PRO 6 HA PRO 6 39.839 19.751 3.235 39 1HB PRO 6 HB2 PRO 6 41.150 18.073 5.085 40 2HB PRO 6 HB1 PRO 6 39.459 18.509 5.121 41 1HG PRO 6 HG2 PRO 6 40.722 16.078 3.875 42 2HG PRO 6 HG1 PRO 6 39.264 16.180 4.881 43 1HD PRO 6 HD2 PRO 6 38.992 15.920 2.352 44 2HD PRO 6 HD1 PRO 6 38.028 17.177 3.127 45 H GLY 7 HN GLY 7 41.675 20.905 3.735 46 1HA GLY 7 HA2 GLY 7 43.907 21.585 3.664 47 2HA GLY 7 HA1 GLY 7 44.332 19.897 3.550 48 H GLN 8 HN GLN 8 42.479 20.117 0.934 49 HA GLN 8 HA GLN 8 44.737 20.979 -0.815 50 1HB GLN 8 HB2 GLN 8 42.571 18.911 -1.296 51 2HB GLN 8 HB1 GLN 8 43.902 19.272 -2.386 52 1HG GLN 8 HG2 GLN 8 45.544 18.502 -0.828 53 2HG GLN 8 HG1 GLN 8 44.364 18.323 0.464 54 1HE2 GLN 8 HE21 GLN 8 43.866 16.246 0.807 55 2HE2 GLN 8 HE22 GLN 8 43.758 15.005 -0.340 56 H THR 9 HN THR 9 44.301 21.796 -2.795 57 HA THR 9 HA THR 9 41.667 23.060 -3.334 58 HB THR 9 HB THR 9 42.824 25.288 -3.757 59 HG1 THR 9 HG1 THR 9 44.815 24.315 -4.300 60 1HG2 THR 9 HG21 THR 9 42.104 24.789 -1.360 61 2HG2 THR 9 HG22 THR 9 43.523 25.829 -1.468 62 3HG2 THR 9 HG23 THR 9 43.704 24.122 -1.075 63 H PHE 10 HN PHE 10 41.889 24.209 -5.584 64 HA PHE 10 HA PHE 10 42.492 22.234 -7.529 65 1HB PHE 10 HB2 PHE 10 40.981 24.088 -8.038 66 2HB PHE 10 HB1 PHE 10 42.261 25.269 -7.789 67 HD1 PHE 10 HD1 PHE 10 43.645 25.893 -9.578 68 HD2 PHE 10 HD2 PHE 10 41.309 22.346 -9.951 69 HE1 PHE 10 HE1 PHE 10 44.294 25.715 -11.929 70 HE2 PHE 10 HE2 PHE 10 41.965 22.173 -12.309 71 HZ PHE 10 HZ PHE 10 43.465 23.866 -13.299 72 H GLN 11 HN GLN 11 44.218 22.253 -9.117 73 HA GLN 11 HA GLN 11 46.685 23.751 -8.478 74 1HB GLN 11 HB2 GLN 11 46.328 21.223 -7.285 75 2HB GLN 11 HB1 GLN 11 47.008 20.759 -8.822 76 1HG GLN 11 HG2 GLN 11 48.819 20.983 -7.254 77 2HG GLN 11 HG1 GLN 11 48.944 22.284 -8.424 78 1HE2 GLN 11 HE21 GLN 11 46.652 22.239 -5.537 79 2HE2 GLN 11 HE22 GLN 11 47.399 23.548 -4.806 80 H THR 12 HN THR 12 47.281 24.428 -10.508 81 HA THR 12 HA THR 12 45.910 23.312 -12.826 82 HB THR 12 HB THR 12 46.320 25.773 -12.675 83 HG1 THR 12 HG1 THR 12 47.767 24.403 -14.696 84 1HG2 THR 12 HG21 THR 12 48.573 26.663 -13.078 85 2HG2 THR 12 HG22 THR 12 49.261 25.053 -13.170 86 3HG2 THR 12 HG23 THR 12 48.665 25.665 -11.634 87 H CYS 13 HN CYS 13 49.341 23.315 -11.765 88 HA CYS 13 HA CYS 13 49.778 21.272 -13.895 89 1HB CYS 13 HB2 CYS 13 51.024 23.283 -14.325 90 2HB CYS 13 HB1 CYS 13 51.844 23.172 -12.784 91 H ALA 14 HN ALA 14 49.565 19.419 -12.878 92 HA ALA 14 HA ALA 14 51.745 18.568 -11.173 93 1HB ALA 14 HB1 ALA 14 50.276 19.677 -9.552 94 2HB ALA 14 HB2 ALA 14 50.295 17.938 -9.268 95 3HB ALA 14 HB3 ALA 14 48.920 18.691 -10.082 96 H SER 15 HN SER 15 52.203 16.470 -11.493 97 HA SER 15 HA SER 15 50.499 14.903 -13.279 98 1HB SER 15 HB2 SER 15 53.122 14.809 -13.220 99 2HB SER 15 HB1 SER 15 52.932 13.866 -11.752 100 HG SER 15 HG SER 15 52.394 13.154 -14.316 101 H SER 16 HN SER 16 51.456 12.473 -11.587 102 HA SER 16 HA SER 16 49.189 12.495 -9.651 103 1HB SER 16 HB2 SER 16 48.870 10.928 -11.609 104 2HB SER 16 HB1 SER 16 50.392 10.127 -11.195 105 HG SER 16 HG SER 16 48.232 10.498 -9.400 106 H CYS 17 HN CYS 17 52.085 13.339 -9.418 107 HA CYS 17 HA CYS 17 53.002 11.305 -7.383 108 1HB CYS 17 HB2 CYS 17 55.205 11.971 -7.714 109 2HB CYS 17 HB1 CYS 17 54.522 11.845 -9.299 110 HA PRO 18 HA PRO 18 51.100 15.016 -5.320 111 1HB PRO 18 HB2 PRO 18 50.406 13.731 -2.970 112 2HB PRO 18 HB1 PRO 18 49.392 13.789 -4.386 113 1HG PRO 18 HG2 PRO 18 51.275 11.632 -3.526 114 2HG PRO 18 HG1 PRO 18 49.624 11.490 -4.163 115 1HD PRO 18 HD2 PRO 18 51.693 11.009 -5.724 116 2HD PRO 18 HD1 PRO 18 50.289 11.910 -6.344 117 H LYS 19 HN LYS 19 51.826 16.423 -3.815 118 HA LYS 19 HA LYS 19 54.509 15.992 -2.704 119 1HB LYS 19 HB2 LYS 19 54.331 18.324 -1.976 120 2HB LYS 19 HB1 LYS 19 53.811 18.217 -3.643 121 1HG LYS 19 HG2 LYS 19 51.403 18.071 -2.767 122 2HG LYS 19 HG1 LYS 19 52.030 18.436 -1.194 123 1HD LYS 19 HD2 LYS 19 52.286 20.335 -3.530 124 2HD LYS 19 HD1 LYS 19 51.108 20.488 -2.274 125 1HE LYS 19 HE2 LYS 19 52.911 22.008 -1.775 126 2HE LYS 19 HE1 LYS 19 53.006 20.699 -0.615 127 1HZ LYS 19 HZ1 LYS 19 54.949 20.047 -1.363 128 2HZ LYS 19 HZ2 LYS 19 55.029 21.567 -2.113 129 3HZ LYS 19 HZ3 LYS 19 54.505 20.216 -2.995 130 H THR 20 HN THR 20 54.877 15.352 -0.758 131 HA THR 20 HA THR 20 52.760 15.464 1.334 132 HB THR 20 HB THR 20 53.130 13.088 1.944 133 HG1 THR 20 HG1 THR 20 55.316 13.079 1.277 134 1HG2 THR 20 HG21 THR 20 52.898 13.248 -1.132 135 2HG2 THR 20 HG22 THR 20 51.523 13.438 -0.069 136 3HG2 THR 20 HG23 THR 20 52.363 11.912 -0.147 137 H CYS 21 HN CYS 21 53.752 14.613 3.470 138 HA CYS 21 HA CYS 21 55.885 16.328 4.176 139 1HB CYS 21 HB2 CYS 21 54.985 13.759 5.479 140 2HB CYS 21 HB1 CYS 21 56.091 14.879 6.212 141 H GLU 22 HN GLU 22 55.827 13.244 2.732 142 HA GLU 22 HA GLU 22 58.620 12.550 3.241 143 1HB GLU 22 HB2 GLU 22 56.889 10.806 2.976 144 2HB GLU 22 HB1 GLU 22 56.537 11.373 1.355 145 1HG GLU 22 HG2 GLU 22 57.998 9.366 1.290 146 2HG GLU 22 HG1 GLU 22 58.826 10.748 0.607 147 H THR 23 HN THR 23 56.716 13.657 0.412 148 HA THR 23 HA THR 23 59.279 14.434 -0.936 149 HB THR 23 HB THR 23 58.180 12.649 -2.094 150 HG1 THR 23 HG1 THR 23 57.692 13.885 -4.058 151 1HG2 THR 23 HG21 THR 23 55.934 12.851 -3.114 152 2HG2 THR 23 HG22 THR 23 55.687 14.401 -2.340 153 3HG2 THR 23 HG23 THR 23 55.791 12.945 -1.374 154 H ARG 24 HN ARG 24 59.087 16.125 0.425 155 HA ARG 24 HA ARG 24 57.182 18.326 -0.024 156 1HB ARG 24 HB2 ARG 24 59.678 18.115 1.677 157 2HB ARG 24 HB1 ARG 24 58.584 19.483 1.693 158 1HG ARG 24 HG2 ARG 24 56.723 17.924 2.401 159 2HG ARG 24 HG1 ARG 24 57.876 16.606 2.365 160 1HD ARG 24 HD2 ARG 24 58.176 19.020 4.157 161 2HD ARG 24 HD1 ARG 24 57.466 17.516 4.709 162 HE ARG 24 HE ARG 24 59.702 16.498 3.858 163 1HH1 ARG 24 HH11 ARG 24 59.343 19.638 5.333 164 2HH1 ARG 24 HH12 ARG 24 60.957 19.640 5.951 165 1HH2 ARG 24 HH21 ARG 24 61.741 16.507 4.650 166 2HH2 ARG 24 HH22 ARG 24 62.329 17.853 5.569 167 H ASN 25 HN ASN 25 60.086 17.270 -1.219 168 HA ASN 25 HA ASN 25 61.659 19.414 -1.818 169 1HB ASN 25 HB2 ASN 25 61.067 16.969 -3.530 170 2HB ASN 25 HB1 ASN 25 62.473 18.006 -3.694 171 1HD2 ASN 25 HD21 ASN 25 60.843 15.780 -1.443 172 2HD2 ASN 25 HD22 ASN 25 62.232 15.422 -0.535 173 H LYS 26 HN LYS 26 58.722 18.577 -3.522 174 HA LYS 26 HA LYS 26 59.135 20.782 -5.473 175 1HB LYS 26 HB2 LYS 26 57.078 18.509 -5.463 176 2HB LYS 26 HB1 LYS 26 57.182 19.762 -6.670 177 1HG LYS 26 HG2 LYS 26 58.214 17.728 -7.524 178 2HG LYS 26 HG1 LYS 26 59.412 18.992 -7.353 179 1HD LYS 26 HD2 LYS 26 60.263 16.791 -6.677 180 2HD LYS 26 HD1 LYS 26 60.351 17.937 -5.374 181 1HE LYS 26 HE2 LYS 26 59.509 15.734 -4.615 182 2HE LYS 26 HE1 LYS 26 58.231 16.920 -4.414 183 1HZ LYS 26 HZ1 LYS 26 57.534 14.800 -5.442 184 2HZ LYS 26 HZ2 LYS 26 58.501 15.173 -6.789 185 3HZ LYS 26 HZ3 LYS 26 57.185 16.169 -6.385 186 H LEU 27 HN LEU 27 58.116 22.539 -5.099 187 HA LEU 27 HA LEU 27 56.162 22.809 -2.910 188 1HB LEU 27 HB2 LEU 27 57.469 24.872 -4.741 189 2HB LEU 27 HB1 LEU 27 56.340 25.285 -3.468 190 HG LEU 27 HG LEU 27 57.813 24.235 -1.830 191 1HD1 LEU 27 HD11 LEU 27 60.224 23.803 -2.345 192 2HD1 LEU 27 HD12 LEU 27 59.882 24.008 -4.054 193 3HD1 LEU 27 HD13 LEU 27 59.186 22.666 -3.159 194 1HD2 LEU 27 HD21 LEU 27 59.080 26.469 -3.475 195 2HD2 LEU 27 HD22 LEU 27 59.534 26.089 -1.821 196 3HD2 LEU 27 HD23 LEU 27 57.916 26.668 -2.175 197 H VAL 28 HN VAL 28 55.346 21.361 -4.907 198 HA VAL 28 HA VAL 28 52.748 22.523 -5.678 199 HB VAL 28 HB VAL 28 54.396 21.153 -7.760 200 1HG1 VAL 28 HG11 VAL 28 52.039 21.220 -8.212 201 2HG1 VAL 28 HG12 VAL 28 52.858 22.255 -9.367 202 3HG1 VAL 28 HG13 VAL 28 52.001 22.965 -8.007 203 1HG2 VAL 28 HG21 VAL 28 54.319 24.209 -7.447 204 2HG2 VAL 28 HG22 VAL 28 55.003 23.378 -8.833 205 3HG2 VAL 28 HG23 VAL 28 55.745 23.203 -7.259 206 H LEU 29 HN LEU 29 51.379 20.815 -6.399 207 HA LEU 29 HA LEU 29 51.588 18.560 -4.825 208 1HB LEU 29 HB2 LEU 29 49.499 19.319 -5.881 209 2HB LEU 29 HB1 LEU 29 50.161 19.015 -7.458 210 HG LEU 29 HG LEU 29 50.280 16.501 -6.730 211 1HD1 LEU 29 HD11 LEU 29 48.564 17.529 -4.439 212 2HD1 LEU 29 HD12 LEU 29 50.180 16.885 -4.285 213 3HD1 LEU 29 HD13 LEU 29 48.869 15.843 -4.798 214 1HD2 LEU 29 HD21 LEU 29 48.497 17.223 -8.233 215 2HD2 LEU 29 HD22 LEU 29 47.523 17.721 -6.873 216 3HD2 LEU 29 HD23 LEU 29 47.903 16.027 -7.102 217 H CYS 30 HN CYS 30 52.511 19.036 -8.015 218 HA CYS 30 HA CYS 30 54.679 17.126 -7.992 219 1HB CYS 30 HB2 CYS 30 52.729 15.566 -8.260 220 2HB CYS 30 HB1 CYS 30 52.219 16.455 -9.653 221 H ASP 31 HN ASP 31 55.647 16.993 -10.263 222 HA ASP 31 HA ASP 31 55.035 19.430 -11.873 223 1HB ASP 31 HB2 ASP 31 56.881 19.955 -10.313 224 2HB ASP 31 HB1 ASP 31 57.794 18.582 -10.907 225 H LYS 32 HN LYS 32 55.883 16.145 -11.819 226 HA LYS 32 HA LYS 32 57.224 15.746 -14.263 227 1HB LYS 32 HB2 LYS 32 55.177 13.930 -12.913 228 2HB LYS 32 HB1 LYS 32 56.307 13.461 -14.173 229 1HG LYS 32 HG2 LYS 32 58.220 14.020 -12.720 230 2HG LYS 32 HG1 LYS 32 57.147 14.631 -11.482 231 1HD LYS 32 HD2 LYS 32 57.932 12.423 -10.833 232 2HD LYS 32 HD1 LYS 32 56.214 12.355 -11.143 233 1HE LYS 32 HE2 LYS 32 58.345 11.452 -13.125 234 2HE LYS 32 HE1 LYS 32 57.452 10.379 -12.063 235 1HZ LYS 32 HZ1 LYS 32 55.495 11.769 -13.287 236 2HZ LYS 32 HZ2 LYS 32 56.043 10.225 -13.736 237 3HZ LYS 32 HZ3 LYS 32 56.651 11.601 -14.521 238 H LYS 33 HN LYS 33 53.990 16.667 -13.757 239 HA LYS 33 HA LYS 33 53.442 16.992 -16.593 240 1HB LYS 33 HB2 LYS 33 52.915 14.581 -16.309 241 2HB LYS 33 HB1 LYS 33 51.853 14.950 -14.969 242 1HG LYS 33 HG2 LYS 33 50.335 16.185 -16.362 243 2HG LYS 33 HG1 LYS 33 51.376 16.014 -17.762 244 1HD LYS 33 HD2 LYS 33 49.966 13.760 -16.231 245 2HD LYS 33 HD1 LYS 33 49.453 14.395 -17.780 246 1HE LYS 33 HE2 LYS 33 52.083 12.921 -17.258 247 2HE LYS 33 HE1 LYS 33 50.682 12.291 -18.100 248 1HZ LYS 33 HZ1 LYS 33 52.408 14.531 -18.949 249 2HZ LYS 33 HZ2 LYS 33 50.930 14.150 -19.693 250 3HZ LYS 33 HZ3 LYS 33 52.204 13.026 -19.710 251 H CYS 34 HN CYS 34 51.399 18.061 -16.951 252 HA CYS 34 HA CYS 34 50.628 19.652 -14.572 253 1HB CYS 34 HB2 CYS 34 50.532 20.347 -17.454 254 2HB CYS 34 HB1 CYS 34 49.861 21.338 -16.190 255 H ASN 35 HN ASN 35 49.155 18.036 -14.063 256 HA ASN 35 HA ASN 35 46.644 17.803 -15.653 257 1HB ASN 35 HB2 ASN 35 47.060 16.714 -12.817 258 2HB ASN 35 HB1 ASN 35 45.816 16.280 -13.954 259 1HD2 ASN 35 HD21 ASN 35 47.870 14.580 -12.625 260 2HD2 ASN 35 HD22 ASN 35 48.666 13.763 -13.878 261 H GLN 36 HN GLN 36 45.012 19.196 -15.378 262 HA GLN 36 HA GLN 36 45.091 21.195 -13.187 263 1HB GLN 36 HB2 GLN 36 43.283 20.879 -15.631 264 2HB GLN 36 HB1 GLN 36 43.205 22.229 -14.518 265 1HG GLN 36 HG2 GLN 36 45.575 22.805 -15.065 266 2HG GLN 36 HG1 GLN 36 45.651 21.449 -16.181 267 1HE2 GLN 36 HE21 GLN 36 45.749 22.472 -18.180 268 2HE2 GLN 36 HE22 GLN 36 44.625 23.616 -18.735 269 H ARG 37 HN ARG 37 44.786 19.619 -11.646 270 HA ARG 37 HA ARG 37 41.942 19.058 -11.006 271 1HB ARG 37 HB2 ARG 37 42.680 16.795 -10.108 272 2HB ARG 37 HB1 ARG 37 42.851 16.913 -11.832 273 1HG ARG 37 HG2 ARG 37 45.286 17.474 -11.553 274 2HG ARG 37 HG1 ARG 37 45.111 17.406 -9.815 275 1HD ARG 37 HD2 ARG 37 44.689 15.041 -11.694 276 2HD ARG 37 HD1 ARG 37 46.115 15.333 -10.716 277 HE ARG 37 HE ARG 37 44.878 14.853 -8.734 278 1HH1 ARG 37 HH11 ARG 37 42.931 14.593 -11.604 279 2HH1 ARG 37 HH12 ARG 37 41.686 13.707 -10.792 280 1HH2 ARG 37 HH21 ARG 37 43.317 13.746 -7.714 281 2HH2 ARG 37 HH22 ARG 37 41.903 13.221 -8.565 282 H CYS 38 HN CYS 38 42.306 17.870 -8.597 283 HA CYS 38 HA CYS 38 43.098 20.202 -7.011 284 1HB CYS 38 HB2 CYS 38 41.198 18.757 -6.288 285 2HB CYS 38 HB1 CYS 38 42.326 17.447 -5.992 286 H GLY 39 HN GLY 39 44.477 19.997 -5.150 287 1HA GLY 39 HA2 GLY 39 46.516 18.067 -4.756 288 2HA GLY 39 HA1 GLY 39 47.157 19.384 -5.755 289 H CYS 40 HN CYS 40 47.902 18.718 -2.951 290 HA CYS 40 HA CYS 40 46.668 20.466 -1.116 291 1HB CYS 40 HB2 CYS 40 49.613 19.755 -1.224 292 2HB CYS 40 HB1 CYS 40 48.789 20.524 0.090 293 H ILE 41 HN ILE 41 47.394 22.429 -0.305 294 HA ILE 41 HA ILE 41 47.767 24.394 -2.391 295 HB ILE 41 HB ILE 41 48.293 24.899 0.567 296 1HG1 ILE 41 HG12 ILE 41 45.620 24.894 -0.954 297 2HG1 ILE 41 HG11 ILE 41 46.042 23.616 0.163 298 1HG2 ILE 41 HG21 ILE 41 47.120 26.568 -1.698 299 2HG2 ILE 41 HG22 ILE 41 48.747 26.738 -1.060 300 3HG2 ILE 41 HG23 ILE 41 47.375 27.142 -0.058 301 1HD1 ILE 41 HD11 ILE 41 44.544 25.185 1.252 302 2HD1 ILE 41 HD12 ILE 41 45.628 26.525 0.929 303 3HD1 ILE 41 HD13 ILE 41 46.122 25.239 2.022 304 H SER 42 HN SER 42 49.518 25.849 -2.525 305 HA SER 42 HA SER 42 52.121 24.479 -2.480 306 1HB SER 42 HB2 SER 42 51.341 27.323 -3.406 307 2HB SER 42 HB1 SER 42 52.917 26.562 -3.704 308 HG SER 42 HG SER 42 51.869 24.917 -4.805 309 H GLY 43 HN GLY 43 52.307 24.187 -0.402 310 1HA GLY 43 HA2 GLY 43 53.996 25.577 1.181 311 2HA GLY 43 HA1 GLY 43 52.444 26.339 1.583 312 H THR 44 HN THR 44 51.023 23.822 0.930 313 HA THR 44 HA THR 44 51.597 22.306 3.440 314 HB THR 44 HB THR 44 49.215 21.610 3.419 315 HG1 THR 44 HG1 THR 44 49.400 22.949 0.942 316 1HG2 THR 44 HG21 THR 44 49.750 23.764 4.490 317 2HG2 THR 44 HG22 THR 44 48.141 23.769 3.775 318 3HG2 THR 44 HG23 THR 44 49.467 24.598 2.961 319 H VAL 45 HN VAL 45 51.821 20.228 3.373 320 HA VAL 45 HA VAL 45 51.758 18.842 0.743 321 HB VAL 45 HB VAL 45 53.577 17.351 1.692 322 1HG1 VAL 45 HG11 VAL 45 55.404 18.969 1.365 323 2HG1 VAL 45 HG12 VAL 45 54.258 20.291 1.492 324 3HG1 VAL 45 HG13 VAL 45 54.149 19.133 0.164 325 1HG2 VAL 45 HG21 VAL 45 53.270 17.873 4.137 326 2HG2 VAL 45 HG22 VAL 45 53.800 19.521 3.815 327 3HG2 VAL 45 HG23 VAL 45 54.911 18.191 3.618 328 H LEU 46 HN LEU 46 50.634 17.122 0.560 329 HA LEU 46 HA LEU 46 48.630 16.308 2.345 330 1HB LEU 46 HB2 LEU 46 48.751 15.799 -0.143 331 2HB LEU 46 HB1 LEU 46 50.003 14.642 0.180 332 HG LEU 46 HG LEU 46 48.362 13.347 1.619 333 1HD1 LEU 46 HD11 LEU 46 46.831 15.255 2.150 334 2HD1 LEU 46 HD12 LEU 46 45.949 13.949 1.393 335 3HD1 LEU 46 HD13 LEU 46 46.391 15.360 0.456 336 1HD2 LEU 46 HD21 LEU 46 47.509 13.864 -1.266 337 2HD2 LEU 46 HD22 LEU 46 47.081 12.451 -0.316 338 3HD2 LEU 46 HD23 LEU 46 48.756 12.736 -0.760 339 H LYS 47 HN LYS 47 49.177 15.815 4.334 340 HA LYS 47 HA LYS 47 51.033 15.038 5.877 341 1HB LYS 47 HB2 LYS 47 48.708 14.848 6.529 342 2HB LYS 47 HB1 LYS 47 48.524 13.370 5.606 343 1HG LYS 47 HG2 LYS 47 50.177 12.238 7.083 344 2HG LYS 47 HG1 LYS 47 50.361 13.718 8.006 345 1HD LYS 47 HD2 LYS 47 47.944 13.633 8.614 346 2HD LYS 47 HD1 LYS 47 47.753 12.168 7.664 347 1HE LYS 47 HE2 LYS 47 49.587 12.452 10.081 348 2HE LYS 47 HE1 LYS 47 48.038 11.622 10.062 349 1HZ LYS 47 HZ1 LYS 47 49.285 9.855 9.604 350 2HZ LYS 47 HZ2 LYS 47 50.597 10.775 9.040 351 3HZ LYS 47 HZ3 LYS 47 49.285 10.452 8.014 352 H SER 48 HN SER 48 49.688 12.296 4.088 353 HA SER 48 HA SER 48 52.378 10.958 4.170 354 1HB SER 48 HB2 SER 48 49.608 9.636 4.319 355 2HB SER 48 HB1 SER 48 51.171 8.811 4.402 356 HG SER 48 HG SER 48 49.960 10.503 6.242 357 H LYS 49 HN LYS 49 52.381 9.094 2.597 358 HA LYS 49 HA LYS 49 52.796 9.934 0.034 359 1HB LYS 49 HB2 LYS 49 52.578 7.653 -0.744 360 2HB LYS 49 HB1 LYS 49 53.365 7.666 0.812 361 1HG LYS 49 HG2 LYS 49 50.444 6.937 0.296 362 2HG LYS 49 HG1 LYS 49 51.732 5.802 0.580 363 1HD LYS 49 HD2 LYS 49 50.673 7.803 2.612 364 2HD LYS 49 HD1 LYS 49 50.372 6.087 2.586 365 1HE LYS 49 HE2 LYS 49 52.785 5.597 2.889 366 2HE LYS 49 HE1 LYS 49 53.140 7.318 2.942 367 1HZ LYS 49 HZ1 LYS 49 51.081 6.746 4.757 368 2HZ LYS 49 HZ2 LYS 49 52.636 7.358 5.056 369 3HZ LYS 49 HZ3 LYS 49 52.376 5.680 5.028 370 H ASP 50 HN ASP 50 49.779 9.156 1.435 371 HA ASP 50 HA ASP 50 48.271 10.500 -0.657 372 1HB ASP 50 HB2 ASP 50 48.716 8.293 -1.783 373 2HB ASP 50 HB1 ASP 50 47.976 7.458 -0.432 374 H SER 51 HN SER 51 48.151 11.345 1.727 375 HA SER 51 HA SER 51 46.079 10.023 3.381 376 1HB SER 51 HB2 SER 51 48.132 11.197 4.349 377 2HB SER 51 HB1 SER 51 47.437 12.727 3.788 378 HG SER 51 HG SER 51 46.848 11.981 5.967 379 H SER 52 HN SER 52 44.956 12.647 4.192 380 HA SER 52 HA SER 52 43.355 13.339 1.755 381 1HB SER 52 HB2 SER 52 42.267 12.860 4.550 382 2HB SER 52 HB1 SER 52 41.303 13.383 3.160 383 HG SER 52 HG SER 52 42.903 11.045 3.310 384 H GLU 53 HN GLU 53 44.847 14.464 4.656 385 HA GLU 53 HA GLU 53 44.005 17.303 4.037 386 1HB GLU 53 HB2 GLU 53 44.268 17.831 6.392 387 2HB GLU 53 HB1 GLU 53 43.176 16.473 6.278 388 1HG GLU 53 HG2 GLU 53 46.113 16.377 7.087 389 2HG GLU 53 HG1 GLU 53 44.731 16.136 8.132 390 H CYS 54 HN CYS 54 45.548 18.826 4.167 391 HA CYS 54 HA CYS 54 48.362 17.885 3.810 392 1HB CYS 54 HB2 CYS 54 47.099 20.469 2.936 393 2HB CYS 54 HB1 CYS 54 48.633 19.800 2.437 394 H VAL 55 HN VAL 55 49.987 18.987 4.710 395 HA VAL 55 HA VAL 55 49.518 21.070 6.743 396 HB VAL 55 HB VAL 55 50.976 19.742 8.348 397 1HG1 VAL 55 HG11 VAL 55 48.303 18.408 7.583 398 2HG1 VAL 55 HG12 VAL 55 48.451 19.800 8.640 399 3HG1 VAL 55 HG13 VAL 55 49.095 18.248 9.138 400 1HG2 VAL 55 HG21 VAL 55 51.070 17.262 8.041 401 2HG2 VAL 55 HG22 VAL 55 51.909 18.089 6.745 402 3HG2 VAL 55 HG23 VAL 55 50.307 17.429 6.470 403 H HIS 56 HN HIS 56 51.210 22.456 6.903 404 HA HIS 56 HA HIS 56 53.130 22.582 4.860 405 1HB HIS 56 HB2 HIS 56 53.216 23.813 7.643 406 2HB HIS 56 HB1 HIS 56 54.250 24.331 6.328 407 HD1 HIS 56 HD1 HIS 56 53.097 25.745 4.517 408 HD2 HIS 56 HD2 HIS 56 50.449 24.525 7.371 409 HE1 HIS 56 HE1 HIS 56 51.027 27.030 4.138 410 HA PRO 57 HA PRO 57 56.598 19.983 5.846 411 1HB PRO 57 HB2 PRO 57 58.666 21.856 5.537 412 2HB PRO 57 HB1 PRO 57 57.941 20.966 4.232 413 1HG PRO 57 HG2 PRO 57 57.313 23.718 5.180 414 2HG PRO 57 HG1 PRO 57 57.474 23.108 3.523 415 1HD PRO 57 HD2 PRO 57 55.106 23.540 4.552 416 2HD PRO 57 HD1 PRO 57 55.376 22.089 3.566 417 H SER 58 HN SER 58 56.378 23.138 7.298 418 HA SER 58 HA SER 58 58.181 22.715 9.495 419 1HB SER 58 HB2 SER 58 57.129 24.844 10.373 420 2HB SER 58 HB1 SER 58 57.560 24.986 8.662 421 HG SER 58 HG SER 58 55.342 24.083 8.323 422 H LYS 59 HN LYS 59 54.920 21.810 8.968 423 HA LYS 59 HA LYS 59 54.293 21.433 11.838 424 1HB LYS 59 HB2 LYS 59 52.702 20.594 9.395 425 2HB LYS 59 HB1 LYS 59 52.151 20.584 11.059 426 1HG LYS 59 HG2 LYS 59 52.302 23.026 11.152 427 2HG LYS 59 HG1 LYS 59 52.993 23.075 9.541 428 1HD LYS 59 HD2 LYS 59 50.628 23.505 9.288 429 2HD LYS 59 HD1 LYS 59 50.941 21.880 8.710 430 1HE LYS 59 HE2 LYS 59 50.091 20.885 10.783 431 2HE LYS 59 HE1 LYS 59 49.835 22.484 11.471 432 1HZ LYS 59 HZ1 LYS 59 48.110 22.910 10.049 433 2HZ LYS 59 HZ2 LYS 59 47.902 21.253 10.359 434 3HZ LYS 59 HZ3 LYS 59 48.610 21.763 8.901 435 H CYS 60 HN CYS 60 54.486 19.600 8.892 436 HA CYS 60 HA CYS 60 54.062 17.083 9.532 437 1HB CYS 60 HB2 CYS 60 56.302 18.198 7.883 438 2HB CYS 60 HB1 CYS 60 56.078 16.483 7.969 Start of MODEL 19 1 1H ASN 1 HT1 ASN 1 33.739 12.545 -10.733 2 2H ASN 1 HT2 ASN 1 35.437 12.532 -10.712 3 3H ASN 1 HT3 ASN 1 34.610 13.647 -11.689 4 HA ASN 1 HA ASN 1 33.740 14.770 -9.784 5 1HB ASN 1 HB2 ASN 1 33.586 12.786 -8.275 6 2HB ASN 1 HB1 ASN 1 35.339 12.692 -8.203 7 1HD2 ASN 1 HD21 ASN 1 36.260 13.760 -6.462 8 2HD2 ASN 1 HD22 ASN 1 35.529 15.014 -5.581 9 H PHE 2 HN PHE 2 34.919 16.397 -8.744 10 HA PHE 2 HA PHE 2 37.845 16.515 -9.112 11 1HB PHE 2 HB2 PHE 2 37.635 18.757 -10.275 12 2HB PHE 2 HB1 PHE 2 36.850 17.496 -11.210 13 HD1 PHE 2 HD1 PHE 2 36.334 20.557 -9.293 14 HD2 PHE 2 HD2 PHE 2 34.337 17.259 -11.116 15 HE1 PHE 2 HE1 PHE 2 34.210 21.773 -9.175 16 HE2 PHE 2 HE2 PHE 2 32.216 18.482 -10.994 17 HZ PHE 2 HZ PHE 2 32.147 20.740 -10.024 18 H VAL 3 HN VAL 3 35.788 16.408 -7.026 19 HA VAL 3 HA VAL 3 36.277 18.908 -5.485 20 HB VAL 3 HB VAL 3 34.446 16.528 -4.892 21 1HG1 VAL 3 HG11 VAL 3 35.128 17.761 -2.830 22 2HG1 VAL 3 HG12 VAL 3 33.433 18.027 -3.189 23 3HG1 VAL 3 HG13 VAL 3 34.615 19.271 -3.563 24 1HG2 VAL 3 HG21 VAL 3 33.797 19.308 -5.978 25 2HG2 VAL 3 HG22 VAL 3 32.616 18.070 -5.578 26 3HG2 VAL 3 HG23 VAL 3 33.733 17.820 -6.907 27 H CYS 4 HN CYS 4 37.474 18.935 -3.690 28 HA CYS 4 HA CYS 4 38.548 16.444 -2.541 29 1HB CYS 4 HB2 CYS 4 40.172 18.599 -3.882 30 2HB CYS 4 HB1 CYS 4 40.909 17.575 -2.703 31 HA PRO 5 HA PRO 5 38.257 18.029 1.308 32 1HB PRO 5 HB2 PRO 5 40.849 17.276 2.369 33 2HB PRO 5 HB1 PRO 5 39.343 16.430 2.505 34 1HG PRO 5 HG2 PRO 5 41.506 15.581 0.976 35 2HG PRO 5 HG1 PRO 5 39.849 14.976 0.860 36 1HD PRO 5 HD2 PRO 5 41.332 16.820 -0.888 37 2HD PRO 5 HD1 PRO 5 39.999 15.741 -1.286 38 HA PRO 6 HA PRO 6 39.923 22.002 2.514 39 1HB PRO 6 HB2 PRO 6 41.346 21.386 4.861 40 2HB PRO 6 HB1 PRO 6 39.654 21.788 4.737 41 1HG PRO 6 HG2 PRO 6 40.889 19.052 4.736 42 2HG PRO 6 HG1 PRO 6 39.505 19.620 5.676 43 1HD PRO 6 HD2 PRO 6 39.003 18.245 3.583 44 2HD PRO 6 HD1 PRO 6 38.143 19.786 3.735 45 H GLY 7 HN GLY 7 42.265 19.528 3.328 46 1HA GLY 7 HA2 GLY 7 44.650 20.969 2.982 47 2HA GLY 7 HA1 GLY 7 44.502 19.227 2.858 48 H GLN 8 HN GLN 8 42.585 19.709 0.486 49 HA GLN 8 HA GLN 8 44.679 20.444 -1.526 50 1HB GLN 8 HB2 GLN 8 42.799 18.053 -1.661 51 2HB GLN 8 HB1 GLN 8 43.931 18.509 -2.918 52 1HG GLN 8 HG2 GLN 8 45.833 18.136 -1.393 53 2HG GLN 8 HG1 GLN 8 44.741 17.777 -0.063 54 1HE2 GLN 8 HE21 GLN 8 43.777 15.732 0.037 55 2HE2 GLN 8 HE22 GLN 8 44.153 14.468 -1.027 56 H THR 9 HN THR 9 44.119 21.580 -3.170 57 HA THR 9 HA THR 9 41.255 22.062 -3.838 58 HB THR 9 HB THR 9 41.791 24.564 -3.980 59 HG1 THR 9 HG1 THR 9 43.991 24.203 -4.431 60 1HG2 THR 9 HG21 THR 9 42.163 24.992 -1.590 61 2HG2 THR 9 HG22 THR 9 42.770 23.358 -1.358 62 3HG2 THR 9 HG23 THR 9 41.073 23.611 -1.719 63 H PHE 10 HN PHE 10 41.318 23.634 -5.822 64 HA PHE 10 HA PHE 10 42.286 22.151 -8.047 65 1HB PHE 10 HB2 PHE 10 40.472 23.850 -8.300 66 2HB PHE 10 HB1 PHE 10 41.581 25.134 -7.847 67 HD1 PHE 10 HD1 PHE 10 43.373 25.843 -9.383 68 HD2 PHE 10 HD2 PHE 10 40.613 22.806 -10.545 69 HE1 PHE 10 HE1 PHE 10 44.094 26.086 -11.709 70 HE2 PHE 10 HE2 PHE 10 41.341 23.059 -12.877 71 HZ PHE 10 HZ PHE 10 43.068 24.696 -13.463 72 H GLN 11 HN GLN 11 44.303 21.908 -8.635 73 HA GLN 11 HA GLN 11 46.370 23.895 -7.767 74 1HB GLN 11 HB2 GLN 11 46.328 21.204 -7.217 75 2HB GLN 11 HB1 GLN 11 47.035 21.129 -8.815 76 1HG GLN 11 HG2 GLN 11 48.838 21.239 -7.192 77 2HG GLN 11 HG1 GLN 11 48.807 22.754 -8.082 78 1HE2 GLN 11 HE21 GLN 11 46.216 22.305 -5.658 79 2HE2 GLN 11 HE22 GLN 11 46.904 23.308 -4.499 80 H THR 12 HN THR 12 48.106 24.137 -9.533 81 HA THR 12 HA THR 12 46.709 24.308 -12.166 82 HB THR 12 HB THR 12 47.529 26.466 -11.251 83 HG1 THR 12 HG1 THR 12 47.681 25.707 -13.546 84 1HG2 THR 12 HG21 THR 12 50.317 25.233 -11.557 85 2HG2 THR 12 HG22 THR 12 49.560 25.551 -10.002 86 3HG2 THR 12 HG23 THR 12 49.949 26.884 -11.081 87 H CYS 13 HN CYS 13 49.657 23.021 -10.697 88 HA CYS 13 HA CYS 13 50.017 21.434 -13.177 89 1HB CYS 13 HB2 CYS 13 51.512 23.310 -13.406 90 2HB CYS 13 HB1 CYS 13 52.269 22.984 -11.866 91 H ALA 14 HN ALA 14 49.616 19.499 -12.394 92 HA ALA 14 HA ALA 14 51.658 18.251 -10.767 93 1HB ALA 14 HB1 ALA 14 50.109 17.590 -8.934 94 2HB ALA 14 HB2 ALA 14 48.842 18.570 -9.675 95 3HB ALA 14 HB3 ALA 14 50.285 19.339 -9.033 96 H SER 15 HN SER 15 51.954 16.226 -11.324 97 HA SER 15 HA SER 15 50.155 14.926 -13.215 98 1HB SER 15 HB2 SER 15 52.759 14.640 -13.190 99 2HB SER 15 HB1 SER 15 52.523 13.631 -11.775 100 HG SER 15 HG SER 15 51.150 13.251 -14.200 101 H SER 16 HN SER 16 51.073 12.380 -11.551 102 HA SER 16 HA SER 16 48.786 12.388 -9.640 103 1HB SER 16 HB2 SER 16 48.320 10.989 -11.708 104 2HB SER 16 HB1 SER 16 49.790 10.057 -11.382 105 HG SER 16 HG SER 16 48.911 9.250 -9.600 106 H CYS 17 HN CYS 17 51.707 13.036 -9.464 107 HA CYS 17 HA CYS 17 52.631 10.813 -7.648 108 1HB CYS 17 HB2 CYS 17 54.834 11.482 -7.981 109 2HB CYS 17 HB1 CYS 17 54.099 11.512 -9.548 110 HA PRO 18 HA PRO 18 50.818 14.178 -4.990 111 1HB PRO 18 HB2 PRO 18 50.833 12.525 -2.697 112 2HB PRO 18 HB1 PRO 18 49.483 12.840 -3.752 113 1HG PRO 18 HG2 PRO 18 51.369 10.545 -3.765 114 2HG PRO 18 HG1 PRO 18 49.633 10.578 -4.120 115 1HD PRO 18 HD2 PRO 18 51.423 10.355 -6.056 116 2HD PRO 18 HD1 PRO 18 49.968 11.348 -6.291 117 H LYS 19 HN LYS 19 51.794 15.650 -3.811 118 HA LYS 19 HA LYS 19 54.610 15.237 -2.988 119 1HB LYS 19 HB2 LYS 19 53.861 17.308 -4.268 120 2HB LYS 19 HB1 LYS 19 52.848 17.715 -2.889 121 1HG LYS 19 HG2 LYS 19 54.998 17.621 -1.465 122 2HG LYS 19 HG1 LYS 19 55.875 17.385 -2.942 123 1HD LYS 19 HD2 LYS 19 56.093 19.665 -2.300 124 2HD LYS 19 HD1 LYS 19 55.195 19.590 -3.792 125 1HE LYS 19 HE2 LYS 19 53.994 20.088 -1.034 126 2HE LYS 19 HE1 LYS 19 54.257 21.292 -2.263 127 1HZ LYS 19 HZ1 LYS 19 52.757 19.378 -3.493 128 2HZ LYS 19 HZ2 LYS 19 52.228 20.882 -2.921 129 3HZ LYS 19 HZ3 LYS 19 52.097 19.504 -1.937 130 H THR 20 HN THR 20 54.749 14.350 -1.082 131 HA THR 20 HA THR 20 52.797 15.049 1.068 132 HB THR 20 HB THR 20 53.195 12.698 1.908 133 HG1 THR 20 HG1 THR 20 55.045 12.885 -0.226 134 1HG2 THR 20 HG21 THR 20 51.537 12.996 -0.094 135 2HG2 THR 20 HG22 THR 20 52.331 11.450 -0.102 136 3HG2 THR 20 HG23 THR 20 52.884 12.704 -1.172 137 H CYS 21 HN CYS 21 53.850 14.308 3.281 138 HA CYS 21 HA CYS 21 55.882 16.219 3.864 139 1HB CYS 21 HB2 CYS 21 55.119 13.691 5.341 140 2HB CYS 21 HB1 CYS 21 56.137 14.934 5.994 141 H GLU 22 HN GLU 22 55.954 13.088 2.589 142 HA GLU 22 HA GLU 22 58.661 12.301 3.162 143 1HB GLU 22 HB2 GLU 22 56.863 10.746 2.323 144 2HB GLU 22 HB1 GLU 22 56.879 11.589 0.787 145 1HG GLU 22 HG2 GLU 22 59.244 10.927 0.413 146 2HG GLU 22 HG1 GLU 22 59.247 10.078 1.954 147 H THR 23 HN THR 23 57.122 13.939 0.420 148 HA THR 23 HA THR 23 59.656 14.512 -0.941 149 HB THR 23 HB THR 23 58.160 15.801 -2.541 150 HG1 THR 23 HG1 THR 23 56.198 14.814 -0.758 151 1HG2 THR 23 HG21 THR 23 57.034 13.050 -1.811 152 2HG2 THR 23 HG22 THR 23 58.439 13.288 -2.846 153 3HG2 THR 23 HG23 THR 23 56.861 13.872 -3.356 154 H ARG 24 HN ARG 24 57.167 16.951 -0.257 155 HA ARG 24 HA ARG 24 57.289 19.113 0.541 156 1HB ARG 24 HB2 ARG 24 59.872 18.143 1.824 157 2HB ARG 24 HB1 ARG 24 59.123 19.684 2.133 158 1HG ARG 24 HG2 ARG 24 57.085 18.581 2.948 159 2HG ARG 24 HG1 ARG 24 57.739 17.004 2.538 160 1HD ARG 24 HD2 ARG 24 58.889 18.881 4.681 161 2HD ARG 24 HD1 ARG 24 57.918 17.457 4.978 162 HE ARG 24 HE ARG 24 59.716 16.079 4.323 163 1HH1 ARG 24 HH11 ARG 24 60.483 19.451 3.981 164 2HH1 ARG 24 HH12 ARG 24 62.181 19.156 3.833 165 1HH2 ARG 24 HH21 ARG 24 61.858 15.698 4.129 166 2HH2 ARG 24 HH22 ARG 24 62.971 17.007 3.913 167 H ASN 25 HN ASN 25 59.621 17.860 -1.365 168 HA ASN 25 HA ASN 25 61.420 19.950 -1.809 169 1HB ASN 25 HB2 ASN 25 60.477 17.736 -3.676 170 2HB ASN 25 HB1 ASN 25 61.969 18.629 -3.865 171 1HD2 ASN 25 HD21 ASN 25 62.347 18.595 -0.802 172 2HD2 ASN 25 HD22 ASN 25 62.916 17.026 -0.496 173 H LYS 26 HN LYS 26 58.429 19.188 -3.658 174 HA LYS 26 HA LYS 26 58.742 21.631 -5.244 175 1HB LYS 26 HB2 LYS 26 56.630 19.409 -5.297 176 2HB LYS 26 HB1 LYS 26 56.648 20.762 -6.392 177 1HG LYS 26 HG2 LYS 26 57.551 18.867 -7.512 178 2HG LYS 26 HG1 LYS 26 58.842 20.019 -7.277 179 1HD LYS 26 HD2 LYS 26 59.616 17.727 -6.901 180 2HD LYS 26 HD1 LYS 26 59.751 18.644 -5.428 181 1HE LYS 26 HE2 LYS 26 57.598 17.600 -4.624 182 2HE LYS 26 HE1 LYS 26 57.466 16.729 -6.146 183 1HZ LYS 26 HZ1 LYS 26 58.446 15.192 -4.822 184 2HZ LYS 26 HZ2 LYS 26 59.324 16.332 -3.923 185 3HZ LYS 26 HZ3 LYS 26 59.828 15.919 -5.490 186 H LEU 27 HN LEU 27 56.415 22.512 -5.605 187 HA LEU 27 HA LEU 27 55.096 23.174 -3.012 188 1HB LEU 27 HB2 LEU 27 55.726 25.222 -5.219 189 2HB LEU 27 HB1 LEU 27 54.821 25.556 -3.766 190 HG LEU 27 HG LEU 27 56.930 25.059 -2.430 191 1HD1 LEU 27 HD11 LEU 27 58.286 23.811 -4.139 192 2HD1 LEU 27 HD12 LEU 27 59.111 25.236 -3.584 193 3HD1 LEU 27 HD13 LEU 27 58.305 25.241 -5.141 194 1HD2 LEU 27 HD21 LEU 27 57.921 27.290 -2.921 195 2HD2 LEU 27 HD22 LEU 27 56.168 27.357 -2.882 196 3HD2 LEU 27 HD23 LEU 27 57.011 27.359 -4.422 197 H VAL 28 HN VAL 28 54.494 21.417 -4.886 198 HA VAL 28 HA VAL 28 51.665 21.957 -5.470 199 HB VAL 28 HB VAL 28 51.881 21.158 -7.870 200 1HG1 VAL 28 HG11 VAL 28 53.341 23.805 -7.296 201 2HG1 VAL 28 HG12 VAL 28 51.597 23.621 -7.406 202 3HG1 VAL 28 HG13 VAL 28 52.603 23.362 -8.819 203 1HG2 VAL 28 HG21 VAL 28 54.840 21.814 -7.414 204 2HG2 VAL 28 HG22 VAL 28 54.131 21.412 -8.966 205 3HG2 VAL 28 HG23 VAL 28 54.192 20.211 -7.688 206 H LEU 29 HN LEU 29 50.500 20.130 -5.992 207 HA LEU 29 HA LEU 29 51.071 17.872 -4.553 208 1HB LEU 29 HB2 LEU 29 48.863 18.418 -5.425 209 2HB LEU 29 HB1 LEU 29 49.382 18.174 -7.066 210 HG LEU 29 HG LEU 29 49.831 15.691 -6.378 211 1HD1 LEU 29 HD11 LEU 29 48.247 16.548 -3.920 212 2HD1 LEU 29 HD12 LEU 29 49.935 16.075 -3.919 213 3HD1 LEU 29 HD13 LEU 29 48.696 14.900 -4.316 214 1HD2 LEU 29 HD21 LEU 29 47.495 14.993 -6.526 215 2HD2 LEU 29 HD22 LEU 29 47.852 16.262 -7.685 216 3HD2 LEU 29 HD23 LEU 29 46.963 16.631 -6.221 217 H CYS 30 HN CYS 30 52.131 18.574 -7.665 218 HA CYS 30 HA CYS 30 54.186 16.539 -7.657 219 1HB CYS 30 HB2 CYS 30 52.274 15.082 -8.208 220 2HB CYS 30 HB1 CYS 30 51.813 16.136 -9.498 221 H ASP 31 HN ASP 31 55.417 16.495 -9.704 222 HA ASP 31 HA ASP 31 55.261 19.098 -11.171 223 1HB ASP 31 HB2 ASP 31 57.752 19.096 -11.143 224 2HB ASP 31 HB1 ASP 31 57.066 19.104 -9.530 225 H LYS 32 HN LYS 32 55.885 15.740 -11.377 226 HA LYS 32 HA LYS 32 57.114 15.351 -13.832 227 1HB LYS 32 HB2 LYS 32 54.793 13.726 -12.706 228 2HB LYS 32 HB1 LYS 32 55.947 13.152 -13.889 229 1HG LYS 32 HG2 LYS 32 56.610 14.001 -11.029 230 2HG LYS 32 HG1 LYS 32 56.509 12.356 -11.612 231 1HD LYS 32 HD2 LYS 32 58.418 12.777 -13.165 232 2HD LYS 32 HD1 LYS 32 58.526 14.434 -12.595 233 1HE LYS 32 HE2 LYS 32 60.182 13.029 -11.433 234 2HE LYS 32 HE1 LYS 32 58.990 13.638 -10.293 235 1HZ LYS 32 HZ1 LYS 32 59.599 11.204 -10.170 236 2HZ LYS 32 HZ2 LYS 32 58.682 11.005 -11.586 237 3HZ LYS 32 HZ3 LYS 32 57.944 11.588 -10.172 238 H LYS 33 HN LYS 33 53.871 16.414 -13.361 239 HA LYS 33 HA LYS 33 53.558 17.113 -16.177 240 1HB LYS 33 HB2 LYS 33 52.770 14.719 -16.195 241 2HB LYS 33 HB1 LYS 33 51.680 15.067 -14.874 242 1HG LYS 33 HG2 LYS 33 50.436 15.014 -16.923 243 2HG LYS 33 HG1 LYS 33 50.382 16.608 -16.226 244 1HD LYS 33 HD2 LYS 33 52.244 17.300 -17.860 245 2HD LYS 33 HD1 LYS 33 52.133 15.699 -18.563 246 1HE LYS 33 HE2 LYS 33 50.772 17.336 -19.843 247 2HE LYS 33 HE1 LYS 33 49.739 16.110 -19.121 248 1HZ LYS 33 HZ1 LYS 33 49.159 18.607 -18.895 249 2HZ LYS 33 HZ2 LYS 33 50.292 18.575 -17.629 250 3HZ LYS 33 HZ3 LYS 33 48.932 17.561 -17.575 251 H CYS 34 HN CYS 34 51.643 18.400 -16.520 252 HA CYS 34 HA CYS 34 50.868 19.803 -14.030 253 1HB CYS 34 HB2 CYS 34 50.938 20.742 -16.837 254 2HB CYS 34 HB1 CYS 34 50.287 21.664 -15.510 255 H ASN 35 HN ASN 35 49.256 18.233 -13.729 256 HA ASN 35 HA ASN 35 46.790 18.447 -15.430 257 1HB ASN 35 HB2 ASN 35 46.802 16.993 -12.702 258 2HB ASN 35 HB1 ASN 35 45.752 16.783 -14.062 259 1HD2 ASN 35 HD21 ASN 35 47.336 14.782 -12.617 260 2HD2 ASN 35 HD22 ASN 35 48.277 13.983 -13.775 261 H GLN 36 HN GLN 36 45.867 20.433 -15.067 262 HA GLN 36 HA GLN 36 46.147 21.782 -12.478 263 1HB GLN 36 HB2 GLN 36 44.862 23.600 -13.606 264 2HB GLN 36 HB1 GLN 36 46.221 23.080 -14.557 265 1HG GLN 36 HG2 GLN 36 44.740 21.740 -16.035 266 2HG GLN 36 HG1 GLN 36 43.333 22.262 -15.119 267 1HE2 GLN 36 HE21 GLN 36 46.228 23.914 -16.502 268 2HE2 GLN 36 HE22 GLN 36 45.337 25.167 -17.223 269 H ARG 37 HN ARG 37 45.227 20.504 -11.074 270 HA ARG 37 HA ARG 37 42.387 20.690 -10.601 271 1HB ARG 37 HB2 ARG 37 41.943 18.199 -10.675 272 2HB ARG 37 HB1 ARG 37 42.288 18.861 -12.250 273 1HG ARG 37 HG2 ARG 37 44.668 18.132 -12.057 274 2HG ARG 37 HG1 ARG 37 44.389 17.540 -10.437 275 1HD ARG 37 HD2 ARG 37 43.092 16.476 -12.983 276 2HD ARG 37 HD1 ARG 37 44.373 15.680 -12.077 277 HE ARG 37 HE ARG 37 41.570 15.667 -11.434 278 1HH1 ARG 37 HH11 ARG 37 44.740 15.665 -10.025 279 2HH1 ARG 37 HH12 ARG 37 44.213 14.886 -8.571 280 1HH2 ARG 37 HH21 ARG 37 40.889 14.675 -9.603 281 2HH2 ARG 37 HH22 ARG 37 42.006 14.315 -8.329 282 H CYS 38 HN CYS 38 41.900 18.843 -8.882 283 HA CYS 38 HA CYS 38 42.589 19.473 -6.398 284 1HB CYS 38 HB2 CYS 38 41.141 17.660 -6.843 285 2HB CYS 38 HB1 CYS 38 42.446 16.695 -7.488 286 H GLY 39 HN GLY 39 44.134 19.447 -4.986 287 1HA GLY 39 HA2 GLY 39 46.336 17.789 -4.658 288 2HA GLY 39 HA1 GLY 39 46.886 19.009 -5.810 289 H CYS 40 HN CYS 40 47.926 18.504 -3.197 290 HA CYS 40 HA CYS 40 47.020 20.157 -1.162 291 1HB CYS 40 HB2 CYS 40 49.894 19.599 -1.918 292 2HB CYS 40 HB1 CYS 40 49.394 20.344 -0.433 293 H ILE 41 HN ILE 41 47.440 22.128 -0.470 294 HA ILE 41 HA ILE 41 47.373 24.245 -2.364 295 HB ILE 41 HB ILE 41 48.356 24.688 0.484 296 1HG1 ILE 41 HG12 ILE 41 46.500 23.076 0.820 297 2HG1 ILE 41 HG11 ILE 41 46.002 24.669 1.309 298 1HG2 ILE 41 HG21 ILE 41 46.900 26.694 0.263 299 2HG2 ILE 41 HG22 ILE 41 46.413 26.163 -1.338 300 3HG2 ILE 41 HG23 ILE 41 48.076 26.620 -1.038 301 1HD1 ILE 41 HD11 ILE 41 44.237 23.544 0.070 302 2HD1 ILE 41 HD12 ILE 41 45.273 23.368 -1.338 303 3HD1 ILE 41 HD13 ILE 41 44.757 24.965 -0.818 304 H SER 42 HN SER 42 48.989 25.929 -2.599 305 HA SER 42 HA SER 42 51.602 24.809 -3.155 306 1HB SER 42 HB2 SER 42 52.123 27.209 -3.911 307 2HB SER 42 HB1 SER 42 50.607 26.617 -4.603 308 HG SER 42 HG SER 42 51.039 28.399 -2.490 309 H GLY 43 HN GLY 43 52.572 24.147 -1.419 310 1HA GLY 43 HA2 GLY 43 54.448 25.048 0.050 311 2HA GLY 43 HA1 GLY 43 53.211 26.063 0.793 312 H THR 44 HN THR 44 51.393 23.567 0.247 313 HA THR 44 HA THR 44 52.023 22.226 2.826 314 HB THR 44 HB THR 44 49.619 21.510 2.824 315 HG1 THR 44 HG1 THR 44 49.932 22.186 0.239 316 1HG2 THR 44 HG21 THR 44 50.153 23.795 3.710 317 2HG2 THR 44 HG22 THR 44 48.555 23.720 2.979 318 3HG2 THR 44 HG23 THR 44 49.889 24.464 2.103 319 H VAL 45 HN VAL 45 51.847 20.109 3.012 320 HA VAL 45 HA VAL 45 52.067 18.434 0.560 321 HB VAL 45 HB VAL 45 53.713 17.001 1.839 322 1HG1 VAL 45 HG11 VAL 45 54.454 18.550 0.132 323 2HG1 VAL 45 HG12 VAL 45 55.623 18.457 1.428 324 3HG1 VAL 45 HG13 VAL 45 54.566 19.861 1.298 325 1HG2 VAL 45 HG21 VAL 45 53.928 19.440 3.624 326 2HG2 VAL 45 HG22 VAL 45 54.982 18.055 3.687 327 3HG2 VAL 45 HG23 VAL 45 53.300 17.875 4.140 328 H LEU 46 HN LEU 46 50.896 16.781 0.441 329 HA LEU 46 HA LEU 46 48.807 16.082 2.177 330 1HB LEU 46 HB2 LEU 46 48.920 15.559 -0.266 331 2HB LEU 46 HB1 LEU 46 50.201 14.428 0.025 332 HG LEU 46 HG LEU 46 48.560 13.085 1.462 333 1HD1 LEU 46 HD11 LEU 46 46.569 15.062 0.269 334 2HD1 LEU 46 HD12 LEU 46 46.988 14.960 1.965 335 3HD1 LEU 46 HD13 LEU 46 46.140 13.642 1.196 336 1HD2 LEU 46 HD21 LEU 46 49.010 12.465 -0.898 337 2HD2 LEU 46 HD22 LEU 46 47.756 13.570 -1.439 338 3HD2 LEU 46 HD23 LEU 46 47.332 12.157 -0.486 339 H LYS 47 HN LYS 47 49.368 15.624 4.241 340 HA LYS 47 HA LYS 47 51.071 14.772 5.840 341 1HB LYS 47 HB2 LYS 47 48.578 13.179 5.320 342 2HB LYS 47 HB1 LYS 47 49.593 12.747 6.673 343 1HG LYS 47 HG2 LYS 47 48.345 15.420 6.167 344 2HG LYS 47 HG1 LYS 47 47.679 14.154 7.200 345 1HD LYS 47 HD2 LYS 47 49.789 14.284 8.599 346 2HD LYS 47 HD1 LYS 47 50.350 15.613 7.600 347 1HE LYS 47 HE2 LYS 47 48.334 16.927 8.227 348 2HE LYS 47 HE1 LYS 47 47.805 15.605 9.255 349 1HZ LYS 47 HZ1 LYS 47 49.142 17.541 10.256 350 2HZ LYS 47 HZ2 LYS 47 50.489 16.719 9.627 351 3HZ LYS 47 HZ3 LYS 47 49.470 15.950 10.745 352 H SER 48 HN SER 48 49.830 12.047 4.111 353 HA SER 48 HA SER 48 52.534 10.821 4.178 354 1HB SER 48 HB2 SER 48 49.824 9.397 4.425 355 2HB SER 48 HB1 SER 48 51.397 8.586 4.443 356 HG SER 48 HG SER 48 51.933 10.134 6.163 357 H LYS 49 HN LYS 49 52.686 8.956 2.700 358 HA LYS 49 HA LYS 49 53.068 9.624 0.120 359 1HB LYS 49 HB2 LYS 49 53.740 7.477 1.118 360 2HB LYS 49 HB1 LYS 49 52.081 6.924 1.095 361 1HG LYS 49 HG2 LYS 49 53.324 5.975 -0.808 362 2HG LYS 49 HG1 LYS 49 52.055 7.024 -1.393 363 1HD LYS 49 HD2 LYS 49 53.771 8.870 -1.686 364 2HD LYS 49 HD1 LYS 49 55.014 7.771 -1.117 365 1HE LYS 49 HE2 LYS 49 54.967 7.858 -3.591 366 2HE LYS 49 HE1 LYS 49 54.504 6.253 -3.044 367 1HZ LYS 49 HZ1 LYS 49 52.326 6.593 -3.588 368 2HZ LYS 49 HZ2 LYS 49 53.106 7.469 -4.816 369 3HZ LYS 49 HZ3 LYS 49 52.432 8.285 -3.487 370 H ASP 50 HN ASP 50 50.006 8.851 1.495 371 HA ASP 50 HA ASP 50 48.545 9.974 -0.754 372 1HB ASP 50 HB2 ASP 50 49.106 7.687 -1.674 373 2HB ASP 50 HB1 ASP 50 48.324 6.947 -0.290 374 H SER 51 HN SER 51 48.380 10.956 1.575 375 HA SER 51 HA SER 51 46.277 9.740 3.258 376 1HB SER 51 HB2 SER 51 48.295 10.927 4.213 377 2HB SER 51 HB1 SER 51 47.709 12.431 3.490 378 HG SER 51 HG SER 51 45.740 11.167 4.831 379 H SER 52 HN SER 52 45.082 12.315 3.954 380 HA SER 52 HA SER 52 43.644 13.143 1.487 381 1HB SER 52 HB2 SER 52 41.463 12.925 2.754 382 2HB SER 52 HB1 SER 52 42.278 11.360 2.629 383 HG SER 52 HG SER 52 43.281 11.878 4.662 384 H GLU 53 HN GLU 53 45.536 14.119 3.851 385 HA GLU 53 HA GLU 53 44.364 16.850 3.940 386 1HB GLU 53 HB2 GLU 53 43.792 15.685 6.096 387 2HB GLU 53 HB1 GLU 53 45.493 15.346 6.352 388 1HG GLU 53 HG2 GLU 53 45.972 17.814 6.396 389 2HG GLU 53 HG1 GLU 53 44.265 18.140 6.147 390 H CYS 54 HN CYS 54 45.820 18.467 3.924 391 HA CYS 54 HA CYS 54 48.687 17.693 3.587 392 1HB CYS 54 HB2 CYS 54 47.255 20.046 2.344 393 2HB CYS 54 HB1 CYS 54 48.893 19.546 2.039 394 H VAL 55 HN VAL 55 50.199 18.949 4.473 395 HA VAL 55 HA VAL 55 49.573 21.330 6.091 396 HB VAL 55 HB VAL 55 50.939 20.281 8.041 397 1HG1 VAL 55 HG11 VAL 55 48.295 18.884 7.310 398 2HG1 VAL 55 HG12 VAL 55 48.404 20.441 8.111 399 3HG1 VAL 55 HG13 VAL 55 48.977 18.999 8.923 400 1HG2 VAL 55 HG21 VAL 55 51.966 18.444 6.779 401 2HG2 VAL 55 HG22 VAL 55 50.394 17.709 6.524 402 3HG2 VAL 55 HG23 VAL 55 51.058 17.835 8.144 403 H HIS 56 HN HIS 56 51.344 22.694 6.282 404 HA HIS 56 HA HIS 56 53.351 22.567 4.316 405 1HB HIS 56 HB2 HIS 56 53.324 24.040 6.982 406 2HB HIS 56 HB1 HIS 56 54.503 24.364 5.724 407 HD1 HIS 56 HD1 HIS 56 53.573 25.528 3.616 408 HD2 HIS 56 HD2 HIS 56 50.671 24.948 6.425 409 HE1 HIS 56 HE1 HIS 56 51.641 26.886 2.908 410 HA PRO 57 HA PRO 57 56.601 19.868 5.672 411 1HB PRO 57 HB2 PRO 57 58.812 21.562 5.354 412 2HB PRO 57 HB1 PRO 57 58.071 20.637 4.074 413 1HG PRO 57 HG2 PRO 57 57.611 23.492 4.807 414 2HG PRO 57 HG1 PRO 57 57.817 22.761 3.205 415 1HD PRO 57 HD2 PRO 57 55.425 23.416 4.064 416 2HD PRO 57 HD1 PRO 57 55.654 21.890 3.190 417 H SER 58 HN SER 58 56.515 23.121 6.919 418 HA SER 58 HA SER 58 58.122 22.636 9.279 419 1HB SER 58 HB2 SER 58 57.327 24.954 9.916 420 2HB SER 58 HB1 SER 58 57.911 24.902 8.245 421 HG SER 58 HG SER 58 55.694 24.407 7.662 422 H LYS 59 HN LYS 59 54.970 21.832 8.509 423 HA LYS 59 HA LYS 59 54.019 21.823 11.334 424 1HB LYS 59 HB2 LYS 59 52.546 21.406 8.727 425 2HB LYS 59 HB1 LYS 59 51.793 21.328 10.312 426 1HG LYS 59 HG2 LYS 59 52.471 23.683 10.729 427 2HG LYS 59 HG1 LYS 59 53.210 23.758 9.137 428 1HD LYS 59 HD2 LYS 59 51.023 23.200 8.097 429 2HD LYS 59 HD1 LYS 59 50.285 23.112 9.682 430 1HE LYS 59 HE2 LYS 59 51.585 25.614 8.497 431 2HE LYS 59 HE1 LYS 59 49.853 25.338 8.630 432 1HZ LYS 59 HZ1 LYS 59 50.339 26.590 10.472 433 2HZ LYS 59 HZ2 LYS 59 51.819 25.807 10.762 434 3HZ LYS 59 HZ3 LYS 59 50.358 25.012 11.101 435 H CYS 60 HN CYS 60 54.537 19.768 8.549 436 HA CYS 60 HA CYS 60 53.454 17.378 9.314 437 1HB CYS 60 HB2 CYS 60 56.040 18.006 7.972 438 2HB CYS 60 HB1 CYS 60 55.576 16.341 8.159 Start of MODEL 20 1 1H ASN 1 HT1 ASN 1 37.345 24.004 -12.957 2 2H ASN 1 HT2 ASN 1 38.958 23.476 -12.909 3 3H ASN 1 HT3 ASN 1 38.578 25.075 -12.485 4 HA ASN 1 HA ASN 1 38.998 23.832 -10.511 5 1HB ASN 1 HB2 ASN 1 37.190 25.544 -10.411 6 2HB ASN 1 HB1 ASN 1 36.013 24.335 -10.904 7 1HD2 ASN 1 HD21 ASN 1 38.686 24.354 -8.462 8 2HD2 ASN 1 HD22 ASN 1 37.711 23.814 -7.181 9 H PHE 2 HN PHE 2 38.504 22.044 -9.154 10 HA PHE 2 HA PHE 2 37.039 19.751 -10.362 11 1HB PHE 2 HB2 PHE 2 39.595 19.657 -10.758 12 2HB PHE 2 HB1 PHE 2 39.798 19.653 -9.017 13 HD1 PHE 2 HD1 PHE 2 37.592 17.803 -11.452 14 HD2 PHE 2 HD2 PHE 2 40.309 17.534 -8.184 15 HE1 PHE 2 HE1 PHE 2 37.336 15.367 -11.433 16 HE2 PHE 2 HE2 PHE 2 40.053 15.100 -8.168 17 HZ PHE 2 HZ PHE 2 38.564 14.008 -9.793 18 H VAL 3 HN VAL 3 37.976 18.286 -8.001 19 HA VAL 3 HA VAL 3 36.581 19.692 -5.759 20 HB VAL 3 HB VAL 3 36.110 16.781 -6.617 21 1HG1 VAL 3 HG11 VAL 3 34.815 18.402 -4.372 22 2HG1 VAL 3 HG12 VAL 3 35.957 17.089 -4.139 23 3HG1 VAL 3 HG13 VAL 3 34.379 16.762 -4.826 24 1HG2 VAL 3 HG21 VAL 3 34.961 18.398 -8.123 25 2HG2 VAL 3 HG22 VAL 3 34.229 19.182 -6.731 26 3HG2 VAL 3 HG23 VAL 3 33.797 17.529 -7.141 27 H CYS 4 HN CYS 4 37.326 19.350 -3.824 28 HA CYS 4 HA CYS 4 39.613 17.492 -3.425 29 1HB CYS 4 HB2 CYS 4 39.354 20.310 -2.543 30 2HB CYS 4 HB1 CYS 4 40.637 19.281 -2.006 31 HA PRO 5 HA PRO 5 38.061 17.645 0.946 32 1HB PRO 5 HB2 PRO 5 40.633 16.818 1.937 33 2HB PRO 5 HB1 PRO 5 39.194 15.856 1.809 34 1HG PRO 5 HG2 PRO 5 41.425 15.368 0.287 35 2HG PRO 5 HG1 PRO 5 39.784 14.939 -0.231 36 1HD PRO 5 HD2 PRO 5 41.374 17.390 -0.875 37 2HD PRO 5 HD1 PRO 5 40.519 16.344 -2.016 38 HA PRO 6 HA PRO 6 39.304 21.393 2.905 39 1HB PRO 6 HB2 PRO 6 40.769 20.441 5.144 40 2HB PRO 6 HB1 PRO 6 39.057 20.773 5.063 41 1HG PRO 6 HG2 PRO 6 40.463 18.164 4.557 42 2HG PRO 6 HG1 PRO 6 38.989 18.460 5.498 43 1HD PRO 6 HD2 PRO 6 38.733 17.481 3.173 44 2HD PRO 6 HD1 PRO 6 37.744 18.902 3.529 45 H GLY 7 HN GLY 7 42.145 19.376 3.597 46 1HA GLY 7 HA2 GLY 7 44.025 21.517 3.283 47 2HA GLY 7 HA1 GLY 7 44.409 19.828 3.485 48 H GLN 8 HN GLN 8 42.470 20.623 0.745 49 HA GLN 8 HA GLN 8 44.833 20.801 -1.047 50 1HB GLN 8 HB2 GLN 8 42.590 18.793 -1.411 51 2HB GLN 8 HB1 GLN 8 43.912 19.042 -2.521 52 1HG GLN 8 HG2 GLN 8 45.540 18.293 -0.847 53 2HG GLN 8 HG1 GLN 8 44.263 18.063 0.343 54 1HE2 GLN 8 HE21 GLN 8 44.445 15.806 0.548 55 2HE2 GLN 8 HE22 GLN 8 44.121 14.717 -0.710 56 H THR 9 HN THR 9 44.410 21.649 -3.040 57 HA THR 9 HA THR 9 41.728 22.810 -3.580 58 HB THR 9 HB THR 9 42.913 25.028 -4.138 59 HG1 THR 9 HG1 THR 9 45.024 23.424 -3.165 60 1HG2 THR 9 HG21 THR 9 41.932 24.671 -1.832 61 2HG2 THR 9 HG22 THR 9 43.368 25.688 -1.811 62 3HG2 THR 9 HG23 THR 9 43.466 24.006 -1.312 63 H PHE 10 HN PHE 10 41.883 23.990 -5.777 64 HA PHE 10 HA PHE 10 42.609 21.972 -7.772 65 1HB PHE 10 HB2 PHE 10 40.452 23.150 -7.873 66 2HB PHE 10 HB1 PHE 10 41.268 24.696 -8.002 67 HD1 PHE 10 HD1 PHE 10 41.830 25.539 -10.136 68 HD2 PHE 10 HD2 PHE 10 40.962 21.390 -9.722 69 HE1 PHE 10 HE1 PHE 10 41.883 25.284 -12.574 70 HE2 PHE 10 HE2 PHE 10 41.010 21.140 -12.162 71 HZ PHE 10 HZ PHE 10 41.467 23.091 -13.591 72 H GLN 11 HN GLN 11 44.526 21.918 -8.770 73 HA GLN 11 HA GLN 11 46.100 24.423 -9.151 74 1HB GLN 11 HB2 GLN 11 46.987 21.638 -8.290 75 2HB GLN 11 HB1 GLN 11 48.109 22.713 -9.087 76 1HG GLN 11 HG2 GLN 11 48.382 22.813 -6.640 77 2HG GLN 11 HG1 GLN 11 47.903 24.362 -7.280 78 1HE2 GLN 11 HE21 GLN 11 46.835 21.676 -5.210 79 2HE2 GLN 11 HE22 GLN 11 45.500 22.499 -4.582 80 H THR 12 HN THR 12 46.877 24.721 -11.147 81 HA THR 12 HA THR 12 45.730 23.096 -13.255 82 HB THR 12 HB THR 12 45.802 25.570 -13.503 83 HG1 THR 12 HG1 THR 12 45.859 24.440 -15.377 84 1HG2 THR 12 HG21 THR 12 48.846 25.227 -13.769 85 2HG2 THR 12 HG22 THR 12 48.080 25.970 -12.373 86 3HG2 THR 12 HG23 THR 12 47.941 26.716 -13.958 87 H CYS 13 HN CYS 13 49.074 23.700 -12.138 88 HA CYS 13 HA CYS 13 49.903 21.579 -14.008 89 1HB CYS 13 HB2 CYS 13 51.384 23.935 -13.021 90 2HB CYS 13 HB1 CYS 13 52.266 22.556 -13.627 91 H ALA 14 HN ALA 14 49.647 19.759 -12.875 92 HA ALA 14 HA ALA 14 51.891 18.924 -11.272 93 1HB ALA 14 HB1 ALA 14 50.424 19.989 -9.497 94 2HB ALA 14 HB2 ALA 14 50.508 18.251 -9.270 95 3HB ALA 14 HB3 ALA 14 49.087 18.971 -10.010 96 H SER 15 HN SER 15 52.290 16.810 -11.600 97 HA SER 15 HA SER 15 50.525 15.353 -13.410 98 1HB SER 15 HB2 SER 15 53.146 15.144 -13.348 99 2HB SER 15 HB1 SER 15 52.906 14.158 -11.916 100 HG SER 15 HG SER 15 52.160 12.617 -13.042 101 H SER 16 HN SER 16 51.380 12.843 -11.781 102 HA SER 16 HA SER 16 49.167 12.923 -9.779 103 1HB SER 16 HB2 SER 16 48.646 11.502 -11.821 104 2HB SER 16 HB1 SER 16 50.103 10.552 -11.500 105 HG SER 16 HG SER 16 49.242 9.795 -9.688 106 H CYS 17 HN CYS 17 52.033 13.610 -9.586 107 HA CYS 17 HA CYS 17 53.016 11.378 -7.807 108 1HB CYS 17 HB2 CYS 17 55.213 12.085 -8.166 109 2HB CYS 17 HB1 CYS 17 54.461 12.134 -9.726 110 HA PRO 18 HA PRO 18 51.371 14.868 -5.192 111 1HB PRO 18 HB2 PRO 18 50.663 13.320 -3.034 112 2HB PRO 18 HB1 PRO 18 49.633 13.680 -4.392 113 1HG PRO 18 HG2 PRO 18 51.280 11.244 -3.905 114 2HG PRO 18 HG1 PRO 18 49.627 11.372 -4.533 115 1HD PRO 18 HD2 PRO 18 51.696 10.929 -6.148 116 2HD PRO 18 HD1 PRO 18 50.328 11.954 -6.643 117 H LYS 19 HN LYS 19 52.362 16.040 -3.722 118 HA LYS 19 HA LYS 19 54.935 15.106 -2.606 119 1HB LYS 19 HB2 LYS 19 55.110 17.467 -1.743 120 2HB LYS 19 HB1 LYS 19 54.814 17.448 -3.470 121 1HG LYS 19 HG2 LYS 19 52.464 17.934 -3.125 122 2HG LYS 19 HG1 LYS 19 52.624 17.795 -1.393 123 1HD LYS 19 HD2 LYS 19 54.138 19.734 -1.336 124 2HD LYS 19 HD1 LYS 19 54.142 19.855 -3.068 125 1HE LYS 19 HE2 LYS 19 51.672 20.251 -2.991 126 2HE LYS 19 HE1 LYS 19 51.752 20.156 -1.234 127 1HZ LYS 19 HZ1 LYS 19 53.688 21.963 -2.065 128 2HZ LYS 19 HZ2 LYS 19 52.268 22.283 -1.197 129 3HZ LYS 19 HZ3 LYS 19 52.261 22.358 -2.895 130 H THR 20 HN THR 20 55.286 15.109 -0.457 131 HA THR 20 HA THR 20 53.050 15.199 1.467 132 HB THR 20 HB THR 20 53.450 12.865 2.264 133 HG1 THR 20 HG1 THR 20 55.613 12.793 1.595 134 1HG2 THR 20 HG21 THR 20 53.188 12.775 -0.815 135 2HG2 THR 20 HG22 THR 20 51.818 13.019 0.247 136 3HG2 THR 20 HG23 THR 20 52.697 11.516 0.289 137 H CYS 21 HN CYS 21 53.990 14.300 3.694 138 HA CYS 21 HA CYS 21 56.060 16.114 4.463 139 1HB CYS 21 HB2 CYS 21 55.111 13.565 5.775 140 2HB CYS 21 HB1 CYS 21 56.231 14.660 6.518 141 H GLU 22 HN GLU 22 56.045 13.100 2.989 142 HA GLU 22 HA GLU 22 58.820 12.298 3.583 143 1HB GLU 22 HB2 GLU 22 57.313 11.168 1.188 144 2HB GLU 22 HB1 GLU 22 58.402 10.371 2.298 145 1HG GLU 22 HG2 GLU 22 56.661 10.473 4.047 146 2HG GLU 22 HG1 GLU 22 55.602 11.271 2.879 147 H THR 23 HN THR 23 56.883 13.078 0.872 148 HA THR 23 HA THR 23 59.015 13.878 -0.929 149 HB THR 23 HB THR 23 55.984 13.524 -1.265 150 HG1 THR 23 HG1 THR 23 56.816 11.625 -0.658 151 1HG2 THR 23 HG21 THR 23 57.240 14.634 -3.195 152 2HG2 THR 23 HG22 THR 23 56.572 13.037 -3.553 153 3HG2 THR 23 HG23 THR 23 58.296 13.215 -3.201 154 H ARG 24 HN ARG 24 58.969 15.654 1.062 155 HA ARG 24 HA ARG 24 57.302 17.966 0.612 156 1HB ARG 24 HB2 ARG 24 59.951 17.664 2.041 157 2HB ARG 24 HB1 ARG 24 58.962 19.112 2.112 158 1HG ARG 24 HG2 ARG 24 57.067 17.723 3.034 159 2HG ARG 24 HG1 ARG 24 58.112 16.322 2.936 160 1HD ARG 24 HD2 ARG 24 58.697 18.757 4.642 161 2HD ARG 24 HD1 ARG 24 57.963 17.284 5.266 162 HE ARG 24 HE ARG 24 60.146 16.228 4.173 163 1HH1 ARG 24 HH11 ARG 24 59.828 19.170 6.003 164 2HH1 ARG 24 HH12 ARG 24 61.444 19.085 6.613 165 1HH2 ARG 24 HH21 ARG 24 62.187 16.116 4.947 166 2HH2 ARG 24 HH22 ARG 24 62.796 17.338 6.015 167 H ASN 25 HN ASN 25 59.976 16.801 -0.929 168 HA ASN 25 HA ASN 25 61.506 18.917 -1.740 169 1HB ASN 25 HB2 ASN 25 60.658 16.493 -3.375 170 2HB ASN 25 HB1 ASN 25 62.045 17.525 -3.705 171 1HD2 ASN 25 HD21 ASN 25 60.682 15.309 -1.264 172 2HD2 ASN 25 HD22 ASN 25 62.172 14.917 -0.552 173 H LYS 26 HN LYS 26 58.238 18.390 -2.861 174 HA LYS 26 HA LYS 26 58.569 20.568 -4.873 175 1HB LYS 26 HB2 LYS 26 56.327 18.463 -4.803 176 2HB LYS 26 HB1 LYS 26 56.556 19.700 -6.008 177 1HG LYS 26 HG2 LYS 26 57.239 17.612 -6.959 178 2HG LYS 26 HG1 LYS 26 58.664 18.606 -6.740 179 1HD LYS 26 HD2 LYS 26 59.302 17.330 -4.741 180 2HD LYS 26 HD1 LYS 26 57.815 16.401 -4.811 181 1HE LYS 26 HE2 LYS 26 58.576 15.501 -7.029 182 2HE LYS 26 HE1 LYS 26 60.047 16.458 -6.896 183 1HZ LYS 26 HZ1 LYS 26 59.231 14.512 -4.831 184 2HZ LYS 26 HZ2 LYS 26 60.750 15.236 -5.053 185 3HZ LYS 26 HZ3 LYS 26 60.187 14.083 -6.167 186 H LEU 27 HN LEU 27 57.185 22.158 -4.735 187 HA LEU 27 HA LEU 27 55.472 22.399 -2.287 188 1HB LEU 27 HB2 LEU 27 56.750 24.601 -3.986 189 2HB LEU 27 HB1 LEU 27 55.796 24.856 -2.539 190 HG LEU 27 HG LEU 27 58.457 23.342 -2.637 191 1HD1 LEU 27 HD11 LEU 27 58.724 25.785 -2.997 192 2HD1 LEU 27 HD12 LEU 27 59.353 25.322 -1.426 193 3HD1 LEU 27 HD13 LEU 27 57.789 26.113 -1.547 194 1HD2 LEU 27 HD21 LEU 27 58.333 23.409 -0.154 195 2HD2 LEU 27 HD22 LEU 27 56.955 22.539 -0.791 196 3HD2 LEU 27 HD23 LEU 27 56.763 24.193 -0.236 197 H VAL 28 HN VAL 28 54.736 21.119 -4.417 198 HA VAL 28 HA VAL 28 52.111 22.241 -5.130 199 HB VAL 28 HB VAL 28 53.821 21.152 -7.326 200 1HG1 VAL 28 HG11 VAL 28 51.466 21.078 -7.790 201 2HG1 VAL 28 HG12 VAL 28 52.196 22.258 -8.857 202 3HG1 VAL 28 HG13 VAL 28 51.289 22.791 -7.452 203 1HG2 VAL 28 HG21 VAL 28 53.500 24.161 -6.786 204 2HG2 VAL 28 HG22 VAL 28 54.234 23.494 -8.235 205 3HG2 VAL 28 HG23 VAL 28 55.009 23.266 -6.680 206 H LEU 29 HN LEU 29 50.800 20.531 -5.942 207 HA LEU 29 HA LEU 29 51.105 18.146 -4.669 208 1HB LEU 29 HB2 LEU 29 49.044 18.979 -5.749 209 2HB LEU 29 HB1 LEU 29 49.755 18.807 -7.318 210 HG LEU 29 HG LEU 29 48.022 17.056 -6.847 211 1HD1 LEU 29 HD11 LEU 29 49.805 16.344 -8.389 212 2HD1 LEU 29 HD12 LEU 29 49.233 15.003 -7.419 213 3HD1 LEU 29 HD13 LEU 29 50.767 15.743 -7.055 214 1HD2 LEU 29 HD21 LEU 29 49.869 16.192 -4.589 215 2HD2 LEU 29 HD22 LEU 29 48.434 15.329 -5.116 216 3HD2 LEU 29 HD23 LEU 29 48.292 16.921 -4.406 217 H CYS 30 HN CYS 30 52.000 18.893 -7.830 218 HA CYS 30 HA CYS 30 54.346 17.147 -7.821 219 1HB CYS 30 HB2 CYS 30 52.540 15.544 -8.391 220 2HB CYS 30 HB1 CYS 30 52.017 16.569 -9.688 221 H ASP 31 HN ASP 31 55.453 17.299 -10.006 222 HA ASP 31 HA ASP 31 54.878 19.896 -11.354 223 1HB ASP 31 HB2 ASP 31 56.605 20.262 -9.633 224 2HB ASP 31 HB1 ASP 31 57.587 18.983 -10.319 225 H LYS 32 HN LYS 32 55.788 16.641 -11.624 226 HA LYS 32 HA LYS 32 57.282 16.545 -14.011 227 1HB LYS 32 HB2 LYS 32 55.279 14.530 -12.930 228 2HB LYS 32 HB1 LYS 32 56.492 14.187 -14.149 229 1HG LYS 32 HG2 LYS 32 58.290 14.789 -12.536 230 2HG LYS 32 HG1 LYS 32 57.084 15.137 -11.308 231 1HD LYS 32 HD2 LYS 32 56.270 12.778 -11.443 232 2HD LYS 32 HD1 LYS 32 57.501 12.429 -12.643 233 1HE LYS 32 HE2 LYS 32 58.050 13.363 -9.791 234 2HE LYS 32 HE1 LYS 32 58.245 11.719 -10.381 235 1HZ LYS 32 HZ1 LYS 32 59.805 12.713 -12.074 236 2HZ LYS 32 HZ2 LYS 32 60.348 12.660 -10.465 237 3HZ LYS 32 HZ3 LYS 32 59.785 14.121 -11.126 238 H LYS 33 HN LYS 33 53.902 17.134 -13.645 239 HA LYS 33 HA LYS 33 53.576 17.639 -16.516 240 1HB LYS 33 HB2 LYS 33 53.208 15.186 -16.365 241 2HB LYS 33 HB1 LYS 33 52.006 15.425 -15.116 242 1HG LYS 33 HG2 LYS 33 50.535 16.604 -16.592 243 2HG LYS 33 HG1 LYS 33 51.704 16.564 -17.898 244 1HD LYS 33 HD2 LYS 33 50.329 14.161 -16.578 245 2HD LYS 33 HD1 LYS 33 49.903 14.823 -18.142 246 1HE LYS 33 HE2 LYS 33 52.178 14.226 -19.004 247 2HE LYS 33 HE1 LYS 33 52.578 13.522 -17.443 248 1HZ LYS 33 HZ1 LYS 33 50.545 12.618 -19.366 249 2HZ LYS 33 HZ2 LYS 33 50.553 12.106 -17.747 250 3HZ LYS 33 HZ3 LYS 33 51.880 11.767 -18.750 251 H CYS 34 HN CYS 34 51.419 18.480 -17.020 252 HA CYS 34 HA CYS 34 50.448 19.996 -14.692 253 1HB CYS 34 HB2 CYS 34 50.364 20.641 -17.604 254 2HB CYS 34 HB1 CYS 34 49.513 21.600 -16.424 255 H ASN 35 HN ASN 35 49.136 18.405 -14.097 256 HA ASN 35 HA ASN 35 46.641 17.872 -15.679 257 1HB ASN 35 HB2 ASN 35 47.221 16.784 -12.865 258 2HB ASN 35 HB1 ASN 35 46.000 16.270 -13.994 259 1HD2 ASN 35 HD21 ASN 35 47.928 14.513 -12.842 260 2HD2 ASN 35 HD22 ASN 35 48.877 13.882 -14.098 261 H GLN 36 HN GLN 36 44.866 19.005 -15.310 262 HA GLN 36 HA GLN 36 44.755 20.989 -13.059 263 1HB GLN 36 HB2 GLN 36 42.975 20.666 -15.550 264 2HB GLN 36 HB1 GLN 36 42.991 22.036 -14.456 265 1HG GLN 36 HG2 GLN 36 45.366 22.522 -15.123 266 2HG GLN 36 HG1 GLN 36 45.308 21.176 -16.240 267 1HE2 GLN 36 HE21 GLN 36 44.775 21.760 -18.320 268 2HE2 GLN 36 HE22 GLN 36 43.874 23.131 -18.755 269 H ARG 37 HN ARG 37 44.466 19.490 -11.573 270 HA ARG 37 HA ARG 37 41.677 18.581 -11.138 271 1HB ARG 37 HB2 ARG 37 42.561 16.352 -10.326 272 2HB ARG 37 HB1 ARG 37 42.912 16.605 -12.007 273 1HG ARG 37 HG2 ARG 37 45.227 17.392 -11.417 274 2HG ARG 37 HG1 ARG 37 44.875 17.170 -9.719 275 1HD ARG 37 HD2 ARG 37 46.159 15.278 -10.565 276 2HD ARG 37 HD1 ARG 37 44.542 14.722 -10.127 277 HE ARG 37 HE ARG 37 44.264 15.330 -12.788 278 1HH1 ARG 37 HH11 ARG 37 46.546 13.434 -10.982 279 2HH1 ARG 37 HH12 ARG 37 46.850 12.353 -12.298 280 1HH2 ARG 37 HH21 ARG 37 44.641 13.968 -14.457 281 2HH2 ARG 37 HH22 ARG 37 45.758 12.655 -14.290 282 H CYS 38 HN CYS 38 42.393 17.295 -8.702 283 HA CYS 38 HA CYS 38 42.958 19.723 -7.073 284 1HB CYS 38 HB2 CYS 38 40.997 18.404 -6.388 285 2HB CYS 38 HB1 CYS 38 42.004 16.984 -6.144 286 H GLY 39 HN GLY 39 44.344 19.560 -5.255 287 1HA GLY 39 HA2 GLY 39 46.221 17.488 -4.760 288 2HA GLY 39 HA1 GLY 39 46.957 18.689 -5.837 289 H CYS 40 HN CYS 40 48.157 18.478 -3.444 290 HA CYS 40 HA CYS 40 47.058 20.000 -1.322 291 1HB CYS 40 HB2 CYS 40 49.911 19.511 -2.103 292 2HB CYS 40 HB1 CYS 40 49.454 20.254 -0.605 293 H ILE 41 HN ILE 41 47.706 21.971 -0.531 294 HA ILE 41 HA ILE 41 47.592 24.094 -2.531 295 HB ILE 41 HB ILE 41 48.091 24.364 0.462 296 1HG1 ILE 41 HG12 ILE 41 45.479 24.146 -1.140 297 2HG1 ILE 41 HG11 ILE 41 46.051 22.904 -0.057 298 1HG2 ILE 41 HG21 ILE 41 48.380 26.463 -0.844 299 2HG2 ILE 41 HG22 ILE 41 46.962 26.571 0.164 300 3HG2 ILE 41 HG23 ILE 41 46.789 26.246 -1.554 301 1HD1 ILE 41 HD11 ILE 41 44.276 24.162 1.023 302 2HD1 ILE 41 HD12 ILE 41 45.156 25.665 0.828 303 3HD1 ILE 41 HD13 ILE 41 45.789 24.406 1.881 304 H SER 42 HN SER 42 49.134 25.862 -2.479 305 HA SER 42 HA SER 42 51.860 24.865 -2.797 306 1HB SER 42 HB2 SER 42 50.918 26.567 -4.399 307 2HB SER 42 HB1 SER 42 50.771 27.732 -3.073 308 HG SER 42 HG SER 42 52.989 27.566 -2.743 309 H GLY 43 HN GLY 43 52.780 24.390 -1.022 310 1HA GLY 43 HA2 GLY 43 54.354 25.587 0.628 311 2HA GLY 43 HA1 GLY 43 52.873 26.302 1.280 312 H THR 44 HN THR 44 51.390 23.806 0.635 313 HA THR 44 HA THR 44 52.057 22.363 3.127 314 HB THR 44 HB THR 44 49.831 21.231 2.799 315 HG1 THR 44 HG1 THR 44 50.302 21.898 0.296 316 1HG2 THR 44 HG21 THR 44 49.637 24.214 2.214 317 2HG2 THR 44 HG22 THR 44 49.813 23.510 3.819 318 3HG2 THR 44 HG23 THR 44 48.366 23.192 2.873 319 H VAL 45 HN VAL 45 51.264 19.944 2.716 320 HA VAL 45 HA VAL 45 52.288 18.556 0.407 321 HB VAL 45 HB VAL 45 53.930 17.138 1.667 322 1HG1 VAL 45 HG11 VAL 45 54.732 20.039 1.695 323 2HG1 VAL 45 HG12 VAL 45 54.870 18.901 0.351 324 3HG1 VAL 45 HG13 VAL 45 55.810 18.670 1.806 325 1HG2 VAL 45 HG21 VAL 45 54.924 17.875 3.810 326 2HG2 VAL 45 HG22 VAL 45 53.223 17.548 4.043 327 3HG2 VAL 45 HG23 VAL 45 53.806 19.201 3.897 328 H LEU 46 HN LEU 46 51.131 16.719 0.262 329 HA LEU 46 HA LEU 46 48.943 16.217 1.999 330 1HB LEU 46 HB2 LEU 46 49.149 15.423 -0.401 331 2HB LEU 46 HB1 LEU 46 50.344 14.269 0.100 332 HG LEU 46 HG LEU 46 48.626 13.185 1.592 333 1HD1 LEU 46 HD11 LEU 46 46.744 15.142 0.196 334 2HD1 LEU 46 HD12 LEU 46 47.145 15.185 1.904 335 3HD1 LEU 46 HD13 LEU 46 46.235 13.844 1.253 336 1HD2 LEU 46 HD21 LEU 46 49.051 12.333 -0.703 337 2HD2 LEU 46 HD22 LEU 46 47.858 13.446 -1.351 338 3HD2 LEU 46 HD23 LEU 46 47.357 12.146 -0.283 339 H LYS 47 HN LYS 47 49.371 15.957 4.039 340 HA LYS 47 HA LYS 47 51.180 15.322 5.725 341 1HB LYS 47 HB2 LYS 47 48.846 15.500 6.324 342 2HB LYS 47 HB1 LYS 47 48.516 13.933 5.602 343 1HG LYS 47 HG2 LYS 47 49.723 12.768 7.304 344 2HG LYS 47 HG1 LYS 47 50.439 14.241 7.918 345 1HD LYS 47 HD2 LYS 47 48.626 13.387 9.396 346 2HD LYS 47 HD1 LYS 47 48.263 14.981 8.788 347 1HE LYS 47 HE2 LYS 47 47.116 12.429 7.591 348 2HE LYS 47 HE1 LYS 47 46.287 13.413 8.783 349 1HZ LYS 47 HZ1 LYS 47 45.444 14.328 6.937 350 2HZ LYS 47 HZ2 LYS 47 46.781 13.955 5.966 351 3HZ LYS 47 HZ3 LYS 47 46.848 15.276 7.024 352 H SER 48 HN SER 48 49.887 12.526 3.929 353 HA SER 48 HA SER 48 52.440 11.080 4.514 354 1HB SER 48 HB2 SER 48 49.612 9.864 4.715 355 2HB SER 48 HB1 SER 48 51.128 8.985 4.961 356 HG SER 48 HG SER 48 50.217 11.242 6.405 357 H LYS 49 HN LYS 49 52.506 9.064 3.216 358 HA LYS 49 HA LYS 49 53.013 9.516 0.592 359 1HB LYS 49 HB2 LYS 49 53.526 7.410 1.791 360 2HB LYS 49 HB1 LYS 49 51.834 6.975 1.773 361 1HG LYS 49 HG2 LYS 49 53.041 5.756 0.022 362 2HG LYS 49 HG1 LYS 49 51.874 6.830 -0.713 363 1HD LYS 49 HD2 LYS 49 53.720 8.500 -1.142 364 2HD LYS 49 HD1 LYS 49 54.866 7.384 -0.417 365 1HE LYS 49 HE2 LYS 49 53.173 6.805 -2.885 366 2HE LYS 49 HE1 LYS 49 54.883 7.213 -2.892 367 1HZ LYS 49 HZ1 LYS 49 55.144 5.229 -1.359 368 2HZ LYS 49 HZ2 LYS 49 54.828 4.921 -2.999 369 3HZ LYS 49 HZ3 LYS 49 53.582 4.784 -1.853 370 H ASP 50 HN ASP 50 49.884 9.026 1.941 371 HA ASP 50 HA ASP 50 48.555 10.093 -0.396 372 1HB ASP 50 HB2 ASP 50 48.992 7.736 -1.196 373 2HB ASP 50 HB1 ASP 50 48.153 7.110 0.208 374 H SER 51 HN SER 51 48.356 11.221 1.878 375 HA SER 51 HA SER 51 46.199 10.169 3.583 376 1HB SER 51 HB2 SER 51 48.203 11.481 4.478 377 2HB SER 51 HB1 SER 51 47.581 12.909 3.641 378 HG SER 51 HG SER 51 46.560 11.509 5.812 379 H SER 52 HN SER 52 44.952 12.780 4.010 380 HA SER 52 HA SER 52 43.530 13.255 1.425 381 1HB SER 52 HB2 SER 52 42.119 11.801 2.913 382 2HB SER 52 HB1 SER 52 42.230 13.028 4.185 383 HG SER 52 HG SER 52 41.267 14.501 2.808 384 H GLU 53 HN GLU 53 44.989 14.477 4.259 385 HA GLU 53 HA GLU 53 44.247 17.286 3.507 386 1HB GLU 53 HB2 GLU 53 44.836 16.180 6.289 387 2HB GLU 53 HB1 GLU 53 44.490 17.860 5.912 388 1HG GLU 53 HG2 GLU 53 42.266 17.175 4.994 389 2HG GLU 53 HG1 GLU 53 42.598 15.511 5.442 390 H CYS 54 HN CYS 54 45.855 18.723 3.402 391 HA CYS 54 HA CYS 54 48.631 17.650 3.537 392 1HB CYS 54 HB2 CYS 54 47.665 20.103 2.079 393 2HB CYS 54 HB1 CYS 54 49.192 19.297 1.906 394 H VAL 55 HN VAL 55 50.106 18.574 4.681 395 HA VAL 55 HA VAL 55 49.546 21.004 6.325 396 HB VAL 55 HB VAL 55 51.092 19.903 8.024 397 1HG1 VAL 55 HG11 VAL 55 49.348 18.253 8.835 398 2HG1 VAL 55 HG12 VAL 55 48.600 18.255 7.247 399 3HG1 VAL 55 HG13 VAL 55 48.557 19.701 8.240 400 1HG2 VAL 55 HG21 VAL 55 50.769 17.465 6.238 401 2HG2 VAL 55 HG22 VAL 55 51.519 17.475 7.824 402 3HG2 VAL 55 HG23 VAL 55 52.250 18.365 6.501 403 H HIS 56 HN HIS 56 51.610 22.130 6.965 404 HA HIS 56 HA HIS 56 53.381 22.285 4.607 405 1HB HIS 56 HB2 HIS 56 53.401 23.833 7.222 406 2HB HIS 56 HB1 HIS 56 54.374 24.246 5.831 407 HD1 HIS 56 HD1 HIS 56 53.135 25.431 3.936 408 HD2 HIS 56 HD2 HIS 56 50.572 24.300 6.906 409 HE1 HIS 56 HE1 HIS 56 50.983 26.534 3.452 410 HA PRO 57 HA PRO 57 56.839 19.920 6.176 411 1HB PRO 57 HB2 PRO 57 58.872 21.849 5.974 412 2HB PRO 57 HB1 PRO 57 58.363 20.791 4.690 413 1HG PRO 57 HG2 PRO 57 57.519 23.602 5.228 414 2HG PRO 57 HG1 PRO 57 57.919 22.822 3.685 415 1HD PRO 57 HD2 PRO 57 55.410 23.236 4.332 416 2HD PRO 57 HD1 PRO 57 55.873 21.697 3.584 417 H SER 58 HN SER 58 56.197 23.116 7.406 418 HA SER 58 HA SER 58 57.781 22.979 9.791 419 1HB SER 58 HB2 SER 58 56.329 24.963 10.480 420 2HB SER 58 HB1 SER 58 57.031 25.140 8.869 421 HG SER 58 HG SER 58 54.867 23.789 8.477 422 H LYS 59 HN LYS 59 54.686 21.648 9.068 423 HA LYS 59 HA LYS 59 54.127 21.145 11.953 424 1HB LYS 59 HB2 LYS 59 52.502 20.465 9.471 425 2HB LYS 59 HB1 LYS 59 52.006 20.080 11.103 426 1HG LYS 59 HG2 LYS 59 50.836 22.079 10.468 427 2HG LYS 59 HG1 LYS 59 52.073 22.531 11.635 428 1HD LYS 59 HD2 LYS 59 53.496 23.373 9.936 429 2HD LYS 59 HD1 LYS 59 52.422 22.801 8.663 430 1HE LYS 59 HE2 LYS 59 50.653 24.365 9.566 431 2HE LYS 59 HE1 LYS 59 51.772 24.893 10.814 432 1HZ LYS 59 HZ1 LYS 59 52.486 26.402 9.415 433 2HZ LYS 59 HZ2 LYS 59 51.530 25.781 8.158 434 3HZ LYS 59 HZ3 LYS 59 53.097 25.182 8.409 435 H CYS 60 HN CYS 60 54.815 19.593 8.902 436 HA CYS 60 HA CYS 60 54.649 16.903 9.670 437 1HB CYS 60 HB2 CYS 60 56.433 18.304 7.711 438 2HB CYS 60 HB1 CYS 60 56.457 16.571 7.849
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